USER MOD reduce.3.24.130724 H: found=0, std=0, add=1706, rem=0, adj=59 USER MOD reduce.3.24.130724 removed 1707 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: B 55 CYS SG : rot -26:sc= 1.34 USER MOD Set 1.2: B 69 THR OG1 : rot 180:sc= 1.1 USER MOD Set 1.3: B 70 GLN : amide:sc= 0 X(o=2.4,f=2.3) USER MOD Set 2.1: B 33 ASN : amide:sc= 0.981 K(o=2.2,f=-2.1) USER MOD Set 2.2: B 34 THR OG1 : rot -65:sc= 1.2 USER MOD Set 3.1: B 25 GLN : amide:sc= -1.96 K(o=-1.5,f=-13!) USER MOD Set 3.2: B 26 SER OG : rot 93:sc= 0.471 USER MOD Set 4.1: B 10 LYS NZ :NH3+ -131:sc= -0.0889 (180deg=-0.809) USER MOD Set 4.2: B 14 SER OG : rot 88:sc= 0.0277 USER MOD Set 5.1: B 5 THR OG1 : rot 140:sc= 1.99 USER MOD Set 5.2: B 7 TYR OH : rot -39:sc= 1.14 USER MOD Set 6.1: B 2 SER OG : rot -60:sc= -4.78! USER MOD Set 6.2: B 31 ASN : amide:sc= -4.24 K(o=-9,f=-15!) USER MOD Set 7.1: A 25 GLN : amide:sc= -5.21! C(o=-5.1!,f=-15!) USER MOD Set 7.2: A 26 SER OG : rot 65:sc= 0.136! USER MOD Set 8.1: A 10 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Set 8.2: A 14 SER OG : rot -140:sc= -0.161 USER MOD Set 9.1: A 5 THR OG1 : rot 140:sc= 1.71 USER MOD Set 9.2: A 7 TYR OH : rot -30:sc= 0.831 USER MOD Single : A 2 SER OG : rot 5:sc= 0.744 USER MOD Single : A 3 GLN : amide:sc= -2.02 X(o=-2,f=-2.4!) USER MOD Single : A 8 LYS NZ :NH3+ -112:sc= -1.18 (180deg=-4.52!) USER MOD Single : A 9 ASN : amide:sc= -17.2! C(o=-17!,f=-23!) USER MOD Single : A 12 LYS NZ :NH3+ -128:sc= 0.286 (180deg=-1.71) USER MOD Single : A 13 SER OG : rot 180:sc= 0 USER MOD Single : A 16 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 17 THR OG1 : rot 180:sc= 0 USER MOD Single : A 18 TYR OH : rot 180:sc= 0 USER MOD Single : A 20 TYR OH : rot 67:sc= -0.962! USER MOD Single : A 31 ASN : amide:sc= -3.05 K(o=-3.1,f=-11!) USER MOD Single : A 33 ASN : amide:sc=-0.00387 X(o=-0.0039,f=-0.17) USER MOD Single : A 34 THR OG1 : rot 180:sc= -0.263 USER MOD Single : A 41 THR OG1 : rot 147:sc= -6.3! USER MOD Single : A 48 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 49 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 52 SER OG : rot 180:sc= 0.0041 USER MOD Single : A 53 HIS :FLIP no HD1:sc= -1.6 F(o=-2.1,f=-1.6) USER MOD Single : A 55 CYS SG : rot 49:sc= -0.216 USER MOD Single : A 57 THR OG1 : rot 167:sc= -3.99! USER MOD Single : A 59 HIS : no HE2:sc= -0.983 K(o=-0.98,f=-2.5!) USER MOD Single : A 67 MET CE :methyl 140:sc= -4.27 (180deg=-11.1!) USER MOD Single : A 69 THR OG1 : rot 140:sc= 0.194 USER MOD Single : A 70 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 71 GLN : amide:sc= -0.197 K(o=-0.2,f=-2.7!) USER MOD Single : A 72 MET CE :methyl 159:sc= -6.86! (180deg=-9.55!) USER MOD Single : A 73 THR OG1 : rot 180:sc= 0 USER MOD Single : A 74 SER OG : rot 180:sc= 0.0755 USER MOD Single : A 78 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 81 SER OG : rot -69:sc= -6.05! USER MOD Single : A 85 ASN : amide:sc= -0.426 X(o=-0.43,f=-0.74) USER MOD Single : A 88 SER OG : rot 180:sc= 0.103 USER MOD Single : A 89 THR OG1 : rot 180:sc= 0 USER MOD Single : A 92 ASN :FLIP amide:sc= -1.71 F(o=-3!,f=-1.7) USER MOD Single : A 103 THR OG1 : rot -76:sc= -4.93! USER MOD Single : B 1 MET CE :methyl -155:sc= -0.096 (180deg=-0.528) USER MOD Single : B 1 MET N :NH3+ 133:sc= 0.456 (180deg=-0.205) USER MOD Single : B 3 GLN :FLIP amide:sc= -0.713 F(o=-2,f=-0.71) USER MOD Single : B 8 LYS NZ :NH3+ -177:sc= -1.74 (180deg=-1.79) USER MOD Single : B 9 ASN : amide:sc= -16.8! C(o=-17!,f=-20!) USER MOD Single : B 12 LYS NZ :NH3+ 172:sc= -0.0505 (180deg=-0.17) USER MOD Single : B 13 SER OG : rot 180:sc= 0 USER MOD Single : B 16 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 17 THR OG1 : rot 180:sc= 0 USER MOD Single : B 18 TYR OH : rot 180:sc= 0 USER MOD Single : B 20 TYR OH : rot 5:sc= -4.08! USER MOD Single : B 41 THR OG1 : rot 180:sc= -3.49! USER MOD Single : B 48 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 49 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 52 SER OG : rot 142:sc= -0.689 USER MOD Single : B 53 HIS : no HD1:sc= 0 X(o=0,f=-0.037) USER MOD Single : B 57 THR OG1 : rot 118:sc= -11.2! USER MOD Single : B 59 HIS : no HE2:sc= -1.05 K(o=-1.1,f=-7.5!) USER MOD Single : B 67 MET CE :methyl 169:sc= -5.74 (180deg=-6.09!) USER MOD Single : B 71 GLN : amide:sc= -0.53 X(o=-0.53,f=-0.039) USER MOD Single : B 72 MET CE :methyl -137:sc= -9.97! (180deg=-17.7!) USER MOD Single : B 73 THR OG1 : rot 180:sc= 0 USER MOD Single : B 74 SER OG : rot -19:sc= -0.842! USER MOD Single : B 78 LYS NZ :NH3+ 176:sc= -0.327 (180deg=-0.364) USER MOD Single : B 81 SER OG : rot -139:sc= -3.27! USER MOD Single : B 85 ASN : amide:sc= -3.08 K(o=-3.1,f=-3.8) USER MOD Single : B 88 SER OG : rot 180:sc= 0.0972 USER MOD Single : B 89 THR OG1 : rot 180:sc= 0 USER MOD Single : B 92 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 103 THR OG1 : rot 58:sc= 1.22 USER MOD ----------------------------------------------------------------- ATOM 20 N SER A 2 3.732 8.772 15.165 1.00 0.00 N ATOM 21 CA SER A 2 3.134 7.869 14.189 1.00 0.00 C ATOM 22 C SER A 2 2.023 8.571 13.407 1.00 0.00 C ATOM 23 O SER A 2 0.988 8.926 13.971 1.00 0.00 O ATOM 24 CB SER A 2 2.577 6.618 14.889 1.00 0.00 C ATOM 25 OG SER A 2 3.078 6.509 16.210 1.00 0.00 O ATOM 0 HA SER A 2 3.911 7.566 13.487 1.00 0.00 H new ATOM 0 HB2 SER A 2 1.488 6.664 14.912 1.00 0.00 H new ATOM 0 HB3 SER A 2 2.846 5.728 14.320 1.00 0.00 H new ATOM 0 HG SER A 2 3.610 7.303 16.425 1.00 0.00 H new ATOM 31 N GLN A 3 2.248 8.750 12.101 1.00 0.00 N ATOM 32 CA GLN A 3 1.273 9.387 11.202 1.00 0.00 C ATOM 33 C GLN A 3 1.405 10.910 11.151 1.00 0.00 C ATOM 34 O GLN A 3 1.725 11.563 12.144 1.00 0.00 O ATOM 35 CB GLN A 3 -0.166 9.023 11.593 1.00 0.00 C ATOM 36 CG GLN A 3 -1.025 8.589 10.417 1.00 0.00 C ATOM 37 CD GLN A 3 -2.474 8.365 10.805 1.00 0.00 C ATOM 38 OE1 GLN A 3 -2.778 8.039 11.952 1.00 0.00 O ATOM 39 NE2 GLN A 3 -3.377 8.540 9.847 1.00 0.00 N ATOM 0 H GLN A 3 3.108 8.459 11.636 1.00 0.00 H new ATOM 0 HA GLN A 3 1.498 8.998 10.209 1.00 0.00 H new ATOM 0 HB2 GLN A 3 -0.141 8.220 12.330 1.00 0.00 H new ATOM 0 HB3 GLN A 3 -0.631 9.883 12.074 1.00 0.00 H new ATOM 0 HG2 GLN A 3 -0.975 9.347 9.636 1.00 0.00 H new ATOM 0 HG3 GLN A 3 -0.619 7.669 9.995 1.00 0.00 H new ATOM 0 HE21 GLN A 3 -3.080 8.811 8.909 1.00 0.00 H new ATOM 0 HE22 GLN A 3 -4.368 8.404 10.049 1.00 0.00 H new ATOM 48 N PHE A 4 1.102 11.454 9.972 1.00 0.00 N ATOM 49 CA PHE A 4 1.116 12.895 9.724 1.00 0.00 C ATOM 50 C PHE A 4 2.512 13.516 9.755 1.00 0.00 C ATOM 51 O PHE A 4 2.675 14.667 10.160 1.00 0.00 O ATOM 52 CB PHE A 4 0.183 13.608 10.704 1.00 0.00 C ATOM 53 CG PHE A 4 -1.266 13.252 10.501 1.00 0.00 C ATOM 54 CD1 PHE A 4 -1.765 13.016 9.227 1.00 0.00 C ATOM 55 CD2 PHE A 4 -2.126 13.141 11.582 1.00 0.00 C ATOM 56 CE1 PHE A 4 -3.090 12.679 9.035 1.00 0.00 C ATOM 57 CE2 PHE A 4 -3.455 12.806 11.396 1.00 0.00 C ATOM 58 CZ PHE A 4 -3.937 12.574 10.122 1.00 0.00 C ATOM 0 H PHE A 4 0.838 10.902 9.156 1.00 0.00 H new ATOM 0 HA PHE A 4 0.755 13.034 8.705 1.00 0.00 H new ATOM 0 HB2 PHE A 4 0.474 13.355 11.724 1.00 0.00 H new ATOM 0 HB3 PHE A 4 0.305 14.686 10.595 1.00 0.00 H new ATOM 0 HD1 PHE A 4 -1.107 13.097 8.374 1.00 0.00 H new ATOM 0 HD2 PHE A 4 -1.754 13.318 12.581 1.00 0.00 H new ATOM 0 HE1 PHE A 4 -3.464 12.498 8.038 1.00 0.00 H new ATOM 0 HE2 PHE A 4 -4.116 12.726 12.246 1.00 0.00 H new ATOM 0 HZ PHE A 4 -4.974 12.311 9.976 1.00 0.00 H new ATOM 68 N THR A 5 3.506 12.776 9.280 1.00 0.00 N ATOM 69 CA THR A 5 4.865 13.283 9.206 1.00 0.00 C ATOM 70 C THR A 5 5.322 13.261 7.757 1.00 0.00 C ATOM 71 O THR A 5 4.828 12.466 6.958 1.00 0.00 O ATOM 72 CB THR A 5 5.817 12.433 10.043 1.00 0.00 C ATOM 73 OG1 THR A 5 5.143 11.843 11.139 1.00 0.00 O ATOM 74 CG2 THR A 5 7.001 13.205 10.587 1.00 0.00 C ATOM 0 H THR A 5 3.393 11.821 8.940 1.00 0.00 H new ATOM 0 HA THR A 5 4.877 14.300 9.597 1.00 0.00 H new ATOM 0 HB THR A 5 6.190 11.672 9.358 1.00 0.00 H new ATOM 0 HG1 THR A 5 5.459 10.923 11.261 1.00 0.00 H new ATOM 0 HG21 THR A 5 7.634 12.537 11.171 1.00 0.00 H new ATOM 0 HG22 THR A 5 7.577 13.619 9.759 1.00 0.00 H new ATOM 0 HG23 THR A 5 6.646 14.016 11.223 1.00 0.00 H new ATOM 82 N LEU A 6 6.278 14.108 7.424 1.00 0.00 N ATOM 83 CA LEU A 6 6.804 14.141 6.072 1.00 0.00 C ATOM 84 C LEU A 6 7.987 13.207 5.988 1.00 0.00 C ATOM 85 O LEU A 6 9.139 13.643 6.004 1.00 0.00 O ATOM 86 CB LEU A 6 7.228 15.554 5.678 1.00 0.00 C ATOM 87 CG LEU A 6 7.167 15.845 4.179 1.00 0.00 C ATOM 88 CD1 LEU A 6 7.560 17.285 3.902 1.00 0.00 C ATOM 89 CD2 LEU A 6 8.068 14.888 3.412 1.00 0.00 C ATOM 0 H LEU A 6 6.703 14.777 8.065 1.00 0.00 H new ATOM 0 HA LEU A 6 6.023 13.824 5.381 1.00 0.00 H new ATOM 0 HB2 LEU A 6 6.591 16.268 6.199 1.00 0.00 H new ATOM 0 HB3 LEU A 6 8.247 15.723 6.026 1.00 0.00 H new ATOM 0 HG LEU A 6 6.142 15.696 3.840 1.00 0.00 H new ATOM 0 HD11 LEU A 6 7.511 17.476 2.830 1.00 0.00 H new ATOM 0 HD12 LEU A 6 6.875 17.955 4.421 1.00 0.00 H new ATOM 0 HD13 LEU A 6 8.576 17.459 4.256 1.00 0.00 H new ATOM 0 HD21 LEU A 6 8.012 15.110 2.346 1.00 0.00 H new ATOM 0 HD22 LEU A 6 9.097 15.005 3.753 1.00 0.00 H new ATOM 0 HD23 LEU A 6 7.742 13.863 3.586 1.00 0.00 H new ATOM 101 N TYR A 7 7.706 11.914 5.931 1.00 0.00 N ATOM 102 CA TYR A 7 8.777 10.942 5.881 1.00 0.00 C ATOM 103 C TYR A 7 9.349 10.820 4.485 1.00 0.00 C ATOM 104 O TYR A 7 8.709 10.303 3.571 1.00 0.00 O ATOM 105 CB TYR A 7 8.320 9.560 6.393 1.00 0.00 C ATOM 106 CG TYR A 7 7.352 9.565 7.561 1.00 0.00 C ATOM 107 CD1 TYR A 7 6.053 10.059 7.442 1.00 0.00 C ATOM 108 CD2 TYR A 7 7.732 9.017 8.781 1.00 0.00 C ATOM 109 CE1 TYR A 7 5.174 10.003 8.506 1.00 0.00 C ATOM 110 CE2 TYR A 7 6.858 8.968 9.849 1.00 0.00 C ATOM 111 CZ TYR A 7 5.581 9.459 9.706 1.00 0.00 C ATOM 112 OH TYR A 7 4.704 9.404 10.765 1.00 0.00 O ATOM 0 H TYR A 7 6.764 11.523 5.919 1.00 0.00 H new ATOM 0 HA TYR A 7 9.562 11.305 6.544 1.00 0.00 H new ATOM 0 HB2 TYR A 7 7.855 9.024 5.565 1.00 0.00 H new ATOM 0 HB3 TYR A 7 9.204 8.993 6.683 1.00 0.00 H new ATOM 0 HD1 TYR A 7 5.730 10.491 6.506 1.00 0.00 H new ATOM 0 HD2 TYR A 7 8.731 8.622 8.896 1.00 0.00 H new ATOM 0 HE1 TYR A 7 4.169 10.385 8.398 1.00 0.00 H new ATOM 0 HE2 TYR A 7 7.175 8.547 10.791 1.00 0.00 H new ATOM 0 HH TYR A 7 4.075 10.153 10.708 1.00 0.00 H new ATOM 122 N LYS A 8 10.589 11.276 4.352 1.00 0.00 N ATOM 123 CA LYS A 8 11.303 11.205 3.095 1.00 0.00 C ATOM 124 C LYS A 8 11.497 9.747 2.702 1.00 0.00 C ATOM 125 O LYS A 8 10.530 9.046 2.423 1.00 0.00 O ATOM 126 CB LYS A 8 12.641 11.938 3.211 1.00 0.00 C ATOM 127 CG LYS A 8 13.341 12.129 1.880 1.00 0.00 C ATOM 128 CD LYS A 8 13.706 13.583 1.633 1.00 0.00 C ATOM 129 CE LYS A 8 15.096 13.907 2.156 1.00 0.00 C ATOM 130 NZ LYS A 8 15.476 15.324 1.896 1.00 0.00 N ATOM 0 H LYS A 8 11.120 11.702 5.111 1.00 0.00 H new ATOM 0 HA LYS A 8 10.723 11.695 2.313 1.00 0.00 H new ATOM 0 HB2 LYS A 8 12.474 12.913 3.668 1.00 0.00 H new ATOM 0 HB3 LYS A 8 13.296 11.380 3.880 1.00 0.00 H new ATOM 0 HG2 LYS A 8 14.244 11.519 1.854 1.00 0.00 H new ATOM 0 HG3 LYS A 8 12.695 11.776 1.076 1.00 0.00 H new ATOM 0 HD2 LYS A 8 13.660 13.794 0.565 1.00 0.00 H new ATOM 0 HD3 LYS A 8 12.974 14.230 2.117 1.00 0.00 H new ATOM 0 HE2 LYS A 8 15.134 13.713 3.228 1.00 0.00 H new ATOM 0 HE3 LYS A 8 15.823 13.245 1.686 1.00 0.00 H new ATOM 0 HZ1 LYS A 8 16.246 15.354 1.198 1.00 0.00 H new ATOM 0 HZ2 LYS A 8 14.653 15.842 1.526 1.00 0.00 H new ATOM 0 HZ3 LYS A 8 15.794 15.766 2.782 1.00 0.00 H new ATOM 144 N ASN A 9 12.731 9.289 2.675 1.00 0.00 N ATOM 145 CA ASN A 9 13.011 7.914 2.320 1.00 0.00 C ATOM 146 C ASN A 9 14.168 7.397 3.164 1.00 0.00 C ATOM 147 O ASN A 9 15.260 7.961 3.119 1.00 0.00 O ATOM 148 CB ASN A 9 13.334 7.796 0.823 1.00 0.00 C ATOM 149 CG ASN A 9 14.548 8.607 0.420 1.00 0.00 C ATOM 150 OD1 ASN A 9 15.632 8.069 0.239 1.00 0.00 O ATOM 151 ND2 ASN A 9 14.365 9.906 0.261 1.00 0.00 N ATOM 0 H ASN A 9 13.555 9.848 2.894 1.00 0.00 H new ATOM 0 HA ASN A 9 12.128 7.307 2.519 1.00 0.00 H new ATOM 0 HB2 ASN A 9 13.503 6.748 0.574 1.00 0.00 H new ATOM 0 HB3 ASN A 9 12.473 8.127 0.243 1.00 0.00 H new ATOM 0 HD21 ASN A 9 15.144 10.500 -0.023 1.00 0.00 H new ATOM 0 HD22 ASN A 9 13.445 10.315 0.422 1.00 0.00 H new ATOM 158 N LYS A 10 13.917 6.325 3.941 1.00 0.00 N ATOM 159 CA LYS A 10 14.932 5.712 4.819 1.00 0.00 C ATOM 160 C LYS A 10 16.284 6.368 4.622 1.00 0.00 C ATOM 161 O LYS A 10 16.764 7.137 5.453 1.00 0.00 O ATOM 162 CB LYS A 10 15.059 4.227 4.523 1.00 0.00 C ATOM 163 CG LYS A 10 14.208 3.805 3.362 1.00 0.00 C ATOM 164 CD LYS A 10 14.653 4.501 2.092 1.00 0.00 C ATOM 165 CE LYS A 10 13.658 4.291 0.966 1.00 0.00 C ATOM 166 NZ LYS A 10 13.621 2.873 0.514 1.00 0.00 N ATOM 0 H LYS A 10 13.009 5.862 3.977 1.00 0.00 H new ATOM 0 HA LYS A 10 14.610 5.857 5.850 1.00 0.00 H new ATOM 0 HB2 LYS A 10 16.102 3.988 4.313 1.00 0.00 H new ATOM 0 HB3 LYS A 10 14.773 3.657 5.407 1.00 0.00 H new ATOM 0 HG2 LYS A 10 14.271 2.725 3.232 1.00 0.00 H new ATOM 0 HG3 LYS A 10 13.163 4.041 3.565 1.00 0.00 H new ATOM 0 HD2 LYS A 10 14.769 5.568 2.282 1.00 0.00 H new ATOM 0 HD3 LYS A 10 15.630 4.122 1.791 1.00 0.00 H new ATOM 0 HE2 LYS A 10 12.665 4.592 1.299 1.00 0.00 H new ATOM 0 HE3 LYS A 10 13.921 4.933 0.125 1.00 0.00 H new ATOM 0 HZ1 LYS A 10 12.929 2.772 -0.256 1.00 0.00 H new ATOM 0 HZ2 LYS A 10 14.562 2.593 0.172 1.00 0.00 H new ATOM 0 HZ3 LYS A 10 13.345 2.262 1.309 1.00 0.00 H new ATOM 180 N ASP A 11 16.857 6.069 3.472 1.00 0.00 N ATOM 181 CA ASP A 11 18.112 6.617 3.057 1.00 0.00 C ATOM 182 C ASP A 11 17.819 7.618 1.946 1.00 0.00 C ATOM 183 O ASP A 11 17.377 7.229 0.869 1.00 0.00 O ATOM 184 CB ASP A 11 19.021 5.487 2.581 1.00 0.00 C ATOM 185 CG ASP A 11 20.453 5.655 3.051 1.00 0.00 C ATOM 186 OD1 ASP A 11 20.653 5.980 4.240 1.00 0.00 O ATOM 187 OD2 ASP A 11 21.374 5.461 2.229 1.00 0.00 O ATOM 0 H ASP A 11 16.447 5.425 2.795 1.00 0.00 H new ATOM 0 HA ASP A 11 18.627 7.124 3.873 1.00 0.00 H new ATOM 0 HB2 ASP A 11 18.632 4.535 2.944 1.00 0.00 H new ATOM 0 HB3 ASP A 11 19.002 5.445 1.492 1.00 0.00 H new ATOM 192 N LYS A 12 18.007 8.908 2.233 1.00 0.00 N ATOM 193 CA LYS A 12 17.689 9.980 1.277 1.00 0.00 C ATOM 194 C LYS A 12 18.180 9.695 -0.150 1.00 0.00 C ATOM 195 O LYS A 12 17.770 10.380 -1.088 1.00 0.00 O ATOM 196 CB LYS A 12 18.243 11.321 1.780 1.00 0.00 C ATOM 197 CG LYS A 12 17.524 11.861 3.021 1.00 0.00 C ATOM 198 CD LYS A 12 18.378 11.707 4.270 1.00 0.00 C ATOM 199 CE LYS A 12 18.299 12.942 5.153 1.00 0.00 C ATOM 200 NZ LYS A 12 16.892 13.366 5.394 1.00 0.00 N ATOM 0 H LYS A 12 18.379 9.240 3.123 1.00 0.00 H new ATOM 0 HA LYS A 12 16.602 10.030 1.219 1.00 0.00 H new ATOM 0 HB2 LYS A 12 19.302 11.203 2.008 1.00 0.00 H new ATOM 0 HB3 LYS A 12 18.169 12.057 0.980 1.00 0.00 H new ATOM 0 HG2 LYS A 12 17.280 12.913 2.873 1.00 0.00 H new ATOM 0 HG3 LYS A 12 16.581 11.331 3.156 1.00 0.00 H new ATOM 0 HD2 LYS A 12 18.048 10.834 4.833 1.00 0.00 H new ATOM 0 HD3 LYS A 12 19.415 11.528 3.984 1.00 0.00 H new ATOM 0 HE2 LYS A 12 18.784 12.737 6.107 1.00 0.00 H new ATOM 0 HE3 LYS A 12 18.849 13.758 4.685 1.00 0.00 H new ATOM 0 HZ1 LYS A 12 16.789 14.374 5.162 1.00 0.00 H new ATOM 0 HZ2 LYS A 12 16.253 12.805 4.795 1.00 0.00 H new ATOM 0 HZ3 LYS A 12 16.650 13.215 6.394 1.00 0.00 H new ATOM 214 N SER A 13 19.020 8.679 -0.333 1.00 0.00 N ATOM 215 CA SER A 13 19.496 8.328 -1.668 1.00 0.00 C ATOM 216 C SER A 13 18.318 7.921 -2.561 1.00 0.00 C ATOM 217 O SER A 13 18.307 8.201 -3.760 1.00 0.00 O ATOM 218 CB SER A 13 20.513 7.187 -1.589 1.00 0.00 C ATOM 219 OG SER A 13 21.682 7.592 -0.897 1.00 0.00 O ATOM 0 H SER A 13 19.382 8.090 0.417 1.00 0.00 H new ATOM 0 HA SER A 13 19.983 9.201 -2.102 1.00 0.00 H new ATOM 0 HB2 SER A 13 20.066 6.331 -1.083 1.00 0.00 H new ATOM 0 HB3 SER A 13 20.777 6.861 -2.595 1.00 0.00 H new ATOM 0 HG SER A 13 22.315 6.845 -0.859 1.00 0.00 H new ATOM 225 N SER A 14 17.324 7.268 -1.955 1.00 0.00 N ATOM 226 CA SER A 14 16.120 6.823 -2.668 1.00 0.00 C ATOM 227 C SER A 14 15.450 7.967 -3.380 1.00 0.00 C ATOM 228 O SER A 14 14.833 7.788 -4.427 1.00 0.00 O ATOM 229 CB SER A 14 15.111 6.240 -1.679 1.00 0.00 C ATOM 230 OG SER A 14 14.465 5.099 -2.216 1.00 0.00 O ATOM 0 H SER A 14 17.328 7.033 -0.962 1.00 0.00 H new ATOM 0 HA SER A 14 16.434 6.073 -3.394 1.00 0.00 H new ATOM 0 HB2 SER A 14 15.620 5.971 -0.753 1.00 0.00 H new ATOM 0 HB3 SER A 14 14.368 6.996 -1.426 1.00 0.00 H new ATOM 0 HG SER A 14 13.516 5.114 -1.971 1.00 0.00 H new ATOM 236 N ALA A 15 15.530 9.133 -2.779 1.00 0.00 N ATOM 237 CA ALA A 15 14.881 10.298 -3.325 1.00 0.00 C ATOM 238 C ALA A 15 15.204 10.512 -4.797 1.00 0.00 C ATOM 239 O ALA A 15 14.424 11.141 -5.513 1.00 0.00 O ATOM 240 CB ALA A 15 15.235 11.530 -2.507 1.00 0.00 C ATOM 0 H ALA A 15 16.039 9.297 -1.911 1.00 0.00 H new ATOM 0 HA ALA A 15 13.806 10.127 -3.265 1.00 0.00 H new ATOM 0 HB1 ALA A 15 14.738 12.403 -2.930 1.00 0.00 H new ATOM 0 HB2 ALA A 15 14.907 11.390 -1.477 1.00 0.00 H new ATOM 0 HB3 ALA A 15 16.314 11.682 -2.526 1.00 0.00 H new ATOM 246 N LYS A 16 16.329 9.974 -5.266 1.00 0.00 N ATOM 247 CA LYS A 16 16.678 10.115 -6.674 1.00 0.00 C ATOM 248 C LYS A 16 15.472 9.711 -7.509 1.00 0.00 C ATOM 249 O LYS A 16 15.063 10.417 -8.431 1.00 0.00 O ATOM 250 CB LYS A 16 17.886 9.241 -7.024 1.00 0.00 C ATOM 251 CG LYS A 16 19.173 10.028 -7.208 1.00 0.00 C ATOM 252 CD LYS A 16 20.381 9.109 -7.286 1.00 0.00 C ATOM 253 CE LYS A 16 21.583 9.707 -6.572 1.00 0.00 C ATOM 254 NZ LYS A 16 22.728 8.757 -6.521 1.00 0.00 N ATOM 0 H LYS A 16 16.999 9.448 -4.705 1.00 0.00 H new ATOM 0 HA LYS A 16 16.948 11.150 -6.883 1.00 0.00 H new ATOM 0 HB2 LYS A 16 18.031 8.503 -6.235 1.00 0.00 H new ATOM 0 HB3 LYS A 16 17.672 8.690 -7.940 1.00 0.00 H new ATOM 0 HG2 LYS A 16 19.109 10.625 -8.118 1.00 0.00 H new ATOM 0 HG3 LYS A 16 19.297 10.724 -6.378 1.00 0.00 H new ATOM 0 HD2 LYS A 16 20.135 8.145 -6.841 1.00 0.00 H new ATOM 0 HD3 LYS A 16 20.632 8.924 -8.330 1.00 0.00 H new ATOM 0 HE2 LYS A 16 21.891 10.620 -7.082 1.00 0.00 H new ATOM 0 HE3 LYS A 16 21.300 9.989 -5.558 1.00 0.00 H new ATOM 0 HZ1 LYS A 16 23.527 9.203 -6.026 1.00 0.00 H new ATOM 0 HZ2 LYS A 16 22.442 7.896 -6.012 1.00 0.00 H new ATOM 0 HZ3 LYS A 16 23.016 8.508 -7.489 1.00 0.00 H new ATOM 268 N THR A 17 14.880 8.584 -7.127 1.00 0.00 N ATOM 269 CA THR A 17 13.681 8.081 -7.775 1.00 0.00 C ATOM 270 C THR A 17 12.467 8.323 -6.884 1.00 0.00 C ATOM 271 O THR A 17 11.415 8.762 -7.349 1.00 0.00 O ATOM 272 CB THR A 17 13.811 6.589 -8.084 1.00 0.00 C ATOM 273 OG1 THR A 17 14.935 6.337 -8.912 1.00 0.00 O ATOM 274 CG2 THR A 17 12.589 6.023 -8.777 1.00 0.00 C ATOM 0 H THR A 17 15.218 7.999 -6.363 1.00 0.00 H new ATOM 0 HA THR A 17 13.551 8.616 -8.716 1.00 0.00 H new ATOM 0 HB THR A 17 13.926 6.100 -7.117 1.00 0.00 H new ATOM 0 HG1 THR A 17 14.998 5.376 -9.094 1.00 0.00 H new ATOM 0 HG21 THR A 17 12.740 4.961 -8.971 1.00 0.00 H new ATOM 0 HG22 THR A 17 11.715 6.155 -8.139 1.00 0.00 H new ATOM 0 HG23 THR A 17 12.431 6.545 -9.721 1.00 0.00 H new ATOM 282 N TYR A 18 12.622 8.012 -5.594 1.00 0.00 N ATOM 283 CA TYR A 18 11.537 8.172 -4.625 1.00 0.00 C ATOM 284 C TYR A 18 12.031 8.790 -3.333 1.00 0.00 C ATOM 285 O TYR A 18 12.783 8.153 -2.595 1.00 0.00 O ATOM 286 CB TYR A 18 10.971 6.822 -4.269 1.00 0.00 C ATOM 287 CG TYR A 18 10.710 5.921 -5.455 1.00 0.00 C ATOM 288 CD1 TYR A 18 9.791 6.277 -6.433 1.00 0.00 C ATOM 289 CD2 TYR A 18 11.382 4.714 -5.594 1.00 0.00 C ATOM 290 CE1 TYR A 18 9.549 5.455 -7.518 1.00 0.00 C ATOM 291 CE2 TYR A 18 11.146 3.886 -6.675 1.00 0.00 C ATOM 292 CZ TYR A 18 10.229 4.262 -7.634 1.00 0.00 C ATOM 293 OH TYR A 18 9.991 3.440 -8.712 1.00 0.00 O ATOM 0 H TYR A 18 13.489 7.648 -5.198 1.00 0.00 H new ATOM 0 HA TYR A 18 10.790 8.818 -5.086 1.00 0.00 H new ATOM 0 HB2 TYR A 18 11.661 6.319 -3.592 1.00 0.00 H new ATOM 0 HB3 TYR A 18 10.038 6.965 -3.725 1.00 0.00 H new ATOM 0 HD1 TYR A 18 9.256 7.211 -6.345 1.00 0.00 H new ATOM 0 HD2 TYR A 18 12.101 4.417 -4.845 1.00 0.00 H new ATOM 0 HE1 TYR A 18 8.831 5.746 -8.270 1.00 0.00 H new ATOM 0 HE2 TYR A 18 11.677 2.950 -6.768 1.00 0.00 H new ATOM 0 HH TYR A 18 10.552 2.640 -8.643 1.00 0.00 H new ATOM 303 N PRO A 19 11.661 10.038 -3.031 1.00 0.00 N ATOM 304 CA PRO A 19 12.124 10.694 -1.831 1.00 0.00 C ATOM 305 C PRO A 19 11.264 10.474 -0.590 1.00 0.00 C ATOM 306 O PRO A 19 11.814 10.213 0.467 1.00 0.00 O ATOM 307 CB PRO A 19 12.127 12.178 -2.206 1.00 0.00 C ATOM 308 CG PRO A 19 11.487 12.267 -3.555 1.00 0.00 C ATOM 309 CD PRO A 19 10.832 10.935 -3.826 1.00 0.00 C ATOM 0 HA PRO A 19 13.093 10.287 -1.542 1.00 0.00 H new ATOM 0 HB2 PRO A 19 11.575 12.766 -1.473 1.00 0.00 H new ATOM 0 HB3 PRO A 19 13.143 12.572 -2.230 1.00 0.00 H new ATOM 0 HG2 PRO A 19 10.750 13.070 -3.579 1.00 0.00 H new ATOM 0 HG3 PRO A 19 12.230 12.493 -4.320 1.00 0.00 H new ATOM 0 HD2 PRO A 19 9.789 10.919 -3.509 1.00 0.00 H new ATOM 0 HD3 PRO A 19 10.848 10.678 -4.885 1.00 0.00 H new ATOM 317 N TYR A 20 9.937 10.629 -0.672 1.00 0.00 N ATOM 318 CA TYR A 20 9.126 10.490 0.545 1.00 0.00 C ATOM 319 C TYR A 20 7.890 9.639 0.419 1.00 0.00 C ATOM 320 O TYR A 20 7.512 9.164 -0.648 1.00 0.00 O ATOM 321 CB TYR A 20 8.674 11.863 1.062 1.00 0.00 C ATOM 322 CG TYR A 20 9.402 12.995 0.426 1.00 0.00 C ATOM 323 CD1 TYR A 20 9.232 13.253 -0.923 1.00 0.00 C ATOM 324 CD2 TYR A 20 10.276 13.777 1.158 1.00 0.00 C ATOM 325 CE1 TYR A 20 9.907 14.265 -1.549 1.00 0.00 C ATOM 326 CE2 TYR A 20 10.974 14.802 0.543 1.00 0.00 C ATOM 327 CZ TYR A 20 10.788 15.043 -0.812 1.00 0.00 C ATOM 328 OH TYR A 20 11.492 16.050 -1.427 1.00 0.00 O ATOM 0 H TYR A 20 9.420 10.841 -1.525 1.00 0.00 H new ATOM 0 HA TYR A 20 9.801 9.982 1.234 1.00 0.00 H new ATOM 0 HB2 TYR A 20 7.605 11.979 0.881 1.00 0.00 H new ATOM 0 HB3 TYR A 20 8.821 11.905 2.141 1.00 0.00 H new ATOM 0 HD1 TYR A 20 8.550 12.641 -1.495 1.00 0.00 H new ATOM 0 HD2 TYR A 20 10.415 13.588 2.212 1.00 0.00 H new ATOM 0 HE1 TYR A 20 9.756 14.455 -2.601 1.00 0.00 H new ATOM 0 HE2 TYR A 20 11.659 15.411 1.114 1.00 0.00 H new ATOM 0 HH TYR A 20 10.872 16.751 -1.720 1.00 0.00 H new ATOM 338 N PHE A 21 7.261 9.533 1.581 1.00 0.00 N ATOM 339 CA PHE A 21 6.017 8.837 1.793 1.00 0.00 C ATOM 340 C PHE A 21 5.345 9.504 2.976 1.00 0.00 C ATOM 341 O PHE A 21 5.969 10.310 3.668 1.00 0.00 O ATOM 342 CB PHE A 21 6.208 7.352 2.091 1.00 0.00 C ATOM 343 CG PHE A 21 7.552 6.782 1.699 1.00 0.00 C ATOM 344 CD1 PHE A 21 7.913 6.689 0.367 1.00 0.00 C ATOM 345 CD2 PHE A 21 8.448 6.327 2.661 1.00 0.00 C ATOM 346 CE1 PHE A 21 9.135 6.162 -0.005 1.00 0.00 C ATOM 347 CE2 PHE A 21 9.670 5.796 2.292 1.00 0.00 C ATOM 348 CZ PHE A 21 10.014 5.714 0.959 1.00 0.00 C ATOM 0 H PHE A 21 7.628 9.952 2.436 1.00 0.00 H new ATOM 0 HA PHE A 21 5.419 8.891 0.883 1.00 0.00 H new ATOM 0 HB2 PHE A 21 6.061 7.191 3.159 1.00 0.00 H new ATOM 0 HB3 PHE A 21 5.429 6.791 1.574 1.00 0.00 H new ATOM 0 HD1 PHE A 21 7.229 7.034 -0.394 1.00 0.00 H new ATOM 0 HD2 PHE A 21 8.186 6.389 3.707 1.00 0.00 H new ATOM 0 HE1 PHE A 21 9.402 6.101 -1.050 1.00 0.00 H new ATOM 0 HE2 PHE A 21 10.356 5.445 3.049 1.00 0.00 H new ATOM 0 HZ PHE A 21 10.969 5.300 0.671 1.00 0.00 H new ATOM 358 N VAL A 22 4.091 9.198 3.211 1.00 0.00 N ATOM 359 CA VAL A 22 3.389 9.814 4.314 1.00 0.00 C ATOM 360 C VAL A 22 2.689 8.793 5.193 1.00 0.00 C ATOM 361 O VAL A 22 1.784 8.091 4.752 1.00 0.00 O ATOM 362 CB VAL A 22 2.366 10.819 3.797 1.00 0.00 C ATOM 363 CG1 VAL A 22 1.601 11.442 4.954 1.00 0.00 C ATOM 364 CG2 VAL A 22 3.045 11.890 2.955 1.00 0.00 C ATOM 0 H VAL A 22 3.541 8.536 2.663 1.00 0.00 H new ATOM 0 HA VAL A 22 4.138 10.323 4.920 1.00 0.00 H new ATOM 0 HB VAL A 22 1.653 10.292 3.162 1.00 0.00 H new ATOM 0 HG11 VAL A 22 0.875 12.157 4.567 1.00 0.00 H new ATOM 0 HG12 VAL A 22 1.081 10.661 5.509 1.00 0.00 H new ATOM 0 HG13 VAL A 22 2.298 11.955 5.617 1.00 0.00 H new ATOM 0 HG21 VAL A 22 2.298 12.598 2.595 1.00 0.00 H new ATOM 0 HG22 VAL A 22 3.782 12.417 3.561 1.00 0.00 H new ATOM 0 HG23 VAL A 22 3.542 11.423 2.105 1.00 0.00 H new ATOM 374 N ASP A 23 3.105 8.732 6.448 1.00 