USER MOD reduce.3.24.130724 H: found=0, std=0, add=1309, rem=0, adj=45 USER MOD reduce.3.24.130724 removed 1309 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 103 GLN : amide:sc= 1.71 K(o=2.6,f=-1.3) USER MOD Set 1.2: A 115 ASN : amide:sc= 0.885 K(o=2.6,f=0.54) USER MOD Set 2.1: A 96 SER OG : rot -141:sc= 1.22 USER MOD Set 2.2: A 122 ASN :FLIP amide:sc= 1.07 F(o=0.57,f=2.3) USER MOD Set 3.1: A 70 ASN :FLIP amide:sc= 0.0929 F(o=-0.32,f=0.37) USER MOD Set 3.2: A 81 THR OG1 : rot 150:sc= 0.279 USER MOD Set 4.1: A 34 GLN : amide:sc= 1.09 K(o=0.86,f=-6.7!) USER MOD Set 4.2: A 53 THR OG1 : rot 130:sc= -0.229 USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ -167:sc= -0.014 (180deg=-0.25) USER MOD Single : A 3 GLN : amide:sc= -0.0285 X(o=-0.029,f=-0.45) USER MOD Single : A 4 GLN : amide:sc= 0 K(o=0,f=-0.67) USER MOD Single : A 5 SER OG : rot 180:sc= 0 USER MOD Single : A 9 GLN : amide:sc=-0.00998 X(o=-0.01,f=-0.38) USER MOD Single : A 10 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 11 LYS NZ :NH3+ 151:sc= -1.87! (180deg=-3.64!) USER MOD Single : A 12 HIS : no HD1:sc= -0.123 X(o=-0.12,f=-0.12) USER MOD Single : A 13 SER OG : rot 180:sc= 0 USER MOD Single : A 15 SER OG : rot 180:sc= 0 USER MOD Single : A 16 THR OG1 : rot 180:sc= 0 USER MOD Single : A 18 ASN : amide:sc= -0.282 K(o=-0.28,f=-1.4) USER MOD Single : A 19 GLN : amide:sc= -0.657 K(o=-0.66,f=-5!) USER MOD Single : A 21 MET CE :methyl 135:sc= -1.15 (180deg=-3.83!) USER MOD Single : A 22 THR OG1 : rot 180:sc= 0 USER MOD Single : A 23 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 25 ASN : amide:sc=-0.00671 X(o=-0.0067,f=-0.4) USER MOD Single : A 26 GLN : amide:sc= 0.168 X(o=0.17,f=-0.081) USER MOD Single : A 28 THR OG1 : rot 180:sc= -0.0884 USER MOD Single : A 30 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 32 THR OG1 : rot 71:sc= 0.701 USER MOD Single : A 33 GLN : amide:sc= -0.0623 X(o=-0.062,f=-0.43) USER MOD Single : A 35 ASN : amide:sc= -0.0237 X(o=-0.024,f=-0.5) USER MOD Single : A 38 ASN :FLIP amide:sc= -0.431 F(o=-3.3!,f=-0.43) USER MOD Single : A 40 LYS NZ :NH3+ -172:sc= 0 (180deg=-0.066) USER MOD Single : A 41 SER OG : rot -136:sc= 0.698 USER MOD Single : A 42 SER OG : rot 180:sc= 0 USER MOD Single : A 43 SER OG : rot 180:sc= 0 USER MOD Single : A 46 TYR OH : rot -154:sc= 0.36 USER MOD Single : A 52 LYS NZ :NH3+ -164:sc= -0.0372 (180deg=-0.293) USER MOD Single : A 59 SER OG : rot -43:sc= 0.314 USER MOD Single : A 60 GLN :FLIP amide:sc= -0.989 F(o=-2.4!,f=-0.99) USER MOD Single : A 63 THR OG1 : rot 180:sc= 0 USER MOD Single : A 66 MET CE :methyl -134:sc= 0 (180deg=-0.607) USER MOD Single : A 67 SER OG : rot 180:sc= -0.153 USER MOD Single : A 72 THR OG1 : rot 180:sc= 0 USER MOD Single : A 78 THR OG1 : rot 77:sc= -0.175 USER MOD Single : A 79 THR OG1 : rot -14:sc= 0.0369 USER MOD Single : A 85 GLN : amide:sc= -0.987 K(o=-0.99,f=-4!) USER MOD Single : A 88 SER OG : rot 180:sc= 0 USER MOD Single : A 89 ASN : amide:sc= -0.481 X(o=-0.48,f=-0.017) USER MOD Single : A 98 THR OG1 : rot 180:sc= 0 USER MOD Single : A 101 TYR OH : rot 180:sc= 0 USER MOD Single : A 105 GLN :FLIP amide:sc= -2.11 F(o=-2.8!,f=-2.1) USER MOD Single : A 107 THR OG1 : rot 180:sc= 0.119 USER MOD Single : A 110 ASN :FLIP amide:sc= -0.231 F(o=-0.8,f=-0.23) USER MOD Single : A 112 GLN : amide:sc= -0.958 X(o=-0.96,f=-0.96) USER MOD Single : A 117 GLN :FLIP amide:sc= -0.728 F(o=-2.3,f=-0.73) USER MOD Single : A 118 ASN : amide:sc=-0.00118 X(o=-0.0012,f=-0.0012) USER MOD Single : A 119 GLN : amide:sc= -0.204 X(o=-0.2,f=-0.43) USER MOD Single : A 126 SER OG : rot 180:sc= -0.0694 USER MOD Single : A 131 SER OG : rot -133:sc= 0.481 USER MOD Single : A 138 GLN :FLIP amide:sc= 0 F(o=-1,f=0) USER MOD Single : A 140 LYS NZ :NH3+ -170:sc= 0 (180deg=-0.0735) USER MOD Single : A 143 SER OG : rot 180:sc= 0 USER MOD Single : A 146 GLN : amide:sc= 0.239 X(o=0.24,f=0) USER MOD Single : A 153 HIS : +bothHN:sc= -0.988 K(o=-0.99,f=-8.5!) USER MOD Single : A 156 GLN : amide:sc= 0.427 X(o=0.43,f=0) USER MOD Single : A 159 MET CE :methyl 160:sc= -0.132 (180deg=-0.641) USER MOD Single : A 160 GLN : amide:sc= 0 X(o=0,f=-0.35) USER MOD Single : A 163 HIS :FLIP no HD1:sc= 0.00649 F(o=-1.3,f=0.0065) USER MOD Single : A 164 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 165 HIS : no HD1:sc= -0.0421 K(o=-0.042,f=-0.62) USER MOD Single : A 166 HIS : no HD1:sc= -0.205 X(o=-0.2,f=0) USER MOD Single : A 167 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 168 HIS : no HD1:sc= -0.179 K(o=-0.18,f=-0.92) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 46.871 28.978 36.540 1.00 71.25 N ATOM 2 CA MET A 1 47.357 27.816 35.750 1.00 24.13 C ATOM 3 C MET A 1 46.373 26.641 35.843 1.00 71.53 C ATOM 4 O MET A 1 46.207 26.041 36.907 1.00 75.51 O ATOM 5 CB MET A 1 48.749 27.385 36.241 1.00 75.25 C ATOM 6 CG MET A 1 49.819 28.461 36.074 1.00 30.44 C ATOM 7 SD MET A 1 51.438 27.940 36.682 1.00 72.02 S ATOM 8 CE MET A 1 52.439 29.372 36.268 1.00 52.34 C ATOM 0 H1 MET A 1 47.425 29.823 36.292 1.00 71.25 H new ATOM 0 H2 MET A 1 45.867 29.147 36.327 1.00 71.25 H new ATOM 0 H3 MET A 1 46.981 28.778 37.555 1.00 71.25 H new ATOM 0 HA MET A 1 47.429 28.119 34.705 1.00 24.13 H new ATOM 0 HB2 MET A 1 48.684 27.110 37.294 1.00 75.25 H new ATOM 0 HB3 MET A 1 49.056 26.492 35.697 1.00 75.25 H new ATOM 0 HG2 MET A 1 49.900 28.726 35.020 1.00 30.44 H new ATOM 0 HG3 MET A 1 49.509 29.361 36.605 1.00 30.44 H new ATOM 0 HE1 MET A 1 53.468 29.200 36.583 1.00 52.34 H new ATOM 0 HE2 MET A 1 52.412 29.536 35.191 1.00 52.34 H new ATOM 0 HE3 MET A 1 52.046 30.251 36.779 1.00 52.34 H new ATOM 20 N VAL A 2 45.719 26.322 34.726 1.00 24.43 N ATOM 21 CA VAL A 2 44.711 25.253 34.686 1.00 35.31 C ATOM 22 C VAL A 2 44.788 24.453 33.371 1.00 21.12 C ATOM 23 O VAL A 2 44.891 25.027 32.286 1.00 21.44 O ATOM 24 CB VAL A 2 43.278 25.831 34.865 1.00 3.33 C ATOM 25 CG1 VAL A 2 42.967 26.873 33.788 1.00 61.34 C ATOM 26 CG2 VAL A 2 42.230 24.716 34.865 1.00 22.51 C ATOM 0 H VAL A 2 45.868 26.789 33.831 1.00 24.43 H new ATOM 0 HA VAL A 2 44.927 24.578 35.514 1.00 35.31 H new ATOM 0 HB VAL A 2 43.239 26.328 35.834 1.00 3.33 H new ATOM 0 HG11 VAL A 2 41.959 27.261 33.937 1.00 61.34 H new ATOM 0 HG12 VAL A 2 43.684 27.691 33.855 1.00 61.34 H new ATOM 0 HG13 VAL A 2 43.036 26.410 32.803 1.00 61.34 H new ATOM 0 HG21 VAL A 2 41.238 25.149 34.992 1.00 22.51 H new ATOM 0 HG22 VAL A 2 42.272 24.177 33.919 1.00 22.51 H new ATOM 0 HG23 VAL A 2 42.432 24.027 35.685 1.00 22.51 H new ATOM 36 N GLN A 3 44.747 23.125 33.478 1.00 31.25 N ATOM 37 CA GLN A 3 44.795 22.243 32.304 1.00 55.53 C ATOM 38 C GLN A 3 43.596 21.283 32.281 1.00 73.03 C ATOM 39 O GLN A 3 43.386 20.519 33.226 1.00 15.40 O ATOM 40 CB GLN A 3 46.107 21.438 32.297 1.00 54.34 C ATOM 41 CG GLN A 3 46.241 20.484 31.110 1.00 1.51 C ATOM 42 CD GLN A 3 46.264 21.206 29.772 1.00 62.12 C ATOM 43 OE1 GLN A 3 46.738 22.335 29.667 1.00 54.13 O ATOM 44 NE2 GLN A 3 45.740 20.574 28.744 1.00 32.32 N ATOM 0 H GLN A 3 44.680 22.631 34.368 1.00 31.25 H new ATOM 0 HA GLN