USER MOD reduce.3.24.130724 H: found=0, std=0, add=1472, rem=0, adj=39 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 183 GLN : amide:sc= -1.59 K(o=-0.95,f=-1.6) USER MOD Set 1.2: A 187 LYS NZ :NH3+ -132:sc= 0.639 (180deg=-0.52) USER MOD Set 2.1: A -1 SER N :NH3+ 166:sc= 1.28 (180deg=9.58e-05) USER MOD Set 2.2: A 176 GLN : amide:sc= 0.793 K(o=2.1,f=-5.2!) USER MOD Set 3.1: A 165 MET CE :methyl 156:sc= -0.527 (180deg=-1.01) USER MOD Set 3.2: A 180 THR OG1 : rot 74:sc= -0.0695 USER MOD Set 4.1: A 161 ASN : amide:sc= -1.55! C(o=-0.74!,f=-4.2!) USER MOD Set 4.2: A 163 GLN : amide:sc= 0.812 K(o=-0.74,f=-4.4) USER MOD Set 5.1: A 60 HIS : no HE2:sc= -4.55 K(o=-5,f=-9.2!) USER MOD Set 5.2: A 137 GLN : amide:sc= -0.407 K(o=-5,f=-7.7!) USER MOD Single : A 0 ASN : amide:sc= 0.385 K(o=0.39,f=-4!) USER MOD Single : A 2 GLN : amide:sc= 0.0295 X(o=0.03,f=-0.071) USER MOD Single : A 4 THR OG1 : rot 180:sc=-0.00103 USER MOD Single : A 7 LYS NZ :NH3+ 170:sc= 0.513 (180deg=0.453) USER MOD Single : A 8 GLN : amide:sc= -1.04 X(o=-1,f=-1.1) USER MOD Single : A 9 TYR OH : rot 180:sc= 0 USER MOD Single : A -1 SER OG : rot 180:sc= 0 USER MOD Single : A 11 THR OG1 : rot 180:sc= 0 USER MOD Single : A 14 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 21 GLN : amide:sc= 0 X(o=0,f=-0.0069) USER MOD Single : A 27 SER OG : rot 148:sc= 1.26 USER MOD Single : A 29 TYR OH : rot 180:sc= 0 USER MOD Single : A 32 HIS : no HD1:sc= 0 X(o=0,f=-0.2) USER MOD Single : A 34 TYR OH : rot 123:sc= 0.781 USER MOD Single : A 35 GLN :FLIP amide:sc= -0.0739 F(o=-1.8!,f=-0.074) USER MOD Single : A 41 HIS : no HD1:sc= -1.02 X(o=-1,f=-0.83) USER MOD Single : A 43 SER OG : rot 180:sc= 0 USER MOD Single : A 45 ASN : amide:sc= 0.549 K(o=0.55,f=-0.082) USER MOD Single : A 48 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 49 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 54 THR OG1 : rot -150:sc= -0.179 USER MOD Single : A 55 LYS NZ :NH3+ -111:sc= 1.11 (180deg=-0.0466) USER MOD Single : A 56 MET CE :methyl 180:sc= -0.899 (180deg=-0.899) USER MOD Single : A 57 THR OG1 : rot 62:sc= 0.556 USER MOD Single : A 58 LYS NZ :NH3+ -163:sc= 1.13 (180deg=0.634) USER MOD Single : A 59 TYR OH : rot 151:sc= 0 USER MOD Single : A 69 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 72 THR OG1 : rot 177:sc= -1.23 USER MOD Single : A 73 GLN : amide:sc= 0.695 K(o=0.69,f=-0.74) USER MOD Single : A 86 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 88 THR OG1 : rot 61:sc= 0.705 USER MOD Single : A 91 MET CE :methyl 176:sc= -1.74 (180deg=-1.88) USER MOD Single : A 96 GLN : amide:sc= 1.48 K(o=1.5,f=-1.2) USER MOD Single : A 97 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 98 THR OG1 : rot 180:sc= -0.0444 USER MOD Single : A 99 GLN : amide:sc= 0.921 K(o=0.92,f=0) USER MOD Single : A 100 THR OG1 : rot 180:sc= 0 USER MOD Single : A 102 GLN : amide:sc= 0 K(o=0,f=-0.64) USER MOD Single : A 103 SER OG : rot 180:sc= 0 USER MOD Single : A 109 LYS NZ :NH3+ -153:sc= 1.22 (180deg=1.03) USER MOD Single : A 117 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 121 TYR OH : rot 180:sc= 0 USER MOD Single : A 126 ASN : amide:sc= -0.0255 X(o=-0.025,f=0) USER MOD Single : A 127 SER OG : rot 180:sc= 0 USER MOD Single : A 131 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 132 SER OG : rot 180:sc= 0 USER MOD Single : A 136 GLN : amide:sc= -0.229 X(o=-0.23,f=0) USER MOD Single : A 139 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 145 GLN :FLIP amide:sc= 0 F(o=-0.85,f=0) USER MOD Single : A 147 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 152 MET CE :methyl -117:sc= -0.0168 (180deg=-0.0785) USER MOD Single : A 153 TYR OH : rot 180:sc= 0 USER MOD Single : A 155 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 157 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 158 TYR OH : rot 30:sc= -0.0684 USER MOD Single : A 159 GLN : amide:sc= 0.315 K(o=0.32,f=-2.8!) USER MOD Single : A 167 THR OG1 : rot 180:sc= 0 USER MOD Single : A 168 SER OG : rot 180:sc= 0 USER MOD Single : A 169 ASN :FLIP amide:sc= -0.0242 F(o=-2.2,f=-0.024) USER MOD Single : A 170 MET CE :methyl 137:sc= -0.421 (180deg=-3.24!) USER MOD Single : A 177 TYR OH : rot 180:sc= 0 USER MOD Single : A 182 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 188 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1 N SER A -1 22.660 -10.344 1.416 1.00 5.24 N ATOM 2 CA SER A -1 23.298 -9.065 1.735 1.00 32.32 C ATOM 3 C SER A -1 22.342 -8.211 2.554 1.00 14.55 C ATOM 4 O SER A -1 21.813 -7.202 2.092 1.00 23.21 O ATOM 5 CB SER A -1 23.740 -8.361 0.456 1.00 62.11 C ATOM 6 OG SER A -1 24.528 -9.234 -0.330 1.00 3.51 O ATOM 0 H1 SER A -1 23.202 -10.826 0.671 1.00 5.24 H new ATOM 0 H2 SER A -1 22.635 -10.941 2.267 1.00 5.24 H new ATOM 0 H3 SER A -1 21.689 -10.174 1.083 1.00 5.24 H new ATOM 0 HA SER A -1 24.193 -9.238 2.333 1.00 32.32 H new ATOM 0 HB2 SER A -1 22.867 -8.037 -0.110 1.00 62.11 H new ATOM 0 HB3 SER A -1 24.311 -7.466 0.703 1.00 62.11 H new ATOM 0 HG SER A -1 24.806 -8.775 -1.150 1.00 3.51 H new ATOM 12 N ASN A 0 22.102 -8.612 3.798 1.00 31.04 N ATOM 13 CA ASN A 0 21.488 -7.733 4.778 1.00 53.44 C ATOM 14 C ASN A 0 22.507 -6.674 5.196 1.00 13.33 C ATOM 15 O ASN A 0 23.710 -6.842 4.991 1.00 30.33 O ATOM 16 CB ASN A 0 20.989 -8.550 5.977 1.00 64.30 C ATOM 17 CG ASN A 0 22.077 -9.377 6.669 1.00 32.31 C ATOM 18 OD1 ASN A 0 22.787 -10.149 6.024 1.00 53.30 O ATOM 19 ND2 ASN A 0 22.209 -9.259 7.978 1.00 1.45 N ATOM 0 H ASN A 0 22.325 -9.543 4.149 1.00 31.04 H new ATOM 0 HA ASN A 0 20.622 -7.230 4.347 1.00 53.44 H new ATOM 0 HB2 ASN A 0 20.545 -7.871 6.706 1.00 64.30 H new ATOM 0 HB3 ASN A 0 20.197 -9.220 5.642 1.00 64.30 H new ATOM 0 HD21 ASN A 0 22.909 -9.813 8.472 1.00 1.45 H new ATOM 0 HD22 ASN A 0 21.611 -8.614 8.495 1.00 1.45 H new ATOM 26 N ALA A 1 22.032 -5.587 5.801 1.00 45.41 N ATOM 27 CA ALA A 1 22.816 -4.444 6.252 1.00 62.33 C ATOM 28 C ALA A 1 23.777 -3.880 5.191 1.00 4.45 C ATOM 29 O ALA A 1 24.872 -3.415 5.527 1.00 72.21 O ATOM 30 CB ALA A 1 23.500 -4.789 7.581 1.00 13.14 C ATOM 0 H ALA A 1 21.038 -5.476 5.999 1.00 45.41 H new ATOM 0 HA ALA A 1 22.129 -3.615 6.423 1.00 62.33 H new ATOM 0 HB1 ALA A 1 24.087 -3.936 7.920 1.00 13.14 H new ATOM 0 HB2 ALA A 1 22.743 -5.029 8.328 1.00 13.14 H new ATOM 0 HB3 ALA A 1 24.156 -5.648 7.440 1.00 13.14 H new ATOM 36 N GLN A 2 23.395 -3.903 3.913 1.00 14.43 N ATOM 37 CA GLN A 2 24.116 -3.310 2.800 1.00 10.31 C ATOM 38 C GLN A 2 23.126 -3.228 1.642 1.00 61.30 C ATOM 39 O GLN A 2 22.569 -4.247 1.253 1.00 14.23 O ATOM 40 CB GLN A 2 25.339 -4.177 2.426 1.00 70.20 C ATOM 41 CG GLN A 2 26.530 -3.347 1.929 1.00 24.22 C ATOM 42 CD GLN A 2 26.195 -2.516 0.695 1.00 72.13 C ATOM 43 OE1 GLN A 2 26.138 -3.034 -0.419 1.00 25.25 O ATOM 44 NE2 GLN A 2 25.964 -1.228 0.864 1.00 10.21 N ATOM 0 H GLN A 2 22.532 -4.359 3.618 1.00 14.43 H new ATOM 0 HA GLN A 2 24.498 -2.321 3.054 1.00 10.31 H new ATOM 0 HB2 GLN A 2 25.645 -4.758 3.296 1.00 70.20 H new ATOM 0 HB3 GLN A 2 25.051 -4.889 1.652 1.00 70.20 H new ATOM 0 HG2 GLN A 2 26.865 -2.685 2.728 1.00 24.22 H new ATOM 0 HG3 GLN A 2 27.361 -4.014 1.698 1.00 24.22 H new ATOM 0 HE21 GLN A 2 26.017 -0.819 1.797 1.00 10.21 H new ATOM 0 HE22 GLN A 2 25.733 -0.642 0.062 1.00 10.21 H new ATOM 53 N ILE A 3 22.878 -2.022 1.145 1.00 51.12 N ATOM 54 CA ILE A 3 22.018 -1.713 0.004 1.00 13.54 C ATOM 55 C ILE A 3 22.739 -0.743 -0.934 1.00 51.41 C ATOM 56 O ILE A 3 23.664 -0.049 -0.512 1.00 33.34 O ATOM 57 CB ILE A 3 20.687 -1.112 0.506 1.00 50.22 C ATOM 58 CG1 ILE A 3 20.919 -0.020 1.570 1.00 43.14 C ATOM 59 CG2 ILE A 3 19.772 -2.221 1.026 1.00 32.05 C ATOM 60 CD1 ILE A 3 19.720 0.896 1.816 1.00 45.33 C ATOM 0 H ILE A 3 23.295 -1.184 1.550 1.00 51.12 H new ATOM 0 HA ILE A 3 21.796 -2.625 -0.549 1.00 13.54 H new ATOM 0 HB ILE A 3 20.193 -0.627 -0.336 1.00 50.22 H new ATOM 0 HG12 ILE A 3 21.192 -0.500 2.510 1.00 43.14 H new ATOM 0 HG13 ILE A 3 21.769 0.590 1.265 1.00 43.14 H new ATOM 0 HG21 ILE A 3 18.836 -1.786 1.377 1.00 32.05 H new ATOM 0 HG22 ILE A 3 19.564 -2.928 0.223 1.00 32.05 H new ATOM 0 HG23 ILE A 3 20.262 -2.741 1.849 1.00 32.05 H new ATOM 0 HD11 ILE A 3 19.975 1.632 2.579 1.00 45.33 H new ATOM 0 HD12 ILE A 3 19.458 1.409 0.890 1.00 45.33 H new ATOM 0 HD13 ILE A 3 18.871 0.302 2.155 1.00 45.33 H new ATOM 72 N THR A 4 22.308 -0.644 -2.195 1.00 45.31 N ATOM 73 CA THR A 4 22.913 0.255 -3.168 1.00 61.33 C ATOM 74 C THR A 4 21.815 0.893 -4.030 1.00 31.15 C ATOM 75 O THR A 4 20.799 0.258 -4.342 1.00 23.45 O ATOM 76 CB THR A 4 23.954 -0.550 -3.970 1.00 23.33 C ATOM 77 OG1 THR A 4 24.935 -1.067 -3.081 1.00 51.30 O ATOM 78 CG2 THR A 4 24.688 0.231 -5.058 1.00 2.33 C ATOM 0 H THR A 4 21.529 -1.188 -2.565 1.00 45.31 H new ATOM 0 HA THR A 4 23.435 1.086 -2.693 1.00 61.33 H new ATOM 0 HB THR A 4 23.379 -1.328 -4.473 1.00 23.33 H new ATOM 0 HG1 THR A 4 25.598 -1.581 -3.588 1.00 51.30 H new ATOM 0 HG21 THR A 4 25.397 -0.426 -5.562 1.00 2.33 H new ATOM 0 HG22 THR A 4 23.967 0.611 -5.782 1.00 2.33 H new ATOM 0 HG23 THR A 4 25.224 1.066 -4.607 1.00 2.33 H new ATOM 86 N ASP A 5 22.052 2.156 -4.386 1.00 30.40 N ATOM 87 CA ASP A 5 21.321 2.949 -5.373 1.00 2.23 C ATOM 88 C ASP A 5 21.201 2.203 -6.697 1.00 71.15 C ATOM 89 O ASP A 5 22.114 1.490 -7.115 1.00 70.14 O ATOM 90 CB ASP A 5 22.009 4.306 -5.617 1.00 3.12 C ATOM 91 CG ASP A 5 23.370 4.188 -6.322 1.00 24.40 C ATOM 92 OD1 ASP A 5 24.384 4.029 -5.603 1.00 54.41 O ATOM 93 OD2 ASP A 5 23.438 4.258 -7.573 1.00 4.32 O ATOM 0 H ASP A 5 22.812 2.688 -3.963 1.00 30.40 H new ATOM 0 HA ASP A 5 20.324 3.123 -4.969 1.00 2.23 H new ATOM 0 HB2 ASP A 5 21.351 4.935 -6.218 1.00 3.12 H new ATOM 0 HB3 ASP A 5 22.147 4.811 -4.661 1.00 3.12 H new ATOM 98 N GLY A 6 20.049 2.340 -7.347 1.00 53.53 N ATOM 99 CA GLY A 6 19.713 1.645 -8.582 1.00 34.52 C ATOM 100 C GLY A 6 19.324 0.185 -8.347 1.00 12.25 C ATOM 101 O GLY A 6 18.608 -0.389 -9.168 1.00 42.22 O ATOM 0 H GLY A 6 19.304 2.955 -7.019 1.00 53.53 H new ATOM 0 HA2 GLY A 6 18.889 2.162 -9.073 1.00 34.52 H new ATOM 0 HA3 GLY A 6 20.565 1.686 -9.261 1.00 34.52 H new ATOM 105 N LYS A 7 19.758 -0.410 -7.230 1.00 4.21 N ATOM 106 CA LYS A 7 19.729 -1.845 -7.007 1.00 4.32 C ATOM 107 C LYS A 7 18.566 -2.170 -6.099 1.00 10.43 C ATOM 108 O LYS A 7 17.537 -2.627 -6.574 1.00 10.35 O ATOM 109 CB LYS A 7 21.090 -2.308 -6.445 1.00 53.33 C ATOM 110 CG LYS A 7 21.239 -3.823 -6.297 1.00 22.24 C ATOM 111 CD LYS A 7 20.953 -4.639 -7.563 1.00 25.32 C ATOM 112 CE LYS A 7 21.434 -6.083 -7.360 1.00 4.22 C ATOM 113 NZ LYS A 7 20.715 -7.045 -8.213 1.00 62.13 N ATOM 0 H LYS A 7 20.146 0.111 -6.444 1.00 4.21 H new ATOM 0 HA LYS A 7 19.577 -2.388 -7.940 1.00 4.32 H new ATOM 0 HB2 LYS A 7 21.881 -1.941 -7.099 1.00 53.33 H new ATOM 0 HB3 LYS A 7 21.242 -1.845 -5.470 1.00 53.33 H new ATOM 0 HG2 LYS A 7 22.255 -4.041 -5.967 1.00 22.24 H new ATOM 0 HG3 LYS A 7 20.568 -4.162 -5.508 1.00 22.24 H new ATOM 0 HD2 LYS A 7 19.885 -4.627 -7.783 1.00 25.32 H new ATOM 0 HD3 LYS A 7 21.459 -4.192 -8.419 1.00 25.32 H new ATOM 0 HE2 LYS A 7 22.501 -6.140 -7.574 1.00 4.22 H new ATOM 0 HE3 LYS A 7 21.303 -6.362 -6.314 1.00 4.22 H new ATOM 0 HZ1 LYS A 7 21.186 -7.971 -8.165 1.00 62.13 H new ATOM 0 HZ2 LYS A 7 19.734 -7.138 -7.881 1.00 62.13 H new ATOM 0 HZ3 LYS A 7 20.717 -6.706 -9.196 1.00 62.13 H new ATOM 127 N GLN A 8 18.724 -1.928 -4.801 1.00 65.31 N ATOM 128 CA GLN A 8 17.756 -2.286 -3.773 1.00 71.14 C ATOM 129 C GLN A 8 16.923 -1.074 -3.371 1.00 23.01 C ATOM 130 O GLN A 8 15.859 -1.223 -2.773 1.00 2.53 O ATOM 131 CB GLN A 8 18.537 -2.832 -2.575 1.00 1.51 C ATOM 132 CG GLN A 8 19.168 -4.203 -2.863 1.00 10.24 C ATOM 133 CD GLN A 8 20.544 -4.317 -2.219 1.00 53.34 C ATOM 134 OE1 GLN A 8 20.657 -4.751 -1.084 1.00 2.15 O ATOM 135 NE2 GLN A 8 21.595 -3.877 -2.896 1.00 25.32 N ATOM 0 H GLN A 8 19.552 -1.465 -4.427 1.00 65.31 H new ATOM 0 HA GLN A 8 17.064 -3.040 -4.148 1.00 71.14 H new ATOM 0 HB2 GLN A 8 19.320 -2.125 -2.302 1.00 1.51 H new ATOM 0 HB3 GLN A 8 17.870 -2.915 -1.717 1.00 1.51 H new ATOM 0 HG2 GLN A 8 18.519 -4.993 -2.485 1.00 10.24 H new ATOM 0 HG3 GLN A 8 19.253 -4.349 -3.940 1.00 10.24 H new ATOM 0 HE21 GLN A 8 21.478 -3.518 -3.844 1.00 25.32 H new ATOM 0 HE22 GLN A 8 22.521 -3.897 -2.469 1.00 25.32 H new ATOM 144 N TYR A 9 17.378 0.124 -3.726 1.00 70.32 N ATOM 145 CA TYR A 9 16.549 1.315 -3.686 1.00 71.13 C ATOM 146 C TYR A 9 16.860 2.185 -4.902 1.00 31.44 C ATOM 147 O TYR A 9 17.940 2.056 -5.485 1.00 11.43 O ATOM 148 CB TYR A 9 16.772 2.075 -2.374 1.00 31.23 C ATOM 149 CG TYR A 9 18.152 2.691 -2.218 1.00 64.21 C ATOM 150 CD1 TYR A 9 19.199 1.953 -1.637 1.00 4.54 C ATOM 151 CD2 TYR A 9 18.386 4.009 -2.647 1.00 4.43 C ATOM 152 CE1 TYR A 9 20.465 2.539 -1.446 1.00 54.24 C ATOM 153 CE2 TYR A 9 19.656 4.593 -2.497 1.00 5.12 C ATOM 154 CZ TYR A 9 20.699 3.865 -1.879 1.00 1.54 C ATOM 155 OH TYR A 9 21.930 4.435 -1.729 1.00 63.32 O ATOM 0 H TYR A 9 18.331 0.292 -4.048 1.00 70.32 H new ATOM 0 HA TYR A 9 15.496 1.035 -3.723 1.00 71.13 H new ATOM 0 HB2 TYR A 9 16.026 2.866 -2.298 1.00 31.23 H new ATOM 0 HB3 TYR A 9 16.598 1.393 -1.542 1.00 31.23 H new ATOM 0 HD1 TYR A 9 19.031 0.930 -1.335 1.00 4.54 H new ATOM 0 HD2 TYR A 9 17.584 4.577 -3.095 1.00 4.43 H new ATOM 0 HE1 TYR A 9 21.255 1.977 -0.970 1.00 54.24 H new ATOM 0 HE2 TYR A 9 19.835 5.597 -2.853 1.00 5.12 H new ATOM 0 HH TYR A 9 21.912 5.349 -2.082 1.00 63.32 H new ATOM 165 N ILE A 10 15.943 3.079 -5.271 1.00 70.02 N ATOM 166 CA ILE A 10 16.131 4.083 -6.318 1.00 43.31 C ATOM 167 C ILE A 10 16.123 5.454 -5.652 1.00 61.44 C ATOM 168 O ILE A 10 15.629 5.603 -4.532 1.00 71.02 O ATOM 169 CB ILE A 10 15.049 3.976 -7.426 1.00 1.44 C ATOM 170 CG1 ILE A 10 14.839 2.550 -7.935 1.00 13.30 C ATOM 171 CG2 ILE A 10 15.382 4.803 -8.676 1.00 52.14 C ATOM 172 CD1 ILE A 10 16.126 1.898 -8.457 1.00 24.14 C ATOM 0 H ILE A 10 15.021 3.126 -4.837 1.00 70.02 H new ATOM 0 HA ILE A 10 17.084 3.918 -6.821 1.00 43.31 H new ATOM 0 HB ILE A 10 14.155 4.350 -6.927 1.00 1.44 H new ATOM 0 HG12 ILE A 10 14.432 1.940 -7.129 1.00 13.30 H new ATOM 0 HG13 ILE A 10 14.096 2.562 -8.733 1.00 13.30 H new ATOM 0 HG21 ILE A 10 14.587 4.686 -9.412 1.00 52.14 H new ATOM 0 HG22 ILE A 10 15.472 5.855 -8.403 1.00 52.14 H new ATOM 0 HG23 ILE A 10 16.324 4.457 -9.101 1.00 52.14 H new ATOM 0 HD11 ILE A 10 15.908 0.888 -8.803 1.00 24.14 H new ATOM 0 HD12 ILE A 10 16.523 2.487 -9.284 1.00 24.14 H new ATOM 0 HD13 ILE A 10 16.863 1.855 -7.655 1.00 24.14 H new ATOM 184 N THR A 11 16.632 6.444 -6.375 1.00 10.33 N ATOM 185 CA THR A 11 16.665 7.842 -5.983 1.00 13.42 C ATOM 186 C THR A 11 15.825 8.625 -6.992 1.00 50.25 C ATOM 187 O THR A 11 15.751 8.241 -8.164 1.00 65.12 O ATOM 188 CB THR A 11 18.122 8.343 -5.959 1.00 33.31 C ATOM 189 OG1 THR A 11 19.014 7.363 -5.449 1.00 13.30 O ATOM 190 CG2 THR A 11 18.246 9.599 -5.098 1.00 3.12 C ATOM 0 H THR A 11 17.051 6.284 -7.291 1.00 10.33 H new ATOM 0 HA THR A 11 16.256 7.979 -4.982 1.00 13.42 H new ATOM 0 HB THR A 11 18.391 8.563 -6.992 1.00 33.31 H new ATOM 0 HG1 THR A 11 19.927 7.719 -5.452 1.00 13.30 H new ATOM 0 HG21 THR A 11 19.282 9.937 -5.094 1.00 3.12 H new ATOM 0 HG22 THR A 11 17.610 10.384 -5.506 1.00 3.12 H new ATOM 0 HG23 THR A 11 17.934 9.373 -4.078 1.00 3.12 H new ATOM 198 N LEU A 12 15.176 9.700 -6.549 1.00 32.43 N ATOM 199 CA LEU A 12 14.428 10.594 -7.431 1.00 71.02 C ATOM 200 C LEU A 12 15.370 11.644 -8.010 1.00 24.20 C ATOM 201 O LEU A 12 16.368 12.003 -7.386 1.00 73.35 O ATOM 202 CB LEU A 12 13.264 11.260 -6.676 1.00 73.04 C ATOM 203 CG LEU A 12 12.336 10.247 -6.002 1.00 32.13 C ATOM 204 CD1 LEU A 12 11.323 10.977 -5.128 1.00 43.45 C ATOM 205 CD2 LEU A 12 11.616 9.341 -7.008 1.00 25.44 C ATOM 0 H LEU A 12 15.154 9.976 -5.567 1.00 32.43 H new ATOM 0 HA LEU A 12 14.001 10.011 -8.247 1.00 71.02 H new ATOM 0 HB2 LEU A 12 13.666 11.936 -5.921 1.00 73.04 H new ATOM 0 HB3 LEU A 12 12.686 11.868 -7.372 1.00 73.04 H new ATOM 0 HG LEU A 12 12.958 9.598 -5.385 1.00 32.13 H new ATOM 0 HD11 LEU A 12 10.665 10.251 -4.650 1.00 43.45 H new ATOM 0 HD12 LEU A 12 11.848 11.549 -4.363 1.00 43.45 H new ATOM 0 HD13 LEU A 12 10.731 11.653 -5.745 1.00 43.45 H new ATOM 0 HD21 LEU A 12 10.972 8.643 -6.473 1.00 25.44 H new ATOM 0 HD22 LEU A 12 11.012 9.951 -7.679 1.00 25.44 H new ATOM 0 HD23 LEU A 12 12.352 8.784 -7.588 1.00 25.44 H new ATOM 217 N ASP A 13 15.007 12.176 -9.175 1.00 22.23 N ATOM 218 CA ASP A 13 15.704 13.255 -9.881 1.00 43.25 C ATOM 219 C ASP A 13 15.482 14.582 -9.145 1.00 62.55 C ATOM 220 O ASP A 13 16.393 15.397 -8.990 1.00 1.12 O ATOM 221 CB ASP A 13 15.129 13.326 -11.305 1.00 73.44 C ATOM 222 CG ASP A 13 16.026 14.042 -12.310 1.00 11.22 C ATOM 223 OD1 ASP A 13 16.327 15.242 -12.132 1.00 63.53 O ATOM 224 OD2 ASP A 13 16.371 13.416 -13.338 1.00 72.45 O ATOM 0 H ASP A 13 14.181 11.853 -9.678 1.00 22.23 H new ATOM 0 HA ASP A 13 16.777 13.066 -9.919 1.00 43.25 H new ATOM 0 HB2 ASP A 13 14.943 12.312 -11.660 1.00 73.44 H new ATOM 0 HB3 ASP A 13 14.165 13.834 -11.270 1.00 73.44 H new ATOM 229 N LYS A 14 14.261 14.744 -8.617 1.00 62.41 N ATOM 230 CA LYS A 14 13.802 15.831 -7.758 1.00 63.52 C ATOM 231 C LYS A 14 13.170 15.221 -6.507 1.00 24.14 C ATOM 232 O LYS A 14 11.958 15.000 -6.479 1.00 34.30 O ATOM 233 CB LYS A 14 12.812 16.720 -8.518 1.00 73.54 C ATOM 234 CG LYS A 14 13.467 17.965 -9.114 1.00 65.35 C ATOM 235 CD LYS A 14 13.708 19.059 -8.062 1.00 71.53 C ATOM 236 CE LYS A 14 14.111 20.367 -8.746 1.00 23.10 C ATOM 237 NZ LYS A 14 15.468 20.307 -9.319 1.00 70.31 N ATOM 0 H LYS A 14 13.519 14.067 -8.795 1.00 62.41 H new ATOM 0 HA LYS A 14 14.638 16.463 -7.459 1.00 63.52 H new ATOM 0 HB2 LYS A 14 12.351 16.140 -9.318 1.00 73.54 H new ATOM 0 HB3 LYS A 14 12.012 17.024 -7.843 1.00 73.54 H new ATOM 0 HG2 LYS A 14 14.417 17.689 -9.572 1.00 65.35 H new ATOM 0 HG3 LYS A 14 12.834 18.361 -9.908 1.00 65.35 H new ATOM 0 HD2 LYS A 14 12.805 19.212 -7.471 1.00 71.53 H new ATOM 0 HD3 LYS A 14 14.491 18.744 -7.372 1.00 71.53 H new ATOM 0 HE2 LYS A 14 13.396 20.596 -9.536 1.00 23.10 H new ATOM 0 HE3 LYS A 14 14.060 21.182 -8.024 1.00 23.10 H new ATOM 0 HZ1 LYS A 14 15.695 21.216 -9.771 1.00 70.31 H new ATOM 0 HZ2 LYS A 14 16.156 20.115 -8.563 1.00 70.31 H new ATOM 0 HZ3 LYS A 14 15.512 19.547 -10.028 1.00 70.31 H new ATOM 251 N PRO A 15 13.978 14.896 -5.491 1.00 11.51 N ATOM 252 CA PRO A 15 13.504 14.537 -4.168 1.00 72.05 C ATOM 253 C PRO A 15 13.145 15.811 -3.386 1.00 65.45 C ATOM 254 O PRO A 15 13.997 16.333 -2.663 1.00 24.13 O ATOM 255 CB PRO A 15 14.686 13.794 -3.537 1.00 74.04 C ATOM 256 CG PRO A 15 15.922 14.411 -4.186 1.00 72.33 C ATOM 257 CD PRO A 15 15.429 14.854 -5.562 1.00 2.53 C ATOM 0 HA PRO A 15 12.604 13.922 -4.177 1.00 72.05 H new ATOM 0 HB2 PRO A 15 14.702 13.921 -2.455 1.00 74.04 H new ATOM 0 HB3 PRO A 15 14.630 12.723 -3.731 1.00 74.04 H new ATOM 0 HG2 PRO A 15 16.300 15.253 -3.606 1.00 72.33 H new ATOM 0 HG3 PRO A 15 16.735 13.689 -4.266 1.00 72.33 H new ATOM 0 HD2 PRO A 15 15.832 15.833 -5.821 1.00 2.53 H new ATOM 0 HD3 PRO A 15 15.759 14.159 -6.334 1.00 2.53 H new ATOM 265 N ILE A 16 11.930 16.347 -3.532 1.00 5.22 N ATOM 266 CA ILE A 16 11.435 17.430 -2.681 1.00 33.24 C ATOM 267 C ILE A 16 9.905 17.488 -2.752 1.00 2.43 C ATOM 268 O ILE A 16 9.349 17.812 -3.796 1.00 13.51 O ATOM 269 CB ILE A 16 12.142 18.776 -2.981 1.00 21.23 C ATOM 270 CG1 ILE A 16 11.676 19.861 -1.989 1.00 61.43 C ATOM 271 CG2 ILE A 16 12.062 19.246 -4.446 1.00 62.25 C ATOM 272 CD1 ILE A 16 12.750 20.931 -1.761 1.00 33.04 C ATOM 0 H ILE A 16 11.264 16.043 -4.242 1.00 5.22 H new ATOM 0 HA ILE A 16 11.693 17.220 -1.643 1.00 33.24 H new ATOM 0 HB ILE A 16 13.206 18.592 -2.831 1.00 21.23 H new ATOM 0 HG12 ILE A 16 10.769 20.333 -2.367 1.00 61.43 H new ATOM 0 HG13 ILE A 16 11.420 19.396 -1.037 1.00 61.43 H new ATOM 0 HG21 ILE A 16 12.586 20.196 -4.553 1.00 62.25 H new ATOM 0 HG22 ILE A 16 12.526 18.501 -5.093 1.00 62.25 H new ATOM 0 HG23 ILE A 16 11.018 19.374 -4.731 1.00 62.25 H new ATOM 0 HD11 ILE A 16 12.379 21.675 -1.056 1.00 33.04 H new ATOM 0 HD12 ILE A 16 13.648 20.464 -1.357 1.00 33.04 H new ATOM 0 HD13 ILE A 16 12.987 21.416 -2.708 1.00 33.04 H new ATOM 284 N ALA A 17 9.230 17.148 -1.648 1.00 52.21 N ATOM 285 CA ALA A 17 7.764 17.200 -1.541 1.00 22.03 C ATOM 286 C ALA A 17 7.236 17.306 -0.099 1.00 32.11 C ATOM 287 O ALA A 17 6.032 17.494 0.098 1.00 31.24 O ATOM 288 CB ALA A 17 7.158 15.947 -2.191 1.00 70.12 C ATOM 0 H ALA A 17 9.688 16.826 -0.795 1.00 52.21 H new ATOM 0 HA ALA A 17 7.462 18.112 -2.055 1.00 22.03 H new ATOM 0 HB1 ALA A 17 6.072 15.985 -2.112 1.00 70.12 H new ATOM 0 HB2 ALA A 17 7.444 15.908 -3.242 1.00 70.12 H new ATOM 0 HB3 ALA A 17 7.528 15.058 -1.681 1.00 70.12 H new ATOM 294 N GLY A 18 8.082 17.185 0.930 1.00 51.25 N ATOM 295 CA GLY A 18 7.639 16.976 2.305 1.00 2.42 C ATOM 296 C GLY A 18 6.937 15.629 2.424 1.00 70.02 C ATOM 297 O GLY A 18 7.624 14.608 2.435 1.00 45.35 O ATOM 0 H GLY A 18 9.096 17.230 0.828 1.00 51.25 H new ATOM 0 HA2 GLY A 18 8.493 17.012 2.981 1.00 2.42 H new ATOM 0 HA3 GLY A 18 6.962 17.776 2.604 1.00 2.42 H new ATOM 301 N GLU A 19 5.599 15.626 2.460 1.00 12.30 N ATOM 302 CA GLU A 19 4.765 14.436 2.665 1.00 61.42 C ATOM 303 C GLU A 19 4.973 13.817 4.067 1.00 32.14 C ATOM 304 O GLU A 19 5.821 14.307 4.824 1.00 45.11 O ATOM 305 CB GLU A 19 4.879 13.484 1.452 1.00 30.10 C ATOM 306 CG GLU A 19 3.539 13.421 0.693 1.00 31.34 C ATOM 307 CD GLU A 19 3.616 12.760 -0.678 1.00 12.50 C ATOM 308 OE1 GLU A 19 4.616 12.077 -0.982 1.00 34.02 O ATOM 309 OE2 GLU A 19 2.637 12.909 -1.447 1.00 21.10 O ATOM 0 H