0.00 N ATOM 375 CA ASP A 23 2.495 7.806 7.399 1.00 0.00 C ATOM 376 C ASP A 23 1.014 8.131 7.570 1.00 0.00 C ATOM 377 O ASP A 23 0.656 9.153 8.155 1.00 0.00 O ATOM 378 CB ASP A 23 3.203 7.870 8.753 1.00 0.00 C ATOM 379 CG ASP A 23 2.639 6.880 9.755 1.00 0.00 C ATOM 380 OD1 ASP A 23 1.547 6.330 9.501 1.00 0.00 O ATOM 381 OD2 ASP A 23 3.292 6.654 10.796 1.00 0.00 O ATOM 0 H ASP A 23 3.855 9.306 6.833 1.00 0.00 H new ATOM 0 HA ASP A 23 2.597 6.795 7.005 1.00 0.00 H new ATOM 0 HB2 ASP A 23 4.266 7.673 8.612 1.00 0.00 H new ATOM 0 HB3 ASP A 23 3.116 8.879 9.157 1.00 0.00 H new ATOM 386 N VAL A 24 0.156 7.265 7.040 1.00 0.00 N ATOM 387 CA VAL A 24 -1.284 7.472 7.122 1.00 0.00 C ATOM 388 C VAL A 24 -2.039 6.160 6.996 1.00 0.00 C ATOM 389 O VAL A 24 -2.346 5.711 5.892 1.00 0.00 O ATOM 390 CB VAL A 24 -1.754 8.460 6.032 1.00 0.00 C ATOM 391 CG1 VAL A 24 -1.263 8.026 4.654 1.00 0.00 C ATOM 392 CG2 VAL A 24 -3.268 8.623 6.047 1.00 0.00 C ATOM 0 H VAL A 24 0.433 6.415 6.550 1.00 0.00 H new ATOM 0 HA VAL A 24 -1.501 7.897 8.102 1.00 0.00 H new ATOM 0 HB VAL A 24 -1.316 9.433 6.255 1.00 0.00 H new ATOM 0 HG11 VAL A 24 -1.607 8.738 3.904 1.00 0.00 H new ATOM 0 HG12 VAL A 24 -0.174 7.993 4.650 1.00 0.00 H new ATOM 0 HG13 VAL A 24 -1.657 7.036 4.422 1.00 0.00 H new ATOM 0 HG21 VAL A 24 -3.566 9.325 5.268 1.00 0.00 H new ATOM 0 HG22 VAL A 24 -3.740 7.657 5.865 1.00 0.00 H new ATOM 0 HG23 VAL A 24 -3.583 9.004 7.018 1.00 0.00 H new ATOM 402 N GLN A 25 -2.345 5.545 8.135 1.00 0.00 N ATOM 403 CA GLN A 25 -3.068 4.285 8.126 1.00 0.00 C ATOM 404 C GLN A 25 -3.369 3.779 9.531 1.00 0.00 C ATOM 405 O GLN A 25 -4.014 4.467 10.323 1.00 0.00 O ATOM 406 CB GLN A 25 -2.265 3.243 7.369 1.00 0.00 C ATOM 407 CG GLN A 25 -3.113 2.107 6.815 1.00 0.00 C ATOM 408 CD GLN A 25 -2.505 0.742 7.088 1.00 0.00 C ATOM 409 OE1 GLN A 25 -2.250 0.386 8.238 1.00 0.00 O ATOM 410 NE2 GLN A 25 -2.268 -0.029 6.033 1.00 0.00 N ATOM 0 H GLN A 25 -2.106 5.896 9.062 1.00 0.00 H new ATOM 0 HA GLN A 25 -4.023 4.459 7.631 1.00 0.00 H new ATOM 0 HB2 GLN A 25 -1.740 3.728 6.546 1.00 0.00 H new ATOM 0 HB3 GLN A 25 -1.506 2.829 8.032 1.00 0.00 H new ATOM 0 HG2 GLN A 25 -4.109 2.153 7.256 1.00 0.00 H new ATOM 0 HG3 GLN A 25 -3.234 2.239 5.740 1.00 0.00 H new ATOM 0 HE21 GLN A 25 -2.495 0.305 5.096 1.00 0.00 H new ATOM 0 HE22 GLN A 25 -1.859 -0.955 6.160 1.00 0.00 H new ATOM 419 N SER A 26 -2.903 2.560 9.829 1.00 0.00 N ATOM 420 CA SER A 26 -3.132 1.951 11.144 1.00 0.00 C ATOM 421 C SER A 26 -2.994 2.967 12.260 1.00 0.00 C ATOM 422 O SER A 26 -1.999 3.676 12.334 1.00 0.00 O ATOM 423 CB SER A 26 -2.148 0.822 11.413 1.00 0.00 C ATOM 424 OG SER A 26 -2.496 -0.341 10.682 1.00 0.00 O ATOM 0 H SER A 26 -2.369 1.980 9.182 1.00 0.00 H new ATOM 0 HA SER A 26 -4.149 1.560 11.125 1.00 0.00 H new ATOM 0 HB2 SER A 26 -1.142 1.140 11.140 1.00 0.00 H new ATOM 0 HB3 SER A 26 -2.133 0.595 12.479 1.00 0.00 H new ATOM 0 HG SER A 26 -2.416 -0.160 9.722 1.00 0.00 H new ATOM 430 N ASP A 27 -3.971 3.009 13.150 1.00 0.00 N ATOM 431 CA ASP A 27 -3.899 3.913 14.283 1.00 0.00 C ATOM 432 C ASP A 27 -3.034 3.258 15.344 1.00 0.00 C ATOM 433 O ASP A 27 -2.237 3.913 16.017 1.00 0.00 O ATOM 434 CB ASP A 27 -5.294 4.216 14.834 1.00 0.00 C ATOM 435 CG ASP A 27 -5.293 5.385 15.799 1.00 0.00 C ATOM 436 OD1 ASP A 27 -4.473 6.309 15.612 1.00 0.00 O ATOM 437 OD2 ASP A 27 -6.112 5.377 16.742 1.00 0.00 O ATOM 0 H ASP A 27 -4.813 2.435 13.111 1.00 0.00 H new ATOM 0 HA ASP A 27 -3.465 4.864 13.974 1.00 0.00 H new ATOM 0 HB2 ASP A 27 -5.969 4.432 14.006 1.00 0.00 H new ATOM 0 HB3 ASP A 27 -5.682 3.332 15.339 1.00 0.00 H new ATOM 442 N LEU A 28 -3.179 1.941 15.451 1.00 0.00 N ATOM 443 CA LEU A 28 -2.397 1.153 16.384 1.00 0.00 C ATOM 444 C LEU A 28 -1.075 0.774 15.749 1.00 0.00 C ATOM 445 O LEU A 28 -0.007 0.932 16.340 1.00 0.00 O ATOM 446 CB LEU A 28 -3.163 -0.104 16.794 1.00 0.00 C ATOM 447 CG LEU A 28 -4.470 0.149 17.547 1.00 0.00 C ATOM 448 CD1 LEU A 28 -4.225 1.036 18.758 1.00 0.00 C ATOM 449 CD2 LEU A 28 -5.503 0.777 16.623 1.00 0.00 C ATOM 0 H LEU A 28 -3.839 1.397 14.895 1.00 0.00 H new ATOM 0 HA LEU A 28 -2.208 1.748 17.277 1.00 0.00 H new ATOM 0 HB2 LEU A 28 -3.384 -0.684 15.898 1.00 0.00 H new ATOM 0 HB3 LEU A 28 -2.515 -0.718 17.419 1.00 0.00 H new ATOM 0 HG LEU A 28 -4.858 -0.808 17.897 1.00 0.00 H new ATOM 0 HD11 LEU A 28 -5.166 1.205 19.281 1.00 0.00 H new ATOM 0 HD12 LEU A 28 -3.519 0.548 19.430 1.00 0.00 H new ATOM 0 HD13 LEU A 28 -3.814 1.992 18.432 1.00 0.00 H new ATOM 0 HD21 LEU A 28 -6.427 0.950 17.175 1.00 0.00 H new ATOM 0 HD22 LEU A 28 -5.123 1.726 16.244 1.00 0.00 H new ATOM 0 HD23 LEU A 28 -5.700 0.105 15.787 1.00 0.00 H new ATOM 461 N LEU A 29 -1.171 0.282 14.527 1.00 0.00 N ATOM 462 CA LEU A 29 -0.010 -0.123 13.756 1.00 0.00 C ATOM 463 C LEU A 29 0.486 1.029 12.891 1.00 0.00 C ATOM 464 O LEU A 29 1.049 0.809 11.819 1.00 0.00 O ATOM 465 CB LEU A 29 -0.382 -1.308 12.868 1.00 0.00 C ATOM 466 CG LEU A 29 -0.905 -2.526 13.621 1.00 0.00 C ATOM 467 CD1 LEU A 29 -1.698 -3.431 12.691 1.00 0.00 C ATOM 468 CD2 LEU A 29 0.242 -3.290 14.265 1.00 0.00 C ATOM 0 H LEU A 29 -2.058 0.152 14.041 1.00 0.00 H new ATOM 0 HA LEU A 29 0.787 -0.410 14.442 1.00 0.00 H new ATOM 0 HB2 LEU A 29 -1.140 -0.986 12.154 1.00 0.00 H new ATOM 0 HB3 LEU A 29 0.495 -1.603 12.292 1.00 0.00 H new ATOM 0 HG LEU A 29 -1.572 -2.180 14.411 1.00 0.00 H new ATOM 0 HD11 LEU A 29 -2.063 -4.295 13.247 1.00 0.00 H new ATOM 0 HD12 LEU A 29 -2.544 -2.880 12.281 1.00 0.00 H new ATOM 0 HD13 LEU A 29 -1.056 -3.768 11.877 1.00 0.00 H new ATOM 0 HD21 LEU A 29 -0.151 -4.156 14.798 1.00 0.00 H new ATOM 0 HD22 LEU A 29 0.936 -3.623 13.493 1.00 0.00 H new ATOM 0 HD23 LEU A 29 0.764 -2.639 14.966 1.00 0.00 H new ATOM 480 N ASP A 30 0.249 2.259 13.342 1.00 0.00 N ATOM 481 CA ASP A 30 0.652 3.430 12.576 1.00 0.00 C ATOM 482 C ASP A 30 2.158 3.455 12.345 1.00 0.00 C ATOM 483 O ASP A 30 2.612 3.408 11.207 1.00 0.00 O ATOM 484 CB ASP A 30 0.217 4.704 13.301 1.00 0.00 C ATOM 485 CG ASP A 30 0.066 5.872 12.352 1.00 0.00 C ATOM 486 OD1 ASP A 30 1.099 6.442 11.946 1.00 0.00 O ATOM 487 OD2 ASP A 30 -1.086 6.217 12.013 1.00 0.00 O ATOM 0 H ASP A 30 -0.216 2.467 14.226 1.00 0.00 H new ATOM 0 HA ASP A 30 0.163 3.378 11.603 1.00 0.00 H new ATOM 0 HB2 ASP A 30 -0.730 4.526 13.810 1.00 0.00 H new ATOM 0 HB3 ASP A 30 0.950 4.953 14.068 1.00 0.00 H new ATOM 492 N ASN A 31 2.933 3.501 13.419 1.00 0.00 N ATOM 493 CA ASN A 31 4.387 3.500 13.295 1.00 0.00 C ATOM 494 C ASN A 31 5.002 2.349 14.065 1.00 0.00 C ATOM 495 O ASN A 31 6.224 2.250 14.181 1.00 0.00 O ATOM 496 CB ASN A 31 4.983 4.829 13.760 1.00 0.00 C ATOM 497 CG ASN A 31 6.480 4.904 13.531 1.00 0.00 C ATOM 498 OD1 ASN A 31 7.043 4.121 12.767 1.00 0.00 O ATOM 499 ND2 ASN A 31 7.134 5.850 14.196 1.00 0.00 N ATOM 0 H ASN A 31 2.586 3.539 14.377 1.00 0.00 H new ATOM 0 HA ASN A 31 4.623 3.370 12.239 1.00 0.00 H new ATOM 0 HB2 ASN A 31 4.496 5.648 13.230 1.00 0.00 H new ATOM 0 HB3 ASN A 31 4.773 4.967 14.821 1.00 0.00 H new ATOM 0 HD21 ASN A 31 8.143 5.948 14.083 1.00 0.00 H new ATOM 0 HD22 ASN A 31 6.627 6.478 14.820 1.00 0.00 H new ATOM 506 N LEU A 32 4.154 1.471 14.577 1.00 0.00 N ATOM 507 CA LEU A 32 4.629 0.314 15.321 1.00 0.00 C ATOM 508 C LEU A 32 5.703 -0.388 14.527 1.00 0.00 C ATOM 509 O LEU A 32 6.866 -0.450 14.926 1.00 0.00 O ATOM 510 CB LEU A 32 3.501 -0.677 15.566 1.00 0.00 C ATOM 511 CG LEU A 32 3.157 -0.929 17.035 1.00 0.00 C ATOM 512 CD1 LEU A 32 1.813 -1.630 17.157 1.00 0.00 C ATOM 513 CD2 LEU A 32 4.250 -1.749 17.704 1.00 0.00 C ATOM 0 H LEU A 32 3.140 1.536 14.492 1.00 0.00 H new ATOM 0 HA LEU A 32 5.017 0.665 16.277 1.00 0.00 H new ATOM 0 HB2 LEU A 32 2.607 -0.317 15.058 1.00 0.00 H new ATOM 0 HB3 LEU A 32 3.769 -1.628 15.105 1.00 0.00 H new ATOM 0 HG LEU A 32 3.088 0.033 17.542 1.00 0.00 H new ATOM 0 HD11 LEU A 32 1.586 -1.801 18.209 1.00 0.00 H new ATOM 0 HD12 LEU A 32 1.036 -1.007 16.714 1.00 0.00 H new ATOM 0 HD13 LEU A 32 1.853 -2.586 16.635 1.00 0.00 H new ATOM 0 HD21 LEU A 32 3.989 -1.919 18.749 1.00 0.00 H new ATOM 0 HD22 LEU A 32 4.350 -2.707 17.194 1.00 0.00 H new ATOM 0 HD23 LEU A 32 5.195 -1.209 17.649 1.00 0.00 H new ATOM 525 N ASN A 33 5.285 -0.923 13.391 1.00 0.00 N ATOM 526 CA ASN A 33 6.186 -1.632 12.521 1.00 0.00 C ATOM 527 C ASN A 33 6.097 -1.131 11.078 1.00 0.00 C ATOM 528 O ASN A 33 6.993 -1.392 10.276 1.00 0.00 O ATOM 529 CB ASN A 33 5.890 -3.132 12.566 1.00 0.00 C ATOM 530 CG ASN A 33 7.129 -3.973 12.331 1.00 0.00 C ATOM 531 OD1 ASN A 33 8.147 -3.800 13.001 1.00 0.00 O ATOM 532 ND2 ASN A 33 7.048 -4.891 11.375 1.00 0.00 N ATOM 0 H ASN A 33 4.323 -0.875 13.056 1.00 0.00 H new ATOM 0 HA ASN A 33 7.199 -1.447 12.878 1.00 0.00 H new ATOM 0 HB2 ASN A 33 5.460 -3.386 13.535 1.00 0.00 H new ATOM 0 HB3 ASN A 33 5.141 -3.375 11.812 1.00 0.00 H new ATOM 0 HD21 ASN A 33 7.850 -5.487 11.171 1.00 0.00 H new ATOM 0 HD22 ASN A 33 6.184 -5.000 10.844 1.00 0.00 H new ATOM 539 N THR A 34 5.016 -0.416 10.736 1.00 0.00 N ATOM 540 CA THR A 34 4.849 0.095 9.370 1.00 0.00 C ATOM 541 C THR A 34 3.663 1.048 9.276 1.00 0.00 C ATOM 542 O THR A 34 2.889 1.189 10.222 1.00 0.00 O ATOM 543 CB THR A 34 4.673 -1.048 8.348 1.00 0.00 C ATOM 544 OG1 THR A 34 3.442 -0.924 7.654 1.00 0.00 O ATOM 545 CG2 THR A 34 4.709 -2.441 8.947 1.00 0.00 C ATOM 0 H THR A 34 4.256 -0.182 11.375 1.00 0.00 H new ATOM 0 HA THR A 34 5.762 0.639 9.128 1.00 0.00 H new ATOM 0 HB THR A 34 5.529 -0.942 7.682 1.00 0.00 H new ATOM 0 HG1 THR A 34 3.354 -1.658 7.011 1.00 0.00 H new ATOM 0 HG21 THR A 34 4.578 -3.180 8.157 1.00 0.00 H new ATOM 0 HG22 THR A 34 5.669 -2.601 9.438 1.00 0.00 H new ATOM 0 HG23 THR A 34 3.906 -2.544 9.677 1.00 0.00 H new ATOM 553 N ARG A 35 3.517 1.681 8.116 1.00 0.00 N ATOM 554 CA ARG A 35 2.413 2.603 7.879 1.00 0.00 C ATOM 555 C ARG A 35 2.054 2.663 6.402 1.00 0.00 C ATOM 556 O ARG A 35 2.932 2.588 5.544 1.00 0.00 O ATOM 557 CB ARG A 35 2.781 4.008 8.354 1.00 0.00 C ATOM 558 CG ARG A 35 4.085 4.523 7.764 1.00 0.00 C ATOM 559 CD ARG A 35 5.085 4.882 8.850 1.00 0.00 C ATOM 560 NE ARG A 35 5.215 3.817 9.842 1.00 0.00 N ATOM 561 CZ ARG A 35 6.250 2.982 9.908 1.00 0.00 C ATOM 562 NH1 ARG A 35 7.245 3.078 9.039 1.00 0.00 N ATOM 563 NH2 ARG A 35 6.287 2.042 10.842 1.00 0.00 N ATOM 0 H ARG A 35 4.151 1.572 7.325 1.00 0.00 H new ATOM 0 HA ARG A 35 1.554 2.235 8.440 1.00 0.00 H new ATOM 0 HB2 ARG A 35 1.976 4.695 8.092 1.00 0.00 H new ATOM 0 HB3 ARG A 35 2.858 4.007 9.441 1.00 0.00 H new ATOM 0 HG2 ARG A 35 4.514 3.764 7.110 1.00 0.00 H new ATOM 0 HG3 ARG A 35 3.885 5.400 7.148 1.00 0.00 H new ATOM 0 HD2 ARG A 35 6.057 5.078 8.398 1.00 0.00 H new ATOM 0 HD3 ARG A 35 4.771 5.802 9.343 1.00 0.00 H new ATOM 0 HE ARG A 35 4.467 3.706 10.526 1.00 0.00 H new ATOM 0 HH11 ARG A 35 7.221 3.795 8.314 1.00 0.00 H new ATOM 0 HH12 ARG A 35 8.035 2.435 9.095 1.00 0.00 H new ATOM 0 HH21 ARG A 35 5.522 1.958 11.511 1.00 0.00 H new ATOM 0 HH22 ARG A 35 7.081 1.403 10.891 1.00 0.00 H new ATOM 577 N LEU A 36 0.772 2.856 6.102 1.00 0.00 N ATOM 578 CA LEU A 36 0.356 2.987 4.712 1.00 0.00 C ATOM 579 C LEU A 36 0.705 4.391 4.260 1.00 0.00 C ATOM 580 O LEU A 36 0.240 5.367 4.846 1.00 0.00 O ATOM 581 CB LEU A 36 -1.142 2.745 4.542 1.00 0.00 C ATOM 582 CG LEU A 36 -1.576 2.410 3.116 1.00 0.00 C ATOM 583 CD1 LEU A 36 -0.752 1.261 2.556 1.00 0.00 C ATOM 584 CD2 LEU A 36 -3.061 2.083 3.068 1.00 0.00 C ATOM 0 H LEU A 36 0.019 2.924 6.787 1.00 0.00 H new ATOM 0 HA LEU A 36 0.870 2.238 4.110 1.00 0.00 H new ATOM 0 HB2 LEU A 36 -1.441 1.929 5.200 1.00 0.00 H new ATOM 0 HB3 LEU A 36 -1.680 3.634 4.872 1.00 0.00 H new ATOM 0 HG LEU A 36 -1.401 3.287 2.493 1.00 0.00 H new ATOM 0 HD11 LEU A 36 -1.079 1.040 1.540 1.00 0.00 H new ATOM 0 HD12 LEU A 36 0.302 1.540 2.546 1.00 0.00 H new ATOM 0 HD13 LEU A 36 -0.887 0.378 3.181 1.00 0.00 H new ATOM 0 HD21 LEU A 36 -3.349 1.847 2.043 1.00 0.00 H new ATOM 0 HD22 LEU A 36 -3.266 1.225 3.709 1.00 0.00 H new ATOM 0 HD23 LEU A 36 -3.634 2.942 3.418 1.00 0.00 H new ATOM 596 N VAL A 37 1.567 4.500 3.262 1.00 0.00 N ATOM 597 CA VAL A 37 2.004 5.809 2.808 1.00 0.00 C ATOM 598 C VAL A 37 1.741 6.074 1.345 1.00 0.00 C ATOM 599 O VAL A 37 1.676 5.163 0.519 1.00 0.00 O ATOM 600 CB VAL A 37 3.520 5.994 3.028 1.00 0.00 C ATOM 601 CG1 VAL A 37 3.837 6.127 4.511 1.00 0.00 C ATOM 602 CG2 VAL A 37 4.293 4.839 2.404 1.00 0.00 C ATOM 0 H VAL A 37 1.972 3.711 2.758 1.00 0.00 H new ATOM 0 HA VAL A 37 1.417 6.509 3.402 1.00 0.00 H new ATOM 0 HB VAL A 37 3.831 6.916 2.536 1.00 0.00 H new ATOM 0 HG11 VAL A 37 4.911 6.257 4.643 1.00 0.00 H new ATOM 0 HG12 VAL A 37 3.314 6.992 4.919 1.00 0.00 H new ATOM 0 HG13 VAL A 37 3.513 5.228 5.034 1.00 0.00 H new ATOM 0 HG21 VAL A 37 5.361 4.985 2.568 1.00 0.00 H new ATOM 0 HG22 VAL A 37 3.980 3.901 2.863 1.00 0.00 H new ATOM 0 HG23 VAL A 37 4.092 4.803 1.333 1.00 0.00 H new ATOM 612 N ILE A 38 1.696 7.359 1.037 1.00 0.00 N ATOM 613 CA ILE A 38 1.561 7.820 -0.319 1.00 0.00 C ATOM 614 C ILE A 38 2.920 8.393 -0.666 1.00 0.00 C ATOM 615 O ILE A 38 3.214 9.551 -0.371 1.00 0.00 O ATOM 616 CB ILE A 38 0.480 8.906 -0.465 1.00 0.00 C ATOM 617 CG1 ILE A 38 -0.800 8.485 0.259 1.00 0.00 C ATOM 618 CG2 ILE A 38 0.204 9.169 -1.934 1.00 0.00 C ATOM 619 CD1 ILE A 38 -0.903 9.026 1.668 1.00 0.00 C ATOM 0 H ILE A 38 1.753 8.107 1.728 1.00 0.00 H new ATOM 0 HA ILE A 38 1.254 7.008 -0.978 1.00 0.00 H new ATOM 0 HB ILE A 38 0.841 9.828 -0.009 1.00 0.00 H new ATOM 0 HG12 ILE A 38 -1.661 8.825 -0.316 1.00 0.00 H new ATOM 0 HG13 ILE A 38 -0.848 7.397 0.292 1.00 0.00 H new ATOM 0 HG21 ILE A 38 -0.562 9.939 -2.028 1.00 0.00 H new ATOM 0 HG22 ILE A 38 1.119 9.506 -2.421 1.00 0.00 H new ATOM 0 HG23 ILE A 38 -0.143 8.251 -2.409 1.00 0.00 H new ATOM 0 HD11 ILE A 38 -1.835 8.688 2.120 1.00 0.00 H new ATOM 0 HD12 ILE A 38 -0.061 8.665 2.259 1.00 0.00 H new ATOM 0 HD13 ILE A 38 -0.887 10.116 1.641 1.00 0.00 H new ATOM 631 N PRO A 39 3.800 7.553 -1.223 1.00 0.00 N ATOM 632 CA PRO A 39 5.168 7.938 -1.525 1.00 0.00 C ATOM 633 C PRO A 39 5.297 9.268 -2.248 1.00 0.00 C ATOM 634 O PRO A 39 5.256 9.334 -3.471 1.00 0.00 O ATOM 635 CB PRO A 39 5.701 6.793 -2.390 1.00 0.00 C ATOM 636 CG PRO A 39 4.540 5.885 -2.644 1.00 0.00 C ATOM 637 CD PRO A 39 3.563 6.139 -1.535 1.00 0.00 C ATOM 0 HA PRO A 39 5.730 8.090 -0.604 1.00 0.00 H new ATOM 0 HB2 PRO A 39 6.111 7.171 -3.326 1.00 0.00 H new ATOM 0 HB3 PRO A 39 6.506 6.263 -1.881 1.00 0.00 H new ATOM 0 HG2 PRO A 39 4.089 6.091 -3.615 1.00 0.00 H new ATOM 0 HG3 PRO A 39 4.856 4.842 -2.654 1.00 0.00 H new ATOM 0 HD2 PRO A 39 2.535 5.959 -1.850 1.00 0.00 H new ATOM 0 HD3 PRO A 39 3.749 5.496 -0.674 1.00 0.00 H new ATOM 645 N LEU A 40 5.496 10.321 -1.472 1.00 0.00 N ATOM 646 CA LEU A 40 5.678 11.655 -2.013 1.00 0.00 C ATOM 647 C LEU A 40 6.914 11.703 -2.884 1.00 0.00 C ATOM 648 O LEU A 40 7.800 10.859 -2.768 1.00 0.00 O ATOM 649 CB LEU A 40 5.822 12.652 -0.867 1.00 0.00 C ATOM 650 CG LEU A 40 4.619 13.543 -0.631 1.00 0.00 C ATOM 651 CD1 LEU A 40 4.741 14.249 0.711 1.00 0.00 C ATOM 652 CD2 LEU A 40 4.473 14.550 -1.760 1.00 0.00 C ATOM 0 H LEU A 40 5.536 10.274 -0.454 1.00 0.00 H new ATOM 0 HA LEU A 40 4.810 11.914 -2.619 1.00 0.00 H new ATOM 0 HB2 LEU A 40 6.030 12.100 0.049 1.00 0.00 H new ATOM 0 HB3 LEU A 40 6.689 13.283 -1.063 1.00 0.00 H new ATOM 0 HG LEU A 40 3.723 12.923 -0.612 1.00 0.00 H new ATOM 0 HD11 LEU A 40 3.870 14.886 0.868 1.00 0.00 H new ATOM 0 HD12 LEU A 40 4.797 13.508 1.508 1.00 0.00 H new ATOM 0 HD13 LEU A 40 5.644 14.860 0.720 1.00 0.00 H new ATOM 0 HD21 LEU A 40 3.604 15.181 -1.574 1.00 0.00 H new ATOM 0 HD22 LEU A 40 5.368 15.170 -1.812 1.00 0.00 H new ATOM 0 HD23 LEU A 40 4.342 14.021 -2.704 1.00 0.00 H new ATOM 664 N THR A 41 6.970 12.697 -3.750 1.00 0.00 N ATOM 665 CA THR A 41 8.105 12.858 -4.633 1.00 0.00 C ATOM 666 C THR A 41 8.204 14.292 -5.128 1.00 0.00 C ATOM 667 O THR A 41 7.346 15.119 -4.821 1.00 0.00 O ATOM 668 CB THR A 41 8.027 11.866 -5.794 1.00 0.00 C ATOM 669 OG1 THR A 41 8.049 12.523 -7.049 1.00 0.00 O ATOM 670 CG2 THR A 41 6.800 10.978 -5.773 1.00 0.00 C ATOM 0 H THR A 41 6.243 13.404 -3.859 1.00 0.00 H new ATOM 0 HA THR A 41 9.014 12.642 -4.073 1.00 0.00 H new ATOM 0 HB THR A 41 8.910 11.241 -5.660 1.00 0.00 H new ATOM 0 HG1 THR A 41 8.510 11.960 -7.705 1.00 0.00 H new ATOM 0 HG21 THR A 41 6.823 10.305 -6.630 1.00 0.00 H new ATOM 0 HG22 THR A 41 6.790 10.393 -4.853 1.00 0.00 H new ATOM 0 HG23 THR A 41 5.903 11.596 -5.821 1.00 0.00 H new ATOM 678 N PRO A 42 9.256 14.623 -5.890 1.00 0.00 N ATOM 679 CA PRO A 42 9.451 15.972 -6.395 1.00 0.00 C ATOM 680 C PRO A 42 8.722 16.226 -7.697 1.00 0.00 C ATOM 681 O PRO A 42 8.997 15.604 -8.723 1.00 0.00 O ATOM 682 CB PRO A 42 10.962 16.015 -6.582 1.00 0.00 C ATOM 683 CG PRO A 42 11.285 14.647 -7.064 1.00 0.00 C ATOM 684 CD PRO A 42 10.356 13.726 -6.314 1.00 0.00 C ATOM 0 HA PRO A 42 9.057 16.739 -5.729 1.00 0.00 H new ATOM 0 HB2 PRO A 42 11.257 16.776 -7.304 1.00 0.00 H new ATOM 0 HB3 PRO A 42 11.477 16.245 -5.649 1.00 0.00 H new ATOM 0 HG2 PRO A 42 11.135 14.564 -8.140 1.00 0.00 H new ATOM 0 HG3 PRO A 42 12.328 14.398 -6.868 1.00 0.00 H new ATOM 0 HD2 PRO A 42 9.993 12.917 -6.948 1.00 0.00 H new ATOM 0 HD3 PRO A 42 10.851 13.264 -5.459 1.00 0.00 H new ATOM 692 N ILE A 43 7.795 17.169 -7.631 1.00 0.00 N ATOM 693 CA ILE A 43 6.998 17.572 -8.775 1.00 0.00 C ATOM 694 C ILE A 43 7.862 17.696 -10.029 1.00 0.00 C ATOM 695 O ILE A 43 7.401 17.476 -11.148 1.00 0.00 O ATOM 696 CB ILE A 43 6.329 18.927 -8.473 1.00 0.00 C ATOM 697 CG1 ILE A 43 5.037 18.717 -7.709 1.00 0.00 C ATOM 698 CG2 ILE A 43 6.102 19.733 -9.743 1.00 0.00 C ATOM 699 CD1 ILE A 43 4.348 20.018 -7.373 1.00 0.00 C ATOM 0 H ILE A 43 7.574 17.679 -6.775 1.00 0.00 H new ATOM 0 HA ILE A 43 6.239 16.811 -8.957 1.00 0.00 H new ATOM 0 HB ILE A 43 7.005 19.508 -7.846 1.00 0.00 H new ATOM 0 HG12 ILE A 43 4.365 18.096 -8.301 1.00 0.00 H new ATOM 0 HG13 ILE A 43 5.247 18.172 -6.789 1.00 0.00 H new ATOM 0 HG21 ILE A 43 5.629 20.682 -9.492 1.00 0.00 H new ATOM 0 HG22 ILE A 43 7.059 19.922 -10.230 1.00 0.00 H new ATOM 0 HG23 ILE A 43 5.456 19.173 -10.419 1.00 0.00 H new ATOM 0 HD11 ILE A 43 3.428 19.812 -6.826 1.00 0.00 H new ATOM 0 HD12 ILE A 43 5.007 20.630 -6.757 1.00 0.00 H new ATOM 0 HD13 ILE A 43 4.111 20.552 -8.293 1.00 0.00 H new ATOM 711 N GLU A 44 9.112 18.071 -9.815 1.00 0.00 N ATOM 712 CA GLU A 44 10.069 18.261 -10.892 1.00 0.00 C ATOM 713 C GLU A 44 10.426 16.951 -11.593 1.00 0.00 C ATOM 714 O GLU A 44 10.240 16.819 -12.802 1.00 0.00 O ATOM 715 CB GLU A 44 11.317 18.918 -10.316 1.00 0.00 C ATOM 716 CG GLU A 44 11.821 20.095 -11.135 1.00 0.00 C ATOM 717 CD GLU A 44 13.131 20.651 -10.613 1.00 0.00 C ATOM 718 OE1 GLU A 44 13.229 20.890 -9.391 1.00 0.00 O ATOM 719 OE2 GLU A 44 14.059 20.846 -11.425 1.00 0.00 O ATOM 0 H GLU A 44 9.493 18.253 -8.886 1.00 0.00 H new ATOM 0 HA GLU A 44 9.616 18.900 -11.650 1.00 0.00 H new ATOM 0 HB2 GLU A 44 11.103 19.257 -9.302 1.00 0.00 H new ATOM 0 HB3 GLU A 44 12.109 18.172 -10.243 1.00 0.00 H new ATOM 0 HG2 GLU A 44 11.950 19.783 -12.171 1.00 0.00 H new ATOM 0 HG3 GLU A 44 11.069 20.884 -11.131 1.00 0.00 H new ATOM 726 N LEU A 45 10.950 15.989 -10.839 1.00 0.00 N ATOM 727 CA LEU A 45 11.340 14.704 -11.414 1.00 0.00 C ATOM 728 C LEU A 45 10.136 13.967 -11.992 1.00 0.00 C ATOM 729 O LEU A 45 10.274 13.171 -12.921 1.00 0.00 O ATOM 730 CB LEU A 45 12.029 13.832 -10.363 1.00 0.00 C ATOM 731 CG LEU A 45 13.145 14.524 -9.577 1.00 0.00 C ATOM 732 CD1 LEU A 45 13.813 13.545 -8.624 1.00 0.00 C ATOM 733 CD2 LEU A 45 14.168 15.129 -10.527 1.00 0.00 C ATOM 0 H LEU A 45 11.114 16.073 -9.836 1.00 0.00 H new ATOM 0 HA LEU A 45 12.040 14.905 -12.225 1.00 0.00 H new ATOM 0 HB2 LEU A 45 11.277 13.476 -9.659 1.00 0.00 H new ATOM 0 HB3 LEU A 45 12.444 12.954 -10.857 1.00 0.00 H new ATOM 0 HG LEU A 45 12.705 15.328 -8.988 1.00 0.00 H new ATOM 0 HD11 LEU A 45 14.604 14.055 -8.074 1.00 0.00 H new ATOM 0 HD12 LEU A 45 13.074 13.159 -7.922 1.00 0.00 H new ATOM 0 HD13 LEU A 45 14.241 12.719 -9.192 1.00 0.00 H new ATOM 0 HD21 LEU A 45 14.955 15.617 -9.952 1.00 0.00 H new ATOM 0 HD22 LEU A 45 14.604 14.342 -11.142 1.00 0.00 H new ATOM 0 HD23 LEU A 45 13.680 15.862 -11.169 1.00 0.00 H new ATOM 745 N LEU A 46 8.956 14.235 -11.443 1.00 0.00 N ATOM 746 CA LEU A 46 7.735 13.591 -11.915 1.00 0.00 C ATOM 747 C LEU A 46 6.887 14.566 -12.727 1.00 0.00 C ATOM 748 O LEU A 46 5.674 14.661 -12.537 1.00 0.00 O ATOM 749 CB LEU A 46 6.929 13.045 -10.732 1.00 0.00 C ATOM 750 CG LEU A 46 7.204 11.581 -10.381 1.00 0.00 C ATOM 751 CD1 LEU A 46 6.281 11.118 -9.265 1.00 0.00 C ATOM 752 CD2 LEU A 46 7.039 10.698 -11.609 1.00 0.00 C ATOM 0 H LEU A 46 8.819 14.891 -10.674 1.00 0.00 H new ATOM 0 HA LEU A 46 8.016 12.760 -12.562 1.00 0.00 H new ATOM 0 HB2 LEU A 46 7.138 13.658 -9.856 1.00 0.00 H new ATOM 0 HB3 LEU A 46 5.867 13.157 -10.953 1.00 0.00 H new ATOM 0 HG LEU A 46 8.234 11.498 -10.033 1.00 0.00 H new ATOM 0 HD11 LEU A 46 6.491 10.075 -9.029 1.00 0.00 H new ATOM 0 HD12 LEU A 46 6.446 11.731 -8.379 1.00 0.00 H new ATOM 0 HD13 LEU A 46 5.244 11.216 -9.586 1.00 0.00 H new ATOM 0 HD21 LEU A 46 7.238 9.661 -11.341 1.00 0.00 H new ATOM 0 HD22 LEU A 46 6.020 10.786 -11.986 1.00 0.00 H new ATOM 0 HD23 LEU A 46 7.740 11.014 -12.381 1.00 0.00 H new ATOM 764 N ASP A 47 7.534 15.292 -13.634 1.00 0.00 N ATOM 765 CA ASP A 47 6.841 16.261 -14.476 1.00 0.00 C ATOM 766 C ASP A 47 6.290 17.394 -13.655 1.00 0.00 C ATOM 767 O ASP A 47 5.397 17.226 -12.826 1.00 0.00 O ATOM 768 CB ASP A 47 5.721 15.600 -15.275 1.00 0.00 C ATOM 769 CG ASP A 47 6.073 14.197 -15.731 1.00 0.00 C ATOM 770 OD1 ASP A 47 7.264 13.945 -16.013 1.00 0.00 O ATOM 771 OD2 ASP A 47 5.158 13.349 -15.807 1.00 0.00 O ATOM 0 H ASP A 47 8.538 15.227 -13.805 1.00 0.00 H new ATOM 0 HA ASP A 47 7.572 16.663 -15.177 1.00 0.00 H new ATOM 0 HB2 ASP A 47 4.819 15.563 -14.665 1.00 0.00 H new ATOM 0 HB3 ASP A 47 5.492 16.213 -16.146 1.00 0.00 H new ATOM 776 N LYS A 48 6.849 18.553 -13.914 1.00 0.00 N ATOM 777 CA LYS A 48 6.466 19.765 -13.242 1.00 0.00 C ATOM 778 C LYS A 48 5.116 20.257 -13.754 1.00 0.00 C ATOM 779 O LYS A 48 5.008 21.349 -14.313 1.00 0.00 O ATOM 780 CB LYS A 48 7.556 20.798 -13.483 1.00 0.00 C ATOM 781 CG LYS A 48 8.411 21.082 -12.258 1.00 0.00 C ATOM 782 CD LYS A 48 7.923 22.301 -11.494 1.00 0.00 C ATOM 783 CE LYS A 48 7.914 23.545 -12.369 1.00 0.00 C ATOM 784 NZ LYS A 48 8.231 24.774 -11.590 1.00 0.00 N ATOM 0 H LYS A 48 7.589 18.678 -14.604 1.00 0.00 H new ATOM 0 HA LYS A 48 6.357 19.588 -12.172 1.00 0.00 H new ATOM 0 HB2 LYS A 48 8.199 20.452 -14.292 1.00 0.00 H new ATOM 0 HB3 LYS A 48 7.096 21.728 -13.817 1.00 0.00 H new ATOM 0 HG2 LYS A 48 8.401 20.213 -11.600 1.00 0.00 H new ATOM 0 HG3 LYS A 48 9.445 21.237 -12.566 1.00 0.00 H new ATOM 0 HD2 LYS A 48 6.918 22.115 -11.115 1.00 0.00 H new ATOM 0 HD3 LYS A 48 8.564 22.469 -10.629 1.00 0.00 H new ATOM 0 HE2 LYS A 48 8.640 23.428 -13.174 1.00 0.00 H new ATOM 0 HE3 LYS A 48 6.935 23.653 -12.836 1.00 0.00 H new ATOM 0 HZ1 LYS A 48 8.215 25.600 -12.222 1.00 0.00 H new ATOM 0 HZ2 LYS A 48 7.524 24.900 -10.838 1.00 0.00 H new ATOM 0 HZ3 LYS A 48 9.176 24.682 -11.165 1.00 0.00 H new ATOM 798 N LYS A 49 4.089 19.432 -13.573 1.00 0.00 N ATOM 799 CA LYS A 49 2.746 19.766 -14.027 1.00 0.00 C ATOM 800 C LYS A 49 1.759 18.661 -13.660 1.00 0.00 C ATOM 801 O LYS A 49 0.850 18.347 -14.428 1.00 0.00 O ATOM 802 CB LYS A 49 2.746 19.981 -15.543 1.00 0.00 C ATOM 803 CG LYS A 49 3.598 18.972 -16.303 1.00 0.00 C ATOM 804 CD LYS A 49 3.890 19.445 -17.718 1.00 0.00 C ATOM 805 CE LYS A 49 4.935 18.570 -18.392 1.00 0.00 C ATOM 806 NZ LYS A 49 5.354 19.122 -19.710 1.00 0.00 N ATOM 0 H LYS A 49 4.163 18.525 -13.113 1.00 0.00 H new ATOM 0 HA LYS A 49 2.434 20.686 -13.532 1.00 0.00 H new ATOM 0 HB2 LYS A 49 1.721 19.927 -15.909 1.00 0.00 H new ATOM 0 HB3 LYS A 49 3.109 20.986 -15.759 1.00 0.00 H new ATOM 0 HG2 LYS A 49 4.536 18.812 -15.771 1.00 0.00 H new ATOM 0 HG3 LYS A 49 3.083 18.012 -16.338 1.00 0.00 H new ATOM 0 HD2 LYS A 49 2.971 19.433 -18.304 1.00 0.00 