USER MOD reduce.3.24.130724 H: found=0, std=0, add=1384, rem=0, adj=40 USER MOD reduce.3.24.130724 removed 1382 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 151 SER OG : rot 124:sc= -2.49! USER MOD Set 1.2: A 154 THR OG1 : rot 180:sc= -0.398 USER MOD Set 2.1: A 148 CYS SG : rot 160:sc= -0.894 USER MOD Set 2.2: A 160 HIS :FLIP no HE2:sc= 0.0809 F(o=-1.7,f=-0.81) USER MOD Set 3.1: A 19 HIS : no HD1:sc= -1.49 K(o=-4.8,f=-9.7!) USER MOD Set 3.2: A 96 THR OG1 : rot -70:sc= -3.29! USER MOD Set 4.1: A 71 MET CE :methyl 158:sc= -0.0116 (180deg=-0.251) USER MOD Set 4.2: A 102 HIS :FLIP no HD1:sc= -3.31! C(o=-4.7!,f=-3.3!) USER MOD Set 5.1: A 31 SER OG : rot 180:sc= 0.139 USER MOD Set 5.2: A 155 LYS NZ :NH3+ -120:sc= 0.268 (180deg=-0.104) USER MOD Single : A 1 GLY N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 3 HIS : no HD1:sc= 0 X(o=0,f=-0.068) USER MOD Single : A 4 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 12 THR OG1 : rot -160:sc= 0 USER MOD Single : A 14 MET CE :methyl -178:sc= -1.84! (180deg=-1.89!) USER MOD Single : A 16 HIS : no HD1:sc= -1.03 K(o=-1,f=-3.3!) USER MOD Single : A 21 LYS NZ :NH3+ -175:sc= 0.674! (180deg=0.35!) USER MOD Single : A 22 THR OG1 : rot 180:sc= 0 USER MOD Single : A 23 THR OG1 : rot -23:sc= 0.0849 USER MOD Single : A 30 HIS : no HD1:sc= -0.421 K(o=-0.42,f=-2.5) USER MOD Single : A 32 LYS NZ :NH3+ -138:sc= 0.336 (180deg=-0.0973) USER MOD Single : A 34 THR OG1 : rot -120:sc= 0.234 USER MOD Single : A 36 GLN : amide:sc=-0.00738 K(o=-0.0074,f=-0.56) USER MOD Single : A 42 THR OG1 : rot 180:sc= 0.00982 USER MOD Single : A 43 GLN : amide:sc= 0 X(o=0,f=-0.34) USER MOD Single : A 44 HIS : no HD1:sc= -0.0091 X(o=-0.0091,f=-0.0091) USER MOD Single : A 48 TYR OH : rot 110:sc= -0.175 USER MOD Single : A 49 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 51 THR OG1 : rot 180:sc= 0 USER MOD Single : A 53 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 55 LYS NZ :NH3+ -153:sc= -0.73! (180deg=-1.04!) USER MOD Single : A 56 LYS NZ :NH3+ -165:sc= 1.3 (180deg=0.943) USER MOD Single : A 58 THR OG1 : rot 180:sc= -0.128 USER MOD Single : A 62 THR OG1 : rot 180:sc= 0 USER MOD Single : A 65 HIS : no HD1:sc= 0 X(o=0,f=-0.0052) USER MOD Single : A 69 THR OG1 : rot 168:sc= 0.814 USER MOD Single : A 70 THR OG1 : rot 180:sc= 0 USER MOD Single : A 77 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 79 THR OG1 : rot -148:sc= 0.864 USER MOD Single : A 93 MET CE :methyl -121:sc= -3.3! (180deg=-5.62!) USER MOD Single : A 95 GLN : amide:sc= 1.18 K(o=1.2,f=-0.0007) USER MOD Single : A 101 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 104 LYS NZ :NH3+ -149:sc= 0.233 (180deg=-0.0123) USER MOD Single : A 107 ASN : amide:sc= -0.36 X(o=-0.36,f=-0.063) USER MOD Single : A 115 ASN : amide:sc= 1.13 K(o=1.1,f=-3.4!) USER MOD Single : A 116 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 117 MET CE :methyl -115:sc= -3.23! (180deg=-7.2!) USER MOD Single : A 119 LYS NZ :NH3+ -161:sc= -0.0874 (180deg=-0.446) USER MOD Single : A 123 ASN : amide:sc= 0.653 K(o=0.65,f=-7.3!) USER MOD Single : A 128 MET CE :methyl -139:sc= -1.26 (180deg=-2.61!) USER MOD Single : A 129 GLN : amide:sc= -0.419 X(o=-0.42,f=0) USER MOD Single : A 132 MET CE :methyl 158:sc= -2.96! (180deg=-5.98!) USER MOD Single : A 134 TYR OH : rot 180:sc= -0.0716 USER MOD Single : A 135 ASN :FLIP amide:sc= -0.34 F(o=-1.5!,f=-0.34) USER MOD Single : A 145 THR OG1 : rot -70:sc= -2.21! USER MOD Single : A 149 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 153 LYS NZ :NH3+ -169:sc= 1.24 (180deg=1.08) USER MOD Single : A 164 MET CE :methyl 144:sc= -1.99 (180deg=-3.76!) USER MOD Single : A 169 SER OG : rot 150:sc= 0 USER MOD Single : A 171 MET CE :methyl -132:sc= -1.23 (180deg=-2.11!) USER MOD Single : A 175 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 177 ASN : amide:sc= -0.0733 X(o=-0.073,f=0) USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 -31.259 4.951 -13.180 1.00 16.35 N ATOM 2 CA GLY A 1 -31.385 6.395 -13.493 1.00 15.80 C ATOM 3 C GLY A 1 -30.481 6.816 -14.633 1.00 15.04 C ATOM 4 O GLY A 1 -30.845 6.700 -15.803 1.00 14.90 O ATOM 0 H1 GLY A 1 -31.896 4.709 -12.394 1.00 16.35 H new ATOM 0 H2 GLY A 1 -31.515 4.391 -14.018 1.00 16.35 H new ATOM 0 H3 GLY A 1 -30.278 4.739 -12.908 1.00 16.35 H new ATOM 0 HA2 GLY A 1 -32.420 6.620 -13.751 1.00 15.80 H new ATOM 0 HA3 GLY A 1 -31.143 6.980 -12.605 1.00 15.80 H new ATOM 10 N SER A 2 -29.295 7.290 -14.287 1.00 14.69 N ATOM 11 CA SER A 2 -28.341 7.769 -15.275 1.00 14.11 C ATOM 12 C SER A 2 -27.706 6.599 -16.027 1.00 13.37 C ATOM 13 O SER A 2 -27.272 5.619 -15.419 1.00 13.12 O ATOM 14 CB SER A 2 -27.269 8.613 -14.585 1.00 14.38 C ATOM 15 OG SER A 2 -27.862 9.672 -13.849 1.00 14.60 O ATOM 0 H SER A 2 -28.968 7.354 -13.323 1.00 14.69 H new ATOM 0 HA SER A 2 -28.866 8.387 -16.003 1.00 14.11 H new ATOM 0 HB2 SER A 2 -26.679 7.985 -13.917 1.00 14.38 H new ATOM 0 HB3 SER A 2 -26.584 9.019 -15.329 1.00 14.38 H new ATOM 0 HG SER A 2 -27.161 10.200 -13.413 1.00 14.60 H new ATOM 21 N HIS A 3 -27.676 6.701 -17.352 1.00 13.19 N ATOM 22 CA HIS A 3 -27.126 5.636 -18.194 1.00 12.67 C ATOM 23 C HIS A 3 -25.673 5.920 -18.559 1.00 11.99 C ATOM 24 O HIS A 3 -25.034 5.143 -19.268 1.00 12.05 O ATOM 25 CB HIS A 3 -27.956 5.476 -19.470 1.00 13.18 C ATOM 26 CG HIS A 3 -29.358 5.023 -19.224 1.00 13.68 C ATOM 27 ND1 HIS A 3 -30.361 5.876 -18.822 1.00 14.14 N ATOM 28 CD2 HIS A 3 -29.928 3.800 -19.326 1.00 13.99 C ATOM 29 CE1 HIS A 3 -31.482 5.200 -18.688 1.00 14.68 C ATOM 30 NE2 HIS A 3 -31.251 3.935 -18.989 1.00 14.60 N ATOM 0 H HIS A 3 -28.025 7.508 -17.869 1.00 13.19 H new ATOM 0 HA HIS A 3 -27.166 4.709 -17.623 1.00 12.67 H new ATOM 0 HB2 HIS A 3 -27.979 6.429 -19.999 1.00 13.18 H new ATOM 0 HB3 HIS A 3 -27.462 4.759 -20.126 1.00 13.18 H new ATOM 0 HD2 HIS A 3 -29.433 2.886 -19.619 1.00 13.99 H new ATOM 0 HE1 HIS A 3 -32.433 5.611 -18.383 1.00 14.68 H new ATOM 0 HE2 HIS A 3 -31.941 3.184 -18.974 1.00 14.60 H new ATOM 39 N MET A 4 -25.155 7.042 -18.081 1.00 11.52 N ATOM 40 CA MET A 4 -23.769 7.407 -18.328 1.00 11.00 C ATOM 41 C MET A 4 -22.861 6.699 -17.330 1.00 10.19 C ATOM 42 O MET A 4 -22.526 7.251 -16.284 1.00 10.08 O ATOM 43 CB MET A 4 -23.589 8.926 -18.239 1.00 11.26 C ATOM 44 CG MET A 4 -22.172 9.395 -18.531 1.00 11.60 C ATOM 45 SD MET A 4 -21.584 8.859 -20.150 1.00 12.31 S ATOM 46 CE MET A 4 -19.952 9.599 -20.170 1.00 12.73 C ATOM 0 H MET A 4 -25.675 7.716 -17.519 1.00 11.52 H new ATOM 0 HA MET A 4 -23.496 7.092 -19.335 1.00 11.00 H new ATOM 0 HB2 MET A 4 -24.272 9.405 -18.941 1.00 11.26 H new ATOM 0 HB3 MET A 4 -23.873 9.258 -17.240 1.00 11.26 H new ATOM 0 HG2 MET A 4 -22.135 10.483 -18.477 1.00 11.60 H new ATOM 0 HG3 MET A 4 -21.501 9.015 -17.761 1.00 11.60 H new ATOM 0 HE1 MET A 4 -19.455 9.359 -21.110 1.00 12.73 H new ATOM 0 HE2 MET A 4 -20.042 10.681 -20.073 1.00 12.73 H new ATOM 0 HE3 MET A 4 -19.365 9.208 -19.339 1.00 12.73 H new ATOM 56 N VAL A 5 -22.492 5.466 -17.669 1.00 9.82 N ATOM 57 CA VAL A 5 -21.667 4.622 -16.807 1.00 9.21 C ATOM 58 C VAL A 5 -22.388 4.341 -15.490 1.00 8.39 C ATOM 59 O VAL A 5 -22.179 5.023 -14.486 1.00 8.39 O ATOM 60 CB VAL A 5 -20.277 5.243 -16.524 1.00 9.62 C ATOM 61 CG1 VAL A 5 -19.412 4.284 -15.718 1.00 10.18 C ATOM 62 CG2 VAL A 5 -19.582 5.627 -17.824 1.00 10.12 C ATOM 0 H VAL A 5 -22.756 5.023 -18.549 1.00 9.82 H new ATOM 0 HA VAL A 5 -21.504 3.687 -17.343 1.00 9.21 H new ATOM 0 HB VAL A 5 -20.424 6.148 -15.935 1.00 9.62 H new ATOM 0 HG11 VAL A 5 -18.440 4.741 -15.531 1.00 10.18 H new ATOM 0 HG12 VAL A 5 -19.899 4.065 -14.768 1.00 10.18 H new ATOM 0 HG13 VAL A 5 -19.276 3.359 -16.278 1.00 10.18 H new ATOM 0 HG21 VAL A 5 -18.607 6.061 -17.601 1.00 10.12 H new ATOM 0 HG22 VAL A 5 -19.451 4.739 -18.442 1.00 10.12 H new ATOM 0 HG23 VAL A 5 -20.190 6.356 -18.360 1.00 10.12 H new ATOM 72 N GLU A 6 -23.238 3.327 -15.503 1.00 7.91 N ATOM 73 CA GLU A 6 -24.040 2.988 -14.335 1.00 7.32 C ATOM 74 C GLU A 6 -23.358 1.908 -13.498 1.00 6.47 C ATOM 75 O GLU A 6 -24.011 1.141 -12.787 1.00 6.49 O ATOM 76 CB GLU A 6 -25.439 2.543 -14.756 1.00 7.80 C ATOM 77 CG GLU A 6 -25.446 1.474 -15.833 1.00 8.31 C ATOM 78 CD GLU A 6 -26.834 0.943 -16.097 1.00 8.82 C ATOM 79 OE1 GLU A 6 -27.564 1.540 -16.913 1.00 9.12 O ATOM 80 OE2 GLU A 6 -27.210 -0.068 -15.469 1.00 9.14 O ATOM 0 H GLU A 6 -23.392 2.723 -16.310 1.00 7.91 H new ATOM 0 HA GLU A 6 -24.135 3.881 -13.718 1.00 7.32 H new ATOM 0 HB2 GLU A 6 -25.969 2.167 -13.881 1.00 7.80 H new ATOM 0 HB3 GLU A 6 -25.993 3.410 -15.115 1.00 7.80 H new ATOM 0 HG2 GLU A 6 -25.035 1.886 -16.755 1.00 8.31 H new ATOM 0 HG3 GLU A 6 -24.795 0.653 -15.532 1.00 8.31 H new ATOM 87 N ARG A 7 -22.042 1.850 -13.607 1.00 5.97 N ATOM 88 CA ARG A 7 -21.231 0.987 -12.764 1.00 5.27 C ATOM 89 C ARG A 7 -20.101 1.801 -12.148 1.00 4.71 C ATOM 90 O ARG A 7 -19.097 2.077 -12.803 1.00 4.95 O ATOM 91 CB ARG A 7 -20.668 -0.200 -13.563 1.00 5.61 C ATOM 92 CG ARG A 7 -19.554 -0.958 -12.842 1.00 5.93 C ATOM 93 CD ARG A 7 -20.007 -1.505 -11.493 1.00 6.48 C ATOM 94 NE ARG A 7 -18.882 -1.992 -10.689 1.00 6.96 N ATOM 95 CZ ARG A 7 -19.015 -2.704 -9.570 1.00 7.68 C ATOM 96 NH1 ARG A 7 -20.216 -3.063 -9.140 1.00 7.98 N ATOM 97 NH2 ARG A 7 -17.943 -3.068 -8.884 1.00 8.35 N ATOM 0 H ARG A 7 -21.506 2.398 -14.280 1.00 5.97 H new ATOM 0 HA ARG A 7 -21.859 0.581 -11.971 1.00 5.27 H new ATOM 0 HB2 ARG A 7 -21.480 -0.892 -13.787 1.00 5.61 H new ATOM 0 HB3 ARG A 7 -20.288 0.164 -14.517 1.00 5.61 H new ATOM 0 HG2 ARG A 7 -19.212 -1.781 -13.469 1.00 5.93 H new ATOM 0 HG3 ARG A 7 -18.702 -0.294 -12.695 1.00 5.93 H new ATOM 0 HD2 ARG A 7 -20.533 -0.724 -10.944 1.00 6.48 H new ATOM 0 HD3 ARG A 7 -20.717 -2.317 -11.651 1.00 6.48 H new ATOM 0 HE ARG A 7 -17.938 -1.772 -11.006 1.00 6.96 H new ATOM 0 HH11 ARG A 7 -21.047 -2.795 -9.666 1.00 7.98 H new ATOM 0 HH12 ARG A 7 -20.309 -3.608 -8.283 1.00 7.98 H new ATOM 0 HH21 ARG A 7 -17.014 -2.804 -9.212 1.00 8.35 H new ATOM 0 HH22 ARG A 7 -18.046 -3.613 -8.028 1.00 8.35 H new ATOM 111 N PRO A 8 -20.273 2.226 -10.891 1.00 4.27 N ATOM 112 CA PRO A 8 -19.243 2.966 -10.171 1.00 3.88 C ATOM 113 C PRO A 8 -18.050 2.080 -9.833 1.00 3.07 C ATOM 114 O PRO A 8 -18.199 1.063 -9.153 1.00 2.74 O ATOM 115 CB PRO A 8 -19.956 3.428 -8.895 1.00 4.13 C ATOM 116 CG PRO A 8 -21.052 2.439 -8.696 1.00 4.60 C ATOM 117 CD PRO A 8 -21.484 2.018 -10.072 1.00 4.51 C ATOM 0 HA PRO A 8 -18.836 3.790 -10.757 1.00 3.88 H new ATOM 0 HB2 PRO A 8 -19.275 3.442 -8.044 1.00 4.13 H new ATOM 0 HB3 PRO A 8 -20.349 4.439 -9.005 1.00 4.13 H new ATOM 0 HG2 PRO A 8 -20.705 1.583 -8.117 1.00 4.60 H new ATOM 0 HG3 PRO A 8 -21.882 2.882 -8.145 1.00 4.60 H new ATOM 0 HD2 PRO A 8 -21.807 0.977 -10.090 1.00 4.51 H new ATOM 0 HD3 PRO A 8 -22.320 2.618 -10.432 1.00 4.51 H new ATOM 125 N PRO A 9 -16.859 2.434 -10.333 1.00 3.13 N ATOM 126 CA PRO A 9 -15.630 1.706 -10.026 1.00 2.76 C ATOM 127 C PRO A 9 -15.278 1.844 -8.553 1.00 1.86 C ATOM 128 O PRO A 9 -14.646 2.821 -8.144 1.00 2.21 O ATOM 129 CB PRO A 9 -14.566 2.381 -10.903 1.00 3.66 C ATOM 130 CG PRO A 9 -15.329 3.181 -11.907 1.00 4.29 C ATOM 131 CD PRO A 9 -16.611 3.572 -11.232 1.00 4.00 C ATOM 0 HA PRO A 9 -15.717 0.637 -10.221 1.00 2.76 H new ATOM 0 HB2 PRO A 9 -13.913 3.018 -10.307 1.00 3.66 H new ATOM 0 HB3 PRO A 9 -13.931 1.641 -11.391 1.00 3.66 H new ATOM 0 HG2 PRO A 9 -14.765 4.062 -12.215 1.00 4.29 H new ATOM 0 HG3 PRO A 9 -15.523 2.596 -12.806 1.00 4.29 H new ATOM 0 HD2 PRO A 9 -16.511 4.508 -10.683 1.00 4.00 H new ATOM 0 HD3 PRO A 9 -17.422 3.707 -11.948 1.00 4.00 H new ATOM 139 N VAL A 10 -15.719 0.880 -7.759 1.00 1.31 N ATOM 140 CA VAL A 10 -15.528 0.929 -6.323 1.00 1.04 C ATOM 141 C VAL A 10 -14.049 0.918 -5.964 1.00 0.88 C ATOM 142 O VAL A 10 -13.363 -0.095 -6.100 1.00 1.10 O ATOM 143 CB VAL A 10 -16.267 -0.224 -5.601 1.00 1.75 C ATOM 144 CG1 VAL A 10 -17.767 0.012 -5.627 1.00 2.58 C ATOM 145 CG2 VAL A 10 -15.939 -1.572 -6.228 1.00 2.47 C ATOM 0 H VAL A 10 -16.214 0.052 -8.090 1.00 1.31 H new ATOM 0 HA VAL A 10 -15.961 1.868 -5.978 1.00 1.04 H new ATOM 0 HB VAL A 10 -15.926 -0.241 -4.566 1.00 1.75 H new ATOM 0 HG11 VAL A 10 -18.273 -0.807 -5.116 1.00 2.58 H new ATOM 0 HG12 VAL A 10 -17.996 0.951 -5.124 1.00 2.58 H new ATOM 0 HG13 VAL A 10 -18.110 0.061 -6.661 1.00 2.58 H new ATOM 0 HG21 VAL A 10 -16.474 -2.360 -5.698 1.00 2.47 H new ATOM 0 HG22 VAL A 10 -16.242 -1.569 -7.275 1.00 2.47 H new ATOM 0 HG23 VAL A 10 -14.866 -1.753 -6.161 1.00 2.47 H new ATOM 155 N VAL A 11 -13.558 2.069 -5.526 1.00 0.67 N ATOM 156 CA VAL A 11 -12.197 2.202 -5.091 1.00 0.60 C ATOM 157 C VAL A 11 -12.039 1.498 -3.748 1.00 0.56 C ATOM 158 O VAL A 11 -12.260 2.074 -2.683 1.00 0.74 O ATOM 159 CB VAL A 11 -11.821 3.693 -4.997 1.00 0.61 C ATOM 160 CG1 VAL A 11 -10.421 3.858 -4.465 1.00 1.00 C ATOM 161 CG2 VAL A 11 -11.953 4.352 -6.364 1.00 0.98 C ATOM 0 H VAL A 11 -14.102 2.930 -5.467 1.00 0.67 H new ATOM 0 HA VAL A 11 -11.522 1.737 -5.809 1.00 0.60 H new ATOM 0 HB VAL A 11 -12.506 4.181 -4.304 1.00 0.61 H new ATOM 0 HG11 VAL A 11 -10.176 4.919 -4.407 1.00 1.00 H new ATOM 0 HG12 VAL A 11 -10.355 3.415 -3.471 1.00 1.00 H new ATOM 0 HG13 VAL A 11 -9.717 3.359 -5.132 1.00 1.00 H new ATOM 0 HG21 VAL A 11 -11.685 5.406 -6.287 1.00 0.98 H new ATOM 0 HG22 VAL A 11 -11.287 3.859 -7.072 1.00 0.98 H new ATOM 0 HG23 VAL A 11 -12.982 4.264 -6.713 1.00 0.98 H new ATOM 171 N THR A 12 -11.696 0.227 -3.833 1.00 0.46 N ATOM 172 CA THR A 12 -11.680 -0.657 -2.687 1.00 0.45 C ATOM 173 C THR A 12 -10.391 -0.504 -1.894 1.00 0.39 C ATOM 174 O THR A 12 -9.300 -0.688 -2.431 1.00 0.43 O ATOM 175 CB THR A 12 -11.831 -2.117 -3.157 1.00 0.55 C ATOM 176 OG1 THR A 12 -12.946 -2.224 -4.054 1.00 0.66 O ATOM 177 CG2 THR A 12 -12.034 -3.053 -1.979 1.00 0.62 C ATOM 0 H THR A 12 -11.419 -0.223 -4.706 1.00 0.46 H new ATOM 0 HA THR A 12 -12.514 -0.391 -2.037 1.00 0.45 H new ATOM 0 HB THR A 12 -10.914 -2.406 -3.671 1.00 0.55 H new ATOM 0 HG1 THR A 12 -13.239 -3.158 -4.102 1.00 0.66 H new ATOM 0 HG21 THR A 12 -12.138 -4.076 -2.341 1.00 0.62 H new ATOM 0 HG22 THR A 12 -11.175 -2.989 -1.311 1.00 0.62 H new ATOM 0 HG23 THR A 12 -12.936 -2.767 -1.438 1.00 0.62 H new ATOM 185 N ILE A 13 -10.516 -0.159 -0.621 1.00 0.39 N ATOM 186 CA ILE A 13 -9.354 -0.036 0.242 1.00 0.38 C ATOM 187 C ILE A 13 -9.052 -1.376 0.886 1.00 0.37 C ATOM 188 O ILE A 13 -9.847 -1.900 1.670 1.00 0.51 O ATOM 189 CB ILE A 13 -9.550 1.033 1.336 1.00 0.50 C ATOM 190 CG1 ILE A 13 -9.736 2.409 0.694 1.00 0.86 C ATOM 191 CG2 ILE A 13 -8.367 1.043 2.302 1.00 0.80 C ATOM 192 CD1 ILE A 13 -9.795 3.532 1.697 1.00 1.03 C ATOM 0 H ILE A 13 -11.407 0.040 -0.166 1.00 0.39 H new ATOM 0 HA ILE A 13 -8.516 0.280 -0.379 1.00 0.38 H new ATOM 0 HB ILE A 13 -10.446 0.789 1.906 1.00 0.50 H new ATOM 0 HG12 ILE A 13 -8.915 2.593 0.001 1.00 0.86 H new ATOM 0 HG13 ILE A 13 -10.654 2.407 0.107 1.00 0.86 H new ATOM 0 HG21 ILE A 13 -8.527 1.805 3.065 1.00 0.80 H new ATOM 0 HG22 ILE A 13 -8.277 0.066 2.777 1.00 0.80 H new ATOM 0 HG23 ILE A 13 -7.451 1.265 1.754 1.00 0.80 H new ATOM 0 HD11 ILE A 13 -9.928 4.480 1.175 1.00 1.03 H new ATOM 0 HD12 ILE A 13 -10.633 3.371 2.375 1.00 1.03 H new ATOM 0 HD13 ILE A 13 -8.867 3.559 2.268 1.00 1.03 H new ATOM 204 N MET A 14 -7.911 -1.933 0.533 1.00 0.31 N ATOM 205 CA MET A 14 -7.540 -3.263 1.011 1.00 0.35 C ATOM 206 C MET A 14 -6.065 -3.345 1.376 1.00 0.29 C ATOM 207 O MET A 14 -5.282 -2.449 1.071 1.00 0.46 O ATOM 208 CB MET A 14 -7.860 -4.345 -0.031 1.00 0.56 C ATOM 209 CG MET A 14 -9.340 -4.484 -0.343 1.00 0.75 C ATOM 210 SD MET A 14 -9.736 -5.994 -1.250 1.00 1.04 S ATOM 211 CE MET A 14 -9.106 -5.603 -2.878 1.00 0.77 C ATOM 0 H MET A 14 -7.224 -1.494 -0.079 1.00 0.31 H new ATOM 0 HA MET A 14 -8.134 -3.441 1.908 1.00 0.35 H new ATOM 0 HB2 MET A 14 -7.325 -4.117 -0.953 1.00 0.56 H new ATOM 0 HB3 MET A 14 -7.483 -5.303 0.328 1.00 0.56 H new ATOM 0 HG2 MET A 14 -9.904 -4.469 0.589 1.00 0.75 H new ATOM 0 HG3 MET A 14 -9.665 -3.622 -0.926 1.00 0.75 H new ATOM 0 HE1 MET A 14 -9.312 -6.431 -3.556 1.00 0.77 H new ATOM 0 HE2 MET A 14 -9.591 -4.700 -3.249 1.00 0.77 H new ATOM 0 HE3 MET A 14 -8.030 -5.439 -2.822 1.00 0.77 H new ATOM 221 N GLY A 15 -5.709 -4.430 2.044 1.00 0.34 N ATOM 222 CA GLY A 15 -4.340 -4.690 2.410 1.00 0.45 C ATOM 223 C GLY A 15 -4.278 -5.454 3.711 1.00 0.62 C ATOM 224 O GLY A 15 -4.422 -6.671 3.737 1.00 1.55 O ATOM 0 H GLY A 15 -6.366 -5.150 2.344 1.00 0.34 H new ATOM 0 HA2 GLY A 15 -3.849 -5.261 1.622 1.00 0.45 H new ATOM 0 HA3 GLY A 15 -3.798 -3.749 2.507 1.00 0.45 H new ATOM 228 N HIS A 16 -4.098 -4.722 4.785 1.00 0.51 N ATOM 229 CA HIS A 16 -4.101 -5.278 6.126 1.00 0.45 C ATOM 230 C HIS A 16 -4.320 -4.144 7.130 1.00 0.49 C ATOM 231 O HIS A 16 -3.944 -2.997 6.883 1.00 0.64 O ATOM 232 CB HIS A 16 -2.787 -6.030 6.393 1.00 0.43 C ATOM 233 CG HIS A 16 -2.608 -6.452 7.821 1.00 0.48 C ATOM 234 ND1 HIS A 16 -3.460 -7.347 8.416 1.00 0.62 N ATOM 235 CD2 HIS A 16 -1.685 -6.052 8.726 1.00 0.50 C ATOM 236 CE1 HIS A 16 -3.040 -7.472 9.663 1.00 0.66 C ATOM 237 NE2 HIS A 16 -1.969 -6.705 9.899 1.00 0.59 N ATOM 0 H HIS A 16 -3.944 -3.714 4.757 1.00 0.51 H new ATOM 0 HA HIS A 16 -4.911 -5.999 6.233 1.00 0.45 H new ATOM 0 HB2 HIS A 16 -2.749 -6.914 5.756 1.00 0.43 H new ATOM 0 HB3 HIS A 16 -1.950 -5.393 6.105 1.00 0.43 H new ATOM 0 HD2 HIS A 16 -0.879 -5.353 8.557 1.00 0.50 H new ATOM 0 HE1 HIS A 16 -3.503 -8.113 10.399 1.00 0.66 H new ATOM 0 HE2 HIS A 16 -1.462 -6.622 10.780 1.00 0.59 H new ATOM 245 N VAL A 17 -4.949 -4.481 8.254 1.00 0.53 N ATOM 246 CA VAL A 17 -5.462 -3.487 9.196 1.00 0.67 C ATOM 247 C VAL A 17 -4.369 -2.650 9.852 1.00 0.64 C ATOM 248 O VAL A 17 -4.625 -1.509 10.236 1.00 0.78 O ATOM 249 CB VAL A 17 -6.323 -4.145 10.296 1.00 0.87 C ATOM 250 CG1 VAL A 17 -7.561 -4.789 9.691 1.00 1.55 C ATOM 251 CG2 VAL A 17 -5.521 -5.168 11.087 1.00 1.62 C ATOM 0 H VAL A 17 -5.117 -5.446 8.537 1.00 0.53 H new ATOM 0 HA VAL A 17 -6.076 -2.816 8.596 1.00 0.67 H new ATOM 0 HB VAL A 17 -6.639 -3.363 10.986 1.00 0.87 H new ATOM 0 HG11 VAL A 17 -8.156 -5.248 10.481 1.00 1.55 H new ATOM 0 HG12 VAL A 17 -8.156 -4.029 9.184 1.00 1.55 H new ATOM 0 HG13 VAL A 17 -7.260 -5.553 8.974 1.00 1.55 H new ATOM 0 HG21 VAL A 17 -6.155 -5.613 11.854 1.00 1.62 H new ATOM 0 HG22 VAL A 17 -5.162 -5.948 10.415 1.00 1.62 H new ATOM 0 HG23 VAL A 17 -4.671 -4.677 11.560 1.00 1.62 H new ATOM 261 N ASP A 18 -3.165 -3.202 9.972 1.00 0.57 N ATOM 262 CA ASP A 18 -2.065 -2.503 10.643 1.00 0.61 C ATOM 263 C ASP A 18 -1.403 -1.486 9.726 1.00 0.56 C ATOM 264 O ASP A 18 -0.768 -0.540 10.192 1.00 0.69 O ATOM 265 CB ASP A 18 -1.006 -3.488 11.142 1.00 0.69 C ATOM 266 CG ASP A 18 -1.436 -4.243 12.381 1.00 1.06 C ATOM 267 OD1 ASP A 18 -1.441 -3.646 13.477 1.00 1.17 O ATOM 268 OD2 ASP A 18 -1.751 -5.447 12.268 1.00 1.78 O ATOM 0 H ASP A 18 -2.923 -4.127 9.616 1.00 0.57 H new ATOM 0 HA ASP A 18 -2.502 -1.980 11.494 1.00 0.61 H new ATOM 0 HB2 ASP A 18 -0.779 -4.201 10.349 1.00 0.69 H new ATOM 0 HB3 ASP A 18 -0.085 -2.945 11.356 1.00 0.69 H new ATOM 273 N HIS A 19 -1.548 -1.686 8.422 1.00 0.46 N ATOM 274 CA HIS A 19 -0.919 -0.817 7.446 1.00 0.48 C ATOM 275 C HIS A 19 -1.587 0.550 7.428 1.00 0.58 C ATOM 276 O HIS A 19 -0.951 1.571 7.693 1.00 0.65 O ATOM 277 CB HIS A 19 -0.983 -1.448 6.058 1.00 0.46 C ATOM 278 CG HIS A 19 -0.184 -2.706 5.936 1.00 0.40 C ATOM 279 ND1 HIS A 19 -0.559 -3.714 5.082 1.00 0.60 N ATOM 280 CD2 HIS A 19 0.966 -3.058 6.557 1.00 0.56 C ATOM 281 CE1 HIS A 19 0.367 -4.645 5.201 1.00 0.53 C ATOM 282 NE2 HIS A 19 1.307 -4.294 6.082 1.00 0.48 N ATOM 0 H HIS A 19 -2.098 -2.445 8.019 1.00 0.46 H new ATOM 0 HA HIS A 19 0.125 -0.687 7.730 1.00 0.48 H new ATOM 0 HB2 HIS A 19 -2.023 -1.663 5.813 1.00 0.46 H new ATOM 0 HB3 HIS A 19 -0.625 -0.727 5.323 