USER MOD reduce.3.24.130724 H: found=0, std=0, add=903, rem=0, adj=29 USER MOD reduce.3.24.130724 removed 903 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 91 THR OG1 : rot 180:sc=-0.00257 USER MOD Set 1.2: A 92 SER OG : rot 64:sc= 0.0485 USER MOD Set 1.3: A 94 SER OG : rot 180:sc= 0 USER MOD Set 2.1: A 76 SER OG : rot -165:sc= 0.0397 USER MOD Set 2.2: A 78 TYR OH : rot 150:sc= -0.872 USER MOD Set 3.1: A 3 GLN : amide:sc=-0.00256 K(o=0.023,f=-2.1!) USER MOD Set 3.2: A 4 THR OG1 : rot 180:sc= 0.0256 USER MOD Single : A 5 TYR OH : rot 180:sc= 0 USER MOD Single : A 8 THR OG1 : rot -131:sc= -0.684! USER MOD Single : A 9 ASN : amide:sc= -0.293 K(o=-0.29,f=-5.6!) USER MOD Single : A 13 THR OG1 : rot -59:sc= 0.668 USER MOD Single : A 17 THR OG1 : rot 111:sc= -0.418 USER MOD Single : A 18 GLN : amide:sc= -0.0161 K(o=-0.016,f=-2.2!) USER MOD Single : A 27 ASN : amide:sc= -0.761 X(o=-0.76,f=-0.46) USER MOD Single : A 28 THR OG1 : rot 180:sc= 0 USER MOD Single : A 31 THR OG1 : rot 180:sc= -0.043 USER MOD Single : A 32 SER OG : rot 5:sc= 1.17 USER MOD Single : A 38 THR OG1 : rot 180:sc= 0 USER MOD Single : A 41 GLN : amide:sc= -1.89! C(o=-1.9!,f=-4.4!) USER MOD Single : A 43 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 44 THR OG1 : rot 70:sc= 0.963 USER MOD Single : A 47 SER OG : rot 97:sc= 1.26 USER MOD Single : A 50 ASN :FLIP amide:sc= -0.0527 F(o=-1.6,f=-0.053) USER MOD Single : A 51 ASN :FLIP amide:sc= -0.857! C(o=-2.4!,f=-0.86!) USER MOD Single : A 58 SER OG : rot 180:sc= 0 USER MOD Single : A 66 HIS : no HD1:sc= -1.68! C(o=-1.7!,f=-3.3!) USER MOD Single : A 67 TYR OH : rot 180:sc= -1.62! USER MOD Single : A 69 THR OG1 : rot -168:sc= -0.675 USER MOD Single : A 80 LYS NZ :NH3+ 143:sc=-0.00629 (180deg=-0.214) USER MOD Single : A 81 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 83 SER OG : rot 180:sc= 0 USER MOD Single : A 88 THR OG1 : rot 24:sc= 1.53 USER MOD Single : A 90 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 93 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 100 TYR OH : rot 180:sc= -1.43! USER MOD Single : A 101 ASN : amide:sc= -4.02! C(o=-4!,f=-9.9!) USER MOD Single : A 103 LYS NZ :NH3+ -171:sc= 0 (180deg=-0.00755) USER MOD Single : A 105 GLN : amide:sc= 0 X(o=0,f=-0.019) USER MOD Single : A 108 THR OG1 : rot 180:sc= -0.811 USER MOD Single : A 111 ASN :FLIP amide:sc= 0 F(o=-0.82,f=0) USER MOD Single : A 115 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 119 TYR OH : rot 180:sc= 0 USER MOD Single : A 123 GLN : amide:sc= -0.604 K(o=-0.6,f=-3.9!) USER MOD ----------------------------------------------------------------- ATOM 14 N TRP A 2 8.844 5.254 -1.140 1.00 0.00 N ATOM 15 CA TRP A 2 9.016 4.241 -2.219 1.00 0.00 C ATOM 16 C TRP A 2 9.296 4.953 -3.544 1.00 0.00 C ATOM 17 O TRP A 2 9.480 4.326 -4.565 1.00 0.00 O ATOM 18 CB TRP A 2 7.734 3.416 -2.359 1.00 0.00 C ATOM 19 CG TRP A 2 7.771 2.246 -1.428 1.00 0.00 C ATOM 20 CD1 TRP A 2 7.778 0.948 -1.814 1.00 0.00 C ATOM 21 CD2 TRP A 2 7.798 2.238 0.029 1.00 0.00 C ATOM 22 NE1 TRP A 2 7.808 0.146 -0.687 1.00 0.00 N ATOM 23 CE2 TRP A 2 7.821 0.894 0.473 1.00 0.00 C ATOM 24 CE3 TRP A 2 7.804 3.257 0.999 1.00 0.00 C ATOM 25 CZ2 TRP A 2 7.849 0.573 1.832 1.00 0.00 C ATOM 26 CZ3 TRP A 2 7.833 2.937 2.366 1.00 0.00 C ATOM 27 CH2 TRP A 2 7.855 1.598 2.782 1.00 0.00 C ATOM 0 HA TRP A 2 9.849 3.585 -1.967 1.00 0.00 H new ATOM 0 HB2 TRP A 2 6.866 4.038 -2.139 1.00 0.00 H new ATOM 0 HB3 TRP A 2 7.626 3.069 -3.387 1.00 0.00 H new ATOM 0 HD1 TRP A 2 7.763 0.596 -2.835 1.00 0.00 H new ATOM 0 HE1 TRP A 2 7.819 -0.874 -0.710 1.00 0.00 H new ATOM 0 HE3 TRP A 2 7.786 4.292 0.690 1.00 0.00 H new ATOM 0 HZ2 TRP A 2 7.866 -0.460 2.147 1.00 0.00 H new ATOM 0 HZ3 TRP A 2 7.838 3.727 3.102 1.00 0.00 H new ATOM 0 HH2 TRP A 2 7.877 1.359 3.835 1.00 0.00 H new ATOM 38 N GLN A 3 9.311 6.258 -3.543 1.00 0.00 N ATOM 39 CA GLN A 3 9.564 6.999 -4.812 1.00 0.00 C ATOM 40 C GLN A 3 10.873 6.514 -5.436 1.00 0.00 C ATOM 41 O GLN A 3 10.886 5.901 -6.486 1.00 0.00 O ATOM 42 CB GLN A 3 9.665 8.497 -4.517 1.00 0.00 C ATOM 43 CG GLN A 3 9.649 9.278 -5.832 1.00 0.00 C ATOM 44 CD GLN A 3 11.008 9.945 -6.047 1.00 0.00 C ATOM 45 OE1 GLN A 3 11.983 9.283 -6.342 1.00 0.00 O ATOM 46 NE2 GLN A 3 11.116 11.238 -5.912 1.00 0.00 N ATOM 0 H GLN A 3 9.159 6.842 -2.721 1.00 0.00 H new ATOM 0 HA GLN A 3 8.743 6.819 -5.506 1.00 0.00 H new ATOM 0 HB2 GLN A 3 8.834 8.811 -3.885 1.00 0.00 H new ATOM 0 HB3 GLN A 3 10.582 8.709 -3.967 1.00 0.00 H new ATOM 0 HG2 GLN A 3 9.426 8.608 -6.662 1.00 0.00 H new ATOM 0 HG3 GLN A 3 8.862 10.032 -5.810 1.00 0.00 H new ATOM 0 HE21 GLN A 3 10.298 11.795 -5.664 1.00 0.00 H new ATOM 0 HE22 GLN A 3 12.018 11.692 -6.054 1.00 0.00 H new ATOM 55 N THR A 4 11.977 6.786 -4.798 1.00 0.00 N ATOM 56 CA THR A 4 13.284 6.343 -5.354 1.00 0.00 C ATOM 57 C THR A 4 13.352 4.816 -5.345 1.00 0.00 C ATOM 58 O THR A 4 13.985 4.214 -6.184 1.00 0.00 O ATOM 59 CB THR A 4 14.421 6.909 -4.499 1.00 0.00 C ATOM 60 OG1 THR A 4 14.072 8.214 -4.055 1.00 0.00 O ATOM 61 CG2 THR A 4 15.702 6.974 -5.330 1.00 0.00 C ATOM 0 H THR A 4 12.030 7.296 -3.916 1.00 0.00 H new ATOM 0 HA THR A 4 13.384 6.705 -6.377 1.00 0.00 H new ATOM 0 HB THR A 4 14.585 6.264 -3.636 1.00 0.00 H new ATOM 0 HG1 THR A 4 14.798 8.578 -3.506 1.00 0.00 H new ATOM 0 HG21 THR A 4 16.511 7.377 -4.721 1.00 0.00 H new ATOM 0 HG22 THR A 4 15.967 5.972 -5.669 1.00 0.00 H new ATOM 0 HG23 THR A 4 15.543 7.619 -6.194 1.00 0.00 H new ATOM 69 N TYR A 5 12.707 4.183 -4.404 1.00 0.00 N ATOM 70 CA TYR A 5 12.742 2.693 -4.353 1.00 0.00 C ATOM 71 C TYR A 5 11.714 2.124 -5.338 1.00 0.00 C ATOM 72 O TYR A 5 11.600 0.928 -5.515 1.00 0.00 O ATOM 73 CB TYR A 5 12.407 2.222 -2.935 1.00 0.00 C ATOM 74 CG TYR A 5 13.257 2.961 -1.928 1.00 0.00 C ATOM 75 CD1 TYR A 5 14.473 3.535 -2.317 1.00 0.00 C ATOM 76 CD2 TYR A 5 12.827 3.067 -0.599 1.00 0.00 C ATOM 77 CE1 TYR A 5 15.259 4.214 -1.379 1.00 0.00 C ATOM 78 CE2 TYR A 5 13.613 3.747 0.339 1.00 0.00 C ATOM 79 CZ TYR A 5 14.829 4.320 -0.051 1.00 0.00 C ATOM 80 OH TYR A 5 15.605 4.990 0.874 1.00 0.00 O ATOM 0 H TYR A 5 12.159 4.631 -3.670 1.00 0.00 H new ATOM 0 HA TYR A 5 13.738 2.343 -4.625 1.00 0.00 H new ATOM 0 HB2 TYR A 5 11.351 2.393 -2.727 1.00 0.00 H new ATOM 0 HB3 TYR A 5 12.579 1.149 -2.850 1.00 0.00 H new ATOM 0 HD1 TYR A 5 14.805 3.454 -3.342 1.00 0.00 H new ATOM 0 HD2 TYR A 5 11.889 2.624 -0.298 1.00 0.00 H new ATOM 0 HE1 TYR A 5 16.197 4.656 -1.680 1.00 0.00 H new ATOM 0 HE2 TYR A 5 13.281 3.829 1.363 1.00 0.00 H new ATOM 0 HH TYR A 5 15.161 4.972 1.748 1.00 0.00 H new ATOM 90 N VAL A 6 10.965 2.972 -5.984 1.00 0.00 N ATOM 91 CA VAL A 6 9.947 2.484 -6.954 1.00 0.00 C ATOM 92 C VAL A 6 10.633 2.219 -8.298 1.00 0.00 C ATOM 93 O VAL A 6 10.344 1.254 -8.978 1.00 0.00 O ATOM 94 CB VAL A 6 8.840 3.555 -7.102 1.00 0.00 C ATOM 95 CG1 VAL A 6 8.438 3.741 -8.572 1.00 0.00 C ATOM 96 CG2 VAL A 6 7.605 3.129 -6.303 1.00 0.00 C ATOM 0 H VAL A 6 11.014 3.986 -5.882 1.00 0.00 H new ATOM 0 HA VAL A 6 9.492 1.558 -6.603 1.00 0.00 H new ATOM 0 HB VAL A 6 9.232 4.499 -6.724 1.00 0.00 H new ATOM 0 HG11 VAL A 6 7.659 4.500 -8.643 1.00 0.00 H new ATOM 0 HG12 VAL A 6 9.307 4.058 -9.149 1.00 0.00 H new ATOM 0 HG13 VAL A 6 8.063 2.798 -8.969 1.00 0.00 H new ATOM 0 HG21 VAL A 6 6.826 3.884 -6.408 1.00 0.00 H new ATOM 0 HG22 VAL A 6 7.239 2.174 -6.681 1.00 0.00 H new ATOM 0 HG23 VAL A 6 7.870 3.025 -5.251 1.00 0.00 H new ATOM 106 N ASP A 7 11.523 3.084 -8.692 1.00 0.00 N ATOM 107 CA ASP A 7 12.211 2.901 -10.000 1.00 0.00 C ATOM 108 C ASP A 7 13.496 2.083 -9.838 1.00 0.00 C ATOM 109 O ASP A 7 14.535 2.454 -10.347 1.00 0.00 O ATOM 110 CB ASP A 7 12.564 4.273 -10.571 1.00 0.00 C ATOM 111 CG ASP A 7 12.478 4.230 -12.098 1.00 0.00 C ATOM 112 OD1 ASP A 7 13.363 3.650 -12.705 1.00 0.00 O ATOM 113 OD2 ASP A 7 11.528 4.775 -12.634 1.00 0.00 O ATOM 0 H ASP A 7 11.805 3.911 -8.165 1.00 0.00 H new ATOM 0 HA ASP A 7 11.541 2.364 -10.672 1.00 0.00 H new ATOM 0 HB2 ASP A 7 11.882 5.028 -10.179 1.00 0.00 H new ATOM 0 HB3 ASP A 7 13.569 4.560 -10.261 1.00 0.00 H new ATOM 118 N THR A 8 13.448 0.971 -9.154 1.00 0.00 N ATOM 119 CA THR A 8 14.689 0.158 -9.005 1.00 0.00 C ATOM 120 C THR A 8 14.360 -1.248 -8.487 1.00 0.00 C ATOM 121 O THR A 8 14.030 -2.135 -9.250 1.00 0.00 O ATOM 122 CB THR A 8 15.653 0.857 -8.044 1.00 0.00 C ATOM 123 OG1 THR A 8 16.532 -0.102 -7.472 1.00 0.00 O ATOM 124 CG2 THR A 8 14.864 1.556 -6.940 1.00 0.00 C ATOM 0 H THR A 8 12.617 0.595 -8.698 1.00 0.00 H new ATOM 0 HA THR A 8 15.160 0.061 -9.983 1.00 0.00 H new ATOM 0 HB THR A 8 16.235 1.599 -8.592 1.00 0.00 H new ATOM 0 HG1 THR A 8 16.558 0.017 -6.500 1.00 0.00 H new ATOM 0 HG21 THR A 8 15.554 2.052 -6.258 1.00 0.00 H new ATOM 0 HG22 THR A 8 14.196 2.295 -7.382 1.00 0.00 H new ATOM 0 HG23 THR A 8 14.277 0.820 -6.390 1.00 0.00 H new ATOM 132 N ASN A 9 14.472 -1.471 -7.205 1.00 0.00 N ATOM 133 CA ASN A 9 14.192 -2.833 -6.658 1.00 0.00 C ATOM 134 C ASN A 9 12.805 -2.890 -6.019 1.00 0.00 C ATOM 135 O ASN A 9 11.927 -3.555 -6.513 1.00 0.00 O ATOM 136 CB ASN A 9 15.244 -3.181 -5.603 1.00 0.00 C ATOM 137 CG ASN A 9 15.792 -4.583 -5.876 1.00 0.00 C ATOM 138 OD1 ASN A 9 15.193 -5.568 -5.491 1.00 0.00 O ATOM 139 ND2 ASN A 9 16.915 -4.715 -6.528 1.00 0.00 N ATOM 0 H ASN A 9 14.744 -0.772 -6.514 1.00 0.00 H new ATOM 0 HA ASN A 9 14.228 -3.549 -7.479 1.00 0.00 H new ATOM 0 HB2 ASN A 9 16.053 -2.451 -5.626 1.00 0.00 H new ATOM 0 HB3 ASN A 9 14.804 -3.138 -4.607 1.00 0.00 H new ATOM 0 HD21 ASN A 9 17.290 -5.645 -6.715 1.00 0.00 H new ATOM 0 HD22 ASN A 9 17.417 -3.888 -6.851 1.00 0.00 H new ATOM 146 N LEU A 10 12.628 -2.215 -4.911 1.00 0.00 N ATOM 147 CA LEU A 10 11.317 -2.222 -4.180 1.00 0.00 C ATOM 148 C LEU A 10 10.145 -2.581 -5.101 1.00 0.00 C ATOM 149 O LEU A 10 9.276 -3.341 -4.729 1.00 0.00 O ATOM 150 CB LEU A 10 11.074 -0.839 -3.578 1.00 0.00 C ATOM 151 CG LEU A 10 10.943 -0.955 -2.059 1.00 0.00 C ATOM 152 CD1 LEU A 10 10.690 0.429 -1.458 1.00 0.00 C ATOM 153 CD2 LEU A 10 9.771 -1.876 -1.717 1.00 0.00 C ATOM 0 H LEU A 10 13.351 -1.646 -4.471 1.00 0.00 H new ATOM 0 HA LEU A 10 11.373 -2.982 -3.400 1.00 0.00 H new ATOM 0 HB2 LEU A 10 11.897 -0.171 -3.832 1.00 0.00 H new ATOM 0 HB3 LEU A 10 10.168 -0.402 -3.999 1.00 0.00 H new ATOM 0 HG LEU A 10 11.865 -1.367 -1.648 1.00 0.00 H new ATOM 0 HD11 LEU A 10 10.597 0.344 -0.375 1.00 0.00 H new ATOM 0 HD12 LEU A 10 11.523 1.089 -1.700 1.00 0.00 H new ATOM 0 HD13 LEU A 10 9.769 0.842 -1.870 1.00 0.00 H new ATOM 0 HD21 LEU A 10 9.677 -1.959 -0.634 1.00 0.00 H new ATOM 0 HD22 LEU A 10 8.851 -1.463 -2.130 1.00 0.00 H new ATOM 0 HD23 LEU A 10 9.948 -2.864 -2.143 1.00 0.00 H new ATOM 165 N VAL A 11 10.095 -2.041 -6.287 1.00 0.00 N ATOM 166 CA VAL A 11 8.951 -2.367 -7.188 1.00 0.00 C ATOM 167 C VAL A 11 9.288 -3.562 -8.085 1.00 0.00 C ATOM 168 O VAL A 11 8.563 -4.536 -8.108 1.00 0.00 O ATOM 169 CB VAL A 11 8.619 -1.152 -8.056 1.00 0.00 C ATOM 170 CG1 VAL A 11 7.653 -1.561 -9.170 1.00 0.00 C ATOM 171 CG2 VAL A 11 7.966 -0.075 -7.190 1.00 0.00 C ATOM 0 H VAL A 11 10.787 -1.396 -6.669 1.00 0.00 H new ATOM 0 HA VAL A 11 8.089 -2.627 -6.573 1.00 0.00 H new ATOM 0 HB VAL A 11 9.536 -0.763 -8.498 1.00 0.00 H new ATOM 0 HG11 VAL A 11 7.419 -0.693 -9.786 1.00 0.00 H new ATOM 0 HG12 VAL A 11 8.115 -2.330 -9.788 1.00 0.00 H new ATOM 0 HG13 VAL A 11 6.735 -1.952 -8.730 1.00 0.00 H new ATOM 0 HG21 VAL A 11 7.728 0.792 -7.806 1.00 0.00 H new ATOM 0 HG22 VAL A 11 7.050 -0.469 -6.749 1.00 0.00 H new ATOM 0 HG23 VAL A 11 8.653 0.220 -6.397 1.00 0.00 H new ATOM 181 N GLY A 12 10.365 -3.498 -8.831 1.00 0.00 N ATOM 182 CA GLY A 12 10.720 -4.647 -9.724 1.00 0.00 C ATOM 183 C GLY A 12 10.437 -5.949 -8.980 1.00 0.00 C ATOM 184 O GLY A 12 9.799 -6.851 -9.486 1.00 0.00 O ATOM 0 H GLY A 12 11.009 -2.707 -8.861 1.00 0.00 H new ATOM 0 HA2 GLY A 12 10.139 -4.604 -10.645 1.00 0.00 H new ATOM 0 HA3 GLY A 12 11.771 -4.595 -10.008 1.00 0.00 H new ATOM 188 N THR A 13 10.888 -6.030 -7.764 1.00 0.00 N ATOM 189 CA THR A 13 10.643 -7.235 -6.935 1.00 0.00 C ATOM 190 C THR A 13 11.605 -7.222 -5.754 1.00 0.00 C ATOM 191 O THR A 13 12.136 -8.236 -5.348 1.00 0.00 O ATOM 192 CB THR A 13 10.845 -8.503 -7.756 1.00 0.00 C ATOM 193 OG1 THR A 13 11.200 -9.582 -6.903 1.00 0.00 O ATOM 194 CG2 THR A 13 11.947 -8.283 -8.797 1.00 0.00 C ATOM 0 H THR A 13 11.426 -5.297 -7.302 1.00 0.00 H new ATOM 0 HA THR A 13 9.613 -7.223 -6.578 1.00 0.00 H new ATOM 0 HB THR A 13 9.913 -8.744 -8.268 1.00 0.00 H new ATOM 0 HG1 THR A 13 12.027 -9.363 -6.425 1.00 0.00 H new ATOM 0 HG21 THR A 13 12.085 -9.194 -9.379 1.00 0.00 H new ATOM 0 HG22 THR A 13 11.662 -7.467 -9.462 1.00 0.00 H new ATOM 0 HG23 THR A 13 12.879 -8.031 -8.292 1.00 0.00 H new ATOM 202 N GLY A 14 11.805 -6.079 -5.167 1.00 0.00 N ATOM 203 CA GLY A 14 12.697 -6.009 -3.982 1.00 0.00 C ATOM 204 C GLY A 14 11.846 -6.306 -2.750 1.00 0.00 C ATOM 205 O GLY A 14 12.175 -5.928 -1.643 1.00 0.00 O ATOM 0 H GLY A 14 11.391 -5.193 -5.455 1.00 0.00 H new ATOM 0 HA2 GLY A 14 13.509 -6.731 -4.070 1.00 0.00 H new ATOM 0 HA3 GLY A 14 13.154 -5.023 -3.904 1.00 0.00 H new ATOM 209 N ALA A 15 10.735 -6.973 -2.958 1.00 0.00 N ATOM 210 CA ALA A 15 9.809 -7.306 -1.843 1.00 0.00 C ATOM 211 C ALA A 15 8.425 -7.454 -2.458 1.00 0.00 C ATOM 212 O ALA A 15 7.625 -8.271 -2.049 1.00 0.00 O ATOM 213 CB ALA A 15 9.795 -6.181 -0.804 1.00 0.00 C ATOM 0 H ALA A 15 10.431 -7.304 -3.874 1.00 0.00 H new ATOM 0 HA ALA A 15 10.123 -8.220 -1.339 1.00 0.00 H new ATOM 0 HB1 ALA A 15 9.112 -6.441 0.005 1.00 0.00 H new ATOM 0 HB2 ALA A 15 10.799 -6.045 -0.402 1.00 0.00 H new ATOM 0 HB3 ALA A 15 9.464 -5.255 -1.275 1.00 0.00 H new ATOM 219 N VAL A 16 8.157 -6.672 -3.468 1.00 0.00 N ATOM 220 CA VAL A 16 6.852 -6.754 -4.161 1.00 0.00 C ATOM 221 C VAL A 16 7.124 -6.744 -5.665 1.00 0.00 C ATOM 222 O VAL A 16 7.953 -5.994 -6.143 1.00 0.00 O ATOM 223 CB VAL A 16 5.974 -5.549 -3.784 1.00 0.00 C ATOM 224 CG1 VAL A 16 4.905 -5.987 -2.784 1.00 0.00 C ATOM 225 CG2 VAL A 16 6.829 -4.447 -3.149 1.00 0.00 C ATOM 0 H VAL A 16 8.799 -5.973 -3.843 1.00 0.00 H new ATOM 0 HA VAL A 16 6.326 -7.663 -3.870 1.00 0.00 H new ATOM 0 HB VAL A 16 5.503 -5.164 -4.688 1.00 0.00 H new ATOM 0 HG11 VAL A 16 4.284 -5.132 -2.518 1.00 0.00 H new ATOM 0 HG12 VAL A 16 4.283 -6.762 -3.232 1.00 0.00 H new ATOM 0 HG13 VAL A 16 5.385 -6.380 -1.888 1.00 0.00 H new ATOM 0 HG21 VAL A 16 6.195 -3.600 -2.887 1.00 0.00 H new ATOM 0 HG22 VAL A 16 7.310 -4.832 -2.250 1.00 0.00 H new ATOM 0 HG23 VAL A 16 7.591 -4.124 -3.858 1.00 0.00 H new ATOM 235 N THR A 17 6.443 -7.559 -6.420 1.00 0.00 N ATOM 236 CA THR A 17 6.685 -7.569 -7.891 1.00 0.00 C ATOM 237 C THR A 17 5.972 -6.369 -8.518 1.00 0.00 C ATOM 238 O THR A 17 5.992 -6.172 -9.717 1.00 0.00 O ATOM 239 CB THR A 17 6.133 -8.864 -8.493 1.00 0.00 C ATOM 240 OG1 THR A 17 4.738 -8.947 -8.236 1.00 0.00 O ATOM 241 CG2 THR A 17 6.842 -10.063 -7.864 1.00 0.00 C ATOM 0 H THR A 17 5.735 -8.214 -6.087 1.00 0.00 H new ATOM 0 HA THR A 17 7.755 -7.510 -8.090 1.00 0.00 H new ATOM 0 HB THR A 17 6.305 -8.867 -9.569 1.00 0.00 H new ATOM 0 HG1 THR A 17 4.244 -8.842 -9.076 1.00 0.00 H new ATOM 0 HG21 THR A 17 6.449 -10.985 -8.293 1.00 0.00 H new ATOM 0 HG22 THR A 17 7.912 -9.998 -8.062 1.00 0.00 H new ATOM 0 HG23 THR A 17 6.672 -10.063 -6.787 1.00 0.00 H new ATOM 249 N GLN A 18 5.353 -5.561 -7.701 1.00 0.00 N ATOM 250 CA GLN A 18 4.634 -4.355 -8.202 1.00 0.00 C ATOM 251 C GLN A 18 4.422 -3.404 -7.022 1.00 0.00 C ATOM 252 O GLN A 18 4.317 -3.831 -5.890 1.00 0.00 O ATOM 253 CB GLN A 18 3.266 -4.749 -8.776 1.00 0.00 C ATOM 254 CG GLN A 18 3.314 -6.175 -9.329 1.00 0.00 C ATOM 255 CD GLN A 18 1.906 -6.608 -9.738 1.00 0.00 C ATOM 256 OE1 GLN A 18 0.933 -5.982 -9.367 1.00 0.00 O ATOM 257 NE2 GLN A 18 1.755 -7.661 -10.493 1.00 0.00 N ATOM 0 H GLN A 18 5.315 -5.688 -6.690 1.00 0.00 H new ATOM 0 HA GLN A 18 5.221 -3.879 -8.988 1.00 0.00 H new ATOM 0 HB2 GLN A 18 2.504 -4.678 -8.000 1.00 0.00 H new ATOM 0 HB3 GLN A 18 2.982 -4.054 -9.566 1.00 0.00 H new ATOM 0 HG2 GLN A 18 3.985 -6.222 -10.187 1.00 0.00 H new ATOM 0 HG3 GLN A 18 3.712 -6.856 -8.576 1.00 0.00 H new ATOM 0 HE21 GLN A 18 2.572 -8.187 -10.805 1.00 0.00 H new ATOM 0 HE22 GLN A 18 0.820 -7.959 -10.772 1.00 0.00 H new ATOM 266 N ALA A 19 4.358 -2.125 -7.265 1.00 0.00 N ATOM 267 CA ALA A 19 4.152 -1.175 -6.134 1.00 0.00 C ATOM 268 C ALA A 19 3.705 0.184 -6.669 1.00 0.00 C ATOM 269 O ALA A 19 4.085 0.595 -7.747 1.00 0.00 O ATOM 270 CB ALA A 19 5.460 -1.009 -5.360 1.00 0.00 C ATOM 0 H ALA A 19 4.438 -1.698 -8.188 1.00 0.00 H new ATOM 0 HA ALA A 19 3.382 -1.572 -5.472 1.00 0.00 H new ATOM 0 HB1 ALA A 19 5.308 -0.314 -4.534 1.00 0.00 H new ATOM 0 HB2 ALA A 19 5.776 -1.976 -4.968 1.00 0.00 H new ATOM 0 HB3 ALA A 19 6.230 -0.618 -6.026 1.00 0.00 H new ATOM 276 N ALA A 20 2.903 0.886 -5.918 1.00 0.00 N ATOM 277 CA ALA A 20 2.432 2.222 -6.373 1.00 0.00 C ATOM 278 C ALA A 20 2.380 3.167 -5.171 1.00 0.00 C ATOM 279 O ALA A 20 2.199 2.745 -4.048 1.00 0.00 O ATOM 280 CB ALA A 20 1.037 2.090 -6.987 1.00 0.00 C ATOM 0 H ALA A 20 2.553 0.591 -5.007 1.00 0.00 H new ATOM 0 HA ALA A 20 3.116 2.620 -7.123 1.00 0.00 H new ATOM 0 HB1 ALA A 20 0.692 3.069 -7.320 1.00 0.00 H new ATOM 0 HB2 ALA A 20 1.077 1.410 -7.838 1.00 0.00 H new ATOM 0 HB3 ALA A 20 0.347 1.697 -6.241 1.00 0.00 H new ATOM 286 N ILE A 21 2.542 4.439 -5.395 1.00 0.00 N ATOM 287 CA ILE A 21 2.509 5.400 -4.258 1.00 0.00 C ATOM 288 C ILE A 21 1.395 6.419 -4.479 1.00 0.00 C ATOM 289 O ILE A 21 1.521 7.339 -5.273 1.00 0.00 O ATOM 290 CB ILE A 21 3.855 6.109 -4.153 1.00 0.00 C ATOM 291 CG1 ILE A 21 4.966 5.062 -4.183 1.00 0.00 C ATOM 292 CG2 ILE A 21 3.923 6.884 -2.836 1.00 0.00 C ATOM 293 CD1 ILE A 21 6.287 5.707 -3.774 1.00 0.00 C ATOM 0 H ILE A 21 2.696 4.855 -6.313 1.00 0.00 H new ATOM 0 HA ILE A 21 2.316 4.861 -3.330 1.00 0.00 H new ATOM 0 HB ILE A 21 3.974 6.803 -4.985 1.00 0.00 H new ATOM 0 HG12 ILE A 21 4.725 4.242 -3.507 1.00 0.00 H new ATOM 0 HG13 ILE A 21 5.052 4.636 -5.183 1.00 0.00 H new ATOM 0 HG21 ILE A 21 4.885 7.391 -2.761 1.00 0.00 H new ATOM 0 HG22 ILE A 21 3.121 7.622 -2.806 1.00 0.00 H new ATOM 0 HG23 ILE A 21 3.811 6.193 -2.001 1.00 0.00 H new ATOM 0 HD11 ILE A 21 7.079 4.959 -3.796 1.00 0.00 H new ATOM 0 HD12 ILE A 21 6.529 6.512 -4.468 1.00 0.00 H new ATOM 0 HD13 ILE A 21 6.198 6.112 -2.766 1.00 0.00 H new ATOM 305 N LEU A 22 0.306 6.242 -3.776 1.00 0.00 N ATOM 306 CA LEU A 22 -0.860 7.163 -3.907 1.00 0.00 C ATOM 307 C LEU A 22 -1.401 7.484 -2.509 1.00 0.00 C ATOM 308 O LEU A 22 -1.088 6.810 -1.547 1.00 0.00 O ATOM 309 CB LEU A 22 -1.962 6.478 -4.725 1.00 0.00 C ATOM 310 CG LEU A 22 -1.767 4.956 -4.689 1.00 0.00 C ATOM 311 CD1 LEU A 22 -3.082 4.255 -5.031 1.00 0.00 C ATOM 312 CD2 LEU A 22 -0.697 4.556 -5.709 1.00 0.00 C ATOM 0 H LEU A 22 0.175 5.485 -3.106 1.00 0.00 H new ATOM 0 HA LEU A 22 -0.549 8.080 -4.408 1.00 0.00 H new ATOM 0 HB2 LEU A 22 -2.941 6.738 -4.323 1.00 0.00 H new ATOM 0 HB3 LEU A 22 -1.936 6.833 -5.755 1.00 0.00 H new ATOM 0 HG LEU A 22 -1.451 4.658 -3.689 1.00 0.00 H new ATOM 0 HD11 LEU A 22 -2.936 3.175 -5.004 1.00 0.00 H new ATOM 0 HD12 LEU A 22 -3.844 4.537 -4.305 1.00 0.00 H new ATOM 0 HD13 LEU A 22 -3.404 4.553 -6.029 1.00 0.00 H new ATOM 0 HD21 LEU A 22 -0.557 3.475 -5.685 1.00 0.00 H new ATOM 0 HD22 LEU A 22 -1.014 4.859 -6.707 1.00 0.00 H new ATOM 0 HD23 LEU A 22 0.243 5.049 -5.462 1.00 0.00 H new ATOM 324 N GLY A 23 -2.207 8.503 -2.383 1.00 0.00 N ATOM 325 CA GLY A 23 -2.755 8.851 -1.040 1.00 0.00 C ATOM 326 C GLY A 23 -2.602 10.350 -0.799 1.00 0.00 C ATOM 327 O GLY A 23 -1.974 11.042 -1.574 1.00 0.00 O ATOM 0 H GLY A 23 -2.509 9.107 -3.147 1.00 0.00 H new ATOM 0 HA2 GLY A 23 -3.806 8.568 -0.980 1.00 0.00 H new ATOM 0 HA3 GLY A 23 -2.230 8.292 -0.265 1.00 0.00 H new ATOM 331 N LEU A 24 -3.158 10.863 0.270 1.00 0.00 N ATOM 332 CA LEU A 24 -3.029 12.293 0.544 1.00 0.00 C ATOM 333 C LEU A 24 -3.660 13.061 -0.608 1.00 0.00 C ATOM 334 O LEU A 24 -3.303 12.903 -1.759 1.00 0.00 O ATOM 335 CB LEU A 24 -1.554 12.616 0.701 1.00 0.00 C ATOM 336 CG LEU A 24 -1.116 12.240 2.121 1.00 0.00 C ATOM 337 CD1 LEU A 24 -0.353 10.913 2.096 1.00 0.00 C ATOM 338 CD2 LEU A 24 -0.209 13.333 2.696 1.00 0.00 C ATOM 0 H LEU A 24 -3.695 10.335 0.958 1.00 0.00 H new ATOM 0 HA LEU A 24 -3.541 12.578 1.463 1.00 0.00 H new ATOM 0 HB2 LEU A 24 -0.967 12.065 -0.034 1.00 0.00 H new ATOM 0 HB3 LEU A 24 -1.378 13.676 0.520 1.00 0.00 H new ATOM 0 HG LEU A 24 -2.003 12.139 2.747 1.00 0.00 H new ATOM 0 HD11 LEU A 24 -0.045 10.652 3.108 1.00 0.00 H new ATOM 0 HD12 LEU A 24 -0.999 10.129 1.700 1.00 0.00 H new ATOM 0 HD13 LEU A 24 0.528 11.012 1.462 1.00 0.00 H new ATOM 0 HD21 LEU A 24 0.098 13.058 3.705 1.00 0.00 H new ATOM 0 HD22 LEU A 24 0.674 13.442 2.066 1.00 0.00 H new ATOM 0 HD23 LEU A 24 -0.752 14.278 2.727 1.00 0.00 H new ATOM 350 N ASP A 25 -4.635 13.854 -0.299 1.00 0.00 N ATOM 351 CA ASP A 25 -5.359 14.622 -1.357 1.00 0.00 C ATOM 352 C ASP A 25 -4.551 15.846 -1.815 1.00 0.00 C ATOM 353 O ASP A 25 -5.104 16.894 -2.084 1.00 0.00 O ATOM 354 CB ASP A 25 -6.703 15.092 -0.799 1.00 0.00 C ATOM 355 CG ASP A 25 -7.750 13.993 -0.989 1.00 0.00 C ATOM 356 OD1 ASP A 25 -7.593 13.204 -1.907 1.00 0.00 O ATOM 357 OD2 ASP A 25 -8.692 13.960 -0.215 1.00 0.00 O ATOM 0 H ASP A 25 -4.972 14.011 0.651 1.00 0.00 H new ATOM 0 HA ASP A 25 -5.505 13.968 -2.216 1.00 0.00 H new ATOM 0 HB2 ASP A 25 -6.604 15.335 0.259 1.00 0.00 H new ATOM 0 HB3 ASP A 25 -7.021 16.003 -1.307 1.00 0.00 H new ATOM 362 N GLY A 26 -3.256 15.720 -1.940 1.00 0.00 N ATOM 363 CA GLY A 26 -2.438 16.868 -2.417 1.00 0.00 C ATOM 364 C GLY A 26 -2.014 16.585 -3.859 1.00 0.00 C ATOM 365 O GLY A 26 -1.885 17.479 -4.672 1.00 0.00 O ATOM 0 H GLY A 26 -2.731 14.870 -1.732 1.00 0.00 H new ATOM 0 HA2 GLY A 26 -3.013 17.793 -2.364 1.00 0.00 H new ATOM 0 HA3 GLY A 26 -1.562 17.001 -1.782 1.00 0.00 H new ATOM 369 N ASN A 27 -1.809 15.333 -4.178 1.00 0.00 N ATOM 370 CA ASN A 27 -1.405 14.957 -5.564 1.00 0.00 C ATOM 371 C ASN A 27 -0.826 13.536 -5.552 1.00 0.00 C ATOM 372 O ASN A 27 -0.860 12.853 -4.548 1.00 0.00 O ATOM 373 CB ASN A 27 -0.345 15.934 -6.077 1.00 0.00 C ATOM 374 CG ASN A 27 -0.903 16.715 -7.267 1.00 0.00 C ATOM 375 OD1 ASN A 27 -0.694 17.907 -7.379 1.00 0.00 O ATOM 376 ND2 ASN A 27 -1.609 16.088 -8.169 1.00 0.00 N ATOM 0 H ASN A 27 -1.905 14.550 -3.532 1.00 0.00 H new ATOM 0 HA ASN A 27 -2.275 14.996 -6.219 1.00 0.00 H new ATOM 0 HB2 ASN A 27 -0.054 16.621 -5.282 1.00 0.00 H new ATOM 0 HB3 ASN A 27 0.552 15.391 -6.374 1.00 0.00 H new ATOM 0 HD21 ASN A 27 -1.985 16.599 -8.968 1.00 0.00 H new ATOM 0 HD22 ASN A 27 -1.784 15.088 -8.075 1.00 0.00 H new ATOM 383 N THR A 28 -0.285 13.088 -6.656 1.00 0.00 N ATOM 384 CA THR A 28 0.304 11.718 -6.696 1.00 0.00 C ATOM 385 C THR A 28 1.818 11.834 -6.511 1.00 0.00 C ATOM 386 O THR A 28 2.337 12.906 -6.269 1.00 0.00 O ATOM 387 CB THR A 28 0.001 11.071 -8.050 1.00 0.00 C ATOM 388 OG1 THR A 28 -1.276 11.501 -8.500 1.00 0.00 O ATOM 389 CG2 THR A 28 0.007 9.549 -7.904 1.00 0.00 C ATOM 0 H THR A 28 -0.226 13.611 -7.529 1.00 0.00 H new ATOM 0 HA THR A 28 -0.123 11.103 -5.904 1.00 0.00 H new ATOM 0 HB THR A 28 0.761 11.366 -8.773 1.00 0.00 H new ATOM 0 HG1 THR A 28 -1.473 11.090 -9.368 1.00 0.00 H new ATOM 0 HG21 THR A 28 -0.209 9.090 -8.869 1.00 0.00 H new ATOM 0 HG22 THR A 28 0.987 9.221 -7.557 1.00 0.00 H new ATOM 0 HG23 THR A 28 -0.753 9.250 -7.182 1.00 0.00 H new ATOM 397 N TRP A 29 2.535 10.751 -6.625 1.00 0.00 N ATOM 398 CA TRP A 29 4.012 10.832 -6.453 1.00 0.00 C ATOM 399 C TRP A 29 4.704 9.886 -7.431 1.00 0.00 C ATOM 400 O TRP A 29 5.559 10.294 -8.192 1.00 0.00 O ATOM 401 CB TRP A 29 4.387 10.454 -5.021 1.00 0.00 C ATOM 402 CG TRP A 29 3.526 11.220 -4.073 1.00 0.00 C ATOM 403 CD1 TRP A 29 3.557 12.561 -3.900 1.00 0.00 C ATOM 404 CD2 TRP A 29 2.508 10.713 -3.169 1.00 0.00 C ATOM 405 NE1 TRP A 29 2.617 12.909 -2.947 1.00 0.00 N ATOM 406 CE2 TRP A 29 1.945 11.803 -2.466 1.00 0.00 C ATOM 407 CE3 TRP A 29 2.023 9.424 -2.896 1.00 0.00 C ATOM 408 CZ2 TRP A 29 0.936 11.619 -1.524 1.00 0.00 C ATOM 409 CZ3 TRP A 29 1.009 9.235 -1.947 1.00 0.00 C ATOM 410 CH2 TRP A 29 0.467 10.330 -1.264 1.00 0.00 C ATOM 0 H TRP A 29 2.167 9.822 -6.828 1.00 0.00 H new ATOM 0 HA TRP A 29 4.337 11.853 -6.654 1.00 0.00 H new ATOM 0 HB2 TRP A 29 4.255 9.383 -4.868 1.00 0.00 H new ATOM 0 HB3 TRP A 29 5.438 10.675 -4.837 1.00 0.00 H new ATOM 0 HD1 TRP A 29 4.209 13.247 -4.420 1.00 0.00 H new ATOM 0 HE1 TRP A 29 2.442 13.865 -2.638 1.00 0.00 H new ATOM 0 HE3 TRP A 29 2.433 8.574 -3.420 1.00 0.00 H new ATOM 0 HZ2 TRP A 29 0.520 12.466 -0.999 1.00 0.00 H new ATOM 0 HZ3 TRP A 29 0.644 8.239 -1.742 1.00 0.00 H new ATOM 0 HH2 TRP A 29 -0.315 10.178 -0.535 1.00 0.00 H new ATOM 421 N ALA A 30 4.358 8.625 -7.429 1.00 0.00 N ATOM 422 CA ALA A 30 5.037 7.698 -8.381 1.00 0.00 C ATOM 423 C ALA A 30 4.444 6.296 -8.275 1.00 0.00 C ATOM 424 O ALA A 30 4.242 5.776 -7.197 1.00 0.00 O ATOM 425 CB ALA A 30 6.529 7.638 -8.052 1.00 0.00 C ATOM 0 H ALA A 30 3.652 8.205 -6.825 1.00 0.00 H new ATOM 0 HA ALA A 30 4.892 8.068 -9.396 1.00 0.00 H new ATOM 0 HB1 ALA A 30 7.028 6.961 -8.746 1.00 0.00 H new ATOM 0 HB2 ALA A 30 6.962 8.634 -8.142 1.00 0.00 H new ATOM 0 HB3 ALA A 30 6.663 7.275 -7.033 1.00 0.00 H new ATOM 431 N THR A 31 4.177 5.678 -9.392 1.00 0.00 N ATOM 432 CA THR A 31 3.607 4.304 -9.371 1.00 0.00 C ATOM 433 C THR A 31 4.344 3.440 -10.397 1.00 0.00 C ATOM 434 O THR A 31 4.932 3.941 -11.334 1.00 0.00 O ATOM 435 CB THR A 31 2.119 4.366 -9.725 1.00 0.00 C ATOM 436 OG1 THR A 31 1.642 3.057 -9.995 1.00 0.00 O ATOM 437 CG2 THR A 31 1.921 5.241 -10.962 1.00 0.00 C ATOM 0 H THR A 31 4.330 6.068 -10.322 1.00 0.00 H new ATOM 0 HA THR A 