USER MOD reduce.3.24.130724 H: found=0, std=0, add=1041, rem=0, adj=24 USER MOD reduce.3.24.130724 removed 1041 hydrogens (8 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 NoAdj-H: B1139 PTR HN2 : B1139 PTR N : B1138 GLU C :(H bumps) USER MOD NoAdj-H: B1139 PTR H : B1139 PTR N : B1138 GLU C :(H bumps) USER MOD Set 1.1: A 30 GLN : amide:sc= 1.48 K(o=2.4,f=-0.97) USER MOD Set 1.2: B1136 GLN : amide:sc= 0.874 K(o=2.4,f=0.48) USER MOD Set 2.1: A 61 HIS : no HD1:sc= -2.98! C(o=-3!,f=-9.2!) USER MOD Set 2.2: A 109 CYS SG : rot 170:sc= 0 USER MOD Set 3.1: A 82 SER OG : rot 180:sc= -1.32 USER MOD Set 3.2: B1141 ASN : amide:sc= -0.0864 K(o=-1.4,f=-2.6!) USER MOD Set 4.1: A 29 SER OG : rot -79:sc= 0.773 USER MOD Set 4.2: A 67 HIS : no HD1:sc= -2.31! C(o=-1.5!,f=-6.1!) USER MOD Set 5.1: A 48 SER OG : rot 90:sc= 0.00595 USER MOD Set 5.2: A 49 GLN : amide:sc= -2.76 K(o=-2.8,f=-13!) USER MOD Single : A 1 GLY N :NH3+ -129:sc= 0.0322 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 5 SER OG : rot 180:sc= 0 USER MOD Single : A 7 THR OG1 : rot 180:sc= 0.0603 USER MOD Single : A 8 SER OG : rot 180:sc= 0 USER MOD Single : A 10 SER OG : rot 180:sc= 0 USER MOD Single : A 14 HIS : no HD1:sc= 0.21 K(o=0.21,f=-3.8!) USER MOD Single : A 16 THR OG1 : rot 180:sc= 0 USER MOD Single : A 17 GLN : amide:sc= -0.721 X(o=-0.72,f=-0.45) USER MOD Single : A 21 HIS : no HD1:sc= 0.656 K(o=0.66,f=-4.2!) USER MOD Single : A 25 SER OG : rot 73:sc= 1.73 USER MOD Single : A 35 GLN : amide:sc= 0 X(o=0,f=-0.37) USER MOD Single : A 36 GLN : amide:sc= -0.98! C(o=-0.98!,f=-2.9!) USER MOD Single : A 51 ASN : amide:sc= 0.0687 X(o=0.069,f=0) USER MOD Single : A 53 GLN : amide:sc= 0 K(o=0,f=-0.58) USER MOD Single : A 58 SER OG : rot -41:sc= 1.05 USER MOD Single : A 60 CYS SG : rot 71:sc= 0.561 USER MOD Single : A 63 GLN : amide:sc= 0 X(o=0,f=-0.42) USER MOD Single : A 64 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 66 LYS NZ :NH3+ 176:sc= 1.09 (180deg=1.08) USER MOD Single : A 68 TYR OH : rot 133:sc= -0.105 USER MOD Single : A 73 SER OG : rot 180:sc= 0 USER MOD Single : A 80 TYR OH : rot -166:sc= 1.27 USER MOD Single : A 83 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 87 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 88 THR OG1 : rot 98:sc= 1.35 USER MOD Single : A 91 THR OG1 : rot 180:sc= 0 USER MOD Single : A 95 GLN : amide:sc= 2.45 K(o=2.5,f=-8.6!) USER MOD Single : A 100 HIS : no HE2:sc= 0.942 K(o=0.94,f=-3.2!) USER MOD Single : A 101 GLN : amide:sc= -0.677! C(o=-0.68!,f=-6.7!) USER MOD Single : A 103 ASN : amide:sc= -0.214 K(o=-0.21,f=-4.8!) USER MOD Single : A 113 HIS : no HD1:sc= -2.52 K(o=-2.5,f=-5.1!) USER MOD Single : A 114 CYS SG : rot 180:sc= -0.195 USER MOD Single : A 115 CYS SG : rot 180:sc= 0 USER MOD Single : A 116 THR OG1 : rot 180:sc= 0.00512 USER MOD Single : B1142 GLN : amide:sc= 0 X(o=0,f=-0.31) USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 10.126 -4.355 42.423 1.00 0.00 N ATOM 2 CA GLY A 1 11.373 -5.128 42.215 1.00 0.00 C ATOM 3 C GLY A 1 12.453 -4.308 41.520 1.00 0.00 C ATOM 4 O GLY A 1 12.452 -3.076 41.586 1.00 0.00 O ATOM 0 H1 GLY A 1 9.833 -4.431 43.418 1.00 0.00 H new ATOM 0 H2 GLY A 1 10.293 -3.356 42.186 1.00 0.00 H new ATOM 0 H3 GLY A 1 9.376 -4.735 41.811 1.00 0.00 H new ATOM 0 HA2 GLY A 1 11.747 -5.476 43.178 1.00 0.00 H new ATOM 0 HA3 GLY A 1 11.153 -6.014 41.620 1.00 0.00 H new ATOM 10 N SER A 2 13.392 -4.984 40.851 1.00 0.00 N ATOM 11 CA SER A 2 14.524 -4.358 40.137 1.00 0.00 C ATOM 12 C SER A 2 14.084 -3.555 38.894 1.00 0.00 C ATOM 13 O SER A 2 13.086 -3.920 38.255 1.00 0.00 O ATOM 14 CB SER A 2 15.537 -5.433 39.710 1.00 0.00 C ATOM 15 OG SER A 2 16.010 -6.150 40.841 1.00 0.00 O ATOM 0 H SER A 2 13.392 -6.002 40.786 1.00 0.00 H new ATOM 0 HA SER A 2 14.981 -3.656 40.835 1.00 0.00 H new ATOM 0 HB2 SER A 2 15.070 -6.121 39.005 1.00 0.00 H new ATOM 0 HB3 SER A 2 16.375 -4.966 39.192 1.00 0.00 H new ATOM 0 HG SER A 2 16.652 -6.831 40.551 1.00 0.00 H new ATOM 21 N PRO A 3 14.816 -2.488 38.505 1.00 0.00 N ATOM 22 CA PRO A 3 14.526 -1.707 37.300 1.00 0.00 C ATOM 23 C PRO A 3 14.799 -2.491 36.003 1.00 0.00 C ATOM 24 O PRO A 3 15.597 -3.436 35.977 1.00 0.00 O ATOM 25 CB PRO A 3 15.401 -0.452 37.409 1.00 0.00 C ATOM 26 CG PRO A 3 16.606 -0.941 38.211 1.00 0.00 C ATOM 27 CD PRO A 3 15.983 -1.939 39.185 1.00 0.00 C ATOM 0 HA PRO A 3 13.467 -1.456 37.242 1.00 0.00 H new ATOM 0 HB2 PRO A 3 15.694 -0.078 36.428 1.00 0.00 H new ATOM 0 HB3 PRO A 3 14.881 0.360 37.917 1.00 0.00 H new ATOM 0 HG2 PRO A 3 17.353 -1.412 37.572 1.00 0.00 H new ATOM 0 HG3 PRO A 3 17.103 -0.123 38.733 1.00 0.00 H new ATOM 0 HD2 PRO A 3 16.691 -2.727 39.443 1.00 0.00 H new ATOM 0 HD3 PRO A 3 15.698 -1.450 40.116 1.00 0.00 H new ATOM 35 N ALA A 4 14.145 -2.079 34.912 1.00 0.00 N ATOM 36 CA ALA A 4 14.239 -2.696 33.583 1.00 0.00 C ATOM 37 C ALA A 4 14.123 -1.659 32.441 1.00 0.00 C ATOM 38 O ALA A 4 13.670 -0.528 32.647 1.00 0.00 O ATOM 39 CB ALA A 4 13.151 -3.773 33.474 1.00 0.00 C ATOM 0 H ALA A 4 13.513 -1.279 34.930 1.00 0.00 H new ATOM 0 HA ALA A 4 15.225 -3.148 33.472 1.00 0.00 H new ATOM 0 HB1 ALA A 4 13.203 -4.245 32.493 1.00 0.00 H new ATOM 0 HB2 ALA A 4 13.305 -4.526 34.247 1.00 0.00 H new ATOM 0 HB3 ALA A 4 12.171 -3.314 33.605 1.00 0.00 H new ATOM 45 N SER A 5 14.516 -2.062 31.228 1.00 0.00 N ATOM 46 CA SER A 5 14.456 -1.261 29.991 1.00 0.00 C ATOM 47 C SER A 5 14.024 -2.101 28.776 1.00 0.00 C ATOM 48 O SER A 5 14.060 -3.337 28.805 1.00 0.00 O ATOM 49 CB SER A 5 15.809 -0.577 29.738 1.00 0.00 C ATOM 50 OG SER A 5 16.854 -1.526 29.583 1.00 0.00 O ATOM 0 H SER A 5 14.901 -2.993 31.070 1.00 0.00 H new ATOM 0 HA SER A 5 13.694 -0.494 30.128 1.00 0.00 H new ATOM 0 HB2 SER A 5 15.743 0.042 28.843 1.00 0.00 H new ATOM 0 HB3 SER A 5 16.042 0.089 30.569 1.00 0.00 H new ATOM 0 HG SER A 5 17.700 -1.058 29.422 1.00 0.00 H new ATOM 56 N GLY A 6 13.591 -1.435 27.696 1.00 0.00 N ATOM 57 CA GLY A 6 13.046 -2.088 26.496 1.00 0.00 C ATOM 58 C GLY A 6 11.675 -2.740 26.734 1.00 0.00 C ATOM 59 O GLY A 6 10.873 -2.257 27.541 1.00 0.00 O ATOM 0 H GLY A 6 13.609 -0.417 27.630 1.00 0.00 H new ATOM 0 HA2 GLY A 6 12.958 -1.351 25.697 1.00 0.00 H new ATOM 0 HA3 GLY A 6 13.748 -2.848 26.153 1.00 0.00 H new ATOM 63 N THR A 7 11.394 -3.840 26.027 1.00 0.00 N ATOM 64 CA THR A 7 10.157 -4.635 26.164 1.00 0.00 C ATOM 65 C THR A 7 10.399 -6.134 25.946 1.00 0.00 C ATOM 66 O THR A 7 11.303 -6.533 25.207 1.00 0.00 O ATOM 67 CB THR A 7 9.052 -4.108 25.227 1.00 0.00 C ATOM 68 OG1 THR A 7 7.856 -4.825 25.440 1.00 0.00 O ATOM 69 CG2 THR A 7 9.376 -4.216 23.735 1.00 0.00 C ATOM 0 H THR A 7 12.032 -4.216 25.326 1.00 0.00 H new ATOM 0 HA THR A 7 9.817 -4.517 27.193 1.00 0.00 H new ATOM 0 HB THR A 7 8.959 -3.051 25.475 1.00 0.00 H new ATOM 0 HG1 THR A 7 7.159 -4.483 24.842 1.00 0.00 H new ATOM 0 HG21 THR A 7 8.543 -3.822 23.152 1.00 0.00 H new ATOM 0 HG22 THR A 7 10.276 -3.642 23.516 1.00 0.00 H new ATOM 0 HG23 THR A 7 9.540 -5.261 23.473 1.00 0.00 H new ATOM 77 N SER A 8 9.574 -6.972 26.584 1.00 0.00 N ATOM 78 CA SER A 8 9.557 -8.436 26.429 1.00 0.00 C ATOM 79 C SER A 8 8.623 -8.926 25.307 1.00 0.00 C ATOM 80 O SER A 8 8.564 -10.127 25.028 1.00 0.00 O ATOM 81 CB SER A 8 9.197 -9.092 27.770 1.00 0.00 C ATOM 82 OG SER A 8 7.933 -8.636 28.232 1.00 0.00 O ATOM 0 H SER A 8 8.874 -6.640 27.247 1.00 0.00 H new ATOM 0 HA SER A 8 10.560 -8.737 26.127 1.00 0.00 H new ATOM 0 HB2 SER A 8 9.178 -10.176 27.656 1.00 0.00 H new ATOM 0 HB3 SER A 8 9.964 -8.862 28.510 1.00 0.00 H new ATOM 0 HG SER A 8 7.722 -9.067 29.086 1.00 0.00 H new ATOM 88 N LEU A 9 7.906 -8.009 24.643 1.00 0.00 N ATOM 89 CA LEU A 9 6.978 -8.295 23.544 1.00 0.00 C ATOM 90 C LEU A 9 7.708 -8.909 22.329 1.00 0.00 C ATOM 91 O LEU A 9 8.679 -8.339 21.823 1.00 0.00 O ATOM 92 CB LEU A 9 6.244 -6.988 23.182 1.00 0.00 C ATOM 93 CG LEU A 9 5.214 -7.102 22.039 1.00 0.00 C ATOM 94 CD1 LEU A 9 4.065 -8.055 22.375 1.00 0.00 C ATOM 95 CD2 LEU A 9 4.622 -5.726 21.742 1.00 0.00 C ATOM 0 H LEU A 9 7.959 -7.015 24.865 1.00 0.00 H new ATOM 0 HA LEU A 9 6.249 -9.042 23.859 1.00 0.00 H new ATOM 0 HB2 LEU A 9 5.734 -6.619 24.072 1.00 0.00 H new ATOM 0 HB3 LEU A 9 6.986 -6.239 22.906 1.00 0.00 H new ATOM 0 HG LEU A 9 5.746 -7.499 21.174 1.00 0.00 H new ATOM 0 HD11 LEU A 9 3.370 -8.097 21.536 1.00 0.00 H new ATOM 0 HD12 LEU A 9 4.463 -9.051 22.567 1.00 0.00 H new ATOM 0 HD13 LEU A 9 3.542 -7.696 23.262 1.00 0.00 H new ATOM 0 HD21 LEU A 9 3.895 -5.809 20.934 1.00 0.00 H new ATOM 0 HD22 LEU A 9 4.130 -5.341 22.635 1.00 0.00 H new ATOM 0 HD23 LEU A 9 5.418 -5.044 21.444 1.00 0.00 H new ATOM 107 N SER A 10 7.217 -10.055 21.846 1.00 0.00 N ATOM 108 CA SER A 10 7.819 -10.828 20.741 1.00 0.00 C ATOM 109 C SER A 10 7.291 -10.477 19.340 1.00 0.00 C ATOM 110 O SER A 10 7.852 -10.919 18.335 1.00 0.00 O ATOM 111 CB SER A 10 7.655 -12.329 21.021 1.00 0.00 C ATOM 112 OG SER A 10 6.281 -12.663 21.166 1.00 0.00 O ATOM 0 H SER A 10 6.370 -10.486 22.217 1.00 0.00 H new ATOM 0 HA SER A 10 8.873 -10.551 20.717 1.00 0.00 H new ATOM 0 HB2 SER A 10 8.091 -12.906 20.206 1.00 0.00 H new ATOM 0 HB3 SER A 10 8.198 -12.597 21.928 1.00 0.00 H new ATOM 0 HG SER A 10 6.195 -13.623 21.342 1.00 0.00 H new ATOM 118 N ALA A 11 6.235 -9.663 19.266 1.00 0.00 N ATOM 119 CA ALA A 11 5.593 -9.209 18.029 1.00 0.00 C ATOM 120 C ALA A 11 6.032 -7.786 17.625 1.00 0.00 C ATOM 121 O ALA A 11 6.234 -6.915 18.475 1.00 0.00 O ATOM 122 CB ALA A 11 4.071 -9.321 18.199 1.00 0.00 C ATOM 0 H ALA A 11 5.785 -9.287 20.100 1.00 0.00 H new ATOM 0 HA ALA A 11 5.912 -9.849 17.207 1.00 0.00 H new ATOM 0 HB1 ALA A 11 3.577 -8.987 17.286 1.00 0.00 H new ATOM 0 HB2 ALA A 11 3.802 -10.359 18.398 1.00 0.00 H new ATOM 0 HB3 ALA A 11 3.751 -8.697 19.034 1.00 0.00 H new ATOM 128 N ALA A 12 6.133 -7.532 16.316 1.00 0.00 N ATOM 129 CA ALA A 12 6.574 -6.257 15.735 1.00 0.00 C ATOM 130 C ALA A 12 5.428 -5.218 15.643 1.00 0.00 C ATOM 131 O ALA A 12 5.121 -4.695 14.570 1.00 0.00 O ATOM 132 CB ALA A 12 7.262 -6.554 14.393 1.00 0.00 C ATOM 0 H ALA A 12 5.903 -8.230 15.608 1.00 0.00 H new ATOM 0 HA ALA A 12 7.299 -5.778 16.393 1.00 0.00 H new ATOM 0 HB1 ALA A 12 7.598 -5.620 13.942 1.00 0.00 H new ATOM 0 HB2 ALA A 12 8.119 -7.206 14.560 1.00 0.00 H new ATOM 0 HB3 ALA A 12 6.557 -7.047 13.724 1.00 0.00 H new ATOM 138 N ILE A 13 4.763 -4.944 16.771 1.00 0.00 N ATOM 139 CA ILE A 13 3.619 -4.020 16.852 1.00 0.00 C ATOM 140 C ILE A 13 4.090 -2.559 16.735 1.00 0.00 C ATOM 141 O ILE A 13 5.003 -2.131 17.448 1.00 0.00 O ATOM 142 CB ILE A 13 2.805 -4.260 18.146 1.00 0.00 C ATOM 143 CG1 ILE A 13 2.398 -5.739 18.354 1.00 0.00 C ATOM 144 CG2 ILE A 13 1.555 -3.363 18.184 1.00 0.00 C ATOM 145 CD1 ILE A 13 1.598 -6.382 17.212 1.00 0.00 C ATOM 0 H ILE A 13 5.006 -5.363 17.669 1.00 0.00 H new ATOM 0 HA ILE A 13 2.955 -4.219 16.011 1.00 0.00 H new ATOM 0 HB ILE A 13 3.471 -3.996 18.967 1.00 0.00 H new ATOM 0 HG12 ILE A 13 3.303 -6.326 18.513 1.00 0.00 H new ATOM 0 HG13 ILE A 13 1.809 -5.808 19.268 1.00 0.00 H new ATOM 0 HG21 ILE A 13 1.000 -3.551 19.103 1.00 0.00 H new ATOM 0 HG22 ILE A 13 1.857 -2.316 18.150 1.00 0.00 H new ATOM 0 HG23 ILE A 13 0.921 -3.586 17.326 1.00 0.00 H new ATOM 0 HD11 ILE A 13 1.368 -7.417 17.466 1.00 0.00 H new ATOM 0 HD12 ILE A 13 0.670 -5.830 17.062 1.00 0.00 H new ATOM 0 HD13 ILE A 13 2.187 -6.356 16.295 1.00 0.00 H new ATOM 157 N HIS A 14 3.456 -1.789 15.846 1.00 0.00 N ATOM 158 CA HIS A 14 3.756 -0.374 15.573 1.00 0.00 C ATOM 159 C HIS A 14 2.811 0.597 16.304 1.00 0.00 C ATOM 160 O HIS A 14 1.696 0.231 16.688 1.00 0.00 O ATOM 161 CB HIS A 14 3.729 -0.145 14.053 1.00 0.00 C ATOM 162 CG HIS A 14 2.375 -0.363 13.418 1.00 0.00 C ATOM 163 ND1 HIS A 14 1.781 -1.609 13.184 1.00 0.00 N ATOM 164 CD2 HIS A 14 1.550 0.615 12.943 1.00 0.00 C ATOM 165 CE1 HIS A 14 0.600 -1.348 12.594 1.00 0.00 C ATOM 166 NE2 HIS A 14 0.441 -0.023 12.431 1.00 0.00 N ATOM 0 H HIS A 14 2.690 -2.144 15.273 1.00 0.00 H new ATOM 0 HA HIS A 14 4.750 -0.158 15.964 1.00 0.00 H new ATOM 0 HB2 HIS A 14 4.056 0.874 13.844 1.00 0.00 H new ATOM 0 HB3 HIS A 14 4.450 -0.814 13.583 1.00 0.00 H new ATOM 0 HD2 HIS A 14 1.731 1.680 12.964 1.00 0.00 H new ATOM 0 HE1 HIS A 14 -0.118 -2.097 12.294 1.00 0.00 H new ATOM 0 HE2 HIS A 14 -0.364 0.433 12.001 1.00 0.00 H new ATOM 174 N ARG A 15 3.256 1.854 16.470 1.00 0.00 N ATOM 175 CA ARG A 15 2.502 2.930 17.169 1.00 0.00 C ATOM 176 C ARG A 15 2.496 4.312 16.510 1.00 0.00 C ATOM 177 O ARG A 15 1.968 5.289 17.041 1.00 0.00 O ATOM 178 CB ARG A 15 2.978 2.998 18.633 1.00 0.00 C ATOM 179 CG ARG A 15 4.474 3.369 18.723 1.00 0.00 C ATOM 180 CD ARG A 15 4.936 3.596 20.167 1.00 0.00 C ATOM 181 NE ARG A 15 4.333 4.808 20.763 1.00 0.00 N ATOM 182 CZ ARG A 15 4.477 5.229 22.007 1.00 0.00 C ATOM 183 NH1 ARG A 15 5.206 4.584 22.877 1.00 0.00 N ATOM 184 NH2 ARG A 15 3.888 6.319 22.408 1.00 0.00 N ATOM 0 H ARG A 15 4.162 2.164 16.120 1.00 0.00 H new ATOM 0 HA ARG A 15 1.453 2.641 17.104 1.00 0.00 H new ATOM 0 HB2 ARG A 15 2.386 3.735 19.176 1.00 0.00 H new ATOM 0 HB3 ARG A 15 2.811 2.036 19.117 1.00 0.00 H new ATOM 0 HG2 ARG A 15 5.070 2.574 18.275 1.00 0.00 H new ATOM 0 HG3 ARG A 15 4.657 4.272 18.140 1.00 0.00 H new ATOM 0 HD2 ARG A 15 4.674 2.727 20.771 1.00 0.00 H new ATOM 0 HD3 ARG A 15 6.022 3.684 20.189 1.00 0.00 H new ATOM 0 HE ARG A 15 3.747 5.376 20.152 1.00 0.00 H new ATOM 0 HH11 ARG A 15 5.686 3.726 22.604 1.00 0.00 H new ATOM 0 HH12 ARG A 15 5.295 4.938 23.830 1.00 0.00 H new ATOM 0 HH21 ARG A 15 3.310 6.855 21.760 1.00 0.00 H new ATOM 0 HH22 ARG A 15 4.004 6.637 23.370 1.00 0.00 H new ATOM 198 N THR A 16 3.133 4.356 15.357 1.00 0.00 N ATOM 199 CA THR A 16 3.330 5.511 14.458 1.00 0.00 C ATOM 200 C THR A 16 3.247 5.071 12.991 1.00 0.00 C ATOM 201 O THR A 16 3.125 3.882 12.694 1.00 0.00 O ATOM 202 CB THR A 16 4.687 6.203 14.726 1.00 0.00 C ATOM 203 OG1 THR A 16 5.734 5.266 14.625 1.00 0.00 O ATOM 204 CG2 THR A 16 4.775 6.869 16.098 1.00 0.00 C ATOM 0 H THR A 16 3.571 3.517 14.978 1.00 0.00 H new ATOM 0 HA THR A 16 2.534 6.228 14.659 1.00 0.00 H new ATOM 0 HB THR A 16 4.775 6.985 13.971 1.00 0.00 H new ATOM 0 HG1 THR A 16 6.590 5.712 14.794 1.00 0.00 H new ATOM 0 HG21 THR A 16 5.754 7.333 16.215 1.00 0.00 H new ATOM 0 HG22 THR A 16 4.000 7.631 16.183 1.00 0.00 H new ATOM 0 HG23 THR A 16 4.634 6.119 16.876 1.00 0.00 H new ATOM 212 N GLN A 17 3.397 6.015 12.058 1.00 0.00 N ATOM 213 CA GLN A 17 3.462 5.776 10.604 1.00 0.00 C ATOM 214 C GLN A 17 4.784 5.116 10.132 1.00 0.00 C ATOM 215 O GLN A 17 5.099 5.160 8.945 1.00 0.00 O ATOM 216 CB GLN A 17 3.156 7.098 9.863 1.00 0.00 C ATOM 217 CG GLN A 17 4.323 8.101 9.701 1.00 0.00 C ATOM 218 CD GLN A 17 5.179 8.307 10.950 1.00 0.00 C ATOM 219 OE1 GLN A 17 6.298 7.829 11.063 1.00 0.00 O ATOM 220 NE2 GLN A 17 4.680 8.997 11.954 1.00 0.00 N ATOM 0 H GLN A 17 3.480 7.003 12.297 1.00 0.00 H new ATOM 0 HA GLN A 17 2.701 5.038 