USER MOD reduce.3.24.130724 H: found=0, std=0, add=974, rem=0, adj=36 USER MOD reduce.3.24.130724 removed 971 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 104 SER OG : rot 15:sc= 0.978 USER MOD Set 1.2: A 127 SER OG : rot -26:sc= 0.0145 USER MOD Single : A 1 GLY N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 5 SER OG : rot 180:sc= 0 USER MOD Single : A 6 SER OG : rot 180:sc= 0 USER MOD Single : A 9 HIS : no HD1:sc= -0.268 X(o=-0.27,f=-0.42) USER MOD Single : A 11 THR OG1 : rot 180:sc= 0 USER MOD Single : A 18 SER OG : rot 180:sc= 0.0598! USER MOD Single : A 20 LYS NZ :NH3+ 170:sc= 0.261 (180deg=0.211) USER MOD Single : A 29 ASN : amide:sc= -0.238 K(o=-0.24,f=-5!) USER MOD Single : A 30 ASN : amide:sc= -0.0424 K(o=-0.042,f=-0.91) USER MOD Single : A 31 MET CE :methyl -121:sc= -6.65! (180deg=-14.3!) USER MOD Single : A 34 TYR OH : rot -39:sc= 0.0555 USER MOD Single : A 36 GLN : amide:sc= -0.876 K(o=-0.88,f=-5.4!) USER MOD Single : A 38 THR OG1 : rot 180:sc= -1.44! USER MOD Single : A 39 CYS SG : rot 180:sc= -2.38! USER MOD Single : A 41 THR OG1 : rot 65:sc= 0.375 USER MOD Single : A 42 GLN : amide:sc= -1.65! K(o=-1.6!,f=-3.2) USER MOD Single : A 44 GLN : amide:sc= 0 K(o=0,f=-0.83) USER MOD Single : A 45 LYS NZ :NH3+ -161:sc= -0.0377 (180deg=-0.338) USER MOD Single : A 46 SER OG : rot 170:sc= -0.145 USER MOD Single : A 47 ASN : amide:sc= -0.0568 K(o=-0.057,f=-1.2) USER MOD Single : A 52 MET CE :methyl -177:sc= -0.204 (180deg=-0.227) USER MOD Single : A 54 THR OG1 : rot 49:sc= -0.362! USER MOD Single : A 55 THR OG1 : rot -89:sc= 0.754 USER MOD Single : A 59 ASN : amide:sc= -3.22 K(o=-3.2,f=-1.4) USER MOD Single : A 61 THR OG1 : rot 180:sc=-0.00336 USER MOD Single : A 65 THR OG1 : rot 180:sc= 0 USER MOD Single : A 67 SER OG : rot 180:sc= 0 USER MOD Single : A 70 THR OG1 : rot 180:sc= 0.00131 USER MOD Single : A 71 THR OG1 : rot 180:sc= 0.00617 USER MOD Single : A 74 LYS NZ :NH3+ -169:sc= 0 (180deg=-0.0964) USER MOD Single : A 76 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 80 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 84 THR OG1 : rot 180:sc= 0.00801 USER MOD Single : A 93 THR OG1 : rot 180:sc= 0 USER MOD Single : A 108 THR OG1 : rot 180:sc= 0 USER MOD Single : A 110 TYR OH : rot 180:sc= 0 USER MOD Single : A 111 ASN : amide:sc= -0.21! C(o=-0.21!,f=-6.6!) USER MOD Single : A 114 LYS NZ :NH3+ 147:sc= 1.26 (180deg=1.14) USER MOD Single : A 118 TYR OH : rot -75:sc= 0.27 USER MOD Single : A 119 LYS NZ :NH3+ -133:sc= -0.0464 (180deg=-0.985) USER MOD Single : A 129 LYS NZ :NH3+ -158:sc= 0.564 (180deg=0.339) USER MOD Single : A 131 SER OG : rot 180:sc= 0 USER MOD Single : A 134 SER OG : rot 180:sc= 0 USER MOD Single : A 135 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 -18.763 33.813 5.255 1.00 0.00 N ATOM 2 CA GLY A 1 -18.326 33.164 4.030 1.00 0.00 C ATOM 3 C GLY A 1 -17.405 34.081 3.223 1.00 0.00 C ATOM 4 O GLY A 1 -17.723 35.249 3.005 1.00 0.00 O ATOM 0 H1 GLY A 1 -19.386 33.171 5.785 1.00 0.00 H new ATOM 0 H2 GLY A 1 -17.934 34.049 5.837 1.00 0.00 H new ATOM 0 H3 GLY A 1 -19.281 34.684 5.021 1.00 0.00 H new ATOM 0 HA2 GLY A 1 -17.803 32.238 4.271 1.00 0.00 H new ATOM 0 HA3 GLY A 1 -19.193 32.893 3.428 1.00 0.00 H new ATOM 8 N SER A 2 -16.283 33.517 2.801 1.00 0.00 N ATOM 9 CA SER A 2 -15.314 34.270 2.022 1.00 0.00 C ATOM 10 C SER A 2 -14.239 33.329 1.474 1.00 0.00 C ATOM 11 O SER A 2 -14.053 33.233 0.262 1.00 0.00 O ATOM 12 CB SER A 2 -14.673 35.376 2.861 1.00 0.00 C ATOM 13 OG SER A 2 -14.341 36.518 2.075 1.00 0.00 O ATOM 0 H SER A 2 -16.023 32.548 2.984 1.00 0.00 H new ATOM 0 HA SER A 2 -15.836 34.740 1.189 1.00 0.00 H new ATOM 0 HB2 SER A 2 -15.357 35.670 3.657 1.00 0.00 H new ATOM 0 HB3 SER A 2 -13.773 34.992 3.341 1.00 0.00 H new ATOM 0 HG SER A 2 -13.936 37.202 2.647 1.00 0.00 H new ATOM 19 N SER A 3 -13.560 32.659 2.393 1.00 0.00 N ATOM 20 CA SER A 3 -12.509 31.729 2.017 1.00 0.00 C ATOM 21 C SER A 3 -12.996 30.289 2.193 1.00 0.00 C ATOM 22 O SER A 3 -13.473 29.918 3.264 1.00 0.00 O ATOM 23 CB SER A 3 -11.243 31.966 2.843 1.00 0.00 C ATOM 24 OG SER A 3 -10.291 32.763 2.144 1.00 0.00 O ATOM 0 H SER A 3 -13.717 32.742 3.397 1.00 0.00 H new ATOM 0 HA SER A 3 -12.263 31.897 0.968 1.00 0.00 H new ATOM 0 HB2 SER A 3 -11.508 32.456 3.780 1.00 0.00 H new ATOM 0 HB3 SER A 3 -10.794 31.007 3.101 1.00 0.00 H new ATOM 0 HG SER A 3 -9.498 32.893 2.705 1.00 0.00 H new ATOM 30 N GLY A 4 -12.858 29.517 1.125 1.00 0.00 N ATOM 31 CA GLY A 4 -13.278 28.127 1.148 1.00 0.00 C ATOM 32 C GLY A 4 -12.074 27.192 1.283 1.00 0.00 C ATOM 33 O GLY A 4 -10.957 27.645 1.527 1.00 0.00 O ATOM 0 H GLY A 4 -12.461 29.828 0.238 1.00 0.00 H new ATOM 0 HA2 GLY A 4 -13.964 27.964 1.979 1.00 0.00 H new ATOM 0 HA3 GLY A 4 -13.824 27.893 0.234 1.00 0.00 H new ATOM 37 N SER A 5 -12.343 25.905 1.119 1.00 0.00 N ATOM 38 CA SER A 5 -11.295 24.903 1.220 1.00 0.00 C ATOM 39 C SER A 5 -11.328 23.987 -0.005 1.00 0.00 C ATOM 40 O SER A 5 -12.400 23.600 -0.467 1.00 0.00 O ATOM 41 CB SER A 5 -11.441 24.081 2.501 1.00 0.00 C ATOM 42 OG SER A 5 -10.420 23.095 2.622 1.00 0.00 O ATOM 0 H SER A 5 -13.271 25.533 0.917 1.00 0.00 H new ATOM 0 HA SER A 5 -10.334 25.416 1.257 1.00 0.00 H new ATOM 0 HB2 SER A 5 -11.407 24.746 3.364 1.00 0.00 H new ATOM 0 HB3 SER A 5 -12.417 23.595 2.511 1.00 0.00 H new ATOM 0 HG SER A 5 -10.547 22.593 3.454 1.00 0.00 H new ATOM 48 N SER A 6 -10.140 23.668 -0.497 1.00 0.00 N ATOM 49 CA SER A 6 -10.019 22.805 -1.660 1.00 0.00 C ATOM 50 C SER A 6 -8.912 21.773 -1.432 1.00 0.00 C ATOM 51 O SER A 6 -8.076 21.939 -0.545 1.00 0.00 O ATOM 52 CB SER A 6 -9.733 23.619 -2.923 1.00 0.00 C ATOM 53 OG SER A 6 -8.662 24.539 -2.735 1.00 0.00 O ATOM 0 H SER A 6 -9.253 23.992 -0.112 1.00 0.00 H new ATOM 0 HA SER A 6 -10.967 22.287 -1.802 1.00 0.00 H new ATOM 0 HB2 SER A 6 -9.490 22.943 -3.743 1.00 0.00 H new ATOM 0 HB3 SER A 6 -10.631 24.163 -3.214 1.00 0.00 H new ATOM 0 HG SER A 6 -8.510 25.038 -3.565 1.00 0.00 H new ATOM 59 N GLY A 7 -8.943 20.730 -2.249 1.00 0.00 N ATOM 60 CA GLY A 7 -7.953 19.671 -2.148 1.00 0.00 C ATOM 61 C GLY A 7 -6.896 19.802 -3.246 1.00 0.00 C ATOM 62 O GLY A 7 -7.076 20.559 -4.199 1.00 0.00 O ATOM 0 H GLY A 7 -9.638 20.596 -2.984 1.00 0.00 H new ATOM 0 HA2 GLY A 7 -7.473 19.709 -1.170 1.00 0.00 H new ATOM 0 HA3 GLY A 7 -8.444 18.701 -2.225 1.00 0.00 H new ATOM 66 N PRO A 8 -5.787 19.034 -3.071 1.00 0.00 N ATOM 67 CA PRO A 8 -4.701 19.058 -4.036 1.00 0.00 C ATOM 68 C PRO A 8 -5.076 18.288 -5.304 1.00 0.00 C ATOM 69 O PRO A 8 -6.224 17.878 -5.468 1.00 0.00 O ATOM 70 CB PRO A 8 -3.512 18.455 -3.305 1.00 0.00 C ATOM 71 CG PRO A 8 -4.092 17.693 -2.124 1.00 0.00 C ATOM 72 CD PRO A 8 -5.539 18.127 -1.955 1.00 0.00 C ATOM 0 HA PRO A 8 -4.470 20.065 -4.384 1.00 0.00 H new ATOM 0 HB2 PRO A 8 -2.947 17.791 -3.959 1.00 0.00 H new ATOM 0 HB3 PRO A 8 -2.825 19.232 -2.969 1.00 0.00 H new ATOM 0 HG2 PRO A 8 -4.033 16.618 -2.297 1.00 0.00 H new ATOM 0 HG3 PRO A 8 -3.523 17.902 -1.218 1.00 0.00 H new ATOM 0 HD2 PRO A 8 -6.215 17.272 -1.982 1.00 0.00 H new ATOM 0 HD3 PRO A 8 -5.694 18.625 -0.998 1.00 0.00 H new ATOM 80 N HIS A 9 -4.087 18.114 -6.167 1.00 0.00 N ATOM 81 CA HIS A 9 -4.299 17.401 -7.415 1.00 0.00 C ATOM 82 C HIS A 9 -2.979 17.307 -8.184 1.00 0.00 C ATOM 83 O HIS A 9 -2.308 18.315 -8.397 1.00 0.00 O ATOM 84 CB HIS A 9 -5.415 18.055 -8.232 1.00 0.00 C ATOM 85 CG HIS A 9 -5.432 19.563 -8.153 1.00 0.00 C ATOM 86 ND1 HIS A 9 -6.440 20.269 -7.521 1.00 0.00 N ATOM 87 CD2 HIS A 9 -4.553 20.490 -8.631 1.00 0.00 C ATOM 88 CE1 HIS A 9 -6.170 21.563 -7.622 1.00 0.00 C ATOM 89 NE2 HIS A 9 -5.001 21.697 -8.310 1.00 0.00 N ATOM 0 H HIS A 9 -3.136 18.455 -6.027 1.00 0.00 H new ATOM 0 HA HIS A 9 -4.630 16.384 -7.204 1.00 0.00 H new ATOM 0 HB2 HIS A 9 -5.310 17.757 -9.275 1.00 0.00 H new ATOM 0 HB3 HIS A 9 -6.376 17.673 -7.887 1.00 0.00 H new ATOM 0 HD2 HIS A 9 -3.646 20.278 -9.178 1.00 0.00 H new ATOM 0 HE1 HIS A 9 -6.771 22.369 -7.228 1.00 0.00 H new ATOM 0 HE2 HIS A 9 -4.545 22.580 -8.540 1.00 0.00 H new ATOM 97 N GLY A 10 -2.647 16.086 -8.578 1.00 0.00 N ATOM 98 CA GLY A 10 -1.420 15.847 -9.318 1.00 0.00 C ATOM 99 C GLY A 10 -1.113 14.350 -9.403 1.00 0.00 C ATOM 100 O GLY A 10 -2.014 13.540 -9.613 1.00 0.00 O ATOM 0 H GLY A 10 -3.206 15.252 -8.399 1.00 0.00 H new ATOM 0 HA2 GLY A 10 -1.510 16.261 -10.322 1.00 0.00 H new ATOM 0 HA3 GLY A 10 -0.592 16.365 -8.833 1.00 0.00 H new ATOM 104 N THR A 11 0.161 14.029 -9.235 1.00 0.00 N ATOM 105 CA THR A 11 0.598 12.645 -9.290 1.00 0.00 C ATOM 106 C THR A 11 1.009 12.159 -7.899 1.00 0.00 C ATOM 107 O THR A 11 1.405 12.957 -7.051 1.00 0.00 O ATOM 108 CB THR A 11 1.720 12.543 -10.325 1.00 0.00 C ATOM 109 OG1 THR A 11 1.085 12.870 -11.558 1.00 0.00 O ATOM 110 CG2 THR A 11 2.205 11.106 -10.525 1.00 0.00 C ATOM 0 H THR A 11 0.905 14.704 -9.061 1.00 0.00 H new ATOM 0 HA THR A 11 -0.213 11.987 -9.603 1.00 0.00 H new ATOM 0 HB THR A 11 2.557 13.168 -10.015 1.00 0.00 H new ATOM 0 HG1 THR A 11 1.741 12.830 -12.285 1.00 0.00 H new ATOM 0 HG21 THR A 11 3.001 11.091 -11.269 1.00 0.00 H new ATOM 0 HG22 THR A 11 2.584 10.715 -9.581 1.00 0.00 H new ATOM 0 HG23 THR A 11 1.376 10.487 -10.868 1.00 0.00 H new ATOM 118 N LEU A 12 0.901 10.853 -7.707 1.00 0.00 N ATOM 119 CA LEU A 12 1.256 10.251 -6.433 1.00 0.00 C ATOM 120 C LEU A 12 2.251 9.113 -6.671 1.00 0.00 C ATOM 121 O LEU A 12 2.175 8.420 -7.684 1.00 0.00 O ATOM 122 CB LEU A 12 -0.001 9.821 -5.674 1.00 0.00 C ATOM 123 CG LEU A 12 0.231 9.005 -4.400 1.00 0.00 C ATOM 124 CD1 LEU A 12 0.083 9.880 -3.154 1.00 0.00 C ATOM 125 CD2 LEU A 12 -0.690 7.784 -4.356 1.00 0.00 C ATOM 0 H LEU A 12 0.572 10.194 -8.413 1.00 0.00 H new ATOM 0 HA LEU A 12 1.752 10.980 -5.793 1.00 0.00 H new ATOM 0 HB2 LEU A 12 -0.566 10.715 -5.411 1.00 0.00 H new ATOM 0 HB3 LEU A 12 -0.626 9.235 -6.348 1.00 0.00 H new ATOM 0 HG LEU A 12 1.256 8.635 -4.413 1.00 0.00 H new ATOM 0 HD11 LEU A 12 0.253 9.276 -2.263 1.00 0.00 H new ATOM 0 HD12 LEU A 12 0.813 10.689 -3.189 1.00 0.00 H new ATOM 0 HD13 LEU A 12 -0.922 10.300 -3.122 1.00 0.00 H new ATOM 0 HD21 LEU A 12 -0.505 7.221 -3.441 1.00 0.00 H new ATOM 0 HD22 LEU A 12 -1.729 8.111 -4.377 1.00 0.00 H new ATOM 0 HD23 LEU A 12 -0.493 7.148 -5.219 1.00 0.00 H new ATOM 137 N GLU A 13 3.160 8.957 -5.720 1.00 0.00 N ATOM 138 CA GLU A 13 4.169 7.915 -5.814 1.00 0.00 C ATOM 139 C GLU A 13 4.003 6.912 -4.670 1.00 0.00 C ATOM 140 O GLU A 13 3.934 7.300 -3.505 1.00 0.00 O ATOM 141 CB GLU A 13 5.577 8.513 -5.819 1.00 0.00 C ATOM 142 CG GLU A 13 6.503 7.727 -6.749 1.00 0.00 C ATOM 143 CD GLU A 13 7.926 7.673 -6.187 1.00 0.00 C ATOM 144 OE1 GLU A 13 8.490 8.765 -5.965 1.00 0.00 O ATOM 145 OE2 GLU A 13 8.416 6.539 -5.993 1.00 0.00 O ATOM 0 H GLU A 13 3.219 9.534 -4.881 1.00 0.00 H new ATOM 0 HA GLU A 13 4.032 7.387 -6.758 1.00 0.00 H new ATOM 0 HB2 GLU A 13 5.533 9.554 -6.139 1.00 0.00 H new ATOM 0 HB3 GLU A 13 5.982 8.507 -4.807 1.00 0.00 H new ATOM 0 HG2 GLU A 13 6.120 6.715 -6.879 1.00 0.00 H new ATOM 0 HG3 GLU A 13 6.515 8.192 -7.735 1.00 0.00 H new ATOM 152 N VAL A 14 3.945 5.642 -5.043 1.00 0.00 N ATOM 153 CA VAL A 14 3.789 4.580 -4.063 1.00 0.00 C ATOM 154 C VAL A 14 5.001 3.649 -4.129 1.00 0.00 C ATOM 155 O VAL A 14 5.145 2.879 -5.077 1.00 0.00 O ATOM 156 CB VAL A 14 2.462 3.852 -4.287 1.00 0.00 C ATOM 157 CG1 VAL A 14 2.304 2.687 -3.308 1.00 0.00 C ATOM 158 CG2 VAL A 14 1.281 4.819 -4.183 1.00 0.00 C ATOM 0 H VAL A 14 4.003 5.324 -6.010 1.00 0.00 H new ATOM 0 HA VAL A 14 3.751 4.993 -3.055 1.00 0.00 H new ATOM 0 HB VAL A 14 2.471 3.442 -5.297 1.00 0.00 H new ATOM 0 HG11 VAL A 14 1.353 2.187 -3.489 1.00 0.00 H new ATOM 0 HG12 VAL A 14 3.120 1.978 -3.451 1.00 0.00 H new ATOM 0 HG13 VAL A 14 2.327 3.065 -2.286 1.00 0.00 H new ATOM 0 HG21 VAL A 14 0.350 4.276 -4.346 1.00 0.00 H new ATOM 0 HG22 VAL A 14 1.268 5.272 -3.192 1.00 0.00 H new ATOM 0 HG23 VAL A 14 1.382 5.600 -4.937 1.00 0.00 H new ATOM 168 N VAL A 15 5.841 3.750 -3.110 1.00 0.00 N ATOM 169 CA VAL A 15 7.036 2.927 -3.040 1.00 0.00 C ATOM 170 C VAL A 15 6.782 1.745 -2.102 1.00 0.00 C ATOM 171 O VAL A 15 7.011 1.844 -0.897 1.00 0.00 O ATOM 172 CB VAL A 15 8.235 3.778 -2.618 1.00 0.00 C ATOM 173 CG1 VAL A 15 9.529 2.963 -2.662 1.00 0.00 C ATOM 174 CG2 VAL A 15 8.348 5.034 -3.484 1.00 0.00 C ATOM 0 H VAL A 15 5.718 4.390 -2.325 1.00 0.00 H new ATOM 0 HA VAL A 15 7.275 2.518 -4.022 1.00 0.00 H new ATOM 0 HB VAL A 15 8.074 4.095 -1.588 1.00 0.00 H new ATOM 0 HG11 VAL A 15 10.366 3.592 -2.357 1.00 0.00 H new ATOM 0 HG12 VAL A 15 9.447 2.114 -1.983 1.00 0.00 H new ATOM 0 HG13 VAL A 15 9.697 2.602 -3.677 1.00 0.00 H new ATOM 0 HG21 VAL A 15 9.208 5.621 -3.163 1.00 0.00 H new ATOM 0 HG22 VAL A 15 8.474 4.746 -4.528 1.00 0.00 H new ATOM 0 HG23 VAL A 15 7.442 5.631 -3.379 1.00 0.00 H new ATOM 184 N LEU A 16 6.312 0.655 -2.689 1.00 0.00 N ATOM 185 CA LEU A 16 6.024 -0.545 -1.921 1.00 0.00 C ATOM 186 C LEU A 16 7.340 -1.203 -1.500 1.00 0.00 C ATOM 187 O LEU A 16 7.831 -2.105 -2.176 1.00 0.00 O ATOM 188 CB LEU A 16 5.095 -1.473 -2.705 1.00 0.00 C ATOM 189 CG LEU A 16 4.989 -2.909 -2.187 1.00 0.00 C ATOM 190 CD1 LEU A 16 4.443 -2.939 -0.759 1.00 0.00 C ATOM 191 CD2 LEU A 16 4.158 -3.775 -3.137 1.00 0.00 C ATOM 0 H LEU A 16 6.123 0.577 -3.688 1.00 0.00 H new ATOM 0 HA LEU A 16 5.486 -0.293 -1.007 1.00 0.00 H new ATOM 0 HB2 LEU A 16 4.097 -1.035 -2.711 1.00 0.00 H new ATOM 0 HB3 LEU A 16 5.435 -1.505 -3.740 1.00 0.00 H new ATOM 0 HG LEU A 16 5.992 -3.335 -2.156 1.00 0.00 H new ATOM 0 HD11 LEU A 16 4.378 -3.972 -0.416 1.00 0.00 H new ATOM 0 HD12 LEU A 16 5.110 -2.380 -0.103 1.00 0.00 H new ATOM 0 HD13 LEU A 16 3.451 -2.487 -0.739 1.00 0.00 H new ATOM 0 HD21 LEU A 16 4.098 -4.790 -2.745 1.00 0.00 H new ATOM 0 HD22 LEU A 16 3.154 -3.360 -3.223 1.00 0.00 H new ATOM 0 HD23 LEU A 16 4.629 -3.792 -4.120 1.00 0.00 H new ATOM 203 N VAL A 17 7.873 -0.726 -0.384 1.00 0.00 N ATOM 204 CA VAL A 17 9.122 -1.257 0.135 1.00 0.00 C ATOM 205 C VAL A 17 8.936 -2.735 0.486 1.00 0.00 C ATOM 206 O VAL A 17 9.167 -3.609 -0.348 1.00 0.00 O ATOM 207 CB VAL A 17 9.595 -0.416 1.322 1.00 0.00 C ATOM 208 CG1 VAL A 17 10.790 -1.071 2.016 1.00 0.00 C ATOM 209 CG2 VAL A 17 