USER MOD reduce.3.24.130724 H: found=0, std=0, add=1472, rem=0, adj=37 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 145 GLN : amide:sc= -1.99 K(o=-0.91,f=-3.9!) USER MOD Set 1.2: A 153 TYR OH : rot -123:sc= 1.09 USER MOD Set 2.1: A 59 TYR OH : rot 180:sc= 0 USER MOD Set 2.2: A 136 GLN : amide:sc= 0.723 K(o=1.7,f=0.95) USER MOD Set 2.3: A 137 GLN : amide:sc= 0.935 K(o=1.7,f=0.95) USER MOD Set 3.1: A 43 SER OG : rot -170:sc=-0.00113 USER MOD Set 3.2: A 58 LYS NZ :NH3+ 164:sc= 1.28 (180deg=1.05) USER MOD Set 4.1: A 8 GLN : amide:sc= -0.521 X(o=-1.7,f=-2.1) USER MOD Set 4.2: A 176 GLN : amide:sc= -1.2 X(o=-1.7,f=-1.7) USER MOD Set 5.1: A 0 ASN : amide:sc= 0.511 K(o=1.1,f=-2.6!) USER MOD Set 5.2: A -1 SER N :NH3+ -118:sc= 0.543 (180deg=0.0022) USER MOD Single : A 2 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 4 THR OG1 : rot 180:sc= 0 USER MOD Single : A 7 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 9 TYR OH : rot 180:sc= -0.0419 USER MOD Single : A -1 SER OG : rot 180:sc= 0.00896 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) USER MOD Single : A 27 SER OG : rot -150:sc= 0 USER MOD Single : A 29 TYR OH : rot 30:sc= 0 USER MOD Single : A 32 HIS : no HD1:sc= 0 X(o=0,f=-0.042) USER MOD Single : A 34 TYR OH : rot 109:sc= -0.0163 USER MOD Single : A 35 GLN : amide:sc= -0.314 X(o=-0.31,f=-0.01) USER MOD Single : A 41 HIS : no HD1:sc= -0.92 X(o=-0.92,f=-0.61) USER MOD Single : A 45 ASN : amide:sc= 0.715 K(o=0.71,f=0) USER MOD Single : A 48 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 49 LYS NZ :NH3+ 175:sc= 0 (180deg=-0.022) USER MOD Single : A 54 THR OG1 : rot -140:sc= 0 USER MOD Single : A 55 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 56 MET CE :methyl -135:sc= -0.444 (180deg=-3.84!) USER MOD Single : A 57 THR OG1 : rot 69:sc= 1.25 USER MOD Single : A 60 HIS : no HE2:sc= -2.71 K(o=-2.7,f=-7.7!) USER MOD Single : A 69 LYS NZ :NH3+ 173:sc= 0 (180deg=-0.0392) USER MOD Single : A 72 THR OG1 : rot -140:sc= 0.00137 USER MOD Single : A 73 GLN : amide:sc= 0.662 K(o=0.66,f=-0.62) USER MOD Single : A 86 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 88 THR OG1 : rot 69:sc= 1.23 USER MOD Single : A 91 MET CE :methyl -175:sc= -2.29 (180deg=-2.43) USER MOD Single : A 96 GLN : amide:sc= 1.88 K(o=1.9,f=-2.9!) USER MOD Single : A 97 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 98 THR OG1 : rot 180:sc= -0.276 USER MOD Single : A 99 GLN : amide:sc= 1.03 K(o=1,f=0) USER MOD Single : A 100 THR OG1 : rot 180:sc= 0 USER MOD Single : A 102 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 103 SER OG : rot 180:sc= 0 USER MOD Single : A 109 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 117 LYS NZ :NH3+ 180:sc= 1.24 (180deg=1.24) USER MOD Single : A 121 TYR OH : rot 76:sc= 1.68 USER MOD Single : A 126 ASN : amide:sc= 0.523 K(o=0.52,f=-0.071) 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 139 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 147 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 152 MET CE :methyl -177:sc= -0.0425 (180deg=-0.0614) USER MOD Single : A 155 ASN : amide:sc= 0.658 K(o=0.66,f=0) USER MOD Single : A 157 LYS NZ :NH3+ -126:sc= 1.28 (180deg=-0.552) USER MOD Single : A 158 TYR OH : rot 30:sc= -0.152 USER MOD Single : A 159 GLN : amide:sc= 0 X(o=0,f=-0.4) USER MOD Single : A 161 ASN : amide:sc= -1.41 K(o=-1.4,f=-6.1!) USER MOD Single : A 163 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 165 MET CE :methyl -170:sc= -0.506 (180deg=-0.58) USER MOD Single : A 167 THR OG1 : rot 180:sc= 0.0582 USER MOD Single : A 168 SER OG : rot 180:sc= 0 USER MOD Single : A 169 ASN : amide:sc= 1.01 K(o=1,f=-0.0057) USER MOD Single : A 170 MET CE :methyl -114:sc= -0.219 (180deg=-2.17!) USER MOD Single : A 177 TYR OH : rot -39:sc= 0.236 USER MOD Single : A 180 THR OG1 : rot 180:sc= -0.639 USER MOD Single : A 182 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 183 GLN : amide:sc= -0.0741 X(o=-0.074,f=0) USER MOD Single : A 187 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 188 LYS NZ :NH3+ 156:sc=-0.00574 (180deg=-0.668) USER MOD ----------------------------------------------------------------- ATOM 1 N SER A -1 22.639 -10.920 7.013 1.00 33.40 N ATOM 2 CA SER A -1 23.058 -9.642 7.598 1.00 61.24 C ATOM 3 C SER A -1 22.185 -8.518 7.041 1.00 34.40 C ATOM 4 O SER A -1 21.433 -7.895 7.791 1.00 33.33 O ATOM 5 CB SER A -1 24.554 -9.403 7.364 1.00 51.23 C ATOM 6 OG SER A -1 25.305 -10.601 7.422 1.00 33.50 O ATOM 0 H1 SER A -1 22.304 -11.554 7.767 1.00 33.40 H new ATOM 0 H2 SER A -1 21.870 -10.755 6.332 1.00 33.40 H new ATOM 0 H3 SER A -1 23.445 -11.359 6.524 1.00 33.40 H new ATOM 0 HA SER A -1 22.918 -9.666 8.679 1.00 61.24 H new ATOM 0 HB2 SER A -1 24.697 -8.934 6.390 1.00 51.23 H new ATOM 0 HB3 SER A -1 24.929 -8.705 8.112 1.00 51.23 H new ATOM 0 HG SER A -1 26.252 -10.402 7.266 1.00 33.50 H new ATOM 12 N ASN A 0 22.210 -8.326 5.714 1.00 11.42 N ATOM 13 CA ASN A 0 21.284 -7.551 4.877 1.00 53.05 C ATOM 14 C ASN A 0 21.481 -6.043 4.980 1.00 3.04 C ATOM 15 O ASN A 0 20.980 -5.303 4.137 1.00 24.31 O ATOM 16 CB ASN A 0 19.798 -7.915 5.139 1.00 24.12 C ATOM 17 CG ASN A 0 19.459 -9.408 5.198 1.00 53.32 C ATOM 18 OD1 ASN A 0 20.322 -10.275 5.128 1.00 22.22 O ATOM 19 ND2 ASN A 0 18.197 -9.759 5.370 1.00 12.15 N ATOM 0 H ASN A 0 22.946 -8.748 5.148 1.00 11.42 H new ATOM 0 HA ASN A 0 21.535 -7.839 3.856 1.00 53.05 H new ATOM 0 HB2 ASN A 0 19.497 -7.459 6.082 1.00 24.12 H new ATOM 0 HB3 ASN A 0 19.192 -7.458 4.356 1.00 24.12 H new ATOM 0 HD21 ASN A 0 17.947 -10.745 5.443 1.00 12.15 H new ATOM 0 HD22 ASN A 0 17.472 -9.044 5.429 1.00 12.15 H new ATOM 26 N ALA A 1 22.285 -5.583 5.930 1.00 64.41 N ATOM 27 CA ALA A 1 22.649 -4.202 6.166 1.00 4.20 C ATOM 28 C ALA A 1 23.681 -3.696 5.157 1.00 20.42 C ATOM 29 O ALA A 1 24.700 -3.114 5.545 1.00 22.12 O ATOM 30 CB ALA A 1 23.118 -4.064 7.616 1.00 34.23 C ATOM 0 H ALA A 1 22.728 -6.213 6.599 1.00 64.41 H new ATOM 0 HA ALA A 1 21.777 -3.565 6.017 1.00 4.20 H new ATOM 0 HB1 ALA A 1 23.397 -3.028 7.811 1.00 34.23 H new ATOM 0 HB2 ALA A 1 22.311 -4.356 8.289 1.00 34.23 H new ATOM 0 HB3 ALA A 1 23.981 -4.709 7.782 1.00 34.23 H new ATOM 36 N GLN A 2 23.463 -3.915 3.860 1.00 4.23 N ATOM 37 CA GLN A 2 24.173 -3.208 2.814 1.00 62.21 C ATOM 38 C GLN A 2 23.316 -3.243 1.563 1.00 23.20 C ATOM 39 O GLN A 2 22.999 -4.306 1.035 1.00 14.33 O ATOM 40 CB GLN A 2 25.567 -3.798 2.565 1.00 15.11 C ATOM 41 CG GLN A 2 26.543 -2.671 2.178 1.00 12.10 C ATOM 42 CD GLN A 2 27.593 -3.143 1.181 1.00 11.43 C ATOM 43 OE1 GLN A 2 28.393 -4.035 1.468 1.00 1.00 O ATOM 44 NE2 GLN A 2 27.590 -2.587 -0.019 1.00 4.02 N ATOM 0 H GLN A 2 22.784 -4.592 3.512 1.00 4.23 H new ATOM 0 HA GLN A 2 24.342 -2.175 3.119 1.00 62.21 H new ATOM 0 HB2 GLN A 2 25.922 -4.309 3.460 1.00 15.11 H new ATOM 0 HB3 GLN A 2 25.521 -4.542 1.770 1.00 15.11 H new ATOM 0 HG2 GLN A 2 25.984 -1.839 1.749 1.00 12.10 H new ATOM 0 HG3 GLN A 2 27.037 -2.295 3.074 1.00 12.10 H new ATOM 0 HE21 GLN A 2 26.920 -1.850 -0.238 1.00 4.02 H new ATOM 0 HE22 GLN A 2 28.258 -2.895 -0.726 1.00 4.02 H new ATOM 53 N ILE A 3 22.927 -2.067 1.111 1.00 25.13 N ATOM 54 CA ILE A 3 22.095 -1.830 -0.045 1.00 1.43 C ATOM 55 C ILE A 3 22.912 -1.072 -1.085 1.00 43.04 C ATOM 56 O ILE A 3 23.961 -0.509 -0.767 1.00 43.32 O ATOM 57 CB ILE A 3 20.831 -1.081 0.420 1.00 12.45 C ATOM 58 CG1 ILE A 3 21.129 0.136 1.323 1.00 71.55 C ATOM 59 CG2 ILE A 3 19.931 -2.083 1.142 1.00 20.21 C ATOM 60 CD1 ILE A 3 19.943 1.093 1.503 1.00 14.13 C ATOM 0 H ILE A 3 23.202 -1.200 1.572 1.00 25.13 H new ATOM 0 HA ILE A 3 21.765 -2.754 -0.519 1.00 1.43 H new ATOM 0 HB ILE A 3 20.337 -0.669 -0.460 1.00 12.45 H new ATOM 0 HG12 ILE A 3 21.444 -0.222 2.303 1.00 71.55 H new ATOM 0 HG13 ILE A 3 21.967 0.690 0.901 1.00 71.55 H new ATOM 0 HG21 ILE A 3 19.026 -1.580 1.483 1.00 20.21 H new ATOM 0 HG22 ILE A 3 19.662 -2.889 0.459 1.00 20.21 H new ATOM 0 HG23 ILE A 3 20.462 -2.496 2.000 1.00 20.21 H new ATOM 0 HD11 ILE A 3 20.237 1.919 2.150 1.00 14.13 H new ATOM 0 HD12 ILE A 3 19.640 1.483 0.532 1.00 14.13 H new ATOM 0 HD13 ILE A 3 19.108 0.557 1.955 1.00 14.13 H new ATOM 72 N THR A 4 22.406 -1.055 -2.312 1.00 2.32 N ATOM 73 CA THR A 4 22.993 -0.351 -3.429 1.00 14.04 C ATOM 74 C THR A 4 21.833 0.315 -4.166 1.00 2.41 C ATOM 75 O THR A 4 20.748 -0.264 -4.310 1.00 42.24 O ATOM 76 CB THR A 4 23.781 -1.343 -4.303 1.00 63.33 C ATOM 77 OG1 THR A 4 24.719 -2.072 -3.526 1.00 54.43 O ATOM 78 CG2 THR A 4 24.554 -0.639 -5.418 1.00 3.05 C ATOM 0 H THR A 4 21.548 -1.549 -2.558 1.00 2.32 H new ATOM 0 HA THR A 4 23.710 0.412 -3.125 1.00 14.04 H new ATOM 0 HB THR A 4 23.040 -2.013 -4.740 1.00 63.33 H new ATOM 0 HG1 THR A 4 25.206 -2.697 -4.103 1.00 54.43 H new ATOM 0 HG21 THR A 4 25.095 -1.378 -6.009 1.00 3.05 H new ATOM 0 HG22 THR A 4 23.857 -0.101 -6.060 1.00 3.05 H new ATOM 0 HG23 THR A 4 25.262 0.065 -4.981 1.00 3.05 H new ATOM 86 N ASP A 5 22.077 1.545 -4.598 1.00 0.13 N ATOM 87 CA ASP A 5 21.260 2.304 -5.527 1.00 4.31 C ATOM 88 C ASP A 5 21.062 1.505 -6.810 1.00 51.21 C ATOM 89 O ASP A 5 21.963 0.819 -7.293 1.00 0.32 O ATOM 90 CB ASP A 5 21.930 3.653 -5.826 1.00 11.04 C ATOM 91 CG ASP A 5 23.389 3.521 -6.272 1.00 23.43 C ATOM 92 OD1 ASP A 5 24.245 3.208 -5.401 1.00 42.22 O ATOM 93 OD2 ASP A 5 23.679 3.768 -7.458 1.00 72.34 O ATOM 0 H ASP A 5 22.898 2.067 -4.290 1.00 0.13 H new ATOM 0 HA ASP A 5 20.283 2.493 -5.082 1.00 4.31 H new ATOM 0 HB2 ASP A 5 21.365 4.167 -6.604 1.00 11.04 H new ATOM 0 HB3 ASP A 5 21.885 4.278 -4.934 1.00 11.04 H new ATOM 98 N GLY A 6 19.840 1.545 -7.327 1.00 14.24 N ATOM 99 CA GLY A 6 19.367 0.733 -8.434 1.00 1.15 C ATOM 100 C GLY A 6 18.969 -0.685 -8.021 1.00 41.34 C ATOM 101 O GLY A 6 18.117 -1.279 -8.683 1.00 12.42 O ATOM 0 H GLY A 6 19.122 2.174 -6.968 1.00 14.24 H new ATOM 0 HA2 GLY A 6 18.509 1.224 -8.894 1.00 1.15 H new ATOM 0 HA3 GLY A 6 20.147 0.677 -9.193 1.00 1.15 H new ATOM 105 N LYS A 7 19.527 -1.229 -6.935 1.00 65.42 N ATOM 106 CA LYS A 7 19.444 -2.657 -6.634 1.00 61.22 C ATOM 107 C LYS A 7 18.225 -2.861 -5.765 1.00 61.44 C ATOM 108 O LYS A 7 17.181 -3.286 -6.245 1.00 24.32 O ATOM 109 CB LYS A 7 20.753 -3.156 -5.980 1.00 3.23 C ATOM 110 CG LYS A 7 20.766 -4.655 -5.627 1.00 0.03 C ATOM 111 CD LYS A 7 20.861 -5.639 -6.803 1.00 4.21 C ATOM 112 CE LYS A 7 20.713 -7.044 -6.202 1.00 54.42 C ATOM 113 NZ LYS A 7 20.601 -8.129 -7.192 1.00 2.50 N ATOM 0 H LYS A 7 20.048 -0.691 -6.242 1.00 65.42 H new ATOM 0 HA LYS A 7 19.333 -3.251 -7.541 1.00 61.22 H new ATOM 0 HB2 LYS A 7 21.583 -2.949 -6.656 1.00 3.23 H new ATOM 0 HB3 LYS A 7 20.931 -2.581 -5.071 1.00 3.23 H new ATOM 0 HG2 LYS A 7 21.607 -4.840 -4.959 1.00 0.03 H new ATOM 0 HG3 LYS A 7 19.859 -4.881 -5.067 1.00 0.03 H new ATOM 0 HD2 LYS A 7 20.078 -5.445 -7.536 1.00 4.21 H new ATOM 0 HD3 LYS A 7 21.815 -5.536 -7.320 1.00 4.21 H new ATOM 0 HE2 LYS A 7 21.572 -7.243 -5.561 1.00 54.42 H new ATOM 0 HE3 LYS A 7 19.829 -7.060 -5.564 1.00 54.42 H new ATOM 0 HZ1 LYS A 7 20.505 -9.040 -6.699 1.00 2.50 H new ATOM 0 HZ2 LYS A 7 19.765 -7.969 -7.790 1.00 2.50 H new ATOM 0 HZ3 LYS A 7 21.454 -8.146 -7.787 1.00 2.50 H new ATOM 127 N GLN A 8 18.359 -2.519 -4.485 1.00 12.44 N ATOM 128 CA GLN A 8 17.317 -2.710 -3.489 1.00 1.01 C ATOM 129 C GLN A 8 16.521 -1.429 -3.273 1.00 25.23 C ATOM 130 O GLN A 8 15.440 -1.479 -2.679 1.00 54.25 O ATOM 131 CB GLN A 8 17.954 -3.190 -2.168 1.00 42.05 C ATOM 132 CG GLN A 8 18.837 -4.447 -2.324 1.00 5.54 C ATOM 133 CD GLN A 8 19.196 -5.131 -1.000 1.00 32.55 C ATOM 134 OE1 GLN A 8 18.546 -4.936 0.022 1.00 0.04 O ATOM 135 NE2 GLN A 8 20.188 -6.003 -1.002 1.00 35.51 N ATOM 0 H GLN A 8 19.208 -2.096 -4.110 1.00 12.44 H new ATOM 0 HA GLN A 8 16.621 -3.468 -3.848 1.00 1.01 H new ATOM 0 HB2 GLN A 8 18.557 -2.383 -1.752 1.00 42.05 H new ATOM 0 HB3 GLN A 8 17.162 -3.400 -1.449 1.00 42.05 H new ATOM 0 HG2 GLN A 8 18.320 -5.164 -2.962 1.00 5.54 H new ATOM 0 HG3 GLN A 8 19.757 -4.169 -2.838 1.00 5.54 H new ATOM 0 HE21 GLN A 8 20.726 -6.162 -1.854 1.00 35.51 H new ATOM 0 HE22 GLN A 8 20.416 -6.518 -0.151 1.00 35.51 H new ATOM 144 N TYR A 9 17.045 -0.293 -3.735 1.00 63.23 N ATOM 145 CA TYR A 9 16.343 0.975 -3.713 1.00 34.23 C ATOM 146 C TYR A 9 16.660 1.771 -4.961 1.00 62.44 C ATOM 147 O TYR A 9 17.682 1.516 -5.598 1.00 74.14 O ATOM 148 CB TYR A 9 16.691 1.772 -2.458 1.00 73.34 C ATOM 149 CG TYR A 9 18.049 2.409 -2.481 1.00 52.23 C ATOM 150 CD1 TYR A 9 19.159 1.695 -2.013 1.00 0.21 C ATOM 151 CD2 TYR A 9 18.183 3.723 -2.942 1.00 21.53 C ATOM 152 CE1 TYR A 9 20.421 2.303 -1.993 1.00 40.44 C ATOM 153 CE2 TYR A 9 19.447 4.330 -2.959 1.00 75.32 C ATOM 154 CZ TYR A 9 20.569 3.621 -2.479 1.00 40.43 C ATOM 155 OH TYR A 9 21.778 4.232 -2.430 1.00 2.11 O ATOM 0 H TYR A 9 17.980 -0.235 -4.138 1.00 63.23 H new ATOM 0 HA TYR A 9 15.272 0.774 -3.692 1.00 34.23 H new ATOM 0 HB2 TYR A 9 15.941 2.550 -2.318 1.00 73.34 H new ATOM 0 HB3 TYR A 9 16.629 1.110 -1.594 1.00 73.34 H new ATOM 0 HD1 TYR A 9 19.043 0.678 -1.668 1.00 0.21 H new ATOM 0 HD2 TYR A 9 17.316 4.268 -3.284 1.00 21.53 H new ATOM 0 HE1 TYR A 9 21.276 1.767 -1.608 1.00 40.44 H new ATOM 0 HE2 TYR A 9 19.561 5.335 -3.338 1.00 75.32 H new ATOM 0 HH TYR A 9 21.704 5.134 -2.806 1.00 2.11 H new ATOM 165 N ILE A 10 15.813 2.747 -5.276 1.00 65.43 N ATOM 166 CA ILE A 10 16.008 3.719 -6.340 1.00 34.11 C ATOM 167 C ILE A 10 15.919 5.100 -5.698 1.00 13.01 C ATOM 168 O ILE A 10 15.303 5.285 -4.640 1.00 51.14 O ATOM 169 CB ILE A 10 14.953 3.560 -7.463 1.00 23.24 C ATOM 170 CG1 ILE A 10 14.575 2.108 -7.781 1.00 31.13 C ATOM 171 CG2 ILE A 10 15.377 4.247 -8.770 1.00 35.40 C ATOM 172 CD1 ILE A 10 15.693 1.211 -8.314 1.00 0.41 C ATOM 0 H ILE A 10 14.936 2.885 -4.774 1.00 65.43 H new ATOM 0 HA ILE A 10 16.978 3.570 -6.815 1.00 34.11 H new ATOM 0 HB ILE A 10 14.072 4.052 -7.050 1.00 23.24 H new ATOM 0 HG12 ILE A 10 14.176 1.653 -6.874 1.00 31.13 H new ATOM 0 HG13 ILE A 10 13.768 2.119 -8.514 1.00 31.13 H new ATOM 0 HG21 ILE A 10 14.602 4.105 -9.524 1.00 35.40 H new ATOM 0 HG22 ILE A 10 15.519 5.313 -8.591 1.00 35.40 H new ATOM 0 HG23 ILE A 10 16.311 3.811 -9.124 1.00 35.40 H new ATOM 0 HD11 ILE A 10 15.300 0.211 -8.500 1.00 0.41 H new ATOM 0 HD12 ILE A 10 16.081 1.627 -9.244 1.00 0.41 H new ATOM 0 HD13 ILE A 10 16.496 1.154 -7.579 1.00 0.41 H new ATOM 184 N THR A 11 16.519 6.065 -6.372 1.00 20.22 N ATOM 185 CA THR A 11 16.479 7.479 -6.028 1.00 75.52 C ATOM 186 C THR A 11 15.468 8.156 -6.962 1.00 14.14 C ATOM 187 O THR A 11 15.229 7.682 -8.076 1.00 40.05 O ATOM 188 CB THR A 11 17.893 8.078 -6.179 1.00 64.15 C ATOM 189 OG1 THR A 11 18.901 7.164 -5.772 1.00 0.04 O ATOM 190 CG2 THR A 11 18.065 9.336 -5.328 1.00 12.02 C ATOM 0 H THR A 11 17.071 5.879 -7.209 1.00 20.22 H new ATOM 0 HA THR A 11 16.167 7.634 -4.995 1.00 75.52 H new ATOM 0 HB THR A 11 17.999 8.313 -7.238 1.00 64.15 H new ATOM 0 HG1 THR A 11 19.782 7.578 -5.884 1.00 0.04 H new ATOM 0 HG21 THR A 11 19.073 9.730 -5.460 1.00 12.02 H new ATOM 0 HG22 THR A 11 17.339 10.087 -5.638 1.00 12.02 H new ATOM 0 HG23 THR A 11 17.906 9.090 -4.278 1.00 12.02 H new ATOM 198 N LEU A 12 14.858 9.255 -6.520 1.00 0.34 N ATOM 199 CA LEU A 12 14.056 10.099 -7.399 1.00 71.24 C ATOM 200 C LEU A 12 14.996 11.163 -7.964 1.00 52.04 C ATOM 201 O LEU A 12 15.918 11.594 -7.275 1.00 41.11 O ATOM 202 CB LEU A 12 12.882 10.749 -6.645 1.00 43.52 C ATOM 203 CG LEU A 12 12.144 9.834 -5.650 1.00 53.33 C ATOM 204 CD1 LEU A 12 11.156 10.664 -4.833 1.00 73.55 C ATOM 205 CD2 LEU A 12 11.444 8.680 -6.374 1.00 55.31 C ATOM 0 H LEU A 12 14.905 9.581 -5.555 1.00 0.34 H new ATOM 0 HA LEU A 12 13.612 9.503 -8.196 1.00 71.24 H new ATOM 0 HB2 LEU A 12 13.257 11.617 -6.103 1.00 43.52 H new ATOM 0 HB3 LEU A 12 12.162 11.116 -7.376 1.00 43.52 H new ATOM 0 HG LEU A 12 12.870 9.387 -4.971 1.00 53.33 H new ATOM 0 HD11 LEU A 12 10.633 10.017 -4.128 1.00 73.55 H new ATOM 0 HD12 LEU A 12 11.696 11.436 -4.285 1.00 73.55 H new ATOM 0 HD13 LEU A 12 10.433 11.131 -5.502 1.00 73.55 H new ATOM 0 HD21 LEU A 12 10.932 8.051 -5.646 1.00 55.31 H new ATOM 0 HD22 LEU A 12 10.718 9.081 -7.081 1.00 55.31 H new ATOM 0 HD23 LEU A 12 12.183 8.085 -6.911 1.00 55.31 H new ATOM 217 N ASP A 13 14.733 11.618 -9.184 1.00 63.14 N ATOM 218 CA ASP A 13 15.495 12.671 -9.879 1.00 5.12 C ATOM 219 C ASP A 13 15.192 14.035 -9.245 1.00 1.11 C ATOM 220 O ASP A 13 16.061 14.895 -9.093 1.00 62.14 O ATOM 221 CB ASP A 13 15.079 12.661 -11.360 1.00 60.12 C ATOM 222 CG ASP A 13 16.010 13.405 -12.324 1.00 4.52 C ATOM 223 OD1 ASP A 13 16.571 14.470 -11.987 1.00 2.22 O ATOM 224 OD2 ASP A 13 16.124 12.959 -13.490 1.00 71.13 O ATOM 0 H ASP A 13 13.959 11.258 -9.742 1.00 63.14 H new ATOM 0 HA ASP A 13 16.566 12.488 -9.794 1.00 5.12 H new ATOM 0 HB2 ASP A 13 15.002 11.624 -11.688 1.00 60.12 H new ATOM 0 HB3 ASP A 13 14.083 13.096 -11.440 1.00 60.12 H new ATOM 229 N LYS A 14 13.940 14.192 -8.797 1.00 42.11 N ATOM 230 CA LYS A 14 13.410 15.344 -8.079 1.00 1.15 C ATOM 231 C LYS A 14 12.783 14.847 -6.778 1.00 23.23 C ATOM 232 O LYS A 14 11.574 14.617 -6.731 1.00 42.12 O ATOM 233 CB LYS A 14 12.410 16.090 -8.970 1.00 33.32 C ATOM 234 CG LYS A 14 13.045 17.290 -9.678 1.00 3.15 C ATOM 235 CD LYS A 14 13.132 18.503 -8.736 1.00 73.12 C ATOM 236 CE LYS A 14 13.630 19.744 -9.484 1.00 23.51 C ATOM 237 NZ LYS A 14 15.070 19.666 -9.807 1.00 61.54 N ATOM 0 H LYS A 14 13.232 13.471 -8.938 1.00 42.11 H new ATOM 0 HA LYS A 14 14.198 16.054 -7.829 1.00 1.15 H new ATOM 0 HB2 LYS A 14 12.007 15.403 -9.714 1.00 33.32 H new ATOM 0 HB3 LYS A 14 11.571 16.431 -8.364 1.00 33.32 H new ATOM 0 HG2 LYS A 14 14.043 17.024 -10.028 1.00 3.15 H new ATOM 0 HG3 LYS A 14 12.457 17.550 -10.558 1.00 3.15 H new ATOM 0 HD2 LYS A 14 12.152 18.703 -8.304 1.00 73.12 H new ATOM 0 HD3 LYS A 14 13.805 18.278 -7.909 1.00 73.12 H new ATOM 0 HE2 LYS A 14 13.060 19.863 -10.405 1.00 23.51 H new ATOM 0 HE3 LYS A 14 13.444 20.630 -8.877 1.00 23.51 H new ATOM 0 HZ1 LYS A 14 15.360 20.528 -10.312 1.00 61.54 H new ATOM 0 HZ2 LYS A 14 15.619 19.579 -8.928 1.00 61.54 H new ATOM 0 HZ3 LYS A 14 15.246 18.836 -10.409 1.00 61.54 H new ATOM 251 N PRO A 15 13.596 14.627 -5.734 1.00 13.23 N ATOM 252 CA PRO A 15 13.123 14.380 -4.385 1.00 24.54 C ATOM 253 C PRO A 15 12.659 15.717 -3.798 1.00 34.12 C ATOM 254 O PRO A 15 13.449 16.444 -3.182 1.00 14.22 O ATOM 255 CB PRO A 15 14.332 13.800 -3.632 1.00 71.52 C ATOM 256 CG PRO A 15 15.528 14.419 -4.354 1.00 0.01 C ATOM 257 CD PRO A 15 15.046 14.640 -5.785 1.00 23.24 C ATOM 0 HA PRO A 15 12.282 13.689 -4.326 1.00 24.54 H new ATOM 0 HB2 PRO A 15 14.316 14.071 -2.576 1.00 71.52 H new ATOM 0 HB3 PRO A 15 14.352 12.711 -3.682 1.00 71.52 H new ATOM 0 HG2 PRO A 15 15.829 15.357 -3.888 1.00 0.01 H new ATOM 0 HG3 PRO A 15 16.393 13.757 -4.326 1.00 0.01 H new ATOM 0 HD2 PRO A 15 15.413 15.589 -6.176 1.00 23.24 H new ATOM 0 HD3 PRO A 15 15.419 13.857 -6.446 1.00 23.24 H new ATOM 265 N ILE A 16 11.409 16.104 -4.029 1.00 24.22 N ATOM 266 CA ILE A 16 10.815 17.282 -3.408 1.00 35.55 C ATOM 267 C ILE A 16 9.292 17.143 -3.426 1.00 14.20 C ATOM 268 O ILE A 16 8.724 16.688 -4.423 1.00 21.34 O ATOM 269 CB ILE A 16 11.325 18.569 -4.098 1.00 32.53 C ATOM 270 CG1 ILE A 16 11.053 19.784 -3.194 1.00 34.12 C ATOM 271 CG2 ILE A 16 10.795 18.757 -5.525 1.00 51.44 C ATOM 272 CD1 ILE A 16 11.829 21.016 -3.654 1.00 42.34 C ATOM 0 H ILE A 16 10.776 15.607 -4.656 1.00 24.22 H new ATOM 0 HA ILE A 16 11.120 17.361 -2.365 1.00 35.55 H new ATOM 0 HB ILE A 16 12.402 18.468 -4.229 1.00 32.53 H new ATOM 0 HG12 ILE A 16 9.986 20.005 -3.194 1.00 34.12 H new ATOM 0 HG13 ILE A 16 11.329 19.543 -2.167 1.00 34.12 H new ATOM 0 HG21 ILE A 16 11.196 19.680 -5.943 1.00 51.44 H new ATOM 0 HG22 ILE A 16 11.105 17.914 -6.142 1.00 51.44 H new ATOM 0 HG23 ILE A 16 9.706 18.810 -5.505 1.00 51.44 H new ATOM 0 HD11 ILE A 16 11.610 21.853 -2.990 1.00 42.34 H new ATOM 0 HD12 ILE A 16 12.898 20.803 -3.629 1.00 42.34 H new ATOM 0 HD13 ILE A 16 11.534 21.273 -4.671 1.00 42.34 H new ATOM 284 N ALA A 17 8.645 17.575 -2.340 1.00 61.53 N ATOM 285 CA ALA A 17 7.203 17.580 -2.131 1.00 54.33 C ATOM 286 C ALA A 17 6.523 16.228 -2.418 1.00 20.14 C ATOM 287 O ALA A 17 7.169 15.204 -2.655 1.00 23.13 O ATOM 288 CB ALA A 17 6.594 18.740 -2.932 1.00 53.33 C ATOM 0 H ALA A 17 9.149 17.952 -1.537 1.00 61.53 H new ATOM 0 HA ALA A 17 7.014 17.737 -1.069 1.00 54.33 H new ATOM 0 HB1 ALA A 17 5.514 18.756 -2.785 1.00 53.33 H new ATOM 0 HB2 ALA A 17 7.021 19.682 -2.589 1.00 53.33 H new ATOM 0 HB3 ALA A 17 6.814 18.606 -3.991 1.00 53.33 H new ATOM 294 N GLY A 18 5.194 16.228 -2.365 1.00 54.13 N ATOM 295 CA GLY A 18 4.367 15.045 -2.513 1.00 22.14 C ATOM 296 C GLY A 18 4.170 14.376 -1.162 1.00 14.00 C ATOM 297 O GLY A 18 5.151 14.036 -0.502 1.00 43.12 O ATOM 0 H GLY A 18 4.652 17.078 -2.213 1.00 54.13 H new ATOM 0 HA2 GLY A 18 3.401 15.317 -2.937 1.00 22.14 H new ATOM 0 HA3 GLY A 18 4.835 14.348 -3.208 1.00 22.14 H new ATOM 301 N GLU A 19 2.899 14.235 -0.763 1.00 13.11 N ATOM 302 CA GLU A 19 2.427 13.390 0.338 1.00 61.14 C ATOM 303 C GLU A 19 2.994 13.738 1.737 1.00 60.51 C ATOM 304 O GLU A 19 3.881 14.588 1.868 1.00 53.31 O ATOM 305 CB GLU A 19 2.613 11.925 -0.095 1.00 41.13 C ATOM 306 CG GLU A 19 1.689 11.547 -1.257 1.00 51.12 C ATOM 307 CD GLU A 19 2.488 10.980 -2.421 1.00 14.10 C ATOM 308 OE1 GLU A 19 2.853 9.790 -2.323 1.00 14.52 O ATOM 309 OE2 GLU A 19 2.793 11.767 -3.347 1.00 25.30 O ATOM 0 H GLU A 19 2.136 14.732 -1.223 1.00 13.11 H new ATOM 0 HA GLU A 19 1.368 13.587 0.507 1.00 61.14 H new ATOM 0 HB2 GLU A 19 