31 3.723 3.871 -8.378 1.00 0.00 H new ATOM 0 HB THR A 31 1.567 4.792 -8.887 1.00 0.00 H new ATOM 0 HG1 THR A 31 0.689 3.096 -10.220 1.00 0.00 H new ATOM 0 HG21 THR A 31 0.861 5.283 -11.212 1.00 0.00 H new ATOM 0 HG22 THR A 31 2.286 6.248 -10.758 1.00 0.00 H new ATOM 0 HG23 THR A 31 2.474 4.817 -11.800 1.00 0.00 H new ATOM 445 N SER A 32 4.319 2.147 -10.228 1.00 0.00 N ATOM 446 CA SER A 32 5.023 1.257 -11.195 1.00 0.00 C ATOM 447 C SER A 32 4.456 -0.160 -11.095 1.00 0.00 C ATOM 448 O SER A 32 4.795 -0.913 -10.204 1.00 0.00 O ATOM 449 CB SER A 32 6.516 1.232 -10.869 1.00 0.00 C ATOM 450 OG SER A 32 7.122 2.427 -11.345 1.00 0.00 O ATOM 0 H SER A 32 3.843 1.668 -9.464 1.00 0.00 H new ATOM 0 HA SER A 32 4.877 1.634 -12.207 1.00 0.00 H new ATOM 0 HB2 SER A 32 6.663 1.140 -9.793 1.00 0.00 H new ATOM 0 HB3 SER A 32 6.986 0.364 -11.331 1.00 0.00 H new ATOM 0 HG SER A 32 6.431 3.026 -11.698 1.00 0.00 H new ATOM 456 N ALA A 33 3.595 -0.528 -12.003 1.00 0.00 N ATOM 457 CA ALA A 33 3.006 -1.896 -11.964 1.00 0.00 C ATOM 458 C ALA A 33 2.239 -2.150 -13.264 1.00 0.00 C ATOM 459 O ALA A 33 2.402 -1.442 -14.239 1.00 0.00 O ATOM 460 CB ALA A 33 2.051 -2.007 -10.775 1.00 0.00 C ATOM 0 H ALA A 33 3.273 0.061 -12.772 1.00 0.00 H new ATOM 0 HA ALA A 33 3.800 -2.635 -11.858 1.00 0.00 H new ATOM 0 HB1 ALA A 33 1.620 -3.008 -10.747 1.00 0.00 H new ATOM 0 HB2 ALA A 33 2.598 -1.821 -9.851 1.00 0.00 H new ATOM 0 HB3 ALA A 33 1.253 -1.271 -10.879 1.00 0.00 H new ATOM 466 N GLY A 34 1.405 -3.153 -13.291 1.00 0.00 N ATOM 467 CA GLY A 34 0.633 -3.445 -14.533 1.00 0.00 C ATOM 468 C GLY A 34 -0.864 -3.307 -14.252 1.00 0.00 C ATOM 469 O GLY A 34 -1.676 -4.033 -14.791 1.00 0.00 O ATOM 0 H GLY A 34 1.225 -3.782 -12.509 1.00 0.00 H new ATOM 0 HA2 GLY A 34 0.929 -2.759 -15.327 1.00 0.00 H new ATOM 0 HA3 GLY A 34 0.856 -4.453 -14.883 1.00 0.00 H new ATOM 473 N PHE A 35 -1.238 -2.379 -13.414 1.00 0.00 N ATOM 474 CA PHE A 35 -2.684 -2.196 -13.101 1.00 0.00 C ATOM 475 C PHE A 35 -2.993 -0.702 -12.970 1.00 0.00 C ATOM 476 O PHE A 35 -2.385 0.000 -12.188 1.00 0.00 O ATOM 477 CB PHE A 35 -3.019 -2.907 -11.785 1.00 0.00 C ATOM 478 CG PHE A 35 -2.465 -2.114 -10.623 1.00 0.00 C ATOM 479 CD1 PHE A 35 -1.083 -2.057 -10.411 1.00 0.00 C ATOM 480 CD2 PHE A 35 -3.334 -1.434 -9.762 1.00 0.00 C ATOM 481 CE1 PHE A 35 -0.569 -1.319 -9.338 1.00 0.00 C ATOM 482 CE2 PHE A 35 -2.821 -0.695 -8.690 1.00 0.00 C ATOM 483 CZ PHE A 35 -1.438 -0.638 -8.477 1.00 0.00 C ATOM 0 H PHE A 35 -0.605 -1.740 -12.933 1.00 0.00 H new ATOM 0 HA PHE A 35 -3.285 -2.622 -13.904 1.00 0.00 H new ATOM 0 HB2 PHE A 35 -4.099 -3.014 -11.683 1.00 0.00 H new ATOM 0 HB3 PHE A 35 -2.598 -3.912 -11.786 1.00 0.00 H new ATOM 0 HD1 PHE A 35 -0.413 -2.582 -11.075 1.00 0.00 H new ATOM 0 HD2 PHE A 35 -4.401 -1.480 -9.925 1.00 0.00 H new ATOM 0 HE1 PHE A 35 0.498 -1.275 -9.174 1.00 0.00 H new ATOM 0 HE2 PHE A 35 -3.492 -0.169 -8.027 1.00 0.00 H new ATOM 0 HZ PHE A 35 -1.042 -0.069 -7.649 1.00 0.00 H new ATOM 493 N ALA A 36 -3.936 -0.212 -13.727 1.00 0.00 N ATOM 494 CA ALA A 36 -4.282 1.235 -13.640 1.00 0.00 C ATOM 495 C ALA A 36 -5.442 1.423 -12.661 1.00 0.00 C ATOM 496 O ALA A 36 -6.536 0.946 -12.882 1.00 0.00 O ATOM 497 CB ALA A 36 -4.693 1.747 -15.021 1.00 0.00 C ATOM 0 H ALA A 36 -4.481 -0.750 -14.401 1.00 0.00 H new ATOM 0 HA ALA A 36 -3.415 1.795 -13.289 1.00 0.00 H new ATOM 0 HB1 ALA A 36 -4.946 2.805 -14.956 1.00 0.00 H new ATOM 0 HB2 ALA A 36 -3.867 1.613 -15.719 1.00 0.00 H new ATOM 0 HB3 ALA A 36 -5.560 1.188 -15.373 1.00 0.00 H new ATOM 503 N VAL A 37 -5.211 2.113 -11.578 1.00 0.00 N ATOM 504 CA VAL A 37 -6.299 2.327 -10.582 1.00 0.00 C ATOM 505 C VAL A 37 -7.193 3.487 -11.032 1.00 0.00 C ATOM 506 O VAL A 37 -6.730 4.461 -11.592 1.00 0.00 O ATOM 507 CB VAL A 37 -5.681 2.659 -9.222 1.00 0.00 C ATOM 508 CG1 VAL A 37 -6.728 2.470 -8.124 1.00 0.00 C ATOM 509 CG2 VAL A 37 -4.497 1.725 -8.959 1.00 0.00 C ATOM 0 H VAL A 37 -4.315 2.538 -11.340 1.00 0.00 H new ATOM 0 HA VAL A 37 -6.899 1.421 -10.502 1.00 0.00 H new ATOM 0 HB VAL A 37 -5.338 3.694 -9.223 1.00 0.00 H new ATOM 0 HG11 VAL A 37 -6.287 2.707 -7.156 1.00 0.00 H new ATOM 0 HG12 VAL A 37 -7.573 3.133 -8.309 1.00 0.00 H new ATOM 0 HG13 VAL A 37 -7.071 1.436 -8.123 1.00 0.00 H new ATOM 0 HG21 VAL A 37 -4.056 1.961 -7.990 1.00 0.00 H new ATOM 0 HG22 VAL A 37 -4.842 0.691 -8.959 1.00 0.00 H new ATOM 0 HG23 VAL A 37 -3.749 1.857 -9.740 1.00 0.00 H new ATOM 519 N THR A 38 -8.472 3.390 -10.787 1.00 0.00 N ATOM 520 CA THR A 38 -9.398 4.486 -11.196 1.00 0.00 C ATOM 521 C THR A 38 -8.861 5.825 -10.683 1.00 0.00 C ATOM 522 O THR A 38 -8.052 5.858 -9.778 1.00 0.00 O ATOM 523 CB THR A 38 -10.782 4.227 -10.596 1.00 0.00 C ATOM 524 OG1 THR A 38 -10.639 3.840 -9.236 1.00 0.00 O ATOM 525 CG2 THR A 38 -11.475 3.110 -11.377 1.00 0.00 C ATOM 0 H THR A 38 -8.916 2.599 -10.321 1.00 0.00 H new ATOM 0 HA THR A 38 -9.471 4.518 -12.283 1.00 0.00 H new ATOM 0 HB THR A 38 -11.383 5.135 -10.655 1.00 0.00 H new ATOM 0 HG1 THR A 38 -11.524 3.675 -8.848 1.00 0.00 H new ATOM 0 HG21 THR A 38 -12.461 2.925 -10.950 1.00 0.00 H new ATOM 0 HG22 THR A 38 -11.581 3.407 -12.420 1.00 0.00 H new ATOM 0 HG23 THR A 38 -10.878 2.200 -11.318 1.00 0.00 H new ATOM 533 N PRO A 39 -9.329 6.893 -11.279 1.00 0.00 N ATOM 534 CA PRO A 39 -8.905 8.253 -10.898 1.00 0.00 C ATOM 535 C PRO A 39 -9.234 8.523 -9.426 1.00 0.00 C ATOM 536 O PRO A 39 -8.688 9.419 -8.814 1.00 0.00 O ATOM 537 CB PRO A 39 -9.711 9.187 -11.813 1.00 0.00 C ATOM 538 CG PRO A 39 -10.589 8.302 -12.735 1.00 0.00 C ATOM 539 CD PRO A 39 -10.312 6.834 -12.377 1.00 0.00 C ATOM 0 HA PRO A 39 -7.830 8.397 -11.010 1.00 0.00 H new ATOM 0 HB2 PRO A 39 -10.334 9.858 -11.221 1.00 0.00 H new ATOM 0 HB3 PRO A 39 -9.043 9.812 -12.406 1.00 0.00 H new ATOM 0 HG2 PRO A 39 -11.645 8.536 -12.598 1.00 0.00 H new ATOM 0 HG3 PRO A 39 -10.354 8.491 -13.783 1.00 0.00 H new ATOM 0 HD2 PRO A 39 -11.223 6.324 -12.065 1.00 0.00 H new ATOM 0 HD3 PRO A 39 -9.917 6.286 -13.232 1.00 0.00 H new ATOM 547 N ALA A 40 -10.122 7.757 -8.853 1.00 0.00 N ATOM 548 CA ALA A 40 -10.482 7.974 -7.423 1.00 0.00 C ATOM 549 C ALA A 40 -9.547 7.153 -6.529 1.00 0.00 C ATOM 550 O ALA A 40 -9.987 6.429 -5.659 1.00 0.00 O ATOM 551 CB ALA A 40 -11.928 7.528 -7.191 1.00 0.00 C ATOM 0 H ALA A 40 -10.613 6.991 -9.313 1.00 0.00 H new ATOM 0 HA ALA A 40 -10.381 9.032 -7.179 1.00 0.00 H new ATOM 0 HB1 ALA A 40 -12.194 7.686 -6.146 1.00 0.00 H new ATOM 0 HB2 ALA A 40 -12.595 8.110 -7.827 1.00 0.00 H new ATOM 0 HB3 ALA A 40 -12.026 6.470 -7.435 1.00 0.00 H new ATOM 557 N GLN A 41 -8.260 7.255 -6.736 1.00 0.00 N ATOM 558 CA GLN A 41 -7.308 6.473 -5.897 1.00 0.00 C ATOM 559 C GLN A 41 -7.136 7.154 -4.535 1.00 0.00 C ATOM 560 O GLN A 41 -7.326 6.548 -3.499 1.00 0.00 O ATOM 561 CB GLN A 41 -5.949 6.403 -6.596 1.00 0.00 C ATOM 562 CG GLN A 41 -6.150 6.114 -8.084 1.00 0.00 C ATOM 563 CD GLN A 41 -4.787 5.986 -8.766 1.00 0.00 C ATOM 564 OE1 GLN A 41 -3.766 5.944 -8.108 1.00 0.00 O ATOM 565 NE2 GLN A 41 -4.726 5.923 -10.068 1.00 0.00 N ATOM 0 H GLN A 41 -7.829 7.845 -7.448 1.00 0.00 H new ATOM 0 HA GLN A 41 -7.702 5.467 -5.754 1.00 0.00 H new ATOM 0 HB2 GLN A 41 -5.414 7.344 -6.467 1.00 0.00 H new ATOM 0 HB3 GLN A 41 -5.336 5.623 -6.144 1.00 0.00 H new ATOM 0 HG2 GLN A 41 -6.721 5.195 -8.213 1.00 0.00 H new ATOM 0 HG3 GLN A 41 -6.727 6.915 -8.547 1.00 0.00 H new ATOM 0 HE21 GLN A 41 -5.582 5.958 -10.621 1.00 0.00 H new ATOM 0 HE22 GLN A 41 -3.822 5.839 -10.533 1.00 0.00 H new ATOM 574 N GLY A 42 -6.767 8.407 -4.530 1.00 0.00 N ATOM 575 CA GLY A 42 -6.571 9.123 -3.237 1.00 0.00 C ATOM 576 C GLY A 42 -7.927 9.412 -2.589 1.00 0.00 C ATOM 577 O GLY A 42 -8.011 9.698 -1.411 1.00 0.00 O ATOM 0 H GLY A 42 -6.593 8.965 -5.366 1.00 0.00 H new ATOM 0 HA2 GLY A 42 -5.959 8.519 -2.566 1.00 0.00 H new ATOM 0 HA3 GLY A 42 -6.033 10.056 -3.406 1.00 0.00 H new ATOM 581 N GLN A 43 -8.988 9.342 -3.344 1.00 0.00 N ATOM 582 CA GLN A 43 -10.333 9.615 -2.762 1.00 0.00 C ATOM 583 C GLN A 43 -10.931 8.313 -2.227 1.00 0.00 C ATOM 584 O GLN A 43 -11.851 8.321 -1.434 1.00 0.00 O ATOM 585 CB GLN A 43 -11.251 10.189 -3.842 1.00 0.00 C ATOM 586 CG GLN A 43 -12.529 10.725 -3.193 1.00 0.00 C ATOM 587 CD GLN A 43 -13.694 10.595 -4.177 1.00 0.00 C ATOM 588 OE1 GLN A 43 -14.314 9.555 -4.268 1.00 0.00 O ATOM 589 NE2 GLN A 43 -14.020 11.616 -4.922 1.00 0.00 N ATOM 0 H GLN A 43 -8.983 9.108 -4.337 1.00 0.00 H new ATOM 0 HA GLN A 43 -10.236 10.333 -1.948 1.00 0.00 H new ATOM 0 HB2 GLN A 43 -10.741 10.988 -4.381 1.00 0.00 H new ATOM 0 HB3 GLN A 43 -11.497 9.418 -4.573 1.00 0.00 H new ATOM 0 HG2 GLN A 43 -12.746 10.170 -2.280 1.00 0.00 H new ATOM 0 HG3 GLN A 43 -12.395 11.768 -2.908 1.00 0.00 H new ATOM 0 HE21 GLN A 43 -13.499 12.490 -4.846 1.00 0.00 H new ATOM 0 HE22 GLN A 43 -14.795 11.540 -5.580 1.00 0.00 H new ATOM 598 N THR A 44 -10.418 7.194 -2.658 1.00 0.00 N ATOM 599 CA THR A 44 -10.960 5.893 -2.176 1.00 0.00 C ATOM 600 C THR A 44 -10.210 5.461 -0.915 1.00 0.00 C ATOM 601 O THR A 44 -10.727 4.731 -0.094 1.00 0.00 O ATOM 602 CB THR A 44 -10.786 4.832 -3.266 1.00 0.00 C ATOM 603 OG1 THR A 44 -11.583 5.180 -4.393 1.00 0.00 O ATOM 604 CG2 THR A 44 -11.222 3.468 -2.725 1.00 0.00 C ATOM 0 H THR A 44 -9.647 7.124 -3.323 1.00 0.00 H new ATOM 0 HA THR A 44 -12.019 6.005 -1.945 1.00 0.00 H new ATOM 0 HB THR A 44 -9.739 4.781 -3.565 1.00 0.00 H new ATOM 0 HG1 THR A 44 -11.202 5.969 -4.832 1.00 0.00 H new ATOM 0 HG21 THR A 44 -11.098 2.712 -3.501 1.00 0.00 H new ATOM 0 HG22 THR A 44 -10.609 3.206 -1.862 1.00 0.00 H new ATOM 0 HG23 THR A 44 -12.269 3.513 -2.426 1.00 0.00 H new ATOM 612 N LEU A 45 -8.993 5.903 -0.756 1.00 0.00 N ATOM 613 CA LEU A 45 -8.212 5.512 0.452 1.00 0.00 C ATOM 614 C LEU A 45 -8.606 6.400 1.634 1.00 0.00 C ATOM 615 O LEU A 45 -8.839 5.924 2.727 1.00 0.00 O ATOM 616 CB LEU A 45 -6.719 5.676 0.168 1.00 0.00 C ATOM 617 CG LEU A 45 -6.142 4.342 -0.306 1.00 0.00 C ATOM 618 CD1 LEU A 45 -4.665 4.518 -0.658 1.00 0.00 C ATOM 619 CD2 LEU A 45 -6.280 3.304 0.811 1.00 0.00 C ATOM 0 H LEU A 45 -8.506 6.517 -1.409 1.00 0.00 H new ATOM 0 HA LEU A 45 -8.426 4.472 0.697 1.00 0.00 H new ATOM 0 HB2 LEU A 45 -6.564 6.442 -0.592 1.00 0.00 H new ATOM 0 HB3 LEU A 45 -6.201 6.010 1.067 1.00 0.00 H new ATOM 0 HG LEU A 45 -6.686 4.004 -1.188 1.00 0.00 H new ATOM 0 HD11 LEU A 45 -4.255 3.566 -0.996 1.00 0.00 H new ATOM 0 HD12 LEU A 45 -4.566 5.258 -1.452 1.00 0.00 H new ATOM 0 HD13 LEU A 45 -4.119 4.856 0.223 1.00 0.00 H new ATOM 0 HD21 LEU A 45 -5.869 2.352 0.476 1.00 0.00 H new ATOM 0 HD22 LEU A 45 -5.736 3.643 1.692 1.00 0.00 H new ATOM 0 HD23 LEU A 45 -7.333 3.177 1.061 1.00 0.00 H new ATOM 631 N ALA A 46 -8.679 7.687 1.429 1.00 0.00 N ATOM 632 CA ALA A 46 -9.053 8.596 2.548 1.00 0.00 C ATOM 633 C ALA A 46 -10.485 8.293 2.994 1.00 0.00 C ATOM 634 O ALA A 46 -10.802 8.335 4.166 1.00 0.00 O ATOM 635 CB ALA A 46 -8.960 10.050 2.081 1.00 0.00 C ATOM 0 H ALA A 46 -8.496 8.147 0.537 1.00 0.00 H new ATOM 0 HA ALA A 46 -8.371 8.441 3.384 1.00 0.00 H new ATOM 0 HB1 ALA A 46 -9.234 10.714 2.901 1.00 0.00 H new ATOM 0 HB2 ALA A 46 -7.939 10.266 1.765 1.00 0.00 H new ATOM 0 HB3 ALA A 46 -9.640 10.208 1.244 1.00 0.00 H new ATOM 641 N SER A 47 -11.353 7.984 2.069 1.00 0.00 N ATOM 642 CA SER A 47 -12.762 7.677 2.443 1.00 0.00 C ATOM 643 C SER A 47 -12.840 6.259 3.011 1.00 0.00 C ATOM 644 O SER A 47 -13.554 5.999 3.960 1.00 0.00 O ATOM 645 CB SER A 47 -13.652 7.780 1.204 1.00 0.00 C ATOM 646 OG SER A 47 -13.433 9.035 0.573 1.00 0.00 O ATOM 0 H SER A 47 -11.147 7.931 1.071 1.00 0.00 H new ATOM 0 HA SER A 47 -13.103 8.389 3.195 1.00 0.00 H new ATOM 0 HB2 SER A 47 -13.428 6.968 0.512 1.00 0.00 H new ATOM 0 HB3 SER A 47 -14.700 7.679 1.485 1.00 0.00 H new ATOM 0 HG SER A 47 -12.785 8.927 -0.154 1.00 0.00 H new ATOM 652 N ALA A 48 -12.110 5.341 2.440 1.00 0.00 N ATOM 653 CA ALA A 48 -12.141 3.942 2.951 1.00 0.00 C ATOM 654 C ALA A 48 -11.763 3.938 4.433 1.00 0.00 C ATOM 655 O ALA A 48 -12.207 3.103 5.195 1.00 0.00 O ATOM 656 CB ALA A 48 -11.145 3.086 2.165 1.00 0.00 C ATOM 0 H ALA A 48 -11.494 5.499 1.643 1.00 0.00 H new ATOM 0 HA ALA A 48 -13.143 3.531 2.828 1.00 0.00 H new ATOM 0 HB1 ALA A 48 -11.169 2.063 2.540 1.00 0.00 H new ATOM 0 HB2 ALA A 48 -11.415 3.092 1.109 1.00 0.00 H new ATOM 0 HB3 ALA A 48 -10.141 3.493 2.285 1.00 0.00 H new ATOM 662 N PHE A 49 -10.950 4.871 4.849 1.00 0.00 N ATOM 663 CA PHE A 49 -10.547 4.925 6.283 1.00 0.00 C ATOM 664 C PHE A 49 -11.573 5.743 7.070 1.00 0.00 C ATOM 665 O PHE A 49 -11.269 6.791 7.603 1.00 0.00 O ATOM 666 CB PHE A 49 -9.173 5.586 6.405 1.00 0.00 C ATOM 667 CG PHE A 49 -8.139 4.730 5.716 1.00 0.00 C ATOM 668 CD1 PHE A 49 -8.135 3.344 5.909 1.00 0.00 C ATOM 669 CD2 PHE A 49 -7.185 5.324 4.883 1.00 0.00 C ATOM 670 CE1 PHE A 49 -7.176 2.551 5.268 1.00 0.00 C ATOM 671 CE2 PHE A 49 -6.225 4.531 4.242 1.00 0.00 C