USER MOD reduce.3.24.130724 H: found=0, std=0, add=1175, rem=0, adj=45 USER MOD reduce.3.24.130724 removed 1174 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Single : A 1 MET CE :methyl -158:sc= -0.163 (180deg=-0.754) USER MOD Single : A 1 MET N :NH3+ -173:sc= -0.213 (180deg=-0.342) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 3 THR OG1 : rot 180:sc= -1.43 USER MOD Single : A 10 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 14 LYS NZ :NH3+ -171:sc= -3.23! (180deg=-3.33!) USER MOD Single : A 17 GLN : amide:sc= -0.273 X(o=-0.27,f=-0.6) USER MOD Single : A 25 SER OG : rot 180:sc= 0 USER MOD Single : A 29 SER OG : rot 180:sc= 0 USER MOD Single : A 31 ASN : amide:sc= 0 K(o=0,f=-0.69) USER MOD Single : A 32 ASN : amide:sc= -0.303 X(o=-0.3,f=-0.01) USER MOD Single : A 34 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 35 GLN :FLIP amide:sc= -0.0413 F(o=-1.4!,f=-0.041) USER MOD Single : A 37 ASN : amide:sc= 0 K(o=0,f=-0.84) USER MOD Single : A 46 THR OG1 : rot -62:sc= 0.834 USER MOD Single : A 52 THR OG1 : rot 36:sc= 0.15 USER MOD Single : A 54 LYS NZ :NH3+ -163:sc= -0.0671 (180deg=-0.36) USER MOD Single : A 60 SER OG : rot 180:sc= 0 USER MOD Single : A 63 TYR OH : rot 180:sc= 0 USER MOD Single : A 65 ASN : amide:sc= -0.273 X(o=-0.27,f=-0.028) USER MOD Single : A 66 LYS NZ :NH3+ -121:sc= -1.18 (180deg=-1.31) USER MOD Single : A 69 THR OG1 : rot 180:sc= 0 USER MOD Single : A 74 SER OG : rot 180:sc= 0 USER MOD Single : A 75 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 76 MET CE :methyl -157:sc= -0.252 (180deg=-0.895) USER MOD Single : A 78 HIS :FLIP no HD1:sc= -1.76 F(o=-2.9!,f=-1.8) USER MOD Single : A 80 ASN : amide:sc= -0.16 K(o=-0.16,f=-1) USER MOD Single : A 82 TYR OH : rot 180:sc= 0 USER MOD Single : A 86 SER OG : rot 180:sc= -0.0614 USER MOD Single : A 88 CYS SG : rot 180:sc= 0 USER MOD Single : A 93 GLN :FLIP amide:sc= 0 F(o=-1.2,f=0) USER MOD Single : A 94 ASN : amide:sc= -0.284 X(o=-0.28,f=-0.063) USER MOD Single : A 97 SER OG : rot 180:sc= 0 USER MOD Single : A 99 THR OG1 : rot 180:sc= 0 USER MOD Single : A 100 TYR OH : rot 180:sc= 0 USER MOD Single : A 103 SER OG : rot 160:sc= -0.451 USER MOD Single : A 104 SER OG : rot 146:sc= 0.43 USER MOD Single : A 107 THR OG1 : rot -24:sc= 0.235 USER MOD Single : A 108 SER OG : rot 78:sc= 1.21 USER MOD Single : A 110 GLN :FLIP amide:sc= -0.235 F(o=-0.96,f=-0.24) USER MOD Single : A 111 SER OG : rot 180:sc= 0 USER MOD Single : A 117 ASN :FLIP amide:sc= 0 F(o=-1.1,f=0) USER MOD Single : A 119 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 120 SER OG : rot 180:sc= 0 USER MOD Single : A 123 ASN :FLIP amide:sc= 0.00841 F(o=-6.5!,f=0.0084) USER MOD Single : A 124 SER OG : rot 180:sc= 0 USER MOD Single : A 125 GLN : amide:sc= 0 K(o=0,f=-0.51) USER MOD Single : A 128 GLN :FLIP amide:sc= -0.209 F(o=-2.7!,f=-0.21) USER MOD Single : A 130 TYR OH : rot 180:sc= 0 USER MOD Single : A 131 GLN :FLIP amide:sc= -0.0183 F(o=-1,f=-0.018) USER MOD Single : A 133 ASN :FLIP amide:sc= -0.084 F(o=-1.6!,f=-0.084) USER MOD Single : A 134 LYS NZ :NH3+ -154:sc= -1.96! (180deg=-3.43!) USER MOD Single : A 137 TYR OH : rot 180:sc= 0 USER MOD Single : A 139 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 142 SER OG : rot 180:sc= 0 USER MOD Single : A 147 GLN : amide:sc= -0.0652 K(o=-0.065,f=-0.72) USER MOD Single : A 148 SER OG : rot -43:sc= 1.07 USER MOD Single : A 150 ASN :FLIP amide:sc= -0.955 F(o=-5.3!,f=-0.95) USER MOD Single : A 152 SER OG : rot 24:sc= 1.21 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 -27.636 2.396 11.789 0.06 0.00 N ATOM 2 CA MET A 1 -27.139 1.019 11.533 0.09 0.00 C ATOM 3 C MET A 1 -26.785 0.832 10.061 0.06 0.00 C ATOM 4 O MET A 1 -26.366 -0.249 9.648 0.23 0.00 O ATOM 5 CB MET A 1 -28.193 -0.008 11.948 0.69 0.00 C ATOM 6 CG MET A 1 -28.474 -0.020 13.442 0.41 0.00 C ATOM 7 SD MET A 1 -27.048 -0.545 14.413 0.07 0.00 S ATOM 8 CE MET A 1 -26.820 -2.215 13.806 0.41 0.00 C ATOM 0 H1 MET A 1 -27.758 2.537 12.812 0.06 0.00 H new ATOM 0 H2 MET A 1 -26.949 3.086 11.424 0.06 0.00 H new ATOM 0 H3 MET A 1 -28.549 2.530 11.310 0.06 0.00 H new ATOM 0 HA MET A 1 -26.237 0.868 12.127 0.09 0.00 H new ATOM 0 HB2 MET A 1 -29.120 0.199 11.414 0.69 0.00 H new ATOM 0 HB3 MET A 1 -27.863 -1.000 11.641 0.69 0.00 H new ATOM 0 HG2 MET A 1 -28.777 0.978 13.759 0.41 0.00 H new ATOM 0 HG3 MET A 1 -29.312 -0.687 13.645 0.41 0.00 H new ATOM 0 HE1 MET A 1 -26.265 -2.797 14.542 0.41 0.00 H new ATOM 0 HE2 MET A 1 -27.793 -2.677 13.637 0.41 0.00 H new ATOM 0 HE3 MET A 1 -26.263 -2.189 12.870 0.41 0.00 H new ATOM 20 N SER A 2 -26.954 1.891 9.276 0.20 0.00 N ATOM 21 CA SER A 2 -26.653 1.840 7.850 1.00 0.00 C ATOM 22 C SER A 2 -26.033 3.149 7.375 0.16 0.00 C ATOM 23 O SER A 2 -26.394 4.228 7.847 0.06 0.00 O ATOM 24 CB SER A 2 -27.920 1.542 7.049 0.31 0.00 C ATOM 25 OG SER A 2 -27.642 1.484 5.660 0.28 0.00 O ATOM 0 H SER A 2 -27.297 2.794 9.603 0.20 0.00 H new ATOM 0 HA SER A 2 -25.932 1.039 7.687 1.00 0.00 H new ATOM 0 HB2 SER A 2 -28.348 0.595 7.378 0.31 0.00 H new ATOM 0 HB3 SER A 2 -28.666 2.313 7.242 0.31 0.00 H new ATOM 0 HG SER A 2 -28.468 1.290 5.169 0.28 0.00 H new ATOM 31 N THR A 3 -25.097 3.043 6.439 1.00 0.00 N ATOM 32 CA THR A 3 -24.419 4.210 5.890 1.00 0.00 C ATOM 33 C THR A 3 -24.095 3.983 4.410 1.00 0.00 C ATOM 34 O THR A 3 -24.159 2.853 3.927 0.26 0.00 O ATOM 35 CB THR A 3 -23.132 4.524 6.691 0.58 0.00 C ATOM 36 OG1 THR A 3 -22.974 5.938 6.850 0.07 0.00 O ATOM 37 CG2 THR A 3 -21.898 3.950 6.013 1.00 0.00 C ATOM 0 H THR A 3 -24.789 2.155 6.043 1.00 0.00 H new ATOM 0 HA THR A 3 -25.084 5.070 5.973 1.00 0.00 H new ATOM 0 HB THR A 3 -23.236 4.056 7.670 0.58 0.00 H new ATOM 0 HG1 THR A 3 -22.157 6.121 7.360 0.07 0.00 H new ATOM 0 HG21 THR A 3 -21.014 4.190 6.603 1.00 0.00 H new ATOM 0 HG22 THR A 3 -21.998 2.868 5.932 1.00 0.00 H new ATOM 0 HG23 THR A 3 -21.797 4.380 5.017 1.00 0.00 H new ATOM 45 N PRO A 4 -23.742 5.050 3.672 1.00 0.00 N ATOM 46 CA PRO A 4 -23.425 4.946 2.254 1.00 0.00 C ATOM 47 C PRO A 4 -22.015 4.422 2.022 0.15 0.00 C ATOM 48 O PRO A 4 -21.754 3.730 1.038 1.00 0.00 O ATOM 49 CB PRO A 4 -23.566 6.378 1.731 0.19 0.00 C ATOM 50 CG PRO A 4 -23.667 7.272 2.931 0.12 0.00 C ATOM 51 CD PRO A 4 -23.595 6.419 4.165 0.15 0.00 C ATOM 0 HA PRO A 4 -24.081 4.241 1.744 1.00 0.00 H new ATOM 0 HB2 PRO A 4 -22.708 6.651 1.117 0.19 0.00 H new ATOM 0 HB3 PRO A 4 -24.451 6.474 1.102 0.19 0.00 H new ATOM 0 HG2 PRO A 4 -22.859 8.004 2.928 0.12 0.00 H new ATOM 0 HG3 PRO A 4 -24.603 7.831 2.910 0.12 0.00 H new ATOM 0 HD2 PRO A 4 -22.647 6.554 4.686 0.15 0.00 H new ATOM 0 HD3 PRO A 4 -24.386 6.674 4.871 0.15 0.00 H new ATOM 59 N ALA A 5 -21.107 4.757 2.932 0.77 0.00 N ATOM 60 CA ALA A 5 -19.728 4.305 2.832 0.09 0.00 C ATOM 61 C ALA A 5 -19.663 2.783 2.910 1.00 0.00 C ATOM 62 O ALA A 5 -18.821 2.149 2.274 0.72 0.00 O ATOM 63 CB ALA A 5 -18.880 4.931 3.929 0.16 0.00 C ATOM 0 H ALA A 5 -21.303 5.340 3.746 0.77 0.00 H new ATOM 0 HA ALA A 5 -19.329 4.621 1.868 0.09 0.00 H new ATOM 0 HB1 ALA A 5 -17.852 4.581 3.838 0.16 0.00 H new ATOM 0 HB2 ALA A 5 -18.904 6.016 3.833 0.16 0.00 H new ATOM 0 HB3 ALA A 5 -19.276 4.644 4.903 0.16 0.00 H new ATOM 69 N ARG A 6 -20.567 2.208 3.700 1.00 0.00 N ATOM 70 CA ARG A 6 -20.637 0.762 3.876 0.40 0.00 C ATOM 71 C ARG A 6 -21.051 0.074 2.580 0.20 0.00 C ATOM 72 O ARG A 6 -20.399 -0.870 2.131 0.30 0.00 O ATOM 73 CB ARG A 6 -21.626 0.413 4.995 0.20 0.00 C ATOM 74 CG ARG A 6 -21.048 0.580 6.391 0.10 0.00 C ATOM 75 CD ARG A 6 -22.060 0.201 7.462 1.00 0.00 C ATOM 76 NE ARG A 6 -22.507 -1.182 7.323 0.16 0.00 N ATOM 77 CZ ARG A 6 -23.215 -1.826 8.246 0.07 0.00 C ATOM 78 NH1 ARG A 6 -23.557 -1.215 9.374 1.00 0.00 N ATOM 79 NH2 ARG A 6 -23.582 -3.084 8.044 0.07 0.00 N ATOM 0 H ARG A 6 -21.266 2.727 4.232 1.00 0.00 H new ATOM 0 HA ARG A 6 -19.645 0.405 4.152 0.40 0.00 H new ATOM 0 HB2 ARG A 6 -22.509 1.045 4.898 0.20 0.00 H new ATOM 0 HB3 ARG A 6 -21.956 -0.618 4.868 0.20 0.00 H new ATOM 0 HG2 ARG A 6 -20.158 -0.041 6.494 0.10 0.00 H new ATOM 0 HG3 ARG A 6 -20.734 1.614 6.535 0.10 0.00 H new ATOM 0 HD2 ARG A 6 -21.616 0.342 8.447 1.00 0.00 H new ATOM 0 HD3 ARG A 6 -22.920 0.868 7.402 1.00 0.00 H new ATOM 0 HE ARG A 6 -22.262 -1.683 6.469 0.16 0.00 H new ATOM 0 HH11 ARG A 6 -23.277 -0.248 9.535 1.00 0.00 H new ATOM 0 HH12 ARG A 6 -24.100 -1.713 10.079 1.00 0.00 H new ATOM 0 HH21 ARG A 6 -23.321 -3.559 7.180 0.07 0.00 H new ATOM 0 HH22 ARG A 6 -24.125 -3.577 8.753 0.07 0.00 H new ATOM 93 N ARG A 7 -22.138 0.553 1.981 0.87 0.00 N ATOM 94 CA ARG A 7 -22.638 -0.011 0.735 1.00 0.00 C ATOM 95 C ARG A 7 -21.588 0.097 -0.366 0.22 0.00 C ATOM 96 O ARG A 7 -21.482 -0.777 -1.226 0.13 0.00 O ATOM 97 CB ARG A 7 -23.918 0.710 0.307 0.07 0.00 C ATOM 98 CG ARG A 7 -25.024 0.650 1.346 1.00 0.00 C ATOM 99 CD ARG A 7 -26.242 1.446 0.903 0.06 0.00 C ATOM 100 NE ARG A 7 -25.912 2.842 0.632 1.00 0.00 N ATOM 101 CZ ARG A 7 -26.772 3.722 0.127 1.00 0.00 C ATOM 102 NH1 ARG A 7 -28.013 3.352 -0.164 0.26 0.00 N ATOM 103 NH2 ARG A 7 -26.390 4.973 -0.091 0.32 0.00 N ATOM 0 H ARG A 7 -22.689 1.332 2.341 0.87 0.00 H new ATOM 0 HA ARG A 7 -22.860 -1.065 0.901 1.00 0.00 H new ATOM 0 HB2 ARG A 7 -23.684 1.754 0.096 0.07 0.00 H new ATOM 0 HB3 ARG A 7 -24.280 0.270 -0.623 0.07 0.00 H new ATOM 0 HG2 ARG A 7 -25.308 -0.388 1.518 1.00 0.00 H new ATOM 0 HG3 ARG A 7 -24.656 1.041 2.295 1.00 0.00 H new ATOM 0 HD2 ARG A 7 -26.665 0.993 0.007 0.06 0.00 H new ATOM 0 HD3 ARG A 7 -27.008 1.398 1.677 0.06 0.00 H new ATOM 0 HE ARG A 7 -24.966 3.161 0.842 1.00 0.00 H new ATOM 0 HH11 ARG A 7 -28.310 2.390 -0.000 0.26 0.00 H new ATOM 0 HH12 ARG A 7 -28.670 4.030 -0.551 0.26 0.00 H new ATOM 0 HH21 ARG A 7 -25.436 5.261 0.129 0.32 0.00 H new ATOM 0 HH22 ARG A 7 -27.050 5.648 -0.478 0.32 0.00 H new ATOM 117 N ARG A 8 -20.815 1.176 -0.328 0.23 0.00 N ATOM 118 CA ARG A 8 -19.769 1.408 -1.315 0.07 0.00 C ATOM 119 C ARG A 8 -18.749 0.274 -1.304 1.00 0.00 C ATOM 120 O ARG A 8 -18.413 -0.281 -2.351 0.73 0.00 O ATOM 121 CB ARG A 8 -19.068 2.743 -1.044 1.00 0.00 C ATOM 122 CG ARG A 8 -17.962 3.068 -2.037 0.07 0.00 C ATOM 123 CD ARG A 8 -18.509 3.258 -3.444 1.00 0.00 C ATOM 124 NE ARG A 8 -19.467 4.358 -3.513 0.20 0.00 N ATOM 125 CZ ARG A 8 -20.126 4.698 -4.617 1.00 0.00 C ATOM 126 NH1 ARG A 8 -19.938 4.020 -5.743 1.00 0.00 N ATOM 127 NH2 ARG A 8 -20.975 5.715 -4.598 1.00 0.00 N ATOM 0 H ARG A 8 -20.894 1.907 0.379 0.23 0.00 H new ATOM 0 HA ARG A 8 -20.235 1.444 -2.299 0.07 0.00 H new ATOM 0 HB2 ARG A 8 -19.809 3.542 -1.065 1.00 0.00 H new ATOM 0 HB3 ARG A 8 -18.647 2.724 -0.039 1.00 0.00 H new ATOM 0 HG2 ARG A 8 -17.444 3.974 -1.722 0.07 0.00 H new ATOM 0 HG3 ARG A 8 -17.226 2.264 -2.038 0.07 0.00 H new ATOM 0 HD2 ARG A 8 -17.685 3.451 -4.131 1.00 0.00 H new ATOM 0 HD3 ARG A 8 -18.990 2.337 -3.774 1.00 0.00 H new ATOM 0 HE ARG A 8 -19.641 4.897 -2.665 0.20 0.00 H new ATOM 0 HH11 ARG A 8 -19.286 3.236 -5.763 1.00 0.00 H new ATOM 0 HH12 ARG A 8 -20.445 4.284 -6.588 1.00 0.00 H new ATOM 0 HH21 ARG A 8 -21.124 6.239 -3.736 1.00 0.00 H new ATOM 0 HH22 ARG A 8 -21.479 5.974 -5.446 1.00 0.00 H new ATOM 141 N LEU A 9 -18.259 -0.067 -0.114 1.00 0.00 N ATOM 142 CA LEU A 9 -17.278 -1.136 0.032 1.00 0.00 C ATOM 143 C LEU A 9 -17.803 -2.440 -0.561 0.13 0.00 C ATOM 144 O LEU A 9 -17.046 -3.217 -1.143 1.00 0.00 O ATOM 145 CB LEU A 9 -16.923 -1.338 1.507 0.13 0.00 C ATOM 146 CG LEU A 9 -16.221 -0.153 2.173 1.00 0.00 C ATOM 147 CD1 LEU A 9 -16.045 -0.407 3.662 1.00 0.00 C ATOM 148 CD2 LEU A 9 -14.875 0.109 1.516 1.00 0.00 C ATOM 0 H LEU A 9 -18.526 0.382 0.762 1.00 0.00 H new ATOM 0 HA LEU A 9 -16.379 -0.846 -0.512 1.00 0.00 H new ATOM 0 HB2 LEU A 9 -17.838 -1.555 2.058 0.13 0.00 H new ATOM 0 HB3 LEU A 9 -16.282 -2.216 1.594 0.13 0.00 H new ATOM 0 HG LEU A 9 -16.844 0.732 2.044 1.00 0.00 H new ATOM 0 HD11 LEU A 9 -15.544 0.446 4.120 1.00 0.00 H new ATOM 0 HD12 LEU A 9 -17.022 -0.546 4.125 1.00 0.00 H new ATOM 0 HD13 LEU A 9 -15.443 -1.304 3.809 1.00 0.00 H new ATOM 0 HD21 LEU A 9 -14.391 0.955 2.003 1.00 0.00 H new ATOM 0 HD22 LEU A 9 -14.245 -0.775 1.613 1.00 0.00 H new ATOM 0 HD23 LEU A 9 -15.023 0.335 0.460 1.00 0.00 H new ATOM 160 N MET A 10 -19.102 -2.672 -0.410 0.40 0.00 N ATOM 161 CA MET A 10 -19.729 -3.877 -0.937 0.05 0.00 C ATOM 162 C MET A 10 -19.702 -3.869 -2.461 0.23 0.00 C ATOM 163 O MET A 10 -19.532 -4.910 -3.097 0.35 0.00 O ATOM 164 CB MET A 10 -21.171 -3.989 -0.438 1.00 0.00 C ATOM 165 CG MET A 10 -21.290 -3.985 1.078 0.16 0.00 C ATOM 166 SD MET A 10 -22.995 -4.136 1.643 0.89 0.00 S ATOM 167 CE MET A 10 -22.774 -4.012 3.415 0.06 0.00 C ATOM 0 H MET A 10 -19.741 -2.041 0.073 0.40 0.00 H new ATOM 0 HA MET A 10 -19.167 -4.741 -0.582 0.05 0.00 H new ATOM 0 HB2 MET A 10 -21.752 -3.160 -0.842 1.00 0.00 H new ATOM 0 HB3 MET A 10 -21.611 -4.907 -0.827 1.00 0.00 H new ATOM 0 HG2 MET A 10 -20.702 -4.807 1.487 0.16 0.00 H new ATOM 0 HG3 MET A 10 -20.862 -3.062 1.469 0.16 0.00 H new ATOM 0 HE1 MET A 10 -23.743 -4.088 3.909 0.06 0.00 H new ATOM 0 HE2 MET A 10 -22.127 -4.819 3.758 0.06 0.00 H new ATOM 0 HE3 MET A 10 -22.317 -3.053 3.658 0.06 0.00 H new ATOM 177 N ARG A 11 -19.868 -2.683 -3.039 1.00 0.00 N ATOM 178 CA ARG A 11 -19.855 -2.529 -4.490 0.18 0.00 C ATOM 179 C ARG A 11 -18.472 -2.841 -5.051 0.09 0.00 C ATOM 180 O ARG A 11 -18.342 -3.354 -6.162 1.00 0.00 O ATOM 181 CB ARG A 11 -20.264 -1.104 -4.877 0.05 0.00 C ATOM 182 CG ARG A 11 -21.700 -0.759 -4.515 0.41 0.00 C ATOM 183 CD ARG A 11 -22.693 -1.527 -5.373 0.08 0.00 C ATOM 184 NE ARG A 11 -24.075 -1.195 -5.040 0.33 0.00 N ATOM 185 CZ ARG A 11 -25.112 -1.468 -5.825 1.00 0.00 C ATOM 186 NH1 ARG A 11 -24.927 -2.086 -6.984 0.06 0.00 N ATOM 187 NH2 ARG A 11 -26.337 -1.125 -5.451 0.11 0.00 N ATOM 0 H ARG A 11 -20.013 -1.814 -2.525 1.00 0.00 H new ATOM 0 HA ARG A 11 -20.571 -3.232 -4.914 0.18 0.00 H new ATOM 0 HB2 ARG A 11 -19.595 -0.398 -4.385 0.05 0.00 H new ATOM 0 HB3 ARG A 11 -20.129 -0.976 -5.951 0.05 0.00 H new ATOM 0 HG2 ARG A 11 -21.875 -0.986 -3.463 0.41 0.00 H new ATOM 0 HG3 ARG A 11 -21.861 0.312 -4.641 0.41 0.00 H new ATOM 0 HD2 ARG A 11 -22.510 -1.306 -6.425 0.08 0.00 H new ATOM 0 HD3 ARG A 11 -22.535 -2.597 -5.240 0.08 0.00 H new ATOM 0 HE ARG A 11 -24.255 -0.726 -4.152 0.33 0.00 H new ATOM 0 HH11 ARG A 11 -23.987 -2.353 -7.275 0.06 0.00 H new ATOM 0 HH12 ARG A 11 -25.725 -2.294 -7.584 0.06 0.00 H new ATOM 0 HH21 ARG A 11 -26.484 -0.651 -4.560 0.11 0.00 H new ATOM 0 HH22 ARG A 11 -27.132 -1.335 -6.054 0.11 0.00 H new ATOM 201 N ASP A 12 -17.442 -2.525 -4.273 0.66 0.00 N ATOM 202 CA ASP A 12 -16.066 -2.773 -4.687 0.23 0.00 C ATOM 203 C ASP A 12 -15.723 -4.255 -4.585 0.95 0.00 C ATOM 204 O ASP A 12 -14.906 -4.765 -5.350 0.05 0.00 O ATOM 205 CB ASP A 12 -15.095 -1.946 -3.837 0.48 0.00 C ATOM 206 CG ASP A 12 -15.220 -0.457 -4.097 0.17 0.00 C ATOM 207 OD1 ASP A 12 -16.052 0.194 -3.435 0.07 0.00 O ATOM 208 OD2 ASP A 12 -14.482 0.058 -4.965 1.00 0.00 O ATOM 0 H ASP A 12 -17.534 -2.096 -3.352 0.66 0.00 H new ATOM 0 HA ASP A 12 -15.968 -2.471 -5.730 0.23 0.00 H new ATOM 0 HB2 ASP A 12 -15.281 -2.144 -2.782 0.48 0.00 H new ATOM 0 HB3 ASP A 12 -14.073 -2.264 -4.045 0.48 0.00 H new ATOM 213 N PHE A 13 -16.352 -4.943 -3.636 0.09 0.00 N ATOM 214 CA PHE A 13 -16.107 -6.368 -3.436 1.00 0.00 C ATOM 215 C PHE A 13 -16.675 -7.194 -4.589 1.00 0.00 C ATOM 216 O PHE A 13 -15.980 -8.037 -5.157 0.05 0.00 O ATOM 217 CB PHE A 13 -16.707 -6.835 -2.108 0.07 0.00 C ATOM 218 CG PHE A 13 -16.491 -8.298 -1.828 0.15 0.00 C ATOM 219 CD1 PHE A 13 -15.242 -8.876 -1.999 1.00 0.00 C ATOM 220 CD2 PHE A 13 -17.539 -9.093 -1.393 0.11 0.00 C ATOM 221 CE1 PHE A 13 -15.043 -10.219 -1.741 0.06 0.00 C ATOM 222 CE2 PHE A 13 -17.346 -10.437 -1.133 1.00 0.00 C ATOM 223 CZ PHE A 13 -16.096 -11.000 -1.306 1.00 0.00 C ATOM 0 H PHE A 13 -17.034 -4.538 -2.995 0.09 0.00 H new ATOM 0 HA PHE A 13 -15.028 -6.519 -3.408 1.00 0.00 H new ATOM 0 HB2 PHE A 13 -16.272 -6.251 -1.297 0.07 0.00 H new ATOM 0 HB3 PHE A 13 -17.777 -6.629 -2.110 0.07 0.00 H new ATOM 0 HD1 PHE A 13 -14.415 -8.269 -2.338 1.00 0.00 H new ATOM 0 HD2 PHE A 13 -18.518 -8.658 -1.255 0.11 0.00 H new ATOM 0 HE1 PHE A 13 -14.066 -10.657 -1.879 0.06 0.00 H new ATOM 0 HE2 PHE A 13 -18.171 -11.046 -0.795 1.00 0.00 H new ATOM 0 HZ PHE A 13 -15.943 -12.049 -1.101 1.00 0.00 H new ATOM 233 N LYS A 14 -17.940 -6.955 -4.929 0.10 0.00 N ATOM 234 CA LYS A 14 -18.586 -7.687 -6.016 0.17 0.00 C ATOM 235 C LYS A 14 -17.875 -7.432 -7.341 0.45 0.00 C ATOM 236 O LYS A 14 -17.824 -8.305 -8.207 0.42 0.00 O ATOM 237 CB LYS A 14 -20.063 -7.301 -6.123 0.06 0.00 C ATOM 238 CG LYS A 14 -20.302 -5.813 -6.311 0.05 0.00 C ATOM 239 CD LYS A 14 -20.397 -5.439 -7.782 0.22 0.00 C ATOM 240 CE LYS A 14 -20.905 -4.018 -7.965 0.18 0.00 C ATOM 241 NZ LYS A 14 -22.288 -3.851 -7.436 0.83 0.00 N ATOM 0 H LYS A 14 -18.535 -6.265 -4.471 0.10 0.00 H new ATOM 0 HA LYS A 14 -18.520 -8.751 -5.791 0.17 0.00 H new ATOM 0 HB2 LYS A 14 -20.508 -7.838 -6.960 0.06 0.00 H new ATOM 0 HB3 LYS A 14 -20.580 -7.630 -5.222 0.06 0.00 H new ATOM 0 HG2 LYS A 14 -21.222 -5.525 -5.802 0.05 0.00 H new ATOM 0 HG3 LYS A 14 -19.492 -5.253 -5.845 