USER MOD reduce.3.24.130724 H: found=0, std=0, add=1175, rem=0, adj=44 USER MOD reduce.3.24.130724 removed 1174 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 82 TYR OH : rot 137:sc= 0.306 USER MOD Set 1.2: A 88 CYS SG : rot 180:sc= 0.291 USER MOD Single : A 1 MET CE :methyl -160:sc= -0.108 (180deg=-0.538) USER MOD Single : A 1 MET N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 3 THR OG1 : rot -90:sc= -0.514 USER MOD Single : A 10 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 14 LYS NZ :NH3+ 154:sc= -0.233 (180deg=-0.849) USER MOD Single : A 17 GLN : amide:sc= 0 X(o=0,f=-0.44) USER MOD Single : A 25 SER OG : rot 180:sc= 0 USER MOD Single : A 29 SER OG : rot 180:sc= 0 USER MOD Single : A 31 ASN :FLIP amide:sc= -0.906 F(o=-2.6,f=-0.91) USER MOD Single : A 32 ASN :FLIP amide:sc= -0.217 F(o=-3.4!,f=-0.22) USER MOD Single : A 34 MET CE :methyl -174:sc= -0.483 (180deg=-0.644) USER MOD Single : A 35 GLN :FLIP amide:sc= -0.363 F(o=-4!,f=-0.36) USER MOD Single : A 37 ASN :FLIP amide:sc= 0 F(o=-0.94,f=0) USER MOD Single : A 46 THR OG1 : rot -69:sc= 0.309 USER MOD Single : A 52 THR OG1 : rot 180:sc= 0 USER MOD Single : A 54 LYS NZ :NH3+ 153:sc= -1.93! (180deg=-3.98!) USER MOD Single : A 60 SER OG : rot 180:sc= 0 USER MOD Single : A 63 TYR OH : rot 180:sc= 0 USER MOD Single : A 65 ASN : amide:sc= -0.263 X(o=-0.26,f=-0.31) USER MOD Single : A 66 LYS NZ :NH3+ 146:sc= 0.546 (180deg=0.105) USER MOD Single : A 69 THR OG1 : rot 180:sc= 0 USER MOD Single : A 74 SER OG : rot 180:sc= 0 USER MOD Single : A 75 LYS NZ :NH3+ -132:sc= -1.37 (180deg=-3.62!) USER MOD Single : A 76 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 78 HIS : no HD1:sc= -0.0359 X(o=-0.036,f=0) USER MOD Single : A 80 ASN :FLIP amide:sc= -0.462 F(o=-4.6!,f=-0.46) USER MOD Single : A 86 SER OG : rot 180:sc= -0.23 USER MOD Single : A 93 GLN :FLIP amide:sc= 0 F(o=-1.1,f=0) USER MOD Single : A 94 ASN : amide:sc= -0.245 X(o=-0.25,f=-0.53) USER MOD Single : A 97 SER OG : rot 180:sc= 0 USER MOD Single : A 99 THR OG1 : rot 180:sc= 0 USER MOD Single : A 100 TYR OH : rot 180:sc= 0 USER MOD Single : A 103 SER OG : rot 180:sc= 0 USER MOD Single : A 104 SER OG : rot 138:sc= 0.0379 USER MOD Single : A 107 THR OG1 : rot -18:sc= 0.414 USER MOD Single : A 108 SER OG : rot 73:sc= 1.31 USER MOD Single : A 110 GLN : amide:sc= 0 K(o=0,f=-0.79) USER MOD Single : A 111 SER OG : rot -14:sc= 0.493 USER MOD Single : A 117 ASN : amide:sc= -0.55 X(o=-0.55,f=-0.87) USER MOD Single : A 119 ASN :FLIP amide:sc= 0 F(o=-0.95,f=0) USER MOD Single : A 120 SER OG : rot 180:sc= 0 USER MOD Single : A 123 ASN : amide:sc= -1.08! C(o=-1.1!,f=-3.7!) USER MOD Single : A 124 SER OG : rot 180:sc= 0 USER MOD Single : A 125 GLN : amide:sc= 0 K(o=0,f=-0.54) USER MOD Single : A 128 GLN : amide:sc= 0 K(o=0,f=-0.53) USER MOD Single : A 130 TYR OH : rot 180:sc= 0 USER MOD Single : A 131 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 133 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 134 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 137 TYR OH : rot 180:sc= 0 USER MOD Single : A 139 LYS NZ :NH3+ 161:sc= -0.0792 (180deg=-0.424) USER MOD Single : A 142 SER OG : rot 180:sc= 0 USER MOD Single : A 147 GLN :FLIP amide:sc= 0 F(o=-1.8,f=0) USER MOD Single : A 148 SER OG : rot -75:sc= 0.261 USER MOD Single : A 150 ASN :FLIP amide:sc= 0 F(o=-1.1,f=0) USER MOD Single : A 152 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 -24.504 3.509 12.032 0.61 0.00 N ATOM 2 CA MET A 1 -25.373 2.355 11.692 0.29 0.00 C ATOM 3 C MET A 1 -25.416 2.127 10.184 1.00 0.00 C ATOM 4 O MET A 1 -25.182 1.015 9.708 1.00 0.00 O ATOM 5 CB MET A 1 -26.790 2.585 12.223 0.28 0.00 C ATOM 6 CG MET A 1 -27.788 1.524 11.783 0.67 0.00 C ATOM 7 SD MET A 1 -29.408 1.732 12.544 0.14 0.00 S ATOM 8 CE MET A 1 -29.029 1.361 14.255 0.06 0.00 C ATOM 0 H1 MET A 1 -24.492 3.643 13.063 0.61 0.00 H new ATOM 0 H2 MET A 1 -23.537 3.327 11.695 0.61 0.00 H new ATOM 0 H3 MET A 1 -24.873 4.368 11.576 0.61 0.00 H new ATOM 0 HA MET A 1 -24.952 1.466 12.163 0.29 0.00 H new ATOM 0 HB2 MET A 1 -26.760 2.614 13.312 0.28 0.00 H new ATOM 0 HB3 MET A 1 -27.140 3.561 11.888 0.28 0.00 H new ATOM 0 HG2 MET A 1 -27.894 1.558 10.699 0.67 0.00 H new ATOM 0 HG3 MET A 1 -27.397 0.538 12.034 0.67 0.00 H new ATOM 0 HE1 MET A 1 -29.946 1.098 14.782 0.06 0.00 H new ATOM 0 HE2 MET A 1 -28.332 0.524 14.300 0.06 0.00 H new ATOM 0 HE3 MET A 1 -28.578 2.235 14.725 0.06 0.00 H new ATOM 20 N SER A 2 -25.716 3.184 9.436 1.00 0.00 N ATOM 21 CA SER A 2 -25.794 3.092 7.983 1.00 0.00 C ATOM 22 C SER A 2 -25.275 4.367 7.323 0.17 0.00 C ATOM 23 O SER A 2 -25.713 5.470 7.651 0.07 0.00 O ATOM 24 CB SER A 2 -27.236 2.829 7.548 1.00 0.00 C ATOM 25 OG SER A 2 -27.730 1.628 8.115 0.42 0.00 O ATOM 0 H SER A 2 -25.909 4.113 9.812 1.00 0.00 H new ATOM 0 HA SER A 2 -25.165 2.261 7.663 1.00 0.00 H new ATOM 0 HB2 SER A 2 -27.868 3.664 7.850 1.00 0.00 H new ATOM 0 HB3 SER A 2 -27.286 2.769 6.461 1.00 0.00 H new ATOM 0 HG SER A 2 -28.654 1.484 7.822 0.42 0.00 H new ATOM 31 N THR A 3 -24.340 4.203 6.391 0.43 0.00 N ATOM 32 CA THR A 3 -23.764 5.337 5.677 0.10 0.00 C ATOM 33 C THR A 3 -23.528 4.999 4.206 0.06 0.00 C ATOM 34 O THR A 3 -23.370 3.833 3.850 0.33 0.00 O ATOM 35 CB THR A 3 -22.434 5.787 6.313 1.00 0.00 C ATOM 36 OG1 THR A 3 -21.730 4.656 6.835 0.21 0.00 O ATOM 37 CG2 THR A 3 -22.679 6.800 7.421 1.00 0.00 C ATOM 0 H THR A 3 -23.966 3.296 6.113 0.43 0.00 H new ATOM 0 HA THR A 3 -24.483 6.153 5.747 0.10 0.00 H new ATOM 0 HB THR A 3 -21.829 6.260 5.539 1.00 0.00 H new ATOM 0 HG1 THR A 3 -21.993 4.508 7.767 0.21 0.00 H new ATOM 0 HG21 THR A 3 -21.726 7.103 7.855 1.00 0.00 H new ATOM 0 HG22 THR A 3 -23.184 7.674 7.010 1.00 0.00 H new ATOM 0 HG23 THR A 3 -23.303 6.350 8.194 1.00 0.00 H new ATOM 45 N PRO A 4 -23.501 6.022 3.330 1.00 0.00 N ATOM 46 CA PRO A 4 -23.283 5.822 1.892 0.44 0.00 C ATOM 47 C PRO A 4 -21.934 5.183 1.592 0.35 0.00 C ATOM 48 O PRO A 4 -21.809 4.375 0.670 0.31 0.00 O ATOM 49 CB PRO A 4 -23.342 7.241 1.311 0.06 0.00 C ATOM 50 CG PRO A 4 -23.093 8.145 2.470 0.75 0.00 C ATOM 51 CD PRO A 4 -23.672 7.446 3.665 0.58 0.00 C ATOM 0 HA PRO A 4 -24.022 5.144 1.465 0.44 0.00 H new ATOM 0 HB2 PRO A 4 -22.591 7.380 0.534 0.06 0.00 H new ATOM 0 HB3 PRO A 4 -24.312 7.441 0.856 0.06 0.00 H new ATOM 0 HG2 PRO A 4 -22.026 8.327 2.602 0.75 0.00 H new ATOM 0 HG3 PRO A 4 -23.565 9.115 2.318 0.75 0.00 H new ATOM 0 HD2 PRO A 4 -23.146 7.711 4.582 0.58 0.00 H new ATOM 0 HD3 PRO A 4 -24.721 7.703 3.814 0.58 0.00 H new ATOM 59 N ALA A 5 -20.924 5.548 2.375 0.79 0.00 N ATOM 60 CA ALA A 5 -19.581 5.009 2.193 0.05 0.00 C ATOM 61 C ALA A 5 -19.566 3.496 2.385 1.00 0.00 C ATOM 62 O ALA A 5 -18.839 2.780 1.696 0.07 0.00 O ATOM 63 CB ALA A 5 -18.609 5.675 3.156 0.14 0.00 C ATOM 0 H ALA A 5 -21.010 6.215 3.142 0.79 0.00 H new ATOM 0 HA ALA A 5 -19.266 5.223 1.172 0.05 0.00 H new ATOM 0 HB1 ALA A 5 -17.611 5.263 3.009 0.14 0.00 H new ATOM 0 HB2 ALA A 5 -18.589 6.749 2.969 0.14 0.00 H new ATOM 0 HB3 ALA A 5 -18.930 5.491 4.181 0.14 0.00 H new ATOM 69 N ARG A 6 -20.375 3.018 3.324 0.09 0.00 N ATOM 70 CA ARG A 6 -20.455 1.590 3.612 0.75 0.00 C ATOM 71 C ARG A 6 -21.080 0.830 2.447 1.00 0.00 C ATOM 72 O ARG A 6 -20.648 -0.272 2.110 0.98 0.00 O ATOM 73 CB ARG A 6 -21.267 1.354 4.887 0.45 0.00 C ATOM 74 CG ARG A 6 -20.610 1.914 6.138 0.35 0.00 C ATOM 75 CD ARG A 6 -19.389 1.101 6.540 0.47 0.00 C ATOM 76 NE ARG A 6 -19.742 -0.257 6.940 0.41 0.00 N ATOM 77 CZ ARG A 6 -19.005 -1.004 7.756 1.00 0.00 C ATOM 78 NH1 ARG A 6 -17.874 -0.527 8.258 1.00 0.00 N ATOM 79 NH2 ARG A 6 -19.397 -2.230 8.073 1.00 0.00 N ATOM 0 H ARG A 6 -20.985 3.599 3.899 0.09 0.00 H new ATOM 0 HA ARG A 6 -19.441 1.217 3.758 0.75 0.00 H new ATOM 0 HB2 ARG A 6 -22.252 1.807 4.770 0.45 0.00 H new ATOM 0 HB3 ARG A 6 -21.422 0.283 5.016 0.45 0.00 H new ATOM 0 HG2 ARG A 6 -20.317 2.949 5.964 0.35 0.00 H new ATOM 0 HG3 ARG A 6 -21.330 1.920 6.956 0.35 0.00 H new ATOM 0 HD2 ARG A 6 -18.689 1.062 5.706 0.47 0.00 H new ATOM 0 HD3 ARG A 6 -18.877 1.599 7.363 0.47 0.00 H new ATOM 0 HE ARG A 6 -20.605 -0.657 6.572 0.41 0.00 H new ATOM 0 HH11 ARG A 6 -17.567 0.416 8.018 1.00 0.00 H new ATOM 0 HH12 ARG A 6 -17.311 -1.103 8.884 1.00 0.00 H new ATOM 0 HH21 ARG A 6 -20.266 -2.602 7.691 1.00 0.00 H new ATOM 0 HH22 ARG A 6 -18.829 -2.801 8.699 1.00 0.00 H new ATOM 93 N ARG A 7 -22.097 1.426 1.835 0.19 0.00 N ATOM 94 CA ARG A 7 -22.782 0.807 0.708 0.08 0.00 C ATOM 95 C ARG A 7 -21.852 0.690 -0.497 1.00 0.00 C ATOM 96 O ARG A 7 -21.961 -0.246 -1.288 0.40 0.00 O ATOM 97 CB ARG A 7 -24.021 1.620 0.337 1.00 0.00 C ATOM 98 CG ARG A 7 -25.000 1.797 1.486 0.87 0.00 C ATOM 99 CD ARG A 7 -26.198 2.636 1.072 0.36 0.00 C ATOM 100 NE ARG A 7 -27.110 2.876 2.187 0.14 0.00 N ATOM 101 CZ ARG A 7 -28.170 3.676 2.113 1.00 0.00 C ATOM 102 NH1 ARG A 7 -28.449 4.311 0.983 0.07 0.00 N ATOM 103 NH2 ARG A 7 -28.951 3.843 3.172 0.05 0.00 N ATOM 0 H ARG A 7 -22.465 2.339 2.102 0.19 0.00 H new ATOM 0 HA ARG A 7 -23.088 -0.197 1.003 0.08 0.00 H new ATOM 0 HB2 ARG A 7 -23.708 2.602 -0.017 1.00 0.00 H new ATOM 0 HB3 ARG A 7 -24.532 1.130 -0.492 1.00 0.00 H new ATOM 0 HG2 ARG A 7 -25.340 0.820 1.830 0.87 0.00 H new ATOM 0 HG3 ARG A 7 -24.494 2.272 2.326 0.87 0.00 H new ATOM 0 HD2 ARG A 7 -25.852 3.590 0.675 0.36 0.00 H new ATOM 0 HD3 ARG A 7 -26.734 2.131 0.268 0.36 0.00 H new ATOM 0 HE ARG A 7 -26.924 2.404 3.072 0.14 0.00 H new ATOM 0 HH11 ARG A 7 -27.850 4.187 0.167 0.07 0.00 H new ATOM 0 HH12 ARG A 7 -29.263 4.924 0.930 0.07 0.00 H new ATOM 0 HH21 ARG A 7 -28.739 3.358 4.044 0.05 0.00 H new ATOM 0 HH22 ARG A 7 -29.764 4.457 3.115 0.05 0.00 H new ATOM 117 N ARG A 8 -20.938 1.649 -0.627 0.23 0.00 N ATOM 118 CA ARG A 8 -19.989 1.654 -1.735 1.00 0.00 C ATOM 119 C ARG A 8 -19.085 0.427 -1.685 1.00 0.00 C ATOM 120 O ARG A 8 -18.888 -0.250 -2.692 0.13 0.00 O ATOM 121 CB ARG A 8 -19.137 2.927 -1.704 0.08 0.00 C ATOM 122 CG ARG A 8 -19.931 4.207 -1.915 1.00 0.00 C ATOM 123 CD ARG A 8 -20.379 4.362 -3.361 0.70 0.00 C ATOM 124 NE ARG A 8 -21.445 3.427 -3.708 0.76 0.00 N ATOM 125 CZ ARG A 8 -22.036 3.390 -4.898 0.16 0.00 C ATOM 126 NH1 ARG A 8 -21.663 4.229 -5.856 1.00 0.00 N ATOM 127 NH2 ARG A 8 -23.002 2.511 -5.132 0.31 0.00 N ATOM 0 H ARG A 8 -20.835 2.431 0.020 0.23 0.00 H new ATOM 0 HA ARG A 8 -20.559 1.628 -2.664 1.00 0.00 H new ATOM 0 HB2 ARG A 8 -18.623 2.984 -0.745 0.08 0.00 H new ATOM 0 HB3 ARG A 8 -18.369 2.857 -2.474 0.08 0.00 H new ATOM 0 HG2 ARG A 8 -20.804 4.205 -1.262 1.00 0.00 H new ATOM 0 HG3 ARG A 8 -19.321 5.064 -1.629 1.00 0.00 H new ATOM 0 HD2 ARG A 8 -20.724 5.383 -3.526 0.70 0.00 H new ATOM 0 HD3 ARG A 8 -19.528 4.203 -4.023 0.70 0.00 H new ATOM 0 HE ARG A 8 -21.754 2.764 -2.997 0.76 0.00 H new ATOM 0 HH11 ARG A 8 -20.920 4.906 -5.681 1.00 0.00 H new ATOM 0 HH12 ARG A 8 -22.119 4.197 -6.768 1.00 0.00 H new ATOM 0 HH21 ARG A 8 -23.291 1.864 -4.399 0.31 0.00 H new ATOM 0 HH22 ARG A 8 -23.456 2.483 -6.045 0.31 0.00 H new ATOM 141 N LEU A 9 -18.538 0.148 -0.505 0.08 0.00 N ATOM 142 CA LEU A 9 -17.649 -0.996 -0.319 1.00 0.00 C ATOM 143 C LEU A 9 -18.306 -2.290 -0.788 0.09 0.00 C ATOM 144 O LEU A 9 -17.628 -3.208 -1.249 0.10 0.00 O ATOM 145 CB LEU A 9 -17.245 -1.120 1.152 0.22 0.00 C ATOM 146 CG LEU A 9 -16.296 -0.034 1.663 0.14 0.00 C ATOM 147 CD1 LEU A 9 -16.113 -0.154 3.169 0.35 0.00 C ATOM 148 CD2 LEU A 9 -14.952 -0.121 0.954 1.00 0.00 C ATOM 0 H LEU A 9 -18.695 0.699 0.339 0.08 0.00 H new ATOM 0 HA LEU A 9 -16.758 -0.828 -0.924 1.00 0.00 H new ATOM 0 HB2 LEU A 9 -18.148 -1.107 1.762 0.22 0.00 H new ATOM 0 HB3 LEU A 9 -16.773 -2.091 1.302 0.22 0.00 H new ATOM 0 HG LEU A 9 -16.737 0.939 1.445 0.14 0.00 H new ATOM 0 HD11 LEU A 9 -15.435 0.626 3.516 0.35 0.00 H new ATOM 0 HD12 LEU A 9 -17.078 -0.042 3.663 0.35 0.00 H new ATOM 0 HD13 LEU A 9 -15.694 -1.132 3.408 0.35 0.00 H new ATOM 0 HD21 LEU A 9 -14.291 0.659 1.331 1.00 0.00 H new ATOM 0 HD22 LEU A 9 -14.505 -1.097 1.141 1.00 0.00 H new ATOM 0 HD23 LEU A 9 -15.097 0.013 -0.118 1.00 0.00 H new ATOM 160 N MET A 10 -19.628 -2.358 -0.669 0.84 0.00 N ATOM 161 CA MET A 10 -20.369 -3.543 -1.083 1.00 0.00 C ATOM 162 C MET A 10 -20.295 -3.728 -2.596 0.29 0.00 C ATOM 163 O MET A 10 -20.069 -4.835 -3.085 1.00 0.00 O ATOM 164 CB MET A 10 -21.830 -3.440 -0.638 0.83 0.00 C ATOM 165 CG MET A 10 -21.999 -3.322 0.868 1.00 0.00 C ATOM 166 SD MET A 10 -23.728 -3.202 1.367 0.18 0.00 S ATOM 167 CE MET A 10 -23.560 -3.097 3.149 0.28 0.00 C ATOM 0 H MET A 10 -20.207 -1.608 -0.290 0.84 0.00 H new ATOM 0 HA MET A 10 -19.914 -4.411 -0.606 1.00 0.00 H new ATOM 0 HB2 MET A 10 -22.287 -2.573 -1.116 0.83 0.00 H new ATOM 0 HB3 MET A 10 -22.371 -4.319 -0.988 0.83 0.00 H new ATOM 0 HG2 MET A 10 -21.545 -4.188 1.349 1.00 0.00 H new ATOM 0 HG3 MET A 10 -21.461 -2.443 1.222 1.00 0.00 H new ATOM 0 HE1 MET A 10 -24.548 -3.018 3.604 0.28 0.00 H new ATOM 0 HE2 MET A 10 -23.060 -3.992 3.521 0.28 0.00 H new ATOM 0 HE3 MET A 10 -22.970 -2.218 3.408 0.28 0.00 H new ATOM 177 N ARG A 11 -20.488 -2.636 -3.331 0.20 0.00 N ATOM 178 CA ARG A 11 -20.443 -2.675 -4.788 0.11 0.00 C ATOM 179 C ARG A 11 -19.007 -2.792 -5.294 0.99 0.00 C ATOM 180 O ARG A 11 -18.761 -3.337 -6.370 0.37 0.00 O ATOM 181 CB ARG A 11 -21.098 -1.421 -5.372 0.43 0.00 C ATOM 182 CG ARG A 11 -22.523 -1.181 -4.892 1.00 0.00 C ATOM 183 CD ARG A 11 -23.486 -2.233 -5.422 0.12 0.00 C ATOM 184 NE ARG A 11 -23.418 -3.478 -4.659 1.00 0.00 N ATOM 185 CZ ARG A 11 -24.376 -4.400 -4.667 0.59 0.00 C ATOM 186 NH1 ARG A 11 -25.464 -4.227 -5.405 0.17 0.00 N ATOM 187 NH2 ARG A 11 -24.246 -5.500 -3.936 0.54 0.00 N ATOM 0 H ARG A 11 -20.677 -1.713 -2.940 0.20 0.00 H new ATOM 0 HA ARG A 11 -20.995 -3.556 -5.116 0.11 0.00 H new ATOM 0 HB2 ARG A 11 -20.489 -0.554 -5.116 0.43 0.00 H new ATOM 0 HB3 ARG A 11 -21.101 -1.499 -6.459 0.43 0.00 H new ATOM 0 HG2 ARG A 11 -22.544 -1.186 -3.802 1.00 0.00 H new ATOM 0 HG3 ARG A 11 -22.852 -0.193 -5.213 1.00 0.00 H new ATOM 0 HD2 ARG A 11 -24.503 -1.843 -5.387 0.12 0.00 H new ATOM 0 HD3 ARG A 11 -23.259 -2.437 -6.468 0.12 0.00 H new ATOM 0 HE ARG A 11 -22.590 -3.649 -4.089 1.00 0.00 H new ATOM 0 HH11 ARG A 11 -25.569 -3.384 -5.970 0.17 0.00 H new ATOM 0 HH12 ARG A 11 -26.196 -4.937 -5.408 0.17 0.00 H new ATOM 0 HH21 ARG A 11 -23.411 -5.639 -3.367 0.54 0.00 H new ATOM 0 HH22 ARG A 11 -24.981 -6.207 -3.943 0.54 0.00 H new ATOM 201 N ASP A 12 -18.064 -2.276 -4.511 0.34 0.00 N ATOM 202 CA ASP A 12 -16.652 -2.314 -4.886 0.07 0.00 C ATOM 203 C ASP A 12 -16.104 -3.736 -4.817 0.79 0.00 C ATOM 204 O ASP A 12 -15.423 -4.194 -5.734 0.20 0.00 O ATOM 205 CB ASP A 12 -15.835 -1.394 -3.978 0.85 0.00 C ATOM 206 CG ASP A 12 -16.307 0.045 -4.030 1.00 0.00 C ATOM 207 OD1 ASP A 12 -16.621 0.526 -5.139 0.07 0.00 O ATOM 208 OD2 ASP A 12 -16.368 0.689 -2.963 1.00 0.00 O ATOM 0 H ASP A 12 -18.250 -1.827 -3.614 0.34 0.00 H new ATOM 0 HA ASP A 12 -16.569 -1.964 -5.915 0.07 0.00 H new ATOM 0 HB2 ASP A 12 -15.896 -1.756 -2.951 0.85 0.00 H new ATOM 0 HB3 ASP A 12 -14.786 -1.439 -4.270 0.85 0.00 H new ATOM 213 N PHE A 13 -16.402 -4.426 -3.722 1.00 0.00 N ATOM 214 CA PHE A 13 -15.938 -5.796 -3.533 0.10 0.00 C ATOM 215 C PHE A 13 -16.593 -6.733 -4.541 0.07 0.00 C ATOM 216 O PHE A 13 -15.936 -7.601 -5.115 1.00 0.00 O ATOM 217 CB PHE A 13 -16.238 -6.265 -2.105 0.35 0.00 C ATOM 218 CG PHE A 13 -15.911 -7.711 -1.860 0.38 0.00 C ATOM 219 CD1 PHE A 13 -14.616 -8.182 -2.018 0.06 0.00 C ATOM 220 CD2 PHE A 13 -16.898 -8.600 -1.466 0.06 0.00 C ATOM 221 CE1 PHE A 13 -14.314 -9.510 -1.790 1.00 0.00 C ATOM 222 CE2 PHE A 13 -16.602 -9.931 -1.237 0.07 0.00 C ATOM 223 CZ PHE A 13 -15.309 -10.385 -1.399 1.00 0.00 C ATOM 0 H PHE A 13 -16.962 -4.060 -2.952 1.00 0.00 H new ATOM 0 HA PHE A 13 -14.860 -5.817 -3.694 0.10 0.00 H new ATOM 0 HB2 PHE A 13 -15.672 -5.651 -1.404 0.35 0.00 H new ATOM 0 HB3 PHE A 13 -17.294 -6.100 -1.893 0.35 0.00 H new ATOM 0 HD1 PHE A 13 -13.834 -7.502 -2.323 0.06 0.00 H new ATOM 0 HD2 PHE A 13 -17.911 -8.249 -1.336 0.06 0.00 H new ATOM 0 HE1 PHE A 13 -13.302 -9.864 -1.917 1.00 0.00 H new ATOM 0 HE2 PHE A 13 -17.381 -10.614 -0.932 0.07 0.00 H new ATOM 0 HZ PHE A 13 -15.075 -11.424 -1.220 1.00 0.00 H new ATOM 233 N LYS A 14 -17.894 -6.551 -4.748 0.36 0.00 N ATOM 234 CA LYS A 14 -18.646 -7.368 -5.685 1.00 0.00 C ATOM 235 C LYS A 14 -18.015 -7.341 -7.074 0.36 0.00 C ATOM 236 O LYS A 14 -18.050 -8.331 -7.802 0.69 0.00 O ATOM 237 CB LYS A 14 -20.082 -6.866 -5.760 0.22 0.00 C ATOM 238 CG LYS A 14 -21.085 -7.969 -6.008 0.31 0.00 C ATOM 239 CD LYS A 14 -22.507 -7.462 -5.870 0.20 0.00 C ATOM 240 CE LYS A 14 -22.954 -6.707 -7.112 0.06 0.00 C ATOM 241 NZ LYS A 14 -22.842 -7.540 -8.341 0.06 0.00 N ATOM 0 H LYS A 14 -18.449 -5.839 -4.274 0.36 0.00 H new ATOM 0 HA LYS A 14 -18.633 -8.398 -5.329 1.00 0.00 H new ATOM 0 HB2 LYS A 14 -20.332 -6.359 -4.828 0.22 0.00 H new ATOM 0 HB3 LYS A 14 -20.161 -6.126 -6.557 0.22 0.00 H new ATOM 0 HG2 LYS A 14 -20.938 -8.379 -7.007 0.31 0.00 H new ATOM 0 HG3 LYS A 14 -20.916 -8.782 -5.302 0.31 0.00 H new ATOM 0 HD2 LYS A 14 -23.178 -8.302 -5.693 0.20 0.00 H new ATOM 0 HD3 LYS A 14 -22.578 -6.808 -5.001 