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 54 LYS NZ :NH3+ -174:sc= -0.724 (180deg=-0.333) USER MOD Set 1.2: A 150 ASN : amide:sc= -1.68 K(o=-2.4,f=-5.9!) USER MOD Set 2.1: A 82 TYR OH : rot -41:sc= 0.00319 USER MOD Set 2.2: A 88 CYS SG : rot 180:sc= 0.00367 USER MOD Set 3.1: A 31 ASN :FLIP amide:sc= -0.39 F(o=-1.9!,f=-0.75) USER MOD Set 3.2: A 35 GLN : amide:sc= -0.359 K(o=-0.75,f=-6.8!) USER MOD Single : A 1 MET CE :methyl 161:sc= -0.145 (180deg=-0.655) USER MOD Single : A 1 MET N :NH3+ -133:sc= 0.0497 (180deg=-0.352) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 3 THR OG1 : rot 165:sc= 0 USER MOD Single : A 10 MET CE :methyl -126:sc= -1.41 (180deg=-2.68!) USER MOD Single : A 14 LYS NZ :NH3+ 160:sc= -0.101 (180deg=-0.588) USER MOD Single : A 17 GLN :FLIP amide:sc= -0.739 F(o=-1.4,f=-0.74) 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 32 ASN : amide:sc= -1.79 K(o=-1.8,f=-4.4!) USER MOD Single : A 34 MET CE :methyl -165:sc= -0.056 (180deg=-0.396) USER MOD Single : A 37 ASN :FLIP amide:sc= 0 F(o=-1.1,f=0) USER MOD Single : A 46 THR OG1 : rot -66:sc= 0.268 USER MOD Single : A 52 THR OG1 : rot 180:sc= 0 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= -0.177 X(o=-0.18,f=-0.67) USER MOD Single : A 66 LYS NZ :NH3+ 180:sc= -1.46 (180deg=-1.46) 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+ 143:sc= -1.62! (180deg=-4.07!) USER MOD Single : A 76 MET CE :methyl 180:sc= -0.11 (180deg=-0.11) USER MOD Single : A 78 HIS : no HD1:sc= -0.0146 X(o=-0.015,f=-0.0025) USER MOD Single : A 80 ASN : amide:sc= -1.99! C(o=-2!,f=-6.5!) USER MOD Single : A 86 SER OG : rot 180:sc= -0.132 USER MOD Single : A 93 GLN : amide:sc= -2.03 X(o=-2,f=-1.8) USER MOD Single : A 94 ASN : amide:sc= 0 K(o=0,f=-0.69) USER MOD Single : A 97 SER OG : rot 180:sc= 0 USER MOD Single : A 99 THR OG1 : rot -26:sc= 0.465 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 -80:sc= -0.921 USER MOD Single : A 107 THR OG1 : rot -2:sc= 0.701 USER MOD Single : A 108 SER OG : rot 67:sc= 1.3 USER MOD Single : A 110 GLN :FLIP amide:sc= -0.866 F(o=-1.9!,f=-0.87) USER MOD Single : A 111 SER OG : rot 180:sc= 0 USER MOD Single : A 117 ASN :FLIP amide:sc= 0 F(o=-1.4,f=0) USER MOD Single : A 119 ASN :FLIP amide:sc= 0 F(o=-1.2,f=0) USER MOD Single : A 120 SER OG : rot 180:sc= 0 USER MOD Single : A 123 ASN : amide:sc= -0.193 K(o=-0.19,f=-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=-0.69) USER MOD Single : A 128 GLN :FLIP amide:sc= -0.295 F(o=-3!,f=-0.29) 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 :FLIP amide:sc= -0.309 F(o=-4.1!,f=-0.31) 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+ -171:sc= 0 (180deg=-0.0704) USER MOD Single : A 142 SER OG : rot -12:sc= 0.605 USER MOD Single : A 147 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 148 SER OG : rot 94:sc= 0.0581 USER MOD Single : A 152 SER OG : rot 45:sc= 0.984 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 -23.708 0.683 12.607 1.00 0.00 N ATOM 2 CA MET A 1 -24.938 1.168 11.929 0.13 0.00 C ATOM 3 C MET A 1 -24.760 1.177 10.416 0.21 0.00 C ATOM 4 O MET A 1 -23.710 0.785 9.902 0.14 0.00 O ATOM 5 CB MET A 1 -25.290 2.574 12.421 1.00 0.00 C ATOM 6 CG MET A 1 -25.553 2.645 13.916 0.51 0.00 C ATOM 7 SD MET A 1 -25.883 4.324 14.484 0.47 0.00 S ATOM 8 CE MET A 1 -27.347 4.727 13.532 0.07 0.00 C ATOM 0 H1 MET A 1 -23.964 -0.023 13.326 1.00 0.00 H new ATOM 0 H2 MET A 1 -23.073 0.249 11.906 1.00 0.00 H new ATOM 0 H3 MET A 1 -23.225 1.483 13.063 1.00 0.00 H new ATOM 0 HA MET A 1 -25.752 0.486 12.174 0.13 0.00 H new ATOM 0 HB2 MET A 1 -24.474 3.253 12.171 1.00 0.00 H new ATOM 0 HB3 MET A 1 -26.173 2.927 11.888 1.00 0.00 H new ATOM 0 HG2 MET A 1 -26.403 2.009 14.162 0.51 0.00 H new ATOM 0 HG3 MET A 1 -24.691 2.247 14.452 0.51 0.00 H new ATOM 0 HE1 MET A 1 -27.863 5.567 13.997 0.07 0.00 H new ATOM 0 HE2 MET A 1 -27.058 4.996 12.516 0.07 0.00 H new ATOM 0 HE3 MET A 1 -28.012 3.864 13.504 0.07 0.00 H new ATOM 20 N SER A 2 -25.790 1.625 9.705 0.44 0.00 N ATOM 21 CA SER A 2 -25.749 1.683 8.246 0.24 0.00 C ATOM 22 C SER A 2 -25.209 3.026 7.765 0.56 0.00 C ATOM 23 O SER A 2 -25.543 4.075 8.318 0.83 0.00 O ATOM 24 CB SER A 2 -27.143 1.443 7.665 0.50 0.00 C ATOM 25 OG SER A 2 -27.122 1.490 6.251 1.00 0.00 O ATOM 0 H SER A 2 -26.664 1.954 10.115 0.44 0.00 H new ATOM 0 HA SER A 2 -25.077 0.899 7.898 0.24 0.00 H new ATOM 0 HB2 SER A 2 -27.515 0.473 7.994 0.50 0.00 H new ATOM 0 HB3 SER A 2 -27.834 2.195 8.046 0.50 0.00 H new ATOM 0 HG SER A 2 -28.025 1.332 5.905 1.00 0.00 H new ATOM 31 N THR A 3 -24.374 2.986 6.731 0.09 0.00 N ATOM 32 CA THR A 3 -23.787 4.200 6.174 0.09 0.00 C ATOM 33 C THR A 3 -23.658 4.111 4.653 0.95 0.00 C ATOM 34 O THR A 3 -23.598 3.017 4.092 0.35 0.00 O ATOM 35 CB THR A 3 -22.401 4.485 6.781 0.07 0.00 C ATOM 36 OG1 THR A 3 -21.706 3.256 7.027 0.30 0.00 O ATOM 37 CG2 THR A 3 -22.529 5.276 8.073 1.00 0.00 C ATOM 0 H THR A 3 -24.089 2.126 6.262 0.09 0.00 H new ATOM 0 HA THR A 3 -24.462 5.017 6.428 0.09 0.00 H new ATOM 0 HB THR A 3 -21.832 5.080 6.067 0.07 0.00 H new ATOM 0 HG1 THR A 3 -20.756 3.442 7.179 0.30 0.00 H new ATOM 0 HG21 THR A 3 -21.537 5.465 8.483 1.00 0.00 H new ATOM 0 HG22 THR A 3 -23.025 6.225 7.871 1.00 0.00 H new ATOM 0 HG23 THR A 3 -23.116 4.705 8.792 1.00 0.00 H new ATOM 45 N PRO A 4 -23.614 5.270 3.967 0.05 0.00 N ATOM 46 CA PRO A 4 -23.491 5.323 2.504 0.88 0.00 C ATOM 47 C PRO A 4 -22.172 4.733 2.015 0.59 0.00 C ATOM 48 O PRO A 4 -22.101 4.168 0.923 0.07 0.00 O ATOM 49 CB PRO A 4 -23.555 6.821 2.188 0.94 0.00 C ATOM 50 CG PRO A 4 -23.165 7.497 3.458 0.05 0.00 C ATOM 51 CD PRO A 4 -23.682 6.619 4.559 0.94 0.00 C ATOM 0 HA PRO A 4 -24.268 4.740 2.011 0.88 0.00 H new ATOM 0 HB2 PRO A 4 -22.876 7.083 1.376 0.94 0.00 H new ATOM 0 HB3 PRO A 4 -24.556 7.116 1.874 0.94 0.00 H new ATOM 0 HG2 PRO A 4 -22.083 7.612 3.524 0.05 0.00 H new ATOM 0 HG3 PRO A 4 -23.596 8.496 3.518 0.05 0.00 H new ATOM 0 HD2 PRO A 4 -23.070 6.697 5.458 0.94 0.00 H new ATOM 0 HD3 PRO A 4 -24.700 6.885 4.842 0.94 0.00 H new ATOM 59 N ALA A 5 -21.131 4.872 2.829 0.63 0.00 N ATOM 60 CA ALA A 5 -19.812 4.355 2.482 0.06 0.00 C ATOM 61 C ALA A 5 -19.776 2.833 2.576 1.00 0.00 C ATOM 62 O ALA A 5 -19.120 2.167 1.775 0.07 0.00 O ATOM 63 CB ALA A 5 -18.755 4.967 3.389 0.49 0.00 C ATOM 0 H ALA A 5 -21.175 5.339 3.735 0.63 0.00 H new ATOM 0 HA ALA A 5 -19.598 4.633 1.450 0.06 0.00 H new ATOM 0 HB1 ALA A 5 -17.774 4.574 3.121 0.49 0.00 H new ATOM 0 HB2 ALA A 5 -18.757 6.051 3.270 0.49 0.00 H new ATOM 0 HB3 ALA A 5 -18.976 4.715 4.426 0.49 0.00 H new ATOM 69 N ARG A 6 -20.487 2.291 3.560 0.12 0.00 N ATOM 70 CA ARG A 6 -20.538 0.848 3.766 0.10 0.00 C ATOM 71 C ARG A 6 -21.220 0.151 2.591 0.38 0.00 C ATOM 72 O ARG A 6 -20.941 -1.013 2.302 0.15 0.00 O ATOM 73 CB ARG A 6 -21.275 0.523 5.067 0.06 0.00 C ATOM 74 CG ARG A 6 -21.248 -0.951 5.433 0.07 0.00 C ATOM 75 CD ARG A 6 -22.007 -1.219 6.723 0.14 0.00 C ATOM 76 NE ARG A 6 -21.911 -2.616 7.135 1.00 0.00 N ATOM 77 CZ ARG A 6 -22.554 -3.121 8.183 0.57 0.00 C ATOM 78 NH1 ARG A 6 -23.344 -2.349 8.918 1.00 0.00 N ATOM 79 NH2 ARG A 6 -22.406 -4.401 8.499 0.05 0.00 N ATOM 0 H ARG A 6 -21.037 2.831 4.228 0.12 0.00 H new ATOM 0 HA ARG A 6 -19.514 0.481 3.835 0.10 0.00 H new ATOM 0 HB2 ARG A 6 -20.830 1.098 5.879 0.06 0.00 H new ATOM 0 HB3 ARG A 6 -22.312 0.847 4.977 0.06 0.00 H new ATOM 0 HG2 ARG A 6 -21.686 -1.536 4.624 0.07 0.00 H new ATOM 0 HG3 ARG A 6 -20.215 -1.281 5.542 0.07 0.00 H new ATOM 0 HD2 ARG A 6 -21.614 -0.580 7.514 0.14 0.00 H new ATOM 0 HD3 ARG A 6 -23.055 -0.952 6.589 0.14 0.00 H new ATOM 0 HE ARG A 6 -21.317 -3.240 6.588 1.00 0.00 H new ATOM 0 HH11 ARG A 6 -23.460 -1.364 8.680 1.00 0.00 H new ATOM 0 HH12 ARG A 6 -23.836 -2.740 9.721 1.00 0.00 H new ATOM 0 HH21 ARG A 6 -21.799 -4.998 7.938 0.05 0.00 H new ATOM 0 HH22 ARG A 6 -22.900 -4.788 9.303 0.05 0.00 H new ATOM 93 N ARG A 7 -22.113 0.871 1.917 1.00 0.00 N ATOM 94 CA ARG A 7 -22.830 0.321 0.774 0.15 0.00 C ATOM 95 C ARG A 7 -21.903 0.167 -0.429 1.00 0.00 C ATOM 96 O ARG A 7 -22.074 -0.738 -1.245 0.64 0.00 O ATOM 97 CB ARG A 7 -24.014 1.216 0.406 1.00 0.00 C ATOM 98 CG ARG A 7 -24.860 0.667 -0.730 0.15 0.00 C ATOM 99 CD ARG A 7 -26.059 1.556 -1.011 0.52 0.00 C ATOM 100 NE ARG A 7 -25.658 2.890 -1.447 1.00 0.00 N ATOM 101 CZ ARG A 7 -26.515 3.821 -1.855 0.27 0.00 C ATOM 102 NH1 ARG A 7 -27.815 3.559 -1.897 0.10 0.00 N ATOM 103 NH2 ARG A 7 -26.072 5.015 -2.224 0.08 0.00 N ATOM 0 H ARG A 7 -22.356 1.835 2.144 1.00 0.00 H new ATOM 0 HA ARG A 7 -23.202 -0.665 1.053 0.15 0.00 H new ATOM 0 HB2 ARG A 7 -24.644 1.351 1.285 1.00 0.00 H new ATOM 0 HB3 ARG A 7 -23.641 2.202 0.127 1.00 0.00 H new ATOM 0 HG2 ARG A 7 -24.251 0.581 -1.630 0.15 0.00 H new ATOM 0 HG3 ARG A 7 -25.201 -0.337 -0.479 0.15 0.00 H new ATOM 0 HD2 ARG A 7 -26.681 1.095 -1.779 0.52 0.00 H new ATOM 0 HD3 ARG A 7 -26.670 1.636 -0.112 0.52 0.00 H new ATOM 0 HE ARG A 7 -24.665 3.121 -1.438 1.00 0.00 H new ATOM 0 HH11 ARG A 7 -28.160 2.641 -1.616 0.10 0.00 H new ATOM 0 HH12 ARG A 7 -28.470 4.276 -2.210 0.10 0.00 H new ATOM 0 HH21 ARG A 7 -25.073 5.220 -2.195 0.08 0.00 H new ATOM 0 HH22 ARG A 7 -26.730 5.729 -2.537 0.08 0.00 H new ATOM 117 N ARG A 8 -20.921 1.058 -0.528 1.00 0.00 N ATOM 118 CA ARG A 8 -19.964 1.026 -1.629 0.12 0.00 C ATOM 119 C ARG A 8 -18.917 -0.062 -1.416 1.00 0.00 C ATOM 120 O ARG A 8 -18.545 -0.767 -2.355 1.00 0.00 O ATOM 121 CB ARG A 8 -19.278 2.388 -1.778 0.32 0.00 C ATOM 122 CG ARG A 8 -20.229 3.519 -2.138 0.07 0.00 C ATOM 123 CD ARG A 8 -20.827 3.326 -3.523 0.95 0.00 C ATOM 124 NE ARG A 8 -21.738 4.409 -3.883 1.00 0.00 N ATOM 125 CZ ARG A 8 -22.373 4.483 -5.049 0.55 0.00 C ATOM 126 NH1 ARG A 8 -22.190 3.545 -5.968 0.06 0.00 N ATOM 127 NH2 ARG A 8 -23.188 5.499 -5.297 1.00 0.00 N ATOM 0 H ARG A 8 -20.767 1.812 0.142 1.00 0.00 H new ATOM 0 HA ARG A 8 -20.513 0.800 -2.543 0.12 0.00 H new ATOM 0 HB2 ARG A 8 -18.773 2.634 -0.844 0.32 0.00 H new ATOM 0 HB3 ARG A 8 -18.509 2.315 -2.546 0.32 0.00 H new ATOM 0 HG2 ARG A 8 -21.029 3.572 -1.399 0.07 0.00 H new ATOM 0 HG3 ARG A 8 -19.697 4.469 -2.100 0.07 0.00 H new ATOM 0 HD2 ARG A 8 -20.025 3.268 -4.259 0.95 0.00 H new ATOM 0 HD3 ARG A 8 -21.361 2.377 -3.558 0.95 0.00 H new ATOM 0 HE ARG A 8 -21.896 5.151 -3.201 1.00 0.00 H new ATOM 0 HH11 ARG A 8 -21.561 2.764 -5.781 0.06 0.00 H new ATOM 0 HH12 ARG A 8 -22.678 3.604 -6.862 0.06 0.00 H new ATOM 0 HH21 ARG A 8 -23.328 6.224 -4.593 1.00 0.00 H new ATOM 0 HH22 ARG A 8 -23.675 5.556 -6.191 1.00 0.00 H new ATOM 141 N LEU A 9 -18.448 -0.195 -0.179 0.07 0.00 N ATOM 142 CA LEU A 9 -17.437 -1.195 0.158 0.66 0.00 C ATOM 143 C LEU A 9 -17.866 -2.590 -0.287 1.00 0.00 C ATOM 144 O LEU A 9 -17.039 -3.397 -0.711 0.11 0.00 O ATOM 145 CB LEU A 9 -17.164 -1.190 1.664 0.06 0.00 C ATOM 146 CG LEU A 9 -16.488 0.073 2.199 0.26 0.00 C ATOM 147 CD1 LEU A 9 -16.395 0.023 3.717 0.86 0.00 C ATOM 148 CD2 LEU A 9 -15.105 0.240 1.587 0.07 0.00 C ATOM 0 H LEU A 9 -18.752 0.378 0.609 0.07 0.00 H new ATOM 0 HA LEU A 9 -16.522 -0.934 -0.374 0.66 0.00 H new ATOM 0 HB2 LEU A 9 -18.109 -1.327 2.189 0.06 0.00 H new ATOM 0 HB3 LEU A 9 -16.538 -2.049 1.906 0.06 0.00 H new ATOM 0 HG LEU A 9 -17.095 0.934 1.917 0.26 0.00 H new ATOM 0 HD11 LEU A 9 -15.911 0.929 4.082 0.86 0.00 H new ATOM 0 HD12 LEU A 9 -17.397 -0.050 4.141 0.86 0.00 H new ATOM 0 HD13 LEU A 9 -15.810 -0.846 4.017 0.86 0.00 H new ATOM 0 HD21 LEU A 9 -14.640 1.144 1.980 0.07 0.00 H new ATOM 0 HD22 LEU A 9 -14.489 -0.623 1.838 0.07 0.00 H new ATOM 0 HD23 LEU A 9 -15.194 0.319 0.504 0.07 0.00 H new ATOM 160 N MET A 10 -19.162 -2.869 -0.187 0.80 0.00 N ATOM 161 CA MET A 10 -19.693 -4.170 -0.578 0.13 0.00 C ATOM 162 C MET A 10 -19.689 -4.330 -2.095 1.00 0.00 C ATOM 163 O MET A 10 -19.180 -5.317 -2.623 1.00 0.00 O ATOM 164 CB MET A 10 -21.113 -4.350 -0.038 0.19 0.00 C ATOM 165 CG MET A 10 -21.198 -4.296 1.479 0.09 0.00 C ATOM 166 SD MET A 10 -22.857 -4.648 2.096 0.58 0.00 S ATOM 167 CE MET A 10 -23.797 -3.342 1.310 0.07 0.00 C ATOM 0 H MET A 10 -19.862 -2.214 0.160 0.80 0.00 H new ATOM 0 HA MET A 10 -19.049 -4.938 -0.150 0.13 0.00 H new ATOM 0 HB2 MET A 10 -21.753 -3.574 -0.457 0.19 0.00 H new ATOM 0 HB3 MET A 10 -21.505 -5.307 -0.382 0.19 0.00 H new ATOM 0 HG2 MET A 10 -20.497 -5.014 1.904 0.09 0.00 H new ATOM 0 HG3 MET A 10 -20.889 -3.308 1.821 0.09 0.00 H new ATOM 0 HE1 MET A 10 -24.353 -2.788 2.066 0.07 0.00 H new ATOM 0 HE2 MET A 10 -23.117 -2.666 0.792 0.07 0.00 H new ATOM 0 HE3 MET A 10 -24.493 -3.776 0.593 0.07 0.00 H new ATOM 177 N ARG A 11 -20.261 -3.350 -2.791 0.22 0.00 N ATOM 178 CA ARG A 11 -20.327 -3.383 -4.247 0.33 0.00 C ATOM 179 C ARG A 11 -18.937 -3.516 -4.863 0.05 0.00 C ATOM 180 O ARG A 11 -18.781 -4.069 -5.951 0.18 0.00 O ATOM 181 CB ARG A 11 -21.015 -2.124 -4.779 0.13 0.00 C ATOM 182 CG ARG A 11 -22.458 -1.975 -4.322 0.75 0.00 C ATOM 183 CD ARG A 11 -23.331 -3.101 -4.851 0.11 0.00 C ATOM 184 NE ARG A 11 -23.263 -3.212 -6.306 0.69 0.00 N ATOM 185 CZ ARG A 11 -23.836 -4.192 -6.999 0.09 0.00 C ATOM 186 NH1 ARG A 11 -24.521 -5.140 -6.373 1.00 0.00 N ATOM 187 NH2 ARG A 11 -23.725 -4.223 -8.321 1.00 0.00 N ATOM 0 H ARG A 11 -20.685 -2.524 -2.369 0.22 0.00 H new ATOM 0 HA ARG A 11 -20.911 -4.258 -4.532 0.33 0.00 H new ATOM 0 HB2 ARG A 11 -20.450 -1.249 -4.458 0.13 0.00 H new ATOM 0 HB3 ARG A 11 -20.988 -2.139 -5.869 0.13 0.00 H new ATOM 0 HG2 ARG A 11 -22.496 -1.965 -3.233 0.75 0.00 H new ATOM 0 HG3 ARG A 11 -22.851 -1.018 -4.663 0.75 0.00 H new ATOM 0 HD2 ARG A 11 -23.019 -4.043 -4.401 0.11 0.00 H new ATOM 0 HD3 ARG A 11 -24.364 -2.931 -4.549 0.11 0.00 H new ATOM 0 HE ARG A 11 -22.747 -2.498 -6.819 0.69 0.00 H new ATOM 0 HH11 ARG A 11 -24.610 -5.119 -5.357 1.00 0.00 H new ATOM 0 HH12 ARG A 11 -24.959 -5.890 -6.908 1.00 0.00 H new ATOM 0 HH21 ARG A 11 -23.200 -3.495 -8.806 1.00 0.00 H new ATOM 0 HH22 ARG A 11 -24.165 -4.975 -8.852 1.00 0.00 H new ATOM 201 N ASP A 12 -17.929 -3.007 -4.159 1.00 0.00 N ATOM 202 CA ASP A 12 -16.553 -3.070 -4.642 0.05 0.00 C ATOM 203 C ASP A 12 -16.020 -4.498 -4.594 0.36 0.00 C ATOM 204 O ASP A 12 -15.237 -4.907 -5.450 1.00 0.00 O ATOM 205 CB ASP A 12 -15.651 -2.149 -3.817 1.00 0.00 C ATOM 206 CG ASP A 12 -16.007 -0.686 -3.989 0.16 0.00 C ATOM 207 OD1 ASP A 12 -16.172 -0.246 -5.146 0.21 0.00 O ATOM 208 OD2 ASP A 12 -16.122 0.022 -2.966 0.24 0.00 O ATOM 0 H ASP A 12 -18.039 -2.548 -3.255 1.00 0.00 H new ATOM 0 HA ASP A 12 -16.549 -2.735 -5.679 0.05 0.00 H new ATOM 0 HB2 ASP A 12 -15.729 -2.418 -2.763 1.00 0.00 H new ATOM 0 HB3 ASP A 12 -14.613 -2.304 -4.110 1.00 0.00 H new ATOM 213 N PHE A 13 -16.449 -5.255 -3.586 1.00 0.00 N ATOM 214 CA PHE A 13 -16.014 -6.639 -3.430 0.51 0.00 C ATOM 215 C PHE A 13 -16.518 -7.500 -4.585 1.00 0.00 C ATOM 216 O PHE A 13 -15.738 -8.195 -5.238 0.77 0.00 O ATOM 217 CB PHE A 13 -16.505 -7.205 -2.092 0.44 0.00 C ATOM 218 CG PHE A 13 -16.194 -8.665 -1.897 0.18 0.00 C ATOM 219 CD1 PHE A 13 -14.942 -9.171 -2.211 0.17 0.00 C ATOM 220 CD2 PHE A 13 -17.156 -9.530 -1.398 1.00 0.00 C ATOM 221 CE1 PHE A 13 -14.655 -10.512 -2.030 0.33 0.00 C ATOM 222 CE2 PHE A 13 -16.874 -10.872 -1.217 0.05 0.00 C ATOM 223 CZ PHE A 13 -15.622 -11.363 -1.533 0.34 0.00 C ATOM 0 H PHE A 13 -17.096 -4.933 -2.867 1.00 0.00 H new ATOM 0 HA PHE A 13 -14.924 -6.657 -3.440 0.51 0.00 H new ATOM 0 HB2 PHE A 13 -16.053 -6.636 -1.280 0.44 0.00 H new ATOM 0 HB3 PHE A 13 -17.583 -7.060 -2.021 0.44 0.00 H new ATOM 0 HD1 PHE A 13 -14.182 -8.510 -2.601 0.17 0.00 H new ATOM 0 HD2 PHE A 13 -18.136 -9.152 -1.148 1.00 0.00 H new ATOM 0 HE1 PHE A 13 -13.675 -10.893 -2.277 0.33 0.00 H new ATOM 0 HE2 PHE A 13 -17.632 -11.536 -0.829 0.05 0.00 H new ATOM 0 HZ PHE A 13 -15.400 -12.410 -1.392 0.34 0.00 H new ATOM 233 N LYS A 14 -17.825 -7.452 -4.832 1.00 0.00 N ATOM 234 CA LYS A 14 -18.425 -8.228 -5.917 0.51 0.00 C ATOM 235 C LYS A 14 -17.858 -7.785 -7.258 1.00 0.00 C ATOM 236 O LYS A 14 -17.737 -8.579 -8.188 0.09 0.00 O ATOM 237 CB LYS A 14 -19.951 -8.073 -5.943 1.00 0.00 C ATOM 238 CG LYS A 14 -20.531 -7.355 -4.737 0.53 0.00 C ATOM 239 CD LYS A 14 -20.467 -8.219 -3.487 1.00 0.00 C ATOM 240 CE LYS A 14 -21.271 -7.617 -2.346 0.08 0.00 C ATOM 241 NZ LYS A 14 -22.709 -7.461 -2.702 0.13 0.00 N ATOM 0 H LYS A 14 -18.487 -6.887 -4.299 1.00 0.00 H new ATOM 0 HA LYS A 14 -18.184 -9.276 -5.739 0.51 0.00 H new ATOM 0 HB2 LYS A 14 -20.233 -7.529 -6.844 1.00 0.00 H new ATOM 0 HB3 LYS A 14 -20.403 -9.062 -6.013 1.00 0.00 H new ATOM 0 HG2 LYS A 14 -19.984 -6.427 -4.567 0.53 0.00 H new ATOM 0 HG3 LYS A 14 -21.567 -7.082 -4.939 0.53 0.00 H new ATOM 0 HD2 LYS A 14 -20.846 -9.215 -3.713 1.00 0.00 H new ATOM 0 HD3 LYS A 14 -19.428 -8.336 -3.178 1.00 0.00 H new ATOM 0 HE2 LYS A 14 -21.182 -8.252 -1.465 0.08 0.00 H new ATOM 0 HE3 LYS A 14 -20.855 -6.645 -2.082 0.08 0.00 H new ATOM 0 HZ1 LYS A 14 -23.275 -7.378 -1.833 0.13 0.00 H new ATOM 0 HZ2 LYS A 14 -22.833 -6.605 -3.279 0.13 0.00 H new ATOM 0 HZ3 LYS A 14 -23.025 -8.291 -3.242 0.13 0.00 H new ATOM 255 N ARG A 15 -17.519 -6.505 -7.347 0.06 0.00 N ATOM 256 CA ARG A 15 -16.973 -5.947 -8.573 1.00 