USER MOD reduce.3.24.130724 H: found=0, std=0, add=1041, rem=0, adj=29 USER MOD reduce.3.24.130724 removed 1037 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 116 TYR OH : rot 180:sc= 0.0626 USER MOD Set 1.2: A 117 GLN : amide:sc= 0.63 K(o=0.69,f=-1.1) USER MOD Set 2.1: A 46 THR OG1 : rot 180:sc= 0 USER MOD Set 2.2: A 47 HIS : no HE2:sc= -2.33! C(o=-2.3!,f=-5.6!) USER MOD Set 3.1: A 8 CYS SG : rot 142:sc= 0.452! USER MOD Set 3.2: A 34 CYS SG : rot 101:sc= -2.36! USER MOD Single : A 1 MET CE :methyl -158:sc= -0.127 (180deg=-1.12) USER MOD Single : A 1 MET N :NH3+ -164:sc= 0 (180deg=-0.286) USER MOD Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 4 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 13 SER OG : rot 180:sc= 0 USER MOD Single : A 14 THR OG1 : rot 100:sc= 0.126 USER MOD Single : A 18 GLN :FLIP amide:sc= -0.45 F(o=-2.7!,f=-0.45) USER MOD Single : A 20 CYS SG : rot 80:sc= -1.06 USER MOD Single : A 21 GLN : amide:sc= -3.18 K(o=-3.2,f=-4) USER MOD Single : A 25 SER OG : rot 47:sc= -1.29! USER MOD Single : A 29 TYR OH : rot 60:sc= -1.39 USER MOD Single : A 30 GLN : amide:sc= 0 K(o=0,f=-0.55) USER MOD Single : A 32 GLN : amide:sc= -0.305 X(o=-0.31,f=-0.3) USER MOD Single : A 36 SER OG : rot 180:sc=-0.000852 USER MOD Single : A 39 MET CE :methyl -151:sc= -0.549 (180deg=-2.21!) USER MOD Single : A 43 TYR OH : rot 150:sc= 0 USER MOD Single : A 45 GLN : amide:sc= -2.86 K(o=-2.9,f=-5.1!) USER MOD Single : A 50 GLN : amide:sc= -0.0477 K(o=-0.048,f=-1.2!) USER MOD Single : A 53 CYS SG : rot -4:sc= -0.942! USER MOD Single : A 60 ASN : amide:sc=-0.00712 X(o=-0.0071,f=-0.13) USER MOD Single : A 62 SER OG : rot 180:sc= 0.0578 USER MOD Single : A 68 GLN :FLIP amide:sc= -1.26 F(o=-2.6!,f=-1.3) USER MOD Single : A 69 GLN : amide:sc= -0.118 K(o=-0.12,f=-0.93) USER MOD Single : A 71 CYS SG : rot 46:sc= -5.38! USER MOD Single : A 87 SER OG : rot 2:sc= 0.79 USER MOD Single : A 95 LYS NZ :NH3+ -165:sc= 0 (180deg=-0.209) USER MOD Single : A 97 GLN : amide:sc= -0.397 K(o=-0.4,f=-1.5!) USER MOD Single : A 99 TYR OH : rot -5:sc= 0.955 USER MOD Single : A 100 HIS : +bothHN:sc= -19.9! C(o=-20!,f=-24!) USER MOD Single : A 101 SER OG : rot 180:sc= 0 USER MOD Single : A 105 HIS :FLIP no HD1:sc= -0.133 F(o=-2.2,f=-0.13) USER MOD Single : A 109 HIS : no HD1:sc= -0.458 X(o=-0.46,f=-0.91) USER MOD Single : A 110 GLN : amide:sc= -1.86 X(o=-1.9,f=-1.7) USER MOD Single : A 113 GLN : amide:sc= 0 K(o=0,f=-1.2!) USER MOD Single : A 133 THR OG1 : rot 180:sc= 0.14 USER MOD Single : A 134 MET CE :methyl -122:sc= -0.223 (180deg=-0.923) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 -1.610 7.010 16.270 1.00 0.00 N ATOM 2 CA MET A 1 -1.283 7.119 14.818 1.00 0.00 C ATOM 3 C MET A 1 0.170 7.568 14.620 1.00 0.00 C ATOM 4 O MET A 1 1.040 6.772 14.329 1.00 0.00 O ATOM 5 CB MET A 1 -2.250 8.168 14.274 1.00 0.00 C ATOM 6 CG MET A 1 -3.666 7.596 14.276 1.00 0.00 C ATOM 7 SD MET A 1 -4.726 8.607 13.213 1.00 0.00 S ATOM 8 CE MET A 1 -4.460 10.190 14.049 1.00 0.00 C ATOM 0 H1 MET A 1 -2.483 6.457 16.389 1.00 0.00 H new ATOM 0 H2 MET A 1 -0.829 6.535 16.767 1.00 0.00 H new ATOM 0 H3 MET A 1 -1.746 7.961 16.668 1.00 0.00 H new ATOM 0 HA MET A 1 -1.383 6.163 14.304 1.00 0.00 H new ATOM 0 HB2 MET A 1 -2.208 9.070 14.885 1.00 0.00 H new ATOM 0 HB3 MET A 1 -1.962 8.455 13.263 1.00 0.00 H new ATOM 0 HG2 MET A 1 -3.654 6.565 13.921 1.00 0.00 H new ATOM 0 HG3 MET A 1 -4.061 7.579 15.292 1.00 0.00 H new ATOM 0 HE1 MET A 1 -5.288 10.863 13.825 1.00 0.00 H new ATOM 0 HE2 MET A 1 -4.405 10.028 15.126 1.00 0.00 H new ATOM 0 HE3 MET A 1 -3.527 10.633 13.700 1.00 0.00 H new ATOM 20 N LEU A 2 0.440 8.840 14.767 1.00 0.00 N ATOM 21 CA LEU A 2 1.836 9.337 14.577 1.00 0.00 C ATOM 22 C LEU A 2 2.829 8.478 15.368 1.00 0.00 C ATOM 23 O LEU A 2 4.004 8.426 15.054 1.00 0.00 O ATOM 24 CB LEU A 2 1.825 10.767 15.117 1.00 0.00 C ATOM 25 CG LEU A 2 3.209 11.389 14.950 1.00 0.00 C ATOM 26 CD1 LEU A 2 3.459 11.704 13.473 1.00 0.00 C ATOM 27 CD2 LEU A 2 3.283 12.681 15.765 1.00 0.00 C ATOM 0 H LEU A 2 -0.245 9.555 15.010 1.00 0.00 H new ATOM 0 HA LEU A 2 2.144 9.293 13.532 1.00 0.00 H new ATOM 0 HB2 LEU A 2 1.082 11.361 14.585 1.00 0.00 H new ATOM 0 HB3 LEU A 2 1.540 10.767 16.169 1.00 0.00 H new ATOM 0 HG LEU A 2 3.966 10.688 15.302 1.00 0.00 H new ATOM 0 HD11 LEU A 2 4.448 12.148 13.358 1.00 0.00 H new ATOM 0 HD12 LEU A 2 3.404 10.784 12.890 1.00 0.00 H new ATOM 0 HD13 LEU A 2 2.703 12.404 13.117 1.00 0.00 H new ATOM 0 HD21 LEU A 2 4.270 13.129 15.649 1.00 0.00 H new ATOM 0 HD22 LEU A 2 2.524 13.379 15.411 1.00 0.00 H new ATOM 0 HD23 LEU A 2 3.108 12.458 16.817 1.00 0.00 H new ATOM 39 N SER A 3 2.374 7.801 16.386 1.00 0.00 N ATOM 40 CA SER A 3 3.305 6.950 17.181 1.00 0.00 C ATOM 41 C SER A 3 4.115 6.065 16.237 1.00 0.00 C ATOM 42 O SER A 3 5.328 6.048 16.272 1.00 0.00 O ATOM 43 CB SER A 3 2.401 6.104 18.076 1.00 0.00 C ATOM 44 OG SER A 3 1.704 6.956 18.977 1.00 0.00 O ATOM 0 H SER A 3 1.404 7.799 16.701 1.00 0.00 H new ATOM 0 HA SER A 3 4.015 7.533 17.767 1.00 0.00 H new ATOM 0 HB2 SER A 3 1.693 5.540 17.469 1.00 0.00 H new ATOM 0 HB3 SER A 3 2.995 5.377 18.630 1.00 0.00 H new ATOM 0 HG SER A 3 1.121 6.417 19.552 1.00 0.00 H new ATOM 50 N GLN A 4 3.450 5.344 15.384 1.00 0.00 N ATOM 51 CA GLN A 4 4.175 4.471 14.420 1.00 0.00 C ATOM 52 C GLN A 4 3.336 4.250 13.161 1.00 0.00 C ATOM 53 O GLN A 4 2.144 4.487 13.146 1.00 0.00 O ATOM 54 CB GLN A 4 4.401 3.159 15.155 1.00 0.00 C ATOM 55 CG GLN A 4 5.424 3.385 16.265 1.00 0.00 C ATOM 56 CD GLN A 4 6.117 2.062 16.595 1.00 0.00 C ATOM 57 OE1 GLN A 4 5.480 1.112 17.002 1.00 0.00 O ATOM 58 NE2 GLN A 4 7.408 1.963 16.429 1.00 0.00 N ATOM 0 H GLN A 4 2.433 5.320 15.311 1.00 0.00 H new ATOM 0 HA GLN A 4 5.115 4.917 14.094 1.00 0.00 H new ATOM 0 HB2 GLN A 4 3.463 2.796 15.575 1.00 0.00 H new ATOM 0 HB3 GLN A 4 4.758 2.396 14.463 1.00 0.00 H new ATOM 0 HG2 GLN A 4 6.160 4.125 15.951 1.00 0.00 H new ATOM 0 HG3 GLN A 4 4.932 3.782 17.153 1.00 0.00 H new ATOM 0 HE21 GLN A 4 7.941 2.763 16.087 1.00 0.00 H new ATOM 0 HE22 GLN A 4 7.884 1.086 16.641 1.00 0.00 H new ATOM 67 N ILE A 5 3.951 3.807 12.101 1.00 0.00 N ATOM 68 CA ILE A 5 3.195 3.582 10.838 1.00 0.00 C ATOM 69 C ILE A 5 3.237 2.104 10.427 1.00 0.00 C ATOM 70 O ILE A 5 4.278 1.479 10.435 1.00 0.00 O ATOM 71 CB ILE A 5 3.920 4.438 9.808 1.00 0.00 C ATOM 72 CG1 ILE A 5 4.059 5.865 10.347 1.00 0.00 C ATOM 73 CG2 ILE A 5 3.119 4.453 8.508 1.00 0.00 C ATOM 74 CD1 ILE A 5 5.037 6.650 9.473 1.00 0.00 C ATOM 0 H ILE A 5 4.947 3.591 12.055 1.00 0.00 H new ATOM 0 HA ILE A 5 2.141 3.842 10.938 1.00 0.00 H new ATOM 0 HB ILE A 5 4.910 4.025 9.615 1.00 0.00 H new ATOM 0 HG12 ILE A 5 3.087 6.358 10.355 1.00 0.00 H new ATOM 0 HG13 ILE A 5 4.414 5.842 11.377 1.00 0.00 H new ATOM 0 HG21 ILE A 5 3.636 5.065 7.769 1.00 0.00 H new ATOM 0 HG22 ILE A 5 3.019 3.435 8.130 1.00 0.00 H new ATOM 0 HG23 ILE A 5 2.129 4.869 8.695 1.00 0.00 H new ATOM 0 HD11 ILE A 5 5.135 7.665 9.858 1.00 0.00 H new ATOM 0 HD12 ILE A 5 6.011 6.161 9.487 1.00 0.00 H new ATOM 0 HD13 ILE A 5 4.663 6.684 8.450 1.00 0.00 H new ATOM 86 N ALA A 6 2.115 1.545 10.053 1.00 0.00 N ATOM 87 CA ALA A 6 2.102 0.119 9.631 1.00 0.00 C ATOM 88 C ALA A 6 2.246 0.032 8.117 1.00 0.00 C ATOM 89 O ALA A 6 1.395 0.477 7.373 1.00 0.00 O ATOM 90 CB ALA A 6 0.747 -0.419 10.074 1.00 0.00 C ATOM 0 H ALA A 6 1.211 2.016 10.023 1.00 0.00 H new ATOM 0 HA ALA A 6 2.921 -0.453 10.068 1.00 0.00 H new ATOM 0 HB1 ALA A 6 0.664 -1.470 9.796 1.00 0.00 H new ATOM 0 HB2 ALA A 6 0.653 -0.321 11.156 1.00 0.00 H new ATOM 0 HB3 ALA A 6 -0.046 0.149 9.588 1.00 0.00 H new ATOM 96 N ILE A 7 3.316 -0.538 7.659 1.00 0.00 N ATOM 97 CA ILE A 7 3.515 -0.654 6.191 1.00 0.00 C ATOM 98 C ILE A 7 3.800 -2.102 5.811 1.00 0.00 C ATOM 99 O ILE A 7 4.700 -2.727 6.337 1.00 0.00 O ATOM 100 CB ILE A 7 4.717 0.235 5.876 1.00 0.00 C ATOM 101 CG1 ILE A 7 4.378 1.684 6.224 1.00 0.00 C ATOM 102 CG2 ILE A 7 5.055 0.132 4.386 1.00 0.00 C ATOM 103 CD1 ILE A 7 5.601 2.573 5.989 1.00 0.00 C ATOM 0 H ILE A 7 4.062 -0.929 8.234 1.00 0.00 H new ATOM 0 HA ILE A 7 2.631 -0.349 5.631 1.00 0.00 H new ATOM 0 HB ILE A 7 5.575 -0.091 6.463 1.00 0.00 H new ATOM 0 HG12 ILE A 7 3.544 2.029 5.613 1.00 0.00 H new ATOM 0 HG13 ILE A 7 4.061 1.753 7.265 1.00 0.00 H new ATOM 0 HG21 ILE A 7 5.913 0.767 4.163 1.00 0.00 H new ATOM 0 HG22 ILE A 7 5.294 -0.902 4.138 1.00 0.00 H new ATOM 0 HG23 ILE A 7 4.199 0.458 3.795 1.00 0.00 H new ATOM 0 HD11 ILE A 7 5.354 3.605 6.239 1.00 0.00 H new ATOM 0 HD12 ILE A 7 6.424 2.234 6.619 1.00 0.00 H new ATOM 0 HD13 ILE A 7 5.898 2.514 4.942 1.00 0.00 H new ATOM 115 N CYS A 8 3.044 -2.637 4.897 1.00 0.00 N ATOM 116 CA CYS A 8 3.273 -4.047 4.469 1.00 0.00 C ATOM 117 C CYS A 8 3.668 -4.064 2.991 1.00 0.00 C ATOM 118 O CYS A 8 2.905 -3.674 2.130 1.00 0.00 O ATOM 119 CB CYS A 8 1.930 -4.744 4.686 1.00 0.00 C ATOM 120 SG CYS A 8 2.172 -6.539 4.724 1.00 0.00 S ATOM 0 H CYS A 8 2.275 -2.160 4.426 1.00 0.00 H new ATOM 0 HA CYS A 8 4.071 -4.541 5.023 1.00 0.00 H new ATOM 0 HB2 CYS A 8 1.482 -4.408 5.621 1.00 0.00 H new ATOM 0 HB3 CYS A 8 1.238 -4.478 3.887 1.00 0.00 H new ATOM 0 HG CYS A 8 1.382 -7.065 5.613 1.00 0.00 H new ATOM 126 N ILE A 9 4.862 -4.491 2.689 1.00 0.00 N ATOM 127 CA ILE A 9 5.305 -4.499 1.266 1.00 0.00 C ATOM 128 C ILE A 9 5.246 -5.890 0.656 1.00 0.00 C ATOM 129 O ILE A 9 5.439 -6.890 1.318 1.00 0.00 O ATOM 130 CB ILE A 9 6.755 -4.044 1.299 1.00 0.00 C ATOM 131 CG1 ILE A 9 7.349 -4.140 -0.108 1.00 0.00 C ATOM 132 CG2 ILE A 9 7.541 -4.955 2.233 1.00 0.00 C ATOM 133 CD1 ILE A 9 8.727 -3.480 -0.133 1.00 0.00 C ATOM 0 H ILE A 9 5.548 -4.833 3.362 1.00 0.00 H new ATOM 0 HA ILE A 9 4.659 -3.860 0.664 1.00 0.00 H new ATOM 0 HB ILE A 9 6.808 -3.014 1.651 1.00 0.00 H new ATOM 0 HG12 ILE A 9 7.430 -5.185 -0.408 1.00 0.00 H new ATOM 0 HG13 ILE A 9 6.689 -3.653 -0.826 1.00 0.00 H new ATOM 0 HG21 ILE A 9 8.583 -4.635 2.262 1.00 0.00 H new ATOM 0 HG22 ILE A 9 7.117 -4.901 3.236 1.00 0.00 H new ATOM 0 HG23 ILE A 9 7.487 -5.982 1.871 1.00 0.00 H new ATOM 0 HD11 ILE A 9 9.146 -3.551 -1.137 1.00 0.00 H new ATOM 0 HD12 ILE A 9 8.633 -2.431 0.148 1.00 0.00 H new ATOM 0 HD13 ILE A 9 9.386 -3.987 0.572 1.00 0.00 H new ATOM 145 N TRP A 10 5.030 -5.949 -0.623 1.00 0.00 N ATOM 146 CA TRP A 10 5.012 -7.270 -1.304 1.00 0.00 C ATOM 147 C TRP A 10 6.099 -7.301 -2.373 1.00 0.00 C ATOM 148 O TRP A 10 5.912 -6.829 -3.477 1.00 0.00 O ATOM 149 CB TRP A 10 3.640 -7.422 -1.953 1.00 0.00 C ATOM 150 CG TRP A 10 3.689 -8.600 -2.883 1.00 0.00 C ATOM 151 CD1 TRP A 10 4.600 -9.601 -2.811 1.00 0.00 C ATOM 152 CD2 TRP A 10 2.830 -8.919 -4.010 1.00 0.00 C ATOM 153 NE1 TRP A 10 4.358 -10.505 -3.826 1.00 0.00 N ATOM 154 CE2 TRP A 10 3.276 -10.134 -4.589 1.00 0.00 C ATOM 155 CE3 TRP A 10 1.721 -8.281 -4.586 1.00 0.00 C ATOM 156 CZ2 TRP A 10 2.641 -10.695 -5.694 1.00 0.00 C ATOM 157 CZ3 TRP A 10 1.082 -8.844 -5.700 1.00 0.00 C ATOM 158 CH2 TRP A 10 1.542 -10.050 -6.251 1.00 0.00 C ATOM 0 H TRP A 10 4.865 -5.143 -1.227 1.00 0.00 H new ATOM 0 HA TRP A 10 5.196 -8.081 -0.599 1.00 0.00 H new ATOM 0 HB2 TRP A 10 2.874 -7.570 -1.192 1.00 0.00 H new ATOM 0 HB3 TRP A 10 3.376 -6.517 -2.500 1.00 0.00 H new ATOM 0 HD1 TRP A 10 5.389 -9.679 -2.077 1.00 0.00 H new ATOM 0 HE1 TRP A 10 4.913 -11.345 -3.990 1.00 0.00 H new ATOM 0 HE3 TRP A 10 1.358 -7.353 -4.170 1.00 0.00 H new ATOM 0 HZ2 TRP A 10 2.999 -11.623 -6.115 1.00 0.00 H new ATOM 0 HZ3 TRP A 10 0.229 -8.346 -6.137 1.00 0.00 H new ATOM 0 HH2 TRP A 10 1.042 -10.477 -7.108 1.00 0.00 H new ATOM 169 N VAL A 11 7.225 -7.863 -2.064 1.00 0.00 N ATOM 170 CA VAL A 11 8.306 -7.930 -3.073 1.00 0.00 C ATOM 171 C VAL A 11 9.119 -9.210 -2.874 1.00 0.00 C ATOM 172 O VAL A 11 9.686 -9.455 -1.826 1.00 0.00 O ATOM 173 CB VAL A 11 9.142 -6.677 -2.843 1.00 0.00 C ATOM 174 CG1 VAL A 11 9.616 -6.621 -1.399 1.00 0.00 C ATOM 175 CG2 VAL A 11 10.346 -6.702 -3.773 1.00 0.00 C ATOM 0 H VAL A 11 7.444 -8.278 -1.158 1.00 0.00 H new ATOM 0 HA VAL A 11 7.934 -7.963 -4.097 1.00 0.00 H new ATOM 0 HB VAL A 11 8.533 -5.796 -3.049 1.00 0.00 H new ATOM 0 HG11 VAL A 11 10.212 -5.721 -1.246 1.00 0.00 H new ATOM 0 HG12 VAL A 11 8.753 -6.602 -0.733 1.00 0.00 H new ATOM 0 HG13 VAL A 11 10.223 -7.500 -1.181 1.00 0.00 H new ATOM 0 HG21 VAL A 11 10.948 -5.808 -3.613 1.00 0.00 H new ATOM 0 HG22 VAL A 11 10.948 -7.587 -3.565 1.00 0.00 H new ATOM 0 HG23 VAL A 11 10.006 -6.730 -4.808 1.00 0.00 H new ATOM 185 N GLU A 12 9.153 -10.034 -3.879 1.00 0.00 N ATOM 186 CA GLU A 12 9.893 -11.329 -3.785 1.00 0.00 C ATOM 187 C GLU A 12 11.407 -11.103 -3.675 1.00 0.00 C ATOM 188 O GLU A 12 12.137 -11.971 -3.236 1.00 0.00 O ATOM 189 CB GLU A 12 9.539 -12.073 -5.076 1.00 0.00 C ATOM 190 CG GLU A 12 8.126 -12.652 -4.964 1.00 0.00 C ATOM 191 CD GLU A 12 7.707 -13.242 -6.313 1.00 0.00 C ATOM 192 OE1 GLU A 12 8.386 -12.974 -7.291 1.00 0.00 O ATOM 193 OE2 GLU A 12 6.712 -13.952 -6.344 1.00 0.00 O ATOM 0 H GLU A 12 8.695 -9.868 -4.775 1.00 0.00 H new ATOM 0 HA GLU A 12 9.615 -11.893 -2.894 1.00 0.00 H new ATOM 0 HB2 GLU A 12 9.598 -11.394 -5.927 1.00 0.00 H new ATOM 0 HB3 GLU A 12 10.257 -12.873 -5.255 1.00 0.00 H new ATOM 0 HG2 GLU A 12 8.097 -13.423 -4.194 1.00 0.00 H new ATOM 0 HG3 GLU A 12 7.425 -11.873 -4.662 1.00 0.00 H new ATOM 200 N SER A 13 11.890 -9.956 -4.069 1.00 0.00 N ATOM 201 CA SER A 13 13.361 -9.703 -3.978 1.00 0.00 C ATOM 202 C SER A 13 13.714 -9.068 -2.627 1.00 0.00 C ATOM 203 O SER A 13 13.156 -8.059 -2.246 1.00 0.00 O ATOM 204 CB SER A 13 13.671 -8.723 -5.107 1.00 0.00 C ATOM 205 OG SER A 13 15.075 -8.688 -5.319 1.00 0.00 O ATOM 0 H SER A 13 11.337 -9.187 -4.447 1.00 0.00 H new ATOM 0 HA SER A 13 13.934 -10.626 -4.062 1.00 0.00 H new ATOM 0 HB2 SER A 13 13.160 -9.028 -6.020 1.00 0.00 H new ATOM 0 HB3 SER A 13 13.304 -7.729 -4.853 1.00 0.00 H new ATOM 0 HG SER A 13 15.281 -8.062 -6.044 1.00 0.00 H new ATOM 211 N THR A 14 14.642 -9.640 -1.907 1.00 0.00 N ATOM 212 CA THR A 14 15.024 -9.045 -0.594 1.00 0.00 C ATOM 213 C THR A 14 15.631 -7.664 -0.816 1.00 0.00 C ATOM 214 O THR A 14 15.276 -6.705 -0.166 1.00 0.00 O ATOM 215 CB THR A 14 16.073 -9.988 -0.005 1.00 0.00 C ATOM 216 OG1 THR A 14 15.917 -11.281 -0.571 1.00 0.00 O ATOM 217 CG2 THR A 14 15.896 -10.060 1.514 1.00 0.00 C ATOM 0 H THR A 14 15.148 -10.486 -2.168 1.00 0.00 H new ATOM 0 HA THR A 14 14.167 -8.931 0.069 1.00 0.00 H new ATOM 0 HB THR A 14 17.071 -9.615 -0.233 1.00 0.00 H new ATOM 0 HG1 THR A 14 16.579 -11.409 -1.283 1.00 0.00 H new ATOM 0 HG21 THR A 14 16.643 -10.732 1.936 1.00 0.00 H new ATOM 0 HG22 THR A 14 16.020 -9.065 1.942 1.00 0.00 H new ATOM 0 HG23 THR A 14 14.899 -10.434 1.747 1.00 0.00 H new ATOM 225 N ALA A 15 16.548 -7.555 -1.737 1.00 0.00 N ATOM 226 CA ALA A 15 17.180 -6.236 -2.005 1.00 0.00 C ATOM 227 C ALA A 15 16.099 -5.174 -2.203 1.00 0.00 C ATOM 228 O ALA