GLU A 19 5.050 16.478 2.344 1.00 12.30 H new ATOM 0 HA GLU A 19 3.711 14.714 2.689 1.00 61.42 H new ATOM 0 HB2 GLU A 19 5.668 13.829 0.783 1.00 30.10 H new ATOM 0 HB3 GLU A 19 5.161 12.487 1.789 1.00 30.10 H new ATOM 0 HG2 GLU A 19 2.816 12.879 1.303 1.00 31.34 H new ATOM 0 HG3 GLU A 19 3.157 14.435 0.572 1.00 31.34 H new ATOM 316 N PRO A 20 4.107 12.894 4.533 1.00 5.40 N ATOM 317 CA PRO A 20 4.116 12.434 5.919 1.00 70.14 C ATOM 318 C PRO A 20 5.267 11.454 6.166 1.00 51.35 C ATOM 319 O PRO A 20 6.014 11.127 5.243 1.00 10.54 O ATOM 320 CB PRO A 20 2.753 11.770 6.100 1.00 13.14 C ATOM 321 CG PRO A 20 2.542 11.107 4.749 1.00 34.32 C ATOM 322 CD PRO A 20 3.074 12.174 3.798 1.00 64.14 C ATOM 0 HA PRO A 20 4.273 13.243 6.632 1.00 70.14 H new ATOM 0 HB2 PRO A 20 2.757 11.045 6.914 1.00 13.14 H new ATOM 0 HB3 PRO A 20 1.972 12.496 6.324 1.00 13.14 H new ATOM 0 HG2 PRO A 20 3.092 10.170 4.662 1.00 34.32 H new ATOM 0 HG3 PRO A 20 1.492 10.879 4.564 1.00 34.32 H new ATOM 0 HD2 PRO A 20 3.483 11.722 2.894 1.00 64.14 H new ATOM 0 HD3 PRO A 20 2.277 12.849 3.484 1.00 64.14 H new ATOM 330 N GLN A 21 5.393 10.978 7.406 1.00 31.23 N ATOM 331 CA GLN A 21 6.352 9.954 7.801 1.00 5.33 C ATOM 332 C GLN A 21 5.989 8.619 7.137 1.00 52.41 C ATOM 333 O GLN A 21 5.239 7.837 7.713 1.00 30.32 O ATOM 334 CB GLN A 21 6.389 9.825 9.338 1.00 65.44 C ATOM 335 CG GLN A 21 7.022 11.040 10.046 1.00 3.20 C ATOM 336 CD GLN A 21 6.077 11.699 11.052 1.00 33.32 C ATOM 337 OE1 GLN A 21 5.575 11.064 11.979 1.00 44.45 O ATOM 338 NE2 GLN A 21 5.777 12.979 10.912 1.00 30.23 N ATOM 0 H GLN A 21 4.815 11.305 8.180 1.00 31.23 H new ATOM 0 HA GLN A 21 7.349 10.241 7.466 1.00 5.33 H new ATOM 0 HB2 GLN A 21 5.372 9.689 9.707 1.00 65.44 H new ATOM 0 HB3 GLN A 21 6.948 8.928 9.605 1.00 65.44 H new ATOM 0 HG2 GLN A 21 7.929 10.723 10.561 1.00 3.20 H new ATOM 0 HG3 GLN A 21 7.320 11.775 9.299 1.00 3.20 H new ATOM 0 HE21 GLN A 21 6.185 13.518 10.148 1.00 30.23 H new ATOM 0 HE22 GLN A 21 5.137 13.428 11.568 1.00 30.23 H new ATOM 347 N VAL A 22 6.570 8.358 5.967 1.00 72.24 N ATOM 348 CA VAL A 22 6.564 7.111 5.201 1.00 61.12 C ATOM 349 C VAL A 22 5.209 6.889 4.511 1.00 12.41 C ATOM 350 O VAL A 22 4.157 7.303 5.010 1.00 52.24 O ATOM 351 CB VAL A 22 7.077 5.937 6.074 1.00 62.45 C ATOM 352 CG1 VAL A 22 7.330 4.660 5.259 1.00 24.32 C ATOM 353 CG2 VAL A 22 8.404 6.339 6.748 1.00 30.42 C ATOM 0 H VAL A 22 7.106 9.080 5.486 1.00 72.24 H new ATOM 0 HA VAL A 22 7.272 7.175 4.375 1.00 61.12 H new ATOM 0 HB VAL A 22 6.300 5.728 6.809 1.00 62.45 H new ATOM 0 HG11 VAL A 22 7.688 3.871 5.921 1.00 24.32 H new ATOM 0 HG12 VAL A 22 6.402 4.342 4.784 1.00 24.32 H new ATOM 0 HG13 VAL A 22 8.080 4.859 4.494 1.00 24.32 H new ATOM 0 HG21 VAL A 22 8.765 5.514 7.362 1.00 30.42 H new ATOM 0 HG22 VAL A 22 9.144 6.573 5.983 1.00 30.42 H new ATOM 0 HG23 VAL A 22 8.242 7.215 7.376 1.00 30.42 H new ATOM 363 N LEU A 23 5.241 6.297 3.310 1.00 73.04 N ATOM 364 CA LEU A 23 4.065 6.105 2.471 1.00 32.30 C ATOM 365 C LEU A 23 4.310 4.954 1.493 1.00 32.10 C ATOM 366 O LEU A 23 5.429 4.748 1.022 1.00 5.50 O ATOM 367 CB LEU A 23 3.804 7.406 1.690 1.00 5.20 C ATOM 368 CG LEU A 23 2.397 7.515 1.073 1.00 62.01 C ATOM 369 CD1 LEU A 23 1.324 7.716 2.146 1.00 10.50 C ATOM 370 CD2 LEU A 23 2.387 8.708 0.114 1.00 5.10 C ATOM 0 H LEU A 23 6.099 5.935 2.894 1.00 73.04 H new ATOM 0 HA LEU A 23 3.201 5.862 3.089 1.00 32.30 H new ATOM 0 HB2 LEU A 23 3.959 8.253 2.359 1.00 5.20 H new ATOM 0 HB3 LEU A 23 4.543 7.490 0.893 1.00 5.20 H new ATOM 0 HG LEU A 23 2.169 6.587 0.548 1.00 62.01 H new ATOM 0 HD11 LEU A 23 0.345 7.788 1.672 1.00 10.50 H new ATOM 0 HD12 LEU A 23 1.333 6.870 2.833 1.00 10.50 H new ATOM 0 HD13 LEU A 23 1.529 8.633 2.698 1.00 10.50 H new ATOM 0 HD21 LEU A 23 1.399 8.805 -0.336 1.00 5.10 H new ATOM 0 HD22 LEU A 23 2.627 9.618 0.663 1.00 5.10 H new ATOM 0 HD23 LEU A 23 3.128 8.551 -0.669 1.00 5.10 H new ATOM 382 N GLU A 24 3.256 4.229 1.139 1.00 34.22 N ATOM 383 CA GLU A 24 3.267 3.094 0.230 1.00 1.20 C ATOM 384 C GLU A 24 2.023 3.144 -0.653 1.00 63.04 C ATOM 385 O GLU A 24 0.987 3.680 -0.244 1.00 4.10 O ATOM 386 CB GLU A 24 3.361 1.760 0.997 1.00 51.35 C ATOM 387 CG GLU A 24 2.499 1.630 2.258 1.00 71.33 C ATOM 388 CD GLU A 24 3.063 2.308 3.514 1.00 25.13 C ATOM 389 OE1 GLU A 24 2.728 3.479 3.801 1.00 71.35 O ATOM 390 OE2 GLU A 24 3.740 1.595 4.290 1.00 73.43 O ATOM 0 H GLU A 24 2.323 4.429 1.498 1.00 34.22 H new ATOM 0 HA GLU A 24 4.153 3.155 -0.403 1.00 1.20 H new ATOM 0 HB2 GLU A 24 3.089 0.955 0.314 1.00 51.35 H new ATOM 0 HB3 GLU A 24 4.402 1.602 1.278 1.00 51.35 H new ATOM 0 HG2 GLU A 24 1.515 2.050 2.050 1.00 71.33 H new ATOM 0 HG3 GLU A 24 2.355 0.571 2.471 1.00 71.33 H new ATOM 397 N PHE A 25 2.123 2.563 -1.852 1.00 71.05 N ATOM 398 CA PHE A 25 1.058 2.523 -2.847 1.00 64.24 C ATOM 399 C PHE A 25 0.949 1.102 -3.382 1.00 33.00 C ATOM 400 O PHE A 25 1.960 0.442 -3.634 1.00 50.55 O ATOM 401 CB PHE A 25 1.333 3.489 -4.006 1.00 74.01 C ATOM 402 CG PHE A 25 1.361 4.960 -3.643 1.00 65.14 C ATOM 403 CD1 PHE A 25 2.560 5.553 -3.203 1.00 44.33 C ATOM 404 CD2 PHE A 25 0.207 5.750 -3.806 1.00 45.34 C ATOM 405 CE1 PHE A 25 2.612 6.933 -2.947 1.00 3.41 C ATOM 406 CE2 PHE A 25 0.261 7.130 -3.540 1.00 74.31 C ATOM 407 CZ PHE A 25 1.460 7.720 -3.111 1.00 10.21 C ATOM 0 H PHE A 25 2.974 2.095 -2.162 1.00 71.05 H new ATOM 0 HA PHE A 25 0.125 2.830 -2.374 1.00 64.24 H new ATOM 0 HB2 PHE A 25 2.291 3.226 -4.454 1.00 74.01 H new ATOM 0 HB3 PHE A 25 0.571 3.337 -4.770 1.00 74.01 H new ATOM 0 HD1 PHE A 25 3.442 4.945 -3.062 1.00 44.33 H new ATOM 0 HD2 PHE A 25 -0.717 5.298 -4.134 1.00 45.34 H new ATOM 0 HE1 PHE A 25 3.537 7.389 -2.624 1.00 3.41 H new ATOM 0 HE2 PHE A 25 -0.623 7.738 -3.666 1.00 74.31 H new ATOM 0 HZ PHE A 25 1.497 8.780 -2.907 1.00 10.21 H new ATOM 417 N PHE A 26 -0.282 0.641 -3.575 1.00 41.32 N ATOM 418 CA PHE A 26 -0.641 -0.697 -4.032 1.00 10.52 C ATOM 419 C PHE A 26 -2.078 -0.659 -4.570 1.00 22.42 C ATOM 420 O PHE A 26 -2.696 0.409 -4.577 1.00 70.24 O ATOM 421 CB PHE A 26 -0.470 -1.708 -2.888 1.00 5.32 C ATOM 422 CG PHE A 26 -1.591 -1.795 -1.872 1.00 21.11 C ATOM 423 CD1 PHE A 26 -2.254 -0.643 -1.405 1.00 50.14 C ATOM 424 CD2 PHE A 26 -1.965 -3.057 -1.371 1.00 64.12 C ATOM 425 CE1 PHE A 26 -3.277 -0.759 -0.463 1.00 43.44 C ATOM 426 CE2 PHE A 26 -2.966 -3.160 -0.395 1.00 54.44 C ATOM 427 CZ PHE A 26 -3.602 -2.008 0.080 1.00 63.03 C ATOM 0 H PHE A 26 -1.102 1.224 -3.407 1.00 41.32 H new ATOM 0 HA PHE A 26 0.018 -1.020 -4.838 1.00 10.52 H new ATOM 0 HB2 PHE A 26 -0.334 -2.696 -3.327 1.00 5.32 H new ATOM 0 HB3 PHE A 26 0.450 -1.466 -2.357 1.00 5.32 H new ATOM 0 HD1 PHE A 26 -1.970 0.331 -1.776 1.00 50.14 H new ATOM 0 HD2 PHE A 26 -1.479 -3.948 -1.740 1.00 64.12 H new ATOM 0 HE1 PHE A 26 -3.821 0.120 -0.151 1.00 43.44 H new ATOM 0 HE2 PHE A 26 -3.246 -4.129 -0.010 1.00 54.44 H new ATOM 0 HZ PHE A 26 -4.342 -2.082 0.863 1.00 63.03 H new ATOM 437 N SER A 27 -2.622 -1.788 -5.041 1.00 53.54 N ATOM 438 CA SER A 27 -4.018 -1.844 -5.455 1.00 1.02 C ATOM 439 C SER A 27 -4.543 -3.278 -5.449 1.00 5.41 C ATOM 440 O SER A 27 -3.762 -4.228 -5.523 1.00 51.11 O ATOM 441 CB SER A 27 -4.144 -1.233 -6.854 1.00 33.33 C ATOM 442 OG SER A 27 -5.416 -0.642 -7.008 1.00 32.23 O ATOM 0 H SER A 27 -2.115 -2.667 -5.142 1.00 53.54 H new ATOM 0 HA SER A 27 -4.621 -1.276 -4.747 1.00 1.02 H new ATOM 0 HB2 SER A 27 -3.365 -0.485 -7.005 1.00 33.33 H new ATOM 0 HB3 SER A 27 -3.997 -2.003 -7.611 1.00 33.33 H new ATOM 0 HG SER A 27 -5.345 0.138 -7.597 1.00 32.23 H new ATOM 448 N PHE A 28 -5.868 -3.410 -5.441 1.00 13.20 N ATOM 449 CA PHE A 28 -6.590 -4.670 -5.359 1.00 70.13 C ATOM 450 C PHE A 28 -6.464 -5.490 -6.643 1.00 24.53 C ATOM 451 O PHE A 28 -6.300 -6.703 -6.561 1.00 43.31 O ATOM 452 CB PHE A 28 -8.065 -4.394 -5.049 1.00 41.34 C ATOM 453 CG PHE A 28 -8.299 -3.610 -3.775 1.00 12.21 C ATOM 454 CD1 PHE A 28 -8.325 -2.201 -3.788 1.00 14.14 C ATOM 455 CD2 PHE A 28 -8.468 -4.299 -2.561 1.00 1.20 C ATOM 456 CE1 PHE A 28 -8.539 -1.491 -2.595 1.00 54.44 C ATOM 457 CE2 PHE A 28 -8.642 -3.582 -1.366 1.00 70.24 C ATOM 458 CZ PHE A 28 -8.683 -2.181 -1.383 1.00 44.22 C ATOM 0 H PHE A 28 -6.491 -2.604 -5.494 1.00 13.20 H new ATOM 0 HA PHE A 28 -6.146 -5.260 -4.557 1.00 70.13 H new ATOM 0 HB2 PHE A 28 -8.503 -3.847 -5.884 1.00 41.34 H new ATOM 0 HB3 PHE A 28 -8.593 -5.345 -4.979 1.00 41.34 H new ATOM 0 HD1 PHE A 28 -8.180 -1.667 -4.716 1.00 14.14 H new ATOM 0 HD2 PHE A 28 -8.464 -5.379 -2.548 1.00 1.20 H new ATOM 0 HE1 PHE A 28 -8.593 -0.412 -2.611 1.00 54.44 H new ATOM 0 HE2 PHE A 28 -8.745 -4.112 -0.431 1.00 70.24 H new ATOM 0 HZ PHE A 28 -8.825 -1.633 -0.463 1.00 44.22 H new ATOM 468 N TYR A 29 -6.512 -4.861 -7.822 1.00 3.35 N ATOM 469 CA TYR A 29 -6.359 -5.519 -9.122 1.00 70.40 C ATOM 470 C TYR A 29 -4.901 -5.482 -9.613 1.00 42.42 C ATOM 471 O TYR A 29 -4.644 -5.638 -10.808 1.00 22.32 O ATOM 472 CB TYR A 29 -7.326 -4.902 -10.149 1.00 51.22 C ATOM 473 CG TYR A 29 -8.796 -5.214 -9.932 1.00 74.20 C ATOM 474 CD1 TYR A 29 -9.325 -6.453 -10.344 1.00 32.43 C ATOM 475 CD2 TYR A 29 -9.656 -4.242 -9.391 1.00 24.12 C ATOM 476 CE1 TYR A 29 -10.705 -6.710 -10.227 1.00 62.51 C ATOM 477 CE2 TYR A 29 -11.037 -4.473 -9.309 1.00 34.52 C ATOM 478 CZ TYR A 29 -11.572 -5.718 -9.710 1.00 53.02 C ATOM 479 OH TYR A 29 -12.916 -5.924 -9.636 1.00 61.34 O ATOM 0 H TYR A 29 -6.662 -3.855 -7.900 1.00 3.35 H new ATOM 0 HA TYR A 29 -6.618 -6.571 -9.003 1.00 70.40 H new ATOM 0 HB2 TYR A 29 -7.197 -3.820 -10.139 1.00 51.22 H new ATOM 0 HB3 TYR A 29 -7.042 -5.248 -11.143 1.00 51.22 H new ATOM 0 HD1 TYR A 29 -8.670 -7.209 -10.751 1.00 32.43 H new ATOM 0 HD2 TYR A 29 -9.249 -3.307 -9.035 1.00 24.12 H new ATOM 0 HE1 TYR A 29 -11.103 -7.667 -10.533 1.00 62.51 H new ATOM 0 HE2 TYR A 29 -11.692 -3.698 -8.939 1.00 34.52 H new ATOM 0 HH TYR A 29 -13.348 -5.132 -9.253 1.00 61.34 H new ATOM 489 N CYS A 30 -3.918 -5.235 -8.742 1.00 70.53 N ATOM 490 CA CYS A 30 -2.510 -5.370 -9.110 1.00 5.23 C ATOM 491 C CYS A 30 -2.034 -6.810 -8.854 1.00 53.42 C ATOM 492 O CYS A 30 -2.294 -7.326 -7.766 1.00 72.11 O ATOM 493 CB CYS A 30 -1.788 -4.419 -8.157 1.00 64.54 C ATOM 494 SG CYS A 30 0.011 -4.399 -8.138 1.00 30.22 S ATOM 0 H CYS A 30 -4.074 -4.941 -7.778 1.00 70.53 H new ATOM 0 HA CYS A 30 -2.327 -5.147 -10.161 1.00 5.23 H new ATOM 0 HB2 CYS A 30 -2.126 -3.408 -8.384 1.00 64.54 H new ATOM 0 HB3 CYS A 30 -2.125 -4.648 -7.146 1.00 64.54 H new ATOM 499 N PRO A 31 -1.185 -7.408 -9.709 1.00 22.53 N ATOM 500 CA PRO A 31 -0.719 -8.777 -9.498 1.00 42.00 C ATOM 501 C PRO A 31 0.471 -8.840 -8.541 1.00 41.22 C ATOM 502 O PRO A 31 0.472 -9.648 -7.615 1.00 61.13 O ATOM 503 CB PRO A 31 -0.349 -9.311 -10.884 1.00 23.25 C ATOM 504 CG PRO A 31 -0.003 -8.052 -11.681 1.00 71.41 C ATOM 505 CD PRO A 31 -0.920 -6.987 -11.077 1.00 54.10 C ATOM 0 HA PRO A 31 -1.495 -9.382 -9.029 1.00 42.00 H new ATOM 0 HB2 PRO A 31 0.496 -9.998 -10.835 1.00 23.25 H new ATOM 0 HB3 PRO A 31 -1.177 -9.856 -11.337 1.00 23.25 H new ATOM 0 HG2 PRO A 31 1.048 -7.785 -11.574 1.00 71.41 H new ATOM 0 HG3 PRO A 31 -0.191 -8.187 -12.746 1.00 71.41 H new ATOM 0 HD2 PRO A 31 -0.444 -6.007 -11.097 1.00 54.10 H new ATOM 0 HD3 PRO A 31 -1.847 -6.903 -11.645 1.00 54.10 H new ATOM 513 N HIS A 32 1.480 -7.982 -8.722 1.00 73.44 N ATOM 514 CA HIS A 32 2.643 -7.978 -7.840 1.00 11.32 C ATOM 515 C HIS A 32 2.201 -7.657 -6.413 1.00 32.23 C ATOM 516 O HIS A 32 2.594 -8.340 -5.468 1.00 23.14 O ATOM 517 CB HIS A 32 3.667 -6.963 -8.350 1.00 63.41 C ATOM 518 CG HIS A 32 4.420 -7.421 -9.578 1.00 12.12 C ATOM 519 ND1 HIS A 32 3.914 -8.070 -10.688 1.00 33.35 N ATOM 520 CD2 HIS A 32 5.754 -7.227 -9.794 1.00 5.42 C ATOM 521 CE1 HIS A 32 4.919 -8.238 -11.560 1.00 41.14 C ATOM 522 NE2 HIS A 32 6.051 -7.707 -11.073 1.00 1.34 N ATOM 0 H HIS A 32 1.512 -7.287 -9.468 1.00 73.44 H new ATOM 0 HA HIS A 32 3.113 -8.961 -7.836 1.00 11.32 H new ATOM 0 HB2 HIS A 32 3.156 -6.027 -8.577 1.00 63.41 H new ATOM 0 HB3 HIS A 32 4.382 -6.751 -7.555 1.00 63.41 H new ATOM 0 HD2 HIS A 32 6.454 -6.783 -9.102 1.00 5.42 H new ATOM 0 HE1 HIS A 32 4.830 -8.730 -12.517 1.00 41.14 H new ATOM 0 HE2 HIS A 32 6.954 -7.662 -11.545 1.00 1.34 H new ATOM 530 N CYS A 33 1.324 -6.660 -6.269 1.00 72.24 N ATOM 531 CA CYS A 33 0.796 -6.235 -4.986 1.00 43.31 C ATOM 532 C CYS A 33 0.111 -7.381 -4.237 1.00 54.54 C ATOM 533 O CYS A 33 0.186 -7.411 -3.014 1.00 71.23 O ATOM 534 CB CYS A 33 -0.197 -5.086 -5.159 1.00 2.43 C ATOM 535 SG CYS A 33 0.299 -3.704 -6.240 1.00 3.13 S ATOM 0 H CYS A 33 0.961 -6.123 -7.056 1.00 72.24 H new ATOM 0 HA CYS A 33 1.648 -5.898 -4.396 1.00 43.31 H new ATOM 0 HB2 CYS A 33 -1.127 -5.500 -5.548 1.00 2.43 H new ATOM 0 HB3 CYS A 33 -0.417 -4.679 -4.172 1.00 2.43 H new ATOM 540 N TYR A 34 -0.529 -8.316 -4.953 1.00 54.41 N ATOM 541 CA TYR A 34 -1.151 -9.494 -4.362 1.00 2.55 C ATOM 542 C TYR A 34 -0.111 -10.313 -3.609 1.00 23.43 C ATOM 543 O TYR A 34 -0.286 -10.598 -2.428 1.00 64.12 O ATOM 544 CB TYR A 34 -1.858 -10.330 -5.441 1.00 51.30 C ATOM 545 CG TYR A 34 -2.533 -11.567 -4.901 1.00 34.12 C ATOM 546 CD1 TYR A 34 -1.785 -12.751 -4.776 1.00 43.14 C ATOM 547 CD2 TYR A 34 -3.869 -11.534 -4.464 1.00 22.24 C ATOM 548 CE1 TYR A 34 -2.309 -13.854 -4.087 1.00 10.35 C ATOM 549 CE2 TYR A 34 -4.397 -12.632 -3.774 1.00 33.22 C ATOM 550 CZ TYR A 34 -3.596 -13.764 -3.519 1.00 42.13 C ATOM 551 OH TYR A 34 -4.039 -14.732 -2.682 1.00 62.22 O ATOM 0 H TYR A 34 -0.627 -8.269 -5.967 1.00 54.41 H new ATOM 0 HA TYR A 34 -1.909 -9.175 -3.647 1.00 2.55 H new ATOM 0 HB2 TYR A 34 -2.602 -9.709 -5.940 1.00 51.30 H new ATOM 0 HB3 TYR A 34 -1.129 -10.624 -6.196 1.00 51.30 H new ATOM 0 HD1 TYR A 34 -0.800 -12.811 -5.214 1.00 43.14 H new ATOM 0 HD2 TYR A 34 -4.484 -10.668 -4.659 1.00 22.24 H new ATOM 0 HE1 TYR A 34 -1.733 -14.763 -3.992 1.00 10.35 H new ATOM 0 HE2 TYR A 34 -5.422 -12.612 -3.436 1.00 33.22 H new ATOM 0 HH TYR A 34 -4.281 -14.334 -1.820 1.00 62.22 H new ATOM 561 N GLN A 35 0.998 -10.681 -4.261 1.00 11.45 N ATOM 562 CA GLN A 35 2.060 -11.411 -3.578 1.00 11.13 C ATOM 563 C GLN A 35 2.526 -10.616 -2.378 1.00 61.13 C ATOM 564 O GLN A 35 2.640 -11.193 -1.306 1.00 1.14 O ATOM 565 CB GLN A 35 3.273 -11.655 -4.482 1.00 34.01 C ATOM 566 CG GLN A 35 2.981 -12.354 -5.800 1.00 45.52 C ATOM 567 CD GLN A 35 2.610 -13.823 -5.707 1.00 62.24 C ATOM 568 OE1 GLN A 35 1.544 -14.190 -5.017 1.00 72.53 O flip ATOM 569 NE2 GLN A 35 3.237 -14.659 -6.339 1.00 32.14 N flip ATOM 0 H GLN A 35 1.178 -10.487 -5.246 1.00 11.45 H new ATOM 0 HA GLN A 35 1.647 -12.375 -3.283 1.00 11.13 H new ATOM 0 HB2 GLN A 35 3.742 -10.695 -4.697 1.00 34.01 H new ATOM 0 HB3 GLN A 35 4.001 -12.249 -3.930 1.00 34.01 H new ATOM 0 HG2 GLN A 35 2.167 -11.825 -6.296 1.00 45.52 H new ATOM 0 HG3 GLN A 35 3.859 -12.261 -6.440 1.00 45.52 H new ATOM 0 HE21 GLN A 35 4.060 -14.382 -6.874 1.00 32.14 H new ATOM 0 HE22 GLN A 35 2.937 -15.634 -6.332 1.00 32.14 H new ATOM 578 N PHE A 36 2.785 -9.323 -2.556 1.00 14.23 N ATOM 579 CA PHE A 36 3.337 -8.507 -1.496 1.00 22.21 C ATOM 580 C PHE A 36 2.407 -8.420 -0.285 1.00 74.12 C ATOM 581 O PHE A 36 2.922 -8.129 0.788 1.00 73.10 O ATOM 582 CB PHE A 36 3.707 -7.122 -2.037 1.00 65.42 C ATOM 583 CG PHE A 36 5.093 -7.065 -2.658 1.00 34.44 C ATOM 584 CD1 PHE A 36 5.398 -7.807 -3.814 1.00 65.31 C ATOM 585 CD2 PHE A 36 6.099 -6.293 -2.052 1.00 22.24 C ATOM 586 CE1 PHE A 36 6.687 -7.767 -4.369 1.00 34.03 C ATOM 587 CE2 PHE A 36 7.391 -6.251 -2.602 1.00 61.43 C ATOM 588 CZ PHE A 36 7.683 -6.984 -3.766 1.00 70.03 C ATOM 0 H PHE A 36 2.618 -8.823 -3.430 1.00 14.23 H new ATOM 0 HA PHE A 36 4.247 -8.990 -1.139 1.00 22.21 H new ATOM 0 HB2 PHE A 36 2.971 -6.823 -2.783 1.00 65.42 H new ATOM 0 HB3 PHE A 36 3.651 -6.397 -1.225 1.00 65.42 H new ATOM 0 HD1 PHE A 36 4.634 -8.413 -4.278 1.00 65.31 H new ATOM 0 HD2 PHE A 36 5.877 -5.729 -1.158 1.00 22.24 H new ATOM 0 HE1 PHE A 36 6.911 -8.338 -5.258 1.00 34.03 H new ATOM 0 HE2 PHE A 36 8.160 -5.656 -2.131 1.00 61.43 H new ATOM 0 HZ PHE A 36 8.673 -6.944 -4.195 1.00 70.03 H new ATOM 598 N GLU A 37 1.100 -8.700 -0.398 1.00 25.35 N ATOM 599 CA GLU A 37 0.148 -8.300 0.637 1.00 62.32 C ATOM 600 C GLU A 37 -0.828 -9.430 0.992 1.00 5.33 C ATOM 601 O GLU A 37 -1.774 -9.210 1.735 1.00 42.44 O ATOM 602 CB GLU A 37 -0.525 -7.000 0.165 1.00 13.43 C ATOM 603 CG GLU A 37 -1.035 -6.077 1.275 1.00 61.44 C ATOM 604 CD GLU A 37 0.057 -5.358 2.085 1.00 13.41 C ATOM 605 OE1 GLU A 37 1.049 -5.983 2.513 1.00 50.14 O ATOM 606 OE2 GLU A 37 -0.077 -4.117 2.261 1.00 5.24 O ATOM 0 H GLU A 37 0.686 -9.196 -1.187 1.00 25.35 H new ATOM 0 HA GLU A 37 0.657 -8.102 1.580 1.00 62.32 H new ATOM 0 HB2 GLU A 37 0.187 -6.445 -0.446 1.00 13.43 H new ATOM 0 HB3 GLU A 37 -1.364 -7.260 -0.480 1.00 13.43 H new ATOM 0 HG2 GLU A 37 -1.688 -5.326 0.829 1.00 61.44 H new ATOM 0 HG3 GLU A 37 -1.646 -6.664 1.961 1.00 61.44 H new ATOM 613 N GLU A 38 -0.569 -10.644 0.499 1.00 41.53 N ATOM 614 CA GLU A 38 -1.222 -11.892 0.864 1.00 45.30 C ATOM 615 C GLU A 38 -0.200 -13.017 1.055 1.00 71.33 C ATOM 616 O GLU A 38 -0.344 -13.850 1.949 1.00 45.24 O ATOM 617 CB GLU A 38 -2.151 -12.339 -0.274 1.00 50.33 C ATOM 618 CG GLU A 38 -3.400 -11.463 -0.417 1.00 41.51 C ATOM 619 CD GLU A 38 -4.664 -12.282 -0.086 1.00 11.54 C ATOM 620 OE1 GLU A 38 -5.077 -13.106 -0.937 1.00 32.41 O ATOM 621 OE2 GLU A 38 -5.165 -12.189 1.056 1.00 33.03 O ATOM 0 H GLU A 38 0.150 -10.784 -0.211 1.00 41.53 H new ATOM 0 HA GLU A 38 -1.768 -11.713 1.790 1.00 45.30 H new ATOM 0 HB2 GLU A 38 -1.597 -12.325 -1.213 1.00 50.33 H new ATOM 0 HB3 GLU A 38 -2.457 -13.370 -0.100 1.00 50.33 H new ATOM 0 HG2 GLU A 38 -3.329 -10.604 0.250 1.00 41.51 H new ATOM 0 HG3 GLU A 38 -3.466 -11.073 -1.433 1.00 41.51 H new ATOM 628 N VAL A 39 0.810 -13.094 0.180 1.00 64.02 N ATOM 629 CA VAL A 39 1.699 -14.250 0.122 1.00 10.23 C ATOM 630 C VAL A 39 2.965 -13.906 0.896 1.00 5.43 C ATOM 631 O VAL A 39 3.150 -14.339 2.033 1.00 21.03 O ATOM 632 CB VAL A 39 1.915 -14.716 -1.334 1.00 31.11 C ATOM 633 CG1 VAL A 39 2.863 -15.917 -1.459 1.00 2.52 C ATOM 634 CG2 VAL A 39 0.563 -15.096 -1.967 1.00 31.05 C ATOM 0 H VAL A 39 1.029 -12.364 -0.498 1.00 64.02 H new ATOM 0 HA VAL A 39 1.258 -15.123 0.604 1.00 10.23 H new ATOM 0 HB VAL A 39 2.377 -13.877 -1.854 1.00 31.11 H new ATOM 0 HG11 VAL A 39 2.968 -16.190 -2.509 1.00 2.52 H new ATOM 0 HG12 VAL A 39 3.840 -15.653 -1.053 1.00 2.52 H new ATOM 0 HG13 VAL A 39 2.455 -16.762 -0.904 1.00 2.52 H new ATOM 0 HG21 VAL A 39 0.722 -15.424 -2.994 1.00 31.05 H new ATOM 0 HG22 VAL A 39 0.107 -15.904 -1.394 1.00 31.05 H new ATOM 0 HG23 VAL A 39 -0.098 -14.229 -1.961 1.00 31.05 H new ATOM 644 N LEU A 40 3.806 -13.069 0.287 1.00 41.20 N ATOM 645 CA LEU A 40 5.033 -12.547 0.871 1.00 33.33 C ATOM 646 C LEU A 40 4.751 -11.707 2.127 1.00 33.42 C ATOM 647 O LEU A 40 5.608 -11.639 3.005 1.00 61.20 O ATOM 648 CB LEU A 40 5.788 -11.721 -0.189 1.00 63.33 C ATOM 649 CG LEU A 40 6.075 -12.458 -1.514 1.00 44.22 C ATOM 650 CD1 LEU A 40 6.810 -11.531 -2.490 1.00 52.14 C ATOM 651 CD2 LEU A 40 6.896 -13.736 -1.336 1.00 24.42 C ATOM 0 H LEU A 40 3.642 -12.726 -0.660 1.00 41.20 H new ATOM 0 HA LEU A 40 5.654 -13.385 1.186 1.00 33.33 H new ATOM 0 HB2 LEU A 40 5.208 -10.825 -0.409 1.00 63.33 H new ATOM 0 HB3 LEU A 40 6.735 -11.391 0.237 1.00 63.33 H new ATOM 0 HG LEU A 40 5.102 -12.747 -1.911 1.00 44.22 H new ATOM 0 HD11 LEU A 40 7.006 -12.064 -3.420 1.00 52.14 H new ATOM 0 HD12 LEU A 40 6.193 -10.656 -2.696 1.00 52.14 H new ATOM 0 HD13 LEU A 40 7.754 -11.213 -2.048 1.00 52.14 H new ATOM 0 HD21 LEU A 40 7.060 -14.202 -2.308 1.00 24.42 H new ATOM 0 HD22 LEU A 40 7.857 -13.491 -0.884 1.00 24.42 H new ATOM 0 HD23 LEU A 40 6.357 -14.428 -0.689 1.00 24.42 H new ATOM 663 N HIS A 41 3.566 -11.080 2.211 1.00 2.13 N ATOM 664 CA HIS A 41 3.081 -10.270 3.334 1.00 50.12 C ATOM 665 C HIS A 41 4.164 -9.316 3.858 1.00 11.45 C ATOM 666 O HIS A 41 4.543 -9.304 5.036 1.00 65.43 O ATOM 667 CB HIS A 41 2.397 -11.147 4.399 1.00 33.24 C ATOM 668 CG HIS A 41 0.890 -11.155 4.311 1.00 54.53 C ATOM 669 ND1 HIS A 41 0.076 -12.266 4.341 1.00 43.42 N ATOM 670 CD2 HIS A 41 0.071 -10.056 4.267 1.00 52.34 C ATOM 671 CE1 HIS A 41 -1.197 -11.844 4.328 1.00 42.33 C ATOM 672 NE2 HIS A 41 -1.246 -10.506 4.359 1.00 33.34 N ATOM 0 H HIS A 41 2.885 -11.129 1.453 1.00 2.13 H new ATOM 0 HA HIS A 41 2.294 -9.605 2.978 1.00 50.12 H new ATOM 0 HB2 HIS A 41 2.762 -12.170 4.302 1.00 33.24 H new ATOM 0 HB3 HIS A 41 2.691 -10.796 5.388 1.00 33.24 H new ATOM 0 HD2 HIS A 41 0.388 -9.028 4.177 1.00 52.34 H new ATOM 0 HE1 HIS A 41 -2.061 -12.492 4.297 1.00 42.33 H new ATOM 0 HE2 HIS A 41 -2.083 -9.929 4.435 1.00 33.34 H new ATOM 680 N VAL A 42 4.665 -8.491 2.946 1.00 72.22 N ATOM 681 CA VAL A 42 5.771 -7.583 3.158 1.00 11.44 C ATOM 682 C VAL A 42 5.407 -6.571 4.239 1.00 74.13 C ATOM 683 O VAL A 42 6.216 -6.364 5.134 1.00 12.15 O ATOM 684 CB VAL A 42 6.182 -6.952 1.814 1.00 1.42 C ATOM 685 CG1 VAL A 42 7.353 -5.972 1.962 1.00 34.25 C ATOM 686 CG2 VAL A 42 6.592 -8.070 0.841 1.00 33.35 C ATOM 0 H VAL A 42 4.290 -8.439 1.999 1.00 72.22 H new ATOM 0 HA VAL A 42 6.648 -8.114 3.527 1.00 11.44 H new ATOM 0 HB VAL A 42 5.325 -6.393 1.437 1.00 1.42 H new ATOM 0 HG11 VAL A 42 7.604 -5.555 0.987 1.00 34.25 H new ATOM 0 HG12 VAL A 42 7.070 -5.166 2.639 1.00 34.25 H new ATOM 0 HG13 VAL A 42 8.219 -6.498 2.365 1.00 34.25 H new ATOM 0 HG21 VAL A 42 6.885 -7.632 -0.113 1.00 33.35 H new ATOM 0 HG22 VAL A 42 7.432 -8.626 1.258 1.00 33.35 H new ATOM 0 HG23 VAL A 42 5.750 -8.746 0.688 1.00 33.35 H new ATOM 696 N SER A 43 4.204 -5.991 4.214 1.00 62.14 N ATOM 