0.05 0.00 H new ATOM 0 HD2 LYS A 14 -19.417 -5.539 -8.248 0.22 0.00 H new ATOM 0 HD3 LYS A 14 -21.064 -6.133 -8.292 0.22 0.00 H new ATOM 0 HE2 LYS A 14 -20.235 -3.325 -7.456 0.18 0.00 H new ATOM 0 HE3 LYS A 14 -20.887 -3.759 -9.024 0.18 0.00 H new ATOM 0 HZ1 LYS A 14 -22.656 -2.919 -7.713 0.83 0.00 H new ATOM 0 HZ2 LYS A 14 -22.901 -4.595 -7.826 0.83 0.00 H new ATOM 0 HZ3 LYS A 14 -22.274 -3.923 -6.399 0.83 0.00 H new ATOM 255 N ARG A 15 -17.327 -6.231 -7.489 1.00 0.00 N ATOM 256 CA ARG A 15 -16.613 -5.858 -8.703 0.98 0.00 C ATOM 257 C ARG A 15 -15.201 -6.433 -8.694 1.00 0.00 C ATOM 258 O ARG A 15 -14.599 -6.652 -9.745 1.00 0.00 O ATOM 259 CB ARG A 15 -16.557 -4.336 -8.843 0.18 0.00 C ATOM 260 CG ARG A 15 -15.890 -3.865 -10.127 0.11 0.00 C ATOM 261 CD ARG A 15 -15.901 -2.349 -10.238 1.00 0.00 C ATOM 262 NE ARG A 15 -15.271 -1.886 -11.473 1.00 0.00 N ATOM 263 CZ ARG A 15 -15.191 -0.605 -11.826 0.18 0.00 C ATOM 264 NH1 ARG A 15 -15.704 0.334 -11.043 0.65 0.00 N ATOM 265 NH2 ARG A 15 -14.599 -0.265 -12.960 0.29 0.00 N ATOM 0 H ARG A 15 -17.364 -5.498 -6.781 1.00 0.00 H new ATOM 0 HA ARG A 15 -17.152 -6.271 -9.556 0.98 0.00 H new ATOM 0 HB2 ARG A 15 -17.571 -3.939 -8.804 0.18 0.00 H new ATOM 0 HB3 ARG A 15 -16.019 -3.921 -7.991 0.18 0.00 H new ATOM 0 HG2 ARG A 15 -14.862 -4.225 -10.157 0.11 0.00 H new ATOM 0 HG3 ARG A 15 -16.405 -4.297 -10.985 0.11 0.00 H new ATOM 0 HD2 ARG A 15 -16.929 -1.990 -10.199 1.00 0.00 H new ATOM 0 HD3 ARG A 15 -15.381 -1.919 -9.382 1.00 0.00 H new ATOM 0 HE ARG A 15 -14.870 -2.584 -12.100 1.00 0.00 H new ATOM 0 HH11 ARG A 15 -16.161 0.075 -10.169 0.65 0.00 H new ATOM 0 HH12 ARG A 15 -15.642 1.315 -11.315 0.65 0.00 H new ATOM 0 HH21 ARG A 15 -14.203 -0.985 -13.565 0.29 0.00 H new ATOM 0 HH22 ARG A 15 -14.538 0.717 -13.229 0.29 0.00 H new ATOM 279 N LEU A 16 -14.681 -6.675 -7.495 0.18 0.00 N ATOM 280 CA LEU A 16 -13.340 -7.222 -7.338 0.06 0.00 C ATOM 281 C LEU A 16 -13.301 -8.700 -7.715 1.00 0.00 C ATOM 282 O LEU A 16 -12.389 -9.150 -8.409 1.00 0.00 O ATOM 283 CB LEU A 16 -12.870 -7.045 -5.895 0.21 0.00 C ATOM 284 CG LEU A 16 -11.434 -7.490 -5.621 0.10 0.00 C ATOM 285 CD1 LEU A 16 -10.445 -6.502 -6.220 0.85 0.00 C ATOM 286 CD2 LEU A 16 -11.201 -7.639 -4.127 0.08 0.00 C ATOM 0 H LEU A 16 -15.170 -6.500 -6.617 0.18 0.00 H new ATOM 0 HA LEU A 16 -12.673 -6.680 -8.008 0.06 0.00 H new ATOM 0 HB2 LEU A 16 -12.966 -5.993 -5.625 0.21 0.00 H new ATOM 0 HB3 LEU A 16 -13.538 -7.605 -5.240 0.21 0.00 H new ATOM 0 HG LEU A 16 -11.277 -8.460 -6.093 0.10 0.00 H new ATOM 0 HD11 LEU A 16 -9.428 -6.836 -6.015 0.85 0.00 H new ATOM 0 HD12 LEU A 16 -10.597 -6.443 -7.298 0.85 0.00 H new ATOM 0 HD13 LEU A 16 -10.600 -5.518 -5.777 0.85 0.00 H new ATOM 0 HD21 LEU A 16 -10.174 -7.956 -3.949 0.08 0.00 H new ATOM 0 HD22 LEU A 16 -11.376 -6.683 -3.634 0.08 0.00 H new ATOM 0 HD23 LEU A 16 -11.886 -8.385 -3.725 0.08 0.00 H new ATOM 298 N GLN A 17 -14.295 -9.452 -7.250 0.16 0.00 N ATOM 299 CA GLN A 17 -14.374 -10.880 -7.528 0.19 0.00 C ATOM 300 C GLN A 17 -14.568 -11.152 -9.017 0.08 0.00 C ATOM 301 O GLN A 17 -13.974 -12.078 -9.568 0.55 0.00 O ATOM 302 CB GLN A 17 -15.520 -11.503 -6.734 0.82 0.00 C ATOM 303 CG GLN A 17 -15.179 -11.771 -5.276 0.89 0.00 C ATOM 304 CD GLN A 17 -14.016 -12.734 -5.120 0.28 0.00 C ATOM 305 OE1 GLN A 17 -12.859 -12.320 -5.053 1.00 0.00 O ATOM 306 NE2 GLN A 17 -14.320 -14.025 -5.064 0.94 0.00 N ATOM 0 H GLN A 17 -15.059 -9.093 -6.677 0.16 0.00 H new ATOM 0 HA GLN A 17 -13.430 -11.332 -7.224 0.19 0.00 H new ATOM 0 HB2 GLN A 17 -16.384 -10.840 -6.780 0.82 0.00 H new ATOM 0 HB3 GLN A 17 -15.811 -12.440 -7.208 0.82 0.00 H new ATOM 0 HG2 GLN A 17 -14.936 -10.829 -4.784 0.89 0.00 H new ATOM 0 HG3 GLN A 17 -16.054 -12.178 -4.770 0.89 0.00 H new ATOM 0 HE21 GLN A 17 -15.294 -14.323 -5.124 0.94 0.00 H new ATOM 0 HE22 GLN A 17 -13.580 -14.719 -4.961 0.94 0.00 H new ATOM 315 N GLU A 18 -15.402 -10.343 -9.661 1.00 0.00 N ATOM 316 CA GLU A 18 -15.675 -10.511 -11.084 0.21 0.00 C ATOM 317 C GLU A 18 -14.466 -10.127 -11.931 0.27 0.00 C ATOM 318 O GLU A 18 -14.345 -10.553 -13.079 0.96 0.00 O ATOM 319 CB GLU A 18 -16.886 -9.673 -11.501 0.94 0.00 C ATOM 320 CG GLU A 18 -16.672 -8.176 -11.373 1.00 0.00 C ATOM 321 CD GLU A 18 -17.890 -7.379 -11.798 0.62 0.00 C ATOM 322 OE1 GLU A 18 -18.761 -7.121 -10.940 0.09 0.00 O ATOM 323 OE2 GLU A 18 -17.975 -7.016 -12.990 1.00 0.00 O ATOM 0 H GLU A 18 -15.899 -9.567 -9.223 1.00 0.00 H new ATOM 0 HA GLU A 18 -15.892 -11.565 -11.254 0.21 0.00 H new ATOM 0 HB2 GLU A 18 -17.138 -9.907 -12.535 0.94 0.00 H new ATOM 0 HB3 GLU A 18 -17.742 -9.961 -10.891 0.94 0.00 H new ATOM 0 HG2 GLU A 18 -16.426 -7.934 -10.339 1.00 0.00 H new ATOM 0 HG3 GLU A 18 -15.817 -7.881 -11.982 1.00 0.00 H new ATOM 330 N ASP A 19 -13.572 -9.323 -11.360 0.09 0.00 N ATOM 331 CA ASP A 19 -12.381 -8.887 -12.077 0.57 0.00 C ATOM 332 C ASP A 19 -11.404 -8.164 -11.148 0.08 0.00 C ATOM 333 O ASP A 19 -11.424 -6.936 -11.048 0.58 0.00 O ATOM 334 CB ASP A 19 -12.775 -7.971 -13.237 0.38 0.00 C ATOM 335 CG ASP A 19 -11.571 -7.413 -13.971 1.00 0.00 C ATOM 336 OD1 ASP A 19 -11.049 -8.109 -14.867 1.00 0.00 O ATOM 337 OD2 ASP A 19 -11.149 -6.282 -13.650 0.06 0.00 O ATOM 0 H ASP A 19 -13.650 -8.963 -10.409 0.09 0.00 H new ATOM 0 HA ASP A 19 -11.880 -9.773 -12.468 0.57 0.00 H new ATOM 0 HB2 ASP A 19 -13.399 -8.526 -13.938 0.38 0.00 H new ATOM 0 HB3 ASP A 19 -13.378 -7.147 -12.856 0.38 0.00 H new ATOM 342 N PRO A 20 -10.540 -8.920 -10.443 0.50 0.00 N ATOM 343 CA PRO A 20 -9.551 -8.344 -9.528 0.33 0.00 C ATOM 344 C PRO A 20 -8.332 -7.790 -10.266 1.00 0.00 C ATOM 345 O PRO A 20 -8.101 -8.127 -11.430 0.10 0.00 O ATOM 346 CB PRO A 20 -9.152 -9.537 -8.660 0.18 0.00 C ATOM 347 CG PRO A 20 -9.322 -10.721 -9.548 1.00 0.00 C ATOM 348 CD PRO A 20 -10.469 -10.396 -10.472 0.11 0.00 C ATOM 0 HA PRO A 20 -9.950 -7.499 -8.967 0.33 0.00 H new ATOM 0 HB2 PRO A 20 -8.123 -9.447 -8.312 0.18 0.00 H new ATOM 0 HB3 PRO A 20 -9.783 -9.612 -7.774 0.18 0.00 H new ATOM 0 HG2 PRO A 20 -8.411 -10.917 -10.113 1.00 0.00 H new ATOM 0 HG3 PRO A 20 -9.534 -11.617 -8.965 1.00 0.00 H new ATOM 0 HD2 PRO A 20 -10.288 -10.768 -11.480 0.11 0.00 H new ATOM 0 HD3 PRO A 20 -11.400 -10.848 -10.128 0.11 0.00 H new ATOM 356 N PRO A 21 -7.533 -6.929 -9.604 1.00 0.00 N ATOM 357 CA PRO A 21 -6.337 -6.340 -10.211 0.72 0.00 C ATOM 358 C PRO A 21 -5.184 -7.336 -10.294 1.00 0.00 C ATOM 359 O PRO A 21 -4.984 -8.143 -9.386 0.14 0.00 O ATOM 360 CB PRO A 21 -5.992 -5.194 -9.260 0.26 0.00 C ATOM 361 CG PRO A 21 -6.506 -5.638 -7.935 1.00 0.00 C ATOM 362 CD PRO A 21 -7.733 -6.464 -8.217 1.00 0.00 C ATOM 0 HA PRO A 21 -6.510 -6.021 -11.239 0.72 0.00 H new ATOM 0 HB2 PRO A 21 -4.917 -5.015 -9.229 0.26 0.00 H new ATOM 0 HB3 PRO A 21 -6.461 -4.262 -9.575 0.26 0.00 H new ATOM 0 HG2 PRO A 21 -5.756 -6.223 -7.403 1.00 0.00 H new ATOM 0 HG3 PRO A 21 -6.749 -4.782 -7.305 1.00 0.00 H new ATOM 0 HD2 PRO A 21 -7.820 -7.300 -7.523 1.00 0.00 H new ATOM 0 HD3 PRO A 21 -8.644 -5.873 -8.120 1.00 0.00 H new ATOM 370 N VAL A 22 -4.431 -7.274 -11.387 0.52 0.00 N ATOM 371 CA VAL A 22 -3.302 -8.176 -11.587 0.07 0.00 C ATOM 372 C VAL A 22 -2.028 -7.617 -10.961 1.00 0.00 C ATOM 373 O VAL A 22 -1.655 -6.470 -11.207 0.40 0.00 O ATOM 374 CB VAL A 22 -3.052 -8.437 -13.086 0.22 0.00 C ATOM 375 CG1 VAL A 22 -1.990 -9.508 -13.274 0.15 0.00 C ATOM 376 CG2 VAL A 22 -4.346 -8.832 -13.781 0.07 0.00 C ATOM 0 H VAL A 22 -4.581 -6.610 -12.147 0.52 0.00 H new ATOM 0 HA VAL A 22 -3.559 -9.115 -11.098 0.07 0.00 H new ATOM 0 HB VAL A 22 -2.688 -7.515 -13.540 0.22 0.00 H new ATOM 0 HG11 VAL A 22 -1.828 -9.677 -14.339 0.15 0.00 H new ATOM 0 HG12 VAL A 22 -1.058 -9.181 -12.813 0.15 0.00 H new ATOM 0 HG13 VAL A 22 -2.321 -10.435 -12.805 0.15 0.00 H new ATOM 0 HG21 VAL A 22 -4.151 -9.012 -14.838 0.07 0.00 H new ATOM 0 HG22 VAL A 22 -4.742 -9.740 -13.325 0.07 0.00 H new ATOM 0 HG23 VAL A 22 -5.074 -8.027 -13.679 0.07 0.00 H new ATOM 386 N GLY A 23 -1.366 -8.437 -10.148 0.34 0.00 N ATOM 387 CA GLY A 23 -0.139 -8.013 -9.500 1.00 0.00 C ATOM 388 C GLY A 23 -0.333 -7.701 -8.029 0.15 0.00 C ATOM 389 O GLY A 23 0.616 -7.754 -7.246 0.43 0.00 O ATOM 0 H GLY A 23 -1.659 -9.389 -9.927 0.34 0.00 H new ATOM 0 HA2 GLY A 23 0.612 -8.796 -9.605 1.00 0.00 H new ATOM 0 HA3 GLY A 23 0.248 -7.129 -10.007 1.00 0.00 H new ATOM 393 N VAL A 24 -1.566 -7.376 -7.651 0.06 0.00 N ATOM 394 CA VAL A 24 -1.883 -7.053 -6.265 0.46 0.00 C ATOM 395 C VAL A 24 -3.232 -7.634 -5.854 1.00 0.00 C ATOM 396 O VAL A 24 -4.188 -7.612 -6.629 0.07 0.00 O ATOM 397 CB VAL A 24 -1.904 -5.528 -6.036 0.87 0.00 C ATOM 398 CG1 VAL A 24 -0.508 -4.947 -6.183 0.23 0.00 C ATOM 399 CG2 VAL A 24 -2.870 -4.858 -7.001 0.16 0.00 C ATOM 0 H VAL A 24 -2.362 -7.330 -8.287 0.06 0.00 H new ATOM 0 HA VAL A 24 -1.099 -7.498 -5.652 0.46 0.00 H new ATOM 0 HB VAL A 24 -2.248 -5.336 -5.019 0.87 0.00 H new ATOM 0 HG11 VAL A 24 -0.543 -3.870 -6.018 0.23 0.00 H new ATOM 0 HG12 VAL A 24 0.156 -5.405 -5.450 0.23 0.00 H new ATOM 0 HG13 VAL A 24 -0.134 -5.148 -7.187 0.23 0.00 H new ATOM 0 HG21 VAL A 24 -2.872 -3.782 -6.825 0.16 0.00 H new ATOM 0 HG22 VAL A 24 -2.557 -5.058 -8.026 0.16 0.00 H new ATOM 0 HG23 VAL A 24 -3.874 -5.253 -6.844 0.16 0.00 H new ATOM 409 N SER A 25 -3.300 -8.157 -4.635 0.82 0.00 N ATOM 410 CA SER A 25 -4.535 -8.735 -4.120 0.14 0.00 C ATOM 411 C SER A 25 -5.047 -7.927 -2.934 0.28 0.00 C ATOM 412 O SER A 25 -4.262 -7.439 -2.127 1.00 0.00 O ATOM 413 CB SER A 25 -4.306 -10.189 -3.705 0.46 0.00 C ATOM 414 OG SER A 25 -3.879 -10.973 -4.806 1.00 0.00 O ATOM 0 H SER A 25 -2.514 -8.193 -3.985 0.82 0.00 H new ATOM 0 HA SER A 25 -5.285 -8.708 -4.910 0.14 0.00 H new ATOM 0 HB2 SER A 25 -3.558 -10.231 -2.913 0.46 0.00 H new ATOM 0 HB3 SER A 25 -5.227 -10.603 -3.295 0.46 0.00 H new ATOM 0 HG SER A 25 -3.738 -11.898 -4.514 1.00 0.00 H new ATOM 420 N GLY A 26 -6.364 -7.778 -2.841 0.09 0.00 N ATOM 421 CA GLY A 26 -6.945 -7.026 -1.743 0.16 0.00 C ATOM 422 C GLY A 26 -8.410 -7.348 -1.528 0.22 0.00 C ATOM 423 O GLY A 26 -9.283 -6.707 -2.111 0.69 0.00 O ATOM 0 H GLY A 26 -7.038 -8.163 -3.503 0.09 0.00 H new ATOM 0 HA2 GLY A 26 -6.392 -7.239 -0.828 0.16 0.00 H new ATOM 0 HA3 GLY A 26 -6.836 -5.959 -1.940 0.16 0.00 H new ATOM 427 N ALA A 27 -8.679 -8.336 -0.679 0.20 0.00 N ATOM 428 CA ALA A 27 -10.048 -8.744 -0.387 0.08 0.00 C ATOM 429 C ALA A 27 -10.202 -9.139 1.081 1.00 0.00 C ATOM 430 O ALA A 27 -9.230 -9.527 1.728 1.00 0.00 O ATOM 431 CB ALA A 27 -10.455 -9.897 -1.293 0.51 0.00 C ATOM 0 H ALA A 27 -7.966 -8.869 -0.181 0.20 0.00 H new ATOM 0 HA ALA A 27 -10.705 -7.896 -0.577 0.08 0.00 H new ATOM 0 HB1 ALA A 27 -11.479 -10.194 -1.066 0.51 0.00 H new ATOM 0 HB2 ALA A 27 -10.391 -9.582 -2.334 0.51 0.00 H new ATOM 0 HB3 ALA A 27 -9.787 -10.743 -1.128 0.51 0.00 H new ATOM 437 N PRO A 28 -11.430 -9.046 1.630 0.11 0.00 N ATOM 438 CA PRO A 28 -11.693 -9.396 3.029 0.19 0.00 C ATOM 439 C PRO A 28 -11.573 -10.895 3.285 1.00 0.00 C ATOM 440 O PRO A 28 -12.290 -11.697 2.689 0.27 0.00 O ATOM 441 CB PRO A 28 -13.135 -8.929 3.251 1.00 0.00 C ATOM 442 CG PRO A 28 -13.752 -8.946 1.895 1.00 0.00 C ATOM 443 CD PRO A 28 -12.651 -8.594 0.934 1.00 0.00 C ATOM 0 HA PRO A 28 -10.973 -8.934 3.705 0.19 0.00 H new ATOM 0 HB2 PRO A 28 -13.665 -9.592 3.935 1.00 0.00 H new ATOM 0 HB3 PRO A 28 -13.165 -7.930 3.687 1.00 0.00 H new ATOM 0 HG2 PRO A 28 -14.169 -9.927 1.668 1.00 0.00 H new ATOM 0 HG3 PRO A 28 -14.571 -8.229 1.830 1.00 0.00 H new ATOM 0 HD2 PRO A 28 -12.777 -9.099 -0.024 1.00 0.00 H new ATOM 0 HD3 PRO A 28 -12.624 -7.524 0.729 1.00 0.00 H new ATOM 451 N SER A 29 -10.658 -11.262 4.178 0.17 0.00 N ATOM 452 CA SER A 29 -10.438 -12.663 4.520 0.08 0.00 C ATOM 453 C SER A 29 -10.784 -12.923 5.983 0.07 0.00 C ATOM 454 O SER A 29 -9.954 -12.722 6.870 0.14 0.00 O ATOM 455 CB SER A 29 -8.985 -13.057 4.249 0.08 0.00 C ATOM 456 OG SER A 29 -8.653 -12.879 2.884 0.96 0.00 O ATOM 0 H SER A 29 -10.057 -10.607 4.678 0.17 0.00 H new ATOM 0 HA SER A 29 -11.092 -13.271 3.895 0.08 0.00 H new ATOM 0 HB2 SER A 29 -8.320 -12.455 4.869 0.08 0.00 H new ATOM 0 HB3 SER A 29 -8.829 -14.098 4.531 0.08 0.00 H new ATOM 0 HG SER A 29 -7.719 -13.136 2.738 0.96 0.00 H new ATOM 462 N GLU A 30 -12.022 -13.355 6.223 1.00 0.00 N ATOM 463 CA GLU A 30 -12.497 -13.645 7.576 1.00 0.00 C ATOM 464 C GLU A 30 -12.555 -12.378 8.429 0.18 0.00 C ATOM 465 O GLU A 30 -13.013 -12.407 9.572 0.19 0.00 O ATOM 466 CB GLU A 30 -11.599 -14.687 8.249 0.46 0.00 C ATOM 467 CG GLU A 30 -11.516 -15.997 7.485 0.08 0.00 C ATOM 468 CD GLU A 30 -10.632 -17.019 8.174 1.00 0.00 C ATOM 469 OE1 GLU A 30 -9.406 -16.999 7.938 0.07 0.00 O ATOM 470 OE2 GLU A 30 -11.168 -17.840 8.948 0.74 0.00 O ATOM 0 H GLU A 30 -12.717 -13.513 5.494 1.00 0.00 H new ATOM 0 HA GLU A 30 -13.507 -14.046 7.492 1.00 0.00 H new ATOM 0 HB2 GLU A 30 -10.596 -14.275 8.358 0.46 0.00 H new ATOM 0 HB3 GLU A 30 -11.974 -14.884 9.253 0.46 0.00 H new ATOM 0 HG2 GLU A 30 -12.518 -16.409 7.368 0.08 0.00 H new ATOM 0 HG3 GLU A 30 -11.131 -15.805 6.483 0.08 0.00 H new ATOM 477 N ASN A 31 -12.092 -11.266 7.863 0.10 0.00 N ATOM 478 CA ASN A 31 -12.090 -9.988 8.564 0.06 0.00 C ATOM 479 C ASN A 31 -13.329 -9.172 8.208 0.09 0.00 C ATOM 480 O ASN A 31 -13.822 -9.240 7.082 0.22 0.00 O ATOM 481 CB ASN A 31 -10.828 -9.194 8.218 0.06 0.00 C ATOM 482 CG ASN A 31 -9.560 -9.920 8.622 0.40 0.00 C ATOM 483 OD1 ASN A 31 -9.545 -10.678 9.590 0.61 0.00 O ATOM 484 ND2 ASN A 31 -8.485 -9.687 7.877 1.00 0.00 N ATOM 0 H ASN A 31 -11.712 -11.226 6.917 0.10 0.00 H new ATOM 0 HA ASN A 31 -12.103 -10.189 9.635 0.06 0.00 H new ATOM 0 HB2 ASN A 31 -10.807 -9.000 7.146 0.06 0.00 H new ATOM 0 HB3 ASN A 31 -10.863 -8.225 8.716 0.06 0.00 H new ATOM 0 HD21 ASN A 31 -7.601 -10.145 8.099 1.00 0.00 H new ATOM 0 HD22 ASN A 31 -8.543 -9.050 7.082 1.00 0.00 H new ATOM 491 N ASN A 32 -13.826 -8.409 9.175 0.15 0.00 N ATOM 492 CA ASN A 32 -15.004 -7.576 8.964 1.00 0.00 C ATOM 493 C ASN A 32 -14.806 -6.649 7.767 0.35 0.00 C ATOM 494 O ASN A 32 -13.681 -6.440 7.314 0.17 0.00 O ATOM 495 CB ASN A 32 -15.301 -6.752 10.219 0.20 0.00 C ATOM 496 CG ASN A 32 -15.566 -7.622 11.431 0.36 0.00 C ATOM 497 OD1 ASN A 32 -16.706 -8.003 11.700 1.00 0.00 O ATOM 498 ND2 ASN A 32 -14.511 -7.941 12.173 0.40 0.00 N ATOM 0 H ASN A 32 -13.431 -8.350 10.114 0.15 0.00 H new ATOM 0 HA ASN A 32 -15.851 -8.230 8.758 1.00 0.00 H new ATOM 0 HB2 ASN A 32 -14.458 -6.093 10.426 0.20 0.00 H new ATOM 0 HB3 ASN A 32 -16.166 -6.115 10.036 0.20 0.00 H new ATOM 0 HD21 ASN A 32 -14.628 -8.523 13.002 0.40 0.00 H new ATOM 0 HD22 ASN A 32 -13.584 -7.604 11.913 0.40 0.00 H new ATOM 505 N ILE A 33 -15.905 -6.095 7.263 0.13 0.00 N ATOM 506 CA ILE A 33 -15.854 -5.192 6.117 0.38 0.00 C ATOM 507 C ILE A 33 -14.942 -3.997 6.395 1.00 0.00 C ATOM 508 O ILE A 33 -14.428 -3.367 5.470 0.15 0.00 O ATOM 509 CB ILE A 33 -17.263 -4.688 5.743 1.00 0.00 C ATOM 510 CG1 ILE A 33 -17.215 -3.854 4.459 0.74 0.00 C ATOM 511 CG2 ILE A 33 -17.857 -3.878 6.888 0.07 0.00 C ATOM 512 CD1 ILE A 33 -18.584 -3.506 3.911 0.09 0.00 C ATOM 0 H ILE A 33 -16.843 -6.256 7.631 0.13 0.00 H new ATOM 0 HA ILE A 33 -15.447 -5.759 5.279 0.38 0.00 H new ATOM 0 HB ILE A 33 -17.903 -5.552 5.563 1.00 0.00 H new ATOM 0 HG12 ILE A 33 -16.666 -2.933 4.654 0.74 0.00 H new ATOM 0 HG13 ILE A 33 -16.658 -4.403 3.700 0.74 0.00 H new ATOM 0 HG21 ILE A 33 -18.851 -3.529 6.609 0.07 0.00 H new ATOM 0 HG22 ILE A 33 -17.928 -4.504 7.778 0.07 0.00 H new ATOM 0 HG23 ILE A 33 -17.217 -3.021 7.098 0.07 0.00 H new ATOM 0 HD11 ILE A 33 -18.473 -2.915 3.002 0.09 0.00 H new ATOM 0 HD12 ILE A 33 -19.129 -4.422 3.684 0.09 0.00 H new ATOM 0 HD13 ILE A 33 -19.137 -2.930 4.653 0.09 0.00 H new ATOM 524 N MET A 34 -14.740 -3.695 7.673 1.00 0.00 N ATOM 525 CA MET A 34 -13.889 -2.578 8.072 0.07 0.00 C ATOM 526 C MET A 34 -12.438 -2.829 7.673 0.08 0.00 C ATOM 527 O MET A 34 -11.870 -2.090 6.867 0.32 0.00 O ATOM 528 CB MET A 34 -13.981 -2.353 9.582 1.00 0.00 C ATOM 529 CG MET A 34 -15.386 -2.035 10.064 0.60 0.00 C ATOM 530 SD MET A 34 -15.481 -1.848 11.854 0.24 0.00 S ATOM 531 CE MET A 34 -17.226 -1.505 12.067 0.23 0.00 C ATOM 0 H MET A 34 -15.154 -4.208 8.451 1.00 0.00 H new ATOM 0 HA MET A 34 -14.241 -1.685 7.556 0.07 0.00 H new ATOM 0 HB2 MET A 34 -13.622 -3.245 10.096 1.00 0.00 H new ATOM 0 HB3 MET A 34 -13.316 -1.535 9.860 1.00 0.00 H new ATOM 0 HG2 MET A 34 -15.730 -1.117 9.588 0.60 0.00 H new ATOM 0 HG3 MET A 34 -16.062 -2.830 9.749 0.60 0.00 H new ATOM 0 HE1 MET A 34 -17.443 -1.365 13.126 0.23 0.00 H new ATOM 0 HE2 MET A 34 -17.488 -0.599 11.520 0.23 0.00 H new ATOM 0 HE3 MET A 34 -17.811 -2.342 11.685 0.23 0.00 H new ATOM 541 N GLN A 35 -11.842 -3.873 8.242 0.59 0.00 N ATOM 542 CA GLN A 35 -10.456 -4.218 7.943 0.21 0.00 C ATOM 543 C GLN A 35 -10.384 -5.234 6.808 0.72 0.00 C ATOM 544 O GLN A 35 -11.096 -6.238 6.812 0.34 0.00 O ATOM 545 CB GLN A 35 -9.765 -4.768 9.194 0.68 0.00 C ATOM 546 CG GLN A 35 -8.289 -5.075 8.991 0.99 0.00 C ATOM 547 CD GLN A 35 -7.582 -5.450 10.280 0.21 0.00 C ATOM 548 OE1 GLN A 35 -8.024 -4.872 11.392 0.41 0.00 O flip ATOM 549 NE2 GLN A 35 -6.642 -6.245 10.275 0.09 0.00 N flip ATOM 0 H GLN A 35 -12.296 -4.494 8.912 0.59 0.00 H new ATOM 0 HA GLN A 35 -9.938 -3.313 7.625 0.21 0.00 H new ATOM 0 HB2 GLN A 35 -9.869 -4.045 10.003 0.68 0.00 H new ATOM 0 HB3 GLN A 35 -10.276 -5.677 9.511 0.68 0.00 H new ATOM 0 HG2 GLN A 35 -8.188 -5.891 8.276 0.99 0.00 H new ATOM 0 HG3 GLN A 35 -7.799 -4.205 8.553 0.99 0.00 H new ATOM 0 HE21 GLN A 35 -6.335 -6.666 9.398 0.09 0.00 H new ATOM 0 HE22 GLN A 35 -6.171 -6.483 11.148 0.09 0.00 H new ATOM 558 N TRP A 36 -9.516 -4.967 5.834 0.55 0.00 N ATOM 559 CA TRP A 36 -9.354 -5.852 4.684 0.25 0.00 C ATOM 560 C TRP A 36 -7.928 -6.385 4.596 0.98 0.00 C ATOM 561 O TRP A 36 -6.985 -5.746 5.063 0.10 0.00 O ATOM 562 CB TRP A 36 -9.701 -5.111 3.389 0.73 0.00 C ATOM 563 CG TRP A 36 -11.166 -5.087 3.067 0.28 0.00 C ATOM 564 CD1 TRP A 36 -12.206 -5.008 3.950 0.60 0.00 C ATOM 565 CD2 TRP A 36 -11.754 -5.135 1.760 1.00 0.00 C ATOM 566 NE1 TRP A 36 -13.402 -5.009 3.271 0.12 0.00 N ATOM 567 CE2 TRP A 36 -13.150 -5.084 1.927 1.00 0.00 C ATOM 568 CE3 TRP A 36 -11.233 -5.215 0.465 1.00 0.00 C ATOM 569 CZ2 TRP A 36 -14.031 -5.113 0.849 0.08 0.00 C ATOM 570 CZ3 TRP A 36 -12.109 -5.242 -0.605 1.00 0.00 C ATOM 571 CH2 TRP A 36 -13.494 -5.192 -0.407 0.23 0.00 C ATOM 0 H TRP A 36 -8.914 -4.144 5.819 0.55 0.00 H new ATOM 0 HA TRP A 36 -10.034 -6.694 4.815 0.25 0.00 H new ATOM 0 HB2 TRP A 36 -9.340 -4.085 3.463 0.73 0.00 H new ATOM 0 HB3 TRP A 36 -9.166 -5.578 2.562 0.73 0.00 H new ATOM 0 HD1 TRP A 36 -12.104 -4.953 5.024 0.60 0.00 H new ATOM 0 HE1 TRP A 36 -14.327 -4.962 3.699 0.12 0.00 H new ATOM 0 HE3 TRP A 36 -10.166 -5.255 0.303 1.00 0.00 H new ATOM 0 HZ2 TRP A 36 -15.100 -5.075 0.999 0.08 0.00 H new ATOM 0 HZ3 TRP A 36 -11.718 -5.303 -1.610 1.00 0.00 H new ATOM 0 HH2 TRP A 36 -14.152 -5.216 -1.263 0.23 0.00 H new ATOM 582 N ASN A 37 -7.778 -7.561 3.993 0.17 0.00 N ATOM 583 CA ASN A 37 -6.469 -8.174 3.826 0.13 0.00 C ATOM 584 C ASN A 37 -5.997 -8.011 2.385 0.17 0.00 C ATOM 585 O ASN A 37 -6.726 -8.331 1.446 0.07 0.00 O ATOM 586 CB ASN A 37 -6.515 -9.658 4.199 0.17 0.00 C ATOM 587 CG ASN A 37 -5.144 -10.305 4.170 0.08 0.00 C ATOM 588 OD1 ASN A 37 -4.128 -9.646 4.395 0.80 0.00 O ATOM 589 ND2 ASN A 37 -5.108 -11.602 3.891 1.00 0.00 N ATOM 0 H ASN A 37 -8.550 -8.108 3.612 0.17 0.00 H new ATOM 0 HA ASN A 37 -5.765 -7.673 4.491 0.13 0.00 H new ATOM 0 HB2 ASN A 37 -6.944 -9.766 5.195 0.17 0.00 H new ATOM 0 HB3 ASN A 37 -7.176 -10.183 3.509 0.17 0.00 H new ATOM 0 HD21 ASN A 37 -4.214 -12.092 3.857 1.00 0.00 H new ATOM 0 HD22 ASN A 37 -5.974 -12.109 3.711 1.00 0.00 H new ATOM 596 N ALA A 38 -4.776 -7.514 2.215 0.55 0.00 N ATOM 597 CA ALA A 38 -4.227 -7.296 0.883 0.54 0.00 C ATOM 598 C ALA A 38 -2.720 -7.508 0.854 0.29 0.00 C ATOM 599 O ALA A 38 -2.034 -7.308 1.852 0.22 0.00 O ATOM 600 CB ALA A 38 -4.567 -5.895 0.402 0.06 0.00 C ATOM 0 H ALA A 38 -4.151 -7.256 2.979 0.55 0.00 H new ATOM 0 HA ALA A 38 -4.678 -8.028 0.213 0.54 0.00 H new ATOM 0 HB1 ALA A 38 -4.152 -5.742 -0.594 0.06 0.00 H new ATOM 0 HB2 ALA A 38 -5.650 -5.775 0.367 0.06 0.00 H new ATOM 0 HB3 ALA A 38 -4.143 -5.162 1.088 0.06 0.00 H new ATOM 606 N VAL A 39 -2.215 -7.927 -0.303 1.00 0.00 N ATOM 607 CA VAL A 39 -0.790 -8.162 -0.481 0.88 0.00 C ATOM 608 C VAL A 39 -0.311 -7.594 -1.814 0.71 0.00 C ATOM 609 O VAL A 39 -0.953 -7.779 -2.847 0.55 0.00 O ATOM 610 CB VAL A 39 -0.457 -9.663 -0.419 1.00 0.00 C ATOM 611 CG1 VAL A 39 -1.238 -10.426 -1.472 1.00 0.00 C ATOM 612 CG2 VAL A 39 1.038 -9.892 -0.582 0.13 0.00 C ATOM 0 H VAL A 39 -2.777 -8.111 -1.134 1.00 0.00 H new ATOM 0 HA VAL A 39 -0.275 -7.655 0.335 0.88 0.00 H new ATOM 0 HB VAL A 39 -0.750 -10.038 0.562 1.00 0.00 H new ATOM 0 HG11 VAL A 39 -0.989 -11.486 -1.413 1.00 0.00 H new ATOM 0 HG12 VAL A 39 -2.306 -10.294 -1.300 1.00 0.00 H new ATOM 0 HG13 VAL A 39 -0.980 -10.048 -2.461 1.00 0.00 H new ATOM 0 HG21 VAL A 39 1.250 -10.960 -0.535 0.13 0.00 H new ATOM 0 HG22 VAL A 39 1.363 -9.500 -1.546 0.13 0.00 H new ATOM 0 HG23 VAL A 39 1.574 -9.380 0.218 0.13 0.00 H new ATOM 622 N ILE A 40 0.817 -6.896 -1.781 0.14 0.00 N ATOM 623 CA ILE A 40 1.384 -6.300 -2.984 0.23 0.00 C ATOM 624 C ILE A 40 2.756 -6.891 -3.293 0.36 0.00 C ATOM 625 O ILE A 40 3.623 -6.960 -2.422 0.69 0.00 O ATOM 626 CB ILE A 40 1.512 -4.771 -2.840 0.53 0.00 C ATOM 627 CG1 ILE A 40 0.126 -4.136 -2.695 0.11 0.00 C ATOM 628 CG2 ILE A 40 2.254 -4.184 -4.035 0.25 0.00 C ATOM 629 CD1 ILE A 40 0.164 -2.644 -2.451 0.26 0.00 C ATOM 0 H ILE A 40 1.358 -6.728 -0.933 0.14 0.00 H new ATOM 0 HA ILE A 40 0.704 -6.525 -3.805 0.23 0.00 H new ATOM 0 HB ILE A 40 2.088 -4.550 -1.941 0.53 0.00 H new ATOM 0 HG12 ILE A 40 -0.451 -4.333 -3.599 0.11 0.00 H new ATOM 0 HG13 ILE A 40 -0.400 -4.617 -1.870 0.11 0.00 H new ATOM 0 HG21 ILE A 40 2.336 -3.103 -3.918 0.25 0.00 H new ATOM 0 HG22 ILE A 40 3.252 -4.619 -4.093 0.25 0.00 H new ATOM 0 HG23 ILE A 40 1.706 -4.409 -4.950 0.25 0.00 H new ATOM 0 HD11 ILE A 40 -0.854 -2.264 -2.359 0.26 0.00 H new ATOM 0 HD12 ILE A 40 0.712 -2.440 -1.531 0.26 0.00 H new ATOM 0 HD13 ILE A 40 0.661 -2.151 -3.287 0.26 0.00 H new ATOM 641 N PHE A 41 2.942 -7.314 -4.538 0.31 0.00 N ATOM 642 CA PHE A 41 4.210 -7.894 -4.965 1.00 0.00 C ATOM 643 C PHE A 41 5.071 -6.848 -5.668 0.44 0.00 C ATOM 644 O PHE A 41 4.585 -6.105 -6.521 0.46 0.00 O ATOM 645 CB PHE A 41 3.962 -9.085 -5.895 0.11 0.00 C ATOM 646 CG PHE A 41 3.034 -10.116 -5.314 1.00 0.00 C ATOM 647 CD1 PHE A 41 3.356 -10.777 -4.138 0.14 0.00 C ATOM 648 CD2 PHE A 41 1.841 -10.427 -5.945 0.53 0.00 C ATOM 649 CE1 PHE A 41 2.505 -11.726 -3.603 0.20 0.00 C ATOM 650 CE2 PHE A 41 0.985 -11.375 -5.416 0.20 0.00 C ATOM 651 CZ PHE A 41 1.319 -12.026 -4.244 0.14 0.00 C ATOM 0 H PHE A 41 2.232 -7.266 -5.269 0.31 0.00 H new ATOM 0 HA PHE A 41 4.743 -8.242 -4.081 1.00 0.00 H new ATOM 0 HB2 PHE A 41 3.546 -8.722 -6.835 0.11 0.00 H new ATOM 0 HB3 PHE A 41 4.916 -9.557 -6.130 0.11 0.00 H new ATOM 0 HD1 PHE A 41 4.283 -10.547 -3.634 0.14 0.00 H new ATOM 0 HD2 PHE A 41 1.576 -9.922 -6.862 0.53 0.00 H new ATOM 0 HE1 PHE A 41 2.767 -12.232 -2.685 0.20 0.00 H new ATOM 0 HE2 PHE A 41 0.057 -11.606 -5.918 0.20 0.00 H new ATOM 0 HZ PHE A 41 0.653 -12.769 -3.830 0.14 0.00 H new ATOM 661 N GLY A 42 6.348 -6.795 -5.300 0.14 0.00 N ATOM 662 CA GLY A 42 7.257 -5.833 -5.899 1.00 0.00 C ATOM 663 C GLY A 42 7.291 -5.925 -7.416 0.83 0.00 C ATOM 664 O GLY A 42 7.102 -7.007 -7.973 0.85 0.00 O ATOM 0 H GLY A 42 6.770 -7.402 -4.597 0.14 0.00 H new ATOM 0 HA2 GLY A 42 6.959 -4.826 -5.607 1.00 0.00 H new ATOM 0 HA3 GLY A 42 8.261 -5.995 -5.507 1.00 0.00 H new ATOM 668 N PRO A 43 7.532 -4.799 -8.117 0.12 0.00 N ATOM 669 CA PRO A 43 7.584 -4.780 -9.582 0.41 0.00 C ATOM 670 C PRO A 43 8.811 -5.504 -10.130 0.15 0.00 C ATOM 671 O PRO A 43 9.759 -5.781 -9.397 0.19 0.00 O ATOM 672 CB PRO A 43 7.649 -3.289 -9.920 0.82 0.00 C ATOM 673 CG PRO A 43 8.244 -2.651 -8.713 0.23 0.00 C ATOM 674 CD PRO A 43 7.771 -3.462 -7.538 1.00 0.00 C ATOM 0 HA PRO A 43 6.730 -5.293 -10.024 0.41 0.00 H new ATOM 0 HB2 PRO A 43 8.261 -3.110 -10.804 0.82 0.00 H new ATOM 0 HB3 PRO A 43 6.658 -2.888 -10.132 0.82 0.00 H new ATOM 0 HG2 PRO A 43 9.332 -2.646 -8.771 0.23 0.00 H new ATOM 0 HG3 PRO A 43 7.925 -1.612 -8.624 0.23 0.00 H new ATOM 0 HD2 PRO A 43 8.519 -3.495 -6.746 1.00 0.00 H new ATOM 0 HD3 PRO A 43 6.863 -3.045 -7.102 1.00 0.00 H new ATOM 682 N GLU A 44 8.781 -5.805 -11.424 0.18 0.00 N ATOM 683 CA GLU A 44 9.887 -6.499 -12.077 0.30 0.00 C ATOM 684 C GLU A 44 11.058 -5.550 -12.321 1.00 0.00 C ATOM 685 O GLU A 44 10.918 -4.543 -13.016 0.46 0.00 O ATOM 686 CB GLU A 44 9.419 -7.107 -13.402 0.80 0.00 C ATOM 687 CG GLU A 44 10.492 -7.908 -14.123 0.09 0.00 C ATOM 688 CD GLU A 44 9.980 -8.548 -15.398 0.08 0.00 C ATOM 689 OE1 GLU A 44 9.488 -9.695 -15.331 1.00 0.00 O ATOM 690 OE2 GLU A 44 10.070 -7.904 -16.463 0.55 0.00 O ATOM 0 H GLU A 44 8.002 -5.579 -12.043 0.18 0.00 H new ATOM 0 HA GLU A 44 10.225 -7.298 -11.417 0.30 0.00 H new ATOM 0 HB2 GLU A 44 8.562 -7.754 -13.212 0.80 0.00 H new ATOM 0 HB3 GLU A 44 9.075 -6.306 -14.057 0.80 0.00 H new ATOM 0 HG2 GLU A 44 11.331 -7.254 -14.360 0.09 0.00 H new ATOM 0 HG3 GLU A 44 10.871 -8.684 -13.457 0.09 0.00 H new ATOM 697 N GLY A 45 12.210 -5.883 -11.750 0.52 0.00 N ATOM 698 CA GLY A 45 13.389 -5.052 -11.916 0.51 0.00 C ATOM 699 C GLY A 45 13.785 -4.344 -10.636 1.00 0.00 C ATOM 700 O GLY A 45 14.585 -3.408 -10.658 0.14 0.00 O ATOM 0 H GLY A 45 12.349 -6.714 -11.175 0.52 0.00 H new ATOM 0 HA2 GLY A 45 14.220 -5.670 -12.258 0.51 0.00 H new ATOM 0 HA3 GLY A 45 13.201 -4.312 -12.694 0.51 0.00 H new ATOM 704 N THR A 46 13.224 -4.790 -9.517 0.78 0.00 N ATOM 705 CA THR A 46 13.521 -4.195 -8.219 0.16 0.00 C ATOM 706 C THR A 46 13.957 -5.262 -7.217 1.00 0.00 C ATOM 707 O THR A 46 13.652 -6.440 -7.393 0.38 0.00 O ATOM 708 CB THR A 46 12.300 -3.442 -7.656 0.13 0.00 C ATOM 709 OG1 THR A 46 11.187 -4.334 -7.534 0.06 0.00 O ATOM 710 CG2 THR A 46 11.924 -2.273 -8.556 0.44 0.00 C ATOM 0 H THR A 46 12.560 -5.563 -9.483 0.78 0.00 H new ATOM 0 HA THR A 46 14.336 -3.487 -8.370 0.16 0.00 H new ATOM 0 HB THR A 46 12.562 -3.054 -6.672 0.13 0.00 H new ATOM 0 HG1 THR A 46 10.937 -4.669 -8.421 0.06 0.00 H new ATOM 0 HG21 THR A 46 11.060 -1.756 -8.139 0.44 0.00 H new ATOM 0 HG22 THR A 46 12.763 -1.581 -8.623 0.44 0.00 H new ATOM 0 HG23 THR A 46 11.679 -2.644 -9.551 0.44 0.00 H new ATOM 718 N PRO A 47 14.678 -4.871 -6.150 0.10 0.00 N ATOM 719 CA PRO A 47 15.146 -5.815 -5.129 0.56 0.00 C ATOM 720 C PRO A 47 13.999 -6.397 -4.307 1.00 0.00 C ATOM 721 O PRO A 47 14.224 -7.153 -3.361 0.13 0.00 O ATOM 722 CB PRO A 47 16.062 -4.967 -4.244 0.06 0.00 C ATOM 723 CG PRO A 47 15.586 -3.568 -4.433 0.06 0.00 C ATOM 724 CD PRO A 47 15.099 -3.486 -5.852 0.11 0.00 C ATOM 0 HA PRO A 47 15.644 -6.677 -5.573 0.56 0.00 H new ATOM 0 HB2 PRO A 47 15.994 -5.270 -3.199 0.06 0.00 H new ATOM 0 HB3 PRO A 47 17.106 -5.073 -4.539 0.06 0.00 H new ATOM 0 HG2 PRO A 47 14.787 -3.329 -3.731 0.06 0.00 H new ATOM 0 HG3 PRO A 47 16.390 -2.854 -4.254 0.06 0.00 H new ATOM 0 HD2 PRO A 47 14.271 -2.784 -5.953 0.11 0.00 H new ATOM 0 HD3 PRO A 47 15.886 -3.151 -6.528 0.11 0.00 H new ATOM 732 N PHE A 48 12.772 -6.039 -4.671 0.47 0.00 N ATOM 733 CA PHE A 48 11.591 -6.526 -3.968 1.00 0.00 C ATOM 734 C PHE A 48 10.818 -7.517 -4.831 0.05 0.00 C ATOM 735 O PHE A 48 9.901 -8.187 -4.354 0.07 0.00 O ATOM 736 CB PHE A 48 10.683 -5.355 -3.587 1.00 0.00 C ATOM 737 CG PHE A 48 11.416 -4.199 -2.966 0.12 0.00 C ATOM 738 CD1 PHE A 48 11.741 -4.207 -1.620 1.00 0.00 C ATOM 739 CD2 PHE A 48 11.781 -3.104 -3.734 0.65 0.00 C ATOM 740 CE1 PHE A 48 12.417 -3.144 -1.049 0.38 0.00 C ATOM 741 CE2 PHE A 48 12.456 -2.038 -3.169 0.07 0.00 C ATOM 742 CZ PHE A 48 12.773 -2.059 -1.825 0.52 0.00 C ATOM 0 H PHE A 48 12.570 -5.412 -5.450 0.47 0.00 H new ATOM 0 HA PHE A 48 11.920 -7.035 -3.062 1.00 0.00 H new ATOM 0 HB2 PHE A 48 10.161 -5.006 -4.478 1.00 0.00 H new ATOM 0 HB3 PHE A 48 9.923 -5.708 -2.890 1.00 0.00 H new ATOM 0 HD1 PHE A 48 11.463 -5.053 -1.009 1.00 0.00 H new ATOM 0 HD2 PHE A 48 11.535 -3.084 -4.785 0.65 0.00 H new ATOM 0 HE1 PHE A 48 12.666 -3.163 0.002 0.38 0.00 H new ATOM 0 HE2 PHE A 48 12.735 -1.190 -3.777 0.07 0.00 H new ATOM 0 HZ PHE A 48 13.299 -1.227 -1.381 0.52 0.00 H new ATOM 752 N GLU A 49 11.195 -7.604 -6.105 0.07 0.00 N ATOM 753 CA GLU A 49 10.535 -8.507 -7.044 0.46 0.00 C ATOM 754 C GLU A 49 10.587 -9.951 -6.547 0.21 0.00 C ATOM 755 O GLU A 49 9.706 -10.755 -6.852 0.07 0.00 O ATOM 756 CB GLU A 49 11.189 -8.404 -8.426 1.00 0.00 C ATOM 757 CG GLU A 49 12.580 -9.012 -8.493 1.00 0.00 C ATOM 758 CD GLU A 49 13.240 -8.811 -9.843 1.00 0.00 C ATOM 759 OE1 GLU A 49 13.884 -7.760 -10.039 0.58 0.00 O ATOM 760 OE2 GLU A 49 13.111 -9.707 -10.706 0.40 0.00 O ATOM 0 H GLU A 49 11.956 -7.059 -6.511 0.07 0.00 H new ATOM 0 HA GLU A 49 9.489 -8.210 -7.120 0.46 0.00 H new ATOM 0 HB2 GLU A 49 10.551 -8.899 -9.158 1.00 0.00 H new ATOM 0 HB3 GLU A 49 11.247 -7.354 -8.713 1.00 0.00 H new ATOM 0 HG2 GLU A 49 13.204 -8.568 -7.718 1.00 0.00 H new ATOM 0 HG3 GLU A 49 12.517 -10.079 -8.279 1.00 0.00 H new ATOM 767 N ASP A 50 11.625 -10.272 -5.782 0.60 0.00 N ATOM 768 CA ASP A 50 11.798 -11.618 -5.247 0.08 0.00 C ATOM 769 C ASP A 50 11.021 -11.804 -3.946 0.27 0.00 C ATOM 770 O ASP A 50 10.621 -12.918 -3.607 0.94 0.00 O ATOM 771 CB ASP A 50 13.282 -11.904 -5.007 0.10 0.00 C ATOM 772 CG ASP A 50 13.910 -10.927 -4.033 0.36 0.00 C ATOM 773 OD1 ASP A 50 13.879 -11.200 -2.814 1.00 0.00 O ATOM 774 OD2 ASP A 50 14.433 -9.889 -4.490 1.00 0.00 O ATOM 0 H ASP A 50 12.361 -9.617 -5.518 0.60 0.00 H new ATOM 0 HA ASP A 50 11.406 -12.321 -5.982 0.08 0.00 H new ATOM 0 HB2 ASP A 50 13.396 -12.918 -4.624 0.10 0.00 H new ATOM 0 HB3 ASP A 50 13.816 -11.860 -5.956 0.10 0.00 H new ATOM 779 N GLY A 51 10.810 -10.708 -3.222 1.00 0.00 N ATOM 780 CA GLY A 51 10.090 -10.780 -1.965 1.00 0.00 C ATOM 781 C GLY A 51 8.625 -10.418 -2.103 1.00 0.00 C ATOM 782 O GLY A 51 8.178 -10.001 -3.171 1.00 0.00 O ATOM 0 H GLY A 51 11.125 -9.774 -3.484 1.00 0.00 H new ATOM 0 HA2 GLY A 51 10.173 -11.789 -1.562 1.00 0.00 H new ATOM 0 HA3 GLY A 51 10.559 -10.109 -1.245 1.00 0.00 H new ATOM 786 N THR A 52 7.878 -10.580 -1.014 0.15 0.00 N ATOM 787 CA THR A 52 6.453 -10.270 -1.006 0.07 0.00 C ATOM 788 C THR A 52 6.085 -9.450 0.227 0.17 0.00 C ATOM 789 O THR A 52 6.432 -9.815 1.352 0.17 0.00 O ATOM 790 CB THR A 52 5.600 -11.552 -1.027 0.11 0.00 C ATOM 791 OG1 THR A 52 5.847 -12.324 0.156 1.00 0.00 O ATOM 792 CG2 THR A 52 5.910 -12.391 -2.257 1.00 0.00 C ATOM 0 H THR A 52 8.238 -10.925 -0.124 0.15 0.00 H new ATOM 0 HA THR A 52 6.245 -9.691 -1.906 0.07 0.00 H new ATOM 0 HB THR A 52 4.550 -11.261 -1.061 0.11 0.00 H new ATOM 0 HG1 THR A 52 5.986 -11.722 0.917 1.00 0.00 H new ATOM 0 HG21 THR A 52 5.295 -13.291 -2.248 1.00 0.00 H new ATOM 0 HG22 THR A 52 5.695 -11.813 -3.156 1.00 0.00 H new ATOM 0 HG23 THR A 52 6.963 -12.672 -2.250 1.00 0.00 H new ATOM 800 N PHE A 53 5.381 -8.344 0.011 0.20 0.00 N ATOM 801 CA PHE A 53 4.966 -7.476 1.109 0.14 0.00 C ATOM 802 C PHE A 53 3.449 -7.446 1.244 1.00 0.00 C ATOM 803 O PHE A 53 2.728 -7.347 0.252 0.71 0.00 O ATOM 804 CB PHE A 53 5.498 -6.055 0.894 0.63 0.00 C ATOM 805 CG PHE A 53 6.985 -5.939 1.067 0.58 0.00 C ATOM 806 CD1 PHE A 53 7.847 -6.283 0.037 0.13 0.00 C ATOM 807 CD2 PHE A 53 7.521 -5.489 2.261 0.17 0.00 C ATOM 808 CE1 PHE A 53 9.215 -6.177 0.197 1.00 0.00 C ATOM 809 CE2 PHE A 53 8.888 -5.382 2.428 0.38 0.00 C ATOM 810 CZ PHE A 53 9.738 -5.727 1.394 0.11 0.00 C ATOM 0 H PHE A 53 5.086 -8.027 -0.912 0.20 0.00 H new ATOM 0 HA PHE A 53 5.384 -7.880 2.031 0.14 0.00 H new ATOM 0 HB2 PHE A 53 5.230 -5.723 -0.109 0.63 0.00 H new ATOM 0 HB3 PHE A 53 5.005 -5.381 1.595 0.63 0.00 H new ATOM 0 HD1 PHE A 53 7.445 -6.638 -0.900 0.13 0.00 H new ATOM 0 HD2 PHE A 53 6.862 -5.218 3.073 0.17 0.00 H new ATOM 0 HE1 PHE A 53 9.876 -6.446 -0.614 1.00 0.00 H new ATOM 0 HE2 PHE A 53 9.292 -5.029 3.365 0.38 0.00 H new ATOM 0 HZ PHE A 53 10.807 -5.645 1.521 0.11 0.00 H new ATOM 820 N LYS A 54 2.974 -7.538 2.482 0.93 0.00 N ATOM 821 CA LYS A 54 1.540 -7.519 2.762 0.06 0.00 C ATOM 822 C LYS A 54 1.156 -6.240 3.498 1.00 0.00 C ATOM 823 O LYS A 54 1.943 -5.702 4.278 0.21 0.00 O ATOM 824 CB LYS A 54 1.149 -8.734 3.599 0.10 0.00 C ATOM 825 CG LYS A 54 1.464 -10.059 2.925 0.08 0.00 C ATOM 826 CD LYS A 54 0.235 -10.951 2.841 0.66 0.00 C ATOM 827 CE LYS A 54 -0.237 -11.389 4.218 0.71 0.00 C ATOM 828 NZ LYS A 54 0.835 -12.095 4.973 0.52 0.00 N ATOM 0 H LYS A 54 3.562 -7.627 3.311 0.93 0.00 H new ATOM 0 HA LYS A 54 1.005 -7.553 1.813 0.06 0.00 H new ATOM 0 HB2 LYS A 54 1.669 -8.689 4.556 0.10 0.00 H new ATOM 0 HB3 LYS A 54 0.081 -8.689 3.814 0.10 0.00 H new ATOM 0 HG2 LYS A 54 1.850 -9.875 1.922 0.08 0.00 H new ATOM 0 HG3 LYS A 54 2.250 -10.572 3.480 0.08 0.00 H new ATOM 0 HD2 LYS A 54 -0.568 -10.417 2.334 0.66 0.00 H new ATOM 0 HD3 LYS A 54 0.464 -11.830 2.238 0.66 0.00 H new ATOM 0 HE2 LYS A 54 -0.566 -10.517 4.784 0.71 0.00 H new ATOM 0 HE3 LYS A 54 -1.101 -12.046 4.114 0.71 0.00 H new ATOM 0 HZ1 LYS A 54 0.413 -12.622 5.764 0.52 0.00 H new ATOM 0 HZ2 LYS A 54 1.328 -12.756 4.340 0.52 0.00 H new ATOM 0 HZ3 LYS A 54 1.514 -11.400 5.344 0.52 0.00 H new ATOM 842 N LEU A 55 -0.056 -5.758 3.248 0.17 0.00 N ATOM 843 CA LEU A 55 -0.538 -4.538 3.887 1.00 0.00 C ATOM 844 C LEU A 55 -2.038 -4.616 4.176 0.06 0.00 C ATOM 845 O LEU A 55 -2.740 -5.474 3.643 0.06 0.00 O ATOM 846 CB LEU A 55 -0.226 -3.301 3.025 0.89 0.00 C ATOM 847 CG LEU A 55 -0.391 -3.453 1.501 1.00 0.00 C ATOM 848 CD1 LEU A 55 0.757 -4.254 0.906 1.00 0.00 C ATOM 849 CD2 LEU A 55 -1.724 -4.093 1.151 1.00 0.00 C ATOM 0 H LEU A 55 -0.722 -6.192 2.609 0.17 0.00 H new ATOM 0 HA LEU A 55 -0.012 -4.440 4.837 1.00 0.00 H new ATOM 0 HB2 LEU A 55 -0.870 -2.486 3.356 0.89 0.00 H new ATOM 0 HB3 LEU A 55 0.801 -2.998 3.226 0.89 0.00 H new ATOM 0 HG LEU A 55 -0.373 -2.453 1.068 1.00 0.00 H new ATOM 0 HD11 LEU A 55 0.616 -4.347 -0.171 1.00 0.00 H new ATOM 0 HD12 LEU A 55 1.699 -3.744 1.106 1.00 0.00 H new ATOM 0 HD13 LEU A 55 0.780 -5.247 1.356 1.00 0.00 H new ATOM 0 HD21 LEU A 55 -1.810 -4.186 0.068 1.00 0.00 H new ATOM 0 HD22 LEU A 55 -1.784 -5.082 1.606 1.00 0.00 