10.352 1.00 0.00 H new ATOM 0 HB2 GLN A 17 2.782 6.850 8.869 1.00 0.00 H new ATOM 0 HB3 GLN A 17 2.347 7.603 10.391 1.00 0.00 H new ATOM 0 HG2 GLN A 17 4.967 7.758 8.891 1.00 0.00 H new ATOM 0 HG3 GLN A 17 3.914 9.064 9.397 1.00 0.00 H new ATOM 0 HE21 GLN A 17 3.748 9.404 11.880 1.00 0.00 H new ATOM 0 HE22 GLN A 17 5.226 9.124 12.806 1.00 0.00 H new ATOM 229 N LEU A 18 5.555 4.484 11.032 1.00 0.00 N ATOM 230 CA LEU A 18 6.891 3.915 10.781 1.00 0.00 C ATOM 231 C LEU A 18 7.047 2.834 9.678 1.00 0.00 C ATOM 232 O LEU A 18 8.168 2.389 9.420 1.00 0.00 O ATOM 233 CB LEU A 18 7.511 3.518 12.133 1.00 0.00 C ATOM 234 CG LEU A 18 6.795 2.410 12.933 1.00 0.00 C ATOM 235 CD1 LEU A 18 6.759 1.053 12.230 1.00 0.00 C ATOM 236 CD2 LEU A 18 7.519 2.209 14.267 1.00 0.00 C ATOM 0 H LEU A 18 5.252 4.349 11.997 1.00 0.00 H new ATOM 0 HA LEU A 18 7.459 4.715 10.305 1.00 0.00 H new ATOM 0 HB2 LEU A 18 8.537 3.197 11.954 1.00 0.00 H new ATOM 0 HB3 LEU A 18 7.560 4.410 12.758 1.00 0.00 H new ATOM 0 HG LEU A 18 5.766 2.749 13.054 1.00 0.00 H new ATOM 0 HD11 LEU A 18 6.239 0.331 12.859 1.00 0.00 H new ATOM 0 HD12 LEU A 18 6.235 1.150 11.279 1.00 0.00 H new ATOM 0 HD13 LEU A 18 7.778 0.709 12.050 1.00 0.00 H new ATOM 0 HD21 LEU A 18 7.019 1.427 14.838 1.00 0.00 H new ATOM 0 HD22 LEU A 18 8.552 1.917 14.080 1.00 0.00 H new ATOM 0 HD23 LEU A 18 7.502 3.140 14.834 1.00 0.00 H new ATOM 248 N TRP A 19 5.968 2.459 8.984 1.00 0.00 N ATOM 249 CA TRP A 19 5.983 1.532 7.839 1.00 0.00 C ATOM 250 C TRP A 19 5.981 2.278 6.487 1.00 0.00 C ATOM 251 O TRP A 19 6.162 1.663 5.436 1.00 0.00 O ATOM 252 CB TRP A 19 4.759 0.609 7.922 1.00 0.00 C ATOM 253 CG TRP A 19 4.659 -0.298 9.112 1.00 0.00 C ATOM 254 CD1 TRP A 19 3.550 -0.447 9.871 1.00 0.00 C ATOM 255 CD2 TRP A 19 5.657 -1.211 9.682 1.00 0.00 C ATOM 256 NE1 TRP A 19 3.775 -1.394 10.845 1.00 0.00 N ATOM 257 CE2 TRP A 19 5.059 -1.888 10.790 1.00 0.00 C ATOM 258 CE3 TRP A 19 7.005 -1.534 9.393 1.00 0.00 C ATOM 259 CZ2 TRP A 19 5.754 -2.821 11.570 1.00 0.00 C ATOM 260 CZ3 TRP A 19 7.716 -2.466 10.178 1.00 0.00 C ATOM 261 CH2 TRP A 19 7.095 -3.108 11.264 1.00 0.00 C ATOM 0 H TRP A 19 5.032 2.799 9.206 1.00 0.00 H new ATOM 0 HA TRP A 19 6.903 0.950 7.889 1.00 0.00 H new ATOM 0 HB2 TRP A 19 3.865 1.232 7.897 1.00 0.00 H new ATOM 0 HB3 TRP A 19 4.742 -0.009 7.025 1.00 0.00 H new ATOM 0 HD1 TRP A 19 2.626 0.095 9.734 1.00 0.00 H new ATOM 0 HE1 TRP A 19 3.076 -1.693 11.525 1.00 0.00 H new ATOM 0 HE3 TRP A 19 7.497 -1.059 8.557 1.00 0.00 H new ATOM 0 HZ2 TRP A 19 5.265 -3.314 12.397 1.00 0.00 H new ATOM 0 HZ3 TRP A 19 8.746 -2.688 9.943 1.00 0.00 H new ATOM 0 HH2 TRP A 19 7.647 -3.819 11.861 1.00 0.00 H new ATOM 272 N PHE A 20 5.789 3.598 6.501 1.00 0.00 N ATOM 273 CA PHE A 20 5.708 4.448 5.315 1.00 0.00 C ATOM 274 C PHE A 20 7.095 4.702 4.688 1.00 0.00 C ATOM 275 O PHE A 20 8.036 5.112 5.375 1.00 0.00 O ATOM 276 CB PHE A 20 5.016 5.750 5.736 1.00 0.00 C ATOM 277 CG PHE A 20 4.722 6.715 4.606 1.00 0.00 C ATOM 278 CD1 PHE A 20 3.567 6.546 3.820 1.00 0.00 C ATOM 279 CD2 PHE A 20 5.588 7.799 4.354 1.00 0.00 C ATOM 280 CE1 PHE A 20 3.271 7.463 2.794 1.00 0.00 C ATOM 281 CE2 PHE A 20 5.293 8.714 3.329 1.00 0.00 C ATOM 282 CZ PHE A 20 4.132 8.548 2.553 1.00 0.00 C ATOM 0 H PHE A 20 5.682 4.122 7.370 1.00 0.00 H new ATOM 0 HA PHE A 20 5.131 3.952 4.535 1.00 0.00 H new ATOM 0 HB2 PHE A 20 4.079 5.501 6.234 1.00 0.00 H new ATOM 0 HB3 PHE A 20 5.643 6.255 6.471 1.00 0.00 H new ATOM 0 HD1 PHE A 20 2.907 5.711 4.004 1.00 0.00 H new ATOM 0 HD2 PHE A 20 6.480 7.926 4.950 1.00 0.00 H new ATOM 0 HE1 PHE A 20 2.383 7.333 2.193 1.00 0.00 H new ATOM 0 HE2 PHE A 20 5.957 9.544 3.137 1.00 0.00 H new ATOM 0 HZ PHE A 20 3.901 9.255 1.770 1.00 0.00 H new ATOM 292 N HIS A 21 7.222 4.446 3.381 1.00 0.00 N ATOM 293 CA HIS A 21 8.453 4.602 2.584 1.00 0.00 C ATOM 294 C HIS A 21 8.121 5.155 1.191 1.00 0.00 C ATOM 295 O HIS A 21 7.055 4.831 0.678 1.00 0.00 O ATOM 296 CB HIS A 21 9.123 3.216 2.468 1.00 0.00 C ATOM 297 CG HIS A 21 10.599 3.286 2.179 1.00 0.00 C ATOM 298 ND1 HIS A 21 11.167 3.663 0.958 1.00 0.00 N ATOM 299 CD2 HIS A 21 11.596 2.992 3.060 1.00 0.00 C ATOM 300 CE1 HIS A 21 12.496 3.576 1.134 1.00 0.00 C ATOM 301 NE2 HIS A 21 12.782 3.179 2.385 1.00 0.00 N ATOM 0 H HIS A 21 6.438 4.110 2.822 1.00 0.00 H new ATOM 0 HA HIS A 21 9.129 5.307 3.068 1.00 0.00 H new ATOM 0 HB2 HIS A 21 8.968 2.667 3.397 1.00 0.00 H new ATOM 0 HB3 HIS A 21 8.632 2.649 1.677 1.00 0.00 H new ATOM 0 HD2 HIS A 21 11.479 2.675 4.086 1.00 0.00 H new ATOM 0 HE1 HIS A 21 13.232 3.795 0.375 1.00 0.00 H new ATOM 0 HE2 HIS A 21 13.717 3.040 2.769 1.00 0.00 H new ATOM 309 N GLY A 22 8.952 5.956 0.513 1.00 0.00 N ATOM 310 CA GLY A 22 8.646 6.351 -0.858 1.00 0.00 C ATOM 311 C GLY A 22 9.893 6.383 -1.695 1.00 0.00 C ATOM 312 O GLY A 22 10.064 7.302 -2.478 1.00 0.00 O ATOM 0 H GLY A 22 9.823 6.334 0.886 1.00 0.00 H new ATOM 0 HA2 GLY A 22 7.930 5.653 -1.291 1.00 0.00 H new ATOM 0 HA3 GLY A 22 8.175 7.334 -0.861 1.00 0.00 H new ATOM 316 N ARG A 23 10.771 5.396 -1.504 1.00 0.00 N ATOM 317 CA ARG A 23 11.987 5.202 -2.298 1.00 0.00 C ATOM 318 C ARG A 23 12.272 3.702 -2.456 1.00 0.00 C ATOM 319 O ARG A 23 13.374 3.208 -2.238 1.00 0.00 O ATOM 320 CB ARG A 23 13.087 6.127 -1.696 1.00 0.00 C ATOM 321 CG ARG A 23 14.610 5.882 -1.831 1.00 0.00 C ATOM 322 CD ARG A 23 15.232 5.988 -3.234 1.00 0.00 C ATOM 323 NE ARG A 23 15.838 4.720 -3.678 1.00 0.00 N ATOM 324 CZ ARG A 23 15.315 3.825 -4.497 1.00 0.00 C ATOM 325 NH1 ARG A 23 14.198 4.004 -5.143 1.00 0.00 N ATOM 326 NH2 ARG A 23 15.917 2.691 -4.689 1.00 0.00 N ATOM 0 H ARG A 23 10.654 4.692 -0.775 1.00 0.00 H new ATOM 0 HA ARG A 23 11.909 5.519 -3.338 1.00 0.00 H new ATOM 0 HB2 ARG A 23 12.904 7.120 -2.106 1.00 0.00 H new ATOM 0 HB3 ARG A 23 12.884 6.181 -0.626 1.00 0.00 H new ATOM 0 HG2 ARG A 23 15.122 6.593 -1.183 1.00 0.00 H new ATOM 0 HG3 ARG A 23 14.825 4.886 -1.444 1.00 0.00 H new ATOM 0 HD2 ARG A 23 14.464 6.290 -3.947 1.00 0.00 H new ATOM 0 HD3 ARG A 23 15.992 6.770 -3.233 1.00 0.00 H new ATOM 0 HE ARG A 23 16.766 4.510 -3.311 1.00 0.00 H new ATOM 0 HH11 ARG A 23 13.677 4.874 -5.030 1.00 0.00 H new ATOM 0 HH12 ARG A 23 13.844 3.275 -5.762 1.00 0.00 H new ATOM 0 HH21 ARG A 23 16.794 2.491 -4.208 1.00 0.00 H new ATOM 0 HH22 ARG A 23 15.513 2.000 -5.321 1.00 0.00 H new ATOM 340 N ILE A 24 11.217 2.964 -2.812 1.00 0.00 N ATOM 341 CA ILE A 24 11.272 1.530 -3.124 1.00 0.00 C ATOM 342 C ILE A 24 10.169 1.188 -4.148 1.00 0.00 C ATOM 343 O ILE A 24 9.073 0.762 -3.801 1.00 0.00 O ATOM 344 CB ILE A 24 11.292 0.715 -1.801 1.00 0.00 C ATOM 345 CG1 ILE A 24 11.808 -0.708 -2.098 1.00 0.00 C ATOM 346 CG2 ILE A 24 9.983 0.735 -0.996 1.00 0.00 C ATOM 347 CD1 ILE A 24 11.871 -1.642 -0.883 1.00 0.00 C ATOM 0 H ILE A 24 10.278 3.355 -2.894 1.00 0.00 H new ATOM 0 HA ILE A 24 12.196 1.242 -3.625 1.00 0.00 H new ATOM 0 HB ILE A 24 11.983 1.217 -1.123 1.00 0.00 H new ATOM 0 HG12 ILE A 24 11.165 -1.161 -2.853 1.00 0.00 H new ATOM 0 HG13 ILE A 24 12.805 -0.633 -2.532 1.00 0.00 H new ATOM 0 HG21 ILE A 24 10.102 0.137 -0.092 1.00 0.00 H new ATOM 0 HG22 ILE A 24 9.740 1.762 -0.722 1.00 0.00 H new ATOM 0 HG23 ILE A 24 9.177 0.320 -1.602 1.00 0.00 H new ATOM 0 HD11 ILE A 24 12.246 -2.618 -1.193 1.00 0.00 H new ATOM 0 HD12 ILE A 24 12.539 -1.219 -0.133 1.00 0.00 H new ATOM 0 HD13 ILE A 24 10.873 -1.755 -0.458 1.00 0.00 H new ATOM 359 N SER A 25 10.445 1.452 -5.431 1.00 0.00 N ATOM 360 CA SER A 25 9.504 1.309 -6.563 1.00 0.00 C ATOM 361 C SER A 25 9.008 -0.124 -6.780 1.00 0.00 C ATOM 362 O SER A 25 9.593 -1.086 -6.288 1.00 0.00 O ATOM 363 CB SER A 25 10.164 1.840 -7.846 1.00 0.00 C ATOM 364 OG SER A 25 9.213 2.082 -8.872 1.00 0.00 O ATOM 0 H SER A 25 11.363 1.784 -5.727 1.00 0.00 H new ATOM 0 HA SER A 25 8.621 1.896 -6.312 1.00 0.00 H new ATOM 0 HB2 SER A 25 10.700 2.763 -7.623 1.00 0.00 H new ATOM 0 HB3 SER A 25 10.903 1.120 -8.199 1.00 0.00 H new ATOM 0 HG SER A 25 8.693 2.884 -8.654 1.00 0.00 H new ATOM 370 N ARG A 26 7.933 -0.292 -7.549 1.00 0.00 N ATOM 371 CA ARG A 26 7.229 -1.570 -7.807 1.00 0.00 C ATOM 372 C ARG A 26 8.082 -2.746 -8.298 1.00 0.00 C ATOM 373 O ARG A 26 7.738 -3.889 -8.025 1.00 0.00 O ATOM 374 CB ARG A 26 6.029 -1.287 -8.740 1.00 0.00 C ATOM 375 CG ARG A 26 6.347 -1.048 -10.229 1.00 0.00 C ATOM 376 CD ARG A 26 7.230 0.176 -10.505 1.00 0.00 C ATOM 377 NE ARG A 26 7.251 0.535 -11.936 1.00 0.00 N ATOM 378 CZ ARG A 26 7.958 1.499 -12.488 1.00 0.00 C ATOM 379 NH1 ARG A 26 8.762 2.265 -11.802 1.00 0.00 N ATOM 380 NH2 ARG A 26 7.828 1.725 -13.757 1.00 0.00 N ATOM 0 H ARG A 26 7.500 0.491 -8.038 1.00 0.00 H new ATOM 0 HA ARG A 26 6.898 -1.932 -6.834 1.00 0.00 H new ATOM 0 HB2 ARG A 26 5.339 -2.128 -8.671 1.00 0.00 H new ATOM 0 HB3 ARG A 26 5.503 -0.411 -8.360 1.00 0.00 H new ATOM 0 HG2 ARG A 26 6.841 -1.934 -10.628 1.00 0.00 H new ATOM 0 HG3 ARG A 26 5.410 -0.934 -10.773 1.00 0.00 H new ATOM 0 HD2 ARG A 26 6.865 1.024 -9.925 1.00 0.00 H new ATOM 0 HD3 ARG A 26 8.246 -0.028 -10.168 1.00 0.00 H new ATOM 0 HE ARG A 26 6.661 -0.017 -12.558 1.00 0.00 H new ATOM 0 HH11 ARG A 26 8.862 2.129 -10.796 1.00 0.00 H new ATOM 0 HH12 ARG A 26 9.291 3.000 -12.272 1.00 0.00 H new ATOM 0 HH21 ARG A 26 7.186 1.160 -14.312 1.00 0.00 H new ATOM 0 HH22 ARG A 26 8.368 2.468 -14.201 1.00 0.00 H new ATOM 394 N GLU A 27 9.194 -2.469 -8.982 1.00 0.00 N ATOM 395 CA GLU A 27 10.151 -3.487 -9.454 1.00 0.00 C ATOM 396 C GLU A 27 11.113 -3.952 -8.342 1.00 0.00 C ATOM 397 O GLU A 27 11.378 -5.143 -8.191 1.00 0.00 O ATOM 398 CB GLU A 27 10.963 -2.932 -10.640 1.00 0.00 C ATOM 399 CG GLU A 27 10.109 -2.554 -11.859 1.00 0.00 C ATOM 400 CD GLU A 27 11.003 -2.069 -13.018 1.00 0.00 C ATOM 401 OE1 GLU A 27 11.540 -0.936 -12.934 1.00 0.00 O ATOM 402 OE2 GLU A 27 11.178 -2.814 -14.013 1.00 0.00 O ATOM 0 H GLU A 27 9.464 -1.517 -9.230 1.00 0.00 H new ATOM 0 HA GLU A 27 9.570 -4.354 -9.768 1.00 0.00 H new ATOM 0 HB2 GLU A 27 11.515 -2.052 -10.309 1.00 0.00 H new ATOM 0 HB3 GLU A 27 11.700 -3.676 -10.942 1.00 0.00 H new ATOM 0 HG2 GLU A 27 9.523 -3.415 -12.180 1.00 0.00 H new ATOM 0 HG3 GLU A 27 9.402 -1.771 -11.586 1.00 0.00 H new ATOM 409 N GLU A 28 11.653 -3.007 -7.565 1.00 0.00 N ATOM 410 CA GLU A 28 12.623 -3.263 -6.484 1.00 0.00 C ATOM 411 C GLU A 28 11.976 -3.722 -5.164 1.00 0.00 C ATOM 412 O GLU A 28 12.546 -4.545 -4.450 1.00 0.00 O ATOM 413 CB GLU A 28 13.557 -2.049 -6.321 1.00 0.00 C ATOM 414 CG GLU A 28 12.824 -0.731 -6.027 1.00 0.00 C ATOM 415 CD GLU A 28 13.737 0.506 -5.998 1.00 0.00 C ATOM 416 OE1 GLU A 28 14.978 0.396 -5.881 1.00 0.00 O ATOM 417 OE2 GLU A 28 13.195 1.636 -6.061 1.00 0.00 O ATOM 0 H GLU A 28 11.425 -2.018 -7.669 1.00 0.00 H new ATOM 0 HA GLU A 28 13.231 -4.118 -6.780 1.00 0.00 H new ATOM 0 HB2 GLU A 28 14.260 -2.250 -5.512 1.00 0.00 H new ATOM 0 HB3 GLU A 28 14.144 -1.931 -7.232 1.00 0.00 H new ATOM 0 HG2 GLU A 28 12.052 -0.581 -6.782 1.00 0.00 H new ATOM 0 HG3 GLU A 28 12.317 -0.817 -5.066 1.00 0.00 H new ATOM 424 N SER A 29 10.760 -3.261 -4.855 1.00 0.00 N ATOM 425 CA SER A 29 9.999 -3.677 -3.658 1.00 0.00 C ATOM 426 C SER A 29 9.581 -5.146 -3.724 1.00 0.00 C ATOM 427 O SER A 29 9.661 -5.847 -2.713 1.00 0.00 O ATOM 428 CB SER A 29 8.779 -2.770 -3.442 1.00 0.00 C ATOM 429 OG SER A 29 8.055 -2.616 -4.644 1.00 0.00 O ATOM 0 H SER A 29 10.265 -2.580 -5.431 1.00 0.00 H new ATOM 0 HA SER A 29 10.664 -3.570 -2.801 1.00 0.00 H new ATOM 0 HB2 SER A 29 8.133 -3.197 -2.674 1.00 0.00 H new ATOM 0 HB3 SER A 29 9.104 -1.795 -3.079 1.00 0.00 H new ATOM 0 HG SER A 29 8.502 -1.954 -5.212 1.00 0.00 H new ATOM 435 N GLN A 30 9.249 -5.663 -4.914 1.00 0.00 N ATOM 436 CA GLN A 30 8.913 -7.084 -5.078 1.00 0.00 C ATOM 437 C GLN A 30 10.105 -8.045 -4.911 1.00 0.00 C ATOM 438 O GLN A 30 9.896 -9.239 -4.695 1.00 0.00 O ATOM 439 CB GLN A 30 8.037 -7.328 -6.322 1.00 0.00 C ATOM 440 CG GLN A 30 8.688 -7.046 -7.678 1.00 0.00 C ATOM 441 CD GLN A 30 7.721 -7.315 -8.837 1.00 0.00 C ATOM 442 OE1 GLN A 30 7.900 -8.254 -9.601 1.00 0.00 O ATOM 443 NE2 GLN A 30 6.674 -6.535 -9.015 1.00 0.00 N ATOM 0 H GLN A 30 9.206 -5.120 -5.776 1.00 0.00 H new ATOM 0 HA GLN A 30 8.285 -7.351 -4.228 1.00 0.00 H new ATOM 0 HB2 GLN A 30 7.709 -8.367 -6.310 1.00 0.00 H new ATOM 0 HB3 GLN A 30 7.143 -6.710 -6.237 1.00 0.00 H new ATOM 0 HG2 GLN A 30 9.020 -6.008 -7.714 1.00 0.00 H new ATOM 0 HG3 GLN A 30 9.575 -7.668 -7.792 1.00 0.00 H new ATOM 0 HE21 GLN A 30 6.511 -5.748 -8.386 1.00 0.00 H new ATOM 0 HE22 GLN A 30 6.026 -6.718 -9.781 1.00 0.00 H new ATOM 452 N ARG A 31 11.347 -7.535 -4.918 1.00 0.00 N ATOM 453 CA ARG A 31 12.559 -8.328 -4.640 1.00 0.00 C ATOM 454 C ARG A 31 12.726 -8.582 -3.130 1.00 0.00 C ATOM 455 O ARG A 31 13.240 -9.628 -2.739 1.00 0.00 O ATOM 456 CB ARG A 31 13.778 -7.610 -5.252 1.00 0.00 C ATOM 457 CG ARG A 31 15.040 -8.490 -5.273 1.00 0.00 C ATOM 458 CD ARG A 31 16.227 -7.780 -5.936 1.00 0.00 C ATOM 459 NE ARG A 31 16.692 -6.611 -5.157 1.00 0.00 N ATOM 460 CZ ARG A 31 17.545 -6.606 -4.145 1.00 0.00 C ATOM 461 NH1 ARG A 31 18.075 -7.699 -3.674 1.00 0.00 N ATOM 462 NH2 ARG A 31 17.887 -5.482 -3.580 1.00 0.00 N ATOM 0 H ARG A 31 11.542 -6.554 -5.118 1.00 0.00 H new ATOM 0 HA ARG A 31 12.468 -9.311 -5.103 1.00 0.00 H new ATOM 0 HB2 ARG A 31 13.539 -7.301 -6.270 1.00 0.00 H new ATOM 0 HB3 ARG A 31 13.983 -6.703 -4.684 1.00 0.00 H new ATOM 0 HG2 ARG A 31 15.307 -8.765 -4.253 1.00 0.00 H new ATOM 0 HG3 ARG A 31 14.827 -9.416 -5.808 1.00 0.00 H new ATOM 0 HD2 ARG A 31 17.050 -8.486 -6.053 1.00 0.00 H new ATOM 0 HD3 ARG A 31 15.940 -7.456 -6.936 1.00 0.00 H new ATOM 0 HE ARG A 31 16.312 -5.705 -5.431 1.00 0.00 H new ATOM 0 HH11 ARG A 31 17.836 -8.601 -4.087 1.00 0.00 H new ATOM 0 HH12 ARG A 31 18.729 -7.653 -2.892 1.00 0.00 H new ATOM 0 HH21 ARG A 31 17.497 -4.602 -3.918 1.00 0.00 H new ATOM 0 HH22 ARG A 31 18.545 -5.483 -2.800 1.00 0.00 H new ATOM 476 N LEU A 32 12.255 -7.648 -2.290 1.00 0.00 N ATOM 477 CA LEU A 32 12.301 -7.739 -0.821 1.00 0.00 C ATOM 478 C LEU A 32 11.021 -8.369 -0.243 1.00 0.00 C ATOM 479 O LEU A 32 11.084 -9.454 0.323 1.00 0.00 O ATOM 480 CB LEU A 32 12.587 -6.352 -0.197 1.00 0.00 C ATOM 481 CG LEU A 32 14.069 -5.920 -0.215 1.00 0.00 C ATOM 482 CD1 LEU A 32 14.577 -5.542 -1.606 1.00 0.00 C ATOM 483 CD2 LEU A 32 14.254 -4.708 0.702 1.00 0.00 C ATOM 0 H LEU A 32 11.820 -6.787 -2.621 1.00 0.00 H new ATOM 0 HA LEU A 32 13.123 -8.404 -0.556 1.00 0.00 H new ATOM 0 HB2 LEU A 32 12.000 -5.603 -0.729 1.00 0.00 H new ATOM 0 HB3 LEU A 32 12.238 -6.356 0.836 1.00 0.00 H new ATOM 0 HG LEU A 32 14.644 -6.781 0.125 1.00 0.00 H new ATOM 0 HD11 LEU A 32 15.625 -5.249 -1.543 1.00 0.00 H new ATOM 0 HD12 LEU A 32 14.479 -6.398 -2.274 1.00 0.00 H new ATOM 0 HD13 LEU A 32 13.990 -4.709 -1.994 1.00 0.00 H new ATOM 0 HD21 LEU A 32 15.300 -4.400 0.692 1.00 0.00 H new ATOM 0 HD22 LEU A 32 13.630 -3.886 0.349 1.00 0.00 H new ATOM 0 HD23 LEU A 32 13.964 -4.973 