USER MOD reduce.3.24.130724 H: found=0, std=0, add=943, rem=0, adj=23 USER MOD reduce.3.24.130724 removed 943 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 111 THR OG1 : rot 168:sc= 0.823 USER MOD Set 1.2: A 134 THR OG1 : rot 90:sc= 0.69 USER MOD Single : A 12 THR OG1 : rot 180:sc= 0 USER MOD Single : A 15 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 17 GLN :FLIP amide:sc= -0.108 F(o=-1.7!,f=-0.11) USER MOD Single : A 20 SER OG : rot 2:sc= 0.231 USER MOD Single : A 44 SER OG : rot 180:sc= 0 USER MOD Single : A 51 THR OG1 : rot 180:sc= -0.273 USER MOD Single : A 55 SER OG : rot 180:sc= 0 USER MOD Single : A 60 SER OG : rot -100:sc= 0.137 USER MOD Single : A 61 TYR OH : rot 30:sc= 0.00423 USER MOD Single : A 63 THR OG1 : rot 180:sc= 0 USER MOD Single : A 65 THR OG1 : rot 180:sc= 0 USER MOD Single : A 69 ASN :FLIP amide:sc= -0.107 F(o=-1.9!,f=-0.11) USER MOD Single : A 78 SER OG : rot 180:sc= 0 USER MOD Single : A 85 SER OG : rot 105:sc= 0.194 USER MOD Single : A 90 SER OG : rot 180:sc= -0.0892 USER MOD Single : A 96 TYR OH : rot 180:sc= 0 USER MOD Single : A 99 THR OG1 : rot -160:sc= 0.375 USER MOD Single : A 103 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 104 THR OG1 : rot 180:sc= 0 USER MOD Single : A 105 ASN : amide:sc= 0.178 K(o=0.18,f=-7!) USER MOD Single : A 109 THR OG1 : rot 180:sc= 0.0781 USER MOD Single : A 112 TYR OH : rot 180:sc= -0.0278 USER MOD Single : A 114 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 115 SER OG : rot 180:sc= 0 USER MOD Single : A 133 HIS : no HD1:sc= -0.0107 X(o=-0.011,f=0) USER MOD Single : A 138 SER OG : rot 180:sc= 0 USER MOD Single : A 141 ASN : amide:sc= 0.0622 X(o=0.062,f=-0.016) USER MOD ----------------------------------------------------------------- ATOM 31 N GLY A 4 -13.010 12.362 3.927 1.00 0.00 N ATOM 32 CA GLY A 4 -11.689 12.397 3.338 1.00 0.00 C ATOM 33 C GLY A 4 -11.430 13.725 2.636 1.00 0.00 C ATOM 34 O GLY A 4 -12.366 14.446 2.276 1.00 0.00 O ATOM 0 HA2 GLY A 4 -10.939 12.241 4.113 1.00 0.00 H new ATOM 0 HA3 GLY A 4 -11.585 11.580 2.624 1.00 0.00 H new ATOM 38 N GLU A 5 -10.157 13.998 2.378 1.00 0.00 N ATOM 39 CA GLU A 5 -9.584 15.168 1.724 1.00 0.00 C ATOM 40 C GLU A 5 -8.501 14.660 0.762 1.00 0.00 C ATOM 41 O GLU A 5 -7.944 13.597 1.046 1.00 0.00 O ATOM 42 CB GLU A 5 -8.983 16.032 2.852 1.00 0.00 C ATOM 43 CG GLU A 5 -8.436 17.417 2.487 1.00 0.00 C ATOM 44 CD GLU A 5 -9.532 18.465 2.252 1.00 0.00 C ATOM 45 OE1 GLU A 5 -10.568 18.179 1.600 1.00 0.00 O ATOM 46 OE2 GLU A 5 -9.412 19.580 2.809 1.00 0.00 O ATOM 0 H GLU A 5 -9.427 13.339 2.649 1.00 0.00 H new ATOM 0 HA GLU A 5 -10.305 15.757 1.156 1.00 0.00 H new ATOM 0 HB2 GLU A 5 -9.751 16.167 3.614 1.00 0.00 H new ATOM 0 HB3 GLU A 5 -8.174 15.464 3.312 1.00 0.00 H new ATOM 0 HG2 GLU A 5 -7.780 17.762 3.286 1.00 0.00 H new ATOM 0 HG3 GLU A 5 -7.826 17.333 1.588 1.00 0.00 H new ATOM 53 N PRO A 6 -8.224 15.304 -0.387 1.00 0.00 N ATOM 54 CA PRO A 6 -7.158 14.838 -1.267 1.00 0.00 C ATOM 55 C PRO A 6 -5.825 15.261 -0.620 1.00 0.00 C ATOM 56 O PRO A 6 -5.760 16.328 0.004 1.00 0.00 O ATOM 57 CB PRO A 6 -7.413 15.557 -2.593 1.00 0.00 C ATOM 58 CG PRO A 6 -8.021 16.893 -2.164 1.00 0.00 C ATOM 59 CD PRO A 6 -8.804 16.544 -0.898 1.00 0.00 C ATOM 0 HA PRO A 6 -7.125 13.760 -1.425 1.00 0.00 H new ATOM 0 HB2 PRO A 6 -6.491 15.698 -3.157 1.00 0.00 H new ATOM 0 HB3 PRO A 6 -8.093 14.993 -3.231 1.00 0.00 H new ATOM 0 HG2 PRO A 6 -7.251 17.638 -1.966 1.00 0.00 H new ATOM 0 HG3 PRO A 6 -8.671 17.304 -2.937 1.00 0.00 H new ATOM 0 HD2 PRO A 6 -8.727 17.343 -0.160 1.00 0.00 H new ATOM 0 HD3 PRO A 6 -9.864 16.416 -1.119 1.00 0.00 H new ATOM 67 N LEU A 7 -4.745 14.484 -0.753 1.00 0.00 N ATOM 68 CA LEU A 7 -3.462 14.803 -0.180 1.00 0.00 C ATOM 69 C LEU A 7 -2.469 14.763 -1.318 1.00 0.00 C ATOM 70 O LEU A 7 -2.447 13.843 -2.144 1.00 0.00 O ATOM 71 CB LEU A 7 -3.095 13.836 0.958 1.00 0.00 C ATOM 72 CG LEU A 7 -2.740 14.530 2.284 1.00 0.00 C ATOM 73 CD1 LEU A 7 -1.661 15.609 2.117 1.00 0.00 C ATOM 74 CD2 LEU A 7 -3.974 15.129 2.971 1.00 0.00 C ATOM 0 H LEU A 7 -4.753 13.606 -1.272 1.00 0.00 H new ATOM 0 HA LEU A 7 -3.468 15.790 0.283 1.00 0.00 H new ATOM 0 HB2 LEU A 7 -3.932 13.158 1.128 1.00 0.00 H new ATOM 0 HB3 LEU A 7 -2.249 13.225 0.642 1.00 0.00 H new ATOM 0 HG LEU A 7 -2.334 13.746 2.923 1.00 0.00 H new ATOM 0 HD11 LEU A 7 -1.450 16.065 3.084 1.00 0.00 H new ATOM 0 HD12 LEU A 7 -0.751 15.156 1.723 1.00 0.00 H new ATOM 0 HD13 LEU A 7 -2.015 16.373 1.425 1.00 0.00 H new ATOM 0 HD21 LEU A 7 -3.675 15.608 3.903 1.00 0.00 H new ATOM 0 HD22 LEU A 7 -4.433 15.868 2.314 1.00 0.00 H new ATOM 0 HD23 LEU A 7 -4.692 14.337 3.185 1.00 0.00 H new ATOM 86 N VAL A 8 -1.639 15.782 -1.327 1.00 0.00 N ATOM 87 CA VAL A 8 -0.596 16.024 -2.298 1.00 0.00 C ATOM 88 C VAL A 8 0.657 16.474 -1.525 1.00 0.00 C ATOM 89 O VAL A 8 0.734 17.629 -1.101 1.00 0.00 O ATOM 90 CB VAL A 8 -1.120 17.065 -3.330 1.00 0.00 C ATOM 91 CG1 VAL A 8 -0.214 17.163 -4.555 1.00 0.00 C ATOM 92 CG2 VAL A 8 -2.540 16.776 -3.860 1.00 0.00 C ATOM 0 H VAL A 8 -1.677 16.509 -0.612 1.00 0.00 H new ATOM 0 HA VAL A 8 -0.323 15.137 -2.869 1.00 0.00 H new ATOM 0 HB VAL A 8 -1.131 17.996 -2.763 1.00 0.00 H new ATOM 0 HG11 VAL A 8 -0.618 17.901 -5.248 1.00 0.00 H new ATOM 0 HG12 VAL A 8 0.786 17.466 -4.245 1.00 0.00 H new ATOM 0 HG13 VAL A 8 -0.162 16.192 -5.048 1.00 0.00 H new ATOM 0 HG21 VAL A 8 -2.827 17.549 -4.573 1.00 0.00 H new ATOM 0 HG22 VAL A 8 -2.553 15.804 -4.354 1.00 0.00 H new ATOM 0 HG23 VAL A 8 -3.245 16.770 -3.028 1.00 0.00 H new ATOM 102 N GLY A 9 1.610 15.562 -1.287 1.00 0.00 N ATOM 103 CA GLY A 9 2.875 15.832 -0.599 1.00 0.00 C ATOM 104 C GLY A 9 3.571 16.969 -1.347 1.00 0.00 C ATOM 105 O GLY A 9 3.477 17.044 -2.580 1.00 0.00 O ATOM 0 H GLY A 9 1.517 14.589 -1.577 1.00 0.00 H new ATOM 0 HA2 GLY A 9 2.695 16.110 0.439 1.00 0.00 H new ATOM 0 HA3 GLY A 9 3.502 14.941 -0.586 1.00 0.00 H new ATOM 109 N GLY A 10 4.278 17.848 -0.641 1.00 0.00 N ATOM 110 CA GLY A 10 4.919 19.015 -1.233 1.00 0.00 C ATOM 111 C GLY A 10 6.405 18.969 -1.543 1.00 0.00 C ATOM 112 O GLY A 10 7.095 19.887 -1.097 1.00 0.00 O ATOM 0 H GLY A 10 4.422 17.768 0.366 1.00 0.00 H new ATOM 0 HA2 GLY A 10 4.397 19.239 -2.163 1.00 0.00 H new ATOM 0 HA3 GLY A 10 4.750 19.857 -0.562 1.00 0.00 H new ATOM 116 N ASP A 11 6.903 17.983 -2.303 1.00 0.00 N ATOM 117 CA ASP A 11 8.331 17.890 -2.694 1.00 0.00 C ATOM 118 C ASP A 11 9.258 17.860 -1.480 1.00 0.00 C ATOM 119 O ASP A 11 10.381 18.370 -1.474 1.00 0.00 O ATOM 120 CB ASP A 11 8.602 19.030 -3.658 1.00 0.00 C ATOM 121 CG ASP A 11 9.789 18.970 -4.626 1.00 0.00 C ATOM 122 OD1 ASP A 11 10.930 18.551 -4.309 1.00 0.00 O ATOM 123 OD2 ASP A 11 9.615 19.500 -5.749 1.00 0.00 O ATOM 0 H ASP A 11 6.331 17.222 -2.669 1.00 0.00 H new ATOM 0 HA ASP A 11 8.542 16.946 -3.197 1.00 0.00 H new ATOM 0 HB2 ASP A 11 7.703 19.161 -4.260 1.00 0.00 H new ATOM 0 HB3 ASP A 11 8.720 19.934 -3.061 1.00 0.00 H new ATOM 128 N THR A 12 8.722 17.302 -0.406 1.00 0.00 N ATOM 129 CA THR A 12 9.377 17.147 0.882 1.00 0.00 C ATOM 130 C THR A 12 8.918 15.865 1.572 1.00 0.00 C ATOM 131 O THR A 12 7.718 15.583 1.607 1.00 0.00 O ATOM 132 CB THR A 12 9.071 18.354 1.787 1.00 0.00 C ATOM 133 OG1 THR A 12 7.678 18.577 1.945 1.00 0.00 O ATOM 134 CG2 THR A 12 9.714 19.662 1.322 1.00 0.00 C ATOM 0 H THR A 12 7.773 16.927 -0.410 1.00 0.00 H new ATOM 0 HA THR A 12 10.452 17.089 0.708 1.00 0.00 H new ATOM 0 HB THR A 12 9.515 18.075 2.743 1.00 0.00 H new ATOM 0 HG1 THR A 12 7.535 19.352 2.528 1.00 0.00 H new ATOM 0 HG21 THR A 12 9.450 20.463 2.013 1.00 0.00 H new ATOM 0 HG22 THR A 12 10.798 19.546 1.298 1.00 0.00 H new ATOM 0 HG23 THR A 12 9.353 19.910 0.324 1.00 0.00 H new ATOM 142 N ASP A 13 9.861 15.170 2.202 1.00 0.00 N ATOM 143 CA ASP A 13 9.650 13.929 2.932 1.00 0.00 C ATOM 144 C ASP A 13 8.686 14.093 4.096 1.00 0.00 C ATOM 145 O ASP A 13 8.840 14.965 4.959 1.00 0.00 O ATOM 146 CB ASP A 13 10.972 13.360 3.466 1.00 0.00 C ATOM 147 CG ASP A 13 11.809 14.371 4.245 1.00 0.00 C ATOM 148 OD1 ASP A 13 12.539 15.162 3.603 1.00 0.00 O ATOM 149 OD2 ASP A 13 11.800 14.370 5.496 1.00 0.00 O ATOM 0 H ASP A 13 10.835 15.472 2.217 1.00 0.00 H new ATOM 0 HA ASP A 13 9.213 13.236 2.213 1.00 0.00 H new ATOM 0 HB2 ASP A 13 10.756 12.508 4.111 1.00 0.00 H new ATOM 0 HB3 ASP A 13 11.560 12.985 2.628 1.00 0.00 H new ATOM 154 N ASP A 14 7.682 13.226 4.128 1.00 0.00 N ATOM 155 CA ASP A 14 6.646 13.116 5.134 1.00 0.00 C ATOM 156 C ASP A 14 6.043 11.723 5.051 1.00 0.00 C ATOM 157 O ASP A 14 6.429 10.900 4.210 1.00 0.00 O ATOM 158 CB ASP A 14 5.601 14.239 5.072 1.00 0.00 C ATOM 159 CG ASP A 14 4.287 13.997 4.336 1.00 0.00 C ATOM 160 OD1 ASP A 14 4.203 14.329 3.135 1.00 0.00 O ATOM 161 OD2 ASP A 14 3.291 13.679 5.024 1.00 0.00 O ATOM 0 H ASP A 14 7.567 12.530 3.392 1.00 0.00 H new ATOM 0 HA ASP A 14 7.097 13.252 6.117 1.00 0.00 H new ATOM 0 HB2 ASP A 14 5.356 14.515 6.098 1.00 0.00 H new ATOM 0 HB3 ASP A 14 6.078 15.105 4.614 1.00 0.00 H new ATOM 166 N GLN A 15 5.150 11.459 5.993 1.00 0.00 N ATOM 167 CA GLN A 15 4.438 10.204 6.144 1.00 0.00 C ATOM 168 C GLN A 15 2.954 10.515 5.977 1.00 0.00 C ATOM 169 O GLN A 15 2.270 10.896 6.932 1.00 0.00 O ATOM 170 CB GLN A 15 4.780 9.591 7.521 1.00 0.00 C ATOM 171 CG GLN A 15 6.081 8.787 7.452 1.00 0.00 C ATOM 172 CD GLN A 15 6.771 8.552 8.791 1.00 0.00 C ATOM 173 OE1 GLN A 15 6.490 7.563 9.471 1.00 0.00 O ATOM 174 NE2 GLN A 15 7.739 9.376 9.154 1.00 0.00 N ATOM 0 H GLN A 15 4.892 12.145 6.703 1.00 0.00 H new ATOM 0 HA GLN A 15 4.725 9.463 5.398 1.00 0.00 H new ATOM 0 HB2 GLN A 15 4.876 10.384 8.263 1.00 0.00 H new ATOM 0 HB3 GLN A 15 3.965 8.945 7.849 1.00 0.00 H new ATOM 0 HG2 GLN A 15 5.868 7.820 6.997 1.00 0.00 H new ATOM 0 HG3 GLN A 15 6.775 9.305 6.790 1.00 0.00 H new ATOM 0 HE21 GLN A 15 7.958 10.190 8.579 1.00 0.00 H new ATOM 0 HE22 GLN A 15 8.267 9.198 10.009 1.00 0.00 H new ATOM 183 N LEU A 16 2.459 10.318 4.756 1.00 0.00 N ATOM 184 CA LEU A 16 1.084 10.575 4.378 1.00 0.00 C ATOM 185 C LEU A 16 0.196 9.423 4.843 1.00 0.00 C ATOM 186 O LEU A 16 0.211 8.376 4.212 1.00 0.00 O ATOM 187 CB LEU A 16 0.969 10.815 2.859 1.00 0.00 C ATOM 188 CG LEU A 16 1.731 12.056 2.329 1.00 0.00 C ATOM 189 CD1 LEU A 16 3.057 11.678 1.657 1.00 0.00 C ATOM 190 CD2 LEU A 16 0.869 12.788 1.293 1.00 0.00 C ATOM 0 H LEU A 16 3.026 9.965 3.985 1.00 0.00 H new ATOM 0 HA LEU A 16 0.741 11.485 4.870 1.00 0.00 H new ATOM 0 HB2 LEU A 16 1.339 9.932 2.338 1.00 0.00 H new ATOM 0 HB3 LEU A 16 -0.085 10.918 2.602 1.00 0.00 H new ATOM 0 HG LEU A 16 1.942 12.691 3.189 1.00 0.00 H new ATOM 0 HD11 LEU A 16 3.555 12.580 1.302 1.00 0.00 H new ATOM 0 HD12 LEU A 16 3.698 11.169 2.377 1.00 0.00 H new ATOM 0 HD13 LEU A 16 2.862 11.015 0.814 1.00 0.00 H new ATOM 0 HD21 LEU A 16 1.408 13.660 0.922 1.00 0.00 H new ATOM 0 HD22 LEU A 16 0.650 12.117 0.463 1.00 0.00 H new ATOM 0 HD23 LEU A 16 -0.064 13.108 1.757 1.00 0.00 H new ATOM 202 N GLN A 17 -0.559 9.555 5.932 1.00 0.00 N ATOM 203 CA GLN A 17 -1.439 8.489 6.417 1.00 0.00 C ATOM 204 C GLN A 17 -2.898 8.660 5.960 1.00 0.00 C ATOM 205 O GLN A 17 -3.370 9.787 5.798 1.00 0.00 O ATOM 206 CB GLN A 17 -1.253 8.325 7.915 1.00 0.00 C ATOM 207 CG GLN A 17 -1.680 9.552 8.716 1.00 0.00 C ATOM 208 CD GLN A 17 -2.273 9.277 10.089 1.00 0.00 C ATOM 209 OE1 GLN A 17 -2.775 8.082 10.343 1.00 0.00 O flip ATOM 210 NE2 GLN A 17 -2.356 10.183 10.918 1.00 0.00 N flip ATOM 0 H GLN A 17 -0.579 10.400 6.503 1.00 0.00 H new ATOM 0 HA GLN A 17 -1.148 7.546 5.954 1.00 0.00 H new ATOM 0 HB2 GLN A 17 -1.827 7.462 8.253 1.00 0.00 H new ATOM 0 HB3 GLN A 17 -0.204 8.112 8.122 1.00 0.00 H new ATOM 0 HG2 GLN A 17 -0.813 10.201 8.840 1.00 0.00 H new ATOM 0 HG3 GLN A 17 -2.412 10.107 8.130 1.00 0.00 H new ATOM 0 HE21 GLN A 17 -1.964 11.102 10.710 1.00 0.00 H new ATOM 0 HE22 GLN A 17 -2.816 10.015 11.813 1.00 0.00 H new ATOM 219 N GLY A 18 -3.639 7.553 5.836 1.00 0.00 N ATOM 220 CA GLY A 18 -5.041 7.541 5.408 1.00 0.00 C ATOM 221 C GLY A 18 -5.979 7.929 6.551 1.00 0.00 C ATOM 222 O GLY A 18 -7.029 8.535 6.338 1.00 0.00 O ATOM 0 H GLY A 18 -3.273 6.622 6.035 1.00 0.00 H new ATOM 0 HA2 GLY A 18 -5.174 8.232 4.576 1.00 0.00 H new ATOM 0 HA3 GLY A 18 -5.302 6.548 5.042 1.00 0.00 H new ATOM 226 N GLY A 19 -5.605 7.597 7.791 1.00 0.00 N ATOM 227 CA GLY A 19 -6.375 7.932 8.983 1.00 0.00 C ATOM 228 C GLY A 19 -7.709 7.205 9.161 1.00 0.00 C ATOM 229 O GLY A 19 -8.457 7.602 10.053 1.00 0.00 O ATOM 0 H GLY A 19 -4.748 7.082 7.992 1.00 0.00 H new ATOM 0 HA2 GLY A 19 -5.756 7.728 9.857 1.00 0.00 H new ATOM 0 HA3 GLY A 19 -6.570 9.004 8.973 1.00 0.00 H new ATOM 233 N SER A 20 -8.008 6.158 8.381 1.00 0.00 N ATOM 234 CA SER A 20 -9.228 5.335 8.405 1.00 0.00 C ATOM 235 C SER A 20 -10.348 5.914 7.532 1.00 0.00 C ATOM 236 O SER A 20 -11.379 5.258 7.326 1.00 0.00 O ATOM 237 CB SER A 20 -9.749 5.089 9.823 1.00 0.00 C ATOM 238 OG SER A 20 -10.456 3.861 9.920 1.00 0.00 O ATOM 0 H SER A 20 -7.357 5.839 7.663 1.00 0.00 H new ATOM 0 HA SER A 20 -8.929 4.375 7.983 1.00 0.00 H new ATOM 0 HB2 SER A 20 -8.912 5.083 10.522 1.00 0.00 H new ATOM 0 HB3 SER A 20 -10.404 5.909 10.117 1.00 0.00 H new ATOM 0 HG SER A 20 -10.435 3.402 9.054 1.00 0.00 H new ATOM 244 N GLY A 21 -10.195 7.156 7.087 1.00 0.00 N ATOM 245 CA GLY A 21 -11.125 7.834 6.218 1.00 0.00 C ATOM 246 C GLY A 21 -10.904 7.296 4.802 1.00 0.00 C ATOM 247 O GLY A 21 -10.269 6.251 4.632 1.00 0.00 O ATOM 0 H GLY A 21 -9.390 7.731 7.335 1.00 0.00 H new ATOM 0 HA2 GLY A 21 -12.151 7.656 6.540 1.00 0.00 H new ATOM 0 HA3 GLY A 21 -10.963 8.912 6.249 1.00 0.00 H new ATOM 251 N ALA A 22 -11.500 7.923 3.792 1.00 0.00 N ATOM 252 CA ALA A 22 -11.311 7.519 2.408 1.00 0.00 C ATOM 253 C ALA A 22 -10.504 8.677 1.835 1.00 0.00 C ATOM 254 O ALA A 22 -11.055 9.690 1.383 1.00 0.00 O ATOM 255 CB ALA A 22 -12.665 7.273 1.734 1.00 0.00 C ATOM 0 H ALA A 22 -12.124 8.721 3.912 1.00 0.00 H new ATOM 0 HA ALA A 22 -10.789 6.573 2.262 1.00 