H new ATOM 0 HD23 LEU A 55 -2.536 -3.471 1.527 1.00 0.00 H new ATOM 861 N VAL A 56 -2.515 -3.716 5.032 0.40 0.00 N ATOM 862 CA VAL A 56 -3.928 -3.672 5.394 0.30 0.00 C ATOM 863 C VAL A 56 -4.545 -2.327 5.024 1.00 0.00 C ATOM 864 O VAL A 56 -3.921 -1.280 5.196 0.08 0.00 O ATOM 865 CB VAL A 56 -4.129 -3.923 6.902 0.36 0.00 C ATOM 866 CG1 VAL A 56 -3.303 -2.943 7.724 0.11 0.00 C ATOM 867 CG2 VAL A 56 -5.600 -3.828 7.274 0.17 0.00 C ATOM 0 H VAL A 56 -1.942 -3.006 5.488 0.40 0.00 H new ATOM 0 HA VAL A 56 -4.426 -4.464 4.834 0.30 0.00 H new ATOM 0 HB VAL A 56 -3.786 -4.933 7.127 0.36 0.00 H new ATOM 0 HG11 VAL A 56 -3.459 -3.137 8.785 0.11 0.00 H new ATOM 0 HG12 VAL A 56 -2.247 -3.066 7.484 0.11 0.00 H new ATOM 0 HG13 VAL A 56 -3.611 -1.923 7.492 0.11 0.00 H new ATOM 0 HG21 VAL A 56 -5.717 -4.009 8.342 0.17 0.00 H new ATOM 0 HG22 VAL A 56 -5.973 -2.833 7.031 0.17 0.00 H new ATOM 0 HG23 VAL A 56 -6.165 -4.574 6.716 0.17 0.00 H new ATOM 877 N ILE A 57 -5.774 -2.362 4.514 0.10 0.00 N ATOM 878 CA ILE A 57 -6.472 -1.144 4.122 0.85 0.00 C ATOM 879 C ILE A 57 -7.690 -0.905 5.006 1.00 0.00 C ATOM 880 O ILE A 57 -8.636 -1.692 5.005 0.10 0.00 O ATOM 881 CB ILE A 57 -6.928 -1.192 2.648 0.56 0.00 C ATOM 882 CG1 ILE A 57 -5.739 -1.450 1.721 0.40 0.00 C ATOM 883 CG2 ILE A 57 -7.626 0.104 2.266 0.17 0.00 C ATOM 884 CD1 ILE A 57 -5.329 -2.903 1.646 1.00 0.00 C ATOM 0 H ILE A 57 -6.305 -3.220 4.363 0.10 0.00 H new ATOM 0 HA ILE A 57 -5.762 -0.326 4.244 0.85 0.00 H new ATOM 0 HB ILE A 57 -7.634 -2.014 2.536 0.56 0.00 H new ATOM 0 HG12 ILE A 57 -5.988 -1.100 0.719 0.40 0.00 H new ATOM 0 HG13 ILE A 57 -4.889 -0.859 2.062 0.40 0.00 H new ATOM 0 HG21 ILE A 57 -7.941 0.054 1.224 0.17 0.00 H new ATOM 0 HG22 ILE A 57 -8.499 0.248 2.903 0.17 0.00 H new ATOM 0 HG23 ILE A 57 -6.939 0.940 2.397 0.17 0.00 H new ATOM 0 HD11 ILE A 57 -4.480 -3.007 0.970 1.00 0.00 H new ATOM 0 HD12 ILE A 57 -5.047 -3.253 2.639 1.00 0.00 H new ATOM 0 HD13 ILE A 57 -6.164 -3.498 1.275 1.00 0.00 H new ATOM 896 N GLU A 58 -7.658 0.188 5.758 0.09 0.00 N ATOM 897 CA GLU A 58 -8.760 0.538 6.645 0.07 0.00 C ATOM 898 C GLU A 58 -9.625 1.631 6.027 1.00 0.00 C ATOM 899 O GLU A 58 -9.112 2.585 5.439 1.00 0.00 O ATOM 900 CB GLU A 58 -8.222 1.001 8.000 1.00 0.00 C ATOM 901 CG GLU A 58 -9.312 1.302 9.017 0.09 0.00 C ATOM 902 CD GLU A 58 -8.756 1.780 10.343 1.00 0.00 C ATOM 903 OE1 GLU A 58 -8.405 0.923 11.183 0.96 0.00 O ATOM 904 OE2 GLU A 58 -8.670 3.010 10.542 0.32 0.00 O ATOM 0 H GLU A 58 -6.880 0.848 5.771 0.09 0.00 H new ATOM 0 HA GLU A 58 -9.376 -0.350 6.791 0.07 0.00 H new ATOM 0 HB2 GLU A 58 -7.564 0.231 8.402 1.00 0.00 H new ATOM 0 HB3 GLU A 58 -7.615 1.895 7.855 1.00 0.00 H new ATOM 0 HG2 GLU A 58 -9.981 2.062 8.613 0.09 0.00 H new ATOM 0 HG3 GLU A 58 -9.909 0.405 9.180 0.09 0.00 H new ATOM 911 N PHE A 59 -10.939 1.486 6.165 1.00 0.00 N ATOM 912 CA PHE A 59 -11.878 2.459 5.621 0.36 0.00 C ATOM 913 C PHE A 59 -12.673 3.130 6.736 0.08 0.00 C ATOM 914 O PHE A 59 -12.829 2.572 7.822 0.11 0.00 O ATOM 915 CB PHE A 59 -12.837 1.785 4.641 1.00 0.00 C ATOM 916 CG PHE A 59 -12.157 1.189 3.440 1.00 0.00 C ATOM 917 CD1 PHE A 59 -11.937 1.950 2.304 0.19 0.00 C ATOM 918 CD2 PHE A 59 -11.740 -0.133 3.449 0.29 0.00 C ATOM 919 CE1 PHE A 59 -11.315 1.403 1.198 0.12 0.00 C ATOM 920 CE2 PHE A 59 -11.119 -0.685 2.345 1.00 0.00 C ATOM 921 CZ PHE A 59 -10.906 0.085 1.217 0.08 0.00 C ATOM 0 H PHE A 59 -11.378 0.703 6.650 1.00 0.00 H new ATOM 0 HA PHE A 59 -11.303 3.220 5.094 0.36 0.00 H new ATOM 0 HB2 PHE A 59 -13.384 1.000 5.164 1.00 0.00 H new ATOM 0 HB3 PHE A 59 -13.572 2.516 4.305 1.00 0.00 H new ATOM 0 HD1 PHE A 59 -12.255 2.982 2.282 0.19 0.00 H new ATOM 0 HD2 PHE A 59 -11.902 -0.738 4.329 0.29 0.00 H new ATOM 0 HE1 PHE A 59 -11.149 2.007 0.318 0.12 0.00 H new ATOM 0 HE2 PHE A 59 -10.800 -1.717 2.363 1.00 0.00 H new ATOM 0 HZ PHE A 59 -10.421 -0.344 0.353 0.08 0.00 H new ATOM 931 N SER A 60 -13.173 4.331 6.460 1.00 0.00 N ATOM 932 CA SER A 60 -13.955 5.075 7.437 0.74 0.00 C ATOM 933 C SER A 60 -15.441 5.014 7.097 0.40 0.00 C ATOM 934 O SER A 60 -15.831 5.199 5.944 0.62 0.00 O ATOM 935 CB SER A 60 -13.495 6.533 7.489 0.08 0.00 C ATOM 936 OG SER A 60 -12.124 6.624 7.837 0.58 0.00 O ATOM 0 H SER A 60 -13.049 4.808 5.567 1.00 0.00 H new ATOM 0 HA SER A 60 -13.800 4.618 8.414 0.74 0.00 H new ATOM 0 HB2 SER A 60 -13.659 7.004 6.520 0.08 0.00 H new ATOM 0 HB3 SER A 60 -14.095 7.081 8.216 0.08 0.00 H new ATOM 0 HG SER A 60 -11.855 7.566 7.862 0.58 0.00 H new ATOM 942 N GLU A 61 -16.262 4.753 8.108 0.06 0.00 N ATOM 943 CA GLU A 61 -17.705 4.673 7.915 0.28 0.00 C ATOM 944 C GLU A 61 -18.268 6.042 7.546 0.65 0.00 C ATOM 945 O GLU A 61 -19.441 6.171 7.191 1.00 0.00 O ATOM 946 CB GLU A 61 -18.378 4.144 9.187 0.48 0.00 C ATOM 947 CG GLU A 61 -19.859 3.849 9.023 1.00 0.00 C ATOM 948 CD GLU A 61 -20.474 3.252 10.273 0.06 0.00 C ATOM 949 OE1 GLU A 61 -20.897 4.028 11.156 0.54 0.00 O ATOM 950 OE2 GLU A 61 -20.535 2.007 10.370 0.62 0.00 O ATOM 0 H GLU A 61 -15.954 4.594 9.067 0.06 0.00 H new ATOM 0 HA GLU A 61 -17.911 3.983 7.097 0.28 0.00 H new ATOM 0 HB2 GLU A 61 -17.869 3.234 9.504 0.48 0.00 H new ATOM 0 HB3 GLU A 61 -18.249 4.875 9.985 0.48 0.00 H new ATOM 0 HG2 GLU A 61 -20.384 4.770 8.768 1.00 0.00 H new ATOM 0 HG3 GLU A 61 -19.999 3.161 8.189 1.00 0.00 H new ATOM 957 N GLU A 62 -17.417 7.060 7.631 0.66 0.00 N ATOM 958 CA GLU A 62 -17.813 8.424 7.303 0.83 0.00 C ATOM 959 C GLU A 62 -18.296 8.515 5.859 1.00 0.00 C ATOM 960 O GLU A 62 -19.499 8.491 5.594 0.06 0.00 O ATOM 961 CB GLU A 62 -16.639 9.379 7.523 1.00 0.00 C ATOM 962 CG GLU A 62 -16.246 9.536 8.982 0.13 0.00 C ATOM 963 CD GLU A 62 -17.372 10.082 9.835 0.35 0.00 C ATOM 964 OE1 GLU A 62 -17.488 11.321 9.945 0.77 0.00 O ATOM 965 OE2 GLU A 62 -18.142 9.272 10.396 0.45 0.00 O ATOM 0 H GLU A 62 -16.445 6.965 7.926 0.66 0.00 H new ATOM 0 HA GLU A 62 -18.635 8.710 7.960 0.83 0.00 H new ATOM 0 HB2 GLU A 62 -15.778 9.018 6.961 1.00 0.00 H new ATOM 0 HB3 GLU A 62 -16.897 10.357 7.118 1.00 0.00 H new ATOM 0 HG2 GLU A 62 -15.933 8.569 9.376 0.13 0.00 H new ATOM 0 HG3 GLU A 62 -15.386 10.202 9.053 0.13 0.00 H new ATOM 972 N TYR A 63 -17.349 8.617 4.929 0.06 0.00 N ATOM 973 CA TYR A 63 -17.671 8.712 3.511 0.79 0.00 C ATOM 974 C TYR A 63 -16.581 8.055 2.664 1.00 0.00 C ATOM 975 O TYR A 63 -15.410 8.055 3.045 1.00 0.00 O ATOM 976 CB TYR A 63 -17.838 10.174 3.093 0.09 0.00 C ATOM 977 CG TYR A 63 -19.035 10.855 3.715 0.90 0.00 C ATOM 978 CD1 TYR A 63 -20.314 10.648 3.212 0.05 0.00 C ATOM 979 CD2 TYR A 63 -18.887 11.703 4.804 0.43 0.00 C ATOM 980 CE1 TYR A 63 -21.412 11.268 3.777 1.00 0.00 C ATOM 981 CE2 TYR A 63 -19.981 12.327 5.375 0.17 0.00 C ATOM 982 CZ TYR A 63 -21.240 12.108 4.858 0.76 0.00 C ATOM 983 OH TYR A 63 -22.330 12.729 5.423 0.20 0.00 O ATOM 0 H TYR A 63 -16.350 8.636 5.135 0.06 0.00 H new ATOM 0 HA TYR A 63 -18.611 8.187 3.345 0.79 0.00 H new ATOM 0 HB2 TYR A 63 -16.937 10.725 3.364 0.09 0.00 H new ATOM 0 HB3 TYR A 63 -17.927 10.224 2.008 0.09 0.00 H new ATOM 0 HD1 TYR A 63 -20.452 9.992 2.365 0.05 0.00 H new ATOM 0 HD2 TYR A 63 -17.902 11.878 5.212 0.43 0.00 H new ATOM 0 HE1 TYR A 63 -22.399 11.096 3.375 1.00 0.00 H new ATOM 0 HE2 TYR A 63 -19.850 12.983 6.223 0.17 0.00 H new ATOM 0 HH TYR A 63 -22.037 13.285 6.175 0.20 0.00 H new ATOM 993 N PRO A 64 -16.952 7.486 1.502 0.06 0.00 N ATOM 994 CA PRO A 64 -15.997 6.826 0.606 0.20 0.00 C ATOM 995 C PRO A 64 -14.966 7.796 0.032 0.10 0.00 C ATOM 996 O PRO A 64 -13.935 7.379 -0.493 0.12 0.00 O ATOM 997 CB PRO A 64 -16.871 6.264 -0.522 0.05 0.00 C ATOM 998 CG PRO A 64 -18.264 6.284 0.007 0.62 0.00 C ATOM 999 CD PRO A 64 -18.324 7.433 0.971 0.08 0.00 C ATOM 0 HA PRO A 64 -15.420 6.067 1.134 0.20 0.00 H new ATOM 0 HB2 PRO A 64 -16.785 6.870 -1.424 0.05 0.00 H new ATOM 0 HB3 PRO A 64 -16.566 5.252 -0.787 0.05 0.00 H new ATOM 0 HG2 PRO A 64 -18.986 6.413 -0.799 0.62 0.00 H new ATOM 0 HG3 PRO A 64 -18.506 5.345 0.504 0.62 0.00 H new ATOM 0 HD2 PRO A 64 -18.602 8.363 0.475 0.08 0.00 H new ATOM 0 HD3 PRO A 64 -19.057 7.261 1.760 0.08 0.00 H new ATOM 1007 N ASN A 65 -15.252 9.091 0.137 0.09 0.00 N ATOM 1008 CA ASN A 65 -14.353 10.117 -0.384 0.05 0.00 C ATOM 1009 C ASN A 65 -13.341 10.561 0.668 1.00 0.00 C ATOM 1010 O ASN A 65 -12.258 11.042 0.331 0.10 0.00 O ATOM 1011 CB ASN A 65 -15.153 11.325 -0.876 1.00 0.00 C ATOM 1012 CG ASN A 65 -14.265 12.406 -1.461 0.13 0.00 C ATOM 1013 OD1 ASN A 65 -13.997 12.421 -2.663 0.48 0.00 O ATOM 1014 ND2 ASN A 65 -13.802 13.315 -0.610 1.00 0.00 N ATOM 0 H ASN A 65 -16.097 9.454 0.577 0.09 0.00 H new ATOM 0 HA ASN A 65 -13.805 9.681 -1.220 0.05 0.00 H new ATOM 0 HB2 ASN A 65 -15.870 11.000 -1.630 1.00 0.00 H new ATOM 0 HB3 ASN A 65 -15.727 11.739 -0.047 1.00 0.00 H new ATOM 0 HD21 ASN A 65 -13.198 14.066 -0.944 1.00 0.00 H new ATOM 0 HD22 ASN A 65 -14.051 13.262 0.378 1.00 0.00 H new ATOM 1021 N LYS A 66 -13.697 10.402 1.941 0.42 0.00 N ATOM 1022 CA LYS A 66 -12.816 10.794 3.036 0.13 0.00 C ATOM 1023 C LYS A 66 -11.435 10.157 2.879 0.11 0.00 C ATOM 1024 O LYS A 66 -11.315 9.044 2.365 0.66 0.00 O ATOM 1025 CB LYS A 66 -13.426 10.397 4.382 0.06 0.00 C ATOM 1026 CG LYS A 66 -14.633 11.232 4.777 1.00 0.00 C ATOM 1027 CD LYS A 66 -14.238 12.665 5.104 1.00 0.00 C ATOM 1028 CE LYS A 66 -15.450 13.512 5.462 1.00 0.00 C ATOM 1029 NZ LYS A 66 -16.186 12.962 6.634 0.05 0.00 N ATOM 0 H LYS A 66 -14.588 10.005 2.238 0.42 0.00 H new ATOM 0 HA LYS A 66 -12.702 11.878 3.006 0.13 0.00 H new ATOM 0 HB2 LYS A 66 -13.719 9.348 4.343 0.06 0.00 H new ATOM 0 HB3 LYS A 66 -12.664 10.487 5.156 0.06 0.00 H new ATOM 0 HG2 LYS A 66 -15.359 11.230 3.964 1.00 0.00 H new ATOM 0 HG3 LYS A 66 -15.121 10.782 5.642 1.00 0.00 H new ATOM 0 HD2 LYS A 66 -13.533 12.668 5.935 1.00 0.00 H new ATOM 0 HD3 LYS A 66 -13.725 13.106 4.249 1.00 0.00 H new ATOM 0 HE2 LYS A 66 -15.129 14.531 5.680 1.00 0.00 H new ATOM 0 HE3 LYS A 66 -16.121 13.566 4.605 1.00 0.00 H new ATOM 0 HZ1 LYS A 66 -17.166 12.749 6.360 0.05 0.00 H new ATOM 0 HZ2 LYS A 66 -15.720 12.091 6.959 0.05 0.00 H new ATOM 0 HZ3 LYS A 66 -16.186 13.662 7.403 0.05 0.00 H new ATOM 1043 N PRO A 67 -10.371 10.855 3.325 0.45 0.00 N ATOM 1044 CA PRO A 67 -8.998 10.346 3.226 0.76 0.00 C ATOM 1045 C PRO A 67 -8.856 8.938 3.807 0.40 0.00 C ATOM 1046 O PRO A 67 -8.949 8.752 5.020 0.27 0.00 O ATOM 1047 CB PRO A 67 -8.189 11.349 4.053 0.38 0.00 C ATOM 1048 CG PRO A 67 -8.979 12.609 3.989 0.13 0.00 C ATOM 1049 CD PRO A 67 -10.420 12.188 3.956 1.00 0.00 C ATOM 0 HA PRO A 67 -8.668 10.261 2.191 0.76 0.00 H new ATOM 0 HB2 PRO A 67 -8.067 11.009 5.081 0.38 0.00 H new ATOM 0 HB3 PRO A 67 -7.189 11.487 3.642 0.38 0.00 H new ATOM 0 HG2 PRO A 67 -8.776 13.242 4.853 0.13 0.00 H new ATOM 0 HG3 PRO A 67 -8.720 13.188 3.102 0.13 0.00 H new ATOM 0 HD2 PRO A 67 -10.849 12.143 4.957 1.00 0.00 H new ATOM 0 HD3 PRO A 67 -11.029 12.884 3.379 1.00 0.00 H new ATOM 1057 N PRO A 68 -8.631 7.925 2.947 0.55 0.00 N ATOM 1058 CA PRO A 68 -8.479 6.534 3.392 0.28 0.00 C ATOM 1059 C PRO A 68 -7.219 6.328 4.226 0.25 0.00 C ATOM 1060 O PRO A 68 -6.289 7.132 4.169 0.98 0.00 O ATOM 1061 CB PRO A 68 -8.388 5.744 2.082 0.17 0.00 C ATOM 1062 CG PRO A 68 -7.914 6.732 1.075 1.00 0.00 C ATOM 1063 CD PRO A 68 -8.511 8.049 1.481 1.00 0.00 C ATOM 0 HA PRO A 68 -9.302 6.222 4.035 0.28 0.00 H new ATOM 0 HB2 PRO A 68 -7.695 4.907 2.172 0.17 0.00 H new ATOM 0 HB3 PRO A 68 -9.356 5.328 1.803 0.17 0.00 H new ATOM 0 HG2 PRO A 68 -6.825 6.784 1.061 1.00 0.00 H new ATOM 0 HG3 PRO A 68 -8.233 6.451 0.071 1.00 0.00 H new ATOM 0 HD2 PRO A 68 -7.872 8.885 1.198 1.00 0.00 H new ATOM 0 HD3 PRO A 68 -9.480 8.215 1.010 1.00 0.00 H new ATOM 1071 N THR A 69 -7.195 5.244 4.995 1.00 0.00 N ATOM 1072 CA THR A 69 -6.048 4.929 5.840 0.34 0.00 C ATOM 1073 C THR A 69 -5.483 3.554 5.501 0.49 0.00 C ATOM 1074 O THR A 69 -6.169 2.543 5.635 0.15 0.00 O ATOM 1075 CB THR A 69 -6.426 4.963 7.333 0.07 0.00 C ATOM 1076 OG1 THR A 69 -7.037 6.218 7.656 0.51 0.00 O ATOM 1077 CG2 THR A 69 -5.197 4.754 8.208 0.25 0.00 C ATOM 0 H THR A 69 -7.957 4.568 5.051 1.00 0.00 H new ATOM 0 HA THR A 69 -5.291 5.689 5.648 0.34 0.00 H new ATOM 0 HB THR A 69 -7.132 4.155 7.524 0.07 0.00 H new ATOM 0 HG1 THR A 69 -7.276 6.231 8.606 0.51 0.00 H new ATOM 0 HG21 THR A 69 -5.489 4.782 9.258 0.25 0.00 H new ATOM 0 HG22 THR A 69 -4.749 3.786 7.981 0.25 0.00 H new ATOM 0 HG23 THR A 69 -4.472 5.544 8.012 0.25 0.00 H new ATOM 1085 N VAL A 70 -4.230 3.524 5.059 1.00 0.00 N ATOM 1086 CA VAL A 70 -3.574 2.271 4.700 1.00 0.00 C ATOM 1087 C VAL A 70 -2.145 2.229 5.234 1.00 0.00 C ATOM 1088 O VAL A 70 -1.437 3.238 5.221 1.00 0.00 O ATOM 1089 CB VAL A 70 -3.554 2.067 3.171 0.06 0.00 C ATOM 1090 CG1 VAL A 70 -2.794 3.192 2.486 0.20 0.00 C ATOM 1091 CG2 VAL A 70 -2.955 0.713 2.819 0.19 0.00 C ATOM 0 H VAL A 70 -3.648 4.353 4.941 1.00 0.00 H new ATOM 0 HA VAL A 70 -4.150 1.465 5.155 1.00 0.00 H new ATOM 0 HB VAL A 70 -4.582 2.088 2.810 0.06 0.00 H new ATOM 0 HG11 VAL A 70 -2.793 3.027 1.409 0.20 0.00 H new ATOM 0 HG12 VAL A 70 -3.276 4.144 2.707 0.20 0.00 H new ATOM 0 HG13 VAL A 70 -1.767 3.212 2.851 0.20 0.00 H new ATOM 0 HG21 VAL A 70 -2.950 0.588 1.736 0.19 0.00 H new ATOM 0 HG22 VAL A 70 -1.934 0.658 3.196 0.19 0.00 H new ATOM 0 HG23 VAL A 70 -3.552 -0.078 3.273 0.19 0.00 H new ATOM 1101 N ARG A 71 -1.728 1.059 5.707 0.09 0.00 N ATOM 1102 CA ARG A 71 -0.383 0.889 6.248 1.00 0.00 C ATOM 1103 C ARG A 71 0.047 -0.573 6.192 0.22 0.00 C ATOM 1104 O ARG A 71 -0.788 -1.477 6.209 0.18 0.00 O ATOM 1105 CB ARG A 71 -0.330 1.396 7.692 0.79 0.00 C ATOM 1106 CG ARG A 71 -1.320 0.705 8.617 1.00 0.00 C ATOM 1107 CD ARG A 71 -1.315 1.328 10.003 0.11 0.00 C ATOM 1108 NE ARG A 71 -2.291 0.697 10.888 0.91 0.00 N ATOM 1109 CZ ARG A 71 -2.695 1.226 12.040 0.39 0.00 C ATOM 1110 NH1 ARG A 71 -2.208 2.391 12.448 1.00 0.00 N ATOM 1111 NH2 ARG A 71 -3.589 0.590 12.786 0.78 0.00 N ATOM 0 H ARG A 71 -2.301 0.215 5.727 0.09 0.00 H new ATOM 0 HA ARG A 71 0.307 1.472 5.637 1.00 0.00 H new ATOM 0 HB2 ARG A 71 0.678 1.254 8.081 0.79 0.00 H new ATOM 0 HB3 ARG A 71 -0.526 2.468 7.699 0.79 0.00 H new ATOM 0 HG2 ARG A 71 -2.322 0.768 8.192 1.00 0.00 H new ATOM 0 HG3 ARG A 71 -1.072 -0.354 8.692 1.00 0.00 H new ATOM 0 HD2 ARG A 71 -0.319 1.238 10.438 0.11 0.00 H new ATOM 0 HD3 ARG A 71 -1.533 2.393 9.923 0.11 0.00 H new ATOM 0 HE ARG A 71 -2.685 -0.201 10.607 0.91 0.00 H new ATOM 0 HH11 ARG A 71 -1.521 2.885 11.878 1.00 0.00 H new ATOM 0 HH12 ARG A 71 -2.520 2.793 13.332 1.00 0.00 H new ATOM 0 HH21 ARG A 71 -3.967 -0.305 12.477 0.78 0.00 H new ATOM 0 HH22 ARG A 71 -3.898 0.996 13.669 0.78 0.00 H new ATOM 1125 N PHE A 72 1.357 -0.795 6.125 0.13 0.00 N ATOM 1126 CA PHE A 72 1.907 -2.145 6.068 0.32 0.00 C ATOM 1127 C PHE A 72 1.905 -2.795 7.447 1.00 0.00 C ATOM 1128 O PHE A 72 2.170 -2.137 8.453 0.50 0.00 O ATOM 1129 CB PHE A 72 3.337 -2.116 5.523 0.63 0.00 C ATOM 1130 CG PHE A 72 3.423 -1.910 4.038 0.07 0.00 C ATOM 1131 CD1 PHE A 72 3.064 -0.699 3.468 1.00 0.00 C ATOM 1132 CD2 PHE A 72 3.871 -2.928 3.212 0.19 0.00 C ATOM 1133 CE1 PHE A 72 3.147 -0.509 2.102 0.05 0.00 C ATOM 1134 CE2 PHE A 72 3.959 -2.743 1.846 0.84 0.00 C ATOM 1135 CZ PHE A 72 3.596 -1.532 1.289 1.00 0.00 C ATOM 0 H PHE A 72 2.059 -0.055 6.109 0.13 0.00 H new ATOM 0 HA PHE A 72 1.276 -2.733 5.401 0.32 0.00 H new ATOM 0 HB2 PHE A 72 3.889 -1.319 6.022 0.63 0.00 H new ATOM 0 HB3 PHE A 72 3.831 -3.054 5.778 0.63 0.00 H new ATOM 0 HD1 PHE A 72 2.715 0.105 4.099 1.00 0.00 H new ATOM 0 HD2 PHE A 72 4.155 -3.878 3.641 0.19 0.00 H new ATOM 0 HE1 PHE A 72 2.861 0.439 1.670 0.05 0.00 H new ATOM 0 HE2 PHE A 72 4.311 -3.545 1.214 0.84 0.00 H new ATOM 0 HZ PHE A 72 3.663 -1.385 0.221 1.00 0.00 H new ATOM 1145 N LEU A 73 1.606 -4.089 7.485 0.97 0.00 N ATOM 1146 CA LEU A 73 1.586 -4.830 8.740 0.17 0.00 C ATOM 1147 C LEU A 73 3.001 -5.233 9.138 0.16 0.00 C ATOM 1148 O LEU A 73 3.346 -5.242 10.320 0.10 0.00 O ATOM 1149 CB LEU A 73 0.703 -6.073 8.616 1.00 0.00 C ATOM 1150 CG LEU A 73 -0.797 -5.800 8.476 0.24 0.00 C ATOM 1151 CD1 LEU A 73 -1.550 -7.093 8.211 0.15 0.00 C ATOM 1152 CD2 LEU A 73 -1.334 -5.116 9.725 0.14 0.00 C ATOM 0 H LEU A 73 1.375 -4.645 6.662 0.97 0.00 H new ATOM 0 HA LEU A 73 1.171 -4.184 9.514 0.17 0.00 H new ATOM 0 HB2 LEU A 73 1.033 -6.648 7.751 1.00 0.00 H new ATOM 0 HB3 LEU A 73 0.861 -6.699 9.494 1.00 0.00 H new ATOM 0 HG LEU A 73 -0.948 -5.133 7.627 0.24 0.00 H new ATOM 0 HD11 LEU A 73 -2.615 -6.881 8.114 0.15 0.00 H new ATOM 0 HD12 LEU A 73 -1.185 -7.544 7.289 0.15 0.00 H new ATOM 0 HD13 LEU A 73 -1.392 -7.783 9.040 0.15 0.00 H new ATOM 0 HD21 LEU A 73 -2.402 -4.930 9.607 0.14 0.00 H new ATOM 0 HD22 LEU A 73 -1.171 -5.758 10.590 0.14 0.00 H new ATOM 0 HD23 LEU A 73 -0.815 -4.169 9.873 0.14 0.00 H new ATOM 1164 N SER A 74 3.813 -5.566 8.140 1.00 0.00 N ATOM 1165 CA SER A 74 5.196 -5.965 8.378 0.20 0.00 C ATOM 1166 C SER A 74 6.107 -4.743 8.446 0.37 0.00 C ATOM 1167 O SER A 74 5.681 -3.623 8.158 0.08 0.00 O ATOM 1168 CB SER A 74 5.673 -6.913 7.276 0.27 0.00 C ATOM 1169 OG SER A 74 4.860 -8.071 7.212 0.92 0.00 O ATOM 0 H SER A 74 3.537 -5.568 7.158 1.00 0.00 H new ATOM 0 HA SER A 74 5.241 -6.484 9.335 0.20 0.00 H new ATOM 0 HB2 SER A 74 5.654 -6.398 6.316 0.27 0.00 H new ATOM 0 HB3 SER A 74 6.708 -7.201 7.463 0.27 0.00 H new ATOM 0 HG SER A 74 5.185 -8.660 6.499 0.92 0.00 H new ATOM 1175 N LYS A 75 7.360 -4.963 8.828 0.17 0.00 N ATOM 1176 CA LYS A 75 8.329 -3.877 8.935 0.32 0.00 C ATOM 1177 C LYS A 75 9.142 -3.740 7.652 0.51 0.00 C ATOM 1178 O LYS A 75 9.843 -4.669 7.249 0.44 0.00 O ATOM 1179 CB LYS A 75 9.269 -4.115 10.120 0.15 0.00 C ATOM 1180 CG LYS A 75 8.557 -4.180 11.464 1.00 0.00 C ATOM 1181 CD LYS A 75 7.906 -2.853 11.829 1.00 0.00 C ATOM 1182 CE LYS A 75 8.942 -1.764 12.059 1.00 0.00 C ATOM 1183 NZ LYS A 75 8.316 -0.478 12.470 0.16 0.00 N ATOM 0 H LYS A 75 7.729 -5.883 9.069 0.17 0.00 H new ATOM 0 HA LYS A 75 7.777 -2.951 9.096 0.32 0.00 H new ATOM 0 HB2 LYS A 75 9.811 -5.047 9.961 0.15 0.00 H new ATOM 0 HB3 LYS A 75 10.010 -3.317 10.150 0.15 0.00 H new ATOM 0 HG2 LYS A 75 7.797 -4.961 11.434 1.00 0.00 H new ATOM 0 HG3 LYS A 75 9.271 -4.459 12.239 1.00 0.00 H new ATOM 0 HD2 LYS A 75 7.228 -2.548 11.031 1.00 0.00 H new ATOM 0 HD3 LYS A 75 7.304 -2.978 12.729 1.00 0.00 H new ATOM 0 HE2 LYS A 75 9.644 -2.088 12.828 1.00 0.00 H new ATOM 0 HE3 LYS A 75 9.517 -1.612 11.146 1.00 0.00 H new ATOM 0 HZ1 LYS A 75 9.057 0.237 12.617 0.16 0.00 H new ATOM 0 HZ2 LYS A 75 7.665 -0.155 11.726 0.16 0.00 H new ATOM 0 HZ3 LYS A 75 7.788 -0.616 13.355 0.16 0.00 H new ATOM 1197 N MET A 76 9.043 -2.578 7.014 0.34 0.00 N ATOM 1198 CA MET A 76 9.773 -2.318 5.777 0.72 0.00 C ATOM 1199 C MET A 76 10.543 -1.006 5.867 0.08 0.00 C ATOM 1200 O MET A 76 10.269 -0.171 6.729 1.00 0.00 O ATOM 1201 CB MET A 76 8.810 -2.276 4.587 0.49 0.00 C ATOM 1202 CG MET A 76 7.823 -1.121 4.641 0.20 0.00 C ATOM 1203 SD MET A 76 6.746 -1.059 3.195 0.17 0.00 S ATOM 1204 CE MET A 76 7.947 -0.859 1.881 0.59 0.00 C ATOM 0 H MET A 76 8.464 -1.801 7.333 0.34 0.00 H new ATOM 0 HA MET A 76 10.486 -3.129 5.629 0.72 0.00 H new ATOM 0 HB2 MET A 76 9.388 -2.206 3.665 0.49 0.00 H new ATOM 0 HB3 MET A 76 8.256 -3.214 4.546 0.49 0.00 H new ATOM 0 HG2 MET A 76 7.213 -1.211 5.540 0.20 0.00 H new ATOM 0 HG3 MET A 76 8.372 -0.183 4.721 0.20 0.00 H new ATOM 0 HE1 MET A 76 7.466 -0.407 1.014 0.59 0.00 H new ATOM 0 HE2 MET A 76 8.757 -0.215 2.223 0.59 0.00 H new ATOM 0 HE3 MET A 76 8.350 -1.833 1.605 0.59 0.00 H new ATOM 1214 N PHE A 77 11.508 -0.831 4.969 0.69 0.00 N ATOM 1215 CA PHE A 77 12.319 0.381 4.942 0.35 0.00 C ATOM 1216 C PHE A 77 12.141 1.116 3.618 0.61 0.00 C ATOM 1217 O PHE A 77 12.622 0.666 2.578 1.00 0.00 O ATOM 1218 CB PHE A 77 13.795 0.035 5.156 0.06 0.00 C ATOM 1219 CG PHE A 77 14.676 1.236 5.352 0.08 0.00 C ATOM 1220 CD1 PHE A 77 14.798 1.824 6.601 0.59 0.00 C ATOM 1221 CD2 PHE A 77 15.382 1.775 4.289 0.14 0.00 C ATOM 1222 CE1 PHE A 77 15.608 2.927 6.785 1.00 0.00 C ATOM 1223 CE2 PHE A 77 16.197 2.878 4.468 0.06 0.00 C ATOM 1224 CZ PHE A 77 16.309 3.454 5.718 0.07 0.00 C ATOM 0 H PHE A 77 11.747 -1.514 4.250 0.69 0.00 H new ATOM 0 HA PHE A 77 11.988 1.034 5.749 0.35 0.00 H new ATOM 0 HB2 PHE A 77 13.884 -0.615 6.026 0.06 0.00 H new ATOM 0 HB3 PHE A 77 14.154 -0.531 4.297 0.06 0.00 H new ATOM 0 HD1 PHE A 77 14.254 1.415 7.439 0.59 0.00 H new ATOM 0 HD2 PHE A 77 15.295 1.329 3.309 0.14 0.00 H new ATOM 0 HE1 PHE A 77 15.693 3.377 7.763 1.00 0.00 H new ATOM 0 HE2 PHE A 77 16.745 3.288 3.632 0.06 0.00 H new ATOM 0 HZ PHE A 77 16.944 4.316 5.861 0.07 0.00 H new ATOM 1234 N HIS A 78 11.445 2.248 3.662 0.58 0.00 N ATOM 1235 CA HIS A 78 11.198 3.041 2.464 1.00 0.00 C ATOM 1236 C HIS A 78 11.805 4.439 2.604 0.05 0.00 C ATOM 1237 O HIS A 78 11.707 5.055 3.666 0.06 0.00 O ATOM 1238 CB HIS A 78 9.692 3.141 2.208 0.20 0.00 C ATOM 1239 CG HIS A 78 9.339 3.466 0.789 0.11 0.00 C ATOM 1240 ND1 HIS A 78 9.159 4.669 0.185 0.13 0.00 N flip ATOM 1241 CD2 HIS A 78 9.126 2.516 -0.184 0.06 0.00 C flip ATOM 1242 CE1 HIS A 78 8.837 4.463 -1.154 1.00 0.00 C flip ATOM 1243 NE2 HIS A 78 8.832 3.156 -1.325 1.00 0.00 N flip ATOM 0 H HIS A 78 11.042 2.636 4.515 0.58 0.00 H new ATOM 0 HA HIS A 78 11.673 2.547 1.616 1.00 0.00 H new ATOM 0 HB2 HIS A 78 9.223 2.196 2.482 0.20 0.00 H new ATOM 0 HB3 HIS A 78 9.272 3.906 2.861 0.20 0.00 H new ATOM 0 HD2 HIS A 78 9.185 1.446 -0.052 0.06 0.00 H new ATOM 0 HE1 HIS A 78 8.633 5.218 -1.899 1.00 0.00 H new ATOM 0 HE2 HIS A 78 8.631 2.692 -2.211 1.00 0.00 H new ATOM 1251 N PRO A 79 12.443 4.962 1.534 0.18 0.00 N ATOM 1252 CA PRO A 79 13.059 6.295 1.554 0.34 0.00 C ATOM 1253 C PRO A 79 12.100 7.368 2.053 0.07 0.00 C ATOM 1254 O PRO A 79 12.525 8.411 2.551 0.90 0.00 O ATOM 1255 CB PRO A 79 13.439 6.552 0.087 0.09 0.00 C ATOM 1256 CG PRO A 79 12.755 5.481 -0.701 0.36 0.00 C ATOM 1257 CD PRO A 79 12.617 4.312 0.228 0.46 0.00 C ATOM 0 HA PRO A 79 13.910 6.333 2.234 0.34 0.00 H new ATOM 0 HB2 PRO A 79 13.115 7.542 -0.234 0.09 0.00 H new ATOM 0 HB3 PRO A 79 14.519 6.510 -0.051 0.09 0.00 H new ATOM 0 HG2 PRO A 79 11.780 5.817 -1.053 0.36 0.00 H new ATOM 0 HG3 PRO A 79 13.337 5.213 -1.583 0.36 0.00 H new ATOM 0 HD2 PRO A 79 11.763 3.687 -0.031 0.46 0.00 H new ATOM 0 HD3 PRO A 79 13.499 3.671 0.208 0.46 0.00 H new ATOM 1265 N ASN A 80 10.803 7.107 1.917 0.17 0.00 N ATOM 1266 CA ASN A 80 9.784 8.049 2.363 1.00 0.00 C ATOM 1267 C ASN A 80 8.612 7.318 3.010 0.11 0.00 C ATOM 1268 O ASN A 80 7.934 6.515 2.367 1.00 0.00 O ATOM 1269 CB ASN A 80 9.290 8.890 1.182 0.44 0.00 C ATOM 1270 CG ASN A 80 8.852 8.038 0.006 0.11 0.00 C ATOM 1271 OD1 ASN A 80 7.688 7.654 -0.098 1.00 0.00 O ATOM 1272 ND2 ASN A 80 9.788 7.740 -0.887 0.12 0.00 N ATOM 0 H ASN A 80 10.434 6.251 1.502 0.17 0.00 H new ATOM 0 HA ASN A 80 10.231 8.707 3.108 1.00 0.00 H new ATOM 0 HB2 ASN A 80 8.456 9.512 1.507 0.44 0.00 H new ATOM 0 HB3 ASN A 80 10.085 9.564 0.862 0.44 0.00 H new ATOM 0 HD21 ASN A 80 9.554 7.171 -1.700 0.12 0.00 H new ATOM 0 HD22 ASN A 80 10.741 8.081 -0.760 0.12 0.00 H new ATOM 1279 N VAL A 81 8.378 7.602 4.288 1.00 0.00 N ATOM 1280 CA VAL A 81 7.285 6.979 5.025 0.34 0.00 C ATOM 1281 C VAL A 81 6.834 7.860 6.188 0.18 0.00 C ATOM 1282 O VAL A 81 7.587 8.712 6.661 0.43 0.00 O ATOM 1283 CB VAL A 81 7.688 5.589 5.560 1.00 0.00 C ATOM 1284 CG1 VAL A 81 8.715 5.714 6.675 0.21 0.00 C ATOM 1285 CG2 VAL A 81 6.463 4.820 6.033 0.09 0.00 C ATOM 0 H VAL A 81 8.932 8.261 4.835 1.00 0.00 H new ATOM 0 HA VAL A 81 6.456 6.859 4.327 0.34 0.00 H new ATOM 0 HB VAL A 81 8.146 5.030 4.744 1.00 0.00 H new ATOM 0 HG11 VAL A 81 8.983 4.721 7.036 0.21 0.00 H new ATOM 0 HG12 VAL A 81 9.605 6.215 6.295 0.21 0.00 H new ATOM 0 HG13 VAL A 81 8.293 6.296 7.495 0.21 0.00 H new ATOM 0 HG21 VAL A 81 6.769 3.843 6.406 0.09 0.00 H new ATOM 0 HG22 VAL A 81 5.970 5.376 6.831 0.09 0.00 H new ATOM 0 HG23 VAL A 81 5.771 4.690 5.201 0.09 0.00 H new ATOM 1295 N TYR A 82 5.603 7.649 6.646 0.26 0.00 N ATOM 1296 CA TYR A 82 5.057 8.421 7.757 0.82 0.00 C ATOM 1297 C TYR A 82 5.444 7.798 9.093 0.13 0.00 C ATOM 1298 O TYR A 82 6.078 6.744 9.137 0.05 0.00 O ATOM 1299 CB TYR A 82 3.534 8.510 7.645 0.07 0.00 C ATOM 1300 CG TYR A 82 3.061 9.394 6.513 0.07 0.00 C ATOM 1301 CD1 TYR A 82 3.052 8.932 5.204 0.07 0.00 C ATOM 1302 CD2 TYR A 82 2.621 10.689 6.757 1.00 0.00 C ATOM 1303 CE1 TYR A 82 2.620 9.737 4.166 0.41 0.00 C ATOM 1304 CE2 TYR A 82 2.187 11.500 5.726 0.10 0.00 C ATOM 1305 CZ TYR A 82 2.187 11.020 4.432 0.38 0.00 C ATOM 1306 OH TYR A 82 1.756 11.823 3.403 0.34 0.00 O ATOM 0 H TYR A 82 4.965 6.950 6.265 0.26 0.00 H new ATOM 0 HA TYR A 82 5.477 9.426 7.709 0.82 0.00 H new ATOM 0 HB2 TYR A 82 3.129 7.508 7.506 0.07 0.00 H new ATOM 0 HB3 TYR A 82 3.131 8.889 8.584 0.07 0.00 H new ATOM 0 HD1 TYR A 82 3.388 7.928 4.993 0.07 0.00 H new ATOM 0 HD2 TYR A 82 2.618 11.068 7.768 1.00 0.00 H new ATOM 0 HE1 TYR A 82 2.621 9.364 3.153 0.41 0.00 H new ATOM 0 HE2 TYR A 82 1.849 12.505 5.932 0.10 0.00 H new ATOM 0 HH TYR A 82 1.484 12.694 3.760 0.34 0.00 H new ATOM 1316 N ALA A 83 5.056 8.454 10.183 0.14 0.00 N ATOM 1317 CA ALA A 83 5.363 7.966 11.523 1.00 0.00 C ATOM 1318 C ALA A 83 4.531 6.735 11.871 0.55 0.00 C ATOM 1319 O ALA A 83 5.026 5.797 12.496 0.39 0.00 O ATOM 1320 CB ALA A 83 5.134 9.066 12.549 0.07 0.00 C ATOM 0 H ALA A 83 4.528 9.326 10.164 0.14 0.00 H new ATOM 0 HA ALA A 83 6.413 7.675 11.542 1.00 0.00 H new ATOM 0 HB1 ALA A 83 5.367 8.689 13.545 0.07 0.00 H new ATOM 0 HB2 ALA A 83 5.779 9.915 12.323 0.07 0.00 H new ATOM 0 HB3 ALA A 83 4.092 9.383 12.516 0.07 0.00 H new ATOM 1326 N ASP A 84 3.266 6.746 11.462 0.35 0.00 N ATOM 1327 CA ASP A 84 2.367 5.631 11.732 0.07 0.00 C ATOM 1328 C ASP A 84 2.623 4.477 10.768 1.00 0.00 C ATOM 1329 O ASP A 84 2.157 3.358 10.986 1.00 0.00 O ATOM 1330 CB ASP A 84 0.909 6.084 11.630 0.92 0.00 C ATOM 1331 CG ASP A 84 0.565 6.616 10.253 0.35 0.00 C ATOM 1332 OD1 ASP A 84 0.767 7.825 10.016 1.00 0.00 O ATOM 1333 OD2 ASP A 84 0.090 5.823 9.412 0.06 0.00 O ATOM 0 H ASP A 84 2.841 7.514 10.943 0.35 0.00 H new ATOM 0 HA ASP A 84 2.560 5.282 12.746 0.07 0.00 H new ATOM 0 HB2 ASP A 84 0.253 5.246 11.867 0.92 0.00 H new ATOM 0 HB3 ASP A 84 0.719 6.858 12.374 0.92 0.00 H new ATOM 1338 N GLY A 85 3.365 4.759 9.701 0.09 0.00 N ATOM 1339 CA GLY A 85 3.674 3.734 8.721 0.21 0.00 C ATOM 1340 C GLY A 85 2.846 3.867 7.457 0.11 0.00 C ATOM 1341 O GLY A 85 2.840 2.968 6.615 0.08 0.00 O ATOM 0 H GLY A 85 3.757 5.678 9.498 0.09 0.00 H new ATOM 0 HA2 GLY A 85 4.732 3.788 8.465 0.21 0.00 H new ATOM 0 HA3 GLY A 85 3.503 2.752 9.162 0.21 0.00 H new ATOM 1345 N SER A 86 2.148 4.991 7.326 0.09 0.00 N ATOM 1346 CA SER A 86 1.312 5.243 6.156 0.13 0.00 C ATOM 1347 C SER A 86 2.162 5.360 4.896 0.27 0.00 C ATOM 1348 O SER A 86 3.367 5.606 4.967 0.14 0.00 O ATOM 1349 CB SER A 86 0.491 6.519 6.356 0.08 0.00 C ATOM 1350 OG SER A 86 -0.314 6.791 5.222 1.00 0.00 O ATOM 0 H SER A 86 2.144 5.742 8.016 0.09 0.00 H new ATOM 0 HA SER A 86 0.633 4.399 6.035 0.13 0.00 H new ATOM 0 HB2 SER A 86 -0.141 6.414 7.238 0.08 0.00 H new ATOM 0 HB3 SER A 86 1.159 7.360 6.541 0.08 0.00 H new ATOM 0 HG SER A 86 -0.830 7.610 5.376 1.00 0.00 H new ATOM 1356 N ILE A 87 1.527 5.183 3.742 0.19 0.00 N ATOM 1357 CA ILE A 87 2.223 5.269 2.463 0.36 0.00 C ATOM 1358 C ILE A 87 2.074 6.659 1.853 0.44 0.00 C ATOM 1359 O ILE A 87 1.022 7.286 1.965 1.00 0.00 O ATOM 1360 CB ILE A 87 1.700 4.217 1.459 1.00 0.00 C ATOM 1361 CG1 ILE A 87 1.905 2.804 2.005 1.00 0.00 C ATOM 1362 CG2 ILE A 87 2.392 4.368 0.113 1.00 0.00 C ATOM 1363 CD1 ILE A 87 0.821 2.355 2.957 0.10 0.00 C ATOM 0 H ILE A 87 0.531 4.979 3.666 0.19 0.00 H new ATOM 0 HA ILE A 87 3.276 5.071 2.662 0.36 0.00 H new ATOM 0 HB ILE A 87 0.632 4.383 1.319 1.00 0.00 H new ATOM 0 HG12 ILE A 87 1.954 2.105 1.170 1.00 0.00 H new ATOM 0 HG13 ILE A 87 2.867 2.758 2.516 1.00 0.00 H new ATOM 0 HG21 ILE A 87 2.009 3.618 -0.579 1.00 0.00 H new ATOM 0 HG22 ILE A 87 2.197 5.363 -0.287 1.00 0.00 H new ATOM 0 HG23 ILE A 87 3.466 4.231 0.239 1.00 0.00 H new ATOM 0 HD11 ILE A 87 1.036 1.344 3.302 0.10 0.00 H new ATOM 0 HD12 ILE A 87 0.785 3.030 3.812 0.10 0.00 H new ATOM 0 HD13 ILE A 87 -0.141 2.367 2.445 0.10 0.00 H new ATOM 1375 N CYS A 88 3.136 7.132 1.209 0.57 0.00 N ATOM 1376 CA CYS A 88 3.126 8.447 0.578 1.00 0.00 C ATOM 1377 C CYS A 88 2.691 8.345 -0.879 0.14 0.00 C ATOM 1378 O CYS A 88 3.420 7.815 -1.719 0.19 0.00 O ATOM 1379 CB CYS A 88 4.512 9.086 0.667 0.41 0.00 C ATOM 1380 SG CYS A 88 4.594 10.768 0.008 0.13 0.00 S ATOM 0 H CYS A 88 4.015 6.624 1.110 0.57 0.00 H new ATOM 0 HA CYS A 88 2.410 9.075 1.108 1.00 0.00 H new ATOM 0 HB2 CYS A 88 4.827 9.100 1.710 0.41 0.00 H new ATOM 0 HB3 CYS A 88 5.224 8.461 0.128 0.41 0.00 H new ATOM 0 HG CYS A 88 5.806 11.223 0.130 0.13 0.00 H new ATOM 1386 N LEU A 89 1.498 8.855 -1.174 0.10 0.00 N ATOM 1387 CA LEU A 89 0.964 8.822 -2.531 0.12 0.00 C ATOM 1388 C LEU A 89 0.151 10.080 -2.823 1.00 0.00 C ATOM 1389 O LEU A 89 -0.537 10.603 -1.946 0.12 0.00 O ATOM 1390 CB LEU A 89 0.094 7.577 -2.730 0.77 0.00 C ATOM 1391 CG LEU A 89 0.335 6.808 -4.033 0.06 0.00 C ATOM 1392 CD1 LEU A 89 0.110 7.704 -5.242 1.00 0.00 C ATOM 1393 CD2 LEU A 89 1.740 6.223 -4.054 0.57 0.00 C ATOM 0 H LEU A 89 0.883 9.296 -0.490 0.10 0.00 H new ATOM 0 HA LEU A 89 1.803 8.783 -3.226 0.12 0.00 H new ATOM 0 HB2 LEU A 89 0.261 6.900 -1.892 0.77 0.00 H new ATOM 0 HB3 LEU A 89 -0.953 7.877 -2.693 0.77 0.00 H new ATOM 0 HG LEU A 89 -0.382 5.988 -4.082 0.06 0.00 H new ATOM 0 HD11 LEU A 89 0.287 7.135 -6.155 1.00 0.00 H new ATOM 0 HD12 LEU A 89 -0.916 8.071 -5.237 1.00 0.00 H new ATOM 0 HD13 LEU A 89 0.798 8.549 -5.202 1.00 0.00 H new ATOM 0 HD21 LEU A 89 1.894 5.680 -4.987 0.57 0.00 H new ATOM 0 HD22 LEU A 89 2.471 7.028 -3.978 0.57 0.00 H new ATOM 0 HD23 LEU A 89 1.863 5.541 -3.213 0.57 0.00 H new ATOM 1405 N ASP A 90 0.232 10.561 -4.061 1.00 0.00 N ATOM 1406 CA ASP A 90 -0.495 11.758 -4.469 0.57 0.00 C ATOM 1407 C ASP A 90 -1.996 11.488 -4.551 0.49 0.00 C ATOM 1408 O ASP A 90 -2.807 12.405 -4.434 0.17 0.00 O ATOM 1409 CB ASP A 90 0.017 12.256 -5.822 0.54 0.00 C ATOM 1410 CG ASP A 90 -0.114 11.210 -6.910 1.00 0.00 C ATOM 1411 OD1 ASP A 90 0.811 10.383 -7.051 0.09 0.00 O ATOM 1412 OD2 ASP A 90 -1.142 11.216 -7.621 0.84 0.00 O ATOM 0 H ASP A 90 0.795 10.139 -4.799 1.00 0.00 H new ATOM 0 HA ASP A 90 -0.324 12.527 -3.716 0.57 0.00 H new ATOM 0 HB2 ASP A 90 -0.538 13.148 -6.111 0.54 0.00 H new ATOM 0 HB3 ASP A 90 1.063 12.548 -5.727 0.54 0.00 H new ATOM 1417 N ILE A 91 -2.355 10.224 -4.754 0.82 0.00 N ATOM 1418 CA ILE A 91 -3.757 9.834 -4.855 0.08 0.00 C ATOM 1419 C ILE A 91 -4.457 9.953 -3.504 0.48 0.00 C ATOM 1420 O ILE A 91 -5.682 10.070 -3.434 0.06 0.00 O ATOM 1421 CB ILE A 91 -3.901 8.389 -5.376 0.20 0.00 C ATOM 1422 CG1 ILE A 91 -5.366 8.077 -5.690 0.08 0.00 C ATOM 1423 CG2 ILE A 91 -3.347 7.402 -4.356 0.53 0.00 C ATOM 1424 CD1 ILE A 91 -5.585 6.704 -6.288 1.00 0.00 C ATOM 0 H ILE A 91 -1.695 9.453 -4.852 0.82 0.00 H new ATOM 0 HA ILE A 91 -4.228 10.514 -5.565 0.08 0.00 H new ATOM 0 HB ILE A 91 -3.326 8.291 -6.297 0.20 0.00 H new ATOM 0 HG12 ILE A 91 -5.950 8.161 -4.773 0.08 0.00 H new ATOM 0 HG13 ILE A 91 -5.748 8.829 -6.381 0.08 0.00 H new ATOM 0 HG21 ILE A 91 -3.455 6.386 -4.737 0.53 0.00 H new ATOM 0 HG22 ILE A 91 -2.292 7.614 -4.181 0.53 0.00 H new ATOM 0 HG23 ILE A 91 -3.897 7.499 -3.420 0.53 0.00 H new ATOM 0 HD11 ILE A 91 -6.647 6.557 -6.483 1.00 0.00 H new ATOM 0 HD12 ILE A 91 -5.030 6.621 -7.222 1.00 0.00 H new ATOM 0 HD13 ILE A 91 -5.236 5.943 -5.590 1.00 0.00 H new ATOM 1436 N LEU A 92 -3.670 9.925 -2.433 1.00 0.00 N ATOM 1437 CA LEU A 92 -4.208 10.027 -1.081 0.06 0.00 C ATOM 1438 C LEU A 92 -4.723 11.436 -0.801 0.06 0.00 C ATOM 1439 O LEU A 92 -5.649 11.622 -0.010 0.96 0.00 O ATOM 1440 CB LEU A 92 -3.134 9.650 -0.057 0.14 0.00 C ATOM 1441 CG LEU A 92 -3.561 9.765 1.408 0.22 0.00 C ATOM 1442 CD1 LEU A 92 -4.683 8.787 1.720 0.62 0.00 C ATOM 1443 CD2 LEU A 92 -2.371 9.526 2.324 0.07 0.00 C ATOM 0 H LEU A 92 -2.655 9.832 -2.476 1.00 0.00 H new ATOM 0 HA LEU A 92 -5.045 9.334 -0.996 0.06 0.00 H new ATOM 0 HB2 LEU A 92 -2.818 8.624 -0.247 0.14 0.00 H new ATOM 0 HB3 LEU A 92 -2.264 10.287 -0.216 0.14 0.00 H new ATOM 0 HG LEU A 92 -3.934 10.774 1.581 0.22 0.00 H new ATOM 0 HD11 LEU A 92 -4.971 8.886 2.767 0.62 0.00 H new ATOM 0 HD12 LEU A 92 -5.542 9.004 1.085 0.62 0.00 H new ATOM 0 HD13 LEU A 92 -4.341 7.769 1.532 0.62 0.00 H new ATOM 0 HD21 LEU A 92 -2.689 9.611 3.363 0.07 0.00 H new ATOM 0 HD22 LEU A 92 -1.971 8.528 2.147 0.07 0.00 H new ATOM 0 HD23 LEU A 92 -1.599 10.268 2.119 0.07 0.00 H new ATOM 1455 N GLN A 93 -4.120 12.424 -1.455 1.00 0.00 N ATOM 1456 CA GLN A 93 -4.518 13.816 -1.270 0.09 0.00 C ATOM 1457 C GLN A 93 -5.900 14.078 -1.867 0.47 0.00 C ATOM 1458 O GLN A 93 -6.656 13.146 -2.140 0.07 0.00 O ATOM 1459 CB GLN A 93 -3.485 14.751 -1.901 0.18 0.00 C ATOM 1460 CG GLN A 93 -2.128 14.706 -1.219 0.23 0.00 C ATOM 1461 CD GLN A 93 -1.126 15.652 -1.851 0.86 0.00 C ATOM 1462 OE1 GLN A 93 -0.381 15.156 -2.831 0.73 0.00 O flip ATOM 1463 NE2 GLN A 93 -1.022 16.815 -1.462 0.36 0.00 N flip ATOM 0 H GLN A 93 -3.356 12.287 -2.116 1.00 0.00 H new ATOM 0 HA GLN A 93 -4.568 14.013 -0.199 0.09 0.00 H new ATOM 0 HB2 GLN A 93 -3.363 14.488 -2.952 0.18 0.00 H new ATOM 0 HB3 GLN A 93 -3.864 15.772 -1.870 0.18 0.00 H new ATOM 0 HG2 GLN A 93 -2.246 14.959 -0.165 0.23 0.00 H new ATOM 0 HG3 GLN A 93 -1.738 13.689 -1.261 0.23 0.00 H new ATOM 0 HE21 GLN A 93 -1.615 17.155 -0.705 0.36 0.00 H new ATOM 0 HE22 GLN A 93 -0.342 17.439 -1.897 0.36 0.00 H new ATOM 1472 N ASN A 94 -6.220 15.354 -2.069 0.08 0.00 N ATOM 1473 CA ASN A 94 -7.511 15.744 -2.628 1.00 0.00 C ATOM 1474 C ASN A 94 -7.668 15.245 -4.062 0.34 0.00 C ATOM 1475 O ASN A 94 -8.729 15.403 -4.670 0.07 0.00 O ATOM 1476 CB ASN A 94 -7.664 17.266 -2.591 0.39 0.00 C ATOM 1477 CG ASN A 94 -6.624 17.971 -3.439 0.22 0.00 C ATOM 1478 OD1 ASN A 94 -6.840 18.223 -4.625 0.05 0.00 O ATOM 1479 ND2 ASN A 94 -5.486 18.293 -2.834 0.11 0.00 N ATOM 0 H ASN A 94 -5.602 16.136 -1.853 0.08 0.00 H new ATOM 0 HA ASN A 94 -8.290 15.286 -2.019 1.00 0.00 H new ATOM 0 HB2 ASN A 94 -8.660 17.537 -2.942 0.39 0.00 H new ATOM 0 HB3 ASN A 94 -7.584 17.612 -1.560 0.39 0.00 H new ATOM 0 HD21 ASN A 94 -4.749 18.768 -3.354 0.11 0.00 