0.20 0.00 H new ATOM 0 HE2 LYS A 14 -23.987 -6.382 -6.987 0.06 0.00 H new ATOM 0 HE3 LYS A 14 -22.349 -5.808 -7.227 0.06 0.00 H new ATOM 0 HZ1 LYS A 14 -23.524 -7.204 -9.051 0.06 0.00 H new ATOM 0 HZ2 LYS A 14 -21.878 -7.466 -8.724 0.06 0.00 H new ATOM 0 HZ3 LYS A 14 -23.046 -8.533 -8.107 0.06 0.00 H new ATOM 255 N ARG A 15 -17.445 -6.197 -7.431 0.08 0.00 N ATOM 256 CA ARG A 15 -16.807 -6.033 -8.733 1.00 0.00 C ATOM 257 C ARG A 15 -15.413 -6.657 -8.741 1.00 0.00 C ATOM 258 O ARG A 15 -14.907 -7.055 -9.790 0.10 0.00 O ATOM 259 CB ARG A 15 -16.717 -4.546 -9.091 0.34 0.00 C ATOM 260 CG ARG A 15 -16.152 -4.282 -10.478 0.27 0.00 C ATOM 261 CD ARG A 15 -16.069 -2.792 -10.770 0.46 0.00 C ATOM 262 NE ARG A 15 -15.624 -2.524 -12.135 1.00 0.00 N ATOM 263 CZ ARG A 15 -15.433 -1.300 -12.623 0.45 0.00 C ATOM 264 NH1 ARG A 15 -15.643 -0.238 -11.859 1.00 0.00 N ATOM 265 NH2 ARG A 15 -15.032 -1.141 -13.877 1.00 0.00 N ATOM 0 H ARG A 15 -17.411 -5.368 -6.838 0.08 0.00 H new ATOM 0 HA ARG A 15 -17.416 -6.545 -9.478 1.00 0.00 H new ATOM 0 HB2 ARG A 15 -17.711 -4.105 -9.024 0.34 0.00 H new ATOM 0 HB3 ARG A 15 -16.094 -4.041 -8.353 0.34 0.00 H new ATOM 0 HG2 ARG A 15 -15.160 -4.726 -10.559 0.27 0.00 H new ATOM 0 HG3 ARG A 15 -16.779 -4.766 -11.226 0.27 0.00 H new ATOM 0 HD2 ARG A 15 -17.047 -2.337 -10.612 0.46 0.00 H new ATOM 0 HD3 ARG A 15 -15.382 -2.323 -10.066 0.46 0.00 H new ATOM 0 HE ARG A 15 -15.450 -3.319 -12.749 1.00 0.00 H new ATOM 0 HH11 ARG A 15 -15.952 -0.357 -10.894 1.00 0.00 H new ATOM 0 HH12 ARG A 15 -15.496 0.698 -12.236 1.00 0.00 H new ATOM 0 HH21 ARG A 15 -14.870 -1.956 -14.468 1.00 0.00 H new ATOM 0 HH22 ARG A 15 -14.886 -0.203 -14.251 1.00 0.00 H new ATOM 279 N LEU A 16 -14.800 -6.743 -7.564 1.00 0.00 N ATOM 280 CA LEU A 16 -13.461 -7.312 -7.437 0.24 0.00 C ATOM 281 C LEU A 16 -13.484 -8.828 -7.606 0.07 0.00 C ATOM 282 O LEU A 16 -12.667 -9.390 -8.336 1.00 0.00 O ATOM 283 CB LEU A 16 -12.857 -6.942 -6.078 0.21 0.00 C ATOM 284 CG LEU A 16 -11.353 -7.202 -5.937 0.67 0.00 C ATOM 285 CD1 LEU A 16 -10.751 -6.272 -4.897 0.06 0.00 C ATOM 286 CD2 LEU A 16 -11.086 -8.653 -5.564 1.00 0.00 C ATOM 0 H LEU A 16 -15.208 -6.426 -6.685 1.00 0.00 H new ATOM 0 HA LEU A 16 -12.842 -6.894 -8.231 0.24 0.00 H new ATOM 0 HB2 LEU A 16 -13.045 -5.885 -5.891 0.21 0.00 H new ATOM 0 HB3 LEU A 16 -13.380 -7.501 -5.302 0.21 0.00 H new ATOM 0 HG LEU A 16 -10.882 -7.004 -6.900 0.67 0.00 H new ATOM 0 HD11 LEU A 16 -9.683 -6.469 -4.808 0.06 0.00 H new ATOM 0 HD12 LEU A 16 -10.905 -5.237 -5.202 0.06 0.00 H new ATOM 0 HD13 LEU A 16 -11.233 -6.443 -3.934 0.06 0.00 H new ATOM 0 HD21 LEU A 16 -10.012 -8.813 -5.470 1.00 0.00 H new ATOM 0 HD22 LEU A 16 -11.571 -8.880 -4.615 1.00 0.00 H new ATOM 0 HD23 LEU A 16 -11.483 -9.307 -6.340 1.00 0.00 H new ATOM 298 N GLN A 17 -14.419 -9.489 -6.925 0.52 0.00 N ATOM 299 CA GLN A 17 -14.537 -10.938 -6.999 0.27 0.00 C ATOM 300 C GLN A 17 -14.743 -11.400 -8.439 0.06 0.00 C ATOM 301 O GLN A 17 -14.380 -12.520 -8.799 0.08 0.00 O ATOM 302 CB GLN A 17 -15.694 -11.414 -6.124 1.00 0.00 C ATOM 303 CG GLN A 17 -17.054 -10.913 -6.581 0.75 0.00 C ATOM 304 CD GLN A 17 -18.197 -11.511 -5.785 1.00 0.00 C ATOM 305 OE1 GLN A 17 -18.045 -11.842 -4.609 1.00 0.00 O ATOM 306 NE2 GLN A 17 -19.351 -11.653 -6.425 0.24 0.00 N ATOM 0 H GLN A 17 -15.104 -9.041 -6.317 0.52 0.00 H new ATOM 0 HA GLN A 17 -13.607 -11.374 -6.633 0.27 0.00 H new ATOM 0 HB2 GLN A 17 -15.704 -12.504 -6.112 1.00 0.00 H new ATOM 0 HB3 GLN A 17 -15.522 -11.085 -5.099 1.00 0.00 H new ATOM 0 HG2 GLN A 17 -17.085 -9.827 -6.493 0.75 0.00 H new ATOM 0 HG3 GLN A 17 -17.188 -11.151 -7.636 0.75 0.00 H new ATOM 0 HE21 GLN A 17 -19.432 -11.365 -7.400 0.24 0.00 H new ATOM 0 HE22 GLN A 17 -20.157 -12.050 -5.942 0.24 0.00 H new ATOM 315 N GLU A 18 -15.328 -10.531 -9.259 1.00 0.00 N ATOM 316 CA GLU A 18 -15.579 -10.852 -10.661 1.00 0.00 C ATOM 317 C GLU A 18 -14.270 -10.946 -11.437 0.23 0.00 C ATOM 318 O GLU A 18 -14.069 -11.870 -12.227 1.00 0.00 O ATOM 319 CB GLU A 18 -16.487 -9.796 -11.294 0.12 0.00 C ATOM 320 CG GLU A 18 -17.881 -9.751 -10.692 1.00 0.00 C ATOM 321 CD GLU A 18 -18.642 -11.048 -10.886 0.17 0.00 C ATOM 322 OE1 GLU A 18 -19.307 -11.196 -11.933 0.20 0.00 O ATOM 323 OE2 GLU A 18 -18.572 -11.918 -9.993 0.10 0.00 O ATOM 0 H GLU A 18 -15.637 -9.601 -8.977 1.00 0.00 H new ATOM 0 HA GLU A 18 -16.078 -11.820 -10.704 1.00 0.00 H new ATOM 0 HB2 GLU A 18 -16.022 -8.816 -11.185 0.12 0.00 H new ATOM 0 HB3 GLU A 18 -16.568 -9.993 -12.363 0.12 0.00 H new ATOM 0 HG2 GLU A 18 -17.806 -9.534 -9.626 1.00 0.00 H new ATOM 0 HG3 GLU A 18 -18.442 -8.934 -11.145 1.00 0.00 H new ATOM 330 N ASP A 19 -13.382 -9.985 -11.205 0.06 0.00 N ATOM 331 CA ASP A 19 -12.091 -9.955 -11.881 1.00 0.00 C ATOM 332 C ASP A 19 -11.095 -9.086 -11.112 1.00 0.00 C ATOM 333 O ASP A 19 -10.969 -7.892 -11.380 1.00 0.00 O ATOM 334 CB ASP A 19 -12.248 -9.424 -13.309 0.12 0.00 C ATOM 335 CG ASP A 19 -10.927 -9.364 -14.052 0.43 0.00 C ATOM 336 OD1 ASP A 19 -10.501 -10.407 -14.591 0.06 0.00 O ATOM 337 OD2 ASP A 19 -10.318 -8.274 -14.093 1.00 0.00 O ATOM 0 H ASP A 19 -13.534 -9.216 -10.553 0.06 0.00 H new ATOM 0 HA ASP A 19 -11.707 -10.974 -11.920 1.00 0.00 H new ATOM 0 HB2 ASP A 19 -12.941 -10.062 -13.857 0.12 0.00 H new ATOM 0 HB3 ASP A 19 -12.689 -8.428 -13.277 0.12 0.00 H new ATOM 342 N PRO A 20 -10.379 -9.677 -10.138 0.10 0.00 N ATOM 343 CA PRO A 20 -9.393 -8.948 -9.335 0.05 0.00 C ATOM 344 C PRO A 20 -8.199 -8.493 -10.169 0.69 0.00 C ATOM 345 O PRO A 20 -7.924 -9.060 -11.227 0.20 0.00 O ATOM 346 CB PRO A 20 -8.950 -9.973 -8.287 1.00 0.00 C ATOM 347 CG PRO A 20 -9.246 -11.297 -8.900 0.54 0.00 C ATOM 348 CD PRO A 20 -10.475 -11.094 -9.740 0.06 0.00 C ATOM 0 HA PRO A 20 -9.811 -8.038 -8.905 0.05 0.00 H new ATOM 0 HB2 PRO A 20 -7.889 -9.871 -8.058 1.00 0.00 H new ATOM 0 HB3 PRO A 20 -9.492 -9.841 -7.351 1.00 0.00 H new ATOM 0 HG2 PRO A 20 -8.410 -11.642 -9.508 0.54 0.00 H new ATOM 0 HG3 PRO A 20 -9.417 -12.053 -8.134 0.54 0.00 H new ATOM 0 HD2 PRO A 20 -10.485 -11.756 -10.606 0.06 0.00 H new ATOM 0 HD3 PRO A 20 -11.386 -11.293 -9.176 0.06 0.00 H new ATOM 356 N PRO A 21 -7.471 -7.460 -9.707 0.06 0.00 N ATOM 357 CA PRO A 21 -6.302 -6.941 -10.423 1.00 0.00 C ATOM 358 C PRO A 21 -5.217 -8.001 -10.587 0.11 0.00 C ATOM 359 O PRO A 21 -5.112 -8.923 -9.779 0.36 0.00 O ATOM 360 CB PRO A 21 -5.802 -5.795 -9.534 0.12 0.00 C ATOM 361 CG PRO A 21 -6.960 -5.443 -8.662 1.00 0.00 C ATOM 362 CD PRO A 21 -7.727 -6.717 -8.460 1.00 0.00 C ATOM 0 HA PRO A 21 -6.554 -6.623 -11.435 1.00 0.00 H new ATOM 0 HB2 PRO A 21 -4.942 -6.104 -8.940 0.12 0.00 H new ATOM 0 HB3 PRO A 21 -5.486 -4.941 -10.133 0.12 0.00 H new ATOM 0 HG2 PRO A 21 -6.622 -5.036 -7.709 1.00 0.00 H new ATOM 0 HG3 PRO A 21 -7.584 -4.682 -9.130 1.00 0.00 H new ATOM 0 HD2 PRO A 21 -7.377 -7.264 -7.585 1.00 0.00 H new ATOM 0 HD3 PRO A 21 -8.791 -6.529 -8.314 1.00 0.00 H new ATOM 370 N VAL A 22 -4.414 -7.866 -11.639 1.00 0.00 N ATOM 371 CA VAL A 22 -3.341 -8.816 -11.905 0.80 0.00 C ATOM 372 C VAL A 22 -2.056 -8.412 -11.186 0.08 0.00 C ATOM 373 O VAL A 22 -1.699 -7.235 -11.144 0.23 0.00 O ATOM 374 CB VAL A 22 -3.061 -8.938 -13.417 0.10 0.00 C ATOM 375 CG1 VAL A 22 -2.736 -7.578 -14.013 0.81 0.00 C ATOM 376 CG2 VAL A 22 -1.931 -9.927 -13.680 1.00 0.00 C ATOM 0 H VAL A 22 -4.487 -7.109 -12.319 1.00 0.00 H new ATOM 0 HA VAL A 22 -3.673 -9.783 -11.527 0.80 0.00 H new ATOM 0 HB VAL A 22 -3.961 -9.316 -13.901 0.10 0.00 H new ATOM 0 HG11 VAL A 22 -2.542 -7.685 -15.080 0.81 0.00 H new ATOM 0 HG12 VAL A 22 -3.580 -6.904 -13.864 0.81 0.00 H new ATOM 0 HG13 VAL A 22 -1.853 -7.168 -13.523 0.81 0.00 H new ATOM 0 HG21 VAL A 22 -1.751 -9.997 -14.753 1.00 0.00 H new ATOM 0 HG22 VAL A 22 -1.024 -9.584 -13.181 1.00 0.00 H new ATOM 0 HG23 VAL A 22 -2.209 -10.908 -13.294 1.00 0.00 H new ATOM 386 N GLY A 23 -1.367 -9.400 -10.620 0.47 0.00 N ATOM 387 CA GLY A 23 -0.130 -9.131 -9.912 0.08 0.00 C ATOM 388 C GLY A 23 -0.363 -8.579 -8.518 1.00 0.00 C ATOM 389 O GLY A 23 0.587 -8.347 -7.769 0.54 0.00 O ATOM 0 H GLY A 23 -1.645 -10.381 -10.640 0.47 0.00 H new ATOM 0 HA2 GLY A 23 0.451 -10.050 -9.842 0.08 0.00 H new ATOM 0 HA3 GLY A 23 0.465 -8.420 -10.485 0.08 0.00 H new ATOM 393 N VAL A 24 -1.628 -8.369 -8.170 1.00 0.00 N ATOM 394 CA VAL A 24 -1.982 -7.840 -6.857 0.40 0.00 C ATOM 395 C VAL A 24 -3.447 -8.109 -6.530 0.05 0.00 C ATOM 396 O VAL A 24 -4.310 -8.052 -7.407 0.75 0.00 O ATOM 397 CB VAL A 24 -1.719 -6.323 -6.774 0.06 0.00 C ATOM 398 CG1 VAL A 24 -2.491 -5.582 -7.855 0.19 0.00 C ATOM 399 CG2 VAL A 24 -2.079 -5.790 -5.395 0.34 0.00 C ATOM 0 H VAL A 24 -2.425 -8.557 -8.778 1.00 0.00 H new ATOM 0 HA VAL A 24 -1.352 -8.352 -6.130 0.40 0.00 H new ATOM 0 HB VAL A 24 -0.655 -6.153 -6.939 0.06 0.00 H new ATOM 0 HG11 VAL A 24 -2.291 -4.513 -7.778 0.19 0.00 H new ATOM 0 HG12 VAL A 24 -2.178 -5.940 -8.836 0.19 0.00 H new ATOM 0 HG13 VAL A 24 -3.559 -5.761 -7.727 0.19 0.00 H new ATOM 0 HG21 VAL A 24 -1.886 -4.718 -5.358 0.34 0.00 H new ATOM 0 HG22 VAL A 24 -3.135 -5.976 -5.197 0.34 0.00 H new ATOM 0 HG23 VAL A 24 -1.475 -6.294 -4.641 0.34 0.00 H new ATOM 409 N SER A 25 -3.722 -8.406 -5.263 0.07 0.00 N ATOM 410 CA SER A 25 -5.087 -8.681 -4.821 0.07 0.00 C ATOM 411 C SER A 25 -5.375 -8.001 -3.487 0.11 0.00 C ATOM 412 O SER A 25 -4.479 -7.829 -2.662 0.06 0.00 O ATOM 413 CB SER A 25 -5.311 -10.188 -4.696 0.05 0.00 C ATOM 414 OG SER A 25 -6.640 -10.475 -4.297 0.59 0.00 O ATOM 0 H SER A 25 -3.020 -8.462 -4.525 0.07 0.00 H new ATOM 0 HA SER A 25 -5.771 -8.279 -5.568 0.07 0.00 H new ATOM 0 HB2 SER A 25 -5.103 -10.670 -5.651 0.05 0.00 H new ATOM 0 HB3 SER A 25 -4.612 -10.604 -3.970 0.05 0.00 H new ATOM 0 HG SER A 25 -6.758 -11.445 -4.226 0.59 0.00 H new ATOM 420 N GLY A 26 -6.629 -7.608 -3.287 0.09 0.00 N ATOM 421 CA GLY A 26 -7.014 -6.957 -2.048 0.71 0.00 C ATOM 422 C GLY A 26 -8.459 -7.222 -1.676 0.41 0.00 C ATOM 423 O GLY A 26 -9.371 -6.581 -2.199 0.40 0.00 O ATOM 0 H GLY A 26 -7.385 -7.729 -3.961 0.09 0.00 H new ATOM 0 HA2 GLY A 26 -6.366 -7.303 -1.243 0.71 0.00 H new ATOM 0 HA3 GLY A 26 -6.858 -5.882 -2.143 0.71 0.00 H new ATOM 427 N ALA A 27 -8.671 -8.168 -0.766 0.46 0.00 N ATOM 428 CA ALA A 27 -10.015 -8.516 -0.322 1.00 0.00 C ATOM 429 C ALA A 27 -10.001 -9.004 1.127 0.31 0.00 C ATOM 430 O ALA A 27 -8.974 -9.476 1.614 1.00 0.00 O ATOM 431 CB ALA A 27 -10.613 -9.577 -1.234 0.07 0.00 C ATOM 0 H ALA A 27 -7.928 -8.707 -0.322 0.46 0.00 H new ATOM 0 HA ALA A 27 -10.635 -7.621 -0.372 1.00 0.00 H new ATOM 0 HB1 ALA A 27 -11.617 -9.828 -0.891 0.07 0.00 H new ATOM 0 HB2 ALA A 27 -10.663 -9.194 -2.253 0.07 0.00 H new ATOM 0 HB3 ALA A 27 -9.988 -10.470 -1.212 0.07 0.00 H new ATOM 437 N PRO A 28 -11.141 -8.897 1.837 1.00 0.00 N ATOM 438 CA PRO A 28 -11.237 -9.330 3.233 0.95 0.00 C ATOM 439 C PRO A 28 -11.229 -10.849 3.370 0.80 0.00 C ATOM 440 O PRO A 28 -12.075 -11.537 2.799 0.73 0.00 O ATOM 441 CB PRO A 28 -12.579 -8.757 3.688 0.17 0.00 C ATOM 442 CG PRO A 28 -13.392 -8.673 2.444 0.33 0.00 C ATOM 443 CD PRO A 28 -12.421 -8.353 1.338 0.52 0.00 C ATOM 0 HA PRO A 28 -10.389 -8.988 3.827 0.95 0.00 H new ATOM 0 HB2 PRO A 28 -13.054 -9.400 4.429 0.17 0.00 H new ATOM 0 HB3 PRO A 28 -12.456 -7.777 4.148 0.17 0.00 H new ATOM 0 HG2 PRO A 28 -13.909 -9.613 2.251 0.33 0.00 H new ATOM 0 HG3 PRO A 28 -14.157 -7.901 2.528 0.33 0.00 H new ATOM 0 HD2 PRO A 28 -12.716 -8.818 0.397 0.52 0.00 H new ATOM 0 HD3 PRO A 28 -12.358 -7.280 1.157 0.52 0.00 H new ATOM 451 N SER A 29 -10.266 -11.365 4.129 0.35 0.00 N ATOM 452 CA SER A 29 -10.148 -12.805 4.339 0.08 0.00 C ATOM 453 C SER A 29 -11.276 -13.322 5.224 1.00 0.00 C ATOM 454 O SER A 29 -12.240 -13.913 4.736 0.59 0.00 O ATOM 455 CB SER A 29 -8.793 -13.141 4.968 1.00 0.00 C ATOM 456 OG SER A 29 -8.656 -14.538 5.167 0.74 0.00 O ATOM 0 H SER A 29 -9.558 -10.809 4.608 0.35 0.00 H new ATOM 0 HA SER A 29 -10.221 -13.295 3.368 0.08 0.00 H new ATOM 0 HB2 SER A 29 -7.990 -12.782 4.324 1.00 0.00 H new ATOM 0 HB3 SER A 29 -8.693 -12.623 5.922 1.00 0.00 H new ATOM 0 HG SER A 29 -7.782 -14.727 5.568 0.74 0.00 H new ATOM 462 N GLU A 30 -11.151 -13.093 6.527 0.35 0.00 N ATOM 463 CA GLU A 30 -12.162 -13.536 7.483 1.00 0.00 C ATOM 464 C GLU A 30 -12.689 -12.360 8.296 0.08 0.00 C ATOM 465 O GLU A 30 -13.841 -12.358 8.732 0.96 0.00 O ATOM 466 CB GLU A 30 -11.582 -14.598 8.418 0.30 0.00 C ATOM 467 CG GLU A 30 -10.410 -14.103 9.250 0.76 0.00 C ATOM 468 CD GLU A 30 -9.870 -15.167 10.185 0.13 0.00 C ATOM 469 OE1 GLU A 30 -10.393 -15.288 11.313 1.00 0.00 O ATOM 470 OE2 GLU A 30 -8.923 -15.881 9.788 0.43 0.00 O ATOM 0 H GLU A 30 -10.360 -12.604 6.946 0.35 0.00 H new ATOM 0 HA GLU A 30 -12.990 -13.971 6.923 1.00 0.00 H new ATOM 0 HB2 GLU A 30 -12.368 -14.950 9.086 0.30 0.00 H new ATOM 0 HB3 GLU A 30 -11.260 -15.455 7.826 0.30 0.00 H new ATOM 0 HG2 GLU A 30 -9.613 -13.769 8.586 0.76 0.00 H new ATOM 0 HG3 GLU A 30 -10.723 -13.237 9.833 0.76 0.00 H new ATOM 477 N ASN A 31 -11.835 -11.361 8.499 0.08 0.00 N ATOM 478 CA ASN A 31 -12.210 -10.174 9.260 0.15 0.00 C ATOM 479 C ASN A 31 -13.345 -9.424 8.574 1.00 0.00 C ATOM 480 O ASN A 31 -13.446 -9.424 7.346 1.00 0.00 O ATOM 481 CB ASN A 31 -11.009 -9.246 9.433 0.07 0.00 C ATOM 482 CG ASN A 31 -11.278 -8.145 10.439 0.23 0.00 C ATOM 483 OD1 ASN A 31 -11.925 -7.076 9.987 1.00 0.00 O flip ATOM 484 ND2 ASN A 31 -10.921 -8.257 11.612 0.08 0.00 N flip ATOM 0 H ASN A 31 -10.878 -11.350 8.147 0.08 0.00 H new ATOM 0 HA ASN A 31 -12.551 -10.501 10.242 0.15 0.00 H new ATOM 0 HB2 ASN A 31 -10.146 -9.828 9.756 0.07 0.00 H new ATOM 0 HB3 ASN A 31 -10.753 -8.802 8.471 0.07 0.00 H new ATOM 0 HD21 ASN A 31 -10.426 -9.095 11.917 0.08 0.00 H new ATOM 0 HD22 ASN A 31 -11.120 -7.511 12.279 0.08 0.00 H new ATOM 491 N ASN A 32 -14.203 -8.799 9.377 0.40 0.00 N ATOM 492 CA ASN A 32 -15.341 -8.042 8.858 0.26 0.00 C ATOM 493 C ASN A 32 -14.911 -7.087 7.746 0.08 0.00 C ATOM 494 O ASN A 32 -13.720 -6.851 7.538 1.00 0.00 O ATOM 495 CB ASN A 32 -16.014 -7.253 9.984 1.00 0.00 C ATOM 496 CG ASN A 32 -16.745 -8.143 10.975 1.00 0.00 C ATOM 497 OD1 ASN A 32 -16.224 -9.345 11.199 0.09 0.00 O flip ATOM 498 ND2 ASN A 32 -17.768 -7.751 11.537 0.12 0.00 N flip ATOM 0 H ASN A 32 -14.132 -8.802 10.394 0.40 0.00 H new ATOM 0 HA ASN A 32 -16.052 -8.756 8.442 0.26 0.00 H new ATOM 0 HB2 ASN A 32 -15.260 -6.671 10.514 1.00 0.00 H new ATOM 0 HB3 ASN A 32 -16.719 -6.543 9.552 1.00 0.00 H new ATOM 0 HD21 ASN A 32 -18.135 -6.821 11.337 0.12 0.00 H new ATOM 0 HD22 ASN A 32 -18.248 -8.357 12.203 0.12 0.00 H new ATOM 505 N ILE A 33 -15.894 -6.534 7.041 0.11 0.00 N ATOM 506 CA ILE A 33 -15.632 -5.609 5.942 1.00 0.00 C ATOM 507 C ILE A 33 -14.773 -4.427 6.393 0.19 0.00 C ATOM 508 O ILE A 33 -14.199 -3.715 5.569 0.53 0.00 O ATOM 509 CB ILE A 33 -16.947 -5.083 5.329 0.08 0.00 C ATOM 510 CG1 ILE A 33 -16.669 -4.337 4.022 0.35 0.00 C ATOM 511 CG2 ILE A 33 -17.675 -4.182 6.316 1.00 0.00 C ATOM 512 CD1 ILE A 33 -17.921 -3.984 3.248 0.32 0.00 C ATOM 0 H ILE A 33 -16.884 -6.711 7.212 0.11 0.00 H new ATOM 0 HA ILE A 33 -15.084 -6.169 5.184 1.00 0.00 H new ATOM 0 HB ILE A 33 -17.588 -5.936 5.108 0.08 0.00 H new ATOM 0 HG12 ILE A 33 -16.120 -3.422 4.245 0.35 0.00 H new ATOM 0 HG13 ILE A 33 -16.024 -4.951 3.393 0.35 0.00 H new ATOM 0 HG21 ILE A 33 -18.600 -3.821 5.866 1.00 0.00 H new ATOM 0 HG22 ILE A 33 -17.907 -4.745 7.220 1.00 0.00 H new ATOM 0 HG23 ILE A 33 -17.040 -3.333 6.571 1.00 0.00 H new ATOM 0 HD11 ILE A 33 -17.647 -3.457 2.334 0.32 0.00 H new ATOM 0 HD12 ILE A 33 -18.461 -4.896 2.993 0.32 0.00 H new ATOM 0 HD13 ILE A 33 -18.558 -3.344 3.859 0.32 0.00 H new ATOM 524 N MET A 34 -14.686 -4.224 7.705 0.09 0.00 N ATOM 525 CA MET A 34 -13.894 -3.131 8.257 0.11 0.00 C ATOM 526 C MET A 34 -12.425 -3.267 7.866 0.88 0.00 C ATOM 527 O MET A 34 -11.864 -2.390 7.209 0.11 0.00 O ATOM 528 CB MET A 34 -14.028 -3.093 9.781 1.00 0.00 C ATOM 529 CG MET A 34 -15.437 -2.787 10.258 0.15 0.00 C ATOM 530 SD MET A 34 -15.562 -2.714 12.056 0.41 0.00 S ATOM 531 CE MET A 34 -15.129 -4.396 12.497 0.84 0.00 C ATOM 0 H MET A 34 -15.154 -4.801 8.404 0.09 0.00 H new ATOM 0 HA MET A 34 -14.275 -2.197 7.843 0.11 0.00 H new ATOM 0 HB2 MET A 34 -13.715 -4.054 10.189 1.00 0.00 H new ATOM 0 HB3 MET A 34 -13.347 -2.341 10.179 1.00 0.00 H new ATOM 0 HG2 MET A 34 -15.760 -1.835 9.836 0.15 0.00 H new ATOM 0 HG3 MET A 34 -16.118 -3.550 9.881 0.15 0.00 H new ATOM 0 HE1 MET A 34 -15.265 -4.537 13.569 0.84 0.00 H new ATOM 0 HE2 MET A 34 -15.771 -5.091 11.955 0.84 0.00 H new ATOM 0 HE3 MET A 34 -14.088 -4.584 12.235 0.84 0.00 H new ATOM 541 N GLN A 35 -11.808 -4.372 8.273 0.85 0.00 N ATOM 542 CA GLN A 35 -10.403 -4.621 7.964 0.52 0.00 C ATOM 543 C GLN A 35 -10.276 -5.560 6.766 0.28 0.00 C ATOM 544 O GLN A 35 -11.000 -6.550 6.664 1.00 0.00 O ATOM 545 CB GLN A 35 -9.689 -5.221 9.175 1.00 0.00 C ATOM 546 CG GLN A 35 -8.193 -4.958 9.194 0.08 0.00 C ATOM 547 CD GLN A 35 -7.860 -3.538 9.609 1.00 0.00 C ATOM 548 OE1 GLN A 35 -7.800 -2.634 8.639 0.87 0.00 O flip ATOM 549 NE2 GLN A 35 -7.662 -3.257 10.791 0.16 0.00 N flip ATOM 0 H GLN A 35 -12.258 -5.109 8.817 0.85 0.00 H new ATOM 0 HA GLN A 35 -9.934 -3.669 