0.00 C ATOM 257 C ARG A 15 -15.518 -6.370 -8.772 1.00 0.00 C ATOM 258 O ARG A 15 -15.040 -6.470 -9.901 0.05 0.00 O ATOM 259 CB ARG A 15 -17.076 -4.421 -8.548 0.07 0.00 C ATOM 260 CG ARG A 15 -16.590 -3.754 -9.827 1.00 0.00 C ATOM 261 CD ARG A 15 -16.722 -2.243 -9.747 0.43 0.00 C ATOM 262 NE ARG A 15 -16.233 -1.586 -10.958 0.36 0.00 N ATOM 263 CZ ARG A 15 -16.093 -0.270 -11.078 1.00 0.00 C ATOM 264 NH1 ARG A 15 -16.403 0.529 -10.063 0.79 0.00 N ATOM 265 NH2 ARG A 15 -15.643 0.250 -12.211 1.00 0.00 N ATOM 0 H ARG A 15 -17.613 -5.835 -6.583 0.06 0.00 H new ATOM 0 HA ARG A 15 -17.556 -6.333 -9.409 1.00 0.00 H new ATOM 0 HB2 ARG A 15 -18.114 -4.139 -8.373 0.07 0.00 H new ATOM 0 HB3 ARG A 15 -16.496 -4.040 -7.707 0.07 0.00 H new ATOM 0 HG2 ARG A 15 -15.548 -4.021 -10.006 1.00 0.00 H new ATOM 0 HG3 ARG A 15 -17.165 -4.127 -10.675 1.00 0.00 H new ATOM 0 HD2 ARG A 15 -17.767 -1.978 -9.588 0.43 0.00 H new ATOM 0 HD3 ARG A 15 -16.165 -1.875 -8.885 0.43 0.00 H new ATOM 0 HE ARG A 15 -15.985 -2.171 -11.756 0.36 0.00 H new ATOM 0 HH11 ARG A 15 -16.749 0.133 -9.189 0.79 0.00 H new ATOM 0 HH12 ARG A 15 -16.295 1.539 -10.157 0.79 0.00 H new ATOM 0 HH21 ARG A 15 -15.404 -0.360 -12.993 1.00 0.00 H new ATOM 0 HH22 ARG A 15 -15.536 1.260 -12.301 1.00 0.00 H new ATOM 279 N LEU A 16 -14.821 -6.619 -7.667 0.14 0.00 N ATOM 280 CA LEU A 16 -13.416 -7.019 -7.720 0.19 0.00 C ATOM 281 C LEU A 16 -13.266 -8.473 -8.160 0.80 0.00 C ATOM 282 O LEU A 16 -12.446 -8.785 -9.025 0.68 0.00 O ATOM 283 CB LEU A 16 -12.755 -6.811 -6.354 1.00 0.00 C ATOM 284 CG LEU A 16 -11.228 -6.936 -6.337 1.00 0.00 C ATOM 285 CD1 LEU A 16 -10.641 -6.109 -5.205 1.00 0.00 C ATOM 286 CD2 LEU A 16 -10.808 -8.393 -6.197 0.16 0.00 C ATOM 0 H LEU A 16 -15.205 -6.551 -6.724 0.14 0.00 H new ATOM 0 HA LEU A 16 -12.918 -6.392 -8.459 0.19 0.00 H new ATOM 0 HB2 LEU A 16 -13.026 -5.822 -5.985 1.00 0.00 H new ATOM 0 HB3 LEU A 16 -13.170 -7.537 -5.654 1.00 0.00 H new ATOM 0 HG LEU A 16 -10.844 -6.556 -7.284 1.00 0.00 H new ATOM 0 HD11 LEU A 16 -9.556 -6.209 -5.207 1.00 0.00 H new ATOM 0 HD12 LEU A 16 -10.910 -5.062 -5.342 1.00 0.00 H new ATOM 0 HD13 LEU A 16 -11.036 -6.463 -4.253 1.00 0.00 H new ATOM 0 HD21 LEU A 16 -9.720 -8.459 -6.187 0.16 0.00 H new ATOM 0 HD22 LEU A 16 -11.204 -8.798 -5.266 0.16 0.00 H new ATOM 0 HD23 LEU A 16 -11.198 -8.967 -7.038 0.16 0.00 H new ATOM 298 N GLN A 17 -14.054 -9.362 -7.559 0.24 0.00 N ATOM 299 CA GLN A 17 -13.997 -10.779 -7.887 0.08 0.00 C ATOM 300 C GLN A 17 -14.268 -11.019 -9.368 0.19 0.00 C ATOM 301 O GLN A 17 -13.852 -12.034 -9.927 1.00 0.00 O ATOM 302 CB GLN A 17 -15.000 -11.553 -7.030 0.54 0.00 C ATOM 303 CG GLN A 17 -16.408 -10.989 -7.075 0.25 0.00 C ATOM 304 CD GLN A 17 -17.377 -11.771 -6.209 1.00 0.00 C ATOM 305 OE1 GLN A 17 -17.491 -11.378 -4.945 0.17 0.00 O flip ATOM 306 NE2 GLN A 17 -18.013 -12.720 -6.669 0.17 0.00 N flip ATOM 0 H GLN A 17 -14.739 -9.123 -6.842 0.24 0.00 H new ATOM 0 HA GLN A 17 -12.990 -11.137 -7.673 0.08 0.00 H new ATOM 0 HB2 GLN A 17 -15.024 -12.591 -7.363 0.54 0.00 H new ATOM 0 HB3 GLN A 17 -14.653 -11.558 -5.997 0.54 0.00 H new ATOM 0 HG2 GLN A 17 -16.390 -9.950 -6.746 0.25 0.00 H new ATOM 0 HG3 GLN A 17 -16.764 -10.991 -8.105 0.25 0.00 H new ATOM 0 HE21 GLN A 17 -17.894 -12.988 -7.646 0.17 0.00 H new ATOM 0 HE22 GLN A 17 -18.658 -13.238 -6.073 0.17 0.00 H new ATOM 315 N GLU A 18 -14.965 -10.081 -10.003 0.75 0.00 N ATOM 316 CA GLU A 18 -15.274 -10.193 -11.424 0.46 0.00 C ATOM 317 C GLU A 18 -14.017 -9.985 -12.262 0.52 0.00 C ATOM 318 O GLU A 18 -13.720 -10.770 -13.162 1.00 0.00 O ATOM 319 CB GLU A 18 -16.340 -9.171 -11.822 0.10 0.00 C ATOM 320 CG GLU A 18 -17.712 -9.459 -11.235 1.00 0.00 C ATOM 321 CD GLU A 18 -18.285 -10.779 -11.712 0.15 0.00 C ATOM 322 OE1 GLU A 18 -18.895 -10.801 -12.802 1.00 0.00 O ATOM 323 OE2 GLU A 18 -18.125 -11.789 -10.995 1.00 0.00 O ATOM 0 H GLU A 18 -15.325 -9.237 -9.557 0.75 0.00 H new ATOM 0 HA GLU A 18 -15.660 -11.195 -11.611 0.46 0.00 H new ATOM 0 HB2 GLU A 18 -16.018 -8.180 -11.502 0.10 0.00 H new ATOM 0 HB3 GLU A 18 -16.418 -9.145 -12.909 0.10 0.00 H new ATOM 0 HG2 GLU A 18 -17.643 -9.469 -10.147 1.00 0.00 H new ATOM 0 HG3 GLU A 18 -18.395 -8.653 -11.504 1.00 0.00 H new ATOM 330 N ASP A 19 -13.285 -8.920 -11.954 0.08 0.00 N ATOM 331 CA ASP A 19 -12.058 -8.602 -12.668 1.00 0.00 C ATOM 332 C ASP A 19 -10.999 -8.065 -11.705 0.30 0.00 C ATOM 333 O ASP A 19 -10.796 -6.855 -11.607 0.16 0.00 O ATOM 334 CB ASP A 19 -12.340 -7.574 -13.767 0.07 0.00 C ATOM 335 CG ASP A 19 -13.337 -8.080 -14.791 1.00 0.00 C ATOM 336 OD1 ASP A 19 -14.553 -7.880 -14.584 0.29 0.00 O ATOM 337 OD2 ASP A 19 -12.903 -8.677 -15.799 1.00 0.00 O ATOM 0 H ASP A 19 -13.523 -8.262 -11.212 0.08 0.00 H new ATOM 0 HA ASP A 19 -11.678 -9.515 -13.126 1.00 0.00 H new ATOM 0 HB2 ASP A 19 -12.721 -6.658 -13.315 0.07 0.00 H new ATOM 0 HB3 ASP A 19 -11.407 -7.317 -14.269 0.07 0.00 H new ATOM 342 N PRO A 20 -10.313 -8.964 -10.974 0.17 0.00 N ATOM 343 CA PRO A 20 -9.274 -8.573 -10.013 0.14 0.00 C ATOM 344 C PRO A 20 -8.063 -7.937 -10.696 0.06 0.00 C ATOM 345 O PRO A 20 -7.727 -8.290 -11.826 0.35 0.00 O ATOM 346 CB PRO A 20 -8.878 -9.895 -9.350 0.33 0.00 C ATOM 347 CG PRO A 20 -9.266 -10.945 -10.332 0.44 0.00 C ATOM 348 CD PRO A 20 -10.494 -10.427 -11.022 0.19 0.00 C ATOM 0 HA PRO A 20 -9.635 -7.822 -9.310 0.14 0.00 H new ATOM 0 HB2 PRO A 20 -7.809 -9.927 -9.139 0.33 0.00 H new ATOM 0 HB3 PRO A 20 -9.395 -10.031 -8.400 0.33 0.00 H new ATOM 0 HG2 PRO A 20 -8.464 -11.127 -11.047 0.44 0.00 H new ATOM 0 HG3 PRO A 20 -9.469 -11.892 -9.832 0.44 0.00 H new ATOM 0 HD2 PRO A 20 -10.564 -10.791 -12.047 0.19 0.00 H new ATOM 0 HD3 PRO A 20 -11.405 -10.737 -10.510 0.19 0.00 H new ATOM 356 N PRO A 21 -7.390 -6.989 -10.017 0.18 0.00 N ATOM 357 CA PRO A 21 -6.212 -6.309 -10.569 0.06 0.00 C ATOM 358 C PRO A 21 -5.046 -7.266 -10.791 0.05 0.00 C ATOM 359 O PRO A 21 -4.960 -8.315 -10.151 1.00 0.00 O ATOM 360 CB PRO A 21 -5.851 -5.269 -9.499 0.11 0.00 C ATOM 361 CG PRO A 21 -7.064 -5.150 -8.640 0.24 0.00 C ATOM 362 CD PRO A 21 -7.718 -6.500 -8.669 0.70 0.00 C ATOM 0 HA PRO A 21 -6.420 -5.873 -11.546 0.06 0.00 H new ATOM 0 HB2 PRO A 21 -4.987 -5.588 -8.917 0.11 0.00 H new ATOM 0 HB3 PRO A 21 -5.595 -4.311 -9.952 0.11 0.00 H new ATOM 0 HG2 PRO A 21 -6.796 -4.867 -7.622 0.24 0.00 H new ATOM 0 HG3 PRO A 21 -7.737 -4.381 -9.018 0.24 0.00 H new ATOM 0 HD2 PRO A 21 -7.325 -7.157 -7.893 0.70 0.00 H new ATOM 0 HD3 PRO A 21 -8.795 -6.432 -8.514 0.70 0.00 H new ATOM 370 N VAL A 22 -4.150 -6.900 -11.703 1.00 0.00 N ATOM 371 CA VAL A 22 -2.986 -7.727 -12.007 1.00 0.00 C ATOM 372 C VAL A 22 -1.778 -7.295 -11.184 0.06 0.00 C ATOM 373 O VAL A 22 -1.525 -6.101 -11.013 1.00 0.00 O ATOM 374 CB VAL A 22 -2.629 -7.669 -13.506 0.68 0.00 C ATOM 375 CG1 VAL A 22 -2.344 -6.238 -13.937 0.22 0.00 C ATOM 376 CG2 VAL A 22 -1.440 -8.569 -13.812 0.95 0.00 C ATOM 0 H VAL A 22 -4.207 -6.037 -12.244 1.00 0.00 H new ATOM 0 HA VAL A 22 -3.248 -8.753 -11.748 1.00 0.00 H new ATOM 0 HB VAL A 22 -3.486 -8.032 -14.073 0.68 0.00 H new ATOM 0 HG11 VAL A 22 -2.094 -6.220 -14.998 0.22 0.00 H new ATOM 0 HG12 VAL A 22 -3.226 -5.623 -13.762 0.22 0.00 H new ATOM 0 HG13 VAL A 22 -1.507 -5.844 -13.361 0.22 0.00 H new ATOM 0 HG21 VAL A 22 -1.205 -8.513 -14.875 0.95 0.00 H new ATOM 0 HG22 VAL A 22 -0.577 -8.242 -13.232 0.95 0.00 H new ATOM 0 HG23 VAL A 22 -1.685 -9.598 -13.548 0.95 0.00 H new ATOM 386 N GLY A 23 -1.036 -8.272 -10.673 0.97 0.00 N ATOM 387 CA GLY A 23 0.135 -7.973 -9.871 1.00 0.00 C ATOM 388 C GLY A 23 -0.205 -7.776 -8.407 1.00 0.00 C ATOM 389 O GLY A 23 0.653 -7.925 -7.537 0.10 0.00 O ATOM 0 H GLY A 23 -1.225 -9.266 -10.800 0.97 0.00 H new ATOM 0 HA2 GLY A 23 0.856 -8.785 -9.968 1.00 0.00 H new ATOM 0 HA3 GLY A 23 0.615 -7.073 -10.255 1.00 0.00 H new ATOM 393 N VAL A 24 -1.463 -7.438 -8.135 1.00 0.00 N ATOM 394 CA VAL A 24 -1.921 -7.221 -6.768 0.07 0.00 C ATOM 395 C VAL A 24 -3.319 -7.790 -6.561 1.00 0.00 C ATOM 396 O VAL A 24 -4.058 -8.011 -7.520 0.30 0.00 O ATOM 397 CB VAL A 24 -1.932 -5.722 -6.407 1.00 0.00 C ATOM 398 CG1 VAL A 24 -0.516 -5.167 -6.383 1.00 0.00 C ATOM 399 CG2 VAL A 24 -2.798 -4.942 -7.386 0.13 0.00 C ATOM 0 H VAL A 24 -2.183 -7.309 -8.845 1.00 0.00 H new ATOM 0 HA VAL A 24 -1.218 -7.739 -6.115 0.07 0.00 H new ATOM 0 HB VAL A 24 -2.359 -5.612 -5.410 1.00 0.00 H new ATOM 0 HG11 VAL A 24 -0.545 -4.108 -6.126 1.00 0.00 H new ATOM 0 HG12 VAL A 24 0.073 -5.705 -5.640 1.00 0.00 H new ATOM 0 HG13 VAL A 24 -0.060 -5.290 -7.365 1.00 0.00 H new ATOM 0 HG21 VAL A 24 -2.793 -3.886 -7.115 0.13 0.00 H new ATOM 0 HG22 VAL A 24 -2.403 -5.059 -8.395 0.13 0.00 H new ATOM 0 HG23 VAL A 24 -3.819 -5.321 -7.350 0.13 0.00 H new ATOM 409 N SER A 25 -3.675 -8.025 -5.302 0.14 0.00 N ATOM 410 CA SER A 25 -4.987 -8.568 -4.967 0.17 0.00 C ATOM 411 C SER A 25 -5.430 -8.110 -3.584 0.43 0.00 C ATOM 412 O SER A 25 -4.606 -7.905 -2.694 0.29 0.00 O ATOM 413 CB SER A 25 -4.958 -10.097 -5.024 0.36 0.00 C ATOM 414 OG SER A 25 -6.221 -10.644 -4.693 1.00 0.00 O ATOM 0 H SER A 25 -3.074 -7.848 -4.497 0.14 0.00 H new ATOM 0 HA SER A 25 -5.703 -8.196 -5.699 0.17 0.00 H new ATOM 0 HB2 SER A 25 -4.669 -10.421 -6.024 0.36 0.00 H new ATOM 0 HB3 SER A 25 -4.203 -10.475 -4.335 0.36 0.00 H new ATOM 0 HG SER A 25 -6.176 -11.622 -4.739 1.00 0.00 H new ATOM 420 N GLY A 26 -6.737 -7.948 -3.411 0.12 0.00 N ATOM 421 CA GLY A 26 -7.271 -7.520 -2.130 0.52 0.00 C ATOM 422 C GLY A 26 -8.723 -7.914 -1.946 0.23 0.00 C ATOM 423 O GLY A 26 -9.569 -7.589 -2.778 0.24 0.00 O ATOM 0 H GLY A 26 -7.438 -8.105 -4.135 0.12 0.00 H new ATOM 0 HA2 GLY A 26 -6.675 -7.955 -1.328 0.52 0.00 H new ATOM 0 HA3 GLY A 26 -7.178 -6.437 -2.045 0.52 0.00 H new ATOM 427 N ALA A 27 -9.012 -8.617 -0.857 0.19 0.00 N ATOM 428 CA ALA A 27 -10.372 -9.053 -0.566 0.26 0.00 C ATOM 429 C ALA A 27 -10.596 -9.180 0.941 0.68 0.00 C ATOM 430 O ALA A 27 -9.678 -9.541 1.679 1.00 0.00 O ATOM 431 CB ALA A 27 -10.663 -10.375 -1.260 1.00 0.00 C ATOM 0 H ALA A 27 -8.322 -8.897 -0.160 0.19 0.00 H new ATOM 0 HA ALA A 27 -11.060 -8.298 -0.947 0.26 0.00 H new ATOM 0 HB1 ALA A 27 -11.682 -10.688 -1.034 1.00 0.00 H new ATOM 0 HB2 ALA A 27 -10.552 -10.253 -2.337 1.00 0.00 H new ATOM 0 HB3 ALA A 27 -9.964 -11.133 -0.907 1.00 0.00 H new ATOM 437 N PRO A 28 -11.821 -8.888 1.418 0.17 0.00 N ATOM 438 CA PRO A 28 -12.151 -8.971 2.844 1.00 0.00 C ATOM 439 C PRO A 28 -12.230 -10.410 3.341 1.00 0.00 C ATOM 440 O PRO A 28 -13.184 -11.129 3.040 0.07 0.00 O ATOM 441 CB PRO A 28 -13.523 -8.303 2.929 0.11 0.00 C ATOM 442 CG PRO A 28 -14.124 -8.511 1.583 1.00 0.00 C ATOM 443 CD PRO A 28 -12.979 -8.454 0.610 0.08 0.00 C ATOM 0 HA PRO A 28 -11.390 -8.498 3.465 1.00 0.00 H new ATOM 0 HB2 PRO A 28 -14.135 -8.753 3.711 0.11 0.00 H new ATOM 0 HB3 PRO A 28 -13.434 -7.242 3.164 0.11 0.00 H new ATOM 0 HG2 PRO A 28 -14.637 -9.471 1.528 1.00 0.00 H new ATOM 0 HG3 PRO A 28 -14.864 -7.742 1.362 1.00 0.00 H new ATOM 0 HD2 PRO A 28 -13.143 -9.113 -0.243 0.08 0.00 H new ATOM 0 HD3 PRO A 28 -12.838 -7.448 0.214 0.08 0.00 H new ATOM 451 N SER A 29 -11.223 -10.824 4.101 1.00 0.00 N ATOM 452 CA SER A 29 -11.182 -12.176 4.647 0.20 0.00 C ATOM 453 C SER A 29 -12.115 -12.293 5.848 0.19 0.00 C ATOM 454 O SER A 29 -13.064 -11.521 5.979 0.10 0.00 O ATOM 455 CB SER A 29 -9.750 -12.537 5.054 1.00 0.00 C ATOM 456 OG SER A 29 -8.867 -12.448 3.950 0.83 0.00 O ATOM 0 H SER A 29 -10.424 -10.243 4.353 1.00 0.00 H new ATOM 0 HA SER A 29 -11.516 -12.872 3.878 0.20 0.00 H new ATOM 0 HB2 SER A 29 -9.415 -11.868 5.846 1.00 0.00 H new ATOM 0 HB3 SER A 29 -9.728 -13.548 5.460 1.00 0.00 H new ATOM 0 HG SER A 29 -7.960 -12.682 4.237 0.83 0.00 H new ATOM 462 N GLU A 30 -11.845 -13.261 6.720 0.34 0.00 N ATOM 463 CA GLU A 30 -12.664 -13.467 7.913 1.00 0.00 C ATOM 464 C GLU A 30 -12.785 -12.176 8.719 0.45 0.00 C ATOM 465 O GLU A 30 -13.692 -12.026 9.538 1.00 0.00 O ATOM 466 CB GLU A 30 -12.066 -14.573 8.784 1.00 0.00 C ATOM 467 CG GLU A 30 -10.629 -14.312 9.203 0.10 0.00 C ATOM 468 CD GLU A 30 -10.077 -15.400 10.103 0.52 0.00 C ATOM 469 OE1 GLU A 30 -9.619 -16.434 9.572 0.10 0.00 O ATOM 470 OE2 GLU A 30 -10.105 -15.219 11.338 0.11 0.00 O ATOM 0 H GLU A 30 -11.067 -13.914 6.624 0.34 0.00 H new ATOM 0 HA GLU A 30 -13.661 -13.768 7.592 1.00 0.00 H new ATOM 0 HB2 GLU A 30 -12.680 -14.691 9.677 1.00 0.00 H new ATOM 0 HB3 GLU A 30 -12.111 -15.516 8.239 1.00 0.00 H new ATOM 0 HG2 GLU A 30 -10.004 -14.230 8.314 0.10 0.00 H new ATOM 0 HG3 GLU A 30 -10.574 -13.354 9.721 0.10 0.00 H new ATOM 477 N ASN A 31 -11.864 -11.248 8.480 0.54 0.00 N ATOM 478 CA ASN A 31 -11.866 -9.966 9.173 0.05 0.00 C ATOM 479 C ASN A 31 -13.072 -9.128 8.768 1.00 0.00 C ATOM 480 O ASN A 31 -13.533 -9.196 7.627 1.00 0.00 O ATOM 481 CB ASN A 31 -10.573 -9.200 8.880 0.87 0.00 C ATOM 482 CG ASN A 31 -9.351 -9.887 9.458 1.00 0.00 C ATOM 483 OD1 ASN A 31 -9.528 -10.559 10.591 0.08 0.00 O flip ATOM 484 ND2 ASN A 31 -8.260 -9.811 8.896 0.14 0.00 N flip ATOM 0 H ASN A 31 -11.104 -11.361 7.809 0.54 0.00 H new ATOM 0 HA ASN A 31 -11.928 -10.162 10.243 0.05 0.00 H new ATOM 0 HB2 ASN A 31 -10.452 -9.096 7.802 0.87 0.00 H new ATOM 0 HB3 ASN A 31 -10.649 -8.193 9.291 0.87 0.00 H new ATOM 0 HD21 ASN A 31 -8.169 -9.284 8.027 0.14 0.00 H new ATOM 0 HD22 ASN A 31 -7.446 -10.275 9.299 0.14 0.00 H new ATOM 491 N ASN A 32 -13.586 -8.343 9.712 0.18 0.00 N ATOM 492 CA ASN A 32 -14.744 -7.490 9.464 1.00 0.00 C ATOM 493 C ASN A 32 -14.537 -6.611 8.231 1.00 0.00 C ATOM 494 O ASN A 32 -13.427 -6.507 7.706 1.00 0.00 O ATOM 495 CB ASN A 32 -15.030 -6.617 10.687 0.10 0.00 C ATOM 496 CG ASN A 32 -13.783 -5.931 11.208 0.08 0.00 C ATOM 497 OD1 ASN A 32 -13.438 -4.833 10.775 0.08 0.00 O ATOM 498 ND2 ASN A 32 -13.101 -6.577 12.146 1.00 0.00 N ATOM 0 H ASN A 32 -13.216 -8.281 10.660 0.18 0.00 H new ATOM 0 HA ASN A 32 -15.600 -8.138 9.276 1.00 0.00 H new ATOM 0 HB2 ASN A 32 -15.774 -5.864 10.427 0.10 0.00 H new ATOM 0 HB3 ASN A 32 -15.461 -7.232 11.477 0.10 0.00 H new ATOM 0 HD21 ASN A 32 -12.254 -6.164 12.537 1.00 0.00 H new ATOM 0 HD22 ASN A 32 -13.424 -7.487 12.476 1.00 0.00 H new ATOM 505 N ILE A 33 -15.614 -5.976 7.781 0.65 0.00 N ATOM 506 CA ILE A 33 -15.568 -5.116 6.603 0.24 0.00 C ATOM 507 C ILE A 33 -14.647 -3.912 6.808 1.00 0.00 C ATOM 508 O ILE A 33 -14.109 -3.366 5.844 0.35 0.00 O ATOM 509 CB ILE A 33 -16.980 -4.622 6.226 0.47 0.00 C ATOM 510 CG1 ILE A 33 -16.934 -3.806 4.930 0.25 0.00 C ATOM 511 CG2 ILE A 33 -17.577 -3.799 7.358 1.00 0.00 C ATOM 512 CD1 ILE A 33 -18.302 -3.441 4.394 0.54 0.00 C ATOM 0 H ILE A 33 -16.534 -6.041 8.217 0.65 0.00 H new ATOM 0 HA ILE A 33 -15.166 -5.720 5.790 0.24 0.00 H new ATOM 0 HB ILE A 33 -17.618 -5.491 6.062 0.47 0.00 H new ATOM 0 HG12 ILE A 33 -16.366 -2.892 5.106 0.25 0.00 H new ATOM 0 HG13 ILE A 33 -16.396 -4.375 4.172 0.25 0.00 H new ATOM 0 HG21 ILE A 33 -18.573 -3.459 7.074 1.00 0.00 H new ATOM 0 HG22 ILE A 33 -17.645 -4.412 8.257 1.00 0.00 H new ATOM 0 HG23 ILE A 33 -16.941 -2.936 7.555 1.00 0.00 H new ATOM 0 HD11 ILE A 33 -18.191 -2.864 3.476 0.54 0.00 H new ATOM 0 HD12 ILE A 33 -18.866 -4.350 4.186 0.54 0.00 H new ATOM 0 HD13 ILE A 33 -18.836 -2.845 5.134 0.54 0.00 H new ATOM 524 N MET A 34 -14.463 -3.503 8.059 0.15 0.00 N ATOM 525 CA MET A 34 -13.608 -2.360 8.367 0.14 0.00 C ATOM 526 C MET A 34 -12.130 -2.712 8.210 0.20 0.00 C ATOM 527 O MET A 34 -11.260 -1.867 8.418 1.00 0.00 O ATOM 528 CB MET A 34 -13.874 -1.858 9.789 1.00 0.00 C ATOM 529 CG MET A 34 -15.286 -1.335 9.996 0.27 0.00 C ATOM 530 SD MET A 34 -15.519 -0.579 11.617 0.37 0.00 S ATOM 531 CE MET A 34 -15.198 -1.973 12.695 1.00 0.00 C ATOM 0 H MET A 34 -14.892 -3.943 8.873 0.15 0.00 H new ATOM 0 HA MET A 34 -13.849 -1.569 7.657 0.14 0.00 H new ATOM 0 HB2 MET A 34 -13.690 -2.670 10.492 1.00 0.00 H new ATOM 0 HB3 MET A 34 -13.164 -1.065 10.024 1.00 0.00 H new ATOM 0 HG2 MET A 34 -15.515 -0.602 9.222 0.27 0.00 H new ATOM 0 HG3 MET A 34 -15.994 -2.155 9.877 0.27 0.00 H new ATOM 0 HE1 MET A 34 -15.556 -1.746 13.699 1.00 0.00 H new ATOM 0 HE2 MET A 34 -15.716 -2.854 12.315 1.00 0.00 H new ATOM 0 HE3 MET A 34 -14.126 -2.169 12.728 1.00 0.00 H new ATOM 541 N GLN A 35 -11.855 -3.958 7.837 1.00 0.00 N ATOM 542 CA GLN A 35 -10.481 -4.415 7.653 0.12 0.00 C ATOM 543 C GLN A 35 -10.367 -5.331 6.438 1.00 0.00 C ATOM 544 O GLN A 35 -10.971 -6.402 6.397 0.14 0.00 O ATOM 545 CB GLN A 35 -9.996 -5.143 8.909 0.17 0.00 C ATOM 546 CG GLN A 35 -8.538 -5.570 8.841 1.00 0.00 C ATOM 547 CD GLN A 35 -8.043 -6.160 10.147 0.12 0.00 C ATOM 548 OE1 GLN A 35 -8.125 -7.368 10.365 0.27 0.00 O ATOM 549 NE2 GLN A 35 -7.529 -5.308 11.026 0.60 0.00 N ATOM 0 H GLN A 35 -12.564 -4.669 7.656 1.00 0.00 H new ATOM 0 HA GLN A 35 -9.852 -3.542 7.481 0.12 0.00 H new ATOM 0 HB2 GLN A 35 -10.135 -4.492 9.772 0.17 0.00 H new ATOM 0 HB3 GLN A 35 -10.617 -6.024 9.070 0.17 0.00 H new ATOM 0 HG2 GLN A 35 -8.415 -6.304 8.045 1.00 0.00 H new ATOM 0 HG3 GLN A 35 -7.923 -4.709 8.579 1.00 0.00 H new ATOM 0 HE21 GLN A 35 -7.480 -4.314 10.804 0.60 0.00 H new ATOM 0 HE22 GLN A 35 -7.183 -5.648 11.923 0.60 0.00 H new