A 15 16.108 -4.140 -1.570 1.00 0.00 O ATOM 229 CB ALA A 15 17.982 -6.441 -3.290 1.00 0.00 C ATOM 0 H ALA A 15 16.886 -8.324 -2.315 1.00 0.00 H new ATOM 0 HA ALA A 15 17.812 -5.897 -1.184 1.00 0.00 H new ATOM 0 HB1 ALA A 15 18.482 -5.511 -3.559 1.00 0.00 H new ATOM 0 HB2 ALA A 15 18.727 -7.221 -3.133 1.00 0.00 H new ATOM 0 HB3 ALA A 15 17.310 -6.738 -4.095 1.00 0.00 H new ATOM 235 N ILE A 16 15.150 -5.433 -3.059 1.00 0.00 N ATOM 236 CA ILE A 16 14.059 -4.443 -3.267 1.00 0.00 C ATOM 237 C ILE A 16 13.291 -4.291 -1.966 1.00 0.00 C ATOM 238 O ILE A 16 12.986 -3.202 -1.525 1.00 0.00 O ATOM 239 CB ILE A 16 13.158 -5.050 -4.333 1.00 0.00 C ATOM 240 CG1 ILE A 16 13.935 -5.216 -5.639 1.00 0.00 C ATOM 241 CG2 ILE A 16 11.961 -4.128 -4.561 1.00 0.00 C ATOM 242 CD1 ILE A 16 13.104 -6.056 -6.611 1.00 0.00 C ATOM 0 H ILE A 16 15.083 -6.282 -3.620 1.00 0.00 H new ATOM 0 HA ILE A 16 14.429 -3.463 -3.568 1.00 0.00 H new ATOM 0 HB ILE A 16 12.811 -6.029 -4.001 1.00 0.00 H new ATOM 0 HG12 ILE A 16 14.151 -4.241 -6.075 1.00 0.00 H new ATOM 0 HG13 ILE A 16 14.893 -5.699 -5.448 1.00 0.00 H new ATOM 0 HG21 ILE A 16 11.311 -4.557 -5.324 1.00 0.00 H new ATOM 0 HG22 ILE A 16 11.404 -4.018 -3.630 1.00 0.00 H new ATOM 0 HG23 ILE A 16 12.312 -3.151 -4.892 1.00 0.00 H new ATOM 0 HD11 ILE A 16 13.651 -6.179 -7.545 1.00 0.00 H new ATOM 0 HD12 ILE A 16 12.910 -7.035 -6.172 1.00 0.00 H new ATOM 0 HD13 ILE A 16 12.157 -5.553 -6.809 1.00 0.00 H new ATOM 254 N LEU A 17 13.001 -5.393 -1.336 1.00 0.00 N ATOM 255 CA LEU A 17 12.283 -5.338 -0.044 1.00 0.00 C ATOM 256 C LEU A 17 13.119 -4.502 0.917 1.00 0.00 C ATOM 257 O LEU A 17 12.640 -3.586 1.554 1.00 0.00 O ATOM 258 CB LEU A 17 12.207 -6.803 0.416 1.00 0.00 C ATOM 259 CG LEU A 17 11.935 -6.886 1.922 1.00 0.00 C ATOM 260 CD1 LEU A 17 13.259 -6.773 2.670 1.00 0.00 C ATOM 261 CD2 LEU A 17 11.005 -5.755 2.365 1.00 0.00 C ATOM 0 H LEU A 17 13.233 -6.330 -1.665 1.00 0.00 H new ATOM 0 HA LEU A 17 11.290 -4.893 -0.101 1.00 0.00 H new ATOM 0 HB2 LEU A 17 11.418 -7.320 -0.130 1.00 0.00 H new ATOM 0 HB3 LEU A 17 13.142 -7.312 0.182 1.00 0.00 H new ATOM 0 HG LEU A 17 11.454 -7.839 2.144 1.00 0.00 H new ATOM 0 HD11 LEU A 17 13.077 -6.831 3.743 1.00 0.00 H new ATOM 0 HD12 LEU A 17 13.917 -7.588 2.369 1.00 0.00 H new ATOM 0 HD13 LEU A 17 13.731 -5.819 2.433 1.00 0.00 H new ATOM 0 HD21 LEU A 17 10.824 -5.832 3.437 1.00 0.00 H new ATOM 0 HD22 LEU A 17 11.469 -4.794 2.143 1.00 0.00 H new ATOM 0 HD23 LEU A 17 10.058 -5.832 1.831 1.00 0.00 H new ATOM 273 N GLN A 18 14.383 -4.805 0.992 1.00 0.00 N ATOM 274 CA GLN A 18 15.295 -4.034 1.878 1.00 0.00 C ATOM 275 C GLN A 18 15.350 -2.573 1.428 1.00 0.00 C ATOM 276 O GLN A 18 15.345 -1.665 2.237 1.00 0.00 O ATOM 277 CB GLN A 18 16.661 -4.693 1.702 1.00 0.00 C ATOM 278 CG GLN A 18 16.658 -6.079 2.346 1.00 0.00 C ATOM 279 CD GLN A 18 18.081 -6.639 2.338 1.00 0.00 C ATOM 280 OE1 GLN A 18 18.283 -7.859 1.926 1.00 0.00 O flip ATOM 281 NE2 GLN A 18 19.017 -5.959 2.709 1.00 0.00 N flip ATOM 0 H GLN A 18 14.827 -5.562 0.472 1.00 0.00 H new ATOM 0 HA GLN A 18 14.967 -4.039 2.917 1.00 0.00 H new ATOM 0 HB2 GLN A 18 16.900 -4.776 0.642 1.00 0.00 H new ATOM 0 HB3 GLN A 18 17.434 -4.073 2.156 1.00 0.00 H new ATOM 0 HG2 GLN A 18 16.284 -6.018 3.368 1.00 0.00 H new ATOM 0 HG3 GLN A 18 15.989 -6.745 1.801 1.00 0.00 H new ATOM 0 HE21 GLN A 18 18.858 -5.004 3.031 1.00 0.00 H new ATOM 0 HE22 GLN A 18 19.962 -6.343 2.698 1.00 0.00 H new ATOM 290 N ASP A 19 15.404 -2.334 0.144 1.00 0.00 N ATOM 291 CA ASP A 19 15.462 -0.925 -0.339 1.00 0.00 C ATOM 292 C ASP A 19 14.237 -0.160 0.159 1.00 0.00 C ATOM 293 O ASP A 19 14.341 0.957 0.626 1.00 0.00 O ATOM 294 CB ASP A 19 15.459 -1.016 -1.868 1.00 0.00 C ATOM 295 CG ASP A 19 16.708 -1.765 -2.342 1.00 0.00 C ATOM 296 OD1 ASP A 19 17.695 -1.744 -1.626 1.00 0.00 O ATOM 297 OD2 ASP A 19 16.656 -2.343 -3.415 1.00 0.00 O ATOM 0 H ASP A 19 15.410 -3.047 -0.585 1.00 0.00 H new ATOM 0 HA ASP A 19 16.344 -0.398 0.025 1.00 0.00 H new ATOM 0 HB2 ASP A 19 14.562 -1.532 -2.210 1.00 0.00 H new ATOM 0 HB3 ASP A 19 15.436 -0.016 -2.302 1.00 0.00 H new ATOM 302 N CYS A 20 13.077 -0.758 0.086 1.00 0.00 N ATOM 303 CA CYS A 20 11.857 -0.061 0.580 1.00 0.00 C ATOM 304 C CYS A 20 11.973 0.157 2.085 1.00 0.00 C ATOM 305 O CYS A 20 11.709 1.229 2.593 1.00 0.00 O ATOM 306 CB CYS A 20 10.693 -1.001 0.273 1.00 0.00 C ATOM 307 SG CYS A 20 10.422 -1.060 -1.515 1.00 0.00 S ATOM 0 H CYS A 20 12.924 -1.693 -0.292 1.00 0.00 H new ATOM 0 HA CYS A 20 11.719 0.913 0.110 1.00 0.00 H new ATOM 0 HB2 CYS A 20 10.908 -2.000 0.652 1.00 0.00 H new ATOM 0 HB3 CYS A 20 9.790 -0.656 0.777 1.00 0.00 H new ATOM 0 HG CYS A 20 11.286 -1.865 -2.059 1.00 0.00 H new ATOM 313 N GLN A 21 12.382 -0.854 2.803 1.00 0.00 N ATOM 314 CA GLN A 21 12.530 -0.705 4.273 1.00 0.00 C ATOM 315 C GLN A 21 13.578 0.360 4.570 1.00 0.00 C ATOM 316 O GLN A 21 13.389 1.222 5.392 1.00 0.00 O ATOM 317 CB GLN A 21 13.002 -2.067 4.763 1.00 0.00 C ATOM 318 CG GLN A 21 11.904 -3.090 4.505 1.00 0.00 C ATOM 319 CD GLN A 21 12.323 -4.442 5.070 1.00 0.00 C ATOM 320 OE1 GLN A 21 13.474 -4.821 4.989 1.00 0.00 O ATOM 321 NE2 GLN A 21 11.431 -5.186 5.647 1.00 0.00 N ATOM 0 H GLN A 21 12.619 -1.774 2.433 1.00 0.00 H new ATOM 0 HA GLN A 21 11.604 -0.400 4.761 1.00 0.00 H new ATOM 0 HB2 GLN A 21 13.917 -2.357 4.247 1.00 0.00 H new ATOM 0 HB3 GLN A 21 13.236 -2.025 5.827 1.00 0.00 H new ATOM 0 HG2 GLN A 21 10.973 -2.764 4.968 1.00 0.00 H new ATOM 0 HG3 GLN A 21 11.715 -3.174 3.435 1.00 0.00 H new ATOM 0 HE21 GLN A 21 10.465 -4.865 5.714 1.00 0.00 H new ATOM 0 HE22 GLN A 21 11.695 -6.092 6.034 1.00 0.00 H new ATOM 330 N ARG A 22 14.680 0.311 3.891 1.00 0.00 N ATOM 331 CA ARG A 22 15.748 1.317 4.125 1.00 0.00 C ATOM 332 C ARG A 22 15.172 2.727 4.151 1.00 0.00 C ATOM 333 O ARG A 22 15.413 3.495 5.060 1.00 0.00 O ATOM 334 CB ARG A 22 16.654 1.154 2.924 1.00 0.00 C ATOM 335 CG ARG A 22 17.768 0.172 3.274 1.00 0.00 C ATOM 336 CD ARG A 22 18.273 -0.500 2.000 1.00 0.00 C ATOM 337 NE ARG A 22 19.396 -1.368 2.451 1.00 0.00 N ATOM 338 CZ ARG A 22 20.572 -0.848 2.680 1.00 0.00 C ATOM 339 NH1 ARG A 22 20.749 0.441 2.582 1.00 0.00 N ATOM 340 NH2 ARG A 22 21.567 -1.619 3.029 1.00 0.00 N ATOM 0 H ARG A 22 14.892 -0.387 3.178 1.00 0.00 H new ATOM 0 HA ARG A 22 16.256 1.173 5.078 1.00 0.00 H new ATOM 0 HB2 ARG A 22 16.085 0.789 2.069 1.00 0.00 H new ATOM 0 HB3 ARG A 22 17.077 2.117 2.637 1.00 0.00 H new ATOM 0 HG2 ARG A 22 18.585 0.695 3.771 1.00 0.00 H new ATOM 0 HG3 ARG A 22 17.399 -0.579 3.972 1.00 0.00 H new ATOM 0 HD2 ARG A 22 17.487 -1.085 1.523 1.00 0.00 H new ATOM 0 HD3 ARG A 22 18.610 0.236 1.270 1.00 0.00 H new ATOM 0 HE ARG A 22 19.247 -2.369 2.581 1.00 0.00 H new ATOM 0 HH11 ARG A 22 19.968 1.045 2.326 1.00 0.00 H new ATOM 0 HH12 ARG A 22 21.668 0.845 2.761 1.00 0.00 H new ATOM 0 HH21 ARG A 22 21.425 -2.625 3.122 1.00 0.00 H new ATOM 0 HH22 ARG A 22 22.486 -1.215 3.208 1.00 0.00 H new ATOM 354 N ALA A 23 14.425 3.074 3.148 1.00 0.00 N ATOM 355 CA ALA A 23 13.844 4.438 3.092 1.00 0.00 C ATOM 356 C ALA A 23 12.726 4.602 4.130 1.00 0.00 C ATOM 357 O ALA A 23 12.706 5.552 4.887 1.00 0.00 O ATOM 358 CB ALA A 23 13.294 4.556 1.671 1.00 0.00 C ATOM 0 H ALA A 23 14.190 2.470 2.361 1.00 0.00 H new ATOM 0 HA ALA A 23 14.577 5.212 3.319 1.00 0.00 H new ATOM 0 HB1 ALA A 23 12.842 5.539 1.536 1.00 0.00 H new ATOM 0 HB2 ALA A 23 14.106 4.429 0.955 1.00 0.00 H new ATOM 0 HB3 ALA A 23 12.541 3.785 1.507 1.00 0.00 H new ATOM 364 N LEU A 24 11.779 3.700 4.151 1.00 0.00 N ATOM 365 CA LEU A 24 10.642 3.818 5.116 1.00 0.00 C ATOM 366 C LEU A 24 11.044 3.481 6.550 1.00 0.00 C ATOM 367 O LEU A 24 10.497 4.019 7.487 1.00 0.00 O ATOM 368 CB LEU A 24 9.619 2.814 4.610 1.00 0.00 C ATOM 369 CG LEU A 24 9.119 3.294 3.262 1.00 0.00 C ATOM 370 CD1 LEU A 24 8.001 2.389 2.779 1.00 0.00 C ATOM 371 CD2 LEU A 24 8.595 4.711 3.419 1.00 0.00 C ATOM 0 H LEU A 24 11.743 2.884 3.540 1.00 0.00 H new ATOM 0 HA LEU A 24 10.269 4.841 5.157 1.00 0.00 H new ATOM 0 HB2 LEU A 24 10.068 1.825 4.520 1.00 0.00 H new ATOM 0 HB3 LEU A 24 8.792 2.725 5.314 1.00 0.00 H new ATOM 0 HG LEU A 24 9.930 3.273 2.534 1.00 0.00 H new ATOM 0 HD11 LEU A 24 7.644 2.737 1.810 1.00 0.00 H new ATOM 0 HD12 LEU A 24 8.374 1.369 2.683 1.00 0.00 H new ATOM 0 HD13 LEU A 24 7.181 2.410 3.496 1.00 0.00 H new ATOM 0 HD21 LEU A 24 8.231 5.073 2.458 1.00 0.00 H new ATOM 0 HD22 LEU A 24 7.780 4.719 4.142 1.00 0.00 H new ATOM 0 HD23 LEU A 24 9.398 5.359 3.770 1.00 0.00 H new ATOM 383 N SER A 25 11.959 2.574 6.722 1.00 0.00 N ATOM 384 CA SER A 25 12.387 2.159 8.094 1.00 0.00 C ATOM 385 C SER A 25 12.710 3.368 8.978 1.00 0.00 C ATOM 386 O SER A 25 13.857 3.680 9.224 1.00 0.00 O ATOM 387 CB SER A 25 13.641 1.309 7.888 1.00 0.00 C ATOM 388 OG SER A 25 13.264 0.040 7.361 1.00 0.00 O ATOM 0 H SER A 25 12.439 2.092 5.962 1.00 0.00 H new ATOM 0 HA SER A 25 11.591 1.614 8.601 1.00 0.00 H new ATOM 0 HB2 SER A 25 14.327 1.811 7.205 1.00 0.00 H new ATOM 0 HB3 SER A 25 14.168 1.182 8.833 1.00 0.00 H new ATOM 0 HG SER A 25 12.637 0.167 6.618 1.00 0.00 H new ATOM 394 N ALA A 26 11.705 4.032 9.468 1.00 0.00 N ATOM 395 CA ALA A 26 11.933 5.204 10.353 1.00 0.00 C ATOM 396 C ALA A 26 11.693 4.777 11.803 1.00 0.00 C ATOM 397 O ALA A 26 11.209 3.694 12.062 1.00 0.00 O ATOM 398 CB ALA A 26 10.903 6.245 9.902 1.00 0.00 C ATOM 0 H ALA A 26 10.725 3.811 9.292 1.00 0.00 H new ATOM 0 HA ALA A 26 12.945 5.604 10.294 1.00 0.00 H new ATOM 0 HB1 ALA A 26 11.005 7.145 10.509 1.00 0.00 H new ATOM 0 HB2 ALA A 26 11.071 6.493 8.854 1.00 0.00 H new ATOM 0 HB3 ALA A 26 9.899 5.839 10.022 1.00 0.00 H new ATOM 404 N ASP A 27 12.038 5.599 12.749 1.00 0.00 N ATOM 405 CA ASP A 27 11.838 5.214 14.177 1.00 0.00 C ATOM 406 C ASP A 27 10.360 4.951 14.471 1.00 0.00 C ATOM 407 O ASP A 27 10.008 4.400 15.495 1.00 0.00 O ATOM 408 CB ASP A 27 12.330 6.420 14.969 1.00 0.00 C ATOM 409 CG ASP A 27 12.926 5.946 16.293 1.00 0.00 C ATOM 410 OD1 ASP A 27 12.647 4.824 16.679 1.00 0.00 O ATOM 411 OD2 ASP A 27 13.655 6.715 16.900 1.00 0.00 O ATOM 0 H ASP A 27 12.450 6.520 12.600 1.00 0.00 H new ATOM 0 HA ASP A 27 12.370 4.298 14.433 1.00 0.00 H new ATOM 0 HB2 ASP A 27 13.079 6.966 14.395 1.00 0.00 H new ATOM 0 HB3 ASP A 27 11.506 7.109 15.154 1.00 0.00 H new ATOM 416 N ARG A 28 9.497 5.355 13.589 1.00 0.00 N ATOM 417 CA ARG A 28 8.040 5.146 13.816 1.00 0.00 C ATOM 418 C ARG A 28 7.452 4.251 12.724 1.00 0.00 C ATOM 419 O ARG A 28 6.293 4.360 12.385 1.00 0.00 O ATOM 420 CB ARG A 28 7.445 6.548 13.715 1.00 0.00 C ATOM 421 CG ARG A 28 7.518 7.016 12.261 1.00 0.00 C ATOM 422 CD ARG A 28 7.183 8.504 12.175 1.00 0.00 C ATOM 423 NE ARG A 28 8.442 9.204 12.557 1.00 0.00 N ATOM 424 CZ ARG A 28 9.400 9.366 11.684 1.00 0.00 C ATOM 425 NH1 ARG A 28 9.285 8.865 10.480 1.00 0.00 N ATOM 426 NH2 ARG A 28 10.476 10.020 12.018 1.00 0.00 N ATOM 0 H ARG A 28 9.736 5.824 12.715 1.00 0.00 H new ATOM 0 HA ARG A 28 7.831 4.662 14.770 1.00 0.00 H new ATOM 0 HB2 ARG A 28 6.410 6.543 14.058 1.00 0.00 H new ATOM 0 HB3 ARG A 28 7.991 7.236 14.360 1.00 0.00 H new ATOM 0 HG2 ARG A 28 8.516 6.836 11.862 1.00 0.00 H new ATOM 0 HG3 ARG A 28 6.822 6.442 11.650 1.00 0.00 H new ATOM 0 HD2 ARG A 28 6.867 8.780 11.169 1.00 0.00 H new ATOM 0 HD3 ARG A 28 6.366 8.765 12.848 1.00 0.00 H new ATOM 0 HE ARG A 28 8.556 9.559 13.506 1.00 0.00 H new ATOM 0 HH11 ARG A 28 8.446 8.346 10.221 1.00 0.00 H new ATOM 0 HH12 ARG A 28 10.035 8.993 9.800 1.00 0.00 H new ATOM 0 HH21 ARG A 28 10.568 10.404 12.959 1.00 0.00 H new ATOM 0 HH22 ARG A 28 11.226 10.148 11.339 1.00 0.00 H new ATOM 440 N TYR A 29 8.244 3.393 12.142 1.00 0.00 N ATOM 441 CA TYR A 29 7.724 2.534 11.044 1.00 0.00 C ATOM 442 C TYR A 29 7.572 1.073 11.471 1.00 0.00 C ATOM 443 O TYR A 29 8.475 0.473 12.019 1.00 0.00 O ATOM 444 CB TYR A 29 8.788 2.645 9.964 1.00 0.00 C ATOM 445 CG TYR A 29 8.393 3.697 8.958 1.00 0.00 C ATOM 446 CD1 TYR A 29 8.393 5.042 9.332 1.00 0.00 C ATOM 447 CD2 TYR A 29 8.026 3.332 7.658 1.00 0.00 C ATOM 448 CE1 TYR A 29 8.030 6.029 8.410 1.00 0.00 C ATOM 449 CE2 TYR A 29 7.662 4.318 6.737 1.00 0.00 C ATOM 450 CZ TYR A 29 7.665 5.667 7.111 1.00 0.00 C ATOM 451 OH TYR A 29 7.303 6.639 6.199 1.00 0.00 O ATOM 0 H TYR A 29 9.226 3.251 12.379 1.00 0.00 H new ATOM 0 HA TYR A 29 6.732 2.852 10.724 1.00 0.00 H new ATOM 0 HB2 TYR A 29 9.748 2.901 10.412 1.00 0.00 H new ATOM 0 HB3 TYR A 29 8.915 1.683 9.466 1.00 0.00 H new ATOM 0 HD1 TYR A 29 8.674 5.321 10.337 1.00 0.00 H new ATOM 0 HD2 TYR A 29 8.024 2.292 7.367 1.00 0.00 H new ATOM 0 HE1 TYR A 29 8.032 7.069 8.702 1.00 0.00 H new ATOM 0 HE2 TYR A 29 7.377 4.038 5.733 1.00 0.00 H new ATOM 0 HH TYR A 29 8.049 7.261 6.071 1.00 0.00 H new ATOM 461 N GLN A 30 6.447 0.488 11.173 1.00 0.00 N ATOM 462 CA GLN A 30 6.242 -0.946 11.504 1.00 0.00 C ATOM 463 C GLN A 30 6.301 -1.738 10.197 1.00 0.00 C ATOM 464 O GLN A 30 5.298 -1.979 9.557 1.00 0.00 O ATOM 465 CB GLN A 30 4.852 -1.029 12.130 1.00 0.00 C ATOM 466 CG GLN A 30 4.674 -2.402 12.774 1.00 0.00 C ATOM 467 CD GLN A 30 3.228 -2.568 13.243 1.00 0.00 C ATOM 468 OE1 GLN A 30 2.592 -1.612 13.639 1.00 0.00 O ATOM 469 NE2 GLN A 30 2.677 -3.749 13.208 1.00 0.00 N ATOM 0 H GLN A 30 5.659 0.944 10.713 1.00 0.00 H new ATOM 0 HA GLN A 30 6.992 -1.347 12.186 1.00 0.00 H new ATOM 0 HB2 GLN A 30 4.729 -0.245 12.877 1.00 0.00 H new ATOM 0 HB3 GLN A 30 4.087 -0.868 11.370 1.00 0.00 H new ATOM 0 HG2 GLN A 30 4.927 -3.185 12.059 1.00 0.00 H new ATOM 0 HG3 GLN A 30 5.355 -2.509 13.618 1.00 0.00 H new ATOM 0 HE21 GLN A 30 3.212 -4.552 12.875 1.00 0.00 H new ATOM 0 HE22 GLN A 30 1.711 -3.870 13.513 1.00 0.00 H new ATOM 478 N LEU A 31 7.481 -2.098 9.772 1.00 0.00 N ATOM 479 CA LEU A 31 7.627 -2.822 8.479 1.00 0.00 C ATOM 480 C LEU A 31 7.103 -4.254 8.551 1.00 0.00 C ATOM 481 O LEU A 31 7.206 -4.930 9.555 1.00 0.00 O ATOM 482 CB LEU A 31 9.124 -2.820 8.197 1.00 0.00 C ATOM 483 CG LEU A 31 9.530 -1.469 7.603 1.00 0.00 C ATOM 484 CD1 LEU A 31 9.036 -1.372 6.159 1.00 0.00 C ATOM 485 CD2 LEU A 31 8.912 -0.333 8.420 1.00 0.00 C ATOM 0 H LEU A 31 8.354 -1.920 10.268 1.00 0.00 H new ATOM 0 HA LEU A 31 7.045 -2.338 7.694 1.00 0.00 H new ATOM 0 HB2 LEU A 31 9.678 -3.006 9.117 1.00 0.00 H new ATOM 0 HB3 LEU A 31 9.376 -3.624 7.505 1.00 0.00 H new ATOM 0 HG LEU A 31 10.617 -1.385 7.627 1.00 0.00 H new ATOM 0 HD11 LEU A 31 9.327 -0.409 5.739 1.00 0.00 H new ATOM 0 HD12 LEU A 31 9.479 -2.174 5.568 1.00 0.00 H new ATOM 0 HD13 LEU A 31 7.950 -1.464 6.139 1.00 0.00 H new ATOM 0 HD21 LEU A 31 9.206 0.625 7.991 1.00 0.00 H new ATOM 0 HD22 LEU A 31 7.826 -0.421 8.402 1.00 0.00 H new ATOM 0 HD23 LEU A 31 9.264 -0.392 9.450 1.00 0.00 H new ATOM 497 N GLN A 32 6.560 -4.716 7.459 1.00 0.00 N ATOM 498 CA GLN A 32 6.032 -6.106 7.383 1.00 0.00 C ATOM 499 C GLN A 32 6.293 -6.636 5.969 1.00 0.00 C ATOM 500 O GLN A 32 5.854 -6.058 4.995 1.00 0.00 O ATOM 501 CB GLN A 32 4.533 -5.968 7.656 1.00 0.00 C ATOM 502 CG GLN A 32 3.921 -7.351 7.878 1.00 0.00 C ATOM 503 CD GLN A 32 4.533 -7.989 9.125 1.00 0.00 C ATOM 504 OE1 GLN A 32 4.302 -7.539 10.231 1.00 0.00 O ATOM 505 NE2 GLN A 32 5.307 -9.027 8.990 1.00 0.00 N ATOM 0 H GLN A 32 6.458 -4.177 6.599 1.00 0.00 H new ATOM 0 HA GLN A 32 6.495 -6.796 8.089 1.00 0.00 H new ATOM 0 HB2 GLN A 32 4.369 -5.342 8.533 1.00 0.00 H new ATOM 0 HB3 GLN A 32 4.044 -5.474 6.816 1.00 0.00 H new ATOM 0 HG2 GLN A 32 2.840 -7.267 7.993 1.00 0.00 H new ATOM 0 HG3 GLN A 32 4.101 -7.983 7.008 1.00 0.00 H new ATOM 0 HE21 GLN A 32 5.499 -9.403 8.061 1.00 0.00 H new ATOM 0 HE22 GLN A 32 5.721 -9.465 9.813 1.00 0.00 H new ATOM 514 N VAL A 33 7.032 -7.703 5.833 1.00 0.00 N ATOM 515 CA VAL A 33 7.337 -8.208 4.461 1.00 0.00 C ATOM 516 C VAL A 33 6.538 -9.467 4.128 1.00 0.00 C ATOM 517 O VAL A 33 6.482 -10.409 4.895 1.00 0.00 O ATOM 518 CB VAL A 33 8.830 -8.528 4.480 1.00 0.00 C ATOM 519 CG1 VAL A 33 9.338 -8.649 3.043 1.00 0.00 C ATOM 520 CG2 VAL A 33 9.591 -7.410 5.199 1.00 0.00 C ATOM 0 H VAL A 33 7.434 -8.242 6.600 1.00 0.00 H new ATOM 0 HA VAL A 33 7.071 -7.470 3.704 1.00 0.00 H new ATOM 0 HB VAL A 33 8.992 -9.468 5.008 1.00 0.00 H new ATOM 0 HG11 VAL A 33 10.404 -8.877 3.052 1.00 0.00 H new ATOM 0 HG12 VAL A 33 8.800 -9.448 2.533 1.00 0.00 H new ATOM 0 HG13 VAL A 33 9.173 -7.708 2.518 1.00 0.00 H new ATOM 0 HG21 VAL A 33 10.656 -7.643 5.210 1.00 0.00 H new ATOM 0 HG22 VAL A 33 9.431 -6.467 4.676 1.00 0.00 H new ATOM 0 HG23 VAL A 33 9.228 -7.323 6.223 1.00 0.00 H new ATOM 530 N CYS A 34 5.939 -9.492 2.971 1.00 0.00 N ATOM 531 CA CYS A 34 5.161 -10.692 2.558 1.00 0.00 C ATOM 532 C CYS A 34 5.862 -11.373 1.378 1.00 0.00 C ATOM 533 O CYS A 34 6.071 -10.781 0.336 1.00 0.00 O ATOM 534 CB CYS A 34 3.787 -10.161 2.153 1.00 0.00 C ATOM 535 SG CYS A 34 2.839 -9.753 3.641 1.00 0.00 S ATOM 0 H CYS A 34 5.955 -8.731 2.292 1.00 0.00 H new ATOM 0 HA CYS A 34 5.076 -11.435 3.351 1.00 0.00 H new ATOM 0 HB2 CYS A 34 3.897 -9.277 1.525 1.00 0.00 H new ATOM 0 HB3 CYS A 34 3.256 -10.908 1.563 1.00 0.00 H new ATOM 0 HG CYS A 34 2.876 -8.469 3.841 1.00 0.00 H new ATOM 541 N GLU A 35 6.245 -12.606 1.549 1.00 0.00 N ATOM 542 CA GLU A 35 6.959 -13.340 0.460 1.00 0.00 C ATOM 543 C GLU A 35 6.103 -13.418 -0.807 1.00 0.00 C ATOM 544 O GLU A 35 6.612 -13.522 -1.905 1.00 0.00 O ATOM 545 CB GLU A 35 7.188 -14.737 1.039 1.00 0.00 C ATOM 546 CG GLU A 35 7.988 -14.623 2.341 1.00 0.00 C ATOM 547 CD GLU A 35 8.639 -15.969 2.662 1.00 0.00 C ATOM 548 OE1 GLU A 35 9.380 -16.458 1.827 1.00 0.00 O ATOM 549 OE2 GLU A 35 8.382 -16.488 3.735 1.00 0.00 O ATOM 0 H GLU A 35 6.094 -13.144 2.402 1.00 0.00 H new ATOM 0 HA GLU A 35 7.886 -12.846 0.168 1.00 0.00 H new ATOM 0 HB2 GLU A 35 6.232 -15.226 1.228 1.00 0.00 H new ATOM 0 HB3 GLU A 35 7.726 -15.356 0.322 1.00 0.00 H new ATOM 0 HG2 GLU A 35 8.752 -13.852 2.244 1.00 0.00 H new ATOM 0 HG3 GLU A 35 7.332 -14.321 3.157 1.00 0.00 H new ATOM 556 N SER A 36 4.811 -13.391 -0.664 1.00 0.00 N ATOM 557 CA SER A 36 3.927 -13.489 -1.859 1.00 0.00 C ATOM 558 C SER A 36 2.943 -12.317 -1.911 1.00 0.00 C ATOM 559 O SER A 36 3.071 -11.349 -1.186 1.00 0.00 O ATOM 560 CB SER A 36 3.177 -14.799 -1.665 1.00 0.00 C ATOM 561 OG SER A 36 3.979 -15.685 -0.897 1.00 0.00 O ATOM 0 H SER A 36 4.326 -13.305 0.229 1.00 0.00 H new ATOM 0 HA SER A 36 4.491 -13.458 -2.791 1.00 0.00 H new ATOM 0 HB2 SER A 36 2.228 -14.618 -1.160 1.00 0.00 H new ATOM 0 HB3 SER A 36 2.944 -15.245 -2.632 1.00 0.00 H new ATOM 0 HG SER A 36 3.500 -16.530 -0.767 1.00 0.00 H new ATOM 567 N GLY A 37 1.942 -12.414 -2.747 1.00 0.00 N ATOM 568 CA GLY A 37 0.922 -11.331 -2.833 1.00 0.00 C ATOM 569 C GLY A 37 -0.265 -11.780 -1.996 1.00 0.00 C ATOM 570 O GLY A 37 -0.996 -10.989 -1.432 1.00 0.00 O ATOM 0 H GLY A 37 1.788 -13.202 -3.376 1.00 0.00 H new ATOM 0 HA2 GLY A 37 1.325 -10.390 -2.459 1.00 0.00 H new ATOM 0 HA3 GLY A 37 0.624 -11.162 -3.868 1.00 0.00 H new ATOM 574 N GLU A 38 -0.424 -13.071 -1.894 1.00 0.00 N ATOM 575 CA GLU A 38 -1.512 -13.648 -1.077 1.00 0.00 C ATOM 576 C GLU A 38 -1.177 -13.407 0.385 1.00 0.00 C ATOM 577 O GLU A 38 -2.020 -13.069 1.191 1.00 0.00 O ATOM 578 CB GLU A 38 -1.465 -15.142 -1.396 1.00 0.00 C ATOM 579 CG GLU A 38 -2.372 -15.460 -2.586 1.00 0.00 C ATOM 580 CD GLU A 38 -3.836 -15.263 -2.187 1.00 0.00 C ATOM 581 OE1 GLU A 38 -4.231 -14.126 -1.992 1.00 0.00 O ATOM 582 OE2 GLU A 38 -4.539 -16.255 -2.082 1.00 0.00 O ATOM 0 H GLU A 38 0.171 -13.759 -2.355 1.00 0.00 H new ATOM 0 HA GLU A 38 -2.495 -13.222 -1.277 1.00 0.00 H new ATOM 0 HB2 GLU A 38 -0.441 -15.441 -1.621 1.00 0.00 H new ATOM 0 HB3 GLU A 38 -1.781 -15.717 -0.525 1.00 0.00 H new ATOM 0 HG2 GLU A 38 -2.124 -14.813 -3.427 1.00 0.00 H new ATOM 0 HG3 GLU A 38 -2.210 -16.486 -2.915 1.00 0.00 H new ATOM 589 N MET A 39 0.071 -13.578 0.719 1.00 0.00 N ATOM 590 CA MET A 39 0.512 -13.355 2.118 1.00 0.00 C ATOM 591 C MET A 39 0.226 -11.910 2.510 1.00 0.00 C ATOM 592 O MET A 39 -0.041 -11.597 3.653 1.00 0.00 O ATOM 593 CB MET A 39 2.016 -13.626 2.099 1.00 0.00 C ATOM 594 CG MET A 39 2.267 -15.065 1.646 1.00 0.00 C ATOM 595 SD MET A 39 1.564 -16.209 2.859 1.00 0.00 S ATOM 596 CE MET A 39 2.510 -15.631 4.289 1.00 0.00 C ATOM 0 H MET A 39 0.808 -13.865 0.075 1.00 0.00 H new ATOM 0 HA MET A 39 -0.002 -13.994 2.837 1.00 0.00 H new ATOM 0 HB2 MET A 39 2.514 -12.929 1.425 1.00 0.00 H new ATOM 0 HB3 MET A 39 2.438 -13.467 3.091 1.00 0.00 H new ATOM 0 HG2 MET A 39 1.817 -15.234 0.668 1.00 0.00 H new ATOM 0 HG3 MET A 39 3.337 -15.243 1.540 1.00 0.00 H new ATOM 0 HE1 MET A 39 2.648 -16.454 4.991 1.00 0.00 H new ATOM 0 HE2 MET A 39 3.484 -15.269 3.959 1.00 0.00 H new ATOM 0 HE3 MET A 39 1.969 -14.822 4.780 1.00 0.00 H new ATOM 606 N LEU A 40 0.275 -11.033 1.551 1.00 0.00 N ATOM 607 CA LEU A 40 0.004 -9.597 1.816 1.00 0.00 C ATOM 608 C LEU A 40 -1.466 -9.413 2.177 1.00 0.00 C ATOM 609 O LEU A 40 -1.815 -8.659 3.063 1.00 0.00 O ATOM 610 CB LEU A 40 0.328 -8.912 0.483 1.00 0.00 C ATOM 611 CG LEU A 40 0.578 -7.422 0.694 1.00 0.00 C ATOM 612 CD1 LEU A 40 -0.534 -6.838 1.558 1.00 0.00 C ATOM 613 CD2 LEU A 40 1.926 -7.234 1.392 1.00 0.00 C ATOM 0 H LEU A 40 0.495 -11.254 0.580 1.00 0.00 H new ATOM 0 HA LEU A 40 0.586 -9.190 2.643 1.00 0.00 H new ATOM 0 HB2 LEU A 40 1.207 -9.374 0.034 1.00 0.00 H new ATOM 0 HB3 LEU A 40 -0.497 -9.053 -0.215 1.00 0.00 H new ATOM 0 HG LEU A 40 0.591 -6.910 -0.268 1.00 0.00 H new ATOM 0 HD11 LEU A 40 -0.356 -5.773 1.709 1.00 0.00 H new ATOM 0 HD12 LEU A 40 -1.493 -6.978 1.060 1.00 0.00 H new ATOM 0 HD13 LEU A 40 -0.549 -7.344 2.523 1.00 0.00 H new ATOM 0 HD21 LEU A 40 2.111 -6.171 1.546 1.00 0.00 H new ATOM 0 HD22 LEU A 40 1.911 -7.743 2.356 1.00 0.00 H new ATOM 0 HD23 LEU A 40 2.718 -7.654 0.772 1.00 0.00 H new ATOM 625 N LEU A 41 -2.329 -10.100 1.492 1.00 0.00 N ATOM 626 CA LEU A 41 -3.780 -9.973 1.778 1.00 0.00 C ATOM 627 C LEU A 41 -4.082 -10.457 3.194 1.00 0.00 C ATOM 628 O LEU A 41 -4.818 -9.833 3.931 1.00 0.00 O ATOM 629 CB LEU A 41 -4.449 -10.874 0.745 1.00 0.00 C ATOM 630 CG LEU A 41 -4.071 -10.391 -0.656 1.00 0.00 C ATOM 631 CD1 LEU A 41 -4.655 -11.333 -1.706 1.00 0.00 C ATOM 632 CD2 LEU A 41 -4.620 -8.983 -0.875 1.00 0.00 C ATOM 0 H LEU A 41 -2.091 -10.748 0.741 1.00 0.00 H new ATOM 0 HA LEU A 41 -4.133 -8.944 1.718 1.00 0.00 H new ATOM 0 HB2 LEU A 41 -4.132 -11.907 0.885 1.00 0.00 H new ATOM 0 HB3 LEU A 41 -5.531 -10.853 0.871 1.00 0.00 H new ATOM 0 HG LEU A 41 -2.985 -10.379 -0.749 1.00 0.00 H new ATOM 0 HD11 LEU A 41 -4.382 -10.983 -2.701 1.00 0.00 H new ATOM 0 HD12 LEU A 41 -4.260 -12.337 -1.554 1.00 0.00 H new ATOM 0 HD13 LEU A 41 -5.741 -11.352 -1.614 1.00 0.00 H new ATOM 0 HD21 LEU A 41 -4.351 -8.639 -1.873 1.00 0.00 H new ATOM 0 HD22 LEU A 41 -5.705 -8.996 -0.776 1.00 0.00 H new ATOM 0 HD23 LEU A 41 -4.196 -8.308 -0.132 1.00 0.00 H new ATOM 644 N GLU A 42 -3.515 -11.566 3.582 1.00 0.00 N ATOM 645 CA GLU A 42 -3.774 -12.086 4.949 1.00 0.00 C ATOM 646 C GLU A 42 -3.328 -11.051 5.982 1.00 0.00 C ATOM 647 O GLU A 42 -4.008 -10.805 6.957 1.00 0.00 O ATOM 648 CB GLU A 42 -2.934 -13.364 5.054 1.00 0.00 C ATOM 649 CG GLU A 42 -3.538 -14.295 6.108 1.00 0.00 C ATOM 650 CD GLU A 42 -2.800 -15.636 6.085 1.00 0.00 C ATOM 651 OE1 GLU A 42 -2.299 -15.997 5.031 1.00 0.00 O ATOM 652 OE2 GLU A 42 -2.754 -16.282 7.119 1.00 0.00 O ATOM 0 H GLU A 42 -2.886 -12.131 3.012 1.00 0.00 H new ATOM 0 HA GLU A 42 -4.829 -12.287 5.132 1.00 0.00 H new ATOM 0 HB2 GLU A 42 -2.899 -13.868 4.088 1.00 0.00 H new ATOM 0 HB3 GLU A 42 -1.907 -13.115 5.321 1.00 0.00 H new ATOM 0 HG2 GLU A 42 -3.461 -13.842 7.096 1.00 0.00 H new ATOM 0 HG3 GLU A 42 -4.599 -14.448 5.909 1.00 0.00 H new ATOM 659 N TYR A 43 -2.200 -10.424 5.772 1.00 0.00 N ATOM 660 CA TYR A 43 -1.750 -9.399 6.755 1.00 0.00 C ATOM 661 C TYR A 43 -2.742 -8.234 6.803 1.00 0.00 C ATOM 662 O TYR A 43 -3.043 -7.705 7.854 1.00 0.00 O ATOM 663 CB TYR A 43 -0.394 -8.897 6.254 1.00 0.00 C ATOM 664 CG TYR A 43 -0.022 -7.668 7.049 1.00 0.00 C ATOM 665 CD1 TYR A 43 0.568 -7.802 8.312 1.00 0.00 C ATOM 666 CD2 TYR A 43 -0.296 -6.393 6.536 1.00 0.00 C ATOM 667 CE1 TYR A 43 0.888 -6.662 9.060 1.00 0.00 C ATOM 668 CE2 TYR A 43 0.019 -5.254 7.287 1.00 0.00 C ATOM 669 CZ TYR A 43 0.612 -5.391 8.548 1.00 0.00 C ATOM 670 OH TYR A 43 0.915 -4.269 9.290 1.00 0.00 O ATOM 0 H TYR A 43 -1.581 -10.575 4.976 1.00 0.00 H new ATOM 0 HA TYR A 43 -1.683 -9.820 7.758 1.00 0.00 H new ATOM 0 HB2 TYR A 43 0.365 -9.670 6.373 1.00 0.00 H new ATOM 0 HB3 TYR A 43 -0.445 -8.661 5.191 1.00 0.00 H new ATOM 0 HD1 TYR A 43 0.776 -8.784 8.709 1.00 0.00 H new ATOM 0 HD2 TYR A 43 -0.750 -6.289 5.562 1.00 0.00 H new ATOM 0 HE1 TYR A 43 1.348 -6.765 10.032 1.00 0.00 H new ATOM 0 HE2 TYR A 43 -0.195 -4.271 6.894 1.00 0.00 H new ATOM 0 HH TYR A 43 1.116 -3.523 8.687 1.00 0.00 H new ATOM 680 N ALA A 44 -3.230 -7.814 5.668 1.00 0.00 N ATOM 681 CA ALA A 44 -4.178 -6.663 5.642 1.00 0.00 C ATOM 682 C ALA A 44 -5.625 -7.117 5.880 1.00 0.00 C ATOM 683 O ALA A 44 -6.403 -6.413 6.490 1.00 0.00 O ATOM 684 CB ALA A 44 -4.025 -6.067 4.240 1.00 0.00 C ATOM 0 H ALA A 44 -3.013 -8.218 4.757 1.00 0.00 H new ATOM 0 HA ALA A 44 -3.958 -5.943 6.431 1.00 0.00 H new ATOM 0 HB1 ALA A 44 -4.691 -5.210 4.134 1.00 0.00 H new ATOM 0 HB2 ALA A 44 -2.994 -5.746 4.092 1.00 0.00 H new ATOM 0 HB3 ALA A 44 -4.281 -6.820 3.495 1.00 0.00 H new ATOM 690 N GLN A 45 -5.997 -8.276 5.405 1.00 0.00 N ATOM 691 CA GLN A 45 -7.403 -8.752 5.603 1.00 0.00 C ATOM 692 C GLN A 45 -7.840 -8.586 7.048 1.00 0.00 C ATOM 693 O GLN A 45 -9.016 -8.550 7.355 1.00 0.00 O ATOM 694 CB GLN A 45 -7.371 -10.235 5.252 1.00 0.00 C ATOM 695 CG GLN A 45 -7.530 -10.385 3.749 1.00 0.00 C ATOM 696 CD GLN A 45 -7.100 -11.785 3.315 1.00 0.00 C ATOM 697 OE1 GLN A 45 -6.734 -12.603 4.133 1.00 0.00 O ATOM 698 NE2 GLN A 45 -7.129 -12.091 2.048 1.00 0.00 N ATOM 0 H GLN A 45 -5.392 -8.915 4.889 1.00 0.00 H new ATOM 0 HA GLN A 45 -8.103 -8.184 4.990 1.00 0.00 H new ATOM 0 HB2 GLN A 45 -6.431 -10.680 5.578 1.00 0.00 H new ATOM 0 HB3 GLN A 45 -8.171 -10.763 5.771 1.00 0.00 H new ATOM 0 HG2 GLN A 45 -8.568 -10.210 3.466 1.00 0.00 H new ATOM 0 HG3 GLN A 45 -6.929 -9.635 3.235 1.00 0.00 H new ATOM 0 HE21 GLN A 45 -7.437 -11.400 1.364 1.00 0.00 H new ATOM 0 HE22 GLN A 45 -6.843 -13.021 1.741 1.00 0.00 H new ATOM 707 N THR A 46 -6.909 -8.515 7.940 1.00 0.00 N ATOM 708 CA THR A 46 -7.273 -8.388 9.371 1.00 0.00 C ATOM 709 C THR A 46 -6.783 -7.043 9.907 1.00 0.00 C ATOM 710 O THR A 46 -7.036 -6.679 11.038 1.00 0.00 O ATOM 711 CB THR A 46 -6.557 -9.566 10.042 1.00 0.00 C ATOM 712 OG1 THR A 46 -5.226 -9.188 10.366 1.00 0.00 O ATOM 713 CG2 THR A 46 -6.533 -10.764 9.074 1.00 0.00 C ATOM 0 H THR A 46 -5.908 -8.539 7.744 1.00 0.00 H new ATOM 0 HA THR A 46 -8.347 -8.415 9.555 1.00 0.00 H new ATOM 0 HB THR A 46 -7.085 -9.845 10.954 1.00 0.00 H new ATOM 0 HG1 THR A 46 -4.768 -9.940 10.797 1.00 0.00 H new ATOM 0 HG21 THR A 46 -6.025 -11.604 9.547 1.00 0.00 H new ATOM 0 HG22 THR A 46 -7.555 -11.051 8.825 1.00 0.00 H new ATOM 0 HG23 THR A 46 -6.003 -10.485 8.163 1.00 0.00 H new ATOM 721 N HIS A 47 -6.090 -6.302 9.089 1.00 0.00 N ATOM 722 CA HIS A 47 -5.581 -4.975 9.520 1.00 0.00 C ATOM 723 C HIS A 47 -5.870 -3.929 8.442 1.00 0.00 C ATOM 724 O HIS A 47 -5.234 -2.898 8.382 1.00 0.00 O ATOM 725 CB HIS A 47 -4.078 -5.184 9.698 1.00 0.00 C ATOM 726 CG HIS A 47 -3.859 -6.074 10.886 1.00 0.00 C ATOM 727 ND1 HIS A 47 -4.788 -6.166 11.910 1.00 0.00 N ATOM 728 CD2 HIS A 47 -2.838 -6.926 11.229 1.00 0.00 C ATOM 729 CE1 HIS A 47 -4.315 -7.043 12.810 1.00 0.00 C ATOM 730 NE2 HIS A 47 -3.130 -7.536 12.445 1.00 0.00 N ATOM 0 H HIS A 47 -5.853 -6.563 8.132 1.00 0.00 H new ATOM 0 HA HIS A 47 -6.052 -4.614 10.435 1.00 0.00 H new ATOM 0 HB2 HIS A 47 -3.650 -5.635 8.803 1.00 0.00 H new ATOM 0 HB3 HIS A 47 -3.577 -4.227 9.844 1.00 0.00 H new ATOM 0 HD1 HIS A 47 -5.671 -5.659 11.969 1.00 0.00 H new ATOM 0 HD2 HIS A 47 -1.946 -7.096 10.645 1.00 0.00 H new ATOM 0 HE1 HIS A 47 -4.831 -7.316 13.719 1.00 0.00 H new ATOM 738 N ARG A 48 -6.825 -4.188 7.585 1.00 0.00 N ATOM 739 CA ARG A 48 -7.140 -3.201 6.498 1.00 0.00 C ATOM 740 C ARG A 48 -7.163 -1.795 7.084 1.00 0.00 C ATOM 741 O ARG A 48 -6.555 -0.876 6.573 1.00 0.00 O ATOM 742 CB ARG A 48 -8.552 -3.509 5.967 1.00 0.00 C ATOM 743 CG ARG A 48 -8.921 -4.981 6.141 1.00 0.00 C ATOM 744 CD ARG A 48 -10.214 -5.277 5.380 1.00 0.00 C ATOM 745 NE ARG A 48 -10.840 -6.405 6.120 1.00 0.00 N ATOM 746 CZ ARG A 48 -12.083 -6.727 5.890 1.00 0.00 C ATOM 747 NH1 ARG A 48 -12.792 -6.040 5.035 1.00 0.00 N ATOM 748 NH2 ARG A 48 -12.622 -7.734 6.524 1.00 0.00 N ATOM 0 H ARG A 48 -7.398 -5.032 7.587 1.00 0.00 H new ATOM 0 HA ARG A 48 -6.392 -3.269 5.708 1.00 0.00 H new ATOM 0 HB2 ARG A 48 -9.279 -2.889 6.491 1.00 0.00 H new ATOM 0 HB3 ARG A 48 -8.608 -3.244 4.911 1.00 0.00 H new ATOM 0 HG2 ARG A 48 -8.115 -5.615 5.771 1.00 0.00 H new ATOM 0 HG3 ARG A 48 -9.048 -5.212 7.199 1.00 0.00 H new ATOM 0 HD2 ARG A 48 -10.869 -4.406 5.359 1.00 0.00 H new ATOM 0 HD3 ARG A 48 -10.010 -5.548 4.344 1.00 0.00 H new ATOM 0 HE ARG A 48 -10.297 -6.927 6.808 1.00 0.00 H new ATOM 0 HH11 ARG A 48 -12.374 -5.249 4.545 1.00 0.00 H new ATOM 0 HH12 ARG A 48 -13.764 -6.294 4.857 1.00 0.00 H new ATOM 0 HH21 ARG A 48 -12.071 -8.267 7.197 1.00 0.00 H new ATOM 0 HH22 ARG A 48 -13.594 -7.988 6.346 1.00 0.00 H new ATOM 762 N ASP A 49 -7.891 -1.629 8.146 1.00 0.00 N ATOM 763 CA ASP A 49 -7.997 -0.287 8.786 1.00 0.00 C ATOM 764 C ASP A 49 -6.778 -0.007 9.668 1.00 0.00 C ATOM 765 O ASP A 49 -6.686 1.025 10.300 1.00 0.00 O ATOM 766 CB ASP A 49 -9.269 -0.357 9.628 1.00 0.00 C ATOM 767 CG ASP A 49 -10.459 -0.641 8.712 1.00 0.00 C ATOM 768 OD1 ASP A 49 -10.241 -0.767 7.519 1.00 0.00 O ATOM 769 OD2 ASP A 49 -11.565 -0.730 9.216 1.00 