7.714 0.52 0.00 H new ATOM 0 HB2 GLN A 35 -10.132 -4.815 10.085 1.00 0.00 H new ATOM 0 HB3 GLN A 35 -9.860 -6.297 9.190 1.00 0.00 H new ATOM 0 HG2 GLN A 35 -7.713 -5.656 9.880 0.08 0.00 H new ATOM 0 HG3 GLN A 35 -7.781 -5.150 8.203 0.08 0.00 H new ATOM 0 HE21 GLN A 35 -7.718 -3.984 11.504 0.16 0.00 H new ATOM 0 HE22 GLN A 35 -7.442 -2.297 11.057 0.16 0.00 H new ATOM 558 N TRP A 36 -9.354 -5.242 5.862 0.20 0.00 N ATOM 559 CA TRP A 36 -9.138 -6.053 4.667 0.05 0.00 C ATOM 560 C TRP A 36 -7.730 -6.641 4.647 0.21 0.00 C ATOM 561 O TRP A 36 -6.855 -6.210 5.396 0.93 0.00 O ATOM 562 CB TRP A 36 -9.365 -5.212 3.407 0.48 0.00 C ATOM 563 CG TRP A 36 -10.813 -5.010 3.064 0.41 0.00 C ATOM 564 CD1 TRP A 36 -11.856 -4.881 3.936 1.00 0.00 C ATOM 565 CD2 TRP A 36 -11.375 -4.909 1.750 0.21 0.00 C ATOM 566 NE1 TRP A 36 -13.031 -4.709 3.244 0.24 0.00 N ATOM 567 CE2 TRP A 36 -12.762 -4.723 1.901 1.00 0.00 C ATOM 568 CE3 TRP A 36 -10.838 -4.957 0.460 0.17 0.00 C ATOM 569 CZ2 TRP A 36 -13.618 -4.585 0.811 0.36 0.00 C ATOM 570 CZ3 TRP A 36 -11.689 -4.821 -0.621 0.18 0.00 C ATOM 571 CH2 TRP A 36 -13.065 -4.637 -0.439 0.24 0.00 C ATOM 0 H TRP A 36 -8.744 -4.428 5.934 0.20 0.00 H new ATOM 0 HA TRP A 36 -9.854 -6.875 4.687 0.05 0.00 H new ATOM 0 HB2 TRP A 36 -8.894 -4.238 3.542 0.48 0.00 H new ATOM 0 HB3 TRP A 36 -8.866 -5.693 2.566 0.48 0.00 H new ATOM 0 HD1 TRP A 36 -11.770 -4.910 5.012 1.00 0.00 H new ATOM 0 HE1 TRP A 36 -13.954 -4.590 3.663 0.24 0.00 H new ATOM 0 HE3 TRP A 36 -9.778 -5.098 0.311 0.17 0.00 H new ATOM 0 HZ2 TRP A 36 -14.680 -4.442 0.948 0.36 0.00 H new ATOM 0 HZ3 TRP A 36 -11.286 -4.857 -1.622 0.18 0.00 H new ATOM 0 HH2 TRP A 36 -13.703 -4.534 -1.304 0.24 0.00 H new ATOM 582 N ASN A 37 -7.523 -7.632 3.784 0.16 0.00 N ATOM 583 CA ASN A 37 -6.223 -8.279 3.654 0.16 0.00 C ATOM 584 C ASN A 37 -5.768 -8.284 2.199 0.06 0.00 C ATOM 585 O ASN A 37 -6.311 -9.016 1.371 0.21 0.00 O ATOM 586 CB ASN A 37 -6.284 -9.713 4.188 0.40 0.00 C ATOM 587 CG ASN A 37 -4.950 -10.430 4.082 0.06 0.00 C ATOM 588 OD1 ASN A 37 -3.861 -9.682 4.226 0.30 0.00 O flip ATOM 589 ND2 ASN A 37 -4.900 -11.643 3.881 0.83 0.00 N flip ATOM 0 H ASN A 37 -8.242 -8.004 3.163 0.16 0.00 H new ATOM 0 HA ASN A 37 -5.501 -7.713 4.243 0.16 0.00 H new ATOM 0 HB2 ASN A 37 -6.602 -9.696 5.231 0.40 0.00 H new ATOM 0 HB3 ASN A 37 -7.038 -10.272 3.634 0.40 0.00 H new ATOM 0 HD21 ASN A 37 -5.762 -12.179 3.776 0.83 0.00 H new ATOM 0 HD22 ASN A 37 -3.997 -12.113 3.819 0.83 0.00 H new ATOM 596 N ALA A 38 -4.770 -7.460 1.893 1.00 0.00 N ATOM 597 CA ALA A 38 -4.251 -7.364 0.535 1.00 0.00 C ATOM 598 C ALA A 38 -2.793 -7.804 0.463 0.21 0.00 C ATOM 599 O ALA A 38 -2.031 -7.629 1.415 0.40 0.00 O ATOM 600 CB ALA A 38 -4.398 -5.943 0.016 0.71 0.00 C ATOM 0 H ALA A 38 -4.306 -6.851 2.567 1.00 0.00 H new ATOM 0 HA ALA A 38 -4.834 -8.036 -0.094 1.00 0.00 H new ATOM 0 HB1 ALA A 38 -4.007 -5.884 -1.000 0.71 0.00 H new ATOM 0 HB2 ALA A 38 -5.451 -5.663 0.016 0.71 0.00 H new ATOM 0 HB3 ALA A 38 -3.842 -5.261 0.659 0.71 0.00 H new ATOM 606 N VAL A 39 -2.414 -8.376 -0.675 0.05 0.00 N ATOM 607 CA VAL A 39 -1.050 -8.840 -0.887 0.98 0.00 C ATOM 608 C VAL A 39 -0.474 -8.249 -2.170 0.06 0.00 C ATOM 609 O VAL A 39 -0.936 -8.559 -3.268 0.11 0.00 O ATOM 610 CB VAL A 39 -0.986 -10.377 -0.966 0.29 0.00 C ATOM 611 CG1 VAL A 39 0.456 -10.849 -1.066 0.24 0.00 C ATOM 612 CG2 VAL A 39 -1.679 -11.004 0.233 1.00 0.00 C ATOM 0 H VAL A 39 -3.037 -8.529 -1.468 0.05 0.00 H new ATOM 0 HA VAL A 39 -0.459 -8.507 -0.034 0.98 0.00 H new ATOM 0 HB VAL A 39 -1.510 -10.697 -1.866 0.29 0.00 H new ATOM 0 HG11 VAL A 39 0.480 -11.937 -1.121 0.24 0.00 H new ATOM 0 HG12 VAL A 39 0.915 -10.431 -1.962 0.24 0.00 H new ATOM 0 HG13 VAL A 39 1.009 -10.518 -0.187 0.24 0.00 H new ATOM 0 HG21 VAL A 39 -1.623 -12.090 0.159 1.00 0.00 H new ATOM 0 HG22 VAL A 39 -1.187 -10.677 1.149 1.00 0.00 H new ATOM 0 HG23 VAL A 39 -2.724 -10.695 0.252 1.00 0.00 H new ATOM 622 N ILE A 40 0.536 -7.395 -2.025 0.72 0.00 N ATOM 623 CA ILE A 40 1.168 -6.763 -3.176 1.00 0.00 C ATOM 624 C ILE A 40 2.526 -7.391 -3.467 0.09 0.00 C ATOM 625 O ILE A 40 3.331 -7.602 -2.560 0.15 0.00 O ATOM 626 CB ILE A 40 1.352 -5.243 -2.963 0.98 0.00 C ATOM 627 CG1 ILE A 40 -0.006 -4.570 -2.732 0.66 0.00 C ATOM 628 CG2 ILE A 40 2.065 -4.623 -4.159 1.00 0.00 C ATOM 629 CD1 ILE A 40 0.077 -3.069 -2.542 0.08 0.00 C ATOM 0 H ILE A 40 0.932 -7.126 -1.124 0.72 0.00 H new ATOM 0 HA ILE A 40 0.504 -6.922 -4.025 1.00 0.00 H new ATOM 0 HB ILE A 40 1.968 -5.085 -2.078 0.98 0.00 H new ATOM 0 HG12 ILE A 40 -0.655 -4.784 -3.581 0.66 0.00 H new ATOM 0 HG13 ILE A 40 -0.475 -5.012 -1.853 0.66 0.00 H new ATOM 0 HG21 ILE A 40 2.187 -3.552 -3.995 1.00 0.00 H new ATOM 0 HG22 ILE A 40 3.044 -5.086 -4.279 1.00 0.00 H new ATOM 0 HG23 ILE A 40 1.474 -4.786 -5.060 1.00 0.00 H new ATOM 0 HD11 ILE A 40 -0.924 -2.666 -2.384 0.08 0.00 H new ATOM 0 HD12 ILE A 40 0.699 -2.846 -1.675 0.08 0.00 H new ATOM 0 HD13 ILE A 40 0.515 -2.614 -3.430 0.08 0.00 H new ATOM 641 N PHE A 41 2.770 -7.688 -4.739 0.38 0.00 N ATOM 642 CA PHE A 41 4.032 -8.288 -5.155 0.16 0.00 C ATOM 643 C PHE A 41 4.904 -7.261 -5.869 0.05 0.00 C ATOM 644 O PHE A 41 4.424 -6.517 -6.726 0.07 0.00 O ATOM 645 CB PHE A 41 3.775 -9.488 -6.069 0.09 0.00 C ATOM 646 CG PHE A 41 2.884 -10.533 -5.456 0.57 0.00 C ATOM 647 CD1 PHE A 41 3.214 -11.119 -4.244 0.12 0.00 C ATOM 648 CD2 PHE A 41 1.718 -10.928 -6.093 1.00 0.00 C ATOM 649 CE1 PHE A 41 2.399 -12.079 -3.679 1.00 0.00 C ATOM 650 CE2 PHE A 41 0.898 -11.888 -5.532 0.54 0.00 C ATOM 651 CZ PHE A 41 1.239 -12.466 -4.324 0.26 0.00 C ATOM 0 H PHE A 41 2.110 -7.523 -5.499 0.38 0.00 H new ATOM 0 HA PHE A 41 4.559 -8.631 -4.265 0.16 0.00 H new ATOM 0 HB2 PHE A 41 3.324 -9.137 -6.997 0.09 0.00 H new ATOM 0 HB3 PHE A 41 4.729 -9.945 -6.331 0.09 0.00 H new ATOM 0 HD1 PHE A 41 4.119 -10.821 -3.736 0.12 0.00 H new ATOM 0 HD2 PHE A 41 1.448 -10.481 -7.038 1.00 0.00 H new ATOM 0 HE1 PHE A 41 2.667 -12.527 -2.734 1.00 0.00 H new ATOM 0 HE2 PHE A 41 -0.009 -12.186 -6.037 0.54 0.00 H new ATOM 0 HZ PHE A 41 0.601 -13.218 -3.885 0.26 0.00 H new ATOM 661 N GLY A 42 6.183 -7.225 -5.512 0.12 0.00 N ATOM 662 CA GLY A 42 7.100 -6.282 -6.125 0.21 0.00 C ATOM 663 C GLY A 42 7.132 -6.400 -7.640 0.24 0.00 C ATOM 664 O GLY A 42 7.014 -7.503 -8.175 0.09 0.00 O ATOM 0 H GLY A 42 6.602 -7.833 -4.808 0.12 0.00 H new ATOM 0 HA2 GLY A 42 6.811 -5.268 -5.849 0.21 0.00 H new ATOM 0 HA3 GLY A 42 8.103 -6.446 -5.730 0.21 0.00 H new ATOM 668 N PRO A 43 7.290 -5.277 -8.366 1.00 0.00 N ATOM 669 CA PRO A 43 7.336 -5.286 -9.834 0.05 0.00 C ATOM 670 C PRO A 43 8.594 -5.966 -10.364 0.38 0.00 C ATOM 671 O PRO A 43 9.383 -6.515 -9.596 0.34 0.00 O ATOM 672 CB PRO A 43 7.334 -3.800 -10.202 1.00 0.00 C ATOM 673 CG PRO A 43 7.893 -3.112 -9.005 1.00 0.00 C ATOM 674 CD PRO A 43 7.436 -3.914 -7.819 0.38 0.00 C ATOM 0 HA PRO A 43 6.505 -5.843 -10.266 0.05 0.00 H new ATOM 0 HB2 PRO A 43 7.941 -3.611 -11.087 1.00 0.00 H new ATOM 0 HB3 PRO A 43 6.327 -3.449 -10.426 1.00 0.00 H new ATOM 0 HG2 PRO A 43 8.981 -3.069 -9.052 1.00 0.00 H new ATOM 0 HG3 PRO A 43 7.536 -2.084 -8.943 1.00 0.00 H new ATOM 0 HD2 PRO A 43 8.163 -3.882 -7.008 0.38 0.00 H new ATOM 0 HD3 PRO A 43 6.494 -3.538 -7.418 0.38 0.00 H new ATOM 682 N GLU A 44 8.776 -5.925 -11.681 0.35 0.00 N ATOM 683 CA GLU A 44 9.939 -6.539 -12.309 1.00 0.00 C ATOM 684 C GLU A 44 11.119 -5.577 -12.347 1.00 0.00 C ATOM 685 O GLU A 44 10.951 -4.363 -12.216 0.48 0.00 O ATOM 686 CB GLU A 44 9.604 -7.004 -13.724 0.08 0.00 C ATOM 687 CG GLU A 44 8.974 -8.383 -13.774 0.06 0.00 C ATOM 688 CD GLU A 44 8.550 -8.783 -15.174 0.79 0.00 C ATOM 689 OE1 GLU A 44 7.411 -8.451 -15.567 1.00 0.00 O ATOM 690 OE2 GLU A 44 9.354 -9.430 -15.876 0.06 0.00 O ATOM 0 H GLU A 44 8.133 -5.474 -12.332 0.35 0.00 H new ATOM 0 HA GLU A 44 10.219 -7.404 -11.707 1.00 0.00 H new ATOM 0 HB2 GLU A 44 8.924 -6.286 -14.183 0.08 0.00 H new ATOM 0 HB3 GLU A 44 10.515 -7.008 -14.322 0.08 0.00 H new ATOM 0 HG2 GLU A 44 9.684 -9.116 -13.390 0.06 0.00 H new ATOM 0 HG3 GLU A 44 8.106 -8.405 -13.116 0.06 0.00 H new ATOM 697 N GLY A 45 12.312 -6.131 -12.530 0.14 0.00 N ATOM 698 CA GLY A 45 13.510 -5.319 -12.589 0.67 0.00 C ATOM 699 C GLY A 45 13.762 -4.558 -11.302 0.08 0.00 C ATOM 700 O GLY A 45 14.373 -3.490 -11.317 0.21 0.00 O ATOM 0 H GLY A 45 12.470 -7.133 -12.639 0.14 0.00 H new ATOM 0 HA2 GLY A 45 14.367 -5.957 -12.803 0.67 0.00 H new ATOM 0 HA3 GLY A 45 13.425 -4.612 -13.414 0.67 0.00 H new ATOM 704 N THR A 46 13.292 -5.110 -10.186 0.16 0.00 N ATOM 705 CA THR A 46 13.468 -4.473 -8.885 1.00 0.00 C ATOM 706 C THR A 46 13.923 -5.484 -7.836 0.47 0.00 C ATOM 707 O THR A 46 13.682 -6.682 -7.979 1.00 0.00 O ATOM 708 CB THR A 46 12.165 -3.806 -8.406 0.09 0.00 C ATOM 709 OG1 THR A 46 11.121 -4.783 -8.307 0.63 0.00 O ATOM 710 CG2 THR A 46 11.741 -2.700 -9.360 0.61 0.00 C ATOM 0 H THR A 46 12.787 -5.996 -10.157 0.16 0.00 H new ATOM 0 HA THR A 46 14.235 -3.709 -9.008 1.00 0.00 H new ATOM 0 HB THR A 46 12.347 -3.368 -7.424 0.09 0.00 H new ATOM 0 HG1 THR A 46 10.869 -5.084 -9.205 0.63 0.00 H new ATOM 0 HG21 THR A 46 10.818 -2.244 -9.001 0.61 0.00 H new ATOM 0 HG22 THR A 46 12.524 -1.944 -9.411 0.61 0.00 H new ATOM 0 HG23 THR A 46 11.576 -3.119 -10.353 0.61 0.00 H new ATOM 718 N PRO A 47 14.589 -5.017 -6.760 0.64 0.00 N ATOM 719 CA PRO A 47 15.067 -5.899 -5.689 1.00 0.00 C ATOM 720 C PRO A 47 13.917 -6.474 -4.865 1.00 0.00 C ATOM 721 O PRO A 47 14.137 -7.204 -3.898 0.24 0.00 O ATOM 722 CB PRO A 47 15.935 -4.976 -4.830 0.22 0.00 C ATOM 723 CG PRO A 47 15.386 -3.615 -5.070 0.73 0.00 C ATOM 724 CD PRO A 47 14.932 -3.604 -6.503 1.00 0.00 C ATOM 0 HA PRO A 47 15.603 -6.765 -6.077 1.00 0.00 H new ATOM 0 HB2 PRO A 47 15.878 -5.246 -3.776 0.22 0.00 H new ATOM 0 HB3 PRO A 47 16.984 -5.037 -5.118 0.22 0.00 H new ATOM 0 HG2 PRO A 47 14.557 -3.403 -4.395 0.73 0.00 H new ATOM 0 HG3 PRO A 47 16.143 -2.851 -4.894 0.73 0.00 H new ATOM 0 HD2 PRO A 47 14.073 -2.949 -6.648 1.00 0.00 H new ATOM 0 HD3 PRO A 47 15.718 -3.253 -7.172 1.00 0.00 H new ATOM 732 N PHE A 48 12.692 -6.134 -5.255 0.42 0.00 N ATOM 733 CA PHE A 48 11.504 -6.616 -4.558 1.00 0.00 C ATOM 734 C PHE A 48 10.759 -7.639 -5.409 1.00 0.00 C ATOM 735 O PHE A 48 9.782 -8.240 -4.961 0.05 0.00 O ATOM 736 CB PHE A 48 10.572 -5.449 -4.223 0.09 0.00 C ATOM 737 CG PHE A 48 11.283 -4.258 -3.648 0.52 0.00 C ATOM 738 CD1 PHE A 48 11.552 -4.183 -2.292 0.87 0.00 C ATOM 739 CD2 PHE A 48 11.682 -3.214 -4.467 0.07 0.00 C ATOM 740 CE1 PHE A 48 12.207 -3.088 -1.762 0.05 0.00 C ATOM 741 CE2 PHE A 48 12.337 -2.117 -3.942 0.40 0.00 C ATOM 742 CZ PHE A 48 12.599 -2.054 -2.587 1.00 0.00 C ATOM 0 H PHE A 48 12.496 -5.526 -6.050 0.42 0.00 H new ATOM 0 HA PHE A 48 11.825 -7.094 -3.633 1.00 0.00 H new ATOM 0 HB2 PHE A 48 10.044 -5.145 -5.127 0.09 0.00 H new ATOM 0 HB3 PHE A 48 9.818 -5.789 -3.513 0.09 0.00 H new ATOM 0 HD1 PHE A 48 11.247 -4.989 -1.641 0.87 0.00 H new ATOM 0 HD2 PHE A 48 11.479 -3.258 -5.527 0.07 0.00 H new ATOM 0 HE1 PHE A 48 12.412 -3.042 -0.703 0.05 0.00 H new ATOM 0 HE2 PHE A 48 12.644 -1.309 -4.590 0.40 0.00 H new ATOM 0 HZ PHE A 48 13.110 -1.197 -2.174 1.00 0.00 H new ATOM 752 N GLU A 49 11.227 -7.830 -6.639 0.11 0.00 N ATOM 753 CA GLU A 49 10.602 -8.773 -7.560 0.13 0.00 C ATOM 754 C GLU A 49 10.571 -10.183 -6.970 0.57 0.00 C ATOM 755 O GLU A 49 9.633 -10.942 -7.205 0.70 0.00 O ATOM 756 CB GLU A 49 11.338 -8.778 -8.906 0.39 0.00 C ATOM 757 CG GLU A 49 12.699 -9.458 -8.864 0.11 0.00 C ATOM 758 CD GLU A 49 13.324 -9.589 -10.240 0.11 0.00 C ATOM 759 OE1 GLU A 49 13.033 -10.587 -10.932 1.00 0.00 O ATOM 760 OE2 GLU A 49 14.105 -8.693 -10.624 1.00 0.00 O ATOM 0 H GLU A 49 12.038 -7.343 -7.021 0.11 0.00 H new ATOM 0 HA GLU A 49 9.574 -8.450 -7.722 0.13 0.00 H new ATOM 0 HB2 GLU A 49 10.715 -9.279 -9.647 0.39 0.00 H new ATOM 0 HB3 GLU A 49 11.467 -7.749 -9.242 0.39 0.00 H new ATOM 0 HG2 GLU A 49 13.367 -8.888 -8.218 0.11 0.00 H new ATOM 0 HG3 GLU A 49 12.594 -10.448 -8.420 0.11 0.00 H new ATOM 767 N ASP A 50 11.603 -10.525 -6.204 0.50 0.00 N ATOM 768 CA ASP A 50 11.686 -11.842 -5.582 0.55 0.00 C ATOM 769 C ASP A 50 10.921 -11.870 -4.263 0.06 0.00 C ATOM 770 O ASP A 50 10.157 -12.797 -3.997 0.06 0.00 O ATOM 771 CB ASP A 50 13.147 -12.230 -5.343 0.08 0.00 C ATOM 772 CG ASP A 50 13.285 -13.611 -4.730 0.12 0.00 C ATOM 773 OD1 ASP A 50 13.283 -13.708 -3.484 0.07 0.00 O ATOM 774 OD2 ASP A 50 13.392 -14.593 -5.493 0.31 0.00 O ATOM 0 H ASP A 50 12.391 -9.910 -6.000 0.50 0.00 H new ATOM 0 HA ASP A 50 11.233 -12.563 -6.262 0.55 0.00 H new ATOM 0 HB2 ASP A 50 13.688 -12.199 -6.289 0.08 0.00 H new ATOM 0 HB3 ASP A 50 13.613 -11.495 -4.686 0.08 0.00 H new ATOM 779 N GLY A 51 11.133 -10.847 -3.440 0.74 0.00 N ATOM 780 CA GLY A 51 10.458 -10.774 -2.157 0.17 0.00 C ATOM 781 C GLY A 51 8.990 -10.419 -2.288 1.00 0.00 C ATOM 782 O GLY A 51 8.549 -9.945 -3.334 1.00 0.00 O ATOM 0 H GLY A 51 11.760 -10.068 -3.639 0.74 0.00 H new ATOM 0 HA2 GLY A 51 10.552 -11.733 -1.647 0.17 0.00 H new ATOM 0 HA3 GLY A 51 10.953 -10.031 -1.532 0.17 0.00 H new ATOM 786 N THR A 52 8.231 -10.653 -1.221 0.48 0.00 N ATOM 787 CA THR A 52 6.802 -10.356 -1.215 0.18 0.00 C ATOM 788 C THR A 52 6.409 -9.579 0.037 0.56 0.00 C ATOM 789 O THR A 52 6.907 -9.851 1.130 0.17 0.00 O ATOM 790 CB THR A 52 5.960 -11.643 -1.291 1.00 0.00 C ATOM 791 OG1 THR A 52 6.295 -12.514 -0.205 0.65 0.00 O ATOM 792 CG2 THR A 52 6.187 -12.363 -2.613 0.06 0.00 C ATOM 0 H THR A 52 8.582 -11.048 -0.349 0.48 0.00 H new ATOM 0 HA THR A 52 6.601 -9.747 -2.097 0.18 0.00 H new ATOM 0 HB THR A 52 4.908 -11.365 -1.222 1.00 0.00 H new ATOM 0 HG1 THR A 52 5.754 -13.329 -0.260 0.65 0.00 H new ATOM 0 HG21 THR A 52 5.581 -13.269 -2.643 0.06 0.00 H new ATOM 0 HG22 THR A 52 5.902 -11.709 -3.437 0.06 0.00 H new ATOM 0 HG23 THR A 52 7.240 -12.627 -2.707 0.06 0.00 H new ATOM 800 N PHE A 53 5.515 -8.609 -0.131 1.00 0.00 N ATOM 801 CA PHE A 53 5.055 -7.790 0.987 1.00 0.00 C ATOM 802 C PHE A 53 3.537 -7.841 1.125 1.00 0.00 C ATOM 803 O PHE A 53 2.832 -8.258 0.206 0.06 0.00 O ATOM 804 CB PHE A 53 5.513 -6.343 0.804 1.00 0.00 C ATOM 805 CG PHE A 53 6.994 -6.159 0.966 0.51 0.00 C ATOM 806 CD1 PHE A 53 7.850 -6.369 -0.102 1.00 0.00 C ATOM 807 CD2 PHE A 53 7.529 -5.777 2.186 1.00 0.00 C ATOM 808 CE1 PHE A 53 9.214 -6.201 0.044 0.09 0.00 C ATOM 809 CE2 PHE A 53 8.891 -5.608 2.338 0.12 0.00 C ATOM 810 CZ PHE A 53 9.735 -5.821 1.265 0.25 0.00 C ATOM 0 H PHE A 53 5.095 -8.371 -1.029 1.00 0.00 H new ATOM 0 HA PHE A 53 5.492 -8.195 1.900 1.00 0.00 H new ATOM 0 HB2 PHE A 53 5.218 -6.000 -0.188 1.00 0.00 H new ATOM 0 HB3 PHE A 53 4.995 -5.712 1.527 1.00 0.00 H new ATOM 0 HD1 PHE A 53 7.448 -6.667 -1.059 1.00 0.00 H new ATOM 0 HD2 PHE A 53 6.873 -5.610 3.028 1.00 0.00 H new ATOM 0 HE1 PHE A 53 9.872 -6.367 -0.796 0.09 0.00 H new ATOM 0 HE2 PHE A 53 9.296 -5.310 3.294 0.12 0.00 H new ATOM 0 HZ PHE A 53 10.801 -5.690 1.381 0.25 0.00 H new ATOM 820 N LYS A 54 3.043 -7.415 2.284 0.08 0.00 N ATOM 821 CA LYS A 54 1.610 -7.402 2.553 0.13 0.00 C ATOM 822 C LYS A 54 1.217 -6.148 3.325 0.07 0.00 C ATOM 823 O LYS A 54 1.961 -5.681 4.188 1.00 0.00 O ATOM 824 CB LYS A 54 1.203 -8.647 3.345 0.06 0.00 C ATOM 825 CG LYS A 54 1.407 -9.948 2.585 0.07 0.00 C ATOM 826 CD LYS A 54 0.933 -11.150 3.391 0.33 0.00 C ATOM 827 CE LYS A 54 1.963 -11.579 4.426 1.00 0.00 C ATOM 828 NZ LYS A 54 2.164 -10.549 5.482 1.00 0.00 N ATOM 0 H LYS A 54 3.617 -7.073 3.054 0.08 0.00 H new ATOM 0 HA LYS A 54 1.087 -7.403 1.597 0.13 0.00 H new ATOM 0 HB2 LYS A 54 1.779 -8.683 4.270 0.06 0.00 H new ATOM 0 HB3 LYS A 54 0.153 -8.561 3.626 0.06 0.00 H new ATOM 0 HG2 LYS A 54 0.865 -9.907 1.640 0.07 0.00 H new ATOM 0 HG3 LYS A 54 2.463 -10.066 2.342 0.07 0.00 H new ATOM 0 HD2 LYS A 54 -0.004 -10.906 3.891 0.33 0.00 H new ATOM 0 HD3 LYS A 54 0.727 -11.981 2.717 0.33 0.00 H new ATOM 0 HE2 LYS A 54 1.643 -12.513 4.888 1.00 0.00 H new ATOM 0 HE3 LYS A 54 2.913 -11.778 3.930 1.00 0.00 H new ATOM 0 HZ1 LYS A 54 2.479 -11.009 6.360 1.00 0.00 H new ATOM 0 HZ2 LYS A 54 2.885 -9.868 5.170 1.00 0.00 H new ATOM 0 HZ3 LYS A 54 1.268 -10.050 5.655 1.00 0.00 H new ATOM 842 N LEU A 55 0.045 -5.606 3.010 1.00 0.00 N ATOM 843 CA LEU A 55 -0.443 -4.404 3.674 0.92 0.00 C ATOM 844 C LEU A 55 -1.933 -4.513 3.984 0.64 0.00 C ATOM 845 O LEU A 55 -2.636 -5.355 3.425 0.09 0.00 O ATOM 846 CB LEU A 55 -0.165 -3.151 2.825 1.00 0.00 C ATOM 847 CG LEU A 55 -0.259 -3.315 1.298 0.22 0.00 C ATOM 848 CD1 LEU A 55 0.933 -4.091 0.759 0.08 0.00 C ATOM 849 CD2 LEU A 55 -1.563 -3.990 0.898 0.15 0.00 C ATOM 0 H LEU A 55 -0.584 -5.980 2.299 1.00 0.00 H new ATOM 0 HA LEU A 55 0.097 -4.308 4.616 0.92 0.00 H new ATOM 0 HB2 LEU A 55 -0.866 -2.373 3.127 1.00 0.00 H new ATOM 0 HB3 LEU A 55 0.835 -2.791 3.067 1.00 0.00 H new ATOM 0 HG LEU A 55 -0.245 -2.318 0.857 0.22 0.00 H new ATOM 0 HD11 LEU A 55 0.842 -4.193 -0.322 0.08 0.00 H new ATOM 0 HD12 LEU A 55 1.853 -3.557 0.997 0.08 0.00 H new ATOM 0 HD13 LEU A 55 0.960 -5.080 1.216 0.08 0.00 H new ATOM 0 HD21 LEU A 55 -1.602 -4.093 -0.186 0.15 0.00 H new ATOM 0 HD22 LEU A 55 -1.618 -4.977 1.358 0.15 0.00 H new ATOM 0 HD23 LEU A 