ATOM 558 N TRP A 36 -9.586 -4.900 5.450 0.17 0.00 N ATOM 559 CA TRP A 36 -9.389 -5.677 4.230 1.00 0.00 C ATOM 560 C TRP A 36 -7.926 -6.075 4.072 0.07 0.00 C ATOM 561 O TRP A 36 -7.027 -5.256 4.262 1.00 0.00 O ATOM 562 CB TRP A 36 -9.844 -4.876 3.004 1.00 0.00 C ATOM 563 CG TRP A 36 -11.331 -4.875 2.795 0.10 0.00 C ATOM 564 CD1 TRP A 36 -12.301 -4.838 3.756 0.30 0.00 C ATOM 565 CD2 TRP A 36 -12.017 -4.908 1.537 0.14 0.00 C ATOM 566 NE1 TRP A 36 -13.546 -4.850 3.173 0.51 0.00 N ATOM 567 CE2 TRP A 36 -13.398 -4.892 1.812 1.00 0.00 C ATOM 568 CE3 TRP A 36 -11.599 -4.950 0.203 0.06 0.00 C ATOM 569 CZ2 TRP A 36 -14.360 -4.917 0.805 1.00 0.00 C ATOM 570 CZ3 TRP A 36 -12.555 -4.975 -0.796 1.00 0.00 C ATOM 571 CH2 TRP A 36 -13.921 -4.958 -0.489 0.14 0.00 C ATOM 0 H TRP A 36 -9.079 -4.015 5.471 0.17 0.00 H new ATOM 0 HA TRP A 36 -9.991 -6.582 4.307 1.00 0.00 H new ATOM 0 HB2 TRP A 36 -9.501 -3.847 3.107 1.00 0.00 H new ATOM 0 HB3 TRP A 36 -9.362 -5.285 2.116 1.00 0.00 H new ATOM 0 HD1 TRP A 36 -12.117 -4.804 4.820 0.30 0.00 H new ATOM 0 HE1 TRP A 36 -14.435 -4.831 3.673 0.51 0.00 H new ATOM 0 HE3 TRP A 36 -10.547 -4.963 -0.043 0.06 0.00 H new ATOM 0 HZ2 TRP A 36 -15.414 -4.904 1.038 1.00 0.00 H new ATOM 0 HZ3 TRP A 36 -12.243 -5.008 -1.829 1.00 0.00 H new ATOM 0 HH2 TRP A 36 -14.643 -4.978 -1.292 0.14 0.00 H new ATOM 582 N ASN A 37 -7.693 -7.335 3.717 0.05 0.00 N ATOM 583 CA ASN A 37 -6.336 -7.837 3.536 1.00 0.00 C ATOM 584 C ASN A 37 -5.968 -7.888 2.058 0.95 0.00 C ATOM 585 O ASN A 37 -6.686 -8.473 1.247 0.26 0.00 O ATOM 586 CB ASN A 37 -6.198 -9.230 4.156 1.00 0.00 C ATOM 587 CG ASN A 37 -4.784 -9.773 4.057 0.15 0.00 C ATOM 588 OD1 ASN A 37 -3.799 -8.883 4.102 1.00 0.00 O flip ATOM 589 ND2 ASN A 37 -4.579 -10.983 3.946 0.19 0.00 N flip ATOM 0 H ASN A 37 -8.425 -8.025 3.549 0.05 0.00 H new ATOM 0 HA ASN A 37 -5.652 -7.153 4.039 1.00 0.00 H new ATOM 0 HB2 ASN A 37 -6.495 -9.189 5.204 1.00 0.00 H new ATOM 0 HB3 ASN A 37 -6.883 -9.916 3.657 1.00 0.00 H new ATOM 0 HD21 ASN A 37 -5.365 -11.633 3.915 0.19 0.00 H new ATOM 0 HD22 ASN A 37 -3.624 -11.335 3.885 0.19 0.00 H new ATOM 596 N ALA A 38 -4.842 -7.269 1.715 1.00 0.00 N ATOM 597 CA ALA A 38 -4.377 -7.237 0.334 0.12 0.00 C ATOM 598 C ALA A 38 -2.900 -7.603 0.243 0.17 0.00 C ATOM 599 O ALA A 38 -2.119 -7.310 1.147 0.05 0.00 O ATOM 600 CB ALA A 38 -4.623 -5.862 -0.271 0.05 0.00 C ATOM 0 H ALA A 38 -4.235 -6.783 2.375 1.00 0.00 H new ATOM 0 HA ALA A 38 -4.941 -7.978 -0.233 0.12 0.00 H new ATOM 0 HB1 ALA A 38 -4.272 -5.850 -1.303 0.05 0.00 H new ATOM 0 HB2 ALA A 38 -5.690 -5.640 -0.249 0.05 0.00 H new ATOM 0 HB3 ALA A 38 -4.084 -5.110 0.304 0.05 0.00 H new ATOM 606 N VAL A 39 -2.524 -8.248 -0.857 0.37 0.00 N ATOM 607 CA VAL A 39 -1.143 -8.660 -1.074 0.85 0.00 C ATOM 608 C VAL A 39 -0.561 -7.992 -2.317 0.06 0.00 C ATOM 609 O VAL A 39 -1.077 -8.160 -3.421 0.16 0.00 O ATOM 610 CB VAL A 39 -1.035 -10.189 -1.229 1.00 0.00 C ATOM 611 CG1 VAL A 39 0.418 -10.616 -1.363 0.12 0.00 C ATOM 612 CG2 VAL A 39 -1.697 -10.892 -0.055 0.10 0.00 C ATOM 0 H VAL A 39 -3.160 -8.497 -1.614 0.37 0.00 H new ATOM 0 HA VAL A 39 -0.575 -8.349 -0.197 0.85 0.00 H new ATOM 0 HB VAL A 39 -1.558 -10.478 -2.141 1.00 0.00 H new ATOM 0 HG11 VAL A 39 0.470 -11.699 -1.471 0.12 0.00 H new ATOM 0 HG12 VAL A 39 0.857 -10.142 -2.241 0.12 0.00 H new ATOM 0 HG13 VAL A 39 0.970 -10.313 -0.473 0.12 0.00 H new ATOM 0 HG21 VAL A 39 -1.611 -11.971 -0.182 0.10 0.00 H new ATOM 0 HG22 VAL A 39 -1.205 -10.595 0.871 0.10 0.00 H new ATOM 0 HG23 VAL A 39 -2.750 -10.615 -0.012 0.10 0.00 H new ATOM 622 N ILE A 40 0.516 -7.233 -2.127 0.52 0.00 N ATOM 623 CA ILE A 40 1.170 -6.544 -3.232 1.00 0.00 C ATOM 624 C ILE A 40 2.543 -7.145 -3.511 1.00 0.00 C ATOM 625 O ILE A 40 3.345 -7.336 -2.597 0.23 0.00 O ATOM 626 CB ILE A 40 1.327 -5.035 -2.949 0.19 0.00 C ATOM 627 CG1 ILE A 40 -0.049 -4.376 -2.803 0.13 0.00 C ATOM 628 CG2 ILE A 40 2.133 -4.367 -4.057 1.00 0.00 C ATOM 629 CD1 ILE A 40 0.016 -2.882 -2.553 0.40 0.00 C ATOM 0 H ILE A 40 0.953 -7.081 -1.218 0.52 0.00 H new ATOM 0 HA ILE A 40 0.532 -6.672 -4.106 1.00 0.00 H new ATOM 0 HB ILE A 40 1.869 -4.909 -2.011 0.19 0.00 H new ATOM 0 HG12 ILE A 40 -0.628 -4.559 -3.708 0.13 0.00 H new ATOM 0 HG13 ILE A 40 -0.584 -4.850 -1.980 0.13 0.00 H new ATOM 0 HG21 ILE A 40 2.235 -3.303 -3.842 1.00 0.00 H new ATOM 0 HG22 ILE A 40 3.122 -4.822 -4.113 1.00 0.00 H new ATOM 0 HG23 ILE A 40 1.620 -4.497 -5.010 1.00 0.00 H new ATOM 0 HD11 ILE A 40 -0.995 -2.484 -2.460 0.40 0.00 H new ATOM 0 HD12 ILE A 40 0.567 -2.691 -1.632 0.40 0.00 H new ATOM 0 HD13 ILE A 40 0.522 -2.395 -3.387 0.40 0.00 H new ATOM 641 N PHE A 41 2.805 -7.442 -4.778 0.49 0.00 N ATOM 642 CA PHE A 41 4.081 -8.021 -5.180 1.00 0.00 C ATOM 643 C PHE A 41 4.958 -6.972 -5.855 0.59 0.00 C ATOM 644 O PHE A 41 4.496 -6.225 -6.719 0.58 0.00 O ATOM 645 CB PHE A 41 3.857 -9.201 -6.125 0.08 0.00 C ATOM 646 CG PHE A 41 2.960 -10.264 -5.558 0.23 0.00 C ATOM 647 CD1 PHE A 41 3.309 -10.937 -4.397 1.00 0.00 C ATOM 648 CD2 PHE A 41 1.768 -10.594 -6.186 0.21 0.00 C ATOM 649 CE1 PHE A 41 2.487 -11.917 -3.875 1.00 0.00 C ATOM 650 CE2 PHE A 41 0.942 -11.573 -5.668 0.14 0.00 C ATOM 651 CZ PHE A 41 1.303 -12.237 -4.511 0.66 0.00 C ATOM 0 H PHE A 41 2.150 -7.291 -5.545 0.49 0.00 H new ATOM 0 HA PHE A 41 4.590 -8.378 -4.285 1.00 0.00 H new ATOM 0 HB2 PHE A 41 3.427 -8.833 -7.056 0.08 0.00 H new ATOM 0 HB3 PHE A 41 4.821 -9.645 -6.373 0.08 0.00 H new ATOM 0 HD1 PHE A 41 4.234 -10.692 -3.895 1.00 0.00 H new ATOM 0 HD2 PHE A 41 1.482 -10.079 -7.091 0.21 0.00 H new ATOM 0 HE1 PHE A 41 2.770 -12.433 -2.970 1.00 0.00 H new ATOM 0 HE2 PHE A 41 0.016 -11.819 -6.166 0.14 0.00 H new ATOM 0 HZ PHE A 41 0.661 -13.005 -4.105 0.66 0.00 H new ATOM 661 N GLY A 42 6.225 -6.922 -5.457 0.93 0.00 N ATOM 662 CA GLY A 42 7.148 -5.962 -6.033 1.00 0.00 C ATOM 663 C GLY A 42 7.282 -6.120 -7.537 1.00 0.00 C ATOM 664 O GLY A 42 7.214 -7.239 -8.048 0.43 0.00 O ATOM 0 H GLY A 42 6.629 -7.530 -4.745 0.93 0.00 H new ATOM 0 HA2 GLY A 42 6.807 -4.952 -5.805 1.00 0.00 H new ATOM 0 HA3 GLY A 42 8.127 -6.080 -5.569 1.00 0.00 H new ATOM 668 N PRO A 43 7.474 -5.014 -8.282 0.41 0.00 N ATOM 669 CA PRO A 43 7.617 -5.067 -9.741 0.45 0.00 C ATOM 670 C PRO A 43 8.917 -5.738 -10.169 0.42 0.00 C ATOM 671 O PRO A 43 9.666 -6.247 -9.336 0.14 0.00 O ATOM 672 CB PRO A 43 7.610 -3.593 -10.158 0.90 0.00 C ATOM 673 CG PRO A 43 8.064 -2.851 -8.949 0.06 0.00 C ATOM 674 CD PRO A 43 7.571 -3.636 -7.766 0.27 0.00 C ATOM 0 HA PRO A 43 6.826 -5.655 -10.206 0.45 0.00 H new ATOM 0 HB2 PRO A 43 8.277 -3.418 -11.002 0.90 0.00 H new ATOM 0 HB3 PRO A 43 6.614 -3.274 -10.467 0.90 0.00 H new ATOM 0 HG2 PRO A 43 9.150 -2.762 -8.932 0.06 0.00 H new ATOM 0 HG3 PRO A 43 7.661 -1.838 -8.940 0.06 0.00 H new ATOM 0 HD2 PRO A 43 8.261 -3.570 -6.925 0.27 0.00 H new ATOM 0 HD3 PRO A 43 6.606 -3.270 -7.416 0.27 0.00 H new ATOM 682 N GLU A 44 9.179 -5.735 -11.471 1.00 0.00 N ATOM 683 CA GLU A 44 10.387 -6.346 -12.011 1.00 0.00 C ATOM 684 C GLU A 44 11.531 -5.340 -12.071 0.07 0.00 C ATOM 685 O GLU A 44 11.335 -4.182 -12.438 0.07 0.00 O ATOM 686 CB GLU A 44 10.115 -6.917 -13.404 0.91 0.00 C ATOM 687 CG GLU A 44 11.332 -7.562 -14.048 0.05 0.00 C ATOM 688 CD GLU A 44 11.021 -8.176 -15.398 0.07 0.00 C ATOM 689 OE1 GLU A 44 11.007 -7.430 -16.400 0.39 0.00 O ATOM 690 OE2 GLU A 44 10.792 -9.401 -15.454 1.00 0.00 O ATOM 0 H GLU A 44 8.570 -5.315 -12.173 1.00 0.00 H new ATOM 0 HA GLU A 44 10.682 -7.157 -11.345 1.00 0.00 H new ATOM 0 HB2 GLU A 44 9.317 -7.656 -13.335 0.91 0.00 H new ATOM 0 HB3 GLU A 44 9.754 -6.117 -14.051 0.91 0.00 H new ATOM 0 HG2 GLU A 44 12.116 -6.814 -14.165 0.05 0.00 H new ATOM 0 HG3 GLU A 44 11.724 -8.333 -13.384 0.05 0.00 H new ATOM 697 N GLY A 45 12.728 -5.792 -11.708 1.00 0.00 N ATOM 698 CA GLY A 45 13.891 -4.924 -11.728 1.00 0.00 C ATOM 699 C GLY A 45 14.092 -4.187 -10.419 0.66 0.00 C ATOM 700 O GLY A 45 14.892 -3.254 -10.340 1.00 0.00 O ATOM 0 H GLY A 45 12.913 -6.747 -11.400 1.00 0.00 H new ATOM 0 HA2 GLY A 45 14.779 -5.518 -11.946 1.00 0.00 H new ATOM 0 HA3 GLY A 45 13.785 -4.200 -12.536 1.00 0.00 H new ATOM 704 N THR A 46 13.365 -4.609 -9.387 0.93 0.00 N ATOM 705 CA THR A 46 13.467 -3.983 -8.073 0.44 0.00 C ATOM 706 C THR A 46 13.992 -4.972 -7.033 1.00 0.00 C ATOM 707 O THR A 46 13.877 -6.183 -7.214 0.12 0.00 O ATOM 708 CB THR A 46 12.104 -3.441 -7.605 0.79 0.00 C ATOM 709 OG1 THR A 46 11.128 -4.490 -7.616 1.00 0.00 O ATOM 710 CG2 THR A 46 11.641 -2.303 -8.500 0.20 0.00 C ATOM 0 H THR A 46 12.700 -5.381 -9.436 0.93 0.00 H new ATOM 0 HA THR A 46 14.168 -3.154 -8.169 0.44 0.00 H new ATOM 0 HB THR A 46 12.217 -3.063 -6.589 0.79 0.00 H new ATOM 0 HG1 THR A 46 10.971 -4.781 -8.539 1.00 0.00 H new ATOM 0 HG21 THR A 46 10.676 -1.935 -8.151 0.20 0.00 H new ATOM 0 HG22 THR A 46 12.371 -1.494 -8.467 0.20 0.00 H new ATOM 0 HG23 THR A 46 11.543 -2.662 -9.524 0.20 0.00 H new ATOM 718 N PRO A 47 14.580 -4.471 -5.931 0.26 0.00 N ATOM 719 CA PRO A 47 15.115 -5.326 -4.866 0.99 0.00 C ATOM 720 C PRO A 47 14.013 -6.048 -4.100 0.55 0.00 C ATOM 721 O PRO A 47 14.285 -6.811 -3.173 1.00 0.00 O ATOM 722 CB PRO A 47 15.847 -4.349 -3.933 1.00 0.00 C ATOM 723 CG PRO A 47 15.941 -3.063 -4.685 0.36 0.00 C ATOM 724 CD PRO A 47 14.779 -3.047 -5.634 0.31 0.00 C ATOM 0 HA PRO A 47 15.757 -6.109 -5.269 0.99 0.00 H new ATOM 0 HB2 PRO A 47 15.301 -4.217 -2.999 1.00 0.00 H new ATOM 0 HB3 PRO A 47 16.837 -4.724 -3.673 1.00 0.00 H new ATOM 0 HG2 PRO A 47 15.901 -2.211 -4.006 0.36 0.00 H new ATOM 0 HG3 PRO A 47 16.885 -2.996 -5.225 0.36 0.00 H new ATOM 0 HD2 PRO A 47 13.893 -2.601 -5.181 0.31 0.00 H new ATOM 0 HD3 PRO A 47 15.000 -2.473 -6.534 0.31 0.00 H new ATOM 732 N PHE A 48 12.767 -5.804 -4.493 0.12 0.00 N ATOM 733 CA PHE A 48 11.624 -6.424 -3.837 1.00 0.00 C ATOM 734 C PHE A 48 10.946 -7.434 -4.758 0.22 0.00 C ATOM 735 O PHE A 48 9.983 -8.093 -4.367 0.08 0.00 O ATOM 736 CB PHE A 48 10.616 -5.355 -3.412 1.00 0.00 C ATOM 737 CG PHE A 48 11.250 -4.139 -2.795 0.22 0.00 C ATOM 738 CD1 PHE A 48 11.664 -3.080 -3.589 0.32 0.00 C ATOM 739 CD2 PHE A 48 11.428 -4.053 -1.424 0.76 0.00 C ATOM 740 CE1 PHE A 48 12.242 -1.959 -3.026 1.00 0.00 C ATOM 741 CE2 PHE A 48 12.006 -2.933 -0.856 0.45 0.00 C ATOM 742 CZ PHE A 48 12.414 -1.886 -1.658 1.00 0.00 C ATOM 0 H PHE A 48 12.524 -5.181 -5.263 0.12 0.00 H new ATOM 0 HA PHE A 48 11.986 -6.950 -2.954 1.00 0.00 H new ATOM 0 HB2 PHE A 48 10.035 -5.049 -4.282 1.00 0.00 H new ATOM 0 HB3 PHE A 48 9.916 -5.791 -2.699 1.00 0.00 H new ATOM 0 HD1 PHE A 48 11.533 -3.132 -4.660 0.32 0.00 H new ATOM 0 HD2 PHE A 48 11.112 -4.870 -0.792 0.76 0.00 H new ATOM 0 HE1 PHE A 48 12.559 -1.140 -3.655 1.00 0.00 H new ATOM 0 HE2 PHE A 48 12.138 -2.877 0.214 0.45 0.00 H new ATOM 0 HZ PHE A 48 12.867 -1.011 -1.216 1.00 0.00 H new ATOM 752 N GLU A 49 11.455 -7.546 -5.980 0.32 0.00 N ATOM 753 CA GLU A 49 10.894 -8.472 -6.959 0.14 0.00 C ATOM 754 C GLU A 49 10.944 -9.912 -6.454 0.30 0.00 C ATOM 755 O GLU A 49 10.082 -10.726 -6.787 0.94 0.00 O ATOM 756 CB GLU A 49 11.647 -8.359 -8.288 0.55 0.00 C ATOM 757 CG GLU A 49 13.075 -8.881 -8.231 0.13 0.00 C ATOM 758 CD GLU A 49 13.826 -8.669 -9.530 0.06 0.00 C ATOM 759 OE1 GLU A 49 13.735 -9.544 -10.417 0.69 0.00 O ATOM 760 OE2 GLU A 49 14.504 -7.628 -9.662 0.22 0.00 O ATOM 0 H GLU A 49 12.254 -7.008 -6.317 0.32 0.00 H new ATOM 0 HA GLU A 49 9.849 -8.202 -7.113 0.14 0.00 H new ATOM 0 HB2 GLU A 49 11.099 -8.909 -9.053 0.55 0.00 H new ATOM 0 HB3 GLU A 49 11.664 -7.314 -8.597 0.55 0.00 H new ATOM 0 HG2 GLU A 49 13.608 -8.382 -7.422 0.13 0.00 H new ATOM 0 HG3 GLU A 49 13.060 -9.945 -7.994 0.13 0.00 H new ATOM 767 N ASP A 50 11.953 -10.219 -5.645 1.00 0.00 N ATOM 768 CA ASP A 50 12.112 -11.564 -5.100 0.33 0.00 C ATOM 769 C ASP A 50 11.282 -11.747 -3.832 0.45 0.00 C ATOM 770 O ASP A 50 10.789 -12.841 -3.556 0.91 0.00 O ATOM 771 CB ASP A 50 13.586 -11.847 -4.805 0.10 0.00 C ATOM 772 CG ASP A 50 13.811 -13.249 -4.277 0.07 0.00 C ATOM 773 OD1 ASP A 50 13.896 -14.186 -5.100 1.00 0.00 O ATOM 774 OD2 ASP A 50 13.904 -13.413 -3.043 0.06 0.00 O ATOM 0 H ASP A 50 12.672 -9.557 -5.352 1.00 0.00 H new ATOM 0 HA ASP A 50 11.755 -12.272 -5.847 0.33 0.00 H new ATOM 0 HB2 ASP A 50 14.169 -11.707 -5.715 0.10 0.00 H new ATOM 0 HB3 ASP A 50 13.953 -11.124 -4.076 0.10 0.00 H new ATOM 779 N GLY A 51 11.131 -10.673 -3.064 0.37 0.00 N ATOM 780 CA GLY A 51 10.364 -10.740 -1.833 0.06 0.00 C ATOM 781 C GLY A 51 8.916 -10.329 -2.024 0.06 0.00 C ATOM 782 O GLY A 51 8.518 -9.923 -3.116 0.24 0.00 O ATOM 0 H GLY A 51 11.527 -9.756 -3.272 0.37 0.00 H new ATOM 0 HA2 GLY A 51 10.401 -11.757 -1.442 0.06 0.00 H new ATOM 0 HA3 GLY A 51 10.826 -10.094 -1.086 0.06 0.00 H new ATOM 786 N THR A 52 8.126 -10.435 -0.959 0.58 0.00 N ATOM 787 CA THR A 52 6.715 -10.069 -1.013 0.09 0.00 C ATOM 788 C THR A 52 6.303 -9.290 0.230 0.89 0.00 C ATOM 789 O THR A 52 6.773 -9.569 1.334 0.13 0.00 O ATOM 790 CB THR A 52 5.812 -11.308 -1.148 0.14 0.00 C ATOM 791 OG1 THR A 52 6.019 -12.190 -0.037 0.10 0.00 O ATOM 792 CG2 THR A 52 6.096 -12.046 -2.448 0.12 0.00 C ATOM 0 H THR A 52 8.440 -10.771 -0.049 0.58 0.00 H new ATOM 0 HA THR A 52 6.588 -9.441 -1.895 0.09 0.00 H new ATOM 0 HB THR A 52 4.774 -10.974 -1.157 0.14 0.00 H new ATOM 0 HG1 THR A 52 5.439 -12.975 -0.130 0.10 0.00 H new ATOM 0 HG21 THR A 52 5.446 -12.918 -2.521 0.12 0.00 H new ATOM 0 HG22 THR A 52 5.909 -11.382 -3.292 0.12 0.00 H new ATOM 0 HG23 THR A 52 7.137 -12.368 -2.464 0.12 0.00 H new ATOM 800 N PHE A 53 5.418 -8.314 0.044 0.58 0.00 N ATOM 801 CA PHE A 53 4.940 -7.491 1.150 1.00 0.00 C ATOM 802 C PHE A 53 3.419 -7.540 1.255 0.66 0.00 C ATOM 803 O PHE A 53 2.716 -7.605 0.245 0.08 0.00 O ATOM 804 CB PHE A 53 5.407 -6.044 0.975 1.00 0.00 C ATOM 805 CG PHE A 53 6.871 -5.848 1.251 0.08 0.00 C ATOM 806 CD1 PHE A 53 7.823 -6.223 0.318 1.00 0.00 C ATOM 807 CD2 PHE A 53 7.294 -5.286 2.446 0.13 0.00 C ATOM 808 CE1 PHE A 53 9.171 -6.043 0.570 0.43 0.00 C ATOM 809 CE2 PHE A 53 8.641 -5.103 2.704 1.00 0.00 C ATOM 810 CZ PHE A 53 9.579 -5.483 1.764 0.36 0.00 C ATOM 0 H PHE A 53 5.018 -8.074 -0.863 0.58 0.00 H new ATOM 0 HA PHE A 53 5.359 -7.892 2.073 1.00 0.00 H new ATOM 0 HB2 PHE A 53 5.191 -5.722 -0.044 1.00 0.00 H new ATOM 0 HB3 PHE A 53 4.831 -5.402 1.641 1.00 0.00 H new ATOM 0 HD1 PHE A 53 7.509 -6.661 -0.618 1.00 0.00 H new ATOM 0 HD2 PHE A 53 6.564 -4.988 3.184 0.13 0.00 H new ATOM 0 HE1 PHE A 53 9.903 -6.340 -0.166 0.43 0.00 H new ATOM 0 HE2 PHE A 53 8.958 -4.664 3.638 1.00 0.00 H new ATOM 0 HZ PHE A 53 10.631 -5.342 1.963 0.36 0.00 H new ATOM 820 N LYS A 54 2.920 -7.508 2.488 0.06 0.00 N ATOM 821 CA LYS A 54 1.482 -7.548 2.739 0.44 0.00 C ATOM 822 C LYS A 54 1.034 -6.292 3.482 0.29 0.00 C ATOM 823 O LYS A 54 1.723 -5.815 4.384 1.00 0.00 O ATOM 824 CB LYS A 54 1.124 -8.794 3.549 0.20 0.00 C ATOM 825 CG LYS A 54 1.511 -10.097 2.866 1.00 0.00 C ATOM 826 CD LYS A 54 1.343 -11.287 3.797 0.75 0.00 C ATOM 827 CE LYS A 54 1.724 -12.590 3.113 0.62 0.00 C ATOM 828 NZ LYS A 54 3.117 -12.554 2.585 1.00 0.00 N ATOM 0 H LYS A 54 3.492 -7.454 3.331 0.06 0.00 H new ATOM 0 HA LYS A 54 0.964 -7.588 1.781 0.44 0.00 H new ATOM 0 HB2 LYS A 54 1.619 -8.741 4.519 0.20 0.00 H new ATOM 0 HB3 LYS A 54 0.051 -8.798 3.739 0.20 0.00 H new ATOM 0 HG2 LYS A 54 0.896 -10.240 1.977 1.00 0.00 H new ATOM 0 HG3 LYS A 54 2.547 -10.039 2.531 1.00 0.00 H new ATOM 0 HD2 LYS A 54 1.961 -11.146 4.684 0.75 0.00 H new ATOM 0 HD3 LYS A 54 0.308 -11.342 4.135 0.75 0.00 H new ATOM 0 HE2 LYS A 54 1.625 -13.414 3.820 0.62 0.00 H new ATOM 0 HE3 LYS A 54 1.031 -12.787 2.295 0.62 0.00 H new ATOM 0 HZ1 LYS A 54 3.304 -13.419 2.039 1.00 0.00 H new ATOM 0 HZ2 LYS A 54 3.234 -11.724 1.969 1.00 0.00 H new ATOM 0 HZ3 LYS A 54 3.787 -12.494 3.378 1.00 0.00 H new ATOM 842 N LEU A 55 -0.124 -5.759 3.100 0.33 0.00 N ATOM 843 CA LEU A 55 -0.654 -4.554 3.730 0.80 0.00 C ATOM 844 C LEU A 55 -2.154 -4.673 3.987 0.85 0.00 C ATOM 845 O LEU A 55 -2.822 -5.551 3.440 1.00 0.00 O ATOM 846 CB LEU A 55 -0.357 -3.307 2.876 0.23 0.00 C ATOM 847 CG LEU A 55 -0.506 -3.458 1.349 0.84 0.00 C ATOM 848 CD1 LEU A 55 0.640 -4.272 0.767 1.00 0.00 C ATOM 849 CD2 LEU A 55 -1.844 -4.084 0.984 0.06 0.00 C ATOM 0 H LEU A 55 -0.711 -6.142 2.359 0.33 0.00 H new ATOM 0 HA LEU A 55 -0.152 -4.443 4.691 0.80 0.00 H new ATOM 0 HB2 LEU A 55 -1.019 -2.505 3.204 0.23 0.00 H new ATOM 0 HB3 LEU A 55 0.663 -2.985 3.088 0.23 0.00 H new ATOM 0 HG LEU A 55 -0.471 -2.459 0.915 0.84 0.00 H new ATOM 0 HD11 LEU A 55 0.510 -4.363 -0.311 1.00 0.00 H new ATOM 0 HD12 LEU A 55 1.585 -3.772 0.978 1.00 0.00 H new ATOM 0 HD13 LEU A 55 0.646 -5.265 1.217 1.00 0.00 H new ATOM 0 HD21 LEU A 55 -1.919 -4.177 -0.099 0.06 0.00 H new ATOM 0 HD22 LEU A 55 -1.920 -5.072 1.439 0.06 0.00 H new ATOM 0 HD23 LEU A 55 -2.653 -3.452 1.351 0.06 0.00 H new ATOM 861 N VAL A 56 -2.674 -3.784 4.830 1.00 0.00 N ATOM 862 CA VAL A 56 -4.094 -3.782 5.161 1.00 0.00 C ATOM 863 C VAL A 56 -4.708 -2.406 4.923 0.14 0.00 C ATOM 864 O VAL A 56 -4.138 -1.385 5.310 0.12 0.00 O ATOM 865 CB VAL A 56 -4.335 -4.203 6.624 0.43 