697 CA SER A 43 3.798 -4.949 5.150 1.00 5.41 C ATOM 698 C SER A 43 4.006 -5.375 6.610 1.00 42.50 C ATOM 699 O SER A 43 4.531 -4.598 7.413 1.00 5.42 O ATOM 700 CB SER A 43 2.350 -4.595 4.801 1.00 54.23 C ATOM 701 OG SER A 43 1.805 -3.469 5.467 1.00 2.33 O ATOM 0 H SER A 43 3.482 -6.236 3.537 1.00 62.14 H new ATOM 0 HA SER A 43 4.420 -4.059 5.055 1.00 5.41 H new ATOM 0 HB2 SER A 43 2.289 -4.421 3.727 1.00 54.23 H new ATOM 0 HB3 SER A 43 1.723 -5.460 5.020 1.00 54.23 H new ATOM 0 HG SER A 43 0.881 -3.330 5.172 1.00 2.33 H new ATOM 707 N ASP A 44 3.625 -6.600 6.981 1.00 72.33 N ATOM 708 CA ASP A 44 3.767 -7.037 8.371 1.00 64.04 C ATOM 709 C ASP A 44 5.218 -7.397 8.699 1.00 52.24 C ATOM 710 O ASP A 44 5.676 -7.178 9.818 1.00 32.42 O ATOM 711 CB ASP A 44 2.819 -8.188 8.713 1.00 51.52 C ATOM 712 CG ASP A 44 2.553 -8.176 10.222 1.00 51.54 C ATOM 713 OD1 ASP A 44 1.852 -7.235 10.671 1.00 63.31 O ATOM 714 OD2 ASP A 44 3.005 -9.094 10.942 1.00 33.43 O ATOM 0 H ASP A 44 3.223 -7.295 6.352 1.00 72.33 H new ATOM 0 HA ASP A 44 3.483 -6.192 8.998 1.00 64.04 H new ATOM 0 HB2 ASP A 44 1.883 -8.082 8.164 1.00 51.52 H new ATOM 0 HB3 ASP A 44 3.258 -9.140 8.415 1.00 51.52 H new ATOM 719 N ASN A 45 5.975 -7.862 7.699 1.00 50.42 N ATOM 720 CA ASN A 45 7.407 -8.117 7.824 1.00 41.30 C ATOM 721 C ASN A 45 8.158 -6.825 8.112 1.00 21.42 C ATOM 722 O ASN A 45 8.997 -6.796 9.012 1.00 24.11 O ATOM 723 CB ASN A 45 7.982 -8.739 6.548 1.00 53.41 C ATOM 724 CG ASN A 45 7.875 -10.246 6.541 1.00 11.45 C ATOM 725 OD1 ASN A 45 8.868 -10.946 6.705 1.00 13.31 O ATOM 726 ND2 ASN A 45 6.701 -10.792 6.290 1.00 53.23 N ATOM 0 H ASN A 45 5.603 -8.073 6.773 1.00 50.42 H new ATOM 0 HA ASN A 45 7.534 -8.816 8.650 1.00 41.30 H new ATOM 0 HB2 ASN A 45 7.456 -8.336 5.682 1.00 53.41 H new ATOM 0 HB3 ASN A 45 9.029 -8.452 6.447 1.00 53.41 H new ATOM 0 HD21 ASN A 45 6.613 -11.806 6.231 1.00 53.23 H new ATOM 0 HD22 ASN A 45 5.881 -10.200 6.155 1.00 53.23 H new ATOM 733 N VAL A 46 7.865 -5.753 7.361 1.00 4.14 N ATOM 734 CA VAL A 46 8.499 -4.470 7.619 1.00 44.40 C ATOM 735 C VAL A 46 8.161 -4.049 9.044 1.00 61.02 C ATOM 736 O VAL A 46 9.083 -3.777 9.804 1.00 1.51 O ATOM 737 CB VAL A 46 8.137 -3.354 6.621 1.00 30.02 C ATOM 738 CG1 VAL A 46 9.259 -2.313 6.589 1.00 50.11 C ATOM 739 CG2 VAL A 46 7.885 -3.780 5.171 1.00 45.31 C ATOM 0 H VAL A 46 7.203 -5.756 6.585 1.00 4.14 H new ATOM 0 HA VAL A 46 9.572 -4.612 7.487 1.00 44.40 H new ATOM 0 HB VAL A 46 7.188 -2.973 6.998 1.00 30.02 H new ATOM 0 HG11 VAL A 46 9.003 -1.523 5.883 1.00 50.11 H new ATOM 0 HG12 VAL A 46 9.386 -1.884 7.583 1.00 50.11 H new ATOM 0 HG13 VAL A 46 10.189 -2.790 6.279 1.00 50.11 H new ATOM 0 HG21 VAL A 46 7.640 -2.903 4.572 1.00 45.31 H new ATOM 0 HG22 VAL A 46 8.781 -4.255 4.770 1.00 45.31 H new ATOM 0 HG23 VAL A 46 7.055 -4.486 5.138 1.00 45.31 H new ATOM 749 N ARG A 47 6.880 -4.054 9.437 1.00 53.24 N ATOM 750 CA ARG A 47 6.430 -3.725 10.788 1.00 10.22 C ATOM 751 C ARG A 47 7.250 -4.445 11.853 1.00 71.41 C ATOM 752 O ARG A 47 7.680 -3.795 12.804 1.00 13.12 O ATOM 753 CB ARG A 47 4.927 -4.028 10.892 1.00 72.40 C ATOM 754 CG ARG A 47 4.376 -3.974 12.320 1.00 33.23 C ATOM 755 CD ARG A 47 2.864 -4.222 12.323 1.00 3.52 C ATOM 756 NE ARG A 47 2.395 -4.514 13.686 1.00 33.14 N ATOM 757 CZ ARG A 47 1.953 -5.695 14.138 1.00 42.30 C ATOM 758 NH1 ARG A 47 1.773 -6.734 13.333 1.00 64.41 N ATOM 759 NH2 ARG A 47 1.697 -5.846 15.428 1.00 12.22 N ATOM 0 H ARG A 47 6.114 -4.293 8.807 1.00 53.24 H new ATOM 0 HA ARG A 47 6.587 -2.663 10.976 1.00 10.22 H new ATOM 0 HB2 ARG A 47 4.380 -3.315 10.276 1.00 72.40 H new ATOM 0 HB3 ARG A 47 4.737 -5.018 10.478 1.00 72.40 H new ATOM 0 HG2 ARG A 47 4.874 -4.722 12.937 1.00 33.23 H new ATOM 0 HG3 ARG A 47 4.592 -3.001 12.762 1.00 33.23 H new ATOM 0 HD2 ARG A 47 2.345 -3.347 11.933 1.00 3.52 H new ATOM 0 HD3 ARG A 47 2.624 -5.056 11.663 1.00 3.52 H new ATOM 0 HE ARG A 47 2.408 -3.742 14.352 1.00 33.14 H new ATOM 0 HH11 ARG A 47 1.973 -6.648 12.336 1.00 64.41 H new ATOM 0 HH12 ARG A 47 1.435 -7.619 13.711 1.00 64.41 H new ATOM 0 HH21 ARG A 47 1.837 -5.066 16.070 1.00 12.22 H new ATOM 0 HH22 ARG A 47 1.360 -6.742 15.780 1.00 12.22 H new ATOM 773 N GLN A 48 7.497 -5.749 11.701 1.00 71.14 N ATOM 774 CA GLN A 48 8.277 -6.550 12.650 1.00 52.52 C ATOM 775 C GLN A 48 9.758 -6.135 12.758 1.00 64.13 C ATOM 776 O GLN A 48 10.487 -6.715 13.573 1.00 32.45 O ATOM 777 CB GLN A 48 8.146 -8.031 12.291 1.00 13.35 C ATOM 778 CG GLN A 48 6.777 -8.599 12.712 1.00 12.55 C ATOM 779 CD GLN A 48 6.964 -9.837 13.583 1.00 73.12 C ATOM 780 OE1 GLN A 48 7.345 -10.902 13.093 1.00 14.33 O ATOM 781 NE2 GLN A 48 6.797 -9.704 14.886 1.00 70.01 N ATOM 0 H GLN A 48 7.156 -6.286 10.904 1.00 71.14 H new ATOM 0 HA GLN A 48 7.859 -6.364 13.639 1.00 52.52 H new ATOM 0 HB2 GLN A 48 8.278 -8.158 11.217 1.00 13.35 H new ATOM 0 HB3 GLN A 48 8.940 -8.596 12.779 1.00 13.35 H new ATOM 0 HG2 GLN A 48 6.214 -7.843 13.259 1.00 12.55 H new ATOM 0 HG3 GLN A 48 6.193 -8.853 11.827 1.00 12.55 H new ATOM 0 HE21 GLN A 48 6.481 -8.814 15.271 1.00 70.01 H new ATOM 0 HE22 GLN A 48 6.984 -10.491 15.507 1.00 70.01 H new ATOM 790 N LYS A 49 10.213 -5.156 11.968 1.00 13.14 N ATOM 791 CA LYS A 49 11.570 -4.613 11.916 1.00 1.45 C ATOM 792 C LYS A 49 11.623 -3.081 11.947 1.00 1.53 C ATOM 793 O LYS A 49 12.724 -2.526 12.029 1.00 41.20 O ATOM 794 CB LYS A 49 12.222 -5.110 10.610 1.00 22.41 C ATOM 795 CG LYS A 49 12.827 -6.513 10.718 1.00 65.10 C ATOM 796 CD LYS A 49 13.992 -6.497 11.715 1.00 5.24 C ATOM 797 CE LYS A 49 14.977 -7.637 11.468 1.00 3.34 C ATOM 798 NZ LYS A 49 16.280 -7.323 12.083 1.00 45.44 N ATOM 0 H LYS A 49 9.596 -4.691 11.302 1.00 13.14 H new ATOM 0 HA LYS A 49 12.099 -4.956 12.805 1.00 1.45 H new ATOM 0 HB2 LYS A 49 11.474 -5.107 9.817 1.00 22.41 H new ATOM 0 HB3 LYS A 49 13.003 -4.409 10.315 1.00 22.41 H new ATOM 0 HG2 LYS A 49 12.067 -7.223 11.043 1.00 65.10 H new ATOM 0 HG3 LYS A 49 13.177 -6.845 9.740 1.00 65.10 H new ATOM 0 HD2 LYS A 49 14.516 -5.544 11.644 1.00 5.24 H new ATOM 0 HD3 LYS A 49 13.601 -6.570 12.730 1.00 5.24 H new ATOM 0 HE2 LYS A 49 14.584 -8.564 11.884 1.00 3.34 H new ATOM 0 HE3 LYS A 49 15.101 -7.796 10.397 1.00 3.34 H new ATOM 0 HZ1 LYS A 49 16.943 -8.105 11.909 1.00 45.44 H new ATOM 0 HZ2 LYS A 49 16.659 -6.449 11.666 1.00 45.44 H new ATOM 0 HZ3 LYS A 49 16.158 -7.194 13.108 1.00 45.44 H new ATOM 812 N LEU A 50 10.491 -2.385 11.815 1.00 2.13 N ATOM 813 CA LEU A 50 10.491 -0.957 11.505 1.00 73.23 C ATOM 814 C LEU A 50 11.073 -0.146 12.667 1.00 50.54 C ATOM 815 O LEU A 50 10.795 -0.472 13.827 1.00 74.15 O ATOM 816 CB LEU A 50 9.067 -0.451 11.196 1.00 54.51 C ATOM 817 CG LEU A 50 8.720 -0.424 9.691 1.00 53.13 C ATOM 818 CD1 LEU A 50 7.234 -0.202 9.378 1.00 30.14 C ATOM 819 CD2 LEU A 50 9.559 0.523 8.826 1.00 14.23 C ATOM 0 H LEU A 50 9.561 -2.791 11.919 1.00 2.13 H new ATOM 0 HA LEU A 50 11.114 -0.820 10.621 1.00 73.23 H new ATOM 0 HB2 LEU A 50 8.347 -1.086 11.712 1.00 54.51 H new ATOM 0 HB3 LEU A 50 8.954 0.554 11.602 1.00 54.51 H new ATOM 0 HG LEU A 50 8.988 -1.442 9.410 1.00 53.13 H new ATOM 0 HD11 LEU A 50 7.086 -0.198 8.298 1.00 30.14 H new ATOM 0 HD12 LEU A 50 6.645 -1.004 9.822 1.00 30.14 H new ATOM 0 HD13 LEU A 50 6.914 0.754 9.791 1.00 30.14 H new ATOM 0 HD21 LEU A 50 9.228 0.459 7.790 1.00 14.23 H new ATOM 0 HD22 LEU A 50 9.437 1.546 9.183 1.00 14.23 H new ATOM 0 HD23 LEU A 50 10.609 0.239 8.889 1.00 14.23 H new ATOM 831 N PRO A 51 11.799 0.950 12.384 1.00 13.40 N ATOM 832 CA PRO A 51 12.165 1.936 13.385 1.00 12.41 C ATOM 833 C PRO A 51 10.935 2.757 13.777 1.00 21.33 C ATOM 834 O PRO A 51 9.934 2.802 13.064 1.00 3.31 O ATOM 835 CB PRO A 51 13.211 2.822 12.709 1.00 34.40 C ATOM 836 CG PRO A 51 12.806 2.795 11.240 1.00 50.31 C ATOM 837 CD PRO A 51 12.116 1.450 11.056 1.00 3.22 C ATOM 0 HA PRO A 51 12.552 1.481 14.297 1.00 12.41 H new ATOM 0 HB2 PRO A 51 13.198 3.835 13.110 1.00 34.40 H new ATOM 0 HB3 PRO A 51 14.219 2.435 12.854 1.00 34.40 H new ATOM 0 HG2 PRO A 51 12.136 3.620 10.998 1.00 50.31 H new ATOM 0 HG3 PRO A 51 13.674 2.888 10.588 1.00 50.31 H new ATOM 0 HD2 PRO A 51 11.211 1.559 10.459 1.00 3.22 H new ATOM 0 HD3 PRO A 51 12.765 0.753 10.526 1.00 3.22 H new ATOM 845 N GLU A 52 11.033 3.487 14.882 1.00 33.31 N ATOM 846 CA GLU A 52 9.916 4.219 15.472 1.00 11.53 C ATOM 847 C GLU A 52 9.649 5.583 14.810 1.00 34.43 C ATOM 848 O GLU A 52 8.983 6.451 15.374 1.00 52.42 O ATOM 849 CB GLU A 52 10.192 4.331 16.980 1.00 30.43 C ATOM 850 CG GLU A 52 11.494 5.060 17.373 1.00 3.11 C ATOM 851 CD GLU A 52 11.302 6.571 17.513 1.00 11.24 C ATOM 852 OE1 GLU A 52 10.612 6.989 18.473 1.00 23.31 O ATOM 853 OE2 GLU A 52 11.769 7.334 16.632 1.00 65.22 O ATOM 0 H GLU A 52 11.904 3.589 15.402 1.00 33.31 H new ATOM 0 HA GLU A 52 8.991 3.670 15.296 1.00 11.53 H new ATOM 0 HB2 GLU A 52 9.353 4.849 17.446 1.00 30.43 H new ATOM 0 HB3 GLU A 52 10.220 3.326 17.401 1.00 30.43 H new ATOM 0 HG2 GLU A 52 11.862 4.655 18.316 1.00 3.11 H new ATOM 0 HG3 GLU A 52 12.258 4.863 16.621 1.00 3.11 H new ATOM 860 N GLY A 53 10.077 5.738 13.566 1.00 10.21 N ATOM 861 CA GLY A 53 10.061 6.966 12.774 1.00 71.34 C ATOM 862 C GLY A 53 9.091 6.877 11.597 1.00 22.33 C ATOM 863 O GLY A 53 9.254 7.598 10.615 1.00 13.13 O ATOM 0 H GLY A 53 10.473 4.956 13.044 1.00 10.21 H new ATOM 0 HA2 GLY A 53 9.781 7.805 13.412 1.00 71.34 H new ATOM 0 HA3 GLY A 53 11.065 7.170 12.402 1.00 71.34 H new ATOM 867 N THR A 54 8.153 5.933 11.637 1.00 10.22 N ATOM 868 CA THR A 54 7.399 5.488 10.479 1.00 72.14 C ATOM 869 C THR A 54 5.912 5.516 10.859 1.00 63.23 C ATOM 870 O THR A 54 5.502 4.983 11.899 1.00 13.42 O ATOM 871 CB THR A 54 7.972 4.098 10.105 1.00 43.45 C ATOM 872 OG1 THR A 54 7.814 3.756 8.746 1.00 63.23 O ATOM 873 CG2 THR A 54 7.401 2.985 10.974 1.00 65.15 C ATOM 0 H THR A 54 7.894 5.449 12.497 1.00 10.22 H new ATOM 0 HA THR A 54 7.487 6.118 9.594 1.00 72.14 H new ATOM 0 HB THR A 54 9.041 4.193 10.294 1.00 43.45 H new ATOM 0 HG1 THR A 54 7.736 2.783 8.661 1.00 63.23 H new ATOM 0 HG21 THR A 54 7.833 2.031 10.673 1.00 65.15 H new ATOM 0 HG22 THR A 54 7.642 3.179 12.019 1.00 65.15 H new ATOM 0 HG23 THR A 54 6.318 2.948 10.852 1.00 65.15 H new ATOM 881 N LYS A 55 5.083 6.146 10.029 1.00 1.11 N ATOM 882 CA LYS A 55 3.642 6.004 10.106 1.00 53.13 C ATOM 883 C LYS A 55 3.301 4.932 9.078 1.00 43.54 C ATOM 884 O LYS A 55 3.609 5.038 7.887 1.00 45.12 O ATOM 885 CB LYS A 55 2.967 7.354 9.833 1.00 61.42 C ATOM 886 CG LYS A 55 1.540 7.484 10.397 1.00 65.41 C ATOM 887 CD LYS A 55 0.487 6.638 9.669 1.00 23.22 C ATOM 888 CE LYS A 55 -0.784 6.520 10.507 1.00 51.33 C ATOM 889 NZ LYS A 55 -1.562 5.301 10.185 1.00 42.45 N ATOM 0 H LYS A 55 5.398 6.769 9.285 1.00 1.11 H new ATOM 0 HA LYS A 55 3.283 5.705 11.091 1.00 53.13 H new ATOM 0 HB2 LYS A 55 3.584 8.146 10.257 1.00 61.42 H new ATOM 0 HB3 LYS A 55 2.934 7.517 8.756 1.00 61.42 H new ATOM 0 HG2 LYS A 55 1.552 7.200 11.449 1.00 65.41 H new ATOM 0 HG3 LYS A 55 1.240 8.531 10.353 1.00 65.41 H new ATOM 0 HD2 LYS A 55 0.253 7.090 8.705 1.00 23.22 H new ATOM 0 HD3 LYS A 55 0.888 5.645 9.466 1.00 23.22 H new ATOM 0 HE2 LYS A 55 -0.519 6.510 11.564 1.00 51.33 H new ATOM 0 HE3 LYS A 55 -1.407 7.399 10.343 1.00 51.33 H new ATOM 0 HZ1 LYS A 55 -2.448 5.570 9.712 1.00 42.45 H new ATOM 0 HZ2 LYS A 55 -1.004 4.690 9.555 1.00 42.45 H new ATOM 0 HZ3 LYS A 55 -1.780 4.787 11.062 1.00 42.45 H new ATOM 903 N MET A 56 2.686 3.862 9.551 1.00 43.15 N ATOM 904 CA MET A 56 2.161 2.785 8.748 1.00 74.35 C ATOM 905 C MET A 56 1.003 3.336 7.917 1.00 10.40 C ATOM 906 O MET A 56 -0.081 3.585 8.455 1.00 71.22 O ATOM 907 CB MET A 56 1.730 1.683 9.718 1.00 73.13 C ATOM 908 CG MET A 56 1.715 0.316 9.123 1.00 72.15 C ATOM 909 SD MET A 56 2.147 -0.994 10.293 1.00 4.10 S ATOM 910 CE MET A 56 3.905 -0.595 10.479 1.00 70.24 C ATOM 0 H MET A 56 2.535 3.719 10.550 1.00 43.15 H new ATOM 0 HA MET A 56 2.888 2.368 8.051 1.00 74.35 H new ATOM 0 HB2 MET A 56 2.402 1.686 10.576 1.00 73.13 H new ATOM 0 HB3 MET A 56 0.733 1.915 10.093 1.00 73.13 H new ATOM 0 HG2 MET A 56 0.723 0.117 8.719 1.00 72.15 H new ATOM 0 HG3 MET A 56 2.412 0.287 8.285 1.00 72.15 H new ATOM 0 HE1 MET A 56 4.366 -1.298 11.173 1.00 70.24 H new ATOM 0 HE2 MET A 56 4.399 -0.665 9.510 1.00 70.24 H new ATOM 0 HE3 MET A 56 4.009 0.418 10.867 1.00 70.24 H new ATOM 920 N THR A 57 1.241 3.597 6.636 1.00 73.31 N ATOM 921 CA THR A 57 0.280 4.254 5.754 1.00 70.12 C ATOM 922 C THR A 57 -0.038 3.300 4.596 1.00 10.10 C ATOM 923 O THR A 57 0.297 2.113 4.686 1.00 5.24 O ATOM 924 CB THR A 57 0.815 5.648 5.366 1.00 11.44 C ATOM 925 OG1 THR A 57 1.522 6.226 6.448 1.00 44.34 O ATOM 926 CG2 THR A 57 -0.318 6.643 5.063 1.00 43.33 C ATOM 0 H THR A 57 2.118 3.355 6.174 1.00 73.31 H new ATOM 0 HA THR A 57 -0.676 4.456 6.237 1.00 70.12 H new ATOM 0 HB THR A 57 1.441 5.486 4.489 1.00 11.44 H new ATOM 0 HG1 THR A 57 2.299 5.669 6.666 1.00 44.34 H new ATOM 0 HG21 THR A 57 0.109 7.610 4.795 1.00 43.33 H new ATOM 0 HG22 THR A 57 -0.919 6.269 4.234 1.00 43.33 H new ATOM 0 HG23 THR A 57 -0.948 6.757 5.945 1.00 43.33 H new ATOM 934 N LYS A 58 -0.771 3.753 3.568 1.00 4.24 N ATOM 935 CA LYS A 58 -1.279 2.938 2.465 1.00 71.24 C ATOM 936 C LYS A 58 -2.175 3.825 1.590 1.00 24.01 C ATOM 937 O LYS A 58 -3.250 4.226 2.046 1.00 13.22 O ATOM 938 CB LYS A 58 -2.041 1.693 2.994 1.00 4.10 C ATOM 939 CG LYS A 58 -1.707 0.411 2.213 1.00 33.40 C ATOM 940 CD LYS A 58 -0.608 -0.478 2.811 1.00 43.41 C ATOM 941 CE LYS A 58 -1.049 -1.354 3.997 1.00 64.12 C ATOM 942 NZ LYS A 58 -0.706 -0.812 5.330 1.00 4.41 N ATOM 0 H LYS A 58 -1.034 4.735 3.483 1.00 4.24 H new ATOM 0 HA LYS A 58 -0.450 2.558 1.867 1.00 71.24 H new ATOM 0 HB2 LYS A 58 -1.799 1.545 4.046 1.00 4.10 H new ATOM 0 HB3 LYS A 58 -3.114 1.878 2.937 1.00 4.10 H new ATOM 0 HG2 LYS A 58 -2.617 -0.182 2.123 1.00 33.40 H new ATOM 0 HG3 LYS A 58 -1.409 0.693 1.203 1.00 33.40 H new ATOM 0 HD2 LYS A 58 -0.219 -1.126 2.026 1.00 43.41 H new ATOM 0 HD3 LYS A 58 0.215 0.158 3.136 1.00 43.41 H new ATOM 0 HE2 LYS A 58 -2.129 -1.495 3.945 1.00 64.12 H new ATOM 0 HE3 LYS A 58 -0.593 -2.339 3.892 1.00 64.12 H new ATOM 0 HZ1 LYS A 58 -0.771 -1.569 6.040 1.00 4.41 H new ATOM 0 HZ2 LYS A 58 0.263 -0.435 5.313 1.00 4.41 H new ATOM 0 HZ3 LYS A 58 -1.369 -0.050 5.576 1.00 4.41 H new ATOM 956 N TYR A 59 -1.760 4.195 0.378 1.00 42.15 N ATOM 957 CA TYR A 59 -2.589 4.948 -0.574 1.00 31.24 C ATOM 958 C TYR A 59 -3.007 4.038 -1.733 1.00 62.44 C ATOM 959 O TYR A 59 -2.283 3.101 -2.080 1.00 44.32 O ATOM 960 CB TYR A 59 -1.902 6.263 -1.006 1.00 21.00 C ATOM 961 CG TYR A 59 -2.147 7.522 -0.156 1.00 10.51 C ATOM 962 CD1 TYR A 59 -2.307 7.472 1.248 1.00 32.01 C ATOM 963 CD2 TYR A 59 -2.219 8.782 -0.793 1.00 44.45 C ATOM 964 CE1 TYR A 59 -2.544 8.646 1.990 1.00 74.15 C ATOM 965 CE2 TYR A 59 -2.432 9.972 -0.057 1.00 72.43 C ATOM 966 CZ TYR A 59 -2.590 9.901 1.342 1.00 3.41 C ATOM 967 OH TYR A 59 -2.805 11.035 2.065 1.00 33.22 O ATOM 0 H TYR A 59 -0.829 3.980 0.022 1.00 42.15 H new ATOM 0 HA TYR A 59 -3.510 5.268 -0.087 1.00 31.24 H new ATOM 0 HB2 TYR A 59 -0.827 6.084 -1.034 1.00 21.00 H new ATOM 0 HB3 TYR A 59 -2.216 6.483 -2.026 1.00 21.00 H new ATOM 0 HD1 TYR A 59 -2.247 6.522 1.758 1.00 32.01 H new ATOM 0 HD2 TYR A 59 -2.109 8.838 -1.866 1.00 44.45 H new ATOM 0 HE1 TYR A 59 -2.691 8.587 3.058 1.00 74.15 H new ATOM 0 HE2 TYR A 59 -2.473 10.926 -0.562 1.00 72.43 H new ATOM 0 HH TYR A 59 -2.370 11.793 1.622 1.00 33.22 H new ATOM 977 N HIS A 60 -4.213 4.261 -2.276 1.00 64.03 N ATOM 978 CA HIS A 60 -4.815 3.426 -3.300 1.00 33.20 C ATOM 979 C HIS A 60 -4.256 3.822 -4.684 1.00 72.12 C ATOM 980 O HIS A 60 -3.709 4.921 -4.818 1.00 14.22 O ATOM 981 CB HIS A 60 -6.336 3.667 -3.139 1.00 74.02 C ATOM 982 CG HIS A 60 -6.760 5.105 -3.365 1.00 14.54 C ATOM 983 ND1 HIS A 60 -6.249 5.985 -4.299 1.00 52.51 N ATOM 984 CD2 HIS A 60 -7.734 5.770 -2.677 1.00 12.30 C ATOM 985 CE1 HIS A 60 -6.917 7.142 -4.193 1.00 22.42 C ATOM 986 NE2 HIS A 60 -7.821 7.058 -3.204 1.00 50.45 N ATOM 0 H HIS A 60 -4.802 5.047 -2.002 1.00 64.03 H new ATOM 0 HA HIS A 60 -4.593 2.363 -3.206 1.00 33.20 H new ATOM 0 HB2 HIS A 60 -6.871 3.027 -3.840 1.00 74.02 H new ATOM 0 HB3 HIS A 60 -6.637 3.363 -2.136 1.00 74.02 H new ATOM 0 HD1 HIS A 60 -5.494 5.788 -4.956 1.00 52.51 H new ATOM 0 HD2 HIS A 60 -8.330 5.370 -1.870 1.00 12.30 H new ATOM 0 HE1 HIS A 60 -6.753 8.012 -4.811 1.00 22.42 H new ATOM 994 N VAL A 61 -4.495 3.037 -5.741 1.00 10.33 N ATOM 995 CA VAL A 61 -4.424 3.515 -7.128 1.00 74.45 C ATOM 996 C VAL A 61 -5.592 2.907 -7.913 1.00 22.12 C ATOM 997 O VAL A 61 -5.638 1.695 -8.139 1.00 2.24 O ATOM 998 CB VAL A 61 -3.059 3.290 -7.837 1.00 5.14 C ATOM 999 CG1 VAL A 61 -1.959 4.243 -7.350 1.00 21.24 C ATOM 1000 CG2 VAL A 61 -2.513 1.867 -7.775 1.00 11.40 C ATOM 0 H VAL A 61 -4.743 2.051 -5.659 1.00 10.33 H new ATOM 0 HA VAL A 61 -4.509 4.601 -7.098 1.00 74.45 H new ATOM 0 HB VAL A 61 -3.310 3.503 -8.876 1.00 5.14 H new ATOM 0 HG11 VAL A 61 -1.033 4.033 -7.885 1.00 21.24 H new ATOM 0 HG12 VAL A 61 -2.261 5.273 -7.538 1.00 21.24 H new ATOM 0 HG13 VAL A 61 -1.801 4.100 -6.281 1.00 21.24 H new ATOM 0 HG21 VAL A 61 -1.559 1.820 -8.299 1.00 11.40 H new ATOM 0 HG22 VAL A 61 -2.370 1.577 -6.734 1.00 11.40 H new ATOM 0 HG23 VAL A 61 -3.220 1.185 -8.247 1.00 11.40 H new ATOM 1010 N GLU A 62 -6.557 3.734 -8.311 1.00 2.43 N ATOM 1011 CA GLU A 62 -7.709 3.341 -9.124 1.00 4.01 C ATOM 1012 C GLU A 62 -7.378 3.205 -10.612 1.00 2.40 C ATOM 1013 O GLU A 62 -8.249 2.869 -11.412 1.00 23.52 O ATOM 1014 CB GLU A 62 -8.904 4.260 -8.858 1.00 10.02 C ATOM 1015 CG GLU A 62 -8.644 5.769 -8.720 1.00 30.30 C ATOM 1016 CD GLU A 62 -8.020 6.426 -9.948 1.00 44.25 C ATOM 1017 OE1 GLU A 62 -6.784 6.347 -10.121 1.00 14.33 O ATOM 1018 OE2 GLU A 62 -8.762 7.106 -10.692 1.00 2.11 O ATOM 0 H GLU A 62 -6.560 4.725 -8.070 1.00 2.43 H new ATOM 0 HA GLU A 62 -7.996 2.337 -8.811 1.00 4.01 H new ATOM 0 HB2 GLU A 62 -9.620 4.118 -9.668 1.00 10.02 H new ATOM 0 HB3 GLU A 62 -9.388 3.920 -7.942 1.00 10.02 H new ATOM 0 HG2 GLU A 62 -9.588 6.267 -8.499 1.00 30.30 H new ATOM 0 HG3 GLU A 62 -7.989 5.934 -7.865 1.00 30.30 H new ATOM 1025 N PHE A 63 -6.103 3.358 -10.967 1.00 64.52 N ATOM 1026 CA PHE A 63 -5.533 3.060 -12.273 1.00 32.52 C ATOM 1027 C PHE A 63 -5.782 1.603 -12.734 1.00 2.30 C ATOM 1028 O PHE A 63 -5.447 1.249 -13.872 1.00 24.12 O ATOM 1029 CB PHE A 63 -4.029 3.365 -12.167 1.00 21.41 C ATOM 1030 CG PHE A 63 -3.307 3.445 -13.492 1.00 63.22 C ATOM 1031 CD1 PHE A 63 -3.369 4.633 -14.244 1.00 3.22 C ATOM 1032 CD2 PHE A 63 -2.597 2.334 -13.986 1.00 72.15 C ATOM 1033 CE1 PHE A 63 -2.727 4.713 -15.490 1.00 71.54 C ATOM 1034 CE2 PHE A 63 -1.978 2.411 -15.244 1.00 11.44 C ATOM 1035 CZ PHE A 63 -2.045 3.594 -15.998 1.00 1.02 C ATOM 0 H PHE A 63 -5.405 3.713 -10.313 1.00 64.52 H new ATOM 0 HA PHE A 63 -6.017 3.672 -13.034 1.00 32.52 H new ATOM 0 HB2 PHE A 63 -3.900 4.311 -11.640 1.00 21.41 H new ATOM 0 HB3 PHE A 63 -3.558 2.594 -11.558 1.00 21.41 H new ATOM 0 HD1 PHE A 63 -3.912 5.485 -13.862 1.00 3.22 H new ATOM 0 HD2 PHE A 63 -2.529 1.429 -13.401 1.00 72.15 H new ATOM 0 HE1 PHE A 63 -2.757 5.632 -16.057 1.00 71.54 H new ATOM 0 HE2 PHE A 63 -1.447 1.555 -15.634 1.00 11.44 H new ATOM 0 HZ PHE A 63 -1.573 3.644 -16.968 1.00 1.02 H new ATOM 1045 N LEU A 64 -6.315 0.723 -11.871 1.00 45.15 N ATOM 1046 CA LEU A 64 -6.536 -0.695 -12.137 1.00 70.34 C ATOM 1047 C LEU A 64 -7.908 -1.116 -11.617 1.00 61.13 C ATOM 1048 O LEU A 64 -8.212 -0.906 -10.439 1.00 13.01 O ATOM 1049 CB LEU A 64 -5.479 -1.570 -11.441 1.00 21.24 C ATOM 1050 CG LEU A 64 -4.017 -1.217 -11.784 1.00 13.24 C ATOM 1051 CD1 LEU A 64 -3.248 -0.859 -10.511 1.00 31.40 C ATOM 1052 CD2 LEU A 64 -3.333 -2.362 -12.520 1.00 65.13 C ATOM 0 H LEU A 64 -6.613 0.997 -10.935 1.00 45.15 H new ATOM 0 HA LEU A 64 -6.469 -0.836 -13.216 1.00 70.34 H new ATOM 0 HB2 LEU A 64 -5.614 -1.489 -10.362 1.00 21.24 H new ATOM 0 HB3 LEU A 64 -5.658 -2.612 -11.707 1.00 21.24 H new ATOM 0 HG LEU A 64 -4.022 -0.351 -12.447 1.00 13.24 H new ATOM 0 HD11 LEU A 64 -2.217 -0.612 -10.766 1.00 31.40 H new ATOM 0 HD12 LEU A 64 -3.719 -0.001 -10.031 1.00 31.40 H new ATOM 0 HD13 LEU A 64 -3.259 -1.709 -9.828 1.00 31.40 H new ATOM 0 HD21 LEU A 64 -2.304 -2.084 -12.749 1.00 65.13 H new ATOM 0 HD22 LEU A 64 -3.338 -3.253 -11.892 1.00 65.13 H new ATOM 0 HD23 LEU A 64 -3.867 -2.569 -13.447 1.00 65.13 H new ATOM 1064 N GLY A 65 -8.663 -1.822 -12.456 1.00 24.32 N ATOM 1065 CA GLY A 65 -9.886 -2.534 -12.126 1.00 2.02 C ATOM 1066 C GLY A 65 -11.095 -1.966 -12.863 1.00 53.15 C ATOM 1067 O GLY A 65 -11.088 -0.782 -13.205 1.00 62.32 O ATOM 0 H GLY A 65 -8.419 -1.915 -13.442 1.00 24.32 H new ATOM 0 HA2 GLY A 65 -9.771 -3.588 -12.377 1.00 2.02 H new ATOM 0 HA3 GLY A 65 -10.058 -2.480 -11.051 1.00 2.02 H new ATOM 1071 N PRO A 66 -12.170 -2.755 -13.057 1.00 1.04 N ATOM 1072 CA PRO A 66 -13.455 -2.231 -13.502 1.00 54.43 C ATOM 1073 C PRO A 66 -14.005 -1.266 -12.452 1.00 53.14 C ATOM 1074 O PRO A 66 -14.186 -0.078 -12.714 1.00 50.44 O ATOM 1075 CB PRO A 66 -14.359 -3.460 -13.678 1.00 12.31 C ATOM 1076 CG PRO A 66 -13.709 -4.565 -12.849 1.00 61.54 C ATOM 1077 CD PRO A 66 -12.228 -4.199 -12.880 1.00 52.13 C ATOM 0 HA PRO A 66 -13.384 -1.670 -14.434 1.00 54.43 H new ATOM 0 HB2 PRO A 66 -15.372 -3.255 -13.333 1.00 12.31 H new ATOM 0 HB3 PRO A 66 -14.432 -3.747 -14.727 1.00 12.31 H new ATOM 0 HG2 PRO A 66 -14.097 -4.586 -11.831 1.00 61.54 H new ATOM 0 HG3 PRO A 66 -13.889 -5.550 -13.279 1.00 61.54 H new ATOM 0 HD2 PRO A 66 -11.734 -4.498 -11.956 1.00 52.13 H new ATOM 0 HD3 PRO A 66 -11.717 -4.712 -13.695 