3.650 11.763 -0.389 1.00 41.13 H new ATOM 0 HB3 GLU A 19 2.416 11.269 0.753 1.00 41.13 H new ATOM 0 HG2 GLU A 19 0.957 10.813 -0.921 1.00 51.12 H new ATOM 0 HG3 GLU A 19 1.133 12.425 -1.585 1.00 51.12 H new ATOM 316 N PRO A 20 2.414 13.205 2.832 1.00 20.31 N ATOM 317 CA PRO A 20 2.929 13.381 4.196 1.00 41.15 C ATOM 318 C PRO A 20 4.287 12.676 4.445 1.00 23.42 C ATOM 319 O PRO A 20 4.407 11.818 5.326 1.00 5.40 O ATOM 320 CB PRO A 20 1.797 12.879 5.108 1.00 41.34 C ATOM 321 CG PRO A 20 1.069 11.854 4.244 1.00 20.42 C ATOM 322 CD PRO A 20 1.137 12.495 2.871 1.00 45.53 C ATOM 0 HA PRO A 20 3.173 14.424 4.399 1.00 41.15 H new ATOM 0 HB2 PRO A 20 2.187 12.429 6.021 1.00 41.34 H new ATOM 0 HB3 PRO A 20 1.136 13.691 5.410 1.00 41.34 H new ATOM 0 HG2 PRO A 20 1.559 10.881 4.265 1.00 20.42 H new ATOM 0 HG3 PRO A 20 0.041 11.700 4.572 1.00 20.42 H new ATOM 0 HD2 PRO A 20 1.082 11.743 2.084 1.00 45.53 H new ATOM 0 HD3 PRO A 20 0.303 13.179 2.716 1.00 45.53 H new ATOM 330 N GLN A 21 5.334 13.121 3.753 1.00 62.34 N ATOM 331 CA GLN A 21 6.761 12.799 3.790 1.00 51.14 C ATOM 332 C GLN A 21 7.186 11.320 3.644 1.00 13.02 C ATOM 333 O GLN A 21 8.289 11.096 3.148 1.00 43.41 O ATOM 334 CB GLN A 21 7.424 13.496 4.995 1.00 62.31 C ATOM 335 CG GLN A 21 8.881 13.899 4.712 1.00 51.55 C ATOM 336 CD GLN A 21 9.602 14.384 5.966 1.00 22.22 C ATOM 337 OE1 GLN A 21 9.790 15.576 6.201 1.00 1.21 O ATOM 338 NE2 GLN A 21 10.029 13.477 6.819 1.00 22.34 N ATOM 0 H GLN A 21 5.172 13.831 3.038 1.00 62.34 H new ATOM 0 HA GLN A 21 7.144 13.202 2.853 1.00 51.14 H new ATOM 0 HB2 GLN A 21 6.849 14.384 5.259 1.00 62.31 H new ATOM 0 HB3 GLN A 21 7.395 12.830 5.857 1.00 62.31 H new ATOM 0 HG2 GLN A 21 9.417 13.047 4.294 1.00 51.55 H new ATOM 0 HG3 GLN A 21 8.898 14.686 3.958 1.00 51.55 H new ATOM 0 HE21 GLN A 21 9.876 12.487 6.629 1.00 22.34 H new ATOM 0 HE22 GLN A 21 10.513 13.765 7.670 1.00 22.34 H new ATOM 347 N VAL A 22 6.402 10.309 4.035 1.00 65.43 N ATOM 348 CA VAL A 22 6.633 8.912 3.644 1.00 60.12 C ATOM 349 C VAL A 22 5.303 8.146 3.622 1.00 14.51 C ATOM 350 O VAL A 22 4.385 8.508 4.365 1.00 21.34 O ATOM 351 CB VAL A 22 7.727 8.284 4.531 1.00 61.31 C ATOM 352 CG1 VAL A 22 7.316 8.098 5.988 1.00 62.51 C ATOM 353 CG2 VAL A 22 8.204 6.955 3.963 1.00 61.54 C ATOM 0 H VAL A 22 5.586 10.436 4.634 1.00 65.43 H new ATOM 0 HA VAL A 22 7.020 8.857 2.626 1.00 60.12 H new ATOM 0 HB VAL A 22 8.544 9.006 4.523 1.00 61.31 H new ATOM 0 HG11 VAL A 22 8.140 7.651 6.544 1.00 62.51 H new ATOM 0 HG12 VAL A 22 7.068 9.066 6.422 1.00 62.51 H new ATOM 0 HG13 VAL A 22 6.446 7.443 6.040 1.00 62.51 H new ATOM 0 HG21 VAL A 22 8.975 6.538 4.611 1.00 61.54 H new ATOM 0 HG22 VAL A 22 7.365 6.262 3.905 1.00 61.54 H new ATOM 0 HG23 VAL A 22 8.614 7.112 2.966 1.00 61.54 H new ATOM 363 N LEU A 23 5.139 7.154 2.736 1.00 12.14 N ATOM 364 CA LEU A 23 3.852 6.526 2.430 1.00 62.21 C ATOM 365 C LEU A 23 4.051 5.306 1.525 1.00 0.00 C ATOM 366 O LEU A 23 5.100 5.183 0.881 1.00 13.23 O ATOM 367 CB LEU A 23 2.987 7.558 1.688 1.00 12.45 C ATOM 368 CG LEU A 23 1.498 7.185 1.595 1.00 35.13 C ATOM 369 CD1 LEU A 23 0.684 8.071 2.534 1.00 53.32 C ATOM 370 CD2 LEU A 23 1.063 7.338 0.141 1.00 64.43 C ATOM 0 H LEU A 23 5.914 6.760 2.203 1.00 12.14 H new ATOM 0 HA LEU A 23 3.375 6.201 3.355 1.00 62.21 H new ATOM 0 HB2 LEU A 23 3.078 8.520 2.192 1.00 12.45 H new ATOM 0 HB3 LEU A 23 3.381 7.687 0.680 1.00 12.45 H new ATOM 0 HG LEU A 23 1.331 6.153 1.905 1.00 35.13 H new ATOM 0 HD11 LEU A 23 -0.370 7.803 2.464 1.00 53.32 H new ATOM 0 HD12 LEU A 23 1.028 7.928 3.558 1.00 53.32 H new ATOM 0 HD13 LEU A 23 0.812 9.116 2.251 1.00 53.32 H new ATOM 0 HD21 LEU A 23 0.008 7.079 0.048 1.00 64.43 H new ATOM 0 HD22 LEU A 23 1.213 8.370 -0.177 1.00 64.43 H new ATOM 0 HD23 LEU A 23 1.657 6.675 -0.488 1.00 64.43 H new ATOM 382 N GLU A 24 3.028 4.453 1.419 1.00 40.41 N ATOM 383 CA GLU A 24 2.980 3.320 0.508 1.00 13.40 C ATOM 384 C GLU A 24 1.727 3.438 -0.396 1.00 24.51 C ATOM 385 O GLU A 24 0.741 4.065 0.006 1.00 54.13 O ATOM 386 CB GLU A 24 2.883 2.011 1.304 1.00 41.34 C ATOM 387 CG GLU A 24 3.370 1.941 2.761 1.00 5.00 C ATOM 388 CD GLU A 24 4.815 2.348 3.067 1.00 14.24 C ATOM 389 OE1 GLU A 24 5.725 2.170 2.238 1.00 51.24 O ATOM 390 OE2 GLU A 24 5.035 2.717 4.248 1.00 5.11 O ATOM 0 H GLU A 24 2.185 4.541 1.987 1.00 40.41 H new ATOM 0 HA GLU A 24 3.886 3.317 -0.098 1.00 13.40 H new ATOM 0 HB2 GLU A 24 1.835 1.711 1.301 1.00 41.34 H new ATOM 0 HB3 GLU A 24 3.433 1.254 0.745 1.00 41.34 H new ATOM 0 HG2 GLU A 24 2.714 2.571 3.361 1.00 5.00 H new ATOM 0 HG3 GLU A 24 3.233 0.917 3.108 1.00 5.00 H new ATOM 397 N PHE A 25 1.690 2.777 -1.559 1.00 32.21 N ATOM 398 CA PHE A 25 0.541 2.701 -2.463 1.00 13.41 C ATOM 399 C PHE A 25 0.379 1.329 -3.118 1.00 73.52 C ATOM 400 O PHE A 25 1.325 0.795 -3.710 1.00 61.24 O ATOM 401 CB PHE A 25 0.714 3.713 -3.594 1.00 3.42 C ATOM 402 CG PHE A 25 0.011 5.021 -3.371 1.00 40.03 C ATOM 403 CD1 PHE A 25 -1.393 5.072 -3.422 1.00 65.24 C ATOM 404 CD2 PHE A 25 0.762 6.193 -3.221 1.00 62.23 C ATOM 405 CE1 PHE A 25 -2.047 6.311 -3.418 1.00 52.12 C ATOM 406 CE2 PHE A 25 0.111 7.435 -3.207 1.00 64.43 C ATOM 407 CZ PHE A 25 -1.289 7.489 -3.332 1.00 23.33 C ATOM 0 H PHE A 25 2.496 2.259 -1.909 1.00 32.21 H new ATOM 0 HA PHE A 25 -0.338 2.904 -1.851 1.00 13.41 H new ATOM 0 HB2 PHE A 25 1.778 3.906 -3.733 1.00 3.42 H new ATOM 0 HB3 PHE A 25 0.347 3.271 -4.520 1.00 3.42 H new ATOM 0 HD1 PHE A 25 -1.966 4.158 -3.464 1.00 65.24 H new ATOM 0 HD2 PHE A 25 1.836 6.141 -3.117 1.00 62.23 H new ATOM 0 HE1 PHE A 25 -3.124 6.359 -3.480 1.00 52.12 H new ATOM 0 HE2 PHE A 25 0.682 8.346 -3.101 1.00 64.43 H new ATOM 0 HZ PHE A 25 -1.786 8.447 -3.362 1.00 23.33 H new ATOM 417 N PHE A 26 -0.862 0.822 -3.123 1.00 33.14 N ATOM 418 CA PHE A 26 -1.256 -0.451 -3.735 1.00 45.31 C ATOM 419 C PHE A 26 -2.606 -0.328 -4.442 1.00 21.32 C ATOM 420 O PHE A 26 -3.240 0.727 -4.378 1.00 23.50 O ATOM 421 CB PHE A 26 -1.323 -1.527 -2.640 1.00 5.34 C ATOM 422 CG PHE A 26 -0.169 -1.456 -1.663 1.00 20.22 C ATOM 423 CD1 PHE A 26 1.141 -1.679 -2.118 1.00 33.41 C ATOM 424 CD2 PHE A 26 -0.389 -1.033 -0.342 1.00 3.43 C ATOM 425 CE1 PHE A 26 2.238 -1.490 -1.264 1.00 52.51 C ATOM 426 CE2 PHE A 26 0.706 -0.857 0.519 1.00 43.33 C ATOM 427 CZ PHE A 26 2.014 -1.081 0.057 1.00 24.51 C ATOM 0 H PHE A 26 -1.646 1.306 -2.685 1.00 33.14 H new ATOM 0 HA PHE A 26 -0.516 -0.730 -4.485 1.00 45.31 H new ATOM 0 HB2 PHE A 26 -2.260 -1.422 -2.094 1.00 5.34 H new ATOM 0 HB3 PHE A 26 -1.335 -2.512 -3.107 1.00 5.34 H new ATOM 0 HD1 PHE A 26 1.306 -1.999 -3.136 1.00 33.41 H new ATOM 0 HD2 PHE A 26 -1.393 -0.845 0.009 1.00 3.43 H new ATOM 0 HE1 PHE A 26 3.243 -1.658 -1.621 1.00 52.51 H new ATOM 0 HE2 PHE A 26 0.542 -0.548 1.541 1.00 43.33 H new ATOM 0 HZ PHE A 26 2.851 -0.937 0.724 1.00 24.51 H new ATOM 437 N SER A 27 -3.076 -1.400 -5.088 1.00 35.23 N ATOM 438 CA SER A 27 -4.492 -1.583 -5.387 1.00 13.14 C ATOM 439 C SER A 27 -4.892 -3.027 -5.091 1.00 43.22 C ATOM 440 O SER A 27 -4.045 -3.919 -5.078 1.00 3.41 O ATOM 441 CB SER A 27 -4.744 -1.266 -6.860 1.00 4.51 C ATOM 442 OG SER A 27 -6.120 -1.247 -7.175 1.00 62.43 O ATOM 0 H SER A 27 -2.483 -2.162 -5.416 1.00 35.23 H new ATOM 0 HA SER A 27 -5.088 -0.912 -4.768 1.00 13.14 H new ATOM 0 HB2 SER A 27 -4.305 -0.298 -7.102 1.00 4.51 H new ATOM 0 HB3 SER A 27 -4.241 -2.008 -7.480 1.00 4.51 H new ATOM 0 HG SER A 27 -6.246 -1.517 -8.109 1.00 62.43 H new ATOM 448 N PHE A 28 -6.189 -3.297 -4.956 1.00 21.44 N ATOM 449 CA PHE A 28 -6.655 -4.673 -4.863 1.00 40.31 C ATOM 450 C PHE A 28 -6.554 -5.427 -6.195 1.00 42.11 C ATOM 451 O PHE A 28 -6.519 -6.655 -6.184 1.00 63.12 O ATOM 452 CB PHE A 28 -8.008 -4.790 -4.138 1.00 24.20 C ATOM 453 CG PHE A 28 -9.359 -4.475 -4.744 1.00 13.20 C ATOM 454 CD1 PHE A 28 -9.577 -4.117 -6.083 1.00 61.23 C ATOM 455 CD2 PHE A 28 -10.468 -4.598 -3.889 1.00 53.13 C ATOM 456 CE1 PHE A 28 -10.879 -3.852 -6.528 1.00 43.22 C ATOM 457 CE2 PHE A 28 -11.774 -4.376 -4.352 1.00 20.30 C ATOM 458 CZ PHE A 28 -11.976 -3.969 -5.677 1.00 34.44 C ATOM 0 H PHE A 28 -6.924 -2.591 -4.909 1.00 21.44 H new ATOM 0 HA PHE A 28 -5.960 -5.205 -4.213 1.00 40.31 H new ATOM 0 HB2 PHE A 28 -8.071 -5.821 -3.791 1.00 24.20 H new ATOM 0 HB3 PHE A 28 -7.926 -4.160 -3.252 1.00 24.20 H new ATOM 0 HD1 PHE A 28 -8.745 -4.046 -6.768 1.00 61.23 H new ATOM 0 HD2 PHE A 28 -10.312 -4.869 -2.855 1.00 53.13 H new ATOM 0 HE1 PHE A 28 -11.036 -3.550 -7.553 1.00 43.22 H new ATOM 0 HE2 PHE A 28 -12.617 -4.518 -3.692 1.00 20.30 H new ATOM 0 HZ PHE A 28 -12.971 -3.748 -6.035 1.00 34.44 H new ATOM 468 N TYR A 29 -6.471 -4.737 -7.342 1.00 0.50 N ATOM 469 CA TYR A 29 -6.372 -5.382 -8.648 1.00 1.15 C ATOM 470 C TYR A 29 -4.921 -5.661 -9.063 1.00 75.41 C ATOM 471 O TYR A 29 -4.734 -6.303 -10.099 1.00 52.23 O ATOM 472 CB TYR A 29 -7.037 -4.492 -9.721 1.00 41.32 C ATOM 473 CG TYR A 29 -8.553 -4.383 -9.707 1.00 73.32 C ATOM 474 CD1 TYR A 29 -9.353 -5.540 -9.675 1.00 22.11 C ATOM 475 CD2 TYR A 29 -9.178 -3.127 -9.821 1.00 52.03 C ATOM 476 CE1 TYR A 29 -10.753 -5.451 -9.765 1.00 44.23 C ATOM 477 CE2 TYR A 29 -10.578 -3.016 -9.896 1.00 31.35 C ATOM 478 CZ TYR A 29 -11.375 -4.188 -9.895 1.00 20.31 C ATOM 479 OH TYR A 29 -12.735 -4.101 -9.954 1.00 4.55 O ATOM 0 H TYR A 29 -6.471 -3.718 -7.384 1.00 0.50 H new ATOM 0 HA TYR A 29 -6.884 -6.341 -8.567 1.00 1.15 H new ATOM 0 HB2 TYR A 29 -6.627 -3.487 -9.624 1.00 41.32 H new ATOM 0 HB3 TYR A 29 -6.736 -4.865 -10.700 1.00 41.32 H new ATOM 0 HD1 TYR A 29 -8.885 -6.509 -9.580 1.00 22.11 H new ATOM 0 HD2 TYR A 29 -8.572 -2.233 -9.851 1.00 52.03 H new ATOM 0 HE1 TYR A 29 -11.354 -6.348 -9.735 1.00 44.23 H new ATOM 0 HE2 TYR A 29 -11.043 -2.043 -9.954 1.00 31.35 H new ATOM 0 HH TYR A 29 -13.132 -4.838 -9.444 1.00 4.55 H new ATOM 489 N CYS A 30 -3.886 -5.168 -8.364 1.00 21.53 N ATOM 490 CA CYS A 30 -2.520 -5.450 -8.811 1.00 11.03 C ATOM 491 C CYS A 30 -2.051 -6.814 -8.268 1.00 2.53 C ATOM 492 O CYS A 30 -2.319 -7.122 -7.106 1.00 40.22 O ATOM 493 CB CYS A 30 -1.614 -4.251 -8.474 1.00 14.40 C ATOM 494 SG CYS A 30 -1.724 -3.433 -6.883 1.00 4.41 S ATOM 0 H CYS A 30 -3.964 -4.596 -7.523 1.00 21.53 H new ATOM 0 HA CYS A 30 -2.470 -5.556 -9.895 1.00 11.03 H new ATOM 0 HB2 CYS A 30 -0.583 -4.586 -8.591 1.00 14.40 H new ATOM 0 HB3 CYS A 30 -1.791 -3.492 -9.237 1.00 14.40 H new ATOM 499 N PRO A 31 -1.290 -7.614 -9.039 1.00 42.11 N ATOM 500 CA PRO A 31 -0.994 -8.989 -8.648 1.00 21.55 C ATOM 501 C PRO A 31 0.301 -9.100 -7.847 1.00 31.20 C ATOM 502 O PRO A 31 0.400 -9.949 -6.963 1.00 43.45 O ATOM 503 CB PRO A 31 -0.902 -9.759 -9.958 1.00 75.11 C ATOM 504 CG PRO A 31 -0.352 -8.722 -10.936 1.00 11.11 C ATOM 505 CD PRO A 31 -1.025 -7.434 -10.463 1.00 24.31 C ATOM 0 HA PRO A 31 -1.765 -9.386 -7.988 1.00 21.55 H new ATOM 0 HB2 PRO A 31 -0.241 -10.622 -9.872 1.00 75.11 H new ATOM 0 HB3 PRO A 31 -1.876 -10.134 -10.274 1.00 75.11 H new ATOM 0 HG2 PRO A 31 0.735 -8.654 -10.887 1.00 11.11 H new ATOM 0 HG3 PRO A 31 -0.610 -8.960 -11.968 1.00 11.11 H new ATOM 0 HD2 PRO A 31 -0.380 -6.572 -10.633 1.00 24.31 H new ATOM 0 HD3 PRO A 31 -1.949 -7.253 -11.012 1.00 24.31 H new ATOM 513 N HIS A 32 1.280 -8.228 -8.110 1.00 55.01 N ATOM 514 CA HIS A 32 2.448 -8.104 -7.252 1.00 14.25 C ATOM 515 C HIS A 32 1.995 -7.745 -5.838 1.00 74.41 C ATOM 516 O HIS A 32 2.450 -8.341 -4.865 1.00 61.51 O ATOM 517 CB HIS A 32 3.415 -7.064 -7.803 1.00 51.33 C ATOM 518 CG HIS A 32 4.163 -7.596 -8.989 1.00 31.10 C ATOM 519 ND1 HIS A 32 5.056 -8.635 -8.976 1.00 32.30 N ATOM 520 CD2 HIS A 32 3.985 -7.224 -10.284 1.00 55.04 C ATOM 521 CE1 HIS A 32 5.423 -8.883 -10.239 1.00 5.02 C ATOM 522 NE2 HIS A 32 4.833 -8.008 -11.078 1.00 14.55 N ATOM 0 H HIS A 32 1.280 -7.600 -8.913 1.00 55.01 H new ATOM 0 HA HIS A 32 2.979 -9.055 -7.222 1.00 14.25 H new ATOM 0 HB2 HIS A 32 2.865 -6.167 -8.088 1.00 51.33 H new ATOM 0 HB3 HIS A 32 4.121 -6.771 -7.026 1.00 51.33 H new ATOM 0 HD2 HIS A 32 3.310 -6.459 -10.639 1.00 55.04 H new ATOM 0 HE1 HIS A 32 6.096 -9.671 -10.543 1.00 5.02 H new ATOM 0 HE2 HIS A 32 4.975 -7.932 -12.085 1.00 14.55 H new ATOM 530 N CYS A 33 1.050 -6.802 -5.754 1.00 45.21 N ATOM 531 CA CYS A 33 0.437 -6.378 -4.511 1.00 74.52 C ATOM 532 C CYS A 33 -0.168 -7.570 -3.772 1.00 52.03 C ATOM 533 O CYS A 33 0.001 -7.655 -2.568 1.00 71.22 O ATOM 534 CB CYS A 33 -0.618 -5.304 -4.780 1.00 72.51 C ATOM 535 SG CYS A 33 -0.056 -3.948 -5.845 1.00 2.04 S ATOM 0 H CYS A 33 0.689 -6.308 -6.570 1.00 45.21 H new ATOM 0 HA CYS A 33 1.208 -5.947 -3.872 1.00 74.52 H new ATOM 0 HB2 CYS A 33 -1.487 -5.774 -5.240 1.00 72.51 H new ATOM 0 HB3 CYS A 33 -0.947 -4.889 -3.827 1.00 72.51 H new ATOM 540 N TYR A 34 -0.810 -8.523 -4.467 1.00 14.12 N ATOM 541 CA TYR A 34 -1.327 -9.729 -3.820 1.00 60.32 C ATOM 542 C TYR A 34 -0.226 -10.394 -3.018 1.00 31.22 C ATOM 543 O TYR A 34 -0.331 -10.503 -1.804 1.00 64.24 O ATOM 544 CB TYR A 34 -1.948 -10.720 -4.818 1.00 0.43 C ATOM 545 CG TYR A 34 -2.699 -11.863 -4.155 1.00 42.15 C ATOM 546 CD1 TYR A 34 -1.999 -12.973 -3.643 1.00 12.13 C ATOM 547 CD2 TYR A 34 -4.097 -11.798 -4.010 1.00 22.20 C ATOM 548 CE1 TYR A 34 -2.672 -13.950 -2.889 1.00 4.14 C ATOM 549 CE2 TYR A 34 -4.777 -12.777 -3.266 1.00 54.22 C ATOM 550 CZ TYR A 34 -4.056 -13.820 -2.651 1.00 0.33 C ATOM 551 OH TYR A 34 -4.680 -14.663 -1.790 1.00 40.45 O ATOM 0 H TYR A 34 -0.980 -8.478 -5.472 1.00 14.12 H new ATOM 0 HA TYR A 34 -2.131 -9.421 -3.151 1.00 60.32 H new ATOM 0 HB2 TYR A 34 -2.631 -10.181 -5.475 1.00 0.43 H new ATOM 0 HB3 TYR A 34 -1.159 -11.132 -5.447 1.00 0.43 H new ATOM 0 HD1 TYR A 34 -0.940 -13.074 -3.831 1.00 12.13 H new ATOM 0 HD2 TYR A 34 -4.649 -10.993 -4.472 1.00 22.20 H new ATOM 0 HE1 TYR A 34 -2.131 -14.797 -2.493 1.00 4.14 H new ATOM 0 HE2 TYR A 34 -5.851 -12.730 -3.166 1.00 54.22 H new ATOM 0 HH TYR A 34 -4.926 -14.176 -0.976 1.00 40.45 H new ATOM 561 N GLN A 35 0.856 -10.810 -3.673 1.00 53.13 N ATOM 562 CA GLN A 35 1.939 -11.499 -2.987 1.00 51.05 C ATOM 563 C GLN A 35 2.429 -10.652 -1.815 1.00 31.54 C ATOM 564 O GLN A 35 2.650 -11.196 -0.740 1.00 35.22 O ATOM 565 CB GLN A 35 3.096 -11.770 -3.956 1.00 45.32 C ATOM 566 CG GLN A 35 2.710 -12.502 -5.241 1.00 23.23 C ATOM 567 CD GLN A 35 2.719 -14.018 -5.120 1.00 60.12 C ATOM 568 OE1 GLN A 35 3.602 -14.659 -5.671 1.00 62.33 O ATOM 569 NE2 GLN A 35 1.721 -14.636 -4.502 1.00 3.42 N ATOM 0 H GLN A 35 1.003 -10.681 -4.674 1.00 53.13 H new ATOM 0 HA GLN A 35 1.568 -12.452 -2.611 1.00 51.05 H new ATOM 0 HB2 GLN A 35 3.556 -10.818 -4.223 1.00 45.32 H new ATOM 0 HB3 GLN A 35 3.854 -12.356 -3.437 1.00 45.32 H new ATOM 0 HG2 GLN A 35 1.715 -12.179 -5.545 1.00 23.23 H new ATOM 0 HG3 GLN A 35 3.397 -12.208 -6.034 1.00 23.23 H new ATOM 0 HE21 GLN A 35 0.989 -14.092 -4.045 1.00 3.42 H new ATOM 0 HE22 GLN A 35 1.686 -15.655 -4.484 1.00 3.42 H new ATOM 578 N PHE A 36 2.560 -9.339 -1.997 1.00 32.40 N ATOM 579 CA PHE A 36 3.128 -8.452 -0.996 1.00 23.23 C ATOM 580 C PHE A 36 2.228 -8.300 0.230 1.00 71.52 C ATOM 581 O PHE A 36 2.753 -8.039 1.311 1.00 12.23 O ATOM 582 CB PHE A 36 3.435 -7.087 -1.621 1.00 51.11 C ATOM 583 CG PHE A 36 4.705 -6.997 -2.447 1.00 65.55 C ATOM 584 CD1 PHE A 36 5.153 -8.083 -3.226 1.00 1.21 C ATOM 585 CD2 PHE A 36 5.453 -5.804 -2.437 1.00 12.41 C ATOM 586 CE1 PHE A 36 6.339 -7.992 -3.958 1.00 34.23 C ATOM 587 CE2 PHE A 36 6.634 -5.702 -3.191 1.00 3.43 C ATOM 588 CZ PHE A 36 7.071 -6.799 -3.950 1.00 31.43 C ATOM 0 H PHE A 36 2.271 -8.862 -2.851 1.00 32.40 H new ATOM 0 HA PHE A 36 4.056 -8.904 -0.645 1.00 23.23 H new ATOM 0 HB2 PHE A 36 2.594 -6.803 -2.254 1.00 51.11 H new ATOM 0 HB3 PHE A 36 3.494 -6.350 -0.821 1.00 51.11 H new ATOM 0 HD1 PHE A 36 4.574 -8.994 -3.257 1.00 1.21 H new ATOM 0 HD2 PHE A 36 5.117 -4.964 -1.847 1.00 12.41 H new ATOM 0 HE1 PHE A 36 6.690 -8.839 -4.528 1.00 34.23 H new ATOM 0 HE2 PHE A 36 7.203 -4.784 -3.187 1.00 3.43 H new ATOM 0 HZ PHE A 36 7.978 -6.722 -4.532 1.00 31.43 H new ATOM 598 N GLU A 37 0.920 -8.520 0.095 1.00 11.00 N ATOM 599 CA GLU A 37 -0.064 -8.165 1.114 1.00 42.14 C ATOM 600 C GLU A 37 -0.770 -9.411 1.680 1.00 72.31 C ATOM 601 O GLU A 37 -1.538 -9.280 2.636 1.00 45.02 O ATOM 602 CB GLU A 37 -1.027 -7.116 0.510 1.00 72.11 C ATOM 603 CG GLU A 37 -1.170 -5.837 1.344 1.00 2.43 C ATOM 604 CD GLU A 37 0.117 -5.006 1.532 1.00 44.02 C ATOM 605 OE1 GLU A 37 1.103 -5.195 0.784 1.00 22.12 O ATOM 606 OE2 GLU A 37 0.121 -4.078 2.376 1.00 44.41 O ATOM 0 H GLU A 37 0.512 -8.954 -0.733 1.00 11.00 H new ATOM 0 HA GLU A 37 0.425 -7.716 1.979 1.00 42.14 H new ATOM 0 HB2 GLU A 37 -0.676 -6.849 -0.487 1.00 72.11 H new ATOM 0 HB3 GLU A 37 -2.011 -7.570 0.390 1.00 72.11 H new ATOM 0 HG2 GLU A 37 -1.923 -5.203 0.875 1.00 2.43 H new ATOM 0 HG3 GLU A 37 -1.550 -6.109 2.329 1.00 2.43 H new ATOM 613 N GLU A 38 -0.460 -10.602 1.127 1.00 13.10 N ATOM 614 CA GLU A 38 -1.184 -11.873 1.344 1.00 60.12 C ATOM 615 C GLU A 38 -0.267 -13.093 1.518 1.00 40.43 C ATOM 616 O GLU A 38 -0.588 -14.044 2.237 1.00 23.30 O ATOM 617 CB GLU A 38 -2.026 -12.187 0.088 1.00 4.05 C ATOM 618 CG GLU A 38 -3.031 -11.111 -0.344 1.00 33.15 C ATOM 619 CD GLU A 38 -4.342 -11.284 0.402 1.00 33.22 C ATOM 620 OE1 GLU A 38 -5.014 -12.320 0.149 1.00 34.54 O ATOM 621 OE2 GLU A 38 -4.667 -10.395 1.211 1.00 4.41 O ATOM 0 H GLU A 38 0.332 -10.709 0.493 1.00 13.10 H new ATOM 0 HA GLU A 38 -1.766 -11.725 2.254 1.00 60.12 H new ATOM 0 HB2 GLU A 38 -1.345 -12.372 -0.743 1.00 4.05 H new ATOM 0 HB3 GLU A 38 -2.572 -13.114 0.265 1.00 4.05 H new ATOM 0 HG2 GLU A 38 -2.621 -10.121 -0.147 1.00 33.15 H new ATOM 0 HG3 GLU A 38 -3.205 -11.176 -1.418 1.00 33.15 H new ATOM 628 N VAL A 39 0.862 -13.113 0.806 1.00 74.21 N ATOM 629 CA VAL A 39 1.733 -14.284 0.752 1.00 14.50 C ATOM 630 C VAL A 39 2.993 -13.886 1.500 1.00 22.54 C ATOM 631 O VAL A 39 3.131 -14.146 2.695 1.00 75.52 O ATOM 632 CB VAL A 39 1.925 -14.766 -0.706 1.00 24.10 C ATOM 633 CG1 VAL A 39 2.884 -15.956 -0.837 1.00 24.25 C ATOM 634 CG2 VAL A 39 0.567 -15.157 -1.315 1.00 24.33 C ATOM 0 H VAL A 39 1.195 -12.322 0.255 1.00 74.21 H new ATOM 0 HA VAL A 39 1.314 -15.166 1.236 1.00 14.50 H new ATOM 0 HB VAL A 39 2.370 -13.928 -1.243 1.00 24.10 H new ATOM 0 HG11 VAL A 39 2.970 -16.240 -1.886 1.00 24.25 H new ATOM 0 HG12 VAL A 39 3.866 -15.676 -0.455 1.00 24.25 H new ATOM 0 HG13 VAL A 39 2.498 -16.799 -0.264 1.00 24.25 H new ATOM 0 HG21 VAL A 39 0.712 -15.495 -2.341 1.00 24.33 H new ATOM 0 HG22 VAL A 39 0.123 -15.961 -0.728 1.00 24.33 H new ATOM 0 HG23 VAL A 39 -0.097 -14.293 -1.308 1.00 24.33 H new ATOM 644 N LEU A 40 3.837 -13.129 0.805 1.00 1.32 N ATOM 645 CA LEU A 40 5.071 -12.543 1.292 1.00 34.40 C ATOM 646 C LEU A 40 4.816 -11.650 2.510 1.00 51.14 C ATOM 647 O LEU A 40 5.712 -11.516 3.338 1.00 20.24 O ATOM 648 CB LEU A 40 5.731 -11.754 0.142 1.00 54.43 C ATOM 649 CG LEU A 40 5.938 -12.560 -1.155 1.00 72.51 C ATOM 650 CD1 LEU A 40 6.516 -11.673 -2.261 1.00 75.12 C ATOM 651 CD2 LEU A 40 6.861 -13.762 -0.966 1.00 41.23 C ATOM 0 H LEU A 40 3.662 -12.897 -0.173 1.00 1.32 H new ATOM 0 HA LEU A 40 5.746 -13.334 1.619 1.00 34.40 H new ATOM 0 HB2 LEU A 40 5.116 -10.882 -0.082 1.00 54.43 H new ATOM 0 HB3 LEU A 40 6.698 -11.383 0.482 1.00 54.43 H new ATOM 0 HG LEU A 40 4.951 -12.927 -1.438 1.00 72.51 H new ATOM 0 HD11 LEU A 40 6.653 -12.264 -3.167 1.00 75.12 H new ATOM 0 HD12 LEU A 40 5.829 -10.851 -2.464 1.00 75.12 H new ATOM 0 HD13 LEU A 40 7.477 -11.272 -1.940 1.00 75.12 H new ATOM 0 HD21 LEU A 40 6.969 -14.291 -1.913 1.00 41.23 H new ATOM 0 HD22 LEU A 40 7.839 -13.420 -0.628 1.00 41.23 H new ATOM 0 HD23 LEU A 40 6.435 -14.435 -0.222 1.00 41.23 H new ATOM 663 N HIS A 41 3.622 -11.039 2.616 1.00 72.43 N ATOM 664 CA HIS A 41 3.190 -10.175 3.721 1.00 72.11 C ATOM 665 C HIS A 41 4.313 -9.202 4.104 1.00 40.32 C ATOM 666 O HIS A 41 4.759 -9.128 5.254 1.00 34.34 O ATOM 667 CB HIS A 41 2.613 -10.985 4.897 1.00 14.41 C ATOM 668 CG HIS A 41 1.148 -11.332 4.769 1.00 32.50 C ATOM 669 ND1 HIS A 41 0.093 -10.440 4.782 1.00 64.25 N ATOM 670 CD2 HIS A 41 0.610 -12.589 4.727 1.00 42.13 C ATOM 671 CE1 HIS A 41 -1.049 -11.146 4.771 1.00 64.25 C ATOM 672 NE2 HIS A 41 -0.779 -12.453 4.762 1.00 15.03 N ATOM 0 H HIS A 41 2.903 -11.141 1.900 1.00 72.43 H new ATOM 0 HA HIS A 41 2.355 -9.559 3.387 1.00 72.11 H new ATOM 0 HB2 HIS A 41 3.183 -11.908 4.998 1.00 14.41 H new ATOM 0 HB3 HIS A 41 2.759 -10.418 5.816 1.00 14.41 H new ATOM 0 HD2 HIS A 41 1.160 -13.517 4.676 1.00 42.13 H new ATOM 0 HE1 HIS A 41 -2.041 -10.719 4.770 1.00 64.25 H new ATOM 0 HE2 HIS A 41 -1.461 -13.212 4.778 1.00 15.03 H new ATOM 680 N VAL A 42 4.785 -8.459 3.103 1.00 15.40 N ATOM 681 CA VAL A 42 5.850 -7.478 3.195 1.00 14.21 C ATOM 682 C VAL A 42 5.496 -6.507 4.311 1.00 20.32 C ATOM 683 O VAL A 42 6.291 -6.380 5.232 1.00 43.24 O ATOM 684 CB VAL A 42 6.065 -6.795 1.827 1.00 33.52 C ATOM 685 CG1 VAL A 42 7.156 -5.717 1.880 1.00 34.40 C ATOM 686 CG2 VAL A 42 6.487 -7.839 0.782 1.00 5.45 C ATOM 0 H VAL A 42 4.410 -8.535 2.158 1.00 15.40 H new ATOM 0 HA VAL A 42 6.803 -7.944 3.444 1.00 14.21 H new ATOM 0 HB VAL A 42 5.119 -6.326 1.558 1.00 33.52 H new ATOM 0 HG11 VAL A 42 7.270 -5.266 0.894 1.00 34.40 H new ATOM 0 HG12 VAL A 42 6.874 -4.949 2.600 1.00 34.40 H new ATOM 0 HG13 VAL A 42 8.100 -6.169 2.183 1.00 34.40 H new ATOM 0 HG21 VAL A 42 6.637 -7.350 -0.181 1.00 5.45 H new ATOM 0 HG22 VAL A 42 7.416 -8.314 1.097 1.00 5.45 H new ATOM 0 HG23 VAL A 42 5.707 -8.595 0.688 1.00 5.45 H new ATOM 696 N SER A 43 4.285 -5.941 4.288 1.00 32.54 N ATOM 697 CA SER A 43 3.761 -4.965 5.238 1.00 45.52 C ATOM 698 C SER A 43 4.089 -5.360 