0.00 C ATOM 866 CG1 VAL A 56 -3.535 -3.326 7.575 1.00 0.00 C ATOM 867 CG2 VAL A 56 -5.818 -4.152 6.963 0.64 0.00 C ATOM 0 H VAL A 56 -2.132 -3.056 5.296 1.00 0.00 H new ATOM 0 HA VAL A 56 -4.574 -4.508 4.506 1.00 0.00 H new ATOM 0 HB VAL A 56 -3.995 -5.232 6.742 0.43 0.00 H new ATOM 0 HG11 VAL A 56 -3.720 -3.640 8.602 1.00 0.00 H new ATOM 0 HG12 VAL A 56 -2.472 -3.422 7.352 1.00 0.00 H new ATOM 0 HG13 VAL A 56 -3.839 -2.286 7.454 1.00 0.00 H new ATOM 0 HG21 VAL A 56 -5.965 -4.453 8.000 0.64 0.00 H new ATOM 0 HG22 VAL A 56 -6.188 -3.136 6.824 0.64 0.00 H new ATOM 0 HG23 VAL A 56 -6.365 -4.830 6.308 0.64 0.00 H new ATOM 877 N ILE A 57 -5.872 -2.387 4.283 1.00 0.00 N ATOM 878 CA ILE A 57 -6.565 -1.139 3.993 0.18 0.00 C ATOM 879 C ILE A 57 -7.735 -0.937 4.949 0.88 0.00 C ATOM 880 O ILE A 57 -8.729 -1.661 4.892 1.00 0.00 O ATOM 881 CB ILE A 57 -7.091 -1.101 2.541 0.72 0.00 C ATOM 882 CG1 ILE A 57 -5.972 -1.430 1.547 0.56 0.00 C ATOM 883 CG2 ILE A 57 -7.683 0.265 2.232 0.11 0.00 C ATOM 884 CD1 ILE A 57 -5.702 -2.913 1.402 0.71 0.00 C ATOM 0 H ILE A 57 -6.355 -3.223 3.955 1.00 0.00 H new ATOM 0 HA ILE A 57 -5.839 -0.336 4.123 0.18 0.00 H new ATOM 0 HB ILE A 57 -7.871 -1.856 2.440 0.72 0.00 H new ATOM 0 HG12 ILE A 57 -6.233 -1.020 0.571 0.56 0.00 H new ATOM 0 HG13 ILE A 57 -5.056 -0.933 1.867 0.56 0.00 H new ATOM 0 HG21 ILE A 57 -8.050 0.279 1.206 0.11 0.00 H new ATOM 0 HG22 ILE A 57 -8.508 0.467 2.915 0.11 0.00 H new ATOM 0 HG23 ILE A 57 -6.916 1.030 2.353 0.11 0.00 H new ATOM 0 HD11 ILE A 57 -4.898 -3.068 0.682 0.71 0.00 H new ATOM 0 HD12 ILE A 57 -5.409 -3.326 2.367 0.71 0.00 H new ATOM 0 HD13 ILE A 57 -6.604 -3.415 1.052 0.71 0.00 H new ATOM 896 N GLU A 58 -7.608 0.049 5.830 0.11 0.00 N ATOM 897 CA GLU A 58 -8.653 0.344 6.805 1.00 0.00 C ATOM 898 C GLU A 58 -9.559 1.468 6.310 1.00 0.00 C ATOM 899 O GLU A 58 -9.083 2.502 5.843 0.61 0.00 O ATOM 900 CB GLU A 58 -8.032 0.724 8.152 0.85 0.00 C ATOM 901 CG GLU A 58 -9.052 0.937 9.259 0.08 0.00 C ATOM 902 CD GLU A 58 -8.404 1.264 10.590 0.32 0.00 C ATOM 903 OE1 GLU A 58 -8.129 2.457 10.840 0.51 0.00 O ATOM 904 OE2 GLU A 58 -8.170 0.327 11.384 0.36 0.00 O ATOM 0 H GLU A 58 -6.792 0.658 5.890 0.11 0.00 H new ATOM 0 HA GLU A 58 -9.258 -0.553 6.934 1.00 0.00 H new ATOM 0 HB2 GLU A 58 -7.338 -0.060 8.456 0.85 0.00 H new ATOM 0 HB3 GLU A 58 -7.448 1.636 8.028 0.85 0.00 H new ATOM 0 HG2 GLU A 58 -9.725 1.747 8.978 0.08 0.00 H new ATOM 0 HG3 GLU A 58 -9.661 0.039 9.366 0.08 0.00 H new ATOM 911 N PHE A 59 -10.867 1.256 6.418 1.00 0.00 N ATOM 912 CA PHE A 59 -11.844 2.248 5.983 1.00 0.00 C ATOM 913 C PHE A 59 -12.597 2.828 7.176 0.52 0.00 C ATOM 914 O PHE A 59 -12.817 2.144 8.175 0.05 0.00 O ATOM 915 CB PHE A 59 -12.835 1.625 4.998 0.21 0.00 C ATOM 916 CG PHE A 59 -12.193 1.087 3.752 0.06 0.00 C ATOM 917 CD1 PHE A 59 -11.983 1.906 2.654 0.67 0.00 C ATOM 918 CD2 PHE A 59 -11.799 -0.241 3.677 1.00 0.00 C ATOM 919 CE1 PHE A 59 -11.393 1.413 1.506 0.12 0.00 C ATOM 920 CE2 PHE A 59 -11.209 -0.739 2.533 0.08 0.00 C ATOM 921 CZ PHE A 59 -11.006 0.089 1.445 0.38 0.00 C ATOM 0 H PHE A 59 -11.275 0.405 6.804 1.00 0.00 H new ATOM 0 HA PHE A 59 -11.306 3.055 5.485 1.00 0.00 H new ATOM 0 HB2 PHE A 59 -13.370 0.818 5.497 0.21 0.00 H new ATOM 0 HB3 PHE A 59 -13.576 2.374 4.719 0.21 0.00 H new ATOM 0 HD1 PHE A 59 -12.284 2.942 2.696 0.67 0.00 H new ATOM 0 HD2 PHE A 59 -11.956 -0.893 4.524 1.00 0.00 H new ATOM 0 HE1 PHE A 59 -11.235 2.062 0.658 0.12 0.00 H new ATOM 0 HE2 PHE A 59 -10.906 -1.775 2.488 0.08 0.00 H new ATOM 0 HZ PHE A 59 -10.545 -0.299 0.549 0.38 0.00 H new ATOM 931 N SER A 60 -12.988 4.095 7.063 0.06 0.00 N ATOM 932 CA SER A 60 -13.722 4.766 8.131 0.12 0.00 C ATOM 933 C SER A 60 -15.140 5.095 7.682 0.12 0.00 C ATOM 934 O SER A 60 -15.341 5.729 6.645 1.00 0.00 O ATOM 935 CB SER A 60 -12.998 6.045 8.556 0.51 0.00 C ATOM 936 OG SER A 60 -11.696 5.760 9.035 0.52 0.00 O ATOM 0 H SER A 60 -12.809 4.676 6.244 0.06 0.00 H new ATOM 0 HA SER A 60 -13.774 4.091 8.985 0.12 0.00 H new ATOM 0 HB2 SER A 60 -12.936 6.729 7.710 0.51 0.00 H new ATOM 0 HB3 SER A 60 -13.572 6.550 9.333 0.51 0.00 H new ATOM 0 HG SER A 60 -11.254 6.594 9.298 0.52 0.00 H new ATOM 942 N GLU A 61 -16.123 4.661 8.467 0.11 0.00 N ATOM 943 CA GLU A 61 -17.522 4.909 8.146 0.08 0.00 C ATOM 944 C GLU A 61 -17.818 6.405 8.135 0.33 0.00 C ATOM 945 O GLU A 61 -18.098 6.998 9.177 0.15 0.00 O ATOM 946 CB GLU A 61 -18.436 4.203 9.150 0.68 0.00 C ATOM 947 CG GLU A 61 -18.111 2.731 9.344 0.08 0.00 C ATOM 948 CD GLU A 61 -18.150 1.949 8.046 0.06 0.00 C ATOM 949 OE1 GLU A 61 -19.254 1.530 7.639 0.16 0.00 O ATOM 950 OE2 GLU A 61 -17.077 1.753 7.438 0.13 0.00 O ATOM 0 H GLU A 61 -15.975 4.136 9.329 0.11 0.00 H new ATOM 0 HA GLU A 61 -17.716 4.509 7.151 0.08 0.00 H new ATOM 0 HB2 GLU A 61 -18.365 4.711 10.112 0.68 0.00 H new ATOM 0 HB3 GLU A 61 -19.469 4.297 8.815 0.68 0.00 H new ATOM 0 HG2 GLU A 61 -17.121 2.637 9.791 0.08 0.00 H new ATOM 0 HG3 GLU A 61 -18.821 2.296 10.047 0.08 0.00 H new ATOM 957 N GLU A 62 -17.746 7.008 6.953 0.07 0.00 N ATOM 958 CA GLU A 62 -18.004 8.435 6.803 0.12 0.00 C ATOM 959 C GLU A 62 -18.706 8.724 5.479 0.25 0.00 C ATOM 960 O GLU A 62 -19.930 8.842 5.428 0.36 0.00 O ATOM 961 CB GLU A 62 -16.694 9.225 6.882 0.06 0.00 C ATOM 962 CG GLU A 62 -16.091 9.270 8.277 0.06 0.00 C ATOM 963 CD GLU A 62 -16.919 10.093 9.244 0.09 0.00 C ATOM 964 OE1 GLU A 62 -17.877 9.540 9.824 0.05 0.00 O ATOM 965 OE2 GLU A 62 -16.608 11.289 9.423 1.00 0.00 O ATOM 0 H GLU A 62 -17.511 6.529 6.084 0.07 0.00 H new ATOM 0 HA GLU A 62 -18.658 8.748 7.617 0.12 0.00 H new ATOM 0 HB2 GLU A 62 -15.971 8.782 6.197 0.06 0.00 H new ATOM 0 HB3 GLU A 62 -16.873 10.244 6.540 0.06 0.00 H new ATOM 0 HG2 GLU A 62 -15.995 8.254 8.660 0.06 0.00 H new ATOM 0 HG3 GLU A 62 -15.085 9.686 8.221 0.06 0.00 H new ATOM 972 N TYR A 63 -17.923 8.829 4.409 1.00 0.00 N ATOM 973 CA TYR A 63 -18.468 9.105 3.085 0.56 0.00 C ATOM 974 C TYR A 63 -17.650 8.398 2.004 0.19 0.00 C ATOM 975 O TYR A 63 -16.462 8.138 2.191 0.19 0.00 O ATOM 976 CB TYR A 63 -18.491 10.613 2.821 0.25 0.00 C ATOM 977 CG TYR A 63 -19.476 11.369 3.688 0.08 0.00 C ATOM 978 CD1 TYR A 63 -20.832 11.374 3.388 0.46 0.00 C ATOM 979 CD2 TYR A 63 -19.047 12.077 4.805 1.00 0.00 C ATOM 980 CE1 TYR A 63 -21.734 12.062 4.176 0.13 0.00 C ATOM 981 CE2 TYR A 63 -19.945 12.767 5.598 0.66 0.00 C ATOM 982 CZ TYR A 63 -21.286 12.756 5.279 0.19 0.00 C ATOM 983 OH TYR A 63 -22.182 13.443 6.067 0.30 0.00 O ATOM 0 H TYR A 63 -16.908 8.727 4.434 1.00 0.00 H new ATOM 0 HA TYR A 63 -19.489 8.724 3.052 0.56 0.00 H new ATOM 0 HB2 TYR A 63 -17.492 11.017 2.985 0.25 0.00 H new ATOM 0 HB3 TYR A 63 -18.736 10.786 1.773 0.25 0.00 H new ATOM 0 HD1 TYR A 63 -21.187 10.831 2.525 0.46 0.00 H new ATOM 0 HD2 TYR A 63 -17.997 12.088 5.057 1.00 0.00 H new ATOM 0 HE1 TYR A 63 -22.785 12.056 3.929 0.13 0.00 H new ATOM 0 HE2 TYR A 63 -19.598 13.312 6.463 0.66 0.00 H new ATOM 0 HH TYR A 63 -21.704 13.877 6.804 0.30 0.00 H new ATOM 993 N PRO A 64 -18.276 8.076 0.855 0.09 0.00 N ATOM 994 CA PRO A 64 -17.592 7.396 -0.252 1.00 0.00 C ATOM 995 C PRO A 64 -16.436 8.221 -0.806 0.91 0.00 C ATOM 996 O PRO A 64 -15.567 7.699 -1.505 0.09 0.00 O ATOM 997 CB PRO A 64 -18.686 7.228 -1.314 1.00 0.00 C ATOM 998 CG PRO A 64 -19.973 7.388 -0.579 0.07 0.00 C ATOM 999 CD PRO A 64 -19.690 8.344 0.542 0.30 0.00 C ATOM 0 HA PRO A 64 -17.148 6.453 0.066 1.00 0.00 H new ATOM 0 HB2 PRO A 64 -18.587 7.974 -2.102 1.00 0.00 H new ATOM 0 HB3 PRO A 64 -18.624 6.250 -1.791 1.00 0.00 H new ATOM 0 HG2 PRO A 64 -20.752 7.775 -1.235 0.07 0.00 H new ATOM 0 HG3 PRO A 64 -20.326 6.430 -0.196 0.07 0.00 H new ATOM 0 HD2 PRO A 64 -19.847 9.379 0.239 0.30 0.00 H new ATOM 0 HD3 PRO A 64 -20.335 8.161 1.401 0.30 0.00 H new ATOM 1007 N ASN A 65 -16.434 9.512 -0.491 0.18 0.00 N ATOM 1008 CA ASN A 65 -15.384 10.410 -0.956 0.79 0.00 C ATOM 1009 C ASN A 65 -14.343 10.641 0.134 1.00 0.00 C ATOM 1010 O ASN A 65 -13.254 11.152 -0.132 1.00 0.00 O ATOM 1011 CB ASN A 65 -15.983 11.747 -1.396 1.00 0.00 C ATOM 1012 CG ASN A 65 -16.722 12.446 -0.273 0.30 0.00 C ATOM 1013 OD1 ASN A 65 -17.920 12.237 -0.077 0.29 0.00 O ATOM 1014 ND2 ASN A 65 -16.010 13.284 0.473 1.00 0.00 N ATOM 0 H ASN A 65 -17.148 9.959 0.084 0.18 0.00 H new ATOM 0 HA ASN A 65 -14.893 9.942 -1.809 0.79 0.00 H new ATOM 0 HB2 ASN A 65 -15.187 12.395 -1.763 1.00 0.00 H new ATOM 0 HB3 ASN A 65 -16.667 11.579 -2.228 1.00 0.00 H new ATOM 0 HD21 ASN A 65 -16.454 13.784 1.243 1.00 0.00 H new ATOM 0 HD22 ASN A 65 -15.020 13.427 0.275 1.00 0.00 H new ATOM 1021 N LYS A 66 -14.685 10.263 1.362 0.06 0.00 N ATOM 1022 CA LYS A 66 -13.783 10.425 2.496 1.00 0.00 C ATOM 1023 C LYS A 66 -12.467 9.686 2.248 0.15 0.00 C ATOM 1024 O LYS A 66 -12.475 8.523 1.845 0.11 0.00 O ATOM 1025 CB LYS A 66 -14.440 9.899 3.776 1.00 0.00 C ATOM 1026 CG LYS A 66 -13.624 10.147 5.034 0.05 0.00 C ATOM 1027 CD LYS A 66 -13.753 11.585 5.507 0.07 0.00 C ATOM 1028 CE LYS A 66 -12.878 11.851 6.722 0.11 0.00 C ATOM 1029 NZ LYS A 66 -11.434 11.639 6.428 0.43 0.00 N ATOM 0 H LYS A 66 -15.583 9.841 1.597 0.06 0.00 H new ATOM 0 HA LYS A 66 -13.571 11.488 2.614 1.00 0.00 H new ATOM 0 HB2 LYS A 66 -15.417 10.368 3.890 1.00 0.00 H new ATOM 0 HB3 LYS A 66 -14.611 8.828 3.671 1.00 0.00 H new ATOM 0 HG2 LYS A 66 -13.956 9.472 5.823 0.05 0.00 H new ATOM 0 HG3 LYS A 66 -12.576 9.919 4.840 0.05 0.00 H new ATOM 0 HD2 LYS A 66 -13.472 12.262 4.700 0.07 0.00 H new ATOM 0 HD3 LYS A 66 -14.794 11.797 5.753 0.07 0.00 H new ATOM 0 HE2 LYS A 66 -13.032 12.875 7.062 0.11 0.00 H new ATOM 0 HE3 LYS A 66 -13.182 11.195 7.538 0.11 0.00 H new ATOM 0 HZ1 LYS A 66 -10.874 11.831 7.283 0.43 0.00 H new ATOM 0 HZ2 LYS A 66 -11.282 10.655 6.128 0.43 0.00 H new ATOM 0 HZ3 LYS A 66 -11.136 12.283 5.667 0.43 0.00 H new ATOM 1043 N PRO A 67 -11.315 10.347 2.484 0.05 0.00 N ATOM 1044 CA PRO A 67 -10.000 9.731 2.277 0.10 0.00 C ATOM 1045 C PRO A 67 -9.838 8.442 3.084 1.00 0.00 C ATOM 1046 O PRO A 67 -10.201 8.394 4.259 0.67 0.00 O ATOM 1047 CB PRO A 67 -9.007 10.795 2.766 0.18 0.00 C ATOM 1048 CG PRO A 67 -9.817 11.766 3.555 0.80 0.00 C ATOM 1049 CD PRO A 67 -11.197 11.733 2.965 0.87 0.00 C ATOM 0 HA PRO A 67 -9.848 9.446 1.236 0.10 0.00 H new ATOM 0 HB2 PRO A 67 -8.224 10.348 3.379 0.18 0.00 H new ATOM 0 HB3 PRO A 67 -8.514 11.286 1.927 0.18 0.00 H new ATOM 0 HG2 PRO A 67 -9.837 11.491 4.609 0.80 0.00 H new ATOM 0 HG3 PRO A 67 -9.391 12.768 3.495 0.80 0.00 H new ATOM 0 HD2 PRO A 67 -11.960 11.970 3.707 0.87 0.00 H new ATOM 0 HD3 PRO A 67 -11.307 12.453 2.154 0.87 0.00 H new ATOM 1057 N PRO A 68 -9.292 7.379 2.464 0.42 0.00 N ATOM 1058 CA PRO A 68 -9.093 6.095 3.133 0.64 0.00 C ATOM 1059 C PRO A 68 -7.783 6.035 3.910 0.09 0.00 C ATOM 1060 O PRO A 68 -6.973 6.962 3.859 0.18 0.00 O ATOM 1061 CB PRO A 68 -9.067 5.116 1.964 0.16 0.00 C ATOM 1062 CG PRO A 68 -8.446 5.889 0.848 1.00 0.00 C ATOM 1063 CD PRO A 68 -8.824 7.335 1.063 1.00 0.00 C ATOM 0 HA PRO A 68 -9.863 5.890 3.876 0.64 0.00 H new ATOM 0 HB2 PRO A 68 -8.485 4.226 2.203 0.16 0.00 H new ATOM 0 HB3 PRO A 68 -10.071 4.780 1.704 0.16 0.00 H new ATOM 0 HG2 PRO A 68 -7.363 5.767 0.848 1.00 0.00 H new ATOM 0 HG3 PRO A 68 -8.807 5.534 -0.117 1.00 0.00 H new ATOM 0 HD2 PRO A 68 -7.973 7.997 0.906 1.00 0.00 H new ATOM 0 HD3 PRO A 68 -9.605 7.650 0.371 1.00 0.00 H new ATOM 1071 N THR A 69 -7.580 4.935 4.627 0.10 0.00 N ATOM 1072 CA THR A 69 -6.371 4.742 5.416 1.00 0.00 C ATOM 1073 C THR A 69 -5.735 3.395 5.097 0.09 0.00 C ATOM 1074 O THR A 69 -6.411 2.368 5.099 0.18 0.00 O ATOM 1075 CB THR A 69 -6.664 4.814 6.926 0.54 0.00 C ATOM 1076 OG1 THR A 69 -7.349 6.034 7.235 0.41 0.00 O ATOM 1077 CG2 THR A 69 -5.378 4.735 7.734 0.13 0.00 C ATOM 0 H THR A 69 -8.242 4.160 4.677 0.10 0.00 H new ATOM 0 HA THR A 69 -5.683 5.546 5.154 1.00 0.00 H new ATOM 0 HB THR A 69 -7.294 3.964 7.190 0.54 0.00 H new ATOM 0 HG1 THR A 69 -7.533 6.071 8.197 0.41 0.00 H new ATOM 0 HG21 THR A 69 -5.612 4.788 8.797 0.13 0.00 H new ATOM 0 HG22 THR A 69 -4.871 3.794 7.521 0.13 0.00 H new ATOM 0 HG23 THR A 69 -4.727 5.567 7.464 0.13 0.00 H new ATOM 1085 N VAL A 70 -4.438 3.403 4.819 0.13 0.00 N ATOM 1086 CA VAL A 70 -3.726 2.173 4.494 1.00 0.00 C ATOM 1087 C VAL A 70 -2.341 2.146 5.136 0.17 0.00 C ATOM 1088 O VAL A 70 -1.697 3.184 5.295 1.00 0.00 O ATOM 1089 CB VAL A 70 -3.585 1.996 2.969 0.22 0.00 C ATOM 1090 CG1 VAL A 70 -2.683 3.069 2.380 1.00 0.00 C ATOM 1091 CG2 VAL A 70 -3.067 0.606 2.642 0.62 0.00 C ATOM 0 H VAL A 70 -3.859 4.243 4.812 0.13 0.00 H new ATOM 0 HA VAL A 70 -4.317 1.349 4.894 1.00 0.00 H new ATOM 0 HB VAL A 70 -4.571 2.107 2.517 0.22 0.00 H new ATOM 0 HG11 VAL A 70 -2.599 2.923 1.303 1.00 0.00 H new ATOM 0 HG12 VAL A 70 -3.108 4.052 2.581 1.00 0.00 H new ATOM 0 HG13 VAL A 70 -1.694 3.002 2.833 1.00 0.00 H new ATOM 0 HG21 VAL A 70 -2.973 0.498 1.561 0.62 0.00 H new ATOM 0 HG22 VAL A 70 -2.092 0.462 3.107 0.62 0.00 H new ATOM 0 HG23 VAL A 70 -3.764 -0.141 3.022 0.62 0.00 H new ATOM 1101 N ARG A 71 -1.894 0.949 5.506 0.15 0.00 N ATOM 1102 CA ARG A 71 -0.587 0.778 6.131 0.33 0.00 C ATOM 1103 C ARG A 71 -0.188 -0.694 6.157 0.08 0.00 C ATOM 1104 O ARG A 71 -1.027 -1.571 6.372 0.05 0.00 O ATOM 1105 CB ARG A 71 -0.599 1.343 7.553 0.08 0.00 C ATOM 1106 CG ARG A 71 -1.632 0.691 8.460 0.21 0.00 C ATOM 1107 CD ARG A 71 -1.619 1.303 9.851 1.00 0.00 C ATOM 1108 NE ARG A 71 -2.564 0.640 10.747 0.22 0.00 N ATOM 1109 CZ ARG A 71 -2.731 0.973 12.024 1.00 0.00 C ATOM 1110 NH1 ARG A 71 -2.026 1.962 12.556 1.00 0.00 N ATOM 1111 NH2 ARG A 71 -3.607 0.314 12.770 0.12 0.00 N ATOM 0 H ARG A 71 -2.419 0.083 5.383 0.15 0.00 H new ATOM 0 HA ARG A 71 0.147 1.325 5.539 0.33 0.00 H new ATOM 0 HB2 ARG A 71 0.390 1.216 7.993 0.08 0.00 H new ATOM 0 HB3 ARG A 71 -0.793 2.415 7.507 0.08 0.00 H new ATOM 0 HG2 ARG A 71 -2.624 0.802 8.022 0.21 0.00 H new ATOM 0 HG3 ARG A 71 -1.433 -0.378 8.530 0.21 0.00 H new ATOM 0 HD2 ARG A 71 -0.614 1.235 10.268 1.00 0.00 H new ATOM 0 HD3 ARG A 71 -1.865 2.363 9.784 1.00 0.00 H new ATOM 0 HE ARG A 71 -3.128 -0.122 10.371 0.22 0.00 H new ATOM 0 HH11 ARG A 71 -1.351 2.472 11.985 1.00 0.00 H new ATOM 0 HH12 ARG A 71 -2.158 2.213 13.536 1.00 0.00 H new ATOM 0 HH21 ARG A 71 -4.152 -0.447 12.365 0.12 0.00 H new ATOM 0 HH22 ARG A 71 -3.736 0.568 13.749 0.12 0.00 H new ATOM 1125 N PHE A 72 1.096 -0.958 5.937 0.67 0.00 N ATOM 1126 CA PHE A 72 1.607 -2.324 5.937 1.00 0.00 C ATOM 1127 C PHE A 72 1.492 -2.951 7.322 1.00 0.00 C ATOM 1128 O PHE A 72 1.598 -2.262 8.336 1.00 0.00 O ATOM 1129 CB PHE A 72 3.069 -2.344 5.483 0.95 0.00 C ATOM 1130 CG PHE A 72 3.260 -2.062 4.019 0.62 0.00 C ATOM 1131 CD1 PHE A 72 3.062 -0.788 3.512 0.23 0.00 C ATOM 1132 CD2 PHE A 72 3.643 -3.072 3.152 0.31 0.00 C ATOM 1133 CE1 PHE A 72 3.241 -0.528 2.165 0.81 0.00 C ATOM 1134 CE2 PHE A 72 3.823 -2.818 1.806 0.49 0.00 C ATOM 1135 CZ PHE A 72 3.623 -1.545 1.312 0.13 0.00 C ATOM 0 H PHE A 72 1.802 -0.244 5.756 0.67 0.00 H new ATOM 0 HA PHE A 72 1.005 -2.907 5.240 1.00 0.00 H new ATOM 0 HB2 PHE A 72 3.628 -1.607 6.060 0.95 0.00 H new ATOM 0 HB3 PHE A 72 3.497 -3.320 5.713 0.95 0.00 H new ATOM 0 HD1 PHE A 72 2.765 0.011 4.175 0.23 0.00 H new ATOM 0 HD2 PHE A 72 3.803 -4.070 3.533 0.31 0.00 H new ATOM 0 HE1 PHE A 72 3.082 0.469 1.781 0.81 0.00 H new ATOM 0 HE2 PHE A 72 4.120 -3.615 1.141 0.49 0.00 H new ATOM 0 HZ PHE A 72 3.765 -1.344 0.260 0.13 0.00 H new ATOM 1145 N LEU A 73 1.274 -4.262 7.357 0.49 0.00 N ATOM 1146 CA LEU A 73 1.155 -4.987 8.617 0.70 0.00 C ATOM 1147 C LEU A 73 2.531 -5.396 9.128 0.32 0.00 C ATOM 1148 O LEU A 73 2.754 -5.494 10.334 0.43 0.00 O ATOM 1149 CB LEU A 73 0.272 -6.224 8.441 0.66 0.00 C ATOM 1150 CG LEU A 73 -1.232 -5.947 8.358 1.00 0.00 C ATOM 1151 CD1 LEU A 73 -1.984 -7.203 7.951 1.00 0.00 C ATOM 1152 CD2 LEU A 73 -1.750 -5.424 9.691 1.00 0.00 C ATOM 0 H LEU A 73 1.176 -4.845 6.526 0.49 0.00 H new ATOM 0 HA LEU A 73 0.691 -4.327 9.350 0.70 0.00 H new ATOM 0 HB2 LEU A 73 0.580 -6.744 7.534 0.66 0.00 H new ATOM 0 HB3 LEU A 73 0.455 -6.902 9.275 0.66 0.00 H new ATOM 0 HG LEU A 73 -1.401 -5.184 7.598 1.00 0.00 H new ATOM 0 HD11 LEU A 73 -3.051 -6.987 7.897 1.00 0.00 H new ATOM 0 HD12 LEU A 73 -1.632 -7.538 6.975 1.00 0.00 H new ATOM 0 HD13 LEU A 73 -1.809 -7.987 8.688 1.00 0.00 H new ATOM 0 HD21 LEU A 73 -2.820 -5.232 9.615 1.00 0.00 H new ATOM 0 HD22 LEU A 73 -1.568 -6.166 10.468 1.00 0.00 H new ATOM 0 HD23 LEU A 73 -1.233 -4.499 9.945 1.00 0.00 H new ATOM 1164 N SER A 74 3.450 -5.636 8.198 1.00 0.00 N ATOM 1165 CA SER A 74 4.808 -6.030 8.550 0.06 0.00 C ATOM 1166 C SER A 74 5.762 -4.845 8.434 1.00 0.00 C ATOM 1167 O SER A 74 5.423 -3.819 7.842 1.00 0.00 O ATOM 1168 CB SER A 74 5.283 -7.172 7.652 0.06 0.00 C ATOM 1169 OG SER A 74 4.451 -8.312 7.793 0.11 0.00 O ATOM 0 H SER A 74 3.278 -5.564 7.195 1.00 0.00 H new ATOM 0 HA SER A 74 4.803 -6.373 9.585 0.06 0.00 H new ATOM 0 HB2 SER A 74 5.284 -6.845 6.612 0.06 0.00 H new ATOM 0 HB3 SER A 74 6.310 -7.434 7.905 0.06 0.00 H new ATOM 0 HG SER A 74 4.775 -9.028 7.207 0.11 0.00 H new ATOM 1175 N LYS A 75 6.954 -4.994 9.001 