H new ATOM 0 HD22 ASN A 94 -5.350 18.065 -1.849 0.11 0.00 H new ATOM 1486 N ARG A 95 -6.611 14.647 -4.599 0.08 0.00 N ATOM 1487 CA ARG A 95 -6.636 14.128 -5.963 0.12 0.00 C ATOM 1488 C ARG A 95 -7.484 12.864 -6.050 1.00 0.00 C ATOM 1489 O ARG A 95 -7.724 12.341 -7.140 1.00 0.00 O ATOM 1490 CB ARG A 95 -5.214 13.839 -6.445 0.11 0.00 C ATOM 1491 CG ARG A 95 -4.303 15.058 -6.437 0.07 0.00 C ATOM 1492 CD ARG A 95 -4.822 16.156 -7.353 0.49 0.00 C ATOM 1493 NE ARG A 95 -5.043 15.677 -8.716 0.06 0.00 N ATOM 1494 CZ ARG A 95 -5.552 16.428 -9.688 0.23 0.00 C ATOM 1495 NH1 ARG A 95 -5.888 17.689 -9.448 0.07 0.00 N ATOM 1496 NH2 ARG A 95 -5.724 15.920 -10.900 1.00 0.00 N ATOM 0 H ARG A 95 -5.726 14.509 -4.112 0.08 0.00 H new ATOM 0 HA ARG A 95 -7.083 14.886 -6.606 0.12 0.00 H new ATOM 0 HB2 ARG A 95 -4.776 13.066 -5.813 0.11 0.00 H new ATOM 0 HB3 ARG A 95 -5.258 13.437 -7.457 0.11 0.00 H new ATOM 0 HG2 ARG A 95 -4.219 15.442 -5.420 0.07 0.00 H new ATOM 0 HG3 ARG A 95 -3.301 14.765 -6.751 0.07 0.00 H new ATOM 0 HD2 ARG A 95 -5.756 16.551 -6.952 0.49 0.00 H new ATOM 0 HD3 ARG A 95 -4.109 16.980 -7.370 0.49 0.00 H new ATOM 0 HE ARG A 95 -4.793 14.712 -8.934 0.06 0.00 H new ATOM 0 HH11 ARG A 95 -5.756 18.084 -8.517 0.07 0.00 H new ATOM 0 HH12 ARG A 95 -6.278 18.264 -10.195 0.07 0.00 H new ATOM 0 HH21 ARG A 95 -5.466 14.951 -11.088 1.00 0.00 H new ATOM 0 HH22 ARG A 95 -6.115 16.498 -11.644 1.00 0.00 H new ATOM 1510 N TRP A 96 -7.935 12.376 -4.899 0.90 0.00 N ATOM 1511 CA TRP A 96 -8.757 11.173 -4.848 0.73 0.00 C ATOM 1512 C TRP A 96 -10.148 11.440 -5.416 1.00 0.00 C ATOM 1513 O TRP A 96 -10.723 12.508 -5.198 1.00 0.00 O ATOM 1514 CB TRP A 96 -8.866 10.664 -3.407 0.97 0.00 C ATOM 1515 CG TRP A 96 -9.844 9.539 -3.242 0.57 0.00 C ATOM 1516 CD1 TRP A 96 -11.003 9.562 -2.520 1.00 0.00 C ATOM 1517 CD2 TRP A 96 -9.751 8.230 -3.812 0.17 0.00 C ATOM 1518 NE1 TRP A 96 -11.634 8.346 -2.605 1.00 0.00 N ATOM 1519 CE2 TRP A 96 -10.886 7.510 -3.393 1.00 0.00 C ATOM 1520 CE3 TRP A 96 -8.819 7.595 -4.636 0.41 0.00 C ATOM 1521 CZ2 TRP A 96 -11.112 6.189 -3.771 0.09 0.00 C ATOM 1522 CZ3 TRP A 96 -9.044 6.284 -5.011 0.11 0.00 C ATOM 1523 CH2 TRP A 96 -10.182 5.594 -4.579 0.96 0.00 C ATOM 0 H TRP A 96 -7.745 12.796 -3.989 0.90 0.00 H new ATOM 0 HA TRP A 96 -8.277 10.408 -5.459 0.73 0.00 H new ATOM 0 HB2 TRP A 96 -7.883 10.333 -3.072 0.97 0.00 H new ATOM 0 HB3 TRP A 96 -9.162 11.490 -2.760 0.97 0.00 H new ATOM 0 HD1 TRP A 96 -11.369 10.412 -1.964 1.00 0.00 H new ATOM 0 HE1 TRP A 96 -12.517 8.104 -2.155 1.00 0.00 H new ATOM 0 HE3 TRP A 96 -7.938 8.120 -4.974 0.41 0.00 H new ATOM 0 HZ2 TRP A 96 -11.989 5.654 -3.439 0.09 0.00 H new ATOM 0 HZ3 TRP A 96 -8.330 5.784 -5.648 0.11 0.00 H new ATOM 0 HH2 TRP A 96 -10.329 4.570 -4.890 0.96 0.00 H new ATOM 1534 N SER A 97 -10.680 10.465 -6.147 1.00 0.00 N ATOM 1535 CA SER A 97 -12.004 10.591 -6.746 0.95 0.00 C ATOM 1536 C SER A 97 -12.869 9.376 -6.407 1.00 0.00 C ATOM 1537 O SER A 97 -12.350 8.273 -6.225 0.32 0.00 O ATOM 1538 CB SER A 97 -11.886 10.745 -8.263 0.67 0.00 C ATOM 1539 OG SER A 97 -11.141 11.902 -8.602 1.00 0.00 O ATOM 0 H SER A 97 -10.214 9.578 -6.339 1.00 0.00 H new ATOM 0 HA SER A 97 -12.482 11.481 -6.336 0.95 0.00 H new ATOM 0 HB2 SER A 97 -11.405 9.862 -8.685 0.67 0.00 H new ATOM 0 HB3 SER A 97 -12.881 10.807 -8.704 0.67 0.00 H new ATOM 0 HG SER A 97 -11.079 11.977 -9.577 1.00 0.00 H new ATOM 1545 N PRO A 98 -14.200 9.561 -6.318 0.06 0.00 N ATOM 1546 CA PRO A 98 -15.128 8.472 -5.996 0.11 0.00 C ATOM 1547 C PRO A 98 -15.425 7.576 -7.197 0.10 0.00 C ATOM 1548 O PRO A 98 -16.352 6.768 -7.163 1.00 0.00 O ATOM 1549 CB PRO A 98 -16.390 9.216 -5.566 1.00 0.00 C ATOM 1550 CG PRO A 98 -16.362 10.482 -6.348 0.15 0.00 C ATOM 1551 CD PRO A 98 -14.908 10.843 -6.514 0.55 0.00 C ATOM 0 HA PRO A 98 -14.722 7.800 -5.240 0.11 0.00 H new ATOM 0 HB2 PRO A 98 -17.286 8.635 -5.783 1.00 0.00 H new ATOM 0 HB3 PRO A 98 -16.389 9.412 -4.494 1.00 0.00 H new ATOM 0 HG2 PRO A 98 -16.844 10.351 -7.317 0.15 0.00 H new ATOM 0 HG3 PRO A 98 -16.902 11.273 -5.828 0.15 0.00 H new ATOM 0 HD2 PRO A 98 -14.710 11.262 -7.501 0.55 0.00 H new ATOM 0 HD3 PRO A 98 -14.595 11.588 -5.783 0.55 0.00 H new ATOM 1559 N THR A 99 -14.635 7.724 -8.255 0.29 0.00 N ATOM 1560 CA THR A 99 -14.821 6.928 -9.463 0.83 0.00 C ATOM 1561 C THR A 99 -13.870 5.737 -9.492 0.07 0.00 C ATOM 1562 O THR A 99 -14.068 4.790 -10.255 0.75 0.00 O ATOM 1563 CB THR A 99 -14.607 7.772 -10.732 1.00 0.00 C ATOM 1564 OG1 THR A 99 -13.284 8.321 -10.738 0.33 0.00 O ATOM 1565 CG2 THR A 99 -15.630 8.894 -10.814 0.71 0.00 C ATOM 0 H THR A 99 -13.861 8.387 -8.301 0.29 0.00 H new ATOM 0 HA THR A 99 -15.849 6.567 -9.445 0.83 0.00 H new ATOM 0 HB THR A 99 -14.734 7.124 -11.599 1.00 0.00 H new ATOM 0 HG1 THR A 99 -13.155 8.855 -11.549 0.33 0.00 H new ATOM 0 HG21 THR A 99 -15.459 9.477 -11.719 0.71 0.00 H new ATOM 0 HG22 THR A 99 -16.634 8.470 -10.840 0.71 0.00 H new ATOM 0 HG23 THR A 99 -15.532 9.541 -9.942 0.71 0.00 H new ATOM 1573 N TYR A 100 -12.839 5.789 -8.655 1.00 0.00 N ATOM 1574 CA TYR A 100 -11.857 4.713 -8.583 0.75 0.00 C ATOM 1575 C TYR A 100 -12.272 3.669 -7.552 1.00 0.00 C ATOM 1576 O TYR A 100 -13.088 3.943 -6.671 0.25 0.00 O ATOM 1577 CB TYR A 100 -10.479 5.275 -8.235 1.00 0.00 C ATOM 1578 CG TYR A 100 -9.912 6.192 -9.293 0.21 0.00 C ATOM 1579 CD1 TYR A 100 -10.173 7.557 -9.270 0.35 0.00 C ATOM 1580 CD2 TYR A 100 -9.118 5.695 -10.318 0.52 0.00 C ATOM 1581 CE1 TYR A 100 -9.658 8.400 -10.238 0.48 0.00 C ATOM 1582 CE2 TYR A 100 -8.598 6.532 -11.289 1.00 0.00 C ATOM 1583 CZ TYR A 100 -8.872 7.882 -11.245 0.35 0.00 C ATOM 1584 OH TYR A 100 -8.358 8.717 -12.209 0.26 0.00 O ATOM 0 H TYR A 100 -12.662 6.565 -8.017 1.00 0.00 H new ATOM 0 HA TYR A 100 -11.807 4.232 -9.560 0.75 0.00 H new ATOM 0 HB2 TYR A 100 -10.546 5.819 -7.293 1.00 0.00 H new ATOM 0 HB3 TYR A 100 -9.788 4.447 -8.076 1.00 0.00 H new ATOM 0 HD1 TYR A 100 -10.789 7.966 -8.483 0.35 0.00 H new ATOM 0 HD2 TYR A 100 -8.903 4.637 -10.358 0.52 0.00 H new ATOM 0 HE1 TYR A 100 -9.871 9.458 -10.205 0.48 0.00 H new ATOM 0 HE2 TYR A 100 -7.980 6.129 -12.078 1.00 0.00 H new ATOM 0 HH TYR A 100 -7.826 8.194 -12.844 0.26 0.00 H new ATOM 1594 N ASP A 101 -11.706 2.471 -7.669 0.14 0.00 N ATOM 1595 CA ASP A 101 -12.021 1.385 -6.748 0.26 0.00 C ATOM 1596 C ASP A 101 -10.857 1.112 -5.798 0.39 0.00 C ATOM 1597 O ASP A 101 -9.874 1.854 -5.779 1.00 0.00 O ATOM 1598 CB ASP A 101 -12.364 0.113 -7.527 0.08 0.00 C ATOM 1599 CG ASP A 101 -13.504 0.321 -8.504 0.06 0.00 C ATOM 1600 OD1 ASP A 101 -14.674 0.157 -8.095 0.43 0.00 O ATOM 1601 OD2 ASP A 101 -13.229 0.646 -9.677 0.51 0.00 O ATOM 0 H ASP A 101 -11.028 2.229 -8.392 0.14 0.00 H new ATOM 0 HA ASP A 101 -12.884 1.688 -6.155 0.26 0.00 H new ATOM 0 HB2 ASP A 101 -11.482 -0.226 -8.070 0.08 0.00 H new ATOM 0 HB3 ASP A 101 -12.630 -0.678 -6.826 0.08 0.00 H new ATOM 1606 N VAL A 102 -10.978 0.044 -5.013 0.06 0.00 N ATOM 1607 CA VAL A 102 -9.938 -0.329 -4.059 0.47 0.00 C ATOM 1608 C VAL A 102 -8.682 -0.813 -4.778 0.76 0.00 C ATOM 1609 O VAL A 102 -7.584 -0.783 -4.222 0.07 0.00 O ATOM 1610 CB VAL A 102 -10.432 -1.427 -3.095 1.00 0.00 C ATOM 1611 CG1 VAL A 102 -10.720 -2.718 -3.847 0.13 0.00 C ATOM 1612 CG2 VAL A 102 -9.418 -1.664 -1.983 0.37 0.00 C ATOM 0 H VAL A 102 -11.786 -0.578 -5.019 0.06 0.00 H new ATOM 0 HA VAL A 102 -9.696 0.564 -3.482 0.47 0.00 H new ATOM 0 HB VAL A 102 -11.362 -1.086 -2.640 1.00 0.00 H new ATOM 0 HG11 VAL A 102 -11.067 -3.478 -3.146 0.13 0.00 H new ATOM 0 HG12 VAL A 102 -11.490 -2.538 -4.598 0.13 0.00 H new ATOM 0 HG13 VAL A 102 -9.810 -3.065 -4.337 0.13 0.00 H new ATOM 0 HG21 VAL A 102 -9.786 -2.442 -1.314 0.37 0.00 H new ATOM 0 HG22 VAL A 102 -8.469 -1.978 -2.417 0.37 0.00 H new ATOM 0 HG23 VAL A 102 -9.272 -0.742 -1.421 0.37 0.00 H new ATOM 1622 N SER A 103 -8.850 -1.260 -6.018 0.16 0.00 N ATOM 1623 CA SER A 103 -7.730 -1.748 -6.815 0.07 0.00 C ATOM 1624 C SER A 103 -6.810 -0.601 -7.224 0.08 0.00 C ATOM 1625 O SER A 103 -5.597 -0.778 -7.351 0.36 0.00 O ATOM 1626 CB SER A 103 -8.238 -2.477 -8.059 0.16 0.00 C ATOM 1627 OG SER A 103 -9.032 -3.596 -7.706 0.25 0.00 O ATOM 0 H SER A 103 -9.752 -1.295 -6.493 0.16 0.00 H new ATOM 0 HA SER A 103 -7.160 -2.446 -6.202 0.07 0.00 H new ATOM 0 HB2 SER A 103 -8.823 -1.792 -8.673 0.16 0.00 H new ATOM 0 HB3 SER A 103 -7.392 -2.804 -8.664 0.16 0.00 H new ATOM 0 HG SER A 103 -9.596 -3.850 -8.466 0.25 0.00 H new ATOM 1633 N SER A 104 -7.397 0.573 -7.432 0.19 0.00 N ATOM 1634 CA SER A 104 -6.636 1.753 -7.832 0.35 0.00 C ATOM 1635 C SER A 104 -5.535 2.068 -6.823 1.00 0.00 C ATOM 1636 O SER A 104 -4.370 2.229 -7.193 0.15 0.00 O ATOM 1637 CB SER A 104 -7.569 2.958 -7.973 0.65 0.00 C ATOM 1638 OG SER A 104 -6.852 4.112 -8.379 1.00 0.00 O ATOM 0 H SER A 104 -8.399 0.734 -7.330 0.19 0.00 H new ATOM 0 HA SER A 104 -6.169 1.541 -8.794 0.35 0.00 H new ATOM 0 HB2 SER A 104 -8.349 2.735 -8.701 0.65 0.00 H new ATOM 0 HB3 SER A 104 -8.066 3.150 -7.022 0.65 0.00 H new ATOM 0 HG SER A 104 -7.418 4.661 -8.960 1.00 0.00 H new ATOM 1644 N ILE A 105 -5.908 2.151 -5.552 0.08 0.00 N ATOM 1645 CA ILE A 105 -4.952 2.447 -4.490 0.82 0.00 C ATOM 1646 C ILE A 105 -4.002 1.272 -4.267 0.19 0.00 C ATOM 1647 O ILE A 105 -2.861 1.457 -3.842 0.22 0.00 O ATOM 1648 CB ILE A 105 -5.680 2.799 -3.172 0.31 0.00 C ATOM 1649 CG1 ILE A 105 -4.674 3.080 -2.038 0.06 0.00 C ATOM 1650 CG2 ILE A 105 -6.655 1.692 -2.791 0.77 0.00 C ATOM 1651 CD1 ILE A 105 -4.304 1.868 -1.199 0.06 0.00 C ATOM 0 H ILE A 105 -6.867 2.017 -5.230 0.08 0.00 H new ATOM 0 HA ILE A 105 -4.367 3.311 -4.804 0.82 0.00 H new ATOM 0 HB ILE A 105 -6.252 3.713 -3.330 0.31 0.00 H new ATOM 0 HG12 ILE A 105 -3.765 3.495 -2.473 0.06 0.00 H new ATOM 0 HG13 ILE A 105 -5.091 3.844 -1.382 0.06 0.00 H new ATOM 0 HG21 ILE A 105 -7.159 1.955 -1.861 0.77 0.00 H new ATOM 0 HG22 ILE A 105 -7.394 1.570 -3.583 0.77 0.00 H new ATOM 0 HG23 ILE A 105 -6.110 0.758 -2.656 0.77 0.00 H new ATOM 0 HD11 ILE A 105 -3.592 2.163 -0.428 0.06 0.00 H new ATOM 0 HD12 ILE A 105 -5.201 1.463 -0.730 0.06 0.00 H new ATOM 0 HD13 ILE A 105 -3.853 1.108 -1.837 0.06 0.00 H new ATOM 1663 N LEU A 106 -4.475 0.067 -4.565 1.00 0.00 N ATOM 1664 CA LEU A 106 -3.666 -1.136 -4.397 0.12 0.00 C ATOM 1665 C LEU A 106 -2.453 -1.107 -5.324 0.15 0.00 C ATOM 1666 O LEU A 106 -1.331 -1.397 -4.905 1.00 0.00 O ATOM 1667 CB LEU A 106 -4.510 -2.385 -4.673 1.00 0.00 C ATOM 1668 CG LEU A 106 -4.517 -3.436 -3.557 0.06 0.00 C ATOM 1669 CD1 LEU A 106 -4.963 -2.821 -2.239 0.09 0.00 C ATOM 1670 CD2 LEU A 106 -5.422 -4.600 -3.932 0.28 0.00 C ATOM 0 H LEU A 106 -5.414 -0.103 -4.924 1.00 0.00 H new ATOM 0 HA LEU A 106 -3.311 -1.168 -3.367 0.12 0.00 H new ATOM 0 HB2 LEU A 106 -5.537 -2.074 -4.862 1.00 0.00 H new ATOM 0 HB3 LEU A 106 -4.146 -2.854 -5.587 1.00 0.00 H new ATOM 0 HG LEU A 106 -3.501 -3.810 -3.433 0.06 0.00 H new ATOM 0 HD11 LEU A 106 -4.960 -3.585 -1.462 0.09 0.00 H new ATOM 0 HD12 LEU A 106 -4.279 -2.019 -1.962 0.09 0.00 H new ATOM 0 HD13 LEU A 106 -5.970 -2.418 -2.348 0.09 0.00 H new ATOM 0 HD21 LEU A 106 -5.417 -5.338 -3.130 0.28 0.00 H new ATOM 0 HD22 LEU A 106 -6.438 -4.236 -4.084 0.28 0.00 H new ATOM 0 HD23 LEU A 106 -5.060 -5.061 -4.851 0.28 0.00 H new ATOM 1682 N THR A 107 -2.685 -0.758 -6.587 0.12 0.00 N ATOM 1683 CA THR A 107 -1.615 -0.694 -7.577 0.11 0.00 C ATOM 1684 C THR A 107 -0.735 0.538 -7.373 0.07 0.00 C ATOM 1685 O THR A 107 0.448 0.526 -7.711 0.20 0.00 O ATOM 1686 CB THR A 107 -2.176 -0.675 -9.010 0.06 0.00 C ATOM 1687 OG1 THR A 107 -2.936 0.521 -9.223 1.00 0.00 O ATOM 1688 CG2 THR A 107 -3.054 -1.889 -9.262 0.37 0.00 C ATOM 0 H THR A 107 -3.607 -0.515 -6.949 0.12 0.00 H new ATOM 0 HA THR A 107 -1.011 -1.591 -7.439 0.11 0.00 H new ATOM 0 HB THR A 107 -1.337 -0.701 -9.705 0.06 0.00 H new ATOM 0 HG1 THR A 107 -3.254 0.864 -8.362 1.00 0.00 H new ATOM 0 HG21 THR A 107 -3.439 -1.854 -10.281 0.37 0.00 H new ATOM 0 HG22 THR A 107 -2.467 -2.797 -9.127 0.37 0.00 H new ATOM 0 HG23 THR A 107 -3.887 -1.888 -8.559 0.37 0.00 H new ATOM 1696 N SER A 108 -1.322 1.598 -6.827 0.09 0.00 N ATOM 1697 CA SER A 108 -0.591 2.842 -6.587 0.61 0.00 C ATOM 1698 C SER A 108 0.632 2.603 -5.706 1.00 0.00 C ATOM 1699 O SER A 108 1.733 3.054 -6.022 0.21 0.00 O ATOM 1700 CB SER A 108 -1.508 3.880 -5.938 0.05 0.00 C ATOM 1701 OG SER A 108 -2.583 4.218 -6.796 1.00 0.00 O ATOM 0 H SER A 108 -2.301 1.623 -6.542 0.09 0.00 H new ATOM 0 HA SER A 108 -0.248 3.220 -7.550 0.61 0.00 H new ATOM 0 HB2 SER A 108 -1.898 3.489 -4.998 0.05 0.00 H new ATOM 0 HB3 SER A 108 -0.935 4.776 -5.697 0.05 0.00 H new ATOM 0 HG SER A 108 -3.261 3.511 -6.765 1.00 0.00 H new ATOM 1707 N ILE A 109 0.431 1.895 -4.599 1.00 0.00 N ATOM 1708 CA ILE A 109 1.516 1.598 -3.670 0.88 0.00 C ATOM 1709 C ILE A 109 2.611 0.777 -4.345 0.22 0.00 C ATOM 1710 O ILE A 109 3.799 0.978 -4.090 0.57 0.00 O ATOM 1711 CB ILE A 109 0.999 0.831 -2.437 0.07 0.00 C ATOM 1712 CG1 ILE A 109 -0.130 1.611 -1.761 0.37 0.00 C ATOM 1713 CG2 ILE A 109 2.136 0.573 -1.455 1.00 0.00 C ATOM 1714 CD1 ILE A 109 -0.845 0.831 -0.679 0.06 0.00 C ATOM 0 H ILE A 109 -0.475 1.516 -4.323 1.00 0.00 H new ATOM 0 HA ILE A 109 1.931 2.553 -3.349 0.88 0.00 H new ATOM 0 HB ILE A 109 0.605 -0.131 -2.765 0.07 0.00 H new ATOM 0 HG12 ILE A 109 0.279 2.524 -1.328 0.37 0.00 H new ATOM 0 HG13 ILE A 109 -0.854 1.914 -2.517 0.37 0.00 H new ATOM 0 HG21 ILE A 109 1.754 0.031 -0.590 1.00 0.00 H new ATOM 0 HG22 ILE A 109 2.910 -0.020 -1.942 1.00 0.00 H new ATOM 0 HG23 ILE A 109 2.558 1.524 -1.129 1.00 0.00 H new ATOM 0 HD11 ILE A 109 -1.632 1.448 -0.245 0.06 0.00 H new ATOM 0 HD12 ILE A 109 -1.285 -0.069 -1.109 0.06 0.00 H new ATOM 0 HD13 ILE A 109 -0.134 0.551 0.098 0.06 0.00 H new ATOM 1726 N GLN A 110 2.203 -0.149 -5.207 1.00 0.00 N ATOM 1727 CA GLN A 110 3.146 -1.004 -5.919 0.35 0.00 C ATOM 1728 C GLN A 110 4.071 -0.174 -6.806 0.19 0.00 C ATOM 1729 O GLN A 110 5.246 -0.500 -6.973 1.00 0.00 O ATOM 1730 CB GLN A 110 2.395 -2.033 -6.767 0.32 0.00 C ATOM 1731 CG GLN A 110 3.309 -2.997 -7.505 1.00 0.00 C ATOM 1732 CD GLN A 110 2.544 -3.994 -8.353 0.05 0.00 C ATOM 1733 OE1 GLN A 110 2.208 -5.137 -7.763 0.06 0.00 O flip ATOM 1734 NE2 GLN A 110 2.259 -3.742 -9.523 0.43 0.00 N flip ATOM 0 H GLN A 110 1.224 -0.327 -5.430 1.00 0.00 H new ATOM 0 HA GLN A 110 3.753 -1.527 -5.180 0.35 0.00 H new ATOM 0 HB2 GLN A 110 1.724 -2.602 -6.123 0.32 0.00 H new ATOM 0 HB3 GLN A 110 1.772 -1.509 -7.492 0.32 0.00 H new ATOM 0 HG2 GLN A 110 3.989 -2.431 -8.141 1.00 0.00 H new ATOM 0 HG3 GLN A 110 3.922 -3.536 -6.782 1.00 0.00 H new ATOM 0 HE21 GLN A 110 2.537 -2.851 -9.935 0.43 0.00 H new ATOM 0 HE22 GLN A 110 1.745 -4.424 -10.081 0.43 0.00 H new ATOM 1743 N SER A 111 3.528 0.899 -7.372 0.73 0.00 N ATOM 1744 CA SER A 111 4.296 1.780 -8.244 1.00 0.00 C ATOM 1745 C SER A 111 5.318 2.583 -7.447 0.07 0.00 C ATOM 1746 O SER A 111 6.372 2.953 -7.965 0.53 0.00 O ATOM 1747 CB SER A 111 3.360 2.726 -8.996 1.00 0.00 C ATOM 1748 OG SER A 111 4.086 3.579 -9.864 1.00 0.00 O ATOM 0 H SER A 111 2.556 1.180 -7.242 0.73 0.00 H new ATOM 0 HA SER A 111 4.832 1.161 -8.963 1.00 0.00 H new ATOM 0 HB2 SER A 111 2.638 2.147 -9.571 1.00 0.00 H new ATOM 0 HB3 SER A 111 2.793 3.325 -8.283 1.00 0.00 H new ATOM 0 HG SER A 111 3.464 4.173 -10.334 1.00 0.00 H new ATOM 1754 N LEU A 112 4.998 2.853 -6.184 0.56 0.00 N ATOM 1755 CA LEU A 112 5.884 3.619 -5.314 0.39 0.00 C ATOM 1756 C LEU A 112 7.242 2.937 -5.185 0.18 0.00 C ATOM 1757 O LEU A 112 8.256 3.591 -4.940 0.05 0.00 O ATOM 1758 CB LEU A 112 5.253 3.786 -3.929 0.24 0.00 C ATOM 1759 CG LEU A 112 5.995 4.736 -2.987 0.06 0.00 C ATOM 1760 CD1 LEU A 112 5.888 6.170 -3.480 1.00 0.00 C ATOM 1761 CD2 LEU A 112 5.451 4.617 -1.573 0.54 0.00 C ATOM 0 H LEU A 112 4.130 2.552 -5.740 0.56 0.00 H new ATOM 0 HA LEU A 112 6.031 4.602 -5.761 0.39 0.00 H new ATOM 0 HB2 LEU A 112 4.232 4.147 -4.053 0.24 0.00 H new ATOM 0 HB3 LEU A 112 5.189 2.806 -3.455 0.24 0.00 H new ATOM 0 HG LEU A 112 7.048 4.455 -2.976 0.06 0.00 H new ATOM 0 HD11 LEU A 112 6.422 6.830 -2.797 1.00 0.00 H new ATOM 0 HD12 LEU A 112 6.326 6.246 -4.475 1.00 0.00 H new ATOM 0 HD13 LEU A 112 4.839 6.463 -3.522 1.00 0.00 H new ATOM 0 HD21 LEU A 112 5.991 5.300 -0.917 0.54 0.00 H new ATOM 0 HD22 LEU A 112 4.391 4.871 -1.568 0.54 0.00 H new ATOM 0 HD23 LEU A 112 5.581 3.595 -1.218 0.54 0.00 H new ATOM 1773 N LEU A 113 7.250 1.619 -5.354 0.72 0.00 N ATOM 1774 CA LEU A 113 8.479 0.841 -5.257 0.06 0.00 C ATOM 1775 C LEU A 113 9.327 1.008 -6.510 0.14 0.00 C ATOM 1776 O LEU A 113 10.548 1.136 -6.434 0.30 0.00 O ATOM 1777 CB LEU A 113 8.159 -0.641 -5.060 0.64 0.00 C ATOM 1778 CG LEU A 113 6.885 -0.938 -4.269 0.62 0.00 C ATOM 1779 CD1 LEU A 113 6.633 -2.434 -4.224 0.90 0.00 C ATOM 1780 CD2 LEU A 113 6.979 -0.368 -2.862 0.16 0.00 C ATOM 0 H LEU A 113 6.417 1.067 -5.559 0.72 0.00 H new ATOM 0 HA LEU A 113 9.039 1.209 -4.397 0.06 0.00 H new ATOM 0 HB2 LEU A 113 8.075 -1.110 -6.040 0.64 0.00 H new ATOM 0 HB3 LEU A 113 9.000 -1.112 -4.552 0.64 0.00 H new ATOM 0 HG LEU A 113 6.046 -0.458 -4.772 0.62 0.00 H new ATOM 0 HD11 LEU A 113 5.723 -2.633 -3.658 0.90 0.00 H new ATOM 0 HD12 LEU A 