1.00 0.46 H new ATOM 0 HD2 HIS A 19 1.509 -2.475 7.286 1.00 0.56 H new ATOM 0 HE1 HIS A 19 0.365 -5.576 4.654 1.00 0.53 H new ATOM 0 HE2 HIS A 19 2.124 -4.843 6.350 1.00 0.48 H new ATOM 290 N GLY A 20 -2.874 0.559 7.124 1.00 0.76 N ATOM 291 CA GLY A 20 -3.616 1.799 7.107 1.00 0.90 C ATOM 292 C GLY A 20 -4.966 1.656 6.441 1.00 0.81 C ATOM 293 O GLY A 20 -5.259 2.347 5.472 1.00 0.93 O ATOM 0 H GLY A 20 -3.418 -0.271 6.889 1.00 0.76 H new ATOM 0 HA2 GLY A 20 -3.754 2.150 8.130 1.00 0.90 H new ATOM 0 HA3 GLY A 20 -3.035 2.559 6.585 1.00 0.90 H new ATOM 297 N LYS A 21 -5.795 0.763 6.961 1.00 0.79 N ATOM 298 CA LYS A 21 -7.110 0.533 6.385 1.00 0.87 C ATOM 299 C LYS A 21 -8.118 1.494 6.997 1.00 0.89 C ATOM 300 O LYS A 21 -8.531 2.473 6.381 1.00 0.93 O ATOM 301 CB LYS A 21 -7.568 -0.898 6.657 1.00 1.09 C ATOM 302 CG LYS A 21 -8.756 -1.336 5.809 1.00 1.20 C ATOM 303 CD LYS A 21 -9.420 -2.589 6.365 1.00 1.39 C ATOM 304 CE LYS A 21 -10.293 -2.273 7.576 1.00 1.73 C ATOM 305 NZ LYS A 21 -11.540 -1.550 7.200 1.00 2.11 N ATOM 0 H LYS A 21 -5.581 0.189 7.777 1.00 0.79 H new ATOM 0 HA LYS A 21 -7.046 0.695 5.309 1.00 0.87 H new ATOM 0 HB2 LYS A 21 -6.735 -1.577 6.476 1.00 1.09 H new ATOM 0 HB3 LYS A 21 -7.832 -0.991 7.711 1.00 1.09 H new ATOM 0 HG2 LYS A 21 -9.486 -0.528 5.763 1.00 1.20 H new ATOM 0 HG3 LYS A 21 -8.424 -1.524 4.788 1.00 1.20 H new ATOM 0 HD2 LYS A 21 -10.028 -3.054 5.589 1.00 1.39 H new ATOM 0 HD3 LYS A 21 -8.655 -3.312 6.646 1.00 1.39 H new ATOM 0 HE2 LYS A 21 -10.553 -3.201 8.086 1.00 1.73 H new ATOM 0 HE3 LYS A 21 -9.725 -1.669 8.283 1.00 1.73 H new ATOM 0 HZ1 LYS A 21 -12.059 -1.282 8.061 1.00 2.11 H new ATOM 0 HZ2 LYS A 21 -11.296 -0.694 6.662 1.00 2.11 H new ATOM 0 HZ3 LYS A 21 -12.137 -2.168 6.614 1.00 2.11 H new ATOM 319 N THR A 22 -8.469 1.213 8.240 1.00 0.92 N ATOM 320 CA THR A 22 -9.481 1.971 8.946 1.00 1.00 C ATOM 321 C THR A 22 -8.964 3.364 9.324 1.00 0.99 C ATOM 322 O THR A 22 -9.738 4.311 9.455 1.00 1.03 O ATOM 323 CB THR A 22 -9.935 1.201 10.203 1.00 1.10 C ATOM 324 OG1 THR A 22 -10.971 1.914 10.885 1.00 1.80 O ATOM 325 CG2 THR A 22 -8.759 0.956 11.141 1.00 1.65 C ATOM 0 H THR A 22 -8.060 0.454 8.785 1.00 0.92 H new ATOM 0 HA THR A 22 -10.337 2.103 8.284 1.00 1.00 H new ATOM 0 HB THR A 22 -10.329 0.236 9.883 1.00 1.10 H new ATOM 0 HG1 THR A 22 -11.247 1.410 11.679 1.00 1.80 H new ATOM 0 HG21 THR A 22 -9.102 0.412 12.021 1.00 1.65 H new ATOM 0 HG22 THR A 22 -7.998 0.370 10.625 1.00 1.65 H new ATOM 0 HG23 THR A 22 -8.334 1.911 11.449 1.00 1.65 H new ATOM 333 N THR A 23 -7.649 3.492 9.475 1.00 0.99 N ATOM 334 CA THR A 23 -7.054 4.780 9.800 1.00 1.02 C ATOM 335 C THR A 23 -7.008 5.668 8.560 1.00 0.96 C ATOM 336 O THR A 23 -6.879 6.885 8.667 1.00 0.96 O ATOM 337 CB THR A 23 -5.638 4.630 10.406 1.00 1.12 C ATOM 338 OG1 THR A 23 -5.117 5.912 10.780 1.00 1.77 O ATOM 339 CG2 THR A 23 -4.685 3.966 9.428 1.00 1.41 C ATOM 0 H THR A 23 -6.982 2.726 9.378 1.00 0.99 H new ATOM 0 HA THR A 23 -7.683 5.249 10.556 1.00 1.02 H new ATOM 0 HB THR A 23 -5.725 3.998 11.290 1.00 1.12 H new ATOM 0 HG1 THR A 23 -5.567 6.612 10.262 1.00 1.77 H new ATOM 0 HG21 THR A 23 -3.699 3.876 9.885 1.00 1.41 H new ATOM 0 HG22 THR A 23 -5.059 2.974 9.172 1.00 1.41 H new ATOM 0 HG23 THR A 23 -4.612 4.570 8.524 1.00 1.41 H new ATOM 347 N LEU A 24 -7.133 5.055 7.383 1.00 0.96 N ATOM 348 CA LEU A 24 -7.222 5.815 6.143 1.00 0.96 C ATOM 349 C LEU A 24 -8.573 6.511 6.114 1.00 0.89 C ATOM 350 O LEU A 24 -8.671 7.699 5.819 1.00 0.91 O ATOM 351 CB LEU A 24 -7.062 4.882 4.932 1.00 1.06 C ATOM 352 CG LEU A 24 -6.495 5.519 3.651 1.00 0.88 C ATOM 353 CD1 LEU A 24 -7.445 6.558 3.075 1.00 1.78 C ATOM 354 CD2 LEU A 24 -5.131 6.135 3.926 1.00 1.57 C ATOM 0 H LEU A 24 -7.174 4.043 7.265 1.00 0.96 H new ATOM 0 HA LEU A 24 -6.423 6.555 6.094 1.00 0.96 H new ATOM 0 HB2 LEU A 24 -6.412 4.056 5.220 1.00 1.06 H new ATOM 0 HB3 LEU A 24 -8.037 4.454 4.699 1.00 1.06 H new ATOM 0 HG LEU A 24 -6.382 4.730 2.908 1.00 0.88 H new ATOM 0 HD11 LEU A 24 -7.011 6.986 2.171 1.00 1.78 H new ATOM 0 HD12 LEU A 24 -8.397 6.086 2.832 1.00 1.78 H new ATOM 0 HD13 LEU A 24 -7.609 7.348 3.808 1.00 1.78 H new ATOM 0 HD21 LEU A 24 -4.742 6.582 3.011 1.00 1.57 H new ATOM 0 HD22 LEU A 24 -5.227 6.904 4.693 1.00 1.57 H new ATOM 0 HD23 LEU A 24 -4.445 5.361 4.272 1.00 1.57 H new ATOM 366 N LEU A 25 -9.601 5.755 6.477 1.00 0.88 N ATOM 367 CA LEU A 25 -10.960 6.270 6.550 1.00 0.91 C ATOM 368 C LEU A 25 -11.050 7.367 7.614 1.00 0.89 C ATOM 369 O LEU A 25 -11.709 8.379 7.419 1.00 0.92 O ATOM 370 CB LEU A 25 -11.916 5.115 6.884 1.00 1.02 C ATOM 371 CG LEU A 25 -13.356 5.251 6.369 1.00 1.21 C ATOM 372 CD1 LEU A 25 -14.071 3.905 6.430 1.00 1.76 C ATOM 373 CD2 LEU A 25 -14.131 6.292 7.170 1.00 1.96 C ATOM 0 H LEU A 25 -9.516 4.770 6.728 1.00 0.88 H new ATOM 0 HA LEU A 25 -11.241 6.703 5.590 1.00 0.91 H new ATOM 0 HB2 LEU A 25 -11.494 4.195 6.480 1.00 1.02 H new ATOM 0 HB3 LEU A 25 -11.950 5.002 7.968 1.00 1.02 H new ATOM 0 HG LEU A 25 -13.311 5.583 5.332 1.00 1.21 H new ATOM 0 HD11 LEU A 25 -15.091 4.018 6.062 1.00 1.76 H new ATOM 0 HD12 LEU A 25 -13.539 3.182 5.811 1.00 1.76 H new ATOM 0 HD13 LEU A 25 -14.095 3.552 7.461 1.00 1.76 H new ATOM 0 HD21 LEU A 25 -15.147 6.367 6.783 1.00 1.96 H new ATOM 0 HD22 LEU A 25 -14.163 5.995 8.218 1.00 1.96 H new ATOM 0 HD23 LEU A 25 -13.637 7.260 7.082 1.00 1.96 H new ATOM 385 N ASP A 26 -10.381 7.156 8.741 1.00 0.91 N ATOM 386 CA ASP A 26 -10.348 8.154 9.818 1.00 0.96 C ATOM 387 C ASP A 26 -9.663 9.445 9.372 1.00 0.92 C ATOM 388 O ASP A 26 -10.225 10.531 9.510 1.00 0.95 O ATOM 389 CB ASP A 26 -9.658 7.589 11.052 1.00 1.05 C ATOM 390 CG ASP A 26 -9.174 8.667 12.014 1.00 1.21 C ATOM 391 OD1 ASP A 26 -10.016 9.237 12.735 1.00 1.35 O ATOM 392 OD2 ASP A 26 -7.952 8.938 12.060 1.00 1.38 O ATOM 0 H ASP A 26 -9.853 6.306 8.939 1.00 0.91 H new ATOM 0 HA ASP A 26 -11.381 8.396 10.070 1.00 0.96 H new ATOM 0 HB2 ASP A 26 -10.348 6.927 11.575 1.00 1.05 H new ATOM 0 HB3 ASP A 26 -8.809 6.982 10.740 1.00 1.05 H new ATOM 397 N ALA A 27 -8.456 9.330 8.828 1.00 0.89 N ATOM 398 CA ALA A 27 -7.709 10.500 8.369 1.00 0.89 C ATOM 399 C ALA A 27 -8.451 11.217 7.254 1.00 0.85 C ATOM 400 O ALA A 27 -8.515 12.445 7.220 1.00 0.90 O ATOM 401 CB ALA A 27 -6.328 10.098 7.889 1.00 0.91 C ATOM 0 H ALA A 27 -7.973 8.442 8.694 1.00 0.89 H new ATOM 0 HA ALA A 27 -7.607 11.181 9.214 1.00 0.89 H new ATOM 0 HB1 ALA A 27 -5.788 10.983 7.552 1.00 0.91 H new ATOM 0 HB2 ALA A 27 -5.781 9.629 8.707 1.00 0.91 H new ATOM 0 HB3 ALA A 27 -6.421 9.393 7.063 1.00 0.91 H new ATOM 407 N ILE A 28 -9.014 10.437 6.351 1.00 0.82 N ATOM 408 CA ILE A 28 -9.785 10.963 5.240 1.00 0.83 C ATOM 409 C ILE A 28 -11.062 11.625 5.770 1.00 0.88 C ATOM 410 O ILE A 28 -11.568 12.588 5.199 1.00 0.94 O ATOM 411 CB ILE A 28 -10.117 9.820 4.254 1.00 0.86 C ATOM 412 CG1 ILE A 28 -10.056 10.284 2.807 1.00 0.99 C ATOM 413 CG2 ILE A 28 -11.483 9.221 4.538 1.00 1.56 C ATOM 414 CD1 ILE A 28 -10.147 9.124 1.846 1.00 0.95 C ATOM 0 H ILE A 28 -8.950 9.419 6.367 1.00 0.82 H new ATOM 0 HA ILE A 28 -9.204 11.716 4.708 1.00 0.83 H new ATOM 0 HB ILE A 28 -9.357 9.053 4.403 1.00 0.86 H new ATOM 0 HG12 ILE A 28 -10.871 10.982 2.614 1.00 0.99 H new ATOM 0 HG13 ILE A 28 -9.125 10.826 2.637 1.00 0.99 H new ATOM 0 HG21 ILE A 28 -11.684 8.420 3.826 1.00 1.56 H new ATOM 0 HG22 ILE A 28 -11.501 8.819 5.551 1.00 1.56 H new ATOM 0 HG23 ILE A 28 -12.246 9.993 4.441 1.00 1.56 H new ATOM 0 HD11 ILE A 28 -10.100 9.495 0.822 1.00 0.95 H new ATOM 0 HD12 ILE A 28 -9.317 8.440 2.022 1.00 0.95 H new ATOM 0 HD13 ILE A 28 -11.090 8.598 1.998 1.00 0.95 H new ATOM 426 N ARG A 29 -11.547 11.105 6.893 1.00 0.93 N ATOM 427 CA ARG A 29 -12.713 11.648 7.573 1.00 1.04 C ATOM 428 C ARG A 29 -12.372 13.001 8.192 1.00 1.08 C ATOM 429 O ARG A 29 -13.212 13.898 8.264 1.00 1.17 O ATOM 430 CB ARG A 29 -13.179 10.665 8.652 1.00 1.16 C ATOM 431 CG ARG A 29 -14.302 11.170 9.535 1.00 1.33 C ATOM 432 CD ARG A 29 -15.592 11.369 8.756 1.00 1.58 C ATOM 433 NE ARG A 29 -16.673 11.858 9.612 1.00 2.13 N ATOM 434 CZ ARG A 29 -17.899 12.136 9.178 1.00 2.85 C ATOM 435 NH1 ARG A 29 -18.211 11.968 7.900 1.00 3.29 N ATOM 436 NH2 ARG A 29 -18.814 12.583 10.030 1.00 3.56 N ATOM 0 H ARG A 29 -11.140 10.293 7.357 1.00 0.93 H new ATOM 0 HA ARG A 29 -13.520 11.792 6.854 1.00 1.04 H new ATOM 0 HB2 ARG A 29 -13.504 9.744 8.168 1.00 1.16 H new ATOM 0 HB3 ARG A 29 -12.327 10.410 9.283 1.00 1.16 H new ATOM 0 HG2 ARG A 29 -14.473 10.461 10.345 1.00 1.33 H new ATOM 0 HG3 ARG A 29 -14.006 12.113 9.994 1.00 1.33 H new ATOM 0 HD2 ARG A 29 -15.422 12.077 7.945 1.00 1.58 H new ATOM 0 HD3 ARG A 29 -15.889 10.426 8.298 1.00 1.58 H new ATOM 0 HE ARG A 29 -16.474 11.994 10.603 1.00 2.13 H new ATOM 0 HH11 ARG A 29 -17.509 11.624 7.245 1.00 3.29 H new ATOM 0 HH12 ARG A 29 -19.153 12.183 7.572 1.00 3.29 H new ATOM 0 HH21 ARG A 29 -18.575 12.712 11.013 1.00 3.56 H new ATOM 0 HH22 ARG A 29 -19.755 12.797 9.701 1.00 3.56 H new ATOM 450 N HIS A 30 -11.124 13.138 8.629 1.00 1.05 N ATOM 451 CA HIS A 30 -10.619 14.404 9.141 1.00 1.13 C ATOM 452 C HIS A 30 -10.628 15.440 8.031 1.00 1.15 C ATOM 453 O HIS A 30 -10.760 16.638 8.268 1.00 1.32 O ATOM 454 CB HIS A 30 -9.204 14.244 9.664 1.00 1.23 C ATOM 455 CG HIS A 30 -9.053 13.291 10.792 1.00 1.70 C ATOM 456 ND1 HIS A 30 -7.839 12.802 11.207 1.00 2.44 N ATOM 457 CD2 HIS A 30 -9.976 12.722 11.572 1.00 2.01 C ATOM 458 CE1 HIS A 30 -8.029 11.965 12.203 1.00 2.88 C ATOM 459 NE2 HIS A 30 -9.325 11.888 12.449 1.00 2.60 N ATOM 0 H HIS A 30 -10.441 12.381 8.638 1.00 1.05 H new ATOM 0 HA HIS A 30 -11.262 14.728 9.959 1.00 1.13 H new ATOM 0 HB2 HIS A 30 -8.565 13.916 8.844 1.00 1.23 H new ATOM 0 HB3 HIS A 30 -8.838 15.220 9.982 1.00 1.23 H new ATOM 0 HD2 HIS A 30 -11.042 12.888 11.522 1.00 2.01 H new ATOM 0 HE1 HIS A 30 -7.255 11.429 12.732 1.00 2.88 H new ATOM 0 HE2 HIS A 30 -9.765 11.310 13.165 1.00 2.60 H new ATOM 468 N SER A 31 -10.493 14.949 6.808 1.00 1.07 N ATOM 469 CA SER A 31 -10.517 15.787 5.626 1.00 1.19 C ATOM 470 C SER A 31 -11.951 15.977 5.124 1.00 1.32 C ATOM 471 O SER A 31 -12.173 16.492 4.029 1.00 1.76 O ATOM 472 CB SER A 31 -9.620 15.175 4.544 1.00 1.15 C ATOM 473 OG SER A 31 -8.251 15.350 4.877 1.00 1.50 O ATOM 0 H SER A 31 -10.364 13.957 6.611 1.00 1.07 H new ATOM 0 HA SER A 31 -10.130 16.774 5.878 1.00 1.19 H new ATOM 0 HB2 SER A 31 -9.842 14.113 4.437 1.00 1.15 H new ATOM 0 HB3 SER A 31 -9.829 15.643 3.582 1.00 1.15 H new ATOM 0 HG SER A 31 -7.691 14.953 4.178 1.00 1.50 H new ATOM 479 N LYS A 32 -12.910 15.571 5.960 1.00 1.43 N ATOM 480 CA LYS A 32 -14.334 15.767 5.699 1.00 1.81 C ATOM 481 C LYS A 32 -14.747 15.133 4.371 1.00 1.37 C ATOM 482 O LYS A 32 -14.450 13.962 4.126 1.00 1.78 O ATOM 483 CB LYS A 32 -14.662 17.262 5.705 1.00 2.82 C ATOM 484 CG LYS A 32 -14.208 17.997 6.958 1.00 3.53 C ATOM 485 CD LYS A 32 -14.724 17.345 8.231 1.00 4.33 C ATOM 486 CE LYS A 32 -14.376 18.176 9.459 1.00 5.18 C ATOM 487 NZ LYS A 32 -12.907 18.352 9.630 1.00 5.71 N ATOM 0 H LYS A 32 -12.717 15.095 6.841 1.00 1.43 H new ATOM 0 HA LYS A 32 -14.899 15.274 6.490 1.00 1.81 H new ATOM 0 HB2 LYS A 32 -14.197 17.728 4.836 1.00 2.82 H new ATOM 0 HB3 LYS A 32 -15.739 17.386 5.595 1.00 2.82 H new ATOM 0 HG2 LYS A 32 -13.119 18.027 6.984 1.00 3.53 H new ATOM 0 HG3 LYS A 32 -14.554 19.030 6.916 1.00 3.53 H new ATOM 0 HD2 LYS A 32 -15.805 17.222 8.167 1.00 4.33 H new ATOM 0 HD3 LYS A 32 -14.295 16.348 8.331 1.00 4.33 H new ATOM 0 HE2 LYS A 32 -14.849 19.155 9.378 1.00 5.18 H new ATOM 0 HE3 LYS A 32 -14.787 17.696 10.347 1.00 5.18 H new ATOM 0 HZ1 LYS A 32 -12.659 18.242 10.634 1.00 5.71 H new ATOM 0 HZ2 LYS A 32 -12.404 17.636 9.068 1.00 5.71 H new ATOM 0 HZ3 LYS A 32 -12.631 19.302 9.308 1.00 5.71 H new ATOM 501 N VAL A 33 -15.480 15.911 3.558 1.00 1.59 N ATOM 502 CA VAL A 33 -15.904 15.545 2.190 1.00 1.75 C ATOM 503 C VAL A 33 -16.552 14.162 2.101 1.00 1.88 C ATOM 504 O VAL A 33 -16.648 13.585 1.020 1.00 2.52 O ATOM 505 CB VAL A 33 -14.743 15.627 1.161 1.00 2.22 C ATOM 506 CG1 VAL A 33 -14.052 16.980 1.229 1.00 2.95 C ATOM 507 CG2 VAL A 33 -13.738 14.495 1.348 1.00 2.99 C ATOM 0 H VAL A 33 -15.804 16.837 3.838 1.00 1.59 H new ATOM 0 HA VAL A 33 -16.658 16.290 1.937 1.00 1.75 H new ATOM 0 HB VAL A 33 -15.181 15.514 0.169 1.00 2.22 H new ATOM 0 HG11 VAL A 33 -13.243 17.012 0.499 1.00 2.95 H new ATOM 0 HG12 VAL A 33 -14.772 17.768 1.008 1.00 2.95 H new ATOM 0 HG13 VAL A 33 -13.645 17.131 2.229 1.00 2.95 H new ATOM 0 HG21 VAL A 33 -12.942 14.589 0.609 1.00 2.99 H new ATOM 0 HG22 VAL A 33 -13.311 14.549 2.350 1.00 2.99 H new ATOM 0 HG23 VAL A 33 -14.241 13.537 1.219 1.00 2.99 H new ATOM 517 N THR A 34 -17.026 13.646 3.213 1.00 1.80 N ATOM 518 CA THR A 34 -17.544 12.295 3.253 1.00 2.15 C ATOM 519 C THR A 34 -19.071 12.265 3.220 1.00 1.77 C ATOM 520 O THR A 34 -19.743 12.888 4.045 1.00 2.24 O ATOM 521 CB THR A 34 -17.031 11.565 4.502 1.00 3.04 C ATOM 522 OG1 THR A 34 -16.647 12.519 5.507 1.00 3.73 O ATOM 523 CG2 THR A 34 -15.845 10.676 4.163 1.00 3.93 C ATOM 0 H THR A 34 -17.064 14.142 4.104 1.00 1.80 H new ATOM 0 HA THR A 34 -17.185 11.783 2.360 1.00 2.15 H new ATOM 0 HB THR A 34 -17.837 10.938 4.884 1.00 3.04 H new ATOM 0 HG1 THR A 34 -15.698 12.403 5.722 1.00 3.73 H new ATOM 0 HG21 THR A 34 -15.500 10.170 5.065 1.00 3.93 H new ATOM 0 HG22 THR A 34 -16.146 9.934 3.423 1.00 3.93 H new ATOM 0 HG23 THR A 34 -15.037 11.286 3.758 1.00 3.93 H new ATOM 531 N GLU A 35 -19.603 11.554 2.232 1.00 1.44 N ATOM 532 CA GLU A 35 -21.036 11.330 2.116 1.00 1.66 C ATOM 533 C GLU A 35 -21.484 10.322 3.157 1.00 1.86 C ATOM 534 O GLU A 35 -22.462 10.534 3.873 1.00 2.52 O ATOM 535 CB GLU A 35 -21.378 10.812 0.719 1.00 2.22 C ATOM 536 CG GLU A 35 -21.272 11.861 -0.373 1.00 3.01 C ATOM 537 CD GLU A 35 -22.314 12.947 -0.231 1.00 3.69 C ATOM 538 OE1 GLU A 35 -23.469 12.727 -0.644 1.00 4.12 O ATOM 539 OE2 GLU A 35 -21.983 14.026 0.301 1.00 4.20 O ATOM 0 H GLU A 35 -19.053 11.118 1.492 1.00 1.44 H new ATOM 0 HA GLU A 35 -21.554 12.275 2.280 1.00 1.66 H new ATOM 0 HB2 GLU A 35 -20.713 9.983 0.478 1.00 2.22 H new ATOM 0 HB3 GLU A 35 -22.393 10.414 0.729 1.00 2.22 H new ATOM 0 HG2 GLU A 35 -20.279 12.309 -0.348 1.00 3.01 H new ATOM 0 HG3 GLU A 35 -21.381 11.381 -1.346 1.00 3.01 H new ATOM 546 N GLN A 36 -20.755 9.224 3.230 1.00 1.82 N ATOM 547 CA GLN A 36 -21.010 8.208 4.233 1.00 2.41 C ATOM 548 C GLN A 36 -20.063 8.431 5.402 1.00 2.32 C ATOM 549 O GLN A 36 -18.856 8.548 5.196 1.00 2.74 O ATOM 550 CB GLN A 36 -20.817 6.806 3.644 1.00 3.30 C ATOM 551 CG GLN A 36 -21.583 6.574 2.349 1.00 3.71 C ATOM 552 CD GLN A 36 -23.087 6.624 2.533 1.00 4.77 C ATOM 553 OE1 GLN A 36 -23.610 6.254 3.583 1.00 5.34 O ATOM 554 NE2 GLN A 36 -23.794 7.088 1.514 1.00 5.38 N ATOM 0 H GLN A 36 -19.978 9.013 2.603 1.00 1.82 H new ATOM 0 HA GLN A 36 -22.042 8.283 4.576 1.00 2.41 H new ATOM 0 HB2 GLN A 36 -19.755 6.641 3.462 1.00 3.30 H new ATOM 0 HB3 GLN A 36 -21.133 6.066 4.380 1.00 3.30 H new ATOM 0 HG2 GLN A 36 -21.287 7.327 1.618 1.00 3.71 H new ATOM 0 HG3 GLN A 36 -21.305 5.604 1.938 1.00 3.71 H new ATOM 0 HE21 GLN A 36 -23.323 7.385 0.660 1.00 5.38 H new ATOM 0 HE22 GLN A 36 -24.810 7.148 1.584 1.00 5.38 H new ATOM 563 N GLU A 37 -20.616 8.532 6.604 1.00 2.52 N ATOM 564 CA GLU A 37 -19.852 8.947 7.782 1.00 2.96 C ATOM 565 C GLU A 37 -18.569 8.143 7.965 1.00 3.08 C ATOM 566 O GLU A 37 -17.465 8.688 7.862 1.00 3.74 O ATOM 567 CB GLU A 37 -20.721 8.834 9.031 1.00 3.77 C ATOM 568 CG GLU A 37 -22.027 9.599 8.924 1.00 4.29 C ATOM 569 CD GLU A 37 -22.780 9.639 10.231 1.00 5.23 C ATOM 570 OE1 GLU A 37 -23.412 8.625 10.580 1.00 5.79 O ATOM 571 OE2 GLU A 37 -22.748 10.681 10.915 1.00 5.67 O ATOM 0 H GLU A 37 -21.598 8.331 6.793 1.00 2.52 H new ATOM 0 HA GLU A 37 -19.559 9.985 7.625 1.00 2.96 H new ATOM 0 HB2 GLU A 37 -20.938 7.783 9.220 1.00 3.77 H new ATOM 0 HB3 GLU A 37 -20.161 9.204 9.890 1.00 3.77 H new ATOM 0 HG2 GLU A 37 -21.822 10.618 8.595 1.00 4.29 H new ATOM 0 HG3 GLU A 37 -22.654 9.137 8.161 1.00 4.29 H new ATOM 578 N ALA A 38 -18.719 6.856 8.233 1.00 2.92 N ATOM 579 CA ALA A 38 -17.581 5.988 8.486 1.00 3.44 C ATOM 580 C ALA A 38 -17.898 4.551 8.096 1.00 3.42 C ATOM 581 O ALA A 38 -19.036 4.228 7.747 1.00 3.69 O ATOM 582 CB ALA A 38 -17.178 6.066 9.953 1.00 4.24 C ATOM 0 H ALA A 38 -19.624 6.387 8.281 1.00 2.92 H new ATOM 0 HA ALA A 38 -16.746 6.328 7.874 1.00 3.44 H new ATOM 0 HB1 ALA A 38 -16.325 5.412 10.131 1.00 4.24 H new ATOM 0 HB2 ALA A 38 -16.907 7.092 10.202 1.00 4.24 H new ATOM 0 HB3 ALA A 38 -18.014 5.750 10.577 1.00 4.24 H new ATOM 588 N GLY A 39 -16.889 3.696 8.159 1.00 3.60 N ATOM 589 CA GLY A 39 -17.067 2.303 7.816 1.00 3.96 C ATOM 590 C GLY A 39 -16.660 1.390 8.953 1.00 4.53 C ATOM 591 O GLY A 39 -15.546 1.497 9.472 1.00 4.95 O ATOM 0 H GLY A 39 -15.942 3.946 8.444 1.00 3.60 H new ATOM 0 HA2 GLY A 39 -18.111 2.122 7.560 1.00 3.96 H new ATOM 0 HA3 GLY A 39 -16.476 2.068 6.931 1.00 3.96 H new ATOM 595 N GLY A 40 -17.556 0.498 9.345 1.00 4.95 N ATOM 596 CA GLY A 40 -17.283 -0.381 10.461 1.00 5.80 C ATOM 597 C GLY A 40 -17.898 -1.754 10.282 1.00 6.36 C ATOM 598 O GLY A 40 -18.159 -2.181 9.158 1.00 6.66 O ATOM 0 H GLY A 40 -18.469 0.367 8.909 1.00 4.95 H new ATOM 0 HA2 GLY A 40 -16.205 -0.483 10.584 1.00 5.80 H new ATOM 0 HA3 GLY A 40 -17.667 0.069 11.376 1.00 5.80 H new ATOM 602 N ILE A 41 -18.132 -2.439 11.394 1.00 6.77 N ATOM 603 CA ILE A 41 -18.692 -3.786 11.372 1.00 7.49 C ATOM 604 C ILE A 41 -20.219 -3.731 11.437 1.00 7.34 C ATOM 605 O ILE A 41 -20.910 -4.629 10.953 1.00 7.90 O ATOM 606 CB ILE A 41 -18.157 -4.623 12.554 1.00 8.32 C ATOM 607 CG1 ILE A 41 -16.633 -4.482 12.653 1.00 8.45 C ATOM 608 CG2 ILE A 41 -18.539 -6.090 12.389 1.00 9.17 C ATOM 609 CD1 ILE A 41 -16.035 -5.126 13.888 1.00 9.07 C ATOM 0 H ILE A 41 -17.941 -2.081 12.330 1.00 6.77 H new ATOM 0 HA ILE A 41 -18.388 -4.259 10.438 1.00 7.49 H new ATOM 0 HB ILE A 41 -18.608 -4.250 13.474 1.00 8.32 H new ATOM 0 HG12 ILE A 41 -16.179 -4.926 11.767 1.00 8.45 H new ATOM 0 HG13 ILE A 41 -16.375 -3.423 12.646 1.00 8.45 H new ATOM 0 HG21 ILE A 41 -18.153 -6.663 13.232 1.00 9.17 H new ATOM 0 HG22 ILE A 41 -19.625 -6.182 12.355 1.00 9.17 H new ATOM 0 HG23 ILE A 41 -18.113 -6.475 11.463 1.00 9.17 H new ATOM 0 HD11 ILE A 41 -14.954 -4.984 13.886 1.00 9.07 H new ATOM 0 HD12 ILE A 41 -16.460 -4.666 14.780 1.00 9.07 H new ATOM 0 HD13 ILE A 41 -16.260 -6.192 13.888 1.00 9.07 H new ATOM 621 N THR A 42 -20.737 -2.665 12.033 1.00 6.77 N ATOM 622 CA THR A 42 -22.174 -2.473 12.150 1.00 6.78 C ATOM 623 C THR A 42 -22.800 -2.258 10.772 1.00 6.26 C ATOM 624 O THR A 42 -22.144 -1.770 9.852 1.00 6.12 O ATOM 625 CB THR A 42 -22.483 -1.262 13.051 1.00 6.87 C ATOM 626 OG1 THR A 42 -21.585 -1.259 14.166 1.00 7.36 O ATOM 627 CG2 THR A 42 -23.917 -1.310 13.565 1.00 7.24 C ATOM 0 H THR A 42 -20.179 -1.917 12.445 1.00 6.77 H new ATOM 0 HA THR A 42 -22.601 -3.370 12.598 1.00 6.78 H new ATOM 0 HB THR A 42 -22.357 -0.355 12.460 1.00 6.87 H new ATOM 0 HG1 THR A 42 -21.778 -0.488 14.740 1.00 7.36 H new ATOM 0 HG21 THR A 42 -24.106 -0.443 14.198 1.00 7.24 H new ATOM 0 HG22 THR A 42 -24.607 -1.300 12.721 1.00 7.24 H new ATOM 0 HG23 THR A 42 -24.066 -2.221 14.144 1.00 7.24 H new ATOM 635 N GLN A 43 -24.064 -2.636 10.639 1.00 6.30 N ATOM 636 CA GLN A 43 -24.784 -2.498 9.381 1.00 6.20 C ATOM 637 C GLN A 43 -25.076 -1.031 9.064 1.00 5.65 C ATOM 638 O GLN A 43 -24.726 -0.140 9.840 1.00 6.00 O ATOM 639 CB GLN A 43 -26.090 -3.284 9.446 1.00 7.05 C ATOM 640 CG GLN A 43 -25.884 -4.782 9.579 1.00 7.68 C ATOM 641 CD GLN A 43 -27.172 -5.520 9.872 1.00 8.40 C ATOM 642 OE1 GLN A 43 -28.257 -5.087 9.483 1.00 8.83 O ATOM 643 NE2 GLN A 43 -27.064 -6.635 10.571 1.00 8.79 N ATOM 0 H GLN A 43 -24.616 -3.044 11.394 1.00 6.30 H new ATOM 0 HA GLN