0.26 0.00 N ATOM 1176 CA LYS A 75 7.956 -3.935 8.959 0.13 0.00 C ATOM 1177 C LYS A 75 8.467 -3.726 7.537 0.12 0.00 C ATOM 1178 O LYS A 75 8.784 -4.686 6.834 1.00 0.00 O ATOM 1179 CB LYS A 75 9.123 -4.272 9.890 0.15 0.00 C ATOM 1180 CG LYS A 75 8.701 -4.546 11.329 1.00 0.00 C ATOM 1181 CD LYS A 75 8.031 -3.337 11.970 0.11 0.00 C ATOM 1182 CE LYS A 75 9.042 -2.281 12.388 0.40 0.00 C ATOM 1183 NZ LYS A 75 9.632 -1.572 11.220 1.00 0.00 N ATOM 0 H LYS A 75 7.250 -5.836 9.494 0.26 0.00 H new ATOM 0 HA LYS A 75 7.487 -3.011 9.296 0.13 0.00 H new ATOM 0 HB2 LYS A 75 9.645 -5.146 9.501 0.15 0.00 H new ATOM 0 HB3 LYS A 75 9.834 -3.446 9.880 0.15 0.00 H new ATOM 0 HG2 LYS A 75 8.016 -5.393 11.350 1.00 0.00 H new ATOM 0 HG3 LYS A 75 9.575 -4.829 11.915 1.00 0.00 H new ATOM 0 HD2 LYS A 75 7.321 -2.901 11.267 0.11 0.00 H new ATOM 0 HD3 LYS A 75 7.461 -3.658 12.842 0.11 0.00 H new ATOM 0 HE2 LYS A 75 8.558 -1.557 13.044 0.40 0.00 H new ATOM 0 HE3 LYS A 75 9.838 -2.751 12.965 0.40 0.00 H new ATOM 0 HZ1 LYS A 75 9.774 -0.570 11.458 1.00 0.00 H new ATOM 0 HZ2 LYS A 75 10.547 -2.003 10.978 1.00 0.00 H new ATOM 0 HZ3 LYS A 75 8.988 -1.647 10.407 1.00 0.00 H new ATOM 1197 N MET A 76 8.541 -2.467 7.119 0.52 0.00 N ATOM 1198 CA MET A 76 9.013 -2.131 5.781 1.00 0.00 C ATOM 1199 C MET A 76 9.859 -0.863 5.806 0.21 0.00 C ATOM 1200 O MET A 76 9.739 -0.042 6.715 0.88 0.00 O ATOM 1201 CB MET A 76 7.831 -1.952 4.822 1.00 0.00 C ATOM 1202 CG MET A 76 6.945 -0.759 5.151 0.07 0.00 C ATOM 1203 SD MET A 76 6.068 -0.946 6.716 0.39 0.00 S ATOM 1204 CE MET A 76 5.145 0.587 6.771 0.05 0.00 C ATOM 0 H MET A 76 8.280 -1.662 7.688 0.52 0.00 H new ATOM 0 HA MET A 76 9.633 -2.955 5.427 1.00 0.00 H new ATOM 0 HB2 MET A 76 8.213 -1.840 3.807 1.00 0.00 H new ATOM 0 HB3 MET A 76 7.224 -2.857 4.836 1.00 0.00 H new ATOM 0 HG2 MET A 76 7.557 0.142 5.189 0.07 0.00 H new ATOM 0 HG3 MET A 76 6.220 -0.619 4.349 0.07 0.00 H new ATOM 0 HE1 MET A 76 4.550 0.621 7.684 0.05 0.00 H new ATOM 0 HE2 MET A 76 5.837 1.429 6.757 0.05 0.00 H new ATOM 0 HE3 MET A 76 4.485 0.645 5.906 0.05 0.00 H new ATOM 1214 N PHE A 77 10.716 -0.710 4.801 1.00 0.00 N ATOM 1215 CA PHE A 77 11.585 0.458 4.708 0.26 0.00 C ATOM 1216 C PHE A 77 11.574 1.030 3.294 0.82 0.00 C ATOM 1217 O PHE A 77 11.920 0.342 2.334 0.89 0.00 O ATOM 1218 CB PHE A 77 13.011 0.088 5.119 0.14 0.00 C ATOM 1219 CG PHE A 77 13.962 1.251 5.114 0.33 0.00 C ATOM 1220 CD1 PHE A 77 13.914 2.206 6.116 0.24 0.00 C ATOM 1221 CD2 PHE A 77 14.904 1.388 4.107 0.25 0.00 C ATOM 1222 CE1 PHE A 77 14.788 3.276 6.115 0.32 0.00 C ATOM 1223 CE2 PHE A 77 15.780 2.456 4.101 0.06 0.00 C ATOM 1224 CZ PHE A 77 15.723 3.402 5.106 0.06 0.00 C ATOM 0 H PHE A 77 10.827 -1.380 4.040 1.00 0.00 H new ATOM 0 HA PHE A 77 11.208 1.222 5.388 0.26 0.00 H new ATOM 0 HB2 PHE A 77 12.990 -0.349 6.118 0.14 0.00 H new ATOM 0 HB3 PHE A 77 13.387 -0.680 4.443 0.14 0.00 H new ATOM 0 HD1 PHE A 77 13.185 2.113 6.907 0.24 0.00 H new ATOM 0 HD2 PHE A 77 14.954 0.652 3.318 0.25 0.00 H new ATOM 0 HE1 PHE A 77 14.740 4.013 6.903 0.32 0.00 H new ATOM 0 HE2 PHE A 77 16.510 2.551 3.310 0.06 0.00 H new ATOM 0 HZ PHE A 77 16.407 4.238 5.103 0.06 0.00 H new ATOM 1234 N HIS A 78 11.172 2.291 3.177 0.06 0.00 N ATOM 1235 CA HIS A 78 11.111 2.960 1.881 0.81 0.00 C ATOM 1236 C HIS A 78 11.722 4.360 1.965 0.07 0.00 C ATOM 1237 O HIS A 78 11.821 4.932 3.052 0.50 0.00 O ATOM 1238 CB HIS A 78 9.659 3.046 1.404 0.15 0.00 C ATOM 1239 CG HIS A 78 9.014 1.708 1.218 0.50 0.00 C ATOM 1240 ND1 HIS A 78 8.156 1.136 2.132 0.13 0.00 N ATOM 1241 CD2 HIS A 78 9.113 0.823 0.193 0.52 0.00 C ATOM 1242 CE1 HIS A 78 7.773 -0.053 1.647 1.00 0.00 C ATOM 1243 NE2 HIS A 78 8.323 -0.290 0.472 0.13 0.00 N ATOM 0 H HIS A 78 10.883 2.872 3.964 0.06 0.00 H new ATOM 0 HA HIS A 78 11.688 2.377 1.163 0.81 0.00 H new ATOM 0 HB2 HIS A 78 9.081 3.623 2.126 0.15 0.00 H new ATOM 0 HB3 HIS A 78 9.626 3.591 0.461 0.15 0.00 H new ATOM 0 HD2 HIS A 78 9.709 0.960 -0.697 0.52 0.00 H new ATOM 0 HE1 HIS A 78 7.101 -0.730 2.153 1.00 0.00 H new ATOM 0 HE2 HIS A 78 8.196 -1.117 -0.112 0.13 0.00 H new ATOM 1251 N PRO A 79 12.143 4.935 0.819 0.90 0.00 N ATOM 1252 CA PRO A 79 12.749 6.271 0.786 0.26 0.00 C ATOM 1253 C PRO A 79 11.833 7.342 1.369 1.00 0.00 C ATOM 1254 O PRO A 79 12.289 8.424 1.742 1.00 0.00 O ATOM 1255 CB PRO A 79 12.989 6.530 -0.704 0.30 0.00 C ATOM 1256 CG PRO A 79 12.996 5.182 -1.340 0.08 0.00 C ATOM 1257 CD PRO A 79 12.064 4.332 -0.524 0.71 0.00 C ATOM 0 HA PRO A 79 13.657 6.312 1.388 0.26 0.00 H new ATOM 0 HB2 PRO A 79 12.205 7.160 -1.125 0.30 0.00 H new ATOM 0 HB3 PRO A 79 13.935 7.047 -0.866 0.30 0.00 H new ATOM 0 HG2 PRO A 79 12.665 5.239 -2.377 0.08 0.00 H new ATOM 0 HG3 PRO A 79 14.001 4.760 -1.349 0.08 0.00 H new ATOM 0 HD2 PRO A 79 11.048 4.358 -0.917 0.71 0.00 H new ATOM 0 HD3 PRO A 79 12.376 3.288 -0.515 0.71 0.00 H new ATOM 1265 N ASN A 80 10.541 7.036 1.445 0.37 0.00 N ATOM 1266 CA ASN A 80 9.565 7.976 1.986 1.00 0.00 C ATOM 1267 C ASN A 80 8.466 7.249 2.752 0.29 0.00 C ATOM 1268 O ASN A 80 7.738 6.432 2.189 0.06 0.00 O ATOM 1269 CB ASN A 80 8.950 8.806 0.858 0.74 0.00 C ATOM 1270 CG ASN A 80 8.417 7.942 -0.268 0.16 0.00 C ATOM 1271 OD1 ASN A 80 7.257 7.531 -0.257 0.05 0.00 O ATOM 1272 ND2 ASN A 80 9.266 7.662 -1.250 0.31 0.00 N ATOM 0 H ASN A 80 10.146 6.146 1.139 0.37 0.00 H new ATOM 0 HA ASN A 80 10.085 8.638 2.679 1.00 0.00 H new ATOM 0 HB2 ASN A 80 8.141 9.416 1.259 0.74 0.00 H new ATOM 0 HB3 ASN A 80 9.700 9.491 0.463 0.74 0.00 H new ATOM 0 HD21 ASN A 80 8.965 7.085 -2.036 0.31 0.00 H new ATOM 0 HD22 ASN A 80 10.219 8.024 -1.219 0.31 0.00 H new ATOM 1279 N VAL A 81 8.354 7.553 4.042 1.00 0.00 N ATOM 1280 CA VAL A 81 7.342 6.939 4.891 0.44 0.00 C ATOM 1281 C VAL A 81 6.997 7.847 6.070 1.00 0.00 C ATOM 1282 O VAL A 81 7.792 8.704 6.456 0.54 0.00 O ATOM 1283 CB VAL A 81 7.809 5.564 5.418 0.63 0.00 C ATOM 1284 CG1 VAL A 81 8.938 5.723 6.425 0.17 0.00 C ATOM 1285 CG2 VAL A 81 6.646 4.797 6.024 1.00 0.00 C ATOM 0 H VAL A 81 8.955 8.223 4.522 1.00 0.00 H new ATOM 0 HA VAL A 81 6.452 6.794 4.279 0.44 0.00 H new ATOM 0 HB VAL A 81 8.191 4.990 4.574 0.63 0.00 H new ATOM 0 HG11 VAL A 81 9.249 4.741 6.781 0.17 0.00 H new ATOM 0 HG12 VAL A 81 9.783 6.221 5.949 0.17 0.00 H new ATOM 0 HG13 VAL A 81 8.592 6.322 7.268 0.17 0.00 H new ATOM 0 HG21 VAL A 81 6.997 3.832 6.389 1.00 0.00 H new ATOM 0 HG22 VAL A 81 6.226 5.367 6.853 1.00 0.00 H new ATOM 0 HG23 VAL A 81 5.879 4.641 5.266 1.00 0.00 H new ATOM 1295 N TYR A 82 5.809 7.658 6.635 0.11 0.00 N ATOM 1296 CA TYR A 82 5.368 8.462 7.772 0.08 0.00 C ATOM 1297 C TYR A 82 5.591 7.718 9.085 0.05 0.00 C ATOM 1298 O TYR A 82 5.986 6.552 9.090 0.45 0.00 O ATOM 1299 CB TYR A 82 3.890 8.828 7.626 0.25 0.00 C ATOM 1300 CG TYR A 82 3.604 9.761 6.469 0.55 0.00 C ATOM 1301 CD1 TYR A 82 3.358 9.263 5.196 0.12 0.00 C ATOM 1302 CD2 TYR A 82 3.580 11.136 6.652 0.07 0.00 C ATOM 1303 CE1 TYR A 82 3.094 10.113 4.137 0.19 0.00 C ATOM 1304 CE2 TYR A 82 3.317 11.992 5.600 0.15 0.00 C ATOM 1305 CZ TYR A 82 3.075 11.476 4.344 0.82 0.00 C ATOM 1306 OH TYR A 82 2.810 12.325 3.294 0.31 0.00 O ATOM 0 H TYR A 82 5.135 6.957 6.326 0.11 0.00 H new ATOM 0 HA TYR A 82 5.961 9.376 7.787 0.08 0.00 H new ATOM 0 HB2 TYR A 82 3.310 7.914 7.496 0.25 0.00 H new ATOM 0 HB3 TYR A 82 3.548 9.294 8.550 0.25 0.00 H new ATOM 0 HD1 TYR A 82 3.373 8.196 5.030 0.12 0.00 H new ATOM 0 HD2 TYR A 82 3.770 11.544 7.634 0.07 0.00 H new ATOM 0 HE1 TYR A 82 2.904 9.711 3.153 0.19 0.00 H new ATOM 0 HE2 TYR A 82 3.301 13.060 5.760 0.15 0.00 H new ATOM 0 HH TYR A 82 3.271 12.005 2.490 0.31 0.00 H new ATOM 1316 N ALA A 83 5.334 8.401 10.196 0.58 0.00 N ATOM 1317 CA ALA A 83 5.503 7.808 11.518 1.00 0.00 C ATOM 1318 C ALA A 83 4.461 6.723 11.768 0.71 0.00 C ATOM 1319 O ALA A 83 4.678 5.813 12.569 0.11 0.00 O ATOM 1320 CB ALA A 83 5.419 8.882 12.591 0.31 0.00 C ATOM 0 H ALA A 83 5.007 9.367 10.207 0.58 0.00 H new ATOM 0 HA ALA A 83 6.489 7.345 11.560 1.00 0.00 H new ATOM 0 HB1 ALA A 83 5.547 8.426 13.573 0.31 0.00 H new ATOM 0 HB2 ALA A 83 6.204 9.620 12.429 0.31 0.00 H new ATOM 0 HB3 ALA A 83 4.446 9.370 12.542 0.31 0.00 H new ATOM 1326 N ASP A 84 3.331 6.826 11.077 0.07 0.00 N ATOM 1327 CA ASP A 84 2.255 5.853 11.221 1.00 0.00 C ATOM 1328 C ASP A 84 2.452 4.685 10.261 0.12 0.00 C ATOM 1329 O ASP A 84 1.603 3.797 10.162 0.29 0.00 O ATOM 1330 CB ASP A 84 0.901 6.518 10.970 0.13 0.00 C ATOM 1331 CG ASP A 84 0.638 7.673 11.916 1.00 0.00 C ATOM 1332 OD1 ASP A 84 0.096 7.427 13.015 0.72 0.00 O ATOM 1333 OD2 ASP A 84 0.977 8.821 11.561 0.29 0.00 O ATOM 0 H ASP A 84 3.137 7.574 10.411 0.07 0.00 H new ATOM 0 HA ASP A 84 2.276 5.469 12.241 1.00 0.00 H new ATOM 0 HB2 ASP A 84 0.862 6.878 9.942 0.13 0.00 H new ATOM 0 HB3 ASP A 84 0.110 5.776 11.078 0.13 0.00 H new ATOM 1338 N GLY A 85 3.580 4.692 9.555 0.80 0.00 N ATOM 1339 CA GLY A 85 3.876 3.633 8.611 0.19 0.00 C ATOM 1340 C GLY A 85 3.014 3.704 7.366 1.00 0.00 C ATOM 1341 O GLY A 85 2.975 2.762 6.575 0.27 0.00 O ATOM 0 H GLY A 85 4.295 5.416 9.622 0.80 0.00 H new ATOM 0 HA2 GLY A 85 4.926 3.689 8.325 0.19 0.00 H new ATOM 0 HA3 GLY A 85 3.729 2.668 9.096 0.19 0.00 H new ATOM 1345 N SER A 86 2.321 4.825 7.192 0.31 0.00 N ATOM 1346 CA SER A 86 1.455 5.014 6.034 1.00 0.00 C ATOM 1347 C SER A 86 2.284 5.215 4.770 0.15 0.00 C ATOM 1348 O SER A 86 3.487 5.473 4.838 0.06 0.00 O ATOM 1349 CB SER A 86 0.534 6.214 6.250 1.00 0.00 C ATOM 1350 OG SER A 86 -0.321 6.407 5.137 0.80 0.00 O ATOM 0 H SER A 86 2.342 5.615 7.837 0.31 0.00 H new ATOM 0 HA SER A 86 0.846 4.118 5.913 1.00 0.00 H new ATOM 0 HB2 SER A 86 -0.063 6.061 7.149 1.00 0.00 H new ATOM 0 HB3 SER A 86 1.132 7.111 6.413 1.00 0.00 H new ATOM 0 HG SER A 86 -0.901 7.180 5.300 0.80 0.00 H new ATOM 1356 N ILE A 87 1.635 5.095 3.616 0.10 0.00 N ATOM 1357 CA ILE A 87 2.312 5.263 2.338 0.20 0.00 C ATOM 1358 C ILE A 87 2.116 6.675 1.794 0.15 0.00 C ATOM 1359 O ILE A 87 1.007 7.208 1.809 0.78 0.00 O ATOM 1360 CB ILE A 87 1.811 4.247 1.291 0.54 0.00 C ATOM 1361 CG1 ILE A 87 2.017 2.815 1.792 1.00 0.00 C ATOM 1362 CG2 ILE A 87 2.523 4.452 -0.038 1.00 0.00 C ATOM 1363 CD1 ILE A 87 0.903 2.319 2.688 0.08 0.00 C ATOM 0 H ILE A 87 0.640 4.882 3.541 0.10 0.00 H new ATOM 0 HA ILE A 87 3.372 5.088 2.520 0.20 0.00 H new ATOM 0 HB ILE A 87 0.744 4.410 1.139 0.54 0.00 H new ATOM 0 HG12 ILE A 87 2.106 2.148 0.934 1.00 0.00 H new ATOM 0 HG13 ILE A 87 2.960 2.762 2.336 1.00 0.00 H new ATOM 0 HG21 ILE A 87 2.156 3.726 -0.763 1.00 0.00 H new ATOM 0 HG22 ILE A 87 2.328 5.460 -0.403 1.00 0.00 H new ATOM 0 HG23 ILE A 87 3.596 4.317 0.099 1.00 0.00 H new ATOM 0 HD11 ILE A 87 1.117 1.298 3.004 0.08 0.00 H new ATOM 0 HD12 ILE A 87 0.828 2.962 3.565 0.08 0.00 H new ATOM 0 HD13 ILE A 87 -0.040 2.339 2.141 0.08 0.00 H new ATOM 1375 N CYS A 88 3.203 7.275 1.318 0.87 0.00 N ATOM 1376 CA CYS A 88 3.149 8.623 0.766 0.19 0.00 C ATOM 1377 C CYS A 88 2.748 8.589 -0.704 1.00 0.00 C ATOM 1378 O CYS A 88 3.590 8.411 -1.584 1.00 0.00 O ATOM 1379 CB CYS A 88 4.504 9.319 0.923 1.00 0.00 C ATOM 1380 SG CYS A 88 4.553 10.997 0.253 0.79 0.00 S ATOM 0 H CYS A 88 4.130 6.849 1.304 0.87 0.00 H new ATOM 0 HA CYS A 88 2.396 9.186 1.318 0.19 0.00 H new ATOM 0 HB2 CYS A 88 4.762 9.354 1.981 1.00 0.00 H new ATOM 0 HB3 CYS A 88 5.268 8.719 0.428 1.00 0.00 H new ATOM 0 HG CYS A 88 5.737 11.502 0.435 0.79 0.00 H new ATOM 1386 N LEU A 89 1.453 8.750 -0.962 0.42 0.00 N ATOM 1387 CA LEU A 89 0.936 8.737 -2.324 1.00 0.00 C ATOM 1388 C LEU A 89 0.127 9.998 -2.610 0.14 0.00 C ATOM 1389 O LEU A 89 -0.656 10.447 -1.773 0.64 0.00 O ATOM 1390 CB LEU A 89 0.066 7.496 -2.547 1.00 0.00 C ATOM 1391 CG LEU A 89 0.366 6.703 -3.822 0.53 0.00 C ATOM 1392 CD1 LEU A 89 0.199 7.578 -5.056 0.19 0.00 C ATOM 1393 CD2 LEU A 89 1.770 6.118 -3.767 0.90 0.00 C ATOM 0 H LEU A 89 0.743 8.891 -0.244 0.42 0.00 H new ATOM 0 HA LEU A 89 1.783 8.708 -3.010 1.00 0.00 H new ATOM 0 HB2 LEU A 89 0.184 6.832 -1.691 1.00 0.00 H new ATOM 0 HB3 LEU A 89 -0.979 7.805 -2.569 1.00 0.00 H new ATOM 0 HG LEU A 89 -0.348 5.882 -3.889 0.53 0.00 H new ATOM 0 HD11 LEU A 89 0.417 6.993 -5.949 0.19 0.00 H new ATOM 0 HD12 LEU A 89 -0.826 7.946 -5.105 0.19 0.00 H new ATOM 0 HD13 LEU A 89 0.886 8.423 -4.999 0.19 0.00 H new ATOM 0 HD21 LEU A 89 1.967 5.558 -4.681 0.90 0.00 H new ATOM 0 HD22 LEU A 89 2.497 6.925 -3.672 0.90 0.00 H new ATOM 0 HD23 LEU A 89 1.853 5.452 -2.908 0.90 0.00 H new ATOM 1405 N ASP A 90 0.323 10.565 -3.798 0.56 0.00 N ATOM 1406 CA ASP A 90 -0.385 11.777 -4.193 0.44 0.00 C ATOM 1407 C ASP A 90 -1.892 11.549 -4.214 0.11 0.00 C ATOM 1408 O ASP A 90 -2.674 12.472 -3.979 1.00 0.00 O ATOM 1409 CB ASP A 90 0.090 12.241 -5.571 0.19 0.00 C ATOM 1410 CG ASP A 90 1.562 12.601 -5.584 0.19 0.00 C ATOM 1411 OD1 ASP A 90 1.888 13.774 -5.302 1.00 0.00 O ATOM 1412 OD2 ASP A 90 2.389 11.712 -5.875 0.95 0.00 O ATOM 0 H ASP A 90 0.966 10.204 -4.503 0.56 0.00 H new ATOM 0 HA ASP A 90 -0.165 12.551 -3.458 0.44 0.00 H new ATOM 0 HB2 ASP A 90 -0.095 11.452 -6.300 0.19 0.00 H new ATOM 0 HB3 ASP A 90 -0.496 13.106 -5.882 0.19 0.00 H new ATOM 1417 N ILE A 91 -2.296 10.316 -4.497 0.16 0.00 N ATOM 1418 CA ILE A 91 -3.709 9.967 -4.550 0.07 0.00 C ATOM 1419 C ILE A 91 -4.351 10.078 -3.169 1.00 0.00 C ATOM 1420 O ILE A 91 -5.554 10.307 -3.049 0.09 0.00 O ATOM 1421 CB ILE A 91 -3.915 8.539 -5.094 1.00 0.00 C ATOM 1422 CG1 ILE A 91 -5.402 8.270 -5.341 0.38 0.00 C ATOM 1423 CG2 ILE A 91 -3.336 7.514 -4.126 1.00 0.00 C ATOM 1424 CD1 ILE A 91 -5.680 6.926 -5.982 0.46 0.00 C ATOM 0 H ILE A 91 -1.663 9.541 -4.693 0.16 0.00 H new ATOM 0 HA ILE A 91 -4.188 10.674 -5.227 0.07 0.00 H new ATOM 0 HB ILE A 91 -3.389 8.449 -6.044 1.00 0.00 H new ATOM 0 HG12 ILE A 91 -5.935 8.327 -4.392 0.38 0.00 H new ATOM 0 HG13 ILE A 91 -5.803 9.057 -5.980 0.38 0.00 H new ATOM 0 HG21 ILE A 91 -3.489 6.511 -4.524 1.00 0.00 H new ATOM 0 HG22 ILE A 91 -2.269 7.695 -4.000 1.00 0.00 H new ATOM 0 HG23 ILE A 91 -3.836 7.602 -3.161 1.00 0.00 H new ATOM 0 HD11 ILE A 91 -6.754 6.807 -6.126 0.46 0.00 H new ATOM 0 HD12 ILE A 91 -5.176 6.872 -6.947 0.46 0.00 H new ATOM 0 HD13 ILE A 91 -5.310 6.131 -5.335 0.46 0.00 H new ATOM 1436 N LEU A 92 -3.535 9.919 -2.130 1.00 0.00 N ATOM 1437 CA LEU A 92 -4.020 9.997 -0.756 0.41 0.00 C ATOM 1438 C LEU A 92 -4.449 11.420 -0.409 0.33 0.00 C ATOM 1439 O LEU A 92 -5.283 11.629 0.472 1.00 0.00 O ATOM 1440 CB LEU A 92 -2.936 9.527 0.217 0.07 0.00 C ATOM 1441 CG LEU A 92 -3.377 9.428 1.681 0.06 0.00 C ATOM 1442 CD1 LEU A 92 -4.441 8.354 1.848 0.16 0.00 C ATOM 1443 CD2 LEU A 92 -2.181 9.139 2.576 0.27 0.00 C ATOM 0 H LEU A 92 -2.535 9.735 -2.214 1.00 0.00 H new ATOM 0 HA LEU A 92 -4.888 9.344 -0.666 0.41 0.00 H new ATOM 0 HB2 LEU A 92 -2.579 8.549 -0.106 0.07 0.00 H new ATOM 0 HB3 LEU A 92 -2.091 10.212 0.154 0.07 0.00 H new ATOM 0 HG LEU A 92 -3.808 10.385 1.977 0.06 0.00 H new ATOM 0 HD11 LEU A 92 -4.741 8.299 2.894 0.16 0.00 H new ATOM 0 HD12 LEU A 92 -5.307 8.602 1.234 0.16 0.00 H new ATOM 0 HD13 LEU A 92 -4.038 7.391 1.535 0.16 0.00 H new ATOM 0 HD21 LEU A 92 -2.510 9.072 3.613 0.27 0.00 H new ATOM 0 HD22 LEU A 92 -1.723 8.195 2.278 0.27 0.00 H new ATOM 0 HD23 LEU A 92 -1.451 9.943 2.479 0.27 0.00 H new ATOM 1455 N GLN A 93 -3.872 12.394 -1.108 0.74 0.00 N ATOM 1456 CA GLN A 93 -4.197 13.798 -0.877 0.36 0.00 C ATOM 1457 C GLN A 93 -5.549 14.150 -1.492 0.18 0.00 C ATOM 1458 O GLN A 93 -6.344 13.267 -1.809 0.08 0.00 O ATOM 1459 CB GLN A 93 -3.102 14.700 -1.453 0.57 0.00 C ATOM 1460 CG GLN A 93 -1.867 14.793 -0.570 1.00 0.00 C ATOM 1461 CD GLN A 93 -1.204 13.449 -0.348 1.00 0.00 C ATOM 1462 OE1 GLN A 93 -1.544 12.723 0.586 0.11 0.00 O ATOM 1463 NE2 GLN A 93 -0.249 13.112 -1.206 0.38 0.00 N ATOM 0 H GLN A 93 -3.178 12.237 -1.838 0.74 0.00 H new ATOM 0 HA GLN A 93 -4.257 13.961 0.199 0.36 0.00 H new ATOM 0 HB2 GLN A 93 -2.811 14.324 -2.434 0.57 0.00 H new ATOM 0 HB3 GLN A 93 -3.508 15.700 -1.603 0.57 0.00 H new ATOM 0 HG2 GLN A 93 -1.150 15.476 -1.026 1.00 0.00 H new ATOM 0 HG3 GLN A 93 -2.146 15.220 0.394 1.00 0.00 H new ATOM 0 HE21 GLN A 93 0.000 13.745 -1.966 0.38 0.00 H new ATOM 0 HE22 GLN A 93 0.235 12.220 -1.105 0.38 0.00 H new ATOM 1472 N ASN A 94 -5.801 15.446 -1.658 0.09 0.00 N ATOM 1473 CA ASN A 94 -7.058 15.917 -2.234 0.33 0.00 C ATOM 1474 C ASN A 94 -7.231 15.423 -3.668 0.59 0.00 C ATOM 1475 O ASN A 94 -8.285 15.612 -4.275 0.06 0.00 O ATOM 1476 CB ASN A 94 -7.114 17.445 -2.195 1.00 0.00 C ATOM 1477 CG ASN A 94 -7.089 17.987 -0.780 1.00 0.00 C ATOM 1478 OD1 ASN A 94 -7.565 17.342 0.154 0.36 0.00 O ATOM 1479 ND2 ASN A 94 -6.529 19.180 -0.615 0.10 0.00 N ATOM 0 H ASN A 94 -5.151 16.189 -1.402 0.09 0.00 H new ATOM 0 HA ASN A 94 -7.875 15.511 -1.637 0.33 0.00 H new ATOM 0 HB2 ASN A 94 -6.270 17.851 -2.752 1.00 0.00 H new ATOM 0 HB3 ASN A 94 -8.020 17.786 -2.696 1.00 0.00 H new ATOM 0 HD21 ASN A 94 -6.481 19.597 0.315 0.10 0.00 H new ATOM 0 HD22 ASN A 94 -6.147 19.679 -1.418 0.10 0.00 H new ATOM 1486 N ARG A 95 -6.189 14.795 -4.206 1.00 0.00 N ATOM 1487 CA ARG A 95 -6.229 14.272 -5.569 0.14 0.00 C ATOM 1488 C ARG A 95 -7.097 