113 6.519 -2.815 -5.239 0.90 0.00 H new ATOM 0 HD13 LEU A 113 7.475 -2.931 -3.743 0.90 0.00 H new ATOM 0 HD21 LEU A 113 6.062 -0.591 -2.317 0.16 0.00 H new ATOM 0 HD22 LEU A 113 7.827 -0.816 -2.344 0.16 0.00 H new ATOM 0 HD23 LEU A 113 7.116 0.712 -2.915 0.16 0.00 H new ATOM 1792 N ASP A 114 8.665 1.004 -7.665 1.00 0.00 N ATOM 1793 CA ASP A 114 9.357 1.145 -8.939 0.48 0.00 C ATOM 1794 C ASP A 114 10.134 2.457 -8.995 0.65 0.00 C ATOM 1795 O ASP A 114 11.359 2.460 -9.116 0.06 0.00 O ATOM 1796 CB ASP A 114 8.359 1.080 -10.098 0.27 0.00 C ATOM 1797 CG ASP A 114 9.037 1.186 -11.451 0.16 0.00 C ATOM 1798 OD1 ASP A 114 9.488 0.145 -11.974 0.17 0.00 O ATOM 1799 OD2 ASP A 114 9.116 2.310 -11.988 0.69 0.00 O ATOM 0 H ASP A 114 7.653 0.905 -7.742 1.00 0.00 H new ATOM 0 HA ASP A 114 10.064 0.320 -9.031 0.48 0.00 H new ATOM 0 HB2 ASP A 114 7.805 0.143 -10.045 0.27 0.00 H new ATOM 0 HB3 ASP A 114 7.633 1.886 -9.994 0.27 0.00 H new ATOM 1804 N GLU A 115 9.411 3.570 -8.908 1.00 0.00 N ATOM 1805 CA GLU A 115 10.030 4.889 -8.945 0.94 0.00 C ATOM 1806 C GLU A 115 9.329 5.851 -7.982 0.17 0.00 C ATOM 1807 O GLU A 115 8.263 6.383 -8.292 0.40 0.00 O ATOM 1808 CB GLU A 115 9.999 5.454 -10.369 1.00 0.00 C ATOM 1809 CG GLU A 115 8.635 5.366 -11.035 0.97 0.00 C ATOM 1810 CD GLU A 115 8.628 5.964 -12.428 0.71 0.00 C ATOM 1811 OE1 GLU A 115 8.991 5.247 -13.384 0.13 0.00 O ATOM 1812 OE2 GLU A 115 8.254 7.148 -12.565 0.09 0.00 O ATOM 0 H GLU A 115 8.396 3.583 -8.811 1.00 0.00 H new ATOM 0 HA GLU A 115 11.068 4.783 -8.629 0.94 0.00 H new ATOM 0 HB2 GLU A 115 10.313 6.497 -10.343 1.00 0.00 H new ATOM 0 HB3 GLU A 115 10.726 4.917 -10.979 1.00 0.00 H new ATOM 0 HG2 GLU A 115 8.328 4.322 -11.090 0.97 0.00 H new ATOM 0 HG3 GLU A 115 7.899 5.882 -10.418 0.97 0.00 H new ATOM 1819 N PRO A 116 9.915 6.083 -6.790 0.09 0.00 N ATOM 1820 CA PRO A 116 9.332 6.984 -5.788 1.00 0.00 C ATOM 1821 C PRO A 116 9.295 8.433 -6.259 1.00 0.00 C ATOM 1822 O PRO A 116 9.548 8.725 -7.429 0.36 0.00 O ATOM 1823 CB PRO A 116 10.273 6.846 -4.586 1.00 0.00 C ATOM 1824 CG PRO A 116 11.560 6.371 -5.166 0.49 0.00 C ATOM 1825 CD PRO A 116 11.183 5.492 -6.323 0.42 0.00 C ATOM 0 HA PRO A 116 8.296 6.725 -5.570 1.00 0.00 H new ATOM 0 HB2 PRO A 116 10.399 7.798 -4.070 1.00 0.00 H new ATOM 0 HB3 PRO A 116 9.882 6.137 -3.856 1.00 0.00 H new ATOM 0 HG2 PRO A 116 12.174 7.209 -5.495 0.49 0.00 H new ATOM 0 HG3 PRO A 116 12.142 5.819 -4.428 0.49 0.00 H new ATOM 0 HD2 PRO A 116 11.945 5.503 -7.103 0.42 0.00 H new ATOM 0 HD3 PRO A 116 11.055 4.454 -6.016 0.42 0.00 H new ATOM 1833 N ASN A 117 8.976 9.336 -5.338 1.00 0.00 N ATOM 1834 CA ASN A 117 8.906 10.757 -5.650 0.06 0.00 C ATOM 1835 C ASN A 117 10.098 11.502 -5.045 1.00 0.00 C ATOM 1836 O ASN A 117 10.241 11.555 -3.823 0.51 0.00 O ATOM 1837 CB ASN A 117 7.601 11.351 -5.118 0.50 0.00 C ATOM 1838 CG ASN A 117 6.374 10.726 -5.756 1.00 0.00 C ATOM 1839 OD1 ASN A 117 6.499 10.327 -7.017 0.30 0.00 O flip ATOM 1840 ND2 ASN A 117 5.325 10.605 -5.123 0.06 0.00 N flip ATOM 0 H ASN A 117 8.762 9.107 -4.367 1.00 0.00 H new ATOM 0 HA ASN A 117 8.936 10.871 -6.734 0.06 0.00 H new ATOM 0 HB2 ASN A 117 7.556 11.211 -4.038 0.50 0.00 H new ATOM 0 HB3 ASN A 117 7.594 12.426 -5.301 0.50 0.00 H new ATOM 0 HD21 ASN A 117 5.273 10.925 -4.156 0.06 0.00 H new ATOM 0 HD22 ASN A 117 4.508 10.184 -5.566 0.06 0.00 H new ATOM 1847 N PRO A 118 10.970 12.088 -5.888 1.00 0.00 N ATOM 1848 CA PRO A 118 12.144 12.824 -5.411 1.00 0.00 C ATOM 1849 C PRO A 118 11.784 14.214 -4.895 0.32 0.00 C ATOM 1850 O PRO A 118 12.661 15.003 -4.544 0.10 0.00 O ATOM 1851 CB PRO A 118 13.021 12.923 -6.657 0.18 0.00 C ATOM 1852 CG PRO A 118 12.055 12.936 -7.792 1.00 0.00 C ATOM 1853 CD PRO A 118 10.889 12.085 -7.363 0.18 0.00 C ATOM 0 HA PRO A 118 12.628 12.328 -4.570 1.00 0.00 H new ATOM 0 HB2 PRO A 118 13.630 13.827 -6.643 0.18 0.00 H new ATOM 0 HB3 PRO A 118 13.706 12.078 -6.728 0.18 0.00 H new ATOM 0 HG2 PRO A 118 11.733 13.953 -8.017 1.00 0.00 H new ATOM 0 HG3 PRO A 118 12.514 12.539 -8.698 1.00 0.00 H new ATOM 0 HD2 PRO A 118 9.943 12.499 -7.712 0.18 0.00 H new ATOM 0 HD3 PRO A 118 10.963 11.075 -7.765 0.18 0.00 H new ATOM 1861 N ASN A 119 10.488 14.505 -4.852 0.41 0.00 N ATOM 1862 CA ASN A 119 10.007 15.798 -4.380 0.69 0.00 C ATOM 1863 C ASN A 119 9.340 15.666 -3.014 1.00 0.00 C ATOM 1864 O ASN A 119 8.400 14.888 -2.845 0.09 0.00 O ATOM 1865 CB ASN A 119 9.022 16.401 -5.383 0.76 0.00 C ATOM 1866 CG ASN A 119 9.649 16.634 -6.742 1.00 0.00 C ATOM 1867 OD1 ASN A 119 10.190 17.706 -7.014 0.10 0.00 O ATOM 1868 ND2 ASN A 119 9.581 15.628 -7.607 1.00 0.00 N ATOM 0 H ASN A 119 9.751 13.861 -5.139 0.41 0.00 H new ATOM 0 HA ASN A 119 10.867 16.461 -4.284 0.69 0.00 H new ATOM 0 HB2 ASN A 119 8.165 15.736 -5.491 0.76 0.00 H new ATOM 0 HB3 ASN A 119 8.645 17.346 -4.993 0.76 0.00 H new ATOM 0 HD21 ASN A 119 9.987 15.727 -8.538 1.00 0.00 H new ATOM 0 HD22 ASN A 119 9.123 14.756 -7.340 1.00 0.00 H new ATOM 1875 N SER A 120 9.835 16.433 -2.045 0.69 0.00 N ATOM 1876 CA SER A 120 9.291 16.413 -0.690 0.41 0.00 C ATOM 1877 C SER A 120 9.317 15.000 -0.103 0.08 0.00 C ATOM 1878 O SER A 120 8.342 14.257 -0.217 1.00 0.00 O ATOM 1879 CB SER A 120 7.858 16.953 -0.682 1.00 0.00 C ATOM 1880 OG SER A 120 7.811 18.280 -1.175 1.00 0.00 O ATOM 0 H SER A 120 10.615 17.078 -2.174 0.69 0.00 H new ATOM 0 HA SER A 120 9.919 17.053 -0.070 0.41 0.00 H new ATOM 0 HB2 SER A 120 7.221 16.312 -1.292 1.00 0.00 H new ATOM 0 HB3 SER A 120 7.461 16.924 0.333 1.00 0.00 H new ATOM 0 HG SER A 120 6.885 18.601 -1.161 1.00 0.00 H new ATOM 1886 N PRO A 121 10.441 14.606 0.528 1.00 0.00 N ATOM 1887 CA PRO A 121 10.580 13.280 1.135 1.00 0.00 C ATOM 1888 C PRO A 121 9.848 13.177 2.469 1.00 0.00 C ATOM 1889 O PRO A 121 9.545 14.190 3.100 0.12 0.00 O ATOM 1890 CB PRO A 121 12.088 13.152 1.344 0.09 0.00 C ATOM 1891 CG PRO A 121 12.555 14.551 1.546 0.17 0.00 C ATOM 1892 CD PRO A 121 11.666 15.418 0.692 0.19 0.00 C ATOM 0 HA PRO A 121 10.151 12.495 0.513 1.00 0.00 H new ATOM 0 HB2 PRO A 121 12.318 12.528 2.208 0.09 0.00 H new ATOM 0 HB3 PRO A 121 12.571 12.693 0.481 0.09 0.00 H new ATOM 0 HG2 PRO A 121 12.486 14.837 2.596 0.17 0.00 H new ATOM 0 HG3 PRO A 121 13.600 14.659 1.255 0.17 0.00 H new ATOM 0 HD2 PRO A 121 11.453 16.372 1.175 0.19 0.00 H new ATOM 0 HD3 PRO A 121 12.129 15.643 -0.269 0.19 0.00 H new ATOM 1900 N ALA A 122 9.570 11.949 2.894 0.13 0.00 N ATOM 1901 CA ALA A 122 8.875 11.715 4.154 0.11 0.00 C ATOM 1902 C ALA A 122 9.839 11.230 5.231 0.69 0.00 C ATOM 1903 O ALA A 122 9.525 11.269 6.421 0.81 0.00 O ATOM 1904 CB ALA A 122 7.749 10.711 3.956 0.17 0.00 C ATOM 0 H ALA A 122 9.816 11.100 2.384 0.13 0.00 H new ATOM 0 HA ALA A 122 8.448 12.661 4.487 0.11 0.00 H new ATOM 0 HB1 ALA A 122 7.238 10.545 4.905 0.17 0.00 H new ATOM 0 HB2 ALA A 122 7.040 11.099 3.225 0.17 0.00 H new ATOM 0 HB3 ALA A 122 8.161 9.768 3.596 0.17 0.00 H new ATOM 1910 N ASN A 123 11.013 10.776 4.806 1.00 0.00 N ATOM 1911 CA ASN A 123 12.028 10.286 5.733 0.24 0.00 C ATOM 1912 C ASN A 123 13.398 10.851 5.370 0.41 0.00 C ATOM 1913 O ASN A 123 14.058 10.365 4.450 1.00 0.00 O ATOM 1914 CB ASN A 123 12.073 8.756 5.714 1.00 0.00 C ATOM 1915 CG ASN A 123 12.673 8.168 6.980 1.00 0.00 C ATOM 1916 OD1 ASN A 123 13.566 8.913 7.624 0.27 0.00 O flip ATOM 1917 ND2 ASN A 123 12.335 7.053 7.377 0.07 0.00 N flip ATOM 0 H ASN A 123 11.286 10.737 3.824 1.00 0.00 H new ATOM 0 HA ASN A 123 11.765 10.619 6.737 0.24 0.00 H new ATOM 0 HB2 ASN A 123 11.062 8.369 5.583 1.00 0.00 H new ATOM 0 HB3 ASN A 123 12.655 8.425 4.854 1.00 0.00 H new ATOM 0 HD21 ASN A 123 11.646 6.513 6.854 0.07 0.00 H new ATOM 0 HD22 ASN A 123 12.744 6.670 8.229 0.07 0.00 H new ATOM 1924 N SER A 124 13.818 11.882 6.096 0.08 0.00 N ATOM 1925 CA SER A 124 15.108 12.516 5.849 1.00 0.00 C ATOM 1926 C SER A 124 16.256 11.565 6.173 1.00 0.00 C ATOM 1927 O SER A 124 17.311 11.612 5.541 0.09 0.00 O ATOM 1928 CB SER A 124 15.240 13.796 6.677 0.10 0.00 C ATOM 1929 OG SER A 124 15.104 13.524 8.061 0.14 0.00 O ATOM 0 H SER A 124 13.284 12.296 6.860 0.08 0.00 H new ATOM 0 HA SER A 124 15.160 12.770 4.790 1.00 0.00 H new ATOM 0 HB2 SER A 124 16.209 14.257 6.487 0.10 0.00 H new ATOM 0 HB3 SER A 124 14.480 14.513 6.368 0.10 0.00 H new ATOM 0 HG SER A 124 15.194 14.357 8.569 0.14 0.00 H new ATOM 1935 N GLN A 125 16.041 10.706 7.163 1.00 0.00 N ATOM 1936 CA GLN A 125 17.057 9.745 7.576 0.50 0.00 C ATOM 1937 C GLN A 125 17.232 8.646 6.530 0.05 0.00 C ATOM 1938 O GLN A 125 18.350 8.355 6.104 1.00 0.00 O ATOM 1939 CB GLN A 125 16.687 9.128 8.927 0.27 0.00 C ATOM 1940 CG GLN A 125 17.665 8.067 9.404 1.00 0.00 C ATOM 1941 CD GLN A 125 17.334 7.549 10.790 0.46 0.00 C ATOM 1942 OE1 GLN A 125 16.172 7.519 11.195 0.06 0.00 O ATOM 1943 NE2 GLN A 125 18.359 7.134 11.526 0.22 0.00 N ATOM 0 H GLN A 125 15.172 10.655 7.695 1.00 0.00 H new ATOM 0 HA GLN A 125 18.003 10.277 7.674 0.50 0.00 H new ATOM 0 HB2 GLN A 125 16.631 9.919 9.674 0.27 0.00 H new ATOM 0 HB3 GLN A 125 15.693 8.687 8.855 0.27 0.00 H new ATOM 0 HG2 GLN A 125 17.665 7.235 8.700 1.00 0.00 H new ATOM 0 HG3 GLN A 125 18.673 8.482 9.407 1.00 0.00 H new ATOM 0 HE21 GLN A 125 19.307 7.177 11.151 0.22 0.00 H new ATOM 0 HE22 GLN A 125 18.198 6.773 12.466 0.22 0.00 H new ATOM 1952 N ALA A 126 16.121 8.041 6.122 0.08 0.00 N ATOM 1953 CA ALA A 126 16.150 6.973 5.128 0.24 0.00 C ATOM 1954 C ALA A 126 16.824 7.435 3.840 0.34 0.00 C ATOM 1955 O ALA A 126 17.678 6.739 3.291 0.17 0.00 O ATOM 1956 CB ALA A 126 14.737 6.483 4.840 1.00 0.00 C ATOM 0 H ALA A 126 15.188 8.272 6.465 0.08 0.00 H new ATOM 0 HA ALA A 126 16.735 6.148 5.535 0.24 0.00 H new ATOM 0 HB1 ALA A 126 14.773 5.686 4.097 1.00 0.00 H new ATOM 0 HB2 ALA A 126 14.289 6.103 5.758 1.00 0.00 H new ATOM 0 HB3 ALA A 126 14.136 7.309 4.458 1.00 0.00 H new ATOM 1962 N ALA A 127 16.431 8.611 3.365 0.05 0.00 N ATOM 1963 CA ALA A 127 16.997 9.171 2.144 0.31 0.00 C ATOM 1964 C ALA A 127 18.473 9.509 2.327 0.56 0.00 C ATOM 1965 O ALA A 127 19.265 9.404 1.391 0.06 0.00 O ATOM 1966 CB ALA A 127 16.221 10.409 1.723 0.10 0.00 C ATOM 0 H ALA A 127 15.722 9.196 3.807 0.05 0.00 H new ATOM 0 HA ALA A 127 16.917 8.419 1.359 0.31 0.00 H new ATOM 0 HB1 ALA A 127 16.654 10.817 0.810 0.10 0.00 H new ATOM 0 HB2 ALA A 127 15.180 10.142 1.543 0.10 0.00 H new ATOM 0 HB3 ALA A 127 16.272 11.157 2.514 0.10 0.00 H new ATOM 1972 N GLN A 128 18.836 9.916 3.541 0.36 0.00 N ATOM 1973 CA GLN A 128 20.217 10.274 3.848 0.40 0.00 C ATOM 1974 C GLN A 128 21.158 9.092 3.630 0.09 0.00 C ATOM 1975 O GLN A 128 22.170 9.217 2.943 0.19 0.00 O ATOM 1976 CB GLN A 128 20.328 10.770 5.291 0.22 0.00 C ATOM 1977 CG GLN A 128 21.697 11.336 5.634 0.08 0.00 C ATOM 1978 CD GLN A 128 22.039 12.569 4.818 1.00 0.00 C ATOM 1979 OE1 GLN A 128 22.641 12.359 3.654 1.00 0.00 O flip ATOM 1980 NE2 GLN A 128 21.762 13.695 5.229 0.11 0.00 N flip ATOM 0 H GLN A 128 18.193 10.006 4.327 0.36 0.00 H new ATOM 0 HA GLN A 128 20.513 11.074 3.169 0.40 0.00 H new ATOM 0 HB2 GLN A 128 19.573 11.537 5.462 0.22 0.00 H new ATOM 0 HB3 GLN A 128 20.104 9.946 5.968 0.22 0.00 H new ATOM 0 HG2 GLN A 128 21.727 11.587 6.694 0.08 0.00 H new ATOM 0 HG3 GLN A 128 22.455 10.571 5.465 0.08 0.00 H new ATOM 0 HE21 GLN A 128 21.299 13.809 6.131 0.11 0.00 H new ATOM 0 HE22 GLN A 128 21.996 14.514 4.668 0.11 0.00 H new ATOM 1989 N LEU A 129 20.821 7.947 4.217 0.79 0.00 N ATOM 1990 CA LEU A 129 21.645 6.748 4.086 0.37 0.00 C ATOM 1991 C LEU A 129 21.759 6.309 2.631 0.15 0.00 C ATOM 1992 O LEU A 129 22.773 5.739 2.225 1.00 0.00 O ATOM 1993 CB LEU A 129 21.071 5.607 4.926 0.51 0.00 C ATOM 1994 CG LEU A 129 21.466 5.623 6.404 0.52 0.00 C ATOM 1995 CD1 LEU A 129 20.789 6.776 7.128 0.06 0.00 C ATOM 1996 CD2 LEU A 129 21.115 4.297 7.061 1.00 0.00 C ATOM 0 H LEU A 129 19.984 7.824 4.787 0.79 0.00 H new ATOM 0 HA LEU A 129 22.642 6.994 4.450 0.37 0.00 H new ATOM 0 HB2 LEU A 129 19.984 5.638 4.857 0.51 0.00 H new ATOM 0 HB3 LEU A 129 21.391 4.660 4.491 0.51 0.00 H new ATOM 0 HG LEU A 129 22.544 5.766 6.471 0.52 0.00 H new ATOM 0 HD11 LEU A 129 21.083 6.769 8.178 0.06 0.00 H new ATOM 0 HD12 LEU A 129 21.091 7.719 6.672 0.06 0.00 H new ATOM 0 HD13 LEU A 129 19.707 6.667 7.054 0.06 0.00 H new ATOM 0 HD21 LEU A 129 21.402 4.324 8.112 1.00 0.00 H new ATOM 0 HD22 LEU A 129 20.042 4.125 6.983 1.00 0.00 H new ATOM 0 HD23 LEU A 129 21.649 3.490 6.560 1.00 0.00 H new ATOM 2008 N TYR A 130 20.718 6.573 1.848 0.14 0.00 N ATOM 2009 CA TYR A 130 20.708 6.201 0.437 0.89 0.00 C ATOM 2010 C TYR A 130 21.892 6.825 -0.297 0.14 0.00 C ATOM 2011 O TYR A 130 22.441 6.231 -1.225 0.07 0.00 O ATOM 2012 CB TYR A 130 19.396 6.632 -0.221 1.00 0.00 C ATOM 2013 CG TYR A 130 19.304 6.273 -1.689 0.08 0.00 C ATOM 2014 CD1 TYR A 130 18.863 5.018 -2.092 0.62 0.00 C ATOM 2015 CD2 TYR A 130 19.655 7.190 -2.672 0.95 0.00 C ATOM 2016 CE1 TYR A 130 18.778 4.688 -3.431 0.06 0.00 C ATOM 2017 CE2 TYR A 130 19.572 6.868 -4.013 0.56 0.00 C ATOM 2018 CZ TYR A 130 19.133 5.616 -4.387 0.98 0.00 C ATOM 2019 OH TYR A 130 19.047 5.291 -5.723 0.25 0.00 O ATOM 0 H TYR A 130 19.870 7.043 2.166 0.14 0.00 H new ATOM 0 HA TYR A 130 20.794 5.116 0.373 0.89 0.00 H new ATOM 0 HB2 TYR A 130 18.564 6.169 0.310 1.00 0.00 H new ATOM 0 HB3 TYR A 130 19.282 7.711 -0.112 1.00 0.00 H new ATOM 0 HD1 TYR A 130 18.582 4.289 -1.346 0.62 0.00 H new ATOM 0 HD2 TYR A 130 19.999 8.172 -2.383 0.95 0.00 H new ATOM 0 HE1 TYR A 130 18.435 3.708 -3.727 0.06 0.00 H new ATOM 0 HE2 TYR A 130 19.849 7.593 -4.764 0.56 0.00 H new ATOM 0 HH TYR A 130 19.333 6.056 -6.265 0.25 0.00 H new ATOM 2029 N GLN A 131 22.282 8.024 0.127 1.00 0.00 N ATOM 2030 CA GLN A 131 23.401 8.725 -0.495 0.28 0.00 C ATOM 2031 C GLN A 131 24.649 8.656 0.380 0.50 0.00 C ATOM 2032 O GLN A 131 25.756 8.934 -0.078 0.45 0.00 O ATOM 2033 CB GLN A 131 23.031 10.186 -0.763 0.53 0.00 C ATOM 2034 CG GLN A 131 22.635 10.957 0.486 0.25 0.00 C ATOM 2035 CD GLN A 131 22.243 12.394 0.190 0.88 0.00 C ATOM 2036 OE1 GLN A 131 22.851 12.977 -0.839 0.13 0.00 O flip ATOM 2037 NE2 GLN A 131 21.406 12.974 0.881 0.13 0.00 N flip ATOM 0 H GLN A 131 21.841 8.529 0.896 1.00 0.00 H new ATOM 0 HA GLN A 131 23.620 8.232 -1.442 0.28 0.00 H new ATOM 0 HB2 GLN A 131 23.878 10.685 -1.234 0.53 0.00 H new ATOM 0 HB3 GLN A 131 22.206 10.218 -1.475 0.53 0.00 H new ATOM 0 HG2 GLN A 131 21.801 10.450 0.971 0.25 0.00 H new ATOM 0 HG3 GLN A 131 23.466 10.950 1.191 0.25 0.00 H new ATOM 0 HE21 GLN A 131 20.964 12.488 1.661 0.13 0.00 H new ATOM 0 HE22 GLN A 131 21.154 13.940 0.673 0.13 0.00 H new ATOM 2046 N GLU A 132 24.460 8.278 1.641 1.00 0.00 N ATOM 2047 CA GLU A 132 25.570 8.171 2.582 0.25 0.00 C ATOM 2048 C GLU A 132 26.074 6.736 2.670 1.00 0.00 C ATOM 2049 O GLU A 132 27.113 6.395 2.104 0.68 0.00 O ATOM 2050 CB GLU A 132 25.139 8.649 3.970 0.09 0.00 C ATOM 2051 CG GLU A 132 24.912 10.150 4.057 0.08 0.00 C ATOM 2052 CD GLU A 132 26.172 10.947 3.788 1.00 0.00 C ATOM 2053 OE1 GLU A 132 26.947 11.172 4.741 0.07 0.00 O ATOM 2054 OE2 GLU A 132 26.386 11.345 2.624 0.06 0.00 O ATOM 0 H GLU A 132 23.549 8.041 2.034 1.00 0.00 H new ATOM 0 HA GLU A 132 26.379 8.804 2.218 0.25 0.00 H new ATOM 0 HB2 GLU A 132 24.220 8.135 4.253 0.09 0.00 H new ATOM 0 HB3 GLU A 132 25.900 8.363 4.696 0.09 0.00 H new ATOM 0 HG2 GLU A 132 24.144 10.440 3.340 0.08 0.00 H new ATOM 0 HG3 GLU A 132 24.534 10.400 5.048 0.08 0.00 H new ATOM 2061 N ASN A 133 25.329 5.903 3.385 0.22 0.00 N ATOM 2062 CA ASN A 133 25.696 4.506 3.562 1.00 0.00 C ATOM 2063 C ASN A 133 24.863 3.602 2.661 0.25 0.00 C ATOM 2064 O ASN A 133 23.849 3.047 3.089 1.00 0.00 O ATOM 2065 CB ASN A 133 25.515 4.100 5.025 0.11 0.00 C ATOM 2066 CG ASN A 133 26.547 4.735 5.938 1.00 0.00 C ATOM 2067 OD1 ASN A 133 27.738 4.989 5.404 0.17 0.00 O flip ATOM 2068 ND2 ASN A 133 26.276 4.995 7.110 0.32 0.00 N flip ATOM 0 H ASN A 133 24.464 6.173 3.853 0.22 0.00 H new ATOM 0 HA ASN A 133 26.743 4.390 3.283 1.00 0.00 H new ATOM 0 HB2 ASN A 133 24.517 4.386 5.357 0.11 0.00 H new ATOM 0 HB3 ASN A 133 25.580 3.015 5.108 0.11 0.00 H new ATOM 0 HD21 ASN A 133 25.349 4.783 7.478 0.32 0.00 H new ATOM 0 HD22 ASN A 133 26.979 5.423 7.713 0.32 0.00 H new ATOM 2075 N LYS A 134 25.291 3.463 1.409 0.22 0.00 N ATOM 2076 CA LYS A 134 24.584 2.619 0.453 0.54 0.00 C ATOM 2077 C LYS A 134 24.674 1.159 0.872 1.00 0.00 C ATOM 2078 O LYS A 134 23.798 0.355 0.555 0.11 0.00 O ATOM 2079 CB LYS A 134 25.161 2.798 -0.951 1.00 0.00 C ATOM 2080 CG LYS A 134 25.045 4.220 -1.481 1.00 0.00 C ATOM 2081 CD LYS A 134 25.613 4.344 -2.888 1.00 0.00 C ATOM 2082 CE LYS A 134 24.602 3.915 -3.944 0.84 0.00 C ATOM 2083 NZ LYS A 134 24.255 2.471 -3.839 1.00 0.00 N ATOM 0 H LYS A 134 26.121 3.923 1.035 0.22 0.00 H new ATOM 0 HA LYS A 134 23.536 2.919 0.439 0.54 0.00 H new ATOM 0 HB2 LYS A 134 26.211 2.507 -0.943 1.00 0.00 H new ATOM 0 HB3 LYS A 134 24.648 2.121 -1.635 1.00 0.00 H new ATOM 0 HG2 LYS A 134 23.998 4.523 -1.483 1.00 0.00 H new ATOM 0 HG3 LYS A 134 25.573 4.901 -0.814 1.00 0.00 H new ATOM 0 HD2 LYS A 134 25.913 5.376 -3.070 1.00 0.00 H new ATOM 0 HD3 LYS A 134 26.510 3.731 -2.973 1.00 0.00 H new ATOM 0 HE2 LYS A 134 23.696 4.513 -3.841 0.84 0.00 