USER MOD reduce.3.24.130724 H: found=0, std=0, add=1472, rem=0, adj=46 USER MOD reduce.3.24.130724 removed 1467 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 8 GLN : amide:sc= -2.11! C(o=-0.61!,f=-1.8!) USER MOD Set 1.2: A 165 MET CE :methyl -110:sc= -0.0616 (180deg=-0.257) USER MOD Set 1.3: A 180 THR OG1 : rot 88:sc= -0.445 USER MOD Set 1.4: A 183 GLN : amide:sc= -0.135 K(o=-0.61,f=-6.5) USER MOD Set 1.5: A 187 LYS NZ :NH3+ -156:sc= 2.14 (180deg=0.794) USER MOD Set 2.1: A 152 MET CE :methyl 162:sc= -0.413 (180deg=-1.64) USER MOD Set 2.2: A 177 TYR OH : rot 180:sc= 0 USER MOD Set 3.1: A 73 GLN : amide:sc= 0.838 K(o=0.72,f=-0.45) USER MOD Set 3.2: A 131 LYS NZ :NH3+ -146:sc= -0.121 (180deg=-0.104) USER MOD Set 4.1: A 60 HIS : no HE2:sc= -10.1! C(o=-10!,f=-17!) USER MOD Set 4.2: A 137 GLN :FLIP amide:sc= 0.0871 F(o=-15!,f=-10) USER MOD Single : A 0 ASN : amide:sc= -0.222 X(o=-0.22,f=-0.16) USER MOD Single : A 2 GLN : amide:sc= -0.0223 X(o=-0.022,f=0) USER MOD Single : A 4 THR OG1 : rot 180:sc= 0 USER MOD Single : A 7 LYS NZ :NH3+ 165:sc= 0.556 (180deg=0.439) USER MOD Single : A 9 TYR OH : rot 180:sc= 0 USER MOD Single : A -1 SER N :NH3+ 134:sc= 0.0596 (180deg=0) USER MOD Single : A -1 SER OG : rot 180:sc= 0 USER MOD Single : A 11 THR OG1 : rot 180:sc= 0.0156 USER MOD Single : A 14 LYS NZ :NH3+ -177:sc= 0 (180deg=-0.00731) USER MOD Single : A 21 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 27 SER OG : rot 180:sc= 0 USER MOD Single : A 29 TYR OH : rot 80:sc= 0 USER MOD Single : A 32 HIS : no HD1:sc= -0.348 X(o=-0.35,f=-0.013) USER MOD Single : A 34 TYR OH : rot -68:sc= 0.861 USER MOD Single : A 35 GLN :FLIP amide:sc= -0.0145 F(o=-2.3!,f=-0.014) USER MOD Single : A 41 HIS : no HE2:sc= 0.295 K(o=0.3,f=-2!) USER MOD Single : A 43 SER OG : rot 96:sc= 0 USER MOD Single : A 45 ASN : amide:sc=-0.00288 X(o=-0.0029,f=-0.0029) USER MOD Single : A 48 GLN : amide:sc= 0 X(o=0,f=-0.18) USER MOD Single : A 49 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 54 THR OG1 : rot -140:sc= 0 USER MOD Single : A 55 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 56 MET CE :methyl -151:sc= -0.0656 (180deg=-1.1) USER MOD Single : A 57 THR OG1 : rot 127:sc= 0.0469 USER MOD Single : A 58 LYS NZ :NH3+ 148:sc= 1.02 (180deg=0.0614) USER MOD Single : A 59 TYR OH : rot 180:sc= 0 USER MOD Single : A 69 LYS NZ :NH3+ -125:sc= 0.0333 (180deg=-0.0813) USER MOD Single : A 72 THR OG1 : rot -82:sc= -0.471 USER MOD Single : A 86 LYS NZ :NH3+ -178:sc= 0 (180deg=-0.00531) USER MOD Single : A 88 THR OG1 : rot 63:sc= 1.1 USER MOD Single : A 91 MET CE :methyl 161:sc= -2.38 (180deg=-4.06!) USER MOD Single : A 96 GLN : amide:sc= 0.195 K(o=0.19,f=-3.3!) USER MOD Single : A 97 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 98 THR OG1 : rot 180:sc= -0.262 USER MOD Single : A 99 GLN : amide:sc= 0 X(o=0,f=-0.094) USER MOD Single : A 100 THR OG1 : rot 180:sc= 0 USER MOD Single : A 102 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 103 SER OG : rot 180:sc= 0.0101 USER MOD Single : A 109 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 117 LYS NZ :NH3+ 152:sc= 1.06 (180deg=0.329) USER MOD Single : A 121 TYR OH : rot 66:sc= 0.0465 USER MOD Single : A 126 ASN : amide:sc= -0.37 X(o=-0.37,f=-0.02) USER MOD Single : A 127 SER OG : rot 180:sc= 0 USER MOD Single : A 132 SER OG : rot 180:sc= 0 USER MOD Single : A 136 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 139 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 145 GLN : amide:sc= 0.0186 X(o=0.019,f=0.075) USER MOD Single : A 147 GLN : amide:sc= -0.109 K(o=-0.11,f=-0.7) USER MOD Single : A 153 TYR OH : rot 30:sc= -0.0567 USER MOD Single : A 155 ASN : amide:sc= -0.229 K(o=-0.23,f=-0.9) USER MOD Single : A 157 LYS NZ :NH3+ -152:sc= 1.19 (180deg=-0.969) USER MOD Single : A 158 TYR OH : rot -136:sc= -0.872 USER MOD Single : A 159 GLN : amide:sc= 1.1 K(o=1.1,f=-0.0035) USER MOD Single : A 161 ASN : amide:sc= 0.182 K(o=0.18,f=-1.1) USER MOD Single : A 163 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 167 THR OG1 : rot -72:sc= 0.756 USER MOD Single : A 168 SER OG : rot 76:sc= 1.28 USER MOD Single : A 169 ASN :FLIP amide:sc= -0.0216 F(o=-1.1,f=-0.022) USER MOD Single : A 170 MET CE :methyl 147:sc= -0.0475 (180deg=-1.51!) USER MOD Single : A 176 GLN : amide:sc= -0.513 X(o=-0.51,f=-0.14) USER MOD Single : A 182 LYS NZ :NH3+ 146:sc= 2.13 (180deg=0.962) USER MOD Single : A 188 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1 N SER A -1 22.653 -11.482 2.280 1.00 74.33 N ATOM 2 CA SER A -1 23.312 -10.235 2.676 1.00 3.21 C ATOM 3 C SER A -1 22.377 -9.076 2.400 1.00 54.10 C ATOM 4 O SER A -1 21.641 -9.102 1.418 1.00 21.31 O ATOM 5 CB SER A -1 24.643 -10.061 1.954 1.00 20.15 C ATOM 6 OG SER A -1 25.587 -10.961 2.506 1.00 55.12 O ATOM 0 H1 SER A -1 23.316 -12.066 1.732 1.00 74.33 H new ATOM 0 H2 SER A -1 22.354 -12.002 3.130 1.00 74.33 H new ATOM 0 H3 SER A -1 21.820 -11.264 1.697 1.00 74.33 H new ATOM 0 HA SER A -1 23.535 -10.267 3.742 1.00 3.21 H new ATOM 0 HB2 SER A -1 24.521 -10.251 0.888 1.00 20.15 H new ATOM 0 HB3 SER A -1 24.996 -9.035 2.057 1.00 20.15 H new ATOM 0 HG SER A -1 26.446 -10.857 2.046 1.00 55.12 H new ATOM 12 N ASN A 0 22.375 -8.070 3.276 1.00 32.22 N ATOM 13 CA ASN A 0 21.429 -6.955 3.188 1.00 1.11 C ATOM 14 C ASN A 0 22.013 -5.602 3.511 1.00 63.33 C ATOM 15 O ASN A 0 21.517 -4.610 2.996 1.00 74.34 O ATOM 16 CB ASN A 0 20.204 -7.205 4.080 1.00 13.11 C ATOM 17 CG ASN A 0 20.621 -7.617 5.485 1.00 60.13 C ATOM 18 OD1 ASN A 0 20.674 -8.811 5.768 1.00 44.40 O ATOM 19 ND2 ASN A 0 20.998 -6.696 6.344 1.00 24.35 N ATOM 0 H ASN A 0 23.023 -8.004 4.061 1.00 32.22 H new ATOM 0 HA ASN A 0 21.140 -6.922 2.138 1.00 1.11 H new ATOM 0 HB2 ASN A 0 19.596 -6.302 4.128 1.00 13.11 H new ATOM 0 HB3 ASN A 0 19.583 -7.984 3.639 1.00 13.11 H new ATOM 0 HD21 ASN A 0 21.342 -6.968 7.265 1.00 24.35 H new ATOM 0 HD22 ASN A 0 20.946 -5.710 6.090 1.00 24.35 H new ATOM 26 N ALA A 1 23.077 -5.557 4.296 1.00 12.14 N ATOM 27 CA ALA A 1 23.587 -4.368 4.983 1.00 11.31 C ATOM 28 C ALA A 1 24.342 -3.393 4.068 1.00 71.32 C ATOM 29 O ALA A 1 25.256 -2.683 4.495 1.00 11.42 O ATOM 30 CB ALA A 1 24.421 -4.812 6.188 1.00 20.14 C ATOM 0 H ALA A 1 23.640 -6.386 4.485 1.00 12.14 H new ATOM 0 HA ALA A 1 22.731 -3.788 5.329 1.00 11.31 H new ATOM 0 HB1 ALA A 1 24.806 -3.934 6.707 1.00 20.14 H new ATOM 0 HB2 ALA A 1 23.797 -5.392 6.868 1.00 20.14 H new ATOM 0 HB3 ALA A 1 25.254 -5.426 5.847 1.00 20.14 H new ATOM 36 N GLN A 2 23.971 -3.380 2.795 1.00 0.14 N ATOM 37 CA GLN A 2 24.508 -2.621 1.703 1.00 71.30 C ATOM 38 C GLN A 2 23.370 -2.588 0.700 1.00 20.15 C ATOM 39 O GLN A 2 22.859 -3.641 0.313 1.00 33.42 O ATOM 40 CB GLN A 2 25.718 -3.351 1.104 1.00 20.32 C ATOM 41 CG GLN A 2 27.066 -2.688 1.395 1.00 43.04 C ATOM 42 CD GLN A 2 28.117 -3.131 0.374 1.00 34.44 C ATOM 43 OE1 GLN A 2 29.064 -3.851 0.683 1.00 62.42 O ATOM 44 NE2 GLN A 2 27.979 -2.718 -0.873 1.00 21.33 N ATOM 0 H GLN A 2 23.201 -3.971 2.482 1.00 0.14 H new ATOM 0 HA GLN A 2 24.848 -1.628 1.996 1.00 71.30 H new ATOM 0 HB2 GLN A 2 25.738 -4.371 1.489 1.00 20.32 H new ATOM 0 HB3 GLN A 2 25.587 -3.420 0.024 1.00 20.32 H new ATOM 0 HG2 GLN A 2 26.958 -1.604 1.366 1.00 43.04 H new ATOM 0 HG3 GLN A 2 27.396 -2.949 2.401 1.00 43.04 H new ATOM 0 HE21 GLN A 2 27.193 -2.121 -1.128 1.00 21.33 H new ATOM 0 HE22 GLN A 2 28.659 -2.997 -1.581 1.00 21.33 H new ATOM 53 N ILE A 3 22.968 -1.380 0.336 1.00 23.14 N ATOM 54 CA ILE A 3 21.974 -1.064 -0.669 1.00 21.22 C ATOM 55 C ILE A 3 22.585 -0.061 -1.643 1.00 43.24 C ATOM 56 O ILE A 3 23.403 0.774 -1.245 1.00 40.13 O ATOM 57 CB ILE A 3 20.704 -0.510 0.010 1.00 23.34 C ATOM 58 CG1 ILE A 3 20.970 0.596 1.061 1.00 64.23 C ATOM 59 CG2 ILE A 3 19.891 -1.656 0.617 1.00 13.03 C ATOM 60 CD1 ILE A 3 19.715 1.438 1.341 1.00 20.24 C ATOM 0 H ILE A 3 23.356 -0.540 0.766 1.00 23.14 H new ATOM 0 HA ILE A 3 21.680 -1.956 -1.223 1.00 21.22 H new ATOM 0 HB ILE A 3 20.129 -0.022 -0.777 1.00 23.34 H new ATOM 0 HG12 ILE A 3 21.314 0.139 1.989 1.00 64.23 H new ATOM 0 HG13 ILE A 3 21.771 1.246 0.709 1.00 64.23 H new ATOM 0 HG21 ILE A 3 18.997 -1.255 1.094 1.00 13.03 H new ATOM 0 HG22 ILE A 3 19.601 -2.353 -0.169 1.00 13.03 H new ATOM 0 HG23 ILE A 3 20.495 -2.177 1.359 1.00 13.03 H new ATOM 0 HD11 ILE A 3 19.947 2.201 2.084 1.00 20.24 H new ATOM 0 HD12 ILE A 3 19.385 1.917 0.419 1.00 20.24 H new ATOM 0 HD13 ILE A 3 18.921 0.794 1.719 1.00 20.24 H new ATOM 72 N THR A 4 22.159 -0.097 -2.900 1.00 41.14 N ATOM 73 CA THR A 4 22.556 0.856 -3.924 1.00 42.14 C ATOM 74 C THR A 4 21.296 1.333 -4.640 1.00 54.20 C ATOM 75 O THR A 4 20.328 0.577 -4.813 1.00 0.42 O ATOM 76 CB THR A 4 23.616 0.198 -4.831 1.00 31.53 C ATOM 77 OG1 THR A 4 24.766 -0.025 -4.029 1.00 31.24 O ATOM 78 CG2 THR A 4 24.072 1.015 -6.040 1.00 60.20 C ATOM 0 H THR A 4 21.512 -0.808 -3.242 1.00 41.14 H new ATOM 0 HA THR A 4 23.033 1.747 -3.515 1.00 42.14 H new ATOM 0 HB THR A 4 23.146 -0.699 -5.235 1.00 31.53 H new ATOM 0 HG1 THR A 4 25.466 -0.446 -4.571 1.00 31.24 H new ATOM 0 HG21 THR A 4 24.817 0.450 -6.601 1.00 60.20 H new ATOM 0 HG22 THR A 4 23.216 1.224 -6.682 1.00 60.20 H new ATOM 0 HG23 THR A 4 24.509 1.954 -5.701 1.00 60.20 H new ATOM 86 N ASP A 5 21.314 2.615 -4.993 1.00 41.14 N ATOM 87 CA ASP A 5 20.330 3.256 -5.849 1.00 11.33 C ATOM 88 C ASP A 5 20.290 2.567 -7.213 1.00 15.05 C ATOM 89 O ASP A 5 21.263 1.955 -7.649 1.00 4.31 O ATOM 90 CB ASP A 5 20.666 4.737 -6.024 1.00 63.10 C ATOM 91 CG ASP A 5 21.881 4.967 -6.916 1.00 63.13 C ATOM 92 OD1 ASP A 5 23.023 4.961 -6.393 1.00 64.13 O ATOM 93 OD2 ASP A 5 21.704 5.185 -8.132 1.00 41.31 O ATOM 0 H ASP A 5 22.042 3.256 -4.678 1.00 41.14 H new ATOM 0 HA ASP A 5 19.350 3.169 -5.379 1.00 11.33 H new ATOM 0 HB2 ASP A 5 19.805 5.252 -6.451 1.00 63.10 H new ATOM 0 HB3 ASP A 5 20.850 5.181 -5.046 1.00 63.10 H new ATOM 98 N GLY A 6 19.139 2.611 -7.873 1.00 60.33 N ATOM 99 CA GLY A 6 18.861 1.832 -9.067 1.00 32.54 C ATOM 100 C GLY A 6 18.651 0.344 -8.769 1.00 44.11 C ATOM 101 O GLY A 6 17.952 -0.324 -9.535 1.00 55.14 O ATOM 0 H GLY A 6 18.359 3.202 -7.585 1.00 60.33 H new ATOM 0 HA2 GLY A 6 17.971 2.229 -9.556 1.00 32.54 H new ATOM 0 HA3 GLY A 6 19.687 1.944 -9.769 1.00 32.54 H new ATOM 105 N LYS A 7 19.218 -0.192 -7.679 1.00 35.11 N ATOM 106 CA LYS A 7 19.240 -1.622 -7.412 1.00 54.20 C ATOM 107 C LYS A 7 18.109 -1.925 -6.458 1.00 3.14 C ATOM 108 O LYS A 7 17.016 -2.245 -6.904 1.00 75.32 O ATOM 109 CB LYS A 7 20.624 -2.057 -6.882 1.00 31.14 C ATOM 110 CG LYS A 7 20.761 -3.573 -6.655 1.00 62.54 C ATOM 111 CD LYS A 7 20.539 -4.425 -7.910 1.00 15.05 C ATOM 112 CE LYS A 7 20.867 -5.889 -7.593 1.00 41.20 C ATOM 113 NZ LYS A 7 20.204 -6.826 -8.522 1.00 72.14 N ATOM 0 H LYS A 7 19.675 0.366 -6.958 1.00 35.11 H new ATOM 0 HA LYS A 7 19.088 -2.199 -8.324 1.00 54.20 H new ATOM 0 HB2 LYS A 7 21.389 -1.735 -7.588 1.00 31.14 H new ATOM 0 HB3 LYS A 7 20.820 -1.540 -5.942 1.00 31.14 H new ATOM 0 HG2 LYS A 7 21.756 -3.780 -6.261 1.00 62.54 H new ATOM 0 HG3 LYS A 7 20.046 -3.880 -5.892 1.00 62.54 H new ATOM 0 HD2 LYS A 7 19.506 -4.336 -8.246 1.00 15.05 H new ATOM 0 HD3 LYS A 7 21.170 -4.067 -8.723 1.00 15.05 H new ATOM 0 HE2 LYS A 7 21.946 -6.036 -7.641 1.00 41.20 H new ATOM 0 HE3 LYS A 7 20.560 -6.115 -6.572 1.00 41.20 H new ATOM 0 HZ1 LYS A 7 20.642 -7.765 -8.439 1.00 72.14 H new ATOM 0 HZ2 LYS A 7 19.194 -6.893 -8.285 1.00 72.14 H new ATOM 0 HZ3 LYS A 7 20.309 -6.480 -9.497 1.00 72.14 H new ATOM 127 N GLN A 8 18.352 -1.778 -5.158 1.00 40.10 N ATOM 128 CA GLN A 8 17.387 -2.100 -4.120 1.00 24.23 C ATOM 129 C GLN A 8 16.515 -0.907 -3.773 1.00 40.40 C ATOM 130 O GLN A 8 15.460 -1.094 -3.166 1.00 41.31 O ATOM 131 CB GLN A 8 18.133 -2.537 -2.853 1.00 62.41 C ATOM 132 CG GLN A 8 18.755 -3.934 -2.913 1.00 61.20 C ATOM 133 CD GLN A 8 19.312 -4.303 -1.540 1.00 13.43 C ATOM 134 OE1 GLN A 8 18.555 -4.526 -0.595 1.00 71.43 O ATOM 135 NE2 GLN A 8 20.621 -4.316 -1.384 1.00 71.43 N ATOM 0 H GLN A 8 19.238 -1.427 -4.795 1.00 40.10 H new ATOM 0 HA GLN A 8 16.750 -2.900 -4.497 1.00 24.23 H new ATOM 0 HB2 GLN A 8 18.922 -1.814 -2.648 1.00 62.41 H new ATOM 0 HB3 GLN A 8 17.441 -2.501 -2.012 1.00 62.41 H new ATOM 0 HG2 GLN A 8 18.007 -4.664 -3.222 1.00 61.20 H new ATOM 0 HG3 GLN A 8 19.550 -3.958 -3.658 1.00 61.20 H new ATOM 0 HE21 GLN A 8 21.231 -4.129 -2.180 1.00 71.43 H new ATOM 0 HE22 GLN A 8 21.023 -4.513 -0.468 1.00 71.43 H new ATOM 144 N TYR A 9 16.933 0.303 -4.133 1.00 2.15 N ATOM 145 CA TYR A 9 16.094 1.474 -3.970 1.00 73.21 C ATOM 146 C TYR A 9 16.249 2.402 -5.163 1.00 61.01 C ATOM 147 O TYR A 9 17.195 2.259 -5.934 1.00 60.23 O ATOM 148 CB TYR A 9 16.395 2.163 -2.638 1.00 64.40 C ATOM 149 CG TYR A 9 17.751 2.830 -2.542 1.00 62.12 C ATOM 150 CD1 TYR A 9 18.894 2.081 -2.204 1.00 74.22 C ATOM 151 CD2 TYR A 9 17.850 4.224 -2.688 1.00 55.33 C ATOM 152 CE1 TYR A 9 20.114 2.729 -1.952 1.00 43.23 C ATOM 153 CE2 TYR A 9 19.070 4.875 -2.447 1.00 35.12 C ATOM 154 CZ TYR A 9 20.202 4.131 -2.060 1.00 1.35 C ATOM 155 OH TYR A 9 21.367 4.767 -1.777 1.00 34.41 O ATOM 0 H TYR A 9 17.849 0.493 -4.539 1.00 2.15 H new ATOM 0 HA TYR A 9 15.047 1.172 -3.938 1.00 73.21 H new ATOM 0 HB2 TYR A 9 15.626 2.914 -2.455 1.00 64.40 H new ATOM 0 HB3 TYR A 9 16.315 1.424 -1.840 1.00 64.40 H new ATOM 0 HD1 TYR A 9 18.832 1.005 -2.138 1.00 74.22 H new ATOM 0 HD2 TYR A 9 16.984 4.797 -2.987 1.00 55.33 H new ATOM 0 HE1 TYR A 9 20.985 2.153 -1.675 1.00 43.23 H new ATOM 0 HE2 TYR A 9 19.141 5.947 -2.558 1.00 35.12 H new ATOM 0 HH TYR A 9 21.252 5.732 -1.904 1.00 34.41 H new ATOM 165 N ILE A 10 15.333 3.352 -5.314 1.00 54.22 N ATOM 166 CA ILE A 10 15.366 4.424 -6.304 1.00 41.20 C ATOM 167 C ILE A 10 15.168 5.717 -5.521 1.00 55.21 C ATOM 168 O ILE A 10 14.690 5.706 -4.382 1.00 22.35 O ATOM 169 CB ILE A 10 14.273 4.256 -7.402 1.00 71.14 C ATOM 170 CG1 ILE A 10 14.059 2.808 -7.865 1.00 11.34 C ATOM 171 CG2 ILE A 10 14.561 5.063 -8.678 1.00 31.02 C ATOM 172 CD1 ILE A 10 15.257 2.213 -8.620 1.00 52.30 C ATOM 0 H ILE A 10 14.505 3.398 -4.720 1.00 54.22 H new ATOM 0 HA ILE A 10 16.313 4.417 -6.844 1.00 41.20 H new ATOM 0 HB ILE A 10 13.382 4.625 -6.894 1.00 71.14 H new ATOM 0 HG12 ILE A 10 13.845 2.187 -6.995 1.00 11.34 H new ATOM 0 HG13 ILE A 10 13.180 2.769 -8.509 1.00 11.34 H new ATOM 0 HG21 ILE A 10 13.761 4.900 -9.400 1.00 31.02 H new ATOM 0 HG22 ILE A 10 14.618 6.124 -8.433 1.00 31.02 H new ATOM 0 HG23 ILE A 10 15.509 4.739 -9.108 1.00 31.02 H new ATOM 0 HD11 ILE A 10 15.029 1.188 -8.914 1.00 52.30 H new ATOM 0 HD12 ILE A 10 15.459 2.809 -9.510 1.00 52.30 H new ATOM 0 HD13 ILE A 10 16.134 2.218 -7.973 1.00 52.30 H new ATOM 184 N THR A 11 15.504 6.827 -6.153 1.00 51.21 N ATOM 185 CA THR A 11 15.244 8.172 -5.670 1.00 3.55 C ATOM 186 C THR A 11 14.067 8.776 -6.418 1.00 71.23 C ATOM 187 O THR A 11 13.690 8.313 -7.499 1.00 1.25 O ATOM 188 CB THR A 11 16.482 9.070 -5.857 1.00 12.21 C ATOM 189 OG1 THR A 11 17.507 8.442 -6.604 1.00 2.35 O ATOM 190 CG2 THR A 11 17.046 9.494 -4.507 1.00 0.34 C ATOM 0 H THR A 11 15.985 6.816 -7.053 1.00 51.21 H new ATOM 0 HA THR A 11 15.010 8.111 -4.607 1.00 3.55 H new ATOM 0 HB THR A 11 16.143 9.942 -6.416 1.00 12.21 H new ATOM 0 HG1 THR A 11 18.267 9.054 -6.695 1.00 2.35 H new ATOM 0 HG21 THR A 11 17.920 10.127 -4.660 1.00 0.34 H new ATOM 0 HG22 THR A 11 16.288 10.049 -3.954 1.00 0.34 H new ATOM 0 HG23 THR A 11 17.334 8.609 -3.939 1.00 0.34 H new ATOM 198 N LEU A 12 13.524 9.854 -5.863 1.00 24.31 N ATOM 199 CA LEU A 12 12.683 10.770 -6.611 1.00 62.43 C ATOM 200 C LEU A 12 13.591 11.683 -7.423 1.00 3.14 C ATOM 201 O LEU A 12 14.734 11.953 -7.031 1.00 43.31 O ATOM 202 CB LEU A 12 11.794 11.577 -5.654 1.00 15.22 C ATOM 203 CG LEU A 12 11.088 10.689 -4.617 1.00 74.24 C ATOM 204 CD1 LEU A 12 10.159 11.496 -3.727 1.00 40.11 C ATOM 205 CD2 LEU A 12 10.291 9.532 -5.210 1.00 21.22 C ATOM 0 H LEU A 12 13.656 10.113 -4.885 1.00 24.31 H new ATOM 0 HA LEU A 12 12.021 10.222 -7.282 1.00 62.43 H new ATOM 0 HB2 LEU A 12 12.402 12.320 -5.138 1.00 15.22 H new ATOM 0 HB3 LEU A 12 11.046 12.122 -6.230 1.00 15.22 H new ATOM 0 HG LEU A 12 11.907 10.264 -4.037 1.00 74.24 H new ATOM 0 HD11 LEU A 12 9.678 10.834 -3.007 1.00 40.11 H new ATOM 0 HD12 LEU A 12 10.733 12.255 -3.195 1.00 40.11 H new ATOM 0 HD13 LEU A 12 9.398 11.980 -4.339 1.00 40.11 H new ATOM 0 HD21 LEU A 12 9.828 8.960 -4.406 1.00 21.22 H new ATOM 0 HD22 LEU A 12 9.517 9.924 -5.870 1.00 21.22 H new ATOM 0 HD23 LEU A 12 10.958 8.884 -5.779 1.00 21.22 H new ATOM 217 N ASP A 13 13.054 12.202 -8.520 1.00 42.52 N ATOM 218 CA ASP A 13 13.711 13.236 -9.318 1.00 2.34 C ATOM 219 C ASP A 13 13.547 14.582 -8.612 1.00 44.41 C ATOM 220 O ASP A 13 14.404 15.457 -8.710 1.00 73.40 O ATOM 221 CB ASP A 13 13.120 13.281 -10.736 1.00 44.33 C ATOM 222 CG ASP A 13 14.227 13.322 -11.789 1.00 10.34 C ATOM 223 OD1 ASP A 13 14.719 14.412 -12.151 1.00 30.44 O ATOM 224 OD2 ASP A 13 14.594 12.231 -12.288 1.00 44.54 O ATOM 0 H ASP A 13 12.145 11.917 -8.885 1.00 42.52 H new ATOM 0 HA ASP A 13 14.772 13.008 -9.414 1.00 2.34 H new ATOM 0 HB2 ASP A 13 12.490 12.407 -10.899 1.00 44.33 H new ATOM 0 HB3 ASP A 13 12.481 14.158 -10.840 1.00 44.33 H new ATOM 229 N LYS A 14 12.472 14.723 -7.823 1.00 4.41 N ATOM 230 CA LYS A 14 12.137 15.905 -7.047 1.00 14.51 C ATOM 231 C LYS A 14 12.035 15.516 -5.560 1.00 3.25 C ATOM 232 O LYS A 14 10.948 15.463 -4.992 1.00 71.34 O ATOM 233 CB LYS A 14 10.854 16.476 -7.659 1.00 74.24 C ATOM 234 CG LYS A 14 10.613 17.971 -7.431 1.00 71.41 C ATOM 235 CD LYS A 14 10.753 18.433 -5.976 1.00 52.34 C ATOM 236 CE LYS A 14 10.194 19.840 -5.743 1.00 10.51 C ATOM 237 NZ LYS A 14 10.785 20.871 -6.620 1.00 74.03 N ATOM 0 H LYS A 14 11.787 13.976 -7.710 1.00 4.41 H new ATOM 0 HA LYS A 14 12.896 16.687 -7.083 1.00 14.51 H new ATOM 0 HB2 LYS A 14 10.873 16.290 -8.733 1.00 74.24 H new ATOM 0 HB3 LYS A 14 10.005 15.925 -7.255 1.00 74.24 H new ATOM 0 HG2 LYS A 14 11.315 18.535 -8.045 1.00 71.41 H new ATOM 0 HG3 LYS A 14 9.611 18.220 -7.781 1.00 71.41 H new ATOM 0 HD2 LYS A 14 10.235 17.729 -5.325 1.00 52.34 H new ATOM 0 HD3 LYS A 14 11.806 18.414 -5.693 1.00 52.34 H new ATOM 0 HE2 LYS A 14 9.115 19.822 -5.896 1.00 10.51 H new ATOM 0 HE3 LYS A 14 10.364 20.120 -4.703 1.00 10.51 H new ATOM 0 HZ1 LYS A 14 10.396 21.803 -6.371 1.00 74.03 H new ATOM 0 HZ2 LYS A 14 11.818 20.882 -6.496 1.00 74.03 H new ATOM 0 HZ3 LYS A 14 10.558 20.655 -7.612 1.00 74.03 H new ATOM 251 N PRO A 15 13.158 15.218 -4.895 1.00 11.15 N ATOM 252 CA PRO A 15 13.193 14.786 -3.501 1.00 4.55 C ATOM 253 C PRO A 15 13.175 15.984 -2.537 1.00 74.21 C ATOM 254 O PRO A 15 14.100 16.171 -1.744 1.00 2.34 O ATOM 255 CB PRO A 15 14.535 14.051 -3.414 1.00 15.22 C ATOM 256 CG PRO A 15 15.425 14.892 -4.324 1.00 61.13 C ATOM 257 CD PRO A 15 14.483 15.213 -5.476 1.00 41.20 C ATOM 0 HA PRO A 15 12.333 14.176 -3.223 1.00 4.55 H new ATOM 0 HB2 PRO A 15 14.914 14.017 -2.393 1.00 15.22 H new ATOM 0 HB3 PRO A 15 14.458 13.020 -3.760 1.00 15.22 H new ATOM 0 HG2 PRO A 15 15.783 15.793 -3.826 1.00 61.13 H new ATOM 0 HG3 PRO A 15 16.305 14.341 -4.657 1.00 61.13 H new ATOM 0 HD2 PRO A 15 14.721 16.179 -5.921 1.00 41.20 H new ATOM 0 HD3 PRO A 15 14.562 14.469 -6.268 1.00 41.20 H new ATOM 265 N ILE A 16 12.110 16.782 -2.519 1.00 22.24 N ATOM 266 CA ILE A 16 12.034 17.943 -1.633 1.00 54.53 C ATOM 267 C ILE A 16 10.792 17.822 -0.761 1.00 53.11 C ATOM 268 O ILE A 16 9.812 17.178 -1.129 1.00 40.13 O ATOM 269 CB ILE A 16 12.197 19.270 -2.427 1.00 43.52 C ATOM 270 CG1 ILE A 16 13.677 19.513 -2.822 1.00 41.32 C ATOM 271 CG2 ILE A 16 11.698 20.523 -1.687 1.00 31.04 C ATOM 272 CD1 ILE A 16 14.078 18.955 -4.185 1.00 14.31 C ATOM 0 H ILE A 16 11.288 16.647 -3.107 1.00 22.24 H new ATOM 0 HA ILE A 16 12.875 17.968 -0.940 1.00 54.53 H new ATOM 0 HB ILE A 16 11.570 19.129 -3.307 1.00 43.52 H new ATOM 0 HG12 ILE A 16 13.868 20.586 -2.814 1.00 41.32 H new ATOM 0 HG13 ILE A 16 14.319 19.069 -2.061 1.00 41.32 H new ATOM 0 HG21 ILE A 16 11.851 21.401 -2.315 1.00 31.04 H new ATOM 0 HG22 ILE A 16 10.636 20.416 -1.465 1.00 31.04 H new ATOM 0 HG23 ILE A 16 12.253 20.641 -0.756 1.00 31.04 H new ATOM 0 HD11 ILE A 16 15.129 19.174 -4.373 1.00 14.31 H new ATOM 0 HD12 ILE A 16 13.924 17.876 -4.196 1.00 14.31 H new ATOM 0 HD13 ILE A 16 13.467 19.416 -4.961 1.00 14.31 H new ATOM 284 N ALA A 17 10.879 18.442 0.412 1.00 12.15 N ATOM 285 CA ALA A 17 9.823 18.572 1.398 1.00 62.41 C ATOM 286 C ALA A 17 8.577 19.144 0.724 1.00 15.54 C ATOM 287 O ALA A 17 8.574 20.304 0.306 1.00 71.03 O ATOM 288 CB ALA A 17 10.333 19.475 2.522 1.00 1.54 C ATOM 0 H ALA A 17 11.743 18.893 0.713 1.00 12.15 H new ATOM 0 HA ALA A 17 9.552 17.606 1.824 1.00 62.41 H new ATOM 0 HB1 ALA A 17 9.556 19.589 3.278 1.00 1.54 H new ATOM 0 HB2 ALA A 17 11.217 19.027 2.975 1.00 1.54 H new ATOM 0 HB3 ALA A 17 10.590 20.453 2.115 1.00 1.54 H new ATOM 294 N GLY A 18 7.539 18.328 0.575 1.00 75.44 N ATOM 295 CA GLY A 18 6.303 18.740 -0.063 1.00 43.21 C ATOM 296 C GLY A 18 5.268 17.626 -0.018 1.00 33.34 C ATOM 297 O GLY A 18 4.092 17.910 0.207 1.00 13.15 O ATOM 0 H GLY A 18 7.536 17.360 0.896 1.00 75.44 H new ATOM 0 HA2 GLY A 18 5.910 19.626 0.435 1.00 43.21 H new ATOM 0 HA3 GLY A 18 6.499 19.017 -1.099 1.00 43.21 H new ATOM 301 N GLU A 19 5.692 16.373 -0.178 1.00 71.33 N ATOM 302 CA GLU A 19 4.894 15.183 0.104 1.00 3.22 C ATOM 303 C GLU A 19 4.949 14.846 1.602 1.00 15.41 C ATOM 304 O GLU A 19 5.820 15.365 2.319 1.00 32.01 O ATOM 305 CB GLU A 19 5.393 14.019 -0.781 1.00 60.31 C ATOM 306 CG GLU A 19 4.657 13.883 -2.130 1.00 15.53 C ATOM 307 CD GLU A 19 4.374 15.207 -2.857 1.00 4.14 C ATOM 308 OE1 GLU A 19 3.431 15.917 -2.420 1.00 71.23 O ATOM 309 OE2 GLU A 19 5.048 15.512 -3.868 1.00 10.24 O ATOM 0 H GLU A 19 6.628 16.153 -0.518 1.00 71.33 H new ATOM 0 HA GLU A 19 3.847 15.366 -0.138 1.00 3.22 H new ATOM 0 HB2 GLU A 19 6.457 14.156 -0.974 1.00 60.31 H new ATOM 0 HB3 GLU A 19 5.287 13.086 -0.227 1.00 60.31 H new ATOM 0 HG2 GLU A 19 5.250 13.246 -2.786 1.00 15.53 H new ATOM 0 HG3 GLU A 19 3.710 13.371 -1.959 1.00 15.53 H new ATOM 316 N PRO A 20 4.054 13.966 2.096 1.00 2.23 N ATOM 317 CA PRO A 20 4.245 13.283 3.373 1.00 73.33 C ATOM 318 C PRO A 20 5.549 12.468 3.363 1.00 43.53 C ATOM 319 O PRO A 20 6.225 12.331 2.334 1.00 60.43 O ATOM 320 CB PRO A 20 3.007 12.392 3.552 1.00 23.34 C ATOM 321 CG PRO A 20 2.571 12.113 2.120 1.00 61.10 C ATOM 322 CD PRO A 20 2.881 13.429 1.414 1.00 23.43 C ATOM 0 HA PRO A 20 4.342 13.982 4.204 1.00 73.33 H new ATOM 0 HB2 PRO A 20 3.246 11.473 4.087 1.00 23.34 H new ATOM 0 HB3 PRO A 20 2.226 12.897 4.120 1.00 23.34 H new ATOM 0 HG2 PRO A 20 3.122 11.280 1.684 1.00 61.10 H new ATOM 0 HG3 PRO A 20 1.512 11.861 2.061 1.00 61.10 H new ATOM 0 HD2 PRO A 20 3.081 13.269 0.355 1.00 23.43 H new ATOM 0 HD3 PRO A 20 2.039 14.118 1.479 1.00 23.43 H new ATOM 330 N GLN A 21 5.920 11.924 4.520 1.00 11.41 N ATOM 331 CA GLN A 21 7.178 11.224 4.722 1.00 23.04 C ATOM 332 C GLN A 21 6.850 9.797 5.151 1.00 11.13 C ATOM 333 O GLN A 21 6.206 9.622 6.184 1.00 20.11 O ATOM 334 CB GLN A 21 8.022 11.995 5.752 1.00 20.03 C ATOM 335 CG GLN A 21 9.491 11.553 5.736 1.00 74.12 C ATOM 336 CD GLN A 21 10.310 12.306 6.785 1.00 54.12 C ATOM 337 OE1 GLN A 21 10.006 12.257 7.977 1.00 24.34 O ATOM 338 NE2 GLN A 21 11.342 13.027 6.370 1.00 72.13 N ATOM 0 H GLN A 21 5.340 11.961 5.358 1.00 11.41 H new ATOM 0 HA GLN A 21 7.775 11.171 3.811 1.00 23.04 H new ATOM 0 HB2 GLN A 21 7.962 13.063 5.543 1.00 20.03 H new ATOM 0 HB3 GLN A 21 7.608 11.841 6.748 1.00 20.03 H new ATOM 0 HG2 GLN A 21 9.552 10.481 5.924 1.00 74.12 H new ATOM 0 HG3 GLN A 21 9.915 11.728 4.747 1.00 74.12 H new ATOM 0 HE21 GLN A 21 11.578 13.055 5.378 1.00 72.13 H new ATOM 0 HE22 GLN A 21 11.900 13.554 7.042 1.00 72.13 H new ATOM 347 N VAL A 22 7.286 8.821 4.349 1.00 20.11 N ATOM 348 CA VAL A 22 6.961 7.396 4.408 1.00 4.52 C ATOM 349 C VAL A 22 5.503 7.186 4.016 1.00 34.35 C ATOM 350 O VAL A 22 4.579 7.625 4.703 1.00 63.31 O ATOM 351 CB VAL A 22 7.329 6.739 5.752 1.00 35.33 C ATOM 352 CG1 VAL A 22 7.156 5.212 5.684 1.00 0.52 C ATOM 353 CG2 VAL A 22 8.790 7.033 6.118 1.00 20.11 C ATOM 0 H VAL A 22 7.926 9.025 3.581 1.00 20.11 H new ATOM 0 HA VAL A 22 7.587 6.878 3.682 1.00 4.52 H new ATOM 0 HB VAL A 22 6.661 7.156 6.506 1.00 35.33 H new ATOM 0 HG11 VAL A 22 7.422 4.772 6.645 1.00 0.52 H new ATOM 0 HG12 VAL A 22 6.118 4.973 5.451 1.00 0.52 H new ATOM 0 HG13 VAL A 22 7.805 4.807 4.908 1.00 0.52 H new ATOM 0 HG21 VAL A 22 9.029 6.560 7.070 1.00 20.11 H new ATOM 0 HG22 VAL A 22 9.446 6.638 5.342 1.00 20.11 H new ATOM 0 HG23 VAL A 22 8.934 8.110 6.202 1.00 20.11 H new ATOM 363 N LEU A 23 5.280 6.528 2.879 1.00 23.35 N ATOM 364 CA LEU A 23 3.948 6.252 2.364 1.00 40.44 C ATOM 365 C LEU A 23 4.003 4.962 1.558 1.00 72.11 C ATOM 366 O LEU A 23 5.084 4.525 1.172 1.00 63.33 O ATOM 367 CB LEU A 23 3.489 7.446 1.510 1.00 15.22 C ATOM 368 CG LEU A 23 1.969 7.679 1.507 1.00 74.00 C ATOM 369 CD1 LEU A 23 1.471 8.216 2.850 1.00 4.15 C ATOM 370 CD2 LEU A 23 1.669 8.735 0.441 1.00 62.40 C ATOM 0 H LEU A 23 6.029 6.170 2.287 1.00 23.35 H new ATOM 0 HA LEU A 23 3.227 6.121 3.171 1.00 40.44 H new ATOM 0 HB2 LEU A 23 3.982 8.348 1.874 1.00 15.22 H new ATOM 0 HB3 LEU A 23 3.823 7.292 0.484 1.00 15.22 H new ATOM 0 HG LEU A 23 1.471 6.729 1.311 1.00 74.00 H new ATOM 0 HD11 LEU A 23 0.392 8.366 2.804 1.00 4.15 H new ATOM 0 HD12 LEU A 23 1.704 7.499 3.637 1.00 4.15 H new ATOM 0 HD13 LEU A 23 1.961 9.165 3.066 1.00 4.15 H new ATOM 0 HD21 LEU A 23 0.596 8.926 0.410 1.00 62.40 H new ATOM 0 HD22 LEU A 23 2.196 9.658 0.685 1.00 62.40 H new ATOM 0 HD23 LEU A 23 2.001 8.374 -0.532 1.00 62.40 H new ATOM 382 N GLU A 24 2.862 4.330 1.308 1.00 51.30 N ATOM 383 CA GLU A 24 2.810 2.986 0.747 1.00 20.03 C ATOM 384 C GLU A 24 1.578 2.910 -0.147 1.00 4.54 C ATOM 385 O GLU A 24 0.526 3.432 0.235 1.00 3.22 O ATOM 386 CB GLU A 24 2.759 2.015 1.930 1.00 75.11 C ATOM 387 CG GLU A 24 2.811 0.525 1.570 1.00 42.54 C ATOM 388 CD GLU A 24 2.991 -0.374 2.806 1.00 63.22 C ATOM 389 OE1 GLU A 24 3.320 0.130 3.906 1.00 71.42 O ATOM 390 OE2 GLU A 24 2.890 -1.614 2.673 1.00 42.22 O ATOM 0 H GLU A 24 1.944 4.737 1.489 1.00 51.30 H new ATOM 0 HA GLU A 24 3.675 2.730 0.135 1.00 20.03 H new ATOM 0 HB2 GLU A 24 3.593 2.238 2.596 1.00 75.11 H new ATOM 0 HB3 GLU A 24 1.844 2.203 2.491 1.00 75.11 H new ATOM 0 HG2 GLU A 24 1.892 0.247 1.053 1.00 42.54 H new ATOM 0 HG3 GLU A 24 3.633 0.351 0.875 1.00 42.54 H new ATOM 397 N PHE A 25 1.703 2.311 -1.332 1.00 4.52 N ATOM 398 CA PHE A 25 0.644 2.253 -2.327 1.00 53.52 C ATOM 399 C PHE A 25 0.569 0.871 -2.942 1.00 40.51 C ATOM 400 O PHE A 25 1.573 0.283 -3.347 1.00 34.21 O ATOM 401 CB PHE A 25 0.873 3.244 -3.466 1.00 73.11 C ATOM 402 CG PHE A 25 0.721 4.695 -3.098 1.00 40.13 C ATOM 403 CD1 PHE A 25 -0.551 5.296 -3.120 1.00 60.14 C ATOM 404 CD2 PHE A 25 1.865 5.459 -2.819 1.00 15.35 C ATOM 405 CE1 PHE A 25 -0.677 6.672 -2.886 1.00 55.53 C ATOM 406 CE2 PHE A 25 1.739 6.839 -2.608 1.00 33.32 C ATOM 407 CZ PHE A 25 0.469 7.440 -2.631 1.00 64.01 C ATOM 0 H PHE A 25 2.561 1.845 -1.628 1.00 4.52 H new ATOM 0 HA PHE A 25 -0.280 2.502 -1.805 1.00 53.52 H new ATOM 0 HB2 PHE A 25 1.877 3.090 -3.863 1.00 73.11 H new ATOM 0 HB3 PHE A 25 0.174 3.015 -4.270 1.00 73.11 H new ATOM 0 HD1 PHE A 25 -1.429 4.698 -3.317 1.00 60.14 H new ATOM 0 HD2 PHE A 25 2.835 4.987 -2.767 1.00 15.35 H new ATOM 0 HE1 PHE A 25 -1.651 7.139 -2.902 1.00 55.53 H new ATOM 0 HE2 PHE A 25 2.618 7.440 -2.428 1.00 33.32 H new ATOM 0 HZ PHE A 25 0.374 8.501 -2.451 1.00 64.01 H new ATOM 417 N PHE A 26 -0.663 0.405 -3.076 1.00 35.05 N ATOM 418 CA PHE A 26 -1.048 -0.857 -3.668 1.00 54.40 C ATOM 419 C PHE A 26 -2.472 -0.719 -4.199 1.00 22.25 C ATOM 420 O PHE A 26 -3.142 0.282 -3.920 1.00 43.32 O ATOM 421 CB PHE A 26 -0.909 -1.981 -2.633 1.00 21.33 C ATOM 422 CG PHE A 26 -1.709 -1.904 -1.332 1.00 24.05 C ATOM 423 CD1 PHE A 26 -1.674 -0.779 -0.476 1.00 52.44 C ATOM 424 CD2 PHE A 26 -2.419 -3.045 -0.910 1.00 60.20 C ATOM 425 CE1 PHE A 26 -2.391 -0.774 0.729 1.00 42.24 C ATOM 426 CE2 PHE A 26 -3.111 -3.053 0.314 1.00 20.24 C ATOM 427 CZ PHE A 26 -3.100 -1.915 1.132 1.00 3.15 C ATOM 0 H PHE A 26 -1.470 0.937 -2.751 1.00 35.05 H new ATOM 0 HA PHE A 26 -0.396 -1.118 -4.501 1.00 54.40 H new ATOM 0 HB2 PHE A 26 -1.176 -2.916 -3.127 1.00 21.33 H new ATOM 0 HB3 PHE A 26 0.145 -2.051 -2.365 1.00 21.33 H new ATOM 0 HD1 PHE A 26 -1.089 0.085 -0.753 1.00 52.44 H new ATOM 0 HD2 PHE A 26 -2.432 -3.926 -1.535 1.00 60.20 H new ATOM 0 HE1 PHE A 26 -2.397 0.111 1.348 1.00 42.24 H new ATOM 0 HE2 PHE A 26 -3.651 -3.936 0.624 1.00 20.24 H new ATOM 0 HZ PHE A 26 -3.636 -1.917 2.070 1.00 3.15 H new ATOM 437 N SER A 27 -2.961 -1.718 -4.937 1.00 73.02 N ATOM 438 CA SER A 27 -4.366 -1.798 -5.309 1.00 44.41 C ATOM 439 C SER A 27 -4.863 -3.222 -5.146 1.00 2.43 C ATOM 440 O SER A 27 -4.078 -4.153 -5.326 1.00 51.15 O ATOM 441 CB SER A 27 -4.586 -1.311 -6.735 1.00 0.10 C ATOM 442 OG SER A 27 -5.869 -0.718 -6.834 1.00 12.11 O ATOM 0 H SER A 27 -2.393 -2.488 -5.290 1.00 73.02 H new ATOM 0 HA SER A 27 -4.936 -1.146 -4.646 1.00 44.41 H new ATOM 0 HB2 SER A 27 -3.817 -0.589 -7.008 1.00 0.10 H new ATOM 0 HB3 SER A 27 -4.503 -2.144 -7.433 1.00 0.10 H new ATOM 0 HG SER A 27 -6.013 -0.402 -7.750 1.00 12.11 H new ATOM 448 N PHE A 28 -6.166 -3.410 -4.915 1.00 43.24 N ATOM 449 CA PHE A 28 -6.697 -4.760 -4.797 1.00 4.53 C ATOM 450 C PHE A 28 -6.642 -5.550 -6.109 1.00 13.43 C ATOM 451 O PHE A 28 -6.713 -6.770 -6.065 1.00 12.10 O ATOM 452 CB PHE A 28 -8.035 -4.810 -4.032 1.00 14.50 C ATOM 453 CG PHE A 28 -9.400 -4.560 -4.648 1.00 12.53 C ATOM 454 CD1 PHE A 28 -9.634 -4.232 -5.996 1.00 73.33 C ATOM 455 CD2 PHE A 28 -10.500 -4.634 -3.768 1.00 43.13 C ATOM 456 CE1 PHE A 28 -10.935 -3.922 -6.421 1.00 21.23 C ATOM 457 CE2 PHE A 28 -11.806 -4.372 -4.212 1.00 43.24 C ATOM 458 CZ PHE A 28 -12.016 -3.973 -5.538 1.00 34.43 C ATOM 0 H PHE A 28 -6.852 -2.663 -4.809 1.00 43.24 H new ATOM 0 HA PHE A 28 -6.015 -5.315 -4.153 1.00 4.53 H new ATOM 0 HB2 PHE A 28 -8.086 -5.802 -3.583 1.00 14.50 H new ATOM 0 HB3 PHE A 28 -7.940 -4.095 -3.215 1.00 14.50 H new ATOM 0 HD1 PHE A 28 -8.816 -4.219 -6.701 1.00 73.33 H new ATOM 0 HD2 PHE A 28 -10.335 -4.897 -2.734 1.00 43.13 H new ATOM 0 HE1 PHE A 28 -11.103 -3.639 -7.450 1.00 21.23 H new ATOM 0 HE2 PHE A 28 -12.642 -4.477 -3.536 1.00 43.24 H new ATOM 0 HZ PHE A 28 -13.007 -3.707 -5.875 1.00 34.43 H new ATOM 468 N TYR A 29 -6.441 -4.898 -7.255 1.00 43.53 N ATOM 469 CA TYR A 29 -6.298 -5.560 -8.550 1.00 13.34 C ATOM 470 C TYR A 29 -4.821 -5.833 -8.907 1.00 54.22 C ATOM 471 O TYR A 29 -4.541 -6.333 -9.997 1.00 2.21 O ATOM 472 CB TYR A 29 -6.925 -4.639 -9.609 1.00 60.24 C ATOM 473 CG TYR A 29 -8.420 -4.378 -9.514 1.00 52.24 C ATOM 474 CD1 TYR A 29 -9.321 -5.458 -9.522 1.00 20.22 C ATOM 475 CD2 TYR A 29 -8.918 -3.059 -9.534 1.00 11.50 C ATOM 476 CE1 TYR A 29 -10.697 -5.238 -9.701 1.00 2.12 C ATOM 477 CE2 TYR A 29 -10.295 -2.827 -9.713 1.00 2.40 C ATOM 478 CZ TYR A 29 -11.175 -3.922 -9.884 1.00 54.24 C ATOM 479 OH TYR A 29 -12.475 -3.706 -10.214 1.00 14.21 O ATOM 0 H TYR A 29 -6.372 -3.882 -7.309 1.00 43.53 H new ATOM 0 HA TYR A 29 -6.797 -6.528 -8.512 1.00 13.34 H new ATOM 0 HB2 TYR A 29 -6.412 -3.678 -9.566 1.00 60.24 H new ATOM 0 HB3 TYR A 29 -6.720 -5.066 -10.591 1.00 60.24 H new ATOM 0 HD1 TYR A 29 -8.952 -6.464 -9.389 1.00 20.22 H new ATOM 0 HD2 TYR A 29 -8.242 -2.226 -9.412 1.00 11.50 H new ATOM 0 HE1 TYR A 29 -11.385 -6.070 -9.699 1.00 2.12 H new ATOM 0 HE2 TYR A 29 -10.678 -1.817 -9.720 1.00 2.40 H new ATOM 0 HH TYR A 29 -13.031 -3.769 -9.410 1.00 14.21 H new ATOM 489 N CYS A 30 -3.854 -5.456 -8.062 1.00 60.11 N ATOM 490 CA CYS A 30 -2.439 -5.675 -8.344 1.00 1.55 C ATOM 491 C CYS A 30 -2.035 -7.109 -7.977 1.00 0.42 C ATOM 492 O CYS A 30 -2.313 -7.522 -6.852 1.00 63.34 O ATOM 493 CB CYS A 30 -1.718 -4.698 -7.410 1.00 63.23 C ATOM 494 SG CYS A 30 0.074 -4.788 -7.295 1.00 42.11 S ATOM 0 H CYS A 30 -4.033 -4.994 -7.170 1.00 60.11 H new ATOM 0 HA CYS A 30 -2.201 -5.527 -9.397 1.00 1.55 H new ATOM 0 HB2 CYS A 30 -1.980 -3.687 -7.721 1.00 63.23 H new ATOM 0 HB3 CYS A 30 -2.122 -4.838 -6.407 1.00 63.23 H new ATOM 499 N PRO A 31 -1.180 -7.793 -8.756 1.00 60.00 N ATOM 500 CA PRO A 31 -0.844 -9.193 -8.488 1.00 62.30 C ATOM 501 C PRO A 31 0.348 -9.339 -7.540 1.00 74.04 C ATOM 502 O PRO A 31 0.378 -10.240 -6.700 1.00 32.41 O ATOM 503 CB PRO A 31 -0.494 -9.779 -9.859 1.00 40.11 C ATOM 504 CG PRO A 31 0.047 -8.576 -10.638 1.00 31.23 C ATOM 505 CD PRO A 31 -0.795 -7.417 -10.108 1.00 73.31 C ATOM 0 HA PRO A 31 -1.674 -9.703 -7.999 1.00 62.30 H new ATOM 0 HB2 PRO A 31 0.250 -10.572 -9.778 1.00 40.11 H new ATOM 0 HB3 PRO A 31 -1.369 -10.211 -10.345 1.00 40.11 H new ATOM 0 HG2 PRO A 31 1.110 -8.420 -10.453 1.00 31.23 H new ATOM 0 HG3 PRO A 31 -0.074 -8.704 -11.714 1.00 31.23 H new ATOM 0 HD2 PRO A 31 -0.225 -6.488 -10.108 1.00 73.31 H new ATOM 0 HD3 PRO A 31 -1.673 -7.253 -10.733 1.00 73.31 H new ATOM 513 N HIS A 32 1.335 -8.452 -7.677 1.00 15.32 N ATOM 514 CA HIS A 32 2.510 -8.381 -6.821 1.00 13.33 C ATOM 515 C HIS A 32 2.065 -8.057 -5.406 1.00 52.30 C ATOM 516 O HIS A 32 2.432 -8.738 -4.452 1.00 71.40 O ATOM 517 CB HIS A 32 3.460 -7.311 -7.358 1.00 75.13 C ATOM 518 CG HIS A 32 3.956 -7.661 -8.733 1.00 4.51 C ATOM 519 ND1 HIS A 32 4.809 -8.680 -9.089 1.00 22.02 N ATOM 520 CD2 HIS A 32 3.426 -7.155 -9.878 1.00 1.24 C ATOM 521 CE1 HIS A 32 4.798 -8.766 -10.429 1.00 71.04 C ATOM 522 NE2 HIS A 32 3.973 -7.846 -10.958 1.00 12.23 N ATOM 0 H HIS A 32 1.334 -7.743 -8.411 1.00 15.32 H new ATOM 0 HA HIS A 32 3.038 -9.335 -6.813 1.00 13.33 H new ATOM 0 HB2 HIS A 32 2.948 -6.349 -7.388 1.00 75.13 H new ATOM 0 HB3 HIS A 32 4.307 -7.201 -6.681 1.00 75.13 H new ATOM 0 HD2 HIS A 32 2.704 -6.354 -9.940 1.00 1.24 H new ATOM 0 HE1 HIS A 32 5.373 -9.477 -11.003 1.00 71.04 H new ATOM 0 HE2 HIS A 32 3.785 -7.686 -11.948 1.00 12.23 H new ATOM 530 N CYS A 33 1.207 -7.042 -5.299 1.00 11.15 N ATOM 531 CA CYS A 33 0.680 -6.562 -4.045 1.00 60.32 C ATOM 532 C CYS A 33 -0.038 -7.685 -3.281 1.00 33.32 C ATOM 533 O CYS A 33 -0.013 -7.663 -2.058 1.00 72.03 O ATOM 534 CB CYS A 33 -0.275 -5.393 -4.292 1.00 31.35 C ATOM 535 SG CYS A 33 0.301 -4.063 -5.401 1.00 74.03 S ATOM 0 H CYS A 33 0.858 -6.527 -6.107 1.00 11.15 H new ATOM 0 HA CYS A 33 1.514 -6.218 -3.433 1.00 60.32 H new ATOM 0 HB2 CYS A 33 -1.202 -5.795 -4.700 1.00 31.35 H new ATOM 0 HB3 CYS A 33 -0.519 -4.947 -3.328 1.00 31.35 H new ATOM 540 N TYR A 34 -0.646 -8.671 -3.965 1.00 53.40 N ATOM 541 CA TYR A 34 -1.232 -9.842 -3.311 1.00 15.42 C ATOM 542 C TYR A 34 -0.168 -10.595 -2.541 1.00 15.24 C ATOM 543 O TYR A 34 -0.296 -10.787 -1.339 1.00 23.43 O ATOM 544 CB TYR A 34 -1.887 -10.791 -4.321 1.00 23.12 C ATOM 545 CG TYR A 34 -2.667 -11.921 -3.679 1.00 33.03 C ATOM 546 CD1 TYR A 34 -4.027 -11.752 -3.358 1.00 22.30 C ATOM 547 CD2 TYR A 34 -2.024 -13.135 -3.369 1.00 23.34 C ATOM 548 CE1 TYR A 34 -4.705 -12.751 -2.643 1.00 15.11 C ATOM 549 CE2 TYR A 34 -2.699 -14.137 -2.650 1.00 1.43 C ATOM 550 CZ TYR A 34 -4.030 -13.919 -2.237 1.00 63.42 C ATOM 551 OH TYR A 34 -4.636 -14.779 -1.380 1.00 4.42 O ATOM 0 H TYR A 34 -0.742 -8.674 -4.980 1.00 53.40 H new ATOM 0 HA TYR A 34 -2.003 -9.481 -2.630 1.00 15.42 H new ATOM 0 HB2 TYR A 34 -2.556 -10.218 -4.963 1.00 23.12 H new ATOM 0 HB3 TYR A 34 -1.114 -11.214 -4.963 1.00 23.12 H new ATOM 0 HD1 TYR A 34 -4.547 -10.856 -3.661 1.00 22.30 H new ATOM 0 HD2 TYR A 34 -1.004 -13.298 -3.686 1.00 23.34 H new ATOM 0 HE1 TYR A 34 -5.750 -12.624 -2.403 1.00 15.11 H new ATOM 0 HE2 TYR A 34 -2.202 -15.067 -2.416 1.00 1.43 H new ATOM 0 HH TYR A 34 -4.722 -14.357 -0.500 1.00 4.42 H new ATOM 561 N GLN A 35 0.902 -11.016 -3.219 1.00 54.22 N ATOM 562 CA GLN A 35 1.972 -11.757 -2.570 1.00 1.52 C ATOM 563 C GLN A 35 2.471 -10.961 -1.366 1.00 23.24 C ATOM 564 O GLN A 35 2.658 -11.535 -0.300 1.00 13.52 O ATOM 565 CB GLN A 35 3.125 -12.032 -3.550 1.00 64.10 C ATOM 566 CG GLN A 35 2.777 -12.514 -4.959 1.00 12.54 C ATOM 567 CD GLN A 35 2.108 -13.875 -5.156 1.00 31.33 C ATOM 568 OE1 GLN A 35 1.355 -14.415 -4.217 1.00 1.12 O flip ATOM 569 NE2 GLN A 35 2.198 -14.416 -6.255 1.00 31.45 N flip ATOM 0 H GLN A 35 1.045 -10.854 -4.216 1.00 54.22 H new ATOM 0 HA GLN A 35 1.587 -12.720 -2.236 1.00 1.52 H new ATOM 0 HB2 GLN A 35 3.706 -11.115 -3.646 1.00 64.10 H new ATOM 0 HB3 GLN A 35 3.778 -12.777 -3.095 1.00 64.10 H new ATOM 0 HG2 GLN A 35 2.125 -11.764 -5.407 1.00 12.54 H new ATOM 0 HG3 GLN A 35 3.701 -12.520 -5.538 1.00 12.54 H new ATOM 0 HE21 GLN A 35 2.780 -14.000 -6.982 1.00 31.45 H new ATOM 0 HE22 GLN A 35 1.691 -15.281 -6.440 1.00 31.45 H new ATOM 578 N PHE A 36 2.621 -9.648 -1.516 1.00 44.51 N ATOM 579 CA PHE A 36 3.162 -8.786 -0.488 1.00 61.11 C ATOM 580 C PHE A 36 2.217 -8.631 0.712 1.00 41.43 C ATOM 581 O PHE A 36 2.722 -8.254 1.765 1.00 44.20 O ATOM 582 CB PHE A 36 3.540 -7.428 -1.096 1.00 12.41 C ATOM 583 CG PHE A 36 4.846 -7.354 -1.885 1.00 71.24 C ATOM 584 CD1 PHE A 36 5.173 -8.309 -2.870 1.00 0.12 C ATOM 585 CD2 PHE A 36 5.736 -6.284 -1.662 1.00 51.11 C ATOM 586 CE1 PHE A 36 6.352 -8.191 -3.620 1.00 42.51 C ATOM 587 CE2 PHE A 36 6.903 -6.145 -2.433 1.00 62.10 C ATOM 588 CZ PHE A 36 7.204 -7.094 -3.423 1.00 63.13 C ATOM 0 H PHE A 36 2.364 -9.153 -2.370 1.00 44.51 H new ATOM 0 HA PHE A 36 4.062 -9.258 -0.094 1.00 61.11 H new ATOM 0 HB2 PHE A 36 2.730 -7.116 -1.755 1.00 12.41 H new ATOM 0 HB3 PHE A 36 3.592 -6.699 -0.287 1.00 12.41 H new ATOM 0 HD1 PHE A 36 4.508 -9.141 -3.049 1.00 0.12 H new ATOM 0 HD2 PHE A 36 5.519 -5.562 -0.889 1.00 51.11 H new ATOM 0 HE1 PHE A 36 6.604 -8.946 -4.350 1.00 42.51 H new ATOM 0 HE2 PHE A 36 7.567 -5.310 -2.264 1.00 62.10 H new ATOM 0 HZ PHE A 36 8.089 -6.980 -4.031 1.00 63.13 H new ATOM 598 N GLU A 37 0.922 -8.973 0.627 1.00 51.23 N ATOM 599 CA GLU A 37 -0.044 -8.683 1.688 1.00 14.23 C ATOM 600 C GLU A 37 -0.761 -9.955 2.175 1.00 2.34 C ATOM 601 O GLU A 37 -1.430 -9.907 3.204 1.00 32.31 O ATOM 602 CB GLU A 37 -1.038 -7.619 1.171 1.00 3.13 C ATOM 603 CG GLU A 37 -1.284 -6.459 2.151 1.00 74.31 C ATOM 604 CD GLU A 37 -0.049 -5.578 2.411 1.00 72.24 C ATOM 605 OE1 GLU A 37 0.878 -5.564 1.571 1.00 63.22 O ATOM 606 OE2 GLU A 37 -0.028 -4.853 3.435 1.00 31.11 O ATOM 0 H GLU A 37 0.520 -9.456 -0.177 1.00 51.23 H new ATOM 0 HA GLU A 37 0.482 -8.290 2.558 1.00 14.23 H new ATOM 0 HB2 GLU A 37 -0.663 -7.213 0.232 1.00 3.13 H new ATOM 0 HB3 GLU A 37 -1.990 -8.103 0.952 1.00 3.13 H new ATOM 0 HG2 GLU A 37 -2.087 -5.833 1.761 1.00 74.31 H new ATOM 0 HG3 GLU A 37 -1.631 -6.868 3.100 1.00 74.31 H new ATOM 613 N GLU A 38 -0.600 -11.084 1.468 1.00 11.51 N ATOM 614 CA GLU A 38 -1.342 -12.334 1.660 1.00 21.31 C ATOM 615 C GLU A 38 -0.446 -13.578 1.597 1.00 22.21 C ATOM 616 O GLU A 38 -0.890 -14.677 1.939 1.00 61.10 O ATOM 617 CB GLU A 38 -2.385 -12.484 0.543 1.00 63.34 C ATOM 618 CG GLU A 38 -3.563 -11.515 0.649 1.00 73.03 C ATOM 619 CD GLU A 38 -4.803 -12.271 1.139 1.00 74.01 C ATOM 620 OE1 GLU A 38 -5.448 -12.986 0.334 1.00 74.13 O ATOM 621 OE2 GLU A 38 -5.043 -12.258 2.365 1.00 3.52 O ATOM 0 H GLU A 38 0.083 -11.151 0.713 1.00 11.51 H new ATOM 0 HA GLU A 38 -1.794 -12.272 2.650 1.00 21.31 H new ATOM 0 HB2 GLU A 38 -1.894 -12.337 -0.419 1.00 63.34 H new ATOM 0 HB3 GLU A 38 -2.767 -13.505 0.553 1.00 63.34 H new ATOM 0 HG2 GLU A 38 -3.321 -10.706 1.338 1.00 73.03 H new ATOM 0 HG3 GLU A 38 -3.761 -11.059 -0.321 1.00 73.03 H new ATOM 628 N VAL A 39 0.810 -13.466 1.154 1.00 22.14 N ATOM 629 CA VAL A 39 1.716 -14.611 1.077 1.00 20.04 C ATOM 630 C VAL A 39 2.998 -14.239 1.815 1.00 75.34 C ATOM 631 O VAL A 39 3.135 -14.526 3.005 1.00 23.13 O ATOM 632 CB VAL A 39 1.895 -15.081 -0.385 1.00 42.20 C ATOM 633 CG1 VAL A 39 2.694 -16.384 -0.435 1.00 24.33 C ATOM 634 CG2 VAL A 39 0.543 -15.313 -1.082 1.00 62.04 C ATOM 0 H VAL A 39 1.222 -12.587 0.842 1.00 22.14 H new ATOM 0 HA VAL A 39 1.307 -15.490 1.575 1.00 20.04 H new ATOM 0 HB VAL A 39 2.431 -14.288 -0.907 1.00 42.20 H new ATOM 0 HG11 VAL A 39 2.810 -16.700 -1.472 1.00 24.33 H new ATOM 0 HG12 VAL A 39 3.677 -16.225 0.008 1.00 24.33 H new ATOM 0 HG13 VAL A 39 2.165 -17.157 0.123 1.00 24.33 H new ATOM 0 HG21 VAL A 39 0.714 -15.642 -2.107 1.00 62.04 H new ATOM 0 HG22 VAL A 39 -0.017 -16.078 -0.544 1.00 62.04 H new ATOM 0 HG23 VAL A 39 -0.027 -14.384 -1.090 1.00 62.04 H new ATOM 644 N LEU A 40 3.878 -13.515 1.128 1.00 13.44 N ATOM 645 CA LEU A 40 5.118 -12.953 1.635 1.00 63.00 C ATOM 646 C LEU A 40 4.874 -12.041 2.843 1.00 32.11 C ATOM 647 O LEU A 40 5.762 -11.906 3.682 1.00 74.21 O ATOM 648 CB LEU A 40 5.784 -12.137 0.510 1.00 32.02 C ATOM 649 CG LEU A 40 6.002 -12.862 -0.833 1.00 15.32 C ATOM 650 CD1 LEU A 40 6.562 -11.875 -1.864 1.00 71.21 C ATOM 651 CD2 LEU A 40 6.954 -14.043 -0.701 1.00 22.14 C ATOM 0 H LEU A 40 3.731 -13.294 0.143 1.00 13.44 H new ATOM 0 HA LEU A 40 5.762 -13.771 1.958 1.00 63.00 H new ATOM 0 HB2 LEU A 40 5.175 -11.252 0.325 1.00 32.02 H new ATOM 0 HB3 LEU A 40 6.752 -11.788 0.870 1.00 32.02 H new ATOM 0 HG LEU A 40 5.035 -13.247 -1.158 1.00 15.32 H new ATOM 0 HD11 LEU A 40 6.716 -12.388 -2.813 1.00 71.21 H new ATOM 0 HD12 LEU A 40 5.856 -11.056 -2.005 1.00 71.21 H new ATOM 0 HD13 LEU A 40 7.513 -11.478 -1.508 1.00 71.21 H new ATOM 0 HD21 LEU A 40 7.076 -14.522 -1.672 1.00 22.14 H new ATOM 0 HD22 LEU A 40 7.922 -13.692 -0.345 1.00 22.14 H new ATOM 0 HD23 LEU A 40 6.546 -14.762 0.009 1.00 22.14 H new ATOM 663 N HIS A 41 3.685 -11.417 2.926 1.00 52.12 N ATOM 664 CA HIS A 41 3.273 -10.487 3.982 1.00 22.11 C ATOM 665 C HIS A 41 4.394 -9.484 4.298 1.00 61.24 C ATOM 666 O HIS A 41 4.731 -9.258 5.464 1.00 54.51 O ATOM 667 CB HIS A 41 2.780 -11.253 5.221 1.00 0.33 C ATOM 668 CG HIS A 41 1.439 -11.921 5.071 1.00 24.13 C ATOM 669 ND1 HIS A 41 1.193 -13.225 4.695 1.00 31.42 N ATOM 670 CD2 HIS A 41 0.242 -11.355 5.406 1.00 20.13 C ATOM 671 CE1 HIS A 41 -0.127 -13.430 4.816 1.00 63.33 C ATOM 672 NE2 HIS A 41 -0.746 -12.329 5.261 1.00 13.13 N ATOM 0 H HIS A 41 2.956 -11.556 2.226 1.00 52.12 H new ATOM 0 HA HIS A 41 2.428 -9.899 3.625 1.00 22.11 H new ATOM 0 HB2 HIS A 41 3.519 -12.012 5.477 1.00 0.33 H new ATOM 0 HB3 HIS A 41 2.731 -10.560 6.061 1.00 0.33 H new ATOM 0 HD1 HIS A 41 1.885 -13.906 4.383 1.00 31.42 H new ATOM 0 HD2 HIS A 41 0.088 -10.335 5.726 1.00 20.13 H new ATOM 0 HE1 HIS A 41 -0.625 -14.360 4.585 1.00 63.33 H new ATOM 680 N VAL A 42 4.987 -8.910 3.248 1.00 61.41 N ATOM 681 CA VAL A 42 6.127 -8.006 3.282 1.00 22.42 C ATOM 682 C VAL A 42 5.839 -6.900 4.280 1.00 4.11 C ATOM 683 O VAL A 42 6.627 -6.718 5.198 1.00 12.53 O ATOM 684 CB VAL A 42 6.422 -7.452 1.870 1.00 31.04 C ATOM 685 CG1 VAL A 42 7.561 -6.421 1.851 1.00 21.15 C ATOM 686 CG2 VAL A 42 6.803 -8.591 0.922 1.00 2.25 C ATOM 0 H VAL A 42 4.660 -9.078 2.296 1.00 61.41 H new ATOM 0 HA VAL A 42 7.022 -8.540 3.602 1.00 22.42 H new ATOM 0 HB VAL A 42 5.506 -6.957 1.547 1.00 31.04 H new ATOM 0 HG11 VAL A 42 7.718 -6.071 0.831 1.00 21.15 H new ATOM 0 HG12 VAL A 42 7.298 -5.576 2.488 1.00 21.15 H new ATOM 0 HG13 VAL A 42 8.476 -6.883 2.221 1.00 21.15 H new ATOM 0 HG21 VAL A 42 7.008 -8.186 -0.069 1.00 2.25 H new ATOM 0 HG22 VAL A 42 7.692 -9.096 1.299 1.00 2.25 