ATOM 672 CZ PHE A 49 -6.221 3.144 4.435 1.00 0.00 C ATOM 0 H PHE A 49 -10.548 5.598 4.258 1.00 0.00 H new ATOM 0 HA PHE A 49 -10.501 3.912 6.683 1.00 0.00 H new ATOM 0 HB2 PHE A 49 -9.195 6.580 5.957 1.00 0.00 H new ATOM 0 HB3 PHE A 49 -8.912 5.715 7.455 1.00 0.00 H new ATOM 0 HD1 PHE A 49 -8.872 2.886 6.552 1.00 0.00 H new ATOM 0 HD2 PHE A 49 -7.189 6.394 4.734 1.00 0.00 H new ATOM 0 HE1 PHE A 49 -7.173 1.481 5.416 1.00 0.00 H new ATOM 0 HE2 PHE A 49 -5.488 4.989 3.599 1.00 0.00 H new ATOM 0 HZ PHE A 49 -5.481 2.532 3.941 1.00 0.00 H new ATOM 682 N ASN A 50 -12.787 5.271 7.150 1.00 0.00 N ATOM 683 CA ASN A 50 -13.830 6.021 7.906 1.00 0.00 C ATOM 684 C ASN A 50 -14.018 5.376 9.279 1.00 0.00 C ATOM 685 O ASN A 50 -13.661 5.937 10.296 1.00 0.00 O ATOM 686 CB ASN A 50 -15.151 5.975 7.135 1.00 0.00 C ATOM 687 CG ASN A 50 -16.025 7.166 7.538 1.00 0.00 C ATOM 688 OD1 ASN A 50 -15.774 7.802 8.650 1.00 0.00 O flip ATOM 689 ND2 ASN A 50 -16.946 7.523 6.831 1.00 0.00 N flip ATOM 0 H ASN A 50 -13.102 4.399 6.725 1.00 0.00 H new ATOM 0 HA ASN A 50 -13.519 7.058 8.029 1.00 0.00 H new ATOM 0 HB2 ASN A 50 -14.958 5.999 6.062 1.00 0.00 H new ATOM 0 HB3 ASN A 50 -15.673 5.041 7.344 1.00 0.00 H new ATOM 0 HD21 ASN A 50 -17.144 7.027 5.962 1.00 0.00 H new ATOM 0 HD22 ASN A 50 -17.522 8.319 7.107 1.00 0.00 H new ATOM 696 N ASN A 51 -14.574 4.197 9.315 1.00 0.00 N ATOM 697 CA ASN A 51 -14.786 3.508 10.618 1.00 0.00 C ATOM 698 C ASN A 51 -14.450 2.023 10.459 1.00 0.00 C ATOM 699 O ASN A 51 -15.051 1.169 11.080 1.00 0.00 O ATOM 700 CB ASN A 51 -16.249 3.662 11.041 1.00 0.00 C ATOM 701 CG ASN A 51 -16.494 2.890 12.338 1.00 0.00 C ATOM 702 OD1 ASN A 51 -15.887 3.265 13.431 1.00 0.00 O flip ATOM 703 ND2 ASN A 51 -17.246 1.935 12.358 1.00 0.00 N flip ATOM 0 H ASN A 51 -14.892 3.680 8.495 1.00 0.00 H new ATOM 0 HA ASN A 51 -14.142 3.949 11.379 1.00 0.00 H new ATOM 0 HB2 ASN A 51 -16.488 4.716 11.183 1.00 0.00 H new ATOM 0 HB3 ASN A 51 -16.906 3.290 10.255 1.00 0.00 H new ATOM 0 HD21 ASN A 51 -17.721 1.642 11.504 1.00 0.00 H new ATOM 0 HD22 ASN A 51 -17.402 1.427 13.229 1.00 0.00 H new ATOM 710 N ALA A 52 -13.493 1.710 9.626 1.00 0.00 N ATOM 711 CA ALA A 52 -13.118 0.282 9.421 1.00 0.00 C ATOM 712 C ALA A 52 -14.378 -0.547 9.164 1.00 0.00 C ATOM 713 O ALA A 52 -14.397 -1.742 9.375 1.00 0.00 O ATOM 714 CB ALA A 52 -12.407 -0.243 10.671 1.00 0.00 C ATOM 0 H ALA A 52 -12.955 2.382 9.079 1.00 0.00 H new ATOM 0 HA ALA A 52 -12.451 0.202 8.563 1.00 0.00 H new ATOM 0 HB1 ALA A 52 -12.132 -1.287 10.522 1.00 0.00 H new ATOM 0 HB2 ALA A 52 -11.508 0.346 10.853 1.00 0.00 H new ATOM 0 HB3 ALA A 52 -13.074 -0.162 11.530 1.00 0.00 H new ATOM 720 N ASP A 53 -15.436 0.078 8.721 1.00 0.00 N ATOM 721 CA ASP A 53 -16.695 -0.679 8.464 1.00 0.00 C ATOM 722 C ASP A 53 -16.713 -1.229 7.029 1.00 0.00 C ATOM 723 O ASP A 53 -16.855 -2.419 6.835 1.00 0.00 O ATOM 724 CB ASP A 53 -17.900 0.241 8.678 1.00 0.00 C ATOM 725 CG ASP A 53 -18.643 -0.178 9.948 1.00 0.00 C ATOM 726 OD1 ASP A 53 -19.157 -1.284 9.972 1.00 0.00 O ATOM 727 OD2 ASP A 53 -18.686 0.615 10.875 1.00 0.00 O ATOM 0 H ASP A 53 -15.483 1.078 8.526 1.00 0.00 H new ATOM 0 HA ASP A 53 -16.746 -1.518 9.158 1.00 0.00 H new ATOM 0 HB2 ASP A 53 -17.570 1.276 8.762 1.00 0.00 H new ATOM 0 HB3 ASP A 53 -18.568 0.188 7.819 1.00 0.00 H new ATOM 732 N PRO A 54 -16.588 -0.351 6.061 1.00 0.00 N ATOM 733 CA PRO A 54 -16.609 -0.749 4.640 1.00 0.00 C ATOM 734 C PRO A 54 -15.395 -1.618 4.295 1.00 0.00 C ATOM 735 O PRO A 54 -15.501 -2.589 3.572 1.00 0.00 O ATOM 736 CB PRO A 54 -16.553 0.571 3.861 1.00 0.00 C ATOM 737 CG PRO A 54 -16.396 1.719 4.890 1.00 0.00 C ATOM 738 CD PRO A 54 -16.415 1.095 6.294 1.00 0.00 C ATOM 0 HA PRO A 54 -17.493 -1.340 4.399 1.00 0.00 H new ATOM 0 HB2 PRO A 54 -15.717 0.567 3.162 1.00 0.00 H new ATOM 0 HB3 PRO A 54 -17.460 0.706 3.272 1.00 0.00 H new ATOM 0 HG2 PRO A 54 -15.463 2.257 4.723 1.00 0.00 H new ATOM 0 HG3 PRO A 54 -17.204 2.442 4.782 1.00 0.00 H new ATOM 0 HD2 PRO A 54 -15.489 1.301 6.831 1.00 0.00 H new ATOM 0 HD3 PRO A 54 -17.229 1.499 6.896 1.00 0.00 H new ATOM 746 N ILE A 55 -14.242 -1.273 4.797 1.00 0.00 N ATOM 747 CA ILE A 55 -13.025 -2.085 4.480 1.00 0.00 C ATOM 748 C ILE A 55 -13.048 -3.388 5.282 1.00 0.00 C ATOM 749 O ILE A 55 -12.643 -4.428 4.803 1.00 0.00 O ATOM 750 CB ILE A 55 -11.734 -1.314 4.814 1.00 0.00 C ATOM 751 CG1 ILE A 55 -12.022 -0.151 5.769 1.00 0.00 C ATOM 752 CG2 ILE A 55 -11.122 -0.765 3.527 1.00 0.00 C ATOM 753 CD1 ILE A 55 -10.703 0.509 6.176 1.00 0.00 C ATOM 0 H ILE A 55 -14.086 -0.472 5.408 1.00 0.00 H new ATOM 0 HA ILE A 55 -13.036 -2.300 3.411 1.00 0.00 H new ATOM 0 HB ILE A 55 -11.040 -2.000 5.298 1.00 0.00 H new ATOM 0 HG12 ILE A 55 -12.673 0.578 5.286 1.00 0.00 H new ATOM 0 HG13 ILE A 55 -12.548 -0.513 6.652 1.00 0.00 H new ATOM 0 HG21 ILE A 55 -10.208 -0.219 3.763 1.00 0.00 H new ATOM 0 HG22 ILE A 55 -10.889 -1.590 2.854 1.00 0.00 H new ATOM 0 HG23 ILE A 55 -11.832 -0.093 3.044 1.00 0.00 H new ATOM 0 HD11 ILE A 55 -10.905 1.337 6.856 1.00 0.00 H new ATOM 0 HD12 ILE A 55 -10.068 -0.223 6.675 1.00 0.00 H new ATOM 0 HD13 ILE A 55 -10.195 0.884 5.288 1.00 0.00 H new ATOM 765 N ARG A 56 -13.512 -3.341 6.499 1.00 0.00 N ATOM 766 CA ARG A 56 -13.550 -4.579 7.330 1.00 0.00 C ATOM 767 C ARG A 56 -14.593 -5.551 6.770 1.00 0.00 C ATOM 768 O ARG A 56 -14.266 -6.618 6.288 1.00 0.00 O ATOM 769 CB ARG A 56 -13.922 -4.211 8.769 1.00 0.00 C ATOM 770 CG ARG A 56 -14.044 -5.483 9.614 1.00 0.00 C ATOM 771 CD ARG A 56 -15.339 -5.433 10.431 1.00 0.00 C ATOM 772 NE ARG A 56 -15.071 -5.883 11.828 1.00 0.00 N ATOM 773 CZ ARG A 56 -15.941 -5.640 12.774 1.00 0.00 C ATOM 774 NH1 ARG A 56 -17.044 -4.995 12.502 1.00 0.00 N ATOM 775 NH2 ARG A 56 -15.706 -6.040 13.994 1.00 0.00 N ATOM 0 H ARG A 56 -13.867 -2.500 6.955 1.00 0.00 H new ATOM 0 HA ARG A 56 -12.569 -5.055 7.311 1.00 0.00 H new ATOM 0 HB2 ARG A 56 -13.164 -3.553 9.193 1.00 0.00 H new ATOM 0 HB3 ARG A 56 -14.864 -3.663 8.782 1.00 0.00 H new ATOM 0 HG2 ARG A 56 -14.042 -6.362 8.969 1.00 0.00 H new ATOM 0 HG3 ARG A 56 -13.185 -5.574 10.279 1.00 0.00 H new ATOM 0 HD2 ARG A 56 -15.738 -4.419 10.436 1.00 0.00 H new ATOM 0 HD3 ARG A 56 -16.095 -6.071 9.972 1.00 0.00 H new ATOM 0 HE ARG A 56 -14.208 -6.381 12.046 1.00 0.00 H new ATOM 0 HH11 ARG A 56 -17.229 -4.679 11.550 1.00 0.00 H new ATOM 0 HH12 ARG A 56 -17.721 -4.807 13.242 1.00 0.00 H new ATOM 0 HH21 ARG A 56 -14.844 -6.542 14.209 1.00 0.00 H new ATOM 0 HH22 ARG A 56 -16.384 -5.851 14.732 1.00 0.00 H new ATOM 789 N ALA A 57 -15.846 -5.197 6.843 1.00 0.00 N ATOM 790 CA ALA A 57 -16.913 -6.104 6.330 1.00 0.00 C ATOM 791 C ALA A 57 -16.969 -6.039 4.800 1.00 0.00 C ATOM 792 O ALA A 57 -17.098 -4.978 4.221 1.00 0.00 O ATOM 793 CB ALA A 57 -18.263 -5.674 6.910 1.00 0.00 C ATOM 0 H ALA A 57 -16.179 -4.317 7.237 1.00 0.00 H new ATOM 0 HA ALA A 57 -16.690 -7.127 6.633 1.00 0.00 H new ATOM 0 HB1 ALA A 57 -19.046 -6.334 6.537 1.00 0.00 H new ATOM 0 HB2 ALA A 57 -18.227 -5.732 7.998 1.00 0.00 H new ATOM 0 HB3 ALA A 57 -18.479 -4.649 6.608 1.00 0.00 H new ATOM 799 N SER A 58 -16.880 -7.172 4.150 1.00 0.00 N ATOM 800 CA SER A 58 -16.934 -7.206 2.657 1.00 0.00 C ATOM 801 C SER A 58 -15.554 -6.889 2.071 1.00 0.00 C ATOM 802 O SER A 58 -15.112 -7.518 1.130 1.00 0.00 O ATOM 803 CB SER A 58 -17.949 -6.181 2.150 1.00 0.00 C ATOM 804 OG SER A 58 -18.376 -6.551 0.845 1.00 0.00 O ATOM 0 H SER A 58 -16.771 -8.084 4.595 1.00 0.00 H new ATOM 0 HA SER A 58 -17.237 -8.204 2.341 1.00 0.00 H new ATOM 0 HB2 SER A 58 -18.803 -6.133 2.825 1.00 0.00 H new ATOM 0 HB3 SER A 58 -17.502 -5.187 2.131 1.00 0.00 H new ATOM 0 HG SER A 58 -19.028 -5.897 0.517 1.00 0.00 H new ATOM 810 N GLY A 59 -14.871 -5.916 2.610 1.00 0.00 N ATOM 811 CA GLY A 59 -13.527 -5.563 2.071 1.00 0.00 C ATOM 812 C GLY A 59 -13.668 -4.412 1.073 1.00 0.00 C ATOM 813 O GLY A 59 -14.722 -3.826 0.933 1.00 0.00 O ATOM 0 H GLY A 59 -15.185 -5.351 3.399 1.00 0.00 H new ATOM 0 HA2 GLY A 59 -12.861 -5.275 2.884 1.00 0.00 H new ATOM 0 HA3 GLY A 59 -13.079 -6.429 1.584 1.00 0.00 H new ATOM 817 N PHE A 60 -12.614 -4.083 0.376 1.00 0.00 N ATOM 818 CA PHE A 60 -12.695 -2.968 -0.611 1.00 0.00 C ATOM 819 C PHE A 60 -12.218 -3.460 -1.980 1.00 0.00 C ATOM 820 O PHE A 60 -11.589 -4.494 -2.094 1.00 0.00 O ATOM 821 CB PHE A 60 -11.811 -1.809 -0.144 1.00 0.00 C ATOM 822 CG PHE A 60 -10.359 -2.212 -0.230 1.00 0.00 C ATOM 823 CD1 PHE A 60 -9.644 -1.997 -1.413 1.00 0.00 C ATOM 824 CD2 PHE A 60 -9.727 -2.799 0.873 1.00 0.00 C ATOM 825 CE1 PHE A 60 -8.297 -2.368 -1.495 1.00 0.00 C ATOM 826 CE2 PHE A 60 -8.380 -3.170 0.792 1.00 0.00 C ATOM 827 CZ PHE A 60 -7.665 -2.955 -0.392 1.00 0.00 C ATOM 0 H PHE A 60 -11.703 -4.536 0.447 1.00 0.00 H new ATOM 0 HA PHE A 60 -13.727 -2.627 -0.691 1.00 0.00 H new ATOM 0 HB2 PHE A 60 -11.992 -0.929 -0.761 1.00 0.00 H new ATOM 0 HB3 PHE A 60 -12.063 -1.536 0.881 1.00 0.00 H new ATOM 0 HD1 PHE A 60 -10.132 -1.544 -2.264 1.00 0.00 H new ATOM 0 HD2 PHE A 60 -10.279 -2.965 1.786 1.00 0.00 H new ATOM 0 HE1 PHE A 60 -7.745 -2.202 -2.408 1.00 0.00 H new ATOM 0 HE2 PHE A 60 -7.892 -3.622 1.643 1.00 0.00 H new ATOM 0 HZ PHE A 60 -6.626 -3.242 -0.455 1.00 0.00 H new ATOM 837 N ASP A 61 -12.515 -2.730 -3.024 1.00 0.00 N ATOM 838 CA ASP A 61 -12.080 -3.162 -4.383 1.00 0.00 C ATOM 839 C ASP A 61 -11.353 -2.014 -5.086 1.00 0.00 C ATOM 840 O ASP A 61 -11.462 -0.866 -4.702 1.00 0.00 O ATOM 841 CB ASP A 61 -13.306 -3.565 -5.205 1.00 0.00 C ATOM 842 CG ASP A 61 -14.087 -4.649 -4.459 1.00 0.00 C ATOM 843 OD1 ASP A 61 -13.452 -5.504 -3.863 1.00 0.00 O ATOM 844 OD2 ASP A 61 -15.305 -4.605 -4.495 1.00 0.00 O ATOM 0 H ASP A 61 -13.039 -1.855 -2.993 1.00 0.00 H new ATOM 0 HA ASP A 61 -11.404 -4.012 -4.290 1.00 0.00 H new ATOM 0 HB2 ASP A 61 -13.942 -2.697 -5.378 1.00 0.00 H new ATOM 0 HB3 ASP A 61 -12.996 -3.933 -6.183 1.00 0.00 H new ATOM 849 N LEU A 62 -10.612 -2.317 -6.118 1.00 0.00 N ATOM 850 CA LEU A 62 -9.876 -1.249 -6.854 1.00 0.00 C ATOM 851 C LEU A 62 -10.015 -1.490 -8.360 1.00 0.00 C ATOM 852 O LEU A 62 -11.023 -1.980 -8.827 1.00 0.00 O ATOM 853 CB LEU A 62 -8.398 -1.281 -6.455 1.00 0.00 C ATOM 854 CG LEU A 62 -8.273 -1.091 -4.942 1.00 0.00 C ATOM 855 CD1 LEU A 62 -6.829 -1.358 -4.510 1.00 0.00 C ATOM 856 CD2 LEU A 62 -8.653 0.347 -4.579 1.00 0.00 C ATOM 0 H LEU A 62 -10.485 -3.261 -6.484 1.00 0.00 H new ATOM 0 HA LEU A 62 -10.292 -0.273 -6.604 1.00 0.00 H new ATOM 0 HB2 LEU A 62 -7.951 -2.230 -6.751 1.00 0.00 H new ATOM 0 HB3 LEU A 62 -7.852 -0.495 -6.977 1.00 0.00 H new ATOM 0 HG LEU A 62 -8.939 -1.787 -4.432 1.00 0.00 H new ATOM 0 HD11 LEU A 62 -6.741 -1.222 -3.432 1.00 0.00 H new ATOM 0 HD12 LEU A 62 -6.554 -2.380 -4.771 1.00 0.00 H new ATOM 0 HD13 LEU A 62 -6.162 -0.662 -5.019 1.00 0.00 H new ATOM 0 HD21 LEU A 62 -8.565 0.486 -3.501 1.00 0.00 H new ATOM 0 HD22 LEU A 62 -7.984 1.040 -5.090 1.00 0.00 H new ATOM 0 HD23 LEU A 62 -9.681 0.541 -4.887 1.00 0.00 H new ATOM 868 N ALA A 63 -9.015 -1.148 -9.125 1.00 0.00 N ATOM 869 CA ALA A 63 -9.102 -1.360 -10.596 1.00 0.00 C ATOM 870 C ALA A 63 -9.454 -2.821 -10.885 1.00 0.00 C ATOM 871 O ALA A 63 -10.409 -3.114 -11.576 1.00 0.00 O ATOM 872 CB ALA A 63 -7.759 -1.020 -11.243 1.00 0.00 C ATOM 0 H ALA A 63 -8.144 -0.732 -8.796 1.00 0.00 H new ATOM 0 HA ALA A 63 -9.877 -0.713 -11.008 1.00 0.00 H new ATOM 0 HB1 ALA A 63 -7.824 -1.176 -12.320 1.00 0.00 H new ATOM 0 HB2 ALA A 63 -7.511 0.022 -11.041 1.00 0.00 H new ATOM 0 HB3 ALA A 63 -6.983 -1.664 -10.830 1.00 0.00 H new ATOM 878 N GLY A 64 -8.690 -3.743 -10.363 1.00 0.00 N ATOM 879 CA GLY A 64 -8.987 -5.182 -10.614 1.00 0.00 C ATOM 880 C GLY A 64 -8.444 -6.035 -9.466 1.00 0.00 C ATOM 881 O GLY A 64 -8.242 -7.225 -9.606 1.00 0.00 O ATOM 0 H GLY A 64 -7.876 -3.562 -9.776 1.00 0.00 H new ATOM 0 HA2 GLY A 64 -10.063 -5.329 -10.710 1.00 0.00 H new ATOM 0 HA3 GLY A 64 -8.537 -5.496 -11.556 1.00 0.00 H new ATOM 885 N VAL A 65 -8.208 -5.439 -8.330 1.00 0.00 N ATOM 886 CA VAL A 65 -7.680 -6.218 -7.174 1.00 0.00 C ATOM 887 C VAL A 65 -8.436 -5.818 -5.905 1.00 0.00 C ATOM 888 O VAL A 65 -8.878 -4.695 -5.763 1.00 0.00 O ATOM 889 CB VAL A 65 -6.189 -5.923 -6.997 1.00 0.00 C ATOM 890 CG1 VAL A 65 -5.693 -6.559 -5.698 1.00 0.00 C ATOM 891 CG2 VAL A 65 -5.411 -6.505 -8.179 1.00 0.00 C ATOM 0 H VAL A 65 -8.358 -4.446 -8.152 1.00 0.00 H new ATOM 0 HA VAL A 65 -7.818 -7.283 -7.359 1.00 0.00 H new ATOM 0 HB VAL A 65 -6.035 -4.845 -6.955 1.00 0.00 H new ATOM 0 HG11 VAL A 65 -4.631 -6.349 -5.572 1.00 0.00 H new ATOM 0 HG12 VAL A 65 -6.247 -6.145 -4.856 1.00 0.00 H new ATOM 0 HG13 VAL A 65 -5.847 -7.637 -5.739 1.00 0.00 H new ATOM 0 HG21 VAL A 65 -4.349 -6.295 -8.054 1.00 0.00 H new ATOM 0 HG22 VAL A 65 -5.566 -7.583 -8.221 1.00 0.00 H new ATOM 0 HG23 VAL A 65 -5.764 -6.052 -9.105 1.00 0.00 H new ATOM 901 N HIS A 66 -8.593 -6.726 -4.981 1.00 0.00 N ATOM 902 CA HIS