H new ATOM 0 HE3 LYS A 134 25.007 4.118 -4.935 0.84 0.00 H new ATOM 0 HZ1 LYS A 134 23.948 2.119 -4.768 1.00 0.00 H new ATOM 0 HZ2 LYS A 134 25.089 1.935 -3.525 1.00 0.00 H new ATOM 0 HZ3 LYS A 134 23.485 2.348 -3.151 1.00 0.00 H new ATOM 2097 N ARG A 135 25.743 0.823 1.586 0.65 0.00 N ATOM 2098 CA ARG A 135 25.950 -0.540 2.058 1.00 0.00 C ATOM 2099 C ARG A 135 24.949 -0.880 3.156 0.07 0.00 C ATOM 2100 O ARG A 135 24.547 -2.032 3.308 1.00 0.00 O ATOM 2101 CB ARG A 135 27.379 -0.710 2.578 1.00 0.00 C ATOM 2102 CG ARG A 135 28.452 -0.365 1.555 1.00 0.00 C ATOM 2103 CD ARG A 135 28.516 -1.392 0.434 0.13 0.00 C ATOM 2104 NE ARG A 135 27.380 -1.282 -0.479 0.09 0.00 N ATOM 2105 CZ ARG A 135 27.218 -2.053 -1.551 0.27 0.00 C ATOM 2106 NH1 ARG A 135 28.114 -2.985 -1.846 0.54 0.00 N ATOM 2107 NH2 ARG A 135 26.157 -1.889 -2.331 0.98 0.00 N ATOM 0 H ARG A 135 26.480 1.477 1.850 0.65 0.00 H new ATOM 0 HA ARG A 135 25.797 -1.223 1.222 1.00 0.00 H new ATOM 0 HB2 ARG A 135 27.513 -0.080 3.457 1.00 0.00 H new ATOM 0 HB3 ARG A 135 27.517 -1.742 2.901 1.00 0.00 H new ATOM 0 HG2 ARG A 135 28.250 0.620 1.134 1.00 0.00 H new ATOM 0 HG3 ARG A 135 29.421 -0.307 2.050 1.00 0.00 H new ATOM 0 HD2 ARG A 135 29.443 -1.261 -0.124 0.13 0.00 H new ATOM 0 HD3 ARG A 135 28.541 -2.394 0.862 0.13 0.00 H new ATOM 0 HE ARG A 135 26.672 -0.575 -0.283 0.09 0.00 H new ATOM 0 HH11 ARG A 135 28.932 -3.113 -1.250 0.54 0.00 H new ATOM 0 HH12 ARG A 135 27.985 -3.574 -2.669 0.54 0.00 H new ATOM 0 HH21 ARG A 135 25.466 -1.172 -2.108 0.98 0.00 H new ATOM 0 HH22 ARG A 135 26.032 -2.480 -3.153 0.98 0.00 H new ATOM 2121 N GLU A 136 24.550 0.135 3.917 0.08 0.00 N ATOM 2122 CA GLU A 136 23.592 -0.051 4.999 0.06 0.00 C ATOM 2123 C GLU A 136 22.169 -0.131 4.451 0.21 0.00 C ATOM 2124 O GLU A 136 21.295 -0.761 5.048 0.14 0.00 O ATOM 2125 CB GLU A 136 23.702 1.095 6.006 0.11 0.00 C ATOM 2126 CG GLU A 136 22.773 0.950 7.201 1.00 0.00 C ATOM 2127 CD GLU A 136 23.070 -0.287 8.025 0.09 0.00 C ATOM 2128 OE1 GLU A 136 23.948 -0.216 8.909 1.00 0.00 O ATOM 2129 OE2 GLU A 136 22.422 -1.330 7.784 0.52 0.00 O ATOM 0 H GLU A 136 24.876 1.095 3.803 0.08 0.00 H new ATOM 0 HA GLU A 136 23.822 -0.989 5.503 0.06 0.00 H new ATOM 0 HB2 GLU A 136 24.730 1.157 6.362 0.11 0.00 H new ATOM 0 HB3 GLU A 136 23.483 2.035 5.499 0.11 0.00 H new ATOM 0 HG2 GLU A 136 22.861 1.833 7.834 1.00 0.00 H new ATOM 0 HG3 GLU A 136 21.741 0.910 6.851 1.00 0.00 H new ATOM 2136 N TYR A 137 21.948 0.513 3.309 0.40 0.00 N ATOM 2137 CA TYR A 137 20.636 0.525 2.672 0.29 0.00 C ATOM 2138 C TYR A 137 20.340 -0.816 2.004 0.24 0.00 C ATOM 2139 O TYR A 137 19.248 -1.363 2.152 0.07 0.00 O ATOM 2140 CB TYR A 137 20.562 1.653 1.641 0.37 0.00 C ATOM 2141 CG TYR A 137 19.219 1.775 0.955 0.22 0.00 C ATOM 2142 CD1 TYR A 137 18.195 2.528 1.517 0.11 0.00 C ATOM 2143 CD2 TYR A 137 18.974 1.140 -0.258 0.11 0.00 C ATOM 2144 CE1 TYR A 137 16.969 2.646 0.891 0.47 0.00 C ATOM 2145 CE2 TYR A 137 17.749 1.253 -0.889 1.00 0.00 C ATOM 2146 CZ TYR A 137 16.752 2.006 -0.310 1.00 0.00 C ATOM 2147 OH TYR A 137 15.531 2.122 -0.936 0.34 0.00 O ATOM 0 H TYR A 137 22.664 1.035 2.804 0.40 0.00 H new ATOM 0 HA TYR A 137 19.885 0.695 3.443 0.29 0.00 H new ATOM 0 HB2 TYR A 137 20.793 2.597 2.134 0.37 0.00 H new ATOM 0 HB3 TYR A 137 21.331 1.491 0.885 0.37 0.00 H new ATOM 0 HD1 TYR A 137 18.360 3.029 2.459 0.11 0.00 H new ATOM 0 HD2 TYR A 137 19.754 0.549 -0.715 0.11 0.00 H new ATOM 0 HE1 TYR A 137 16.185 3.237 1.341 0.47 0.00 H new ATOM 0 HE2 TYR A 137 17.575 0.754 -1.831 1.00 0.00 H new ATOM 0 HH TYR A 137 15.542 1.612 -1.773 0.34 0.00 H new ATOM 2157 N GLU A 138 21.321 -1.341 1.275 0.11 0.00 N ATOM 2158 CA GLU A 138 21.164 -2.613 0.575 0.06 0.00 C ATOM 2159 C GLU A 138 20.869 -3.748 1.553 0.06 0.00 C ATOM 2160 O GLU A 138 19.908 -4.498 1.379 0.84 0.00 O ATOM 2161 CB GLU A 138 22.426 -2.937 -0.225 0.51 0.00 C ATOM 2162 CG GLU A 138 22.714 -1.944 -1.340 0.06 0.00 C ATOM 2163 CD GLU A 138 21.642 -1.944 -2.412 0.85 0.00 C ATOM 2164 OE1 GLU A 138 20.672 -1.169 -2.283 1.00 0.00 O ATOM 2165 OE2 GLU A 138 21.774 -2.719 -3.383 0.49 0.00 O ATOM 0 H GLU A 138 22.235 -0.904 1.153 0.11 0.00 H new ATOM 0 HA GLU A 138 20.319 -2.517 -0.107 0.06 0.00 H new ATOM 0 HB2 GLU A 138 23.279 -2.965 0.454 0.51 0.00 H new ATOM 0 HB3 GLU A 138 22.327 -3.934 -0.655 0.51 0.00 H new ATOM 0 HG2 GLU A 138 22.800 -0.943 -0.917 0.06 0.00 H new ATOM 0 HG3 GLU A 138 23.676 -2.182 -1.794 0.06 0.00 H new ATOM 2172 N LYS A 139 21.709 -3.867 2.577 0.07 0.00 N ATOM 2173 CA LYS A 139 21.549 -4.911 3.584 0.64 0.00 C ATOM 2174 C LYS A 139 20.175 -4.835 4.242 0.89 0.00 C ATOM 2175 O LYS A 139 19.610 -5.854 4.638 1.00 0.00 O ATOM 2176 CB LYS A 139 22.642 -4.786 4.646 1.00 0.00 C ATOM 2177 CG LYS A 139 24.052 -4.949 4.095 0.08 0.00 C ATOM 2178 CD LYS A 139 24.290 -6.350 3.552 1.00 0.00 C ATOM 2179 CE LYS A 139 24.280 -7.392 4.659 0.12 0.00 C ATOM 2180 NZ LYS A 139 24.524 -8.763 4.133 0.25 0.00 N ATOM 0 H LYS A 139 22.508 -3.253 2.731 0.07 0.00 H new ATOM 0 HA LYS A 139 21.636 -5.877 3.087 0.64 0.00 H new ATOM 0 HB2 LYS A 139 22.560 -3.811 5.127 1.00 0.00 H new ATOM 0 HB3 LYS A 139 22.474 -5.537 5.418 1.00 0.00 H new ATOM 0 HG2 LYS A 139 24.219 -4.219 3.303 0.08 0.00 H new ATOM 0 HG3 LYS A 139 24.776 -4.737 4.882 0.08 0.00 H new ATOM 0 HD2 LYS A 139 23.521 -6.591 2.818 1.00 0.00 H new ATOM 0 HD3 LYS A 139 25.247 -6.381 3.032 1.00 0.00 H new ATOM 0 HE2 LYS A 139 25.043 -7.145 5.397 0.12 0.00 H new ATOM 0 HE3 LYS A 139 23.319 -7.366 5.173 0.12 0.00 H new ATOM 0 HZ1 LYS A 139 24.509 -9.444 4.919 0.25 0.00 H new ATOM 0 HZ2 LYS A 139 23.781 -9.009 3.448 0.25 0.00 H new ATOM 0 HZ3 LYS A 139 25.452 -8.795 3.664 0.25 0.00 H new ATOM 2194 N ARG A 140 19.643 -3.622 4.357 1.00 0.00 N ATOM 2195 CA ARG A 140 18.335 -3.417 4.972 0.14 0.00 C ATOM 2196 C ARG A 140 17.221 -3.972 4.090 0.63 0.00 C ATOM 2197 O ARG A 140 16.228 -4.500 4.589 1.00 0.00 O ATOM 2198 CB ARG A 140 18.097 -1.928 5.231 1.00 0.00 C ATOM 2199 CG ARG A 140 16.798 -1.637 5.967 0.77 0.00 C ATOM 2200 CD ARG A 140 16.814 -2.208 7.376 1.00 0.00 C ATOM 2201 NE ARG A 140 17.889 -1.641 8.183 1.00 0.00 N ATOM 2202 CZ ARG A 140 18.215 -2.079 9.397 0.71 0.00 C ATOM 2203 NH1 ARG A 140 17.554 -3.093 9.940 0.12 0.00 N ATOM 2204 NH2 ARG A 140 19.204 -1.502 10.065 0.21 0.00 N ATOM 0 H ARG A 140 20.096 -2.767 4.033 1.00 0.00 H new ATOM 0 HA ARG A 140 18.323 -3.953 5.921 0.14 0.00 H new ATOM 0 HB2 ARG A 140 18.930 -1.531 5.811 1.00 0.00 H new ATOM 0 HB3 ARG A 140 18.091 -1.399 4.278 1.00 0.00 H new ATOM 0 HG2 ARG A 140 16.638 -0.560 6.012 0.77 0.00 H new ATOM 0 HG3 ARG A 140 15.961 -2.061 5.411 0.77 0.00 H new ATOM 0 HD2 ARG A 140 15.856 -2.011 7.858 1.00 0.00 H new ATOM 0 HD3 ARG A 140 16.930 -3.291 7.327 1.00 0.00 H new ATOM 0 HE ARG A 140 18.422 -0.863 7.794 1.00 0.00 H new ATOM 0 HH11 ARG A 140 16.794 -3.539 9.427 0.12 0.00 H new ATOM 0 HH12 ARG A 140 17.806 -3.426 10.870 0.12 0.00 H new ATOM 0 HH21 ARG A 140 19.714 -0.723 9.649 0.21 0.00 H new ATOM 0 HH22 ARG A 140 19.455 -1.837 10.995 0.21 0.00 H new ATOM 2218 N VAL A 141 17.392 -3.850 2.776 0.75 0.00 N ATOM 2219 CA VAL A 141 16.398 -4.338 1.826 0.15 0.00 C ATOM 2220 C VAL A 141 16.181 -5.839 1.977 0.35 0.00 C ATOM 2221 O VAL A 141 15.046 -6.309 2.025 0.11 0.00 O ATOM 2222 CB VAL A 141 16.811 -4.036 0.371 1.00 0.00 C ATOM 2223 CG1 VAL A 141 15.750 -4.527 -0.601 0.08 0.00 C ATOM 2224 CG2 VAL A 141 17.067 -2.548 0.185 1.00 0.00 C ATOM 0 H VAL A 141 18.209 -3.417 2.346 0.75 0.00 H new ATOM 0 HA VAL A 141 15.468 -3.814 2.049 0.15 0.00 H new ATOM 0 HB VAL A 141 17.738 -4.570 0.160 1.00 0.00 H new ATOM 0 HG11 VAL A 141 16.061 -4.304 -1.622 0.08 0.00 H new ATOM 0 HG12 VAL A 141 15.623 -5.604 -0.487 0.08 0.00 H new ATOM 0 HG13 VAL A 141 14.805 -4.026 -0.392 0.08 0.00 H new ATOM 0 HG21 VAL A 141 17.357 -2.355 -0.848 1.00 0.00 H new ATOM 0 HG22 VAL A 141 16.159 -1.991 0.417 1.00 0.00 H new ATOM 0 HG23 VAL A 141 17.868 -2.230 0.852 1.00 0.00 H new ATOM 2234 N SER A 142 17.277 -6.586 2.056 0.09 0.00 N ATOM 2235 CA SER A 142 17.207 -8.036 2.194 0.07 0.00 C ATOM 2236 C SER A 142 16.699 -8.437 3.576 0.13 0.00 C ATOM 2237 O SER A 142 16.062 -9.478 3.735 0.11 0.00 O ATOM 2238 CB SER A 142 18.581 -8.659 1.941 0.71 0.00 C ATOM 2239 OG SER A 142 18.532 -10.070 2.065 1.00 0.00 O ATOM 0 H SER A 142 18.225 -6.211 2.027 0.09 0.00 H new ATOM 0 HA SER A 142 16.502 -8.409 1.451 0.07 0.00 H new ATOM 0 HB2 SER A 142 18.927 -8.390 0.943 0.71 0.00 H new ATOM 0 HB3 SER A 142 19.304 -8.253 2.649 0.71 0.00 H new ATOM 0 HG SER A 142 19.422 -10.444 1.897 1.00 0.00 H new ATOM 2245 N ALA A 143 16.987 -7.605 4.572 0.50 0.00 N ATOM 2246 CA ALA A 143 16.564 -7.877 5.941 0.50 0.00 C ATOM 2247 C ALA A 143 15.043 -7.867 6.072 0.21 0.00 C ATOM 2248 O ALA A 143 14.443 -8.853 6.502 0.08 0.00 O ATOM 2249 CB ALA A 143 17.182 -6.862 6.891 0.48 0.00 C ATOM 0 H ALA A 143 17.511 -6.738 4.457 0.50 0.00 H new ATOM 0 HA ALA A 143 16.912 -8.875 6.206 0.50 0.00 H new ATOM 0 HB1 ALA A 143 16.860 -7.074 7.910 0.48 0.00 H new ATOM 0 HB2 ALA A 143 18.269 -6.925 6.834 0.48 0.00 H new ATOM 0 HB3 ALA A 143 16.861 -5.859 6.611 0.48 0.00 H new ATOM 2255 N ILE A 144 14.427 -6.749 5.700 1.00 0.00 N ATOM 2256 CA ILE A 144 12.977 -6.603 5.787 0.26 0.00 C ATOM 2257 C ILE A 144 12.247 -7.657 4.956 1.00 0.00 C ATOM 2258 O ILE A 144 11.231 -8.202 5.388 0.39 0.00 O ATOM 2259 CB ILE A 144 12.525 -5.203 5.329 0.29 0.00 C ATOM 2260 CG1 ILE A 144 13.039 -4.911 3.917 0.08 0.00 C ATOM 2261 CG2 ILE A 144 13.014 -4.144 6.310 0.48 0.00 C ATOM 2262 CD1 ILE A 144 12.516 -3.617 3.331 0.45 0.00 C ATOM 0 H ILE A 144 14.911 -5.929 5.334 1.00 0.00 H new ATOM 0 HA ILE A 144 12.718 -6.741 6.837 0.26 0.00 H new ATOM 0 HB ILE A 144 11.436 -5.177 5.308 0.29 0.00 H new ATOM 0 HG12 ILE A 144 14.128 -4.876 3.937 0.08 0.00 H new ATOM 0 HG13 ILE A 144 12.759 -5.735 3.261 0.08 0.00 H new ATOM 0 HG21 ILE A 144 12.688 -3.159 5.975 0.48 0.00 H new ATOM 0 HG22 ILE A 144 12.602 -4.346 7.299 0.48 0.00 H new ATOM 0 HG23 ILE A 144 14.103 -4.168 6.359 0.48 0.00 H new ATOM 0 HD11 ILE A 144 12.924 -3.480 2.330 0.45 0.00 H new ATOM 0 HD12 ILE A 144 11.428 -3.656 3.277 0.45 0.00 H new ATOM 0 HD13 ILE A 144 12.819 -2.783 3.964 0.45 0.00 H new ATOM 2274 N VAL A 145 12.767 -7.940 3.768 0.13 0.00 N ATOM 2275 CA VAL A 145 12.157 -8.923 2.880 1.00 0.00 C ATOM 2276 C VAL A 145 12.197 -10.322 3.486 0.69 0.00 C ATOM 2277 O VAL A 145 11.187 -11.025 3.511 0.08 0.00 O ATOM 2278 CB VAL A 145 12.852 -8.944 1.502 0.17 0.00 C ATOM 2279 CG1 VAL A 145 12.342 -10.099 0.652 0.93 0.00 C ATOM 2280 CG2 VAL A 145 12.647 -7.620 0.784 0.72 0.00 C ATOM 0 H VAL A 145 13.610 -7.503 3.397 0.13 0.00 H new ATOM 0 HA VAL A 145 11.117 -8.624 2.748 1.00 0.00 H new ATOM 0 HB VAL A 145 13.920 -9.090 1.662 0.17 0.00 H new ATOM 0 HG11 VAL A 145 12.848 -10.091 -0.314 0.93 0.00 H new ATOM 0 HG12 VAL A 145 12.545 -11.042 1.160 0.93 0.00 H new ATOM 0 HG13 VAL A 145 11.268 -9.992 0.500 0.93 0.00 H new ATOM 0 HG21 VAL A 145 13.143 -7.651 -0.186 0.72 0.00 H new ATOM 0 HG22 VAL A 145 11.581 -7.445 0.641 0.72 0.00 H new ATOM 0 HG23 VAL A 145 13.070 -6.813 1.382 0.72 0.00 H new ATOM 2290 N GLU A 146 13.368 -10.716 3.979 1.00 0.00 N ATOM 2291 CA GLU A 146 13.547 -12.038 4.574 0.43 0.00 C ATOM 2292 C GLU A 146 12.510 -12.312 5.661 0.18 0.00 C ATOM 2293 O GLU A 146 12.047 -13.443 5.815 0.68 0.00 O ATOM 2294 CB GLU A 146 14.956 -12.170 5.155 0.94 0.00 C ATOM 2295 CG GLU A 146 15.249 -13.546 5.735 0.66 0.00 C ATOM 2296 CD GLU A 146 15.154 -14.646 4.695 0.33 0.00 C ATOM 2297 OE1 GLU A 146 16.149 -14.870 3.974 0.73 0.00 O ATOM 2298 OE2 GLU A 146 14.084 -15.285 4.604 1.00 0.00 O ATOM 0 H GLU A 146 14.208 -10.138 3.978 1.00 0.00 H new ATOM 0 HA GLU A 146 13.409 -12.776 3.784 0.43 0.00 H new ATOM 0 HB2 GLU A 146 15.684 -11.952 4.374 0.94 0.00 H new ATOM 0 HB3 GLU A 146 15.090 -11.420 5.935 0.94 0.00 H new ATOM 0 HG2 GLU A 146 16.248 -13.548 6.171 0.66 0.00 H new ATOM 0 HG3 GLU A 146 14.548 -13.753 6.543 0.66 0.00 H new ATOM 2305 N GLN A 147 12.147 -11.277 6.411 1.00 0.00 N ATOM 2306 CA GLN A 147 11.168 -11.419 7.484 0.59 0.00 C ATOM 2307 C GLN A 147 9.799 -11.805 6.933 0.06 0.00 C ATOM 2308 O GLN A 147 9.120 -12.674 7.483 0.17 0.00 O ATOM 2309 CB GLN A 147 11.060 -10.119 8.282 0.26 0.00 C ATOM 2310 CG GLN A 147 12.379 -9.665 8.889 0.06 0.00 C ATOM 2311 CD GLN A 147 12.980 -10.696 9.826 0.64 0.00 C ATOM 2312 OE1 GLN A 147 12.260 -11.456 10.473 0.27 0.00 O ATOM 2313 NE2 GLN A 147 14.304 -10.726 9.899 1.00 0.00 N ATOM 0 H GLN A 147 12.515 -10.332 6.297 1.00 0.00 H new ATOM 0 HA GLN A 147 11.509 -12.216 8.144 0.59 0.00 H new ATOM 0 HB2 GLN A 147 10.680 -9.333 7.630 0.26 0.00 H new ATOM 0 HB3 GLN A 147 10.329 -10.252 9.080 0.26 0.00 H new ATOM 0 HG2 GLN A 147 13.088 -9.451 8.089 0.06 0.00 H new ATOM 0 HG3 GLN A 147 12.222 -8.734 9.433 0.06 0.00 H new ATOM 0 HE21 GLN A 147 14.860 -10.076 9.344 1.00 0.00 H new ATOM 0 HE22 GLN A 147 14.766 -11.399 10.511 1.00 0.00 H new ATOM 2322 N SER A 148 9.398 -11.156 5.843 1.00 0.00 N ATOM 2323 CA SER A 148 8.104 -11.429 5.222 1.00 0.00 C ATOM 2324 C SER A 148 8.256 -12.366 4.027 0.09 0.00 C ATOM 2325 O SER A 148 7.347 -12.491 3.206 0.24 0.00 O ATOM 2326 CB SER A 148 7.448 -10.119 4.779 0.37 0.00 C ATOM 2327 OG SER A 148 6.169 -10.352 4.220 0.13 0.00 O ATOM 0 H SER A 148 9.949 -10.439 5.372 1.00 0.00 H new ATOM 0 HA SER A 148 7.469 -11.918 5.961 1.00 0.00 H new ATOM 0 HB2 SER A 148 7.358 -9.447 5.633 0.37 0.00 H new ATOM 0 HB3 SER A 148 8.083 -9.621 4.047 0.37 0.00 H new ATOM 0 HG SER A 148 6.208 -11.131 3.626 0.13 0.00 H new ATOM 2333 N TRP A 149 9.408 -13.025 3.935 1.00 0.00 N ATOM 2334 CA TRP A 149 9.672 -13.947 2.839 1.00 0.00 C ATOM 2335 C TRP A 149 9.221 -15.359 3.196 0.16 0.00 C ATOM 2336 O TRP A 149 9.184 -16.246 2.342 1.00 0.00 O ATOM 2337 CB TRP A 149 11.163 -13.947 2.491 0.05 0.00 C ATOM 2338 CG TRP A 149 11.444 -14.393 1.089 0.35 0.00 C ATOM 2339 CD1 TRP A 149 11.311 -13.649 -0.048 0.07 0.00 C ATOM 2340 CD2 TRP A 149 11.905 -15.683 0.673 1.00 0.00 C ATOM 2341 NE1 TRP A 149 11.662 -14.397 -1.145 0.36 0.00 N ATOM 2342 CE2 TRP A 149 12.029 -15.650 -0.728 0.73 0.00 C ATOM 2343 CE3 TRP A 149 12.226 -16.862 1.351 0.26 0.00 C ATOM 2344 CZ2 TRP A 149 12.460 -16.750 -1.464 0.47 0.00 C ATOM 2345 CZ3 TRP A 149 12.654 -17.955 0.620 0.63 0.00 C ATOM 2346 CH2 TRP A 149 12.768 -17.892 -0.775 0.17 0.00 C ATOM 0 H TRP A 149 10.171 -12.937 4.606 1.00 0.00 H new ATOM 0 HA TRP A 149 9.104 -13.612 1.971 1.00 0.00 H new ATOM 0 HB2 TRP A 149 11.562 -12.943 2.632 0.05 0.00 H new ATOM 0 HB3 TRP A 149 11.691 -14.600 3.186 0.05 0.00 H new ATOM 0 HD1 TRP A 149 10.978 -12.622 -0.080 0.07 0.00 H new ATOM 0 HE1 TRP A 149 11.651 -14.073 -2.112 0.36 0.00 H new ATOM 0 HE3 TRP A 149 12.141 -16.919 2.426 0.26 0.00 H new ATOM 0 HZ2 TRP A 149 12.548 -16.704 -2.539 0.47 0.00 H new ATOM 0 HZ3 TRP A 149 12.904 -18.872 1.133 0.63 0.00 H new ATOM 0 HH2 TRP A 149 13.106 -18.762 -1.318 0.17 0.00 H new ATOM 2357 N ASN A 150 8.877 -15.560 4.464 0.60 0.00 N ATOM 2358 CA ASN A 150 8.427 -16.863 4.939 0.18 0.00 C ATOM 2359 C ASN A 150 7.431 -16.713 6.085 0.05 0.00 C ATOM 2360 O ASN A 150 6.891 -17.703 6.581 0.25 0.00 O ATOM 2361 CB ASN A 150 9.620 -17.709 5.393 0.23 0.00 C ATOM 2362 CG ASN A 150 10.308 -17.150 6.629 0.05 0.00 C ATOM 2363 OD1 ASN A 150 10.358 -15.827 6.746 1.00 0.00 O flip ATOM 2364 ND2 ASN A 150 10.796 -17.905 7.470 1.00 0.00 N flip ATOM 0 H ASN A 150 8.901 -14.836 5.182 0.60 0.00 H new ATOM 0 HA ASN A 150 7.928 -17.367 4.111 0.18 0.00 H new ATOM 0 HB2 ASN A 150 9.281 -18.724 5.600 0.23 0.00 H new ATOM 0 HB3 ASN A 150 10.343 -17.774 4.580 0.23 0.00 H new ATOM 0 HD21 ASN A 150 10.737 -18.915 7.344 1.00 0.00 H new ATOM 0 HD22 ASN A 150 11.259 -17.520 8.293 1.00 0.00 H new ATOM 2371 N ASP A 151 7.196 -15.471 6.502 1.00 0.00 N ATOM 2372 CA ASP A 151 6.262 -15.185 7.592 1.00 0.00 C ATOM 2373 C ASP A 151 6.716 -15.855 8.888 0.52 0.00 C ATOM 2374 O ASP A 151 5.957 -15.940 9.852 0.92 0.00 O ATOM 2375 CB ASP A 151 4.850 -15.649 7.221 1.00 0.00 C ATOM 2376 CG ASP A 151 3.801 -15.174 8.208 0.18 0.00 C ATOM 2377 OD1 ASP A 151 3.408 -13.991 8.133 0.51 0.00 O ATOM 2378 OD2 ASP A 151 3.374 -15.985 9.058 1.00 0.00 O ATOM 0 H ASP A 151 7.640 -14.644 6.102 1.00 0.00 H new ATOM 0 HA ASP A 151 6.246 -14.107 7.752 1.00 0.00 H new ATOM 0 HB2 ASP A 151 4.600 -15.281 6.226 1.00 0.00 H new ATOM 0 HB3 ASP A 151 4.831 -16.738 7.172 1.00 0.00 H new ATOM 2383 N SER A 152 7.965 -16.319 8.897 0.29 0.00 N ATOM 2384 CA SER A 152 8.540 -16.985 10.066 0.36 0.00 C ATOM 2385 C SER A 152 7.585 -18.034 10.631 0.32 0.00 C ATOM 2386 O SER A 152 6.867 -17.721 11.606 0.10 0.00 O ATOM 2387 CB SER A 152 8.900 -15.957 11.144 0.64 0.00 C ATOM 2388 OG SER A 152 7.762 -15.216 11.551 1.00 0.00 O ATOM 2389 OXT SER A 152 7.563 -19.162 10.094 0.38 0.00 O ATOM 0 H SER A 152 8.601 -16.245 8.103 0.29 0.00 H new ATOM 0 HA SER A 152 9.449 -17.495 9.747 0.36 0.00 H new ATOM 0 HB2 SER A 152 9.332 -16.467 12.005 0.64 0.00 H new ATOM 0 HB3 SER A 152 9.661 -15.277 10.761 0.64 0.00 H new ATOM 0 HG SER A 152 6.951 -15.737 11.371 1.00 0.00 H new TER 2395 SER A 152