1.00 52.13 H new ATOM 1085 N LEU A 67 -14.142 -1.752 -11.219 1.00 2.20 N ATOM 1086 CA LEU A 67 -14.690 -1.030 -10.077 1.00 44.23 C ATOM 1087 C LEU A 67 -13.561 -0.321 -9.316 1.00 61.32 C ATOM 1088 O LEU A 67 -13.575 -0.257 -8.086 1.00 22.52 O ATOM 1089 CB LEU A 67 -15.457 -2.029 -9.194 1.00 51.25 C ATOM 1090 CG LEU A 67 -16.710 -2.642 -9.837 1.00 41.33 C ATOM 1091 CD1 LEU A 67 -17.183 -3.800 -8.961 1.00 51.41 C ATOM 1092 CD2 LEU A 67 -17.888 -1.676 -9.990 1.00 41.44 C ATOM 0 H LEU A 67 -13.861 -2.703 -10.981 1.00 2.20 H new ATOM 0 HA LEU A 67 -15.385 -0.256 -10.402 1.00 44.23 H new ATOM 0 HB2 LEU A 67 -14.780 -2.836 -8.914 1.00 51.25 H new ATOM 0 HB3 LEU A 67 -15.750 -1.525 -8.273 1.00 51.25 H new ATOM 0 HG LEU A 67 -16.414 -2.948 -10.841 1.00 41.33 H new ATOM 0 HD11 LEU A 67 -18.073 -4.249 -9.401 1.00 51.41 H new ATOM 0 HD12 LEU A 67 -16.395 -4.550 -8.892 1.00 51.41 H new ATOM 0 HD13 LEU A 67 -17.419 -3.429 -7.964 1.00 51.41 H new ATOM 0 HD21 LEU A 67 -18.727 -2.196 -10.453 1.00 41.44 H new ATOM 0 HD22 LEU A 67 -18.186 -1.307 -9.008 1.00 41.44 H new ATOM 0 HD23 LEU A 67 -17.591 -0.836 -10.618 1.00 41.44 H new ATOM 1104 N GLY A 68 -12.547 0.164 -10.039 1.00 25.51 N ATOM 1105 CA GLY A 68 -11.443 0.942 -9.493 1.00 70.54 C ATOM 1106 C GLY A 68 -11.969 2.152 -8.728 1.00 41.21 C ATOM 1107 O GLY A 68 -11.616 2.324 -7.564 1.00 21.53 O ATOM 0 H GLY A 68 -12.474 0.020 -11.046 1.00 25.51 H new ATOM 0 HA2 GLY A 68 -10.843 0.318 -8.830 1.00 70.54 H new ATOM 0 HA3 GLY A 68 -10.788 1.271 -10.300 1.00 70.54 H new ATOM 1111 N LYS A 69 -12.841 2.954 -9.353 1.00 13.12 N ATOM 1112 CA LYS A 69 -13.445 4.149 -8.750 1.00 64.35 C ATOM 1113 C LYS A 69 -14.196 3.826 -7.451 1.00 72.41 C ATOM 1114 O LYS A 69 -14.148 4.586 -6.483 1.00 53.31 O ATOM 1115 CB LYS A 69 -14.330 4.849 -9.799 1.00 71.33 C ATOM 1116 CG LYS A 69 -15.032 6.135 -9.329 1.00 4.32 C ATOM 1117 CD LYS A 69 -14.089 7.242 -8.815 1.00 5.31 C ATOM 1118 CE LYS A 69 -14.110 8.528 -9.653 1.00 1.31 C ATOM 1119 NZ LYS A 69 -13.465 8.363 -10.971 1.00 12.30 N ATOM 0 H LYS A 69 -13.152 2.787 -10.310 1.00 13.12 H new ATOM 0 HA LYS A 69 -12.655 4.839 -8.453 1.00 64.35 H new ATOM 0 HB2 LYS A 69 -13.714 5.089 -10.665 1.00 71.33 H new ATOM 0 HB3 LYS A 69 -15.090 4.144 -10.135 1.00 71.33 H new ATOM 0 HG2 LYS A 69 -15.619 6.534 -10.156 1.00 4.32 H new ATOM 0 HG3 LYS A 69 -15.734 5.879 -8.535 1.00 4.32 H new ATOM 0 HD2 LYS A 69 -14.361 7.487 -7.788 1.00 5.31 H new ATOM 0 HD3 LYS A 69 -13.071 6.854 -8.792 1.00 5.31 H new ATOM 0 HE2 LYS A 69 -15.143 8.846 -9.796 1.00 1.31 H new ATOM 0 HE3 LYS A 69 -13.605 9.323 -9.104 1.00 1.31 H new ATOM 0 HZ1 LYS A 69 -13.508 9.261 -11.493 1.00 12.30 H new ATOM 0 HZ2 LYS A 69 -12.471 8.087 -10.839 1.00 12.30 H new ATOM 0 HZ3 LYS A 69 -13.961 7.625 -11.510 1.00 12.30 H new ATOM 1133 N ASP A 70 -14.914 2.704 -7.421 1.00 42.42 N ATOM 1134 CA ASP A 70 -15.679 2.211 -6.284 1.00 53.14 C ATOM 1135 C ASP A 70 -14.740 1.836 -5.134 1.00 43.42 C ATOM 1136 O ASP A 70 -15.053 2.088 -3.965 1.00 72.33 O ATOM 1137 CB ASP A 70 -16.527 0.990 -6.701 1.00 70.12 C ATOM 1138 CG ASP A 70 -17.341 1.202 -7.987 1.00 62.55 C ATOM 1139 OD1 ASP A 70 -16.723 1.352 -9.067 1.00 54.35 O ATOM 1140 OD2 ASP A 70 -18.587 1.271 -7.897 1.00 52.45 O ATOM 0 H ASP A 70 -14.979 2.086 -8.230 1.00 42.42 H new ATOM 0 HA ASP A 70 -16.347 3.002 -5.944 1.00 53.14 H new ATOM 0 HB2 ASP A 70 -15.868 0.133 -6.838 1.00 70.12 H new ATOM 0 HB3 ASP A 70 -17.210 0.740 -5.889 1.00 70.12 H new ATOM 1145 N LEU A 71 -13.581 1.245 -5.451 1.00 23.53 N ATOM 1146 CA LEU A 71 -12.544 0.933 -4.470 1.00 32.32 C ATOM 1147 C LEU A 71 -11.910 2.202 -3.896 1.00 42.44 C ATOM 1148 O LEU A 71 -11.671 2.229 -2.689 1.00 52.44 O ATOM 1149 CB LEU A 71 -11.435 0.051 -5.069 1.00 25.21 C ATOM 1150 CG LEU A 71 -11.878 -1.383 -5.392 1.00 34.22 C ATOM 1151 CD1 LEU A 71 -10.902 -2.011 -6.394 1.00 53.31 C ATOM 1152 CD2 LEU A 71 -11.995 -2.255 -4.135 1.00 13.22 C ATOM 0 H LEU A 71 -13.339 0.970 -6.403 1.00 23.53 H new ATOM 0 HA LEU A 71 -13.041 0.385 -3.669 1.00 32.32 H new ATOM 0 HB2 LEU A 71 -11.066 0.520 -5.981 1.00 25.21 H new ATOM 0 HB3 LEU A 71 -10.599 0.013 -4.370 1.00 25.21 H new ATOM 0 HG LEU A 71 -12.873 -1.332 -5.833 1.00 34.22 H new ATOM 0 HD11 LEU A 71 -11.219 -3.029 -6.621 1.00 53.31 H new ATOM 0 HD12 LEU A 71 -10.891 -1.421 -7.310 1.00 53.31 H new ATOM 0 HD13 LEU A 71 -9.901 -2.030 -5.963 1.00 53.31 H new ATOM 0 HD21 LEU A 71 -12.311 -3.259 -4.417 1.00 13.22 H new ATOM 0 HD22 LEU A 71 -11.027 -2.306 -3.636 1.00 13.22 H new ATOM 0 HD23 LEU A 71 -12.730 -1.820 -3.458 1.00 13.22 H new ATOM 1164 N THR A 72 -11.641 3.228 -4.716 1.00 34.41 N ATOM 1165 CA THR A 72 -10.996 4.485 -4.308 1.00 5.22 C ATOM 1166 C THR A 72 -11.758 5.072 -3.125 1.00 52.55 C ATOM 1167 O THR A 72 -11.186 5.297 -2.059 1.00 72.31 O ATOM 1168 CB THR A 72 -11.012 5.515 -5.463 1.00 2.21 C ATOM 1169 OG1 THR A 72 -11.119 4.917 -6.718 1.00 65.53 O ATOM 1170 CG2 THR A 72 -9.796 6.423 -5.463 1.00 12.10 C ATOM 0 H THR A 72 -11.872 3.206 -5.709 1.00 34.41 H new ATOM 0 HA THR A 72 -9.962 4.272 -4.038 1.00 5.22 H new ATOM 0 HB THR A 72 -11.902 6.116 -5.277 1.00 2.21 H new ATOM 0 HG1 THR A 72 -11.175 5.611 -7.407 1.00 65.53 H new ATOM 0 HG21 THR A 72 -9.865 7.123 -6.296 1.00 12.10 H new ATOM 0 HG22 THR A 72 -9.756 6.977 -4.525 1.00 12.10 H new ATOM 0 HG23 THR A 72 -8.893 5.822 -5.568 1.00 12.10 H new ATOM 1178 N GLN A 73 -13.063 5.298 -3.317 1.00 3.31 N ATOM 1179 CA GLN A 73 -13.926 5.899 -2.316 1.00 45.45 C ATOM 1180 C GLN A 73 -13.980 4.995 -1.078 1.00 52.11 C ATOM 1181 O GLN A 73 -13.884 5.495 0.043 1.00 11.50 O ATOM 1182 CB GLN A 73 -15.290 6.189 -2.980 1.00 41.22 C ATOM 1183 CG GLN A 73 -16.270 6.972 -2.089 1.00 50.33 C ATOM 1184 CD GLN A 73 -17.436 7.636 -2.835 1.00 3.51 C ATOM 1185 OE1 GLN A 73 -17.511 7.663 -4.067 1.00 61.25 O ATOM 1186 NE2 GLN A 73 -18.354 8.242 -2.099 1.00 22.21 N ATOM 0 H GLN A 73 -13.546 5.063 -4.184 1.00 3.31 H new ATOM 0 HA GLN A 73 -13.547 6.853 -1.951 1.00 45.45 H new ATOM 0 HB2 GLN A 73 -15.122 6.752 -3.898 1.00 41.22 H new ATOM 0 HB3 GLN A 73 -15.751 5.243 -3.265 1.00 41.22 H new ATOM 0 HG2 GLN A 73 -16.677 6.294 -1.339 1.00 50.33 H new ATOM 0 HG3 GLN A 73 -15.715 7.742 -1.554 1.00 50.33 H new ATOM 0 HE21 GLN A 73 -18.289 8.218 -1.081 1.00 22.21 H new ATOM 0 HE22 GLN A 73 -19.126 8.733 -2.549 1.00 22.21 H new ATOM 1195 N ALA A 74 -14.079 3.671 -1.249 1.00 65.02 N ATOM 1196 CA ALA A 74 -14.122 2.733 -0.130 1.00 71.03 C ATOM 1197 C ALA A 74 -12.883 2.788 0.755 1.00 2.14 C ATOM 1198 O ALA A 74 -12.997 2.549 1.959 1.00 72.42 O ATOM 1199 CB ALA A 74 -14.326 1.302 -0.646 1.00 12.51 C ATOM 0 H ALA A 74 -14.131 3.225 -2.165 1.00 65.02 H new ATOM 0 HA ALA A 74 -14.966 3.035 0.490 1.00 71.03 H new ATOM 0 HB1 ALA A 74 -14.356 0.612 0.197 1.00 12.51 H new ATOM 0 HB2 ALA A 74 -15.265 1.244 -1.196 1.00 12.51 H new ATOM 0 HB3 ALA A 74 -13.502 1.032 -1.306 1.00 12.51 H new ATOM 1205 N TRP A 75 -11.717 3.109 0.197 1.00 12.41 N ATOM 1206 CA TRP A 75 -10.476 3.105 0.935 1.00 50.31 C ATOM 1207 C TRP A 75 -10.507 4.104 2.087 1.00 65.04 C ATOM 1208 O TRP A 75 -10.098 3.789 3.206 1.00 41.15 O ATOM 1209 CB TRP A 75 -9.362 3.411 -0.056 1.00 24.01 C ATOM 1210 CG TRP A 75 -8.011 3.093 0.448 1.00 11.21 C ATOM 1211 CD1 TRP A 75 -6.983 3.960 0.585 1.00 50.14 C ATOM 1212 CD2 TRP A 75 -7.547 1.808 0.942 1.00 31.03 C ATOM 1213 NE1 TRP A 75 -5.867 3.266 0.983 1.00 64.12 N ATOM 1214 CE2 TRP A 75 -6.168 1.947 1.222 1.00 13.52 C ATOM 1215 CE3 TRP A 75 -8.130 0.542 1.190 1.00 65.03 C ATOM 1216 CZ2 TRP A 75 -5.409 0.878 1.664 1.00 71.13 C ATOM 1217 CZ3 TRP A 75 -7.377 -0.519 1.728 1.00 53.42 C ATOM 1218 CH2 TRP A 75 -6.009 -0.346 1.974 1.00 33.02 C ATOM 0 H TRP A 75 -11.617 3.378 -0.782 1.00 12.41 H new ATOM 0 HA TRP A 75 -10.308 2.132 1.396 1.00 50.31 H new ATOM 0 HB2 TRP A 75 -9.539 2.848 -0.973 1.00 24.01 H new ATOM 0 HB3 TRP A 75 -9.402 4.468 -0.318 1.00 24.01 H new ATOM 0 HD1 TRP A 75 -7.032 5.025 0.410 1.00 50.14 H new ATOM 0 HE1 TRP A 75 -4.938 3.675 1.087 1.00 64.12 H new ATOM 0 HE3 TRP A 75 -9.174 0.387 0.962 1.00 65.03 H new ATOM 0 HZ2 TRP A 75 -4.340 0.990 1.771 1.00 71.13 H new ATOM 0 HZ3 TRP A 75 -7.852 -1.463 1.950 1.00 53.42 H new ATOM 0 HH2 TRP A 75 -5.424 -1.149 2.398 1.00 33.02 H new ATOM 1229 N ALA A 76 -11.072 5.289 1.848 1.00 21.34 N ATOM 1230 CA ALA A 76 -11.196 6.308 2.869 1.00 65.23 C ATOM 1231 C ALA A 76 -12.020 5.835 4.073 1.00 62.33 C ATOM 1232 O ALA A 76 -11.646 6.180 5.191 1.00 23.14 O ATOM 1233 CB ALA A 76 -11.766 7.577 2.258 1.00 24.00 C ATOM 0 H ALA A 76 -11.453 5.560 0.941 1.00 21.34 H new ATOM 0 HA ALA A 76 -10.200 6.521 3.257 1.00 65.23 H new ATOM 0 HB1 ALA A 76 -11.858 8.342 3.029 1.00 24.00 H new ATOM 0 HB2 ALA A 76 -11.101 7.933 1.471 1.00 24.00 H new ATOM 0 HB3 ALA A 76 -12.749 7.368 1.835 1.00 24.00 H new ATOM 1239 N VAL A 77 -13.081 5.025 3.904 1.00 65.25 N ATOM 1240 CA VAL A 77 -13.752 4.419 5.061 1.00 73.12 C ATOM 1241 C VAL A 77 -12.752 3.625 5.918 1.00 52.42 C ATOM 1242 O VAL A 77 -12.787 3.733 7.147 1.00 5.30 O ATOM 1243 CB VAL A 77 -14.924 3.512 4.622 1.00 30.43 C ATOM 1244 CG1 VAL A 77 -15.561 2.747 5.798 1.00 31.34 C ATOM 1245 CG2 VAL A 77 -16.028 4.300 3.914 1.00 4.34 C ATOM 0 H VAL A 77 -13.482 4.781 2.999 1.00 65.25 H new ATOM 0 HA VAL A 77 -14.161 5.229 5.665 1.00 73.12 H new ATOM 0 HB VAL A 77 -14.479 2.796 3.931 1.00 30.43 H new ATOM 0 HG11 VAL A 77 -16.378 2.127 5.429 1.00 31.34 H new ATOM 0 HG12 VAL A 77 -14.810 2.114 6.270 1.00 31.34 H new ATOM 0 HG13 VAL A 77 -15.947 3.458 6.528 1.00 31.34 H new ATOM 0 HG21 VAL A 77 -16.830 3.622 3.624 1.00 4.34 H new ATOM 0 HG22 VAL A 77 -16.422 5.060 4.588 1.00 4.34 H new ATOM 0 HG23 VAL A 77 -15.619 4.780 3.025 1.00 4.34 H new ATOM 1255 N ALA A 78 -11.912 2.795 5.285 1.00 22.24 N ATOM 1256 CA ALA A 78 -10.984 1.925 5.994 1.00 3.21 C ATOM 1257 C ALA A 78 -9.931 2.749 6.732 1.00 23.40 C ATOM 1258 O ALA A 78 -9.631 2.443 7.885 1.00 61.14 O ATOM 1259 CB ALA A 78 -10.321 0.923 5.042 1.00 11.10 C ATOM 0 H ALA A 78 -11.862 2.713 4.270 1.00 22.24 H new ATOM 0 HA ALA A 78 -11.554 1.357 6.729 1.00 3.21 H new ATOM 0 HB1 ALA A 78 -9.634 0.288 5.602 1.00 11.10 H new ATOM 0 HB2 ALA A 78 -11.087 0.304 4.574 1.00 11.10 H new ATOM 0 HB3 ALA A 78 -9.770 1.463 4.272 1.00 11.10 H new ATOM 1265 N ILE A 79 -9.383 3.788 6.097 1.00 1.22 N ATOM 1266 CA ILE A 79 -8.422 4.683 6.734 1.00 50.24 C ATOM 1267 C ILE A 79 -9.087 5.419 7.902 1.00 25.04 C ATOM 1268 O ILE A 79 -8.447 5.579 8.944 1.00 65.42 O ATOM 1269 CB ILE A 79 -7.811 5.645 5.688 1.00 53.25 C ATOM 1270 CG1 ILE A 79 -7.011 4.813 4.659 1.00 63.25 C ATOM 1271 CG2 ILE A 79 -6.918 6.713 6.354 1.00 22.14 C ATOM 1272 CD1 ILE A 79 -6.304 5.630 3.592 1.00 71.34 C ATOM 0 H ILE A 79 -9.594 4.030 5.129 1.00 1.22 H new ATOM 0 HA ILE A 79 -7.597 4.104 7.149 1.00 50.24 H new ATOM 0 HB ILE A 79 -8.614 6.181 5.182 1.00 53.25 H new ATOM 0 HG12 ILE A 79 -6.269 4.218 5.192 1.00 63.25 H new ATOM 0 HG13 ILE A 79 -7.690 4.114 4.171 1.00 63.25 H new ATOM 0 HG21 ILE A 79 -6.506 7.371 5.589 1.00 22.14 H new ATOM 0 HG22 ILE A 79 -7.513 7.299 7.055 1.00 22.14 H new ATOM 0 HG23 ILE A 79 -6.104 6.224 6.889 1.00 22.14 H new ATOM 0 HD11 ILE A 79 -5.770 4.962 2.916 1.00 71.34 H new ATOM 0 HD12 ILE A 79 -7.038 6.205 3.028 1.00 71.34 H new ATOM 0 HD13 ILE A 79 -5.596 6.310 4.065 1.00 71.34 H new ATOM 1284 N ALA A 80 -10.346 5.850 7.755 1.00 10.11 N ATOM 1285 CA ALA A 80 -11.052 6.614 8.780 1.00 31.30 C ATOM 1286 C ALA A 80 -11.322 5.783 10.043 1.00 32.24 C ATOM 1287 O ALA A 80 -11.491 6.356 11.117 1.00 32.42 O ATOM 1288 CB ALA A 80 -12.351 7.186 8.193 1.00 1.24 C ATOM 0 H ALA A 80 -10.902 5.676 6.918 1.00 10.11 H new ATOM 0 HA ALA A 80 -10.411 7.438 9.092 1.00 31.30 H new ATOM 0 HB1 ALA A 80 -12.877 7.756 8.959 1.00 1.24 H new ATOM 0 HB2 ALA A 80 -12.114 7.839 7.353 1.00 1.24 H new ATOM 0 HB3 ALA A 80 -12.986 6.369 7.849 1.00 1.24 H new ATOM 1294 N LEU A 81 -11.349 4.446 9.953 1.00 70.44 N ATOM 1295 CA LEU A 81 -11.384 3.573 11.135 1.00 13.53 C ATOM 1296 C LEU A 81 -10.006 3.006 11.490 1.00 1.24 C ATOM 1297 O LEU A 81 -9.841 2.451 12.577 1.00 62.33 O ATOM 1298 CB LEU A 81 -12.385 2.426 10.935 1.00 73.14 C ATOM 1299 CG LEU A 81 -13.830 2.879 10.682 1.00 73.01 C ATOM 1300 CD1 LEU A 81 -14.691 1.652 10.377 1.00 43.15 C ATOM 1301 CD2 LEU A 81 -14.427 3.667 11.853 1.00 25.12 C ATOM 0 H LEU A 81 -11.347 3.942 9.066 1.00 70.44 H new ATOM 0 HA LEU A 81 -11.707 4.195 11.970 1.00 13.53 H new ATOM 0 HB2 LEU A 81 -12.056 1.816 10.093 1.00 73.14 H new ATOM 0 HB3 LEU A 81 -12.367 1.787 11.818 1.00 73.14 H new ATOM 0 HG LEU A 81 -13.817 3.559 9.831 1.00 73.01 H new ATOM 0 HD11 LEU A 81 -15.719 1.965 10.196 1.00 43.15 H new ATOM 0 HD12 LEU A 81 -14.304 1.147 9.492 1.00 43.15 H new ATOM 0 HD13 LEU A 81 -14.664 0.968 11.226 1.00 43.15 H new ATOM 0 HD21 LEU A 81 -15.449 3.958 11.612 1.00 25.12 H new ATOM 0 HD22 LEU A 81 -14.428 3.044 12.748 1.00 25.12 H new ATOM 0 HD23 LEU A 81 -13.828 4.560 12.034 1.00 25.12 H new ATOM 1313 N GLY A 82 -9.011 3.139 10.613 1.00 63.22 N ATOM 1314 CA GLY A 82 -7.698 2.531 10.763 1.00 74.03 C ATOM 1315 C GLY A 82 -7.784 1.011 10.736 1.00 65.14 C ATOM 1316 O GLY A 82 -7.370 0.347 11.688 1.00 31.10 O ATOM 0 H GLY A 82 -9.103 3.688 9.758 1.00 63.22 H new ATOM 0 HA2 GLY A 82 -7.043 2.874 9.962 1.00 74.03 H new ATOM 0 HA3 GLY A 82 -7.250 2.855 11.702 1.00 74.03 H new ATOM 1320 N VAL A 83 -8.358 0.452 9.671 1.00 14.11 N ATOM 1321 CA VAL A 83 -8.589 -0.981 9.522 1.00 73.34 C ATOM 1322 C VAL A 83 -8.170 -1.491 8.143 1.00 25.34 C ATOM 1323 O VAL A 83 -8.550 -2.608 7.792 1.00 22.12 O ATOM 1324 CB VAL A 83 -10.053 -1.336 9.856 1.00 31.32 C ATOM 1325 CG1 VAL A 83 -10.393 -1.034 11.322 1.00 62.21 C ATOM 1326 CG2 VAL A 83 -11.050 -0.645 8.917 1.00 13.40 C ATOM 0 H VAL A 83 -8.682 0.996 8.871 1.00 14.11 H new ATOM 0 HA VAL A 83 -7.953 -1.497 10.241 1.00 73.34 H new ATOM 0 HB VAL A 83 -10.148 -2.411 9.701 1.00 31.32 H new ATOM 0 HG11 VAL A 83 -11.433 -1.298 11.516 1.00 62.21 H new ATOM 0 HG12 VAL A 83 -9.743 -1.617 11.974 1.00 62.21 H new ATOM 0 HG13 VAL A 83 -10.246 0.028 11.518 1.00 62.21 H new ATOM 0 HG21 VAL A 83 -12.066 -0.927 9.194 1.00 13.40 H new ATOM 0 HG22 VAL A 83 -10.938 0.436 9.000 1.00 13.40 H new ATOM 0 HG23 VAL A 83 -10.855 -0.952 7.890 1.00 13.40 H new ATOM 1336 N GLU A 84 -7.403 -0.712 7.369 1.00 51.34 N ATOM 1337 CA GLU A 84 -6.911 -1.084 6.040 1.00 10.53 C ATOM 1338 C GLU A 84 -6.370 -2.512 6.081 1.00 32.01 C ATOM 1339 O GLU A 84 -6.846 -3.418 5.406 1.00 1.13 O ATOM 1340 CB GLU A 84 -5.791 -0.142 5.552 1.00 13.41 C ATOM 1341 CG GLU A 84 -6.026 1.363 5.685 1.00 74.35 C ATOM 1342 CD GLU A 84 -5.388 1.879 6.985 1.00 73.32 C ATOM 1343 OE1 GLU A 84 -5.908 1.558 8.079 1.00 3.43 O ATOM 1344 OE2 GLU A 84 -4.317 2.523 6.926 1.00 30.13 O ATOM 0 H GLU A 84 -7.101 0.218 7.659 1.00 51.34 H new ATOM 0 HA GLU A 84 -7.748 -1.005 5.346 1.00 10.53 H new ATOM 0 HB2 GLU A 84 -4.881 -0.390 6.099 1.00 13.41 H new ATOM 0 HB3 GLU A 84 -5.601 -0.361 4.501 1.00 13.41 H new ATOM 0 HG2 GLU A 84 -5.599 1.884 4.828 1.00 74.35 H new ATOM 0 HG3 GLU A 84 -7.095 1.574 5.686 1.00 74.35 H new ATOM 1351 N ASP A 85 -5.413 -2.728 6.971 1.00 45.43 N ATOM 1352 CA ASP A 85 -4.640 -3.941 7.091 1.00 72.34 C ATOM 1353 C ASP A 85 -5.470 -5.093 7.673 1.00 14.15 C ATOM 1354 O ASP A 85 -5.011 -6.232 7.699 1.00 72.04 O ATOM 1355 CB ASP A 85 -3.464 -3.649 8.020 1.00 11.12 C ATOM 1356 CG ASP A 85 -2.539 -2.500 7.587 1.00 63.14 C ATOM 1357 OD1 ASP A 85 -2.985 -1.326 7.630 1.00 33.03 O ATOM 1358 OD2 ASP A 85 -1.345 -2.740 7.287 1.00 74.45 O ATOM 0 H ASP A 85 -5.147 -2.024 7.659 1.00 45.43 H new ATOM 0 HA ASP A 85 -4.305 -4.249 6.101 1.00 72.34 H new ATOM 0 HB2 ASP A 85 -3.856 -3.421 9.011 1.00 11.12 H new ATOM 0 HB3 ASP A 85 -2.866 -4.556 8.115 1.00 11.12 H new ATOM 1363 N LYS A 86 -6.680 -4.828 8.186 1.00 52.34 N ATOM 1364 CA LYS A 86 -7.630 -5.868 8.595 1.00 1.22 C ATOM 1365 C LYS A 86 -8.493 -6.304 7.416 1.00 30.03 C ATOM 1366 O LYS A 86 -8.954 -7.447 7.379 1.00 52.23 O ATOM 1367 CB LYS A 86 -8.558 -5.359 9.710 1.00 32.34 C ATOM 1368 CG LYS A 86 -7.795 -4.819 10.929 1.00 14.44 C ATOM 1369 CD LYS A 86 -8.726 -4.593 12.125 1.00 50.34 C ATOM 1370 CE LYS A 86 -7.938 -3.936 13.265 1.00 50.54 C ATOM 1371 NZ LYS A 86 -8.664 -3.955 14.554 1.00 11.10 N ATOM 0 H LYS A 86 -7.027 -3.880 8.329 1.00 52.34 H new ATOM 0 HA LYS A 86 -7.046 -6.712 8.961 1.00 1.22 H new ATOM 0 HB2 LYS A 86 -9.198 -4.572 9.311 1.00 32.34 H new ATOM 0 HB3 LYS A 86 -9.212 -6.170 10.029 1.00 32.34 H new ATOM 0 HG2 LYS A 86 -7.009 -5.521 11.207 1.00 14.44 H new ATOM 0 HG3 LYS A 86 -7.306 -3.881 10.666 1.00 14.44 H new ATOM 0 HD2 LYS A 86 -9.563 -3.959 11.834 1.00 50.34 H new ATOM 0 HD3 LYS A 86 -9.146 -5.542 12.458 1.00 50.34 H new ATOM 0 HE2 LYS A 86 -6.984 -4.450 13.384 1.00 50.54 H new ATOM 0 HE3 LYS A 86 -7.713 -2.904 12.996 1.00 50.54 H new ATOM 0 HZ1 LYS A 86 -8.084 -3.498 15.286 1.00 11.10 H new ATOM 0 HZ2 LYS A 86 -9.563 -3.441 14.454 1.00 11.10 H new ATOM 0 HZ3 LYS A 86 -8.857 -4.939 14.829 1.00 11.10 H new ATOM 1385 N ILE A 87 -8.754 -5.384 6.485 1.00 13.53 N ATOM 1386 CA ILE A 87 -9.708 -5.595 5.405 1.00 32.03 C ATOM 1387 C ILE A 87 -9.006 -5.956 4.105 1.00 32.02 C ATOM 1388 O ILE A 87 -9.679 -6.485 3.230 1.00 33.43 O ATOM 1389 CB ILE A 87 -10.731 -4.434 5.265 1.00 10.53 C ATOM 1390 CG1 ILE A 87 -10.195 -3.011 4.976 1.00 13.24 C ATOM 1391 CG2 ILE A 87 -11.609 -4.384 6.520 1.00 32.03 C ATOM 1392 CD1 ILE A 87 -10.237 -2.628 3.493 1.00 11.34 C ATOM 0 H ILE A 87 -8.305 -4.468 6.463 1.00 13.53 H new ATOM 0 HA ILE A 87 -10.314 -6.460 5.674 1.00 32.03 H new ATOM 0 HB ILE A 87 -11.274 -4.692 4.356 1.00 10.53 H new ATOM 0 HG12 ILE A 87 -10.780 -2.289 5.546 1.00 13.24 H new ATOM 0 HG13 ILE A 87 -9.167 -2.940 5.332 1.00 13.24 H new ATOM 0 HG21 ILE A 87 -12.329 -3.571 6.428 1.00 32.03 H new ATOM 0 HG22 ILE A 87 -12.141 -5.329 6.630 1.00 32.03 H new ATOM 0 HG23 ILE A 87 -10.982 -4.216 7.396 1.00 32.03 H new ATOM 0 HD11 ILE A 87 -9.846 -1.618 3.367 1.00 11.34 H new ATOM 0 HD12 ILE A 87 -9.628 -3.327 2.919 1.00 11.34 H new ATOM 0 HD13 ILE A 87 -11.266 -2.666 3.136 1.00 11.34 H new ATOM 1404 N THR A 88 -7.689 -5.762 3.981 1.00 73.12 N ATOM 1405 CA THR A 88 -6.960 -5.988 2.745 1.00 73.01 C ATOM 1406 C THR A 88 -7.111 -7.434 2.291 1.00 11.45 C ATOM 1407 O THR A 88 -7.476 -7.677 1.143 1.00 65.13 O ATOM 1408 CB THR A 88 -5.476 -5.610 2.931 1.00 30.14 C ATOM 1409 OG1 THR A 88 -5.327 -4.209 3.050 1.00 5.22 O ATOM 1410 CG2 THR A 88 -4.637 -6.036 1.729 1.00 43.43 C ATOM 0 H THR A 88 -7.100 -5.440 4.749 1.00 73.12 H new ATOM 0 HA THR A 88 -7.378 -5.352 1.965 1.00 73.01 H new ATOM 0 HB THR A 88 -5.140 -6.121 3.833 1.00 30.14 H new ATOM 0 HG1 THR A 88 -5.825 -3.892 3.833 1.00 5.22 H new ATOM 0 HG21 THR A 88 -3.597 -5.754 1.893 1.00 43.43 H new ATOM 0 HG22 THR A 88 -4.705 -7.117 1.603 1.00 43.43 H new ATOM 0 HG23 THR A 88 -5.009 -5.542 0.832 1.00 43.43 H new ATOM 1418 N ALA A 89 -6.834 -8.368 3.195 1.00 32.05 N ATOM 1419 CA ALA A 89 -6.680 -9.781 2.899 1.00 33.25 C ATOM 1420 C ALA A 89 -7.941 -10.335 2.224 1.00 31.15 C ATOM 1421 O ALA A 89 -7.899 -10.712 1.051 1.00 14.21 O ATOM 1422 CB ALA A 89 -6.317 -10.485 4.209 1.00 12.31 C ATOM 0 H ALA A 89 -6.707 -8.152 4.184 1.00 32.05 H new ATOM 0 HA ALA A 89 -5.879 -9.957 2.181 1.00 33.25 H new ATOM 0 HB1 ALA A 89 -6.193 -11.552 4.026 1.00 12.31 H new ATOM 0 HB2 ALA A 89 -5.386 -10.073 4.598 1.00 12.31 H new ATOM 0 HB3 ALA A 89 -7.114 -10.332 4.937 1.00 12.31 H new ATOM 1428 N PRO A 90 -9.104 -10.312 2.897 1.00 4.43 N ATOM 1429 CA PRO A 90 -10.306 -10.889 2.327 1.00 14.21 C ATOM 1430 C PRO A 90 -10.800 -10.115 1.099 1.00 24.03 C ATOM 1431 O PRO A 90 -11.434 -10.705 0.224 1.00 72.20 O ATOM 1432 CB PRO A 90 -11.311 -10.883 3.467 1.00 50.33 C ATOM 1433 CG PRO A 90 -10.869 -9.749 4.378 1.00 3.32 C ATOM 1434 CD PRO A 90 -9.365 -9.749 4.215 1.00 14.14 C ATOM 0 HA PRO A 90 -10.134 -11.896 1.947 1.00 14.21 H new ATOM 0 HB2 PRO A 90 -12.324 -10.721 3.099 1.00 50.33 H new ATOM 0 HB3 PRO A 90 -11.313 -11.836 3.996 1.00 50.33 H new ATOM 0 HG2 PRO A 90 -11.307 -8.797 4.079 1.00 3.32 H new ATOM 0 HG3 PRO A 90 -11.163 -9.925 5.413 1.00 3.32 H new ATOM 0 HD2 PRO A 90 -8.964 -8.739 4.294 1.00 14.14 H new ATOM 0 HD3 PRO A 90 -8.888 -10.343 4.995 1.00 14.14 H new ATOM 1442 N MET A 91 -10.498 -8.815 1.007 1.00 31.42 N ATOM 1443 CA MET A 91 -10.744 -8.028 -0.203 1.00 70.21 C ATOM 1444 C MET A 91 -9.962 -8.610 -1.378 1.00 31.21 C ATOM 1445 O MET A 91 -10.536 -8.803 -2.444 1.00 32.15 O ATOM 1446 CB MET A 91 -10.363 -6.546 -0.045 1.00 70.43 C ATOM 1447 CG MET A 91 -11.379 -5.577 -0.661 1.00 12.55 C ATOM 1448 SD MET A 91 -12.977 -5.368 0.178 1.00 10.35 S ATOM 1449 CE MET A 91 -12.461 -5.125 1.895 1.00 42.22 C ATOM 0 H MET A 91 -10.077 -8.282 1.768 1.00 31.42 H new ATOM 0 HA MET A 91 -11.817 -8.080 -0.387 1.00 70.21 H new ATOM 0 HB2 MET A 91 -10.256 -6.319 1.016 1.00 70.43 H new ATOM 0 HB3 MET A 91 -9.390 -6.379 -0.507 1.00 70.43 H new ATOM 0 HG2 MET A 91 -10.907 -4.597 -0.729 1.00 12.55 H new ATOM 0 HG3 MET A 91 -11.578 -5.906 -1.681 1.00 12.55 H new ATOM 0 HE1 MET A 91 -13.335 -4.914 2.511 1.00 42.22 H new ATOM 0 HE2 MET A 91 -11.970 -6.028 2.259 1.00 42.22 H new ATOM 0 HE3 MET A 91 -11.766 -4.287 1.951 1.00 42.22 H new ATOM 1459 N PHE A 92 -8.661 -8.874 -1.224 1.00 14.44 N ATOM 1460 CA PHE A 92 -7.838 -9.423 -2.294 1.00 24.15 C ATOM 1461 C PHE A 92 -8.339 -10.820 -2.641 1.00 50.51 C ATOM 1462 O PHE A 92 -8.423 -11.151 -3.826 1.00 25.33 O ATOM 1463 CB PHE A 92 -6.351 -9.423 -1.911 1.00 23.21 C ATOM 1464 CG PHE A 92 -5.629 -8.102 -2.154 1.00 13.31 C ATOM 1465 CD1 PHE A 92 -6.143 -6.889 -1.657 1.00 41.23 C ATOM 1466 CD2 PHE A 92 -4.410 -8.080 -2.858 1.00 74.01 C ATOM 1467 CE1 PHE A 92 -5.447 -5.686 -1.851 1.00 44.14 C ATOM 1468 CE2 PHE A 92 -3.694 -6.880 -3.017 1.00 63.10 C ATOM 1469 CZ PHE A 92 -4.220 -5.676 -2.529 1.00 73.44 C ATOM 0 H PHE A 92 -8.154 -8.712 -0.354 1.00 14.44 H new ATOM 0 HA PHE A 92 -7.926 -8.792 -3.178 1.00 24.15 H new ATOM 0 HB2 PHE A 92 -6.262 -9.681 -0.856 1.00 23.21 H new ATOM 0 HB3 PHE A 92 -5.845 -10.207 -2.475 1.00 23.21 H new ATOM 0 HD1 PHE A 92 -7.081 -6.884 -1.122 1.00 41.23 H new ATOM 0 HD2 PHE A 92 -4.021 -8.994 -3.280 1.00 74.01 H new ATOM 0 HE1 PHE A 92 -5.860 -4.761 -1.475 1.00 44.14 H new ATOM 0 HE2 PHE A 92 -2.736 -6.886 -3.516 1.00 63.10 H new ATOM 0 HZ PHE A 92 -3.685 -4.749 -2.674 1.00 73.44 H new ATOM 1479 N GLU A 93 -8.774 -11.607 -1.656 1.00 5.23 N ATOM 1480 CA GLU A 93 -9.441 -12.869 -1.929 1.00 52.12 C ATOM 1481 C GLU A 93 -10.739 -12.664 -2.727 1.00 73.02 C ATOM 1482 O GLU A 93 -11.063 -13.478 -3.586 1.00 65.13 O ATOM 1483 CB GLU A 93 -9.660 -13.681 -0.634 1.00 31.41 C ATOM 1484 CG GLU A 93 -8.986 -15.049 -0.801 1.00 73.24 C ATOM 1485 CD GLU A 93 -9.187 -16.041 0.345 1.00 52.31 C ATOM 1486 OE1 GLU A 93 -10.218 -16.758 0.338 1.00 70.44 O ATOM 1487 OE2 GLU A 93 -8.264 -16.226 1.165 1.00 4.23 O ATOM 0 H GLU A 93 -8.674 -11.388 -0.665 1.00 5.23 H new ATOM 0 HA GLU A 93 -8.783 -13.463 -2.563 1.00 52.12 H new ATOM 0 HB2 GLU A 93 -9.239 -13.152 0.221 1.00 31.41 H new ATOM 0 HB3 GLU A 93 -10.725 -13.804 -0.439 1.00 31.41 H new ATOM 0 HG2 GLU A 93 -9.357 -15.505 -1.719 1.00 73.24 H new ATOM 0 HG3 GLU A 93 -7.916 -14.891 -0.934 1.00 73.24 H new ATOM 1494 N ALA A 94 -11.462 -11.563 -2.537 1.00 51.40 N ATOM 1495 CA ALA A 94 -12.739 -11.335 -3.198 1.00 53.32 C ATOM 1496 C ALA A 94 -12.590 -10.636 -4.554 1.00 30.15 C ATOM 1497 O ALA A 94 -13.507 -10.673 -5.378 1.00 4.42 O ATOM 1498 CB ALA A 94 -13.639 -10.547 -2.244 1.00 65.11 C ATOM 0 H ALA A 94 -11.176 -10.804 -1.919 1.00 51.40 H new ATOM 0 HA ALA A 94 -13.196 -12.298 -3.426 1.00 53.32 H new ATOM 0 HB1 ALA A 94 -14.603 -10.365 -2.720 1.00 65.11 H new ATOM 0 HB2 ALA A 94 -13.789 -11.120 -1.329 1.00 65.11 H new ATOM 0 HB3 ALA A 94 -13.168 -9.594 -2.003 1.00 65.11 H new ATOM 1504 N VAL A 95 -11.440 -10.020 -4.810 1.00 12.11 N ATOM 1505 CA VAL A 95 -11.156 -9.252 -6.015 1.00 5.03 C ATOM 1506 C VAL A 95 -10.328 -10.102 -6.978 1.00 12.33 C ATOM 1507 O VAL A 95 -10.625 -10.123 -8.172 1.00 11.15 O ATOM 1508 CB VAL A 95 -10.468 -7.922 -5.632 1.00 24.14 C ATOM 1509 CG1 VAL A 95 -9.938 -7.209 -6.874 1.00 51.41 C ATOM 1510 CG2 VAL A 95 -11.457 -6.971 -4.940 1.00 2.41 C ATOM 0 H VAL A 95 -10.654 -10.043 -4.161 1.00 12.11 H new ATOM 0 HA VAL A 95 -12.079 -8.992 -6.533 1.00 5.03 H new ATOM 0 HB VAL A 95 -9.649 -8.171 -4.957 1.00 24.14 H new ATOM 0 HG11 VAL A 95 -9.458 -6.275 -6.581 1.00 51.41 H new ATOM 0 HG12 VAL A 95 -9.212 -7.847 -7.378 1.00 51.41 H new ATOM 0 HG13 VAL A 95 -10.765 -6.995 -7.551 1.00 51.41 H new ATOM 0 HG21 VAL A 95 -10.948 -6.043 -4.681 1.00 2.41 H new ATOM 0 HG22 VAL A 95 -12.286 -6.755 -5.614 1.00 2.41 H new ATOM 0 HG23 VAL A 95 -11.840 -7.440 -4.034 1.00 2.41 H new ATOM 1520 N GLN A 96 -9.321 -10.819 -6.477 1.00 4.11 N ATOM 1521 CA GLN A 96 -8.423 -11.638 -7.278 1.00 45.21 C ATOM 1522 C GLN A 96 -8.858 -13.093 -7.232 1.00 4.43 C ATOM 1523 O GLN A 96 -9.132 -13.690 -8.269 1.00 11.33 O ATOM 1524 CB GLN A 96 -6.979 -11.498 -6.808 1.00 22.32 C ATOM 1525 CG GLN A 96 -6.544 -10.055 -7.063 1.00 3.12 C ATOM 1526 CD GLN A 96 -5.066 -9.916 -7.356 1.00 41.14 C ATOM 1527 OE1 GLN A 96 -4.371 -10.814 -7.827 1.00 53.10 O ATOM 1528 NE2 GLN A 96 -4.553 -8.746 -7.087 1.00 5.13 N ATOM 0 H GLN A 96 -9.106 -10.844 -5.480 1.00 4.11 H new ATOM 0 HA GLN A 96 -8.474 -11.286 -8.309 1.00 45.21 H new ATOM 0 HB2 GLN A 96 -6.897 -11.741 -5.749 1.00 22.32 H new ATOM 0 HB3 GLN A 96 -6.333 -12.193 -7.345 1.00 22.32 H new ATOM 0 HG2 GLN A 96 -7.113 -9.655 -7.903 1.00 3.12 H new ATOM 0 HG3 GLN A 96 -6.793 -9.449 -6.192 1.00 3.12 H new ATOM 0 HE21 GLN A 96 -5.140 -8.009 -6.696 1.00 5.13 H new ATOM 0 HE22 GLN A 96 -3.565 -8.569 -7.267 1.00 5.13 H new ATOM 1537 N LYS A 97 -8.881 -13.696 -6.043 1.00 22.24 N ATOM 1538 CA LYS A 97 -9.011 -15.143 -5.924 1.00 61.11 C ATOM 1539 C LYS A 97 -10.375 -15.601 -6.424 1.00 64.41 C ATOM 1540 O LYS A 97 -10.428 -16.432 -7.329 1.00 21.15 O ATOM 1541 CB LYS A 97 -8.751 -15.575 -4.492 1.00 65.12 C ATOM 1542 CG LYS A 97 -7.282 -15.294 -4.137 1.00 53.30 C ATOM 1543 CD LYS A 97 -6.524 -16.568 -3.790 1.00 43.13 C ATOM 1544 CE LYS A 97 -6.377 -16.628 -2.269 1.00 1.25 C ATOM 1545 NZ LYS A 97 -5.420 -17.640 -1.781 1.00 3.23 N ATOM 0 H LYS A 97 -8.811 -13.204 -5.152 1.00 22.24 H new ATOM 0 HA LYS A 97 -8.262 -15.624 -6.553 1.00 61.11 H new ATOM 0 HB2 LYS A 97 -9.411 -15.037 -3.812 1.00 65.12 H new ATOM 0 HB3 LYS A 97 -8.969 -16.636 -4.375 1.00 65.12 H new ATOM 0 HG2 LYS A 97 -6.794 -14.800 -4.977 1.00 53.30 H new ATOM 0 HG3 LYS A 97 -7.239 -14.605 -3.293 1.00 53.30 H new ATOM 0 HD2 LYS A 97 -7.061 -17.443 -4.156 1.00 43.13 H new ATOM 0 HD3 LYS A 97 -5.545 -16.572 -4.268 1.00 43.13 H new ATOM 0 HE2 LYS A 97 -6.064 -15.648 -1.909 1.00 1.25 H new ATOM 0 HE3 LYS A 97 -7.354 -16.831 -1.831 1.00 1.25 H new ATOM 0 HZ1 LYS A 97 -5.384 -17.611 -0.742 1.00 3.23 H new ATOM 0 HZ2 LYS A 97 -5.726 -18.585 -2.091 1.00 3.23 H new ATOM 0 HZ3 LYS A 97 -4.475 -17.438 -2.166 1.00 3.23 H new ATOM 1559 N THR A 98 -11.466 -15.102 -5.842 1.00 31.35 N ATOM 1560 CA THR A 98 -12.823 -15.527 -6.201 1.00 1.24 C ATOM 1561 C THR A 98 -13.498 -14.573 -7.205 1.00 5.04 C ATOM 1562 O THR A 98 -14.500 -14.928 -7.834 1.00 33.45 O ATOM 1563 CB THR A 98 -13.673 -15.728 -4.932 1.00 64.41 C ATOM 1564 OG1 THR A 98 -13.983 -14.496 -4.325 1.00 3.15 O ATOM 1565 CG2 THR A 98 -12.973 -16.613 -3.889 1.00 14.41 C ATOM 0 H THR A 98 -11.436 -14.393 -5.109 1.00 31.35 H new ATOM 0 HA THR A 98 -12.743 -16.485 -6.714 1.00 1.24 H new ATOM 0 HB THR A 98 -14.585 -16.225 -5.263 1.00 64.41 H new ATOM 0 HG1 THR A 98 -14.524 -14.653 -3.523 1.00 3.15 H new ATOM 0 HG21 THR A 98 -13.615 -16.722 -3.015 1.00 14.41 H new ATOM 0 HG22 THR A 98 -12.775 -17.595 -4.319 1.00 14.41 H new ATOM 0 HG23 THR A 98 -12.032 -16.150 -3.592 1.00 14.41 H new ATOM 1573 N GLN A 99 -12.953 -13.357 -7.354 1.00 61.30 N ATOM 1574 CA GLN A 99 -13.453 -12.244 -8.170 1.00 41.41 C ATOM 1575 C GLN A 99 -14.949 -11.949 -7.971 1.00 22.22 C ATOM 1576 O GLN A 99 -15.605 -11.404 -8.863 1.00 65.12 O ATOM 1577 CB GLN A 99 -13.062 -12.411 -9.655 1.00 41.44 C ATOM 1578 CG GLN A 99 -11.578 -12.764 -9.824 1.00 33.25 C ATOM 1579 CD GLN A 99 -10.931 -12.123 -11.044 1.00 23.51 C ATOM 1580 OE1 GLN A 99 -10.998 -12.651 -12.148 1.00 70.31 O ATOM 1581 NE2 GLN A 99 -10.315 -10.963 -10.883 1.00 74.14 N ATOM 0 H GLN A 99 -12.089 -13.109 -6.872 1.00 61.30 H new ATOM 0 HA GLN A 99 -12.950 -11.349 -7.804 1.00 41.41 H new ATOM 0 HB2 GLN A 99 -13.674 -13.193 -10.105 1.00 41.44 H new ATOM 0 HB3 GLN A 99 -13.278 -11.488 -10.193 1.00 41.44 H new ATOM 0 HG2 GLN A 99 -11.036 -12.453 -8.931 1.00 33.25 H new ATOM 0 HG3 GLN A 99 -11.477 -13.847 -9.897 1.00 33.25 H new ATOM 0 HE21 GLN A 99 -10.267 -10.535 -9.958 1.00 74.14 H new ATOM 0 HE22 GLN A 99 -9.888 -10.497 -11.684 1.00 74.14 H new ATOM 1590 N THR A 100 -15.483 -12.303 -6.800 1.00 61.24 N ATOM 1591 CA THR A 100 -16.874 -12.152 -6.399 1.00 4.21 C ATOM 1592 C THR A 100 -17.304 -10.676 -6.354 1.00 2.24 C ATOM 1593 O THR A 100 -18.498 -10.388 -6.330 1.00 12.34 O ATOM 1594 CB THR A 100 -17.056 -12.891 -5.059 1.00 44.20 C ATOM 1595 OG1 THR A 100 -18.407 -13.024 -4.691 1.00 72.44 O ATOM 1596 CG2 THR A 100 -16.350 -12.166 -3.917 1.00 73.11 C ATOM 0 H THR A 100 -14.917 -12.728 -6.065 1.00 61.24 H new ATOM 0 HA THR A 100 -17.537 -12.599 -7.140 1.00 4.21 H new ATOM 0 HB THR A 100 -16.621 -13.877 -5.220 1.00 44.20 H new ATOM 0 HG1 THR A 100 -18.468 -13.500 -3.837 1.00 72.44 H new ATOM 0 HG21 THR A 100 -16.501 -12.716 -2.988 1.00 73.11 H new ATOM 0 HG22 THR A 100 -15.283 -12.101 -4.132 1.00 73.11 H new ATOM 0 HG23 THR A 100 -16.761 -11.162 -3.814 1.00 73.11 H new ATOM 1604 N VAL A 101 -16.365 -9.729 -6.347 1.00 62.14 N ATOM 1605 CA VAL A 101 -16.657 -8.309 -6.411 1.00 14.14 C ATOM 1606 C VAL A 101 -17.217 -7.972 -7.792 1.00 51.13 C ATOM 1607 O VAL A 101 -16.497 -8.038 -8.788 1.00 64.20 O ATOM 1608 CB VAL A 101 -15.390 -7.520 -6.051 1.00 21.15 C ATOM 1609 CG1 VAL A 101 -15.566 -6.020 -6.293 1.00 4.05 C ATOM 1610 CG2 VAL A 101 -15.089 -7.702 -4.564 1.00 24.43 C ATOM 0 H VAL A 101 -15.368 -9.937 -6.296 1.00 62.14 H new ATOM 0 HA VAL A 101 -17.421 -8.026 -5.687 1.00 14.14 H new ATOM 0 HB VAL A 101 -14.584 -7.897 -6.680 1.00 21.15 H new ATOM 0 HG11 VAL A 101 -14.647 -5.498 -6.026 1.00 4.05 H new ATOM 0 HG12 VAL A 101 -15.790 -5.845 -7.345 1.00 4.05 H new ATOM 0 HG13 VAL A 101 -16.387 -5.646 -5.680 1.00 4.05 H new ATOM 0 HG21 VAL A 101 -14.190 -7.143 -4.304 1.00 24.43 H new ATOM 0 HG22 VAL A 101 -15.929 -7.333 -3.975 1.00 24.43 H new ATOM 0 HG23 VAL A 101 -14.933 -8.760 -4.351 1.00 24.43 H new ATOM 1620 N GLN A 102 -18.498 -7.608 -7.849 1.00 24.35 N ATOM 1621 CA GLN A 102 -19.227 -7.287 -9.077 1.00 11.14 C ATOM 1622 C GLN A 102 -20.085 -6.048 -8.872 1.00 62.14 C ATOM 1623 O GLN A 102 -20.308 -5.258 -9.800 1.00 70.25 O ATOM 1624 CB GLN A 102 -20.150 -8.448 -9.457 1.00 53.31 C ATOM 1625 CG GLN A 102 -19.339 -9.737 -9.650 1.00 54.12 C ATOM 1626 CD GLN A 102 -19.989 -10.837 -10.481 1.00 5.04 C ATOM 1627 OE1 GLN A 102 -20.965 -10.640 -11.202 1.00 10.01 O ATOM 1628 NE2 GLN A 102 -19.438 -12.039 -10.412 1.00 24.14 N ATOM 0 H GLN A 102 -19.077 -7.526 -7.013 1.00 24.35 H new ATOM 0 HA GLN A 102 -18.498 -7.109 -9.868 1.00 11.14 H new ATOM 0 HB2 GLN A 102 -20.899 -8.595 -8.679 1.00 53.31 H new ATOM 0 HB3 GLN A 102 -20.687 -8.208 -10.375 1.00 53.31 H new ATOM 0 HG2 GLN A 102 -18.389 -9.475 -10.116 1.00 54.12 H new ATOM 0 HG3 GLN A 102 -19.109 -10.145 -8.666 1.00 54.12 H new ATOM 0 HE21 GLN A 102 -18.628 -12.195 -9.812 1.00 24.14 H new ATOM 0 HE22 GLN A 102 -19.823 -12.809 -10.959 1.00 24.14 H new ATOM 1637 N SER A 103 -20.543 -5.836 -7.644 1.00 4.34 N ATOM 1638 CA SER A 103 -21.262 -4.643 -7.293 1.00 5.44 C ATOM 1639 C SER A 103 -20.753 -4.129 -5.953 1.00 50.23 C ATOM 1640 O SER A 103 -20.132 -4.870 -5.191 1.00 50.32 O ATOM 1641 CB SER A 103 -22.772 -4.900 -7.348 1.00 71.55 C ATOM 1642 OG SER A 103 -23.193 -6.254 -7.491 1.00 53.04 O ATOM 0 H SER A 103 -20.421 -6.492 -6.873 1.00 4.34 H new ATOM 0 HA SER A 103 -21.081 -3.847 -8.015 1.00 5.44 H new ATOM 0 HB2 SER A 103 -23.217 -4.501 -6.436 1.00 71.55 H new ATOM 0 HB3 SER A 103 -23.183 -4.328 -8.180 1.00 71.55 H new ATOM 0 HG SER A 103 -24.172 -6.292 -7.512 1.00 53.04 H new ATOM 1648 N VAL A 104 -21.032 -2.863 -5.642 1.00 44.24 N ATOM 1649 CA VAL A 104 -20.639 -2.228 -4.384 1.00 32.14 C ATOM 1650 C VAL A 104 -21.197 -3.026 -3.190 1.00 52.25 C ATOM 1651 O VAL A 104 -20.548 -3.121 -2.149 1.00 23.32 O ATOM 1652 CB VAL A 104 -21.090 -0.755 -4.401 1.00 53.45 C ATOM 1653 CG1 VAL A 104 -20.653 0.001 -3.142 1.00 31.12 C ATOM 1654 CG2 VAL A 104 -20.489 -0.015 -5.607 1.00 2.00 C ATOM 0 H VAL A 104 -21.545 -2.241 -6.266 1.00 44.24 H new ATOM 0 HA VAL A 104 -19.555 -2.233 -4.271 1.00 32.14 H new ATOM 0 HB VAL A 104 -22.178 -0.776 -4.455 1.00 53.45 H new ATOM 0 HG11 VAL A 104 -20.994 1.034 -3.201 1.00 31.12 H new ATOM 0 HG12 VAL A 104 -21.087 -0.475 -2.263 1.00 31.12 H new ATOM 0 HG13 VAL A 104 -19.566 -0.018 -3.065 1.00 31.12 H new ATOM 0 HG21 VAL A 104 -20.821 1.023 -5.599 1.00 2.00 H new ATOM 0 HG22 VAL A 104 -19.401 -0.049 -5.549 1.00 2.00 H new ATOM 0 HG23 VAL A 104 -20.819 -0.494 -6.529 1.00 2.00 H new ATOM 1664 N ALA A 105 -22.350 -3.676 -3.393 1.00 71.55 N ATOM 1665 CA ALA A 105 -22.973 -4.668 -2.525 1.00 33.24 C ATOM 1666 C ALA A 105 -21.998 -5.749 -2.041 1.00 63.03 C ATOM 1667 O ALA A 105 -22.058 -6.177 -0.887 1.00 5.33 O ATOM 1668 CB ALA A 105 -24.104 -5.337 -3.310 1.00 32.30 C ATOM 0 H ALA A 105 -22.907 -3.506 -4.230 1.00 71.55 H new ATOM 0 HA ALA A 105 -23.336 -4.151 -1.637 1.00 33.24 H new ATOM 0 HB1 ALA A 105 -24.589 -6.086 -2.683 1.00 32.30 H new ATOM 0 HB2 ALA A 105 -24.835 -4.585 -3.608 1.00 32.30 H new ATOM 0 HB3 ALA A 105 -23.695 -5.818 -4.199 1.00 32.30 H new ATOM 1674 N ASP A 106 -21.105 -6.212 -2.916 1.00 53.34 N ATOM 1675 CA ASP A 106 -20.188 -7.295 -2.598 1.00 43.41 C ATOM 1676 C ASP A 106 -19.061 -6.743 -1.740 1.00 41.31 C ATOM 1677 O ASP A 106 -18.603 -7.398 -0.804 1.00 50.30 O ATOM 1678 CB ASP A 106 -19.604 -7.919 -3.874 1.00 74.24 C ATOM 1679 CG ASP A 106 -20.666 -8.484 -4.806 1.00 61.30 C ATOM 1680 OD1 ASP A 106 -21.468 -9.356 -4.395 1.00 5.35 O ATOM 1681 OD2 ASP A 106 -20.745 -8.024 -5.959 1.00 13.22 O ATOM 0 H ASP A 106 -21.001 -5.845 -3.862 1.00 53.34 H new ATOM 0 HA ASP A 106 -20.732 -8.072 -2.061 1.00 43.41 H new ATOM 0 HB2 ASP A 106 -19.026 -7.165 -4.408 1.00 74.24 H new ATOM 0 HB3 ASP A 106 -18.912 -8.715 -3.598 1.00 74.24 H new ATOM 1686 N ILE A 107 -18.615 -5.529 -2.066 1.00 32.13 N ATOM 1687 CA ILE A 107 -17.475 -4.863 -1.452 1.00 25.30 C ATOM 1688 C ILE A 107 -17.837 -4.559 0.004 1.00 70.42 C ATOM 1689 O ILE A 107 -17.088 -4.905 0.920 1.00 70.23 O ATOM 1690 CB ILE A 107 -17.051 -3.606 -2.260 1.00 62.31 C ATOM 1691 CG1 ILE A 107 -17.156 -3.906 -3.774 1.00 3.34 C ATOM 1692 CG2 ILE A 107 -15.622 -3.197 -1.860 1.00 50.13 C ATOM 1693 CD1 ILE A 107 -16.510 -2.932 -4.763 1.00 71.11 C ATOM 0 H ILE A 107 -19.057 -4.965 -2.792 1.00 32.13 H new ATOM 0 HA ILE A 107 -16.598 -5.510 -1.463 1.00 25.30 H new ATOM 0 HB ILE A 107 -17.716 -2.772 -2.035 1.00 62.31 H new ATOM 0 HG12 ILE A 107 -16.720 -4.890 -3.947 1.00 3.34 H new ATOM 0 HG13 ILE A 107 -18.214 -3.978 -4.024 1.00 3.34 H new ATOM 0 HG21 ILE A 107 -15.324 -2.315 -2.427 1.00 50.13 H new ATOM 0 HG22 ILE A 107 -15.593 -2.970 -0.794 1.00 50.13 H new ATOM 0 HG23 ILE A 107 -14.935 -4.016 -2.075 1.00 50.13 H new ATOM 0 HD11 ILE A 107 -16.673 -3.286 -5.781 1.00 71.11 H new ATOM 0 HD12 ILE A 107 -16.957 -1.945 -4.646 1.00 71.11 H new ATOM 0 HD13 ILE A 107 -15.439 -2.871 -4.567 1.00 71.11 H new ATOM 1705 N ARG A 108 -19.022 -3.976 0.252 1.00 63.34 N ATOM 1706 CA ARG A 108 -19.465 -3.698 1.613 1.00 30.04 C ATOM 1707 C ARG A 108 -19.524 -4.949 2.481 1.00 24.03 C ATOM 1708 O ARG A 108 -19.270 -4.819 3.677 1.00 52.24 O ATOM 1709 CB ARG A 108 -20.792 -2.925 1.628 1.00 44.43 C ATOM 1710 CG ARG A 108 -21.981 -3.645 0.979 1.00 31.43 C ATOM 1711 CD ARG A 108 -23.320 -2.972 1.283 1.00 42.44 C ATOM 1712 NE ARG A 108 -23.259 -1.517 1.080 1.00 43.31 N ATOM 1713 CZ ARG A 108 -24.305 -0.686 1.137 1.00 13.44 C ATOM 1714 NH1 ARG A 108 -25.544 -1.168 1.203 1.00 52.54 N ATOM 1715 NH2 ARG A 108 -24.116 0.628 1.116 1.00 44.13 N ATOM 0 H ARG A 108 -19.681 -3.693 -0.473 1.00 63.34 H new ATOM 0 HA ARG A 108 -18.707 -3.055 2.061 1.00 30.04 H new ATOM 0 HB2 ARG A 108 -21.048 -2.697 2.663 1.00 44.43 H new ATOM 0 HB3 ARG A 108 -20.644 -1.973 1.119 1.00 44.43 H new ATOM 0 HG2 ARG A 108 -21.834 -3.679 -0.100 1.00 31.43 H new ATOM 0 HG3 ARG A 108 -22.010 -4.677 1.330 1.00 31.43 H new ATOM 0 HD2 ARG A 108 -24.093 -3.396 0.643 1.00 42.44 H new ATOM 0 HD3 ARG A 108 -23.607 -3.183 2.313 1.00 42.44 H new ATOM 0 HE ARG A 108 -22.346 -1.109 0.880 1.00 43.31 H new ATOM 0 HH11 ARG A 108 -25.699 -2.176 1.210 1.00 52.54 H new ATOM 0 HH12 ARG A 108 -26.338 -0.529 1.246 1.00 52.54 H new ATOM 0 HH21 ARG A 108 -23.171 1.006 1.056 1.00 44.13 H new ATOM 0 HH22 ARG A 108 -24.916 1.259 1.160 1.00 44.13 H new ATOM 1729 N LYS A 109 -19.821 -6.130 1.921 1.00 73.35 N ATOM 1730 CA LYS A 109 -19.866 -7.380 2.680 1.00 5.23 C ATOM 1731 C LYS A 109 -18.526 -7.604 3.348 1.00 34.33 C ATOM 1732 O LYS A 109 -18.457 -7.688 4.571 1.00 41.44 O ATOM 1733 CB LYS A 109 -20.262 -8.567 1.777 1.00 13.52 C ATOM 1734 CG LYS A 109 -20.612 -9.823 2.594 1.00 70.13 C ATOM 1735 CD LYS A 109 -20.775 -11.084 1.724 1.00 64.11 C ATOM 1736 CE LYS A 109 -19.446 -11.675 1.216 1.00 33.24 C ATOM 1737 NZ LYS A 109 -18.679 -12.364 2.278 1.00 14.12 N ATOM 0 H LYS A 109 -20.036 -6.242 0.930 1.00 73.35 H new ATOM 0 HA LYS A 109 -20.633 -7.307 3.451 1.00 5.23 H new ATOM 0 HB2 LYS A 109 -21.117 -8.285 1.162 1.00 13.52 H new ATOM 0 HB3 LYS A 109 -19.441 -8.794 1.097 1.00 13.52 H new ATOM 0 HG2 LYS A 109 -19.830 -9.998 3.333 1.00 70.13 H new ATOM 0 HG3 LYS A 109 -21.537 -9.646 3.143 1.00 70.13 H new ATOM 0 HD2 LYS A 109 -21.301 -11.845 2.301 1.00 64.11 H new ATOM 0 HD3 LYS A 109 -21.404 -10.842 0.867 1.00 64.11 H new ATOM 0 HE2 LYS A 109 -19.652 -12.378 0.409 1.00 33.24 H new ATOM 0 HE3 LYS A 109 -18.836 -10.876 0.795 1.00 33.24 H new ATOM 0 HZ1 LYS A 109 -17.665 -12.336 2.048 1.00 14.12 H new ATOM 0 HZ2 LYS A 109 -18.841 -11.887 3.188 1.00 14.12 H new ATOM 0 HZ3 LYS A 109 -18.991 -13.354 2.345 1.00 14.12 H new ATOM 1751 N VAL A 110 -17.466 -7.641 2.554 1.00 52.13 N ATOM 1752 CA VAL A 110 -16.145 -7.989 3.041 1.00 52.44 C ATOM 1753 C VAL A 110 -15.681 -6.991 4.106 1.00 53.13 C ATOM 1754 O VAL A 110 -15.114 -7.405 5.115 1.00 32.01 O ATOM 1755 CB VAL A 110 -15.195 -8.107 1.841 1.00 1.42 C ATOM 1756 CG1 VAL A 110 -13.798 -8.487 2.310 1.00 34.15 C ATOM 1757 CG2 VAL A 110 -15.695 -9.203 0.890 1.00 45.13 C ATOM 0 H VAL A 110 -17.500 -7.431 1.557 1.00 52.13 H new ATOM 0 HA VAL A 110 -16.158 -8.957 3.542 1.00 52.44 H new ATOM 0 HB VAL A 110 -15.166 -7.144 1.331 1.00 1.42 H new ATOM 0 HG11 VAL A 110 -13.134 -8.567 1.449 1.00 34.15 H new ATOM 0 HG12 VAL A 110 -13.421 -7.722 2.988 1.00 34.15 H new ATOM 0 HG13 VAL A 110 -13.836 -9.445 2.829 1.00 34.15 H new ATOM 0 HG21 VAL A 110 -15.018 -9.284 0.040 1.00 45.13 H new ATOM 0 HG22 VAL A 110 -15.729 -10.156 1.418 1.00 45.13 H new ATOM 0 HG23 VAL A 110 -16.694 -8.949 0.536 1.00 45.13 H new ATOM 1767 N PHE A 111 -15.992 -5.697 3.945 1.00 70.15 N ATOM 1768 CA PHE A 111 -15.741 -4.698 4.985 1.00 23.44 C ATOM 1769 C PHE A 111 -16.379 -5.128 6.315 1.00 2.31 C ATOM 1770 O PHE A 111 -15.699 -5.124 7.343 1.00 50.15 O ATOM 1771 CB PHE A 111 -16.252 -3.309 4.564 1.00 61.13 C ATOM 1772 CG PHE A 111 -15.253 -2.443 3.819 1.00 43.22 C ATOM 1773 CD1 PHE A 111 -14.912 -2.736 2.486 1.00 62.21 C ATOM 1774 CD2 PHE A 111 -14.708 -1.297 4.435 1.00 30.42 C ATOM 1775 CE1 PHE A 111 -14.037 -1.896 1.779 1.00 51.34 C ATOM 1776 CE2 PHE A 111 -13.829 -0.459 3.728 1.00 63.42 C ATOM 1777 CZ PHE A 111 -13.487 -0.763 2.400 1.00 10.21 C ATOM 0 H PHE A 111 -16.420 -5.320 3.099 1.00 70.15 H new ATOM 0 HA PHE A 111 -14.662 -4.628 5.124 1.00 23.44 H new ATOM 0 HB2 PHE A 111 -17.132 -3.440 3.935 1.00 61.13 H new ATOM 0 HB3 PHE A 111 -16.575 -2.774 5.457 1.00 61.13 H new ATOM 0 HD1 PHE A 111 -15.325 -3.610 2.005 1.00 62.21 H new ATOM 0 HD2 PHE A 111 -14.968 -1.062 5.457 1.00 30.42 H new ATOM 0 HE1 PHE A 111 -13.786 -2.122 0.753 1.00 51.34 H new ATOM 0 HE2 PHE A 111 -13.417 0.418 4.205 1.00 63.42 H new ATOM 0 HZ PHE A 111 -12.803 -0.127 1.858 1.00 10.21 H new ATOM 1787 N VAL A 112 -17.670 -5.477 6.317 1.00 61.33 N ATOM 1788 CA VAL A 112 -18.372 -5.849 7.544 1.00 54.11 C ATOM 1789 C VAL A 112 -17.782 -7.111 8.134 1.00 50.30 C ATOM 1790 O VAL A 112 -17.552 -7.170 9.344 1.00 14.34 O ATOM 1791 CB VAL A 112 -19.894 -6.020 7.339 1.00 33.03 C ATOM 1792 CG1 VAL A 112 -20.587 -6.480 8.631 1.00 71.34 C ATOM 1793 CG2 VAL A 112 -20.543 -4.713 6.882 1.00 61.34 C ATOM 0 H VAL A 112 -18.249 -5.509 5.478 1.00 61.33 H new ATOM 0 HA VAL A 112 -18.235 -5.022 8.241 1.00 54.11 H new ATOM 0 HB VAL A 112 -20.019 -6.781 6.568 1.00 33.03 H new ATOM 0 HG11 VAL A 112 -21.656 -6.590 8.451 1.00 71.34 H new ATOM 0 HG12 VAL A 112 -20.171 -7.437 8.946 1.00 71.34 H new ATOM 0 HG13 VAL A 112 -20.425 -5.739 9.414 1.00 71.34 H new ATOM 0 HG21 VAL A 112 -21.614 -4.866 6.747 1.00 61.34 H new ATOM 0 HG22 VAL A 112 -20.379 -3.943 7.635 1.00 61.34 H new ATOM 0 HG23 VAL A 112 -20.099 -4.397 5.938 1.00 61.34 H new ATOM 1803 N ASP A 113 -17.534 -8.102 7.287 1.00 45.34 N ATOM 1804 CA ASP A 113 -17.154 -9.435 7.717 1.00 74.24 C ATOM 1805 C ASP A 113 -15.819 -9.357 8.449 1.00 11.45 C ATOM 1806 O ASP A 113 -15.636 -9.923 9.530 1.00 70.32 O ATOM 1807 CB ASP A 113 -17.070 -10.340 6.485 1.00 62.24 C ATOM 1808 CG ASP A 113 -18.423 -10.820 5.947 1.00 44.12 C ATOM 1809 OD1 ASP A 113 -19.464 -10.573 6.595 1.00 21.35 O ATOM 1810 OD2 ASP A 113 -18.407 -11.438 4.857 1.00 33.21 O ATOM 0 H ASP A 113 -17.592 -7.999 6.274 1.00 45.34 H new ATOM 0 HA ASP A 113 -17.892 -9.853 8.402 1.00 74.24 H new ATOM 0 HB2 ASP A 113 -16.549 -9.803 5.692 1.00 62.24 H new ATOM 0 HB3 ASP A 113 -16.463 -11.211 6.732 1.00 62.24 H new ATOM 1815 N ALA A 114 -14.909 -8.551 7.903 1.00 72.33 N ATOM 1816 CA ALA A 114 -13.603 -8.267 8.463 1.00 23.14 C ATOM 1817 C ALA A 114 -13.652 -7.230 9.598 1.00 23.04 C ATOM 1818 O ALA A 114 -12.620 -6.984 10.230 1.00 31.14 O ATOM 1819 CB ALA A 114 -12.709 -7.797 7.326 1.00 54.11 C ATOM 0 H ALA A 114 -15.075 -8.062 7.023 1.00 72.33 H new ATOM 0 HA ALA A 114 -13.205 -9.174 8.919 1.00 23.14 H new ATOM 0 HB1 ALA A 114 -11.715 -7.574 7.713 1.00 54.11 H new ATOM 0 HB2 ALA A 114 -12.637 -8.581 6.572 1.00 54.11 H new ATOM 0 HB3 ALA A 114 -13.133 -6.899 6.877 1.00 54.11 H new ATOM 1825 N GLY A 115 -14.808 -6.631 9.910 1.00 64.02 N ATOM 1826 CA GLY A 115 -15.041 -5.978 11.196 1.00 32.01 C ATOM 1827 C GLY A 115 -15.449 -4.505 11.167 1.00 5.44 C ATOM 1828 O GLY A 115 -15.262 -3.822 12.182 1.00 45.55 O ATOM 0 H GLY A 115 -15.605 -6.588 9.275 1.00 64.02 H new ATOM 0 HA2 GLY A 115 -15.818 -6.534 11.721 1.00 32.01 H new ATOM 0 HA3 GLY A 115 -14.131 -6.065 11.789 1.00 32.01 