H new ATOM 0 HD3 LYS A 49 4.239 20.477 -17.693 1.00 0.00 H new ATOM 0 HE2 LYS A 49 5.806 18.479 -17.743 1.00 0.00 H new ATOM 0 HE3 LYS A 49 4.534 17.566 -18.530 1.00 0.00 H new ATOM 0 HZ1 LYS A 49 6.067 18.497 -20.137 1.00 0.00 H new ATOM 0 HZ2 LYS A 49 4.528 19.185 -20.338 1.00 0.00 H new ATOM 0 HZ3 LYS A 49 5.760 20.070 -19.576 1.00 0.00 H new ATOM 820 N ALA A 50 1.949 18.072 -12.484 1.00 0.00 N ATOM 821 CA ALA A 50 1.079 16.998 -12.017 1.00 0.00 C ATOM 822 C ALA A 50 -0.280 17.536 -11.572 1.00 0.00 C ATOM 823 O ALA A 50 -0.373 18.255 -10.577 1.00 0.00 O ATOM 824 CB ALA A 50 1.746 16.242 -10.877 1.00 0.00 C ATOM 0 H ALA A 50 2.697 18.320 -11.837 1.00 0.00 H new ATOM 0 HA ALA A 50 0.911 16.314 -12.849 1.00 0.00 H new ATOM 0 HB1 ALA A 50 1.088 15.443 -10.536 1.00 0.00 H new ATOM 0 HB2 ALA A 50 2.686 15.814 -11.225 1.00 0.00 H new ATOM 0 HB3 ALA A 50 1.942 16.927 -10.052 1.00 0.00 H new ATOM 830 N PRO A 51 -1.359 17.194 -12.302 1.00 0.00 N ATOM 831 CA PRO A 51 -2.714 17.649 -11.968 1.00 0.00 C ATOM 832 C PRO A 51 -3.146 17.200 -10.576 1.00 0.00 C ATOM 833 O PRO A 51 -2.456 16.415 -9.924 1.00 0.00 O ATOM 834 CB PRO A 51 -3.596 16.992 -13.036 1.00 0.00 C ATOM 835 CG PRO A 51 -2.666 16.651 -14.150 1.00 0.00 C ATOM 836 CD PRO A 51 -1.348 16.341 -13.502 1.00 0.00 C ATOM 0 HA PRO A 51 -2.782 18.737 -11.956 1.00 0.00 H new ATOM 0 HB2 PRO A 51 -4.089 16.101 -12.647 1.00 0.00 H new ATOM 0 HB3 PRO A 51 -4.381 17.670 -13.371 1.00 0.00 H new ATOM 0 HG2 PRO A 51 -3.033 15.796 -14.718 1.00 0.00 H new ATOM 0 HG3 PRO A 51 -2.572 17.482 -14.849 1.00 0.00 H new ATOM 0 HD2 PRO A 51 -1.263 15.285 -13.246 1.00 0.00 H new ATOM 0 HD3 PRO A 51 -0.510 16.578 -14.158 1.00 0.00 H new ATOM 844 N SER A 52 -4.291 17.702 -10.125 1.00 0.00 N ATOM 845 CA SER A 52 -4.813 17.351 -8.809 1.00 0.00 C ATOM 846 C SER A 52 -5.984 16.380 -8.928 1.00 0.00 C ATOM 847 O SER A 52 -6.951 16.642 -9.643 1.00 0.00 O ATOM 848 CB SER A 52 -5.255 18.610 -8.061 1.00 0.00 C ATOM 849 OG SER A 52 -5.797 19.570 -8.952 1.00 0.00 O ATOM 0 H SER A 52 -4.875 18.353 -10.651 1.00 0.00 H new ATOM 0 HA SER A 52 -4.016 16.863 -8.248 1.00 0.00 H new ATOM 0 HB2 SER A 52 -5.999 18.347 -7.309 1.00 0.00 H new ATOM 0 HB3 SER A 52 -4.404 19.040 -7.532 1.00 0.00 H new ATOM 0 HG SER A 52 -6.073 20.364 -8.449 1.00 0.00 H new ATOM 855 N HIS A 53 -5.889 15.258 -8.220 1.00 0.00 N ATOM 856 CA HIS A 53 -6.940 14.246 -8.244 1.00 0.00 C ATOM 857 C HIS A 53 -6.606 13.095 -7.298 1.00 0.00 C ATOM 858 O HIS A 53 -7.131 13.020 -6.188 1.00 0.00 O ATOM 859 CB HIS A 53 -7.137 13.717 -9.667 1.00 0.00 C ATOM 860 CG HIS A 53 -8.280 14.359 -10.391 1.00 0.00 C ATOM 861 ND1 HIS A 53 -8.302 15.137 -11.500 1.00 0.00 N flip ATOM 862 CD2 HIS A 53 -9.592 14.233 -9.987 1.00 0.00 C flip ATOM 863 CE1 HIS A 53 -9.614 15.462 -11.741 1.00 0.00 C flip ATOM 864 NE2 HIS A 53 -10.372 14.904 -10.816 1.00 0.00 N flip ATOM 0 H HIS A 53 -5.095 15.027 -7.623 1.00 0.00 H new ATOM 0 HA HIS A 53 -7.867 14.710 -7.908 1.00 0.00 H new ATOM 0 HB2 HIS A 53 -6.221 13.878 -10.236 1.00 0.00 H new ATOM 0 HB3 HIS A 53 -7.302 12.640 -9.626 1.00 0.00 H new ATOM 0 HD2 HIS A 53 -9.930 13.673 -9.127 1.00 0.00 H new ATOM 0 HE1 HIS A 53 -9.969 16.075 -12.556 1.00 0.00 H new ATOM 0 HE2 HIS A 53 -11.387 14.978 -10.752 1.00 0.00 H new ATOM 873 N LEU A 54 -5.729 12.202 -7.746 1.00 0.00 N ATOM 874 CA LEU A 54 -5.323 11.057 -6.939 1.00 0.00 C ATOM 875 C LEU A 54 -4.002 11.338 -6.229 1.00 0.00 C ATOM 876 O LEU A 54 -3.830 11.001 -5.058 1.00 0.00 O ATOM 877 CB LEU A 54 -5.195 9.810 -7.815 1.00 0.00 C ATOM 878 CG LEU A 54 -4.868 8.521 -7.061 1.00 0.00 C ATOM 879 CD1 LEU A 54 -5.621 7.343 -7.662 1.00 0.00 C ATOM 880 CD2 LEU A 54 -3.369 8.261 -7.075 1.00 0.00 C ATOM 0 H LEU A 54 -5.286 12.249 -8.664 1.00 0.00 H new ATOM 0 HA LEU A 54 -6.090 10.881 -6.184 1.00 0.00 H new ATOM 0 HB2 LEU A 54 -6.130 9.668 -8.358 1.00 0.00 H new ATOM 0 HB3 LEU A 54 -4.418 9.985 -8.559 1.00 0.00 H new ATOM 0 HG LEU A 54 -5.187 8.638 -6.025 1.00 0.00 H new ATOM 0 HD11 LEU A 54 -5.375 6.435 -7.112 1.00 0.00 H new ATOM 0 HD12 LEU A 54 -6.694 7.526 -7.599 1.00 0.00 H new ATOM 0 HD13 LEU A 54 -5.335 7.223 -8.707 1.00 0.00 H new ATOM 0 HD21 LEU A 54 -3.154 7.340 -6.534 1.00 0.00 H new ATOM 0 HD22 LEU A 54 -3.026 8.165 -8.105 1.00 0.00 H new ATOM 0 HD23 LEU A 54 -2.851 9.092 -6.596 1.00 0.00 H new ATOM 892 N CYS A 55 -3.077 11.968 -6.947 1.00 0.00 N ATOM 893 CA CYS A 55 -1.773 12.309 -6.390 1.00 0.00 C ATOM 894 C CYS A 55 -1.683 13.813 -6.139 1.00 0.00 C ATOM 895 O CYS A 55 -1.328 14.578 -7.036 1.00 0.00 O ATOM 896 CB CYS A 55 -0.655 11.870 -7.338 1.00 0.00 C ATOM 897 SG CYS A 55 -0.888 12.402 -9.051 1.00 0.00 S ATOM 0 H CYS A 55 -3.207 12.253 -7.918 1.00 0.00 H new ATOM 0 HA CYS A 55 -1.655 11.784 -5.442 1.00 0.00 H new ATOM 0 HB2 CYS A 55 0.293 12.265 -6.972 1.00 0.00 H new ATOM 0 HB3 CYS A 55 -0.578 10.783 -7.314 1.00 0.00 H new ATOM 0 HG CYS A 55 -1.171 13.671 -9.077 1.00 0.00 H new ATOM 903 N PRO A 56 -2.024 14.261 -4.918 1.00 0.00 N ATOM 904 CA PRO A 56 -1.998 15.682 -4.567 1.00 0.00 C ATOM 905 C PRO A 56 -0.596 16.205 -4.271 1.00 0.00 C ATOM 906 O PRO A 56 0.154 15.608 -3.498 1.00 0.00 O ATOM 907 CB PRO A 56 -2.863 15.739 -3.310 1.00 0.00 C ATOM 908 CG PRO A 56 -2.678 14.408 -2.668 1.00 0.00 C ATOM 909 CD PRO A 56 -2.481 13.422 -3.791 1.00 0.00 C ATOM 0 HA PRO A 56 -2.352 16.306 -5.388 1.00 0.00 H new ATOM 0 HB2 PRO A 56 -2.548 16.546 -2.648 1.00 0.00 H new ATOM 0 HB3 PRO A 56 -3.909 15.919 -3.556 1.00 0.00 H new ATOM 0 HG2 PRO A 56 -1.816 14.414 -2.000 1.00 0.00 H new ATOM 0 HG3 PRO A 56 -3.546 14.143 -2.065 1.00 0.00 H new ATOM 0 HD2 PRO A 56 -1.743 12.663 -3.532 1.00 0.00 H new ATOM 0 HD3 PRO A 56 -3.406 12.898 -4.031 1.00 0.00 H new ATOM 917 N THR A 57 -0.262 17.338 -4.881 1.00 0.00 N ATOM 918 CA THR A 57 1.036 17.972 -4.683 1.00 0.00 C ATOM 919 C THR A 57 1.124 18.578 -3.312 1.00 0.00 C ATOM 920 O THR A 57 0.111 18.823 -2.657 1.00 0.00 O ATOM 921 CB THR A 57 1.255 19.102 -5.688 1.00 0.00 C ATOM 922 OG1 THR A 57 1.610 18.606 -6.967 1.00 0.00 O ATOM 923 CG2 THR A 57 2.317 20.106 -5.251 1.00 0.00 C ATOM 0 H THR A 57 -0.878 17.839 -5.521 1.00 0.00 H new ATOM 0 HA THR A 57 1.790 17.196 -4.814 1.00 0.00 H new ATOM 0 HB THR A 57 0.296 19.617 -5.738 1.00 0.00 H new ATOM 0 HG1 THR A 57 1.538 19.326 -7.628 1.00 0.00 H new ATOM 0 HG21 THR A 57 2.420 20.880 -6.011 1.00 0.00 H new ATOM 0 HG22 THR A 57 2.020 20.562 -4.307 1.00 0.00 H new ATOM 0 HG23 THR A 57 3.271 19.594 -5.122 1.00 0.00 H new ATOM 931 N ILE A 58 2.345 18.880 -2.907 1.00 0.00 N ATOM 932 CA ILE A 58 2.546 19.523 -1.653 1.00 0.00 C ATOM 933 C ILE A 58 3.347 20.800 -1.794 1.00 0.00 C ATOM 934 O ILE A 58 4.092 20.978 -2.754 1.00 0.00 O ATOM 935 CB ILE A 58 3.211 18.606 -0.603 1.00 0.00 C ATOM 936 CG1 ILE A 58 4.733 18.804 -0.547 1.00 0.00 C ATOM 937 CG2 ILE A 58 2.866 17.147 -0.850 1.00 0.00 C ATOM 938 CD1 ILE A 58 5.130 20.083 0.095 1.00 0.00 C ATOM 0 H ILE A 58 3.196 18.686 -3.435 1.00 0.00 H new ATOM 0 HA ILE A 58 1.547 19.770 -1.294 1.00 0.00 H new ATOM 0 HB ILE A 58 2.809 18.893 0.369 1.00 0.00 H new ATOM 0 HG12 ILE A 58 5.182 17.975 0.000 1.00 0.00 H new ATOM 0 HG13 ILE A 58 5.135 18.772 -1.560 1.00 0.00 H new ATOM 0 HG21 ILE A 58 3.348 16.526 -0.095 1.00 0.00 H new ATOM 0 HG22 ILE A 58 1.786 17.014 -0.793 1.00 0.00 H new ATOM 0 HG23 ILE A 58 3.216 16.853 -1.839 1.00 0.00 H new ATOM 0 HD11 ILE A 58 6.217 20.164 0.104 1.00 0.00 H new ATOM 0 HD12 ILE A 58 4.709 20.918 -0.466 1.00 0.00 H new ATOM 0 HD13 ILE A 58 4.756 20.108 1.119 1.00 0.00 H new ATOM 950 N HIS A 59 3.215 21.665 -0.795 1.00 0.00 N ATOM 951 CA HIS A 59 3.964 22.907 -0.757 1.00 0.00 C ATOM 952 C HIS A 59 4.582 23.125 0.619 1.00 0.00 C ATOM 953 O HIS A 59 4.009 23.815 1.461 1.00 0.00 O ATOM 954 CB HIS A 59 3.090 24.095 -1.106 1.00 0.00 C ATOM 955 CG HIS A 59 2.149 23.845 -2.244 1.00 0.00 C ATOM 956 ND1 HIS A 59 1.134 22.913 -2.191 1.00 0.00 N ATOM 957 CD2 HIS A 59 2.071 24.414 -3.470 1.00 0.00 C ATOM 958 CE1 HIS A 59 0.474 22.917 -3.335 1.00 0.00 C ATOM 959 NE2 HIS A 59 1.022 23.819 -4.128 1.00 0.00 N ATOM 0 H HIS A 59 2.593 21.524 0.001 1.00 0.00 H new ATOM 0 HA HIS A 59 4.756 22.825 -1.502 1.00 0.00 H new ATOM 0 HB2 HIS A 59 2.513 24.379 -0.226 1.00 0.00 H new ATOM 0 HB3 HIS A 59 3.729 24.942 -1.355 1.00 0.00 H new ATOM 0 HD1 HIS A 59 0.925 22.314 -1.392 1.00 0.00 H new ATOM 0 HD2 HIS A 59 2.713 25.191 -3.858 1.00 0.00 H new ATOM 0 HE1 HIS A 59 -0.370 22.289 -3.580 1.00 0.00 H new ATOM 968 N ILE A 60 5.752 22.552 0.841 1.00 0.00 N ATOM 969 CA ILE A 60 6.438 22.715 2.130 1.00 0.00 C ATOM 970 C ILE A 60 7.631 23.657 1.993 1.00 0.00 C ATOM 971 O ILE A 60 7.891 24.190 0.914 1.00 0.00 O ATOM 972 CB ILE A 60 6.918 21.376 2.755 1.00 0.00 C ATOM 973 CG1 ILE A 60 8.059 20.757 1.930 1.00 0.00 C ATOM 974 CG2 ILE A 60 5.751 20.401 2.943 1.00 0.00 C ATOM 975 CD1 ILE A 60 8.925 19.804 2.722 1.00 0.00 C ATOM 0 H ILE A 60 6.249 21.976 0.162 1.00 0.00 H new ATOM 0 HA ILE A 60 5.694 23.139 2.804 1.00 0.00 H new ATOM 0 HB ILE A 60 7.317 21.591 3.746 1.00 0.00 H new ATOM 0 HG12 ILE A 60 7.635 20.227 1.077 1.00 0.00 H new ATOM 0 HG13 ILE A 60 8.683 21.556 1.530 1.00 0.00 H new ATOM 0 HG21 ILE A 60 6.119 19.474 3.382 1.00 0.00 H new ATOM 0 HG22 ILE A 60 5.008 20.846 3.605 1.00 0.00 H new ATOM 0 HG23 ILE A 60 5.295 20.189 1.976 1.00 0.00 H new ATOM 0 HD11 ILE A 60 9.709 19.405 2.079 1.00 0.00 H new ATOM 0 HD12 ILE A 60 9.378 20.334 3.560 1.00 0.00 H new ATOM 0 HD13 ILE A 60 8.313 18.985 3.100 1.00 0.00 H new ATOM 987 N ASP A 61 8.355 23.857 3.092 1.00 0.00 N ATOM 988 CA ASP A 61 9.522 24.735 3.088 1.00 0.00 C ATOM 989 C ASP A 61 10.497 24.333 1.988 1.00 0.00 C ATOM 990 O ASP A 61 11.050 25.184 1.292 1.00 0.00 O ATOM 991 CB ASP A 61 10.222 24.698 4.448 1.00 0.00 C ATOM 992 CG ASP A 61 11.006 25.965 4.729 1.00 0.00 C ATOM 993 OD1 ASP A 61 12.083 26.144 4.122 1.00 0.00 O ATOM 994 OD2 ASP A 61 10.543 26.779 5.556 1.00 0.00 O ATOM 0 H ASP A 61 8.155 23.424 3.994 1.00 0.00 H new ATOM 0 HA ASP A 61 9.181 25.752 2.894 1.00 0.00 H new ATOM 0 HB2 ASP A 61 9.479 24.552 5.232 1.00 0.00 H new ATOM 0 HB3 ASP A 61 10.895 23.842 4.484 1.00 0.00 H new ATOM 999 N GLU A 62 10.690 23.030 1.829 1.00 0.00 N ATOM 1000 CA GLU A 62 11.585 22.509 0.803 1.00 0.00 C ATOM 1001 C GLU A 62 11.085 22.884 -0.592 1.00 0.00 C ATOM 1002 O GLU A 62 11.823 22.788 -1.572 1.00 0.00 O ATOM 1003 CB GLU A 62 11.698 20.986 0.920 1.00 0.00 C ATOM 1004 CG GLU A 62 12.533 20.515 2.103 1.00 0.00 C ATOM 1005 CD GLU A 62 12.180 21.224 3.397 1.00 0.00 C ATOM 1006 OE1 GLU A 62 12.536 22.413 3.538 1.00 0.00 O ATOM 1007 OE2 GLU A 62 11.550 20.590 4.270 1.00 0.00 O ATOM 0 H GLU A 62 10.239 22.314 2.398 1.00 0.00 H new ATOM 0 HA GLU A 62 12.569 22.953 0.953 1.00 0.00 H new ATOM 0 HB2 GLU A 62 10.697 20.563 1.004 1.00 0.00 H new ATOM 0 HB3 GLU A 62 12.134 20.593 0.002 1.00 0.00 H new ATOM 0 HG2 GLU A 62 12.395 19.442 2.234 1.00 0.00 H new ATOM 0 HG3 GLU A 62 13.588 20.676 1.883 1.00 0.00 H new ATOM 1014 N GLY A 63 9.824 23.306 -0.674 1.00 0.00 N ATOM 1015 CA GLY A 63 9.245 23.682 -1.950 1.00 0.00 C ATOM 1016 C GLY A 63 7.909 23.008 -2.192 1.00 0.00 C ATOM 1017 O GLY A 63 6.901 23.383 -1.595 1.00 0.00 O ATOM 0 H GLY A 63 9.194 23.394 0.123 1.00 0.00 H new ATOM 0 HA2 GLY A 63 9.116 24.764 -1.984 1.00 0.00 H new ATOM 0 HA3 GLY A 63 9.934 23.418 -2.752 1.00 0.00 H new ATOM 1021 N ASP A 64 7.905 22.007 -3.065 1.00 0.00 N ATOM 1022 CA ASP A 64 6.687 21.271 -3.383 1.00 0.00 C ATOM 1023 C ASP A 64 7.011 19.828 -3.741 1.00 0.00 C ATOM 1024 O ASP A 64 8.144 19.504 -4.093 1.00 0.00 O ATOM 1025 CB ASP A 64 5.943 21.944 -4.537 1.00 0.00 C ATOM 1026 CG ASP A 64 6.784 22.028 -5.796 1.00 0.00 C ATOM 1027 OD1 ASP A 64 7.346 20.990 -6.205 1.00 0.00 O ATOM 1028 OD2 ASP A 64 6.881 23.131 -6.372 1.00 0.00 O ATOM 0 H ASP A 64 8.733 21.686 -3.566 1.00 0.00 H new ATOM 0 HA ASP A 64 6.046 21.275 -2.502 1.00 0.00 H new ATOM 0 HB2 ASP A 64 5.030 21.389 -4.750 1.00 0.00 H new ATOM 0 HB3 ASP A 64 5.643 22.948 -4.236 1.00 0.00 H new ATOM 1033 N PHE A 65 6.009 18.968 -3.630 1.00 0.00 N ATOM 1034 CA PHE A 65 6.168 17.549 -3.913 1.00 0.00 C ATOM 1035 C PHE A 65 4.845 16.958 -4.393 1.00 0.00 C ATOM 1036 O PHE A 65 3.892 17.701 -4.614 1.00 0.00 O ATOM 1037 CB PHE A 65 6.693 16.850 -2.662 1.00 0.00 C ATOM 1038 CG PHE A 65 7.982 17.454 -2.185 1.00 0.00 C ATOM 1039 CD1 PHE A 65 9.129 17.353 -2.953 1.00 0.00 C ATOM 1040 CD2 PHE A 65 8.041 18.149 -0.988 1.00 0.00 C ATOM 1041 CE1 PHE A 65 10.312 17.928 -2.537 1.00 0.00 C ATOM 1042 CE2 PHE A 65 9.223 18.729 -0.568 1.00 0.00 C ATOM 1043 CZ PHE A 65 10.360 18.618 -1.343 1.00 0.00 C ATOM 0 H PHE A 65 5.067 19.233 -3.343 1.00 0.00 H new ATOM 0 HA PHE A 65 6.892 17.401 -4.714 1.00 0.00 H new ATOM 0 HB2 PHE A 65 5.947 16.914 -1.870 1.00 0.00 H new ATOM 0 HB3 PHE A 65 6.844 15.791 -2.873 1.00 0.00 H new ATOM 0 HD1 PHE A 65 9.097 16.817 -3.890 1.00 0.00 H new ATOM 0 HD2 PHE A 65 7.155 18.238 -0.377 1.00 0.00 H new ATOM 0 HE1 PHE A 65 11.200 17.838 -3.145 1.00 0.00 H new ATOM 0 HE2 PHE A 65 9.257 19.269 0.367 1.00 0.00 H new ATOM 0 HZ PHE A 65 11.285 19.070 -1.016 1.00 0.00 H new ATOM 1053 N ILE A 66 4.769 15.639 -4.577 1.00 0.00 N ATOM 1054 CA ILE A 66 3.527 15.040 -5.054 1.00 0.00 C ATOM 1055 C ILE A 66 3.314 13.645 -4.495 1.00 0.00 C ATOM 1056 O ILE A 66 4.122 12.742 -4.709 1.00 0.00 O ATOM 1057 CB ILE A 66 3.448 14.977 -6.599 1.00 0.00 C ATOM 1058 CG1 ILE A 66 4.827 15.145 -7.224 1.00 0.00 C ATOM 1059 CG2 ILE A 66 2.500 16.038 -7.121 1.00 0.00 C ATOM 1060 CD1 ILE A 66 5.780 14.052 -6.825 1.00 0.00 C ATOM 0 H ILE A 66 5.531 14.983 -4.408 1.00 0.00 H new ATOM 0 HA ILE A 66 2.737 15.698 -4.692 1.00 0.00 H new ATOM 0 HB ILE A 66 3.066 13.995 -6.879 1.00 0.00 H new ATOM 0 HG12 ILE A 66 4.730 15.159 -8.310 1.00 0.00 H new ATOM 0 HG13 ILE A 66 5.241 16.109 -6.928 1.00 0.00 H new ATOM 0 HG21 ILE A 66 2.454 15.982 -8.209 1.00 0.00 H new ATOM 0 HG22 ILE A 66 1.505 15.873 -6.707 1.00 0.00 H new ATOM 0 HG23 ILE A 66 2.858 17.024 -6.823 1.00 0.00 H new ATOM 0 HD11 ILE A 66 6.747 14.221 -7.299 1.00 0.00 H new ATOM 0 HD12 ILE A 66 5.902 14.053 -5.742 1.00 0.00 H new ATOM 0 HD13 ILE A 66 5.383 13.089 -7.145 1.00 0.00 H new ATOM 1072 N MET A 67 2.206 13.476 -3.790 1.00 0.00 N ATOM 1073 CA MET A 67 1.860 12.196 -3.211 1.00 0.00 C ATOM 1074 C MET A 67 1.724 11.145 -4.306 1.00 0.00 C ATOM 1075 O MET A 67 0.790 11.194 -5.106 1.00 0.00 O ATOM 1076 CB MET A 67 0.543 12.332 -2.447 1.00 0.00 C ATOM 1077 CG MET A 67 0.722 12.527 -0.955 1.00 0.00 C ATOM 1078 SD MET A 67 1.294 14.185 -0.535 1.00 0.00 S ATOM 1079 CE MET A 67 -0.258 14.992 -0.153 1.00 0.00 C ATOM 0 H MET A 67 1.530 14.217 -3.607 1.00 0.00 H new ATOM 0 HA MET A 67 2.648 11.882 -2.526 1.00 0.00 H new ATOM 0 HB2 MET A 67 -0.015 13.177 -2.851 1.00 0.00 H new ATOM 0 HB3 MET A 67 -0.060 11.440 -2.618 1.00 0.00 H new ATOM 0 HG2 MET A 67 -0.225 12.335 -0.451 1.00 0.00 H new ATOM 0 HG3 MET A 67 1.437 11.794 -0.580 1.00 0.00 H new ATOM 0 HE1 MET A 67 -0.126 15.643 0.711 1.00 0.00 H new ATOM 0 HE2 MET A 67 -0.580 15.585 -1.009 1.00 0.00 H new ATOM 0 HE3 MET A 67 -1.014 14.239 0.072 1.00 0.00 H new ATOM 1089 N LEU A 68 2.650 10.193 -4.341 1.00 0.00 N ATOM 1090 CA LEU A 68 2.597 9.142 -5.352 1.00 0.00 C ATOM 1091 C LEU A 68 1.750 7.978 -4.860 1.00 0.00 C ATOM 1092 O LEU A 68 2.272 6.943 -4.450 1.00 0.00 O ATOM 1093 CB LEU A 68 4.002 8.647 -5.722 1.00 0.00 C ATOM 1094 CG LEU A 68 4.227 8.397 -7.214 1.00 0.00 C ATOM 1095 CD1 LEU A 68 3.875 9.637 -8.022 1.00 0.00 C ATOM 1096 CD2 LEU A 68 5.669 7.984 -7.471 1.00 0.00 C ATOM 0 H LEU A 68 3.435 10.126 -3.693 1.00 0.00 H new ATOM 0 HA LEU A 68 2.141 9.566 -6.247 1.00 0.00 H new ATOM 0 HB2 LEU A 68 4.732 9.380 -5.378 1.00 0.00 H new ATOM 0 HB3 LEU A 68 4.199 7.722 -5.180 1.00 0.00 H new ATOM 0 HG LEU A 68 3.573 7.584 -7.531 1.00 0.00 H new ATOM 0 HD11 LEU A 68 4.041 9.440 -9.081 1.00 0.00 H new ATOM 0 HD12 LEU A 68 2.828 9.891 -7.860 1.00 0.00 H new ATOM 0 HD13 LEU A 68 4.504 10.469 -7.704 1.00 0.00 H new ATOM 0 HD21 LEU A 68 5.813 7.810 -8.537 1.00 0.00 H new ATOM 0 HD22 LEU A 68 6.339 8.777 -7.139 1.00 0.00 H new ATOM 0 HD23 LEU A 68 5.889 7.069 -6.921 1.00 0.00 H new ATOM 1108 N THR A 69 0.437 8.152 -4.912 1.00 0.00 N ATOM 1109 CA THR A 69 -0.481 7.110 -4.479 1.00 0.00 C ATOM 1110 C THR A 69 -0.657 6.061 -5.573 1.00 0.00 C ATOM 1111 O THR A 69 -1.290 5.027 -5.358 1.00 0.00 O ATOM 1112 CB THR A 69 -1.833 7.713 -4.097 1.00 0.00 C ATOM 1113 OG1 THR A 69 -1.773 9.129 -4.098 1.00 0.00 O ATOM 1114 CG2 THR A 69 -2.318 7.275 -2.728 1.00 0.00 C ATOM 0 H THR A 69 -0.015 9.002 -5.249 1.00 0.00 H new ATOM 0 HA THR A 69 -0.057 6.624 -3.600 1.00 0.00 H new ATOM 0 HB THR A 69 -2.533 7.349 -4.849 1.00 0.00 H new ATOM 0 HG1 THR A 69 -2.600 9.491 -4.478 1.00 0.00 H new ATOM 0 HG21 THR A 69 -3.282 7.738 -2.518 1.00 0.00 H new ATOM 0 HG22 THR A 69 -2.425 6.190 -2.710 1.00 0.00 H new ATOM 0 HG23 THR A 69 -1.596 7.581 -1.971 1.00 0.00 H new ATOM 1122 N GLN A 70 -0.081 6.328 -6.744 1.00 0.00 N ATOM 1123 CA GLN A 70 -0.163 5.401 -7.862 1.00 0.00 C ATOM 1124 C GLN A 70 0.477 4.064 -7.500 1.00 0.00 C ATOM 1125 O GLN A 70 0.242 3.055 -8.164 1.00 0.00 O ATOM 1126 CB GLN A 70 0.523 5.992 -9.095 1.00 0.00 C ATOM 1127 CG GLN A 70 -0.204 7.193 -9.678 1.00 0.00 C ATOM 1128 CD GLN A 70 -0.091 7.265 -11.189 1.00 0.00 C ATOM 1129 OE1 GLN A 70 0.932 7.689 -11.727 1.00 0.00 O ATOM 1130 NE2 GLN A 70 -1.145 6.851 -11.882 1.00 0.00 N ATOM 0 H GLN A 70 0.446 7.179 -6.939 1.00 0.00 H new ATOM 0 HA GLN A 70 -1.216 5.233 -8.090 1.00 0.00 H new ATOM 0 HB2 GLN A 70 1.539 6.286 -8.830 1.00 0.00 H new ATOM 0 HB3 GLN A 70 0.604 5.220 -9.860 1.00 0.00 H new ATOM 0 HG2 GLN A 70 -1.256 7.148 -9.398 1.00 0.00 H new ATOM 0 HG3 GLN A 70 0.203 8.106 -9.243 1.00 0.00 H new ATOM 0 HE21 GLN A 70 -1.973 6.507 -11.395 1.00 0.00 H new ATOM 0 HE22 GLN A 70 -1.127 6.877 -12.902 1.00 0.00 H new ATOM 1139 N GLN A 71 1.280 4.059 -6.435 1.00 0.00 N ATOM 1140 CA GLN A 71 1.936 2.841 -5.986 1.00 0.00 C ATOM 1141 C GLN A 71 1.483 2.506 -4.577 1.00 0.00 C ATOM 1142 O GLN A 71 1.063 1.384 -4.300 1.00 0.00 O ATOM 1143 CB GLN A 71 3.457 3.002 -6.028 1.00 0.00 C ATOM 1144 CG GLN A 71 3.983 3.461 -7.378 1.00 0.00 C ATOM 1145 CD GLN A 71 5.227 4.318 -7.258 1.00 0.00 C ATOM 1146 OE1 GLN A 71 5.685 4.618 -6.155 1.00 0.00 O ATOM 1147 NE2 GLN A 71 5.783 4.718 -8.396 1.00 0.00 N ATOM 0 H GLN A 71 1.488 4.884 -5.872 1.00 0.00 H new ATOM 0 HA GLN A 71 1.660 2.026 -6.655 1.00 0.00 H new ATOM 0 HB2 GLN A 71 3.759 3.721 -5.266 1.00 0.00 H new ATOM 0 HB3 GLN A 71 3.922 2.050 -5.771 1.00 0.00 H new ATOM 0 HG2 GLN A 71 4.205 2.589 -7.993 1.00 0.00 H new ATOM 0 HG3 GLN A 71 3.206 4.025 -7.894 1.00 0.00 H new ATOM 0 HE21 GLN A 71 5.370 4.446 -9.288 1.00 0.00 H new ATOM 0 HE22 GLN A 71 6.623 5.297 -8.378 1.00 0.00 H new ATOM 1156 N MET A 72 1.555 3.499 -3.695 1.00 0.00 N ATOM 1157 CA MET A 72 1.138 3.333 -2.308 1.00 0.00 C ATOM 1158 C MET A 72 1.678 2.031 -1.718 1.00 0.00 C ATOM 1159 O MET A 72 1.182 0.946 -2.018 1.00 0.00 O ATOM 1160 CB MET A 72 -0.386 3.370 -2.223 1.00 0.00 C ATOM 1161 CG MET A 72 -0.898 3.511 -0.799 1.00 0.00 C ATOM 1162 SD MET A 72 -1.799 5.049 -0.527 1.00 0.00 S ATOM 1163 CE MET A 72 -3.473 4.529 -0.894 1.00 0.00 C ATOM 0 H MET A 72 1.901 4.432 -3.919 1.00 0.00 H new ATOM 0 HA MET A 72 1.551 4.154 -1.722 1.00 0.00 H new ATOM 0 HB2 MET A 72 -0.758 4.202 -2.821 1.00 0.00 H new ATOM 0 HB3 MET A 72 -0.791 2.457 -2.660 1.00 0.00 H new ATOM 0 HG2 MET A 72 -1.549 2.668 -0.567 1.00 0.00 H new ATOM 0 HG3 MET A 72 -0.056 3.462 -0.109 1.00 0.00 H new ATOM 0 HE1 MET A 72 -4.178 5.219 -0.430 1.00 0.00 H new ATOM 0 HE2 MET A 72 -3.625 4.526 -1.973 1.00 0.00 H new ATOM 0 HE3 MET A 72 -3.636 3.525 -0.502 1.00 0.00 H new ATOM 1173 N THR A 73 2.706 2.148 -0.886 1.00 0.00 N ATOM 1174 CA THR A 73 3.328 0.979 -0.269 1.00 0.00 C ATOM 1175 C THR A 73 3.768 1.272 1.163 1.00 0.00 C ATOM 1176 O THR A 73 4.320 2.332 1.441 1.00 0.00 O ATOM 1177 CB THR A 73 4.534 0.540 -1.101 1.00 0.00 C ATOM 1178 OG1 THR A 73 5.348 -0.359 -0.369 1.00 0.00 O ATOM 1179 CG2 THR A 73 5.411 1.697 -1.545 1.00 0.00 C ATOM 0 H THR A 73 3.127 3.039 -0.622 1.00 0.00 H new ATOM 0 HA THR A 73 2.589 0.178 -0.237 1.00 0.00 H new ATOM 0 HB THR A 73 4.115 0.062 -1.986 1.00 0.00 H new ATOM 0 HG1 THR A 73 6.113 -0.629 -0.919 1.00 0.00 H new ATOM 0 HG21 THR A 73 6.248 1.316 -2.130 1.00 0.00 H new ATOM 0 HG22 THR A 73 4.825 2.385 -2.155 1.00 0.00 H new ATOM 0 HG23 THR A 73 5.791 2.223 -0.669 1.00 0.00 H new ATOM 1187 N SER A 74 3.528 0.322 2.066 1.00 0.00 N ATOM 1188 CA SER A 74 3.908 0.488 3.468 1.00 0.00 C ATOM 1189 C SER A 74 5.422 0.431 3.636 1.00 0.00 C ATOM 1190 O SER A 74 6.096 -0.416 3.049 1.00 0.00 O ATOM 1191 CB SER A 74 3.240 -0.578 4.341 1.00 0.00 C ATOM 1192 OG SER A 74 2.155 -1.187 3.663 1.00 0.00 O ATOM 0 H SER A 74 3.074 -0.566 1.853 1.00 0.00 H new ATOM 0 HA SER A 74 3.564 1.470 3.791 1.00 0.00 H new ATOM 0 HB2 SER A 74 3.972 -1.337 4.617 1.00 0.00 H new ATOM 0 HB3 SER A 74 2.886 -0.125 5.267 1.00 0.00 H new ATOM 0 HG SER A 74 1.747 -1.865 4.241 1.00 0.00 H new ATOM 1198 N VAL A 75 5.944 1.347 4.441 1.00 0.00 N ATOM 1199 CA VAL A 75 7.378 1.427 4.702 1.00 0.00 C ATOM 1200 C VAL A 75 7.683 0.989 6.131 1.00 0.00 C ATOM 1201 O VAL A 75 7.465 1.741 7.075 1.00 0.00 O ATOM 1202 CB VAL A 75 7.911 2.865 4.452 1.00 0.00 C ATOM 1203 CG1 VAL A 75 6.877 3.904 4.855 1.00 0.00 C ATOM 1204 CG2 VAL A 75 9.228 3.134 5.172 1.00 0.00 C ATOM 0 H VAL A 75 5.391 2.052 4.929 1.00 0.00 H new ATOM 0 HA VAL A 75 7.886 0.753 4.012 1.00 0.00 H new ATOM 0 HB VAL A 75 8.101 2.943 3.382 1.00 0.00 H new ATOM 0 HG11 VAL A 75 7.273 4.902 4.671 1.00 0.00 H new ATOM 0 HG12 VAL A 75 5.969 3.760 4.269 1.00 0.00 H new ATOM 0 HG13 VAL A 75 6.646 3.795 5.915 1.00 0.00 H new ATOM 0 HG21 VAL A 75 9.555 4.153 4.963 1.00 0.00 H new ATOM 0 HG22 VAL A 75 9.087 3.011 6.246 1.00 0.00 H new ATOM 0 HG23 VAL A 75 9.984 2.431 4.822 1.00 0.00 H new ATOM 1214 N PRO A 76 8.190 -0.241 6.307 1.00 0.00 N ATOM 1215 CA PRO A 76 8.522 -0.776 7.631 1.00 0.00 C ATOM 1216 C PRO A 76 9.324 0.207 8.484 1.00 0.00 C ATOM 1217 O PRO A 76 10.303 0.792 8.022 1.00 0.00 O ATOM 1218 CB PRO A 76 9.358 -2.012 7.303 1.00 0.00 C ATOM 1219 CG PRO A 76 8.858 -2.460 5.974 1.00 0.00 C ATOM 1220 CD PRO A 76 8.474 -1.210 5.231 1.00 0.00 C ATOM 0 HA PRO A 76 7.630 -0.986 8.222 1.00 0.00 H new ATOM 0 HB2 PRO A 76 10.421 -1.774 7.267 1.00 0.00 H new ATOM 0 HB3 PRO A 76 9.231 -2.789 8.057 1.00 0.00 H new ATOM 0 HG2 PRO A 76 9.627 -3.014 5.435 1.00 0.00 H new ATOM 0 HG3 PRO A 76 8.003 -3.127 6.084 1.00 0.00 H new ATOM 0 HD2 PRO A 76 9.280 -0.865 4.583 1.00 0.00 H new ATOM 0 HD3 PRO A 76 7.602 -1.372 4.597 1.00 0.00 H new ATOM 1228 N VAL A 77 8.887 0.377 9.733 1.00 0.00 N ATOM 1229 CA VAL A 77 9.533 1.284 10.692 1.00 0.00 C ATOM 1230 C VAL A 77 11.043 1.403 10.475 1.00 0.00 C ATOM 1231 O VAL A 77 11.595 2.503 10.503 1.00 0.00 O ATOM 1232 CB VAL A 77 9.279 0.821 12.141 1.00 0.00 C ATOM 1233 CG1 VAL A 77 9.886 -0.554 12.379 1.00 0.00 C ATOM 1234 CG2 VAL A 77 9.830 1.835 13.134 1.00 0.00 C ATOM 0 H VAL A 77 8.074 -0.110 10.112 1.00 0.00 H new ATOM 0 HA VAL A 77 9.087 2.264 10.523 1.00 0.00 H new ATOM 0 HB VAL A 77 8.202 0.748 12.293 1.00 0.00 H new ATOM 0 HG11 VAL A 77 9.696 -0.863 13.407 1.00 0.00 H new ATOM 0 HG12 VAL A 77 9.436 -1.274 11.695 1.00 0.00 H new ATOM 0 HG13 VAL A 77 10.961 -0.512 12.206 1.00 0.00 H new ATOM 0 HG21 VAL A 77 9.640 1.489 14.150 1.00 0.00 H new ATOM 0 HG22 VAL A 77 10.904 1.946 12.983 1.00 0.00 H new ATOM 0 HG23 VAL A 77 9.341 2.797 12.981 1.00 0.00 H new ATOM 1244 N LYS A 78 11.705 0.266 10.277 1.00 0.00 N ATOM 1245 CA LYS A 78 13.160 0.244 10.074 1.00 0.00 C ATOM 1246 C LYS A 78 13.615 1.350 9.144 1.00 0.00 C ATOM 1247 O LYS A 78 14.449 2.184 9.495 1.00 0.00 O ATOM 1248 CB LYS A 78 13.639 -1.071 9.462 1.00 0.00 C ATOM 1249 CG LYS A 78 12.525 -1.942 8.942 1.00 0.00 C ATOM 1250 CD LYS A 78 11.949 -2.795 10.057 1.00 0.00 C ATOM 1251 CE LYS A 78 12.542 -4.195 10.056 1.00 0.00 C