55 -2.404 -3.385 1.235 0.15 0.00 H new ATOM 861 N VAL A 56 -2.406 -3.656 4.884 0.17 0.00 N ATOM 862 CA VAL A 56 -3.810 -3.648 5.276 0.05 0.00 C ATOM 863 C VAL A 56 -4.474 -2.327 4.905 0.13 0.00 C ATOM 864 O VAL A 56 -3.841 -1.271 4.942 1.00 0.00 O ATOM 865 CB VAL A 56 -3.966 -3.888 6.792 1.00 0.00 C ATOM 866 CG1 VAL A 56 -3.204 -2.835 7.580 0.14 0.00 C ATOM 867 CG2 VAL A 56 -5.434 -3.904 7.192 0.07 0.00 C ATOM 0 H VAL A 56 -1.834 -2.956 5.357 0.17 0.00 H new ATOM 0 HA VAL A 56 -4.300 -4.458 4.736 0.05 0.00 H new ATOM 0 HB VAL A 56 -3.543 -4.865 7.027 1.00 0.00 H new ATOM 0 HG11 VAL A 56 -3.326 -3.020 8.647 0.14 0.00 H new ATOM 0 HG12 VAL A 56 -2.146 -2.882 7.322 0.14 0.00 H new ATOM 0 HG13 VAL A 56 -3.593 -1.846 7.337 0.14 0.00 H new ATOM 0 HG21 VAL A 56 -5.517 -4.075 8.265 0.07 0.00 H new ATOM 0 HG22 VAL A 56 -5.890 -2.946 6.941 0.07 0.00 H new ATOM 0 HG23 VAL A 56 -5.948 -4.702 6.657 0.07 0.00 H new ATOM 877 N ILE A 57 -5.753 -2.392 4.544 0.93 0.00 N ATOM 878 CA ILE A 57 -6.500 -1.200 4.165 1.00 0.00 C ATOM 879 C ILE A 57 -7.777 -1.065 4.989 0.47 0.00 C ATOM 880 O ILE A 57 -8.710 -1.856 4.840 1.00 0.00 O ATOM 881 CB ILE A 57 -6.868 -1.210 2.665 0.29 0.00 C ATOM 882 CG1 ILE A 57 -5.620 -1.404 1.800 1.00 0.00 C ATOM 883 CG2 ILE A 57 -7.579 0.082 2.286 0.23 0.00 C ATOM 884 CD1 ILE A 57 -5.208 -2.853 1.636 1.00 0.00 C ATOM 0 H ILE A 57 -6.292 -3.257 4.507 0.93 0.00 H new ATOM 0 HA ILE A 57 -5.849 -0.348 4.363 1.00 0.00 H new ATOM 0 HB ILE A 57 -7.542 -2.047 2.484 0.29 0.00 H new ATOM 0 HG12 ILE A 57 -5.802 -0.974 0.815 1.00 0.00 H new ATOM 0 HG13 ILE A 57 -4.793 -0.849 2.242 1.00 0.00 H new ATOM 0 HG21 ILE A 57 -7.832 0.061 1.226 0.23 0.00 H new ATOM 0 HG22 ILE A 57 -8.491 0.182 2.875 0.23 0.00 H new ATOM 0 HG23 ILE A 57 -6.924 0.930 2.485 0.23 0.00 H new ATOM 0 HD11 ILE A 57 -4.317 -2.909 1.011 1.00 0.00 H new ATOM 0 HD12 ILE A 57 -4.993 -3.283 2.614 1.00 0.00 H new ATOM 0 HD13 ILE A 57 -6.017 -3.410 1.165 1.00 0.00 H new ATOM 896 N GLU A 58 -7.811 -0.060 5.857 1.00 0.00 N ATOM 897 CA GLU A 58 -8.973 0.183 6.704 0.21 0.00 C ATOM 898 C GLU A 58 -9.854 1.281 6.112 1.00 0.00 C ATOM 899 O GLU A 58 -9.355 2.306 5.649 0.40 0.00 O ATOM 900 CB GLU A 58 -8.526 0.577 8.114 0.51 0.00 C ATOM 901 CG GLU A 58 -9.680 0.809 9.076 0.05 0.00 C ATOM 902 CD GLU A 58 -9.209 1.195 10.465 0.08 0.00 C ATOM 903 OE1 GLU A 58 -8.994 2.402 10.704 0.12 0.00 O ATOM 904 OE2 GLU A 58 -9.056 0.291 11.313 0.62 0.00 O ATOM 0 H GLU A 58 -7.046 0.601 5.993 1.00 0.00 H new ATOM 0 HA GLU A 58 -9.555 -0.737 6.758 0.21 0.00 H new ATOM 0 HB2 GLU A 58 -7.882 -0.206 8.514 0.51 0.00 H new ATOM 0 HB3 GLU A 58 -7.925 1.484 8.055 0.51 0.00 H new ATOM 0 HG2 GLU A 58 -10.324 1.595 8.683 0.05 0.00 H new ATOM 0 HG3 GLU A 58 -10.284 -0.096 9.139 0.05 0.00 H new ATOM 911 N PHE A 59 -11.163 1.058 6.132 0.48 0.00 N ATOM 912 CA PHE A 59 -12.112 2.028 5.595 0.37 0.00 C ATOM 913 C PHE A 59 -12.963 2.631 6.708 0.07 0.00 C ATOM 914 O PHE A 59 -13.346 1.941 7.654 0.69 0.00 O ATOM 915 CB PHE A 59 -13.014 1.367 4.552 1.00 0.00 C ATOM 916 CG PHE A 59 -12.258 0.720 3.426 0.06 0.00 C ATOM 917 CD1 PHE A 59 -11.906 1.447 2.301 0.76 0.00 C ATOM 918 CD2 PHE A 59 -11.902 -0.617 3.494 0.79 0.00 C ATOM 919 CE1 PHE A 59 -11.213 0.853 1.264 0.72 0.00 C ATOM 920 CE2 PHE A 59 -11.209 -1.218 2.459 0.34 0.00 C ATOM 921 CZ PHE A 59 -10.863 -0.481 1.344 1.00 0.00 C ATOM 0 H PHE A 59 -11.592 0.215 6.514 0.48 0.00 H new ATOM 0 HA PHE A 59 -11.544 2.829 5.121 0.37 0.00 H new ATOM 0 HB2 PHE A 59 -13.632 0.615 5.043 1.00 0.00 H new ATOM 0 HB3 PHE A 59 -13.690 2.117 4.141 1.00 0.00 H new ATOM 0 HD1 PHE A 59 -12.176 2.490 2.234 0.76 0.00 H new ATOM 0 HD2 PHE A 59 -12.169 -1.197 4.365 0.79 0.00 H new ATOM 0 HE1 PHE A 59 -10.945 1.431 0.392 0.72 0.00 H new ATOM 0 HE2 PHE A 59 -10.939 -2.262 2.523 0.34 0.00 H new ATOM 0 HZ PHE A 59 -10.319 -0.947 0.535 1.00 0.00 H new ATOM 931 N SER A 60 -13.254 3.924 6.590 0.31 0.00 N ATOM 932 CA SER A 60 -14.064 4.622 7.582 1.00 0.00 C ATOM 933 C SER A 60 -15.473 4.870 7.052 0.06 0.00 C ATOM 934 O SER A 60 -15.679 4.989 5.844 1.00 0.00 O ATOM 935 CB SER A 60 -13.408 5.949 7.966 1.00 0.00 C ATOM 936 OG SER A 60 -12.125 5.741 8.529 0.37 0.00 O ATOM 0 H SER A 60 -12.940 4.509 5.816 0.31 0.00 H new ATOM 0 HA SER A 60 -14.133 3.992 8.469 1.00 0.00 H new ATOM 0 HB2 SER A 60 -13.323 6.584 7.084 1.00 0.00 H new ATOM 0 HB3 SER A 60 -14.040 6.477 8.680 1.00 0.00 H new ATOM 0 HG SER A 60 -11.727 6.605 8.764 0.37 0.00 H new ATOM 942 N GLU A 61 -16.438 4.951 7.962 0.22 0.00 N ATOM 943 CA GLU A 61 -17.827 5.186 7.584 0.64 0.00 C ATOM 944 C GLU A 61 -18.091 6.674 7.383 0.81 0.00 C ATOM 945 O GLU A 61 -19.230 7.088 7.166 0.10 0.00 O ATOM 946 CB GLU A 61 -18.771 4.625 8.650 1.00 0.00 C ATOM 947 CG GLU A 61 -18.598 5.267 10.018 0.76 0.00 C ATOM 948 CD GLU A 61 -19.527 4.676 11.062 0.28 0.00 C ATOM 949 OE1 GLU A 61 -20.666 5.172 11.193 0.17 0.00 O ATOM 950 OE2 GLU A 61 -19.115 3.717 11.747 0.20 0.00 O ATOM 0 H GLU A 61 -16.284 4.857 8.966 0.22 0.00 H new ATOM 0 HA GLU A 61 -18.013 4.673 6.641 0.64 0.00 H new ATOM 0 HB2 GLU A 61 -19.801 4.764 8.321 1.00 0.00 H new ATOM 0 HB3 GLU A 61 -18.607 3.551 8.739 1.00 0.00 H new ATOM 0 HG2 GLU A 61 -17.565 5.144 10.345 0.76 0.00 H new ATOM 0 HG3 GLU A 61 -18.782 6.338 9.938 0.76 0.00 H new ATOM 957 N GLU A 62 -17.029 7.472 7.454 0.82 0.00 N ATOM 958 CA GLU A 62 -17.144 8.916 7.279 0.89 0.00 C ATOM 959 C GLU A 62 -17.669 9.259 5.888 1.00 0.00 C ATOM 960 O GLU A 62 -18.860 9.515 5.711 0.76 0.00 O ATOM 961 CB GLU A 62 -15.792 9.590 7.517 0.49 0.00 C ATOM 962 CG GLU A 62 -15.348 9.564 8.971 1.00 0.00 C ATOM 963 CD GLU A 62 -14.032 10.282 9.194 0.07 0.00 C ATOM 964 OE1 GLU A 62 -14.030 11.530 9.207 1.00 0.00 O ATOM 965 OE2 GLU A 62 -13.002 9.594 9.356 1.00 0.00 O ATOM 0 H GLU A 62 -16.080 7.143 7.631 0.82 0.00 H new ATOM 0 HA GLU A 62 -17.858 9.290 8.013 0.89 0.00 H new ATOM 0 HB2 GLU A 62 -15.036 9.096 6.906 0.49 0.00 H new ATOM 0 HB3 GLU A 62 -15.847 10.625 7.181 0.49 0.00 H new ATOM 0 HG2 GLU A 62 -16.118 10.025 9.590 1.00 0.00 H new ATOM 0 HG3 GLU A 62 -15.253 8.529 9.299 1.00 0.00 H new ATOM 972 N TYR A 63 -16.776 9.261 4.903 0.07 0.00 N ATOM 973 CA TYR A 63 -17.154 9.574 3.529 1.00 0.00 C ATOM 974 C TYR A 63 -16.341 8.743 2.537 1.00 0.00 C ATOM 975 O TYR A 63 -15.191 8.399 2.807 0.30 0.00 O ATOM 976 CB TYR A 63 -16.949 11.064 3.244 0.21 0.00 C ATOM 977 CG TYR A 63 -17.843 11.970 4.060 0.15 0.00 C ATOM 978 CD1 TYR A 63 -19.148 12.231 3.661 0.23 0.00 C ATOM 979 CD2 TYR A 63 -17.383 12.564 5.228 1.00 0.00 C ATOM 980 CE1 TYR A 63 -19.969 13.059 4.403 0.86 0.00 C ATOM 981 CE2 TYR A 63 -18.197 13.391 5.977 0.20 0.00 C ATOM 982 CZ TYR A 63 -19.490 13.636 5.559 0.44 0.00 C ATOM 983 OH TYR A 63 -20.303 14.459 6.302 1.00 0.00 O ATOM 0 H TYR A 63 -15.786 9.050 5.031 0.07 0.00 H new ATOM 0 HA TYR A 63 -18.209 9.329 3.408 1.00 0.00 H new ATOM 0 HB2 TYR A 63 -15.909 11.322 3.441 0.21 0.00 H new ATOM 0 HB3 TYR A 63 -17.128 11.250 2.185 0.21 0.00 H new ATOM 0 HD1 TYR A 63 -19.527 11.779 2.756 0.23 0.00 H new ATOM 0 HD2 TYR A 63 -16.371 12.376 5.556 1.00 0.00 H new ATOM 0 HE1 TYR A 63 -20.981 13.253 4.078 0.86 0.00 H new ATOM 0 HE2 TYR A 63 -17.824 13.843 6.884 0.20 0.00 H new ATOM 0 HH TYR A 63 -19.812 14.782 7.086 1.00 0.00 H new ATOM 993 N PRO A 64 -16.930 8.408 1.374 1.00 0.00 N ATOM 994 CA PRO A 64 -16.246 7.618 0.345 0.24 0.00 C ATOM 995 C PRO A 64 -15.004 8.326 -0.189 0.32 0.00 C ATOM 996 O PRO A 64 -14.073 7.687 -0.680 0.38 0.00 O ATOM 997 CB PRO A 64 -17.293 7.471 -0.767 1.00 0.00 C ATOM 998 CG PRO A 64 -18.600 7.768 -0.114 0.07 0.00 C ATOM 999 CD PRO A 64 -18.302 8.763 0.967 0.40 0.00 C ATOM 0 HA PRO A 64 -15.894 6.664 0.737 0.24 0.00 H new ATOM 0 HB2 PRO A 64 -17.096 8.162 -1.587 1.00 0.00 H new ATOM 0 HB3 PRO A 64 -17.282 6.466 -1.188 1.00 0.00 H new ATOM 0 HG2 PRO A 64 -19.312 8.173 -0.832 0.07 0.00 H new ATOM 0 HG3 PRO A 64 -19.045 6.863 0.300 0.07 0.00 H new ATOM 0 HD2 PRO A 64 -18.362 9.788 0.600 0.40 0.00 H new ATOM 0 HD3 PRO A 64 -19.004 8.680 1.797 0.40 0.00 H new ATOM 1007 N ASN A 65 -14.998 9.653 -0.088 0.74 0.00 N ATOM 1008 CA ASN A 65 -13.874 10.453 -0.561 0.53 0.00 C ATOM 1009 C ASN A 65 -12.860 10.684 0.554 0.55 0.00 C ATOM 1010 O ASN A 65 -11.709 11.035 0.294 0.66 0.00 O ATOM 1011 CB ASN A 65 -14.369 11.796 -1.101 0.09 0.00 C ATOM 1012 CG ASN A 65 -14.963 12.668 -0.014 0.19 0.00 C ATOM 1013 OD1 ASN A 65 -16.165 12.623 0.248 0.14 0.00 O ATOM 1014 ND2 ASN A 65 -14.119 13.470 0.627 0.18 0.00 N ATOM 0 H ASN A 65 -15.760 10.196 0.318 0.74 0.00 H new ATOM 0 HA ASN A 65 -13.383 9.903 -1.364 0.53 0.00 H new ATOM 0 HB2 ASN A 65 -13.540 12.323 -1.574 0.09 0.00 H new ATOM 0 HB3 ASN A 65 -15.118 11.621 -1.873 0.09 0.00 H new ATOM 0 HD21 ASN A 65 -14.460 14.081 1.369 0.18 0.00 H new ATOM 0 HD22 ASN A 65 -13.130 13.475 0.377 0.18 0.00 H new ATOM 1021 N LYS A 66 -13.299 10.495 1.798 0.40 0.00 N ATOM 1022 CA LYS A 66 -12.432 10.679 2.955 1.00 0.00 C ATOM 1023 C LYS A 66 -11.143 9.876 2.787 0.12 0.00 C ATOM 1024 O LYS A 66 -11.189 8.696 2.436 0.46 0.00 O ATOM 1025 CB LYS A 66 -13.162 10.247 4.232 0.37 0.00 C ATOM 1026 CG LYS A 66 -12.519 10.749 5.518 0.07 0.00 C ATOM 1027 CD LYS A 66 -11.340 9.885 5.938 1.00 0.00 C ATOM 1028 CE LYS A 66 -10.681 10.420 7.200 1.00 0.00 C ATOM 1029 NZ LYS A 66 -9.492 9.613 7.593 0.11 0.00 N ATOM 0 H LYS A 66 -14.252 10.214 2.028 0.40 0.00 H new ATOM 0 HA LYS A 66 -12.175 11.735 3.035 1.00 0.00 H new ATOM 0 HB2 LYS A 66 -14.190 10.606 4.189 0.37 0.00 H new ATOM 0 HB3 LYS A 66 -13.206 9.158 4.262 0.37 0.00 H new ATOM 0 HG2 LYS A 66 -12.184 11.777 5.379 0.07 0.00 H new ATOM 0 HG3 LYS A 66 -13.262 10.761 6.315 0.07 0.00 H new ATOM 0 HD2 LYS A 66 -11.678 8.863 6.108 1.00 0.00 H new ATOM 0 HD3 LYS A 66 -10.608 9.849 5.131 1.00 0.00 H new ATOM 0 HE2 LYS A 66 -10.380 11.455 7.041 1.00 0.00 H new ATOM 0 HE3 LYS A 66 -11.405 10.420 8.015 1.00 0.00 H new ATOM 0 HZ1 LYS A 66 -8.776 10.235 8.021 0.11 0.00 H new ATOM 0 HZ2 LYS A 66 -9.777 8.888 8.282 0.11 0.00 H new ATOM 0 HZ3 LYS A 66 -9.092 9.152 6.751 0.11 0.00 H new ATOM 1043 N PRO A 67 -9.971 10.500 3.032 0.34 0.00 N ATOM 1044 CA PRO A 67 -8.679 9.822 2.902 1.00 0.00 C ATOM 1045 C PRO A 67 -8.644 8.507 3.681 0.42 0.00 C ATOM 1046 O PRO A 67 -8.664 8.512 4.912 0.22 0.00 O ATOM 1047 CB PRO A 67 -7.670 10.822 3.493 0.74 0.00 C ATOM 1048 CG PRO A 67 -8.490 11.871 4.172 1.00 0.00 C ATOM 1049 CD PRO A 67 -9.807 11.898 3.454 0.11 0.00 C ATOM 0 HA PRO A 67 -8.465 9.556 1.867 1.00 0.00 H new ATOM 0 HB2 PRO A 67 -7.000 10.331 4.199 0.74 0.00 H new ATOM 0 HB3 PRO A 67 -7.047 11.257 2.712 0.74 0.00 H new ATOM 0 HG2 PRO A 67 -8.626 11.637 5.228 1.00 0.00 H new ATOM 0 HG3 PRO A 67 -7.999 12.843 4.122 1.00 0.00 H new ATOM 0 HD2 PRO A 67 -10.618 12.222 4.106 0.11 0.00 H new ATOM 0 HD3 PRO A 67 -9.791 12.579 2.603 0.11 0.00 H new ATOM 1057 N PRO A 68 -8.602 7.359 2.973 1.00 0.00 N ATOM 1058 CA PRO A 68 -8.573 6.039 3.614 0.25 0.00 C ATOM 1059 C PRO A 68 -7.354 5.849 4.513 0.99 0.00 C ATOM 1060 O PRO A 68 -6.625 6.797 4.804 1.00 0.00 O ATOM 1061 CB PRO A 68 -8.520 5.059 2.435 1.00 0.00 C ATOM 1062 CG PRO A 68 -9.012 5.835 1.263 0.45 0.00 C ATOM 1063 CD PRO A 68 -8.584 7.253 1.503 1.00 0.00 C ATOM 0 HA PRO A 68 -9.434 5.895 4.267 0.25 0.00 H new ATOM 0 HB2 PRO A 68 -7.506 4.696 2.270 1.00 0.00 H new ATOM 0 HB3 PRO A 68 -9.145 4.185 2.620 1.00 0.00 H new ATOM 0 HG2 PRO A 68 -8.590 5.451 0.334 0.45 0.00 H new ATOM 0 HG3 PRO A 68 -10.096 5.763 1.174 0.45 0.00 H new ATOM 0 HD2 PRO A 68 -7.592 7.450 1.096 1.00 0.00 H new ATOM 0 HD3 PRO A 68 -9.266 7.965 1.038 1.00 0.00 H new ATOM 1071 N THR A 69 -7.142 4.610 4.945 1.00 0.00 N ATOM 1072 CA THR A 69 -6.022 4.279 5.811 0.11 0.00 C ATOM 1073 C THR A 69 -5.281 3.062 5.274 0.59 0.00 C ATOM 1074 O THR A 69 -5.851 1.976 5.163 0.07 0.00 O ATOM 1075 CB THR A 69 -6.488 3.993 7.252 0.94 0.00 C ATOM 1076 OG1 THR A 69 -7.260 5.096 7.744 1.00 0.00 O ATOM 1077 CG2 THR A 69 -5.299 3.754 8.170 0.16 0.00 C ATOM 0 H THR A 69 -7.736 3.816 4.706 1.00 0.00 H new ATOM 0 HA THR A 69 -5.355 5.141 5.826 0.11 0.00 H new ATOM 0 HB THR A 69 -7.103 3.093 7.239 0.94 0.00 H new ATOM 0 HG1 THR A 69 -7.554 4.907 8.659 1.00 0.00 H new ATOM 0 HG21 THR A 69 -5.654 3.554 9.181 0.16 0.00 H new ATOM 0 HG22 THR A 69 -4.728 2.898 7.810 0.16 0.00 H new ATOM 0 HG23 THR A 69 -4.662 4.638 8.177 0.16 0.00 H new ATOM 1085 N VAL A 70 -4.011 3.247 4.938 0.40 0.00 N ATOM 1086 CA VAL A 70 -3.202 2.165 4.397 1.00 0.00 C ATOM 1087 C VAL A 70 -1.828 2.120 5.057 1.00 0.00 C ATOM 1088 O VAL A 70 -1.200 3.156 5.280 0.96 0.00 O ATOM 1089 CB VAL A 70 -3.036 2.313 2.874 0.06 0.00 C ATOM 1090 CG1 VAL A 70 -2.129 1.225 2.317 1.00 0.00 C ATOM 1091 CG2 VAL A 70 -4.389 2.287 2.184 0.45 0.00 C ATOM 0 H VAL A 70 -3.520 4.136 5.031 0.40 0.00 H new ATOM 0 HA VAL A 70 -3.724 1.232 4.610 1.00 0.00 H new ATOM 0 HB VAL A 70 -2.567 3.277 2.677 0.06 0.00 H new ATOM 0 HG11 VAL A 70 -2.028 1.352 1.239 1.00 0.00 H new ATOM 0 HG12 VAL A 70 -1.147 1.296 2.784 1.00 0.00 H new ATOM 0 HG13 VAL A 70 -2.562 0.247 2.528 1.00 0.00 H new ATOM 0 HG21 VAL A 70 -4.251 2.393 1.108 0.45 0.00 H new ATOM 0 HG22 VAL A 70 -4.887 1.340 2.394 0.45 0.00 H new ATOM 0 HG23 VAL A 70 -5.002 3.109 2.554 0.45 0.00 H new ATOM 1101 N ARG A 71 -1.366 0.910 5.361 0.37 0.00 N ATOM 1102 CA ARG A 71 -0.066 0.723 5.996 0.50 0.00 C ATOM 1103 C ARG A 71 0.375 -0.736 5.912 1.00 0.00 C ATOM 1104 O ARG A 71 -0.448 -1.647 5.984 0.30 0.00 O ATOM 1105 CB ARG A 71 -0.119 1.164 7.459 0.47 0.00 C ATOM 1106 CG ARG A 71 -1.172 0.433 8.276 0.88 0.00 C ATOM 1107 CD ARG A 71 -1.186 0.906 9.720 0.59 0.00 C ATOM 1108 NE ARG A 71 0.084 0.646 10.394 0.27 0.00 N ATOM 1109 CZ ARG A 71 0.356 1.039 11.634 0.09 0.00 C ATOM 1110 NH1 ARG A 71 -0.548 1.708 12.336 0.96 0.00 N ATOM 1111 NH2 ARG A 71 1.536 0.764 12.174 0.38 0.00 N ATOM 0 H ARG A 71 -1.873 0.044 5.177 0.37 0.00 H new ATOM 0 HA ARG A 71 0.660 1.338 5.464 0.50 0.00 H new ATOM 0 HB2 ARG A 71 0.858 1.003 7.914 0.47 0.00 H new ATOM 0 HB3 ARG A 71 -0.318 2.235 7.500 0.47 0.00 H new ATOM 0 HG2 ARG A 71 -2.154 0.592 7.831 0.88 0.00 H new ATOM 0 HG3 ARG A 71 -0.978 -0.639 8.245 0.88 0.00 H new ATOM 0 HD2 ARG A 71 -1.400 1.974 9.749 0.59 0.00 H new ATOM 0 HD3 ARG A 71 -1.991 0.405 10.258 0.59 0.00 H new ATOM 0 HE ARG A 71 0.803 0.133 9.883 0.27 0.00 H new ATOM 0 HH11 ARG A 71 -1.456 1.923 11.925 0.96 0.00 H new ATOM 0 HH12 ARG A 71 -0.335 2.008 13.287 0.96 0.00 H new ATOM 0 HH21 ARG A 71 2.235 0.251 11.637 0.38 0.00 H new ATOM 0 HH22 ARG A 71 1.744 1.066 13.126 0.38 0.00 H new ATOM 1125 N PHE A 72 1.679 -0.950 5.759 0.31 0.00 N ATOM 1126 CA PHE A 72 2.228 -2.299 5.670 0.47 0.00 C ATOM 1127 C PHE A 72 2.178 -2.998 7.026 0.23 0.00 C ATOM 1128 O PHE A 72 2.577 -2.431 8.042 1.00 0.00 O ATOM 1129 CB PHE A 72 3.670 -2.259 5.163 0.47 0.00 C ATOM 1130 CG PHE A 72 3.784 -2.069 3.675 0.24 0.00 C ATOM 1131 CD1 PHE A 72 3.484 -0.850 3.091 0.21 0.00 C ATOM 1132 CD2 PHE A 72 4.194 -3.114 2.864 1.00 0.00 C ATOM 1133 CE1 PHE A 72 3.591 -0.676 1.725 0.21 0.00 C ATOM 1134 CE2 PHE A 72 4.303 -2.947 1.497 1.00 0.00 C ATOM 1135 CZ PHE A 72 4.000 -1.727 0.926 0.36 0.00 C ATOM 0 H PHE A 72 2.374 -0.207 5.694 0.31 0.00 H new ATOM 0 HA PHE A 72 1.618 -2.862 4.964 0.47 0.00 H new ATOM 0 HB2 PHE A 72 4.200 -1.449 5.665 0.47 0.00 H new ATOM 0 HB3 PHE A 72 4.169 -3.187 5.441 0.47 0.00 H new ATOM 0 HD1 PHE A 72 3.163 -0.026 3.711 0.21 0.00 H new ATOM 0 HD2 PHE A 72 4.431 -4.071 3.305 1.00 0.00 H new ATOM 0 HE1 PHE A 72 3.355 0.280 1.282 0.21 0.00 H new ATOM 0 HE2 PHE A 72 4.625 -3.770 0.876 1.00 0.00 H new ATOM 0 HZ PHE A 72 4.082 -1.594 -0.143 0.36 0.00 H new ATOM 1145 N LEU A 73 1.689 -4.234 7.030 0.18 0.00 N ATOM 1146 CA LEU A 73 1.589 -5.015 8.258 0.71 0.00 C ATOM 1147 C LEU A 73 2.965 -5.492 8.715 0.71 0.00 C ATOM 1148 O LEU A 73 3.261 -5.511 9.910 0.81 0.00 O ATOM 1149 CB LEU A 73 0.668 -6.219 8.049 0.24 0.00 C ATOM 1150 CG LEU A 73 -0.822 -5.889 7.923 0.05 0.00 C ATOM 1151 CD1 LEU A 73 -1.606 -7.129 7.524 0.12 0.00 C ATOM 1152 CD2 LEU A 73 -1.354 -5.319 9.231 1.00 0.00 C ATOM 0 H LEU A 73 1.355 -4.717 6.196 0.18 0.00 H new ATOM 0 HA LEU A 73 1.169 -4.372 9.032 0.71 0.00 H new ATOM 0 HB2 LEU A 73 0.984 -6.745 7.148 0.24 0.00 H new ATOM 0 HB3 LEU A 73 0.802 -6.907 8.884 0.24 0.00 H new ATOM 0 HG LEU A 73 -0.946 -5.136 7.145 0.05 0.00 H new ATOM 0 HD11 LEU A 73 -2.663 -6.879 7.438 0.12 0.00 H new ATOM 0 HD12 LEU A 73 -1.241 -7.497 6.565 0.12 0.00 H new ATOM 0 HD13 LEU A 73 -1.476 -7.901 8.282 0.12 0.00 H new ATOM 0 HD21 LEU A 73 -2.414 -5.090 9.124 1.00 0.00 H new ATOM 0 HD22 LEU A 73 -1.220 -6.050 10.028 1.00 0.00 H new ATOM 0 HD23 LEU A 73 -0.809 -4.408 9.479 1.00 0.00 H new ATOM 1164 N SER A 74 3.802 -5.877 7.756 0.13 0.00 N ATOM 1165 CA SER A 74 5.146 -6.356 8.059 1.00 0.00 C ATOM 1166 C SER A 74 6.139 -5.199 8.104 0.10 0.00 C ATOM 1167 O SER A 74 5.815 -4.075 7.718 0.34 0.00 O ATOM 1168 CB SER A 74 5.588 -7.386 7.019 1.00 0.00 C ATOM 1169 OG SER A 74 4.743 -8.523 7.036 0.30 0.00 O ATOM 0 H SER A 74 3.573 -5.866 6.762 0.13 0.00 H new ATOM 0 HA SER A 74 5.125 -6.829 9.041 1.00 