A 3 44.750 22.869 31.413 1.00 55.53 H new ATOM 0 HB2 GLN A 3 46.948 22.132 32.290 1.00 54.34 H new ATOM 0 HB3 GLN A 3 46.175 20.864 33.221 1.00 54.34 H new ATOM 0 HG2 GLN A 3 47.156 19.902 31.219 1.00 1.51 H new ATOM 0 HG3 GLN A 3 45.411 19.778 31.122 1.00 1.51 H new ATOM 0 HE21 GLN A 3 45.355 19.637 28.864 1.00 32.32 H new ATOM 0 HE22 GLN A 3 45.719 21.021 27.827 1.00 32.32 H new ATOM 53 N GLN A 4 42.814 21.317 31.198 1.00 60.12 N ATOM 54 CA GLN A 4 41.632 20.450 31.074 1.00 30.10 C ATOM 55 C GLN A 4 40.989 20.553 29.678 1.00 62.51 C ATOM 56 O GLN A 4 40.988 21.616 29.059 1.00 63.11 O ATOM 57 CB GLN A 4 40.595 20.826 32.146 1.00 30.31 C ATOM 58 CG GLN A 4 39.503 19.782 32.355 1.00 74.03 C ATOM 59 CD GLN A 4 38.482 20.205 33.399 1.00 12.24 C ATOM 60 OE1 GLN A 4 38.788 20.970 34.309 1.00 75.10 O ATOM 61 NE2 GLN A 4 37.275 19.688 33.294 1.00 33.05 N ATOM 0 H GLN A 4 42.974 21.930 30.398 1.00 60.12 H new ATOM 0 HA GLN A 4 41.961 19.421 31.217 1.00 30.10 H new ATOM 0 HB2 GLN A 4 41.111 20.990 33.092 1.00 30.31 H new ATOM 0 HB3 GLN A 4 40.129 21.772 31.869 1.00 30.31 H new ATOM 0 HG2 GLN A 4 38.995 19.599 31.408 1.00 74.03 H new ATOM 0 HG3 GLN A 4 39.959 18.840 32.659 1.00 74.03 H new ATOM 0 HE21 GLN A 4 37.056 19.056 32.524 1.00 33.05 H new ATOM 0 HE22 GLN A 4 36.559 19.920 33.982 1.00 33.05 H new ATOM 70 N SER A 5 40.444 19.434 29.194 1.00 31.24 N ATOM 71 CA SER A 5 39.706 19.399 27.918 1.00 2.11 C ATOM 72 C SER A 5 38.404 18.595 28.066 1.00 14.33 C ATOM 73 O SER A 5 38.080 18.121 29.158 1.00 2.25 O ATOM 74 CB SER A 5 40.574 18.799 26.801 1.00 52.02 C ATOM 75 OG SER A 5 41.718 19.602 26.549 1.00 51.25 O ATOM 0 H SER A 5 40.498 18.532 29.667 1.00 31.24 H new ATOM 0 HA SER A 5 39.454 20.424 27.647 1.00 2.11 H new ATOM 0 HB2 SER A 5 40.887 17.793 27.082 1.00 52.02 H new ATOM 0 HB3 SER A 5 39.984 18.706 25.889 1.00 52.02 H new ATOM 0 HG SER A 5 42.252 19.195 25.835 1.00 51.25 H new ATOM 81 N GLU A 6 37.663 18.436 26.971 1.00 21.42 N ATOM 82 CA GLU A 6 36.360 17.749 27.004 1.00 14.31 C ATOM 83 C GLU A 6 36.306 16.554 26.029 1.00 24.41 C ATOM 84 O GLU A 6 37.233 16.333 25.246 1.00 50.23 O ATOM 85 CB GLU A 6 35.229 18.756 26.715 1.00 12.33 C ATOM 86 CG GLU A 6 35.613 19.896 25.772 1.00 65.24 C ATOM 87 CD GLU A 6 35.976 19.427 24.372 1.00 42.04 C ATOM 88 OE1 GLU A 6 35.064 19.307 23.526 1.00 3.54 O ATOM 89 OE2 GLU A 6 37.175 19.192 24.110 1.00 53.43 O ATOM 0 H GLU A 6 37.937 18.771 26.047 1.00 21.42 H new ATOM 0 HA GLU A 6 36.222 17.339 28.004 1.00 14.31 H new ATOM 0 HB2 GLU A 6 34.383 18.218 26.287 1.00 12.33 H new ATOM 0 HB3 GLU A 6 34.891 19.182 27.659 1.00 12.33 H new ATOM 0 HG2 GLU A 6 34.783 20.599 25.707 1.00 65.24 H new ATOM 0 HG3 GLU A 6 36.458 20.439 26.196 1.00 65.24 H new ATOM 96 N VAL A 7 35.217 15.781 26.091 1.00 41.11 N ATOM 97 CA VAL A 7 35.076 14.560 25.276 1.00 11.24 C ATOM 98 C VAL A 7 34.601 14.861 23.841 1.00 25.40 C ATOM 99 O VAL A 7 33.994 15.900 23.574 1.00 11.12 O ATOM 100 CB VAL A 7 34.100 13.550 25.936 1.00 32.24 C ATOM 101 CG1 VAL A 7 34.612 13.120 27.311 1.00 64.14 C ATOM 102 CG2 VAL A 7 32.693 14.136 26.039 1.00 24.51 C ATOM 0 H VAL A 7 34.418 15.975 26.695 1.00 41.11 H new ATOM 0 HA VAL A 7 36.071 14.119 25.221 1.00 11.24 H new ATOM 0 HB VAL A 7 34.050 12.666 25.300 1.00 32.24 H new ATOM 0 HG11 VAL A 7 33.912 12.412 27.755 1.00 64.14 H new ATOM 0 HG12 VAL A 7 35.588 12.647 27.204 1.00 64.14 H new ATOM 0 HG13 VAL A 7 34.702 13.994 27.956 1.00 64.14 H new ATOM 0 HG21 VAL A 7 32.029 13.408 26.505 1.00 24.51 H new ATOM 0 HG22 VAL A 7 32.720 15.042 26.644 1.00 24.51 H new ATOM 0 HG23 VAL A 7 32.325 14.376 25.042 1.00 24.51 H new ATOM 112 N ARG A 8 34.871 13.931 22.922 1.00 12.45 N ATOM 113 CA ARG A 8 34.530 14.106 21.505 1.00 41.33 C ATOM 114 C ARG A 8 33.641 12.959 20.986 1.00 30.34 C ATOM 115 O ARG A 8 34.003 11.781 21.075 1.00 71.22 O ATOM 116 CB ARG A 8 35.819 14.218 20.673 1.00 21.43 C ATOM 117 CG ARG A 8 36.673 15.426 21.058 1.00 72.11 C ATOM 118 CD ARG A 8 35.934 16.737 20.807 1.00 42.12 C ATOM 119 NE ARG A 8 36.595 17.879 21.438 1.00 10.45 N ATOM 120 CZ ARG A 8 37.050 18.916 20.793 1.00 13.31 C ATOM 121 NH1 ARG A 8 37.013 18.961 19.499 1.00 31.15 N ATOM 122 NH2 ARG A 8 37.550 19.906 21.454 1.00 41.21 N ATOM 0 H ARG A 8 35.327 13.044 23.134 1.00 12.45 H new ATOM 0 HA ARG A 8 33.955 15.027 21.403 1.00 41.33 H new ATOM 0 HB2 ARG A 8 36.407 13.309 20.799 1.00 21.43 H new ATOM 0 HB3 ARG A 8 35.559 14.285 19.617 1.00 21.43 H new ATOM 0 HG2 ARG A 8 36.948 15.358 22.111 1.00 72.11 H new ATOM 0 HG3 ARG A 8 37.600 15.415 20.485 1.00 72.11 H new ATOM 0 HD2 ARG A 8 35.862 16.910 19.733 1.00 42.12 H new ATOM 0 HD3 ARG A 8 34.915 16.655 21.186 1.00 42.12 H new ATOM 0 HE ARG A 8 36.707 17.863 22.452 1.00 10.45 H new ATOM 0 HH11 ARG A 8 36.624 18.179 18.972 1.00 31.15 H new ATOM 0 HH12 ARG A 8 37.373 19.779 19.007 1.00 31.15 H new ATOM 0 HH21 ARG A 8 37.587 19.872 22.473 1.00 41.21 H new ATOM 0 HH22 ARG A 8 37.908 20.722 20.957 1.00 41.21 H new ATOM 136 N GLN A 9 32.473 13.313 20.449 1.00 61.10 N ATOM 137 CA GLN A 9 31.503 12.321 19.962 1.00 31.03 C ATOM 138 C GLN A 9 31.754 11.938 18.493 1.00 33.13 C ATOM 139 O GLN A 9 32.171 12.771 17.683 1.00 0.21 O ATOM 140 CB GLN A 9 30.076 12.862 20.111 1.00 43.22 C ATOM 141 CG GLN A 9 29.756 13.401 21.501 1.00 22.43 C ATOM 142 CD GLN A 9 29.947 12.374 22.607 1.00 32.22 C ATOM 143 OE1 GLN A 9 29.780 11.176 22.402 1.00 12.55 O ATOM 144 NE2 GLN A 9 30.307 12.836 23.786 1.00 15.01 N ATOM 0 H GLN A 9 32.171 14.281 20.338 1.00 61.10 H new ATOM 0 HA GLN A 9 31.627 11.424 20.568 1.00 31.03 H new ATOM 0 HB2 GLN A 9 29.922 13.656 19.381 1.00 43.22 H new ATOM 0 HB3 GLN A 9 29.371 12.067 19.870 1.00 43.22 H new ATOM 0 HG2 GLN A 9 30.391 14.264 21.703 1.00 22.43 H new ATOM 0 HG3 GLN A 9 28.725 13.754 21.517 1.00 22.43 H new ATOM 0 HE21 GLN A 9 30.437 13.838 23.923 1.00 15.01 H new ATOM 0 HE22 GLN A 9 30.456 12.192 24.563 1.00 15.01 H new ATOM 153 N MET A 10 31.475 10.679 18.153 1.00 23.21 N ATOM 154 CA MET A 10 31.677 10.168 16.789 1.00 35.53 C ATOM 155 C MET A 10 30.410 9.465 16.263 1.00 14.12 C ATOM 156 O MET A 10 29.744 8.730 16.998 1.00 41.04 O ATOM 157 CB MET A 10 32.859 9.187 16.762 1.00 1.15 C ATOM 158 CG MET A 10 34.166 9.770 17.289 1.00 21.33 C ATOM 159 SD MET A 10 34.730 11.199 16.341 1.00 60.33 S ATOM 160 CE MET A 10 36.223 11.630 17.235 1.00 11.22 C ATOM 0 H MET A 10 31.106 9.987 18.806 1.00 23.21 H new ATOM 0 HA MET A 10 31.893 11.018 16.142 1.00 35.53 H new ATOM 0 HB2 MET A 10 32.601 8.308 17.353 1.00 1.15 H new ATOM 0 HB3 MET A 10 33.012 8.848 15.737 1.00 1.15 H new ATOM 0 HG2 MET A 10 34.034 10.061 18.331 1.00 21.33 H new ATOM 0 HG3 MET A 10 34.936 8.999 17.268 1.00 21.33 H new ATOM 0 HE1 MET A 10 36.689 12.498 16.769 1.00 11.22 H new ATOM 0 HE2 MET A 10 35.973 11.864 18.270 1.00 11.22 H new ATOM 0 HE3 MET A 10 36.917 10.790 17.211 1.00 11.22 H new ATOM 170 N LYS A 11 30.073 9.704 14.995 1.00 40.44 N ATOM 171 CA LYS A 11 28.913 9.056 14.358 1.00 24.31 C ATOM 172 C LYS A 11 29.120 8.898 12.840 1.00 31.23 C ATOM 173 O LYS A 11 29.490 