H new ATOM 0 HG23 VAL A 42 5.980 -9.303 0.860 1.00 2.25 H new ATOM 696 N SER A 43 4.704 -6.216 4.126 1.00 51.22 N ATOM 697 CA SER A 43 4.260 -5.078 4.920 1.00 62.14 C ATOM 698 C SER A 43 4.455 -5.328 6.427 1.00 43.40 C ATOM 699 O SER A 43 5.041 -4.499 7.133 1.00 20.31 O ATOM 700 CB SER A 43 2.811 -4.822 4.477 1.00 72.04 C ATOM 701 OG SER A 43 2.147 -3.770 5.133 1.00 51.32 O ATOM 0 H SER A 43 4.032 -6.460 3.398 1.00 51.22 H new ATOM 0 HA SER A 43 4.852 -4.179 4.752 1.00 62.14 H new ATOM 0 HB2 SER A 43 2.809 -4.616 3.407 1.00 72.04 H new ATOM 0 HB3 SER A 43 2.238 -5.737 4.626 1.00 72.04 H new ATOM 0 HG SER A 43 2.214 -2.954 4.594 1.00 51.32 H new ATOM 707 N ASP A 44 4.032 -6.487 6.935 1.00 55.51 N ATOM 708 CA ASP A 44 4.114 -6.790 8.368 1.00 11.33 C ATOM 709 C ASP A 44 5.452 -7.433 8.738 1.00 52.41 C ATOM 710 O ASP A 44 5.880 -7.379 9.891 1.00 32.05 O ATOM 711 CB ASP A 44 2.910 -7.645 8.794 1.00 63.13 C ATOM 712 CG ASP A 44 2.165 -6.967 9.945 1.00 74.42 C ATOM 713 OD1 ASP A 44 2.617 -7.097 11.104 1.00 55.42 O ATOM 714 OD2 ASP A 44 1.156 -6.264 9.687 1.00 34.35 O ATOM 0 H ASP A 44 3.627 -7.236 6.373 1.00 55.51 H new ATOM 0 HA ASP A 44 4.071 -5.854 8.925 1.00 11.33 H new ATOM 0 HB2 ASP A 44 2.237 -7.786 7.948 1.00 63.13 H new ATOM 0 HB3 ASP A 44 3.248 -8.635 9.102 1.00 63.13 H new ATOM 719 N ASN A 45 6.176 -7.972 7.757 1.00 3.21 N ATOM 720 CA ASN A 45 7.570 -8.369 7.927 1.00 54.52 C ATOM 721 C ASN A 45 8.428 -7.130 8.183 1.00 40.21 C ATOM 722 O ASN A 45 9.306 -7.159 9.044 1.00 54.31 O ATOM 723 CB ASN A 45 8.077 -9.122 6.687 1.00 24.31 C ATOM 724 CG ASN A 45 8.800 -10.401 7.076 1.00 35.35 C ATOM 725 OD1 ASN A 45 10.017 -10.435 7.224 1.00 51.41 O ATOM 726 ND2 ASN A 45 8.055 -11.485 7.223 1.00 44.30 N ATOM 0 H ASN A 45 5.810 -8.145 6.821 1.00 3.21 H new ATOM 0 HA ASN A 45 7.642 -9.040 8.783 1.00 54.52 H new ATOM 0 HB2 ASN A 45 7.237 -9.360 6.035 1.00 24.31 H new ATOM 0 HB3 ASN A 45 8.750 -8.480 6.118 1.00 24.31 H new ATOM 0 HD21 ASN A 45 8.491 -12.375 7.465 1.00 44.30 H new ATOM 0 HD22 ASN A 45 7.045 -11.431 7.095 1.00 44.30 H new ATOM 733 N VAL A 46 8.162 -6.028 7.463 1.00 24.43 N ATOM 734 CA VAL A 46 8.883 -4.776 7.648 1.00 54.24 C ATOM 735 C VAL A 46 8.703 -4.293 9.088 1.00 22.44 C ATOM 736 O VAL A 46 9.685 -3.942 9.733 1.00 60.03 O ATOM 737 CB VAL A 46 8.477 -3.667 6.645 1.00 62.30 C ATOM 738 CG1 VAL A 46 9.648 -2.698 6.507 1.00 32.05 C ATOM 739 CG2 VAL A 46 8.130 -4.101 5.216 1.00 11.13 C ATOM 0 H VAL A 46 7.442 -5.988 6.741 1.00 24.43 H new ATOM 0 HA VAL A 46 9.934 -4.983 7.447 1.00 54.24 H new ATOM 0 HB VAL A 46 7.563 -3.253 7.072 1.00 62.30 H new ATOM 0 HG11 VAL A 46 9.385 -1.907 5.805 1.00 32.05 H new ATOM 0 HG12 VAL A 46 9.874 -2.260 7.479 1.00 32.05 H new ATOM 0 HG13 VAL A 46 10.523 -3.234 6.139 1.00 32.05 H new ATOM 0 HG21 VAL A 46 7.865 -3.225 4.624 1.00 11.13 H new ATOM 0 HG22 VAL A 46 8.991 -4.596 4.767 1.00 11.13 H new ATOM 0 HG23 VAL A 46 7.287 -4.791 5.240 1.00 11.13 H new ATOM 749 N ARG A 47 7.474 -4.305 9.620 1.00 61.12 N ATOM 750 CA ARG A 47 7.161 -3.864 10.982 1.00 71.02 C ATOM 751 C ARG A 47 8.117 -4.464 12.013 1.00 1.12 C ATOM 752 O ARG A 47 8.636 -3.732 12.857 1.00 54.21 O ATOM 753 CB ARG A 47 5.681 -4.162 11.280 1.00 61.44 C ATOM 754 CG ARG A 47 5.302 -3.868 12.739 1.00 1.14 C ATOM 755 CD ARG A 47 3.787 -3.939 12.976 1.00 0.51 C ATOM 756 NE ARG A 47 3.456 -3.823 14.410 1.00 3.22 N ATOM 757 CZ ARG A 47 2.240 -3.900 14.970 1.00 63.24 C ATOM 758 NH1 ARG A 47 1.149 -4.063 14.237 1.00 12.25 N ATOM 759 NH2 ARG A 47 2.123 -3.803 16.289 1.00 24.44 N ATOM 0 H ARG A 47 6.655 -4.628 9.105 1.00 61.12 H new ATOM 0 HA ARG A 47 7.310 -2.787 11.056 1.00 71.02 H new ATOM 0 HB2 ARG A 47 5.054 -3.565 10.618 1.00 61.44 H new ATOM 0 HB3 ARG A 47 5.473 -5.209 11.058 1.00 61.44 H new ATOM 0 HG2 ARG A 47 5.803 -4.582 13.393 1.00 1.14 H new ATOM 0 HG3 ARG A 47 5.664 -2.877 13.013 1.00 1.14 H new ATOM 0 HD2 ARG A 47 3.294 -3.140 12.422 1.00 0.51 H new ATOM 0 HD3 ARG A 47 3.401 -4.882 12.588 1.00 0.51 H new ATOM 0 HE ARG A 47 4.239 -3.667 15.045 1.00 3.22 H new ATOM 0 HH11 ARG A 47 1.222 -4.133 13.222 1.00 12.25 H new ATOM 0 HH12 ARG A 47 0.236 -4.119 14.687 1.00 12.25 H new ATOM 0 HH21 ARG A 47 2.953 -3.671 16.866 1.00 24.44 H new ATOM 0 HH22 ARG A 47 1.203 -3.860 16.725 1.00 24.44 H new ATOM 773 N GLN A 48 8.407 -5.761 11.912 1.00 1.53 N ATOM 774 CA GLN A 48 9.336 -6.437 12.818 1.00 42.52 C ATOM 775 C GLN A 48 10.786 -5.915 12.773 1.00 20.32 C ATOM 776 O GLN A 48 11.578 -6.301 13.636 1.00 23.02 O ATOM 777 CB GLN A 48 9.314 -7.945 12.570 1.00 53.14 C ATOM 778 CG GLN A 48 7.970 -8.595 12.937 1.00 64.34 C ATOM 779 CD GLN A 48 8.152 -10.055 13.349 1.00 21.12 C ATOM 780 OE1 GLN A 48 8.991 -10.762 12.794 1.00 52.23 O ATOM 781 NE2 GLN A 48 7.383 -10.534 14.314 1.00 72.21 N ATOM 0 H GLN A 48 8.005 -6.372 11.201 1.00 1.53 H new ATOM 0 HA GLN A 48 8.976 -6.207 13.821 1.00 42.52 H new ATOM 0 HB2 GLN A 48 9.530 -8.138 11.519 1.00 53.14 H new ATOM 0 HB3 GLN A 48 10.109 -8.415 13.150 1.00 53.14 H new ATOM 0 HG2 GLN A 48 7.506 -8.040 13.753 1.00 64.34 H new ATOM 0 HG3 GLN A 48 7.292 -8.537 12.086 1.00 64.34 H new ATOM 0 HE21 GLN A 48 6.693 -9.932 14.762 1.00 72.21 H new ATOM 0 HE22 GLN A 48 7.481 -11.505 14.609 1.00 72.21 H new ATOM 790 N LYS A 49 11.151 -5.071 11.803 1.00 21.01 N ATOM 791 CA LYS A 49 12.500 -4.558 11.543 1.00 14.41 C ATOM 792 C LYS A 49 12.566 -3.027 11.500 1.00 31.01 C ATOM 793 O LYS A 49 13.657 -2.474 11.371 1.00 63.30 O ATOM 794 CB LYS A 49 12.978 -5.099 10.182 1.00 40.50 C ATOM 795 CG LYS A 49 13.158 -6.621 10.155 1.00 72.22 C ATOM 796 CD LYS A 49 14.283 -7.101 11.079 1.00 34.11 C ATOM 797 CE LYS A 49 15.662 -6.725 10.518 1.00 73.34 C ATOM 798 NZ LYS A 49 16.757 -7.070 11.442 1.00 21.55 N ATOM 0 H LYS A 49 10.470 -4.705 11.137 1.00 21.01 H new ATOM 0 HA LYS A 49 13.134 -4.891 12.365 1.00 14.41 H new ATOM 0 HB2 LYS A 49 12.259 -4.813 9.414 1.00 40.50 H new ATOM 0 HB3 LYS A 49 13.925 -4.625 9.924 1.00 40.50 H new ATOM 0 HG2 LYS A 49 12.223 -7.098 10.449 1.00 72.22 H new ATOM 0 HG3 LYS A 49 13.371 -6.939 9.135 1.00 72.22 H new ATOM 0 HD2 LYS A 49 14.158 -6.660 12.068 1.00 34.11 H new ATOM 0 HD3 LYS A 49 14.220 -8.182 11.201 1.00 34.11 H new ATOM 0 HE2 LYS A 49 15.817 -7.237 9.568 1.00 73.34 H new ATOM 0 HE3 LYS A 49 15.688 -5.655 10.311 1.00 73.34 H new ATOM 0 HZ1 LYS A 49 17.667 -6.797 11.019 1.00 21.55 H new ATOM 0 HZ2 LYS A 49 16.626 -6.562 12.340 1.00 21.55 H new ATOM 0 HZ3 LYS A 49 16.751 -8.095 11.620 1.00 21.55 H new ATOM 812 N LEU A 50 11.430 -2.322 11.510 1.00 63.01 N ATOM 813 CA LEU A 50 11.424 -0.894 11.204 1.00 4.34 C ATOM 814 C LEU A 50 12.036 -0.082 12.342 1.00 3.44 C ATOM 815 O LEU A 50 11.888 -0.452 13.510 1.00 15.33 O ATOM 816 CB LEU A 50 10.001 -0.386 10.909 1.00 1.35 C ATOM 817 CG LEU A 50 9.630 -0.597 9.433 1.00 55.42 C ATOM 818 CD1 LEU A 50 8.127 -0.492 9.155 1.00 22.33 C ATOM 819 CD2 LEU A 50 10.388 0.306 8.453 1.00 54.53 C ATOM 0 H LEU A 50 10.513 -2.715 11.725 1.00 63.01 H new ATOM 0 HA LEU A 50 12.032 -0.758 10.310 1.00 4.34 H new ATOM 0 HB2 LEU A 50 9.286 -0.909 11.545 1.00 1.35 H new ATOM 0 HB3 LEU A 50 9.932 0.673 11.156 1.00 1.35 H new ATOM 0 HG LEU A 50 9.947 -1.624 9.252 1.00 55.42 H new ATOM 0 HD11 LEU A 50 7.941 -0.652 8.093 1.00 22.33 H new ATOM 0 HD12 LEU A 50 7.596 -1.248 9.734 1.00 22.33 H new ATOM 0 HD13 LEU A 50 7.773 0.499 9.440 1.00 22.33 H new ATOM 0 HD21 LEU A 50 10.064 0.090 7.435 1.00 54.53 H new ATOM 0 HD22 LEU A 50 10.181 1.350 8.686 1.00 54.53 H new ATOM 0 HD23 LEU A 50 11.458 0.120 8.541 1.00 54.53 H new ATOM 831 N PRO A 51 12.652 1.071 12.041 1.00 41.10 N ATOM 832 CA PRO A 51 13.066 2.013 13.061 1.00 72.33 C ATOM 833 C PRO A 51 11.833 2.697 13.651 1.00 71.00 C ATOM 834 O PRO A 51 10.791 2.816 12.999 1.00 11.53 O ATOM 835 CB PRO A 51 13.994 2.991 12.344 1.00 44.33 C ATOM 836 CG PRO A 51 13.463 3.013 10.916 1.00 55.44 C ATOM 837 CD PRO A 51 12.853 1.629 10.715 1.00 3.45 C ATOM 0 HA PRO A 51 13.582 1.547 13.900 1.00 72.33 H new ATOM 0 HB2 PRO A 51 13.961 3.981 12.799 1.00 44.33 H new ATOM 0 HB3 PRO A 51 15.031 2.658 12.380 1.00 44.33 H new ATOM 0 HG2 PRO A 51 12.719 3.798 10.781 1.00 55.44 H new ATOM 0 HG3 PRO A 51 14.261 3.203 10.198 1.00 55.44 H new ATOM 0 HD2 PRO A 51 11.909 1.696 10.175 1.00 3.45 H new ATOM 0 HD3 PRO A 51 13.514 0.996 10.124 1.00 3.45 H new ATOM 845 N GLU A 52 11.970 3.202 14.874 1.00 20.25 N ATOM 846 CA GLU A 52 10.907 3.802 15.681 1.00 34.03 C ATOM 847 C GLU A 52 10.452 5.187 15.222 1.00 73.20 C ATOM 848 O GLU A 52 9.998 6.017 16.008 1.00 34.23 O ATOM 849 CB GLU A 52 11.325 3.776 17.155 1.00 15.34 C ATOM 850 CG GLU A 52 12.571 4.620 17.486 1.00 63.30 C ATOM 851 CD GLU A 52 12.255 5.803 18.395 1.00 14.45 C ATOM 852 OE1 GLU A 52 11.945 5.604 19.588 1.00 3.45 O ATOM 853 OE2 GLU A 52 12.291 6.951 17.898 1.00 3.24 O ATOM 0 H GLU A 52 12.870 3.205 15.355 1.00 20.25 H new ATOM 0 HA GLU A 52 10.014 3.192 15.541 1.00 34.03 H new ATOM 0 HB2 GLU A 52 10.491 4.130 17.761 1.00 15.34 H new ATOM 0 HB3 GLU A 52 11.515 2.743 17.447 1.00 15.34 H new ATOM 0 HG2 GLU A 52 13.317 3.987 17.966 1.00 63.30 H new ATOM 0 HG3 GLU A 52 13.013 4.987 16.560 1.00 63.30 H new ATOM 860 N GLY A 53 10.576 5.451 13.935 1.00 21.05 N ATOM 861 CA GLY A 53 10.435 6.761 13.348 1.00 12.25 C ATOM 862 C GLY A 53 10.010 6.715 11.889 1.00 4.13 C ATOM 863 O GLY A 53 10.281 7.659 11.154 1.00 12.35 O ATOM 0 H GLY A 53 10.786 4.728 13.247 1.00 21.05 H new ATOM 0 HA2 GLY A 53 9.700 7.331 13.917 1.00 12.25 H new ATOM 0 HA3 GLY A 53 11.383 7.293 13.428 1.00 12.25 H new ATOM 867 N THR A 54 9.416 5.608 11.448 1.00 35.13 N ATOM 868 CA THR A 54 9.007 5.432 10.064 1.00 42.20 C ATOM 869 C THR A 54 7.575 5.937 9.848 1.00 23.02 C ATOM 870 O THR A 54 7.347 6.670 8.899 1.00 41.40 O ATOM 871 CB THR A 54 9.247 3.963 9.676 1.00 0.32 C ATOM 872 OG1 THR A 54 9.336 3.802 8.280 1.00 51.42 O ATOM 873 CG2 THR A 54 8.228 3.023 10.303 1.00 3.54 C ATOM 0 H THR A 54 9.206 4.808 12.045 1.00 35.13 H new ATOM 0 HA THR A 54 9.607 6.042 9.389 1.00 42.20 H new ATOM 0 HB THR A 54 10.214 3.680 10.091 1.00 0.32 H new ATOM 0 HG1 THR A 54 8.873 2.980 8.015 1.00 51.42 H new ATOM 0 HG21 THR A 54 8.442 1.999 9.998 1.00 3.54 H new ATOM 0 HG22 THR A 54 8.284 3.097 11.389 1.00 3.54 H new ATOM 0 HG23 THR A 54 7.227 3.299 9.972 1.00 3.54 H new ATOM 881 N LYS A 55 6.621 5.607 10.734 1.00 61.14 N ATOM 882 CA LYS A 55 5.182 5.695 10.498 1.00 52.50 C ATOM 883 C LYS A 55 4.787 4.897 9.245 1.00 62.40 C ATOM 884 O LYS A 55 4.807 5.351 8.103 1.00 54.11 O ATOM 885 CB LYS A 55 4.739 7.152 10.466 1.00 74.14 C ATOM 886 CG LYS A 55 3.240 7.416 10.706 1.00 1.45 C ATOM 887 CD LYS A 55 2.348 7.012 9.525 1.00 51.51 C ATOM 888 CE LYS A 55 0.847 7.284 9.684 1.00 20.21 C ATOM 889 NZ LYS A 55 0.282 6.642 10.888 1.00 4.31 N ATOM 0 H LYS A 55 6.845 5.260 11.666 1.00 61.14 H new ATOM 0 HA LYS A 55 4.645 5.232 11.326 1.00 52.50 H new ATOM 0 HB2 LYS A 55 5.307 7.699 11.218 1.00 74.14 H new ATOM 0 HB3 LYS A 55 5.009 7.570 9.496 1.00 74.14 H new ATOM 0 HG2 LYS A 55 2.921 6.871 11.594 1.00 1.45 H new ATOM 0 HG3 LYS A 55 3.095 8.476 10.914 1.00 1.45 H new ATOM 0 HD2 LYS A 55 2.699 7.536 8.636 1.00 51.51 H new ATOM 0 HD3 LYS A 55 2.485 5.946 9.341 1.00 51.51 H new ATOM 0 HE2 LYS A 55 0.679 8.360 9.737 1.00 20.21 H new ATOM 0 HE3 LYS A 55 0.320 6.922 8.801 1.00 20.21 H new ATOM 0 HZ1 LYS A 55 -0.734 6.855 10.951 1.00 4.31 H new ATOM 0 HZ2 LYS A 55 0.417 5.612 10.828 1.00 4.31 H new ATOM 0 HZ3 LYS A 55 0.765 7.006 11.734 1.00 4.31 H new ATOM 903 N MET A 56 4.367 3.671 9.503 1.00 1.13 N ATOM 904 CA MET A 56 3.726 2.797 8.524 1.00 41.34 C ATOM 905 C MET A 56 2.424 3.446 8.065 1.00 34.12 C ATOM 906 O MET A 56 1.545 3.728 8.886 1.00 44.33 O ATOM 907 CB MET A 56 3.435 1.404 9.106 1.00 32.02 C ATOM 908 CG MET A 56 4.497 0.375 8.813 1.00 11.33 C ATOM 909 SD MET A 56 4.907 -0.778 10.149 1.00 2.14 S ATOM 910 CE MET A 56 5.582 0.365 11.370 1.00 13.12 C ATOM 0 H MET A 56 4.463 3.240 10.423 1.00 1.13 H new ATOM 0 HA MET A 56 4.406 2.664 7.682 1.00 41.34 H new ATOM 0 HB2 MET A 56 3.319 1.491 10.186 1.00 32.02 H new ATOM 0 HB3 MET A 56 2.483 1.049 8.711 1.00 32.02 H new ATOM 0 HG2 MET A 56 4.177 -0.207 7.948 1.00 11.33 H new ATOM 0 HG3 MET A 56 5.408 0.899 8.525 1.00 11.33 H new ATOM 0 HE1 MET A 56 6.318 -0.153 11.985 1.00 13.12 H new ATOM 0 HE2 MET A 56 6.059 1.202 10.860 1.00 13.12 H new ATOM 0 HE3 MET A 56 4.777 0.737 12.004 1.00 13.12 H new ATOM 920 N THR A 57 2.292 3.664 6.761 1.00 60.32 N ATOM 921 CA THR A 57 1.071 4.174 6.138 1.00 74.02 C ATOM 922 C THR A 57 0.621 3.171 5.066 1.00 20.02 C ATOM 923 O THR A 57 1.253 2.134 4.905 1.00 31.25 O ATOM 924 CB THR A 57 1.292 5.612 5.629 1.00 73.04 C ATOM 925 OG1 THR A 57 2.170 6.348 6.461 1.00 12.24 O ATOM 926 CG2 THR A 57 -0.016 6.419 5.592 1.00 32.11 C ATOM 0 H THR A 57 3.043 3.489 6.093 1.00 60.32 H new ATOM 0 HA THR A 57 0.255 4.256 6.856 1.00 74.02 H new ATOM 0 HB THR A 57 1.710 5.487 4.630 1.00 73.04 H new ATOM 0 HG1 THR A 57 2.893 6.727 5.919 1.00 12.24 H new ATOM 0 HG21 THR A 57 0.188 7.426 5.227 1.00 32.11 H new ATOM 0 HG22 THR A 57 -0.727 5.929 4.927 1.00 32.11 H new ATOM 0 HG23 THR A 57 -0.437 6.475 6.596 1.00 32.11 H new ATOM 934 N LYS A 58 -0.486 3.431 4.362 1.00 33.03 N ATOM 935 CA LYS A 58 -1.130 2.494 3.441 1.00 32.45 C ATOM 936 C LYS A 58 -2.231 3.268 2.724 1.00 63.22 C ATOM 937 O LYS A 58 -3.357 3.368 3.215 1.00 33.15 O ATOM 938 CB LYS A 58 -1.654 1.255 4.218 1.00 55.52 C ATOM 939 CG LYS A 58 -0.831 -0.025 3.969 1.00 72.41 C ATOM 940 CD LYS A 58 -0.588 -0.866 5.235 1.00 13.14 C ATOM 941 CE LYS A 58 -1.890 -1.420 5.835 1.00 55.54 C ATOM 942 NZ LYS A 58 -1.664 -2.160 7.095 1.00 23.32 N ATOM 0 H LYS A 58 -0.971 4.326 4.421 1.00 33.03 H new ATOM 0 HA LYS A 58 -0.434 2.100 2.700 1.00 32.45 H new ATOM 0 HB2 LYS A 58 -1.650 1.478 5.285 1.00 55.52 H new ATOM 0 HB3 LYS A 58 -2.690 1.071 3.935 1.00 55.52 H new ATOM 0 HG2 LYS A 58 -1.347 -0.639 3.230 1.00 72.41 H new ATOM 0 HG3 LYS A 58 0.131 0.252 3.538 1.00 72.41 H new ATOM 0 HD2 LYS A 58 0.078 -1.694 4.994 1.00 13.14 H new ATOM 0 HD3 LYS A 58 -0.080 -0.255 5.981 1.00 13.14 H new ATOM 0 HE2 LYS A 58 -2.580 -0.597 6.020 1.00 55.54 H new ATOM 0 HE3 LYS A 58 -2.368 -2.080 5.111 1.00 55.54 H new ATOM 0 HZ1 LYS A 58 -2.489 -2.046 7.717 1.00 23.32 H new ATOM 0 HZ2 LYS A 58 -1.526 -3.169 6.885 1.00 23.32 H new ATOM 0 HZ3 LYS A 58 -0.818 -1.786 7.570 1.00 23.32 H new ATOM 956 N TYR A 59 -1.885 3.911 1.613 1.00 34.41 N ATOM 957 CA TYR A 59 -2.806 4.634 0.744 1.00 31.35 C ATOM 958 C TYR A 59 -3.370 3.669 -0.315 1.00 15.41 C ATOM 959 O TYR A 59 -3.018 2.485 -0.351 1.00 33.05 O ATOM 960 CB TYR A 59 -2.079 5.868 0.155 1.00 0.32 C ATOM 961 CG TYR A 59 -2.109 7.165 0.973 1.00 41.51 C ATOM 962 CD1 TYR A 59 -2.475 7.186 2.336 1.00 34.22 C ATOM 963 CD2 TYR A 59 -1.865 8.394 0.317 1.00 60.12 C ATOM 964 CE1 TYR A 59 -2.634 8.408 3.014 1.00 24.03 C ATOM 965 CE2 TYR A 59 -2.036 9.627 0.978 1.00 74.12 C ATOM 966 CZ TYR A 59 -2.406 9.634 2.340 1.00 13.32 C ATOM 967 OH TYR A 59 -2.537 10.831 2.979 1.00 23.02 O ATOM 0 H TYR A 59 -0.921 3.944 1.282 1.00 34.41 H new ATOM 0 HA TYR A 59 -3.665 5.015 1.296 1.00 31.35 H new ATOM 0 HB2 TYR A 59 -1.036 5.597 -0.008 1.00 0.32 H new ATOM 0 HB3 TYR A 59 -2.511 6.077 -0.824 1.00 0.32 H new ATOM 0 HD1 TYR A 59 -2.634 6.257 2.862 1.00 34.22 H new ATOM 0 HD2 TYR A 59 -1.541 8.388 -0.713 1.00 60.12 H new ATOM 0 HE1 TYR A 59 -2.931 8.412 4.052 1.00 24.03 H new ATOM 0 HE2 TYR A 59 -1.886 10.556 0.448 1.00 74.12 H new ATOM 0 HH TYR A 59 -2.339 11.559 2.354 1.00 23.02 H new ATOM 977 N HIS A 60 -4.298 4.144 -1.151 1.00 63.22 N ATOM 978 CA HIS A 60 -4.865 3.413 -2.281 1.00 20.31 C ATOM 979 C HIS A 60 -4.524 4.126 -3.593 1.00 53.23 C ATOM 980 O HIS A 60 -4.009 5.244 -3.565 1.00 52.52 O ATOM 981 CB HIS A 60 -6.380 3.325 -2.065 1.00 75.12 C ATOM 982 CG HIS A 60 -7.060 4.661 -1.906 1.00 32.02 C ATOM 983 ND1 HIS A 60 -7.884 4.941 -0.868 1.00 14.22 N ATOM 984 CD2 HIS A 60 -7.029 5.780 -2.694 1.00 61.41 C ATOM 985 CE1 HIS A 60 -8.383 6.166 -1.000 1.00 0.41 C ATOM 986 NE2 HIS A 60 -7.871 6.735 -2.094 1.00 35.00 N ATOM 0 H HIS A 60 -4.687 5.082 -1.053 1.00 63.22 H new ATOM 0 HA HIS A 60 -4.448 2.408 -2.345 1.00 20.31 H new ATOM 0 HB2 HIS A 60 -6.826 2.801 -2.910 1.00 75.12 H new ATOM 0 HB3 HIS A 60 -6.575 2.723 -1.178 1.00 75.12 H new ATOM 0 HD1 HIS A 60 -8.091 4.305 -0.098 1.00 14.22 H new ATOM 0 HD2 HIS A 60 -6.464 5.906 -3.606 1.00 61.41 H new ATOM 0 HE1 HIS A 60 -9.091 6.628 -0.328 1.00 0.41 H new ATOM 994 N VAL A 61 -4.894 3.527 -4.727 1.00 63.32 N ATOM 995 CA VAL A 61 -4.850 4.137 -6.060 1.00 22.33 C ATOM 996 C VAL A 61 -6.198 3.909 -6.760 1.00 74.23 C ATOM 997 O VAL A 61 -7.052 3.195 -6.222 1.00 2.22 O ATOM 998 CB VAL A 61 -3.654 3.591 -6.874 1.00 52.13 C ATOM 999 CG1 VAL A 61 -2.332 3.704 -6.102 1.00 2.52 C ATOM 1000 CG2 VAL A 61 -3.831 2.127 -7.314 1.00 32.24 C ATOM 0 H VAL A 61 -5.245 2.570 -4.744 1.00 63.32 H new ATOM 0 HA VAL A 61 -4.693 5.212 -5.974 1.00 22.33 H new ATOM 0 HB VAL A 61 -3.621 4.219 -7.764 1.00 52.13 H new ATOM 0 HG11 VAL A 61 -1.520 3.309 -6.712 1.00 2.52 H new ATOM 0 HG12 VAL A 61 -2.135 4.750 -5.869 1.00 2.52 H new ATOM 0 HG13 VAL A 61 -2.401 3.133 -5.176 1.00 2.52 H new ATOM 0 HG21 VAL A 61 -2.956 1.809 -7.880 1.00 32.24 H new ATOM 0 HG22 VAL A 61 -3.944 1.494 -6.434 1.00 32.24 H new ATOM 0 HG23 VAL A 61 -4.719 2.040 -7.940 1.00 32.24 H new ATOM 1010 N GLU A 62 -6.385 4.463 -7.958 1.00 44.25 N ATOM 1011 CA GLU A 62 -7.583 4.402 -8.794 1.00 43.44 C ATOM 1012 C GLU A 62 -7.227 4.047 -10.249 1.00 1.50 C ATOM 1013 O GLU A 62 -7.532 4.788 -11.183 1.00 53.25 O ATOM 1014 CB GLU A 62 -8.414 5.698 -8.672 1.00 72.14 C ATOM 1015 CG GLU A 62 -7.670 7.026 -8.469 1.00 2.11 C ATOM 1016 CD GLU A 62 -6.489 7.286 -9.421 1.00 45.21 C ATOM 1017 OE1 GLU A 62 -5.413 6.671 -9.245 1.00 70.04 O ATOM 1018 OE2 GLU A 62 -6.585 8.196 -10.278 1.00 30.40 O ATOM 0 H GLU A 62 -5.646 5.008 -8.403 1.00 44.25 H new ATOM 0 HA GLU A 62 -8.219 3.595 -8.429 1.00 43.44 H new ATOM 0 HB2 GLU A 62 -9.019 5.791 -9.574 1.00 72.14 H new ATOM 0 HB3 GLU A 62 -9.104 5.573 -7.837 1.00 72.14 H new ATOM 0 HG2 GLU A 62 -8.385 7.841 -8.577 1.00 2.11 H new ATOM 0 HG3 GLU A 62 -7.300 7.060 -7.444 1.00 2.11 H new ATOM 1025 N PHE A 63 -6.609 2.882 -10.451 1.00 2.50 N ATOM 1026 CA PHE A 63 -6.273 2.323 -11.755 1.00 41.52 C ATOM 1027 C PHE A 63 -6.327 0.795 -11.694 1.00 75.13 C ATOM 1028 O PHE A 63 -6.962 0.222 -10.801 1.00 42.32 O ATOM 1029 CB PHE A 63 -4.954 2.897 -12.313 1.00 54.51 C ATOM 1030 CG PHE A 63 -3.675 2.600 -11.550 1.00 12.23 C ATOM 1031 CD1 PHE A 63 -2.872 1.482 -11.861 1.00 14.55 C ATOM 1032 CD2 PHE A 63 -3.238 3.509 -10.572 1.00 42.34 C ATOM 1033 CE1 PHE A 63 -1.666 1.271 -11.176 1.00 23.01 C ATOM 1034 CE2 PHE A 63 -2.009 3.317 -9.917 1.00 35.14 C ATOM 1035 CZ PHE A 63 -1.229 2.188 -10.208 1.00 23.44 C ATOM 0 H PHE A 63 -6.319 2.282 -9.679 1.00 2.50 H new ATOM 0 HA PHE A 63 -7.023 2.632 -12.483 1.00 41.52 H new ATOM 0 HB2 PHE A 63 -4.831 2.526 -13.331 1.00 54.51 H new ATOM 0 HB3 PHE A 63 -5.061 3.980 -12.379 1.00 54.51 H new ATOM 0 HD1 PHE A 63 -3.186 0.788 -12.627 1.00 14.55 H new ATOM 0 HD2 PHE A 63 -3.851 4.362 -10.321 1.00 42.34 H new ATOM 0 HE1 PHE A 63 -1.070 0.397 -11.395 1.00 23.01 H new ATOM 0 HE2 PHE A 63 -1.666 4.038 -9.190 1.00 35.14 H new ATOM 0 HZ PHE A 63 -0.296 2.025 -9.689 1.00 23.44 H new ATOM 1045 N LEU A 64 -5.736 0.121 -12.679 1.00 41.33 N ATOM 1046 CA LEU A 64 -5.693 -1.328 -12.899 1.00 61.33 C ATOM 1047 C LEU A 64 -7.038 -1.792 -13.431 1.00 33.31 C ATOM 1048 O LEU A 64 -7.226 -1.914 -14.638 1.00 50.33 O ATOM 1049 CB LEU A 64 -5.265 -2.131 -11.647 1.00 23.10 C ATOM 1050 CG LEU A 64 -3.785 -1.976 -11.294 1.00 54.52 C ATOM 1051 CD1 LEU A 64 -3.524 -2.076 -9.802 1.00 44.22 C ATOM 1052 CD2 LEU A 64 -2.989 -3.031 -12.020 1.00 2.14 C ATOM 0 H LEU A 64 -5.228 0.618 -13.411 1.00 41.33 H new ATOM 0 HA LEU A 64 -4.918 -1.527 -13.639 1.00 61.33 H new ATOM 0 HB2 LEU A 64 -5.868 -1.811 -10.797 1.00 23.10 H new ATOM 0 HB3 LEU A 64 -5.482 -3.187 -11.812 1.00 23.10 H new ATOM 0 HG LEU A 64 -3.477 -0.978 -11.606 1.00 54.52 H new ATOM 0 HD11 LEU A 64 -2.457 -1.959 -9.611 1.00 44.22 H new ATOM 0 HD12 LEU A 64 -4.074 -1.291 -9.283 1.00 44.22 H new ATOM 0 HD13 LEU A 64 -3.853 -3.050 -9.440 1.00 44.22 H new ATOM 0 HD21 LEU A 64 -1.933 -2.925 -11.772 1.00 2.14 H new ATOM 0 HD22 LEU A 64 -3.335 -4.020 -11.719 1.00 2.14 H new ATOM 0 HD23 LEU A 64 -3.123 -2.912 -13.095 1.00 2.14 H new ATOM 1064 N GLY A 65 -7.961 -2.051 -12.520 1.00 44.23 N ATOM 1065 CA GLY A 65 -9.295 -2.527 -12.793 1.00 74.05 C ATOM 1066 C GLY A 65 -10.297 -1.376 -12.855 1.00 42.33 C ATOM 1067 O GLY A 65 -9.964 -0.210 -12.625 1.00 61.42 O ATOM 0 H GLY A 65 -7.786 -1.927 -11.523 1.00 44.23 H new ATOM 0 HA2 GLY A 65 -9.303 -3.069 -13.739 1.00 74.05 H new ATOM 0 HA3 GLY A 65 -9.597 -3.232 -12.019 1.00 74.05 H new ATOM 1071 N PRO A 66 -11.539 -1.702 -13.216 1.00 55.55 N ATOM 1072 CA PRO A 66 -12.588 -0.750 -13.544 1.00 34.43 C ATOM 1073 C PRO A 66 -13.021 0.099 -12.352 1.00 41.34 C ATOM 1074 O PRO A 66 -13.305 1.281 -12.531 1.00 43.25 O ATOM 1075 CB PRO A 66 -13.747 -1.601 -14.075 1.00 41.32 C ATOM 1076 CG PRO A 66 -13.483 -2.993 -13.503 1.00 24.32 C ATOM 1077 CD PRO A 66 -11.960 -3.051 -13.499 1.00 63.33 C ATOM 0 HA PRO A 66 -12.235 -0.025 -14.277 1.00 34.43 H new ATOM 0 HB2 PRO A 66 -14.710 -1.211 -13.746 1.00 41.32 H new ATOM 0 HB3 PRO A 66 -13.764 -1.615 -15.165 1.00 41.32 H new ATOM 0 HG2 PRO A 66 -13.898 -3.108 -12.502 1.00 24.32 H new ATOM 0 HG3 PRO A 66 -13.919 -3.778 -14.121 1.00 24.32 H new ATOM 