0.00 H new ATOM 0 HB2 SER A 74 5.575 -6.934 6.027 1.00 0.00 H new ATOM 0 HB3 SER A 74 6.616 -7.690 7.218 1.00 0.00 H new ATOM 0 HG SER A 74 5.046 -9.166 6.361 0.30 0.00 H new ATOM 1175 N LYS A 75 7.350 -5.482 8.579 1.00 0.00 N ATOM 1176 CA LYS A 75 8.391 -4.465 8.676 0.55 0.00 C ATOM 1177 C LYS A 75 8.898 -4.071 7.293 0.09 0.00 C ATOM 1178 O LYS A 75 9.312 -4.924 6.507 0.44 0.00 O ATOM 1179 CB LYS A 75 9.549 -4.975 9.539 0.24 0.00 C ATOM 1180 CG LYS A 75 10.714 -4.000 9.651 0.12 0.00 C ATOM 1181 CD LYS A 75 10.298 -2.676 10.281 0.29 0.00 C ATOM 1182 CE LYS A 75 10.011 -2.824 11.769 0.07 0.00 C ATOM 1183 NZ LYS A 75 8.668 -3.412 12.026 0.37 0.00 N ATOM 0 H LYS A 75 7.633 -6.407 8.902 1.00 0.00 H new ATOM 0 HA LYS A 75 7.961 -3.580 9.146 0.55 0.00 H new ATOM 0 HB2 LYS A 75 9.174 -5.194 10.539 0.24 0.00 H new ATOM 0 HB3 LYS A 75 9.913 -5.914 9.122 0.24 0.00 H new ATOM 0 HG2 LYS A 75 11.507 -4.451 10.248 0.12 0.00 H new ATOM 0 HG3 LYS A 75 11.127 -3.815 8.659 0.12 0.00 H new ATOM 0 HD2 LYS A 75 11.088 -1.940 10.135 0.29 0.00 H new ATOM 0 HD3 LYS A 75 9.410 -2.296 9.776 0.29 0.00 H new ATOM 0 HE2 LYS A 75 10.775 -3.454 12.224 0.07 0.00 H new ATOM 0 HE3 LYS A 75 10.076 -1.848 12.249 0.07 0.00 H new ATOM 0 HZ1 LYS A 75 8.172 -2.844 12.742 0.37 0.00 H new ATOM 0 HZ2 LYS A 75 8.116 -3.416 11.144 0.37 0.00 H new ATOM 0 HZ3 LYS A 75 8.776 -4.387 12.371 0.37 0.00 H new ATOM 1197 N MET A 76 8.863 -2.775 7.003 1.00 0.00 N ATOM 1198 CA MET A 76 9.318 -2.266 5.712 0.07 0.00 C ATOM 1199 C MET A 76 10.178 -1.019 5.886 1.00 0.00 C ATOM 1200 O MET A 76 10.172 -0.389 6.945 0.53 0.00 O ATOM 1201 CB MET A 76 8.118 -1.959 4.812 0.36 0.00 C ATOM 1202 CG MET A 76 7.046 -1.112 5.482 0.05 0.00 C ATOM 1203 SD MET A 76 7.527 0.618 5.660 0.29 0.00 S ATOM 1204 CE MET A 76 6.122 1.273 6.558 0.12 0.00 C ATOM 0 H MET A 76 8.525 -2.057 7.644 1.00 0.00 H new ATOM 0 HA MET A 76 9.929 -3.036 5.240 0.07 0.00 H new ATOM 0 HB2 MET A 76 8.469 -1.443 3.918 0.36 0.00 H new ATOM 0 HB3 MET A 76 7.673 -2.898 4.484 0.36 0.00 H new ATOM 0 HG2 MET A 76 6.127 -1.170 4.899 0.05 0.00 H new ATOM 0 HG3 MET A 76 6.826 -1.526 6.466 0.05 0.00 H new ATOM 0 HE1 MET A 76 6.272 2.337 6.743 0.12 0.00 H new ATOM 0 HE2 MET A 76 5.216 1.132 5.969 0.12 0.00 H new ATOM 0 HE3 MET A 76 6.022 0.750 7.509 0.12 0.00 H new ATOM 1214 N PHE A 77 10.915 -0.666 4.838 0.30 0.00 N ATOM 1215 CA PHE A 77 11.780 0.507 4.868 1.00 0.00 C ATOM 1216 C PHE A 77 11.780 1.209 3.515 0.55 0.00 C ATOM 1217 O PHE A 77 12.310 0.685 2.535 0.67 0.00 O ATOM 1218 CB PHE A 77 13.207 0.104 5.251 1.00 0.00 C ATOM 1219 CG PHE A 77 14.135 1.270 5.437 1.00 0.00 C ATOM 1220 CD1 PHE A 77 14.212 1.921 6.657 0.36 0.00 C ATOM 1221 CD2 PHE A 77 14.929 1.713 4.392 0.55 0.00 C ATOM 1222 CE1 PHE A 77 15.066 2.994 6.832 1.00 0.00 C ATOM 1223 CE2 PHE A 77 15.785 2.784 4.561 0.12 0.00 C ATOM 1224 CZ PHE A 77 15.855 3.425 5.782 0.85 0.00 C ATOM 0 H PHE A 77 10.930 -1.177 3.955 0.30 0.00 H new ATOM 0 HA PHE A 77 11.395 1.198 5.617 1.00 0.00 H new ATOM 0 HB2 PHE A 77 13.176 -0.475 6.174 1.00 0.00 H new ATOM 0 HB3 PHE A 77 13.610 -0.550 4.478 1.00 0.00 H new ATOM 0 HD1 PHE A 77 13.598 1.587 7.480 0.36 0.00 H new ATOM 0 HD2 PHE A 77 14.878 1.216 3.435 0.55 0.00 H new ATOM 0 HE1 PHE A 77 15.117 3.495 7.788 1.00 0.00 H new ATOM 0 HE2 PHE A 77 16.399 3.120 3.739 0.12 0.00 H new ATOM 0 HZ PHE A 77 16.525 4.261 5.916 0.85 0.00 H new ATOM 1234 N HIS A 78 11.184 2.395 3.466 0.28 0.00 N ATOM 1235 CA HIS A 78 11.117 3.164 2.228 0.05 0.00 C ATOM 1236 C HIS A 78 11.635 4.584 2.438 0.06 0.00 C ATOM 1237 O HIS A 78 11.622 5.092 3.559 1.00 0.00 O ATOM 1238 CB HIS A 78 9.679 3.199 1.704 0.13 0.00 C ATOM 1239 CG HIS A 78 9.131 1.841 1.392 0.17 0.00 C ATOM 1240 ND1 HIS A 78 8.162 1.213 2.142 1.00 0.00 N ATOM 1241 CD2 HIS A 78 9.438 0.986 0.383 0.71 0.00 C ATOM 1242 CE1 HIS A 78 7.916 0.022 1.580 0.30 0.00 C ATOM 1243 NE2 HIS A 78 8.665 -0.164 0.509 0.65 0.00 N ATOM 0 H HIS A 78 10.741 2.845 4.267 0.28 0.00 H new ATOM 0 HA HIS A 78 11.752 2.675 1.489 0.05 0.00 H new ATOM 0 HB2 HIS A 78 9.041 3.680 2.445 0.13 0.00 H new ATOM 0 HB3 HIS A 78 9.642 3.814 0.805 0.13 0.00 H new ATOM 0 HD2 HIS A 78 10.166 1.169 -0.393 0.71 0.00 H new ATOM 0 HE1 HIS A 78 7.198 -0.693 1.954 0.30 0.00 H new ATOM 0 HE2 HIS A 78 8.675 -0.982 -0.100 0.65 0.00 H new ATOM 1251 N PRO A 79 12.102 5.244 1.359 0.05 0.00 N ATOM 1252 CA PRO A 79 12.624 6.611 1.442 0.09 0.00 C ATOM 1253 C PRO A 79 11.595 7.586 1.998 0.06 0.00 C ATOM 1254 O PRO A 79 11.949 8.615 2.574 1.00 0.00 O ATOM 1255 CB PRO A 79 12.966 6.966 -0.009 1.00 0.00 C ATOM 1256 CG PRO A 79 13.106 5.655 -0.704 0.31 0.00 C ATOM 1257 CD PRO A 79 12.156 4.718 -0.016 1.00 0.00 C ATOM 0 HA PRO A 79 13.478 6.675 2.116 0.09 0.00 H new ATOM 0 HB2 PRO A 79 12.181 7.571 -0.463 1.00 0.00 H new ATOM 0 HB3 PRO A 79 13.888 7.544 -0.067 1.00 0.00 H new ATOM 0 HG2 PRO A 79 12.865 5.747 -1.763 0.31 0.00 H new ATOM 0 HG3 PRO A 79 14.130 5.288 -0.641 0.31 0.00 H new ATOM 0 HD2 PRO A 79 11.173 4.722 -0.488 1.00 0.00 H new ATOM 0 HD3 PRO A 79 12.516 3.690 -0.040 1.00 0.00 H new ATOM 1265 N ASN A 80 10.318 7.256 1.825 0.07 0.00 N ATOM 1266 CA ASN A 80 9.240 8.101 2.315 0.24 0.00 C ATOM 1267 C ASN A 80 8.248 7.289 3.141 0.09 0.00 C ATOM 1268 O ASN A 80 7.605 6.372 2.631 0.51 0.00 O ATOM 1269 CB ASN A 80 8.515 8.765 1.141 0.11 0.00 C ATOM 1270 CG ASN A 80 9.443 9.591 0.268 0.06 0.00 C ATOM 1271 OD1 ASN A 80 10.481 10.159 0.872 1.00 0.00 O flip ATOM 1272 ND2 ASN A 80 9.228 9.717 -0.938 1.00 0.00 N flip ATOM 0 H ASN A 80 10.007 6.409 1.349 0.07 0.00 H new ATOM 0 HA ASN A 80 9.674 8.872 2.952 0.24 0.00 H new ATOM 0 HB2 ASN A 80 8.039 7.996 0.532 0.11 0.00 H new ATOM 0 HB3 ASN A 80 7.720 9.404 1.525 0.11 0.00 H new ATOM 0 HD21 ASN A 80 8.419 9.263 -1.362 1.00 0.00 H new ATOM 0 HD22 ASN A 80 9.859 10.275 -1.513 1.00 0.00 H new ATOM 1279 N VAL A 81 8.121 7.648 4.414 1.00 0.00 N ATOM 1280 CA VAL A 81 7.206 6.967 5.327 0.07 0.00 C ATOM 1281 C VAL A 81 6.748 7.914 6.438 0.35 0.00 C ATOM 1282 O VAL A 81 7.555 8.641 7.015 0.06 0.00 O ATOM 1283 CB VAL A 81 7.860 5.717 5.966 0.81 0.00 C ATOM 1284 CG1 VAL A 81 7.004 5.181 7.103 1.00 0.00 C ATOM 1285 CG2 VAL A 81 8.091 4.633 4.923 1.00 0.00 C ATOM 0 H VAL A 81 8.644 8.413 4.841 1.00 0.00 H new ATOM 0 HA VAL A 81 6.346 6.648 4.737 0.07 0.00 H new ATOM 0 HB VAL A 81 8.826 6.016 6.372 0.81 0.00 H new ATOM 0 HG11 VAL A 81 7.483 4.303 7.537 1.00 0.00 H new ATOM 0 HG12 VAL A 81 6.893 5.949 7.868 1.00 0.00 H new ATOM 0 HG13 VAL A 81 6.021 4.906 6.720 1.00 0.00 H new ATOM 0 HG21 VAL A 81 8.551 3.765 5.396 1.00 0.00 H new ATOM 0 HG22 VAL A 81 7.137 4.343 4.482 1.00 0.00 H new ATOM 0 HG23 VAL A 81 8.750 5.013 4.143 1.00 0.00 H new ATOM 1295 N TYR A 82 5.450 7.902 6.730 0.09 0.00 N ATOM 1296 CA TYR A 82 4.893 8.759 7.772 0.85 0.00 C ATOM 1297 C TYR A 82 5.001 8.097 9.142 0.36 0.00 C ATOM 1298 O TYR A 82 5.413 6.943 9.255 1.00 0.00 O ATOM 1299 CB TYR A 82 3.431 9.091 7.470 0.53 0.00 C ATOM 1300 CG TYR A 82 3.249 9.978 6.258 0.96 0.00 C ATOM 1301 CD1 TYR A 82 3.421 11.353 6.349 0.06 0.00 C ATOM 1302 CD2 TYR A 82 2.909 9.439 5.024 0.24 0.00 C ATOM 1303 CE1 TYR A 82 3.257 12.168 5.245 0.74 0.00 C ATOM 1304 CE2 TYR A 82 2.746 10.248 3.913 0.90 0.00 C ATOM 1305 CZ TYR A 82 2.921 11.610 4.029 0.23 0.00 C ATOM 1306 OH TYR A 82 2.760 12.417 2.927 0.10 0.00 O ATOM 0 H TYR A 82 4.765 7.309 6.260 0.09 0.00 H new ATOM 0 HA TYR A 82 5.471 9.683 7.787 0.85 0.00 H new ATOM 0 HB2 TYR A 82 2.881 8.163 7.316 0.53 0.00 H new ATOM 0 HB3 TYR A 82 2.992 9.582 8.338 0.53 0.00 H new ATOM 0 HD1 TYR A 82 3.687 11.793 7.299 0.06 0.00 H new ATOM 0 HD2 TYR A 82 2.770 8.372 4.930 0.24 0.00 H new ATOM 0 HE1 TYR A 82 3.391 13.236 5.334 0.74 0.00 H new ATOM 0 HE2 TYR A 82 2.483 9.814 2.960 0.90 0.00 H new ATOM 0 HH TYR A 82 3.193 12.002 2.152 0.10 0.00 H new ATOM 1316 N ALA A 83 4.627 8.838 10.181 0.15 0.00 N ATOM 1317 CA ALA A 83 4.681 8.327 11.545 0.26 0.00 C ATOM 1318 C ALA A 83 3.726 7.152 11.734 0.06 0.00 C ATOM 1319 O ALA A 83 4.015 6.220 12.486 0.12 0.00 O ATOM 1320 CB ALA A 83 4.356 9.437 12.535 0.59 0.00 C ATOM 0 H ALA A 83 4.283 9.795 10.103 0.15 0.00 H new ATOM 0 HA ALA A 83 5.694 7.969 11.732 0.26 0.00 H new ATOM 0 HB1 ALA A 83 4.399 9.043 13.550 0.59 0.00 H new ATOM 0 HB2 ALA A 83 5.081 10.244 12.427 0.59 0.00 H new ATOM 0 HB3 ALA A 83 3.355 9.820 12.337 0.59 0.00 H new ATOM 1326 N ASP A 84 2.590 7.201 11.046 0.23 0.00 N ATOM 1327 CA ASP A 84 1.591 6.143 11.139 0.28 0.00 C ATOM 1328 C ASP A 84 1.981 4.945 10.279 0.07 0.00 C ATOM 1329 O ASP A 84 1.247 3.958 10.203 0.38 0.00 O ATOM 1330 CB ASP A 84 0.222 6.670 10.708 0.08 0.00 C ATOM 1331 CG ASP A 84 -0.248 7.828 11.566 1.00 0.00 C ATOM 1332 OD1 ASP A 84 -0.850 7.572 12.630 0.12 0.00 O ATOM 1333 OD2 ASP A 84 -0.012 8.990 11.174 0.18 0.00 O ATOM 0 H ASP A 84 2.338 7.963 10.417 0.23 0.00 H new ATOM 0 HA ASP A 84 1.539 5.817 12.178 0.28 0.00 H new ATOM 0 HB2 ASP A 84 0.270 6.989 9.667 0.08 0.00 H new ATOM 0 HB3 ASP A 84 -0.508 5.862 10.761 0.08 0.00 H new ATOM 1338 N GLY A 85 3.140 5.038 9.635 0.18 0.00 N ATOM 1339 CA GLY A 85 3.607 3.955 8.788 0.60 0.00 C ATOM 1340 C GLY A 85 2.890 3.914 7.455 1.00 0.00 C ATOM 1341 O GLY A 85 3.104 3.004 6.653 0.08 0.00 O ATOM 0 H GLY A 85 3.764 5.843 9.684 0.18 0.00 H new ATOM 0 HA2 GLY A 85 4.678 4.066 8.618 0.60 0.00 H new ATOM 0 HA3 GLY A 85 3.463 3.006 9.304 0.60 0.00 H new ATOM 1345 N SER A 86 2.033 4.902 7.218 0.15 0.00 N ATOM 1346 CA SER A 86 1.282 4.980 5.972 0.14 0.00 C ATOM 1347 C SER A 86 2.213 5.223 4.791 0.71 0.00 C ATOM 1348 O SER A 86 3.370 5.608 4.971 1.00 0.00 O ATOM 1349 CB SER A 86 0.238 6.095 6.051 0.07 0.00 C ATOM 1350 OG SER A 86 0.849 7.349 6.300 1.00 0.00 O ATOM 0 H SER A 86 1.842 5.660 7.873 0.15 0.00 H new ATOM 0 HA SER A 86 0.775 4.027 5.822 0.14 0.00 H new ATOM 0 HB2 SER A 86 -0.323 6.139 5.117 0.07 0.00 H new ATOM 0 HB3 SER A 86 -0.478 5.872 6.842 0.07 0.00 H new ATOM 0 HG SER A 86 0.161 8.045 6.344 1.00 0.00 H new ATOM 1356 N ILE A 87 1.707 4.999 3.583 1.00 0.00 N ATOM 1357 CA ILE A 87 2.500 5.197 2.376 0.10 0.00 C ATOM 1358 C ILE A 87 2.195 6.544 1.733 0.26 0.00 C ATOM 1359 O ILE A 87 1.036 6.953 1.646 0.06 0.00 O ATOM 1360 CB ILE A 87 2.255 4.077 1.343 0.39 0.00 C ATOM 1361 CG1 ILE A 87 2.572 2.708 1.949 0.12 0.00 C ATOM 1362 CG2 ILE A 87 3.095 4.309 0.097 1.00 0.00 C ATOM 1363 CD1 ILE A 87 1.446 2.140 2.785 0.06 0.00 C ATOM 0 H ILE A 87 0.753 4.681 3.414 1.00 0.00 H new ATOM 0 HA ILE A 87 3.546 5.171 2.681 0.10 0.00 H new ATOM 0 HB ILE A 87 1.202 4.096 1.061 0.39 0.00 H new ATOM 0 HG12 ILE A 87 2.805 2.009 1.145 0.12 0.00 H new ATOM 0 HG13 ILE A 87 3.466 2.792 2.567 0.12 0.00 H new ATOM 0 HG21 ILE A 87 2.910 3.510 -0.621 1.00 0.00 H new ATOM 0 HG22 ILE A 87 2.827 5.267 -0.349 1.00 0.00 H new ATOM 0 HG23 ILE A 87 4.151 4.317 0.366 1.00 0.00 H new ATOM 0 HD11 ILE A 87 1.742 1.169 3.182 0.06 0.00 H new ATOM 0 HD12 ILE A 87 1.228 2.818 3.610 0.06 0.00 H new ATOM 0 HD13 ILE A 87 0.556 2.023 2.166 0.06 0.00 H new ATOM 1375 N CYS A 88 3.243 7.229 1.286 0.57 0.00 N ATOM 1376 CA CYS A 88 3.091 8.532 0.649 1.00 0.00 C ATOM 1377 C CYS A 88 2.796 8.378 -0.840 1.00 0.00 C ATOM 1378 O CYS A 88 3.686 8.057 -1.629 0.98 0.00 O ATOM 1379 CB CYS A 88 4.352 9.374 0.850 0.82 0.00 C ATOM 1380 SG CYS A 88 4.269 11.019 0.106 0.28 0.00 S ATOM 0 H CYS A 88 4.207 6.903 1.353 0.57 0.00 H new ATOM 0 HA CYS A 88 2.248 9.041 1.116 1.00 0.00 H new ATOM 0 HB2 CYS A 88 4.539 9.480 1.919 0.82 0.00 H new ATOM 0 HB3 CYS A 88 5.204 8.839 0.429 0.82 0.00 H new ATOM 0 HG CYS A 88 5.381 11.654 0.332 0.28 0.00 H new ATOM 1386 N LEU A 89 1.541 8.606 -1.215 0.56 0.00 N ATOM 1387 CA LEU A 89 1.122 8.494 -2.607 0.13 0.00 C ATOM 1388 C LEU A 89 0.406 9.767 -3.053 0.25 0.00 C ATOM 1389 O LEU A 89 -0.369 10.349 -2.296 1.00 0.00 O ATOM 1390 CB LEU A 89 0.205 7.280 -2.786 0.73 0.00 C ATOM 1391 CG LEU A 89 0.520 6.387 -3.990 0.30 0.00 C ATOM 1392 CD1 LEU A 89 0.398 7.165 -5.293 1.00 0.00 C ATOM 1393 CD2 LEU A 89 1.910 5.783 -3.856 0.13 0.00 C ATOM 0 H LEU A 89 0.795 8.870 -0.572 0.56 0.00 H new ATOM 0 HA LEU A 89 2.008 8.360 -3.227 0.13 0.00 H new ATOM 0 HB2 LEU A 89 0.255 6.673 -1.882 0.73 0.00 H new ATOM 0 HB3 LEU A 89 -0.822 7.633 -2.876 0.73 0.00 H new ATOM 0 HG LEU A 89 -0.209 5.577 -4.011 0.30 0.00 H new ATOM 0 HD11 LEU A 89 0.627 6.508 -6.132 1.00 0.00 H new ATOM 0 HD12 LEU A 89 -0.618 7.545 -5.396 1.00 0.00 H new ATOM 0 HD13 LEU A 89 1.098 8.000 -5.285 1.00 0.00 H new ATOM 0 HD21 LEU A 89 2.117 5.152 -4.720 0.13 0.00 H new ATOM 0 HD22 LEU A 89 2.650 6.581 -3.804 0.13 0.00 H new ATOM 0 HD23 LEU A 89 1.960 5.183 -2.948 0.13 0.00 H new ATOM 1405 N ASP A 90 0.673 10.192 -4.285 0.17 0.00 N ATOM 1406 CA ASP A 90 0.058 11.402 -4.828 0.16 0.00 C ATOM 1407 C ASP A 90 -1.454 11.253 -4.965 0.53 0.00 C ATOM 1408 O ASP A 90 -2.180 12.244 -5.032 0.15 0.00 O ATOM 1409 CB ASP A 90 0.666 11.743 -6.190 0.14 0.00 C ATOM 1410 CG ASP A 90 2.125 12.142 -6.090 0.13 0.00 C ATOM 1411 OD1 ASP A 90 2.400 13.293 -5.693 1.00 0.00 O ATOM 1412 OD2 ASP A 90 2.992 11.303 -6.410 0.47 0.00 O ATOM 0 H ASP A 90 1.310 9.718 -4.926 0.17 0.00 H new ATOM 0 HA ASP A 90 0.258 12.212 -4.126 0.16 0.00 H new ATOM 0 HB2 ASP A 90 0.573 10.882 -6.852 0.14 0.00 H new ATOM 0 HB3 ASP A 90 0.100 12.557 -6.644 0.14 0.00 H new ATOM 1417 N ILE A 91 -1.928 10.011 -5.008 0.12 0.00 N ATOM 1418 CA ILE A 91 -3.356 9.742 -5.143 0.12 0.00 C ATOM 1419 C ILE A 91 -4.119 10.182 -3.896 0.47 0.00 C ATOM 1420 O ILE A 91 -5.305 10.506 -3.964 0.25 0.00 O ATOM 1421 CB ILE A 91 -3.625 8.246 -5.402 0.34 0.00 C ATOM 1422 CG1 ILE A 91 -5.113 8.010 -5.674 1.00 0.00 C ATOM 1423 CG2 ILE A 91 -3.158 7.411 -4.218 0.17 0.00 C ATOM 1424 CD1 ILE A 91 -5.434 6.594 -6.101 0.12 0.00 C ATOM 0 H ILE A 91 -1.345 9.176 -4.951 0.12 0.00 H new ATOM 0 HA ILE A 91 -3.708 10.317 -6.000 0.12 0.00 H new ATOM 0 HB ILE A 91 -3.062 7.939 -6.283 0.34 0.00 H new ATOM 0 HG12 ILE A 91 -5.680 8.246 -4.774 1.00 0.00 H new ATOM 0 HG13 ILE A 91 -5.446 8.699 -6.450 1.00 0.00 H new ATOM 0 HG21 ILE A 91 -3.355 6.357 -4.416 0.17 0.00 H new ATOM 0 HG22 ILE A 91 -2.089 7.559 -4.068 0.17 0.00 H new ATOM 0 HG23 ILE A 91 -3.696 7.718 -3.321 0.17 0.00 H new ATOM 0 HD11 ILE A 91 -6.506 6.501 -6.276 0.12 0.00 H new ATOM 0 HD12 ILE A 91 -4.895 6.360 -7.019 0.12 0.00 H new ATOM 0 HD13 ILE A 91 -5.133 5.900 -5.316 0.12 0.00 H new ATOM 1436 N LEU A 92 -3.429 10.197 -2.758 0.09 0.00 N ATOM 1437 CA LEU A 92 -4.043 10.595 -1.497 0.54 0.00 C ATOM 1438 C LEU A 92 -4.342 12.091 -1.477 0.48 0.00 C ATOM 1439 O LEU A 92 -5.009 12.588 -0.570 0.05 0.00 O ATOM 1440 CB LEU A 92 -3.131 10.229 -0.324 0.08 0.00 C ATOM 1441 CG LEU A 92 -2.907 8.728 -0.116 0.44 0.00 C ATOM 1442 CD1 LEU A 92 -1.911 8.491 1.007 0.30 0.00 C ATOM 1443 CD2 LEU A 92 -4.224 8.024 0.180 0.13 0.00 C ATOM 0 H LEU A 92 -2.445 9.938 -2.685 0.09 0.00 H new ATOM 0 HA LEU A 92 -4.986 10.057 -1.399 0.54 0.00 H new ATOM 0 HB2 LEU A 92 -2.163 10.707 -0.474 0.08 0.00 H new ATOM 0 HB3 LEU A 92 -3.555 10.647 0.589 0.08 0.00 H new ATOM 0 HG LEU A 92 -2.497 8.311 -1.036 0.44 0.00 H new ATOM 0 HD11 LEU A 92 -1.763 7.420 1.142 0.30 0.00 H new ATOM 0 HD12 LEU A 92 -0.960 8.960 0.755 0.30 0.00 H new ATOM 0 HD13 LEU A 92 -2.295 8.923 1.931 0.30 0.00 H new ATOM 0 HD21 LEU A 92 -4.043 6.959 0.324 0.13 0.00 H new ATOM 0 HD22 LEU A 92 -4.665 8.443 1.084 0.13 0.00 H new ATOM 0 HD23 LEU A 92 -4.908 8.165 -0.657 0.13 0.00 H new ATOM 1455 N GLN A 93 -3.844 12.805 -2.483 0.29 0.00 N ATOM 1456 CA GLN A 93 -4.062 14.245 -2.581 0.32 0.00 C ATOM 1457 C GLN A 93 -5.476 14.543 -3.066 0.11 0.00 C ATOM 1458 O GLN A 93 -6.346 13.670 -3.052 1.00 0.00 O ATOM 1459 CB GLN A 93 -3.039 14.877 -3.530 0.42 0.00 C ATOM 1460 CG GLN A 93 -1.601 14.733 -3.059 1.00 0.00 C ATOM 1461 CD GLN A 93 -0.618 15.448 -3.965 0.50 0.00 C ATOM 1462 OE1 GLN A 93 -0.129 14.745 -4.980 0.54 0.00 O flip ATOM 1463 NE2 GLN A 93 -0.303 16.621 -3.758 0.12 0.00 N flip ATOM 0 H GLN A 93 -3.287 12.410 -3.241 0.29 0.00 H new ATOM 0 HA GLN A 93 -3.936 14.677 -1.588 0.32 0.00 H new ATOM 0 HB2 GLN A 93 -3.138 14.419 -4.514 0.42 0.00 H new ATOM 0 HB3 GLN A 93 -3.270 15.936 -3.647 0.42 0.00 H new ATOM 0 HG2 GLN A 93 -1.512 15.129 -2.048 1.00 0.00 H new ATOM 0 HG3 GLN A 93 -1.342 13.675 -3.011 1.00 0.00 H new ATOM 0 HE21 GLN A 93 -0.703 17.124 -2.966 0.12 0.00 H new ATOM 0 HE22 GLN A 93 0.358 17.089 -4.379 0.12 0.00 H new ATOM 1472 N ASN A 94 -5.701 15.781 -3.497 0.07 0.00 N ATOM 1473 CA ASN A 94 -7.012 16.196 -3.984 1.00 0.00 C ATOM 1474 C ASN A 94 -7.356 15.493 -5.295 0.05 0.00 C ATOM 1475 O ASN A 94 -8.481 15.592 -5.787 0.32 0.00 O ATOM 1476 CB ASN A 94 -7.045 17.714 -4.179 1.00 0.00 C ATOM 1477 CG ASN A 94 -8.407 18.214 -4.619 1.00 0.00 C ATOM 1478 OD1 ASN A 94 -8.686 18.319 -5.813 1.00 0.00 O ATOM 1479 ND2 ASN A 94 -9.264 18.527 -3.654 0.35 0.00 N ATOM 0 H ASN A 94 -4.992 16.514 -3.519 0.07 0.00 H new ATOM 0 HA ASN A 94 -7.756 15.914 -3.239 1.00 0.00 H new ATOM 0 HB2 ASN A 94 -6.766 18.203 -3.246 1.00 0.00 H new ATOM 0 HB3 ASN A 94 -6.300 17.998 -4.922 1.00 0.00 H new ATOM 0 HD21 ASN A 94 -10.195 18.870 -3.890 0.35 0.00 H new ATOM 