9.847 12.148 1.00 12.41 O ATOM 174 CB LYS A 11 27.627 9.855 14.646 1.00 61.12 C ATOM 175 CG LYS A 11 27.723 11.342 14.304 1.00 21.35 C ATOM 176 CD LYS A 11 26.445 12.109 14.665 1.00 35.40 C ATOM 177 CE LYS A 11 25.315 11.907 13.650 1.00 65.45 C ATOM 178 NZ LYS A 11 24.886 10.488 13.529 1.00 15.50 N ATOM 0 H LYS A 11 30.584 10.341 14.384 1.00 40.44 H new ATOM 0 HA LYS A 11 28.811 8.058 14.785 1.00 24.31 H new ATOM 0 HB2 LYS A 11 26.805 9.416 14.080 1.00 61.12 H new ATOM 0 HB3 LYS A 11 27.377 9.752 15.702 1.00 61.12 H new ATOM 0 HG2 LYS A 11 28.568 11.780 14.834 1.00 21.35 H new ATOM 0 HG3 LYS A 11 27.922 11.455 13.238 1.00 21.35 H new ATOM 0 HD2 LYS A 11 26.103 11.789 15.649 1.00 35.40 H new ATOM 0 HD3 LYS A 11 26.675 13.172 14.737 1.00 35.40 H new ATOM 0 HE2 LYS A 11 24.459 12.515 13.942 1.00 65.45 H new ATOM 0 HE3 LYS A 11 25.643 12.266 12.674 1.00 65.45 H new ATOM 0 HZ1 LYS A 11 23.883 10.451 13.257 1.00 15.50 H new ATOM 0 HZ2 LYS A 11 25.460 10.013 12.803 1.00 15.50 H new ATOM 0 HZ3 LYS A 11 25.015 10.007 14.442 1.00 15.50 H new ATOM 192 N HIS A 12 28.905 7.680 12.332 1.00 21.24 N ATOM 193 CA HIS A 12 29.057 7.391 10.894 1.00 15.32 C ATOM 194 C HIS A 12 28.009 6.368 10.409 1.00 25.22 C ATOM 195 O HIS A 12 27.927 5.255 10.935 1.00 32.41 O ATOM 196 CB HIS A 12 30.468 6.855 10.601 1.00 34.45 C ATOM 197 CG HIS A 12 31.573 7.806 10.960 1.00 3.25 C ATOM 198 ND1 HIS A 12 32.027 8.793 10.111 1.00 54.41 N ATOM 199 CD2 HIS A 12 32.317 7.918 12.087 1.00 24.24 C ATOM 200 CE1 HIS A 12 32.997 9.465 10.698 1.00 52.22 C ATOM 201 NE2 HIS A 12 33.191 8.957 11.895 1.00 42.12 N ATOM 0 H HIS A 12 28.625 6.875 12.892 1.00 21.24 H new ATOM 0 HA HIS A 12 28.902 8.326 10.355 1.00 15.32 H new ATOM 0 HB2 HIS A 12 30.612 5.924 11.149 1.00 34.45 H new ATOM 0 HB3 HIS A 12 30.541 6.615 9.540 1.00 34.45 H new ATOM 0 HD2 HIS A 12 32.237 7.304 12.972 1.00 24.24 H new ATOM 0 HE1 HIS A 12 33.541 10.293 10.268 1.00 52.22 H new ATOM 0 HE2 HIS A 12 33.881 9.283 12.572 1.00 42.12 H new ATOM 210 N SER A 13 27.218 6.750 9.403 1.00 24.22 N ATOM 211 CA SER A 13 26.201 5.851 8.816 1.00 44.42 C ATOM 212 C SER A 13 26.287 5.837 7.280 1.00 72.41 C ATOM 213 O SER A 13 25.856 6.780 6.615 1.00 43.34 O ATOM 214 CB SER A 13 24.782 6.272 9.241 1.00 50.40 C ATOM 215 OG SER A 13 24.625 6.251 10.654 1.00 42.14 O ATOM 0 H SER A 13 27.256 7.674 8.973 1.00 24.22 H new ATOM 0 HA SER A 13 26.406 4.848 9.190 1.00 44.42 H new ATOM 0 HB2 SER A 13 24.573 7.274 8.867 1.00 50.40 H new ATOM 0 HB3 SER A 13 24.053 5.603 8.784 1.00 50.40 H new ATOM 0 HG SER A 13 23.713 6.525 10.886 1.00 42.14 H new ATOM 221 N VAL A 14 26.850 4.764 6.724 1.00 22.02 N ATOM 222 CA VAL A 14 26.965 4.601 5.264 1.00 3.12 C ATOM 223 C VAL A 14 25.965 3.548 4.747 1.00 63.51 C ATOM 224 O VAL A 14 25.674 2.573 5.440 1.00 4.34 O ATOM 225 CB VAL A 14 28.407 4.181 4.863 1.00 14.24 C ATOM 226 CG1 VAL A 14 28.545 4.045 3.345 1.00 22.55 C ATOM 227 CG2 VAL A 14 29.431 5.175 5.418 1.00 24.21 C ATOM 0 H VAL A 14 27.237 3.988 7.261 1.00 22.02 H new ATOM 0 HA VAL A 14 26.735 5.565 4.809 1.00 3.12 H new ATOM 0 HB VAL A 14 28.606 3.203 5.301 1.00 14.24 H new ATOM 0 HG11 VAL A 14 29.565 3.750 3.097 1.00 22.55 H new ATOM 0 HG12 VAL A 14 27.850 3.287 2.983 1.00 22.55 H new ATOM 0 HG13 VAL A 14 28.318 5.001 2.872 1.00 22.55 H new ATOM 0 HG21 VAL A 14 30.434 4.864 5.127 1.00 24.21 H new ATOM 0 HG22 VAL A 14 29.228 6.168 5.017 1.00 24.21 H new ATOM 0 HG23 VAL A 14 29.360 5.201 6.505 1.00 24.21 H new ATOM 237 N SER A 15 25.426 3.749 3.542 1.00 51.42 N ATOM 238 CA SER A 15 24.455 2.803 2.964 1.00 75.20 C ATOM 239 C SER A 15 25.040 2.049 1.757 1.00 54.30 C ATOM 240 O SER A 15 25.046 2.557 0.637 1.00 30.34 O ATOM 241 CB SER A 15 23.167 3.534 2.546 1.00 12.53 C ATOM 242 OG SER A 15 22.524 4.141 3.662 1.00 25.53 O ATOM 0 H SER A 15 25.640 4.550 2.948 1.00 51.42 H new ATOM 0 HA SER A 15 24.219 2.072 3.738 1.00 75.20 H new ATOM 0 HB2 SER A 15 23.405 4.296 1.804 1.00 12.53 H new ATOM 0 HB3 SER A 15 22.485 2.828 2.072 1.00 12.53 H new ATOM 0 HG SER A 15 21.711 4.598 3.362 1.00 25.53 H new ATOM 248 N THR A 16 25.537 0.836 1.999 1.00 62.53 N ATOM 249 CA THR A 16 26.095 -0.017 0.935 1.00 33.52 C ATOM 250 C THR A 16 25.018 -0.945 0.345 1.00 44.42 C ATOM 251 O THR A 16 23.820 -0.681 0.473 1.00 53.31 O ATOM 252 CB THR A 16 27.262 -0.885 1.476 1.00 70.14 C ATOM 253 OG1 THR A 16 26.798 -1.713 2.553 1.00 41.42 O ATOM 254 CG2 THR A 16 28.417 -0.012 1.962 1.00 61.25 C ATOM 0 H THR A 16 25.567 0.415 2.927 1.00 62.53 H new ATOM 0 HA THR A 16 26.466 0.646 0.154 1.00 33.52 H new ATOM 0 HB THR A 16 27.623 -1.512 0.661 1.00 70.14 H new ATOM 0 HG1 THR A 16 27.539 -2.259 2.888 1.00 41.42 H new ATOM 0 HG21 THR A 16 29.221 -0.647 2.336 1.00 61.25 H new ATOM 0 HG22 THR A 16 28.788 0.594 1.135 1.00 61.25 H new ATOM 0 HG23 THR A 16 28.068 0.641 2.762 1.00 61.25 H new ATOM 262 N LEU A 17 25.443 -2.013 -0.333 1.00 62.12 N ATOM 263 CA LEU A 17 24.511 -3.034 -0.833 1.00 31.05 C ATOM 264 C LEU A 17 24.094 -3.993 0.295 1.00 74.23 C ATOM 265 O LEU A 17 24.578 -3.883 1.425 1.00 41.23 O ATOM 266 CB LEU A 17 25.156 -3.831 -1.977 1.00 2.14 C ATOM 267 CG LEU A 17 25.535 -3.016 -3.222 1.00 54.42 C ATOM 268 CD1 LEU A 17 26.214 -3.905 -4.261 1.00 21.32 C ATOM 269 CD2 LEU A 17 24.306 -2.336 -3.821 1.00 40.54 C ATOM 0 H LEU A 17 26.423 -2.196 -0.550 1.00 62.12 H new ATOM 0 HA LEU A 17 23.622 -2.526 -1.206 1.00 31.05 H new ATOM 0 HB2 LEU A 17 26.054 -4.317 -1.596 1.00 2.14 H new ATOM 0 HB3 LEU A 17 24.469 -4.622 -2.278 1.00 2.14 H new ATOM 0 HG LEU A 17 26.239 -2.241 -2.918 1.00 54.42 H new ATOM 0 HD11 LEU A 17 26.475 -3.309 -5.135 1.00 21.32 H new ATOM 0 HD12 LEU A 17 27.119 -4.338 -3.834 1.00 21.32 H new ATOM 0 HD13 LEU A 17 25.534 -4.704 -4.556 1.00 21.32 H new ATOM 0 HD21 LEU A 17 24.599 -1.765 -4.702 1.00 40.54 H new ATOM 0 HD22 LEU A 17 23.575 -3.092 -4.106 1.00 40.54 H new ATOM 0 HD23 LEU A 17 23.866 -1.665 -3.083 1.00 40.54 H new ATOM 281 N ASN A 18 23.200 -4.931 -0.013 1.00 11.04 N ATOM 282 CA ASN A 18 22.785 -5.949 0.961 1.00 34.31 C ATOM 283 C ASN A 18 23.935 -6.927 1.283 1.00 11.04 C ATOM 284 O ASN A 18 23.988 -8.056 0.787 1.00 30.45 O ATOM 285 CB ASN A 18 21.544 -6.702 0.464 1.00 23.41 C ATOM 286 CG ASN A 18 21.647 -7.123 -0.994 1.00 11.34 C ATOM 287 OD1 ASN A 18 22.731 -7.348 -1.518 1.00 45.51 O ATOM 288 ND2 ASN A 18 20.520 -7.221 -1.663 1.00 74.02 N ATOM 0 H ASN A 18 22.749 -5.010 -0.924 1.00 11.04 H new ATOM 0 HA ASN A 18 22.525 -5.436 1.887 1.00 34.31 H new ATOM 0 HB2 ASN A 18 21.391 -7.587 1.082 1.00 23.41 H new ATOM 0 HB3 ASN A 18 20.666 -6.069 0.592 1.00 23.41 H new ATOM 0 HD21 ASN A 18 20.533 -7.491 -2.647 1.00 74.02 H new ATOM 0 HD22 ASN A 18 19.633 -7.027 -1.199 1.00 74.02 H new ATOM 295 N GLN A 19 24.856 -6.467 2.119 1.00 64.04 N ATOM 296 CA GLN A 19 26.056 -7.235 2.471 1.00 2.21 C ATOM 297 C GLN A 19 25.823 -8.126 3.700 1.00 72.34 C ATOM 298 O GLN A 19 24.875 -7.925 4.461 1.00 22.24 O ATOM 299 CB GLN A 19 27.228 -6.278 2.741 1.00 72.44 C ATOM 300 CG GLN A 19 27.581 -5.367 1.564 1.00 1.30 C ATOM 301 CD GLN A 19 28.209 -6.105 