1.719 1.00 0.00 H new ATOM 495 N ILE A 33 9.856 -7.736 -0.439 1.00 0.00 N ATOM 496 CA ILE A 33 8.546 -8.150 0.141 1.00 0.00 C ATOM 497 C ILE A 33 8.016 -9.451 -0.501 1.00 0.00 C ATOM 498 O ILE A 33 7.097 -10.070 0.024 1.00 0.00 O ATOM 499 CB ILE A 33 7.558 -6.962 0.013 1.00 0.00 C ATOM 500 CG1 ILE A 33 8.069 -5.730 0.803 1.00 0.00 C ATOM 501 CG2 ILE A 33 6.129 -7.266 0.507 1.00 0.00 C ATOM 502 CD1 ILE A 33 7.777 -4.434 0.043 1.00 0.00 C ATOM 0 H ILE A 33 9.784 -6.899 -1.018 1.00 0.00 H new ATOM 0 HA ILE A 33 8.667 -8.390 1.197 1.00 0.00 H new ATOM 0 HB ILE A 33 7.511 -6.764 -1.058 1.00 0.00 H new ATOM 0 HG12 ILE A 33 7.592 -5.697 1.782 1.00 0.00 H new ATOM 0 HG13 ILE A 33 9.142 -5.822 0.974 1.00 0.00 H new ATOM 0 HG21 ILE A 33 5.505 -6.381 0.381 1.00 0.00 H new ATOM 0 HG22 ILE A 33 5.712 -8.090 -0.072 1.00 0.00 H new ATOM 0 HG23 ILE A 33 6.159 -7.542 1.561 1.00 0.00 H new ATOM 0 HD11 ILE A 33 8.145 -3.584 0.618 1.00 0.00 H new ATOM 0 HD12 ILE A 33 8.276 -4.460 -0.926 1.00 0.00 H new ATOM 0 HD13 ILE A 33 6.702 -4.333 -0.105 1.00 0.00 H new ATOM 514 N GLY A 34 8.629 -9.920 -1.596 1.00 0.00 N ATOM 515 CA GLY A 34 8.174 -11.095 -2.360 1.00 0.00 C ATOM 516 C GLY A 34 8.881 -12.414 -2.028 1.00 0.00 C ATOM 517 O GLY A 34 8.447 -13.465 -2.501 1.00 0.00 O ATOM 0 H GLY A 34 9.468 -9.489 -1.984 1.00 0.00 H new ATOM 0 HA2 GLY A 34 7.105 -11.224 -2.192 1.00 0.00 H new ATOM 0 HA3 GLY A 34 8.307 -10.889 -3.422 1.00 0.00 H new ATOM 521 N GLN A 35 9.928 -12.384 -1.192 1.00 0.00 N ATOM 522 CA GLN A 35 10.628 -13.583 -0.678 1.00 0.00 C ATOM 523 C GLN A 35 10.198 -13.884 0.779 1.00 0.00 C ATOM 524 O GLN A 35 10.895 -14.549 1.547 1.00 0.00 O ATOM 525 CB GLN A 35 12.150 -13.478 -0.898 1.00 0.00 C ATOM 526 CG GLN A 35 12.822 -12.288 -0.193 1.00 0.00 C ATOM 527 CD GLN A 35 14.349 -12.286 -0.310 1.00 0.00 C ATOM 528 OE1 GLN A 35 14.975 -13.089 -0.994 1.00 0.00 O ATOM 529 NE2 GLN A 35 15.020 -11.375 0.366 1.00 0.00 N ATOM 0 H GLN A 35 10.325 -11.511 -0.844 1.00 0.00 H new ATOM 0 HA GLN A 35 10.325 -14.457 -1.254 1.00 0.00 H new ATOM 0 HB2 GLN A 35 12.618 -14.399 -0.551 1.00 0.00 H new ATOM 0 HB3 GLN A 35 12.344 -13.405 -1.968 1.00 0.00 H new ATOM 0 HG2 GLN A 35 12.433 -11.361 -0.614 1.00 0.00 H new ATOM 0 HG3 GLN A 35 12.547 -12.299 0.862 1.00 0.00 H new ATOM 0 HE21 GLN A 35 14.521 -10.697 0.942 1.00 0.00 H new ATOM 0 HE22 GLN A 35 16.038 -11.348 0.314 1.00 0.00 H new ATOM 538 N GLN A 36 9.031 -13.347 1.152 1.00 0.00 N ATOM 539 CA GLN A 36 8.391 -13.335 2.456 1.00 0.00 C ATOM 540 C GLN A 36 7.207 -14.330 2.512 1.00 0.00 C ATOM 541 O GLN A 36 6.459 -14.463 1.541 1.00 0.00 O ATOM 542 CB GLN A 36 8.076 -11.886 2.799 1.00 0.00 C ATOM 543 CG GLN A 36 9.417 -11.088 2.816 1.00 0.00 C ATOM 544 CD GLN A 36 9.316 -9.726 3.472 1.00 0.00 C ATOM 545 OE1 GLN A 36 9.952 -8.741 3.129 1.00 0.00 O ATOM 546 NE2 GLN A 36 8.514 -9.656 4.490 1.00 0.00 N ATOM 0 H GLN A 36 8.456 -12.859 0.466 1.00 0.00 H new ATOM 0 HA GLN A 36 9.048 -13.707 3.242 1.00 0.00 H new ATOM 0 HB2 GLN A 36 7.390 -11.462 2.066 1.00 0.00 H new ATOM 0 HB3 GLN A 36 7.584 -11.823 3.769 1.00 0.00 H new ATOM 0 HG2 GLN A 36 10.171 -11.676 3.338 1.00 0.00 H new ATOM 0 HG3 GLN A 36 9.765 -10.961 1.791 1.00 0.00 H new ATOM 0 HE21 GLN A 36 7.982 -10.477 4.778 1.00 0.00 H new ATOM 0 HE22 GLN A 36 8.415 -8.780 5.002 1.00 0.00 H new ATOM 555 N GLY A 37 7.018 -15.019 3.647 1.00 0.00 N ATOM 556 CA GLY A 37 6.023 -16.099 3.824 1.00 0.00 C ATOM 557 C GLY A 37 4.694 -15.759 4.517 1.00 0.00 C ATOM 558 O GLY A 37 4.044 -16.663 5.048 1.00 0.00 O ATOM 0 H GLY A 37 7.563 -14.840 4.490 1.00 0.00 H new ATOM 0 HA2 GLY A 37 5.790 -16.502 2.838 1.00 0.00 H new ATOM 0 HA3 GLY A 37 6.498 -16.899 4.391 1.00 0.00 H new ATOM 562 N LEU A 38 4.294 -14.483 4.561 1.00 0.00 N ATOM 563 CA LEU A 38 3.044 -14.036 5.200 1.00 0.00 C ATOM 564 C LEU A 38 1.796 -14.255 4.305 1.00 0.00 C ATOM 565 O LEU A 38 1.912 -14.600 3.125 1.00 0.00 O ATOM 566 CB LEU A 38 3.163 -12.546 5.595 1.00 0.00 C ATOM 567 CG LEU A 38 4.246 -12.102 6.603 1.00 0.00 C ATOM 568 CD1 LEU A 38 4.291 -12.988 7.847 1.00 0.00 C ATOM 569 CD2 LEU A 38 5.650 -12.009 6.001 1.00 0.00 C ATOM 0 H LEU A 38 4.833 -13.721 4.150 1.00 0.00 H new ATOM 0 HA LEU A 38 2.901 -14.648 6.090 1.00 0.00 H new ATOM 0 HB2 LEU A 38 3.320 -11.978 4.678 1.00 0.00 H new ATOM 0 HB3 LEU A 38 2.198 -12.239 5.998 1.00 0.00 H new ATOM 0 HG LEU A 38 3.940 -11.097 6.892 1.00 0.00 H new ATOM 0 HD11 LEU A 38 5.070 -12.630 8.521 1.00 0.00 H new ATOM 0 HD12 LEU A 38 3.327 -12.952 8.355 1.00 0.00 H new ATOM 0 HD13 LEU A 38 4.508 -14.015 7.554 1.00 0.00 H new ATOM 0 HD21 LEU A 38 6.355 -11.692 6.769 1.00 0.00 H new ATOM 0 HD22 LEU A 38 5.947 -12.985 5.617 1.00 0.00 H new ATOM 0 HD23 LEU A 38 5.650 -11.284 5.187 1.00 0.00 H new ATOM 581 N VAL A 39 0.591 -14.069 4.871 1.00 0.00 N ATOM 582 CA VAL A 39 -0.683 -14.112 4.128 1.00 0.00 C ATOM 583 C VAL A 39 -0.849 -12.879 3.253 1.00 0.00 C ATOM 584 O VAL A 39 -0.288 -11.821 3.536 1.00 0.00 O ATOM 585 CB VAL A 39 -1.907 -14.365 5.031 1.00 0.00 C ATOM 586 CG1 VAL A 39 -1.820 -15.740 5.701 1.00 0.00 C ATOM 587 CG2 VAL A 39 -2.128 -13.298 6.104 1.00 0.00 C ATOM 0 H VAL A 39 0.472 -13.883 5.867 1.00 0.00 H new ATOM 0 HA VAL A 39 -0.632 -14.979 3.469 1.00 0.00 H new ATOM 0 HB VAL A 39 -2.764 -14.322 4.359 1.00 0.00 H new ATOM 0 HG11 VAL A 39 -2.695 -15.893 6.332 1.00 0.00 H new ATOM 0 HG12 VAL A 39 -1.784 -16.516 4.936 1.00 0.00 H new ATOM 0 HG13 VAL A 39 -0.919 -15.791 6.312 1.00 0.00 H new ATOM 0 HG21 VAL A 39 -3.008 -13.552 6.694 1.00 0.00 H new ATOM 0 HG22 VAL A 39 -1.255 -13.251 6.756 1.00 0.00 H new ATOM 0 HG23 VAL A 39 -2.278 -12.329 5.628 1.00 0.00 H new ATOM 597 N ASP A 40 -1.705 -13.007 2.235 1.00 0.00 N ATOM 598 CA ASP A 40 -1.989 -12.026 1.161 1.00 0.00 C ATOM 599 C ASP A 40 -2.413 -10.640 1.607 1.00 0.00 C ATOM 600 O ASP A 40 -2.528 -9.708 0.815 1.00 0.00 O ATOM 601 CB ASP A 40 -3.064 -12.586 0.225 1.00 0.00 C ATOM 602 CG ASP A 40 -2.846 -14.073 -0.041 1.00 0.00 C ATOM 603 OD1 ASP A 40 -1.782 -14.405 -0.597 1.00 0.00 O ATOM 604 OD2 ASP A 40 -3.695 -14.882 0.390 1.00 0.00 O ATOM 0 H ASP A 40 -2.261 -13.855 2.124 1.00 0.00 H new ATOM 0 HA ASP A 40 -1.028 -11.888 0.665 1.00 0.00 H new ATOM 0 HB2 ASP A 40 -4.049 -12.434 0.666 1.00 0.00 H new ATOM 0 HB3 ASP A 40 -3.049 -12.039 -0.718 1.00 0.00 H new ATOM 609 N GLY A 41 -2.613 -10.536 2.902 1.00 0.00 N ATOM 610 CA GLY A 41 -3.013 -9.331 3.581 1.00 0.00 C ATOM 611 C GLY A 41 -1.928 -8.599 4.360 1.00 0.00 C ATOM 612 O GLY A 41 -2.220 -7.536 4.888 1.00 0.00 O ATOM 0 H GLY A 41 -2.495 -11.327 3.536 1.00 0.00 H new ATOM 0 HA2 GLY A 41 -3.425 -8.644 2.842 1.00 0.00 H new ATOM 0 HA3 GLY A 41 -3.820 -9.579 4.271 1.00 0.00 H new ATOM 616 N LEU A 42 -0.673 -9.046 4.376 1.00 0.00 N ATOM 617 CA LEU A 42 0.365 -8.400 5.192 1.00 0.00 C ATOM 618 C LEU A 42 1.035 -7.418 4.247 1.00 0.00 C ATOM 619 O LEU A 42 2.060 -7.672 3.628 1.00 0.00 O ATOM 620 CB LEU A 42 1.303 -9.452 5.822 1.00 0.00 C ATOM 621 CG LEU A 42 1.005 -9.787 7.295 1.00 0.00 C ATOM 622 CD1 LEU A 42 1.357 -8.624 8.223 1.00 0.00 C ATOM 623 CD2 LEU A 42 -0.452 -10.184 7.522 1.00 0.00 C ATOM 0 H LEU A 42 -0.347 -9.849 3.837 1.00 0.00 H new ATOM 0 HA LEU A 42 -0.021 -7.865 6.060 1.00 0.00 H new ATOM 0 HB2 LEU A 42 1.242 -10.369 5.236 1.00 0.00 H new ATOM 0 HB3 LEU A 42 2.330 -9.094 5.747 1.00 0.00 H new ATOM 0 HG LEU A 42 1.637 -10.642 7.534 1.00 0.00 H new ATOM 0 HD11 LEU A 42 1.132 -8.900 9.253 1.00 0.00 H new ATOM 0 HD12 LEU A 42 2.419 -8.394 8.132 1.00 0.00 H new ATOM 0 HD13 LEU A 42 0.771 -7.747 7.946 1.00 0.00 H new ATOM 0 HD21 LEU A 42 -0.607 -10.410 8.577 1.00 0.00 H new ATOM 0 HD22 LEU A 42 -1.103 -9.361 7.227 1.00 0.00 H new ATOM 0 HD23 LEU A 42 -0.687 -11.065 6.924 1.00 0.00 H new ATOM 635 N PHE A 43 0.399 -6.258 4.168 1.00 0.00 N ATOM 636 CA PHE A 43 0.721 -5.205 3.227 1.00 0.00 C ATOM 637 C PHE A 43 1.584 -4.030 3.742 1.00 0.00 C ATOM 638 O PHE A 43 1.911 -3.941 4.927 1.00 0.00 O ATOM 639 CB PHE A 43 -0.648 -4.845 2.612 1.00 0.00 C ATOM 640 CG PHE A 43 -1.611 -3.875 3.321 1.00 0.00 C ATOM 641 CD1 PHE A 43 -1.354 -3.297 4.584 1.00 0.00 C ATOM 642 CD2 PHE A 43 -2.862 -3.615 2.728 1.00 0.00 C ATOM 643 CE1 PHE A 43 -2.289 -2.450 5.205 1.00 0.00 C ATOM 644 CE2 PHE A 43 -3.813 -2.783 3.353 1.00 0.00 C ATOM 645 CZ PHE A 43 -3.523 -2.190 4.590 1.00 0.00 C ATOM 0 H PHE A 43 -0.381 -6.020 4.780 1.00 0.00 H new ATOM 0 HA PHE A 43 1.431 -5.548 2.474 1.00 0.00 H new ATOM 0 HB2 PHE A 43 -0.454 -4.433 1.622 1.00 0.00 H new ATOM 0 HB3 PHE A 43 -1.188 -5.781 2.468 1.00 0.00 H new ATOM 0 HD1 PHE A 43 -0.420 -3.510 5.083 1.00 0.00 H new ATOM 0 HD2 PHE A 43 -3.098 -4.063 1.774 1.00 0.00 H new ATOM 0 HE1 PHE A 43 -2.057 -1.998 6.158 1.00 0.00 H new ATOM 0 HE2 PHE A 43 -4.766 -2.602 2.878 1.00 0.00 H new ATOM 0 HZ PHE A 43 -4.243 -1.539 5.065 1.00 0.00 H new ATOM 655 N LEU A 44 1.959 -3.131 2.826 1.00 0.00 N ATOM 656 CA LEU A 44 2.733 -1.902 3.074 1.00 0.00 C ATOM 657 C LEU A 44 2.194 -0.734 2.224 1.00 0.00 C ATOM 658 O LEU A 44 1.937 -0.918 1.032 1.00 0.00 O ATOM 659 CB LEU A 44 4.224 -2.176 2.741 1.00 0.00 C ATOM 660 CG LEU A 44 5.280 -1.269 3.414 1.00 0.00 C ATOM 661 CD1 LEU A 44 5.448 -1.674 4.878 1.00 0.00 C ATOM 662 CD2 LEU A 44 6.634 -1.465 2.726 1.00 0.00 C ATOM 0 H LEU A 44 1.721 -3.243 1.841 1.00 0.00 H new ATOM 0 HA LEU A 44 2.637 -1.618 4.122 1.00 0.00 H new ATOM 0 HB2 LEU A 44 4.445 -3.209 3.011 1.00 0.00 H new ATOM 0 HB3 LEU A 44 4.349 -2.095 1.661 1.00 0.00 H new ATOM 0 HG LEU A 44 4.951 -0.233 3.336 1.00 0.00 H new ATOM 0 HD11 LEU A 44 6.193 -1.033 5.350 1.00 0.00 H new ATOM 0 HD12 LEU A 44 4.496 -1.566 5.397 1.00 0.00 H new ATOM 0 HD13 LEU A 44 5.776 -2.712 4.933 1.00 0.00 H new ATOM 0 HD21 LEU A 44 7.379 -0.826 3.200 1.00 0.00 H new ATOM 0 HD22 LEU A 44 6.940 -2.507 2.816 1.00 0.00 H new ATOM 0 HD23 LEU A 44 6.548 -1.202 1.672 1.00 0.00 H new ATOM 674 N VAL A 45 2.047 0.464 2.804 1.00 0.00 N ATOM 675 CA VAL A 45 1.653 1.693 2.080 1.00 0.00 C ATOM 676 C VAL A 45 2.927 2.507 1.845 1.00 0.00 C ATOM 677 O VAL A 45 3.461 3.144 2.754 1.00 0.00 O ATOM 678 CB VAL A 45 0.567 2.511 2.814 1.00 0.00 C ATOM 679 CG1 VAL A 45 -0.006 3.584 1.877 1.00 0.00 C ATOM 680 CG2 VAL A 45 -0.608 1.645 3.280 1.00 0.00 C ATOM 0 H VAL A 45 2.199 0.615 3.801 1.00 0.00 H new ATOM 0 HA VAL A 45 1.189 1.423 1.131 1.00 0.00 H new ATOM 0 HB VAL A 45 1.054 2.952 3.684 1.00 0.00 H new ATOM 0 HG11 VAL A 45 -0.771 4.156 2.403 1.00 0.00 H new ATOM 0 HG12 VAL A 45 0.793 4.254 1.559 1.00 0.00 H new ATOM 0 HG13 VAL A 45 -0.448 3.105 1.003 1.00 0.00 H new ATOM 0 HG21 VAL A 45 -1.341 2.270 3.789 1.00 0.00 H new ATOM 0 HG22 VAL A 45 -1.074 1.169 2.417 1.00 0.00 H new ATOM 0 HG23 VAL A 45 -0.246 0.879 3.966 1.00 0.00 H new ATOM 690 N ARG A 46 3.454 2.395 0.626 1.00 0.00 N ATOM 691 CA ARG A 46 4.726 2.976 0.167 1.00 0.00 C ATOM 692 C ARG A 46 4.583 3.484 -1.251 1.00 0.00 C ATOM 693 O ARG A 46 3.574 3.229 -1.894 1.00 0.00 O ATOM 694 CB ARG A 46 5.854 1.908 0.335 1.00 0.00 C ATOM 695 CG ARG A 46 6.417 1.182 -0.916 1.00 0.00 C ATOM 696 CD ARG A 46 5.357 0.343 -1.635 1.00 0.00 C ATOM 697 NE ARG A 46 5.690 -0.149 -2.997 1.00 0.00 N ATOM 698 CZ ARG A 46 5.941 0.506 -4.118 1.00 0.00 C ATOM 699 NH1 ARG A 46 6.381 1.715 -4.226 1.00 0.00 N ATOM 700 NH2 ARG A 46 5.691 -0.058 -5.253 1.00 0.00 N ATOM 0 H ARG A 46 2.984 1.869 -0.111 1.00 0.00 H new ATOM 0 HA ARG A 46 5.002 3.841 0.770 1.00 0.00 H new ATOM 0 HB2 ARG A 46 6.692 2.395 0.834 1.00 0.00 H new ATOM 0 HB3 ARG A 46 5.479 1.143 1.015 1.00 0.00 H new ATOM 0 HG2 ARG A 46 6.822 1.920 -1.608 1.00 0.00 H new ATOM 0 HG3 ARG A 46 7.244 0.538 -0.617 1.00 0.00 H new ATOM 0 HD2 ARG A 46 5.129 -0.521 -1.010 1.00 0.00 H new ATOM 0 HD3 ARG A 46 4.445 0.937 -1.704 1.00 0.00 H new ATOM 0 HE ARG A 46 5.732 -1.165 -3.082 1.00 0.00 H new ATOM 0 HH11 ARG A 46 6.571 2.265 -3.388 1.00 0.00 H new ATOM 0 HH12 ARG A 46 6.539 2.120 -5.149 1.00 0.00 H new ATOM 0 HH21 ARG A 46 5.303 -1.001 -5.279 1.00 0.00 H new ATOM 0 HH22 ARG A 46 5.881 0.440 -6.123 1.00 0.00 H new ATOM 714 N GLU A 47 5.540 4.258 -1.728 1.00 0.00 N ATOM 715 CA GLU A 47 5.578 4.676 -3.120 1.00 0.00 C ATOM 716 C GLU A 47 7.033 4.693 -3.560 1.00 0.00 C ATOM 717 O GLU A 47 7.868 3.936 -3.055 1.00 0.00 O ATOM 718 CB GLU A 47 4.773 5.973 -3.350 1.00 0.00 C ATOM 719 CG GLU A 47 5.241 7.205 -2.552 1.00 0.00 C ATOM 720 CD GLU A 47 4.335 7.468 -1.349 1.00 0.00 C ATOM 721 OE1 GLU A 47 4.534 6.998 -0.235 1.00 0.00 O ATOM 722 OE2 GLU A 47 3.247 8.241 -1.605 1.00 0.00 O ATOM 0 H GLU A 47 6.312 4.615 -1.164 1.00 0.00 H new ATOM 0 HA GLU A 47 5.064 3.969 -3.771 1.00 0.00 H new ATOM 0 HB2 GLU A 47 4.809 6.217 -4.412 1.00 0.00 H new ATOM 0 HB3 GLU A 47 3.729 5.779 -3.103 1.00 0.00 H new ATOM 0 HG2 GLU A 47 6.265 7.052 -2.211 1.00 0.00 H new ATOM 0 HG3 GLU A 47 5.248 8.080 -3.202 1.00 0.00 H new ATOM 730 N SER A 48 7.345 5.572 -4.486 1.00 0.00 N ATOM 731 CA SER A 48 8.673 5.829 -4.950 1.00 0.00 C ATOM 732 C SER A 48 8.842 7.324 -5.175 1.00 0.00 C ATOM 733 O SER A 48 7.888 8.091 -5.311 1.00 0.00 O ATOM 734 CB SER A 48 8.901 5.067 -6.241 1.00 0.00 C ATOM 735 OG SER A 48 10.289 5.105 -6.492 1.00 0.00 O ATOM 0 H SER A 48 6.643 6.148 -4.951 1.00 0.00 H new ATOM 0 HA SER A 48 9.404 5.500 -4.211 1.00 0.00 H new ATOM 0 HB2 SER A 48 8.552 4.038 -6.151 1.00 0.00 H new ATOM 0 HB3 SER A 48 8.346 5.521 -7.062 1.00 0.00 H new ATOM 0 HG SER A 48 10.719 4.333 -6.068 1.00 0.00 H new ATOM 741 N GLN A 49 10.104 7.689 -5.289 1.00 0.00 N ATOM 742 CA GLN A 49 10.592 9.011 -5.634 1.00 0.00 C ATOM 743 C GLN A 49 10.894 8.996 -7.170 1.00 0.00 C ATOM 744 O GLN A 49 11.450 9.947 -7.725 1.00 0.00 O ATOM 745 CB GLN A 49 11.759 9.312 -4.652 1.00 0.00 C ATOM 746 CG GLN A 49 13.148 8.837 -5.124 1.00 0.00 C ATOM 747 CD GLN A 49 13.122 7.442 -5.731 1.00 0.00 C ATOM 748 OE1 GLN A 49 12.634 6.477 -5.169 1.00 0.00 O ATOM 749 NE2 GLN A 49 13.530 7.239 -6.950 1.00 0.00 N ATOM 0 H GLN A 49 10.865 7.028 -5.133 1.00 0.00 H new ATOM 0 HA GLN A 49 9.898 9.842 -5.506 1.00 0.00 H new ATOM 0 HB2 GLN A 49 11.799 10.387 -4.478 1.00 0.00 H new ATOM 0 HB3 GLN A 49 11.538 8.842 -3.694 1.00 0.00 H new ATOM 0 HG2 GLN A 49 13.536 9.541 -5.860 1.00 0.00 H new ATOM 0 HG3 GLN A 49 13.836 8.847 -4.279 1.00 0.00 H new ATOM 0 HE21 GLN A 49 13.949 8.002 -7.481 1.00 0.00 H new ATOM 0 HE22 GLN A 49 13.431 6.317 -7.374 1.00 0.00 H new ATOM 758 N ARG A 50 10.486 7.889 -7.841 1.00 0.00 N ATOM 759 CA ARG A 50 10.568 7.535 -9.269 1.00 0.00 C ATOM 760 C ARG A 50 9.219 7.832 -9.943 1.00 0.00 C ATOM 761 O ARG A 50 9.183 8.804 -10.697 1.00 0.00 O ATOM 762 CB ARG A 50 11.047 6.074 -9.389 1.00 0.00 C ATOM 763 CG ARG A 50 11.392 5.610 -10.814 1.00 0.00 C ATOM 764 CD ARG A 50 11.886 4.154 -10.754 1.00 0.00 C ATOM 765 NE ARG A 50 12.024 3.544 -12.093 1.00 0.00 N ATOM 766 CZ ARG A 50 12.028 2.248 -12.362 1.00 0.00 C ATOM 767 NH1 ARG A 50 11.980 1.334 -11.441 1.00 0.00 N ATOM 