9.930 1.011 0.883 1.00 0.00 C ATOM 0 H VAL A 17 7.463 0.022 0.175 1.00 0.00 H new ATOM 0 HA VAL A 17 9.905 -1.198 -0.621 1.00 0.00 H new ATOM 0 HB VAL A 17 8.778 -0.362 2.042 1.00 0.00 H new ATOM 0 HG11 VAL A 17 11.107 -0.453 2.856 1.00 0.00 H new ATOM 0 HG12 VAL A 17 10.504 -2.058 2.379 1.00 0.00 H new ATOM 0 HG13 VAL A 17 11.613 -1.170 1.308 1.00 0.00 H new ATOM 0 HG21 VAL A 17 10.264 1.588 1.745 1.00 0.00 H new ATOM 0 HG22 VAL A 17 10.723 0.985 0.135 1.00 0.00 H new ATOM 0 HG23 VAL A 17 9.043 1.478 0.455 1.00 0.00 H new ATOM 219 N SER A 18 8.519 -2.968 1.722 1.00 0.00 N ATOM 220 CA SER A 18 8.300 -4.325 2.194 1.00 0.00 C ATOM 221 C SER A 18 7.285 -4.322 3.339 1.00 0.00 C ATOM 222 O SER A 18 6.641 -3.307 3.601 1.00 0.00 O ATOM 223 CB SER A 18 9.611 -4.969 2.648 1.00 0.00 C ATOM 224 OG SER A 18 9.402 -6.256 3.223 1.00 0.00 O ATOM 0 H SER A 18 8.327 -2.240 2.411 1.00 0.00 H new ATOM 0 HA SER A 18 7.905 -4.916 1.367 1.00 0.00 H new ATOM 0 HB2 SER A 18 10.285 -5.058 1.796 1.00 0.00 H new ATOM 0 HB3 SER A 18 10.100 -4.322 3.376 1.00 0.00 H new ATOM 0 HG SER A 18 10.263 -6.635 3.499 1.00 0.00 H new ATOM 230 N ALA A 19 7.173 -5.471 3.991 1.00 0.00 N ATOM 231 CA ALA A 19 6.248 -5.614 5.102 1.00 0.00 C ATOM 232 C ALA A 19 6.726 -6.743 6.016 1.00 0.00 C ATOM 233 O ALA A 19 7.188 -7.779 5.540 1.00 0.00 O ATOM 234 CB ALA A 19 4.837 -5.858 4.563 1.00 0.00 C ATOM 0 H ALA A 19 7.708 -6.311 3.771 1.00 0.00 H new ATOM 0 HA ALA A 19 6.217 -4.700 5.696 1.00 0.00 H new ATOM 0 HB1 ALA A 19 4.143 -5.965 5.396 1.00 0.00 H new ATOM 0 HB2 ALA A 19 4.533 -5.014 3.944 1.00 0.00 H new ATOM 0 HB3 ALA A 19 4.829 -6.769 3.964 1.00 0.00 H new ATOM 240 N LYS A 20 6.599 -6.505 7.313 1.00 0.00 N ATOM 241 CA LYS A 20 7.013 -7.490 8.299 1.00 0.00 C ATOM 242 C LYS A 20 5.826 -7.829 9.203 1.00 0.00 C ATOM 243 O LYS A 20 5.013 -6.962 9.519 1.00 0.00 O ATOM 244 CB LYS A 20 8.246 -7.000 9.061 1.00 0.00 C ATOM 245 CG LYS A 20 9.453 -6.875 8.128 1.00 0.00 C ATOM 246 CD LYS A 20 10.208 -5.569 8.380 1.00 0.00 C ATOM 247 CE LYS A 20 10.593 -4.895 7.062 1.00 0.00 C ATOM 248 NZ LYS A 20 11.240 -3.589 7.317 1.00 0.00 N ATOM 0 H LYS A 20 6.215 -5.645 7.704 1.00 0.00 H new ATOM 0 HA LYS A 20 7.317 -8.415 7.809 1.00 0.00 H new ATOM 0 HB2 LYS A 20 8.035 -6.034 9.519 1.00 0.00 H new ATOM 0 HB3 LYS A 20 8.477 -7.693 9.870 1.00 0.00 H new ATOM 0 HG2 LYS A 20 10.123 -7.721 8.279 1.00 0.00 H new ATOM 0 HG3 LYS A 20 9.121 -6.913 7.091 1.00 0.00 H new ATOM 0 HD2 LYS A 20 9.588 -4.894 8.970 1.00 0.00 H new ATOM 0 HD3 LYS A 20 11.105 -5.771 8.965 1.00 0.00 H new ATOM 0 HE2 LYS A 20 11.270 -5.540 6.501 1.00 0.00 H new ATOM 0 HE3 LYS A 20 9.705 -4.753 6.446 1.00 0.00 H new ATOM 0 HZ1 LYS A 20 11.645 -3.224 6.432 1.00 0.00 H new ATOM 0 HZ2 LYS A 20 10.534 -2.916 7.678 1.00 0.00 H new ATOM 0 HZ3 LYS A 20 11.996 -3.708 8.021 1.00 0.00 H new ATOM 262 N GLY A 21 5.765 -9.093 9.595 1.00 0.00 N ATOM 263 CA GLY A 21 4.691 -9.558 10.457 1.00 0.00 C ATOM 264 C GLY A 21 5.065 -9.401 11.932 1.00 0.00 C ATOM 265 O GLY A 21 5.815 -8.495 12.293 1.00 0.00 O ATOM 0 H GLY A 21 6.442 -9.810 9.332 1.00 0.00 H new ATOM 0 HA2 GLY A 21 3.782 -8.995 10.247 1.00 0.00 H new ATOM 0 HA3 GLY A 21 4.475 -10.605 10.242 1.00 0.00 H new ATOM 269 N LEU A 22 4.526 -10.297 12.745 1.00 0.00 N ATOM 270 CA LEU A 22 4.793 -10.270 14.173 1.00 0.00 C ATOM 271 C LEU A 22 5.600 -11.511 14.560 1.00 0.00 C ATOM 272 O LEU A 22 5.923 -12.336 13.708 1.00 0.00 O ATOM 273 CB LEU A 22 3.490 -10.113 14.959 1.00 0.00 C ATOM 274 CG LEU A 22 2.684 -8.844 14.675 1.00 0.00 C ATOM 275 CD1 LEU A 22 1.215 -9.030 15.061 1.00 0.00 C ATOM 276 CD2 LEU A 22 3.309 -7.631 15.367 1.00 0.00 C ATOM 0 H LEU A 22 3.905 -11.047 12.442 1.00 0.00 H new ATOM 0 HA LEU A 22 5.400 -9.402 14.431 1.00 0.00 H new ATOM 0 HB2 LEU A 22 2.857 -10.976 14.751 1.00 0.00 H new ATOM 0 HB3 LEU A 22 3.725 -10.140 16.023 1.00 0.00 H new ATOM 0 HG LEU A 22 2.714 -8.653 13.602 1.00 0.00 H new ATOM 0 HD11 LEU A 22 0.664 -8.114 14.849 1.00 0.00 H new ATOM 0 HD12 LEU A 22 0.789 -9.851 14.485 1.00 0.00 H new ATOM 0 HD13 LEU A 22 1.144 -9.258 16.125 1.00 0.00 H new ATOM 0 HD21 LEU A 22 2.717 -6.742 15.149 1.00 0.00 H new ATOM 0 HD22 LEU A 22 3.330 -7.797 16.444 1.00 0.00 H new ATOM 0 HD23 LEU A 22 4.326 -7.488 15.002 1.00 0.00 H new ATOM 288 N GLU A 23 5.902 -11.603 15.847 1.00 0.00 N ATOM 289 CA GLU A 23 6.665 -12.729 16.358 1.00 0.00 C ATOM 290 C GLU A 23 5.722 -13.839 16.829 1.00 0.00 C ATOM 291 O GLU A 23 6.159 -14.957 17.096 1.00 0.00 O ATOM 292 CB GLU A 23 7.602 -12.291 17.485 1.00 0.00 C ATOM 293 CG GLU A 23 6.811 -11.737 18.672 1.00 0.00 C ATOM 294 CD GLU A 23 6.891 -12.682 19.873 1.00 0.00 C ATOM 295 OE1 GLU A 23 6.355 -13.805 19.748 1.00 0.00 O ATOM 296 OE2 GLU A 23 7.486 -12.261 20.888 1.00 0.00 O ATOM 0 H GLU A 23 5.632 -10.916 16.551 1.00 0.00 H new ATOM 0 HA GLU A 23 7.282 -13.121 15.550 1.00 0.00 H new ATOM 0 HB2 GLU A 23 8.207 -13.138 17.810 1.00 0.00 H new ATOM 0 HB3 GLU A 23 8.290 -11.531 17.116 1.00 0.00 H new ATOM 0 HG2 GLU A 23 7.202 -10.758 18.949 1.00 0.00 H new ATOM 0 HG3 GLU A 23 5.769 -11.595 18.385 1.00 0.00 H new ATOM 303 N ASP A 24 4.447 -13.490 16.917 1.00 0.00 N ATOM 304 CA ASP A 24 3.439 -14.443 17.351 1.00 0.00 C ATOM 305 C ASP A 24 2.268 -14.424 16.367 1.00 0.00 C ATOM 306 O ASP A 24 1.109 -14.459 16.775 1.00 0.00 O ATOM 307 CB ASP A 24 2.899 -14.080 18.736 1.00 0.00 C ATOM 308 CG ASP A 24 2.888 -15.228 19.747 1.00 0.00 C ATOM 309 OD1 ASP A 24 3.576 -16.234 19.471 1.00 0.00 O ATOM 310 OD2 ASP A 24 2.192 -15.073 20.774 1.00 0.00 O ATOM 0 H ASP A 24 4.089 -12.561 16.695 1.00 0.00 H new ATOM 0 HA ASP A 24 3.902 -15.429 17.391 1.00 0.00 H new ATOM 0 HB2 ASP A 24 3.499 -13.265 19.141 1.00 0.00 H new ATOM 0 HB3 ASP A 24 1.882 -13.703 18.626 1.00 0.00 H new ATOM 315 N ALA A 25 2.612 -14.369 15.088 1.00 0.00 N ATOM 316 CA ALA A 25 1.604 -14.345 14.043 1.00 0.00 C ATOM 317 C ALA A 25 2.247 -14.740 12.711 1.00 0.00 C ATOM 318 O ALA A 25 3.118 -14.035 12.205 1.00 0.00 O ATOM 319 CB ALA A 25 0.956 -12.960 13.989 1.00 0.00 C ATOM 0 H ALA A 25 3.575 -14.340 14.753 1.00 0.00 H new ATOM 0 HA ALA A 25 0.815 -15.066 14.255 1.00 0.00 H new ATOM 0 HB1 ALA A 25 0.200 -12.943 13.204 1.00 0.00 H new ATOM 0 HB2 ALA A 25 0.489 -12.739 14.949 1.00 0.00 H new ATOM 0 HB3 ALA A 25 1.718 -12.210 13.775 1.00 0.00 H new ATOM 325 N ASP A 26 1.792 -15.867 12.183 1.00 0.00 N ATOM 326 CA ASP A 26 2.312 -16.365 10.921 1.00 0.00 C ATOM 327 C ASP A 26 1.695 -15.567 9.770 1.00 0.00 C ATOM 328 O ASP A 26 0.535 -15.775 9.417 1.00 0.00 O ATOM 329 CB ASP A 26 1.953 -17.838 10.720 1.00 0.00 C ATOM 330 CG ASP A 26 1.860 -18.288 9.260 1.00 0.00 C ATOM 331 OD1 ASP A 26 2.495 -17.617 8.418 1.00 0.00 O ATOM 332 OD2 ASP A 26 1.156 -19.293 9.020 1.00 0.00 O ATOM 0 H ASP A 26 1.069 -16.449 12.606 1.00 0.00 H new ATOM 0 HA ASP A 26 3.397 -16.257 10.937 1.00 0.00 H new ATOM 0 HB2 ASP A 26 2.699 -18.451 11.226 1.00 0.00 H new ATOM 0 HB3 ASP A 26 0.997 -18.033 11.206 1.00 0.00 H new ATOM 337 N PHE A 27 2.497 -14.670 9.217 1.00 0.00 N ATOM 338 CA PHE A 27 2.045 -13.840 8.113 1.00 0.00 C ATOM 339 C PHE A 27 3.158 -13.643 7.082 1.00 0.00 C ATOM 340 O PHE A 27 4.218 -13.107 7.402 1.00 0.00 O ATOM 341 CB PHE A 27 1.666 -12.480 8.703 1.00 0.00 C ATOM 342 CG PHE A 27 1.223 -11.451 7.660 1.00 0.00 C ATOM 343 CD1 PHE A 27 0.313 -11.795 6.709 1.00 0.00 C ATOM 344 CD2 PHE A 27 1.739 -10.193 7.684 1.00 0.00 C ATOM 345 CE1 PHE A 27 -0.098 -10.841 5.742 1.00 0.00 C ATOM 346 CE2 PHE A 27 1.328 -9.239 6.716 1.00 0.00 C ATOM 347 CZ PHE A 27 0.418 -9.583 5.766 1.00 0.00 C ATOM 0 H PHE A 27 3.458 -14.499 9.513 1.00 0.00 H new ATOM 0 HA PHE A 27 1.203 -14.316 7.611 1.00 0.00 H new ATOM 0 HB2 PHE A 27 0.861 -12.620 9.425 1.00 0.00 H new ATOM 0 HB3 PHE A 27 2.520 -12.082 9.251 1.00 0.00 H new ATOM 0 HD1 PHE A 27 -0.097 -12.794 6.690 1.00 0.00 H new ATOM 0 HD2 PHE A 27 2.461 -9.920 8.439 1.00 0.00 H new ATOM 0 HE1 PHE A 27 -0.820 -11.114 4.987 1.00 0.00 H new ATOM 0 HE2 PHE A 27 1.738 -8.240 6.734 1.00 0.00 H new ATOM 0 HZ PHE A 27 0.105 -8.857 5.030 1.00 0.00 H new ATOM 357 N LEU A 28 2.879 -14.088 5.866 1.00 0.00 N ATOM 358 CA LEU A 28 3.844 -13.968 4.786 1.00 0.00 C ATOM 359 C LEU A 28 4.997 -14.945 5.026 1.00 0.00 C ATOM 360 O LEU A 28 6.147 -14.643 4.713 1.00 0.00 O ATOM 361 CB LEU A 28 4.293 -12.514 4.628 1.00 0.00 C ATOM 362 CG LEU A 28 3.187 -11.498 4.339 1.00 0.00 C ATOM 363 CD1 LEU A 28 3.702 -10.066 4.498 1.00 0.00 C ATOM 364 CD2 LEU A 28 2.572 -11.736 2.958 1.00 0.00 C ATOM 0 H LEU A 28 1.999 -14.532 5.604 1.00 0.00 H new ATOM 0 HA LEU A 28 3.387 -14.242 3.835 1.00 0.00 H new ATOM 0 HB2 LEU A 28 4.807 -12.212 5.541 1.00 0.00 H new ATOM 0 HB3 LEU A 28 5.023 -12.466 3.820 1.00 0.00 H new ATOM 0 HG LEU A 28 2.394 -11.638 5.074 1.00 0.00 H new ATOM 0 HD11 LEU A 28 2.896 -9.364 4.287 1.00 0.00 H new ATOM 0 HD12 LEU A 28 4.055 -9.917 5.519 1.00 0.00 H new ATOM 0 HD13 LEU A 28 4.523 -9.895 3.802 1.00 0.00 H new ATOM 0 HD21 LEU A 28 1.788 -11.000 2.777 1.00 0.00 H new ATOM 0 HD22 LEU A 28 3.344 -11.639 2.194 1.00 0.00 H new ATOM 0 HD23 LEU A 28 2.145 -12.738 2.918 1.00 0.00 H new ATOM 376 N ASN A 29 4.648 -16.097 5.581 1.00 0.00 N ATOM 377 CA ASN A 29 5.639 -17.121 5.866 1.00 0.00 C ATOM 378 C ASN A 29 6.337 -17.526 4.567 1.00 0.00 C ATOM 379 O ASN A 29 6.444 -16.724 3.640 1.00 0.00 O ATOM 380 CB ASN A 29 4.985 -18.369 6.461 1.00 0.00 C ATOM 381 CG ASN A 29 5.924 -19.061 7.451 1.00 0.00 C ATOM 382 OD1 ASN A 29 7.107 -19.235 7.207 1.00 0.00 O ATOM 383 ND2 ASN A 29 5.334 -19.446 8.579 1.00 0.00 N ATOM 0 H ASN A 29 3.693 -16.344 5.841 1.00 0.00 H new ATOM 0 HA ASN A 29 6.351 -16.711 6.582 1.00 0.00 H new ATOM 0 HB2 ASN A 29 4.059 -18.093 6.965 1.00 0.00 H new ATOM 0 HB3 ASN A 29 4.719 -19.061 5.662 1.00 0.00 H new ATOM 0 HD21 ASN A 29 5.876 -19.918 9.303 1.00 0.00 H new ATOM 0 HD22 ASN A 29 4.339 -19.270 8.720 1.00 0.00 H new ATOM 390 N ASN A 30 6.794 -18.769 4.540 1.00 0.00 N ATOM 391 CA ASN A 30 7.478 -19.290 3.370 1.00 0.00 C ATOM 392 C ASN A 30 6.481 -19.423 2.218 1.00 0.00 C ATOM 393 O ASN A 30 6.145 -20.533 1.807 1.00 0.00 O ATOM 394 CB ASN A 30 8.067 -20.675 3.647 1.00 0.00 C ATOM 395 CG ASN A 30 9.507 -20.567 4.154 1.00 0.00 C ATOM 396 OD1 ASN A 30 9.961 -19.523 4.592 1.00 0.00 O ATOM 397 ND2 ASN A 30 10.196 -21.701 4.070 1.00 0.00 N ATOM 0 H ASN A 30 6.704 -19.431 5.311 1.00 0.00 H new ATOM 0 HA ASN A 30 8.282 -18.600 3.115 1.00 0.00 H new ATOM 0 HB2 ASN A 30 7.455 -21.193 4.386 1.00 0.00 H new ATOM 0 HB3 ASN A 30 8.042 -21.273 2.736 1.00 0.00 H new ATOM 0 HD21 ASN A 30 11.166 -21.733 4.383 1.00 0.00 H new ATOM 0 HD22 ASN A 30 9.754 -22.539 3.693 1.00 0.00 H new ATOM 404 N MET A 31 6.035 -18.275 1.728 1.00 0.00 N ATOM 405 CA MET A 31 5.082 -18.249 0.631 1.00 0.00 C ATOM 406 C MET A 31 5.450 -17.170 -0.389 1.00 0.00 C ATOM 407 O MET A 31 6.501 -16.540 -0.280 1.00 0.00 O ATOM 408 CB MET A 31 3.680 -17.978 1.179 1.00 0.00 C ATOM 409 CG MET A 31 3.598 -16.588 1.814 1.00 0.00 C ATOM 410 SD MET A 31 2.500 -16.622 3.220 1.00 0.00 S ATOM 411 CE MET A 31 1.322 -15.376 2.724 1.00 0.00 C ATOM 0 H MET A 31 6.316 -17.356 2.071 1.00 0.00 H new ATOM 0 HA MET A 31 5.105 -19.217 0.131 1.00 0.00 H new ATOM 0 HB2 MET A 31 2.949 -18.057 0.374 1.00 0.00 H new ATOM 0 HB3 MET A 31 3.422 -18.736 1.919 1.00 0.00 H new ATOM 0 HG2 MET A 31 4.591 -16.262 2.125 1.00 0.00 H new ATOM 0 HG3 MET A 31 3.241 -15.865 1.081 1.00 0.00 H new ATOM 0 HE1 MET A 31 1.300 -14.579 3.468 1.00 0.00 H new ATOM 0 HE2 MET A 31 1.614 -14.963 1.758 1.00 0.00 H new ATOM 0 HE3 MET A 31 0.331 -15.824 2.643 1.00 0.00 H new ATOM 421 N ASP A 32 4.563 -16.989 -1.357 1.00 0.00 N ATOM 422 CA ASP A 32 4.781 -15.997 -2.395 1.00 0.00 C ATOM 423 C ASP A 32 3.629 -14.990 -2.383 1.00 0.00 C ATOM 424 O ASP A 32 2.789 -14.992 -3.282 1.00 0.00 O ATOM 425 CB ASP A 32 4.825 -16.648 -3.779 1.00 0.00 C ATOM 426 CG ASP A 32 6.058 -17.513 -4.048 1.00 0.00 C ATOM 427 OD1 ASP A 32 6.754 -17.832 -3.059 1.00 0.00 O ATOM 428 OD2 ASP A 32 6.278 -17.836 -5.235 1.00 0.00 O ATOM 0 H ASP A 32 3.692 -17.513 -1.444 1.00 0.00 H new ATOM 0 HA ASP A 32 5.734 -15.506 -2.197 1.00 0.00 H new ATOM 0 HB2 ASP A 32 3.934 -17.264 -3.903 1.00 0.00 H new ATOM 0 HB3 ASP A 32 4.778 -15.864 -4.534 1.00 0.00 H new ATOM 433 N PRO A 33 3.625 -14.133 -1.327 1.00 0.00 N ATOM 434 CA PRO A 33 2.590 -13.124 -1.186 1.00 0.00 C ATOM 435 C PRO A 33 2.811 -11.970 -2.167 1.00 0.00 C ATOM 436 O PRO A 33 3.835 -11.916 -2.846 1.00 0.00 O ATOM 437 CB PRO A 33 2.660 -12.689 0.268 1.00 0.00 C ATOM 438 CG PRO A 33 4.027 -13.127 0.769 1.00 0.00 C ATOM 439 CD PRO A 33 4.604 -14.102 -0.244 1.00 0.00 C ATOM 0 HA PRO A 33 1.597 -13.504 -1.427 1.00 0.00 H new ATOM 0 HB2 PRO A 33 2.538 -11.610 0.359 1.00 0.00 H new ATOM 0 HB3 PRO A 33 1.864 -13.150 0.852 1.00 0.00 H new ATOM 0 HG2 PRO A 33 4.684 -12.266 0.887 1.00 0.00 H new ATOM 0 HG3 PRO A 33 3.942 -13.599 1.748 1.00 0.00 H new ATOM 0 HD2 PRO A 33 5.579 -13.771 -0.601 1.00 0.00 H new ATOM 0 HD3 PRO A 33 4.743 -15.091 0.193 1.00 0.00 H new ATOM 447 N TYR A 34 1.835 -11.076 -2.209 1.00 0.00 N ATOM 448 CA TYR A 34 1.910 -9.927 -3.095 1.00 0.00 C ATOM 449 C TYR A 34 0.919 -8.841 -2.670 1.00 0.00 C ATOM 450 O TYR A 34 -0.209 -9.142 -2.284 1.00 0.00 O ATOM 451 CB TYR A 34 1.523 -10.439 -4.484 1.00 0.00 C ATOM 452 CG TYR A 34 0.064 -10.884 -4.598 1.00 0.00 C ATOM 453 CD1 TYR A 34 -0.939 -9.942 -4.704 1.00 0.00 C ATOM 454 CD2 TYR A 34 -0.250 -12.228 -4.596 1.00 0.00 C ATOM 455 CE1 TYR A 34 -2.313 -10.362 -4.811 1.00 0.00 C ATOM 456 CE2 TYR A 34 -1.623 -12.648 -4.703 1.00 0.00 C ATOM 457 CZ TYR A 34 -2.587 -11.694 -4.806 1.00 0.00 C ATOM 458 OH TYR A 34 -3.884 -12.090 -4.907 1.00 0.00 O ATOM 0 H TYR A 34 0.987 -11.124 -1.644 1.00 0.00 H new ATOM 0 HA TYR A 34 2.909 -9.491 -3.074 1.00 0.00 H new ATOM 0 HB2 TYR A 34 1.711 -9.653 -5.215 1.00 0.00 H new ATOM 0 HB3 TYR A 34 2.169 -11.277 -4.744 1.00 0.00 H new ATOM 0 HD1 TYR A 34 -0.694 -8.890 -4.707 1.00 0.00 H new ATOM 0 HD2 TYR A 34 0.535 -12.965 -4.514 1.00 0.00 H new ATOM 0 HE1 TYR A 34 -3.108 -9.635 -4.893 1.00 0.00 H new ATOM 0 HE2 TYR A 34 -1.882 -13.697 -4.702 1.00 0.00 H new ATOM 0 HH TYR A 