0.00 O ATOM 0 H ASP A 49 -8.423 -2.369 8.605 1.00 0.00 H new ATOM 0 HA ASP A 49 -8.033 0.517 8.051 1.00 0.00 H new ATOM 0 HB2 ASP A 49 -9.179 -1.140 10.381 1.00 0.00 H new ATOM 0 HB3 ASP A 49 -9.420 0.582 10.160 1.00 0.00 H new ATOM 774 N GLN A 50 -5.840 -0.915 9.709 1.00 0.00 N ATOM 775 CA GLN A 50 -4.627 -0.690 10.543 1.00 0.00 C ATOM 776 C GLN A 50 -3.390 -0.538 9.654 1.00 0.00 C ATOM 777 O GLN A 50 -2.335 -0.151 10.115 1.00 0.00 O ATOM 778 CB GLN A 50 -4.499 -1.928 11.431 1.00 0.00 C ATOM 779 CG GLN A 50 -5.722 -2.044 12.343 1.00 0.00 C ATOM 780 CD GLN A 50 -5.493 -3.178 13.337 1.00 0.00 C ATOM 781 OE1 GLN A 50 -4.385 -3.390 13.789 1.00 0.00 O ATOM 782 NE2 GLN A 50 -6.498 -3.923 13.703 1.00 0.00 N ATOM 0 H GLN A 50 -5.862 -1.800 9.202 1.00 0.00 H new ATOM 0 HA GLN A 50 -4.709 0.221 11.135 1.00 0.00 H new ATOM 0 HB2 GLN A 50 -4.409 -2.822 10.813 1.00 0.00 H new ATOM 0 HB3 GLN A 50 -3.592 -1.863 12.032 1.00 0.00 H new ATOM 0 HG2 GLN A 50 -5.887 -1.106 12.873 1.00 0.00 H new ATOM 0 HG3 GLN A 50 -6.617 -2.237 11.751 1.00 0.00 H new ATOM 0 HE21 GLN A 50 -7.428 -3.746 13.324 1.00 0.00 H new ATOM 0 HE22 GLN A 50 -6.354 -4.683 14.368 1.00 0.00 H new ATOM 791 N ILE A 51 -3.503 -0.826 8.383 1.00 0.00 N ATOM 792 CA ILE A 51 -2.316 -0.669 7.496 1.00 0.00 C ATOM 793 C ILE A 51 -2.203 0.793 7.074 1.00 0.00 C ATOM 794 O ILE A 51 -3.077 1.332 6.424 1.00 0.00 O ATOM 795 CB ILE A 51 -2.561 -1.561 6.276 1.00 0.00 C ATOM 796 CG1 ILE A 51 -2.867 -3.002 6.706 1.00 0.00 C ATOM 797 CG2 ILE A 51 -1.311 -1.569 5.403 1.00 0.00 C ATOM 798 CD1 ILE A 51 -2.087 -3.361 7.978 1.00 0.00 C ATOM 0 H ILE A 51 -4.353 -1.158 7.928 1.00 0.00 H new ATOM 0 HA ILE A 51 -1.391 -0.952 7.997 1.00 0.00 H new ATOM 0 HB ILE A 51 -3.414 -1.166 5.725 1.00 0.00 H new ATOM 0 HG12 ILE A 51 -3.936 -3.115 6.884 1.00 0.00 H new ATOM 0 HG13 ILE A 51 -2.603 -3.691 5.904 1.00 0.00 H new ATOM 0 HG21 ILE A 51 -1.479 -2.203 4.532 1.00 0.00 H new ATOM 0 HG22 ILE A 51 -1.090 -0.553 5.075 1.00 0.00 H new ATOM 0 HG23 ILE A 51 -0.469 -1.957 5.977 1.00 0.00 H new ATOM 0 HD11 ILE A 51 -2.316 -4.386 8.268 1.00 0.00 H new ATOM 0 HD12 ILE A 51 -1.018 -3.268 7.787 1.00 0.00 H new ATOM 0 HD13 ILE A 51 -2.372 -2.684 8.783 1.00 0.00 H new ATOM 810 N ASP A 52 -1.141 1.445 7.452 1.00 0.00 N ATOM 811 CA ASP A 52 -0.982 2.876 7.090 1.00 0.00 C ATOM 812 C ASP A 52 -0.528 3.025 5.638 1.00 0.00 C ATOM 813 O ASP A 52 -0.904 3.960 4.963 1.00 0.00 O ATOM 814 CB ASP A 52 0.080 3.406 8.056 1.00 0.00 C ATOM 815 CG ASP A 52 -0.514 3.465 9.464 1.00 0.00 C ATOM 816 OD1 ASP A 52 -1.664 3.085 9.614 1.00 0.00 O ATOM 817 OD2 ASP A 52 0.187 3.886 10.366 1.00 0.00 O ATOM 0 H ASP A 52 -0.376 1.047 7.997 1.00 0.00 H new ATOM 0 HA ASP A 52 -1.919 3.427 7.169 1.00 0.00 H new ATOM 0 HB2 ASP A 52 0.957 2.759 8.044 1.00 0.00 H new ATOM 0 HB3 ASP A 52 0.411 4.397 7.745 1.00 0.00 H new ATOM 822 N CYS A 53 0.281 2.125 5.151 1.00 0.00 N ATOM 823 CA CYS A 53 0.757 2.245 3.741 1.00 0.00 C ATOM 824 C CYS A 53 1.079 0.869 3.154 1.00 0.00 C ATOM 825 O CYS A 53 1.579 -0.003 3.839 1.00 0.00 O ATOM 826 CB CYS A 53 2.037 3.071 3.853 1.00 0.00 C ATOM 827 SG CYS A 53 2.237 4.098 2.378 1.00 0.00 S ATOM 0 H CYS A 53 0.632 1.316 5.663 1.00 0.00 H new ATOM 0 HA CYS A 53 0.008 2.696 3.090 1.00 0.00 H new ATOM 0 HB2 CYS A 53 1.998 3.700 4.742 1.00 0.00 H new ATOM 0 HB3 CYS A 53 2.897 2.411 3.967 1.00 0.00 H new ATOM 0 HG CYS A 53 1.290 3.828 1.529 1.00 0.00 H new ATOM 833 N LEU A 54 0.818 0.665 1.887 1.00 0.00 N ATOM 834 CA LEU A 54 1.147 -0.662 1.287 1.00 0.00 C ATOM 835 C LEU A 54 2.155 -0.493 0.150 1.00 0.00 C ATOM 836 O LEU A 54 1.988 0.335 -0.723 1.00 0.00 O ATOM 837 CB LEU A 54 -0.170 -1.216 0.757 1.00 0.00 C ATOM 838 CG LEU A 54 -0.064 -2.739 0.686 1.00 0.00 C ATOM 839 CD1 LEU A 54 -1.437 -3.337 0.395 1.00 0.00 C ATOM 840 CD2 LEU A 54 0.916 -3.139 -0.421 1.00 0.00 C ATOM 0 H LEU A 54 0.399 1.346 1.253 1.00 0.00 H new ATOM 0 HA LEU A 54 1.597 -1.335 2.017 1.00 0.00 H new ATOM 0 HB2 LEU A 54 -0.993 -0.924 1.409 1.00 0.00 H new ATOM 0 HB3 LEU A 54 -0.384 -0.805 -0.230 1.00 0.00 H new ATOM 0 HG LEU A 54 0.299 -3.117 1.642 1.00 0.00 H new ATOM 0 HD11 LEU A 54 -1.358 -4.423 0.345 1.00 0.00 H new ATOM 0 HD12 LEU A 54 -2.130 -3.060 1.189 1.00 0.00 H new ATOM 0 HD13 LEU A 54 -1.805 -2.956 -0.557 1.00 0.00 H new ATOM 0 HD21 LEU A 54 0.988 -4.226 -0.468 1.00 0.00 H new ATOM 0 HD22 LEU A 54 0.560 -2.757 -1.378 1.00 0.00 H new ATOM 0 HD23 LEU A 54 1.899 -2.719 -0.206 1.00 0.00 H new ATOM 852 N ILE A 55 3.208 -1.266 0.143 1.00 0.00 N ATOM 853 CA ILE A 55 4.210 -1.122 -0.951 1.00 0.00 C ATOM 854 C ILE A 55 3.984 -2.202 -2.000 1.00 0.00 C ATOM 855 O ILE A 55 3.831 -3.364 -1.681 1.00 0.00 O ATOM 856 CB ILE A 55 5.556 -1.317 -0.277 1.00 0.00 C ATOM 857 CG1 ILE A 55 5.626 -0.438 0.964 1.00 0.00 C ATOM 858 CG2 ILE A 55 6.675 -0.926 -1.244 1.00 0.00 C ATOM 859 CD1 ILE A 55 6.897 -0.772 1.728 1.00 0.00 C ATOM 0 H ILE A 55 3.416 -1.982 0.839 1.00 0.00 H new ATOM 0 HA ILE A 55 4.142 -0.158 -1.455 1.00 0.00 H new ATOM 0 HB ILE A 55 5.675 -2.363 0.007 1.00 0.00 H new ATOM 0 HG12 ILE A 55 5.621 0.615 0.682 1.00 0.00 H new ATOM 0 HG13 ILE A 55 4.752 -0.604 1.594 1.00 0.00 H new ATOM 0 HG21 ILE A 55 7.641 -1.066 -0.759 1.00 0.00 H new ATOM 0 HG22 ILE A 55 6.622 -1.552 -2.134 1.00 0.00 H new ATOM 0 HG23 ILE A 55 6.561 0.120 -1.529 1.00 0.00 H new ATOM 0 HD11 ILE A 55 6.960 -0.149 2.620 1.00 0.00 H new ATOM 0 HD12 ILE A 55 6.881 -1.822 2.019 1.00 0.00 H new ATOM 0 HD13 ILE A 55 7.763 -0.585 1.093 1.00 0.00 H new ATOM 871 N LEU A 56 3.952 -1.835 -3.246 1.00 0.00 N ATOM 872 CA LEU A 56 3.723 -2.859 -4.296 1.00 0.00 C ATOM 873 C LEU A 56 4.743 -2.748 -5.419 1.00 0.00 C ATOM 874 O LEU A 56 5.257 -1.689 -5.721 1.00 0.00 O ATOM 875 CB LEU A 56 2.323 -2.579 -4.832 1.00 0.00 C ATOM 876 CG LEU A 56 1.294 -3.048 -3.808 1.00 0.00 C ATOM 877 CD1 LEU A 56 -0.115 -2.878 -4.382 1.00 0.00 C ATOM 878 CD2 LEU A 56 1.546 -4.524 -3.479 1.00 0.00 C ATOM 0 H LEU A 56 4.073 -0.879 -3.581 1.00 0.00 H new ATOM 0 HA LEU A 56 3.822 -3.865 -3.889 1.00 0.00 H new ATOM 0 HB2 LEU A 56 2.201 -1.514 -5.027 1.00 0.00 H new ATOM 0 HB3 LEU A 56 2.173 -3.096 -5.780 1.00 0.00 H new ATOM 0 HG LEU A 56 1.383 -2.453 -2.899 1.00 0.00 H new ATOM 0 HD11 LEU A 56 -0.849 -3.213 -3.650 1.00 0.00 H new ATOM 0 HD12 LEU A 56 -0.289 -1.827 -4.615 1.00 0.00 H new ATOM 0 HD13 LEU A 56 -0.212 -3.472 -5.291 1.00 0.00 H new ATOM 0 HD21 LEU A 56 0.813 -4.864 -2.747 1.00 0.00 H new ATOM 0 HD22 LEU A 56 1.455 -5.120 -4.387 1.00 0.00 H new ATOM 0 HD23 LEU A 56 2.549 -4.639 -3.068 1.00 0.00 H new ATOM 890 N VAL A 57 5.012 -3.843 -6.054 1.00 0.00 N ATOM 891 CA VAL A 57 5.968 -3.835 -7.182 1.00 0.00 C ATOM 892 C VAL A 57 5.218 -4.267 -8.441 1.00 0.00 C ATOM 893 O VAL A 57 4.536 -5.275 -8.449 1.00 0.00 O ATOM 894 CB VAL A 57 7.033 -4.866 -6.805 1.00 0.00 C ATOM 895 CG1 VAL A 57 7.945 -5.134 -8.005 1.00 0.00 C ATOM 896 CG2 VAL A 57 7.871 -4.334 -5.640 1.00 0.00 C ATOM 0 H VAL A 57 4.606 -4.754 -5.838 1.00 0.00 H new ATOM 0 HA VAL A 57 6.415 -2.859 -7.370 1.00 0.00 H new ATOM 0 HB VAL A 57 6.543 -5.794 -6.510 1.00 0.00 H new ATOM 0 HG11 VAL A 57 8.701 -5.869 -7.730 1.00 0.00 H new ATOM 0 HG12 VAL A 57 7.351 -5.517 -8.835 1.00 0.00 H new ATOM 0 HG13 VAL A 57 8.433 -4.207 -8.306 1.00 0.00 H new ATOM 0 HG21 VAL A 57 8.630 -5.069 -5.372 1.00 0.00 H new ATOM 0 HG22 VAL A 57 8.356 -3.404 -5.936 1.00 0.00 H new ATOM 0 HG23 VAL A 57 7.225 -4.150 -4.782 1.00 0.00 H new ATOM 906 N ALA A 58 5.322 -3.520 -9.497 1.00 0.00 N ATOM 907 CA ALA A 58 4.600 -3.900 -10.742 1.00 0.00 C ATOM 908 C ALA A 58 5.461 -4.845 -11.575 1.00 0.00 C ATOM 909 O ALA A 58 5.133 -5.183 -12.695 1.00 0.00 O ATOM 910 CB ALA A 58 4.364 -2.587 -11.481 1.00 0.00 C ATOM 0 H ALA A 58 5.873 -2.664 -9.556 1.00 0.00 H new ATOM 0 HA ALA A 58 3.664 -4.420 -10.539 1.00 0.00 H new ATOM 0 HB1 ALA A 58 3.834 -2.784 -12.413 1.00 0.00 H new ATOM 0 HB2 ALA A 58 3.767 -1.921 -10.858 1.00 0.00 H new ATOM 0 HB3 ALA A 58 5.322 -2.116 -11.701 1.00 0.00 H new ATOM 916 N ALA A 59 6.560 -5.275 -11.030 1.00 0.00 N ATOM 917 CA ALA A 59 7.448 -6.202 -11.774 1.00 0.00 C ATOM 918 C ALA A 59 6.999 -7.643 -11.540 1.00 0.00 C ATOM 919 O ALA A 59 7.635 -8.582 -11.977 1.00 0.00 O ATOM 920 CB ALA A 59 8.828 -5.962 -11.176 1.00 0.00 C ATOM 0 H ALA A 59 6.883 -5.022 -10.096 1.00 0.00 H new ATOM 0 HA ALA A 59 7.434 -6.036 -12.851 1.00 0.00 H new ATOM 0 HB1 ALA A 59 9.555 -6.608 -11.668 1.00 0.00 H new ATOM 0 HB2 ALA A 59 9.112 -4.920 -11.322 1.00 0.00 H new ATOM 0 HB3 ALA A 59 8.806 -6.186 -10.109 1.00 0.00 H new ATOM 926 N ASN A 60 5.906 -7.826 -10.855 1.00 0.00 N ATOM 927 CA ASN A 60 5.422 -9.203 -10.599 1.00 0.00 C ATOM 928 C ASN A 60 4.404 -9.591 -11.676 1.00 0.00 C ATOM 929 O ASN A 60 3.896 -8.746 -12.387 1.00 0.00 O ATOM 930 CB ASN A 60 4.787 -9.139 -9.210 1.00 0.00 C ATOM 931 CG ASN A 60 5.873 -9.345 -8.152 1.00 0.00 C ATOM 932 OD1 ASN A 60 6.575 -10.337 -8.165 1.00 0.00 O ATOM 933 ND2 ASN A 60 6.039 -8.439 -7.228 1.00 0.00 N ATOM 0 H ASN A 60 5.330 -7.081 -10.463 1.00 0.00 H new ATOM 0 HA ASN A 60 6.211 -9.955 -10.633 1.00 0.00 H new ATOM 0 HB2 ASN A 60 4.298 -8.176 -9.064 1.00 0.00 H new ATOM 0 HB3 ASN A 60 4.018 -9.905 -9.113 1.00 0.00 H new ATOM 0 HD21 ASN A 60 6.758 -8.563 -6.516 1.00 0.00 H new ATOM 0 HD22 ASN A 60 5.449 -7.607 -7.218 1.00 0.00 H new ATOM 940 N PRO A 61 4.162 -10.863 -11.778 1.00 0.00 N ATOM 941 CA PRO A 61 3.219 -11.384 -12.800 1.00 0.00 C ATOM 942 C PRO A 61 1.768 -11.013 -12.477 1.00 0.00 C ATOM 943 O PRO A 61 1.226 -10.067 -13.015 1.00 0.00 O ATOM 944 CB PRO A 61 3.430 -12.896 -12.741 1.00 0.00 C ATOM 945 CG PRO A 61 3.973 -13.161 -11.371 1.00 0.00 C ATOM 946 CD PRO A 61 4.736 -11.930 -10.953 1.00 0.00 C ATOM 0 HA PRO A 61 3.403 -10.965 -13.790 1.00 0.00 H new ATOM 0 HB2 PRO A 61 2.495 -13.431 -12.905 1.00 0.00 H new ATOM 0 HB3 PRO A 61 4.126 -13.227 -13.512 1.00 0.00 H new ATOM 0 HG2 PRO A 61 3.165 -13.370 -10.670 1.00 0.00 H new ATOM 0 HG3 PRO A 61 4.624 -14.035 -11.377 1.00 0.00 H new ATOM 0 HD2 PRO A 61 4.611 -11.724 -9.890 1.00 0.00 H new ATOM 0 HD3 PRO A 61 5.805 -12.042 -11.132 1.00 0.00 H new ATOM 954 N SER A 62 1.132 -11.759 -11.623 1.00 0.00 N ATOM 955 CA SER A 62 -0.290 -11.460 -11.286 1.00 0.00 C ATOM 956 C SER A 62 -0.375 -10.449 -10.139 1.00 0.00 C ATOM 957 O SER A 62 -1.264 -10.509 -9.311 1.00 0.00 O ATOM 958 CB SER A 62 -0.883 -12.804 -10.872 1.00 0.00 C ATOM 959 OG SER A 62 -0.034 -13.414 -9.909 1.00 0.00 O ATOM 0 H SER A 62 1.532 -12.564 -11.142 1.00 0.00 H new ATOM 0 HA SER A 62 -0.827 -11.016 -12.124 1.00 0.00 H new ATOM 0 HB2 SER A 62 -1.881 -12.662 -10.457 1.00 0.00 H new ATOM 0 HB3 SER A 62 -0.989 -13.451 -11.742 1.00 0.00 H new ATOM 0 HG SER A 62 -0.412 -14.277 -9.639 1.00 0.00 H new ATOM 965 N PHE A 63 0.535 -9.519 -10.088 1.00 0.00 N ATOM 966 CA PHE A 63 0.501 -8.501 -9.000 1.00 0.00 C ATOM 967 C PHE A 63 -0.801 -7.691 -9.049 1.00 0.00 C ATOM 968 O PHE A 63 -1.427 -7.447 -8.037 1.00 0.00 O ATOM 969 CB PHE A 63 1.728 -7.615 -9.264 1.00 0.00 C ATOM 970 CG PHE A 63 1.451 -6.201 -8.812 1.00 0.00 C ATOM 971 CD1 PHE A 63 1.292 -5.920 -7.453 1.00 0.00 C ATOM 972 CD2 PHE A 63 1.332 -5.180 -9.759 1.00 0.00 C ATOM 973 CE1 PHE A 63 1.013 -4.618 -7.041 1.00 0.00 C ATOM 974 CE2 PHE A 63 1.058 -3.875 -9.348 1.00 0.00 C ATOM 975 CZ PHE A 63 0.896 -3.591 -7.987 1.00 0.00 C ATOM 0 H PHE A 63 1.302 -9.418 -10.753 1.00 0.00 H new ATOM 0 HA PHE A 63 0.530 -8.949 -8.007 1.00 0.00 H new ATOM 0 HB2 PHE A 63 2.594 -8.012 -8.734 1.00 0.00 H new ATOM 0 HB3 PHE A 63 1.972 -7.625 -10.326 1.00 0.00 H new ATOM 0 HD1 PHE A 63 1.385 -6.710 -6.723 1.00 0.00 H new ATOM 0 HD2 PHE A 63 1.452 -5.401 -10.809 1.00 0.00 H new ATOM 0 HE1 PHE A 63 0.887 -4.400 -5.991 1.00 0.00 H new ATOM 0 HE2 PHE A 63 0.971 -3.085 -10.079 1.00 0.00 H new ATOM 0 HZ PHE A 63 0.681 -2.582 -7.667 1.00 0.00 H new ATOM 985 N ARG A 64 -1.204 -7.262 -10.207 1.00 0.00 N ATOM 986 CA ARG A 64 -2.455 -6.463 -10.304 1.00 0.00 C ATOM 987 C ARG A 64 -3.633 -7.251 -9.723 1.00 0.00 C ATOM 988 O ARG A 64 -4.514 -6.694 -9.099 1.00 0.00 O ATOM 989 CB ARG A 64 -2.642 -6.212 -11.798 1.00 0.00 C ATOM 990 CG ARG A 64 -1.931 -4.911 -12.179 1.00 0.00 C ATOM 991 CD ARG A 64 -0.469 -5.202 -12.530 1.00 0.00 C ATOM 992 NE ARG A 64 -0.348 -4.903 -13.985 1.00 0.00 N ATOM 993 CZ ARG A 64 0.754 -5.195 -14.624 1.00 0.00 C ATOM 994 NH1 ARG A 64 1.719 -5.829 -14.017 1.00 0.00 N ATOM 995 NH2 ARG A 64 0.886 -4.873 -15.879 1.00 0.00 N ATOM 0 H ARG A 64 -0.723 -7.429 -11.091 1.00 0.00 H new ATOM 0 HA ARG A 64 -2.402 -5.530 -9.742 1.00 0.00 H new ATOM 0 HB2 ARG A 64 -2.237 -7.045 -12.373 1.00 0.00 H new ATOM 0 HB3 ARG A 64 -3.703 -6.145 -12.038 1.00 0.00 H new ATOM 0 HG2 ARG A 64 -2.433 -4.447 -13.028 1.00 0.00 H new ATOM 0 HG3 ARG A 64 -1.982 -4.202 -11.352 1.00 0.00 H new ATOM 0 HD2 ARG A 64 0.208 -4.581 -11.943 1.00 0.00 H new ATOM 0 HD3 ARG A 64 -0.213 -6.240 -12.319 1.00 0.00 H new ATOM 0 HE ARG A 64 -1.126 -4.470 -14.483 1.00 0.00 H new ATOM 0 HH11 ARG A 64 1.616 -6.099 -13.039 1.00 0.00 H new ATOM 0 HH12 ARG A 64 2.577 -6.054 -14.520 1.00 0.00 H new ATOM 0 HH21 ARG A 64 0.129 -4.392 -16.365 1.00 0.00 H new ATOM 0 HH22 ARG A 64 1.747 -5.102 -16.376 1.00 0.00 H new ATOM 1009 N ALA A 65 -3.649 -8.541 -9.912 1.00 0.00 N ATOM 1010 CA ALA A 65 -4.763 -9.363 -9.354 1.00 0.00 C ATOM 1011 C ALA A 65 -4.702 -9.347 -7.823 1.00 0.00 C ATOM 1012 O ALA A 65 -5.710 -9.302 -7.150 1.00 0.00 O ATOM 1013 CB ALA A 65 -4.517 -10.773 -9.889 1.00 0.00 C ATOM 0 H ALA A 65 -2.940 -9.063 -10.428 1.00 0.00 H new ATOM 0 HA ALA A 65 -5.746 -8.988 -9.640 1.00 0.00 H new ATOM 0 HB1 ALA A 65 -5.296 -11.442 -9.523 1.00 0.00 H new ATOM 0 HB2 ALA A 65 -4.535 -10.757 -10.979 1.00 0.00 H new ATOM 0 HB3 ALA A 65 -3.545 -11.127 -9.547 1.00 0.00 H new ATOM 1019 N VAL A 66 -3.523 -9.373 -7.269 1.00 0.00 N ATOM 1020 CA VAL A 66 -3.391 -9.340 -5.785 1.00 0.00 C ATOM 1021 C VAL A 66 -3.890 -7.993 -5.256 1.00 0.00 C ATOM 1022 O VAL A 66 -4.600 -7.918 -4.265 1.00 0.00 O ATOM 1023 CB VAL A 66 -1.897 -9.471 -5.542 1.00 0.00 C ATOM 1024 CG1 VAL A 66 -1.585 -9.190 -4.071 1.00 0.00 C ATOM 1025 CG2 VAL A 66 -1.434 -10.882 -5.903 1.00 0.00 C ATOM 0 H VAL A 66 -2.642 -9.416 -7.781 1.00 0.00 H new ATOM 0 HA VAL A 66 -3.967 -10.121 -5.289 1.00 0.00 H new ATOM 0 HB VAL A 66 -1.371 -8.749 -6.167 1.00 0.00 H new ATOM 0 HG11 VAL A 66 -0.512 -9.285 -3.902 1.00 0.00 H new ATOM 0 HG12 VAL A 66 -1.904 -8.179 -3.818 1.00 0.00 H new ATOM 0 HG13 VAL A 66 -2.116 -9.905 -3.443 1.00 0.00 H new ATOM 0 HG21 VAL A 66 -0.362 -10.969 -5.727 1.00 0.00 H new ATOM 0 HG22 VAL A 66 -1.964 -11.608 -5.286 1.00 0.00 H new ATOM 0 HG23 VAL A 66 -1.646 -11.077 -6.954 1.00 0.00 H new ATOM 1035 N VAL A 67 -3.523 -6.925 -5.913 1.00 0.00 N ATOM 1036 CA VAL A 67 -3.978 -5.585 -5.451 1.00 0.00 C ATOM 1037 C VAL A 67 -5.501 -5.517 -5.517 1.00 0.00 C ATOM 1038 O VAL A 67 -6.151 -5.015 -4.622 1.00 0.00 O ATOM 1039 CB VAL A 67 -3.371 -4.571 -6.423 1.00 0.00 C ATOM 1040 CG1 VAL A 67 -3.446 -3.176 -5.802 1.00 0.00 C ATOM 1041 CG2 VAL A 67 -1.910 -4.919 -6.706 1.00 0.00 C ATOM 0 H VAL A 67 -2.932 -6.924 -6.744 1.00 0.00 H new ATOM 0 HA VAL A 67 -3.671 -5.385 -4.424 1.00 0.00 H new ATOM 0 HB VAL A 67 -3.929 -4.595 -7.359 1.00 0.00 H new ATOM 0 HG11 VAL A 67 -3.015 -2.448 -6.489 1.00 0.00 H new ATOM 0 HG12 VAL A 67 -4.488 -2.920 -5.608 1.00 0.00 H new ATOM 0 HG13 VAL A 67 -2.889 -3.164 -4.865 1.00 0.00 H new ATOM 0 HG21 VAL A 67 -1.490 -4.190 -7.399 1.00 0.00 H new ATOM 0 HG22 VAL A 67 -1.345 -4.902 -5.774 1.00 0.00 H new ATOM 0 HG23 VAL A 67 -1.852 -5.914 -7.147 1.00 0.00 H new ATOM 1051 N GLN A 68 -6.076 -6.024 -6.574 1.00 0.00 N ATOM 1052 CA GLN A 68 -7.557 -5.993 -6.700 1.00 0.00 C ATOM 1053 C GLN A 68 -8.181 -6.757 -5.527 1.00 0.00 C ATOM 1054 O GLN A 68 -9.208 -6.378 -4.999 1.00 0.00 O ATOM 1055 CB GLN A 68 -7.847 -6.662 -8.058 1.00 0.00 C ATOM 1056 CG GLN A 68 -8.288 -8.119 -7.869 1.00 0.00 C ATOM 1057 CD GLN A 68 -8.209 -8.866 -9.205 1.00 0.00 C ATOM 1058 OE1 GLN A 68 -8.013 -8.199 -10.311 1.00 0.00 O flip ATOM 1059 NE2 GLN A 68 -8.331 -10.075 -9.241 1.00 0.00 N flip ATOM 0 H GLN A 68 -5.582 -6.458 -7.354 1.00 0.00 H new ATOM 0 HA GLN A 68 -7.979 -4.989 -6.667 1.00 0.00 H new ATOM 0 HB2 GLN A 68 -8.626 -6.108 -8.582 1.00 0.00 H new ATOM 0 HB3 GLN A 68 -6.955 -6.626 -8.683 1.00 0.00 H new ATOM 0 HG2 GLN A 68 -7.652 -8.608 -7.131 1.00 0.00 H new ATOM 0 HG3 GLN A 68 -9.307 -8.152 -7.483 1.00 0.00 H new ATOM 0 HE21 GLN A 68 -8.484 -10.598 -8.379 1.00 0.00 H new ATOM 0 HE22 GLN A 68 -8.280 -10.566 -10.133 1.00 0.00 H new ATOM 1068 N GLN A 69 -7.553 -7.822 -5.102 1.00 0.00 N ATOM 1069 CA GLN A 69 -8.101 -8.592 -3.954 1.00 0.00 C ATOM 1070 C GLN A 69 -8.179 -7.682 -2.727 1.00 0.00 C ATOM 1071 O GLN A 69 -9.151 -7.693 -1.997 1.00 0.00 O ATOM 1072 CB GLN A 69 -7.113 -9.738 -3.733 1.00 0.00 C ATOM 1073 CG GLN A 69 -7.680 -10.711 -2.695 1.00 0.00 C ATOM 1074 CD GLN A 69 -8.865 -11.475 -3.288 1.00 0.00 C ATOM 1075 OE1 GLN A 69 -8.837 -11.870 -4.437 1.00 0.00 O ATOM 1076 NE2 GLN A 69 -9.913 -11.703 -2.543 1.00 0.00 N ATOM 0 H GLN A 69 -6.688 -8.188 -5.500 1.00 0.00 H new ATOM 0 HA GLN A 69 -9.107 -8.971 -4.136 1.00 0.00 H new ATOM 0 HB2 GLN A 69 -6.929 -10.259 -4.672 1.00 0.00 H new ATOM 0 HB3 GLN A 69 -6.155 -9.345 -3.393 1.00 0.00 H new ATOM 0 HG2 GLN A 69 -6.906 -11.411 -2.380 1.00 0.00 H new ATOM 0 HG3 GLN A 69 -7.997 -10.164 -1.807 1.00 0.00 H new ATOM 0 HE21 GLN A 69 -9.935 -11.371 -1.579 1.00 0.00 H new ATOM 0 HE22 GLN A 69 -10.709 -12.213 -2.925 1.00 0.00 H new ATOM 1085 N LEU A 70 -7.178 -6.867 -2.504 1.00 0.00 N ATOM 1086 CA LEU A 70 -7.237 -5.944 -1.335 1.00 0.00 C ATOM 1087 C LEU A 70 -8.486 -5.064 -1.471 1.00 0.00 C ATOM 1088 O LEU A 70 -9.273 -4.936 -0.555 1.00 0.00 O ATOM 1089 CB LEU A 70 -5.960 -5.099 -1.413 1.00 0.00 C ATOM 1090 CG LEU A 70 -4.833 -5.787 -0.629 1.00 0.00 C ATOM 1091 CD1 LEU A 70 -3.617 -5.971 -1.534 1.00 0.00 C ATOM 1092 CD2 LEU A 70 -4.433 -4.919 0.567 1.00 0.00 C ATOM 0 H LEU A 70 -6.334 -6.802 -3.074 1.00 0.00 H new ATOM 0 HA LEU A 70 -7.297 -6.467 -0.380 1.00 0.00 H new ATOM 0 HB2 LEU A 70 -5.663 -4.967 -2.453 1.00 0.00 H new ATOM 0 HB3 LEU A 70 -6.145 -4.105 -1.005 1.00 0.00 H new ATOM 0 HG LEU A 70 -5.184 -6.758 -0.279 1.00 0.00 H new ATOM 0 HD11 LEU A 70 -2.818 -6.459 -0.976 1.00 0.00 H new ATOM 0 HD12 LEU A 70 -3.891 -6.588 -2.390 1.00 0.00 H new ATOM 0 HD13 LEU A 70 -3.273 -4.998 -1.883 1.00 0.00 H new ATOM 0 HD21 LEU A 70 -3.633 -5.410 1.121 1.00 0.00 H new ATOM 0 HD22 LEU A 70 -4.086 -3.948 0.212 1.00 0.00 H new ATOM 0 HD23 LEU A 70 -5.295 -4.780 1.220 1.00 0.00 H new ATOM 1104 N CYS A 71 -8.681 -4.478 -2.623 1.00 0.00 N ATOM 1105 CA CYS A 71 -9.892 -3.630 -2.835 1.00 0.00 C ATOM 1106 C CYS A 71 -11.146 -4.501 -2.750 1.00 0.00 C ATOM 1107 O CYS A 71 -12.175 -4.085 -2.259 1.00 0.00 O ATOM 1108 CB CYS A 71 -9.746 -3.068 -4.246 1.00 0.00 C ATOM 1109 SG CYS A 71 -8.381 -1.882 -4.299 1.00 0.00 S ATOM 0 H CYS A 71 -8.055 -4.549 -3.425 1.00 0.00 H new ATOM 0 HA CYS A 71 -9.981 -2.841 -2.089 1.00 0.00 H new ATOM 0 HB2 CYS A 71 -9.563 -3.878 -4.952 1.00 0.00 H new ATOM 0 HB3 CYS A 71 -10.673 -2.582 -4.551 1.00 0.00 H new ATOM 0 HG CYS A 71 -7.353 -2.376 -3.676 1.00 0.00 H new ATOM 1115 N PHE A 72 -11.060 -5.711 -3.236 1.00 0.00 N ATOM 1116 CA PHE A 72 -12.238 -6.626 -3.200 1.00 0.00 C ATOM 1117 C PHE A 72 -12.766 -6.745 -1.767 1.00 0.00 C ATOM 1118 O PHE A 72 -13.958 -6.764 -1.537 1.00 0.00 O ATOM 1119 CB PHE A 72 -11.703 -7.970 -3.699 1.00 0.00 C ATOM 1120 CG PHE A 72 -12.848 -8.942 -3.875 1.00 0.00 C ATOM 1121 CD1 PHE A 72 -13.380 -9.611 -2.767 1.00 0.00 C ATOM 1122 CD2 PHE A 72 -13.381 -9.170 -5.151 1.00 0.00 C ATOM 1123 CE1 PHE A 72 -14.443 -10.507 -2.933 1.00 0.00 C ATOM 1124 CE2 PHE A 72 -14.444 -10.067 -5.317 1.00 0.00 C ATOM 1125 CZ PHE A 72 -14.975 -10.736 -4.209 1.00 0.00 C ATOM 0 H PHE A 72 -10.220 -6.107 -3.658 1.00 0.00 H new ATOM 0 HA PHE A 72 -13.067 -6.268 -3.811 1.00 0.00 H new ATOM 0 HB2 PHE A 72 -11.179 -7.835 -4.645 1.00 0.00 H new ATOM 0 HB3 PHE A 72 -10.980 -8.370 -2.989 1.00 0.00 H new ATOM 0 HD1 PHE A 72 -12.970 -9.436 -1.783 1.00 0.00 H new ATOM 0 HD2 PHE A 72 -12.972 -8.654 -6.007 1.00 0.00 H new ATOM 0 HE1 PHE A 72 -14.853 -11.022 -2.077 1.00 0.00 H new ATOM 0 HE2 PHE A 72 -14.854 -10.242 -6.301 1.00 0.00 H new ATOM 0 HZ PHE A 72 -15.794 -11.428 -4.337 1.00 0.00 H new ATOM 1135 N GLU A 73 -11.889 -6.816 -0.801 1.00 0.00 N ATOM 1136 CA GLU A 73 -12.348 -6.919 0.613 1.00 0.00 C ATOM 1137 C GLU A 73 -12.534 -5.520 1.201 1.00 0.00 C ATOM 1138 O GLU A 73 -13.129 -5.349 2.246 1.00 0.00 O ATOM 1139 CB GLU A 73 -11.234 -7.657 1.348 1.00 0.00 C ATOM 1140 CG GLU A 73 -10.869 -8.920 0.569 1.00 0.00 C ATOM 1141 CD GLU A 73 -10.908 -10.132 1.504 1.00 0.00 C ATOM 1142 OE1 GLU A 73 -11.254 -9.954 2.661 1.00 0.00 O ATOM 1143 OE2 GLU A 73 -10.594 -11.215 1.046 1.00 0.00 O ATOM 0 H GLU A 73 -10.877 -6.807 -0.930 1.00 0.00 H new ATOM 0 HA GLU A 73 -13.302 -7.439 0.699 1.00 0.00 H new ATOM 0 HB2 GLU A 73 -10.360 -7.013 1.450 1.00 0.00 H new ATOM 0 HB3 GLU A 73 -11.557 -7.918 2.356 1.00 0.00 H new ATOM 0 HG2 GLU A 73 -11.565 -9.063 -0.257 1.00 0.00 H new ATOM 0 HG3 GLU A 73 -9.875 -8.816 0.134 1.00 0.00 H new ATOM 1150 N GLY A 74 -12.035 -4.515 0.532 1.00 0.00 N ATOM 1151 CA GLY A 74 -12.192 -3.127 1.047 1.00 0.00 C ATOM 1152 C GLY A 74 -10.878 -2.625 1.651 1.00 0.00 C ATOM 1153 O GLY A 74 -10.835 -1.573 2.258 1.00 0.00 O ATOM 0 H GLY A 74 -11.526 -4.597 -0.348 1.00 0.00 H new ATOM 0 HA2 GLY A 74 -12.503 -2.466 0.238 1.00 0.00 H new ATOM 0 HA3 GLY A 74 -12.979 -3.100 1.801 1.00 0.00 H new ATOM 1157 N VAL A 75 -9.799 -3.346 1.495 1.00 0.00 N ATOM 1158 CA VAL A 75 -8.516 -2.855 2.075 1.00 0.00 C ATOM 1159 C VAL A 75 -7.930 -1.764 1.185 1.00 0.00 C ATOM 1160 O VAL A 75 -7.277 -2.035 0.198 1.00 0.00 O ATOM 1161 CB VAL A 75 -7.569 -4.054 2.125 1.00 0.00 C ATOM 1162 CG1 VAL A 75 -6.329 -3.675 2.941 1.00 0.00 C ATOM 1163 CG2 VAL A 75 -8.263 -5.239 2.792 1.00 0.00 C ATOM 0 H VAL A 75 -9.750 -4.237 1.001 1.00 0.00 H new ATOM 0 HA VAL A 75 -8.668 -2.434 3.069 1.00 0.00 H new ATOM 0 HB VAL A 75 -7.282 -4.331 1.110 1.00 0.00 H new ATOM 0 HG11 VAL A 75 -5.647 -4.524 2.982 1.00 0.00 H new ATOM 0 HG12 VAL A 75 -5.828 -2.830 2.470 1.00 0.00 H new ATOM 0 HG13 VAL A 75 -6.629 -3.401 3.952 1.00 0.00 H new ATOM 0 HG21 VAL A 75 -7.581 -6.089 2.824 1.00 0.00 H new ATOM 0 HG22 VAL A 75 -8.552 -4.967 3.807 1.00 0.00 H new ATOM 0 HG23 VAL A 75 -9.152 -5.508 2.222 1.00 0.00 H new ATOM 1173 N VAL A 76 -8.153 -0.529 1.529 1.00 0.00 N ATOM 1174 CA VAL A 76 -7.602 0.576 0.702 1.00 0.00 C ATOM 1175 C VAL A 76 -6.609 1.392 1.534 1.00 0.00 C ATOM 1176 O VAL A 76 -6.913 1.847 2.619 1.00 0.00 O ATOM 1177 CB VAL A 76 -8.807 1.427 0.300 1.00 0.00 C ATOM 1178 CG1 VAL A 76 -8.429 2.314 -0.889 1.00 0.00 C ATOM 1179 CG2 VAL A 76 -9.973 0.520 -0.108 1.00 0.00 C ATOM 0 H VAL A 76 -8.691 -0.237 2.345 1.00 0.00 H new ATOM 0 HA VAL A 76 -7.067 0.213 -0.176 1.00 0.00 H new ATOM 0 HB VAL A 76 -9.105 2.045 1.147 1.00 0.00 H new ATOM 0 HG11 VAL A 76 -9.287 2.921 -1.177 1.00 0.00 H new ATOM 0 HG12 VAL A 76 -7.601 2.965 -0.608 1.00 0.00 H new ATOM 0 HG13 VAL A 76 -8.129 1.688 -1.729 1.00 0.00 H new ATOM 0 HG21 VAL A 76 -10.828 1.133 -0.393 1.00 0.00 H new ATOM 0 HG22 VAL A 76 -9.673 -0.100 -0.953 1.00 0.00 H new ATOM 0 HG23 VAL A 76 -10.248 -0.119 0.731 1.00 0.00 H new ATOM 1189 N VAL A 77 -5.421 1.566 1.034 1.00 0.00 N ATOM 1190 CA VAL A 77 -4.390 2.336 1.788 1.00 0.00 C ATOM 1191 C VAL A 77 -3.499 3.092 0.817 1.00 0.00 C ATOM 1192 O VAL A 77 -3.481 2.793 -0.356 1.00 0.00 O ATOM 1193 CB VAL A 77 -3.541 1.281 2.500 1.00 0.00 C ATOM 1194 CG1 VAL A 77 -4.241 0.811 3.772 1.00 0.00 C ATOM 1195 CG2 VAL A 77 -3.311 0.089 1.551 1.00 0.00 C ATOM 0 H VAL A 77 -5.115 1.207 0.130 1.00 0.00 H new ATOM 0 HA VAL A 77 -4.844 3.051 2.474 1.00 0.00 H new ATOM 0 HB VAL A 77 -2.580 1.717 2.775 1.00 0.00 H new ATOM 0 HG11 VAL A 77 -3.627 0.060 4.269 1.00 0.00 H new ATOM 0 HG12 VAL A 77 -4.389 1.659 4.440 1.00 0.00 H new ATOM 0 HG13 VAL A 77 -5.208 0.377 3.516 1.00 0.00 H new ATOM 0 HG21 VAL A 77 -2.706 -0.665 2.054 1.00 0.00 H new ATOM 0 HG22 VAL A 77 -4.271 -0.344 1.271 1.00 0.00 H new ATOM 0 HG23 VAL A 77 -2.792 0.432 0.656 1.00 0.00 H new ATOM 1205 N PRO A 78 -2.740 4.009 1.341 1.00 0.00 N ATOM 1206 CA PRO A 78 -1.798 4.753 0.486 1.00 0.00 C ATOM 1207 C PRO A 78 -0.759 3.766 -0.016 1.00 0.00 C ATOM 1208 O PRO A 78 0.250 3.527 0.611 1.00 0.00 O ATOM 1209 CB PRO A 78 -1.196 5.793 1.420 1.00 0.00 C ATOM 1210 CG PRO A 78 -1.386 5.229 2.787 1.00 0.00 C ATOM 1211 CD PRO A 78 -2.663 4.425 2.740 1.00 0.00 C ATOM 0 HA PRO A 78 -2.244 5.230 -0.387 1.00 0.00 H new ATOM 0 HB2 PRO A 78 -0.141 5.957 1.202 1.00 0.00 H new ATOM 0 HB3 PRO A 78 -1.696 6.756 1.316 1.00 0.00 H new ATOM 0 HG2 PRO A 78 -0.541 4.601 3.069 1.00 0.00 H new ATOM 0 HG3 PRO A 78 -1.454 6.024 3.530 1.00 0.00 H new ATOM 0 HD2 PRO A 78 -2.626 3.569 3.414 1.00 0.00 H new ATOM 0 HD3 PRO A 78 -3.527 5.023 3.031 1.00 0.00 H new ATOM 1219 N ALA A 79 -1.035 3.150 -1.122 1.00 0.00 N ATOM 1220 CA ALA A 79 -0.104 2.129 -1.654 1.00 0.00 C ATOM 1221 C ALA A 79 0.873 2.738 -2.660 1.00 0.00 C ATOM 1222 O ALA A 79 0.482 3.329 -3.646 1.00 0.00 O ATOM 1223 CB ALA A 79 -1.022 1.109 -2.325 1.00 0.00 C ATOM 0 H ALA A 79 -1.871 3.310 -1.684 1.00 0.00 H new ATOM 0 HA ALA A 79 0.518 1.686 -0.876 1.00 0.00 H new ATOM 0 HB1 ALA A 79 -0.422 0.306 -2.753 1.00 0.00 H new ATOM 0 HB2 ALA A 79 -1.708 0.695 -1.586 1.00 0.00 H new ATOM 0 HB3 ALA A 79 -1.592 1.597 -3.115 1.00 0.00 H new ATOM 1229 N ILE A 80 2.146 2.577 -2.419 1.00 0.00 N ATOM 1230 CA ILE A 80 3.161 3.119 -3.363 1.00 0.00 C ATOM 1231 C ILE A 80 3.571 1.999 -4.322 1.00 0.00 C ATOM 1232 O ILE A 80 3.971 0.929 -3.906 1.00 0.00 O ATOM 1233 CB ILE A 80 4.334 3.559 -2.486 1.00 0.00 C ATOM 1234 CG1 ILE A 80 3.803 4.422 -1.335 1.00 0.00 C ATOM 1235 CG2 ILE A 80 5.315 4.383 -3.326 1.00 0.00 C ATOM 1236 CD1 ILE A 80 4.883 4.564 -0.261 1.00 0.00 C ATOM 0 H ILE A 80 2.526 2.092 -1.606 1.00 0.00 H new ATOM 0 HA ILE A 80 2.797 3.953 -3.963 1.00 0.00 H new ATOM 0 HB ILE A 80 4.844 2.683 -2.086 1.00 0.00 H new ATOM 0 HG12 ILE A 80 3.514 5.405 -1.707 1.00 0.00 H new ATOM 0 HG13 ILE A 80 2.909 3.967 -0.908 1.00 0.00 H new ATOM 0 HG21 ILE A 80 6.152 4.698 -2.703 1.00 0.00 H new ATOM 0 HG22 ILE A 80 5.686 3.776 -4.152 1.00 0.00 H new ATOM 0 HG23 ILE A 80 4.806 5.262 -3.721 1.00 0.00 H new ATOM 0 HD11 ILE A 80 4.505 5.178 0.557 1.00 0.00 H new ATOM 0 HD12 ILE A 80 5.150 3.578 0.119 1.00 0.00 H new ATOM 0 HD13 ILE A 80 5.765 5.038 -0.692 1.00 0.00 H new ATOM 1248 N VAL A 81 3.444 2.218 -5.598 1.00 0.00 N ATOM 1249 CA VAL A 81 3.792 1.146 -6.573 1.00 0.00 C ATOM 1250 C VAL A 81 5.166 1.387 -7.198 1.00 0.00 C ATOM 1251 O VAL A 81 5.539 2.502 -7.507 1.00 0.00 O ATOM 1252 CB VAL A 81 2.695 1.221 -7.631 1.00 0.00 C ATOM 1253 CG1 VAL A 81 2.955 0.169 -8.711 1.00 0.00 C ATOM 1254 CG2 VAL A 81 1.333 0.966 -6.971 1.00 0.00 C ATOM 0 H VAL A 81 3.115 3.091 -6.010 1.00 0.00 H new ATOM 0 HA VAL A 81 3.849 0.166 -6.099 1.00 0.00 H new ATOM 0 HB VAL A 81 2.693 2.210 -8.088 1.00 0.00 H new ATOM 0 HG11 VAL A 81 2.172 0.222 -9.467 1.00 0.00 H new ATOM 0 HG12 VAL A 81 3.922 0.357 -9.177 1.00 0.00 H new ATOM 0 HG13 VAL A 81 2.957 -0.823 -8.260 1.00 0.00 H new ATOM 0 HG21 VAL A 81 0.548 1.019 -7.725 1.00 0.00 H new ATOM 0 HG22 VAL A 81 1.330 -0.023 -6.513 1.00 0.00 H new ATOM 0 HG23 VAL A 81 1.153 1.721 -6.206 1.00 0.00 H new ATOM 1264 N VAL A 82 5.922 0.340 -7.381 1.00 0.00 N ATOM 1265 CA VAL A 82 7.280 0.485 -7.982 1.00 0.00 C ATOM 1266 C VAL A 82 7.329 -0.180 -9.360 1.00 0.00 C ATOM 1267 O VAL A 82 6.622 -1.130 -9.626 1.00 0.00 O ATOM 1268 CB VAL A 82 8.217 -0.246 -7.020 1.00 0.00 C ATOM 1269 CG1 VAL A 82 9.666 0.157 -7.304 1.00 0.00 C ATOM 1270 CG2 VAL A 82 7.862 0.126 -5.583 1.00 0.00 C ATOM 0 H VAL A 82 5.657 -0.615 -7.139 1.00 0.00 H new ATOM 0 HA VAL A 82 7.555 1.531 -8.119 1.00 0.00 H new ATOM 0 HB VAL A 82 8.106 -1.322 -7.158 1.00 0.00 H new ATOM 0 HG11 VAL A 82 10.331 -0.366 -6.616 1.00 0.00 H new ATOM 0 HG12 VAL A 82 9.923 -0.108 -8.329 1.00 0.00 H new ATOM 0 HG13 VAL A 82 9.778 1.233 -7.169 1.00 0.00 H new ATOM 0 HG21 VAL A 82 8.530 -0.395 -4.897 1.00 0.00 H new ATOM 0 HG22 VAL A 82 7.971 1.202 -5.448 1.00 0.00 H new ATOM 0 HG23 VAL A 82 6.832 -0.163 -5.376 1.00 0.00 H new ATOM 1280 N GLY A 83 8.174 0.303 -10.229 1.00 0.00 N ATOM 1281 CA GLY A 83 8.286 -0.315 -11.580 1.00 0.00 C ATOM 1282 C GLY A 83 7.186 0.200 -12.513 1.00 0.00 C ATOM 1283 O GLY A 83 6.671 -0.534 -13.332 1.00 0.00 O ATOM 0 H GLY A 83 8.791 1.098 -10.062 1.00 0.00 H new ATOM 0 HA2 GLY A 83 9.264 -0.091 -12.006 1.00 0.00 H new ATOM 0 HA3 GLY A 83 8.217 -1.399 -11.494 1.00 0.00 H new ATOM 1287 N ASP A 84 6.827 1.454 -12.417 1.00 0.00 N ATOM 1288 CA ASP A 84 5.771 1.985 -13.332 1.00 0.00 C ATOM 1289 C ASP A 84 6.362 2.202 -14.728 1.00 0.00 C ATOM 1290 O ASP A 84 7.562 2.144 -14.916 1.00 0.00 O ATOM 1291 CB ASP A 84 5.323 3.314 -12.720 1.00 0.00 C ATOM 1292 CG ASP A 84 6.474 4.322 -12.763 1.00 0.00 C ATOM 1293 OD1 ASP A 84 7.598 3.902 -12.967 1.00 0.00 O ATOM 1294 OD2 ASP A 84 6.208 5.500 -12.590 1.00 0.00 O ATOM 0 H ASP A 84 7.213 2.126 -11.754 1.00 0.00 H new ATOM 0 HA ASP A 84 4.932 1.298 -13.437 1.00 0.00 H new ATOM 0 HB2 ASP A 84 4.465 3.705 -13.267 1.00 0.00 H new ATOM 0 HB3 ASP A 84 5.001 3.160 -11.690 1.00 0.00 H new ATOM 1299 N ARG A 85 5.535 2.444 -15.711 1.00 0.00 N ATOM 1300 CA ARG A 85 6.062 2.652 -17.092 1.00 0.00 C ATOM 1301 C ARG A 85 5.772 4.069 -17.580 1.00 0.00 C ATOM 1302 O ARG A 85 4.939 4.771 -17.038 1.00 0.00 O ATOM 1303 