768 NH2 ARG A 50 12.034 1.793 -13.576 1.00 0.00 N ATOM 0 H ARG A 50 10.037 7.134 -7.323 1.00 0.00 H new ATOM 0 HA ARG A 50 11.301 8.140 -9.802 1.00 0.00 H new ATOM 0 HB2 ARG A 50 11.927 5.945 -8.760 1.00 0.00 H new ATOM 0 HB3 ARG A 50 10.271 5.421 -8.990 1.00 0.00 H new ATOM 0 HG2 ARG A 50 10.516 5.685 -11.458 1.00 0.00 H new ATOM 0 HG3 ARG A 50 12.160 6.252 -11.245 1.00 0.00 H new ATOM 0 HD2 ARG A 50 12.848 4.122 -10.243 1.00 0.00 H new ATOM 0 HD3 ARG A 50 11.190 3.562 -10.160 1.00 0.00 H new ATOM 0 HE ARG A 50 12.126 4.181 -12.883 1.00 0.00 H new ATOM 0 HH11 ARG A 50 11.937 1.602 -10.458 1.00 0.00 H new ATOM 0 HH12 ARG A 50 11.986 0.348 -11.701 1.00 0.00 H new ATOM 0 HH21 ARG A 50 12.036 2.441 -14.364 1.00 0.00 H new ATOM 0 HH22 ARG A 50 12.037 0.787 -13.744 1.00 0.00 H new ATOM 782 N ASN A 51 8.112 7.091 -9.693 1.00 0.00 N ATOM 783 CA ASN A 51 6.818 7.505 -10.257 1.00 0.00 C ATOM 784 C ASN A 51 6.397 8.878 -9.665 1.00 0.00 C ATOM 785 O ASN A 51 6.284 8.992 -8.440 1.00 0.00 O ATOM 786 CB ASN A 51 5.741 6.432 -10.027 1.00 0.00 C ATOM 787 CG ASN A 51 5.877 5.379 -11.104 1.00 0.00 C ATOM 788 OD1 ASN A 51 5.264 5.446 -12.161 1.00 0.00 O ATOM 789 ND2 ASN A 51 6.796 4.469 -10.925 1.00 0.00 N ATOM 0 H ASN A 51 8.092 6.241 -9.129 1.00 0.00 H new ATOM 0 HA ASN A 51 6.926 7.618 -11.336 1.00 0.00 H new ATOM 0 HB2 ASN A 51 5.858 5.983 -9.041 1.00 0.00 H new ATOM 0 HB3 ASN A 51 4.748 6.879 -10.058 1.00 0.00 H new ATOM 0 HD21 ASN A 51 7.009 3.806 -11.670 1.00 0.00 H new ATOM 0 HD22 ASN A 51 7.301 4.422 -10.040 1.00 0.00 H new ATOM 796 N PRO A 52 6.140 9.922 -10.484 1.00 0.00 N ATOM 797 CA PRO A 52 5.899 11.289 -9.992 1.00 0.00 C ATOM 798 C PRO A 52 4.508 11.483 -9.355 1.00 0.00 C ATOM 799 O PRO A 52 4.262 12.471 -8.662 1.00 0.00 O ATOM 800 CB PRO A 52 6.090 12.184 -11.224 1.00 0.00 C ATOM 801 CG PRO A 52 5.680 11.281 -12.387 1.00 0.00 C ATOM 802 CD PRO A 52 6.181 9.910 -11.942 1.00 0.00 C ATOM 0 HA PRO A 52 6.586 11.534 -9.182 1.00 0.00 H new ATOM 0 HB2 PRO A 52 5.468 13.078 -11.171 1.00 0.00 H new ATOM 0 HB3 PRO A 52 7.123 12.519 -11.321 1.00 0.00 H new ATOM 0 HG2 PRO A 52 4.601 11.287 -12.543 1.00 0.00 H new ATOM 0 HG3 PRO A 52 6.139 11.595 -13.324 1.00 0.00 H new ATOM 0 HD2 PRO A 52 5.552 9.115 -12.344 1.00 0.00 H new ATOM 0 HD3 PRO A 52 7.193 9.728 -12.303 1.00 0.00 H new ATOM 810 N GLN A 53 3.603 10.527 -9.589 1.00 0.00 N ATOM 811 CA GLN A 53 2.203 10.498 -9.154 1.00 0.00 C ATOM 812 C GLN A 53 1.955 9.288 -8.231 1.00 0.00 C ATOM 813 O GLN A 53 0.851 8.748 -8.248 1.00 0.00 O ATOM 814 CB GLN A 53 1.313 10.498 -10.419 1.00 0.00 C ATOM 815 CG GLN A 53 1.423 11.818 -11.211 1.00 0.00 C ATOM 816 CD GLN A 53 0.649 11.823 -12.533 1.00 0.00 C ATOM 817 OE1 GLN A 53 0.169 10.813 -13.034 1.00 0.00 O ATOM 818 NE2 GLN A 53 0.507 12.970 -13.165 1.00 0.00 N ATOM 0 H GLN A 53 3.847 9.694 -10.125 1.00 0.00 H new ATOM 0 HA GLN A 53 1.952 11.377 -8.561 1.00 0.00 H new ATOM 0 HB2 GLN A 53 1.599 9.666 -11.062 1.00 0.00 H new ATOM 0 HB3 GLN A 53 0.275 10.335 -10.130 1.00 0.00 H new ATOM 0 HG2 GLN A 53 1.060 12.634 -10.587 1.00 0.00 H new ATOM 0 HG3 GLN A 53 2.474 12.018 -11.418 1.00 0.00 H new ATOM 0 HE21 GLN A 53 0.898 13.824 -12.767 1.00 0.00 H new ATOM 0 HE22 GLN A 53 0.006 13.005 -14.053 1.00 0.00 H new ATOM 827 N GLY A 54 2.935 8.858 -7.404 1.00 0.00 N ATOM 828 CA GLY A 54 2.800 7.625 -6.612 1.00 0.00 C ATOM 829 C GLY A 54 2.363 7.679 -5.145 1.00 0.00 C ATOM 830 O GLY A 54 2.947 8.332 -4.282 1.00 0.00 O ATOM 0 H GLY A 54 3.821 9.346 -7.272 1.00 0.00 H new ATOM 0 HA2 GLY A 54 2.089 6.985 -7.135 1.00 0.00 H new ATOM 0 HA3 GLY A 54 3.765 7.119 -6.640 1.00 0.00 H new ATOM 834 N PHE A 55 1.299 6.915 -4.921 1.00 0.00 N ATOM 835 CA PHE A 55 0.589 6.558 -3.680 1.00 0.00 C ATOM 836 C PHE A 55 0.073 5.088 -3.752 1.00 0.00 C ATOM 837 O PHE A 55 -1.106 4.856 -4.017 1.00 0.00 O ATOM 838 CB PHE A 55 -0.557 7.567 -3.464 1.00 0.00 C ATOM 839 CG PHE A 55 -0.140 9.029 -3.464 1.00 0.00 C ATOM 840 CD1 PHE A 55 0.249 9.657 -2.265 1.00 0.00 C ATOM 841 CD2 PHE A 55 -0.128 9.762 -4.670 1.00 0.00 C ATOM 842 CE1 PHE A 55 0.654 11.005 -2.273 1.00 0.00 C ATOM 843 CE2 PHE A 55 0.279 11.107 -4.678 1.00 0.00 C ATOM 844 CZ PHE A 55 0.670 11.729 -3.479 1.00 0.00 C ATOM 0 H PHE A 55 0.845 6.464 -5.715 1.00 0.00 H new ATOM 0 HA PHE A 55 1.265 6.610 -2.826 1.00 0.00 H new ATOM 0 HB2 PHE A 55 -1.303 7.418 -4.245 1.00 0.00 H new ATOM 0 HB3 PHE A 55 -1.042 7.344 -2.514 1.00 0.00 H new ATOM 0 HD1 PHE A 55 0.237 9.103 -1.338 1.00 0.00 H new ATOM 0 HD2 PHE A 55 -0.433 9.287 -5.591 1.00 0.00 H new ATOM 0 HE1 PHE A 55 0.953 11.484 -1.352 1.00 0.00 H new ATOM 0 HE2 PHE A 55 0.291 11.662 -5.604 1.00 0.00 H new ATOM 0 HZ PHE A 55 0.983 12.763 -3.484 1.00 0.00 H new ATOM 854 N VAL A 56 0.932 4.082 -3.560 1.00 0.00 N ATOM 855 CA VAL A 56 0.638 2.640 -3.710 1.00 0.00 C ATOM 856 C VAL A 56 0.329 1.929 -2.387 1.00 0.00 C ATOM 857 O VAL A 56 0.793 2.293 -1.308 1.00 0.00 O ATOM 858 CB VAL A 56 1.766 1.861 -4.487 1.00 0.00 C ATOM 859 CG1 VAL A 56 2.941 2.715 -4.980 1.00 0.00 C ATOM 860 CG2 VAL A 56 2.416 0.722 -3.688 1.00 0.00 C ATOM 0 H VAL A 56 1.899 4.251 -3.282 1.00 0.00 H new ATOM 0 HA VAL A 56 -0.271 2.619 -4.311 1.00 0.00 H new ATOM 0 HB VAL A 56 1.189 1.484 -5.331 1.00 0.00 H new ATOM 0 HG11 VAL A 56 3.659 2.081 -5.501 1.00 0.00 H new ATOM 0 HG12 VAL A 56 2.573 3.482 -5.662 1.00 0.00 H new ATOM 0 HG13 VAL A 56 3.428 3.190 -4.128 1.00 0.00 H new ATOM 0 HG21 VAL A 56 3.180 0.240 -4.298 1.00 0.00 H new ATOM 0 HG22 VAL A 56 2.873 1.126 -2.785 1.00 0.00 H new ATOM 0 HG23 VAL A 56 1.656 -0.010 -3.414 1.00 0.00 H new ATOM 870 N LEU A 57 -0.458 0.865 -2.524 1.00 0.00 N ATOM 871 CA LEU A 57 -0.784 -0.103 -1.483 1.00 0.00 C ATOM 872 C LEU A 57 -0.108 -1.384 -2.006 1.00 0.00 C ATOM 873 O LEU A 57 -0.210 -1.654 -3.200 1.00 0.00 O ATOM 874 CB LEU A 57 -2.307 -0.212 -1.269 1.00 0.00 C ATOM 875 CG LEU A 57 -2.694 -0.065 0.207 1.00 0.00 C ATOM 876 CD1 LEU A 57 -4.198 -0.279 0.377 1.00 0.00 C ATOM 877 CD2 LEU A 57 -1.956 -1.077 1.085 1.00 0.00 C ATOM 0 H LEU A 57 -0.909 0.644 -3.412 1.00 0.00 H new ATOM 0 HA LEU A 57 -0.429 0.157 -0.486 1.00 0.00 H new ATOM 0 HB2 LEU A 57 -2.811 0.558 -1.854 1.00 0.00 H new ATOM 0 HB3 LEU A 57 -2.657 -1.175 -1.641 1.00 0.00 H new ATOM 0 HG LEU A 57 -2.415 0.942 0.518 1.00 0.00 H new ATOM 0 HD11 LEU A 57 -4.464 -0.173 1.429 1.00 0.00 H new ATOM 0 HD12 LEU A 57 -4.740 0.462 -0.211 1.00 0.00 H new ATOM 0 HD13 LEU A 57 -4.464 -1.279 0.035 1.00 0.00 H new ATOM 0 HD21 LEU A 57 -2.255 -0.943 2.125 1.00 0.00 H new ATOM 0 HD22 LEU A 57 -2.205 -2.088 0.763 1.00 0.00 H new ATOM 0 HD23 LEU A 57 -0.881 -0.922 0.994 1.00 0.00 H new ATOM 889 N SER A 58 0.610 -2.165 -1.202 1.00 0.00 N ATOM 890 CA SER A 58 1.378 -3.309 -1.731 1.00 0.00 C ATOM 891 C SER A 58 1.153 -4.513 -0.851 1.00 0.00 C ATOM 892 O SER A 58 1.443 -4.459 0.338 1.00 0.00 O ATOM 893 CB SER A 58 2.853 -2.920 -1.883 1.00 0.00 C ATOM 894 OG SER A 58 3.443 -2.475 -0.679 1.00 0.00 O ATOM 0 H SER A 58 0.681 -2.036 -0.193 1.00 0.00 H new ATOM 0 HA SER A 58 1.032 -3.582 -2.728 1.00 0.00 H new ATOM 0 HB2 SER A 58 3.411 -3.779 -2.257 1.00 0.00 H new ATOM 0 HB3 SER A 58 2.938 -2.134 -2.633 1.00 0.00 H new ATOM 0 HG SER A 58 2.813 -1.897 -0.200 1.00 0.00 H new ATOM 900 N LEU A 59 0.671 -5.603 -1.442 1.00 0.00 N ATOM 901 CA LEU A 59 0.248 -6.798 -0.709 1.00 0.00 C ATOM 902 C LEU A 59 1.332 -7.875 -0.663 1.00 0.00 C ATOM 903 O LEU A 59 2.234 -7.863 -1.499 1.00 0.00 O ATOM 904 CB LEU A 59 -1.061 -7.295 -1.357 1.00 0.00 C ATOM 905 CG LEU A 59 -2.138 -6.215 -1.626 1.00 0.00 C ATOM 906 CD1 LEU A 59 -3.465 -6.889 -1.931 1.00 0.00 C ATOM 907 CD2 LEU A 59 -2.391 -5.272 -0.457 1.00 0.00 C ATOM 0 H LEU A 59 0.561 -5.685 -2.453 1.00 0.00 H new ATOM 0 HA LEU A 59 0.072 -6.550 0.338 1.00 0.00 H new ATOM 0 HB2 LEU A 59 -0.815 -7.777 -2.303 1.00 0.00 H new ATOM 0 HB3 LEU A 59 -1.495 -8.060 -0.713 1.00 0.00 H new ATOM 0 HG LEU A 59 -1.751 -5.628 -2.459 1.00 0.00 H new ATOM 0 HD11 LEU A 59 -4.224 -6.130 -2.120 1.00 0.00 H new ATOM 0 HD12 LEU A 59 -3.358 -7.522 -2.812 1.00 0.00 H new ATOM 0 HD13 LEU A 59 -3.767 -7.499 -1.080 1.00 0.00 H new ATOM 0 HD21 LEU A 59 -3.159 -4.549 -0.732 1.00 0.00 H new ATOM 0 HD22 LEU A 59 -2.726 -5.846 0.407 1.00 0.00 H new ATOM 0 HD23 LEU A 59 -1.470 -4.746 -0.208 1.00 0.00 H new ATOM 919 N CYS A 60 1.254 -8.818 0.285 1.00 0.00 N ATOM 920 CA CYS A 60 2.341 -9.815 0.455 1.00 0.00 C ATOM 921 C CYS A 60 1.730 -11.182 0.223 1.00 0.00 C ATOM 922 O CYS A 60 1.504 -11.962 1.147 1.00 0.00 O ATOM 923 CB CYS A 60 3.066 -9.653 1.792 1.00 0.00 C ATOM 924 SG CYS A 60 4.510 -10.757 1.895 1.00 0.00 S ATOM 0 H CYS A 60 0.475 -8.919 0.935 1.00 0.00 H new ATOM 0 HA CYS A 60 3.137 -9.665 -0.275 1.00 0.00 H new ATOM 0 HB2 CYS A 60 3.387 -8.618 1.912 1.00 0.00 H new ATOM 0 HB3 CYS A 60 2.379 -9.871 2.610 1.00 0.00 H new ATOM 0 HG CYS A 60 5.437 -10.336 1.087 1.00 0.00 H new ATOM 930 N HIS A 61 1.372 -11.414 -1.039 1.00 0.00 N ATOM 931 CA HIS A 61 0.645 -12.607 -1.413 1.00 0.00 C ATOM 932 C HIS A 61 1.510 -13.867 -1.592 1.00 0.00 C ATOM 933 O HIS A 61 2.719 -13.867 -1.341 1.00 0.00 O ATOM 934 CB HIS A 61 -0.340 -12.221 -2.526 1.00 0.00 C ATOM 935 CG HIS A 61 -0.731 -13.211 -3.605 1.00 0.00 C ATOM 936 ND1 HIS A 61 -0.025 -13.461 -4.785 1.00 0.00 N ATOM 937 CD2 HIS A 61 -1.866 -13.969 -3.618 1.00 0.00 C ATOM 938 CE1 HIS A 61 -0.782 -14.316 -5.495 1.00 0.00 C ATOM 939 NE2 HIS A 61 -1.879 -14.656 -4.808 1.00 0.00 N ATOM 0 H HIS A 61 1.578 -10.785 -1.815 1.00 0.00 H new ATOM 0 HA HIS A 61 0.042 -12.974 -0.583 1.00 0.00 H new ATOM 0 HB2 HIS A 61 -1.261 -11.900 -2.039 1.00 0.00 H new ATOM 0 HB3 HIS A 61 0.075 -11.348 -3.030 1.00 0.00 H new ATOM 0 HD2 HIS A 61 -2.613 -14.019 -2.840 1.00 0.00 H new ATOM 0 HE1 HIS A 61 -0.538 -14.678 -6.483 1.00 0.00 H new ATOM 0 HE2 HIS A 61 -2.599 -15.311 -5.114 1.00 0.00 H new ATOM 947 N LEU A 62 0.872 -14.938 -2.057 1.00 0.00 N ATOM 948 CA LEU A 62 1.432 -16.296 -2.204 1.00 0.00 C ATOM 949 C LEU A 62 1.938 -16.736 -3.540 1.00 0.00 C ATOM 950 O LEU A 62 2.339 -17.893 -3.700 1.00 0.00 O ATOM 951 CB LEU A 62 0.669 -17.344 -1.360 1.00 0.00 C ATOM 952 CG LEU A 62 -0.829 -17.526 -1.687 1.00 0.00 C ATOM 953 CD1 LEU A 62 -1.138 -17.886 -3.138 1.00 0.00 C ATOM 954 CD2 LEU A 62 -1.430 -18.614 -0.793 1.00 0.00 C ATOM 0 H LEU A 62 -0.101 -14.889 -2.360 1.00 0.00 H new ATOM 0 HA LEU A 62 2.416 -16.200 -1.746 1.00 0.00 H new ATOM 0 HB2 LEU A 62 1.165 -18.307 -1.480 1.00 0.00 H new ATOM 0 HB3 LEU A 62 0.759 -17.068 -0.309 1.00 0.00 H new ATOM 0 HG LEU A 62 -1.272 -16.547 -1.504 1.00 0.00 H new ATOM 0 HD11 LEU A 62 -2.215 -17.992 -3.265 1.00 0.00 H new ATOM 0 HD12 LEU A 62 -0.771 -17.097 -3.795 1.00 0.00 H new ATOM 0 HD13 LEU A 62 -0.649 -18.826 -3.392 1.00 0.00 H new ATOM 0 HD21 LEU A 62 -2.487 -18.737 -1.030 1.00 0.00 H new ATOM 0 HD22 LEU A 62 -0.908 -19.555 -0.965 1.00 0.00 H new ATOM 0 HD23 LEU A 62 -1.323 -18.326 0.253 1.00 0.00 H new ATOM 966 N GLN A 63 1.993 -15.782 -4.461 1.00 0.00 N ATOM 967 CA GLN A 63 2.660 -16.033 -5.716 1.00 0.00 C ATOM 968 C GLN A 63 3.358 -14.793 -6.273 1.00 0.00 C ATOM 969 O GLN A 63 4.367 -14.924 -6.972 1.00 0.00 O ATOM 970 CB GLN A 63 1.798 -16.705 -6.809 1.00 0.00 C ATOM 971 CG GLN A 63 1.161 -18.066 -6.479 1.00 0.00 C ATOM 972 CD GLN A 63 0.374 -18.668 -7.646 1.00 0.00 C ATOM 973 OE1 GLN A 63 0.181 -18.074 -8.702 1.00 0.00 O ATOM 974 NE2 GLN A 63 -0.130 -19.877 -7.499 1.00 0.00 N ATOM 0 H GLN A 63 1.591 -14.850 -4.360 1.00 0.00 H new ATOM 0 HA GLN A 63 3.415 -16.771 -5.445 1.00 0.00 H new ATOM 0 HB2 GLN A 63 0.997 -16.015 -7.076 1.00 0.00 H new ATOM 0 HB3 GLN A 63 2.419 -16.831 -7.696 1.00 0.00 H new ATOM 0 HG2 GLN A 63 1.944 -18.763 -6.181 1.00 0.00 H new ATOM 0 HG3 GLN A 63 0.496 -17.950 -5.623 1.00 0.00 H new ATOM 0 HE21 GLN A 63 0.018 -20.389 -6.629 1.00 0.00 H new ATOM 0 HE22 GLN A 63 -0.668 -20.301 -8.255 1.00 0.00 H new ATOM 983 N LYS A 64 2.853 -13.598 -5.946 1.00 0.00 N ATOM 984 CA LYS A 64 3.479 -12.326 -6.306 1.00 0.00 C ATOM 985 C LYS A 64 3.183 -11.229 -5.277 1.00 0.00 C ATOM 986 O LYS A 64 2.350 -11.404 -4.391 1.00 0.00 O ATOM 987 CB LYS A 64 3.024 -11.891 -7.720 1.00 0.00 C ATOM 988 CG LYS A 64 1.505 -11.631 -7.841 1.00 0.00 C ATOM 989 CD LYS A 64 0.722 -12.801 -8.463 1.00 0.00 C ATOM 990 CE LYS A 64 1.039 -12.993 -9.958 1.00 0.00 C ATOM 991 NZ LYS A 64 0.260 -14.117 -10.554 1.00 0.00 N ATOM 0 H LYS A 64 1.987 -13.489 -5.417 1.00 0.00 H new ATOM 0 HA LYS A 64 4.559 -12.476 -6.311 1.00 0.00 H new ATOM 0 HB2 LYS A 64 3.561 -10.984 -8.000 1.00 0.00 H new ATOM 0 HB3 LYS A 64 3.308 -12.663 -8.435 1.00 0.00 H new ATOM 0 HG2 LYS A 64 1.102 -11.422 -6.850 1.00 0.00 H new ATOM 0 HG3 LYS A 64 1.346 -10.738 -8.445 1.00 0.00 H new ATOM 0 HD2 LYS A 64 0.957 -13.719 -7.924 1.00 0.00 H new ATOM 0 HD3 LYS A 64 -0.347 -12.625 -8.341 1.00 0.00 H new ATOM 0 HE2 LYS A 64 0.817 -12.072 -10.497 1.00 0.00 H new ATOM 0 HE3 LYS A 64 2.105 -13.185 -10.081 1.00 0.00 H new ATOM 0 HZ1 LYS A 64 0.503 -14.212 -11.561 1.00 0.00 H new ATOM 0 HZ2 LYS A 64 0.491 -15.001 -10.057 1.00 0.00 H new ATOM 0 HZ3 LYS A 64 -0.757 -13.922 -10.460 1.00 0.00 H new ATOM 1005 N VAL A 65 3.850 -10.084 -5.418 1.00 0.00 N ATOM 1006 CA VAL A 65 3.605 -8.879 -4.607 1.00 0.00 C ATOM 1007 C VAL A 65 3.486 -7.674 -5.550 1.00 0.00 C ATOM 1008 O VAL A 65 4.473 -7.123 -6.034 1.00 0.00 O ATOM 1009 CB VAL A 65 4.605 -8.729 -3.441 1.00 0.00 C ATOM 1010 CG1 VAL A 65 4.574 -9.984 -2.565 1.00 0.00 C ATOM 1011 CG2 VAL A 65 6.058 -8.507 -3.828 1.00 0.00 C ATOM 0 H VAL A 65 4.590 -9.960 -6.109 1.00 0.00 H new ATOM 0 HA VAL A 65 2.655 -8.962 -4.079 1.00 0.00 H new ATOM 0 HB VAL A 65 4.268 -7.827 -2.929 1.00 0.00 H new ATOM 0 HG11 VAL A 65 5.282 -9.872 -1.744 1.00 0.00 H new ATOM 0 HG12 VAL A 65 3.570 -10.122 -2.163 1.00 0.00 H new ATOM 0 HG13 VAL A 65 4.848 -10.853 -3.164 1.00 0.00 H new ATOM 0 HG21 VAL A 65 6.665 -8.416 -2.927 1.00 0.00 H new ATOM 0 HG22 VAL A 65 6.410 -9.352 -4.419 1.00 0.00 H new ATOM 0 HG23 VAL A 65 6.142 -7.593 -4.416 1.00 0.00 H new ATOM 1021 N LYS A 66 2.237 -7.333 -5.884 1.00 0.00 N ATOM 1022 CA LYS A 66 1.860 -6.260 -6.825 1.00 0.00 C ATOM 1023 C LYS A 66 1.463 -4.991 -6.056 1.00 0.00 C ATOM 1024 O LYS A 66 1.114 -5.054 -4.875 1.00 0.00 O ATOM 1025 CB LYS A 66 0.823 -6.769 -7.858 1.00 0.00 C ATOM 1026 CG LYS A 66 -0.342 -7.594 -7.263 1.00 0.00 C ATOM 1027 CD LYS A 66 -1.495 -7.958 -8.227 1.00 0.00 C ATOM 1028 CE LYS A 66 -1.056 -8.353 -9.648 1.00 0.00 C ATOM 1029 NZ LYS A 66 -2.201 -8.864 -10.459 1.00 0.00 N ATOM 0 H LYS A 66 1.426 -7.812 -5.494 1.00 0.00 H new ATOM 0 HA LYS A 66 2.719 -5.967 -7.428 1.00 0.00 H new ATOM 0 HB2 LYS A 66 0.408 -5.911 -8.386 1.00 0.00 H new ATOM 0 HB3 LYS A 66 1.340 -7.380 -8.598 1.00 0.00 H new ATOM 0 HG2 LYS A 66 0.068 -8.519 -6.857 1.00 0.00 H new ATOM 0 HG3 LYS A 66 -0.761 -7.037 -6.425 1.00 0.00 H new ATOM 0 HD2 LYS A 66 -2.062 -8.783 -7.796 1.00 0.00 H new ATOM 0 HD3 LYS A 66 -2.173 -7.107 -8.296 1.00 0.00 H new ATOM 0 HE2 LYS A 66 -0.615 -7.489 -10.146 1.00 0.00 H new ATOM 0 HE3 LYS A 66 -0.281 -9.118 -9.590 1.00 0.00 H new ATOM 0 HZ1 LYS A 66 -1.881 -9.056 -11.430 1.00 0.00 H new ATOM 0 HZ2 LYS A 66 -2.563 -9.741 -10.034 1.00 0.00 H new ATOM 0 HZ3 LYS A 66 -2.958 -8.151 -10.479 1.00 0.00 H new ATOM 1043 N HIS A 67 1.490 -3.845 -6.738 1.00 0.00 N ATOM 1044 CA HIS A 67 1.289 -2.513 -6.139 1.00 0.00 C ATOM 1045 C HIS A 67 0.086 -1.764 -6.704 1.00 0.00 C ATOM 1046 O HIS A 67 -0.065 -1.610 -7.898 1.00 0.00 O ATOM 1047 CB HIS A 67 2.583 -1.739 -6.346 1.00 0.00 C ATOM 1048 CG HIS A 67 3.795 -2.517 -5.892 1.00 0.00 C ATOM 1049 ND1 HIS A 67 4.310 -2.508 -4.597 1.00 0.00 N ATOM 1050 CD2 HIS A 67 4.445 -3.478 -6.608 1.00 0.00 C ATOM 1051 CE1 HIS A 67 5.224 -3.492 -4.549 1.00 0.00 C ATOM 1052 NE2 HIS A 67 5.340 -4.071 -5.751 1.00 0.00 N ATOM 0 H HIS A 67 1.655 -3.810 -7.744 1.00 0.00 H new ATOM 0 HA HIS A 67 1.059 -2.624 -5.079 1.00 0.00 H new ATOM 0 HB2 HIS A 67 2.689 -1.489 -7.402 1.00 0.00 H new ATOM 0 HB3 HIS A 67 2.532 -0.798 -5.799 1.00 0.00 H new ATOM 0 HD2 HIS A 67 4.287 -3.725 -7.647 1.00 0.00 H new ATOM 0 HE1 HIS A 67 5.783 -3.775 -3.669 1.00 0.00 H new ATOM 0 HE2 HIS A 67 5.984 -4.825 -5.990 1.00 0.00 H new ATOM 1060 N TYR A 68 -0.682 -1.113 -5.851 1.00 0.00 N ATOM 1061 CA TYR A 68 -1.964 -0.474 -6.169 1.00 0.00 C ATOM 1062 C TYR A 68 -1.846 1.037 -6.433 1.00 0.00 C ATOM 1063 O TYR A 68 -2.398 1.847 -5.688 1.00 0.00 O ATOM 1064 CB TYR A 68 -2.960 -0.774 -5.020 1.00 0.00 C ATOM 1065 CG TYR A 68 -3.530 -2.181 -4.854 1.00 0.00 C ATOM 1066 CD1 TYR A 68 -2.741 -3.348 -4.960 1.00 0.00 C ATOM 1067 CD2 TYR A 68 -4.894 -2.310 -4.516 1.00 0.00 C ATOM 1068 CE1 TYR A 68 -3.331 -4.619 -4.817 1.00 0.00 C ATOM 1069 CE2 TYR A 68 -5.481 -3.576 -4.344 1.00 0.00 C ATOM 1070 CZ TYR A 68 -4.702 -4.734 -4.523 1.00 0.00 C ATOM 1071 OH TYR A 68 -5.263 -5.964 -4.403 1.00 0.00 O ATOM 0 H TYR A 68 -0.425 -1.005 -4.870 1.00 0.00 H new ATOM 0 HA TYR A 68 -2.331 -0.894 -7.105 1.00 0.00 H new ATOM 0 HB2 TYR A 68 -2.465 -0.512 -4.085 1.00 0.00 H new ATOM 0 HB3 TYR A 68 -3.804 -0.094 -5.136 1.00 0.00 H new ATOM 0 HD1 TYR A 68 -1.681 -3.265 -5.151 1.00 0.00 H new ATOM 0 HD2 TYR A 68 -5.496 -1.423 -4.387 1.00 0.00 H new ATOM 0 HE1 TYR A 68 -2.729 -5.508 -4.933 1.00 0.00 H new ATOM 0 HE2 TYR A 68 -6.524 -3.659 -4.076 1.00 0.00 H new ATOM 0 HH TYR A 68 -5.815 -5.994 -3.594 1.00 0.00 H new ATOM 1081 N LEU A 69 -1.061 1.449 -7.436 1.00 0.00 N ATOM 1082 CA LEU A 69 -0.915 2.860 -7.804 1.00 0.00 C ATOM 1083 C LEU A 69 -0.787 3.135 -9.305 1.00 0.00 C ATOM 1084 O LEU A 69 0.063 2.519 -9.928 1.00 0.00 O ATOM 1085 CB LEU A 69 0.346 3.383 -7.140 1.00 0.00 C ATOM 1086 CG LEU A 69 0.797 4.809 -7.464 1.00 0.00 C ATOM 1087 CD1 LEU A 69 1.548 4.910 -8.790 1.00 0.00 C ATOM 1088 CD2 LEU A 69 -0.374 5.800 -7.345 1.00 0.00 C ATOM 0 H LEU A 69 -0.511 0.814 -8.014 1.00 0.00 H new ATOM 0 HA LEU A 69 -1.830 3.353 -7.476 1.00 0.00 H new ATOM 0 HB2 LEU A 69 0.207 3.315 -6.061 1.00 0.00 H new ATOM 0 HB3 LEU A 69 1.162 2.709 -7.399 1.00 0.00 H new ATOM 0 HG LEU A 69 1.530 5.097 -6.711 1.00 0.00 H new ATOM 0 HD11 LEU A 69 1.842 5.945 -8.964 1.00 0.00 H new ATOM 0 HD12 LEU A 69 2.438 4.282 -8.753 1.00 0.00 H new ATOM 0 HD13 LEU A 69 0.901 4.575 -9.601 1.00 0.00 H new ATOM 0 HD21 LEU A 69 -0.025 6.805 -7.581 1.00 0.00 H new ATOM 0 HD22 LEU A 69 -1.163 5.517 -8.042 1.00 0.00 H new ATOM 0 HD23 LEU A 69 -0.765 5.781 -6.328 1.00 0.00 H new ATOM 1100 N ILE A 70 -1.580 4.043 -9.892 1.00 0.00 N ATOM 1101 CA ILE A 70 -1.373 4.485 -11.296 1.00 0.00 C ATOM 1102 C ILE A 70 -1.617 6.002 -11.475 1.00 0.00 C ATOM 1103 O ILE A 70 -0.947 6.632 -12.295 1.00 0.00 O ATOM 1104 CB ILE A 70 -2.140 3.635 -12.342 1.00 0.00 C ATOM 1105 CG1 ILE A 70 -1.678 2.170 -12.224 1.00 0.00 C ATOM 1106 CG2 ILE A 70 -1.873 4.106 -13.788 1.00 0.00 C ATOM 1107 CD1 ILE A 70 -2.168 1.234 -13.307 1.00 0.00 C ATOM 0 H ILE A 70 -2.370 4.489 -9.426 1.00 0.00 H new ATOM 0 HA ILE A 70 -0.318 4.305 -11.502 1.00 0.00 H new ATOM 0 HB ILE A 70 -3.205 3.743 -12.138 1.00 0.00 H new ATOM 0 HG12 ILE A 70 -0.588 2.152 -12.221 1.00 0.00 H new ATOM 0 HG13 ILE A 70 -2.006 1.782 -11.260 1.00 0.00 H new ATOM 0 HG21 ILE A 70 -2.432 3.480 -14.484 1.00 0.00 H new ATOM 0 HG22 ILE A 70 -2.191 5.143 -13.897 1.00 0.00 H new ATOM 0 HG23 ILE A 70 -0.808 4.028 -14.005 1.00 0.00 H new ATOM 0 HD11 ILE A 70 -1.782 0.231 -13.123 1.00 0.00 H new ATOM 0 HD12 ILE A 70 -3.258 1.210 -13.302 1.00 0.00 H new ATOM 0 HD13 ILE A 70 -1.818 1.585 -14.278 1.00 0.00 H new ATOM 1119 N LEU A 71 -2.496 6.617 -10.667 1.00 0.00 N ATOM 1120 CA LEU A 71 -2.926 8.015 -10.820 1.00 0.00 C ATOM 1121 C LEU A 71 -2.884 8.840 -9.502 1.00 0.00 C ATOM 1122 O LEU A 71 -2.918 8.257 -8.414 1.00 0.00 O ATOM 1123 CB LEU A 71 -4.371 7.993 -11.405 1.00 0.00 C ATOM 1124 CG LEU A 71 -4.834 6.772 -12.258 1.00 0.00 C ATOM 1125 CD1 LEU A 71 -6.355 6.673 -12.261 1.00 0.00 C ATOM 1126 CD2 LEU A 71 -4.345 6.805 -13.708 1.00 0.00 C ATOM 0 H LEU A 71 -2.935 6.147 -9.875 1.00 0.00 H new ATOM 0 HA LEU A 71 -2.224 8.517 -11.486 1.00 0.00 H new ATOM 0 HB2 LEU A 71 -5.064 8.089 -10.569 1.00 0.00 H new ATOM 0 HB3 LEU A 71 -4.488 8.885 -12.020 1.00 0.00 H new ATOM 0 HG LEU A 71 -4.384 5.900 -11.783 1.00 0.00 H new ATOM 0 HD11 LEU A 71 -6.663 5.816 -12.860 1.00 0.00 H new ATOM 0 HD12 LEU A 71 -6.714 6.549 -11.239 1.00 0.00 H new ATOM 0 HD13 LEU A 71 -6.778 7.583 -12.686 1.00 0.00 H new ATOM 0 HD21 LEU A 71 -4.709 5.923 -14.235 1.00 0.00 H new ATOM 0 HD22 LEU A 71 -4.723 7.702 -14.199 1.00 0.00 H new ATOM 0 HD23 LEU A 71 -3.255 6.814 -13.724 1.00 0.00 H new ATOM 1138 N PRO A 72 -2.844 10.191 -9.587 1.00 0.00 N ATOM 1139 CA PRO A 72 -2.863 11.111 -8.444 1.00 0.00 C ATOM 1140 C PRO A 72 -4.307 11.469 -8.017 1.00 0.00 C ATOM 1141 O PRO A 72 -5.259 10.744 -8.321 1.00 0.00 O ATOM 1142 CB PRO A 72 -2.060 12.318 -8.958 1.00 0.00 C ATOM 1143 CG PRO A 72 -2.524 12.423 -10.408 1.00 0.00 C ATOM 1144 CD PRO A 72 -2.688 10.961 -10.819 1.00 0.00 C ATOM 0 HA PRO A 72 -2.432 10.689 -7.536 1.00 0.00 H new ATOM 0 HB2 PRO A 72 -2.281 13.224 -8.394 1.00 0.00 H new ATOM 0 HB3 PRO A 72 -0.985 12.152 -8.886 1.00 0.00 H new ATOM 0 HG2 PRO A 72 -3.460 12.975 -10.494 1.00 0.00 H new ATOM 0 HG3 PRO A 72 -1.792 12.938 -11.030 1.00 0.00 H new ATOM 0 HD2 PRO A 72 -3.557 10.836 -11.465 1.00 0.00 H new ATOM 0 HD3 PRO A 72 -1.820 10.618 -11.382 1.00 0.00 H new ATOM 1152 N SER A 73 -4.491 12.584 -7.299 1.00 0.00 N ATOM 1153 CA SER A 73 -5.813 13.111 -6.912 1.00 0.00 C ATOM 1154 C SER A 73 -6.664 13.571 -8.110 1.00 0.00 C ATOM 1155 O SER A 73 -6.130 14.157 -9.058 1.00 0.00 O ATOM 1156 CB SER A 73 -5.675 14.272 -5.918 1.00 0.00 C ATOM 1157 OG SER A 73 -5.065 13.818 -4.723 1.00 0.00 O ATOM 0 H SER A 73 -3.716 13.157 -6.964 1.00 0.00 H new ATOM 0 HA SER A 73 -6.332 12.276 -6.442 1.00 0.00 H new ATOM 0 HB2 SER A 73 -5.079 15.070 -6.360 1.00 0.00 H new ATOM 0 HB3 SER A 73 -6.657 14.692 -5.698 1.00 0.00 H new ATOM 0 HG SER A 73 -4.979 14.565 -4.095 1.00 0.00 H new ATOM 1163 N GLU A 74 -7.989 13.361 -8.057 1.00 0.00 N ATOM 1164 CA GLU A 74 -8.957 13.834 -9.066 1.00 0.00 C ATOM 1165 C GLU A 74 -10.164 14.561 -8.429 1.00 0.00 C ATOM 1166 O GLU A 74 -10.224 14.739 -7.211 1.00 0.00 O ATOM 1167 CB GLU A 74 -9.402 12.645 -9.943 1.00 0.00 C ATOM 1168 CG GLU A 74 -8.250 12.007 -10.742 1.00 0.00 C ATOM 1169 CD GLU A 74 -8.730 10.998 -11.791 1.00 0.00 C ATOM 1170 OE1 GLU A 74 -9.870 10.925 -12.244 1.00 0.00 O ATOM 1171 OE2 GLU A 74 -7.773 10.155 -12.237 1.00 0.00 O ATOM 0 H GLU A 74 -8.430 12.846 -7.295 1.00 0.00 H new ATOM 0 HA GLU A 74 -8.464 14.575 -9.695 1.00 0.00 H new ATOM 0 HB2 GLU A 74 -9.857 11.885 -9.308 1.00 0.00 H new ATOM 0 HB3 GLU A 74 -10.171 12.983 -10.637 1.00 0.00 H new ATOM 0 HG2 GLU A 74 -7.681 12.793 -11.237 1.00 0.00 H new ATOM 0 HG3 GLU A 74 -7.570 11.508 -10.052 1.00 0.00 H new ATOM 1179 N GLU A 75 -11.146 14.970 -9.244 1.00 0.00 N ATOM 1180 CA GLU A 75 -12.377 15.659 -8.798 1.00 0.00 C ATOM 1181 C GLU A 75 -13.598 14.721 -8.661 1.00 0.00 C ATOM 1182 O GLU A 75 -14.576 15.069 -8.002 1.00 0.00 O ATOM 1183 CB GLU A 75 -12.671 16.853 -9.723 1.00 0.00 C ATOM 1184 CG GLU A 75 -13.037 16.462 -11.162 1.00 0.00 C ATOM 1185 CD GLU A 75 -13.306 17.713 -12.017 1.00 0.00 C ATOM 1186 OE1 GLU A 75 -14.467 18.191 -12.059 1.00 0.00 O ATOM 1187 OE2 GLU A 75 -12.359 18.228 -12.663 1.00 0.00 O ATOM 0 H GLU A 75 -11.111 14.831 -10.254 1.00 0.00 H new ATOM 0 HA GLU A 75 -12.192 16.027 -7.789 1.00 0.00 H new ATOM 0 HB2 GLU A 75 -13.489 17.434 -9.298 1.00 0.00 H new ATOM 0 HB3 GLU A 75 -11.796 17.503 -9.747 1.00 0.00 H new ATOM 0 HG2 GLU A 75 -12.227 15.882 -11.603 1.00 0.00 H new ATOM 0 HG3 GLU A 75 -13.920 15.823 -11.157 1.00 0.00 H new ATOM 1194 N GLU A 76 -13.527 13.512 -9.237 1.00 0.00 N ATOM 1195 CA GLU A 76 -14.537 12.437 -9.121 1.00 0.00 C ATOM 1196 C GLU A 76 -14.084 11.349 -8.117 1.00 0.00 C ATOM 1197 O GLU A 76 -14.351 10.154 -8.269 1.00 0.00 O ATOM 1198 CB GLU A 76 -14.940 11.897 -10.507 1.00 0.00 C ATOM 1199 CG GLU A 76 -13.766 11.381 -11.351 1.00 0.00 C ATOM 1200 CD GLU A 76 -14.237 10.305 -12.353 1.00 0.00 C ATOM 1201 OE1 GLU A 76 -14.289 9.104 -11.986 1.00 0.00 O ATOM 1202 OE2 GLU A 76 -14.567 10.659 -13.513 1.00 0.00 O ATOM 0 H GLU A 76 -12.736 13.241 -9.820 1.00 0.00 H new ATOM 0 HA GLU A 76 -15.451 12.855 -8.699 1.00 0.00 H new ATOM 0 HB2 GLU A 76 -15.659 11.089 -10.374 1.00 0.00 H new ATOM 0 HB3 GLU A 76 -15.448 12.688 -11.058 1.00 0.00 H new ATOM 0 HG2 GLU A 76 -13.309 12.210 -11.891 1.00 0.00 H new ATOM 0 HG3 GLU A 76 -12.999 10.964 -10.698 1.00 0.00 H new ATOM 1209 N GLY A 77 -13.335 11.779 -7.102 1.00 0.00 N ATOM 1210 CA GLY A 77 -12.692 10.961 -6.073 1.00 0.00 C ATOM 1211 C GLY A 77 -11.611 11.763 -5.353 1.00 0.00 C ATOM 1212 O GLY A 77 -11.644 12.994 -5.348 1.00 0.00 O ATOM 0 H GLY A 77 -13.149 12.773 -6.968 1.00 0.00 H new ATOM 0 HA2 GLY A 77 -13.437 10.617 -5.355 1.00 0.00 H new ATOM 0 HA3 GLY A 77 -12.253 10.073 -6.527 1.00 0.00 H new ATOM 1216 N ARG A 78 -10.666 11.074 -4.714 1.00 0.00 N ATOM 1217 CA ARG A 78 -9.468 11.653 -4.070 1.00 0.00 C ATOM 1218 C ARG A 78 -8.280 11.031 -4.804 1.00 0.00 C ATOM 1219 O ARG A 78 -8.258 11.132 -6.028 1.00 0.00 O ATOM 1220 CB ARG A 78 -9.503 11.467 -2.536 1.00 0.00 C ATOM 1221 CG ARG A 78 -10.725 12.068 -1.812 1.00 0.00 C ATOM 1222 CD ARG A 78 -10.710 13.600 -1.682 1.00 0.00 C ATOM 1223 NE ARG A 78 -10.877 14.277 -2.983 1.00 0.00 N ATOM 1224 CZ ARG A 78 -10.555 15.514 -3.305 1.00 0.00 C ATOM 1225 NH1 ARG A 78 -10.170 16.385 -2.417 1.00 0.00 N ATOM 1226 NH2 ARG A 78 -10.609 15.889 -4.552 1.00 0.00 N ATOM 0 H ARG A 78 -10.707 10.059 -4.622 1.00 0.00 H new ATOM 0 HA ARG A 78 -9.402 12.737 -4.160 1.00 0.00 H new ATOM 0 HB2 ARG A 78 -9.465 10.400 -2.318 1.00 0.00 H new ATOM 0 HB3 ARG A 78 -8.601 11.911 -2.115 1.00 0.00 H new ATOM 0 HG2 ARG A 78 -11.628 11.772 -2.346 1.00 0.00 H new ATOM 0 HG3 ARG A 78 -10.788 11.634 -0.814 1.00 0.00 H new ATOM 0 HD2 ARG A 78 -11.508 13.912 -1.008 1.00 0.00 H new ATOM 0 HD3 ARG A 78 -9.769 13.914 -1.230 1.00 0.00 H new ATOM 0 HE ARG A 78 -11.294 13.717 -3.727 1.00 0.00 H new ATOM 0 HH11 ARG A 78 -10.110 16.119 -1.434 1.00 0.00 H new ATOM 0 HH12 ARG A 78 -9.929 17.334 -2.704 1.00 0.00 H new ATOM 0 HH21 ARG A 78 -10.899 15.227 -5.272 1.00 0.00 H new ATOM 0 HH22 ARG A 78 -10.361 16.845 -4.808 1.00 0.00 H new ATOM 1240 N LEU A 79 -7.323 10.397 -4.118 1.00 0.00 N ATOM 1241 CA LEU A 79 -6.223 9.667 -4.773 1.00 0.00 C ATOM 1242 C LEU A 79 -6.865 8.563 -5.627 1.00 0.00 C ATOM 1243 O LEU A 79 -7.433 7.626 -5.071 1.00 0.00 O ATOM 1244 CB LEU A 79 -5.279 9.076 -3.708 1.00 0.00 C ATOM 1245 CG LEU A 79 -4.417 10.115 -2.968 1.00 0.00 C ATOM 1246 CD1 LEU A 79 -3.661 9.429 -1.832 1.00 0.00 C ATOM 1247 CD2 LEU A 79 -3.400 10.767 -3.905 1.00 0.00 C ATOM 0 H LEU A 79 -7.285 10.373 -3.099 1.00 0.00 H new ATOM 0 HA LEU A 79 -5.624 10.326 -5.402 1.00 0.00 H new ATOM 0 HB2 LEU A 79 -5.875 8.530 -2.976 1.00 0.00 H new ATOM 0 HB3 LEU A 79 -4.620 8.352 -4.187 1.00 0.00 H new ATOM 0 HG LEU A 79 -5.082 10.887 -2.581 1.00 0.00 H new ATOM 0 HD11 LEU A 79 -3.050 10.163 -1.306 1.00 0.00 H new ATOM 0 HD12 LEU A 79 -4.374 8.985 -1.137 1.00 0.00 H new ATOM 0 HD13 LEU A 79 -3.019 8.649 -2.241 1.00 0.00 H new ATOM 0 HD21 LEU A 79 -2.808 11.495 -3.350 1.00 0.00 H new ATOM 0 HD22 LEU A 79 -2.741 10.002 -4.316 1.00 0.00 H new ATOM 0 HD23 LEU A 79 -3.924 11.270 -4.718 1.00 0.00 H new ATOM 1259 N TYR A 80 -6.810 8.655 -6.958 1.00 0.00 N ATOM 1260 CA TYR A 80 -7.520 7.711 -7.828 1.00 0.00 C ATOM 1261 C TYR A 80 -6.782 6.384 -8.032 1.00 0.00 C ATOM 1262 O TYR A 80 -5.723 6.314 -8.656 1.00 0.00 O ATOM 1263 CB TYR A 80 -7.956 8.390 -9.121 1.00 0.00 C ATOM 1264 CG TYR A 80 -9.286 7.905 -9.676 1.00 0.00 C ATOM 1265 CD1 TYR A 80 -9.413 6.651 -10.309 1.00 0.00 C ATOM 1266 CD2 TYR A 80 -10.415 8.739 -9.555 1.00 0.00 C ATOM 1267 CE1 TYR A 80 -10.636 6.278 -10.904 1.00 0.00 C ATOM 1268 CE2 TYR A 80 -11.637 8.363 -10.141 1.00 0.00 C ATOM 1269 CZ TYR A 80 -11.741 7.156 -10.858 1.00 0.00 C ATOM 1270 OH TYR A 80 -12.898 6.851 -11.499 1.00 0.00 O ATOM 0 H TYR A 80 -6.283 9.372 -7.457 1.00 0.00 H new ATOM 0 HA TYR A 80 -8.430 7.413 -7.308 1.00 0.00 H new ATOM 0 HB2 TYR A 80 -8.020 9.464 -8.948 1.00 0.00 H new ATOM 0 HB3 TYR A 80 -7.185 8.234 -9.875 1.00 0.00 H new ATOM 0 HD1 TYR A 80 -8.571 5.975 -10.338 1.00 0.00 H new ATOM 0 HD2 TYR A 80 -10.342 9.669 -9.011 1.00 0.00 H new ATOM 0 HE1 TYR A 80 -10.727 5.320 -11.395 1.00 0.00 H new ATOM 0 HE2 TYR A 80 -12.500 9.004 -10.040 1.00 0.00 H new ATOM 0 HH TYR A 80 -13.466 7.648 -11.546 1.00 0.00 H new ATOM 1280 N PHE A 81 -7.375 5.320 -7.488 1.00 0.00 N ATOM 1281 CA PHE A 81 -6.915 3.943 -7.643 1.00 0.00 C ATOM 1282 C PHE A 81 -7.917 2.816 -7.582 1.00 0.00 C ATOM 1283 O PHE A 81 -9.112 3.020 -7.427 1.00 0.00 O ATOM 1284 CB PHE A 81 -5.596 3.659 -6.869 1.00 0.00 C ATOM 1285 CG PHE A 81 -5.644 3.691 -5.347 1.00 0.00 C ATOM 1286 CD1 PHE A 81 -5.640 4.921 -4.660 1.00 0.00 C ATOM 1287 CD2 PHE A 81 -5.575 2.493 -4.608 1.00 0.00 C ATOM 1288 CE1 PHE A 81 -5.603 4.954 -3.254 1.00 0.00 C ATOM 1289 CE2 PHE A 81 -5.523 2.524 -3.201 1.00 0.00 C ATOM 1290 CZ PHE A 81 -5.548 3.754 -2.524 1.00 0.00 C ATOM 0 H PHE A 81 -8.213 5.397 -6.911 1.00 0.00 H new ATOM 0 HA PHE A 81 -6.698 3.920 -8.711 1.00 0.00 H new ATOM 0 HB2 PHE A 81 -5.235 2.676 -7.172 1.00 0.00 H new ATOM 0 HB3 PHE A 81 -4.853 4.386 -7.196 1.00 0.00 H new ATOM 0 HD1 PHE A 81 -5.666 5.846 -5.217 1.00 0.00 H new ATOM 0 HD2 PHE A 81 -5.562 1.544 -5.124 1.00 0.00 H new ATOM 0 HE1 PHE A 81 -5.617 5.901 -2.736 1.00 0.00 H new ATOM 0 HE2 PHE A 81 -5.464 1.602 -2.643 1.00 0.00 H new ATOM 0 HZ PHE A 81 -5.525 3.778 -1.445 1.00 0.00 H new ATOM 1300 N SER A 82 -7.421 1.626 -7.905 1.00 0.00 N ATOM 1301 CA SER A 82 -8.176 0.393 -7.917 1.00 0.00 C ATOM 1302 C SER A 82 -7.278 -0.819 -7.618 1.00 0.00 C ATOM 1303 O SER A 82 -6.421 -0.799 -6.742 1.00 0.00 O ATOM 1304 CB SER A 82 -9.035 0.319 -9.193 1.00 0.00 C ATOM 1305 OG SER A 82 -8.250 0.428 -10.350 1.00 0.00 O ATOM 0 H SER A 82 -6.446 1.497 -8.174 1.00 0.00 H new ATOM 0 HA SER A 82 -8.894 0.371 -7.097 1.00 0.00 H new ATOM 0 HB2 SER A 82 -9.581 -0.624 -9.211 1.00 0.00 H new ATOM 0 HB3 SER A 82 -9.777 1.117 -9.180 1.00 0.00 H new ATOM 0 HG SER A 82 -8.825 0.376 -11.142 1.00 0.00 H new ATOM 1311 N MET A 83 -7.570 -1.893 -8.328 1.00 0.00 N ATOM 1312 CA MET A 83 -7.072 -3.259 -8.272 1.00 0.00 C ATOM 1313 C MET A 83 -7.297 -3.810 -9.700 1.00 0.00 C ATOM 1314 O MET A 83 -7.543 -3.023 -10.615 1.00 0.00 O ATOM 1315 CB MET A 83 -7.902 -3.962 -7.174 1.00 0.00 C ATOM 1316 CG MET A 83 -7.412 -5.344 -6.728 1.00 0.00 C ATOM 1317 SD MET A 83 -8.312 -6.754 -7.420 1.00 0.00 S ATOM 1318 CE MET A 83 -9.809 -6.728 -6.395 1.00 0.00 C ATOM 0 H MET A 83 -8.267 -1.815 -9.069 1.00 0.00 H new ATOM 0 HA MET A 83 -6.021 -3.390 -8.014 1.00 0.00 H new ATOM 0 HB2 MET A 83 -7.932 -3.312 -6.300 1.00 0.00 H new ATOM 0 HB3 MET A 83 -8.927 -4.062 -7.532 1.00 0.00 H new ATOM 0 HG2 MET A 83 -6.360 -5.441 -6.996 1.00 0.00 H new ATOM 0 HG3 MET A 83 -7.470 -5.397 -5.641 1.00 0.00 H new ATOM 0 HE1 MET A 83 -10.471 -7.540 -6.697 1.00 0.00 H new ATOM 0 HE2 MET A 83 -9.535 -6.854 -5.348 1.00 0.00 H new ATOM 0 HE3 MET A 83 -10.322 -5.775 -6.524 1.00 0.00 H new ATOM 1328 N ASP A 84 -7.234 -5.120 -9.940 1.00 0.00 N ATOM 1329 CA ASP A 84 -7.582 -5.653 -11.269 1.00 0.00 C ATOM 1330 C ASP A 84 -9.122 -5.707 -11.432 1.00 0.00 C ATOM 1331 O ASP A 84 -9.631 -5.641 -12.552 1.00 0.00 O ATOM 1332 CB ASP A 84 -6.901 -7.006 -11.498 1.00 0.00 C ATOM 1333 CG ASP A 84 -5.377 -6.881 -11.680 1.00 0.00 C ATOM 1334 OD1 ASP A 84 -4.929 -6.079 -12.535 1.00 0.00 O ATOM 1335 OD2 ASP A 84 -4.622 -7.601 -10.979 1.00 0.00 O ATOM 0 H ASP A 84 -6.953 -5.821 -9.255 1.00 0.00 H new ATOM 0 HA ASP A 84 -7.207 -4.986 -12.045 1.00 0.00 H new ATOM 0 HB2 ASP A 84 -7.109 -7.661 -10.652 1.00 0.00 H new ATOM 0 HB3 ASP A 84 -7.331 -7.480 -12.381 1.00 0.00 H new ATOM 1340 N ASP A 85 -9.867 -5.777 -10.315 1.00 0.00 N ATOM 1341 CA ASP A 85 -11.337 -5.720 -10.245 1.00 0.00 C ATOM 1342 C ASP A 85 -11.820 -4.888 -9.025 1.00 0.00 C ATOM 1343 O ASP A 85 -12.508 -5.403 -8.138 1.00 0.00 O ATOM 1344 CB ASP A 85 -11.892 -7.156 -10.274 1.00 0.00 C ATOM 1345 CG ASP A 85 -13.429 -7.206 -10.372 1.00 0.00 C ATOM 1346 OD1 ASP A 85 -14.029 -6.362 -11.083 1.00 0.00 O ATOM 1347 OD2 ASP A 85 -14.046 -8.120 -9.772 1.00 0.00 O ATOM 0 H ASP A 85 -9.441 -5.880 -9.394 1.00 0.00 H new ATOM 0 HA ASP A 85 -11.732 -5.193 -11.114 1.00 0.00 H new ATOM 0 HB2 ASP A 85 -11.462 -7.689 -11.122 1.00 0.00 H new ATOM 0 HB3 ASP A 85 -11.574 -7.681 -9.373 1.00 0.00 H new ATOM 1352 N GLY A 86 -11.401 -3.614 -8.928 1.00 0.00 N ATOM 1353 CA GLY A 86 -11.684 -2.725 -7.774 1.00 0.00 C ATOM 1354 C GLY A 86 -12.014 -1.257 -8.102 1.00 0.00 C ATOM 1355 O GLY A 86 -12.006 -0.842 -9.261 1.00 0.00 O ATOM 0 H GLY A 86 -10.848 -3.161 -9.656 1.00 0.00 H new ATOM 0 HA2 GLY A 86 -12.520 -3.146 -7.216 1.00 0.00 H new ATOM 0 HA3 GLY A 86 -10.819 -2.740 -7.111 1.00 0.00 H new ATOM 1359 N GLN A 87 -12.323 -0.472 -7.058 1.00 0.00 N ATOM 1360 CA GLN A 87 -12.699 0.961 -7.113 1.00 0.00 C ATOM 1361 C GLN A 87 -12.130 1.789 -5.928 1.00 0.00 C ATOM 1362 O GLN A 87 -12.860 2.531 -5.272 1.00 0.00 O ATOM 1363 CB GLN A 87 -14.234 1.054 -7.245 1.00 0.00 C ATOM 1364 CG GLN A 87 -15.015 0.349 -6.119 1.00 0.00 C ATOM 1365 CD GLN A 87 -16.512 0.589 -6.282 1.00 0.00 C ATOM 1366 OE1 GLN A 87 -17.140 1.347 -5.552 1.00 0.00 O ATOM 1367 NE2 GLN A 87 -17.136 -0.017 -7.272 1.00 0.00 N ATOM 0 H GLN A 87 -12.319 -0.831 -6.103 1.00 0.00 H new ATOM 0 HA GLN A 87 -12.240 1.419 -7.989 1.00 0.00 H new ATOM 0 HB2 GLN A 87 -14.521 2.105 -7.266 1.00 0.00 H new ATOM 0 HB3 GLN A 87 -14.531 0.623 -8.201 1.00 0.00 H new ATOM 0 HG2 GLN A 87 -14.807 -0.721 -6.138 1.00 0.00 H new ATOM 0 HG3 GLN A 87 -14.684 0.721 -5.149 1.00 0.00 H new ATOM 0 HE21 GLN A 87 -16.624 -0.650 -7.886 1.00 0.00 H new ATOM 0 HE22 GLN A 87 -18.131 0.147 -7.424 1.00 0.00 H new ATOM 1376 N THR A 88 -10.828 1.672 -5.629 1.00 0.00 N ATOM 1377 CA THR A 88 -10.168 2.285 -4.446 1.00 0.00 C ATOM 1378 C THR A 88 -9.761 3.756 -4.384 1.00 0.00 C ATOM 1379 O THR A 88 -9.199 4.208 -3.389 1.00 0.00 O ATOM 1380 CB THR A 88 -9.183 1.309 -3.788 1.00 0.00 C ATOM 1381 OG1 THR A 88 -8.240 0.928 -4.753 1.00 0.00 O ATOM 1382 CG2 THR A 88 -9.899 0.023 -3.363 1.00 0.00 C ATOM 0 H THR A 88 -10.182 1.138 -6.210 1.00 0.00 H new ATOM 0 HA THR A 88 -11.050 2.447 -3.826 1.00 0.00 H new ATOM 0 HB THR A 88 -8.734 1.798 -2.924 1.00 0.00 H new ATOM 0 HG1 THR A 88 -7.427 1.465 -4.646 1.00 0.00 H new ATOM 0 HG21 THR A 88 -9.183 -0.656 -2.899 1.00 0.00 H new ATOM 0 HG22 THR A 88 -10.686 0.264 -2.649 1.00 0.00 H new ATOM 0 HG23 THR A 88 -10.337 -0.456 -4.239 1.00 0.00 H new ATOM 1390 N ARG A 89 -10.153 4.494 -5.415 1.00 0.00 N ATOM 1391 CA ARG A 89 -10.094 5.956 -5.696 1.00 0.00 C ATOM 1392 C ARG A 89 -10.371 7.020 -4.597 1.00 0.00 C ATOM 1393 O ARG A 89 -10.614 8.182 -4.931 1.00 0.00 O ATOM 1394 CB ARG A 89 -10.982 6.228 -6.936 1.00 0.00 C ATOM 1395 CG ARG A 89 -12.476 5.973 -6.649 1.00 0.00 C ATOM 1396 CD ARG A 89 -13.389 6.429 -7.795 1.00 0.00 C ATOM 1397 NE ARG A 89 -14.772 5.957 -7.576 1.00 0.00 N ATOM 1398 CZ ARG A 89 -15.909 6.599 -7.795 1.00 0.00 C ATOM 1399 NH1 ARG A 89 -15.967 7.840 -8.187 1.00 0.00 N ATOM 1400 NH2 ARG A 89 -17.044 5.984 -7.618 1.00 0.00 N ATOM 0 H ARG A 89 -10.590 4.021 -6.206 1.00 0.00 H new ATOM 0 HA ARG A 89 -9.024 6.120 -5.825 1.00 0.00 H new ATOM 0 HB2 ARG A 89 -10.847 7.260 -7.258 1.00 0.00 H new ATOM 0 HB3 ARG A 89 -10.658 5.592 -7.760 1.00 0.00 H new ATOM 0 HG2 ARG A 89 -12.630 4.909 -6.469 1.00 0.00 H new ATOM 0 HG3 ARG A 89 -12.760 6.495 -5.735 1.00 0.00 H new ATOM 0 HD2 ARG A 89 -13.377 7.517 -7.866 1.00 0.00 H new ATOM 0 HD3 ARG A 89 -13.013 6.043 -8.743 1.00 0.00 H new ATOM 0 HE ARG A 89 -14.863 5.010 -7.207 1.00 0.00 H new ATOM 0 HH11 ARG A 89 -15.107 8.367 -8.341 1.00 0.00 H new ATOM 0 HH12 ARG A 89 -16.872 8.285 -8.340 1.00 0.00 H new ATOM 0 HH21 ARG A 89 -17.055 5.011 -7.312 1.00 0.00 H new ATOM 0 HH22 ARG A 89 -17.922 6.475 -7.786 1.00 0.00 H new ATOM 1414 N PHE A 90 -10.355 6.679 -3.317 1.00 0.00 N ATOM 1415 CA PHE A 90 -10.481 7.597 -2.179 1.00 0.00 C ATOM 1416 C PHE A 90 -9.112 7.733 -1.470 1.00 0.00 C ATOM 1417 O PHE A 90 -8.140 7.084 -1.858 1.00 0.00 O ATOM 1418 CB PHE A 90 -11.619 7.102 -1.268 1.00 0.00 C ATOM 1419 CG PHE A 90 -12.130 8.131 -0.277 1.00 0.00 C ATOM 1420 CD1 PHE A 90 -12.781 9.289 -0.742 1.00 0.00 C ATOM 1421 CD2 PHE A 90 -11.977 7.930 1.110 1.00 0.00 C ATOM 1422 CE1 PHE A 90 -13.260 10.248 0.169 1.00 0.00 C ATOM 1423 CE2 PHE A 90 -12.472 8.882 2.020 1.00 0.00 C ATOM 1424 CZ PHE A 90 -13.105 10.045 1.551 1.00 0.00 C ATOM 0 H PHE A 90 -10.249 5.708 -3.022 1.00 0.00 H new ATOM 0 HA PHE A 90 -10.752 8.603 -2.500 1.00 0.00 H new ATOM 0 HB2 PHE A 90 -12.450 6.775 -1.893 1.00 0.00 H new ATOM 0 HB3 PHE A 90 -11.271 6.228 -0.717 1.00 0.00 H new ATOM 0 HD1 PHE A 90 -12.913 9.442 -1.803 1.00 0.00 H new ATOM 0 HD2 PHE A 90 -11.479 7.044 1.475 1.00 0.00 H new ATOM 0 HE1 PHE A 90 -13.747 11.141 -0.194 1.00 0.00 H new ATOM 0 HE2 PHE A 90 -12.365 8.718 3.082 1.00 0.00 H new ATOM 0 HZ PHE A 90 -13.472 10.781 2.251 1.00 0.00 H new ATOM 1434 N THR A 91 -8.988 8.579 -0.438 1.00 0.00 N ATOM 1435 CA THR A 91 -7.709 8.714 0.300 1.00 0.00 C ATOM 1436 C THR A 91 -7.334 7.398 1.006 1.00 0.00 C ATOM 1437 O THR A 91 -8.208 6.601 1.356 1.00 0.00 O ATOM 1438 CB THR A 91 -7.721 9.922 1.252 1.00 0.00 C ATOM 1439 OG1 THR A 91 -6.436 10.092 1.805 1.00 0.00 O ATOM 1440 CG2 THR A 91 -8.709 9.798 2.411 1.00 0.00 C ATOM 0 H THR A 91 -9.741 9.175 -0.094 1.00 0.00 H new ATOM 0 HA THR A 91 -6.923 8.915 -0.427 1.00 0.00 H new ATOM 0 HB THR A 91 -8.032 10.772 0.645 1.00 0.00 H new ATOM 0 HG1 THR A 91 -6.440 10.862 2.411 1.00 0.00 H new ATOM 0 HG21 THR A 91 -8.654 10.691 3.033 1.00 0.00 H new ATOM 0 HG22 THR A 91 -9.720 9.692 2.018 1.00 0.00 H new ATOM 0 HG23 THR A 91 -8.459 8.922 3.010 1.00 0.00 H new ATOM 1448 N ASP A 92 -6.041 7.133 1.201 1.00 0.00 N ATOM 1449 CA ASP A 92 -5.550 5.866 1.760 1.00 0.00 C ATOM 1450 C ASP A 92 -5.738 5.736 3.282 1.00 0.00 C ATOM 1451 O ASP A 92 -6.094 4.657 3.760 1.00 0.00 O ATOM 1452 CB ASP A 92 -4.083 5.655 1.355 1.00 0.00 C ATOM 1453 CG ASP A 92 -3.122 6.632 2.056 1.00 0.00 C ATOM 1454 OD1 ASP A 92 -3.006 7.795 1.603 1.00 0.00 O ATOM 1455 OD2 ASP A 92 -2.485 6.237 3.061 1.00 0.00 O ATOM 0 H ASP A 92 -5.298 7.794 0.975 1.00 0.00 H new ATOM 0 HA ASP A 92 -6.166 5.074 1.334 1.00 0.00 H new ATOM 0 HB2 ASP A 92 -3.790 4.632 1.591 1.00 0.00 H new ATOM 0 HB3 ASP A 92 -3.989 5.772 0.275 1.00 0.00 H new ATOM 1460 N LEU A 93 -5.576 6.826 4.045 1.00 0.00 N ATOM 1461 CA LEU A 93 -5.622 6.790 5.513 1.00 0.00 C ATOM 1462 C LEU A 93 -7.023 6.451 6.048 1.00 0.00 C ATOM 1463 O LEU A 93 -7.172 5.572 6.895 1.00 0.00 O ATOM 1464 CB LEU A 93 -5.097 8.132 6.060 1.00 0.00 C ATOM 1465 CG LEU A 93 -5.077 8.240 7.600 1.00 0.00 C ATOM 1466 CD1 LEU A 93 -4.188 7.183 8.257 1.00 0.00 C ATOM 1467 CD2 LEU A 93 -4.559 9.621 8.006 1.00 0.00 C ATOM 0 H LEU A 93 -5.410 7.757 3.662 1.00 0.00 H new ATOM 0 HA LEU A 93 -4.978 5.985 5.867 1.00 0.00 H new ATOM 0 HB2 LEU A 93 -4.086 8.290 5.686 1.00 0.00 H new ATOM 0 HB3 LEU A 93 -5.714 8.937 5.661 1.00 0.00 H new ATOM 0 HG LEU A 93 -6.100 8.080 7.941 1.00 0.00 H new ATOM 0 HD11 LEU A 93 -4.213 7.308 9.339 1.00 0.00 H new ATOM 0 HD12 LEU A 93 -4.553 6.189 7.998 1.00 0.00 H new ATOM 0 HD13 LEU A 93 -3.164 7.298 7.902 1.00 0.00 H new ATOM 0 HD21 LEU A 93 -4.544 9.699 9.093 1.00 0.00 H new ATOM 0 HD22 LEU A 93 -3.550 9.759 7.619 1.00 0.00 H new ATOM 0 HD23 LEU A 93 -5.214 10.390 7.596 1.00 0.00 H new ATOM 1479 N LEU A 94 -8.059 7.110 5.514 1.00 0.00 N ATOM 1480 CA LEU A 94 -9.446 6.867 5.928 1.00 0.00 C ATOM 1481 C LEU A 94 -9.917 5.465 5.514 1.00 0.00 C ATOM 1482 O LEU A 94 -10.629 4.817 6.280 1.00 0.00 O ATOM 1483 CB LEU A 94 -10.373 7.973 5.388 1.00 0.00 C ATOM 1484 CG LEU A 94 -10.064 9.395 5.906 1.00 0.00 C ATOM 1485 CD1 LEU A 94 -11.064 10.390 5.319 1.00 0.00 C ATOM 1486 CD2 LEU A 94 -10.135 9.500 7.431 1.00 0.00 C ATOM 0 H LEU A 94 -7.961 7.821 4.789 1.00 0.00 H new ATOM 0 HA LEU A 94 -9.490 6.903 7.017 1.00 0.00 H new ATOM 0 HB2 LEU A 94 -10.312 7.978 4.300 1.00 0.00 H new ATOM 0 HB3 LEU A 94 -11.402 7.723 5.649 1.00 0.00 H new ATOM 0 HG LEU A 94 -9.045 9.622 5.593 1.00 0.00 H new ATOM 0 HD11 LEU A 94 -10.841 11.391 5.688 1.00 0.00 H new ATOM 0 HD12 LEU A 94 -10.992 10.380 4.231 1.00 0.00 H new ATOM 0 HD13 LEU A 94 -12.074 10.110 5.618 1.00 0.00 H new ATOM 0 HD21 LEU A 94 -9.909 10.522 7.736 1.00 0.00 H new ATOM 0 HD22 LEU A 94 -11.137 9.234 7.768 1.00 0.00 H new ATOM 0 HD23 LEU A 94 -9.410 8.819 7.877 1.00 0.00 H new ATOM 1498 N GLN A 95 -9.469 4.947 4.362 1.00 0.00 N ATOM 1499 CA GLN A 95 -9.755 3.595 3.919 1.00 0.00 C ATOM 1500 C GLN A 95 -9.082 2.545 4.816 1.00 0.00 C ATOM 1501 O GLN A 95 -9.735 1.582 5.210 1.00 0.00 O ATOM 1502 CB GLN A 95 -9.263 3.483 2.474 1.00 0.00 C ATOM 1503 CG GLN A 95 -10.316 3.949 1.461 1.00 0.00 C ATOM 1504 CD GLN A 95 -9.878 3.674 0.029 1.00 0.00 C ATOM 1505 OE1 GLN A 95 -10.317 2.722 -0.601 1.00 0.00 O ATOM 1506 NE2 GLN A 95 -8.996 4.468 -0.524 1.00 0.00 N ATOM 0 H GLN A 95 -8.889 5.473 3.708 1.00 0.00 H new ATOM 0 HA GLN A 95 -10.826 3.399 3.980 1.00 0.00 H new ATOM 0 HB2 GLN A 95 -8.358 4.079 2.354 1.00 0.00 H new ATOM 0 HB3 GLN A 95 -8.993 2.448 2.264 1.00 0.00 H new ATOM 0 HG2 GLN A 95 -11.260 3.441 1.657 1.00 0.00 H new ATOM 0 HG3 GLN A 95 -10.496 5.016 1.588 1.00 0.00 H new ATOM 0 HE21 GLN A 95 -8.627 5.263 -0.002 1.00 0.00 H new ATOM 0 HE22 GLN A 95 -8.677 4.292 -1.477 1.00 0.00 H new ATOM 1515 N LEU A 96 -7.814 2.750 5.191 1.00 0.00 N ATOM 1516 CA LEU A 96 -7.069 1.844 6.073 1.00 0.00 C ATOM 1517 C LEU A 96 -7.725 1.722 7.462 1.00 0.00 C ATOM 1518 O LEU A 96 -7.714 0.636 8.040 1.00 0.00 O ATOM 1519 CB LEU A 96 -5.602 2.322 6.114 1.00 0.00 C ATOM 1520 CG LEU A 96 -4.643 1.422 6.922 1.00 0.00 C ATOM 1521 CD1 LEU A 96 -3.240 1.460 6.313 1.00 0.00 C ATOM 1522 CD2 LEU A 96 -4.512 1.872 8.382 1.00 0.00 C ATOM 0 H LEU A 96 -7.271 3.558 4.887 1.00 0.00 H new ATOM 0 HA LEU A 96 -7.090 0.827 5.681 1.00 0.00 H new ATOM 0 HB2 LEU A 96 -5.231 2.396 5.092 1.00 0.00 H new ATOM 0 HB3 LEU A 96 -5.575 3.327 6.536 1.00 0.00 H new ATOM 0 HG LEU A 96 -5.067 0.419 6.888 1.00 0.00 H new ATOM 0 HD11 LEU A 96 -2.574 0.821 6.893 1.00 0.00 H new ATOM 0 HD12 LEU A 96 -3.280 1.103 5.284 1.00 0.00 H new ATOM 0 HD13 LEU A 96 -2.865 2.483 6.328 1.00 0.00 H new ATOM 0 HD21 LEU A 96 -3.827 1.207 8.908 1.00 0.00 H new ATOM 0 HD22 LEU A 96 -4.126 2.891 8.415 1.00 0.00 H new ATOM 0 HD23 LEU A 96 -5.490 1.839 8.862 1.00 0.00 H new ATOM 1534 N VAL A 97 -8.347 2.796 7.968 1.00 0.00 N ATOM 1535 CA VAL A 97 -9.105 2.793 9.235 1.00 0.00 C ATOM 1536 C VAL A 97 -10.507 2.187 9.072 1.00 0.00 C ATOM 1537 O VAL A 97 -10.869 1.274 9.810 1.00 0.00 O ATOM 1538 CB VAL A 97 -9.156 4.213 9.842 1.00 0.00 C ATOM 1539 CG1 VAL A 97 -10.023 4.282 11.108 1.00 0.00 C ATOM 1540 CG2 VAL A 97 -7.749 4.689 10.230 1.00 0.00 C ATOM 0 H VAL A 97 -8.340 3.705 7.506 1.00 0.00 H new ATOM 0 HA VAL A 97 -8.575 2.148 9.935 1.00 0.00 H new ATOM 0 HB VAL A 97 -9.590 4.849 9.071 1.00 0.00 H new ATOM 0 HG11 VAL A 97 -10.024 5.302 11.493 1.00 0.00 H new ATOM 0 HG12 VAL A 97 -11.043 3.984 10.867 1.00 0.00 H new ATOM 0 HG13 VAL A 97 -9.618 3.609 11.864 1.00 0.00 H new ATOM 0 HG21 VAL A 97 -7.808 5.691 10.655 1.00 0.00 H new ATOM 0 HG22 VAL A 97 -7.324 4.007 10.966 1.00 0.00 H new ATOM 0 HG23 VAL A 97 -7.114 4.708 9.344 1.00 0.00 H new ATOM 1550 N GLU A 98 -11.311 2.635 8.110 1.00 0.00 N ATOM 1551 CA GLU A 98 -12.707 2.192 7.945 1.00 0.00 C ATOM 1552 C GLU A 98 -12.839 0.764 7.435 1.00 0.00 C ATOM 1553 O GLU A 98 -13.724 0.072 7.911 1.00 0.00 O ATOM 1554 CB GLU A 98 -13.423 3.189 7.018 1.00 0.00 C ATOM 1555 CG GLU A 98 -14.835 2.785 6.571 1.00 0.00 C ATOM 1556 CD GLU A 98 -15.854 2.628 7.724 1.00 0.00 C ATOM 1557 OE1 GLU A 98 -15.656 3.199 8.826 1.00 0.00 O ATOM 1558 OE2 GLU A 98 -16.896 1.959 7.517 1.00 0.00 O ATOM 0 H GLU A 98 -11.017 3.321 7.415 1.00 0.00 H new ATOM 0 HA GLU A 98 -13.177 2.179 8.928 1.00 0.00 H new ATOM 0 HB2 GLU A 98 -13.484 4.151 7.527 1.00 0.00 H new ATOM 0 HB3 GLU A 98 -12.809 3.337 6.130 1.00 0.00 H new ATOM 0 HG2 GLU A 98 -15.209 3.533 5.872 1.00 0.00 H new ATOM 0 HG3 GLU A 98 -14.774 1.843 6.026 1.00 0.00 H new ATOM 1565 N PHE A 99 -12.019 0.313 6.488 1.00 0.00 N ATOM 1566 CA PHE A 99 -12.004 -1.081 6.026 1.00 0.00 C ATOM 1567 C PHE A 99 -11.168 -2.047 6.901 1.00 0.00 C ATOM 1568 O PHE A 99 -11.030 -3.211 6.534 1.00 0.00 O ATOM 1569 