A 43 -24.155 -2.896 8.585 1.00 6.20 H new ATOM 0 HB2 GLN A 43 -26.678 -2.929 10.292 1.00 7.05 H new ATOM 0 HB3 GLN A 43 -26.672 -3.083 8.547 1.00 7.05 H new ATOM 0 HG2 GLN A 43 -25.449 -5.169 8.658 1.00 7.68 H new ATOM 0 HG3 GLN A 43 -25.167 -4.978 10.377 1.00 7.68 H new ATOM 0 HE21 GLN A 43 -26.146 -6.960 10.874 1.00 8.79 H new ATOM 0 HE22 GLN A 43 -27.899 -7.172 10.807 1.00 8.79 H new ATOM 652 N HIS A 44 -25.723 -0.806 7.917 1.00 5.11 N ATOM 653 CA HIS A 44 -26.095 0.536 7.433 1.00 4.88 C ATOM 654 C HIS A 44 -24.890 1.250 6.827 1.00 4.31 C ATOM 655 O HIS A 44 -25.013 1.959 5.829 1.00 4.61 O ATOM 656 CB HIS A 44 -26.727 1.410 8.531 1.00 5.23 C ATOM 657 CG HIS A 44 -27.892 0.779 9.228 1.00 5.70 C ATOM 658 ND1 HIS A 44 -29.142 0.649 8.658 1.00 6.04 N ATOM 659 CD2 HIS A 44 -27.988 0.238 10.464 1.00 6.21 C ATOM 660 CE1 HIS A 44 -29.952 0.057 9.516 1.00 6.66 C ATOM 661 NE2 HIS A 44 -29.275 -0.203 10.616 1.00 6.76 N ATOM 0 H HIS A 44 -26.009 -1.556 7.288 1.00 5.11 H new ATOM 0 HA HIS A 44 -26.850 0.386 6.662 1.00 4.88 H new ATOM 0 HB2 HIS A 44 -25.964 1.652 9.271 1.00 5.23 H new ATOM 0 HB3 HIS A 44 -27.051 2.352 8.088 1.00 5.23 H new ATOM 0 HD2 HIS A 44 -27.196 0.167 11.195 1.00 6.21 H new ATOM 0 HE1 HIS A 44 -30.993 -0.175 9.345 1.00 6.66 H new ATOM 0 HE2 HIS A 44 -29.650 -0.660 11.448 1.00 6.76 H new ATOM 670 N ILE A 45 -23.728 1.056 7.427 1.00 3.86 N ATOM 671 CA ILE A 45 -22.499 1.647 6.926 1.00 3.48 C ATOM 672 C ILE A 45 -21.452 0.573 6.657 1.00 3.02 C ATOM 673 O ILE A 45 -21.726 -0.619 6.793 1.00 3.28 O ATOM 674 CB ILE A 45 -21.936 2.723 7.891 1.00 3.98 C ATOM 675 CG1 ILE A 45 -22.039 2.285 9.360 1.00 4.52 C ATOM 676 CG2 ILE A 45 -22.658 4.047 7.681 1.00 4.50 C ATOM 677 CD1 ILE A 45 -20.999 1.269 9.783 1.00 5.19 C ATOM 0 H ILE A 45 -23.610 0.490 8.267 1.00 3.86 H new ATOM 0 HA ILE A 45 -22.742 2.144 5.987 1.00 3.48 H new ATOM 0 HB ILE A 45 -20.878 2.851 7.662 1.00 3.98 H new ATOM 0 HG12 ILE A 45 -21.949 3.165 9.996 1.00 4.52 H new ATOM 0 HG13 ILE A 45 -23.030 1.866 9.533 1.00 4.52 H new ATOM 0 HG21 ILE A 45 -22.254 4.794 8.364 1.00 4.50 H new ATOM 0 HG22 ILE A 45 -22.515 4.380 6.653 1.00 4.50 H new ATOM 0 HG23 ILE A 45 -23.722 3.916 7.875 1.00 4.50 H new ATOM 0 HD11 ILE A 45 -21.144 1.015 10.833 1.00 5.19 H new ATOM 0 HD12 ILE A 45 -21.100 0.370 9.175 1.00 5.19 H new ATOM 0 HD13 ILE A 45 -20.003 1.689 9.646 1.00 5.19 H new ATOM 689 N GLY A 46 -20.264 0.998 6.257 1.00 2.83 N ATOM 690 CA GLY A 46 -19.201 0.065 5.939 1.00 2.96 C ATOM 691 C GLY A 46 -18.218 0.669 4.963 1.00 2.37 C ATOM 692 O GLY A 46 -17.013 0.666 5.196 1.00 2.97 O ATOM 0 H GLY A 46 -20.014 1.981 6.146 1.00 2.83 H new ATOM 0 HA2 GLY A 46 -18.680 -0.223 6.853 1.00 2.96 H new ATOM 0 HA3 GLY A 46 -19.627 -0.844 5.515 1.00 2.96 H new ATOM 696 N ALA A 47 -18.743 1.194 3.870 1.00 1.69 N ATOM 697 CA ALA A 47 -17.941 1.923 2.907 1.00 1.33 C ATOM 698 C ALA A 47 -18.424 3.360 2.833 1.00 1.25 C ATOM 699 O ALA A 47 -19.473 3.690 3.390 1.00 1.45 O ATOM 700 CB ALA A 47 -18.013 1.253 1.544 1.00 1.71 C ATOM 0 H ALA A 47 -19.731 1.127 3.627 1.00 1.69 H new ATOM 0 HA ALA A 47 -16.899 1.919 3.226 1.00 1.33 H new ATOM 0 HB1 ALA A 47 -17.406 1.812 0.831 1.00 1.71 H new ATOM 0 HB2 ALA A 47 -17.637 0.233 1.620 1.00 1.71 H new ATOM 0 HB3 ALA A 47 -19.048 1.234 1.202 1.00 1.71 H new ATOM 706 N TYR A 48 -17.691 4.210 2.137 1.00 1.05 N ATOM 707 CA TYR A 48 -18.002 5.627 2.135 1.00 1.04 C ATOM 708 C TYR A 48 -17.629 6.280 0.814 1.00 0.91 C ATOM 709 O TYR A 48 -16.637 5.923 0.184 1.00 0.86 O ATOM 710 CB TYR A 48 -17.300 6.338 3.297 1.00 1.16 C ATOM 711 CG TYR A 48 -15.795 6.277 3.236 1.00 1.12 C ATOM 712 CD1 TYR A 48 -15.134 5.063 3.203 1.00 1.34 C ATOM 713 CD2 TYR A 48 -15.040 7.436 3.202 1.00 1.31 C ATOM 714 CE1 TYR A 48 -13.759 5.005 3.142 1.00 1.77 C ATOM 715 CE2 TYR A 48 -13.663 7.392 3.140 1.00 1.73 C ATOM 716 CZ TYR A 48 -13.023 6.163 3.136 1.00 1.96 C ATOM 717 OH TYR A 48 -11.651 6.117 3.046 1.00 2.54 O ATOM 0 H TYR A 48 -16.884 3.947 1.571 1.00 1.05 H new ATOM 0 HA TYR A 48 -19.080 5.725 2.264 1.00 1.04 H new ATOM 0 HB2 TYR A 48 -17.610 7.383 3.311 1.00 1.16 H new ATOM 0 HB3 TYR A 48 -17.633 5.894 4.235 1.00 1.16 H new ATOM 0 HD1 TYR A 48 -15.704 4.146 3.225 1.00 1.34 H new ATOM 0 HD2 TYR A 48 -15.539 8.394 3.224 1.00 1.31 H new ATOM 0 HE1 TYR A 48 -13.260 4.048 3.099 1.00 1.77 H new ATOM 0 HE2 TYR A 48 -13.089 8.306 3.095 1.00 1.73 H new ATOM 0 HH TYR A 48 -11.369 6.452 2.169 1.00 2.54 H new ATOM 727 N GLN A 49 -18.450 7.225 0.396 1.00 1.01 N ATOM 728 CA GLN A 49 -18.202 7.987 -0.816 1.00 1.00 C ATOM 729 C GLN A 49 -17.714 9.381 -0.455 1.00 1.11 C ATOM 730 O GLN A 49 -18.273 10.028 0.431 1.00 1.34 O ATOM 731 CB GLN A 49 -19.483 8.065 -1.644 1.00 1.16 C ATOM 732 CG GLN A 49 -19.850 6.750 -2.309 1.00 1.18 C ATOM 733 CD GLN A 49 -21.324 6.650 -2.643 1.00 1.42 C ATOM 734 OE1 GLN A 49 -21.771 7.112 -3.692 1.00 1.80 O ATOM 735 NE2 GLN A 49 -22.086 6.020 -1.761 1.00 1.96 N ATOM 0 H GLN A 49 -19.306 7.487 0.885 1.00 1.01 H new ATOM 0 HA GLN A 49 -17.432 7.491 -1.408 1.00 1.00 H new ATOM 0 HB2 GLN A 49 -20.304 8.380 -1.001 1.00 1.16 H new ATOM 0 HB3 GLN A 49 -19.366 8.831 -2.410 1.00 1.16 H new ATOM 0 HG2 GLN A 49 -19.267 6.636 -3.223 1.00 1.18 H new ATOM 0 HG3 GLN A 49 -19.575 5.926 -1.650 1.00 1.18 H new ATOM 0 HE21 GLN A 49 -21.675 5.652 -0.903 1.00 1.96 H new ATOM 0 HE22 GLN A 49 -23.083 5.903 -1.940 1.00 1.96 H new ATOM 744 N VAL A 50 -16.662 9.835 -1.116 1.00 1.04 N ATOM 745 CA VAL A 50 -16.083 11.127 -0.824 1.00 1.18 C ATOM 746 C VAL A 50 -16.307 12.119 -1.954 1.00 1.28 C ATOM 747 O VAL A 50 -16.421 11.743 -3.122 1.00 1.38 O ATOM 748 CB VAL A 50 -14.576 11.009 -0.571 1.00 1.24 C ATOM 749 CG1 VAL A 50 -14.304 10.312 0.749 1.00 1.93 C ATOM 750 CG2 VAL A 50 -13.894 10.288 -1.723 1.00 1.59 C ATOM 0 H VAL A 50 -16.193 9.321 -1.862 1.00 1.04 H new ATOM 0 HA VAL A 50 -16.583 11.493 0.073 1.00 1.18 H new ATOM 0 HB VAL A 50 -14.159 12.014 -0.509 1.00 1.24 H new ATOM 0 HG11 VAL A 50 -13.228 10.240 0.907 1.00 1.93 H new ATOM 0 HG12 VAL A 50 -14.753 10.884 1.561 1.00 1.93 H new ATOM 0 HG13 VAL A 50 -14.736 9.311 0.728 1.00 1.93 H new ATOM 0 HG21 VAL A 50 -12.825 10.214 -1.524 1.00 1.59 H new ATOM 0 HG22 VAL A 50 -14.314 9.287 -1.825 1.00 1.59 H new ATOM 0 HG23 VAL A 50 -14.054 10.845 -2.646 1.00 1.59 H new ATOM 760 N THR A 51 -16.357 13.387 -1.598 1.00 1.42 N ATOM 761 CA THR A 51 -16.454 14.443 -2.579 1.00 1.57 C ATOM 762 C THR A 51 -15.137 15.204 -2.656 1.00 1.83 C ATOM 763 O THR A 51 -14.976 16.278 -2.077 1.00 2.06 O ATOM 764 CB THR A 51 -17.604 15.411 -2.251 1.00 1.67 C ATOM 765 OG1 THR A 51 -18.815 14.668 -2.048 1.00 1.94 O ATOM 766 CG2 THR A 51 -17.807 16.407 -3.384 1.00 1.88 C ATOM 0 H THR A 51 -16.332 13.710 -0.631 1.00 1.42 H new ATOM 0 HA THR A 51 -16.666 13.986 -3.546 1.00 1.57 H new ATOM 0 HB THR A 51 -17.349 15.959 -1.344 1.00 1.67 H new ATOM 0 HG1 THR A 51 -19.546 15.286 -1.837 1.00 1.94 H new ATOM 0 HG21 THR A 51 -18.625 17.083 -3.132 1.00 1.88 H new ATOM 0 HG22 THR A 51 -16.893 16.982 -3.531 1.00 1.88 H new ATOM 0 HG23 THR A 51 -18.049 15.870 -4.301 1.00 1.88 H new ATOM 774 N VAL A 52 -14.200 14.624 -3.382 1.00 2.18 N ATOM 775 CA VAL A 52 -12.922 15.255 -3.658 1.00 2.71 C ATOM 776 C VAL A 52 -12.777 15.385 -5.162 1.00 2.73 C ATOM 777 O VAL A 52 -12.944 14.394 -5.883 1.00 2.83 O ATOM 778 CB VAL A 52 -11.738 14.452 -3.059 1.00 3.49 C ATOM 779 CG1 VAL A 52 -11.797 12.987 -3.476 1.00 4.12 C ATOM 780 CG2 VAL A 52 -10.407 15.066 -3.466 1.00 3.97 C ATOM 0 H VAL A 52 -14.304 13.699 -3.799 1.00 2.18 H new ATOM 0 HA VAL A 52 -12.898 16.238 -3.187 1.00 2.71 H new ATOM 0 HB VAL A 52 -11.823 14.498 -1.973 1.00 3.49 H new ATOM 0 HG11 VAL A 52 -10.954 12.451 -3.040 1.00 4.12 H new ATOM 0 HG12 VAL A 52 -12.729 12.546 -3.124 1.00 4.12 H new ATOM 0 HG13 VAL A 52 -11.750 12.916 -4.563 1.00 4.12 H new ATOM 0 HG21 VAL A 52 -9.591 14.486 -3.034 1.00 3.97 H new ATOM 0 HG22 VAL A 52 -10.321 15.060 -4.553 1.00 3.97 H new ATOM 0 HG23 VAL A 52 -10.354 16.093 -3.103 1.00 3.97 H new ATOM 790 N ASN A 53 -12.567 16.622 -5.640 1.00 2.87 N ATOM 791 CA ASN A 53 -12.530 16.915 -7.086 1.00 2.97 C ATOM 792 C ASN A 53 -13.920 16.767 -7.684 1.00 2.55 C ATOM 793 O ASN A 53 -14.169 17.090 -8.846 1.00 2.91 O ATOM 794 CB ASN A 53 -11.592 15.960 -7.777 1.00 3.48 C ATOM 795 CG ASN A 53 -10.852 16.577 -8.948 1.00 3.97 C ATOM 796 OD1 ASN A 53 -11.332 16.545 -10.081 1.00 4.43 O ATOM 797 ND2 ASN A 53 -9.677 17.120 -8.687 1.00 4.21 N ATOM 0 H ASN A 53 -12.420 17.438 -5.047 1.00 2.87 H new ATOM 0 HA ASN A 53 -12.182 17.938 -7.227 1.00 2.97 H new ATOM 0 HB2 ASN A 53 -10.866 15.590 -7.053 1.00 3.48 H new ATOM 0 HB3 ASN A 53 -12.159 15.098 -8.129 1.00 3.48 H new ATOM 0 HD21 ASN A 53 -9.129 17.535 -9.440 1.00 4.21 H new ATOM 0 HD22 ASN A 53 -9.318 17.124 -7.732 1.00 4.21 H new ATOM 804 N ASP A 54 -14.794 16.254 -6.840 1.00 2.17 N ATOM 805 CA ASP A 54 -16.166 15.890 -7.179 1.00 2.21 C ATOM 806 C ASP A 54 -16.160 14.709 -8.133 1.00 2.44 C ATOM 807 O ASP A 54 -16.988 14.591 -9.034 1.00 3.17 O ATOM 808 CB ASP A 54 -16.957 17.053 -7.750 1.00 2.57 C ATOM 809 CG ASP A 54 -18.442 16.742 -7.851 1.00 3.06 C ATOM 810 OD1 ASP A 54 -18.995 16.150 -6.897 1.00 3.62 O ATOM 811 OD2 ASP A 54 -19.055 17.062 -8.891 1.00 3.37 O ATOM 0 H ASP A 54 -14.565 16.071 -5.863 1.00 2.17 H new ATOM 0 HA ASP A 54 -16.672 15.606 -6.256 1.00 2.21 H new ATOM 0 HB2 ASP A 54 -16.813 17.932 -7.121 1.00 2.57 H new ATOM 0 HB3 ASP A 54 -16.571 17.302 -8.739 1.00 2.57 H new ATOM 816 N LYS A 55 -15.197 13.825 -7.925 1.00 2.26 N ATOM 817 CA LYS A 55 -15.102 12.616 -8.717 1.00 2.71 C ATOM 818 C LYS A 55 -16.022 11.551 -8.133 1.00 2.17 C ATOM 819 O LYS A 55 -16.243 10.499 -8.730 1.00 2.81 O ATOM 820 CB LYS A 55 -13.653 12.122 -8.752 1.00 3.83 C ATOM 821 CG LYS A 55 -13.298 11.371 -10.025 1.00 4.80 C ATOM 822 CD LYS A 55 -13.582 12.221 -11.255 1.00 5.76 C ATOM 823 CE LYS A 55 -12.971 11.628 -12.512 1.00 6.66 C ATOM 824 NZ LYS A 55 -11.486 11.638 -12.456 1.00 7.44 N ATOM 0 H LYS A 55 -14.472 13.925 -7.214 1.00 2.26 H new ATOM 0 HA LYS A 55 -15.414 12.827 -9.740 1.00 2.71 H new ATOM 0 HB2 LYS A 55 -12.984 12.976 -8.645 1.00 3.83 H new ATOM 0 HB3 LYS A 55 -13.479 11.471 -7.895 1.00 3.83 H new ATOM 0 HG2 LYS A 55 -12.244 11.093 -10.006 1.00 4.80 H new ATOM 0 HG3 LYS A 55 -13.871 10.445 -10.078 1.00 4.80 H new ATOM 0 HD2 LYS A 55 -14.660 12.318 -11.387 1.00 5.76 H new ATOM 0 HD3 LYS A 55 -13.188 13.225 -11.100 1.00 5.76 H new ATOM 0 HE2 LYS A 55 -13.324 10.605 -12.641 1.00 6.66 H new ATOM 0 HE3 LYS A 55 -13.307 12.193 -13.382 1.00 6.66 H new ATOM 0 HZ1 LYS A 55 -11.102 11.674 -13.422 1.00 7.44 H new ATOM 0 HZ2 LYS A 55 -11.164 12.472 -11.924 1.00 7.44 H new ATOM 0 HZ3 LYS A 55 -11.151 10.775 -11.983 1.00 7.44 H new ATOM 838 N LYS A 56 -16.549 11.869 -6.943 1.00 1.66 N ATOM 839 CA LYS A 56 -17.527 11.037 -6.240 1.00 1.89 C ATOM 840 C LYS A 56 -16.978 9.636 -5.991 1.00 1.55 C ATOM 841 O LYS A 56 -17.670 8.637 -6.182 1.00 1.86 O ATOM 842 CB LYS A 56 -18.847 10.989 -7.023 1.00 2.73 C ATOM 843 CG LYS A 56 -19.373 12.370 -7.396 1.00 3.49 C ATOM 844 CD LYS A 56 -20.736 12.293 -8.064 1.00 4.29 C ATOM 845 CE LYS A 56 -21.142 13.630 -8.674 1.00 4.99 C ATOM 846 NZ LYS A 56 -21.178 14.728 -7.669 1.00 5.43 N ATOM 0 H LYS A 56 -16.304 12.721 -6.438 1.00 1.66 H new ATOM 0 HA LYS A 56 -17.725 11.486 -5.267 1.00 1.89 H new ATOM 0 HB2 LYS A 56 -18.702 10.405 -7.932 1.00 2.73 H new ATOM 0 HB3 LYS A 56 -19.597 10.470 -6.427 1.00 2.73 H new ATOM 0 HG2 LYS A 56 -19.442 12.987 -6.500 1.00 3.49 H new ATOM 0 HG3 LYS A 56 -18.667 12.859 -8.067 1.00 3.49 H new ATOM 0 HD2 LYS A 56 -20.718 11.529 -8.841 1.00 4.29 H new ATOM 0 HD3 LYS A 56 -21.483 11.985 -7.332 1.00 4.29 H new ATOM 0 HE2 LYS A 56 -20.442 13.891 -9.468 1.00 4.99 H new ATOM 0 HE3 LYS A 56 -22.125 13.532 -9.135 1.00 4.99 H new ATOM 0 HZ1 LYS A 56 -21.694 15.541 -8.062 1.00 5.43 H new ATOM 0 HZ2 LYS A 56 -21.659 14.396 -6.809 1.00 5.43 H new ATOM 0 HZ3 LYS A 56 -20.207 15.015 -7.433 1.00 5.43 H new ATOM 860 N ILE A 57 -15.729 9.588 -5.538 1.00 1.14 N ATOM 861 CA ILE A 57 -15.029 8.329 -5.325 1.00 0.88 C ATOM 862 C ILE A 57 -15.720 7.482 -4.264 1.00 0.85 C ATOM 863 O ILE A 57 -15.867 7.899 -3.112 1.00 0.97 O ATOM 864 CB ILE A 57 -13.561 8.558 -4.898 1.00 0.80 C ATOM 865 CG1 ILE A 57 -12.819 9.401 -5.941 1.00 0.86 C ATOM 866 CG2 ILE A 57 -12.858 7.221 -4.692 1.00 0.87 C ATOM 867 CD1 ILE A 57 -11.405 9.772 -5.538 1.00 0.86 C ATOM 0 H ILE A 57 -15.178 10.416 -5.310 1.00 1.14 H new ATOM 0 HA ILE A 57 -15.047 7.802 -6.279 1.00 0.88 H new ATOM 0 HB ILE A 57 -13.556 9.104 -3.954 1.00 0.80 H new ATOM 0 HG12 ILE A 57 -12.786 8.851 -6.881 1.00 0.86 H new ATOM 0 HG13 ILE A 57 -13.385 10.314 -6.125 1.00 0.86 H new ATOM 0 HG21 ILE A 57 -11.825 7.396 -4.392 1.00 0.87 H new ATOM 0 HG22 ILE A 57 -13.372 6.656 -3.914 1.00 0.87 H new ATOM 0 HG23 ILE A 57 -12.874 6.654 -5.623 1.00 0.87 H new ATOM 0 HD11 ILE A 57 -10.946 10.368 -6.327 1.00 0.86 H new ATOM 0 HD12 ILE A 57 -11.430 10.350 -4.614 1.00 0.86 H new ATOM 0 HD13 ILE A 57 -10.821 8.865 -5.382 1.00 0.86 H new ATOM 879 N THR A 58 -16.154 6.302 -4.668 1.00 0.80 N ATOM 880 CA THR A 58 -16.735 5.347 -3.746 1.00 0.80 C ATOM 881 C THR A 58 -15.640 4.483 -3.132 1.00 0.73 C ATOM 882 O THR A 58 -15.090 3.606 -3.795 1.00 0.85 O ATOM 883 CB THR A 58 -17.761 4.447 -4.463 1.00 0.88 C ATOM 884 OG1 THR A 58 -18.699 5.263 -5.177 1.00 1.11 O ATOM 885 CG2 THR A 58 -18.505 3.563 -3.469 1.00 1.28 C ATOM 0 H THR A 58 -16.114 5.982 -5.636 1.00 0.80 H new ATOM 0 HA THR A 58 -17.247 5.901 -2.959 1.00 0.80 H new ATOM 0 HB THR A 58 -17.225 3.803 -5.159 1.00 0.88 H new ATOM 0 HG1 THR A 58 -19.350 4.690 -5.634 1.00 1.11 H new ATOM 0 HG21 THR A 58 -19.222 2.939 -4.003 1.00 1.28 H new ATOM 0 HG22 THR A 58 -17.792 2.928 -2.943 1.00 1.28 H new ATOM 0 HG23 THR A 58 -19.033 4.189 -2.750 1.00 1.28 H new ATOM 893 N PHE A 59 -15.315 4.736 -1.873 1.00 0.65 N ATOM 894 CA PHE A 59 -14.277 3.977 -1.197 1.00 0.64 C ATOM 895 C PHE A 59 -14.866 2.748 -0.537 1.00 0.73 C ATOM 896 O PHE A 59 -15.586 2.850 0.457 1.00 0.83 O ATOM 897 CB PHE A 59 -13.562 4.823 -0.148 1.00 0.64 C ATOM 898 CG PHE A 59 -12.513 5.738 -0.701 1.00 0.60 C ATOM 899 CD1 PHE A 59 -11.322 5.236 -1.191 1.00 0.75 C ATOM 900 CD2 PHE A 59 -12.727 7.105 -0.743 1.00 0.80 C ATOM 901 CE1 PHE A 59 -10.362 6.080 -1.711 1.00 0.79 C ATOM 902 CE2 PHE A 59 -11.769 7.954 -1.260 1.00 0.84 C ATOM 903 CZ PHE A 59 -10.551 7.424 -1.705 1.00 0.70 C ATOM 0 H PHE A 59 -15.754 5.458 -1.302 1.00 0.65 H new ATOM 0 HA PHE A 59 -13.550 3.673 -1.950 1.00 0.64 H new ATOM 0 HB2 PHE A 59 -14.302 5.419 0.386 1.00 0.64 H new ATOM 0 HB3 PHE A 59 -13.099 4.159 0.583 1.00 0.64 H new ATOM 0 HD1 PHE A 59 -11.141 4.172 -1.167 1.00 0.75 H new ATOM 0 HD2 PHE A 59 -13.654 7.512 -0.367 1.00 0.80 H new ATOM 0 HE1 PHE A 59 -9.454 5.668 -2.126 1.00 0.79 H new ATOM 0 HE2 PHE A 59 -11.957 9.016 -1.321 1.00 0.84 H new ATOM 0 HZ PHE A 59 -9.765 8.083 -2.042 1.00 0.70 H new ATOM 913 N LEU A 60 -14.560 1.592 -1.092 1.00 0.85 N ATOM 914 CA LEU A 60 -15.047 0.339 -0.556 1.00 1.00 C ATOM 915 C LEU A 60 -14.056 -0.197 0.470 1.00 1.96 C ATOM 916 O LEU A 60 -13.195 -1.015 0.156 1.00 2.78 O ATOM 917 CB LEU A 60 -15.267 -0.667 -1.690 1.00 1.51 C ATOM 918 CG LEU A 60 -15.903 -1.998 -1.284 1.00 2.10 C ATOM 919 CD1 LEU A 60 -17.234 -1.769 -0.585 1.00 2.68 C ATOM 920 CD2 LEU A 60 -16.088 -2.888 -2.503 1.00 3.00 C ATOM 0 H LEU A 60 -13.972 1.496 -1.920 1.00 0.85 H new ATOM 0 HA LEU A 60 -16.004 0.501 -0.060 1.00 1.00 H new ATOM 0 HB2 LEU A 60 -15.897 -0.201 -2.447 1.00 1.51 H new ATOM 0 HB3 LEU A 60 -14.305 -0.873 -2.159 1.00 1.51 H new ATOM 0 HG LEU A 60 -15.234 -2.499 -0.585 1.00 2.10 H new ATOM 0 HD11 LEU A 60 -17.668 -2.729 -0.305 1.00 2.68 H new ATOM 0 HD12 LEU A 60 -17.076 -1.168 0.310 1.00 2.68 H new ATOM 0 HD13 LEU A 60 -17.913 -1.246 -1.258 1.00 2.68 H new ATOM 0 HD21 LEU A 60 -16.541 -3.832 -2.199 1.00 3.00 H new ATOM 0 HD22 LEU A 60 -16.737 -2.389 -3.223 1.00 3.00 H new ATOM 0 HD23 LEU A 60 -15.119 -3.082 -2.962 1.00 3.00 H new ATOM 932 N ASP A 61 -14.153 0.317 1.688 1.00 2.55 N ATOM 933 CA ASP A 61 -13.312 -0.142 2.785 1.00 3.74 C ATOM 934 C ASP A 61 -13.828 -1.477 3.300 1.00 3.82 C ATOM 935 O ASP A 61 -15.037 -1.695 3.352 1.00 3.97 O ATOM 936 CB ASP A 61 -13.286 0.896 3.912 1.00 4.77 C ATOM 937 CG ASP A 61 -12.487 0.433 5.118 1.00 5.89 C ATOM 938 OD1 ASP A 61 -11.407 -0.164 4.935 1.00 6.48 O ATOM 939 OD2 ASP A 61 -12.930 0.664 6.261 1.00 6.37 O ATOM 0 H ASP A 61 -14.809 1.056 1.942 1.00 2.55 H new ATOM 0 HA ASP A 61 -12.293 -0.272 2.421 1.00 3.74 H new ATOM 0 HB2 ASP A 61 -12.860 1.826 3.534 1.00 4.77 H new ATOM 0 HB3 ASP A 61 -14.308 1.116 4.221 1.00 4.77 H new ATOM 944 N THR A 62 -12.908 -2.364 3.660 1.00 4.12 N ATOM 945 CA THR A 62 -13.260 -3.707 4.112 1.00 4.33 C ATOM 946 C THR A 62 -14.058 -3.660 5.417 1.00 4.42 C ATOM 947 O THR A 62 -13.508 -3.343 6.476 1.00 4.82 O ATOM 948 CB THR A 62 -11.993 -4.558 4.318 1.00 5.07 C ATOM 949 OG1 THR A 62 -11.154 -4.471 3.157 1.00 5.52 O ATOM 950 CG2 THR A 62 -12.345 -6.015 4.580 1.00 5.57 C ATOM 0 H THR A 62 -11.905 -2.176 3.648 1.00 4.12 H new ATOM 0 HA THR A 62 -13.879 -4.162 3.339 1.00 4.33 H new ATOM 0 HB THR A 62 -11.463 -4.169 5.188 1.00 5.07 H new ATOM 0 HG1 THR A 62 -10.349 -5.013 3.294 1.00 5.52 H new ATOM 0 HG21 THR A 62 -11.430 -6.591 4.721 1.00 5.57 H new ATOM 0 HG22 THR A 62 -12.960 -6.085 5.477 1.00 5.57 H new ATOM 0 HG23 THR A 62 -12.897 -6.415 3.729 1.00 5.57 H new ATOM 958 N PRO A 63 -15.365 -3.976 5.354 1.00 4.51 N ATOM 959 CA PRO A 63 -16.261 -3.903 6.497 1.00 5.03 C ATOM 960 C PRO A 63 -16.439 -5.245 7.211 1.00 5.20 C ATOM 961 O PRO A 63 -17.205 -5.350 8.169 1.00 5.77 O ATOM 962 CB PRO A 63 -17.568 -3.470 5.836 1.00 5.50 C ATOM 963 CG PRO A 63 -17.531 -4.063 4.457 1.00 5.27 C ATOM 964 CD PRO A 63 -16.089 -4.404 4.146 1.00 4.66 C ATOM 0 HA PRO A 63 -15.892 -3.236 7.276 1.00 5.03 H new ATOM 0 HB2 PRO A 63 -18.430 -3.831 6.396 1.00 5.50 H new ATOM 0 HB3 PRO A 63 -17.647 -2.384 5.795 1.00 5.50 H new ATOM 0 HG2 PRO A 63 -18.155 -4.955 4.407 1.00 5.27 H new ATOM 0 HG3 PRO A 63 -17.924 -3.357 3.726 1.00 5.27 H new ATOM 0 HD2 PRO A 63 -15.960 -5.470 3.958 1.00 4.66 H new ATOM 0 HD3 PRO A 63 -15.735 -3.879 3.259 1.00 4.66 H new ATOM 972 N GLY A 64 -15.735 -6.266 6.740 1.00 5.00 N ATOM 973 CA GLY A 64 -15.852 -7.581 7.339 1.00 5.40 C ATOM 974 C GLY A 64 -15.083 -8.638 6.576 1.00 5.25 C ATOM 975 O GLY A 64 -13.863 -8.744 6.710 1.00 5.54 O ATOM 0 H GLY A 64 -15.086 -6.207 5.955 1.00 5.00 H new ATOM 0 HA2 GLY A 64 -15.488 -7.542 8.366 1.00 5.40 H new ATOM 0 HA3 GLY A 64 -16.904 -7.864 7.384 1.00 5.40 H new ATOM 979 N HIS A 65 -15.793 -9.420 5.775 1.00 5.14 N ATOM 980 CA HIS A 65 -15.176 -10.497 5.004 1.00 5.24 C ATOM 981 C HIS A 65 -15.221 -10.191 3.513 1.00 4.67 C ATOM 982 O HIS A 65 -14.300 -10.533 2.769 1.00 4.91 O ATOM 983 CB HIS A 65 -15.866 -11.834 5.288 1.00 5.90 C ATOM 984 CG HIS A 65 -15.583 -12.385 6.653 1.00 6.66 C ATOM 985 ND1 HIS A 65 -16.526 -12.453 7.654 1.00 7.35 N ATOM 986 CD2 HIS A 65 -14.447 -12.903 7.178 1.00 7.14 C ATOM 987 CE1 HIS A 65 -15.984 -12.985 8.734 1.00 8.09 C ATOM 988 NE2 HIS A 65 -14.724 -13.269 8.470 1.00 7.99 N ATOM 0 H HIS A 65 -16.800 -9.330 5.640 1.00 5.14 H new ATOM 0 HA HIS A 65 -14.133 -10.572 5.311 1.00 5.24 H new ATOM 0 HB2 HIS A 65 -16.943 -11.708 5.174 1.00 5.90 H new ATOM 0 HB3 HIS A 65 -15.549 -12.561 4.540 1.00 5.90 H new ATOM 0 HD2 HIS A 65 -13.498 -13.008 6.672 1.00 7.14 H new ATOM 0 HE1 HIS A 65 -16.487 -13.158 9.674 1.00 8.09 H new ATOM 0 HE2 HIS A 65 -14.063 -13.692 9.121 1.00 7.99 H new ATOM 997 N GLU A 66 -16.301 -9.560 3.078 1.00 4.31 N ATOM 998 CA GLU A 66 -16.423 -9.139 1.690 1.00 4.06 C ATOM 999 C GLU A 66 -15.705 -7.808 1.503 1.00 