0 HD22 ASN A 94 -8.991 18.425 -2.677 0.35 0.00 H new ATOM 1486 N ARG A 95 -6.385 14.777 -5.853 0.38 0.00 N ATOM 1487 CA ARG A 95 -6.584 14.058 -7.105 0.05 0.00 C ATOM 1488 C ARG A 95 -7.465 12.830 -6.898 0.58 0.00 C ATOM 1489 O ARG A 95 -7.907 12.202 -7.860 0.51 0.00 O ATOM 1490 CB ARG A 95 -5.239 13.641 -7.698 0.07 0.00 C ATOM 1491 CG ARG A 95 -4.378 14.817 -8.126 1.00 0.00 C ATOM 1492 CD ARG A 95 -3.052 14.353 -8.703 0.46 0.00 C ATOM 1493 NE ARG A 95 -3.235 13.470 -9.852 0.06 0.00 N ATOM 1494 CZ ARG A 95 -2.253 13.112 -10.671 0.13 0.00 C ATOM 1495 NH1 ARG A 95 -1.021 13.562 -10.476 0.26 0.00 N ATOM 1496 NH2 ARG A 95 -2.502 12.300 -11.691 0.36 0.00 N ATOM 0 H ARG A 95 -5.450 14.680 -5.456 0.38 0.00 H new ATOM 0 HA ARG A 95 -7.088 14.729 -7.801 0.05 0.00 H new ATOM 0 HB2 ARG A 95 -4.694 13.050 -6.962 0.07 0.00 H new ATOM 0 HB3 ARG A 95 -5.414 12.996 -8.559 0.07 0.00 H new ATOM 0 HG2 ARG A 95 -4.912 15.409 -8.869 1.00 0.00 H new ATOM 0 HG3 ARG A 95 -4.196 15.467 -7.270 1.00 0.00 H new ATOM 0 HD2 ARG A 95 -2.463 15.220 -9.002 0.46 0.00 H new ATOM 0 HD3 ARG A 95 -2.483 13.832 -7.932 0.46 0.00 H new ATOM 0 HE ARG A 95 -4.171 13.108 -10.036 0.06 0.00 H new ATOM 0 HH11 ARG A 95 -0.824 14.186 -9.694 0.26 0.00 H new ATOM 0 HH12 ARG A 95 -0.270 13.284 -11.108 0.26 0.00 H new ATOM 0 HH21 ARG A 95 -3.448 11.951 -11.846 0.36 0.00 H new ATOM 0 HH22 ARG A 95 -1.748 12.025 -12.320 0.36 0.00 H new ATOM 1510 N TRP A 96 -7.712 12.491 -5.636 0.13 0.00 N ATOM 1511 CA TRP A 96 -8.545 11.341 -5.307 0.27 0.00 C ATOM 1512 C TRP A 96 -9.979 11.562 -5.771 1.00 0.00 C ATOM 1513 O TRP A 96 -10.516 12.664 -5.663 1.00 0.00 O ATOM 1514 CB TRP A 96 -8.519 11.070 -3.802 0.13 0.00 C ATOM 1515 CG TRP A 96 -9.482 10.000 -3.379 0.08 0.00 C ATOM 1516 CD1 TRP A 96 -10.566 10.151 -2.562 0.23 0.00 C ATOM 1517 CD2 TRP A 96 -9.452 8.618 -3.755 1.00 0.00 C ATOM 1518 NE1 TRP A 96 -11.209 8.947 -2.405 0.19 0.00 N ATOM 1519 CE2 TRP A 96 -10.545 7.992 -3.128 1.00 0.00 C ATOM 1520 CE3 TRP A 96 -8.607 7.849 -4.563 1.00 0.00 C ATOM 1521 CZ2 TRP A 96 -10.814 6.634 -3.280 1.00 0.00 C ATOM 1522 CZ3 TRP A 96 -8.877 6.502 -4.714 0.28 0.00 C ATOM 1523 CH2 TRP A 96 -9.973 5.906 -4.075 0.18 0.00 C ATOM 0 H TRP A 96 -7.348 12.995 -4.827 0.13 0.00 H new ATOM 0 HA TRP A 96 -8.140 10.473 -5.827 0.27 0.00 H new ATOM 0 HB2 TRP A 96 -7.510 10.779 -3.509 0.13 0.00 H new ATOM 0 HB3 TRP A 96 -8.752 11.992 -3.269 0.13 0.00 H new ATOM 0 HD1 TRP A 96 -10.873 11.081 -2.106 0.23 0.00 H new ATOM 0 HE1 TRP A 96 -12.045 8.790 -1.842 0.19 0.00 H new ATOM 0 HE3 TRP A 96 -7.760 8.299 -5.059 1.00 0.00 H new ATOM 0 HZ2 TRP A 96 -11.657 6.172 -2.787 1.00 0.00 H new ATOM 0 HZ3 TRP A 96 -8.232 5.898 -5.335 0.28 0.00 H new ATOM 0 HH2 TRP A 96 -10.157 4.851 -4.213 0.18 0.00 H new ATOM 1534 N SER A 97 -10.594 10.502 -6.284 0.42 0.00 N ATOM 1535 CA SER A 97 -11.967 10.574 -6.765 0.09 0.00 C ATOM 1536 C SER A 97 -12.769 9.362 -6.291 0.54 0.00 C ATOM 1537 O SER A 97 -12.244 8.250 -6.240 0.73 0.00 O ATOM 1538 CB SER A 97 -11.988 10.651 -8.292 0.20 0.00 C ATOM 1539 OG SER A 97 -11.409 11.859 -8.753 1.00 0.00 O ATOM 0 H SER A 97 -10.162 9.583 -6.377 0.42 0.00 H new ATOM 0 HA SER A 97 -12.427 11.474 -6.358 0.09 0.00 H new ATOM 0 HB2 SER A 97 -11.445 9.803 -8.709 0.20 0.00 H new ATOM 0 HB3 SER A 97 -13.016 10.578 -8.648 0.20 0.00 H new ATOM 0 HG SER A 97 -11.434 11.881 -9.732 1.00 0.00 H new ATOM 1545 N PRO A 98 -14.053 9.559 -5.937 0.24 0.00 N ATOM 1546 CA PRO A 98 -14.918 8.471 -5.468 1.00 0.00 C ATOM 1547 C PRO A 98 -15.199 7.442 -6.559 0.10 0.00 C ATOM 1548 O PRO A 98 -15.876 6.439 -6.323 0.83 0.00 O ATOM 1549 CB PRO A 98 -16.218 9.179 -5.058 0.53 0.00 C ATOM 1550 CG PRO A 98 -15.872 10.628 -4.972 0.16 0.00 C ATOM 1551 CD PRO A 98 -14.764 10.847 -5.959 1.00 0.00 C ATOM 0 HA PRO A 98 -14.452 7.913 -4.656 1.00 0.00 H new ATOM 0 HB2 PRO A 98 -17.007 9.007 -5.790 0.53 0.00 H new ATOM 0 HB3 PRO A 98 -16.584 8.805 -4.102 0.53 0.00 H new ATOM 0 HG2 PRO A 98 -16.735 11.250 -5.210 0.16 0.00 H new ATOM 0 HG3 PRO A 98 -15.555 10.894 -3.964 0.16 0.00 H new ATOM 0 HD2 PRO A 98 -15.147 11.081 -6.952 1.00 0.00 H new ATOM 0 HD3 PRO A 98 -14.116 11.672 -5.664 1.00 0.00 H new ATOM 1559 N THR A 99 -14.677 7.696 -7.757 0.24 0.00 N ATOM 1560 CA THR A 99 -14.874 6.793 -8.885 0.36 0.00 C ATOM 1561 C THR A 99 -13.976 5.565 -8.771 0.07 0.00 C ATOM 1562 O THR A 99 -14.402 4.446 -9.058 0.98 0.00 O ATOM 1563 CB THR A 99 -14.594 7.500 -10.226 0.12 0.00 C ATOM 1564 OG1 THR A 99 -15.422 8.662 -10.349 0.08 0.00 O ATOM 1565 CG2 THR A 99 -14.854 6.562 -11.396 0.64 0.00 C ATOM 0 H THR A 99 -14.115 8.520 -7.970 0.24 0.00 H new ATOM 0 HA THR A 99 -15.917 6.479 -8.860 0.36 0.00 H new ATOM 0 HB THR A 99 -13.545 7.797 -10.243 0.12 0.00 H new ATOM 0 HG1 THR A 99 -15.237 9.107 -11.203 0.08 0.00 H new ATOM 0 HG21 THR A 99 -14.650 7.082 -12.332 0.64 0.00 H new ATOM 0 HG22 THR A 99 -14.203 5.691 -11.316 0.64 0.00 H new ATOM 0 HG23 THR A 99 -15.895 6.240 -11.380 0.64 0.00 H new ATOM 1573 N TYR A 100 -12.732 5.780 -8.352 0.80 0.00 N ATOM 1574 CA TYR A 100 -11.775 4.686 -8.206 1.00 0.00 C ATOM 1575 C TYR A 100 -12.259 3.666 -7.179 1.00 0.00 C ATOM 1576 O TYR A 100 -13.252 3.887 -6.488 0.67 0.00 O ATOM 1577 CB TYR A 100 -10.404 5.228 -7.798 0.19 0.00 C ATOM 1578 CG TYR A 100 -9.789 6.159 -8.820 0.19 0.00 C ATOM 1579 CD1 TYR A 100 -9.075 5.660 -9.902 0.21 0.00 C ATOM 1580 CD2 TYR A 100 -9.920 7.538 -8.700 1.00 0.00 C ATOM 1581 CE1 TYR A 100 -8.509 6.508 -10.836 0.82 0.00 C ATOM 1582 CE2 TYR A 100 -9.358 8.391 -9.628 0.45 0.00 C ATOM 1583 CZ TYR A 100 -8.654 7.873 -10.694 1.00 0.00 C ATOM 1584 OH TYR A 100 -8.091 8.721 -11.620 1.00 0.00 O ATOM 0 H TYR A 100 -12.363 6.699 -8.108 0.80 0.00 H new ATOM 0 HA TYR A 100 -11.688 4.186 -9.171 1.00 0.00 H new ATOM 0 HB2 TYR A 100 -10.500 5.756 -6.849 0.19 0.00 H new ATOM 0 HB3 TYR A 100 -9.727 4.390 -7.629 0.19 0.00 H new ATOM 0 HD1 TYR A 100 -8.960 4.592 -10.016 0.21 0.00 H new ATOM 0 HD2 TYR A 100 -10.471 7.949 -7.867 1.00 0.00 H new ATOM 0 HE1 TYR A 100 -7.957 6.104 -11.672 0.82 0.00 H new ATOM 0 HE2 TYR A 100 -9.469 9.460 -9.520 0.45 0.00 H new ATOM 0 HH TYR A 100 -8.287 9.649 -11.375 1.00 0.00 H new ATOM 1594 N ASP A 101 -11.542 2.549 -7.081 1.00 0.00 N ATOM 1595 CA ASP A 101 -11.898 1.491 -6.142 0.97 0.00 C ATOM 1596 C ASP A 101 -10.675 1.015 -5.363 1.00 0.00 C ATOM 1597 O ASP A 101 -9.604 1.615 -5.441 0.69 0.00 O ATOM 1598 CB ASP A 101 -12.530 0.312 -6.887 0.28 0.00 C ATOM 1599 CG ASP A 101 -13.753 0.721 -7.684 0.19 0.00 C ATOM 1600 OD1 ASP A 101 -13.590 1.142 -8.849 0.05 0.00 O ATOM 1601 OD2 ASP A 101 -14.875 0.621 -7.144 0.09 0.00 O ATOM 0 H ASP A 101 -10.712 2.354 -7.640 1.00 0.00 H new ATOM 0 HA ASP A 101 -12.620 1.898 -5.434 0.97 0.00 H new ATOM 0 HB2 ASP A 101 -11.792 -0.128 -7.558 0.28 0.00 H new ATOM 0 HB3 ASP A 101 -12.808 -0.460 -6.170 0.28 0.00 H new ATOM 1606 N VAL A 102 -10.850 -0.066 -4.607 0.87 0.00 N ATOM 1607 CA VAL A 102 -9.768 -0.633 -3.808 0.49 0.00 C ATOM 1608 C VAL A 102 -8.608 -1.088 -4.693 1.00 0.00 C ATOM 1609 O VAL A 102 -7.474 -1.216 -4.234 0.07 0.00 O ATOM 1610 CB VAL A 102 -10.264 -1.822 -2.961 0.11 0.00 C ATOM 1611 CG1 VAL A 102 -10.769 -2.945 -3.856 1.00 0.00 C ATOM 1612 CG2 VAL A 102 -9.165 -2.321 -2.034 1.00 0.00 C ATOM 0 H VAL A 102 -11.735 -0.568 -4.531 0.87 0.00 H new ATOM 0 HA VAL A 102 -9.416 0.154 -3.141 0.49 0.00 H new ATOM 0 HB VAL A 102 -11.095 -1.478 -2.345 0.11 0.00 H new ATOM 0 HG11 VAL A 102 -11.114 -3.775 -3.239 1.00 0.00 H new ATOM 0 HG12 VAL A 102 -11.594 -2.580 -4.468 1.00 0.00 H new ATOM 0 HG13 VAL A 102 -9.961 -3.286 -4.503 1.00 0.00 H new ATOM 0 HG21 VAL A 102 -9.538 -3.160 -1.446 1.00 0.00 H new ATOM 0 HG22 VAL A 102 -8.309 -2.645 -2.626 1.00 0.00 H new ATOM 0 HG23 VAL A 102 -8.860 -1.516 -1.365 1.00 0.00 H new ATOM 1622 N SER A 103 -8.902 -1.339 -5.963 0.19 0.00 N ATOM 1623 CA SER A 103 -7.886 -1.775 -6.912 0.10 0.00 C ATOM 1624 C SER A 103 -6.899 -0.649 -7.214 0.15 0.00 C ATOM 1625 O SER A 103 -5.722 -0.896 -7.475 0.13 0.00 O ATOM 1626 CB SER A 103 -8.543 -2.259 -8.206 0.68 0.00 C ATOM 1627 OG SER A 103 -9.450 -3.319 -7.954 1.00 0.00 O ATOM 0 H SER A 103 -9.837 -1.248 -6.360 0.19 0.00 H new ATOM 0 HA SER A 103 -7.335 -2.601 -6.462 0.10 0.00 H new ATOM 0 HB2 SER A 103 -9.069 -1.431 -8.681 0.68 0.00 H new ATOM 0 HB3 SER A 103 -7.775 -2.592 -8.905 0.68 0.00 H new ATOM 0 HG SER A 103 -9.857 -3.608 -8.797 1.00 0.00 H new ATOM 1633 N SER A 104 -7.390 0.588 -7.182 0.08 0.00 N ATOM 1634 CA SER A 104 -6.557 1.754 -7.465 0.08 0.00 C ATOM 1635 C SER A 104 -5.416 1.898 -6.459 1.00 0.00 C ATOM 1636 O SER A 104 -4.252 2.014 -6.846 0.34 0.00 O ATOM 1637 CB SER A 104 -7.411 3.022 -7.461 0.16 0.00 C ATOM 1638 OG SER A 104 -6.626 4.167 -7.751 1.00 0.00 O ATOM 0 H SER A 104 -8.361 0.809 -6.963 0.08 0.00 H new ATOM 0 HA SER A 104 -6.116 1.609 -8.451 0.08 0.00 H new ATOM 0 HB2 SER A 104 -8.209 2.929 -8.197 0.16 0.00 H new ATOM 0 HB3 SER A 104 -7.887 3.141 -6.488 0.16 0.00 H new ATOM 0 HG SER A 104 -7.119 4.756 -8.360 1.00 0.00 H new ATOM 1644 N ILE A 105 -5.749 1.886 -5.170 0.13 0.00 N ATOM 1645 CA ILE A 105 -4.741 2.025 -4.119 0.10 0.00 C ATOM 1646 C ILE A 105 -3.696 0.916 -4.201 0.13 0.00 C ATOM 1647 O ILE A 105 -2.512 1.148 -3.960 0.55 0.00 O ATOM 1648 CB ILE A 105 -5.378 2.029 -2.709 0.09 0.00 C ATOM 1649 CG1 ILE A 105 -4.304 1.901 -1.622 1.00 0.00 C ATOM 1650 CG2 ILE A 105 -6.398 0.910 -2.580 0.35 0.00 C ATOM 1651 CD1 ILE A 105 -3.281 3.014 -1.641 0.06 0.00 C ATOM 0 H ILE A 105 -6.704 1.782 -4.828 0.13 0.00 H new ATOM 0 HA ILE A 105 -4.253 2.986 -4.282 0.10 0.00 H new ATOM 0 HB ILE A 105 -5.889 2.982 -2.573 0.09 0.00 H new ATOM 0 HG12 ILE A 105 -4.789 1.882 -0.646 1.00 0.00 H new ATOM 0 HG13 ILE A 105 -3.791 0.947 -1.742 1.00 0.00 H new ATOM 0 HG21 ILE A 105 -6.835 0.929 -1.582 0.35 0.00 H new ATOM 0 HG22 ILE A 105 -7.184 1.047 -3.323 0.35 0.00 H new ATOM 0 HG23 ILE A 105 -5.908 -0.050 -2.743 0.35 0.00 H new ATOM 0 HD11 ILE A 105 -2.555 2.854 -0.844 0.06 0.00 H new ATOM 0 HD12 ILE A 105 -2.768 3.021 -2.603 0.06 0.00 H new ATOM 0 HD13 ILE A 105 -3.781 3.971 -1.490 0.06 0.00 H new ATOM 1663 N LEU A 106 -4.137 -0.287 -4.547 1.00 0.00 N ATOM 1664 CA LEU A 106 -3.231 -1.424 -4.652 0.91 0.00 C ATOM 1665 C LEU A 106 -2.163 -1.180 -5.715 0.44 0.00 C ATOM 1666 O LEU A 106 -0.967 -1.215 -5.426 0.14 0.00 O ATOM 1667 CB LEU A 106 -4.010 -2.701 -4.983 0.33 0.00 C ATOM 1668 CG LEU A 106 -4.871 -3.257 -3.846 1.00 0.00 C ATOM 1669 CD1 LEU A 106 -5.651 -4.474 -4.317 0.29 0.00 C ATOM 1670 CD2 LEU A 106 -4.006 -3.611 -2.645 0.33 0.00 C ATOM 0 H LEU A 106 -5.112 -0.500 -4.759 1.00 0.00 H new ATOM 0 HA LEU A 106 -2.737 -1.546 -3.688 0.91 0.00 H new ATOM 0 HB2 LEU A 106 -4.654 -2.502 -5.840 0.33 0.00 H new ATOM 0 HB3 LEU A 106 -3.301 -3.470 -5.289 0.33 0.00 H new ATOM 0 HG LEU A 106 -5.581 -2.487 -3.543 1.00 0.00 H new ATOM 0 HD11 LEU A 106 -6.258 -4.857 -3.497 0.29 0.00 H new ATOM 0 HD12 LEU A 106 -6.299 -4.192 -5.147 0.29 0.00 H new ATOM 0 HD13 LEU A 106 -4.956 -5.247 -4.646 0.29 0.00 H new ATOM 0 HD21 LEU A 106 -4.635 -4.005 -1.847 0.33 0.00 H new ATOM 0 HD22 LEU A 106 -3.273 -4.364 -2.934 0.33 0.00 H new ATOM 0 HD23 LEU A 106 -3.489 -2.718 -2.293 0.33 0.00 H new ATOM 1682 N THR A 107 -2.605 -0.933 -6.943 0.89 0.00 N ATOM 1683 CA THR A 107 -1.692 -0.691 -8.055 0.75 0.00 C ATOM 1684 C THR A 107 -0.805 0.523 -7.796 0.63 0.00 C ATOM 1685 O THR A 107 0.313 0.605 -8.305 0.07 0.00 O ATOM 1686 CB THR A 107 -2.462 -0.482 -9.372 0.20 0.00 C ATOM 1687 OG1 THR A 107 -3.304 0.673 -9.271 0.37 0.00 O ATOM 1688 CG2 THR A 107 -3.307 -1.703 -9.701 1.00 0.00 C ATOM 0 H THR A 107 -3.593 -0.895 -7.194 0.89 0.00 H new ATOM 0 HA THR A 107 -1.062 -1.576 -8.144 0.75 0.00 H new ATOM 0 HB THR A 107 -1.737 -0.333 -10.172 0.20 0.00 H new ATOM 0 HG1 THR A 107 -3.425 0.908 -8.327 0.37 0.00 H new ATOM 0 HG21 THR A 107 -3.843 -1.534 -10.635 1.00 0.00 H new ATOM 0 HG22 THR A 107 -2.661 -2.575 -9.806 1.00 0.00 H new ATOM 0 HG23 THR A 107 -4.024 -1.877 -8.898 1.00 0.00 H new ATOM 1696 N SER A 108 -1.308 1.464 -7.004 0.16 0.00 N ATOM 1697 CA SER A 108 -0.558 2.674 -6.680 0.07 0.00 C ATOM 1698 C SER A 108 0.690 2.347 -5.864 0.25 0.00 C ATOM 1699 O SER A 108 1.785 2.819 -6.171 0.81 0.00 O ATOM 1700 CB SER A 108 -1.442 3.657 -5.910 0.35 0.00 C ATOM 1701 OG SER A 108 -2.534 4.090 -6.702 0.29 0.00 O ATOM 0 H SER A 108 -2.232 1.413 -6.574 0.16 0.00 H new ATOM 0 HA SER A 108 -0.243 3.134 -7.617 0.07 0.00 H new ATOM 0 HB2 SER A 108 -1.813 3.182 -5.002 0.35 0.00 H new ATOM 0 HB3 SER A 108 -0.850 4.518 -5.600 0.35 0.00 H new ATOM 0 HG SER A 108 -3.187 3.364 -6.784 0.29 0.00 H new ATOM 1707 N ILE A 109 0.518 1.537 -4.823 0.09 0.00 N ATOM 1708 CA ILE A 109 1.631 1.149 -3.963 0.12 0.00 C ATOM 1709 C ILE A 109 2.593 0.217 -4.692 0.09 0.00 C ATOM 1710 O ILE A 109 3.810 0.321 -4.539 0.49 0.00 O ATOM 1711 CB ILE A 109 1.134 0.453 -2.681 0.10 0.00 C ATOM 1712 CG1 ILE A 109 0.098 1.325 -1.970 0.45 0.00 C ATOM 1713 CG2 ILE A 109 2.304 0.147 -1.755 1.00 0.00 C ATOM 1714 CD1 ILE A 109 -0.562 0.644 -0.790 0.93 0.00 C ATOM 0 H ILE A 109 -0.381 1.137 -4.555 0.09 0.00 H new ATOM 0 HA ILE A 109 2.154 2.066 -3.692 0.12 0.00 H new ATOM 0 HB ILE A 109 0.660 -0.489 -2.957 0.10 0.00 H new ATOM 0 HG12 ILE A 109 0.580 2.240 -1.627 0.45 0.00 H new ATOM 0 HG13 ILE A 109 -0.670 1.618 -2.686 0.45 0.00 H new ATOM 0 HG21 ILE A 109 1.936 -0.344 -0.854 1.00 0.00 H new ATOM 0 HG22 ILE A 109 3.009 -0.510 -2.264 1.00 0.00 H new ATOM 0 HG23 ILE A 109 2.805 1.076 -1.483 1.00 0.00 H new ATOM 0 HD11 ILE A 109 -1.284 1.322 -0.336 0.93 0.00 H new ATOM 0 HD12 ILE A 109 -1.074 -0.257 -1.129 0.93 0.00 H new ATOM 0 HD13 ILE A 109 0.196 0.375 -0.054 0.93 0.00 H new ATOM 1726 N GLN A 110 2.037 -0.695 -5.488 1.00 0.00 N ATOM 1727 CA GLN A 110 2.843 -1.651 -6.242 0.18 0.00 C ATOM 1728 C GLN A 110 3.814 -0.929 -7.173 0.09 0.00 C ATOM 1729 O GLN A 110 4.985 -1.298 -7.271 0.55 0.00 O ATOM 1730 CB GLN A 110 1.936 -2.584 -7.050 0.28 0.00 C ATOM 1731 CG GLN A 110 2.695 -3.593 -7.897 0.09 0.00 C ATOM 1732 CD GLN A 110 1.778 -4.465 -8.730 0.09 0.00 C ATOM 1733 OE1 GLN A 110 0.685 -4.047 -9.114 0.89 0.00 O ATOM 1734 NE2 GLN A 110 2.219 -5.683 -9.019 1.00 0.00 N ATOM 0 H GLN A 110 1.031 -0.791 -5.627 1.00 0.00 H new ATOM 0 HA GLN A 110 3.423 -2.243 -5.534 0.18 0.00 H new ATOM 0 HB2 GLN A 110 1.278 -3.120 -6.365 0.28 0.00 H new ATOM 0 HB3 GLN A 110 1.299 -1.984 -7.700 0.28 0.00 H new ATOM 0 HG2 GLN A 110 3.383 -3.063 -8.556 0.09 0.00 H new ATOM 0 HG3 GLN A 110 3.299 -4.226 -7.247 0.09 0.00 H new ATOM 0 HE21 GLN A 110 3.131 -5.989 -8.680 1.00 0.00 H new ATOM 0 HE22 GLN A 110 1.646 -6.313 -9.580 1.00 0.00 H new ATOM 1743 N SER A 111 3.315 0.092 -7.859 0.29 0.00 N ATOM 1744 CA SER A 111 4.133 0.868 -8.784 0.06 0.00 C ATOM 1745 C SER A 111 5.120 1.758 -8.033 0.56 0.00 C ATOM 1746 O SER A 111 6.205 2.056 -8.534 0.12 0.00 O ATOM 1747 CB SER A 111 3.244 1.723 -9.688 0.89 0.00 C ATOM 1748 OG SER A 111 2.460 2.627 -8.928 0.07 0.00 O ATOM 0 H SER A 111 2.346 0.403 -7.792 0.29 0.00 H new ATOM 0 HA SER A 111 4.701 0.169 -9.397 0.06 0.00 H new ATOM 0 HB2 SER A 111 3.864 2.278 -10.392 0.89 0.00 H new ATOM 0 HB3 SER A 111 2.592 1.078 -10.277 0.89 0.00 H new ATOM 0 HG SER A 111 2.479 2.363 -7.984 0.07 0.00 H new ATOM 1754 N LEU A 112 4.737 2.179 -6.831 0.42 0.00 N ATOM 1755 CA LEU A 112 5.584 3.043 -6.015 0.49 0.00 C ATOM 1756 C LEU A 112 6.911 2.355 -5.709 1.00 0.00 C ATOM 1757 O LEU A 112 7.957 3.003 -5.649 1.00 0.00 O ATOM 1758 CB LEU A 112 4.857 3.405 -4.711 0.06 0.00 C ATOM 1759 CG LEU A 112 5.260 4.739 -4.065 0.77 0.00 C ATOM 1760 CD1 LEU A 112 6.664 4.657 -3.488 0.08 0.00 C ATOM 1761 CD2 LEU A 112 5.160 5.880 -5.068 0.13 0.00 C ATOM 0 H LEU A 112 3.845 1.936 -6.400 0.42 0.00 H new ATOM 0 HA LEU A 112 5.792 3.958 -6.570 0.49 0.00 H new ATOM 0 HB2 LEU A 112 3.786 3.429 -4.910 0.06 0.00 H new ATOM 0 HB3 LEU A 112 5.029 2.607 -3.988 0.06 0.00 H new ATOM 0 HG LEU A 112 4.566 4.941 -3.249 0.77 0.00 H new ATOM 0 HD11 LEU A 112 6.928 5.613 -3.036 0.08 0.00 H new ATOM 0 HD12 LEU A 112 6.701 3.875 -2.730 0.08 0.00 H new ATOM 0 HD13 LEU A 112 7.371 4.425 -4.284 0.08 0.00 H new ATOM 0 HD21 LEU A 112 5.450 6.814 -4.587 0.13 0.00 H new ATOM 0 HD22 LEU A 112 5.824 5.684 -5.910 0.13 0.00 H new ATOM 0 HD23 LEU A 112 4.134 5.960 -5.427 0.13 0.00 H new ATOM 1773 N LEU A 113 6.859 1.041 -5.530 1.00 0.00 N ATOM 1774 CA LEU A 113 8.054 0.260 -5.231 1.00 0.00 C ATOM 1775 C LEU A 113 9.112 0.453 -6.308 0.23 0.00 C ATOM 1776 O LEU A 113 10.307 0.495 -6.018 1.00 0.00 O ATOM 1777 CB LEU A 113 7.710 -1.226 -5.130 1.00 0.00 C ATOM 1778 CG LEU A 113 6.356 -1.541 -4.499 1.00 0.00 C ATOM 1779 CD1 LEU A 113 6.125 -3.042 -4.472 0.07 0.00 C ATOM 1780 CD2 LEU A 113 6.271 -0.957 -3.100 0.08 0.00 C ATOM 0 H LEU A 113 6.001 0.492 -5.587 1.00 0.00 H new ATOM 0 HA LEU A 113 8.448 0.609 -4.277 1.00 0.00 H new ATOM 0 HB2 LEU A 113 7.735 -1.657 -6.131 1.00 0.00 H new ATOM 0 HB3 LEU A 113 8.487 -1.723 -4.550 1.00 0.00 H new ATOM 0 HG LEU A 113 5.574 -1.083 -5.105 1.00 0.00 H new ATOM 0 HD11 LEU A 113 5.156 -3.253 -4.020 0.07 0.00 H new ATOM 0 HD12 LEU A 