34 -4.452 -11.487 -4.384 1.00 0.00 H new ATOM 468 N VAL A 35 1.377 -7.601 -2.755 1.00 0.00 N ATOM 469 CA VAL A 35 0.545 -6.469 -2.385 1.00 0.00 C ATOM 470 C VAL A 35 -0.233 -5.990 -3.612 1.00 0.00 C ATOM 471 O VAL A 35 0.245 -6.106 -4.739 1.00 0.00 O ATOM 472 CB VAL A 35 1.405 -5.370 -1.757 1.00 0.00 C ATOM 473 CG1 VAL A 35 0.600 -4.083 -1.569 1.00 0.00 C ATOM 474 CG2 VAL A 35 2.009 -5.838 -0.431 1.00 0.00 C ATOM 0 H VAL A 35 2.314 -7.355 -3.075 1.00 0.00 H new ATOM 0 HA VAL A 35 -0.185 -6.763 -1.631 1.00 0.00 H new ATOM 0 HB VAL A 35 2.225 -5.154 -2.442 1.00 0.00 H new ATOM 0 HG11 VAL A 35 1.235 -3.319 -1.121 1.00 0.00 H new ATOM 0 HG12 VAL A 35 0.240 -3.734 -2.537 1.00 0.00 H new ATOM 0 HG13 VAL A 35 -0.250 -4.278 -0.915 1.00 0.00 H new ATOM 0 HG21 VAL A 35 2.616 -5.039 -0.005 1.00 0.00 H new ATOM 0 HG22 VAL A 35 1.209 -6.095 0.263 1.00 0.00 H new ATOM 0 HG23 VAL A 35 2.634 -6.714 -0.605 1.00 0.00 H new ATOM 484 N GLN A 36 -1.420 -5.461 -3.351 1.00 0.00 N ATOM 485 CA GLN A 36 -2.269 -4.964 -4.420 1.00 0.00 C ATOM 486 C GLN A 36 -2.728 -3.537 -4.114 1.00 0.00 C ATOM 487 O GLN A 36 -3.680 -3.336 -3.361 1.00 0.00 O ATOM 488 CB GLN A 36 -3.467 -5.889 -4.644 1.00 0.00 C ATOM 489 CG GLN A 36 -4.565 -5.182 -5.442 1.00 0.00 C ATOM 490 CD GLN A 36 -5.777 -6.095 -5.635 1.00 0.00 C ATOM 491 OE1 GLN A 36 -5.971 -7.071 -4.928 1.00 0.00 O ATOM 492 NE2 GLN A 36 -6.580 -5.726 -6.629 1.00 0.00 N ATOM 0 H GLN A 36 -1.813 -5.366 -2.415 1.00 0.00 H new ATOM 0 HA GLN A 36 -1.687 -4.948 -5.341 1.00 0.00 H new ATOM 0 HB2 GLN A 36 -3.145 -6.784 -5.176 1.00 0.00 H new ATOM 0 HB3 GLN A 36 -3.864 -6.215 -3.683 1.00 0.00 H new ATOM 0 HG2 GLN A 36 -4.869 -4.273 -4.923 1.00 0.00 H new ATOM 0 HG3 GLN A 36 -4.175 -4.879 -6.414 1.00 0.00 H new ATOM 0 HE21 GLN A 36 -6.359 -4.898 -7.182 1.00 0.00 H new ATOM 0 HE22 GLN A 36 -7.416 -6.271 -6.838 1.00 0.00 H new ATOM 501 N LEU A 37 -2.030 -2.584 -4.713 1.00 0.00 N ATOM 502 CA LEU A 37 -2.354 -1.181 -4.513 1.00 0.00 C ATOM 503 C LEU A 37 -3.702 -0.875 -5.171 1.00 0.00 C ATOM 504 O LEU A 37 -4.129 -1.586 -6.079 1.00 0.00 O ATOM 505 CB LEU A 37 -1.213 -0.292 -5.009 1.00 0.00 C ATOM 506 CG LEU A 37 0.027 -0.232 -4.114 1.00 0.00 C ATOM 507 CD1 LEU A 37 -0.194 -1.012 -2.817 1.00 0.00 C ATOM 508 CD2 LEU A 37 1.270 -0.711 -4.867 1.00 0.00 C ATOM 0 H LEU A 37 -1.241 -2.755 -5.337 1.00 0.00 H new ATOM 0 HA LEU A 37 -2.459 -0.962 -3.450 1.00 0.00 H new ATOM 0 HB2 LEU A 37 -0.908 -0.642 -5.995 1.00 0.00 H new ATOM 0 HB3 LEU A 37 -1.596 0.721 -5.134 1.00 0.00 H new ATOM 0 HG LEU A 37 0.199 0.808 -3.838 1.00 0.00 H new ATOM 0 HD11 LEU A 37 0.702 -0.953 -2.200 1.00 0.00 H new ATOM 0 HD12 LEU A 37 -1.037 -0.584 -2.274 1.00 0.00 H new ATOM 0 HD13 LEU A 37 -0.405 -2.055 -3.051 1.00 0.00 H new ATOM 0 HD21 LEU A 37 2.137 -0.658 -4.209 1.00 0.00 H new ATOM 0 HD22 LEU A 37 1.124 -1.741 -5.193 1.00 0.00 H new ATOM 0 HD23 LEU A 37 1.436 -0.075 -5.737 1.00 0.00 H new ATOM 520 N THR A 38 -4.334 0.183 -4.685 1.00 0.00 N ATOM 521 CA THR A 38 -5.624 0.592 -5.214 1.00 0.00 C ATOM 522 C THR A 38 -5.832 2.094 -5.010 1.00 0.00 C ATOM 523 O THR A 38 -5.573 2.619 -3.928 1.00 0.00 O ATOM 524 CB THR A 38 -6.701 -0.267 -4.549 1.00 0.00 C ATOM 525 OG1 THR A 38 -6.086 -1.544 -4.403 1.00 0.00 O ATOM 526 CG2 THR A 38 -7.892 -0.530 -5.472 1.00 0.00 C ATOM 0 H THR A 38 -3.977 0.769 -3.931 1.00 0.00 H new ATOM 0 HA THR A 38 -5.679 0.432 -6.291 1.00 0.00 H new ATOM 0 HB THR A 38 -7.048 0.225 -3.640 1.00 0.00 H new ATOM 0 HG1 THR A 38 -6.715 -2.163 -3.978 1.00 0.00 H new ATOM 0 HG21 THR A 38 -8.627 -1.144 -4.952 1.00 0.00 H new ATOM 0 HG22 THR A 38 -8.348 0.418 -5.757 1.00 0.00 H new ATOM 0 HG23 THR A 38 -7.551 -1.052 -6.366 1.00 0.00 H new ATOM 534 N CYS A 39 -6.299 2.743 -6.066 1.00 0.00 N ATOM 535 CA CYS A 39 -6.545 4.175 -6.016 1.00 0.00 C ATOM 536 C CYS A 39 -7.817 4.471 -6.813 1.00 0.00 C ATOM 537 O CYS A 39 -7.758 4.703 -8.020 1.00 0.00 O ATOM 538 CB CYS A 39 -5.348 4.973 -6.534 1.00 0.00 C ATOM 539 SG CYS A 39 -4.579 5.910 -5.163 1.00 0.00 S ATOM 0 H CYS A 39 -6.514 2.304 -6.961 1.00 0.00 H new ATOM 0 HA CYS A 39 -6.685 4.487 -4.981 1.00 0.00 H new ATOM 0 HB2 CYS A 39 -4.617 4.299 -6.980 1.00 0.00 H new ATOM 0 HB3 CYS A 39 -5.669 5.658 -7.318 1.00 0.00 H new ATOM 0 HG CYS A 39 -3.562 6.582 -5.614 1.00 0.00 H new ATOM 545 N ARG A 40 -8.938 4.455 -6.106 1.00 0.00 N ATOM 546 CA ARG A 40 -10.222 4.719 -6.733 1.00 0.00 C ATOM 547 C ARG A 40 -10.569 3.606 -7.723 1.00 0.00 C ATOM 548 O ARG A 40 -11.162 2.597 -7.345 1.00 0.00 O ATOM 549 CB ARG A 40 -10.210 6.061 -7.468 1.00 0.00 C ATOM 550 CG ARG A 40 -10.786 7.173 -6.590 1.00 0.00 C ATOM 551 CD ARG A 40 -10.274 7.057 -5.152 1.00 0.00 C ATOM 552 NE ARG A 40 -11.285 6.384 -4.307 1.00 0.00 N ATOM 553 CZ ARG A 40 -11.188 6.258 -2.977 1.00 0.00 C ATOM 554 NH1 ARG A 40 -10.126 6.759 -2.332 1.00 0.00 N ATOM 555 NH2 ARG A 40 -12.154 5.631 -2.291 1.00 0.00 N ATOM 0 H ARG A 40 -8.983 4.263 -5.105 1.00 0.00 H new ATOM 0 HA ARG A 40 -10.974 4.756 -5.945 1.00 0.00 H new ATOM 0 HB2 ARG A 40 -9.189 6.312 -7.756 1.00 0.00 H new ATOM 0 HB3 ARG A 40 -10.790 5.981 -8.387 1.00 0.00 H new ATOM 0 HG2 ARG A 40 -10.511 8.145 -7.000 1.00 0.00 H new ATOM 0 HG3 ARG A 40 -11.875 7.120 -6.598 1.00 0.00 H new ATOM 0 HD2 ARG A 40 -9.341 6.495 -5.134 1.00 0.00 H new ATOM 0 HD3 ARG A 40 -10.057 8.048 -4.754 1.00 0.00 H new ATOM 0 HE ARG A 40 -12.107 5.992 -4.766 1.00 0.00 H new ATOM 0 HH11 ARG A 40 -9.391 7.237 -2.854 1.00 0.00 H new ATOM 0 HH12 ARG A 40 -10.052 6.663 -1.319 1.00 0.00 H new ATOM 0 HH21 ARG A 40 -12.963 5.250 -2.782 1.00 0.00 H new ATOM 0 HH22 ARG A 40 -12.080 5.535 -1.278 1.00 0.00 H new ATOM 569 N THR A 41 -10.183 3.826 -8.971 1.00 0.00 N ATOM 570 CA THR A 41 -10.446 2.854 -10.018 1.00 0.00 C ATOM 571 C THR A 41 -9.139 2.424 -10.687 1.00 0.00 C ATOM 572 O THR A 41 -9.074 2.302 -11.909 1.00 0.00 O ATOM 573 CB THR A 41 -11.454 3.469 -10.992 1.00 0.00 C ATOM 574 OG1 THR A 41 -10.694 4.436 -11.713 1.00 0.00 O ATOM 575 CG2 THR A 41 -12.528 4.293 -10.281 1.00 0.00 C ATOM 0 H THR A 41 -9.690 4.664 -9.281 1.00 0.00 H new ATOM 0 HA THR A 41 -10.881 1.942 -9.610 1.00 0.00 H new ATOM 0 HB THR A 41 -11.929 2.677 -11.571 1.00 0.00 H new ATOM 0 HG1 THR A 41 -10.004 3.982 -12.241 1.00 0.00 H new ATOM 0 HG21 THR A 41 -13.217 4.706 -11.018 1.00 0.00 H new ATOM 0 HG22 THR A 41 -13.077 3.655 -9.589 1.00 0.00 H new ATOM 0 HG23 THR A 41 -12.057 5.106 -9.729 1.00 0.00 H new ATOM 583 N GLN A 42 -8.130 2.207 -9.856 1.00 0.00 N ATOM 584 CA GLN A 42 -6.829 1.793 -10.352 1.00 0.00 C ATOM 585 C GLN A 42 -6.079 1.001 -9.278 1.00 0.00 C ATOM 586 O GLN A 42 -5.843 1.505 -8.181 1.00 0.00 O ATOM 587 CB GLN A 42 -6.010 2.999 -10.815 1.00 0.00 C ATOM 588 CG GLN A 42 -5.399 3.738 -9.623 1.00 0.00 C ATOM 589 CD GLN A 42 -5.206 5.223 -9.938 1.00 0.00 C ATOM 590 OE1 GLN A 42 -4.214 5.637 -10.515 1.00 0.00 O ATOM 591 NE2 GLN A 42 -6.207 5.998 -9.529 1.00 0.00 N ATOM 0 H GLN A 42 -8.187 2.310 -8.843 1.00 0.00 H new ATOM 0 HA GLN A 42 -6.980 1.145 -11.215 1.00 0.00 H new ATOM 0 HB2 GLN A 42 -5.218 2.669 -11.487 1.00 0.00 H new ATOM 0 HB3 GLN A 42 -6.646 3.679 -11.382 1.00 0.00 H new ATOM 0 HG2 GLN A 42 -6.046 3.628 -8.752 1.00 0.00 H new ATOM 0 HG3 GLN A 42 -4.439 3.290 -9.366 1.00 0.00 H new ATOM 0 HE21 GLN A 42 -7.009 5.586 -9.051 1.00 0.00 H new ATOM 0 HE22 GLN A 42 -6.173 7.004 -9.693 1.00 0.00 H new ATOM 600 N ASP A 43 -5.725 -0.226 -9.632 1.00 0.00 N ATOM 601 CA ASP A 43 -5.007 -1.092 -8.713 1.00 0.00 C ATOM 602 C ASP A 43 -3.751 -1.630 -9.401 1.00 0.00 C ATOM 603 O ASP A 43 -3.733 -1.805 -10.619 1.00 0.00 O ATOM 604 CB ASP A 43 -5.867 -2.288 -8.297 1.00 0.00 C ATOM 605 CG ASP A 43 -6.728 -2.884 -9.413 1.00 0.00 C ATOM 606 OD1 ASP A 43 -6.164 -3.111 -10.505 1.00 0.00 O ATOM 607 OD2 ASP A 43 -7.930 -3.100 -9.148 1.00 0.00 O ATOM 0 H ASP A 43 -5.922 -0.641 -10.543 1.00 0.00 H new ATOM 0 HA ASP A 43 -4.751 -0.507 -7.830 1.00 0.00 H new ATOM 0 HB2 ASP A 43 -5.213 -3.068 -7.907 1.00 0.00 H new ATOM 0 HB3 ASP A 43 -6.520 -1.981 -7.480 1.00 0.00 H new ATOM 612 N GLN A 44 -2.732 -1.877 -8.592 1.00 0.00 N ATOM 613 CA GLN A 44 -1.475 -2.391 -9.108 1.00 0.00 C ATOM 614 C GLN A 44 -0.847 -3.362 -8.106 1.00 0.00 C ATOM 615 O GLN A 44 -0.588 -2.995 -6.960 1.00 0.00 O ATOM 616 CB GLN A 44 -0.512 -1.251 -9.444 1.00 0.00 C ATOM 617 CG GLN A 44 -1.135 -0.287 -10.456 1.00 0.00 C ATOM 618 CD GLN A 44 -0.153 0.825 -10.830 1.00 0.00 C ATOM 619 OE1 GLN A 44 1.052 0.640 -10.863 1.00 0.00 O ATOM 620 NE2 GLN A 44 -0.735 1.988 -11.108 1.00 0.00 N ATOM 0 H GLN A 44 -2.751 -1.731 -7.583 1.00 0.00 H new ATOM 0 HA GLN A 44 -1.679 -2.933 -10.031 1.00 0.00 H new ATOM 0 HB2 GLN A 44 -0.251 -0.710 -8.534 1.00 0.00 H new ATOM 0 HB3 GLN A 44 0.414 -1.660 -9.848 1.00 0.00 H new ATOM 0 HG2 GLN A 44 -1.429 -0.834 -11.352 1.00 0.00 H new ATOM 0 HG3 GLN A 44 -2.042 0.149 -10.037 1.00 0.00 H new ATOM 0 HE21 GLN A 44 -1.750 2.074 -11.061 1.00 0.00 H new ATOM 0 HE22 GLN A 44 -0.166 2.794 -11.368 1.00 0.00 H new ATOM 629 N LYS A 45 -0.620 -4.581 -8.573 1.00 0.00 N ATOM 630 CA LYS A 45 -0.028 -5.607 -7.731 1.00 0.00 C ATOM 631 C LYS A 45 1.434 -5.809 -8.135 1.00 0.00 C ATOM 632 O LYS A 45 1.816 -5.517 -9.267 1.00 0.00 O ATOM 633 CB LYS A 45 -0.862 -6.888 -7.780 1.00 0.00 C ATOM 634 CG LYS A 45 -2.358 -6.571 -7.711 1.00 0.00 C ATOM 635 CD LYS A 45 -3.183 -7.852 -7.573 1.00 0.00 C ATOM 636 CE LYS A 45 -3.187 -8.645 -8.882 1.00 0.00 C ATOM 637 NZ LYS A 45 -3.947 -7.921 -9.925 1.00 0.00 N ATOM 0 H LYS A 45 -0.835 -4.881 -9.524 1.00 0.00 H new ATOM 0 HA LYS A 45 -0.031 -5.293 -6.687 1.00 0.00 H new ATOM 0 HB2 LYS A 45 -0.644 -7.433 -8.698 1.00 0.00 H new ATOM 0 HB3 LYS A 45 -0.586 -7.538 -6.950 1.00 0.00 H new ATOM 0 HG2 LYS A 45 -2.556 -5.914 -6.864 1.00 0.00 H new ATOM 0 HG3 LYS A 45 -2.662 -6.033 -8.609 1.00 0.00 H new ATOM 0 HD2 LYS A 45 -2.774 -8.468 -6.772 1.00 0.00 H new ATOM 0 HD3 LYS A 45 -4.206 -7.602 -7.292 1.00 0.00 H new ATOM 0 HE2 LYS A 45 -2.163 -8.809 -9.218 1.00 0.00 H new ATOM 0 HE3 LYS A 45 -3.630 -9.627 -8.717 1.00 0.00 H new ATOM 0 HZ1 LYS A 45 -4.217 -8.583 -10.680 1.00 0.00 H new ATOM 0 HZ2 LYS A 45 -4.804 -7.507 -9.506 1.00 0.00 H new ATOM 0 HZ3 LYS A 45 -3.355 -7.164 -10.323 1.00 0.00 H new ATOM 651 N SER A 46 2.213 -6.309 -7.186 1.00 0.00 N ATOM 652 CA SER A 46 3.624 -6.554 -7.429 1.00 0.00 C ATOM 653 C SER A 46 3.898 -8.059 -7.451 1.00 0.00 C ATOM 654 O SER A 46 2.971 -8.863 -7.365 1.00 0.00 O ATOM 655 CB SER A 46 4.492 -5.873 -6.368 1.00 0.00 C ATOM 656 OG SER A 46 5.680 -5.318 -6.926 1.00 0.00 O ATOM 0 H SER A 46 1.893 -6.551 -6.248 1.00 0.00 H new ATOM 0 HA SER A 46 3.882 -6.130 -8.399 1.00 0.00 H new ATOM 0 HB2 SER A 46 3.918 -5.085 -5.881 1.00 0.00 H new ATOM 0 HB3 SER A 46 4.757 -6.597 -5.597 1.00 0.00 H new ATOM 0 HG SER A 46 6.125 -4.758 -6.256 1.00 0.00 H new ATOM 662 N ASN A 47 5.174 -8.395 -7.568 1.00 0.00 N ATOM 663 CA ASN A 47 5.581 -9.789 -7.603 1.00 0.00 C ATOM 664 C ASN A 47 4.898 -10.544 -6.461 1.00 0.00 C ATOM 665 O ASN A 47 4.173 -9.949 -5.665 1.00 0.00 O ATOM 666 CB ASN A 47 7.094 -9.926 -7.422 1.00 0.00 C ATOM 667 CG ASN A 47 7.813 -9.901 -8.772 1.00 0.00 C ATOM 668 OD1 ASN A 47 7.250 -9.555 -9.798 1.00 0.00 O ATOM 669 ND2 ASN A 47 9.084 -10.286 -8.715 1.00 0.00 N ATOM 0 H ASN A 47 5.940 -7.725 -7.640 1.00 0.00 H new ATOM 0 HA ASN A 47 5.295 -10.199 -8.572 1.00 0.00 H new ATOM 0 HB2 ASN A 47 7.463 -9.115 -6.794 1.00 0.00 H new ATOM 0 HB3 ASN A 47 7.319 -10.858 -6.904 1.00 0.00 H new ATOM 0 HD21 ASN A 47 9.650 -10.304 -9.563 1.00 0.00 H new ATOM 0 HD22 ASN A 47 9.493 -10.563 -7.823 1.00 0.00 H new ATOM 676 N VAL A 48 5.153 -11.844 -6.417 1.00 0.00 N ATOM 677 CA VAL A 48 4.571 -12.686 -5.386 1.00 0.00 C ATOM 678 C VAL A 48 5.631 -12.991 -4.325 1.00 0.00 C ATOM 679 O VAL A 48 5.708 -14.112 -3.824 1.00 0.00 O ATOM 680 CB VAL A 48 3.975 -13.947 -6.015 1.00 0.00 C ATOM 681 CG1 VAL A 48 2.807 -13.598 -6.941 1.00 0.00 C ATOM 682 CG2 VAL A 48 5.045 -14.747 -6.760 1.00 0.00 C ATOM 0 H VAL A 48 5.755 -12.334 -7.079 1.00 0.00 H new ATOM 0 HA VAL A 48 3.751 -12.169 -4.888 1.00 0.00 H new ATOM 0 HB VAL A 48 3.589 -14.573 -5.210 1.00 0.00 H new ATOM 0 HG11 VAL A 48 2.401 -14.512 -7.375 1.00 0.00 H new ATOM 0 HG12 VAL A 48 2.029 -13.091 -6.370 1.00 0.00 H new ATOM 0 HG13 VAL A 48 3.158 -12.942 -7.738 1.00 0.00 H new ATOM 0 HG21 VAL A 48 4.594 -15.638 -7.197 1.00 0.00 H new ATOM 0 HG22 VAL A 48 5.474 -14.132 -7.551 1.00 0.00 H new ATOM 0 HG23 VAL A 48 5.830 -15.042 -6.063 1.00 0.00 H new ATOM 692 N ALA A 49 6.421 -11.974 -4.014 1.00 0.00 N ATOM 693 CA ALA A 49 7.472 -12.119 -3.022 1.00 0.00 C ATOM 694 C ALA A 49 7.801 -13.603 -2.847 1.00 0.00 C ATOM 695 O ALA A 49 7.440 -14.208 -1.839 1.00 0.00 O ATOM 696 CB ALA A 49 7.033 -11.461 -1.713 1.00 0.00 C ATOM 0 H ALA A 49 6.354 -11.046 -4.432 1.00 0.00 H new ATOM 0 HA ALA A 49 8.382 -11.616 -3.350 1.00 0.00 H new ATOM 0 HB1 ALA A 49 7.822 -11.570 -0.969 1.00 0.00 H new ATOM 0 HB2 ALA A 49 6.840 -10.402 -1.885 1.00 0.00 H new ATOM 0 HB3 ALA A 49 6.124 -11.941 -1.351 1.00 0.00 H new ATOM 702 N GLU A 50 8.482 -14.148 -3.845 1.00 0.00 N ATOM 703 CA GLU A 50 8.863 -15.549 -3.814 1.00 0.00 C ATOM 704 C GLU A 50 9.778 -15.824 -2.619 1.00 0.00 C ATOM 705 O GLU A 50 10.914 -15.356 -2.582 1.00 0.00 O ATOM 706 CB GLU A 50 9.534 -15.964 -5.125 1.00 0.00 C ATOM 707 CG GLU A 50 8.550 -15.886 -6.294 1.00 0.00 C ATOM 708 CD GLU A 50 9.290 -15.735 -7.625 1.00 0.00 C ATOM 709 OE1 GLU A 50 9.803 -14.621 -7.866 1.00 0.00 O ATOM 710 OE2 GLU A 50 9.326 -16.738 -8.370 1.00 0.00 O ATOM 0 H GLU A 50 8.780 -13.644 -4.680 1.00 0.00 H new ATOM 0 HA GLU A 50 7.960 -16.148 -3.701 1.00 0.00 H new ATOM 0 HB2 GLU A 50 10.389 -15.317 -5.321 1.00 0.00 H new ATOM 0 HB3 GLU A 50 9.918 -16.980 -5.035 1.00 0.00 H new ATOM 0 HG2 GLU A 50 7.934 -16.785 -6.316 1.00 0.00 H new ATOM 0 HG3 GLU A 50 7.876 -15.041 -6.151 1.00 0.00 H new ATOM 717 N GLY A 51 9.247 -16.583 -1.671 1.00 0.00 N ATOM 718 CA GLY A 51 10.002 -16.926 -0.478 1.00 0.00 C ATOM 719 C GLY A 51 10.924 -15.778 -0.063 1.00 0.00 C ATOM 720 O GLY A 51 12.021 -15.634 -0.599 1.00 0.00 O ATOM 0 H GLY A 51 8.304 -16.970 -1.705 1.00 0.00 H new ATOM 0 HA2 GLY