ATOM 1252 NZ LYS A 78 11.624 -5.186 9.431 1.00 0.00 N ATOM 0 H LYS A 78 11.263 -0.653 10.252 1.00 0.00 H new ATOM 0 HA LYS A 78 13.587 0.375 11.068 1.00 0.00 H new ATOM 0 HB2 LYS A 78 14.327 -0.851 8.646 1.00 0.00 H new ATOM 0 HB3 LYS A 78 14.202 -1.626 10.212 1.00 0.00 H new ATOM 0 HG2 LYS A 78 11.741 -1.320 8.511 1.00 0.00 H new ATOM 0 HG3 LYS A 78 12.899 -2.582 8.143 1.00 0.00 H new ATOM 0 HD2 LYS A 78 12.143 -2.318 11.018 1.00 0.00 H new ATOM 0 HD3 LYS A 78 10.867 -2.858 9.945 1.00 0.00 H new ATOM 0 HE2 LYS A 78 13.489 -4.188 9.517 1.00 0.00 H new ATOM 0 HE3 LYS A 78 12.760 -4.498 11.080 1.00 0.00 H new ATOM 0 HZ1 LYS A 78 12.065 -6.128 9.450 1.00 0.00 H new ATOM 0 HZ2 LYS A 78 10.729 -5.212 9.960 1.00 0.00 H new ATOM 0 HZ3 LYS A 78 11.436 -4.912 8.446 1.00 0.00 H new ATOM 1266 N ILE A 79 13.077 1.310 7.937 1.00 0.00 N ATOM 1267 CA ILE A 79 13.436 2.267 6.911 1.00 0.00 C ATOM 1268 C ILE A 79 12.433 3.419 6.823 1.00 0.00 C ATOM 1269 O ILE A 79 12.312 4.058 5.780 1.00 0.00 O ATOM 1270 CB ILE A 79 13.571 1.596 5.519 1.00 0.00 C ATOM 1271 CG1 ILE A 79 12.642 0.380 5.396 1.00 0.00 C ATOM 1272 CG2 ILE A 79 15.023 1.196 5.255 1.00 0.00 C ATOM 1273 CD1 ILE A 79 11.173 0.746 5.428 1.00 0.00 C ATOM 0 H ILE A 79 12.386 0.619 7.645 1.00 0.00 H new ATOM 0 HA ILE A 79 14.405 2.671 7.204 1.00 0.00 H new ATOM 0 HB ILE A 79 13.270 2.323 4.765 1.00 0.00 H new ATOM 0 HG12 ILE A 79 12.859 -0.142 4.464 1.00 0.00 H new ATOM 0 HG13 ILE A 79 12.854 -0.315 6.208 1.00 0.00 H new ATOM 0 HG21 ILE A 79 15.099 0.727 4.274 1.00 0.00 H new ATOM 0 HG22 ILE A 79 15.656 2.083 5.283 1.00 0.00 H new ATOM 0 HG23 ILE A 79 15.351 0.492 6.020 1.00 0.00 H new ATOM 0 HD11 ILE A 79 10.571 -0.158 5.337 1.00 0.00 H new ATOM 0 HD12 ILE A 79 10.942 1.242 6.371 1.00 0.00 H new ATOM 0 HD13 ILE A 79 10.947 1.417 4.600 1.00 0.00 H new ATOM 1285 N LEU A 80 11.711 3.672 7.919 1.00 0.00 N ATOM 1286 CA LEU A 80 10.710 4.744 7.963 1.00 0.00 C ATOM 1287 C LEU A 80 11.238 6.048 7.410 1.00 0.00 C ATOM 1288 O LEU A 80 11.669 6.929 8.152 1.00 0.00 O ATOM 1289 CB LEU A 80 10.195 4.955 9.386 1.00 0.00 C ATOM 1290 CG LEU A 80 9.014 5.932 9.524 1.00 0.00 C ATOM 1291 CD1 LEU A 80 8.312 6.160 8.185 1.00 0.00 C ATOM 1292 CD2 LEU A 80 8.027 5.419 10.564 1.00 0.00 C ATOM 0 H LEU A 80 11.801 3.148 8.790 1.00 0.00 H new ATOM 0 HA LEU A 80 9.885 4.423 7.327 1.00 0.00 H new ATOM 0 HB2 LEU A 80 9.895 3.989 9.792 1.00 0.00 H new ATOM 0 HB3 LEU A 80 11.018 5.318 10.002 1.00 0.00 H new ATOM 0 HG LEU A 80 9.411 6.892 9.854 1.00 0.00 H new ATOM 0 HD11 LEU A 80 7.484 6.855 8.322 1.00 0.00 H new ATOM 0 HD12 LEU A 80 9.021 6.576 7.469 1.00 0.00 H new ATOM 0 HD13 LEU A 80 7.931 5.211 7.808 1.00 0.00 H new ATOM 0 HD21 LEU A 80 7.196 6.118 10.653 1.00 0.00 H new ATOM 0 HD22 LEU A 80 7.649 4.444 10.257 1.00 0.00 H new ATOM 0 HD23 LEU A 80 8.529 5.327 11.527 1.00 0.00 H new ATOM 1304 N SER A 81 11.138 6.154 6.093 1.00 0.00 N ATOM 1305 CA SER A 81 11.527 7.335 5.341 1.00 0.00 C ATOM 1306 C SER A 81 12.236 8.383 6.192 1.00 0.00 C ATOM 1307 O SER A 81 11.601 9.062 6.998 1.00 0.00 O ATOM 1308 CB SER A 81 10.272 7.925 4.724 1.00 0.00 C ATOM 1309 OG SER A 81 9.107 7.366 5.308 1.00 0.00 O ATOM 0 H SER A 81 10.776 5.403 5.505 1.00 0.00 H new ATOM 0 HA SER A 81 12.245 7.035 4.578 1.00 0.00 H new ATOM 0 HB2 SER A 81 10.269 9.006 4.861 1.00 0.00 H new ATOM 0 HB3 SER A 81 10.269 7.740 3.650 1.00 0.00 H new ATOM 0 HG SER A 81 9.026 6.426 5.042 1.00 0.00 H new ATOM 1315 N GLU A 82 13.551 8.516 6.008 1.00 0.00 N ATOM 1316 CA GLU A 82 14.327 9.497 6.775 1.00 0.00 C ATOM 1317 C GLU A 82 13.576 10.828 6.887 1.00 0.00 C ATOM 1318 O GLU A 82 13.560 11.620 5.947 1.00 0.00 O ATOM 1319 CB GLU A 82 15.698 9.724 6.135 1.00 0.00 C ATOM 1320 CG GLU A 82 16.847 9.562 7.116 1.00 0.00 C ATOM 1321 CD GLU A 82 17.658 10.832 7.285 1.00 0.00 C ATOM 1322 OE1 GLU A 82 17.051 11.896 7.525 1.00 0.00 O ATOM 1323 OE2 GLU A 82 18.901 10.761 7.179 1.00 0.00 O ATOM 0 H GLU A 82 14.096 7.966 5.344 1.00 0.00 H new ATOM 0 HA GLU A 82 14.469 9.094 7.778 1.00 0.00 H new ATOM 0 HB2 GLU A 82 15.829 9.022 5.312 1.00 0.00 H new ATOM 0 HB3 GLU A 82 15.731 10.726 5.707 1.00 0.00 H new ATOM 0 HG2 GLU A 82 16.451 9.257 8.085 1.00 0.00 H new ATOM 0 HG3 GLU A 82 17.502 8.761 6.773 1.00 0.00 H new ATOM 1330 N PRO A 83 12.934 11.088 8.042 1.00 0.00 N ATOM 1331 CA PRO A 83 12.172 12.320 8.268 1.00 0.00 C ATOM 1332 C PRO A 83 12.869 13.573 7.748 1.00 0.00 C ATOM 1333 O PRO A 83 13.699 14.166 8.436 1.00 0.00 O ATOM 1334 CB PRO A 83 12.050 12.367 9.788 1.00 0.00 C ATOM 1335 CG PRO A 83 11.997 10.937 10.191 1.00 0.00 C ATOM 1336 CD PRO A 83 12.891 10.199 9.224 1.00 0.00 C ATOM 0 HA PRO A 83 11.221 12.307 7.736 1.00 0.00 H new ATOM 0 HB2 PRO A 83 12.900 12.878 10.241 1.00 0.00 H new ATOM 0 HB3 PRO A 83 11.153 12.903 10.100 1.00 0.00 H new ATOM 0 HG2 PRO A 83 12.341 10.808 11.217 1.00 0.00 H new ATOM 0 HG3 PRO A 83 10.976 10.557 10.147 1.00 0.00 H new ATOM 0 HD2 PRO A 83 13.885 10.038 9.641 1.00 0.00 H new ATOM 0 HD3 PRO A 83 12.487 9.218 8.973 1.00 0.00 H new ATOM 1344 N VAL A 84 12.505 13.982 6.537 1.00 0.00 N ATOM 1345 CA VAL A 84 13.073 15.180 5.931 1.00 0.00 C ATOM 1346 C VAL A 84 12.422 16.427 6.533 1.00 0.00 C ATOM 1347 O VAL A 84 13.080 17.441 6.767 1.00 0.00 O ATOM 1348 CB VAL A 84 12.857 15.198 4.406 1.00 0.00 C ATOM 1349 CG1 VAL A 84 11.381 15.030 4.069 1.00 0.00 C ATOM 1350 CG2 VAL A 84 13.406 16.481 3.798 1.00 0.00 C ATOM 0 H VAL A 84 11.819 13.501 5.956 1.00 0.00 H new ATOM 0 HA VAL A 84 14.144 15.175 6.134 1.00 0.00 H new ATOM 0 HB VAL A 84 13.402 14.358 3.976 1.00 0.00 H new ATOM 0 HG11 VAL A 84 11.251 15.046 2.987 1.00 0.00 H new ATOM 0 HG12 VAL A 84 11.024 14.079 4.464 1.00 0.00 H new ATOM 0 HG13 VAL A 84 10.811 15.845 4.515 1.00 0.00 H new ATOM 0 HG21 VAL A 84 13.243 16.472 2.720 1.00 0.00 H new ATOM 0 HG22 VAL A 84 12.895 17.339 4.235 1.00 0.00 H new ATOM 0 HG23 VAL A 84 14.474 16.552 4.002 1.00 0.00 H new ATOM 1360 N ASN A 85 11.111 16.330 6.772 1.00 0.00 N ATOM 1361 CA ASN A 85 10.328 17.429 7.338 1.00 0.00 C ATOM 1362 C ASN A 85 9.042 16.892 7.974 1.00 0.00 C ATOM 1363 O ASN A 85 8.988 15.733 8.383 1.00 0.00 O ATOM 1364 CB ASN A 85 9.998 18.452 6.247 1.00 0.00 C ATOM 1365 CG ASN A 85 10.090 19.880 6.748 1.00 0.00 C ATOM 1366 OD1 ASN A 85 11.062 20.260 7.402 1.00 0.00 O ATOM 1367 ND2 ASN A 85 9.075 20.681 6.443 1.00 0.00 N ATOM 0 H ASN A 85 10.565 15.490 6.579 1.00 0.00 H new ATOM 0 HA ASN A 85 10.917 17.920 8.113 1.00 0.00 H new ATOM 0 HB2 ASN A 85 10.682 18.319 5.409 1.00 0.00 H new ATOM 0 HB3 ASN A 85 8.992 18.266 5.870 1.00 0.00 H new ATOM 0 HD21 ASN A 85 9.081 21.653 6.753 1.00 0.00 H new ATOM 0 HD22 ASN A 85 8.290 20.324 5.899 1.00 0.00 H new ATOM 1374 N GLU A 86 8.004 17.729 8.048 1.00 0.00 N ATOM 1375 CA GLU A 86 6.731 17.322 8.624 1.00 0.00 C ATOM 1376 C GLU A 86 5.606 18.136 8.012 1.00 0.00 C ATOM 1377 O GLU A 86 5.687 19.363 7.947 1.00 0.00 O ATOM 1378 CB GLU A 86 6.734 17.509 10.143 1.00 0.00 C ATOM 1379 CG GLU A 86 7.857 16.771 10.853 1.00 0.00 C ATOM 1380 CD GLU A 86 9.151 17.562 10.878 1.00 0.00 C ATOM 1381 OE1 GLU A 86 9.092 18.801 10.732 1.00 0.00 O ATOM 1382 OE2 GLU A 86 10.222 16.942 11.044 1.00 0.00 O ATOM 0 H GLU A 86 8.026 18.693 7.714 1.00 0.00 H new ATOM 0 HA GLU A 86 6.579 16.265 8.406 1.00 0.00 H new ATOM 0 HB2 GLU A 86 6.813 18.573 10.368 1.00 0.00 H new ATOM 0 HB3 GLU A 86 5.779 17.168 10.543 1.00 0.00 H new ATOM 0 HG2 GLU A 86 7.551 16.549 11.875 1.00 0.00 H new ATOM 0 HG3 GLU A 86 8.029 15.816 10.357 1.00 0.00 H new ATOM 1389 N LEU A 87 4.555 17.462 7.558 1.00 0.00 N ATOM 1390 CA LEU A 87 3.437 18.171 6.955 1.00 0.00 C ATOM 1391 C LEU A 87 2.087 17.721 7.505 1.00 0.00 C ATOM 1392 O LEU A 87 1.240 17.188 6.787 1.00 0.00 O ATOM 1393 CB LEU A 87 3.434 18.042 5.448 1.00 0.00 C ATOM 1394 CG LEU A 87 4.169 16.840 4.884 1.00 0.00 C ATOM 1395 CD1 LEU A 87 3.676 15.570 5.566 1.00 0.00 C ATOM 1396 CD2 LEU A 87 3.971 16.786 3.375 1.00 0.00 C ATOM 0 H LEU A 87 4.455 16.448 7.595 1.00 0.00 H new ATOM 0 HA LEU A 87 3.580 19.218 7.222 1.00 0.00 H new ATOM 0 HB2 LEU A 87 2.399 18.003 5.108 1.00 0.00 H new ATOM 0 HB3 LEU A 87 3.875 18.945 5.025 1.00 0.00 H new ATOM 0 HG LEU A 87 5.238 16.928 5.080 1.00 0.00 H new ATOM 0 HD11 LEU A 87 4.206 14.709 5.159 1.00 0.00 H new ATOM 0 HD12 LEU A 87 3.862 15.637 6.638 1.00 0.00 H new ATOM 0 HD13 LEU A 87 2.607 15.454 5.390 1.00 0.00 H new ATOM 0 HD21 LEU A 87 4.499 15.923 2.969 1.00 0.00 H new ATOM 0 HD22 LEU A 87 2.908 16.700 3.150 1.00 0.00 H new ATOM 0 HD23 LEU A 87 4.364 17.697 2.924 1.00 0.00 H new ATOM 1408 N SER A 88 1.901 17.975 8.774 1.00 0.00 N ATOM 1409 CA SER A 88 0.659 17.652 9.474 1.00 0.00 C ATOM 1410 C SER A 88 -0.452 18.563 9.012 1.00 0.00 C ATOM 1411 O SER A 88 -1.576 18.128 8.830 1.00 0.00 O ATOM 1412 CB SER A 88 0.829 17.767 10.985 1.00 0.00 C ATOM 1413 OG SER A 88 1.925 18.601 11.316 1.00 0.00 O ATOM 0 H SER A 88 2.605 18.415 9.366 1.00 0.00 H new ATOM 0 HA SER A 88 0.401 16.620 9.238 1.00 0.00 H new ATOM 0 HB2 SER A 88 -0.083 18.169 11.427 1.00 0.00 H new ATOM 0 HB3 SER A 88 0.981 16.776 11.413 1.00 0.00 H new ATOM 0 HG SER A 88 2.010 18.658 12.291 1.00 0.00 H new ATOM 1419 N THR A 89 -0.128 19.828 8.793 1.00 0.00 N ATOM 1420 CA THR A 89 -1.116 20.780 8.313 1.00 0.00 C ATOM 1421 C THR A 89 -1.712 20.264 7.014 1.00 0.00 C ATOM 1422 O THR A 89 -2.829 20.615 6.633 1.00 0.00 O ATOM 1423 CB THR A 89 -0.460 22.133 8.080 1.00 0.00 C ATOM 1424 OG1 THR A 89 0.644 22.007 7.192 1.00 0.00 O ATOM 1425 CG2 THR A 89 0.038 22.763 9.360 1.00 0.00 C ATOM 0 H THR A 89 0.804 20.216 8.939 1.00 0.00 H new ATOM 0 HA THR A 89 -1.904 20.896 9.057 1.00 0.00 H new ATOM 0 HB THR A 89 -1.230 22.774 7.651 1.00 0.00 H new ATOM 0 HG1 THR A 89 1.053 22.886 7.052 1.00 0.00 H new ATOM 0 HG21 THR A 89 0.497 23.726 9.137 1.00 0.00 H new ATOM 0 HG22 THR A 89 -0.799 22.909 10.043 1.00 0.00 H new ATOM 0 HG23 THR A 89 0.775 22.109 9.825 1.00 0.00 H new ATOM 1433 N PHE A 90 -0.942 19.411 6.351 1.00 0.00 N ATOM 1434 CA PHE A 90 -1.351 18.805 5.098 1.00 0.00 C ATOM 1435 C PHE A 90 -1.998 17.440 5.348 1.00 0.00 C ATOM 1436 O PHE A 90 -2.302 16.705 4.409 1.00 0.00 O ATOM 1437 CB PHE A 90 -0.123 18.659 4.207 1.00 0.00 C ATOM 1438 CG PHE A 90 0.051 19.769 3.211 1.00 0.00 C ATOM 1439 CD1 PHE A 90 -0.489 21.026 3.442 1.00 0.00 C ATOM 1440 CD2 PHE A 90 0.767 19.560 2.046 1.00 0.00 C ATOM 1441 CE1 PHE A 90 -0.314 22.046 2.528 1.00 0.00 C ATOM 1442 CE2 PHE A 90 0.939 20.567 1.137 1.00 0.00 C ATOM 1443 CZ PHE A 90 0.402 21.814 1.371 1.00 0.00 C ATOM 0 H PHE A 90 -0.017 19.122 6.670 1.00 0.00 H new ATOM 0 HA PHE A 90 -2.090 19.438 4.606 1.00 0.00 H new ATOM 0 HB2 PHE A 90 0.765 18.609 4.837 1.00 0.00 H new ATOM 0 HB3 PHE A 90 -0.187 17.712 3.671 1.00 0.00 H new ATOM 0 HD1 PHE A 90 -1.052 21.208 4.346 1.00 0.00 H new ATOM 0 HD2 PHE A 90 1.196 18.588 1.852 1.00 0.00 H new ATOM 0 HE1 PHE A 90 -0.736 23.022 2.718 1.00 0.00 H new ATOM 0 HE2 PHE A 90 1.498 20.384 0.231 1.00 0.00 H new ATOM 0 HZ PHE A 90 0.541 22.607 0.651 1.00 0.00 H new ATOM 1453 N ARG A 91 -2.196 17.110 6.627 1.00 0.00 N ATOM 1454 CA ARG A 91 -2.797 15.838 7.025 1.00 0.00 C ATOM 1455 C ARG A 91 -3.991 15.466 6.153 1.00 0.00 C ATOM 1456 O ARG A 91 -4.057 14.355 5.632 1.00 0.00 O ATOM 1457 CB ARG A 91 -3.226 15.882 8.483 1.00 0.00 C ATOM 1458 CG ARG A 91 -3.935 17.159 8.802 1.00 0.00 C ATOM 1459 CD ARG A 91 -3.773 17.570 10.258 1.00 0.00 C ATOM 1460 NE ARG A 91 -5.061 17.734 10.928 1.00 0.00 N ATOM 1461 CZ ARG A 91 -5.200 17.854 12.246 1.00 0.00 C ATOM 1462 NH1 ARG A 91 -4.136 17.828 13.039 1.00 0.00 N ATOM 1463 NH2 ARG A 91 -6.408 18.000 12.774 1.00 0.00 N ATOM 0 H ARG A 91 -1.945 17.714 7.410 1.00 0.00 H new ATOM 0 HA ARG A 91 -2.033 15.073 6.891 1.00 0.00 H new ATOM 0 HB2 ARG A 91 -3.880 15.037 8.698 1.00 0.00 H new ATOM 0 HB3 ARG A 91 -2.351 15.779 9.125 1.00 0.00 H new ATOM 0 HG2 ARG A 91 -3.553 17.953 8.160 1.00 0.00 H new ATOM 0 HG3 ARG A 91 -4.995 17.048 8.575 1.00 0.00 H new ATOM 0 HD2 ARG A 91 -3.184 16.818 10.783 1.00 0.00 H new ATOM 0 HD3 ARG A 91 -3.215 18.505 10.311 1.00 0.00 H new ATOM 0 HE ARG A 91 -5.902 17.758 10.352 1.00 0.00 H new ATOM 0 HH11 ARG A 91 -3.204 17.716 12.639 1.00 0.00 H new ATOM 0 HH12 ARG A 91 -4.250 17.921 14.048 1.00 0.00 H new ATOM 0 HH21 ARG A 91 -7.230 18.020 12.170 1.00 0.00 H new ATOM 0 HH22 ARG A 91 -6.515 18.092 13.784 1.00 0.00 H new ATOM 1477 N ASN A 92 -4.945 16.386 5.994 1.00 0.00 N ATOM 1478 CA ASN A 92 -6.118 16.092 5.179 1.00 0.00 C ATOM 1479 C ASN A 92 -5.696 15.625 3.794 1.00 0.00 C ATOM 1480 O ASN A 92 -6.146 14.585 3.325 1.00 0.00 O ATOM 1481 CB ASN A 92 -7.066 17.288 5.073 1.00 0.00 C ATOM 1482 CG ASN A 92 -6.654 18.287 4.008 1.00 0.00 C ATOM 1483 OD1 ASN A 92 -6.948 17.959 2.753 1.00 0.00 O flip ATOM 1484 ND2 ASN A 92 -6.082 19.335 4.306 1.00 0.00 N flip ATOM 0 H ASN A 92 -4.928 17.318 6.409 1.00 0.00 H new ATOM 0 HA ASN A 92 -6.665 15.291 5.677 1.00 0.00 H new ATOM 0 HB2 ASN A 92 -8.071 16.928 4.854 1.00 0.00 H new ATOM 0 HB3 ASN A 92 -7.111 17.794 6.038 1.00 0.00 H new ATOM 0 HD21 ASN A 92 -5.877 19.544 5.283 1.00 0.00 H new ATOM 0 HD22 ASN A 92 -5.813 19.995 3.576 1.00 0.00 H new ATOM 1491 N GLU A 93 -4.802 16.381 3.154 1.00 0.00 N ATOM 1492 CA GLU A 93 -4.299 16.002 1.837 1.00 0.00 C ATOM 1493 C GLU A 93 -3.954 14.536 1.859 1.00 0.00 C ATOM 1494 O GLU A 93 -4.327 13.759 0.980 1.00 0.00 O ATOM 1495 CB GLU A 93 -3.025 16.770 1.504 1.00 0.00 C ATOM 1496 CG GLU A 93 -3.046 17.432 0.136 1.00 0.00 C ATOM 1497 CD GLU A 93 -3.852 18.715 0.122 1.00 0.00 C ATOM 1498 OE1 GLU A 93 -3.316 19.758 0.552 1.00 0.00 O ATOM 1499 OE2 GLU A 93 -5.020 18.678 -0.319 1.00 0.00 O ATOM 0 H GLU A 93 -4.416 17.250 3.523 1.00 0.00 H new ATOM 0 HA GLU A 93 -5.065 16.225 1.094 1.00 0.00 H new ATOM 0 HB2 GLU A 93 -2.864 17.534 2.264 1.00 0.00 H new ATOM 0 HB3 GLU A 93 -2.177 16.087 1.554 1.00 0.00 H new ATOM 0 HG2 GLU A 93 -2.024 17.646 -0.176 1.00 0.00 H new ATOM 0 HG3 GLU A 93 -3.463 16.737 -0.593 1.00 0.00 H new ATOM 1506 N ILE A 94 -3.223 14.188 2.901 1.00 0.00 N ATOM 1507 CA ILE A 94 -2.785 12.840 3.114 1.00 0.00 C ATOM 1508 C ILE A 94 -3.986 11.920 3.333 1.00 0.00 C ATOM 1509 O ILE A 94 -4.014 10.787 2.852 1.00 0.00 O ATOM 1510 CB ILE A 94 -1.835 12.785 4.326 1.00 0.00 C ATOM 1511 CG1 ILE A 94 -0.422 13.195 3.901 1.00 0.00 C ATOM 1512 CG2 ILE A 94 -1.834 11.405 4.971 1.00 0.00 C ATOM 1513 CD1 ILE A 94 -0.379 14.418 3.007 1.00 0.00 C ATOM 0 H ILE A 94 -2.920 14.843 3.622 1.00 0.00 H new ATOM 0 HA ILE A 94 -2.248 12.497 2.230 1.00 0.00 H new ATOM 0 HB ILE A 94 -2.194 13.490 5.076 1.00 0.00 H new ATOM 0 HG12 ILE A 94 0.173 13.389 4.793 1.00 0.00 H new ATOM 0 HG13 ILE A 94 0.047 12.360 3.380 1.00 0.00 H new ATOM 0 HG21 ILE A 94 -1.153 11.402 5.822 1.00 0.00 H new ATOM 0 HG22 ILE A 94 -2.841 11.161 5.310 1.00 0.00 H new ATOM 0 HG23 ILE A 94 -1.507 10.663 4.242 1.00 0.00 H new ATOM 0 HD11 ILE A 94 0.656 14.644 2.750 1.00 0.00 H new ATOM 0 HD12 ILE A 94 -0.945 14.223 2.096 1.00 0.00 H new ATOM 0 HD13 ILE A 94 -0.817 15.268 3.531 1.00 0.00 H new ATOM 1525 N ILE A 95 -4.978 12.429 4.064 1.00 0.00 N ATOM 1526 CA ILE A 95 -6.190 11.672 4.355 1.00 0.00 C ATOM 1527 C ILE A 95 -7.126 11.655 3.148 1.00 0.00 C ATOM 1528 O ILE A 95 -7.320 10.608 2.534 1.00 0.00 O ATOM 1529 CB ILE A 95 -6.939 12.249 5.576 1.00 0.00 C ATOM 1530 CG1 ILE A 95 -6.044 12.206 6.817 1.00 0.00 C ATOM 1531 CG2 ILE A 95 -8.233 11.484 5.825 1.00 0.00 C ATOM 1532 CD1 ILE A 95 -5.744 10.803 7.300 1.00 0.00 C ATOM 0 H ILE A 95 -4.963 13.366 4.466 1.00 0.00 H new ATOM 0 HA ILE A 95 -5.882 10.652 4.585 1.00 0.00 H new ATOM 0 HB ILE A 95 -7.192 13.288 5.365 1.00 0.00 H new ATOM 0 HG12 ILE A 95 -5.105 12.713 6.595 1.00 0.00 H new ATOM 0 HG13 ILE A 95 -6.525 12.763 7.621 1.00 0.00 H new ATOM 0 HG21 ILE A 95 -8.745 11.907 6.689 1.00 0.00 H new ATOM 0 HG22 ILE A 95 -8.876 11.562 4.948 1.00 0.00 H new ATOM 0 HG23 ILE A 95 -8.005 10.435 6.015 1.00 0.00 H new ATOM 0 HD11 ILE A 95 -5.105 10.851 8.182 1.00 0.00 H new ATOM 0 HD12 ILE A 95 -6.676 10.299 7.554 1.00 0.00 H new ATOM 0 HD13 ILE A 95 -5.234 10.248 6.512 1.00 0.00 H new ATOM 1544 N ALA A 96 -7.703 12.817 2.806 1.00 0.00 N ATOM 1545 CA ALA A 96 -8.615 12.912 1.659 1.00 0.00 C ATOM 1546 C ALA A 96 -8.178 11.972 0.538 1.00 0.00 C ATOM 1547 O ALA A 96 -8.982 11.197 0.021 1.00 0.00 O ATOM 1548 CB ALA A 96 -8.697 14.350 1.161 1.00 0.00 C ATOM 0 H ALA A 96 -7.556 13.696 3.303 1.00 0.00 H new ATOM 0 HA ALA A 96 -9.609 12.605 1.985 1.00 0.00 H new ATOM 0 HB1 ALA A 96 -9.377 14.402 0.311 1.00 0.00 H new ATOM 0 HB2 ALA A 96 -9.066 14.992 1.961 1.00 0.00 H new ATOM 0 HB3 ALA A 96 -7.706 14.686 0.854 1.00 0.00 H new ATOM 1554 N ALA A 97 -6.886 12.008 0.207 1.00 0.00 N ATOM 1555 CA ALA A 97 -6.328 11.113 -0.807 1.00 0.00 C ATOM 1556 C ALA A 97 -6.814 9.713 -0.528 1.00 0.00 C ATOM 1557 O ALA A 97 -7.709 9.204 -1.190 1.00 0.00 O ATOM 1558 CB ALA A 97 -4.810 11.146 -0.730 1.00 0.00 C ATOM 0 H ALA A 97 -6.208 12.646 0.625 1.00 0.00 H new ATOM 0 HA ALA A 97 -6.644 11.429 -1.801 1.00 0.00 H new ATOM 0 HB1 ALA A 97 -4.393 10.480 -1.485 1.00 0.00 H new ATOM 0 HB2 ALA A 97 -4.459 12.162 -0.909 1.00 0.00 H new ATOM 0 HB3 ALA A 97 -4.489 10.820 0.259 1.00 0.00 H new ATOM 1564 N ILE A 98 -6.241 9.142 0.512 1.00 0.00 N ATOM 1565 CA ILE A 98 -6.588 7.832 1.001 1.00 0.00 C ATOM 1566 C ILE A 98 -8.097 7.666 1.048 1.00 0.00 C ATOM 1567 O ILE A 98 -8.676 6.758 0.462 1.00 0.00 O ATOM 1568 CB ILE A 98 -6.045 7.742 2.425 1.00 0.00 C ATOM 1569 CG1 ILE A 98 -4.549 7.415 2.391 1.00 0.00 C ATOM 1570 CG2 ILE A 98 -6.829 6.732 3.267 1.00 0.00 C ATOM 1571 CD1 ILE A 98 -4.064 6.636 3.590 1.00 0.00 C ATOM 0 H ILE A 98 -5.502 9.592 1.052 1.00 0.00 H new ATOM 0 HA ILE A 98 -6.175 7.061 0.351 1.00 0.00 H new ATOM 0 HB ILE A 98 -6.175 8.711 2.907 1.00 0.00 H new ATOM 0 HG12 ILE A 98 -4.333 6.844 1.488 1.00 0.00 H new ATOM 0 HG13 ILE A 98 -3.985 8.346 2.323 1.00 0.00 H new ATOM 0 HG21 ILE A 98 -6.413 6.697 4.274 1.00 0.00 H new ATOM 0 HG22 ILE A 98 -7.875 7.034 3.317 1.00 0.00 H new ATOM 0 HG23 ILE A 98 -6.758 5.745 2.810 1.00 0.00 H new ATOM 0 HD11 ILE A 98 -2.996 6.444 3.491 1.00 0.00 H new ATOM 0 HD12 ILE A 98 -4.247 7.213 4.497 1.00 0.00 H new ATOM 0 HD13 ILE A 98 -4.599 5.688 3.649 1.00 0.00 H new ATOM 1583 N ASP A 99 -8.701 8.573 1.785 1.00 0.00 N ATOM 1584 CA ASP A 99 -10.132 8.610 1.996 1.00 0.00 C ATOM 1585 C ASP A 99 -10.915 8.340 0.708 1.00 0.00 C ATOM 1586 O ASP A 99 -11.993 7.751 0.733 1.00 0.00 O ATOM 1587 CB ASP A 99 -10.466 9.970 2.585 1.00 0.00 C ATOM 1588 CG ASP A 99 -11.530 9.899 3.662 1.00 0.00 C ATOM 1589 OD1 ASP A 99 -11.677 8.824 4.282 1.00 0.00 O ATOM 1590 OD2 ASP A 99 -12.217 10.918 3.887 1.00 0.00 O ATOM 0 H ASP A 99 -8.200 9.321 2.264 1.00 0.00 H new ATOM 0 HA ASP A 99 -10.427 7.816 2.682 1.00 0.00 H new ATOM 0 HB2 ASP A 99 -9.561 10.412 3.003 1.00 0.00 H new ATOM 0 HB3 ASP A 99 -10.805 10.632 1.789 1.00 0.00 H new ATOM 1595 N PHE A 100 -10.341 8.736 -0.410 1.00 0.00 N ATOM 1596 CA PHE A 100 -10.936 8.507 -1.722 1.00 0.00 C ATOM 1597 C PHE A 100 -10.190 7.360 -2.385 1.00 0.00 C ATOM 1598 O PHE A 100 -10.762 6.520 -3.080 1.00 0.00 O ATOM 1599 CB PHE A 100 -10.846 9.774 -2.582 1.00 0.00 C ATOM 1600 CG PHE A 100 -11.177 9.551 -4.032 1.00 0.00 C ATOM 1601 CD1 PHE A 100 -12.486 9.334 -4.431 1.00 0.00 C ATOM 1602 CD2 PHE A 100 -10.179 9.558 -4.996 1.00 0.00 C ATOM 1603 CE1 PHE A 100 -12.795 9.129 -5.762 1.00 0.00 C ATOM 1604 CE2 PHE A 100 -10.483 9.354 -6.329 1.00 0.00 C ATOM 1605 CZ PHE A 100 -11.793 9.139 -6.712 1.00 0.00 C ATOM 0 H PHE A 100 -9.447 9.227 -0.440 1.00 0.00 H new ATOM 0 HA PHE A 100 -11.991 8.255 -1.615 1.00 0.00 H new ATOM 0 HB2 PHE A 100 -11.523 10.526 -2.176 1.00 0.00 H new ATOM 0 HB3 PHE A 100 -9.837 10.181 -2.508 1.00 0.00 H new ATOM 0 HD1 PHE A 100 -13.274 9.325 -3.693 1.00 0.00 H new ATOM 0 HD2 PHE A 100 -9.153 9.725 -4.702 1.00 0.00 H new ATOM 0 HE1 PHE A 100 -13.820 8.961 -6.059 1.00 0.00 H new ATOM 0 HE2 PHE A 100 -9.697 9.363 -7.070 1.00 0.00 H new ATOM 0 HZ PHE A 100 -12.033 8.979 -7.753 1.00 0.00 H new ATOM 1615 N LEU A 101 -8.891 7.363 -2.133 1.00 0.00 N ATOM 1616 CA LEU A 101 -7.963 6.376 -2.641 1.00 0.00 C ATOM 1617 C LEU A 101 -8.367 4.978 -2.261 1.00 0.00 C ATOM 1618 O LEU A 101 -8.449 4.079 -3.097 1.00 0.00 O ATOM 1619 CB LEU A 101 -6.608 6.631 -1.995 1.00 0.00 C ATOM 1620 CG LEU A 101 -5.400 6.407 -2.869 1.00 0.00 C ATOM 1621 CD1 LEU A 101 -5.510 5.091 -3.626 1.00 0.00 C ATOM 1622 CD2 LEU A 101 -5.242 7.596 -3.806 1.00 0.00 C ATOM 0 H LEU A 101 -8.445 8.073 -1.553 1.00 0.00 H new ATOM 0 HA LEU A 101 -7.942 6.460 -3.728 1.00 0.00 H new ATOM 0 HB2 LEU A 101 -6.587 7.661 -1.639 1.00 0.00 H new ATOM 0 HB3 LEU A 101 -6.520 5.989 -1.119 1.00 0.00 H new ATOM 0 HG LEU A 101 -4.506 6.331 -2.250 1.00 0.00 H new ATOM 0 HD11 LEU A 101 -4.626 4.954 -4.249 1.00 0.00 H new ATOM 0 HD12 LEU A 101 -5.584 4.268 -2.916 1.00 0.00 H new ATOM 0 HD13 LEU A 101 -6.399 5.107 -4.257 1.00 0.00 H new ATOM 0 HD21 LEU A 101 -4.371 7.444 -4.443 1.00 0.00 H new ATOM 0 HD22 LEU A 101 -6.133 7.691 -4.427 1.00 0.00 H new ATOM 0 HD23 LEU A 101 -5.109 8.506 -3.220 1.00 0.00 H new ATOM 1634 N ILE A 102 -8.554 4.798 -0.969 1.00 0.00 N ATOM 1635 CA ILE A 102 -8.876 3.507 -0.434 1.00 0.00 C ATOM 1636 C ILE A 102 -10.303 3.448 0.103 1.00 0.00 C ATOM 1637 O ILE A 102 -10.820 2.361 0.358 1.00 0.00 O ATOM 1638 CB ILE A 102 -7.872 3.126 0.674 1.00 0.00 C ATOM 1639 CG1 ILE A 102 -6.465 3.669 0.336 1.00 0.00 C ATOM 1640 CG2 ILE A 102 -7.836 1.616 0.855 1.00 0.00 C ATOM 1641 CD1 ILE A 102 -5.394 3.234 1.316 1.00 0.00 C ATOM 0 H ILE A 102 -8.486 5.540 -0.273 1.00 0.00 H new ATOM 0 HA ILE A 102 -8.806 2.788 -1.250 1.00 0.00 H new ATOM 0 HB ILE A 102 -8.197 3.578 1.611 1.00 0.00 H new ATOM 0 HG12 ILE A 102 -6.187 3.336 -0.664 1.00 0.00 H new ATOM 0 HG13 ILE A 102 -6.502 4.758 0.311 1.00 0.00 H new ATOM 0 HG21 ILE A 102 -7.124 1.360 1.640 1.00 0.00 H new ATOM 0 HG22 ILE A 102 -8.827 1.259 1.135 1.00 0.00 H new ATOM 0 HG23 ILE A 102 -7.531 1.145 -0.079 1.00 0.00 H new ATOM 0 HD11 ILE A 102 -4.434 3.653 1.015 1.00 0.00 H new ATOM 0 HD12 ILE A 102 -5.648 3.590 2.314 1.00 0.00 H new ATOM 0 HD13 ILE A 102 -5.329 2.146 1.324 1.00 0.00 H new ATOM 1653 N THR A 103 -10.955 4.607 0.273 1.00 0.00 N ATOM 1654 CA THR A 103 -12.332 4.602 0.778 1.00 0.00 C ATOM 1655 C THR A 103 -13.289 5.328 -0.170 1.00 0.00 C ATOM 1656 O THR A 103 -14.487 5.416 0.099 1.00 0.00 O ATOM 1657 CB THR A 103 -12.410 5.189 2.199 1.00 0.00 C ATOM 1658 OG1 THR A 103 -13.236 6.339 2.240 1.00 0.00 O ATOM 1659 CG2 THR A 103 -11.064 5.569 2.780 1.00 0.00 C ATOM 0 H THR A 103 -10.567 5.529 0.076 1.00 0.00 H new ATOM 0 HA THR A 103 -12.650 3.561 0.827 1.00 0.00 H new ATOM 0 HB THR A 103 -12.831 4.384 2.802 1.00 0.00 H new ATOM 0 HG1 THR A 103 -12.757 7.100 1.851 1.00 0.00 H new ATOM 0 HG21 THR A 103 -11.202 5.975 3.782 1.00 0.00 H new ATOM 0 HG22 THR A 103 -10.427 4.686 2.830 1.00 0.00 H new ATOM 0 HG23 THR A 103 -10.593 6.320 2.146 1.00 0.00 H new ATOM 1667 N GLY A 104 -12.758 5.825 -1.288 1.00 0.00 N ATOM 1668 CA GLY A 104 -13.577 6.515 -2.276 1.00 0.00 C ATOM 1669 C GLY A 104 -14.660 7.394 -1.672 1.00 0.00 C ATOM 1670 O GLY A 104 -15.782 7.435 -2.178 1.00 0.00 O ATOM 0 H GLY A 104 -11.769 5.761 -1.528 1.00 0.00 H new ATOM 0 HA2 GLY A 104 -12.931 7.130 -2.903 1.00 0.00 H new ATOM 0 HA3 GLY A 104 -14.044 5.776 -2.927 1.00 0.00 H new ATOM 1674 N ILE A 105 -14.332 8.099 -0.593 1.00 0.00 N ATOM 1675 CA ILE A 105 -15.297 8.976 0.064 1.00 0.00 C ATOM 1676 C ILE A 105 -15.900 9.971 -0.923 1.00 0.00 C ATOM 1677 O ILE A 105 -16.872 10.659 -0.549 1.00 0.00 O ATOM 1678 CB ILE A 105 -14.659 9.757 1.229 1.00 0.00 C ATOM 1679 CG1 ILE A 105 -13.374 10.452 0.771 1.00 0.00 C ATOM 1680 CG2 ILE A 105 -14.380 8.829 2.403 1.00 0.00 C ATOM 1681 CD1 ILE A 105 -13.618 11.754 0.040 1.00 0.00 C ATOM 1682 OXT ILE A 105 -15.394 10.054 -2.062 1.00 0.00 O ATOM 0 H ILE A 105 -13.410 8.081 -0.157 1.00 0.00 H new ATOM 0 HA ILE A 105 -16.082 8.331 0.458 1.00 0.00 H new ATOM 0 HB