3.33 C ATOM 1000 O GLU A 66 -16.166 -6.772 1.982 1.00 3.69 O ATOM 1001 CB GLU A 66 -17.895 -9.022 1.281 1.00 4.70 C ATOM 1002 CG GLU A 66 -18.090 -8.700 -0.194 1.00 5.39 C ATOM 1003 CD GLU A 66 -19.551 -8.648 -0.597 1.00 5.92 C ATOM 1004 OE1 GLU A 66 -20.185 -7.583 -0.430 1.00 6.36 O ATOM 1005 OE2 GLU A 66 -20.078 -9.670 -1.089 1.00 6.21 O ATOM 0 H GLU A 66 -17.103 -9.329 3.664 1.00 4.31 H new ATOM 0 HA GLU A 66 -15.962 -9.890 1.049 1.00 4.06 H new ATOM 0 HB2 GLU A 66 -18.404 -9.958 1.511 1.00 4.70 H new ATOM 0 HB3 GLU A 66 -18.370 -8.246 1.880 1.00 4.70 H new ATOM 0 HG2 GLU A 66 -17.622 -7.741 -0.417 1.00 5.39 H new ATOM 0 HG3 GLU A 66 -17.579 -9.451 -0.796 1.00 5.39 H new ATOM 1012 N ALA A 67 -14.566 -7.852 0.833 1.00 2.88 N ATOM 1013 CA ALA A 67 -13.746 -6.666 0.645 1.00 2.74 C ATOM 1014 C ALA A 67 -13.847 -6.161 -0.787 1.00 2.07 C ATOM 1015 O ALA A 67 -14.332 -5.063 -1.035 1.00 2.63 O ATOM 1016 CB ALA A 67 -12.300 -6.970 1.003 1.00 3.51 C ATOM 0 H ALA A 67 -14.187 -8.699 0.409 1.00 2.88 H new ATOM 0 HA ALA A 67 -14.114 -5.881 1.306 1.00 2.74 H new ATOM 0 HB1 ALA A 67 -11.694 -6.076 0.859 1.00 3.51 H new ATOM 0 HB2 ALA A 67 -12.241 -7.284 2.045 1.00 3.51 H new ATOM 0 HB3 ALA A 67 -11.927 -7.769 0.362 1.00 3.51 H new ATOM 1022 N PHE A 68 -13.399 -6.983 -1.726 1.00 1.52 N ATOM 1023 CA PHE A 68 -13.400 -6.610 -3.132 1.00 1.22 C ATOM 1024 C PHE A 68 -14.614 -7.217 -3.828 1.00 1.89 C ATOM 1025 O PHE A 68 -15.228 -8.149 -3.304 1.00 2.61 O ATOM 1026 CB PHE A 68 -12.104 -7.087 -3.803 1.00 1.13 C ATOM 1027 CG PHE A 68 -11.932 -6.612 -5.220 1.00 0.93 C ATOM 1028 CD1 PHE A 68 -11.828 -5.261 -5.508 1.00 1.43 C ATOM 1029 CD2 PHE A 68 -11.870 -7.520 -6.263 1.00 0.87 C ATOM 1030 CE1 PHE A 68 -11.667 -4.825 -6.806 1.00 1.62 C ATOM 1031 CE2 PHE A 68 -11.709 -7.091 -7.564 1.00 1.14 C ATOM 1032 CZ PHE A 68 -11.619 -5.733 -7.835 1.00 1.40 C ATOM 0 H PHE A 68 -13.029 -7.915 -1.538 1.00 1.52 H new ATOM 0 HA PHE A 68 -13.455 -5.525 -3.214 1.00 1.22 H new ATOM 0 HB2 PHE A 68 -11.255 -6.745 -3.211 1.00 1.13 H new ATOM 0 HB3 PHE A 68 -12.082 -8.177 -3.792 1.00 1.13 H new ATOM 0 HD1 PHE A 68 -11.874 -4.540 -4.705 1.00 1.43 H new ATOM 0 HD2 PHE A 68 -11.949 -8.577 -6.056 1.00 0.87 H new ATOM 0 HE1 PHE A 68 -11.579 -3.769 -7.014 1.00 1.62 H new ATOM 0 HE2 PHE A 68 -11.653 -7.809 -8.369 1.00 1.14 H new ATOM 0 HZ PHE A 68 -11.511 -5.391 -8.854 1.00 1.40 H new ATOM 1042 N THR A 69 -14.955 -6.681 -4.999 1.00 2.35 N ATOM 1043 CA THR A 69 -16.045 -7.207 -5.810 1.00 3.23 C ATOM 1044 C THR A 69 -15.896 -8.721 -6.018 1.00 3.47 C ATOM 1045 O THR A 69 -14.780 -9.245 -6.108 1.00 3.95 O ATOM 1046 CB THR A 69 -16.083 -6.508 -7.189 1.00 4.06 C ATOM 1047 OG1 THR A 69 -15.975 -5.089 -7.024 1.00 4.44 O ATOM 1048 CG2 THR A 69 -17.375 -6.826 -7.931 1.00 4.74 C ATOM 0 H THR A 69 -14.484 -5.874 -5.408 1.00 2.35 H new ATOM 0 HA THR A 69 -16.975 -7.011 -5.277 1.00 3.23 H new ATOM 0 HB THR A 69 -15.241 -6.879 -7.774 1.00 4.06 H new ATOM 0 HG1 THR A 69 -15.808 -4.670 -7.894 1.00 4.44 H new ATOM 0 HG21 THR A 69 -17.374 -6.321 -8.897 1.00 4.74 H new ATOM 0 HG22 THR A 69 -17.451 -7.902 -8.084 1.00 4.74 H new ATOM 0 HG23 THR A 69 -18.226 -6.482 -7.343 1.00 4.74 H new ATOM 1056 N THR A 70 -17.019 -9.420 -6.083 1.00 3.68 N ATOM 1057 CA THR A 70 -17.011 -10.855 -6.302 1.00 4.33 C ATOM 1058 C THR A 70 -17.069 -11.162 -7.804 1.00 4.42 C ATOM 1059 O THR A 70 -17.494 -12.241 -8.223 1.00 5.01 O ATOM 1060 CB THR A 70 -18.190 -11.522 -5.563 1.00 5.25 C ATOM 1061 OG1 THR A 70 -18.337 -10.932 -4.263 1.00 5.60 O ATOM 1062 CG2 THR A 70 -17.966 -13.020 -5.401 1.00 5.89 C ATOM 0 H THR A 70 -17.949 -9.013 -5.987 1.00 3.68 H new ATOM 0 HA THR A 70 -16.084 -11.264 -5.901 1.00 4.33 H new ATOM 0 HB THR A 70 -19.091 -11.366 -6.157 1.00 5.25 H new ATOM 0 HG1 THR A 70 -19.087 -11.355 -3.795 1.00 5.60 H new ATOM 0 HG21 THR A 70 -18.814 -13.460 -4.877 1.00 5.89 H new ATOM 0 HG22 THR A 70 -17.868 -13.482 -6.384 1.00 5.89 H new ATOM 0 HG23 THR A 70 -17.056 -13.192 -4.827 1.00 5.89 H new ATOM 1070 N MET A 71 -16.616 -10.189 -8.600 1.00 4.24 N ATOM 1071 CA MET A 71 -16.594 -10.284 -10.061 1.00 4.73 C ATOM 1072 C MET A 71 -17.996 -10.460 -10.638 1.00 5.29 C ATOM 1073 O MET A 71 -18.503 -11.576 -10.769 1.00 5.64 O ATOM 1074 CB MET A 71 -15.664 -11.409 -10.537 1.00 4.83 C ATOM 1075 CG MET A 71 -14.201 -10.988 -10.657 1.00 4.67 C ATOM 1076 SD MET A 71 -13.466 -10.491 -9.086 1.00 4.68 S ATOM 1077 CE MET A 71 -13.421 -12.057 -8.219 1.00 4.52 C ATOM 0 H MET A 71 -16.251 -9.305 -8.244 1.00 4.24 H new ATOM 0 HA MET A 71 -16.199 -9.339 -10.435 1.00 4.73 H new ATOM 0 HB2 MET A 71 -15.736 -12.246 -9.842 1.00 4.83 H new ATOM 0 HB3 MET A 71 -16.010 -11.768 -11.506 1.00 4.83 H new ATOM 0 HG2 MET A 71 -13.626 -11.815 -11.073 1.00 4.67 H new ATOM 0 HG3 MET A 71 -14.126 -10.161 -11.363 1.00 4.67 H new ATOM 0 HE1 MET A 71 -12.670 -12.015 -7.430 1.00 4.52 H new ATOM 0 HE2 MET A 71 -14.398 -12.258 -7.780 1.00 4.52 H new ATOM 0 HE3 MET A 71 -13.167 -12.853 -8.919 1.00 4.52 H new ATOM 1087 N ARG A 72 -18.616 -9.340 -10.982 1.00 5.68 N ATOM 1088 CA ARG A 72 -19.941 -9.346 -11.578 1.00 6.44 C ATOM 1089 C ARG A 72 -19.830 -9.385 -13.098 1.00 6.64 C ATOM 1090 O ARG A 72 -20.658 -9.995 -13.775 1.00 7.15 O ATOM 1091 CB ARG A 72 -20.732 -8.110 -11.130 1.00 7.03 C ATOM 1092 CG ARG A 72 -22.116 -7.999 -11.755 1.00 7.56 C ATOM 1093 CD ARG A 72 -22.995 -9.187 -11.392 1.00 8.19 C ATOM 1094 NE ARG A 72 -23.327 -9.220 -9.968 1.00 8.54 N ATOM 1095 CZ ARG A 72 -23.367 -10.331 -9.237 1.00 9.20 C ATOM 1096 NH1 ARG A 72 -23.018 -11.496 -9.768 1.00 9.56 N ATOM 1097 NH2 ARG A 72 -23.751 -10.272 -7.970 1.00 9.71 N ATOM 0 H ARG A 72 -18.217 -8.410 -10.857 1.00 5.68 H new ATOM 0 HA ARG A 72 -20.474 -10.236 -11.243 1.00 6.44 H new ATOM 0 HB2 ARG A 72 -20.835 -8.131 -10.045 1.00 7.03 H new ATOM 0 HB3 ARG A 72 -20.160 -7.216 -11.378 1.00 7.03 H new ATOM 0 HG2 ARG A 72 -22.593 -7.078 -11.421 1.00 7.56 H new ATOM 0 HG3 ARG A 72 -22.022 -7.934 -12.839 1.00 7.56 H new ATOM 0 HD2 ARG A 72 -23.915 -9.147 -11.976 1.00 8.19 H new ATOM 0 HD3 ARG A 72 -22.484 -10.110 -11.665 1.00 8.19 H new ATOM 0 HE ARG A 72 -23.541 -8.336 -9.506 1.00 8.54 H new ATOM 0 HH11 ARG A 72 -22.717 -11.543 -10.741 1.00 9.56 H new ATOM 0 HH12 ARG A 72 -23.051 -12.344 -9.203 1.00 9.56 H new ATOM 0 HH21 ARG A 72 -24.015 -9.377 -7.558 1.00 9.71 H new ATOM 0 HH22 ARG A 72 -23.783 -11.122 -7.407 1.00 9.71 H new ATOM 1111 N ALA A 73 -18.797 -8.741 -13.624 1.00 6.52 N ATOM 1112 CA ALA A 73 -18.580 -8.700 -15.062 1.00 6.92 C ATOM 1113 C ALA A 73 -17.923 -9.985 -15.545 1.00 6.65 C ATOM 1114 O ALA A 73 -16.820 -10.318 -15.108 1.00 6.71 O ATOM 1115 CB ALA A 73 -17.734 -7.495 -15.445 1.00 7.52 C ATOM 0 H ALA A 73 -18.097 -8.240 -13.076 1.00 6.52 H new ATOM 0 HA ALA A 73 -19.551 -8.607 -15.548 1.00 6.92 H new ATOM 0 HB1 ALA A 73 -17.584 -7.484 -16.525 1.00 7.52 H new ATOM 0 HB2 ALA A 73 -18.244 -6.581 -15.140 1.00 7.52 H new ATOM 0 HB3 ALA A 73 -16.767 -7.555 -14.945 1.00 7.52 H new ATOM 1121 N ARG A 74 -18.608 -10.690 -16.442 1.00 6.69 N ATOM 1122 CA ARG A 74 -18.214 -12.038 -16.861 1.00 6.76 C ATOM 1123 C ARG A 74 -16.731 -12.137 -17.196 1.00 6.62 C ATOM 1124 O ARG A 74 -15.999 -12.921 -16.584 1.00 6.89 O ATOM 1125 CB ARG A 74 -19.033 -12.474 -18.074 1.00 7.36 C ATOM 1126 CG ARG A 74 -20.523 -12.589 -17.803 1.00 7.67 C ATOM 1127 CD ARG A 74 -20.830 -13.703 -16.820 1.00 8.48 C ATOM 1128 NE ARG A 74 -22.266 -13.843 -16.601 1.00 8.99 N ATOM 1129 CZ ARG A 74 -22.873 -14.984 -16.294 1.00 9.80 C ATOM 1130 NH1 ARG A 74 -22.173 -16.102 -16.144 1.00 10.19 N ATOM 1131 NH2 ARG A 74 -24.190 -15.007 -16.140 1.00 10.42 N ATOM 0 H ARG A 74 -19.452 -10.346 -16.900 1.00 6.69 H new ATOM 0 HA ARG A 74 -18.409 -12.698 -16.016 1.00 6.76 H new ATOM 0 HB2 ARG A 74 -18.875 -11.760 -18.882 1.00 7.36 H new ATOM 0 HB3 ARG A 74 -18.662 -13.438 -18.423 1.00 7.36 H new ATOM 0 HG2 ARG A 74 -20.895 -11.643 -17.409 1.00 7.67 H new ATOM 0 HG3 ARG A 74 -21.050 -12.774 -18.739 1.00 7.67 H new ATOM 0 HD2 ARG A 74 -20.425 -14.643 -17.195 1.00 8.48 H new ATOM 0 HD3 ARG A 74 -20.334 -13.499 -15.871 1.00 8.48 H new ATOM 0 HE ARG A 74 -22.844 -13.007 -16.690 1.00 8.99 H new ATOM 0 HH11 ARG A 74 -21.160 -16.090 -16.265 1.00 10.19 H new ATOM 0 HH12 ARG A 74 -22.648 -16.973 -15.908 1.00 10.19 H new ATOM 0 HH21 ARG A 74 -24.732 -14.151 -16.257 1.00 10.42 H new ATOM 0 HH22 ARG A 74 -24.661 -15.881 -15.904 1.00 10.42 H new ATOM 1145 N GLY A 75 -16.287 -11.328 -18.145 1.00 6.47 N ATOM 1146 CA GLY A 75 -14.915 -11.414 -18.610 1.00 6.51 C ATOM 1147 C GLY A 75 -14.032 -10.339 -18.016 1.00 6.34 C ATOM 1148 O GLY A 75 -13.062 -9.916 -18.649 1.00 6.75 O ATOM 0 H GLY A 75 -16.851 -10.612 -18.603 1.00 6.47 H new ATOM 0 HA2 GLY A 75 -14.510 -12.393 -18.356 1.00 6.51 H new ATOM 0 HA3 GLY A 75 -14.898 -11.334 -19.697 1.00 6.51 H new ATOM 1152 N ALA A 76 -14.369 -9.902 -16.803 1.00 6.08 N ATOM 1153 CA ALA A 76 -13.597 -8.880 -16.098 1.00 6.24 C ATOM 1154 C ALA A 76 -13.484 -7.606 -16.933 1.00 5.83 C ATOM 1155 O ALA A 76 -12.401 -7.232 -17.386 1.00 6.16 O ATOM 1156 CB ALA A 76 -12.218 -9.419 -15.730 1.00 6.69 C ATOM 0 H ALA A 76 -15.179 -10.243 -16.285 1.00 6.08 H new ATOM 0 HA ALA A 76 -14.123 -8.625 -15.178 1.00 6.24 H new ATOM 0 HB1 ALA A 76 -11.654 -8.648 -15.206 1.00 6.69 H new ATOM 0 HB2 ALA A 76 -12.328 -10.290 -15.084 1.00 6.69 H new ATOM 0 HB3 ALA A 76 -11.685 -9.705 -16.637 1.00 6.69 H new ATOM 1162 N GLN A 77 -14.619 -6.952 -17.139 1.00 5.40 N ATOM 1163 CA GLN A 77 -14.679 -5.757 -17.972 1.00 5.18 C ATOM 1164 C GLN A 77 -14.720 -4.493 -17.109 1.00 4.21 C ATOM 1165 O GLN A 77 -14.634 -3.374 -17.617 1.00 4.21 O ATOM 1166 CB GLN A 77 -15.920 -5.831 -18.871 1.00 5.87 C ATOM 1167 CG GLN A 77 -16.022 -4.704 -19.889 1.00 6.56 C ATOM 1168 CD GLN A 77 -17.262 -4.808 -20.753 1.00 7.26 C ATOM 1169 OE1 GLN A 77 -18.317 -4.263 -20.422 1.00 7.65 O ATOM 1170 NE2 GLN A 77 -17.147 -5.514 -21.864 1.00 7.72 N ATOM 0 H GLN A 77 -15.515 -7.230 -16.739 1.00 5.40 H new ATOM 0 HA GLN A 77 -13.783 -5.709 -18.591 1.00 5.18 H new ATOM 0 HB2 GLN A 77 -15.915 -6.784 -19.400 1.00 5.87 H new ATOM 0 HB3 GLN A 77 -16.811 -5.820 -18.243 1.00 5.87 H new ATOM 0 HG2 GLN A 77 -16.027 -3.747 -19.367 1.00 6.56 H new ATOM 0 HG3 GLN A 77 -15.138 -4.714 -20.526 1.00 6.56 H new ATOM 0 HE21 GLN A 77 -16.256 -5.949 -22.102 1.00 7.72 H new ATOM 0 HE22 GLN A 77 -17.950 -5.624 -22.484 1.00 7.72 H new ATOM 1179 N VAL A 78 -14.834 -4.678 -15.804 1.00 3.82 N ATOM 1180 CA VAL A 78 -14.987 -3.553 -14.893 1.00 3.25 C ATOM 1181 C VAL A 78 -13.718 -3.321 -14.083 1.00 3.06 C ATOM 1182 O VAL A 78 -13.308 -4.171 -13.293 1.00 3.67 O ATOM 1183 CB VAL A 78 -16.173 -3.762 -13.927 1.00 3.79 C ATOM 1184 CG1 VAL A 78 -16.293 -2.597 -12.955 1.00 4.27 C ATOM 1185 CG2 VAL A 78 -17.472 -3.949 -14.700 1.00 4.38 C ATOM 0 H VAL A 78 -14.824 -5.592 -15.352 1.00 3.82 H new ATOM 0 HA VAL A 78 -15.184 -2.676 -15.510 1.00 3.25 H new ATOM 0 HB VAL A 78 -15.983 -4.668 -13.351 1.00 3.79 H new ATOM 0 HG11 VAL A 78 -17.136 -2.768 -12.285 1.00 4.27 H new ATOM 0 HG12 VAL A 78 -15.376 -2.514 -12.371 1.00 4.27 H new ATOM 0 HG13 VAL A 78 -16.453 -1.674 -13.512 1.00 4.27 H new ATOM 0 HG21 VAL A 78 -18.294 -4.095 -14.000 1.00 4.38 H new ATOM 0 HG22 VAL A 78 -17.665 -3.064 -15.307 1.00 4.38 H new ATOM 0 HG23 VAL A 78 -17.388 -4.822 -15.347 1.00 4.38 H new ATOM 1195 N THR A 79 -13.097 -2.172 -14.299 1.00 2.63 N ATOM 1196 CA THR A 79 -11.947 -1.769 -13.513 1.00 2.70 C ATOM 1197 C THR A 79 -12.385 -1.255 -12.140 1.00 1.92 C ATOM 1198 O THR A 79 -12.681 -0.070 -11.972 1.00 2.39 O ATOM 1199 CB THR A 79 -11.128 -0.666 -14.225 1.00 3.62 C ATOM 1200 OG1 THR A 79 -10.642 -1.139 -15.492 1.00 4.18 O ATOM 1201 CG2 THR A 79 -9.954 -0.221 -13.363 1.00 4.13 C ATOM 0 H THR A 79 -13.373 -1.501 -15.016 1.00 2.63 H new ATOM 0 HA THR A 79 -11.318 -2.651 -13.393 1.00 2.70 H new ATOM 0 HB THR A 79 -11.787 0.186 -14.389 1.00 3.62 H new ATOM 0 HG1 THR A 79 -9.782 -0.714 -15.692 1.00 4.18 H new ATOM 0 HG21 THR A 79 -9.393 0.555 -13.884 1.00 4.13 H new ATOM 0 HG22 THR A 79 -10.326 0.174 -12.417 1.00 4.13 H new ATOM 0 HG23 THR A 79 -9.301 -1.072 -13.169 1.00 4.13 H new ATOM 1209 N ASP A 80 -12.460 -2.153 -11.172 1.00 1.32 N ATOM 1210 CA ASP A 80 -12.722 -1.755 -9.798 1.00 1.15 C ATOM 1211 C ASP A 80 -11.412 -1.381 -9.126 1.00 0.93 C ATOM 1212 O ASP A 80 -10.604 -2.245 -8.802 1.00 1.30 O ATOM 1213 CB ASP A 80 -13.419 -2.868 -9.010 1.00 1.82 C ATOM 1214 CG ASP A 80 -14.864 -3.082 -9.426 1.00 2.56 C ATOM 1215 OD1 ASP A 80 -15.580 -2.079 -9.638 1.00 3.06 O ATOM 1216 OD2 ASP A 80 -15.287 -4.250 -9.573 1.00 3.12 O ATOM 0 H ASP A 80 -12.344 -3.157 -11.310 1.00 1.32 H new ATOM 0 HA ASP A 80 -13.392 -0.895 -9.812 1.00 1.15 H new ATOM 0 HB2 ASP A 80 -12.868 -3.799 -9.144 1.00 1.82 H new ATOM 0 HB3 ASP A 80 -13.386 -2.628 -7.947 1.00 1.82 H new ATOM 1221 N ILE A 81 -11.212 -0.081 -8.944 1.00 0.74 N ATOM 1222 CA ILE A 81 -9.972 0.467 -8.396 1.00 0.55 C ATOM 1223 C ILE A 81 -9.570 -0.219 -7.095 1.00 0.47 C ATOM 1224 O ILE A 81 -10.321 -0.193 -6.119 1.00 0.63 O ATOM 1225 CB ILE A 81 -10.125 1.980 -8.141 1.00 0.63 C ATOM 1226 CG1 ILE A 81 -10.424 2.702 -9.452 1.00 0.72 C ATOM 1227 CG2 ILE A 81 -8.876 2.551 -7.489 1.00 0.67 C ATOM 1228 CD1 ILE A 81 -9.324 2.545 -10.473 1.00 0.73 C ATOM 0 H ILE A 81 -11.908 0.629 -9.173 1.00 0.74 H new ATOM 0 HA ILE A 81 -9.189 0.288 -9.133 1.00 0.55 H new ATOM 0 HB ILE A 81 -10.959 2.133 -7.456 1.00 0.63 H new ATOM 0 HG12 ILE A 81 -11.356 2.319 -9.868 1.00 0.72 H new ATOM 0 HG13 ILE A 81 -10.577 3.762 -9.250 1.00 0.72 H new ATOM 0 HG21 ILE A 81 -9.010 3.619 -7.320 1.00 0.67 H new ATOM 0 HG22 ILE A 81 -8.702 2.052 -6.536 1.00 0.67 H new ATOM 0 HG23 ILE A 81 -8.019 2.392 -8.143 1.00 0.67 H new ATOM 0 HD11 ILE A 81 -9.594 3.080 -11.384 1.00 0.73 H new ATOM 0 HD12 ILE A 81 -8.396 2.954 -10.074 1.00 0.73 H new ATOM 0 HD13 ILE A 81 -9.187 1.488 -10.700 1.00 0.73 H new ATOM 1240 N VAL A 82 -8.393 -0.836 -7.070 1.00 0.32 N ATOM 1241 CA VAL A 82 -7.941 -1.509 -5.876 1.00 0.30 C ATOM 1242 C VAL A 82 -6.863 -0.721 -5.164 1.00 0.25 C ATOM 1243 O VAL A 82 -5.740 -0.608 -5.650 1.00 0.28 O ATOM 1244 CB VAL A 82 -7.386 -2.891 -6.201 1.00 0.39 C ATOM 1245 CG1 VAL A 82 -6.890 -3.554 -4.939 1.00 0.97 C ATOM 1246 CG2 VAL A 82 -8.442 -3.734 -6.884 1.00 1.19 C ATOM 0 H VAL A 82 -7.747 -0.879 -7.858 1.00 0.32 H new ATOM 0 HA VAL A 82 -8.811 -1.601 -5.226 1.00 0.30 H new ATOM 0 HB VAL A 82 -6.545 -2.788 -6.887 1.00 0.39 H new ATOM 0 HG11 VAL A 82 -6.495 -4.541 -5.178 1.00 0.97 H new ATOM 0 HG12 VAL A 82 -6.103 -2.946 -4.494 1.00 0.97 H new ATOM 0 HG13 VAL A 82 -7.714 -3.654 -4.233 1.00 0.97 H new ATOM 0 HG21 VAL A 82 -8.032 -4.718 -7.110 1.00 1.19 H new ATOM 0 HG22 VAL A 82 -9.303 -3.843 -6.225 1.00 1.19 H new ATOM 0 HG23 VAL A 82 -8.752 -3.249 -7.809 1.00 1.19 H new ATOM 1256 N ILE A 83 -7.196 -0.196 -4.006 1.00 0.25 N ATOM 1257 CA ILE A 83 -6.213 0.460 -3.179 1.00 0.25 C ATOM 1258 C ILE A 83 -5.554 -0.566 -2.304 1.00 0.27 C ATOM 1259 O ILE A 83 -6.156 -1.090 -1.372 1.00 0.45 O ATOM 1260 CB ILE A 83 -6.823 1.526 -2.259 1.00 0.34 C ATOM 1261 CG1 ILE A 83 -7.712 2.469 -3.044 1.00 0.48 C ATOM 1262 CG2 ILE A 83 -5.729 2.295 -1.532 1.00 0.84 C ATOM 1263 CD1 ILE A 83 -6.956 3.397 -3.970 1.00 1.32 C ATOM 0 H ILE A 83 -8.139 -0.211 -3.618 1.00 0.25 H new ATOM 0 HA ILE A 83 -5.508 0.949 -3.851 1.00 0.25 H new ATOM 0 HB ILE A 83 -7.439 1.022 -1.514 1.00 0.34 H new ATOM 0 HG12 ILE A 83 -8.418 1.882 -3.631 1.00 0.48 H new ATOM 0 HG13 ILE A 83 -8.297 3.067 -2.345 1.00 0.48 H new ATOM 0 HG21 ILE A 83 -6.181 3.046 -0.885 1.00 0.84 H new ATOM 0 HG22 ILE A 83 -5.138 1.605 -0.930 1.00 0.84 H new ATOM 0 HG23 ILE A 83 -5.083 2.785 -2.261 1.00 0.84 H new ATOM 0 HD11 ILE A 83 -7.661 4.040 -4.496 1.00 1.32 H new ATOM 0 HD12 ILE A 83 -6.269 4.012 -3.388 1.00 1.32 H new ATOM 0 HD13 ILE A 83 -6.392 2.809 -4.694 1.00 1.32 H new ATOM 1275 N LEU A 84 -4.333 -0.856 -2.625 1.00 0.22 N ATOM 1276 CA LEU A 84 -3.552 -1.802 -1.869 1.00 0.27 C ATOM 1277 C LEU A 84 -2.658 -1.051 -0.878 1.00 0.27 C ATOM 1278 O LEU A 84 -1.608 -0.516 -1.239 1.00 0.31 O ATOM 1279 CB LEU A 84 -2.744 -2.666 -2.844 1.00 0.35 C ATOM 1280 CG LEU A 84 -2.059 -3.884 -2.242 1.00 0.49 C ATOM 1281 CD1 LEU A 84 -0.732 -3.498 -1.613 1.00 1.33 C ATOM 1282 CD2 LEU A 84 -2.979 -4.544 -1.227 1.00 1.33 C ATOM 0 H LEU A 84 -3.842 -0.446 -3.420 1.00 0.22 H new ATOM 0 HA LEU A 84 -4.196 -2.462 -1.288 1.00 0.27 H new ATOM 0 HB2 LEU A 84 -3.410 -3.003 -3.638 1.00 0.35 H new ATOM 0 HB3 LEU A 84 -1.984 -2.039 -3.310 1.00 0.35 H new ATOM 0 HG LEU A 84 -1.849 -4.602 -3.035 1.00 0.49 H new ATOM 0 HD11 LEU A 84 -0.259 -4.384 -1.189 1.00 1.33 H new ATOM 0 HD12 LEU A 84 -0.080 -3.068 -2.374 1.00 1.33 H new ATOM 0 HD13 LEU A 84 -0.903 -2.765 -0.825 1.00 1.33 H new ATOM 0 HD21 LEU A 84 -2.483 -5.415 -0.799 1.00 1.33 H new ATOM 0 HD22 LEU A 84 -3.214 -3.834 -0.434 1.00 1.33 H new ATOM 0 HD23 LEU A 84 -3.900 -4.856 -1.720 1.00 1.33 H new ATOM 1294 N VAL A 85 -3.095 -0.997 0.369 1.00 0.28 N ATOM 1295 CA VAL A 85 -2.369 -0.270 1.399 1.00 0.28 C ATOM 1296 C VAL A 85 -1.319 -1.161 2.051 1.00 0.27 C ATOM 1297 O VAL A 85 -1.594 -2.308 2.405 1.00 0.34 O ATOM 1298 CB VAL A 85 -3.312 0.281 2.494 1.00 0.32 C ATOM 1299 CG1 VAL A 85 -2.532 1.126 3.497 1.00 1.17 C ATOM 1300 CG2 VAL A 85 -4.443 1.090 1.874 1.00 1.20 C ATOM 0 H VAL A 85 -3.950 -1.448 0.694 1.00 0.28 H new ATOM 0 HA VAL A 85 -1.884 0.572 0.904 1.00 0.28 H new ATOM 0 HB VAL A 85 -3.750 -0.564 3.025 1.00 0.32 H new ATOM 0 HG11 VAL A 85 -3.212 1.505 4.260 1.00 1.17 H new ATOM 0 HG12 VAL A 85 -1.763 0.514 3.968 1.00 1.17 H new ATOM 0 HG13 VAL A 85 -2.063 1.963 2.980 1.00 1.17 H new ATOM 0 HG21 VAL A 85 -5.094 1.468 2.662 1.00 1.20 H new ATOM 0 HG22 VAL A 85 -4.027 1.928 1.314 1.00 1.20 H new ATOM 0 HG23 VAL A 85 -5.019 0.454 1.201 1.00 1.20 H new ATOM 1310 N VAL A 86 -0.123 -0.616 2.195 1.00 0.25 N ATOM 1311 CA VAL A 86 0.971 -1.293 2.869 1.00 0.27 C ATOM 1312 C VAL A 86 1.593 -0.339 3.872 1.00 0.24 C ATOM 1313 O VAL A 86 1.089 0.761 4.085 1.00 0.26 O ATOM 1314 CB VAL A 86 2.060 -1.772 1.880 1.00 0.36 C ATOM 1315 CG1 VAL A 86 1.528 -2.866 0.975 1.00 1.12 C ATOM 1316 CG2 VAL A 86 2.585 -0.614 1.051 1.00 0.95 C ATOM 0 H VAL A 86 0.117 0.312 1.846 1.00 0.25 H new ATOM 0 HA VAL A 86 0.566 -2.175 3.366 1.00 0.27 H new ATOM 0 HB VAL A 86 2.884 -2.180 2.466 1.00 0.36 H new ATOM 0 HG11 VAL A 86 2.313 -3.185 0.289 1.00 1.12 H new ATOM 0 HG12 VAL A 86 1.207 -3.714 1.580 1.00 1.12 H new ATOM 0 HG13 VAL A 86 0.680 -2.486 0.404 1.00 1.12 H new ATOM 0 HG21 VAL A 86 3.349 -0.976 0.363 1.00 0.95 H new ATOM 0 HG22 VAL A 86 1.766 -0.172 0.483 1.00 0.95 H new ATOM 0 HG23 VAL A 86 3.017 0.139 1.710 1.00 0.95 H new ATOM 1326 N ALA A 87 2.675 -0.747 4.494 1.00 0.28 N ATOM 1327 CA ALA A 87 3.367 0.126 5.417 1.00 0.32 C ATOM 1328 C ALA A 87 4.865 0.050 5.204 1.00 0.46 C ATOM 1329 O ALA A 87 5.395 -1.018 4.895 1.00 0.75 O ATOM 1330 CB ALA A 87 3.000 -0.209 6.848 1.00 0.42 C ATOM 0 H ALA A 87 3.093 -1.670 4.380 1.00 0.28 H new ATOM 0 HA ALA A 87 3.053 1.151 5.222 1.00 0.32 H new ATOM 0 HB1 ALA A 87 3.531 0.459 7.526 1.00 0.42 H new ATOM 0 HB2 ALA A 87 1.926 -0.087 6.986 1.00 0.42 H new ATOM 0 HB3 ALA A 87 3.279 -1.241 7.063 1.00 0.42 H new ATOM 1336 N ALA A 88 5.515 1.199 5.369 1.00 0.37 N ATOM 1337 CA ALA A 88 6.957 1.359 5.165 1.00 0.59 C ATOM 1338 C ALA A 88 7.769 0.147 5.615 1.00 0.53 C ATOM 1339 O ALA A 88 8.433 -0.502 4.803 1.00 1.14 O ATOM 1340 CB ALA A 88 7.437 2.596 5.911 1.00 1.18 C ATOM 0 H ALA A 88 5.049 2.061 5.653 1.00 0.37 H new ATOM 0 HA ALA A 88 7.116 1.464 4.092 1.00 0.59 H new ATOM 0 HB1 ALA A 88 8.510 2.718 5.761 1.00 1.18 H new ATOM 0 HB2 ALA A 88 6.916 3.475 5.532 1.00 1.18 H new ATOM 0 HB3 ALA A 88 7.230 2.482 