0 HD2 PRO A 66 -11.593 -3.746 -12.744 1.00 63.33 H new ATOM 0 HD3 PRO A 66 -11.575 -3.392 -14.460 1.00 63.33 H new ATOM 1085 N LEU A 67 -13.059 -0.479 -11.150 1.00 24.10 N ATOM 1086 CA LEU A 67 -13.554 0.171 -9.938 1.00 61.34 C ATOM 1087 C LEU A 67 -12.496 1.039 -9.260 1.00 21.32 C ATOM 1088 O LEU A 67 -12.574 1.245 -8.049 1.00 43.13 O ATOM 1089 CB LEU A 67 -14.097 -0.895 -8.973 1.00 35.44 C ATOM 1090 CG LEU A 67 -15.378 -1.579 -9.469 1.00 21.02 C ATOM 1091 CD1 LEU A 67 -15.766 -2.635 -8.436 1.00 72.13 C ATOM 1092 CD2 LEU A 67 -16.531 -0.577 -9.631 1.00 71.05 C ATOM 0 H LEU A 67 -12.739 -1.434 -10.990 1.00 24.10 H new ATOM 0 HA LEU A 67 -14.359 0.847 -10.226 1.00 61.34 H new ATOM 0 HB2 LEU A 67 -13.330 -1.652 -8.813 1.00 35.44 H new ATOM 0 HB3 LEU A 67 -14.294 -0.431 -8.006 1.00 35.44 H new ATOM 0 HG LEU A 67 -15.192 -2.024 -10.447 1.00 21.02 H new ATOM 0 HD11 LEU A 67 -16.675 -3.142 -8.758 1.00 72.13 H new ATOM 0 HD12 LEU A 67 -14.960 -3.362 -8.339 1.00 72.13 H new ATOM 0 HD13 LEU A 67 -15.940 -2.155 -7.473 1.00 72.13 H new ATOM 0 HD21 LEU A 67 -17.420 -1.099 -9.984 1.00 71.05 H new ATOM 0 HD22 LEU A 67 -16.743 -0.108 -8.670 1.00 71.05 H new ATOM 0 HD23 LEU A 67 -16.249 0.188 -10.354 1.00 71.05 H new ATOM 1104 N GLY A 68 -11.500 1.530 -9.999 1.00 33.34 N ATOM 1105 CA GLY A 68 -10.449 2.383 -9.462 1.00 31.11 C ATOM 1106 C GLY A 68 -11.016 3.493 -8.573 1.00 0.33 C ATOM 1107 O GLY A 68 -10.601 3.640 -7.421 1.00 24.31 O ATOM 0 H GLY A 68 -11.403 1.342 -10.997 1.00 33.34 H new ATOM 0 HA2 GLY A 68 -9.749 1.778 -8.886 1.00 31.11 H new ATOM 0 HA3 GLY A 68 -9.886 2.827 -10.283 1.00 31.11 H new ATOM 1111 N LYS A 69 -11.999 4.245 -9.078 1.00 51.45 N ATOM 1112 CA LYS A 69 -12.611 5.382 -8.388 1.00 44.25 C ATOM 1113 C LYS A 69 -13.490 4.976 -7.191 1.00 43.13 C ATOM 1114 O LYS A 69 -13.982 5.859 -6.476 1.00 64.11 O ATOM 1115 CB LYS A 69 -13.446 6.190 -9.398 1.00 5.23 C ATOM 1116 CG LYS A 69 -12.954 7.617 -9.619 1.00 2.14 C ATOM 1117 CD LYS A 69 -12.762 8.441 -8.345 1.00 61.22 C ATOM 1118 CE LYS A 69 -12.664 9.896 -8.780 1.00 43.21 C ATOM 1119 NZ LYS A 69 -12.267 10.762 -7.666 1.00 43.25 N ATOM 0 H LYS A 69 -12.400 4.075 -10.000 1.00 51.45 H new ATOM 0 HA LYS A 69 -11.799 5.984 -7.980 1.00 44.25 H new ATOM 0 HB2 LYS A 69 -13.446 5.666 -10.354 1.00 5.23 H new ATOM 0 HB3 LYS A 69 -14.479 6.224 -9.053 1.00 5.23 H new ATOM 0 HG2 LYS A 69 -12.006 7.579 -10.155 1.00 2.14 H new ATOM 0 HG3 LYS A 69 -13.664 8.134 -10.264 1.00 2.14 H new ATOM 0 HD2 LYS A 69 -13.598 8.297 -7.660 1.00 61.22 H new ATOM 0 HD3 LYS A 69 -11.860 8.133 -7.816 1.00 61.22 H new ATOM 0 HE2 LYS A 69 -11.940 9.987 -9.590 1.00 43.21 H new ATOM 0 HE3 LYS A 69 -13.626 10.225 -9.174 1.00 43.21 H new ATOM 0 HZ1 LYS A 69 -12.966 11.523 -7.552 1.00 43.25 H new ATOM 0 HZ2 LYS A 69 -12.219 10.202 -6.791 1.00 43.25 H new ATOM 0 HZ3 LYS A 69 -11.334 11.176 -7.864 1.00 43.25 H new ATOM 1133 N ASP A 70 -13.726 3.683 -6.964 1.00 32.42 N ATOM 1134 CA ASP A 70 -14.574 3.156 -5.901 1.00 2.10 C ATOM 1135 C ASP A 70 -13.706 2.432 -4.871 1.00 61.31 C ATOM 1136 O ASP A 70 -14.073 2.354 -3.696 1.00 61.31 O ATOM 1137 CB ASP A 70 -15.617 2.195 -6.493 1.00 11.44 C ATOM 1138 CG ASP A 70 -16.646 2.858 -7.412 1.00 23.13 C ATOM 1139 OD1 ASP A 70 -16.355 3.879 -8.075 1.00 24.30 O ATOM 1140 OD2 ASP A 70 -17.782 2.351 -7.490 1.00 52.42 O ATOM 0 H ASP A 70 -13.314 2.948 -7.539 1.00 32.42 H new ATOM 0 HA ASP A 70 -15.098 3.977 -5.411 1.00 2.10 H new ATOM 0 HB2 ASP A 70 -15.098 1.417 -7.052 1.00 11.44 H new ATOM 0 HB3 ASP A 70 -16.144 1.703 -5.675 1.00 11.44 H new ATOM 1145 N LEU A 71 -12.526 1.949 -5.277 1.00 44.32 N ATOM 1146 CA LEU A 71 -11.475 1.505 -4.372 1.00 44.54 C ATOM 1147 C LEU A 71 -10.985 2.692 -3.543 1.00 14.52 C ATOM 1148 O LEU A 71 -10.870 2.602 -2.318 1.00 2.51 O ATOM 1149 CB LEU A 71 -10.277 0.913 -5.146 1.00 72.43 C ATOM 1150 CG LEU A 71 -10.321 -0.609 -5.307 1.00 51.14 C ATOM 1151 CD1 LEU A 71 -9.151 -1.091 -6.180 1.00 32.40 C ATOM 1152 CD2 LEU A 71 -10.262 -1.222 -3.906 1.00 20.31 C ATOM 0 H LEU A 71 -12.277 1.857 -6.262 1.00 44.32 H new ATOM 0 HA LEU A 71 -11.891 0.730 -3.728 1.00 44.54 H new ATOM 0 HB2 LEU A 71 -10.236 1.370 -6.135 1.00 72.43 H new ATOM 0 HB3 LEU A 71 -9.356 1.186 -4.631 1.00 72.43 H new ATOM 0 HG LEU A 71 -11.238 -0.919 -5.808 1.00 51.14 H new ATOM 0 HD11 LEU A 71 -9.197 -2.175 -6.284 1.00 32.40 H new ATOM 0 HD12 LEU A 71 -9.217 -0.629 -7.165 1.00 32.40 H new ATOM 0 HD13 LEU A 71 -8.208 -0.812 -5.711 1.00 32.40 H new ATOM 0 HD21 LEU A 71 -10.291 -2.309 -3.983 1.00 20.31 H new ATOM 0 HD22 LEU A 71 -9.338 -0.918 -3.414 1.00 20.31 H new ATOM 0 HD23 LEU A 71 -11.115 -0.876 -3.321 1.00 20.31 H new ATOM 1164 N THR A 72 -10.729 3.811 -4.216 1.00 71.15 N ATOM 1165 CA THR A 72 -10.417 5.100 -3.620 1.00 33.04 C ATOM 1166 C THR A 72 -11.484 5.428 -2.568 1.00 35.13 C ATOM 1167 O THR A 72 -11.168 5.678 -1.402 1.00 12.24 O ATOM 1168 CB THR A 72 -10.305 6.174 -4.732 1.00 42.53 C ATOM 1169 OG1 THR A 72 -11.036 5.790 -5.859 1.00 60.23 O ATOM 1170 CG2 THR A 72 -8.897 6.512 -5.204 1.00 14.32 C ATOM 0 H THR A 72 -10.734 3.842 -5.236 1.00 71.15 H new ATOM 0 HA THR A 72 -9.453 5.077 -3.112 1.00 33.04 H new ATOM 0 HB THR A 72 -10.700 7.070 -4.253 1.00 42.53 H new ATOM 0 HG1 THR A 72 -10.502 5.172 -6.400 1.00 60.23 H new ATOM 0 HG21 THR A 72 -8.947 7.274 -5.982 1.00 14.32 H new ATOM 0 HG22 THR A 72 -8.312 6.888 -4.364 1.00 14.32 H new ATOM 0 HG23 THR A 72 -8.423 5.616 -5.604 1.00 14.32 H new ATOM 1178 N GLN A 73 -12.764 5.358 -2.946 1.00 72.22 N ATOM 1179 CA GLN A 73 -13.846 5.725 -2.051 1.00 22.12 C ATOM 1180 C GLN A 73 -13.857 4.809 -0.815 1.00 11.41 C ATOM 1181 O GLN A 73 -13.832 5.313 0.311 1.00 55.24 O ATOM 1182 CB GLN A 73 -15.186 5.795 -2.821 1.00 72.24 C ATOM 1183 CG GLN A 73 -16.124 6.858 -2.216 1.00 43.35 C ATOM 1184 CD GLN A 73 -17.294 7.304 -3.096 1.00 12.24 C ATOM 1185 OE1 GLN A 73 -17.261 7.279 -4.324 1.00 53.53 O ATOM 1186 NE2 GLN A 73 -18.351 7.826 -2.489 1.00 0.51 N ATOM 0 H GLN A 73 -13.068 5.049 -3.869 1.00 72.22 H new ATOM 0 HA GLN A 73 -13.686 6.730 -1.662 1.00 22.12 H new ATOM 0 HB2 GLN A 73 -14.994 6.029 -3.868 1.00 72.24 H new ATOM 0 HB3 GLN A 73 -15.673 4.820 -2.797 1.00 72.24 H new ATOM 0 HG2 GLN A 73 -16.527 6.468 -1.282 1.00 43.35 H new ATOM 0 HG3 GLN A 73 -15.530 7.736 -1.964 1.00 43.35 H new ATOM 0 HE21 GLN A 73 -18.392 7.853 -1.470 1.00 0.51 H new ATOM 0 HE22 GLN A 73 -19.123 8.200 -3.041 1.00 0.51 H new ATOM 1195 N ALA A 74 -13.902 3.480 -0.976 1.00 60.24 N ATOM 1196 CA ALA A 74 -14.190 2.593 0.157 1.00 43.14 C ATOM 1197 C ALA A 74 -13.070 2.545 1.189 1.00 74.45 C ATOM 1198 O ALA A 74 -13.351 2.427 2.381 1.00 53.13 O ATOM 1199 CB ALA A 74 -14.521 1.174 -0.319 1.00 54.51 C ATOM 0 H ALA A 74 -13.746 3.002 -1.864 1.00 60.24 H new ATOM 0 HA ALA A 74 -15.062 3.023 0.651 1.00 43.14 H new ATOM 0 HB1 ALA A 74 -14.730 0.540 0.543 1.00 54.51 H new ATOM 0 HB2 ALA A 74 -15.396 1.203 -0.968 1.00 54.51 H new ATOM 0 HB3 ALA A 74 -13.673 0.768 -0.871 1.00 54.51 H new ATOM 1205 N TRP A 75 -11.815 2.665 0.757 1.00 14.34 N ATOM 1206 CA TRP A 75 -10.663 2.637 1.645 1.00 53.23 C ATOM 1207 C TRP A 75 -10.789 3.719 2.712 1.00 60.24 C ATOM 1208 O TRP A 75 -10.450 3.500 3.867 1.00 64.42 O ATOM 1209 CB TRP A 75 -9.444 2.943 0.798 1.00 31.03 C ATOM 1210 CG TRP A 75 -8.116 2.704 1.441 1.00 34.43 C ATOM 1211 CD1 TRP A 75 -7.094 3.572 1.649 1.00 55.54 C ATOM 1212 CD2 TRP A 75 -7.637 1.423 1.914 1.00 33.12 C ATOM 1213 NE1 TRP A 75 -6.012 2.901 2.175 1.00 75.14 N ATOM 1214 CE2 TRP A 75 -6.283 1.560 2.312 1.00 51.41 C ATOM 1215 CE3 TRP A 75 -8.215 0.144 1.993 1.00 4.11 C ATOM 1216 CZ2 TRP A 75 -5.518 0.457 2.689 1.00 3.44 C ATOM 1217 CZ3 TRP A 75 -7.481 -0.956 2.447 1.00 31.01 C ATOM 1218 CH2 TRP A 75 -6.126 -0.807 2.781 1.00 3.21 C ATOM 0 H TRP A 75 -11.572 2.785 -0.226 1.00 14.34 H new ATOM 0 HA TRP A 75 -10.590 1.666 2.135 1.00 53.23 H new ATOM 0 HB2 TRP A 75 -9.498 2.342 -0.110 1.00 31.03 H new ATOM 0 HB3 TRP A 75 -9.493 3.988 0.492 1.00 31.03 H new ATOM 0 HD1 TRP A 75 -7.124 4.630 1.434 1.00 55.54 H new ATOM 0 HE1 TRP A 75 -5.127 3.341 2.429 1.00 75.14 H new ATOM 0 HE3 TRP A 75 -9.245 0.009 1.698 1.00 4.11 H new ATOM 0 HZ2 TRP A 75 -4.467 0.573 2.909 1.00 3.44 H new ATOM 0 HZ3 TRP A 75 -7.957 -1.921 2.541 1.00 31.01 H new ATOM 0 HH2 TRP A 75 -5.552 -1.661 3.108 1.00 3.21 H new ATOM 1229 N ALA A 76 -11.307 4.890 2.338 1.00 13.43 N ATOM 1230 CA ALA A 76 -11.515 5.977 3.271 1.00 63.01 C ATOM 1231 C ALA A 76 -12.483 5.591 4.400 1.00 41.31 C ATOM 1232 O ALA A 76 -12.208 5.967 5.536 1.00 60.03 O ATOM 1233 CB ALA A 76 -11.968 7.213 2.512 1.00 73.45 C ATOM 0 H ALA A 76 -11.590 5.102 1.381 1.00 13.43 H new ATOM 0 HA ALA A 76 -10.570 6.204 3.764 1.00 63.01 H new ATOM 0 HB1 ALA A 76 -12.125 8.033 3.213 1.00 73.45 H new ATOM 0 HB2 ALA A 76 -11.204 7.496 1.788 1.00 73.45 H new ATOM 0 HB3 ALA A 76 -12.900 6.998 1.990 1.00 73.45 H new ATOM 1239 N VAL A 77 -13.562 4.822 4.158 1.00 1.33 N ATOM 1240 CA VAL A 77 -14.321 4.236 5.274 1.00 64.35 C ATOM 1241 C VAL A 77 -13.408 3.388 6.176 1.00 3.22 C ATOM 1242 O VAL A 77 -13.504 3.475 7.400 1.00 21.32 O ATOM 1243 CB VAL A 77 -15.513 3.396 4.761 1.00 60.02 C ATOM 1244 CG1 VAL A 77 -16.316 2.721 5.887 1.00 54.12 C ATOM 1245 CG2 VAL A 77 -16.471 4.266 3.950 1.00 41.32 C ATOM 0 H VAL A 77 -13.918 4.598 3.229 1.00 1.33 H new ATOM 0 HA VAL A 77 -14.720 5.058 5.869 1.00 64.35 H new ATOM 0 HB VAL A 77 -15.074 2.613 4.143 1.00 60.02 H new ATOM 0 HG11 VAL A 77 -17.137 2.148 5.456 1.00 54.12 H new ATOM 0 HG12 VAL A 77 -15.664 2.053 6.449 1.00 54.12 H new ATOM 0 HG13 VAL A 77 -16.717 3.483 6.555 1.00 54.12 H new ATOM 0 HG21 VAL A 77 -17.304 3.658 3.597 1.00 41.32 H new ATOM 0 HG22 VAL A 77 -16.851 5.072 4.578 1.00 41.32 H new ATOM 0 HG23 VAL A 77 -15.943 4.690 3.096 1.00 41.32 H new ATOM 1255 N ALA A 78 -12.552 2.545 5.588 1.00 53.51 N ATOM 1256 CA ALA A 78 -11.691 1.657 6.354 1.00 74.25 C ATOM 1257 C ALA A 78 -10.708 2.451 7.213 1.00 20.24 C ATOM 1258 O ALA A 78 -10.578 2.129 8.389 1.00 23.42 O ATOM 1259 CB ALA A 78 -10.974 0.660 5.441 1.00 24.24 C ATOM 0 H ALA A 78 -12.442 2.464 4.577 1.00 53.51 H new ATOM 0 HA ALA A 78 -12.319 1.079 7.032 1.00 74.25 H new ATOM 0 HB1 ALA A 78 -10.338 0.010 6.041 1.00 24.24 H new ATOM 0 HB2 ALA A 78 -11.711 0.057 4.910 1.00 24.24 H new ATOM 0 HB3 ALA A 78 -10.362 1.202 4.720 1.00 24.24 H new ATOM 1265 N ILE A 79 -10.056 3.481 6.668 1.00 54.41 N ATOM 1266 CA ILE A 79 -9.164 4.374 7.406 1.00 32.40 C ATOM 1267 C ILE A 79 -9.942 5.118 8.493 1.00 2.20 C ATOM 1268 O ILE A 79 -9.410 5.296 9.590 1.00 23.14 O ATOM 1269 CB ILE A 79 -8.451 5.343 6.428 1.00 34.04 C ATOM 1270 CG1 ILE A 79 -7.444 4.539 5.579 1.00 24.13 C ATOM 1271 CG2 ILE A 79 -7.738 6.506 7.155 1.00 72.31 C ATOM 1272 CD1 ILE A 79 -6.697 5.368 4.539 1.00 3.43 C ATOM 0 H ILE A 79 -10.136 3.721 5.680 1.00 54.41 H new ATOM 0 HA ILE A 79 -8.392 3.787 7.904 1.00 32.40 H new ATOM 0 HB ILE A 79 -9.208 5.799 5.790 1.00 34.04 H new ATOM 0 HG12 ILE A 79 -6.718 4.072 6.244 1.00 24.13 H new ATOM 0 HG13 ILE A 79 -7.976 3.734 5.071 1.00 24.13 H new ATOM 0 HG21 ILE A 79 -7.256 7.153 6.422 1.00 72.31 H new ATOM 0 HG22 ILE A 79 -8.468 7.082 7.723 1.00 72.31 H new ATOM 0 HG23 ILE A 79 -6.986 6.104 7.834 1.00 72.31 H new ATOM 0 HD11 ILE A 79 -6.010 4.726 3.987 1.00 3.43 H new ATOM 0 HD12 ILE A 79 -7.412 5.814 3.848 1.00 3.43 H new ATOM 0 HD13 ILE A 79 -6.134 6.157 5.038 1.00 3.43 H new ATOM 1284 N ALA A 80 -11.171 5.570 8.211 1.00 44.24 N ATOM 1285 CA ALA A 80 -11.945 6.378 9.143 1.00 20.43 C ATOM 1286 C ALA A 80 -12.136 5.632 10.461 1.00 14.52 C ATOM 1287 O ALA A 80 -11.953 6.222 11.527 1.00 71.35 O ATOM 1288 CB ALA A 80 -13.269 6.830 8.512 1.00 55.51 C ATOM 0 H ALA A 80 -11.650 5.382 7.330 1.00 44.24 H new ATOM 0 HA ALA A 80 -11.391 7.288 9.371 1.00 20.43 H new ATOM 0 HB1 ALA A 80 -13.827 7.432 9.229 1.00 55.51 H new ATOM 0 HB2 ALA A 80 -13.064 7.425 7.622 1.00 55.51 H new ATOM 0 HB3 ALA A 80 -13.858 5.955 8.236 1.00 55.51 H new ATOM 1294 N LEU A 81 -12.428 4.330 10.397 1.00 1.51 N ATOM 1295 CA LEU A 81 -12.506 3.495 11.590 1.00 31.00 C ATOM 1296 C LEU A 81 -11.126 2.960 12.001 1.00 54.44 C ATOM 1297 O LEU A 81 -10.882 2.756 13.192 1.00 14.50 O ATOM 1298 CB LEU A 81 -13.491 2.336 11.359 1.00 0.23 C ATOM 1299 CG LEU A 81 -14.947 2.774 11.093 1.00 40.35 C ATOM 1300 CD1 LEU A 81 -15.781 1.537 10.745 1.00 35.44 C ATOM 1301 CD2 LEU A 81 -15.578 3.484 12.298 1.00 3.11 C ATOM 0 H LEU A 81 -12.614 3.833 9.526 1.00 1.51 H new ATOM 0 HA LEU A 81 -12.871 4.114 12.410 1.00 31.00 H new ATOM 0 HB2 LEU A 81 -13.143 1.744 10.512 1.00 0.23 H new ATOM 0 HB3 LEU A 81 -13.475 1.684 12.232 1.00 0.23 H new ATOM 0 HG LEU A 81 -14.933 3.485 10.267 1.00 40.35 H new ATOM 0 HD11 LEU A 81 -16.812 1.835 10.555 1.00 35.44 H new ATOM 0 HD12 LEU A 81 -15.371 1.061 9.854 1.00 35.44 H new ATOM 0 HD13 LEU A 81 -15.754 0.834 11.578 1.00 35.44 H new ATOM 0 HD21 LEU A 81 -16.602 3.770 12.057 1.00 3.11 H new ATOM 0 HD22 LEU A 81 -15.582 2.811 13.156 1.00 3.11 H new ATOM 0 HD23 LEU A 81 -14.999 4.375 12.539 1.00 3.11 H new ATOM 1313 N GLY A 82 -10.218 2.753 11.049 1.00 13.32 N ATOM 1314 CA GLY A 82 -8.896 2.173 11.234 1.00 42.52 C ATOM 1315 C GLY A 82 -8.932 0.653 11.181 1.00 72.42 C ATOM 1316 O GLY A 82 -8.456 -0.009 12.105 1.00 74.24 O ATOM 0 H GLY A 82 -10.398 3.000 10.076 1.00 13.32 H new ATOM 0 HA2 GLY A 82 -8.224 2.548 10.462 1.00 42.52 H new ATOM 0 HA3 GLY A 82 -8.490 2.493 12.193 1.00 42.52 H new ATOM 1320 N VAL A 83 -9.522 0.087 10.130 1.00 60.24 N ATOM 1321 CA VAL A 83 -9.773 -1.344 9.987 1.00 20.42 C ATOM 1322 C VAL A 83 -9.220 -1.879 8.662 1.00 64.32 C ATOM 1323 O VAL A 83 -9.674 -2.926 8.202 1.00 23.30 O ATOM 1324 CB VAL A 83 -11.275 -1.648 10.205 1.00 43.32 C ATOM 1325 CG1 VAL A 83 -11.705 -1.320 11.643 1.00 41.11 C ATOM 1326 CG2 VAL A 83 -12.196 -0.921 9.211 1.00 3.42 C ATOM 0 H VAL A 83 -9.848 0.629 9.330 1.00 60.24 H new ATOM 0 HA VAL A 83 -9.230 -1.883 10.763 1.00 20.42 H new ATOM 0 HB VAL A 83 -11.386 -2.717 10.025 1.00 43.32 H new ATOM 0 HG11 VAL A 83 -12.765 -1.544 11.766 1.00 41.11 H new ATOM 0 HG12 VAL A 83 -11.124 -1.921 12.343 1.00 41.11 H new ATOM 0 HG13 VAL A 83 -11.532 -0.262 11.842 1.00 41.11 H new ATOM 0 HG21 VAL A 83 -13.234 -1.179 9.421 1.00 3.42 H new ATOM 0 HG22 VAL A 83 -12.062 0.156 9.312 1.00 3.42 H new ATOM 0 HG23 VAL A 83 -11.945 -1.224 8.194 1.00 3.42 H new ATOM 1336 N GLU A 84 -8.260 -1.186 8.036 1.00 53.42 N ATOM 1337 CA GLU A 84 -7.725 -1.543 6.722 1.00 61.25 C ATOM 1338 C GLU A 84 -7.262 -2.993 6.695 1.00 14.13 C ATOM 1339 O GLU A 84 -7.705 -3.774 5.862 1.00 72.02 O ATOM 1340 CB GLU A 84 -6.533 -0.657 6.326 1.00 60.22 C ATOM 1341 CG GLU A 84 -6.786 0.852 6.337 1.00 42.25 C ATOM 1342 CD GLU A 84 -6.253 1.485 7.627 1.00 41.31 C ATOM 1343 OE1 GLU A 84 -6.689 1.082 8.729 1.00 14.22 O ATOM 1344 OE2 GLU A 84 -5.359 2.362 7.550 1.00 35.00 O ATOM 0 H GLU A 84 -7.830 -0.352 8.435 1.00 53.42 H new ATOM 0 HA GLU A 84 -8.539 -1.393 6.012 1.00 61.25 H new ATOM 0 HB2 GLU A 84 -5.706 -0.872 7.003 1.00 60.22 H new ATOM 0 HB3 GLU A 84 -6.209 -0.944 5.326 1.00 60.22 H new ATOM 0 HG2 GLU A 84 -6.304 1.312 5.475 1.00 42.25 H new ATOM 0 HG3 GLU A 84 -7.855 1.047 6.246 1.00 42.25 H new ATOM 1351 N ASP A 85 -6.409 -3.374 7.639 1.00 72.04 N ATOM 1352 CA ASP A 85 -5.843 -4.703 7.768 1.00 74.15 C ATOM 1353 C ASP A 85 -6.969 -5.736 7.865 1.00 1.10 C ATOM 1354 O ASP A 85 -6.967 -6.759 7.181 1.00 43.14 O ATOM 1355 CB ASP A 85 -4.982 -4.712 9.036 1.00 0.11 C ATOM 1356 CG ASP A 85 -3.757 -3.798 8.969 1.00 33.22 C ATOM 1357 OD1 ASP A 85 -3.914 -2.575 8.734 1.00 12.54 O ATOM 1358 OD2 ASP A 85 -2.634 -4.290 9.217 1.00 73.00 O ATOM 0 H ASP A 85 -6.082 -2.735 8.364 1.00 72.04 H new ATOM 0 HA ASP A 85 -5.233 -4.958 6.901 1.00 74.15 H new ATOM 0 HB2 ASP A 85 -5.599 -4.412 9.883 1.00 0.11 H new ATOM 0 HB3 ASP A 85 -4.650 -5.732 9.229 1.00 0.11 H new ATOM 1363 N LYS A 86 -8.001 -5.408 8.650 1.00 60.41 N ATOM 1364 CA LYS A 86 -9.140 -6.274 8.942 1.00 54.14 C ATOM 1365 C LYS A 86 -10.075 -6.417 7.747 1.00 24.00 C ATOM 1366 O LYS A 86 -11.083 -7.110 7.863 1.00 0.11 O ATOM 1367 CB LYS A 86 -9.971 -5.719 10.106 1.00 34.30 C ATOM 1368 CG LYS A 86 -9.154 -5.137 11.269 1.00 1.22 C ATOM 1369 CD LYS A 86 -10.055 -4.732 12.443 1.00 23.00 C ATOM 1370 CE LYS A 86 -9.949 -5.702 13.628 1.00 11.41 C ATOM 1371 NZ LYS A 86 -10.328 -7.087 13.272 1.00 35.12 N ATOM 0 H LYS A 86 -8.065 -4.501 9.113 1.00 60.41 H new ATOM 0 HA LYS A 86 -8.717 -7.246 9.196 1.00 54.14 H new ATOM 0 HB2 LYS A 86 -10.632 -4.942 9.722 1.00 34.30 H new ATOM 0 HB3 LYS A 86 -10.606 -6.517 10.492 1.00 34.30 H new ATOM 0 HG2 LYS A 86 -8.424 -5.873 11.606 1.00 1.22 H new ATOM 0 HG3 LYS A 86 -8.594 -4.268 10.923 1.00 1.22 H new ATOM 0 HD2 LYS A 86 -9.786 -3.729 12.774 1.00 23.00 H new ATOM 0 HD3 LYS A 86 -11.090 -4.689 12.104 1.00 23.00 H new ATOM 0 HE2 LYS A 86 -8.927 -5.696 14.006 1.00 11.41 H new ATOM 0 HE3 LYS A 86 -10.590 -5.351 14.437 1.00 11.41 H new ATOM 0 HZ1 LYS A 86 -10.270 -7.691 14.117 1.00 35.12 H new ATOM 0 HZ2 LYS A 86 -11.301 -7.097 12.905 1.00 35.12 H new ATOM 0 HZ3 LYS A 86 -9.679 -7.448 12.544 1.00 35.12 H new ATOM 1385 N ILE A 87 -9.837 -5.695 6.657 1.00 73.25 N ATOM 1386 CA ILE A 87 -10.544 -5.805 5.404 1.00 32.22 C ATOM 1387 C ILE A 87 -9.542 -5.828 4.259 1.00 24.34 C ATOM 1388 O ILE A 87 -9.897 -5.484 3.140 1.00 33.00 O ATOM 1389 CB ILE A 87 -11.593 -4.690 5.272 1.00 53.33 C ATOM 1390 CG1 ILE A 87 -11.047 -3.246 5.186 1.00 74.31 C ATOM 1391 CG2 ILE A 87 -12.619 -4.825 6.396 1.00 72.05 C ATOM 1392 CD1 ILE A 87 -11.195 -2.648 3.783 1.00 60.13 C ATOM 0 H ILE A 87 -9.107 -4.983 6.632 1.00 73.25 H new ATOM 0 HA ILE A 87 -11.099 -6.742 5.368 1.00 32.22 H new ATOM 0 HB ILE A 87 -12.057 -4.843 4.297 1.00 53.33 H new ATOM 0 HG12 ILE A 87 -11.575 -2.618 5.903 1.00 74.31 H new ATOM 0 HG13 ILE A 87 -9.995 -3.241 5.471 1.00 74.31 H new ATOM 0 HG21 ILE A 87 -13.365 -4.035 6.305 1.00 72.05 H new ATOM 0 HG22 ILE A 87 -13.109 -5.796 6.327 1.00 72.05 H new ATOM 0 HG23 ILE A 87 -12.116 -4.740 7.360 1.00 72.05 H new ATOM 0 HD11 ILE A 87 -10.797 -1.633 3.776 1.00 60.13 H new ATOM 0 HD12 ILE A 87 -10.645 -3.259 3.067 1.00 60.13 H new ATOM 0 HD13 ILE A 87 -12.249 -2.626 3.506 1.00 60.13 H new ATOM 1404 N THR A 88 -8.295 -6.217 4.510 1.00 1.10 N ATOM 1405 CA THR A 88 -7.386 -6.496 3.425 1.00 71.41 C ATOM 1406 C THR A 88 -7.579 -7.959 3.039 1.00 21.44 C ATOM 1407 O THR A 88 -7.978 -8.255 1.915 1.00 11.43 O ATOM 1408 CB THR A 88 -5.956 -6.115 3.822 1.00 31.32 C ATOM 1409 OG1 THR A 88 -5.901 -4.726 4.092 1.00 4.51 O ATOM 1410 CG2 THR A 88 -4.997 -6.405 2.673 1.00 24.01 C ATOM 0 H THR A 88 -7.904 -6.342 5.444 1.00 1.10 H new ATOM 0 HA THR A 88 -7.592 -5.893 2.541 1.00 71.41 H new ATOM 0 HB THR A 88 -5.672 -6.694 4.701 1.00 31.32 H new ATOM 0 HG1 THR A 88 -6.483 -4.517 4.853 1.00 4.51 H new ATOM 0 HG21 THR A 88 -3.984 -6.130 2.967 1.00 24.01 H new ATOM 0 HG22 THR A 88 -5.029 -7.467 2.431 1.00 24.01 H new ATOM 0 HG23 THR A 88 -5.291 -5.825 1.798 1.00 24.01 H new ATOM 1418 N ALA A 89 -7.397 -8.874 3.992 1.00 31.31 N ATOM 1419 CA ALA A 89 -7.229 -10.294 3.695 1.00 13.24 C ATOM 1420 C ALA A 89 -8.426 -10.892 2.935 1.00 12.24 C ATOM 1421 O ALA A 89 -8.276 -11.333 1.794 1.00 53.44 O ATOM 1422 CB ALA A 89 -6.926 -11.054 4.988 1.00 43.41 C ATOM 0 H ALA A 89 -7.362 -8.651 4.987 1.00 31.31 H new ATOM 0 HA ALA A 89 -6.381 -10.400 3.018 1.00 13.24 H new ATOM 0 HB1 ALA A 89 -6.801 -12.114 4.766 1.00 43.41 H new ATOM 0 HB2 ALA A 89 -6.010 -10.665 5.432 1.00 43.41 H new ATOM 0 HB3 ALA A 89 -7.752 -10.925 5.688 1.00 43.41 H new ATOM 1428 N PRO A 90 -9.648 -10.867 3.498 1.00 0.31 N ATOM 1429 CA PRO A 90 -10.799 -11.463 2.834 1.00 75.03 C ATOM 1430 C PRO A 90 -11.168 -10.704 1.559 1.00 75.31 C ATOM 1431 O PRO A 90 -11.755 -11.262 0.633 1.00 61.43 O ATOM 1432 CB PRO A 90 -11.928 -11.386 3.855 1.00 61.03 C ATOM 1433 CG PRO A 90 -11.538 -10.255 4.802 1.00 31.00 C ATOM 1434 CD PRO A 90 -10.030 -10.224 4.746 1.00 13.12 C ATOM 0 HA PRO A 90 -10.594 -12.487 2.521 1.00 75.03 H new ATOM 0 HB2 PRO A 90 -12.883 -11.182 3.371 1.00 61.03 H new ATOM 0 HB3 PRO A 90 -12.038 -12.328 4.392 1.00 61.03 H new ATOM 0 HG2 PRO A 90 -11.967 -9.305 4.485 1.00 31.00 H new ATOM 0 HG3 PRO A 90 -11.895 -10.443 5.815 1.00 31.00 H new ATOM 0 HD2 PRO A 90 -9.662 -9.199 4.782 1.00 13.12 H new ATOM 0 HD3 PRO A 90 -9.600 -10.748 5.600 1.00 13.12 H new ATOM 1442 N MET A 91 -10.834 -9.416 1.515 1.00 40.13 N ATOM 1443 CA MET A 91 -11.073 -8.563 0.363 1.00 22.20 C ATOM 1444 C MET A 91 -10.237 -9.058 -0.811 1.00 3.10 C ATOM 1445 O MET A 91 -10.754 -9.172 -1.922 1.00 55.55 O ATOM 1446 CB MET A 91 -10.808 -7.096 0.738 1.00 3.13 C ATOM 1447 CG MET A 91 -11.697 -6.061 0.035 1.00 55.23 C ATOM 1448 SD MET A 91 -12.049 -4.535 0.940 1.00 52.41 S ATOM 1449 CE MET A 91 -13.339 -5.168 2.033 1.00 43.12 C ATOM 0 H MET A 91 -10.383 -8.933 2.292 1.00 40.13 H new ATOM 0 HA MET A 91 -12.116 -8.613 0.049 1.00 22.20 H new ATOM 0 HB2 MET A 91 -10.935 -6.986 1.815 1.00 3.13 H new ATOM 0 HB3 MET A 91 -9.766 -6.865 0.515 1.00 3.13 H new ATOM 0 HG2 MET A 91 -11.224 -5.794 -0.910 1.00 55.23 H new ATOM 0 HG3 MET A 91 -12.646 -6.538 -0.208 1.00 55.23 H new ATOM 0 HE1 MET A 91 -13.456 -4.498 2.885 1.00 43.12 H new ATOM 0 HE2 MET A 91 -14.281 -5.229 1.487 1.00 43.12 H new ATOM 0 HE3 MET A 91 -13.061 -6.160 2.388 1.00 43.12 H new ATOM 1459 N PHE A 92 -8.975 -9.403 -0.560 1.00 52.55 N ATOM 1460 CA PHE A 92 -8.045 -9.900 -1.557 1.00 35.31 C ATOM 1461 C PHE A 92 -8.470 -11.298 -1.997 1.00 61.03 C ATOM 1462 O PHE A 92 -8.478 -11.580 -3.204 1.00 