A 66 -9.324 -6.387 -3.728 1.00 0.00 C ATOM 903 C HIS A 66 -8.845 -7.287 -2.588 1.00 0.00 C ATOM 904 O HIS A 66 -8.275 -8.338 -2.807 1.00 0.00 O ATOM 905 CB HIS A 66 -10.825 -6.591 -3.943 1.00 0.00 C ATOM 906 CG HIS A 66 -11.067 -7.954 -4.529 1.00 0.00 C ATOM 907 ND1 HIS A 66 -10.559 -8.328 -5.763 1.00 0.00 N ATOM 908 CD2 HIS A 66 -11.761 -9.044 -4.063 1.00 0.00 C ATOM 909 CE1 HIS A 66 -10.950 -9.595 -5.996 1.00 0.00 C ATOM 910 NE2 HIS A 66 -11.685 -10.078 -4.991 1.00 0.00 N ATOM 0 H HIS A 66 -8.248 -7.684 -5.039 1.00 0.00 H new ATOM 0 HA HIS A 66 -9.130 -5.346 -3.469 1.00 0.00 H new ATOM 0 HB2 HIS A 66 -11.356 -6.491 -2.996 1.00 0.00 H new ATOM 0 HB3 HIS A 66 -11.215 -5.822 -4.610 1.00 0.00 H new ATOM 0 HD2 HIS A 66 -12.286 -9.091 -3.120 1.00 0.00 H new ATOM 0 HE1 HIS A 66 -10.700 -10.152 -6.887 1.00 0.00 H new ATOM 0 HE2 HIS A 66 -12.102 -11.006 -4.919 1.00 0.00 H new ATOM 918 N TYR A 67 -9.073 -6.879 -1.369 1.00 0.00 N ATOM 919 CA TYR A 67 -8.633 -7.702 -0.208 1.00 0.00 C ATOM 920 C TYR A 67 -9.713 -7.674 0.876 1.00 0.00 C ATOM 921 O TYR A 67 -10.729 -7.021 0.737 1.00 0.00 O ATOM 922 CB TYR A 67 -7.333 -7.129 0.361 1.00 0.00 C ATOM 923 CG TYR A 67 -6.307 -7.018 -0.739 1.00 0.00 C ATOM 924 CD1 TYR A 67 -6.302 -5.899 -1.579 1.00 0.00 C ATOM 925 CD2 TYR A 67 -5.360 -8.033 -0.919 1.00 0.00 C ATOM 926 CE1 TYR A 67 -5.350 -5.794 -2.600 1.00 0.00 C ATOM 927 CE2 TYR A 67 -4.408 -7.930 -1.940 1.00 0.00 C ATOM 928 CZ TYR A 67 -4.403 -6.810 -2.781 1.00 0.00 C ATOM 929 OH TYR A 67 -3.465 -6.706 -3.789 1.00 0.00 O ATOM 0 H TYR A 67 -9.546 -6.008 -1.127 1.00 0.00 H new ATOM 0 HA TYR A 67 -8.468 -8.729 -0.535 1.00 0.00 H new ATOM 0 HB2 TYR A 67 -7.517 -6.149 0.801 1.00 0.00 H new ATOM 0 HB3 TYR A 67 -6.959 -7.771 1.158 1.00 0.00 H new ATOM 0 HD1 TYR A 67 -7.033 -5.116 -1.440 1.00 0.00 H new ATOM 0 HD2 TYR A 67 -5.364 -8.896 -0.270 1.00 0.00 H new ATOM 0 HE1 TYR A 67 -5.346 -4.930 -3.248 1.00 0.00 H new ATOM 0 HE2 TYR A 67 -3.678 -8.714 -2.079 1.00 0.00 H new ATOM 0 HH TYR A 67 -2.883 -7.494 -3.777 1.00 0.00 H new ATOM 939 N VAL A 68 -9.500 -8.373 1.956 1.00 0.00 N ATOM 940 CA VAL A 68 -10.510 -8.383 3.050 1.00 0.00 C ATOM 941 C VAL A 68 -10.174 -7.281 4.055 1.00 0.00 C ATOM 942 O VAL A 68 -11.040 -6.729 4.704 1.00 0.00 O ATOM 943 CB VAL A 68 -10.485 -9.744 3.747 1.00 0.00 C ATOM 944 CG1 VAL A 68 -9.248 -9.848 4.643 1.00 0.00 C ATOM 945 CG2 VAL A 68 -11.747 -9.904 4.597 1.00 0.00 C ATOM 0 H VAL A 68 -8.669 -8.938 2.128 1.00 0.00 H new ATOM 0 HA VAL A 68 -11.504 -8.206 2.639 1.00 0.00 H new ATOM 0 HB VAL A 68 -10.449 -10.532 2.995 1.00 0.00 H new ATOM 0 HG11 VAL A 68 -9.237 -10.820 5.136 1.00 0.00 H new ATOM 0 HG12 VAL A 68 -8.349 -9.739 4.036 1.00 0.00 H new ATOM 0 HG13 VAL A 68 -9.276 -9.060 5.395 1.00 0.00 H new ATOM 0 HG21 VAL A 68 -11.730 -10.874 5.094 1.00 0.00 H new ATOM 0 HG22 VAL A 68 -11.784 -9.113 5.346 1.00 0.00 H new ATOM 0 HG23 VAL A 68 -12.627 -9.839 3.957 1.00 0.00 H new ATOM 955 N THR A 69 -8.918 -6.959 4.181 1.00 0.00 N ATOM 956 CA THR A 69 -8.508 -5.893 5.135 1.00 0.00 C ATOM 957 C THR A 69 -8.841 -6.330 6.562 1.00 0.00 C ATOM 958 O THR A 69 -9.990 -6.390 6.952 1.00 0.00 O ATOM 959 CB THR A 69 -9.257 -4.602 4.805 1.00 0.00 C ATOM 960 OG1 THR A 69 -8.922 -4.186 3.488 1.00 0.00 O ATOM 961 CG2 THR A 69 -8.867 -3.511 5.802 1.00 0.00 C ATOM 0 H THR A 69 -8.154 -7.391 3.661 1.00 0.00 H new ATOM 0 HA THR A 69 -7.435 -5.721 5.052 1.00 0.00 H new ATOM 0 HB THR A 69 -10.331 -4.779 4.869 1.00 0.00 H new ATOM 0 HG1 THR A 69 -9.240 -3.270 3.343 1.00 0.00 H new ATOM 0 HG21 THR A 69 -9.403 -2.592 5.564 1.00 0.00 H new ATOM 0 HG22 THR A 69 -9.126 -3.831 6.811 1.00 0.00 H new ATOM 0 HG23 THR A 69 -7.794 -3.331 5.743 1.00 0.00 H new ATOM 969 N LEU A 70 -7.843 -6.636 7.344 1.00 0.00 N ATOM 970 CA LEU A 70 -8.095 -7.071 8.747 1.00 0.00 C ATOM 971 C LEU A 70 -8.107 -5.849 9.666 1.00 0.00 C ATOM 972 O LEU A 70 -9.127 -5.483 10.214 1.00 0.00 O ATOM 973 CB LEU A 70 -6.984 -8.028 9.184 1.00 0.00 C ATOM 974 CG LEU A 70 -6.944 -9.227 8.236 1.00 0.00 C ATOM 975 CD1 LEU A 70 -5.576 -9.904 8.325 1.00 0.00 C ATOM 976 CD2 LEU A 70 -8.030 -10.227 8.634 1.00 0.00 C ATOM 0 H LEU A 70 -6.861 -6.603 7.071 1.00 0.00 H new ATOM 0 HA LEU A 70 -9.059 -7.577 8.806 1.00 0.00 H new ATOM 0 HB2 LEU A 70 -6.023 -7.514 9.178 1.00 0.00 H new ATOM 0 HB3 LEU A 70 -7.160 -8.364 10.206 1.00 0.00 H new ATOM 0 HG LEU A 70 -7.116 -8.887 7.215 1.00 0.00 H new ATOM 0 HD11 LEU A 70 -5.548 -10.759 7.649 1.00 0.00 H new ATOM 0 HD12 LEU A 70 -4.799 -9.193 8.043 1.00 0.00 H new ATOM 0 HD13 LEU A 70 -5.404 -10.244 9.346 1.00 0.00 H new ATOM 0 HD21 LEU A 70 -8.002 -11.082 7.959 1.00 0.00 H new ATOM 0 HD22 LEU A 70 -7.856 -10.565 9.655 1.00 0.00 H new ATOM 0 HD23 LEU A 70 -9.007 -9.747 8.572 1.00 0.00 H new ATOM 988 N ARG A 71 -6.979 -5.215 9.837 1.00 0.00 N ATOM 989 CA ARG A 71 -6.924 -4.015 10.719 1.00 0.00 C ATOM 990 C ARG A 71 -6.649 -2.773 9.867 1.00 0.00 C ATOM 991 O ARG A 71 -5.825 -2.793 8.974 1.00 0.00 O ATOM 992 CB ARG A 71 -5.804 -4.190 11.747 1.00 0.00 C ATOM 993 CG ARG A 71 -4.526 -4.646 11.038 1.00 0.00 C ATOM 994 CD ARG A 71 -3.318 -3.937 11.653 1.00 0.00 C ATOM 995 NE ARG A 71 -2.552 -4.897 12.498 1.00 0.00 N ATOM 996 CZ ARG A 71 -1.333 -4.612 12.875 1.00 0.00 C ATOM 997 NH1 ARG A 71 -0.782 -3.483 12.517 1.00 0.00 N ATOM 998 NH2 ARG A 71 -0.666 -5.459 13.610 1.00 0.00 N ATOM 0 H ARG A 71 -6.093 -5.476 9.404 1.00 0.00 H new ATOM 0 HA ARG A 71 -7.876 -3.897 11.237 1.00 0.00 H new ATOM 0 HB2 ARG A 71 -5.627 -3.251 12.271 1.00 0.00 H new ATOM 0 HB3 ARG A 71 -6.097 -4.923 12.498 1.00 0.00 H new ATOM 0 HG2 ARG A 71 -4.412 -5.726 11.130 1.00 0.00 H new ATOM 0 HG3 ARG A 71 -4.589 -4.422 9.973 1.00 0.00 H new ATOM 0 HD2 ARG A 71 -2.678 -3.539 10.866 1.00 0.00 H new ATOM 0 HD3 ARG A 71 -3.648 -3.090 12.255 1.00 0.00 H new ATOM 0 HE ARG A 71 -2.980 -5.778 12.783 1.00 0.00 H new ATOM 0 HH11 ARG A 71 -1.303 -2.821 11.942 1.00 0.00 H new ATOM 0 HH12 ARG A 71 0.169 -3.263 12.813 1.00 0.00 H new ATOM 0 HH21 ARG A 71 -1.096 -6.341 13.889 1.00 0.00 H new ATOM 0 HH22 ARG A 71 0.285 -5.239 13.905 1.00 0.00 H new ATOM 1012 N ALA A 72 -7.333 -1.694 10.132 1.00 0.00 N ATOM 1013 CA ALA A 72 -7.110 -0.456 9.332 1.00 0.00 C ATOM 1014 C ALA A 72 -7.601 0.760 10.123 1.00 0.00 C ATOM 1015 O ALA A 72 -8.753 1.138 10.045 1.00 0.00 O ATOM 1016 CB ALA A 72 -7.885 -0.557 8.015 1.00 0.00 C ATOM 0 H ALA A 72 -8.036 -1.616 10.867 1.00 0.00 H new ATOM 0 HA ALA A 72 -6.046 -0.344 9.122 1.00 0.00 H new ATOM 0 HB1 ALA A 72 -7.724 0.347 7.428 1.00 0.00 H new ATOM 0 HB2 ALA A 72 -7.535 -1.422 7.452 1.00 0.00 H new ATOM 0 HB3 ALA A 72 -8.949 -0.668 8.226 1.00 0.00 H new ATOM 1022 N ASP A 73 -6.735 1.377 10.885 1.00 0.00 N ATOM 1023 CA ASP A 73 -7.154 2.568 11.680 1.00 0.00 C ATOM 1024 C ASP A 73 -5.974 3.069 12.516 1.00 0.00 C ATOM 1025 O ASP A 73 -5.848 4.248 12.782 1.00 0.00 O ATOM 1026 CB ASP A 73 -8.306 2.186 12.612 1.00 0.00 C ATOM 1027 CG ASP A 73 -8.926 3.455 13.203 1.00 0.00 C ATOM 1028 OD1 ASP A 73 -8.631 4.526 12.699 1.00 0.00 O ATOM 1029 OD2 ASP A 73 -9.685 3.333 14.150 1.00 0.00 O ATOM 0 H ASP A 73 -5.757 1.107 10.990 1.00 0.00 H new ATOM 0 HA ASP A 73 -7.481 3.355 11.000 1.00 0.00 H new ATOM 0 HB2 ASP A 73 -9.060 1.621 12.063 1.00 0.00 H new ATOM 0 HB3 ASP A 73 -7.943 1.540 13.411 1.00 0.00 H new ATOM 1034 N ASP A 74 -5.111 2.186 12.938 1.00 0.00 N ATOM 1035 CA ASP A 74 -3.946 2.622 13.759 1.00 0.00 C ATOM 1036 C ASP A 74 -3.020 3.491 12.906 1.00 0.00 C ATOM 1037 O ASP A 74 -3.201 4.688 12.804 1.00 0.00 O ATOM 1038 CB ASP A 74 -3.185 1.392 14.261 1.00 0.00 C ATOM 1039 CG ASP A 74 -3.557 1.123 15.721 1.00 0.00 C ATOM 1040 OD1 ASP A 74 -3.213 1.940 16.560 1.00 0.00 O ATOM 1041 OD2 ASP A 74 -4.177 0.104 15.975 1.00 0.00 O ATOM 0 H ASP A 74 -5.162 1.185 12.751 1.00 0.00 H new ATOM 0 HA ASP A 74 -4.297 3.200 14.614 1.00 0.00 H new ATOM 0 HB2 ASP A 74 -3.428 0.525 13.647 1.00 0.00 H new ATOM 0 HB3 ASP A 74 -2.111 1.554 14.172 1.00 0.00 H new ATOM 1046 N ARG A 75 -2.030 2.905 12.291 1.00 0.00 N ATOM 1047 CA ARG A 75 -1.101 3.709 11.449 1.00 0.00 C ATOM 1048 C ARG A 75 -0.779 2.946 10.162 1.00 0.00 C ATOM 1049 O ARG A 75 -0.946 3.456 9.072 1.00 0.00 O ATOM 1050 CB ARG A 75 0.189 3.978 12.227 1.00 0.00 C ATOM 1051 CG ARG A 75 -0.154 4.318 13.680 1.00 0.00 C ATOM 1052 CD ARG A 75 -0.923 5.638 13.726 1.00 0.00 C ATOM 1053 NE ARG A 75 -0.108 6.670 14.440 1.00 0.00 N ATOM 1054 CZ ARG A 75 0.439 6.418 15.602 1.00 0.00 C ATOM 1055 NH1 ARG A 75 0.137 5.329 16.260 1.00 0.00 N ATOM 1056 NH2 ARG A 75 1.249 7.290 16.137 1.00 0.00 N ATOM 0 H ARG A 75 -1.825 1.907 12.335 1.00 0.00 H new ATOM 0 HA ARG A 75 -1.573 4.657 11.193 1.00 0.00 H new ATOM 0 HB2 ARG A 75 0.838 3.103 12.190 1.00 0.00 H new ATOM 0 HB3 ARG A 75 0.738 4.801 11.769 1.00 0.00 H new ATOM 0 HG2 ARG A 75 -0.753 3.520 14.120 1.00 0.00 H new ATOM 0 HG3 ARG A 75 0.758 4.395 14.272 1.00 0.00 H new ATOM 0 HD2 ARG A 75 -1.148 5.974 12.714 1.00 0.00 H new ATOM 0 HD3 ARG A 75 -1.877 5.497 14.235 1.00 0.00 H new ATOM 0 HE ARG A 75 0.024 7.587 14.013 1.00 0.00 H new ATOM 0 HH11 ARG A 75 -0.531 4.665 15.868 1.00 0.00 H new ATOM 0 HH12 ARG A 75 0.570 5.143 17.165 1.00 0.00 H new ATOM 0 HH21 ARG A 75 1.453 8.163 15.650 1.00 0.00 H new ATOM 0 HH22 ARG A 75 1.678 7.099 17.042 1.00 0.00 H new ATOM 1070 N SER A 76 -0.322 1.729 10.274 1.00 0.00 N ATOM 1071 CA SER A 76 0.004 0.944 9.049 1.00 0.00 C ATOM 1072 C SER A 76 -1.234 0.166 8.599 1.00 0.00 C ATOM 1073 O SER A 76 -2.171 -0.012 9.351 1.00 0.00 O ATOM 1074 CB SER A 76 1.136 -0.034 9.353 1.00 0.00 C ATOM 1075 OG SER A 76 2.365 0.677 9.420 1.00 0.00 O ATOM 0 H SER A 76 -0.161 1.245 11.157 1.00 0.00 H new ATOM 0 HA SER A 76 0.316 1.624 8.256 1.00 0.00 H new ATOM 0 HB2 SER A 76 0.947 -0.546 10.297 1.00 0.00 H new ATOM 0 HB3 SER A 76 1.188 -0.800 8.580 1.00 0.00 H new ATOM 0 HG SER A 76 3.112 0.044 9.380 1.00 0.00 H new ATOM 1081 N ILE A 77 -1.250 -0.297 7.376 1.00 0.00 N ATOM 1082 CA ILE A 77 -2.437 -1.056 6.890 1.00 0.00 C ATOM 1083 C ILE A 77 -2.025 -2.034 5.786 1.00 0.00 C ATOM 1084 O ILE A 77 -2.153 -1.744 4.613 1.00 0.00 O ATOM 1085 CB ILE A 77 -3.470 -0.079 6.323 1.00 0.00 C ATOM 1086 CG1 ILE A 77 -4.054 0.768 7.456 1.00 0.00 C ATOM 1087 CG2 ILE A 77 -4.596 -0.863 5.645 1.00 0.00 C ATOM 1088 CD1 ILE A 77 -3.242 2.056 7.601 1.00 0.00 C ATOM 0 H ILE A 77 -0.497 -0.183 6.698 1.00 0.00 H new ATOM 0 HA ILE A 77 -2.863 -1.611 7.725 1.00 0.00 H new ATOM 0 HB ILE A 77 -2.987 0.572 5.595 1.00 0.00 H new ATOM 0 HG12 ILE A 77 -5.097 1.005 7.247 1.00 0.00 H new ATOM 0 HG13 ILE A 77 -4.036 0.207 8.390 1.00 0.00 H new ATOM 0 HG21 ILE A 77 -5.332 -0.167 5.241 1.00 0.00 H new ATOM 0 HG22 ILE A 77 -4.184 -1.465 4.836 1.00 0.00 H new ATOM 0 HG23 ILE A 77 -5.076 -1.515 6.375 1.00 0.00 H new ATOM 0 HD11 ILE A 77 -3.658 2.659 8.408 1.00 0.00 H new ATOM 0 HD12 ILE A 77 -2.205 1.809 7.830 1.00 0.00 H new ATOM 0 HD13 ILE A 77 -3.283 2.619 6.669 1.00 0.00 H new ATOM 1100 N TYR A 78 -1.554 -3.199 6.143 1.00 0.00 N ATOM 1101 CA TYR A 78 -1.168 -4.190 5.097 1.00 0.00 C ATOM 1102 C TYR A 78 -2.317 -5.190 4.938 1.00 0.00 C ATOM 1103 O TYR A 78 -2.465 -6.108 5.719 1.00 0.00 O ATOM 1104 CB TYR A 78 0.112 -4.940 5.500 1.00 0.00 C ATOM 1105 CG TYR A 78 0.833 -4.208 6.608 1.00 0.00 C ATOM 1106 CD1 TYR A 78 0.478 -4.440 7.942 1.00 0.00 C ATOM 1107 CD2 TYR A 78 1.863 -3.305 6.302 1.00 0.00 C ATOM 1108 CE1 TYR A 78 1.148 -3.770 8.971 1.00 0.00 C ATOM 1109 CE2 TYR A 78 2.533 -2.637 7.334 1.00 0.00 C ATOM 1110 CZ TYR A 78 2.176 -2.870 8.668 1.00 0.00 C ATOM 1111 OH TYR A 78 2.837 -2.209 9.684 1.00 0.00 O ATOM 0 H TYR A 78 -1.421 -3.506 7.107 1.00 0.00 H new ATOM 0 HA TYR A 78 -0.975 -3.670 4.159 1.00 0.00 H new ATOM 0 HB2 TYR A 78 -0.139 -5.949 5.827 1.00 0.00 H new ATOM 0 HB3 TYR A 78 0.769 -5.040 4.636 1.00 0.00 H new ATOM 0 HD1 TYR A 78 -0.313 -5.136 8.177 1.00 0.00 H new ATOM 0 HD2 TYR A 78 2.138 -3.126 5.273 1.00 0.00 H new ATOM 0 HE1 TYR A 78 0.872 -3.947 10.000 1.00 0.00 H new ATOM 0 HE2 TYR A 78 3.326 -1.941 7.101 1.00 0.00 H new ATOM 0 HH TYR A 78 3.758 -2.022 9.407 1.00 0.00 H new ATOM 1121 N GLY A 79 -3.147 -5.006 3.946 1.00 0.00 N ATOM 1122 CA GLY A 79 -4.302 -5.931 3.757 1.00 0.00 C ATOM 1123 C GLY A 79 -3.871 -7.184 2.991 1.00 0.00 C ATOM 1124 O GLY A 79 -2.807 -7.238 2.407 1.00 0.00 O ATOM 0 H GLY A 79 -3.075 -4.256 3.259 1.00 0.00 H new ATOM 0 HA2 GLY A 79 -4.710 -6.214 4.727 1.00 0.00 H new ATOM 0 HA3 GLY A 79 -5.097 -5.422 3.213 1.00 0.00 H new ATOM 1128 N LYS A 80 -4.704 -8.192 2.990 1.00 0.00 N ATOM 1129 CA LYS A 80 -4.371 -9.451 2.264 1.00 0.00 C ATOM 1130 C LYS A 80 -5.671 -10.109 1.788 1.00 0.00 C ATOM 1131 O LYS A 80 -6.747 -9.755 2.225 1.00 0.00 O ATOM 1132 CB LYS A 80 -3.629 -10.402 3.203 1.00 0.00 C ATOM 1133 CG LYS A 80 -4.537 -10.773 4.376 1.00 0.00 C ATOM 1134 CD LYS A 80 -5.377 -11.997 4.003 