6.686 1.00 43.13 C ATOM 699 O SER A 43 4.690 -4.586 7.439 1.00 51.13 O ATOM 700 CB SER A 43 2.246 -4.908 4.969 1.00 54.12 C ATOM 701 OG SER A 43 1.537 -3.951 5.727 1.00 32.41 O ATOM 0 H SER A 43 3.607 -6.168 3.561 1.00 32.54 H new ATOM 0 HA SER A 43 4.216 -3.983 5.109 1.00 45.52 H new ATOM 0 HB2 SER A 43 2.089 -4.699 3.911 1.00 54.12 H new ATOM 0 HB3 SER A 43 1.821 -5.892 5.166 1.00 54.12 H new ATOM 0 HG SER A 43 0.574 -4.090 5.611 1.00 32.41 H new ATOM 707 N ASP A 44 3.738 -6.585 7.074 1.00 74.52 N ATOM 708 CA ASP A 44 3.865 -7.056 8.453 1.00 12.51 C ATOM 709 C ASP A 44 5.320 -7.397 8.794 1.00 0.40 C ATOM 710 O ASP A 44 5.776 -7.211 9.922 1.00 0.20 O ATOM 711 CB ASP A 44 2.952 -8.273 8.651 1.00 1.53 C ATOM 712 CG ASP A 44 2.792 -8.616 10.133 1.00 54.05 C ATOM 713 OD1 ASP A 44 2.393 -7.713 10.905 1.00 5.45 O ATOM 714 OD2 ASP A 44 3.023 -9.790 10.507 1.00 2.32 O ATOM 0 H ASP A 44 3.355 -7.283 6.437 1.00 74.52 H new ATOM 0 HA ASP A 44 3.558 -6.260 9.131 1.00 12.51 H new ATOM 0 HB2 ASP A 44 1.974 -8.070 8.215 1.00 1.53 H new ATOM 0 HB3 ASP A 44 3.366 -9.130 8.120 1.00 1.53 H new ATOM 719 N ASN A 45 6.093 -7.830 7.796 1.00 45.01 N ATOM 720 CA ASN A 45 7.512 -8.114 7.954 1.00 31.33 C ATOM 721 C ASN A 45 8.332 -6.838 8.089 1.00 35.25 C ATOM 722 O ASN A 45 9.284 -6.824 8.869 1.00 34.40 O ATOM 723 CB ASN A 45 8.027 -8.948 6.782 1.00 43.45 C ATOM 724 CG ASN A 45 7.778 -10.423 7.029 1.00 60.23 C ATOM 725 OD1 ASN A 45 8.652 -11.132 7.520 1.00 55.54 O ATOM 726 ND2 ASN A 45 6.608 -10.929 6.667 1.00 52.32 N ATOM 0 H ASN A 45 5.745 -7.993 6.851 1.00 45.01 H new ATOM 0 HA ASN A 45 7.628 -8.684 8.876 1.00 31.33 H new ATOM 0 HB2 ASN A 45 7.531 -8.639 5.862 1.00 43.45 H new ATOM 0 HB3 ASN A 45 9.094 -8.772 6.644 1.00 43.45 H new ATOM 0 HD21 ASN A 45 6.421 -11.924 6.795 1.00 52.32 H new ATOM 0 HD22 ASN A 45 5.894 -10.324 6.261 1.00 52.32 H new ATOM 733 N VAL A 46 7.989 -5.764 7.365 1.00 13.13 N ATOM 734 CA VAL A 46 8.648 -4.480 7.570 1.00 60.21 C ATOM 735 C VAL A 46 8.396 -4.047 9.014 1.00 15.45 C ATOM 736 O VAL A 46 9.350 -3.739 9.723 1.00 31.12 O ATOM 737 CB VAL A 46 8.221 -3.374 6.577 1.00 3.23 C ATOM 738 CG1 VAL A 46 9.359 -2.356 6.471 1.00 72.45 C ATOM 739 CG2 VAL A 46 7.905 -3.808 5.140 1.00 20.41 C ATOM 0 H VAL A 46 7.268 -5.764 6.643 1.00 13.13 H new ATOM 0 HA VAL A 46 9.712 -4.620 7.377 1.00 60.21 H new ATOM 0 HB VAL A 46 7.289 -2.993 6.994 1.00 3.23 H new ATOM 0 HG11 VAL A 46 9.077 -1.567 5.774 1.00 72.45 H new ATOM 0 HG12 VAL A 46 9.552 -1.922 7.452 1.00 72.45 H new ATOM 0 HG13 VAL A 46 10.260 -2.853 6.111 1.00 72.45 H new ATOM 0 HG21 VAL A 46 7.620 -2.936 4.551 1.00 20.41 H new ATOM 0 HG22 VAL A 46 8.787 -4.272 4.698 1.00 20.41 H new ATOM 0 HG23 VAL A 46 7.084 -4.525 5.149 1.00 20.41 H new ATOM 749 N ARG A 47 7.137 -4.073 9.473 1.00 33.34 N ATOM 750 CA ARG A 47 6.736 -3.669 10.820 1.00 11.01 C ATOM 751 C ARG A 47 7.625 -4.282 11.898 1.00 55.54 C ATOM 752 O ARG A 47 8.075 -3.558 12.783 1.00 43.25 O ATOM 753 CB ARG A 47 5.249 -3.997 11.011 1.00 52.45 C ATOM 754 CG ARG A 47 4.758 -3.790 12.447 1.00 52.22 C ATOM 755 CD ARG A 47 3.252 -4.049 12.497 1.00 20.44 C ATOM 756 NE ARG A 47 2.738 -4.027 13.877 1.00 73.24 N ATOM 757 CZ ARG A 47 1.450 -3.869 14.205 1.00 40.24 C ATOM 758 NH1 ARG A 47 0.522 -3.816 13.254 1.00 5.42 N ATOM 759 NH2 ARG A 47 1.089 -3.742 15.482 1.00 0.44 N ATOM 0 H ARG A 47 6.352 -4.384 8.900 1.00 33.34 H new ATOM 0 HA ARG A 47 6.871 -2.593 10.929 1.00 11.01 H new ATOM 0 HB2 ARG A 47 4.658 -3.373 10.340 1.00 52.45 H new ATOM 0 HB3 ARG A 47 5.073 -5.033 10.721 1.00 52.45 H new ATOM 0 HG2 ARG A 47 5.279 -4.466 13.125 1.00 52.22 H new ATOM 0 HG3 ARG A 47 4.977 -2.775 12.778 1.00 52.22 H new ATOM 0 HD2 ARG A 47 2.734 -3.295 11.904 1.00 20.44 H new ATOM 0 HD3 ARG A 47 3.034 -5.016 12.044 1.00 20.44 H new ATOM 0 HE ARG A 47 3.410 -4.140 14.636 1.00 73.24 H new ATOM 0 HH11 ARG A 47 0.791 -3.896 12.273 1.00 5.42 H new ATOM 0 HH12 ARG A 47 -0.459 -3.696 13.505 1.00 5.42 H new ATOM 0 HH21 ARG A 47 1.796 -3.765 16.217 1.00 0.44 H new ATOM 0 HH22 ARG A 47 0.106 -3.622 15.724 1.00 0.44 H new ATOM 773 N GLN A 48 7.923 -5.575 11.812 1.00 5.12 N ATOM 774 CA GLN A 48 8.792 -6.274 12.761 1.00 4.30 C ATOM 775 C GLN A 48 10.257 -5.788 12.802 1.00 40.04 C ATOM 776 O GLN A 48 11.021 -6.269 13.648 1.00 60.32 O ATOM 777 CB GLN A 48 8.728 -7.774 12.483 1.00 22.10 C ATOM 778 CG GLN A 48 7.400 -8.384 12.955 1.00 2.40 C ATOM 779 CD GLN A 48 7.665 -9.570 13.873 1.00 75.31 C ATOM 780 OE1 GLN A 48 7.953 -10.672 13.411 1.00 71.41 O ATOM 781 NE2 GLN A 48 7.662 -9.357 15.176 1.00 11.13 N ATOM 0 H GLN A 48 7.564 -6.178 11.072 1.00 5.12 H new ATOM 0 HA GLN A 48 8.405 -6.039 13.753 1.00 4.30 H new ATOM 0 HB2 GLN A 48 8.850 -7.951 11.415 1.00 22.10 H new ATOM 0 HB3 GLN A 48 9.556 -8.273 12.986 1.00 22.10 H new ATOM 0 HG2 GLN A 48 6.812 -7.632 13.481 1.00 2.40 H new ATOM 0 HG3 GLN A 48 6.812 -8.704 12.095 1.00 2.40 H new ATOM 0 HE21 GLN A 48 7.420 -8.436 15.542 1.00 11.13 H new ATOM 0 HE22 GLN A 48 7.901 -10.113 15.817 1.00 11.13 H new ATOM 790 N LYS A 49 10.654 -4.863 11.922 1.00 52.42 N ATOM 791 CA LYS A 49 11.951 -4.191 11.866 1.00 53.22 C ATOM 792 C LYS A 49 11.838 -2.660 11.930 1.00 4.00 C ATOM 793 O LYS A 49 12.875 -1.996 11.994 1.00 43.44 O ATOM 794 CB LYS A 49 12.657 -4.582 10.553 1.00 32.52 C ATOM 795 CG LYS A 49 13.261 -5.989 10.511 1.00 23.24 C ATOM 796 CD LYS A 49 14.400 -6.146 11.530 1.00 11.55 C ATOM 797 CE LYS A 49 15.384 -7.271 11.195 1.00 60.43 C ATOM 798 NZ LYS A 49 16.231 -6.985 10.012 1.00 1.33 N ATOM 0 H LYS A 49 10.032 -4.544 11.179 1.00 52.42 H new ATOM 0 HA LYS A 49 12.520 -4.511 12.739 1.00 53.22 H new ATOM 0 HB2 LYS A 49 11.940 -4.491 9.737 1.00 32.52 H new ATOM 0 HB3 LYS A 49 13.452 -3.861 10.362 1.00 32.52 H new ATOM 0 HG2 LYS A 49 12.484 -6.725 10.717 1.00 23.24 H new ATOM 0 HG3 LYS A 49 13.638 -6.194 9.509 1.00 23.24 H new ATOM 0 HD2 LYS A 49 14.947 -5.206 11.596 1.00 11.55 H new ATOM 0 HD3 LYS A 49 13.970 -6.334 12.514 1.00 11.55 H new ATOM 0 HE2 LYS A 49 16.027 -7.449 12.057 1.00 60.43 H new ATOM 0 HE3 LYS A 49 14.826 -8.190 11.018 1.00 60.43 H new ATOM 0 HZ1 LYS A 49 16.929 -7.747 9.893 1.00 1.33 H new ATOM 0 HZ2 LYS A 49 15.633 -6.927 9.163 1.00 1.33 H new ATOM 0 HZ3 LYS A 49 16.726 -6.081 10.150 1.00 1.33 H new ATOM 812 N LEU A 50 10.642 -2.070 11.820 1.00 2.11 N ATOM 813 CA LEU A 50 10.532 -0.640 11.509 1.00 21.42 C ATOM 814 C LEU A 50 10.920 0.248 12.702 1.00 44.53 C ATOM 815 O LEU A 50 10.588 -0.106 13.841 1.00 22.41 O ATOM 816 CB LEU A 50 9.117 -0.256 11.037 1.00 44.05 C ATOM 817 CG LEU A 50 8.919 -0.411 9.516 1.00 11.00 C ATOM 818 CD1 LEU A 50 7.460 -0.260 9.072 1.00 21.41 C ATOM 819 CD2 LEU A 50 9.760 0.540 8.654 1.00 11.14 C ATOM 0 H LEU A 50 9.750 -2.551 11.939 1.00 2.11 H new ATOM 0 HA LEU A 50 11.237 -0.464 10.696 1.00 21.42 H new ATOM 0 HB2 LEU A 50 8.387 -0.877 11.557 1.00 44.05 H new ATOM 0 HB3 LEU A 50 8.915 0.777 11.319 1.00 44.05 H new ATOM 0 HG LEU A 50 9.262 -1.432 9.348 1.00 11.00 H new ATOM 0 HD11 LEU A 50 7.394 -0.381 7.991 1.00 21.41 H new ATOM 0 HD12 LEU A 50 6.851 -1.021 9.560 1.00 21.41 H new ATOM 0 HD13 LEU A 50 7.096 0.729 9.349 1.00 21.41 H new ATOM 0 HD21 LEU A 50 9.552 0.356 7.600 1.00 11.14 H new ATOM 0 HD22 LEU A 50 9.508 1.572 8.898 1.00 11.14 H new ATOM 0 HD23 LEU A 50 10.818 0.369 8.850 1.00 11.14 H new ATOM 831 N PRO A 51 11.542 1.417 12.434 1.00 4.03 N ATOM 832 CA PRO A 51 11.888 2.417 13.437 1.00 60.31 C ATOM 833 C PRO A 51 10.683 3.251 13.865 1.00 34.13 C ATOM 834 O PRO A 51 9.719 3.428 13.111 1.00 51.45 O ATOM 835 CB PRO A 51 12.913 3.329 12.754 1.00 11.52 C ATOM 836 CG PRO A 51 12.545 3.264 11.279 1.00 3.51 C ATOM 837 CD PRO A 51 11.980 1.861 11.116 1.00 63.13 C ATOM 0 HA PRO A 51 12.266 1.936 14.339 1.00 60.31 H new ATOM 0 HB2 PRO A 51 12.855 4.349 13.135 1.00 11.52 H new ATOM 0 HB3 PRO A 51 13.932 2.982 12.926 1.00 11.52 H new ATOM 0 HG2 PRO A 51 11.811 4.025 11.014 1.00 3.51 H new ATOM 0 HG3 PRO A 51 13.414 3.423 10.641 1.00 3.51 H new ATOM 0 HD2 PRO A 51 11.147 1.861 10.413 1.00 63.13 H new ATOM 0 HD3 PRO A 51 12.736 1.186 10.714 1.00 63.13 H new ATOM 845 N GLU A 52 10.804 3.889 15.031 1.00 53.11 N ATOM 846 CA GLU A 52 9.798 4.730 15.669 1.00 12.21 C ATOM 847 C GLU A 52 9.701 6.120 15.024 1.00 43.13 C ATOM 848 O GLU A 52 9.663 7.144 15.713 1.00 3.25 O ATOM 849 CB GLU A 52 10.052 4.810 17.183 1.00 62.13 C ATOM 850 CG GLU A 52 11.404 5.407 17.621 1.00 34.31 C ATOM 851 CD GLU A 52 12.396 4.311 18.006 1.00 33.41 C ATOM 852 OE1 GLU A 52 12.929 3.655 17.078 1.00 2.51 O ATOM 853 OE2 GLU A 52 12.597 4.083 19.221 1.00 3.50 O ATOM 0 H GLU A 52 11.658 3.827 15.585 1.00 53.11 H new ATOM 0 HA GLU A 52 8.826 4.263 15.513 1.00 12.21 H new ATOM 0 HB2 GLU A 52 9.255 5.403 17.632 1.00 62.13 H new ATOM 0 HB3 GLU A 52 9.973 3.804 17.596 1.00 62.13 H new ATOM 0 HG2 GLU A 52 11.818 6.007 16.811 1.00 34.31 H new ATOM 0 HG3 GLU A 52 11.251 6.076 18.468 1.00 34.31 H new ATOM 860 N GLY A 53 9.679 6.163 13.697 1.00 2.43 N ATOM 861 CA GLY A 53 9.492 7.364 12.897 1.00 25.22 C ATOM 862 C GLY A 53 8.930 7.087 11.503 1.00 73.31 C ATOM 863 O GLY A 53 8.609 8.036 10.789 1.00 64.15 O ATOM 0 H GLY A 53 9.796 5.326 13.127 1.00 2.43 H new ATOM 0 HA2 GLY A 53 8.819 8.040 13.424 1.00 25.22 H new ATOM 0 HA3 GLY A 53 10.448 7.878 12.799 1.00 25.22 H new ATOM 867 N THR A 54 8.789 5.823 11.089 1.00 54.43 N ATOM 868 CA THR A 54 8.144 5.494 9.818 1.00 73.21 C ATOM 869 C THR A 54 6.719 6.069 9.726 1.00 52.54 C ATOM 870 O THR A 54 6.378 6.643 8.692 1.00 63.33 O ATOM 871 CB THR A 54 8.190 3.968 9.630 1.00 74.15 C ATOM 872 OG1 THR A 54 7.732 3.537 8.362 1.00 21.32 O ATOM 873 CG2 THR A 54 7.354 3.240 10.685 1.00 72.42 C ATOM 0 H THR A 54 9.114 5.013 11.617 1.00 54.43 H new ATOM 0 HA THR A 54 8.687 5.964 8.998 1.00 73.21 H new ATOM 0 HB THR A 54 9.247 3.719 9.729 1.00 74.15 H new ATOM 0 HG1 THR A 54 7.199 2.721 8.467 1.00 21.32 H new ATOM 0 HG21 THR A 54 7.413 2.165 10.517 1.00 72.42 H new ATOM 0 HG22 THR A 54 7.738 3.474 11.678 1.00 72.42 H new ATOM 0 HG23 THR A 54 6.315 3.562 10.612 1.00 72.42 H new ATOM 881 N LYS A 55 5.910 5.963 10.796 1.00 23.44 N ATOM 882 CA LYS A 55 4.460 6.161 10.809 1.00 24.33 C ATOM 883 C LYS A 55 3.818 5.452 9.610 1.00 54.35 C ATOM 884 O LYS A 55 3.664 5.983 8.508 1.00 31.41 O ATOM 885 CB LYS A 55 4.143 7.641 10.867 1.00 33.45 C ATOM 886 CG LYS A 55 2.664 7.982 11.044 1.00 53.13 C ATOM 887 CD LYS A 55 2.226 8.024 12.508 1.00 73.22 C ATOM 888 CE LYS A 55 0.768 8.487 12.525 1.00 42.12 C ATOM 889 NZ LYS A 55 0.340 8.928 13.864 1.00 35.25 N ATOM 0 H LYS A 55 6.274 5.725 11.718 1.00 23.44 H new ATOM 0 HA LYS A 55 4.029 5.710 11.703 1.00 24.33 H new ATOM 0 HB2 LYS A 55 4.703 8.084 11.690 1.00 33.45 H new ATOM 0 HB3 LYS A 55 4.500 8.109 9.950 1.00 33.45 H new ATOM 0 HG2 LYS A 55 2.463 8.949 10.584 1.00 53.13 H new ATOM 0 HG3 LYS A 55 2.062 7.245 10.512 1.00 53.13 H new ATOM 0 HD2 LYS A 55 2.324 7.041 12.968 1.00 73.22 H new ATOM 0 HD3 LYS A 55 2.854 8.707 13.079 1.00 73.22 H new ATOM 0 HE2 LYS A 55 0.640 9.306 11.817 1.00 42.12 H new ATOM 0 HE3 LYS A 55 0.126 7.672 12.190 1.00 42.12 H new ATOM 0 HZ1 LYS A 55 -0.654 9.233 13.828 1.00 35.25 H new ATOM 0 HZ2 LYS A 55 0.437 8.140 14.536 1.00 35.25 H new ATOM 0 HZ3 LYS A 55 0.935 9.723 14.174 1.00 35.25 H new ATOM 903 N MET A 56 3.449 4.213 9.867 1.00 15.53 N ATOM 904 CA MET A 56 2.900 3.240 8.928 1.00 60.21 C ATOM 905 C MET A 56 1.623 3.814 8.307 1.00 43.42 C ATOM 906 O MET A 56 0.593 3.914 8.978 1.00 15.02 O ATOM 907 CB MET A 56 2.650 1.888 9.638 1.00 71.31 C ATOM 908 CG MET A 56 3.386 0.698 9.063 1.00 42.02 C ATOM 909 SD MET A 56 4.052 -0.523 10.235 1.00 73.21 S ATOM 910 CE MET A 56 5.044 0.537 11.306 1.00 23.30 C ATOM 0 H MET A 56 3.529 3.826 10.807 1.00 15.53 H new ATOM 0 HA MET A 56 3.613 3.047 8.126 1.00 60.21 H new ATOM 0 HB2 MET A 56 2.929 1.992 10.686 1.00 71.31 H new ATOM 0 HB3 MET A 56 1.581 1.678 9.612 1.00 71.31 H new ATOM 0 HG2 MET A 56 2.709 0.179 8.385 1.00 42.02 H new ATOM 0 HG3 MET A 56 4.214 1.073 8.461 1.00 42.02 H new ATOM 0 HE1 MET A 56 6.013 0.070 11.483 1.00 23.30 H new ATOM 0 HE2 MET A 56 5.190 1.505 10.826 1.00 23.30 H new ATOM 0 HE3 MET A 56 4.530 0.677 12.257 1.00 23.30 H new ATOM 920 N THR A 57 1.696 4.241 7.046 1.00 71.33 N ATOM 921 CA THR A 57 0.636 4.952 6.344 1.00 32.21 C ATOM 922 C THR A 57 0.655 4.470 4.891 1.00 43.23 C ATOM 923 O THR A 57 1.641 4.681 4.191 1.00 71.54 O ATOM 924 CB THR A 57 0.863 6.475 6.458 1.00 72.13 C ATOM 925 OG1 THR A 57 1.175 6.854 7.789 1.00 20.14 O ATOM 926 CG2 THR A 57 -0.386 7.250 6.038 1.00 13.40 C ATOM 0 H THR A 57 2.524 4.095 6.469 1.00 71.33 H new ATOM 0 HA THR A 57 -0.343 4.750 6.778 1.00 32.21 H new ATOM 0 HB THR A 57 1.697 6.713 5.797 1.00 72.13 H new ATOM 0 HG1 THR A 57 2.063 6.515 8.026 1.00 20.14 H new ATOM 0 HG21 THR A 57 -0.198 8.320 6.128 1.00 13.40 H new ATOM 0 HG22 THR A 57 -0.632 7.011 5.003 1.00 13.40 H new ATOM 0 HG23 THR A 57 -1.220 6.973 6.683 1.00 13.40 H new ATOM 934 N LYS A 58 -0.404 3.801 4.429 1.00 24.24 N ATOM 935 CA LYS A 58 -0.545 3.301 3.064 1.00 24.22 C ATOM 936 C LYS A 58 -1.840 3.855 2.478 1.00 60.21 C ATOM 937 O LYS A 58 -2.858 3.899 3.170 1.00 13.10 O ATOM 938 CB LYS A 58 -0.437 1.756 2.990 1.00 51.24 C ATOM 939 CG LYS A 58 -1.360 0.899 3.869 1.00 61.11 C ATOM 940 CD LYS A 58 -0.681 0.026 4.949 1.00 51.44 C ATOM 941 CE LYS A 58 -0.018 -1.278 4.456 1.00 3.03 C ATOM 942 NZ LYS A 58 -0.939 -2.426 4.243 1.00 13.04 N ATOM 0 H LYS A 58 -1.211 3.587 5.015 1.00 24.24 H new ATOM 0 HA LYS A 58 0.285 3.655 2.453 1.00 24.22 H new ATOM 0 HB2 LYS A 58 -0.607 1.464 1.954 1.00 51.24 H new ATOM 0 HB3 LYS A 58 0.591 1.487 3.233 1.00 51.24 H new ATOM 0 HG2 LYS A 58 -2.069 1.562 4.365 1.00 61.11 H new ATOM 0 HG3 LYS A 58 -1.938 0.244 3.217 1.00 61.11 H new ATOM 0 HD2 LYS A 58 0.078 0.628 5.449 1.00 51.44 H new ATOM 0 HD3 LYS A 58 -1.428 -0.232 5.700 1.00 51.44 H new ATOM 0 HE2 LYS A 58 0.498 -1.070 3.519 1.00 3.03 H new ATOM 0 HE3 LYS A 58 0.742 -1.574 5.179 1.00 3.03 H new ATOM 0 HZ1 LYS A 58 -0.463 -3.151 3.668 1.00 13.04 H new ATOM 0 HZ2 LYS A 58 -1.205 -2.833 5.162 1.00 13.04 H new ATOM 0 HZ3 LYS A 58 -1.794 -2.098 3.749 1.00 13.04 H new ATOM 956 N TYR A 59 -1.817 4.295 1.224 1.00 24.34 N ATOM 957 CA TYR A 59 -2.973 4.742 0.451 1.00 2.52 C ATOM 958 C TYR A 59 -3.340 3.647 -0.569 1.00 13.20 C ATOM 959 O TYR A 59 -2.770 2.551 -0.532 1.00 54.11 O ATOM 960 CB TYR A 59 -2.645 6.087 -0.215 1.00 73.43 C ATOM 961 CG TYR A 59 -2.541 7.348 0.643 1.00 20.40 C ATOM 962 CD1 TYR A 59 -3.008 7.437 1.975 1.00 11.11 C ATOM 963 CD2 TYR A 59 -2.043 8.507 0.023 1.00 64.32 C ATOM 964 CE1 TYR A 59 -2.961 8.670 2.661 1.00 52.23 C ATOM 965 CE2 TYR A 59 -1.984 9.731 0.699 1.00 51.25 C ATOM 966 CZ TYR A 59 -2.445 9.825 2.027 1.00 0.10 C ATOM 967 OH TYR A 59 -2.387 11.020 2.682 1.00 13.12 O ATOM 0 H TYR A 59 -0.949 4.353 0.692 1.00 24.34 H new ATOM 0 HA TYR A 59 -3.840 4.902 1.092 1.00 2.52 H new ATOM 0 HB2 TYR A 59 -1.696 5.969 -0.738 1.00 73.43 H new ATOM 0 HB3 TYR A 59 -3.406 6.270 -0.973 1.00 73.43 H new ATOM 0 HD1 TYR A 59 -3.401 6.560 2.468 1.00 11.11 H new ATOM 0 HD2 TYR A 59 -1.698 8.452 -0.999 1.00 64.32 H new ATOM 0 HE1 TYR A 59 -3.322 8.732 3.677 1.00 52.23 H new ATOM 0 HE2 TYR A 59 -1.585 10.603 0.203 1.00 51.25 H new ATOM 0 HH TYR A 59 -2.003 11.699 2.090 1.00 13.12 H new ATOM 977 N HIS A 60 -4.314 3.903 -1.451 1.00 43.03 N ATOM 978 CA HIS A 60 -4.807 2.961 -2.456 1.00 11.13 C ATOM 979 C HIS A 60 -5.056 3.748 -3.748 1.00 44.13 C ATOM 980 O HIS A 60 -5.648 4.831 -3.683 1.00 63.33 O ATOM 981 CB HIS A 60 -6.111 2.327 -1.951 1.00 1.01 C ATOM 982 CG HIS A 60 -6.365 0.922 -2.434 1.00 2.54 C ATOM 983 ND1 HIS A 60 -6.095 -0.233 -1.735 1.00 14.50 N ATOM 984 CD2 HIS A 60 -7.013 0.568 -3.582 1.00 33.34 C ATOM 985 CE1 HIS A 60 -6.619 -1.258 -2.419 1.00 2.01 C ATOM 986 NE2 HIS A 60 -7.195 -0.822 -3.558 1.00 20.30 N ATOM 0 H HIS A 60 -4.795 4.802 -1.483 1.00 43.03 H new ATOM 0 HA HIS A 60 -4.086 2.165 -2.641 1.00 11.13 H new ATOM 0 HB2 HIS A 60 -6.097 2.324 -0.861 1.00 1.01 H new ATOM 0 HB3 HIS A 60 -6.946 2.957 -2.257 1.00 1.01 H new ATOM 0 HD1 HIS A 60 -5.586 -0.297 -0.853 1.00 14.50 H new ATOM 0 HD2 HIS A 60 -7.329 1.238 -4.368 1.00 33.34 H new ATOM 0 HE1 HIS A 60 -6.585 -2.290 -2.103 1.00 2.01 H new ATOM 994 N VAL A 61 -4.606 3.256 -4.905 1.00 42.42 N ATOM 995 CA VAL A 61 -4.669 4.015 -6.161 1.00 1.34 C ATOM 996 C VAL A 61 -6.019 3.845 -6.877 1.00 12.31 C ATOM 997 O VAL A 61 -6.821 2.967 -6.538 1.00 41.44 O ATOM 998 CB VAL A 61 -3.479 3.679 -7.088 1.00 71.55 C ATOM 999 CG1 VAL A 61 -2.128 3.895 -6.412 1.00 54.21 C ATOM 1000 CG2 VAL A 61 -3.470 2.244 -7.616 1.00 74.51 C ATOM 0 H VAL A 61 -4.191 2.329 -5.000 1.00 42.42 H new ATOM 0 HA VAL A 61 -4.588 5.070 -5.898 1.00 1.34 H new ATOM 0 HB VAL A 61 -3.623 4.369 -7.919 1.00 71.55 H new ATOM 0 HG11 VAL A 61 -1.328 3.644 -7.109 1.00 54.21 H new ATOM 0 HG12 VAL A 61 -2.034 4.939 -6.113 1.00 54.21 H new ATOM 0 HG13 VAL A 61 -2.056 3.257 -5.531 1.00 54.21 H new ATOM 0 HG21 VAL A 61 -2.601 2.098 -8.257 1.00 74.51 H new ATOM 0 HG22 VAL A 61 -3.424 1.548 -6.778 1.00 74.51 H new ATOM 0 HG23 VAL A 61 -4.379 2.062 -8.190 1.00 74.51 H new ATOM 1010 N GLU A 62 -6.239 4.644 -7.924 1.00 73.12 N ATOM 1011 CA GLU A 62 -7.447 4.698 -8.750 1.00 34.41 C ATOM 1012 C GLU A 62 -7.153 4.454 -10.246 1.00 62.33 C ATOM 1013 O GLU A 62 -8.075 4.444 -11.068 1.00 43.41 O ATOM 1014 CB GLU A 62 -8.228 6.010 -8.493 1.00 1.01 C ATOM 1015 CG GLU A 62 -7.419 7.238 -8.035 1.00 60.31 C ATOM 1016 CD GLU A 62 -6.414 7.704 -9.084 1.00 51.12 C ATOM 1017 OE1 GLU A 62 -5.358 7.054 -9.257 1.00 62.11 O ATOM 1018 OE2 GLU A 62 -6.698 8.729 -9.748 1.00 4.00 O ATOM 0 H GLU A 62 -5.534 5.312 -8.237 1.00 73.12 H new ATOM 0 HA GLU A 62 -8.093 3.873 -8.448 1.00 34.41 H new ATOM 0 HB2 GLU A 62 -8.752 6.275 -9.411 1.00 1.01 H new ATOM 0 HB3 GLU A 62 -8.988 5.807 -7.739 1.00 1.01 H new ATOM 0 HG2 GLU A 62 -8.104 8.054 -7.806 1.00 60.31 H new ATOM 0 HG3 GLU A 62 -6.890 6.997 -7.113 1.00 60.31 H new ATOM 1025 N PHE A 63 -5.887 4.214 -10.610 1.00 34.22 N ATOM 1026 CA PHE A 63 -5.463 3.942 -11.982 1.00 52.12 C ATOM 1027 C PHE A 63 -5.911 2.563 -12.475 1.00 1.13 C ATOM 1028 O PHE A 63 -6.142 2.373 -13.671 1.00 31.41 O ATOM 1029 CB PHE A 63 -3.931 4.022 -12.056 1.00 33.35 C ATOM 1030 CG PHE A 63 -3.376 3.961 -13.463 1.00 51.21 C ATOM 1031 CD1 PHE A 63 -3.286 5.148 -14.212 1.00 23.42 C ATOM 1032 CD2 PHE A 63 -3.001 2.733 -14.045 1.00 22.34 C ATOM 1033 CE1 PHE A 63 -2.839 5.105 -15.541 1.00 4.11 C ATOM 1034 CE2 PHE A 63 -2.574 2.695 -15.386 1.00 33.31 C ATOM 1035 CZ PHE A 63 -2.489 3.881 -16.133 1.00 41.52 C ATOM 0 H PHE A 63 -5.116 4.204 -9.942 1.00 34.22 H new ATOM 0 HA PHE A 63 -5.931 4.689 -12.623 1.00 52.12 H new ATOM 0 HB2 PHE A 63 -3.603 4.950 -11.588 1.00 33.35 H new ATOM 0 HB3 PHE A 63 -3.507 3.204 -11.474 1.00 33.35 H new ATOM 0 HD1 PHE A 63 -3.561 6.092 -13.764 1.00 23.42 H new ATOM 0 HD2 PHE A 63 -3.041 1.824 -13.464 1.00 22.34 H new ATOM 0 HE1 PHE A 63 -2.764 6.019 -16.112 1.00 4.11 H new ATOM 0 HE2 PHE A 63 -2.311 1.752 -15.841 1.00 33.31 H new ATOM 0 HZ PHE A 63 -2.155 3.852 -17.160 1.00 41.52 H new ATOM 1045 N LEU A 64 -5.954 1.566 -11.588 1.00 71.21 N ATOM 1046 CA LEU A 64 -6.181 0.177 -11.961 1.00 71.21 C ATOM 1047 C LEU A 64 -7.672 -0.100 -11.890 1.00 40.23 C ATOM 1048 O LEU A 64 -8.296 0.083 -10.841 1.00 73.54 O ATOM 1049 CB LEU A 64 -5.407 -0.787 -11.045 1.00 60.43 C ATOM 1050 CG LEU A 64 -3.880 -0.655 -11.209 1.00 60.33 C ATOM 1051 CD1 LEU A 64 -3.178 -0.676 -9.859 1.00 71.53 C ATOM 1052 CD2 LEU A 64 -3.279 -1.780 -12.050 1.00 22.12 C ATOM 0 H LEU A 64 -5.831 1.706 -10.585 1.00 71.21 H new ATOM 0 HA LEU A 64 -5.816 0.013 -12.975 1.00 71.21 H new ATOM 0 HB2 LEU A 64 -5.676 -0.592 -10.007 1.00 60.43 H new ATOM 0 HB3 LEU A 64 -5.706 -1.812 -11.265 1.00 60.43 H new ATOM 0 HG LEU A 64 -3.725 0.298 -11.714 1.00 60.33 H new ATOM 0 HD11 LEU A 64 -2.102 -0.581 -10.007 1.00 71.53 H new ATOM 0 HD12 LEU A 64 -3.535 0.155 -9.250 1.00 71.53 H new ATOM 0 HD13 LEU A 64 -3.393 -1.616 -9.352 1.00 71.53 H new ATOM 0 HD21 LEU A 64 -2.202 -1.637 -12.133 1.00 22.12 H new ATOM 0 HD22 LEU A 64 -3.482 -2.739 -11.573 1.00 22.12 H new ATOM 0 HD23 LEU A 64 -3.724 -1.768 -13.045 1.00 22.12 H new ATOM 1064 N GLY A 65 -8.208 -0.614 -12.992 1.00 1.21 N ATOM 1065 CA GLY A 65 -9.547 -1.159 -13.044 1.00 34.14 C ATOM 1066 C GLY A 65 -10.624 -0.078 -13.152 1.00 61.33 C ATOM 1067 O GLY A 65 -10.365 1.117 -12.999 1.00 52.24 O ATOM 0 H GLY A 65 -7.713 -0.661 -13.882 1.00 1.21 H new ATOM 0 HA2 GLY A 65 -9.627 -1.832 -13.898 1.00 34.14 H new ATOM 0 HA3 GLY A 65 -9.726 -1.756 -12.150 1.00 34.14 H new ATOM 1071 N PRO A 66 -11.855 -0.497 -13.463 1.00 13.25 N ATOM 1072 CA PRO A 66 -13.003 0.379 -13.633 1.00 61.13 C ATOM 1073 C PRO A 66 -13.363 1.018 -12.293 1.00 3.24 C ATOM 1074 O PRO A 66 -13.480 2.239 -12.197 1.00 15.31 O ATOM 1075 CB PRO A 66 -14.110 -0.527 -14.183 1.00 65.32 C ATOM 1076 CG PRO A 66 -13.729 -1.928 -13.696 1.00 31.23 C ATOM 1077 CD PRO A 66 -12.209 -1.881 -13.691 1.00 2.50 C ATOM 0 HA PRO A 66 -12.822 1.210 -14.314 1.00 61.13 H new ATOM 0 HB2 PRO A 66 -15.090 -0.229 -13.810 1.00 65.32 H new ATOM 0 HB3 PRO A 66 -14.156 -0.483 -15.271 1.00 65.32 H new ATOM 0 HG2 PRO A 66 -14.131 -2.134 -12.704 1.00 31.23 H new ATOM 0 HG3 PRO A 66 -14.108 -2.704 -14.361 1.00 31.23 H new ATOM 0 HD2 PRO A 66 -11.801 -2.522 -12.910 1.00 2.50 H new ATOM 0 HD3 PRO A 66 -11.804 -2.237 -14.639 1.00 2.50 H new ATOM 1085 N LEU A 67 -13.447 0.190 -11.248 1.00 