1.33 O ATOM 1463 CB PHE A 92 -6.615 -9.861 -0.994 1.00 44.23 C ATOM 1464 CG PHE A 92 -5.943 -8.492 -1.032 1.00 21.30 C ATOM 1465 CD1 PHE A 92 -6.656 -7.320 -0.710 1.00 72.11 C ATOM 1466 CD2 PHE A 92 -4.617 -8.371 -1.497 1.00 60.34 C ATOM 1467 CE1 PHE A 92 -6.072 -6.059 -0.844 1.00 2.33 C ATOM 1468 CE2 PHE A 92 -4.014 -7.105 -1.612 1.00 31.32 C ATOM 1469 CZ PHE A 92 -4.751 -5.948 -1.301 1.00 40.13 C ATOM 0 H PHE A 92 -8.565 -9.340 0.372 1.00 52.55 H new ATOM 0 HA PHE A 92 -8.058 -9.265 -2.443 1.00 35.31 H new ATOM 0 HB2 PHE A 92 -6.638 -10.209 0.039 1.00 44.23 H new ATOM 0 HB3 PHE A 92 -6.001 -10.566 -1.554 1.00 44.23 H new ATOM 0 HD1 PHE A 92 -7.672 -7.399 -0.353 1.00 72.11 H new ATOM 0 HD2 PHE A 92 -4.061 -9.256 -1.767 1.00 60.34 H new ATOM 0 HE1 PHE A 92 -6.636 -5.172 -0.596 1.00 2.33 H new ATOM 0 HE2 PHE A 92 -2.988 -7.022 -1.938 1.00 31.32 H new ATOM 0 HZ PHE A 92 -4.299 -4.974 -1.414 1.00 40.13 H new ATOM 1479 N GLU A 93 -8.919 -12.146 -1.064 1.00 60.41 N ATOM 1480 CA GLU A 93 -9.495 -13.435 -1.428 1.00 44.32 C ATOM 1481 C GLU A 93 -10.732 -13.258 -2.325 1.00 60.13 C ATOM 1482 O GLU A 93 -10.982 -14.097 -3.185 1.00 0.22 O ATOM 1483 CB GLU A 93 -9.771 -14.348 -0.205 1.00 0.21 C ATOM 1484 CG GLU A 93 -9.068 -15.703 -0.423 1.00 61.24 C ATOM 1485 CD GLU A 93 -9.547 -16.888 0.426 1.00 35.23 C ATOM 1486 OE1 GLU A 93 -9.007 -17.165 1.522 1.00 32.04 O ATOM 1487 OE2 GLU A 93 -10.385 -17.669 -0.095 1.00 23.11 O ATOM 0 H GLU A 93 -8.893 -11.960 -0.061 1.00 60.41 H new ATOM 0 HA GLU A 93 -8.741 -13.962 -2.012 1.00 44.32 H new ATOM 0 HB2 GLU A 93 -9.406 -13.876 0.707 1.00 0.21 H new ATOM 0 HB3 GLU A 93 -10.844 -14.496 -0.080 1.00 0.21 H new ATOM 0 HG2 GLU A 93 -9.177 -15.974 -1.473 1.00 61.24 H new ATOM 0 HG3 GLU A 93 -8.003 -15.564 -0.238 1.00 61.24 H new ATOM 1494 N ALA A 94 -11.459 -12.144 -2.239 1.00 15.21 N ATOM 1495 CA ALA A 94 -12.669 -11.927 -3.022 1.00 71.22 C ATOM 1496 C ALA A 94 -12.432 -11.095 -4.285 1.00 42.22 C ATOM 1497 O ALA A 94 -13.387 -10.811 -5.010 1.00 4.52 O ATOM 1498 CB ALA A 94 -13.752 -11.356 -2.102 1.00 4.40 C ATOM 0 H ALA A 94 -11.222 -11.367 -1.622 1.00 15.21 H new ATOM 0 HA ALA A 94 -13.015 -12.884 -3.412 1.00 71.22 H new ATOM 0 HB1 ALA A 94 -14.664 -11.188 -2.674 1.00 4.40 H new ATOM 0 HB2 ALA A 94 -13.954 -12.062 -1.296 1.00 4.40 H new ATOM 0 HB3 ALA A 94 -13.410 -10.411 -1.680 1.00 4.40 H new ATOM 1504 N VAL A 95 -11.186 -10.730 -4.589 1.00 2.12 N ATOM 1505 CA VAL A 95 -10.830 -9.922 -5.756 1.00 61.21 C ATOM 1506 C VAL A 95 -9.880 -10.699 -6.660 1.00 33.14 C ATOM 1507 O VAL A 95 -10.046 -10.657 -7.879 1.00 63.15 O ATOM 1508 CB VAL A 95 -10.222 -8.588 -5.285 1.00 72.22 C ATOM 1509 CG1 VAL A 95 -9.630 -7.769 -6.433 1.00 14.50 C ATOM 1510 CG2 VAL A 95 -11.275 -7.707 -4.607 1.00 73.15 C ATOM 0 H VAL A 95 -10.381 -10.993 -4.020 1.00 2.12 H new ATOM 0 HA VAL A 95 -11.721 -9.697 -6.343 1.00 61.21 H new ATOM 0 HB VAL A 95 -9.432 -8.866 -4.588 1.00 72.22 H new ATOM 0 HG11 VAL A 95 -9.216 -6.840 -6.041 1.00 14.50 H new ATOM 0 HG12 VAL A 95 -8.840 -8.342 -6.919 1.00 14.50 H new ATOM 0 HG13 VAL A 95 -10.411 -7.541 -7.158 1.00 14.50 H new ATOM 0 HG21 VAL A 95 -10.815 -6.772 -4.286 1.00 73.15 H new ATOM 0 HG22 VAL A 95 -12.078 -7.493 -5.312 1.00 73.15 H new ATOM 0 HG23 VAL A 95 -11.682 -8.228 -3.740 1.00 73.15 H new ATOM 1520 N GLN A 96 -8.909 -11.414 -6.088 1.00 15.21 N ATOM 1521 CA GLN A 96 -7.909 -12.134 -6.867 1.00 2.54 C ATOM 1522 C GLN A 96 -8.270 -13.611 -6.911 1.00 41.35 C ATOM 1523 O GLN A 96 -8.311 -14.224 -7.972 1.00 32.11 O ATOM 1524 CB GLN A 96 -6.517 -11.976 -6.265 1.00 35.14 C ATOM 1525 CG GLN A 96 -6.225 -10.488 -6.102 1.00 22.44 C ATOM 1526 CD GLN A 96 -4.793 -10.094 -6.387 1.00 12.30 C ATOM 1527 OE1 GLN A 96 -4.006 -10.788 -7.029 1.00 0.51 O ATOM 1528 NE2 GLN A 96 -4.441 -8.933 -5.898 1.00 24.24 N ATOM 0 H GLN A 96 -8.797 -11.508 -5.079 1.00 15.21 H new ATOM 0 HA GLN A 96 -7.897 -11.716 -7.874 1.00 2.54 H new ATOM 0 HB2 GLN A 96 -6.462 -12.480 -5.300 1.00 35.14 H new ATOM 0 HB3 GLN A 96 -5.771 -12.440 -6.910 1.00 35.14 H new ATOM 0 HG2 GLN A 96 -6.882 -9.927 -6.767 1.00 22.44 H new ATOM 0 HG3 GLN A 96 -6.474 -10.191 -5.083 1.00 22.44 H new ATOM 0 HE21 GLN A 96 -5.113 -8.377 -5.369 1.00 24.24 H new ATOM 0 HE22 GLN A 96 -3.494 -8.583 -6.046 1.00 24.24 H new ATOM 1537 N LYS A 97 -8.508 -14.187 -5.733 1.00 52.44 N ATOM 1538 CA LYS A 97 -8.617 -15.626 -5.565 1.00 24.41 C ATOM 1539 C LYS A 97 -9.967 -16.100 -6.103 1.00 1.31 C ATOM 1540 O LYS A 97 -9.993 -16.920 -7.016 1.00 71.35 O ATOM 1541 CB LYS A 97 -8.427 -15.977 -4.096 1.00 54.42 C ATOM 1542 CG LYS A 97 -7.034 -15.579 -3.583 1.00 1.21 C ATOM 1543 CD LYS A 97 -6.086 -16.772 -3.614 1.00 64.15 C ATOM 1544 CE LYS A 97 -6.178 -17.460 -2.247 1.00 24.04 C ATOM 1545 NZ LYS A 97 -5.251 -18.589 -2.068 1.00 62.44 N ATOM 0 H LYS A 97 -8.630 -13.661 -4.868 1.00 52.44 H new ATOM 0 HA LYS A 97 -7.839 -16.138 -6.131 1.00 24.41 H new ATOM 0 HB2 LYS A 97 -9.189 -15.473 -3.502 1.00 54.42 H new ATOM 0 HB3 LYS A 97 -8.571 -17.049 -3.958 1.00 54.42 H new ATOM 0 HG2 LYS A 97 -6.632 -14.773 -4.197 1.00 1.21 H new ATOM 0 HG3 LYS A 97 -7.112 -15.196 -2.565 1.00 1.21 H new ATOM 0 HD2 LYS A 97 -6.362 -17.462 -4.411 1.00 64.15 H new ATOM 0 HD3 LYS A 97 -5.065 -16.447 -3.813 1.00 64.15 H new ATOM 0 HE2 LYS A 97 -5.985 -16.721 -1.469 1.00 24.04 H new ATOM 0 HE3 LYS A 97 -7.198 -17.817 -2.102 1.00 24.04 H new ATOM 0 HZ1 LYS A 97 -5.379 -18.996 -1.119 1.00 62.44 H new ATOM 0 HZ2 LYS A 97 -5.446 -19.316 -2.786 1.00 62.44 H new ATOM 0 HZ3 LYS A 97 -4.272 -18.254 -2.172 1.00 62.44 H new ATOM 1559 N THR A 98 -11.085 -15.607 -5.554 1.00 60.34 N ATOM 1560 CA THR A 98 -12.437 -15.981 -5.982 1.00 32.04 C ATOM 1561 C THR A 98 -13.050 -14.960 -6.947 1.00 62.24 C ATOM 1562 O THR A 98 -13.961 -15.309 -7.696 1.00 33.43 O ATOM 1563 CB THR A 98 -13.361 -16.246 -4.778 1.00 4.40 C ATOM 1564 OG1 THR A 98 -13.754 -15.051 -4.144 1.00 1.40 O ATOM 1565 CG2 THR A 98 -12.709 -17.161 -3.736 1.00 61.31 C ATOM 0 H THR A 98 -11.075 -14.930 -4.792 1.00 60.34 H new ATOM 0 HA THR A 98 -12.340 -16.915 -6.535 1.00 32.04 H new ATOM 0 HB THR A 98 -14.239 -16.744 -5.188 1.00 4.40 H new ATOM 0 HG1 THR A 98 -14.340 -15.260 -3.387 1.00 1.40 H new ATOM 0 HG21 THR A 98 -13.399 -17.318 -2.907 1.00 61.31 H new ATOM 0 HG22 THR A 98 -12.468 -18.120 -4.194 1.00 61.31 H new ATOM 0 HG23 THR A 98 -11.796 -16.697 -3.365 1.00 61.31 H new ATOM 1573 N GLN A 99 -12.520 -13.731 -6.980 1.00 44.11 N ATOM 1574 CA GLN A 99 -12.772 -12.713 -8.007 1.00 4.13 C ATOM 1575 C GLN A 99 -14.223 -12.211 -8.052 1.00 44.34 C ATOM 1576 O GLN A 99 -14.668 -11.645 -9.049 1.00 12.14 O ATOM 1577 CB GLN A 99 -12.294 -13.208 -9.395 1.00 13.24 C ATOM 1578 CG GLN A 99 -10.873 -13.792 -9.381 1.00 13.50 C ATOM 1579 CD GLN A 99 -10.432 -14.370 -10.721 1.00 51.42 C ATOM 1580 OE1 GLN A 99 -11.167 -15.106 -11.374 1.00 21.02 O ATOM 1581 NE2 GLN A 99 -9.216 -14.078 -11.156 1.00 40.43 N ATOM 0 H GLN A 99 -11.875 -13.405 -6.260 1.00 44.11 H new ATOM 0 HA GLN A 99 -12.183 -11.842 -7.721 1.00 4.13 H new ATOM 0 HB2 GLN A 99 -12.987 -13.967 -9.760 1.00 13.24 H new ATOM 0 HB3 GLN A 99 -12.330 -12.378 -10.100 1.00 13.24 H new ATOM 0 HG2 GLN A 99 -10.172 -13.011 -9.084 1.00 13.50 H new ATOM 0 HG3 GLN A 99 -10.819 -14.574 -8.623 1.00 13.50 H new ATOM 0 HE21 GLN A 99 -8.612 -13.466 -10.608 1.00 40.43 H new ATOM 0 HE22 GLN A 99 -8.884 -14.465 -12.039 1.00 40.43 H new ATOM 1590 N THR A 100 -14.981 -12.426 -6.984 1.00 40.54 N ATOM 1591 CA THR A 100 -16.408 -12.156 -6.906 1.00 33.41 C ATOM 1592 C THR A 100 -16.742 -10.664 -6.783 1.00 74.15 C ATOM 1593 O THR A 100 -17.878 -10.261 -7.064 1.00 24.02 O ATOM 1594 CB THR A 100 -16.955 -13.041 -5.778 1.00 35.43 C ATOM 1595 OG1 THR A 100 -18.358 -12.982 -5.682 1.00 42.32 O ATOM 1596 CG2 THR A 100 -16.354 -12.669 -4.422 1.00 71.01 C ATOM 0 H THR A 100 -14.603 -12.808 -6.117 1.00 40.54 H new ATOM 0 HA THR A 100 -16.907 -12.414 -7.840 1.00 33.41 H new ATOM 0 HB THR A 100 -16.663 -14.059 -6.038 1.00 35.43 H new ATOM 0 HG1 THR A 100 -18.661 -13.562 -4.952 1.00 42.32 H new ATOM 0 HG21 THR A 100 -16.767 -13.319 -3.650 1.00 71.01 H new ATOM 0 HG22 THR A 100 -15.271 -12.791 -4.458 1.00 71.01 H new ATOM 0 HG23 THR A 100 -16.595 -11.632 -4.190 1.00 71.01 H new ATOM 1604 N VAL A 101 -15.775 -9.823 -6.409 1.00 64.44 N ATOM 1605 CA VAL A 101 -15.935 -8.387 -6.516 1.00 62.05 C ATOM 1606 C VAL A 101 -16.006 -8.003 -7.980 1.00 64.45 C ATOM 1607 O VAL A 101 -15.117 -8.332 -8.766 1.00 34.10 O ATOM 1608 CB VAL A 101 -14.829 -7.643 -5.765 1.00 15.14 C ATOM 1609 CG1 VAL A 101 -14.749 -6.162 -6.160 1.00 33.34 C ATOM 1610 CG2 VAL A 101 -15.150 -7.726 -4.270 1.00 11.11 C ATOM 0 H VAL A 101 -14.876 -10.120 -6.030 1.00 64.44 H new ATOM 0 HA VAL A 101 -16.869 -8.089 -6.039 1.00 62.05 H new ATOM 0 HB VAL A 101 -13.873 -8.104 -6.013 1.00 15.14 H new ATOM 0 HG11 VAL A 101 -13.949 -5.679 -5.599 1.00 33.34 H new ATOM 0 HG12 VAL A 101 -14.544 -6.081 -7.228 1.00 33.34 H new ATOM 0 HG13 VAL A 101 -15.697 -5.673 -5.934 1.00 33.34 H new ATOM 0 HG21 VAL A 101 -14.379 -7.204 -3.703 1.00 11.11 H new ATOM 0 HG22 VAL A 101 -16.118 -7.262 -4.079 1.00 11.11 H new ATOM 0 HG23 VAL A 101 -15.182 -8.771 -3.962 1.00 11.11 H new ATOM 1620 N GLN A 102 -17.068 -7.277 -8.311 1.00 75.05 N ATOM 1621 CA GLN A 102 -17.352 -6.767 -9.638 1.00 15.12 C ATOM 1622 C GLN A 102 -18.054 -5.408 -9.567 1.00 34.21 C ATOM 1623 O GLN A 102 -17.895 -4.613 -10.494 1.00 54.45 O ATOM 1624 CB GLN A 102 -18.220 -7.776 -10.393 1.00 12.21 C ATOM 1625 CG GLN A 102 -17.495 -9.093 -10.687 1.00 20.02 C ATOM 1626 CD GLN A 102 -18.035 -9.792 -11.927 1.00 4.24 C ATOM 1627 OE1 GLN A 102 -18.909 -10.652 -11.824 1.00 52.54 O ATOM 1628 NE2 GLN A 102 -17.578 -9.418 -13.109 1.00 61.12 N ATOM 0 H GLN A 102 -17.782 -7.020 -7.630 1.00 75.05 H new ATOM 0 HA GLN A 102 -16.411 -6.627 -10.169 1.00 15.12 H new ATOM 0 HB2 GLN A 102 -19.116 -7.984 -9.808 1.00 12.21 H new ATOM 0 HB3 GLN A 102 -18.549 -7.332 -11.333 1.00 12.21 H new ATOM 0 HG2 GLN A 102 -16.431 -8.897 -10.819 1.00 20.02 H new ATOM 0 HG3 GLN A 102 -17.592 -9.757 -9.828 1.00 20.02 H new ATOM 0 HE21 GLN A 102 -16.853 -8.703 -13.173 1.00 61.12 H new ATOM 0 HE22 GLN A 102 -17.950 -9.844 -13.958 1.00 61.12 H new ATOM 1637 N SER A 103 -18.768 -5.104 -8.474 1.00 15.54 N ATOM 1638 CA SER A 103 -19.328 -3.778 -8.228 1.00 20.12 C ATOM 1639 C SER A 103 -19.257 -3.442 -6.740 1.00 35.24 C ATOM 1640 O SER A 103 -18.902 -4.289 -5.919 1.00 21.34 O ATOM 1641 CB SER A 103 -20.770 -3.741 -8.731 1.00 21.24 C ATOM 1642 OG SER A 103 -21.224 -2.414 -8.870 1.00 75.05 O ATOM 0 H SER A 103 -18.971 -5.778 -7.736 1.00 15.54 H new ATOM 0 HA SER A 103 -18.748 -3.029 -8.766 1.00 20.12 H new ATOM 0 HB2 SER A 103 -20.837 -4.254 -9.690 1.00 21.24 H new ATOM 0 HB3 SER A 103 -21.415 -4.279 -8.036 1.00 21.24 H new ATOM 0 HG SER A 103 -22.149 -2.417 -9.195 1.00 75.05 H new ATOM 1648 N VAL A 104 -19.659 -2.218 -6.391 1.00 0.43 N ATOM 1649 CA VAL A 104 -19.695 -1.679 -5.024 1.00 3.40 C ATOM 1650 C VAL A 104 -20.459 -2.629 -4.108 1.00 23.30 C ATOM 1651 O VAL A 104 -19.985 -2.939 -3.014 1.00 72.32 O ATOM 1652 CB VAL A 104 -20.358 -0.284 -4.998 1.00 63.14 C ATOM 1653 CG1 VAL A 104 -20.347 0.348 -3.595 1.00 61.04 C ATOM 1654 CG2 VAL A 104 -19.660 0.680 -5.955 1.00 71.04 C ATOM 0 H VAL A 104 -19.984 -1.543 -7.083 1.00 0.43 H new ATOM 0 HA VAL A 104 -18.669 -1.581 -4.670 1.00 3.40 H new ATOM 0 HB VAL A 104 -21.391 -0.445 -5.308 1.00 63.14 H new ATOM 0 HG11 VAL A 104 -20.825 1.327 -3.633 1.00 61.04 H new ATOM 0 HG12 VAL A 104 -20.891 -0.294 -2.902 1.00 61.04 H new ATOM 0 HG13 VAL A 104 -19.318 0.460 -3.254 1.00 61.04 H new ATOM 0 HG21 VAL A 104 -20.150 1.653 -5.913 1.00 71.04 H new ATOM 0 HG22 VAL A 104 -18.615 0.788 -5.665 1.00 71.04 H new ATOM 0 HG23 VAL A 104 -19.716 0.289 -6.971 1.00 71.04 H new ATOM 1664 N ALA A 105 -21.608 -3.118 -4.585 1.00 24.13 N ATOM 1665 CA ALA A 105 -22.472 -4.068 -3.906 1.00 74.31 C ATOM 1666 C ALA A 105 -21.725 -5.328 -3.441 1.00 75.03 C ATOM 1667 O ALA A 105 -22.163 -5.971 -2.489 1.00 71.12 O ATOM 1668 CB ALA A 105 -23.620 -4.425 -4.849 1.00 42.21 C ATOM 0 H ALA A 105 -21.971 -2.845 -5.498 1.00 24.13 H new ATOM 0 HA ALA A 105 -22.855 -3.604 -2.997 1.00 74.31 H new ATOM 0 HB1 ALA A 105 -24.284 -5.139 -4.361 1.00 42.21 H new ATOM 0 HB2 ALA A 105 -24.178 -3.523 -5.100 1.00 42.21 H new ATOM 0 HB3 ALA A 105 -23.218 -4.868 -5.760 1.00 42.21 H new ATOM 1674 N ASP A 106 -20.594 -5.677 -4.063 1.00 73.04 N ATOM 1675 CA ASP A 106 -19.819 -6.865 -3.719 1.00 35.03 C ATOM 1676 C ASP A 106 -18.708 -6.529 -2.733 1.00 23.33 C ATOM 1677 O ASP A 106 -18.267 -7.392 -1.977 1.00 52.14 O ATOM 1678 CB ASP A 106 -19.200 -7.499 -4.974 1.00 51.14 C ATOM 1679 CG ASP A 106 -20.201 -7.811 -6.085 1.00 33.00 C ATOM 1680 OD1 ASP A 106 -21.261 -8.433 -5.812 1.00 71.23 O ATOM 1681 OD2 ASP A 106 -19.960 -7.377 -7.233 1.00 2.52 O ATOM 0 H ASP A 106 -20.190 -5.135 -4.827 1.00 73.04 H new ATOM 0 HA ASP A 106 -20.505 -7.575 -3.257 1.00 35.03 H new ATOM 0 HB2 ASP A 106 -18.438 -6.826 -5.367 1.00 51.14 H new ATOM 0 HB3 ASP A 106 -18.694 -8.421 -4.688 1.00 51.14 H new ATOM 1686 N ILE A 107 -18.256 -5.277 -2.708 1.00 2.54 N ATOM 1687 CA ILE A 107 -17.201 -4.830 -1.808 1.00 54.12 C ATOM 1688 C ILE A 107 -17.819 -4.521 -0.451 1.00 73.25 C ATOM 1689 O ILE A 107 -17.273 -4.912 0.582 1.00 20.34 O ATOM 1690 CB ILE A 107 -16.441 -3.604 -2.364 1.00 15.11 C ATOM 1691 CG1 ILE A 107 -16.281 -3.699 -3.893 1.00 75.35 C ATOM 1692 CG2 ILE A 107 -15.088 -3.557 -1.645 1.00 14.43 C ATOM 1693 CD1 ILE A 107 -15.358 -2.711 -4.609 1.00 64.42 C ATOM 0 H ILE A 107 -18.615 -4.541 -3.316 1.00 2.54 H new ATOM 0 HA ILE A 107 -16.463 -5.626 -1.708 1.00 54.12 H new ATOM 0 HB ILE A 107 -16.994 -2.683 -2.181 1.00 15.11 H new ATOM 0 HG12 ILE A 107 -15.929 -4.704 -4.124 1.00 75.35 H new ATOM 0 HG13 ILE A 107 -17.273 -3.600 -4.334 1.00 75.35 H new ATOM 0 HG21 ILE A 107 -14.513 -2.704 -2.006 1.00 14.43 H new ATOM 0 HG22 ILE A 107 -15.250 -3.457 -0.572 1.00 14.43 H new ATOM 0 HG23 ILE A 107 -14.537 -4.476 -1.845 1.00 14.43 H new ATOM 0 HD11 ILE A 107 -15.362 -2.919 -5.679 1.00 64.42 H new ATOM 0 HD12 ILE A 107 -15.709 -1.694 -4.436 1.00 64.42 H new ATOM 0 HD13 ILE A 107 -14.344 -2.815 -4.223 1.00 64.42 H new ATOM 1705 N ARG A 108 -18.979 -3.845 -0.434 1.00 24.11 N ATOM 1706 CA ARG A 108 -19.661 -3.513 0.808 1.00 1.40 C ATOM 1707 C ARG A 108 -19.919 -4.750 1.648 1.00 41.11 C ATOM 1708 O ARG A 108 -19.869 -4.650 2.866 1.00 44.42 O ATOM 1709 CB ARG A 108 -20.951 -2.731 0.527 1.00 32.41 C ATOM 1710 CG ARG A 108 -22.032 -3.496 -0.249 1.00 23.12 C ATOM 1711 CD ARG A 108 -23.395 -2.810 -0.172 1.00 14.40 C ATOM 1712 NE ARG A 108 -23.313 -1.358 -0.383 1.00 15.54 N ATOM 1713 CZ ARG A 108 -24.359 -0.524 -0.468 1.00 24.30 C ATOM 1714 NH1 ARG A 108 -25.609 -0.969 -0.380 1.00 35.00 N ATOM 1715 NH2 ARG A 108 -24.165 0.777 -0.637 1.00 4.30 N ATOM 0 H ARG A 108 -19.458 -3.521 -1.274 1.00 24.11 H new ATOM 0 HA ARG A 108 -19.005 -2.867 1.392 1.00 1.40 H new ATOM 0 HB2 ARG A 108 -21.373 -2.406 1.478 1.00 32.41 H new ATOM 0 HB3 ARG A 108 -20.695 -1.831 -0.032 1.00 32.41 H new ATOM 0 HG2 ARG A 108 -21.732 -3.586 -1.293 1.00 23.12 H new ATOM 0 HG3 ARG A 108 -22.114 -4.508 0.148 1.00 23.12 H new ATOM 0 HD2 ARG A 108 -24.058 -3.245 -0.920 1.00 14.40 H new ATOM 0 HD3 ARG A 108 -23.841 -3.007 0.803 1.00 14.40 H new ATOM 0 HE ARG A 108 -22.382 -0.951 -0.472 1.00 15.54 H new ATOM 0 HH11 ARG A 108 -25.788 -1.964 -0.245 1.00 35.00 H new ATOM 0 HH12 ARG A 108 -26.389 -0.315 -0.448 1.00 35.00 H new ATOM 0 HH21 ARG A 108 -23.217 1.147 -0.703 1.00 4.30 H new ATOM 0 HH22 ARG A 108 -24.964 1.408 -0.701 1.00 4.30 H new ATOM 1729 N LYS A 109 -20.135 -5.897 1.006 1.00 52.32 N ATOM 1730 CA LYS A 109 -20.347 -7.182 1.638 1.00 3.54 C ATOM 1731 C LYS A 109 -19.167 -7.520 2.524 1.00 73.14 C ATOM 1732 O LYS A 109 -19.317 -7.619 3.733 1.00 14.13 O ATOM 1733 CB LYS A 109 -20.558 -8.205 0.511 1.00 73.22 C ATOM 1734 CG LYS A 109 -20.569 -9.674 0.937 1.00 41.32 C ATOM 1735 CD LYS A 109 -20.793 -10.568 -0.281 1.00 72.43 C ATOM 1736 CE LYS A 109 -20.836 -12.026 0.166 1.00 15.14 C ATOM 1737 NZ LYS A 109 -20.868 -12.948 -0.982 1.00 0.31 N ATOM 0 H LYS A 109 -20.167 -5.950 -0.012 1.00 52.32 H new ATOM 0 HA LYS A 109 -21.223 -7.180 2.287 1.00 3.54 H new ATOM 0 HB2 LYS A 109 -21.504 -7.983 0.017 1.00 73.22 H new ATOM 0 HB3 LYS A 109 -19.771 -8.067 -0.231 1.00 73.22 H new ATOM 0 HG2 LYS A 109 -19.624 -9.929 1.417 1.00 41.32 H new ATOM 0 HG3 LYS A 109 -21.356 -9.842 1.672 1.00 41.32 H new ATOM 0 HD2 LYS A 109 -21.726 -10.300 -0.777 1.00 72.43 H new ATOM 0 HD3 LYS A 109 -19.993 -10.421 -1.006 1.00 72.43 H new ATOM 0 HE2 LYS A 109 -19.964 -12.243 0.783 1.00 15.14 H new ATOM 0 HE3 LYS A 109 -21.716 -12.190 0.789 1.00 15.14 H new ATOM 0 HZ1 LYS A 109 -20.897 -13.929 -0.639 1.00 0.31 H new ATOM 0 HZ2 LYS A 109 -21.713 -12.757 -1.557 1.00 0.31 H new ATOM 0 HZ3 LYS A 109 -20.016 -12.809 -1.562 1.00 0.31 H new ATOM 1751 N VAL A 110 -17.986 -7.643 1.930 1.00 3.11 N ATOM 1752 CA VAL A 110 -16.783 -8.059 2.643 1.00 44.41 C ATOM 1753 C VAL A 110 -16.522 -7.145 3.850 1.00 51.43 C ATOM 1754 O VAL A 110 -16.191 -7.645 4.922 1.00 15.22 O ATOM 1755 CB VAL A 110 -15.593 -8.120 1.671 1.00 2.34 C ATOM 1756 CG1 VAL A 110 -14.313 -8.569 2.386 1.00 3.52 C ATOM 1757 CG2 VAL A 110 -15.856 -9.105 0.525 1.00 64.02 C ATOM 0 H VAL A 110 -17.835 -7.457 0.939 1.00 3.11 H new ATOM 0 HA VAL A 110 -16.925 -9.063 3.043 1.00 44.41 H new ATOM 0 HB VAL A 110 -15.469 -7.112 1.276 1.00 2.34 H new ATOM 0 HG11 VAL A 110 -13.490 -8.602 1.672 1.00 3.52 H new ATOM 0 HG12 VAL A 110 -14.075 -7.864 3.182 1.00 3.52 H new ATOM 0 HG13 VAL A 110 -14.463 -9.561 2.813 1.00 3.52 H new ATOM 0 HG21 VAL A 110 -14.995 -9.124 -0.143 1.00 64.02 H new ATOM 0 HG22 VAL A 110 -16.020 -10.102 0.933 1.00 64.02 H new ATOM 0 HG23 VAL A 110 -16.740 -8.790 -0.030 1.00 64.02 H new ATOM 1767 N PHE A 111 -16.733 -5.828 3.712 1.00 23.23 N ATOM 1768 CA PHE A 111 -16.649 -4.893 4.837 1.00 1.33 C ATOM 1769 C PHE A 111 -17.559 -5.350 5.992 1.00 0.53 C ATOM 1770 O PHE A 111 -17.099 -5.489 7.126 1.00 63.31 O ATOM 1771 CB PHE A 111 -17.030 -3.470 4.397 1.00 41.54 C ATOM 1772 CG PHE A 111 -15.924 -2.578 3.869 1.00 35.41 C ATOM 1773 CD1 PHE A 111 -15.457 -2.723 2.551 1.00 4.10 C ATOM 1774 CD2 PHE A 111 -15.453 -1.513 4.661 1.00 73.24 C ATOM 1775 CE1 PHE A 111 -14.533 -1.805 2.023 1.00 64.42 C ATOM 1776 CE2 PHE A 111 -14.530 -0.596 4.136 1.00 0.51 C ATOM 1777 CZ PHE A 111 -14.074 -0.742 2.817 1.00 3.11 C ATOM 0 H PHE A 111 -16.965 -5.386 2.823 1.00 23.23 H new ATOM 0 HA PHE A 111 -15.617 -4.882 5.187 1.00 1.33 H new ATOM 0 HB2 PHE A 111 -17.794 -3.551 3.624 1.00 41.54 H new ATOM 0 HB3 PHE A 111 -17.490 -2.967 5.248 1.00 41.54 H new ATOM 0 HD1 PHE A 111 -15.809 -3.542 1.942 1.00 4.10 H new ATOM 0 HD2 PHE A 111 -15.804 -1.402 5.676 1.00 73.24 H new ATOM 0 HE1 PHE A 111 -14.177 -1.917 1.009 1.00 64.42 H new ATOM 0 HE2 PHE A 111 -14.171 0.220 4.746 1.00 0.51 H new ATOM 0 HZ PHE A 111 -13.367 -0.034 2.411 1.00 3.11 H new ATOM 1787 N VAL A 112 -18.844 -5.590 5.720 1.00 43.43 N ATOM 1788 CA VAL A 112 -19.829 -6.003 6.725 1.00 63.13 C ATOM 1789 C VAL A 112 -19.433 -7.340 7.320 1.00 51.14 C ATOM 1790 O VAL A 112 -19.510 -7.524 8.537 1.00 24.24 O ATOM 1791 CB VAL A 112 -21.253 -6.061 6.124 1.00 62.43 C ATOM 1792 CG1 VAL A 112 -22.327 -6.526 7.113 1.00 40.11 C ATOM 1793 CG2 VAL A 112 -21.663 -4.666 5.661 1.00 31.12 C ATOM 0 H VAL A 112 -19.236 -5.502 4.782 1.00 43.43 H new ATOM 0 HA VAL A 112 -19.843 -5.258 7.521 1.00 63.13 H new ATOM 0 HB VAL A 112 -21.198 -6.783 5.310 1.00 62.43 H new ATOM 0 HG11 VAL A 112 -23.297 -6.540 6.616 1.00 40.11 H new ATOM 0 HG12 VAL A 112 -22.086 -7.528 7.467 1.00 40.11 H new ATOM 0 HG13 VAL A 112 -22.363 -5.841 7.960 1.00 40.11 H new ATOM 0 HG21 VAL A 112 -22.666 -4.704 5.237 1.00 31.12 H new ATOM 0 HG22 VAL A 112 -21.654 -3.983 6.511 1.00 31.12 H new ATOM 0 HG23 VAL A 112 -20.962 -4.313 4.904 1.00 31.12 H new ATOM 1803 N ASP A 113 -18.970 -8.246 6.470 1.00 61.45 N ATOM 1804 CA ASP A 113 -18.735 -9.628 6.825 1.00 63.32 C ATOM 1805 C ASP A 113 -17.583 -9.687 7.820 1.00 64.03 C ATOM 1806 O ASP A 113 -17.637 -10.447 8.787 1.00 73.43 O ATOM 1807 CB ASP A 113 -18.421 -10.418 5.551 1.00 71.12 C ATOM 1808 CG ASP A 113 -19.634 -10.720 4.666 1.00 73.44 C ATOM 1809 OD1 ASP A 113 -20.787 -10.448 5.072 1.00 73.23 O ATOM 1810 OD2 ASP A 113 -19.400 -11.207 3.538 1.00 53.15 O ATOM 0 H ASP A 113 -18.745 -8.032 5.498 1.00 61.45 H new ATOM 0 HA ASP A 113 -19.615 -10.070 7.292 1.00 63.32 H new ATOM 0 HB2 ASP A 113 -17.691 -9.859 4.965 1.00 71.12 H new ATOM 0 HB3 ASP A 113 -17.950 -11.360 5.832 1.00 71.12 H new ATOM 1815 N ALA A 114 -16.573 -8.832 7.627 1.00 32.10 N ATOM 1816 CA ALA A 114 -15.444 -8.678 8.527 1.00 62.42 C ATOM 1817 C ALA A 114 -15.827 -7.970 9.828 1.00 42.53 C ATOM 1818 O ALA A 114 -15.164 -8.163 10.848 1.00 60.11 O ATOM 1819 CB ALA A 114 -14.346 -7.900 7.801 1.00 23.13 C ATOM 0 H ALA A 114 -16.525 -8.215 6.816 1.00 32.10 H new ATOM 0 HA ALA A 114 -15.089 -9.670 8.807 1.00 62.42 H new ATOM 0 HB1 ALA A 114 -13.490 -7.775 8.464 1.00 23.13 H new ATOM 0 HB2 ALA A 114 -14.039 -8.449 6.911 1.00 23.13 H new ATOM 0 HB3 ALA A 114 -14.726 -6.920 7.510 1.00 23.13 H new ATOM 1825 N GLY A 115 -16.887 -7.164 9.818 1.00 12.33 N ATOM 1826 CA GLY A 115 -17.366 -6.442 10.986 1.00 64.42 C ATOM 1827 C GLY A 115 -17.245 -4.943 10.793 1.00 40.35 C ATOM 1828 O GLY A 115 -16.615 -4.263 11.603 1.00 0.41 O ATOM 0 H GLY A 115 -17.444 -6.994 8.981 1.00 12.33 H new ATOM 0 HA2 GLY