A 51 9.316 -17.159 0.336 1.00 0.00 H new ATOM 0 HA3 GLY A 51 10.593 -17.823 -0.663 1.00 0.00 H new ATOM 724 N MET A 52 10.444 -14.990 0.888 1.00 0.00 N ATOM 725 CA MET A 52 11.211 -13.859 1.381 1.00 0.00 C ATOM 726 C MET A 52 11.567 -14.040 2.858 1.00 0.00 C ATOM 727 O MET A 52 12.635 -13.620 3.299 1.00 0.00 O ATOM 728 CB MET A 52 10.399 -12.575 1.204 1.00 0.00 C ATOM 729 CG MET A 52 10.869 -11.794 -0.024 1.00 0.00 C ATOM 730 SD MET A 52 10.629 -12.772 -1.498 1.00 0.00 S ATOM 731 CE MET A 52 11.041 -11.562 -2.744 1.00 0.00 C ATOM 0 H MET A 52 9.533 -15.113 1.330 1.00 0.00 H new ATOM 0 HA MET A 52 12.137 -13.795 0.809 1.00 0.00 H new ATOM 0 HB2 MET A 52 9.342 -12.820 1.101 1.00 0.00 H new ATOM 0 HB3 MET A 52 10.496 -11.953 2.094 1.00 0.00 H new ATOM 0 HG2 MET A 52 10.315 -10.859 -0.104 1.00 0.00 H new ATOM 0 HG3 MET A 52 11.922 -11.533 0.082 1.00 0.00 H new ATOM 0 HE1 MET A 52 10.892 -11.994 -3.734 1.00 0.00 H new ATOM 0 HE2 MET A 52 10.400 -10.688 -2.629 1.00 0.00 H new ATOM 0 HE3 MET A 52 12.084 -11.265 -2.632 1.00 0.00 H new ATOM 741 N GLY A 53 10.650 -14.665 3.582 1.00 0.00 N ATOM 742 CA GLY A 53 10.853 -14.906 5.001 1.00 0.00 C ATOM 743 C GLY A 53 10.052 -13.913 5.846 1.00 0.00 C ATOM 744 O GLY A 53 10.612 -12.961 6.388 1.00 0.00 O ATOM 0 H GLY A 53 9.765 -15.012 3.213 1.00 0.00 H new ATOM 0 HA2 GLY A 53 10.552 -15.924 5.247 1.00 0.00 H new ATOM 0 HA3 GLY A 53 11.913 -14.820 5.240 1.00 0.00 H new ATOM 748 N THR A 54 8.755 -14.169 5.931 1.00 0.00 N ATOM 749 CA THR A 54 7.872 -13.309 6.701 1.00 0.00 C ATOM 750 C THR A 54 8.239 -11.839 6.487 1.00 0.00 C ATOM 751 O THR A 54 8.002 -11.004 7.359 1.00 0.00 O ATOM 752 CB THR A 54 7.944 -13.747 8.165 1.00 0.00 C ATOM 753 OG1 THR A 54 9.340 -13.884 8.418 1.00 0.00 O ATOM 754 CG2 THR A 54 7.386 -15.155 8.384 1.00 0.00 C ATOM 0 H THR A 54 8.294 -14.959 5.480 1.00 0.00 H new ATOM 0 HA THR A 54 6.838 -13.405 6.369 1.00 0.00 H new ATOM 0 HB THR A 54 7.393 -13.038 8.783 1.00 0.00 H new ATOM 0 HG1 THR A 54 9.810 -13.086 8.098 1.00 0.00 H new ATOM 0 HG21 THR A 54 7.461 -15.416 9.440 1.00 0.00 H new ATOM 0 HG22 THR A 54 6.341 -15.184 8.077 1.00 0.00 H new ATOM 0 HG23 THR A 54 7.958 -15.869 7.792 1.00 0.00 H new ATOM 762 N THR A 55 8.811 -11.568 5.323 1.00 0.00 N ATOM 763 CA THR A 55 9.213 -10.214 4.984 1.00 0.00 C ATOM 764 C THR A 55 9.307 -10.050 3.466 1.00 0.00 C ATOM 765 O THR A 55 10.403 -9.980 2.913 1.00 0.00 O ATOM 766 CB THR A 55 10.525 -9.914 5.711 1.00 0.00 C ATOM 767 OG1 THR A 55 11.378 -10.996 5.347 1.00 0.00 O ATOM 768 CG2 THR A 55 10.395 -10.037 7.230 1.00 0.00 C ATOM 0 H THR A 55 9.006 -12.264 4.603 1.00 0.00 H new ATOM 0 HA THR A 55 8.470 -9.487 5.312 1.00 0.00 H new ATOM 0 HB THR A 55 10.859 -8.908 5.456 1.00 0.00 H new ATOM 0 HG1 THR A 55 11.268 -11.729 5.988 1.00 0.00 H new ATOM 0 HG21 THR A 55 11.354 -9.814 7.697 1.00 0.00 H new ATOM 0 HG22 THR A 55 9.644 -9.333 7.589 1.00 0.00 H new ATOM 0 HG23 THR A 55 10.093 -11.052 7.488 1.00 0.00 H new ATOM 776 N PRO A 56 8.112 -9.992 2.819 1.00 0.00 N ATOM 777 CA PRO A 56 8.050 -9.838 1.375 1.00 0.00 C ATOM 778 C PRO A 56 8.382 -8.402 0.963 1.00 0.00 C ATOM 779 O PRO A 56 7.565 -7.499 1.131 1.00 0.00 O ATOM 780 CB PRO A 56 6.638 -10.253 0.996 1.00 0.00 C ATOM 781 CG PRO A 56 5.823 -10.179 2.277 1.00 0.00 C ATOM 782 CD PRO A 56 6.794 -10.072 3.442 1.00 0.00 C ATOM 0 HA PRO A 56 8.785 -10.452 0.854 1.00 0.00 H new ATOM 0 HB2 PRO A 56 6.228 -9.591 0.234 1.00 0.00 H new ATOM 0 HB3 PRO A 56 6.625 -11.262 0.583 1.00 0.00 H new ATOM 0 HG2 PRO A 56 5.156 -9.317 2.256 1.00 0.00 H new ATOM 0 HG3 PRO A 56 5.196 -11.065 2.382 1.00 0.00 H new ATOM 0 HD2 PRO A 56 6.589 -9.190 4.049 1.00 0.00 H new ATOM 0 HD3 PRO A 56 6.719 -10.937 4.101 1.00 0.00 H new ATOM 790 N GLU A 57 9.584 -8.237 0.429 1.00 0.00 N ATOM 791 CA GLU A 57 10.034 -6.927 -0.009 1.00 0.00 C ATOM 792 C GLU A 57 9.929 -6.811 -1.531 1.00 0.00 C ATOM 793 O GLU A 57 10.217 -7.766 -2.251 1.00 0.00 O ATOM 794 CB GLU A 57 11.463 -6.652 0.464 1.00 0.00 C ATOM 795 CG GLU A 57 11.917 -5.250 0.052 1.00 0.00 C ATOM 796 CD GLU A 57 12.713 -4.579 1.173 1.00 0.00 C ATOM 797 OE1 GLU A 57 13.586 -5.270 1.740 1.00 0.00 O ATOM 798 OE2 GLU A 57 12.430 -3.391 1.437 1.00 0.00 O ATOM 0 H GLU A 57 10.259 -8.989 0.290 1.00 0.00 H new ATOM 0 HA GLU A 57 9.386 -6.173 0.439 1.00 0.00 H new ATOM 0 HB2 GLU A 57 11.516 -6.751 1.548 1.00 0.00 H new ATOM 0 HB3 GLU A 57 12.139 -7.396 0.042 1.00 0.00 H new ATOM 0 HG2 GLU A 57 12.530 -5.312 -0.847 1.00 0.00 H new ATOM 0 HG3 GLU A 57 11.048 -4.641 -0.196 1.00 0.00 H new ATOM 805 N TRP A 58 9.516 -5.634 -1.976 1.00 0.00 N ATOM 806 CA TRP A 58 9.369 -5.381 -3.399 1.00 0.00 C ATOM 807 C TRP A 58 10.272 -4.201 -3.765 1.00 0.00 C ATOM 808 O TRP A 58 11.066 -4.289 -4.701 1.00 0.00 O ATOM 809 CB TRP A 58 7.902 -5.147 -3.766 1.00 0.00 C ATOM 810 CG TRP A 58 6.982 -6.324 -3.433 1.00 0.00 C ATOM 811 CD1 TRP A 58 6.627 -7.344 -4.227 1.00 0.00 C ATOM 812 CD2 TRP A 58 6.311 -6.562 -2.178 1.00 0.00 C ATOM 813 NE1 TRP A 58 5.780 -8.218 -3.578 1.00 0.00 N ATOM 814 CE2 TRP A 58 5.581 -7.728 -2.292 1.00 0.00 C ATOM 815 CE3 TRP A 58 6.320 -5.817 -0.986 1.00 0.00 C ATOM 816 CZ2 TRP A 58 4.806 -8.252 -1.251 1.00 0.00 C ATOM 817 CZ3 TRP A 58 5.541 -6.355 0.046 1.00 0.00 C ATOM 818 CH2 TRP A 58 4.800 -7.527 -0.053 1.00 0.00 C ATOM 0 H TRP A 58 9.278 -4.844 -1.376 1.00 0.00 H new ATOM 0 HA TRP A 58 9.679 -6.250 -3.979 1.00 0.00 H new ATOM 0 HB2 TRP A 58 7.544 -4.260 -3.243 1.00 0.00 H new ATOM 0 HB3 TRP A 58 7.834 -4.937 -4.833 1.00 0.00 H new ATOM 0 HD1 TRP A 58 6.962 -7.466 -5.246 1.00 0.00 H new ATOM 0 HE1 TRP A 58 5.374 -9.068 -3.970 1.00 0.00 H new ATOM 0 HE3 TRP A 58 6.883 -4.902 -0.875 1.00 0.00 H new ATOM 0 HZ2 TRP A 58 4.243 -9.166 -1.366 1.00 0.00 H new ATOM 0 HZ3 TRP A 58 5.514 -5.822 0.985 1.00 0.00 H new ATOM 0 HH2 TRP A 58 4.222 -7.877 0.790 1.00 0.00 H new ATOM 829 N ASN A 59 10.120 -3.124 -3.009 1.00 0.00 N ATOM 830 CA ASN A 59 10.912 -1.928 -3.242 1.00 0.00 C ATOM 831 C ASN A 59 10.607 -1.384 -4.639 1.00 0.00 C ATOM 832 O ASN A 59 11.484 -0.827 -5.297 1.00 0.00 O ATOM 833 CB ASN A 59 12.409 -2.236 -3.171 1.00 0.00 C ATOM 834 CG ASN A 59 12.913 -2.179 -1.727 1.00 0.00 C ATOM 835 OD1 ASN A 59 12.710 -1.213 -1.010 1.00 0.00 O ATOM 836 ND2 ASN A 59 13.579 -3.264 -1.343 1.00 0.00 N ATOM 0 H ASN A 59 9.460 -3.054 -2.234 1.00 0.00 H new ATOM 0 HA ASN A 59 10.657 -1.199 -2.472 1.00 0.00 H new ATOM 0 HB2 ASN A 59 12.601 -3.225 -3.588 1.00 0.00 H new ATOM 0 HB3 ASN A 59 12.960 -1.520 -3.781 1.00 0.00 H new ATOM 0 HD21 ASN A 59 13.956 -3.323 -0.397 1.00 0.00 H new ATOM 0 HD22 ASN A 59 13.713 -4.037 -1.994 1.00 0.00 H new ATOM 843 N GLU A 60 9.361 -1.565 -5.050 1.00 0.00 N ATOM 844 CA GLU A 60 8.929 -1.099 -6.357 1.00 0.00 C ATOM 845 C GLU A 60 8.397 0.332 -6.262 1.00 0.00 C ATOM 846 O GLU A 60 8.497 0.966 -5.213 1.00 0.00 O ATOM 847 CB GLU A 60 7.878 -2.037 -6.954 1.00 0.00 C ATOM 848 CG GLU A 60 8.518 -3.034 -7.921 1.00 0.00 C ATOM 849 CD GLU A 60 8.140 -2.715 -9.369 1.00 0.00 C ATOM 850 OE1 GLU A 60 8.347 -1.548 -9.765 1.00 0.00 O ATOM 851 OE2 GLU A 60 7.651 -3.645 -10.046 1.00 0.00 O ATOM 0 H GLU A 60 8.636 -2.028 -4.501 1.00 0.00 H new ATOM 0 HA GLU A 60 9.791 -1.101 -7.024 1.00 0.00 H new ATOM 0 HB2 GLU A 60 7.370 -2.576 -6.154 1.00 0.00 H new ATOM 0 HB3 GLU A 60 7.120 -1.454 -7.477 1.00 0.00 H new ATOM 0 HG2 GLU A 60 9.602 -3.008 -7.810 1.00 0.00 H new ATOM 0 HG3 GLU A 60 8.196 -4.045 -7.672 1.00 0.00 H new ATOM 858 N THR A 61 7.843 0.799 -7.371 1.00 0.00 N ATOM 859 CA THR A 61 7.295 2.143 -7.426 1.00 0.00 C ATOM 860 C THR A 61 6.086 2.189 -8.362 1.00 0.00 C ATOM 861 O THR A 61 6.200 1.872 -9.545 1.00 0.00 O ATOM 862 CB THR A 61 8.419 3.096 -7.837 1.00 0.00 C ATOM 863 OG1 THR A 61 9.162 3.294 -6.638 1.00 0.00 O ATOM 864 CG2 THR A 61 7.903 4.492 -8.191 1.00 0.00 C ATOM 0 H THR A 61 7.762 0.270 -8.239 1.00 0.00 H new ATOM 0 HA THR A 61 6.923 2.458 -6.451 1.00 0.00 H new ATOM 0 HB THR A 61 8.954 2.680 -8.691 1.00 0.00 H new ATOM 0 HG1 THR A 61 9.912 3.899 -6.814 1.00 0.00 H new ATOM 0 HG21 THR A 61 8.741 5.128 -8.475 1.00 0.00 H new ATOM 0 HG22 THR A 61 7.203 4.421 -9.023 1.00 0.00 H new ATOM 0 HG23 THR A 61 7.397 4.923 -7.327 1.00 0.00 H new ATOM 872 N PHE A 62 4.955 2.585 -7.798 1.00 0.00 N ATOM 873 CA PHE A 62 3.726 2.676 -8.568 1.00 0.00 C ATOM 874 C PHE A 62 3.122 4.079 -8.473 1.00 0.00 C ATOM 875 O PHE A 62 2.730 4.518 -7.393 1.00 0.00 O ATOM 876 CB PHE A 62 2.745 1.669 -7.965 1.00 0.00 C ATOM 877 CG PHE A 62 3.322 0.263 -7.796 1.00 0.00 C ATOM 878 CD1 PHE A 62 3.535 -0.521 -8.888 1.00 0.00 C ATOM 879 CD2 PHE A 62 3.622 -0.205 -6.555 1.00 0.00 C ATOM 880 CE1 PHE A 62 4.071 -1.826 -8.731 1.00 0.00 C ATOM 881 CE2 PHE A 62 4.158 -1.510 -6.398 1.00 0.00 C ATOM 882 CZ PHE A 62 4.371 -2.294 -7.489 1.00 0.00 C ATOM 0 H PHE A 62 4.864 2.847 -6.816 1.00 0.00 H new ATOM 0 HA PHE A 62 3.929 2.467 -9.618 1.00 0.00 H new ATOM 0 HB2 PHE A 62 2.417 2.035 -6.992 1.00 0.00 H new ATOM 0 HB3 PHE A 62 1.861 1.614 -8.600 1.00 0.00 H new ATOM 0 HD1 PHE A 62 3.296 -0.150 -9.874 1.00 0.00 H new ATOM 0 HD2 PHE A 62 3.452 0.417 -5.688 1.00 0.00 H new ATOM 0 HE1 PHE A 62 4.241 -2.448 -9.598 1.00 0.00 H new ATOM 0 HE2 PHE A 62 4.397 -1.881 -5.412 1.00 0.00 H new ATOM 0 HZ PHE A 62 4.778 -3.287 -7.370 1.00 0.00 H new ATOM 892 N ILE A 63 3.065 4.743 -9.618 1.00 0.00 N ATOM 893 CA ILE A 63 2.515 6.087 -9.677 1.00 0.00 C ATOM 894 C ILE A 63 0.991 6.005 -9.782 1.00 0.00 C ATOM 895 O ILE A 63 0.455 5.083 -10.395 1.00 0.00 O ATOM 896 CB ILE A 63 3.167 6.883 -10.809 1.00 0.00 C ATOM 897 CG1 ILE A 63 4.683 6.673 -10.824 1.00 0.00 C ATOM 898 CG2 ILE A 63 2.794 8.365 -10.722 1.00 0.00 C ATOM 899 CD1 ILE A 63 5.324 7.211 -9.543 1.00 0.00 C ATOM 0 H ILE A 63 3.391 4.376 -10.512 1.00 0.00 H new ATOM 0 HA ILE A 63 2.743 6.633 -8.762 1.00 0.00 H new ATOM 0 HB ILE A 63 2.781 6.509 -11.757 1.00 0.00 H new ATOM 0 HG12 ILE A 63 4.906 5.611 -10.928 1.00 0.00 H new ATOM 0 HG13 ILE A 63 5.115 7.175 -11.690 1.00 0.00 H new ATOM 0 HG21 ILE A 63 3.270 8.909 -11.538 1.00 0.00 H new ATOM 0 HG22 ILE A 63 1.712 8.473 -10.797 1.00 0.00 H new ATOM 0 HG23 ILE A 63 3.134 8.770 -9.769 1.00 0.00 H new ATOM 0 HD11 ILE A 63 6.401 7.049 -9.579 1.00 0.00 H new ATOM 0 HD12 ILE A 63 5.120 8.278 -9.455 1.00 0.00 H new ATOM 0 HD13 ILE A 63 4.908 6.689 -8.681 1.00 0.00 H new ATOM 911 N PHE A 64 0.334 6.982 -9.173 1.00 0.00 N ATOM 912 CA PHE A 64 -1.118 7.033 -9.190 1.00 0.00 C ATOM 913 C PHE A 64 -1.614 8.458 -9.445 1.00 0.00 C ATOM 914 O PHE A 64 -1.229 9.388 -8.740 1.00 0.00 O ATOM 915 CB PHE A 64 -1.597 6.578 -7.811 1.00 0.00 C ATOM 916 CG PHE A 64 -1.516 5.066 -7.591 1.00 0.00 C ATOM 917 CD1 PHE A 64 -2.388 4.239 -8.227 1.00 0.00 C ATOM 918 CD2 PHE A 64 -0.571 4.549 -6.760 1.00 0.00 C ATOM 919 CE1 PHE A 64 -2.312 2.835 -8.023 1.00 0.00 C ATOM 920 CE2 PHE A 64 -0.496 3.146 -6.556 1.00 0.00 C ATOM 921 CZ PHE A 64 -1.368 2.319 -7.192 1.00 0.00 C ATOM 0 H PHE A 64 0.781 7.745 -8.665 1.00 0.00 H new ATOM 0 HA PHE A 64 -1.504 6.395 -9.986 1.00 0.00 H new ATOM 0 HB2 PHE A 64 -1.001 7.078 -7.048 1.00 0.00 H new ATOM 0 HB3 PHE A 64 -2.629 6.900 -7.672 1.00 0.00 H new ATOM 0 HD1 PHE A 64 -3.138 4.649 -8.887 1.00 0.00 H new ATOM 0 HD2 PHE A 64 0.122 5.206 -6.256 1.00 0.00 H new ATOM 0 HE1 PHE A 64 -3.004 2.178 -8.528 1.00 0.00 H new ATOM 0 HE2 PHE A 64 0.254 2.736 -5.896 1.00 0.00 H new ATOM 0 HZ PHE A 64 -1.311 1.252 -7.037 1.00 0.00 H new ATOM 931 N THR A 65 -2.461 8.583 -10.456 1.00 0.00 N ATOM 932 CA THR A 65 -3.014 9.878 -10.814 1.00 0.00 C ATOM 933 C THR A 65 -3.946 10.383 -9.710 1.00 0.00 C ATOM 934 O THR A 65 -4.939 9.733 -9.387 1.00 0.00 O ATOM 935 CB THR A 65 -3.701 9.740 -12.174 1.00 0.00 C ATOM 936 OG1 THR A 65 -2.625 9.740 -13.108 1.00 0.00 O ATOM 937 CG2 THR A 65 -4.517 10.980 -12.546 1.00 0.00 C ATOM 0 H THR A 65 -2.778 7.808 -11.039 1.00 0.00 H new ATOM 0 HA THR A 65 -2.231 10.631 -10.905 1.00 0.00 H new ATOM 0 HB THR A 65 -4.352 8.866 -12.165 1.00 0.00 H new ATOM 0 HG1 THR A 65 -2.981 9.652 -14.017 1.00 0.00 H new ATOM 0 HG21 THR A 65 -4.984 10.830 -13.520 1.00 0.00 H new ATOM 0 HG22 THR A 65 -5.289 11.146 -11.795 1.00 0.00 H new ATOM 0 HG23 THR A 65 -3.860 11.849 -12.589 1.00 0.00 H new ATOM 945 N VAL A 66 -3.593 11.536 -9.163 1.00 0.00 N ATOM 946 CA VAL A 66 -4.385 12.135 -8.102 1.00 0.00 C ATOM 947 C VAL A 66 -5.182 13.311 -8.670 1.00 0.00 C ATOM 948 O VAL A 66 -4.673 14.073 -9.490 1.00 0.00 O ATOM 949 CB VAL A 66 -3.481 12.534 -6.934 1.00 0.00 C ATOM 950 CG1 VAL A 66 -4.279 13.248 -5.842 1.00 0.00 C ATOM 951 CG2 VAL A 66 -2.746 11.317 -6.370 1.00 0.00 C ATOM 0 H VAL A 66 -2.769 12.072 -9.434 1.00 0.00 H new ATOM 0 HA VAL A 66 -5.102 11.415 -7.708 1.00 0.00 H new ATOM 0 HB VAL A 66 -2.733 13.231 -7.312 1.00 0.00 H new ATOM 0 HG11 VAL A 66 -3.613 13.521 -5.024 1.00 0.00 H new ATOM 0 HG12 VAL A 66 -4.735 14.148 -6.254 1.00 0.00 H new ATOM 0 HG13 VAL A 66 -5.059 12.585 -5.469 1.00 0.00 H new ATOM 0 HG21 VAL A 66 -2.110 11.628 -5.541 1.00 0.00 H new ATOM 0 HG22 VAL A 66 -3.472 10.585 -6.016 1.00 0.00 H new ATOM 0 HG23 VAL A 66 -2.131 10.869 -7.151 1.00 0.00 H new ATOM 961 N SER A 67 -6.420 13.423 -8.210 1.00 0.00 N ATOM 962 CA SER A 67 -7.292 14.493 -8.661 1.00 0.00 C ATOM 963 C SER A 67 -8.339 14.803 -7.589 1.00 0.00 C ATOM 964 O SER A 67 -8.303 15.865 -6.970 1.00 0.00 O ATOM 965 CB SER A 67 -7.976 14.127 -9.980 1.00 0.00 C ATOM 966 OG SER A 67 -8.414 15.281 -10.692 1.00 0.00 O ATOM 0 H SER A 67 -6.839 12.790 -7.529 1.00 0.00 H new ATOM 0 HA SER A 67 -6.683 15.381 -8.832 1.00 0.00 H new ATOM 0 HB2 SER A 67 -7.284 13.558 -10.602 1.00 0.00 H new ATOM 0 HB3 SER A 67 -8.829 13.480 -9.778 1.00 0.00 H new ATOM 0 HG SER A 67 -8.844 15.006 -11.529 1.00 0.00 H new ATOM 972 N GLU A 68 -9.246 13.856 -7.402 1.00 0.00 N ATOM 973 CA GLU A 68 -10.301 14.014 -6.415 1.00 0.00 C ATOM 974 C GLU A 68 -10.743 12.648 -5.887 1.00 0.00 C ATOM 975 O GLU A 68 -10.781 11.672 -6.635 1.00 0.00 O ATOM 976 CB GLU A 68 -11.486 14.787 -6.998 1.00 0.00 C ATOM 977 CG GLU A 68 -12.442 13.848 -7.737 1.00 0.00 C ATOM 978 CD GLU A 68 -13.557 14.635 -8.428 1.00 0.00 C ATOM 979 OE1 GLU A 68 -13.283 15.159 -9.530 1.00 