0.386 1.00 33.21 C ATOM 302 OE1 GLN A 19 27.940 -7.277 0.140 1.00 75.11 O ATOM 303 NE2 GLN A 19 29.055 -5.420 -0.354 1.00 30.44 N ATOM 0 H GLN A 19 24.799 -5.556 2.574 1.00 64.04 H new ATOM 0 HA GLN A 19 26.293 -7.883 1.628 1.00 2.21 H new ATOM 0 HB2 GLN A 19 26.985 -5.659 3.604 1.00 72.44 H new ATOM 0 HB3 GLN A 19 28.107 -6.865 3.007 1.00 72.44 H new ATOM 0 HG2 GLN A 19 26.678 -4.860 1.224 1.00 1.30 H new ATOM 0 HG3 GLN A 19 28.270 -4.595 1.907 1.00 1.30 H new ATOM 0 HE21 GLN A 19 29.260 -4.447 -0.126 1.00 30.44 H new ATOM 0 HE22 GLN A 19 29.506 -5.862 -1.155 1.00 30.44 H new ATOM 312 N GLU A 20 26.703 -9.105 3.884 1.00 2.04 N ATOM 313 CA GLU A 20 26.646 -9.996 5.045 1.00 44.43 C ATOM 314 C GLU A 20 27.252 -9.315 6.285 1.00 4.21 C ATOM 315 O GLU A 20 28.467 -9.317 6.479 1.00 1.01 O ATOM 316 CB GLU A 20 27.385 -11.309 4.735 1.00 34.41 C ATOM 317 CG GLU A 20 27.367 -12.323 5.876 1.00 54.42 C ATOM 318 CD GLU A 20 28.112 -13.602 5.528 1.00 13.41 C ATOM 319 OE1 GLU A 20 27.490 -14.523 4.959 1.00 62.21 O ATOM 320 OE2 GLU A 20 29.325 -13.689 5.810 1.00 33.43 O ATOM 0 H GLU A 20 27.470 -9.305 3.242 1.00 2.04 H new ATOM 0 HA GLU A 20 25.602 -10.222 5.261 1.00 44.43 H new ATOM 0 HB2 GLU A 20 26.937 -11.765 3.852 1.00 34.41 H new ATOM 0 HB3 GLU A 20 28.421 -11.079 4.485 1.00 34.41 H new ATOM 0 HG2 GLU A 20 27.815 -11.875 6.763 1.00 54.42 H new ATOM 0 HG3 GLU A 20 26.334 -12.564 6.127 1.00 54.42 H new ATOM 327 N MET A 21 26.398 -8.697 7.097 1.00 64.41 N ATOM 328 CA MET A 21 26.838 -8.018 8.327 1.00 4.24 C ATOM 329 C MET A 21 26.559 -8.868 9.575 1.00 1.32 C ATOM 330 O MET A 21 25.806 -9.842 9.522 1.00 23.42 O ATOM 331 CB MET A 21 26.134 -6.658 8.467 1.00 64.25 C ATOM 332 CG MET A 21 26.509 -5.626 7.403 1.00 34.43 C ATOM 333 SD MET A 21 28.139 -4.879 7.666 1.00 55.11 S ATOM 334 CE MET A 21 29.241 -6.119 6.983 1.00 73.01 C ATOM 0 H MET A 21 25.393 -8.649 6.930 1.00 64.41 H new ATOM 0 HA MET A 21 27.915 -7.868 8.249 1.00 4.24 H new ATOM 0 HB2 MET A 21 25.056 -6.818 8.433 1.00 64.25 H new ATOM 0 HB3 MET A 21 26.364 -6.246 9.449 1.00 64.25 H new ATOM 0 HG2 MET A 21 26.490 -6.103 6.423 1.00 34.43 H new ATOM 0 HG3 MET A 21 25.755 -4.839 7.389 1.00 34.43 H new ATOM 0 HE1 MET A 21 29.994 -5.634 6.362 1.00 73.01 H new ATOM 0 HE2 MET A 21 29.731 -6.657 7.795 1.00 73.01 H new ATOM 0 HE3 MET A 21 28.668 -6.821 6.377 1.00 73.01 H new ATOM 344 N THR A 22 27.175 -8.494 10.698 1.00 34.33 N ATOM 345 CA THR A 22 26.922 -9.164 11.985 1.00 4.34 C ATOM 346 C THR A 22 25.452 -9.036 12.401 1.00 60.04 C ATOM 347 O THR A 22 24.854 -9.973 12.938 1.00 4.22 O ATOM 348 CB THR A 22 27.807 -8.588 13.116 1.00 73.15 C ATOM 349 OG1 THR A 22 27.613 -7.166 13.216 1.00 3.45 O ATOM 350 CG2 THR A 22 29.283 -8.890 12.868 1.00 13.33 C ATOM 0 H THR A 22 27.852 -7.733 10.747 1.00 34.33 H new ATOM 0 HA THR A 22 27.170 -10.215 11.837 1.00 4.34 H new ATOM 0 HB THR A 22 27.512 -9.063 14.052 1.00 73.15 H new ATOM 0 HG1 THR A 22 28.175 -6.809 13.935 1.00 3.45 H new ATOM 0 HG21 THR A 22 29.881 -8.473 13.679 1.00 13.33 H new ATOM 0 HG22 THR A 22 29.431 -9.969 12.825 1.00 13.33 H new ATOM 0 HG23 THR A 22 29.592 -8.444 11.923 1.00 13.33 H new ATOM 358 N GLN A 23 24.884 -7.867 12.151 1.00 41.43 N ATOM 359 CA GLN A 23 23.464 -7.606 12.412 1.00 5.04 C ATOM 360 C GLN A 23 22.683 -7.487 11.096 1.00 63.34 C ATOM 361 O GLN A 23 23.235 -7.084 10.071 1.00 51.53 O ATOM 362 CB GLN A 23 23.306 -6.327 13.248 1.00 31.11 C ATOM 363 CG GLN A 23 23.910 -5.082 12.604 1.00 33.24 C ATOM 364 CD GLN A 23 23.801 -3.851 13.490 1.00 44.21 C ATOM 365 OE1 GLN A 23 22.830 -3.099 13.422 1.00 50.23 O ATOM 366 NE2 GLN A 23 24.795 -3.630 14.322 1.00 52.44 N ATOM 0 H GLN A 23 25.387 -7.069 11.762 1.00 41.43 H new ATOM 0 HA GLN A 23 23.056 -8.445 12.975 1.00 5.04 H new ATOM 0 HB2 GLN A 23 22.245 -6.152 13.427 1.00 31.11 H new ATOM 0 HB3 GLN A 23 23.772 -6.482 14.221 1.00 31.11 H new ATOM 0 HG2 GLN A 23 24.959 -5.269 12.376 1.00 33.24 H new ATOM 0 HG3 GLN A 23 23.408 -4.888 11.656 1.00 33.24 H new ATOM 0 HE21 GLN A 23 25.586 -4.273 14.354 1.00 52.44 H new ATOM 0 HE22 GLN A 23 24.775 -2.815 14.936 1.00 52.44 H new ATOM 375 N LEU A 24 21.398 -7.840 11.129 1.00 35.24 N ATOM 376 CA LEU A 24 20.566 -7.845 9.922 1.00 74.41 C ATOM 377 C LEU A 24 20.344 -6.427 9.364 1.00 44.41 C ATOM 378 O LEU A 24 20.150 -5.465 10.114 1.00 65.30 O ATOM 379 CB LEU A 24 19.211 -8.508 10.207 1.00 14.14 C ATOM 380 CG LEU A 24 18.283 -8.659 8.988 1.00 70.44 C ATOM 381 CD1 LEU A 24 18.922 -9.557 7.931 1.00 64.04 C ATOM 382 CD2 LEU A 24 16.919 -9.203 9.409 1.00 22.02 C ATOM 0 H LEU A 24 20.909 -8.126 11.977 1.00 35.24 H new ATOM 0 HA LEU A 24 21.102 -8.420 9.167 1.00 74.41 H new ATOM 0 HB2 LEU A 24 19.391 -9.496 10.631 1.00 14.14 H new ATOM 0 HB3 LEU A 24 18.692 -7.924 10.968 1.00 14.14 H new ATOM 0 HG LEU A 24 18.133 -7.672 8.550 1.00 70.44 H new ATOM 0 HD11 LEU A 24 18.250 -9.650 7.078 1.00 64.04 H new ATOM 0 HD12 LEU A 24 19.865 -9.119 7.603 1.00 64.04 H new ATOM 0 HD13 LEU A 24 19.108 -10.543 8.356 1.00 64.04 H new ATOM 0 HD21 LEU A 24 16.280 -9.301 8.532 1.00 22.02 H new ATOM 0 HD22 LEU A 24 17.045 -10.179 9.877 1.00 22.02 H new ATOM 0 HD23 LEU A 24 16.457 -8.517 10.119 1.00 22.02 H new ATOM 394 N ASN A 25 20.362 -6.319 8.038 1.00 34.24 N ATOM 395 CA ASN A 25 20.119 -5.047 7.349 1.00 30.21 C ATOM 396 C ASN A 25 18.720 -4.502 7.681 1.00 73.22 C ATOM 397 O ASN A 25 17.720 -5.207 7.529 1.00 63.03 O ATOM 398 CB ASN A 25 20.262 -5.240 5.835 1.00 13.13 C ATOM 399 CG ASN A 25 21.624 -5.790 5.453 1.00 3.32 C ATOM 400 OD1 ASN A 25 22.627 -5.488 6.084 1.00 21.31 O ATOM 401 ND2 ASN A 25 21.670 -6.619 4.429 1.00 10.12 N ATOM 0 H ASN A 25 20.544 -7.103 7.411 1.00 34.24 H new ATOM 0 HA ASN A 25 20.858 -4.322 7.692 1.00 30.21 H new ATOM 0 HB2 ASN A 25 19.486 -5.919 5.482 1.00 13.13 H new ATOM 0 HB3 ASN A 25 20.103 -4.286 5.332 1.00 13.13 H new ATOM 0 HD21 ASN A 25 22.560 -7.028 4.143 1.00 10.12 H new ATOM 0 HD22 ASN A 25 20.816 -6.852 3.922 1.00 10.12 H new ATOM 408 N GLN A 26 18.652 -3.243 8.116 1.00 4.22 N ATOM 409 CA GLN A 26 17.384 -2.639 8.549 1.00 13.14 C ATOM 410 C GLN A 26 16.351 -2.614 7.411 1.00 15.10 C ATOM 411 O GLN A 26 15.146 -2.704 7.654 1.00 32.24 O ATOM 412 CB GLN A 26 17.624 -1.228 9.105 1.00 23.51 C ATOM 413 CG GLN A 26 18.596 -1.197 10.282 1.00 34.22 C ATOM 414 CD GLN A 26 18.161 -2.095 11.435 1.00 45.42 C ATOM 415 OE1 GLN A 26 17.435 -1.672 12.329 1.00 55.22 O ATOM 416 NE2 GLN A 26 18.601 -3.341 11.430 1.00 35.42 N ATOM 0 H GLN A 26 19.457 -2.620 8.179 1.00 4.22 H new ATOM 0 HA GLN A 26 16.973 -3.260 9.345 1.00 13.14 H new ATOM 0 HB2 GLN A 26 18.010 -0.592 8.308 1.00 23.51 H new ATOM 0 HB3 GLN A 26 16.671 -0.802 9.419 1.00 23.51 H new ATOM 0 HG2 GLN A 26 19.583 -1.507 9.939 1.00 34.22 H new ATOM 0 HG3 GLN A 26 18.690 -0.172 10.642 1.00 34.22 H new ATOM 0 HE21 GLN A 26 19.204 -3.666 10.674 1.00 35.42 H new ATOM 0 HE22 GLN A 26 18.338 -3.978 12.182 1.00 35.42 H new ATOM 425 N GLU A 27 16.831 -2.502 6.174 1.00 75.33 N ATOM 426 CA GLU A 27 15.965 -2.640 4.993 1.00 21.10 C ATOM 427 C GLU A 27 15.281 -4.019 