ILE A 105 -15.362 10.523 1.557 1.00 0.00 H new ATOM 0 HG12 ILE A 105 -12.745 10.645 1.640 1.00 0.00 H new ATOM 0 HG13 ILE A 105 -12.818 9.778 0.119 1.00 0.00 H new ATOM 0 HG21 ILE A 105 -13.929 9.397 3.217 1.00 0.00 H new ATOM 0 HG22 ILE A 105 -15.314 8.384 2.745 1.00 0.00 H new ATOM 0 HG23 ILE A 105 -13.696 8.041 2.089 1.00 0.00 H new ATOM 0 HD11 ILE A 105 -12.664 12.190 -0.255 1.00 0.00 H new ATOM 0 HD12 ILE A 105 -14.220 11.565 -0.849 1.00 0.00 H new ATOM 0 HD13 ILE A 105 -14.146 12.446 0.696 1.00 0.00 H new ATOM 1695 N MET B 1 -13.346 -2.626 -14.348 1.00 0.00 N ATOM 1696 CA MET B 1 -13.623 -3.641 -13.298 1.00 0.00 C ATOM 1697 C MET B 1 -12.427 -4.565 -13.095 1.00 0.00 C ATOM 1698 O MET B 1 -12.139 -5.419 -13.934 1.00 0.00 O ATOM 1699 CB MET B 1 -14.851 -4.452 -13.717 1.00 0.00 C ATOM 1700 CG MET B 1 -14.794 -4.944 -15.154 1.00 0.00 C ATOM 1701 SD MET B 1 -15.723 -3.891 -16.285 1.00 0.00 S ATOM 1702 CE MET B 1 -17.401 -4.212 -15.745 1.00 0.00 C ATOM 0 H1 MET B 1 -14.151 -2.577 -15.004 1.00 0.00 H new ATOM 0 H2 MET B 1 -13.204 -1.697 -13.904 1.00 0.00 H new ATOM 0 H3 MET B 1 -12.488 -2.894 -14.872 1.00 0.00 H new ATOM 0 HA MET B 1 -13.811 -3.135 -12.351 1.00 0.00 H new ATOM 0 HB2 MET B 1 -14.954 -5.309 -13.052 1.00 0.00 H new ATOM 0 HB3 MET B 1 -15.743 -3.839 -13.587 1.00 0.00 H new ATOM 0 HG2 MET B 1 -13.754 -4.990 -15.477 1.00 0.00 H new ATOM 0 HG3 MET B 1 -15.188 -5.959 -15.202 1.00 0.00 H new ATOM 0 HE1 MET B 1 -18.091 -4.020 -16.567 1.00 0.00 H new ATOM 0 HE2 MET B 1 -17.490 -5.252 -15.432 1.00 0.00 H new ATOM 0 HE3 MET B 1 -17.645 -3.559 -14.907 1.00 0.00 H new ATOM 1714 N SER B 2 -11.733 -4.388 -11.975 1.00 0.00 N ATOM 1715 CA SER B 2 -10.568 -5.207 -11.662 1.00 0.00 C ATOM 1716 C SER B 2 -10.376 -5.322 -10.145 1.00 0.00 C ATOM 1717 O SER B 2 -10.009 -4.353 -9.485 1.00 0.00 O ATOM 1718 CB SER B 2 -9.311 -4.621 -12.331 1.00 0.00 C ATOM 1719 OG SER B 2 -8.829 -5.501 -13.331 1.00 0.00 O ATOM 0 H SER B 2 -11.957 -3.686 -11.270 1.00 0.00 H new ATOM 0 HA SER B 2 -10.733 -6.210 -12.055 1.00 0.00 H new ATOM 0 HB2 SER B 2 -9.544 -3.652 -12.772 1.00 0.00 H new ATOM 0 HB3 SER B 2 -8.537 -4.453 -11.582 1.00 0.00 H new ATOM 0 HG SER B 2 -8.600 -6.363 -12.925 1.00 0.00 H new ATOM 1725 N GLN B 3 -10.641 -6.516 -9.594 1.00 0.00 N ATOM 1726 CA GLN B 3 -10.505 -6.754 -8.148 1.00 0.00 C ATOM 1727 C GLN B 3 -11.265 -8.010 -7.710 1.00 0.00 C ATOM 1728 O GLN B 3 -12.136 -8.504 -8.424 1.00 0.00 O ATOM 1729 CB GLN B 3 -11.034 -5.556 -7.350 1.00 0.00 C ATOM 1730 CG GLN B 3 -12.320 -4.969 -7.910 1.00 0.00 C ATOM 1731 CD GLN B 3 -13.216 -4.393 -6.830 1.00 0.00 C ATOM 1732 OE1 GLN B 3 -14.499 -4.730 -6.885 1.00 0.00 O flip ATOM 1733 NE2 GLN B 3 -12.760 -3.655 -5.957 1.00 0.00 N flip ATOM 0 H GLN B 3 -10.950 -7.330 -10.125 1.00 0.00 H new ATOM 0 HA GLN B 3 -9.443 -6.894 -7.947 1.00 0.00 H new ATOM 0 HB2 GLN B 3 -11.205 -5.864 -6.319 1.00 0.00 H new ATOM 0 HB3 GLN B 3 -10.270 -4.779 -7.328 1.00 0.00 H new ATOM 0 HG2 GLN B 3 -12.075 -4.187 -8.629 1.00 0.00 H new ATOM 0 HG3 GLN B 3 -12.863 -5.743 -8.453 1.00 0.00 H new ATOM 0 HE21 GLN B 3 -11.767 -3.422 -5.953 1.00 0.00 H new ATOM 0 HE22 GLN B 3 -13.375 -3.276 -5.237 1.00 0.00 H new ATOM 1742 N PHE B 4 -10.942 -8.486 -6.505 1.00 0.00 N ATOM 1743 CA PHE B 4 -11.595 -9.653 -5.896 1.00 0.00 C ATOM 1744 C PHE B 4 -11.139 -10.998 -6.459 1.00 0.00 C ATOM 1745 O PHE B 4 -11.911 -11.957 -6.477 1.00 0.00 O ATOM 1746 CB PHE B 4 -13.118 -9.527 -5.985 1.00 0.00 C ATOM 1747 CG PHE B 4 -13.656 -8.453 -5.087 1.00 0.00 C ATOM 1748 CD1 PHE B 4 -13.188 -8.333 -3.790 1.00 0.00 C ATOM 1749 CD2 PHE B 4 -14.607 -7.553 -5.540 1.00 0.00 C ATOM 1750 CE1 PHE B 4 -13.656 -7.338 -2.958 1.00 0.00 C ATOM 1751 CE2 PHE B 4 -15.084 -6.556 -4.710 1.00 0.00 C ATOM 1752 CZ PHE B 4 -14.607 -6.448 -3.417 1.00 0.00 C ATOM 0 H PHE B 4 -10.217 -8.072 -5.919 1.00 0.00 H new ATOM 0 HA PHE B 4 -11.282 -9.648 -4.852 1.00 0.00 H new ATOM 0 HB2 PHE B 4 -13.403 -9.312 -7.015 1.00 0.00 H new ATOM 0 HB3 PHE B 4 -13.575 -10.481 -5.721 1.00 0.00 H new ATOM 0 HD1 PHE B 4 -12.446 -9.028 -3.425 1.00 0.00 H new ATOM 0 HD2 PHE B 4 -14.979 -7.631 -6.551 1.00 0.00 H new ATOM 0 HE1 PHE B 4 -13.280 -7.255 -1.949 1.00 0.00 H new ATOM 0 HE2 PHE B 4 -15.829 -5.862 -5.071 1.00 0.00 H new ATOM 0 HZ PHE B 4 -14.977 -5.669 -2.767 1.00 0.00 H new ATOM 1762 N THR B 5 -9.882 -11.090 -6.871 1.00 0.00 N ATOM 1763 CA THR B 5 -9.342 -12.342 -7.373 1.00 0.00 C ATOM 1764 C THR B 5 -8.157 -12.768 -6.517 1.00 0.00 C ATOM 1765 O THR B 5 -7.505 -11.937 -5.886 1.00 0.00 O ATOM 1766 CB THR B 5 -8.890 -12.207 -8.824 1.00 0.00 C ATOM 1767 OG1 THR B 5 -9.673 -11.249 -9.514 1.00 0.00 O ATOM 1768 CG2 THR B 5 -8.954 -13.503 -9.604 1.00 0.00 C ATOM 0 H THR B 5 -9.220 -10.314 -6.867 1.00 0.00 H new ATOM 0 HA THR B 5 -10.130 -13.094 -7.324 1.00 0.00 H new ATOM 0 HB THR B 5 -7.848 -11.893 -8.764 1.00 0.00 H new ATOM 0 HG1 THR B 5 -9.096 -10.715 -10.099 1.00 0.00 H new ATOM 0 HG21 THR B 5 -8.618 -13.329 -10.626 1.00 0.00 H new ATOM 0 HG22 THR B 5 -8.310 -14.244 -9.131 1.00 0.00 H new ATOM 0 HG23 THR B 5 -9.980 -13.870 -9.617 1.00 0.00 H new ATOM 1776 N LEU B 6 -7.868 -14.055 -6.522 1.00 0.00 N ATOM 1777 CA LEU B 6 -6.741 -14.585 -5.773 1.00 0.00 C ATOM 1778 C LEU B 6 -5.522 -14.587 -6.673 1.00 0.00 C ATOM 1779 O LEU B 6 -5.142 -15.622 -7.220 1.00 0.00 O ATOM 1780 CB LEU B 6 -7.045 -16.002 -5.285 1.00 0.00 C ATOM 1781 CG LEU B 6 -5.872 -16.732 -4.633 1.00 0.00 C ATOM 1782 CD1 LEU B 6 -5.416 -15.998 -3.380 1.00 0.00 C ATOM 1783 CD2 LEU B 6 -6.260 -18.166 -4.308 1.00 0.00 C ATOM 0 H LEU B 6 -8.399 -14.757 -7.038 1.00 0.00 H new ATOM 0 HA LEU B 6 -6.553 -13.962 -4.899 1.00 0.00 H new ATOM 0 HB2 LEU B 6 -7.865 -15.954 -4.569 1.00 0.00 H new ATOM 0 HB3 LEU B 6 -7.395 -16.593 -6.131 1.00 0.00 H new ATOM 0 HG LEU B 6 -5.039 -16.752 -5.336 1.00 0.00 H new ATOM 0 HD11 LEU B 6 -4.580 -16.533 -2.929 1.00 0.00 H new ATOM 0 HD12 LEU B 6 -5.101 -14.988 -3.644 1.00 0.00 H new ATOM 0 HD13 LEU B 6 -6.240 -15.947 -2.668 1.00 0.00 H new ATOM 0 HD21 LEU B 6 -5.415 -18.675 -3.844 1.00 0.00 H new ATOM 0 HD22 LEU B 6 -7.106 -18.167 -3.621 1.00 0.00 H new ATOM 0 HD23 LEU B 6 -6.537 -18.685 -5.226 1.00 0.00 H new ATOM 1795 N TYR B 7 -4.935 -13.412 -6.865 1.00 0.00 N ATOM 1796 CA TYR B 7 -3.789 -13.295 -7.749 1.00 0.00 C ATOM 1797 C TYR B 7 -2.493 -13.715 -7.089 1.00 0.00 C ATOM 1798 O TYR B 7 -2.077 -13.139 -6.088 1.00 0.00 O ATOM 1799 CB TYR B 7 -3.657 -11.860 -8.287 1.00 0.00 C ATOM 1800 CG TYR B 7 -4.954 -11.164 -8.651 1.00 0.00 C ATOM 1801 CD1 TYR B 7 -5.850 -10.731 -7.674 1.00 0.00 C ATOM 1802 CD2 TYR B 7 -5.254 -10.891 -9.980 1.00 0.00 C ATOM 1803 CE1 TYR B 7 -7.003 -10.055 -8.021 1.00 0.00 C ATOM 1804 CE2 TYR B 7 -6.402 -10.208 -10.330 1.00 0.00 C ATOM 1805 CZ TYR B 7 -7.273 -9.791 -9.348 1.00 0.00 C ATOM 1806 OH TYR B 7 -8.419 -9.110 -9.691 1.00 0.00 O ATOM 0 H TYR B 7 -5.230 -12.540 -6.426 1.00 0.00 H new ATOM 0 HA TYR B 7 -3.971 -13.980 -8.577 1.00 0.00 H new ATOM 0 HB2 TYR B 7 -3.143 -11.258 -7.538 1.00 0.00 H new ATOM 0 HB3 TYR B 7 -3.019 -11.882 -9.171 1.00 0.00 H new ATOM 0 HD1 TYR B 7 -5.639 -10.927 -6.633 1.00 0.00 H new ATOM 0 HD2 TYR B 7 -4.576 -11.219 -10.754 1.00 0.00 H new ATOM 0 HE1 TYR B 7 -7.693 -9.733 -7.255 1.00 0.00 H new ATOM 0 HE2 TYR B 7 -6.616 -10.002 -11.368 1.00 0.00 H new ATOM 0 HH TYR B 7 -9.159 -9.407 -9.121 1.00 0.00 H new ATOM 1816 N LYS B 8 -1.844 -14.710 -7.703 1.00 0.00 N ATOM 1817 CA LYS B 8 -0.568 -15.221 -7.224 1.00 0.00 C ATOM 1818 C LYS B 8 0.584 -14.710 -8.061 1.00 0.00 C ATOM 1819 O LYS B 8 0.682 -15.014 -9.242 1.00 0.00 O ATOM 1820 CB LYS B 8 -0.551 -16.747 -7.222 1.00 0.00 C ATOM 1821 CG LYS B 8 0.850 -17.344 -7.115 1.00 0.00 C ATOM 1822 CD LYS B 8 1.035 -18.110 -5.814 1.00 0.00 C ATOM 1823 CE LYS B 8 0.899 -19.610 -6.026 1.00 0.00 C ATOM 1824 NZ LYS B 8 2.223 -20.292 -6.036 1.00 0.00 N ATOM 0 H LYS B 8 -2.191 -15.177 -8.541 1.00 0.00 H new ATOM 0 HA LYS B 8 -0.447 -14.860 -6.203 1.00 0.00 H new ATOM 0 HB2 LYS B 8 -1.155 -17.107 -6.389 1.00 0.00 H new ATOM 0 HB3 LYS B 8 -1.022 -17.108 -8.136 1.00 0.00 H new ATOM 0 HG2 LYS B 8 1.027 -18.011 -7.959 1.00 0.00 H new ATOM 0 HG3 LYS B 8 1.591 -16.547 -7.177 1.00 0.00 H new ATOM 0 HD2 LYS B 8 2.017 -17.888 -5.396 1.00 0.00 H new ATOM 0 HD3 LYS B 8 0.296 -17.776 -5.086 1.00 0.00 H new ATOM 0 HE2 LYS B 8 0.279 -20.033 -5.236 1.00 0.00 H new ATOM 0 HE3 LYS B 8 0.387 -19.798 -6.969 1.00 0.00 H new ATOM 0 HZ1 LYS B 8 2.091 -21.304 -6.234 1.00 0.00 H new ATOM 0 HZ2 LYS B 8 2.825 -19.871 -6.773 1.00 0.00 H new ATOM 0 HZ3 LYS B 8 2.680 -20.177 -5.109 1.00 0.00 H new ATOM 1838 N ASN B 9 1.460 -13.966 -7.398 1.00 0.00 N ATOM 1839 CA ASN B 9 2.664 -13.395 -7.985 1.00 0.00 C ATOM 1840 C ASN B 9 2.767 -13.595 -9.500 1.00 0.00 C ATOM 1841 O ASN B 9 2.713 -14.718 -9.996 1.00 0.00 O ATOM 1842 CB ASN B 9 3.886 -14.013 -7.309 1.00 0.00 C ATOM 1843 CG ASN B 9 3.936 -15.514 -7.494 1.00 0.00 C ATOM 1844 OD1 ASN B 9 3.527 -16.041 -8.523 1.00 0.00 O ATOM 1845 ND2 ASN B 9 4.431 -16.211 -6.489 1.00 0.00 N ATOM 0 H ASN B 9 1.349 -13.737 -6.410 1.00 0.00 H new ATOM 0 HA ASN B 9 2.617 -12.319 -7.819 1.00 0.00 H new ATOM 0 HB2 ASN B 9 4.792 -13.567 -7.719 1.00 0.00 H new ATOM 0 HB3 ASN B 9 3.869 -13.779 -6.245 1.00 0.00 H new ATOM 0 HD21 ASN B 9 4.484 -17.228 -6.551 1.00 0.00 H new ATOM 0 HD22 ASN B 9 4.761 -15.733 -5.650 1.00 0.00 H new ATOM 1852 N LYS B 10 2.933 -12.487 -10.228 1.00 0.00 N ATOM 1853 CA LYS B 10 3.073 -12.511 -11.696 1.00 0.00 C ATOM 1854 C LYS B 10 3.712 -13.809 -12.159 1.00 0.00 C ATOM 1855 O LYS B 10 3.339 -14.393 -13.176 1.00 0.00 O ATOM 1856 CB LYS B 10 3.946 -11.364 -12.179 1.00 0.00 C ATOM 1857 CG LYS B 10 4.585 -10.610 -11.050 1.00 0.00 C ATOM 1858 CD LYS B 10 5.412 -11.537 -10.179 1.00 0.00 C ATOM 1859 CE LYS B 10 6.284 -10.769 -9.199 1.00 0.00 C ATOM 1860 NZ LYS B 10 5.820 -10.936 -7.793 1.00 0.00 N ATOM 0 H LYS B 10 2.975 -11.551 -9.824 1.00 0.00 H new ATOM 0 HA LYS B 10 2.070 -12.418 -12.112 1.00 0.00 H new ATOM 0 HB2 LYS B 10 4.723 -11.755 -12.835 1.00 0.00 H new ATOM 0 HB3 LYS B 10 3.342 -10.678 -12.773 1.00 0.00 H new ATOM 0 HG2 LYS B 10 5.219 -9.818 -11.449 1.00 0.00 H new ATOM 0 HG3 LYS B 10 3.815 -10.129 -10.447 1.00 0.00 H new ATOM 0 HD2 LYS B 10 4.749 -12.205 -9.629 1.00 0.00 H new ATOM 0 HD3 LYS B 10 6.042 -12.163 -10.811 1.00 0.00 H new ATOM 0 HE2 LYS B 10 7.315 -11.112 -9.284 1.00 0.00 H new ATOM 0 HE3 LYS B 10 6.278 -9.711 -9.460 1.00 0.00 H new ATOM 0 HZ1 LYS B 10 5.752 -10.004 -7.337 1.00 0.00 H new ATOM 0 HZ2 LYS B 10 4.886 -11.393 -7.788 1.00 0.00 H new ATOM 0 HZ3 LYS B 10 6.498 -11.528 -7.272 1.00 0.00 H new ATOM 1874 N ASP B 11 4.702 -14.226 -11.385 1.00 0.00 N ATOM 1875 CA ASP B 11 5.456 -15.420 -11.649 1.00 0.00 C ATOM 1876 C ASP B 11 5.506 -16.283 -10.383 1.00 0.00 C ATOM 1877 O ASP B 11 6.032 -15.860 -9.355 1.00 0.00 O ATOM 1878 CB ASP B 11 6.852 -15.006 -12.113 1.00 0.00 C ATOM 1879 CG ASP B 11 7.421 -15.947 -13.158 1.00 0.00 C ATOM 1880 OD1 ASP B 11 7.595 -17.144 -12.847 1.00 0.00 O ATOM 1881 OD2 ASP B 11 7.692 -15.487 -14.287 1.00 0.00 O ATOM 0 H ASP B 11 5.001 -13.730 -10.545 1.00 0.00 H new ATOM 0 HA ASP B 11 4.989 -16.018 -12.432 1.00 0.00 H new ATOM 0 HB2 ASP B 11 6.811 -13.997 -12.522 1.00 0.00 H new ATOM 0 HB3 ASP B 11 7.522 -14.975 -11.254 1.00 0.00 H new ATOM 1886 N LYS B 12 4.921 -17.479 -10.457 1.00 0.00 N ATOM 1887 CA LYS B 12 4.858 -18.394 -9.310 1.00 0.00 C ATOM 1888 C LYS B 12 6.203 -18.529 -8.588 1.00 0.00 C ATOM 1889 O LYS B 12 6.245 -18.936 -7.427 1.00 0.00 O ATOM 1890 CB LYS B 12 4.352 -19.769 -9.762 1.00 0.00 C ATOM 1891 CG LYS B 12 2.863 -19.990 -9.499 1.00 0.00 C ATOM 1892 CD LYS B 12 2.607 -21.342 -8.851 1.00 0.00 C ATOM 1893 CE LYS B 12 2.249 -22.397 -9.885 1.00 0.00 C ATOM 1894 NZ LYS B 12 3.288 -22.510 -10.946 1.00 0.00 N ATOM 0 H LYS B 12 4.481 -17.841 -11.303 1.00 0.00 H new ATOM 0 HA LYS B 12 4.158 -17.965 -8.593 1.00 0.00 H new ATOM 0 HB2 LYS B 12 4.545 -19.885 -10.828 1.00 0.00 H new ATOM 0 HB3 LYS B 12 4.922 -20.543 -9.249 1.00 0.00 H new ATOM 0 HG2 LYS B 12 2.485 -19.198 -8.853 1.00 0.00 H new ATOM 0 HG3 LYS B 12 2.313 -19.925 -10.438 1.00 0.00 H new ATOM 0 HD2 LYS B 12 3.494 -21.657 -8.301 1.00 0.00 H new ATOM 0 HD3 LYS B 12 1.798 -21.252 -8.126 1.00 0.00 H new ATOM 0 HE2 LYS B 12 2.127 -23.362 -9.392 1.00 0.00 H new ATOM 0 HE3 LYS B 12 1.291 -22.148 -10.341 1.00 0.00 H new ATOM 0 HZ1 LYS B 12 3.077 -23.327 -11.553 1.00 0.00 H new ATOM 0 HZ2 LYS B 12 3.293 -21.643 -11.521 1.00 0.00 H new ATOM 0 HZ3 LYS B 12 4.221 -22.638 -10.506 1.00 0.00 H new ATOM 1908 N SER B 13 7.297 -18.179 -9.259 1.00 0.00 N ATOM 1909 CA SER B 13 8.620 -18.261 -8.641 1.00 0.00 C ATOM 1910 C SER B 13 8.699 -17.353 -7.411 1.00 0.00 C ATOM 1911 O SER B 13 9.358 -17.679 -6.424 1.00 0.00 O ATOM 1912 CB SER B 13 9.702 -17.870 -9.649 1.00 0.00 C ATOM 1913 OG SER B 13 9.565 -16.517 -10.047 1.00 0.00 O ATOM 0 H SER B 13 7.296 -17.839 -10.221 1.00 0.00 H new ATOM 0 HA SER B 13 8.786 -19.291 -8.324 1.00 0.00 H new ATOM 0 HB2 SER B 13 10.687 -18.024 -9.208 1.00 0.00 H new ATOM 0 HB3 SER B 13 9.639 -18.517 -10.524 1.00 0.00 H new ATOM 0 HG SER B 13 10.270 -16.292 -10.690 1.00 0.00 H new ATOM 1919 N SER B 14 8.015 -16.216 -7.488 1.00 0.00 N ATOM 1920 CA SER B 14 7.980 -15.239 -6.398 1.00 0.00 C ATOM 1921 C SER B 14 7.523 -15.850 -5.099 1.00 0.00 C ATOM 1922 O SER B 14 7.886 -15.385 -4.024 1.00 0.00 O ATOM 1923 CB SER B 14 6.995 -14.126 -6.731 1.00 0.00 C ATOM 1924 OG SER B 14 6.911 -13.915 -8.130 1.00 0.00 O ATOM 0 H SER B 14 7.469 -15.943 -8.305 1.00 0.00 H new ATOM 0 HA SER B 14 8.997 -14.863 -6.287 1.00 0.00 H new ATOM 0 HB2 SER B 14 6.010 -14.380 -6.339 1.00 0.00 H new ATOM 0 HB3 SER B 14 7.305 -13.204 -6.240 1.00 0.00 H new ATOM 0 HG SER B 14 6.237 -14.515 -8.511 1.00 0.00 H new ATOM 1930 N ALA B 15 6.668 -16.845 -5.201 1.00 0.00 N ATOM 1931 CA ALA B 15 6.096 -17.452 -4.022 1.00 0.00 C ATOM 1932 C ALA B 15 7.152 -17.838 -2.996 1.00 0.00 C ATOM 1933 O ALA B 15 6.855 -17.916 -1.804 1.00 0.00 O ATOM 1934 CB ALA B 15 5.237 -18.651 -4.398 1.00 0.00 C ATOM 0 H ALA B 15 6.356 -17.248 -6.084 1.00 0.00 H new ATOM 0 HA ALA B 15 5.461 -16.701 -3.551 1.00 0.00 H new ATOM 0 HB1 ALA B 15 4.815 -19.094 -3.496 1.00 0.00 H new ATOM 0 HB2 ALA B 15 4.429 -18.328 -5.055 1.00 0.00 H new ATOM 0 HB3 ALA B 15 5.850 -19.391 -4.913 1.00 0.00 H new ATOM 1940 N LYS B 16 8.389 -18.053 -3.440 1.00 0.00 N ATOM 1941 CA LYS B 16 9.458 -18.393 -2.509 1.00 0.00 C ATOM 1942 C LYS B 16 9.456 -17.373 -1.378 1.00 0.00 C ATOM 1943 O LYS B 16 9.505 -17.722 -0.199 1.00 0.00 O ATOM 1944 CB LYS B 16 10.813 -18.398 -3.219 1.00 0.00 C ATOM 1945 CG LYS B 16 11.208 -19.761 -3.765 1.00 0.00 C ATOM 1946 CD LYS B 16 11.989 -19.635 -5.063 1.00 0.00 C ATOM 1947 CE LYS B 16 12.034 -20.955 -5.816 1.00 0.00 C ATOM 1948 NZ LYS B 16 12.369 -20.763 -7.254 1.00 0.00 N ATOM 0 H LYS B 16 8.671 -17.999 -4.419 1.00 0.00 H new ATOM 0 HA LYS B 16 9.290 -19.393 -2.109 1.00 0.00 H new ATOM 0 HB2 LYS B 16 10.787 -17.681 -4.039 1.00 0.00 H new ATOM 0 HB3 LYS B 16 11.580 -18.058 -2.523 1.00 0.00 H new ATOM 0 HG2 LYS B 16 11.810 -20.290 -3.026 1.00 0.00 H new ATOM 0 HG3 LYS B 16 10.313 -20.360 -3.934 1.00 0.00 H new ATOM 0 HD2 LYS B 16 11.531 -18.872 -5.692 1.00 0.00 H new ATOM 0 HD3 LYS B 16 13.005 -19.303 -4.847 1.00 0.00 H new ATOM 0 HE2 LYS B 16 12.773 -21.611 -5.356 1.00 0.00 H new ATOM 0 HE3 LYS B 16 11.069 -21.454 -5.732 1.00 0.00 H new ATOM 0 HZ1 LYS B 16 12.390 -21.686 -7.732 1.00 0.00 H new ATOM 0 HZ2 LYS B 16 11.650 -20.158 -7.700 1.00 0.00 H new ATOM 0 HZ3 LYS B 16 13.302 -20.310 -7.336 1.00 0.00 H new ATOM 1962 N THR B 17 9.348 -16.106 -1.766 1.00 0.00 N ATOM 1963 CA THR B 17 9.277 -15.007 -0.818 1.00 0.00 C ATOM 1964 C THR B 17 7.842 -14.492 -0.729 1.00 0.00 C ATOM 1965 O THR B 17 7.335 -14.210 0.357 1.00 0.00 O ATOM 1966 CB THR B 17 10.217 -13.874 -1.232 1.00 0.00 C ATOM 1967 OG1 THR B 17 11.557 -14.328 -1.287 1.00 0.00 O ATOM 1968 CG2 THR B 17 10.172 -12.688 -0.292 1.00 0.00 C ATOM 0 H THR B 17 9.308 -15.816 -2.743 1.00 0.00 H new ATOM 0 HA THR B 17 9.589 -15.371 0.161 1.00 0.00 H new ATOM 0 HB THR B 17 9.869 -13.554 -2.214 1.00 0.00 H new ATOM 0 HG1 THR B 17 12.142 -13.589 -1.555 1.00 0.00 H new ATOM 0 HG21 THR B 17 10.861 -11.920 -0.642 1.00 0.00 H new ATOM 0 HG22 THR B 17 9.160 -12.283 -0.265 1.00 0.00 H new ATOM 0 HG23 THR B 17 10.462 -13.006 0.709 1.00 0.00 H new ATOM 1976 N TYR B 18 7.201 -14.361 -1.892 1.00 0.00 N ATOM 1977 CA TYR B 18 5.827 -13.865 -1.971 1.00 0.00 C ATOM 1978 C TYR B 18 5.023 -14.619 -3.016 1.00 0.00 C ATOM 1979 O TYR B 18 5.347 -14.561 -4.201 1.00 0.00 O ATOM 1980 CB TYR B 18 5.832 -12.416 -2.385 1.00 0.00 C ATOM 1981 CG TYR B 18 6.756 -11.540 -1.570 1.00 0.00 C ATOM 1982 CD1 TYR B 18 6.642 -11.474 -0.187 1.00 0.00 C ATOM 1983 CD2 TYR B 18 7.743 -10.778 -2.184 1.00 0.00 C ATOM 1984 CE1 TYR B 18 7.484 -10.673 0.561 1.00 0.00 C ATOM 1985 CE2 TYR B 18 8.589 -9.976 -1.442 1.00 0.00 C ATOM 1986 CZ TYR B 18 8.456 -9.927 -0.071 1.00 0.00 C ATOM 1987 OH TYR B 18 9.296 -9.129 0.670 1.00 0.00 O ATOM 0 H TYR B 18 7.614 -14.593 -2.795 1.00 0.00 H new ATOM 0 HA TYR B 18 5.379 -14.002 -0.987 1.00 0.00 H new ATOM 0 HB2 TYR B 18 6.120 -12.351 -3.434 1.00 0.00 H new ATOM 0 HB3 TYR B 18 4.818 -12.025 -2.308 1.00 0.00 H new ATOM 0 HD1 TYR B 18 5.883 -12.058 0.312 1.00 0.00 H new ATOM 0 HD2 TYR B 18 7.850 -10.813 -3.258 1.00 0.00 H new ATOM 0 HE1 TYR B 18 7.381 -10.632 1.635 1.00 0.00 H new ATOM 0 HE2 TYR B 18 9.351 -9.390 -1.934 1.00 0.00 H new ATOM 0 HH TYR B 18 9.924 -8.671 0.073 1.00 0.00 H new ATOM 1997 N PRO B 19 3.973 -15.349 -2.620 1.00 0.00 N ATOM 1998 CA PRO B 19 3.174 -16.107 -3.563 1.00 0.00 C ATOM 1999 C PRO B 19 2.062 -15.305 -4.239 1.00 0.00 C ATOM 2000 O PRO B 19 1.866 -15.436 -5.443 1.00 0.00 O ATOM 2001 CB PRO B 19 2.575 -17.234 -2.717 1.00 0.00 C ATOM 2002 CG PRO B 19 2.953 -16.939 -1.296 1.00 0.00 C ATOM 2003 CD PRO B 19 3.495 -15.534 -1.255 1.00 0.00 C ATOM 0 HA PRO B 19 3.793 -16.447 -4.393 1.00 0.00 H new ATOM 0 HB2 PRO B 19 1.492 -17.273 -2.831 1.00 0.00 H new ATOM 0 HB3 PRO B 19 2.963 -18.203 -3.030 1.00 0.00 H new ATOM 0 HG2 PRO B 19 2.087 -17.035 -0.641 1.00 0.00 H new ATOM 0 HG3 PRO B 19 3.701 -17.649 -0.943 1.00 0.00 H new ATOM 0 HD2 PRO B 19 2.726 -14.808 -0.991 1.00 0.00 H new ATOM 0 HD3 PRO B 19 4.297 -15.428 -0.525 1.00 0.00 H new ATOM 2011 N TYR B 20 1.310 -14.500 -3.486 1.00 0.00 N ATOM 2012 CA TYR B 20 0.213 -13.742 -4.101 1.00 0.00 C ATOM 2013 C TYR B 20 -0.108 -12.429 -3.433 1.00 0.00 C ATOM 2014 O TYR B 20 0.447 -12.047 -2.404 1.00 0.00 O ATOM 2015 CB TYR B 20 -1.108 -14.526 -4.125 1.00 0.00 C ATOM 2016 CG TYR B 20 -1.108 -15.806 -3.372 1.00 0.00 C ATOM 2017 CD1 TYR B 20 -0.469 -15.917 -2.149 1.00 0.00 C ATOM 2018 CD2 TYR B 20 -1.756 -16.903 -3.899 1.00 0.00 C ATOM 2019 CE1 TYR B 20 -0.462 -17.095 -1.455 1.00 0.00 C ATOM 2020 CE2 TYR B 20 -1.764 -18.103 -3.217 1.00 0.00 C ATOM 2021 CZ TYR B 20 -1.114 -18.199 -1.995 1.00 0.00 C ATOM 2022 OH TYR B 20 -1.126 -19.393 -1.322 1.00 0.00 O ATOM 0 H TYR B 20 1.431 -14.357 -2.483 1.00 0.00 H new ATOM 0 HA TYR B 20 0.599 -13.558 -5.104 1.00 0.00 H new ATOM 0 HB2 TYR B 20 -1.895 -13.889 -3.723 1.00 0.00 H new ATOM 0 HB3 TYR B 20 -1.367 -14.736 -5.163 1.00 0.00 H new ATOM 0 HD1 TYR B 20 0.034 -15.056 -1.735 1.00 0.00 H new ATOM 0 HD2 TYR B 20 -2.260 -16.823 -4.851 1.00 0.00 H new ATOM 0 HE1 TYR B 20 0.042 -17.167 -0.502 1.00 0.00 H new ATOM 0 HE2 TYR B 20 -2.272 -18.961 -3.632 1.00 0.00 H new ATOM 0 HH TYR B 20 -0.700 -19.279 -0.447 1.00 0.00 H new ATOM 2032 N PHE B 21 -1.091 -11.794 -4.056 1.00 0.00 N ATOM 2033 CA PHE B 21 -1.657 -10.547 -3.622 1.00 0.00 C ATOM 2034 C PHE B 21 -3.111 -10.535 -4.049 1.00 0.00 C ATOM 2035 O PHE B 21 -3.541 -11.395 -4.818 1.00 0.00 O ATOM 2036 CB PHE B 21 -0.920 -9.353 -4.221 1.00 0.00 C ATOM 2037 CG PHE B 21 0.451 -9.667 -4.770 1.00 0.00 C ATOM 2038 CD1 PHE B 21 1.478 -10.038 -3.920 1.00 0.00 C ATOM 2039 CD2 PHE B 21 0.716 -9.584 -6.131 1.00 0.00 C ATOM 2040 CE1 PHE B 21 2.738 -10.323 -4.409 1.00 0.00 C ATOM 2041 CE2 PHE B 21 1.976 -9.866 -6.626 1.00 0.00 C ATOM 2042 CZ PHE B 21 2.988 -10.236 -5.763 1.00 0.00 C ATOM 0 H PHE B 21 -1.524 -12.155 -4.906 1.00 0.00 H new ATOM 0 HA PHE B 21 -1.566 -10.461 -2.539 1.00 0.00 H new ATOM 0 HB2 PHE B 21 -1.529 -8.932 -5.021 1.00 0.00 H new ATOM 0 HB3 PHE B 21 -0.822 -8.583 -3.456 1.00 0.00 H new ATOM 0 HD1 PHE B 21 1.292 -10.106 -2.858 1.00 0.00 H new ATOM 0 HD2 PHE B 21 -0.072 -9.296 -6.811 1.00 0.00 H new ATOM 0 HE1 PHE B 21 3.527 -10.614 -3.732 1.00 0.00 H new ATOM 0 HE2 PHE B 21 2.168 -9.797 -7.687 1.00 0.00 H new ATOM 0 HZ PHE B 21 3.973 -10.457 -6.147 1.00 0.00 H new ATOM 2052 N VAL B 22 -3.876 -9.593 -3.542 1.00 0.00 N ATOM 2053 CA VAL B 22 -5.284 -9.531 -3.876 1.00 0.00 C ATOM 2054 C VAL B 22 -5.714 -8.149 -4.327 1.00 0.00 C ATOM 2055 O VAL B 22 -5.746 -7.206 -3.543 1.00 0.00 O ATOM 2056 CB VAL B 22 -6.128 -9.957 -2.682 1.00 0.00 C ATOM 2057 CG1 VAL B 22 -7.609 -9.799 -2.987 1.00 0.00 C ATOM 2058 CG2 VAL B 22 -5.804 -11.388 -2.295 1.00 0.00 C ATOM 0 H VAL B 22 -3.553 -8.866 -2.904 1.00 0.00 H new ATOM 0 HA VAL B 22 -5.440 -10.216 -4.710 1.00 0.00 H new ATOM 0 HB VAL B 22 -5.889 -9.310 -1.838 1.00 0.00 H new ATOM 0 HG11 VAL B 22 -8.194 -10.109 -2.121 1.00 0.00 H new ATOM 0 HG12 VAL B 22 -7.824 -8.755 -3.216 1.00 0.00 H new ATOM 0 HG13 VAL B 22 -7.872 -10.420 -3.843 1.00 0.00 H new ATOM 0 HG21 VAL B 22 -6.414 -11.681 -1.440 1.00 0.00 H new ATOM 0 HG22 VAL B 22 -6.016 -12.049 -3.135 1.00 0.00 H new ATOM 0 HG23 VAL B 22 -4.749 -11.464 -2.031 1.00 0.00 H new ATOM 2068 N ASP B 23 -6.064 -8.054 -5.597 1.00 0.00 N ATOM 2069 CA ASP B 23 -6.515 -6.790 -6.173 1.00 0.00 C ATOM 2070 C ASP B 23 -7.731 -6.250 -5.425 1.00 0.00 C ATOM 2071 O ASP B 23 -8.823 -6.808 -5.521 1.00 0.00 O ATOM 2072 CB ASP B 23 -6.860 -6.983 -7.642 1.00 0.00 C ATOM 2073 CG ASP B 23 -5.639 -7.306 -8.482 1.00 0.00 C ATOM 2074 OD1 ASP B 23 -4.514 -7.249 -7.942 1.00 0.00 O ATOM 2075 OD2 ASP B 23 -5.805 -7.614 -9.679 1.00 0.00 O ATOM 0 H ASP B 23 -6.046 -8.835 -6.253 1.00 0.00 H new ATOM 0 HA ASP B 23 -5.705 -6.066 -6.081 1.00 0.00 H new ATOM 0 HB2 ASP B 23 -7.588 -7.788 -7.739 1.00 0.00 H new ATOM 0 HB3 ASP B 23 -7.332 -6.078 -8.024 1.00 0.00 H new ATOM 2080 N VAL B 24 -7.538 -5.166 -4.674 1.00 0.00 N ATOM 2081 CA VAL B 24 -8.635 -4.577 -3.912 1.00 0.00 C ATOM 2082 C VAL B 24 -8.383 -3.110 -3.584 1.00 0.00 C ATOM 2083 O VAL B 24 -7.624 -2.797 -2.667 1.00 0.00 O ATOM 2084 CB VAL B 24 -8.887 -5.371 -2.608 1.00 0.00 C ATOM 2085 CG1 VAL B 24 -7.580 -5.597 -1.860 1.00 0.00 C ATOM 2086 CG2 VAL B 24 -9.912 -4.675 -1.717 1.00 0.00 C ATOM 0 H VAL B 24 -6.644 -4.684 -4.578 1.00 0.00 H new ATOM 0 HA VAL B 24 -9.522 -4.631 -4.543 1.00 0.00 H new ATOM 0 HB VAL B 24 -9.300 -6.341 -2.883 1.00 0.00 H new ATOM 0 HG11 VAL B 24 -7.776 -6.157 -0.946 1.00 0.00 H new ATOM 0 HG12 VAL B 24 -6.893 -6.161 -2.491 1.00 0.00 H new ATOM 0 HG13 VAL B 24 -7.134 -4.635 -1.608 1.00 0.00 H new ATOM 0 HG21 VAL B 24 -10.064 -5.261 -0.811 1.00 0.00 H new ATOM 0 HG22 VAL B 24 -9.548 -3.683 -1.451 1.00 0.00 H new ATOM 0 HG23 VAL B 24 -10.857 -4.584 -2.252 1.00 0.00 H new ATOM 2096 N GLN B 25 -9.051 -2.214 -4.310 1.00 0.00 N ATOM 2097 CA GLN B 25 -8.917 -0.783 -4.056 1.00 0.00 C ATOM 2098 C GLN B 25 -9.664 0.059 -5.088 1.00 0.00 C ATOM 2099 O GLN B 25 -10.864 0.298 -4.951 1.00 0.00 O ATOM 2100 CB GLN B 25 -7.443 -0.371 -3.989 1.00 0.00 C ATOM 2101 CG GLN B 25 -7.215 1.134 -3.920 1.00 0.00 C ATOM 2102 CD GLN B 25 -6.218 1.619 -4.953 1.00 0.00 C ATOM 2103 OE1 GLN B 25 -6.324 1.296 -6.136 1.00 0.00 O ATOM 2104 NE2 GLN B 25 -5.239 2.399 -4.509 1.00 0.00 N ATOM 0 H GLN B 25 -9.685 -2.453 -5.072 1.00 0.00 H new ATOM 0 HA GLN B 25 -9.376 -0.590 -3.086 1.00 0.00 H new ATOM 0 HB2 GLN B 25 -6.987 -0.836 -3.115 1.00 0.00 H new ATOM 0 HB3 GLN B 25 -6.928 -0.765 -4.865 1.00 0.00 H new ATOM 0 HG2 GLN B 25 -8.164 1.649 -4.067 1.00 0.00 H new ATOM 0 HG3 GLN B 25 -6.859 1.399 -2.924 1.00 0.00 H new ATOM 0 HE21 GLN B 