0.00 O ATOM 980 OE2 GLU A 68 -14.658 14.696 -7.839 1.00 0.00 O ATOM 0 H GLU A 68 -9.272 12.976 -7.917 1.00 0.00 H new ATOM 0 HA GLU A 68 -9.907 14.594 -5.580 1.00 0.00 H new ATOM 0 HB2 GLU A 68 -12.020 15.299 -6.198 1.00 0.00 H new ATOM 0 HB3 GLU A 68 -11.123 15.555 -7.682 1.00 0.00 H new ATOM 0 HG2 GLU A 68 -11.889 13.268 -8.476 1.00 0.00 H new ATOM 0 HG3 GLU A 68 -12.876 13.137 -7.034 1.00 0.00 H new ATOM 987 N GLY A 69 -11.067 12.622 -4.602 1.00 0.00 N ATOM 988 CA GLY A 69 -11.505 11.392 -3.966 1.00 0.00 C ATOM 989 C GLY A 69 -10.312 10.595 -3.433 1.00 0.00 C ATOM 990 O GLY A 69 -10.372 10.040 -2.337 1.00 0.00 O ATOM 0 H GLY A 69 -11.035 13.433 -3.985 1.00 0.00 H new ATOM 0 HA2 GLY A 69 -12.187 11.624 -3.148 1.00 0.00 H new ATOM 0 HA3 GLY A 69 -12.061 10.786 -4.682 1.00 0.00 H new ATOM 994 N THR A 70 -9.257 10.565 -4.233 1.00 0.00 N ATOM 995 CA THR A 70 -8.052 9.846 -3.855 1.00 0.00 C ATOM 996 C THR A 70 -7.352 10.551 -2.692 1.00 0.00 C ATOM 997 O THR A 70 -6.491 11.403 -2.905 1.00 0.00 O ATOM 998 CB THR A 70 -7.173 9.710 -5.100 1.00 0.00 C ATOM 999 OG1 THR A 70 -8.082 9.318 -6.126 1.00 0.00 O ATOM 1000 CG2 THR A 70 -6.195 8.538 -5.001 1.00 0.00 C ATOM 0 H THR A 70 -9.211 11.027 -5.141 1.00 0.00 H new ATOM 0 HA THR A 70 -8.286 8.845 -3.493 1.00 0.00 H new ATOM 0 HB THR A 70 -6.617 10.635 -5.254 1.00 0.00 H new ATOM 0 HG1 THR A 70 -7.596 9.209 -6.970 1.00 0.00 H new ATOM 0 HG21 THR A 70 -5.596 8.486 -5.910 1.00 0.00 H new ATOM 0 HG22 THR A 70 -5.540 8.682 -4.142 1.00 0.00 H new ATOM 0 HG23 THR A 70 -6.752 7.609 -4.880 1.00 0.00 H new ATOM 1008 N THR A 71 -7.749 10.170 -1.486 1.00 0.00 N ATOM 1009 CA THR A 71 -7.170 10.755 -0.288 1.00 0.00 C ATOM 1010 C THR A 71 -6.408 9.695 0.508 1.00 0.00 C ATOM 1011 O THR A 71 -5.621 10.025 1.394 1.00 0.00 O ATOM 1012 CB THR A 71 -8.298 11.417 0.506 1.00 0.00 C ATOM 1013 OG1 THR A 71 -9.373 10.486 0.426 1.00 0.00 O ATOM 1014 CG2 THR A 71 -8.840 12.672 -0.182 1.00 0.00 C ATOM 0 H THR A 71 -8.464 9.464 -1.313 1.00 0.00 H new ATOM 0 HA THR A 71 -6.435 11.520 -0.536 1.00 0.00 H new ATOM 0 HB THR A 71 -7.937 11.676 1.501 1.00 0.00 H new ATOM 0 HG1 THR A 71 -10.146 10.836 0.916 1.00 0.00 H new ATOM 0 HG21 THR A 71 -9.638 13.103 0.423 1.00 0.00 H new ATOM 0 HG22 THR A 71 -8.037 13.400 -0.295 1.00 0.00 H new ATOM 0 HG23 THR A 71 -9.231 12.408 -1.164 1.00 0.00 H new ATOM 1022 N GLU A 72 -6.667 8.442 0.164 1.00 0.00 N ATOM 1023 CA GLU A 72 -6.015 7.331 0.836 1.00 0.00 C ATOM 1024 C GLU A 72 -5.758 6.190 -0.151 1.00 0.00 C ATOM 1025 O GLU A 72 -6.395 6.118 -1.201 1.00 0.00 O ATOM 1026 CB GLU A 72 -6.843 6.849 2.029 1.00 0.00 C ATOM 1027 CG GLU A 72 -7.887 5.819 1.591 1.00 0.00 C ATOM 1028 CD GLU A 72 -9.224 6.062 2.294 1.00 0.00 C ATOM 1029 OE1 GLU A 72 -9.763 7.177 2.121 1.00 0.00 O ATOM 1030 OE2 GLU A 72 -9.678 5.127 2.988 1.00 0.00 O ATOM 0 H GLU A 72 -7.320 8.172 -0.572 1.00 0.00 H new ATOM 0 HA GLU A 72 -5.055 7.677 1.219 1.00 0.00 H new ATOM 0 HB2 GLU A 72 -6.185 6.409 2.779 1.00 0.00 H new ATOM 0 HB3 GLU A 72 -7.339 7.698 2.499 1.00 0.00 H new ATOM 0 HG2 GLU A 72 -8.025 5.872 0.511 1.00 0.00 H new ATOM 0 HG3 GLU A 72 -7.530 4.814 1.818 1.00 0.00 H new ATOM 1037 N LEU A 73 -4.825 5.327 0.222 1.00 0.00 N ATOM 1038 CA LEU A 73 -4.477 4.193 -0.617 1.00 0.00 C ATOM 1039 C LEU A 73 -4.850 2.896 0.104 1.00 0.00 C ATOM 1040 O LEU A 73 -4.746 2.810 1.327 1.00 0.00 O ATOM 1041 CB LEU A 73 -3.006 4.265 -1.032 1.00 0.00 C ATOM 1042 CG LEU A 73 -2.520 3.161 -1.974 1.00 0.00 C ATOM 1043 CD1 LEU A 73 -2.959 3.435 -3.413 1.00 0.00 C ATOM 1044 CD2 LEU A 73 -1.005 2.973 -1.862 1.00 0.00 C ATOM 0 H LEU A 73 -4.299 5.390 1.094 1.00 0.00 H new ATOM 0 HA LEU A 73 -5.048 4.217 -1.545 1.00 0.00 H new ATOM 0 HB2 LEU A 73 -2.831 5.228 -1.512 1.00 0.00 H new ATOM 0 HB3 LEU A 73 -2.393 4.242 -0.131 1.00 0.00 H new ATOM 0 HG LEU A 73 -2.984 2.223 -1.670 1.00 0.00 H new ATOM 0 HD11 LEU A 73 -2.601 2.635 -4.061 1.00 0.00 H new ATOM 0 HD12 LEU A 73 -4.047 3.479 -3.459 1.00 0.00 H new ATOM 0 HD13 LEU A 73 -2.543 4.386 -3.746 1.00 0.00 H new ATOM 0 HD21 LEU A 73 -0.685 2.183 -2.541 1.00 0.00 H new ATOM 0 HD22 LEU A 73 -0.502 3.904 -2.125 1.00 0.00 H new ATOM 0 HD23 LEU A 73 -0.747 2.698 -0.839 1.00 0.00 H new ATOM 1056 N LYS A 74 -5.275 1.919 -0.683 1.00 0.00 N ATOM 1057 CA LYS A 74 -5.664 0.631 -0.135 1.00 0.00 C ATOM 1058 C LYS A 74 -4.644 -0.427 -0.559 1.00 0.00 C ATOM 1059 O LYS A 74 -4.373 -0.593 -1.747 1.00 0.00 O ATOM 1060 CB LYS A 74 -7.103 0.292 -0.530 1.00 0.00 C ATOM 1061 CG LYS A 74 -8.086 0.715 0.563 1.00 0.00 C ATOM 1062 CD LYS A 74 -8.011 2.223 0.814 1.00 0.00 C ATOM 1063 CE LYS A 74 -9.379 2.879 0.618 1.00 0.00 C ATOM 1064 NZ LYS A 74 -9.428 3.601 -0.673 1.00 0.00 N ATOM 0 H LYS A 74 -5.359 1.994 -1.697 1.00 0.00 H new ATOM 0 HA LYS A 74 -5.657 0.663 0.955 1.00 0.00 H new ATOM 0 HB2 LYS A 74 -7.355 0.793 -1.464 1.00 0.00 H new ATOM 0 HB3 LYS A 74 -7.192 -0.780 -0.709 1.00 0.00 H new ATOM 0 HG2 LYS A 74 -9.100 0.441 0.271 1.00 0.00 H new ATOM 0 HG3 LYS A 74 -7.864 0.178 1.485 1.00 0.00 H new ATOM 0 HD2 LYS A 74 -7.656 2.410 1.828 1.00 0.00 H new ATOM 0 HD3 LYS A 74 -7.287 2.673 0.135 1.00 0.00 H new ATOM 0 HE2 LYS A 74 -10.160 2.120 0.646 1.00 0.00 H new ATOM 0 HE3 LYS A 74 -9.577 3.571 1.436 1.00 0.00 H new ATOM 0 HZ1 LYS A 74 -10.284 4.190 -0.709 1.00 0.00 H new ATOM 0 HZ2 LYS A 74 -8.587 4.206 -0.764 1.00 0.00 H new ATOM 0 HZ3 LYS A 74 -9.447 2.915 -1.454 1.00 0.00 H new ATOM 1078 N ALA A 75 -4.106 -1.117 0.436 1.00 0.00 N ATOM 1079 CA ALA A 75 -3.122 -2.155 0.181 1.00 0.00 C ATOM 1080 C ALA A 75 -3.557 -3.447 0.877 1.00 0.00 C ATOM 1081 O ALA A 75 -3.478 -3.554 2.100 1.00 0.00 O ATOM 1082 CB ALA A 75 -1.745 -1.678 0.646 1.00 0.00 C ATOM 0 H ALA A 75 -4.333 -0.977 1.421 1.00 0.00 H new ATOM 0 HA ALA A 75 -3.052 -2.363 -0.887 1.00 0.00 H new ATOM 0 HB1 ALA A 75 -1.007 -2.457 0.455 1.00 0.00 H new ATOM 0 HB2 ALA A 75 -1.470 -0.775 0.101 1.00 0.00 H new ATOM 0 HB3 ALA A 75 -1.776 -1.462 1.714 1.00 0.00 H new ATOM 1088 N LYS A 76 -4.007 -4.394 0.068 1.00 0.00 N ATOM 1089 CA LYS A 76 -4.455 -5.674 0.591 1.00 0.00 C ATOM 1090 C LYS A 76 -3.407 -6.743 0.277 1.00 0.00 C ATOM 1091 O LYS A 76 -3.013 -6.912 -0.876 1.00 0.00 O ATOM 1092 CB LYS A 76 -5.852 -6.009 0.063 1.00 0.00 C ATOM 1093 CG LYS A 76 -6.935 -5.387 0.947 1.00 0.00 C ATOM 1094 CD LYS A 76 -8.312 -5.965 0.614 1.00 0.00 C ATOM 1095 CE LYS A 76 -9.165 -6.111 1.876 1.00 0.00 C ATOM 1096 NZ LYS A 76 -10.395 -5.295 1.769 1.00 0.00 N ATOM 0 H LYS A 76 -4.071 -4.301 -0.946 1.00 0.00 H new ATOM 0 HA LYS A 76 -4.551 -5.630 1.676 1.00 0.00 H new ATOM 0 HB2 LYS A 76 -5.956 -5.643 -0.958 1.00 0.00 H new ATOM 0 HB3 LYS A 76 -5.982 -7.091 0.029 1.00 0.00 H new ATOM 0 HG2 LYS A 76 -6.703 -5.571 1.996 1.00 0.00 H new ATOM 0 HG3 LYS A 76 -6.947 -4.306 0.808 1.00 0.00 H new ATOM 0 HD2 LYS A 76 -8.820 -5.316 -0.100 1.00 0.00 H new ATOM 0 HD3 LYS A 76 -8.196 -6.937 0.135 1.00 0.00 H new ATOM 0 HE2 LYS A 76 -9.428 -7.158 2.025 1.00 0.00 H new ATOM 0 HE3 LYS A 76 -8.590 -5.800 2.748 1.00 0.00 H new ATOM 0 HZ1 LYS A 76 -10.962 -5.406 2.634 1.00 0.00 H new ATOM 0 HZ2 LYS A 76 -10.138 -4.294 1.649 1.00 0.00 H new ATOM 0 HZ3 LYS A 76 -10.951 -5.610 0.948 1.00 0.00 H new ATOM 1110 N ILE A 77 -2.985 -7.438 1.323 1.00 0.00 N ATOM 1111 CA ILE A 77 -1.990 -8.486 1.174 1.00 0.00 C ATOM 1112 C ILE A 77 -2.684 -9.788 0.768 1.00 0.00 C ATOM 1113 O ILE A 77 -3.778 -10.087 1.244 1.00 0.00 O ATOM 1114 CB ILE A 77 -1.146 -8.609 2.444 1.00 0.00 C ATOM 1115 CG1 ILE A 77 -0.422 -7.297 2.750 1.00 0.00 C ATOM 1116 CG2 ILE A 77 -0.178 -9.789 2.347 1.00 0.00 C ATOM 1117 CD1 ILE A 77 -1.335 -6.329 3.506 1.00 0.00 C ATOM 0 H ILE A 77 -3.314 -7.296 2.278 1.00 0.00 H new ATOM 0 HA ILE A 77 -1.290 -8.235 0.377 1.00 0.00 H new ATOM 0 HB ILE A 77 -1.815 -8.810 3.281 1.00 0.00 H new ATOM 0 HG12 ILE A 77 0.470 -7.500 3.343 1.00 0.00 H new ATOM 0 HG13 ILE A 77 -0.088 -6.836 1.820 1.00 0.00 H new ATOM 0 HG21 ILE A 77 0.410 -9.854 3.263 1.00 0.00 H new ATOM 0 HG22 ILE A 77 -0.742 -10.712 2.212 1.00 0.00 H new ATOM 0 HG23 ILE A 77 0.489 -9.644 1.497 1.00 0.00 H new ATOM 0 HD11 ILE A 77 -0.795 -5.404 3.711 1.00 0.00 H new ATOM 0 HD12 ILE A 77 -2.214 -6.109 2.900 1.00 0.00 H new ATOM 0 HD13 ILE A 77 -1.647 -6.783 4.447 1.00 0.00 H new ATOM 1129 N PHE A 78 -2.019 -10.527 -0.108 1.00 0.00 N ATOM 1130 CA PHE A 78 -2.558 -11.790 -0.583 1.00 0.00 C ATOM 1131 C PHE A 78 -1.450 -12.833 -0.746 1.00 0.00 C ATOM 1132 O PHE A 78 -0.314 -12.607 -0.331 1.00 0.00 O ATOM 1133 CB PHE A 78 -3.193 -11.520 -1.948 1.00 0.00 C ATOM 1134 CG PHE A 78 -4.465 -10.672 -1.886 1.00 0.00 C ATOM 1135 CD1 PHE A 78 -4.380 -9.315 -1.909 1.00 0.00 C ATOM 1136 CD2 PHE A 78 -5.681 -11.276 -1.807 1.00 0.00 C ATOM 1137 CE1 PHE A 78 -5.560 -8.528 -1.851 1.00 0.00 C ATOM 1138 CE2 PHE A 78 -6.862 -10.489 -1.749 1.00 0.00 C ATOM 1139 CZ PHE A 78 -6.777 -9.132 -1.773 1.00 0.00 C ATOM 0 H PHE A 78 -1.112 -10.275 -0.501 1.00 0.00 H new ATOM 0 HA PHE A 78 -3.282 -12.178 0.133 1.00 0.00 H new ATOM 0 HB2 PHE A 78 -2.464 -11.017 -2.583 1.00 0.00 H new ATOM 0 HB3 PHE A 78 -3.427 -12.473 -2.423 1.00 0.00 H new ATOM 0 HD1 PHE A 78 -3.414 -8.836 -1.971 1.00 0.00 H new ATOM 0 HD2 PHE A 78 -5.749 -12.354 -1.788 1.00 0.00 H new ATOM 0 HE1 PHE A 78 -5.492 -7.450 -1.869 1.00 0.00 H new ATOM 0 HE2 PHE A 78 -7.828 -10.968 -1.686 1.00 0.00 H new ATOM 0 HZ PHE A 78 -7.675 -8.534 -1.730 1.00 0.00 H new ATOM 1149 N ASP A 79 -1.819 -13.951 -1.353 1.00 0.00 N ATOM 1150 CA ASP A 79 -0.870 -15.029 -1.576 1.00 0.00 C ATOM 1151 C ASP A 79 -0.969 -15.496 -3.030 1.00 0.00 C ATOM 1152 O ASP A 79 -2.063 -15.574 -3.588 1.00 0.00 O ATOM 1153 CB ASP A 79 -1.174 -16.226 -0.673 1.00 0.00 C ATOM 1154 CG ASP A 79 -0.046 -16.617 0.284 1.00 0.00 C ATOM 1155 OD1 ASP A 79 1.074 -16.100 0.082 1.00 0.00 O ATOM 1156 OD2 ASP A 79 -0.330 -17.424 1.196 1.00 0.00 O ATOM 0 H ASP A 79 -2.762 -14.134 -1.697 1.00 0.00 H new ATOM 0 HA ASP A 79 0.128 -14.652 -1.351 1.00 0.00 H new ATOM 0 HB2 ASP A 79 -2.066 -16.003 -0.087 1.00 0.00 H new ATOM 0 HB3 ASP A 79 -1.411 -17.085 -1.301 1.00 0.00 H new ATOM 1161 N LYS A 80 0.188 -15.795 -3.602 1.00 0.00 N ATOM 1162 CA LYS A 80 0.246 -16.253 -4.980 1.00 0.00 C ATOM 1163 C LYS A 80 -0.885 -17.253 -5.228 1.00 0.00 C ATOM 1164 O LYS A 80 -1.499 -17.250 -6.294 1.00 0.00 O ATOM 1165 CB LYS A 80 1.636 -16.803 -5.304 1.00 0.00 C ATOM 1166 CG LYS A 80 1.556 -17.912 -6.355 1.00 0.00 C ATOM 1167 CD LYS A 80 2.919 -18.149 -7.007 1.00 0.00 C ATOM 1168 CE LYS A 80 2.923 -19.451 -7.810 1.00 0.00 C ATOM 1169 NZ LYS A 80 4.084 -19.490 -8.728 1.00 0.00 N ATOM 0 H LYS A 80 1.093 -15.729 -3.136 1.00 0.00 H new ATOM 0 HA LYS A 80 0.091 -15.420 -5.665 1.00 0.00 H new ATOM 0 HB2 LYS A 80 2.274 -15.998 -5.668 1.00 0.00 H new ATOM 0 HB3 LYS A 80 2.098 -17.190 -4.396 1.00 0.00 H new ATOM 0 HG2 LYS A 80 1.206 -18.834 -5.890 1.00 0.00 H new ATOM 0 HG3 LYS A 80 0.826 -17.643 -7.118 1.00 0.00 H new ATOM 0 HD2 LYS A 80 3.163 -17.313 -7.662 1.00 0.00 H new ATOM 0 HD3 LYS A 80 3.692 -18.189 -6.239 1.00 0.00 H new ATOM 0 HE2 LYS A 80 2.959 -20.303 -7.132 1.00 0.00 H new ATOM 0 HE3 LYS A 80 1.998 -19.536 -8.380 1.00 0.00 H new ATOM 0 HZ1 LYS A 80 4.072 -20.380 -9.266 1.00 0.00 H new ATOM 0 HZ2 LYS A 80 4.033 -18.687 -9.387 1.00 0.00 H new ATOM 0 HZ3 LYS A 80 4.964 -19.430 -8.177 1.00 0.00 H new ATOM 1183 N ASP A 81 -1.125 -18.086 -4.226 1.00 0.00 N ATOM 1184 CA ASP A 81 -2.171 -19.090 -4.323 1.00 0.00 C ATOM 1185 C ASP A 81 -3.354 -18.674 -3.446 1.00 0.00 C ATOM 1186 O ASP A 81 -3.597 -19.274 -2.400 1.00 0.00 O ATOM 1187 CB ASP A 81 -1.675 -20.452 -3.832 1.00 0.00 C ATOM 1188 CG ASP A 81 -1.156 -21.385 -4.928 1.00 0.00 C ATOM 1189 OD1 ASP A 81 -1.919 -21.605 -5.894 1.00 0.00 O ATOM 1190 OD2 ASP A 81 -0.009 -21.857 -4.776 1.00 0.00 O ATOM 0 H ASP A 81 -0.613 -18.086 -3.344 1.00 0.00 H new ATOM 0 HA ASP A 81 -2.466 -19.169 -5.369 1.00 0.00 H new ATOM 0 HB2 ASP A 81 -0.879 -20.291 -3.105 1.00 0.00 H new ATOM 0 HB3 ASP A 81 -2.490 -20.951 -3.307 1.00 0.00 H new ATOM 1195 N VAL A 82 -4.058 -17.650 -3.905 1.00 0.00 N ATOM 1196 CA VAL A 82 -5.210 -17.147 -3.175 1.00 0.00 C ATOM 1197 C VAL A 82 -6.175 -16.476 -4.155 1.00 0.00 C ATOM 1198 O VAL A 82 -7.132 -17.099 -4.613 1.00 0.00 O ATOM 1199 CB VAL A 82 -4.751 -16.213 -2.054 1.00 0.00 C ATOM 1200 CG1 VAL A 82 -5.885 -15.284 -1.616 1.00 0.00 C ATOM 1201 CG2 VAL A 82 -4.205 -17.009 -0.866 1.00 0.00 C ATOM 0 H VAL A 82 -3.853 -17.155 -4.773 1.00 0.00 H new ATOM 0 HA VAL A 82 -5.748 -17.966 -2.698 1.00 0.00 H new ATOM 0 HB VAL A 82 -3.942 -15.595 -2.443 1.00 0.00 H new ATOM 0 HG11 VAL A 82 -5.532 -14.630 -0.818 1.00 0.00 H new ATOM 0 HG12 VAL A 82 -6.208 -14.680 -2.464 1.00 0.00 H new ATOM 0 HG13 VAL A 82 -6.723 -15.879 -1.254 1.00 0.00 H new ATOM 0 HG21 VAL A 82 -3.886 -16.321 -0.083 1.00 0.00 H new ATOM 0 HG22 VAL A 82 -4.985 -17.664 -0.478 1.00 0.00 H new ATOM 0 HG23 VAL A 82 -3.355 -17.610 -1.190 1.00 0.00 H new ATOM 1211 N GLY A 83 -5.891 -15.215 -4.446 1.00 0.00 N ATOM 1212 CA GLY A 83 -6.722 -14.453 -5.362 1.00 0.00 C ATOM 1213 C GLY A 83 -7.240 -13.175 -4.700 1.00 0.00 C ATOM 1214 O GLY A 83 -7.769 -13.218 -3.590 1.00 0.00 O ATOM 0 H GLY A 83 -5.097 -14.702 -4.063 1.00 0.00 H new ATOM 0 HA2 GLY A 83 -6.148 -14.198 -6.253 1.00 0.00 H new ATOM 0 HA3 GLY A 83 -7.563 -15.064 -5.689 1.00 0.00 H new ATOM 1218 N THR A 84 -7.070 -12.069 -5.408 1.00 0.00 N ATOM 1219 CA THR A 84 -7.513 -10.781 -4.902 1.00 0.00 C ATOM 1220 C THR A 84 -8.935 -10.887 -4.346 1.00 0.00 C ATOM 1221 O THR A 84 -9.314 -10.131 -3.452 1.00 0.00 O ATOM 1222 CB THR A 84 -7.378 -9.757 -6.031 1.00 0.00 C ATOM 1223 OG1 THR A 84 -7.997 -10.389 -7.148 1.00 0.00 O ATOM 1224 CG2 THR A 84 -5.926 -9.560 -6.471 1.00 0.00 C ATOM 0 H THR A 84 -6.631 -12.038 -6.328 1.00 0.00 H new ATOM 0 HA THR A 84 -6.894 -10.450 -4.068 1.00 0.00 H new ATOM 0 HB THR A 84 -7.792 -8.802 -5.707 1.00 0.00 H new ATOM 0 HG1 THR A 84 -7.956 -9.793 -7.925 1.00 0.00 H new ATOM 0 HG21 THR A 84 -5.886 -8.824 -7.274 1.00 0.00 H new ATOM 0 HG22 THR A 84 -5.334 -9.208 -5.626 1.00 0.00 H new ATOM 0 HG23 THR A 84 -5.522 -10.508 -6.827 1.00 0.00 H new ATOM 1232 N GLU A 85 -9.682 -11.832 -4.897 1.00 0.00 N ATOM 1233 CA GLU A 85 -11.054 -12.047 -4.467 1.00 0.00 C ATOM 1234 C GLU A 85 -11.100 -13.078 -3.338 1.00 0.00 C ATOM 1235 O GLU A 85 -11.738 -12.851 -2.311 1.00 0.00 O ATOM 1236 CB GLU A 85 -11.935 -12.479 -5.641 1.00 0.00 C ATOM 1237 CG GLU A 85 -12.627 -11.273 -6.279 1.00 0.00 C ATOM 1238 CD GLU A 85 -14.053 -11.625 -6.711 1.00 0.00 C ATOM 1239 OE1 GLU A 85 -14.855 -11.948 -5.809 1.00 0.00 O ATOM 1240 OE2 GLU A 85 -14.308 -11.562 -7.933 1.00 0.00 O ATOM 0 H GLU A 85 -9.364 -12.458 -5.637 1.00 0.00 H new ATOM 0 HA GLU A 85 -11.448 -11.104 -4.088 1.00 0.00 H new ATOM 0 HB2 GLU A 85 -11.328 -12.991 -6.387 1.00 0.00 H new ATOM 0 HB3 GLU A 85 -12.684 -13.192 -5.296 1.00 0.00 H new ATOM 0 HG2 GLU A 85 -12.652 -10.446 -5.570 1.00 0.00 H new ATOM 0 HG3 GLU A 85 -12.054 -10.935 -7.143 1.00 0.00 H new ATOM 1247 N ASP A 86 -10.417 -14.190 -3.566 1.00 0.00 N ATOM 1248 CA ASP A 86 -10.372 -15.257 -2.581 1.00 0.00 C ATOM 1249 C ASP A 86 -10.388 -14.649 -1.177 1.00 0.00 C ATOM 1250 O ASP A 86 -11.400 -14.710 -0.481 1.00 0.00 O ATOM 1251 CB ASP A 86 -9.094 -16.085 -2.723 1.00 0.00 C ATOM 1252 CG ASP A 86 -8.869 -17.123 -1.621 1.00 0.00 C ATOM 1253 OD1 ASP A 86 -9.056 -16.749 -0.443 1.00 0.00 O ATOM 1254 OD2 ASP A 86 -8.516 -18.266 -1.982 1.00 0.00 O ATOM 0 H ASP A 86 -9.890 -14.375 -4.419 1.00 0.00 H new ATOM 0 HA ASP A 86 -11.237 -15.900 -2.741 1.00 0.00 H new ATOM 0 HB2 ASP A 86 -9.116 -16.597 -3.685 1.00 0.00 H new ATOM 0 HB3 ASP A 86 -8.240 -15.407 -2.743 1.00 0.00 H new ATOM 1259 N ASP A 87 -9.253 -14.077 -0.802 1.00 0.00 N ATOM 1260 CA ASP A 87 -9.123 -13.459 0.507 1.00 0.00 C ATOM 1261 C ASP A 87 -7.763 -12.766 0.606 1.00 0.00 C ATOM 1262 O ASP A 87 -6.825 -13.126 -0.103 1.00 0.00 O ATOM 1263 CB ASP A 87 -9.202 -14.505 1.620 1.00 0.00 C ATOM 1264 CG ASP A 87 -9.077 -13.949 3.040 1.00 0.00 C ATOM 1265 OD1 ASP A 87 -10.032 -13.265 3.468 1.00 0.00 O ATOM 1266 OD2 ASP A 87 -8.029 -14.220 3.666 1.00 0.00 O ATOM 0 H ASP A 87 -8.415 -14.029 -1.382 1.00 0.00 H new ATOM 0 HA ASP A 87 -9.938 -12.744 0.625 1.00 0.00 H new ATOM 0 HB2 ASP A 87 -10.152 -15.033 1.535 1.00 0.00 H new ATOM 0 HB3 ASP A 87 -8.413 -15.241 1.463 1.00 0.00 H new ATOM 1271 N ALA A 88 -7.699 -11.783 1.492 1.00 0.00 N ATOM 1272 CA ALA A 88 -6.469 -11.035 1.693 1.00 0.00 C ATOM 1273 C ALA A 88 -5.889 -11.377 3.067 1.00 0.00 C ATOM 1274 O ALA A 88 -6.517 -11.118 4.092 1.00 0.00 O ATOM 1275 CB ALA A 88 -6.748 -9.540 1.533 1.00 0.00 C ATOM 0 H ALA A 88 -8.479 -11.487 2.079 1.00 0.00 H new ATOM 0 HA ALA A 88 -5.726 -11.309 0.944 1.00 0.00 H new ATOM 0 HB1 ALA A 88 -5.825 -8.980 1.684 1.00 0.00 H new ATOM 0 HB2 ALA A 88 -7.130 -9.346 0.531 1.00 0.00 H new ATOM 0 HB3 ALA A 88 -7.487 -9.227 2.270 1.00 0.00 H new ATOM 1281 N VAL A 89 -4.696 -11.953 3.043 1.00 0.00 N ATOM 1282 CA VAL A 89 -4.024 -12.333 4.274 1.00 0.00 C ATOM 1283 C VAL A 89 -4.054 -11.155 5.251 1.00 0.00 C ATOM 1284 O VAL A 89 -3.988 -11.348 6.464 1.00 0.00 O ATOM 1285 CB VAL A 89 -2.606 -12.819 3.968 1.00 0.00 C ATOM 1286 CG1 VAL A 89 -2.609 -14.290 3.548 1.00 0.00 C ATOM 1287 CG2 VAL A 89 -1.945 -11.945 2.900 1.00 0.00 C ATOM 0 H VAL A 89 -4.178 -12.166 2.191 1.00 0.00 H new ATOM 0 HA VAL A 89 -4.543 -13.165 4.751 1.00 0.00 H new ATOM 0 HB VAL A 89 -2.018 -12.733 4.882 1.00 0.00 H new ATOM 0 HG11 VAL A 89 -1.589 -14.610 3.336 1.00 0.00 H new ATOM 0 HG12 VAL A 89 -3.020 -14.898 4.354 1.00 0.00 H new ATOM 0 HG13 VAL A 89 -3.220 -14.412 2.654 1.00 0.00 H new ATOM 0 HG21 VAL A 89 -0.938 -12.312 2.701 1.00 0.00 H new ATOM 0 HG22 VAL A 89 -2.533 -11.984 1.983 1.00 0.00 H new ATOM 0 HG23 VAL A 89 -1.892 -10.915 3.254 1.00 0.00 H new ATOM 1297 N GLY A 90 -4.154 -9.961 4.685 1.00 0.00 N ATOM 1298 CA GLY A 90 -4.194 -8.753 5.491 1.00 0.00 C ATOM 1299 C GLY A 90 -4.383 -7.514 4.613 1.00 0.00 C ATOM 1300 O GLY A 90 -4.477 -7.624 3.391 1.00 0.00 O ATOM 0 H GLY A 90 -4.208 -9.805 3.679 1.00 0.00 H new ATOM 0 HA2 GLY A 90 -5.008 -8.820 6.212 1.00 0.00 H new ATOM 0 HA3 GLY A 90 -3.270 -8.661 6.061 1.00 0.00 H new ATOM 1304 N GLU A 91 -4.432 -6.364 5.269 1.00 0.00 N ATOM 1305 CA GLU A 91 -4.608 -5.107 4.563 1.00 0.00 C ATOM 1306 C GLU A 91 -4.053 -3.949 5.395 1.00 0.00 C ATOM 1307 O GLU A 91 -3.766 -4.113 6.580 1.00 0.00 O ATOM 1308 CB GLU A 91 -6.079 -4.875 4.214 1.00 0.00 C ATOM 1309 CG GLU A 91 -6.831 -4.251 5.392 1.00 0.00 C ATOM 1310 CD GLU A 91 -6.916 -2.731 5.246 1.00 0.00 C ATOM 1311 OE1 GLU A 91 -7.377 -2.289 4.171 1.00 0.00 O ATOM 1312 OE2 GLU A 91 -6.518 -2.044 6.212 1.00 0.00 O ATOM 0 H GLU A 91 -4.353 -6.277 6.282 1.00 0.00 H new ATOM 0 HA GLU A 91 -4.051 -5.157 3.628 1.00 0.00 H new ATOM 0 HB2 GLU A 91 -6.151 -4.221 3.345 1.00 0.00 H new ATOM 0 HB3 GLU A 91 -6.545 -5.822 3.941 1.00 0.00 H new ATOM 0 HG2 GLU A 91 -7.835 -4.671 5.450 1.00 0.00 H new ATOM 0 HG3 GLU A 91 -6.326 -4.502 6.325 1.00 0.00 H new ATOM 1319 N ALA A 92 -3.917 -2.804 4.742 1.00 0.00 N ATOM 1320 CA ALA A 92 -3.401 -1.620 5.407 1.00 0.00 C ATOM 1321 C ALA A 92 -3.947 -0.371 4.710 1.00 0.00 C ATOM 1322 O ALA A 92 -4.106 -0.356 3.491 1.00 0.00 O ATOM 1323 CB ALA A 92 -1.872 -1.663 5.413 1.00 0.00 C ATOM 0 H ALA A 92 -4.155 -2.671 3.759 1.00 0.00 H new ATOM 0 HA ALA A 92 -3.730 -1.589 6.446 1.00 0.00 H new ATOM 0 HB1 ALA A 92 -1.485 -0.775 5.912 1.00 0.00 H new ATOM 0 HB2 ALA A 92 -1.535 -2.553 5.944 1.00 0.00 H new ATOM 0 HB3 ALA A 92 -1.505 -1.692 4.387 1.00 0.00 H new ATOM 1329 N THR A 93 -4.217 0.646 5.515 1.00 0.00 N ATOM 1330 CA THR A 93 -4.741 1.896 4.991 1.00 0.00 C ATOM 1331 C THR A 93 -3.644 2.962 4.958 1.00 0.00 C ATOM 1332 O THR A 93 -3.162 3.395 6.004 1.00 0.00 O ATOM 1333 CB THR A 93 -5.950 2.295 5.840 1.00 0.00 C ATOM 1334 OG1 THR A 93 -6.938 1.320 5.516 1.00 0.00 O ATOM 1335 CG2 THR A 93 -6.571 3.618 5.389 1.00 0.00 C ATOM 0 H THR A 93 -4.083 0.630 6.526 1.00 0.00 H new ATOM 0 HA THR A 93 -5.073 1.784 3.959 1.00 0.00 H new ATOM 0 HB THR A 93 -5.650 2.372 6.885 1.00 0.00 H new ATOM 0 HG1 THR A 93 -7.756 1.502 6.024 1.00 0.00 H new ATOM 0 HG21 THR A 93 -7.425 3.855 6.024 1.00 0.00 H new ATOM 0 HG22 THR A 93 -5.830 4.413 5.467 1.00 0.00 H new ATOM 0 HG23 THR A 93 -6.902 3.530 4.354 1.00 0.00 H new ATOM 1343 N ILE A 94 -3.281 3.355 3.746 1.00 0.00 N ATOM 1344 CA ILE A 94 -2.249 4.362 3.563 1.00 0.00 C ATOM 1345 C ILE A 94 -2.893 5.662 3.077 1.00 0.00 C ATOM 1346 O ILE A 94 -3.215 5.796 1.897 1.00 0.00 O ATOM 1347 CB ILE A 94 -1.147 3.838 2.640 1.00 0.00 C ATOM 1348 CG1 ILE A 94 -0.487 2.589 3.228 1.00 0.00 C ATOM 1349 CG2 ILE A 94 -0.126 4.934 2.329 1.00 0.00 C ATOM 1350 CD1 ILE A 94 -0.535 1.425 2.236 1.00 0.00 C ATOM 0 H ILE A 94 -3.683 2.994 2.881 1.00 0.00 H new ATOM 0 HA ILE A 94 -1.759 4.583 4.511 1.00 0.00 H new ATOM 0 HB ILE A 94 -1.603 3.545 1.694 1.00 0.00 H new ATOM 0 HG12 ILE A 94 0.549 2.808 3.487 1.00 0.00 H new ATOM 0 HG13 ILE A 94 -0.993 2.306 4.151 1.00 0.00 H new ATOM 0 HG21 ILE A 94 0.647 4.536 1.671 1.00 0.00 H new ATOM 0 HG22 ILE A 94 -0.626 5.768 1.837 1.00 0.00 H new ATOM 0 HG23 ILE A 94 0.330 5.280 3.256 1.00 0.00 H new ATOM 0 HD11 ILE A 94 -0.059 0.550 2.679 1.00 0.00 H new ATOM 0 HD12 ILE A 94 -1.573 1.192 1.998 1.00 0.00 H new ATOM 0 HD13 ILE A 94 -0.007 1.702 1.324 1.00 0.00 H new ATOM 1362 N PRO A 95 -3.065 6.611 4.035 1.00 0.00 N ATOM 1363 CA PRO A 95 -3.664 7.896 3.717 1.00 0.00 C ATOM 1364 C PRO A 95 -2.677 8.789 2.961 1.00 0.00 C ATOM 1365 O PRO A 95 -1.490 8.818 3.281 1.00 0.00 O ATOM 1366 CB PRO A 95 -4.084 8.477 5.057 1.00 0.00 C ATOM 1367 CG PRO A 95 -3.293 7.716 6.108 1.00 0.00 C ATOM 1368 CD PRO A 95 -2.695 6.487 5.442 1.00 0.00 C ATOM 0 HA PRO A 95 -4.522 7.807 3.050 1.00 0.00 H new ATOM 0 HB2 PRO A 95 -3.870 9.545 5.104 1.00 0.00 H new ATOM 0 HB3 PRO A 95 -5.156 8.360 5.215 1.00 0.00 H new ATOM 0 HG2 PRO A 95 -2.506 8.346 6.524 1.00 0.00 H new ATOM 0 HG3 PRO A 95 -3.940 7.425 6.936 1.00 0.00 H new ATOM 0 HD2 PRO A 95 -1.612 6.457 5.566 1.00 0.00 H new ATOM 0 HD3 PRO A 95 -3.091 5.569 5.876 1.00 0.00 H new ATOM 1376 N LEU A 96 -3.206 9.495 1.972 1.00 0.00 N ATOM 1377 CA LEU A 96 -2.387 10.386 1.168 1.00 0.00 C ATOM 1378 C LEU A 96 -2.558 11.821 1.670 1.00 0.00 C ATOM 1379 O LEU A 96 -2.116 12.767 1.019 1.00 0.00 O ATOM 1380 CB LEU A 96 -2.705 10.211 -0.318 1.00 0.00 C ATOM 1381 CG LEU A 96 -2.839 8.769 -0.811 1.00 0.00 C ATOM 1382 CD1 LEU A 96 -3.515 8.719 -2.183 1.00 0.00 C ATOM 1383 CD2 LEU A 96 -1.482 8.063 -0.814 1.00 0.00 C ATOM 0 H LEU A 96 -4.191 9.468 1.710 1.00 0.00 H new ATOM 0 HA LEU A 96 -1.332 10.135 1.275 1.00 0.00 H new ATOM 0 HB2 LEU A 96 -3.636 10.736 -0.534 1.00 0.00 H new ATOM 0 HB3 LEU A 96 -1.922 10.700 -0.897 1.00 0.00 H new ATOM 0 HG LEU A 96 -3.482 8.228 -0.116 1.00 0.00 H new ATOM 0 HD11 LEU A 96 -3.598 7.683 -2.510 1.00 0.00 H new ATOM 0 HD12 LEU A 96 -4.510 9.159 -2.115 1.00 0.00 H new ATOM 0 HD13 LEU A 96 -2.919 9.280 -2.903 1.00 0.00 H new ATOM 0 HD21 LEU A 96 -1.605 7.040 -1.169 1.00 0.00 H new ATOM 0 HD22 LEU A 96 -0.796 8.595 -1.473 1.00 0.00 H new ATOM 0 HD23 LEU A 96 -1.076 8.050 0.198 1.00 0.00 H new ATOM 1395 N GLU A 97 -3.201 11.938 2.822 1.00 0.00 N ATOM 1396 CA GLU A 97 -3.437 13.242 3.418 1.00 0.00 C ATOM 1397 C GLU A 97 -2.118 13.853 3.895 1.00 0.00 C ATOM 1398 O GLU A 97 -1.908 15.059 3.773 1.00 0.00 O ATOM 1399 CB GLU A 97 -4.443 13.146 4.567 1.00 0.00 C ATOM 1400 CG GLU A 97 -5.516 14.231 4.448 1.00 0.00 C ATOM 1401 CD GLU A 97 -6.468 14.193 5.644 1.00 0.00 C ATOM 1402 OE1 GLU A 97 -5.951 14.106 6.779 1.00 0.00 O ATOM 1403 OE2 GLU A 97 -7.692 14.254 5.397 1.00 0.00 O ATOM 0 H GLU A 97 -3.566 11.151 3.359 1.00 0.00 H new ATOM 0 HA GLU A 97 -3.865 13.895 2.658 1.00 0.00 H new ATOM 0 HB2 GLU A 97 -4.913 12.163 4.562 1.00 0.00 H new ATOM 0 HB3 GLU A 97 -3.923 13.246 5.520 1.00 0.00 H new ATOM 0 HG2 GLU A 97 -5.042 15.211 4.387 1.00 0.00 H new ATOM 0 HG3 GLU A 97 -6.079 14.091 3.525 1.00 0.00 H new ATOM 1410 N PRO A 98 -1.240 12.971 4.443 1.00 0.00 N ATOM 1411 CA PRO A 98 0.053 13.411 4.939 1.00 0.00 C ATOM 1412 C PRO A 98 1.013 13.703 3.784 1.00 0.00 C ATOM 1413 O PRO A 98 1.944 14.493 3.930 1.00 0.00 O ATOM 1414 CB PRO A 98 0.533 12.285 5.840 1.00 0.00 C ATOM 1415 CG PRO A 98 -0.284 11.064 5.453 1.00 0.00 C ATOM 1416 CD PRO A 98 -1.454 11.535 4.604 1.00 0.00 C ATOM 0 HA PRO A 98 -0.006 14.348 5.492 1.00 0.00 H new ATOM 0 HB2 PRO A 98 1.599 12.102 5.702 1.00 0.00 H new ATOM 0 HB3 PRO A 98 0.386 12.536 6.891 1.00 0.00 H new ATOM 0 HG2 PRO A 98 0.330 10.355 4.897 1.00 0.00 H new ATOM 0 HG3 PRO A 98 -0.642 10.547 6.343 1.00 0.00 H new ATOM 0 HD2 PRO A 98 -1.474 11.027 3.640 1.00 0.00 H new ATOM 0 HD3 PRO A 98 -2.406 11.329 5.093 1.00 0.00 H new ATOM 1424 N VAL A 99 0.753 13.048 2.661 1.00 0.00 N ATOM 1425 CA VAL A 99 1.583 13.227 1.482 1.00 0.00 C ATOM 1426 C VAL A 99 1.075 14.430 0.684 1.00 0.00 C ATOM 1427 O VAL A 99 1.691 14.831 -0.302 1.00 0.00 O ATOM 1428 CB VAL A 99 1.612 11.936 0.662 1.00 0.00 C ATOM 1429 CG1 VAL A 99 0.408 11.856 -0.279 1.00 0.00 C ATOM 1430 CG2 VAL A 99 2.924 11.809 -0.115 1.00 0.00 C ATOM 0 H VAL A 99 -0.020 12.393 2.543 1.00 0.00 H new ATOM 0 HA VAL A 99 2.613 13.438 1.769 1.00 0.00 H new ATOM 0 HB VAL A 99 1.551 11.098 1.356 1.00 0.00 H new ATOM 0 HG11 VAL A 99 0.453 10.929 -0.850 1.00 0.00 H new ATOM 0 HG12 VAL A 99 -0.512 11.878 0.305 1.00 0.00 H new ATOM 0 HG13 VAL A 99 0.424 12.704 -0.963 1.00 0.00 H new ATOM 0 HG21 VAL A 99 2.918 10.883 -0.689 1.00 0.00 H new ATOM 0 HG22 VAL A 99 3.029 12.656 -0.793 1.00 0.00 H new ATOM 0 HG23 VAL A 99 3.761 11.798 0.583 1.00 0.00 H new ATOM 1440 N PHE A 100 -0.044 14.973 1.141 1.00 0.00 N ATOM 1441 CA PHE A 100 -0.642 16.122 0.482 1.00 0.00 C ATOM 1442 C PHE A 100 -0.218 17.425 1.162 1.00 0.00 C ATOM 1443 O PHE A 100 -0.114 18.464 0.511 1.00 0.00 O ATOM 1444 CB PHE A 100 -2.159 15.967 0.603 1.00 0.00 C ATOM 1445 CG PHE A 100 -2.744 14.858 -0.273 1.00 0.00 C ATOM 1446 CD1 PHE A 100 -1.934 14.155 -1.111 1.00 0.00 C ATOM 1447 CD2 PHE A 100 -4.072 14.574 -0.215 1.00 0.00 C ATOM 1448 CE1 PHE A 100 -2.477 13.126 -1.924 1.00 0.00 C ATOM 1449 CE2 PHE A 100 -4.615 13.544 -1.028 1.00 0.00 C ATOM 1450 CZ PHE A 100 -3.806 12.842 -1.866 1.00 0.00 C ATOM 0 H PHE A 100 -0.552 14.639 1.960 1.00 0.00 H new ATOM 0 HA PHE A 100 -0.319 16.165 -0.558 1.00 0.00 H new ATOM 0 HB2 PHE A 100 -2.411 15.764 1.644 1.00 0.00 H new ATOM 0 HB3 PHE A 100 -2.633 16.912 0.338 1.00 0.00 H new ATOM 0 HD1 PHE A 100 -0.879 14.380 -1.157 1.00 0.00 H new ATOM 0 HD2 PHE A 100 -4.715 15.132 0.450 1.00 0.00 H new ATOM 0 HE1 PHE A 100 -1.835 12.568 -2.589 1.00 0.00 H new ATOM 0 HE2 PHE A 100 -5.670 13.318 -0.981 1.00 0.00 H new ATOM 0 HZ PHE A 100 -4.219 12.059 -2.485 1.00 0.00 H new ATOM 1460 N VAL A 101 0.015 17.328 2.463 1.00 0.00 N ATOM 1461 CA VAL A 101 0.426 18.487 3.238 1.00 0.00 C ATOM 1462 C VAL A 101 1.952 18.509 3.344 1.00 0.00 C ATOM 1463 O VAL A 101 2.558 19.578 3.393 1.00 0.00 O ATOM 1464 CB VAL A 101 -0.269 18.477 4.601 1.00 0.00 C ATOM 1465 CG1 VAL A 101 -1.699 17.946 4.484 1.00 0.00 C ATOM 1466 CG2 VAL A 101 0.535 17.666 5.620 1.00 0.00 C ATOM 0 H VAL A 101 -0.073 16.465 3.000 1.00 0.00 H new ATOM 0 HA VAL A 101 0.122 19.408 2.740 1.00 0.00 H new ATOM 0 HB VAL A 101 -0.322 19.506 4.957 1.00 0.00 H new ATOM 0 HG11 VAL A 101 -2.170 17.950 5.467 1.00 0.00 H new ATOM 0 HG12 VAL A 101 -2.269 18.582 3.806 1.00 0.00 H new ATOM 0 HG13 VAL A 101 -1.678 16.928 4.095 1.00 0.00 H new ATOM 0 HG21 VAL A 101 0.019 17.675 6.580 1.00 0.00 H new ATOM 0 HG22 VAL A 101 0.634 16.638 5.271 1.00 0.00 H new ATOM 0 HG23 VAL A 101 1.525 18.107 5.736 1.00 0.00 H new ATOM 1476 N GLU A 102 2.529 17.317 3.377 1.00 0.00 N ATOM 1477 CA GLU A 102 3.972 17.186 3.477 1.00 0.00 C ATOM 1478 C GLU A 102 4.608 17.243 2.086 1.00 0.00 C ATOM 1479 O GLU A 102 5.674 17.831 1.910 1.00 0.00 O ATOM 1480 CB GLU A 102 4.357 15.896 4.204 1.00 0.00 C ATOM 1481 CG GLU A 102 3.705 15.830 5.586 1.00 0.00 C ATOM 1482 CD GLU A 102 4.706 16.197 6.683 1.00 0.00 C ATOM 1483 OE1 GLU A 102 4.832 17.411 6.954 1.00 0.00 O ATOM 1484 OE2 GLU A 102 5.324 15.256 7.226 1.00 0.00 O ATOM 0 H GLU A 102 2.023 16.433 3.336 1.00 0.00 H new ATOM 0 HA GLU A 102 4.353 18.022 4.064 1.00 0.00 H new ATOM 0 HB2 