113 6.143 -3.431 -5.490 0.07 0.00 H new ATOM 0 HD13 LEU A 113 6.910 -3.521 -3.887 0.07 0.00 H new ATOM 0 HD21 LEU A 113 5.299 -1.192 -2.666 0.08 0.00 H new ATOM 0 HD22 LEU A 113 7.058 -1.384 -2.479 0.08 0.00 H new ATOM 0 HD23 LEU A 113 6.395 0.125 -3.149 0.08 0.00 H new ATOM 1792 N ASP A 114 8.661 0.566 -7.552 1.00 0.00 N ATOM 1793 CA ASP A 114 9.570 0.740 -8.673 0.14 0.00 C ATOM 1794 C ASP A 114 10.429 1.988 -8.494 0.08 0.00 C ATOM 1795 O ASP A 114 11.658 1.917 -8.534 0.34 0.00 O ATOM 1796 CB ASP A 114 8.789 0.825 -9.987 0.26 0.00 C ATOM 1797 CG ASP A 114 9.700 0.898 -11.196 0.19 0.00 C ATOM 1798 OD1 ASP A 114 10.158 2.011 -11.528 0.81 0.00 O ATOM 1799 OD2 ASP A 114 9.955 -0.157 -11.812 0.77 0.00 O ATOM 0 H ASP A 114 7.674 0.540 -7.807 1.00 0.00 H new ATOM 0 HA ASP A 114 10.229 -0.128 -8.708 0.14 0.00 H new ATOM 0 HB2 ASP A 114 8.139 -0.045 -10.077 0.26 0.00 H new ATOM 0 HB3 ASP A 114 8.144 1.704 -9.967 0.26 0.00 H new ATOM 1804 N GLU A 115 9.777 3.131 -8.298 1.00 0.00 N ATOM 1805 CA GLU A 115 10.482 4.393 -8.114 0.11 0.00 C ATOM 1806 C GLU A 115 9.586 5.429 -7.430 0.05 0.00 C ATOM 1807 O GLU A 115 8.576 5.852 -7.996 0.43 0.00 O ATOM 1808 CB GLU A 115 10.968 4.928 -9.464 1.00 0.00 C ATOM 1809 CG GLU A 115 9.876 5.015 -10.518 0.78 0.00 C ATOM 1810 CD GLU A 115 10.395 5.506 -11.855 0.10 0.00 C ATOM 1811 OE1 GLU A 115 10.412 6.737 -12.069 0.69 0.00 O ATOM 1812 OE2 GLU A 115 10.786 4.662 -12.687 0.08 0.00 O ATOM 0 H GLU A 115 8.760 3.208 -8.263 1.00 0.00 H new ATOM 0 HA GLU A 115 11.343 4.210 -7.471 0.11 0.00 H new ATOM 0 HB2 GLU A 115 11.399 5.918 -9.318 1.00 0.00 H new ATOM 0 HB3 GLU A 115 11.766 4.284 -9.833 1.00 0.00 H new ATOM 0 HG2 GLU A 115 9.422 4.033 -10.647 0.78 0.00 H new ATOM 0 HG3 GLU A 115 9.091 5.686 -10.168 0.78 0.00 H new ATOM 1819 N PRO A 116 9.936 5.850 -6.199 0.29 0.00 N ATOM 1820 CA PRO A 116 9.149 6.843 -5.456 0.06 0.00 C ATOM 1821 C PRO A 116 9.299 8.249 -6.027 0.18 0.00 C ATOM 1822 O PRO A 116 9.735 8.426 -7.164 0.06 0.00 O ATOM 1823 CB PRO A 116 9.739 6.779 -4.047 0.82 0.00 C ATOM 1824 CG PRO A 116 11.140 6.316 -4.244 0.15 0.00 C ATOM 1825 CD PRO A 116 11.112 5.393 -5.430 0.25 0.00 C ATOM 0 HA PRO A 116 8.081 6.629 -5.499 0.06 0.00 H new ATOM 0 HB2 PRO A 116 9.709 7.754 -3.561 0.82 0.00 H new ATOM 0 HB3 PRO A 116 9.180 6.090 -3.414 0.82 0.00 H new ATOM 0 HG2 PRO A 116 11.807 7.159 -4.422 0.15 0.00 H new ATOM 0 HG3 PRO A 116 11.508 5.800 -3.357 0.15 0.00 H new ATOM 0 HD2 PRO A 116 12.028 5.466 -6.017 0.25 0.00 H new ATOM 0 HD3 PRO A 116 11.011 4.351 -5.125 0.25 0.00 H new ATOM 1833 N ASN A 117 8.929 9.244 -5.225 0.72 0.00 N ATOM 1834 CA ASN A 117 9.018 10.639 -5.642 1.00 0.00 C ATOM 1835 C ASN A 117 9.799 11.464 -4.617 0.11 0.00 C ATOM 1836 O ASN A 117 9.358 11.625 -3.480 0.08 0.00 O ATOM 1837 CB ASN A 117 7.615 11.224 -5.818 1.00 0.00 C ATOM 1838 CG ASN A 117 6.833 10.528 -6.915 0.11 0.00 C ATOM 1839 OD1 ASN A 117 7.405 10.044 -7.890 0.31 0.00 O ATOM 1840 ND2 ASN A 117 5.516 10.472 -6.757 0.30 0.00 N ATOM 0 H ASN A 117 8.564 9.109 -4.282 0.72 0.00 H new ATOM 0 HA ASN A 117 9.547 10.678 -6.594 1.00 0.00 H new ATOM 0 HB2 ASN A 117 7.069 11.142 -4.878 1.00 0.00 H new ATOM 0 HB3 ASN A 117 7.693 12.286 -6.049 1.00 0.00 H new ATOM 0 HD21 ASN A 117 4.937 10.014 -7.461 0.30 0.00 H new ATOM 0 HD22 ASN A 117 5.083 10.887 -5.932 0.30 0.00 H new ATOM 1847 N PRO A 118 10.978 11.998 -5.003 0.40 0.00 N ATOM 1848 CA PRO A 118 11.808 12.803 -4.103 0.64 0.00 C ATOM 1849 C PRO A 118 11.298 14.234 -3.957 0.18 0.00 C ATOM 1850 O PRO A 118 12.011 15.108 -3.461 0.29 0.00 O ATOM 1851 CB PRO A 118 13.170 12.790 -4.792 1.00 0.00 C ATOM 1852 CG PRO A 118 12.849 12.690 -6.243 0.24 0.00 C ATOM 1853 CD PRO A 118 11.596 11.856 -6.337 0.06 0.00 C ATOM 0 HA PRO A 118 11.817 12.406 -3.088 0.64 0.00 H new ATOM 0 HB2 PRO A 118 13.736 13.695 -4.571 1.00 0.00 H new ATOM 0 HB3 PRO A 118 13.776 11.947 -4.460 1.00 0.00 H new ATOM 0 HG2 PRO A 118 12.693 13.678 -6.677 0.24 0.00 H new ATOM 0 HG3 PRO A 118 13.668 12.226 -6.792 0.24 0.00 H new ATOM 0 HD2 PRO A 118 10.934 12.216 -7.125 0.06 0.00 H new ATOM 0 HD3 PRO A 118 11.825 10.815 -6.563 0.06 0.00 H new ATOM 1861 N ASN A 119 10.064 14.468 -4.393 0.86 0.00 N ATOM 1862 CA ASN A 119 9.462 15.794 -4.308 0.35 0.00 C ATOM 1863 C ASN A 119 9.412 16.275 -2.862 1.00 0.00 C ATOM 1864 O ASN A 119 9.859 17.379 -2.549 1.00 0.00 O ATOM 1865 CB ASN A 119 8.050 15.773 -4.901 0.38 0.00 C ATOM 1866 CG ASN A 119 7.368 17.128 -4.833 0.48 0.00 C ATOM 1867 OD1 ASN A 119 8.155 18.196 -4.923 0.23 0.00 O flip ATOM 1868 ND2 ASN A 119 6.148 17.213 -4.706 0.46 0.00 N flip ATOM 0 H ASN A 119 9.462 13.757 -4.808 0.86 0.00 H new ATOM 0 HA ASN A 119 10.079 16.486 -4.881 0.35 0.00 H new ATOM 0 HB2 ASN A 119 8.101 15.448 -5.940 0.38 0.00 H new ATOM 0 HB3 ASN A 119 7.446 15.039 -4.367 0.38 0.00 H new ATOM 0 HD21 ASN A 119 5.582 16.367 -4.641 0.46 0.00 H new ATOM 0 HD22 ASN A 119 5.702 18.129 -4.666 0.46 0.00 H new ATOM 1875 N SER A 120 8.867 15.438 -1.986 0.57 0.00 N ATOM 1876 CA SER A 120 8.762 15.772 -0.570 0.61 0.00 C ATOM 1877 C SER A 120 9.226 14.602 0.296 0.06 0.00 C ATOM 1878 O SER A 120 8.414 13.796 0.750 0.08 0.00 O ATOM 1879 CB SER A 120 7.319 16.144 -0.219 0.42 0.00 C ATOM 1880 OG SER A 120 6.893 17.281 -0.952 0.51 0.00 O ATOM 0 H SER A 120 8.491 14.522 -2.232 0.57 0.00 H new ATOM 0 HA SER A 120 9.407 16.628 -0.371 0.61 0.00 H new ATOM 0 HB2 SER A 120 6.661 15.302 -0.433 0.42 0.00 H new ATOM 0 HB3 SER A 120 7.242 16.346 0.849 0.42 0.00 H new ATOM 0 HG SER A 120 5.968 17.498 -0.711 0.51 0.00 H new ATOM 1886 N PRO A 121 10.548 14.487 0.527 1.00 0.00 N ATOM 1887 CA PRO A 121 11.120 13.406 1.340 1.00 0.00 C ATOM 1888 C PRO A 121 10.507 13.338 2.735 1.00 0.00 C ATOM 1889 O PRO A 121 10.630 14.275 3.524 0.41 0.00 O ATOM 1890 CB PRO A 121 12.605 13.764 1.430 1.00 0.00 C ATOM 1891 CG PRO A 121 12.862 14.630 0.248 0.11 0.00 C ATOM 1892 CD PRO A 121 11.590 15.395 0.012 1.00 0.00 C ATOM 0 HA PRO A 121 10.931 12.428 0.897 1.00 0.00 H new ATOM 0 HB2 PRO A 121 12.830 14.287 2.359 1.00 0.00 H new ATOM 0 HB3 PRO A 121 13.229 12.870 1.408 1.00 0.00 H new ATOM 0 HG2 PRO A 121 13.696 15.307 0.434 0.11 0.00 H new ATOM 0 HG3 PRO A 121 13.125 14.032 -0.624 0.11 0.00 H new ATOM 0 HD2 PRO A 121 11.590 16.348 0.540 1.00 0.00 H new ATOM 0 HD3 PRO A 121 11.444 15.617 -1.045 1.00 0.00 H new ATOM 1900 N ALA A 122 9.848 12.222 3.031 0.48 0.00 N ATOM 1901 CA ALA A 122 9.221 12.026 4.333 0.25 0.00 C ATOM 1902 C ALA A 122 10.250 11.569 5.363 0.65 0.00 C ATOM 1903 O ALA A 122 10.265 12.051 6.496 0.08 0.00 O ATOM 1904 CB ALA A 122 8.086 11.017 4.228 0.08 0.00 C ATOM 0 H ALA A 122 9.734 11.440 2.386 0.48 0.00 H new ATOM 0 HA ALA A 122 8.808 12.979 4.663 0.25 0.00 H new ATOM 0 HB1 ALA A 122 7.628 10.881 5.208 0.08 0.00 H new ATOM 0 HB2 ALA A 122 7.338 11.383 3.525 0.08 0.00 H new ATOM 0 HB3 ALA A 122 8.479 10.063 3.876 0.08 0.00 H new ATOM 1910 N ASN A 123 11.108 10.637 4.957 0.51 0.00 N ATOM 1911 CA ASN A 123 12.146 10.115 5.839 0.08 0.00 C ATOM 1912 C ASN A 123 13.511 10.680 5.450 0.06 0.00 C ATOM 1913 O ASN A 123 14.053 10.349 4.395 0.17 0.00 O ATOM 1914 CB ASN A 123 12.177 8.586 5.782 0.78 0.00 C ATOM 1915 CG ASN A 123 13.100 7.984 6.824 0.95 0.00 C ATOM 1916 OD1 ASN A 123 13.710 6.940 6.598 0.08 0.00 O ATOM 1917 ND2 ASN A 123 13.200 8.635 7.978 0.09 0.00 N ATOM 0 H ASN A 123 11.104 10.228 4.023 0.51 0.00 H new ATOM 0 HA ASN A 123 11.916 10.424 6.859 0.08 0.00 H new ATOM 0 HB2 ASN A 123 11.168 8.200 5.928 0.78 0.00 H new ATOM 0 HB3 ASN A 123 12.499 8.269 4.790 0.78 0.00 H new ATOM 0 HD21 ASN A 123 13.801 8.272 8.718 0.09 0.00 H new ATOM 0 HD22 ASN A 123 12.676 9.498 8.124 0.09 0.00 H new ATOM 1924 N SER A 124 14.057 11.534 6.309 1.00 0.00 N ATOM 1925 CA SER A 124 15.354 12.154 6.055 1.00 0.00 C ATOM 1926 C SER A 124 16.494 11.144 6.177 0.85 0.00 C ATOM 1927 O SER A 124 17.539 11.300 5.548 0.13 0.00 O ATOM 1928 CB SER A 124 15.585 13.314 7.026 1.00 0.00 C ATOM 1929 OG SER A 124 14.597 14.317 6.866 0.82 0.00 O ATOM 0 H SER A 124 13.622 11.813 7.188 1.00 0.00 H new ATOM 0 HA SER A 124 15.344 12.531 5.032 1.00 0.00 H new ATOM 0 HB2 SER A 124 15.569 12.943 8.051 1.00 0.00 H new ATOM 0 HB3 SER A 124 16.573 13.742 6.858 1.00 0.00 H new ATOM 0 HG SER A 124 14.766 15.046 7.499 0.82 0.00 H new ATOM 1935 N GLN A 125 16.287 10.110 6.988 1.00 0.00 N ATOM 1936 CA GLN A 125 17.308 9.086 7.192 0.27 0.00 C ATOM 1937 C GLN A 125 17.505 8.238 5.939 0.15 0.00 C ATOM 1938 O GLN A 125 18.625 8.098 5.448 0.18 0.00 O ATOM 1939 CB GLN A 125 16.932 8.188 8.374 0.17 0.00 C ATOM 1940 CG GLN A 125 17.950 7.093 8.656 1.00 0.00 C ATOM 1941 CD GLN A 125 17.526 6.180 9.792 1.00 0.00 C ATOM 1942 OE1 GLN A 125 16.824 6.600 10.711 1.00 0.00 O ATOM 1943 NE2 GLN A 125 17.951 4.923 9.731 0.40 0.00 N ATOM 0 H GLN A 125 15.425 9.959 7.513 1.00 0.00 H new ATOM 0 HA GLN A 125 18.247 9.594 7.410 0.27 0.00 H new ATOM 0 HB2 GLN A 125 16.818 8.804 9.266 0.17 0.00 H new ATOM 0 HB3 GLN A 125 15.963 7.729 8.177 0.17 0.00 H new ATOM 0 HG2 GLN A 125 18.099 6.499 7.754 1.00 0.00 H new ATOM 0 HG3 GLN A 125 18.910 7.548 8.900 1.00 0.00 H new ATOM 0 HE21 GLN A 125 18.532 4.618 8.950 0.40 0.00 H new ATOM 0 HE22 GLN A 125 17.697 4.262 10.465 0.40 0.00 H new ATOM 1952 N ALA A 126 16.414 7.681 5.426 0.13 0.00 N ATOM 1953 CA ALA A 126 16.475 6.837 4.236 0.58 0.00 C ATOM 1954 C ALA A 126 16.978 7.613 3.023 1.00 0.00 C ATOM 1955 O ALA A 126 17.939 7.201 2.370 0.52 0.00 O ATOM 1956 CB ALA A 126 15.109 6.234 3.950 1.00 0.00 C ATOM 0 H ALA A 126 15.478 7.798 5.814 0.13 0.00 H new ATOM 0 HA ALA A 126 17.185 6.034 4.432 0.58 0.00 H new ATOM 0 HB1 ALA A 126 15.167 5.607 3.060 1.00 0.00 H new ATOM 0 HB2 ALA A 126 14.793 5.630 4.800 1.00 0.00 H new ATOM 0 HB3 ALA A 126 14.386 7.033 3.784 1.00 0.00 H new ATOM 1962 N ALA A 127 16.325 8.729 2.722 0.79 0.00 N ATOM 1963 CA ALA A 127 16.705 9.561 1.585 1.00 0.00 C ATOM 1964 C ALA A 127 18.183 9.938 1.634 0.58 0.00 C ATOM 1965 O ALA A 127 18.836 10.056 0.596 1.00 0.00 O ATOM 1966 CB ALA A 127 15.845 10.815 1.540 0.12 0.00 C ATOM 0 H ALA A 127 15.527 9.080 3.251 0.79 0.00 H new ATOM 0 HA ALA A 127 16.539 8.979 0.678 1.00 0.00 H new ATOM 0 HB1 ALA A 127 16.139 11.427 0.687 0.12 0.00 H new ATOM 0 HB2 ALA A 127 14.797 10.534 1.441 0.12 0.00 H new ATOM 0 HB3 ALA A 127 15.983 11.384 2.459 0.12 0.00 H new ATOM 1972 N GLN A 128 18.709 10.123 2.841 1.00 0.00 N ATOM 1973 CA GLN A 128 20.109 10.494 3.017 0.22 0.00 C ATOM 1974 C GLN A 128 21.035 9.313 2.744 0.08 0.00 C ATOM 1975 O GLN A 128 22.127 9.482 2.205 0.61 0.00 O ATOM 1976 CB GLN A 128 20.349 11.024 4.432 0.77 0.00 C ATOM 1977 CG GLN A 128 21.788 11.447 4.682 0.91 0.00 C ATOM 1978 CD GLN A 128 21.997 12.020 6.069 0.06 0.00 C ATOM 1979 OE1 GLN A 128 21.301 11.652 7.016 0.06 0.00 O ATOM 1980 NE2 GLN A 128 22.962 12.923 6.195 0.73 0.00 N ATOM 0 H GLN A 128 18.187 10.022 3.711 1.00 0.00 H new ATOM 0 HA GLN A 128 20.334 11.280 2.296 0.22 0.00 H new ATOM 0 HB2 GLN A 128 19.692 11.875 4.610 0.77 0.00 H new ATOM 0 HB3 GLN A 128 20.074 10.253 5.152 0.77 0.00 H new ATOM 0 HG2 GLN A 128 22.444 10.587 4.546 0.91 0.00 H new ATOM 0 HG3 GLN A 128 22.078 12.190 3.939 0.91 0.00 H new ATOM 0 HE21 GLN A 128 23.513 13.197 5.382 0.73 0.00 H new ATOM 0 HE22 GLN A 128 23.152 13.343 7.105 0.73 0.00 H new ATOM 1989 N LEU A 129 20.596 8.118 3.124 1.00 0.00 N ATOM 1990 CA LEU A 129 21.392 6.911 2.923 0.08 0.00 C ATOM 1991 C LEU A 129 21.608 6.632 1.438 0.23 0.00 C ATOM 1992 O LEU A 129 22.603 6.018 1.053 1.00 0.00 O ATOM 1993 CB LEU A 129 20.712 5.711 3.584 0.10 0.00 C ATOM 1994 CG LEU A 129 20.671 5.748 5.114 0.08 0.00 C ATOM 1995 CD1 LEU A 129 19.766 4.650 5.650 0.97 0.00 C ATOM 1996 CD2 LEU A 129 22.075 5.614 5.687 0.89 0.00 C ATOM 0 H LEU A 129 19.694 7.958 3.573 1.00 0.00 H new ATOM 0 HA LEU A 129 22.366 7.072 3.386 0.08 0.00 H new ATOM 0 HB2 LEU A 129 19.690 5.641 3.210 0.10 0.00 H new ATOM 0 HB3 LEU A 129 21.228 4.803 3.272 0.10 0.00 H new ATOM 0 HG LEU A 129 20.263 6.710 5.426 0.08 0.00 H new ATOM 0 HD11 LEU A 129 19.749 4.692 6.739 0.97 0.00 H new ATOM 0 HD12 LEU A 129 18.756 4.791 5.266 0.97 0.00 H new ATOM 0 HD13 LEU A 129 20.143 3.679 5.330 0.97 0.00 H new ATOM 0 HD21 LEU A 129 22.028 5.642 6.776 0.89 0.00 H new ATOM 0 HD22 LEU A 129 22.510 4.667 5.367 0.89 0.00 H new ATOM 0 HD23 LEU A 129 22.694 6.437 5.329 0.89 0.00 H new ATOM 2008 N TYR A 130 20.676 7.088 0.610 1.00 0.00 N ATOM 2009 CA TYR A 130 20.761 6.875 -0.832 0.05 0.00 C ATOM 2010 C TYR A 130 21.919 7.655 -1.449 0.17 0.00 C ATOM 2011 O TYR A 130 22.524 7.209 -2.424 0.62 0.00 O ATOM 2012 CB TYR A 130 19.446 7.277 -1.503 0.74 0.00 C ATOM 2013 CG TYR A 130 19.428 7.045 -2.998 0.24 0.00 C ATOM 2014 CD1 TYR A 130 19.080 5.807 -3.524 0.38 0.00 C ATOM 2015 CD2 TYR A 130 19.760 8.064 -3.883 1.00 0.00 C ATOM 2016 CE1 TYR A 130 19.063 5.590 -4.889 0.80 0.00 C ATOM 2017 CE2 TYR A 130 19.746 7.855 -5.249 0.57 0.00 C ATOM 2018 CZ TYR A 130 19.396 6.617 -5.747 1.00 0.00 C ATOM 2019 OH TYR A 130 19.380 6.406 -7.108 1.00 0.00 O ATOM 0 H TYR A 130 19.852 7.608 0.911 1.00 0.00 H new ATOM 0 HA TYR A 130 20.945 5.814 -0.999 0.05 0.00 H new ATOM 0 HB2 TYR A 130 18.630 6.716 -1.048 0.74 0.00 H new ATOM 0 HB3 TYR A 130 19.256 8.332 -1.306 0.74 0.00 H new ATOM 0 HD1 TYR A 130 18.818 5.001 -2.855 0.38 0.00 H new ATOM 0 HD2 TYR A 130 20.033 9.035 -3.497 1.00 0.00 H new ATOM 0 HE1 TYR A 130 18.790 4.621 -5.281 0.80 0.00 H new ATOM 0 HE2 TYR A 130 20.008 8.657 -5.923 0.57 0.00 H new ATOM 0 HH TYR A 130 19.639 7.231 -7.570 1.00 0.00 H new ATOM 2029 N GLN A 131 22.227 8.818 -0.881 0.22 0.00 N ATOM 2030 CA GLN A 131 23.307 9.654 -1.397 0.17 0.00 C ATOM 2031 C GLN A 131 24.596 9.462 -0.602 0.25 0.00 C ATOM 2032 O GLN A 131 25.690 9.701 -1.116 0.12 0.00 O ATOM 2033 CB GLN A 131 22.895 11.127 -1.369 0.07 0.00 C ATOM 2034 CG GLN A 131 22.571 11.644 0.023 1.00 0.00 C ATOM 2035 CD GLN A 131 22.194 13.113 0.029 0.13 0.00 C ATOM 2036 OE1 GLN A 131 21.022 13.466 -0.108 0.13 0.00 O ATOM 2037 NE2 GLN A 131 23.188 13.978 0.189 1.00 0.00 N ATOM 0 H GLN A 131 21.747 9.202 -0.067 0.22 0.00 H new ATOM 0 HA GLN A 131 23.497 9.349 -2.426 0.17 0.00 H new ATOM 0 HB2 GLN A 131 23.700 11.728 -1.792 0.07 0.00 H new ATOM 0 HB3 GLN A 131 22.024 11.264 -2.010 0.07 0.00 H new ATOM 0 HG2 GLN A 131 21.750 11.061 0.441 1.00 0.00 H new ATOM 0 HG3 GLN A 131 23.433 11.492 0.672 1.00 0.00 H new ATOM 0 HE21 GLN A 131 24.144 13.641 0.299 1.00 0.00 H new ATOM 0 HE22 GLN A 131 22.995 14.980 0.202 1.00 0.00 H new ATOM 2046 N GLU A 132 24.466 9.034 0.648 1.00 0.00 N ATOM 2047 CA GLU A 132 25.626 8.822 1.507 1.00 0.00 C ATOM 2048 C GLU A 132 26.158 7.399 1.376 1.00 0.00 C ATOM 2049 O GLU A 132 27.128 7.152 0.657 0.19 0.00 O ATOM 2050 CB GLU A 132 25.267 9.107 2.966 0.11 0.00 C ATOM 2051 CG GLU A 132 24.895 10.557 3.228 0.83 0.00 C ATOM 2052 CD GLU A 132 26.046 11.509 2.965 0.25 0.00 C ATOM 2053 OE1 GLU A 132 26.191 11.958 1.809 1.00 0.00 O ATOM 2054 OE2 GLU A 132 26.800 11.807 3.914 0.73 0.00 O ATOM 0 H GLU A 132 23.570 8.827 1.090 1.00 0.00 H new ATOM 0 HA GLU A 132 26.407 9.512 1.187 1.00 0.00 H new ATOM 0 HB2 GLU A 132 24.433 8.468 3.258 0.11 0.00 H new ATOM 0 HB3 GLU A 132 26.112 8.837 3.599 0.11 0.00 H new ATOM 0 HG2 GLU A 132 24.050 10.831 2.597 0.83 0.00 H new ATOM 0 HG3 GLU A 132 24.569 10.664 4.263 0.83 0.00 H new ATOM 2061 N ASN A 133 25.517 6.469 2.075 0.72 0.00 N ATOM 2062 CA ASN A 133 25.926 5.071 2.045 0.82 0.00 C ATOM 2063 C ASN A 133 24.946 4.238 1.227 1.00 0.00 C ATOM 2064 O ASN A 133 23.943 3.750 1.749 1.00 0.00 O ATOM 2065 CB ASN A 133 26.020 4.522 3.468 0.09 0.00 C ATOM 2066 CG ASN A 133 27.144 5.159 4.261 0.96 0.00 C ATOM 2067 OD1 ASN A 133 26.949 6.171 4.935 1.00 0.00 O ATOM 2068 ND2 ASN A 133 28.332 4.568 4.185 0.78 0.00 N ATOM 0 H ASN A 133 24.711 6.659 2.670 0.72 0.00 H new ATOM 0 HA ASN A 133 26.907 5.010 1.573 0.82 0.00 H new ATOM 0 HB2 ASN A 133 25.074 4.692 3.983 0.09 0.00 H new ATOM 0 HB3 ASN A 133 26.173 3.443 3.429 0.09 0.00 H new ATOM 0 HD21 ASN A 133 29.126 4.952 4.697 0.78 0.00 H new ATOM 0 HD22 ASN A 133 28.450 3.731 3.614 0.78 0.00 H new ATOM 2075 N LYS A 134 25.241 4.083 -0.060 0.16 0.00 N ATOM 2076 CA LYS A 134 24.387 3.311 -0.953 1.00 0.00 C ATOM 2077 C LYS A 134 24.352 1.846 -0.535 1.00 0.00 C ATOM 2078 O LYS A 134 23.317 1.187 -0.634 0.76 0.00 O ATOM 2079 CB LYS A 134 24.875 3.435 -2.396 1.00 0.00 C ATOM 2080 CG LYS A 134 24.866 4.861 -2.922 0.06 0.00 C ATOM 2081 CD LYS A 134 25.241 4.922 -4.396 0.41 0.00 C ATOM 2082 CE LYS A 134 26.682 4.499 -4.629 0.97 0.00 C ATOM 2083 NZ LYS A 134 27.046 4.541 -6.072 0.13 0.00 N ATOM 0 H LYS A 134 26.066 4.483 -0.507 0.16 0.00 H new ATOM 0 HA LYS A 134 23.376 3.712 -0.888 1.00 0.00 H new ATOM 0 HB2 LYS A 134 25.888 3.038 -2.463 1.00 0.00 H new ATOM 0 HB3 LYS A 134 24.247 2.816 -3.037 1.00 0.00 H new ATOM 0 HG2 LYS A 134 23.876 5.294 -2.781 0.06 0.00 H new ATOM 0 HG3 LYS A 134 25.564 5.466 -2.344 0.06 0.00 H new ATOM 0 HD2 LYS A 134 24.575 4.275 -4.968 0.41 0.00 H new ATOM 0 HD3 LYS A 134 25.095 5.937 -4.767 0.41 0.00 H new ATOM 0 HE2 LYS A 134 27.348 5.154 -4.067 0.97 0.00 H new