25 -5.189 2.642 -3.520 1.00 0.00 H new ATOM 0 HE22 GLN B 25 -4.537 2.755 -5.157 1.00 0.00 H new ATOM 2113 N SER B 26 -8.949 0.531 -6.106 1.00 0.00 N ATOM 2114 CA SER B 26 -9.566 1.373 -7.131 1.00 0.00 C ATOM 2115 C SER B 26 -10.587 0.621 -7.950 1.00 0.00 C ATOM 2116 O SER B 26 -10.228 -0.081 -8.885 1.00 0.00 O ATOM 2117 CB SER B 26 -8.538 1.941 -8.095 1.00 0.00 C ATOM 2118 OG SER B 26 -7.694 2.883 -7.456 1.00 0.00 O ATOM 0 H SER B 26 -7.955 0.349 -6.244 1.00 0.00 H new ATOM 0 HA SER B 26 -10.052 2.179 -6.582 1.00 0.00 H new ATOM 0 HB2 SER B 26 -7.936 1.131 -8.506 1.00 0.00 H new ATOM 0 HB3 SER B 26 -9.047 2.416 -8.933 1.00 0.00 H new ATOM 0 HG SER B 26 -6.892 2.430 -7.122 1.00 0.00 H new ATOM 2124 N ASP B 27 -11.860 0.808 -7.652 1.00 0.00 N ATOM 2125 CA ASP B 27 -12.889 0.168 -8.448 1.00 0.00 C ATOM 2126 C ASP B 27 -12.831 0.765 -9.849 1.00 0.00 C ATOM 2127 O ASP B 27 -13.104 0.092 -10.843 1.00 0.00 O ATOM 2128 CB ASP B 27 -14.272 0.374 -7.828 1.00 0.00 C ATOM 2129 CG ASP B 27 -14.498 -0.504 -6.613 1.00 0.00 C ATOM 2130 OD1 ASP B 27 -14.880 -1.680 -6.793 1.00 0.00 O ATOM 2131 OD2 ASP B 27 -14.293 -0.016 -5.482 1.00 0.00 O ATOM 0 H ASP B 27 -12.200 1.384 -6.882 1.00 0.00 H new ATOM 0 HA ASP B 27 -12.715 -0.907 -8.487 1.00 0.00 H new ATOM 0 HB2 ASP B 27 -14.387 1.420 -7.543 1.00 0.00 H new ATOM 0 HB3 ASP B 27 -15.037 0.160 -8.574 1.00 0.00 H new ATOM 2136 N LEU B 28 -12.436 2.040 -9.907 1.00 0.00 N ATOM 2137 CA LEU B 28 -12.294 2.749 -11.168 1.00 0.00 C ATOM 2138 C LEU B 28 -10.917 2.499 -11.755 1.00 0.00 C ATOM 2139 O LEU B 28 -10.776 2.021 -12.880 1.00 0.00 O ATOM 2140 CB LEU B 28 -12.517 4.252 -10.977 1.00 0.00 C ATOM 2141 CG LEU B 28 -13.923 4.652 -10.529 1.00 0.00 C ATOM 2142 CD1 LEU B 28 -14.297 3.930 -9.245 1.00 0.00 C ATOM 2143 CD2 LEU B 28 -14.010 6.158 -10.339 1.00 0.00 C ATOM 0 H LEU B 28 -12.209 2.600 -9.085 1.00 0.00 H new ATOM 0 HA LEU B 28 -13.050 2.374 -11.858 1.00 0.00 H new ATOM 0 HB2 LEU B 28 -11.801 4.618 -10.241 1.00 0.00 H new ATOM 0 HB3 LEU B 28 -12.295 4.758 -11.917 1.00 0.00 H new ATOM 0 HG LEU B 28 -14.630 4.361 -11.306 1.00 0.00 H new ATOM 0 HD11 LEU B 28 -15.301 4.226 -8.940 1.00 0.00 H new ATOM 0 HD12 LEU B 28 -14.272 2.853 -9.412 1.00 0.00 H new ATOM 0 HD13 LEU B 28 -13.587 4.192 -8.460 1.00 0.00 H new ATOM 0 HD21 LEU B 28 -15.017 6.427 -10.020 1.00 0.00 H new ATOM 0 HD22 LEU B 28 -13.293 6.471 -9.580 1.00 0.00 H new ATOM 0 HD23 LEU B 28 -13.782 6.657 -11.281 1.00 0.00 H new ATOM 2155 N LEU B 29 -9.906 2.816 -10.963 1.00 0.00 N ATOM 2156 CA LEU B 29 -8.518 2.626 -11.354 1.00 0.00 C ATOM 2157 C LEU B 29 -8.057 1.220 -10.987 1.00 0.00 C ATOM 2158 O LEU B 29 -6.905 1.012 -10.607 1.00 0.00 O ATOM 2159 CB LEU B 29 -7.643 3.655 -10.646 1.00 0.00 C ATOM 2160 CG LEU B 29 -8.031 5.108 -10.902 1.00 0.00 C ATOM 2161 CD1 LEU B 29 -7.527 6.002 -9.779 1.00 0.00 C ATOM 2162 CD2 LEU B 29 -7.495 5.578 -12.246 1.00 0.00 C ATOM 0 H LEU B 29 -10.024 3.212 -10.031 1.00 0.00 H new ATOM 0 HA LEU B 29 -8.431 2.756 -12.433 1.00 0.00 H new ATOM 0 HB2 LEU B 29 -7.681 3.467 -9.573 1.00 0.00 H new ATOM 0 HB3 LEU B 29 -6.609 3.509 -10.959 1.00 0.00 H new ATOM 0 HG LEU B 29 -9.119 5.173 -10.928 1.00 0.00 H new ATOM 0 HD11 LEU B 29 -7.813 7.034 -9.979 1.00 0.00 H new ATOM 0 HD12 LEU B 29 -7.965 5.681 -8.834 1.00 0.00 H new ATOM 0 HD13 LEU B 29 -6.441 5.932 -9.718 1.00 0.00 H new ATOM 0 HD21 LEU B 29 -7.783 6.617 -12.409 1.00 0.00 H new ATOM 0 HD22 LEU B 29 -6.408 5.497 -12.253 1.00 0.00 H new ATOM 0 HD23 LEU B 29 -7.910 4.957 -13.040 1.00 0.00 H new ATOM 2174 N ASP B 30 -8.975 0.265 -11.075 1.00 0.00 N ATOM 2175 CA ASP B 30 -8.678 -1.116 -10.720 1.00 0.00 C ATOM 2176 C ASP B 30 -7.579 -1.706 -11.604 1.00 0.00 C ATOM 2177 O ASP B 30 -6.520 -2.078 -11.110 1.00 0.00 O ATOM 2178 CB ASP B 30 -9.953 -1.964 -10.818 1.00 0.00 C ATOM 2179 CG ASP B 30 -10.810 -1.610 -12.021 1.00 0.00 C ATOM 2180 OD1 ASP B 30 -10.259 -1.093 -13.015 1.00 0.00 O ATOM 2181 OD2 ASP B 30 -12.035 -1.846 -11.966 1.00 0.00 O ATOM 0 H ASP B 30 -9.932 0.423 -11.390 1.00 0.00 H new ATOM 0 HA ASP B 30 -8.312 -1.127 -9.693 1.00 0.00 H new ATOM 0 HB2 ASP B 30 -9.679 -3.018 -10.872 1.00 0.00 H new ATOM 0 HB3 ASP B 30 -10.540 -1.833 -9.909 1.00 0.00 H new ATOM 2186 N ASN B 31 -7.811 -1.767 -12.907 1.00 0.00 N ATOM 2187 CA ASN B 31 -6.803 -2.291 -13.829 1.00 0.00 C ATOM 2188 C ASN B 31 -6.453 -1.259 -14.873 1.00 0.00 C ATOM 2189 O ASN B 31 -5.697 -1.531 -15.806 1.00 0.00 O ATOM 2190 CB ASN B 31 -7.284 -3.571 -14.510 1.00 0.00 C ATOM 2191 CG ASN B 31 -8.680 -3.432 -15.086 1.00 0.00 C ATOM 2192 OD1 ASN B 31 -9.331 -2.400 -14.923 1.00 0.00 O ATOM 2193 ND2 ASN B 31 -9.147 -4.474 -15.763 1.00 0.00 N ATOM 0 H ASN B 31 -8.678 -1.464 -13.351 1.00 0.00 H new ATOM 0 HA ASN B 31 -5.914 -2.526 -13.244 1.00 0.00 H new ATOM 0 HB2 ASN B 31 -6.590 -3.837 -15.307 1.00 0.00 H new ATOM 0 HB3 ASN B 31 -7.271 -4.389 -13.790 1.00 0.00 H new ATOM 0 HD21 ASN B 31 -10.080 -4.439 -16.173 1.00 0.00 H new ATOM 0 HD22 ASN B 31 -8.572 -5.310 -15.873 1.00 0.00 H new ATOM 2200 N LEU B 32 -6.999 -0.069 -14.703 1.00 0.00 N ATOM 2201 CA LEU B 32 -6.734 1.026 -15.629 1.00 0.00 C ATOM 2202 C LEU B 32 -5.252 1.103 -15.909 1.00 0.00 C ATOM 2203 O LEU B 32 -4.790 0.841 -17.020 1.00 0.00 O ATOM 2204 CB LEU B 32 -7.176 2.359 -15.040 1.00 0.00 C ATOM 2205 CG LEU B 32 -8.268 3.090 -15.824 1.00 0.00 C ATOM 2206 CD1 LEU B 32 -9.223 3.799 -14.876 1.00 0.00 C ATOM 2207 CD2 LEU B 32 -7.649 4.080 -16.799 1.00 0.00 C ATOM 0 H LEU B 32 -7.628 0.168 -13.935 1.00 0.00 H new ATOM 0 HA LEU B 32 -7.292 0.834 -16.545 1.00 0.00 H new ATOM 0 HB2 LEU B 32 -7.533 2.188 -14.024 1.00 0.00 H new ATOM 0 HB3 LEU B 32 -6.306 3.011 -14.966 1.00 0.00 H new ATOM 0 HG LEU B 32 -8.835 2.354 -16.394 1.00 0.00 H new ATOM 0 HD11 LEU B 32 -9.992 4.313 -15.452 1.00 0.00 H new ATOM 0 HD12 LEU B 32 -9.691 3.068 -14.217 1.00 0.00 H new ATOM 0 HD13 LEU B 32 -8.671 4.525 -14.279 1.00 0.00 H new ATOM 0 HD21 LEU B 32 -8.439 4.592 -17.349 1.00 0.00 H new ATOM 0 HD22 LEU B 32 -7.058 4.812 -16.248 1.00 0.00 H new ATOM 0 HD23 LEU B 32 -7.006 3.547 -17.500 1.00 0.00 H new ATOM 2219 N ASN B 33 -4.514 1.467 -14.873 1.00 0.00 N ATOM 2220 CA ASN B 33 -3.082 1.585 -14.975 1.00 0.00 C ATOM 2221 C ASN B 33 -2.374 0.755 -13.903 1.00 0.00 C ATOM 2222 O ASN B 33 -1.184 0.474 -14.027 1.00 0.00 O ATOM 2223 CB ASN B 33 -2.660 3.051 -14.861 1.00 0.00 C ATOM 2224 CG ASN B 33 -3.056 3.666 -13.533 1.00 0.00 C ATOM 2225 OD1 ASN B 33 -2.334 3.551 -12.543 1.00 0.00 O ATOM 2226 ND2 ASN B 33 -4.210 4.322 -13.506 1.00 0.00 N ATOM 0 H ASN B 33 -4.892 1.685 -13.951 1.00 0.00 H new ATOM 0 HA ASN B 33 -2.787 1.200 -15.951 1.00 0.00 H new ATOM 0 HB2 ASN B 33 -1.580 3.126 -14.985 1.00 0.00 H new ATOM 0 HB3 ASN B 33 -3.114 3.621 -15.672 1.00 0.00 H new ATOM 0 HD21 ASN B 33 -4.530 4.756 -12.640 1.00 0.00 H new ATOM 0 HD22 ASN B 33 -4.777 4.392 -14.351 1.00 0.00 H new ATOM 2233 N THR B 34 -3.110 0.358 -12.856 1.00 0.00 N ATOM 2234 CA THR B 34 -2.532 -0.442 -11.772 1.00 0.00 C ATOM 2235 C THR B 34 -3.620 -0.928 -10.826 1.00 0.00 C ATOM 2236 O THR B 34 -4.795 -0.626 -11.019 1.00 0.00 O ATOM 2237 CB THR B 34 -1.495 0.356 -10.977 1.00 0.00 C ATOM 2238 OG1 THR B 34 -1.956 1.670 -10.724 1.00 0.00 O ATOM 2239 CG2 THR B 34 -0.150 0.464 -11.662 1.00 0.00 C ATOM 0 H THR B 34 -4.099 0.577 -12.738 1.00 0.00 H new ATOM 0 HA THR B 34 -2.037 -1.298 -12.232 1.00 0.00 H new ATOM 0 HB THR B 34 -1.362 -0.203 -10.051 1.00 0.00 H new ATOM 0 HG1 THR B 34 -2.038 2.157 -11.571 1.00 0.00 H new ATOM 0 HG21 THR B 34 0.531 1.043 -11.038 1.00 0.00 H new ATOM 0 HG22 THR B 34 0.260 -0.534 -11.817 1.00 0.00 H new ATOM 0 HG23 THR B 34 -0.271 0.961 -12.625 1.00 0.00 H new ATOM 2247 N ARG B 35 -3.221 -1.669 -9.795 1.00 0.00 N ATOM 2248 CA ARG B 35 -4.171 -2.185 -8.816 1.00 0.00 C ATOM 2249 C ARG B 35 -3.523 -2.367 -7.449 1.00 0.00 C ATOM 2250 O ARG B 35 -2.348 -2.724 -7.354 1.00 0.00 O ATOM 2251 CB ARG B 35 -4.733 -3.522 -9.303 1.00 0.00 C ATOM 2252 CG ARG B 35 -5.969 -3.986 -8.549 1.00 0.00 C ATOM 2253 CD ARG B 35 -7.141 -4.285 -9.481 1.00 0.00 C ATOM 2254 NE ARG B 35 -6.954 -5.509 -10.267 1.00 0.00 N ATOM 2255 CZ ARG B 35 -6.342 -5.564 -11.451 1.00 0.00 C ATOM 2256 NH1 ARG B 35 -5.898 -4.463 -12.037 1.00 0.00 N ATOM 2257 NH2 ARG B 35 -6.203 -6.731 -12.066 1.00 0.00 N ATOM 0 H ARG B 35 -2.250 -1.924 -9.617 1.00 0.00 H new ATOM 0 HA ARG B 35 -4.977 -1.458 -8.711 1.00 0.00 H new ATOM 0 HB2 ARG B 35 -4.977 -3.438 -10.362 1.00 0.00 H new ATOM 0 HB3 ARG B 35 -3.959 -4.284 -9.214 1.00 0.00 H new ATOM 0 HG2 ARG B 35 -5.727 -4.881 -7.976 1.00 0.00 H new ATOM 0 HG3 ARG B 35 -6.264 -3.219 -7.833 1.00 0.00 H new ATOM 0 HD2 ARG B 35 -8.053 -4.375 -8.891 1.00 0.00 H new ATOM 0 HD3 ARG B 35 -7.282 -3.443 -10.159 1.00 0.00 H new ATOM 0 HE ARG B 35 -7.318 -6.380 -9.881 1.00 0.00 H new ATOM 0 HH11 ARG B 35 -6.022 -3.558 -11.583 1.00 0.00 H new ATOM 0 HH12 ARG B 35 -5.432 -4.520 -12.942 1.00 0.00 H new ATOM 0 HH21 ARG B 35 -6.563 -7.582 -11.633 1.00 0.00 H new ATOM 0 HH22 ARG B 35 -5.736 -6.778 -12.971 1.00 0.00 H new ATOM 2271 N LEU B 36 -4.299 -2.149 -6.386 1.00 0.00 N ATOM 2272 CA LEU B 36 -3.784 -2.326 -5.036 1.00 0.00 C ATOM 2273 C LEU B 36 -4.039 -3.752 -4.593 1.00 0.00 C ATOM 2274 O LEU B 36 -5.073 -4.329 -4.928 1.00 0.00 O ATOM 2275 CB LEU B 36 -4.451 -1.362 -4.062 1.00 0.00 C ATOM 2276 CG LEU B 36 -3.739 -1.196 -2.717 1.00 0.00 C ATOM 2277 CD1 LEU B 36 -2.253 -0.936 -2.922 1.00 0.00 C ATOM 2278 CD2 LEU B 36 -4.372 -0.068 -1.917 1.00 0.00 C ATOM 0 H LEU B 36 -5.274 -1.853 -6.436 1.00 0.00 H new ATOM 0 HA LEU B 36 -2.714 -2.117 -5.041 1.00 0.00 H new ATOM 0 HB2 LEU B 36 -4.526 -0.384 -4.538 1.00 0.00 H new ATOM 0 HB3 LEU B 36 -5.469 -1.705 -3.876 1.00 0.00 H new ATOM 0 HG LEU B 36 -3.848 -2.123 -2.155 1.00 0.00 H new ATOM 0 HD11 LEU B 36 -1.767 -0.821 -1.953 1.00 0.00 H new ATOM 0 HD12 LEU B 36 -1.807 -1.776 -3.455 1.00 0.00 H new ATOM 0 HD13 LEU B 36 -2.120 -0.025 -3.505 1.00 0.00 H new ATOM 0 HD21 LEU B 36 -3.854 0.037 -0.964 1.00 0.00 H new ATOM 0 HD22 LEU B 36 -4.293 0.864 -2.477 1.00 0.00 H new ATOM 0 HD23 LEU B 36 -5.423 -0.295 -1.736 1.00 0.00 H new ATOM 2290 N VAL B 37 -3.106 -4.334 -3.856 1.00 0.00 N ATOM 2291 CA VAL B 37 -3.281 -5.705 -3.414 1.00 0.00 C ATOM 2292 C VAL B 37 -2.853 -5.935 -1.982 1.00 0.00 C ATOM 2293 O VAL B 37 -1.998 -5.233 -1.441 1.00 0.00 O ATOM 2294 CB VAL B 37 -2.485 -6.700 -4.280 1.00 0.00 C ATOM 2295 CG1 VAL B 37 -3.172 -6.933 -5.615 1.00 0.00 C ATOM 2296 CG2 VAL B 37 -1.053 -6.222 -4.489 1.00 0.00 C ATOM 0 H VAL B 37 -2.238 -3.889 -3.557 1.00 0.00 H new ATOM 0 HA VAL B 37 -4.353 -5.876 -3.508 1.00 0.00 H new ATOM 0 HB VAL B 37 -2.451 -7.649 -3.746 1.00 0.00 H new ATOM 0 HG11 VAL B 37 -2.589 -7.639 -6.206 1.00 0.00 H new ATOM 0 HG12 VAL B 37 -4.169 -7.339 -5.445 1.00 0.00 H new ATOM 0 HG13 VAL B 37 -3.251 -5.988 -6.153 1.00 0.00 H new ATOM 0 HG21 VAL B 37 -0.515 -6.944 -5.104 1.00 0.00 H new ATOM 0 HG22 VAL B 37 -1.062 -5.254 -4.990 1.00 0.00 H new ATOM 0 HG23 VAL B 37 -0.557 -6.126 -3.523 1.00 0.00 H new ATOM 2306 N ILE B 38 -3.406 -6.995 -1.414 1.00 0.00 N ATOM 2307 CA ILE B 38 -3.048 -7.426 -0.085 1.00 0.00 C ATOM 2308 C ILE B 38 -2.237 -8.695 -0.276 1.00 0.00 C ATOM 2309 O ILE B 38 -2.786 -9.791 -0.389 1.00 0.00 O ATOM 2310 CB ILE B 38 -4.282 -7.719 0.793 1.00 0.00 C ATOM 2311 CG1 ILE B 38 -5.490 -6.901 0.327 1.00 0.00 C ATOM 2312 CG2 ILE B 38 -3.969 -7.420 2.247 1.00 0.00 C ATOM 2313 CD1 ILE B 38 -5.246 -5.408 0.333 1.00 0.00 C ATOM 0 H ILE B 38 -4.113 -7.575 -1.865 1.00 0.00 H new ATOM 0 HA ILE B 38 -2.494 -6.642 0.431 1.00 0.00 H new ATOM 0 HB ILE B 38 -4.532 -8.776 0.696 1.00 0.00 H new ATOM 0 HG12 ILE B 38 -5.763 -7.213 -0.681 1.00 0.00 H new ATOM 0 HG13 ILE B 38 -6.341 -7.125 0.971 1.00 0.00 H new ATOM 0 HG21 ILE B 38 -4.846 -7.630 2.859 1.00 0.00 H new ATOM 0 HG22 ILE B 38 -3.139 -8.045 2.576 1.00 0.00 H new ATOM 0 HG23 ILE B 38 -3.696 -6.370 2.352 1.00 0.00 H new ATOM 0 HD11 ILE B 38 -6.143 -4.891 -0.008 1.00 0.00 H new ATOM 0 HD12 ILE B 38 -5.003 -5.083 1.345 1.00 0.00 H new ATOM 0 HD13 ILE B 38 -4.416 -5.172 -0.333 1.00 0.00 H new ATOM 2325 N PRO B 39 -0.912 -8.543 -0.397 1.00 0.00 N ATOM 2326 CA PRO B 39 -0.007 -9.656 -0.670 1.00 0.00 C ATOM 2327 C PRO B 39 -0.133 -10.833 0.301 1.00 0.00 C ATOM 2328 O PRO B 39 0.519 -10.851 1.339 1.00 0.00 O ATOM 2329 CB PRO B 39 1.395 -9.027 -0.574 1.00 0.00 C ATOM 2330 CG PRO B 39 1.200 -7.659 -0.006 1.00 0.00 C ATOM 2331 CD PRO B 39 -0.198 -7.257 -0.359 1.00 0.00 C ATOM 0 HA PRO B 39 -0.236 -10.097 -1.640 1.00 0.00 H new ATOM 0 HB2 PRO B 39 2.047 -9.624 0.064 1.00 0.00 H new ATOM 0 HB3 PRO B 39 1.867 -8.977 -1.555 1.00 0.00 H new ATOM 0 HG2 PRO B 39 1.343 -7.662 1.075 1.00 0.00 H new ATOM 0 HG3 PRO B 39 1.924 -6.958 -0.422 1.00 0.00 H new ATOM 0 HD2 PRO B 39 -0.623 -6.581 0.383 1.00 0.00 H new ATOM 0 HD3 PRO B 39 -0.240 -6.743 -1.319 1.00 0.00 H new ATOM 2339 N LEU B 40 -0.940 -11.838 -0.054 1.00 0.00 N ATOM 2340 CA LEU B 40 -1.085 -13.025 0.796 1.00 0.00 C ATOM 2341 C LEU B 40 0.176 -13.850 0.729 1.00 0.00 C ATOM 2342 O LEU B 40 0.960 -13.732 -0.212 1.00 0.00 O ATOM 2343 CB LEU B 40 -2.272 -13.897 0.379 1.00 0.00 C ATOM 2344 CG LEU B 40 -3.401 -13.178 -0.342 1.00 0.00 C ATOM 2345 CD1 LEU B 40 -3.347 -13.459 -1.836 1.00 0.00 C ATOM 2346 CD2 LEU B 40 -4.753 -13.594 0.229 1.00 0.00 C ATOM 0 H LEU B 40 -1.495 -11.855 -0.910 1.00 0.00 H new ATOM 0 HA LEU B 40 -1.266 -12.676 1.813 1.00 0.00 H new ATOM 0 HB2 LEU B 40 -1.904 -14.694 -0.267 1.00 0.00 H new ATOM 0 HB3 LEU B 40 -2.680 -14.372 1.271 1.00 0.00 H new ATOM 0 HG LEU B 40 -3.276 -12.106 -0.188 1.00 0.00 H new ATOM 0 HD11 LEU B 40 -4.163 -12.936 -2.334 1.00 0.00 H new ATOM 0 HD12 LEU B 40 -2.395 -13.112 -2.237 1.00 0.00 H new ATOM 0 HD13 LEU B 40 -3.444 -14.531 -2.008 1.00 0.00 H new ATOM 0 HD21 LEU B 40 -5.548 -13.069 -0.300 1.00 0.00 H new ATOM 0 HD22 LEU B 40 -4.884 -14.669 0.107 1.00 0.00 H new ATOM 0 HD23 LEU B 40 -4.794 -13.342 1.289 1.00 0.00 H new ATOM 2358 N THR B 41 0.376 -14.680 1.733 1.00 0.00 N ATOM 2359 CA THR B 41 1.554 -15.513 1.775 1.00 0.00 C ATOM 2360 C THR B 41 1.353 -16.720 2.671 1.00 0.00 C ATOM 2361 O THR B 41 0.411 -16.778 3.455 1.00 0.00 O ATOM 2362 CB THR B 41 2.756 -14.682 2.192 1.00 0.00 C ATOM 2363 OG1 THR B 41 3.713 -15.456 2.892 1.00 0.00 O ATOM 2364 CG2 THR B 41 2.411 -13.488 3.060 1.00 0.00 C ATOM 0 H THR B 41 -0.258 -14.793 2.524 1.00 0.00 H new ATOM 0 HA THR B 41 1.742 -15.905 0.776 1.00 0.00 H new ATOM 0 HB THR B 41 3.164 -14.318 1.249 1.00 0.00 H new ATOM 0 HG1 THR B 41 4.472 -14.889 3.143 1.00 0.00 H new ATOM 0 HG21 THR B 41 3.323 -12.948 3.314 1.00 0.00 H new ATOM 0 HG22 THR B 41 1.736 -12.826 2.517 1.00 0.00 H new ATOM 0 HG23 THR B 41 1.925 -13.831 3.974 1.00 0.00 H new ATOM 2372 N PRO B 42 2.213 -17.732 2.531 1.00 0.00 N ATOM 2373 CA PRO B 42 2.098 -18.971 3.292 1.00 0.00 C ATOM 2374 C PRO B 42 2.323 -18.788 4.775 1.00 0.00 C ATOM 2375 O PRO B 42 3.407 -18.423 5.230 1.00 0.00 O ATOM 2376 CB PRO B 42 3.176 -19.852 2.651 1.00 0.00 C ATOM 2377 CG PRO B 42 4.184 -18.871 2.192 1.00 0.00 C ATOM 2378 CD PRO B 42 3.348 -17.790 1.589 1.00 0.00 C ATOM 0 HA PRO B 42 1.096 -19.397 3.247 1.00 0.00 H new ATOM 0 HB2 PRO B 42 3.598 -20.558 3.367 1.00 0.00 H new ATOM 0 HB3 PRO B 42 2.778 -20.438 1.823 1.00 0.00 H new ATOM 0 HG2 PRO B 42 4.791 -18.499 3.018 1.00 0.00 H new ATOM 0 HG3 PRO B 42 4.869 -19.306 1.464 1.00 0.00 H new ATOM 0 HD2 PRO B 42 3.883 -16.842 1.533 1.00 0.00 H new ATOM 0 HD3 PRO B 42 3.028 -18.036 0.577 1.00 0.00 H new ATOM 2386 N ILE B 43 1.263 -19.072 5.513 1.00 0.00 N ATOM 2387 CA ILE B 43 1.257 -18.986 6.957 1.00 0.00 C ATOM 2388 C ILE B 43 2.540 -19.569 7.540 1.00 0.00 C ATOM 2389 O ILE B 43 3.137 -19.013 8.462 1.00 0.00 O ATOM 2390 CB ILE B 43 0.039 -19.758 7.494 1.00 0.00 C ATOM 2391 CG1 ILE B 43 -1.172 -18.843 7.534 1.00 0.00 C ATOM 2392 CG2 ILE B 43 0.328 -20.383 8.851 1.00 0.00 C ATOM 2393 CD1 ILE B 43 -2.391 -19.495 8.148 1.00 0.00 C ATOM 0 H ILE B 43 0.372 -19.372 5.117 1.00 0.00 H new ATOM 0 HA ILE B 43 1.197 -17.939 7.253 1.00 0.00 H new ATOM 0 HB ILE B 43 -0.180 -20.583 6.817 1.00 0.00 H new ATOM 0 HG12 ILE B 43 -0.923 -17.946 8.101 1.00 0.00 H new ATOM 0 HG13 ILE B 43 -1.411 -18.523 6.520 1.00 0.00 H new ATOM 0 HG21 ILE B 43 -0.554 -20.920 9.200 1.00 0.00 H new ATOM 0 HG22 ILE B 43 1.164 -21.077 8.761 1.00 0.00 H new ATOM 0 HG23 ILE B 43 0.582 -19.600 9.566 1.00 0.00 H new ATOM 0 HD11 ILE B 43 -3.221 -18.789 8.147 1.00 0.00 H new ATOM 0 HD12 ILE B 43 -2.664 -20.376 7.567 1.00 0.00 H new ATOM 0 HD13 ILE B 43 -2.168 -19.791 9.173 1.00 0.00 H new ATOM 2405 N GLU B 44 2.946 -20.695 6.979 1.00 0.00 N ATOM 2406 CA GLU B 44 4.148 -21.391 7.404 1.00 0.00 C ATOM 2407 C GLU B 44 5.358 -20.461 7.408 1.00 0.00 C ATOM 2408 O GLU B 44 6.235 -20.571 8.265 1.00 0.00 O ATOM 2409 CB GLU B 44 4.384 -22.570 6.467 1.00 0.00 C ATOM 2410 CG GLU B 44 4.251 -23.927 7.141 1.00 0.00 C ATOM 2411 CD GLU B 44 5.087 -24.041 8.402 1.00 0.00 C ATOM 2412 OE1 GLU B 44 5.870 -23.109 8.682 1.00 0.00 O ATOM 2413 OE2 GLU B 44 4.959 -25.063 9.108 1.00 0.00 O ATOM 0 H GLU B 44 2.450 -21.153 6.214 1.00 0.00 H new ATOM 0 HA GLU B 44 4.012 -21.747 8.425 1.00 0.00 H new ATOM 0 HB2 GLU B 44 3.674 -22.514 5.642 1.00 0.00 H new ATOM 0 HB3 GLU B 44 5.382 -22.485 6.036 1.00 0.00 H new ATOM 0 HG2 GLU B 44 3.204 -24.104 7.387 1.00 0.00 H new ATOM 0 HG3 GLU B 44 4.550 -24.707 6.440 1.00 0.00 H new ATOM 2420 N LEU B 45 5.399 -19.545 6.447 1.00 0.00 N ATOM 2421 CA LEU B 45 6.501 -18.596 6.344 1.00 0.00 C ATOM 2422 C LEU B 45 6.421 -17.545 7.448 1.00 0.00 C ATOM 2423 O LEU B 45 7.433 -16.958 7.833 1.00 0.00 O ATOM 2424 CB LEU B 45 6.490 -17.913 4.974 1.00 0.00 C ATOM 2425 CG LEU B 45 7.120 -18.725 3.841 1.00 0.00 C ATOM 2426 CD1 LEU B 45 7.133 -17.919 2.551 1.00 0.00 C ATOM 2427 CD2 LEU B 45 8.530 -19.157 4.216 1.00 0.00 C ATOM 0 H LEU B 45 4.682 -19.440 5.729 1.00 0.00 H new ATOM 0 HA LEU B 45 7.433 -19.149 6.459 1.00 0.00 H new ATOM 0 HB2 LEU B 45 5.458 -17.685 4.707 1.00 0.00 H new ATOM 0 HB3 LEU B 45 7.016 -16.962 5.055 1.00 0.00 H new ATOM 0 HG LEU B 45 6.518 -19.619 3.681 1.00 0.00 H new ATOM 0 HD11 LEU B 45 7.585 -18.512 1.756 1.00 0.00 H new ATOM 0 HD12 LEU B 45 6.111 -17.659 2.274 1.00 0.00 H new ATOM 0 HD13 LEU B 45 7.712 -17.007 2.697 1.00 0.00 H new ATOM 0 HD21 LEU B 45 8.963 -19.734 3.399 1.00 0.00 H new ATOM 0 HD22 LEU B 45 9.143 -18.275 4.403 1.00 0.00 H new ATOM 0 HD23 LEU B 45 8.495 -19.772 5.115 1.00 0.00 H new ATOM 2439 N LEU B 46 5.213 -17.311 7.954 1.00 0.00 N ATOM 2440 CA LEU B 46 5.006 -16.329 9.013 1.00 0.00 C ATOM 2441 C LEU B 46 4.427 -16.985 10.264 1.00 0.00 C ATOM 2442 O LEU B 46 3.495 -16.463 10.875 1.00 0.00 O ATOM 2443 CB LEU B 46 4.075 -15.216 8.527 1.00 0.00 C ATOM 2444 CG LEU B 46 4.396 -13.822 9.068 1.00 0.00 C ATOM 2445 CD1 LEU B 46 5.403 -13.120 8.170 1.00 0.00 C ATOM 2446 CD2 LEU B 46 3.125 -12.996 9.195 1.00 0.00 C ATOM 0 H LEU B 46 4.364 -17.787 7.648 1.00 0.00 H new ATOM 0 HA LEU B 46 5.974 -15.899 9.269 1.00 0.00 H new ATOM 0 HB2 LEU B 46 4.110 -15.183 7.438 1.00 0.00 H new ATOM 0 HB3 LEU B 46 3.052 -15.471 8.806 1.00 0.00 H new ATOM 0 HG LEU B 46 4.837 -13.929 10.059 1.00 0.00 H new ATOM 0 HD11 LEU B 46 5.619 -12.130 8.571 1.00 0.00 H new ATOM 0 HD12 LEU B 46 6.323 -13.704 8.129 1.00 0.00 H new ATOM 0 HD13 LEU B 46 4.990 -13.023 7.166 1.00 0.00 H new ATOM 0 HD21 LEU B 46 3.371 -12.007 9.581 1.00 0.00 H new ATOM 0 HD22 LEU B 46 2.656 -12.897 8.216 1.00 0.00 H new ATOM 0 HD23 LEU B 46 2.436 -13.492 9.879 1.00 0.00 H new ATOM 2458 N ASP B 47 4.986 -18.134 10.639 1.00 0.00 N ATOM 2459 CA ASP B 47 4.530 -18.865 11.816 1.00 0.00 C ATOM 2460 C ASP B 47 3.256 -19.619 11.530 1.00 0.00 C ATOM 2461 O ASP B 47 2.232 -19.050 11.151 1.00 0.00 O ATOM 2462 CB ASP B 47 4.343 -17.937 13.017 1.00 0.00 C ATOM 2463 CG ASP B 47 5.404 -16.855 13.091 1.00 0.00 C ATOM 2464 OD1 ASP B 47 6.563 -17.181 13.421 1.00 0.00 O ATOM 2465 OD2 ASP B 47 5.074 -15.681 12.820 1.00 0.00 O ATOM 0 H ASP B 47 5.758 -18.579 10.142 1.00 0.00 H new ATOM 0 HA ASP B 47 5.307 -19.587 12.067 1.00 0.00 H new ATOM 0 HB2 ASP B 47 3.359 -17.472 12.962 1.00 0.00 H new ATOM 0 HB3 ASP B 47 4.366 -18.526 13.934 1.00 0.00 H new ATOM 2470 N LYS B 48 3.357 -20.918 11.711 1.00 0.00 N ATOM 2471 CA LYS B 48 2.260 -21.828 11.480 1.00 0.00 C ATOM 2472 C LYS B 48 1.454 -22.058 12.758 1.00 0.00 C ATOM 2473 O LYS B 48 0.840 -23.110 12.933 1.00 0.00 O ATOM 2474 CB LYS B 48 2.838 -23.140 10.971 1.00 0.00 C ATOM 2475 CG LYS B 48 2.300 -23.567 9.615 1.00 0.00 C ATOM 2476 CD LYS B 48 0.804 -23.827 9.657 1.00 0.00 C ATOM 2477 CE LYS B 48 0.452 -24.920 10.655 1.00 0.00 C ATOM 2478 NZ LYS B 48 -0.335 -26.015 10.023 1.00 0.00 N ATOM 0 H LYS B 48 4.213 -21.375 12.026 1.00 0.00 H new ATOM 0 HA LYS B 48 1.578 -21.402 10.744 1.00 0.00 H new ATOM 0 HB2 LYS B 48 3.922 -23.047 10.908 1.00 0.00 H new ATOM 0 HB3 LYS B 48 2.627 -23.925 11.698 1.00 0.00 H new ATOM 0 HG2 LYS B 48 2.513 -22.792 8.879 1.00 0.00 H new ATOM 0 HG3 LYS B 48 2.816 -24.469 9.287 1.00 0.00 H new ATOM 0 HD2 LYS B 48 0.282 -22.908 9.924 1.00 0.00 H new ATOM 0 HD3 LYS B 48 0.456 -24.114 8.665 1.00 0.00 H new ATOM 0 HE2 LYS B 48 1.367 -25.330 11.082 1.00 0.00 H new ATOM 0 HE3 LYS B 48 -0.119 -24.490 11.478 1.00 0.00 H new ATOM 0 HZ1 LYS B 48 -0.555 -26.740 10.735 1.00 0.00 H new ATOM 0 HZ2 LYS B 48 -1.220 -25.628 9.637 1.00 0.00 H new ATOM 0 HZ3 LYS B 48 0.220 -26.442 9.254 1.00 0.00 H new ATOM 2492 N LYS B 49 1.466 -21.072 13.650 1.00 0.00 N ATOM 2493 CA LYS B 49 0.743 -21.173 14.912 1.00 0.00 C ATOM 2494 C LYS B 49 0.120 -19.833 15.294 1.00 0.00 C ATOM 2495 O LYS B 49 -1.089 -19.642 15.169 1.00 0.00 O ATOM 2496 CB LYS B 49 1.678 -21.652 16.029 1.00 0.00 C ATOM 2497 CG LYS B 49 3.138 -21.277 15.815 1.00 0.00 C ATOM 2498 CD LYS B 49 3.799 -20.843 17.114 1.00 0.00 C ATOM 2499 CE LYS B 49 5.277 -20.549 16.915 1.00 0.00 C ATOM 2500 NZ LYS B 49 6.091 -21.795 16.874 1.00 0.00 N ATOM 0 H LYS B 49 1.969 -20.194 13.522 1.00 0.00 H new ATOM 0 HA LYS B 49 -0.057 -21.901 14.782 1.00 0.00 H new ATOM 0 HB2 LYS B 49 1.341 -21.232 16.977 1.00 0.00 H new ATOM 0 HB3 LYS B 49 1.600 -22.736 16.115 1.00 0.00 H new ATOM 0 HG2 LYS B 49 3.676 -22.129 15.399 1.00 0.00 H new ATOM 0 HG3 LYS B 49 3.204 -20.470 15.085 1.00 0.00 H new ATOM 0 HD2 LYS B 49 3.299 -19.954 17.499 1.00 0.00 H new ATOM 0 HD3 LYS B 49 3.680 -21.626 17.863 1.00 0.00 H new ATOM 0 HE2 LYS B 49 5.415 -19.995 15.987 1.00 0.00 H new ATOM 0 HE3 LYS B 49 5.632 -19.910 17.724 1.00 0.00 H new ATOM 0 HZ1 LYS B 49 7.093 -21.551 16.737 1.00 0.00 H new ATOM 0 HZ2 LYS B 49 5.980 -22.312 17.770 1.00 0.00 H new ATOM 0 HZ3 LYS B 49 5.770 -22.394 16.087 1.00 0.00 H new ATOM 2514 N ALA B 50 0.954 -18.910 15.762 1.00 0.00 N ATOM 2515 CA ALA B 50 0.487 -17.589 16.166 1.00 0.00 C ATOM 2516 C ALA B 50 -0.218 -16.876 15.012 1.00 0.00 C ATOM 2517 O ALA B 50 0.422 -16.465 14.045 1.00 0.00 O ATOM 2518 CB ALA B 50 1.653 -16.751 16.668 1.00 0.00 C ATOM 0 H ALA B 50 1.958 -19.053 15.871 1.00 0.00 H new ATOM 0 HA ALA B 50 -0.233 -17.717 16.974 1.00 0.00 H new ATOM 0 HB1 ALA B 50 1.292 -15.767 16.967 1.00 0.00 H new ATOM 0 HB2 ALA B 50 2.113 -17.244 17.524 1.00 0.00 H new ATOM 0 HB3 ALA B 50 2.391 -16.641 15.873 1.00 0.00 H new ATOM 2524 N PRO B 51 -1.552 -16.716 15.098 1.00 0.00 N ATOM 2525 CA PRO B 51 -2.333 -16.046 14.053 1.00 0.00 C ATOM 2526 C PRO B 51 -2.087 -14.541 14.023 1.00 0.00 C ATOM 2527 O PRO B 51 -1.424 -13.993 14.904 1.00 0.00 O ATOM 2528 CB PRO B 51 -3.780 -16.343 14.446 1.00 0.00 C ATOM 2529 CG PRO B 51 -3.737 -16.541 15.921 1.00 0.00 C ATOM 2530 CD PRO B 51 -2.403 -17.171 16.215 1.00 0.00 C ATOM 0 HA PRO B 51 -2.068 -16.398 13.056 1.00 0.00 H new ATOM 0 HB2 PRO B 51 -4.441 -15.519 14.176 1.00 0.00 H new ATOM 0 HB3 PRO B 51 -4.154 -17.232 13.938 1.00 0.00 H new ATOM 0 HG2 PRO B 51 -3.844 -15.592 16.446 1.00 0.00 H new ATOM 0 HG3 PRO B 51 -4.553 -17.183 16.253 1.00 0.00 H new ATOM 0 HD2 PRO B 51 -2.009 -16.845 17.178 1.00 0.00 H new ATOM 0 HD3 PRO B 51 -2.472 -18.258 