A 115 -18.407 -6.704 11.177 1.00 64.42 H new ATOM 0 HA3 GLY A 115 -16.795 -6.745 11.864 1.00 64.42 H new ATOM 1832 N VAL A 116 -17.857 -4.425 9.729 1.00 21.11 N ATOM 1833 CA VAL A 116 -18.078 -2.997 9.555 1.00 40.41 C ATOM 1834 C VAL A 116 -19.570 -2.732 9.474 1.00 43.44 C ATOM 1835 O VAL A 116 -20.291 -3.353 8.687 1.00 72.41 O ATOM 1836 CB VAL A 116 -17.233 -2.401 8.413 1.00 4.50 C ATOM 1837 CG1 VAL A 116 -17.462 -0.883 8.300 1.00 61.24 C ATOM 1838 CG2 VAL A 116 -15.733 -2.658 8.642 1.00 35.04 C ATOM 0 H VAL A 116 -18.215 -4.992 8.960 1.00 21.11 H new ATOM 0 HA VAL A 116 -17.713 -2.455 10.427 1.00 40.41 H new ATOM 0 HB VAL A 116 -17.546 -2.889 7.490 1.00 4.50 H new ATOM 0 HG11 VAL A 116 -16.856 -0.483 7.487 1.00 61.24 H new ATOM 0 HG12 VAL A 116 -18.515 -0.688 8.097 1.00 61.24 H new ATOM 0 HG13 VAL A 116 -17.178 -0.402 9.236 1.00 61.24 H new ATOM 0 HG21 VAL A 116 -15.160 -2.227 7.821 1.00 35.04 H new ATOM 0 HG22 VAL A 116 -15.424 -2.198 9.581 1.00 35.04 H new ATOM 0 HG23 VAL A 116 -15.550 -3.732 8.687 1.00 35.04 H new ATOM 1848 N LYS A 117 -20.052 -1.824 10.323 1.00 71.03 N ATOM 1849 CA LYS A 117 -21.440 -1.405 10.310 1.00 74.45 C ATOM 1850 C LYS A 117 -21.807 -0.942 8.918 1.00 0.53 C ATOM 1851 O LYS A 117 -21.144 -0.071 8.350 1.00 24.23 O ATOM 1852 CB LYS A 117 -21.691 -0.305 11.339 1.00 23.21 C ATOM 1853 CG LYS A 117 -22.054 -0.952 12.669 1.00 31.24 C ATOM 1854 CD LYS A 117 -22.245 0.036 13.823 1.00 3.54 C ATOM 1855 CE LYS A 117 -20.978 0.274 14.652 1.00 2.33 C ATOM 1856 NZ LYS A 117 -19.941 1.039 13.928 1.00 34.24 N ATOM 0 H LYS A 117 -19.486 -1.363 11.036 1.00 71.03 H new ATOM 0 HA LYS A 117 -22.071 -2.251 10.583 1.00 74.45 H new ATOM 0 HB2 LYS A 117 -20.803 0.317 11.451 1.00 23.21 H new ATOM 0 HB3 LYS A 117 -22.497 0.348 11.004 1.00 23.21 H new ATOM 0 HG2 LYS A 117 -22.973 -1.525 12.542 1.00 31.24 H new ATOM 0 HG3 LYS A 117 -21.271 -1.661 12.940 1.00 31.24 H new ATOM 0 HD2 LYS A 117 -22.588 0.989 13.420 1.00 3.54 H new ATOM 0 HD3 LYS A 117 -23.033 -0.334 14.479 1.00 3.54 H new ATOM 0 HE2 LYS A 117 -21.244 0.809 15.564 1.00 2.33 H new ATOM 0 HE3 LYS A 117 -20.565 -0.688 14.955 1.00 2.33 H new ATOM 0 HZ1 LYS A 117 -19.358 1.565 14.610 1.00 34.24 H new ATOM 0 HZ2 LYS A 117 -19.338 0.384 13.390 1.00 34.24 H new ATOM 0 HZ3 LYS A 117 -20.396 1.707 13.273 1.00 34.24 H new ATOM 1870 N GLY A 118 -22.893 -1.494 8.393 1.00 44.21 N ATOM 1871 CA GLY A 118 -23.453 -0.990 7.164 1.00 60.23 C ATOM 1872 C GLY A 118 -23.953 0.437 7.353 1.00 22.10 C ATOM 1873 O GLY A 118 -24.019 1.153 6.358 1.00 35.33 O ATOM 0 H GLY A 118 -23.394 -2.283 8.801 1.00 44.21 H new ATOM 0 HA2 GLY A 118 -22.700 -1.017 6.376 1.00 60.23 H new ATOM 0 HA3 GLY A 118 -24.274 -1.630 6.842 1.00 60.23 H new ATOM 1877 N GLU A 119 -24.234 0.891 8.589 1.00 61.11 N ATOM 1878 CA GLU A 119 -24.674 2.273 8.775 1.00 44.31 C ATOM 1879 C GLU A 119 -23.504 3.208 8.472 1.00 63.45 C ATOM 1880 O GLU A 119 -23.703 4.262 7.873 1.00 41.54 O ATOM 1881 CB GLU A 119 -25.292 2.521 10.171 1.00 75.41 C ATOM 1882 CG GLU A 119 -24.257 2.869 11.250 1.00 31.33 C ATOM 1883 CD GLU A 119 -24.828 3.069 12.652 1.00 71.45 C ATOM 1884 OE1 GLU A 119 -25.144 2.040 13.306 1.00 21.34 O ATOM 1885 OE2 GLU A 119 -24.881 4.219 13.134 1.00 23.22 O ATOM 0 H GLU A 119 -24.166 0.337 9.443 1.00 61.11 H new ATOM 0 HA GLU A 119 -25.483 2.483 8.075 1.00 44.31 H new ATOM 0 HB2 GLU A 119 -26.016 3.333 10.099 1.00 75.41 H new ATOM 0 HB3 GLU A 119 -25.840 1.631 10.479 1.00 75.41 H new ATOM 0 HG2 GLU A 119 -23.512 2.074 11.287 1.00 31.33 H new ATOM 0 HG3 GLU A 119 -23.737 3.779 10.953 1.00 31.33 H new ATOM 1892 N ASP A 120 -22.296 2.788 8.865 1.00 0.40 N ATOM 1893 CA ASP A 120 -21.074 3.566 8.845 1.00 60.25 C ATOM 1894 C ASP A 120 -20.600 3.611 7.419 1.00 3.54 C ATOM 1895 O ASP A 120 -20.256 4.675 6.925 1.00 11.11 O ATOM 1896 CB ASP A 120 -19.991 2.895 9.703 1.00 72.12 C ATOM 1897 CG ASP A 120 -19.762 3.627 11.015 1.00 62.33 C ATOM 1898 OD1 ASP A 120 -19.293 4.784 10.983 1.00 42.51 O ATOM 1899 OD2 ASP A 120 -20.007 3.007 12.075 1.00 20.23 O ATOM 0 H ASP A 120 -22.148 1.844 9.223 1.00 0.40 H new ATOM 0 HA ASP A 120 -21.261 4.564 9.243 1.00 60.25 H new ATOM 0 HB2 ASP A 120 -20.280 1.865 9.910 1.00 72.12 H new ATOM 0 HB3 ASP A 120 -19.057 2.857 9.142 1.00 72.12 H new ATOM 1904 N TYR A 121 -20.614 2.460 6.746 1.00 61.01 N ATOM 1905 CA TYR A 121 -20.290 2.370 5.346 1.00 40.42 C ATOM 1906 C TYR A 121 -21.190 3.305 4.556 1.00 72.44 C ATOM 1907 O TYR A 121 -20.698 4.172 3.837 1.00 14.53 O ATOM 1908 CB TYR A 121 -20.423 0.920 4.878 1.00 43.45 C ATOM 1909 CG TYR A 121 -19.867 0.621 3.493 1.00 43.22 C ATOM 1910 CD1 TYR A 121 -20.527 1.071 2.331 1.00 0.30 C ATOM 1911 CD2 TYR A 121 -18.714 -0.176 3.362 1.00 1.14 C ATOM 1912 CE1 TYR A 121 -20.023 0.763 1.055 1.00 44.31 C ATOM 1913 CE2 TYR A 121 -18.218 -0.501 2.088 1.00 51.52 C ATOM 1914 CZ TYR A 121 -18.859 -0.021 0.925 1.00 51.22 C ATOM 1915 OH TYR A 121 -18.373 -0.321 -0.309 1.00 23.30 O ATOM 0 H TYR A 121 -20.854 1.565 7.172 1.00 61.01 H new ATOM 0 HA TYR A 121 -19.258 2.678 5.179 1.00 40.42 H new ATOM 0 HB2 TYR A 121 -19.918 0.277 5.599 1.00 43.45 H new ATOM 0 HB3 TYR A 121 -21.478 0.648 4.892 1.00 43.45 H new ATOM 0 HD1 TYR A 121 -21.429 1.658 2.422 1.00 0.30 H new ATOM 0 HD2 TYR A 121 -18.208 -0.539 4.245 1.00 1.14 H new ATOM 0 HE1 TYR A 121 -20.529 1.128 0.173 1.00 44.31 H new ATOM 0 HE2 TYR A 121 -17.340 -1.123 1.998 1.00 51.52 H new ATOM 0 HH TYR A 121 -18.071 0.500 -0.750 1.00 23.30 H new ATOM 1925 N ASP A 122 -22.508 3.120 4.679 1.00 4.30 N ATOM 1926 CA ASP A 122 -23.474 3.831 3.852 1.00 21.21 C ATOM 1927 C ASP A 122 -23.462 5.326 4.154 1.00 35.34 C ATOM 1928 O ASP A 122 -23.724 6.121 3.259 1.00 72.04 O ATOM 1929 CB ASP A 122 -24.879 3.242 4.048 1.00 31.40 C ATOM 1930 CG ASP A 122 -25.736 3.309 2.787 1.00 3.22 C ATOM 1931 OD1 ASP A 122 -25.241 2.903 1.704 1.00 15.24 O ATOM 1932 OD2 ASP A 122 -26.950 3.574 2.909 1.00 44.21 O ATOM 0 H ASP A 122 -22.928 2.477 5.351 1.00 4.30 H new ATOM 0 HA ASP A 122 -23.189 3.704 2.808 1.00 21.21 H new ATOM 0 HB2 ASP A 122 -24.790 2.203 4.365 1.00 31.40 H new ATOM 0 HB3 ASP A 122 -25.383 3.779 4.852 1.00 31.40 H new ATOM 1937 N ALA A 123 -23.116 5.716 5.388 1.00 42.41 N ATOM 1938 CA ALA A 123 -22.942 7.107 5.780 1.00 3.31 C ATOM 1939 C ALA A 123 -21.642 7.664 5.215 1.00 71.13 C ATOM 1940 O ALA A 123 -21.652 8.594 4.406 1.00 31.31 O ATOM 1941 CB ALA A 123 -22.951 7.228 7.310 1.00 0.20 C ATOM 0 H ALA A 123 -22.948 5.058 6.149 1.00 42.41 H new ATOM 0 HA ALA A 123 -23.770 7.688 5.374 1.00 3.31 H new ATOM 0 HB1 ALA A 123 -22.820 8.272 7.593 1.00 0.20 H new ATOM 0 HB2 ALA A 123 -23.902 6.863 7.698 1.00 0.20 H new ATOM 0 HB3 ALA A 123 -22.137 6.634 7.727 1.00 0.20 H new ATOM 1947 N ALA A 124 -20.518 7.103 5.659 1.00 15.24 N ATOM 1948 CA ALA A 124 -19.189 7.594 5.376 1.00 64.15 C ATOM 1949 C ALA A 124 -18.972 7.717 3.870 1.00 34.42 C ATOM 1950 O ALA A 124 -18.392 8.705 3.439 1.00 44.51 O ATOM 1951 CB ALA A 124 -18.136 6.722 6.058 1.00 2.53 C ATOM 0 H ALA A 124 -20.518 6.267 6.244 1.00 15.24 H new ATOM 0 HA ALA A 124 -19.082 8.596 5.792 1.00 64.15 H new ATOM 0 HB1 ALA A 124 -17.142 7.108 5.833 1.00 2.53 H new ATOM 0 HB2 ALA A 124 -18.295 6.736 7.136 1.00 2.53 H new ATOM 0 HB3 ALA A 124 -18.219 5.698 5.692 1.00 2.53 H new ATOM 1957 N TRP A 125 -19.520 6.802 3.063 1.00 35.41 N ATOM 1958 CA TRP A 125 -19.444 6.826 1.605 1.00 23.34 C ATOM 1959 C TRP A 125 -19.737 8.212 1.024 1.00 64.23 C ATOM 1960 O TRP A 125 -19.038 8.669 0.111 1.00 73.31 O ATOM 1961 CB TRP A 125 -20.425 5.792 1.042 1.00 41.31 C ATOM 1962 CG TRP A 125 -20.272 5.481 -0.408 1.00 32.34 C ATOM 1963 CD1 TRP A 125 -21.012 5.964 -1.424 1.00 75.12 C ATOM 1964 CD2 TRP A 125 -19.317 4.577 -1.011 1.00 34.14 C ATOM 1965 NE1 TRP A 125 -20.581 5.402 -2.612 1.00 40.15 N ATOM 1966 CE2 TRP A 125 -19.507 4.558 -2.420 1.00 23.43 C ATOM 1967 CE3 TRP A 125 -18.315 3.762 -0.477 1.00 24.43 C ATOM 1968 CZ2 TRP A 125 -18.697 3.784 -3.268 1.00 63.34 C ATOM 1969 CZ3 TRP A 125 -17.478 3.013 -1.317 1.00 34.43 C ATOM 1970 CH2 TRP A 125 -17.651 3.023 -2.716 1.00 2.43 C ATOM 0 H TRP A 125 -20.043 6.003 3.420 1.00 35.41 H new ATOM 0 HA TRP A 125 -18.423 6.579 1.314 1.00 23.34 H new ATOM 0 HB2 TRP A 125 -20.314 4.867 1.607 1.00 41.31 H new ATOM 0 HB3 TRP A 125 -21.440 6.150 1.213 1.00 41.31 H new ATOM 0 HD1 TRP A 125 -21.816 6.678 -1.327 1.00 75.12 H new ATOM 0 HE1 TRP A 125 -21.006 5.589 -3.520 1.00 40.15 H new ATOM 0 HE3 TRP A 125 -18.184 3.708 0.594 1.00 24.43 H new ATOM 0 HZ2 TRP A 125 -18.876 3.774 -4.333 1.00 63.34 H new ATOM 0 HZ3 TRP A 125 -16.687 2.418 -0.884 1.00 34.43 H new ATOM 0 HH2 TRP A 125 -16.990 2.455 -3.354 1.00 2.43 H new ATOM 1981 N ASN A 126 -20.757 8.894 1.552 1.00 52.21 N ATOM 1982 CA ASN A 126 -21.187 10.217 1.111 1.00 44.23 C ATOM 1983 C ASN A 126 -20.792 11.330 2.091 1.00 52.21 C ATOM 1984 O ASN A 126 -21.111 12.492 1.830 1.00 41.22 O ATOM 1985 CB ASN A 126 -22.694 10.235 0.812 1.00 54.31 C ATOM 1986 CG ASN A 126 -23.559 9.964 2.032 1.00 64.05 C ATOM 1987 OD1 ASN A 126 -24.020 10.880 2.708 1.00 41.21 O ATOM 1988 ND2 ASN A 126 -23.842 8.707 2.303 1.00 20.13 N ATOM 0 H ASN A 126 -21.320 8.528 2.320 1.00 52.21 H new ATOM 0 HA ASN A 126 -20.654 10.428 0.184 1.00 44.23 H new ATOM 0 HB2 ASN A 126 -22.962 11.206 0.395 1.00 54.31 H new ATOM 0 HB3 ASN A 126 -22.913 9.489 0.048 1.00 54.31 H new ATOM 0 HD21 ASN A 126 -24.454 8.480 3.086 1.00 20.13 H new ATOM 0 HD22 ASN A 126 -23.449 7.961 1.729 1.00 20.13 H new ATOM 1995 N SER A 127 -20.105 11.014 3.187 1.00 62.25 N ATOM 1996 CA SER A 127 -19.643 11.955 4.195 1.00 51.24 C ATOM 1997 C SER A 127 -18.396 12.682 3.692 1.00 43.23 C ATOM 1998 O SER A 127 -17.576 12.105 2.969 1.00 54.31 O ATOM 1999 CB SER A 127 -19.322 11.148 5.457 1.00 33.32 C ATOM 2000 OG SER A 127 -18.869 11.928 6.539 1.00 4.10 O ATOM 0 H SER A 127 -19.846 10.051 3.402 1.00 62.25 H new ATOM 0 HA SER A 127 -20.404 12.706 4.408 1.00 51.24 H new ATOM 0 HB2 SER A 127 -20.215 10.604 5.764 1.00 33.32 H new ATOM 0 HB3 SER A 127 -18.563 10.404 5.216 1.00 33.32 H new ATOM 0 HG SER A 127 -18.686 11.347 7.307 1.00 4.10 H new ATOM 2006 N PHE A 128 -18.203 13.923 4.143 1.00 52.41 N ATOM 2007 CA PHE A 128 -17.049 14.754 3.807 1.00 32.44 C ATOM 2008 C PHE A 128 -15.746 14.053 4.173 1.00 35.12 C ATOM 2009 O PHE A 128 -14.769 14.196 3.448 1.00 41.35 O ATOM 2010 CB PHE A 128 -17.164 16.082 4.578 1.00 2.54 C ATOM 2011 CG PHE A 128 -16.261 17.225 4.148 1.00 2.40 C ATOM 2012 CD1 PHE A 128 -14.871 17.120 4.292 1.00 63.44 C ATOM 2013 CD2 PHE A 128 -16.805 18.426 3.657 1.00 62.01 C ATOM 2014 CE1 PHE A 128 -14.025 18.164 3.881 1.00 43.14 C ATOM 2015 CE2 PHE A 128 -15.966 19.482 3.266 1.00 23.22 C ATOM 2016 CZ PHE A 128 -14.571 19.353 3.375 1.00 12.20 C ATOM 0 H PHE A 128 -18.862 14.388 4.767 1.00 52.41 H new ATOM 0 HA PHE A 128 -17.038 14.938 2.733 1.00 32.44 H new ATOM 0 HB2 PHE A 128 -18.196 16.424 4.506 1.00 2.54 H new ATOM 0 HB3 PHE A 128 -16.969 15.877 5.631 1.00 2.54 H new ATOM 0 HD1 PHE A 128 -14.445 16.226 4.724 1.00 63.44 H new ATOM 0 HD2 PHE A 128 -17.877 18.537 3.580 1.00 62.01 H new ATOM 0 HE1 PHE A 128 -12.953 18.051 3.955 1.00 43.14 H new ATOM 0 HE2 PHE A 128 -16.394 20.396 2.881 1.00 23.22 H new ATOM 0 HZ PHE A 128 -13.924 20.163 3.072 1.00 12.20 H new ATOM 2026 N VAL A 129 -15.712 13.286 5.265 1.00 43.24 N ATOM 2027 CA VAL A 129 -14.507 12.606 5.733 1.00 51.35 C ATOM 2028 C VAL A 129 -13.892 11.811 4.588 1.00 34.40 C ATOM 2029 O VAL A 129 -12.724 11.983 4.244 1.00 1.20 O ATOM 2030 CB VAL A 129 -14.855 11.688 6.916 1.00 31.21 C ATOM 2031 CG1 VAL A 129 -13.583 11.048 7.475 1.00 23.12 C ATOM 2032 CG2 VAL A 129 -15.580 12.466 8.015 1.00 23.31 C ATOM 0 H VAL A 129 -16.529 13.119 5.853 1.00 43.24 H new ATOM 0 HA VAL A 129 -13.778 13.341 6.073 1.00 51.35 H new ATOM 0 HB VAL A 129 -15.521 10.903 6.557 1.00 31.21 H new ATOM 0 HG11 VAL A 129 -13.840 10.400 8.313 1.00 23.12 H new ATOM 0 HG12 VAL A 129 -13.099 10.459 6.696 1.00 23.12 H new ATOM 0 HG13 VAL A 129 -12.903 11.828 7.816 1.00 23.12 H new ATOM 0 HG21 VAL A 129 -15.816 11.795 8.841 1.00 23.31 H new ATOM 0 HG22 VAL A 129 -14.939 13.272 8.373 1.00 23.31 H new ATOM 0 HG23 VAL A 129 -16.503 12.887 7.615 1.00 23.31 H new ATOM 2042 N VAL A 130 -14.712 10.976 3.952 1.00 20.44 N ATOM 2043 CA VAL A 130 -14.304 10.184 2.815 1.00 21.00 C ATOM 2044 C VAL A 130 -13.915 11.087 1.657 1.00 3.52 C ATOM 2045 O VAL A 130 -12.896 10.869 1.006 1.00 72.23 O ATOM 2046 CB VAL A 130 -15.445 9.214 2.471 1.00 60.45 C ATOM 2047 CG1 VAL A 130 -15.356 8.577 1.078 1.00 22.23 C ATOM 2048 CG2 VAL A 130 -15.472 8.109 3.545 1.00 40.23 C ATOM 0 H VAL A 130 -15.686 10.836 4.222 1.00 20.44 H new ATOM 0 HA VAL A 130 -13.417 9.594 3.045 1.00 21.00 H new ATOM 0 HB VAL A 130 -16.363 9.801 2.456 1.00 60.45 H new ATOM 0 HG11 VAL A 130 -16.204 7.909 0.928 1.00 22.23 H new ATOM 0 HG12 VAL A 130 -15.371 9.359 0.319 1.00 22.23 H new ATOM 0 HG13 VAL A 130 -14.429 8.010 0.996 1.00 22.23 H new ATOM 0 HG21 VAL A 130 -16.275 7.406 3.324 1.00 40.23 H new ATOM 0 HG22 VAL A 130 -14.518 7.581 3.548 1.00 40.23 H new ATOM 0 HG23 VAL A 130 -15.642 8.557 4.524 1.00 40.23 H new ATOM 2058 N LYS A 131 -14.729 12.101 1.378 1.00 73.35 N ATOM 2059 CA LYS A 131 -14.526 13.003 0.257 1.00 4.33 C ATOM 2060 C LYS A 131 -13.149 13.670 0.328 1.00 55.31 C ATOM 2061 O LYS A 131 -12.426 13.696 -0.672 1.00 34.12 O ATOM 2062 CB LYS A 131 -15.670 14.015 0.231 1.00 51.22 C ATOM 2063 CG LYS A 131 -17.092 13.418 0.164 1.00 4.20 C ATOM 2064 CD LYS A 131 -17.690 13.274 -1.233 1.00 44.52 C ATOM 2065 CE LYS A 131 -17.217 11.971 -1.874 1.00 52.35 C ATOM 2066 NZ LYS A 131 -18.033 10.794 -1.487 1.00 61.35 N ATOM 0 H LYS A 131 -15.557 12.319 1.933 1.00 73.35 H new ATOM 0 HA LYS A 131 -14.538 12.445 -0.679 1.00 4.33 H new ATOM 0 HB2 LYS A 131 -15.599 14.638 1.122 1.00 51.22 H new ATOM 0 HB3 LYS A 131 -15.531 14.671 -0.628 1.00 51.22 H new ATOM 0 HG2 LYS A 131 -17.075 12.435 0.634 1.00 4.20 H new ATOM 0 HG3 LYS A 131 -17.756 14.044 0.760 1.00 4.20 H new ATOM 0 HD2 LYS A 131 -18.778 13.285 -1.174 1.00 44.52 H new ATOM 0 HD3 LYS A 131 -17.395 14.121 -1.852 1.00 44.52 H new ATOM 0 HE2 LYS A 131 -17.240 12.079 -2.958 1.00 52.35 H new ATOM 0 HE3 LYS A 131 -16.179 11.792 -1.593 1.00 52.35 H new ATOM 0 HZ1 LYS A 131 -17.424 9.952 -1.433 1.00 61.35 H new ATOM 0 HZ2 LYS A 131 -18.471 10.965 -0.559 1.00 61.35 H new ATOM 0 HZ3 LYS A 131 -18.776 10.638 -2.197 1.00 61.35 H new ATOM 2080 N SER A 132 -12.769 14.170 1.498 1.00 35.13 N ATOM 2081 CA SER A 132 -11.470 14.753 1.761 1.00 2.52 C ATOM 2082 C SER A 132 -10.385 13.686 1.687 1.00 32.04 C ATOM 2083 O SER A 132 -9.391 13.890 0.991 1.00 62.21 O ATOM 2084 CB SER A 132 -11.520 15.428 3.133 1.00 4.44 C ATOM 2085 OG SER A 132 -10.414 16.286 3.311 1.00 33.14 O ATOM 0 H SER A 132 -13.382 14.178 2.314 1.00 35.13 H new ATOM 0 HA SER A 132 -11.224 15.501 1.007 1.00 2.52 H new ATOM 0 HB2 SER A 132 -12.445 15.996 3.230 1.00 4.44 H new ATOM 0 HB3 SER A 132 -11.527 14.670 3.916 1.00 4.44 H new ATOM 0 HG SER A 132 -10.466 16.709 4.194 1.00 33.14 H new ATOM 2091 N LEU A 133 -10.584 12.541 2.354 1.00 42.51 N ATOM 2092 CA LEU A 133 -9.616 11.458 2.354 1.00 35.40 C ATOM 2093 C LEU A 133 -9.270 11.071 0.930 1.00 44.41 C ATOM 2094 O LEU A 133 -8.089 11.019 0.636 1.00 11.11 O ATOM 2095 CB LEU A 133 -10.099 10.231 3.149 1.00 60.34 C ATOM 2096 CG LEU A 133 -9.627 10.230 4.613 1.00 64.02 C ATOM 2097 CD1 LEU A 133 -10.378 9.153 5.401 1.00 34.33 C ATOM 2098 CD2 LEU A 133 -8.119 9.943 4.709 1.00 12.44 C ATOM 0 H LEU A 133 -11.421 12.349 2.904 1.00 42.51 H new ATOM 0 HA LEU A 133 -8.721 11.823 2.858 1.00 35.40 H new ATOM 0 HB2 LEU A 133 -11.188 10.197 3.126 1.00 60.34 H new ATOM 0 HB3 LEU A 133 -9.742 9.325 2.659 1.00 60.34 H new ATOM 0 HG LEU A 133 -9.830 11.217 5.029 1.00 64.02 H new ATOM 0 HD11 LEU A 133 -10.039 9.157 6.437 1.00 34.33 H new ATOM 0 HD12 LEU A 133 -11.448 9.358 5.368 1.00 34.33 H new ATOM 0 HD13 LEU A 133 -10.182 8.176 4.959 1.00 34.33 H new ATOM 0 HD21 LEU A 133 -7.813 9.948 5.755 1.00 12.44 H new ATOM 0 HD22 LEU A 133 -7.906 8.967 4.274 1.00 12.44 H new ATOM 0 HD23 LEU A 133 -7.567 10.710 4.166 1.00 12.44 H new ATOM 2110 N VAL A 134 -10.234 10.821 0.041 1.00 20.01 N ATOM 2111 CA VAL A 134 -9.966 10.464 -1.355 1.00 41.11 C ATOM 2112 C VAL A 134 -8.950 11.437 -1.958 1.00 14.34 C ATOM 2113 O VAL A 134 -7.923 11.000 -2.473 1.00 41.15 O ATOM 2114 CB VAL A 134 -11.289 10.422 -2.145 1.00 62.35 C ATOM 2115 CG1 VAL A 134 -11.091 10.361 -3.667 1.00 1.40 C ATOM 2116 CG2 VAL A 134 -12.116 9.195 -1.729 1.00 51.44 C ATOM 0 H VAL A 134 -11.227 10.861 0.270 1.00 20.01 H new ATOM 0 HA VAL A 134 -9.525 9.469 -1.409 1.00 41.11 H new ATOM 0 HB VAL A 134 -11.804 11.352 -1.907 1.00 62.35 H new ATOM 0 HG11 VAL A 134 -12.063 10.334 -4.160 1.00 1.40 H new ATOM 0 HG12 VAL A 134 -10.541 11.242 -3.998 1.00 1.40 H new ATOM 0 HG13 VAL A 134 -10.528 9.464 -3.925 1.00 1.40 H new ATOM 0 HG21 VAL A 134 -13.048 9.176 -2.294 1.00 51.44 H new ATOM 0 HG22 VAL A 134 -11.549 8.287 -1.935 1.00 51.44 H new ATOM 0 HG23 VAL A 134 -12.338 9.250 -0.663 1.00 51.44 H new ATOM 2126 N ALA A 135 -9.205 12.742 -1.835 1.00 71.32 N ATOM 2127 CA ALA A 135 -8.355 13.778 -2.408 1.00 44.11 C ATOM 2128 C ALA A 135 -6.901 13.728 -1.904 1.00 53.54 C ATOM 2129 O ALA A 135 -6.005 14.144 -2.639 1.00 15.42 O ATOM 2130 CB ALA A 135 -8.989 15.141 -2.131 1.00 71.25 C ATOM 0 H ALA A 135 -10.013 13.107 -1.331 1.00 71.32 H new ATOM 0 HA ALA A 135 -8.291 13.601 -3.482 1.00 44.11 H new ATOM 0 HB1 ALA A 135 -8.363 15.926 -2.555 1.00 71.25 H new ATOM 0 HB2 ALA A 135 -9.979 15.181 -2.586 1.00 71.25 H new ATOM 0 HB3 ALA A 135 -9.078 15.289 -1.055 1.00 71.25 H new ATOM 2136 N GLN A 136 -6.645 13.219 -0.693 1.00 44.42 N ATOM 2137 CA GLN A 136 -5.290 12.985 -0.196 1.00 63.43 C ATOM 2138 C GLN A 136 -4.514 11.943 -0.994 1.00 31.21 C ATOM 2139 O GLN A 136 -3.294 12.068 -1.100 1.00 14.31 O ATOM 2140 CB GLN A 136 -5.314 12.612 1.302 1.00 74.13 C ATOM 2141 CG GLN A 136 -5.424 13.923 2.056 1.00 71.33 C ATOM 2142 CD GLN A 136 -5.413 13.826 3.579 1.00 51.55 C ATOM 2143 OE1 GLN A 136 -6.396 13.443 4.217 1.00 74.03 O ATOM 2144 NE2 GLN A 136 -4.338 14.255 4.218 1.00 63.42 N ATOM 0 H GLN A 136 -7.376 12.958 -0.031 1.00 44.42 H new ATOM 0 HA GLN A 136 -4.757 13.926 -0.328 1.00 63.43 H new ATOM 0 HB2 GLN A 136 -6.157 11.959 1.528 1.00 74.13 H new ATOM 0 HB3 GLN A 136 -4.409 12.074 1.585 1.00 74.13 H new ATOM 0 HG2 GLN A 136 -4.600 14.566 1.747 1.00 71.33 H new ATOM 0 HG3 GLN A 136 -6.346 14.418 1.751 1.00 71.33 H new ATOM 0 HE21 GLN A 136 -3.524 14.572 3.691 1.00 63.42 H new ATOM 0 HE22 GLN A 136 -4.322 14.269 5.238 1.00 63.42 H new ATOM 2153 N GLN A 137 -5.185 10.927 -1.534 1.00 1.53 N ATOM 2154 CA GLN A 137 -4.549 9.909 -2.356 1.00 54.34 C ATOM 2155 C GLN A 137 -4.543 10.291 -3.823 1.00 34.44 C ATOM 2156 O GLN A 137 -3.568 9.973 -4.488 1.00 73.11 O ATOM 2157 CB GLN A 137 -5.276 8.579 -2.239 1.00 33.42 C ATOM 2158 CG GLN A 137 -5.096 7.951 -0.860 1.00 75.14 C ATOM 2159 CD GLN A 137 -5.874 8.646 0.236 1.00 60.01 C ATOM 2160 OE1 GLN A 137 -7.179 8.552 0.169 1.00 15.21 O flip ATOM 2161 NE2 GLN A 137 -5.339 9.193 1.191 1.00 13.54 N flip ATOM 0 H GLN A 137 -6.188 10.790 -1.411 1.00 1.53 H new ATOM 0 HA GLN A 137 -3.526 9.823 -1.990 1.00 54.34 H new ATOM 0 HB2 GLN A 137 -6.338 8.727 -2.434 1.00 33.42 H new ATOM 0 HB3 GLN A 137 -4.904 7.894 -3.001 1.00 33.42 H new ATOM 0 HG2 GLN A 137 -5.404 6.906 -0.904 1.00 75.14 H new ATOM 0 HG3 GLN A 137 -4.037 7.961 -0.603 1.00 75.14 H new ATOM 0 HE21 GLN A 137 -4.322 9.262 1.235 1.00 13.54 H new ATOM 0 HE22 GLN A 137 -5.910 9.580 1.943 1.00 13.54 H new ATOM 2170 N GLU A 138 -5.585 10.952 -4.334 1.00 2.44 N ATOM 2171 CA GLU A 138 -5.601 11.395 -5.729 1.00 22.34 C ATOM 2172 C GLU A 138 -4.374 12.275 -5.960 1.00 21.05 C ATOM 2173 O GLU A 138 -3.522 11.971 -6.795 1.00 3.45 O ATOM 2174 CB GLU A 138 -6.917 12.113 -6.071 1.00 51.34 C ATOM 2175 CG GLU A 138 -8.122 11.173 -5.910 1.00 62.22 C ATOM 2176 CD GLU A 138 -9.279 11.506 -6.849 1.00 23.02 C ATOM 2177 OE1 GLU A 138 -10.048 12.459 -6.579 1.00 63.12 O ATOM 2178 OE2 GLU A 138 -9.528 10.739 -7.809 1.00 23.10 O ATOM 0 H GLU A 138 -6.424 11.191 -3.805 1.00 2.44 H new ATOM 0 HA GLU A 138 -5.553 10.537 -6.400 1.00 22.34 H new ATOM 0 HB2 GLU A 138 -7.040 12.980 -5.422 1.00 51.34 H new ATOM 0 HB3 GLU A 138 -6.876 12.484 -7.095 1.00 51.34 H new ATOM 0 HG2 GLU A 138 -7.800 10.147 -6.091 1.00 62.22 H new ATOM 0 HG3 GLU A 138 -8.475 11.219 -4.880 1.00 62.22 H new ATOM 2185 N LYS A 139 -4.195 13.274 -5.094 1.00 43.21 N ATOM 2186 CA LYS A 139 -3.026 14.138 -5.101 1.00 34.03 C ATOM 2187 C LYS A 139 -1.706 13.391 -4.900 1.00 33.24 C ATOM 2188 O LYS A 139 -0.664 13.964 -5.189 1.00 24.03 O ATOM 2189 CB LYS A 139 -3.234 15.213 -4.031 1.00 5.35 C ATOM 2190 CG LYS A 139 -2.118 16.265 -4.061 1.00 1.51 C ATOM 2191 CD LYS A 139 -2.536 17.560 -3.365 1.00 34.32 C ATOM 2192 CE LYS A 139 -2.708 17.363 -1.857 1.00 1.44 C ATOM 2193 NZ LYS A 139 -3.610 18.383 -1.288 1.00 20.13 N ATOM 0 H LYS A 139 -4.868 13.504 -4.363 1.00 43.21 H new ATOM 0 HA LYS A 139 -2.935 14.588 -6.089 1.00 34.03 H new ATOM 0 HB2 LYS A 139 -4.197 15.699 -4.186 1.00 5.35 H new ATOM 0 HB3 LYS A 139 -3.267 14.746 -3.047 1.00 5.35 H new ATOM 0 HG2 LYS A 139 -1.228 15.864 -3.577 1.00 1.51 H new ATOM 0 HG3 LYS A 139 -1.849 16.479 -5.095 1.00 1.51 H new ATOM 0 HD2 LYS A 139 -1.786 18.330 -3.548 1.00 34.32 H new ATOM 0 HD3 LYS A 139 -3.472 17.918 -3.794 1.00 34.32 H new ATOM 0 HE2 LYS A 139 -3.108 16.368 -1.660 1.00 1.44 H new ATOM 0 HE3 LYS A 139 -1.736 