6.975 1.00 1.18 H new ATOM 1346 N ASP A 89 7.701 -0.166 6.902 1.00 0.56 N ATOM 1347 CA ASP A 89 8.574 -1.180 7.483 1.00 0.93 C ATOM 1348 C ASP A 89 7.941 -2.571 7.489 1.00 0.85 C ATOM 1349 O ASP A 89 8.500 -3.501 8.071 1.00 1.24 O ATOM 1350 CB ASP A 89 8.980 -0.779 8.909 1.00 1.44 C ATOM 1351 CG ASP A 89 7.797 -0.630 9.848 1.00 1.68 C ATOM 1352 OD1 ASP A 89 7.096 0.402 9.775 1.00 1.90 O ATOM 1353 OD2 ASP A 89 7.558 -1.549 10.661 1.00 2.01 O ATOM 0 H ASP A 89 7.054 0.265 7.562 1.00 0.56 H new ATOM 0 HA ASP A 89 9.460 -1.234 6.851 1.00 0.93 H new ATOM 0 HB2 ASP A 89 9.662 -1.529 9.310 1.00 1.44 H new ATOM 0 HB3 ASP A 89 9.528 0.163 8.873 1.00 1.44 H new ATOM 1358 N ASP A 90 6.797 -2.734 6.836 1.00 0.48 N ATOM 1359 CA ASP A 90 6.167 -4.053 6.774 1.00 0.46 C ATOM 1360 C ASP A 90 6.128 -4.573 5.348 1.00 0.45 C ATOM 1361 O ASP A 90 6.460 -5.731 5.086 1.00 0.69 O ATOM 1362 CB ASP A 90 4.744 -4.033 7.343 1.00 0.52 C ATOM 1363 CG ASP A 90 4.243 -5.429 7.671 1.00 0.74 C ATOM 1364 OD1 ASP A 90 4.901 -6.136 8.462 1.00 0.93 O ATOM 1365 OD2 ASP A 90 3.184 -5.826 7.147 1.00 1.09 O ATOM 0 H ASP A 90 6.294 -1.991 6.351 1.00 0.48 H new ATOM 0 HA ASP A 90 6.776 -4.719 7.385 1.00 0.46 H new ATOM 0 HB2 ASP A 90 4.722 -3.419 8.243 1.00 0.52 H new ATOM 0 HB3 ASP A 90 4.072 -3.566 6.623 1.00 0.52 H new ATOM 1370 N GLY A 91 5.747 -3.703 4.425 1.00 0.36 N ATOM 1371 CA GLY A 91 5.579 -4.110 3.047 1.00 0.36 C ATOM 1372 C GLY A 91 4.232 -4.762 2.824 1.00 0.35 C ATOM 1373 O GLY A 91 3.240 -4.368 3.437 1.00 0.52 O ATOM 0 H GLY A 91 5.551 -2.719 4.607 1.00 0.36 H new ATOM 0 HA2 GLY A 91 5.677 -3.242 2.395 1.00 0.36 H new ATOM 0 HA3 GLY A 91 6.372 -4.806 2.772 1.00 0.36 H new ATOM 1377 N VAL A 92 4.199 -5.757 1.955 1.00 0.38 N ATOM 1378 CA VAL A 92 2.990 -6.497 1.674 1.00 0.37 C ATOM 1379 C VAL A 92 2.923 -7.751 2.553 1.00 0.36 C ATOM 1380 O VAL A 92 3.666 -8.712 2.354 1.00 0.47 O ATOM 1381 CB VAL A 92 2.936 -6.858 0.172 1.00 0.47 C ATOM 1382 CG1 VAL A 92 4.212 -7.541 -0.278 1.00 1.08 C ATOM 1383 CG2 VAL A 92 1.752 -7.734 -0.130 1.00 1.06 C ATOM 0 H VAL A 92 5.012 -6.072 1.426 1.00 0.38 H new ATOM 0 HA VAL A 92 2.123 -5.880 1.907 1.00 0.37 H new ATOM 0 HB VAL A 92 2.832 -5.925 -0.381 1.00 0.47 H new ATOM 0 HG11 VAL A 92 4.141 -7.782 -1.339 1.00 1.08 H new ATOM 0 HG12 VAL A 92 5.059 -6.875 -0.113 1.00 1.08 H new ATOM 0 HG13 VAL A 92 4.355 -8.458 0.293 1.00 1.08 H new ATOM 0 HG21 VAL A 92 1.738 -7.973 -1.193 1.00 1.06 H new ATOM 0 HG22 VAL A 92 1.824 -8.655 0.448 1.00 1.06 H new ATOM 0 HG23 VAL A 92 0.834 -7.210 0.136 1.00 1.06 H new ATOM 1393 N MET A 93 2.053 -7.723 3.553 1.00 0.29 N ATOM 1394 CA MET A 93 1.883 -8.858 4.448 1.00 0.31 C ATOM 1395 C MET A 93 0.915 -9.862 3.813 1.00 0.31 C ATOM 1396 O MET A 93 0.314 -9.557 2.784 1.00 0.31 O ATOM 1397 CB MET A 93 1.396 -8.364 5.817 1.00 0.36 C ATOM 1398 CG MET A 93 -0.075 -8.008 5.886 1.00 0.67 C ATOM 1399 SD MET A 93 -1.081 -9.382 6.469 1.00 1.32 S ATOM 1400 CE MET A 93 -0.189 -9.787 7.965 1.00 0.65 C ATOM 0 H MET A 93 1.453 -6.925 3.765 1.00 0.29 H new ATOM 0 HA MET A 93 2.833 -9.368 4.605 1.00 0.31 H new ATOM 0 HB2 MET A 93 1.602 -9.136 6.559 1.00 0.36 H new ATOM 0 HB3 MET A 93 1.980 -7.487 6.098 1.00 0.36 H new ATOM 0 HG2 MET A 93 -0.210 -7.154 6.550 1.00 0.67 H new ATOM 0 HG3 MET A 93 -0.419 -7.701 4.898 1.00 0.67 H new ATOM 0 HE1 MET A 93 0.153 -10.821 7.916 1.00 0.65 H new ATOM 0 HE2 MET A 93 0.671 -9.125 8.067 1.00 0.65 H new ATOM 0 HE3 MET A 93 -0.846 -9.663 8.826 1.00 0.65 H new ATOM 1410 N PRO A 94 0.791 -11.083 4.378 1.00 0.38 N ATOM 1411 CA PRO A 94 -0.111 -12.126 3.871 1.00 0.42 C ATOM 1412 C PRO A 94 -1.436 -11.615 3.301 1.00 0.39 C ATOM 1413 O PRO A 94 -1.791 -11.938 2.166 1.00 0.42 O ATOM 1414 CB PRO A 94 -0.352 -12.976 5.111 1.00 0.52 C ATOM 1415 CG PRO A 94 0.938 -12.916 5.855 1.00 0.61 C ATOM 1416 CD PRO A 94 1.560 -11.574 5.540 1.00 0.46 C ATOM 0 HA PRO A 94 0.331 -12.649 3.023 1.00 0.42 H new ATOM 0 HB2 PRO A 94 -1.175 -12.583 5.709 1.00 0.52 H new ATOM 0 HB3 PRO A 94 -0.611 -14.001 4.846 1.00 0.52 H new ATOM 0 HG2 PRO A 94 0.772 -13.023 6.927 1.00 0.61 H new ATOM 0 HG3 PRO A 94 1.598 -13.729 5.552 1.00 0.61 H new ATOM 0 HD2 PRO A 94 1.483 -10.891 6.386 1.00 0.46 H new ATOM 0 HD3 PRO A 94 2.620 -11.672 5.304 1.00 0.46 H new ATOM 1424 N GLN A 95 -2.157 -10.801 4.062 1.00 0.40 N ATOM 1425 CA GLN A 95 -3.475 -10.371 3.651 1.00 0.43 C ATOM 1426 C GLN A 95 -3.391 -9.309 2.566 1.00 0.36 C ATOM 1427 O GLN A 95 -4.315 -9.147 1.769 1.00 0.39 O ATOM 1428 CB GLN A 95 -4.256 -9.866 4.854 1.00 0.53 C ATOM 1429 CG GLN A 95 -4.380 -10.916 5.939 1.00 0.64 C ATOM 1430 CD GLN A 95 -5.815 -11.170 6.348 1.00 0.88 C ATOM 1431 OE1 GLN A 95 -6.337 -10.545 7.270 1.00 1.41 O ATOM 1432 NE2 GLN A 95 -6.466 -12.091 5.656 1.00 1.47 N ATOM 0 H GLN A 95 -1.848 -10.431 4.961 1.00 0.40 H new ATOM 0 HA GLN A 95 -4.003 -11.226 3.229 1.00 0.43 H new ATOM 0 HB2 GLN A 95 -3.763 -8.983 5.260 1.00 0.53 H new ATOM 0 HB3 GLN A 95 -5.251 -9.557 4.535 1.00 0.53 H new ATOM 0 HG2 GLN A 95 -3.936 -11.848 5.589 1.00 0.64 H new ATOM 0 HG3 GLN A 95 -3.809 -10.599 6.812 1.00 0.64 H new ATOM 0 HE21 GLN A 95 -5.996 -12.587 4.898 1.00 1.47 H new ATOM 0 HE22 GLN A 95 -7.438 -12.305 5.880 1.00 1.47 H new ATOM 1441 N THR A 96 -2.264 -8.607 2.523 1.00 0.33 N ATOM 1442 CA THR A 96 -2.021 -7.623 1.491 1.00 0.31 C ATOM 1443 C THR A 96 -1.926 -8.309 0.123 1.00 0.29 C ATOM 1444 O THR A 96 -2.173 -7.701 -0.918 1.00 0.34 O ATOM 1445 CB THR A 96 -0.728 -6.856 1.798 1.00 0.34 C ATOM 1446 OG1 THR A 96 -0.635 -6.629 3.207 1.00 0.37 O ATOM 1447 CG2 THR A 96 -0.701 -5.524 1.083 1.00 0.46 C ATOM 0 H THR A 96 -1.505 -8.707 3.197 1.00 0.33 H new ATOM 0 HA THR A 96 -2.850 -6.916 1.467 1.00 0.31 H new ATOM 0 HB THR A 96 0.115 -7.455 1.452 1.00 0.34 H new ATOM 0 HG1 THR A 96 -1.312 -5.974 3.478 1.00 0.37 H new ATOM 0 HG21 THR A 96 0.227 -5.003 1.319 1.00 0.46 H new ATOM 0 HG22 THR A 96 -0.761 -5.687 0.007 1.00 0.46 H new ATOM 0 HG23 THR A 96 -1.549 -4.920 1.407 1.00 0.46 H new ATOM 1455 N VAL A 97 -1.585 -9.596 0.143 1.00 0.33 N ATOM 1456 CA VAL A 97 -1.491 -10.389 -1.060 1.00 0.39 C ATOM 1457 C VAL A 97 -2.838 -11.005 -1.416 1.00 0.34 C ATOM 1458 O VAL A 97 -3.231 -11.006 -2.580 1.00 0.37 O ATOM 1459 CB VAL A 97 -0.449 -11.506 -0.885 1.00 0.60 C ATOM 1460 CG1 VAL A 97 -0.487 -12.470 -2.046 1.00 1.00 C ATOM 1461 CG2 VAL A 97 0.932 -10.912 -0.738 1.00 1.05 C ATOM 0 H VAL A 97 -1.368 -10.109 0.998 1.00 0.33 H new ATOM 0 HA VAL A 97 -1.182 -9.728 -1.870 1.00 0.39 H new ATOM 0 HB VAL A 97 -0.693 -12.061 0.021 1.00 0.60 H new ATOM 0 HG11 VAL A 97 0.260 -13.250 -1.896 1.00 1.00 H new ATOM 0 HG12 VAL A 97 -1.476 -12.923 -2.111 1.00 1.00 H new ATOM 0 HG13 VAL A 97 -0.272 -11.934 -2.971 1.00 1.00 H new ATOM 0 HG21 VAL A 97 1.661 -11.713 -0.615 1.00 1.05 H new ATOM 0 HG22 VAL A 97 1.176 -10.333 -1.629 1.00 1.05 H new ATOM 0 HG23 VAL A 97 0.957 -10.261 0.136 1.00 1.05 H new ATOM 1471 N GLU A 98 -3.545 -11.519 -0.410 1.00 0.35 N ATOM 1472 CA GLU A 98 -4.839 -12.169 -0.627 1.00 0.40 C ATOM 1473 C GLU A 98 -5.814 -11.230 -1.330 1.00 0.34 C ATOM 1474 O GLU A 98 -6.629 -11.658 -2.148 1.00 0.45 O ATOM 1475 CB GLU A 98 -5.447 -12.632 0.699 1.00 0.54 C ATOM 1476 CG GLU A 98 -4.599 -13.640 1.452 1.00 0.72 C ATOM 1477 CD GLU A 98 -5.353 -14.286 2.596 1.00 1.14 C ATOM 1478 OE1 GLU A 98 -5.338 -13.742 3.720 1.00 1.62 O ATOM 1479 OE2 GLU A 98 -5.965 -15.351 2.378 1.00 1.55 O ATOM 0 H GLU A 98 -3.244 -11.498 0.564 1.00 0.35 H new ATOM 0 HA GLU A 98 -4.664 -13.037 -1.262 1.00 0.40 H new ATOM 0 HB2 GLU A 98 -5.609 -11.762 1.335 1.00 0.54 H new ATOM 0 HB3 GLU A 98 -6.426 -13.070 0.504 1.00 0.54 H new ATOM 0 HG2 GLU A 98 -4.259 -14.412 0.762 1.00 0.72 H new ATOM 0 HG3 GLU A 98 -3.709 -13.145 1.840 1.00 0.72 H new ATOM 1486 N ALA A 99 -5.706 -9.945 -1.029 1.00 0.28 N ATOM 1487 CA ALA A 99 -6.605 -8.958 -1.598 1.00 0.27 C ATOM 1488 C ALA A 99 -6.186 -8.625 -3.018 1.00 0.25 C ATOM 1489 O ALA A 99 -7.022 -8.365 -3.878 1.00 0.34 O ATOM 1490 CB ALA A 99 -6.628 -7.707 -0.736 1.00 0.31 C ATOM 0 H ALA A 99 -5.005 -9.563 -0.394 1.00 0.28 H new ATOM 0 HA ALA A 99 -7.613 -9.373 -1.625 1.00 0.27 H new ATOM 0 HB1 ALA A 99 -7.306 -6.975 -1.175 1.00 0.31 H new ATOM 0 HB2 ALA A 99 -6.969 -7.963 0.267 1.00 0.31 H new ATOM 0 HB3 ALA A 99 -5.625 -7.284 -0.681 1.00 0.31 H new ATOM 1496 N ILE A 100 -4.886 -8.661 -3.258 1.00 0.25 N ATOM 1497 CA ILE A 100 -4.333 -8.397 -4.576 1.00 0.24 C ATOM 1498 C ILE A 100 -4.556 -9.585 -5.503 1.00 0.28 C ATOM 1499 O ILE A 100 -4.963 -9.412 -6.642 1.00 0.34 O ATOM 1500 CB ILE A 100 -2.836 -8.060 -4.460 1.00 0.25 C ATOM 1501 CG1 ILE A 100 -2.626 -6.555 -4.621 1.00 0.36 C ATOM 1502 CG2 ILE A 100 -1.987 -8.840 -5.452 1.00 0.37 C ATOM 1503 CD1 ILE A 100 -1.182 -6.114 -4.491 1.00 0.38 C ATOM 0 H ILE A 100 -4.186 -8.873 -2.547 1.00 0.25 H new ATOM 0 HA ILE A 100 -4.848 -7.539 -5.008 1.00 0.24 H new ATOM 0 HB ILE A 100 -2.505 -8.362 -3.466 1.00 0.25 H new ATOM 0 HG12 ILE A 100 -3.002 -6.249 -5.597 1.00 0.36 H new ATOM 0 HG13 ILE A 100 -3.223 -6.034 -3.872 1.00 0.36 H new ATOM 0 HG21 ILE A 100 -0.939 -8.566 -5.329 1.00 0.37 H new ATOM 0 HG22 ILE A 100 -2.106 -9.908 -5.272 1.00 0.37 H new ATOM 0 HG23 ILE A 100 -2.306 -8.606 -6.467 1.00 0.37 H new ATOM 0 HD11 ILE A 100 -1.119 -5.033 -4.618 1.00 0.38 H new ATOM 0 HD12 ILE A 100 -0.806 -6.386 -3.505 1.00 0.38 H new ATOM 0 HD13 ILE A 100 -0.581 -6.605 -5.257 1.00 0.38 H new ATOM 1515 N ASN A 101 -4.278 -10.783 -5.008 1.00 0.31 N ATOM 1516 CA ASN A 101 -4.572 -12.014 -5.720 1.00 0.38 C ATOM 1517 C ASN A 101 -6.021 -12.031 -6.178 1.00 0.37 C ATOM 1518 O ASN A 101 -6.338 -12.486 -7.275 1.00 0.46 O ATOM 1519 CB ASN A 101 -4.313 -13.202 -4.799 1.00 0.46 C ATOM 1520 CG ASN A 101 -3.851 -14.415 -5.561 1.00 1.08 C ATOM 1521 OD1 ASN A 101 -4.647 -15.253 -5.982 1.00 1.85 O ATOM 1522 ND2 ASN A 101 -2.551 -14.505 -5.749 1.00 1.55 N ATOM 0 H ASN A 101 -3.841 -10.927 -4.098 1.00 0.31 H new ATOM 0 HA ASN A 101 -3.929 -12.078 -6.598 1.00 0.38 H new ATOM 0 HB2 ASN A 101 -3.560 -12.930 -4.059 1.00 0.46 H new ATOM 0 HB3 ASN A 101 -5.225 -13.443 -4.252 1.00 0.46 H new ATOM 0 HD21 ASN A 101 -2.164 -15.296 -6.264 1.00 1.55 H new ATOM 0 HD22 ASN A 101 -1.931 -13.784 -5.380 1.00 1.55 H new ATOM 1529 N HIS A 102 -6.890 -11.509 -5.324 1.00 0.33 N ATOM 1530 CA HIS A 102 -8.311 -11.434 -5.616 1.00 0.38 C ATOM 1531 C HIS A 102 -8.613 -10.270 -6.557 1.00 0.38 C ATOM 1532 O HIS A 102 -9.571 -10.315 -7.325 1.00 0.47 O ATOM 1533 CB HIS A 102 -9.104 -11.265 -4.312 1.00 0.43 C ATOM 1534 CG HIS A 102 -10.591 -11.303 -4.494 1.00 0.55 C ATOM 1535 ND1 HIS A 102 -11.478 -10.304 -4.698 1.00 0.75 N flip ATOM 1536 CD2 HIS A 102 -11.329 -12.465 -4.466 1.00 0.61 C flip ATOM 1537 CE1 HIS A 102 -12.726 -10.871 -4.786 1.00 0.85 C flip ATOM 1538 NE2 HIS A 102 -12.607 -12.179 -4.643 1.00 0.77 N flip ATOM 0 H HIS A 102 -6.630 -11.128 -4.414 1.00 0.33 H new ATOM 0 HA HIS A 102 -8.609 -12.361 -6.106 1.00 0.38 H new ATOM 0 HB2 HIS A 102 -8.813 -12.053 -3.617 1.00 0.43 H new ATOM 0 HB3 HIS A 102 -8.829 -10.316 -3.852 1.00 0.43 H new ATOM 0 HD2 HIS A 102 -10.926 -13.457 -4.322 1.00 0.61 H new ATOM 0 HE1 HIS A 102 -13.651 -10.336 -4.946 1.00 0.85 H new ATOM 0 HE2 HIS A 102 -13.372 -12.854 -4.665 1.00 0.77 H new ATOM 1547 N ALA A 103 -7.792 -9.233 -6.497 1.00 0.32 N ATOM 1548 CA ALA A 103 -8.078 -8.003 -7.221 1.00 0.38 C ATOM 1549 C ALA A 103 -7.453 -7.986 -8.610 1.00 0.40 C ATOM 1550 O ALA A 103 -8.093 -7.621 -9.595 1.00 0.48 O ATOM 1551 CB ALA A 103 -7.575 -6.819 -6.424 1.00 0.43 C ATOM 0 H ALA A 103 -6.926 -9.217 -5.958 1.00 0.32 H new ATOM 0 HA ALA A 103 -9.159 -7.944 -7.350 1.00 0.38 H new ATOM 0 HB1 ALA A 103 -7.789 -5.898 -6.966 1.00 0.43 H new ATOM 0 HB2 ALA A 103 -8.074 -6.794 -5.455 1.00 0.43 H new ATOM 0 HB3 ALA A 103 -6.499 -6.911 -6.276 1.00 0.43 H new ATOM 1557 N LYS A 104 -6.201 -8.401 -8.677 1.00 0.40 N ATOM 1558 CA LYS A 104 -5.397 -8.273 -9.881 1.00 0.51 C ATOM 1559 C LYS A 104 -5.947 -9.136 -11.011 1.00 0.50 C ATOM 1560 O LYS A 104 -5.739 -8.845 -12.189 1.00 0.60 O ATOM 1561 CB LYS A 104 -3.955 -8.670 -9.556 1.00 0.64 C ATOM 1562 CG LYS A 104 -3.709 -10.170 -9.575 1.00 1.11 C ATOM 1563 CD LYS A 104 -2.442 -10.531 -8.825 1.00 1.57 C ATOM 1564 CE LYS A 104 -1.228 -9.777 -9.346 1.00 1.92 C ATOM 1565 NZ LYS A 104 -0.994 -9.999 -10.797 1.00 2.56 N ATOM 0 H LYS A 104 -5.711 -8.838 -7.896 1.00 0.40 H new ATOM 0 HA LYS A 104 -5.429 -7.238 -10.220 1.00 0.51 H new ATOM 0 HB2 LYS A 104 -3.287 -8.193 -10.273 1.00 0.64 H new ATOM 0 HB3 LYS A 104 -3.695 -8.282 -8.571 1.00 0.64 H new ATOM 0 HG2 LYS A 104 -4.558 -10.685 -9.127 1.00 1.11 H new ATOM 0 HG3 LYS A 104 -3.634 -10.515 -10.606 1.00 1.11 H new ATOM 0 HD2 LYS A 104 -2.575 -10.313 -7.765 1.00 1.57 H new ATOM 0 HD3 LYS A 104 -2.265 -11.603 -8.910 1.00 1.57 H new ATOM 0 HE2 LYS A 104 -1.361 -8.711 -9.163 1.00 1.92 H new ATOM 0 HE3 LYS A 104 -0.345 -10.088 -8.788 1.00 1.92 H new ATOM 0 HZ1 LYS A 104 0.025 -9.944 -10.997 1.00 2.56 H new ATOM 0 HZ2 LYS A 104 -1.349 -10.939 -11.066 1.00 2.56 H new ATOM 0 HZ3 LYS A 104 -1.494 -9.270 -11.345 1.00 2.56 H new ATOM 1579 N ALA A 105 -6.678 -10.184 -10.650 1.00 0.51 N ATOM 1580 CA ALA A 105 -7.169 -11.134 -11.635 1.00 0.61 C ATOM 1581 C ALA A 105 -8.541 -10.742 -12.159 1.00 0.66 C ATOM 1582 O ALA A 105 -9.175 -11.500 -12.896 1.00 0.76 O ATOM 1583 CB ALA A 105 -7.197 -12.541 -11.055 1.00 0.72 C ATOM 0 H ALA A 105 -6.942 -10.395 -9.687 1.00 0.51 H new ATOM 0 HA ALA A 105 -6.479 -11.119 -12.479 1.00 0.61 H new ATOM 0 HB1 ALA A 105 -7.567 -13.237 -11.807 1.00 0.72 H new ATOM 0 HB2 ALA A 105 -6.190 -12.831 -10.756 1.00 0.72 H new ATOM 0 HB3 ALA A 105 -7.854 -12.563 -10.186 1.00 0.72 H new ATOM 1589 N ALA A 106 -8.984 -9.551 -11.793 1.00 0.62 N ATOM 1590 CA ALA A 106 -10.222 -9.004 -12.307 1.00 0.70 C ATOM 1591 C ALA A 106 -9.893 -7.976 -13.378 1.00 0.72 C ATOM 1592 O ALA A 106 -10.758 -7.233 -13.836 1.00 0.90 O ATOM 1593 CB ALA A 106 -11.042 -8.386 -11.187 1.00 0.75 C ATOM 0 H ALA A 106 -8.497 -8.942 -11.135 1.00 0.62 H new ATOM 0 HA ALA A 106 -10.823 -9.801 -12.745 1.00 0.70 H new ATOM 0 HB1 ALA A 106 -11.968 -7.981 -11.595 1.00 0.75 H new ATOM 0 HB2 ALA A 106 -11.276 -9.148 -10.444 1.00 0.75 H new ATOM 0 HB3 ALA A 106 -10.471 -7.585 -10.718 1.00 0.75 H new ATOM 1599 N ASN A 107 -8.608 -7.946 -13.744 1.00 0.67 N ATOM 1600 CA ASN A 107 -8.101 -7.095 -14.815 1.00 0.73 C ATOM 1601 C ASN A 107 -8.147 -5.630 -14.404 1.00 0.67 C ATOM 1602 O ASN A 107 -8.473 -4.747 -15.191 1.00 0.80 O ATOM 1603 CB ASN A 107 -8.882 -7.346 -16.093 1.00 0.92 C ATOM 1604 CG ASN A 107 -8.197 -6.810 -17.341 1.00 1.44 C ATOM 1605 OD1 ASN A 107 -7.311 -7.456 -17.903 1.00 1.99 O ATOM 1606 ND2 ASN A 107 -8.625 -5.649 -17.810 1.00 2.06 N ATOM 0 H ASN A 107 -7.889 -8.517 -13.300 1.00 0.67 H new ATOM 0 HA ASN A 107 -7.057 -7.345 -15.005 1.00 0.73 H new ATOM 0 HB2 ASN A 107 -9.040 -8.418 -16.208 1.00 0.92 H new ATOM 0 HB3 ASN A 107 -9.866 -6.887 -16.003 1.00 0.92 H new ATOM 0 HD21 ASN A 107 -8.219 -5.263 -18.662 1.00 2.06 H new ATOM 0 HD22 ASN A 107 -9.361 -5.141 -17.319 1.00 2.06 H new ATOM 1613 N VAL A 108 -7.830 -5.385 -13.145 1.00 0.55 N ATOM 1614 CA VAL A 108 -7.796 -4.036 -12.622 1.00 0.49 C ATOM 1615 C VAL A 108 -6.397 -3.684 -12.122 1.00 0.40 C ATOM 1616 O VAL A 108 -5.631 -4.560 -11.710 1.00 0.42 O ATOM 1617 CB VAL A 108 -8.820 -3.851 -11.475 1.00 0.54 C ATOM 1618 CG1 VAL A 108 -9.669 -5.096 -11.273 1.00 1.00 C ATOM 1619 CG2 VAL A 108 -8.130 -3.460 -10.179 1.00 1.08 C ATOM 0 H VAL A 108 -7.592 -6.108 -12.466 1.00 0.55 H new ATOM 0 HA VAL A 108 -8.063 -3.364 -13.438 1.00 0.49 H new ATOM 0 HB VAL A 108 -9.485 -3.038 -11.768 1.00 0.54 H new ATOM 0 HG11 VAL A 108 -10.375 -4.927 -10.460 1.00 1.00 H new ATOM 0 HG12 VAL A 108 -10.217 -5.316 -12.189 1.00 1.00 H new ATOM 0 HG13 VAL A 108 -9.025 -5.939 -11.025 1.00 1.00 H new ATOM 0 HG21 VAL A 108 -8.875 -3.337 -9.393 1.00 1.08 H new ATOM 0 HG22 VAL A 108 -7.425 -4.240 -9.892 1.00 1.08 H new ATOM 0 HG23 VAL A 108 -7.594 -2.521 -10.321 1.00 1.08 H new ATOM 1629 N PRO A 109 -6.042 -2.395 -12.197 1.00 0.39 N ATOM 1630 CA PRO A 109 -4.817 -1.869 -11.606 1.00 0.35 C ATOM 1631 C PRO A 109 -4.865 -1.771 -10.084 1.00 0.30 C ATOM 1632 O PRO A 109 -5.930 -1.596 -9.462 1.00 0.34 O ATOM 1633 CB PRO A 109 -4.695 -0.462 -12.175 1.00 0.43 C ATOM 1634 CG PRO A 109 -5.717 -0.357 -13.245 1.00 0.51 C ATOM 1635 CD PRO A 109 -6.781 -1.358 -12.917 1.00 0.48 C ATOM 0 HA PRO A 109 -3.982 -2.531 -11.836 1.00 0.35 H new ATOM 0 HB2 PRO A 109 -4.864 0.287 -11.401 1.00 0.43 H new ATOM 0 HB3 PRO A 109 -3.695 -0.289 -12.573 1.00 0.43 H new ATOM 0 HG2 PRO A 109 -6.132 0.650 -13.288 1.00 0.51 H new ATOM 0 HG3 PRO A 109 -5.279 -0.563 -14.222 1.00 0.51 H new ATOM 0 HD2 PRO A 109 -7.569 -0.923 -12.303 1.00 0.48 H new ATOM 0 HD3 PRO A 109 -7.257 -1.751 -13.815 1.00 0.48 H new ATOM 1643 N ILE A 110 -3.684 -1.805 -9.502 1.00 0.27 N ATOM 1644 CA ILE A 110 -3.541 -1.799 -8.054 1.00 0.25 C ATOM 1645 C ILE A 110 -2.825 -0.526 -7.607 1.00 0.23 C ATOM 1646 O ILE A 110 -1.922 -0.034 -8.291 1.00 0.26 O ATOM 1647 CB ILE A 110 -2.794 -3.073 -7.551 1.00 0.30 C ATOM 1648 CG1 ILE A 110 -3.790 -4.203 -7.241 1.00 0.46 C ATOM 1649 CG2 ILE A 110 -1.931 -2.786 -6.330 1.00 0.45 C ATOM 1650 CD1 ILE A 110 -4.430 -4.829 -8.461 1.00 0.96 C ATOM 0 H ILE A 110 -2.801 -1.837 -10.011 1.00 0.27 H new ATOM 0 HA ILE A 110 -4.536 -1.814 -7.609 1.00 0.25 H new ATOM 0 HB ILE A 110 -2.132 -3.393 -8.356 1.00 0.30 H new ATOM 0 HG12 ILE A 110 -3.274 -4.981 -6.678 1.00 0.46 H new ATOM 0 HG13 ILE A 110 -4.576 -3.810 -6.595 1.00 0.46 H new ATOM 0 HG21 ILE A 110 -1.430 -3.701 -6.015 1.00 0.45 H new ATOM 0 HG22 ILE A 110 -1.185 -2.032 -6.581 1.00 0.45 H new ATOM 0 HG23 ILE A 110 -2.559 -2.419 -5.519 1.00 0.45 H new ATOM 0 HD11 ILE A 110 -5.117 -5.615 -8.148 1.00 0.96 H new ATOM 0 HD12 ILE A 110 -4.978 -4.067 -9.015 1.00 0.96 H new ATOM 0 HD13 ILE A 110 -3.656 -5.256 -9.099 1.00 0.96 H new ATOM 1662 N ILE A 111 -3.246 0.023 -6.478 1.00 0.23 N ATOM 1663 CA ILE A 111 -2.627 1.226 -5.948 1.00 0.25 C ATOM 1664 C ILE A 111 -1.922 0.877 -4.679 1.00 0.32 C ATOM 1665 O ILE A 111 -2.412 0.080 -3.919 1.00 0.71 O ATOM 1666 CB ILE A 111 -3.650 2.349 -5.642 1.00 0.29 C ATOM 1667 CG1 ILE A 111 -4.332 2.839 -6.911 1.00 0.35 C ATOM 1668 CG2 ILE A 111 -3.000 3.504 -4.908 1.00 0.34 C ATOM 1669 CD1 ILE A 111 -5.543 2.022 -7.254 1.00 0.53 C ATOM 0 H ILE A 111 -4.012 -0.345 -5.913 1.00 0.23 H new ATOM 0 HA ILE A 111 -1.943 1.602 -6.709 1.00 0.25 H new ATOM 0 HB ILE A 111 -4.413 1.921 -4.991 1.00 0.29 H new ATOM 0 HG12 ILE A 111 -4.623 3.882 -6.786 1.00 0.35 H new ATOM 0 HG13 ILE A 111 -3.624 2.803 -7.739 1.00 0.35 H new ATOM 0 HG21 ILE A 111 -3.745 4.274 -4.709 1.00 0.34 H new ATOM 0 HG22 ILE A 111 -2.585 3.148 -3.965 1.00 0.34 H new ATOM 0 HG23 ILE A 111 -2.202 3.922 -5.521 1.00 0.34 H new ATOM 0 HD11 ILE A 111 -5.996 2.409 -8.167 1.00 0.53 H new ATOM 0 HD12 ILE A 111 -5.250 0.983 -7.406 1.00 0.53 H new ATOM 0 HD13 ILE A 111 -6.264 2.080 -6.438 1.00 0.53 H new ATOM 1681 N VAL A 112 -0.770 1.436 -4.457 1.00 0.21 N ATOM 1682 CA VAL A 112 -0.082 1.199 -3.235 1.00 0.20 C ATOM 1683 C VAL A 112 -0.127 2.417 -2.356 1.00 0.20 C ATOM 1684 O VAL A 112 0.069 3.541 -2.814 1.00 0.23 O ATOM 1685 CB VAL A 112 1.371 0.841 -3.476 1.00 0.20 C ATOM 1686 CG1 VAL A 112 1.794 -0.213 -2.512 1.00 0.20 C ATOM 1687 CG2 VAL A 112 1.577 0.358 -4.894 1.00 0.22 C ATOM 0 H VAL A 112 -0.292 2.058 -5.109 1.00 0.21 H new ATOM 0 HA VAL A 112 -0.584 0.364 -2.747 1.00 0.20 H new ATOM 0 HB VAL A 112 1.979 1.734 -3.327 1.00 0.20 H new ATOM 0 HG11 VAL A 112 2.839 -0.468 -2.688 1.00 0.20 H new ATOM 0 HG12 VAL A 112 1.677 0.157 -1.494 1.00 0.20 H new ATOM 0 HG13 VAL A 112 1.176 -1.100 -2.649 1.00 0.20 H new ATOM 0 HG21 VAL A 