4.988 1.00 60.44 C ATOM 428 O GLU A 27 14.067 -4.134 4.795 1.00 22.31 O ATOM 429 CB GLU A 27 16.792 -2.454 3.709 1.00 65.40 C ATOM 430 CG GLU A 27 15.988 -2.612 2.420 1.00 51.55 C ATOM 431 CD GLU A 27 16.840 -2.444 1.168 1.00 2.15 C ATOM 432 OE1 GLU A 27 17.447 -3.442 0.715 1.00 44.50 O ATOM 433 OE2 GLU A 27 16.915 -1.317 0.634 1.00 42.54 O ATOM 0 H GLU A 27 17.811 -2.317 5.958 1.00 75.33 H new ATOM 0 HA GLU A 27 15.194 -1.870 5.032 1.00 21.10 H new ATOM 0 HB2 GLU A 27 17.245 -1.463 3.722 1.00 65.40 H new ATOM 0 HB3 GLU A 27 17.607 -3.178 3.707 1.00 65.40 H new ATOM 0 HG2 GLU A 27 15.521 -3.597 2.407 1.00 51.55 H new ATOM 0 HG3 GLU A 27 15.183 -1.877 2.407 1.00 51.55 H new ATOM 440 N THR A 28 16.075 -5.062 5.230 1.00 20.42 N ATOM 441 CA THR A 28 15.567 -6.438 5.292 1.00 72.53 C ATOM 442 C THR A 28 14.624 -6.625 6.492 1.00 35.24 C ATOM 443 O THR A 28 13.689 -7.430 6.447 1.00 61.13 O ATOM 444 CB THR A 28 16.729 -7.463 5.387 1.00 51.21 C ATOM 445 OG1 THR A 28 17.698 -7.207 4.356 1.00 23.43 O ATOM 446 CG2 THR A 28 16.215 -8.897 5.256 1.00 62.34 C ATOM 0 H THR A 28 17.080 -4.982 5.388 1.00 20.42 H new ATOM 0 HA THR A 28 15.012 -6.617 4.371 1.00 72.53 H new ATOM 0 HB THR A 28 17.195 -7.350 6.366 1.00 51.21 H new ATOM 0 HG1 THR A 28 18.428 -7.857 4.425 1.00 23.43 H new ATOM 0 HG21 THR A 28 17.052 -9.591 5.326 1.00 62.34 H new ATOM 0 HG22 THR A 28 15.504 -9.103 6.056 1.00 62.34 H new ATOM 0 HG23 THR A 28 15.722 -9.020 4.292 1.00 62.34 H new ATOM 454 N VAL A 29 14.879 -5.878 7.568 1.00 63.52 N ATOM 455 CA VAL A 29 13.997 -5.883 8.740 1.00 65.01 C ATOM 456 C VAL A 29 12.605 -5.337 8.381 1.00 32.02 C ATOM 457 O VAL A 29 11.585 -5.918 8.756 1.00 34.23 O ATOM 458 CB VAL A 29 14.593 -5.053 9.910 1.00 32.51 C ATOM 459 CG1 VAL A 29 13.646 -5.038 11.111 1.00 61.05 C ATOM 460 CG2 VAL A 29 15.964 -5.597 10.312 1.00 12.24 C ATOM 0 H VAL A 29 15.688 -5.262 7.653 1.00 63.52 H new ATOM 0 HA VAL A 29 13.904 -6.920 9.064 1.00 65.01 H new ATOM 0 HB VAL A 29 14.717 -4.026 9.566 1.00 32.51 H new ATOM 0 HG11 VAL A 29 14.088 -4.450 11.915 1.00 61.05 H new ATOM 0 HG12 VAL A 29 12.694 -4.595 10.818 1.00 61.05 H new ATOM 0 HG13 VAL A 29 13.480 -6.058 11.456 1.00 61.05 H new ATOM 0 HG21 VAL A 29 16.365 -5.002 11.133 1.00 12.24 H new ATOM 0 HG22 VAL A 29 15.865 -6.635 10.630 1.00 12.24 H new ATOM 0 HG23 VAL A 29 16.641 -5.542 9.460 1.00 12.24 H new ATOM 470 N LYS A 30 12.577 -4.223 7.641 1.00 60.32 N ATOM 471 CA LYS A 30 11.319 -3.650 7.142 1.00 13.54 C ATOM 472 C LYS A 30 10.543 -4.683 6.310 1.00 33.22 C ATOM 473 O LYS A 30 9.343 -4.887 6.505 1.00 23.41 O ATOM 474 CB LYS A 30 11.598 -2.406 6.286 1.00 53.35 C ATOM 475 CG LYS A 30 12.207 -1.232 7.051 1.00 42.11 C ATOM 476 CD LYS A 30 11.219 -0.622 8.042 1.00 1.35 C ATOM 477 CE LYS A 30 11.803 0.603 8.742 1.00 51.22 C ATOM 478 NZ LYS A 30 10.836 1.222 9.686 1.00 74.44 N ATOM 0 H LYS A 30 13.410 -3.699 7.374 1.00 60.32 H new ATOM 0 HA LYS A 30 10.715 -3.364 8.003 1.00 13.54 H new ATOM 0 HB2 LYS A 30 12.271 -2.683 5.475 1.00 53.35 H new ATOM 0 HB3 LYS A 30 10.664 -2.079 5.828 1.00 53.35 H new ATOM 0 HG2 LYS A 30 13.095 -1.569 7.585 1.00 42.11 H new ATOM 0 HG3 LYS A 30 12.531 -0.468 6.345 1.00 42.11 H new ATOM 0 HD2 LYS A 30 10.305 -0.341 7.518 1.00 1.35 H new ATOM 0 HD3 LYS A 30 10.942 -1.369 8.786 1.00 1.35 H new ATOM 0 HE2 LYS A 30 12.704 0.315 9.284 1.00 51.22 H new ATOM 0 HE3 LYS A 30 12.101 1.339 7.995 1.00 51.22 H new ATOM 0 HZ1 LYS A 30 11.274 2.050 10.139 1.00 74.44 H new ATOM 0 HZ2 LYS A 30 9.986 1.521 9.166 1.00 74.44 H new ATOM 0 HZ3 LYS A 30 10.570 0.529 10.415 1.00 74.44 H new ATOM 492 N ILE A 31 11.247 -5.330 5.381 1.00 12.14 N ATOM 493 CA ILE A 31 10.660 -6.383 4.546 1.00 0.21 C ATOM 494 C ILE A 31 10.042 -7.503 5.405 1.00 72.31 C ATOM 495 O ILE A 31 8.884 -7.881 5.219 1.00 72.33 O ATOM 496 CB ILE A 31 11.723 -6.992 3.598 1.00 1.30 C ATOM 497 CG1 ILE A 31 12.268 -5.910 2.646 1.00 54.22 C ATOM 498 CG2 ILE A 31 11.142 -8.169 2.814 1.00 52.43 C ATOM 499 CD1 ILE A 31 13.381 -6.392 1.735 1.00 64.32 C ATOM 0 H ILE A 31 12.231 -5.143 5.186 1.00 12.14 H new ATOM 0 HA ILE A 31 9.871 -5.920 3.953 1.00 0.21 H new ATOM 0 HB ILE A 31 12.550 -7.370 4.200 1.00 1.30 H new ATOM 0 HG12 ILE A 31 11.449 -5.534 2.033 1.00 54.22 H new ATOM 0 HG13 ILE A 31 12.635 -5.071 3.238 1.00 54.22 H new ATOM 0 HG21 ILE A 31 11.907 -8.580 2.155 1.00 52.43 H new ATOM 0 HG22 ILE A 31 10.809 -8.940 3.509 1.00 52.43 H new ATOM 0 HG23 ILE A 31 10.296 -7.827 2.218 1.00 52.43 H new ATOM 0 HD11 ILE A 31 13.710 -5.572 1.097 1.00 64.32 H new ATOM 0 HD12 ILE A 31 14.219 -6.741 2.338 1.00 64.32 H new ATOM 0 HD13 ILE A 31 13.015 -7.210 1.115 1.00 64.32 H new ATOM 511 N THR A 32 10.823 -8.019 6.351 1.00 20.23 N ATOM 512 CA THR A 32 10.357 -9.080 7.256 1.00 24.40 C ATOM 513 C THR A 32 9.115 -8.641 8.049 1.00 63.44 C ATOM 514 O THR A 32 8.149 -9.393 8.179 1.00 0.43 O ATOM 515 CB THR A 32 11.469 -9.505 8.249 1.00 21.13 C ATOM 516 OG1 THR A 32 12.640 -9.922 7.528 1.00 14.43 O ATOM 517 CG2 THR A 32 11.006 -10.645 9.156 1.00 3.11 C ATOM 0 H THR A 32 11.785 -7.722 6.515 1.00 20.23 H new ATOM 0 HA THR A 32 10.094 -9.931 6.628 1.00 24.40 H new ATOM 0 HB THR A 32 11.702 -8.641 8.872 1.00 21.13 H new ATOM 0 HG1 THR A 32 13.069 -9.141 7.120 1.00 14.43 H new ATOM 0 HG21 THR A 32 11.811 -10.917 9.839 1.00 3.11 H new ATOM 0 HG22 THR A 32 10.137 -10.323 9.730 1.00 3.11 H new ATOM 0 HG23 THR A 32 10.740 -11.509 8.547 1.00 3.11 H new ATOM 525 N GLN A 33 9.148 -7.415 8.574 1.00 52.02 N ATOM 526 CA GLN A 33 8.010 -6.846 9.309 1.00 74.55 C ATOM 527 C GLN A 33 6.759 -6.760 8.418 1.00 31.52 C ATOM 528 O GLN A 33 5.655 -7.108 8.845 1.00 4.40 O ATOM 529 CB GLN A 33 8.370 -5.451 9.847 1.00 1.13 C ATOM 530 CG GLN A 33 7.220 -4.743 10.559 1.00 14.52 C ATOM 531 CD GLN A 33 7.614 -3.385 11.125 1.00 42.31 C ATOM 532 OE1 GLN A 33 8.497 -2.709 10.608 1.00 45.11 O ATOM 533 NE2 GLN A 33 6.956 -2.974 12.191 1.00 72.44 N ATOM 0 H GLN A 33 9.953 -6.792 8.505 1.00 52.02 H new ATOM 0 HA GLN A 33 7.786 -7.507 10.146 1.00 74.55 H new ATOM 0 HB2 GLN A 33 9.208 -5.545 10.537 1.00 1.13 H new ATOM 0 HB3 GLN A 33 8.708 -4.829 9.018 1.00 1.13 H new ATOM 0 HG2 GLN A 33 6.393 -4.613 9.861 1.00 14.52 H new ATOM 0 HG3 GLN A 33 6.857 -5.376 11.369 1.00 14.52 H new ATOM 0 HE21 GLN A 33 6.227 -3.560 12.597 1.00 72.44 H new ATOM 0 HE22 GLN A 33 7.176 -2.070 12.609 1.00 72.44 H new ATOM 542 N GLN A 34 6.944 -6.302 7.177 1.00 22.34 N ATOM 543 CA GLN A 34 5.840 -6.180 6.217 1.00 60.51 C ATOM 544 C GLN A 34 5.128 -7.523 6.007 1.00 2.31 C ATOM 545 O GLN A 34 3.904 -7.607 6.110 1.00 42.50 O ATOM 546 CB GLN A 34 6.359 -5.653 4.872 1.00 42.12 C ATOM 547 CG GLN A 34 5.264 -5.445 3.825 1.00 32.22 C ATOM 548 CD GLN A 34 5.799 -4.903 2.510 1.00 1.13 C ATOM 549 OE1 GLN A 34 5.899 -3.696 2.319 1.00 52.44 O ATOM 550 NE2 GLN A 34 6.131 -5.784 1.588 1.00 5.14 N ATOM 0 H GLN A 34 7.850 -6.008 6.811 1.00 22.34 H new ATOM 0 HA GLN A 34 5.120 -5.473 6.630 1.00 60.51 H new ATOM 0 HB2 GLN A 34 6.874 -4.707 5.038 1.00 42.12 H new ATOM 0 HB3 GLN A 34 7.096 -6.353 4.479 1.00 42.12 H new