73.52 N ATOM 1086 CA LEU A 67 -13.729 0.545 -9.863 1.00 12.51 C ATOM 1087 C LEU A 67 -12.546 1.236 -9.183 1.00 40.12 C ATOM 1088 O LEU A 67 -12.548 1.325 -7.960 1.00 71.34 O ATOM 1089 CB LEU A 67 -14.132 -0.717 -9.070 1.00 11.50 C ATOM 1090 CG LEU A 67 -15.370 -1.453 -9.606 1.00 71.22 C ATOM 1091 CD1 LEU A 67 -15.689 -2.655 -8.714 1.00 24.53 C ATOM 1092 CD2 LEU A 67 -16.598 -0.539 -9.674 1.00 0.12 C ATOM 0 H LEU A 67 -13.310 -0.814 -11.360 1.00 73.52 H new ATOM 0 HA LEU A 67 -14.554 1.257 -9.872 1.00 12.51 H new ATOM 0 HB2 LEU A 67 -13.290 -1.409 -9.065 1.00 11.50 H new ATOM 0 HB3 LEU A 67 -14.317 -0.433 -8.034 1.00 11.50 H new ATOM 0 HG LEU A 67 -15.137 -1.784 -10.618 1.00 71.22 H new ATOM 0 HD11 LEU A 67 -16.568 -3.172 -9.100 1.00 24.53 H new ATOM 0 HD12 LEU A 67 -14.840 -3.338 -8.707 1.00 24.53 H new ATOM 0 HD13 LEU A 67 -15.887 -2.312 -7.698 1.00 24.53 H new ATOM 0 HD21 LEU A 67 -17.449 -1.101 -10.058 1.00 0.12 H new ATOM 0 HD22 LEU A 67 -16.830 -0.166 -8.676 1.00 0.12 H new ATOM 0 HD23 LEU A 67 -16.390 0.302 -10.336 1.00 0.12 H new ATOM 1104 N GLY A 68 -11.529 1.693 -9.921 1.00 24.14 N ATOM 1105 CA GLY A 68 -10.375 2.370 -9.351 1.00 41.44 C ATOM 1106 C GLY A 68 -10.791 3.502 -8.411 1.00 55.03 C ATOM 1107 O GLY A 68 -10.286 3.583 -7.295 1.00 54.54 O ATOM 0 H GLY A 68 -11.490 1.600 -10.936 1.00 24.14 H new ATOM 0 HA2 GLY A 68 -9.763 1.651 -8.806 1.00 41.44 H new ATOM 0 HA3 GLY A 68 -9.756 2.772 -10.153 1.00 41.44 H new ATOM 1111 N LYS A 69 -11.732 4.357 -8.823 1.00 63.45 N ATOM 1112 CA LYS A 69 -12.165 5.466 -7.978 1.00 65.33 C ATOM 1113 C LYS A 69 -12.991 4.973 -6.790 1.00 63.12 C ATOM 1114 O LYS A 69 -12.848 5.520 -5.694 1.00 23.12 O ATOM 1115 CB LYS A 69 -12.886 6.506 -8.848 1.00 75.31 C ATOM 1116 CG LYS A 69 -13.300 7.798 -8.135 1.00 3.31 C ATOM 1117 CD LYS A 69 -12.162 8.442 -7.327 1.00 65.22 C ATOM 1118 CE LYS A 69 -12.270 9.963 -7.199 1.00 61.45 C ATOM 1119 NZ LYS A 69 -13.632 10.460 -6.928 1.00 12.30 N ATOM 0 H LYS A 69 -12.202 4.301 -9.727 1.00 63.45 H new ATOM 0 HA LYS A 69 -11.300 5.957 -7.532 1.00 65.33 H new ATOM 0 HB2 LYS A 69 -12.237 6.766 -9.684 1.00 75.31 H new ATOM 0 HB3 LYS A 69 -13.778 6.044 -9.270 1.00 75.31 H new ATOM 0 HG2 LYS A 69 -13.660 8.513 -8.875 1.00 3.31 H new ATOM 0 HG3 LYS A 69 -14.134 7.584 -7.467 1.00 3.31 H new ATOM 0 HD2 LYS A 69 -12.147 8.004 -6.329 1.00 65.22 H new ATOM 0 HD3 LYS A 69 -11.211 8.194 -7.798 1.00 65.22 H new ATOM 0 HE2 LYS A 69 -11.610 10.295 -6.398 1.00 61.45 H new ATOM 0 HE3 LYS A 69 -11.907 10.419 -8.120 1.00 61.45 H new ATOM 0 HZ1 LYS A 69 -13.597 11.482 -6.739 1.00 12.30 H new ATOM 0 HZ2 LYS A 69 -14.238 10.281 -7.754 1.00 12.30 H new ATOM 0 HZ3 LYS A 69 -14.023 9.968 -6.099 1.00 12.30 H new ATOM 1133 N ASP A 70 -13.820 3.938 -6.972 1.00 72.12 N ATOM 1134 CA ASP A 70 -14.565 3.357 -5.856 1.00 13.55 C ATOM 1135 C ASP A 70 -13.601 2.751 -4.837 1.00 33.50 C ATOM 1136 O ASP A 70 -13.883 2.801 -3.639 1.00 54.14 O ATOM 1137 CB ASP A 70 -15.570 2.297 -6.323 1.00 44.03 C ATOM 1138 CG ASP A 70 -16.608 2.877 -7.277 1.00 40.23 C ATOM 1139 OD1 ASP A 70 -17.393 3.774 -6.899 1.00 12.13 O ATOM 1140 OD2 ASP A 70 -16.614 2.478 -8.464 1.00 40.02 O ATOM 0 H ASP A 70 -13.989 3.491 -7.873 1.00 72.12 H new ATOM 0 HA ASP A 70 -15.131 4.163 -5.388 1.00 13.55 H new ATOM 0 HB2 ASP A 70 -15.037 1.485 -6.817 1.00 44.03 H new ATOM 0 HB3 ASP A 70 -16.073 1.868 -5.457 1.00 44.03 H new ATOM 1145 N LEU A 71 -12.461 2.202 -5.278 1.00 51.14 N ATOM 1146 CA LEU A 71 -11.449 1.682 -4.375 1.00 40.34 C ATOM 1147 C LEU A 71 -10.862 2.743 -3.469 1.00 31.10 C ATOM 1148 O LEU A 71 -10.773 2.501 -2.262 1.00 0.10 O ATOM 1149 CB LEU A 71 -10.292 1.015 -5.125 1.00 0.03 C ATOM 1150 CG LEU A 71 -10.531 -0.426 -5.544 1.00 51.14 C ATOM 1151 CD1 LEU A 71 -9.274 -1.002 -6.224 1.00 40.45 C ATOM 1152 CD2 LEU A 71 -10.917 -1.205 -4.287 1.00 23.30 C ATOM 0 H LEU A 71 -12.224 2.110 -6.266 1.00 51.14 H new ATOM 0 HA LEU A 71 -11.977 0.945 -3.769 1.00 40.34 H new ATOM 0 HB2 LEU A 71 -10.072 1.603 -6.016 1.00 0.03 H new ATOM 0 HB3 LEU A 71 -9.404 1.049 -4.493 1.00 0.03 H new ATOM 0 HG LEU A 71 -11.335 -0.498 -6.277 1.00 51.14 H new ATOM 0 HD11 LEU A 71 -9.461 -2.035 -6.518 1.00 40.45 H new ATOM 0 HD12 LEU A 71 -9.035 -0.410 -7.108 1.00 40.45 H new ATOM 0 HD13 LEU A 71 -8.436 -0.969 -5.528 1.00 40.45 H new ATOM 0 HD21 LEU A 71 -11.098 -2.248 -4.547 1.00 23.30 H new ATOM 0 HD22 LEU A 71 -10.107 -1.147 -3.560 1.00 23.30 H new ATOM 0 HD23 LEU A 71 -11.822 -0.776 -3.857 1.00 23.30 H new ATOM 1164 N THR A 72 -10.435 3.878 -4.018 1.00 33.31 N ATOM 1165 CA THR A 72 -9.930 4.965 -3.198 1.00 13.13 C ATOM 1166 C THR A 72 -11.031 5.351 -2.201 1.00 12.32 C ATOM 1167 O THR A 72 -10.757 5.439 -1.005 1.00 1.02 O ATOM 1168 CB THR A 72 -9.492 6.129 -4.103 1.00 32.13 C ATOM 1169 OG1 THR A 72 -8.724 5.639 -5.180 1.00 14.40 O ATOM 1170 CG2 THR A 72 -8.650 7.169 -3.365 1.00 15.00 C ATOM 0 H THR A 72 -10.430 4.064 -5.021 1.00 33.31 H new ATOM 0 HA THR A 72 -9.048 4.671 -2.629 1.00 13.13 H new ATOM 0 HB THR A 72 -10.408 6.607 -4.451 1.00 32.13 H new ATOM 0 HG1 THR A 72 -7.978 6.250 -5.355 1.00 14.40 H new ATOM 0 HG21 THR A 72 -8.370 7.966 -4.054 1.00 15.00 H new ATOM 0 HG22 THR A 72 -9.229 7.588 -2.541 1.00 15.00 H new ATOM 0 HG23 THR A 72 -7.750 6.696 -2.972 1.00 15.00 H new ATOM 1178 N GLN A 73 -12.293 5.486 -2.639 1.00 22.30 N ATOM 1179 CA GLN A 73 -13.396 5.818 -1.744 1.00 62.11 C ATOM 1180 C GLN A 73 -13.506 4.779 -0.615 1.00 33.34 C ATOM 1181 O GLN A 73 -13.565 5.168 0.549 1.00 34.31 O ATOM 1182 CB GLN A 73 -14.691 6.056 -2.553 1.00 21.40 C ATOM 1183 CG GLN A 73 -15.786 6.744 -1.714 1.00 65.22 C ATOM 1184 CD GLN A 73 -16.916 7.416 -2.505 1.00 62.12 C ATOM 1185 OE1 GLN A 73 -16.882 7.540 -3.731 1.00 22.24 O ATOM 1186 NE2 GLN A 73 -17.917 7.944 -1.816 1.00 3.34 N ATOM 0 H GLN A 73 -12.568 5.368 -3.614 1.00 22.30 H new ATOM 0 HA GLN A 73 -13.203 6.763 -1.236 1.00 62.11 H new ATOM 0 HB2 GLN A 73 -14.465 6.670 -3.425 1.00 21.40 H new ATOM 0 HB3 GLN A 73 -15.066 5.102 -2.924 1.00 21.40 H new ATOM 0 HG2 GLN A 73 -16.227 6.001 -1.049 1.00 65.22 H new ATOM 0 HG3 GLN A 73 -15.313 7.497 -1.083 1.00 65.22 H new ATOM 0 HE21 GLN A 73 -17.947 7.843 -0.801 1.00 3.34 H new ATOM 0 HE22 GLN A 73 -18.657 8.452 -2.300 1.00 3.34 H new ATOM 1195 N ALA A 74 -13.469 3.474 -0.903 1.00 65.13 N ATOM 1196 CA ALA A 74 -13.499 2.419 0.115 1.00 63.12 C ATOM 1197 C ALA A 74 -12.351 2.530 1.120 1.00 44.12 C ATOM 1198 O ALA A 74 -12.560 2.321 2.313 1.00 22.13 O ATOM 1199 CB ALA A 74 -13.454 1.048 -0.569 1.00 75.34 C ATOM 0 H ALA A 74 -13.417 3.117 -1.857 1.00 65.13 H new ATOM 0 HA ALA A 74 -14.426 2.538 0.675 1.00 63.12 H new ATOM 0 HB1 ALA A 74 -13.476 0.263 0.187 1.00 75.34 H new ATOM 0 HB2 ALA A 74 -14.316 0.942 -1.228 1.00 75.34 H new ATOM 0 HB3 ALA A 74 -12.538 0.963 -1.153 1.00 75.34 H new ATOM 1205 N TRP A 75 -11.145 2.846 0.652 1.00 3.51 N ATOM 1206 CA TRP A 75 -9.951 2.925 1.484 1.00 4.20 C ATOM 1207 C TRP A 75 -10.146 3.939 2.615 1.00 71.43 C ATOM 1208 O TRP A 75 -9.781 3.675 3.758 1.00 13.02 O ATOM 1209 CB TRP A 75 -8.744 3.298 0.620 1.00 51.11 C ATOM 1210 CG TRP A 75 -7.449 2.996 1.288 1.00 5.31 C ATOM 1211 CD1 TRP A 75 -6.498 3.889 1.634 1.00 51.42 C ATOM 1212 CD2 TRP A 75 -6.959 1.697 1.724 1.00 53.44 C ATOM 1213 NE1 TRP A 75 -5.454 3.228 2.250 1.00 74.24 N ATOM 1214 CE2 TRP A 75 -5.677 1.875 2.311 1.00 13.02 C ATOM 1215 CE3 TRP A 75 -7.473 0.388 1.682 1.00 33.41 C ATOM 1216 CZ2 TRP A 75 -4.926 0.806 2.811 1.00 43.15 C ATOM 1217 CZ3 TRP A 75 -6.754 -0.685 2.229 1.00 12.41 C ATOM 1218 CH2 TRP A 75 -5.474 -0.487 2.774 1.00 64.33 C ATOM 0 H TRP A 75 -10.970 3.057 -0.330 1.00 3.51 H new ATOM 0 HA TRP A 75 -9.770 1.951 1.938 1.00 4.20 H new ATOM 0 HB2 TRP A 75 -8.797 2.757 -0.325 1.00 51.11 H new ATOM 0 HB3 TRP A 75 -8.787 4.361 0.381 1.00 51.11 H new ATOM 0 HD1 TRP A 75 -6.546 4.953 1.457 1.00 51.42 H new ATOM 0 HE1 TRP A 75 -4.620 3.688 2.615 1.00 74.24 H new ATOM 0 HE3 TRP A 75 -8.434 0.207 1.223 1.00 33.41 H new ATOM 0 HZ2 TRP A 75 -3.940 0.972 3.219 1.00 43.15 H new ATOM 0 HZ3 TRP A 75 -7.189 -1.674 2.231 1.00 12.41 H new ATOM 0 HH2 TRP A 75 -4.914 -1.325 3.163 1.00 64.33 H new ATOM 1229 N ALA A 76 -10.808 5.065 2.330 1.00 1.41 N ATOM 1230 CA ALA A 76 -11.133 6.062 3.340 1.00 52.33 C ATOM 1231 C ALA A 76 -11.963 5.508 4.498 1.00 20.15 C ATOM 1232 O ALA A 76 -11.677 5.883 5.630 1.00 25.54 O ATOM 1233 CB ALA A 76 -11.867 7.234 2.718 1.00 0.10 C ATOM 0 H ALA A 76 -11.131 5.305 1.393 1.00 1.41 H new ATOM 0 HA ALA A 76 -10.178 6.388 3.752 1.00 52.33 H new ATOM 0 HB1 ALA A 76 -12.101 7.968 3.489 1.00 0.10 H new ATOM 0 HB2 ALA A 76 -11.237 7.695 1.957 1.00 0.10 H new ATOM 0 HB3 ALA A 76 -12.791 6.883 2.260 1.00 0.10 H new ATOM 1239 N VAL A 77 -12.960 4.641 4.268 1.00 72.24 N ATOM 1240 CA VAL A 77 -13.689 4.012 5.375 1.00 11.31 C ATOM 1241 C VAL A 77 -12.692 3.231 6.243 1.00 41.33 C ATOM 1242 O VAL A 77 -12.779 3.276 7.471 1.00 62.22 O ATOM 1243 CB VAL A 77 -14.815 3.090 4.848 1.00 4.11 C ATOM 1244 CG1 VAL A 77 -15.442 2.252 5.972 1.00 1.13 C ATOM 1245 CG2 VAL A 77 -15.986 3.839 4.194 1.00 75.11 C ATOM 0 H VAL A 77 -13.276 4.363 3.339 1.00 72.24 H new ATOM 0 HA VAL A 77 -14.167 4.783 5.979 1.00 11.31 H new ATOM 0 HB VAL A 77 -14.307 2.473 4.106 1.00 4.11 H new ATOM 0 HG11 VAL A 77 -16.228 1.619 5.559 1.00 1.13 H new ATOM 0 HG12 VAL A 77 -14.676 1.627 6.430 1.00 1.13 H new ATOM 0 HG13 VAL A 77 -15.868 2.915 6.725 1.00 1.13 H new ATOM 0 HG21 VAL A 77 -16.731 3.121 3.852 1.00 75.11 H new ATOM 0 HG22 VAL A 77 -16.438 4.513 4.921 1.00 75.11 H new ATOM 0 HG23 VAL A 77 -15.620 4.415 3.344 1.00 75.11 H new ATOM 1255 N ALA A 78 -11.773 2.495 5.611 1.00 45.34 N ATOM 1256 CA ALA A 78 -10.830 1.641 6.308 1.00 34.50 C ATOM 1257 C ALA A 78 -9.854 2.456 7.153 1.00 1.31 C ATOM 1258 O ALA A 78 -9.616 2.075 8.296 1.00 72.52 O ATOM 1259 CB ALA A 78 -10.101 0.743 5.311 1.00 5.21 C ATOM 0 H ALA A 78 -11.669 2.481 4.596 1.00 45.34 H new ATOM 0 HA ALA A 78 -11.385 1.005 6.998 1.00 34.50 H new ATOM 0 HB1 ALA A 78 -9.395 0.106 5.844 1.00 5.21 H new ATOM 0 HB2 ALA A 78 -10.825 0.121 4.784 1.00 5.21 H new ATOM 0 HB3 ALA A 78 -9.562 1.360 4.592 1.00 5.21 H new ATOM 1265 N ILE A 79 -9.324 3.563 6.624 1.00 71.22 N ATOM 1266 CA ILE A 79 -8.501 4.513 7.370 1.00 4.53 C ATOM 1267 C ILE A 79 -9.330 5.140 8.494 1.00 43.12 C ATOM 1268 O ILE A 79 -8.848 5.209 9.622 1.00 3.13 O ATOM 1269 CB ILE A 79 -7.903 5.577 6.411 1.00 63.53 C ATOM 1270 CG1 ILE A 79 -6.768 4.931 5.582 1.00 53.51 C ATOM 1271 CG2 ILE A 79 -7.371 6.820 7.160 1.00 24.34 C ATOM 1272 CD1 ILE A 79 -6.287 5.799 4.416 1.00 12.20 C ATOM 0 H ILE A 79 -9.459 3.826 5.648 1.00 71.22 H new ATOM 0 HA ILE A 79 -7.661 3.993 7.830 1.00 4.53 H new ATOM 0 HB ILE A 79 -8.703 5.922 5.757 1.00 63.53 H new ATOM 0 HG12 ILE A 79 -5.924 4.721 6.239 1.00 53.51 H new ATOM 0 HG13 ILE A 79 -7.114 3.974 5.192 1.00 53.51 H new ATOM 0 HG21 ILE A 79 -6.964 7.531 6.441 1.00 24.34 H new ATOM 0 HG22 ILE A 79 -8.186 7.288 7.713 1.00 24.34 H new ATOM 0 HG23 ILE A 79 -6.587 6.518 7.855 1.00 24.34 H new ATOM 0 HD11 ILE A 79 -5.491 5.281 3.881 1.00 12.20 H new ATOM 0 HD12 ILE A 79 -7.118 5.988 3.736 1.00 12.20 H new ATOM 0 HD13 ILE A 79 -5.909 6.747 4.800 1.00 12.20 H new ATOM 1284 N ALA A 80 -10.563 5.585 8.213 1.00 60.42 N ATOM 1285 CA ALA A 80 -11.390 6.303 9.180 1.00 71.13 C ATOM 1286 C ALA A 80 -11.647 5.460 10.434 1.00 31.40 C ATOM 1287 O ALA A 80 -11.880 6.026 11.503 1.00 21.11 O ATOM 1288 CB ALA A 80 -12.703 6.772 8.526 1.00 63.34 C ATOM 0 H ALA A 80 -11.011 5.455 7.306 1.00 60.42 H new ATOM 0 HA ALA A 80 -10.844 7.189 9.503 1.00 71.13 H new ATOM 0 HB1 ALA A 80 -13.306 7.305 9.261 1.00 63.34 H new ATOM 0 HB2 ALA A 80 -12.477 7.437 7.692 1.00 63.34 H new ATOM 0 HB3 ALA A 80 -13.257 5.907 8.161 1.00 63.34 H new ATOM 1294 N LEU A 81 -11.570 4.126 10.320 1.00 33.21 N ATOM 1295 CA LEU A 81 -11.715 3.210 11.447 1.00 20.42 C ATOM 1296 C LEU A 81 -10.405 2.558 11.888 1.00 12.00 C ATOM 1297 O LEU A 81 -10.353 2.001 12.988 1.00 34.41 O ATOM 1298 CB LEU A 81 -12.722 2.116 11.074 1.00 53.44 C ATOM 1299 CG LEU A 81 -14.120 2.646 10.732 1.00 11.41 C ATOM 1300 CD1 LEU A 81 -14.992 1.459 10.322 1.00 14.35 C ATOM 1301 CD2 LEU A 81 -14.739 3.428 11.894 1.00 14.00 C ATOM 0 H LEU A 81 -11.403 3.654 9.431 1.00 33.21 H new ATOM 0 HA LEU A 81 -12.063 3.805 12.291 1.00 20.42 H new ATOM 0 HB2 LEU A 81 -12.337 1.558 10.220 1.00 53.44 H new ATOM 0 HB3 LEU A 81 -12.804 1.414 11.903 1.00 53.44 H new ATOM 0 HG LEU A 81 -14.047 3.353 9.906 1.00 11.41 H new ATOM 0 HD11 LEU A 81 -15.993 1.812 10.074 1.00 14.35 H new ATOM 0 HD12 LEU A 81 -14.554 0.969 9.453 1.00 14.35 H new ATOM 0 HD13 LEU A 81 -15.052 0.749 11.147 1.00 14.35 H new ATOM 0 HD21 LEU A 81 -15.728 3.784 11.607 1.00 14.00 H new ATOM 0 HD22 LEU A 81 -14.826 2.778 12.765 1.00 14.00 H new ATOM 0 HD23 LEU A 81 -14.104 4.279 12.139 1.00 14.00 H new ATOM 1313 N GLY A 82 -9.362 2.585 11.065 1.00 4.30 N ATOM 1314 CA GLY A 82 -8.166 1.782 11.235 1.00 32.31 C ATOM 1315 C GLY A 82 -8.500 0.293 11.177 1.00 20.42 C ATOM 1316 O GLY A 82 -8.435 -0.394 12.201 1.00 15.44 O ATOM 0 H GLY A 82 -9.329 3.184 10.240 1.00 4.30 H new ATOM 0 HA2 GLY A 82 -7.444 2.028 10.457 1.00 32.31 H new ATOM 0 HA3 GLY A 82 -7.697 2.017 12.191 1.00 32.31 H new ATOM 1320 N VAL A 83 -8.866 -0.221 10.003 1.00 11.50 N ATOM 1321 CA VAL A 83 -9.101 -1.648 9.751 1.00 62.15 C ATOM 1322 C VAL A 83 -8.467 -2.118 8.439 1.00 55.03 C ATOM 1323 O VAL A 83 -8.796 -3.206 7.968 1.00 44.33 O ATOM 1324 CB VAL A 83 -10.606 -1.992 9.812 1.00 62.53 C ATOM 1325 CG1 VAL A 83 -11.149 -1.865 11.235 1.00 44.12 C ATOM 1326 CG2 VAL A 83 -11.459 -1.152 8.849 1.00 12.24 C ATOM 0 H VAL A 83 -9.012 0.358 9.176 1.00 11.50 H new ATOM 0 HA VAL A 83 -8.605 -2.197 10.552 1.00 62.15 H new ATOM 0 HB VAL A 83 -10.684 -3.030 9.489 1.00 62.53 H new ATOM 0 HG11 VAL A 83 -12.210 -2.114 11.243 1.00 44.12 H new ATOM 0 HG12 VAL A 83 -10.611 -2.548 11.892 1.00 44.12 H new ATOM 0 HG13 VAL A 83 -11.014 -0.842 11.586 1.00 44.12 H new ATOM 0 HG21 VAL A 83 -12.505 -1.443 8.941 1.00 12.24 H new ATOM 0 HG22 VAL A 83 -11.353 -0.096 9.096 1.00 12.24 H new ATOM 0 HG23 VAL A 83 -11.125 -1.320 7.825 1.00 12.24 H new ATOM 1336 N GLU A 84 -7.583 -1.317 7.843 1.00 33.33 N ATOM 1337 CA GLU A 84 -6.992 -1.536 6.530 1.00 63.34 C ATOM 1338 C GLU A 84 -6.427 -2.946 6.392 1.00 21.51 C ATOM 1339 O GLU A 84 -6.750 -3.662 5.446 1.00 0.34 O ATOM 1340 CB GLU A 84 -5.854 -0.524 6.291 1.00 0.14 C ATOM 1341 CG GLU A 84 -6.218 0.963 6.426 1.00 52.25 C ATOM 1342 CD GLU A 84 -5.887 1.540 7.811 1.00 51.11 C ATOM 1343 OE1 GLU A 84 -6.088 0.829 8.829 1.00 73.21 O ATOM 1344 OE2 GLU A 84 -5.372 2.670 7.901 1.00 1.22 O ATOM 0 H GLU A 84 -7.247 -0.461 8.285 1.00 33.33 H new ATOM 0 HA GLU A 84 -7.783 -1.404 5.792 1.00 63.34 H new ATOM 0 HB2 GLU A 84 -5.050 -0.743 6.993 1.00 0.14 H new ATOM 0 HB3 GLU A 84 -5.456 -0.688 5.289 1.00 0.14 H new ATOM 0 HG2 GLU A 84 -5.685 1.532 5.665 1.00 52.25 H new ATOM 0 HG3 GLU A 84 -7.283 1.090 6.231 1.00 52.25 H new ATOM 1351 N ASP A 85 -5.610 -3.361 7.356 1.00 64.23 N ATOM 1352 CA ASP A 85 -4.962 -4.669 7.350 1.00 1.31 C ATOM 1353 C ASP A 85 -6.011 -5.780 7.456 1.00 52.12 C ATOM 1354 O ASP A 85 -5.924 -6.801 6.773 1.00 54.13 O ATOM 1355 CB ASP A 85 -3.953 -4.733 8.508 1.00 5.12 C ATOM 1356 CG ASP A 85 -2.508 -4.661 8.009 1.00 11.14 C ATOM 1357 OD1 ASP A 85 -2.004 -3.536 7.758 1.00 32.11 O ATOM 1358 OD2 ASP A 85 -1.875 -5.727 7.866 1.00 21.34 O ATOM 0 H ASP A 85 -5.377 -2.793 8.171 1.00 64.23 H new ATOM 0 HA ASP A 85 -4.426 -4.815 6.412 1.00 1.31 H new ATOM 0 HB2 ASP A 85 -4.140 -3.911 9.199 1.00 5.12 H new ATOM 0 HB3 ASP A 85 -4.099 -5.658 9.066 1.00 5.12 H new ATOM 1363 N LYS A 86 -7.060 -5.550 8.259 1.00 13.41 N ATOM 1364 CA LYS A 86 -8.105 -6.552 8.497 1.00 21.23 C ATOM 1365 C LYS A 86 -8.865 -6.829 7.206 1.00 51.42 C ATOM 1366 O LYS A 86 -9.190 -7.974 6.891 1.00 42.13 O ATOM 1367 CB LYS A 86 -9.103 -6.105 9.585 1.00 64.22 C ATOM 1368 CG LYS A 86 -8.429 -5.636 10.878 1.00 33.13 C ATOM 1369 CD LYS A 86 -9.418 -5.448 12.032 1.00 55.42 C ATOM 1370 CE LYS A 86 -8.579 -5.217 13.291 1.00 3.23 C ATOM 1371 NZ LYS A 86 -9.347 -4.670 14.430 1.00 63.55 N ATOM 0 H LYS A 86 -7.206 -4.672 8.757 1.00 13.41 H new ATOM 0 HA LYS A 86 -7.609 -7.458 8.845 1.00 21.23 H new ATOM 0 HB2 LYS A 86 -9.719 -5.296 9.192 1.00 64.22 H new ATOM 0 HB3 LYS A 86 -9.773 -6.933 9.814 1.00 64.22 H new ATOM 0 HG2 LYS A 86 -7.671 -6.363 11.171 1.00 33.13 H new ATOM 0 HG3 LYS A 86 -7.913 -4.694 10.692 1.00 33.13 H new ATOM 0 HD2 LYS A 86 -10.077 -4.600 11.844 1.00 55.42 H new ATOM 0 HD3 LYS A 86 -10.053 -6.326 12.145 1.00 55.42 H new ATOM 0 HE2 LYS A 86 -8.125 -6.161 13.592 1.00 3.23 H new ATOM 0 HE3 LYS A 86 -7.764 -4.533 13.053 1.00 3.23 H new ATOM 0 HZ1 LYS A 86 -8.714 -4.540 15.245 1.00 63.55 H new ATOM 0 HZ2 LYS A 86 -9.759 -3.753 14.162 1.00 63.55 H new ATOM 0 HZ3 LYS A 86 -10.108 -5.331 14.685 1.00 63.55 H new ATOM 1385 N ILE A 87 -9.190 -5.757 6.484 1.00 62.35 N ATOM 1386 CA ILE A 87 -9.994 -5.785 5.270 1.00 13.42 C ATOM 1387 C ILE A 87 -9.125 -5.901 4.023 1.00 4.24 C ATOM 1388 O ILE A 87 -9.607 -5.627 2.930 1.00 44.44 O ATOM 1389 CB ILE A 87 -10.970 -4.588 5.219 1.00 34.41 C ATOM 1390 CG1 ILE A 87 -10.306 -3.196 5.179 1.00 61.54 C ATOM 1391 CG2 ILE A 87 -11.921 -4.677 6.409 1.00 23.10 C ATOM 1392 CD1 ILE A 87 -10.421 -2.580 3.793 1.00 12.32 C ATOM 0 H ILE A 87 -8.889 -4.816 6.739 1.00 62.35 H new ATOM 0 HA ILE A 87 -10.609 -6.685 5.292 1.00 13.42 H new ATOM 0 HB ILE A 87 -11.499 -4.672 4.270 1.00 34.41 H new ATOM 0 HG12 ILE A 87 -10.778 -2.542 5.912 1.00 61.54 H new ATOM 0 HG13 ILE A 87 -9.256 -3.281 5.457 1.00 61.54 H new ATOM 0 HG21 ILE A 87 -12.615 -3.837 6.384 1.00 23.10 H new ATOM 0 HG22 ILE A 87 -12.480 -5.611 6.359 1.00 23.10 H new ATOM 0 HG23 ILE A 87 -11.348 -4.646 7.336 1.00 23.10 H new ATOM 0 HD11 ILE A 87 -9.946 -1.599 3.790 1.00 12.32 H new ATOM 0 HD12 ILE A 87 -9.927 -3.225 3.066 1.00 12.32 H new ATOM 0 HD13 ILE A 87 -11.473 -2.474 3.528 1.00 12.32 H new ATOM 1404 N THR A 88 -7.865 -6.306 4.150 1.00 23.13 N ATOM 1405 CA THR A 88 -7.076 -6.654 2.986 1.00 41.54 C ATOM 1406 C THR A 88 -7.272 -8.142 2.642 1.00 15.01 C ATOM 1407 O THR A 88 -7.643 -8.447 1.508 1.00 74.41 O ATOM 1408 CB THR A 88 -5.634 -6.187 3.220 1.00 41.33 C ATOM 1409 OG1 THR A 88 -5.622 -4.764 3.249 1.00 72.44 O ATOM 1410 CG2 THR A 88 -4.710 -6.612 2.092 1.00 3.22 C ATOM 0 H THR A 88 -7.377 -6.399 5.041 1.00 23.13 H new ATOM 0 HA THR A 88 -7.406 -6.136 2.086 1.00 41.54 H new ATOM 0 HB THR A 88 -5.289 -6.630 4.154 1.00 41.33 H new ATOM 0 HG1 THR A 88 -6.077 -4.449 4.058 1.00 72.44 H new ATOM 0 HG21 THR A 88 -3.699 -6.261 2.298 1.00 3.22 H new ATOM 0 HG22 THR A 88 -4.708 -7.699 2.014 1.00 3.22 H new ATOM 0 HG23 THR A 88 -5.059 -6.181 1.154 1.00 3.22 H new ATOM 1418 N ALA A 89 -7.172 -9.048 3.623 1.00 3.32 N ATOM 1419 CA ALA A 89 -7.125 -10.495 3.388 1.00 25.23 C ATOM 1420 C ALA A 89 -8.332 -11.039 2.602 1.00 60.12 C ATOM 1421 O ALA A 89 -8.168 -11.593 1.511 1.00 42.44 O ATOM 1422 CB ALA A 89 -6.904 -11.234 4.712 1.00 3.23 C ATOM 0 H ALA A 89 -7.121 -8.794 4.610 1.00 3.32 H new ATOM 0 HA ALA A 89 -6.273 -10.687 2.736 1.00 25.23 H new ATOM 0 HB1 ALA A 89 -6.870 -12.308 4.528 1.00 3.23 H new ATOM 0 HB2 ALA A 89 -5.962 -10.912 5.155 1.00 3.23 H new ATOM 0 HB3 ALA A 89 -7.722 -11.008 5.396 1.00 3.23 H new ATOM 1428 N PRO A 90 -9.567 -10.904 3.115 1.00 43.34 N ATOM 1429 CA PRO A 90 -10.736 -11.440 2.427 1.00 23.33 C ATOM 1430 C PRO A 90 -11.024 -10.683 1.133 1.00 40.01 C ATOM 1431 O PRO A 90 -11.630 -11.217 0.207 1.00 51.32 O ATOM 1432 CB PRO A 90 -11.876 -11.299 3.428 1.00 54.22 C ATOM 1433 CG PRO A 90 -11.440 -10.222 4.419 1.00 73.11 C ATOM 1434 CD PRO A 90 -9.929 -10.212 4.342 1.00 44.03 C ATOM 0 HA PRO A 90 -10.589 -12.476 2.122 1.00 23.33 H new ATOM 0 HB2 PRO A 90 -12.802 -11.016 2.927 1.00 54.22 H new ATOM 0 HB3 PRO A 90 -12.066 -12.244 3.938 1.00 54.22 H new ATOM 0 HG2 PRO A 90 -11.856 -9.250 4.154 1.00 73.11 H new ATOM 0 HG3 PRO A 90 -11.783 -10.451 5.428 1.00 73.11 H new ATOM 0 HD2 PRO A 90 -9.549 -9.190 4.336 1.00 44.03 H new ATOM 0 HD3 PRO A 90 -9.494 -10.709 5.209 1.00 44.03 H new ATOM 1442 N MET A 91 -10.595 -9.428 1.075 1.00 54.52 N ATOM 1443 CA MET A 91 -10.791 -8.535 -0.052 1.00 0.04 C ATOM 1444 C MET A 91 -10.046 -9.034 -1.269 1.00 71.42 C ATOM 1445 O MET A 91 -10.644 -9.144 -2.341 1.00 63.12 O ATOM 1446 CB MET A 91 -10.360 -7.124 0.349 1.00 11.31 C ATOM 1447 CG MET A 91 -10.931 -6.000 -0.513 1.00 72.54 C ATOM 1448 SD MET A 91 -12.598 -5.417 -0.093 1.00 55.45 S ATOM 1449 CE MET A 91 -12.359 -4.866 1.611 1.00 54.22 C ATOM 0 H MET A 91 -10.083 -8.992 1.842 1.00 54.52 H new ATOM 0 HA MET A 91 -11.846 -8.509 -0.323 1.00 0.04 H new ATOM 0 HB2 MET A 91 -10.655 -6.952 1.384 1.00 11.31 H new ATOM 0 HB3 MET A 91 -9.272 -7.070 0.314 1.00 11.31 H new ATOM 0 HG2 MET A 91 -10.250 -5.151 -0.459 1.00 72.54 H new ATOM 0 HG3 MET A 91 -10.939 -6.337 -1.550 1.00 72.54 H new ATOM 0 HE1 MET A 91 -13.317 -4.564 2.033 1.00 54.22 H new ATOM 0 HE2 MET A 91 -11.943 -5.682 2.202 1.00 54.22 H new ATOM 0 HE3 MET A 91 -11.672 -4.020 1.627 1.00 54.22 H new ATOM 1459 N PHE A 92 -8.762 -9.343 -1.116 1.00 35.21 N ATOM 1460 CA PHE A 92 -7.951 -9.812 -2.220 1.00 63.21 C ATOM 1461 C PHE A 92 -8.413 -11.212 -2.611 1.00 22.30 C ATOM 1462 O PHE A 92 -8.412 -11.538 -3.803 1.00 35.33 O ATOM 1463 CB PHE A 92 -6.476 -9.767 -1.831 1.00 2.40 C ATOM 1464 CG PHE A 92 -5.830 -8.386 -1.902 1.00 42.53 C ATOM 1465 CD1 PHE A 92 -6.437 -7.258 -1.318 1.00 40.42 C ATOM 1466 CD2 PHE A 92 -4.576 -8.233 -2.519 1.00 71.32 C ATOM 1467 CE1 PHE A 92 -5.807 -6.007 -1.344 1.00 11.21 C ATOM 1468 CE2 PHE A 92 -3.911 -6.995 -2.499 1.00 40.22 C ATOM 1469 CZ PHE A 92 -4.528 -5.881 -1.908 1.00 4.12 C ATOM 0 H PHE A 92 -8.263 -9.274 -0.229 1.00 35.21 H new ATOM 0 HA PHE A 92 -8.069 -9.166 -3.090 1.00 63.21 H new ATOM 0 HB2 PHE A 92 -6.372 -10.148 -0.815 1.00 2.40 H new ATOM 0 HB3 PHE A 92 -5.923 -10.444 -2.483 1.00 2.40 H new ATOM 0 HD1 PHE A 92 -7.402 -7.358 -0.843 1.00 40.42 H new ATOM 0 HD2 PHE A 92 -4.118 -9.077 -3.014 1.00 71.32 H new ATOM 0 HE1 PHE A 92 -6.304 -5.142 -0.931 1.00 11.21 H new ATOM 0 HE2 PHE A 92 -2.928 -6.901 -2.937 1.00 40.22 H new ATOM 0 HZ PHE A 92 -4.019 -4.929 -1.887 1.00 4.12 H new ATOM 1479 N GLU A 93 -8.921 -12.008 -1.663 1.00 1.11 N ATOM 1480 CA GLU A 93 -9.625 -13.230 -2.008 1.00 1.12 C ATOM 1481 C GLU A 93 -10.815 -12.919 -2.922 1.00 31.44 C ATOM 1482 O GLU A 93 -10.962 -13.524 -3.981 1.00 2.51 O ATOM 1483 CB GLU A 93 -10.000 -14.083 -0.776 1.00 74.42 C ATOM 1484 CG GLU A 93 -9.346 -15.472 -0.883 1.00 52.23 C ATOM 1485 CD GLU A 93 -9.810 -16.552 0.106 1.00 51.03 C ATOM 1486 OE1 GLU A 93 -10.839 -16.381 0.809 1.00 75.33 O ATOM 1487 OE2 GLU A 93 -9.194 -17.642 0.099 1.00 43.01 O ATOM 0 H GLU A 93 -8.854 -11.823 -0.662 1.00 1.11 H new ATOM 0 HA GLU A 93 -8.939 -13.862 -2.571 1.00 1.12 H new ATOM 0 HB2 GLU A 93 -9.670 -13.585 0.136 1.00 74.42 H new ATOM 0 HB3 GLU A 93 -11.083 -14.185 -0.710 1.00 74.42 H new ATOM 0 HG2 GLU A 93 -9.514 -15.846 -1.893 1.00 52.23 H new ATOM 0 HG3 GLU A 93 -8.270 -15.347 -0.764 1.00 52.23 H new ATOM 1494 N ALA A 94 -11.629 -11.922 -2.596 1.00 65.12 N ATOM 1495 CA ALA A 94 -12.852 -11.639 -3.336 1.00 2.00 C ATOM 1496 C ALA A 94 -12.602 -10.848 -4.630 1.00 54.54 C ATOM 1497 O ALA A 94 -13.553 -10.510 -5.335 1.00 60.22 O ATOM 1498 CB ALA A 94 -13.851 -10.971 -2.384 1.00 52.01 C ATOM 0 H ALA A 94 -11.460 -11.289 -1.814 1.00 65.12 H new ATOM 0 HA ALA A 94 -13.285 -12.574 -3.691 1.00 2.00 H new ATOM 0 HB1 ALA A 94 -14.774 -10.751 -2.921 1.00 52.01 H new ATOM 0 HB2 ALA A 94 -14.066 -11.642 -1.552 1.00 52.01 H new ATOM 0 HB3 ALA A 94 -13.425 -10.044 -2.001 1.00 52.01 H new ATOM 1504 N VAL A 95 -11.349 -10.556 -4.976 1.00 61.34 N ATOM 1505 CA VAL A 95 -10.966 -9.707 -6.102 1.00 3.14 C ATOM 1506 C VAL A 95 -10.041 -10.451 -7.049 1.00 43.01 C ATOM 1507 O VAL A 95 -10.186 -10.301 -8.259 1.00 62.32 O ATOM 1508 CB VAL A 95 -10.299 -8.442 -5.545 1.00 11.33 C ATOM 1509 CG1 VAL A 95 -9.553 -7.630 -6.600 1.00 45.32 C ATOM 1510 CG2 VAL A 95 -11.353 -7.543 -4.907 1.00 0.55 C ATOM 0 H VAL A 95 -10.545 -10.917 -4.462 1.00 61.34 H new ATOM 0 HA VAL A 95 -11.849 -9.428 -6.678 1.00 3.14 H new ATOM 0 HB VAL A 95 -9.567 -8.784 -4.814 1.00 11.33 H new ATOM 0 HG11 VAL A 95 -9.107 -6.751 -6.135 1.00 45.32 H new ATOM 0 HG12 VAL A 95 -8.768 -8.243 -7.043 1.00 45.32 H new ATOM 0 HG13 VAL A 95 -10.250 -7.315 -7.377 1.00 45.32 H new ATOM 0 HG21 VAL A 95 -10.876 -6.646 -4.513 1.00 0.55 H new ATOM 0 HG22 VAL A 95 -12.093 -7.261 -5.656 1.00 0.55 H new ATOM 0 HG23 VAL A 95 -11.845 -8.079 -4.095 1.00 0.55 H new ATOM 1520 N GLN A 96 -9.111 -11.248 -6.528 1.00 14.21 N ATOM 1521 CA GLN A 96 -8.112 -11.938 -7.326 1.00 22.44 C ATOM 1522 C GLN A 96 -8.446 -13.427 -7.367 1.00 13.30 C ATOM 1523 O GLN A 96 -8.439 -14.037 -8.432 1.00 71.25 O ATOM 1524 CB GLN A 96 -6.721 -11.699 -6.758 1.00 60.25 C ATOM 1525 CG GLN A 96 -6.431 -10.198 -6.893 1.00 40.44 C ATOM 1526 CD GLN A 96 -4.961 -9.871 -6.992 1.00 62.34 C ATOM 1527 OE1 GLN A 96 -4.124 -10.684 -7.372 1.00 61.15 O ATOM 1528 NE2 GLN A 96 -4.618 -8.661 -6.631 1.00 54.24 N ATOM 0 H GLN A 96 -9.033 -11.432 -5.528 1.00 14.21 H new ATOM 0 HA GLN A 96 -8.121 -11.548 -8.344 1.00 22.44 H new ATOM 0 HB2 GLN A 96 -6.673 -12.008 -5.714 1.00 60.25 H new ATOM 0 HB3 GLN A 96 -5.978 -12.285 -7.299 1.00 60.25 H new ATOM 0 HG2 GLN A 96 -6.939 -9.817 -7.779 1.00 40.44 H new ATOM 0 HG3 GLN A 96 -6.853 -9.677 -6.034 1.00 40.44 H new ATOM 0 HE21 GLN A 96 -5.330 -8.001 -6.318 1.00 54.24 H new ATOM 0 HE22 GLN A 96 -3.639 -8.378 -6.662 1.00 54.24 H new ATOM 1537 N LYS A 97 -8.738 -14.018 -6.203 1.00 1.23 N ATOM 1538 CA LYS A 97 -8.906 -15.462 -6.058 1.00 31.45 C ATOM 1539 C LYS A 97 -10.268 -15.902 -6.585 1.00 1.44 C ATOM 1540 O LYS A 97 -10.333 -16.863 -7.341 1.00 71.12 O ATOM 1541 CB LYS A 97 -8.752 -15.862 -4.593 1.00 33.32 C ATOM 1542 CG LYS A 97 -7.338 -15.549 -4.079 1.00 3.05 C ATOM 1543 CD LYS A 97 -6.482 -16.801 -3.947 1.00 11.13 C ATOM 1544 CE LYS A 97 -6.535 -17.237 -2.480 1.00 21.31 C ATOM 1545 NZ LYS A 97 -5.516 -18.235 -2.101 1.00 25.32 N ATOM 0 H LYS A 97 -8.864 -13.502 -5.332 1.00 1.23 H new ATOM 0 HA LYS A 97 -8.135 -15.961 -6.645 1.00 31.45 H new ATOM 0 HB2 LYS A 97 -9.488 -15.331 -3.989 1.00 33.32 H new ATOM 0 HB3 LYS A 97 -8.956 -16.927 -4.480 1.00 33.32 H new ATOM 0 HG2 LYS A 97 -6.853 -14.850 -4.760 1.00 3.05 H new ATOM 0 HG3 LYS A 97 -7.407 -15.055 -3.110 1.00 3.05 H new ATOM 0 HD2 LYS A 97 -6.856 -17.592 -4.597 1.00 11.13 H new ATOM 0 HD3 LYS A 97 -5.455 -16.598 -4.251 1.00 11.13 H new ATOM 0 HE2 LYS A 97 -6.416 -16.357 -1.848 1.00 21.31 H new ATOM 0 HE3 LYS A 97 -7.523 -17.648 -2.272 1.00 21.31 H new ATOM 0 HZ1 LYS A 97 -5.622 -18.474 -1.094 1.00 25.32 H new ATOM 0 HZ2 LYS A 97 -5.640 -19.093 -2.676 1.00 25.32 H new ATOM 0 HZ3 LYS A 97 -4.567 -17.842 -2.265 1.00 25.32 H new ATOM 1559 N THR A 98 -11.352 -15.273 -6.123 1.00 53.41 N ATOM 1560 CA THR A 98 -12.730 -15.580 -6.530 1.00 34.12 C ATOM 1561 C THR A 98 -13.293 -14.535 -7.509 1.00 21.32 C ATOM 1562 O THR A 98 -14.187 -14.848 -8.301 1.00 51.42 O ATOM 1563 CB THR A 98 -13.651 -15.782 -5.303 1.00 22.31 C ATOM 1564 OG1 THR A 98 -14.096 -14.558 -4.758 1.00 24.14 O ATOM 1565 CG2 THR A 98 -12.981 -16.575 -4.176 1.00 20.35 C ATOM 0 H THR A 98 -11.297 -14.518 -5.439 1.00 53.41 H new ATOM 0 HA THR A 98 -12.701 -16.526 -7.071 1.00 34.12 H new ATOM 0 HB THR A 98 -14.498 -16.349 -5.691 1.00 22.31 H new ATOM 0 HG1 THR A 98 -14.675 -14.734 -3.987 1.00 24.14 H new ATOM 0 HG21 THR A 98 -13.677 -16.683 -3.344 1.00 20.35 H new ATOM 0 HG22 THR A 98 -12.698 -17.561 -4.544 1.00 20.35 H new ATOM 0 HG23 THR A 98 -12.091 -16.045 -3.838 1.00 20.35 H new ATOM 1573 N GLN A 99 -12.756 -13.310 -7.476 1.00 24.30 N ATOM 1574 CA GLN A 99 -13.077 -12.169 -8.340 1.00 63.21 C ATOM 1575 C GLN A 99 -14.554 -11.750 -8.321 1.00 14.34 C ATOM 1576 O GLN A 99 -15.055 -11.182 -9.292 1.00 64.24 O ATOM 1577 CB GLN A 99 -12.549 -12.372 -9.778 1.00 11.20 C ATOM 1578 CG GLN A 99 -11.116 -12.914 -9.854 1.00 21.33 C ATOM 1579 CD GLN A 99 -10.344 -12.347 -11.046 1.00 12.42 C ATOM 1580 OE1 GLN A 99 -10.377 -12.883 -12.149 1.00 2.35 O ATOM 1581 NE2 GLN A 99 -9.695 -11.205 -10.878 1.00 4.32 N ATOM 0 H GLN A 99 -12.034 -13.073 -6.796 1.00 24.30 H new ATOM 0 HA GLN A 99 -12.544 -11.324 -7.903 1.00 63.21 H new ATOM 0 HB2 GLN A 99 -13.213 -13.059 -10.303 1.00 11.20 H new ATOM 0 HB3 GLN A 99 -12.593 -11.420 -10.307 1.00 11.20 H new ATOM 0 HG2 GLN A 99 -10.588 -12.669 -8.932 1.00 21.33 H new ATOM 0 HG3 GLN A 99 -11.144 -14.001 -9.926 1.00 21.33 H new ATOM 0 HE21 GLN A 99 -9.670 -10.763 -9.959 1.00 4.32 H new ATOM 0 HE22 GLN A 99 -9.220 -10.767 -11.667 1.00 4.32 H new ATOM 1590 N THR A 100 -15.261 -12.030 -7.229 1.00 13.25 N ATOM 1591 CA THR A 100 -16.677 -11.713 -7.088 1.00 51.33 C ATOM 1592 C THR A 100 -16.947 -10.204 -7.006 1.00 1.02 C ATOM 1593 O THR A 100 -18.063 -9.764 -7.285 1.00 43.45 O ATOM 1594 CB THR A 100 -17.229 -12.520 -5.903 1.00 13.53 C ATOM 1595 OG1 THR A 100 -18.631 -12.447 -5.826 1.00 25.42 O ATOM 1596 CG2 THR A 100 -16.657 -12.047 -4.569 1.00 11.21 C ATOM 0 H THR A 100 -14.862 -12.488 -6.410 1.00 13.25 H new ATOM 0 HA THR A 100 -17.216 -12.010 -7.988 1.00 51.33 H new ATOM 0 HB THR A 100 -16.923 -13.550 -6.086 1.00 13.53 H new ATOM 0 HG1 THR A 100 -18.944 -12.974 -5.061 1.00 25.42 H new ATOM 0 HG21 THR A 100 -17.076 -12.646 -3.761 1.00 11.21 H new ATOM 0 HG22 THR A 100 -15.573 -12.157 -4.578 1.00 11.21 H new ATOM 0 HG23 THR A 100 -16.914 -10.999 -4.414 1.00 11.21 H new ATOM 1604 N VAL A 101 -15.957 -9.384 -6.654 1.00 5.31 N ATOM 1605 CA VAL A 101 -16.105 -7.946 -6.682 1.00 44.02 C ATOM 1606 C VAL A 101 -16.245 -7.481 -8.118 1.00 12.20 C ATOM 1607 O VAL A 101 -15.378 -7.719 -8.960 1.00 52.33 O ATOM 1608 CB VAL A 101 -14.967 -7.260 -5.924 1.00 4.43 C ATOM 1609 CG1 VAL A 101 -14.884 -5.771 -6.264 1.00 54.51 C ATOM 1610 CG2 VAL A 101 -15.255 -7.394 -4.422 1.00 12.54 C ATOM 0 H VAL A 101 -15.039 -9.704 -6.345 1.00 5.31 H new ATOM 0 HA VAL A 101 -17.017 -7.657 -6.159 1.00 44.02 H new ATOM 0 HB VAL A 101 -14.024 -7.730 -6.204 1.00 4.43 H new ATOM 0 HG11 VAL A 101 -14.065 -5.316 -5.708 1.00 54.51 H new ATOM 0 HG12 VAL A 101 -14.707 -5.651 -7.333 1.00 54.51 H new ATOM 0 HG13 VAL A 101 -15.821 -5.283 -5.994 1.00 54.51 H new ATOM 0 HG21 VAL A 101 -14.458 -6.913 -3.854 1.00 12.54 H new ATOM 0 HG22 VAL A 101 -16.206 -6.915 -4.190 1.00 12.54 H new ATOM 0 HG23 VAL A 101 -15.305 -8.449 -4.154 1.00 12.54 H new ATOM 1620 N GLN A 102 -17.348 -6.779 -8.357 1.00 5.21 N ATOM 1621 CA GLN A 102 -17.735 -6.223 -9.636 1.00 75.51 C ATOM 1622 C GLN A 102 -18.469 -4.895 -9.465 1.00 62.23 C ATOM 1623 O GLN A 102 -18.459 -4.079 -10.391 1.00 54.43 O ATOM 1624 CB GLN A 102 -18.680 -7.178 -10.353 1.00 33.33 C ATOM 1625 CG GLN A 102 -18.091 -8.553 -10.645 1.00 51.24 C ATOM 1626 CD GLN A 102 -18.902 -9.234 -11.732 1.00 4.02 C ATOM 1627 OE1 GLN A 102 -20.038 -9.637 -11.495 1.00 71.31 O ATOM 1628 NE2 GLN A 102 -18.384 -9.300 -12.944 1.00 74.55 N ATOM 0 H GLN A 102 -18.026 -6.576 -7.623 1.00 5.21 H new ATOM 0 HA GLN A 102 -16.822 -6.068 -10.211 1.00 75.51 H new ATOM 0 HB2 GLN A 102 -19.578 -7.303 -9.747 1.00 33.33 H new ATOM 0 HB3 GLN A 102 -18.991 -6.723 -11.294 1.00 33.33 H new ATOM 0 HG2 GLN A 102 -17.052 -8.455 -10.960 1.00 51.24 H new ATOM 0 HG3 GLN A 102 -18.094 -9.161 -9.740 1.00 51.24 H new ATOM 0 HE21 GLN A 102 -17.438 -8.958 -13.114 1.00 74.55 H new ATOM 0 HE22 GLN A 102 -18.930 -9.693 -13.711 1.00 74.55 H new ATOM 1637 N SER A 103 -19.102 -4.665 -8.310 1.00 74.14 N ATOM 1638 CA SER A 103 -19.782 -3.415 -8.003 1.00 41.11 C ATOM 1639 C SER A 103 -19.415 -2.991 -6.580 1.00 72.35 C ATOM 1640 O SER A 103 -18.951 -3.816 -5.788 1.00 12.44 O ATOM 1641 CB SER A 103 -21.305 -3.586 -8.144 1.00 3.31 C ATOM 1642 OG SER A 103 -21.685 -4.544 -9.124 1.00 74.45 O ATOM 0 H SER A 103 -19.154 -5.352 -7.558 1.00 74.14 H new ATOM 0 HA SER A 103 -19.467 -2.642 -8.704 1.00 41.11 H new ATOM 0 HB2 SER A 103 -21.719 -3.882 -7.180 1.00 3.31 H new ATOM 0 HB3 SER A 103 -21.748 -2.623 -8.399 1.00 3.31 H new ATOM 0 HG SER A 103 -22.662 -4.604 -9.161 1.00 74.45 H new ATOM 1648 N VAL A 104 -19.683 -1.734 -6.221 1.00 73.25 N ATOM 1649 CA VAL A 104 -19.530 -1.216 -4.861 1.00 31.43 C ATOM 1650 C VAL A 104 -20.335 -2.087 -3.890 1.00 71.53 C ATOM 1651 O VAL A 104 -19.832 -2.490 -2.839 1.00 0.13 O ATOM 1652 CB VAL A 104 -19.982 0.255 -4.822 1.00 31.35 C ATOM 1653 CG1 VAL A 104 -19.686 0.892 -3.460 1.00 44.01 C ATOM 1654 CG2 VAL A 104 -19.292 1.082 -5.916 1.00 41.33 C ATOM 0 H VAL A 104 -20.019 -1.034 -6.882 1.00 73.25 H new ATOM 0 HA VAL A 104 -18.485 -1.254 -4.555 1.00 31.43 H new ATOM 0 HB VAL A 104 -21.058 0.256 -4.995 1.00 31.35 H new ATOM 0 HG11 VAL A 104 -20.017 1.931 -3.464 1.00 44.01 H new ATOM 0 HG12 VAL A 104 -20.216 0.346 -2.680 1.00 44.01 H new ATOM 0 HG13 VAL A 104 -18.614 0.853 -3.266 1.00 44.01 H new ATOM 0 HG21 VAL A 104 -19.633 2.116 -5.861 1.00 41.33 H new ATOM 0 HG22 VAL A 104 -18.212 1.048 -5.771 1.00 41.33 H new ATOM 0 HG23 VAL A 104 -19.540 0.670 -6.894 1.00 41.33 H new ATOM 1664 N ALA A 105 -21.538 -2.478 -4.321 1.00 15.40 N ATOM 1665 CA ALA A 105 -22.432 -3.416 -3.660 1.00 32.11 C ATOM 1666 C ALA A 105 -21.876 -4.832 -3.501 1.00 63.43 C ATOM 1667 O ALA A 105 -22.635 -5.713 -3.098 1.00 51.02 O ATOM 1668 CB ALA A 105 -23.731 -3.472 -4.470 1.00 63.22 C ATOM 0 H ALA A 105 -21.931 -2.124 -5.193 1.00 15.40 H new ATOM 0 HA ALA A 105 -22.582 -3.049 -2.645 1.00 32.11 H new ATOM 0 HB1 ALA A 105 -24.424 -4.169 -3.999 1.00 63.22 H new ATOM 0 HB2 ALA A 105 -24.181 -2.480 -4.505 1.00 63.22 H new ATOM 0 HB3 ALA A 105 -23.513 -3.807 -5.484 1.00 63.22 H new ATOM 1674 N ASP A 106 -20.601 -5.080 -3.799 1.00 23.15 N ATOM 1675 CA ASP A 106 -19.887 -6.306 -3.466 1.00 11.03 C ATOM 1676 C ASP A 106 -18.799 -5.989 -2.458 1.00 55.54 C ATOM 1677 O ASP A 106 -18.689 -6.648 -1.431 1.00 15.14 O ATOM 1678 CB ASP A 106 -19.295 -6.966 -4.720 1.00 14.15 C ATOM 1679 CG ASP A 106 -20.334 -7.262 -5.793 1.00 52.15 C ATOM 1680 OD1 ASP A 106 -21.461 -7.697 -5.454 1.00 61.53 O ATOM 1681 OD2 ASP A 106 -20.032 -7.007 -6.980 1.00 5.01 O ATOM 0 H ASP A 106 -20.019 -4.407 -4.297 1.00 23.15 H new ATOM 0 HA ASP A 106 -20.589 -7.017 -3.030 1.00 11.03 H new ATOM 0 HB2 ASP A 106 -18.528 -6.314 -5.137 1.00 14.15 H new ATOM 0 HB3 ASP A 106 -18.803 -7.896 -4.435 1.00 14.15 H new ATOM 1686 N ILE A 107 -18.023 -4.938 -2.702 1.00 62.42 N ATOM 1687 CA ILE A 107 -16.910 -4.539 -1.843 1.00 14.41 C ATOM 1688 C ILE A 107 -17.409 -4.248 -0.426 1.00 2.13 C ATOM 1689 O ILE A 107 -16.755 -4.606 0.555 1.00 22.40 O ATOM 1690 CB ILE A 107 -16.146 -3.326 -2.434 1.00 23.53 C ATOM 1691 CG1 ILE A 107 -16.176 -3.359 -3.971 1.00 64.42 C ATOM 1692 CG2 ILE A 107 -14.704 -3.374 -1.911 1.00 64.25 C ATOM 1693 CD1 ILE A 107 -15.305 -2.390 -4.759 1.00 0.43 C ATOM 0 H ILE A 107 -18.150 -4.331 -3.512 1.00 62.42 H new ATOM 0 HA ILE A 107 -16.205 -5.368 -1.792 1.00 14.41 H new ATOM 0 HB ILE A 107 -16.622 -2.396 -2.125 1.00 23.53 H new ATOM 0 HG12 ILE A 107 -15.905 -4.368 -4.281 1.00 64.42 H new ATOM 0 HG13 ILE A 107 -17.208 -3.197 -4.281 1.00 64.42 H new ATOM 0 HG21 ILE A 107 -14.143 -2.530 -2.312 1.00 64.25 H new ATOM 0 HG22 ILE A 107 -14.710 -3.321 -0.822 1.00 64.25 H new ATOM 0 HG23 ILE A 107 -14.233 -4.305 -2.226 1.00 64.25 H new ATOM 0 HD11 ILE A 107 -15.452 -2.554 -5.826 1.00 0.43 H new ATOM 0 HD12 ILE A 107 -15.581 -1.366 -4.508 1.00 0.43 H new ATOM 0 HD13 ILE A 107 -14.257 -2.556 -4.508 1.00 0.43 H new ATOM 1705 N ARG A 108 -18.595 -3.647 -0.296 1.00 0.01 N ATOM 1706 CA ARG A 108 -19.148 -3.328 1.008 1.00 13.13 C ATOM 1707 C ARG A 108 -19.557 -4.570 1.799 1.00 72.12 C ATOM 1708 O ARG A 108 -19.604 -4.474 3.023 1.00 21.50 O ATOM 1709 CB ARG A 108 -20.248 -2.273 0.844 1.00 44.34 C ATOM 1710 CG ARG A 108 -21.532 -2.687 0.123 1.00 3.45 C ATOM 1711 CD ARG A 108 -22.680 -3.004 1.081 1.00 25.30 C ATOM 1712 NE ARG A 108 -22.858 -4.449 1.168 1.00 5.13 N ATOM 1713 CZ ARG A 108 -23.428 -5.131 2.155 1.00 23.15 C ATOM 1714 NH1 ARG A 108 -23.896 -4.527 3.238 1.00 72.54 N ATOM 1715 NH2 ARG A 108 -23.498 -6.443 2.018 1.00 33.23 N ATOM 0 H ARG A 108 -19.185 -3.375 -1.082 1.00 0.01 H new ATOM 0 HA ARG A 108 -18.372 -2.886 1.634 1.00 13.13 H new ATOM 0 HB2 ARG A 108 -20.522 -1.917 1.837 1.00 44.34 H new ATOM 0 HB3 ARG A 108 -19.822 -1.425 0.308 1.00 44.34 H new ATOM 0 HG2 ARG A 108 -21.838 -1.886 -0.550 1.00 3.45 H new ATOM 0 HG3 ARG A 108 -21.329 -3.562 -0.494 1.00 3.45 H new ATOM 0 HD2 ARG A 108 -22.468 -2.593 2.068 1.00 25.30 H new ATOM 0 HD3 ARG A 108 -23.599 -2.534 0.731 1.00 25.30 H new ATOM 0 HE ARG A 108 -22.505 -4.997 0.383 1.00 5.13 H new ATOM 0 HH11 ARG A 108 -23.823 -3.514 3.329 1.00 72.54 H new ATOM 0 HH12 ARG A 108 -24.329 -5.076 3.981 1.00 72.54 H new ATOM 0 HH21 ARG A 108 -23.123 -6.889 1.181 1.00 33.23 H new ATOM 0 HH22 ARG A 108 -23.927 -7.010 2.749 1.00 33.23 H new ATOM 1729 N LYS A 109 -19.763 -5.732 1.155 1.00 63.25 N ATOM 1730 CA LYS A 109 -19.829 -7.026 1.855 1.00 2.42 C ATOM 1731 C LYS A 109 -18.556 -7.261 2.626 1.00 13.00 C ATOM 1732 O LYS A 109 -18.590 -7.449 3.833 1.00 15.51 O ATOM 1733 CB LYS A 109 -20.076 -8.227 0.908 1.00 0.35 C ATOM 1734 CG LYS A 109 -20.173 -9.554 1.691 1.00 12.33 C ATOM 1735 CD LYS A 109 -21.100 -10.602 1.050 1.00 74.31 C ATOM 1736 CE LYS A 109 -20.439 -11.735 0.256 1.00 71.22 C ATOM 1737 NZ LYS A 109 -19.573 -11.280 -0.846 1.00 43.01 N ATOM 0 H LYS A 109 -19.887 -5.801 0.145 1.00 63.25 H new ATOM 0 HA LYS A 109 -20.684 -6.965 2.528 1.00 2.42 H new ATOM 0 HB2 LYS A 109 -20.997 -8.066 0.347 1.00 0.35 H new ATOM 0 HB3 LYS A 109 -19.267 -8.291 0.181 1.00 0.35 H new ATOM 0 HG2 LYS A 109 -19.174 -9.980 1.786 1.00 12.33 H new ATOM 0 HG3 LYS A 109 -20.527 -9.342 2.700 1.00 12.33 H new ATOM 0 HD2 LYS A 109 -21.700 -11.051 1.842 1.00 74.31 H new ATOM 0 HD3 LYS A 109 -21.788 -10.081 0.385 1.00 74.31 H new ATOM 0 HE2 LYS A 109 -19.847 -12.344 0.939 1.00 71.22 H new ATOM 0 HE3 LYS A 109 -21.218 -12.379 -0.152 1.00 71.22 H new ATOM 0 HZ1 LYS A 109 -19.166 -12.105 -1.331 1.00 43.01 H new ATOM 0 HZ2 LYS A 109 -20.135 -10.723 -1.522 1.00 43.01 H new ATOM 0 HZ3 LYS A 109 -18.806 -10.690 -0.464 1.00 43.01 H new ATOM 1751 N VAL A 110 -17.434 -7.263 1.925 1.00 42.05 N ATOM 1752 CA VAL A 110 -16.170 -7.739 2.470 1.00 12.31 C ATOM 1753 C VAL A 110 -15.781 -6.983 3.742 1.00 13.13 C ATOM 1754 O VAL A 110 -15.269 -7.588 4.684 1.00 14.44 O ATOM 1755 CB VAL A 110 -15.076 -7.658 1.405 1.00 60.31 C ATOM 1756 CG1 VAL A 110 -13.766 -8.206 1.969 1.00 43.31 C ATOM 1757 CG2 VAL A 110 -15.460 -8.481 0.166 1.00 24.21 C ATOM 0 H VAL A 110 -17.372 -6.935 0.961 1.00 42.05 H new ATOM 0 HA VAL A 110 -16.292 -8.784 2.756 1.00 12.31 H new ATOM 0 HB VAL A 110 -14.957 -6.613 1.119 1.00 60.31 H new ATOM 0 HG11 VAL A 110 -12.989 -8.147 1.207 1.00 43.31 H new ATOM 0 HG12 VAL A 110 -13.469 -7.617 2.837 1.00 43.31 H new ATOM 0 HG13 VAL A 110 -13.904 -9.246 2.266 1.00 43.31 H new ATOM 0 HG21 VAL A 110 -14.667 -8.409 -0.579 1.00 24.21 H new ATOM 0 HG22 VAL A 110 -15.597 -9.524 0.450 1.00 24.21 H new ATOM 0 HG23 VAL A 110 -16.389 -8.094 -0.254 1.00 24.21 H new ATOM 1767 N PHE A 111 -16.057 -5.676 3.790 1.00 51.44 N ATOM 1768 CA PHE A 111 -15.900 -4.889 5.006 1.00 42.31 C ATOM 1769 C PHE A 111 -16.623 -5.593 6.168 1.00 61.55 C ATOM 1770 O PHE A 111 -16.001 -5.915 7.180 1.00 12.41 O ATOM 1771 CB PHE A 111 -16.412 -3.455 4.776 1.00 40.44 C ATOM 1772 CG PHE A 111 -15.366 -2.513 4.202 1.00 25.25 C ATOM 1773 CD1 PHE A 111 -14.895 -2.685 2.888 1.00 65.25 C ATOM 1774 CD2 PHE A 111 -14.828 -1.481 4.995 1.00 1.45 C ATOM 1775 CE1 PHE A 111 -13.880 -1.851 2.384 1.00 43.31 C ATOM 1776 CE2 PHE A 111 -13.837 -0.629 4.480 1.00 51.14 C ATOM 1777 CZ PHE A 111 -13.367 -0.809 3.171 1.00 43.11 C ATOM 0 H PHE A 111 -16.393 -5.141 2.989 1.00 51.44 H new ATOM 0 HA PHE A 111 -14.846 -4.812 5.271 1.00 42.31 H new ATOM 0 HB2 PHE A 111 -17.267 -3.489 4.100 1.00 40.44 H new ATOM 0 HB3 PHE A 111 -16.770 -3.051 5.723 1.00 40.44 H new ATOM 0 HD1 PHE A 111 -15.314 -3.460 2.263 1.00 65.25 H new ATOM 0 HD2 PHE A 111 -15.180 -1.344 6.007 1.00 1.45 H new ATOM 0 HE1 PHE A 111 -13.495 -2.013 1.388 1.00 43.31 H new ATOM 0 HE2 PHE A 111 -13.437 0.165 5.093 1.00 51.14 H new ATOM 0 HZ PHE A 111 -12.613 -0.148 2.770 1.00 43.11 H new ATOM 1787 N VAL A 112 -17.923 -5.856 6.024 1.00 31.23 N ATOM 1788 CA VAL A 112 -18.751 -6.478 7.059 1.00 4.14 C ATOM 1789 C VAL A 112 -18.281 -7.904 7.342 1.00 0.32 C ATOM 1790 O VAL A 112 -18.233 -8.302 8.506 1.00 20.31 O ATOM 1791 CB VAL A 112 -20.246 -6.443 6.668 1.00 23.43 C ATOM 1792 CG1 VAL A 112 -21.140 -6.980 7.797 1.00 2.20 C ATOM 1793 CG2 VAL A 112 -20.671 -5.009 6.334 1.00 74.12 C ATOM 0 H VAL A 112 -18.439 -5.639 5.171 1.00 31.23 H new ATOM 0 HA VAL A 112 -18.639 -5.902 7.978 1.00 4.14 H new ATOM 0 HB VAL A 112 -20.369 -7.083 5.794 1.00 23.43 H new ATOM 0 HG11 VAL A 112 -22.184 -6.940 7.485 1.00 2.20 H new ATOM 0 HG12 VAL A 112 -20.867 -8.012 8.018 1.00 2.20 H new ATOM 0 HG13 VAL A 112 -21.004 -6.370 8.690 1.00 2.20 H new ATOM 0 HG21 VAL A 112 -21.726 -4.997 6.060 1.00 74.12 H new ATOM 0 HG22 VAL A 112 -20.515 -4.371 7.204 1.00 74.12 H new ATOM 0 HG23 VAL A 112 -20.075 -4.638 5.500 1.00 74.12 H new ATOM 1803 N ASP A 113 -17.869 -8.653 6.319 1.00 73.21 N ATOM 1804 CA ASP A 113 -17.431 -10.043 6.460 1.00 4.51 C ATOM 1805 C ASP A 113 -16.222 -10.105 7.392 1.00 4.20 C ATOM 1806 O ASP A 113 -16.139 -10.956 8.279 1.00 41.51 O ATOM 1807 CB ASP A 113 -17.026 -10.604 5.090 1.00 31.21 C ATOM 1808 CG ASP A 113 -18.143 -11.296 4.313 1.00 11.14 C ATOM 1809 OD1 ASP A 113 -19.321 -10.938 4.493 1.00 14.44 O ATOM 1810 OD2 ASP A 113 -17.801 -12.152 3.457 1.00 1.53 O ATOM 0 H ASP A 113 -17.829 -8.309 5.360 1.00 73.21 H new ATOM 0 HA ASP A 113 -18.251 -10.632 6.871 1.00 4.51 H new ATOM 0 HB2 ASP A 113 -16.635 -9.788 4.483 1.00 31.21 H new ATOM 0 HB3 ASP A 113 -16.211 -11.314 5.233 1.00 31.21 H new ATOM 1815 N ALA A 114 -15.288 -9.167 7.213 1.00 4.02 N ATOM 1816 CA ALA A 114 -14.090 -9.005 8.025 1.00 43.22 C ATOM 1817 C ALA A 114 -14.385 -8.354 9.382 1.00 1.02 C ATOM 1818 O ALA A 114 -13.464 -8.074 10.157 1.00 43.33 O ATOM 1819 CB ALA A 114 -13.116 -8.136 7.239 1.00 12.11 C ATOM 0 H ALA A 114 -15.353 -8.474 6.467 1.00 4.02 H new ATOM 0 HA ALA A 114 -13.671 -9.989 8.235 1.00 43.22 H new ATOM 0 HB1 ALA A 114 -12.205 -7.994 7.820 1.00 12.11 H new ATOM 0 HB2 ALA A 114 -12.872 -8.624 6.295 1.00 12.11 H new ATOM 0 HB3 ALA A 114 -13.573 -7.167 7.039 1.00 12.11 H new ATOM 1825 N GLY A 115 -15.649 -8.076 9.684 1.00 3.11 N ATOM 1826 CA GLY A 115 -16.102 -7.541 10.947 1.00 45.02 C ATOM 1827 C GLY A 115 -16.004 -6.029 10.976 1.00 0.15 C ATOM 1828 O GLY A 115 -15.283 -5.477 11.806 1.00 53.05 O ATOM 0 H GLY A 115 -16.411 -8.226 9.023 1.00 3.11 H new ATOM 0 HA2 GLY A 115 -17.134 -7.843 11.122 1.00 45.02 H new ATOM 0 HA3 GLY A 115 -15.505 -7.961 11.757 1.00 45.02 H new ATOM 1832 N VAL A 