GLU A 102 4.049 15.035 3.611 1.00 0.00 H new ATOM 0 HB3 GLU A 102 5.441 15.842 4.306 1.00 0.00 H new ATOM 0 HG2 GLU A 102 2.854 16.510 5.623 1.00 0.00 H new ATOM 0 HG3 GLU A 102 3.319 14.826 5.762 1.00 0.00 H new ATOM 1491 N GLY A 103 3.926 16.623 1.134 1.00 0.00 N ATOM 1492 CA GLY A 103 4.411 16.595 -0.236 1.00 0.00 C ATOM 1493 C GLY A 103 5.283 15.362 -0.484 1.00 0.00 C ATOM 1494 O GLY A 103 5.678 15.095 -1.618 1.00 0.00 O ATOM 0 H GLY A 103 3.042 16.136 1.284 1.00 0.00 H new ATOM 0 HA2 GLY A 103 3.566 16.592 -0.925 1.00 0.00 H new ATOM 0 HA3 GLY A 103 4.986 17.498 -0.441 1.00 0.00 H new ATOM 1498 N SER A 104 5.557 14.644 0.595 1.00 0.00 N ATOM 1499 CA SER A 104 6.375 13.446 0.509 1.00 0.00 C ATOM 1500 C SER A 104 6.431 12.751 1.871 1.00 0.00 C ATOM 1501 O SER A 104 6.831 13.356 2.864 1.00 0.00 O ATOM 1502 CB SER A 104 7.788 13.778 0.024 1.00 0.00 C ATOM 1503 OG SER A 104 7.821 14.061 -1.372 1.00 0.00 O ATOM 0 H SER A 104 5.227 14.869 1.534 1.00 0.00 H new ATOM 0 HA SER A 104 5.919 12.772 -0.217 1.00 0.00 H new ATOM 0 HB2 SER A 104 8.169 14.637 0.577 1.00 0.00 H new ATOM 0 HB3 SER A 104 8.451 12.940 0.240 1.00 0.00 H new ATOM 0 HG SER A 104 6.910 14.226 -1.694 1.00 0.00 H new ATOM 1509 N ILE A 105 6.023 11.491 1.873 1.00 0.00 N ATOM 1510 CA ILE A 105 6.021 10.707 3.096 1.00 0.00 C ATOM 1511 C ILE A 105 7.067 9.595 2.986 1.00 0.00 C ATOM 1512 O ILE A 105 7.185 8.950 1.945 1.00 0.00 O ATOM 1513 CB ILE A 105 4.612 10.197 3.404 1.00 0.00 C ATOM 1514 CG1 ILE A 105 3.625 11.359 3.535 1.00 0.00 C ATOM 1515 CG2 ILE A 105 4.611 9.301 4.644 1.00 0.00 C ATOM 1516 CD1 ILE A 105 4.134 12.400 4.534 1.00 0.00 C ATOM 0 H ILE A 105 5.691 10.993 1.047 1.00 0.00 H new ATOM 0 HA ILE A 105 6.303 11.328 3.946 1.00 0.00 H new ATOM 0 HB ILE A 105 4.280 9.585 2.565 1.00 0.00 H new ATOM 0 HG12 ILE A 105 3.476 11.826 2.561 1.00 0.00 H new ATOM 0 HG13 ILE A 105 2.655 10.982 3.859 1.00 0.00 H new ATOM 0 HG21 ILE A 105 3.597 8.952 4.840 1.00 0.00 H new ATOM 0 HG22 ILE A 105 5.263 8.444 4.474 1.00 0.00 H new ATOM 0 HG23 ILE A 105 4.972 9.867 5.502 1.00 0.00 H new ATOM 0 HD11 ILE A 105 3.414 13.215 4.609 1.00 0.00 H new ATOM 0 HD12 ILE A 105 4.258 11.935 5.512 1.00 0.00 H new ATOM 0 HD13 ILE A 105 5.092 12.792 4.194 1.00 0.00 H new ATOM 1528 N PRO A 106 7.818 9.400 4.103 1.00 0.00 N ATOM 1529 CA PRO A 106 8.850 8.378 4.142 1.00 0.00 C ATOM 1530 C PRO A 106 8.234 6.983 4.270 1.00 0.00 C ATOM 1531 O PRO A 106 7.036 6.849 4.511 1.00 0.00 O ATOM 1532 CB PRO A 106 9.729 8.750 5.324 1.00 0.00 C ATOM 1533 CG PRO A 106 8.898 9.692 6.181 1.00 0.00 C ATOM 1534 CD PRO A 106 7.706 10.145 5.353 1.00 0.00 C ATOM 0 HA PRO A 106 9.437 8.338 3.225 1.00 0.00 H new ATOM 0 HB2 PRO A 106 10.021 7.864 5.888 1.00 0.00 H new ATOM 0 HB3 PRO A 106 10.648 9.233 4.991 1.00 0.00 H new ATOM 0 HG2 PRO A 106 8.564 9.188 7.088 1.00 0.00 H new ATOM 0 HG3 PRO A 106 9.494 10.550 6.494 1.00 0.00 H new ATOM 0 HD2 PRO A 106 6.766 9.928 5.860 1.00 0.00 H new ATOM 0 HD3 PRO A 106 7.732 11.220 5.177 1.00 0.00 H new ATOM 1542 N PRO A 107 9.106 5.952 4.098 1.00 0.00 N ATOM 1543 CA PRO A 107 8.660 4.572 4.192 1.00 0.00 C ATOM 1544 C PRO A 107 8.420 4.172 5.650 1.00 0.00 C ATOM 1545 O PRO A 107 9.368 4.009 6.417 1.00 0.00 O ATOM 1546 CB PRO A 107 9.758 3.759 3.526 1.00 0.00 C ATOM 1547 CG PRO A 107 10.984 4.656 3.500 1.00 0.00 C ATOM 1548 CD PRO A 107 10.532 6.073 3.811 1.00 0.00 C ATOM 0 HA PRO A 107 7.703 4.404 3.699 1.00 0.00 H new ATOM 0 HB2 PRO A 107 9.957 2.842 4.081 1.00 0.00 H new ATOM 0 HB3 PRO A 107 9.468 3.464 2.517 1.00 0.00 H new ATOM 0 HG2 PRO A 107 11.718 4.320 4.232 1.00 0.00 H new ATOM 0 HG3 PRO A 107 11.466 4.615 2.523 1.00 0.00 H new ATOM 0 HD2 PRO A 107 11.074 6.484 4.663 1.00 0.00 H new ATOM 0 HD3 PRO A 107 10.711 6.740 2.968 1.00 0.00 H new ATOM 1556 N THR A 108 7.147 4.025 5.987 1.00 0.00 N ATOM 1557 CA THR A 108 6.770 3.647 7.338 1.00 0.00 C ATOM 1558 C THR A 108 5.936 2.365 7.320 1.00 0.00 C ATOM 1559 O THR A 108 5.228 2.094 6.351 1.00 0.00 O ATOM 1560 CB THR A 108 6.047 4.834 7.977 1.00 0.00 C ATOM 1561 OG1 THR A 108 7.085 5.569 8.619 1.00 0.00 O ATOM 1562 CG2 THR A 108 5.126 4.411 9.123 1.00 0.00 C ATOM 0 H THR A 108 6.364 4.161 5.348 1.00 0.00 H new ATOM 0 HA THR A 108 7.647 3.418 7.944 1.00 0.00 H new ATOM 0 HB THR A 108 5.465 5.355 7.217 1.00 0.00 H new ATOM 0 HG1 THR A 108 6.704 6.358 9.058 1.00 0.00 H new ATOM 0 HG21 THR A 108 4.638 5.291 9.541 1.00 0.00 H new ATOM 0 HG22 THR A 108 4.370 3.721 8.747 1.00 0.00 H new ATOM 0 HG23 THR A 108 5.713 3.919 9.899 1.00 0.00 H new ATOM 1570 N ALA A 109 6.046 1.610 8.403 1.00 0.00 N ATOM 1571 CA ALA A 109 5.311 0.363 8.524 1.00 0.00 C ATOM 1572 C ALA A 109 3.883 0.660 8.985 1.00 0.00 C ATOM 1573 O ALA A 109 3.648 0.911 10.167 1.00 0.00 O ATOM 1574 CB ALA A 109 6.049 -0.575 9.481 1.00 0.00 C ATOM 0 H ALA A 109 6.633 1.838 9.205 1.00 0.00 H new ATOM 0 HA ALA A 109 5.248 -0.140 7.559 1.00 0.00 H new ATOM 0 HB1 ALA A 109 5.497 -1.511 9.571 1.00 0.00 H new ATOM 0 HB2 ALA A 109 7.047 -0.779 9.093 1.00 0.00 H new ATOM 0 HB3 ALA A 109 6.129 -0.105 10.461 1.00 0.00 H new ATOM 1580 N TYR A 110 2.966 0.622 8.030 1.00 0.00 N ATOM 1581 CA TYR A 110 1.567 0.885 8.323 1.00 0.00 C ATOM 1582 C TYR A 110 0.901 -0.338 8.959 1.00 0.00 C ATOM 1583 O TYR A 110 1.136 -1.468 8.533 1.00 0.00 O ATOM 1584 CB TYR A 110 0.900 1.172 6.977 1.00 0.00 C ATOM 1585 CG TYR A 110 1.364 2.472 6.317 1.00 0.00 C ATOM 1586 CD1 TYR A 110 0.990 3.689 6.851 1.00 0.00 C ATOM 1587 CD2 TYR A 110 2.157 2.428 5.189 1.00 0.00 C ATOM 1588 CE1 TYR A 110 1.427 4.912 6.230 1.00 0.00 C ATOM 1589 CE2 TYR A 110 2.594 3.652 4.568 1.00 0.00 C ATOM 1590 CZ TYR A 110 2.207 4.834 5.119 1.00 0.00 C ATOM 1591 OH TYR A 110 2.620 5.989 4.533 1.00 0.00 O ATOM 0 H TYR A 110 3.164 0.413 7.052 1.00 0.00 H new ATOM 0 HA TYR A 110 1.471 1.716 9.022 1.00 0.00 H new ATOM 0 HB2 TYR A 110 1.100 0.341 6.300 1.00 0.00 H new ATOM 0 HB3 TYR A 110 -0.180 1.214 7.120 1.00 0.00 H new ATOM 0 HD1 TYR A 110 0.370 3.723 7.734 1.00 0.00 H new ATOM 0 HD2 TYR A 110 2.450 1.476 4.772 1.00 0.00 H new ATOM 0 HE1 TYR A 110 1.142 5.871 6.638 1.00 0.00 H new ATOM 0 HE2 TYR A 110 3.215 3.632 3.685 1.00 0.00 H new ATOM 0 HH TYR A 110 3.171 5.780 3.750 1.00 0.00 H new ATOM 1601 N ASN A 111 0.084 -0.070 9.966 1.00 0.00 N ATOM 1602 CA ASN A 111 -0.617 -1.134 10.664 1.00 0.00 C ATOM 1603 C ASN A 111 -1.324 -2.028 9.643 1.00 0.00 C ATOM 1604 O ASN A 111 -2.086 -1.542 8.810 1.00 0.00 O ATOM 1605 CB ASN A 111 -1.678 -0.567 11.610 1.00 0.00 C ATOM 1606 CG ASN A 111 -1.133 0.632 12.389 1.00 0.00 C ATOM 1607 OD1 ASN A 111 -0.028 1.099 12.167 1.00 0.00 O ATOM 1608 ND2 ASN A 111 -1.968 1.102 13.311 1.00 0.00 N ATOM 0 H ASN A 111 -0.108 0.869 10.316 1.00 0.00 H new ATOM 0 HA ASN A 111 0.116 -1.699 11.241 1.00 0.00 H new ATOM 0 HB2 ASN A 111 -2.556 -0.266 11.039 1.00 0.00 H new ATOM 0 HB3 ASN A 111 -2.001 -1.341 12.306 1.00 0.00 H new ATOM 0 HD21 ASN A 111 -1.697 1.901 13.884 1.00 0.00 H new ATOM 0 HD22 ASN A 111 -2.879 0.663 13.445 1.00 0.00 H new ATOM 1615 N VAL A 112 -1.044 -3.320 9.743 1.00 0.00 N ATOM 1616 CA VAL A 112 -1.644 -4.286 8.838 1.00 0.00 C ATOM 1617 C VAL A 112 -2.600 -5.187 9.622 1.00 0.00 C ATOM 1618 O VAL A 112 -2.168 -5.977 10.460 1.00 0.00 O ATOM 1619 CB VAL A 112 -0.549 -5.068 8.108 1.00 0.00 C ATOM 1620 CG1 VAL A 112 -1.117 -6.335 7.464 1.00 0.00 C ATOM 1621 CG2 VAL A 112 0.151 -4.191 7.069 1.00 0.00 C ATOM 0 H VAL A 112 -0.411 -3.719 10.436 1.00 0.00 H new ATOM 0 HA VAL A 112 -2.230 -3.779 8.071 1.00 0.00 H new ATOM 0 HB VAL A 112 0.194 -5.371 8.845 1.00 0.00 H new ATOM 0 HG11 VAL A 112 -0.319 -6.872 6.952 1.00 0.00 H new ATOM 0 HG12 VAL A 112 -1.547 -6.974 8.235 1.00 0.00 H new ATOM 0 HG13 VAL A 112 -1.890 -6.063 6.745 1.00 0.00 H new ATOM 0 HG21 VAL A 112 0.924 -4.771 6.565 1.00 0.00 H new ATOM 0 HG22 VAL A 112 -0.577 -3.843 6.336 1.00 0.00 H new ATOM 0 HG23 VAL A 112 0.606 -3.333 7.564 1.00 0.00 H new ATOM 1631 N VAL A 113 -3.882 -5.038 9.322 1.00 0.00 N ATOM 1632 CA VAL A 113 -4.903 -5.828 9.988 1.00 0.00 C ATOM 1633 C VAL A 113 -5.544 -6.782 8.978 1.00 0.00 C ATOM 1634 O VAL A 113 -5.309 -6.667 7.776 1.00 0.00 O ATOM 1635 CB VAL A 113 -5.918 -4.906 10.667 1.00 0.00 C ATOM 1636 CG1 VAL A 113 -5.551 -4.672 12.133 1.00 0.00 C ATOM 1637 CG2 VAL A 113 -6.044 -3.580 9.914 1.00 0.00 C ATOM 0 H VAL A 113 -4.237 -4.382 8.626 1.00 0.00 H new ATOM 0 HA VAL A 113 -4.460 -6.438 10.775 1.00 0.00 H new ATOM 0 HB VAL A 113 -6.889 -5.400 10.640 1.00 0.00 H new ATOM 0 HG11 VAL A 113 -6.288 -4.013 12.592 1.00 0.00 H new ATOM 0 HG12 VAL A 113 -5.537 -5.625 12.661 1.00 0.00 H new ATOM 0 HG13 VAL A 113 -4.565 -4.210 12.192 1.00 0.00 H new ATOM 0 HG21 VAL A 113 -6.772 -2.943 10.417 1.00 0.00 H new ATOM 0 HG22 VAL A 113 -5.076 -3.079 9.894 1.00 0.00 H new ATOM 0 HG23 VAL A 113 -6.374 -3.771 8.893 1.00 0.00 H new ATOM 1647 N LYS A 114 -6.341 -7.701 9.503 1.00 0.00 N ATOM 1648 CA LYS A 114 -7.017 -8.674 8.661 1.00 0.00 C ATOM 1649 C LYS A 114 -8.428 -8.915 9.201 1.00 0.00 C ATOM 1650 O LYS A 114 -8.639 -9.810 10.019 1.00 0.00 O ATOM 1651 CB LYS A 114 -6.180 -9.949 8.537 1.00 0.00 C ATOM 1652 CG LYS A 114 -6.983 -11.070 7.876 1.00 0.00 C ATOM 1653 CD LYS A 114 -7.743 -10.552 6.652 1.00 0.00 C ATOM 1654 CE LYS A 114 -8.508 -11.684 5.963 1.00 0.00 C ATOM 1655 NZ LYS A 114 -9.538 -11.134 5.054 1.00 0.00 N ATOM 0 H LYS A 114 -6.534 -7.793 10.500 1.00 0.00 H new ATOM 0 HA LYS A 114 -7.124 -8.291 7.646 1.00 0.00 H new ATOM 0 HB2 LYS A 114 -5.284 -9.744 7.951 1.00 0.00 H new ATOM 0 HB3 LYS A 114 -5.849 -10.268 9.525 1.00 0.00 H new ATOM 0 HG2 LYS A 114 -6.312 -11.876 7.578 1.00 0.00 H new ATOM 0 HG3 LYS A 114 -7.687 -11.491 8.594 1.00 0.00 H new ATOM 0 HD2 LYS A 114 -8.439 -9.770 6.956 1.00 0.00 H new ATOM 0 HD3 LYS A 114 -7.043 -10.101 5.949 1.00 0.00 H new ATOM 0 HE2 LYS A 114 -7.815 -12.310 5.401 1.00 0.00 H new ATOM 0 HE3 LYS A 114 -8.978 -12.322 6.712 1.00 0.00 H new ATOM 0 HZ1 LYS A 114 -9.650 -11.765 4.235 1.00 0.00 H new ATOM 0 HZ2 LYS A 114 -10.443 -11.059 5.560 1.00 0.00 H new ATOM 0 HZ3 LYS A 114 -9.245 -10.191 4.727 1.00 0.00 H new ATOM 1669 N ASP A 115 -9.358 -8.102 8.723 1.00 0.00 N ATOM 1670 CA ASP A 115 -10.742 -8.216 9.147 1.00 0.00 C ATOM 1671 C ASP A 115 -10.950 -7.395 10.422 1.00 0.00 C ATOM 1672 O ASP A 115 -12.074 -7.008 10.739 1.00 0.00 O ATOM 1673 CB ASP A 115 -11.106 -9.670 9.456 1.00 0.00 C ATOM 1674 CG ASP A 115 -12.560 -10.048 9.167 1.00 0.00 C ATOM 1675 OD1 ASP A 115 -13.419 -9.673 9.994 1.00 0.00 O ATOM 1676 OD2 ASP A 115 -12.779 -10.704 8.126 1.00 0.00 O ATOM 0 H ASP A 115 -9.180 -7.361 8.045 1.00 0.00 H new ATOM 0 HA ASP A 115 -11.374 -7.851 8.337 1.00 0.00 H new ATOM 0 HB2 ASP A 115 -10.454 -10.323 8.876 1.00 0.00 H new ATOM 0 HB3 ASP A 115 -10.898 -9.865 10.508 1.00 0.00 H new ATOM 1681 N GLU A 116 -9.849 -7.154 11.117 1.00 0.00 N ATOM 1682 CA GLU A 116 -9.896 -6.386 12.350 1.00 0.00 C ATOM 1683 C GLU A 116 -8.710 -6.748 13.247 1.00 0.00 C ATOM 1684 O GLU A 116 -8.344 -5.982 14.137 1.00 0.00 O ATOM 1685 CB GLU A 116 -11.222 -6.603 13.081 1.00 0.00 C ATOM 1686 CG GLU A 116 -11.627 -8.078 13.055 1.00 0.00 C ATOM 1687 CD GLU A 116 -11.785 -8.630 14.473 1.00 0.00 C ATOM 1688 OE1 GLU A 116 -10.748 -8.713 15.168 1.00 0.00 O ATOM 1689 OE2 GLU A 116 -12.937 -8.955 14.831 1.00 0.00 O ATOM 0 H GLU A 116 -8.919 -7.477 10.850 1.00 0.00 H new ATOM 0 HA GLU A 116 -9.826 -5.328 12.098 1.00 0.00 H new ATOM 0 HB2 GLU A 116 -11.132 -6.265 14.113 1.00 0.00 H new ATOM 0 HB3 GLU A 116 -12.001 -6.000 12.615 1.00 0.00 H new ATOM 0 HG2 GLU A 116 -12.564 -8.192 12.511 1.00 0.00 H new ATOM 0 HG3 GLU A 116 -10.875 -8.656 12.518 1.00 0.00 H new ATOM 1696 N GLU A 117 -8.142 -7.915 12.980 1.00 0.00 N ATOM 1697 CA GLU A 117 -7.005 -8.388 13.752 1.00 0.00 C ATOM 1698 C GLU A 117 -5.700 -7.876 13.140 1.00 0.00 C ATOM 1699 O GLU A 117 -5.539 -7.876 11.921 1.00 0.00 O ATOM 1700 CB GLU A 117 -7.005 -9.915 13.847 1.00 0.00 C ATOM 1701 CG GLU A 117 -7.928 -10.394 14.969 1.00 0.00 C ATOM 1702 CD GLU A 117 -8.866 -11.498 14.473 1.00 0.00 C ATOM 1703 OE1 GLU A 117 -8.351 -12.608 14.220 1.00 0.00 O ATOM 1704 OE2 GLU A 117 -10.076 -11.205 14.359 1.00 0.00 O ATOM 0 H GLU A 117 -8.448 -8.547 12.240 1.00 0.00 H new ATOM 0 HA GLU A 117 -7.088 -7.994 14.765 1.00 0.00 H new ATOM 0 HB2 GLU A 117 -7.329 -10.342 12.898 1.00 0.00 H new ATOM 0 HB3 GLU A 117 -5.991 -10.272 14.028 1.00 0.00 H new ATOM 0 HG2 GLU A 117 -7.331 -10.766 15.802 1.00 0.00 H new ATOM 0 HG3 GLU A 117 -8.514 -9.556 15.346 1.00 0.00 H new ATOM 1711 N TYR A 118 -4.800 -7.453 14.016 1.00 0.00 N ATOM 1712 CA TYR A 118 -3.513 -6.939 13.577 1.00 0.00 C ATOM 1713 C TYR A 118 -2.577 -8.080 13.172 1.00 0.00 C ATOM 1714 O TYR A 118 -2.231 -8.926 13.995 1.00 0.00 O ATOM 1715 CB TYR A 118 -2.917 -6.211 14.783 1.00 0.00 C ATOM 1716 CG TYR A 118 -1.611 -5.472 14.481 1.00 0.00 C ATOM 1717 CD1 TYR A 118 -1.627 -4.338 13.694 1.00 0.00 C ATOM 1718 CD2 TYR A 118 -0.419 -5.939 14.994 1.00 0.00 C ATOM 1719 CE1 TYR A 118 -0.398 -3.642 13.410 1.00 0.00 C ATOM 1720 CE2 TYR A 118 0.810 -5.244 14.710 1.00 0.00 C ATOM 1721 CZ TYR A 118 0.759 -4.130 13.931 1.00 0.00 C ATOM 1722 OH TYR A 118 1.919 -3.473 13.663 1.00 0.00 O ATOM 0 H TYR A 118 -4.936 -7.456 15.027 1.00 0.00 H new ATOM 0 HA TYR A 118 -3.634 -6.286 12.712 1.00 0.00 H new ATOM 0 HB2 TYR A 118 -3.648 -5.496 15.161 1.00 0.00 H new ATOM 0 HB3 TYR A 118 -2.738 -6.934 15.579 1.00 0.00 H new ATOM 0 HD1 TYR A 118 -2.560 -3.973 13.291 1.00 0.00 H new ATOM 0 HD2 TYR A 118 -0.407 -6.827 15.609 1.00 0.00 H new ATOM 0 HE1 TYR A 118 -0.396 -2.753 12.797 1.00 0.00 H new ATOM 0 HE2 TYR A 118 1.750 -5.599 15.106 1.00 0.00 H new ATOM 0 HH TYR A 118 2.196 -3.661 12.742 1.00 0.00 H new ATOM 1732 N LYS A 119 -2.194 -8.066 11.903 1.00 0.00 N ATOM 1733 CA LYS A 119 -1.305 -9.088 11.379 1.00 0.00 C ATOM 1734 C LYS A 119 0.147 -8.656 11.596 1.00 0.00 C ATOM 1735 O LYS A 119 0.937 -9.395 12.182 1.00 0.00 O ATOM 1736 CB LYS A 119 -1.643 -9.394 9.918 1.00 0.00 C ATOM 1737 CG LYS A 119 -3.141 -9.652 9.745 1.00 0.00 C ATOM 1738 CD LYS A 119 -3.560 -10.944 10.449 1.00 0.00 C ATOM 1739 CE LYS A 119 -4.383 -10.643 11.703 1.00 0.00 