ATOM 0 HG2 GLN A 34 4.758 -6.393 3.643 1.00 32.22 H new ATOM 0 HG3 GLN A 34 4.517 -4.756 4.219 1.00 32.22 H new ATOM 0 HE21 GLN A 34 6.036 -6.782 1.778 1.00 5.14 H new ATOM 0 HE22 GLN A 34 6.483 -5.468 0.684 1.00 5.14 H new ATOM 559 N ASN A 35 5.904 -8.570 5.721 1.00 51.02 N ATOM 560 CA ASN A 35 5.347 -9.909 5.489 1.00 23.32 C ATOM 561 C ASN A 35 4.537 -10.407 6.700 1.00 24.42 C ATOM 562 O ASN A 35 3.445 -10.957 6.547 1.00 71.31 O ATOM 563 CB ASN A 35 6.468 -10.906 5.174 1.00 24.21 C ATOM 564 CG ASN A 35 7.329 -10.471 4.002 1.00 11.52 C ATOM 565 OD1 ASN A 35 6.885 -9.753 3.114 1.00 25.24 O ATOM 566 ND2 ASN A 35 8.567 -10.919 3.984 1.00 60.44 N ATOM 0 H ASN A 35 6.920 -8.519 5.644 1.00 51.02 H new ATOM 0 HA ASN A 35 4.672 -9.837 4.636 1.00 23.32 H new ATOM 0 HB2 ASN A 35 7.097 -11.029 6.056 1.00 24.21 H new ATOM 0 HB3 ASN A 35 6.031 -11.880 4.956 1.00 24.21 H new ATOM 0 HD21 ASN A 35 9.188 -10.670 3.214 1.00 60.44 H new ATOM 0 HD22 ASN A 35 8.905 -11.515 4.740 1.00 60.44 H new ATOM 573 N ARG A 36 5.077 -10.205 7.903 1.00 43.02 N ATOM 574 CA ARG A 36 4.400 -10.633 9.136 1.00 61.24 C ATOM 575 C ARG A 36 3.069 -9.889 9.341 1.00 34.32 C ATOM 576 O ARG A 36 2.039 -10.506 9.620 1.00 65.42 O ATOM 577 CB ARG A 36 5.309 -10.430 10.354 1.00 4.52 C ATOM 578 CG ARG A 36 6.591 -11.253 10.302 1.00 1.44 C ATOM 579 CD ARG A 36 7.395 -11.133 11.592 1.00 50.20 C ATOM 580 NE ARG A 36 6.678 -11.691 12.740 1.00 4.53 N ATOM 581 CZ ARG A 36 7.061 -11.551 13.982 1.00 3.31 C ATOM 582 NH1 ARG A 36 8.111 -10.857 14.276 1.00 54.40 N ATOM 583 NH2 ARG A 36 6.379 -12.094 14.936 1.00 65.44 N ATOM 0 H ARG A 36 5.977 -9.750 8.053 1.00 43.02 H new ATOM 0 HA ARG A 36 4.180 -11.695 9.032 1.00 61.24 H new ATOM 0 HB2 ARG A 36 5.568 -9.374 10.432 1.00 4.52 H new ATOM 0 HB3 ARG A 36 4.756 -10.690 11.257 1.00 4.52 H new ATOM 0 HG2 ARG A 36 6.344 -12.300 10.124 1.00 1.44 H new ATOM 0 HG3 ARG A 36 7.201 -10.922 9.462 1.00 1.44 H new ATOM 0 HD2 ARG A 36 8.348 -11.649 11.474 1.00 50.20 H new ATOM 0 HD3 ARG A 36 7.622 -10.084 11.781 1.00 50.20 H new ATOM 0 HE ARG A 36 5.826 -12.222 12.559 1.00 4.53 H new ATOM 0 HH11 ARG A 36 8.651 -10.411 13.535 1.00 54.40 H new ATOM 0 HH12 ARG A 36 8.399 -10.755 15.249 1.00 54.40 H new ATOM 0 HH21 ARG A 36 5.540 -12.633 14.720 1.00 65.44 H new ATOM 0 HH22 ARG A 36 6.679 -11.984 15.904 1.00 65.44 H new ATOM 597 N LEU A 37 3.097 -8.562 9.200 1.00 14.22 N ATOM 598 CA LEU A 37 1.875 -7.752 9.290 1.00 15.25 C ATOM 599 C LEU A 37 0.898 -8.122 8.162 1.00 75.52 C ATOM 600 O LEU A 37 -0.324 -8.100 8.338 1.00 74.41 O ATOM 601 CB LEU A 37 2.219 -6.255 9.221 1.00 20.43 C ATOM 602 CG LEU A 37 3.139 -5.736 10.340 1.00 3.43 C ATOM 603 CD1 LEU A 37 3.416 -4.244 10.164 1.00 34.25 C ATOM 604 CD2 LEU A 37 2.532 -6.012 11.714 1.00 2.22 C ATOM 0 H LEU A 37 3.946 -8.026 9.024 1.00 14.22 H new ATOM 0 HA LEU A 37 1.396 -7.959 10.247 1.00 15.25 H new ATOM 0 HB2 LEU A 37 2.694 -6.053 8.261 1.00 20.43 H new ATOM 0 HB3 LEU A 37 1.290 -5.685 9.244 1.00 20.43 H new ATOM 0 HG LEU A 37 4.087 -6.270 10.273 1.00 3.43 H new ATOM 0 HD11 LEU A 37 4.068 -3.898 10.966 1.00 34.25 H new ATOM 0 HD12 LEU A 37 3.901 -4.075 9.203 1.00 34.25 H new ATOM 0 HD13 LEU A 37 2.476 -3.693 10.198 1.00 34.25 H new ATOM 0 HD21 LEU A 37 3.200 -5.636 12.489 1.00 2.22 H new ATOM 0 HD22 LEU A 37 1.567 -5.511 11.793 1.00 2.22 H new ATOM 0 HD23 LEU A 37 2.395 -7.086 11.842 1.00 2.22 H new ATOM 616 N ASN A 38 1.454 -8.475 7.006 1.00 31.31 N ATOM 617 CA ASN A 38 0.659 -8.896 5.848 1.00 20.02 C ATOM 618 C ASN A 38 -0.110 -10.191 6.164 1.00 0.21 C ATOM 619 O ASN A 38 -1.281 -10.336 5.814 1.00 63.23 O ATOM 620 CB ASN A 38 1.583 -9.105 4.639 1.00 50.31 C ATOM 621 CG ASN A 38 0.846 -9.040 3.314 1.00 24.14 C ATOM 622 OD1 ASN A 38 0.798 -7.862 2.723 1.00 64.43 O flip ATOM 623 ND2 ASN A 38 0.339 -10.035 2.813 1.00 71.02 N flip ATOM 0 H ASN A 38 2.461 -8.479 6.842 1.00 31.31 H new ATOM 0 HA ASN A 38 -0.067 -8.118 5.614 1.00 20.02 H new ATOM 0 HB2 ASN A 38 2.366 -8.347 4.651 1.00 50.31 H new ATOM 0 HB3 ASN A 38 2.076 -10.073 4.728 1.00 50.31 H new ATOM 0 HD21 ASN A 38 0.393 -10.932 3.295 1.00 71.02 H new ATOM 0 HD22 ASN A 38 -0.137 -9.967 1.914 1.00 71.02 H new ATOM 630 N ALA A 39 0.563 -11.121 6.846 1.00 35.51 N ATOM 631 CA ALA A 39 -0.055 -12.381 7.276 1.00 52.05 C ATOM 632 C ALA A 39 -1.044 -12.162 8.438 1.00 61.10 C ATOM 633 O ALA A 39 -2.031 -12.889 8.573 1.00 61.22 O ATOM 634 CB ALA A 39 1.026 -13.379 7.679 1.00 65.14 C ATOM 0 H ALA A 39 1.542 -11.025 7.114 1.00 35.51 H new ATOM 0 HA ALA A 39 -0.621 -12.782 6.435 1.00 52.05 H new ATOM 0 HB1 ALA A 39 0.560 -14.312 7.997 1.00 65.14 H new ATOM 0 HB2 ALA A 39 1.679 -13.571 6.828 1.00 65.14 H new ATOM 0 HB3 ALA A 39 1.613 -12.968 8.501 1.00 65.14 H new ATOM 640 N LYS A 40 -0.764 -11.166 9.282 1.00 42.53 N ATOM 641 CA LYS A 40 -1.659 -10.808 10.397 1.00 33.01 C ATOM 642 C LYS A 40 -2.818 -9.901 9.934 1.00 34.30 C ATOM 643 O LYS A 40 -3.740 -9.616 10.705 1.00 51.12 O ATOM 644 CB LYS A 40 -0.870 -10.099 11.509 1.00 30.54 C ATOM 645 CG LYS A 40 0.146 -10.985 12.229 1.00 33.00 C ATOM 646 CD LYS A 40 0.990 -10.179 13.217 1.00 3.33 C ATOM 647 CE LYS A 40 1.928 -11.064 14.037 1.00 42.23 C ATOM 648 NZ LYS A 40 1.188 -11.939 14.986 1.00 23.33 N ATOM 0 H LYS A 40 0.075 -10.590 9.218 1.00 42.53 H new ATOM 0 HA LYS A 40 -2.084 -11.736 10.780 1.00 33.01 H new ATOM 0 HB2 LYS A 40 -0.347 -9.245 11.078 1.00 30.54 H new ATOM 0 HB3 LYS A 40 -1.574 -9.705 12.242 1.00 30.54 H new ATOM 0 HG2 LYS A 40 -0.376 -11.782 12.759 1.00 33.00 H new ATOM 0 HG3 LYS A 40 0.797 -11.463 11.497 1.00 33.00 H new ATOM 0 HD2 LYS A 40 1.576 -9.440 12.671 1.00 3.33 H new ATOM 0 HD3 LYS A 40 0.332 -9.630 13.890 1.00 3.33 H new ATOM 0 HE2 LYS A 40 2.523 -11.682 13.364 1.00 42.23 H new ATOM 0 HE3 LYS A 40 2.625 -10.436 14.592 1.00 42.23 H new ATOM 0 HZ1 LYS A 40 1.864 -12.420 15.613 1.00 23.33 H new ATOM 0 HZ2 LYS A 40 0.538 -11.361 15.556 1.00 23.33 H new ATOM 0 HZ3 LYS A 40 0.645 -12.648 14.453 1.00 23.33 H new ATOM 662 N SER A 41 -2.760 -9.446 8.683 1.00 54.24 N ATOM 663 CA SER A 41 -3.781 -8.546 8.121 1.00 23.31 C ATOM 664 C SER A 41 -5.203 -9.128 8.219 1.00 71.31 C ATOM 665 O SER A 41 -5.511 -10.168 7.632 1.00 64.24 O ATOM 666 CB SER A 41 -3.467 -8.231 6.656 1.00 61.23 C ATOM 667 OG SER A 41 -4.420 -7.332 6.111 1.00 33.21 O ATOM 0 H SER A 41 -2.013 -9.685 8.031 1.00 54.24 H new ATOM 0 HA SER A 41 -3.752 -7.634 8.717 1.00 23.31 H new ATOM 0 HB2 SER A 41 -2.469 -7.799 6.580 1.00 61.23 H new ATOM 0 HB3 SER A 41 -3.460 -9.154 6.076 1.00 61.23 H new ATOM 0 HG SER A 41 -4.686 -7.639 5.219 1.00 33.21 H new ATOM 673 N SER A 42 -6.067 -8.440 8.962 1.00 13.15 N ATOM 674 CA SER A 42 -7.469 -8.855 9.120 1.00 33.31 C ATOM 675 C SER A 42 -8.275 -8.641 7.826 1.00 12.10 C ATOM 676 O SER A 42 -9.149 -9.439 7.486 1.00 51.24 O ATOM 677 CB SER A 42 -8.118 -8.074 10.269 1.00 31.35 C ATOM 678 OG SER A 42 -9.481 -8.428 10.439 1.00 1.02 O ATOM 0 H SER A 42 -5.824 -7.588 9.468 1.00 13.15 H new ATOM 0 HA SER A 42 -7.476 -9.921 9.348 1.00 33.31 H new ATOM 0 HB2 SER A 42 -7.574 -8.267 