1.00 0.00 C ATOM 1135 CE LYS A 80 -5.761 -12.760 5.272 1.00 0.00 C ATOM 1136 NZ LYS A 80 -7.220 -13.063 5.248 1.00 0.00 N ATOM 0 H LYS A 80 -5.607 -8.196 3.465 1.00 0.00 H new ATOM 0 HA LYS A 80 -3.736 -9.227 1.407 1.00 0.00 H new ATOM 0 HB2 LYS A 80 -3.328 -11.300 2.664 1.00 0.00 H new ATOM 0 HB3 LYS A 80 -2.718 -9.930 3.570 1.00 0.00 H new ATOM 0 HG2 LYS A 80 -3.937 -10.986 5.261 1.00 0.00 H new ATOM 0 HG3 LYS A 80 -5.187 -9.935 4.626 1.00 0.00 H new ATOM 0 HD2 LYS A 80 -6.274 -11.686 3.468 1.00 0.00 H new ATOM 0 HD3 LYS A 80 -4.815 -12.646 3.332 1.00 0.00 H new ATOM 0 HE2 LYS A 80 -5.188 -13.685 5.341 1.00 0.00 H new ATOM 0 HE3 LYS A 80 -5.516 -12.167 6.153 1.00 0.00 H new ATOM 0 HZ1 LYS A 80 -7.386 -14.002 5.662 1.00 0.00 H new ATOM 0 HZ2 LYS A 80 -7.733 -12.346 5.800 1.00 0.00 H new ATOM 0 HZ3 LYS A 80 -7.561 -13.053 4.265 1.00 0.00 H new ATOM 1150 N LYS A 81 -5.588 -11.059 0.894 1.00 0.00 N ATOM 1151 CA LYS A 81 -6.833 -11.717 0.400 1.00 0.00 C ATOM 1152 C LYS A 81 -6.692 -13.243 0.462 1.00 0.00 C ATOM 1153 O LYS A 81 -7.647 -13.967 0.260 1.00 0.00 O ATOM 1154 CB LYS A 81 -7.092 -11.290 -1.047 1.00 0.00 C ATOM 1155 CG LYS A 81 -5.780 -11.328 -1.834 1.00 0.00 C ATOM 1156 CD LYS A 81 -6.053 -10.996 -3.303 1.00 0.00 C ATOM 1157 CE LYS A 81 -6.403 -12.278 -4.062 1.00 0.00 C ATOM 1158 NZ LYS A 81 -6.888 -11.930 -5.427 1.00 0.00 N ATOM 0 H LYS A 81 -4.719 -11.406 0.487 1.00 0.00 H new ATOM 0 HA LYS A 81 -7.667 -11.414 1.032 1.00 0.00 H new ATOM 0 HB2 LYS A 81 -7.824 -11.954 -1.508 1.00 0.00 H new ATOM 0 HB3 LYS A 81 -7.514 -10.285 -1.071 1.00 0.00 H new ATOM 0 HG2 LYS A 81 -5.072 -10.613 -1.415 1.00 0.00 H new ATOM 0 HG3 LYS A 81 -5.324 -12.314 -1.752 1.00 0.00 H new ATOM 0 HD2 LYS A 81 -6.872 -10.281 -3.379 1.00 0.00 H new ATOM 0 HD3 LYS A 81 -5.177 -10.525 -3.749 1.00 0.00 H new ATOM 0 HE2 LYS A 81 -5.528 -12.924 -4.129 1.00 0.00 H new ATOM 0 HE3 LYS A 81 -7.170 -12.835 -3.523 1.00 0.00 H new ATOM 0 HZ1 LYS A 81 -7.126 -12.801 -5.943 1.00 0.00 H new ATOM 0 HZ2 LYS A 81 -7.734 -11.330 -5.352 1.00 0.00 H new ATOM 0 HZ3 LYS A 81 -6.143 -11.416 -5.940 1.00 0.00 H new ATOM 1172 N GLY A 82 -5.517 -13.741 0.733 1.00 0.00 N ATOM 1173 CA GLY A 82 -5.335 -15.220 0.797 1.00 0.00 C ATOM 1174 C GLY A 82 -4.353 -15.658 -0.290 1.00 0.00 C ATOM 1175 O GLY A 82 -3.722 -16.692 -0.195 1.00 0.00 O ATOM 0 H GLY A 82 -4.677 -13.191 0.912 1.00 0.00 H new ATOM 0 HA2 GLY A 82 -4.961 -15.509 1.779 1.00 0.00 H new ATOM 0 HA3 GLY A 82 -6.293 -15.722 0.661 1.00 0.00 H new ATOM 1179 N SER A 83 -4.216 -14.873 -1.323 1.00 0.00 N ATOM 1180 CA SER A 83 -3.272 -15.232 -2.417 1.00 0.00 C ATOM 1181 C SER A 83 -2.310 -14.066 -2.645 1.00 0.00 C ATOM 1182 O SER A 83 -1.112 -14.198 -2.493 1.00 0.00 O ATOM 1183 CB SER A 83 -4.057 -15.506 -3.700 1.00 0.00 C ATOM 1184 OG SER A 83 -5.378 -15.908 -3.364 1.00 0.00 O ATOM 0 H SER A 83 -4.719 -13.996 -1.456 1.00 0.00 H new ATOM 0 HA SER A 83 -2.711 -16.125 -2.142 1.00 0.00 H new ATOM 0 HB2 SER A 83 -4.084 -14.611 -4.322 1.00 0.00 H new ATOM 0 HB3 SER A 83 -3.564 -16.285 -4.282 1.00 0.00 H new ATOM 0 HG SER A 83 -5.885 -16.083 -4.184 1.00 0.00 H new ATOM 1190 N ALA A 84 -2.828 -12.921 -2.996 1.00 0.00 N ATOM 1191 CA ALA A 84 -1.947 -11.741 -3.221 1.00 0.00 C ATOM 1192 C ALA A 84 -1.985 -10.851 -1.977 1.00 0.00 C ATOM 1193 O ALA A 84 -2.507 -11.233 -0.949 1.00 0.00 O ATOM 1194 CB ALA A 84 -2.445 -10.950 -4.433 1.00 0.00 C ATOM 0 H ALA A 84 -3.824 -12.752 -3.137 1.00 0.00 H new ATOM 0 HA ALA A 84 -0.926 -12.073 -3.408 1.00 0.00 H new ATOM 0 HB1 ALA A 84 -1.799 -10.087 -4.595 1.00 0.00 H new ATOM 0 HB2 ALA A 84 -2.427 -11.588 -5.316 1.00 0.00 H new ATOM 0 HB3 ALA A 84 -3.465 -10.610 -4.252 1.00 0.00 H new ATOM 1200 N GLY A 85 -1.440 -9.668 -2.057 1.00 0.00 N ATOM 1201 CA GLY A 85 -1.456 -8.768 -0.870 1.00 0.00 C ATOM 1202 C GLY A 85 -1.064 -7.350 -1.287 1.00 0.00 C ATOM 1203 O GLY A 85 -0.345 -7.148 -2.246 1.00 0.00 O ATOM 0 H GLY A 85 -0.987 -9.288 -2.888 1.00 0.00 H new ATOM 0 HA2 GLY A 85 -2.449 -8.763 -0.420 1.00 0.00 H new ATOM 0 HA3 GLY A 85 -0.765 -9.138 -0.113 1.00 0.00 H new ATOM 1207 N VAL A 86 -1.528 -6.365 -0.567 1.00 0.00 N ATOM 1208 CA VAL A 86 -1.181 -4.957 -0.908 1.00 0.00 C ATOM 1209 C VAL A 86 -0.810 -4.211 0.376 1.00 0.00 C ATOM 1210 O VAL A 86 -1.661 -3.854 1.167 1.00 0.00 O ATOM 1211 CB VAL A 86 -2.382 -4.275 -1.570 1.00 0.00 C ATOM 1212 CG1 VAL A 86 -3.539 -4.184 -0.574 1.00 0.00 C ATOM 1213 CG2 VAL A 86 -1.983 -2.867 -2.016 1.00 0.00 C ATOM 0 H VAL A 86 -2.135 -6.476 0.245 1.00 0.00 H new ATOM 0 HA VAL A 86 -0.338 -4.943 -1.599 1.00 0.00 H new ATOM 0 HB VAL A 86 -2.697 -4.859 -2.435 1.00 0.00 H new ATOM 0 HG11 VAL A 86 -4.391 -3.698 -1.049 1.00 0.00 H new ATOM 0 HG12 VAL A 86 -3.824 -5.187 -0.255 1.00 0.00 H new ATOM 0 HG13 VAL A 86 -3.227 -3.602 0.294 1.00 0.00 H new ATOM 0 HG21 VAL A 86 -2.836 -2.379 -2.488 1.00 0.00 H new ATOM 0 HG22 VAL A 86 -1.667 -2.287 -1.149 1.00 0.00 H new ATOM 0 HG23 VAL A 86 -1.161 -2.930 -2.729 1.00 0.00 H new ATOM 1223 N ILE A 87 0.456 -3.981 0.595 1.00 0.00 N ATOM 1224 CA ILE A 87 0.880 -3.268 1.833 1.00 0.00 C ATOM 1225 C ILE A 87 0.669 -1.762 1.659 1.00 0.00 C ATOM 1226 O ILE A 87 1.391 -1.102 0.939 1.00 0.00 O ATOM 1227 CB ILE A 87 2.362 -3.558 2.101 1.00 0.00 C ATOM 1228 CG1 ILE A 87 2.503 -4.965 2.686 1.00 0.00 C ATOM 1229 CG2 ILE A 87 2.924 -2.539 3.096 1.00 0.00 C ATOM 1230 CD1 ILE A 87 3.425 -5.799 1.795 1.00 0.00 C ATOM 0 H ILE A 87 1.214 -4.256 -0.029 1.00 0.00 H new ATOM 0 HA ILE A 87 0.284 -3.615 2.677 1.00 0.00 H new ATOM 0 HB ILE A 87 2.916 -3.487 1.165 1.00 0.00 H new ATOM 0 HG12 ILE A 87 2.908 -4.911 3.697 1.00 0.00 H new ATOM 0 HG13 ILE A 87 1.524 -5.439 2.760 1.00 0.00 H new ATOM 0 HG21 ILE A 87 3.977 -2.753 3.280 1.00 0.00 H new ATOM 0 HG22 ILE A 87 2.824 -1.535 2.684 1.00 0.00 H new ATOM 0 HG23 ILE A 87 2.371 -2.603 4.033 1.00 0.00 H new ATOM 0 HD11 ILE A 87 3.525 -6.801 2.212 1.00 0.00 H new ATOM 0 HD12 ILE A 87 3.001 -5.864 0.793 1.00 0.00 H new ATOM 0 HD13 ILE A 87 4.406 -5.327 1.744 1.00 0.00 H new ATOM 1242 N THR A 88 -0.313 -1.214 2.320 1.00 0.00 N ATOM 1243 CA THR A 88 -0.566 0.249 2.198 1.00 0.00 C ATOM 1244 C THR A 88 -0.240 0.933 3.529 1.00 0.00 C ATOM 1245 O THR A 88 -1.033 0.930 4.450 1.00 0.00 O ATOM 1246 CB THR A 88 -2.037 0.491 1.849 1.00 0.00 C ATOM 1247 OG1 THR A 88 -2.861 -0.139 2.819 1.00 0.00 O ATOM 1248 CG2 THR A 88 -2.341 -0.089 0.466 1.00 0.00 C ATOM 0 H THR A 88 -0.950 -1.715 2.939 1.00 0.00 H new ATOM 0 HA THR A 88 0.064 0.661 1.410 1.00 0.00 H new ATOM 0 HB THR A 88 -2.236 1.563 1.841 1.00 0.00 H new ATOM 0 HG1 THR A 88 -2.361 -0.243 3.655 1.00 0.00 H new ATOM 0 HG21 THR A 88 -3.389 0.085 0.221 1.00 0.00 H new ATOM 0 HG22 THR A 88 -1.709 0.395 -0.278 1.00 0.00 H new ATOM 0 HG23 THR A 88 -2.142 -1.161 0.469 1.00 0.00 H new ATOM 1256 N VAL A 89 0.921 1.518 3.638 1.00 0.00 N ATOM 1257 CA VAL A 89 1.292 2.202 4.910 1.00 0.00 C ATOM 1258 C VAL A 89 1.698 3.645 4.610 1.00 0.00 C ATOM 1259 O VAL A 89 2.003 3.993 3.488 1.00 0.00 O ATOM 1260 CB VAL A 89 2.464 1.470 5.564 1.00 0.00 C ATOM 1261 CG1 VAL A 89 2.133 -0.018 5.692 1.00 0.00 C ATOM 1262 CG2 VAL A 89 3.715 1.642 4.701 1.00 0.00 C ATOM 0 H VAL A 89 1.628 1.552 2.903 1.00 0.00 H new ATOM 0 HA VAL A 89 0.438 2.195 5.587 1.00 0.00 H new ATOM 0 HB VAL A 89 2.644 1.886 6.555 1.00 0.00 H new ATOM 0 HG11 VAL A 89 2.970 -0.538 6.158 1.00 0.00 H new ATOM 0 HG12 VAL A 89 1.241 -0.141 6.307 1.00 0.00 H new ATOM 0 HG13 VAL A 89 1.952 -0.437 4.702 1.00 0.00 H new ATOM 0 HG21 VAL A 89 4.552 1.121 5.166 1.00 0.00 H new ATOM 0 HG22 VAL A 89 3.533 1.226 3.710 1.00 0.00 H new ATOM 0 HG23 VAL A 89 3.952 2.702 4.612 1.00 0.00 H new ATOM 1272 N LYS A 90 1.703 4.489 5.605 1.00 0.00 N ATOM 1273 CA LYS A 90 2.085 5.910 5.375 1.00 0.00 C ATOM 1274 C LYS A 90 3.567 6.104 5.702 1.00 0.00 C ATOM 1275 O LYS A 90 4.138 5.384 6.496 1.00 0.00 O ATOM 1276 CB LYS A 90 1.243 6.814 6.280 1.00 0.00 C ATOM 1277 CG LYS A 90 0.195 7.550 5.442 1.00 0.00 C ATOM 1278 CD LYS A 90 -1.201 7.247 5.990 1.00 0.00 C ATOM 1279 CE LYS A 90 -2.203 8.258 5.429 1.00 0.00 C ATOM 1280 NZ LYS A 90 -3.080 8.750 6.529 1.00 0.00 N ATOM 0 H LYS A 90 1.459 4.255 6.567 1.00 0.00 H new ATOM 0 HA LYS A 90 1.908 6.168 4.331 1.00 0.00 H new ATOM 0 HB2 LYS A 90 0.754 6.219 7.051 1.00 0.00 H new ATOM 0 HB3 LYS A 90 1.884 7.532 6.791 1.00 0.00 H new ATOM 0 HG2 LYS A 90 0.382 8.624 5.467 1.00 0.00 H new ATOM 0 HG3 LYS A 90 0.264 7.239 4.400 1.00 0.00 H new ATOM 0 HD2 LYS A 90 -1.498 6.235 5.716 1.00 0.00 H new ATOM 0 HD3 LYS A 90 -1.193 7.293 7.079 1.00 0.00 H new ATOM 0 HE2 LYS A 90 -1.675 9.093 4.969 1.00 0.00 H new ATOM 0 HE3 LYS A 90 -2.806 7.794 4.648 1.00 0.00 H new ATOM 0 HZ1 LYS A 90 -3.762 9.437 6.149 1.00 0.00 H new ATOM 0 HZ2 LYS A 90 -3.594 7.949 6.948 1.00 0.00 H new ATOM 0 HZ3 LYS A 90 -2.498 9.208 7.259 1.00 0.00 H new ATOM 1294 N THR A 91 4.193 7.075 5.096 1.00 0.00 N ATOM 1295 CA THR A 91 5.635 7.323 5.371 1.00 0.00 C ATOM 1296 C THR A 91 5.917 8.822 5.264 1.00 0.00 C ATOM 1297 O THR A 91 5.772 9.559 6.217 1.00 0.00 O ATOM 1298 CB THR A 91 6.489 6.566 4.352 1.00 0.00 C ATOM 1299 OG1 THR A 91 5.744 6.382 3.156 1.00 0.00 O ATOM 1300 CG2 THR A 91 6.884 5.205 4.926 1.00 0.00 C ATOM 0 H THR A 91 3.766 7.709 4.420 1.00 0.00 H new ATOM 0 HA THR A 91 5.881 6.975 6.374 1.00 0.00 H new ATOM 0 HB THR A 91 7.390 7.140 4.134 1.00 0.00 H new ATOM 0 HG1 THR A 91 6.290 5.899 2.502 1.00 0.00 H new ATOM 0 HG21 THR A 91 7.492 4.666 4.199 1.00 0.00 H new ATOM 0 HG22 THR A 91 7.456 5.349 5.843 1.00 0.00 H new ATOM 0 HG23 THR A 91 5.986 4.628 5.146 1.00 0.00 H new ATOM 1308 N SER A 92 6.313 9.281 4.108 1.00 0.00 N ATOM 1309 CA SER A 92 6.595 10.734 3.943 1.00 0.00 C ATOM 1310 C SER A 92 5.381 11.410 3.306 1.00 0.00 C ATOM 1311 O SER A 92 5.435 11.884 2.189 1.00 0.00 O ATOM 1312 CB SER A 92 7.814 10.919 3.040 1.00 0.00 C ATOM 1313 OG SER A 92 7.698 10.062 1.913 1.00 0.00 O ATOM 0 H SER A 92 6.453 8.713 3.272 1.00 0.00 H new ATOM 0 HA SER A 92 6.797 11.181 4.916 1.00 0.00 H new ATOM 0 HB2 SER A 92 7.887 11.957 2.716 1.00 0.00 H new ATOM 0 HB3 SER A 92 8.727 10.693 3.591 1.00 0.00 H new ATOM 0 HG SER A 92 6.921 10.328 1.379 1.00 0.00 H new ATOM 1319 N LYS A 93 4.281 11.449 4.007 1.00 0.00 N ATOM 1320 CA LYS A 93 3.061 12.083 3.441 1.00 0.00 C ATOM 1321 C LYS A 93 2.598 11.276 2.228 1.00 0.00 C ATOM 1322 O LYS A 93 1.985 11.800 1.319 1.00 0.00 O ATOM 1323 CB LYS A 93 3.378 13.517 3.008 1.00 0.00 C ATOM 1324 CG LYS A 93 4.162 14.227 4.115 1.00 0.00 C ATOM 1325 CD LYS A 93 4.107 15.741 3.895 1.00 0.00 C ATOM 1326 CE LYS A 93 5.370 16.200 3.162 1.00 0.00 C ATOM 1327 NZ LYS A 93 5.945 17.386 3.858 1.00 0.00 N ATOM 0 H LYS A 93 4.176 11.069 4.948 1.00 0.00 H new ATOM 0 HA LYS A 93 2.275 12.102 4.196 1.00 0.00 H new ATOM 0 HB2 LYS A 93 3.958 13.509 2.085 1.00 0.00 H new ATOM 0 HB3 LYS A 93 2.454 14.057 2.799 1.00 0.00 H new ATOM 0 HG2 LYS A 93 3.743 13.976 5.089 1.00 0.00 H new ATOM 0 HG3 LYS A 93 5.198 13.887 4.116 1.00 0.00 H new ATOM 0 HD2 LYS A 93 3.222 16.002 3.314 1.00 0.00 H new ATOM 0 HD3 LYS A 93 4.023 16.255 4.853 1.00 0.00 H new ATOM 0 HE2 LYS A 93 6.101 15.392 3.134 1.00 0.00 H new ATOM 0 HE3 LYS A 93 5.132 16.451 2.128 1.00 0.00 H new ATOM 0 HZ1 LYS A 93 6.803 17.698 3.360 1.00 0.00 H new ATOM 0 HZ2 LYS A 93 5.248 18.157 3.863 1.00 0.00 H new ATOM 0 HZ3 LYS A 93 6.186 17.131 4.837 1.00 0.00 H new ATOM 1341 N SER A 94 2.891 10.002 2.203 1.00 0.00 N ATOM 1342 CA SER A 94 2.469 9.164 1.045 1.00 0.00 C ATOM 1343 C SER A 94 2.149 7.745 1.517 1.00 0.00 C ATOM 1344 O SER A 94 2.734 7.243 2.457 1.00 0.00 O ATOM 1345 CB SER A 94 3.596 9.114 0.013 1.00 0.00 C ATOM 1346 OG SER A 94 4.763 8.576 0.618 1.00 0.00 O ATOM 0 H SER A 94 3.403 9.508 2.933 1.00 0.00 H new ATOM 0 HA SER A 94 1.578 9.601 0.594 1.00 0.00 H new ATOM 0 HB2 SER A 94 3.298 8.502 -0.838 1.00 0.00 H new ATOM 0 HB3 SER A 94 3.799 10.114 -0.370 1.00 0.00 H new ATOM 0 HG SER A 94 5.487 8.541 -0.042 1.00 0.00 H new ATOM 1352 N ILE A 95 1.225 7.091 0.865 1.00 0.00 N ATOM 1353 CA ILE A 95 0.867 5.703 1.270 1.00 0.00 C ATOM 1354 C ILE A 95 1.438 4.712 0.257 1.00 0.00 C ATOM 1355 O ILE A 95 0.826 4.427 -0.753 1.00 0.00 O ATOM 1356 CB ILE A 95 -0.656 5.541 1.309 1.00 0.00 C ATOM 1357 CG1 ILE A 95 -1.321 6.893 1.578 1.00 0.00 C ATOM 1358 CG2 ILE A 95 -1.034 4.559 2.420 1.00 0.00 C ATOM 1359 CD1 ILE A 95 -2.826 6.778 1.329 1.00 0.00 C ATOM 0 H ILE A 95 0.703 7.459 0.070 1.00 0.00 H new ATOM 0 HA ILE A 95 1.281 5.510 2.260 1.00 0.00 H new ATOM 0 HB ILE A 95 -0.999 5.160 0.347 1.00 0.00 H new ATOM 0 HG12 ILE A 95 -1.134 7.204 2.606 1.00 0.00 H new ATOM 0 HG13 ILE A 95 -0.891 7.657 0.930 1.00 0.00 H new ATOM 0 HG21 ILE A 95 -2.117 4.442 2.449 1.00 0.00 H new ATOM 0 HG22 ILE A 95 -0.570 3.592 2.224 1.00 0.00 H new ATOM 0 HG23 ILE A 95 -0.684 4.942 3.379 1.00 0.00 H new ATOM 0 HD11 