CB PHE A 99 -11.692 -1.129 4.522 1.00 0.00 C ATOM 1570 CG PHE A 99 -12.785 -0.486 3.682 1.00 0.00 C ATOM 1571 CD1 PHE A 99 -13.891 -1.251 3.265 1.00 0.00 C ATOM 1572 CD2 PHE A 99 -12.732 0.885 3.369 1.00 0.00 C ATOM 1573 CE1 PHE A 99 -14.935 -0.649 2.542 1.00 0.00 C ATOM 1574 CE2 PHE A 99 -13.783 1.494 2.660 1.00 0.00 C ATOM 1575 CZ PHE A 99 -14.886 0.726 2.244 1.00 0.00 C ATOM 0 H PHE A 99 -11.339 0.907 6.013 1.00 0.00 H new ATOM 0 HA PHE A 99 -13.008 -1.484 6.162 1.00 0.00 H new ATOM 0 HB2 PHE A 99 -10.746 -0.621 4.334 1.00 0.00 H new ATOM 0 HB3 PHE A 99 -11.563 -2.166 4.213 1.00 0.00 H new ATOM 0 HD1 PHE A 99 -13.937 -2.304 3.501 1.00 0.00 H new ATOM 0 HD2 PHE A 99 -11.879 1.473 3.675 1.00 0.00 H new ATOM 0 HE1 PHE A 99 -15.776 -1.242 2.215 1.00 0.00 H new ATOM 0 HE2 PHE A 99 -13.743 2.550 2.435 1.00 0.00 H new ATOM 0 HZ PHE A 99 -15.693 1.190 1.697 1.00 0.00 H new ATOM 1585 N HIS A 100 -10.613 -1.622 8.053 1.00 0.00 N ATOM 1586 CA HIS A 100 -9.702 -2.459 8.875 1.00 0.00 C ATOM 1587 C HIS A 100 -10.277 -3.810 9.344 1.00 0.00 C ATOM 1588 O HIS A 100 -9.534 -4.775 9.513 1.00 0.00 O ATOM 1589 CB HIS A 100 -9.162 -1.671 10.091 1.00 0.00 C ATOM 1590 CG HIS A 100 -10.038 -1.692 11.326 1.00 0.00 C ATOM 1591 ND1 HIS A 100 -10.992 -0.752 11.672 1.00 0.00 N ATOM 1592 CD2 HIS A 100 -10.000 -2.627 12.327 1.00 0.00 C ATOM 1593 CE1 HIS A 100 -11.528 -1.108 12.857 1.00 0.00 C ATOM 1594 NE2 HIS A 100 -10.943 -2.251 13.271 1.00 0.00 N ATOM 0 H HIS A 100 -10.779 -0.694 8.443 1.00 0.00 H new ATOM 0 HA HIS A 100 -8.891 -2.709 8.191 1.00 0.00 H new ATOM 0 HB2 HIS A 100 -8.183 -2.071 10.355 1.00 0.00 H new ATOM 0 HB3 HIS A 100 -9.012 -0.634 9.791 1.00 0.00 H new ATOM 0 HD1 HIS A 100 -11.247 0.070 11.124 1.00 0.00 H new ATOM 0 HD2 HIS A 100 -9.357 -3.493 12.372 1.00 0.00 H new ATOM 0 HE1 HIS A 100 -12.298 -0.567 13.387 1.00 0.00 H new ATOM 1603 N GLN A 101 -11.582 -3.847 9.621 1.00 0.00 N ATOM 1604 CA GLN A 101 -12.311 -5.009 10.144 1.00 0.00 C ATOM 1605 C GLN A 101 -12.703 -6.026 9.050 1.00 0.00 C ATOM 1606 O GLN A 101 -12.659 -7.233 9.293 1.00 0.00 O ATOM 1607 CB GLN A 101 -13.488 -4.544 11.033 1.00 0.00 C ATOM 1608 CG GLN A 101 -14.688 -3.856 10.349 1.00 0.00 C ATOM 1609 CD GLN A 101 -14.303 -2.620 9.539 1.00 0.00 C ATOM 1610 OE1 GLN A 101 -13.940 -2.747 8.378 1.00 0.00 O ATOM 1611 NE2 GLN A 101 -14.263 -1.432 10.117 1.00 0.00 N ATOM 0 H GLN A 101 -12.186 -3.037 9.482 1.00 0.00 H new ATOM 0 HA GLN A 101 -11.634 -5.575 10.784 1.00 0.00 H new ATOM 0 HB2 GLN A 101 -13.865 -5.415 11.570 1.00 0.00 H new ATOM 0 HB3 GLN A 101 -13.091 -3.856 11.780 1.00 0.00 H new ATOM 0 HG2 GLN A 101 -15.180 -4.572 9.691 1.00 0.00 H new ATOM 0 HG3 GLN A 101 -15.414 -3.570 11.110 1.00 0.00 H new ATOM 0 HE21 GLN A 101 -14.566 -1.325 11.085 1.00 0.00 H new ATOM 0 HE22 GLN A 101 -13.930 -0.622 9.595 1.00 0.00 H new ATOM 1620 N LEU A 102 -13.039 -5.547 7.846 1.00 0.00 N ATOM 1621 CA LEU A 102 -13.349 -6.336 6.645 1.00 0.00 C ATOM 1622 C LEU A 102 -12.784 -5.619 5.402 1.00 0.00 C ATOM 1623 O LEU A 102 -13.443 -4.768 4.796 1.00 0.00 O ATOM 1624 CB LEU A 102 -14.877 -6.536 6.523 1.00 0.00 C ATOM 1625 CG LEU A 102 -15.525 -7.478 7.557 1.00 0.00 C ATOM 1626 CD1 LEU A 102 -17.045 -7.461 7.380 1.00 0.00 C ATOM 1627 CD2 LEU A 102 -15.053 -8.927 7.407 1.00 0.00 C ATOM 0 H LEU A 102 -13.106 -4.544 7.673 1.00 0.00 H new ATOM 0 HA LEU A 102 -12.885 -7.319 6.722 1.00 0.00 H new ATOM 0 HB2 LEU A 102 -15.357 -5.561 6.600 1.00 0.00 H new ATOM 0 HB3 LEU A 102 -15.094 -6.920 5.526 1.00 0.00 H new ATOM 0 HG LEU A 102 -15.230 -7.117 8.542 1.00 0.00 H new ATOM 0 HD11 LEU A 102 -17.504 -8.127 8.111 1.00 0.00 H new ATOM 0 HD12 LEU A 102 -17.417 -6.447 7.529 1.00 0.00 H new ATOM 0 HD13 LEU A 102 -17.298 -7.797 6.374 1.00 0.00 H new ATOM 0 HD21 LEU A 102 -15.540 -9.548 8.159 1.00 0.00 H new ATOM 0 HD22 LEU A 102 -15.310 -9.292 6.413 1.00 0.00 H new ATOM 0 HD23 LEU A 102 -13.972 -8.973 7.542 1.00 0.00 H new ATOM 1639 N ASN A 103 -11.541 -5.956 5.044 1.00 0.00 N ATOM 1640 CA ASN A 103 -10.794 -5.308 3.962 1.00 0.00 C ATOM 1641 C ASN A 103 -11.142 -5.865 2.554 1.00 0.00 C ATOM 1642 O ASN A 103 -12.102 -6.623 2.384 1.00 0.00 O ATOM 1643 CB ASN A 103 -9.275 -5.334 4.260 1.00 0.00 C ATOM 1644 CG ASN A 103 -8.843 -5.260 5.720 1.00 0.00 C ATOM 1645 OD1 ASN A 103 -9.086 -6.164 6.507 1.00 0.00 O ATOM 1646 ND2 ASN A 103 -8.080 -4.263 6.105 1.00 0.00 N ATOM 0 H ASN A 103 -11.017 -6.699 5.506 1.00 0.00 H new ATOM 0 HA ASN A 103 -11.110 -4.265 3.931 1.00 0.00 H new ATOM 0 HB2 ASN A 103 -8.864 -6.249 3.834 1.00 0.00 H new ATOM 0 HB3 ASN A 103 -8.814 -4.501 3.730 1.00 0.00 H new ATOM 0 HD21 ASN A 103 -7.698 -4.249 7.051 1.00 0.00 H new ATOM 0 HD22 ASN A 103 -7.870 -3.503 5.458 1.00 0.00 H new ATOM 1653 N ARG A 104 -10.371 -5.456 1.527 1.00 0.00 N ATOM 1654 CA ARG A 104 -10.574 -5.837 0.107 1.00 0.00 C ATOM 1655 C ARG A 104 -9.649 -6.963 -0.396 1.00 0.00 C ATOM 1656 O ARG A 104 -9.967 -7.604 -1.398 1.00 0.00 O ATOM 1657 CB ARG A 104 -10.380 -4.599 -0.795 1.00 0.00 C ATOM 1658 CG ARG A 104 -11.461 -3.506 -0.719 1.00 0.00 C ATOM 1659 CD ARG A 104 -11.495 -2.707 0.592 1.00 0.00 C ATOM 1660 NE ARG A 104 -12.194 -1.419 0.401 1.00 0.00 N ATOM 1661 CZ ARG A 104 -11.659 -0.253 0.081 1.00 0.00 C ATOM 1662 NH1 ARG A 104 -10.375 -0.064 -0.005 1.00 0.00 N ATOM 1663 NH2 ARG A 104 -12.406 0.777 -0.185 1.00 0.00 N ATOM 0 H ARG A 104 -9.571 -4.838 1.660 1.00 0.00 H new ATOM 0 HA ARG A 104 -11.591 -6.224 0.052 1.00 0.00 H new ATOM 0 HB2 ARG A 104 -9.421 -4.145 -0.547 1.00 0.00 H new ATOM 0 HB3 ARG A 104 -10.314 -4.939 -1.828 1.00 0.00 H new ATOM 0 HG2 ARG A 104 -11.310 -2.811 -1.545 1.00 0.00 H new ATOM 0 HG3 ARG A 104 -12.436 -3.971 -0.867 1.00 0.00 H new ATOM 0 HD2 ARG A 104 -11.998 -3.288 1.365 1.00 0.00 H new ATOM 0 HD3 ARG A 104 -10.478 -2.526 0.940 1.00 0.00 H new ATOM 0 HE ARG A 104 -13.206 -1.431 0.531 1.00 0.00 H new ATOM 0 HH11 ARG A 104 -9.733 -0.835 0.178 1.00 0.00 H new ATOM 0 HH12 ARG A 104 -10.010 0.855 -0.256 1.00 0.00 H new ATOM 0 HH21 ARG A 104 -13.422 0.693 -0.149 1.00 0.00 H new ATOM 0 HH22 ARG A 104 -11.976 1.669 -0.430 1.00 0.00 H new ATOM 1677 N GLY A 105 -8.525 -7.193 0.291 1.00 0.00 N ATOM 1678 CA GLY A 105 -7.449 -8.134 -0.076 1.00 0.00 C ATOM 1679 C GLY A 105 -6.925 -8.043 -1.516 1.00 0.00 C ATOM 1680 O GLY A 105 -7.144 -7.062 -2.233 1.00 0.00 O ATOM 0 H GLY A 105 -8.326 -6.705 1.164 1.00 0.00 H new ATOM 0 HA2 GLY A 105 -6.611 -7.977 0.603 1.00 0.00 H new ATOM 0 HA3 GLY A 105 -7.810 -9.149 0.093 1.00 0.00 H new ATOM 1684 N ILE A 106 -6.178 -9.080 -1.914 1.00 0.00 N ATOM 1685 CA ILE A 106 -5.693 -9.250 -3.309 1.00 0.00 C ATOM 1686 C ILE A 106 -6.776 -9.927 -4.183 1.00 0.00 C ATOM 1687 O ILE A 106 -7.671 -10.558 -3.618 1.00 0.00 O ATOM 1688 CB ILE A 106 -4.331 -9.981 -3.337 1.00 0.00 C ATOM 1689 CG1 ILE A 106 -3.603 -9.709 -4.677 1.00 0.00 C ATOM 1690 CG2 ILE A 106 -4.483 -11.480 -3.054 1.00 0.00 C ATOM 1691 CD1 ILE A 106 -2.132 -10.126 -4.681 1.00 0.00 C ATOM 0 H ILE A 106 -5.887 -9.830 -1.287 1.00 0.00 H new ATOM 0 HA ILE A 106 -5.514 -8.268 -3.747 1.00 0.00 H new ATOM 0 HB ILE A 106 -3.712 -9.581 -2.534 1.00 0.00 H new ATOM 0 HG12 ILE A 106 -4.123 -10.239 -5.475 1.00 0.00 H new ATOM 0 HG13 ILE A 106 -3.669 -8.645 -4.905 1.00 0.00 H new ATOM 0 HG21 ILE A 106 -3.503 -11.957 -3.083 1.00 0.00 H new ATOM 0 HG22 ILE A 106 -4.926 -11.621 -2.068 1.00 0.00 H new ATOM 0 HG23 ILE A 106 -5.128 -11.929 -3.809 1.00 0.00 H new ATOM 0 HD11 ILE A 106 -1.693 -9.903 -5.654 1.00 0.00 H new ATOM 0 HD12 ILE A 106 -1.596 -9.577 -3.907 1.00 0.00 H new ATOM 0 HD13 ILE A 106 -2.057 -11.196 -4.486 1.00 0.00 H new ATOM 1703 N LEU A 107 -6.697 -9.841 -5.530 1.00 0.00 N ATOM 1704 CA LEU A 107 -7.676 -10.457 -6.463 1.00 0.00 C ATOM 1705 C LEU A 107 -8.392 -11.761 -5.979 1.00 0.00 C ATOM 1706 O LEU A 107 -9.626 -11.720 -5.919 1.00 0.00 O ATOM 1707 CB LEU A 107 -7.029 -10.686 -7.855 1.00 0.00 C ATOM 1708 CG LEU A 107 -7.728 -9.993 -9.030 1.00 0.00 C ATOM 1709 CD1 LEU A 107 -7.043 -10.411 -10.332 1.00 0.00 C ATOM 1710 CD2 LEU A 107 -9.215 -10.332 -9.159 1.00 0.00 C ATOM 0 H LEU A 107 -5.948 -9.339 -6.007 1.00 0.00 H new ATOM 0 HA LEU A 107 -8.479 -9.721 -6.515 1.00 0.00 H new ATOM 0 HB2 LEU A 107 -5.995 -10.343 -7.817 1.00 0.00 H new ATOM 0 HB3 LEU A 107 -7.002 -11.758 -8.052 1.00 0.00 H new ATOM 0 HG LEU A 107 -7.652 -8.923 -8.839 1.00 0.00 H new ATOM 0 HD11 LEU A 107 -7.533 -9.923 -11.174 1.00 0.00 H new ATOM 0 HD12 LEU A 107 -5.994 -10.116 -10.302 1.00 0.00 H new ATOM 0 HD13 LEU A 107 -7.113 -11.492 -10.449 1.00 0.00 H new ATOM 0 HD21 LEU A 107 -9.636 -9.802 -10.014 1.00 0.00 H new ATOM 0 HD22 LEU A 107 -9.332 -11.406 -9.304 1.00 0.00 H new ATOM 0 HD23 LEU A 107 -9.737 -10.029 -8.251 1.00 0.00 H new ATOM 1722 N PRO A 108 -7.708 -12.892 -5.641 1.00 0.00 N ATOM 1723 CA PRO A 108 -8.392 -14.189 -5.495 1.00 0.00 C ATOM 1724 C PRO A 108 -8.246 -14.932 -4.141 1.00 0.00 C ATOM 1725 O PRO A 108 -9.018 -15.859 -3.885 1.00 0.00 O ATOM 1726 CB PRO A 108 -7.784 -15.027 -6.632 1.00 0.00 C ATOM 1727 CG PRO A 108 -6.406 -14.409 -6.916 1.00 0.00 C ATOM 1728 CD PRO A 108 -6.322 -13.208 -5.975 1.00 0.00 C ATOM 0 HA PRO A 108 -9.469 -14.027 -5.534 1.00 0.00 H new ATOM 0 HB2 PRO A 108 -7.691 -16.073 -6.340 1.00 0.00 H new ATOM 0 HB3 PRO A 108 -8.416 -14.999 -7.520 1.00 0.00 H new ATOM 0 HG2 PRO A 108 -5.604 -15.122 -6.722 1.00 0.00 H new ATOM 0 HG3 PRO A 108 -6.316 -14.103 -7.958 1.00 0.00 H new ATOM 0 HD2 PRO A 108 -5.745 -13.446 -5.081 1.00 0.00 H new ATOM 0 HD3 PRO A 108 -5.830 -12.363 -6.456 1.00 0.00 H new ATOM 1736 N CYS A 109 -7.283 -14.574 -3.279 1.00 0.00 N ATOM 1737 CA CYS A 109 -6.939 -15.246 -2.031 1.00 0.00 C ATOM 1738 C CYS A 109 -7.469 -14.502 -0.770 1.00 0.00 C ATOM 1739 O CYS A 109 -8.608 -14.029 -0.792 1.00 0.00 O ATOM 1740 CB CYS A 109 -5.418 -15.411 -2.143 1.00 0.00 C ATOM 1741 SG CYS A 109 -4.947 -16.482 -3.541 1.00 0.00 S ATOM 0 H CYS A 109 -6.693 -13.760 -3.450 1.00 0.00 H new ATOM 0 HA CYS A 109 -7.422 -16.213 -1.893 1.00 0.00 H new ATOM 0 HB2 CYS A 109 -4.955 -14.432 -2.265 1.00 0.00 H new ATOM 0 HB3 CYS A 109 -5.030 -15.834 -1.216 1.00 0.00 H new ATOM 0 HG CYS A 109 -3.661 -16.418 -3.723 1.00 0.00 H new ATOM 1747 N LEU A 110 -6.711 -14.424 0.343 1.00 0.00 N ATOM 1748 CA LEU A 110 -7.142 -13.793 1.609 1.00 0.00 C ATOM 1749 C LEU A 110 -7.616 -12.340 1.394 1.00 0.00 C ATOM 1750 O LEU A 110 -6.940 -11.538 0.742 1.00 0.00 O ATOM 1751 CB LEU A 110 -6.010 -13.826 2.671 1.00 0.00 C ATOM 1752 CG LEU A 110 -5.867 -15.080 3.563 1.00 0.00 C ATOM 1753 CD1 LEU A 110 -6.996 -15.146 4.594 1.00 0.00 C ATOM 1754 CD2 LEU A 110 -5.851 -16.398 2.790 1.00 0.00 C ATOM 0 H LEU A 110 -5.766 -14.804 0.389 1.00 0.00 H new ATOM 0 HA LEU A 110 -7.986 -14.377 1.977 1.00 0.00 H new ATOM 0 HB2 LEU A 110 -5.064 -13.681 2.150 1.00 0.00 H new ATOM 0 HB3 LEU A 110 -6.147 -12.967 3.328 1.00 0.00 H new ATOM 0 HG LEU A 110 -4.897 -14.968 4.047 1.00 0.00 H new ATOM 0 HD11 LEU A 110 -6.874 -16.037 5.210 1.00 0.00 H new ATOM 0 HD12 LEU A 110 -6.963 -14.259 5.227 1.00 0.00 H new ATOM 0 HD13 LEU A 110 -7.956 -15.189 4.080 1.00 0.00 H new ATOM 0 HD21 LEU A 110 -5.748 -17.228 3.489 1.00 0.00 H new ATOM 0 HD22 LEU A 110 -6.782 -16.505 2.234 1.00 0.00 H new ATOM 0 HD23 LEU A 110 -5.011 -16.402 2.095 1.00 0.00 H new ATOM 1766 N LEU A 111 -8.766 -12.004 1.994 1.00 0.00 N ATOM 1767 CA LEU A 111 -9.445 -10.709 1.825 1.00 0.00 C ATOM 1768 C LEU A 111 -9.148 -9.644 2.898 1.00 0.00 C ATOM 1769 O LEU A 111 -9.406 -8.465 2.672 1.00 0.00 O ATOM 1770 CB LEU A 111 -10.946 -10.928 1.550 1.00 0.00 C ATOM 1771 CG LEU A 111 -11.893 -11.272 2.718 1.00 0.00 C ATOM 1772 CD1 LEU A 111 -11.458 -12.527 3.480 1.00 0.00 C ATOM 1773 CD2 LEU A 111 -12.080 -10.103 3.691 1.00 0.00 C ATOM 0 H LEU A 111 -9.261 -12.636 2.623 1.00 0.00 H new ATOM 0 HA LEU A 111 -9.000 -10.248 0.943 1.00 0.00 H new ATOM 0 HB2 LEU A 111 -11.326 -10.022 1.078 1.00 0.00 H new ATOM 0 HB3 LEU A 111 -11.029 -11.729 0.816 1.00 0.00 H new ATOM 0 HG LEU A 111 -12.856 -11.478 2.252 1.00 0.00 H new ATOM 0 HD11 LEU A 111 -12.160 -12.722 4.291 1.00 0.00 H new ATOM 0 HD12 LEU A 111 -11.443 -13.379 2.800 1.00 0.00 H new ATOM 0 HD13 LEU A 111 -10.461 -12.375 3.892 1.00 0.00 H new ATOM 0 HD21 LEU A 111 -12.756 -10.401 4.493 1.00 0.00 H new ATOM 0 HD22 LEU A 111 -11.115 -9.824 4.115 1.00 0.00 H new ATOM 0 HD23 LEU A 111 -12.502 -9.251 3.159 1.00 0.00 H new ATOM 1785 N ARG A 112 -8.614 -10.027 4.067 1.00 0.00 N ATOM 1786 CA ARG A 112 -8.267 -9.084 5.153 1.00 0.00 C ATOM 1787 C ARG A 112 -6.860 -8.499 4.967 1.00 0.00 C ATOM 1788 O ARG A 112 -6.069 -9.062 4.217 1.00 0.00 O ATOM 1789 CB ARG A 112 -8.487 -9.741 6.530 1.00 0.00 C ATOM 1790 CG ARG A 112 -7.539 -10.910 6.853 1.00 0.00 C ATOM 1791 CD ARG A 112 -7.903 -11.518 8.212 1.00 0.00 C ATOM 1792 NE ARG A 112 -7.029 -12.659 8.555 1.00 0.00 N ATOM 1793 CZ ARG A 112 -7.181 -13.482 9.580 1.00 0.00 C ATOM 1794 NH1 ARG A 112 -8.159 -13.353 10.432 1.00 0.00 N ATOM 1795 NH2 ARG A 112 -6.346 -14.462 9.773 1.00 0.00 N ATOM 0 H ARG A 112 -8.408 -11.000 4.291 1.00 0.00 H new ATOM 0 HA ARG A 112 -8.942 -8.230 5.105 1.00 0.00 H new ATOM 0 HB2 ARG A 112 -8.375 -8.979 7.301 1.00 0.00 H new ATOM 0 HB3 ARG A 112 -9.514 -10.101 6.584 1.00 0.00 H new ATOM 0 HG2 ARG A 112 -7.607 -11.670 6.075 1.00 0.00 H new ATOM 0 HG3 ARG A 112 -6.507 -10.559 6.867 1.00 0.00 H new ATOM 0 HD2 ARG A 112 -7.823 -10.754 8.985 1.00 0.00 H new ATOM 0 HD3 ARG A 112 -8.942 -11.848 8.196 1.00 0.00 H new ATOM 0 HE ARG A 112 -6.231 -12.829 7.942 1.00 0.00 H new ATOM 0 HH11 ARG A 112 -8.837 -12.599 10.320 1.00 0.00 H new ATOM 0 HH12 ARG A 112 -8.246 -14.006 11.211 1.00 0.00 H new ATOM 0 HH21 ARG A 112 -5.566 -14.601 9.131 1.00 0.00 H new ATOM 0 HH22 ARG A 112 -6.472 -15.091 10.566 1.00 0.00 H new ATOM 1809 N HIS A 113 -6.529 -7.404 5.659 1.00 0.00 N ATOM 1810 CA HIS A 113 -5.180 -6.809 5.660 1.00 0.00 C ATOM 1811 C HIS A 113 -4.688 -6.382 7.045 1.00 0.00 C ATOM 1812 O HIS A 113 -5.464 -5.981 7.915 1.00 0.00 O ATOM 1813 CB HIS A 113 -5.038 -5.596 4.721 1.00 0.00 C ATOM 1814 CG HIS A 113 -5.463 -5.729 3.282 1.00 0.00 C ATOM 1815 ND1 HIS A 113 -6.544 -5.064 2.697 1.00 0.00 N ATOM 1816 CD2 HIS A 113 -4.670 -6.216 2.284 1.00 0.00 C ATOM 1817 CE1 HIS A 113 -6.372 -5.155 1.370 1.00 0.00 C ATOM 1818 NE2 HIS A 113 -5.266 -5.861 1.094 1.00 0.00 N ATOM 0 H HIS A 113 -7.195 -6.897 6.242 1.00 0.00 H new ATOM 0 HA HIS A 113 -4.560 -7.628 5.296 1.00 0.00 H new ATOM 0 HB2 HIS A 113 -5.607 -4.775 5.157 1.00 0.00 H new ATOM 0 HB3 HIS A 113 -3.990 -5.296 4.728 1.00 0.00 H new ATOM 0 HD2 HIS A 113 -3.752 -6.772 2.404 1.00 0.00 H new ATOM 0 HE1 HIS A 113 -7.029 -4.722 0.631 1.00 0.00 H new ATOM 0 HE2 HIS A 113 -4.924 -6.095 0.162 1.00 0.00 H new ATOM 1826 N CYS A 114 -3.369 -6.468 7.203 1.00 0.00 N ATOM 1827 CA CYS A 114 -2.570 -6.060 8.354 1.00 0.00 C ATOM 1828 C CYS A 114 -1.243 -5.426 7.868 1.00 