11.193 1.00 31.35 H new ATOM 0 HB3 SER A 42 -8.041 -7.005 10.071 1.00 31.35 H new ATOM 0 HG SER A 42 -9.863 -7.913 11.180 1.00 1.02 H new ATOM 684 N SER A 43 -7.979 -7.556 7.111 1.00 73.12 N ATOM 685 CA SER A 43 -8.657 -7.245 5.841 1.00 71.51 C ATOM 686 C SER A 43 -7.739 -6.429 4.921 1.00 24.52 C ATOM 687 O SER A 43 -7.279 -5.346 5.290 1.00 31.11 O ATOM 688 CB SER A 43 -9.965 -6.472 6.092 1.00 71.51 C ATOM 689 OG SER A 43 -10.878 -7.234 6.876 1.00 72.53 O ATOM 0 H SER A 43 -7.273 -6.873 7.386 1.00 73.12 H new ATOM 0 HA SER A 43 -8.897 -8.189 5.352 1.00 71.51 H new ATOM 0 HB2 SER A 43 -9.743 -5.533 6.600 1.00 71.51 H new ATOM 0 HB3 SER A 43 -10.427 -6.217 5.138 1.00 71.51 H new ATOM 0 HG SER A 43 -11.697 -6.716 7.019 1.00 72.53 H new ATOM 695 N GLY A 44 -7.471 -6.958 3.728 1.00 2.23 N ATOM 696 CA GLY A 44 -6.561 -6.301 2.797 1.00 3.25 C ATOM 697 C GLY A 44 -5.119 -6.779 2.952 1.00 42.10 C ATOM 698 O GLY A 44 -4.881 -7.907 3.385 1.00 33.11 O ATOM 0 H GLY A 44 -7.869 -7.833 3.387 1.00 2.23 H new ATOM 0 HA2 GLY A 44 -6.894 -6.487 1.776 1.00 3.25 H new ATOM 0 HA3 GLY A 44 -6.602 -5.223 2.954 1.00 3.25 H new ATOM 702 N VAL A 45 -4.155 -5.932 2.589 1.00 15.42 N ATOM 703 CA VAL A 45 -2.729 -6.270 2.734 1.00 45.32 C ATOM 704 C VAL A 45 -1.916 -5.096 3.303 1.00 41.51 C ATOM 705 O VAL A 45 -2.238 -3.930 3.073 1.00 11.23 O ATOM 706 CB VAL A 45 -2.098 -6.711 1.387 1.00 31.31 C ATOM 707 CG1 VAL A 45 -2.664 -8.055 0.935 1.00 11.52 C ATOM 708 CG2 VAL A 45 -2.307 -5.644 0.311 1.00 72.40 C ATOM 0 H VAL A 45 -4.330 -5.008 2.193 1.00 15.42 H new ATOM 0 HA VAL A 45 -2.691 -7.104 3.435 1.00 45.32 H new ATOM 0 HB VAL A 45 -1.026 -6.830 1.541 1.00 31.31 H new ATOM 0 HG11 VAL A 45 -2.206 -8.343 -0.011 1.00 11.52 H new ATOM 0 HG12 VAL A 45 -2.447 -8.813 1.688 1.00 11.52 H new ATOM 0 HG13 VAL A 45 -3.743 -7.970 0.805 1.00 11.52 H new ATOM 0 HG21 VAL A 45 -1.856 -5.977 -0.624 1.00 72.40 H new ATOM 0 HG22 VAL A 45 -3.375 -5.482 0.161 1.00 72.40 H new ATOM 0 HG23 VAL A 45 -1.840 -4.711 0.628 1.00 72.40 H new ATOM 718 N TYR A 46 -0.863 -5.416 4.052 1.00 31.14 N ATOM 719 CA TYR A 46 0.031 -4.399 4.623 1.00 34.23 C ATOM 720 C TYR A 46 1.271 -4.164 3.748 1.00 10.11 C ATOM 721 O TYR A 46 1.950 -5.111 3.350 1.00 54.32 O ATOM 722 CB TYR A 46 0.481 -4.806 6.035 1.00 15.13 C ATOM 723 CG TYR A 46 -0.536 -4.510 7.121 1.00 33.41 C ATOM 724 CD1 TYR A 46 -1.697 -5.261 7.243 1.00 3.45 C ATOM 725 CD2 TYR A 46 -0.328 -3.473 8.031 1.00 3.20 C ATOM 726 CE1 TYR A 46 -2.624 -4.987 8.229 1.00 35.24 C ATOM 727 CE2 TYR A 46 -1.251 -3.193 9.018 1.00 52.31 C ATOM 728 CZ TYR A 46 -2.393 -3.956 9.116 1.00 54.01 C ATOM 729 OH TYR A 46 -3.317 -3.678 10.093 1.00 72.01 O ATOM 0 H TYR A 46 -0.603 -6.375 4.281 1.00 31.14 H new ATOM 0 HA TYR A 46 -0.537 -3.470 4.669 1.00 34.23 H new ATOM 0 HB2 TYR A 46 0.701 -5.873 6.040 1.00 15.13 H new ATOM 0 HB3 TYR A 46 1.410 -4.287 6.272 1.00 15.13 H new ATOM 0 HD1 TYR A 46 -1.878 -6.073 6.555 1.00 3.45 H new ATOM 0 HD2 TYR A 46 0.571 -2.879 7.962 1.00 3.20 H new ATOM 0 HE1 TYR A 46 -3.525 -5.577 8.305 1.00 35.24 H new ATOM 0 HE2 TYR A 46 -1.079 -2.381 9.709 1.00 52.31 H new ATOM 0 HH TYR A 46 -3.243 -2.737 10.355 1.00 72.01 H new ATOM 739 N LEU A 47 1.545 -2.895 3.459 1.00 34.53 N ATOM 740 CA LEU A 47 2.777 -2.474 2.782 1.00 50.14 C ATOM 741 C LEU A 47 3.499 -1.409 3.625 1.00 40.53 C ATOM 742 O LEU A 47 2.855 -0.584 4.274 1.00 74.42 O ATOM 743 CB LEU A 47 2.452 -1.915 1.388 1.00 33.35 C ATOM 744 CG LEU A 47 1.861 -2.929 0.392 1.00 72.42 C ATOM 745 CD1 LEU A 47 1.427 -2.235 -0.896 1.00 24.42 C ATOM 746 CD2 LEU A 47 2.865 -4.041 0.088 1.00 61.41 C ATOM 0 H LEU A 47 0.919 -2.123 3.687 1.00 34.53 H new ATOM 0 HA LEU A 47 3.431 -3.339 2.667 1.00 50.14 H new ATOM 0 HB2 LEU A 47 1.749 -1.090 1.501 1.00 33.35 H new ATOM 0 HB3 LEU A 47 3.364 -1.500 0.960 1.00 33.35 H new ATOM 0 HG LEU A 47 0.981 -3.378 0.853 1.00 72.42 H new ATOM 0 HD11 LEU A 47 1.013 -2.972 -1.584 1.00 24.42 H new ATOM 0 HD12 LEU A 47 0.670 -1.485 -0.668 1.00 24.42 H new ATOM 0 HD13 LEU A 47 2.288 -1.752 -1.357 1.00 24.42 H new ATOM 0 HD21 LEU A 47 2.425 -4.745 -0.618 1.00 61.41 H new ATOM 0 HD22 LEU A 47 3.767 -3.608 -0.345 1.00 61.41 H new ATOM 0 HD23 LEU A 47 3.120 -4.563 1.010 1.00 61.41 H new ATOM 758 N LEU A 48 4.829 -1.435 3.633 1.00 1.32 N ATOM 759 CA LEU A 48 5.614 -0.483 4.432 1.00 44.11 C ATOM 760 C LEU A 48 6.435 0.468 3.541 1.00 31.13 C ATOM 761 O LEU A 48 7.074 0.039 2.583 1.00 42.41 O ATOM 762 CB LEU A 48 6.551 -1.232 5.393 1.00 63.33 C ATOM 763 CG LEU A 48 5.863 -2.147 6.424 1.00 60.21 C ATOM 764 CD1 LEU A 48 6.900 -2.768 7.359 1.00 61.22 C ATOM 765 CD2 LEU A 48 4.809 -1.377 7.219 1.00 1.53 C ATOM 0 H LEU A 48 5.389 -2.100 3.099 1.00 1.32 H new ATOM 0 HA LEU A 48 4.909 0.117 5.008 1.00 44.11 H new ATOM 0 HB2 LEU A 48 7.239 -1.836 4.802 1.00 63.33 H new ATOM 0 HB3 LEU A 48 7.151 -0.498 5.930 1.00 63.33 H new ATOM 0 HG LEU A 48 5.357 -2.949 5.887 1.00 60.21 H new ATOM 0 HD11 LEU A 48 6.399 -3.412 8.082 1.00 61.22 H new ATOM 0 HD12 LEU A 48 7.608 -3.358 6.777 1.00 61.22 H new ATOM 0 HD13 LEU A 48 7.434 -1.978 7.886 1.00 61.22 H new ATOM 0 HD21 LEU A 48 4.338 -2.045 7.940 1.00 1.53 H new ATOM 0 HD22 LEU A 48 5.284 -0.550 7.747 1.00 1.53 H new ATOM 0 HD23 LEU A 48 4.053 -0.987 6.538 1.00 1.53 H new ATOM 777 N PRO A 49 6.452 1.777 3.870 1.00 34.32 N ATOM 778 CA PRO A 49 7.198 2.793 3.092 1.00 61.10 C ATOM 779 C PRO A 49 8.717 2.542 3.056 1.00 75.15 C ATOM 780 O PRO A 49 9.439 3.151 2.263 1.00 43.41 O ATOM 781 CB PRO A 49 6.892 4.110 3.827 1.00 3.04 C ATOM 782 CG PRO A 49 5.664 3.830 4.628 1.00 61.13 C ATOM 783 CD PRO A 49 5.743 2.380 5.012 1.00 35.41 C ATOM 0 HA PRO A 49 6.895 2.786 2.045 1.00 61.10 H new ATOM 0 HB2 PRO A 49 7.722 4.406 4.468 1.00 3.04 H new ATOM 0 HB3 PRO A 49 6.726 4.925 3.123 1.00 3.04 H new ATOM 0 HG2 PRO A 49 5.621 4.466 5.512 1.00 61.13 H new ATOM 0 HG3 PRO A 49 4.764 4.031 4.047 1.00 61.13 H new ATOM 0 HD2 PRO A 49 6.287 2.238 5.946 1.00 35.41 H new ATOM 0 HD3 PRO A 49 4.754 1.944 5.150 1.00 35.41 H new ATOM 791 N GLY A 50 9.199 1.658 3.930 1.00 63.02 N ATOM 792 CA GLY A 50 10.619 1.321 3.960 1.00 72.54 C ATOM 793 C GLY A 50 10.905 -0.115 3.522 1.00 44.30 C ATOM 794 O GLY A 50 12.039 -0.582 3.610 1.00 14.20 O ATOM 0 H GLY A 50 8.631 1.167 4.620 1.00 63.02 H new ATOM 0 HA2 GLY A 50 11.163 2.007 3.311 1.00 72.54 H new ATOM 0 HA3 GLY A 50 11.000 1.469 4.971 1.00 72.54 H new ATOM 798 N ALA A 51 9.874 -0.818 3.052 1.00 24.43 N ATOM 799 CA ALA A 51 10.016 -2.216 2.624 1.00 2.14 C ATOM 800 C ALA A 51 9.885 -2.344 1.100 1.00 12.23 C ATOM 801 O ALA A 51 8.786 -2.295 0.552 1.00 24.10 O ATOM 802 CB ALA A 51 8.985 -3.095 3.324 1.00 71.30 C ATOM 0 H ALA A 51 8.930 -0.445 2.957 1.00 24.43 H new ATOM 0 HA ALA A 51 11.013 -2.555 2.906 1.00 2.14 H new ATOM 0 HB1 ALA A 51 9.104 -4.127 2.996 1.00 71.30 H new ATOM 0 HB2 ALA A 51 9.131 -3.038 4.403 1.00 71.30 H new ATOM 0 HB3 ALA A 51 7.982 -2.748 3.075 1.00 71.30 H new ATOM 808 N LYS A 52 11.016 -2.510 0.423 1.00 73.22 N ATOM 809 CA LYS A 52 11.040 -2.594 -1.042 1.00 51.21 C ATOM 810 C