H new ATOM 1832 N VAL A 116 -16.010 -3.999 10.067 1.00 64.41 N ATOM 1833 CA VAL A 116 -16.486 -2.624 9.937 1.00 70.42 C ATOM 1834 C VAL A 116 -17.996 -2.576 10.184 1.00 42.12 C ATOM 1835 O VAL A 116 -18.769 -3.391 9.675 1.00 64.33 O ATOM 1836 CB VAL A 116 -16.068 -2.072 8.559 1.00 54.51 C ATOM 1837 CG1 VAL A 116 -16.640 -0.676 8.268 1.00 25.13 C ATOM 1838 CG2 VAL A 116 -14.533 -2.019 8.485 1.00 25.42 C ATOM 0 H VAL A 116 -16.149 -4.551 9.220 1.00 64.41 H new ATOM 0 HA VAL A 116 -16.031 -1.979 10.689 1.00 70.42 H new ATOM 0 HB VAL A 116 -16.476 -2.745 7.805 1.00 54.51 H new ATOM 0 HG11 VAL A 116 -16.309 -0.345 7.284 1.00 25.13 H new ATOM 0 HG12 VAL A 116 -17.729 -0.717 8.289 1.00 25.13 H new ATOM 0 HG13 VAL A 116 -16.289 0.026 9.024 1.00 25.13 H new ATOM 0 HG21 VAL A 116 -14.229 -1.630 7.513 1.00 25.42 H new ATOM 0 HG22 VAL A 116 -14.153 -1.368 9.272 1.00 25.42 H new ATOM 0 HG23 VAL A 116 -14.128 -3.022 8.617 1.00 25.42 H new ATOM 1848 N LYS A 117 -18.431 -1.609 10.985 1.00 12.30 N ATOM 1849 CA LYS A 117 -19.847 -1.397 11.244 1.00 63.15 C ATOM 1850 C LYS A 117 -20.565 -1.011 9.954 1.00 1.44 C ATOM 1851 O LYS A 117 -20.048 -0.245 9.137 1.00 33.01 O ATOM 1852 CB LYS A 117 -20.028 -0.318 12.323 1.00 52.41 C ATOM 1853 CG LYS A 117 -20.655 -0.859 13.610 1.00 24.24 C ATOM 1854 CD LYS A 117 -22.064 -1.437 13.424 1.00 10.32 C ATOM 1855 CE LYS A 117 -22.867 -1.492 14.729 1.00 3.43 C ATOM 1856 NZ LYS A 117 -22.223 -2.273 15.803 1.00 14.40 N ATOM 0 H LYS A 117 -17.815 -0.955 11.469 1.00 12.30 H new ATOM 0 HA LYS A 117 -20.288 -2.324 11.612 1.00 63.15 H new ATOM 0 HB2 LYS A 117 -19.058 0.122 12.555 1.00 52.41 H new ATOM 0 HB3 LYS A 117 -20.655 0.481 11.928 1.00 52.41 H new ATOM 0 HG2 LYS A 117 -20.007 -1.634 14.020 1.00 24.24 H new ATOM 0 HG3 LYS A 117 -20.697 -0.057 14.346 1.00 24.24 H new ATOM 0 HD2 LYS A 117 -22.605 -0.833 12.696 1.00 10.32 H new ATOM 0 HD3 LYS A 117 -21.986 -2.442 13.009 1.00 10.32 H new ATOM 0 HE2 LYS A 117 -23.032 -0.475 15.084 1.00 3.43 H new ATOM 0 HE3 LYS A 117 -23.848 -1.920 14.521 1.00 3.43 H new ATOM 0 HZ1 LYS A 117 -22.827 -2.262 16.650 1.00 14.40 H new ATOM 0 HZ2 LYS A 117 -22.089 -3.254 15.486 1.00 14.40 H new ATOM 0 HZ3 LYS A 117 -21.299 -1.854 16.031 1.00 14.40 H new ATOM 1870 N GLY A 118 -21.797 -1.488 9.807 1.00 71.34 N ATOM 1871 CA GLY A 118 -22.622 -1.229 8.639 1.00 54.53 C ATOM 1872 C GLY A 118 -23.142 0.205 8.590 1.00 61.21 C ATOM 1873 O GLY A 118 -23.688 0.620 7.564 1.00 22.34 O ATOM 0 H GLY A 118 -22.254 -2.073 10.507 1.00 71.34 H new ATOM 0 HA2 GLY A 118 -22.043 -1.432 7.738 1.00 54.53 H new ATOM 0 HA3 GLY A 118 -23.467 -1.918 8.636 1.00 54.53 H new ATOM 1877 N GLU A 119 -22.989 0.961 9.675 1.00 30.04 N ATOM 1878 CA GLU A 119 -23.381 2.364 9.751 1.00 5.33 C ATOM 1879 C GLU A 119 -22.213 3.258 9.382 1.00 3.44 C ATOM 1880 O GLU A 119 -22.420 4.282 8.751 1.00 23.04 O ATOM 1881 CB GLU A 119 -23.969 2.696 11.125 1.00 3.12 C ATOM 1882 CG GLU A 119 -22.947 2.650 12.262 1.00 63.03 C ATOM 1883 CD GLU A 119 -23.580 2.300 13.608 1.00 10.22 C ATOM 1884 OE1 GLU A 119 -24.705 2.760 13.909 1.00 11.13 O ATOM 1885 OE2 GLU A 119 -22.970 1.541 14.392 1.00 42.31 O ATOM 0 H GLU A 119 -22.582 0.608 10.541 1.00 30.04 H new ATOM 0 HA GLU A 119 -24.171 2.552 9.024 1.00 5.33 H new ATOM 0 HB2 GLU A 119 -24.414 3.691 11.089 1.00 3.12 H new ATOM 0 HB3 GLU A 119 -24.774 1.995 11.344 1.00 3.12 H new ATOM 0 HG2 GLU A 119 -22.178 1.915 12.025 1.00 63.03 H new ATOM 0 HG3 GLU A 119 -22.451 3.617 12.339 1.00 63.03 H new ATOM 1892 N ASP A 120 -20.991 2.830 9.691 1.00 5.40 N ATOM 1893 CA ASP A 120 -19.781 3.600 9.466 1.00 74.41 C ATOM 1894 C ASP A 120 -19.554 3.656 7.980 1.00 70.24 C ATOM 1895 O ASP A 120 -19.303 4.724 7.435 1.00 73.41 O ATOM 1896 CB ASP A 120 -18.570 2.921 10.124 1.00 25.34 C ATOM 1897 CG ASP A 120 -18.299 3.408 11.540 1.00 31.34 C ATOM 1898 OD1 ASP A 120 -18.210 4.645 11.714 1.00 62.15 O ATOM 1899 OD2 ASP A 120 -18.123 2.537 12.421 1.00 44.43 O ATOM 0 H ASP A 120 -20.816 1.918 10.114 1.00 5.40 H new ATOM 0 HA ASP A 120 -19.893 4.595 9.897 1.00 74.41 H new ATOM 0 HB2 ASP A 120 -18.733 1.843 10.143 1.00 25.34 H new ATOM 0 HB3 ASP A 120 -17.686 3.098 9.511 1.00 25.34 H new ATOM 1904 N TYR A 121 -19.674 2.497 7.327 1.00 70.35 N ATOM 1905 CA TYR A 121 -19.506 2.387 5.903 1.00 64.24 C ATOM 1906 C TYR A 121 -20.429 3.377 5.206 1.00 33.40 C ATOM 1907 O TYR A 121 -19.970 4.245 4.472 1.00 45.21 O ATOM 1908 CB TYR A 121 -19.744 0.941 5.454 1.00 42.14 C ATOM 1909 CG TYR A 121 -19.370 0.616 4.012 1.00 21.34 C ATOM 1910 CD1 TYR A 121 -20.173 1.064 2.945 1.00 72.15 C ATOM 1911 CD2 TYR A 121 -18.238 -0.177 3.738 1.00 73.44 C ATOM 1912 CE1 TYR A 121 -19.834 0.757 1.614 1.00 5.54 C ATOM 1913 CE2 TYR A 121 -17.921 -0.524 2.411 1.00 54.13 C ATOM 1914 CZ TYR A 121 -18.704 -0.043 1.337 1.00 63.01 C ATOM 1915 OH TYR A 121 -18.365 -0.357 0.056 1.00 65.42 O ATOM 0 H TYR A 121 -19.892 1.613 7.787 1.00 70.35 H new ATOM 0 HA TYR A 121 -18.483 2.639 5.624 1.00 64.24 H new ATOM 0 HB2 TYR A 121 -19.180 0.280 6.112 1.00 42.14 H new ATOM 0 HB3 TYR A 121 -20.799 0.707 5.596 1.00 42.14 H new ATOM 0 HD1 TYR A 121 -21.057 1.649 3.150 1.00 72.15 H new ATOM 0 HD2 TYR A 121 -17.612 -0.520 4.548 1.00 73.44 H new ATOM 0 HE1 TYR A 121 -20.439 1.134 0.803 1.00 5.54 H new ATOM 0 HE2 TYR A 121 -17.073 -1.163 2.212 1.00 54.13 H new ATOM 0 HH TYR A 121 -17.559 -0.914 0.058 1.00 65.42 H new ATOM 1925 N ASP A 122 -21.737 3.237 5.425 1.00 74.35 N ATOM 1926 CA ASP A 122 -22.728 3.993 4.673 1.00 11.44 C ATOM 1927 C ASP A 122 -22.806 5.451 5.126 1.00 24.13 C ATOM 1928 O ASP A 122 -23.276 6.278 4.345 1.00 63.21 O ATOM 1929 CB ASP A 122 -24.095 3.306 4.758 1.00 5.31 C ATOM 1930 CG ASP A 122 -25.065 3.872 3.718 1.00 11.34 C ATOM 1931 OD1 ASP A 122 -24.938 3.513 2.522 1.00 51.34 O ATOM 1932 OD2 ASP A 122 -25.952 4.674 4.081 1.00 1.30 O ATOM 0 H ASP A 122 -22.132 2.604 6.120 1.00 74.35 H new ATOM 0 HA ASP A 122 -22.413 4.010 3.630 1.00 11.44 H new ATOM 0 HB2 ASP A 122 -23.976 2.234 4.603 1.00 5.31 H new ATOM 0 HB3 ASP A 122 -24.510 3.439 5.757 1.00 5.31 H new ATOM 1937 N ALA A 123 -22.325 5.792 6.329 1.00 32.24 N ATOM 1938 CA ALA A 123 -22.217 7.177 6.771 1.00 12.30 C ATOM 1939 C ALA A 123 -21.012 7.819 6.092 1.00 13.14 C ATOM 1940 O ALA A 123 -21.154 8.743 5.286 1.00 42.45 O ATOM 1941 CB ALA A 123 -22.092 7.253 8.299 1.00 73.43 C ATOM 0 H ALA A 123 -22.002 5.112 7.018 1.00 32.24 H new ATOM 0 HA ALA A 123 -23.120 7.720 6.491 1.00 12.30 H new ATOM 0 HB1 ALA A 123 -22.013 8.296 8.606 1.00 73.43 H new ATOM 0 HB2 ALA A 123 -22.973 6.805 8.759 1.00 73.43 H new ATOM 0 HB3 ALA A 123 -21.201 6.712 8.619 1.00 73.43 H new ATOM 1947 N ALA A 124 -19.821 7.298 6.404 1.00 70.04 N ATOM 1948 CA ALA A 124 -18.550 7.844 5.970 1.00 43.51 C ATOM 1949 C ALA A 124 -18.525 8.004 4.453 1.00 44.21 C ATOM 1950 O ALA A 124 -18.035 9.021 3.968 1.00 50.43 O ATOM 1951 CB ALA A 124 -17.393 6.977 6.471 1.00 30.23 C ATOM 0 H ALA A 124 -19.722 6.463 6.981 1.00 70.04 H new ATOM 0 HA ALA A 124 -18.427 8.836 6.405 1.00 43.51 H new ATOM 0 HB1 ALA A 124 -16.447 7.403 6.135 1.00 30.23 H new ATOM 0 HB2 ALA A 124 -17.409 6.943 7.560 1.00 30.23 H new ATOM 0 HB3 ALA A 124 -17.497 5.967 6.075 1.00 30.23 H new ATOM 1957 N TRP A 125 -19.116 7.061 3.713 1.00 50.34 N ATOM 1958 CA TRP A 125 -19.190 7.045 2.259 1.00 45.53 C ATOM 1959 C TRP A 125 -19.577 8.392 1.660 1.00 3.53 C ATOM 1960 O TRP A 125 -19.010 8.763 0.633 1.00 12.12 O ATOM 1961 CB TRP A 125 -20.127 5.924 1.819 1.00 14.54 C ATOM 1962 CG TRP A 125 -20.222 5.678 0.356 1.00 44.24 C ATOM 1963 CD1 TRP A 125 -21.128 6.209 -0.487 1.00 53.24 C ATOM 1964 CD2 TRP A 125 -19.379 4.812 -0.448 1.00 61.34 C ATOM 1965 NE1 TRP A 125 -20.902 5.714 -1.755 1.00 1.21 N ATOM 1966 CE2 TRP A 125 -19.801 4.888 -1.803 1.00 45.31 C ATOM 1967 CE3 TRP A 125 -18.301 3.960 -0.155 1.00 34.03 C ATOM 1968 CZ2 TRP A 125 -19.154 4.182 -2.830 1.00 2.30 C ATOM 1969 CZ3 TRP A 125 -17.634 3.262 -1.176 1.00 21.10 C ATOM 1970 CH2 TRP A 125 -18.039 3.381 -2.523 1.00 12.21 C ATOM 0 H TRP A 125 -19.575 6.254 4.136 1.00 50.34 H new ATOM 0 HA TRP A 125 -18.190 6.849 1.871 1.00 45.53 H new ATOM 0 HB2 TRP A 125 -19.805 5.001 2.300 1.00 14.54 H new ATOM 0 HB3 TRP A 125 -21.126 6.147 2.194 1.00 14.54 H new ATOM 0 HD1 TRP A 125 -21.905 6.908 -0.215 1.00 53.24 H new ATOM 0 HE1 TRP A 125 -21.483 5.934 -2.564 1.00 1.21 H new ATOM 0 HE3 TRP A 125 -17.980 3.840 0.869 1.00 34.03 H new ATOM 0 HZ2 TRP A 125 -19.509 4.253 -3.847 1.00 2.30 H new ATOM 0 HZ3 TRP A 125 -16.799 2.625 -0.926 1.00 21.10 H new ATOM 0 HH2 TRP A 125 -17.502 2.865 -3.305 1.00 12.21 H new ATOM 1981 N ASN A 126 -20.467 9.159 2.298 1.00 30.21 N ATOM 1982 CA ASN A 126 -20.908 10.473 1.838 1.00 44.24 C ATOM 1983 C ASN A 126 -20.491 11.613 2.786 1.00 34.43 C ATOM 1984 O ASN A 126 -20.782 12.769 2.487 1.00 45.23 O ATOM 1985 CB ASN A 126 -22.417 10.466 1.551 1.00 51.42 C ATOM 1986 CG ASN A 126 -23.246 10.098 2.768 1.00 70.35 C ATOM 1987 OD1 ASN A 126 -23.695 10.953 3.521 1.00 72.32 O ATOM 1988 ND2 ASN A 126 -23.517 8.815 2.955 1.00 24.33 N ATOM 0 H ASN A 126 -20.910 8.873 3.171 1.00 30.21 H new ATOM 0 HA ASN A 126 -20.392 10.680 0.901 1.00 44.24 H new ATOM 0 HB2 ASN A 126 -22.719 11.451 1.196 1.00 51.42 H new ATOM 0 HB3 ASN A 126 -22.626 9.760 0.748 1.00 51.42 H new ATOM 0 HD21 ASN A 126 -24.107 8.527 3.735 1.00 24.33 H new ATOM 0 HD22 ASN A 126 -23.135 8.115 2.319 1.00 24.33 H new ATOM 1995 N SER A 127 -19.780 11.325 3.880 1.00 73.22 N ATOM 1996 CA SER A 127 -19.160 12.291 4.787 1.00 53.25 C ATOM 1997 C SER A 127 -17.891 12.851 4.198 1.00 54.54 C ATOM 1998 O SER A 127 -17.118 12.196 3.497 1.00 43.32 O ATOM 1999 CB SER A 127 -18.868 11.576 6.108 1.00 22.32 C ATOM 2000 OG SER A 127 -18.248 12.391 7.085 1.00 73.42 O ATOM 0 H SER A 127 -19.614 10.361 4.170 1.00 73.22 H new ATOM 0 HA SER A 127 -19.836 13.130 4.951 1.00 53.25 H new ATOM 0 HB2 SER A 127 -19.803 11.190 6.514 1.00 22.32 H new ATOM 0 HB3 SER A 127 -18.228 10.716 5.909 1.00 22.32 H new ATOM 0 HG SER A 127 -18.095 11.867 7.899 1.00 73.42 H new ATOM 2006 N PHE A 128 -17.671 14.108 4.550 1.00 52.12 N ATOM 2007 CA PHE A 128 -16.496 14.892 4.251 1.00 3.34 C ATOM 2008 C PHE A 128 -15.145 14.340 4.621 1.00 14.41 C ATOM 2009 O PHE A 128 -14.133 14.660 4.000 1.00 13.52 O ATOM 2010 CB PHE A 128 -16.627 16.302 4.719 1.00 41.45 C ATOM 2011 CG PHE A 128 -17.587 16.618 5.800 1.00 43.42 C ATOM 2012 CD1 PHE A 128 -17.602 15.845 6.941 1.00 34.22 C ATOM 2013 CD2 PHE A 128 -18.484 17.652 5.604 1.00 53.34 C ATOM 2014 CE1 PHE A 128 -18.494 16.140 7.982 1.00 72.04 C ATOM 2015 CE2 PHE A 128 -19.386 17.979 6.628 1.00 23.03 C ATOM 2016 CZ PHE A 128 -19.376 17.227 7.821 1.00 52.32 C ATOM 0 H PHE A 128 -18.358 14.637 5.088 1.00 52.12 H new ATOM 0 HA PHE A 128 -16.490 14.841 3.162 1.00 3.34 H new ATOM 0 HB2 PHE A 128 -15.642 16.631 5.049 1.00 41.45 H new ATOM 0 HB3 PHE A 128 -16.894 16.911 3.855 1.00 41.45 H new ATOM 0 HD1 PHE A 128 -16.924 15.009 7.034 1.00 34.22 H new ATOM 0 HD2 PHE A 128 -18.490 18.201 4.674 1.00 53.34 H new ATOM 0 HE1 PHE A 128 -18.505 15.548 8.885 1.00 72.04 H new ATOM 0 HE2 PHE A 128 -20.080 18.797 6.504 1.00 23.03 H new ATOM 0 HZ PHE A 128 -20.053 17.488 8.621 1.00 52.32 H new ATOM 2026 N VAL A 129 -15.180 13.524 5.645 1.00 71.01 N ATOM 2027 CA VAL A 129 -14.108 12.654 6.082 1.00 14.33 C ATOM 2028 C VAL A 129 -13.537 11.958 4.851 1.00 52.25 C ATOM 2029 O VAL A 129 -12.355 12.094 4.527 1.00 12.40 O ATOM 2030 CB VAL A 129 -14.699 11.664 7.103 1.00 74.35 C ATOM 2031 CG1 VAL A 129 -13.750 10.513 7.421 1.00 71.24 C ATOM 2032 CG2 VAL A 129 -15.035 12.428 8.382 1.00 52.53 C ATOM 0 H VAL A 129 -16.008 13.442 6.235 1.00 71.01 H new ATOM 0 HA VAL A 129 -13.295 13.195 6.566 1.00 14.33 H new ATOM 0 HB VAL A 129 -15.594 11.221 6.667 1.00 74.35 H new ATOM 0 HG11 VAL A 129 -14.217 9.846 8.146 1.00 71.24 H new ATOM 0 HG12 VAL A 129 -13.530 9.960 6.508 1.00 71.24 H new ATOM 0 HG13 VAL A 129 -12.824 10.909 7.837 1.00 71.24 H new ATOM 0 HG21 VAL A 129 -15.455 11.741 9.117 1.00 52.53 H new ATOM 0 HG22 VAL A 129 -14.128 12.880 8.785 1.00 52.53 H new ATOM 0 HG23 VAL A 129 -15.762 13.209 8.159 1.00 52.53 H new ATOM 2042 N VAL A 130 -14.409 11.257 4.129 1.00 42.42 N ATOM 2043 CA VAL A 130 -14.066 10.553 2.920 1.00 50.34 C ATOM 2044 C VAL A 130 -13.734 11.555 1.823 1.00 13.43 C ATOM 2045 O VAL A 130 -12.706 11.413 1.176 1.00 70.21 O ATOM 2046 CB VAL A 130 -15.186 9.553 2.580 1.00 43.43 C ATOM 2047 CG1 VAL A 130 -15.172 9.013 1.147 1.00 3.34 C ATOM 2048 CG2 VAL A 130 -15.128 8.377 3.573 1.00 54.35 C ATOM 0 H VAL A 130 -15.393 11.168 4.384 1.00 42.42 H new ATOM 0 HA VAL A 130 -13.164 9.953 3.043 1.00 50.34 H new ATOM 0 HB VAL A 130 -16.117 10.114 2.664 1.00 43.43 H new ATOM 0 HG11 VAL A 130 -16.001 8.318 1.012 1.00 3.34 H new ATOM 0 HG12 VAL A 130 -15.275 9.841 0.445 1.00 3.34 H new ATOM 0 HG13 VAL A 130 -14.231 8.495 0.962 1.00 3.34 H new ATOM 0 HG21 VAL A 130 -15.918 7.664 3.339 1.00 54.35 H new ATOM 0 HG22 VAL A 130 -14.159 7.883 3.496 1.00 54.35 H new ATOM 0 HG23 VAL A 130 -15.265 8.751 4.588 1.00 54.35 H new ATOM 2058 N LYS A 131 -14.529 12.611 1.636 1.00 24.11 N ATOM 2059 CA LYS A 131 -14.347 13.556 0.543 1.00 1.30 C ATOM 2060 C LYS A 131 -12.938 14.140 0.507 1.00 32.03 C ATOM 2061 O LYS A 131 -12.265 14.118 -0.529 1.00 22.00 O ATOM 2062 CB LYS A 131 -15.439 14.627 0.638 1.00 13.52 C ATOM 2063 CG LYS A 131 -16.820 13.997 0.548 1.00 74.13 C ATOM 2064 CD LYS A 131 -17.852 14.984 0.039 1.00 44.33 C ATOM 2065 CE LYS A 131 -19.236 14.400 0.314 1.00 33.20 C ATOM 2066 NZ LYS A 131 -20.290 15.117 -0.422 1.00 31.42 N ATOM 0 H LYS A 131 -15.319 12.831 2.243 1.00 24.11 H new ATOM 0 HA LYS A 131 -14.451 13.034 -0.408 1.00 1.30 H new ATOM 0 HB2 LYS A 131 -15.342 15.170 1.578 1.00 13.52 H new ATOM 0 HB3 LYS A 131 -15.313 15.354 -0.164 1.00 13.52 H new ATOM 0 HG2 LYS A 131 -16.784 13.133 -0.116 1.00 74.13 H new ATOM 0 HG3 LYS A 131 -17.119 13.632 1.531 1.00 74.13 H new ATOM 0 HD2 LYS A 131 -17.738 15.946 0.538 1.00 44.33 H new ATOM 0 HD3 LYS A 131 -17.717 15.160 -1.028 1.00 44.33 H new ATOM 0 HE2 LYS A 131 -19.248 13.347 0.032 1.00 33.20 H new ATOM 0 HE3 LYS A 131 -19.444 14.446 1.383 1.00 33.20 H new ATOM 0 HZ1 LYS A 131 -21.214 14.690 -0.209 1.00 31.42 H new ATOM 0 HZ2 LYS A 131 -20.295 16.117 -0.135 1.00 31.42 H new ATOM 0 HZ3 LYS A 131 -20.106 15.051 -1.444 1.00 31.42 H new ATOM 2080 N SER A 132 -12.471 14.603 1.658 1.00 43.34 N ATOM 2081 CA SER A 132 -11.164 15.196 1.811 1.00 65.31 C ATOM 2082 C SER A 132 -10.036 14.158 1.901 1.00 70.31 C ATOM 2083 O SER A 132 -8.890 14.508 1.604 1.00 71.44 O ATOM 2084 CB SER A 132 -11.235 16.081 3.049 1.00 3.50 C ATOM 2085 OG SER A 132 -12.168 17.136 2.845 1.00 63.02 O ATOM 0 H SER A 132 -13.007 14.573 2.525 1.00 43.34 H new ATOM 0 HA SER A 132 -10.912 15.781 0.926 1.00 65.31 H new ATOM 0 HB2 SER A 132 -11.530 15.487 3.914 1.00 3.50 H new ATOM 0 HB3 SER A 132 -10.250 16.494 3.267 1.00 3.50 H new ATOM 0 HG SER A 132 -12.207 17.698 3.647 1.00 63.02 H new ATOM 2091 N LEU A 133 -10.318 12.903 2.276 1.00 32.12 N ATOM 2092 CA LEU A 133 -9.374 11.796 2.141 1.00 4.44 C ATOM 2093 C LEU A 133 -9.168 11.457 0.668 1.00 5.43 C ATOM 2094 O LEU A 133 -8.020 11.443 0.232 1.00 13.54 O ATOM 2095 CB LEU A 133 -9.840 10.556 2.930 1.00 45.52 C ATOM 2096 CG LEU A 133 -9.363 10.565 4.393 1.00 52.12 C ATOM 2097 CD1 LEU A 133 -10.105 9.499 5.209 1.00 50.12 C ATOM 2098 CD2 LEU A 133 -7.854 10.304 4.516 1.00 63.12 C ATOM 0 H LEU A 133 -11.213 12.631 2.683 1.00 32.12 H new ATOM 0 HA LEU A 133 -8.420 12.111 2.565 1.00 4.44 H new ATOM 0 HB2 LEU A 133 -10.929 10.505 2.908 1.00 45.52 H new ATOM 0 HB3 LEU A 133 -9.469 9.657 2.437 1.00 45.52 H new ATOM 0 HG LEU A 133 -9.579 11.561 4.780 1.00 52.12 H new ATOM 0 HD11 LEU A 133 -9.754 9.521 6.241 1.00 50.12 H new ATOM 0 HD12 LEU A 133 -11.176 9.703 5.186 1.00 50.12 H new ATOM 0 HD13 LEU A 133 -9.913 8.515 4.781 1.00 50.12 H new ATOM 0 HD21 LEU A 133 -7.566 10.320 5.567 1.00 63.12 H new ATOM 0 HD22 LEU A 133 -7.618 9.329 4.090 1.00 63.12 H new ATOM 0 HD23 LEU A 133 -7.306 11.077 3.978 1.00 63.12 H new ATOM 2110 N VAL A 134 -10.243 11.249 -0.095 1.00 13.22 N ATOM 2111 CA VAL A 134 -10.218 10.986 -1.530 1.00 70.14 C ATOM 2112 C VAL A 134 -9.347 12.044 -2.195 1.00 70.44 C ATOM 2113 O VAL A 134 -8.406 11.691 -2.897 1.00 30.23 O ATOM 2114 CB VAL A 134 -11.659 10.960 -2.092 1.00 43.25 C ATOM 2115 CG1 VAL A 134 -11.730 10.920 -3.628 1.00 4.52 C ATOM 2116 CG2 VAL A 134 -12.438 9.740 -1.577 1.00 25.40 C ATOM 0 H VAL A 134 -11.189 11.260 0.287 1.00 13.22 H new ATOM 0 HA VAL A 134 -9.788 10.007 -1.740 1.00 70.14 H new ATOM 0 HB VAL A 134 -12.099 11.894 -1.743 1.00 43.25 H new ATOM 0 HG11 VAL A 134 -12.773 10.903 -3.944 1.00 4.52 H new ATOM 0 HG12 VAL A 134 -11.241 11.804 -4.038 1.00 4.52 H new ATOM 0 HG13 VAL A 134 -11.226 10.025 -3.992 1.00 4.52 H new ATOM 0 HG21 VAL A 134 -13.447 9.751 -1.990 1.00 25.40 H new ATOM 0 HG22 VAL A 134 -11.929 8.827 -1.886 1.00 25.40 H new ATOM 0 HG23 VAL A 134 -12.491 9.775 -0.489 1.00 25.40 H new ATOM 2126 N ALA A 135 -9.601 13.329 -1.929 1.00 30.40 N ATOM 2127 CA ALA A 135 -8.873 14.409 -2.574 1.00 65.15 C ATOM 2128 C ALA A 135 -7.354 14.328 -2.354 1.00 30.14 C ATOM 2129 O ALA A 135 -6.619 14.571 -3.306 1.00 43.45 O ATOM 2130 CB ALA A 135 -9.436 15.747 -2.106 1.00 42.35 C ATOM 0 H ALA A 135 -10.311 13.641 -1.266 1.00 30.40 H new ATOM 0 HA ALA A 135 -9.015 14.311 -3.650 1.00 65.15 H new ATOM 0 HB1 ALA A 135 -8.892 16.559 -2.588 1.00 42.35 H new ATOM 0 HB2 ALA A 135 -10.492 15.810 -2.370 1.00 42.35 H new ATOM 0 HB3 ALA A 135 -9.327 15.829 -1.025 1.00 42.35 H new ATOM 2136 N GLN A 136 -6.880 13.948 -1.154 1.00 70.04 N ATOM 2137 CA GLN A 136 -5.454 13.699 -0.921 1.00 43.41 C ATOM 2138 C GLN A 136 -4.926 12.629 -1.854 1.00 72.05 C ATOM 2139 O GLN A 136 -3.815 12.722 -2.366 1.00 4.11 O ATOM 2140 CB GLN A 136 -5.191 13.202 0.510 1.00 23.01 C ATOM 2141 CG GLN A 136 -5.234 14.324 1.526 1.00 51.44 C ATOM 2142 CD GLN A 136 -4.867 13.825 2.917 1.00 44.45 C ATOM 2143 OE1 GLN A 136 -3.758 14.022 3.402 1.00 45.52 O ATOM 2144 NE2 GLN A 136 -5.787 13.182 3.607 1.00 70.14 N ATOM 0 H GLN A 136 -7.468 13.808 -0.332 1.00 70.04 H new ATOM 0 HA GLN A 136 -4.952 14.651 -1.094 1.00 43.41 H new ATOM 0 HB2 GLN A 136 -5.934 12.449 0.773 1.00 23.01 H new ATOM 0 HB3 GLN A 136 -4.216 12.716 0.550 1.00 23.01 H new ATOM 0 HG2 GLN A 136 -4.545 15.114 1.227 1.00 51.44 H new ATOM 0 HG3 GLN A 136 -6.232 14.761 1.546 1.00 51.44 H new ATOM 0 HE21 GLN A 136 -6.708 13.020 3.201 1.00 70.14 H new ATOM 0 HE22 GLN A 136 -5.578 12.847 4.547 1.00 70.14 H new ATOM 2153 N GLN A 137 -5.684 11.548 -1.948 1.00 2.50 N ATOM 2154 CA GLN A 137 -5.210 10.299 -2.481 1.00 24.32 C ATOM 2155 C GLN A 137 -5.280 10.344 -4.005 1.00 42.32 C ATOM 2156 O GLN A 137 -4.399 9.807 -4.662 1.00 64.14 O ATOM 2157 CB GLN A 137 -6.031 9.180 -1.836 1.00 1.20 C ATOM 2158 CG GLN A 137 -5.859 9.120 -0.310 1.00 10.23 C ATOM 2159 CD GLN A 137 -6.971 8.364 0.419 1.00 44.51 C ATOM 2160 OE1 GLN A 137 -7.660 7.494 -0.101 1.00 62.02 O ATOM 2161 NE2 GLN A 137 -7.159 8.665 1.691 1.00 71.01 N ATOM 0 H GLN A 137 -6.659 11.522 -1.649 1.00 2.50 H new ATOM 0 HA GLN A 137 -4.163 10.108 -2.244 1.00 24.32 H new ATOM 0 HB2 GLN A 137 -7.085 9.326 -2.073 1.00 1.20 H new ATOM 0 HB3 GLN A 137 -5.736 8.224 -2.268 1.00 1.20 H new ATOM 0 HG2 GLN A 137 -4.904 8.647 -0.082 1.00 10.23 H new ATOM 0 HG3 GLN A 137 -5.812 10.137 0.079 1.00 10.23 H new ATOM 0 HE21 GLN A 137 -6.591 9.387 2.133 1.00 71.01 H new ATOM 0 HE22 GLN A 137 -7.872 8.175 2.231 1.00 71.01 H new ATOM 2170 N GLU A 138 -6.241 11.063 -4.585 1.00 10.52 N ATOM 2171 CA GLU A 138 -6.254 11.403 -6.001 1.00 42.25 C ATOM 2172 C GLU A 138 -5.078 12.340 -6.290 1.00 42.33 C ATOM 2173 O GLU A 138 -4.230 12.028 -7.123 1.00 41.04 O ATOM 2174 CB GLU A 138 -7.595 12.035 -6.408 1.00 32.40 C ATOM 2175 CG GLU A 138 -8.798 11.133 -6.080 1.00 73.52 C ATOM 2176 CD GLU A 138 -9.759 10.988 -7.254 1.00 62.35 C ATOM 2177 OE1 GLU A 138 -10.484 11.958 -7.580 1.00 72.23 O ATOM 2178 OE2 GLU A 138 -9.781 9.898 -7.871 1.00 62.51 O ATOM 0 H GLU A 138 -7.043 11.430 -4.073 1.00 10.52 H new ATOM 0 HA GLU A 138 -6.145 10.497 -6.597 1.00 42.25 H new ATOM 0 HB2 GLU A 138 -7.712 12.991 -5.897 1.00 32.40 H new ATOM 0 HB3 GLU A 138 -7.584 12.245 -7.478 1.00 32.40 H new ATOM 0 HG2 GLU A 138 -8.439 10.147 -5.786 1.00 73.52 H new ATOM 0 HG3 GLU A 138 -9.334 11.545 -5.225 1.00 73.52 H new ATOM 2185 N LYS A 139 -4.941 13.442 -5.542 1.00 34.11 N ATOM 2186 CA LYS A 139 -3.830 14.385 -5.703 1.00 22.40 C ATOM 2187 C LYS A 139 -2.449 13.756 -5.439 1.00 50.03 C ATOM 2188 O LYS A 139 -1.425 14.394 -5.672 1.00 2.41 O ATOM 2189 CB LYS A 139 -4.096 15.609 -4.810 1.00 44.51 C ATOM 2190 CG LYS A 139 -3.044 16.704 -5.042 1.00 63.35 C ATOM 2191 CD LYS A 139 -3.428 18.064 -4.455 1.00 34.23 C ATOM 2192 CE LYS A 139 -4.140 18.964 -5.466 1.00 43.23 C ATOM 2193 NZ LYS A 139 -3.188 19.898 -6.102 1.00 53.02 N ATOM 0 H LYS A 139 -5.599 13.704 -4.808 1.00 34.11 H new ATOM 0 HA LYS A 139 -3.789 14.695 -6.747 1.00 22.40 H new ATOM 0 HB2 LYS A 139 -5.090 16.006 -5.018 1.00 44.51 H new ATOM 0 HB3 LYS A 139 -4.086 15.307 -3.763 1.00 44.51 H new ATOM 0 HG2 LYS A 139 -2.098 16.384 -4.605 1.00 63.35 H new ATOM 0 HG3 LYS A 139 -2.879 16.815 -6.114 1.00 63.35 H new ATOM 0 HD2 LYS A 139 -4.075 17.912 -3.591 1.00 34.23 H new ATOM 0 HD3 LYS A 139 -2.530 18.567 -4.096 1.00 34.23 H new ATOM 0 HE2 LYS A 139 -4.620 18.352 -6.229 1.00 43.23 H new ATOM 0 HE3 LYS A 139 -4.929 19.526 -4.966 1.00 43.23 H new ATOM 0 HZ1 LYS A 139 -3.694 20.498 -6.784 1.00 53.02 H new ATOM 0 HZ2 LYS A 139 -2.749 20.496 -5.373 1.00 53.02 H new ATOM 0 HZ3 LYS A 139 -2.450 19.358 -6.597 1.00 53.02 H new ATOM 2207 N ALA A 140 -2.373 12.520 -4.953 1.00 24.43 N ATOM 2208 CA ALA A 140 -1.110 11.829 -4.734 1.00 13.43 C ATOM 2209 C ALA A 140 -0.948 10.548 -5.526 1.00 72.21 C ATOM 2210 O ALA A 140 0.171 10.038 -5.585 1.00 70.45 O ATOM 2211 CB ALA A 140 -0.951 11.534 -3.247 1.00 71.01 C ATOM 0 H ALA A 140 -3.192 11.968 -4.699 1.00 24.43 H new ATOM 0 HA ALA A 140 -0.330 12.500 -5.093 1.00 13.43 H new ATOM 0 HB1 ALA A 140 -0.007 11.017 -3.078 1.00 71.01 H new ATOM 0 HB2 ALA A 140 -0.958 12.470 -2.688 1.00 71.01 H new ATOM 0 HB3 ALA A 140 -1.775 10.905 -2.911 1.00 71.01 H new ATOM 2217 N ALA A 141 -2.007 10.031 -6.140 1.00 52.44 N ATOM 2218 CA ALA A 141 -1.959 8.758 -6.834 1.00 63.34 C ATOM 2219 C ALA A 141 -2.626 8.812 -8.210 1.00 51.11 C ATOM 2220 O ALA A 141 -2.606 7.818 -8.935 1.00 23.30 O ATOM 2221 CB ALA A 141 -2.559 7.671 -5.935 1.00 4.40 C ATOM 0 H ALA A 141 -2.920 10.485 -6.168 1.00 52.44 H new ATOM 0 HA ALA A 141 -0.916 8.511 -7.035 1.00 63.34 H new ATOM 0 HB1 ALA A 141 -2.525 6.712 -6.452 1.00 4.40 H new ATOM 0 HB2 ALA A 141 -1.985 7.605 -5.011 1.00 4.40 H new ATOM 0 HB3 ALA A 141 -3.594 7.922 -5.702 1.00 4.40 H new ATOM 2227 N ALA A 142 -3.133 9.977 -8.604 1.00 34.53 N ATOM 2228 CA ALA A 142 -3.653 10.275 -9.930 1.00 63.12 C ATOM 2229 C ALA A 142 -3.056 11.577 -10.482 1.00 63.45 C ATOM 2230 O ALA A 142 -3.424 11.986 -11.585 1.00 22.54 O ATOM 2231 CB ALA A 142 -5.181 10.338 -9.879 1.00 11.13 C ATOM 0 H ALA A 142 -3.194 10.777 -7.974 1.00 34.53 H new ATOM 0 HA ALA A 142 -3.359 9.477 -10.612 1.00 63.12 H new ATOM 0 HB1 ALA A 142 -5.569 10.561 -10.873 1.00 11.13 H new ATOM 0 HB2 ALA A 142 -5.574 9.378 -9.543 1.00 11.13 H new ATOM 0 HB3 ALA A 142 -5.490 11.119 -9.185 1.00 11.13 H new ATOM 2237 N ASP A 143 -2.163 12.241 -9.731 1.00 1.41 N ATOM 2238 CA ASP A 143 -1.488 13.462 -10.159 1.00 45.42 C ATOM 2239 C ASP A 143 -0.566 13.209 -11.357 1.00 72.11 C ATOM 2240 O ASP A 143 -1.026 13.281 -12.494 1.00 25.40 O ATOM 2241 CB ASP A 143 -0.749 14.034 -8.943 1.00 12.21 C ATOM 2242 CG ASP A 143 -0.058 15.359 -9.235 1.00 54.15 C ATOM 2243 OD1 ASP A 143 -0.770 16.317 -9.617 1.00 73.51 O ATOM 2244 OD2 ASP A 143 1.178 15.425 -9.049 1.00 10.41 O ATOM 0 H ASP A 143 -1.890 11.935 -8.797 1.00 1.41 H new ATOM 0 HA ASP A 143 -2.212 14.195 -10.514 1.00 45.42 H new ATOM 0 HB2 ASP A 143 -1.458 14.172 -8.126 1.00 12.21 H new ATOM 0 HB3 ASP A 143 -0.007 13.311 -8.603 1.00 12.21 H new ATOM 2249 N LEU A 144 0.691 12.801 -11.143 1.00 74.43 N ATOM 2250 CA LEU A 144 1.671 12.575 -12.214 1.00 25.53 C ATOM 2251 C LEU A 144 2.994 12.013 -11.674 1.00 31.34 C ATOM 2252 O LEU A 144 4.033 12.236 -12.296 1.00 12.11 O ATOM 2253 CB LEU A 144 1.883 13.850 -13.085 1.00 52.44 C ATOM 2254 CG LEU A 144 2.079 15.208 -12.375 1.00 32.24 C ATOM 2255 CD1 LEU A 144 3.378 15.301 -11.571 1.00 44.04 C ATOM 2256 CD2 LEU A 144 2.080 16.335 -13.412 1.00 11.02 C ATOM 0 H LEU A 144 1.061 12.616 -10.211 1.00 74.43 H new ATOM 0 HA LEU A 144 1.255 11.812 -12.871 1.00 25.53 H new ATOM 0 HB2 LEU A 144 2.755 13.678 -13.716 1.00 52.44 H new ATOM 0 HB3 LEU A 144 1.023 13.944 -13.748 1.00 52.44 H new ATOM 0 HG LEU A 144 1.250 15.303 -11.674 1.00 32.24 H new ATOM 0 HD11 LEU A 144 3.446 16.282 -11.101 1.00 44.04 H new ATOM 0 HD12 LEU A 144 3.386 14.529 -10.801 1.00 44.04 H new ATOM 0 HD13 LEU A 144 4.229 15.158 -12.237 1.00 44.04 H new ATOM 0 HD21 LEU A 144 2.218 17.292 -12.909 1.00 11.02 H new ATOM 0 HD22 LEU A 144 2.893 16.177 -14.121 1.00 11.02 H new ATOM 0 HD23 LEU A 144 1.129 16.340 -13.945 1.00 11.02 H new ATOM 2268 N GLN A 145 3.018 11.347 -10.509 1.00 24.24 N ATOM 2269 CA GLN A 145 4.285 11.021 -9.849 1.00 25.51 C ATOM 2270 C GLN A 145 4.606 9.537 -10.060 1.00 12.33 C ATOM 2271 O GLN A 145 5.518 9.184 -10.809 1.00 73.12 O ATOM 2272 CB GLN A 145 4.296 11.432 -8.364 1.00 42.34 C ATOM 2273 CG GLN A 145 3.714 12.830 -8.051 1.00 13.34 C ATOM 2274 CD GLN A 145 2.675 12.737 -6.942 1.00 41.34 C ATOM 2275 OE1 GLN A 145 1.646 11.934 -7.145 1.00 70.15 O flip ATOM 2276 NE2 GLN A 145 2.819 13.327 -5.875 1.00 53.32 N flip ATOM 0 H GLN A 145 2.186 11.029 -10.013 1.00 24.24 H new ATOM 0 HA GLN A 145 5.080 11.608 -10.310 1.00 25.51 H new ATOM 0 HB2 GLN A 145 3.735 10.690 -7.796 1.00 42.34 H new ATOM 0 HB3 GLN A 145 5.324 11.398 -8.004 1.00 42.34 H new ATOM 0 HG2 GLN A 145 4.515 13.506 -7.751 1.00 13.34 H new ATOM 0 HG3 GLN A 145 3.261 13.251 -8.948 1.00 13.34 H new ATOM 0 HE21 GLN A 145 3.620 13.943 -5.737 1.00 53.32 H new ATOM 0 HE22 GLN A 145 2.137 13.201 -5.127 1.00 53.32 H new ATOM 2285 N LEU A 146 3.843 8.684 -9.375 1.00 52.15 N ATOM 2286 CA LEU A 146 4.062 7.254 -9.227 1.00 42.13 C ATOM 2287 C LEU A 146 3.475 6.499 -10.417 1.00 44.05 C ATOM 2288 O LEU A 146 4.205 6.009 -11.276 1.00 43.21 O ATOM 2289 CB LEU A 146 3.449 6.851 -7.870 1.00 2.40 C ATOM 2290 CG LEU A 146 3.296 5.330 -7.668 1.00 61.43 C ATOM 2291 CD1 LEU A 146 4.165 4.813 -6.534 1.00 44.34 C ATOM 2292 CD2 LEU A 146 1.835 4.961 -7.374 1.00 3.12 C ATOM 0 H LEU A 146 3.007 8.997 -8.881 1.00 52.15 H new ATOM 0 HA LEU A 146 5.121 6.996 -9.225 1.00 42.13 H new ATOM 0 HB2 LEU A 146 4.072 7.251 -7.070 1.00 2.40 H new ATOM 0 HB3 LEU A 146 2.469 7.319 -7.774 1.00 2.40 H new ATOM 0 HG LEU A 146 3.619 4.862 -8.598 1.00 61.43 H new ATOM 0 HD11 LEU A 146 4.024 3.737 -6.429 1.00 44.34 H new ATOM 0 HD12 LEU A 146 5.212 5.022 -6.754 1.00 44.34 H new ATOM 0 HD13 LEU A 146 3.883 5.308 -5.605 1.00 44.34 H new ATOM 0 HD21 LEU A 146 1.753 3.883 -7.235 1.00 3.12 H new ATOM 0 HD22 LEU A 146 1.507 5.470 -6.468 1.00 3.12 H new ATOM 0 HD23 LEU A 146 1.207 5.268 -8.210 1.00 3.12 H new ATOM 2304 N GLN A 147 2.149 6.395 -10.451 1.00 62.34 N ATOM 2305 CA GLN A 147 1.316 5.807 -11.494 1.00 50.42 C ATOM 2306 C GLN A 147 1.576 4.314 -11.782 1.00 25.22 C ATOM 2307 O GLN A 147 0.979 3.749 -12.701 1.00 70.23 O ATOM 2308 CB GLN A 147 1.358 6.726 -12.726 1.00 71.42 C ATOM 2309 CG GLN A 147 1.041 8.187 -12.357 1.00 3.43 C ATOM 2310 CD GLN A 147 0.586 9.033 -13.539 1.00 71.45 C ATOM 2311 OE1 GLN A 147 1.381 9.452 -14.372 1.00 25.30 O ATOM 2312 NE2 GLN A 147 -0.695 9.340 -13.628 1.00 24.44 N ATOM 0 H GLN A 147 1.582 6.751 -9.682 1.00 62.34 H new ATOM 0 HA GLN A 147 0.290 5.763 -11.129 1.00 50.42 H new ATOM 0 HB2 GLN A 147 2.345 6.673 -13.186 1.00 71.42 H new ATOM 0 HB3 GLN A 147 0.641 6.374 -13.467 1.00 71.42 H new ATOM 0 HG2 GLN A 147 0.264 8.199 -11.593 1.00 3.43 H new ATOM 0 HG3 GLN A 147 1.928 8.642 -11.916 1.00 3.43 H new ATOM 0 HE21 GLN A 147 -1.353 8.989 -12.932 1.00 24.44 H new ATOM 0 HE22 GLN A 147 -1.027 9.928 -14.392 1.00 24.44 H new ATOM 2321 N GLY A 148 2.403 3.635 -10.983 1.00 4.13 N ATOM 2322 CA GLY A 148 2.689 2.213 -11.085 1.00 14.10 C ATOM 2323 C GLY A 148 2.943 1.656 -9.690 1.00 63.31 C ATOM 2324 O GLY A 148 3.514 2.350 -8.852 1.00 54.04 O ATOM 0 H GLY A 148 2.908 4.084 -10.219 1.00 4.13 H new ATOM 0 HA2 GLY A 148 1.852 1.693 -11.551 1.00 14.10 H new ATOM 0 HA3 GLY A 148 3.560 2.049 -11.720 1.00 14.10 H new ATOM 2328 N VAL A 149 2.563 0.406 -9.431 1.00 13.12 N ATOM 2329 CA VAL A 149 2.603 -0.195 -8.095 1.00 24.52 C ATOM 2330 C VAL A 149 3.149 -1.633 -8.153 1.00 43.41 C ATOM 2331 O VAL A 149 3.212 -2.198 -9.251 1.00 33.51 O ATOM 2332 CB VAL A 149 1.183 -0.133 -7.484 1.00 31.21 C ATOM 2333 CG1 VAL A 149 0.854 1.290 -7.031 1.00 24.12 C ATOM 2334 CG2 VAL A 149 0.078 -0.682 -8.399 1.00 45.05 C ATOM 0 H VAL A 149 2.214 -0.227 -10.150 1.00 13.12 H new ATOM 0 HA VAL A 149 3.285 0.364 -7.455 1.00 24.52 H new ATOM 0 HB VAL A 149 1.204 -0.797 -6.620 1.00 31.21 H new ATOM 0 HG11 VAL A 149 -0.149 1.313 -6.604 1.00 24.12 H new ATOM 0 HG12 VAL A 149 1.576 1.609 -6.279 1.00 24.12 H new ATOM 0 HG13 VAL A 149 0.900 1.964 -7.886 1.00 24.12 H new ATOM 0 HG21 VAL A 149 -0.885 -0.602 -7.895 1.00 45.05 H new ATOM 0 HG22 VAL A 149 0.053 -0.107 -9.324 1.00 45.05 H new ATOM 0 HG23 VAL A 149 0.281 -1.728 -8.628 1.00 45.05 H new ATOM 2344 N PRO A 150 3.467 -2.271 -7.009 1.00 63.54 N ATOM 2345 CA PRO A 150 3.560 -1.682 -5.672 1.00 63.02 C ATOM 2346 C PRO A 150 4.779 -0.786 -5.508 1.00 22.14 C ATOM 2347 O PRO A 150 5.723 -0.873 -6.295 1.00 71.15 O ATOM 2348 CB PRO A 150 3.631 -2.857 -4.712 1.00 25.32 C ATOM 2349 CG PRO A 150 4.275 -3.973 -5.532 1.00 33.13 C ATOM 2350 CD PRO A 150 3.803 -3.686 -6.956 1.00 45.43 C ATOM 0 HA PRO A 150 2.701 -1.039 -5.482 1.00 63.02 H new ATOM 0 HB2 PRO A 150 4.226 -2.616 -3.831 1.00 25.32 H new ATOM 0 HB3 PRO A 150 2.640 -3.143 -4.359 1.00 25.32 H new ATOM 0 HG2 PRO A 150 5.362 -3.950 -5.457 1.00 33.13 H new ATOM 0 HG3 PRO A 150 3.953 -4.958 -5.193 1.00 33.13 H new ATOM 0 HD2 PRO A 150 4.584 -3.925 -7.678 1.00 45.43 H new ATOM 0 HD3 PRO A 150 2.937 -4.299 -7.208 1.00 45.43 H new ATOM 2358 N ALA A 151 4.739 0.055 -4.474 1.00 21.34 N ATOM 2359 CA ALA A 151 5.828 0.940 -4.104 1.00 33.22 C ATOM 2360 C ALA A 151 5.838 1.216 -2.601 1.00 11.40 C ATOM 2361 O ALA A 151 4.778 1.194 -1.967 1.00 13.31 O ATOM 2362 CB ALA A 151 5.630 2.263 -4.846 1.00 52.13 C ATOM 0 H ALA A 151 3.928 0.137 -3.861 1.00 21.34 H new ATOM 0 HA ALA A 151 6.774 0.468 -4.368 1.00 33.22 H new ATOM 0 HB1 ALA A 151 6.436 2.950 -4.587 1.00 52.13 H new ATOM 0 HB2 ALA A 151 5.639 2.082 -5.921 1.00 52.13 H new ATOM 0 HB3 ALA A 151 4.674 2.701 -4.560 1.00 52.13 H new ATOM 2368 N MET A 152 7.003 1.588 -2.064 1.00 14.50 N ATOM 2369 CA MET A 152 7.176 2.096 -0.706 1.00 53.33 C ATOM 2370 C MET A 152 8.255 3.177 -0.747 1.00 63.03 C ATOM 2371 O MET A 152 9.388 2.911 -1.155 1.00 1.43 O ATOM 2372 CB MET A 152 7.532 0.949 0.255 1.00 1.12 C ATOM 2373 CG MET A 152 7.408 1.372 1.727 1.00 33.03 C ATOM 2374 SD MET A 152 7.481 0.024 2.952 1.00 3.24 S ATOM 2375 CE MET A 152 5.921 -0.864 2.632 1.00 61.15 C ATOM 0 H MET A 152 7.880 1.541 -2.583 1.00 14.50 H new ATOM 0 HA MET A 152 6.250 2.532 -0.331 1.00 53.33 H new ATOM 0 HB2 MET A 152 6.875 0.100 0.065 1.00 1.12 H new ATOM 0 HB3 MET A 152 8.551 0.614 0.059 1.00 1.12 H new ATOM 0 HG2 MET A 152 8.205 2.082 1.949 1.00 33.03 H new ATOM 0 HG3 MET A 152 6.464 1.902 1.854 1.00 33.03 H new ATOM 0 HE1 MET A 152 5.286 -0.814 3.516 1.00 61.15 H new ATOM 0 HE2 MET A 152 5.406 -0.403 1.789 1.00 61.15 H new ATOM 0 HE3 MET A 152 6.137 -1.907 2.399 1.00 61.15 H new ATOM 2385 N TYR A 153 7.897 4.403 -0.372 1.00 52.55 N ATOM 2386 CA TYR A 153 8.800 5.538 -0.265 1.00 3.52 C ATOM 2387 C TYR A 153 9.213 5.664 1.200 1.00 43.33 C ATOM 2388 O TYR A 153 8.349 5.673 2.084 1.00 11.33 O ATOM 2389 CB TYR A 153 8.089 6.821 -0.716 1.00 72.42 C ATOM 2390 CG TYR A 153 7.806 6.922 -2.201 1.00 14.24 C ATOM 2391 CD1 TYR A 153 6.584 6.474 -2.736 1.00 64.03 C ATOM 2392 CD2 TYR A 153 8.743 7.555 -3.036 1.00 62.22 C ATOM 2393 CE1 TYR A 153 6.316 6.655 -4.105 1.00 64.02 C ATOM 2394 CE2 TYR A 153 8.471 7.768 -4.398 1.00 12.50 C ATOM 2395 CZ TYR A 153 7.249 7.314 -4.941 1.00 34.01 C ATOM 2396 OH TYR A 153 6.948 7.540 -6.247 1.00 43.12 O ATOM 0 H TYR A 153 6.935 4.638 -0.126 1.00 52.55 H new ATOM 0 HA TYR A 153 9.673 5.390 -0.900 1.00 3.52 H new ATOM 0 HB2 TYR A 153 7.145 6.901 -0.178 1.00 72.42 H new ATOM 0 HB3 TYR A 153 8.697 7.676 -0.421 1.00 72.42 H new ATOM 0 HD1 TYR A 153 5.856 5.994 -2.099 1.00 64.03 H new ATOM 0 HD2 TYR A 153 9.686 7.883 -2.624 1.00 62.22 H new ATOM 0 HE1 TYR A 153 5.390 6.288 -4.522 1.00 64.02 H new ATOM 0 HE2 TYR A 153 9.190 8.275 -5.024 1.00 12.50 H new ATOM 0 HH TYR A 153 7.695 8.003 -6.680 1.00 43.12 H new ATOM 2406 N VAL A 154 10.512 5.812 1.471 1.00 12.54 N ATOM 2407 CA VAL A 154 11.050 5.798 2.835 1.00 43.11 C ATOM 2408 C VAL A 154 11.240 7.195 3.432 1.00 10.12 C ATOM 2409 O VAL A 154 11.094 7.375 4.643 1.00 22.04 O ATOM 2410 CB VAL A 154 12.370 5.000 2.849 1.00 23.02 C ATOM 2411 CG1 VAL A 154 13.006 5.033 4.251 1.00 51.24 C ATOM 2412 CG2 VAL A 154 12.079 3.546 2.495 1.00 65.03 C ATOM 0 H VAL A 154 11.222 5.945 0.751 1.00 12.54 H new ATOM 0 HA VAL A 154 10.313 5.311 3.474 1.00 43.11 H new ATOM 0 HB VAL A 154 13.053 5.448 2.127 1.00 23.02 H new ATOM 0 HG11 VAL A 154 13.936 4.465 4.242 1.00 51.24 H new ATOM 0 HG12 VAL A 154 13.214 6.065 4.532 1.00 51.24 H new ATOM 0 HG13 VAL A 154 12.319 4.592 4.973 1.00 51.24 H new ATOM 0 HG21 VAL A 154 13.008 2.977 2.503 1.00 65.03 H new ATOM 0 HG22 VAL A 154 11.389 3.125 3.226 1.00 65.03 H new ATOM 0 HG23 VAL A 154 11.631 3.496 1.502 1.00 65.03 H new ATOM 2422 N ASN A 155 11.627 8.181 2.625 1.00 2.42 N ATOM 2423 CA ASN A 155 11.891 9.539 3.108 1.00 64.01 C ATOM 2424 C ASN A 155 11.602 10.546 1.991 1.00 14.33 C ATOM 2425 O ASN A 155 12.304 11.546 1.819 1.00 10.44 O ATOM 2426 CB ASN A 155 13.333 9.609 3.645 1.00 3.22 C ATOM 2427 CG ASN A 155 13.504 10.680 4.711 1.00 23.44 C ATOM 2428 OD1 ASN A 155 13.986 11.776 4.445 1.00 22.40 O ATOM 2429 ND2 ASN A 155 13.148 10.374 5.946 1.00 5.30 N ATOM 0 H ASN A 155 11.767 8.064 1.621 1.00 2.42 H new ATOM 0 HA ASN A 155 11.231 9.800 3.935 1.00 64.01 H new ATOM 0 HB2 ASN A 155 13.611 8.640 4.060 1.00 3.22 H new ATOM 0 HB3 ASN A 155 14.016 9.810 2.819 1.00 3.22 H new ATOM 0 HD21 ASN A 155 13.272 11.054 6.696 1.00 5.30 H new ATOM 0 HD22 ASN A 155 12.749 9.458 6.149 1.00 5.30 H new ATOM 2436 N GLY A 156 10.634 10.225 1.129 1.00 30.41 N ATOM 2437 CA GLY A 156 10.419 10.819 -0.182 1.00 24.14 C ATOM 2438 C GLY A 156 11.537 10.409 -1.134 1.00 5.10 C ATOM 2439 O GLY A 156 11.315 9.670 -2.085 1.00 22.31 O ATOM 0 H GLY A 156 9.945 9.504 1.344 1.00 30.41 H new ATOM 0 HA2 GLY A 156 9.456 10.500 -0.581 1.00 24.14 H new ATOM 0 HA3 GLY A 156 10.384 11.905 -0.096 1.00 24.14 H new ATOM 2443 N LYS A 157 12.770 10.835 -0.849 1.00 21.40 N ATOM 2444 CA LYS A 157 13.923 10.712 -1.737 1.00 43.51 C ATOM 2445 C LYS A 157 14.312 9.300 -2.167 1.00 62.41 C ATOM 2446 O LYS A 157 15.031 9.195 -3.162 1.00 5.22 O ATOM 2447 CB LYS A 157 15.137 11.436 -1.132 1.00 24.30 C ATOM 2448 CG LYS A 157 15.686 10.895 0.189 1.00 14.33 C ATOM 2449 CD LYS A 157 16.751 11.850 0.760 1.00 62.32 C ATOM 2450 CE LYS A 157 18.151 11.512 0.232 1.00 71.23 C ATOM 2451 NZ LYS A 157 19.080 12.656 0.262 1.00 14.21 N ATOM 0 H LYS A 157 12.998 11.289 0.035 1.00 21.40 H new ATOM 0 HA LYS A 157 13.595 11.187 -2.662 1.00 43.51 H new ATOM 0 HB2 LYS A 157 15.943 11.416 -1.866 1.00 24.30 H new ATOM 0 HB3 LYS A 157 14.867 12.481 -0.983 1.00 24.30 H new ATOM 0 HG2 LYS A 157 14.874 10.776 0.906 1.00 14.33 H new ATOM 0 HG3 LYS A 157 16.120 9.908 0.032 1.00 14.33 H new ATOM 0 HD2 LYS A 157 16.499 12.877 0.495 1.00 62.32 H new ATOM 0 HD3 LYS A 157 16.748 11.791 1.848 1.00 62.32 H new ATOM 0 HE2 LYS A 157 18.569 10.699 0.826 1.00 71.23 H new ATOM 0 HE3 LYS A 157 18.067 11.148 -0.792 1.00 71.23 H new ATOM 0 HZ1 LYS A 157 20.006 12.361 -0.107 1.00 14.21 H new ATOM 0 HZ2 LYS A 157 18.702 13.426 -0.326 1.00 14.21 H new ATOM 0 HZ3 LYS A 157 19.188 12.990 1.241 1.00 14.21 H new ATOM 2465 N TYR A 158 13.864 8.257 -1.460 1.00 1.30 N ATOM 2466 CA TYR A 158 14.178 6.879 -1.800 1.00 44.31 C ATOM 2467 C TYR A 158 12.924 6.034 -1.880 1.00 34.40 C ATOM 2468 O TYR A 158 12.099 6.072 -0.960 1.00 33.10 O ATOM 2469 CB TYR A 158 15.177 6.262 -0.821 1.00 54.44 C ATOM 2470 CG TYR A 158 16.482 7.015 -0.705 1.00 13.24 C ATOM 2471 CD1 TYR A 158 17.251 7.295 -1.848 1.00 30.24 C ATOM 2472 CD2 TYR A 158 16.906 7.468 0.553 1.00 3.51 C ATOM 2473 CE1 TYR A 158 18.449 8.012 -1.731 1.00 24.14 C ATOM 2474 CE2 TYR A 158 18.101 8.196 0.677 1.00 73.13 C ATOM 2475 CZ TYR A 158 18.895 8.441 -0.464 1.00 24.13 C ATOM 2476 OH TYR A 158 20.061 9.127 -0.342 1.00 74.35 O ATOM 0 H TYR A 158 13.272 8.353 -0.635 1.00 1.30 H new ATOM 0 HA TYR A 158 14.646 6.895 -2.784 1.00 44.31 H new ATOM 0 HB2 TYR A 158 14.715 6.206 0.164 1.00 54.44 H new ATOM 0 HB3 TYR A 158 15.388 5.239 -1.132 1.00 54.44 H new ATOM 0 HD1 TYR A 158 16.918 6.957 -2.818 1.00 30.24 H new ATOM 0 HD2 TYR A 158 16.312 7.256 1.429 1.00 3.51 H new ATOM 0 HE1 TYR A 158 19.032 8.236 -2.612 1.00 24.14 H new ATOM 0 HE2 TYR A 158 18.411 8.567 1.643 1.00 73.13 H new ATOM 0 HH TYR A 158 20.223 9.644 -1.159 1.00 74.35 H new ATOM 2486 N GLN A 159 12.840 5.237 -2.947 1.00 52.42 N ATOM 2487 CA GLN A 159 11.783 4.272 -3.207 1.00 25.31 C ATOM 2488 C GLN A 159 12.453 2.901 -3.164 1.00 61.13 C ATOM 2489 O GLN A 159 13.570 2.739 -3.673 1.00 51.44 O ATOM 2490 CB GLN A 159 11.123 4.582 -4.570 1.00 21.00 C ATOM 2491 CG GLN A 159 9.625 4.243 -4.659 1.00 63.01 C ATOM 2492 CD GLN A 159 9.345 2.816 -5.116 1.00 2.20 C ATOM 2493 OE1 GLN A 159 8.939 1.973 -4.322 1.00 2.42 O ATOM 2494 NE2 GLN A 159 9.511 2.541 -6.406 1.00 44.21 N ATOM 0 H GLN A 159 13.543 5.252 -3.685 1.00 52.42 H new ATOM 0 HA GLN A 159 10.979 4.309 -2.472 1.00 25.31 H new ATOM 0 HB2 GLN A 159 11.254 5.642 -4.787 1.00 21.00 H new ATOM 0 HB3 GLN A 159 11.652 4.030 -5.347 1.00 21.00 H new ATOM 0 HG2 GLN A 159 9.168 4.398 -3.682 1.00 63.01 H new ATOM 0 HG3 GLN A 159 9.145 4.937 -5.349 1.00 63.01 H new ATOM 0 HE21 GLN A 159 9.850 3.263 -7.042 1.00 44.21 H new ATOM 0 HE22 GLN A 159 9.299 1.608 -6.760 1.00 44.21 H new ATOM 2503 N LEU A 160 11.811 1.926 -2.527 1.00 53.14 N ATOM 2504 CA LEU A 160 12.292 0.552 -2.477 1.00 11.30 C ATOM 2505 C LEU A 160 12.307 0.012 -3.905 1.00 54.51 C ATOM 2506 O LEU A 160 11.429 0.349 -4.702 1.00 72.01 O ATOM 2507 CB LEU A 160 11.351 -0.258 -1.559 1.00 64.42 C ATOM 2508 CG LEU A 160 11.785 -0.321 -0.081 1.00 62.44 C ATOM 2509 CD1 LEU A 160 12.962 -1.272 0.158 1.00 22.13 C ATOM 2510 CD2 LEU A 160 12.123 1.057 0.484 1.00 4.43 C ATOM 0 H LEU A 160 10.934 2.071 -2.027 1.00 53.14 H new ATOM 0 HA LEU A 160 13.301 0.481 -2.070 1.00 11.30 H new ATOM 0 HB2 LEU A 160 10.353 0.177 -1.612 1.00 64.42 H new ATOM 0 HB3 LEU A 160 11.277 -1.275 -1.945 1.00 64.42 H new ATOM 0 HG LEU A 160 10.918 -0.716 0.449 1.00 62.44 H new ATOM 0 HD11 LEU A 160 13.220 -1.272 1.217 1.00 22.13 H new ATOM 0 HD12 LEU A 160 12.683 -2.280 -0.148 1.00 22.13 H new ATOM 0 HD13 LEU A 160 13.821 -0.941 -0.425 1.00 22.13 H new ATOM 0 HD21 LEU A 160 12.423 0.959 1.527 1.00 4.43 H new ATOM 0 HD22 LEU A 160 12.941 1.495 -0.089 1.00 4.43 H new ATOM 0 HD23 LEU A 160 11.247 1.702 0.417 1.00 4.43 H new ATOM 2522 N ASN A 161 13.305 -0.805 -4.243 1.00 11.31 N ATOM 2523 CA ASN A 161 13.486 -1.315 -5.598 1.00 30.02 C ATOM 2524 C ASN A 161 13.538 -2.837 -5.585 1.00 61.04 C ATOM 2525 O ASN A 161 14.614 -3.427 -5.717 1.00 32.34 O ATOM 2526 CB ASN A 161 14.735 -0.722 -6.244 1.00 45.41 C ATOM 2527 CG ASN A 161 14.658 -0.867 -7.758 1.00 52.04 C ATOM 2528 OD1 ASN A 161 13.691 -0.459 -8.397 1.00 33.34 O ATOM 2529 ND2 ASN A 161 15.678 -1.402 -8.391 1.00 23.32 N ATOM 0 H ASN A 161 14.010 -1.131 -3.582 1.00 11.31 H new ATOM 0 HA ASN A 161 12.631 -1.008 -6.201 1.00 30.02 H new ATOM 0 HB2 ASN A 161 14.828 0.330 -5.976 1.00 45.41 H new ATOM 0 HB3 ASN A 161 15.624 -1.227 -5.867 1.00 45.41 H new ATOM 0 HD21 ASN A 161 15.665 -1.477 -9.408 1.00 23.32 H new ATOM 0 HD22 ASN A 161 16.483 -1.742 -7.865 1.00 23.32 H new ATOM 2536 N PRO A 162 12.393 -3.512 -5.424 1.00 42.12 N ATOM 2537 CA PRO A 162 12.398 -4.947 -5.237 1.00 22.04 C ATOM 2538 C PRO A 162 12.842 -5.673 -6.509 1.00 33.24 C ATOM 2539 O PRO A 162 13.376 -6.773 -6.406 1.00 32.12 O ATOM 2540 CB PRO A 162 10.977 -5.293 -4.796 1.00 63.32 C ATOM 2541 CG PRO A 162 10.117 -4.171 -5.366 1.00 65.33 C ATOM 2542 CD PRO A 162 11.055 -2.970 -5.267 1.00 23.02 C ATOM 0 HA PRO A 162 13.118 -5.272 -4.486 1.00 22.04 H new ATOM 0 HB2 PRO A 162 10.668 -6.265 -5.181 1.00 63.32 H new ATOM 0 HB3 PRO A 162 10.899 -5.340 -3.710 1.00 63.32 H new ATOM 0 HG2 PRO A 162 9.816 -4.370 -6.395 1.00 65.33 H new ATOM 0 HG3 PRO A 162 9.204 -4.024 -4.790 1.00 65.33 H new ATOM 0 HD2 PRO A 162 10.835 -2.235 -6.041 1.00 23.02 H new ATOM 0 HD3 PRO A 162 10.946 -2.464 -4.308 1.00 23.02 H new ATOM 2550 N GLN A 163 12.717 -5.039 -7.684 1.00 11.44 N ATOM 2551 CA GLN A 163 13.259 -5.550 -8.943 1.00 3.11 C ATOM 2552 C GLN A 163 14.739 -5.931 -8.875 1.00 2.05 C ATOM 2553 O GLN A 163 15.154 -6.843 -9.590 1.00 41.31 O ATOM 2554 CB GLN A 163 13.013 -4.637 -10.150 1.00 45.01 C ATOM 2555 CG GLN A 163 13.267 -3.197 -9.803 1.00 25.22 C ATOM 2556 CD GLN A 163 13.906 -2.427 -10.958 1.00 41.11 C ATOM 2557 OE1 GLN A 163 15.120 -2.254 -10.999 1.00 50.24 O ATOM 2558 NE2 GLN A 163 13.139 -1.957 -11.923 1.00 13.11 N ATOM 0 H GLN A 163 12.231 -4.148 -7.784 1.00 11.44 H new ATOM 0 HA GLN A 163 12.686 -6.464 -9.098 1.00 3.11 H new ATOM 0 HB2 GLN A 163 13.662 -4.935 -10.973 1.00 45.01 H new ATOM 0 HB3 GLN A 163 11.986 -4.755 -10.495 1.00 45.01 H new ATOM 0 HG2 GLN A 163 12.326 -2.720 -9.528 1.00 25.22 H new ATOM 0 HG3 GLN A 163 13.918 -3.145 -8.930 1.00 25.22 H new ATOM 0 HE21 GLN A 163 12.130 -2.101 -11.888 1.00 13.11 H new ATOM 0 HE22 GLN A 163 13.555 -1.449 -12.704 1.00 13.11 H new ATOM 2567 N GLY A 164 15.535 -5.231 -8.060 1.00 24.31 N ATOM 2568 CA GLY A 164 16.958 -5.500 -7.958 1.00 53.42 C ATOM 2569 C GLY A 164 17.321 -6.271 -6.696 1.00 14.22 C ATOM 2570 O GLY A 164 18.514 -6.452 -6.444 1.00 70.04 O ATOM 0 H GLY A 164 15.208 -4.472 -7.462 1.00 24.31 H new ATOM 0 HA2 GLY A 164 17.280 -6.068 -8.831 1.00 53.42 H new ATOM 0 HA3 GLY A 164 17.504 -4.557 -7.972 1.00 53.42 H new ATOM 2574 N MET A 165 16.353 -6.704 -5.879 1.00 33.11 N ATOM 2575 CA MET A 165 16.640 -7.577 -4.756 1.00 1.45 C ATOM 2576 C MET A 165 16.780 -9.008 -5.256 1.00 42.22 C ATOM 2577 O MET A 165 16.606 -9.307 -6.435 1.00 71.30 O ATOM 2578 CB MET A 165 15.546 -7.434 -3.690 1.00 62.21 C ATOM 2579 CG MET A 165 15.775 -6.119 -2.954 1.00 63.44 C ATOM 2580 SD MET A 165 14.565 -5.681 -1.690 1.00 5.21 S ATOM 2581 CE MET A 165 15.312 -4.090 -1.275 1.00 44.30 C ATOM 0 H MET A 165 15.368 -6.459 -5.982 1.00 33.11 H new ATOM 0 HA MET A 165 17.583 -7.295 -4.287 1.00 1.45 H new ATOM 0 HB2 MET A 165 14.559 -7.445 -4.153 1.00 62.21 H new ATOM 0 HB3 MET A 165 15.581 -8.272 -2.993 1.00 62.21 H new ATOM 0 HG2 MET A 165 16.759 -6.157 -2.486 1.00 63.44 H new ATOM 0 HG3 MET A 165 15.804 -5.316 -3.691 1.00 63.44 H new ATOM 0 HE1 MET A 165 14.556 -3.435 -0.842 1.00 44.30 H new ATOM 0 HE2 MET A 165 16.116 -4.242 -0.555 1.00 44.30 H new ATOM 0 HE3 MET A 165 15.716 -3.631 -2.178 1.00 44.30 H new ATOM 2591 N ASP A 166 17.157 -9.903 -4.349 1.00 10.33 N ATOM 2592 CA ASP A 166 17.062 -11.333 -4.590 1.00 70.04 C ATOM 2593 C ASP A 166 15.588 -11.701 -4.467 1.00 2.12 C ATOM 2594 O ASP A 166 15.075 -11.714 -3.351 1.00 10.51 O ATOM 2595 CB ASP A 166 17.896 -12.102 -3.561 1.00 11.22 C ATOM 2596 CG ASP A 166 17.947 -13.601 -3.856 1.00 3.25 C ATOM 2597 OD1 ASP A 166 17.031 -14.153 -4.505 1.00 3.55 O ATOM 2598 OD2 ASP A 166 18.910 -14.247 -3.374 1.00 2.21 O ATOM 0 H ASP A 166 17.534 -9.657 -3.434 1.00 10.33 H new ATOM 0 HA ASP A 166 17.446 -11.591 -5.577 1.00 70.04 H new ATOM 0 HB2 ASP A 166 18.910 -11.702 -3.547 1.00 11.22 H new ATOM 0 HB3 ASP A 166 17.478 -11.944 -2.567 1.00 11.22 H new ATOM 2603 N THR A 167 14.894 -11.988 -5.563 1.00 54.30 N ATOM 2604 CA THR A 167 13.485 -12.366 -5.610 1.00 25.32 C ATOM 2605 C THR A 167 13.360 -13.808 -6.116 1.00 34.13 C ATOM 2606 O THR A 167 12.360 -14.149 -6.747 1.00 41.20 O ATOM 2607 CB THR A 167 12.683 -11.364 -6.471 1.00 23.22 C ATOM 2608 OG1 THR A 167 13.139 -11.339 -7.802 1.00 23.51 O ATOM 2609 CG2 THR A 167 12.698 -9.927 -5.958 1.00 72.44 C ATOM 0 H THR A 167 15.320 -11.962 -6.490 1.00 54.30 H new ATOM 0 HA THR A 167 13.057 -12.327 -4.608 1.00 25.32 H new ATOM 0 HB THR A 167 11.661 -11.737 -6.408 1.00 23.22 H new ATOM 0 HG1 THR A 167 12.608 -10.696 -8.318 1.00 23.51 H new ATOM 0 HG21 THR A 167 12.110 -9.296 -6.625 1.00 72.44 H new ATOM 0 HG22 THR A 167 12.270 -9.894 -4.956 1.00 72.44 H new ATOM 0 HG23 THR A 167 13.725 -9.563 -5.926 1.00 72.44 H new ATOM 2617 N SER A 168 14.368 -14.651 -5.876 1.00 14.11 N ATOM 2618 CA SER A 168 14.393 -16.016 -6.403 1.00 11.21 C ATOM 2619 C SER A 168 14.187 -17.099 -5.347 1.00 31.14 C ATOM 2620 O SER A 168 14.118 -18.278 -5.696 1.00 10.35 O ATOM 2621 CB SER A 168 15.637 -16.236 -7.259 1.00 4.42 C ATOM 2622 OG SER A 168 15.558 -15.410 -8.413 1.00 23.32 O ATOM 0 H SER A 168 15.184 -14.408 -5.315 1.00 14.11 H new ATOM 0 HA SER A 168 13.521 -16.120 -7.049 1.00 11.21 H new ATOM 0 HB2 SER A 168 16.534 -15.999 -6.687 1.00 4.42 H new ATOM 0 HB3 SER A 168 15.713 -17.284 -7.551 1.00 4.42 H new ATOM 0 HG SER A 168 16.355 -15.545 -8.967 1.00 23.32 H new ATOM 2628 N ASN A 169 14.030 -16.726 -4.076 1.00 63.00 N ATOM 2629 CA ASN A 169 13.775 -17.645 -2.974 1.00 30.21 C ATOM 2630 C ASN A 169 12.572 -17.191 -2.150 1.00 21.13 C ATOM 2631 O ASN A 169 12.109 -17.967 -1.321 1.00 54.21 O ATOM 2632 CB ASN A 169 15.010 -17.819 -2.066 1.00 31.41 C ATOM 2633 CG ASN A 169 16.335 -17.418 -2.699 1.00 13.44 C ATOM 2634 OD1 ASN A 169 16.611 -16.130 -2.644 1.00 62.12 O flip ATOM 2635 ND2 ASN A 169 17.072 -18.210 -3.278 1.00 22.05 N flip ATOM 0 H ASN A 169 14.079 -15.751 -3.781 1.00 63.00 H new ATOM 0 HA ASN A 169 13.551 -18.616 -3.417 1.00 30.21 H new ATOM 0 HB2 ASN A 169 14.863 -17.229 -1.161 1.00 31.41 H new ATOM 0 HB3 ASN A 169 15.072 -18.863 -1.759 1.00 31.41 H new ATOM 0 HD21 ASN A 169 16.834 -19.202 -3.305 1.00 22.05 H new ATOM 0 HD22 ASN A 169 17.922 -17.877 -3.732 1.00 22.05 H new ATOM 2642 N MET A 170 12.049 -15.976 -2.377 1.00 54.22 N ATOM 2643 CA MET A 170 10.868 -15.384 -1.741 1.00 54.10 C ATOM 2644 C MET A 170 11.117 -15.027 -0.277 1.00 74.40 C ATOM 2645 O MET A 170 11.085 -13.850 0.060 1.00 30.21 O ATOM 2646 CB MET A 170 9.607 -16.246 -1.940 1.00 63.02 C ATOM 2647 CG MET A 170 9.338 -16.642 -3.400 1.00 51.50 C ATOM 2648 SD MET A 170 8.549 -15.395 -4.470 1.00 5.44 S ATOM 2649 CE MET A 170 9.895 -14.229 -4.788 1.00 73.30 C ATOM 0 H MET A 170 12.470 -15.341 -3.055 1.00 54.22 H new ATOM 0 HA MET A 170 10.674 -14.441 -2.252 1.00 54.10 H new ATOM 0 HB2 MET A 170 9.702 -17.152 -1.341 1.00 63.02 H new ATOM 0 HB3 MET A 170 8.744 -15.701 -1.558 1.00 63.02 H new ATOM 0 HG2 MET A 170 10.288 -16.924 -3.854 1.00 51.50 H new ATOM 0 HG3 MET A 170 8.709 -17.532 -3.398 1.00 51.50 H new ATOM 0 HE1 MET A 170 9.890 -13.946 -5.841 1.00 73.30 H new ATOM 0 HE2 MET A 170 9.759 -13.340 -4.173 1.00 73.30 H new ATOM 0 HE3 MET A 170 10.848 -14.698 -4.543 1.00 73.30 H new ATOM 2659 N ASP A 171 11.476 -15.989 0.567 1.00 65.01 N ATOM 2660 CA ASP A 171 11.719 -15.752 1.992 1.00 12.12 C ATOM 2661 C ASP A 171 12.826 -14.709 2.160 1.00 63.10 C ATOM 2662 O ASP A 171 12.676 -13.676 2.811 1.00 2.45 O ATOM 2663 CB ASP A 171 12.113 -17.075 2.654 1.00 12.25 C ATOM 2664 CG ASP A 171 11.853 -17.040 4.153 1.00 72.10 C ATOM 2665 OD1 ASP A 171 10.712 -17.375 4.554 1.00 1.32 O ATOM 2666 OD2 ASP A 171 12.799 -16.736 4.911 1.00 62.20 O ATOM 0 H ASP A 171 11.608 -16.960 0.284 1.00 65.01 H new ATOM 0 HA ASP A 171 10.816 -15.371 2.469 1.00 12.12 H new ATOM 0 HB2 ASP A 171 11.549 -17.892 2.204 1.00 12.25 H new ATOM 0 HB3 ASP A 171 13.168 -17.276 2.470 1.00 12.25 H new ATOM 2671 N VAL A 172 13.917 -14.954 1.434 1.00 11.31 N ATOM 2672 CA VAL A 172 15.116 -14.135 1.394 1.00 12.22 C ATOM 2673 C VAL A 172 14.825 -12.747 0.828 1.00 51.23 C ATOM 2674 O VAL A 172 15.560 -11.799 1.119 1.00 41.44 O ATOM 2675 CB VAL A 172 16.144 -14.847 0.496 1.00 2.55 C ATOM 2676 CG1 VAL A 172 17.431 -14.040 0.275 1.00 23.41 C ATOM 2677 CG2 VAL A 172 16.488 -16.239 1.046 1.00 52.42 C ATOM 0 H VAL A 172 13.986 -15.772 0.829 1.00 11.31 H new ATOM 0 HA VAL A 172 15.497 -14.007 2.407 1.00 12.22 H new ATOM 0 HB VAL A 172 15.663 -14.947 -0.477 1.00 2.55 H new ATOM 0 HG11 VAL A 172 18.108 -14.604 -0.367 1.00 23.41 H new ATOM 0 HG12 VAL A 172 17.188 -13.090 -0.200 1.00 23.41 H new ATOM 0 HG13 VAL A 172 17.912 -13.853 1.235 1.00 23.41 H new ATOM 0 HG21 VAL A 172 17.216 -16.719 0.392 1.00 52.42 H new ATOM 0 HG22 VAL A 172 16.908 -16.141 2.047 1.00 52.42 H new ATOM 0 HG23 VAL A 172 15.584 -16.846 1.090 1.00 52.42 H new ATOM 2687 N PHE A 173 13.805 -12.631 -0.034 1.00 22.42 N ATOM 2688 CA PHE A 173 13.448 -11.351 -0.597 1.00 11.33 C ATOM 2689 C PHE A 173 12.982 -10.451 0.547 1.00 42.34 C ATOM 2690 O PHE A 173 13.588 -9.408 0.784 1.00 14.34 O ATOM 2691 CB PHE A 173 12.388 -11.488 -1.702 1.00 71.11 C ATOM 2692 CG PHE A 173 11.748 -10.173 -2.040 1.00 41.14 C ATOM 2693 CD1 PHE A 173 12.498 -9.145 -2.637 1.00 62.44 C ATOM 2694 CD2 PHE A 173 10.427 -9.948 -1.620 1.00 5.11 C ATOM 2695 CE1 PHE A 173 11.925 -7.870 -2.754 1.00 41.22 C ATOM 2696 CE2 PHE A 173 9.862 -8.674 -1.731 1.00 32.23 C ATOM 2697 CZ PHE A 173 10.623 -7.634 -2.277 1.00 61.04 C ATOM 0 H PHE A 173 13.225 -13.410 -0.346 1.00 22.42 H new ATOM 0 HA PHE A 173 14.314 -10.902 -1.084 1.00 11.33 H new ATOM 0 HB2 PHE A 173 12.850 -11.906 -2.596 1.00 71.11 H new ATOM 0 HB3 PHE A 173 11.620 -12.192 -1.381 1.00 71.11 H new ATOM 0 HD1 PHE A 173 13.498 -9.333 -2.999 1.00 62.44 H new ATOM 0 HD2 PHE A 173 9.846 -10.761 -1.210 1.00 5.11 H new ATOM 0 HE1 PHE A 173 12.485 -7.068 -3.211 1.00 41.22 H new ATOM 0 HE2 PHE A 173 8.850 -8.494 -1.399 1.00 32.23 H new ATOM 0 HZ PHE A 173 10.206 -6.639 -2.333 1.00 61.04 H new ATOM 2707 N VAL A 174 11.938 -10.860 1.270 1.00 21.33 N ATOM 2708 CA VAL A 174 11.315 -10.008 2.275 1.00 74.04 C ATOM 2709 C VAL A 174 12.246 -9.805 3.472 1.00 22.11 C ATOM 2710 O VAL A 174 12.252 -8.727 4.076 1.00 30.22 O ATOM 2711 CB VAL A 174 9.959 -10.584 2.714 1.00 33.21 C ATOM 2712 CG1 VAL A 174 9.174 -9.519 3.488 1.00 22.14 C ATOM 2713 CG2 VAL A 174 9.096 -11.014 1.526 1.00 51.41 C ATOM 0 H VAL A 174 11.508 -11.780 1.175 1.00 21.33 H new ATOM 0 HA VAL A 174 11.133 -9.031 1.828 1.00 74.04 H new ATOM 0 HB VAL A 174 10.174 -11.457 3.331 1.00 33.21 H new ATOM 0 HG11 VAL A 174 8.213 -9.929 3.798 1.00 22.14 H new ATOM 0 HG12 VAL A 174 9.741 -9.217 4.369 1.00 22.14 H new ATOM 0 HG13 VAL A 174 9.009 -8.652 2.848 1.00 22.14 H new ATOM 0 HG21 VAL A 174 8.149 -11.414 1.890 1.00 51.41 H new ATOM 0 HG22 VAL A 174 8.904 -10.153 0.885 1.00 51.41 H new ATOM 0 HG23 VAL A 174 9.619 -11.782 0.956 1.00 51.41 H new ATOM 2723 N ALA A 175 13.056 -10.814 3.806 1.00 73.24 N ATOM 2724 CA ALA A 175 14.040 -10.721 4.873 1.00 53.22 C ATOM 2725 C ALA A 175 15.035 -9.588 4.612 1.00 13.55 C ATOM 2726 O ALA A 175 15.432 -8.892 5.551 1.00 61.34 O ATOM 2727 CB ALA A 175 14.756 -12.058 5.026 1.00 23.43 C ATOM 0 H ALA A 175 13.042 -11.720 3.338 1.00 73.24 H new ATOM 0 HA ALA A 175 13.526 -10.488 5.805 1.00 53.22 H new ATOM 0 HB1 ALA A 175 15.493 -11.987 5.826 1.00 23.43 H new ATOM 0 HB2 ALA A 175 14.030 -12.834 5.270 1.00 23.43 H new ATOM 0 HB3 ALA A 175 15.258 -12.311 4.092 1.00 23.43 H new ATOM 2733 N GLN A 176 15.436 -9.384 3.355 1.00 31.01 N ATOM 2734 CA GLN A 176 16.259 -8.244 2.978 1.00 4.45 C ATOM 2735 C GLN A 176 15.427 -6.978 2.754 1.00 50.23 C ATOM 2736 O GLN A 176 15.898 -5.899 3.097 1.00 63.34 O ATOM 2737 CB GLN A 176 17.068 -8.603 1.735 1.00 10.21 C ATOM 2738 CG GLN A 176 18.174 -9.604 2.090 1.00 42.44 C ATOM 2739 CD GLN A 176 18.875 -10.120 0.847 1.00 30.01 C ATOM 2740 OE1 GLN A 176 20.052 -9.851 0.607 1.00 31.35 O ATOM 2741 NE2 GLN A 176 18.178 -10.901 0.050 1.00 42.52 N ATOM 0 H GLN A 176 15.199 -10.002 2.579 1.00 31.01 H new ATOM 0 HA GLN A 176 16.937 -8.019 3.801 1.00 4.45 H new ATOM 0 HB2 GLN A 176 16.412 -9.030 0.977 1.00 10.21 H new ATOM 0 HB3 GLN A 176 17.507 -7.702 1.306 1.00 10.21 H new ATOM 0 HG2 GLN A 176 18.901 -9.127 2.748 1.00 42.44 H new ATOM 0 HG3 GLN A 176 17.746 -10.441 2.642 1.00 42.44 H new ATOM 0 HE21 GLN A 176 17.204 -11.112 0.267 1.00 42.52 H new ATOM 0 HE22 GLN A 176 18.612 -11.296 -0.784 1.00 42.52 H new ATOM 2750 N TYR A 177 14.198 -7.064 2.237 1.00 53.10 N ATOM 2751 CA TYR A 177 13.351 -5.896 1.990 1.00 32.43 C ATOM 2752 C TYR A 177 13.168 -5.088 3.273 1.00 11.41 C ATOM 2753 O TYR A 177 13.522 -3.911 3.313 1.00 41.41 O ATOM 2754 CB TYR A 177 11.992 -6.315 1.407 1.00 72.04 C ATOM 2755 CG TYR A 177 11.115 -5.153 0.963 1.00 5.35 C ATOM 2756 CD1 TYR A 177 10.359 -4.428 1.907 1.00 11.44 C ATOM 2757 CD2 TYR A 177 11.043 -4.803 -0.399 1.00 42.10 C ATOM 2758 CE1 TYR A 177 9.524 -3.377 1.489 1.00 22.14 C ATOM 2759 CE2 TYR A 177 10.200 -3.758 -0.827 1.00 70.10 C ATOM 2760 CZ TYR A 177 9.425 -3.053 0.122 1.00 45.44 C ATOM 2761 OH TYR A 177 8.589 -2.057 -0.264 1.00 42.24 O ATOM 0 H TYR A 177 13.762 -7.949 1.978 1.00 53.10 H new ATOM 0 HA TYR A 177 13.848 -5.263 1.255 1.00 32.43 H new ATOM 0 HB2 TYR A 177 12.163 -6.972 0.554 1.00 72.04 H new ATOM 0 HB3 TYR A 177 11.453 -6.897 2.155 1.00 72.04 H new ATOM 0 HD1 TYR A 177 10.422 -4.681 2.955 1.00 11.44 H new ATOM 0 HD2 TYR A 177 11.639 -5.340 -1.122 1.00 42.10 H new ATOM 0 HE1 TYR A 177 8.957 -2.817 2.218 1.00 22.14 H new ATOM 0 HE2 TYR A 177 10.146 -3.497 -1.874 1.00 70.10 H new ATOM 0 HH TYR A 177 8.633 -1.952 -1.237 1.00 42.24 H new ATOM 2771 N ALA A 178 12.645 -5.719 4.331 1.00 43.43 N ATOM 2772 CA ALA A 178 12.346 -5.054 5.598 1.00 44.44 C ATOM 2773 C ALA A 178 13.595 -4.410 6.218 1.00 21.12 C ATOM 2774 O ALA A 178 13.514 -3.389 6.902 1.00 5.51 O ATOM 2775 CB ALA A 178 11.740 -6.085 6.555 1.00 13.23 C ATOM 0 H ALA A 178 12.417 -6.713 4.329 1.00 43.43 H new ATOM 0 HA ALA A 178 11.637 -4.247 5.414 1.00 44.44 H new ATOM 0 HB1 ALA A 178 11.510 -5.607 7.507 1.00 13.23 H new ATOM 0 HB2 ALA A 178 10.825 -6.490 6.122 1.00 13.23 H new ATOM 0 HB3 ALA A 178 12.453 -6.893 6.718 1.00 13.23 H new ATOM 2781 N ASP A 179 14.757 -5.005 5.961 1.00 4.34 N ATOM 2782 CA ASP A 179 16.057 -4.549 6.422 1.00 22.14 C ATOM 2783 C ASP A 179 16.471 -3.294 5.656 1.00 71.32 C ATOM 2784 O ASP A 179 16.771 -2.271 6.267 1.00 11.14 O ATOM 2785 CB ASP A 179 17.049 -5.684 6.192 1.00 11.54 C ATOM 2786 CG ASP A 179 18.422 -5.390 6.777 1.00 23.25 C ATOM 2787 OD1 ASP A 179 18.592 -5.626 7.996 1.00 31.25 O ATOM 2788 OD2 ASP A 179 19.322 -5.012 5.995 1.00 63.01 O ATOM 0 H ASP A 179 14.816 -5.855 5.401 1.00 4.34 H new ATOM 0 HA ASP A 179 16.028 -4.291 7.481 1.00 22.14 H new ATOM 0 HB2 ASP A 179 16.657 -6.599 6.636 1.00 11.54 H new ATOM 0 HB3 ASP A 179 17.146 -5.865 5.122 1.00 11.54 H new ATOM 2793 N THR A 180 16.407 -3.339 4.322 1.00 74.22 N ATOM 2794 CA THR A 180 16.657 -2.214 3.432 1.00 12.22 C ATOM 2795 C THR A 180 15.754 -1.029 3.789 1.00 65.30 C ATOM 2796 O THR A 180 16.232 0.106 3.777 1.00 72.22 O ATOM 2797 CB THR A 180 16.462 -2.680 1.974 1.00 25.44 C ATOM 2798 OG1 THR A 180 17.359 -3.726 1.640 1.00 10.24 O ATOM 2799 CG2 THR A 180 16.489 -1.547 0.940 1.00 13.43 C ATOM 0 H THR A 180 16.170 -4.194 3.819 1.00 74.22 H new ATOM 0 HA THR A 180 17.683 -1.866 3.548 1.00 12.22 H new ATOM 0 HB THR A 180 15.447 -3.076 1.928 1.00 25.44 H new ATOM 0 HG1 THR A 180 17.065 -4.558 2.067 1.00 10.24 H new ATOM 0 HG21 THR A 180 16.345 -1.961 -0.058 1.00 13.43 H new ATOM 0 HG22 THR A 180 15.691 -0.837 1.157 1.00 13.43 H new ATOM 0 HG23 THR A 180 17.451 -1.036 0.985 1.00 13.43 H new ATOM 2807 N VAL A 181 14.488 -1.279 4.147 1.00 61.20 N ATOM 2808 CA VAL A 181 13.583 -0.199 4.556 1.00 23.14 C ATOM 2809 C VAL A 181 14.195 0.499 5.773 1.00 64.21 C ATOM 2810 O VAL A 181 14.477 1.696 5.719 1.00 4.32 O ATOM 2811 CB VAL A 181 12.143 -0.692 4.831 1.00 1.24 C ATOM 2812 CG1 VAL A 181 11.267 0.455 5.364 1.00 2.14 C ATOM 2813 CG2 VAL A 181 11.445 -1.237 3.576 1.00 64.30 C ATOM 0 H VAL A 181 14.071 -2.210 4.162 1.00 61.20 H new ATOM 0 HA VAL A 181 13.482 0.510 3.734 1.00 23.14 H new ATOM 0 HB VAL A 181 12.248 -1.493 5.563 1.00 1.24 H new ATOM 0 HG11 VAL A 181 10.258 0.086 5.551 1.00 2.14 H new ATOM 0 HG12 VAL A 181 11.692 0.836 6.293 1.00 2.14 H new ATOM 0 HG13 VAL A 181 11.229 1.257 4.627 1.00 2.14 H new ATOM 0 HG21 VAL A 181 10.439 -1.567 3.834 1.00 64.30 H new ATOM 0 HG22 VAL A 181 11.387 -0.452 2.822 1.00 64.30 H new ATOM 0 HG23 VAL A 181 12.013 -2.079 3.181 1.00 64.30 H new ATOM 2823 N LYS A 182 14.440 -0.248 6.857 1.00 14.44 N ATOM 2824 CA LYS A 182 14.968 0.333 8.087 1.00 72.44 C ATOM 2825 C LYS A 182 16.327 0.997 7.850 1.00 2.12 C ATOM 2826 O LYS A 182 16.585 2.027 8.463 1.00 25.24 O ATOM 2827 CB LYS A 182 15.010 -0.739 9.190 1.00 62.32 C ATOM 2828 CG LYS A 182 15.416 -0.174 10.566 1.00 43.53 C ATOM 2829 CD LYS A 182 16.907 -0.327 10.898 1.00 25.43 C ATOM 2830 CE LYS A 182 17.244 -1.787 11.224 1.00 50.21 C ATOM 2831 NZ LYS A 182 18.660 -1.941 11.596 1.00 32.41 N ATOM 0 H LYS A 182 14.280 -1.254 6.902 1.00 14.44 H new ATOM 0 HA LYS A 182 14.303 1.128 8.425 1.00 72.44 H new ATOM 0 HB2 LYS A 182 14.029 -1.207 9.271 1.00 62.32 H new ATOM 0 HB3 LYS A 182 15.713 -1.520 8.903 1.00 62.32 H new ATOM 0 HG2 LYS A 182 15.154 0.884 10.603 1.00 43.53 H new ATOM 0 HG3 LYS A 182 14.831 -0.674 11.338 1.00 43.53 H new ATOM 0 HD2 LYS A 182 17.509 0.010 10.054 1.00 25.43 H new ATOM 0 HD3 LYS A 182 17.163 0.308 11.746 1.00 25.43 H new ATOM 0 HE2 LYS A 182 16.612 -2.134 12.041 1.00 50.21 H new ATOM 0 HE3 LYS A 182 17.023 -2.415 10.361 1.00 50.21 H new ATOM 0 HZ1 LYS A 182 18.856 -2.940 11.811 1.00 32.41 H new ATOM 0 HZ2 LYS A 182 19.262 -1.632 10.806 1.00 32.41 H new ATOM 0 HZ3 LYS A 182 18.864 -1.360 12.434 1.00 32.41 H new ATOM 2845 N GLN A 183 17.178 0.460 6.970 1.00 70.22 N ATOM 2846 CA GLN A 183 18.492 1.023 6.692 1.00 14.30 C ATOM 2847 C GLN A 183 18.370 2.440 6.168 1.00 5.53 C ATOM 2848 O GLN A 183 19.108 3.325 6.583 1.00 23.34 O ATOM 2849 CB GLN A 183 19.250 0.166 5.682 1.00 14.42 C ATOM 2850 CG GLN A 183 19.974 -0.997 6.360 1.00 10.22 C ATOM 2851 CD GLN A 183 21.190 -1.333 5.526 1.00 44.10 C ATOM 2852 OE1 GLN A 183 22.293 -0.840 5.750 1.00 65.33 O ATOM 2853 NE2 GLN A 183 21.018 -2.107 4.476 1.00 54.43 N ATOM 0 H GLN A 183 16.969 -0.381 6.431 1.00 70.22 H new ATOM 0 HA GLN A 183 19.049 1.038 7.629 1.00 14.30 H new ATOM 0 HB2 GLN A 183 18.554 -0.222 4.939 1.00 14.42 H new ATOM 0 HB3 GLN A 183 19.973 0.784 5.150 1.00 14.42 H new ATOM 0 HG2 GLN A 183 20.269 -0.725 7.373 1.00 10.22 H new ATOM 0 HG3 GLN A 183 19.316 -1.862 6.441 1.00 10.22 H new ATOM 0 HE21 GLN A 183 20.103 -2.517 4.289 1.00 54.43 H new ATOM 0 HE22 GLN A 183 21.800 -2.297 3.849 1.00 54.43 H new ATOM 2862 N LEU A 184 17.449 2.693 5.252 1.00 24.11 N ATOM 2863 CA LEU A 184 17.370 4.021 4.678 1.00 22.24 C ATOM 2864 C LEU A 184 16.907 5.057 5.703 1.00 1.32 C ATOM 2865 O LEU A 184 17.252 6.232 5.581 1.00 4.10 O ATOM 2866 CB LEU A 184 16.410 3.982 3.503 1.00 65.11 C ATOM 2867 CG LEU A 184 16.967 3.259 2.268 1.00 34.00 C ATOM 2868 CD1 LEU A 184 15.844 3.091 1.243 1.00 50.34 C ATOM 2869 CD2 LEU A 184 18.135 4.020 1.635 1.00 13.14 C ATOM 0 H LEU A 184 16.768 2.020 4.901 1.00 24.11 H new ATOM 0 HA LEU A 184 18.365 4.320 4.348 1.00 22.24 H new ATOM 0 HB2 LEU A 184 15.489 3.490 3.815 1.00 65.11 H new ATOM 0 HB3 LEU A 184 16.148 5.003 3.227 1.00 65.11 H new ATOM 0 HG LEU A 184 17.345 2.287 2.584 1.00 34.00 H new ATOM 0 HD11 LEU A 184 16.229 2.578 0.362 1.00 50.34 H new ATOM 0 HD12 LEU A 184 15.037 2.503 1.681 1.00 50.34 H new ATOM 0 HD13 LEU A 184 15.464 4.071 0.955 1.00 50.34 H new ATOM 0 HD21 LEU A 184 18.497 3.472 0.765 1.00 13.14 H new ATOM 0 HD22 LEU A 184 17.800 5.010 1.326 1.00 13.14 H new ATOM 0 HD23 LEU A 184 18.941 4.120 2.362 1.00 13.14 H new ATOM 2881 N VAL A 185 16.168 4.657 6.738 1.00 10.52 N ATOM 2882 CA VAL A 185 15.733 5.568 7.794 1.00 24.11 C ATOM 2883 C VAL A 185 16.931 6.088 8.608 1.00 64.13 C ATOM 2884 O VAL A 185 16.850 7.167 9.201 1.00 2.33 O ATOM 2885 CB VAL A 185 14.682 4.858 8.672 1.00 1.14 C ATOM 2886 CG1 VAL A 185 14.226 5.756 9.827 1.00 34.20 C ATOM 2887 CG2 VAL A 185 13.462 4.438 7.840 1.00 53.14 C ATOM 0 H VAL A 185 15.855 3.695 6.867 1.00 10.52 H new ATOM 0 HA VAL A 185 15.267 6.448 7.351 1.00 24.11 H new ATOM 0 HB VAL A 185 15.156 3.967 9.084 1.00 1.14 H new ATOM 0 HG11 VAL A 185 13.485 5.228 10.428 1.00 34.20 H new ATOM 0 HG12 VAL A 185 15.083 6.011 10.450 1.00 34.20 H new ATOM 0 HG13 VAL A 185 13.784 6.668 9.426 1.00 34.20 H new ATOM 0 HG21 VAL A 185 12.737 3.940 8.483 1.00 53.14 H new ATOM 0 HG22 VAL A 185 13.005 5.321 7.393 1.00 53.14 H new ATOM 0 HG23 VAL A 185 13.777 3.755 7.052 1.00 53.14 H new ATOM 2897 N GLU A 186 18.055 5.374 8.597 1.00 5.34 N ATOM 2898 CA GLU A 186 19.285 5.782 9.290 1.00 11.11 C ATOM 2899 C GLU A 186 20.304 6.346 8.286 1.00 63.02 C ATOM 2900 O GLU A 186 21.325 6.917 8.678 1.00 72.02 O ATOM 2901 CB GLU A 186 19.847 4.644 10.179 1.00 24.14 C ATOM 2902 CG GLU A 186 19.957 3.307 9.451 1.00 53.22 C ATOM 2903 CD GLU A 186 20.814 2.232 10.115 1.00 14.10 C ATOM 2904 OE1 GLU A 186 20.426 1.615 11.133 1.00 72.21 O ATOM 2905 OE2 GLU A 186 21.858 1.887 9.516 1.00 25.03 O ATOM 0 H GLU A 186 18.143 4.486 8.103 1.00 5.34 H new ATOM 0 HA GLU A 186 19.049 6.591 9.981 1.00 11.11 H new ATOM 0 HB2 GLU A 186 20.832 4.932 10.546 1.00 24.14 H new ATOM 0 HB3 GLU A 186 19.205 4.523 11.051 1.00 24.14 H new ATOM 0 HG2 GLU A 186 18.951 2.907 9.320 1.00 53.22 H new ATOM 0 HG3 GLU A 186 20.358 3.494 8.455 1.00 53.22 H new ATOM 2912 N LYS A 187 20.024 6.253 6.982 1.00 42.41 N ATOM 2913 CA LYS A 187 20.933 6.596 5.891 1.00 53.52 C ATOM 2914 C LYS A 187 20.247 7.597 4.959 1.00 21.42 C ATOM 2915 O LYS A 187 19.773 7.243 3.875 1.00 70.41 O ATOM 2916 CB LYS A 187 21.389 5.324 5.171 1.00 65.43 C ATOM 2917 CG LYS A 187 22.271 4.435 6.060 1.00 61.42 C ATOM 2918 CD LYS A 187 22.352 3.033 5.464 1.00 62.34 C ATOM 2919 CE LYS A 187 23.573 2.258 5.973 1.00 74.03 C ATOM 2920 NZ LYS A 187 23.431 1.729 7.346 1.00 44.51 N ATOM 0 H LYS A 187 19.119 5.922 6.647 1.00 42.41 H new ATOM 0 HA LYS A 187 21.832 7.075 6.278 1.00 53.52 H new ATOM 0 HB2 LYS A 187 20.515 4.758 4.849 1.00 65.43 H new ATOM 0 HB3 LYS A 187 21.941 5.596 4.272 1.00 65.43 H new ATOM 0 HG2 LYS A 187 23.270 4.864 6.143 1.00 61.42 H new ATOM 0 HG3 LYS A 187 21.859 4.389 7.068 1.00 61.42 H new ATOM 0 HD2 LYS A 187 21.445 2.482 5.711 1.00 62.34 H new ATOM 0 HD3 LYS A 187 22.396 3.104 4.377 1.00 62.34 H new ATOM 0 HE2 LYS A 187 23.769 1.427 5.295 1.00 74.03 H new ATOM 0 HE3 LYS A 187 24.444 2.912 5.937 1.00 74.03 H new ATOM 0 HZ1 LYS A 187 24.280 1.964 7.898 1.00 44.51 H new ATOM 0 HZ2 LYS A 187 22.596 2.154 7.797 1.00 44.51 H new ATOM 0 HZ3 LYS A 187 23.317 0.696 7.310 1.00 44.51 H new ATOM 2934 N LYS A 188 20.168 8.853 5.403 1.00 61.35 N ATOM 2935 CA LYS A 188 19.793 9.988 4.574 1.00 33.14 C ATOM 2936 C LYS A 188 21.071 10.745 4.301 1.00 5.31 C ATOM 2937 O LYS A 188 21.407 10.935 3.117 1.00 30.21 O ATOM 2938 CB LYS A 188 18.720 10.888 5.221 1.00 54.13 C ATOM 2939 CG LYS A 188 17.500 10.144 5.789 1.00 62.14 C ATOM 2940 CD LYS A 188 17.577 9.741 7.271 1.00 12.41 C ATOM 2941 CE LYS A 188 17.583 10.976 8.181 1.00 25.14 C ATOM 2942 NZ LYS A 188 17.191 10.670 9.574 1.00 3.41 N ATOM 0 H LYS A 188 20.368 9.109 6.370 1.00 61.35 H new ATOM 0 HA LYS A 188 19.327 9.641 3.652 1.00 33.14 H new ATOM 0 HB2 LYS A 188 19.184 11.460 6.025 1.00 54.13 H new ATOM 0 HB3 LYS A 188 18.374 11.606 4.478 1.00 54.13 H new ATOM 0 HG2 LYS A 188 16.621 10.773 5.651 1.00 62.14 H new ATOM 0 HG3 LYS A 188 17.343 9.242 5.197 1.00 62.14 H new ATOM 0 HD2 LYS A 188 16.728 9.105 7.522 1.00 12.41 H new ATOM 0 HD3 LYS A 188 18.478 9.153 7.445 1.00 12.41 H new ATOM 0 HE2 LYS A 188 18.580 11.417 8.179 1.00 25.14 H new ATOM 0 HE3 LYS A 188 16.902 11.724 7.774 1.00 25.14 H new ATOM 0 HZ1 LYS A 188 17.214 11.542 10.140 1.00 3.41 H new ATOM 0 HZ2 LYS A 188 16.229 10.275 9.585 1.00 3.41 H new ATOM 0 HZ3 LYS A 188 17.854 9.978 9.977 1.00 3.41 H new TER 2956 LYS A 188