16.250 1.00 0.00 H new ATOM 2538 N SER B 52 -2.624 -13.878 13.004 1.00 0.00 N ATOM 2539 CA SER B 52 -2.463 -12.436 12.861 1.00 0.00 C ATOM 2540 C SER B 52 -3.813 -11.728 12.912 1.00 0.00 C ATOM 2541 O SER B 52 -4.750 -12.106 12.209 1.00 0.00 O ATOM 2542 CB SER B 52 -1.754 -12.110 11.545 1.00 0.00 C ATOM 2543 OG SER B 52 -1.749 -10.714 11.300 1.00 0.00 O ATOM 0 H SER B 52 -3.174 -14.316 12.265 1.00 0.00 H new ATOM 0 HA SER B 52 -1.855 -12.080 13.693 1.00 0.00 H new ATOM 0 HB2 SER B 52 -0.729 -12.480 11.579 1.00 0.00 H new ATOM 0 HB3 SER B 52 -2.252 -12.625 10.723 1.00 0.00 H new ATOM 0 HG SER B 52 -0.893 -10.455 10.900 1.00 0.00 H new ATOM 2549 N HIS B 53 -3.905 -10.700 13.750 1.00 0.00 N ATOM 2550 CA HIS B 53 -5.141 -9.939 13.893 1.00 0.00 C ATOM 2551 C HIS B 53 -5.547 -9.308 12.565 1.00 0.00 C ATOM 2552 O HIS B 53 -6.516 -9.732 11.935 1.00 0.00 O ATOM 2553 CB HIS B 53 -4.977 -8.854 14.958 1.00 0.00 C ATOM 2554 CG HIS B 53 -4.680 -9.395 16.322 1.00 0.00 C ATOM 2555 ND1 HIS B 53 -5.458 -10.352 16.938 1.00 0.00 N ATOM 2556 CD2 HIS B 53 -3.682 -9.108 17.191 1.00 0.00 C ATOM 2557 CE1 HIS B 53 -4.953 -10.630 18.127 1.00 0.00 C ATOM 2558 NE2 HIS B 53 -3.875 -9.889 18.304 1.00 0.00 N ATOM 0 H HIS B 53 -3.139 -10.375 14.340 1.00 0.00 H new ATOM 0 HA HIS B 53 -5.928 -10.626 14.204 1.00 0.00 H new ATOM 0 HB2 HIS B 53 -4.172 -8.182 14.659 1.00 0.00 H new ATOM 0 HB3 HIS B 53 -5.889 -8.259 15.003 1.00 0.00 H new ATOM 0 HD2 HIS B 53 -2.883 -8.397 17.037 1.00 0.00 H new ATOM 0 HE1 HIS B 53 -5.354 -11.342 18.833 1.00 0.00 H new ATOM 0 HE2 HIS B 53 -3.281 -9.895 19.133 1.00 0.00 H new ATOM 2567 N LEU B 54 -4.799 -8.293 12.145 1.00 0.00 N ATOM 2568 CA LEU B 54 -5.079 -7.604 10.891 1.00 0.00 C ATOM 2569 C LEU B 54 -5.004 -8.571 9.712 1.00 0.00 C ATOM 2570 O LEU B 54 -6.016 -8.868 9.078 1.00 0.00 O ATOM 2571 CB LEU B 54 -4.095 -6.451 10.689 1.00 0.00 C ATOM 2572 CG LEU B 54 -4.598 -5.316 9.795 1.00 0.00 C ATOM 2573 CD1 LEU B 54 -5.522 -4.392 10.575 1.00 0.00 C ATOM 2574 CD2 LEU B 54 -3.424 -4.539 9.213 1.00 0.00 C ATOM 0 H LEU B 54 -3.994 -7.929 12.655 1.00 0.00 H new ATOM 0 HA LEU B 54 -6.091 -7.201 10.942 1.00 0.00 H new ATOM 0 HB2 LEU B 54 -3.839 -6.038 11.665 1.00 0.00 H new ATOM 0 HB3 LEU B 54 -3.176 -6.850 10.260 1.00 0.00 H new ATOM 0 HG LEU B 54 -5.165 -5.749 8.971 1.00 0.00 H new ATOM 0 HD11 LEU B 54 -5.870 -3.591 9.923 1.00 0.00 H new ATOM 0 HD12 LEU B 54 -6.378 -4.959 10.942 1.00 0.00 H new ATOM 0 HD13 LEU B 54 -4.981 -3.964 11.419 1.00 0.00 H new ATOM 0 HD21 LEU B 54 -3.798 -3.735 8.579 1.00 0.00 H new ATOM 0 HD22 LEU B 54 -2.830 -4.116 10.023 1.00 0.00 H new ATOM 0 HD23 LEU B 54 -2.802 -5.209 8.619 1.00 0.00 H new ATOM 2586 N CYS B 55 -3.801 -9.062 9.429 1.00 0.00 N ATOM 2587 CA CYS B 55 -3.594 -10.000 8.329 1.00 0.00 C ATOM 2588 C CYS B 55 -4.380 -11.289 8.563 1.00 0.00 C ATOM 2589 O CYS B 55 -4.027 -12.088 9.430 1.00 0.00 O ATOM 2590 CB CYS B 55 -2.105 -10.321 8.184 1.00 0.00 C ATOM 2591 SG CYS B 55 -1.039 -8.862 8.113 1.00 0.00 S ATOM 0 H CYS B 55 -2.954 -8.826 9.946 1.00 0.00 H new ATOM 0 HA CYS B 55 -3.953 -9.535 7.411 1.00 0.00 H new ATOM 0 HB2 CYS B 55 -1.795 -10.944 9.023 1.00 0.00 H new ATOM 0 HB3 CYS B 55 -1.958 -10.910 7.279 1.00 0.00 H new ATOM 0 HG CYS B 55 -1.719 -7.849 7.664 1.00 0.00 H new ATOM 2597 N PRO B 56 -5.468 -11.508 7.800 1.00 0.00 N ATOM 2598 CA PRO B 56 -6.302 -12.688 7.933 1.00 0.00 C ATOM 2599 C PRO B 56 -5.957 -13.772 6.918 1.00 0.00 C ATOM 2600 O PRO B 56 -5.828 -13.501 5.724 1.00 0.00 O ATOM 2601 CB PRO B 56 -7.688 -12.117 7.650 1.00 0.00 C ATOM 2602 CG PRO B 56 -7.457 -11.003 6.670 1.00 0.00 C ATOM 2603 CD PRO B 56 -5.992 -10.625 6.750 1.00 0.00 C ATOM 0 HA PRO B 56 -6.192 -13.177 8.901 1.00 0.00 H new ATOM 0 HB2 PRO B 56 -8.351 -12.877 7.235 1.00 0.00 H new ATOM 0 HB3 PRO B 56 -8.157 -11.749 8.562 1.00 0.00 H new ATOM 0 HG2 PRO B 56 -7.717 -11.320 5.660 1.00 0.00 H new ATOM 0 HG3 PRO B 56 -8.088 -10.146 6.907 1.00 0.00 H new ATOM 0 HD2 PRO B 56 -5.483 -10.786 5.799 1.00 0.00 H new ATOM 0 HD3 PRO B 56 -5.862 -9.574 7.007 1.00 0.00 H new ATOM 2611 N THR B 57 -5.818 -15.001 7.399 1.00 0.00 N ATOM 2612 CA THR B 57 -5.500 -16.130 6.535 1.00 0.00 C ATOM 2613 C THR B 57 -6.672 -16.493 5.675 1.00 0.00 C ATOM 2614 O THR B 57 -7.813 -16.130 5.961 1.00 0.00 O ATOM 2615 CB THR B 57 -5.131 -17.365 7.355 1.00 0.00 C ATOM 2616 OG1 THR B 57 -3.798 -17.287 7.821 1.00 0.00 O ATOM 2617 CG2 THR B 57 -5.287 -18.683 6.605 1.00 0.00 C ATOM 0 H THR B 57 -5.921 -15.241 8.385 1.00 0.00 H new ATOM 0 HA THR B 57 -4.656 -15.823 5.917 1.00 0.00 H new ATOM 0 HB THR B 57 -5.840 -17.364 8.183 1.00 0.00 H new ATOM 0 HG1 THR B 57 -3.794 -17.280 8.801 1.00 0.00 H new ATOM 0 HG21 THR B 57 -5.005 -19.509 7.258 1.00 0.00 H new ATOM 0 HG22 THR B 57 -6.325 -18.804 6.294 1.00 0.00 H new ATOM 0 HG23 THR B 57 -4.643 -18.680 5.726 1.00 0.00 H new ATOM 2625 N ILE B 58 -6.389 -17.268 4.643 1.00 0.00 N ATOM 2626 CA ILE B 58 -7.430 -17.732 3.789 1.00 0.00 C ATOM 2627 C ILE B 58 -7.439 -19.238 3.668 1.00 0.00 C ATOM 2628 O ILE B 58 -6.562 -19.927 4.183 1.00 0.00 O ATOM 2629 CB ILE B 58 -7.345 -17.169 2.370 1.00 0.00 C ATOM 2630 CG1 ILE B 58 -6.022 -17.593 1.740 1.00 0.00 C ATOM 2631 CG2 ILE B 58 -7.514 -15.654 2.374 1.00 0.00 C ATOM 2632 CD1 ILE B 58 -4.881 -16.720 2.177 1.00 0.00 C ATOM 0 H ILE B 58 -5.451 -17.579 4.390 1.00 0.00 H new ATOM 0 HA ILE B 58 -8.343 -17.378 4.267 1.00 0.00 H new ATOM 0 HB ILE B 58 -8.159 -17.573 1.768 1.00 0.00 H new ATOM 0 HG12 ILE B 58 -5.809 -18.628 2.008 1.00 0.00 H new ATOM 0 HG13 ILE B 58 -6.110 -17.557 0.654 1.00 0.00 H new ATOM 0 HG21 ILE B 58 -7.450 -15.278 1.353 1.00 0.00 H new ATOM 0 HG22 ILE B 58 -8.486 -15.397 2.794 1.00 0.00 H new ATOM 0 HG23 ILE B 58 -6.727 -15.202 2.977 1.00 0.00 H new ATOM 0 HD11 ILE B 58 -3.960 -17.060 1.703 1.00 0.00 H new ATOM 0 HD12 ILE B 58 -5.080 -15.689 1.886 1.00 0.00 H new ATOM 0 HD13 ILE B 58 -4.774 -16.777 3.260 1.00 0.00 H new ATOM 2644 N HIS B 59 -8.412 -19.728 2.919 1.00 0.00 N ATOM 2645 CA HIS B 59 -8.510 -21.142 2.642 1.00 0.00 C ATOM 2646 C HIS B 59 -8.722 -21.324 1.156 1.00 0.00 C ATOM 2647 O HIS B 59 -9.849 -21.461 0.680 1.00 0.00 O ATOM 2648 CB HIS B 59 -9.651 -21.789 3.404 1.00 0.00 C ATOM 2649 CG HIS B 59 -9.834 -21.262 4.794 1.00 0.00 C ATOM 2650 ND1 HIS B 59 -8.781 -20.930 5.619 1.00 0.00 N ATOM 2651 CD2 HIS B 59 -10.960 -21.010 5.504 1.00 0.00 C ATOM 2652 CE1 HIS B 59 -9.249 -20.497 6.776 1.00 0.00 C ATOM 2653 NE2 HIS B 59 -10.568 -20.536 6.732 1.00 0.00 N ATOM 0 H HIS B 59 -9.145 -19.161 2.493 1.00 0.00 H new ATOM 0 HA HIS B 59 -7.588 -21.625 2.965 1.00 0.00 H new ATOM 0 HB2 HIS B 59 -10.576 -21.642 2.846 1.00 0.00 H new ATOM 0 HB3 HIS B 59 -9.477 -22.864 3.454 1.00 0.00 H new ATOM 0 HD1 HIS B 59 -7.794 -21.007 5.374 1.00 0.00 H new ATOM 0 HD2 HIS B 59 -11.976 -21.155 5.167 1.00 0.00 H new ATOM 0 HE1 HIS B 59 -8.654 -20.167 7.615 1.00 0.00 H new ATOM 2662 N ILE B 60 -7.626 -21.298 0.436 1.00 0.00 N ATOM 2663 CA ILE B 60 -7.654 -21.431 -1.010 1.00 0.00 C ATOM 2664 C ILE B 60 -7.043 -22.753 -1.471 1.00 0.00 C ATOM 2665 O ILE B 60 -6.654 -23.588 -0.655 1.00 0.00 O ATOM 2666 CB ILE B 60 -6.918 -20.251 -1.662 1.00 0.00 C ATOM 2667 CG1 ILE B 60 -5.464 -20.205 -1.183 1.00 0.00 C ATOM 2668 CG2 ILE B 60 -7.635 -18.951 -1.317 1.00 0.00 C ATOM 2669 CD1 ILE B 60 -4.468 -19.946 -2.290 1.00 0.00 C ATOM 0 H ILE B 60 -6.691 -21.185 0.829 1.00 0.00 H new ATOM 0 HA ILE B 60 -8.698 -21.424 -1.323 1.00 0.00 H new ATOM 0 HB ILE B 60 -6.918 -20.380 -2.744 1.00 0.00 H new ATOM 0 HG12 ILE B 60 -5.364 -19.426 -0.427 1.00 0.00 H new ATOM 0 HG13 ILE B 60 -5.220 -21.151 -0.700 1.00 0.00 H new ATOM 0 HG21 ILE B 60 -7.113 -18.114 -1.780 1.00 0.00 H new ATOM 0 HG22 ILE B 60 -8.659 -18.990 -1.689 1.00 0.00 H new ATOM 0 HG23 ILE B 60 -7.647 -18.818 -0.235 1.00 0.00 H new ATOM 0 HD11 ILE B 60 -3.460 -19.927 -1.876 1.00 0.00 H new ATOM 0 HD12 ILE B 60 -4.539 -20.738 -3.036 1.00 0.00 H new ATOM 0 HD13 ILE B 60 -4.686 -18.986 -2.758 1.00 0.00 H new ATOM 2681 N ASP B 61 -6.982 -22.942 -2.788 1.00 0.00 N ATOM 2682 CA ASP B 61 -6.442 -24.169 -3.372 1.00 0.00 C ATOM 2683 C ASP B 61 -5.094 -24.544 -2.767 1.00 0.00 C ATOM 2684 O ASP B 61 -4.871 -25.698 -2.399 1.00 0.00 O ATOM 2685 CB ASP B 61 -6.306 -24.016 -4.888 1.00 0.00 C ATOM 2686 CG ASP B 61 -7.651 -23.954 -5.586 1.00 0.00 C ATOM 2687 OD1 ASP B 61 -8.439 -23.036 -5.274 1.00 0.00 O ATOM 2688 OD2 ASP B 61 -7.916 -24.822 -6.444 1.00 0.00 O ATOM 0 H ASP B 61 -7.301 -22.258 -3.474 1.00 0.00 H new ATOM 0 HA ASP B 61 -7.142 -24.973 -3.146 1.00 0.00 H new ATOM 0 HB2 ASP B 61 -5.743 -23.110 -5.110 1.00 0.00 H new ATOM 0 HB3 ASP B 61 -5.732 -24.853 -5.285 1.00 0.00 H new ATOM 2693 N GLU B 62 -4.197 -23.572 -2.665 1.00 0.00 N ATOM 2694 CA GLU B 62 -2.873 -23.817 -2.102 1.00 0.00 C ATOM 2695 C GLU B 62 -2.954 -24.137 -0.609 1.00 0.00 C ATOM 2696 O GLU B 62 -1.951 -24.497 0.008 1.00 0.00 O ATOM 2697 CB GLU B 62 -1.965 -22.606 -2.326 1.00 0.00 C ATOM 2698 CG GLU B 62 -2.057 -22.025 -3.728 1.00 0.00 C ATOM 2699 CD GLU B 62 -0.775 -22.202 -4.518 1.00 0.00 C ATOM 2700 OE1 GLU B 62 0.305 -21.884 -3.977 1.00 0.00 O ATOM 2701 OE2 GLU B 62 -0.851 -22.659 -5.678 1.00 0.00 O ATOM 0 H GLU B 62 -4.360 -22.610 -2.963 1.00 0.00 H new ATOM 0 HA GLU B 62 -2.450 -24.681 -2.614 1.00 0.00 H new ATOM 0 HB2 GLU B 62 -2.222 -21.831 -1.604 1.00 0.00 H new ATOM 0 HB3 GLU B 62 -0.933 -22.895 -2.129 1.00 0.00 H new ATOM 0 HG2 GLU B 62 -2.878 -22.504 -4.262 1.00 0.00 H new ATOM 0 HG3 GLU B 62 -2.295 -20.963 -3.662 1.00 0.00 H new ATOM 2708 N GLY B 63 -4.145 -24.001 -0.029 1.00 0.00 N ATOM 2709 CA GLY B 63 -4.316 -24.277 1.385 1.00 0.00 C ATOM 2710 C GLY B 63 -4.698 -23.038 2.168 1.00 0.00 C ATOM 2711 O GLY B 63 -5.769 -22.469 1.955 1.00 0.00 O ATOM 0 H GLY B 63 -4.992 -23.705 -0.514 1.00 0.00 H new ATOM 0 HA2 GLY B 63 -5.086 -25.038 1.514 1.00 0.00 H new ATOM 0 HA3 GLY B 63 -3.390 -24.688 1.788 1.00 0.00 H new ATOM 2715 N ASP B 64 -3.821 -22.613 3.072 1.00 0.00 N ATOM 2716 CA ASP B 64 -4.078 -21.427 3.880 1.00 0.00 C ATOM 2717 C ASP B 64 -2.861 -20.509 3.903 1.00 0.00 C ATOM 2718 O ASP B 64 -1.753 -20.924 4.242 1.00 0.00 O ATOM 2719 CB ASP B 64 -4.457 -21.826 5.308 1.00 0.00 C ATOM 2720 CG ASP B 64 -5.823 -22.480 5.383 1.00 0.00 C ATOM 2721 OD1 ASP B 64 -6.136 -23.304 4.498 1.00 0.00 O ATOM 2722 OD2 ASP B 64 -6.579 -22.168 6.327 1.00 0.00 O ATOM 0 H ASP B 64 -2.930 -23.070 3.263 1.00 0.00 H new ATOM 0 HA ASP B 64 -4.910 -20.887 3.429 1.00 0.00 H new ATOM 0 HB2 ASP B 64 -3.707 -22.512 5.702 1.00 0.00 H new ATOM 0 HB3 ASP B 64 -4.445 -20.941 5.945 1.00 0.00 H new ATOM 2727 N PHE B 65 -3.092 -19.259 3.532 1.00 0.00 N ATOM 2728 CA PHE B 65 -2.047 -18.244 3.490 1.00 0.00 C ATOM 2729 C PHE B 65 -2.522 -17.014 4.264 1.00 0.00 C ATOM 2730 O PHE B 65 -3.558 -17.083 4.915 1.00 0.00 O ATOM 2731 CB PHE B 65 -1.680 -17.933 2.036 1.00 0.00 C ATOM 2732 CG PHE B 65 -1.039 -19.112 1.348 1.00 0.00 C ATOM 2733 CD1 PHE B 65 -1.740 -20.296 1.186 1.00 0.00 C ATOM 2734 CD2 PHE B 65 0.265 -19.048 0.884 1.00 0.00 C ATOM 2735 CE1 PHE B 65 -1.154 -21.389 0.577 1.00 0.00 C ATOM 2736 CE2 PHE B 65 0.855 -20.137 0.270 1.00 0.00 C ATOM 2737 CZ PHE B 65 0.145 -21.310 0.118 1.00 0.00 C ATOM 0 H PHE B 65 -4.011 -18.918 3.251 1.00 0.00 H new ATOM 0 HA PHE B 65 -1.136 -18.604 3.969 1.00 0.00 H new ATOM 0 HB2 PHE B 65 -2.577 -17.640 1.491 1.00 0.00 H new ATOM 0 HB3 PHE B 65 -0.998 -17.083 2.009 1.00 0.00 H new ATOM 0 HD1 PHE B 65 -2.758 -20.365 1.540 1.00 0.00 H new ATOM 0 HD2 PHE B 65 0.828 -18.134 1.004 1.00 0.00 H new ATOM 0 HE1 PHE B 65 -1.713 -22.306 0.460 1.00 0.00 H new ATOM 0 HE2 PHE B 65 1.871 -20.070 -0.090 1.00 0.00 H new ATOM 0 HZ PHE B 65 0.604 -22.163 -0.359 1.00 0.00 H new ATOM 2747 N ILE B 66 -1.780 -15.905 4.240 1.00 0.00 N ATOM 2748 CA ILE B 66 -2.196 -14.731 5.005 1.00 0.00 C ATOM 2749 C ILE B 66 -1.968 -13.433 4.249 1.00 0.00 C ATOM 2750 O ILE B 66 -0.845 -13.118 3.857 1.00 0.00 O ATOM 2751 CB ILE B 66 -1.474 -14.641 6.372 1.00 0.00 C ATOM 2752 CG1 ILE B 66 -0.260 -15.567 6.404 1.00 0.00 C ATOM 2753 CG2 ILE B 66 -2.430 -14.961 7.512 1.00 0.00 C ATOM 2754 CD1 ILE B 66 0.808 -15.131 5.441 1.00 0.00 C ATOM 0 H ILE B 66 -0.912 -15.796 3.715 1.00 0.00 H new ATOM 0 HA ILE B 66 -3.266 -14.861 5.169 1.00 0.00 H new ATOM 0 HB ILE B 66 -1.124 -13.617 6.504 1.00 0.00 H new ATOM 0 HG12 ILE B 66 0.150 -15.591 7.413 1.00 0.00 H new ATOM 0 HG13 ILE B 66 -0.573 -16.583 6.162 1.00 0.00 H new ATOM 0 HG21 ILE B 66 -1.900 -14.891 8.462 1.00 0.00 H new ATOM 0 HG22 ILE B 66 -3.256 -14.250 7.504 1.00 0.00 H new ATOM 0 HG23 ILE B 66 -2.820 -15.971 7.387 1.00 0.00 H new ATOM 0 HD11 ILE B 66 1.652 -15.818 5.498 1.00 0.00 H new ATOM 0 HD12 ILE B 66 0.407 -15.132 4.428 1.00 0.00 H new ATOM 0 HD13 ILE B 66 1.141 -14.125 5.698 1.00 0.00 H new ATOM 2766 N MET B 67 -3.039 -12.664 4.075 1.00 0.00 N ATOM 2767 CA MET B 67 -2.946 -11.384 3.394 1.00 0.00 C ATOM 2768 C MET B 67 -1.980 -10.477 4.134 1.00 0.00 C ATOM 2769 O MET B 67 -2.265 -10.033 5.246 1.00 0.00 O ATOM 2770 CB MET B 67 -4.316 -10.714 3.323 1.00 0.00 C ATOM 2771 CG MET B 67 -5.232 -11.309 2.276 1.00 0.00 C ATOM 2772 SD MET B 67 -6.530 -10.172 1.761 1.00 0.00 S ATOM 2773 CE MET B 67 -7.116 -9.585 3.348 1.00 0.00 C ATOM 0 H MET B 67 -3.976 -12.907 4.396 1.00 0.00 H new ATOM 0 HA MET B 67 -2.584 -11.557 2.381 1.00 0.00 H new ATOM 0 HB2 MET B 67 -4.797 -10.788 4.298 1.00 0.00 H new ATOM 0 HB3 MET B 67 -4.181 -9.653 3.114 1.00 0.00 H new ATOM 0 HG2 MET B 67 -4.643 -11.599 1.406 1.00 0.00 H new ATOM 0 HG3 MET B 67 -5.686 -12.218 2.671 1.00 0.00 H new ATOM 0 HE1 MET B 67 -7.781 -8.735 3.198 1.00 0.00 H new ATOM 0 HE2 MET B 67 -7.657 -10.384 3.854 1.00 0.00 H new ATOM 0 HE3 MET B 67 -6.267 -9.278 3.959 1.00 0.00 H new ATOM 2783 N LEU B 68 -0.843 -10.198 3.520 1.00 0.00 N ATOM 2784 CA LEU B 68 0.144 -9.335 4.151 1.00 0.00 C ATOM 2785 C LEU B 68 -0.319 -7.883 4.082 1.00 0.00 C ATOM 2786 O LEU B 68 0.159 -7.101 3.260 1.00 0.00 O ATOM 2787 CB LEU B 68 1.519 -9.505 3.491 1.00 0.00 C ATOM 2788 CG LEU B 68 2.700 -9.562 4.461 1.00 0.00 C ATOM 2789 CD1 LEU B 68 3.054 -11.008 4.779 1.00 0.00 C ATOM 2790 CD2 LEU B 68 3.904 -8.834 3.882 1.00 0.00 C ATOM 0 H LEU B 68 -0.581 -10.550 2.599 1.00 0.00 H new ATOM 0 HA LEU B 68 0.243 -9.621 5.198 1.00 0.00 H new ATOM 0 HB2 LEU B 68 1.510 -10.420 2.899 1.00 0.00 H new ATOM 0 HB3 LEU B 68 1.677 -8.679 2.798 1.00 0.00 H new ATOM 0 HG LEU B 68 2.411 -9.064 5.386 1.00 0.00 H new ATOM 0 HD11 LEU B 68 3.896 -11.033 5.470 1.00 0.00 H new ATOM 0 HD12 LEU B 68 2.195 -11.501 5.235 1.00 0.00 H new ATOM 0 HD13 LEU B 68 3.324 -11.527 3.859 1.00 0.00 H new ATOM 0 HD21 LEU B 68 4.734 -8.886 4.587 1.00 0.00 H new ATOM 0 HD22 LEU B 68 4.196 -9.304 2.943 1.00 0.00 H new ATOM 0 HD23 LEU B 68 3.646 -7.791 3.701 1.00 0.00 H new ATOM 2802 N THR B 69 -1.263 -7.535 4.958 1.00 0.00 N ATOM 2803 CA THR B 69 -1.811 -6.182 5.010 1.00 0.00 C ATOM 2804 C THR B 69 -0.801 -5.205 5.608 1.00 0.00 C ATOM 2805 O THR B 69 -0.971 -3.990 5.514 1.00 0.00 O ATOM 2806 CB THR B 69 -3.104 -6.160 5.832 1.00 0.00 C ATOM 2807 OG1 THR B 69 -3.012 -7.044 6.935 1.00 0.00 O ATOM 2808 CG2 THR B 69 -4.339 -6.546 5.039 1.00 0.00 C ATOM 0 H THR B 69 -1.664 -8.176 5.643 1.00 0.00 H new ATOM 0 HA THR B 69 -2.031 -5.871 3.989 1.00 0.00 H new ATOM 0 HB THR B 69 -3.214 -5.125 6.157 1.00 0.00 H new ATOM 0 HG1 THR B 69 -3.846 -7.015 7.448 1.00 0.00 H new ATOM 0 HG21 THR B 69 -5.214 -6.507 5.687 1.00 0.00 H new ATOM 0 HG22 THR B 69 -4.471 -5.851 4.210 1.00 0.00 H new ATOM 0 HG23 THR B 69 -4.220 -7.557 4.650 1.00 0.00 H new ATOM 2816 N GLN B 70 0.254 -5.741 6.221 1.00 0.00 N ATOM 2817 CA GLN B 70 1.288 -4.911 6.828 1.00 0.00 C ATOM 2818 C GLN B 70 2.385 -4.574 5.820 1.00 0.00 C ATOM 2819 O GLN B 70 3.485 -4.170 6.199 1.00 0.00 O ATOM 2820 CB GLN B 70 1.895 -5.622 8.039 1.00 0.00 C ATOM 2821 CG GLN B 70 1.168 -5.331 9.342 1.00 0.00 C ATOM 2822 CD GLN B 70 1.824 -5.997 10.536 1.00 0.00 C ATOM 2823 OE1 GLN B 70 2.746 -5.447 11.138 1.00 0.00 O ATOM 2824 NE2 GLN B 70 1.349 -7.187 10.885 1.00 0.00 N ATOM 0 H GLN B 70 0.413 -6.745 6.309 1.00 0.00 H new ATOM 0 HA GLN B 70 0.823 -3.980 7.154 1.00 0.00 H new ATOM 0 HB2 GLN B 70 1.887 -6.697 7.860 1.00 0.00 H new ATOM 0 HB3 GLN B 70 2.938 -5.323 8.140 1.00 0.00 H new ATOM 0 HG2 GLN B 70 1.136 -4.253 9.503 1.00 0.00 H new ATOM 0 HG3 GLN B 70 0.136 -5.672 9.262 1.00 0.00 H new ATOM 0 HE21 GLN B 70 0.583 -7.605 10.357 1.00 0.00 H new ATOM 0 HE22 GLN B 70 1.750 -7.683 11.681 1.00 0.00 H new ATOM 2833 N GLN B 71 2.080 -4.736 4.535 1.00 0.00 N ATOM 2834 CA GLN B 71 3.036 -4.443 3.476 1.00 0.00 C ATOM 2835 C GLN B 71 2.303 -4.180 2.168 1.00 0.00 C ATOM 2836 O GLN B 71 2.827 -4.439 1.084 1.00 0.00 O ATOM 2837 CB GLN B 71 4.019 -5.604 3.304 1.00 0.00 C ATOM 2838 CG GLN B 71 5.475 -5.193 3.448 1.00 0.00 C ATOM 2839 CD GLN B 71 6.370 -6.349 3.849 1.00 0.00 C ATOM 2840 OE1 GLN B 71 7.007 -6.320 4.901 1.00 0.00 O ATOM 2841 NE2 GLN B 71 6.422 -7.376 3.008 1.00 0.00 N ATOM 0 H GLN B 71 1.175 -5.070 4.203 1.00 0.00 H new ATOM 0 HA GLN B 71 3.598 -3.551 3.753 1.00 0.00 H new ATOM 0 HB2 GLN B 71 3.792 -6.374 4.042 1.00 0.00 H new ATOM 0 HB3 GLN B 71 3.872 -6.052 2.321 1.00 0.00 H new ATOM 0 HG2 GLN B 71 5.826 -4.777 2.504 1.00 0.00 H new ATOM 0 HG3 GLN B 71 5.553 -4.402 4.194 1.00 0.00 H new ATOM 0 HE21 GLN B 71 5.877 -7.358 2.146 1.00 0.00 H new ATOM 0 HE22 GLN B 71 7.007 -8.183 3.224 1.00 0.00 H new ATOM 2850 N MET B 72 1.081 -3.664 2.282 1.00 0.00 N ATOM 2851 CA MET B 72 0.257 -3.359 1.119 1.00 0.00 C ATOM 2852 C MET B 72 1.071 -2.636 0.052 1.00 0.00 C ATOM 2853 O MET B 72 1.979 -1.867 0.367 1.00 0.00 O ATOM 2854 CB MET B 72 -0.939 -2.510 1.544 1.00 0.00 C ATOM 2855 CG MET B 72 -2.171 -2.715 0.676 1.00 0.00 C ATOM 2856 SD MET B 72 -3.708 -2.449 1.580 1.00 0.00 S ATOM 2857 CE MET B 72 -3.619 -3.762 2.794 1.00 0.00 C ATOM 0 H MET B 72 0.639 -3.448 3.175 1.00 0.00 H new ATOM 0 HA MET B 72 -0.103 -4.294 0.690 1.00 0.00 H new ATOM 0 HB2 MET B 72 -1.191 -2.744 2.578 1.00 0.00 H new ATOM 0 HB3 MET B 72 -0.656 -1.458 1.515 1.00 0.00 H new ATOM 0 HG2 MET B 72 -2.130 -2.033 -0.173 1.00 0.00 H new ATOM 0 HG3 MET B 72 -2.162 -3.727 0.272 1.00 0.00 H new ATOM 0 HE1 MET B 72 -4.594 -4.240 2.885 1.00 0.00 H new ATOM 0 HE2 MET B 72 -2.881 -4.500 2.478 1.00 0.00 H new ATOM 0 HE3 MET B 72 -3.327 -3.347 3.759 1.00 0.00 H new ATOM 2867 N THR B 73 0.755 -2.900 -1.210 1.00 0.00 N ATOM 2868 CA THR B 73 1.478 -2.284 -2.314 1.00 0.00 C ATOM 2869 C THR B 73 0.757 -2.508 -3.640 1.00 0.00 C ATOM 2870 O THR B 73 0.385 -3.634 -3.964 1.00 0.00 O ATOM 2871 CB THR B 73 2.894 -2.865 -2.386 1.00 0.00 C ATOM 2872 OG1 THR B 73 3.483 -2.599 -3.647 1.00 0.00 O ATOM 2873 CG2 THR B 73 2.943 -4.368 -2.164 1.00 0.00 C ATOM 0 H THR B 73 0.007 -3.533 -1.493 1.00 0.00 H new ATOM 0 HA THR B 73 1.529 -1.210 -2.135 1.00 0.00 H new ATOM 0 HB THR B 73 3.444 -2.378 -1.581 1.00 0.00 H new ATOM 0 HG1 THR B 73 4.387 -2.977 -3.672 1.00 0.00 H new ATOM 0 HG21 THR B 73 3.975 -4.712 -2.229 1.00 0.00 H new ATOM 0 HG22 THR B 73 2.543 -4.603 -1.178 1.00 0.00 H new ATOM 0 HG23 THR B 73 2.346 -4.868 -2.926 1.00 0.00 H new ATOM 2881 N SER B 74 0.570 -1.438 -4.412 1.00 0.00 N ATOM 2882 CA SER B 74 -0.098 -1.554 -5.704 1.00 0.00 C ATOM 2883 C SER B 74 0.796 -2.282 -6.693 1.00 0.00 C ATOM 2884 O SER B 74 1.877 -1.807 -7.043 1.00 0.00 O ATOM 2885 CB SER B 74 -0.500 -0.181 -6.256 1.00 0.00 C ATOM 2886 OG SER B 74 0.469 0.314 -7.164 1.00 0.00 O ATOM 0 H SER B 74 0.868 -0.493 -4.168 1.00 0.00 H new ATOM 0 HA SER B 74 -1.011 -2.131 -5.558 1.00 0.00 H new ATOM 0 HB2 SER B 74 -1.465 -0.257 -6.757 1.00 0.00 H new ATOM 0 HB3 SER B 74 -0.622 0.523 -5.432 1.00 0.00 H new ATOM 0 HG SER B 74 1.317 -0.157 -7.026 1.00 0.00 H new ATOM 2892 N VAL B 75 0.336 -3.442 -7.133 1.00 0.00 N ATOM 2893 CA VAL B 75 1.086 -4.253 -8.076 1.00 0.00 C ATOM 2894 C VAL B 75 0.690 -3.907 -9.508 1.00 0.00 C ATOM 2895 O VAL B 75 -0.451 -4.124 -9.915 1.00 0.00 O ATOM 2896 CB VAL B 75 0.860 -5.756 -7.815 1.00 0.00 C ATOM 2897 CG1 VAL B 75 1.476 -6.160 -6.486 1.00 0.00 C ATOM 2898 CG2 VAL B 75 -0.620 -6.101 -7.872 1.00 0.00 C ATOM 0 H VAL B 75 -0.558 -3.844 -6.850 1.00 0.00 H new ATOM 0 HA VAL B 75 2.145 -4.036 -7.938 1.00 0.00 H new ATOM 0 HB VAL B 75 1.356 -6.324 -8.602 1.00 0.00 H new ATOM 0 HG11 VAL B 75 1.308 -7.223 -6.316 1.00 0.00 H new ATOM 0 HG12 VAL B 75 2.547 -5.960 -6.506 1.00 0.00 H new ATOM 0 HG13 VAL B 75 1.015 -5.587 -5.682 1.00 0.00 H new ATOM 0 HG21 VAL B 75 -0.753 -7.167 -7.685 1.00 0.00 H new ATOM 0 HG22 VAL B 75 -1.156 -5.530 -7.114 1.00 0.00 H new ATOM 0 HG23 VAL B 75 -1.013 -5.854 -8.858 1.00 0.00 H new ATOM 2908 N PRO B 76 1.628 -3.340 -10.291 1.00 0.00 N ATOM 2909 CA PRO B 76 1.366 -2.945 -11.673 1.00 0.00 C ATOM 2910 C PRO B 76 0.571 -3.989 -12.446 1.00 0.00 C ATOM 2911 O PRO B 76 1.035 -5.109 -12.659 1.00 0.00 O ATOM 2912 CB PRO B 76 2.764 -2.780 -12.260 1.00 0.00 C ATOM 2913 CG PRO B 76 3.610 -2.372 -11.103 1.00 0.00 C ATOM 2914 CD PRO B 76 3.013 -3.026 -9.884 1.00 0.00 C ATOM 0 HA PRO B 76 0.756 -2.044 -11.730 1.00 0.00 H new ATOM 0 HB2 PRO B 76 3.120 -3.710 -12.704 1.00 0.00 H new ATOM 0 HB3 PRO B 76 2.777 -2.026 -13.047 1.00 0.00 H new ATOM 0 HG2 PRO B 76 4.643 -2.689 -11.247 1.00 0.00 H new ATOM 0 HG3 PRO B 76 3.622 -1.287 -10.995 1.00 0.00 H new ATOM 0 HD2 PRO B 76 3.561 -3.926 -9.605 1.00 0.00 H new ATOM 0 HD3 PRO B 76 3.035 -2.359 -9.022 1.00 0.00 H new ATOM 2922 N VAL B 77 -0.633 -3.599 -12.858 1.00 0.00 N ATOM 2923 CA VAL B 77 -1.535 -4.470 -13.616 1.00 0.00 C ATOM 2924 C VAL B 77 -0.778 -5.440 -14.523 1.00 0.00 C ATOM 2925 O VAL B 77 -1.168 -6.597 -14.678 1.00 0.00 O ATOM 2926 CB VAL B 77 -2.490 -3.631 -14.486 1.00 0.00 C ATOM 2927 CG1 VAL B 77 -1.695 -2.743 -15.433 1.00 0.00 C ATOM 2928 CG2 VAL B 77 -3.447 -4.528 -15.259 1.00 0.00 C ATOM 0 H VAL B 77 -1.013 -2.670 -12.677 1.00 0.00 H new ATOM 0 HA VAL B 77 -2.097 -5.048 -12.882 1.00 0.00 H new ATOM 0 HB VAL B 77 -3.085 -2.994 -13.832 1.00 0.00 H new ATOM 0 HG11 VAL B 77 -2.381 -2.155 -16.043 1.00 0.00 H new ATOM 0 HG12 VAL B 77 -1.058 -2.073 -14.855 1.00 0.00 H new ATOM 0 HG13 VAL B 77 -1.076 -3.364 -16.080 1.00 0.00 H new ATOM 0 HG21 VAL B 77 -4.112 -3.913 -15.866 1.00 0.00 H new ATOM 0 HG22 VAL B 77 -2.878 -5.195 -15.906 1.00 0.00 H new ATOM 0 HG23 VAL B 77 -4.038 -5.119 -14.559 1.00 0.00 H new ATOM 2938 N LYS B 78 0.295 -4.950 -15.133 1.00 0.00 N ATOM 2939 CA LYS B 78 1.104 -5.760 -16.048 1.00 0.00 C ATOM 2940 C LYS B 78 1.377 -7.146 -15.495 1.00 0.00 C ATOM 2941 O LYS B 78 1.059 -8.160 -16.117 1.00 0.00 O ATOM 2942 CB LYS B 78 2.464 -5.123 -16.330 1.00 0.00 C ATOM 2943 CG LYS B 78 2.799 -3.973 -15.414 1.00 0.00 C ATOM 2944 CD LYS B 78 2.228 -2.678 -15.957 1.00 0.00 C ATOM 2945 CE LYS B 78 3.265 -1.897 -16.748 1.00 0.00 C ATOM 2946 NZ LYS B 78 3.729 -2.647 -17.948 1.00 0.00 N ATOM 0 H LYS B 78 0.629 -3.994 -15.013 1.00 0.00 H new ATOM 0 HA LYS B 78 0.515 -5.824 -16.963 1.00 0.00 H new ATOM 0 HB2 LYS B 78 3.238 -5.885 -16.239 1.00 0.00 H new ATOM 0 HB3 LYS B 78 2.483 -4.771 -17.361 1.00 0.00 H new ATOM 0 HG2 LYS B 78 2.399 -4.165 -14.419 1.00 0.00 H new ATOM 0 HG3 LYS B 78 3.881 -3.886 -15.311 1.00 0.00 H new ATOM 0 HD2 LYS B 78 1.372 -2.897 -16.595 1.00 0.00 H new ATOM 0 HD3 LYS B 78 1.863 -2.067 -15.132 1.00 0.00 H new ATOM 0 HE2 LYS B 78 2.841 -0.942 -17.058 1.00 0.00 H new ATOM 0 HE3 LYS B 78 4.118 -1.674 -16.107 1.00 0.00 H new ATOM 0 HZ1 LYS B 78 4.384 -2.054 -18.496 1.00 0.00 H new ATOM 0 HZ2 LYS B 78 4.217 -3.515 -17.648 1.00 0.00 H new ATOM 0 HZ3 LYS B 78 2.911 -2.897 -18.539 1.00 0.00 H new ATOM 2960 N ILE B 79 2.017 -7.168 -14.335 1.00 0.00 N ATOM 2961 CA ILE B 79 2.398 -8.416 -13.699 1.00 0.00 C ATOM 2962 C ILE B 79 1.377 -8.876 -12.659 1.00 0.00 C ATOM 2963 O ILE B 79 1.722 -9.633 -11.753 1.00 0.00 O ATOM 2964 CB ILE B 79 3.797 -8.338 -13.030 1.00 0.00 C ATOM 2965 CG1 ILE B 79 4.174 -6.889 -12.704 1.00 0.00 C ATOM 2966 CG2 ILE B 79 4.865 -9.005 -13.904 1.00 0.00 C ATOM 2967 CD1 ILE B 79 3.338 -6.316 -11.582 1.00 