C ATOM 1740 NZ LYS A 119 -4.046 -11.594 12.786 1.00 0.00 N ATOM 0 H LYS A 119 -2.483 -7.363 11.223 1.00 0.00 H new ATOM 0 HA LYS A 119 -1.443 -10.025 11.918 1.00 0.00 H new ATOM 0 HB2 LYS A 119 -1.339 -8.558 9.288 1.00 0.00 H new ATOM 0 HB3 LYS A 119 -1.079 -10.266 9.585 1.00 0.00 H new ATOM 0 HG2 LYS A 119 -3.707 -8.813 10.150 1.00 0.00 H new ATOM 0 HG3 LYS A 119 -3.382 -9.717 8.684 1.00 0.00 H new ATOM 0 HD2 LYS A 119 -4.144 -11.562 9.766 1.00 0.00 H new ATOM 0 HD3 LYS A 119 -2.674 -11.518 10.720 1.00 0.00 H new ATOM 0 HE2 LYS A 119 -4.191 -9.623 12.035 1.00 0.00 H new ATOM 0 HE3 LYS A 119 -5.446 -10.708 11.472 1.00 0.00 H new ATOM 0 HZ1 LYS A 119 -4.922 -11.960 13.212 1.00 0.00 H new ATOM 0 HZ2 LYS A 119 -3.495 -12.384 12.395 1.00 0.00 H new ATOM 0 HZ3 LYS A 119 -3.485 -11.107 13.514 1.00 0.00 H new ATOM 1754 N GLY A 120 0.454 -7.462 11.113 1.00 0.00 N ATOM 1755 CA GLY A 120 1.797 -6.923 11.248 1.00 0.00 C ATOM 1756 C GLY A 120 1.848 -5.461 10.799 1.00 0.00 C ATOM 1757 O GLY A 120 1.075 -4.633 11.277 1.00 0.00 O ATOM 0 H GLY A 120 -0.204 -6.852 10.627 1.00 0.00 H new ATOM 0 HA2 GLY A 120 2.121 -7.000 12.286 1.00 0.00 H new ATOM 0 HA3 GLY A 120 2.492 -7.515 10.652 1.00 0.00 H new ATOM 1761 N GLU A 121 2.767 -5.188 9.884 1.00 0.00 N ATOM 1762 CA GLU A 121 2.930 -3.841 9.365 1.00 0.00 C ATOM 1763 C GLU A 121 3.446 -3.885 7.925 1.00 0.00 C ATOM 1764 O GLU A 121 4.143 -4.823 7.541 1.00 0.00 O ATOM 1765 CB GLU A 121 3.863 -3.019 10.257 1.00 0.00 C ATOM 1766 CG GLU A 121 5.182 -3.755 10.496 1.00 0.00 C ATOM 1767 CD GLU A 121 5.946 -3.143 11.672 1.00 0.00 C ATOM 1768 OE1 GLU A 121 5.321 -3.007 12.746 1.00 0.00 O ATOM 1769 OE2 GLU A 121 7.138 -2.824 11.470 1.00 0.00 O ATOM 0 H GLU A 121 3.407 -5.877 9.489 1.00 0.00 H new ATOM 0 HA GLU A 121 1.956 -3.352 9.366 1.00 0.00 H new ATOM 0 HB2 GLU A 121 4.060 -2.054 9.791 1.00 0.00 H new ATOM 0 HB3 GLU A 121 3.376 -2.819 11.211 1.00 0.00 H new ATOM 0 HG2 GLU A 121 4.984 -4.808 10.695 1.00 0.00 H new ATOM 0 HG3 GLU A 121 5.796 -3.710 9.596 1.00 0.00 H new ATOM 1776 N ILE A 122 3.084 -2.860 7.169 1.00 0.00 N ATOM 1777 CA ILE A 122 3.502 -2.770 5.780 1.00 0.00 C ATOM 1778 C ILE A 122 4.293 -1.477 5.573 1.00 0.00 C ATOM 1779 O ILE A 122 3.815 -0.392 5.901 1.00 0.00 O ATOM 1780 CB ILE A 122 2.297 -2.909 4.848 1.00 0.00 C ATOM 1781 CG1 ILE A 122 2.739 -2.973 3.385 1.00 0.00 C ATOM 1782 CG2 ILE A 122 1.283 -1.790 5.092 1.00 0.00 C ATOM 1783 CD1 ILE A 122 1.543 -2.825 2.443 1.00 0.00 C ATOM 0 H ILE A 122 2.506 -2.084 7.492 1.00 0.00 H new ATOM 0 HA ILE A 122 4.168 -3.596 5.528 1.00 0.00 H new ATOM 0 HB ILE A 122 1.798 -3.851 5.074 1.00 0.00 H new ATOM 0 HG12 ILE A 122 3.463 -2.183 3.186 1.00 0.00 H new ATOM 0 HG13 ILE A 122 3.241 -3.921 3.194 1.00 0.00 H new ATOM 0 HG21 ILE A 122 0.436 -1.913 4.416 1.00 0.00 H new ATOM 0 HG22 ILE A 122 0.934 -1.834 6.124 1.00 0.00 H new ATOM 0 HG23 ILE A 122 1.756 -0.825 4.910 1.00 0.00 H new ATOM 0 HD11 ILE A 122 1.886 -2.874 1.409 1.00 0.00 H new ATOM 0 HD12 ILE A 122 0.832 -3.630 2.628 1.00 0.00 H new ATOM 0 HD13 ILE A 122 1.058 -1.865 2.619 1.00 0.00 H new ATOM 1795 N TRP A 123 5.491 -1.635 5.029 1.00 0.00 N ATOM 1796 CA TRP A 123 6.354 -0.494 4.774 1.00 0.00 C ATOM 1797 C TRP A 123 6.037 0.034 3.373 1.00 0.00 C ATOM 1798 O TRP A 123 6.144 -0.699 2.391 1.00 0.00 O ATOM 1799 CB TRP A 123 7.826 -0.868 4.953 1.00 0.00 C ATOM 1800 CG TRP A 123 8.226 -1.142 6.404 1.00 0.00 C ATOM 1801 CD1 TRP A 123 7.846 -2.161 7.187 1.00 0.00 C ATOM 1802 CD2 TRP A 123 9.107 -0.340 7.219 1.00 0.00 C ATOM 1803 NE1 TRP A 123 8.414 -2.075 8.442 1.00 0.00 N ATOM 1804 CE2 TRP A 123 9.205 -0.932 8.462 1.00 0.00 C ATOM 1805 CE3 TRP A 123 9.797 0.847 6.916 1.00 0.00 C ATOM 1806 CZ2 TRP A 123 9.984 -0.409 9.501 1.00 0.00 C ATOM 1807 CZ3 TRP A 123 10.572 1.357 7.965 1.00 0.00 C ATOM 1808 CH2 TRP A 123 10.681 0.773 9.222 1.00 0.00 C ATOM 0 H TRP A 123 5.884 -2.536 4.758 1.00 0.00 H new ATOM 0 HA TRP A 123 6.167 0.300 5.497 1.00 0.00 H new ATOM 0 HB2 TRP A 123 8.041 -1.753 4.354 1.00 0.00 H new ATOM 0 HB3 TRP A 123 8.446 -0.061 4.562 1.00 0.00 H new ATOM 0 HD1 TRP A 123 7.179 -2.951 6.875 1.00 0.00 H new ATOM 0 HE1 TRP A 123 8.278 -2.729 9.213 1.00 0.00 H new ATOM 0 HE3 TRP A 123 9.734 1.327 5.951 1.00 0.00 H new ATOM 0 HZ2 TRP A 123 10.044 -0.891 10.466 1.00 0.00 H new ATOM 0 HZ3 TRP A 123 11.124 2.268 7.785 1.00 0.00 H new ATOM 0 HH2 TRP A 123 11.301 1.229 9.980 1.00 0.00 H new ATOM 1819 N VAL A 124 5.655 1.302 3.326 1.00 0.00 N ATOM 1820 CA VAL A 124 5.322 1.936 2.061 1.00 0.00 C ATOM 1821 C VAL A 124 5.588 3.440 2.165 1.00 0.00 C ATOM 1822 O VAL A 124 5.312 4.053 3.195 1.00 0.00 O ATOM 1823 CB VAL A 124 3.878 1.609 1.676 1.00 0.00 C ATOM 1824 CG1 VAL A 124 3.550 2.139 0.278 1.00 0.00 C ATOM 1825 CG2 VAL A 124 3.613 0.105 1.768 1.00 0.00 C ATOM 0 H VAL A 124 5.569 1.907 4.143 1.00 0.00 H new ATOM 0 HA VAL A 124 5.953 1.548 1.261 1.00 0.00 H new ATOM 0 HB VAL A 124 3.220 2.109 2.387 1.00 0.00 H new ATOM 0 HG11 VAL A 124 2.518 1.893 0.029 1.00 0.00 H new ATOM 0 HG12 VAL A 124 3.680 3.221 0.259 1.00 0.00 H new ATOM 0 HG13 VAL A 124 4.218 1.681 -0.451 1.00 0.00 H new ATOM 0 HG21 VAL A 124 2.579 -0.100 1.489 1.00 0.00 H new ATOM 0 HG22 VAL A 124 4.283 -0.425 1.091 1.00 0.00 H new ATOM 0 HG23 VAL A 124 3.787 -0.233 2.789 1.00 0.00 H new ATOM 1835 N ALA A 125 6.119 3.990 1.083 1.00 0.00 N ATOM 1836 CA ALA A 125 6.425 5.410 1.039 1.00 0.00 C ATOM 1837 C ALA A 125 5.501 6.095 0.030 1.00 0.00 C ATOM 1838 O ALA A 125 5.239 5.555 -1.043 1.00 0.00 O ATOM 1839 CB ALA A 125 7.904 5.603 0.700 1.00 0.00 C ATOM 0 H ALA A 125 6.345 3.478 0.230 1.00 0.00 H new ATOM 0 HA ALA A 125 6.251 5.871 2.011 1.00 0.00 H new ATOM 0 HB1 ALA A 125 8.134 6.668 0.667 1.00 0.00 H new ATOM 0 HB2 ALA A 125 8.518 5.123 1.462 1.00 0.00 H new ATOM 0 HB3 ALA A 125 8.116 5.156 -0.271 1.00 0.00 H new ATOM 1845 N LEU A 126 5.033 7.275 0.411 1.00 0.00 N ATOM 1846 CA LEU A 126 4.144 8.039 -0.447 1.00 0.00 C ATOM 1847 C LEU A 126 4.839 9.335 -0.870 1.00 0.00 C ATOM 1848 O LEU A 126 5.437 10.021 -0.042 1.00 0.00 O ATOM 1849 CB LEU A 126 2.795 8.262 0.241 1.00 0.00 C ATOM 1850 CG LEU A 126 2.144 7.022 0.857 1.00 0.00 C ATOM 1851 CD1 LEU A 126 1.224 7.406 2.018 1.00 0.00 C ATOM 1852 CD2 LEU A 126 1.413 6.201 -0.207 1.00 0.00 C ATOM 0 H LEU A 126 5.253 7.720 1.302 1.00 0.00 H new ATOM 0 HA LEU A 126 3.924 7.482 -1.358 1.00 0.00 H new ATOM 0 HB2 LEU A 126 2.929 9.006 1.026 1.00 0.00 H new ATOM 0 HB3 LEU A 126 2.104 8.687 -0.487 1.00 0.00 H new ATOM 0 HG LEU A 126 2.932 6.389 1.266 1.00 0.00 H new ATOM 0 HD11 LEU A 126 0.774 6.507 2.438 1.00 0.00 H new ATOM 0 HD12 LEU A 126 1.803 7.916 2.788 1.00 0.00 H new ATOM 0 HD13 LEU A 126 0.439 8.070 1.656 1.00 0.00 H new ATOM 0 HD21 LEU A 126 0.959 5.325 0.257 1.00 0.00 H new ATOM 0 HD22 LEU A 126 0.636 6.811 -0.667 1.00 0.00 H new ATOM 0 HD23 LEU A 126 2.122 5.881 -0.970 1.00 0.00 H new ATOM 1864 N SER A 127 4.739 9.629 -2.157 1.00 0.00 N ATOM 1865 CA SER A 127 5.351 10.830 -2.700 1.00 0.00 C ATOM 1866 C SER A 127 4.387 11.517 -3.669 1.00 0.00 C ATOM 1867 O SER A 127 4.161 11.030 -4.776 1.00 0.00 O ATOM 1868 CB SER A 127 6.670 10.506 -3.405 1.00 0.00 C ATOM 1869 OG SER A 127 7.736 11.334 -2.950 1.00 0.00 O ATOM 0 H SER A 127 4.243 9.056 -2.840 1.00 0.00 H new ATOM 0 HA SER A 127 5.568 11.506 -1.873 1.00 0.00 H new ATOM 0 HB2 SER A 127 6.925 9.460 -3.234 1.00 0.00 H new ATOM 0 HB3 SER A 127 6.547 10.632 -4.481 1.00 0.00 H new ATOM 0 HG SER A 127 7.373 12.182 -2.619 1.00 0.00 H new ATOM 1875 N PHE A 128 3.844 12.638 -3.218 1.00 0.00 N ATOM 1876 CA PHE A 128 2.909 13.397 -4.031 1.00 0.00 C ATOM 1877 C PHE A 128 3.647 14.379 -4.944 1.00 0.00 C ATOM 1878 O PHE A 128 4.705 14.891 -4.583 1.00 0.00 O ATOM 1879 CB PHE A 128 2.017 14.186 -3.069 1.00 0.00 C ATOM 1880 CG PHE A 128 0.998 15.090 -3.765 1.00 0.00 C ATOM 1881 CD1 PHE A 128 0.236 14.601 -4.780 1.00 0.00 C ATOM 1882 CD2 PHE A 128 0.855 16.383 -3.370 1.00 0.00 C ATOM 1883 CE1 PHE A 128 -0.710 15.440 -5.426 1.00 0.00 C ATOM 1884 CE2 PHE A 128 -0.091 17.223 -4.016 1.00 0.00 C ATOM 1885 CZ PHE A 128 -0.854 16.733 -5.030 1.00 0.00 C ATOM 0 H PHE A 128 4.034 13.039 -2.300 1.00 0.00 H new ATOM 0 HA PHE A 128 2.331 12.721 -4.661 1.00 0.00 H new ATOM 0 HB2 PHE A 128 1.486 13.485 -2.425 1.00 0.00 H new ATOM 0 HB3 PHE A 128 2.648 14.797 -2.423 1.00 0.00 H new ATOM 0 HD1 PHE A 128 0.351 13.574 -5.095 1.00 0.00 H new ATOM 0 HD2 PHE A 128 1.461 16.772 -2.565 1.00 0.00 H new ATOM 0 HE1 PHE A 128 -1.315 15.051 -6.232 1.00 0.00 H new ATOM 0 HE2 PHE A 128 -0.204 18.250 -3.702 1.00 0.00 H new ATOM 0 HZ PHE A 128 -1.574 17.371 -5.521 1.00 0.00 H new ATOM 1895 N LYS A 129 3.059 14.611 -6.108 1.00 0.00 N ATOM 1896 CA LYS A 129 3.648 15.521 -7.075 1.00 0.00 C ATOM 1897 C LYS A 129 2.548 16.392 -7.685 1.00 0.00 C ATOM 1898 O LYS A 129 1.937 16.018 -8.684 1.00 0.00 O ATOM 1899 CB LYS A 129 4.465 14.747 -8.112 1.00 0.00 C ATOM 1900 CG LYS A 129 5.843 14.377 -7.560 1.00 0.00 C ATOM 1901 CD LYS A 129 6.323 13.043 -8.134 1.00 0.00 C ATOM 1902 CE LYS A 129 6.975 12.183 -7.050 1.00 0.00 C ATOM 1903 NZ LYS A 129 7.886 11.187 -7.656 1.00 0.00 N ATOM 0 H LYS A 129 2.181 14.185 -6.403 1.00 0.00 H new ATOM 0 HA LYS A 129 4.353 16.193 -6.585 1.00 0.00 H new ATOM 0 HB2 LYS A 129 3.930 13.842 -8.400 1.00 0.00 H new ATOM 0 HB3 LYS A 129 4.580 15.350 -9.013 1.00 0.00 H new ATOM 0 HG2 LYS A 129 6.559 15.161 -7.805 1.00 0.00 H new ATOM 0 HG3 LYS A 129 5.798 14.314 -6.473 1.00 0.00 H new ATOM 0 HD2 LYS A 129 5.481 12.507 -8.571 1.00 0.00 H new ATOM 0 HD3 LYS A 129 7.037 13.224 -8.938 1.00 0.00 H new ATOM 0 HE2 LYS A 129 7.529 12.818 -6.358 1.00 0.00 H new ATOM 0 HE3 LYS A 129 6.205 11.675 -6.469 1.00 0.00 H new ATOM 0 HZ1 LYS A 129 8.026 10.397 -6.994 1.00 0.00 H new ATOM 0 HZ2 LYS A 129 7.470 10.829 -8.540 1.00 0.00 H new ATOM 0 HZ3 LYS A 129 8.802 11.634 -7.861 1.00 0.00 H new ATOM 1917 N PRO A 130 2.323 17.568 -7.040 1.00 0.00 N ATOM 1918 CA PRO A 130 1.306 18.496 -7.508 1.00 0.00 C ATOM 1919 C PRO A 130 1.774 19.233 -8.764 1.00 0.00 C ATOM 1920 O PRO A 130 2.955 19.550 -8.899 1.00 0.00 O ATOM 1921 CB PRO A 130 1.052 19.426 -6.333 1.00 0.00 C ATOM 1922 CG PRO A 130 2.256 19.281 -5.418 1.00 0.00 C ATOM 1923 CD PRO A 130 3.027 18.045 -5.853 1.00 0.00 C ATOM 0 HA PRO A 130 0.385 17.996 -7.809 1.00 0.00 H new ATOM 0 HB2 PRO A 130 0.939 20.457 -6.668 1.00 0.00 H new ATOM 0 HB3 PRO A 130 0.132 19.157 -5.814 1.00 0.00 H new ATOM 0 HG2 PRO A 130 2.889 20.166 -5.477 1.00 0.00 H new ATOM 0 HG3 PRO A 130 1.937 19.186 -4.380 1.00 0.00 H new ATOM 0 HD2 PRO A 130 4.066 18.285 -6.079 1.00 0.00 H new ATOM 0 HD3 PRO A 130 3.038 17.289 -5.068 1.00 0.00 H new ATOM 1931 N SER A 131 0.824 19.486 -9.652 1.00 0.00 N ATOM 1932 CA SER A 131 1.123 20.180 -10.893 1.00 0.00 C ATOM 1933 C SER A 131 1.498 21.635 -10.601 1.00 0.00 C ATOM 1934 O SER A 131 0.640 22.517 -10.623 1.00 0.00 O ATOM 1935 CB SER A 131 -0.062 20.121 -11.858 1.00 0.00 C ATOM 1936 OG SER A 131 0.272 20.631 -13.146 1.00 0.00 O ATOM 0 H SER A 131 -0.155 19.222 -9.536 1.00 0.00 H new ATOM 0 HA SER A 131 1.968 19.681 -11.368 1.00 0.00 H new ATOM 0 HB2 SER A 131 -0.401 19.089 -11.953 1.00 0.00 H new ATOM 0 HB3 SER A 131 -0.894 20.693 -11.446 1.00 0.00 H new ATOM 0 HG SER A 131 -0.511 20.575 -13.733 1.00 0.00 H new ATOM 1942 N GLY A 132 2.779 21.841 -10.334 1.00 0.00 N ATOM 1943 CA GLY A 132 3.277 23.173 -10.038 1.00 0.00 C ATOM 1944 C GLY A 132 3.265 24.053 -11.290 1.00 0.00 C ATOM 1945 O GLY A 132 2.380 23.926 -12.134 1.00 0.00 O ATOM 0 H GLY A 132 3.487 21.107 -10.316 1.00 0.00 H new ATOM 0 HA2 GLY A 132 2.664 23.630 -9.262 1.00 0.00 H new ATOM 0 HA3 GLY A 132 4.292 23.107 -9.645 1.00 0.00 H new ATOM 1949 N PRO A 133 4.285 24.950 -11.371 1.00 0.00 N ATOM 1950 CA PRO A 133 4.400 25.851 -12.505 1.00 0.00 C ATOM 1951 C PRO A 133 4.906 25.111 -13.745 1.00 0.00 C ATOM 1952 O PRO A 133 6.092 25.169 -14.066 1.00 0.00 O ATOM 1953 CB PRO A 133 5.344 26.948 -12.042 1.00 0.00 C ATOM 1954 CG PRO A 133 6.085 26.381 -10.841 1.00 0.00 C ATOM 1955 CD PRO A 133 5.351 25.129 -10.390 1.00 0.00 C ATOM 0 HA PRO A 133 3.440 26.271 -12.807 1.00 0.00 H new ATOM 0 HB2 PRO A 133 6.039 27.225 -12.834 1.00 0.00 H new ATOM 0 HB3 PRO A 133 4.793 27.849 -11.771 1.00 0.00 H new ATOM 0 HG2 PRO A 133 7.116 26.145 -11.105 1.00 0.00 H new ATOM 0 HG3 PRO A 133 6.122 27.113 -10.035 1.00 0.00 H new ATOM 0 HD2 PRO A 133 6.017 24.266 -10.367 1.00 0.00 H new ATOM 0 HD3 PRO A 133 4.948 25.247 -9.384 1.00 0.00 H new ATOM 1963 N SER A 134 3.982 24.431 -14.407 1.00 0.00 N ATOM 1964 CA SER A 134 4.319 23.680 -15.605 1.00 0.00 C ATOM 1965 C SER A 134 5.316 24.471 -16.454 1.00 0.00 C ATOM 1966 O SER A 134 5.390 25.694 -16.353 1.00 0.00 O ATOM 1967 CB SER A 134 3.068 23.353 -16.421 1.00 0.00 C ATOM 1968 OG SER A 134 2.707 24.419 -17.296 1.00 0.00 O ATOM 0 H SER A 134 3.000 24.384 -14.137 1.00 0.00 H new ATOM 0 HA SER A 134 4.776 22.738 -15.301 1.00 0.00 H new ATOM 0 HB2 SER A 134 3.242 22.449 -17.004 1.00 0.00 H new ATOM 0 HB3 SER A 134 2.239 23.142 -15.745 1.00 0.00 H new ATOM 0 HG SER A 134 1.904 24.171 -17.801 1.00 0.00 H new ATOM 1974 N SER A 135 6.058 23.739 -17.273 1.00 0.00 N ATOM 1975 CA SER A 135 7.047 24.357 -18.140 1.00 0.00 C ATOM 1976 C SER A 135 6.686 24.108 -19.606 1.00 0.00 C ATOM 1977 O SER A 135 6.595 25.047 -20.395 1.00 0.00 O ATOM 1978 CB SER A 135 8.450 23.826 -17.841 1.00 0.00 C ATOM 1979 OG SER A 135 9.243 24.778 -17.138 1.00 0.00 O ATOM 0 H SER A 135 5.994 22.724 -17.354 1.00 0.00 H new ATOM 0 HA SER A 135 7.046 25.430 -17.950 1.00 0.00 H new ATOM 0 HB2 SER A 135 8.374 22.912 -17.252 1.00 0.00 H new ATOM 0 HB3 SER A 135 8.944 23.562 -18.776 1.00 0.00 H new ATOM 0 HG SER A 135 10.131 24.400 -16.965 1.00 0.00 H new ATOM 1985 N GLY A 136 6.490 22.837 -19.926 1.00 0.00 N ATOM 1986 CA GLY A 136 6.142 22.453 -21.284 1.00 0.00 C ATOM 1987 C GLY A 136 5.764 20.972 -21.354 1.00 0.00 C ATOM 1988 O GLY A 136 6.403 20.197 -22.064 1.00 0.00 O ATOM 0 H GLY A 136 6.565 22.061 -19.269 1.00 0.00 H new ATOM 0 HA2 GLY A 136 5.309 23.062 -21.636 1.00 0.00 H new ATOM 0 HA3 GLY A 136 6.983 22.649 -21.948 1.00 0.00 H new TER 1992 GLY A 136