0.00 C ATOM 1829 O CYS A 114 -0.917 -5.508 6.686 1.00 0.00 O ATOM 1830 CB CYS A 114 -2.331 -7.271 9.282 1.00 0.00 C ATOM 1831 SG CYS A 114 -3.473 -8.683 9.073 1.00 0.00 S ATOM 0 H CYS A 114 -2.783 -6.858 6.465 1.00 0.00 H new ATOM 0 HA CYS A 114 -3.105 -5.306 8.932 1.00 0.00 H new ATOM 0 HB2 CYS A 114 -1.313 -7.627 9.126 1.00 0.00 H new ATOM 0 HB3 CYS A 114 -2.394 -6.929 10.315 1.00 0.00 H new ATOM 0 HG CYS A 114 -3.156 -9.625 9.911 1.00 0.00 H new ATOM 1837 N CYS A 115 -0.425 -4.860 8.760 1.00 0.00 N ATOM 1838 CA CYS A 115 0.803 -4.138 8.367 1.00 0.00 C ATOM 1839 C CYS A 115 2.061 -5.019 8.499 1.00 0.00 C ATOM 1840 O CYS A 115 2.266 -5.669 9.526 1.00 0.00 O ATOM 1841 CB CYS A 115 0.940 -2.853 9.192 1.00 0.00 C ATOM 1842 SG CYS A 115 -0.430 -1.714 8.831 1.00 0.00 S ATOM 0 H CYS A 115 -0.587 -4.885 9.767 1.00 0.00 H new ATOM 0 HA CYS A 115 0.715 -3.875 7.313 1.00 0.00 H new ATOM 0 HB2 CYS A 115 0.948 -3.095 10.255 1.00 0.00 H new ATOM 0 HB3 CYS A 115 1.891 -2.370 8.968 1.00 0.00 H new ATOM 0 HG CYS A 115 -0.295 -0.634 9.542 1.00 0.00 H new ATOM 1848 N THR A 116 2.906 -5.024 7.460 1.00 0.00 N ATOM 1849 CA THR A 116 4.103 -5.880 7.349 1.00 0.00 C ATOM 1850 C THR A 116 5.441 -5.148 7.511 1.00 0.00 C ATOM 1851 O THR A 116 5.500 -3.917 7.550 1.00 0.00 O ATOM 1852 CB THR A 116 4.067 -6.653 6.018 1.00 0.00 C ATOM 1853 OG1 THR A 116 4.787 -7.855 6.164 1.00 0.00 O ATOM 1854 CG2 THR A 116 4.654 -5.910 4.813 1.00 0.00 C ATOM 0 H THR A 116 2.776 -4.418 6.650 1.00 0.00 H new ATOM 0 HA THR A 116 4.056 -6.567 8.194 1.00 0.00 H new ATOM 0 HB THR A 116 3.009 -6.807 5.808 1.00 0.00 H new ATOM 0 HG1 THR A 116 4.767 -8.353 5.320 1.00 0.00 H new ATOM 0 HG21 THR A 116 4.581 -6.540 3.926 1.00 0.00 H new ATOM 0 HG22 THR A 116 4.099 -4.987 4.649 1.00 0.00 H new ATOM 0 HG23 THR A 116 5.701 -5.675 5.005 1.00 0.00 H new ATOM 1862 N ARG A 117 6.522 -5.937 7.561 1.00 0.00 N ATOM 1863 CA ARG A 117 7.931 -5.514 7.598 1.00 0.00 C ATOM 1864 C ARG A 117 8.652 -6.037 6.345 1.00 0.00 C ATOM 1865 O ARG A 117 8.334 -7.123 5.850 1.00 0.00 O ATOM 1866 CB ARG A 117 8.558 -6.000 8.919 1.00 0.00 C ATOM 1867 CG ARG A 117 10.031 -5.592 9.108 1.00 0.00 C ATOM 1868 CD ARG A 117 10.533 -5.986 10.501 1.00 0.00 C ATOM 1869 NE ARG A 117 11.993 -5.806 10.623 1.00 0.00 N ATOM 1870 CZ ARG A 117 12.718 -5.924 11.716 1.00 0.00 C ATOM 1871 NH1 ARG A 117 12.190 -6.152 12.889 1.00 0.00 N ATOM 1872 NH2 ARG A 117 14.010 -5.823 11.645 1.00 0.00 N ATOM 0 H ARG A 117 6.432 -6.953 7.578 1.00 0.00 H new ATOM 0 HA ARG A 117 8.025 -4.428 7.578 1.00 0.00 H new ATOM 0 HB2 ARG A 117 7.974 -5.607 9.751 1.00 0.00 H new ATOM 0 HB3 ARG A 117 8.485 -7.087 8.964 1.00 0.00 H new ATOM 0 HG2 ARG A 117 10.646 -6.071 8.346 1.00 0.00 H new ATOM 0 HG3 ARG A 117 10.135 -4.516 8.971 1.00 0.00 H new ATOM 0 HD2 ARG A 117 10.027 -5.383 11.255 1.00 0.00 H new ATOM 0 HD3 ARG A 117 10.276 -7.026 10.700 1.00 0.00 H new ATOM 0 HE ARG A 117 12.495 -5.564 9.768 1.00 0.00 H new ATOM 0 HH11 ARG A 117 11.179 -6.246 12.984 1.00 0.00 H new ATOM 0 HH12 ARG A 117 12.789 -6.236 13.710 1.00 0.00 H new ATOM 0 HH21 ARG A 117 14.460 -5.653 10.745 1.00 0.00 H new ATOM 0 HH22 ARG A 117 14.576 -5.914 12.489 1.00 0.00 H new ATOM 1886 N VAL A 118 9.608 -5.267 5.826 1.00 0.00 N ATOM 1887 CA VAL A 118 10.448 -5.644 4.666 1.00 0.00 C ATOM 1888 C VAL A 118 11.543 -6.659 5.057 1.00 0.00 C ATOM 1889 O VAL A 118 11.644 -7.069 6.214 1.00 0.00 O ATOM 1890 CB VAL A 118 11.031 -4.391 3.973 1.00 0.00 C ATOM 1891 CG1 VAL A 118 9.921 -3.453 3.483 1.00 0.00 C ATOM 1892 CG2 VAL A 118 11.990 -3.592 4.865 1.00 0.00 C ATOM 0 H VAL A 118 9.832 -4.345 6.200 1.00 0.00 H new ATOM 0 HA VAL A 118 9.808 -6.146 3.941 1.00 0.00 H new ATOM 0 HB VAL A 118 11.599 -4.775 3.126 1.00 0.00 H new ATOM 0 HG11 VAL A 118 10.366 -2.583 3.001 1.00 0.00 H new ATOM 0 HG12 VAL A 118 9.289 -3.980 2.768 1.00 0.00 H new ATOM 0 HG13 VAL A 118 9.318 -3.129 4.331 1.00 0.00 H new ATOM 0 HG21 VAL A 118 12.362 -2.727 4.316 1.00 0.00 H new ATOM 0 HG22 VAL A 118 11.462 -3.256 5.758 1.00 0.00 H new ATOM 0 HG23 VAL A 118 12.829 -4.225 5.156 1.00 0.00 H new ATOM 1902 N ALA A 119 12.404 -7.055 4.112 1.00 0.00 N ATOM 1903 CA ALA A 119 13.512 -8.001 4.321 1.00 0.00 C ATOM 1904 C ALA A 119 14.726 -7.404 5.092 1.00 0.00 C ATOM 1905 O ALA A 119 15.883 -7.737 4.806 1.00 0.00 O ATOM 1906 CB ALA A 119 13.879 -8.614 2.961 1.00 0.00 C ATOM 0 H ALA A 119 12.349 -6.717 3.151 1.00 0.00 H new ATOM 0 HA ALA A 119 13.177 -8.792 4.992 1.00 0.00 H new ATOM 0 HB1 ALA A 119 14.699 -9.320 3.090 1.00 0.00 H new ATOM 0 HB2 ALA A 119 13.013 -9.134 2.551 1.00 0.00 H new ATOM 0 HB3 ALA A 119 14.185 -7.823 2.276 1.00 0.00 H new ATOM 1912 N LEU A 120 14.461 -6.505 6.050 1.00 0.00 N ATOM 1913 CA LEU A 120 15.418 -5.808 6.924 1.00 0.00 C ATOM 1914 C LEU A 120 14.833 -5.614 8.338 1.00 0.00 C ATOM 1915 O LEU A 120 15.517 -5.974 9.323 1.00 0.00 O ATOM 1916 CB LEU A 120 15.819 -4.469 6.260 1.00 0.00 C ATOM 1917 CG LEU A 120 16.839 -3.632 7.053 1.00 0.00 C ATOM 1918 CD1 LEU A 120 18.183 -4.345 7.205 1.00 0.00 C ATOM 1919 CD2 LEU A 120 17.080 -2.311 6.324 1.00 0.00 C ATOM 1920 OXT LEU A 120 13.688 -5.127 8.475 1.00 0.00 O ATOM 0 H LEU A 120 13.501 -6.224 6.250 1.00 0.00 H new ATOM 0 HA LEU A 120 16.317 -6.412 7.048 1.00 0.00 H new ATOM 0 HB2 LEU A 120 16.232 -4.679 5.273 1.00 0.00 H new ATOM 0 HB3 LEU A 120 14.920 -3.872 6.109 1.00 0.00 H new ATOM 0 HG LEU A 120 16.422 -3.470 8.047 1.00 0.00 H new ATOM 0 HD11 LEU A 120 18.868 -3.714 7.771 1.00 0.00 H new ATOM 0 HD12 LEU A 120 18.037 -5.287 7.733 1.00 0.00 H new ATOM 0 HD13 LEU A 120 18.603 -4.543 6.219 1.00 0.00 H new ATOM 0 HD21 LEU A 120 17.802 -1.714 6.882 1.00 0.00 H new ATOM 0 HD22 LEU A 120 17.469 -2.512 5.326 1.00 0.00 H new ATOM 0 HD23 LEU A 120 16.141 -1.763 6.244 1.00 0.00 H new TER 1932 LEU A 120 ATOM 1933 N PRO B1135 7.481 -11.450 -18.513 1.00 0.00 N ATOM 1934 CA PRO B1135 7.977 -10.345 -17.657 1.00 0.00 C ATOM 1935 C PRO B1135 7.244 -10.222 -16.307 1.00 0.00 C ATOM 1936 O PRO B1135 6.176 -10.809 -16.120 1.00 0.00 O ATOM 1937 CB PRO B1135 7.878 -9.073 -18.514 1.00 0.00 C ATOM 1938 CG PRO B1135 7.955 -9.578 -19.964 1.00 0.00 C ATOM 1939 CD PRO B1135 8.041 -11.100 -19.836 1.00 0.00 C ATOM 0 HA PRO B1135 9.006 -10.536 -17.353 1.00 0.00 H new ATOM 0 HB2 PRO B1135 6.945 -8.541 -18.328 1.00 0.00 H new ATOM 0 HB3 PRO B1135 8.690 -8.380 -18.291 1.00 0.00 H new ATOM 0 HG2 PRO B1135 7.078 -9.277 -20.536 1.00 0.00 H new ATOM 0 HG3 PRO B1135 8.826 -9.173 -20.479 1.00 0.00 H new ATOM 0 HD2 PRO B1135 7.481 -11.587 -20.634 1.00 0.00 H new ATOM 0 HD3 PRO B1135 9.074 -11.437 -19.920 1.00 0.00 H new ATOM 1949 N GLN B1136 7.807 -9.451 -15.369 1.00 0.00 N ATOM 1950 CA GLN B1136 7.206 -9.197 -14.049 1.00 0.00 C ATOM 1951 C GLN B1136 6.031 -8.193 -14.114 1.00 0.00 C ATOM 1952 O GLN B1136 6.056 -7.280 -14.946 1.00 0.00 O ATOM 1953 CB GLN B1136 8.280 -8.672 -13.080 1.00 0.00 C ATOM 1954 CG GLN B1136 9.352 -9.706 -12.698 1.00 0.00 C ATOM 1955 CD GLN B1136 8.773 -10.946 -12.014 1.00 0.00 C ATOM 1956 OE1 GLN B1136 8.795 -12.048 -12.546 1.00 0.00 O ATOM 1957 NE2 GLN B1136 8.230 -10.820 -10.823 1.00 0.00 N ATOM 0 H GLN B1136 8.702 -8.980 -15.504 1.00 0.00 H new ATOM 0 HA GLN B1136 6.804 -10.145 -13.691 1.00 0.00 H new ATOM 0 HB2 GLN B1136 8.770 -7.810 -13.532 1.00 0.00 H new ATOM 0 HB3 GLN B1136 7.791 -8.321 -12.171 1.00 0.00 H new ATOM 0 HG2 GLN B1136 9.890 -10.011 -13.596 1.00 0.00 H new ATOM 0 HG3 GLN B1136 10.079 -9.238 -12.034 1.00 0.00 H new ATOM 0 HE21 GLN B1136 8.205 -9.907 -10.368 1.00 0.00 H new ATOM 0 HE22 GLN B1136 7.834 -11.635 -10.354 1.00 0.00 H new ATOM 1966 N PRO B1137 5.023 -8.311 -13.222 1.00 0.00 N ATOM 1967 CA PRO B1137 3.945 -7.330 -13.105 1.00 0.00 C ATOM 1968 C PRO B1137 4.426 -6.036 -12.424 1.00 0.00 C ATOM 1969 O PRO B1137 5.246 -6.073 -11.502 1.00 0.00 O ATOM 1970 CB PRO B1137 2.856 -8.030 -12.285 1.00 0.00 C ATOM 1971 CG PRO B1137 3.657 -8.959 -11.370 1.00 0.00 C ATOM 1972 CD PRO B1137 4.835 -9.381 -12.248 1.00 0.00 C ATOM 0 HA PRO B1137 3.576 -7.018 -14.082 1.00 0.00 H new ATOM 0 HB2 PRO B1137 2.260 -7.318 -11.715 1.00 0.00 H new ATOM 0 HB3 PRO B1137 2.167 -8.586 -12.921 1.00 0.00 H new ATOM 0 HG2 PRO B1137 3.990 -8.446 -10.468 1.00 0.00 H new ATOM 0 HG3 PRO B1137 3.066 -9.817 -11.049 1.00 0.00 H new ATOM 0 HD2 PRO B1137 5.735 -9.524 -11.649 1.00 0.00 H new ATOM 0 HD3 PRO B1137 4.629 -10.328 -12.746 1.00 0.00 H new ATOM 1980 N GLU B1138 3.884 -4.894 -12.857 1.00 0.00 N ATOM 1981 CA GLU B1138 4.136 -3.575 -12.257 1.00 0.00 C ATOM 1982 C GLU B1138 3.064 -3.221 -11.212 1.00 0.00 C ATOM 1983 O GLU B1138 3.179 -3.626 -10.054 1.00 0.00 O ATOM 1984 CB GLU B1138 4.314 -2.501 -13.353 1.00 0.00 C ATOM 1985 CG GLU B1138 5.775 -2.381 -13.769 1.00 0.00 C ATOM 1986 CD GLU B1138 5.952 -1.405 -14.941 1.00 0.00 C ATOM 1987 OE1 GLU B1138 6.115 -0.191 -14.672 1.00 0.00 O ATOM 1988 OE2 GLU B1138 5.979 -1.850 -16.115 1.00 0.00 O ATOM 0 H GLU B1138 3.244 -4.857 -13.651 1.00 0.00 H new ATOM 0 HA GLU B1138 5.078 -3.611 -11.709 1.00 0.00 H new ATOM 0 HB2 GLU B1138 3.705 -2.757 -14.220 1.00 0.00 H new ATOM 0 HB3 GLU B1138 3.957 -1.539 -12.986 1.00 0.00 H new ATOM 0 HG2 GLU B1138 6.369 -2.042 -12.920 1.00 0.00 H new ATOM 0 HG3 GLU B1138 6.155 -3.363 -14.052 1.00 0.00 H new HETATM 1995 N PTR B1139 2.031 -2.478 -11.620 1.00 0.00 N HETATM 1996 CA PTR B1139 0.997 -1.969 -10.731 1.00 0.00 C HETATM 1997 C PTR B1139 -0.292 -2.855 -10.566 1.00 0.00 C HETATM 1998 O PTR B1139 -0.258 -4.081 -10.711 1.00 0.00 O HETATM 1999 CB PTR B1139 0.972 -0.417 -10.817 1.00 0.00 C HETATM 2000 CG PTR B1139 2.216 0.341 -10.270 1.00 0.00 C HETATM 2001 CD1 PTR B1139 2.310 0.721 -8.901 1.00 0.00 C HETATM 2002 CD2 PTR B1139 3.237 0.796 -11.144 1.00 0.00 C HETATM 2003 CE1 PTR B1139 3.371 1.539 -8.426 1.00 0.00 C HETATM 2004 CE2 PTR B1139 4.239 1.680 -10.680 1.00 0.00 C HETATM 2005 CZ PTR B1139 4.341 2.042 -9.326 1.00 0.00 C HETATM 2006 OH PTR B1139 5.369 2.829 -9.082 1.00 0.00 O HETATM 2007 P PTR B1139 6.078 3.136 -7.703 1.00 0.00 P HETATM 2008 O1P PTR B1139 6.246 1.836 -7.051 1.00 0.00 O HETATM 2009 O2P PTR B1139 7.353 3.655 -8.225 1.00 0.00 O HETATM 2010 O3P PTR B1139 5.248 4.102 -6.982 1.00 0.00 O HETATM 0 HE2 PTR B1139 4.953 2.092 -11.393 1.00 0.00 H new HETATM 0 HE1 PTR B1139 3.438 1.780 -7.365 1.00 0.00 H new HETATM 0 HD2 PTR B1139 3.249 0.462 -12.181 1.00 0.00 H new HETATM 0 HD1 PTR B1139 1.550 0.376 -8.200 1.00 0.00 H new HETATM 0 HB3 PTR B1139 0.838 -0.138 -11.862 1.00 0.00 H new HETATM 0 HB2 PTR B1139 0.094 -0.062 -10.277 1.00 0.00 H new HETATM 0 HA PTR B1139 1.232 -2.129 -9.679 1.00 0.00 H new ATOM 2019 N VAL B1140 -1.408 -2.223 -10.190 1.00 0.00 N ATOM 2020 CA VAL B1140 -2.802 -2.701 -10.054 1.00 0.00 C ATOM 2021 C VAL B1140 -3.690 -1.452 -9.941 1.00 0.00 C ATOM 2022 O VAL B1140 -3.552 -0.542 -9.132 1.00 0.00 O ATOM 2023 CB VAL B1140 -3.170 -3.594 -8.834 1.00 0.00 C ATOM 2024 CG1 VAL B1140 -4.104 -4.681 -9.351 1.00 0.00 C ATOM 2025 CG2 VAL B1140 -2.044 -4.367 -8.149 1.00 0.00 C ATOM 0 H VAL B1140 -1.356 -1.236 -9.940 1.00 0.00 H new ATOM 0 HA VAL B1140 -2.947 -3.340 -10.925 1.00 0.00 H new ATOM 0 HB VAL B1140 -3.562 -2.891 -8.099 1.00 0.00 H new ATOM 0 HG11 VAL B1140 -4.391 -5.336 -8.528 1.00 0.00 H new ATOM 0 HG12 VAL B1140 -4.996 -4.222 -9.778 1.00 0.00 H new ATOM 0 HG13 VAL B1140 -3.594 -5.264 -10.118 1.00 0.00 H new ATOM 0 HG21 VAL B1140 -2.451 -4.943 -7.318 1.00 0.00 H new ATOM 0 HG22 VAL B1140 -1.578 -5.043 -8.866 1.00 0.00 H new ATOM 0 HG23 VAL B1140 -1.298 -3.667 -7.774 1.00 0.00 H new ATOM 2035 N ASN B1141 -4.516 -1.461 -10.946 1.00 0.00 N ATOM 2036 CA ASN B1141 -5.546 -0.695 -11.648 1.00 0.00 C ATOM 2037 C ASN B1141 -5.347 -1.522 -12.969 1.00 0.00 C ATOM 2038 O ASN B1141 -6.265 -2.141 -13.504 1.00 0.00 O ATOM 2039 CB ASN B1141 -5.138 0.769 -11.826 1.00 0.00 C ATOM 2040 CG ASN B1141 -5.503 1.825 -10.797 1.00 0.00 C ATOM 2041 OD1 ASN B1141 -6.282 2.732 -11.035 1.00 0.00 O ATOM 2042 ND2 ASN B1141 -4.779 1.873 -9.698 1.00 0.00 N ATOM 0 H ASN B1141 -4.455 -2.325 -11.485 1.00 0.00 H new ATOM 0 HA ASN B1141 -6.543 -0.610 -11.215 1.00 0.00 H new ATOM 0 HB2 ASN B1141 -4.053 0.786 -11.926 1.00 0.00 H new ATOM 0 HB3 ASN B1141 -5.551 1.099 -12.779 1.00 0.00 H new ATOM 0 HD21 ASN B1141 -4.874 2.662 -9.059 1.00 0.00 H new ATOM 0 HD22 ASN B1141 -4.123 1.121 -9.486 1.00 0.00 H new ATOM 2049 N GLN B1142 -4.044 -1.657 -13.332 1.00 0.00 N ATOM 2050 CA GLN B1142 -3.362 -2.441 -14.315 1.00 0.00 C ATOM 2051 C GLN B1142 -2.070 -2.908 -13.651 1.00 0.00 C ATOM 2052 O GLN B1142 -1.561 -2.118 -12.862 1.00 0.00 O ATOM 2053 CB GLN B1142 -2.801 -1.542 -15.420 1.00 0.00 C ATOM 2054 CG GLN B1142 -3.752 -0.883 -16.447 1.00 0.00 C ATOM 2055 CD GLN B1142 -4.732 0.184 -15.933 1.00 0.00 C ATOM 2056 OE1 GLN B1142 -5.889 -0.096 -15.655 1.00 0.00 O ATOM 2057 NE2 GLN B1142 -4.383 1.453 -15.823 1.00 0.00 N ATOM 0 H GLN B1142 -3.354 -1.101 -12.827 1.00 0.00 H new ATOM 0 HA GLN B1142 -4.043 -3.208 -14.685 1.00 0.00 H new ATOM 0 HB2 GLN B1142 -2.246 -0.740 -14.933 1.00 0.00 H new ATOM 0 HB3 GLN B1142 -2.079 -2.134 -15.982 1.00 0.00 H new ATOM 0 HG2 GLN B1142 -3.140 -0.429 -17.227 1.00 0.00 H new ATOM 0 HG3 GLN B1142 -4.335 -1.674 -16.919 1.00 0.00 H new ATOM 0 HE21 GLN B1142 -3.429 1.741 -16.043 1.00 0.00 H new ATOM 0 HE22 GLN B1142 -5.067 2.145 -15.518 1.00 0.00 H new ATOM 2066 N PRO B1143 -1.395 -3.986 -14.079 1.00 0.00 N ATOM 2067 CA PRO B1143 0.057 -4.085 -13.920 1.00 0.00 C ATOM 2068 C PRO B1143 0.769 -3.127 -14.911 1.00 0.00 C ATOM 2069 O PRO B1143 1.583 -3.519 -15.747 1.00 0.00 O ATOM 2070 CB PRO B1143 0.352 -5.574 -14.122 1.00 0.00 C ATOM 2071 CG PRO B1143 -0.679 -5.968 -15.187 1.00 0.00 C ATOM 2072 CD PRO B1143 -1.902 -5.102 -14.862 1.00 0.00 C ATOM 0 HA PRO B1143 0.433 -3.767 -12.948 1.00 0.00 H new ATOM 0 HB2 PRO B1143 1.374 -5.744 -14.462 1.00 0.00 H new ATOM 0 HB3 PRO B1143 0.224 -6.143 -13.201 1.00 0.00 H new ATOM 0 HG2 PRO B1143 -0.308 -5.772 -16.193 1.00 0.00 H new ATOM 0 HG3 PRO B1143 -0.918 -7.030 -15.137 1.00 0.00 H new ATOM 0 HD2 PRO B1143 -2.388 -4.753 -15.773 1.00 0.00 H new ATOM 0 HD3 PRO B1143 -2.645 -5.668 -14.301 1.00 0.00 H new ATOM 2080 N ASP B1144 0.401 -1.856 -14.735 1.00 0.00 N ATOM 2081 CA ASP B1144 0.643 -0.588 -15.421 1.00 0.00 C ATOM 2082 C ASP B1144 0.307 -0.520 -16.934 1.00 0.00 C ATOM 2083 O ASP B1144 0.850 -1.302 -17.749 1.00 0.00 O ATOM 2084 CB ASP B1144 2.025 0.001 -15.099 1.00 0.00 C ATOM 2085 CG ASP B1144 2.229 1.397 -15.734 1.00 0.00 C ATOM 2086 OD1 ASP B1144 1.709 2.399 -15.184 1.00 0.00 O ATOM 2087 OD2 ASP B1144 2.924 1.506 -16.778 1.00 0.00 O ATOM 2088 OXT ASP B1144 -0.519 0.347 -17.301 1.00 0.00 O ATOM 0 H ASP B1144 -0.202 -1.663 -13.935 1.00 0.00 H new ATOM 0 HA ASP B1144 -0.118 0.059 -14.985 1.00 0.00 H new ATOM 0 HB2 ASP B1144 2.143 0.075 -14.018 1.00 0.00 H new ATOM 0 HB3 ASP B1144 2.799 -0.676 -15.459 1.00 0.00 H new TER 2093 ASP B1144