0.00 C ATOM 0 H ILE B 79 2.283 -6.332 -13.815 1.00 0.00 H new ATOM 0 HA ILE B 79 2.433 -9.147 -14.507 1.00 0.00 H new ATOM 0 HB ILE B 79 3.747 -8.887 -12.090 1.00 0.00 H new ATOM 0 HG12 ILE B 79 5.228 -6.843 -12.429 1.00 0.00 H new ATOM 0 HG13 ILE B 79 4.051 -6.275 -13.596 1.00 0.00 H new ATOM 0 HG21 ILE B 79 5.834 -8.935 -13.411 1.00 0.00 H new ATOM 0 HG22 ILE B 79 4.609 -10.054 -14.055 1.00 0.00 H new ATOM 0 HG23 ILE B 79 4.912 -8.501 -14.869 1.00 0.00 H new ATOM 0 HD11 ILE B 79 3.644 -5.288 -11.389 1.00 0.00 H new ATOM 0 HD12 ILE B 79 2.286 -6.335 -11.866 1.00 0.00 H new ATOM 0 HD13 ILE B 79 3.481 -6.912 -10.681 1.00 0.00 H new ATOM 2979 N LEU B 80 0.123 -8.428 -12.787 1.00 0.00 N ATOM 2980 CA LEU B 80 -0.930 -8.822 -11.842 1.00 0.00 C ATOM 2981 C LEU B 80 -0.764 -10.268 -11.422 1.00 0.00 C ATOM 2982 O LEU B 80 -1.162 -11.187 -12.137 1.00 0.00 O ATOM 2983 CB LEU B 80 -2.320 -8.611 -12.443 1.00 0.00 C ATOM 2984 CG LEU B 80 -3.399 -8.213 -11.431 1.00 0.00 C ATOM 2985 CD1 LEU B 80 -3.132 -8.860 -10.077 1.00 0.00 C ATOM 2986 CD2 LEU B 80 -3.465 -6.699 -11.295 1.00 0.00 C ATOM 0 H LEU B 80 -0.186 -7.799 -13.528 1.00 0.00 H new ATOM 0 HA LEU B 80 -0.834 -8.186 -10.962 1.00 0.00 H new ATOM 0 HB2 LEU B 80 -2.257 -7.838 -13.209 1.00 0.00 H new ATOM 0 HB3 LEU B 80 -2.629 -9.530 -12.941 1.00 0.00 H new ATOM 0 HG LEU B 80 -4.362 -8.571 -11.796 1.00 0.00 H new ATOM 0 HD11 LEU B 80 -3.910 -8.564 -9.373 1.00 0.00 H new ATOM 0 HD12 LEU B 80 -3.134 -9.945 -10.185 1.00 0.00 H new ATOM 0 HD13 LEU B 80 -2.161 -8.534 -9.703 1.00 0.00 H new ATOM 0 HD21 LEU B 80 -4.236 -6.432 -10.573 1.00 0.00 H new ATOM 0 HD22 LEU B 80 -2.501 -6.322 -10.953 1.00 0.00 H new ATOM 0 HD23 LEU B 80 -3.705 -6.257 -12.262 1.00 0.00 H new ATOM 2998 N SER B 81 -0.150 -10.440 -10.253 1.00 0.00 N ATOM 2999 CA SER B 81 0.123 -11.750 -9.678 1.00 0.00 C ATOM 3000 C SER B 81 -0.554 -12.879 -10.448 1.00 0.00 C ATOM 3001 O SER B 81 -1.779 -12.980 -10.467 1.00 0.00 O ATOM 3002 CB SER B 81 -0.302 -11.774 -8.213 1.00 0.00 C ATOM 3003 OG SER B 81 -1.200 -10.719 -7.926 1.00 0.00 O ATOM 0 H SER B 81 0.174 -9.665 -9.675 1.00 0.00 H new ATOM 0 HA SER B 81 1.197 -11.919 -9.750 1.00 0.00 H new ATOM 0 HB2 SER B 81 -0.773 -12.730 -7.983 1.00 0.00 H new ATOM 0 HB3 SER B 81 0.578 -11.691 -7.575 1.00 0.00 H new ATOM 0 HG SER B 81 -0.980 -10.330 -7.054 1.00 0.00 H new ATOM 3009 N GLU B 82 0.256 -13.726 -11.084 1.00 0.00 N ATOM 3010 CA GLU B 82 -0.265 -14.855 -11.860 1.00 0.00 C ATOM 3011 C GLU B 82 -1.437 -15.522 -11.134 1.00 0.00 C ATOM 3012 O GLU B 82 -1.236 -16.302 -10.204 1.00 0.00 O ATOM 3013 CB GLU B 82 0.843 -15.880 -12.111 1.00 0.00 C ATOM 3014 CG GLU B 82 0.854 -16.429 -13.529 1.00 0.00 C ATOM 3015 CD GLU B 82 1.139 -17.917 -13.576 1.00 0.00 C ATOM 3016 OE1 GLU B 82 2.114 -18.355 -12.928 1.00 0.00 O ATOM 3017 OE2 GLU B 82 0.389 -18.644 -14.260 1.00 0.00 O ATOM 0 H GLU B 82 1.273 -13.653 -11.078 1.00 0.00 H new ATOM 0 HA GLU B 82 -0.623 -14.473 -12.816 1.00 0.00 H new ATOM 0 HB2 GLU B 82 1.808 -15.418 -11.902 1.00 0.00 H new ATOM 0 HB3 GLU B 82 0.727 -16.707 -11.411 1.00 0.00 H new ATOM 0 HG2 GLU B 82 -0.110 -16.233 -13.998 1.00 0.00 H new ATOM 0 HG3 GLU B 82 1.607 -15.900 -14.114 1.00 0.00 H new ATOM 3024 N PRO B 83 -2.682 -15.207 -11.543 1.00 0.00 N ATOM 3025 CA PRO B 83 -3.889 -15.760 -10.920 1.00 0.00 C ATOM 3026 C PRO B 83 -3.822 -17.262 -10.664 1.00 0.00 C ATOM 3027 O PRO B 83 -4.254 -18.062 -11.494 1.00 0.00 O ATOM 3028 CB PRO B 83 -4.978 -15.446 -11.942 1.00 0.00 C ATOM 3029 CG PRO B 83 -4.523 -14.183 -12.580 1.00 0.00 C ATOM 3030 CD PRO B 83 -3.018 -14.268 -12.636 1.00 0.00 C ATOM 0 HA PRO B 83 -4.053 -15.331 -9.931 1.00 0.00 H new ATOM 0 HB2 PRO B 83 -5.081 -16.247 -12.674 1.00 0.00 H new ATOM 0 HB3 PRO B 83 -5.950 -15.324 -11.464 1.00 0.00 H new ATOM 0 HG2 PRO B 83 -4.946 -14.075 -13.579 1.00 0.00 H new ATOM 0 HG3 PRO B 83 -4.844 -13.316 -12.003 1.00 0.00 H new ATOM 0 HD2 PRO B 83 -2.673 -14.637 -13.602 1.00 0.00 H new ATOM 0 HD3 PRO B 83 -2.555 -13.293 -12.483 1.00 0.00 H new ATOM 3038 N VAL B 84 -3.311 -17.636 -9.495 1.00 0.00 N ATOM 3039 CA VAL B 84 -3.230 -19.040 -9.116 1.00 0.00 C ATOM 3040 C VAL B 84 -4.642 -19.609 -8.989 1.00 0.00 C ATOM 3041 O VAL B 84 -4.902 -20.765 -9.324 1.00 0.00 O ATOM 3042 CB VAL B 84 -2.504 -19.219 -7.769 1.00 0.00 C ATOM 3043 CG1 VAL B 84 -3.163 -18.366 -6.693 1.00 0.00 C ATOM 3044 CG2 VAL B 84 -2.480 -20.684 -7.357 1.00 0.00 C ATOM 0 H VAL B 84 -2.948 -16.987 -8.796 1.00 0.00 H new ATOM 0 HA VAL B 84 -2.667 -19.566 -9.887 1.00 0.00 H new ATOM 0 HB VAL B 84 -1.473 -18.887 -7.888 1.00 0.00 H new ATOM 0 HG11 VAL B 84 -2.638 -18.504 -5.748 1.00 0.00 H new ATOM 0 HG12 VAL B 84 -3.119 -17.316 -6.983 1.00 0.00 H new ATOM 0 HG13 VAL B 84 -4.204 -18.667 -6.577 1.00 0.00 H new ATOM 0 HG21 VAL B 84 -1.962 -20.785 -6.403 1.00 0.00 H new ATOM 0 HG22 VAL B 84 -3.502 -21.050 -7.256 1.00 0.00 H new ATOM 0 HG23 VAL B 84 -1.959 -21.267 -8.116 1.00 0.00 H new ATOM 3054 N ASN B 85 -5.545 -18.763 -8.494 1.00 0.00 N ATOM 3055 CA ASN B 85 -6.945 -19.124 -8.297 1.00 0.00 C ATOM 3056 C ASN B 85 -7.795 -17.856 -8.196 1.00 0.00 C ATOM 3057 O ASN B 85 -7.432 -16.818 -8.749 1.00 0.00 O ATOM 3058 CB ASN B 85 -7.095 -19.977 -7.034 1.00 0.00 C ATOM 3059 CG ASN B 85 -8.073 -21.121 -7.222 1.00 0.00 C ATOM 3060 OD1 ASN B 85 -9.232 -21.035 -6.817 1.00 0.00 O ATOM 3061 ND2 ASN B 85 -7.608 -22.201 -7.840 1.00 0.00 N ATOM 0 H ASN B 85 -5.324 -17.806 -8.218 1.00 0.00 H new ATOM 0 HA ASN B 85 -7.290 -19.710 -9.149 1.00 0.00 H new ATOM 0 HB2 ASN B 85 -6.121 -20.378 -6.752 1.00 0.00 H new ATOM 0 HB3 ASN B 85 -7.431 -19.347 -6.211 1.00 0.00 H new ATOM 0 HD21 ASN B 85 -8.219 -23.003 -7.995 1.00 0.00 H new ATOM 0 HD22 ASN B 85 -6.640 -22.229 -8.159 1.00 0.00 H new ATOM 3068 N GLU B 86 -8.916 -17.931 -7.484 1.00 0.00 N ATOM 3069 CA GLU B 86 -9.788 -16.778 -7.317 1.00 0.00 C ATOM 3070 C GLU B 86 -10.545 -16.878 -6.005 1.00 0.00 C ATOM 3071 O GLU B 86 -11.246 -17.860 -5.763 1.00 0.00 O ATOM 3072 CB GLU B 86 -10.773 -16.669 -8.480 1.00 0.00 C ATOM 3073 CG GLU B 86 -10.141 -16.915 -9.840 1.00 0.00 C ATOM 3074 CD GLU B 86 -11.088 -16.615 -10.986 1.00 0.00 C ATOM 3075 OE1 GLU B 86 -12.039 -15.832 -10.780 1.00 0.00 O ATOM 3076 OE2 GLU B 86 -10.879 -17.164 -12.088 1.00 0.00 O ATOM 0 H GLU B 86 -9.239 -18.777 -7.015 1.00 0.00 H new ATOM 0 HA GLU B 86 -9.168 -15.882 -7.304 1.00 0.00 H new ATOM 0 HB2 GLU B 86 -11.580 -17.386 -8.329 1.00 0.00 H new ATOM 0 HB3 GLU B 86 -11.223 -15.676 -8.472 1.00 0.00 H new ATOM 0 HG2 GLU B 86 -9.249 -16.296 -9.939 1.00 0.00 H new ATOM 0 HG3 GLU B 86 -9.817 -17.954 -9.904 1.00 0.00 H new ATOM 3083 N LEU B 87 -10.402 -15.868 -5.149 1.00 0.00 N ATOM 3084 CA LEU B 87 -11.088 -15.893 -3.865 1.00 0.00 C ATOM 3085 C LEU B 87 -12.029 -14.713 -3.664 1.00 0.00 C ATOM 3086 O LEU B 87 -11.883 -13.908 -2.746 1.00 0.00 O ATOM 3087 CB LEU B 87 -10.113 -16.014 -2.713 1.00 0.00 C ATOM 3088 CG LEU B 87 -9.427 -14.734 -2.234 1.00 0.00 C ATOM 3089 CD1 LEU B 87 -8.225 -15.094 -1.369 1.00 0.00 C ATOM 3090 CD2 LEU B 87 -9.021 -13.864 -3.419 1.00 0.00 C ATOM 0 H LEU B 87 -9.830 -15.041 -5.318 1.00 0.00 H new ATOM 0 HA LEU B 87 -11.712 -16.787 -3.879 1.00 0.00 H new ATOM 0 HB2 LEU B 87 -10.644 -16.448 -1.866 1.00 0.00 H new ATOM 0 HB3 LEU B 87 -9.338 -16.724 -3.001 1.00 0.00 H new ATOM 0 HG LEU B 87 -10.126 -14.154 -1.631 1.00 0.00 H new ATOM 0 HD11 LEU B 87 -7.736 -14.182 -1.028 1.00 0.00 H new ATOM 0 HD12 LEU B 87 -8.557 -15.672 -0.507 1.00 0.00 H new ATOM 0 HD13 LEU B 87 -7.521 -15.686 -1.953 1.00 0.00 H new ATOM 0 HD21 LEU B 87 -8.535 -12.959 -3.056 1.00 0.00 H new ATOM 0 HD22 LEU B 87 -8.330 -14.416 -4.056 1.00 0.00 H new ATOM 0 HD23 LEU B 87 -9.907 -13.594 -3.993 1.00 0.00 H new ATOM 3102 N SER B 88 -13.017 -14.664 -4.521 1.00 0.00 N ATOM 3103 CA SER B 88 -14.054 -13.633 -4.472 1.00 0.00 C ATOM 3104 C SER B 88 -14.950 -13.850 -3.279 1.00 0.00 C ATOM 3105 O SER B 88 -15.288 -12.906 -2.583 1.00 0.00 O ATOM 3106 CB SER B 88 -14.886 -13.619 -5.748 1.00 0.00 C ATOM 3107 OG SER B 88 -14.717 -14.817 -6.486 1.00 0.00 O ATOM 0 H SER B 88 -13.136 -15.335 -5.280 1.00 0.00 H new ATOM 0 HA SER B 88 -13.557 -12.667 -4.380 1.00 0.00 H new ATOM 0 HB2 SER B 88 -15.939 -13.490 -5.497 1.00 0.00 H new ATOM 0 HB3 SER B 88 -14.598 -12.767 -6.363 1.00 0.00 H new ATOM 0 HG SER B 88 -15.264 -14.781 -7.298 1.00 0.00 H new ATOM 3113 N THR B 89 -15.317 -15.098 -3.020 1.00 0.00 N ATOM 3114 CA THR B 89 -16.148 -15.392 -1.866 1.00 0.00 C ATOM 3115 C THR B 89 -15.444 -14.875 -0.617 1.00 0.00 C ATOM 3116 O THR B 89 -16.073 -14.552 0.391 1.00 0.00 O ATOM 3117 CB THR B 89 -16.409 -16.892 -1.749 1.00 0.00 C ATOM 3118 OG1 THR B 89 -17.464 -17.140 -0.837 1.00 0.00 O ATOM 3119 CG2 THR B 89 -15.197 -17.677 -1.289 1.00 0.00 C ATOM 0 H THR B 89 -15.057 -15.908 -3.583 1.00 0.00 H new ATOM 0 HA THR B 89 -17.114 -14.899 -1.979 1.00 0.00 H new ATOM 0 HB THR B 89 -16.669 -17.226 -2.753 1.00 0.00 H new ATOM 0 HG1 THR B 89 -17.621 -18.105 -0.773 1.00 0.00 H new ATOM 0 HG21 THR B 89 -15.451 -18.735 -1.227 1.00 0.00 H new ATOM 0 HG22 THR B 89 -14.383 -17.540 -2.001 1.00 0.00 H new ATOM 0 HG23 THR B 89 -14.884 -17.321 -0.307 1.00 0.00 H new ATOM 3127 N PHE B 90 -14.120 -14.780 -0.725 1.00 0.00 N ATOM 3128 CA PHE B 90 -13.280 -14.282 0.349 1.00 0.00 C ATOM 3129 C PHE B 90 -13.135 -12.763 0.245 1.00 0.00 C ATOM 3130 O PHE B 90 -12.374 -12.148 0.991 1.00 0.00 O ATOM 3131 CB PHE B 90 -11.910 -14.947 0.267 1.00 0.00 C ATOM 3132 CG PHE B 90 -11.774 -16.156 1.142 1.00 0.00 C ATOM 3133 CD1 PHE B 90 -12.758 -17.130 1.166 1.00 0.00 C ATOM 3134 CD2 PHE B 90 -10.659 -16.319 1.941 1.00 0.00 C ATOM 3135 CE1 PHE B 90 -12.626 -18.244 1.973 1.00 0.00 C ATOM 3136 CE2 PHE B 90 -10.522 -17.421 2.745 1.00 0.00 C ATOM 3137 CZ PHE B 90 -11.504 -18.389 2.764 1.00 0.00 C ATOM 0 H PHE B 90 -13.604 -15.048 -1.563 1.00 0.00 H new ATOM 0 HA PHE B 90 -13.741 -14.520 1.308 1.00 0.00 H new ATOM 0 HB2 PHE B 90 -11.716 -15.234 -0.767 1.00 0.00 H new ATOM 0 HB3 PHE B 90 -11.146 -14.221 0.545 1.00 0.00 H new ATOM 0 HD1 PHE B 90 -13.637 -17.018 0.548 1.00 0.00 H new ATOM 0 HD2 PHE B 90 -9.884 -15.567 1.932 1.00 0.00 H new ATOM 0 HE1 PHE B 90 -13.398 -18.999 1.985 1.00 0.00 H new ATOM 0 HE2 PHE B 90 -9.644 -17.531 3.364 1.00 0.00 H new ATOM 0 HZ PHE B 90 -11.396 -19.258 3.396 1.00 0.00 H new ATOM 3147 N ARG B 91 -13.871 -12.169 -0.699 1.00 0.00 N ATOM 3148 CA ARG B 91 -13.838 -10.727 -0.932 1.00 0.00 C ATOM 3149 C ARG B 91 -13.823 -9.942 0.374 1.00 0.00 C ATOM 3150 O ARG B 91 -12.991 -9.055 0.552 1.00 0.00 O ATOM 3151 CB ARG B 91 -15.036 -10.299 -1.765 1.00 0.00 C ATOM 3152 CG ARG B 91 -16.288 -10.954 -1.280 1.00 0.00 C ATOM 3153 CD ARG B 91 -17.331 -11.115 -2.374 1.00 0.00 C ATOM 3154 NE ARG B 91 -18.404 -10.131 -2.260 1.00 0.00 N ATOM 3155 CZ ARG B 91 -19.338 -10.158 -1.312 1.00 0.00 C ATOM 3156 NH1 ARG B 91 -19.334 -11.118 -0.394 1.00 0.00 N ATOM 3157 NH2 ARG B 91 -20.278 -9.224 -1.280 1.00 0.00 N ATOM 0 H ARG B 91 -14.503 -12.674 -1.320 1.00 0.00 H new ATOM 0 HA ARG B 91 -12.917 -10.508 -1.471 1.00 0.00 H new ATOM 0 HB2 ARG B 91 -15.147 -9.216 -1.719 1.00 0.00 H new ATOM 0 HB3 ARG B 91 -14.868 -10.558 -2.810 1.00 0.00 H new ATOM 0 HG2 ARG B 91 -16.044 -11.934 -0.870 1.00 0.00 H new ATOM 0 HG3 ARG B 91 -16.710 -10.364 -0.466 1.00 0.00 H new ATOM 0 HD2 ARG B 91 -16.852 -11.017 -3.348 1.00 0.00 H new ATOM 0 HD3 ARG B 91 -17.754 -12.119 -2.326 1.00 0.00 H new ATOM 0 HE ARG B 91 -18.440 -9.378 -2.948 1.00 0.00 H new ATOM 0 HH11 ARG B 91 -18.613 -11.839 -0.413 1.00 0.00 H new ATOM 0 HH12 ARG B 91 -20.052 -11.134 0.330 1.00 0.00 H new ATOM 0 HH21 ARG B 91 -20.286 -8.484 -1.982 1.00 0.00 H new ATOM 0 HH22 ARG B 91 -20.993 -9.245 -0.553 1.00 0.00 H new ATOM 3171 N ASN B 92 -14.733 -10.263 1.295 1.00 0.00 N ATOM 3172 CA ASN B 92 -14.768 -9.554 2.569 1.00 0.00 C ATOM 3173 C ASN B 92 -13.399 -9.609 3.224 1.00 0.00 C ATOM 3174 O ASN B 92 -12.832 -8.580 3.570 1.00 0.00 O ATOM 3175 CB ASN B 92 -15.807 -10.126 3.524 1.00 0.00 C ATOM 3176 CG ASN B 92 -17.011 -9.220 3.675 1.00 0.00 C ATOM 3177 OD1 ASN B 92 -18.034 -9.406 3.014 1.00 0.00 O ATOM 3178 ND2 ASN B 92 -16.891 -8.229 4.552 1.00 0.00 N ATOM 0 H ASN B 92 -15.438 -10.992 1.185 1.00 0.00 H new ATOM 0 HA ASN B 92 -15.047 -8.522 2.356 1.00 0.00 H new ATOM 0 HB2 ASN B 92 -16.132 -11.101 3.161 1.00 0.00 H new ATOM 0 HB3 ASN B 92 -15.350 -10.285 4.501 1.00 0.00 H new ATOM 0 HD21 ASN B 92 -17.666 -7.583 4.701 1.00 0.00 H new ATOM 0 HD22 ASN B 92 -16.024 -8.115 5.077 1.00 0.00 H new ATOM 3185 N GLU B 93 -12.853 -10.818 3.363 1.00 0.00 N ATOM 3186 CA GLU B 93 -11.524 -10.982 3.942 1.00 0.00 C ATOM 3187 C GLU B 93 -10.609 -9.940 3.352 1.00 0.00 C ATOM 3188 O GLU B 93 -9.855 -9.261 4.047 1.00 0.00 O ATOM 3189 CB GLU B 93 -10.947 -12.349 3.593 1.00 0.00 C ATOM 3190 CG GLU B 93 -10.457 -13.136 4.797 1.00 0.00 C ATOM 3191 CD GLU B 93 -11.593 -13.653 5.657 1.00 0.00 C ATOM 3192 OE1 GLU B 93 -12.490 -14.330 5.112 1.00 0.00 O ATOM 3193 OE2 GLU B 93 -11.586 -13.381 6.876 1.00 0.00 O ATOM 0 H GLU B 93 -13.307 -11.688 3.085 1.00 0.00 H new ATOM 0 HA GLU B 93 -11.604 -10.883 5.025 1.00 0.00 H new ATOM 0 HB2 GLU B 93 -11.708 -12.932 3.075 1.00 0.00 H new ATOM 0 HB3 GLU B 93 -10.119 -12.216 2.897 1.00 0.00 H new ATOM 0 HG2 GLU B 93 -9.853 -13.977 4.456 1.00 0.00 H new ATOM 0 HG3 GLU B 93 -9.808 -12.502 5.401 1.00 0.00 H new ATOM 3200 N ILE B 94 -10.703 -9.843 2.039 1.00 0.00 N ATOM 3201 CA ILE B 94 -9.914 -8.915 1.284 1.00 0.00 C ATOM 3202 C ILE B 94 -10.333 -7.480 1.606 1.00 0.00 C ATOM 3203 O ILE B 94 -9.498 -6.580 1.699 1.00 0.00 O ATOM 3204 CB ILE B 94 -10.063 -9.196 -0.225 1.00 0.00 C ATOM 3205 CG1 ILE B 94 -9.165 -10.370 -0.627 1.00 0.00 C ATOM 3206 CG2 ILE B 94 -9.745 -7.960 -1.054 1.00 0.00 C ATOM 3207 CD1 ILE B 94 -9.249 -11.559 0.308 1.00 0.00 C ATOM 0 H ILE B 94 -11.333 -10.412 1.474 1.00 0.00 H new ATOM 0 HA ILE B 94 -8.866 -9.039 1.558 1.00 0.00 H new ATOM 0 HB ILE B 94 -11.101 -9.461 -0.424 1.00 0.00 H new ATOM 0 HG12 ILE B 94 -9.434 -10.692 -1.633 1.00 0.00 H new ATOM 0 HG13 ILE B 94 -8.132 -10.026 -0.669 1.00 0.00 H new ATOM 0 HG21 ILE B 94 -9.860 -8.193 -2.113 1.00 0.00 H new ATOM 0 HG22 ILE B 94 -10.428 -7.155 -0.783 1.00 0.00 H new ATOM 0 HG23 ILE B 94 -8.719 -7.646 -0.861 1.00 0.00 H new ATOM 0 HD11 ILE B 94 -8.584 -12.347 -0.045 1.00 0.00 H new ATOM 0 HD12 ILE B 94 -8.950 -11.255 1.311 1.00 0.00 H new ATOM 0 HD13 ILE B 94 -10.273 -11.931 0.332 1.00 0.00 H new ATOM 3219 N ILE B 95 -11.640 -7.285 1.780 1.00 0.00 N ATOM 3220 CA ILE B 95 -12.190 -5.973 2.098 1.00 0.00 C ATOM 3221 C ILE B 95 -12.070 -5.673 3.588 1.00 0.00 C ATOM 3222 O ILE B 95 -11.317 -4.785 3.974 1.00 0.00 O ATOM 3223 CB ILE B 95 -13.672 -5.859 1.687 1.00 0.00 C ATOM 3224 CG1 ILE B 95 -13.856 -6.264 0.226 1.00 0.00 C ATOM 3225 CG2 ILE B 95 -14.179 -4.442 1.914 1.00 0.00 C ATOM 3226 CD1 ILE B 95 -15.181 -6.942 -0.048 1.00 0.00 C ATOM 0 H ILE B 95 -12.338 -8.025 1.705 1.00 0.00 H new ATOM 0 HA ILE B 95 -11.608 -5.247 1.530 1.00 0.00 H new ATOM 0 HB ILE B 95 -14.255 -6.539 2.308 1.00 0.00 H new ATOM 0 HG12 ILE B 95 -13.774 -5.377 -0.402 1.00 0.00 H new ATOM 0 HG13 ILE B 95 -13.047 -6.935 -0.062 1.00 0.00 H new ATOM 0 HG21 ILE B 95 -15.226 -4.379 1.619 1.00 0.00 H new ATOM 0 HG22 ILE B 95 -14.083 -4.186 2.969 1.00 0.00 H new ATOM 0 HG23 ILE B 95 -13.591 -3.745 1.317 1.00 0.00 H new ATOM 0 HD11 ILE B 95 -15.245 -7.203 -1.104 1.00 0.00 H new ATOM 0 HD12 ILE B 95 -15.258 -7.847 0.554 1.00 0.00 H new ATOM 0 HD13 ILE B 95 -15.996 -6.265 0.209 1.00 0.00 H new ATOM 3238 N ALA B 96 -12.809 -6.413 4.432 1.00 0.00 N ATOM 3239 CA ALA B 96 -12.755 -6.193 5.882 1.00 0.00 C ATOM 3240 C ALA B 96 -11.340 -5.826 6.314 1.00 0.00 C ATOM 3241 O ALA B 96 -11.135 -4.854 7.042 1.00 0.00 O ATOM 3242 CB ALA B 96 -13.259 -7.419 6.629 1.00 0.00 C ATOM 0 H ALA B 96 -13.441 -7.158 4.138 1.00 0.00 H new ATOM 0 HA ALA B 96 -13.409 -5.358 6.132 1.00 0.00 H new ATOM 0 HB1 ALA B 96 -13.211 -7.236 7.702 1.00 0.00 H new ATOM 0 HB2 ALA B 96 -14.291 -7.622 6.341 1.00 0.00 H new ATOM 0 HB3 ALA B 96 -12.637 -8.278 6.379 1.00 0.00 H new ATOM 3248 N ALA B 97 -10.361 -6.567 5.799 1.00 0.00 N ATOM 3249 CA ALA B 97 -8.956 -6.274 6.065 1.00 0.00 C ATOM 3250 C ALA B 97 -8.728 -4.816 5.807 1.00 0.00 C ATOM 3251 O ALA B 97 -8.559 -4.011 6.717 1.00 0.00 O ATOM 3252 CB ALA B 97 -8.081 -7.096 5.131 1.00 0.00 C ATOM 0 H ALA B 97 -10.516 -7.374 5.195 1.00 0.00 H new ATOM 0 HA ALA B 97 -8.706 -6.521 7.097 1.00 0.00 H new ATOM 0 HB1 ALA B 97 -7.032 -6.878 5.329 1.00 0.00 H new ATOM 0 HB2 ALA B 97 -8.268 -8.157 5.297 1.00 0.00 H new ATOM 0 HB3 ALA B 97 -8.315 -6.843 4.097 1.00 0.00 H new ATOM 3258 N ILE B 98 -8.794 -4.495 4.544 1.00 0.00 N ATOM 3259 CA ILE B 98 -8.659 -3.157 4.075 1.00 0.00 C ATOM 3260 C ILE B 98 -9.572 -2.232 4.875 1.00 0.00 C ATOM 3261 O ILE B 98 -9.137 -1.324 5.568 1.00 0.00 O ATOM 3262 CB ILE B 98 -9.098 -3.164 2.608 1.00 0.00 C ATOM 3263 CG1 ILE B 98 -7.964 -3.690 1.725 1.00 0.00 C ATOM 3264 CG2 ILE B 98 -9.578 -1.788 2.141 1.00 0.00 C ATOM 3265 CD1 ILE B 98 -7.872 -2.996 0.390 1.00 0.00 C ATOM 0 H ILE B 98 -8.947 -5.177 3.801 1.00 0.00 H new ATOM 0 HA ILE B 98 -7.634 -2.803 4.184 1.00 0.00 H new ATOM 0 HB ILE B 98 -9.953 -3.834 2.517 1.00 0.00 H new ATOM 0 HG12 ILE B 98 -7.018 -3.572 2.253 1.00 0.00 H new ATOM 0 HG13 ILE B 98 -8.107 -4.758 1.562 1.00 0.00 H new ATOM 0 HG21 ILE B 98 -9.879 -1.843 1.095 1.00 0.00 H new ATOM 0 HG22 ILE B 98 -10.428 -1.474 2.747 1.00 0.00 H new ATOM 0 HG23 ILE B 98 -8.770 -1.065 2.248 1.00 0.00 H new ATOM 0 HD11 ILE B 98 -7.047 -3.419 -0.184 1.00 0.00 H new ATOM 0 HD12 ILE B 98 -8.804 -3.136 -0.158 1.00 0.00 H new ATOM 0 HD13 ILE B 98 -7.698 -1.931 0.545 1.00 0.00 H new ATOM 3277 N ASP B 99 -10.854 -2.505 4.736 1.00 0.00 N ATOM 3278 CA ASP B 99 -11.919 -1.758 5.377 1.00 0.00 C ATOM 3279 C ASP B 99 -11.638 -1.399 6.837 1.00 0.00 C ATOM 3280 O ASP B 99 -12.130 -0.385 7.326 1.00 0.00 O ATOM 3281 CB ASP B 99 -13.193 -2.572 5.244 1.00 0.00 C ATOM 3282 CG ASP B 99 -14.424 -1.707 5.056 1.00 0.00 C ATOM 3283 OD1 ASP B 99 -14.542 -0.682 5.759 1.00 0.00 O ATOM 3284 OD2 ASP B 99 -15.271 -2.056 4.207 1.00 0.00 O ATOM 0 H ASP B 99 -11.194 -3.274 4.158 1.00 0.00 H new ATOM 0 HA ASP B 99 -12.012 -0.795 4.876 1.00 0.00 H new ATOM 0 HB2 ASP B 99 -13.098 -3.251 4.397 1.00 0.00 H new ATOM 0 HB3 ASP B 99 -13.320 -3.189 6.134 1.00 0.00 H new ATOM 3289 N PHE B 100 -10.842 -2.204 7.521 1.00 0.00 N ATOM 3290 CA PHE B 100 -10.490 -1.931 8.912 1.00 0.00 C ATOM 3291 C PHE B 100 -9.083 -1.380 8.958 1.00 0.00 C ATOM 3292 O PHE B 100 -8.827 -0.265 9.412 1.00 0.00 O ATOM 3293 CB PHE B 100 -10.580 -3.209 9.758 1.00 0.00 C ATOM 3294 CG PHE B 100 -9.911 -3.101 11.102 1.00 0.00 C ATOM 3295 CD1 PHE B 100 -10.469 -2.327 12.107 1.00 0.00 C ATOM 3296 CD2 PHE B 100 -8.725 -3.774 11.359 1.00 0.00 C ATOM 3297 CE1 PHE B 100 -9.858 -2.226 13.343 1.00 0.00 C ATOM 3298 CE2 PHE B 100 -8.111 -3.675 12.593 1.00 0.00 C ATOM 3299 CZ PHE B 100 -8.678 -2.900 13.586 1.00 0.00 C ATOM 0 H PHE B 100 -10.425 -3.053 7.139 1.00 0.00 H new ATOM 0 HA PHE B 100 -11.190 -1.204 9.324 1.00 0.00 H new ATOM 0 HB2 PHE B 100 -11.630 -3.462 9.905 1.00 0.00 H new ATOM 0 HB3 PHE B 100 -10.129 -4.032 9.204 1.00 0.00 H new ATOM 0 HD1 PHE B 100 -11.392 -1.797 11.923 1.00 0.00 H new ATOM 0 HD2 PHE B 100 -8.277 -4.382 10.587 1.00 0.00 H new ATOM 0 HE1 PHE B 100 -10.304 -1.620 14.118 1.00 0.00 H new ATOM 0 HE2 PHE B 100 -7.188 -4.203 12.781 1.00 0.00 H new ATOM 0 HZ PHE B 100 -8.199 -2.822 14.551 1.00 0.00 H new ATOM 3309 N LEU B 101 -8.187 -2.200 8.451 1.00 0.00 N ATOM 3310 CA LEU B 101 -6.776 -1.894 8.363 1.00 0.00 C ATOM 3311 C LEU B 101 -6.548 -0.529 7.738 1.00 0.00 C ATOM 3312 O LEU B 101 -5.601 0.178 8.085 1.00 0.00 O ATOM 3313 CB LEU B 101 -6.131 -2.991 7.519 1.00 0.00 C ATOM 3314 CG LEU B 101 -5.419 -2.558 6.240 1.00 0.00 C ATOM 3315 CD1 LEU B 101 -3.969 -2.201 6.520 1.00 0.00 C ATOM 3316 CD2 LEU B 101 -5.520 -3.665 5.202 1.00 0.00 C ATOM 0 H LEU B 101 -8.426 -3.120 8.080 1.00 0.00 H new ATOM 0 HA LEU B 101 -6.332 -1.860 9.358 1.00 0.00 H new ATOM 0 HB2 LEU B 101 -5.411 -3.519 8.144 1.00 0.00 H new ATOM 0 HB3 LEU B 101 -6.905 -3.709 7.248 1.00 0.00 H new ATOM 0 HG LEU B 101 -5.904 -1.664 5.849 1.00 0.00 H new ATOM 0 HD11 LEU B 101 -3.484 -1.896 5.593 1.00 0.00 H new ATOM 0 HD12 LEU B 101 -3.928 -1.382 7.238 1.00 0.00 H new ATOM 0 HD13 LEU B 101 -3.453 -3.069 6.931 1.00 0.00 H new ATOM 0 HD21 LEU B 101 -5.011 -3.355 4.289 1.00 0.00 H new ATOM 0 HD22 LEU B 101 -5.052 -4.570 5.589 1.00 0.00 H new ATOM 0 HD23 LEU B 101 -6.569 -3.864 4.983 1.00 0.00 H new ATOM 3328 N ILE B 102 -7.411 -0.175 6.796 1.00 0.00 N ATOM 3329 CA ILE B 102 -7.288 1.089 6.106 1.00 0.00 C ATOM 3330 C ILE B 102 -8.226 2.141 6.688 1.00 0.00 C ATOM 3331 O ILE B 102 -7.954 3.337 6.576 1.00 0.00 O ATOM 3332 CB ILE B 102 -7.549 0.940 4.586 1.00 0.00 C ATOM 3333 CG1 ILE B 102 -9.052 0.923 4.279 1.00 0.00 C ATOM 3334 CG2 ILE B 102 -6.873 -0.320 4.043 1.00 0.00 C ATOM 3335 CD1 ILE B 102 -9.560 2.213 3.674 1.00 0.00 C ATOM 0 H ILE B 102 -8.200 -0.748 6.497 1.00 0.00 H new ATOM 0 HA ILE B 102 -6.260 1.421 6.250 1.00 0.00 H new ATOM 0 HB ILE B 102 -7.116 1.807 4.086 1.00 0.00 H new ATOM 0 HG12 ILE B 102 -9.266 0.102 3.595 1.00 0.00 H new ATOM 0 HG13 ILE B 102 -9.600 0.722 5.199 1.00 0.00 H new ATOM 0 HG21 ILE B 102 -7.069 -0.406 2.974 1.00 0.00 H new ATOM 0 HG22 ILE B 102 -5.798 -0.257 4.211 1.00 0.00 H new ATOM 0 HG23 ILE B 102 -7.270 -1.196 4.556 1.00 0.00 H new ATOM 0 HD11 ILE B 102 -10.630 2.129 3.483 1.00 0.00 H new ATOM 0 HD12 ILE B 102 -9.378 3.036 4.366 1.00 0.00 H new ATOM 0 HD13 ILE B 102 -9.038 2.405 2.736 1.00 0.00 H new ATOM 3347 N THR B 103 -9.339 1.716 7.295 1.00 0.00 N ATOM 3348 CA THR B 103 -10.274 2.700 7.849 1.00 0.00 C ATOM 3349 C THR B 103 -10.880 2.280 9.189 1.00 0.00 C ATOM 3350 O THR B 103 -10.805 3.022 10.169 1.00 0.00 O ATOM 3351 CB THR B 103 -11.388 2.989 6.839 1.00 0.00 C ATOM 3352 OG1 THR B 103 -11.767 1.815 6.134 1.00 0.00 O ATOM 3353 CG2 THR B 103 -10.996 4.027 5.810 1.00 0.00 C ATOM 0 H THR B 103 -9.608 0.739 7.413 1.00 0.00 H new ATOM 0 HA THR B 103 -9.694 3.603 8.041 1.00 0.00 H new ATOM 0 HB THR B 103 -12.218 3.368 7.435 1.00 0.00 H new ATOM 0 HG1 THR B 103 -12.057 1.130 6.772 1.00 0.00 H new ATOM 0 HG21 THR B 103 -11.826 4.189 5.122 1.00 0.00 H new ATOM 0 HG22 THR B 103 -10.753 4.963 6.312 1.00 0.00 H new ATOM 0 HG23 THR B 103 -10.127 3.677 5.253 1.00 0.00 H new ATOM 3361 N GLY B 104 -11.499 1.112 9.224 1.00 0.00 N ATOM 3362 CA GLY B 104 -12.132 0.638 10.442 1.00 0.00 C ATOM 3363 C GLY B 104 -13.461 -0.024 10.145 1.00 0.00 C ATOM 3364 O GLY B 104 -14.459 0.653 9.898 1.00 0.00 O ATOM 0 H GLY B 104 -11.576 0.478 8.428 1.00 0.00 H new ATOM 0 HA2 GLY B 104 -11.474 -0.070 10.945 1.00 0.00 H new ATOM 0 HA3 GLY B 104 -12.283 1.473 11.126 1.00 0.00 H new ATOM 3368 N ILE B 105 -13.468 -1.350 10.142 1.00 0.00 N ATOM 3369 CA ILE B 105 -14.675 -2.106 9.840 1.00 0.00 C ATOM 3370 C ILE B 105 -14.936 -3.189 10.883 1.00 0.00 C ATOM 3371 O ILE B 105 -16.098 -3.632 10.996 1.00 0.00 O ATOM 3372 CB ILE B 105 -14.563 -2.743 8.444 1.00 0.00 C ATOM 3373 CG1 ILE B 105 -15.896 -3.332 8.005 1.00 0.00 C ATOM 3374 CG2 ILE B 105 -13.476 -3.807 8.414 1.00 0.00 C ATOM 3375 CD1 ILE B 105 -15.836 -3.910 6.614 1.00 0.00 C ATOM 3376 OXT ILE B 105 -13.976 -3.584 11.578 1.00 0.00 O ATOM 0 H ILE B 105 -12.650 -1.925 10.346 1.00 0.00 H new ATOM 0 HA ILE B 105 -15.515 -1.411 9.859 1.00 0.00 H new ATOM 0 HB ILE B 105 -14.289 -1.955 7.742 1.00 0.00 H new ATOM 0 HG12 ILE B 105 -16.195 -4.110 8.707 1.00 0.00 H new ATOM 0 HG13 ILE B 105 -16.662 -2.558 8.042 1.00 0.00 H new ATOM 0 HG21 ILE B 105 -13.419 -4.241 7.416 1.00 0.00 H new ATOM 0 HG22 ILE B 105 -12.517 -3.355 8.669 1.00 0.00 H new ATOM 0 HG23 ILE B 105 -13.712 -4.589 9.136 1.00 0.00 H new ATOM 0 HD11 ILE B 105 -16.811 -4.318 6.347 1.00 0.00 H new ATOM 0 HD12 ILE B 105 -15.564 -3.127 5.906 1.00 0.00 H new ATOM 0 HD13 ILE B 105 -15.090 -4.704 6.582 1.00 0.00 H new