0.00 H new ATOM 0 HB1 ALA A 22 -12.507 6.971 0.699 1.00 0.00 H new ATOM 0 HB2 ALA A 22 -13.197 6.484 2.265 1.00 0.00 H new ATOM 0 HB3 ALA A 22 -13.255 8.189 1.759 1.00 0.00 H new ATOM 261 N ASP A 23 -9.185 8.526 1.855 1.00 0.00 N ATOM 262 CA ASP A 23 -8.220 9.512 1.395 1.00 0.00 C ATOM 263 C ASP A 23 -7.688 9.097 0.022 1.00 0.00 C ATOM 264 O ASP A 23 -8.003 8.030 -0.515 1.00 0.00 O ATOM 265 CB ASP A 23 -7.101 9.629 2.454 1.00 0.00 C ATOM 266 CG ASP A 23 -6.364 10.975 2.417 1.00 0.00 C ATOM 267 OD1 ASP A 23 -5.716 11.284 1.395 1.00 0.00 O ATOM 268 OD2 ASP A 23 -6.409 11.688 3.450 1.00 0.00 O ATOM 0 H ASP A 23 -8.742 7.677 2.207 1.00 0.00 H new ATOM 0 HA ASP A 23 -8.679 10.494 1.278 1.00 0.00 H new ATOM 0 HB2 ASP A 23 -7.533 9.487 3.445 1.00 0.00 H new ATOM 0 HB3 ASP A 23 -6.381 8.825 2.301 1.00 0.00 H new ATOM 273 N ARG A 24 -7.036 10.025 -0.663 1.00 0.00 N ATOM 274 CA ARG A 24 -6.413 9.824 -1.955 1.00 0.00 C ATOM 275 C ARG A 24 -5.176 10.669 -1.764 1.00 0.00 C ATOM 276 O ARG A 24 -5.196 11.887 -1.981 1.00 0.00 O ATOM 277 CB ARG A 24 -7.260 10.263 -3.157 1.00 0.00 C ATOM 278 CG ARG A 24 -8.585 9.519 -3.322 1.00 0.00 C ATOM 279 CD ARG A 24 -9.696 10.161 -2.498 1.00 0.00 C ATOM 280 NE ARG A 24 -11.000 9.642 -2.900 1.00 0.00 N ATOM 281 CZ ARG A 24 -12.157 10.286 -2.771 1.00 0.00 C ATOM 282 NH1 ARG A 24 -12.221 11.432 -2.104 1.00 0.00 N ATOM 283 NH2 ARG A 24 -13.245 9.770 -3.326 1.00 0.00 N ATOM 0 H ARG A 24 -6.924 10.977 -0.315 1.00 0.00 H new ATOM 0 HA ARG A 24 -6.240 8.777 -2.205 1.00 0.00 H new ATOM 0 HB2 ARG A 24 -7.469 11.329 -3.065 1.00 0.00 H new ATOM 0 HB3 ARG A 24 -6.671 10.131 -4.065 1.00 0.00 H new ATOM 0 HG2 ARG A 24 -8.870 9.511 -4.374 1.00 0.00 H new ATOM 0 HG3 ARG A 24 -8.460 8.480 -3.018 1.00 0.00 H new ATOM 0 HD2 ARG A 24 -9.531 9.964 -1.439 1.00 0.00 H new ATOM 0 HD3 ARG A 24 -9.674 11.243 -2.628 1.00 0.00 H new ATOM 0 HE ARG A 24 -11.026 8.710 -3.313 1.00 0.00 H new ATOM 0 HH11 ARG A 24 -11.379 11.826 -1.685 1.00 0.00 H new ATOM 0 HH12 ARG A 24 -13.113 11.919 -2.010 1.00 0.00 H new ATOM 0 HH21 ARG A 24 -13.187 8.892 -3.842 1.00 0.00 H new ATOM 0 HH22 ARG A 24 -14.140 10.251 -3.237 1.00 0.00 H new ATOM 297 N LEU A 25 -4.088 9.989 -1.430 1.00 0.00 N ATOM 298 CA LEU A 25 -2.815 10.610 -1.151 1.00 0.00 C ATOM 299 C LEU A 25 -1.789 10.279 -2.210 1.00 0.00 C ATOM 300 O LEU A 25 -1.696 9.151 -2.698 1.00 0.00 O ATOM 301 CB LEU A 25 -2.335 10.262 0.274 1.00 0.00 C ATOM 302 CG LEU A 25 -2.710 8.883 0.854 1.00 0.00 C ATOM 303 CD1 LEU A 25 -2.126 7.684 0.097 1.00 0.00 C ATOM 304 CD2 LEU A 25 -2.214 8.822 2.294 1.00 0.00 C ATOM 0 H LEU A 25 -4.072 8.973 -1.346 1.00 0.00 H new ATOM 0 HA LEU A 25 -2.949 11.691 -1.187 1.00 0.00 H new ATOM 0 HB2 LEU A 25 -1.248 10.345 0.289 1.00 0.00 H new ATOM 0 HB3 LEU A 25 -2.722 11.024 0.951 1.00 0.00 H new ATOM 0 HG LEU A 25 -3.793 8.801 0.768 1.00 0.00 H new ATOM 0 HD11 LEU A 25 -2.444 6.759 0.579 1.00 0.00 H new ATOM 0 HD12 LEU A 25 -2.480 7.697 -0.934 1.00 0.00 H new ATOM 0 HD13 LEU A 25 -1.038 7.742 0.107 1.00 0.00 H new ATOM 0 HD21 LEU A 25 -2.468 7.854 2.726 1.00 0.00 H new ATOM 0 HD22 LEU A 25 -1.132 8.954 2.312 1.00 0.00 H new ATOM 0 HD23 LEU A 25 -2.686 9.614 2.875 1.00 0.00 H new ATOM 316 N ASP A 26 -0.967 11.285 -2.493 1.00 0.00 N ATOM 317 CA ASP A 26 0.101 11.199 -3.466 1.00 0.00 C ATOM 318 C ASP A 26 1.336 11.886 -2.911 1.00 0.00 C ATOM 319 O ASP A 26 1.261 13.030 -2.462 1.00 0.00 O ATOM 320 CB ASP A 26 -0.286 11.960 -4.756 1.00 0.00 C ATOM 321 CG ASP A 26 -1.351 11.380 -5.704 1.00 0.00 C ATOM 322 OD1 ASP A 26 -2.460 10.976 -5.268 1.00 0.00 O ATOM 323 OD2 ASP A 26 -1.187 11.600 -6.933 1.00 0.00 O ATOM 0 H ASP A 26 -1.031 12.197 -2.041 1.00 0.00 H new ATOM 0 HA ASP A 26 0.284 10.146 -3.680 1.00 0.00 H new ATOM 0 HB2 ASP A 26 -0.624 12.952 -4.457 1.00 0.00 H new ATOM 0 HB3 ASP A 26 0.626 12.096 -5.338 1.00 0.00 H new ATOM 328 N GLY A 27 2.482 11.211 -2.989 1.00 0.00 N ATOM 329 CA GLY A 27 3.770 11.695 -2.514 1.00 0.00 C ATOM 330 C GLY A 27 4.185 12.948 -3.267 1.00 0.00 C ATOM 331 O GLY A 27 4.399 13.996 -2.659 1.00 0.00 O ATOM 0 H GLY A 27 2.537 10.279 -3.400 1.00 0.00 H new ATOM 0 HA2 GLY A 27 3.712 11.909 -1.447 1.00 0.00 H new ATOM 0 HA3 GLY A 27 4.525 10.920 -2.644 1.00 0.00 H new ATOM 335 N GLY A 28 4.236 12.869 -4.595 1.00 0.00 N ATOM 336 CA GLY A 28 4.609 13.983 -5.462 1.00 0.00 C ATOM 337 C GLY A 28 5.940 13.751 -6.160 1.00 0.00 C ATOM 338 O GLY A 28 5.963 13.071 -7.188 1.00 0.00 O ATOM 0 H GLY A 28 4.016 12.015 -5.107 1.00 0.00 H new ATOM 0 HA2 GLY A 28 3.831 14.135 -6.210 1.00 0.00 H new ATOM 0 HA3 GLY A 28 4.666 14.897 -4.871 1.00 0.00 H new ATOM 342 N ALA A 29 7.018 14.365 -5.666 1.00 0.00 N ATOM 343 CA ALA A 29 8.353 14.247 -6.228 1.00 0.00 C ATOM 344 C ALA A 29 9.344 14.291 -5.071 1.00 0.00 C ATOM 345 O ALA A 29 9.729 15.378 -4.637 1.00 0.00 O ATOM 346 CB ALA A 29 8.594 15.385 -7.230 1.00 0.00 C ATOM 0 H ALA A 29 6.979 14.970 -4.846 1.00 0.00 H new ATOM 0 HA ALA A 29 8.476 13.310 -6.771 1.00 0.00 H new ATOM 0 HB1 ALA A 29 9.596 15.294 -7.650 1.00 0.00 H new ATOM 0 HB2 ALA A 29 7.858 15.326 -8.032 1.00 0.00 H new ATOM 0 HB3 ALA A 29 8.500 16.344 -6.721 1.00 0.00 H new ATOM 352 N GLY A 30 9.751 13.135 -4.563 1.00 0.00 N ATOM 353 CA GLY A 30 10.682 13.048 -3.456 1.00 0.00 C ATOM 354 C GLY A 30 10.795 11.606 -2.995 1.00 0.00 C ATOM 355 O GLY A 30 10.384 10.678 -3.689 1.00 0.00 O ATOM 0 H GLY A 30 9.440 12.229 -4.913 1.00 0.00 H new ATOM 0 HA2 GLY A 30 11.660 13.420 -3.761 1.00 0.00 H new ATOM 0 HA3 GLY A 30 10.343 13.678 -2.633 1.00 0.00 H new ATOM 359 N ASP A 31 11.446 11.401 -1.863 1.00 0.00 N ATOM 360 CA ASP A 31 11.711 10.189 -1.154 1.00 0.00 C ATOM 361 C ASP A 31 10.791 10.417 0.058 1.00 0.00 C ATOM 362 O ASP A 31 11.212 10.980 1.077 1.00 0.00 O ATOM 363 CB ASP A 31 13.203 10.247 -0.821 1.00 0.00 C ATOM 364 CG ASP A 31 14.155 9.338 -1.597 1.00 0.00 C ATOM 365 OD1 ASP A 31 13.755 8.396 -2.317 1.00 0.00 O ATOM 366 OD2 ASP A 31 15.375 9.589 -1.460 1.00 0.00 O ATOM 0 H ASP A 31 11.848 12.195 -1.366 1.00 0.00 H new ATOM 0 HA ASP A 31 11.532 9.224 -1.629 1.00 0.00 H new ATOM 0 HB2 ASP A 31 13.535 11.275 -0.963 1.00 0.00 H new ATOM 0 HB3 ASP A 31 13.316 10.019 0.239 1.00 0.00 H new ATOM 371 N ASP A 32 9.500 10.114 -0.095 1.00 0.00 N ATOM 372 CA ASP A 32 8.426 10.299 0.873 1.00 0.00 C ATOM 373 C ASP A 32 7.709 8.954 1.049 1.00 0.00 C ATOM 374 O ASP A 32 7.988 8.019 0.288 1.00 0.00 O ATOM 375 CB ASP A 32 7.517 11.475 0.451 1.00 0.00 C ATOM 376 CG ASP A 32 8.138 12.533 -0.489 1.00 0.00 C ATOM 377 OD1 ASP A 32 9.148 13.179 -0.135 1.00 0.00 O ATOM 378 OD2 ASP A 32 7.632 12.671 -1.627 1.00 0.00 O ATOM 0 H ASP A 32 9.157 9.703 -0.963 1.00 0.00 H new ATOM 0 HA ASP A 32 8.806 10.588 1.853 1.00 0.00 H new ATOM 0 HB2 ASP A 32 6.634 11.063 -0.037 1.00 0.00 H new ATOM 0 HB3 ASP A 32 7.175 11.981 1.354 1.00 0.00 H new ATOM 383 N ILE A 33 6.886 8.770 2.091 1.00 0.00 N ATOM 384 CA ILE A 33 6.199 7.499 2.325 1.00 0.00 C ATOM 385 C ILE A 33 4.708 7.739 2.614 1.00 0.00 C ATOM 386 O ILE A 33 4.340 8.818 3.080 1.00 0.00 O ATOM 387 CB ILE A 33 6.990 6.714 3.397 1.00 0.00 C ATOM 388 CG1 ILE A 33 7.300 7.500 4.687 1.00 0.00 C ATOM 389 CG2 ILE A 33 8.290 6.157 2.784 1.00 0.00 C ATOM 390 CD1 ILE A 33 8.624 8.282 4.785 1.00 0.00 C ATOM 0 H ILE A 33 6.682 9.489 2.785 1.00 0.00 H new ATOM 0 HA ILE A 33 6.185 6.864 1.439 1.00 0.00 H new ATOM 0 HB ILE A 33 6.332 5.904 3.711 1.00 0.00 H new ATOM 0 HG12 ILE A 33 6.487 8.209 4.844 1.00 0.00 H new ATOM 0 HG13 ILE A 33 7.272 6.794 5.517 1.00 0.00 H new ATOM 0 HG21 ILE A 33 8.843 5.605 3.544 1.00 0.00 H new ATOM 0 HG22 ILE A 33 8.046 5.490 1.957 1.00 0.00 H new ATOM 0 HG23 ILE A 33 8.902 6.981 2.417 1.00 0.00 H new ATOM 0 HD11 ILE A 33 8.684 8.776 5.755 1.00 0.00 H new ATOM 0 HD12 ILE A 33 9.462 7.594 4.677 1.00 0.00 H new ATOM 0 HD13 ILE A 33 8.664 9.030 3.993 1.00 0.00 H new ATOM 402 N LEU A 34 3.835 6.752 2.356 1.00 0.00 N ATOM 403 CA LEU A 34 2.387 6.875 2.540 1.00 0.00 C ATOM 404 C LEU A 34 1.791 5.622 3.203 1.00 0.00 C ATOM 405 O LEU A 34 2.428 4.571 3.250 1.00 0.00 O ATOM 406 CB LEU A 34 1.669 7.206 1.193 1.00 0.00 C ATOM 407 CG LEU A 34 2.468 7.938 0.099 1.00 0.00 C ATOM 408 CD1 LEU A 34 3.387 6.971 -0.658 1.00 0.00 C ATOM 409 CD2 LEU A 34 1.510 8.597 -0.897 1.00 0.00 C ATOM 0 H LEU A 34 4.122 5.837 2.010 1.00 0.00 H new ATOM 0 HA LEU A 34 2.215 7.711 3.218 1.00 0.00 H new ATOM 0 HB2 LEU A 34 1.308 6.269 0.770 1.00 0.00 H new ATOM 0 HB3 LEU A 34 0.792 7.810 1.424 1.00 0.00 H new ATOM 0 HG LEU A 34 3.081 8.697 0.586 1.00 0.00 H new ATOM 0 HD11 LEU A 34 3.938 7.517 -1.424 1.00 0.00 H new ATOM 0 HD12 LEU A 34 4.090 6.516 0.040 1.00 0.00 H new ATOM 0 HD13 LEU A 34 2.787 6.192 -1.129 1.00 0.00 H new ATOM 0 HD21 LEU A 34 2.084 9.112 -1.667 1.00 0.00 H new ATOM 0 HD22 LEU A 34 0.885 7.834 -1.360 1.00 0.00 H new ATOM 0 HD23 LEU A 34 0.878 9.315 -0.374 1.00 0.00 H new ATOM 421 N ASP A 35 0.558 5.721 3.704 1.00 0.00 N ATOM 422 CA ASP A 35 -0.219 4.673 4.373 1.00 0.00 C ATOM 423 C ASP A 35 -1.675 4.760 3.944 1.00 0.00 C ATOM 424 O ASP A 35 -2.272 5.827 4.024 1.00 0.00 O ATOM 425 CB ASP A 35 -0.101 4.780 5.909 1.00 0.00 C ATOM 426 CG ASP A 35 -1.350 4.330 6.694 1.00 0.00 C ATOM 427 OD1 ASP A 35 -1.422 3.147 7.103 1.00 0.00 O ATOM 428 OD2 ASP A 35 -2.196 5.182 7.058 1.00 0.00 O ATOM 0 H ASP A 35 0.039 6.597 3.650 1.00 0.00 H new ATOM 0 HA ASP A 35 0.185 3.705 4.078 1.00 0.00 H new ATOM 0 HB2 ASP A 35 0.749 4.181 6.235 1.00 0.00 H new ATOM 0 HB3 ASP A 35 0.119 5.815 6.170 1.00 0.00 H new ATOM 433 N GLY A 36 -2.256 3.635 3.526 1.00 0.00 N ATOM 434 CA GLY A 36 -3.642 3.583 3.075 1.00 0.00 C ATOM 435 C GLY A 36 -4.669 3.658 4.205 1.00 0.00 C ATOM 436 O GLY A 36 -5.795 4.088 3.962 1.00 0.00 O ATOM 0 H GLY A 36 -1.777 2.735 3.492 1.00 0.00 H new ATOM 0 HA2 GLY A 36 -3.819 4.406 2.383 1.00 0.00 H new ATOM 0 HA3 GLY A 36 -3.797 2.659 2.518 1.00 0.00 H new ATOM 440 N GLY A 37 -4.301 3.279 5.433 1.00 0.00 N ATOM 441 CA GLY A 37 -5.192 3.289 6.590 1.00 0.00 C ATOM 442 C GLY A 37 -6.335 2.274 6.437 1.00 0.00 C ATOM 443 O GLY A 37 -6.523 1.668 5.378 1.00 0.00 O ATOM 0 H GLY A 37 -3.360 2.952 5.651 1.00 0.00 H new ATOM 0 HA2 GLY A 37 -4.621 3.061 7.490 1.00 0.00 H new ATOM 0 HA3 GLY A 37 -5.608 4.288 6.720 1.00 0.00 H new ATOM 447 N ALA A 38 -7.099 2.033 7.512 1.00 0.00 N ATOM 448 CA ALA A 38 -8.207 1.085 7.442 1.00 0.00 C ATOM 449 C ALA A 38 -9.331 1.723 6.624 1.00 0.00 C ATOM 450 O ALA A 38 -10.182 2.434 7.173 1.00 0.00 O ATOM 451 CB ALA A 38 -8.665 0.794 8.880 1.00 0.00 C ATOM 0 H ALA A 38 -6.970 2.475 8.422 1.00 0.00 H new ATOM 0 HA ALA A 38 -7.915 0.150 6.964 1.00 0.00 H new ATOM 0 HB1 ALA A 38 -9.494 0.087 8.862 1.00 0.00 H new ATOM 0 HB2 ALA A 38 -7.837 0.368 9.446 1.00 0.00 H new ATOM 0 HB3 ALA A 38 -8.989 1.721 9.353 1.00 0.00 H new ATOM 457 N GLY A 39 -9.483 1.250 5.392 1.00 0.00 N ATOM 458 CA GLY A 39 -10.438 1.694 4.422 1.00 0.00 C ATOM 459 C GLY A 39 -9.977 1.296 3.025 1.00 0.00 C ATOM 460 O GLY A 39 -9.076 0.470 2.875 1.00 0.00 O ATOM 0 H GLY A 39 -8.896 0.496 5.035 1.00 0.00 H new ATOM 0 HA2 GLY A 39 -11.414 1.256 4.632 1.00 0.00 H new ATOM 0 HA3 GLY A 39 -10.555 2.776 4.482 1.00 0.00 H new ATOM 464 N ARG A 40 -10.646 1.820 2.000 1.00 0.00 N ATOM 465 CA ARG A 40 -10.411 1.618 0.581 1.00 0.00 C ATOM 466 C ARG A 40 -10.018 2.975 0.014 1.00 0.00 C ATOM 467 O ARG A 40 -10.882 3.785 -0.364 1.00 0.00 O ATOM 468 CB ARG A 40 -11.675 1.008 -0.002 1.00 0.00 C ATOM 469 CG ARG A 40 -12.963 1.822 0.172 1.00 0.00 C ATOM 470 CD ARG A 40 -14.112 0.938 0.649 1.00 0.00 C ATOM 471 NE ARG A 40 -15.369 1.667 0.463 1.00 0.00 N ATOM 472 CZ ARG A 40 -15.843 2.676 1.201 1.00 0.00 C ATOM 473 NH1 ARG A 40 -15.443 2.891 2.450 1.00 0.00 N ATOM 474 NH2 ARG A 40 -16.738 3.480 0.646 1.00 0.00 N ATOM 0 H ARG A 40 -11.432 2.450 2.160 1.00 0.00 H new ATOM 0 HA ARG A 40 -9.604 0.927 0.338 1.00 0.00 H new ATOM 0 HB2 ARG A 40 -11.516 0.843 -1.068 1.00 0.00 H new ATOM 0 HB3 ARG A 40 -11.824 0.029 0.453 1.00 0.00 H new ATOM 0 HG2 ARG A 40 -12.795 2.625 0.890 1.00 0.00 H new ATOM 0 HG3 ARG A 40 -13.230 2.292 -0.774 1.00 0.00 H new ATOM 0 HD2 ARG A 40 -14.129 0.004 0.087 1.00 0.00 H new ATOM 0 HD3 ARG A 40 -13.978 0.676 1.699 1.00 0.00 H new ATOM 0 HE ARG A 40 -15.950 1.370 -0.321 1.00 0.00 H new ATOM 0 HH11 ARG A 40 -14.751 2.275 2.877 1.00 0.00 H new ATOM 0 HH12 ARG A 40 -15.828 3.672 2.982 1.00 0.00 H new ATOM 0 HH21 ARG A 40 -17.043 3.318 -0.314 1.00 0.00 H new ATOM 0 HH22 ARG A 40 -17.122 4.261 1.179 1.00 0.00 H new ATOM 488 N ASP A 41 -8.723 3.175 -0.144 1.00 0.00 N ATOM 489 CA ASP A 41 -8.116 4.419 -0.594 1.00 0.00 C ATOM 490 C ASP A 41 -7.495 4.265 -1.980 1.00 0.00 C ATOM 491 O ASP A 41 -7.437 3.152 -2.519 1.00 0.00 O ATOM 492 CB ASP A 41 -7.161 4.923 0.501 1.00 0.00 C ATOM 493 CG ASP A 41 -7.896 5.408 1.771 1.00 0.00 C ATOM 494 OD1 ASP A 41 -8.969 4.860 2.115 1.00 0.00 O ATOM 495 OD2 ASP A 41 -7.395 6.366 2.402 1.00 0.00 O ATOM 0 H ASP A 41 -8.035 2.446 0.045 1.00 0.00 H new ATOM 0 HA ASP A 41 -8.870 5.194 -0.734 1.00 0.00 H new ATOM 0 HB2 ASP A 41 -6.472 4.122 0.771 1.00 0.00 H new ATOM 0 HB3 ASP A 41 -6.560 5.740 0.102 1.00 0.00 H new ATOM 500 N ARG A 42 -7.221 5.391 -2.649 1.00 0.00 N ATOM 501 CA ARG A 42 -6.627 5.450 -3.982 1.00 0.00 C ATOM 502 C ARG A 42 -5.297 6.204 -3.921 1.00 0.00 C ATOM 503 O ARG A 42 -5.296 7.438 -3.895 1.00 0.00 O ATOM 504 CB ARG A 42 -7.621 6.130 -4.923 1.00 0.00 C ATOM 505 CG ARG A 42 -7.132 6.049 -6.372 1.00 0.00 C ATOM 506 CD ARG A 42 -7.984 6.922 -7.297 1.00 0.00 C ATOM 507 NE ARG A 42 -7.145 7.485 -8.361 1.00 0.00 N ATOM 508 CZ ARG A 42 -7.415 7.625 -9.656 1.00 0.00 C ATOM 509 NH1 ARG A 42 -8.588 7.254 -10.157 1.00 0.00 N ATOM 510 NH2 ARG A 42 -6.480 8.155 -10.430 1.00 0.00 N ATOM 0 H ARG A 42 -7.414 6.314 -2.261 1.00 0.00 H new ATOM 0 HA ARG A 42 -6.417 4.449 -4.358 1.00 0.00 H new ATOM 0 HB2 ARG A 42 -8.597 5.653 -4.836 1.00 0.00 H new ATOM 0 HB3 ARG A 42 -7.749 7.173 -4.634 1.00 0.00 H new ATOM 0 HG2 ARG A 42 -6.091 6.368 -6.425 1.00 0.00 H new ATOM 0 HG3 ARG A 42 -7.166 5.014 -6.712 1.00 0.00 H new ATOM 0 HD2 ARG A 42 -8.789 6.330 -7.731 1.00 0.00 H new ATOM 0 HD3 ARG A 42 -8.451 7.725 -6.726 1.00 0.00 H new ATOM 0 HE ARG A 42 -6.226 7.815 -8.066 1.00 0.00 H new ATOM 0 HH11 ARG A 42 -9.300 6.854 -9.546 1.00 0.00 H new ATOM 0 HH12 ARG A 42 -8.777 7.369 -11.153 1.00 0.00 H new ATOM 0 HH21 ARG A 42 -5.587 8.441 -10.028 1.00 0.00 H new ATOM 0 HH22 ARG A 42 -6.653 8.277 -11.428 1.00 0.00 H new ATOM 524 N LEU A 43 -4.171 5.497 -3.954 1.00 0.00 N ATOM 525 CA LEU A 43 -2.839 6.072 -3.876 1.00 0.00 C ATOM 526 C LEU A 43 -2.081 6.100 -5.209 1.00 0.00 C ATOM 527 O LEU A 43 -2.306 5.260 -6.082 1.00 0.00 O ATOM 528 CB LEU A 43 -2.115 5.309 -2.766 1.00 0.00 C ATOM 529 CG LEU A 43 -1.875 3.795 -2.933 1.00 0.00 C ATOM 530 CD1 LEU A 43 -0.498 3.513 -3.522 1.00 0.00 C ATOM 531 CD2 LEU A 43 -1.922 3.127 -1.558 1.00 0.00 C ATOM 0 H LEU A 43 -4.164 4.481 -4.038 1.00 0.00 H new ATOM 0 HA LEU A 43 -2.901 7.134 -3.637 1.00 0.00 H new ATOM 0 HB2 LEU A 43 -1.144 5.782 -2.621 1.00 0.00 H new ATOM 0 HB3 LEU A 43 -2.680 5.453 -1.845 1.00 0.00 H new ATOM 0 HG LEU A 43 -2.645 3.408 -3.600 1.00 0.00 H new ATOM 0 HD11 LEU A 43 -0.361 2.437 -3.627 1.00 0.00 H new ATOM 0 HD12 LEU A 43 -0.417 3.986 -4.501 1.00 0.00 H new ATOM 0 HD13 LEU A 43 0.270 3.914 -2.860 1.00 0.00 H new ATOM 0 HD21 LEU A 43 -1.753 2.056 -1.668 1.00 0.00 H new ATOM 0 HD22 LEU A 43 -1.148 3.553 -0.920 1.00 0.00 H new ATOM 0 HD23 LEU A 43 -2.899 3.296 -1.105 1.00 0.00 H new ATOM 543 N SER A 44 -1.222 7.110 -5.378 1.00 0.00 N ATOM 544 CA SER A 44 -0.371 7.366 -6.541 1.00 0.00 C ATOM 545 C SER A 44 0.873 8.069 -5.980 1.00 0.00 C ATOM 546 O SER A 44 0.821 9.265 -5.703 1.00 0.00 O ATOM 547 CB SER A 44 -1.169 8.207 -7.553 1.00 0.00 C ATOM 548 OG SER A 44 -0.478 8.466 -8.766 1.00 0.00 O ATOM 0 H SER A 44 -1.095 7.818 -4.655 1.00 0.00 H new ATOM 0 HA SER A 44 -0.059 6.473 -7.082 1.00 0.00 H new ATOM 0 HB2 SER A 44 -2.102 7.691 -7.782 1.00 0.00 H new ATOM 0 HB3 SER A 44 -1.435 9.157 -7.089 1.00 0.00 H new ATOM 0 HG SER A 44 -1.046 9.002 -9.358 1.00 0.00 H new ATOM 554 N GLY A 45 1.993 7.372 -5.801 1.00 0.00 N ATOM 555 CA GLY A 45 3.207 7.933 -5.217 1.00 0.00 C ATOM 556 C GLY A 45 3.864 9.047 -6.006 1.00 0.00 C ATOM 557 O GLY A 45 4.143 10.110 -5.447 1.00 0.00 O ATOM 0 H GLY A 45 2.083 6.390 -6.061 1.00 0.00 H new ATOM 0 HA2 GLY A 45 2.969 8.310 -4.222 1.00 0.00 H new ATOM 0 HA3 GLY A 45 3.931 7.128 -5.088 1.00 0.00 H new ATOM 561 N GLY A 46 4.034 8.850 -7.307 1.00 0.00 N ATOM 562 CA GLY A 46 4.693 9.828 -8.162 1.00 0.00 C ATOM 563 C GLY A 46 6.176 9.460 -8.264 1.00 0.00 C ATOM 564 O GLY A 46 6.589 8.427 -7.735 1.00 0.00 O ATOM 0 H GLY A 46 3.721 8.012 -7.797 1.00 0.00 H new ATOM 0 HA2 GLY A 46 4.235 9.836 -9.151 1.00 0.00 H new ATOM 0 HA3 GLY A 46 4.579 10.830 -7.750 1.00 0.00 H new ATOM 568 N ALA A 47 6.984 10.295 -8.921 1.00 0.00 N ATOM 569 CA ALA A 47 8.412 10.037 -9.086 1.00 0.00 C ATOM 570 C ALA A 47 9.087 9.957 -7.713 1.00 0.00 C ATOM 571 O ALA A 47 9.011 10.920 -6.944 1.00 0.00 O ATOM 572 CB ALA A 47 9.040 11.137 -9.950 1.00 0.00 C ATOM 0 H ALA A 47 6.667 11.164 -9.351 1.00 0.00 H new ATOM 0 HA ALA A 47 8.557 9.082 -9.591 1.00 0.00 H new ATOM 0 HB1 ALA A 47 10.105 10.941 -10.071 1.00 0.00 H new ATOM 0 HB2 ALA A 47 8.560 11.149 -10.929 1.00 0.00 H new ATOM 0 HB3 ALA A 47 8.902 12.104 -9.466 1.00 0.00 H new ATOM 578 N GLY A 48 9.741 8.836 -7.406 1.00 0.00 N ATOM 579 CA GLY A 48 10.418 8.614 -6.139 1.00 0.00 C ATOM 580 C GLY A 48 10.520 7.124 -5.839 1.00 0.00 C ATOM 581 O GLY A 48 10.174 6.300 -6.683 1.00 0.00 O ATOM 0 H GLY A 48 9.813 8.046 -8.047 1.00 0.00 H new ATOM 0 HA2 GLY A 48 11.415 9.053 -6.172 1.00 0.00 H new ATOM 0 HA3 GLY A 48 9.875 9.115 -5.338 1.00 0.00 H new ATOM 585 N ALA A 49 11.090 6.775 -4.682 1.00 0.00 N ATOM 586 CA ALA A 49 11.230 5.406 -4.206 1.00 0.00 C ATOM 587 C ALA A 49 10.260 5.442 -3.018 1.00 0.00 C ATOM 588 O ALA A 49 10.669 5.650 -1.869 1.00 0.00 O ATOM 589 CB ALA A 49 12.677 5.138 -3.792 1.00 0.00 C ATOM 0 H ALA A 49 11.477 7.462 -4.035 1.00 0.00 H new ATOM 0 HA ALA A 49 11.012 4.617 -4.925 1.00 0.00 H new ATOM 0 HB1 ALA A 49 12.770 4.111 -3.438 1.00 0.00 H new ATOM 0 HB2 ALA A 49 13.334 5.287 -4.649 1.00 0.00 H new ATOM 0 HB3 ALA A 49 12.960 5.824 -2.994 1.00 0.00 H new ATOM 595 N ASP A 50 8.966 5.390 -3.314 1.00 0.00 N ATOM 596 CA ASP A 50 7.870 5.495 -2.364 1.00 0.00 C ATOM 597 C ASP A 50 7.612 4.188 -1.659 1.00 0.00 C ATOM 598 O ASP A 50 7.968 3.125 -2.152 1.00 0.00 O ATOM 599 CB ASP A 50 6.587 6.004 -3.039 1.00 0.00 C ATOM 600 CG ASP A 50 6.221 5.375 -4.396 1.00 0.00 C ATOM 601 OD1 ASP A 50 7.076 5.225 -5.298 1.00 0.00 O ATOM 602 OD2 ASP A 50 5.018 5.126 -4.603 1.00 0.00 O ATOM 0 H ASP A 50 8.639 5.267 -4.272 1.00 0.00 H new ATOM 0 HA ASP A 50 8.173 6.225 -1.614 1.00 0.00 H new ATOM 0 HB2 ASP A 50 5.755 5.842 -2.354 1.00 0.00 H new ATOM 0 HB3 ASP A 50 6.680 7.081 -3.178 1.00 0.00 H new ATOM 607 N THR A 51 7.019 4.277 -0.472 1.00 0.00 N ATOM 608 CA THR A 51 6.711 3.108 0.350 1.00 0.00 C ATOM 609 C THR A 51 5.238 3.100 0.745 1.00 0.00 C ATOM 610 O THR A 51 4.775 4.079 1.333 1.00 0.00 O ATOM 611 CB THR A 51 7.573 3.082 1.623 1.00 0.00 C ATOM 612 OG1 THR A 51 8.943 3.308 1.324 1.00 0.00 O ATOM 613 CG2 THR A 51 7.424 1.744 2.353 1.00 0.00 C ATOM 0 H THR A 51 6.738 5.162 -0.051 1.00 0.00 H new ATOM 0 HA THR A 51 6.932 2.223 -0.247 1.00 0.00 H new ATOM 0 HB THR A 51 7.220 3.885 2.270 1.00 0.00 H new ATOM 0 HG1 THR A 51 9.466 3.288 2.152 1.00 0.00 H new ATOM 0 HG21 THR A 51 8.043 1.748 3.250 1.00 0.00 H new ATOM 0 HG22 THR A 51 6.381 1.596 2.632 1.00 0.00 H new ATOM 0 HG23 THR A 51 7.742 0.934 1.697 1.00 0.00 H new ATOM 621 N PHE A 52 4.522 2.009 0.460 1.00 0.00 N ATOM 622 CA PHE A 52 3.121 1.844 0.817 1.00 0.00 C ATOM 623 C PHE A 52 3.136 1.097 2.144 1.00 0.00 C ATOM 624 O PHE A 52 3.745 0.023 2.248 1.00 0.00 O ATOM 625 CB PHE A 52 2.356 1.044 -0.247 1.00 0.00 C ATOM 626 CG PHE A 52 2.491 1.532 -1.671 1.00 0.00 C ATOM 627 CD1 PHE A 52 2.722 2.890 -1.947 1.00 0.00 C ATOM 628 CD2 PHE A 52 2.441 0.606 -2.728 1.00 0.00 C ATOM 629 CE1 PHE A 52 2.988 3.291 -3.259 1.00 0.00 C ATOM 630 CE2 PHE A 52 2.728 1.015 -4.040 1.00 0.00 C ATOM 631 CZ PHE A 52 3.028 2.361 -4.307 1.00 0.00 C ATOM 0 H PHE A 52 4.911 1.206 -0.033 1.00 0.00 H new ATOM 0 HA PHE A 52 2.613 2.806 0.889 1.00 0.00 H new ATOM 0 HB2 PHE A 52 2.693 0.008 -0.206 1.00 0.00 H new ATOM 0 HB3 PHE A 52 1.299 1.045 0.017 1.00 0.00 H new ATOM 0 HD1 PHE A 52 2.694 3.619 -1.151 1.00 0.00 H new ATOM 0 HD2 PHE A 52 2.181 -0.423 -2.530 1.00 0.00 H new ATOM 0 HE1 PHE A 52 3.166 4.335 -3.469 1.00 0.00 H new ATOM 0 HE2 PHE A 52 2.718 0.294 -4.844 1.00 0.00 H new ATOM 0 HZ PHE A 52 3.286 2.675 -5.307 1.00 0.00 H new ATOM 641 N VAL A 53 2.516 1.658 3.173 1.00 0.00 N ATOM 642 CA VAL A 53 2.457 1.061 4.494 1.00 0.00 C ATOM 643 C VAL A 53 1.000 0.678 4.729 1.00 0.00 C ATOM 644 O VAL A 53 0.171 1.526 5.051 1.00 0.00 O ATOM 645 CB VAL A 53 3.036 2.043 5.536 1.00 0.00 C ATOM 646 CG1 VAL A 53 3.015 1.440 6.950 1.00 0.00 C ATOM 647 CG2 VAL A 53 4.484 2.448 5.196 1.00 0.00 C ATOM 0 H VAL A 53 2.033 2.554 3.109 1.00 0.00 H new ATOM 0 HA VAL A 53 3.067 0.162 4.586 1.00 0.00 H new ATOM 0 HB VAL A 53 2.400 2.927 5.508 1.00 0.00 H new ATOM 0 HG11 VAL A 53 3.429 2.158 7.658 1.00 0.00 H new ATOM 0 HG12 VAL A 53 1.988 1.205 7.230 1.00 0.00 H new ATOM 0 HG13 VAL A 53 3.613 0.529 6.966 1.00 0.00 H new ATOM 0 HG21 VAL A 53 4.856 3.139 5.952 1.00 0.00 H new ATOM 0 HG22 VAL A 53 5.115 1.559 5.175 1.00 0.00 H new ATOM 0 HG23 VAL A 53 4.507 2.932 4.220 1.00 0.00 H new ATOM 657 N PHE A 54 0.687 -0.607 4.564 1.00 0.00 N ATOM 658 CA PHE A 54 -0.650 -1.143 4.763 1.00 0.00 C ATOM 659 C PHE A 54 -0.513 -2.152 5.898 1.00 0.00 C ATOM 660 O PHE A 54 0.257 -3.106 5.767 1.00 0.00 O ATOM 661 CB PHE A 54 -1.225 -1.672 3.435 1.00 0.00 C ATOM 662 CG PHE A 54 -0.932 -3.109 3.049 1.00 0.00 C ATOM 663 CD1 PHE A 54 -1.815 -4.135 3.441 1.00 0.00 C ATOM 664 CD2 PHE A 54 0.188 -3.422 2.261 1.00 0.00 C ATOM 665 CE1 PHE A 54 -1.564 -5.467 3.070 1.00 0.00 C ATOM 666 CE2 PHE A 54 0.436 -4.754 1.888 1.00 0.00 C ATOM 667 CZ PHE A 54 -0.423 -5.783 2.312 1.00 0.00 C ATOM 0 H PHE A 54 1.369 -1.312 4.284 1.00 0.00 H new ATOM 0 HA PHE A 54 -1.391 -0.401 5.060 1.00 0.00 H new ATOM 0 HB2 PHE A 54 -2.308 -1.551 3.469 1.00 0.00 H new ATOM 0 HB3 PHE A 54 -0.857 -1.031 2.634 1.00 0.00 H new ATOM 0 HD1 PHE A 54 -2.689 -3.896 4.029 1.00 0.00 H new ATOM 0 HD2 PHE A 54 0.859 -2.638 1.942 1.00 0.00 H new ATOM 0 HE1 PHE A 54 -2.248 -6.248 3.367 1.00 0.00 H new ATOM 0 HE2 PHE A 54 1.292 -4.989 1.272 1.00 0.00 H new ATOM 0 HZ PHE A 54 -0.208 -6.810 2.057 1.00 0.00 H new ATOM 677 N SER A 55 -1.122 -1.920 7.066 1.00 0.00 N ATOM 678 CA SER A 55 -1.003 -2.842 8.191 1.00 0.00 C ATOM 679 C SER A 55 -2.102 -2.746 9.259 1.00 0.00 C ATOM 680 O SER A 55 -1.796 -2.862 10.454 1.00 0.00 O ATOM 681 CB SER A 55 0.422 -2.783 8.770 1.00 0.00 C ATOM 682 OG SER A 55 1.028 -1.494 8.752 1.00 0.00 O ATOM 0 H SER A 55 -1.701 -1.101 7.253 1.00 0.00 H new ATOM 0 HA SER A 55 -1.178 -3.837 7.782 1.00 0.00 H new ATOM 0 HB2 SER A 55 0.394 -3.140 9.799 1.00 0.00 H new ATOM 0 HB3 SER A 55 1.054 -3.472 8.210 1.00 0.00 H new ATOM 0 HG SER A 55 1.927 -1.550 9.139 1.00 0.00 H new ATOM 688 N ALA A 56 -3.369 -2.543 8.883 1.00 0.00 N ATOM 689 CA ALA A 56 -4.466 -2.462 9.852 1.00 0.00 C ATOM 690 C ALA A 56 -5.378 -3.683 9.752 1.00 0.00 C ATOM 691 O ALA A 56 -5.206 -4.549 8.899 1.00 0.00 O ATOM 692 CB ALA A 56 -5.239 -1.142 9.728 1.00 0.00 C ATOM 0 H ALA A 56 -3.660 -2.432 7.912 1.00 0.00 H new ATOM 0 HA ALA A 56 -4.030 -2.469 10.851 1.00 0.00 H new ATOM 0 HB1 ALA A 56 -6.044 -1.121 10.463 1.00 0.00 H new ATOM 0 HB2 ALA A 56 -4.563 -0.306 9.906 1.00 0.00 H new ATOM 0 HB3 ALA A 56 -5.661 -1.060 8.726 1.00 0.00 H new ATOM 698 N ARG A 57 -6.360 -3.790 10.649 1.00 0.00 N ATOM 699 CA ARG A 57 -7.300 -4.916 10.659 1.00 0.00 C ATOM 700 C ARG A 57 -8.125 -4.961 9.377 1.00 0.00 C ATOM 701 O ARG A 57 -8.287 -6.026 8.790 1.00 0.00 O ATOM 702 CB ARG A 57 -8.178 -4.876 11.920 1.00 0.00 C ATOM 703 CG ARG A 57 -9.078 -3.633 12.011 1.00 0.00 C ATOM 704 CD ARG A 57 -9.647 -3.459 13.409 1.00 0.00 C ATOM 705 NE ARG A 57 -10.611 -4.508 13.754 1.00 0.00 N ATOM 706 CZ ARG A 57 -11.268 -4.556 14.909 1.00 0.00 C ATOM 707 NH1 ARG A 57 -11.131 -3.571 15.793 1.00 0.00 N ATOM 708 NH2 ARG A 57 -12.038 -5.606 15.161 1.00 0.00 N ATOM 0 H ARG A 57 -6.527 -3.104 11.385 1.00 0.00 H new ATOM 0 HA ARG A 57 -6.728 -5.843 10.692 1.00 0.00 H new ATOM 0 HB2 ARG A 57 -8.803 -5.768 11.944 1.00 0.00 H new ATOM 0 HB3 ARG A 57 -7.536 -4.913 12.800 1.00 0.00 H new ATOM 0 HG2 ARG A 57 -8.505 -2.747 11.737 1.00 0.00 H new ATOM 0 HG3 ARG A 57 -9.894 -3.720 11.293 1.00 0.00 H new ATOM 0 HD2 ARG A 57 -8.832 -3.465 14.133 1.00 0.00 H new ATOM 0 HD3 ARG A 57 -10.132 -2.485 13.483 1.00 0.00 H new ATOM 0 HE ARG A 57 -10.788 -5.243 13.069 1.00 0.00 H new ATOM 0 HH11 ARG A 57 -10.522 -2.780 15.584 1.00 0.00 H new ATOM 0 HH12 ARG A 57 -11.635 -3.607 16.679 1.00 0.00 H new ATOM 0 HH21 ARG A 57 -12.117 -6.357 14.475 1.00 0.00 H new ATOM 0 HH22 ARG A 57 -12.551 -5.663 16.041 1.00 0.00 H new ATOM 722 N GLU A 58 -8.660 -3.810 8.966 1.00 0.00 N ATOM 723 CA GLU A 58 -9.465 -3.685 7.768 1.00 0.00 C ATOM 724 C GLU A 58 -8.538 -3.550 6.563 1.00 0.00 C ATOM 725 O GLU A 58 -8.825 -4.116 5.512 1.00 0.00 O ATOM 726 CB GLU A 58 -10.373 -2.458 7.914 1.00 0.00 C ATOM 727 CG GLU A 58 -11.281 -2.534 9.156 1.00 0.00 C ATOM 728 CD GLU A 58 -12.696 -1.995 8.929 1.00 0.00 C ATOM 729 OE1 GLU A 58 -12.879 -0.801 8.599 1.00 0.00 O ATOM 730 OE2 GLU A 58 -13.653 -2.788 9.129 1.00 0.00 O ATOM 0 H GLU A 58 -8.540 -2.931 9.469 1.00 0.00 H new ATOM 0 HA GLU A 58 -10.091 -4.565 7.622 1.00 0.00 H new ATOM 0 HB2 GLU A 58 -9.757 -1.561 7.974 1.00 0.00 H new ATOM 0 HB3 GLU A 58 -10.992 -2.361 7.022 1.00 0.00 H new ATOM 0 HG2 GLU A 58 -11.347 -3.572 9.482 1.00 0.00 H new ATOM 0 HG3 GLU A 58 -10.816 -1.974 9.968 1.00 0.00 H new ATOM 737 N ASP A 59 -7.418 -2.834 6.730 1.00 0.00 N ATOM 738 CA ASP A 59 -6.405 -2.610 5.699 1.00 0.00 C ATOM 739 C ASP A 59 -5.561 -3.888 5.596 1.00 0.00 C ATOM 740 O ASP A 59 -4.388 -3.927 5.971 1.00 0.00 O ATOM 741 CB ASP A 59 -5.520 -1.414 6.051 1.00 0.00 C ATOM 742 CG ASP A 59 -4.575 -1.017 4.920 1.00 0.00 C ATOM 743 OD1 ASP A 59 -4.772 -1.479 3.768 1.00 0.00 O ATOM 744 OD2 ASP A 59 -3.640 -0.251 5.236 1.00 0.00 O ATOM 0 H ASP A 59 -7.188 -2.382 7.615 1.00 0.00 H new ATOM 0 HA ASP A 59 -6.884 -2.387 4.746 1.00 0.00 H new ATOM 0 HB2 ASP A 59 -6.153 -0.563 6.304 1.00 0.00 H new ATOM 0 HB3 ASP A 59 -4.935 -1.651 6.939 1.00 0.00 H new ATOM 749 N SER A 60 -6.197 -4.974 5.162 1.00 0.00 N ATOM 750 CA SER A 60 -5.586 -6.284 5.037 1.00 0.00 C ATOM 751 C SER A 60 -6.336 -7.175 4.053 1.00 0.00 C ATOM 752 O SER A 60 -5.718 -7.989 3.361 1.00 0.00 O ATOM 753 CB SER A 60 -5.674 -6.921 6.440 1.00 0.00 C ATOM 754 OG SER A 60 -4.936 -8.124 6.569 1.00 0.00 O ATOM 0 H SER A 60 -7.178 -4.961 4.882 1.00 0.00 H new ATOM 0 HA SER A 60 -4.565 -6.185 4.669 1.00 0.00 H new ATOM 0 HB2 SER A 60 -5.314 -6.204 7.178 1.00 0.00 H new ATOM 0 HB3 SER A 60 -6.720 -7.120 6.673 1.00 0.00 H new ATOM 0 HG SER A 60 -5.543 -8.890 6.495 1.00 0.00 H new ATOM 760 N TYR A 61 -7.668 -7.084 4.021 1.00 0.00 N ATOM 761 CA TYR A 61 -8.501 -7.909 3.162 1.00 0.00 C ATOM 762 C TYR A 61 -9.909 -7.329 3.062 1.00 0.00 C ATOM 763 O TYR A 61 -10.262 -6.358 3.735 1.00 0.00 O ATOM 764 CB TYR A 61 -8.557 -9.324 3.787 1.00 0.00 C ATOM 765 CG TYR A 61 -8.636 -9.380 5.309 1.00 0.00 C ATOM 766 CD1 TYR A 61 -9.773 -8.896 5.991 1.00 0.00 C ATOM 767 CD2 TYR A 61 -7.580 -9.956 6.044 1.00 0.00 C ATOM 768 CE1 TYR A 61 -9.853 -8.977 7.392 1.00 0.00 C ATOM 769 CE2 TYR A 61 -7.664 -10.060 7.443 1.00 0.00 C ATOM 770 CZ TYR A 61 -8.797 -9.564 8.124 1.00 0.00 C