ILE A 95 -3.301 7.740 1.520 1.00 0.00 H new ATOM 0 HD12 ILE A 95 -3.002 6.486 0.294 1.00 0.00 H new ATOM 0 HD13 ILE A 95 -3.249 6.026 1.995 1.00 0.00 H new ATOM 1371 N LEU A 96 2.598 4.174 0.513 1.00 0.00 N ATOM 1372 CA LEU A 96 3.179 3.197 -0.447 1.00 0.00 C ATOM 1373 C LEU A 96 2.177 2.061 -0.653 1.00 0.00 C ATOM 1374 O LEU A 96 1.345 1.796 0.193 1.00 0.00 O ATOM 1375 CB LEU A 96 4.486 2.635 0.113 1.00 0.00 C ATOM 1376 CG LEU A 96 4.295 2.274 1.585 1.00 0.00 C ATOM 1377 CD1 LEU A 96 4.910 0.900 1.856 1.00 0.00 C ATOM 1378 CD2 LEU A 96 4.986 3.323 2.457 1.00 0.00 C ATOM 0 H LEU A 96 3.164 4.367 1.339 1.00 0.00 H new ATOM 0 HA LEU A 96 3.386 3.689 -1.397 1.00 0.00 H new ATOM 0 HB2 LEU A 96 4.787 1.753 -0.453 1.00 0.00 H new ATOM 0 HB3 LEU A 96 5.285 3.369 0.008 1.00 0.00 H new ATOM 0 HG LEU A 96 3.231 2.248 1.820 1.00 0.00 H new ATOM 0 HD11 LEU A 96 4.774 0.641 2.906 1.00 0.00 H new ATOM 0 HD12 LEU A 96 4.420 0.153 1.232 1.00 0.00 H new ATOM 0 HD13 LEU A 96 5.975 0.926 1.623 1.00 0.00 H new ATOM 0 HD21 LEU A 96 4.851 3.068 3.508 1.00 0.00 H new ATOM 0 HD22 LEU A 96 6.050 3.347 2.223 1.00 0.00 H new ATOM 0 HD23 LEU A 96 4.549 4.303 2.262 1.00 0.00 H new ATOM 1390 N VAL A 97 2.241 1.390 -1.769 1.00 0.00 N ATOM 1391 CA VAL A 97 1.280 0.280 -2.018 1.00 0.00 C ATOM 1392 C VAL A 97 2.021 -0.933 -2.580 1.00 0.00 C ATOM 1393 O VAL A 97 2.084 -1.137 -3.776 1.00 0.00 O ATOM 1394 CB VAL A 97 0.220 0.742 -3.019 1.00 0.00 C ATOM 1395 CG1 VAL A 97 -0.649 -0.448 -3.430 1.00 0.00 C ATOM 1396 CG2 VAL A 97 -0.659 1.813 -2.368 1.00 0.00 C ATOM 0 H VAL A 97 2.914 1.561 -2.516 1.00 0.00 H new ATOM 0 HA VAL A 97 0.800 0.001 -1.080 1.00 0.00 H new ATOM 0 HB VAL A 97 0.709 1.156 -3.901 1.00 0.00 H new ATOM 0 HG11 VAL A 97 -1.404 -0.118 -4.143 1.00 0.00 H new ATOM 0 HG12 VAL A 97 -0.024 -1.213 -3.891 1.00 0.00 H new ATOM 0 HG13 VAL A 97 -1.139 -0.862 -2.549 1.00 0.00 H new ATOM 0 HG21 VAL A 97 -1.416 2.144 -3.079 1.00 0.00 H new ATOM 0 HG22 VAL A 97 -1.147 1.397 -1.487 1.00 0.00 H new ATOM 0 HG23 VAL A 97 -0.041 2.661 -2.074 1.00 0.00 H new ATOM 1406 N GLY A 98 2.578 -1.743 -1.724 1.00 0.00 N ATOM 1407 CA GLY A 98 3.308 -2.948 -2.205 1.00 0.00 C ATOM 1408 C GLY A 98 2.321 -3.909 -2.867 1.00 0.00 C ATOM 1409 O GLY A 98 1.723 -4.745 -2.219 1.00 0.00 O ATOM 0 H GLY A 98 2.559 -1.622 -0.711 1.00 0.00 H new ATOM 0 HA2 GLY A 98 4.082 -2.658 -2.915 1.00 0.00 H new ATOM 0 HA3 GLY A 98 3.808 -3.440 -1.371 1.00 0.00 H new ATOM 1413 N VAL A 99 2.152 -3.801 -4.156 1.00 0.00 N ATOM 1414 CA VAL A 99 1.208 -4.716 -4.863 1.00 0.00 C ATOM 1415 C VAL A 99 1.993 -5.938 -5.351 1.00 0.00 C ATOM 1416 O VAL A 99 2.791 -5.848 -6.262 1.00 0.00 O ATOM 1417 CB VAL A 99 0.551 -4.005 -6.064 1.00 0.00 C ATOM 1418 CG1 VAL A 99 -0.967 -3.991 -5.875 1.00 0.00 C ATOM 1419 CG2 VAL A 99 1.043 -2.555 -6.179 1.00 0.00 C ATOM 0 H VAL A 99 2.625 -3.121 -4.751 1.00 0.00 H new ATOM 0 HA VAL A 99 0.417 -5.020 -4.177 1.00 0.00 H new ATOM 0 HB VAL A 99 0.821 -4.545 -6.971 1.00 0.00 H new ATOM 0 HG11 VAL A 99 -1.435 -3.489 -6.722 1.00 0.00 H new ATOM 0 HG12 VAL A 99 -1.335 -5.015 -5.812 1.00 0.00 H new ATOM 0 HG13 VAL A 99 -1.214 -3.459 -4.956 1.00 0.00 H new ATOM 0 HG21 VAL A 99 0.565 -2.075 -7.033 1.00 0.00 H new ATOM 0 HG22 VAL A 99 0.789 -2.011 -5.269 1.00 0.00 H new ATOM 0 HG23 VAL A 99 2.124 -2.547 -6.317 1.00 0.00 H new ATOM 1429 N TYR A 100 1.788 -7.079 -4.743 1.00 0.00 N ATOM 1430 CA TYR A 100 2.545 -8.293 -5.171 1.00 0.00 C ATOM 1431 C TYR A 100 1.590 -9.473 -5.368 1.00 0.00 C ATOM 1432 O TYR A 100 0.418 -9.401 -5.056 1.00 0.00 O ATOM 1433 CB TYR A 100 3.582 -8.657 -4.102 1.00 0.00 C ATOM 1434 CG TYR A 100 2.900 -8.841 -2.767 1.00 0.00 C ATOM 1435 CD1 TYR A 100 2.348 -7.739 -2.101 1.00 0.00 C ATOM 1436 CD2 TYR A 100 2.823 -10.115 -2.192 1.00 0.00 C ATOM 1437 CE1 TYR A 100 1.721 -7.911 -0.862 1.00 0.00 C ATOM 1438 CE2 TYR A 100 2.197 -10.287 -0.951 1.00 0.00 C ATOM 1439 CZ TYR A 100 1.646 -9.184 -0.286 1.00 0.00 C ATOM 1440 OH TYR A 100 1.030 -9.353 0.937 1.00 0.00 O ATOM 0 H TYR A 100 1.134 -7.222 -3.974 1.00 0.00 H new ATOM 0 HA TYR A 100 3.046 -8.077 -6.115 1.00 0.00 H new ATOM 0 HB2 TYR A 100 4.102 -9.573 -4.384 1.00 0.00 H new ATOM 0 HB3 TYR A 100 4.335 -7.872 -4.031 1.00 0.00 H new ATOM 0 HD1 TYR A 100 2.406 -6.756 -2.544 1.00 0.00 H new ATOM 0 HD2 TYR A 100 3.246 -10.966 -2.706 1.00 0.00 H new ATOM 0 HE1 TYR A 100 1.295 -7.061 -0.350 1.00 0.00 H new ATOM 0 HE2 TYR A 100 2.139 -11.270 -0.507 1.00 0.00 H new ATOM 0 HH TYR A 100 1.064 -10.298 1.193 1.00 0.00 H new ATOM 1450 N ASN A 101 2.094 -10.559 -5.889 1.00 0.00 N ATOM 1451 CA ASN A 101 1.235 -11.755 -6.118 1.00 0.00 C ATOM 1452 C ASN A 101 1.504 -12.798 -5.028 1.00 0.00 C ATOM 1453 O ASN A 101 2.120 -12.512 -4.021 1.00 0.00 O ATOM 1454 CB ASN A 101 1.561 -12.349 -7.491 1.00 0.00 C ATOM 1455 CG ASN A 101 3.078 -12.396 -7.673 1.00 0.00 C ATOM 1456 OD1 ASN A 101 3.814 -12.457 -6.709 1.00 0.00 O ATOM 1457 ND2 ASN A 101 3.582 -12.368 -8.877 1.00 0.00 N ATOM 0 H ASN A 101 3.069 -10.669 -6.167 1.00 0.00 H new ATOM 0 HA ASN A 101 0.185 -11.465 -6.083 1.00 0.00 H new ATOM 0 HB2 ASN A 101 1.142 -13.352 -7.575 1.00 0.00 H new ATOM 0 HB3 ASN A 101 1.107 -11.747 -8.278 1.00 0.00 H new ATOM 0 HD21 ASN A 101 4.593 -12.397 -9.007 1.00 0.00 H new ATOM 0 HD22 ASN A 101 2.965 -12.317 -9.687 1.00 0.00 H new ATOM 1464 N GLU A 102 1.044 -14.005 -5.221 1.00 0.00 N ATOM 1465 CA GLU A 102 1.266 -15.065 -4.197 1.00 0.00 C ATOM 1466 C GLU A 102 2.749 -15.450 -4.158 1.00 0.00 C ATOM 1467 O GLU A 102 3.228 -16.002 -3.187 1.00 0.00 O ATOM 1468 CB GLU A 102 0.430 -16.297 -4.554 1.00 0.00 C ATOM 1469 CG GLU A 102 0.945 -16.898 -5.863 1.00 0.00 C ATOM 1470 CD GLU A 102 0.049 -18.067 -6.279 1.00 0.00 C ATOM 1471 OE1 GLU A 102 -0.520 -18.694 -5.400 1.00 0.00 O ATOM 1472 OE2 GLU A 102 -0.052 -18.316 -7.469 1.00 0.00 O ATOM 0 H GLU A 102 0.523 -14.303 -6.046 1.00 0.00 H new ATOM 0 HA GLU A 102 0.968 -14.688 -3.219 1.00 0.00 H new ATOM 0 HB2 GLU A 102 0.489 -17.035 -3.754 1.00 0.00 H new ATOM 0 HB3 GLU A 102 -0.620 -16.021 -4.656 1.00 0.00 H new ATOM 0 HG2 GLU A 102 0.955 -16.138 -6.645 1.00 0.00 H new ATOM 0 HG3 GLU A 102 1.972 -17.240 -5.738 1.00 0.00 H new ATOM 1479 N LYS A 103 3.480 -15.167 -5.201 1.00 0.00 N ATOM 1480 CA LYS A 103 4.928 -15.525 -5.210 1.00 0.00 C ATOM 1481 C LYS A 103 5.601 -14.959 -3.958 1.00 0.00 C ATOM 1482 O LYS A 103 6.422 -15.603 -3.337 1.00 0.00 O ATOM 1483 CB LYS A 103 5.594 -14.941 -6.458 1.00 0.00 C ATOM 1484 CG LYS A 103 5.127 -15.713 -7.692 1.00 0.00 C ATOM 1485 CD LYS A 103 5.315 -14.848 -8.942 1.00 0.00 C ATOM 1486 CE LYS A 103 6.024 -15.664 -10.025 1.00 0.00 C ATOM 1487 NZ LYS A 103 7.469 -15.795 -9.684 1.00 0.00 N ATOM 0 H LYS A 103 3.140 -14.705 -6.044 1.00 0.00 H new ATOM 0 HA LYS A 103 5.033 -16.610 -5.220 1.00 0.00 H new ATOM 0 HB2 LYS A 103 5.341 -13.886 -6.559 1.00 0.00 H new ATOM 0 HB3 LYS A 103 6.678 -15.001 -6.367 1.00 0.00 H new ATOM 0 HG2 LYS A 103 5.694 -16.639 -7.790 1.00 0.00 H new ATOM 0 HG3 LYS A 103 4.079 -15.991 -7.584 1.00 0.00 H new ATOM 0 HD2 LYS A 103 4.348 -14.502 -9.307 1.00 0.00 H new ATOM 0 HD3 LYS A 103 5.900 -13.961 -8.699 1.00 0.00 H new ATOM 0 HE2 LYS A 103 5.568 -16.651 -10.108 1.00 0.00 H new ATOM 0 HE3 LYS A 103 5.911 -15.178 -10.994 1.00 0.00 H new ATOM 0 HZ1 LYS A 103 7.979 -16.214 -10.488 1.00 0.00 H new ATOM 0 HZ2 LYS A 103 7.863 -14.855 -9.476 1.00 0.00 H new ATOM 0 HZ3 LYS A 103 7.575 -16.407 -8.850 1.00 0.00 H new ATOM 1501 N ILE A 104 5.258 -13.758 -3.583 1.00 0.00 N ATOM 1502 CA ILE A 104 5.873 -13.147 -2.371 1.00 0.00 C ATOM 1503 C ILE A 104 5.002 -13.464 -1.152 1.00 0.00 C ATOM 1504 O ILE A 104 3.790 -13.396 -1.209 1.00 0.00 O ATOM 1505 CB ILE A 104 5.972 -11.629 -2.569 1.00 0.00 C ATOM 1506 CG1 ILE A 104 7.193 -11.310 -3.433 1.00 0.00 C ATOM 1507 CG2 ILE A 104 6.116 -10.926 -1.216 1.00 0.00 C ATOM 1508 CD1 ILE A 104 6.741 -10.617 -4.720 1.00 0.00 C ATOM 0 H ILE A 104 4.577 -13.172 -4.065 1.00 0.00 H new ATOM 0 HA ILE A 104 6.872 -13.553 -2.212 1.00 0.00 H new ATOM 0 HB ILE A 104 5.065 -11.276 -3.059 1.00 0.00 H new ATOM 0 HG12 ILE A 104 7.882 -10.668 -2.884 1.00 0.00 H new ATOM 0 HG13 ILE A 104 7.733 -12.227 -3.671 1.00 0.00 H new ATOM 0 HG21 ILE A 104 6.185 -9.849 -1.371 1.00 0.00 H new ATOM 0 HG22 ILE A 104 5.247 -11.148 -0.596 1.00 0.00 H new ATOM 0 HG23 ILE A 104 7.018 -11.279 -0.717 1.00 0.00 H new ATOM 0 HD11 ILE A 104 7.611 -10.390 -5.336 1.00 0.00 H new ATOM 0 HD12 ILE A 104 6.069 -11.275 -5.271 1.00 0.00 H new ATOM 0 HD13 ILE A 104 6.221 -9.692 -4.472 1.00 0.00 H new ATOM 1520 N GLN A 105 5.611 -13.810 -0.051 1.00 0.00 N ATOM 1521 CA GLN A 105 4.820 -14.132 1.170 1.00 0.00 C ATOM 1522 C GLN A 105 4.418 -12.833 1.878 1.00 0.00 C ATOM 1523 O GLN A 105 5.127 -11.848 1.814 1.00 0.00 O ATOM 1524 CB GLN A 105 5.663 -14.993 2.114 1.00 0.00 C ATOM 1525 CG GLN A 105 5.338 -16.470 1.880 1.00 0.00 C ATOM 1526 CD GLN A 105 6.624 -17.235 1.564 1.00 0.00 C ATOM 1527 OE1 GLN A 105 7.280 -16.961 0.578 1.00 0.00 O ATOM 1528 NE2 GLN A 105 7.015 -18.191 2.362 1.00 0.00 N ATOM 0 H GLN A 105 6.623 -13.884 0.056 1.00 0.00 H new ATOM 0 HA GLN A 105 3.922 -14.681 0.886 1.00 0.00 H new ATOM 0 HB2 GLN A 105 6.724 -14.811 1.941 1.00 0.00 H new ATOM 0 HB3 GLN A 105 5.458 -14.724 3.150 1.00 0.00 H new ATOM 0 HG2 GLN A 105 4.860 -16.892 2.764 1.00 0.00 H new ATOM 0 HG3 GLN A 105 4.631 -16.571 1.056 1.00 0.00 H new ATOM 0 HE21 GLN A 105 6.465 -18.421 3.190 1.00 0.00 H new ATOM 0 HE22 GLN A 105 7.871 -18.708 2.158 1.00 0.00 H new ATOM 1537 N PRO A 106 3.284 -12.875 2.532 1.00 0.00 N ATOM 1538 CA PRO A 106 2.752 -11.710 3.264 1.00 0.00 C ATOM 1539 C PRO A 106 3.686 -11.324 4.417 1.00 0.00 C ATOM 1540 O PRO A 106 3.502 -10.311 5.061 1.00 0.00 O ATOM 1541 CB PRO A 106 1.396 -12.180 3.811 1.00 0.00 C ATOM 1542 CG PRO A 106 1.219 -13.670 3.424 1.00 0.00 C ATOM 1543 CD PRO A 106 2.441 -14.083 2.590 1.00 0.00 C ATOM 0 HA PRO A 106 2.661 -10.831 2.626 1.00 0.00 H new ATOM 0 HB2 PRO A 106 1.359 -12.060 4.894 1.00 0.00 H new ATOM 0 HB3 PRO A 106 0.587 -11.579 3.395 1.00 0.00 H new ATOM 0 HG2 PRO A 106 1.138 -14.290 4.317 1.00 0.00 H new ATOM 0 HG3 PRO A 106 0.301 -13.811 2.853 1.00 0.00 H new ATOM 0 HD2 PRO A 106 2.973 -14.914 3.053 1.00 0.00 H new ATOM 0 HD3 PRO A 106 2.147 -14.408 1.592 1.00 0.00 H new ATOM 1551 N GLY A 107 4.680 -12.126 4.692 1.00 0.00 N ATOM 1552 CA GLY A 107 5.610 -11.801 5.812 1.00 0.00 C ATOM 1553 C GLY A 107 6.926 -11.243 5.262 1.00 0.00 C ATOM 1554 O GLY A 107 7.501 -10.328 5.819 1.00 0.00 O ATOM 0 H GLY A 107 4.888 -12.990 4.191 1.00 0.00 H new ATOM 0 HA2 GLY A 107 5.148 -11.072 6.478 1.00 0.00 H new ATOM 0 HA3 GLY A 107 5.805 -12.695 6.404 1.00 0.00 H new ATOM 1558 N THR A 108 7.415 -11.789 4.182 1.00 0.00 N ATOM 1559 CA THR A 108 8.700 -11.288 3.615 1.00 0.00 C ATOM 1560 C THR A 108 8.531 -9.842 3.139 1.00 0.00 C ATOM 1561 O THR A 108 9.472 -9.074 3.117 1.00 0.00 O ATOM 1562 CB THR A 108 9.117 -12.169 2.435 1.00 0.00 C ATOM 1563 OG1 THR A 108 8.376 -13.381 2.465 1.00 0.00 O ATOM 1564 CG2 THR A 108 10.612 -12.480 2.531 1.00 0.00 C ATOM 0 H THR A 108 6.983 -12.557 3.669 1.00 0.00 H new ATOM 0 HA THR A 108 9.469 -11.324 4.386 1.00 0.00 H new ATOM 0 HB THR A 108 8.917 -11.644 1.501 1.00 0.00 H new ATOM 0 HG1 THR A 108 8.641 -13.945 1.709 1.00 0.00 H new ATOM 0 HG21 THR A 108 10.908 -13.107 1.690 1.00 0.00 H new ATOM 0 HG22 THR A 108 11.179 -11.550 2.507 1.00 0.00 H new ATOM 0 HG23 THR A 108 10.815 -13.005 3.464 1.00 0.00 H new ATOM 1572 N ALA A 109 7.343 -9.464 2.754 1.00 0.00 N ATOM 1573 CA ALA A 109 7.123 -8.068 2.276 1.00 0.00 C ATOM 1574 C ALA A 109 6.805 -7.160 3.466 1.00 0.00 C ATOM 1575 O ALA A 109 7.181 -6.005 3.496 1.00 0.00 O ATOM 1576 CB ALA A 109 5.952 -8.045 1.292 1.00 0.00 C ATOM 0 H ALA A 109 6.515 -10.060 2.749 1.00 0.00 H new ATOM 0 HA ALA A 109 8.025 -7.710 1.779 1.00 0.00 H new ATOM 0 HB1 ALA A 109 5.791 -7.025 0.942 1.00 0.00 H new ATOM 0 HB2 ALA A 109 6.178 -8.689 0.442 1.00 0.00 H new ATOM 0 HB3 ALA A 109 5.051 -8.405 1.790 1.00 0.00 H new ATOM 1582 N ALA A 110 6.113 -7.671 4.446 1.00 0.00 N ATOM 1583 CA ALA A 110 5.769 -6.836 5.632 1.00 0.00 C ATOM 1584 C ALA A 110 7.027 -6.578 6.465 1.00 0.00 C ATOM 1585 O ALA A 110 7.083 -5.653 7.250 1.00 0.00 O ATOM 1586 CB ALA A 110 4.736 -7.575 6.486 1.00 0.00 C ATOM 0 H ALA A 110 5.770 -8.631 4.477 1.00 0.00 H new ATOM 0 HA ALA A 110 5.358 -5.883 5.298 1.00 0.00 H new ATOM 0 HB1 ALA A 110 4.481 -6.968 7.355 1.00 0.00 H new ATOM 0 HB2 ALA A 110 3.839 -7.757 5.895 1.00 0.00 H new ATOM 0 HB3 ALA A 110 5.152 -8.527 6.817 1.00 0.00 H new ATOM 1592 N ASN A 111 8.035 -7.390 6.303 1.00 0.00 N ATOM 1593 CA ASN A 111 9.285 -7.193 7.089 1.00 0.00 C ATOM 1594 C ASN A 111 10.120 -6.076 6.459 1.00 0.00 C ATOM 1595 O ASN A 111 10.673 -5.239 7.144 1.00 0.00 O ATOM 1596 CB ASN A 111 10.090 -8.493 7.091 1.00 