112 2.627 0.107 -5.044 1.00 0.22 H new ATOM 0 HG22 VAL A 112 0.964 -0.526 -5.070 1.00 0.22 H new ATOM 0 HG23 VAL A 112 1.289 1.144 -5.592 1.00 0.22 H new ATOM 1697 N ALA A 113 -0.372 2.181 -1.101 1.00 0.19 N ATOM 1698 CA ALA A 113 -0.297 3.217 -0.116 1.00 0.21 C ATOM 1699 C ALA A 113 0.658 2.762 0.955 1.00 0.21 C ATOM 1700 O ALA A 113 0.265 2.136 1.930 1.00 0.23 O ATOM 1701 CB ALA A 113 -1.669 3.511 0.462 1.00 0.25 C ATOM 0 H ALA A 113 -0.629 1.265 -0.732 1.00 0.19 H new ATOM 0 HA ALA A 113 0.061 4.143 -0.566 1.00 0.21 H new ATOM 0 HB1 ALA A 113 -1.588 4.301 1.208 1.00 0.25 H new ATOM 0 HB2 ALA A 113 -2.339 3.833 -0.336 1.00 0.25 H new ATOM 0 HB3 ALA A 113 -2.068 2.610 0.929 1.00 0.25 H new ATOM 1707 N ILE A 114 1.919 3.052 0.732 1.00 0.21 N ATOM 1708 CA ILE A 114 2.966 2.714 1.667 1.00 0.24 C ATOM 1709 C ILE A 114 2.922 3.672 2.844 1.00 0.25 C ATOM 1710 O ILE A 114 3.532 4.729 2.802 1.00 0.30 O ATOM 1711 CB ILE A 114 4.344 2.804 0.990 1.00 0.28 C ATOM 1712 CG1 ILE A 114 4.318 2.163 -0.400 1.00 0.32 C ATOM 1713 CG2 ILE A 114 5.376 2.124 1.857 1.00 0.36 C ATOM 1714 CD1 ILE A 114 5.626 2.293 -1.151 1.00 0.85 C ATOM 0 H ILE A 114 2.248 3.531 -0.106 1.00 0.21 H new ATOM 0 HA ILE A 114 2.809 1.692 2.013 1.00 0.24 H new ATOM 0 HB ILE A 114 4.604 3.856 0.869 1.00 0.28 H new ATOM 0 HG12 ILE A 114 4.070 1.106 -0.299 1.00 0.32 H new ATOM 0 HG13 ILE A 114 3.524 2.622 -0.988 1.00 0.32 H new ATOM 0 HG21 ILE A 114 6.353 2.187 1.378 1.00 0.36 H new ATOM 0 HG22 ILE A 114 5.416 2.616 2.829 1.00 0.36 H new ATOM 0 HG23 ILE A 114 5.105 1.077 1.991 1.00 0.36 H new ATOM 0 HD11 ILE A 114 5.534 1.816 -2.127 1.00 0.85 H new ATOM 0 HD12 ILE A 114 5.866 3.348 -1.284 1.00 0.85 H new ATOM 0 HD13 ILE A 114 6.421 1.808 -0.584 1.00 0.85 H new ATOM 1726 N ASN A 115 2.204 3.307 3.888 1.00 0.26 N ATOM 1727 CA ASN A 115 1.943 4.231 4.980 1.00 0.31 C ATOM 1728 C ASN A 115 3.100 4.221 5.974 1.00 0.37 C ATOM 1729 O ASN A 115 3.930 3.314 5.952 1.00 0.39 O ATOM 1730 CB ASN A 115 0.627 3.847 5.676 1.00 0.39 C ATOM 1731 CG ASN A 115 0.209 4.819 6.771 1.00 0.47 C ATOM 1732 OD1 ASN A 115 0.485 6.020 6.704 1.00 0.60 O ATOM 1733 ND2 ASN A 115 -0.459 4.300 7.789 1.00 0.69 N ATOM 0 H ASN A 115 1.791 2.382 4.005 1.00 0.26 H new ATOM 0 HA ASN A 115 1.850 5.241 4.580 1.00 0.31 H new ATOM 0 HB2 ASN A 115 -0.166 3.791 4.930 1.00 0.39 H new ATOM 0 HB3 ASN A 115 0.731 2.851 6.106 1.00 0.39 H new ATOM 0 HD21 ASN A 115 -0.766 4.898 8.556 1.00 0.69 H new ATOM 0 HD22 ASN A 115 -0.667 3.302 7.806 1.00 0.69 H new ATOM 1740 N LYS A 116 3.149 5.246 6.822 1.00 0.49 N ATOM 1741 CA LYS A 116 4.129 5.346 7.902 1.00 0.62 C ATOM 1742 C LYS A 116 5.523 5.678 7.386 1.00 0.57 C ATOM 1743 O LYS A 116 6.515 5.129 7.858 1.00 0.67 O ATOM 1744 CB LYS A 116 4.174 4.063 8.743 1.00 0.78 C ATOM 1745 CG LYS A 116 2.866 3.738 9.449 1.00 1.15 C ATOM 1746 CD LYS A 116 3.017 2.511 10.328 1.00 1.50 C ATOM 1747 CE LYS A 116 1.728 2.176 11.059 1.00 2.05 C ATOM 1748 NZ LYS A 116 1.931 1.099 12.062 1.00 2.61 N ATOM 0 H LYS A 116 2.505 6.036 6.779 1.00 0.49 H new ATOM 0 HA LYS A 116 3.800 6.169 8.537 1.00 0.62 H new ATOM 0 HB2 LYS A 116 4.444 3.227 8.097 1.00 0.78 H new ATOM 0 HB3 LYS A 116 4.963 4.157 9.489 1.00 0.78 H new ATOM 0 HG2 LYS A 116 2.554 4.589 10.055 1.00 1.15 H new ATOM 0 HG3 LYS A 116 2.082 3.568 8.711 1.00 1.15 H new ATOM 0 HD2 LYS A 116 3.319 1.661 9.716 1.00 1.50 H new ATOM 0 HD3 LYS A 116 3.813 2.680 11.054 1.00 1.50 H new ATOM 0 HE2 LYS A 116 1.348 3.069 11.555 1.00 2.05 H new ATOM 0 HE3 LYS A 116 0.971 1.865 10.339 1.00 2.05 H new ATOM 0 HZ1 LYS A 116 1.030 0.897 12.541 1.00 2.61 H new ATOM 0 HZ2 LYS A 116 2.270 0.239 11.585 1.00 2.61 H new ATOM 0 HZ3 LYS A 116 2.635 1.406 12.763 1.00 2.61 H new ATOM 1762 N MET A 117 5.609 6.583 6.422 1.00 0.58 N ATOM 1763 CA MET A 117 6.905 7.103 6.001 1.00 0.69 C ATOM 1764 C MET A 117 7.158 8.402 6.733 1.00 0.81 C ATOM 1765 O MET A 117 8.104 9.131 6.448 1.00 1.03 O ATOM 1766 CB MET A 117 6.972 7.328 4.501 1.00 0.85 C ATOM 1767 CG MET A 117 5.963 6.497 3.749 1.00 0.81 C ATOM 1768 SD MET A 117 6.509 4.799 3.511 1.00 1.37 S ATOM 1769 CE MET A 117 7.789 5.047 2.290 1.00 0.65 C ATOM 0 H MET A 117 4.809 6.970 5.921 1.00 0.58 H new ATOM 0 HA MET A 117 7.671 6.367 6.245 1.00 0.69 H new ATOM 0 HB2 MET A 117 6.802 8.383 4.287 1.00 0.85 H new ATOM 0 HB3 MET A 117 7.974 7.088 4.145 1.00 0.85 H new ATOM 0 HG2 MET A 117 5.018 6.499 4.293 1.00 0.81 H new ATOM 0 HG3 MET A 117 5.773 6.954 2.778 1.00 0.81 H new ATOM 0 HE1 MET A 117 7.500 4.564 1.357 1.00 0.65 H new ATOM 0 HE2 MET A 117 7.926 6.115 2.119 1.00 0.65 H new ATOM 0 HE3 MET A 117 8.723 4.614 2.649 1.00 0.65 H new ATOM 1779 N ASP A 118 6.252 8.694 7.661 1.00 0.84 N ATOM 1780 CA ASP A 118 6.477 9.732 8.665 1.00 1.06 C ATOM 1781 C ASP A 118 7.585 9.260 9.603 1.00 1.10 C ATOM 1782 O ASP A 118 8.126 10.024 10.400 1.00 1.49 O ATOM 1783 CB ASP A 118 5.193 10.050 9.442 1.00 1.25 C ATOM 1784 CG ASP A 118 4.667 8.874 10.234 1.00 1.61 C ATOM 1785 OD1 ASP A 118 3.930 8.042 9.657 1.00 2.45 O ATOM 1786 OD2 ASP A 118 5.014 8.762 11.430 1.00 1.73 O ATOM 0 H ASP A 118 5.350 8.224 7.740 1.00 0.84 H new ATOM 0 HA ASP A 118 6.779 10.656 8.171 1.00 1.06 H new ATOM 0 HB2 ASP A 118 5.384 10.881 10.121 1.00 1.25 H new ATOM 0 HB3 ASP A 118 4.425 10.381 8.742 1.00 1.25 H new ATOM 1791 N LYS A 119 7.893 7.968 9.498 1.00 1.11 N ATOM 1792 CA LYS A 119 9.155 7.415 9.974 1.00 1.34 C ATOM 1793 C LYS A 119 10.256 7.939 9.016 1.00 1.43 C ATOM 1794 O LYS A 119 10.064 8.985 8.403 1.00 1.78 O ATOM 1795 CB LYS A 119 9.051 5.879 9.950 1.00 1.81 C ATOM 1796 CG LYS A 119 7.779 5.323 10.588 1.00 1.99 C ATOM 1797 CD LYS A 119 7.769 5.463 12.106 1.00 2.61 C ATOM 1798 CE LYS A 119 8.681 4.448 12.778 1.00 3.15 C ATOM 1799 NZ LYS A 119 8.256 3.042 12.523 1.00 3.70 N ATOM 0 H LYS A 119 7.272 7.276 9.079 1.00 1.11 H new ATOM 0 HA LYS A 119 9.392 7.713 10.995 1.00 1.34 H new ATOM 0 HB2 LYS A 119 9.102 5.540 8.915 1.00 1.81 H new ATOM 0 HB3 LYS A 119 9.915 5.460 10.466 1.00 1.81 H new ATOM 0 HG2 LYS A 119 6.914 5.841 10.174 1.00 1.99 H new ATOM 0 HG3 LYS A 119 7.676 4.270 10.324 1.00 1.99 H new ATOM 0 HD2 LYS A 119 8.084 6.470 12.379 1.00 2.61 H new ATOM 0 HD3 LYS A 119 6.751 5.336 12.475 1.00 2.61 H new ATOM 0 HE2 LYS A 119 9.701 4.587 12.419 1.00 3.15 H new ATOM 0 HE3 LYS A 119 8.694 4.631 13.852 1.00 3.15 H new ATOM 0 HZ1 LYS A 119 8.685 2.415 13.234 1.00 3.70 H new ATOM 0 HZ2 LYS A 119 7.220 2.976 12.583 1.00 3.70 H new ATOM 0 HZ3 LYS A 119 8.567 2.752 11.574 1.00 3.70 H new ATOM 1813 N PRO A 120 11.431 7.296 8.864 1.00 1.71 N ATOM 1814 CA PRO A 120 12.309 7.632 7.740 1.00 2.15 C ATOM 1815 C PRO A 120 11.579 7.463 6.404 1.00 2.06 C ATOM 1816 O PRO A 120 11.386 8.429 5.663 1.00 2.57 O ATOM 1817 CB PRO A 120 13.456 6.628 7.851 1.00 2.65 C ATOM 1818 CG PRO A 120 13.456 6.187 9.276 1.00 2.67 C ATOM 1819 CD PRO A 120 12.041 6.305 9.769 1.00 2.11 C ATOM 0 HA PRO A 120 12.647 8.668 7.774 1.00 2.15 H new ATOM 0 HB2 PRO A 120 13.306 5.784 7.178 1.00 2.65 H new ATOM 0 HB3 PRO A 120 14.407 7.086 7.581 1.00 2.65 H new ATOM 0 HG2 PRO A 120 13.811 5.160 9.362 1.00 2.67 H new ATOM 0 HG3 PRO A 120 14.126 6.807 9.872 1.00 2.67 H new ATOM 0 HD2 PRO A 120 11.521 5.348 9.723 1.00 2.11 H new ATOM 0 HD3 PRO A 120 12.006 6.637 10.807 1.00 2.11 H new ATOM 1827 N GLU A 121 11.148 6.219 6.157 1.00 1.72 N ATOM 1828 CA GLU A 121 10.431 5.797 4.940 1.00 1.80 C ATOM 1829 C GLU A 121 10.651 4.304 4.756 1.00 1.43 C ATOM 1830 O GLU A 121 10.034 3.656 3.914 1.00 2.12 O ATOM 1831 CB GLU A 121 10.931 6.533 3.691 1.00 2.45 C ATOM 1832 CG GLU A 121 12.328 6.127 3.243 1.00 2.79 C ATOM 1833 CD GLU A 121 12.782 6.872 2.007 1.00 3.60 C ATOM 1834 OE1 GLU A 121 12.189 6.664 0.931 1.00 4.03 O ATOM 1835 OE2 GLU A 121 13.730 7.680 2.107 1.00 3.92 O ATOM 0 H GLU A 121 11.291 5.454 6.816 1.00 1.72 H new ATOM 0 HA GLU A 121 9.374 6.035 5.061 1.00 1.80 H new ATOM 0 HB2 GLU A 121 10.233 6.353 2.873 1.00 2.45 H new ATOM 0 HB3 GLU A 121 10.922 7.605 3.887 1.00 2.45 H new ATOM 0 HG2 GLU A 121 13.033 6.311 4.053 1.00 2.79 H new ATOM 0 HG3 GLU A 121 12.345 5.056 3.043 1.00 2.79 H new ATOM 1842 N ALA A 122 11.541 3.790 5.593 1.00 0.99 N ATOM 1843 CA ALA A 122 12.038 2.420 5.512 1.00 1.09 C ATOM 1844 C ALA A 122 12.725 2.175 4.176 1.00 0.90 C ATOM 1845 O ALA A 122 13.928 2.398 4.046 1.00 1.24 O ATOM 1846 CB ALA A 122 10.938 1.401 5.764 1.00 1.47 C ATOM 0 H ALA A 122 11.947 4.322 6.363 1.00 0.99 H new ATOM 0 HA ALA A 122 12.776 2.290 6.303 1.00 1.09 H new ATOM 0 HB1 ALA A 122 11.351 0.395 5.694 1.00 1.47 H new ATOM 0 HB2 ALA A 122 10.521 1.554 6.760 1.00 1.47 H new ATOM 0 HB3 ALA A 122 10.152 1.523 5.019 1.00 1.47 H new ATOM 1852 N ASN A 123 11.952 1.762 3.178 1.00 0.59 N ATOM 1853 CA ASN A 123 12.482 1.543 1.838 1.00 0.57 C ATOM 1854 C ASN A 123 11.367 1.136 0.880 1.00 0.46 C ATOM 1855 O ASN A 123 11.056 -0.048 0.744 1.00 0.52 O ATOM 1856 CB ASN A 123 13.570 0.467 1.849 1.00 0.85 C ATOM 1857 CG ASN A 123 14.321 0.404 0.536 1.00 1.28 C ATOM 1858 OD1 ASN A 123 13.970 -0.358 -0.364 1.00 1.77 O ATOM 1859 ND2 ASN A 123 15.352 1.219 0.411 1.00 1.84 N ATOM 0 H ASN A 123 10.954 1.572 3.272 1.00 0.59 H new ATOM 0 HA ASN A 123 12.921 2.481 1.497 1.00 0.57 H new ATOM 0 HB2 ASN A 123 14.272 0.670 2.658 1.00 0.85 H new ATOM 0 HB3 ASN A 123 13.118 -0.503 2.055 1.00 0.85 H new ATOM 0 HD21 ASN A 123 15.890 1.232 -0.456 1.00 1.84 H new ATOM 0 HD22 ASN A 123 15.611 1.836 1.181 1.00 1.84 H new ATOM 1866 N PRO A 124 10.726 2.135 0.238 1.00 0.41 N ATOM 1867 CA PRO A 124 9.736 1.916 -0.820 1.00 0.47 C ATOM 1868 C PRO A 124 10.111 0.785 -1.777 1.00 0.42 C ATOM 1869 O PRO A 124 9.366 -0.172 -1.905 1.00 0.40 O ATOM 1870 CB PRO A 124 9.727 3.253 -1.552 1.00 0.66 C ATOM 1871 CG PRO A 124 10.011 4.261 -0.492 1.00 0.70 C ATOM 1872 CD PRO A 124 10.874 3.574 0.539 1.00 0.46 C ATOM 0 HA PRO A 124 8.771 1.614 -0.414 1.00 0.47 H new ATOM 0 HB2 PRO A 124 10.482 3.280 -2.338 1.00 0.66 H new ATOM 0 HB3 PRO A 124 8.764 3.438 -2.028 1.00 0.66 H new ATOM 0 HG2 PRO A 124 10.523 5.128 -0.910 1.00 0.70 H new ATOM 0 HG3 PRO A 124 9.086 4.622 -0.044 1.00 0.70 H new ATOM 0 HD2 PRO A 124 11.914 3.892 0.463 1.00 0.46 H new ATOM 0 HD3 PRO A 124 10.544 3.805 1.552 1.00 0.46 H new ATOM 1880 N ASP A 125 11.274 0.904 -2.426 1.00 0.45 N ATOM 1881 CA ASP A 125 11.765 -0.089 -3.408 1.00 0.45 C ATOM 1882 C ASP A 125 11.580 -1.516 -2.928 1.00 0.38 C ATOM 1883 O ASP A 125 11.080 -2.351 -3.671 1.00 0.33 O ATOM 1884 CB ASP A 125 13.249 0.137 -3.683 1.00 0.56 C ATOM 1885 CG ASP A 125 13.529 1.423 -4.436 1.00 1.16 C ATOM 1886 OD1 ASP A 125 13.140 2.502 -3.937 1.00 2.00 O ATOM 1887 OD2 ASP A 125 14.116 1.364 -5.537 1.00 1.28 O ATOM 0 H ASP A 125 11.908 1.691 -2.290 1.00 0.45 H new ATOM 0 HA ASP A 125 11.177 0.049 -4.315 1.00 0.45 H new ATOM 0 HB2 ASP A 125 13.789 0.153 -2.736 1.00 0.56 H new ATOM 0 HB3 ASP A 125 13.638 -0.704 -4.257 1.00 0.56 H new ATOM 1892 N ARG A 126 11.983 -1.789 -1.694 1.00 0.40 N ATOM 1893 CA ARG A 126 11.820 -3.117 -1.111 1.00 0.40 C ATOM 1894 C ARG A 126 10.374 -3.558 -1.234 1.00 0.34 C ATOM 1895 O ARG A 126 10.076 -4.608 -1.800 1.00 0.32 O ATOM 1896 CB ARG A 126 12.236 -3.098 0.360 1.00 0.47 C ATOM 1897 CG ARG A 126 12.174 -4.457 1.043 1.00 0.58 C ATOM 1898 CD ARG A 126 10.816 -4.706 1.685 1.00 1.25 C ATOM 1899 NE ARG A 126 10.824 -5.885 2.553 1.00 1.38 N ATOM 1900 CZ ARG A 126 9.810 -6.229 3.349 1.00 2.08 C ATOM 1901 NH1 ARG A 126 8.676 -5.540 3.321 1.00 2.99 N ATOM 1902 NH2 ARG A 126 9.920 -7.283 4.150 1.00 2.15 N ATOM 0 H ARG A 126 12.426 -1.109 -1.076 1.00 0.40 H new ATOM 0 HA ARG A 126 12.455 -3.821 -1.648 1.00 0.40 H new ATOM 0 HB2 ARG A 126 13.253 -2.713 0.434 1.00 0.47 H new ATOM 0 HB3 ARG A 126 11.592 -2.403 0.899 1.00 0.47 H new ATOM 0 HG2 ARG A 126 12.380 -5.240 0.313 1.00 0.58 H new ATOM 0 HG3 ARG A 126 12.952 -4.517 1.804 1.00 0.58 H new ATOM 0 HD2 ARG A 126 10.524 -3.831 2.266 1.00 1.25 H new ATOM 0 HD3 ARG A 126 10.065 -4.836 0.905 1.00 1.25 H new ATOM 0 HE ARG A 126 11.654 -6.478 2.549 1.00 1.38 H new ATOM 0 HH11 ARG A 126 8.578 -4.745 2.690 1.00 2.99 H new ATOM 0 HH12 ARG A 126 7.903 -5.806 3.931 1.00 2.99 H new ATOM 0 HH21 ARG A 126 10.781 -7.831 4.157 1.00 2.15 H new ATOM 0 HH22 ARG A 126 9.144 -7.545 4.758 1.00 2.15 H new ATOM 1916 N VAL A 127 9.494 -2.722 -0.718 1.00 0.34 N ATOM 1917 CA VAL A 127 8.057 -2.977 -0.769 1.00 0.34 C ATOM 1918 C VAL A 127 7.592 -3.080 -2.221 1.00 0.31 C ATOM 1919 O VAL A 127 6.840 -3.977 -2.587 1.00 0.33 O ATOM 1920 CB VAL A 127 7.265 -1.859 -0.058 1.00 0.37 C ATOM 1921 CG1 VAL A 127 5.771 -2.156 -0.070 1.00 0.39 C ATOM 1922 CG2 VAL A 127 7.767 -1.669 1.365 1.00 0.40 C ATOM 0 H VAL A 127 9.747 -1.850 -0.253 1.00 0.34 H new ATOM 0 HA VAL A 127 7.868 -3.919 -0.254 1.00 0.34 H new ATOM 0 HB VAL A 127 7.426 -0.930 -0.605 1.00 0.37 H new ATOM 0 HG11 VAL A 127 5.236 -1.353 0.437 1.00 0.39 H new ATOM 0 HG12 VAL A 127 5.423 -2.230 -1.100 1.00 0.39 H new ATOM 0 HG13 VAL A 127 5.583 -3.098 0.445 1.00 0.39 H new ATOM 0 HG21 VAL A 127 7.196 -0.877 1.849 1.00 0.40 H new ATOM 0 HG22 VAL A 127 7.643 -2.598 1.922 1.00 0.40 H new ATOM 0 HG23 VAL A 127 8.822 -1.396 1.345 1.00 0.40 H new ATOM 1932 N MET A 128 8.089 -2.164 -3.043 1.00 0.28 N ATOM 1933 CA MET A 128 7.721 -2.093 -4.452 1.00 0.26 C ATOM 1934 C MET A 128 8.131 -3.365 -5.191 1.00 0.25 C ATOM 1935 O MET A 128 7.463 -3.794 -6.136 1.00 0.25 O ATOM 1936 CB MET A 128 8.380 -0.872 -5.110 1.00 0.25 C ATOM 1937 CG MET A 128 8.085 0.448 -4.414 1.00 0.27 C ATOM 1938 SD MET A 128 9.014 1.840 -5.096 1.00 0.30 S ATOM 1939 CE MET A 128 8.134 2.112 -6.629 1.00 0.29 C ATOM 0 H MET A 128 8.757 -1.450 -2.753 1.00 0.28 H new ATOM 0 HA MET A 128 6.637 -1.994 -4.514 1.00 0.26 H new ATOM 0 HB2 MET A 128 9.459 -1.024 -5.133 1.00 0.25 H new ATOM 0 HB3 MET A 128 8.045 -0.807 -6.145 1.00 0.25 H new ATOM 0 HG2 MET A 128 7.019 0.660 -4.490 1.00 0.27 H new ATOM 0 HG3 MET A 128 8.316 0.351 -3.353 1.00 0.27 H new ATOM 0 HE1 MET A 128 8.847 2.323 -7.426 1.00 0.29 H new ATOM 0 HE2 MET A 128 7.560 1.220 -6.882 1.00 0.29 H new ATOM 0 HE3 MET A 128 7.457 2.959 -6.515 1.00 0.29 H new ATOM 1949 N GLN A 129 9.225 -3.978 -4.750 1.00 0.25 N ATOM 1950 CA GLN A 129 9.736 -5.176 -5.392 1.00 0.26 C ATOM 1951 C GLN A 129 8.888 -6.379 -5.021 1.00 0.29 C ATOM 1952 O GLN A 129 8.813 -7.350 -5.771 1.00 0.31 O ATOM 1953 CB GLN A 129 11.199 -5.399 -5.013 1.00 0.29 C ATOM 1954 CG GLN A 129 12.157 -4.470 -5.745 1.00 0.31 C ATOM 1955 CD GLN A 129 13.498 -4.325 -5.048 1.00 0.46 C ATOM 1956 OE1 GLN A 129 14.148 -3.280 -5.140 1.00 1.16 O ATOM 1957 NE2 GLN A 129 13.922 -5.364 -4.345 1.00 1.28 N ATOM 0 H GLN A 129 9.773 -3.662 -3.950 1.00 0.25 H new ATOM 0 HA GLN A 129 9.682 -5.045 -6.473 1.00 0.26 H new ATOM 0 HB2 GLN A 129 11.315 -5.256 -3.939 1.00 0.29 H new ATOM 0 HB3 GLN A 129 11.470 -6.433 -5.228 1.00 0.29 H new ATOM 0 HG2 GLN A 129 12.318 -4.847 -6.755 1.00 0.31 H new ATOM 0 HG3 GLN A 129 11.697 -3.487 -5.842 1.00 0.31 H new ATOM 0 HE21 GLN A 129 13.355 -6.210 -4.293 1.00 1.28 H new ATOM 0 HE22 GLN A 129 14.815 -5.318 -3.855 1.00 1.28 H new ATOM 1966 N GLU A 130 8.229 -6.304 -3.874 1.00 0.33 N ATOM 1967 CA GLU A 130 7.298 -7.346 -3.479 1.00 0.38 C ATOM 1968 C GLU A 130 6.034 -7.222 -4.303 1.00 0.33 C ATOM 1969 O GLU A 130 5.385 -8.210 -4.626 1.00 0.36 O ATOM 1970 CB GLU A 130 6.932 -7.245 -2.006 1.00 0.48 C ATOM 1971 CG GLU A 130 8.054 -6.768 -1.119 1.00 0.71 C ATOM 1972 CD GLU A 130 7.676 -6.788 0.349 1.00 1.18 C ATOM 1973 OE1 GLU A 130 7.091 -5.794 0.832 1.00 2.02 O ATOM 1974 OE2 GLU A 130 7.953 -7.808 1.023 1.00 1.46 O ATOM 0 H GLU A 130 8.322 -5.538 -3.206 1.00 0.33 H new ATOM 0 HA GLU A 130 7.781 -8.309 -3.648 1.00 0.38 H new ATOM 0 HB2 GLU A 130 6.086 -6.565 -1.900 1.00 0.48 H new ATOM 0 HB3 GLU A 130 6.600 -8.223 -1.658 1.00 0.48 H new ATOM 0 HG2 GLU A 130 8.930 -7.398 -1.275 1.00 0.71 H new ATOM 0 HG3 GLU A 130 8.335 -5.755 -1.406 1.00 0.71 H new ATOM 1981 N LEU A 131 5.687 -5.996 -4.665 1.00 0.29 N ATOM 1982 CA LEU A 131 4.502 -5.787 -5.474 1.00 0.29 C ATOM 1983 C LEU A 131 4.736 -6.315 -6.862 1.00 0.24 C ATOM 1984 O LEU A 131 3.898 -7.014 -7.426 1.00 0.25 O ATOM 1985 CB LEU A 131 4.103 -4.315 -5.520 1.00 0.32 C ATOM 1986 CG LEU A 131 3.166 -3.895 -4.397 1.00 0.48 C ATOM 1987 CD1 LEU A 131 1.969 -4.810 -4.383 1.00 0.34 C ATOM 1988 CD2 LEU A 131 3.877 -3.964 -3.070 1.00 1.06 C ATOM 0 H LEU A 131 6.198 -5.149 -4.417 1.00 0.29 H new ATOM 0 HA LEU A 131 3.677 -6.332 -5.015 1.00 0.29 H new ATOM 0 HB2 LEU A 131 5.004 -3.703 -5.476 1.00 0.32 H new ATOM 0 HB3 LEU A 131 3.623 -4.108 -6.477 1.00 0.32 H new ATOM 0 HG LEU A 131 2.842 -2.868 -4.565 1.00 0.48 H new ATOM 0 HD11 LEU A 131 1.294 -4.514 -3.580 1.00 0.34 H new ATOM 0 HD12 LEU A 131 1.448 -4.743 -5.338 1.00 0.34 H new ATOM 0 HD13 LEU A 131 2.298 -5.837 -4.221 1.00 0.34 H new ATOM 0 HD21 LEU A 131 3.195 -3.661 -2.276 1.00 1.06 H new ATOM 0 HD22 LEU A 131 4.213 -4.985 -2.890 1.00 1.06 H new ATOM 0 HD23 LEU A 131 4.738 -3.296 -3.083 1.00 1.06 H new ATOM 2000 N MET A 132 5.904 -6.026 -7.388 1.00 0.21 N ATOM 2001 CA MET A 132 6.272 -6.530 -8.687 1.00 0.22 C ATOM 2002 C MET A 132 6.619 -8.011 -8.592 1.00 0.26 C ATOM 2003 O MET A 132 6.832 -8.674 -9.605 1.00 0.32 O ATOM 2004 CB MET A 132 7.420 -5.717 -9.261 1.00 0.23 C ATOM 2005 CG MET A 132 8.798 -6.098 -8.749 1.00 0.26 C ATOM 2006 SD MET A 132 9.691 -7.097 -9.944 1.00 0.35 S ATOM 2007 CE MET A 132 9.195 -6.262 -11.450 1.00 0.32 C ATOM 0 H MET A 132 6.612 -5.447 -6.937 1.00 0.21 H new ATOM 0 HA MET A 132 5.427 -6.429 -9.368 1.00 0.22 H new ATOM 0 HB2 MET A 132 7.411 -5.820 -10.346 1.00 0.23 H new ATOM 0 HB3 MET A 132 7.245 -4.664 -9.040 1.00 0.23 H new ATOM 0 HG2 MET A 132 9.368 -5.195 -8.529 1.00 0.26 H new ATOM 0 HG3 MET A 132 8.700 -6.649 -7.813 1.00 0.26 H new ATOM 0 HE1 MET A 132 9.921 -6.468 -12.236 1.00 0.32 H new ATOM 0 HE2 MET A 132 8.214 -6.622 -11.759 1.00 0.32 H new ATOM 0 HE3 MET A 132 9.148 -5.188 -11.272 1.00 0.32 H new ATOM 2017 N GLU A 133 6.639 -8.537 -7.367 1.00 0.27 N ATOM 2018 CA GLU A 133 6.744 -9.970 -7.162 1.00 0.35 C ATOM 2019 C GLU A 133 5.428 -10.590 -7.584 1.00 0.34 C ATOM 2020 O GLU A 133 5.392 -11.684 -8.140 1.00 0.40 O ATOM 2021 CB GLU A 133 7.056 -10.294 -5.697 1.00 0.44 C ATOM 2022 CG GLU A 133 6.868 -11.757 -5.311 1.00 0.67 C ATOM 2023 CD GLU A 133 7.879 -12.679 -5.956 1.00 1.30 C ATOM 2024 OE1 GLU A 133 9.079 -12.567 -5.629 1.00 1.55 O ATOM 2025 OE2 GLU A 133 7.478 -13.535 -6.774 1.00 2.18 O ATOM 0 H GLU A 133 6.584 -7.989 -6.508 1.00 0.27 H new ATOM 0 HA GLU A 133 7.562 -10.377 -7.757 1.00 0.35 H new ATOM 0 HB2 GLU A 133 8.087 -10.007 -5.488 1.00 0.44 H new ATOM 0 HB3 GLU A 133 6.419 -9.680 -5.060 1.00 0.44 H new ATOM 0 HG2 GLU A 133 6.939 -11.852 -4.227 1.00 0.67 H new ATOM 0 HG3 GLU A 133 5.864 -12.074 -5.594 1.00 0.67 H new ATOM 2032 N TYR A 134 4.334 -9.867 -7.353 1.00 0.30 N ATOM 2033 CA TYR A 134 3.053 -10.302 -7.865 1.00 0.34 C ATOM 2034 C TYR A 134 2.820 -9.690 -9.245 1.00 0.36 C ATOM 2035 O TYR A 134 1.693 -9.566 -9.715 1.00 0.44 O ATOM 2036 CB TYR A 134 1.981 -9.959 -6.852 1.00 0.32 C ATOM 2037 CG TYR A 134 2.391 -10.457 -5.483 1.00 0.37 C ATOM 2038 CD1 TYR A 134 2.467 -11.820 -5.225 1.00 0.51 C ATOM 2039 CD2 TYR A 134 2.793 -9.580 -4.489 1.00 0.37 C ATOM 2040 CE1 TYR A 134 2.918 -12.291 -4.011 1.00 0.61 C ATOM 2041 CE2 TYR A 134 3.263 -10.043 -3.277 1.00 0.49 C ATOM 2042 CZ TYR A 134 3.318 -11.401 -3.040 1.00 0.57 C ATOM 2043 OH TYR A 134 3.809 -11.874 -1.846 1.00 0.74 O ATOM 0 H TYR A 134 4.315 -8.995 -6.824 1.00 0.30 H new ATOM 0 HA TYR A 134 3.024 -11.383 -8.004 1.00 0.34 H new ATOM 0 HB2 TYR A 134 1.825 -8.881 -6.825 1.00 0.32 H new ATOM 0 HB3 TYR A 134 1.033 -10.411 -7.145 1.00 0.32 H new ATOM 0 HD1 TYR A 134 2.168 -12.522 -5.989 1.00 0.51 H new ATOM 0 HD2 TYR A 