ATOM 771 OH TYR A 61 -8.882 -9.720 9.473 1.00 0.00 O ATOM 0 H TYR A 61 -8.196 -6.429 4.597 1.00 0.00 H new ATOM 0 HA TYR A 61 -8.083 -7.945 2.156 1.00 0.00 H new ATOM 0 HB2 TYR A 61 -9.422 -9.846 3.379 1.00 0.00 H new ATOM 0 HB3 TYR A 61 -7.673 -9.876 3.468 1.00 0.00 H new ATOM 0 HD1 TYR A 61 -10.588 -8.460 5.432 1.00 0.00 H new ATOM 0 HD2 TYR A 61 -6.702 -10.319 5.530 1.00 0.00 H new ATOM 0 HE1 TYR A 61 -10.720 -8.591 7.908 1.00 0.00 H new ATOM 0 HE2 TYR A 61 -6.860 -10.520 7.998 1.00 0.00 H new ATOM 0 HH TYR A 61 -9.820 -9.840 9.730 1.00 0.00 H new ATOM 781 N ARG A 62 -10.765 -7.992 2.291 1.00 0.00 N ATOM 782 CA ARG A 62 -12.157 -7.625 2.101 1.00 0.00 C ATOM 783 C ARG A 62 -12.962 -8.752 2.718 1.00 0.00 C ATOM 784 O ARG A 62 -12.488 -9.888 2.839 1.00 0.00 O ATOM 785 CB ARG A 62 -12.537 -7.407 0.627 1.00 0.00 C ATOM 786 CG ARG A 62 -12.221 -8.552 -0.353 1.00 0.00 C ATOM 787 CD ARG A 62 -12.905 -8.340 -1.716 1.00 0.00 C ATOM 788 NE ARG A 62 -14.374 -8.395 -1.612 1.00 0.00 N ATOM 789 CZ ARG A 62 -15.277 -7.875 -2.452 1.00 0.00 C ATOM 790 NH1 ARG A 62 -14.924 -7.172 -3.516 1.00 0.00 N ATOM 791 NH2 ARG A 62 -16.566 -8.063 -2.209 1.00 0.00 N ATOM 0 H ARG A 62 -10.497 -8.825 1.767 1.00 0.00 H new ATOM 0 HA ARG A 62 -12.360 -6.664 2.574 1.00 0.00 H new ATOM 0 HB2 ARG A 62 -13.607 -7.206 0.579 1.00 0.00 H new ATOM 0 HB3 ARG A 62 -12.028 -6.510 0.275 1.00 0.00 H new ATOM 0 HG2 ARG A 62 -11.143 -8.623 -0.494 1.00 0.00 H new ATOM 0 HG3 ARG A 62 -12.549 -9.499 0.076 1.00 0.00 H new ATOM 0 HD2 ARG A 62 -12.607 -7.375 -2.125 1.00 0.00 H new ATOM 0 HD3 ARG A 62 -12.562 -9.102 -2.416 1.00 0.00 H new ATOM 0 HE ARG A 62 -14.748 -8.889 -0.802 1.00 0.00 H new ATOM 0 HH11 ARG A 62 -13.937 -7.012 -3.717 1.00 0.00 H new ATOM 0 HH12 ARG A 62 -15.639 -6.790 -4.135 1.00 0.00 H new ATOM 0 HH21 ARG A 62 -16.858 -8.598 -1.391 1.00 0.00 H new ATOM 0 HH22 ARG A 62 -17.266 -7.673 -2.840 1.00 0.00 H new ATOM 805 N THR A 63 -14.177 -8.420 3.121 1.00 0.00 N ATOM 806 CA THR A 63 -15.092 -9.365 3.725 1.00 0.00 C ATOM 807 C THR A 63 -16.449 -9.152 3.085 1.00 0.00 C ATOM 808 O THR A 63 -16.726 -8.079 2.535 1.00 0.00 O ATOM 809 CB THR A 63 -15.098 -9.258 5.263 1.00 0.00 C ATOM 810 OG1 THR A 63 -15.179 -7.926 5.727 1.00 0.00 O ATOM 811 CG2 THR A 63 -13.856 -9.910 5.871 1.00 0.00 C ATOM 0 H THR A 63 -14.557 -7.477 3.036 1.00 0.00 H new ATOM 0 HA THR A 63 -14.774 -10.391 3.537 1.00 0.00 H new ATOM 0 HB THR A 63 -15.996 -9.787 5.584 1.00 0.00 H new ATOM 0 HG1 THR A 63 -15.181 -7.920 6.707 1.00 0.00 H new ATOM 0 HG21 THR A 63 -13.891 -9.817 6.956 1.00 0.00 H new ATOM 0 HG22 THR A 63 -13.828 -10.965 5.598 1.00 0.00 H new ATOM 0 HG23 THR A 63 -12.962 -9.413 5.493 1.00 0.00 H new ATOM 819 N ASP A 64 -17.331 -10.144 3.203 1.00 0.00 N ATOM 820 CA ASP A 64 -18.665 -10.063 2.627 1.00 0.00 C ATOM 821 C ASP A 64 -19.446 -8.857 3.167 1.00 0.00 C ATOM 822 O ASP A 64 -20.313 -8.339 2.470 1.00 0.00 O ATOM 823 CB ASP A 64 -19.433 -11.365 2.856 1.00 0.00 C ATOM 824 CG ASP A 64 -20.778 -11.304 2.143 1.00 0.00 C ATOM 825 OD1 ASP A 64 -20.780 -11.164 0.899 1.00 0.00 O ATOM 826 OD2 ASP A 64 -21.825 -11.367 2.827 1.00 0.00 O ATOM 0 H ASP A 64 -17.140 -11.016 3.696 1.00 0.00 H new ATOM 0 HA ASP A 64 -18.552 -9.917 1.553 1.00 0.00 H new ATOM 0 HB2 ASP A 64 -18.853 -12.210 2.485 1.00 0.00 H new ATOM 0 HB3 ASP A 64 -19.584 -11.526 3.923 1.00 0.00 H new ATOM 831 N THR A 65 -19.105 -8.357 4.357 1.00 0.00 N ATOM 832 CA THR A 65 -19.758 -7.210 4.972 1.00 0.00 C ATOM 833 C THR A 65 -19.050 -5.878 4.651 1.00 0.00 C ATOM 834 O THR A 65 -19.674 -4.821 4.798 1.00 0.00 O ATOM 835 CB THR A 65 -19.859 -7.484 6.484 1.00 0.00 C ATOM 836 OG1 THR A 65 -20.746 -6.578 7.117 1.00 0.00 O ATOM 837 CG2 THR A 65 -18.497 -7.483 7.189 1.00 0.00 C ATOM 0 H THR A 65 -18.354 -8.748 4.926 1.00 0.00 H new ATOM 0 HA THR A 65 -20.758 -7.089 4.555 1.00 0.00 H new ATOM 0 HB THR A 65 -20.263 -8.492 6.577 1.00 0.00 H new ATOM 0 HG1 THR A 65 -20.790 -6.779 8.075 1.00 0.00 H new ATOM 0 HG21 THR A 65 -18.637 -7.682 8.252 1.00 0.00 H new ATOM 0 HG22 THR A 65 -17.862 -8.256 6.756 1.00 0.00 H new ATOM 0 HG23 THR A 65 -18.022 -6.510 7.062 1.00 0.00 H new ATOM 845 N ALA A 66 -17.769 -5.878 4.242 1.00 0.00 N ATOM 846 CA ALA A 66 -17.038 -4.652 3.938 1.00 0.00 C ATOM 847 C ALA A 66 -15.786 -4.887 3.082 1.00 0.00 C ATOM 848 O ALA A 66 -14.872 -5.621 3.468 1.00 0.00 O ATOM 849 CB ALA A 66 -16.621 -3.973 5.248 1.00 0.00 C ATOM 0 H ALA A 66 -17.220 -6.728 4.116 1.00 0.00 H new ATOM 0 HA ALA A 66 -17.711 -4.020 3.359 1.00 0.00 H new ATOM 0 HB1 ALA A 66 -16.075 -3.057 5.025 1.00 0.00 H new ATOM 0 HB2 ALA A 66 -17.509 -3.733 5.832 1.00 0.00 H new ATOM 0 HB3 ALA A 66 -15.982 -4.646 5.820 1.00 0.00 H new ATOM 855 N VAL A 67 -15.741 -4.253 1.913 1.00 0.00 N ATOM 856 CA VAL A 67 -14.634 -4.317 0.968 1.00 0.00 C ATOM 857 C VAL A 67 -13.654 -3.195 1.311 1.00 0.00 C ATOM 858 O VAL A 67 -14.080 -2.057 1.487 1.00 0.00 O ATOM 859 CB VAL A 67 -15.141 -4.136 -0.483 1.00 0.00 C ATOM 860 CG1 VAL A 67 -14.040 -4.458 -1.503 1.00 0.00 C ATOM 861 CG2 VAL A 67 -16.360 -5.018 -0.780 1.00 0.00 C ATOM 0 H VAL A 67 -16.504 -3.659 1.588 1.00 0.00 H new ATOM 0 HA VAL A 67 -14.148 -5.290 1.038 1.00 0.00 H new ATOM 0 HB VAL A 67 -15.431 -3.089 -0.575 1.00 0.00 H new ATOM 0 HG11 VAL A 67 -14.428 -4.321 -2.512 1.00 0.00 H new ATOM 0 HG12 VAL A 67 -13.193 -3.791 -1.346 1.00 0.00 H new ATOM 0 HG13 VAL A 67 -13.717 -5.491 -1.375 1.00 0.00 H new ATOM 0 HG21 VAL A 67 -16.682 -4.859 -1.809 1.00 0.00 H new ATOM 0 HG22 VAL A 67 -16.093 -6.066 -0.641 1.00 0.00 H new ATOM 0 HG23 VAL A 67 -17.172 -4.757 -0.101 1.00 0.00 H new ATOM 871 N PHE A 68 -12.353 -3.498 1.341 1.00 0.00 N ATOM 872 CA PHE A 68 -11.298 -2.522 1.631 1.00 0.00 C ATOM 873 C PHE A 68 -10.209 -2.564 0.547 1.00 0.00 C ATOM 874 O PHE A 68 -9.050 -2.253 0.794 1.00 0.00 O ATOM 875 CB PHE A 68 -10.743 -2.731 3.045 1.00 0.00 C ATOM 876 CG PHE A 68 -11.805 -2.606 4.117 1.00 0.00 C ATOM 877 CD1 PHE A 68 -12.593 -1.443 4.208 1.00 0.00 C ATOM 878 CD2 PHE A 68 -12.034 -3.673 4.999 1.00 0.00 C ATOM 879 CE1 PHE A 68 -13.616 -1.362 5.162 1.00 0.00 C ATOM 880 CE2 PHE A 68 -13.065 -3.597 5.949 1.00 0.00 C ATOM 881 CZ PHE A 68 -13.852 -2.437 6.030 1.00 0.00 C ATOM 0 H PHE A 68 -11.999 -4.438 1.163 1.00 0.00 H new ATOM 0 HA PHE A 68 -11.723 -1.518 1.608 1.00 0.00 H new ATOM 0 HB2 PHE A 68 -10.284 -3.718 3.108 1.00 0.00 H new ATOM 0 HB3 PHE A 68 -9.956 -2.001 3.233 1.00 0.00 H new ATOM 0 HD1 PHE A 68 -12.409 -0.613 3.542 1.00 0.00 H new ATOM 0 HD2 PHE A 68 -11.415 -4.556 4.947 1.00 0.00 H new ATOM 0 HE1 PHE A 68 -14.223 -0.471 5.229 1.00 0.00 H new ATOM 0 HE2 PHE A 68 -13.252 -4.427 6.614 1.00 0.00 H new ATOM 0 HZ PHE A 68 -14.642 -2.373 6.764 1.00 0.00 H new ATOM 891 N ASN A 69 -10.571 -3.014 -0.658 1.00 0.00 N ATOM 892 CA ASN A 69 -9.706 -3.154 -1.822 1.00 0.00 C ATOM 893 C ASN A 69 -9.044 -1.831 -2.203 1.00 0.00 C ATOM 894 O ASN A 69 -9.692 -0.973 -2.807 1.00 0.00 O ATOM 895 CB ASN A 69 -10.543 -3.739 -2.976 1.00 0.00 C ATOM 896 CG ASN A 69 -9.846 -4.055 -4.302 1.00 0.00 C ATOM 897 OD1 ASN A 69 -8.985 -3.222 -4.855 1.00 0.00 O flip ATOM 898 ND2 ASN A 69 -10.177 -5.067 -4.922 1.00 0.00 N flip ATOM 0 H ASN A 69 -11.529 -3.305 -0.853 1.00 0.00 H new ATOM 0 HA ASN A 69 -8.886 -3.833 -1.590 1.00 0.00 H new ATOM 0 HB2 ASN A 69 -11.004 -4.659 -2.617 1.00 0.00 H new ATOM 0 HB3 ASN A 69 -11.352 -3.039 -3.186 1.00 0.00 H new ATOM 0 HD21 ASN A 69 -10.841 -5.723 -4.511 1.00 0.00 H new ATOM 0 HD22 ASN A 69 -9.787 -5.249 -5.847 1.00 0.00 H new ATOM 905 N ASP A 70 -7.758 -1.681 -1.900 1.00 0.00 N ATOM 906 CA ASP A 70 -6.949 -0.496 -2.212 1.00 0.00 C ATOM 907 C ASP A 70 -6.686 -0.493 -3.725 1.00 0.00 C ATOM 908 O ASP A 70 -6.822 -1.530 -4.393 1.00 0.00 O ATOM 909 CB ASP A 70 -5.648 -0.553 -1.396 1.00 0.00 C ATOM 910 CG ASP A 70 -4.566 0.464 -1.778 1.00 0.00 C ATOM 911 OD1 ASP A 70 -4.891 1.564 -2.262 1.00 0.00 O ATOM 912 OD2 ASP A 70 -3.383 0.103 -1.581 1.00 0.00 O ATOM 0 H ASP A 70 -7.227 -2.404 -1.413 1.00 0.00 H new ATOM 0 HA ASP A 70 -7.462 0.429 -1.947 1.00 0.00 H new ATOM 0 HB2 ASP A 70 -5.896 -0.411 -0.344 1.00 0.00 H new ATOM 0 HB3 ASP A 70 -5.227 -1.554 -1.491 1.00 0.00 H new ATOM 917 N LEU A 71 -6.436 0.680 -4.298 1.00 0.00 N ATOM 918 CA LEU A 71 -6.161 0.889 -5.705 1.00 0.00 C ATOM 919 C LEU A 71 -4.885 1.712 -5.827 1.00 0.00 C ATOM 920 O LEU A 71 -4.878 2.892 -5.479 1.00 0.00 O ATOM 921 CB LEU A 71 -7.346 1.579 -6.384 1.00 0.00 C ATOM 922 CG LEU A 71 -8.434 0.579 -6.823 1.00 0.00 C ATOM 923 CD1 LEU A 71 -9.737 0.798 -6.066 1.00 0.00 C ATOM 924 CD2 LEU A 71 -8.698 0.642 -8.333 1.00 0.00 C ATOM 0 H LEU A 71 -6.420 1.549 -3.764 1.00 0.00 H new ATOM 0 HA LEU A 71 -6.018 -0.067 -6.210 1.00 0.00 H new ATOM 0 HB2 LEU A 71 -7.780 2.307 -5.699 1.00 0.00 H new ATOM 0 HB3 LEU A 71 -6.992 2.132 -7.254 1.00 0.00 H new ATOM 0 HG LEU A 71 -8.051 -0.413 -6.582 1.00 0.00 H new ATOM 0 HD11 LEU A 71 -10.479 0.075 -6.403 1.00 0.00 H new ATOM 0 HD12 LEU A 71 -9.563 0.669 -4.998 1.00 0.00 H new ATOM 0 HD13 LEU A 71 -10.102 1.807 -6.255 1.00 0.00 H new ATOM 0 HD21 LEU A 71 -9.471 -0.079 -8.598 1.00 0.00 H new ATOM 0 HD22 LEU A 71 -9.029 1.645 -8.603 1.00 0.00 H new ATOM 0 HD23 LEU A 71 -7.781 0.405 -8.873 1.00 0.00 H new ATOM 936 N ILE A 72 -3.817 1.085 -6.322 1.00 0.00 N ATOM 937 CA ILE A 72 -2.518 1.708 -6.498 1.00 0.00 C ATOM 938 C ILE A 72 -2.432 2.087 -7.971 1.00 0.00 C ATOM 939 O ILE A 72 -2.888 1.324 -8.838 1.00 0.00 O ATOM 940 CB ILE A 72 -1.404 0.684 -6.151 1.00 0.00 C ATOM 941 CG1 ILE A 72 -1.504 0.160 -4.698 1.00 0.00 C ATOM 942 CG2 ILE A 72 0.010 1.249 -6.387 1.00 0.00 C ATOM 943 CD1 ILE A 72 -2.266 -1.162 -4.576 1.00 0.00 C ATOM 0 H ILE A 72 -3.839 0.109 -6.616 1.00 0.00 H new ATOM 0 HA ILE A 72 -2.393 2.578 -5.854 1.00 0.00 H new ATOM 0 HB ILE A 72 -1.568 -0.150 -6.833 1.00 0.00 H new ATOM 0 HG12 ILE A 72 -0.499 0.029 -4.298 1.00 0.00 H new ATOM 0 HG13 ILE A 72 -1.997 0.912 -4.082 1.00 0.00 H new ATOM 0 HG21 ILE A 72 0.752 0.493 -6.129 1.00 0.00 H new ATOM 0 HG22 ILE A 72 0.122 1.524 -7.436 1.00 0.00 H new ATOM 0 HG23 ILE A 72 0.158 2.130 -5.763 1.00 0.00 H new ATOM 0 HD11 ILE A 72 -2.297 -1.469 -3.531 1.00 0.00 H new ATOM 0 HD12 ILE A 72 -3.283 -1.031 -4.946 1.00 0.00 H new ATOM 0 HD13 ILE A 72 -1.762 -1.928 -5.165 1.00 0.00 H new ATOM 955 N LEU A 73 -1.972 3.300 -8.250 1.00 0.00 N ATOM 956 CA LEU A 73 -1.749 3.830 -9.585 1.00 0.00 C ATOM 957 C LEU A 73 -0.226 3.906 -9.766 1.00 0.00 C ATOM 958 O LEU A 73 0.515 3.854 -8.786 1.00 0.00 O ATOM 959 CB LEU A 73 -2.402 5.214 -9.745 1.00 0.00 C ATOM 960 CG LEU A 73 -3.928 5.255 -9.965 1.00 0.00 C ATOM 961 CD1 LEU A 73 -4.391 4.421 -11.167 1.00 0.00 C ATOM 962 CD2 LEU A 73 -4.740 4.834 -8.735 1.00 0.00 C ATOM 0 H LEU A 73 -1.734 3.969 -7.518 1.00 0.00 H new ATOM 0 HA LEU A 73 -2.201 3.192 -10.345 1.00 0.00 H new ATOM 0 HB2 LEU A 73 -2.174 5.800 -8.854 1.00 0.00 H new ATOM 0 HB3 LEU A 73 -1.926 5.716 -10.587 1.00 0.00 H new ATOM 0 HG LEU A 73 -4.125 6.308 -10.167 1.00 0.00 H new ATOM 0 HD11 LEU A 73 -5.474 4.494 -11.265 1.00 0.00 H new ATOM 0 HD12 LEU A 73 -3.919 4.797 -12.074 1.00 0.00 H new ATOM 0 HD13 LEU A 73 -4.109 3.379 -11.017 1.00 0.00 H new ATOM 0 HD21 LEU A 73 -5.804 4.888 -8.966 1.00 0.00 H new ATOM 0 HD22 LEU A 73 -4.480 3.812 -8.460 1.00 0.00 H new ATOM 0 HD23 LEU A 73 -4.514 5.502 -7.904 1.00 0.00 H new ATOM 974 N ASP A 74 0.229 4.022 -11.012 1.00 0.00 N ATOM 975 CA ASP A 74 1.622 4.151 -11.469 1.00 0.00 C ATOM 976 C ASP A 74 2.683 3.451 -10.606 1.00 0.00 C ATOM 977 O ASP A 74 3.585 4.095 -10.073 1.00 0.00 O ATOM 978 CB ASP A 74 1.961 5.635 -11.663 1.00 0.00 C ATOM 979 CG ASP A 74 1.366 6.215 -12.933 1.00 0.00 C ATOM 980 OD1 ASP A 74 1.911 5.938 -14.022 1.00 0.00 O ATOM 981 OD2 ASP A 74 0.367 6.963 -12.846 1.00 0.00 O ATOM 0 H ASP A 74 -0.419 4.029 -11.800 1.00 0.00 H new ATOM 0 HA ASP A 74 1.666 3.613 -12.416 1.00 0.00 H new ATOM 0 HB2 ASP A 74 1.597 6.201 -10.806 1.00 0.00 H new ATOM 0 HB3 ASP A 74 3.044 5.755 -11.687 1.00 0.00 H new ATOM 986 N PHE A 75 2.585 2.127 -10.456 1.00 0.00 N ATOM 987 CA PHE A 75 3.564 1.358 -9.679 1.00 0.00 C ATOM 988 C PHE A 75 4.918 1.511 -10.380 1.00 0.00 C ATOM 989 O PHE A 75 4.952 1.595 -11.616 1.00 0.00 O ATOM 990 CB PHE A 75 3.116 -0.112 -9.654 1.00 0.00 C ATOM 991 CG PHE A 75 3.825 -1.055 -8.700 1.00 0.00 C ATOM 992 CD1 PHE A 75 3.701 -0.862 -7.315 1.00 0.00 C ATOM 993 CD2 PHE A 75 4.507 -2.190 -9.178 1.00 0.00 C ATOM 994 CE1 PHE A 75 4.233 -1.807 -6.420 1.00 0.00 C ATOM 995 CE2 PHE A 75 5.042 -3.136 -8.286 1.00 0.00 C ATOM 996 CZ PHE A 75 4.900 -2.947 -6.902 1.00 0.00 C ATOM 0 H PHE A 75 1.838 1.564 -10.862 1.00 0.00 H new ATOM 0 HA PHE A 75 3.643 1.710 -8.651 1.00 0.00 H new ATOM 0 HB2 PHE A 75 2.052 -0.133 -9.416 1.00 0.00 H new ATOM 0 HB3 PHE A 75 3.225 -0.512 -10.662 1.00 0.00 H new ATOM 0 HD1 PHE A 75 3.196 0.014 -6.936 1.00 0.00 H new ATOM 0 HD2 PHE A 75 4.621 -2.336 -10.242 1.00 0.00 H new ATOM 0 HE1 PHE A 75 4.129 -1.656 -5.356 1.00 0.00 H new ATOM 0 HE2 PHE A 75 5.560 -4.005 -8.664 1.00 0.00 H new ATOM 0 HZ PHE A 75 5.301 -3.674 -6.211 1.00 0.00 H new ATOM 1006 N GLU A 76 6.034 1.542 -9.663 1.00 0.00 N ATOM 1007 CA GLU A 76 7.362 1.677 -10.228 1.00 0.00 C ATOM 1008 C GLU A 76 8.279 0.695 -9.505 1.00 0.00 C ATOM 1009 O GLU A 76 9.156 1.119 -8.757 1.00 0.00 O ATOM 1010 CB GLU A 76 7.836 3.146 -10.168 1.00 0.00 C ATOM 1011 CG GLU A 76 9.057 3.298 -11.092 1.00 0.00 C ATOM 1012 CD GLU A 76 9.597 4.709 -11.339 1.00 0.00 C ATOM 1013 OE1 GLU A 76 8.954 5.723 -10.981 1.00 0.00 O ATOM 1014 OE2 GLU A 76 10.654 4.787 -12.020 1.00 0.00 O ATOM 0 H GLU A 76 6.036 1.472 -8.645 1.00 0.00 H new ATOM 0 HA GLU A 76 7.372 1.425 -11.288 1.00 0.00 H new ATOM 0 HB2 GLU A 76 7.036 3.816 -10.483 1.00 0.00 H new ATOM 0 HB3 GLU A 76 8.097 3.419 -9.146 1.00 0.00 H new ATOM 0 HG2 GLU A 76 9.867 2.698 -10.677 1.00 0.00 H new ATOM 0 HG3 GLU A 76 8.801 2.864 -12.059 1.00 0.00 H new ATOM 1021 