CB ARG A 85 5.313 1.649 -17.966 1.00 0.00 C ATOM 1304 CG ARG A 85 5.768 0.233 -17.630 1.00 0.00 C ATOM 1305 CD ARG A 85 5.187 -0.728 -18.665 1.00 0.00 C ATOM 1306 NE ARG A 85 3.873 -1.155 -18.104 1.00 0.00 N ATOM 1307 CZ ARG A 85 3.307 -2.258 -18.517 1.00 0.00 C ATOM 1308 NH1 ARG A 85 3.891 -2.996 -19.427 1.00 0.00 N ATOM 1309 NH2 ARG A 85 2.154 -2.622 -18.019 1.00 0.00 N ATOM 0 H ARG A 85 4.521 2.506 -15.618 1.00 0.00 H new ATOM 0 HA ARG A 85 7.143 2.514 -17.127 1.00 0.00 H new ATOM 0 HB2 ARG A 85 4.239 1.744 -17.806 1.00 0.00 H new ATOM 0 HB3 ARG A 85 5.498 1.860 -19.019 1.00 0.00 H new ATOM 0 HG2 ARG A 85 6.857 0.176 -17.631 1.00 0.00 H new ATOM 0 HG3 ARG A 85 5.435 -0.043 -16.629 1.00 0.00 H new ATOM 0 HD2 ARG A 85 5.063 -0.239 -19.631 1.00 0.00 H new ATOM 0 HD3 ARG A 85 5.845 -1.583 -18.822 1.00 0.00 H new ATOM 0 HE ARG A 85 3.414 -0.584 -17.395 1.00 0.00 H new ATOM 0 HH11 ARG A 85 4.790 -2.710 -19.815 1.00 0.00 H new ATOM 0 HH12 ARG A 85 3.447 -3.857 -19.748 1.00 0.00 H new ATOM 0 HH21 ARG A 85 1.700 -2.046 -17.311 1.00 0.00 H new ATOM 0 HH22 ARG A 85 1.709 -3.482 -18.339 1.00 0.00 H new ATOM 1323 N ASP A 86 6.446 4.482 -18.613 1.00 0.00 N ATOM 1324 CA ASP A 86 6.214 5.844 -19.161 1.00 0.00 C ATOM 1325 C ASP A 86 5.275 5.761 -20.364 1.00 0.00 C ATOM 1326 O ASP A 86 5.142 6.698 -21.125 1.00 0.00 O ATOM 1327 CB ASP A 86 7.593 6.344 -19.589 1.00 0.00 C ATOM 1328 CG ASP A 86 8.207 7.168 -18.457 1.00 0.00 C ATOM 1329 OD1 ASP A 86 7.454 7.642 -17.621 1.00 0.00 O ATOM 1330 OD2 ASP A 86 9.418 7.312 -18.444 1.00 0.00 O ATOM 0 H ASP A 86 7.151 3.932 -19.104 1.00 0.00 H new ATOM 0 HA ASP A 86 5.752 6.513 -18.435 1.00 0.00 H new ATOM 0 HB2 ASP A 86 8.239 5.500 -19.831 1.00 0.00 H new ATOM 0 HB3 ASP A 86 7.509 6.950 -20.491 1.00 0.00 H new ATOM 1335 N SER A 87 4.623 4.643 -20.544 1.00 0.00 N ATOM 1336 CA SER A 87 3.698 4.506 -21.702 1.00 0.00 C ATOM 1337 C SER A 87 2.692 5.658 -21.694 1.00 0.00 C ATOM 1338 O SER A 87 1.904 5.805 -20.781 1.00 0.00 O ATOM 1339 CB SER A 87 2.993 3.166 -21.498 1.00 0.00 C ATOM 1340 OG SER A 87 2.004 3.303 -20.486 1.00 0.00 O ATOM 0 H SER A 87 4.692 3.823 -19.941 1.00 0.00 H new ATOM 0 HA SER A 87 4.218 4.539 -22.659 1.00 0.00 H new ATOM 0 HB2 SER A 87 2.533 2.839 -22.430 1.00 0.00 H new ATOM 0 HB3 SER A 87 3.716 2.401 -21.214 1.00 0.00 H new ATOM 0 HG SER A 87 1.983 4.231 -20.172 1.00 0.00 H new ATOM 1346 N GLU A 88 2.724 6.482 -22.701 1.00 0.00 N ATOM 1347 CA GLU A 88 1.789 7.634 -22.754 1.00 0.00 C ATOM 1348 C GLU A 88 0.487 7.248 -23.464 1.00 0.00 C ATOM 1349 O GLU A 88 -0.350 8.085 -23.741 1.00 0.00 O ATOM 1350 CB GLU A 88 2.547 8.703 -23.541 1.00 0.00 C ATOM 1351 CG GLU A 88 2.740 8.240 -24.986 1.00 0.00 C ATOM 1352 CD GLU A 88 4.236 8.157 -25.302 1.00 0.00 C ATOM 1353 OE1 GLU A 88 4.989 8.915 -24.714 1.00 0.00 O ATOM 1354 OE2 GLU A 88 4.601 7.337 -26.127 1.00 0.00 O ATOM 0 H GLU A 88 3.362 6.406 -23.493 1.00 0.00 H new ATOM 0 HA GLU A 88 1.498 7.980 -21.762 1.00 0.00 H new ATOM 0 HB2 GLU A 88 1.995 9.643 -23.521 1.00 0.00 H new ATOM 0 HB3 GLU A 88 3.515 8.892 -23.077 1.00 0.00 H new ATOM 0 HG2 GLU A 88 2.272 7.266 -25.132 1.00 0.00 H new ATOM 0 HG3 GLU A 88 2.251 8.934 -25.670 1.00 0.00 H new ATOM 1361 N ASP A 89 0.299 5.989 -23.756 1.00 0.00 N ATOM 1362 CA ASP A 89 -0.961 5.569 -24.440 1.00 0.00 C ATOM 1363 C ASP A 89 -2.142 5.688 -23.472 1.00 0.00 C ATOM 1364 O ASP A 89 -2.006 5.427 -22.292 1.00 0.00 O ATOM 1365 CB ASP A 89 -0.750 4.107 -24.837 1.00 0.00 C ATOM 1366 CG ASP A 89 0.329 4.009 -25.918 1.00 0.00 C ATOM 1367 OD1 ASP A 89 0.081 4.472 -27.019 1.00 0.00 O ATOM 1368 OD2 ASP A 89 1.381 3.463 -25.628 1.00 0.00 O ATOM 0 H ASP A 89 0.957 5.237 -23.553 1.00 0.00 H new ATOM 0 HA ASP A 89 -1.181 6.192 -25.307 1.00 0.00 H new ATOM 0 HB2 ASP A 89 -0.456 3.523 -23.964 1.00 0.00 H new ATOM 0 HB3 ASP A 89 -1.684 3.683 -25.205 1.00 0.00 H new ATOM 1373 N PRO A 90 -3.265 6.078 -24.008 1.00 0.00 N ATOM 1374 CA PRO A 90 -4.486 6.234 -23.184 1.00 0.00 C ATOM 1375 C PRO A 90 -5.116 4.869 -22.877 1.00 0.00 C ATOM 1376 O PRO A 90 -5.804 4.706 -21.891 1.00 0.00 O ATOM 1377 CB PRO A 90 -5.399 7.082 -24.062 1.00 0.00 C ATOM 1378 CG PRO A 90 -4.941 6.841 -25.468 1.00 0.00 C ATOM 1379 CD PRO A 90 -3.498 6.408 -25.417 1.00 0.00 C ATOM 0 HA PRO A 90 -4.293 6.691 -22.213 1.00 0.00 H new ATOM 0 HB2 PRO A 90 -6.443 6.795 -23.935 1.00 0.00 H new ATOM 0 HB3 PRO A 90 -5.325 8.138 -23.801 1.00 0.00 H new ATOM 0 HG2 PRO A 90 -5.553 6.074 -25.943 1.00 0.00 H new ATOM 0 HG3 PRO A 90 -5.047 7.747 -26.064 1.00 0.00 H new ATOM 0 HD2 PRO A 90 -3.319 5.547 -26.061 1.00 0.00 H new ATOM 0 HD3 PRO A 90 -2.833 7.203 -25.754 1.00 0.00 H new ATOM 1387 N ASP A 91 -4.884 3.891 -23.709 1.00 0.00 N ATOM 1388 CA ASP A 91 -5.472 2.542 -23.453 1.00 0.00 C ATOM 1389 C ASP A 91 -4.783 1.889 -22.251 1.00 0.00 C ATOM 1390 O ASP A 91 -5.241 0.896 -21.720 1.00 0.00 O ATOM 1391 CB ASP A 91 -5.205 1.741 -24.727 1.00 0.00 C ATOM 1392 CG ASP A 91 -5.857 2.446 -25.918 1.00 0.00 C ATOM 1393 OD1 ASP A 91 -6.363 3.539 -25.730 1.00 0.00 O ATOM 1394 OD2 ASP A 91 -5.838 1.882 -27.000 1.00 0.00 O ATOM 0 H ASP A 91 -4.315 3.965 -24.552 1.00 0.00 H new ATOM 0 HA ASP A 91 -6.536 2.591 -23.223 1.00 0.00 H new ATOM 0 HB2 ASP A 91 -4.132 1.645 -24.891 1.00 0.00 H new ATOM 0 HB3 ASP A 91 -5.604 0.732 -24.625 1.00 0.00 H new ATOM 1399 N GLU A 92 -3.683 2.442 -21.818 1.00 0.00 N ATOM 1400 CA GLU A 92 -2.956 1.863 -20.652 1.00 0.00 C ATOM 1401 C GLU A 92 -2.884 2.906 -19.535 1.00 0.00 C ATOM 1402 O GLU A 92 -1.894 3.600 -19.390 1.00 0.00 O ATOM 1403 CB GLU A 92 -1.562 1.531 -21.181 1.00 0.00 C ATOM 1404 CG GLU A 92 -1.672 0.460 -22.268 1.00 0.00 C ATOM 1405 CD GLU A 92 -2.251 -0.822 -21.670 1.00 0.00 C ATOM 1406 OE1 GLU A 92 -1.576 -1.431 -20.856 1.00 0.00 O ATOM 1407 OE2 GLU A 92 -3.359 -1.176 -22.036 1.00 0.00 O ATOM 0 H GLU A 92 -3.254 3.274 -22.224 1.00 0.00 H new ATOM 0 HA GLU A 92 -3.445 0.980 -20.240 1.00 0.00 H new ATOM 0 HB2 GLU A 92 -1.091 2.427 -21.585 1.00 0.00 H new ATOM 0 HB3 GLU A 92 -0.928 1.176 -20.369 1.00 0.00 H new ATOM 0 HG2 GLU A 92 -2.309 0.815 -23.079 1.00 0.00 H new ATOM 0 HG3 GLU A 92 -0.690 0.261 -22.697 1.00 0.00 H new ATOM 1414 N PRO A 93 -3.958 2.992 -18.799 1.00 0.00 N ATOM 1415 CA PRO A 93 -4.055 3.977 -17.689 1.00 0.00 C ATOM 1416 C PRO A 93 -3.199 3.546 -16.496 1.00 0.00 C ATOM 1417 O PRO A 93 -3.704 3.207 -15.445 1.00 0.00 O ATOM 1418 CB PRO A 93 -5.532 3.948 -17.321 1.00 0.00 C ATOM 1419 CG PRO A 93 -6.006 2.597 -17.747 1.00 0.00 C ATOM 1420 CD PRO A 93 -5.173 2.185 -18.929 1.00 0.00 C ATOM 0 HA PRO A 93 -3.699 4.968 -17.972 1.00 0.00 H new ATOM 0 HB2 PRO A 93 -5.676 4.098 -16.251 1.00 0.00 H new ATOM 0 HB3 PRO A 93 -6.082 4.739 -17.831 1.00 0.00 H new ATOM 0 HG2 PRO A 93 -5.902 1.879 -16.934 1.00 0.00 H new ATOM 0 HG3 PRO A 93 -7.063 2.626 -18.013 1.00 0.00 H new ATOM 0 HD2 PRO A 93 -4.949 1.118 -18.908 1.00 0.00 H new ATOM 0 HD3 PRO A 93 -5.687 2.384 -19.869 1.00 0.00 H new ATOM 1428 N ALA A 94 -1.913 3.560 -16.652 1.00 0.00 N ATOM 1429 CA ALA A 94 -1.023 3.153 -15.527 1.00 0.00 C ATOM 1430 C ALA A 94 -1.418 3.888 -14.241 1.00 0.00 C ATOM 1431 O ALA A 94 -1.248 3.376 -13.152 1.00 0.00 O ATOM 1432 CB ALA A 94 0.382 3.551 -15.967 1.00 0.00 C ATOM 0 H ALA A 94 -1.433 3.835 -17.509 1.00 0.00 H new ATOM 0 HA ALA A 94 -1.093 2.087 -15.312 1.00 0.00 H new ATOM 0 HB1 ALA A 94 1.097 3.283 -15.189 1.00 0.00 H new ATOM 0 HB2 ALA A 94 0.636 3.028 -16.889 1.00 0.00 H new ATOM 0 HB3 ALA A 94 0.419 4.627 -16.138 1.00 0.00 H new ATOM 1438 N LYS A 95 -1.940 5.081 -14.355 1.00 0.00 N ATOM 1439 CA LYS A 95 -2.343 5.834 -13.132 1.00 0.00 C ATOM 1440 C LYS A 95 -3.553 5.165 -12.474 1.00 0.00 C ATOM 1441 O LYS A 95 -3.801 5.330 -11.299 1.00 0.00 O ATOM 1442 CB LYS A 95 -2.712 7.237 -13.616 1.00 0.00 C ATOM 1443 CG LYS A 95 -4.024 7.183 -14.404 1.00 0.00 C ATOM 1444 CD LYS A 95 -4.309 8.555 -15.012 1.00 0.00 C ATOM 1445 CE LYS A 95 -4.221 8.462 -16.535 1.00 0.00 C ATOM 1446 NZ LYS A 95 -2.774 8.240 -16.819 1.00 0.00 N ATOM 0 H LYS A 95 -2.104 5.564 -15.238 1.00 0.00 H new ATOM 0 HA LYS A 95 -1.544 5.859 -12.391 1.00 0.00 H new ATOM 0 HB2 LYS A 95 -2.815 7.910 -12.765 1.00 0.00 H new ATOM 0 HB3 LYS A 95 -1.916 7.637 -14.244 1.00 0.00 H new ATOM 0 HG2 LYS A 95 -3.958 6.431 -15.191 1.00 0.00 H new ATOM 0 HG3 LYS A 95 -4.843 6.887 -13.748 1.00 0.00 H new ATOM 0 HD2 LYS A 95 -5.300 8.899 -14.714 1.00 0.00 H new ATOM 0 HD3 LYS A 95 -3.592 9.287 -14.639 1.00 0.00 H new ATOM 0 HE2 LYS A 95 -4.830 7.643 -16.917 1.00 0.00 H new ATOM 0 HE3 LYS A 95 -4.582 9.375 -17.009 1.00 0.00 H new ATOM 0 HZ1 LYS A 95 -2.587 8.417 -17.827 1.00 0.00 H new ATOM 0 HZ2 LYS A 95 -2.203 8.890 -16.242 1.00 0.00 H new ATOM 0 HZ3 LYS A 95 -2.521 7.258 -16.587 1.00 0.00 H new ATOM 1460 N GLU A 96 -4.314 4.410 -13.223 1.00 0.00 N ATOM 1461 CA GLU A 96 -5.506 3.739 -12.626 1.00 0.00 C ATOM 1462 C GLU A 96 -5.629 2.308 -13.149 1.00 0.00 C ATOM 1463 O GLU A 96 -6.246 2.061 -14.168 1.00 0.00 O ATOM 1464 CB GLU A 96 -6.700 4.573 -13.086 1.00 0.00 C ATOM 1465 CG GLU A 96 -7.914 4.250 -12.213 1.00 0.00 C ATOM 1466 CD GLU A 96 -7.872 5.109 -10.949 1.00 0.00 C ATOM 1467 OE1 GLU A 96 -7.082 4.802 -10.073 1.00 0.00 O ATOM 1468 OE2 GLU A 96 -8.630 6.063 -10.880 1.00 0.00 O ATOM 0 H GLU A 96 -4.163 4.230 -14.216 1.00 0.00 H new ATOM 0 HA GLU A 96 -5.440 3.677 -11.540 1.00 0.00 H new ATOM 0 HB2 GLU A 96 -6.463 5.635 -13.019 1.00 0.00 H new ATOM 0 HB3 GLU A 96 -6.924 4.361 -14.132 1.00 0.00 H new ATOM 0 HG2 GLU A 96 -8.834 4.441 -12.765 1.00 0.00 H new ATOM 0 HG3 GLU A 96 -7.914 3.193 -11.948 1.00 0.00 H new ATOM 1475 N GLN A 97 -5.060 1.362 -12.458 1.00 0.00 N ATOM 1476 CA GLN A 97 -5.158 -0.055 -12.916 1.00 0.00 C ATOM 1477 C GLN A 97 -4.456 -0.990 -11.926 1.00 0.00 C ATOM 1478 O GLN A 97 -4.811 -2.146 -11.799 1.00 0.00 O ATOM 1479 CB GLN A 97 -4.463 -0.093 -14.279 1.00 0.00 C ATOM 1480 CG GLN A 97 -2.953 0.074 -14.099 1.00 0.00 C ATOM 1481 CD GLN A 97 -2.238 -0.356 -15.382 1.00 0.00 C ATOM 1482 OE1 GLN A 97 -2.863 -0.539 -16.407 1.00 0.00 O ATOM 1483 NE2 GLN A 97 -0.945 -0.532 -15.365 1.00 0.00 N ATOM 0 H GLN A 97 -4.532 1.506 -11.597 1.00 0.00 H new ATOM 0 HA GLN A 97 -6.194 -0.388 -12.982 1.00 0.00 H new ATOM 0 HB2 GLN A 97 -4.676 -1.038 -14.779 1.00 0.00 H new ATOM 0 HB3 GLN A 97 -4.852 0.700 -14.917 1.00 0.00 H new ATOM 0 HG2 GLN A 97 -2.716 1.112 -13.868 1.00 0.00 H new ATOM 0 HG3 GLN A 97 -2.607 -0.527 -13.258 1.00 0.00 H new ATOM 0 HE21 GLN A 97 -0.421 -0.378 -14.504 1.00 0.00 H new ATOM 0 HE22 GLN A 97 -0.459 -0.823 -16.213 1.00 0.00 H new ATOM 1492 N LEU A 98 -3.464 -0.506 -11.227 1.00 0.00 N ATOM 1493 CA LEU A 98 -2.751 -1.374 -10.248 1.00 0.00 C ATOM 1494 C LEU A 98 -3.484 -1.344 -8.901 1.00 0.00 C ATOM 1495 O LEU A 98 -3.648 -2.354 -8.251 1.00 0.00 O ATOM 1496 CB LEU A 98 -1.351 -0.765 -10.123 1.00 0.00 C ATOM 1497 CG LEU A 98 -0.699 -0.688 -11.509 1.00 0.00 C ATOM 1498 CD1 LEU A 98 0.754 -0.231 -11.367 1.00 0.00 C ATOM 1499 CD2 LEU A 98 -0.738 -2.067 -12.170 1.00 0.00 C ATOM 0 H LEU A 98 -3.118 0.451 -11.292 1.00 0.00 H new ATOM 0 HA LEU A 98 -2.707 -2.416 -10.564 1.00 0.00 H new ATOM 0 HB2 LEU A 98 -1.414 0.231 -9.684 1.00 0.00 H new ATOM 0 HB3 LEU A 98 -0.738 -1.370 -9.455 1.00 0.00 H new ATOM 0 HG LEU A 98 -1.245 0.026 -12.126 1.00 0.00 H new ATOM 0 HD11 LEU A 98 1.216 -0.177 -12.353 1.00 0.00 H new ATOM 0 HD12 LEU A 98 0.782 0.753 -10.898 1.00 0.00 H new ATOM 0 HD13 LEU A 98 1.301 -0.943 -10.749 1.00 0.00 H new ATOM 0 HD21 LEU A 98 -0.275 -2.012 -13.155 1.00 0.00 H new ATOM 0 HD22 LEU A 98 -0.194 -2.782 -11.553 1.00 0.00 H new ATOM 0 HD23 LEU A 98 -1.773 -2.391 -12.274 1.00 0.00 H new ATOM 1511 N TYR A 99 -3.934 -0.187 -8.489 1.00 0.00 N ATOM 1512 CA TYR A 99 -4.665 -0.074 -7.190 1.00 0.00 C ATOM 1513 C TYR A 99 -5.680 1.072 -7.292 1.00 0.00 C ATOM 1514 O TYR A 99 -6.314 1.258 -8.312 1.00 0.00 O ATOM 1515 CB TYR A 99 -3.573 0.258 -6.166 1.00 0.00 C ATOM 1516 CG TYR A 99 -3.913 -0.299 -4.796 1.00 0.00 C ATOM 1517 CD1 TYR A 99 -5.246 -0.468 -4.396 1.00 0.00 C ATOM 1518 CD2 TYR A 99 -2.873 -0.628 -3.911 1.00 0.00 C ATOM 1519 CE1 TYR A 99 -5.536 -0.967 -3.111 1.00 0.00 C ATOM 1520 CE2 TYR A 99 -3.166 -1.125 -2.631 1.00 0.00 C ATOM 1521 CZ TYR A 99 -4.497 -1.294 -2.235 1.00 0.00 C ATOM 1522 OH TYR A 99 -4.789 -1.790 -0.981 1.00 0.00 O ATOM 0 H TYR A 99 -3.826 0.690 -8.999 1.00 0.00 H new ATOM 0 HA TYR A 99 -5.213 -0.976 -6.918 1.00 0.00 H new ATOM 0 HB2 TYR A 99 -2.620 -0.152 -6.501 1.00 0.00 H new ATOM 0 HB3 TYR A 99 -3.449 1.339 -6.101 1.00 0.00 H new ATOM 0 HD1 TYR A 99 -6.050 -0.216 -5.072 1.00 0.00 H new ATOM 0 HD2 TYR A 99 -1.845 -0.498 -4.216 1.00 0.00 H new ATOM 0 HE1 TYR A 99 -6.563 -1.097 -2.802 1.00 0.00 H new ATOM 0 HE2 TYR A 99 -2.364 -1.377 -1.953 1.00 0.00 H new ATOM 0 HH TYR A 99 -5.758 -1.769 -0.839 1.00 0.00 H new ATOM 1532 N HIS A 100 -5.824 1.853 -6.255 1.00 0.00 N ATOM 1533 CA HIS A 100 -6.789 3.000 -6.315 1.00 0.00 C ATOM 1534 C HIS A 100 -6.076 4.272 -6.781 1.00 0.00 C ATOM 1535 O HIS A 100 -4.865 4.318 -6.881 1.00 0.00 O ATOM 1536 CB HIS A 100 -7.351 3.197 -4.896 1.00 0.00 C ATOM 1537 CG HIS A 100 -6.308 2.895 -3.858 1.00 0.00 C ATOM 1538 ND1 HIS A 100 -6.264 1.670 -3.182 1.00 0.00 N ATOM 1539 CD2 HIS A 100 -5.256 3.633 -3.366 1.00 0.00 C ATOM 1540 CE1 HIS A 100 -5.217 1.710 -2.334 1.00 0.00 C ATOM 1541 NE2 HIS A 100 -4.597 2.873 -2.425 1.00 0.00 N ATOM 0 H HIS A 100 -5.321 1.752 -5.373 1.00 0.00 H new ATOM 0 HA HIS A 100 -7.590 2.791 -7.024 1.00 0.00 H new ATOM 0 HB2 HIS A 100 -7.700 4.223 -4.778 1.00 0.00 H new ATOM 0 HB3 HIS A 100 -8.214 2.548 -4.749 1.00 0.00 H new ATOM 0 HD1 HIS A 100 -6.908 0.889 -3.308 1.00 0.00 H new ATOM 0 HD2 HIS A 100 -4.992 4.636 -3.666 1.00 0.00 H new ATOM 0 HE1 HIS A 100 -4.926 0.906 -1.674 1.00 0.00 H new ATOM 0 HE2 HIS A 100 -3.775 3.158 -1.892 1.00 0.00 H new ATOM 1549 N SER A 101 -6.824 5.304 -7.067 1.00 0.00 N ATOM 1550 CA SER A 101 -6.202 6.582 -7.530 1.00 0.00 C ATOM 1551 C SER A 101 -5.342 7.181 -6.417 1.00 0.00 C ATOM 1552 O SER A 101 -4.567 8.091 -6.634 1.00 0.00 O ATOM 1553 CB SER A 101 -7.371 7.512 -7.856 1.00 0.00 C ATOM 1554 OG SER A 101 -6.875 8.677 -8.503 1.00 0.00 O ATOM 0 H SER A 101 -7.842 5.319 -7.000 1.00 0.00 H new ATOM 0 HA SER A 101 -5.555 6.430 -8.394 1.00 0.00 H new ATOM 0 HB2 SER A 101 -8.089 7.002 -8.499 1.00 0.00 H new ATOM 0 HB3 SER A 101 -7.899 7.786 -6.943 1.00 0.00 H new ATOM 0 HG SER A 101 -7.621 9.276 -8.716 1.00 0.00 H new ATOM 1560 N ALA A 102 -5.479 6.680 -5.222 1.00 0.00 N ATOM 1561 CA ALA A 102 -4.680 7.219 -4.085 1.00 0.00 C ATOM 1562 C ALA A 102 -3.280 6.602 -4.082 1.00 0.00 C ATOM 1563 O ALA A 102 -2.340 7.168 -3.562 1.00 0.00 O ATOM 1564 CB ALA A 102 -5.452 6.792 -2.839 1.00 0.00 C ATOM 0 H ALA A 102 -6.112 5.917 -4.982 1.00 0.00 H new ATOM 0 HA ALA A 102 -4.549 8.300 -4.142 