0.00 C ATOM 1597 CG ASN A 111 9.611 -9.387 8.237 1.00 0.00 C ATOM 1598 OD1 ASN A 111 8.361 -9.336 8.609 1.00 0.00 O flip ATOM 1599 ND2 ASN A 111 10.381 -10.140 8.799 1.00 0.00 N flip ATOM 0 H ASN A 111 8.047 -8.182 5.660 1.00 0.00 H new ATOM 0 HA ASN A 111 9.031 -6.917 8.112 1.00 0.00 H new ATOM 0 HB2 ASN A 111 9.970 -9.009 6.138 1.00 0.00 H new ATOM 0 HB3 ASN A 111 11.152 -8.276 7.204 1.00 0.00 H new ATOM 0 HD21 ASN A 111 11.358 -10.180 8.509 1.00 0.00 H new ATOM 0 HD22 ASN A 111 10.051 -10.732 9.561 1.00 0.00 H new ATOM 1606 N VAL A 112 10.216 -6.057 5.158 1.00 0.00 N ATOM 1607 CA VAL A 112 11.016 -4.996 4.484 1.00 0.00 C ATOM 1608 C VAL A 112 10.276 -3.659 4.566 1.00 0.00 C ATOM 1609 O VAL A 112 10.876 -2.615 4.728 1.00 0.00 O ATOM 1610 CB VAL A 112 11.227 -5.369 3.026 1.00 0.00 C ATOM 1611 CG1 VAL A 112 12.184 -4.370 2.373 1.00 0.00 C ATOM 1612 CG2 VAL A 112 11.819 -6.779 2.935 1.00 0.00 C ATOM 0 H VAL A 112 9.775 -6.731 4.532 1.00 0.00 H new ATOM 0 HA VAL A 112 11.982 -4.904 4.981 1.00 0.00 H new ATOM 0 HB VAL A 112 10.269 -5.345 2.507 1.00 0.00 H new ATOM 0 HG11 VAL A 112 12.334 -4.640 1.328 1.00 0.00 H new ATOM 0 HG12 VAL A 112 11.760 -3.368 2.432 1.00 0.00 H new ATOM 0 HG13 VAL A 112 13.141 -4.390 2.893 1.00 0.00 H new ATOM 0 HG21 VAL A 112 11.969 -7.044 1.888 1.00 0.00 H new ATOM 0 HG22 VAL A 112 12.775 -6.806 3.457 1.00 0.00 H new ATOM 0 HG23 VAL A 112 11.134 -7.492 3.395 1.00 0.00 H new ATOM 1622 N VAL A 113 8.976 -3.682 4.453 1.00 0.00 N ATOM 1623 CA VAL A 113 8.199 -2.413 4.522 1.00 0.00 C ATOM 1624 C VAL A 113 8.150 -1.921 5.969 1.00 0.00 C ATOM 1625 O VAL A 113 7.794 -0.792 6.239 1.00 0.00 O ATOM 1626 CB VAL A 113 6.776 -2.662 4.021 1.00 0.00 C ATOM 1627 CG1 VAL A 113 5.954 -1.377 4.145 1.00 0.00 C ATOM 1628 CG2 VAL A 113 6.825 -3.094 2.555 1.00 0.00 C ATOM 0 H VAL A 113 8.419 -4.525 4.316 1.00 0.00 H new ATOM 0 HA VAL A 113 8.679 -1.658 3.899 1.00 0.00 H new ATOM 0 HB VAL A 113 6.313 -3.446 4.620 1.00 0.00 H new ATOM 0 HG11 VAL A 113 4.940 -1.558 3.787 1.00 0.00 H new ATOM 0 HG12 VAL A 113 5.920 -1.066 5.189 1.00 0.00 H new ATOM 0 HG13 VAL A 113 6.415 -0.591 3.547 1.00 0.00 H new ATOM 0 HG21 VAL A 113 5.812 -3.273 2.194 1.00 0.00 H new ATOM 0 HG22 VAL A 113 7.289 -2.308 1.959 1.00 0.00 H new ATOM 0 HG23 VAL A 113 7.409 -4.010 2.465 1.00 0.00 H new ATOM 1638 N GLU A 114 8.504 -2.760 6.904 1.00 0.00 N ATOM 1639 CA GLU A 114 8.475 -2.336 8.332 1.00 0.00 C ATOM 1640 C GLU A 114 9.785 -1.628 8.684 1.00 0.00 C ATOM 1641 O GLU A 114 9.808 -0.707 9.477 1.00 0.00 O ATOM 1642 CB GLU A 114 8.304 -3.565 9.227 1.00 0.00 C ATOM 1643 CG GLU A 114 6.831 -3.710 9.615 1.00 0.00 C ATOM 1644 CD GLU A 114 6.624 -3.187 11.038 1.00 0.00 C ATOM 1645 OE1 GLU A 114 6.917 -2.025 11.269 1.00 0.00 O ATOM 1646 OE2 GLU A 114 6.177 -3.957 11.871 1.00 0.00 O ATOM 0 H GLU A 114 8.811 -3.719 6.741 1.00 0.00 H new ATOM 0 HA GLU A 114 7.640 -1.653 8.489 1.00 0.00 H new ATOM 0 HB2 GLU A 114 8.644 -4.459 8.704 1.00 0.00 H new ATOM 0 HB3 GLU A 114 8.919 -3.466 10.121 1.00 0.00 H new ATOM 0 HG2 GLU A 114 6.204 -3.155 8.917 1.00 0.00 H new ATOM 0 HG3 GLU A 114 6.529 -4.755 9.553 1.00 0.00 H new ATOM 1653 N LYS A 115 10.877 -2.048 8.105 1.00 0.00 N ATOM 1654 CA LYS A 115 12.181 -1.395 8.413 1.00 0.00 C ATOM 1655 C LYS A 115 12.278 -0.067 7.657 1.00 0.00 C ATOM 1656 O LYS A 115 12.555 0.965 8.235 1.00 0.00 O ATOM 1657 CB LYS A 115 13.329 -2.315 7.990 1.00 0.00 C ATOM 1658 CG LYS A 115 13.673 -3.262 9.142 1.00 0.00 C ATOM 1659 CD LYS A 115 15.192 -3.414 9.246 1.00 0.00 C ATOM 1660 CE LYS A 115 15.554 -3.987 10.617 1.00 0.00 C ATOM 1661 NZ LYS A 115 15.981 -2.882 11.521 1.00 0.00 N ATOM 0 H LYS A 115 10.922 -2.814 7.433 1.00 0.00 H new ATOM 0 HA LYS A 115 12.249 -1.207 9.484 1.00 0.00 H new ATOM 0 HB2 LYS A 115 13.044 -2.887 7.107 1.00 0.00 H new ATOM 0 HB3 LYS A 115 14.203 -1.723 7.718 1.00 0.00 H new ATOM 0 HG2 LYS A 115 13.271 -2.873 10.078 1.00 0.00 H new ATOM 0 HG3 LYS A 115 13.211 -4.235 8.977 1.00 0.00 H new ATOM 0 HD2 LYS A 115 15.557 -4.072 8.457 1.00 0.00 H new ATOM 0 HD3 LYS A 115 15.676 -2.447 9.105 1.00 0.00 H new ATOM 0 HE2 LYS A 115 14.697 -4.509 11.043 1.00 0.00 H new ATOM 0 HE3 LYS A 115 16.355 -4.719 10.517 1.00 0.00 H new ATOM 0 HZ1 LYS A 115 16.227 -3.272 12.453 1.00 0.00 H new ATOM 0 HZ2 LYS A 115 16.811 -2.403 11.116 1.00 0.00 H new ATOM 0 HZ3 LYS A 115 15.204 -2.199 11.626 1.00 0.00 H new ATOM 1675 N LEU A 116 12.047 -0.080 6.372 1.00 0.00 N ATOM 1676 CA LEU A 116 12.123 1.190 5.595 1.00 0.00 C ATOM 1677 C LEU A 116 11.261 2.243 6.287 1.00 0.00 C ATOM 1678 O LEU A 116 11.689 3.358 6.518 1.00 0.00 O ATOM 1679 CB LEU A 116 11.607 0.958 4.171 1.00 0.00 C ATOM 1680 CG LEU A 116 12.769 1.069 3.182 1.00 0.00 C ATOM 1681 CD1 LEU A 116 13.642 -0.184 3.276 1.00 0.00 C ATOM 1682 CD2 LEU A 116 12.220 1.198 1.760 1.00 0.00 C ATOM 0 H LEU A 116 11.810 -0.910 5.829 1.00 0.00 H new ATOM 0 HA LEU A 116 13.157 1.531 5.546 1.00 0.00 H new ATOM 0 HB2 LEU A 116 11.145 -0.026 4.096 1.00 0.00 H new ATOM 0 HB3 LEU A 116 10.837 1.691 3.928 1.00 0.00 H new ATOM 0 HG LEU A 116 13.366 1.948 3.424 1.00 0.00 H new ATOM 0 HD11 LEU A 116 14.470 -0.104 2.571 1.00 0.00 H new ATOM 0 HD12 LEU A 116 14.035 -0.278 4.288 1.00 0.00 H new ATOM 0 HD13 LEU A 116 13.044 -1.063 3.036 1.00 0.00 H new ATOM 0 HD21 LEU A 116 13.048 1.277 1.056 1.00 0.00 H new ATOM 0 HD22 LEU A 116 11.622 0.319 1.520 1.00 0.00 H new ATOM 0 HD23 LEU A 116 11.598 2.090 1.690 1.00 0.00 H new ATOM 1694 N ALA A 117 10.051 1.899 6.636 1.00 0.00 N ATOM 1695 CA ALA A 117 9.183 2.886 7.327 1.00 0.00 C ATOM 1696 C ALA A 117 9.836 3.256 8.653 1.00 0.00 C ATOM 1697 O ALA A 117 9.962 4.413 8.981 1.00 0.00 O ATOM 1698 CB ALA A 117 7.801 2.284 7.589 1.00 0.00 C ATOM 0 H ALA A 117 9.631 0.984 6.473 1.00 0.00 H new ATOM 0 HA ALA A 117 9.064 3.771 6.702 1.00 0.00 H new ATOM 0 HB1 ALA A 117 7.175 3.018 8.096 1.00 0.00 H new ATOM 0 HB2 ALA A 117 7.340 2.006 6.641 1.00 0.00 H new ATOM 0 HB3 ALA A 117 7.903 1.399 8.217 1.00 0.00 H new ATOM 1704 N ASP A 118 10.261 2.272 9.408 1.00 0.00 N ATOM 1705 CA ASP A 118 10.920 2.551 10.720 1.00 0.00 C ATOM 1706 C ASP A 118 11.815 3.786 10.595 1.00 0.00 C ATOM 1707 O ASP A 118 12.019 4.518 11.542 1.00 0.00 O ATOM 1708 CB ASP A 118 11.768 1.345 11.126 1.00 0.00 C ATOM 1709 CG ASP A 118 11.062 0.581 12.247 1.00 0.00 C ATOM 1710 OD1 ASP A 118 9.844 0.637 12.300 1.00 0.00 O ATOM 1711 OD2 ASP A 118 11.750 -0.048 13.033 1.00 0.00 O ATOM 0 H ASP A 118 10.179 1.284 9.170 1.00 0.00 H new ATOM 0 HA ASP A 118 10.158 2.735 11.477 1.00 0.00 H new ATOM 0 HB2 ASP A 118 11.924 0.691 10.268 1.00 0.00 H new ATOM 0 HB3 ASP A 118 12.752 1.674 11.459 1.00 0.00 H new ATOM 1716 N TYR A 119 12.344 4.025 9.428 1.00 0.00 N ATOM 1717 CA TYR A 119 13.217 5.214 9.236 1.00 0.00 C ATOM 1718 C TYR A 119 12.351 6.478 9.198 1.00 0.00 C ATOM 1719 O TYR A 119 12.633 7.455 9.862 1.00 0.00 O ATOM 1720 CB TYR A 119 13.973 5.080 7.908 1.00 0.00 C ATOM 1721 CG TYR A 119 15.049 4.018 8.009 1.00 0.00 C ATOM 1722 CD1 TYR A 119 15.562 3.631 9.257 1.00 0.00 C ATOM 1723 CD2 TYR A 119 15.541 3.423 6.839 1.00 0.00 C ATOM 1724 CE1 TYR A 119 16.561 2.652 9.330 1.00 0.00 C ATOM 1725 CE2 TYR A 119 16.539 2.446 6.914 1.00 0.00 C ATOM 1726 CZ TYR A 119 17.049 2.060 8.159 1.00 0.00 C ATOM 1727 OH TYR A 119 18.034 1.097 8.233 1.00 0.00 O ATOM 0 H TYR A 119 12.209 3.447 8.598 1.00 0.00 H new ATOM 0 HA TYR A 119 13.929 5.281 10.059 1.00 0.00 H new ATOM 0 HB2 TYR A 119 13.275 4.823 7.111 1.00 0.00 H new ATOM 0 HB3 TYR A 119 14.423 6.036 7.642 1.00 0.00 H new ATOM 0 HD1 TYR A 119 15.186 4.088 10.161 1.00 0.00 H new ATOM 0 HD2 TYR A 119 15.149 3.720 5.878 1.00 0.00 H new ATOM 0 HE1 TYR A 119 16.955 2.354 10.290 1.00 0.00 H new ATOM 0 HE2 TYR A 119 16.916 1.989 6.011 1.00 0.00 H new ATOM 0 HH TYR A 119 18.258 0.789 7.330 1.00 0.00 H new ATOM 1737 N LEU A 120 11.315 6.473 8.405 1.00 0.00 N ATOM 1738 CA LEU A 120 10.447 7.681 8.298 1.00 0.00 C ATOM 1739 C LEU A 120 9.443 7.769 9.460 1.00 0.00 C ATOM 1740 O LEU A 120 8.703 8.727 9.559 1.00 0.00 O ATOM 1741 CB LEU A 120 9.685 7.626 6.976 1.00 0.00 C ATOM 1742 CG LEU A 120 10.420 8.468 5.933 1.00 0.00 C ATOM 1743 CD1 LEU A 120 10.224 7.852 4.548 1.00 0.00 C ATOM 1744 CD2 LEU A 120 9.862 9.892 5.943 1.00 0.00 C ATOM 0 H LEU A 120 11.031 5.683 7.825 1.00 0.00 H new ATOM 0 HA LEU A 120 11.085 8.564 8.341 1.00 0.00 H new ATOM 0 HB2 LEU A 120 9.601 6.594 6.634 1.00 0.00 H new ATOM 0 HB3 LEU A 120 8.670 8.000 7.112 1.00 0.00 H new ATOM 0 HG LEU A 120 11.484 8.493 6.170 1.00 0.00 H new ATOM 0 HD11 LEU A 120 10.748 8.453 3.805 1.00 0.00 H new ATOM 0 HD12 LEU A 120 10.623 6.838 4.541 1.00 0.00 H new ATOM 0 HD13 LEU A 120 9.161 7.826 4.309 1.00 0.00 H new ATOM 0 HD21 LEU A 120 10.386 10.493 5.200 1.00 0.00 H new ATOM 0 HD22 LEU A 120 8.798 9.868 5.706 1.00 0.00 H new ATOM 0 HD23 LEU A 120 10.004 10.331 6.930 1.00 0.00 H new ATOM 1756 N ILE A 121 9.397 6.806 10.345 1.00 0.00 N ATOM 1757 CA ILE A 121 8.421 6.912 11.473 1.00 0.00 C ATOM 1758 C ILE A 121 8.964 7.895 12.510 1.00 0.00 C ATOM 1759 O ILE A 121 8.227 8.665 13.093 1.00 0.00 O ATOM 1760 CB ILE A 121 8.206 5.552 12.149 1.00 0.00 C ATOM 1761 CG1 ILE A 121 8.273 4.424 11.121 1.00 0.00 C ATOM 1762 CG2 ILE A 121 6.833 5.534 12.822 1.00 0.00 C ATOM 1763 CD1 ILE A 121 7.473 4.806 9.872 1.00 0.00 C ATOM 0 H ILE A 121 9.979 5.968 10.338 1.00 0.00 H new ATOM 0 HA ILE A 121 7.468 7.257 11.072 1.00 0.00 H new ATOM 0 HB ILE A 121 8.991 5.402 12.890 1.00 0.00 H new ATOM 0 HG12 ILE A 121 9.311 4.227 10.852 1.00 0.00 H new ATOM 0 HG13 ILE A 121 7.875 3.505 11.551 1.00 0.00 H new ATOM 0 HG21 ILE A 121 6.677 4.569 13.304 1.00 0.00 H new ATOM 0 HG22 ILE A 121 6.784 6.325 13.570 1.00 0.00 H new ATOM 0 HG23 ILE A 121 6.058 5.695 12.072 1.00 0.00 H new ATOM 0 HD11 ILE A 121 7.526 3.996 9.144 1.00 0.00 H new ATOM 0 HD12 ILE A 121 6.432 4.980 10.146 1.00 0.00 H new ATOM 0 HD13 ILE A 121 7.890 5.714 9.436 1.00 0.00 H new ATOM 1775 N GLY A 122 10.250 7.871 12.744 1.00 0.00 N ATOM 1776 CA GLY A 122 10.850 8.800 13.745 1.00 0.00 C ATOM 1777 C GLY A 122 10.213 10.182 13.604 1.00 0.00 C ATOM 1778 O GLY A 122 9.955 10.861 14.578 1.00 0.00 O ATOM 0 H GLY A 122 10.912 7.246 12.283 1.00 0.00 H new ATOM 0 HA2 GLY A 122 10.692 8.416 14.753 1.00 0.00 H new ATOM 0 HA3 GLY A 122 11.927 8.867 13.594 1.00 0.00 H new ATOM 1782 N GLN A 123 9.952 10.601 12.397 1.00 0.00 N ATOM 1783 CA GLN A 123 9.324 11.935 12.189 1.00 0.00 C ATOM 1784 C GLN A 123 7.806 11.802 12.327 1.00 0.00 C ATOM 1785 O GLN A 123 7.192 12.425 13.170 1.00 0.00 O ATOM 1786 CB GLN A 123 9.668 12.448 10.788 1.00 0.00 C ATOM 1787 CG GLN A 123 10.989 13.220 10.835 1.00 0.00 C ATOM 1788 CD GLN A 123 10.765 14.576 11.507 1.00 0.00 C ATOM 1789 OE1 GLN A 123 9.732 14.808 12.103 1.00 0.00 O ATOM 1790 NE2 GLN A 123 11.696 15.488 11.437 1.00 0.00 N ATOM 0 H GLN A 123 10.147 10.076 11.544 1.00 0.00 H new ATOM 0 HA GLN A 123 9.699 12.638 12.933 1.00 0.00 H new ATOM 0 HB2 GLN A 123 9.748 11.612 10.093 1.00 0.00 H new ATOM 0 HB3 GLN A 123 8.871 13.094 10.420 1.00 0.00 H new ATOM 0 HG2 GLN A 123 11.737 12.649 11.385 1.00 0.00 H new ATOM 0 HG3 GLN A 123 11.375 13.362 9.826 1.00 0.00 H new ATOM 0 HE21 GLN A 123 12.563 15.294 10.937 1.00 0.00 H new ATOM 0 HE22 GLN A 123 11.556 16.395 11.883 1.00 0.00 H new ATOM 1799 N GLY A 124 7.198 10.989 11.507 1.00 0.00 N ATOM 1800 CA GLY A 124 5.721 10.809 11.593 1.00 0.00 C ATOM 1801 C GLY A 124 5.024 11.786 10.646 1.00 0.00 C ATOM 1802 O GLY A 124 4.948 12.970 10.907 1.00 0.00 O ATOM 0 H GLY A 124 7.660 10.442 10.781 1.00 0.00 H new ATOM 0 HA2 GLY A 124 5.455 9.784 11.334 1.00 0.00 H new ATOM 0 HA3 GLY A 124 5.384 10.977 12.616 1.00 0.00 H new ATOM 1806 N PHE A 125 4.503 11.301 9.550 1.00 0.00 N ATOM 1807 CA PHE A 125 3.800 12.210 8.598 1.00 0.00 C ATOM 1808 C PHE A 125 2.323 11.820 8.520 1.00 0.00 C ATOM 1809 O PHE A 125 1.496 12.634 8.894 1.00 0.00 O ATOM 1810 CB PHE A 125 4.422 12.105 7.202 1.00 0.00 C ATOM 1811 CG PHE A 125 5.928 12.211 7.300 1.00 0.00 C ATOM 1812 CD1 PHE A 125 6.666 11.217 7.955 1.00 0.00 C ATOM 1813 CD2 PHE A 125 6.586 13.307 6.728 1.00 0.00 C ATOM 1814 CE1 PHE A 125 8.061 11.321 8.038 1.00 0.00 C ATOM 1815 CE2 PHE A 125 7.979 13.410 6.811 1.00 0.00 C ATOM 1816 CZ PHE A 125 8.717 12.417 7.466 1.00 0.00 C ATOM 1817 OXT PHE A 125 2.046 10.713 8.089 1.00 0.00 O ATOM 0 H PHE A 125 4.533 10.320 9.274 1.00 0.00 H new ATOM 0 HA PHE A 125 3.897 13.235 8.955 1.00 0.00 H new ATOM 0 HB2 PHE A 125 4.145 11.157 6.741 1.00 0.00 H new ATOM 0 HB3 PHE A 125 4.034 12.897 6.561 1.00 0.00 H new ATOM 0 HD1 PHE A 125 6.160 10.371 8.396 1.00 0.00 H new ATOM 0 HD2 PHE A 125 6.018 14.074 6.222 1.00 0.00 H new ATOM 0 HE1 PHE A 125 8.630 10.555 8.544 1.00 0.00 H new ATOM 0 HE2 PHE A 125 8.485 14.256 6.370 1.00 0.00 H new ATOM 0 HZ PHE A 125 9.792 12.497 7.530 1.00 0.00 H new