116 -16.733 -5.354 10.092 1.00 11.11 N ATOM 1833 CA VAL A 116 -16.910 -3.906 10.139 1.00 1.41 C ATOM 1834 C VAL A 116 -18.392 -3.567 10.298 1.00 54.24 C ATOM 1835 O VAL A 116 -19.262 -4.246 9.741 1.00 23.13 O ATOM 1836 CB VAL A 116 -16.259 -3.255 8.905 1.00 42.44 C ATOM 1837 CG1 VAL A 116 -16.533 -1.757 8.830 1.00 54.41 C ATOM 1838 CG2 VAL A 116 -14.737 -3.477 8.879 1.00 51.24 C ATOM 0 H VAL A 116 -17.222 -5.801 9.316 1.00 11.11 H new ATOM 0 HA VAL A 116 -16.402 -3.491 11.010 1.00 1.41 H new ATOM 0 HB VAL A 116 -16.713 -3.742 8.042 1.00 42.44 H new ATOM 0 HG11 VAL A 116 -16.053 -1.343 7.943 1.00 54.41 H new ATOM 0 HG12 VAL A 116 -17.608 -1.586 8.774 1.00 54.41 H new ATOM 0 HG13 VAL A 116 -16.134 -1.269 9.719 1.00 54.41 H new ATOM 0 HG21 VAL A 116 -14.315 -3.002 7.993 1.00 51.24 H new ATOM 0 HG22 VAL A 116 -14.290 -3.040 9.772 1.00 51.24 H new ATOM 0 HG23 VAL A 116 -14.526 -4.546 8.853 1.00 51.24 H new ATOM 1848 N LYS A 117 -18.666 -2.483 11.036 1.00 74.25 N ATOM 1849 CA LYS A 117 -19.974 -1.861 11.136 1.00 41.01 C ATOM 1850 C LYS A 117 -20.385 -1.373 9.762 1.00 40.54 C ATOM 1851 O LYS A 117 -19.747 -0.487 9.177 1.00 42.03 O ATOM 1852 CB LYS A 117 -19.965 -0.689 12.133 1.00 73.31 C ATOM 1853 CG LYS A 117 -20.406 -1.130 13.533 1.00 71.32 C ATOM 1854 CD LYS A 117 -20.316 0.004 14.563 1.00 64.22 C ATOM 1855 CE LYS A 117 -18.876 0.263 15.025 1.00 60.22 C ATOM 1856 NZ LYS A 117 -18.571 1.699 15.188 1.00 24.35 N ATOM 0 H LYS A 117 -17.956 -2.008 11.593 1.00 74.25 H new ATOM 0 HA LYS A 117 -20.688 -2.597 11.504 1.00 41.01 H new ATOM 0 HB2 LYS A 117 -18.963 -0.263 12.185 1.00 73.31 H new ATOM 0 HB3 LYS A 117 -20.628 0.099 11.774 1.00 73.31 H new ATOM 0 HG2 LYS A 117 -21.432 -1.495 13.489 1.00 71.32 H new ATOM 0 HG3 LYS A 117 -19.785 -1.964 13.860 1.00 71.32 H new ATOM 0 HD2 LYS A 117 -20.725 0.917 14.131 1.00 64.22 H new ATOM 0 HD3 LYS A 117 -20.933 -0.244 15.427 1.00 64.22 H new ATOM 0 HE2 LYS A 117 -18.707 -0.248 15.973 1.00 60.22 H new ATOM 0 HE3 LYS A 117 -18.185 -0.170 14.302 1.00 60.22 H new ATOM 0 HZ1 LYS A 117 -17.586 1.811 15.501 1.00 24.35 H new ATOM 0 HZ2 LYS A 117 -18.703 2.187 14.279 1.00 24.35 H new ATOM 0 HZ3 LYS A 117 -19.209 2.111 15.899 1.00 24.35 H new ATOM 1870 N GLY A 118 -21.484 -1.923 9.280 1.00 20.11 N ATOM 1871 CA GLY A 118 -22.190 -1.418 8.136 1.00 73.33 C ATOM 1872 C GLY A 118 -22.701 -0.006 8.370 1.00 11.43 C ATOM 1873 O GLY A 118 -22.781 0.751 7.407 1.00 12.55 O ATOM 0 H GLY A 118 -21.914 -2.753 9.689 1.00 20.11 H new ATOM 0 HA2 GLY A 118 -21.531 -1.427 7.268 1.00 73.33 H new ATOM 0 HA3 GLY A 118 -23.029 -2.075 7.906 1.00 73.33 H new ATOM 1877 N GLU A 119 -22.994 0.379 9.621 1.00 23.34 N ATOM 1878 CA GLU A 119 -23.550 1.707 9.887 1.00 13.31 C ATOM 1879 C GLU A 119 -22.462 2.761 9.713 1.00 1.10 C ATOM 1880 O GLU A 119 -22.746 3.911 9.397 1.00 20.44 O ATOM 1881 CB GLU A 119 -24.257 1.782 11.254 1.00 44.45 C ATOM 1882 CG GLU A 119 -23.311 2.011 12.434 1.00 35.41 C ATOM 1883 CD GLU A 119 -24.052 2.137 13.762 1.00 23.23 C ATOM 1884 OE1 GLU A 119 -24.472 3.252 14.127 1.00 52.45 O ATOM 1885 OE2 GLU A 119 -24.137 1.144 14.515 1.00 0.30 O ATOM 0 H GLU A 119 -22.857 -0.201 10.449 1.00 23.34 H new ATOM 0 HA GLU A 119 -24.333 1.913 9.157 1.00 13.31 H new ATOM 0 HB2 GLU A 119 -24.990 2.588 11.228 1.00 44.45 H new ATOM 0 HB3 GLU A 119 -24.807 0.856 11.418 1.00 44.45 H new ATOM 0 HG2 GLU A 119 -22.603 1.184 12.494 1.00 35.41 H new ATOM 0 HG3 GLU A 119 -22.730 2.916 12.259 1.00 35.41 H new ATOM 1892 N ASP A 120 -21.206 2.352 9.893 1.00 25.25 N ATOM 1893 CA ASP A 120 -20.047 3.192 9.705 1.00 31.53 C ATOM 1894 C ASP A 120 -19.725 3.281 8.229 1.00 4.15 C ATOM 1895 O ASP A 120 -19.311 4.337 7.766 1.00 73.31 O ATOM 1896 CB ASP A 120 -18.847 2.561 10.415 1.00 64.55 C ATOM 1897 CG ASP A 120 -18.442 3.241 11.708 1.00 61.21 C ATOM 1898 OD1 ASP A 120 -18.441 4.489 11.763 1.00 4.54 O ATOM 1899 OD2 ASP A 120 -18.072 2.509 12.650 1.00 72.34 O ATOM 0 H ASP A 120 -20.972 1.402 10.181 1.00 25.25 H new ATOM 0 HA ASP A 120 -20.253 4.183 10.109 1.00 31.53 H new ATOM 0 HB2 ASP A 120 -19.076 1.517 10.627 1.00 64.55 H new ATOM 0 HB3 ASP A 120 -17.995 2.569 9.735 1.00 64.55 H new ATOM 1904 N TYR A 121 -19.857 2.167 7.508 1.00 74.33 N ATOM 1905 CA TYR A 121 -19.536 2.070 6.103 1.00 44.42 C ATOM 1906 C TYR A 121 -20.491 2.980 5.360 1.00 24.23 C ATOM 1907 O TYR A 121 -20.084 3.934 4.704 1.00 31.33 O ATOM 1908 CB TYR A 121 -19.671 0.620 5.615 1.00 41.41 C ATOM 1909 CG TYR A 121 -19.235 0.466 4.176 1.00 31.45 C ATOM 1910 CD1 TYR A 121 -20.105 0.809 3.121 1.00 4.43 C ATOM 1911 CD2 TYR A 121 -17.921 0.052 3.905 1.00 0.25 C ATOM 1912 CE1 TYR A 121 -19.637 0.780 1.797 1.00 24.43 C ATOM 1913 CE2 TYR A 121 -17.461 0.000 2.582 1.00 22.20 C ATOM 1914 CZ TYR A 121 -18.318 0.361 1.517 1.00 3.14 C ATOM 1915 OH TYR A 121 -17.908 0.258 0.225 1.00 1.34 O ATOM 0 H TYR A 121 -20.199 1.292 7.904 1.00 74.33 H new ATOM 0 HA TYR A 121 -18.504 2.372 5.923 1.00 44.42 H new ATOM 0 HB2 TYR A 121 -19.071 -0.033 6.248 1.00 41.41 H new ATOM 0 HB3 TYR A 121 -20.707 0.298 5.717 1.00 41.41 H new ATOM 0 HD1 TYR A 121 -21.126 1.093 3.330 1.00 4.43 H new ATOM 0 HD2 TYR A 121 -17.265 -0.226 4.716 1.00 0.25 H new ATOM 0 HE1 TYR A 121 -20.289 1.079 0.990 1.00 24.43 H new ATOM 0 HE2 TYR A 121 -16.449 -0.317 2.376 1.00 22.20 H new ATOM 0 HH TYR A 121 -17.731 1.152 -0.134 1.00 1.34 H new ATOM 1925 N ASP A 122 -21.778 2.688 5.513 1.00 14.14 N ATOM 1926 CA ASP A 122 -22.869 3.369 4.829 1.00 42.35 C ATOM 1927 C ASP A 122 -22.878 4.849 5.191 1.00 15.01 C ATOM 1928 O ASP A 122 -23.340 5.662 4.383 1.00 2.22 O ATOM 1929 CB ASP A 122 -24.230 2.772 5.223 1.00 31.33 C ATOM 1930 CG ASP A 122 -24.604 1.440 4.572 1.00 1.32 C ATOM 1931 OD1 ASP A 122 -23.875 0.951 3.671 1.00 32.41 O ATOM 1932 OD2 ASP A 122 -25.682 0.907 4.918 1.00 11.14 O ATOM 0 H ASP A 122 -22.100 1.947 6.136 1.00 14.14 H new ATOM 0 HA ASP A 122 -22.711 3.241 3.758 1.00 42.35 H new ATOM 0 HB2 ASP A 122 -24.244 2.639 6.305 1.00 31.33 H new ATOM 0 HB3 ASP A 122 -25.005 3.500 4.981 1.00 31.33 H new ATOM 1937 N ALA A 123 -22.397 5.213 6.388 1.00 12.13 N ATOM 1938 CA ALA A 123 -22.346 6.607 6.780 1.00 12.50 C ATOM 1939 C ALA A 123 -21.126 7.264 6.157 1.00 2.25 C ATOM 1940 O ALA A 123 -21.261 8.159 5.321 1.00 51.54 O ATOM 1941 CB ALA A 123 -22.332 6.731 8.306 1.00 73.45 C ATOM 0 H ALA A 123 -22.044 4.560 7.088 1.00 12.13 H new ATOM 0 HA ALA A 123 -23.236 7.121 6.418 1.00 12.50 H new ATOM 0 HB1 ALA A 123 -22.294 7.784 8.585 1.00 73.45 H new ATOM 0 HB2 ALA A 123 -23.235 6.280 8.716 1.00 73.45 H new ATOM 0 HB3 ALA A 123 -21.457 6.218 8.705 1.00 73.45 H new ATOM 1947 N ALA A 124 -19.937 6.806 6.559 1.00 53.03 N ATOM 1948 CA ALA A 124 -18.680 7.420 6.197 1.00 41.11 C ATOM 1949 C ALA A 124 -18.564 7.534 4.686 1.00 64.22 C ATOM 1950 O ALA A 124 -18.146 8.591 4.229 1.00 73.13 O ATOM 1951 CB ALA A 124 -17.504 6.659 6.804 1.00 74.52 C ATOM 0 H ALA A 124 -19.831 5.984 7.154 1.00 53.03 H new ATOM 0 HA ALA A 124 -18.652 8.429 6.609 1.00 41.11 H new ATOM 0 HB1 ALA A 124 -16.570 7.142 6.516 1.00 74.52 H new ATOM 0 HB2 ALA A 124 -17.592 6.659 7.890 1.00 74.52 H new ATOM 0 HB3 ALA A 124 -17.508 5.632 6.440 1.00 74.52 H new ATOM 1957 N TRP A 125 -18.998 6.518 3.925 1.00 52.43 N ATOM 1958 CA TRP A 125 -18.947 6.497 2.464 1.00 1.30 C ATOM 1959 C TRP A 125 -19.474 7.785 1.836 1.00 1.41 C ATOM 1960 O TRP A 125 -18.940 8.245 0.825 1.00 2.31 O ATOM 1961 CB TRP A 125 -19.736 5.283 1.942 1.00 40.43 C ATOM 1962 CG TRP A 125 -19.719 5.101 0.450 1.00 72.45 C ATOM 1963 CD1 TRP A 125 -20.549 5.676 -0.449 1.00 35.12 C ATOM 1964 CD2 TRP A 125 -18.774 4.328 -0.341 1.00 4.05 C ATOM 1965 NE1 TRP A 125 -20.146 5.353 -1.732 1.00 31.30 N ATOM 1966 CE2 TRP A 125 -19.010 4.573 -1.724 1.00 2.22 C ATOM 1967 CE3 TRP A 125 -17.726 3.452 -0.013 1.00 45.21 C ATOM 1968 CZ2 TRP A 125 -18.195 4.033 -2.731 1.00 75.23 C ATOM 1969 CZ3 TRP A 125 -16.892 2.919 -1.008 1.00 64.43 C ATOM 1970 CH2 TRP A 125 -17.119 3.209 -2.364 1.00 44.33 C ATOM 0 H TRP A 125 -19.403 5.670 4.322 1.00 52.43 H new ATOM 0 HA TRP A 125 -17.900 6.416 2.172 1.00 1.30 H new ATOM 0 HB2 TRP A 125 -19.334 4.382 2.406 1.00 40.43 H new ATOM 0 HB3 TRP A 125 -20.772 5.375 2.269 1.00 40.43 H new ATOM 0 HD1 TRP A 125 -21.399 6.295 -0.202 1.00 35.12 H new ATOM 0 HE1 TRP A 125 -20.629 5.654 -2.578 1.00 31.30 H new ATOM 0 HE3 TRP A 125 -17.560 3.185 1.020 1.00 45.21 H new ATOM 0 HZ2 TRP A 125 -18.392 4.248 -3.771 1.00 75.23 H new ATOM 0 HZ3 TRP A 125 -16.068 2.280 -0.729 1.00 64.43 H new ATOM 0 HH2 TRP A 125 -16.468 2.799 -3.122 1.00 44.33 H new ATOM 1981 N ASN A 126 -20.522 8.359 2.427 1.00 34.14 N ATOM 1982 CA ASN A 126 -21.216 9.530 1.919 1.00 55.55 C ATOM 1983 C ASN A 126 -20.864 10.780 2.733 1.00 33.45 C ATOM 1984 O ASN A 126 -21.308 11.867 2.373 1.00 14.33 O ATOM 1985 CB ASN A 126 -22.734 9.276 1.910 1.00 51.03 C ATOM 1986 CG ASN A 126 -23.119 8.017 1.145 1.00 35.23 C ATOM 1987 OD1 ASN A 126 -23.181 7.992 -0.084 1.00 12.21 O ATOM 1988 ND2 ASN A 126 -23.359 6.929 1.854 1.00 73.33 N ATOM 0 H ASN A 126 -20.919 8.007 3.298 1.00 34.14 H new ATOM 0 HA ASN A 126 -20.890 9.712 0.895 1.00 55.55 H new ATOM 0 HB2 ASN A 126 -23.090 9.194 2.937 1.00 51.03 H new ATOM 0 HB3 ASN A 126 -23.238 10.134 1.465 1.00 51.03 H new ATOM 0 HD21 ASN A 126 -23.599 6.056 1.384 1.00 73.33 H new ATOM 0 HD22 ASN A 126 -23.305 6.961 2.872 1.00 73.33 H new ATOM 1995 N SER A 127 -20.096 10.651 3.813 1.00 24.33 N ATOM 1996 CA SER A 127 -19.744 11.707 4.751 1.00 41.44 C ATOM 1997 C SER A 127 -18.470 12.422 4.274 1.00 23.10 C ATOM 1998 O SER A 127 -17.587 11.804 3.666 1.00 25.12 O ATOM 1999 CB SER A 127 -19.545 11.036 6.119 1.00 4.03 C ATOM 2000 OG SER A 127 -19.453 11.940 7.200 1.00 55.03 O ATOM 0 H SER A 127 -19.681 9.755 4.068 1.00 24.33 H new ATOM 0 HA SER A 127 -20.524 12.465 4.821 1.00 41.44 H new ATOM 0 HB2 SER A 127 -20.375 10.354 6.300 1.00 4.03 H new ATOM 0 HB3 SER A 127 -18.638 10.433 6.087 1.00 4.03 H new ATOM 0 HG SER A 127 -19.329 11.441 8.034 1.00 55.03 H new ATOM 2006 N PHE A 128 -18.342 13.718 4.592 1.00 2.00 N ATOM 2007 CA PHE A 128 -17.221 14.594 4.224 1.00 71.33 C ATOM 2008 C PHE A 128 -15.871 13.959 4.571 1.00 34.41 C ATOM 2009 O PHE A 128 -14.915 14.137 3.822 1.00 52.22 O ATOM 2010 CB PHE A 128 -17.367 15.954 4.935 1.00 62.32 C ATOM 2011 CG PHE A 128 -16.494 17.100 4.439 1.00 73.15 C ATOM 2012 CD1 PHE A 128 -15.102 17.042 4.594 1.00 21.14 C ATOM 2013 CD2 PHE A 128 -17.066 18.256 3.873 1.00 22.20 C ATOM 2014 CE1 PHE A 128 -14.286 18.078 4.112 1.00 5.43 C ATOM 2015 CE2 PHE A 128 -16.253 19.313 3.429 1.00 21.31 C ATOM 2016 CZ PHE A 128 -14.858 19.221 3.532 1.00 24.34 C ATOM 0 H PHE A 128 -19.051 14.207 5.139 1.00 2.00 H new ATOM 0 HA PHE A 128 -17.248 14.742 3.144 1.00 71.33 H new ATOM 0 HB2 PHE A 128 -18.409 16.265 4.857 1.00 62.32 H new ATOM 0 HB3 PHE A 128 -17.158 15.805 5.994 1.00 62.32 H new ATOM 0 HD1 PHE A 128 -14.653 16.193 5.088 1.00 21.14 H new ATOM 0 HD2 PHE A 128 -18.139 18.331 3.779 1.00 22.20 H new ATOM 0 HE1 PHE A 128 -13.212 17.995 4.188 1.00 5.43 H new ATOM 0 HE2 PHE A 128 -16.704 20.199 3.007 1.00 21.31 H new ATOM 0 HZ PHE A 128 -14.230 20.021 3.169 1.00 24.34 H new ATOM 2026 N VAL A 129 -15.798 13.191 5.660 1.00 13.43 N ATOM 2027 CA VAL A 129 -14.621 12.453 6.108 1.00 32.24 C ATOM 2028 C VAL A 129 -13.993 11.735 4.925 1.00 44.22 C ATOM 2029 O VAL A 129 -12.836 11.984 4.568 1.00 44.02 O ATOM 2030 CB VAL A 129 -15.066 11.498 7.236 1.00 14.13 C ATOM 2031 CG1 VAL A 129 -13.963 10.531 7.684 1.00 5.54 C ATOM 2032 CG2 VAL A 129 -15.536 12.352 8.420 1.00 33.33 C ATOM 0 H VAL A 129 -16.597 13.062 6.281 1.00 13.43 H new ATOM 0 HA VAL A 129 -13.852 13.114 6.508 1.00 32.24 H new ATOM 0 HB VAL A 129 -15.872 10.872 6.853 1.00 14.13 H new ATOM 0 HG11 VAL A 129 -14.343 9.889 8.479 1.00 5.54 H new ATOM 0 HG12 VAL A 129 -13.652 9.917 6.839 1.00 5.54 H new ATOM 0 HG13 VAL A 129 -13.109 11.099 8.054 1.00 5.54 H new ATOM 0 HG21 VAL A 129 -15.857 11.701 9.233 1.00 33.33 H new ATOM 0 HG22 VAL A 129 -14.715 12.983 8.762 1.00 33.33 H new ATOM 0 HG23 VAL A 129 -16.370 12.980 8.107 1.00 33.33 H new ATOM 2042 N VAL A 130 -14.791 10.860 4.311 1.00 62.32 N ATOM 2043 CA VAL A 130 -14.337 10.104 3.164 1.00 4.22 C ATOM 2044 C VAL A 130 -14.060 11.053 2.023 1.00 2.32 C ATOM 2045 O VAL A 130 -13.019 10.914 1.410 1.00 2.43 O ATOM 2046 CB VAL A 130 -15.371 9.029 2.808 1.00 23.10 C ATOM 2047 CG1 VAL A 130 -15.242 8.444 1.399 1.00 42.53 C ATOM 2048 CG2 VAL A 130 -15.295 7.892 3.849 1.00 13.05 C ATOM 0 H VAL A 130 -15.751 10.664 4.595 1.00 62.32 H new ATOM 0 HA VAL A 130 -13.406 9.583 3.390 1.00 4.22 H new ATOM 0 HB VAL A 130 -16.339 9.530 2.824 1.00 23.10 H new ATOM 0 HG11 VAL A 130 -16.017 7.694 1.244 1.00 42.53 H new ATOM 0 HG12 VAL A 130 -15.355 9.240 0.663 1.00 42.53 H new ATOM 0 HG13 VAL A 130 -14.262 7.982 1.285 1.00 42.53 H new ATOM 0 HG21 VAL A 130 -16.028 7.123 3.603 1.00 13.05 H new ATOM 0 HG22 VAL A 130 -14.296 7.457 3.840 1.00 13.05 H new ATOM 0 HG23 VAL A 130 -15.508 8.292 4.840 1.00 13.05 H new ATOM 2058 N LYS A 131 -14.933 12.009 1.720 1.00 44.31 N ATOM 2059 CA LYS A 131 -14.762 12.934 0.607 1.00 21.21 C ATOM 2060 C LYS A 131 -13.369 13.573 0.642 1.00 0.05 C ATOM 2061 O LYS A 131 -12.639 13.528 -0.346 1.00 11.41 O ATOM 2062 CB LYS A 131 -15.876 13.982 0.647 1.00 2.02 C ATOM 2063 CG LYS A 131 -17.316 13.452 0.624 1.00 40.03 C ATOM 2064 CD LYS A 131 -17.669 12.544 -0.561 1.00 15.12 C ATOM 2065 CE LYS A 131 -17.624 13.342 -1.868 1.00 2.41 C ATOM 2066 NZ LYS A 131 -17.877 12.515 -3.061 1.00 73.44 N ATOM 0 H LYS A 131 -15.791 12.164 2.249 1.00 44.31 H new ATOM 0 HA LYS A 131 -14.835 12.392 -0.336 1.00 21.21 H new ATOM 0 HB2 LYS A 131 -15.748 14.582 1.548 1.00 2.02 H new ATOM 0 HB3 LYS A 131 -15.745 14.651 -0.203 1.00 2.02 H new ATOM 0 HG2 LYS A 131 -17.496 12.901 1.547 1.00 40.03 H new ATOM 0 HG3 LYS A 131 -17.997 14.303 0.622 1.00 40.03 H new ATOM 0 HD2 LYS A 131 -16.969 11.710 -0.611 1.00 15.12 H new ATOM 0 HD3 LYS A 131 -18.663 12.119 -0.420 1.00 15.12 H new ATOM 0 HE2 LYS A 131 -18.364 14.141 -1.824 1.00 2.41 H new ATOM 0 HE3 LYS A 131 -16.647 13.817 -1.963 1.00 2.41 H new ATOM 0 HZ1 LYS A 131 -17.833 13.111 -3.912 1.00 73.44 H new ATOM 0 HZ2 LYS A 131 -17.157 11.767 -3.124 1.00 73.44 H new ATOM 0 HZ3 LYS A 131 -18.820 12.082 -2.990 1.00 73.44 H new ATOM 2080 N SER A 132 -12.958 14.117 1.786 1.00 44.02 N ATOM 2081 CA SER A 132 -11.652 14.737 1.940 1.00 54.11 C ATOM 2082 C SER A 132 -10.566 13.675 1.898 1.00 42.34 C ATOM 2083 O SER A 132 -9.507 13.950 1.340 1.00 24.21 O ATOM 2084 CB SER A 132 -11.624 15.496 3.268 1.00 15.45 C ATOM 2085 OG SER A 132 -10.512 16.369 3.305 1.00 55.13 O ATOM 0 H SER A 132 -13.527 14.138 2.633 1.00 44.02 H new ATOM 0 HA SER A 132 -11.468 15.436 1.124 1.00 54.11 H new ATOM 0 HB2 SER A 132 -12.546 16.064 3.391 1.00 15.45 H new ATOM 0 HB3 SER A 132 -11.571 14.791 4.098 1.00 15.45 H new ATOM 0 HG SER A 132 -10.503 16.852 4.158 1.00 55.13 H new ATOM 2091 N LEU A 133 -10.799 12.479 2.434 1.00 34.23 N ATOM 2092 CA LEU A 133 -9.825 11.414 2.382 1.00 24.13 C ATOM 2093 C LEU A 133 -9.547 10.950 0.943 1.00 21.20 C ATOM 2094 O LEU A 133 -8.395 10.700 0.588 1.00 12.41 O ATOM 2095 CB LEU A 133 -10.203 10.249 3.274 1.00 31.30 C ATOM 2096 CG LEU A 133 -10.026 10.473 4.786 1.00 73.24 C ATOM 2097 CD1 LEU A 133 -10.676 9.346 5.587 1.00 11.11 C ATOM 2098 CD2 LEU A 133 -8.543 10.523 5.114 1.00 5.30 C ATOM 0 H LEU A 133 -11.665 12.231 2.912 1.00 34.23 H new ATOM 0 HA LEU A 133 -8.896 11.831 2.771 1.00 24.13 H new ATOM 0 HB2 LEU A 133 -11.246 9.995 3.084 1.00 31.30 H new ATOM 0 HB3 LEU A 133 -9.606 9.385 2.982 1.00 31.30 H new ATOM 0 HG LEU A 133 -10.508 11.413 5.054 1.00 73.24 H new ATOM 0 HD11 LEU A 133 -10.536 9.529 6.652 1.00 11.11 H new ATOM 0 HD12 LEU A 133 -11.742 9.308 5.362 1.00 11.11 H new ATOM 0 HD13 LEU A 133 -10.214 8.396 5.319 1.00 11.11 H new ATOM 0 HD21 LEU A 133 -8.412 10.682 6.184 1.00 5.30 H new ATOM 0 HD22 LEU A 133 -8.075 9.581 4.827 1.00 5.30 H new ATOM 0 HD23 LEU A 133 -8.077 11.342 4.566 1.00 5.30 H new ATOM 2110 N VAL A 134 -10.579 10.916 0.099 1.00 63.25 N ATOM 2111 CA VAL A 134 -10.433 10.634 -1.332 1.00 52.14 C ATOM 2112 C VAL A 134 -9.454 11.635 -1.906 1.00 12.14 C ATOM 2113 O VAL A 134 -8.508 11.215 -2.554 1.00 35.12 O ATOM 2114 CB VAL A 134 -11.766 10.646 -2.112 1.00 44.04 C ATOM 2115 CG1 VAL A 134 -11.549 10.240 -3.581 1.00 43.13 C ATOM 2116 CG2 VAL A 134 -12.792 9.666 -1.515 1.00 52.23 C ATOM 0 H VAL A 134 -11.543 11.084 0.388 1.00 63.25 H new ATOM 0 HA VAL A 134 -10.060 9.616 -1.441 1.00 52.14 H new ATOM 0 HB VAL A 134 -12.145 11.666 -2.043 1.00 44.04 H new ATOM 0 HG11 VAL A 134 -12.503 10.257 -4.108 1.00 43.13 H new ATOM 0 HG12 VAL A 134 -10.861 10.941 -4.054 1.00 43.13 H new ATOM 0 HG13 VAL A 134 -11.129 9.235 -3.622 1.00 43.13 H new ATOM 0 HG21 VAL A 134 -13.714 9.707 -2.094 1.00 52.23 H new ATOM 0 HG22 VAL A 134 -12.389 8.654 -1.546 1.00 52.23 H new ATOM 0 HG23 VAL A 134 -13.000 9.942 -0.481 1.00 52.23 H new ATOM 2126 N ALA A 135 -9.636 12.928 -1.630 1.00 12.10 N ATOM 2127 CA ALA A 135 -8.758 13.955 -2.162 1.00 2.15 C ATOM 2128 C ALA A 135 -7.293 13.678 -1.819 1.00 42.53 C ATOM 2129 O ALA A 135 -6.444 13.701 -2.712 1.00 34.22 O ATOM 2130 CB ALA A 135 -9.192 15.312 -1.621 1.00 23.14 C ATOM 0 H ALA A 135 -10.388 13.283 -1.039 1.00 12.10 H new ATOM 0 HA ALA A 135 -8.836 13.953 -3.249 1.00 2.15 H new ATOM 0 HB1 ALA A 135 -8.537 16.088 -2.017 1.00 23.14 H new ATOM 0 HB2 ALA A 135 -10.219 15.514 -1.926 1.00 23.14 H new ATOM 0 HB3 ALA A 135 -9.131 15.306 -0.533 1.00 23.14 H new ATOM 2136 N GLN A 136 -7.011 13.405 -0.536 1.00 0.21 N ATOM 2137 CA GLN A 136 -5.637 13.252 -0.052 1.00 63.45 C ATOM 2138 C GLN A 136 -4.892 12.125 -0.791 1.00 62.14 C ATOM 2139 O GLN A 136 -3.679 12.211 -1.005 1.00 75.24 O ATOM 2140 CB GLN A 136 -5.582 13.165 1.487 1.00 4.40 C ATOM 2141 CG GLN A 136 -6.110 11.868 2.036 1.00 44.21 C ATOM 2142 CD GLN A 136 -5.569 11.375 3.382 1.00 44.44 C ATOM 2143 OE1 GLN A 136 -5.566 10.175 3.632 1.00 14.05 O ATOM 2144 NE2 GLN A 136 -5.186 12.247 4.302 1.00 40.03 N ATOM 0 H GLN A 136 -7.722 13.286 0.185 1.00 0.21 H new ATOM 0 HA GLN A 136 -5.083 14.157 -0.300 1.00 63.45 H new ATOM 0 HB2 GLN A 136 -4.550 13.295 1.813 1.00 4.40 H new ATOM 0 HB3 GLN A 136 -6.156 13.989 1.910 1.00 4.40 H new ATOM 0 HG2 GLN A 136 -7.192 11.961 2.127 1.00 44.21 H new ATOM 0 HG3 GLN A 136 -5.918 11.091 1.296 1.00 44.21 H new ATOM 0 HE21 GLN A 136 -5.189 13.245 4.091 1.00 40.03 H new ATOM 0 HE22 GLN A 136 -4.888 11.921 5.221 1.00 40.03 H new ATOM 2153 N GLN A 137 -5.649 11.084 -1.142 1.00 13.20 N ATOM 2154 CA GLN A 137 -5.183 9.837 -1.736 1.00 34.45 C ATOM 2155 C GLN A 137 -5.169 9.925 -3.262 1.00 12.33 C ATOM 2156 O GLN A 137 -4.177 9.569 -3.889 1.00 20.44 O ATOM 2157 CB GLN A 137 -6.101 8.704 -1.242 1.00 45.34 C ATOM 2158 CG GLN A 137 -5.729 8.303 0.193 1.00 5.43 C ATOM 2159 CD GLN A 137 -6.897 7.758 0.995 1.00 22.14 C ATOM 2160 OE1 GLN A 137 -7.635 6.897 0.528 1.00 23.20 O ATOM 2161 NE2 GLN A 137 -7.084 8.195 2.227 1.00 13.31 N ATOM 0 H GLN A 137 -6.660 11.093 -1.010 1.00 13.20 H new ATOM 0 HA GLN A 137 -4.156 9.636 -1.430 1.00 34.45 H new ATOM 0 HB2 GLN A 137 -7.141 9.028 -1.278 1.00 45.34 H new ATOM 0 HB3 GLN A 137 -6.013 7.841 -1.902 1.00 45.34 H new ATOM 0 HG2 GLN A 137 -4.941 7.551 0.158 1.00 5.43 H new ATOM 0 HG3 GLN A 137 -5.319 9.171 0.709 1.00 5.43 H new ATOM 0 HE21 GLN A 137 -6.469 8.911 2.613 1.00 13.31 H new ATOM 0 HE22 GLN A 137 -7.844 7.816 2.793 1.00 13.31 H new ATOM 2170 N GLU A 138 -6.252 10.402 -3.874 1.00 3.30 N ATOM 2171 CA GLU A 138 -6.417 10.459 -5.321 1.00 1.01 C ATOM 2172 C GLU A 138 -5.351 11.379 -5.911 1.00 74.43 C ATOM 2173 O GLU A 138 -4.670 11.004 -6.867 1.00 43.45 O ATOM 2174 CB GLU A 138 -7.865 10.860 -5.689 1.00 1.10 C ATOM 2175 CG GLU A 138 -8.161 12.369 -5.723 1.00 14.12 C ATOM 2176 CD GLU A 138 -9.642 12.719 -5.895 1.00 60.42 C ATOM 2177 OE1 GLU A 138 -10.340 12.073 -6.707 1.00 74.43 O ATOM 2178 OE2 GLU A 138 -10.137 13.671 -5.244 1.00 14.43 O ATOM 0 H GLU A 138 -7.056 10.767 -3.363 1.00 3.30 H new ATOM 0 HA GLU A 138 -6.268 9.474 -5.762 1.00 1.01 H new ATOM 0 HB2 GLU A 138 -8.098 10.442 -6.668 1.00 1.10 H new ATOM 0 HB3 GLU A 138 -8.543 10.393 -4.974 1.00 1.10 H new ATOM 0 HG2 GLU A 138 -7.799 12.819 -4.799 1.00 14.12 H new ATOM 0 HG3 GLU A 138 -7.596 12.819 -6.539 1.00 14.12 H new ATOM 2185 N LYS A 139 -5.157 12.558 -5.308 1.00 13.41 N ATOM 2186 CA LYS A 139 -4.139 13.500 -5.741 1.00 35.30 C ATOM 2187 C LYS A 139 -2.780 12.822 -5.665 1.00 52.34 C ATOM 2188 O LYS A 139 -2.018 12.877 -6.624 1.00 51.03 O ATOM 2189 CB LYS A 139 -4.216 14.761 -4.868 1.00 3.00 C ATOM 2190 CG LYS A 139 -3.138 15.782 -5.272 1.00 34.32 C ATOM 2191 CD LYS A 139 -3.581 17.224 -5.003 1.00 33.52 C ATOM 2192 CE LYS A 139 -4.603 17.665 -6.058 1.00 12.00 C ATOM 2193 NZ LYS A 139 -5.479 18.748 -5.577 1.00 74.15 N ATOM 0 H LYS A 139 -5.704 12.878 -4.509 1.00 13.41 H new ATOM 0 HA LYS A 139 -4.300 13.808 -6.774 1.00 35.30 H new ATOM 0 HB2 LYS A 139 -5.203 15.213 -4.963 1.00 3.00 H new ATOM 0 HB3 LYS A 139 -4.090 14.490 -3.820 1.00 3.00 H new ATOM 0 HG2 LYS A 139 -2.220 15.576 -4.721 1.00 34.32 H new ATOM 0 HG3 LYS A 139 -2.907 15.665 -6.331 1.00 34.32 H new ATOM 0 HD2 LYS A 139 -4.019 17.299 -4.007 1.00 33.52 H new ATOM 0 HD3 LYS A 139 -2.717 17.888 -5.022 1.00 33.52 H new ATOM 0 HE2 LYS A 139 -4.076 17.998 -6.952 1.00 12.00 H new ATOM 0 HE3 LYS A 139 -5.214 16.810 -6.348 1.00 12.00 H new ATOM 0 HZ1 LYS A 139 -6.151 19.010 -6.326 