1.00 0.00 H new ATOM 0 HB1 ALA A 102 -4.933 7.148 -1.949 1.00 0.00 H new ATOM 0 HB2 ALA A 102 -6.455 7.218 -2.869 1.00 0.00 H new ATOM 0 HB3 ALA A 102 -5.520 5.705 -2.808 1.00 0.00 H new ATOM 1570 N GLU A 103 -3.139 5.438 -4.653 1.00 0.00 N ATOM 1571 CA GLU A 103 -1.807 4.769 -4.677 1.00 0.00 C ATOM 1572 C GLU A 103 -0.763 5.663 -5.363 1.00 0.00 C ATOM 1573 O GLU A 103 -1.043 6.308 -6.355 1.00 0.00 O ATOM 1574 CB GLU A 103 -2.034 3.478 -5.474 1.00 0.00 C ATOM 1575 CG GLU A 103 -1.967 3.771 -6.976 1.00 0.00 C ATOM 1576 CD GLU A 103 -2.364 2.520 -7.759 1.00 0.00 C ATOM 1577 OE1 GLU A 103 -1.665 1.526 -7.640 1.00 0.00 O ATOM 1578 OE2 GLU A 103 -3.358 2.576 -8.463 1.00 0.00 O ATOM 0 H GLU A 103 -3.891 4.919 -5.106 1.00 0.00 H new ATOM 0 HA GLU A 103 -1.426 4.570 -3.676 1.00 0.00 H new ATOM 0 HB2 GLU A 103 -1.280 2.738 -5.206 1.00 0.00 H new ATOM 0 HB3 GLU A 103 -3.004 3.051 -5.221 1.00 0.00 H new ATOM 0 HG2 GLU A 103 -2.634 4.596 -7.226 1.00 0.00 H new ATOM 0 HG3 GLU A 103 -0.959 4.081 -7.252 1.00 0.00 H new ATOM 1585 N LEU A 104 0.441 5.694 -4.851 1.00 0.00 N ATOM 1586 CA LEU A 104 1.504 6.530 -5.485 1.00 0.00 C ATOM 1587 C LEU A 104 2.482 5.638 -6.241 1.00 0.00 C ATOM 1588 O LEU A 104 2.637 4.476 -5.934 1.00 0.00 O ATOM 1589 CB LEU A 104 2.214 7.244 -4.334 1.00 0.00 C ATOM 1590 CG LEU A 104 1.670 8.664 -4.221 1.00 0.00 C ATOM 1591 CD1 LEU A 104 0.254 8.620 -3.651 1.00 0.00 C ATOM 1592 CD2 LEU A 104 2.569 9.483 -3.296 1.00 0.00 C ATOM 0 H LEU A 104 0.733 5.177 -4.022 1.00 0.00 H new ATOM 0 HA LEU A 104 1.090 7.241 -6.200 1.00 0.00 H new ATOM 0 HB2 LEU A 104 2.055 6.704 -3.401 1.00 0.00 H new ATOM 0 HB3 LEU A 104 3.289 7.266 -4.510 1.00 0.00 H new ATOM 0 HG LEU A 104 1.651 9.127 -5.208 1.00 0.00 H new ATOM 0 HD11 LEU A 104 -0.137 9.634 -3.569 1.00 0.00 H new ATOM 0 HD12 LEU A 104 -0.386 8.036 -4.312 1.00 0.00 H new ATOM 0 HD13 LEU A 104 0.273 8.158 -2.664 1.00 0.00 H new ATOM 0 HD21 LEU A 104 2.180 10.498 -3.215 1.00 0.00 H new ATOM 0 HD22 LEU A 104 2.590 9.023 -2.308 1.00 0.00 H new ATOM 0 HD23 LEU A 104 3.579 9.513 -3.704 1.00 0.00 H new ATOM 1604 N HIS A 105 3.142 6.171 -7.229 1.00 0.00 N ATOM 1605 CA HIS A 105 4.111 5.346 -8.001 1.00 0.00 C ATOM 1606 C HIS A 105 5.530 5.851 -7.751 1.00 0.00 C ATOM 1607 O HIS A 105 5.762 7.034 -7.600 1.00 0.00 O ATOM 1608 CB HIS A 105 3.719 5.532 -9.468 1.00 0.00 C ATOM 1609 CG HIS A 105 2.482 4.732 -9.763 1.00 0.00 C ATOM 1610 ND1 HIS A 105 1.417 4.363 -8.980 1.00 0.00 N flip ATOM 1611 CD2 HIS A 105 2.232 4.197 -11.018 1.00 0.00 C flip ATOM 1612 CE1 HIS A 105 0.520 3.608 -9.732 1.00 0.00 C flip ATOM 1613 NE2 HIS A 105 1.060 3.540 -10.951 1.00 0.00 N flip ATOM 0 H HIS A 105 3.053 7.140 -7.535 1.00 0.00 H new ATOM 0 HA HIS A 105 4.088 4.295 -7.712 1.00 0.00 H new ATOM 0 HB2 HIS A 105 3.541 6.587 -9.677 1.00 0.00 H new ATOM 0 HB3 HIS A 105 4.535 5.212 -10.117 1.00 0.00 H new ATOM 0 HD2 HIS A 105 2.863 4.291 -11.890 1.00 0.00 H new ATOM 0 HE1 HIS A 105 -0.411 3.172 -9.401 1.00 0.00 H new ATOM 0 HE2 HIS A 105 0.635 3.049 -11.737 1.00 0.00 H new ATOM 1621 N LEU A 106 6.480 4.965 -7.695 1.00 0.00 N ATOM 1622 CA LEU A 106 7.881 5.400 -7.442 1.00 0.00 C ATOM 1623 C LEU A 106 8.834 4.775 -8.463 1.00 0.00 C ATOM 1624 O LEU A 106 8.707 3.621 -8.821 1.00 0.00 O ATOM 1625 CB LEU A 106 8.194 4.912 -6.028 1.00 0.00 C ATOM 1626 CG LEU A 106 9.656 5.214 -5.697 1.00 0.00 C ATOM 1627 CD1 LEU A 106 9.914 6.717 -5.840 1.00 0.00 C ATOM 1628 CD2 LEU A 106 9.952 4.784 -4.258 1.00 0.00 C ATOM 0 H LEU A 106 6.350 3.960 -7.813 1.00 0.00 H new ATOM 0 HA LEU A 106 8.001 6.479 -7.535 1.00 0.00 H new ATOM 0 HB2 LEU A 106 7.538 5.403 -5.309 1.00 0.00 H new ATOM 0 HB3 LEU A 106 8.006 3.841 -5.951 1.00 0.00 H new ATOM 0 HG LEU A 106 10.303 4.667 -6.383 1.00 0.00 H new ATOM 0 HD11 LEU A 106 10.956 6.931 -5.604 1.00 0.00 H new ATOM 0 HD12 LEU A 106 9.703 7.027 -6.864 1.00 0.00 H new ATOM 0 HD13 LEU A 106 9.267 7.264 -5.155 1.00 0.00 H new ATOM 0 HD21 LEU A 106 10.994 4.999 -4.021 1.00 0.00 H new ATOM 0 HD22 LEU A 106 9.304 5.332 -3.574 1.00 0.00 H new ATOM 0 HD23 LEU A 106 9.769 3.715 -4.153 1.00 0.00 H new ATOM 1640 N GLY A 107 9.791 5.529 -8.933 1.00 0.00 N ATOM 1641 CA GLY A 107 10.754 4.977 -9.929 1.00 0.00 C ATOM 1642 C GLY A 107 11.487 3.783 -9.315 1.00 0.00 C ATOM 1643 O GLY A 107 11.757 3.755 -8.130 1.00 0.00 O ATOM 0 H GLY A 107 9.948 6.502 -8.671 1.00 0.00 H new ATOM 0 HA2 GLY A 107 10.225 4.669 -10.831 1.00 0.00 H new ATOM 0 HA3 GLY A 107 11.469 5.745 -10.225 1.00 0.00 H new ATOM 1647 N ILE A 108 11.810 2.789 -10.101 1.00 0.00 N ATOM 1648 CA ILE A 108 12.515 1.607 -9.551 1.00 0.00 C ATOM 1649 C ILE A 108 13.850 2.018 -8.926 1.00 0.00 C ATOM 1650 O ILE A 108 14.202 1.577 -7.850 1.00 0.00 O ATOM 1651 CB ILE A 108 12.750 0.716 -10.761 1.00 0.00 C ATOM 1652 CG1 ILE A 108 11.418 0.155 -11.260 1.00 0.00 C ATOM 1653 CG2 ILE A 108 13.657 -0.429 -10.353 1.00 0.00 C ATOM 1654 CD1 ILE A 108 11.628 -0.502 -12.625 1.00 0.00 C ATOM 0 H ILE A 108 11.613 2.750 -11.101 1.00 0.00 H new ATOM 0 HA ILE A 108 11.945 1.110 -8.766 1.00 0.00 H new ATOM 0 HB ILE A 108 13.213 1.296 -11.560 1.00 0.00 H new ATOM 0 HG12 ILE A 108 11.027 -0.573 -10.549 1.00 0.00 H new ATOM 0 HG13 ILE A 108 10.680 0.953 -11.337 1.00 0.00 H new ATOM 0 HG21 ILE A 108 13.834 -1.077 -11.212 1.00 0.00 H new ATOM 0 HG22 ILE A 108 14.607 -0.031 -9.996 1.00 0.00 H new ATOM 0 HG23 ILE A 108 13.182 -1.003 -9.557 1.00 0.00 H new ATOM 0 HD11 ILE A 108 10.681 -0.904 -12.985 1.00 0.00 H new ATOM 0 HD12 ILE A 108 12.000 0.239 -13.332 1.00 0.00 H new ATOM 0 HD13 ILE A 108 12.353 -1.311 -12.532 1.00 0.00 H new ATOM 1666 N HIS A 109 14.594 2.862 -9.584 1.00 0.00 N ATOM 1667 CA HIS A 109 15.896 3.296 -9.009 1.00 0.00 C ATOM 1668 C HIS A 109 15.659 4.466 -8.052 1.00 0.00 C ATOM 1669 O HIS A 109 16.583 5.069 -7.544 1.00 0.00 O ATOM 1670 CB HIS A 109 16.742 3.732 -10.207 1.00 0.00 C ATOM 1671 CG HIS A 109 16.217 5.033 -10.744 1.00 0.00 C ATOM 1672 ND1 HIS A 109 16.721 6.260 -10.340 1.00 0.00 N ATOM 1673 CD2 HIS A 109 15.225 5.314 -11.649 1.00 0.00 C ATOM 1674 CE1 HIS A 109 16.035 7.214 -10.995 1.00 0.00 C ATOM 1675 NE2 HIS A 109 15.111 6.692 -11.808 1.00 0.00 N ATOM 0 H HIS A 109 14.358 3.268 -10.490 1.00 0.00 H new ATOM 0 HA HIS A 109 16.392 2.507 -8.443 1.00 0.00 H new ATOM 0 HB2 HIS A 109 17.784 3.844 -9.908 1.00 0.00 H new ATOM 0 HB3 HIS A 109 16.713 2.968 -10.984 1.00 0.00 H new ATOM 0 HD2 HIS A 109 14.623 4.577 -12.161 1.00 0.00 H new ATOM 0 HE1 HIS A 109 16.210 8.273 -10.878 1.00 0.00 H new ATOM 0 HE2 HIS A 109 14.463 7.195 -12.414 1.00 0.00 H new ATOM 1683 N GLN A 110 14.416 4.783 -7.802 1.00 0.00 N ATOM 1684 CA GLN A 110 14.092 5.903 -6.878 1.00 0.00 C ATOM 1685 C GLN A 110 13.747 5.348 -5.499 1.00 0.00 C ATOM 1686 O GLN A 110 13.130 6.008 -4.687 1.00 0.00 O ATOM 1687 CB GLN A 110 12.884 6.598 -7.510 1.00 0.00 C ATOM 1688 CG GLN A 110 13.320 7.313 -8.791 1.00 0.00 C ATOM 1689 CD GLN A 110 12.128 8.058 -9.387 1.00 0.00 C ATOM 1690 OE1 GLN A 110 11.391 8.716 -8.681 1.00 0.00 O ATOM 1691 NE2 GLN A 110 11.906 7.985 -10.671 1.00 0.00 N ATOM 0 H GLN A 110 13.607 4.309 -8.203 1.00 0.00 H new ATOM 0 HA GLN A 110 14.924 6.594 -6.742 1.00 0.00 H new ATOM 0 HB2 GLN A 110 12.107 5.867 -7.735 1.00 0.00 H new ATOM 0 HB3 GLN A 110 12.455 7.314 -6.809 1.00 0.00 H new ATOM 0 HG2 GLN A 110 14.128 8.012 -8.574 1.00 0.00 H new ATOM 0 HG3 GLN A 110 13.708 6.591 -9.510 1.00 0.00 H new ATOM 0 HE21 GLN A 110 12.524 7.433 -11.265 1.00 0.00 H new ATOM 0 HE22 GLN A 110 11.114 8.480 -11.081 1.00 0.00 H new ATOM 1700 N LEU A 111 14.147 4.139 -5.225 1.00 0.00 N ATOM 1701 CA LEU A 111 13.844 3.552 -3.892 1.00 0.00 C ATOM 1702 C LEU A 111 14.583 4.343 -2.814 1.00 0.00 C ATOM 1703 O LEU A 111 15.768 4.190 -2.612 1.00 0.00 O ATOM 1704 CB LEU A 111 14.350 2.104 -3.959 1.00 0.00 C ATOM 1705 CG LEU A 111 13.365 1.181 -4.712 1.00 0.00 C ATOM 1706 CD1 LEU A 111 12.887 0.084 -3.765 1.00 0.00 C ATOM 1707 CD2 LEU A 111 12.142 1.948 -5.232 1.00 0.00 C ATOM 0 H LEU A 111 14.667 3.535 -5.862 1.00 0.00 H new ATOM 0 HA LEU A 111 12.782 3.584 -3.648 1.00 0.00 H new ATOM 0 HB2 LEU A 111 15.320 2.081 -4.456 1.00 0.00 H new ATOM 0 HB3 LEU A 111 14.501 1.725 -2.948 1.00 0.00 H new ATOM 0 HG LEU A 111 13.892 0.760 -5.568 1.00 0.00 H new ATOM 0 HD11 LEU A 111 12.191 -0.571 -4.289 1.00 0.00 H new ATOM 0 HD12 LEU A 111 13.742 -0.497 -3.419 1.00 0.00 H new ATOM 0 HD13 LEU A 111 12.385 0.535 -2.909 1.00 0.00 H new ATOM 0 HD21 LEU A 111 11.477 1.261 -5.755 1.00 0.00 H new ATOM 0 HD22 LEU A 111 11.612 2.399 -4.393 1.00 0.00 H new ATOM 0 HD23 LEU A 111 12.468 2.730 -5.918 1.00 0.00 H new ATOM 1719 N GLU A 112 13.863 5.190 -2.143 1.00 0.00 N ATOM 1720 CA GLU A 112 14.445 6.049 -1.064 1.00 0.00 C ATOM 1721 C GLU A 112 13.436 7.144 -0.741 1.00 0.00 C ATOM 1722 O GLU A 112 13.365 7.646 0.361 1.00 0.00 O ATOM 1723 CB GLU A 112 15.710 6.672 -1.651 1.00 0.00 C ATOM 1724 CG GLU A 112 15.366 7.324 -2.986 1.00 0.00 C ATOM 1725 CD GLU A 112 16.653 7.689 -3.726 1.00 0.00 C ATOM 1726 OE1 GLU A 112 17.513 6.832 -3.833 1.00 0.00 O ATOM 1727 OE2 GLU A 112 16.757 8.819 -4.174 1.00 0.00 O ATOM 0 H GLU A 112 12.865 5.332 -2.297 1.00 0.00 H new ATOM 0 HA GLU A 112 14.671 5.488 -0.157 1.00 0.00 H new ATOM 0 HB2 GLU A 112 16.119 7.413 -0.964 1.00 0.00 H new ATOM 0 HB3 GLU A 112 16.476 5.909 -1.790 1.00 0.00 H new ATOM 0 HG2 GLU A 112 14.767 6.643 -3.591 1.00 0.00 H new ATOM 0 HG3 GLU A 112 14.764 8.217 -2.821 1.00 0.00 H new ATOM 1734 N GLN A 113 12.643 7.497 -1.719 1.00 0.00 N ATOM 1735 CA GLN A 113 11.596 8.540 -1.518 1.00 0.00 C ATOM 1736 C GLN A 113 10.396 7.909 -0.813 1.00 0.00 C ATOM 1737 O GLN A 113 9.465 8.578 -0.418 1.00 0.00 O ATOM 1738 CB GLN A 113 11.214 8.981 -2.930 1.00 0.00 C ATOM 1739 CG GLN A 113 12.319 9.868 -3.504 1.00 0.00 C ATOM 1740 CD GLN A 113 12.035 10.151 -4.981 1.00 0.00 C ATOM 1741 OE1 GLN A 113 10.925 9.979 -5.442 1.00 0.00 O ATOM 1742 NE2 GLN A 113 13.000 10.578 -5.747 1.00 0.00 N ATOM 0 H GLN A 113 12.678 7.102 -2.659 1.00 0.00 H new ATOM 0 HA GLN A 113 11.935 9.378 -0.910 1.00 0.00 H new ATOM 0 HB2 GLN A 113 11.065 8.109 -3.567 1.00 0.00 H new ATOM 0 HB3 GLN A 113 10.270 9.525 -2.909 1.00 0.00 H new ATOM 0 HG2 GLN A 113 12.374 10.804 -2.948 1.00 0.00 H new ATOM 0 HG3 GLN A 113 13.286 9.377 -3.397 1.00 0.00 H new ATOM 0 HE21 GLN A 113 13.933 10.723 -5.360 1.00 0.00 H new ATOM 0 HE22 GLN A 113 12.822 10.768 -6.733 1.00 0.00 H new ATOM 1751 N LEU A 114 10.417 6.615 -0.668 1.00 0.00 N ATOM 1752 CA LEU A 114 9.293 5.902 -0.008 1.00 0.00 C ATOM 1753 C LEU A 114 8.802 6.619 1.254 1.00 0.00 C ATOM 1754 O LEU A 114 7.619 6.799 1.420 1.00 0.00 O ATOM 1755 CB LEU A 114 9.866 4.541 0.361 1.00 0.00 C ATOM 1756 CG LEU A 114 10.030 3.689 -0.895 1.00 0.00 C ATOM 1757 CD1 LEU A 114 11.517 3.403 -1.134 1.00 0.00 C ATOM 1758 CD2 LEU A 114 9.279 2.370 -0.700 1.00 0.00 C ATOM 0 H LEU A 114 11.178 6.013 -0.984 1.00 0.00 H new ATOM 0 HA LEU A 114 8.429 5.845 -0.670 1.00 0.00 H new ATOM 0 HB2 LEU A 114 10.829 4.664 0.856 1.00 0.00 H new ATOM 0 HB3 LEU A 114 9.206 4.039 1.068 1.00 0.00 H new ATOM 0 HG LEU A 114 9.627 4.221 -1.757 1.00 0.00 H new ATOM 0 HD11 LEU A 114 11.631 2.795 -2.031 1.00 0.00 H new ATOM 0 HD12 LEU A 114 12.052 4.344 -1.263 1.00 0.00 H new ATOM 0 HD13 LEU A 114 11.927 2.867 -0.278 1.00 0.00 H new ATOM 0 HD21 LEU A 114 9.389 1.753 -1.592 1.00 0.00 H new ATOM 0 HD22 LEU A 114 9.690 1.841 0.160 1.00 0.00 H new ATOM 0 HD23 LEU A 114 8.222 2.575 -0.529 1.00 0.00 H new ATOM 1770 N PRO A 115 9.707 6.982 2.127 1.00 0.00 N ATOM 1771 CA PRO A 115 9.297 7.652 3.387 1.00 0.00 C ATOM 1772 C PRO A 115 8.628 8.971 3.055 1.00 0.00 C ATOM 1773 O PRO A 115 7.538 9.262 3.509 1.00 0.00 O ATOM 1774 CB PRO A 115 10.613 7.828 4.143 1.00 0.00 C ATOM 1775 CG PRO A 115 11.660 7.802 3.079 1.00 0.00 C ATOM 1776 CD PRO A 115 11.160 6.834 2.039 1.00 0.00 C ATOM 0 HA PRO A 115 8.573 7.096 3.983 1.00 0.00 H new ATOM 0 HB2 PRO A 115 10.631 8.768 4.695 1.00 0.00 H new ATOM 0 HB3 PRO A 115 10.764 7.029 4.869 1.00 0.00 H new ATOM 0 HG2 PRO A 115 11.809 8.794 2.652 1.00 0.00 H new ATOM 0 HG3 PRO A 115 12.621 7.482 3.483 1.00 0.00 H new ATOM 0 HD2 PRO A 115 11.532 7.081 1.045 1.00 0.00 H new ATOM 0 HD3 PRO A 115 11.476 5.813 2.252 1.00 0.00 H new ATOM 1784 N TYR A 116 9.248 9.751 2.232 1.00 0.00 N ATOM 1785 CA TYR A 116 8.621 11.029 1.830 1.00 0.00 C ATOM 1786 C TYR A 116 7.375 10.707 0.991 1.00 0.00 C ATOM 1787 O TYR A 116 6.392 11.422 1.011 1.00 0.00 O ATOM 1788 CB TYR A 116 9.721 11.756 1.033 1.00 0.00 C ATOM 1789 CG TYR A 116 9.259 12.047 -0.372 1.00 0.00 C ATOM 1790 CD1 TYR A 116 8.209 12.941 -0.584 1.00 0.00 C ATOM 1791 CD2 TYR A 116 9.875 11.415 -1.456 1.00 0.00 C ATOM 1792 CE1 TYR A 116 7.772 13.207 -1.885 1.00 0.00 C ATOM 1793 CE2 TYR A 116 9.438 11.678 -2.758 1.00 0.00 C ATOM 1794 CZ TYR A 116 8.385 12.575 -2.974 1.00 0.00 C ATOM 1795 OH TYR A 116 7.949 12.836 -4.258 1.00 0.00 O ATOM 0 H TYR A 116 10.161 9.561 1.819 1.00 0.00 H new ATOM 0 HA TYR A 116 8.281 11.656 2.654 1.00 0.00 H new ATOM 0 HB2 TYR A 116 9.985 12.687 1.534 1.00 0.00 H new ATOM 0 HB3 TYR A 116 10.622 11.143 1.005 1.00 0.00 H new ATOM 0 HD1 TYR A 116 7.735 13.427 0.256 1.00 0.00 H new ATOM 0 HD2 TYR A 116 10.688 10.724 -1.288 1.00 0.00 H new ATOM 0 HE1 TYR A 116 6.961 13.901 -2.050 1.00 0.00 H new ATOM 0 HE2 TYR A 116 9.912 11.190 -3.596 1.00 0.00 H new ATOM 0 HH TYR A 116 8.481 12.316 -4.896 1.00 0.00 H new ATOM 1805 N GLN A 117 7.413 9.611 0.276 1.00 0.00 N ATOM 1806 CA GLN A 117 6.241 9.192 -0.545 1.00 0.00 C ATOM 1807 C GLN A 117 5.154 8.667 0.384 1.00 0.00 C ATOM 1808 O GLN A 117 3.981 8.919 0.206 1.00 0.00 O ATOM 1809 CB GLN A 117 6.760 8.058 -1.432 1.00 0.00 C ATOM 1810 CG GLN A 117 7.446 8.636 -2.670 1.00 0.00 C ATOM 1811 CD GLN A 117 6.382 9.010 -3.703 1.00 0.00 C ATOM 1812 OE1 GLN A 117 5.601 8.177 -4.116 1.00 0.00 O ATOM 1813 NE2 GLN A 117 6.312 10.239 -4.135 1.00 0.00 N ATOM 0 H GLN A 117 8.216 8.983 0.227 1.00 0.00 H new ATOM 0 HA GLN A 117 5.823 10.008 -1.134 1.00 0.00 H new ATOM 0 HB2 GLN A 117 7.462 7.439 -0.872 1.00 0.00 H new ATOM 0 HB3 GLN A 117 5.934 7.412 -1.731 1.00 0.00 H new ATOM 0 HG2 GLN A 117 8.032 9.514 -2.399 1.00 0.00 H new ATOM 0 HG3 GLN A 117 8.139 7.907 -3.091 1.00 0.00 H new ATOM 0 HE21 GLN A 117 6.968 10.939 -3.789 1.00 0.00 H new ATOM 0 HE22 GLN A 117 5.602 10.499 -4.819 1.00 0.00 H new ATOM 1822 N VAL A 118 5.557 7.933 1.377 1.00 0.00 N ATOM 1823 CA VAL A 118 4.588 7.368 2.347 1.00 0.00 C ATOM 1824 C VAL A 118 3.814 8.498 3.028 1.00 0.00 C ATOM 1825 O VAL A 118 2.602 8.478 3.070 1.00 0.00 O ATOM 1826 CB VAL A 118 5.458 6.583 3.332 1.00 0.00 C ATOM 1827 CG1 VAL A 118 4.778 6.494 4.700 1.00 0.00 C ATOM 1828 CG2 VAL A 118 5.661 5.174 2.777 1.00 0.00 C ATOM 0 H VAL A 118 6.532 7.697 1.560 1.00 0.00 H new ATOM 0 HA VAL A 118 3.834 6.728 1.889 1.00 