17.418 -1.367 1.00 1.44 H new ATOM 0 HZ1 LYS A 139 -3.709 18.227 -0.265 1.00 20.13 H new ATOM 0 HZ2 LYS A 139 -3.214 19.330 -1.457 1.00 20.13 H new ATOM 0 HZ3 LYS A 139 -4.543 18.313 -1.741 1.00 20.13 H new ATOM 2207 N ALA A 140 -1.699 12.147 -4.420 1.00 54.42 N ATOM 2208 CA ALA A 140 -0.466 11.444 -4.095 1.00 43.24 C ATOM 2209 C ALA A 140 -0.210 10.187 -4.918 1.00 0.51 C ATOM 2210 O ALA A 140 0.850 9.587 -4.782 1.00 31.05 O ATOM 2211 CB ALA A 140 -0.413 11.169 -2.591 1.00 1.22 C ATOM 0 H ALA A 140 -2.545 11.604 -4.248 1.00 54.42 H new ATOM 0 HA ALA A 140 0.353 12.107 -4.374 1.00 43.24 H new ATOM 0 HB1 ALA A 140 0.511 10.643 -2.350 1.00 1.22 H new ATOM 0 HB2 ALA A 140 -0.445 12.113 -2.047 1.00 1.22 H new ATOM 0 HB3 ALA A 140 -1.266 10.555 -2.303 1.00 1.22 H new ATOM 2217 N ALA A 141 -1.110 9.808 -5.815 1.00 0.31 N ATOM 2218 CA ALA A 141 -0.900 8.718 -6.758 1.00 73.21 C ATOM 2219 C ALA A 141 -1.044 9.202 -8.193 1.00 32.01 C ATOM 2220 O ALA A 141 -0.352 8.691 -9.073 1.00 51.41 O ATOM 2221 CB ALA A 141 -1.900 7.600 -6.444 1.00 73.20 C ATOM 0 H ALA A 141 -2.021 10.257 -5.909 1.00 0.31 H new ATOM 0 HA ALA A 141 0.115 8.334 -6.654 1.00 73.21 H new ATOM 0 HB1 ALA A 141 -1.755 6.776 -7.142 1.00 73.20 H new ATOM 0 HB2 ALA A 141 -1.741 7.245 -5.426 1.00 73.20 H new ATOM 0 HB3 ALA A 141 -2.916 7.983 -6.540 1.00 73.20 H new ATOM 2227 N ALA A 142 -1.876 10.222 -8.408 1.00 10.32 N ATOM 2228 CA ALA A 142 -2.280 10.673 -9.734 1.00 30.24 C ATOM 2229 C ALA A 142 -1.633 12.006 -10.108 1.00 31.42 C ATOM 2230 O ALA A 142 -1.934 12.538 -11.173 1.00 34.15 O ATOM 2231 CB ALA A 142 -3.808 10.751 -9.800 1.00 63.43 C ATOM 0 H ALA A 142 -2.293 10.764 -7.652 1.00 10.32 H new ATOM 0 HA ALA A 142 -1.929 9.948 -10.468 1.00 30.24 H new ATOM 0 HB1 ALA A 142 -4.113 11.088 -10.791 1.00 63.43 H new ATOM 0 HB2 ALA A 142 -4.231 9.765 -9.606 1.00 63.43 H new ATOM 0 HB3 ALA A 142 -4.169 11.455 -9.050 1.00 63.43 H new ATOM 2237 N ASP A 143 -0.780 12.553 -9.235 1.00 1.53 N ATOM 2238 CA ASP A 143 -0.024 13.775 -9.475 1.00 62.22 C ATOM 2239 C ASP A 143 0.954 13.603 -10.642 1.00 74.30 C ATOM 2240 O ASP A 143 0.594 13.884 -11.781 1.00 74.13 O ATOM 2241 CB ASP A 143 0.691 14.121 -8.170 1.00 13.54 C ATOM 2242 CG ASP A 143 1.565 15.368 -8.256 1.00 13.12 C ATOM 2243 OD1 ASP A 143 1.187 16.351 -8.928 1.00 5.15 O ATOM 2244 OD2 ASP A 143 2.579 15.369 -7.524 1.00 70.34 O ATOM 0 H ASP A 143 -0.596 12.143 -8.320 1.00 1.53 H new ATOM 0 HA ASP A 143 -0.686 14.591 -9.765 1.00 62.22 H new ATOM 0 HB2 ASP A 143 -0.053 14.264 -7.386 1.00 13.54 H new ATOM 0 HB3 ASP A 143 1.310 13.275 -7.871 1.00 13.54 H new ATOM 2249 N LEU A 144 2.160 13.085 -10.384 1.00 65.33 N ATOM 2250 CA LEU A 144 3.203 12.797 -11.371 1.00 21.01 C ATOM 2251 C LEU A 144 4.384 12.109 -10.672 1.00 74.02 C ATOM 2252 O LEU A 144 5.521 12.574 -10.769 1.00 24.13 O ATOM 2253 CB LEU A 144 3.648 14.060 -12.146 1.00 4.25 C ATOM 2254 CG LEU A 144 4.114 15.250 -11.277 1.00 45.31 C ATOM 2255 CD1 LEU A 144 5.528 15.703 -11.650 1.00 71.34 C ATOM 2256 CD2 LEU A 144 3.170 16.438 -11.467 1.00 12.54 C ATOM 0 H LEU A 144 2.448 12.844 -9.435 1.00 65.33 H new ATOM 0 HA LEU A 144 2.791 12.122 -12.122 1.00 21.01 H new ATOM 0 HB2 LEU A 144 4.461 13.784 -12.818 1.00 4.25 H new ATOM 0 HB3 LEU A 144 2.818 14.392 -12.770 1.00 4.25 H new ATOM 0 HG LEU A 144 4.109 14.913 -10.241 1.00 45.31 H new ATOM 0 HD11 LEU A 144 5.820 16.541 -11.017 1.00 71.34 H new ATOM 0 HD12 LEU A 144 6.225 14.878 -11.504 1.00 71.34 H new ATOM 0 HD13 LEU A 144 5.547 16.013 -12.695 1.00 71.34 H new ATOM 0 HD21 LEU A 144 3.506 17.272 -10.851 1.00 12.54 H new ATOM 0 HD22 LEU A 144 3.169 16.738 -12.515 1.00 12.54 H new ATOM 0 HD23 LEU A 144 2.161 16.152 -11.171 1.00 12.54 H new ATOM 2268 N GLN A 145 4.132 11.054 -9.879 1.00 43.51 N ATOM 2269 CA GLN A 145 5.234 10.400 -9.168 1.00 14.14 C ATOM 2270 C GLN A 145 5.089 8.882 -9.054 1.00 14.15 C ATOM 2271 O GLN A 145 6.025 8.182 -9.434 1.00 71.11 O ATOM 2272 CB GLN A 145 5.599 11.135 -7.857 1.00 10.42 C ATOM 2273 CG GLN A 145 4.495 11.844 -7.058 1.00 43.42 C ATOM 2274 CD GLN A 145 3.639 10.864 -6.276 1.00 11.32 C ATOM 2275 OE1 GLN A 145 3.984 10.486 -5.161 1.00 33.31 O ATOM 2276 NE2 GLN A 145 2.517 10.432 -6.840 1.00 31.31 N ATOM 0 H GLN A 145 3.209 10.650 -9.720 1.00 43.51 H new ATOM 0 HA GLN A 145 6.117 10.503 -9.799 1.00 14.14 H new ATOM 0 HB2 GLN A 145 6.067 10.408 -7.194 1.00 10.42 H new ATOM 0 HB3 GLN A 145 6.357 11.880 -8.100 1.00 10.42 H new ATOM 0 HG2 GLN A 145 4.947 12.559 -6.371 1.00 43.42 H new ATOM 0 HG3 GLN A 145 3.863 12.413 -7.740 1.00 43.42 H new ATOM 0 HE21 GLN A 145 2.253 10.762 -7.768 1.00 31.31 H new ATOM 0 HE22 GLN A 145 1.919 9.770 -6.345 1.00 31.31 H new ATOM 2285 N LEU A 146 3.943 8.361 -8.608 1.00 21.42 N ATOM 2286 CA LEU A 146 3.736 6.931 -8.398 1.00 63.33 C ATOM 2287 C LEU A 146 3.681 6.210 -9.735 1.00 51.20 C ATOM 2288 O LEU A 146 4.695 5.708 -10.219 1.00 32.23 O ATOM 2289 CB LEU A 146 2.484 6.738 -7.523 1.00 2.23 C ATOM 2290 CG LEU A 146 2.159 5.263 -7.245 1.00 72.14 C ATOM 2291 CD1 LEU A 146 3.173 4.613 -6.309 1.00 20.32 C ATOM 2292 CD2 LEU A 146 0.769 5.154 -6.630 1.00 14.42 C ATOM 0 H LEU A 146 3.126 8.928 -8.381 1.00 21.42 H new ATOM 0 HA LEU A 146 4.572 6.483 -7.861 1.00 63.33 H new ATOM 0 HB2 LEU A 146 2.628 7.256 -6.575 1.00 2.23 H new ATOM 0 HB3 LEU A 146 1.630 7.205 -8.014 1.00 2.23 H new ATOM 0 HG LEU A 146 2.200 4.736 -8.198 1.00 72.14 H new ATOM 0 HD11 LEU A 146 2.900 3.571 -6.143 1.00 20.32 H new ATOM 0 HD12 LEU A 146 4.165 4.661 -6.758 1.00 20.32 H new ATOM 0 HD13 LEU A 146 3.180 5.142 -5.356 1.00 20.32 H new ATOM 0 HD21 LEU A 146 0.539 4.107 -6.433 1.00 14.42 H new ATOM 0 HD22 LEU A 146 0.740 5.714 -5.695 1.00 14.42 H new ATOM 0 HD23 LEU A 146 0.032 5.563 -7.321 1.00 14.42 H new ATOM 2304 N GLN A 147 2.507 6.217 -10.365 1.00 25.33 N ATOM 2305 CA GLN A 147 2.310 5.691 -11.705 1.00 34.33 C ATOM 2306 C GLN A 147 2.772 4.222 -11.837 1.00 45.14 C ATOM 2307 O GLN A 147 3.278 3.802 -12.884 1.00 63.31 O ATOM 2308 CB GLN A 147 2.937 6.646 -12.732 1.00 22.12 C ATOM 2309 CG GLN A 147 2.626 8.127 -12.407 1.00 23.05 C ATOM 2310 CD GLN A 147 2.843 9.109 -13.552 1.00 51.21 C ATOM 2311 OE1 GLN A 147 3.507 10.123 -13.372 1.00 21.11 O ATOM 2312 NE2 GLN A 147 2.259 8.888 -14.716 1.00 64.42 N ATOM 0 H GLN A 147 1.656 6.595 -9.948 1.00 25.33 H new ATOM 0 HA GLN A 147 1.242 5.649 -11.918 1.00 34.33 H new ATOM 0 HB2 GLN A 147 4.017 6.498 -12.754 1.00 22.12 H new ATOM 0 HB3 GLN A 147 2.562 6.406 -13.727 1.00 22.12 H new ATOM 0 HG2 GLN A 147 1.588 8.199 -12.081 1.00 23.05 H new ATOM 0 HG3 GLN A 147 3.247 8.434 -11.565 1.00 23.05 H new ATOM 0 HE21 GLN A 147 1.708 8.041 -14.858 1.00 64.42 H new ATOM 0 HE22 GLN A 147 2.359 9.564 -15.473 1.00 64.42 H new ATOM 2321 N GLY A 148 2.621 3.438 -10.766 1.00 64.01 N ATOM 2322 CA GLY A 148 2.796 1.994 -10.740 1.00 42.23 C ATOM 2323 C GLY A 148 2.622 1.482 -9.309 1.00 54.30 C ATOM 2324 O GLY A 148 2.737 2.274 -8.379 1.00 74.03 O ATOM 0 H GLY A 148 2.362 3.816 -9.855 1.00 64.01 H new ATOM 0 HA2 GLY A 148 2.070 1.518 -11.398 1.00 42.23 H new ATOM 0 HA3 GLY A 148 3.786 1.731 -11.113 1.00 42.23 H new ATOM 2328 N VAL A 149 2.330 0.194 -9.099 1.00 60.30 N ATOM 2329 CA VAL A 149 2.274 -0.407 -7.760 1.00 42.11 C ATOM 2330 C VAL A 149 2.855 -1.834 -7.782 1.00 0.41 C ATOM 2331 O VAL A 149 2.825 -2.477 -8.839 1.00 32.23 O ATOM 2332 CB VAL A 149 0.830 -0.403 -7.196 1.00 52.42 C ATOM 2333 CG1 VAL A 149 0.351 0.993 -6.777 1.00 14.14 C ATOM 2334 CG2 VAL A 149 -0.195 -1.072 -8.120 1.00 71.03 C ATOM 0 H VAL A 149 2.126 -0.462 -9.852 1.00 60.30 H new ATOM 0 HA VAL A 149 2.885 0.202 -7.094 1.00 42.11 H new ATOM 0 HB VAL A 149 0.894 -1.015 -6.296 1.00 52.42 H new ATOM 0 HG11 VAL A 149 -0.666 0.928 -6.391 1.00 14.14 H new ATOM 0 HG12 VAL A 149 1.009 1.386 -6.002 1.00 14.14 H new ATOM 0 HG13 VAL A 149 0.370 1.658 -7.640 1.00 14.14 H new ATOM 0 HG21 VAL A 149 -1.182 -1.031 -7.659 1.00 71.03 H new ATOM 0 HG22 VAL A 149 -0.219 -0.549 -9.076 1.00 71.03 H new ATOM 0 HG23 VAL A 149 0.086 -2.112 -8.283 1.00 71.03 H new ATOM 2344 N PRO A 150 3.284 -2.383 -6.627 1.00 0.44 N ATOM 2345 CA PRO A 150 3.350 -1.724 -5.324 1.00 41.50 C ATOM 2346 C PRO A 150 4.493 -0.730 -5.222 1.00 20.33 C ATOM 2347 O PRO A 150 5.465 -0.794 -5.977 1.00 1.33 O ATOM 2348 CB PRO A 150 3.550 -2.842 -4.311 1.00 52.52 C ATOM 2349 CG PRO A 150 4.291 -3.921 -5.092 1.00 63.01 C ATOM 2350 CD PRO A 150 3.715 -3.766 -6.498 1.00 33.13 C ATOM 0 HA PRO A 150 2.440 -1.149 -5.152 1.00 41.50 H new ATOM 0 HB2 PRO A 150 4.129 -2.503 -3.452 1.00 52.52 H new ATOM 0 HB3 PRO A 150 2.597 -3.209 -3.929 1.00 52.52 H new ATOM 0 HG2 PRO A 150 5.370 -3.765 -5.076 1.00 63.01 H new ATOM 0 HG3 PRO A 150 4.107 -4.915 -4.685 1.00 63.01 H new ATOM 0 HD2 PRO A 150 4.464 -4.009 -7.251 1.00 33.13 H new ATOM 0 HD3 PRO A 150 2.878 -4.447 -6.650 1.00 33.13 H new ATOM 2358 N ALA A 151 4.377 0.155 -4.239 1.00 55.53 N ATOM 2359 CA ALA A 151 5.391 1.130 -3.908 1.00 1.12 C ATOM 2360 C ALA A 151 5.435 1.347 -2.400 1.00 14.23 C ATOM 2361 O ALA A 151 4.394 1.361 -1.743 1.00 4.43 O ATOM 2362 CB ALA A 151 5.051 2.444 -4.613 1.00 64.13 C ATOM 0 H ALA A 151 3.553 0.210 -3.640 1.00 55.53 H new ATOM 0 HA ALA A 151 6.368 0.773 -4.235 1.00 1.12 H new ATOM 0 HB1 ALA A 151 5.807 3.192 -4.374 1.00 64.13 H new ATOM 0 HB2 ALA A 151 5.028 2.283 -5.691 1.00 64.13 H new ATOM 0 HB3 ALA A 151 4.075 2.795 -4.278 1.00 64.13 H new ATOM 2368 N MET A 152 6.635 1.602 -1.887 1.00 13.42 N ATOM 2369 CA MET A 152 6.925 1.942 -0.504 1.00 15.52 C ATOM 2370 C MET A 152 7.915 3.095 -0.581 1.00 24.43 C ATOM 2371 O MET A 152 9.065 2.896 -0.984 1.00 52.43 O ATOM 2372 CB MET A 152 7.517 0.720 0.205 1.00 32.21 C ATOM 2373 CG MET A 152 7.942 0.978 1.656 1.00 74.24 C ATOM 2374 SD MET A 152 6.601 0.940 2.871 1.00 62.44 S ATOM 2375 CE MET A 152 6.204 -0.833 2.782 1.00 24.04 C ATOM 0 H MET A 152 7.477 1.574 -2.461 1.00 13.42 H new ATOM 0 HA MET A 152 6.041 2.231 0.065 1.00 15.52 H new ATOM 0 HB2 MET A 152 6.782 -0.085 0.191 1.00 32.21 H new ATOM 0 HB3 MET A 152 8.382 0.371 -0.358 1.00 32.21 H new ATOM 0 HG2 MET A 152 8.687 0.233 1.937 1.00 74.24 H new ATOM 0 HG3 MET A 152 8.430 1.952 1.707 1.00 74.24 H new ATOM 0 HE1 MET A 152 5.635 -1.123 3.665 1.00 24.04 H new ATOM 0 HE2 MET A 152 5.612 -1.029 1.888 1.00 24.04 H new ATOM 0 HE3 MET A 152 7.127 -1.411 2.739 1.00 24.04 H new ATOM 2385 N TYR A 153 7.448 4.303 -0.298 1.00 41.42 N ATOM 2386 CA TYR A 153 8.270 5.496 -0.226 1.00 74.13 C ATOM 2387 C TYR A 153 8.926 5.577 1.144 1.00 23.04 C ATOM 2388 O TYR A 153 8.341 5.143 2.142 1.00 44.34 O ATOM 2389 CB TYR A 153 7.407 6.735 -0.465 1.00 3.45 C ATOM 2390 CG TYR A 153 6.958 6.880 -1.897 1.00 55.40 C ATOM 2391 CD1 TYR A 153 7.865 7.388 -2.841 1.00 33.12 C ATOM 2392 CD2 TYR A 153 5.659 6.511 -2.294 1.00 0.15 C ATOM 2393 CE1 TYR A 153 7.470 7.549 -4.175 1.00 60.33 C ATOM 2394 CE2 TYR A 153 5.266 6.673 -3.634 1.00 14.51 C ATOM 2395 CZ TYR A 153 6.170 7.195 -4.582 1.00 51.31 C ATOM 2396 OH TYR A 153 5.788 7.362 -5.872 1.00 75.13 O ATOM 0 H TYR A 153 6.462 4.482 -0.108 1.00 41.42 H new ATOM 0 HA TYR A 153 9.043 5.450 -0.993 1.00 74.13 H new ATOM 0 HB2 TYR A 153 6.530 6.689 0.181 1.00 3.45 H new ATOM 0 HB3 TYR A 153 7.970 7.623 -0.176 1.00 3.45 H new ATOM 0 HD1 TYR A 153 8.867 7.654 -2.538 1.00 33.12 H new ATOM 0 HD2 TYR A 153 4.967 6.105 -1.572 1.00 0.15 H new ATOM 0 HE1 TYR A 153 8.168 7.948 -4.896 1.00 60.33 H new ATOM 0 HE2 TYR A 153 4.267 6.396 -3.939 1.00 14.51 H new ATOM 0 HH TYR A 153 6.567 7.267 -6.459 1.00 75.13 H new ATOM 2406 N VAL A 154 10.119 6.171 1.209 1.00 35.04 N ATOM 2407 CA VAL A 154 10.876 6.331 2.445 1.00 73.34 C ATOM 2408 C VAL A 154 11.520 7.721 2.435 1.00 0.14 C ATOM 2409 O VAL A 154 11.933 8.214 1.379 1.00 22.02 O ATOM 2410 CB VAL A 154 11.911 5.186 2.601 1.00 20.32 C ATOM 2411 CG1 VAL A 154 12.428 5.104 4.045 1.00 55.12 C ATOM 2412 CG2 VAL A 154 11.368 3.798 2.228 1.00 64.24 C ATOM 0 H VAL A 154 10.590 6.559 0.392 1.00 35.04 H new ATOM 0 HA VAL A 154 10.221 6.262 3.313 1.00 73.34 H new ATOM 0 HB VAL A 154 12.709 5.441 1.904 1.00 20.32 H new ATOM 0 HG11 VAL A 154 13.152 4.293 4.127 1.00 55.12 H new ATOM 0 HG12 VAL A 154 12.906 6.046 4.314 1.00 55.12 H new ATOM 0 HG13 VAL A 154 11.593 4.915 4.720 1.00 55.12 H new ATOM 0 HG21 VAL A 154 12.151 3.052 2.364 1.00 64.24 H new ATOM 0 HG22 VAL A 154 10.520 3.555 2.869 1.00 64.24 H new ATOM 0 HG23 VAL A 154 11.046 3.801 1.187 1.00 64.24 H new ATOM 2422 N ASN A 155 11.637 8.344 3.614 1.00 4.34 N ATOM 2423 CA ASN A 155 12.331 9.611 3.879 1.00 0.43 C ATOM 2424 C ASN A 155 11.922 10.753 2.930 1.00 14.22 C ATOM 2425 O ASN A 155 12.683 11.691 2.701 1.00 13.21 O ATOM 2426 CB ASN A 155 13.844 9.334 3.918 1.00 41.40 C ATOM 2427 CG ASN A 155 14.707 10.468 4.466 1.00 4.22 C ATOM 2428 OD1 ASN A 155 14.237 11.478 4.979 1.00 60.43 O ATOM 2429 ND2 ASN A 155 16.011 10.282 4.365 1.00 60.33 N ATOM 0 H ASN A 155 11.224 7.953 4.461 1.00 4.34 H new ATOM 0 HA ASN A 155 12.021 9.991 4.853 1.00 0.43 H new ATOM 0 HB2 ASN A 155 14.017 8.444 4.523 1.00 41.40 H new ATOM 0 HB3 ASN A 155 14.179 9.102 2.907 1.00 41.40 H new ATOM 0 HD21 ASN A 155 16.656 10.989 4.719 1.00 60.33 H new ATOM 0 HD22 ASN A 155 16.373 9.432 3.933 1.00 60.33 H new ATOM 2436 N GLY A 156 10.724 10.695 2.338 1.00 54.32 N ATOM 2437 CA GLY A 156 10.251 11.716 1.410 1.00 42.54 C ATOM 2438 C GLY A 156 11.018 11.744 0.087 1.00 4.23 C ATOM 2439 O GLY A 156 10.786 12.648 -0.710 1.00 35.01 O ATOM 0 H GLY A 156 10.059 9.937 2.492 1.00 54.32 H new ATOM 0 HA2 GLY A 156 9.194 11.546 1.204 1.00 42.54 H new ATOM 0 HA3 GLY A 156 10.330 12.693 1.887 1.00 42.54 H new ATOM 2443 N LYS A 157 11.960 10.818 -0.149 1.00 0.53 N ATOM 2444 CA LYS A 157 12.918 10.943 -1.246 1.00 44.23 C ATOM 2445 C LYS A 157 13.356 9.629 -1.876 1.00 71.21 C ATOM 2446 O LYS A 157 14.031 9.676 -2.905 1.00 14.24 O ATOM 2447 CB LYS A 157 14.124 11.770 -0.786 1.00 61.40 C ATOM 2448 CG LYS A 157 15.102 11.079 0.160 1.00 42.44 C ATOM 2449 CD LYS A 157 15.981 12.133 0.850 1.00 1.54 C ATOM 2450 CE LYS A 157 17.432 11.673 0.875 1.00 32.24 C ATOM 2451 NZ LYS A 157 18.339 12.621 1.530 1.00 24.41 N ATOM 0 H LYS A 157 12.075 9.973 0.411 1.00 0.53 H new ATOM 0 HA LYS A 157 12.390 11.459 -2.048 1.00 44.23 H new ATOM 0 HB2 LYS A 157 14.674 12.092 -1.670 1.00 61.40 H new ATOM 0 HB3 LYS A 157 13.753 12.670 -0.296 1.00 61.40 H new ATOM 0 HG2 LYS A 157 14.556 10.501 0.906 1.00 42.44 H new ATOM 0 HG3 LYS A 157 15.725 10.377 -0.394 1.00 42.44 H new ATOM 0 HD2 LYS A 157 15.902 13.084 0.323 1.00 1.54 H new ATOM 0 HD3 LYS A 157 15.628 12.302 1.867 1.00 1.54 H new ATOM 0 HE2 LYS A 157 17.491 10.713 1.388 1.00 32.24 H new ATOM 0 HE3 LYS A 157 17.770 11.508 -0.148 1.00 32.24 H new ATOM 0 HZ1 LYS A 157 19.293 12.523 1.127 1.00 24.41 H new ATOM 0 HZ2 LYS A 157 17.996 13.591 1.378 1.00 24.41 H new ATOM 0 HZ3 LYS A 157 18.372 12.422 2.550 1.00 24.41 H new ATOM 2465 N TYR A 158 12.963 8.479 -1.328 1.00 43.53 N ATOM 2466 CA TYR A 158 13.317 7.178 -1.873 1.00 2.21 C ATOM 2467 C TYR A 158 12.064 6.365 -2.152 1.00 4.51 C ATOM 2468 O TYR A 158 11.021 6.612 -1.547 1.00 63.13 O ATOM 2469 CB TYR A 158 14.201 6.410 -0.886 1.00 1.22 C ATOM 2470 CG TYR A 158 15.483 7.122 -0.540 1.00 2.52 C ATOM 2471 CD1 TYR A 158 16.449 7.322 -1.540 1.00 32.34 C ATOM 2472 CD2 TYR A 158 15.690 7.624 0.757 1.00 3.44 C ATOM 2473 CE1 TYR A 158 17.623 8.029 -1.248 1.00 60.42 C ATOM 2474 CE2 TYR A 158 16.864 8.339 1.051 1.00 72.02 C ATOM 2475 CZ TYR A 158 17.840 8.535 0.048 1.00 43.02 C ATOM 2476 OH TYR A 158 18.931 9.304 0.297 1.00 13.15 O ATOM 0 H TYR A 158 12.386 8.429 -0.488 1.00 43.53 H new ATOM 0 HA TYR A 158 13.863 7.336 -2.803 1.00 2.21 H new ATOM 0 HB2 TYR A 158 13.637 6.230 0.029 1.00 1.22 H new ATOM 0 HB3 TYR A 158 14.440 5.435 -1.309 1.00 1.22 H new ATOM 0 HD1 TYR A 158 16.287 6.931 -2.534 1.00 32.34 H new ATOM 0 HD2 TYR A 158 14.949 7.461 1.525 1.00 3.44 H new ATOM 0 HE1 TYR A 158 18.363 8.186 -2.019 1.00 60.42 H new ATOM 0 HE2 TYR A 158 17.020 8.738 2.042 1.00 72.02 H new ATOM 0 HH TYR A 158 19.346 9.020 1.138 1.00 13.15 H new ATOM 2486 N GLN A 159 12.210 5.327 -2.972 1.00 32.45 N ATOM 2487 CA GLN A 159 11.254 4.247 -3.156 1.00 11.32 C ATOM 2488 C GLN A 159 12.031 2.935 -3.010 1.00 52.13 C ATOM 2489 O GLN A 159 13.151 2.833 -3.519 1.00 32.33 O ATOM 2490 CB GLN A 159 10.621 4.372 -4.552 1.00 64.22 C ATOM 2491 CG GLN A 159 9.397 3.463 -4.749 1.00 53.31 C ATOM 2492 CD GLN A 159 9.271 3.003 -6.202 1.00 22.45 C ATOM 2493 OE1 GLN A 159 8.955 3.787 -7.091 1.00 32.22 O ATOM 2494 NE2 GLN A 159 9.536 1.738 -6.477 1.00 51.53 N ATOM 0 H GLN A 159 13.041 5.214 -3.553 1.00 32.45 H new ATOM 0 HA GLN A 159 10.449 4.282 -2.422 1.00 11.32 H new ATOM 0 HB2 GLN A 159 10.326 5.408 -4.718 1.00 64.22 H new ATOM 0 HB3 GLN A 159 11.370 4.129 -5.306 1.00 64.22 H new ATOM 0 HG2 GLN A 159 9.479 2.594 -4.096 1.00 53.31 H new ATOM 0 HG3 GLN A 159 8.494 3.998 -4.456 1.00 53.31 H new ATOM 0 HE21 GLN A 159 9.798 1.097 -5.728 1.00 51.53 H new ATOM 0 HE22 GLN A 159 9.479 1.402 -7.439 1.00 51.53 H new ATOM 2503 N LEU A 160 11.461 1.922 -2.353 1.00 61.00 N ATOM 2504 CA LEU A 160 11.993 0.560 -2.388 1.00 43.54 C ATOM 2505 C LEU A 160 11.853 0.036 -3.818 1.00 13.11 C ATOM 2506 O LEU A 160 10.841 0.321 -4.461 1.00 72.30 O ATOM 2507 CB LEU A 160 11.178 -0.323 -1.429 1.00 0.43 C ATOM 2508 CG LEU A 160 11.712 -0.432 0.009 1.00 31.24 C ATOM 2509 CD1 LEU A 160 12.973 -1.300 0.079 1.00 15.31 C ATOM 2510 CD2 LEU A 160 11.967 0.937 0.638 1.00 31.21 C ATOM 0 H LEU A 160 10.621 2.023 -1.784 1.00 61.00 H new ATOM 0 HA LEU A 160 13.039 0.545 -2.083 1.00 43.54 H new ATOM 0 HB2 LEU A 160 10.160 0.064 -1.388 1.00 0.43 H new ATOM 0 HB3 LEU A 160 11.121 -1.326 -1.851 1.00 0.43 H new ATOM 0 HG LEU A 160 10.930 -0.920 0.591 1.00 31.24 H new ATOM 0 HD11 LEU A 160 13.321 -1.354 1.111 1.00 15.31 H new ATOM 0 HD12 LEU A 160 12.744 -2.304 -0.279 1.00 15.31 H new ATOM 0 HD13 LEU A 160 13.752 -0.861 -0.544 1.00 15.31 H new ATOM 0 HD21 LEU A 160 12.343 0.807 1.653 1.00 31.21 H new ATOM 0 HD22 LEU A 160 12.704 1.478 0.045 1.00 31.21 H new ATOM 0 HD23 LEU A 160 11.036 1.504 0.666 1.00 31.21 H new ATOM 2522 N ASN A 161 12.827 -0.730 -4.313 1.00 74.34 N ATOM 2523 CA ASN A 161 12.828 -1.257 -5.677 1.00 2.42 C ATOM 2524 C ASN A 161 12.824 -2.782 -5.691 1.00 74.13 C ATOM 2525 O ASN A 161 13.891 -3.398 -5.781 1.00 41.50 O ATOM 2526 CB ASN A 161 14.025 -0.751 -6.482 1.00 24.41 C ATOM 2527 CG ASN A 161 13.804 -1.037 -7.969 1.00 32.32 C ATOM 2528 OD1 ASN A 161 12.705 -0.900 -8.501 1.00 0.31 O ATOM 2529 ND2 ASN A 161 14.843 -1.392 -8.694 1.00 74.41 N ATOM 0 H ASN A 161 13.646 -1.004 -3.771 1.00 74.34 H new ATOM 0 HA ASN A 161 11.912 -0.895 -6.143 1.00 2.42 H new ATOM 0 HB2 ASN A 161 14.156 0.319 -6.323 1.00 24.41 H new ATOM 0 HB3 ASN A 161 14.938 -1.238 -6.140 1.00 24.41 H new ATOM 0 HD21 ASN A 161 14.735 -1.553 -9.695 1.00 74.41 H new ATOM 0 HD22 ASN A 161 15.756 -1.506 -8.255 1.00 74.41 H new ATOM 2536 N PRO A 162 11.659 -3.441 -5.608 1.00 23.23 N ATOM 2537 CA PRO A 162 11.645 -4.892 -5.534 1.00 15.14 C ATOM 2538 C PRO A 162 12.164 -5.526 -6.831 1.00 13.55 C ATOM 2539 O PRO A 162 12.720 -6.621 -6.793 1.00 34.25 O ATOM 2540 CB PRO A 162 10.189 -5.259 -5.231 1.00 54.30 C ATOM 2541 CG PRO A 162 9.382 -4.058 -5.724 1.00 52.13 C ATOM 2542 CD PRO A 162 10.324 -2.894 -5.427 1.00 75.03 C ATOM 0 HA PRO A 162 12.312 -5.275 -4.761 1.00 15.14 H new ATOM 0 HB2 PRO A 162 9.895 -6.174 -5.746 1.00 54.30 H new ATOM 0 HB3 PRO A 162 10.036 -5.430 -4.165 1.00 54.30 H new ATOM 0 HG2 PRO A 162 9.149 -4.132 -6.786 1.00 52.13 H new ATOM 0 HG3 PRO A 162 8.434 -3.960 -5.195 1.00 52.13 H new ATOM 0 HD2 PRO A 162 10.144 -2.058 -6.102 1.00 75.03 H new ATOM 0 HD3 PRO A 162 10.184 -2.520 -4.413 1.00 75.03 H new ATOM 2550 N GLN A 163 12.066 -4.810 -7.958 1.00 20.25 N ATOM 2551 CA GLN A 163 12.485 -5.271 -9.280 1.00 23.14 C ATOM 2552 C GLN A 163 14.008 -5.428 -9.396 1.00 31.05 C ATOM 2553 O GLN A 163 14.498 -5.900 -10.423 1.00 14.14 O ATOM 2554 CB GLN A 163 12.006 -4.293 -10.370 1.00 75.24 C ATOM 2555 CG GLN A 163 10.577 -3.745 -10.201 1.00 40.22 C ATOM 2556 CD GLN A 163 9.730 -3.918 -11.460 1.00 72.10 C ATOM 2557 OE1 GLN A 163 9.459 -2.977 -12.193 1.00 53.54 O ATOM 2558 NE2 GLN A 163 9.270 -5.128 -11.728 1.00 72.24 N ATOM 0 H GLN A 163 11.681 -3.866 -7.971 1.00 20.25 H new ATOM 0 HA GLN A 163 12.029 -6.251 -9.421 1.00 23.14 H new ATOM 0 HB2 GLN A 163 12.696 -3.450 -10.403 1.00 75.24 H new ATOM 0 HB3 GLN A 163 12.070 -4.795 -11.335 1.00 75.24 H new ATOM 0 HG2 GLN A 163 10.092 -4.255 -9.368 1.00 40.22 H new ATOM 0 HG3 GLN A 163 10.625 -2.687 -9.942 1.00 40.22 H new ATOM 0 HE21 GLN A 163 9.500 -5.909 -11.113 1.00 72.24 H new ATOM 0 HE22 GLN A 163 8.686 -5.281 -12.550 1.00 72.24 H new ATOM 2567 N GLY A 164 14.778 -4.981 -8.402 1.00 2.34 N ATOM 2568 CA GLY A 164 16.222 -5.145 -8.368 1.00 75.03 C ATOM 2569 C GLY A 164 16.669 -6.081 -7.252 1.00 63.21 C ATOM 2570 O GLY A 164 17.872 -6.158 -6.995 1.00 3.35 O ATOM 0 H GLY A 164 14.405 -4.489 -7.590 1.00 2.34 H new ATOM 0 HA2 GLY A 164 16.564 -5.536 -9.326 1.00 75.03 H new ATOM 0 HA3 GLY A 164 16.693 -4.171 -8.234 1.00 75.03 H new ATOM 2574 N MET A 165 15.748 -6.758 -6.555 1.00 40.13 N ATOM 2575 CA MET A 165 16.080 -7.610 -5.430 1.00 22.35 C ATOM 2576 C MET A 165 16.152 -9.058 -5.864 1.00 54.12 C ATOM 2577 O MET A 165 15.534 -9.458 -6.856 1.00 31.25 O ATOM 2578 CB MET A 165 15.025 -7.435 -4.336 1.00 44.14 C ATOM 2579 CG MET A 165 15.253 -6.077 -3.698 1.00 35.11 C ATOM 2580 SD MET A 165 14.187 -5.679 -2.289 1.00 2.12 S ATOM 2581 CE MET A 165 14.927 -4.075 -1.893 1.00 15.12 C ATOM 0 H MET A 165 14.750 -6.723 -6.764 1.00 40.13 H new ATOM 0 HA MET A 165 17.057 -7.324 -5.040 1.00 22.35 H new ATOM 0 HB2 MET A 165 14.022 -7.498 -4.757 1.00 44.14 H new ATOM 0 HB3 MET A 165 15.108 -8.227 -3.592 1.00 44.14 H new ATOM 0 HG2 MET A 165 16.291 -6.020 -3.371 1.00 35.11 H new ATOM 0 HG3 MET A 165 15.116 -5.311 -4.461 1.00 35.11 H new ATOM 0 HE1 MET A 165 15.473 -4.149 -0.953 1.00 15.12 H new ATOM 0 HE2 MET A 165 15.612 -3.784 -2.689 1.00 15.12 H new ATOM 0 HE3 MET A 165 14.141 -3.325 -1.798 1.00 15.12 H new ATOM 2591 N ASP A 166 16.856 -9.860 -5.064 1.00 60.14 N ATOM 2592 CA ASP A 166 16.824 -11.306 -5.268 1.00 3.33 C ATOM 2593 C ASP A 166 15.409 -11.758 -4.940 1.00 40.43 C ATOM 2594 O ASP A 166 14.989 -11.709 -3.785 1.00 41.54 O ATOM 2595 CB ASP A 166 17.847 -12.112 -4.451 1.00 43.32 C ATOM 2596 CG ASP A 166 18.009 -13.502 -5.067 1.00 1.35 C ATOM 2597 OD1 ASP A 166 17.016 -14.102 -5.527 1.00 43.20 O ATOM 2598 OD2 ASP A 166 19.146 -14.026 -5.107 1.00 12.45 O ATOM 0 H ASP A 166 17.440 -9.543 -4.290 1.00 60.14 H new ATOM 0 HA ASP A 166 17.107 -11.503 -6.302 1.00 3.33 H new ATOM 0 HB2 ASP A 166 18.806 -11.595 -4.437 1.00 43.32 H new ATOM 0 HB3 ASP A 166 17.516 -12.197 -3.416 1.00 43.32 H new ATOM 2603 N THR A 167 14.654 -12.149 -5.950 1.00 12.23 N ATOM 2604 CA THR A 167 13.232 -12.456 -5.943 1.00 52.10 C ATOM 2605 C THR A 167 13.049 -13.942 -6.287 1.00 12.34 C ATOM 2606 O THR A 167 11.942 -14.391 -6.558 1.00 72.04 O ATOM 2607 CB THR A 167 12.526 -11.493 -6.932 1.00 75.40 C ATOM 2608 OG1 THR A 167 13.409 -11.057 -7.959 1.00 12.21 O ATOM 2609 CG2 THR A 167 12.029 -10.224 -6.240 1.00 23.12 C ATOM 0 H THR A 167 15.055 -12.271 -6.880 1.00 12.23 H new ATOM 0 HA THR A 167 12.777 -12.303 -4.964 1.00 52.10 H new ATOM 0 HB THR A 167 11.693 -12.065 -7.341 1.00 75.40 H new ATOM 0 HG1 THR A 167 14.058 -10.425 -7.586 1.00 12.21 H new ATOM 0 HG21 THR A 167 11.541 -9.579 -6.970 1.00 23.12 H new ATOM 0 HG22 THR A 167 11.317 -10.491 -5.459 1.00 23.12 H new ATOM 0 HG23 THR A 167 12.874 -9.697 -5.797 1.00 23.12 H new ATOM 2617 N SER A 168 14.143 -14.704 -6.278 1.00 44.52 N ATOM 2618 CA SER A 168 14.234 -16.070 -6.786 1.00 54.52 C ATOM 2619 C SER A 168 13.934 -17.123 -5.730 1.00 33.12 C ATOM 2620 O SER A 168 13.950 -18.312 -6.044 1.00 11.53 O ATOM 2621 CB SER A 168 15.630 -16.310 -7.390 1.00 44.42 C ATOM 2622 OG SER A 168 16.239 -15.109 -7.843 1.00 1.22 O ATOM 0 H SER A 168 15.029 -14.369 -5.899 1.00 44.52 H new ATOM 0 HA SER A 168 13.468 -16.173 -7.555 1.00 54.52 H new ATOM 0 HB2 SER A 168 16.270 -16.779 -6.643 1.00 44.42 H new ATOM 0 HB3 SER A 168 15.547 -17.008 -8.223 1.00 44.42 H new ATOM 0 HG SER A 168 16.571 -14.601 -7.074 1.00 1.22 H new ATOM 2628 N ASN A 169 13.719 -16.706 -4.483 1.00 72.41 N ATOM 2629 CA ASN A 169 13.668 -17.589 -3.336 1.00 34.33 C ATOM 2630 C ASN A 169 12.550 -17.195 -2.377 1.00 1.15 C ATOM 2631 O ASN A 169 12.312 -17.929 -1.426 1.00 75.10 O ATOM 2632 CB ASN A 169 15.012 -17.609 -2.566 1.00 13.25 C ATOM 2633 CG ASN A 169 16.229 -17.037 -3.284 1.00 53.23 C ATOM 2634 OD1 ASN A 169 16.253 -15.728 -3.432 1.00 73.04 O flip ATOM 2635 ND2 ASN A 169 17.156 -17.716 -3.709 1.00 64.40 N flip ATOM 0 H ASN A 169 13.574 -15.725 -4.245 1.00 72.41 H new ATOM 0 HA ASN A 169 13.470 -18.587 -3.726 1.00 34.33 H new ATOM 0 HB2 ASN A 169 14.878 -17.058 -1.635 1.00 13.25 H new ATOM 0 HB3 ASN A 169 15.232 -18.642 -2.296 1.00 13.25 H new ATOM 0 HD21 ASN A 169 17.140 -18.730 -3.596 1.00 64.40 H new ATOM 0 HD22 ASN A 169 17.944 -17.268 -4.176 1.00 64.40 H new ATOM 2642 N MET A 170 11.880 -16.057 -2.603 1.00 11.55 N ATOM 2643 CA MET A 170 10.784 -15.501 -1.803 1.00 31.32 C ATOM 2644 C MET A 170 11.242 -15.084 -0.405 1.00 42.51 C ATOM 2645 O MET A 170 11.242 -13.892 -0.117 1.00 32.43 O ATOM 2646 CB MET A 170 9.576 -16.459 -1.760 1.00 75.21 C ATOM 2647 CG MET A 170 9.081 -16.941 -3.133 1.00 23.23 C ATOM 2648 SD MET A 170 7.966 -15.837 -4.057 1.00 12.25 S ATOM 2649 CE MET A 170 9.127 -14.644 -4.772 1.00 24.42 C ATOM 0 H MET A 170 12.105 -15.463 -3.401 1.00 11.55 H new ATOM 0 HA MET A 170 10.453 -14.589 -2.300 1.00 31.32 H new ATOM 0 HB2 MET A 170 9.843 -17.329 -1.160 1.00 75.21 H new ATOM 0 HB3 MET A 170 8.753 -15.960 -1.249 1.00 75.21 H new ATOM 0 HG2 MET A 170 9.954 -17.136 -3.756 1.00 23.23 H new ATOM 0 HG3 MET A 170 8.571 -17.894 -2.992 1.00 23.23 H new ATOM 0 HE1 MET A 170 8.758 -14.315 -5.743 1.00 24.42 H new ATOM 0 HE2 MET A 170 9.220 -13.784 -4.109 1.00 24.42 H new ATOM 0 HE3 MET A 170 10.103 -15.114 -4.895 1.00 24.42 H new ATOM 2659 N ASP A 171 11.713 -15.990 0.446 1.00 42.43 N ATOM 2660 CA ASP A 171 11.980 -15.623 1.842 1.00 2.12 C ATOM 2661 C ASP A 171 13.195 -14.698 1.911 1.00 22.45 C ATOM 2662 O ASP A 171 13.231 -13.743 2.679 1.00 52.34 O ATOM 2663 CB ASP A 171 12.166 -16.856 2.737 1.00 61.21 C ATOM 2664 CG ASP A 171 11.280 -16.740 3.980 1.00 44.50 C ATOM 2665 OD1 ASP A 171 11.688 -16.075 4.963 1.00 42.51 O ATOM 2666 OD2 ASP A 171 10.158 -17.297 3.961 1.00 31.44 O ATOM 0 H ASP A 171 11.915 -16.961 0.207 1.00 42.43 H new ATOM 0 HA ASP A 171 11.109 -15.091 2.225 1.00 2.12 H new ATOM 0 HB2 ASP A 171 11.912 -17.759 2.183 1.00 61.21 H new ATOM 0 HB3 ASP A 171 13.211 -16.947 3.033 1.00 61.21 H new ATOM 2671 N VAL A 172 14.192 -14.944 1.053 1.00 2.54 N ATOM 2672 CA VAL A 172 15.363 -14.085 0.868 1.00 40.24 C ATOM 2673 C VAL A 172 14.926 -12.682 0.447 1.00 73.03 C ATOM 2674 O VAL A 172 15.542 -11.709 0.880 1.00 41.23 O ATOM 2675 CB VAL A 172 16.286 -14.711 -0.196 1.00 11.31 C ATOM 2676 CG1 VAL A 172 17.492 -13.842 -0.585 1.00 40.40 C ATOM 2677 CG2 VAL A 172 16.807 -16.085 0.258 1.00 72.30 C ATOM 0 H VAL A 172 14.205 -15.769 0.453 1.00 2.54 H new ATOM 0 HA VAL A 172 15.908 -14.001 1.808 1.00 40.24 H new ATOM 0 HB VAL A 172 15.653 -14.805 -1.079 1.00 11.31 H new ATOM 0 HG11 VAL A 172 18.086 -14.360 -1.338 1.00 40.40 H new ATOM 0 HG12 VAL A 172 17.141 -12.893 -0.990 1.00 40.40 H new ATOM 0 HG13 VAL A 172 18.106 -13.656 0.296 1.00 40.40 H new ATOM 0 HG21 VAL A 172 17.455 -16.501 -0.513 1.00 72.30 H new ATOM 0 HG22 VAL A 172 17.371 -15.972 1.184 1.00 72.30 H new ATOM 0 HG23 VAL A 172 15.965 -16.756 0.425 1.00 72.30 H new ATOM 2687 N PHE A 173 13.878 -12.586 -0.385 1.00 4.55 N ATOM 2688 CA PHE A 173 13.399 -11.316 -0.892 1.00 75.32 C ATOM 2689 C PHE A 173 12.982 -10.447 0.286 1.00 20.35 C ATOM 2690 O PHE A 173 13.534 -9.362 0.457 1.00 11.24 O ATOM 2691 CB PHE A 173 12.292 -11.503 -1.947 1.00 22.31 C ATOM 2692 CG PHE A 173 11.576 -10.231 -2.277 1.00 53.34 C ATOM 2693 CD1 PHE A 173 12.199 -9.237 -3.053 1.00 71.10 C ATOM 2694 CD2 PHE A 173 10.306 -10.025 -1.716 1.00 73.21 C ATOM 2695 CE1 PHE A 173 11.563 -7.992 -3.193 1.00 35.34 C ATOM 2696 CE2 PHE A 173 9.684 -8.780 -1.850 1.00 53.51 C ATOM 2697 CZ PHE A 173 10.328 -7.759 -2.562 1.00 55.22 C ATOM 0 H PHE A 173 13.348 -13.392 -0.718 1.00 4.55 H new ATOM 0 HA PHE A 173 14.199 -10.800 -1.423 1.00 75.32 H new ATOM 0 HB2 PHE A 173 12.731 -11.913 -2.857 1.00 22.31 H new ATOM 0 HB3 PHE A 173 11.571 -12.235 -1.583 1.00 22.31 H new ATOM 0 HD1 PHE A 173 13.148 -9.427 -3.532 1.00 71.10 H new ATOM 0 HD2 PHE A 173 9.812 -10.824 -1.184 1.00 73.21 H new ATOM 0 HE1 PHE A 173 12.022 -7.214 -3.785 1.00 35.34 H new ATOM 0 HE2 PHE A 173 8.714 -8.606 -1.408 1.00 53.51 H new ATOM 0 HZ PHE A 173 9.871 -6.783 -2.627 1.00 55.22 H new ATOM 2707 N VAL A 174 12.066 -10.942 1.119 1.00 12.21 N ATOM 2708 CA VAL A 174 11.564 -10.179 2.253 1.00 23.43 C ATOM 2709 C VAL A 174 12.686 -9.922 3.268 1.00 71.03 C ATOM 2710 O VAL A 174 12.777 -8.815 3.804 1.00 31.44 O ATOM 2711 CB VAL A 174 10.351 -10.884 2.890 1.00 52.43 C ATOM 2712 CG1 VAL A 174 9.593 -9.881 3.765 1.00 34.11 C ATOM 2713 CG2 VAL A 174 9.381 -11.431 1.833 1.00 53.40 C ATOM 0 H VAL A 174 11.658 -11.872 1.026 1.00 12.21 H new ATOM 0 HA VAL A 174 11.219 -9.207 1.900 1.00 23.43 H new ATOM 0 HB VAL A 174 10.727 -11.721 3.478 1.00 52.43 H new ATOM 0 HG11 VAL A 174 8.733 -10.372 4.220 1.00 34.11 H new ATOM 0 HG12 VAL A 174 10.254 -9.509 4.548 1.00 34.11 H new ATOM 0 HG13 VAL A 174 9.252 -9.047 3.151 1.00 34.11 H new ATOM 0 HG21 VAL A 174 8.542 -11.920 2.328 1.00 53.40 H new ATOM 0 HG22 VAL A 174 9.012 -10.610 1.218 1.00 53.40 H new ATOM 0 HG23 VAL A 174 9.900 -12.152 1.202 1.00 53.40 H new ATOM 2723 N ALA A 175 13.575 -10.903 3.475 1.00 32.25 N ATOM 2724 CA ALA A 175 14.691 -10.825 4.415 1.00 33.43 C ATOM 2725 C ALA A 175 15.531 -9.579 4.151 1.00 63.21 C ATOM 2726 O ALA A 175 15.882 -8.849 5.085 1.00 12.44 O ATOM 2727 CB ALA A 175 15.574 -12.077 4.311 1.00 54.41 C ATOM 0 H ALA A 175 13.533 -11.793 2.979 1.00 32.25 H new ATOM 0 HA ALA A 175 14.279 -10.766 5.422 1.00 33.43 H new ATOM 0 HB1 ALA A 175 16.399 -12.000 5.019 1.00 54.41 H new ATOM 0 HB2 ALA A 175 14.980 -12.961 4.541 1.00 54.41 H new ATOM 0 HB3 ALA A 175 15.970 -12.160 3.299 1.00 54.41 H new ATOM 2733 N GLN A 176 15.875 -9.348 2.882 1.00 61.03 N ATOM 2734 CA GLN A 176 16.629 -8.177 2.486 1.00 33.23 C ATOM 2735 C GLN A 176 15.734 -6.940 2.351 1.00 32.42 C ATOM 2736 O GLN A 176 16.160 -5.861 2.756 1.00 73.41 O ATOM 2737 CB GLN A 176 17.354 -8.466 1.170 1.00 60.43 C ATOM 2738 CG GLN A 176 18.374 -9.612 1.212 1.00 51.01 C ATOM 2739 CD GLN A 176 19.101 -9.758 -0.128 1.00 72.41 C ATOM 2740 OE1 GLN A 176 19.563 -8.790 -0.739 1.00 20.25 O ATOM 2741 NE2 GLN A 176 19.166 -10.959 -0.666 1.00 62.22 N ATOM 0 H GLN A 176 15.636 -9.970 2.110 1.00 61.03 H new ATOM 0 HA GLN A 176 17.358 -7.957 3.266 1.00 33.23 H new ATOM 0 HB2 GLN A 176 16.609 -8.695 0.408 1.00 60.43 H new ATOM 0 HB3 GLN A 176 17.867 -7.558 0.852 1.00 60.43 H new ATOM 0 HG2 GLN A 176 19.100 -9.427 2.004 1.00 51.01 H new ATOM 0 HG3 GLN A 176 17.866 -10.545 1.456 1.00 51.01 H new ATOM 0 HE21 GLN A 176 18.786 -11.763 -0.166 1.00 62.22 H new ATOM 0 HE22 GLN A 176 19.596 -11.085 -1.582 1.00 62.22 H new ATOM 2750 N TYR A 177 14.519 -7.062 1.799 1.00 13.41 N ATOM 2751 CA TYR A 177 13.578 -5.949 1.626 1.00 22.01 C ATOM 2752 C TYR A 177 13.413 -5.189 2.940 1.00 3.34 C ATOM 2753 O TYR A 177 13.705 -3.994 2.995 1.00 75.03 O ATOM 2754 CB TYR A 177 12.208 -6.437 1.107 1.00 72.02 C ATOM 2755 CG TYR A 177 11.232 -5.319 0.739 1.00 20.05 C ATOM 2756 CD1 TYR A 177 10.571 -4.587 1.749 1.00 71.04 C ATOM 2757 CD2 TYR A 177 10.980 -5.002 -0.612 1.00 3.53 C ATOM 2758 CE1 TYR A 177 9.698 -3.537 1.416 1.00 11.51 C ATOM 2759 CE2 TYR A 177 10.091 -3.959 -0.955 1.00 11.43 C ATOM 2760 CZ TYR A 177 9.446 -3.230 0.065 1.00 21.13 C ATOM 2761 OH TYR A 177 8.612 -2.208 -0.248 1.00 60.41 O ATOM 0 H TYR A 177 14.157 -7.952 1.455 1.00 13.41 H new ATOM 0 HA TYR A 177 13.992 -5.275 0.876 1.00 22.01 H new ATOM 0 HB2 TYR A 177 12.369 -7.064 0.230 1.00 72.02 H new ATOM 0 HB3 TYR A 177 11.749 -7.066 1.869 1.00 72.02 H new ATOM 0 HD1 TYR A 177 10.738 -4.836 2.787 1.00 71.04 H new ATOM 0 HD2 TYR A 177 11.472 -5.563 -1.393 1.00 3.53 H new ATOM 0 HE1 TYR A 177 9.220 -2.965 2.197 1.00 11.51 H new ATOM 0 HE2 TYR A 177 9.907 -3.721 -1.992 1.00 11.43 H new ATOM 0 HH TYR A 177 8.546 -2.126 -1.222 1.00 60.41 H new ATOM 2771 N ALA A 178 12.954 -5.888 3.985 1.00 13.31 N ATOM 2772 CA ALA A 178 12.581 -5.300 5.263 1.00 12.42 C ATOM 2773 C ALA A 178 13.746 -4.542 5.899 1.00 75.23 C ATOM 2774 O ALA A 178 13.544 -3.487 6.501 1.00 23.41 O ATOM 2775 CB ALA A 178 12.088 -6.410 6.195 1.00 23.34 C ATOM 0 H ALA A 178 12.831 -6.900 3.958 1.00 13.31 H new ATOM 0 HA ALA A 178 11.784 -4.576 5.095 1.00 12.42 H new ATOM 0 HB1 ALA A 178 11.806 -5.980 7.156 1.00 23.34 H new ATOM 0 HB2 ALA A 178 11.223 -6.902 5.750 1.00 23.34 H new ATOM 0 HB3 ALA A 178 12.884 -7.140 6.344 1.00 23.34 H new ATOM 2781 N ASP A 179 14.955 -5.080 5.747 1.00 41.21 N ATOM 2782 CA ASP A 179 16.174 -4.500 6.285 1.00 4.52 C ATOM 2783 C ASP A 179 16.485 -3.189 5.574 1.00 31.32 C ATOM 2784 O ASP A 179 16.665 -2.147 6.202 1.00 3.13 O ATOM 2785 CB ASP A 179 17.315 -5.474 6.042 1.00 42.02 C ATOM 2786 CG ASP A 179 18.566 -5.017 6.774 1.00 74.53 C ATOM 2787 OD1 ASP A 179 18.668 -5.376 7.975 1.00 1.45 O ATOM 2788 OD2 ASP A 179 19.450 -4.421 6.125 1.00 24.23 O ATOM 0 H ASP A 179 15.113 -5.948 5.236 1.00 41.21 H new ATOM 0 HA ASP A 179 16.050 -4.308 7.351 1.00 4.52 H new ATOM 0 HB2 ASP A 179 17.030 -6.470 6.382 1.00 42.02 H new ATOM 0 HB3 ASP A 179 17.518 -5.548 4.974 1.00 42.02 H new ATOM 2793 N THR A 180 16.475 -3.231 4.242 1.00 0.42 N ATOM 2794 CA THR A 180 16.735 -2.097 3.381 1.00 74.42 C ATOM 2795 C THR A 180 15.779 -0.933 3.662 1.00 31.43 C ATOM 2796 O THR A 180 16.198 0.218 3.540 1.00 44.20 O ATOM 2797 CB THR A 180 16.738 -2.605 1.933 1.00 63.22 C ATOM 2798 OG1 THR A 180 17.900 -3.401 1.807 1.00 4.01 O ATOM 2799 CG2 THR A 180 16.616 -1.499 0.882 1.00 31.35 C ATOM 0 H THR A 180 16.278 -4.087 3.724 1.00 0.42 H new ATOM 0 HA THR A 180 17.714 -1.663 3.583 1.00 74.42 H new ATOM 0 HB THR A 180 15.845 -3.197 1.731 1.00 63.22 H new ATOM 0 HG1 THR A 180 17.695 -4.323 2.069 1.00 4.01 H new ATOM 0 HG21 THR A 180 16.626 -1.941 -0.114 1.00 31.35 H new ATOM 0 HG22 THR A 180 15.681 -0.958 1.030 1.00 31.35 H new ATOM 0 HG23 THR A 180 17.454 -0.809 0.981 1.00 31.35 H new ATOM 2807 N VAL A 181 14.547 -1.190 4.117 1.00 73.23 N ATOM 2808 CA VAL A 181 13.680 -0.089 4.556 1.00 62.13 C ATOM 2809 C VAL A 181 14.352 0.655 5.722 1.00 4.11 C ATOM 2810 O VAL A 181 14.558 1.868 5.637 1.00 22.14 O ATOM 2811 CB VAL A 181 12.235 -0.528 4.890 1.00 55.33 C ATOM 2812 CG1 VAL A 181 11.320 0.708 4.938 1.00 52.14 C ATOM 2813 CG2 VAL A 181 11.641 -1.493 3.853 1.00 24.34 C ATOM 0 H VAL A 181 14.137 -2.121 4.190 1.00 73.23 H new ATOM 0 HA VAL A 181 13.564 0.595 3.715 1.00 62.13 H new ATOM 0 HB VAL A 181 12.288 -1.041 5.850 1.00 55.33 H new ATOM 0 HG11 VAL A 181 10.302 0.398 5.173 1.00 52.14 H new ATOM 0 HG12 VAL A 181 11.677 1.395 5.705 1.00 52.14 H new ATOM 0 HG13 VAL A 181 11.332 1.208 3.969 1.00 52.14 H new ATOM 0 HG21 VAL A 181 10.626 -1.762 4.146 1.00 24.34 H new ATOM 0 HG22 VAL A 181 11.621 -1.010 2.876 1.00 24.34 H new ATOM 0 HG23 VAL A 181 12.254 -2.393 3.800 1.00 24.34 H new ATOM 2823 N LYS A 182 14.766 -0.053 6.782 1.00 22.21 N ATOM 2824 CA LYS A 182 15.461 0.553 7.921 1.00 23.22 C ATOM 2825 C LYS A 182 16.800 1.175 7.514 1.00 14.25 C ATOM 2826 O LYS A 182 17.232 2.126 8.170 1.00 22.23 O ATOM 2827 CB LYS A 182 15.625 -0.491 9.047 1.00 20.04 C ATOM 2828 CG LYS A 182 16.247 0.095 10.332 1.00 55.34 C ATOM 2829 CD LYS A 182 17.758 -0.179 10.457 1.00 71.23 C ATOM 2830 CE LYS A 182 18.454 0.858 11.349 1.00 40.30 C ATOM 2831 NZ LYS A 182 18.771 2.102 10.613 1.00 52.02 N ATOM 0 H LYS A 182 14.628 -1.060 6.872 1.00 22.21 H new ATOM 0 HA LYS A 182 14.852 1.375 8.298 1.00 23.22 H new ATOM 0 HB2 LYS A 182 14.650 -0.917 9.284 1.00 20.04 H new ATOM 0 HB3 LYS A 182 16.251 -1.308 8.688 1.00 20.04 H new ATOM 0 HG2 LYS A 182 16.077 1.172 10.351 1.00 55.34 H new ATOM 0 HG3 LYS A 182 15.736 -0.324 11.199 1.00 55.34 H new ATOM 0 HD2 LYS A 182 17.914 -1.176 10.869 1.00 71.23 H new ATOM 0 HD3 LYS A 182 18.212 -0.169 9.466 1.00 71.23 H new ATOM 0 HE2 LYS A 182 17.813 1.093 12.199 1.00 40.30 H new ATOM 0 HE3 LYS A 182 19.373 0.431 11.751 1.00 40.30 H new ATOM 0 HZ1 LYS A 182 18.685 2.916 11.254 1.00 52.02 H new ATOM 0 HZ2 LYS A 182 19.743 2.051 10.247 1.00 52.02 H new ATOM 0 HZ3 LYS A 182 18.108 2.214 9.819 1.00 52.02 H new ATOM 2845 N GLN A 183 17.457 0.677 6.467 1.00 72.20 N ATOM 2846 CA GLN A 183 18.697 1.252 5.967 1.00 13.25 C ATOM 2847 C GLN A 183 18.491 2.611 5.329 1.00 41.42 C ATOM 2848 O GLN A 183 19.386 3.440 5.411 1.00 53.32 O ATOM 2849 CB GLN A 183 19.358 0.337 4.962 1.00 43.13 C ATOM 2850 CG GLN A 183 19.956 -0.891 5.647 1.00 44.12 C ATOM 2851 CD GLN A 183 21.134 -1.302 4.803 1.00 0.01 C ATOM 2852 OE1 GLN A 183 22.249 -0.811 4.959 1.00 62.43 O ATOM 2853 NE2 GLN A 183 20.905 -2.070 3.776 1.00 74.41 N ATOM 0 H GLN A 183 17.140 -0.139 5.943 1.00 72.20 H new ATOM 0 HA GLN A 183 19.342 1.374 6.837 1.00 13.25 H new ATOM 0 HB2 GLN A 183 18.628 0.022 4.217 1.00 43.13 H new ATOM 0 HB3 GLN A 183 20.141 0.879 4.432 1.00 43.13 H new ATOM 0 HG2 GLN A 183 20.268 -0.657 6.665 1.00 44.12 H new ATOM 0 HG3 GLN A 183 19.224 -1.696 5.714 1.00 44.12 H new ATOM 0 HE21 GLN A 183 19.981 -2.480 3.642 1.00 74.41 H new ATOM 0 HE22 GLN A 183 21.650 -2.261 3.106 1.00 74.41 H new ATOM 2862 N LEU A 184 17.367 2.877 4.674 1.00 42.12 N ATOM 2863 CA LEU A 184 17.219 4.177 4.029 1.00 62.40 C ATOM 2864 C LEU A 184 17.041 5.283 5.064 1.00 71.43 C ATOM 2865 O LEU A 184 17.526 6.391 4.870 1.00 15.33 O ATOM 2866 CB LEU A 184 16.026 4.158 3.082 1.00 23.45 C ATOM 2867 CG LEU A 184 16.311 3.347 1.807 1.00 40.14 C ATOM 2868 CD1 LEU A 184 15.003 3.086 1.057 1.00 42.42 C ATOM 2869 CD2 LEU A 184 17.299 4.064 0.881 1.00 71.20 C ATOM 0 H LEU A 184 16.575 2.241 4.576 1.00 42.12 H new ATOM 0 HA LEU A 184 18.127 4.380 3.461 1.00 62.40 H new ATOM 0 HB2 LEU A 184 15.163 3.734 3.595 1.00 23.45 H new ATOM 0 HB3 LEU A 184 15.764 5.180 2.810 1.00 23.45 H new ATOM 0 HG LEU A 184 16.763 2.403 2.111 1.00 40.14 H new ATOM 0 HD11 LEU A 184 15.210 2.511 0.154 1.00 42.42 H new ATOM 0 HD12 LEU A 184 14.322 2.524 1.697 1.00 42.42 H new ATOM 0 HD13 LEU A 184 14.544 4.036 0.785 1.00 42.42 H new ATOM 0 HD21 LEU A 184 17.472 3.456 -0.007 1.00 71.20 H new ATOM 0 HD22 LEU A 184 16.886 5.029 0.586 1.00 71.20 H new ATOM 0 HD23 LEU A 184 18.242 4.218 1.405 1.00 71.20 H new ATOM 2881 N VAL A 185 16.397 4.973 6.188 1.00 51.22 N ATOM 2882 CA VAL A 185 16.114 5.923 7.259 1.00 51.21 C ATOM 2883 C VAL A 185 17.400 6.487 7.889 1.00 21.32 C ATOM 2884 O VAL A 185 17.385 7.569 8.472 1.00 51.32 O ATOM 2885 CB VAL A 185 15.217 5.212 8.295 1.00 60.13 C ATOM 2886 CG1 VAL A 185 14.940 6.110 9.499 1.00 23.42 C ATOM 2887 CG2 VAL A 185 13.888 4.769 7.660 1.00 23.22 C ATOM 0 H VAL A 185 16.051 4.034 6.382 1.00 51.22 H new ATOM 0 HA VAL A 185 15.592 6.791 6.856 1.00 51.21 H new ATOM 0 HB VAL A 185 15.756 4.329 8.638 1.00 60.13 H new ATOM 0 HG11 VAL A 185 14.306 5.580 10.210 1.00 23.42 H new ATOM 0 HG12 VAL A 185 15.882 6.375 9.980 1.00 23.42 H new ATOM 0 HG13 VAL A 185 14.434 7.017 9.168 1.00 23.42 H new ATOM 0 HG21 VAL A 185 13.274 4.271 8.411 1.00 23.22 H new ATOM 0 HG22 VAL A 185 13.358 5.642 7.279 1.00 23.22 H new ATOM 0 HG23 VAL A 185 14.089 4.080 6.840 1.00 23.22 H new ATOM 2897 N GLU A 186 18.516 5.769 7.786 1.00 11.04 N ATOM 2898 CA GLU A 186 19.805 6.198 8.347 1.00 41.41 C ATOM 2899 C GLU A 186 20.678 6.824 7.251 1.00 74.30 C ATOM 2900 O GLU A 186 21.638 7.542 7.549 1.00 12.05 O ATOM 2901 CB GLU A 186 20.539 5.012 9.017 1.00 4.35 C ATOM 2902 CG GLU A 186 20.564 3.814 8.073 1.00 11.21 C ATOM 2903 CD GLU A 186 21.540 2.691 8.381 1.00 24.14 C ATOM 2904 OE1 GLU A 186 21.182 1.831 9.216 1.00 40.02 O ATOM 2905 OE2 GLU A 186 22.587 2.597 7.691 1.00 1.04 O ATOM 0 H GLU A 186 18.557 4.868 7.310 1.00 11.04 H new ATOM 0 HA GLU A 186 19.613 6.949 9.113 1.00 41.41 H new ATOM 0 HB2 GLU A 186 21.557 5.303 9.276 1.00 4.35 H new ATOM 0 HB3 GLU A 186 20.038 4.742 9.947 1.00 4.35 H new ATOM 0 HG2 GLU A 186 19.561 3.388 8.045 1.00 11.21 H new ATOM 0 HG3 GLU A 186 20.782 4.182 7.070 1.00 11.21 H new ATOM 2912 N LYS A 187 20.373 6.543 5.982 1.00 35.34 N ATOM 2913 CA LYS A 187 21.211 6.844 4.832 1.00 64.21 C ATOM 2914 C LYS A 187 20.683 8.123 4.208 1.00 20.13 C ATOM 2915 O LYS A 187 20.072 8.111 3.140 1.00 23.52 O ATOM 2916 CB LYS A 187 21.267 5.649 3.863 1.00 1.03 C ATOM 2917 CG LYS A 187 22.268 4.602 4.375 1.00 0.01 C ATOM 2918 CD LYS A 187 22.219 3.289 3.593 1.00 41.00 C ATOM 2919 CE LYS A 187 23.471 2.442 3.880 1.00 22.51 C ATOM 2920 NZ LYS A 187 23.437 1.719 5.176 1.00 73.53 N ATOM 0 H LYS A 187 19.501 6.082 5.724 1.00 35.34 H new ATOM 0 HA LYS A 187 22.248 7.008 5.124 1.00 64.21 H new ATOM 0 HB2 LYS A 187 20.278 5.202 3.767 1.00 1.03 H new ATOM 0 HB3 LYS A 187 21.560 5.989 2.870 1.00 1.03 H new ATOM 0 HG2 LYS A 187 23.276 5.014 4.318 1.00 0.01 H new ATOM 0 HG3 LYS A 187 22.065 4.399 5.427 1.00 0.01 H new ATOM 0 HD2 LYS A 187 21.324 2.730 3.866 1.00 41.00 H new ATOM 0 HD3 LYS A 187 22.151 3.497 2.525 1.00 41.00 H new ATOM 0 HE2 LYS A 187 23.596 1.717 3.076 1.00 22.51 H new ATOM 0 HE3 LYS A 187 24.346 3.091 3.863 1.00 22.51 H new ATOM 0 HZ1 LYS A 187 24.409 1.519 5.488 1.00 73.53 H new ATOM 0 HZ2 LYS A 187 22.959 2.306 5.889 1.00 73.53 H new ATOM 0 HZ3 LYS A 187 22.919 0.824 5.061 1.00 73.53 H new ATOM 2934 N LYS A 188 21.031 9.228 4.863 1.00 41.01 N ATOM 2935 CA LYS A 188 20.616 10.581 4.566 1.00 51.23 C ATOM 2936 C LYS A 188 19.124 10.764 4.770 1.00 23.44 C ATOM 2937 O LYS A 188 18.499 11.549 4.029 1.00 44.04 O ATOM 2938 CB LYS A 188 21.184 11.033 3.202 1.00 63.22 C ATOM 2939 CG LYS A 188 22.096 12.246 3.364 1.00 40.31 C ATOM 2940 CD LYS A 188 21.391 13.605 3.506 1.00 43.40 C ATOM 2941 CE LYS A 188 20.692 13.886 4.838 1.00 20.53 C ATOM 2942 NZ LYS A 188 21.647 14.037 5.958 1.00 13.13 N ATOM 0 H LYS A 188 21.654 9.190 5.670 1.00 41.01 H new ATOM 0 HA LYS A 188 21.052 11.274 5.286 1.00 51.23 H new ATOM 0 HB2 LYS A 188 21.740 10.214 2.746 1.00 63.22 H new ATOM 0 HB3 LYS A 188 20.365 11.277 2.526 1.00 63.22 H new ATOM 0 HG2 LYS A 188 22.722 12.090 4.243 1.00 40.31 H new ATOM 0 HG3 LYS A 188 22.762 12.293 2.502 1.00 40.31 H new ATOM 0 HD2 LYS A 188 22.129 14.389 3.338 1.00 43.40 H new ATOM 0 HD3 LYS A 188 20.651 13.688 2.710 1.00 43.40 H new ATOM 0 HE2 LYS A 188 20.096 14.794 4.748 1.00 20.53 H new ATOM 0 HE3 LYS A 188 20.001 13.073 5.061 1.00 20.53 H new ATOM 0 HZ1 LYS A 188 21.124 14.226 6.837 1.00 13.13 H new ATOM 0 HZ2 LYS A 188 22.198 13.162 6.064 1.00 13.13 H new ATOM 0 HZ3 LYS A 188 22.291 14.830 5.761 1.00 13.13 H new TER 2956 LYS A 188