1.00 74.15 H new ATOM 0 HZ2 LYS A 139 -6.003 18.424 -4.739 1.00 74.15 H new ATOM 0 HZ3 LYS A 139 -4.902 19.576 -5.325 1.00 74.15 H new ATOM 2207 N ALA A 140 -2.516 12.141 -4.554 1.00 51.32 N ATOM 2208 CA ALA A 140 -1.231 11.528 -4.276 1.00 13.35 C ATOM 2209 C ALA A 140 -0.865 10.398 -5.251 1.00 0.23 C ATOM 2210 O ALA A 140 0.277 9.959 -5.237 1.00 13.23 O ATOM 2211 CB ALA A 140 -1.231 11.064 -2.820 1.00 42.42 C ATOM 0 H ALA A 140 -3.203 12.000 -3.813 1.00 51.32 H new ATOM 0 HA ALA A 140 -0.449 12.272 -4.429 1.00 13.35 H new ATOM 0 HB1 ALA A 140 -0.273 10.599 -2.586 1.00 42.42 H new ATOM 0 HB2 ALA A 140 -1.387 11.921 -2.165 1.00 42.42 H new ATOM 0 HB3 ALA A 140 -2.032 10.341 -2.669 1.00 42.42 H new ATOM 2217 N ALA A 141 -1.762 9.934 -6.128 1.00 13.11 N ATOM 2218 CA ALA A 141 -1.430 8.941 -7.153 1.00 73.51 C ATOM 2219 C ALA A 141 -1.682 9.444 -8.573 1.00 43.14 C ATOM 2220 O ALA A 141 -1.526 8.676 -9.525 1.00 3.14 O ATOM 2221 CB ALA A 141 -2.219 7.660 -6.875 1.00 62.44 C ATOM 0 H ALA A 141 -2.736 10.236 -6.147 1.00 13.11 H new ATOM 0 HA ALA A 141 -0.360 8.741 -7.096 1.00 73.51 H new ATOM 0 HB1 ALA A 141 -1.979 6.914 -7.632 1.00 62.44 H new ATOM 0 HB2 ALA A 141 -1.954 7.276 -5.890 1.00 62.44 H new ATOM 0 HB3 ALA A 141 -3.287 7.877 -6.904 1.00 62.44 H new ATOM 2227 N ALA A 142 -2.051 10.714 -8.732 1.00 54.52 N ATOM 2228 CA ALA A 142 -2.304 11.333 -10.026 1.00 75.23 C ATOM 2229 C ALA A 142 -1.534 12.642 -10.209 1.00 23.54 C ATOM 2230 O ALA A 142 -1.625 13.233 -11.286 1.00 15.51 O ATOM 2231 CB ALA A 142 -3.808 11.545 -10.169 1.00 11.22 C ATOM 0 H ALA A 142 -2.184 11.352 -7.947 1.00 54.52 H new ATOM 0 HA ALA A 142 -1.944 10.669 -10.812 1.00 75.23 H new ATOM 0 HB1 ALA A 142 -4.020 12.008 -11.133 1.00 11.22 H new ATOM 0 HB2 ALA A 142 -4.318 10.584 -10.108 1.00 11.22 H new ATOM 0 HB3 ALA A 142 -4.162 12.195 -9.368 1.00 11.22 H new ATOM 2237 N ASP A 143 -0.808 13.078 -9.171 1.00 51.22 N ATOM 2238 CA ASP A 143 0.026 14.273 -9.099 1.00 61.11 C ATOM 2239 C ASP A 143 1.066 14.253 -10.221 1.00 3.44 C ATOM 2240 O ASP A 143 0.778 14.782 -11.292 1.00 72.34 O ATOM 2241 CB ASP A 143 0.620 14.357 -7.680 1.00 71.24 C ATOM 2242 CG ASP A 143 1.740 15.385 -7.551 1.00 1.02 C ATOM 2243 OD1 ASP A 143 1.443 16.583 -7.353 1.00 2.45 O ATOM 2244 OD2 ASP A 143 2.915 14.970 -7.632 1.00 60.24 O ATOM 0 H ASP A 143 -0.791 12.559 -8.293 1.00 51.22 H new ATOM 0 HA ASP A 143 -0.552 15.183 -9.261 1.00 61.11 H new ATOM 0 HB2 ASP A 143 -0.174 14.606 -6.976 1.00 71.24 H new ATOM 0 HB3 ASP A 143 1.002 13.377 -7.396 1.00 71.24 H new ATOM 2249 N LEU A 144 2.220 13.602 -10.017 1.00 75.31 N ATOM 2250 CA LEU A 144 3.294 13.423 -10.997 1.00 61.42 C ATOM 2251 C LEU A 144 4.465 12.640 -10.388 1.00 23.23 C ATOM 2252 O LEU A 144 5.623 12.997 -10.610 1.00 4.00 O ATOM 2253 CB LEU A 144 3.716 14.755 -11.679 1.00 55.01 C ATOM 2254 CG LEU A 144 3.940 16.003 -10.794 1.00 21.50 C ATOM 2255 CD1 LEU A 144 5.209 15.940 -9.941 1.00 60.43 C ATOM 2256 CD2 LEU A 144 4.011 17.242 -11.693 1.00 14.45 C ATOM 0 H LEU A 144 2.438 13.166 -9.121 1.00 75.31 H new ATOM 0 HA LEU A 144 2.903 12.814 -11.812 1.00 61.42 H new ATOM 0 HB2 LEU A 144 4.640 14.568 -12.227 1.00 55.01 H new ATOM 0 HB3 LEU A 144 2.953 15.005 -12.416 1.00 55.01 H new ATOM 0 HG LEU A 144 3.099 16.049 -10.102 1.00 21.50 H new ATOM 0 HD11 LEU A 144 5.295 16.851 -9.349 1.00 60.43 H new ATOM 0 HD12 LEU A 144 5.158 15.078 -9.275 1.00 60.43 H new ATOM 0 HD13 LEU A 144 6.079 15.845 -10.590 1.00 60.43 H new ATOM 0 HD21 LEU A 144 4.169 18.129 -11.079 1.00 14.45 H new ATOM 0 HD22 LEU A 144 4.838 17.135 -12.395 1.00 14.45 H new ATOM 0 HD23 LEU A 144 3.077 17.345 -12.245 1.00 14.45 H new ATOM 2268 N GLN A 145 4.196 11.585 -9.601 1.00 34.10 N ATOM 2269 CA GLN A 145 5.259 10.895 -8.864 1.00 72.53 C ATOM 2270 C GLN A 145 5.207 9.362 -8.968 1.00 11.20 C ATOM 2271 O GLN A 145 6.248 8.760 -9.218 1.00 5.43 O ATOM 2272 CB GLN A 145 5.369 11.448 -7.426 1.00 24.40 C ATOM 2273 CG GLN A 145 4.065 11.736 -6.678 1.00 20.54 C ATOM 2274 CD GLN A 145 3.259 10.469 -6.499 1.00 43.13 C ATOM 2275 OE1 GLN A 145 3.697 9.546 -5.824 1.00 32.34 O ATOM 2276 NE2 GLN A 145 2.164 10.311 -7.240 1.00 42.04 N ATOM 0 H GLN A 145 3.263 11.198 -9.462 1.00 34.10 H new ATOM 0 HA GLN A 145 6.202 11.126 -9.359 1.00 72.53 H new ATOM 0 HB2 GLN A 145 5.946 10.736 -6.835 1.00 24.40 H new ATOM 0 HB3 GLN A 145 5.946 12.372 -7.464 1.00 24.40 H new ATOM 0 HG2 GLN A 145 4.288 12.172 -5.704 1.00 20.54 H new ATOM 0 HG3 GLN A 145 3.479 12.471 -7.229 1.00 20.54 H new ATOM 0 HE21 GLN A 145 1.809 11.088 -7.798 1.00 42.04 H new ATOM 0 HE22 GLN A 145 1.680 9.413 -7.250 1.00 42.04 H new ATOM 2285 N LEU A 146 4.035 8.739 -8.818 1.00 51.12 N ATOM 2286 CA LEU A 146 3.862 7.306 -8.604 1.00 0.30 C ATOM 2287 C LEU A 146 3.849 6.587 -9.938 1.00 45.33 C ATOM 2288 O LEU A 146 4.892 6.149 -10.418 1.00 11.25 O ATOM 2289 CB LEU A 146 2.563 7.091 -7.794 1.00 53.34 C ATOM 2290 CG LEU A 146 2.301 5.622 -7.454 1.00 53.22 C ATOM 2291 CD1 LEU A 146 3.156 5.154 -6.281 1.00 72.53 C ATOM 2292 CD2 LEU A 146 0.833 5.420 -7.101 1.00 12.22 C ATOM 0 H LEU A 146 3.148 9.242 -8.844 1.00 51.12 H new ATOM 0 HA LEU A 146 4.691 6.888 -8.033 1.00 0.30 H new ATOM 0 HB2 LEU A 146 2.619 7.667 -6.870 1.00 53.34 H new ATOM 0 HB3 LEU A 146 1.719 7.482 -8.362 1.00 53.34 H new ATOM 0 HG LEU A 146 2.563 5.034 -8.334 1.00 53.22 H new ATOM 0 HD11 LEU A 146 2.942 4.106 -6.070 1.00 72.53 H new ATOM 0 HD12 LEU A 146 4.211 5.265 -6.532 1.00 72.53 H new ATOM 0 HD13 LEU A 146 2.927 5.756 -5.401 1.00 72.53 H new ATOM 0 HD21 LEU A 146 0.658 4.371 -6.861 1.00 12.22 H new ATOM 0 HD22 LEU A 146 0.578 6.037 -6.240 1.00 12.22 H new ATOM 0 HD23 LEU A 146 0.212 5.707 -7.950 1.00 12.22 H new ATOM 2304 N GLN A 147 2.680 6.519 -10.575 1.00 4.30 N ATOM 2305 CA GLN A 147 2.528 5.940 -11.892 1.00 60.21 C ATOM 2306 C GLN A 147 3.033 4.478 -11.934 1.00 0.45 C ATOM 2307 O GLN A 147 3.596 4.036 -12.940 1.00 5.20 O ATOM 2308 CB GLN A 147 3.180 6.879 -12.921 1.00 63.15 C ATOM 2309 CG GLN A 147 2.896 8.385 -12.698 1.00 62.42 C ATOM 2310 CD GLN A 147 3.183 9.143 -13.991 1.00 51.23 C ATOM 2311 OE1 GLN A 147 4.329 9.436 -14.328 1.00 33.41 O ATOM 2312 NE2 GLN A 147 2.165 9.460 -14.771 1.00 73.33 N ATOM 0 H GLN A 147 1.808 6.871 -10.179 1.00 4.30 H new ATOM 0 HA GLN A 147 1.474 5.859 -12.156 1.00 60.21 H new ATOM 0 HB2 GLN A 147 4.258 6.721 -12.904 1.00 63.15 H new ATOM 0 HB3 GLN A 147 2.833 6.602 -13.916 1.00 63.15 H new ATOM 0 HG2 GLN A 147 1.858 8.532 -12.398 1.00 62.42 H new ATOM 0 HG3 GLN A 147 3.519 8.770 -11.890 1.00 62.42 H new ATOM 0 HE21 GLN A 147 1.214 9.217 -14.492 1.00 73.33 H new ATOM 0 HE22 GLN A 147 2.330 9.947 -15.652 1.00 73.33 H new ATOM 2321 N GLY A 148 2.880 3.730 -10.834 1.00 15.40 N ATOM 2322 CA GLY A 148 3.186 2.309 -10.718 1.00 0.03 C ATOM 2323 C GLY A 148 2.922 1.806 -9.296 1.00 60.55 C ATOM 2324 O GLY A 148 2.949 2.594 -8.357 1.00 35.12 O ATOM 0 H GLY A 148 2.522 4.123 -9.963 1.00 15.40 H new ATOM 0 HA2 GLY A 148 2.580 1.744 -11.426 1.00 0.03 H new ATOM 0 HA3 GLY A 148 4.229 2.135 -10.981 1.00 0.03 H new ATOM 2328 N VAL A 149 2.671 0.504 -9.121 1.00 45.32 N ATOM 2329 CA VAL A 149 2.501 -0.145 -7.818 1.00 62.32 C ATOM 2330 C VAL A 149 2.995 -1.604 -7.917 1.00 53.22 C ATOM 2331 O VAL A 149 3.006 -2.151 -9.028 1.00 62.42 O ATOM 2332 CB VAL A 149 1.019 -0.105 -7.365 1.00 74.21 C ATOM 2333 CG1 VAL A 149 0.519 1.297 -6.997 1.00 53.04 C ATOM 2334 CG2 VAL A 149 0.057 -0.719 -8.390 1.00 20.21 C ATOM 0 H VAL A 149 2.578 -0.144 -9.903 1.00 45.32 H new ATOM 0 HA VAL A 149 3.087 0.392 -7.073 1.00 62.32 H new ATOM 0 HB VAL A 149 1.016 -0.717 -6.463 1.00 74.21 H new ATOM 0 HG11 VAL A 149 -0.526 1.242 -6.691 1.00 53.04 H new ATOM 0 HG12 VAL A 149 1.117 1.693 -6.177 1.00 53.04 H new ATOM 0 HG13 VAL A 149 0.609 1.954 -7.862 1.00 53.04 H new ATOM 0 HG21 VAL A 149 -0.964 -0.660 -8.012 1.00 20.21 H new ATOM 0 HG22 VAL A 149 0.129 -0.171 -9.330 1.00 20.21 H new ATOM 0 HG23 VAL A 149 0.322 -1.763 -8.557 1.00 20.21 H new ATOM 2344 N PRO A 150 3.290 -2.299 -6.798 1.00 0.00 N ATOM 2345 CA PRO A 150 3.372 -1.787 -5.431 1.00 64.23 C ATOM 2346 C PRO A 150 4.500 -0.794 -5.251 1.00 41.11 C ATOM 2347 O PRO A 150 5.610 -0.982 -5.761 1.00 64.15 O ATOM 2348 CB PRO A 150 3.622 -2.997 -4.527 1.00 61.33 C ATOM 2349 CG PRO A 150 4.163 -4.080 -5.455 1.00 53.23 C ATOM 2350 CD PRO A 150 3.538 -3.733 -6.805 1.00 25.13 C ATOM 0 HA PRO A 150 2.448 -1.262 -5.187 1.00 64.23 H new ATOM 0 HB2 PRO A 150 4.337 -2.760 -3.739 1.00 61.33 H new ATOM 0 HB3 PRO A 150 2.703 -3.320 -4.037 1.00 61.33 H new ATOM 0 HG2 PRO A 150 5.252 -4.063 -5.500 1.00 53.23 H new ATOM 0 HG3 PRO A 150 3.873 -5.076 -5.122 1.00 53.23 H new ATOM 0 HD2 PRO A 150 4.206 -4.006 -7.622 1.00 25.13 H new ATOM 0 HD3 PRO A 150 2.610 -4.285 -6.955 1.00 25.13 H new ATOM 2358 N ALA A 151 4.213 0.238 -4.464 1.00 25.20 N ATOM 2359 CA ALA A 151 5.171 1.264 -4.144 1.00 65.32 C ATOM 2360 C ALA A 151 5.184 1.498 -2.654 1.00 15.51 C ATOM 2361 O ALA A 151 4.145 1.450 -1.998 1.00 42.03 O ATOM 2362 CB ALA A 151 4.797 2.539 -4.893 1.00 12.43 C ATOM 0 H ALA A 151 3.299 0.377 -4.032 1.00 25.20 H new ATOM 0 HA ALA A 151 6.171 0.955 -4.448 1.00 65.32 H new ATOM 0 HB1 ALA A 151 5.516 3.323 -4.658 1.00 12.43 H new ATOM 0 HB2 ALA A 151 4.807 2.347 -5.966 1.00 12.43 H new ATOM 0 HB3 ALA A 151 3.800 2.859 -4.591 1.00 12.43 H new ATOM 2368 N MET A 152 6.384 1.748 -2.159 1.00 53.54 N ATOM 2369 CA MET A 152 6.732 1.936 -0.775 1.00 24.33 C ATOM 2370 C MET A 152 7.889 2.922 -0.858 1.00 33.35 C ATOM 2371 O MET A 152 8.892 2.631 -1.524 1.00 11.30 O ATOM 2372 CB MET A 152 7.135 0.583 -0.163 1.00 15.30 C ATOM 2373 CG MET A 152 5.979 -0.434 -0.181 1.00 73.35 C ATOM 2374 SD MET A 152 6.087 -1.885 0.907 1.00 32.14 S ATOM 2375 CE MET A 152 5.455 -1.169 2.449 1.00 74.54 C ATOM 0 H MET A 152 7.198 1.830 -2.768 1.00 53.54 H new ATOM 0 HA MET A 152 5.929 2.309 -0.139 1.00 24.33 H new ATOM 0 HB2 MET A 152 7.983 0.176 -0.714 1.00 15.30 H new ATOM 0 HB3 MET A 152 7.466 0.736 0.864 1.00 15.30 H new ATOM 0 HG2 MET A 152 5.063 0.101 0.069 1.00 73.35 H new ATOM 0 HG3 MET A 152 5.869 -0.794 -1.204 1.00 73.35 H new ATOM 0 HE1 MET A 152 5.503 -1.914 3.243 1.00 74.54 H new ATOM 0 HE2 MET A 152 6.061 -0.306 2.725 1.00 74.54 H new ATOM 0 HE3 MET A 152 4.421 -0.856 2.308 1.00 74.54 H new ATOM 2385 N TYR A 153 7.696 4.134 -0.350 1.00 22.32 N ATOM 2386 CA TYR A 153 8.674 5.210 -0.448 1.00 11.02 C ATOM 2387 C TYR A 153 9.428 5.332 0.875 1.00 52.13 C ATOM 2388 O TYR A 153 8.974 4.803 1.894 1.00 42.34 O ATOM 2389 CB TYR A 153 7.965 6.523 -0.780 1.00 1.34 C ATOM 2390 CG TYR A 153 7.434 6.660 -2.193 1.00 3.21 C ATOM 2391 CD1 TYR A 153 8.277 7.175 -3.198 1.00 23.21 C ATOM 2392 CD2 TYR A 153 6.079 6.402 -2.474 1.00 42.05 C ATOM 2393 CE1 TYR A 153 7.758 7.522 -4.456 1.00 25.20 C ATOM 2394 CE2 TYR A 153 5.555 6.731 -3.737 1.00 52.41 C ATOM 2395 CZ TYR A 153 6.378 7.344 -4.712 1.00 31.25 C ATOM 2396 OH TYR A 153 5.839 7.767 -5.886 1.00 33.41 O ATOM 0 H TYR A 153 6.846 4.400 0.147 1.00 22.32 H new ATOM 0 HA TYR A 153 9.386 4.988 -1.243 1.00 11.02 H new ATOM 0 HB2 TYR A 153 7.132 6.647 -0.088 1.00 1.34 H new ATOM 0 HB3 TYR A 153 8.659 7.343 -0.594 1.00 1.34 H new ATOM 0 HD1 TYR A 153 9.331 7.304 -2.999 1.00 23.21 H new ATOM 0 HD2 TYR A 153 5.445 5.954 -1.723 1.00 42.05 H new ATOM 0 HE1 TYR A 153 8.407 7.921 -5.221 1.00 25.20 H new ATOM 0 HE2 TYR A 153 4.521 6.515 -3.964 1.00 52.41 H new ATOM 0 HH TYR A 153 5.110 8.396 -5.703 1.00 33.41 H new ATOM 2406 N VAL A 154 10.556 6.058 0.888 1.00 32.30 N ATOM 2407 CA VAL A 154 11.263 6.372 2.127 1.00 4.11 C ATOM 2408 C VAL A 154 11.745 7.834 2.122 1.00 35.24 C ATOM 2409 O VAL A 154 12.336 8.319 1.151 1.00 20.41 O ATOM 2410 CB VAL A 154 12.374 5.339 2.447 1.00 71.42 C ATOM 2411 CG1 VAL A 154 12.849 5.557 3.894 1.00 13.00 C ATOM 2412 CG2 VAL A 154 11.926 3.880 2.307 1.00 12.24 C ATOM 0 H VAL A 154 10.995 6.437 0.049 1.00 32.30 H new ATOM 0 HA VAL A 154 10.561 6.284 2.956 1.00 4.11 H new ATOM 0 HB VAL A 154 13.168 5.502 1.718 1.00 71.42 H new ATOM 0 HG11 VAL A 154 13.631 4.836 4.133 1.00 13.00 H new ATOM 0 HG12 VAL A 154 13.243 6.568 3.999 1.00 13.00 H new ATOM 0 HG13 VAL A 154 12.010 5.421 4.577 1.00 13.00 H new ATOM 0 HG21 VAL A 154 12.759 3.219 2.547 1.00 12.24 H new ATOM 0 HG22 VAL A 154 11.100 3.686 2.991 1.00 12.24 H new ATOM 0 HG23 VAL A 154 11.601 3.696 1.283 1.00 12.24 H new ATOM 2422 N ASN A 155 11.492 8.511 3.253 1.00 0.04 N ATOM 2423 CA ASN A 155 11.928 9.845 3.691 1.00 2.33 C ATOM 2424 C ASN A 155 11.825 10.953 2.632 1.00 0.41 C ATOM 2425 O ASN A 155 12.637 11.883 2.628 1.00 54.32 O ATOM 2426 CB ASN A 155 13.324 9.787 4.354 1.00 60.34 C ATOM 2427 CG ASN A 155 13.417 10.732 5.559 1.00 54.43 C ATOM 2428 OD1 ASN A 155 13.517 10.291 6.699 1.00 52.13 O ATOM 2429 ND2 ASN A 155 13.351 12.038 5.350 1.00 43.43 N ATOM 0 H ASN A 155 10.905 8.083 3.969 1.00 0.04 H new ATOM 0 HA ASN A 155 11.201 10.147 4.445 1.00 2.33 H new ATOM 0 HB2 ASN A 155 13.533 8.766 4.674 1.00 60.34 H new ATOM 0 HB3 ASN A 155 14.086 10.054 3.622 1.00 60.34 H new ATOM 0 HD21 ASN A 155 13.383 12.683 6.139 1.00 43.43 H new ATOM 0 HD22 ASN A 155 13.268 12.399 4.400 1.00 43.43 H new ATOM 2436 N GLY A 156 10.868 10.873 1.718 1.00 42.55 N ATOM 2437 CA GLY A 156 10.623 11.865 0.683 1.00 54.12 C ATOM 2438 C GLY A 156 11.792 11.957 -0.285 1.00 34.53 C ATOM 2439 O GLY A 156 12.153 13.070 -0.675 1.00 3.43 O ATOM 0 H GLY A 156 10.219 10.088 1.676 1.00 42.55 H new ATOM 0 HA2 GLY A 156 9.716 11.607 0.137 1.00 54.12 H new ATOM 0 HA3 GLY A 156 10.452 12.838 1.143 1.00 54.12 H new ATOM 2443 N LYS A 157 12.477 10.837 -0.577 1.00 25.32 N ATOM 2444 CA LYS A 157 13.579 10.831 -1.544 1.00 15.44 C ATOM 2445 C LYS A 157 13.972 9.471 -2.134 1.00 34.30 C ATOM 2446 O LYS A 157 14.730 9.471 -3.105 1.00 73.42 O ATOM 2447 CB LYS A 157 14.802 11.558 -0.958 1.00 22.22 C ATOM 2448 CG LYS A 157 15.478 10.906 0.249 1.00 13.00 C ATOM 2449 CD LYS A 157 16.493 11.877 0.881 1.00 74.42 C ATOM 2450 CE LYS A 157 17.938 11.577 0.476 1.00 1.14 C ATOM 2451 NZ LYS A 157 18.875 12.653 0.857 1.00 40.34 N ATOM 0 H LYS A 157 12.284 9.928 -0.156 1.00 25.32 H new ATOM 0 HA LYS A 157 13.185 11.370 -2.406 1.00 15.44 H new ATOM 0 HB2 LYS A 157 15.545 11.663 -1.748 1.00 22.22 H new ATOM 0 HB3 LYS A 157 14.495 12.564 -0.673 1.00 22.22 H new ATOM 0 HG2 LYS A 157 14.727 10.623 0.987 1.00 13.00 H new ATOM 0 HG3 LYS A 157 15.983 9.990 -0.059 1.00 13.00 H new ATOM 0 HD2 LYS A 157 16.243 12.897 0.588 1.00 74.42 H new ATOM 0 HD3 LYS A 157 16.408 11.828 1.967 1.00 74.42 H new ATOM 0 HE2 LYS A 157 18.255 10.644 0.942 1.00 1.14 H new ATOM 0 HE3 LYS A 157 17.984 11.426 -0.603 1.00 1.14 H new ATOM 0 HZ1 LYS A 157 19.409 12.961 0.019 1.00 40.34 H new ATOM 0 HZ2 LYS A 157 18.341 13.458 1.242 1.00 40.34 H new ATOM 0 HZ3 LYS A 157 19.536 12.299 1.578 1.00 40.34 H new ATOM 2465 N TYR A 158 13.473 8.342 -1.621 1.00 5.40 N ATOM 2466 CA TYR A 158 13.780 7.009 -2.138 1.00 34.31 C ATOM 2467 C TYR A 158 12.502 6.227 -2.393 1.00 3.24 C ATOM 2468 O TYR A 158 11.458 6.529 -1.814 1.00 52.02 O ATOM 2469 CB TYR A 158 14.659 6.243 -1.140 1.00 73.14 C ATOM 2470 CG TYR A 158 15.995 6.898 -0.897 1.00 54.42 C ATOM 2471 CD1 TYR A 158 16.901 7.026 -1.963 1.00 21.12 C ATOM 2472 CD2 TYR A 158 16.306 7.435 0.366 1.00 73.43 C ATOM 2473 CE1 TYR A 158 18.095 7.737 -1.786 1.00 71.43 C ATOM 2474 CE2 TYR A 158 17.506 8.141 0.551 1.00 3.41 C ATOM 2475 CZ TYR A 158 18.395 8.318 -0.538 1.00 71.13 C ATOM 2476 OH TYR A 158 19.512 9.085 -0.431 1.00 43.01 O ATOM 0 H TYR A 158 12.836 8.331 -0.824 1.00 5.40 H new ATOM 0 HA TYR A 158 14.318 7.124 -3.079 1.00 34.31 H new ATOM 0 HB2 TYR A 158 14.128 6.154 -0.192 1.00 73.14 H new ATOM 0 HB3 TYR A 158 14.820 5.231 -1.511 1.00 73.14 H new ATOM 0 HD1 TYR A 158 16.677 6.576 -2.919 1.00 21.12 H new ATOM 0 HD2 TYR A 158 15.623 7.304 1.192 1.00 73.43 H new ATOM 0 HE1 TYR A 158 18.787 7.840 -2.608 1.00 71.43 H new ATOM 0 HE2 TYR A 158 17.751 8.548 1.521 1.00 3.41 H new ATOM 0 HH TYR A 158 19.699 9.512 -1.293 1.00 43.01 H new ATOM 2486 N GLN A 159 12.609 5.183 -3.213 1.00 12.14 N ATOM 2487 CA GLN A 159 11.528 4.271 -3.554 1.00 1.00 C ATOM 2488 C GLN A 159 12.134 2.864 -3.482 1.00 23.52 C ATOM 2489 O GLN A 159 13.250 2.651 -3.974 1.00 40.44 O ATOM 2490 CB GLN A 159 11.022 4.675 -4.952 1.00 23.10 C ATOM 2491 CG GLN A 159 9.596 4.221 -5.298 1.00 43.22 C ATOM 2492 CD GLN A 159 9.150 4.800 -6.650 1.00 42.04 C ATOM 2493 OE1 GLN A 159 9.952 4.974 -7.566 1.00 2.22 O ATOM 2494 NE2 GLN A 159 7.883 5.129 -6.832 1.00 25.43 N ATOM 0 H GLN A 159 13.487 4.943 -3.674 1.00 12.14 H new ATOM 0 HA GLN A 159 10.666 4.301 -2.888 1.00 1.00 H new ATOM 0 HB2 GLN A 159 11.069 5.761 -5.036 1.00 23.10 H new ATOM 0 HB3 GLN A 159 11.705 4.268 -5.698 1.00 23.10 H new ATOM 0 HG2 GLN A 159 9.555 3.132 -5.333 1.00 43.22 H new ATOM 0 HG3 GLN A 159 8.908 4.541 -4.516 1.00 43.22 H new ATOM 0 HE21 GLN A 159 7.207 4.990 -6.081 1.00 25.43 H new ATOM 0 HE22 GLN A 159 7.581 5.522 -7.724 1.00 25.43 H new ATOM 2503 N LEU A 160 11.474 1.916 -2.807 1.00 3.10 N ATOM 2504 CA LEU A 160 11.983 0.557 -2.648 1.00 4.33 C ATOM 2505 C LEU A 160 12.015 -0.091 -4.028 1.00 34.34 C ATOM 2506 O LEU A 160 11.104 0.154 -4.827 1.00 52.41 O ATOM 2507 CB LEU A 160 10.999 -0.233 -1.753 1.00 41.31 C ATOM 2508 CG LEU A 160 11.239 -0.154 -0.232 1.00 2.14 C ATOM 2509 CD1 LEU A 160 12.235 -1.232 0.177 1.00 24.14 C ATOM 2510 CD2 LEU A 160 11.665 1.241 0.254 1.00 42.04 C ATOM 0 H LEU A 160 10.572 2.074 -2.357 1.00 3.10 H new ATOM 0 HA LEU A 160 12.976 0.562 -2.199 1.00 4.33 H new ATOM 0 HB2 LEU A 160 9.990 0.123 -1.958 1.00 41.31 H new ATOM 0 HB3 LEU A 160 11.034 -1.281 -2.050 1.00 41.31 H new ATOM 0 HG LEU A 160 10.285 -0.337 0.263 1.00 2.14 H new ATOM 0 HD11 LEU A 160 12.407 -1.179 1.252 1.00 24.14 H new ATOM 0 HD12 LEU A 160 11.835 -2.213 -0.079 1.00 24.14 H new ATOM 0 HD13 LEU A 160 13.177 -1.076 -0.349 1.00 24.14 H new ATOM 0 HD21 LEU A 160 11.816 1.220 1.333 1.00 42.04 H new ATOM 0 HD22 LEU A 160 12.595 1.529 -0.237 1.00 42.04 H new ATOM 0 HD23 LEU A 160 10.887 1.964 0.010 1.00 42.04 H new ATOM 2522 N ASN A 161 12.994 -0.961 -4.300 1.00 21.45 N ATOM 2523 CA ASN A 161 13.089 -1.643 -5.589 1.00 3.11 C ATOM 2524 C ASN A 161 12.901 -3.149 -5.481 1.00 0.21 C ATOM 2525 O ASN A 161 13.890 -3.880 -5.416 1.00 14.42 O ATOM 2526 CB ASN A 161 14.386 -1.379 -6.352 1.00 5.43 C ATOM 2527 CG ASN A 161 14.208 -1.904 -7.785 1.00 34.25 C ATOM 2528 OD1 ASN A 161 13.095 -2.066 -8.273 1.00 51.14 O ATOM 2529 ND2 ASN A 161 15.264 -2.212 -8.502 1.00 35.51 N ATOM 0 H ASN A 161 13.732 -1.208 -3.641 1.00 21.45 H new ATOM 0 HA ASN A 161 12.266 -1.206 -6.154 1.00 3.11 H new ATOM 0 HB2 ASN A 161 14.612 -0.313 -6.362 1.00 5.43 H new ATOM 0 HB3 ASN A 161 15.223 -1.878 -5.864 1.00 5.43 H new ATOM 0 HD21 ASN A 161 15.150 -2.579 -9.447 1.00 35.51 H new ATOM 0 HD22 ASN A 161 16.199 -2.085 -8.114 1.00 35.51 H new ATOM 2536 N PRO A 162 11.667 -3.665 -5.499 1.00 4.40 N ATOM 2537 CA PRO A 162 11.485 -5.102 -5.533 1.00 1.23 C ATOM 2538 C PRO A 162 12.085 -5.731 -6.804 1.00 54.53 C ATOM 2539 O PRO A 162 12.449 -6.906 -6.803 1.00 72.35 O ATOM 2540 CB PRO A 162 9.979 -5.316 -5.431 1.00 54.04 C ATOM 2541 CG PRO A 162 9.360 -4.010 -5.928 1.00 41.02 C ATOM 2542 CD PRO A 162 10.401 -2.956 -5.565 1.00 53.31 C ATOM 0 HA PRO A 162 12.011 -5.595 -4.715 1.00 1.23 H new ATOM 0 HB2 PRO A 162 9.658 -6.162 -6.040 1.00 54.04 H new ATOM 0 HB3 PRO A 162 9.679 -5.530 -4.405 1.00 54.04 H new ATOM 0 HG2 PRO A 162 9.175 -4.037 -7.002 1.00 41.02 H new ATOM 0 HG3 PRO A 162 8.403 -3.811 -5.445 1.00 41.02 H new ATOM 0 HD2 PRO A 162 10.434 -2.164 -6.313 1.00 53.31 H new ATOM 0 HD3 PRO A 162 10.165 -2.484 -4.611 1.00 53.31 H new ATOM 2550 N GLN A 163 12.223 -4.953 -7.884 1.00 45.33 N ATOM 2551 CA GLN A 163 12.583 -5.424 -9.219 1.00 14.14 C ATOM 2552 C GLN A 163 14.097 -5.635 -9.377 1.00 11.54 C ATOM 2553 O GLN A 163 14.557 -5.928 -10.479 1.00 72.14 O ATOM 2554 CB GLN A 163 12.085 -4.429 -10.287 1.00 52.05 C ATOM 2555 CG GLN A 163 10.722 -3.766 -10.016 1.00 11.41 C ATOM 2556 CD GLN A 163 9.718 -3.927 -11.158 1.00 1.42 C ATOM 2557 OE1 GLN A 163 9.296 -2.961 -11.779 1.00 5.33 O ATOM 2558 NE2 GLN A 163 9.273 -5.149 -11.436 1.00 44.41 N ATOM 0 H GLN A 163 12.081 -3.944 -7.847 1.00 45.33 H new ATOM 0 HA GLN A 163 12.099 -6.391 -9.357 1.00 14.14 H new ATOM 0 HB2 GLN A 163 12.832 -3.643 -10.398 1.00 52.05 H new ATOM 0 HB3 GLN A 163 12.028 -4.952 -11.242 1.00 52.05 H new ATOM 0 HG2 GLN A 163 10.296 -4.192 -9.108 1.00 11.41 H new ATOM 0 HG3 GLN A 163 10.877 -2.704 -9.828 1.00 11.41 H new ATOM 0 HE21 GLN A 163 9.628 -5.952 -10.916 1.00 44.41 H new ATOM 0 HE22 GLN A 163 8.577 -5.284 -12.169 1.00 44.41 H new ATOM 2567 N GLY A 164 14.885 -5.431 -8.320 1.00 41.05 N ATOM 2568 CA GLY A 164 16.319 -5.686 -8.279 1.00 1.41 C ATOM 2569 C GLY A 164 16.678 -6.512 -7.047 1.00 74.13 C ATOM 2570 O GLY A 164 17.815 -6.458 -6.580 1.00 13.21 O ATOM 0 H GLY A 164 14.524 -5.070 -7.437 1.00 41.05 H new ATOM 0 HA2 GLY A 164 16.627 -6.215 -9.181 1.00 1.41 H new ATOM 0 HA3 GLY A 164 16.862 -4.741 -8.262 1.00 1.41 H new ATOM 2574 N MET A 165 15.711 -7.240 -6.477 1.00 73.41 N ATOM 2575 CA MET A 165 15.913 -8.083 -5.309 1.00 42.24 C ATOM 2576 C MET A 165 15.911 -9.545 -5.708 1.00 33.11 C ATOM 2577 O MET A 165 15.526 -9.897 -6.830 1.00 0.03 O ATOM 2578 CB MET A 165 14.814 -7.808 -4.287 1.00 60.44 C ATOM 2579 CG MET A 165 15.045 -6.458 -3.639 1.00 72.21 C ATOM 2580 SD MET A 165 13.754 -6.030 -2.446 1.00 21.14 S ATOM 2581 CE MET A 165 14.153 -4.304 -2.093 1.00 4.20 C ATOM 0 H MET A 165 14.753 -7.255 -6.826 1.00 73.41 H new ATOM 0 HA MET A 165 16.881 -7.853 -4.863 1.00 42.24 H new ATOM 0 HB2 MET A 165 13.839 -7.826 -4.774 1.00 60.44 H new ATOM 0 HB3 MET A 165 14.806 -8.590 -3.528 1.00 60.44 H new ATOM 0 HG2 MET A 165 16.012 -6.461 -3.137 1.00 72.21 H new ATOM 0 HG3 MET A 165 15.089 -5.691 -4.412 1.00 72.21 H new ATOM 0 HE1 MET A 165 13.558 -3.959 -1.247 1.00 4.20 H new ATOM 0 HE2 MET A 165 15.212 -4.218 -1.851 1.00 4.20 H new ATOM 0 HE3 MET A 165 13.930 -3.693 -2.967 1.00 4.20 H new ATOM 2591 N ASP A 166 16.297 -10.397 -4.758 1.00 2.41 N ATOM 2592 CA ASP A 166 16.480 -11.832 -4.988 1.00 72.53 C ATOM 2593 C ASP A 166 15.127 -12.558 -4.884 1.00 40.34 C ATOM 2594 O ASP A 166 14.842 -13.391 -4.017 1.00 0.04 O ATOM 2595 CB ASP A 166 17.593 -12.395 -4.091 1.00 0.41 C ATOM 2596 CG ASP A 166 18.485 -13.345 -4.883 1.00 4.33 C ATOM 2597 OD1 ASP A 166 19.448 -12.835 -5.508 1.00 2.52 O ATOM 2598 OD2 ASP A 166 18.267 -14.575 -4.851 1.00 5.52 O ATOM 0 H ASP A 166 16.493 -10.109 -3.799 1.00 2.41 H new ATOM 0 HA ASP A 166 16.832 -12.010 -6.004 1.00 72.53 H new ATOM 0 HB2 ASP A 166 18.190 -11.578 -3.686 1.00 0.41 H new ATOM 0 HB3 ASP A 166 17.154 -12.920 -3.243 1.00 0.41 H new ATOM 2603 N THR A 167 14.242 -12.200 -5.810 1.00 13.03 N ATOM 2604 CA THR A 167 12.872 -12.658 -6.006 1.00 4.44 C ATOM 2605 C THR A 167 12.834 -14.085 -6.585 1.00 11.23 C ATOM 2606 O THR A 167 11.934 -14.432 -7.349 1.00 34.42 O ATOM 2607 CB THR A 167 12.144 -11.634 -6.912 1.00 11.03 C ATOM 2608 OG1 THR A 167 12.950 -11.239 -8.006 1.00 65.21 O ATOM 2609 CG2 THR A 167 11.778 -10.354 -6.164 1.00 63.44 C ATOM 0 H THR A 167 14.495 -11.508 -6.516 1.00 13.03 H new ATOM 0 HA THR A 167 12.356 -12.715 -5.048 1.00 4.44 H new ATOM 0 HB THR A 167 11.244 -12.147 -7.251 1.00 11.03 H new ATOM 0 HG1 THR A 167 12.460 -10.594 -8.558 1.00 65.21 H new ATOM 0 HG21 THR A 167 11.270 -9.669 -6.842 1.00 63.44 H new ATOM 0 HG22 THR A 167 11.118 -10.596 -5.331 1.00 63.44 H new ATOM 0 HG23 THR A 167 12.684 -9.883 -5.784 1.00 63.44 H new ATOM 2617 N SER A 168 13.815 -14.910 -6.224 1.00 42.21 N ATOM 2618 CA SER A 168 13.940 -16.311 -6.604 1.00 52.34 C ATOM 2619 C SER A 168 13.877 -17.239 -5.397 1.00 25.42 C ATOM 2620 O SER A 168 13.907 -18.454 -5.568 1.00 22.44 O ATOM 2621 CB SER A 168 15.235 -16.504 -7.394 1.00 14.25 C ATOM 2622 OG SER A 168 15.281 -15.582 -8.470 1.00 73.22 O ATOM 0 H SER A 168 14.583 -14.601 -5.628 1.00 42.21 H new ATOM 0 HA SER A 168 13.092 -16.578 -7.235 1.00 52.34 H new ATOM 0 HB2 SER A 168 16.096 -16.359 -6.741 1.00 14.25 H new ATOM 0 HB3 SER A 168 15.292 -17.524 -7.774 1.00 14.25 H new ATOM 0 HG SER A 168 16.113 -15.707 -8.973 1.00 73.22 H new ATOM 2628 N ASN A 169 13.784 -16.691 -4.182 1.00 52.22 N ATOM 2629 CA ASN A 169 13.718 -17.473 -2.959 1.00 53.01 C ATOM 2630 C ASN A 169 12.617 -16.979 -2.033 1.00 53.11 C ATOM 2631 O ASN A 169 12.345 -17.664 -1.059 1.00 51.42 O ATOM 2632 CB ASN A 169 15.063 -17.489 -2.204 1.00 23.53 C ATOM 2633 CG ASN A 169 16.279 -17.014 -2.983 1.00 24.10 C ATOM 2634 OD1 ASN A 169 17.102 -17.786 -3.461 1.00 1.42 O ATOM 2635 ND2 ASN A 169 16.401 -15.709 -3.134 1.00 14.43 N ATOM 0 H ASN A 169 13.753 -15.684 -4.026 1.00 52.22 H new ATOM 0 HA ASN A 169 13.486 -18.493 -3.266 1.00 53.01 H new ATOM 0 HB2 ASN A 169 14.963 -16.868 -1.314 1.00 23.53 H new ATOM 0 HB3 ASN A 169 15.252 -18.507 -1.863 1.00 23.53 H new ATOM 0 HD21 ASN A 169 17.190 -15.328 -3.656 1.00 14.43 H new ATOM 0 HD22 ASN A 169 15.706 -15.082 -2.729 1.00 14.43 H new ATOM 2642 N MET A 170 11.991 -15.824 -2.312 1.00 4.00 N ATOM 2643 CA MET A 170 10.816 -15.252 -1.636 1.00 61.53 C ATOM 2644 C MET A 170 11.035 -14.845 -0.178 1.00 13.34 C ATOM 2645 O MET A 170 10.792 -13.694 0.185 1.00 20.24 O ATOM 2646 CB MET A 170 9.588 -16.162 -1.779 1.00 24.40 C ATOM 2647 CG MET A 170 9.243 -16.540 -3.225 1.00 4.41 C ATOM 2648 SD MET A 170 8.372 -15.266 -4.199 1.00 4.03 S ATOM 2649 CE MET A 170 9.750 -14.231 -4.743 1.00 40.12 C ATOM 0 H MET A 170 12.316 -15.223 -3.070 1.00 4.00 H new ATOM 0 HA MET A 170 10.630 -14.315 -2.161 1.00 61.53 H new ATOM 0 HB2 MET A 170 9.759 -17.075 -1.209 1.00 24.40 H new ATOM 0 HB3 MET A 170 8.728 -15.664 -1.332 1.00 24.40 H new ATOM 0 HG2 MET A 170 10.167 -16.796 -3.743 1.00 4.41 H new ATOM 0 HG3 MET A 170 8.628 -17.439 -3.207 1.00 4.41 H new ATOM 0 HE1 MET A 170 9.669 -13.246 -4.283 1.00 40.12 H new ATOM 0 HE2 MET A 170 10.691 -14.693 -4.446 1.00 40.12 H new ATOM 0 HE3 MET A 170 9.722 -14.129 -5.828 1.00 40.12 H new ATOM 2659 N ASP A 171 11.545 -15.738 0.656 1.00 11.34 N ATOM 2660 CA ASP A 171 11.804 -15.453 2.060 1.00 3.11 C ATOM 2661 C ASP A 171 13.013 -14.525 2.115 1.00 63.14 C ATOM 2662 O ASP A 171 12.989 -13.514 2.806 1.00 32.41 O ATOM 2663 CB ASP A 171 12.015 -16.754 2.856 1.00 61.35 C ATOM 2664 CG ASP A 171 10.760 -17.181 3.627 1.00 61.11 C ATOM 2665 OD1 ASP A 171 9.638 -17.086 3.089 1.00 32.31 O ATOM 2666 OD2 ASP A 171 10.906 -17.597 4.803 1.00 4.22 O ATOM 0 H ASP A 171 11.793 -16.687 0.376 1.00 11.34 H new ATOM 0 HA ASP A 171 10.950 -14.962 2.527 1.00 3.11 H new ATOM 0 HB2 ASP A 171 12.306 -17.551 2.172 1.00 61.35 H new ATOM 0 HB3 ASP A 171 12.839 -16.618 3.556 1.00 61.35 H new ATOM 2671 N VAL A 172 14.058 -14.820 1.331 1.00 20.20 N ATOM 2672 CA VAL A 172 15.233 -13.964 1.178 1.00 60.21 C ATOM 2673 C VAL A 172 14.825 -12.586 0.650 1.00 54.31 C ATOM 2674 O VAL A 172 15.403 -11.585 1.081 1.00 34.23 O ATOM 2675 CB VAL A 172 16.242 -14.628 0.222 1.00 22.30 C ATOM 2676 CG1 VAL A 172 17.480 -13.751 0.001 1.00 60.42 C ATOM 2677 CG2 VAL A 172 16.711 -16.000 0.732 1.00 21.12 C ATOM 0 H VAL A 172 14.108 -15.675 0.778 1.00 20.20 H new ATOM 0 HA VAL A 172 15.703 -13.832 2.152 1.00 60.21 H new ATOM 0 HB VAL A 172 15.709 -14.757 -0.720 1.00 22.30 H new ATOM 0 HG11 VAL A 172 18.167 -14.255 -0.679 1.00 60.42 H new ATOM 0 HG12 VAL A 172 17.178 -12.797 -0.430 1.00 60.42 H new ATOM 0 HG13 VAL A 172 17.977 -13.576 0.955 1.00 60.42 H new ATOM 0 HG21 VAL A 172 17.421 -16.428 0.024 1.00 21.12 H new ATOM 0 HG22 VAL A 172 17.193 -15.882 1.703 1.00 21.12 H new ATOM 0 HG23 VAL A 172 15.852 -16.664 0.831 1.00 21.12 H new ATOM 2687 N PHE A 173 13.863 -12.541 -0.284 1.00 3.10 N ATOM 2688 CA PHE A 173 13.377 -11.303 -0.858 1.00 21.42 C ATOM 2689 C PHE A 173 12.878 -10.378 0.255 1.00 40.31 C ATOM 2690 O PHE A 173 13.419 -9.284 0.404 1.00 63.44 O ATOM 2691 CB PHE A 173 12.314 -11.604 -1.929 1.00 4.30 C ATOM 2692 CG PHE A 173 11.414 -10.433 -2.250 1.00 24.24 C ATOM 2693 CD1 PHE A 173 11.898 -9.382 -3.039 1.00 31.44 C ATOM 2694 CD2 PHE A 173 10.124 -10.355 -1.695 1.00 62.23 C ATOM 2695 CE1 PHE A 173 11.120 -8.232 -3.232 1.00 73.25 C ATOM 2696 CE2 PHE A 173 9.354 -9.192 -1.862 1.00 41.34 C ATOM 2697 CZ PHE A 173 9.866 -8.120 -2.611 1.00 33.54 C ATOM 0 H PHE A 173 13.406 -13.373 -0.656 1.00 3.10 H new ATOM 0 HA PHE A 173 14.185 -10.774 -1.364 1.00 21.42 H new ATOM 0 HB2 PHE A 173 12.815 -11.925 -2.842 1.00 4.30 H new ATOM 0 HB3 PHE A 173 11.700 -12.439 -1.592 1.00 4.30 H new ATOM 0 HD1 PHE A 173 12.872 -9.458 -3.499 1.00 31.44 H new ATOM 0 HD2 PHE A 173 9.725 -11.191 -1.139 1.00 62.23 H new ATOM 0 HE1 PHE A 173 11.485 -7.432 -3.859 1.00 73.25 H new ATOM 0 HE2 PHE A 173 8.373 -9.123 -1.416 1.00 41.34 H new ATOM 0 HZ PHE A 173 9.295 -7.209 -2.709 1.00 33.54 H new ATOM 2707 N VAL A 174 11.883 -10.798 1.044 1.00 62.11 N ATOM 2708 CA VAL A 174 11.318 -9.932 2.085 1.00 24.41 C ATOM 2709 C VAL A 174 12.345 -9.660 3.180 1.00 55.14 C ATOM 2710 O VAL A 174 12.432 -8.527 3.662 1.00 43.05 O ATOM 2711 CB VAL A 174 10.030 -10.505 2.699 1.00 72.35 C ATOM 2712 CG1 VAL A 174 9.360 -9.472 3.620 1.00 21.25 C ATOM 2713 CG2 VAL A 174 9.027 -10.857 1.607 1.00 72.31 C ATOM 0 H VAL A 174 11.456 -11.722 0.983 1.00 62.11 H new ATOM 0 HA VAL A 174 11.054 -8.993 1.597 1.00 24.41 H new ATOM 0 HB VAL A 174 10.310 -11.394 3.264 1.00 72.35 H new ATOM 0 HG11 VAL A 174 8.451 -9.898 4.044 1.00 21.25 H new ATOM 0 HG12 VAL A 174 10.044 -9.204 4.425 1.00 21.25 H new ATOM 0 HG13 VAL A 174 9.109 -8.581 3.045 1.00 21.25 H new ATOM 0 HG21 VAL A 174 8.122 -11.261 2.061 1.00 72.31 H new ATOM 0 HG22 VAL A 174 8.779 -9.961 1.038 1.00 72.31 H new ATOM 0 HG23 VAL A 174 9.462 -11.601 0.940 1.00 72.31 H new ATOM 2723 N ALA A 175 13.149 -10.667 3.534 1.00 22.42 N ATOM 2724 CA ALA A 175 14.181 -10.540 4.553 1.00 71.14 C ATOM 2725 C ALA A 175 15.088 -9.346 4.264 1.00 2.33 C ATOM 2726 O ALA A 175 15.482 -8.645 5.202 1.00 51.44 O ATOM 2727 CB ALA A 175 15.011 -11.823 4.639 1.00 75.53 C ATOM 0 H ALA A 175 13.097 -11.596 3.116 1.00 22.42 H new ATOM 0 HA ALA A 175 13.689 -10.375 5.512 1.00 71.14 H new ATOM 0 HB1 ALA A 175 15.777 -11.710 5.406 1.00 75.53 H new ATOM 0 HB2 ALA A 175 14.362 -12.660 4.896 1.00 75.53 H new ATOM 0 HB3 ALA A 175 15.486 -12.014 3.677 1.00 75.53 H new ATOM 2733 N GLN A 176 15.438 -9.124 2.992 1.00 14.44 N ATOM 2734 CA GLN A 176 16.204 -7.961 2.580 1.00 0.03 C ATOM 2735 C GLN A 176 15.313 -6.739 2.292 1.00 2.32 C ATOM 2736 O GLN A 176 15.729 -5.634 2.622 1.00 24.21 O ATOM 2737 CB GLN A 176 17.079 -8.334 1.383 1.00 53.15 C ATOM 2738 CG GLN A 176 18.178 -9.333 1.762 1.00 5.40 C ATOM 2739 CD GLN A 176 19.092 -9.649 0.590 1.00 11.22 C ATOM 2740 OE1 GLN A 176 19.948 -8.854 0.224 1.00 42.44 O ATOM 2741 NE2 GLN A 176 18.932 -10.807 -0.026 1.00 32.41 N ATOM 0 H GLN A 176 15.194 -9.751 2.225 1.00 14.44 H new ATOM 0 HA GLN A 176 16.847 -7.659 3.407 1.00 0.03 H new ATOM 0 HB2 GLN A 176 16.456 -8.762 0.598 1.00 53.15 H new ATOM 0 HB3 GLN A 176 17.535 -7.433 0.973 1.00 53.15 H new ATOM 0 HG2 GLN A 176 18.769 -8.927 2.583 1.00 5.40 H new ATOM 0 HG3 GLN A 176 17.721 -10.254 2.123 1.00 5.40 H new ATOM 0 HE21 GLN A 176 18.214 -11.459 0.291 1.00 32.41 H new ATOM 0 HE22 GLN A 176 19.526 -11.049 -0.819 1.00 32.41 H new ATOM 2750 N TYR A 177 14.104 -6.882 1.732 1.00 64.12 N ATOM 2751 CA TYR A 177 13.147 -5.788 1.487 1.00 20.20 C ATOM 2752 C TYR A 177 12.921 -4.987 2.768 1.00 3.55 C ATOM 2753 O TYR A 177 13.240 -3.801 2.828 1.00 1.13 O ATOM 2754 CB TYR A 177 11.806 -6.297 0.913 1.00 51.21 C ATOM 2755 CG TYR A 177 10.905 -5.208 0.329 1.00 22.34 C ATOM 2756 CD1 TYR A 177 10.214 -4.303 1.163 1.00 45.53 C ATOM 2757 CD2 TYR A 177 10.771 -5.081 -1.067 1.00 41.12 C ATOM 2758 CE1 TYR A 177 9.412 -3.289 0.602 1.00 3.20 C ATOM 2759 CE2 TYR A 177 9.999 -4.051 -1.634 1.00 3.32 C ATOM 2760 CZ TYR A 177 9.280 -3.176 -0.799 1.00 74.35 C ATOM 2761 OH TYR A 177 8.502 -2.200 -1.340 1.00 60.43 O ATOM 0 H TYR A 177 13.752 -7.789 1.427 1.00 64.12 H new ATOM 0 HA TYR A 177 13.584 -5.135 0.732 1.00 20.20 H new ATOM 0 HB2 TYR A 177 12.015 -7.032 0.136 1.00 51.21 H new ATOM 0 HB3 TYR A 177 11.262 -6.815 1.703 1.00 51.21 H new ATOM 0 HD1 TYR A 177 10.300 -4.388 2.236 1.00 45.53 H new ATOM 0 HD2 TYR A 177 11.270 -5.787 -1.714 1.00 41.12 H new ATOM 0 HE1 TYR A 177 8.895 -2.594 1.248 1.00 3.20 H new ATOM 0 HE2 TYR A 177 9.958 -3.932 -2.707 1.00 3.32 H new ATOM 0 HH TYR A 177 7.693 -2.088 -0.798 1.00 60.43 H new ATOM 2771 N ALA A 178 12.415 -5.646 3.813 1.00 33.44 N ATOM 2772 CA ALA A 178 12.126 -5.041 5.110 1.00 12.31 C ATOM 2773 C ALA A 178 13.348 -4.316 5.685 1.00 0.51 C ATOM 2774 O ALA A 178 13.233 -3.279 6.338 1.00 0.31 O ATOM 2775 CB ALA A 178 11.670 -6.141 6.078 1.00 3.53 C ATOM 0 H ALA A 178 12.190 -6.640 3.777 1.00 33.44 H new ATOM 0 HA ALA A 178 11.339 -4.299 4.977 1.00 12.31 H new ATOM 0 HB1 ALA A 178 11.451 -5.701 7.051 1.00 3.53 H new ATOM 0 HB2 ALA A 178 10.773 -6.621 5.687 1.00 3.53 H new ATOM 0 HB3 ALA A 178 12.462 -6.883 6.185 1.00 3.53 H new ATOM 2781 N ASP A 179 14.533 -4.862 5.439 1.00 62.32 N ATOM 2782 CA ASP A 179 15.797 -4.341 5.930 1.00 20.13 C ATOM 2783 C ASP A 179 16.183 -3.054 5.213 1.00 24.50 C ATOM 2784 O ASP A 179 16.491 -2.056 5.863 1.00 61.31 O ATOM 2785 CB ASP A 179 16.898 -5.365 5.705 1.00 32.11 C ATOM 2786 CG ASP A 179 18.029 -5.133 6.702 1.00 74.14 C ATOM 2787 OD1 ASP A 179 18.880 -4.250 6.456 1.00 23.22 O ATOM 2788 OD2 ASP A 179 18.041 -5.853 7.728 1.00 45.43 O ATOM 0 H ASP A 179 14.641 -5.705 4.875 1.00 62.32 H new ATOM 0 HA ASP A 179 15.678 -4.133 6.993 1.00 20.13 H new ATOM 0 HB2 ASP A 179 16.499 -6.373 5.821 1.00 32.11 H new ATOM 0 HB3 ASP A 179 17.277 -5.287 4.686 1.00 32.11 H new ATOM 2793 N THR A 180 16.121 -3.035 3.876 1.00 21.31 N ATOM 2794 CA THR A 180 16.454 -1.821 3.155 1.00 4.42 C ATOM 2795 C THR A 180 15.483 -0.706 3.543 1.00 3.23 C ATOM 2796 O THR A 180 15.938 0.430 3.615 1.00 52.43 O ATOM 2797 CB THR A 180 16.598 -2.054 1.641 1.00 11.20 C ATOM 2798 OG1 THR A 180 16.943 -0.857 0.965 1.00 24.12 O ATOM 2799 CG2 THR A 180 15.367 -2.595 0.943 1.00 22.10 C ATOM 0 H THR A 180 15.850 -3.827 3.293 1.00 21.31 H new ATOM 0 HA THR A 180 17.447 -1.488 3.455 1.00 4.42 H new ATOM 0 HB THR A 180 17.382 -2.810 1.586 1.00 11.20 H new ATOM 0 HG1 THR A 180 17.029 -1.036 0.005 1.00 24.12 H new ATOM 0 HG21 THR A 180 15.577 -2.722 -0.119 1.00 22.10 H new ATOM 0 HG22 THR A 180 15.096 -3.558 1.377 1.00 22.10 H new ATOM 0 HG23 THR A 180 14.541 -1.895 1.068 1.00 22.10 H new ATOM 2807 N VAL A 181 14.221 -1.002 3.884 1.00 71.33 N ATOM 2808 CA VAL A 181 13.342 0.036 4.438 1.00 11.24 C ATOM 2809 C VAL A 181 13.983 0.603 5.714 1.00 20.50 C ATOM 2810 O VAL A 181 14.242 1.806 5.796 1.00 22.31 O ATOM 2811 CB VAL A 181 11.895 -0.439 4.710 1.00 12.02 C ATOM 2812 CG1 VAL A 181 11.034 0.761 5.139 1.00 14.54 C ATOM 2813 CG2 VAL A 181 11.192 -1.078 3.504 1.00 11.14 C ATOM 0 H VAL A 181 13.795 -1.924 3.790 1.00 71.33 H new ATOM 0 HA VAL A 181 13.245 0.813 3.680 1.00 11.24 H new ATOM 0 HB VAL A 181 11.989 -1.200 5.484 1.00 12.02 H new ATOM 0 HG11 VAL A 181 10.014 0.427 5.331 1.00 14.54 H new ATOM 0 HG12 VAL A 181 11.449 1.200 6.046 1.00 14.54 H new ATOM 0 HG13 VAL A 181 11.028 1.507 4.344 1.00 14.54 H new ATOM 0 HG21 VAL A 181 10.184 -1.380 3.788 1.00 11.14 H new ATOM 0 HG22 VAL A 181 11.138 -0.356 2.689 1.00 11.14 H new ATOM 0 HG23 VAL A 181 11.754 -1.953 3.177 1.00 11.14 H new ATOM 2823 N LYS A 182 14.250 -0.243 6.716 1.00 31.53 N ATOM 2824 CA LYS A 182 14.708 0.239 8.020 1.00 23.41 C ATOM 2825 C LYS A 182 16.140 0.788 8.018 1.00 54.33 C ATOM 2826 O LYS A 182 16.542 1.409 9.005 1.00 52.13 O ATOM 2827 CB LYS A 182 14.516 -0.837 9.095 1.00 2.22 C ATOM 2828 CG LYS A 182 15.369 -2.107 8.972 1.00 71.31 C ATOM 2829 CD LYS A 182 16.115 -2.473 10.263 1.00 60.13 C ATOM 2830 CE LYS A 182 17.460 -1.731 10.301 1.00 44.41 C ATOM 2831 NZ LYS A 182 18.281 -2.090 11.475 1.00 74.25 N ATOM 0 H LYS A 182 14.157 -1.256 6.648 1.00 31.53 H new ATOM 0 HA LYS A 182 14.078 1.095 8.263 1.00 23.41 H new ATOM 0 HB2 LYS A 182 14.719 -0.385 10.066 1.00 2.22 H new ATOM 0 HB3 LYS A 182 13.467 -1.133 9.094 1.00 2.22 H new ATOM 0 HG2 LYS A 182 14.727 -2.940 8.685 1.00 71.31 H new ATOM 0 HG3 LYS A 182 16.094 -1.972 8.169 1.00 71.31 H new ATOM 0 HD2 LYS A 182 15.514 -2.205 11.132 1.00 60.13 H new ATOM 0 HD3 LYS A 182 16.279 -3.550 10.309 1.00 60.13 H new ATOM 0 HE2 LYS A 182 18.018 -1.954 9.392 1.00 44.41 H new ATOM 0 HE3 LYS A 182 17.277 -0.657 10.307 1.00 44.41 H new ATOM 0 HZ1 LYS A 182 19.175 -1.560 11.448 1.00 74.25 H new ATOM 0 HZ2 LYS A 182 17.764 -1.853 12.346 1.00 74.25 H new ATOM 0 HZ3 LYS A 182 18.483 -3.110 11.459 1.00 74.25 H new ATOM 2845 N GLN A 183 16.911 0.571 6.953 1.00 73.14 N ATOM 2846 CA GLN A 183 18.173 1.262 6.705 1.00 72.24 C ATOM 2847 C GLN A 183 17.985 2.575 5.948 1.00 14.00 C ATOM 2848 O GLN A 183 18.747 3.507 6.165 1.00 13.50 O ATOM 2849 CB GLN A 183 19.150 0.384 5.909 1.00 71.12 C ATOM 2850 CG GLN A 183 19.982 -0.563 6.784 1.00 23.33 C ATOM 2851 CD GLN A 183 21.431 -0.625 6.299 1.00 13.01 C ATOM 2852 OE1 GLN A 183 22.360 -0.190 6.969 1.00 51.54 O ATOM 2853 NE2 GLN A 183 21.679 -1.103 5.093 1.00 13.24 N ATOM 0 H GLN A 183 16.670 -0.103 6.226 1.00 73.14 H new ATOM 0 HA GLN A 183 18.584 1.478 7.691 1.00 72.24 H new ATOM 0 HB2 GLN A 183 18.588 -0.205 5.185 1.00 71.12 H new ATOM 0 HB3 GLN A 183 19.824 1.027 5.343 1.00 71.12 H new ATOM 0 HG2 GLN A 183 19.955 -0.224 7.820 1.00 23.33 H new ATOM 0 HG3 GLN A 183 19.545 -1.561 6.764 1.00 23.33 H new ATOM 0 HE21 GLN A 183 20.917 -1.469 4.523 1.00 13.24 H new ATOM 0 HE22 GLN A 183 22.633 -1.106 4.732 1.00 13.24 H new ATOM 2862 N LEU A 184 17.017 2.709 5.048 1.00 15.12 N ATOM 2863 CA LEU A 184 16.889 3.958 4.303 1.00 12.52 C ATOM 2864 C LEU A 184 16.494 5.116 5.219 1.00 22.32 C ATOM 2865 O LEU A 184 16.898 6.251 4.990 1.00 1.24 O ATOM 2866 CB LEU A 184 15.865 3.822 3.181 1.00 2.20 C ATOM 2867 CG LEU A 184 16.383 3.128 1.912 1.00 31.23 C ATOM 2868 CD1 LEU A 184 15.225 2.953 0.935 1.00 31.20 C ATOM 2869 CD2 LEU A 184 17.488 3.911 1.210 1.00 15.45 C ATOM 0 H LEU A 184 16.328 1.992 4.820 1.00 15.12 H new ATOM 0 HA LEU A 184 17.865 4.175 3.870 1.00 12.52 H new ATOM 0 HB2 LEU A 184 15.007 3.265 3.558 1.00 2.20 H new ATOM 0 HB3 LEU A 184 15.507 4.816 2.913 1.00 2.20 H new ATOM 0 HG LEU A 184 16.802 2.170 2.221 1.00 31.23 H new ATOM 0 HD11 LEU A 184 15.583 2.461 0.031 1.00 31.20 H new ATOM 0 HD12 LEU A 184 14.448 2.343 1.397 1.00 31.20 H new ATOM 0 HD13 LEU A 184 14.815 3.930 0.678 1.00 31.20 H new ATOM 0 HD21 LEU A 184 17.811 3.368 0.322 1.00 15.45 H new ATOM 0 HD22 LEU A 184 17.111 4.891 0.919 1.00 15.45 H new ATOM 0 HD23 LEU A 184 18.333 4.034 1.887 1.00 15.45 H new ATOM 2881 N VAL A 185 15.744 4.836 6.283 1.00 71.43 N ATOM 2882 CA VAL A 185 15.316 5.840 7.249 1.00 0.12 C ATOM 2883 C VAL A 185 16.504 6.513 7.969 1.00 63.13 C ATOM 2884 O VAL A 185 16.372 7.641 8.451 1.00 65.31 O ATOM 2885 CB VAL A 185 14.293 5.173 8.203 1.00 25.21 C ATOM 2886 CG1 VAL A 185 13.928 6.078 9.384 1.00 45.03 C ATOM 2887 CG2 VAL A 185 13.003 4.804 7.455 1.00 73.24 C ATOM 0 H VAL A 185 15.414 3.895 6.499 1.00 71.43 H new ATOM 0 HA VAL A 185 14.826 6.670 6.740 1.00 0.12 H new ATOM 0 HB VAL A 185 14.775 4.273 8.585 1.00 25.21 H new ATOM 0 HG11 VAL A 185 13.209 5.568 10.025 1.00 45.03 H new ATOM 0 HG12 VAL A 185 14.826 6.307 9.958 1.00 45.03 H new ATOM 0 HG13 VAL A 185 13.489 7.004 9.011 1.00 45.03 H new ATOM 0 HG21 VAL A 185 12.302 4.338 8.147 1.00 73.24 H new ATOM 0 HG22 VAL A 185 12.555 5.705 7.037 1.00 73.24 H new ATOM 0 HG23 VAL A 185 13.236 4.107 6.650 1.00 73.24 H new ATOM 2897 N GLU A 186 17.667 5.868 8.042 1.00 33.33 N ATOM 2898 CA GLU A 186 18.857 6.417 8.708 1.00 12.34 C ATOM 2899 C GLU A 186 19.835 6.976 7.678 1.00 21.53 C ATOM 2900 O GLU A 186 20.766 7.704 8.028 1.00 11.45 O ATOM 2901 CB GLU A 186 19.559 5.384 9.616 1.00 73.15 C ATOM 2902 CG GLU A 186 19.828 4.081 8.869 1.00 34.43 C ATOM 2903 CD GLU A 186 20.987 3.238 9.390 1.00 24.32 C ATOM 2904 OE1 GLU A 186 22.144 3.641 9.108 1.00 12.42 O ATOM 2905 OE2 GLU A 186 20.745 2.164 9.994 1.00 1.11 O ATOM 0 H GLU A 186 17.816 4.943 7.639 1.00 33.33 H new ATOM 0 HA GLU A 186 18.515 7.226 9.354 1.00 12.34 H new ATOM 0 HB2 GLU A 186 20.499 5.797 9.981 1.00 73.15 H new ATOM 0 HB3 GLU A 186 18.939 5.183 10.489 1.00 73.15 H new ATOM 0 HG2 GLU A 186 18.922 3.475 8.898 1.00 34.43 H new ATOM 0 HG3 GLU A 186 20.019 4.318 7.822 1.00 34.43 H new ATOM 2912 N LYS A 187 19.639 6.644 6.406 1.00 1.00 N ATOM 2913 CA LYS A 187 20.447 7.094 5.283 1.00 20.34 C ATOM 2914 C LYS A 187 19.601 8.145 4.577 1.00 55.35 C ATOM 2915 O LYS A 187 19.029 7.891 3.515 1.00 13.42 O ATOM 2916 CB LYS A 187 20.794 5.895 4.391 1.00 2.12 C ATOM 2917 CG LYS A 187 21.823 4.949 5.025 1.00 1.20 C ATOM 2918 CD LYS A 187 21.764 3.574 4.356 1.00 54.23 C ATOM 2919 CE LYS A 187 23.035 2.738 4.582 1.00 54.45 C ATOM 2920 NZ LYS A 187 24.119 3.155 3.664 1.00 64.23 N ATOM 0 H LYS A 187 18.879 6.027 6.120 1.00 1.00 H new ATOM 0 HA LYS A 187 21.403 7.527 5.578 1.00 20.34 H new ATOM 0 HB2 LYS A 187 19.883 5.337 4.172 1.00 2.12 H new ATOM 0 HB3 LYS A 187 21.182 6.258 3.439 1.00 2.12 H new ATOM 0 HG2 LYS A 187 22.824 5.368 4.922 1.00 1.20 H new ATOM 0 HG3 LYS A 187 21.627 4.850 6.093 1.00 1.20 H new ATOM 0 HD2 LYS A 187 20.903 3.026 4.740 1.00 54.23 H new ATOM 0 HD3 LYS A 187 21.607 3.704 3.285 1.00 54.23 H new ATOM 0 HE2 LYS A 187 23.367 2.847 5.614 1.00 54.45 H new ATOM 0 HE3 LYS A 187 22.811 1.682 4.429 1.00 54.45 H new ATOM 0 HZ1 LYS A 187 24.964 2.575 3.838 1.00 64.23 H new ATOM 0 HZ2 LYS A 187 23.809 3.028 2.680 1.00 64.23 H new ATOM 0 HZ3 LYS A 187 24.347 4.156 3.828 1.00 64.23 H new ATOM 2934 N LYS A 188 19.444 9.300 5.219 1.00 12.01 N ATOM 2935 CA LYS A 188 18.843 10.460 4.598 1.00 63.33 C ATOM 2936 C LYS A 188 20.027 11.191 4.018 1.00 22.34 C ATOM 2937 O LYS A 188 20.108 11.309 2.791 1.00 75.44 O ATOM 2938 CB LYS A 188 18.026 11.327 5.570 1.00 64.11 C ATOM 2939 CG LYS A 188 17.176 10.543 6.587 1.00 24.42 C ATOM 2940 CD LYS A 188 16.637 11.416 7.730 1.00 33.32 C ATOM 2941 CE LYS A 188 17.637 11.667 8.882 1.00 4.01 C ATOM 2942 NZ LYS A 188 18.551 12.817 8.670 1.00 53.23 N ATOM 0 H LYS A 188 19.733 9.450 6.186 1.00 12.01 H new ATOM 0 HA LYS A 188 18.101 10.186 3.848 1.00 63.33 H new ATOM 0 HB2 LYS A 188 18.710 11.977 6.116 1.00 64.11 H new ATOM 0 HB3 LYS A 188 17.367 11.973 4.990 1.00 64.11 H new ATOM 0 HG2 LYS A 188 16.338 10.078 6.068 1.00 24.42 H new ATOM 0 HG3 LYS A 188 17.777 9.737 7.007 1.00 24.42 H new ATOM 0 HD2 LYS A 188 16.329 12.378 7.319 1.00 33.32 H new ATOM 0 HD3 LYS A 188 15.744 10.943 8.139 1.00 33.32 H new ATOM 0 HE2 LYS A 188 17.076 11.831 9.802 1.00 4.01 H new ATOM 0 HE3 LYS A 188 18.235 10.767 9.029 1.00 4.01 H new ATOM 0 HZ1 LYS A 188 18.885 13.169 9.590 1.00 53.23 H new ATOM 0 HZ2 LYS A 188 19.365 12.513 8.099 1.00 53.23 H new ATOM 0 HZ3 LYS A 188 18.044 13.576 8.172 1.00 53.23 H new TER 2956 LYS A 188