ATOM 0 HE3 LYS A 134 26.830 3.489 -4.246 0.97 0.00 H new ATOM 0 HZ1 LYS A 134 28.036 4.246 -6.189 0.13 0.00 H new ATOM 0 HZ2 LYS A 134 26.427 3.897 -6.605 0.13 0.00 H new ATOM 0 HZ3 LYS A 134 26.929 5.510 -6.431 0.13 0.00 H new ATOM 2097 N ARG A 135 25.489 1.342 -0.067 0.07 0.00 N ATOM 2098 CA ARG A 135 25.589 -0.046 0.366 0.14 0.00 C ATOM 2099 C ARG A 135 24.671 -0.310 1.555 0.69 0.00 C ATOM 2100 O ARG A 135 24.109 -1.397 1.688 0.74 0.00 O ATOM 2101 CB ARG A 135 27.035 -0.384 0.738 0.86 0.00 C ATOM 2102 CG ARG A 135 28.028 -0.118 -0.382 0.42 0.00 C ATOM 2103 CD ARG A 135 29.442 -0.501 0.025 1.00 0.00 C ATOM 2104 NE ARG A 135 29.561 -1.925 0.323 0.26 0.00 N ATOM 2105 CZ ARG A 135 30.720 -2.534 0.564 0.10 0.00 C ATOM 2106 NH1 ARG A 135 31.853 -1.845 0.538 0.46 0.00 N ATOM 2107 NH2 ARG A 135 30.745 -3.832 0.831 1.00 0.00 N ATOM 0 H ARG A 135 26.354 1.875 0.022 0.07 0.00 H new ATOM 0 HA ARG A 135 25.276 -0.683 -0.461 0.14 0.00 H new ATOM 0 HB2 ARG A 135 27.322 0.199 1.613 0.86 0.00 H new ATOM 0 HB3 ARG A 135 27.093 -1.435 1.022 0.86 0.00 H new ATOM 0 HG2 ARG A 135 27.738 -0.682 -1.268 0.42 0.00 H new ATOM 0 HG3 ARG A 135 27.999 0.938 -0.652 0.42 0.00 H new ATOM 0 HD2 ARG A 135 30.133 -0.240 -0.777 1.00 0.00 H new ATOM 0 HD3 ARG A 135 29.736 0.078 0.900 1.00 0.00 H new ATOM 0 HE ARG A 135 28.709 -2.485 0.348 0.26 0.00 H new ATOM 0 HH11 ARG A 135 31.838 -0.846 0.333 0.46 0.00 H new ATOM 0 HH12 ARG A 135 32.740 -2.314 0.723 0.46 0.00 H new ATOM 0 HH21 ARG A 135 29.876 -4.365 0.852 1.00 0.00 H new ATOM 0 HH22 ARG A 135 31.634 -4.298 1.015 1.00 0.00 H new ATOM 2121 N GLU A 136 24.519 0.693 2.414 0.23 0.00 N ATOM 2122 CA GLU A 136 23.670 0.567 3.594 0.51 0.00 C ATOM 2123 C GLU A 136 22.198 0.512 3.198 0.12 0.00 C ATOM 2124 O GLU A 136 21.377 -0.074 3.907 0.97 0.00 O ATOM 2125 CB GLU A 136 23.912 1.738 4.549 1.00 0.00 C ATOM 2126 CG GLU A 136 23.162 1.614 5.866 0.07 0.00 C ATOM 2127 CD GLU A 136 23.591 0.402 6.670 1.00 0.00 C ATOM 2128 OE1 GLU A 136 24.629 0.483 7.360 1.00 0.00 O ATOM 2129 OE2 GLU A 136 22.888 -0.629 6.610 1.00 0.00 O ATOM 0 H GLU A 136 24.972 1.601 2.315 0.23 0.00 H new ATOM 0 HA GLU A 136 23.927 -0.363 4.101 0.51 0.00 H new ATOM 0 HB2 GLU A 136 24.980 1.814 4.754 1.00 0.00 H new ATOM 0 HB3 GLU A 136 23.615 2.664 4.057 1.00 0.00 H new ATOM 0 HG2 GLU A 136 23.325 2.514 6.458 0.07 0.00 H new ATOM 0 HG3 GLU A 136 22.092 1.553 5.666 0.07 0.00 H new ATOM 2136 N TYR A 137 21.871 1.122 2.065 1.00 0.00 N ATOM 2137 CA TYR A 137 20.498 1.147 1.575 0.17 0.00 C ATOM 2138 C TYR A 137 20.107 -0.199 0.968 0.46 0.00 C ATOM 2139 O TYR A 137 19.002 -0.693 1.194 1.00 0.00 O ATOM 2140 CB TYR A 137 20.327 2.257 0.535 0.15 0.00 C ATOM 2141 CG TYR A 137 18.914 2.387 0.008 1.00 0.00 C ATOM 2142 CD1 TYR A 137 17.943 3.066 0.735 0.39 0.00 C ATOM 2143 CD2 TYR A 137 18.552 1.834 -1.213 0.08 0.00 C ATOM 2144 CE1 TYR A 137 16.652 3.189 0.258 0.87 0.00 C ATOM 2145 CE2 TYR A 137 17.263 1.953 -1.697 0.07 0.00 C ATOM 2146 CZ TYR A 137 16.316 2.630 -0.956 0.08 0.00 C ATOM 2147 OH TYR A 137 15.031 2.749 -1.433 0.20 0.00 O ATOM 0 H TYR A 137 22.540 1.607 1.467 1.00 0.00 H new ATOM 0 HA TYR A 137 19.842 1.345 2.422 0.17 0.00 H new ATOM 0 HB2 TYR A 137 20.629 3.206 0.977 0.15 0.00 H new ATOM 0 HB3 TYR A 137 21.001 2.066 -0.301 0.15 0.00 H new ATOM 0 HD1 TYR A 137 18.202 3.504 1.688 0.39 0.00 H new ATOM 0 HD2 TYR A 137 19.290 1.302 -1.794 0.08 0.00 H new ATOM 0 HE1 TYR A 137 15.909 3.721 0.834 0.87 0.00 H new ATOM 0 HE2 TYR A 137 16.998 1.519 -2.650 0.07 0.00 H new ATOM 0 HH TYR A 137 14.962 2.300 -2.301 0.20 0.00 H new ATOM 2157 N GLU A 138 21.019 -0.787 0.202 0.92 0.00 N ATOM 2158 CA GLU A 138 20.769 -2.073 -0.442 0.19 0.00 C ATOM 2159 C GLU A 138 20.603 -3.183 0.591 1.00 0.00 C ATOM 2160 O GLU A 138 19.685 -3.998 0.499 1.00 0.00 O ATOM 2161 CB GLU A 138 21.916 -2.424 -1.392 0.13 0.00 C ATOM 2162 CG GLU A 138 22.223 -1.335 -2.405 0.06 0.00 C ATOM 2163 CD GLU A 138 23.318 -1.731 -3.375 1.00 0.00 C ATOM 2164 OE1 GLU A 138 23.004 -2.394 -4.385 0.72 0.00 O ATOM 2165 OE2 GLU A 138 24.489 -1.376 -3.127 0.28 0.00 O ATOM 0 H GLU A 138 21.940 -0.393 0.011 0.92 0.00 H new ATOM 0 HA GLU A 138 19.843 -1.986 -1.010 0.19 0.00 H new ATOM 0 HB2 GLU A 138 22.813 -2.626 -0.806 0.13 0.00 H new ATOM 0 HB3 GLU A 138 21.668 -3.343 -1.923 0.13 0.00 H new ATOM 0 HG2 GLU A 138 21.317 -1.098 -2.963 0.06 0.00 H new ATOM 0 HG3 GLU A 138 22.520 -0.428 -1.879 0.06 0.00 H new ATOM 2172 N LYS A 139 21.496 -3.206 1.573 1.00 0.00 N ATOM 2173 CA LYS A 139 21.458 -4.219 2.622 0.18 0.00 C ATOM 2174 C LYS A 139 20.152 -4.156 3.407 0.96 0.00 C ATOM 2175 O LYS A 139 19.572 -5.188 3.748 0.11 0.00 O ATOM 2176 CB LYS A 139 22.645 -4.040 3.570 0.14 0.00 C ATOM 2177 CG LYS A 139 23.995 -4.213 2.891 0.05 0.00 C ATOM 2178 CD LYS A 139 24.235 -5.659 2.487 0.78 0.00 C ATOM 2179 CE LYS A 139 25.629 -5.853 1.916 0.08 0.00 C ATOM 2180 NZ LYS A 139 26.686 -5.494 2.902 0.35 0.00 N ATOM 0 H LYS A 139 22.257 -2.533 1.665 1.00 0.00 H new ATOM 0 HA LYS A 139 21.520 -5.197 2.145 0.18 0.00 H new ATOM 0 HB2 LYS A 139 22.596 -3.047 4.017 0.14 0.00 H new ATOM 0 HB3 LYS A 139 22.562 -4.760 4.384 0.14 0.00 H new ATOM 0 HG2 LYS A 139 24.044 -3.575 2.009 0.05 0.00 H new ATOM 0 HG3 LYS A 139 24.787 -3.886 3.565 0.05 0.00 H new ATOM 0 HD2 LYS A 139 24.102 -6.307 3.353 0.78 0.00 H new ATOM 0 HD3 LYS A 139 23.493 -5.959 1.748 0.78 0.00 H new ATOM 0 HE2 LYS A 139 25.755 -6.892 1.610 0.08 0.00 H new ATOM 0 HE3 LYS A 139 25.744 -5.241 1.021 0.08 0.00 H new ATOM 0 HZ1 LYS A 139 27.587 -5.928 2.618 0.35 0.00 H new ATOM 0 HZ2 LYS A 139 26.794 -4.460 2.934 0.35 0.00 H new ATOM 0 HZ3 LYS A 139 26.415 -5.843 3.844 0.35 0.00 H new ATOM 2194 N ARG A 140 19.694 -2.941 3.695 0.18 0.00 N ATOM 2195 CA ARG A 140 18.457 -2.747 4.442 0.17 0.00 C ATOM 2196 C ARG A 140 17.281 -3.406 3.730 0.31 0.00 C ATOM 2197 O ARG A 140 16.393 -3.971 4.368 1.00 0.00 O ATOM 2198 CB ARG A 140 18.179 -1.255 4.636 0.63 0.00 C ATOM 2199 CG ARG A 140 16.955 -0.968 5.493 0.80 0.00 C ATOM 2200 CD ARG A 140 17.163 -1.407 6.932 0.13 0.00 C ATOM 2201 NE ARG A 140 18.204 -0.626 7.597 1.00 0.00 N ATOM 2202 CZ ARG A 140 18.597 -0.834 8.851 0.55 0.00 C ATOM 2203 NH1 ARG A 140 18.044 -1.799 9.572 0.26 0.00 N ATOM 2204 NH2 ARG A 140 19.544 -0.075 9.383 0.38 0.00 N ATOM 0 H ARG A 140 20.162 -2.077 3.422 0.18 0.00 H new ATOM 0 HA ARG A 140 18.577 -3.216 5.418 0.17 0.00 H new ATOM 0 HB2 ARG A 140 19.051 -0.789 5.095 0.63 0.00 H new ATOM 0 HB3 ARG A 140 18.045 -0.789 3.660 0.63 0.00 H new ATOM 0 HG2 ARG A 140 16.734 0.099 5.466 0.80 0.00 H new ATOM 0 HG3 ARG A 140 16.090 -1.484 5.076 0.80 0.00 H new ATOM 0 HD2 ARG A 140 16.227 -1.305 7.481 0.13 0.00 H new ATOM 0 HD3 ARG A 140 17.432 -2.463 6.954 0.13 0.00 H new ATOM 0 HE ARG A 140 18.655 0.121 7.070 1.00 0.00 H new ATOM 0 HH11 ARG A 140 17.315 -2.385 9.166 0.26 0.00 H new ATOM 0 HH12 ARG A 140 18.348 -1.956 10.533 0.26 0.00 H new ATOM 0 HH21 ARG A 140 19.972 0.669 8.831 0.38 0.00 H new ATOM 0 HH22 ARG A 140 19.845 -0.234 10.344 0.38 0.00 H new ATOM 2218 N VAL A 141 17.282 -3.328 2.403 0.11 0.00 N ATOM 2219 CA VAL A 141 16.218 -3.919 1.600 0.18 0.00 C ATOM 2220 C VAL A 141 16.144 -5.427 1.819 0.06 0.00 C ATOM 2221 O VAL A 141 15.064 -5.989 1.982 1.00 0.00 O ATOM 2222 CB VAL A 141 16.422 -3.630 0.099 0.07 0.00 C ATOM 2223 CG1 VAL A 141 15.371 -4.342 -0.739 0.07 0.00 C ATOM 2224 CG2 VAL A 141 16.392 -2.131 -0.164 0.37 0.00 C ATOM 0 H VAL A 141 18.009 -2.861 1.861 0.11 0.00 H new ATOM 0 HA VAL A 141 15.281 -3.463 1.921 0.18 0.00 H new ATOM 0 HB VAL A 141 17.401 -4.012 -0.191 0.07 0.00 H new ATOM 0 HG11 VAL A 141 15.537 -4.122 -1.794 0.07 0.00 H new ATOM 0 HG12 VAL A 141 15.443 -5.417 -0.577 0.07 0.00 H new ATOM 0 HG13 VAL A 141 14.379 -3.997 -0.448 0.07 0.00 H new ATOM 0 HG21 VAL A 141 16.538 -1.945 -1.228 0.37 0.00 H new ATOM 0 HG22 VAL A 141 15.429 -1.726 0.147 0.37 0.00 H new ATOM 0 HG23 VAL A 141 17.188 -1.646 0.401 0.37 0.00 H new ATOM 2234 N SER A 142 17.303 -6.075 1.824 0.32 0.00 N ATOM 2235 CA SER A 142 17.373 -7.518 2.026 0.10 0.00 C ATOM 2236 C SER A 142 16.839 -7.903 3.400 1.00 0.00 C ATOM 2237 O SER A 142 16.300 -8.994 3.585 0.44 0.00 O ATOM 2238 CB SER A 142 18.813 -8.007 1.870 0.15 0.00 C ATOM 2239 OG SER A 142 19.315 -7.722 0.576 0.61 0.00 O ATOM 0 H SER A 142 18.208 -5.624 1.690 0.32 0.00 H new ATOM 0 HA SER A 142 16.751 -7.995 1.269 0.10 0.00 H new ATOM 0 HB2 SER A 142 19.444 -7.531 2.620 0.15 0.00 H new ATOM 0 HB3 SER A 142 18.857 -9.081 2.051 0.15 0.00 H new ATOM 0 HG SER A 142 20.238 -8.044 0.505 0.61 0.00 H new ATOM 2245 N ALA A 143 16.996 -7.000 4.363 0.26 0.00 N ATOM 2246 CA ALA A 143 16.536 -7.246 5.724 0.07 0.00 C ATOM 2247 C ALA A 143 15.013 -7.230 5.813 0.47 0.00 C ATOM 2248 O ALA A 143 14.400 -8.204 6.250 0.06 0.00 O ATOM 2249 CB ALA A 143 17.132 -6.215 6.672 0.98 0.00 C ATOM 0 H ALA A 143 17.438 -6.091 4.225 0.26 0.00 H new ATOM 0 HA ALA A 143 16.874 -8.240 6.017 0.07 0.00 H new ATOM 0 HB1 ALA A 143 16.782 -6.408 7.686 0.98 0.00 H new ATOM 0 HB2 ALA A 143 18.220 -6.282 6.645 0.98 0.00 H new ATOM 0 HB3 ALA A 143 16.822 -5.216 6.365 0.98 0.00 H new ATOM 2255 N ILE A 144 14.409 -6.122 5.395 0.29 0.00 N ATOM 2256 CA ILE A 144 12.956 -5.980 5.436 0.06 0.00 C ATOM 2257 C ILE A 144 12.266 -7.060 4.609 0.13 0.00 C ATOM 2258 O ILE A 144 11.190 -7.538 4.969 1.00 0.00 O ATOM 2259 CB ILE A 144 12.508 -4.595 4.931 0.19 0.00 C ATOM 2260 CG1 ILE A 144 13.076 -4.323 3.535 0.13 0.00 C ATOM 2261 CG2 ILE A 144 12.944 -3.512 5.909 0.05 0.00 C ATOM 2262 CD1 ILE A 144 12.534 -3.065 2.892 0.05 0.00 C ATOM 0 H ILE A 144 14.902 -5.310 5.024 0.29 0.00 H new ATOM 0 HA ILE A 144 12.663 -6.089 6.480 0.06 0.00 H new ATOM 0 HB ILE A 144 11.420 -4.583 4.864 0.19 0.00 H new ATOM 0 HG12 ILE A 144 14.161 -4.247 3.602 0.13 0.00 H new ATOM 0 HG13 ILE A 144 12.855 -5.174 2.891 0.13 0.00 H new ATOM 0 HG21 ILE A 144 12.622 -2.538 5.541 0.05 0.00 H new ATOM 0 HG22 ILE A 144 12.493 -3.699 6.884 0.05 0.00 H new ATOM 0 HG23 ILE A 144 14.030 -3.523 6.003 0.05 0.00 H new ATOM 0 HD11 ILE A 144 12.982 -2.938 1.906 0.05 0.00 H new ATOM 0 HD12 ILE A 144 11.452 -3.145 2.792 0.05 0.00 H new ATOM 0 HD13 ILE A 144 12.778 -2.204 3.514 0.05 0.00 H new ATOM 2274 N VAL A 145 12.889 -7.442 3.498 0.95 0.00 N ATOM 2275 CA VAL A 145 12.334 -8.470 2.626 0.26 0.00 C ATOM 2276 C VAL A 145 12.410 -9.843 3.286 0.09 0.00 C ATOM 2277 O VAL A 145 11.475 -10.639 3.191 0.46 0.00 O ATOM 2278 CB VAL A 145 13.073 -8.514 1.271 0.06 0.00 C ATOM 2279 CG1 VAL A 145 12.662 -9.741 0.469 1.00 0.00 C ATOM 2280 CG2 VAL A 145 12.807 -7.245 0.476 0.22 0.00 C ATOM 0 H VAL A 145 13.778 -7.055 3.181 0.95 0.00 H new ATOM 0 HA VAL A 145 11.289 -8.213 2.450 0.26 0.00 H new ATOM 0 HB VAL A 145 14.143 -8.580 1.470 0.06 0.00 H new ATOM 0 HG11 VAL A 145 13.196 -9.750 -0.481 1.00 0.00 H new ATOM 0 HG12 VAL A 145 12.907 -10.642 1.031 1.00 0.00 H new ATOM 0 HG13 VAL A 145 11.589 -9.711 0.282 1.00 0.00 H new ATOM 0 HG21 VAL A 145 13.336 -7.294 -0.476 0.22 0.00 H new ATOM 0 HG22 VAL A 145 11.737 -7.149 0.292 0.22 0.00 H new ATOM 0 HG23 VAL A 145 13.157 -6.381 1.041 0.22 0.00 H new ATOM 2290 N GLU A 146 13.526 -10.110 3.957 1.00 0.00 N ATOM 2291 CA GLU A 146 13.732 -11.391 4.627 0.10 0.00 C ATOM 2292 C GLU A 146 12.704 -11.609 5.735 0.56 0.00 C ATOM 2293 O GLU A 146 12.172 -12.710 5.889 0.07 0.00 O ATOM 2294 CB GLU A 146 15.145 -11.461 5.209 1.00 0.00 C ATOM 2295 CG GLU A 146 15.499 -12.822 5.783 1.00 0.00 C ATOM 2296 CD GLU A 146 15.446 -13.925 4.742 0.47 0.00 C ATOM 2297 OE1 GLU A 146 16.408 -14.044 3.955 0.09 0.00 O ATOM 2298 OE2 GLU A 146 14.443 -14.669 4.719 0.56 0.00 O ATOM 0 H GLU A 146 14.303 -9.456 4.052 1.00 0.00 H new ATOM 0 HA GLU A 146 13.607 -12.180 3.886 0.10 0.00 H new ATOM 0 HB2 GLU A 146 15.863 -11.207 4.429 1.00 0.00 H new ATOM 0 HB3 GLU A 146 15.244 -10.709 5.992 1.00 0.00 H new ATOM 0 HG2 GLU A 146 16.499 -12.782 6.214 1.00 0.00 H new ATOM 0 HG3 GLU A 146 14.812 -13.060 6.595 1.00 0.00 H new ATOM 2305 N GLN A 147 12.429 -10.560 6.504 0.66 0.00 N ATOM 2306 CA GLN A 147 11.467 -10.646 7.600 1.00 0.00 C ATOM 2307 C GLN A 147 10.075 -11.001 7.086 1.00 0.00 C ATOM 2308 O GLN A 147 9.335 -11.740 7.737 0.10 0.00 O ATOM 2309 CB GLN A 147 11.413 -9.323 8.368 0.40 0.00 C ATOM 2310 CG GLN A 147 12.734 -8.931 9.006 0.05 0.00 C ATOM 2311 CD GLN A 147 12.634 -7.649 9.810 0.11 0.00 C ATOM 2312 OE1 GLN A 147 12.864 -6.519 9.152 0.56 0.00 O flip ATOM 2313 NE2 GLN A 147 12.350 -7.675 11.007 1.00 0.00 N flip ATOM 0 H GLN A 147 12.857 -9.641 6.390 0.66 0.00 H new ATOM 0 HA GLN A 147 11.799 -11.438 8.271 1.00 0.00 H new ATOM 0 HB2 GLN A 147 11.100 -8.531 7.688 0.40 0.00 H new ATOM 0 HB3 GLN A 147 10.652 -9.395 9.145 0.40 0.00 H new ATOM 0 HG2 GLN A 147 13.073 -9.738 9.656 0.05 0.00 H new ATOM 0 HG3 GLN A 147 13.488 -8.810 8.228 0.05 0.00 H new ATOM 0 HE21 GLN A 147 12.181 -8.567 11.472 1.00 0.00 H new ATOM 0 HE22 GLN A 147 12.283 -6.804 11.534 1.00 0.00 H new ATOM 2322 N SER A 148 9.725 -10.472 5.920 1.00 0.00 N ATOM 2323 CA SER A 148 8.417 -10.731 5.325 1.00 0.00 C ATOM 2324 C SER A 148 8.505 -11.796 4.237 0.14 0.00 C ATOM 2325 O SER A 148 7.566 -11.978 3.460 1.00 0.00 O ATOM 2326 CB SER A 148 7.836 -9.441 4.744 1.00 0.00 C ATOM 2327 OG SER A 148 8.687 -8.901 3.746 0.27 0.00 O ATOM 0 H SER A 148 10.327 -9.862 5.367 1.00 0.00 H new ATOM 0 HA SER A 148 7.759 -11.101 6.111 1.00 0.00 H new ATOM 0 HB2 SER A 148 6.853 -9.641 4.318 1.00 0.00 H new ATOM 0 HB3 SER A 148 7.696 -8.711 5.541 1.00 0.00 H new ATOM 0 HG SER A 148 9.463 -8.480 4.171 0.27 0.00 H new ATOM 2333 N TRP A 149 9.629 -12.502 4.187 1.00 0.00 N ATOM 2334 CA TRP A 149 9.828 -13.547 3.188 0.49 0.00 C ATOM 2335 C TRP A 149 9.248 -14.873 3.670 0.39 0.00 C ATOM 2336 O TRP A 149 8.478 -15.518 2.959 0.48 0.00 O ATOM 2337 CB TRP A 149 11.316 -13.715 2.877 0.95 0.00 C ATOM 2338 CG TRP A 149 11.576 -14.257 1.506 0.17 0.00 C ATOM 2339 CD1 TRP A 149 11.706 -13.537 0.353 0.58 0.00 C ATOM 2340 CD2 TRP A 149 11.732 -15.634 1.138 0.88 0.00 C ATOM 2341 NE1 TRP A 149 11.936 -14.378 -0.707 1.00 0.00 N ATOM 2342 CE2 TRP A 149 11.957 -15.670 -0.251 0.19 0.00 C ATOM 2343 CE3 TRP A 149 11.705 -16.837 1.849 0.08 0.00 C ATOM 2344 CZ2 TRP A 149 12.153 -16.863 -0.943 0.10 0.00 C ATOM 2345 CZ3 TRP A 149 11.901 -18.021 1.161 0.18 0.00 C ATOM 2346 CH2 TRP A 149 12.123 -18.026 -0.222 1.00 0.00 C ATOM 0 H TRP A 149 10.415 -12.371 4.824 1.00 0.00 H new ATOM 0 HA TRP A 149 9.307 -13.247 2.279 0.49 0.00 H new ATOM 0 HB2 TRP A 149 11.813 -12.750 2.979 0.95 0.00 H new ATOM 0 HB3 TRP A 149 11.761 -14.382 3.615 0.95 0.00 H new ATOM 0 HD1 TRP A 149 11.638 -12.461 0.285 0.58 0.00 H new ATOM 0 HE1 TRP A 149 12.069 -14.089 -1.676 1.00 0.00 H new ATOM 0 HE3 TRP A 149 11.534 -16.842 2.915 0.08 0.00 H new ATOM 0 HZ2 TRP A 149 12.322 -16.870 -2.010 0.10 0.00 H new ATOM 0 HZ3 TRP A 149 11.883 -18.957 1.699 0.18 0.00 H new ATOM 0 HH2 TRP A 149 12.274 -18.967 -0.730 1.00 0.00 H new ATOM 2357 N ASN A 150 9.627 -15.269 4.883 1.00 0.00 N ATOM 2358 CA ASN A 150 9.150 -16.516 5.475 0.15 0.00 C ATOM 2359 C ASN A 150 9.554 -17.720 4.629 1.00 0.00 C ATOM 2360 O ASN A 150 8.945 -17.997 3.596 1.00 0.00 O ATOM 2361 CB ASN A 150 7.630 -16.484 5.645 0.60 0.00 C ATOM 2362 CG ASN A 150 7.097 -17.729 6.328 1.00 0.00 C ATOM 2363 OD1 ASN A 150 7.886 -18.291 7.236 0.47 0.00 O flip ATOM 2364 ND2 ASN A 150 5.986 -18.178 6.045 1.00 0.00 N flip ATOM 0 H ASN A 150 10.266 -14.741 5.477 1.00 0.00 H new ATOM 0 HA ASN A 150 9.615 -16.615 6.456 0.15 0.00 H new ATOM 0 HB2 ASN A 150 7.351 -15.606 6.227 0.60 0.00 H new ATOM 0 HB3 ASN A 150 7.160 -16.380 4.667 0.60 0.00 H new ATOM 0 HD21 ASN A 150 5.413 -17.714 5.341 1.00 0.00 H new ATOM 0 HD22 ASN A 150 5.639 -19.014 6.515 1.00 0.00 H new ATOM 2371 N ASP A 151 10.585 -18.431 5.073 0.21 0.00 N ATOM 2372 CA ASP A 151 11.069 -19.606 4.359 0.17 0.00 C ATOM 2373 C ASP A 151 10.551 -20.884 5.012 0.59 0.00 C ATOM 2374 O ASP A 151 9.940 -21.725 4.354 0.35 0.00 O ATOM 2375 CB ASP A 151 12.598 -19.618 4.326 1.00 0.00 C ATOM 2376 CG ASP A 151 13.149 -20.829 3.599 1.00 0.00 C ATOM 2377 OD1 ASP A 151 13.195 -20.802 2.352 0.44 0.00 O ATOM 2378 OD2 ASP A 151 13.534 -21.804 4.279 1.00 0.00 O ATOM 0 H ASP A 151 11.102 -18.213 5.925 0.21 0.00 H new ATOM 0 HA ASP A 151 10.695 -19.561 3.336 0.17 0.00 H new ATOM 0 HB2 ASP A 151 12.956 -18.711 3.839 1.00 0.00 H new ATOM 0 HB3 ASP A 151 12.981 -19.604 5.346 1.00 0.00 H new ATOM 2383 N SER A 152 10.802 -21.017 6.311 0.32 0.00 N ATOM 2384 CA SER A 152 10.366 -22.191 7.057 0.07 0.00 C ATOM 2385 C SER A 152 8.995 -21.957 7.687 0.34 0.00 C ATOM 2386 O SER A 152 7.983 -22.307 7.045 0.25 0.00 O ATOM 2387 CB SER A 152 11.389 -22.537 8.141 0.39 0.00 C ATOM 2388 OG SER A 152 12.661 -22.801 7.575 0.09 0.00 O ATOM 2389 OXT SER A 152 8.948 -21.426 8.818 0.63 0.00 O ATOM 0 H SER A 152 11.305 -20.326 6.868 0.32 0.00 H new ATOM 0 HA SER A 152 10.286 -23.027 6.362 0.07 0.00 H new ATOM 0 HB2 SER A 152 11.467 -21.712 8.849 0.39 0.00 H new ATOM 0 HB3 SER A 152 11.049 -23.408 8.702 0.39 0.00 H new ATOM 0 HG SER A 152 13.298 -23.018 8.288 0.09 0.00 H new TER 2395 SER A 152