13.019 -5.646 0.16 0.00 C ATOM 1489 O ARG A 95 -7.241 12.416 -6.710 0.97 0.00 O ATOM 1490 CB ARG A 95 -4.815 13.962 -6.058 0.31 0.00 C ATOM 1491 CG ARG A 95 -3.916 15.186 -6.113 0.08 0.00 C ATOM 1492 CD ARG A 95 -2.527 14.835 -6.615 0.27 0.00 C ATOM 1493 NE ARG A 95 -2.544 14.359 -7.996 0.47 0.00 N ATOM 1494 CZ ARG A 95 -1.447 14.072 -8.693 0.46 0.00 C ATOM 1495 NH1 ARG A 95 -0.249 14.211 -8.140 1.00 0.00 N ATOM 1496 NH2 ARG A 95 -1.547 13.647 -9.945 0.05 0.00 N ATOM 0 H ARG A 95 -5.307 14.636 -3.719 1.00 0.00 H new ATOM 0 HA ARG A 95 -6.668 15.034 -6.213 0.14 0.00 H new ATOM 0 HB2 ARG A 95 -4.365 13.219 -5.400 0.31 0.00 H new ATOM 0 HB3 ARG A 95 -4.871 13.516 -7.051 0.31 0.00 H new ATOM 0 HG2 ARG A 95 -4.361 15.936 -6.766 0.08 0.00 H new ATOM 0 HG3 ARG A 95 -3.844 15.630 -5.120 0.08 0.00 H new ATOM 0 HD2 ARG A 95 -1.884 15.712 -6.543 0.27 0.00 H new ATOM 0 HD3 ARG A 95 -2.094 14.068 -5.973 0.27 0.00 H new ATOM 0 HE ARG A 95 -3.448 14.240 -8.452 0.47 0.00 H new ATOM 0 HH11 ARG A 95 -0.166 14.539 -7.178 1.00 0.00 H new ATOM 0 HH12 ARG A 95 0.589 13.990 -8.677 1.00 0.00 H new ATOM 0 HH21 ARG A 95 -2.466 13.540 -10.375 0.05 0.00 H new ATOM 0 HH22 ARG A 95 -0.705 13.427 -10.478 0.05 0.00 H new ATOM 1510 N TRP A 96 -7.670 12.629 -4.509 0.44 0.00 N ATOM 1511 CA TRP A 96 -8.525 11.447 -4.444 0.46 0.00 C ATOM 1512 C TRP A 96 -9.898 11.727 -5.047 1.00 0.00 C ATOM 1513 O TRP A 96 -10.406 12.846 -4.970 0.60 0.00 O ATOM 1514 CB TRP A 96 -8.673 10.982 -2.992 0.56 0.00 C ATOM 1515 CG TRP A 96 -9.711 9.914 -2.808 1.00 0.00 C ATOM 1516 CD1 TRP A 96 -10.893 10.026 -2.134 0.13 0.00 C ATOM 1517 CD2 TRP A 96 -9.660 8.574 -3.310 0.08 0.00 C ATOM 1518 NE1 TRP A 96 -11.579 8.836 -2.183 1.00 0.00 N ATOM 1519 CE2 TRP A 96 -10.842 7.929 -2.898 0.56 0.00 C ATOM 1520 CE3 TRP A 96 -8.731 7.856 -4.064 0.33 0.00 C ATOM 1521 CZ2 TRP A 96 -11.117 6.602 -3.218 0.13 0.00 C ATOM 1522 CZ3 TRP A 96 -9.003 6.539 -4.383 0.10 0.00 C ATOM 1523 CH2 TRP A 96 -10.188 5.923 -3.958 0.94 0.00 C ATOM 0 H TRP A 96 -7.557 13.115 -3.620 0.44 0.00 H new ATOM 0 HA TRP A 96 -8.053 10.656 -5.027 0.46 0.00 H new ATOM 0 HB2 TRP A 96 -7.712 10.608 -2.639 0.56 0.00 H new ATOM 0 HB3 TRP A 96 -8.930 11.839 -2.369 0.56 0.00 H new ATOM 0 HD1 TRP A 96 -11.239 10.919 -1.635 0.13 0.00 H new ATOM 0 HE1 TRP A 96 -12.488 8.657 -1.757 1.00 0.00 H new ATOM 0 HE3 TRP A 96 -7.814 8.322 -4.393 0.33 0.00 H new ATOM 0 HZ2 TRP A 96 -12.031 6.126 -2.894 0.13 0.00 H new ATOM 0 HZ3 TRP A 96 -8.291 5.976 -4.969 0.10 0.00 H new ATOM 0 HH2 TRP A 96 -10.371 4.891 -4.220 0.94 0.00 H new ATOM 1534 N SER A 97 -10.492 10.700 -5.646 0.07 0.00 N ATOM 1535 CA SER A 97 -11.807 10.828 -6.262 0.09 0.00 C ATOM 1536 C SER A 97 -12.638 9.566 -6.026 0.20 0.00 C ATOM 1537 O SER A 97 -12.091 8.465 -5.945 0.78 0.00 O ATOM 1538 CB SER A 97 -11.664 11.087 -7.761 0.53 0.00 C ATOM 1539 OG SER A 97 -10.986 12.307 -8.005 1.00 0.00 O ATOM 0 H SER A 97 -10.082 9.769 -5.718 0.07 0.00 H new ATOM 0 HA SER A 97 -12.321 11.673 -5.803 0.09 0.00 H new ATOM 0 HB2 SER A 97 -11.119 10.265 -8.225 0.53 0.00 H new ATOM 0 HB3 SER A 97 -12.650 11.117 -8.224 0.53 0.00 H new ATOM 0 HG SER A 97 -10.906 12.449 -8.971 1.00 0.00 H new ATOM 1545 N PRO A 98 -13.975 9.704 -5.914 0.78 0.00 N ATOM 1546 CA PRO A 98 -14.865 8.563 -5.681 0.93 0.00 C ATOM 1547 C PRO A 98 -15.021 7.679 -6.915 0.09 0.00 C ATOM 1548 O PRO A 98 -15.714 6.662 -6.879 1.00 0.00 O ATOM 1549 CB PRO A 98 -16.198 9.222 -5.325 1.00 0.00 C ATOM 1550 CG PRO A 98 -16.161 10.538 -6.020 0.07 0.00 C ATOM 1551 CD PRO A 98 -14.721 10.975 -6.004 1.00 0.00 C ATOM 0 HA PRO A 98 -14.479 7.899 -4.907 0.93 0.00 H new ATOM 0 HB2 PRO A 98 -17.041 8.619 -5.662 1.00 0.00 H new ATOM 0 HB3 PRO A 98 -16.304 9.345 -4.247 1.00 0.00 H new ATOM 0 HG2 PRO A 98 -16.531 10.450 -7.042 0.07 0.00 H new ATOM 0 HG3 PRO A 98 -16.795 11.265 -5.513 0.07 0.00 H new ATOM 0 HD2 PRO A 98 -14.460 11.530 -6.905 1.00 0.00 H new ATOM 0 HD3 PRO A 98 -14.509 11.626 -5.156 1.00 0.00 H new ATOM 1559 N THR A 99 -14.371 8.072 -8.007 1.00 0.00 N ATOM 1560 CA THR A 99 -14.439 7.314 -9.251 1.00 0.00 C ATOM 1561 C THR A 99 -13.507 6.105 -9.214 0.12 0.00 C ATOM 1562 O THR A 99 -13.548 5.250 -10.101 0.09 0.00 O ATOM 1563 CB THR A 99 -14.085 8.189 -10.465 1.00 0.00 C ATOM 1564 OG1 THR A 99 -14.200 7.428 -11.673 0.09 0.00 O ATOM 1565 CG2 THR A 99 -12.676 8.730 -10.332 0.07 0.00 C ATOM 0 H THR A 99 -13.792 8.910 -8.055 1.00 0.00 H new ATOM 0 HA THR A 99 -15.468 6.969 -9.353 1.00 0.00 H new ATOM 0 HB THR A 99 -14.782 9.026 -10.503 1.00 0.00 H new ATOM 0 HG1 THR A 99 -14.059 6.478 -11.476 0.09 0.00 H new ATOM 0 HG21 THR A 99 -12.440 9.347 -11.199 0.07 0.00 H new ATOM 0 HG22 THR A 99 -12.601 9.332 -9.426 0.07 0.00 H new ATOM 0 HG23 THR A 99 -11.972 7.900 -10.275 0.07 0.00 H new ATOM 1573 N TYR A 100 -12.669 6.040 -8.183 0.13 0.00 N ATOM 1574 CA TYR A 100 -11.727 4.935 -8.029 0.16 0.00 C ATOM 1575 C TYR A 100 -12.268 3.889 -7.057 1.00 0.00 C ATOM 1576 O TYR A 100 -13.367 4.036 -6.521 0.70 0.00 O ATOM 1577 CB TYR A 100 -10.376 5.453 -7.536 0.75 0.00 C ATOM 1578 CG TYR A 100 -9.704 6.409 -8.495 0.32 0.00 C ATOM 1579 CD1 TYR A 100 -8.952 5.938 -9.564 0.07 0.00 C ATOM 1580 CD2 TYR A 100 -9.818 7.784 -8.329 1.00 0.00 C ATOM 1581 CE1 TYR A 100 -8.334 6.808 -10.441 0.18 0.00 C ATOM 1582 CE2 TYR A 100 -9.204 8.662 -9.202 0.33 0.00 C ATOM 1583 CZ TYR A 100 -8.463 8.169 -10.255 0.07 0.00 C ATOM 1584 OH TYR A 100 -7.849 9.039 -11.126 0.50 0.00 O ATOM 0 H TYR A 100 -12.623 6.739 -7.442 0.13 0.00 H new ATOM 0 HA TYR A 100 -11.595 4.466 -9.004 0.16 0.00 H new ATOM 0 HB2 TYR A 100 -10.516 5.953 -6.578 0.75 0.00 H new ATOM 0 HB3 TYR A 100 -9.714 4.605 -7.359 0.75 0.00 H new ATOM 0 HD1 TYR A 100 -8.849 4.873 -9.712 0.07 0.00 H new ATOM 0 HD2 TYR A 100 -10.396 8.173 -7.504 1.00 0.00 H new ATOM 0 HE1 TYR A 100 -7.753 6.425 -11.267 0.18 0.00 H new ATOM 0 HE2 TYR A 100 -9.304 9.728 -9.060 0.33 0.00 H new ATOM 0 HH TYR A 100 -8.039 9.961 -10.856 0.50 0.00 H new ATOM 1594 N ASP A 101 -11.491 2.831 -6.835 0.13 0.00 N ATOM 1595 CA ASP A 101 -11.897 1.761 -5.929 0.25 0.00 C ATOM 1596 C ASP A 101 -10.715 1.268 -5.097 0.10 0.00 C ATOM 1597 O ASP A 101 -9.624 1.837 -5.149 1.00 0.00 O ATOM 1598 CB ASP A 101 -12.497 0.597 -6.724 1.00 0.00 C ATOM 1599 CG ASP A 101 -13.655 1.032 -7.601 0.16 0.00 C ATOM 1600 OD1 ASP A 101 -13.401 1.477 -8.740 0.66 0.00 O ATOM 1601 OD2 ASP A 101 -14.815 0.930 -7.151 1.00 0.00 O ATOM 0 H ASP A 101 -10.579 2.693 -7.270 0.13 0.00 H new ATOM 0 HA ASP A 101 -12.651 2.160 -5.250 0.25 0.00 H new ATOM 0 HB2 ASP A 101 -11.723 0.148 -7.346 1.00 0.00 H new ATOM 0 HB3 ASP A 101 -12.838 -0.174 -6.033 1.00 0.00 H new ATOM 1606 N VAL A 102 -10.945 0.207 -4.327 0.10 0.00 N ATOM 1607 CA VAL A 102 -9.905 -0.369 -3.480 0.42 0.00 C ATOM 1608 C VAL A 102 -8.747 -0.901 -4.320 1.00 0.00 C ATOM 1609 O VAL A 102 -7.631 -1.063 -3.828 0.29 0.00 O ATOM 1610 CB VAL A 102 -10.466 -1.505 -2.598 0.08 0.00 C ATOM 1611 CG1 VAL A 102 -10.948 -2.665 -3.456 0.11 0.00 C ATOM 1612 CG2 VAL A 102 -9.427 -1.969 -1.589 0.09 0.00 C ATOM 0 H VAL A 102 -11.844 -0.272 -4.273 0.10 0.00 H new ATOM 0 HA VAL A 102 -9.538 0.428 -2.834 0.42 0.00 H new ATOM 0 HB VAL A 102 -11.321 -1.116 -2.045 0.08 0.00 H new ATOM 0 HG11 VAL A 102 -11.339 -3.454 -2.814 0.11 0.00 H new ATOM 0 HG12 VAL A 102 -11.735 -2.319 -4.127 0.11 0.00 H new ATOM 0 HG13 VAL A 102 -10.116 -3.054 -4.043 0.11 0.00 H new ATOM 0 HG21 VAL A 102 -9.845 -2.770 -0.979 0.09 0.00 H new ATOM 0 HG22 VAL A 102 -8.546 -2.336 -2.116 0.09 0.00 H new ATOM 0 HG23 VAL A 102 -9.144 -1.134 -0.948 0.09 0.00 H new ATOM 1622 N SER A 103 -9.024 -1.183 -5.588 0.70 0.00 N ATOM 1623 CA SER A 103 -8.007 -1.692 -6.500 0.65 0.00 C ATOM 1624 C SER A 103 -6.982 -0.611 -6.829 1.00 0.00 C ATOM 1625 O SER A 103 -5.808 -0.902 -7.060 0.05 0.00 O ATOM 1626 CB SER A 103 -8.657 -2.200 -7.788 1.00 0.00 C ATOM 1627 OG SER A 103 -9.574 -3.247 -7.519 0.10 0.00 O ATOM 0 H SER A 103 -9.946 -1.067 -6.008 0.70 0.00 H new ATOM 0 HA SER A 103 -7.494 -2.518 -6.008 0.65 0.00 H new ATOM 0 HB2 SER A 103 -9.173 -1.380 -8.286 1.00 0.00 H new ATOM 0 HB3 SER A 103 -7.886 -2.554 -8.473 1.00 0.00 H new ATOM 0 HG SER A 103 -9.977 -3.553 -8.358 0.10 0.00 H new ATOM 1633 N SER A 104 -7.438 0.639 -6.851 1.00 0.00 N ATOM 1634 CA SER A 104 -6.570 1.771 -7.164 0.09 0.00 C ATOM 1635 C SER A 104 -5.427 1.905 -6.159 0.52 0.00 C ATOM 1636 O SER A 104 -4.263 1.991 -6.549 0.20 0.00 O ATOM 1637 CB SER A 104 -7.384 3.064 -7.204 0.07 0.00 C ATOM 1638 OG SER A 104 -8.386 3.004 -8.205 1.00 0.00 O ATOM 0 H SER A 104 -8.406 0.894 -6.655 1.00 0.00 H new ATOM 0 HA SER A 104 -6.131 1.587 -8.145 0.09 0.00 H new ATOM 0 HB2 SER A 104 -7.846 3.237 -6.232 0.07 0.00 H new ATOM 0 HB3 SER A 104 -6.722 3.908 -7.397 0.07 0.00 H new ATOM 0 HG SER A 104 -7.986 3.192 -9.080 1.00 0.00 H new ATOM 1644 N ILE A 105 -5.759 1.929 -4.871 0.55 0.00 N ATOM 1645 CA ILE A 105 -4.745 2.061 -3.825 0.42 0.00 C ATOM 1646 C ILE A 105 -3.740 0.913 -3.884 0.10 0.00 C ATOM 1647 O ILE A 105 -2.548 1.110 -3.649 0.33 0.00 O ATOM 1648 CB ILE A 105 -5.383 2.123 -2.416 0.07 0.00 C ATOM 1649 CG1 ILE A 105 -4.315 1.990 -1.321 0.10 0.00 C ATOM 1650 CG2 ILE A 105 -6.438 1.042 -2.256 0.55 0.00 C ATOM 1651 CD1 ILE A 105 -3.234 3.047 -1.388 0.24 0.00 C ATOM 0 H ILE A 105 -6.716 1.859 -4.526 0.55 0.00 H new ATOM 0 HA ILE A 105 -4.222 2.999 -4.008 0.42 0.00 H new ATOM 0 HB ILE A 105 -5.863 3.096 -2.310 0.07 0.00 H new ATOM 0 HG12 ILE A 105 -4.800 2.041 -0.346 0.10 0.00 H new ATOM 0 HG13 ILE A 105 -3.852 1.006 -1.396 0.10 0.00 H new ATOM 0 HG21 ILE A 105 -6.874 1.104 -1.259 0.55 0.00 H new ATOM 0 HG22 ILE A 105 -7.219 1.183 -3.003 0.55 0.00 H new ATOM 0 HG23 ILE A 105 -5.979 0.063 -2.392 0.55 0.00 H new ATOM 0 HD11 ILE A 105 -2.517 2.886 -0.583 0.24 0.00 H new ATOM 0 HD12 ILE A 105 -2.722 2.983 -2.348 0.24 0.00 H new ATOM 0 HD13 ILE A 105 -3.683 4.034 -1.282 0.24 0.00 H new ATOM 1663 N LEU A 106 -4.225 -0.281 -4.204 0.95 0.00 N ATOM 1664 CA LEU A 106 -3.362 -1.455 -4.293 0.17 0.00 C ATOM 1665 C LEU A 106 -2.258 -1.248 -5.326 1.00 0.00 C ATOM 1666 O LEU A 106 -1.087 -1.513 -5.058 0.45 0.00 O ATOM 1667 CB LEU A 106 -4.190 -2.696 -4.645 0.05 0.00 C ATOM 1668 CG LEU A 106 -4.583 -3.583 -3.457 0.17 0.00 C ATOM 1669 CD1 LEU A 106 -5.148 -2.748 -2.317 1.00 0.00 C ATOM 1670 CD2 LEU A 106 -5.591 -4.635 -3.895 1.00 0.00 C ATOM 0 H LEU A 106 -5.208 -0.463 -4.406 0.95 0.00 H new ATOM 0 HA LEU A 106 -2.893 -1.605 -3.321 0.17 0.00 H new ATOM 0 HB2 LEU A 106 -5.099 -2.373 -5.152 0.05 0.00 H new ATOM 0 HB3 LEU A 106 -3.625 -3.299 -5.356 0.05 0.00 H new ATOM 0 HG LEU A 106 -3.686 -4.085 -3.095 0.17 0.00 H new ATOM 0 HD11 LEU A 106 -5.419 -3.401 -1.487 1.00 0.00 H new ATOM 0 HD12 LEU A 106 -4.397 -2.031 -1.984 1.00 0.00 H new ATOM 0 HD13 LEU A 106 -6.033 -2.213 -2.662 1.00 0.00 H new ATOM 0 HD21 LEU A 106 -5.861 -5.258 -3.042 1.00 0.00 H new ATOM 0 HD22 LEU A 106 -6.484 -4.144 -4.283 1.00 0.00 H new ATOM 0 HD23 LEU A 106 -5.152 -5.258 -4.674 1.00 0.00 H new ATOM 1682 N THR A 107 -2.639 -0.774 -6.507 0.38 0.00 N ATOM 1683 CA THR A 107 -1.680 -0.529 -7.580 0.34 0.00 C ATOM 1684 C THR A 107 -0.854 0.725 -7.312 0.10 0.00 C ATOM 1685 O THR A 107 0.283 0.840 -7.770 1.00 0.00 O ATOM 1686 CB THR A 107 -2.388 -0.382 -8.938 1.00 0.00 C ATOM 1687 OG1 THR A 107 -3.389 0.640 -8.861 0.06 0.00 O ATOM 1688 CG2 THR A 107 -3.029 -1.696 -9.360 0.94 0.00 C ATOM 0 H THR A 107 -3.605 -0.551 -6.746 0.38 0.00 H new ATOM 0 HA THR A 107 -1.017 -1.393 -7.612 0.34 0.00 H new ATOM 0 HB THR A 107 -1.642 -0.104 -9.683 1.00 0.00 H new ATOM 0 HG1 THR A 107 -3.423 0.997 -7.949 0.06 0.00 H new ATOM 0 HG21 THR A 107 -3.523 -1.567 -10.323 0.94 0.00 H new ATOM 0 HG22 THR A 107 -2.261 -2.464 -9.447 0.94 0.00 H new ATOM 0 HG23 THR A 107 -3.763 -1.999 -8.613 0.94 0.00 H new ATOM 1696 N SER A 108 -1.431 1.663 -6.568 1.00 0.00 N ATOM 1697 CA SER A 108 -0.750 2.914 -6.244 0.05 0.00 C ATOM 1698 C SER A 108 0.515 2.661 -5.430 0.33 0.00 C ATOM 1699 O SER A 108 1.570 3.229 -5.715 0.11 0.00 O ATOM 1700 CB SER A 108 -1.685 3.846 -5.471 1.00 0.00 C ATOM 1701 OG SER A 108 -2.806 4.211 -6.255 0.25 0.00 O ATOM 0 H SER A 108 -2.370 1.581 -6.177 1.00 0.00 H new ATOM 0 HA SER A 108 -0.465 3.389 -7.183 0.05 0.00 H new ATOM 0 HB2 SER A 108 -2.021 3.354 -4.558 1.00 0.00 H new ATOM 0 HB3 SER A 108 -1.142 4.741 -5.169 1.00 0.00 H new ATOM 0 HG SER A 108 -3.368 3.423 -6.408 0.25 0.00 H new ATOM 1707 N ILE A 109 0.403 1.810 -4.416 0.05 0.00 N ATOM 1708 CA ILE A 109 1.539 1.490 -3.561 0.08 0.00 C ATOM 1709 C ILE A 109 2.596 0.695 -4.325 0.12 0.00 C ATOM 1710 O ILE A 109 3.794 0.899 -4.139 0.27 0.00 O ATOM 1711 CB ILE A 109 1.106 0.689 -2.318 0.62 0.00 C ATOM 1712 CG1 ILE A 109 0.034 1.456 -1.539 0.25 0.00 C ATOM 1713 CG2 ILE A 109 2.307 0.398 -1.429 1.00 0.00 C ATOM 1714 CD1 ILE A 109 -0.560 0.670 -0.387 0.13 0.00 C ATOM 0 H ILE A 109 -0.462 1.330 -4.167 0.05 0.00 H new ATOM 0 HA ILE A 109 1.965 2.439 -3.237 0.08 0.00 H new ATOM 0 HB ILE A 109 0.683 -0.261 -2.645 0.62 0.00 H new ATOM 0 HG12 ILE A 109 0.468 2.378 -1.153 0.25 0.00 H new ATOM 0 HG13 ILE A 109 -0.765 1.742 -2.223 0.25 0.00 H new ATOM 0 HG21 ILE A 109 1.984 -0.168 -0.555 1.00 0.00 H new ATOM 0 HG22 ILE A 109 3.041 -0.183 -1.987 1.00 0.00 H new ATOM 0 HG23 ILE A 109 2.757 1.337 -1.107 1.00 0.00 H new ATOM 0 HD11 ILE A 109 -1.312 1.277 0.118 0.13 0.00 H new ATOM 0 HD12 ILE A 109 -1.024 -0.240 -0.768 0.13 0.00 H new ATOM 0 HD13 ILE A 109 0.228 0.407 0.319 0.13 0.00 H new ATOM 1726 N GLN A 110 2.140 -0.213 -5.185 0.07 0.00 N ATOM 1727 CA GLN A 110 3.048 -1.037 -5.977 0.84 0.00 C ATOM 1728 C GLN A 110 3.952 -0.166 -6.844 1.00 0.00 C ATOM 1729 O GLN A 110 5.099 -0.522 -7.118 0.29 0.00 O ATOM 1730 CB GLN A 110 2.256 -2.006 -6.861 0.89 0.00 C ATOM 1731 CG GLN A 110 3.139 -2.903 -7.713 0.05 0.00 C ATOM 1732 CD GLN A 110 2.345 -3.811 -8.631 0.13 0.00 C ATOM 1733 OE1 GLN A 110 2.038 -5.012 -8.154 1.00 0.00 O flip ATOM 1734 NE2 GLN A 110 2.014 -3.439 -9.757 0.38 0.00 N flip ATOM 0 H GLN A 110 1.150 -0.396 -5.350 0.07 0.00 H new ATOM 0 HA GLN A 110 3.671 -1.610 -5.290 0.84 0.00 H new ATOM 0 HB2 GLN A 110 1.622 -2.627 -6.229 0.89 0.00 H new ATOM 0 HB3 GLN A 110 1.595 -1.435 -7.512 0.89 0.00 H new ATOM 0 HG2 GLN A 110 3.807 -2.284 -8.312 0.05 0.00 H new ATOM 0 HG3 GLN A 110 3.766 -3.512 -7.062 0.05 0.00 H new ATOM 0 HE21 GLN A 110 2.272 -2.507 -10.083 0.38 0.00 H new ATOM 0 HE22 GLN A 110 1.482 -4.063 -10.364 0.38 0.00 H new ATOM 1743 N SER A 111 3.427 0.977 -7.273 0.21 0.00 N ATOM 1744 CA SER A 111 4.181 1.903 -8.111 1.00 0.00 C ATOM 1745 C SER A 111 5.302 2.568 -7.318 0.34 0.00 C ATOM 1746 O SER A 111 6.337 2.932 -7.874 0.45 0.00 O ATOM 1747 CB SER A 111 3.251 2.964 -8.698 1.00 0.00 C ATOM 1748 OG SER A 111 3.968 3.878 -9.509 0.11 0.00 O ATOM 0 H SER A 111 2.480 1.285 -7.053 0.21 0.00 H new ATOM 0 HA SER A 111 4.629 1.334 -8.926 1.00 0.00 H new ATOM 0 HB2 SER A 111 2.472 2.482 -9.289 1.00 0.00 H new ATOM 0 HB3 SER A 111 2.753 3.502 -7.891 1.00 0.00 H new ATOM 0 HG SER A 111 3.350 4.546 -9.874 0.11 0.00 H new ATOM 1754 N LEU A 112 5.085 2.724 -6.015 0.07 0.00 N ATOM 1755 CA LEU A 112 6.072 3.352 -5.142 0.05 0.00 C ATOM 1756 C LEU A 112 7.401 2.606 -5.200 0.48 0.00 C ATOM 1757 O LEU A 112 8.467 3.205 -5.058 0.15 0.00 O ATOM 1758 CB LEU A 112 5.555 3.386 -3.702 0.13 0.00 C ATOM 1759 CG LEU A 112 6.391 4.219 -2.729 0.53 0.00 C ATOM 1760 CD1 LEU A 112 6.279 5.701 -3.058 0.09 0.00 C ATOM 1761 CD2 LEU A 112 5.954 3.958 -1.296 1.00 0.00 C ATOM 0 H LEU A 112 4.234 2.424 -5.540 0.07 0.00 H new ATOM 0 HA LEU A 112 6.234 4.373 -5.489 0.05 0.00 H new ATOM 0 HB2 LEU A 112 4.537 3.776 -3.708 0.13 0.00 H new ATOM 0 HB3 LEU A 112 5.502 2.364 -3.328 0.13 0.00 H new ATOM 0 HG LEU A 112 7.435 3.923 -2.833 0.53 0.00 H new ATOM 0 HD11 LEU A 112 6.881 6.276 -2.355 0.09 0.00 H new ATOM 0 HD12 LEU A 112 6.639 5.877 -4.072 0.09 0.00 H new ATOM 0 HD13 LEU A 112 5.237 6.012 -2.984 0.09 0.00 H new ATOM 0 HD21 LEU A 112 6.559 4.558 -0.616 1.00 0.00 H new ATOM 0 HD22 LEU A 112 4.904 4.227 -1.181 1.00 0.00 H new ATOM 0 HD23 LEU A 112 6.086 2.902 -1.062 1.00 0.00 H new ATOM 1773 N LEU A 113 7.328 1.295 -5.410 1.00 0.00 N ATOM 1774 CA LEU A 113 8.524 0.463 -5.488 1.00 0.00 C ATOM 1775 C LEU A 113 9.205 0.627 -6.838 0.18 0.00 C ATOM 1776 O LEU A 113 10.426 0.761 -6.920 0.71 0.00 O ATOM 1777 CB LEU A 113 8.168 -1.009 -5.277 0.08 0.00 C ATOM 1778 CG LEU A 113 6.950 -1.268 -4.392 0.14 0.00 C ATOM 1779 CD1 LEU A 113 6.655 -2.757 -4.322 0.68 0.00 C ATOM 1780 CD2 LEU A 113 7.172 -0.698 -2.999 0.48 0.00 C ATOM 0 H LEU A 113 6.452 0.786 -5.529 1.00 0.00 H new ATOM 0 HA LEU A 113 9.207 0.784 -4.702 1.00 0.00 H new ATOM 0 HB2 LEU A 113 7.992 -1.466 -6.251 0.08 0.00 H new ATOM 0 HB3 LEU A 113 9.029 -1.514 -4.839 0.08 0.00 H new ATOM 0 HG LEU A 113 6.088 -0.767 -4.832 0.14 0.00 H new ATOM 0 HD11 LEU A 113 5.785 -2.926 -3.688 0.68 0.00 H new ATOM 0 HD12 LEU A 113 6.453 -3.135 -5.324 0.68 0.00 H new ATOM 0 HD13 LEU A 113 7.516 -3.279 -3.904 0.68 0.00 H new ATOM 0 HD21 LEU A 113 6.294 -0.892 -2.382 0.48 0.00 H new ATOM 0 HD22 LEU A 113 8.044 -1.171 -2.547 0.48 0.00 H new ATOM 0 HD23 LEU A 113 7.337 0.377 -3.068 0.48 0.00 H new ATOM 1792 N ASP A 114 8.402 0.607 -7.897 0.15 0.00 N ATOM 1793 CA ASP A 114 8.917 0.749 -9.251 0.26 0.00 C ATOM 1794 C ASP A 114 9.720 2.038 -9.395 1.00 0.00 C ATOM 1795 O ASP A 114 10.716 2.086 -10.119 0.96 0.00 O ATOM 1796 CB ASP A 114 7.767 0.738 -10.258 0.44 0.00 C ATOM 1797 CG ASP A 114 8.255 0.786 -11.693 0.23 0.00 C ATOM 1798 OD1 ASP A 114 8.738 -0.254 -12.189 1.00 0.00 O ATOM 1799 OD2 ASP A 114 8.154 1.860 -12.320 1.00 0.00 O ATOM 0 H ASP A 114 7.390 0.493 -7.841 0.15 0.00 H new ATOM 0 HA ASP A 114 9.577 -0.094 -9.453 0.26 0.00 H new ATOM 0 HB2 ASP A 114 7.167 -0.160 -10.111 0.44 0.00 H new ATOM 0 HB3 ASP A 114 7.115 1.591 -10.070 0.44 0.00 H new ATOM 1804 N GLU A 115 9.276 3.078 -8.699 1.00 0.00 N ATOM 1805 CA GLU A 115 9.946 4.373 -8.738 0.24 0.00 C ATOM 1806 C GLU A 115 10.430 4.776 -7.344 0.35 0.00 C ATOM 1807 O GLU A 115 9.652 5.286 -6.538 1.00 0.00 O ATOM 1808 CB GLU A 115 8.999 5.442 -9.287 0.42 0.00 C ATOM 1809 CG GLU A 115 8.489 5.141 -10.687 0.10 0.00 C ATOM 1810 CD GLU A 115 7.552 6.212 -11.209 0.74 0.00 C ATOM 1811 OE1 GLU A 115 8.045 7.201 -11.790 1.00 0.00 O ATOM 1812 OE2 GLU A 115 6.324 6.061 -11.037 1.00 0.00 O ATOM 0 H GLU A 115 8.452 3.050 -8.099 1.00 0.00 H new ATOM 0 HA GLU A 115 10.811 4.289 -9.396 0.24 0.00 H new ATOM 0 HB2 GLU A 115 8.148 5.543 -8.613 0.42 0.00 H new ATOM 0 HB3 GLU A 115 9.514 6.402 -9.296 0.42 0.00 H new ATOM 0 HG2 GLU A 115 9.337 5.043 -11.365 0.10 0.00 H new ATOM 0 HG3 GLU A 115 7.972 4.182 -10.683 0.10 0.00 H new ATOM 1819 N PRO A 116 11.723 4.544 -7.036 1.00 0.00 N ATOM 1820 CA PRO A 116 12.297 4.891 -5.729 0.50 0.00 C ATOM 1821 C PRO A 116 12.163 6.375 -5.411 0.57 0.00 C ATOM 1822 O PRO A 116 12.314 6.790 -4.263 0.36 0.00 O ATOM 1823 CB PRO A 116 13.773 4.505 -5.864 0.92 0.00 C ATOM 1824 CG PRO A 116 13.812 3.518 -6.977 0.18 0.00 C ATOM 1825 CD PRO A 116 12.722 3.924 -7.925 0.73 0.00 C ATOM 0 HA PRO A 116 11.784 4.377 -4.916 0.50 0.00 H new ATOM 0 HB2 PRO A 116 14.390 5.376 -6.087 0.92 0.00 H new ATOM 0 HB3 PRO A 116 14.154 4.072 -4.939 0.92 0.00 H new ATOM 0 HG2 PRO A 116 14.783 3.526 -7.472 0.18 0.00 H new ATOM 0 HG3 PRO A 116 13.651 2.505 -6.607 0.18 0.00 H new ATOM 0 HD2 PRO A 116 13.082 4.625 -8.678 0.73 0.00 H new ATOM 0 HD3 PRO A 116 12.311 3.067 -8.458 0.73 0.00 H new ATOM 1833 N ASN A 117 11.876 7.167 -6.436 0.06 0.00 N ATOM 1834 CA ASN A 117 11.722 8.608 -6.271 0.38 0.00 C ATOM 1835 C ASN A 117 10.326 9.056 -6.700 0.11 0.00 C ATOM 1836 O ASN A 117 10.036 9.138 -7.895 0.98 0.00 O ATOM 1837 CB ASN A 117 12.784 9.352 -7.086 1.00 0.00 C ATOM 1838 CG ASN A 117 12.690 10.858 -6.928 0.22 0.00 C ATOM 1839 OD1 ASN A 117 12.261 11.306 -5.753 0.17 0.00 O flip ATOM 1840 ND2 ASN A 117 13.004 11.610 -7.849 1.00 0.00 N flip ATOM 0 H ASN A 117 11.745 6.836 -7.392 0.06 0.00 H new ATOM 0 HA ASN A 117 11.853 8.846 -5.215 0.38 0.00 H new ATOM 0 HB2 ASN A 117 13.774 9.019 -6.776 1.00 0.00 H new ATOM 0 HB3 ASN A 117 12.676 9.093 -8.139 1.00 0.00 H new ATOM 0 HD21 ASN A 117 13.329 11.223 -8.735 1.00 0.00 H new ATOM 0 HD22 ASN A 117 12.940 12.621 -7.727 1.00 0.00 H new ATOM 1847 N PRO A 118 9.436 9.351 -5.732 0.05 0.00 N ATOM 1848 CA PRO A 118 8.073 9.793 -6.021 0.85 0.00 C ATOM 1849 C PRO A 118 7.992 11.297 -6.252 0.94 0.00 C ATOM 1850 O PRO A 118 6.926 11.899 -6.122 0.07 0.00 O ATOM 1851 CB PRO A 118 7.323 9.406 -4.752 1.00 0.00 C ATOM 1852 CG PRO A 118 8.330 9.561 -3.663 1.00 0.00 C ATOM 1853 CD PRO A 118 9.680 9.270 -4.277 0.25 0.00 C ATOM 0 HA PRO A 118 7.672 9.347 -6.931 0.85 0.00 H new ATOM 0 HB2 PRO A 118 6.459 10.051 -4.589 1.00 0.00 H new ATOM 0 HB3 PRO A 118 6.951 8.383 -4.807 1.00 0.00 H new ATOM 0 HG2 PRO A 118 8.302 10.569 -3.250 1.00 0.00 H new ATOM 0 HG3 PRO A 118 8.122 8.874 -2.842 1.00 0.00 H new ATOM 0 HD2 PRO A 118 10.429 9.995 -3.957 0.25 0.00 H new ATOM 0 HD3 PRO A 118 10.046 8.285 -3.988 0.25 0.00 H new ATOM 1861 N ASN A 119 9.130 11.899 -6.593 0.16 0.00 N ATOM 1862 CA ASN A 119 9.200 13.336 -6.840 0.44 0.00 C ATOM 1863 C ASN A 119 8.818 14.124 -5.590 0.11 0.00 C ATOM 1864 O ASN A 119 8.576 15.330 -5.654 0.59 0.00 O ATOM 1865 CB ASN A 119 8.289 13.725 -8.008 0.20 0.00 C ATOM 1866 CG ASN A 119 8.712 13.088 -9.318 1.00 0.00 C ATOM 1867 OD1 ASN A 119 10.012 12.883 -9.488 0.14 0.00 O flip ATOM 1868 ND2 ASN A 119 7.876 12.786 -10.171 0.39 0.00 N flip ATOM 0 H ASN A 119 10.019 11.411 -6.705 0.16 0.00 H new ATOM 0 HA ASN A 119 10.229 13.583 -7.100 0.44 0.00 H new ATOM 0 HB2 ASN A 119 7.265 13.429 -7.779 0.20 0.00 H new ATOM 0 HB3 ASN A 119 8.290 14.809 -8.119 0.20 0.00 H new ATOM 0 HD21 ASN A 119 6.886 12.961 -9.999 0.39 0.00 H new ATOM 0 HD22 ASN A 119 8.174 12.361 -11.049 0.39 0.00 H new ATOM 1875 N SER A 120 8.770 13.436 -4.453 1.00 0.00 N ATOM 1876 CA SER A 120 8.420 14.070 -3.186 0.05 0.00 C ATOM 1877 C SER A 120 8.827 13.188 -2.004 1.00 0.00 C ATOM 1878 O SER A 120 7.973 12.647 -1.303 0.08 0.00 O ATOM 1879 CB SER A 120 6.919 14.360 -3.129 0.88 0.00 C ATOM 1880 OG SER A 120 6.562 14.967 -1.899 1.00 0.00 O ATOM 0 H SER A 120 8.969 12.438 -4.383 1.00 0.00 H new ATOM 0 HA SER A 120 8.965 15.012 -3.119 0.05 0.00 H new ATOM 0 HB2 SER A 120 6.640 15.014 -3.955 0.88 0.00 H new ATOM 0 HB3 SER A 120 6.361 13.432 -3.255 0.88 0.00 H new ATOM 0 HG SER A 120 5.598 15.143 -1.889 1.00 0.00 H new ATOM 1886 N PRO A 121 10.145 13.027 -1.774 0.09 0.00 N ATOM 1887 CA PRO A 121 10.661 12.206 -0.673 0.08 0.00 C ATOM 1888 C PRO A 121 10.200 12.713 0.691 0.51 0.00 C ATOM 1889 O PRO A 121 10.042 13.917 0.895 1.00 0.00 O ATOM 1890 CB PRO A 121 12.185 12.333 -0.802 1.00 0.00 C ATOM 1891 CG PRO A 121 12.421 12.786 -2.203 0.10 0.00 C ATOM 1892 CD PRO A 121 11.232 13.626 -2.568 0.21 0.00 C ATOM 0 HA PRO A 121 10.303 11.178 -0.735 0.08 0.00 H new ATOM 0 HB2 PRO A 121 12.583 13.050 -0.084 1.00 0.00 H new ATOM 0 HB3 PRO A 121 12.678 11.380 -0.608 1.00 0.00 H new ATOM 0 HG2 PRO A 121 13.344 13.361 -2.278 0.10 0.00 H new ATOM 0 HG3 PRO A 121 12.520 11.935 -2.877 0.10 0.00 H new ATOM 0 HD2 PRO A 121 11.386 14.675 -2.314 0.21 0.00 H new ATOM 0 HD3 PRO A 121 11.021 13.584 -3.637 0.21 0.00 H new ATOM 1900 N ALA A 122 9.987 11.785 1.619 0.07 0.00 N ATOM 1901 CA ALA A 122 9.546 12.133 2.964 0.08 0.00 C ATOM 1902 C ALA A 122 10.644 11.856 3.985 0.30 0.00 C ATOM 1903 O ALA A 122 10.750 12.541 5.003 1.00 0.00 O ATOM 1904 CB ALA A 122 8.282 11.364 3.321 0.08 0.00 C ATOM 0 H ALA A 122 10.113 10.785 1.463 0.07 0.00 H new ATOM 0 HA ALA A 122 9.324 13.200 2.985 0.08 0.00 H new ATOM 0 HB1 ALA A 122 7.964 11.634 4.328 0.08 0.00 H new ATOM 0 HB2 ALA A 122 7.492 11.613 2.612 0.08 0.00 H new ATOM 0 HB3 ALA A 122 8.483 10.294 3.279 0.08 0.00 H new ATOM 1910 N ASN A 123 11.461 10.844 3.704 0.70 0.00 N ATOM 1911 CA ASN A 123 12.558 10.475 4.592 0.61 0.00 C ATOM 1912 C ASN A 123 13.902 10.718 3.912 0.67 0.00 C ATOM 1913 O ASN A 123 14.354 9.910 3.101 0.06 0.00 O ATOM 1914 CB ASN A 123 12.435 9.006 5.003 0.30 0.00 C ATOM 1915 CG ASN A 123 13.288 8.671 6.211 0.06 0.00 C ATOM 1916 OD1 ASN A 123 14.435 8.246 6.076 0.06 0.00 O ATOM 1917 ND2 ASN A 123 12.730 8.863 7.400 1.00 0.00 N ATOM 0 H ASN A 123 11.383 10.265 2.868 0.70 0.00 H new ATOM 0 HA ASN A 123 12.503 11.097 5.485 0.61 0.00 H new ATOM 0 HB2 ASN A 123 11.392 8.779 5.224 0.30 0.00 H new ATOM 0 HB3 ASN A 123 12.729 8.372 4.167 0.30 0.00 H new ATOM 0 HD21 ASN A 123 13.256 8.656 8.249 1.00 0.00 H new ATOM 0 HD22 ASN A 123 11.776 9.217 7.464 1.00 0.00 H new ATOM 1924 N SER A 124 14.534 11.838 4.248 0.06 0.00 N ATOM 1925 CA SER A 124 15.823 12.196 3.665 1.00 0.00 C ATOM 1926 C SER A 124 16.917 11.229 4.099 0.16 0.00 C ATOM 1927 O SER A 124 17.894 11.022 3.381 0.34 0.00 O ATOM 1928 CB SER A 124 16.206 13.621 4.065 0.35 0.00 C ATOM 1929 OG SER A 124 17.462 13.985 3.517 0.09 0.00 O ATOM 0 H SER A 124 14.174 12.514 4.922 0.06 0.00 H new ATOM 0 HA SER A 124 15.725 12.136 2.581 1.00 0.00 H new ATOM 0 HB2 SER A 124 15.440 14.317 3.721 0.35 0.00 H new ATOM 0 HB3 SER A 124 16.243 13.699 5.152 0.35 0.00 H new ATOM 0 HG SER A 124 17.683 14.901 3.786 0.09 0.00 H new ATOM 1935 N GLN A 125 16.747 10.637 5.276 0.07 0.00 N ATOM 1936 CA GLN A 125 17.725 9.695 5.806 0.16 0.00 C ATOM 1937 C GLN A 125 17.840 8.456 4.920 0.22 0.00 C ATOM 1938 O GLN A 125 18.936 7.944 4.699 1.00 0.00 O ATOM 1939 CB GLN A 125 17.349 9.285 7.231 0.92 0.00 C ATOM 1940 CG GLN A 125 18.277 8.237 7.830 0.15 0.00 C ATOM 1941 CD GLN A 125 17.869 7.825 9.231 0.06 0.00 C ATOM 1942 OE1 GLN A 125 16.691 7.865 9.585 1.00 0.00 O ATOM 1943 NE2 GLN A 125 18.845 7.422 10.036 0.67 0.00 N ATOM 0 H GLN A 125 15.941 10.793 5.881 0.07 0.00 H new ATOM 0 HA GLN A 125 18.694 10.194 5.820 0.16 0.00 H new ATOM 0 HB2 GLN A 125 17.355 10.170 7.868 0.92 0.00 H new ATOM 0 HB3 GLN A 125 16.330 8.898 7.232 0.92 0.00 H new ATOM 0 HG2 GLN A 125 18.289 7.358 7.186 0.15 0.00 H new ATOM 0 HG3 GLN A 125 19.294 8.629 7.853 0.15 0.00 H new ATOM 0 HE21 GLN A 125 19.808 7.405 9.701 0.67 0.00 H new ATOM 0 HE22 GLN A 125 18.632 7.130 10.990 0.67 0.00 H new ATOM 1952 N ALA A 126 16.705 7.982 4.415 1.00 0.00 N ATOM 1953 CA ALA A 126 16.688 6.799 3.562 1.00 0.00 C ATOM 1954 C ALA A 126 17.401 7.054 2.238 0.19 0.00 C ATOM 1955 O ALA A 126 18.321 6.323 1.869 0.90 0.00 O ATOM 1956 CB ALA A 126 15.255 6.354 3.314 1.00 0.00 C ATOM 0 H ALA A 126 15.788 8.397 4.581 1.00 0.00 H new ATOM 0 HA ALA A 126 17.225 6.004 4.079 1.00 0.00 H new ATOM 0 HB1 ALA A 126 15.254 5.470 2.676 1.00 0.00 H new ATOM 0 HB2 ALA A 126 14.778 6.116 4.265 1.00 0.00 H new ATOM 0 HB3 ALA A 126 14.705 7.157 2.823 1.00 0.00 H new ATOM 1962 N ALA A 127 16.975 8.094 1.527 0.26 0.00 N ATOM 1963 CA ALA A 127 17.579 8.441 0.245 0.68 0.00 C ATOM 1964 C ALA A 127 19.058 8.783 0.405 1.00 0.00 C ATOM 1965 O ALA A 127 19.865 8.512 -0.484 0.06 0.00 O ATOM 1966 CB ALA A 127 16.833 9.603 -0.395 0.18 0.00 C ATOM 0 H ALA A 127 16.215 8.710 1.816 0.26 0.00 H new ATOM 0 HA ALA A 127 17.504 7.571 -0.408 0.68 0.00 H new ATOM 0 HB1 ALA A 127 17.295 9.850 -1.351 0.18 0.00 H new ATOM 0 HB2 ALA A 127 15.792 9.322 -0.557 0.18 0.00 H new ATOM 0 HB3 ALA A 127 16.876 10.470 0.264 0.18 0.00 H new ATOM 1972 N GLN A 128 19.404 9.379 1.542 0.33 0.00 N ATOM 1973 CA GLN A 128 20.787 9.765 1.817 0.26 0.00 C ATOM 1974 C GLN A 128 21.680 8.538 1.976 0.24 0.00 C ATOM 1975 O GLN A 128 22.756 8.462 1.384 0.09 0.00 O ATOM 1976 CB GLN A 128 20.856 10.624 3.078 0.08 0.00 C ATOM 1977 CG GLN A 128 22.229 11.227 3.328 0.92 0.00 C ATOM 1978 CD GLN A 128 22.648 12.198 2.241 1.00 0.00 C ATOM 1979 OE1 GLN A 128 23.302 11.682 1.206 1.00 0.00 O flip ATOM 1980 NE2 GLN A 128 22.386 13.398 2.330 1.00 0.00 N flip ATOM 0 H GLN A 128 18.747 9.606 2.289 0.33 0.00 H new ATOM 0 HA GLN A 128 21.148 10.344 0.967 0.26 0.00 H new ATOM 0 HB2 GLN A 128 20.124 11.428 3.001 0.08 0.00 H new ATOM 0 HB3 GLN A 128 20.573 10.016 3.938 0.08 0.00 H new ATOM 0 HG2 GLN A 128 22.226 11.742 4.288 0.92 0.00 H new ATOM 0 HG3 GLN A 128 22.966 10.427 3.398 0.92 0.00 H new ATOM 0 HE21 GLN A 128 21.881 13.751 3.143 1.00 0.00 H new ATOM 0 HE22 GLN A 128 22.673 14.039 1.590 1.00 0.00 H new ATOM 1989 N LEU A 129 21.229 7.583 2.784 1.00 0.00 N ATOM 1990 CA LEU A 129 21.990 6.359 3.027 0.81 0.00 C ATOM 1991 C LEU A 129 22.279 5.620 1.725 0.24 0.00 C ATOM 1992 O LEU A 129 23.274 4.903 1.617 1.00 0.00 O ATOM 1993 CB LEU A 129 21.224 5.441 3.982 1.00 0.00 C ATOM 1994 CG LEU A 129 21.146 5.927 5.431 0.36 0.00 C ATOM 1995 CD1 LEU A 129 20.162 5.081 6.223 0.55 0.00 C ATOM 1996 CD2 LEU A 129 22.521 5.889 6.080 0.11 0.00 C ATOM 0 H LEU A 129 20.340 7.632 3.282 1.00 0.00 H new ATOM 0 HA LEU A 129 22.940 6.641 3.480 0.81 0.00 H new ATOM 0 HB2 LEU A 129 20.210 5.314 3.603 1.00 0.00 H new ATOM 0 HB3 LEU A 129 21.694 4.458 3.970 1.00 0.00 H new ATOM 0 HG LEU A 129 20.793 6.958 5.430 0.36 0.00 H new ATOM 0 HD11 LEU A 129 20.119 5.440 7.251 0.55 0.00 H new ATOM 0 HD12 LEU A 129 19.173 5.155 5.771 0.55 0.00 H new ATOM 0 HD13 LEU A 129 20.488 4.041 6.215 0.55 0.00 H new ATOM 0 HD21 LEU A 129 22.447 6.238 7.110 0.11 0.00 H new ATOM 0 HD22 LEU A 129 22.900 4.867 6.069 0.11 0.00 H new ATOM 0 HD23 LEU A 129 23.203 6.535 5.526 0.11 0.00 H new ATOM 2008 N TYR A 130 21.408 5.799 0.741 1.00 0.00 N ATOM 2009 CA TYR A 130 21.567 5.142 -0.550 0.70 0.00 C ATOM 2010 C TYR A 130 22.849 5.591 -1.247 1.00 0.00 C ATOM 2011 O TYR A 130 23.584 4.773 -1.799 0.23 0.00 O ATOM 2012 CB TYR A 130 20.362 5.436 -1.443 0.09 0.00 C ATOM 2013 CG TYR A 130 20.400 4.716 -2.772 1.00 0.00 C ATOM 2014 CD1 TYR A 130 19.903 3.425 -2.898 1.00 0.00 C ATOM 2015 CD2 TYR A 130 20.934 5.326 -3.901 0.53 0.00 C ATOM 2016 CE1 TYR A 130 19.936 2.764 -4.112 0.39 0.00 C ATOM 2017 CE2 TYR A 130 20.971 4.672 -5.117 0.98 0.00 C ATOM 2018 CZ TYR A 130 20.472 3.390 -5.217 0.21 0.00 C ATOM 2019 OH TYR A 130 20.506 2.735 -6.425 0.56 0.00 O ATOM 0 H TYR A 130 20.583 6.394 0.812 1.00 0.00 H new ATOM 0 HA TYR A 130 21.633 4.069 -0.373 0.70 0.00 H new ATOM 0 HB2 TYR A 130 19.452 5.155 -0.914 0.09 0.00 H new ATOM 0 HB3 TYR A 130 20.308 6.510 -1.623 0.09 0.00 H new ATOM 0 HD1 TYR A 130 19.484 2.930 -2.034 1.00 0.00 H new ATOM 0 HD2 TYR A 130 21.327 6.329 -3.826 0.53 0.00 H new ATOM 0 HE1 TYR A 130 19.543 1.761 -4.194 0.39 0.00 H new ATOM 0 HE2 TYR A 130 21.388 5.162 -5.985 0.98 0.00 H new ATOM 0 HH TYR A 130 20.914 3.316 -7.101 0.56 0.00 H new ATOM 2029 N GLN A 131 23.109 6.894 -1.218 1.00 0.00 N ATOM 2030 CA GLN A 131 24.294 7.452 -1.860 0.55 0.00 C ATOM 2031 C GLN A 131 25.472 7.527 -0.892 0.17 0.00 C ATOM 2032 O GLN A 131 26.619 7.678 -1.313 0.66 0.00 O ATOM 2033 CB GLN A 131 23.986 8.845 -2.411 0.39 0.00 C ATOM 2034 CG GLN A 131 23.594 9.849 -1.340 1.00 0.00 C ATOM 2035 CD GLN A 131 23.336 11.230 -1.906 0.42 0.00 C ATOM 2036 OE1 GLN A 131 22.206 11.573 -2.248 0.10 0.00 O ATOM 2037 NE2 GLN A 131 24.393 12.029 -2.013 0.05 0.00 N ATOM 0 H GLN A 131 22.515 7.583 -0.757 1.00 0.00 H new ATOM 0 HA GLN A 131 24.572 6.789 -2.679 0.55 0.00 H new ATOM 0 HB2 GLN A 131 24.861 9.218 -2.944 0.39 0.00 H new ATOM 0 HB3 GLN A 131 23.178 8.768 -3.139 0.39 0.00 H new ATOM 0 HG2 GLN A 131 22.699 9.497 -0.827 1.00 0.00 H new ATOM 0 HG3 GLN A 131 24.387 9.908 -0.594 1.00 0.00 H new ATOM 0 HE21 GLN A 131 25.312 11.701 -1.716 0.05 0.00 H new ATOM 0 HE22 GLN A 131 24.285 12.970 -2.392 0.05 0.00 H new ATOM 2046 N GLU A 132 25.187 7.422 0.402 1.00 0.00 N ATOM 2047 CA GLU A 132 26.232 7.482 1.417 0.53 0.00 C ATOM 2048 C GLU A 132 26.738 6.085 1.768 0.66 0.00 C ATOM 2049 O GLU A 132 27.823 5.686 1.342 1.00 0.00 O ATOM 2050 CB GLU A 132 25.714 8.186 2.674 0.11 0.00 C ATOM 2051 CG GLU A 132 25.497 9.678 2.485 0.28 0.00 C ATOM 2052 CD GLU A 132 26.789 10.426 2.225 0.09 0.00 C ATOM 2053 OE1 GLU A 132 27.170 10.562 1.042 1.00 0.00 O ATOM 2054 OE2 GLU A 132 27.423 10.876 3.203 1.00 0.00 O ATOM 0 H GLU A 132 24.245 7.295 0.771 1.00 0.00 H new ATOM 0 HA GLU A 132 27.065 8.054 1.008 0.53 0.00 H new ATOM 0 HB2 GLU A 132 24.774 7.725 2.978 0.11 0.00 H new ATOM 0 HB3 GLU A 132 26.423 8.030 3.487 0.11 0.00 H new ATOM 0 HG2 GLU A 132 24.814 9.839 1.651 0.28 0.00 H new ATOM 0 HG3 GLU A 132 25.017 10.087 3.374 0.28 0.00 H new ATOM 2061 N ASN A 133 25.950 5.348 2.540 1.00 0.00 N ATOM 2062 CA ASN A 133 26.323 3.996 2.940 0.71 0.00 C ATOM 2063 C ASN A 133 25.376 2.975 2.319 0.44 0.00 C ATOM 2064 O ASN A 133 24.363 2.608 2.916 0.44 0.00 O ATOM 2065 CB ASN A 133 26.309 3.866 4.464 0.08 0.00 C ATOM 2066 CG ASN A 133 27.230 2.766 4.967 0.17 0.00 C ATOM 2067 OD1 ASN A 133 27.436 1.738 4.152 0.43 0.00 O flip ATOM 2068 ND2 ASN A 133 27.752 2.842 6.080 0.47 0.00 N flip ATOM 0 H ASN A 133 25.050 5.662 2.902 1.00 0.00 H new ATOM 0 HA ASN A 133 27.333 3.799 2.581 0.71 0.00 H new ATOM 0 HB2 ASN A 133 26.607 4.816 4.908 0.08 0.00 H new ATOM 0 HB3 ASN A 133 25.291 3.663 4.798 0.08 0.00 H new ATOM 0 HD21 ASN A 133 27.568 3.649 6.676 0.47 0.00 H new ATOM 0 HD22 ASN A 133 28.369 2.098 6.406 0.47 0.00 H new ATOM 2075 N LYS A 134 25.707 2.528 1.111 0.52 0.00 N ATOM 2076 CA LYS A 134 24.884 1.554 0.405 0.49 0.00 C ATOM 2077 C LYS A 134 24.834 0.227 1.157 0.21 0.00 C ATOM 2078 O LYS A 134 23.859 -0.516 1.055 1.00 0.00 O ATOM 2079 CB LYS A 134 25.421 1.332 -1.010 0.05 0.00 C ATOM 2080 CG LYS A 134 24.534 0.439 -1.866 1.00 0.00 C ATOM 2081 CD LYS A 134 25.188 0.104 -3.196 1.00 0.00 C ATOM 2082 CE LYS A 134 26.407 -0.786 -3.012 0.07 0.00 C ATOM 2083 NZ LYS A 134 26.971 -1.236 -4.315 0.09 0.00 N ATOM 0 H LYS A 134 26.539 2.825 0.602 0.52 0.00 H new ATOM 0 HA LYS A 134 23.871 1.952 0.345 0.49 0.00 H new ATOM 0 HB2 LYS A 134 25.533 2.298 -1.503 0.05 0.00 H new ATOM 0 HB3 LYS A 134 26.415 0.889 -0.947 0.05 0.00 H new ATOM 0 HG2 LYS A 134 24.316 -0.482 -1.326 1.00 0.00 H new ATOM 0 HG3 LYS A 134 23.581 0.937 -2.045 1.00 0.00 H new ATOM 0 HD2 LYS A 134 24.466 -0.396 -3.841 1.00 0.00 H new ATOM 0 HD3 LYS A 134 25.482 1.025 -3.700 1.00 0.00 H new ATOM 0 HE2 LYS A 134 27.171 -0.244 -2.454 0.07 0.00 H new ATOM 0 HE3 LYS A 134 26.134 -1.656 -2.415 0.07 0.00 H new ATOM 0 HZ1 LYS A 134 27.800 -1.840 -4.144 0.09 0.00 H new ATOM 0 HZ2 LYS A 134 26.251 -1.775 -4.837 0.09 0.00 H new ATOM 0 HZ3 LYS A 134 27.256 -0.407 -4.875 0.09 0.00 H new ATOM 2097 N ARG A 135 25.890 -0.063 1.911 0.87 0.00 N ATOM 2098 CA ARG A 135 25.965 -1.303 2.676 0.19 0.00 C ATOM 2099 C ARG A 135 24.892 -1.341 3.761 0.87 0.00 C ATOM 2100 O ARG A 135 24.408 -2.413 4.129 0.13 0.00 O ATOM 2101 CB ARG A 135 27.351 -1.460 3.301 0.79 0.00 C ATOM 2102 CG ARG A 135 28.485 -1.457 2.287 0.11 0.00 C ATOM 2103 CD ARG A 135 28.383 -2.634 1.327 0.11 0.00 C ATOM 2104 NE ARG A 135 28.484 -3.916 2.018 0.11 0.00 N ATOM 2105 CZ ARG A 135 28.259 -5.091 1.436 0.17 0.00 C ATOM 2106 NH1 ARG A 135 27.912 -5.146 0.158 0.12 0.00 N ATOM 2107 NH2 ARG A 135 28.381 -6.212 2.134 0.60 0.00 N ATOM 0 H ARG A 135 26.705 0.543 2.009 0.87 0.00 H new ATOM 0 HA ARG A 135 25.790 -2.133 1.992 0.19 0.00 H new ATOM 0 HB2 ARG A 135 27.512 -0.652 4.014 0.79 0.00 H new ATOM 0 HB3 ARG A 135 27.382 -2.393 3.864 0.79 0.00 H new ATOM 0 HG2 ARG A 135 28.467 -0.524 1.723 0.11 0.00 H new ATOM 0 HG3 ARG A 135 29.441 -1.495 2.809 0.11 0.00 H new ATOM 0 HD2 ARG A 135 27.434 -2.584 0.793 0.11 0.00 H new ATOM 0 HD3 ARG A 135 29.174 -2.562 0.580 0.11 0.00 H new ATOM 0 HE ARG A 135 28.742 -3.911 3.005 0.11 0.00 H new ATOM 0 HH11 ARG A 135 27.817 -4.286 -0.382 0.12 0.00 H new ATOM 0 HH12 ARG A 135 27.740 -6.048 -0.285 0.12 0.00 H new ATOM 0 HH21 ARG A 135 28.647 -6.174 3.118 0.60 0.00 H new ATOM 0 HH22 ARG A 135 28.208 -7.112 1.687 0.60 0.00 H new ATOM 2121 N GLU A 136 24.522 -0.169 4.266 0.14 0.00 N ATOM 2122 CA GLU A 136 23.504 -0.073 5.306 0.10 0.00 C ATOM 2123 C GLU A 136 22.104 -0.133 4.700 1.00 0.00 C ATOM 2124 O GLU A 136 21.164 -0.617 5.327 0.36 0.00 O ATOM 2125 CB GLU A 136 23.675 1.225 6.098 0.06 0.00 C ATOM 2126 CG GLU A 136 22.710 1.359 7.265 1.00 0.00 C ATOM 2127 CD GLU A 136 22.944 2.619 8.073 0.38 0.00 C ATOM 2128 OE1 GLU A 136 23.981 2.697 8.765 0.51 0.00 O ATOM 2129 OE2 GLU A 136 22.090 3.529 8.017 1.00 0.00 O ATOM 0 H GLU A 136 24.911 0.727 3.972 0.14 0.00 H new ATOM 0 HA GLU A 136 23.626 -0.920 5.981 0.10 0.00 H new ATOM 0 HB2 GLU A 136 24.697 1.279 6.474 0.06 0.00 H new ATOM 0 HB3 GLU A 136 23.538 2.072 5.425 0.06 0.00 H new ATOM 0 HG2 GLU A 136 21.687 1.358 6.888 1.00 0.00 H new ATOM 0 HG3 GLU A 136 22.810 0.491 7.916 1.00 0.00 H new ATOM 2136 N TYR A 137 21.979 0.363 3.472 1.00 0.00 N ATOM 2137 CA TYR A 137 20.700 0.368 2.774 0.07 0.00 C ATOM 2138 C TYR A 137 20.320 -1.038 2.321 0.72 0.00 C ATOM 2139 O TYR A 137 19.183 -1.472 2.502 0.07 0.00 O ATOM 2140 CB TYR A 137 20.761 1.311 1.570 0.34 0.00 C ATOM 2141 CG TYR A 137 19.458 1.417 0.810 0.92 0.00 C ATOM 2142 CD1 TYR A 137 18.439 2.252 1.254 0.14 0.00 C ATOM 2143 CD2 TYR A 137 19.245 0.682 -0.350 0.06 0.00 C ATOM 2144 CE1 TYR A 137 17.247 2.352 0.563 0.82 0.00 C ATOM 2145 CE2 TYR A 137 18.056 0.777 -1.046 1.00 0.00 C ATOM 2146 CZ TYR A 137 17.060 1.612 -0.586 0.47 0.00 C ATOM 2147 OH TYR A 137 15.873 1.709 -1.276 0.13 0.00 O ATOM 0 H TYR A 137 22.750 0.767 2.940 1.00 0.00 H new ATOM 0 HA TYR A 137 19.935 0.722 3.466 0.07 0.00 H new ATOM 0 HB2 TYR A 137 21.053 2.304 1.913 0.34 0.00 H new ATOM 0 HB3 TYR A 137 21.540 0.967 0.890 0.34 0.00 H new ATOM 0 HD1 TYR A 137 18.582 2.832 2.154 0.14 0.00 H new ATOM 0 HD2 TYR A 137 20.022 0.026 -0.713 0.06 0.00 H new ATOM 0 HE1 TYR A 137 16.466 3.006 0.921 0.82 0.00 H new ATOM 0 HE2 TYR A 137 17.907 0.200 -1.947 1.00 0.00 H new ATOM 0 HH TYR A 137 15.903 1.125 -2.062 0.13 0.00 H new ATOM 2157 N GLU A 138 21.278 -1.745 1.729 0.32 0.00 N ATOM 2158 CA GLU A 138 21.042 -3.102 1.251 0.53 0.00 C ATOM 2159 C GLU A 138 20.722 -4.041 2.412 1.00 0.00 C ATOM 2160 O GLU A 138 19.946 -4.985 2.264 0.09 0.00 O ATOM 2161 CB GLU A 138 22.257 -3.620 0.473 0.14 0.00 C ATOM 2162 CG GLU A 138 23.537 -3.672 1.290 1.00 0.00 C ATOM 2163 CD GLU A 138 24.704 -4.238 0.504 0.87 0.00 C ATOM 2164 OE1 GLU A 138 25.376 -3.461 -0.207 0.45 0.00 O ATOM 2165 OE2 GLU A 138 24.944 -5.461 0.596 0.26 0.00 O ATOM 0 H GLU A 138 22.225 -1.400 1.569 0.32 0.00 H new ATOM 0 HA GLU A 138 20.183 -3.077 0.581 0.53 0.00 H new ATOM 0 HB2 GLU A 138 22.036 -4.619 0.098 0.14 0.00 H new ATOM 0 HB3 GLU A 138 22.418 -2.982 -0.396 0.14 0.00 H new ATOM 0 HG2 GLU A 138 23.787 -2.668 1.633 1.00 0.00 H new ATOM 0 HG3 GLU A 138 23.372 -4.281 2.179 1.00 0.00 H new ATOM 2172 N LYS A 139 21.326 -3.774 3.566 0.11 0.00 N ATOM 2173 CA LYS A 139 21.108 -4.585 4.752 0.14 0.00 C ATOM 2174 C LYS A 139 19.691 -4.385 5.294 0.43 0.00 C ATOM 2175 O LYS A 139 19.068 -5.323 5.792 0.92 0.00 O ATOM 2176 CB LYS A 139 22.165 -4.230 5.808 1.00 0.00 C ATOM 2177 CG LYS A 139 21.617 -4.022 7.211 0.34 0.00 C ATOM 2178 CD LYS A 139 21.307 -5.345 7.897 0.47 0.00 C ATOM 2179 CE LYS A 139 20.538 -5.134 9.191 1.00 0.00 C ATOM 2180 NZ LYS A 139 21.296 -4.294 10.160 0.20 0.00 N ATOM 0 H LYS A 139 21.973 -2.997 3.702 0.11 0.00 H new ATOM 0 HA LYS A 139 21.208 -5.639 4.493 0.14 0.00 H new ATOM 0 HB2 LYS A 139 22.910 -5.025 5.838 1.00 0.00 H new ATOM 0 HB3 LYS A 139 22.680 -3.322 5.496 1.00 0.00 H new ATOM 0 HG2 LYS A 139 22.341 -3.465 7.805 0.34 0.00 H new ATOM 0 HG3 LYS A 139 20.712 -3.417 7.162 0.34 0.00 H new ATOM 0 HD2 LYS A 139 20.725 -5.977 7.226 0.47 0.00 H new ATOM 0 HD3 LYS A 139 22.237 -5.874 8.107 0.47 0.00 H new ATOM 0 HE2 LYS A 139 19.581 -4.660 8.971 1.00 0.00 H new ATOM 0 HE3 LYS A 139 20.318 -6.101 9.644 1.00 0.00 H new ATOM 0 HZ1 LYS A 139 20.810 -4.300 11.079 0.20 0.00 H new ATOM 0 HZ2 LYS A 139 22.256 -4.676 10.274 0.20 0.00 H new ATOM 0 HZ3 LYS A 139 21.352 -3.318 9.804 0.20 0.00 H new ATOM 2194 N ARG A 140 19.190 -3.158 5.191 0.88 0.00 N ATOM 2195 CA ARG A 140 17.849 -2.836 5.670 0.95 0.00 C ATOM 2196 C ARG A 140 16.780 -3.463 4.782 0.16 0.00 C ATOM 2197 O ARG A 140 15.872 -4.134 5.273 0.97 0.00 O ATOM 2198 CB ARG A 140 17.654 -1.318 5.725 0.26 0.00 C ATOM 2199 CG ARG A 140 18.302 -0.664 6.935 0.25 0.00 C ATOM 2200 CD ARG A 140 17.601 -1.066 8.223 0.09 0.00 C ATOM 2201 NE ARG A 140 18.161 -0.387 9.388 0.43 0.00 N ATOM 2202 CZ ARG A 140 17.525 -0.269 10.550 1.00 0.00 C ATOM 2203 NH1 ARG A 140 16.314 -0.786 10.704 0.91 0.00 N ATOM 2204 NH2 ARG A 140 18.103 0.364 11.563 0.31 0.00 N ATOM 0 H ARG A 140 19.692 -2.370 4.781 0.88 0.00 H new ATOM 0 HA ARG A 140 17.746 -3.248 6.674 0.95 0.00 H new ATOM 0 HB2 ARG A 140 18.066 -0.874 4.819 0.26 0.00 H new ATOM 0 HB3 ARG A 140 16.587 -1.097 5.731 0.26 0.00 H new ATOM 0 HG2 ARG A 140 19.353 -0.950 6.986 0.25 0.00 H new ATOM 0 HG3 ARG A 140 18.271 0.420 6.825 0.25 0.00 H new ATOM 0 HD2 ARG A 140 16.539 -0.834 8.145 0.09 0.00 H new ATOM 0 HD3 ARG A 140 17.683 -2.144 8.358 0.09 0.00 H new ATOM 0 HE ARG A 140 19.093 0.020 9.306 0.43 0.00 H new ATOM 0 HH11 ARG A 140 15.867 -1.277 9.930 0.91 0.00 H new ATOM 0 HH12 ARG A 140 15.830 -0.693 11.597 0.91 0.00 H new ATOM 0 HH21 ARG A 140 19.036 0.761 11.451 0.31 0.00 H new ATOM 0 HH22 ARG A 140 17.614 0.454 12.454 0.31 0.00 H new ATOM 2218 N VAL A 141 16.893 -3.241 3.478 0.07 0.00 N ATOM 2219 CA VAL A 141 15.933 -3.787 2.526 1.00 0.00 C ATOM 2220 C VAL A 141 15.905 -5.310 2.586 1.00 0.00 C ATOM 2221 O VAL A 141 14.853 -5.927 2.433 1.00 0.00 O ATOM 2222 CB VAL A 141 16.247 -3.340 1.084 0.06 0.00 C ATOM 2223 CG1 VAL A 141 17.650 -3.765 0.684 0.26 0.00 C ATOM 2224 CG2 VAL A 141 15.217 -3.898 0.113 0.18 0.00 C ATOM 0 H VAL A 141 17.639 -2.688 3.056 0.07 0.00 H new ATOM 0 HA VAL A 141 14.954 -3.399 2.808 1.00 0.00 H new ATOM 0 HB VAL A 141 16.197 -2.252 1.045 0.06 0.00 H new ATOM 0 HG11 VAL A 141 17.852 -3.440 -0.337 0.26 0.00 H new ATOM 0 HG12 VAL A 141 18.374 -3.310 1.359 0.26 0.00 H new ATOM 0 HG13 VAL A 141 17.732 -4.850 0.742 0.26 0.00 H new ATOM 0 HG21 VAL A 141 15.456 -3.571 -0.899 0.18 0.00 H new ATOM 0 HG22 VAL A 141 15.230 -4.987 0.155 0.18 0.00 H new ATOM 0 HG23 VAL A 141 14.226 -3.536 0.386 0.18 0.00 H new ATOM 2234 N SER A 142 17.066 -5.914 2.812 0.34 0.00 N ATOM 2235 CA SER A 142 17.164 -7.366 2.889 1.00 0.00 C ATOM 2236 C SER A 142 16.515 -7.887 4.167 0.33 0.00 C ATOM 2237 O SER A 142 15.990 -8.999 4.197 0.83 0.00 O ATOM 2238 CB SER A 142 18.628 -7.808 2.823 0.07 0.00 C ATOM 2239 OG SER A 142 19.374 -7.277 3.905 1.00 0.00 O ATOM 0 H SER A 142 17.950 -5.422 2.945 0.34 0.00 H new ATOM 0 HA SER A 142 16.631 -7.787 2.036 1.00 0.00 H new ATOM 0 HB2 SER A 142 18.683 -8.896 2.840 0.07 0.00 H new ATOM 0 HB3 SER A 142 19.067 -7.481 1.880 0.07 0.00 H new ATOM 0 HG SER A 142 18.846 -6.587 4.359 1.00 0.00 H new ATOM 2245 N ALA A 143 16.553 -7.077 5.219 0.20 0.00 N ATOM 2246 CA ALA A 143 15.969 -7.459 6.501 0.17 0.00 C ATOM 2247 C ALA A 143 14.443 -7.480 6.435 0.09 0.00 C ATOM 2248 O ALA A 143 13.814 -8.476 6.790 1.00 0.00 O ATOM 2249 CB ALA A 143 16.439 -6.516 7.598 0.07 0.00 C ATOM 0 H ALA A 143 16.982 -6.152 5.210 0.20 0.00 H new ATOM 0 HA ALA A 143 16.306 -8.469 6.734 0.17 0.00 H new ATOM 0 HB1 ALA A 143 15.995 -6.813 8.548 0.07 0.00 H new ATOM 0 HB2 ALA A 143 17.525 -6.560 7.675 0.07 0.00 H new ATOM 0 HB3 ALA A 143 16.134 -5.498 7.358 0.07 0.00 H new ATOM 2255 N ILE A 144 13.854 -6.377 5.978 0.38 0.00 N ATOM 2256 CA ILE A 144 12.402 -6.272 5.873 0.08 0.00 C ATOM 2257 C ILE A 144 11.829 -7.348 4.953 0.46 0.00 C ATOM 2258 O ILE A 144 10.708 -7.817 5.157 0.29 0.00 O ATOM 2259 CB ILE A 144 11.971 -4.885 5.355 0.50 0.00 C ATOM 2260 CG1 ILE A 144 12.600 -4.607 3.988 0.54 0.00 C ATOM 2261 CG2 ILE A 144 12.355 -3.805 6.356 1.00 0.00 C ATOM 2262 CD1 ILE A 144 12.099 -3.337 3.334 0.17 0.00 C ATOM 0 H ILE A 144 14.360 -5.545 5.675 0.38 0.00 H new ATOM 0 HA ILE A 144 12.007 -6.415 6.879 0.08 0.00 H new ATOM 0 HB ILE A 144 10.887 -4.876 5.240 0.50 0.00 H new ATOM 0 HG12 ILE A 144 13.682 -4.544 4.102 0.54 0.00 H new ATOM 0 HG13 ILE A 144 12.398 -5.450 3.327 0.54 0.00 H new ATOM 0 HG21 ILE A 144 12.045 -2.831 5.977 1.00 0.00 H new ATOM 0 HG22 ILE A 144 11.860 -3.999 7.308 1.00 0.00 H new ATOM 0 HG23 ILE A 144 13.435 -3.811 6.501 1.00 0.00 H new ATOM 0 HD11 ILE A 144 12.589 -3.207 2.369 0.17 0.00 H new ATOM 0 HD12 ILE A 144 11.021 -3.404 3.187 0.17 0.00 H new ATOM 0 HD13 ILE A 144 12.325 -2.484 3.974 0.17 0.00 H new ATOM 2274 N VAL A 145 12.602 -7.735 3.943 0.56 0.00 N ATOM 2275 CA VAL A 145 12.168 -8.754 2.994 0.16 0.00 C ATOM 2276 C VAL A 145 12.244 -10.150 3.610 0.05 0.00 C ATOM 2277 O VAL A 145 11.351 -10.972 3.413 1.00 0.00 O ATOM 2278 CB VAL A 145 13.008 -8.712 1.700 0.18 0.00 C ATOM 2279 CG1 VAL A 145 12.737 -9.933 0.831 1.00 0.00 C ATOM 2280 CG2 VAL A 145 12.728 -7.433 0.928 0.12 0.00 C ATOM 0 H VAL A 145 13.532 -7.358 3.761 0.56 0.00 H new ATOM 0 HA VAL A 145 11.130 -8.535 2.743 0.16 0.00 H new ATOM 0 HB VAL A 145 14.062 -8.727 1.979 0.18 0.00 H new ATOM 0 HG11 VAL A 145 13.342 -9.877 -0.074 1.00 0.00 H new ATOM 0 HG12 VAL A 145 12.993 -10.837 1.384 1.00 0.00 H new ATOM 0 HG13 VAL A 145 11.681 -9.960 0.560 1.00 0.00 H new ATOM 0 HG21 VAL A 145 13.328 -7.418 0.018 0.12 0.00 H new ATOM 0 HG22 VAL A 145 11.671 -7.390 0.666 0.12 0.00 H new ATOM 0 HG23 VAL A 145 12.984 -6.572 1.545 0.12 0.00 H new ATOM 2290 N GLU A 146 13.315 -10.408 4.355 0.53 0.00 N ATOM 2291 CA GLU A 146 13.503 -11.705 4.997 1.00 0.00 C ATOM 2292 C GLU A 146 12.401 -11.981 6.016 1.00 0.00 C ATOM 2293 O GLU A 146 11.832 -13.072 6.047 0.27 0.00 O ATOM 2294 CB GLU A 146 14.871 -11.770 5.678 0.44 0.00 C ATOM 2295 CG GLU A 146 16.021 -12.001 4.713 0.22 0.00 C ATOM 2296 CD GLU A 146 15.902 -13.318 3.971 0.21 0.00 C ATOM 2297 OE1 GLU A 146 16.349 -14.348 4.518 0.11 0.00 O ATOM 2298 OE2 GLU A 146 15.363 -13.319 2.846 0.10 0.00 O ATOM 0 H GLU A 146 14.064 -9.738 4.529 0.53 0.00 H new ATOM 0 HA GLU A 146 13.453 -12.471 4.223 1.00 0.00 H new ATOM 0 HB2 GLU A 146 15.043 -10.839 6.219 0.44 0.00 H new ATOM 0 HB3 GLU A 146 14.862 -12.571 6.417 0.44 0.00 H new ATOM 0 HG2 GLU A 146 16.056 -11.184 3.992 0.22 0.00 H new ATOM 0 HG3 GLU A 146 16.962 -11.981 5.263 0.22 0.00 H new ATOM 2305 N GLN A 147 12.107 -10.987 6.845 0.08 0.00 N ATOM 2306 CA GLN A 147 11.076 -11.123 7.868 1.00 0.00 C ATOM 2307 C GLN A 147 9.699 -11.316 7.238 0.07 0.00 C ATOM 2308 O GLN A 147 8.803 -11.898 7.848 1.00 0.00 O ATOM 2309 CB GLN A 147 11.063 -9.892 8.777 0.18 0.00 C ATOM 2310 CG GLN A 147 12.393 -9.632 9.466 1.00 0.00 C ATOM 2311 CD GLN A 147 12.344 -8.429 10.389 0.67 0.00 C ATOM 2312 OE1 GLN A 147 12.614 -7.302 9.973 0.19 0.00 O ATOM 2313 NE2 GLN A 147 12.001 -8.665 11.648 1.00 0.00 N ATOM 0 H GLN A 147 12.568 -10.077 6.829 0.08 0.00 H new ATOM 0 HA GLN A 147 11.309 -12.006 8.463 1.00 0.00 H new ATOM 0 HB2 GLN A 147 10.792 -9.017 8.186 0.18 0.00 H new ATOM 0 HB3 GLN A 147 10.289 -10.018 9.534 0.18 0.00 H new ATOM 0 HG2 GLN A 147 12.680 -10.514 10.039 1.00 0.00 H new ATOM 0 HG3 GLN A 147 13.165 -9.476 8.712 1.00 0.00 H new ATOM 0 HE21 GLN A 147 11.786 -9.616 11.948 1.00 0.00 H new ATOM 0 HE22 GLN A 147 11.953 -7.896 12.316 1.00 0.00 H new ATOM 2322 N SER A 148 9.539 -10.822 6.014 0.15 0.00 N ATOM 2323 CA SER A 148 8.269 -10.938 5.303 0.08 0.00 C ATOM 2324 C SER A 148 8.344 -12.007 4.216 0.13 0.00 C ATOM 2325 O SER A 148 7.426 -12.148 3.407 0.36 0.00 O ATOM 2326 CB SER A 148 7.887 -9.591 4.689 0.13 0.00 C ATOM 2327 OG SER A 148 7.716 -8.603 5.693 1.00 0.00 O ATOM 0 H SER A 148 10.271 -10.338 5.494 0.15 0.00 H new ATOM 0 HA SER A 148 7.504 -11.236 6.020 0.08 0.00 H new ATOM 0 HB2 SER A 148 8.661 -9.274 3.990 0.13 0.00 H new ATOM 0 HB3 SER A 148 6.965 -9.697 4.117 0.13 0.00 H new ATOM 0 HG SER A 148 8.552 -8.105 5.808 1.00 0.00 H new ATOM 2333 N TRP A 149 9.442 -12.759 4.205 0.16 0.00 N ATOM 2334 CA TRP A 149 9.637 -13.816 3.216 0.13 0.00 C ATOM 2335 C TRP A 149 8.953 -15.103 3.666 1.00 0.00 C ATOM 2336 O TRP A 149 9.481 -15.841 4.498 0.42 0.00 O ATOM 2337 CB TRP A 149 11.132 -14.063 2.998 0.49 0.00 C ATOM 2338 CG TRP A 149 11.478 -14.431 1.587 0.08 0.00 C ATOM 2339 CD1 TRP A 149 11.699 -13.573 0.548 1.00 0.00 C ATOM 2340 CD2 TRP A 149 11.645 -15.753 1.059 0.33 0.00 C ATOM 2341 NE1 TRP A 149 11.991 -14.280 -0.594 0.07 0.00 N ATOM 2342 CE2 TRP A 149 11.965 -15.619 -0.306 1.00 0.00 C ATOM 2343 CE3 TRP A 149 11.556 -17.037 1.606 0.09 0.00 C ATOM 2344 CZ2 TRP A 149 12.195 -16.718 -1.129 0.10 0.00 C ATOM 2345 CZ3 TRP A 149 11.785 -18.128 0.788 0.17 0.00 C ATOM 2346 CH2 TRP A 149 12.102 -17.961 -0.566 0.06 0.00 C ATOM 0 H TRP A 149 10.209 -12.656 4.869 0.16 0.00 H new ATOM 0 HA TRP A 149 9.189 -13.497 2.275 0.13 0.00 H new ATOM 0 HB2 TRP A 149 11.685 -13.166 3.277 0.49 0.00 H new ATOM 0 HB3 TRP A 149 11.461 -14.860 3.664 0.49 0.00 H new ATOM 0 HD1 TRP A 149 11.651 -12.496 0.614 1.00 0.00 H new ATOM 0 HE1 TRP A 149 12.194 -13.874 -1.507 0.07 0.00 H new ATOM 0 HE3 TRP A 149 11.313 -17.174 2.649 0.09 0.00 H new ATOM 0 HZ2 TRP A 149 12.438 -16.594 -2.174 0.10 0.00 H new ATOM 0 HZ3 TRP A 149 11.718 -19.124 1.199 0.17 0.00 H new ATOM 0 HH2 TRP A 149 12.277 -18.833 -1.179 0.06 0.00 H new ATOM 2357 N ASN A 150 7.772 -15.366 3.113 0.56 0.00 N ATOM 2358 CA ASN A 150 7.009 -16.560 3.462 0.08 0.00 C ATOM 2359 C ASN A 150 7.714 -17.825 2.985 0.79 0.00 C ATOM 2360 O ASN A 150 8.593 -17.773 2.123 0.17 0.00 O ATOM 2361 CB ASN A 150 5.603 -16.488 2.864 0.15 0.00 C ATOM 2362 CG ASN A 150 4.818 -15.295 3.373 0.28 0.00 C ATOM 2363 OD1 ASN A 150 5.386 -14.254 3.704 0.30 0.00 O ATOM 2364 ND2 ASN A 150 3.500 -15.442 3.442 1.00 0.00 N ATOM 0 H ASN A 150 7.322 -14.767 2.420 0.56 0.00 H new ATOM 0 HA ASN A 150 6.933 -16.601 4.549 0.08 0.00 H new ATOM 0 HB2 ASN A 150 5.676 -16.435 1.778 0.15 0.00 H new ATOM 0 HB3 ASN A 150 5.062 -17.404 3.103 0.15 0.00 H new ATOM 0 HD21 ASN A 150 2.918 -14.675 3.779 1.00 0.00 H new ATOM 0 HD22 ASN A 150 3.069 -16.322 3.158 1.00 0.00 H new ATOM 2371 N ASP A 151 7.319 -18.962 3.550 1.00 0.00 N ATOM 2372 CA ASP A 151 7.906 -20.246 3.186 0.17 0.00 C ATOM 2373 C ASP A 151 6.838 -21.332 3.114 0.44 0.00 C ATOM 2374 O ASP A 151 7.097 -22.442 2.650 0.15 0.00 O ATOM 2375 CB ASP A 151 8.985 -20.642 4.197 1.00 0.00 C ATOM 2376 CG ASP A 151 10.126 -19.644 4.249 0.45 0.00 C ATOM 2377 OD1 ASP A 151 11.080 -19.791 3.455 0.22 0.00 O ATOM 2378 OD2 ASP A 151 10.066 -18.716 5.082 0.12 0.00 O ATOM 0 H ASP A 151 6.593 -19.019 4.264 1.00 0.00 H new ATOM 0 HA ASP A 151 8.361 -20.143 2.201 0.17 0.00 H new ATOM 0 HB2 ASP A 151 8.537 -20.729 5.187 1.00 0.00 H new ATOM 0 HB3 ASP A 151 9.378 -21.625 3.938 1.00 0.00 H new ATOM 2383 N SER A 152 5.635 -21.004 3.578 0.46 0.00 N ATOM 2384 CA SER A 152 4.526 -21.952 3.566 0.37 0.00 C ATOM 2385 C SER A 152 3.245 -21.286 3.074 0.43 0.00 C ATOM 2386 O SER A 152 2.521 -20.700 3.908 1.00 0.00 O ATOM 2387 CB SER A 152 4.312 -22.533 4.964 0.78 0.00 C ATOM 2388 OG SER A 152 4.030 -21.511 5.905 1.00 0.00 O ATOM 2389 OXT SER A 152 2.973 -21.357 1.857 0.06 0.00 O ATOM 0 H SER A 152 5.404 -20.090 3.967 0.46 0.00 H new ATOM 0 HA SER A 152 4.777 -22.760 2.879 0.37 0.00 H new ATOM 0 HB2 SER A 152 3.489 -23.248 4.942 0.78 0.00 H new ATOM 0 HB3 SER A 152 5.202 -23.081 5.273 0.78 0.00 H new ATOM 0 HG SER A 152 3.373 -20.890 5.526 1.00 0.00 H new TER 2395 SER A 152