0.00 H new ATOM 0 HB VAL A 118 6.414 7.091 3.455 1.00 0.00 H new ATOM 0 HG11 VAL A 118 5.412 5.932 5.386 1.00 0.00 H new ATOM 0 HG12 VAL A 118 4.619 7.498 5.093 1.00 0.00 H new ATOM 0 HG13 VAL A 118 3.818 5.988 4.597 1.00 0.00 H new ATOM 0 HG21 VAL A 118 6.279 4.598 3.465 1.00 0.00 H new ATOM 0 HG22 VAL A 118 4.693 4.685 2.662 1.00 0.00 H new ATOM 0 HG23 VAL A 118 6.155 5.233 1.807 1.00 0.00 H new ATOM 1838 N ASP A 119 4.482 9.502 3.532 1.00 0.00 N ATOM 1839 CA ASP A 119 3.720 10.616 4.159 1.00 0.00 C ATOM 1840 C ASP A 119 2.833 11.246 3.089 1.00 0.00 C ATOM 1841 O ASP A 119 1.692 11.589 3.326 1.00 0.00 O ATOM 1842 CB ASP A 119 4.764 11.613 4.661 1.00 0.00 C ATOM 1843 CG ASP A 119 5.451 11.045 5.904 1.00 0.00 C ATOM 1844 OD1 ASP A 119 6.452 10.367 5.746 1.00 0.00 O ATOM 1845 OD2 ASP A 119 4.964 11.298 6.994 1.00 0.00 O ATOM 0 H ASP A 119 5.498 9.597 3.537 1.00 0.00 H new ATOM 0 HA ASP A 119 3.084 10.288 4.981 1.00 0.00 H new ATOM 0 HB2 ASP A 119 5.501 11.808 3.882 1.00 0.00 H new ATOM 0 HB3 ASP A 119 4.290 12.565 4.897 1.00 0.00 H new ATOM 1850 N ALA A 120 3.353 11.370 1.897 1.00 0.00 N ATOM 1851 CA ALA A 120 2.552 11.946 0.784 1.00 0.00 C ATOM 1852 C ALA A 120 1.405 10.996 0.441 1.00 0.00 C ATOM 1853 O ALA A 120 0.273 11.402 0.278 1.00 0.00 O ATOM 1854 CB ALA A 120 3.523 12.054 -0.391 1.00 0.00 C ATOM 0 H ALA A 120 4.303 11.095 1.648 1.00 0.00 H new ATOM 0 HA ALA A 120 2.116 12.912 1.036 1.00 0.00 H new ATOM 0 HB1 ALA A 120 3.005 12.472 -1.254 1.00 0.00 H new ATOM 0 HB2 ALA A 120 4.355 12.703 -0.117 1.00 0.00 H new ATOM 0 HB3 ALA A 120 3.903 11.064 -0.641 1.00 0.00 H new ATOM 1860 N ALA A 121 1.693 9.723 0.341 1.00 0.00 N ATOM 1861 CA ALA A 121 0.618 8.746 0.023 1.00 0.00 C ATOM 1862 C ALA A 121 -0.461 8.829 1.103 1.00 0.00 C ATOM 1863 O ALA A 121 -1.641 8.820 0.820 1.00 0.00 O ATOM 1864 CB ALA A 121 1.303 7.375 0.034 1.00 0.00 C ATOM 0 H ALA A 121 2.623 9.323 0.466 1.00 0.00 H new ATOM 0 HA ALA A 121 0.138 8.936 -0.937 1.00 0.00 H new ATOM 0 HB1 ALA A 121 0.570 6.600 -0.193 1.00 0.00 H new ATOM 0 HB2 ALA A 121 2.094 7.357 -0.716 1.00 0.00 H new ATOM 0 HB3 ALA A 121 1.732 7.191 1.019 1.00 0.00 H new ATOM 1870 N LEU A 122 -0.060 8.933 2.340 1.00 0.00 N ATOM 1871 CA LEU A 122 -1.065 9.041 3.433 1.00 0.00 C ATOM 1872 C LEU A 122 -1.958 10.253 3.183 1.00 0.00 C ATOM 1873 O LEU A 122 -3.163 10.163 3.218 1.00 0.00 O ATOM 1874 CB LEU A 122 -0.243 9.244 4.708 1.00 0.00 C ATOM 1875 CG LEU A 122 0.600 8.000 4.986 1.00 0.00 C ATOM 1876 CD1 LEU A 122 1.780 8.371 5.893 1.00 0.00 C ATOM 1877 CD2 LEU A 122 -0.268 6.945 5.678 1.00 0.00 C ATOM 0 H LEU A 122 0.915 8.948 2.640 1.00 0.00 H new ATOM 0 HA LEU A 122 -1.709 8.164 3.500 1.00 0.00 H new ATOM 0 HB2 LEU A 122 0.403 10.115 4.600 1.00 0.00 H new ATOM 0 HB3 LEU A 122 -0.905 9.441 5.551 1.00 0.00 H new ATOM 0 HG LEU A 122 0.981 7.600 4.046 1.00 0.00 H new ATOM 0 HD11 LEU A 122 2.380 7.483 6.090 1.00 0.00 H new ATOM 0 HD12 LEU A 122 2.396 9.123 5.400 1.00 0.00 H new ATOM 0 HD13 LEU A 122 1.404 8.771 6.834 1.00 0.00 H new ATOM 0 HD21 LEU A 122 0.330 6.056 5.878 1.00 0.00 H new ATOM 0 HD22 LEU A 122 -0.648 7.346 6.618 1.00 0.00 H new ATOM 0 HD23 LEU A 122 -1.105 6.681 5.031 1.00 0.00 H new ATOM 1889 N ALA A 123 -1.378 11.387 2.915 1.00 0.00 N ATOM 1890 CA ALA A 123 -2.212 12.590 2.649 1.00 0.00 C ATOM 1891 C ALA A 123 -3.048 12.352 1.396 1.00 0.00 C ATOM 1892 O ALA A 123 -4.237 12.601 1.364 1.00 0.00 O ATOM 1893 CB ALA A 123 -1.214 13.720 2.417 1.00 0.00 C ATOM 0 H ALA A 123 -0.370 11.533 2.869 1.00 0.00 H new ATOM 0 HA ALA A 123 -2.897 12.820 3.465 1.00 0.00 H new ATOM 0 HB1 ALA A 123 -1.753 14.645 2.213 1.00 0.00 H new ATOM 0 HB2 ALA A 123 -0.596 13.848 3.306 1.00 0.00 H new ATOM 0 HB3 ALA A 123 -0.579 13.475 1.566 1.00 0.00 H new ATOM 1899 N GLU A 124 -2.419 11.859 0.367 1.00 0.00 N ATOM 1900 CA GLU A 124 -3.144 11.581 -0.899 1.00 0.00 C ATOM 1901 C GLU A 124 -4.309 10.630 -0.634 1.00 0.00 C ATOM 1902 O GLU A 124 -5.404 10.817 -1.125 1.00 0.00 O ATOM 1903 CB GLU A 124 -2.101 10.904 -1.789 1.00 0.00 C ATOM 1904 CG GLU A 124 -2.706 10.613 -3.159 1.00 0.00 C ATOM 1905 CD GLU A 124 -2.701 11.894 -3.997 1.00 0.00 C ATOM 1906 OE1 GLU A 124 -2.044 12.839 -3.592 1.00 0.00 O ATOM 1907 OE2 GLU A 124 -3.353 11.906 -5.026 1.00 0.00 O ATOM 0 H GLU A 124 -1.424 11.635 0.351 1.00 0.00 H new ATOM 0 HA GLU A 124 -3.561 12.480 -1.353 1.00 0.00 H new ATOM 0 HB2 GLU A 124 -1.227 11.547 -1.896 1.00 0.00 H new ATOM 0 HB3 GLU A 124 -1.761 9.977 -1.327 1.00 0.00 H new ATOM 0 HG2 GLU A 124 -2.135 9.833 -3.663 1.00 0.00 H new ATOM 0 HG3 GLU A 124 -3.725 10.241 -3.048 1.00 0.00 H new ATOM 1914 N PHE A 125 -4.077 9.608 0.141 1.00 0.00 N ATOM 1915 CA PHE A 125 -5.167 8.643 0.437 1.00 0.00 C ATOM 1916 C PHE A 125 -6.286 9.323 1.228 1.00 0.00 C ATOM 1917 O PHE A 125 -7.453 9.179 0.918 1.00 0.00 O ATOM 1918 CB PHE A 125 -4.504 7.546 1.264 1.00 0.00 C ATOM 1919 CG PHE A 125 -5.493 6.436 1.483 1.00 0.00 C ATOM 1920 CD1 PHE A 125 -6.425 6.531 2.520 1.00 0.00 C ATOM 1921 CD2 PHE A 125 -5.485 5.316 0.645 1.00 0.00 C ATOM 1922 CE1 PHE A 125 -7.354 5.505 2.720 1.00 0.00 C ATOM 1923 CE2 PHE A 125 -6.413 4.288 0.845 1.00 0.00 C ATOM 1924 CZ PHE A 125 -7.346 4.383 1.883 1.00 0.00 C ATOM 0 H PHE A 125 -3.180 9.401 0.581 1.00 0.00 H new ATOM 0 HA PHE A 125 -5.627 8.248 -0.469 1.00 0.00 H new ATOM 0 HB2 PHE A 125 -3.621 7.168 0.749 1.00 0.00 H new ATOM 0 HB3 PHE A 125 -4.168 7.946 2.221 1.00 0.00 H new ATOM 0 HD1 PHE A 125 -6.428 7.396 3.166 1.00 0.00 H new ATOM 0 HD2 PHE A 125 -4.763 5.245 -0.155 1.00 0.00 H new ATOM 0 HE1 PHE A 125 -8.077 5.578 3.519 1.00 0.00 H new ATOM 0 HE2 PHE A 125 -6.409 3.423 0.199 1.00 0.00 H new ATOM 0 HZ PHE A 125 -8.061 3.589 2.039 1.00 0.00 H new ATOM 1934 N LEU A 126 -5.942 10.068 2.243 1.00 0.00 N ATOM 1935 CA LEU A 126 -6.989 10.761 3.045 1.00 0.00 C ATOM 1936 C LEU A 126 -7.750 11.755 2.167 1.00 0.00 C ATOM 1937 O LEU A 126 -8.950 11.910 2.276 1.00 0.00 O ATOM 1938 CB LEU A 126 -6.218 11.499 4.136 1.00 0.00 C ATOM 1939 CG LEU A 126 -5.465 10.492 5.000 1.00 0.00 C ATOM 1940 CD1 LEU A 126 -4.645 11.242 6.049 1.00 0.00 C ATOM 1941 CD2 LEU A 126 -6.467 9.574 5.696 1.00 0.00 C ATOM 0 H LEU A 126 -4.983 10.226 2.551 1.00 0.00 H new ATOM 0 HA LEU A 126 -7.724 10.069 3.457 1.00 0.00 H new ATOM 0 HB2 LEU A 126 -5.518 12.204 3.687 1.00 0.00 H new ATOM 0 HB3 LEU A 126 -6.905 12.080 4.752 1.00 0.00 H new ATOM 0 HG LEU A 126 -4.800 9.896 4.375 1.00 0.00 H new ATOM 0 HD11 LEU A 126 -4.105 10.526 6.669 1.00 0.00 H new ATOM 0 HD12 LEU A 126 -3.933 11.901 5.552 1.00 0.00 H new ATOM 0 HD13 LEU A 126 -5.311 11.835 6.676 1.00 0.00 H new ATOM 0 HD21 LEU A 126 -5.932 8.853 6.314 1.00 0.00 H new ATOM 0 HD22 LEU A 126 -7.130 10.169 6.324 1.00 0.00 H new ATOM 0 HD23 LEU A 126 -7.055 9.044 4.947 1.00 0.00 H new ATOM 1953 N ARG A 127 -7.052 12.437 1.305 1.00 0.00 N ATOM 1954 CA ARG A 127 -7.720 13.433 0.424 1.00 0.00 C ATOM 1955 C ARG A 127 -8.745 12.748 -0.491 1.00 0.00 C ATOM 1956 O ARG A 127 -9.778 13.305 -0.805 1.00 0.00 O ATOM 1957 CB ARG A 127 -6.584 14.057 -0.389 1.00 0.00 C ATOM 1958 CG ARG A 127 -7.027 15.420 -0.932 1.00 0.00 C ATOM 1959 CD ARG A 127 -5.878 16.062 -1.716 1.00 0.00 C ATOM 1960 NE ARG A 127 -6.204 15.820 -3.150 1.00 0.00 N ATOM 1961 CZ ARG A 127 -5.642 16.542 -4.085 1.00 0.00 C ATOM 1962 NH1 ARG A 127 -4.833 17.517 -3.769 1.00 0.00 N ATOM 1963 NH2 ARG A 127 -5.892 16.295 -5.343 1.00 0.00 N ATOM 0 H ARG A 127 -6.045 12.348 1.172 1.00 0.00 H new ATOM 0 HA ARG A 127 -8.274 14.182 0.990 1.00 0.00 H new ATOM 0 HB2 ARG A 127 -5.698 14.174 0.235 1.00 0.00 H new ATOM 0 HB3 ARG A 127 -6.309 13.398 -1.213 1.00 0.00 H new ATOM 0 HG2 ARG A 127 -7.897 15.300 -1.577 1.00 0.00 H new ATOM 0 HG3 ARG A 127 -7.327 16.070 -0.110 1.00 0.00 H new ATOM 0 HD2 ARG A 127 -5.803 17.128 -1.503 1.00 0.00 H new ATOM 0 HD3 ARG A 127 -4.920 15.615 -1.449 1.00 0.00 H new ATOM 0 HE ARG A 127 -6.868 15.088 -3.403 1.00 0.00 H new ATOM 0 HH11 ARG A 127 -4.636 17.719 -2.789 1.00 0.00 H new ATOM 0 HH12 ARG A 127 -4.398 18.077 -4.502 1.00 0.00 H new ATOM 0 HH21 ARG A 127 -6.526 15.538 -5.598 1.00 0.00 H new ATOM 0 HH22 ARG A 127 -5.453 16.859 -6.071 1.00 0.00 H new ATOM 1977 N LEU A 128 -8.472 11.543 -0.926 1.00 0.00 N ATOM 1978 CA LEU A 128 -9.440 10.842 -1.822 1.00 0.00 C ATOM 1979 C LEU A 128 -10.203 9.756 -1.069 1.00 0.00 C ATOM 1980 O LEU A 128 -10.996 9.046 -1.645 1.00 0.00 O ATOM 1981 CB LEU A 128 -8.591 10.236 -2.941 1.00 0.00 C ATOM 1982 CG LEU A 128 -8.542 11.200 -4.134 1.00 0.00 C ATOM 1983 CD1 LEU A 128 -8.381 12.639 -3.634 1.00 0.00 C ATOM 1984 CD2 LEU A 128 -7.352 10.841 -5.025 1.00 0.00 C ATOM 0 H LEU A 128 -7.627 11.018 -0.701 1.00 0.00 H new ATOM 0 HA LEU A 128 -10.194 11.527 -2.210 1.00 0.00 H new ATOM 0 HB2 LEU A 128 -7.582 10.039 -2.579 1.00 0.00 H new ATOM 0 HB3 LEU A 128 -9.011 9.279 -3.251 1.00 0.00 H new ATOM 0 HG LEU A 128 -9.469 11.117 -4.701 1.00 0.00 H new ATOM 0 HD11 LEU A 128 -8.347 13.318 -4.486 1.00 0.00 H new ATOM 0 HD12 LEU A 128 -9.226 12.899 -2.996 1.00 0.00 H new ATOM 0 HD13 LEU A 128 -7.456 12.725 -3.064 1.00 0.00 H new ATOM 0 HD21 LEU A 128 -7.314 11.524 -5.874 1.00 0.00 H new ATOM 0 HD22 LEU A 128 -6.429 10.924 -4.451 1.00 0.00 H new ATOM 0 HD23 LEU A 128 -7.463 9.819 -5.386 1.00 0.00 H new ATOM 1996 N ALA A 129 -9.987 9.618 0.210 1.00 0.00 N ATOM 1997 CA ALA A 129 -10.727 8.569 0.966 1.00 0.00 C ATOM 1998 C ALA A 129 -12.201 8.962 1.111 1.00 0.00 C ATOM 1999 O ALA A 129 -12.499 10.049 1.559 1.00 0.00 O ATOM 2000 CB ALA A 129 -10.072 8.526 2.336 1.00 0.00 C ATOM 0 H ALA A 129 -9.337 10.180 0.760 1.00 0.00 H new ATOM 0 HA ALA A 129 -10.692 7.604 0.460 1.00 0.00 H new ATOM 0 HB1 ALA A 129 -10.565 7.774 2.952 1.00 0.00 H new ATOM 0 HB2 ALA A 129 -9.018 8.272 2.227 1.00 0.00 H new ATOM 0 HB3 ALA A 129 -10.163 9.502 2.813 1.00 0.00 H new ATOM 2006 N PRO A 130 -13.085 8.070 0.741 1.00 0.00 N ATOM 2007 CA PRO A 130 -12.690 6.742 0.196 1.00 0.00 C ATOM 2008 C PRO A 130 -12.200 6.874 -1.249 1.00 0.00 C ATOM 2009 O PRO A 130 -12.954 7.220 -2.138 1.00 0.00 O ATOM 2010 CB PRO A 130 -13.983 5.940 0.239 1.00 0.00 C ATOM 2011 CG PRO A 130 -15.074 6.961 0.201 1.00 0.00 C ATOM 2012 CD PRO A 130 -14.537 8.226 0.810 1.00 0.00 C ATOM 0 HA PRO A 130 -11.878 6.281 0.757 1.00 0.00 H new ATOM 0 HB2 PRO A 130 -14.052 5.257 -0.608 1.00 0.00 H new ATOM 0 HB3 PRO A 130 -14.041 5.334 1.143 1.00 0.00 H new ATOM 0 HG2 PRO A 130 -15.397 7.138 -0.825 1.00 0.00 H new ATOM 0 HG3 PRO A 130 -15.946 6.610 0.754 1.00 0.00 H new ATOM 0 HD2 PRO A 130 -14.870 9.106 0.259 1.00 0.00 H new ATOM 0 HD3 PRO A 130 -14.876 8.348 1.839 1.00 0.00 H new ATOM 2020 N VAL A 131 -10.946 6.599 -1.499 1.00 0.00 N ATOM 2021 CA VAL A 131 -10.430 6.712 -2.896 1.00 0.00 C ATOM 2022 C VAL A 131 -11.190 5.746 -3.804 1.00 0.00 C ATOM 2023 O VAL A 131 -11.812 4.808 -3.347 1.00 0.00 O ATOM 2024 CB VAL A 131 -8.955 6.320 -2.825 1.00 0.00 C ATOM 2025 CG1 VAL A 131 -8.167 7.388 -2.061 1.00 0.00 C ATOM 2026 CG2 VAL A 131 -8.823 4.978 -2.106 1.00 0.00 C ATOM 0 H VAL A 131 -10.262 6.303 -0.803 1.00 0.00 H new ATOM 0 HA VAL A 131 -10.558 7.716 -3.300 1.00 0.00 H new ATOM 0 HB VAL A 131 -8.556 6.237 -3.836 1.00 0.00 H new ATOM 0 HG11 VAL A 131 -7.116 7.101 -2.015 1.00 0.00 H new ATOM 0 HG12 VAL A 131 -8.260 8.345 -2.574 1.00 0.00 H new ATOM 0 HG13 VAL A 131 -8.563 7.479 -1.050 1.00 0.00 H new ATOM 0 HG21 VAL A 131 -7.772 4.695 -2.054 1.00 0.00 H new ATOM 0 HG22 VAL A 131 -9.226 5.065 -1.097 1.00 0.00 H new ATOM 0 HG23 VAL A 131 -9.377 4.216 -2.654 1.00 0.00 H new ATOM 2036 N GLU A 132 -11.152 5.966 -5.085 1.00 0.00 N ATOM 2037 CA GLU A 132 -11.879 5.057 -6.009 1.00 0.00 C ATOM 2038 C GLU A 132 -11.008 3.863 -6.406 1.00 0.00 C ATOM 2039 O GLU A 132 -10.079 3.983 -7.181 1.00 0.00 O ATOM 2040 CB GLU A 132 -12.197 5.919 -7.222 1.00 0.00 C ATOM 2041 CG GLU A 132 -12.853 5.055 -8.292 1.00 0.00 C ATOM 2042 CD GLU A 132 -13.298 5.942 -9.451 1.00 0.00 C ATOM 2043 OE1 GLU A 132 -14.238 6.697 -9.262 1.00 0.00 O ATOM 2044 OE2 GLU A 132 -12.692 5.853 -10.504 1.00 0.00 O ATOM 0 H GLU A 132 -10.651 6.734 -5.532 1.00 0.00 H new ATOM 0 HA GLU A 132 -12.775 4.637 -5.551 1.00 0.00 H new ATOM 0 HB2 GLU A 132 -12.861 6.735 -6.939 1.00 0.00 H new ATOM 0 HB3 GLU A 132 -11.285 6.371 -7.611 1.00 0.00 H new ATOM 0 HG2 GLU A 132 -12.152 4.299 -8.646 1.00 0.00 H new ATOM 0 HG3 GLU A 132 -13.709 4.526 -7.874 1.00 0.00 H new ATOM 2051 N THR A 133 -11.315 2.708 -5.881 1.00 0.00 N ATOM 2052 CA THR A 133 -10.525 1.490 -6.220 1.00 0.00 C ATOM 2053 C THR A 133 -11.115 0.802 -7.452 1.00 0.00 C ATOM 2054 O THR A 133 -12.303 0.552 -7.521 1.00 0.00 O ATOM 2055 CB THR A 133 -10.669 0.581 -4.999 1.00 0.00 C ATOM 2056 OG1 THR A 133 -11.926 0.821 -4.383 1.00 0.00 O ATOM 2057 CG2 THR A 133 -9.545 0.863 -4.003 1.00 0.00 C ATOM 0 H THR A 133 -12.084 2.555 -5.228 1.00 0.00 H new ATOM 0 HA THR A 133 -9.485 1.724 -6.447 1.00 0.00 H new ATOM 0 HB THR A 133 -10.608 -0.461 -5.314 1.00 0.00 H new ATOM 0 HG1 THR A 133 -12.023 0.239 -3.601 1.00 0.00 H new ATOM 0 HG21 THR A 133 -9.655 0.211 -3.136 1.00 0.00 H new ATOM 0 HG22 THR A 133 -8.582 0.675 -4.478 1.00 0.00 H new ATOM 0 HG23 THR A 133 -9.595 1.904 -3.683 1.00 0.00 H new ATOM 2065 N MET A 134 -10.299 0.482 -8.421 1.00 0.00 N ATOM 2066 CA MET A 134 -10.823 -0.210 -9.633 1.00 0.00 C ATOM 2067 C MET A 134 -11.462 -1.538 -9.221 1.00 0.00 C ATOM 2068 O MET A 134 -12.488 -1.936 -9.737 1.00 0.00 O ATOM 2069 CB MET A 134 -9.597 -0.443 -10.522 1.00 0.00 C ATOM 2070 CG MET A 134 -9.001 0.903 -10.936 1.00 0.00 C ATOM 2071 SD MET A 134 -10.005 1.635 -12.254 1.00 0.00 S ATOM 2072 CE MET A 134 -9.466 0.527 -13.582 1.00 0.00 C ATOM 0 H MET A 134 -9.296 0.669 -8.425 1.00 0.00 H new ATOM 0 HA MET A 134 -11.586 0.368 -10.155 1.00 0.00 H new ATOM 0 HB2 MET A 134 -8.853 -1.032 -9.986 1.00 0.00 H new ATOM 0 HB3 MET A 134 -9.880 -1.015 -11.406 1.00 0.00 H new ATOM 0 HG2 MET A 134 -8.964 1.575 -10.078 1.00 0.00 H new ATOM 0 HG3 MET A 134 -7.975 0.767 -11.279 1.00 0.00 H new ATOM 0 HE1 MET A 134 -9.031 1.114 -14.391 1.00 0.00 H new ATOM 0 HE2 MET A 134 -8.720 -0.168 -13.196 1.00 0.00 H new ATOM 0 HE3 MET A 134 -10.322 -0.032 -13.959 1.00 0.00 H new ATOM 2082 N ALA A 135 -10.863 -2.224 -8.286 1.00 0.00 N ATOM 2083 CA ALA A 135 -11.433 -3.523 -7.829 1.00 0.00 C ATOM 2084 C ALA A 135 -12.261 -3.313 -6.559 1.00 0.00 C ATOM 2085 O ALA A 135 -12.011 -4.013 -5.591 1.00 0.00 O ATOM 2086 CB ALA A 135 -10.223 -4.407 -7.534 1.00 0.00 C ATOM 2087 OXT ALA A 135 -13.129 -2.455 -6.574 1.00 0.00 O ATOM 0 H ALA A 135 -10.002 -1.940 -7.818 1.00 0.00 H new ATOM 0 HA ALA A 135 -12.092 -3.970 -8.574 1.00 0.00 H new ATOM 0 HB1 ALA A 135 -10.562 -5.385 -7.191 1.00 0.00 H new ATOM 0 HB2 ALA A 135 -9.630 -4.526 -8.441 1.00 0.00 H new ATOM 0 HB3 ALA A 135 -9.613 -3.942 -6.760 1.00 0.00 H new TER 2093 ALA A 135