N ALA A 77 8.134 -0.605 -9.805 1.00 0.00 N ATOM 1022 CA ALA A 77 8.890 -1.720 -9.229 1.00 0.00 C ATOM 1023 C ALA A 77 10.415 -1.523 -9.194 1.00 0.00 C ATOM 1024 O ALA A 77 11.124 -2.292 -8.529 1.00 0.00 O ATOM 1025 CB ALA A 77 8.551 -3.001 -9.996 1.00 0.00 C ATOM 0 H ALA A 77 7.449 -0.920 -10.492 1.00 0.00 H new ATOM 0 HA ALA A 77 8.585 -1.783 -8.184 1.00 0.00 H new ATOM 0 HB1 ALA A 77 9.110 -3.836 -9.574 1.00 0.00 H new ATOM 0 HB2 ALA A 77 7.483 -3.201 -9.916 1.00 0.00 H new ATOM 0 HB3 ALA A 77 8.819 -2.879 -11.045 1.00 0.00 H new ATOM 1031 N SER A 78 10.944 -0.575 -9.968 1.00 0.00 N ATOM 1032 CA SER A 78 12.360 -0.253 -9.992 1.00 0.00 C ATOM 1033 C SER A 78 12.771 0.575 -8.751 1.00 0.00 C ATOM 1034 O SER A 78 13.930 0.473 -8.334 1.00 0.00 O ATOM 1035 CB SER A 78 12.681 0.544 -11.263 1.00 0.00 C ATOM 1036 OG SER A 78 12.239 -0.143 -12.424 1.00 0.00 O ATOM 0 H SER A 78 10.387 -0.004 -10.604 1.00 0.00 H new ATOM 0 HA SER A 78 12.921 -1.187 -9.981 1.00 0.00 H new ATOM 0 HB2 SER A 78 12.204 1.523 -11.212 1.00 0.00 H new ATOM 0 HB3 SER A 78 13.755 0.716 -11.326 1.00 0.00 H new ATOM 0 HG SER A 78 12.454 0.387 -13.220 1.00 0.00 H new ATOM 1042 N GLU A 79 11.872 1.366 -8.145 1.00 0.00 N ATOM 1043 CA GLU A 79 12.146 2.226 -6.982 1.00 0.00 C ATOM 1044 C GLU A 79 11.127 2.079 -5.850 1.00 0.00 C ATOM 1045 O GLU A 79 11.519 2.177 -4.686 1.00 0.00 O ATOM 1046 CB GLU A 79 12.255 3.715 -7.388 1.00 0.00 C ATOM 1047 CG GLU A 79 12.836 3.984 -8.782 1.00 0.00 C ATOM 1048 CD GLU A 79 13.570 5.320 -8.945 1.00 0.00 C ATOM 1049 OE1 GLU A 79 13.040 6.402 -8.628 1.00 0.00 O ATOM 1050 OE2 GLU A 79 14.766 5.296 -9.348 1.00 0.00 O ATOM 0 H GLU A 79 10.904 1.427 -8.460 1.00 0.00 H new ATOM 0 HA GLU A 79 13.106 1.880 -6.598 1.00 0.00 H new ATOM 0 HB2 GLU A 79 11.261 4.160 -7.337 1.00 0.00 H new ATOM 0 HB3 GLU A 79 12.873 4.229 -6.652 1.00 0.00 H new ATOM 0 HG2 GLU A 79 13.526 3.178 -9.031 1.00 0.00 H new ATOM 0 HG3 GLU A 79 12.024 3.944 -9.509 1.00 0.00 H new ATOM 1057 N ASP A 80 9.850 1.844 -6.158 1.00 0.00 N ATOM 1058 CA ASP A 80 8.797 1.702 -5.159 1.00 0.00 C ATOM 1059 C ASP A 80 9.021 0.497 -4.254 1.00 0.00 C ATOM 1060 O ASP A 80 9.768 -0.457 -4.546 1.00 0.00 O ATOM 1061 CB ASP A 80 7.379 1.661 -5.763 1.00 0.00 C ATOM 1062 CG ASP A 80 6.844 0.263 -6.121 1.00 0.00 C ATOM 1063 OD1 ASP A 80 6.675 -0.607 -5.231 1.00 0.00 O ATOM 1064 OD2 ASP A 80 6.528 0.088 -7.313 1.00 0.00 O ATOM 0 H ASP A 80 9.518 1.747 -7.118 1.00 0.00 H new ATOM 0 HA ASP A 80 8.861 2.606 -4.553 1.00 0.00 H new ATOM 0 HB2 ASP A 80 6.690 2.123 -5.056 1.00 0.00 H new ATOM 0 HB3 ASP A 80 7.370 2.274 -6.664 1.00 0.00 H new ATOM 1069 N ARG A 81 8.336 0.561 -3.117 1.00 0.00 N ATOM 1070 CA ARG A 81 8.373 -0.482 -2.111 1.00 0.00 C ATOM 1071 C ARG A 81 7.071 -0.584 -1.324 1.00 0.00 C ATOM 1072 O ARG A 81 6.269 0.344 -1.267 1.00 0.00 O ATOM 1073 CB ARG A 81 9.596 -0.314 -1.204 1.00 0.00 C ATOM 1074 CG ARG A 81 9.866 1.060 -0.601 1.00 0.00 C ATOM 1075 CD ARG A 81 10.572 2.054 -1.528 1.00 0.00 C ATOM 1076 NE ARG A 81 12.001 1.789 -1.700 1.00 0.00 N ATOM 1077 CZ ARG A 81 12.965 2.286 -0.927 1.00 0.00 C ATOM 1078 NH1 ARG A 81 12.657 2.867 0.234 1.00 0.00 N ATOM 1079 NH2 ARG A 81 14.223 2.206 -1.337 1.00 0.00 N ATOM 0 H ARG A 81 7.735 1.348 -2.870 1.00 0.00 H new ATOM 0 HA ARG A 81 8.474 -1.436 -2.629 1.00 0.00 H new ATOM 0 HB2 ARG A 81 9.501 -1.024 -0.383 1.00 0.00 H new ATOM 0 HB3 ARG A 81 10.477 -0.605 -1.777 1.00 0.00 H new ATOM 0 HG2 ARG A 81 8.917 1.493 -0.286 1.00 0.00 H new ATOM 0 HG3 ARG A 81 10.471 0.932 0.296 1.00 0.00 H new ATOM 0 HD2 ARG A 81 10.088 2.033 -2.504 1.00 0.00 H new ATOM 0 HD3 ARG A 81 10.444 3.061 -1.131 1.00 0.00 H new ATOM 0 HE ARG A 81 12.279 1.179 -2.468 1.00 0.00 H new ATOM 0 HH11 ARG A 81 11.683 2.931 0.530 1.00 0.00 H new ATOM 0 HH12 ARG A 81 13.396 3.247 0.826 1.00 0.00 H new ATOM 0 HH21 ARG A 81 14.441 1.769 -2.232 1.00 0.00 H new ATOM 0 HH22 ARG A 81 14.973 2.582 -0.757 1.00 0.00 H new ATOM 1093 N ILE A 82 6.889 -1.700 -0.614 1.00 0.00 N ATOM 1094 CA ILE A 82 5.710 -1.962 0.201 1.00 0.00 C ATOM 1095 C ILE A 82 6.175 -2.537 1.536 1.00 0.00 C ATOM 1096 O ILE A 82 7.187 -3.245 1.612 1.00 0.00 O ATOM 1097 CB ILE A 82 4.737 -2.930 -0.528 1.00 0.00 C ATOM 1098 CG1 ILE A 82 4.444 -2.460 -1.975 1.00 0.00 C ATOM 1099 CG2 ILE A 82 3.436 -3.099 0.283 1.00 0.00 C ATOM 1100 CD1 ILE A 82 3.380 -3.270 -2.726 1.00 0.00 C ATOM 0 H ILE A 82 7.572 -2.458 -0.592 1.00 0.00 H new ATOM 0 HA ILE A 82 5.160 -1.037 0.374 1.00 0.00 H new ATOM 0 HB ILE A 82 5.222 -3.904 -0.601 1.00 0.00 H new ATOM 0 HG12 ILE A 82 4.128 -1.417 -1.943 1.00 0.00 H new ATOM 0 HG13 ILE A 82 5.372 -2.494 -2.545 1.00 0.00 H new ATOM 0 HG21 ILE A 82 2.766 -3.780 -0.242 1.00 0.00 H new ATOM 0 HG22 ILE A 82 3.671 -3.507 1.266 1.00 0.00 H new ATOM 0 HG23 ILE A 82 2.951 -2.130 0.399 1.00 0.00 H new ATOM 0 HD11 ILE A 82 3.250 -2.860 -3.728 1.00 0.00 H new ATOM 0 HD12 ILE A 82 3.698 -4.310 -2.798 1.00 0.00 H new ATOM 0 HD13 ILE A 82 2.434 -3.216 -2.187 1.00 0.00 H new ATOM 1112 N ASP A 83 5.450 -2.225 2.603 1.00 0.00 N ATOM 1113 CA ASP A 83 5.687 -2.701 3.957 1.00 0.00 C ATOM 1114 C ASP A 83 4.500 -3.589 4.296 1.00 0.00 C ATOM 1115 O ASP A 83 3.370 -3.105 4.305 1.00 0.00 O ATOM 1116 CB ASP A 83 5.815 -1.558 4.964 1.00 0.00 C ATOM 1117 CG ASP A 83 6.215 -2.062 6.360 1.00 0.00 C ATOM 1118 OD1 ASP A 83 6.099 -3.277 6.649 1.00 0.00 O ATOM 1119 OD2 ASP A 83 6.685 -1.229 7.170 1.00 0.00 O ATOM 0 H ASP A 83 4.643 -1.604 2.543 1.00 0.00 H new ATOM 0 HA ASP A 83 6.632 -3.241 4.011 1.00 0.00 H new ATOM 0 HB2 ASP A 83 6.559 -0.844 4.610 1.00 0.00 H new ATOM 0 HB3 ASP A 83 4.867 -1.024 5.029 1.00 0.00 H new ATOM 1124 N LEU A 84 4.735 -4.883 4.519 1.00 0.00 N ATOM 1125 CA LEU A 84 3.699 -5.860 4.851 1.00 0.00 C ATOM 1126 C LEU A 84 4.151 -6.872 5.909 1.00 0.00 C ATOM 1127 O LEU A 84 3.487 -7.890 6.085 1.00 0.00 O ATOM 1128 CB LEU A 84 3.161 -6.551 3.577 1.00 0.00 C ATOM 1129 CG LEU A 84 4.126 -7.303 2.629 1.00 0.00 C ATOM 1130 CD1 LEU A 84 4.685 -6.386 1.532 1.00 0.00 C ATOM 1131 CD2 LEU A 84 5.291 -8.043 3.301 1.00 0.00 C ATOM 0 H LEU A 84 5.670 -5.288 4.473 1.00 0.00 H new ATOM 0 HA LEU A 84 2.875 -5.308 5.304 1.00 0.00 H new ATOM 0 HB2 LEU A 84 2.399 -7.264 3.894 1.00 0.00 H new ATOM 0 HB3 LEU A 84 2.657 -5.788 2.985 1.00 0.00 H new ATOM 0 HG LEU A 84 3.486 -8.073 2.199 1.00 0.00 H new ATOM 0 HD11 LEU A 84 5.357 -6.955 0.890 1.00 0.00 H new ATOM 0 HD12 LEU A 84 3.863 -5.989 0.936 1.00 0.00 H new ATOM 0 HD13 LEU A 84 5.232 -5.562 1.990 1.00 0.00 H new ATOM 0 HD21 LEU A 84 5.899 -8.532 2.540 1.00 0.00 H new ATOM 0 HD22 LEU A 84 5.904 -7.331 3.853 1.00 0.00 H new ATOM 0 HD23 LEU A 84 4.898 -8.792 3.988 1.00 0.00 H new ATOM 1143 N SER A 85 5.270 -6.629 6.603 1.00 0.00 N ATOM 1144 CA SER A 85 5.812 -7.528 7.626 1.00 0.00 C ATOM 1145 C SER A 85 4.737 -7.988 8.630 1.00 0.00 C ATOM 1146 O SER A 85 4.766 -9.133 9.091 1.00 0.00 O ATOM 1147 CB SER A 85 7.012 -6.838 8.302 1.00 0.00 C ATOM 1148 OG SER A 85 7.703 -7.695 9.181 1.00 0.00 O ATOM 0 H SER A 85 5.832 -5.789 6.466 1.00 0.00 H new ATOM 0 HA SER A 85 6.159 -8.447 7.153 1.00 0.00 H new ATOM 0 HB2 SER A 85 7.699 -6.478 7.536 1.00 0.00 H new ATOM 0 HB3 SER A 85 6.662 -5.964 8.852 1.00 0.00 H new ATOM 0 HG SER A 85 8.544 -7.980 8.766 1.00 0.00 H new ATOM 1154 N ALA A 86 3.771 -7.129 8.969 1.00 0.00 N ATOM 1155 CA ALA A 86 2.711 -7.471 9.903 1.00 0.00 C ATOM 1156 C ALA A 86 1.636 -8.388 9.319 1.00 0.00 C ATOM 1157 O ALA A 86 1.094 -9.211 10.062 1.00 0.00 O ATOM 1158 CB ALA A 86 2.035 -6.193 10.401 1.00 0.00 C ATOM 0 H ALA A 86 3.708 -6.180 8.601 1.00 0.00 H new ATOM 0 HA ALA A 86 3.193 -8.018 10.713 1.00 0.00 H new ATOM 0 HB1 ALA A 86 1.240 -6.451 11.101 1.00 0.00 H new ATOM 0 HB2 ALA A 86 2.771 -5.564 10.902 1.00 0.00 H new ATOM 0 HB3 ALA A 86 1.611 -5.652 9.555 1.00 0.00 H new ATOM 1164 N LEU A 87 1.305 -8.276 8.029 1.00 0.00 N ATOM 1165 CA LEU A 87 0.275 -9.066 7.381 1.00 0.00 C ATOM 1166 C LEU A 87 0.642 -9.388 5.924 1.00 0.00 C ATOM 1167 O LEU A 87 0.324 -8.637 5.009 1.00 0.00 O ATOM 1168 CB LEU A 87 -1.094 -8.360 7.528 1.00 0.00 C ATOM 1169 CG LEU A 87 -1.145 -6.810 7.571 1.00 0.00 C ATOM 1170 CD1 LEU A 87 -0.679 -6.184 6.261 1.00 0.00 C ATOM 1171 CD2 LEU A 87 -2.569 -6.310 7.855 1.00 0.00 C ATOM 0 H LEU A 87 1.761 -7.616 7.399 1.00 0.00 H new ATOM 0 HA LEU A 87 0.197 -10.033 7.878 1.00 0.00 H new ATOM 0 HB2 LEU A 87 -1.722 -8.686 6.699 1.00 0.00 H new ATOM 0 HB3 LEU A 87 -1.557 -8.729 8.443 1.00 0.00 H new ATOM 0 HG LEU A 87 -0.472 -6.509 8.374 1.00 0.00 H new ATOM 0 HD11 LEU A 87 -0.732 -5.098 6.338 1.00 0.00 H new ATOM 0 HD12 LEU A 87 0.349 -6.484 6.060 1.00 0.00 H new ATOM 0 HD13 LEU A 87 -1.321 -6.522 5.448 1.00 0.00 H new ATOM 0 HD21 LEU A 87 -2.574 -5.220 7.879 1.00 0.00 H new ATOM 0 HD22 LEU A 87 -3.240 -6.658 7.070 1.00 0.00 H new ATOM 0 HD23 LEU A 87 -2.905 -6.696 8.817 1.00 0.00 H new ATOM 1183 N GLY A 88 1.272 -10.538 5.685 1.00 0.00 N ATOM 1184 CA GLY A 88 1.665 -10.948 4.349 1.00 0.00 C ATOM 1185 C GLY A 88 3.019 -11.631 4.380 1.00 0.00 C ATOM 1186 O GLY A 88 4.040 -10.989 4.628 1.00 0.00 O ATOM 0 H GLY A 88 1.521 -11.206 6.414 1.00 0.00 H new ATOM 0 HA2 GLY A 88 0.918 -11.626 3.936 1.00 0.00 H new ATOM 0 HA3 GLY A 88 1.704 -10.079 3.692 1.00 0.00 H new ATOM 1190 N PHE A 89 3.037 -12.950 4.179 1.00 0.00 N ATOM 1191 CA PHE A 89 4.308 -13.671 4.161 1.00 0.00 C ATOM 1192 C PHE A 89 5.119 -13.211 2.937 1.00 0.00 C ATOM 1193 O PHE A 89 4.599 -12.543 2.041 1.00 0.00 O ATOM 1194 CB PHE A 89 4.120 -15.193 4.166 1.00 0.00 C ATOM 1195 CG PHE A 89 5.320 -15.967 4.690 1.00 0.00 C ATOM 1196 CD1 PHE A 89 5.815 -15.725 5.986 1.00 0.00 C ATOM 1197 CD2 PHE A 89 5.945 -16.939 3.887 1.00 0.00 C ATOM 1198 CE1 PHE A 89 6.905 -16.459 6.481 1.00 0.00 C ATOM 1199 CE2 PHE A 89 7.061 -17.647 4.365 1.00 0.00 C ATOM 1200 CZ PHE A 89 7.525 -17.426 5.674 1.00 0.00 C ATOM 0 H PHE A 89 2.209 -13.527 4.030 1.00 0.00 H new ATOM 0 HA PHE A 89 4.853 -13.436 5.075 1.00 0.00 H new ATOM 0 HB2 PHE A 89 3.249 -15.438 4.774 1.00 0.00 H new ATOM 0 HB3 PHE A 89 3.903 -15.525 3.151 1.00 0.00 H new ATOM 0 HD1 PHE A 89 5.353 -14.969 6.604 1.00 0.00 H new ATOM 0 HD2 PHE A 89 5.565 -17.142 2.897 1.00 0.00 H new ATOM 0 HE1 PHE A 89 7.266 -16.280 7.483 1.00 0.00 H new ATOM 0 HE2 PHE A 89 7.562 -18.360 3.727 1.00 0.00 H new ATOM 0 HZ PHE A 89 8.356 -17.999 6.058 1.00 0.00 H new ATOM 1210 N SER A 90 6.380 -13.621 2.860 1.00 0.00 N ATOM 1211 CA SER A 90 7.294 -13.262 1.770 1.00 0.00 C ATOM 1212 C SER A 90 7.685 -14.466 0.912 1.00 0.00 C ATOM 1213 O SER A 90 8.284 -14.300 -0.153 1.00 0.00 O ATOM 1214 CB SER A 90 8.523 -12.543 2.348 1.00 0.00 C ATOM 1215 OG SER A 90 8.567 -11.200 1.918 1.00 0.00 O ATOM 0 H SER A 90 6.808 -14.223 3.563 1.00 0.00 H new ATOM 0 HA SER A 90 6.772 -12.582 1.097 1.00 0.00 H new ATOM 0 HB2 SER A 90 8.493 -12.580 3.437 1.00 0.00 H new ATOM 0 HB3 SER A 90 9.431 -13.059 2.037 1.00 0.00 H new ATOM 0 HG SER A 90 9.356 -10.760 2.299 1.00 0.00 H new ATOM 1221 N GLY A 91 7.376 -15.678 1.364 1.00 0.00 N ATOM 1222 CA GLY A 91 7.659 -16.906 0.653 1.00 0.00 C ATOM 1223 C GLY A 91 6.414 -17.245 -0.145 1.00 0.00 C ATOM 1224 O GLY A 91 5.385 -17.614 0.428 1.00 0.00 O ATOM 0 H GLY A 91 6.910 -15.830 2.259 1.00 0.00 H new ATOM 0 HA2 GLY A 91 8.519 -16.783 -0.005 1.00 0.00 H new ATOM 0 HA3 GLY A 91 7.903 -17.709 1.349 1.00 0.00 H new ATOM 1228 N LEU A 92 6.458 -17.016 -1.455 1.00 0.00 N ATOM 1229 CA LEU A 92 5.321 -17.327 -2.309 1.00 0.00 C ATOM 1230 C LEU A 92 5.163 -18.843 -2.409 1.00 0.00 C ATOM 1231 O LEU A 92 6.130 -19.598 -2.281 1.00 0.00 O ATOM 1232 CB LEU A 92 5.371 -16.614 -3.677 1.00 0.00 C ATOM 1233 CG LEU A 92 6.732 -16.369 -4.355 1.00 0.00 C ATOM 1234 CD1 LEU A 92 7.464 -17.660 -4.723 1.00 0.00 C ATOM 1235 CD2 LEU A 92 6.492 -15.533 -5.618 1.00 0.00 C ATOM 0 H LEU A 92 7.262 -16.620 -1.942 1.00 0.00 H new ATOM 0 HA LEU A 92 4.420 -16.925 -1.846 1.00 0.00 H new ATOM 0 HB2 LEU A 92 4.761 -17.193 -4.370 1.00 0.00 H new ATOM 0 HB3 LEU A 92 4.886 -15.645 -3.558 1.00 0.00 H new ATOM 0 HG LEU A 92 7.372 -15.847 -3.644 1.00 0.00 H new ATOM 0 HD11 LEU A 92 8.415 -17.417 -5.197 1.00 0.00 H new ATOM 0 HD12 LEU A 92 7.647 -18.244 -3.821 1.00 0.00 H new ATOM 0 HD13 LEU A 92 6.853 -18.241 -5.414 1.00 0.00 H new ATOM 0 HD21 LEU A 92 7.443 -15.346 -6.117 1.00 0.00 H new ATOM 0 HD22 LEU A 92 5.829 -16.075 -6.292 1.00 0.00 H new ATOM 0 HD23 LEU A 92 6.033 -14.583 -5.344 1.00 0.00 H new ATOM 1247 N GLY A 93 3.926 -19.282 -2.629 1.00 0.00 N ATOM 1248 CA GLY A 93 3.559 -20.686 -2.747 1.00 0.00 C ATOM 1249 C GLY A 93 2.260 -20.753 -3.525 1.00 0.00 C ATOM 1250 O GLY A 93 2.311 -20.823 -4.756 1.00 0.00 O ATOM 0 H GLY A 93 3.131 -18.651 -2.733 1.00 0.00 H new ATOM 0 HA2 GLY A 93 4.342 -21.245 -3.259 1.00 0.00 H new ATOM 0 HA3 GLY A 93 3.439 -21.135 -1.761 1.00 0.00 H new ATOM 1254 N ASP A 94 1.110 -20.611 -2.856 1.00 0.00 N ATOM 1255 CA ASP A 94 -0.196 -20.650 -3.538 1.00 0.00 C ATOM 1256 C ASP A 94 -1.255 -19.721 -2.931 1.00 0.00 C ATOM 1257 O ASP A 94 -2.362 -19.641 -3.450 1.00 0.00 O ATOM 1258 CB ASP A 94 -0.712 -22.095 -3.621 1.00 0.00 C ATOM 1259 CG ASP A 94 -1.907 -22.220 -4.575 1.00 0.00 C ATOM 1260 OD1 ASP A 94 -1.710 -22.213 -5.816 1.00 0.00 O ATOM 1261 OD2 ASP A 94 -3.052 -22.376 -4.094 1.00 0.00 O ATOM 0 H ASP A 94 1.053 -20.469 -1.848 1.00 0.00 H new ATOM 0 HA ASP A 94 -0.021 -20.265 -4.543 1.00 0.00 H new ATOM 0 HB2 ASP A 94 0.092 -22.749 -3.958 1.00 0.00 H new ATOM 0 HB3 ASP A 94 -1.003 -22.434 -2.627 1.00 0.00 H new ATOM 1266 N GLY A 95 -0.929 -18.948 -1.890 1.00 0.00 N ATOM 1267 CA GLY A 95 -1.914 -18.053 -1.271 1.00 0.00 C ATOM 1268 C GLY A 95 -2.875 -18.830 -0.378 1.00 0.00 C ATOM 1269 O GLY A 95 -4.007 -18.384 -0.175 1.00 0.00 O ATOM 0 H GLY A 95 -0.003 -18.923 -1.462 1.00 0.00 H new ATOM 0 HA2 GLY A 95 -1.400 -17.292 -0.683 1.00 0.00 H new ATOM 0 HA3 GLY A 95 -2.474 -17.531 -2.047 1.00 0.00 H new ATOM 1273 N TYR A 96 -2.434 -19.987 0.132 1.00 0.00 N ATOM 1274 CA TYR A 96 -3.275 -20.842 0.954 1.00 0.00 C ATOM 1275 C TYR A 96 -3.285 -20.456 2.411 1.00 0.00 C ATOM 1276 O TYR A 96 -4.265 -19.941 2.941 1.00 0.00 O ATOM 1277 CB TYR A 96 -3.009 -22.332 0.683 1.00 0.00 C ATOM 1278 CG TYR A 96 -3.846 -23.263 1.544 1.00 0.00 C ATOM 1279 CD1 TYR A 96 -5.252 -23.171 1.512 1.00 0.00 C ATOM 1280 CD2 TYR A 96 -3.225 -24.198 2.397 1.00 0.00 C ATOM 1281 CE1 TYR A 96 -6.033 -24.024 2.309 1.00 0.00 C ATOM 1282 CE2 TYR A 96 -4.001 -25.047 3.208 1.00 0.00 C ATOM 1283 CZ TYR A 96 -5.411 -24.970 3.156 1.00 0.00 C ATOM 1284 OH TYR A 96 -6.192 -25.816 3.881 1.00 0.00 O ATOM 0 H TYR A 96 -1.491 -20.347 -0.016 1.00 0.00 H new ATOM 0 HA TYR A 96 -4.305 -20.669 0.643 1.00 0.00 H new ATOM 0 HB2 TYR A 96 -3.209 -22.544 -0.367 1.00 0.00 H new ATOM 0 HB3 TYR A 96 -1.953 -22.542 0.855 1.00 0.00 H new ATOM 0 HD1 TYR A 96 -5.730 -22.443 0.873 1.00 0.00 H new ATOM 0 HD2 TYR A 96 -2.147 -24.263 2.428 1.00 0.00 H new ATOM 0 HE1 TYR A 96 -7.110 -23.957 2.275 1.00 0.00 H new ATOM 0 HE2 TYR A 96 -3.521 -25.755 3.868 1.00 0.00 H new ATOM 0 HH TYR A 96 -5.623 -26.409 4.415 1.00 0.00 H new ATOM 1294 N GLY A 97 -2.169 -20.748 3.027 1.00 0.00 N ATOM 1295 CA GLY A 97 -1.864 -20.525 4.428 1.00 0.00 C ATOM 1296 C GLY A 97 -0.710 -19.557 4.577 1.00 0.00 C ATOM 1297 O GLY A 97 -0.834 -18.352 4.369 1.00 0.00 O ATOM 0 H GLY A 97 -1.389 -21.180 2.532 1.00 0.00 H new ATOM 0 HA2 GLY A 97 -2.743 -20.132 4.939 1.00 0.00 H new ATOM 0 HA3 GLY A 97 -1.615 -21.472 4.906 1.00 0.00 H new ATOM 1301 N GLY A 98 0.457 -20.093 4.916 1.00 0.00 N ATOM 1302 CA GLY A 98 1.677 -19.326 5.091 1.00 0.00 C ATOM 1303 C GLY A 98 2.269 -18.925 3.742 1.00 0.00 C ATOM 1304 O GLY A 98 3.483 -18.744 3.661 1.00 0.00 O ATOM 0 H GLY A 98 0.580 -21.092 5.079 1.00 0.00 H new ATOM 0 HA2 GLY A 98 1.468 -18.433 5.680 1.00 0.00 H new ATOM 0 HA3 GLY A 98 2.404 -19.915 5.651 1.00 0.00 H new ATOM 1308 N THR A 99 1.467 -18.853 2.675 1.00 0.00 N ATOM 1309 CA THR A 99 1.922 -18.501 1.348 1.00 0.00 C ATOM 1310 C THR A 99 1.017 -17.432 0.750 1.00 0.00 C ATOM 1311 O THR A 99 -0.116 -17.238 1.193 1.00 0.00 O ATOM 1312 CB THR A 99 2.009 -19.779 0.495 1.00 0.00 C ATOM 1313 OG1 THR A 99 0.748 -20.362 0.226 1.00 0.00 O ATOM 1314 CG2 THR A 99 2.891 -20.840 1.155 1.00 0.00 C ATOM 0 H THR A 99 0.466 -19.043 2.722 1.00 0.00 H new ATOM 0 HA THR A 99 2.921 -18.065 1.382 1.00 0.00 H new ATOM 0 HB THR A 99 2.449 -19.453 -0.448 1.00 0.00 H new ATOM 0 HG1 THR A 99 0.869 -21.301 -0.028 1.00 0.00 H new ATOM 0 HG21 THR A 99 2.928 -21.727 0.523 1.00 0.00 H new ATOM 0 HG22 THR A 99 3.899 -20.446 1.286 1.00 0.00 H new ATOM 0 HG23 THR A 99 2.476 -21.104 2.128 1.00 0.00 H new ATOM 1322 N LEU A 100 1.497 -16.762 -0.296 1.00 0.00 N ATOM 1323 CA LEU A 100 0.861 -15.745 -1.061 1.00 0.00 C ATOM 1324 C LEU A 100 0.857 -16.208 -2.524 1.00 0.00 C ATOM 1325 O LEU A 100 1.578 -17.150 -2.892 1.00 0.00 O ATOM 1326 CB LEU A 100 1.691 -14.486 -0.831 1.00 0.00 C ATOM 1327 CG LEU A 100 2.948 -14.284 -1.705 1.00 0.00 C ATOM 1328 CD1 LEU A 100 2.674 -13.316 -2.863 1.00 0.00 C ATOM 1329 CD2 LEU A 100 4.117 -13.758 -0.875 1.00 0.00 C ATOM 0 H LEU A 100 2.436 -16.953 -0.646 1.00 0.00 H new ATOM 0 HA LEU A 100 -0.174 -15.545 -0.784 1.00 0.00 H new ATOM 0 HB2 LEU A 100 1.040 -13.624 -0.976 1.00 0.00 H new ATOM 0 HB3 LEU A 100 2.004 -14.477 0.213 1.00 0.00 H new ATOM 0 HG LEU A 100 3.210 -15.260 -2.114 1.00 0.00 H new ATOM 0 HD11 LEU A 100 3.579 -13.196 -3.459 1.00 0.00 H new ATOM 0 HD12 LEU A 100 1.877 -13.715 -3.490 1.00 0.00 H new ATOM 0 HD13 LEU A 100 2.371 -12.348 -2.464 1.00 0.00 H new ATOM 0 HD21 LEU A 100 4.988 -13.625 -1.517 1.00 0.00 H new ATOM 0 HD22 LEU A 100 3.845 -12.801 -0.429 1.00 0.00 H new ATOM 0 HD23 LEU A 100 4.353 -14.472 -0.086 1.00 0.00 H new ATOM 1341 N LEU A 101 0.057 -15.551 -3.355 1.00 0.00 N ATOM 1342 CA LEU A 101 -0.096 -15.794 -4.780 1.00 0.00 C ATOM 1343 C LEU A 101 -0.209 -14.443 -5.453 1.00 0.00 C ATOM 1344 O LEU A 101 -0.815 -13.528 -4.908 1.00 0.00 O ATOM 1345 CB LEU A 101 -1.330 -16.666 -5.041 1.00 0.00 C ATOM 1346 CG LEU A 101 -1.528 -17.067 -6.519 1.00 0.00 C ATOM 1347 CD1 LEU A 101 -2.159 -18.458 -6.603 1.00 0.00 C ATOM 1348 CD2 LEU A 101 -2.450 -16.103 -7.276 1.00 0.00 C ATOM 0 H LEU A 101 -0.537 -14.788 -3.030 1.00 0.00 H new ATOM 0 HA LEU A 101 0.759 -16.336 -5.184 1.00 0.00 H new ATOM 0 HB2 LEU A 101 -1.254 -17.571 -4.439 1.00 0.00 H new ATOM 0 HB3 LEU A 101 -2.216 -16.131 -4.701 1.00 0.00 H new ATOM 0 HG LEU A 101 -0.539 -17.043 -6.976 1.00 0.00 H new ATOM 0 HD11 LEU A 101 -2.295 -18.733 -7.649 1.00 0.00 H new ATOM 0 HD12 LEU A 101 -1.506 -19.184 -6.119 1.00 0.00 H new ATOM 0 HD13 LEU A 101 -3.127 -18.450 -6.101 1.00 0.00 H new ATOM 0 HD21 LEU A 101 -2.553 -16.434 -8.309 1.00 0.00 H new ATOM 0 HD22 LEU A 101 -3.431 -16.088 -6.800 1.00 0.00 H new ATOM 0 HD23 LEU A 101 -2.023 -15.100 -7.257 1.00 0.00 H new ATOM 1360 N LEU A 102 0.368 -14.306 -6.635 1.00 0.00 N ATOM 1361 CA LEU A 102 0.352 -13.090 -7.425 1.00 0.00 C ATOM 1362 C LEU A 102 -0.106 -13.476 -8.830 1.00 0.00 C ATOM 1363 O LEU A 102 0.227 -14.560 -9.310 1.00 0.00 O ATOM 1364 CB LEU A 102 1.729 -12.401 -7.320 1.00 0.00 C ATOM 1365 CG LEU A 102 2.746 -12.850 -8.386 1.00 0.00 C ATOM 1366 CD1 LEU A 102 2.505 -12.068 -9.684 1.00 0.00 C ATOM 1367 CD2 LEU A 102 4.187 -12.654 -7.904 1.00 0.00 C ATOM 0 H LEU A 102 0.878 -15.066 -7.085 1.00 0.00 H new ATOM 0 HA LEU A 102 -0.351 -12.338 -7.067 1.00 0.00 H new ATOM 0 HB2 LEU A 102 1.590 -11.323 -7.399 1.00 0.00 H new ATOM 0 HB3 LEU A 102 2.146 -12.597 -6.332 1.00 0.00 H new ATOM 0 HG LEU A 102 2.605 -13.915 -8.570 1.00 0.00 H new ATOM 0 HD11 LEU A 102 3.224 -12.385 -10.439 1.00 0.00 H new ATOM 0 HD12 LEU A 102 1.494 -12.261 -10.043 1.00 0.00 H new ATOM 0 HD13 LEU A 102 2.625 -11.001 -9.494 1.00 0.00 H new ATOM 0 HD21 LEU A 102 4.878 -12.981 -8.681 1.00 0.00 H new ATOM 0 HD22 LEU A 102 4.358 -11.600 -7.687 1.00 0.00 H new ATOM 0 HD23 LEU A 102 4.352 -13.242 -7.001 1.00 0.00 H new ATOM 1379 N LYS A 103 -0.886 -12.625 -9.494 1.00 0.00 N ATOM 1380 CA LYS A 103 -1.393 -12.875 -10.837 1.00 0.00 C ATOM 1381 C LYS A 103 -1.546 -11.554 -11.581 1.00 0.00 C ATOM 1382 O LYS A 103 -1.474 -10.474 -10.989 1.00 0.00 O ATOM 1383 CB LYS A 103 -2.729 -13.647 -10.743 1.00 0.00 C ATOM 1384 CG LYS A 103 -2.571 -15.106 -11.190 1.00 0.00 C ATOM 1385 CD LYS A 103 -2.480 -15.216 -12.714 1.00 0.00 C ATOM 1386 CE LYS A 103 -2.210 -16.667 -13.106 1.00 0.00 C ATOM 1387 NZ LYS A 103 -2.409 -16.885 -14.550 1.00 0.00 N ATOM 0 H LYS A 103 -1.186 -11.731 -9.107 1.00 0.00 H new ATOM 0 HA LYS A 103 -0.690 -13.489 -11.400 1.00 0.00 H new ATOM 0 HB2 LYS A 103 -3.095 -13.618 -9.717 1.00 0.00 H new ATOM 0 HB3 LYS A 103 -3.479 -13.155 -11.363 1.00 0.00 H new ATOM 0 HG2 LYS A 103 -1.675 -15.531 -10.739 1.00 0.00 H new ATOM 0 HG3 LYS A 103 -3.417 -15.692 -10.831 1.00 0.00 H new ATOM 0 HD2 LYS A 103 -3.408 -14.872 -13.170 1.00 0.00 H new ATOM 0 HD3 LYS A 103 -1.684 -14.573 -13.089 1.00 0.00 H new ATOM 0 HE2 LYS A 103 -1.189 -16.934 -12.835 1.00 0.00 H new ATOM 0 HE3 LYS A 103 -2.872 -17.326 -12.543 1.00 0.00 H new ATOM 0 HZ1 LYS A 103 -2.217 -17.881 -14.780 1.00 0.00 H new ATOM 0 HZ2 LYS A 103 -3.391 -16.654 -14.804 1.00 0.00 H new ATOM 0 HZ3 LYS A 103 -1.760 -16.274 -15.086 1.00 0.00 H new ATOM 1401 N THR A 104 -1.810 -11.639 -12.877 1.00 0.00 N ATOM 1402 CA THR A 104 -1.982 -10.504 -13.761 1.00 0.00 C ATOM 1403 C THR A 104 -3.267 -10.673 -14.562 1.00 0.00 C ATOM 1404 O THR A 104 -3.711 -11.801 -14.807 1.00 0.00 O ATOM 1405 CB THR A 104 -0.766 -10.421 -14.699 1.00 0.00 C ATOM 1406 OG1 THR A 104 -0.420 -11.702 -15.201 1.00 0.00 O ATOM 1407 CG2 THR A 104 0.454 -9.856 -13.981 1.00 0.00 C ATOM 0 H THR A 104 -1.913 -12.534 -13.355 1.00 0.00 H new ATOM 0 HA THR A 104 -2.054 -9.582 -13.184 1.00 0.00 H new ATOM 0 HB THR A 104 -1.052 -9.761 -15.518 1.00 0.00 H new ATOM 0 HG1 THR A 104 0.355 -11.622 -15.796 1.00 0.00 H new ATOM 0 HG21 THR A 104 1.295 -9.811 -14.673 1.00 0.00 H new ATOM 0 HG22 THR A 104 0.230 -8.853 -13.617 1.00 0.00 H new ATOM 0 HG23 THR A 104 0.711 -10.499 -13.139 1.00 0.00 H new ATOM 1415 N ASN A 105 -3.873 -9.554 -14.957 1.00 0.00 N ATOM 1416 CA ASN A 105 -5.093 -9.542 -15.761 1.00 0.00 C ATOM 1417 C ASN A 105 -4.781 -10.027 -17.185 1.00 0.00 C ATOM 1418 O ASN A 105 -3.627 -10.306 -17.523 1.00 0.00 O ATOM 1419 CB ASN A 105 -5.745 -8.150 -15.767 1.00 0.00 C ATOM 1420 CG ASN A 105 -5.144 -7.200 -16.792 1.00 0.00 C ATOM 1421 OD1 ASN A 105 -3.962 -6.906 -16.745 1.00 0.00 O ATOM 1422 ND2 ASN A 105 -5.913 -6.720 -17.751 1.00 0.00 N ATOM 0 H ASN A 105 -3.527 -8.623 -14.726 1.00 0.00 H new ATOM 0 HA ASN A 105 -5.815 -10.226 -15.314 1.00 0.00 H new ATOM 0 HB2 ASN A 105 -6.811 -8.258 -15.966 1.00 0.00 H new ATOM 0 HB3 ASN A 105 -5.649 -7.709 -14.775 1.00 0.00 H new ATOM 0 HD21 ASN A 105 -5.519 -6.099 -18.458 1.00 0.00 H new ATOM 0 HD22 ASN A 105 -6.901 -6.970 -17.785 1.00 0.00 H new ATOM 1429 N ALA A 106 -5.805 -10.109 -18.040 1.00 0.00 N ATOM 1430 CA ALA A 106 -5.663 -10.556 -19.423 1.00 0.00 C ATOM 1431 C ALA A 106 -4.594 -9.753 -20.171 1.00 0.00 C ATOM 1432 O ALA A 106 -3.715 -10.337 -20.805 1.00 0.00 O ATOM 1433 CB ALA A 106 -7.014 -10.448 -20.139 1.00 0.00 C ATOM 0 H ALA A 106 -6.762 -9.864 -17.787 1.00 0.00 H new ATOM 0 HA ALA A 106 -5.339 -11.597 -19.413 1.00 0.00 H new ATOM 0 HB1 ALA A 106 -6.907 -10.782 -21.171 1.00 0.00 H new ATOM 0 HB2 ALA A 106 -7.747 -11.074 -19.630 1.00 0.00 H new ATOM 0 HB3 ALA A 106 -7.351 -9.411 -20.126 1.00 0.00 H new ATOM 1439 N GLU A 107 -4.653 -8.422 -20.105 1.00 0.00 N ATOM 1440 CA GLU A 107 -3.701 -7.547 -20.780 1.00 0.00 C ATOM 1441 C GLU A 107 -2.325 -7.598 -20.109 1.00 0.00 C ATOM 1442 O GLU A 107 -1.296 -7.567 -20.783 1.00 0.00 O ATOM 1443 CB GLU A 107 -4.272 -6.126 -20.789 1.00 0.00 C ATOM 1444 CG GLU A 107 -3.746 -5.319 -21.980 1.00 0.00 C ATOM 1445 CD GLU A 107 -4.476 -3.984 -22.124 1.00 0.00 C ATOM 1446 OE1 GLU A 107 -5.683 -3.895 -21.789 1.00 0.00 O ATOM 1447 OE2 GLU A 107 -3.826 -2.982 -22.488 1.00 0.00 O ATOM 0 H GLU A 107 -5.368 -7.921 -19.578 1.00 0.00 H new ATOM 0 HA GLU A 107 -3.555 -7.885 -21.806 1.00 0.00 H new ATOM 0 HB2 GLU A 107 -5.360 -6.170 -20.830 1.00 0.00 H new ATOM 0 HB3 GLU A 107 -4.008 -5.620 -19.860 1.00 0.00 H new ATOM 0 HG2 GLU A 107 -2.678 -5.138 -21.854 1.00 0.00 H new ATOM 0 HG3 GLU A 107 -3.866 -5.900 -22.895 1.00 0.00 H new ATOM 1454 N GLY A 108 -2.312 -7.760 -18.787 1.00 0.00 N ATOM 1455 CA GLY A 108 -1.163 -7.845 -17.901 1.00 0.00 C ATOM 1456 C GLY A 108 -0.833 -6.521 -17.214 1.00 0.00 C ATOM 1457 O GLY A 108 -0.006 -6.513 -16.307 1.00 0.00 O ATOM 0 H GLY A 108 -3.186 -7.842 -18.267 1.00 0.00 H new ATOM 0 HA2 GLY A 108 -1.353 -8.603 -17.142 1.00 0.00 H new ATOM 0 HA3 GLY A 108 -0.296 -8.177 -18.472 1.00 0.00 H new ATOM 1461 N THR A 109 -1.460 -5.411 -17.612 1.00 0.00 N ATOM 1462 CA THR A 109 -1.234 -4.071 -17.065 1.00 0.00 C ATOM 1463 C THR A 109 -1.817 -3.933 -15.658 1.00 0.00 C ATOM 1464 O THR A 109 -1.576 -2.955 -14.957 1.00 0.00 O ATOM 1465 CB THR A 109 -1.794 -2.995 -18.014 1.00 0.00 C ATOM 1466 OG1 THR A 109 -2.014 -3.517 -19.317 1.00 0.00 O ATOM 1467 CG2 THR A 109 -0.822 -1.818 -18.136 1.00 0.00 C ATOM 0 H THR A 109 -2.164 -5.421 -18.350 1.00 0.00 H new ATOM 0 HA THR A 109 -0.158 -3.920 -16.982 1.00 0.00 H new ATOM 0 HB THR A 109 -2.740 -2.661 -17.587 1.00 0.00 H new ATOM 0 HG1 THR A 109 -2.371 -2.812 -19.896 1.00 0.00 H new ATOM 0 HG21 THR A 109 -1.239 -1.071 -18.811 1.00 0.00 H new ATOM 0 HG22 THR A 109 -0.665 -1.372 -17.154 1.00 0.00 H new ATOM 0 HG23 THR A 109 0.131 -2.172 -18.530 1.00 0.00 H new ATOM 1475 N ARG A 110 -2.592 -4.918 -15.214 1.00 0.00 N ATOM 1476 CA ARG A 110 -3.171 -4.918 -13.894 1.00 0.00 C ATOM 1477 C ARG A 110 -2.721 -6.148 -13.153 1.00 0.00 C ATOM 1478 O ARG A 110 -2.841 -7.270 -13.647 1.00 0.00 O ATOM 1479 CB ARG A 110 -4.680 -4.786 -13.958 1.00 0.00 C ATOM 1480 CG ARG A 110 -5.065 -3.319 -14.202 1.00 0.00 C ATOM 1481 CD ARG A 110 -6.239 -2.890 -13.327 1.00 0.00 C ATOM 1482 NE ARG A 110 -7.423 -3.719 -13.533 1.00 0.00 N ATOM 1483 CZ ARG A 110 -8.599 -3.563 -12.929 1.00 0.00 C ATOM 1484 NH1 ARG A 110 -8.776 -2.617 -12.006 1.00 0.00 N ATOM 1485 NH2 ARG A 110 -9.581 -4.384 -13.273 1.00 0.00 N ATOM 0 H ARG A 110 -2.831 -5.739 -15.770 1.00 0.00 H new ATOM 0 HA ARG A 110 -2.820 -4.048 -13.339 1.00 0.00 H new ATOM 0 HB2 ARG A 110 -5.075 -5.413 -14.757 1.00 0.00 H new ATOM 0 HB3 ARG A 110 -5.125 -5.138 -13.027 1.00 0.00 H new ATOM 0 HG2 ARG A 110 -4.207 -2.679 -13.998 1.00 0.00 H new ATOM 0 HG3 ARG A 110 -5.324 -3.181 -15.252 1.00 0.00 H new ATOM 0 HD2 ARG A 110 -5.943 -2.939 -12.279 1.00 0.00 H new ATOM 0 HD3 ARG A 110 -6.486 -1.850 -13.541 1.00 0.00 H new ATOM 0 HE ARG A 110 -7.342 -4.487 -14.200 1.00 0.00 H new ATOM 0 HH11 ARG A 110 -8.004 -2.000 -11.754 1.00 0.00 H new ATOM 0 HH12 ARG A 110 -9.683 -2.510 -11.552 1.00 0.00 H new ATOM 0 HH21 ARG A 110 -9.421 -5.104 -13.978 1.00 0.00 H new ATOM 0 HH22 ARG A 110 -10.497 -4.296 -12.833 1.00 0.00 H new ATOM 1499 N THR A 111 -2.156 -5.924 -11.979 1.00 0.00 N ATOM 1500 CA THR A 111 -1.666 -6.958 -11.103 1.00 0.00 C ATOM 1501 C THR A 111 -2.720 -7.170 -10.023 1.00 0.00 C ATOM 1502 O THR A 111 -3.206 -6.211 -9.418 1.00 0.00 O ATOM 1503 CB THR A 111 -0.333 -6.474 -10.528 1.00 0.00 C ATOM 1504 OG1 THR A 111 0.648 -6.452 -11.548 1.00 0.00 O ATOM 1505 CG2 THR A 111 0.174 -7.310 -9.353 1.00 0.00 C ATOM 0 H THR A 111 -2.025 -4.985 -11.603 1.00 0.00 H new ATOM 0 HA THR A 111 -1.495 -7.908 -11.609 1.00 0.00 H new ATOM 0 HB THR A 111 -0.515 -5.472 -10.140 1.00 0.00 H new ATOM 0 HG1 THR A 111 1.437 -5.964 -11.233 1.00 0.00 H new ATOM 0 HG21 THR A 111 1.123 -6.905 -9.001 1.00 0.00 H new ATOM 0 HG22 THR A 111 -0.556 -7.281 -8.544 1.00 0.00 H new ATOM 0 HG23 THR A 111 0.317 -8.341 -9.675 1.00 0.00 H new ATOM 1513 N TYR A 112 -3.110 -8.426 -9.821 1.00 0.00 N ATOM 1514 CA TYR A 112 -4.066 -8.823 -8.800 1.00 0.00 C ATOM 1515 C TYR A 112 -3.338 -9.933 -8.045 1.00 0.00 C ATOM 1516 O TYR A 112 -3.104 -11.016 -8.588 1.00 0.00 O ATOM 1517 CB TYR A 112 -5.372 -9.306 -9.456 1.00 0.00 C ATOM 1518 CG TYR A 112 -6.473 -8.260 -9.485 1.00 0.00 C ATOM 1519 CD1 TYR A 112 -6.342 -7.091 -10.262 1.00 0.00 C ATOM 1520 CD2 TYR A 112 -7.626 -8.447 -8.700 1.00 0.00 C ATOM 1521 CE1 TYR A 112 -7.340 -6.100 -10.230 1.00 0.00 C ATOM 1522 CE2 TYR A 112 -8.627 -7.466 -8.665 1.00 0.00 C ATOM 1523 CZ TYR A 112 -8.485 -6.281 -9.420 1.00 0.00 C ATOM 1524 OH TYR A 112 -9.454 -5.326 -9.373 1.00 0.00 O ATOM 0 H TYR A 112 -2.762 -9.209 -10.375 1.00 0.00 H new ATOM 0 HA TYR A 112 -4.367 -8.015 -8.133 1.00 0.00 H new ATOM 0 HB2 TYR A 112 -5.158 -9.622 -10.477 1.00 0.00 H new ATOM 0 HB3 TYR A 112 -5.733 -10.184 -8.920 1.00 0.00 H new ATOM 0 HD1 TYR A 112 -5.471 -6.955 -10.885 1.00 0.00 H new ATOM 0 HD2 TYR A 112 -7.740 -9.352 -8.121 1.00 0.00 H new ATOM 0 HE1 TYR A 112 -7.232 -5.203 -10.822 1.00 0.00 H new ATOM 0 HE2 TYR A 112 -9.508 -7.617 -8.059 1.00 0.00 H new ATOM 0 HH TYR A 112 -10.169 -5.615 -8.768 1.00 0.00 H new ATOM 1534 N LEU A 113 -3.039 -9.718 -6.766 1.00 0.00 N ATOM 1535 CA LEU A 113 -2.335 -10.669 -5.906 1.00 0.00 C ATOM 1536 C LEU A 113 -3.197 -10.941 -4.671 1.00 0.00 C ATOM 1537 O LEU A 113 -4.169 -10.224 -4.411 1.00 0.00 O ATOM 1538 CB LEU A 113 -0.900 -10.199 -5.596 1.00 0.00 C ATOM 1539 CG LEU A 113 -0.725 -8.922 -4.752 1.00 0.00 C ATOM 1540 CD1 LEU A 113 -0.789 -9.213 -3.246 1.00 0.00 C ATOM 1541 CD2 LEU A 113 0.643 -8.317 -5.079 1.00 0.00 C ATOM 0 H LEU A 113 -3.286 -8.853 -6.285 1.00 0.00 H new ATOM 0 HA LEU A 113 -2.196 -11.620 -6.420 1.00 0.00 H new ATOM 0 HB2 LEU A 113 -0.386 -11.012 -5.083 1.00 0.00 H new ATOM 0 HB3 LEU A 113 -0.386 -10.045 -6.545 1.00 0.00 H new ATOM 0 HG LEU A 113 -1.537 -8.236 -4.994 1.00 0.00 H new ATOM 0 HD11 LEU A 113 -0.661 -8.284 -2.690 1.00 0.00 H new ATOM 0 HD12 LEU A 113 -1.756 -9.652 -3.001 1.00 0.00 H new ATOM 0 HD13 LEU A 113 0.005 -9.910 -2.976 1.00 0.00 H new ATOM 0 HD21 LEU A 113 0.789 -7.410 -4.492 1.00 0.00 H new ATOM 0 HD22 LEU A 113 1.426 -9.036 -4.837 1.00 0.00 H new ATOM 0 HD23 LEU A 113 0.689 -8.074 -6.140 1.00 0.00 H new ATOM 1553 N LYS A 114 -2.881 -12.006 -3.937 1.00 0.00 N ATOM 1554 CA LYS A 114 -3.566 -12.453 -2.734 1.00 0.00 C ATOM 1555 C LYS A 114 -2.538 -12.953 -1.729 1.00 0.00 C ATOM 1556 O LYS A 114 -1.805 -13.895 -2.025 1.00 0.00 O ATOM 1557 CB LYS A 114 -4.510 -13.625 -3.069 1.00 0.00 C ATOM 1558 CG LYS A 114 -5.797 -13.224 -3.808 1.00 0.00 C ATOM 1559 CD LYS A 114 -6.014 -13.990 -5.117 1.00 0.00 C ATOM 1560 CE LYS A 114 -5.027 -13.607 -6.232 1.00 0.00 C ATOM 1561 NZ LYS A 114 -5.709 -13.115 -7.447 1.00 0.00 N ATOM 0 H LYS A 114 -2.097 -12.611 -4.182 1.00 0.00 H new ATOM 0 HA LYS A 114 -4.136 -11.619 -2.324 1.00 0.00 H new ATOM 0 HB2 LYS A 114 -3.967 -14.347 -3.679 1.00 0.00 H new ATOM 0 HB3 LYS A 114 -4.782 -14.130 -2.142 1.00 0.00 H new ATOM 0 HG2 LYS A 114 -6.651 -13.393 -3.152 1.00 0.00 H new ATOM 0 HG3 LYS A 114 -5.766 -12.156 -4.022 1.00 0.00 H new ATOM 0 HD2 LYS A 114 -5.928 -15.059 -4.920 1.00 0.00 H new ATOM 0 HD3 LYS A 114 -7.031 -13.811 -5.467 1.00 0.00 H new ATOM 0 HE2 LYS A 114 -4.348 -12.838 -5.864 1.00 0.00 H new ATOM 0 HE3 LYS A 114 -4.418 -14.474 -6.487 1.00 0.00 H new ATOM 0 HZ1 LYS A 114 -5.000 -12.870 -8.168 1.00 0.00 H new ATOM 0 HZ2 LYS A 114 -6.337 -13.857 -7.817 1.00 0.00 H new ATOM 0 HZ3 LYS A 114 -6.270 -12.271 -7.213 1.00 0.00 H new ATOM 1575 N SER A 115 -2.499 -12.375 -0.536 1.00 0.00 N ATOM 1576 CA SER A 115 -1.598 -12.789 0.524 1.00 0.00 C ATOM 1577 C SER A 115 -2.523 -13.482 1.518 1.00 0.00 C ATOM 1578 O SER A 115 -3.329 -12.810 2.165 1.00 0.00 O ATOM 1579 CB SER A 115 -0.834 -11.584 1.081 1.00 0.00 C ATOM 1580 OG SER A 115 0.489 -11.959 1.388 1.00 0.00 O ATOM 0 H SER A 115 -3.102 -11.594 -0.277 1.00 0.00 H new ATOM 0 HA SER A 115 -0.801 -13.464 0.212 1.00 0.00 H new ATOM 0 HB2 SER A 115 -0.832 -10.774 0.352 1.00 0.00 H new ATOM 0 HB3 SER A 115 -1.332 -11.207 1.975 1.00 0.00 H new ATOM 0 HG SER A 115 0.975 -11.185 1.742 1.00 0.00 H new ATOM 1586 N PHE A 116 -2.439 -14.814 1.593 1.00 0.00 N ATOM 1587 CA PHE A 116 -3.233 -15.691 2.444 1.00 0.00 C ATOM 1588 C PHE A 116 -4.728 -15.355 2.390 1.00 0.00 C ATOM 1589 O PHE A 116 -5.255 -14.675 3.278 1.00 0.00 O ATOM 1590 CB PHE A 116 -2.672 -15.691 3.875 1.00 0.00 C ATOM 1591 CG PHE A 116 -3.291 -16.649 4.901 1.00 0.00 C ATOM 1592 CD1 PHE A 116 -4.414 -17.461 4.632 1.00 0.00 C ATOM 1593 CD2 PHE A 116 -2.675 -16.768 6.160 1.00 0.00 C ATOM 1594 CE1 PHE A 116 -4.905 -18.357 5.596 1.00 0.00 C ATOM 1595 CE2 PHE A 116 -3.134 -17.698 7.108 1.00 0.00 C ATOM 1596 CZ PHE A 116 -4.250 -18.502 6.827 1.00 0.00 C ATOM 0 H PHE A 116 -1.772 -15.336 1.024 1.00 0.00 H new ATOM 0 HA PHE A 116 -3.152 -16.707 2.058 1.00 0.00 H new ATOM 0 HB2 PHE A 116 -1.607 -15.913 3.814 1.00 0.00 H new ATOM 0 HB3 PHE A 116 -2.765 -14.679 4.268 1.00 0.00 H new ATOM 0 HD1 PHE A 116 -4.903 -17.392 3.671 1.00 0.00 H new ATOM 0 HD2 PHE A 116 -1.835 -16.134 6.402 1.00 0.00 H new ATOM 0 HE1 PHE A 116 -5.792 -18.937 5.388 1.00 0.00 H new ATOM 0 HE2 PHE A 116 -2.626 -17.795 8.056 1.00 0.00 H new ATOM 0 HZ PHE A 116 -4.600 -19.224 7.550 1.00 0.00 H new ATOM 1606 N GLU A 117 -5.410 -15.742 1.312 1.00 0.00 N ATOM 1607 CA GLU A 117 -6.848 -15.509 1.230 1.00 0.00 C ATOM 1608 C GLU A 117 -7.504 -16.687 1.972 1.00 0.00 C ATOM 1609 O GLU A 117 -6.890 -17.751 2.086 1.00 0.00 O ATOM 1610 CB GLU A 117 -7.321 -15.360 -0.227 1.00 0.00 C ATOM 1611 CG GLU A 117 -7.413 -16.672 -1.023 1.00 0.00 C ATOM 1612 CD GLU A 117 -8.037 -16.480 -2.408 1.00 0.00 C ATOM 1613 OE1 GLU A 117 -9.209 -16.047 -2.491 1.00 0.00 O ATOM 1614 OE2 GLU A 117 -7.392 -16.836 -3.421 1.00 0.00 O ATOM 0 H GLU A 117 -5.000 -16.207 0.502 1.00 0.00 H new ATOM 0 HA GLU A 117 -7.135 -14.566 1.695 1.00 0.00 H new ATOM 0 HB2 GLU A 117 -8.302 -14.884 -0.227 1.00 0.00 H new ATOM 0 HB3 GLU A 117 -6.640 -14.686 -0.746 1.00 0.00 H new ATOM 0 HG2 GLU A 117 -6.415 -17.096 -1.134 1.00 0.00 H new ATOM 0 HG3 GLU A 117 -8.004 -17.394 -0.459 1.00 0.00 H new ATOM 1621 N ALA A 118 -8.732 -16.535 2.469 1.00 0.00 N ATOM 1622 CA ALA A 118 -9.428 -17.599 3.174 1.00 0.00 C ATOM 1623 C ALA A 118 -10.813 -17.767 2.563 1.00 0.00 C ATOM 1624 O ALA A 118 -10.922 -18.198 1.412 1.00 0.00 O ATOM 1625 CB ALA A 118 -9.370 -17.373 4.693 1.00 0.00 C ATOM 0 H ALA A 118 -9.267 -15.670 2.392 1.00 0.00 H new ATOM 0 HA ALA A 118 -8.935 -18.563 3.046 1.00 0.00 H new ATOM 0 HB1 ALA A 118 -9.897 -18.181 5.201 1.00 0.00 H new ATOM 0 HB2 ALA A 118 -8.330 -17.356 5.019 1.00 0.00 H new ATOM 0 HB3 ALA A 118 -9.842 -16.421 4.938 1.00 0.00 H new ATOM 1631 N ASP A 119 -11.860 -17.452 3.312 1.00 0.00 N ATOM 1632 CA ASP A 119 -13.245 -17.551 2.862 1.00 0.00 C ATOM 1633 C ASP A 119 -13.808 -16.156 2.680 1.00 0.00 C ATOM 1634 O ASP A 119 -13.344 -15.202 3.312 1.00 0.00 O ATOM 1635 CB ASP A 119 -14.122 -18.377 3.812 1.00 0.00 C ATOM 1636 CG ASP A 119 -13.895 -19.866 3.595 1.00 0.00 C ATOM 1637 OD1 ASP A 119 -14.112 -20.337 2.458 1.00 0.00 O ATOM 1638 OD2 ASP A 119 -13.431 -20.540 4.547 1.00 0.00 O ATOM 0 H ASP A 119 -11.771 -17.113 4.270 1.00 0.00 H new ATOM 0 HA ASP A 119 -13.252 -18.082 1.910 1.00 0.00 H new ATOM 0 HB2 ASP A 119 -13.893 -18.116 4.845 1.00 0.00 H new ATOM 0 HB3 ASP A 119 -15.172 -18.136 3.647 1.00 0.00 H new ATOM 1643 N ALA A 120 -14.823 -16.044 1.824 1.00 0.00 N ATOM 1644 CA ALA A 120 -15.511 -14.807 1.481 1.00 0.00 C ATOM 1645 C ALA A 120 -16.173 -14.126 2.683 1.00 0.00 C ATOM 1646 O ALA A 120 -16.491 -12.942 2.590 1.00 0.00 O ATOM 1647 CB ALA A 120 -16.555 -15.097 0.401 1.00 0.00 C ATOM 0 H ALA A 120 -15.203 -16.852 1.330 1.00 0.00 H new ATOM 0 HA ALA A 120 -14.758 -14.110 1.113 1.00 0.00 H new ATOM 0 HB1 ALA A 120 -17.074 -14.175 0.140 1.00 0.00 H new ATOM 0 HB2 ALA A 120 -16.061 -15.499 -0.484 1.00 0.00 H new ATOM 0 HB3 ALA A 120 -17.275 -15.824 0.777 1.00 0.00 H new ATOM 1653 N GLU A 121 -16.302 -14.806 3.822 1.00 0.00 N ATOM 1654 CA GLU A 121 -16.922 -14.266 5.022 1.00 0.00 C ATOM 1655 C GLU A 121 -15.873 -13.987 6.097 1.00 0.00 C ATOM 1656 O GLU A 121 -15.913 -12.927 6.721 1.00 0.00 O ATOM 1657 CB GLU A 121 -17.979 -15.273 5.479 1.00 0.00 C ATOM 1658 CG GLU A 121 -19.000 -14.691 6.460 1.00 0.00 C ATOM 1659 CD GLU A 121 -20.301 -15.485 6.346 1.00 0.00 C ATOM 1660 OE1 GLU A 121 -20.292 -16.701 6.650 1.00 0.00 O ATOM 1661 OE2 GLU A 121 -21.314 -14.914 5.868 1.00 0.00 O ATOM 0 H GLU A 121 -15.971 -15.764 3.934 1.00 0.00 H new ATOM 0 HA GLU A 121 -17.400 -13.307 4.821 1.00 0.00 H new ATOM 0 HB2 GLU A 121 -18.506 -15.656 4.605 1.00 0.00 H new ATOM 0 HB3 GLU A 121 -17.481 -16.122 5.948 1.00 0.00 H new ATOM 0 HG2 GLU A 121 -18.615 -14.741 7.479 1.00 0.00 H new ATOM 0 HG3 GLU A 121 -19.179 -13.639 6.238 1.00 0.00 H new ATOM 1668 N GLY A 122 -14.872 -14.865 6.232 1.00 0.00 N ATOM 1669 CA GLY A 122 -13.802 -14.721 7.206 1.00 0.00 C ATOM 1670 C GLY A 122 -12.901 -13.567 6.794 1.00 0.00 C ATOM 1671 O GLY A 122 -12.821 -12.555 7.492 1.00 0.00 O ATOM 0 H GLY A 122 -14.788 -15.703 5.657 1.00 0.00 H new ATOM 0 HA2 GLY A 122 -14.218 -14.537 8.196 1.00 0.00 H new ATOM 0 HA3 GLY A 122 -13.225 -15.644 7.269 1.00 0.00 H new ATOM 1675 N ARG A 123 -12.167 -13.749 5.691 1.00 0.00 N ATOM 1676 CA ARG A 123 -11.255 -12.756 5.117 1.00 0.00 C ATOM 1677 C ARG A 123 -10.732 -13.240 3.773 1.00 0.00 C ATOM 1678 O ARG A 123 -10.253 -14.369 3.670 1.00 0.00 O ATOM 1679 CB ARG A 123 -10.073 -12.389 6.030 1.00 0.00 C ATOM 1680 CG ARG A 123 -9.257 -13.501 6.704 1.00 0.00 C ATOM 1681 CD ARG A 123 -9.929 -14.045 7.970 1.00 0.00 C ATOM 1682 NE ARG A 123 -8.944 -14.600 8.903 1.00 0.00 N ATOM 1683 CZ ARG A 123 -8.256 -13.918 9.825 1.00 0.00 C ATOM 1684 NH1 ARG A 123 -8.378 -12.602 9.967 1.00 0.00 N ATOM 1685 NH2 ARG A 123 -7.429 -14.577 10.619 1.00 0.00 N ATOM 0 H ARG A 123 -12.193 -14.618 5.158 1.00 0.00 H new ATOM 0 HA ARG A 123 -11.843 -11.847 4.995 1.00 0.00 H new ATOM 0 HB2 ARG A 123 -9.380 -11.789 5.440 1.00 0.00 H new ATOM 0 HB3 ARG A 123 -10.460 -11.745 6.820 1.00 0.00 H new ATOM 0 HG2 ARG A 123 -9.110 -14.317 5.997 1.00 0.00 H new ATOM 0 HG3 ARG A 123 -8.269 -13.117 6.958 1.00 0.00 H new ATOM 0 HD2 ARG A 123 -10.486 -13.246 8.460 1.00 0.00 H new ATOM 0 HD3 ARG A 123 -10.650 -14.816 7.698 1.00 0.00 H new ATOM 0 HE ARG A 123 -8.766 -15.603 8.843 1.00 0.00 H new ATOM 0 HH11 ARG A 123 -9.012 -12.080 9.362 1.00 0.00 H new ATOM 0 HH12 ARG A 123 -7.838 -12.114 10.681 1.00 0.00 H new ATOM 0 HH21 ARG A 123 -7.325 -15.587 10.522 1.00 0.00 H new ATOM 0 HH22 ARG A 123 -6.895 -14.075 11.329 1.00 0.00 H new ATOM 1699 N ARG A 124 -10.779 -12.405 2.736 1.00 0.00 N ATOM 1700 CA ARG A 124 -10.285 -12.758 1.410 1.00 0.00 C ATOM 1701 C ARG A 124 -9.518 -11.538 0.920 1.00 0.00 C ATOM 1702 O ARG A 124 -10.018 -10.421 0.990 1.00 0.00 O ATOM 1703 CB ARG A 124 -11.442 -13.253 0.523 1.00 0.00 C ATOM 1704 CG ARG A 124 -11.040 -14.557 -0.186 1.00 0.00 C ATOM 1705 CD ARG A 124 -12.255 -15.329 -0.692 1.00 0.00 C ATOM 1706 NE ARG A 124 -11.856 -16.422 -1.588 1.00 0.00 N ATOM 1707 CZ ARG A 124 -12.676 -17.304 -2.170 1.00 0.00 C ATOM 1708 NH1 ARG A 124 -13.975 -17.306 -1.875 1.00 0.00 N ATOM 1709 NH2 ARG A 124 -12.193 -18.161 -3.059 1.00 0.00 N ATOM 0 H ARG A 124 -11.163 -11.462 2.794 1.00 0.00 H new ATOM 0 HA ARG A 124 -9.598 -13.604 1.397 1.00 0.00 H new ATOM 0 HB2 ARG A 124 -12.332 -13.419 1.131 1.00 0.00 H new ATOM 0 HB3 ARG A 124 -11.697 -12.492 -0.215 1.00 0.00 H new ATOM 0 HG2 ARG A 124 -10.382 -14.326 -1.024 1.00 0.00 H new ATOM 0 HG3 ARG A 124 -10.473 -15.184 0.502 1.00 0.00 H new ATOM 0 HD2 ARG A 124 -12.810 -15.734 0.154 1.00 0.00 H new ATOM 0 HD3 ARG A 124 -12.926 -14.651 -1.219 1.00 0.00 H new ATOM 0 HE ARG A 124 -10.860 -16.518 -1.785 1.00 0.00 H new ATOM 0 HH11 ARG A 124 -14.347 -16.634 -1.204 1.00 0.00 H new ATOM 0 HH12 ARG A 124 -14.598 -17.980 -2.320 1.00 0.00 H new ATOM 0 HH21 ARG A 124 -11.201 -18.145 -3.296 1.00 0.00 H new ATOM 0 HH22 ARG A 124 -12.813 -18.836 -3.506 1.00 0.00 H new ATOM 1723 N PHE A 125 -8.275 -11.735 0.496 1.00 0.00 N ATOM 1724 CA PHE A 125 -7.399 -10.663 0.047 1.00 0.00 C ATOM 1725 C PHE A 125 -7.721 -10.289 -1.395 1.00 0.00 C ATOM 1726 O PHE A 125 -7.647 -11.145 -2.272 1.00 0.00 O ATOM 1727 CB PHE A 125 -5.957 -11.177 0.177 1.00 0.00 C ATOM 1728 CG PHE A 125 -4.866 -10.124 0.121 1.00 0.00 C ATOM 1729 CD1 PHE A 125 -4.586 -9.420 -1.065 1.00 0.00 C ATOM 1730 CD2 PHE A 125 -4.083 -9.887 1.266 1.00 0.00 C ATOM 1731 CE1 PHE A 125 -3.525 -8.499 -1.099 1.00 0.00 C ATOM 1732 CE2 PHE A 125 -3.024 -8.967 1.232 1.00 0.00 C ATOM 1733 CZ PHE A 125 -2.739 -8.279 0.043 1.00 0.00 C ATOM 0 H PHE A 125 -7.843 -12.658 0.454 1.00 0.00 H new ATOM 0 HA PHE A 125 -7.535 -9.764 0.649 1.00 0.00 H new ATOM 0 HB2 PHE A 125 -5.868 -11.714 1.122 1.00 0.00 H new ATOM 0 HB3 PHE A 125 -5.777 -11.900 -0.619 1.00 0.00 H new ATOM 0 HD1 PHE A 125 -5.186 -9.587 -1.948 1.00 0.00 H new ATOM 0 HD2 PHE A 125 -4.299 -10.419 2.181 1.00 0.00 H new ATOM 0 HE1 PHE A 125 -3.313 -7.957 -2.009 1.00 0.00 H new ATOM 0 HE2 PHE A 125 -2.431 -8.789 2.117 1.00 0.00 H new ATOM 0 HZ PHE A 125 -1.916 -7.581 0.006 1.00 0.00 H new ATOM 1743 N GLU A 126 -8.069 -9.027 -1.647 1.00 0.00 N ATOM 1744 CA GLU A 126 -8.383 -8.535 -2.983 1.00 0.00 C ATOM 1745 C GLU A 126 -7.935 -7.078 -3.089 1.00 0.00 C ATOM 1746 O GLU A 126 -8.422 -6.219 -2.355 1.00 0.00 O ATOM 1747 CB GLU A 126 -9.874 -8.661 -3.279 1.00 0.00 C ATOM 1748 CG GLU A 126 -10.087 -8.714 -4.794 1.00 0.00 C ATOM 1749 CD GLU A 126 -10.085 -10.151 -5.317 1.00 0.00 C ATOM 1750 OE1 GLU A 126 -11.159 -10.799 -5.276 1.00 0.00 O ATOM 1751 OE2 GLU A 126 -9.025 -10.626 -5.786 1.00 0.00 O ATOM 0 H GLU A 126 -8.141 -8.314 -0.921 1.00 0.00 H new ATOM 0 HA GLU A 126 -7.853 -9.138 -3.721 1.00 0.00 H new ATOM 0 HB2 GLU A 126 -10.274 -9.561 -2.812 1.00 0.00 H new ATOM 0 HB3 GLU A 126 -10.414 -7.815 -2.854 1.00 0.00 H new ATOM 0 HG2 GLU A 126 -11.034 -8.237 -5.045 1.00 0.00 H new ATOM 0 HG3 GLU A 126 -9.302 -8.145 -5.292 1.00 0.00 H new ATOM 1758 N VAL A 127 -6.997 -6.795 -3.982 1.00 0.00 N ATOM 1759 CA VAL A 127 -6.450 -5.467 -4.218 1.00 0.00 C ATOM 1760 C VAL A 127 -6.324 -5.271 -5.728 1.00 0.00 C ATOM 1761 O VAL A 127 -6.432 -6.240 -6.484 1.00 0.00 O ATOM 1762 CB VAL A 127 -5.111 -5.370 -3.459 1.00 0.00 C ATOM 1763 CG1 VAL A 127 -3.990 -6.197 -4.107 1.00 0.00 C ATOM 1764 CG2 VAL A 127 -4.645 -3.925 -3.266 1.00 0.00 C ATOM 0 H VAL A 127 -6.582 -7.508 -4.582 1.00 0.00 H new ATOM 0 HA VAL A 127 -7.089 -4.666 -3.847 1.00 0.00 H new ATOM 0 HB VAL A 127 -5.318 -5.797 -2.478 1.00 0.00 H new ATOM 0 HG11 VAL A 127 -3.074 -6.087 -3.526 1.00 0.00 H new ATOM 0 HG12 VAL A 127 -4.280 -7.247 -4.131 1.00 0.00 H new ATOM 0 HG13 VAL A 127 -3.819 -5.844 -5.124 1.00 0.00 H new ATOM 0 HG21 VAL A 127 -3.698 -3.917 -2.726 1.00 0.00 H new ATOM 0 HG22 VAL A 127 -4.512 -3.453 -4.239 1.00 0.00 H new ATOM 0 HG23 VAL A 127 -5.393 -3.375 -2.695 1.00 0.00 H new ATOM 1774 N ALA A 128 -6.114 -4.034 -6.179 1.00 0.00 N ATOM 1775 CA ALA A 128 -5.964 -3.720 -7.595 1.00 0.00 C ATOM 1776 C ALA A 128 -4.753 -2.817 -7.777 1.00 0.00 C ATOM 1777 O ALA A 128 -4.703 -1.724 -7.213 1.00 0.00 O ATOM 1778 CB ALA A 128 -7.228 -3.048 -8.133 1.00 0.00 C ATOM 0 H ALA A 128 -6.043 -3.220 -5.568 1.00 0.00 H new ATOM 0 HA ALA A 128 -5.814 -4.641 -8.158 1.00 0.00 H new ATOM 0 HB1 ALA A 128 -7.097 -2.821 -9.191 1.00 0.00 H new ATOM 0 HB2 ALA A 128 -8.078 -3.719 -8.008 1.00 0.00 H new ATOM 0 HB3 ALA A 128 -7.411 -2.124 -7.584 1.00 0.00 H new ATOM 1784 N LEU A 129 -3.802 -3.228 -8.607 1.00 0.00 N ATOM 1785 CA LEU A 129 -2.586 -2.478 -8.882 1.00 0.00 C ATOM 1786 C LEU A 129 -2.520 -2.252 -10.386 1.00 0.00 C ATOM 1787 O LEU A 129 -2.617 -3.221 -11.144 1.00 0.00 O ATOM 1788 CB LEU A 129 -1.422 -3.276 -8.292 1.00 0.00 C ATOM 1789 CG LEU A 129 -0.063 -2.589 -8.476 1.00 0.00 C ATOM 1790 CD1 LEU A 129 0.807 -2.947 -7.272 1.00 0.00 C ATOM 1791 CD2 LEU A 129 0.664 -3.015 -9.754 1.00 0.00 C ATOM 0 H LEU A 129 -3.857 -4.110 -9.117 1.00 0.00 H new ATOM 0 HA LEU A 129 -2.551 -1.490 -8.423 1.00 0.00 H new ATOM 0 HB2 LEU A 129 -1.601 -3.434 -7.228 1.00 0.00 H new ATOM 0 HB3 LEU A 129 -1.391 -4.260 -8.760 1.00 0.00 H new ATOM 0 HG LEU A 129 -0.240 -1.517 -8.558 1.00 0.00 H new ATOM 0 HD11 LEU A 129 1.783 -2.472 -7.374 1.00 0.00 H new ATOM 0 HD12 LEU A 129 0.326 -2.596 -6.359 1.00 0.00 H new ATOM 0 HD13 LEU A 129 0.933 -4.029 -7.223 1.00 0.00 H new ATOM 0 HD21 LEU A 129 1.618 -2.492 -9.822 1.00 0.00 H new ATOM 0 HD22 LEU A 129 0.841 -4.090 -9.731 1.00 0.00 H new ATOM 0 HD23 LEU A 129 0.052 -2.767 -10.621 1.00 0.00 H new ATOM 1803 N ASP A 130 -2.420 -0.993 -10.817 1.00 0.00 N ATOM 1804 CA ASP A 130 -2.370 -0.600 -12.234 1.00 0.00 C ATOM 1805 C ASP A 130 -0.967 -0.137 -12.682 1.00 0.00 C ATOM 1806 O ASP A 130 -0.537 0.956 -12.293 1.00 0.00 O ATOM 1807 CB ASP A 130 -3.447 0.479 -12.464 1.00 0.00 C ATOM 1808 CG ASP A 130 -3.986 0.507 -13.893 1.00 0.00 C ATOM 1809 OD1 ASP A 130 -3.338 1.086 -14.787 1.00 0.00 O ATOM 1810 OD2 ASP A 130 -5.111 -0.008 -14.104 1.00 0.00 O ATOM 0 H ASP A 130 -2.370 -0.198 -10.180 1.00 0.00 H new ATOM 0 HA ASP A 130 -2.579 -1.470 -12.856 1.00 0.00 H new ATOM 0 HB2 ASP A 130 -4.274 0.308 -11.775 1.00 0.00 H new ATOM 0 HB3 ASP A 130 -3.028 1.456 -12.223 1.00 0.00 H new ATOM 1815 N GLY A 131 -0.234 -0.933 -13.471 1.00 0.00 N ATOM 1816 CA GLY A 131 1.109 -0.594 -13.947 1.00 0.00 C ATOM 1817 C GLY A 131 1.662 -1.576 -14.993 1.00 0.00 C ATOM 1818 O GLY A 131 1.185 -2.702 -15.150 1.00 0.00 O ATOM 0 H GLY A 131 -0.563 -1.841 -13.799 1.00 0.00 H new ATOM 0 HA2 GLY A 131 1.090 0.408 -14.377 1.00 0.00 H new ATOM 0 HA3 GLY A 131 1.789 -0.563 -13.096 1.00 0.00 H new ATOM 1822 N ASP A 132 2.749 -1.190 -15.655 1.00 0.00 N ATOM 1823 CA ASP A 132 3.435 -1.937 -16.716 1.00 0.00 C ATOM 1824 C ASP A 132 4.757 -2.571 -16.259 1.00 0.00 C ATOM 1825 O ASP A 132 5.095 -3.688 -16.649 1.00 0.00 O ATOM 1826 CB ASP A 132 3.678 -0.940 -17.858 1.00 0.00 C ATOM 1827 CG ASP A 132 3.965 -1.583 -19.214 1.00 0.00 C ATOM 1828 OD1 ASP A 132 4.972 -2.305 -19.376 1.00 0.00 O ATOM 1829 OD2 ASP A 132 3.214 -1.289 -20.174 1.00 0.00 O ATOM 0 H ASP A 132 3.204 -0.298 -15.458 1.00 0.00 H new ATOM 0 HA ASP A 132 2.814 -2.777 -17.028 1.00 0.00 H new ATOM 0 HB2 ASP A 132 2.803 -0.297 -17.954 1.00 0.00 H new ATOM 0 HB3 ASP A 132 4.517 -0.298 -17.590 1.00 0.00 H new ATOM 1834 N HIS A 133 5.491 -1.891 -15.373 1.00 0.00 N ATOM 1835 CA HIS A 133 6.787 -2.338 -14.844 1.00 0.00 C ATOM 1836 C HIS A 133 6.680 -3.317 -13.654 1.00 0.00 C ATOM 1837 O HIS A 133 7.695 -3.779 -13.131 1.00 0.00 O ATOM 1838 CB HIS A 133 7.619 -1.080 -14.520 1.00 0.00 C ATOM 1839 CG HIS A 133 8.071 -0.383 -15.775 1.00 0.00 C ATOM 1840 ND1 HIS A 133 9.273 -0.581 -16.405 1.00 0.00 N ATOM 1841 CD2 HIS A 133 7.330 0.477 -16.545 1.00 0.00 C ATOM 1842 CE1 HIS A 133 9.256 0.125 -17.541 1.00 0.00 C ATOM 1843 NE2 HIS A 133 8.087 0.772 -17.683 1.00 0.00 N ATOM 0 H HIS A 133 5.195 -0.992 -14.993 1.00 0.00 H new ATOM 0 HA HIS A 133 7.292 -2.934 -15.605 1.00 0.00 H new ATOM 0 HB2 HIS A 133 7.025 -0.395 -13.915 1.00 0.00 H new ATOM 0 HB3 HIS A 133 8.488 -1.360 -13.924 1.00 0.00 H new ATOM 0 HD2 HIS A 133 6.345 0.856 -16.315 1.00 0.00 H new ATOM 0 HE1 HIS A 133 10.071 0.169 -18.248 1.00 0.00 H new ATOM 0 HE2 HIS A 133 7.807 1.362 -18.466 1.00 0.00 H new ATOM 1851 N THR A 134 5.459 -3.625 -13.228 1.00 0.00 N ATOM 1852 CA THR A 134 5.037 -4.487 -12.145 1.00 0.00 C ATOM 1853 C THR A 134 5.419 -5.940 -12.417 1.00 0.00 C ATOM 1854 O THR A 134 5.952 -6.285 -13.473 1.00 0.00 O ATOM 1855 CB THR A 134 3.519 -4.258 -11.940 1.00 0.00 C ATOM 1856 OG1 THR A 134 3.015 -4.982 -10.834 1.00 0.00 O ATOM 1857 CG2 THR A 134 2.664 -4.574 -13.168 1.00 0.00 C ATOM 0 H THR A 134 4.647 -3.223 -13.697 1.00 0.00 H new ATOM 0 HA THR A 134 5.550 -4.243 -11.215 1.00 0.00 H new ATOM 0 HB THR A 134 3.439 -3.188 -11.750 1.00 0.00 H new ATOM 0 HG1 THR A 134 3.083 -4.433 -10.025 1.00 0.00 H new ATOM 0 HG21 THR A 134 1.615 -4.387 -12.939 1.00 0.00 H new ATOM 0 HG22 THR A 134 2.973 -3.940 -13.999 1.00 0.00 H new ATOM 0 HG23 THR A 134 2.794 -5.621 -13.442 1.00 0.00 H new ATOM 1865 N GLY A 135 5.156 -6.797 -11.437 1.00 0.00 N ATOM 1866 CA GLY A 135 5.447 -8.212 -11.481 1.00 0.00 C ATOM 1867 C GLY A 135 6.760 -8.481 -10.778 1.00 0.00 C ATOM 1868 O GLY A 135 6.865 -9.510 -10.107 1.00 0.00 O ATOM 0 H GLY A 135 4.719 -6.508 -10.562 1.00 0.00 H new ATOM 0 HA2 GLY A 135 4.645 -8.774 -11.003 1.00 0.00 H new ATOM 0 HA3 GLY A 135 5.500 -8.551 -12.516 1.00 0.00 H new ATOM 1872 N ASP A 136 7.734 -7.575 -10.907 1.00 0.00 N ATOM 1873 CA ASP A 136 9.016 -7.791 -10.235 1.00 0.00 C ATOM 1874 C ASP A 136 8.969 -7.286 -8.801 1.00 0.00 C ATOM 1875 O ASP A 136 8.539 -6.164 -8.533 1.00 0.00 O ATOM 1876 CB ASP A 136 10.199 -7.121 -10.939 1.00 0.00 C ATOM 1877 CG ASP A 136 11.485 -7.244 -10.104 1.00 0.00 C ATOM 1878 OD1 ASP A 136 12.072 -8.352 -10.024 1.00 0.00 O ATOM 1879 OD2 ASP A 136 11.916 -6.218 -9.528 1.00 0.00 O ATOM 0 H ASP A 136 7.665 -6.715 -11.451 1.00 0.00 H new ATOM 0 HA ASP A 136 9.174 -8.869 -10.263 1.00 0.00 H new ATOM 0 HB2 ASP A 136 10.351 -7.580 -11.916 1.00 0.00 H new ATOM 0 HB3 ASP A 136 9.974 -6.069 -11.112 1.00 0.00 H new ATOM 1884 N LEU A 137 9.433 -8.114 -7.876 1.00 0.00 N ATOM 1885 CA LEU A 137 9.542 -7.876 -6.458 1.00 0.00 C ATOM 1886 C LEU A 137 10.981 -8.246 -6.093 1.00 0.00 C ATOM 1887 O LEU A 137 11.588 -9.113 -6.728 1.00 0.00 O ATOM 1888 CB LEU A 137 8.492 -8.753 -5.761 1.00 0.00 C ATOM 1889 CG LEU A 137 8.902 -10.169 -5.294 1.00 0.00 C ATOM 1890 CD1 LEU A 137 7.829 -10.699 -4.341 1.00 0.00 C ATOM 1891 CD2 LEU A 137 9.023 -11.161 -6.460 1.00 0.00 C ATOM 0 H LEU A 137 9.768 -9.044 -8.127 1.00 0.00 H new ATOM 0 HA LEU A 137 9.352 -6.847 -6.152 1.00 0.00 H new ATOM 0 HB2 LEU A 137 8.132 -8.208 -4.888 1.00 0.00 H new ATOM 0 HB3 LEU A 137 7.647 -8.860 -6.441 1.00 0.00 H new ATOM 0 HG LEU A 137 9.876 -10.085 -4.813 1.00 0.00 H new ATOM 0 HD11 LEU A 137 8.104 -11.698 -4.003 1.00 0.00 H new ATOM 0 HD12 LEU A 137 7.746 -10.035 -3.481 1.00 0.00 H new ATOM 0 HD13 LEU A 137 6.871 -10.743 -4.860 1.00 0.00 H new ATOM 0 HD21 LEU A 137 9.313 -12.139 -6.077 1.00 0.00 H new ATOM 0 HD22 LEU A 137 8.063 -11.241 -6.971 1.00 0.00 H new ATOM 0 HD23 LEU A 137 9.779 -10.808 -7.161 1.00 0.00 H new ATOM 1903 N SER A 138 11.540 -7.616 -5.072 1.00 0.00 N ATOM 1904 CA SER A 138 12.871 -7.852 -4.596 1.00 0.00 C ATOM 1905 C SER A 138 12.860 -7.593 -3.105 1.00 0.00 C ATOM 1906 O SER A 138 11.867 -7.192 -2.490 1.00 0.00 O ATOM 1907 CB SER A 138 13.855 -6.897 -5.282 1.00 0.00 C ATOM 1908 OG SER A 138 13.426 -5.555 -5.116 1.00 0.00 O ATOM 0 H SER A 138 11.049 -6.899 -4.538 1.00 0.00 H new ATOM 0 HA SER A 138 13.184 -8.873 -4.815 1.00 0.00 H new ATOM 0 HB2 SER A 138 14.852 -7.024 -4.859 1.00 0.00 H new ATOM 0 HB3 SER A 138 13.926 -7.136 -6.343 1.00 0.00 H new ATOM 0 HG SER A 138 14.061 -4.952 -5.556 1.00 0.00 H new ATOM 1914 N ALA A 139 14.034 -7.797 -2.551 1.00 0.00 N ATOM 1915 CA ALA A 139 14.307 -7.596 -1.142 1.00 0.00 C ATOM 1916 C ALA A 139 14.192 -6.108 -0.797 1.00 0.00 C ATOM 1917 O ALA A 139 14.088 -5.782 0.383 1.00 0.00 O ATOM 1918 CB ALA A 139 15.687 -8.133 -0.770 1.00 0.00 C ATOM 0 H ALA A 139 14.847 -8.115 -3.079 1.00 0.00 H new ATOM 0 HA ALA A 139 13.569 -8.150 -0.562 1.00 0.00 H new ATOM 0 HB1 ALA A 139 15.867 -7.970 0.293 1.00 0.00 H new ATOM 0 HB2 ALA A 139 15.732 -9.200 -0.986 1.00 0.00 H new ATOM 0 HB3 ALA A 139 16.449 -7.613 -1.351 1.00 0.00 H new ATOM 1924 N ALA A 140 14.273 -5.206 -1.783 1.00 0.00 N ATOM 1925 CA ALA A 140 14.150 -3.768 -1.618 1.00 0.00 C ATOM 1926 C ALA A 140 12.700 -3.329 -1.855 1.00 0.00 C ATOM 1927 O ALA A 140 12.333 -2.209 -1.518 1.00 0.00 O ATOM 1928 CB ALA A 140 15.078 -3.055 -2.604 1.00 0.00 C ATOM 0 H ALA A 140 14.433 -5.478 -2.753 1.00 0.00 H new ATOM 0 HA ALA A 140 14.434 -3.503 -0.600 1.00 0.00 H new ATOM 0 HB1 ALA A 140 14.983 -1.976 -2.478 1.00 0.00 H new ATOM 0 HB2 ALA A 140 16.109 -3.354 -2.414 1.00 0.00 H new ATOM 0 HB3 ALA A 140 14.803 -3.326 -3.623 1.00 0.00 H new ATOM 1934 N ASN A 141 11.871 -4.194 -2.446 1.00 0.00 N ATOM 1935 CA ASN A 141 10.464 -3.942 -2.744 1.00 0.00 C ATOM 1936 C ASN A 141 9.554 -4.398 -1.596 1.00 0.00 C ATOM 1937 O ASN A 141 8.373 -4.048 -1.567 1.00 0.00 O ATOM 1938 CB ASN A 141 10.120 -4.717 -4.027 1.00 0.00 C ATOM 1939 CG ASN A 141 8.733 -4.434 -4.578 1.00 0.00 C ATOM 1940 OD1 ASN A 141 7.863 -5.298 -4.523 1.00 0.00 O ATOM 1941 ND2 ASN A 141 8.518 -3.266 -5.137 1.00 0.00 N ATOM 0 H ASN A 141 12.175 -5.122 -2.740 1.00 0.00 H new ATOM 0 HA ASN A 141 10.303 -2.872 -2.874 1.00 0.00 H new ATOM 0 HB2 ASN A 141 10.858 -4.475 -4.792 1.00 0.00 H new ATOM 0 HB3 ASN A 141 10.207 -5.785 -3.826 1.00 0.00 H new ATOM 0 HD21 ASN A 141 7.606 -3.055 -5.542 1.00 0.00 H new ATOM 0 HD22 ASN A 141 9.263 -2.570 -5.166 1.00 0.00 H new ATOM 1948 N VAL A 142 10.092 -5.149 -0.628 1.00 0.00 N ATOM 1949 CA VAL A 142 9.356 -5.691 0.512 1.00 0.00 C ATOM 1950 C VAL A 142 10.115 -5.500 1.833 1.00 0.00 C ATOM 1951 O VAL A 142 11.340 -5.649 1.898 1.00 0.00 O ATOM 1952 CB VAL A 142 9.111 -7.201 0.261 1.00 0.00 C ATOM 1953 CG1 VAL A 142 8.277 -7.824 1.386 1.00 0.00 C ATOM 1954 CG2 VAL A 142 8.391 -7.509 -1.063 1.00 0.00 C ATOM 0 H VAL A 142 11.080 -5.402 -0.619 1.00 0.00 H new ATOM 0 HA VAL A 142 8.412 -5.153 0.604 1.00 0.00 H new ATOM 0 HB VAL A 142 10.112 -7.631 0.220 1.00 0.00 H new ATOM 0 HG11 VAL A 142 8.123 -8.883 1.181 1.00 0.00 H new ATOM 0 HG12 VAL A 142 8.803 -7.711 2.334 1.00 0.00 H new ATOM 0 HG13 VAL A 142 7.312 -7.321 1.444 1.00 0.00 H new ATOM 0 HG21 VAL A 142 8.258 -8.586 -1.163 1.00 0.00 H new ATOM 0 HG22 VAL A 142 7.416 -7.021 -1.069 1.00 0.00 H new ATOM 0 HG23 VAL A 142 8.988 -7.138 -1.896 1.00 0.00 H new ATOM 1964 N VAL A 143 9.376 -5.184 2.900 1.00 0.00 N ATOM 1965 CA VAL A 143 9.924 -5.010 4.244 1.00 0.00 C ATOM 1966 C VAL A 143 9.999 -6.391 4.879 1.00 0.00 C ATOM 1967 O VAL A 143 9.040 -7.167 4.837 1.00 0.00 O ATOM 1968 CB VAL A 143 9.074 -4.070 5.121 1.00 0.00 C ATOM 1969 CG1 VAL A 143 9.515 -4.012 6.589 1.00 0.00 C ATOM 1970 CG2 VAL A 143 9.178 -2.654 4.565 1.00 0.00 C ATOM 0 H VAL A 143 8.367 -5.040 2.852 1.00 0.00 H new ATOM 0 HA VAL A 143 10.906 -4.544 4.169 1.00 0.00 H new ATOM 0 HB VAL A 143 8.060 -4.469 5.095 1.00 0.00 H new ATOM 0 HG11 VAL A 143 8.866 -3.329 7.137 1.00 0.00 H new ATOM 0 HG12 VAL A 143 9.448 -5.007 7.029 1.00 0.00 H new ATOM 0 HG13 VAL A 143 10.545 -3.659 6.646 1.00 0.00 H new ATOM 0 HG21 VAL A 143 8.581 -1.978 5.177 1.00 0.00 H new ATOM 0 HG22 VAL A 143 10.219 -2.333 4.580 1.00 0.00 H new ATOM 0 HG23 VAL A 143 8.808 -2.638 3.540 1.00 0.00 H new ATOM 1980 N PHE A 144 11.153 -6.707 5.451 1.00 0.00 N ATOM 1981 CA PHE A 144 11.422 -7.958 6.129 1.00 0.00 C ATOM 1982 C PHE A 144 10.990 -7.839 7.590 1.00 0.00 C ATOM 1983 O PHE A 144 10.452 -8.788 8.156 1.00 0.00 O ATOM 1984 CB PHE A 144 12.918 -8.234 6.017 1.00 0.00 C ATOM 1985 CG PHE A 144 13.283 -9.112 4.835 1.00 0.00 C ATOM 1986 CD1 PHE A 144 12.940 -8.738 3.519 1.00 0.00 C ATOM 1987 CD2 PHE A 144 13.949 -10.328 5.055 1.00 0.00 C ATOM 1988 CE1 PHE A 144 13.297 -9.561 2.437 1.00 0.00 C ATOM 1989 CE2 PHE A 144 14.302 -11.151 3.975 1.00 0.00 C ATOM 1990 CZ PHE A 144 13.987 -10.763 2.662 1.00 0.00 C ATOM 0 H PHE A 144 11.953 -6.074 5.453 1.00 0.00 H new ATOM 0 HA PHE A 144 10.867 -8.782 5.680 1.00 0.00 H new ATOM 0 HB2 PHE A 144 13.449 -7.286 5.933 1.00 0.00 H new ATOM 0 HB3 PHE A 144 13.261 -8.712 6.935 1.00 0.00 H new ATOM 0 HD1 PHE A 144 12.402 -7.818 3.343 1.00 0.00 H new ATOM 0 HD2 PHE A 144 14.191 -10.632 6.063 1.00 0.00 H new ATOM 0 HE1 PHE A 144 13.040 -9.268 1.430 1.00 0.00 H new ATOM 0 HE2 PHE A 144 14.816 -12.084 4.153 1.00 0.00 H new ATOM 0 HZ PHE A 144 14.275 -11.387 1.829 1.00 0.00 H new