134 2.738 -8.516 -4.666 1.00 0.37 H new ATOM 0 HE1 TYR A 134 2.957 -13.354 -3.822 1.00 0.61 H new ATOM 0 HE2 TYR A 134 3.586 -9.346 -2.518 1.00 0.49 H new ATOM 0 HH TYR A 134 4.048 -11.119 -1.269 1.00 0.74 H new ATOM 2053 N ASN A 135 3.943 -9.305 -9.873 1.00 0.35 N ATOM 2054 CA ASN A 135 3.984 -8.778 -11.237 1.00 0.38 C ATOM 2055 C ASN A 135 3.191 -7.491 -11.309 1.00 0.42 C ATOM 2056 O ASN A 135 2.627 -7.125 -12.336 1.00 0.59 O ATOM 2057 CB ASN A 135 3.469 -9.812 -12.252 1.00 0.47 C ATOM 2058 CG ASN A 135 3.719 -9.409 -13.699 1.00 1.19 C ATOM 2059 OD1 ASN A 135 4.847 -8.761 -13.956 1.00 1.94 O flip ATOM 2060 ND2 ASN A 135 2.921 -9.711 -14.585 1.00 1.89 N flip ATOM 0 H ASN A 135 4.862 -9.354 -9.434 1.00 0.35 H new ATOM 0 HA ASN A 135 5.020 -8.565 -11.500 1.00 0.38 H new ATOM 0 HB2 ASN A 135 3.951 -10.771 -12.060 1.00 0.47 H new ATOM 0 HB3 ASN A 135 2.399 -9.957 -12.102 1.00 0.47 H new ATOM 0 HD21 ASN A 135 2.063 -10.210 -14.350 1.00 1.89 H new ATOM 0 HD22 ASN A 135 3.117 -9.463 -15.555 1.00 1.89 H new ATOM 2067 N LEU A 136 3.167 -6.806 -10.191 1.00 0.38 N ATOM 2068 CA LEU A 136 2.536 -5.525 -10.100 1.00 0.46 C ATOM 2069 C LEU A 136 3.599 -4.453 -10.147 1.00 0.39 C ATOM 2070 O LEU A 136 3.931 -3.829 -9.139 1.00 0.43 O ATOM 2071 CB LEU A 136 1.717 -5.448 -8.836 1.00 0.62 C ATOM 2072 CG LEU A 136 0.598 -6.475 -8.755 1.00 0.89 C ATOM 2073 CD1 LEU A 136 0.249 -6.751 -7.312 1.00 1.68 C ATOM 2074 CD2 LEU A 136 -0.625 -5.995 -9.521 1.00 1.44 C ATOM 0 H LEU A 136 3.588 -7.128 -9.320 1.00 0.38 H new ATOM 0 HA LEU A 136 1.857 -5.373 -10.939 1.00 0.46 H new ATOM 0 HB2 LEU A 136 2.378 -5.579 -7.979 1.00 0.62 H new ATOM 0 HB3 LEU A 136 1.286 -4.450 -8.756 1.00 0.62 H new ATOM 0 HG LEU A 136 0.942 -7.403 -9.213 1.00 0.89 H new ATOM 0 HD11 LEU A 136 -0.553 -7.488 -7.266 1.00 1.68 H new ATOM 0 HD12 LEU A 136 1.126 -7.137 -6.793 1.00 1.68 H new ATOM 0 HD13 LEU A 136 -0.078 -5.828 -6.834 1.00 1.68 H new ATOM 0 HD21 LEU A 136 -1.415 -6.743 -9.451 1.00 1.44 H new ATOM 0 HD22 LEU A 136 -0.976 -5.056 -9.094 1.00 1.44 H new ATOM 0 HD23 LEU A 136 -0.362 -5.842 -10.568 1.00 1.44 H new ATOM 2086 N VAL A 137 4.176 -4.307 -11.326 1.00 0.33 N ATOM 2087 CA VAL A 137 5.235 -3.345 -11.545 1.00 0.27 C ATOM 2088 C VAL A 137 4.719 -1.937 -11.358 1.00 0.26 C ATOM 2089 O VAL A 137 3.749 -1.530 -11.985 1.00 0.27 O ATOM 2090 CB VAL A 137 5.850 -3.454 -12.951 1.00 0.27 C ATOM 2091 CG1 VAL A 137 7.332 -3.777 -12.848 1.00 0.61 C ATOM 2092 CG2 VAL A 137 5.116 -4.491 -13.793 1.00 0.49 C ATOM 0 H VAL A 137 3.924 -4.849 -12.152 1.00 0.33 H new ATOM 0 HA VAL A 137 6.009 -3.570 -10.811 1.00 0.27 H new ATOM 0 HB VAL A 137 5.741 -2.493 -13.453 1.00 0.27 H new ATOM 0 HG11 VAL A 137 7.758 -3.852 -13.848 1.00 0.61 H new ATOM 0 HG12 VAL A 137 7.839 -2.986 -12.296 1.00 0.61 H new ATOM 0 HG13 VAL A 137 7.462 -4.725 -12.326 1.00 0.61 H new ATOM 0 HG21 VAL A 137 5.572 -4.546 -14.781 1.00 0.49 H new ATOM 0 HG22 VAL A 137 5.181 -5.465 -13.308 1.00 0.49 H new ATOM 0 HG23 VAL A 137 4.069 -4.204 -13.892 1.00 0.49 H new ATOM 2102 N PRO A 138 5.353 -1.197 -10.453 1.00 0.25 N ATOM 2103 CA PRO A 138 5.071 0.217 -10.235 1.00 0.27 C ATOM 2104 C PRO A 138 5.002 1.016 -11.520 1.00 0.30 C ATOM 2105 O PRO A 138 5.571 0.644 -12.545 1.00 0.29 O ATOM 2106 CB PRO A 138 6.269 0.695 -9.439 1.00 0.30 C ATOM 2107 CG PRO A 138 6.752 -0.498 -8.709 1.00 0.29 C ATOM 2108 CD PRO A 138 6.368 -1.708 -9.521 1.00 0.27 C ATOM 0 HA PRO A 138 4.105 0.348 -9.748 1.00 0.27 H new ATOM 0 HB2 PRO A 138 7.043 1.095 -10.094 1.00 0.30 H new ATOM 0 HB3 PRO A 138 5.991 1.492 -8.750 1.00 0.30 H new ATOM 0 HG2 PRO A 138 7.833 -0.454 -8.573 1.00 0.29 H new ATOM 0 HG3 PRO A 138 6.308 -0.546 -7.715 1.00 0.29 H new ATOM 0 HD2 PRO A 138 7.225 -2.122 -10.051 1.00 0.27 H new ATOM 0 HD3 PRO A 138 5.969 -2.502 -8.891 1.00 0.27 H new ATOM 2116 N GLU A 139 4.332 2.140 -11.428 1.00 0.35 N ATOM 2117 CA GLU A 139 4.225 3.075 -12.536 1.00 0.40 C ATOM 2118 C GLU A 139 5.538 3.819 -12.673 1.00 0.42 C ATOM 2119 O GLU A 139 5.882 4.318 -13.744 1.00 0.50 O ATOM 2120 CB GLU A 139 3.071 4.034 -12.297 1.00 0.47 C ATOM 2121 CG GLU A 139 1.924 3.870 -13.285 1.00 0.80 C ATOM 2122 CD GLU A 139 2.289 4.318 -14.688 1.00 1.49 C ATOM 2123 OE1 GLU A 139 3.052 3.606 -15.366 1.00 2.01 O ATOM 2124 OE2 GLU A 139 1.811 5.392 -15.118 1.00 1.98 O ATOM 0 H GLU A 139 3.843 2.438 -10.584 1.00 0.35 H new ATOM 0 HA GLU A 139 4.023 2.539 -13.463 1.00 0.40 H new ATOM 0 HB2 GLU A 139 2.692 3.887 -11.286 1.00 0.47 H new ATOM 0 HB3 GLU A 139 3.443 5.057 -12.352 1.00 0.47 H new ATOM 0 HG2 GLU A 139 1.619 2.824 -13.310 1.00 0.80 H new ATOM 0 HG3 GLU A 139 1.065 4.444 -12.937 1.00 0.80 H new ATOM 2131 N GLU A 140 6.241 3.912 -11.549 1.00 0.42 N ATOM 2132 CA GLU A 140 7.656 4.206 -11.532 1.00 0.44 C ATOM 2133 C GLU A 140 8.381 3.393 -12.571 1.00 0.43 C ATOM 2134 O GLU A 140 9.145 3.906 -13.385 1.00 0.51 O ATOM 2135 CB GLU A 140 8.227 3.786 -10.189 1.00 0.45 C ATOM 2136 CG GLU A 140 8.168 4.830 -9.133 1.00 0.75 C ATOM 2137 CD GLU A 140 6.755 5.240 -8.787 1.00 0.87 C ATOM 2138 OE1 GLU A 140 5.878 4.357 -8.697 1.00 1.01 O ATOM 2139 OE2 GLU A 140 6.523 6.452 -8.584 1.00 1.14 O ATOM 0 H GLU A 140 5.835 3.783 -10.622 1.00 0.42 H new ATOM 0 HA GLU A 140 7.783 5.272 -11.723 1.00 0.44 H new ATOM 0 HB2 GLU A 140 7.688 2.905 -9.840 1.00 0.45 H new ATOM 0 HB3 GLU A 140 9.266 3.489 -10.329 1.00 0.45 H new ATOM 0 HG2 GLU A 140 8.663 4.460 -8.235 1.00 0.75 H new ATOM 0 HG3 GLU A 140 8.724 5.707 -9.465 1.00 0.75 H new ATOM 2146 N TRP A 141 8.121 2.103 -12.519 1.00 0.35 N ATOM 2147 CA TRP A 141 8.943 1.148 -13.218 1.00 0.35 C ATOM 2148 C TRP A 141 8.356 0.814 -14.584 1.00 0.38 C ATOM 2149 O TRP A 141 9.076 0.402 -15.491 1.00 0.45 O ATOM 2150 CB TRP A 141 9.156 -0.096 -12.376 1.00 0.32 C ATOM 2151 CG TRP A 141 9.631 0.169 -10.955 1.00 0.29 C ATOM 2152 CD1 TRP A 141 9.985 1.370 -10.362 1.00 0.34 C ATOM 2153 CD2 TRP A 141 9.774 -0.820 -9.930 1.00 0.25 C ATOM 2154 NE1 TRP A 141 10.325 1.161 -9.049 1.00 0.31 N ATOM 2155 CE2 TRP A 141 10.208 -0.166 -8.762 1.00 0.26 C ATOM 2156 CE3 TRP A 141 9.576 -2.196 -9.893 1.00 0.23 C ATOM 2157 CZ2 TRP A 141 10.431 -0.843 -7.566 1.00 0.24 C ATOM 2158 CZ3 TRP A 141 9.791 -2.871 -8.706 1.00 0.23 C ATOM 2159 CH2 TRP A 141 10.217 -2.192 -7.552 1.00 0.23 C ATOM 0 H TRP A 141 7.345 1.695 -11.998 1.00 0.35 H new ATOM 0 HA TRP A 141 9.920 1.599 -13.390 1.00 0.35 H new ATOM 0 HB2 TRP A 141 8.220 -0.653 -12.333 1.00 0.32 H new ATOM 0 HB3 TRP A 141 9.885 -0.735 -12.875 1.00 0.32 H new ATOM 0 HD1 TRP A 141 9.992 2.329 -10.859 1.00 0.34 H new ATOM 0 HE1 TRP A 141 10.619 1.884 -8.392 1.00 0.31 H new ATOM 0 HE3 TRP A 141 9.259 -2.729 -10.777 1.00 0.23 H new ATOM 0 HZ2 TRP A 141 10.761 -0.320 -6.681 1.00 0.24 H new ATOM 0 HZ3 TRP A 141 9.629 -3.938 -8.665 1.00 0.23 H new ATOM 0 HH2 TRP A 141 10.378 -2.746 -6.639 1.00 0.23 H new ATOM 2170 N GLY A 142 7.049 0.996 -14.736 1.00 0.35 N ATOM 2171 CA GLY A 142 6.453 0.899 -16.052 1.00 0.39 C ATOM 2172 C GLY A 142 5.476 -0.239 -16.153 1.00 0.38 C ATOM 2173 O GLY A 142 5.277 -0.805 -17.227 1.00 0.45 O ATOM 0 H GLY A 142 6.399 1.207 -13.979 1.00 0.35 H new ATOM 0 HA2 GLY A 142 5.944 1.834 -16.288 1.00 0.39 H new ATOM 0 HA3 GLY A 142 7.239 0.767 -16.796 1.00 0.39 H new ATOM 2177 N GLY A 143 4.883 -0.592 -15.032 1.00 0.33 N ATOM 2178 CA GLY A 143 3.886 -1.634 -15.034 1.00 0.34 C ATOM 2179 C GLY A 143 2.481 -1.090 -14.936 1.00 0.37 C ATOM 2180 O GLY A 143 2.020 -0.372 -15.823 1.00 0.50 O ATOM 0 H GLY A 143 5.073 -0.177 -14.120 1.00 0.33 H new ATOM 0 HA2 GLY A 143 3.982 -2.222 -15.947 1.00 0.34 H new ATOM 0 HA3 GLY A 143 4.070 -2.310 -14.199 1.00 0.34 H new ATOM 2184 N ASP A 144 1.808 -1.419 -13.846 1.00 0.33 N ATOM 2185 CA ASP A 144 0.420 -1.017 -13.649 1.00 0.40 C ATOM 2186 C ASP A 144 0.092 -0.883 -12.165 1.00 0.30 C ATOM 2187 O ASP A 144 -1.031 -1.170 -11.717 1.00 0.32 O ATOM 2188 CB ASP A 144 -0.537 -2.012 -14.328 1.00 0.57 C ATOM 2189 CG ASP A 144 -0.402 -3.437 -13.804 1.00 0.93 C ATOM 2190 OD1 ASP A 144 0.601 -4.107 -14.146 1.00 1.19 O ATOM 2191 OD2 ASP A 144 -1.297 -3.894 -13.062 1.00 1.30 O ATOM 0 H ASP A 144 2.200 -1.966 -13.079 1.00 0.33 H new ATOM 0 HA ASP A 144 0.286 -0.040 -14.113 1.00 0.40 H new ATOM 0 HB2 ASP A 144 -1.563 -1.675 -14.182 1.00 0.57 H new ATOM 0 HB3 ASP A 144 -0.350 -2.009 -15.402 1.00 0.57 H new ATOM 2196 N THR A 145 1.069 -0.439 -11.392 1.00 0.25 N ATOM 2197 CA THR A 145 0.854 -0.268 -9.964 1.00 0.24 C ATOM 2198 C THR A 145 1.318 1.104 -9.482 1.00 0.24 C ATOM 2199 O THR A 145 2.505 1.423 -9.511 1.00 0.31 O ATOM 2200 CB THR A 145 1.555 -1.386 -9.179 1.00 0.25 C ATOM 2201 OG1 THR A 145 1.187 -2.647 -9.747 1.00 0.32 O ATOM 2202 CG2 THR A 145 1.161 -1.365 -7.711 1.00 0.28 C ATOM 0 H THR A 145 2.003 -0.194 -11.721 1.00 0.25 H new ATOM 0 HA THR A 145 -0.219 -0.331 -9.781 1.00 0.24 H new ATOM 0 HB THR A 145 2.632 -1.232 -9.243 1.00 0.25 H new ATOM 0 HG1 THR A 145 0.246 -2.833 -9.548 1.00 0.32 H new ATOM 0 HG21 THR A 145 1.675 -2.169 -7.185 1.00 0.28 H new ATOM 0 HG22 THR A 145 1.441 -0.407 -7.273 1.00 0.28 H new ATOM 0 HG23 THR A 145 0.084 -1.503 -7.621 1.00 0.28 H new ATOM 2210 N ILE A 146 0.367 1.912 -9.040 1.00 0.26 N ATOM 2211 CA ILE A 146 0.647 3.276 -8.617 1.00 0.27 C ATOM 2212 C ILE A 146 1.101 3.298 -7.160 1.00 0.24 C ATOM 2213 O ILE A 146 0.313 3.038 -6.252 1.00 0.26 O ATOM 2214 CB ILE A 146 -0.588 4.198 -8.786 1.00 0.35 C ATOM 2215 CG1 ILE A 146 -0.978 4.348 -10.264 1.00 0.48 C ATOM 2216 CG2 ILE A 146 -0.316 5.563 -8.177 1.00 0.34 C ATOM 2217 CD1 ILE A 146 -1.698 3.149 -10.850 1.00 1.23 C ATOM 0 H ILE A 146 -0.614 1.644 -8.964 1.00 0.26 H new ATOM 0 HA ILE A 146 1.444 3.654 -9.257 1.00 0.27 H new ATOM 0 HB ILE A 146 -1.423 3.733 -8.262 1.00 0.35 H new ATOM 0 HG12 ILE A 146 -1.615 5.226 -10.371 1.00 0.48 H new ATOM 0 HG13 ILE A 146 -0.076 4.535 -10.847 1.00 0.48 H new ATOM 0 HG21 ILE A 146 -1.192 6.199 -8.304 1.00 0.34 H new ATOM 0 HG22 ILE A 146 -0.099 5.451 -7.115 1.00 0.34 H new ATOM 0 HG23 ILE A 146 0.539 6.020 -8.675 1.00 0.34 H new ATOM 0 HD11 ILE A 146 -1.935 3.342 -11.896 1.00 1.23 H new ATOM 0 HD12 ILE A 146 -1.058 2.270 -10.779 1.00 1.23 H new ATOM 0 HD13 ILE A 146 -2.620 2.972 -10.296 1.00 1.23 H new ATOM 2229 N PHE A 147 2.367 3.609 -6.946 1.00 0.23 N ATOM 2230 CA PHE A 147 2.943 3.615 -5.608 1.00 0.22 C ATOM 2231 C PHE A 147 2.850 4.988 -4.971 1.00 0.24 C ATOM 2232 O PHE A 147 3.125 6.010 -5.605 1.00 0.38 O ATOM 2233 CB PHE A 147 4.398 3.160 -5.648 1.00 0.23 C ATOM 2234 CG PHE A 147 4.534 1.676 -5.541 1.00 0.21 C ATOM 2235 CD1 PHE A 147 4.344 0.868 -6.646 1.00 0.20 C ATOM 2236 CD2 PHE A 147 4.823 1.086 -4.325 1.00 0.21 C ATOM 2237 CE1 PHE A 147 4.442 -0.505 -6.539 1.00 0.20 C ATOM 2238 CE2 PHE A 147 4.918 -0.285 -4.211 1.00 0.22 C ATOM 2239 CZ PHE A 147 4.731 -1.081 -5.322 1.00 0.19 C ATOM 0 H PHE A 147 3.022 3.863 -7.686 1.00 0.23 H new ATOM 0 HA PHE A 147 2.367 2.917 -5.001 1.00 0.22 H new ATOM 0 HB2 PHE A 147 4.856 3.498 -6.578 1.00 0.23 H new ATOM 0 HB3 PHE A 147 4.946 3.632 -4.833 1.00 0.23 H new ATOM 0 HD1 PHE A 147 4.117 1.315 -7.603 1.00 0.20 H new ATOM 0 HD2 PHE A 147 4.976 1.706 -3.454 1.00 0.21 H new ATOM 0 HE1 PHE A 147 4.292 -1.127 -7.409 1.00 0.20 H new ATOM 0 HE2 PHE A 147 5.138 -0.735 -3.254 1.00 0.22 H new ATOM 0 HZ PHE A 147 4.811 -2.155 -5.237 1.00 0.19 H new ATOM 2249 N CYS A 148 2.445 4.997 -3.716 1.00 0.25 N ATOM 2250 CA CYS A 148 2.384 6.210 -2.932 1.00 0.28 C ATOM 2251 C CYS A 148 3.006 5.965 -1.571 1.00 0.26 C ATOM 2252 O CYS A 148 2.630 5.021 -0.886 1.00 0.32 O ATOM 2253 CB CYS A 148 0.931 6.641 -2.745 1.00 0.30 C ATOM 2254 SG CYS A 148 0.001 6.817 -4.286 1.00 1.10 S ATOM 0 H CYS A 148 2.149 4.161 -3.213 1.00 0.25 H new ATOM 0 HA CYS A 148 2.930 6.996 -3.454 1.00 0.28 H new ATOM 0 HB2 CYS A 148 0.427 5.911 -2.112 1.00 0.30 H new ATOM 0 HB3 CYS A 148 0.912 7.592 -2.213 1.00 0.30 H new ATOM 0 HG CYS A 148 -1.273 6.761 -4.033 1.00 1.10 H new ATOM 2260 N LYS A 149 3.963 6.787 -1.187 1.00 0.37 N ATOM 2261 CA LYS A 149 4.492 6.722 0.162 1.00 0.38 C ATOM 2262 C LYS A 149 3.719 7.678 1.061 1.00 0.39 C ATOM 2263 O LYS A 149 3.794 8.897 0.920 1.00 0.47 O ATOM 2264 CB LYS A 149 5.996 6.983 0.192 1.00 0.47 C ATOM 2265 CG LYS A 149 6.488 8.045 -0.773 1.00 0.64 C ATOM 2266 CD LYS A 149 8.005 8.028 -0.847 1.00 0.94 C ATOM 2267 CE LYS A 149 8.539 8.951 -1.927 1.00 1.57 C ATOM 2268 NZ LYS A 149 10.012 8.817 -2.067 1.00 2.44 N ATOM 0 H LYS A 149 4.386 7.500 -1.781 1.00 0.37 H new ATOM 0 HA LYS A 149 4.357 5.711 0.546 1.00 0.38 H new ATOM 0 HB2 LYS A 149 6.277 7.276 1.203 1.00 0.47 H new ATOM 0 HB3 LYS A 149 6.515 6.049 -0.025 1.00 0.47 H new ATOM 0 HG2 LYS A 149 6.067 7.870 -1.763 1.00 0.64 H new ATOM 0 HG3 LYS A 149 6.144 9.027 -0.450 1.00 0.64 H new ATOM 0 HD2 LYS A 149 8.417 8.324 0.118 1.00 0.94 H new ATOM 0 HD3 LYS A 149 8.346 7.011 -1.040 1.00 0.94 H new ATOM 0 HE2 LYS A 149 8.058 8.720 -2.877 1.00 1.57 H new ATOM 0 HE3 LYS A 149 8.286 9.983 -1.685 1.00 1.57 H new ATOM 0 HZ1 LYS A 149 10.350 9.459 -2.812 1.00 2.44 H new ATOM 0 HZ2 LYS A 149 10.470 9.061 -1.166 1.00 2.44 H new ATOM 0 HZ3 LYS A 149 10.249 7.837 -2.321 1.00 2.44 H new ATOM 2282 N LEU A 150 2.957 7.087 1.961 1.00 0.40 N ATOM 2283 CA LEU A 150 1.941 7.779 2.724 1.00 0.45 C ATOM 2284 C LEU A 150 2.413 8.513 3.942 1.00 0.45 C ATOM 2285 O LEU A 150 3.558 8.418 4.391 1.00 0.49 O ATOM 2286 CB LEU A 150 0.947 6.783 3.264 1.00 0.60 C ATOM 2287 CG LEU A 150 -0.209 6.416 2.386 1.00 0.49 C ATOM 2288 CD1 LEU A 150 -1.365 7.317 2.759 1.00 1.25 C ATOM 2289 CD2 LEU A 150 0.168 6.552 0.928 1.00 1.27 C ATOM 0 H LEU A 150 3.029 6.095 2.185 1.00 0.40 H new ATOM 0 HA LEU A 150 1.544 8.500 2.009 1.00 0.45 H new ATOM 0 HB2 LEU A 150 1.487 5.868 3.510 1.00 0.60 H new ATOM 0 HB3 LEU A 150 0.548 7.178 4.198 1.00 0.60 H new ATOM 0 HG LEU A 150 -0.496 5.375 2.533 1.00 0.49 H new ATOM 0 HD11 LEU A 150 -2.228 7.078 2.138 1.00 1.25 H new ATOM 0 HD12 LEU A 150 -1.620 7.166 3.808 1.00 1.25 H new ATOM 0 HD13 LEU A 150 -1.081 8.357 2.601 1.00 1.25 H new ATOM 0 HD21 LEU A 150 -0.684 6.281 0.305 1.00 1.27 H new ATOM 0 HD22 LEU A 150 0.456 7.583 0.721 1.00 1.27 H new ATOM 0 HD23 LEU A 150 1.005 5.890 0.705 1.00 1.27 H new ATOM 2301 N SER A 151 1.427 9.206 4.476 1.00 0.49 N ATOM 2302 CA SER A 151 1.421 9.715 5.812 1.00 0.55 C ATOM 2303 C SER A 151 0.064 10.359 6.100 1.00 0.57 C ATOM 2304 O SER A 151 -0.211 11.487 5.691 1.00 0.60 O ATOM 2305 CB SER A 151 2.585 10.671 6.022 1.00 0.66 C ATOM 2306 OG SER A 151 2.629 11.662 5.010 1.00 1.79 O ATOM 0 H SER A 151 0.577 9.433 3.960 1.00 0.49 H new ATOM 0 HA SER A 151 1.559 8.902 6.525 1.00 0.55 H new ATOM 0 HB2 SER A 151 2.494 11.149 6.997 1.00 0.66 H new ATOM 0 HB3 SER A 151 3.521 10.112 6.027 1.00 0.66 H new ATOM 0 HG SER A 151 2.611 12.551 5.422 1.00 1.79 H new ATOM 2312 N ALA A 152 -0.795 9.611 6.779 1.00 0.62 N ATOM 2313 CA ALA A 152 -2.178 10.027 6.996 1.00 0.70 C ATOM 2314 C ALA A 152 -2.292 11.067 8.105 1.00 0.74 C ATOM 2315 O ALA A 152 -3.293 11.776 8.207 1.00 0.87 O ATOM 2316 CB ALA A 152 -3.033 8.814 7.318 1.00 0.86 C ATOM 0 H ALA A 152 -0.559 8.709 7.192 1.00 0.62 H new ATOM 0 HA ALA A 152 -2.537 10.493 6.078 1.00 0.70 H new ATOM 0 HB1 ALA A 152 -4.064 9.128 7.479 1.00 0.86 H new ATOM 0 HB2 ALA A 152 -2.994 8.110 6.487 1.00 0.86 H new ATOM 0 HB3 ALA A 152 -2.655 8.332 8.220 1.00 0.86 H new ATOM 2322 N LYS A 153 -1.256 11.164 8.923 1.00 0.77 N ATOM 2323 CA LYS A 153 -1.247 12.091 10.038 1.00 0.93 C ATOM 2324 C LYS A 153 -0.900 13.486 9.553 1.00 0.86 C ATOM 2325 O LYS A 153 -1.596 14.460 9.837 1.00 0.96 O ATOM 2326 CB LYS A 153 -0.243 11.616 11.089 1.00 1.13 C ATOM 2327 CG LYS A 153 1.185 11.456 10.581 1.00 1.19 C ATOM 2328 CD LYS A 153 2.102 10.864 11.640 1.00 1.68 C ATOM 2329 CE LYS A 153 1.709 9.435 11.985 1.00 2.31 C ATOM 2330 NZ LYS A 153 2.684 8.801 12.910 1.00 3.03 N ATOM 0 H LYS A 153 -0.406 10.607 8.833 1.00 0.77 H new ATOM 0 HA LYS A 153 -2.238 12.125 10.490 1.00 0.93 H new ATOM 0 HB2 LYS A 153 -0.242 12.325 11.917 1.00 1.13 H new ATOM 0 HB3 LYS A 153 -0.581 10.660 11.488 1.00 1.13 H new ATOM 0 HG2 LYS A 153 1.187 10.814 9.700 1.00 1.19 H new ATOM 0 HG3 LYS A 153 1.570 12.427 10.269 1.00 1.19 H new ATOM 0 HD2 LYS A 153 3.132 10.883 11.282 1.00 1.68 H new ATOM 0 HD3 LYS A 153 2.066 11.479 12.539 1.00 1.68 H new ATOM 0 HE2 LYS A 153 0.719 9.431 12.442 1.00 2.31 H new ATOM 0 HE3 LYS A 153 1.640 8.846 11.070 1.00 2.31 H new ATOM 0 HZ1 LYS A 153 2.489 7.781 12.974 1.00 3.03 H new ATOM 0 HZ2 LYS A 153 3.649 8.947 12.551 1.00 3.03 H new ATOM 0 HZ3 LYS A 153 2.597 9.230 13.853 1.00 3.03 H new ATOM 2344 N THR A 154 0.178 13.553 8.803 1.00 0.78 N ATOM 2345 CA THR A 154 0.647 14.797 8.218 1.00 0.81 C ATOM 2346 C THR A 154 -0.103 15.125 6.928 1.00 0.73 C ATOM 2347 O THR A 154 0.140 16.154 6.302 1.00 0.82 O ATOM 2348 CB THR A 154 2.156 14.720 7.948 1.00 0.89 C ATOM 2349 OG1 THR A 154 2.477 13.421 7.437 1.00 1.19 O ATOM 2350 CG2 THR A 154 2.949 14.981 9.220 1.00 1.20 C ATOM 0 H THR A 154 0.759 12.745 8.579 1.00 0.78 H new ATOM 0 HA THR A 154 0.451 15.597 8.932 1.00 0.81 H new ATOM 0 HB THR A 154 2.421 15.484 7.217 1.00 0.89 H new ATOM 0 HG1 THR A 154 3.440 13.367 7.261 1.00 1.19 H new ATOM 0 HG21 THR A 154 4.015 14.921 9.003 1.00 1.20 H new ATOM 0 HG22 THR A 154 2.711 15.975 9.599 1.00 1.20 H new ATOM 0 HG23 THR A 154 2.689 14.234 9.970 1.00 1.20 H new ATOM 2358 N LYS A 155 -1.001 14.213 6.540 1.00 0.65 N ATOM 2359 CA LYS A 155 -1.920 14.409 5.410 1.00 0.67 C ATOM 2360 C LYS A 155 -1.239 14.256 4.046 1.00 0.66 C ATOM 2361 O LYS A 155 -1.919 14.235 3.018 1.00 0.86 O ATOM 2362 CB LYS A 155 -2.615 15.775 5.497 1.00 0.86 C ATOM 2363 CG LYS A 155 -4.126 15.688 5.657 1.00 1.27 C ATOM 2364 CD LYS A 155 -4.520 15.019 6.965 1.00 1.12 C ATOM 2365 CE LYS A 155 -6.031 14.923 7.104 1.00 1.39 C ATOM 2366 NZ LYS A 155 -6.668 16.263 7.232 1.00 2.27 N ATOM 0 H LYS A 155 -1.112 13.311 7.004 1.00 0.65 H new ATOM 0 HA LYS A 155 -2.665 13.617 5.488 1.00 0.67 H new ATOM 0 HB2 LYS A 155 -2.201 16.329 6.339 1.00 0.86 H new ATOM 0 HB3 LYS A 155 -2.387 16.346 4.597 1.00 0.86 H new ATOM 0 HG2 LYS A 155 -4.553 16.690 5.618 1.00 1.27 H new ATOM 0 HG3 LYS A 155 -4.548 15.129 4.822 1.00 1.27 H new ATOM 0 HD2 LYS A 155 -4.084 14.021 7.011 1.00 1.12 H new ATOM 0 HD3 LYS A 155 -4.111 15.584 7.802 1.00 1.12 H new ATOM 0 HE2 LYS A 155 -6.442 14.408 6.236 1.00 1.39 H new ATOM 0 HE3 LYS A 155 -6.277 14.320 7.978 1.00 1.39 H new ATOM 0 HZ1 LYS A 155 -7.177 16.321 8.137 1.00 2.27 H new ATOM 0 HZ2 LYS A 155 -5.935 17.000 7.199 1.00 2.27 H new ATOM 0 HZ3 LYS A 155 -7.338 16.405 6.449 1.00 2.27 H new ATOM 2380 N GLU A 156 0.084 14.113 4.030 1.00 0.62 N ATOM 2381 CA GLU A 156 0.818 14.006 2.768 1.00 0.66 C ATOM 2382 C GLU A 156 0.424 12.733 2.024 1.00 0.59 C ATOM 2383 O GLU A 156 0.322 12.718 0.796 1.00 0.58 O ATOM 2384 CB GLU A 156 2.324 14.019 3.022 1.00 0.75 C ATOM 2385 CG GLU A 156 2.830 15.313 3.633 1.00 1.13 C ATOM 2386 CD GLU A 156 2.663 16.497 2.705 1.00 1.78 C ATOM 2387 OE1 GLU A 156 3.571 16.757 1.892 1.00 2.03 O ATOM 2388 OE2 GLU A 156 1.616 17.173 2.781 1.00 2.64 O ATOM 0 H GLU A 156 0.666 14.069 4.866 1.00 0.62 H new ATOM 0 HA GLU A 156 0.559 14.866 2.150 1.00 0.66 H new ATOM 0 HB2 GLU A 156 2.579 13.191 3.684 1.00 0.75 H new ATOM 0 HB3 GLU A 156 2.844 13.845 2.080 1.00 0.75 H new ATOM 0 HG2 GLU A 156 2.294 15.506 4.563 1.00 1.13 H new ATOM 0 HG3 GLU A 156 3.884 15.202 3.889 1.00 1.13 H new ATOM 2395 N GLY A 157 0.201 11.671 2.789 1.00 0.62 N ATOM 2396 CA GLY A 157 -0.245 10.417 2.229 1.00 0.61 C ATOM 2397 C GLY A 157 -1.569 10.543 1.509 1.00 0.48 C ATOM 2398 O GLY A 157 -1.741 10.028 0.406 1.00 0.46 O ATOM 0 H GLY A 157 0.324 11.661 3.801 1.00 0.62 H new ATOM 0 HA2 GLY A 157 0.508 10.044 1.535 1.00 0.61 H new ATOM 0 HA3 GLY A 157 -0.337 9.679 3.026 1.00 0.61 H new ATOM 2402 N LEU A 158 -2.498 11.250 2.138 1.00 0.48 N ATOM 2403 CA LEU A 158 -3.870 11.331 1.659 1.00 0.50 C ATOM 2404 C LEU A 158 -3.966 12.082 0.340 1.00 0.46 C ATOM 2405 O LEU A 158 -4.561 11.585 -0.616 1.00 0.51 O ATOM 2406 CB LEU A 158 -4.748 12.014 2.704 1.00 0.62 C ATOM 2407 CG LEU A 158 -4.867 11.277 4.036 1.00 0.83 C ATOM 2408 CD1 LEU A 158 -5.750 12.062 4.988 1.00 1.55 C ATOM 2409 CD2 LEU A 158 -5.423 9.876 3.826 1.00 1.27 C ATOM 0 H LEU A 158 -2.322 11.781 2.991 1.00 0.48 H new ATOM 0 HA LEU A 158 -4.220 10.313 1.491 1.00 0.50 H new ATOM 0 HB2 LEU A 158 -4.351 13.011 2.893 1.00 0.62 H new ATOM 0 HB3 LEU A 158 -5.747 12.143 2.288 1.00 0.62 H new ATOM 0 HG LEU A 158 -3.873 11.186 4.474 1.00 0.83 H new ATOM 0 HD11 LEU A 158 -5.829 11.528 5.935 1.00 1.55 H new ATOM 0 HD12 LEU A 158 -5.314 13.046 5.161 1.00 1.55 H new ATOM 0 HD13 LEU A 158 -6.743 12.177 4.553 1.00 1.55 H new ATOM 0 HD21 LEU A 158 -5.500 9.367 4.787 1.00 1.27 H new ATOM 0 HD22 LEU A 158 -6.411 9.941 3.370 1.00 1.27 H new ATOM 0 HD23 LEU A 158 -4.757 9.315 3.171 1.00 1.27 H new ATOM 2421 N ASP A 159 -3.379 13.272 0.295 1.00 0.48 N ATOM 2422 CA ASP A 159 -3.469 14.119 -0.890 1.00 0.57 C ATOM 2423 C ASP A 159 -2.923 13.404 -2.116 1.00 0.50 C ATOM 2424 O ASP A 159 -3.613 13.287 -3.128 1.00 0.52 O ATOM 2425 CB ASP A 159 -2.721 15.434 -0.683 1.00 0.73 C ATOM 2426 CG ASP A 159 -2.731 16.298 -1.930 1.00 1.54 C ATOM 2427 OD1 ASP A 159 -3.800 16.841 -2.274 1.00 1.58 O ATOM 2428 OD2 ASP A 159 -1.669 16.431 -2.578 1.00 2.50 O ATOM 0 H ASP A 159 -2.838 13.672 1.061 1.00 0.48 H new ATOM 0 HA ASP A 159 -4.524 14.338 -1.054 1.00 0.57 H new ATOM 0 HB2 ASP A 159 -3.175 15.983 0.142 1.00 0.73 H new ATOM 0 HB3 ASP A 159 -1.691 15.223 -0.397 1.00 0.73 H new ATOM 2433 N HIS A 160 -1.695 12.904 -2.014 1.00 0.47 N ATOM 2434 CA HIS A 160 -1.055 12.238 -3.144 1.00 0.46 C ATOM 2435 C HIS A 160 -1.853 11.010 -3.574 1.00 0.41 C ATOM 2436 O HIS A 160 -1.918 10.692 -4.758 1.00 0.43 O ATOM 2437 CB HIS A 160 0.386 11.829 -2.804 1.00 0.50 C ATOM 2438 CG HIS A 160 1.139 11.265 -3.978 1.00 0.56 C ATOM 2439 ND1 HIS A 160 1.424 9.985 -4.323 1.00 0.67 N flip ATOM 2440 CD2 HIS A 160 1.670 12.052 -4.977 1.00 0.59 C flip ATOM 2441 CE1 HIS A 160 2.115 10.029 -5.510 1.00 0.73 C flip ATOM 2442 NE2 HIS A 160 2.247 11.286 -5.886 1.00 0.67 N flip ATOM 0 H HIS A 160 -1.127 12.946 -1.168 1.00 0.47 H new ATOM 0 HA HIS A 160 -1.028 12.949 -3.970 1.00 0.46 H new ATOM 0 HB2 HIS A 160 0.922 12.698 -2.421 1.00 0.50 H new ATOM 0 HB3 HIS A 160 0.367 11.089 -2.004 1.00 0.50 H new ATOM 0 HD1 HIS A 160 1.173 9.146 -3.799 1.00 0.67 H new ATOM 0 HD2 HIS A 160 1.622 13.130 -5.012 1.00 0.59 H new ATOM 0 HE1 HIS A 160 2.490 9.171 -6.049 1.00 0.73 H new ATOM 2451 N LEU A 161 -2.455 10.331 -2.608 1.00 0.39 N ATOM 2452 CA LEU A 161 -3.229 9.132 -2.891 1.00 0.39 C ATOM 2453 C LEU A 161 -4.456 9.458 -3.733 1.00 0.39 C ATOM 2454 O LEU A 161 -4.628 8.908 -4.821 1.00 0.42 O ATOM 2455 CB LEU A 161 -3.651 8.454 -1.585 1.00 0.41 C ATOM 2456 CG LEU A 161 -4.437 7.156 -1.754 1.00 0.51 C ATOM 2457 CD1 LEU A 161 -3.617 6.147 -2.540 1.00 0.91 C ATOM 2458 CD2 LEU A 161 -4.827 6.587 -0.401 1.00 0.88 C ATOM 0 H LEU A 161 -2.422 10.590 -1.622 1.00 0.39 H new ATOM 0 HA LEU A 161 -2.598 8.448 -3.459 1.00 0.39 H new ATOM 0 HB2 LEU A 161 -2.757 8.246 -0.997 1.00 0.41 H new ATOM 0 HB3 LEU A 161 -4.256 9.154 -1.009 1.00 0.41 H new ATOM 0 HG LEU A 161 -5.350 7.372 -2.308 1.00 0.51 H new ATOM 0 HD11 LEU A 161 -4.187 5.225 -2.655 1.00 0.91 H new ATOM 0 HD12 LEU A 161 -3.384 6.555 -3.524 1.00 0.91 H new ATOM 0 HD13 LEU A 161 -2.690 5.936 -2.006 1.00 0.91 H new ATOM 0 HD21 LEU A 161 -5.386 5.662 -0.543 1.00 0.88 H new ATOM 0 HD22 LEU A 161 -3.928 6.382 0.180 1.00 0.88 H new ATOM 0 HD23 LEU A 161 -5.447 7.308 0.132 1.00 0.88 H new ATOM 2470 N LEU A 162 -5.288 10.371 -3.238 1.00 0.40 N ATOM 2471 CA LEU A 162 -6.515 10.765 -3.924 1.00 0.44 C ATOM 2472 C LEU A 162 -6.218 11.221 -5.347 1.00 0.45 C ATOM 2473 O LEU A 162 -6.959 10.902 -6.277 1.00 0.48 O ATOM 2474 CB LEU A 162 -7.197 11.895 -3.151 1.00 0.50 C ATOM 2475 CG LEU A 162 -7.598 11.560 -1.713 1.00 0.69 C ATOM 2476 CD1 LEU A 162 -8.170 12.787 -1.016 1.00 1.05 C ATOM 2477 CD2 LEU A 162 -8.604 10.419 -1.690 1.00 1.06 C ATOM 0 H LEU A 162 -5.132 10.856 -2.355 1.00 0.40 H new ATOM 0 HA LEU A 162 -7.178 9.901 -3.970 1.00 0.44 H new ATOM 0 HB2 LEU A 162 -6.527 12.755 -3.132 1.00 0.50 H new ATOM 0 HB3 LEU A 162 -8.090 12.198 -3.698 1.00 0.50 H new ATOM 0 HG LEU A 162 -6.705 11.243 -1.175 1.00 0.69 H new ATOM 0 HD11 LEU A 162 -8.449 12.528 0.005 1.00 1.05 H new ATOM 0 HD12 LEU A 162 -7.420 13.578 -0.998 1.00 1.05 H new ATOM 0 HD13 LEU A 162 -9.051 13.135 -1.556 1.00 1.05 H new ATOM 0 HD21 LEU A 162 -8.877 10.195 -0.659 1.00 1.06 H new ATOM 0 HD22 LEU A 162 -9.495 10.709 -2.247 1.00 1.06 H new ATOM 0 HD23 LEU A 162 -8.161 9.534 -2.148 1.00 1.06 H new ATOM 2489 N GLU A 163 -5.114 11.945 -5.511 1.00 0.46 N ATOM 2490 CA GLU A 163 -4.720 12.457 -6.820 1.00 0.52 C ATOM 2491 C GLU A 163 -4.419 11.311 -7.784 1.00 0.51 C ATOM 2492 O GLU A 163 -4.791 11.359 -8.954 1.00 0.56 O ATOM 2493 CB GLU A 163 -3.493 13.363 -6.701 1.00 0.62 C ATOM 2494 CG GLU A 163 -3.709 14.580 -5.815 1.00 1.06 C ATOM 2495 CD GLU A 163 -4.795 15.504 -6.326 1.00 1.75 C ATOM 2496 OE1 GLU A 163 -4.623 16.088 -7.419 1.00 1.97 O ATOM 2497 OE2 GLU A 163 -5.836 15.632 -5.652 1.00 2.49 O ATOM 0 H GLU A 163 -4.476 12.190 -4.754 1.00 0.46 H new ATOM 0 HA GLU A 163 -5.554 13.039 -7.213 1.00 0.52 H new ATOM 0 HB2 GLU A 163 -2.661 12.781 -6.305 1.00 0.62 H new ATOM 0 HB3 GLU A 163 -3.203 13.698 -7.697 1.00 0.62 H new ATOM 0 HG2 GLU A 163 -3.967 14.248 -4.809 1.00 1.06 H new ATOM 0 HG3 GLU A 163 -2.775 15.136 -5.738 1.00 1.06 H new ATOM 2504 N MET A 164 -3.753 10.276 -7.282 1.00 0.49 N ATOM 2505 CA MET A 164 -3.403 9.127 -8.111 1.00 0.52 C ATOM 2506 C MET A 164 -4.645 8.310 -8.431 1.00 0.51 C ATOM 2507 O MET A 164 -4.804 7.809 -9.542 1.00 0.57 O ATOM 2508 CB MET A 164 -2.370 8.246 -7.407 1.00 0.53 C ATOM 2509 CG MET A 164 -1.054 8.943 -7.078 1.00 0.68 C ATOM 2510 SD MET A 164 -0.098 9.429 -8.533 1.00 0.87 S ATOM 2511 CE MET A 164 -0.893 10.970 -8.996 1.00 0.67 C ATOM 0 H MET A 164 -3.446 10.209 -6.312 1.00 0.49 H new ATOM 0 HA MET A 164 -2.970 9.497 -9.040 1.00 0.52 H new ATOM 0 HB2 MET A 164 -2.806 7.867 -6.482 1.00 0.53 H new ATOM 0 HB3 MET A 164 -2.160 7.382 -8.037 1.00 0.53 H new ATOM 0 HG2 MET A 164 -1.264 9.830 -6.480 1.00 0.68 H new ATOM 0 HG3 MET A 164 -0.447 8.280 -6.462 1.00 0.68 H new ATOM 0 HE1 MET A 164 -0.145 11.666 -9.375 1.00 0.67 H new ATOM 0 HE2 MET A 164 -1.635 10.778 -9.771 1.00 0.67 H new ATOM 0 HE3 MET A 164 -1.383 11.403 -8.124 1.00 0.67 H new ATOM 2521 N ILE A 165 -5.524 8.195 -7.443 1.00 0.48 N ATOM 2522 CA ILE A 165 -6.772 7.474 -7.574 1.00 0.51 C ATOM 2523 C ILE A 165 -7.608 8.014 -8.737 1.00 0.58 C ATOM 2524 O ILE A 165 -8.011 7.262 -9.627 1.00 0.64 O ATOM 2525 CB ILE A 165 -7.565 7.594 -6.256 1.00 0.50 C ATOM 2526 CG1 ILE A 165 -6.859 6.827 -5.136 1.00 0.48 C ATOM 2527 CG2 ILE A 165 -8.982 7.102 -6.425 1.00 0.59 C ATOM 2528 CD1 ILE A 165 -7.491 7.021 -3.777 1.00 0.50 C ATOM 0 H ILE A 165 -5.383 8.606 -6.520 1.00 0.48 H new ATOM 0 HA ILE A 165 -6.549 6.428 -7.782 1.00 0.51 H new ATOM 0 HB ILE A 165 -7.608 8.648 -5.983 1.00 0.50 H new ATOM 0 HG12 ILE A 165 -6.859 5.764 -5.379 1.00 0.48 H new ATOM 0 HG13 ILE A 165 -5.817 7.144 -5.091 1.00 0.48 H new ATOM 0 HG21 ILE A 165 -9.516 7.199 -5.480 1.00 0.59 H new ATOM 0 HG22 ILE A 165 -9.485 7.696 -7.188 1.00 0.59 H new ATOM 0 HG23 ILE A 165 -8.970 6.055 -6.729 1.00 0.59 H new ATOM 0 HD11 ILE A 165 -6.938 6.448 -3.033 1.00 0.50 H new ATOM 0 HD12 ILE A 165 -7.467 8.078 -3.512 1.00 0.50 H new ATOM 0 HD13 ILE A 165 -8.525 6.677 -3.804 1.00 0.50 H new ATOM 2540 N LEU A 166 -7.852 9.322 -8.744 1.00 0.61 N ATOM 2541 CA LEU A 166 -8.668 9.922 -9.786 1.00 0.72 C ATOM 2542 C LEU A 166 -7.940 9.971 -11.118 1.00 0.72 C ATOM 2543 O LEU A 166 -8.566 9.913 -12.176 1.00 0.81 O ATOM 2544 CB LEU A 166 -9.136 11.319 -9.391 1.00 0.82 C ATOM 2545 CG LEU A 166 -8.102 12.245 -8.745 1.00 0.98 C ATOM 2546 CD1 LEU A 166 -7.312 13.002 -9.801 1.00 1.81 C ATOM 2547 CD2 LEU A 166 -8.784 13.215 -7.794 1.00 1.48 C ATOM 0 H LEU A 166 -7.499 9.977 -8.047 1.00 0.61 H new ATOM 0 HA LEU A 166 -9.544 9.284 -9.904 1.00 0.72 H new ATOM 0 HB2 LEU A 166 -9.520 11.812 -10.284 1.00 0.82 H new ATOM 0 HB3 LEU A 166 -9.973 11.213 -8.701 1.00 0.82 H new ATOM 0 HG LEU A 166 -7.403 11.631 -8.177 1.00 0.98 H new ATOM 0 HD11 LEU A 166 -6.585 13.652 -9.315 1.00 1.81 H new ATOM 0 HD12 LEU A 166 -6.791 12.292 -10.444 1.00 1.81 H new ATOM 0 HD13 LEU A 166 -7.993 13.605 -10.402 1.00 1.81 H new ATOM 0 HD21 LEU A 166 -8.037 13.867 -7.342 1.00 1.48 H new ATOM 0 HD22 LEU A 166 -9.506 13.818 -8.345 1.00 1.48 H new ATOM 0 HD23 LEU A 166 -9.299 12.657 -7.012 1.00 1.48 H new ATOM 2559 N LEU A 167 -6.622 10.091 -11.059 1.00 0.69 N ATOM 2560 CA LEU A 167 -5.782 10.046 -12.253 1.00 0.79 C ATOM 2561 C LEU A 167 -6.051 8.770 -13.049 1.00 0.87 C ATOM 2562 O LEU A 167 -6.028 8.770 -14.281 1.00 1.02 O ATOM 2563 CB LEU A 167 -4.300 10.115 -11.862 1.00 0.84 C ATOM 2564 CG LEU A 167 -3.316 10.150 -13.036 1.00 1.06 C ATOM 2565 CD1 LEU A 167 -3.517 11.408 -13.868 1.00 1.42 C ATOM 2566 CD2 LEU A 167 -1.883 10.058 -12.530 1.00 1.41 C ATOM 0 H LEU A 167 -6.105 10.222 -10.190 1.00 0.69 H new ATOM 0 HA LEU A 167 -6.025 10.906 -12.877 1.00 0.79 H new ATOM 0 HB2 LEU A 167 -4.143 11.004 -11.251 1.00 0.84 H new ATOM 0 HB3 LEU A 167 -4.065 9.253 -11.238 1.00 0.84 H new ATOM 0 HG LEU A 167 -3.509 9.289 -13.675 1.00 1.06 H new ATOM 0 HD11 LEU A 167 -2.809 11.413 -14.696 1.00 1.42 H new ATOM 0 HD12 LEU A 167 -4.534 11.426 -14.260 1.00 1.42 H new ATOM 0 HD13 LEU A 167 -3.353 12.287 -13.244 1.00 1.42 H new ATOM 0 HD21 LEU A 167 -1.196 10.084 -13.376 1.00 1.41 H new ATOM 0 HD22 LEU A 167 -1.676 10.899 -11.868 1.00 1.41 H new ATOM 0 HD23 LEU A 167 -1.750 9.125 -11.983 1.00 1.41 H new ATOM 2578 N VAL A 168 -6.352 7.693 -12.332 1.00 0.83 N ATOM 2579 CA VAL A 168 -6.563 6.396 -12.940 1.00 0.96 C ATOM 2580 C VAL A 168 -7.941 6.328 -13.590 1.00 1.01 C ATOM 2581 O VAL A 168 -8.133 5.651 -14.602 1.00 1.14 O ATOM 2582 CB VAL A 168 -6.412 5.280 -11.890 1.00 1.03 C ATOM 2583 CG1 VAL A 168 -6.769 3.939 -12.484 1.00 1.17 C ATOM 2584 CG2 VAL A 168 -4.995 5.253 -11.344 1.00 1.14 C ATOM 0 H VAL A 168 -6.455 7.700 -11.317 1.00 0.83 H new ATOM 0 HA VAL A 168 -5.808 6.251 -13.713 1.00 0.96 H new ATOM 0 HB VAL A 168 -7.098 5.488 -11.069 1.00 1.03 H new ATOM 0 HG11 VAL A 168 -6.656 3.164 -11.726 1.00 1.17 H new ATOM 0 HG12 VAL A 168 -7.802 3.958 -12.832 1.00 1.17 H new ATOM 0 HG13 VAL A 168 -6.107 3.725 -13.323 1.00 1.17 H new ATOM 0 HG21 VAL A 168 -4.906 4.459 -10.603 1.00 1.14 H new ATOM 0 HG22 VAL A 168 -4.295 5.070 -12.159 1.00 1.14 H new ATOM 0 HG23 VAL A 168 -4.766 6.211 -10.878 1.00 1.14 H new ATOM 2594 N SER A 169 -8.885 7.067 -13.015 1.00 0.98 N ATOM 2595 CA SER A 169 -10.246 7.148 -13.540 1.00 1.14 C ATOM 2596 C SER A 169 -10.241 7.568 -15.016 1.00 1.22 C ATOM 2597 O SER A 169 -11.111 7.163 -15.790 1.00 1.41 O ATOM 2598 CB SER A 169 -11.070 8.136 -12.702 1.00 1.20 C ATOM 2599 OG SER A 169 -12.411 8.218 -13.148 1.00 1.54 O ATOM 0 H SER A 169 -8.730 7.625 -12.175 1.00 0.98 H new ATOM 0 HA SER A 169 -10.702 6.160 -13.475 1.00 1.14 H new ATOM 0 HB2 SER A 169 -11.054 7.827 -11.657 1.00 1.20 H new ATOM 0 HB3 SER A 169 -10.611 9.123 -12.750 1.00 1.20 H new ATOM 0 HG SER A 169 -12.995 8.430 -12.390 1.00 1.54 H new ATOM 2605 N GLU A 170 -9.262 8.383 -15.397 1.00 1.15 N ATOM 2606 CA GLU A 170 -9.094 8.765 -16.793 1.00 1.33 C ATOM 2607 C GLU A 170 -8.087 7.856 -17.486 1.00 1.37 C ATOM 2608 O GLU A 170 -8.261 7.512 -18.655 1.00 1.53 O ATOM 2609 CB GLU A 170 -8.641 10.224 -16.922 1.00 1.46 C ATOM 2610 CG GLU A 170 -9.765 11.241 -16.795 1.00 2.02 C ATOM 2611 CD GLU A 170 -10.341 11.328 -15.399 1.00 2.31 C ATOM 2612 OE1 GLU A 170 -9.684 11.919 -14.517 1.00 2.79 O ATOM 2613 OE2 GLU A 170 -11.467 10.840 -15.176 1.00 2.65 O ATOM 0 H GLU A 170 -8.576 8.790 -14.761 1.00 1.15 H new ATOM 0 HA GLU A 170 -10.065 8.658 -17.277 1.00 1.33 H new ATOM 0 HB2 GLU A 170 -7.893 10.429 -16.156 1.00 1.46 H new ATOM 0 HB3 GLU A 170 -8.154 10.357 -17.888 1.00 1.46 H new ATOM 0 HG2 GLU A 170 -9.392 12.222 -17.088 1.00 2.02 H new ATOM 0 HG3 GLU A 170 -10.561 10.981 -17.493 1.00 2.02 H new ATOM 2620 N MET A 171 -7.048 7.459 -16.752 1.00 1.30 N ATOM 2621 CA MET A 171 -5.943 6.673 -17.308 1.00 1.44 C ATOM 2622 C MET A 171 -6.441 5.427 -18.035 1.00 1.51 C ATOM 2623 O MET A 171 -5.988 5.130 -19.141 1.00 1.76 O ATOM 2624 CB MET A 171 -4.966 6.264 -16.201 1.00 1.40 C ATOM 2625 CG MET A 171 -3.708 5.579 -16.720 1.00 1.67 C ATOM 2626 SD MET A 171 -2.626 5.003 -15.395 1.00 1.82 S ATOM 2627 CE MET A 171 -3.621 3.679 -14.706 1.00 1.77 C ATOM 0 H MET A 171 -6.947 7.671 -15.759 1.00 1.30 H new ATOM 0 HA MET A 171 -5.431 7.306 -18.032 1.00 1.44 H new ATOM 0 HB2 MET A 171 -4.680 7.150 -15.635 1.00 1.40 H new ATOM 0 HB3 MET A 171 -5.475 5.594 -15.508 1.00 1.40 H new ATOM 0 HG2 MET A 171 -3.993 4.732 -17.344 1.00 1.67 H new ATOM 0 HG3 MET A 171 -3.158 6.273 -17.356 1.00 1.67 H new ATOM 0 HE1 MET A 171 -3.657 3.778 -13.621 1.00 1.77 H new ATOM 0 HE2 MET A 171 -4.632 3.736 -15.110 1.00 1.77 H new ATOM 0 HE3 MET A 171 -3.179 2.718 -14.968 1.00 1.77 H new ATOM 2637 N GLU A 172 -7.372 4.717 -17.410 1.00 1.43 N ATOM 2638 CA GLU A 172 -7.953 3.505 -17.991 1.00 1.58 C ATOM 2639 C GLU A 172 -8.499 3.763 -19.396 1.00 1.73 C ATOM 2640 O GLU A 172 -8.255 2.991 -20.326 1.00 2.00 O ATOM 2641 CB GLU A 172 -9.080 2.979 -17.097 1.00 1.62 C ATOM 2642 CG GLU A 172 -8.622 2.534 -15.718 1.00 2.05 C ATOM 2643 CD GLU A 172 -7.666 1.364 -15.779 1.00 2.83 C ATOM 2644 OE1 GLU A 172 -8.146 0.213 -15.871 1.00 3.31 O ATOM 2645 OE2 GLU A 172 -6.439 1.595 -15.725 1.00 3.45 O ATOM 0 H GLU A 172 -7.746 4.960 -16.493 1.00 1.43 H new ATOM 0 HA GLU A 172 -7.160 2.761 -18.061 1.00 1.58 H new ATOM 0 HB2 GLU A 172 -9.833 3.759 -16.984 1.00 1.62 H new ATOM 0 HB3 GLU A 172 -9.563 2.139 -17.596 1.00 1.62 H new ATOM 0 HG2 GLU A 172 -8.138 3.369 -15.212 1.00 2.05 H new ATOM 0 HG3 GLU A 172 -9.491 2.259 -15.120 1.00 2.05 H new ATOM 2652 N GLU A 173 -9.215 4.868 -19.547 1.00 1.74 N ATOM 2653 CA GLU A 173 -9.862 5.194 -20.811 1.00 2.08 C ATOM 2654 C GLU A 173 -8.898 5.865 -21.780 1.00 2.36 C ATOM 2655 O GLU A 173 -9.235 6.091 -22.943 1.00 2.69 O ATOM 2656 CB GLU A 173 -11.076 6.088 -20.569 1.00 2.29 C ATOM 2657 CG GLU A 173 -12.236 5.360 -19.912 1.00 2.72 C ATOM 2658 CD GLU A 173 -12.727 4.197 -20.748 1.00 2.95 C ATOM 2659 OE1 GLU A 173 -13.486 4.431 -21.711 1.00 3.18 O ATOM 2660 OE2 GLU A 173 -12.339 3.048 -20.465 1.00 3.36 O ATOM 0 H GLU A 173 -9.363 5.556 -18.808 1.00 1.74 H new ATOM 0 HA GLU A 173 -10.191 4.259 -21.265 1.00 2.08 H new ATOM 0 HB2 GLU A 173 -10.780 6.928 -19.941 1.00 2.29 H new ATOM 0 HB3 GLU A 173 -11.408 6.503 -21.520 1.00 2.29 H new ATOM 0 HG2 GLU A 173 -11.927 4.996 -18.932 1.00 2.72 H new ATOM 0 HG3 GLU A 173 -13.056 6.059 -19.748 1.00 2.72 H new ATOM 2667 N LEU A 174 -7.710 6.191 -21.300 1.00 2.34 N ATOM 2668 CA LEU A 174 -6.681 6.764 -22.150 1.00 2.77 C ATOM 2669 C LEU A 174 -5.810 5.652 -22.709 1.00 2.83 C ATOM 2670 O LEU A 174 -5.726 5.459 -23.925 1.00 3.15 O ATOM 2671 CB LEU A 174 -5.817 7.761 -21.368 1.00 3.04 C ATOM 2672 CG LEU A 174 -6.568 8.953 -20.772 1.00 3.65 C ATOM 2673 CD1 LEU A 174 -5.610 9.857 -20.012 1.00 4.14 C ATOM 2674 CD2 LEU A 174 -7.291 9.732 -21.858 1.00 4.09 C ATOM 0 H LEU A 174 -7.434 6.069 -20.326 1.00 2.34 H new ATOM 0 HA LEU A 174 -7.163 7.300 -22.968 1.00 2.77 H new ATOM 0 HB2 LEU A 174 -5.317 7.227 -20.560 1.00 3.04 H new ATOM 0 HB3 LEU A 174 -5.038 8.138 -22.030 1.00 3.04 H new ATOM 0 HG LEU A 174 -7.314 8.574 -20.073 1.00 3.65 H new ATOM 0 HD11 LEU A 174 -6.160 10.700 -19.594 1.00 4.14 H new ATOM 0 HD12 LEU A 174 -5.141 9.294 -19.205 1.00 4.14 H new ATOM 0 HD13 LEU A 174 -4.841 10.226 -20.691 1.00 4.14 H new ATOM 0 HD21 LEU A 174 -7.818 10.575 -21.411 1.00 4.09 H new ATOM 0 HD22 LEU A 174 -6.567 10.101 -22.585 1.00 4.09 H new ATOM 0 HD23 LEU A 174 -8.007 9.080 -22.358 1.00 4.09 H new ATOM 2686 N LYS A 175 -5.196 4.907 -21.804 1.00 2.71 N ATOM 2687 CA LYS A 175 -4.337 3.793 -22.163 1.00 2.98 C ATOM 2688 C LYS A 175 -3.977 2.985 -20.923 1.00 2.92 C ATOM 2689 O LYS A 175 -3.141 3.399 -20.120 1.00 3.27 O ATOM 2690 CB LYS A 175 -3.056 4.284 -22.839 1.00 3.56 C ATOM 2691 CG LYS A 175 -2.149 3.151 -23.281 1.00 3.99 C ATOM 2692 CD LYS A 175 -0.783 3.657 -23.711 1.00 4.91 C ATOM 2693 CE LYS A 175 -0.857 4.506 -24.966 1.00 5.73 C ATOM 2694 NZ LYS A 175 0.490 4.960 -25.394 1.00 6.31 N ATOM 0 H LYS A 175 -5.280 5.059 -20.799 1.00 2.71 H new ATOM 0 HA LYS A 175 -4.883 3.162 -22.864 1.00 2.98 H new ATOM 0 HB2 LYS A 175 -3.318 4.891 -23.705 1.00 3.56 H new ATOM 0 HB3 LYS A 175 -2.512 4.930 -22.150 1.00 3.56 H new ATOM 0 HG2 LYS A 175 -2.032 2.439 -22.464 1.00 3.99 H new ATOM 0 HG3 LYS A 175 -2.614 2.614 -24.108 1.00 3.99 H new ATOM 0 HD2 LYS A 175 -0.343 4.242 -22.903 1.00 4.91 H new ATOM 0 HD3 LYS A 175 -0.122 2.809 -23.886 1.00 4.91 H new ATOM 0 HE2 LYS A 175 -1.321 3.932 -25.768 1.00 5.73 H new ATOM 0 HE3 LYS A 175 -1.494 5.372 -24.784 1.00 5.73 H new ATOM 0 HZ1 LYS A 175 0.404 5.538 -26.254 1.00 6.31 H new ATOM 0 HZ2 LYS A 175 0.922 5.528 -24.637 1.00 6.31 H new ATOM 0 HZ3 LYS A 175 1.089 4.133 -25.591 1.00 6.31 H new ATOM 2708 N ALA A 176 -4.608 1.835 -20.771 1.00 3.23 N ATOM 2709 CA ALA A 176 -4.329 0.952 -19.648 1.00 3.81 C ATOM 2710 C ALA A 176 -3.332 -0.128 -20.062 1.00 4.06 C ATOM 2711 O ALA A 176 -3.604 -1.321 -19.953 1.00 4.47 O ATOM 2712 CB ALA A 176 -5.618 0.329 -19.134 1.00 4.57 C ATOM 0 H ALA A 176 -5.321 1.488 -21.413 1.00 3.23 H new ATOM 0 HA ALA A 176 -3.887 1.536 -18.841 1.00 3.81 H new ATOM 0 HB1 ALA A 176 -5.394 -0.329 -18.294 1.00 4.57 H new ATOM 0 HB2 ALA A 176 -6.298 1.116 -18.807 1.00 4.57 H new ATOM 0 HB3 ALA A 176 -6.087 -0.247 -19.932 1.00 4.57 H new ATOM 2718 N ASN A 177 -2.178 0.310 -20.553 1.00 4.28 N ATOM 2719 CA ASN A 177 -1.150 -0.602 -21.043 1.00 4.87 C ATOM 2720 C ASN A 177 0.140 0.162 -21.326 1.00 5.36 C ATOM 2721 O ASN A 177 0.107 1.207 -21.969 1.00 5.81 O ATOM 2722 CB ASN A 177 -1.627 -1.311 -22.319 1.00 5.37 C ATOM 2723 CG ASN A 177 -0.614 -2.310 -22.845 1.00 5.96 C ATOM 2724 OD1 ASN A 177 -0.625 -3.481 -22.463 1.00 6.37 O ATOM 2725 ND2 ASN A 177 0.265 -1.860 -23.726 1.00 6.38 N ATOM 0 H ASN A 177 -1.930 1.297 -20.623 1.00 4.28 H new ATOM 0 HA ASN A 177 -0.958 -1.351 -20.275 1.00 4.87 H new ATOM 0 HB2 ASN A 177 -2.566 -1.825 -22.115 1.00 5.37 H new ATOM 0 HB3 ASN A 177 -1.831 -0.567 -23.089 1.00 5.37 H new ATOM 0 HD21 ASN A 177 0.967 -2.491 -24.114 1.00 6.38 H new ATOM 0 HD22 ASN A 177 0.241 -0.883 -24.017 1.00 6.38 H new ATOM 2732 N PRO A 178 1.285 -0.344 -20.840 1.00 5.69 N ATOM 2733 CA PRO A 178 2.596 0.281 -21.069 1.00 6.51 C ATOM 2734 C PRO A 178 2.984 0.300 -22.546 1.00 7.07 C ATOM 2735 O PRO A 178 2.865 1.370 -23.181 1.00 7.39 O ATOM 2736 CB PRO A 178 3.569 -0.601 -20.273 1.00 6.95 C ATOM 2737 CG PRO A 178 2.713 -1.363 -19.322 1.00 6.50 C ATOM 2738 CD PRO A 178 1.401 -1.558 -20.020 1.00 5.73 C ATOM 2739 OXT PRO A 178 3.410 -0.750 -23.071 1.00 7.47 O ATOM 0 HA PRO A 178 2.600 1.326 -20.759 1.00 6.51 H new ATOM 0 HB2 PRO A 178 4.121 -1.272 -20.931 1.00 6.95 H new ATOM 0 HB3 PRO A 178 4.305 0.003 -19.743 1.00 6.95 H new ATOM 0 HG2 PRO A 178 3.167 -2.321 -19.068 1.00 6.50 H new ATOM 0 HG3 PRO A 178 2.582 -0.815 -18.389 1.00 6.50 H new ATOM 0 HD2 PRO A 178 1.398 -2.461 -20.631 1.00 5.73 H new ATOM 0 HD3 PRO A 178 0.576 -1.649 -19.313 1.00 5.73 H new TER 2747 PRO A 178