LYS A 52 10.657 -4.008 -1.527 1.00 51.33 C ATOM 811 O LYS A 52 11.439 -4.697 -2.191 1.00 4.43 O ATOM 812 CB LYS A 52 12.434 -2.183 -1.547 1.00 30.41 C ATOM 813 CG LYS A 52 12.546 -2.056 -3.063 1.00 73.11 C ATOM 814 CD LYS A 52 13.892 -1.467 -3.476 1.00 65.42 C ATOM 815 CE LYS A 52 14.088 -1.504 -4.986 1.00 35.25 C ATOM 816 NZ LYS A 52 14.162 -2.897 -5.499 1.00 53.53 N ATOM 0 H LYS A 52 11.933 -2.590 0.862 1.00 73.22 H new ATOM 0 HA LYS A 52 10.298 -1.909 -1.453 1.00 51.21 H new ATOM 0 HB2 LYS A 52 12.704 -1.229 -1.094 1.00 30.41 H new ATOM 0 HB3 LYS A 52 13.162 -2.917 -1.202 1.00 30.41 H new ATOM 0 HG2 LYS A 52 12.420 -3.037 -3.522 1.00 73.11 H new ATOM 0 HG3 LYS A 52 11.741 -1.424 -3.437 1.00 73.11 H new ATOM 0 HD2 LYS A 52 13.960 -0.437 -3.126 1.00 65.42 H new ATOM 0 HD3 LYS A 52 14.695 -2.022 -2.992 1.00 65.42 H new ATOM 0 HE2 LYS A 52 13.265 -0.981 -5.472 1.00 35.25 H new ATOM 0 HE3 LYS A 52 15.003 -0.971 -5.247 1.00 35.25 H new ATOM 0 HZ1 LYS A 52 14.559 -2.892 -6.460 1.00 53.53 H new ATOM 0 HZ2 LYS A 52 14.771 -3.465 -4.876 1.00 53.53 H new ATOM 0 HZ3 LYS A 52 13.208 -3.310 -5.521 1.00 53.53 H new ATOM 830 N THR A 53 9.439 -4.431 -1.182 1.00 33.54 N ATOM 831 CA THR A 53 8.920 -5.758 -1.559 1.00 30.12 C ATOM 832 C THR A 53 7.406 -5.734 -1.822 1.00 70.21 C ATOM 833 O THR A 53 6.675 -4.926 -1.251 1.00 44.22 O ATOM 834 CB THR A 53 9.214 -6.831 -0.473 1.00 65.50 C ATOM 835 OG1 THR A 53 9.084 -6.263 0.841 1.00 34.13 O ATOM 836 CG2 THR A 53 10.605 -7.432 -0.653 1.00 62.24 C ATOM 0 H THR A 53 8.784 -3.871 -0.637 1.00 33.54 H new ATOM 0 HA THR A 53 9.441 -6.023 -2.479 1.00 30.12 H new ATOM 0 HB THR A 53 8.483 -7.631 -0.586 1.00 65.50 H new ATOM 0 HG1 THR A 53 8.508 -6.836 1.389 1.00 34.13 H new ATOM 0 HG21 THR A 53 10.782 -8.179 0.121 1.00 62.24 H new ATOM 0 HG22 THR A 53 10.674 -7.903 -1.634 1.00 62.24 H new ATOM 0 HG23 THR A 53 11.355 -6.644 -0.575 1.00 62.24 H new ATOM 844 N PRO A 54 6.923 -6.625 -2.709 1.00 23.13 N ATOM 845 CA PRO A 54 5.492 -6.727 -3.047 1.00 3.44 C ATOM 846 C PRO A 54 4.656 -7.544 -2.040 1.00 31.32 C ATOM 847 O PRO A 54 5.192 -8.190 -1.139 1.00 72.42 O ATOM 848 CB PRO A 54 5.535 -7.440 -4.401 1.00 62.30 C ATOM 849 CG PRO A 54 6.721 -8.343 -4.300 1.00 3.45 C ATOM 850 CD PRO A 54 7.739 -7.592 -3.481 1.00 32.14 C ATOM 0 HA PRO A 54 5.010 -5.750 -3.044 1.00 3.44 H new ATOM 0 HB2 PRO A 54 4.620 -8.003 -4.584 1.00 62.30 H new ATOM 0 HB3 PRO A 54 5.643 -6.731 -5.222 1.00 62.30 H new ATOM 0 HG2 PRO A 54 6.455 -9.287 -3.824 1.00 3.45 H new ATOM 0 HG3 PRO A 54 7.114 -8.584 -5.288 1.00 3.45 H new ATOM 0 HD2 PRO A 54 8.296 -8.260 -2.824 1.00 32.14 H new ATOM 0 HD3 PRO A 54 8.468 -7.086 -4.114 1.00 32.14 H new ATOM 858 N ALA A 55 3.333 -7.497 -2.212 1.00 61.33 N ATOM 859 CA ALA A 55 2.394 -8.308 -1.428 1.00 22.23 C ATOM 860 C ALA A 55 1.222 -8.763 -2.314 1.00 72.42 C ATOM 861 O ALA A 55 0.926 -8.128 -3.328 1.00 22.13 O ATOM 862 CB ALA A 55 1.882 -7.519 -0.228 1.00 42.42 C ATOM 0 H ALA A 55 2.880 -6.895 -2.900 1.00 61.33 H new ATOM 0 HA ALA A 55 2.916 -9.191 -1.059 1.00 22.23 H new ATOM 0 HB1 ALA A 55 1.187 -8.135 0.343 1.00 42.42 H new ATOM 0 HB2 ALA A 55 2.722 -7.236 0.407 1.00 42.42 H new ATOM 0 HB3 ALA A 55 1.371 -6.621 -0.574 1.00 42.42 H new ATOM 868 N ARG A 56 0.546 -9.850 -1.936 1.00 62.03 N ATOM 869 CA ARG A 56 -0.508 -10.430 -2.782 1.00 73.31 C ATOM 870 C ARG A 56 -1.905 -10.309 -2.137 1.00 53.41 C ATOM 871 O ARG A 56 -2.164 -10.845 -1.054 1.00 72.30 O ATOM 872 CB ARG A 56 -0.167 -11.893 -3.091 1.00 54.51 C ATOM 873 CG ARG A 56 -0.950 -12.484 -4.261 1.00 20.15 C ATOM 874 CD ARG A 56 -0.241 -13.698 -4.851 1.00 21.32 C ATOM 875 NE ARG A 56 1.141 -13.380 -5.227 1.00 11.21 N ATOM 876 CZ ARG A 56 1.691 -13.689 -6.370 1.00 44.24 C ATOM 877 NH1 ARG A 56 1.030 -14.334 -7.271 1.00 73.04 N ATOM 878 NH2 ARG A 56 2.917 -13.349 -6.605 1.00 63.21 N ATOM 0 H ARG A 56 0.705 -10.345 -1.059 1.00 62.03 H new ATOM 0 HA ARG A 56 -0.548 -9.864 -3.713 1.00 73.31 H new ATOM 0 HB2 ARG A 56 0.899 -11.968 -3.307 1.00 54.51 H new ATOM 0 HB3 ARG A 56 -0.356 -12.494 -2.201 1.00 54.51 H new ATOM 0 HG2 ARG A 56 -1.947 -12.771 -3.925 1.00 20.15 H new ATOM 0 HG3 ARG A 56 -1.080 -11.726 -5.033 1.00 20.15 H new ATOM 0 HD2 ARG A 56 -0.244 -14.511 -4.125 1.00 21.32 H new ATOM 0 HD3 ARG A 56 -0.786 -14.050 -5.727 1.00 21.32 H new ATOM 0 HE ARG A 56 1.714 -12.881 -4.546 1.00 11.21 H new ATOM 0 HH11 ARG A 56 0.064 -14.610 -7.095 1.00 73.04 H new ATOM 0 HH12 ARG A 56 1.474 -14.568 -8.159 1.00 73.04 H new ATOM 0 HH21 ARG A 56 3.450 -12.842 -5.899 1.00 63.21 H new ATOM 0 HH22 ARG A 56 3.351 -13.588 -7.497 1.00 63.21 H new ATOM 892 N LEU A 57 -2.804 -9.607 -2.826 1.00 23.35 N ATOM 893 CA LEU A 57 -4.153 -9.318 -2.316 1.00 11.04 C ATOM 894 C LEU A 57 -5.252 -9.971 -3.171 1.00 3.42 C ATOM 895 O LEU A 57 -5.307 -9.776 -4.384 1.00 23.34 O ATOM 896 CB LEU A 57 -4.367 -7.795 -2.272 1.00 11.04 C ATOM 897 CG LEU A 57 -5.798 -7.316 -1.949 1.00 32.44 C ATOM 898 CD1 LEU A 57 -6.258 -7.834 -0.588 1.00 72.35 C ATOM 899 CD2 LEU A 57 -5.872 -5.790 -2.001 1.00 10.41 C ATOM 0 H LEU A 57 -2.623 -9.221 -3.753 1.00 23.35 H new ATOM 0 HA LEU A 57 -4.226 -9.741 -1.314 1.00 11.04 H new ATOM 0 HB2 LEU A 57 -3.689 -7.375 -1.528 1.00 11.04 H new ATOM 0 HB3 LEU A 57 -4.077 -7.380 -3.237 1.00 11.04 H new ATOM 0 HG LEU A 57 -6.471 -7.722 -2.704 1.00 32.44 H new ATOM 0 HD11 LEU A 57 -7.269 -7.481 -0.387 1.00 72.35 H new ATOM 0 HD12 LEU A 57 -6.248 -8.924 -0.591 1.00 72.35 H new ATOM 0 HD13 LEU A 57 -5.585 -7.468 0.187 1.00 72.35 H new ATOM 0 HD21 LEU A 57 -6.887 -5.467 -1.771 1.00 10.41 H new ATOM 0 HD22 LEU A 57 -5.182 -5.367 -1.270 1.00 10.41 H new ATOM 0 HD23 LEU A 57 -5.599 -5.446 -2.999 1.00 10.41 H new ATOM 911 N GLU A 58 -6.129 -10.740 -2.527 1.00 61.14 N ATOM 912 CA GLU A 58 -7.319 -11.281 -3.190 1.00 30.30 C ATOM 913 C GLU A 58 -8.466 -10.262 -3.110 1.00 42.53 C ATOM 914 O GLU A 58 -9.031 -10.029 -2.039 1.00 50.40 O ATOM 915 CB GLU A 58 -7.740 -12.613 -2.548 1.00 53.53 C ATOM 916 CG GLU A 58 -8.944 -13.268 -3.222 1.00 25.41 C ATOM 917 CD GLU A 58 -9.354 -14.572 -2.554 1.00 44.11 C ATOM 918 OE1 GLU A 58 -10.108 -14.527 -1.558 1.00 61.32 O ATOM 919 OE2 GLU A 58 -8.916 -15.648 -3.014 1.00 42.04 O ATOM 0 H GLU A 58 -6.039 -11.004 -1.546 1.00 61.14 H new ATOM 0 HA GLU A 58 -7.082 -11.469 -4.237 1.00 30.30 H new ATOM 0 HB2 GLU A 58 -6.897 -13.304 -2.580 1.00 53.53 H new ATOM 0 HB3 GLU A 58 -7.972 -12.442 -1.497 1.00 53.53 H new ATOM 0 HG2 GLU A 58 -9.786 -12.576 -3.205 1.00 25.41 H new ATOM 0 HG3 GLU A 58 -8.709 -13.459 -4.269 1.00 25.41 H new ATOM 926 N SER A 59 -8.795 -9.648 -4.242 1.00 1.32 N ATOM 927 CA SER A 59 -9.772 -8.550 -4.270 1.00 4.51 C ATOM 928 C SER A 59 -11.056 -8.931 -5.018 1.00 71.13 C ATOM 929 O SER A 59 -11.207 -10.057 -5.496 1.00 62.01 O ATOM 930 CB SER A 59 -9.157 -7.319 -4.938 1.00 43.02 C ATOM 931 OG SER A 59 -8.962 -7.529 -6.327 1.00 54.40 O ATOM 0 H SER A 59 -8.404 -9.887 -5.153 1.00 1.32 H new ATOM 0 HA SER A 59 -10.035 -8.332 -3.235 1.00 4.51 H new ATOM 0 HB2 SER A 59 -9.807 -6.457 -4.786 1.00 43.02 H new ATOM 0 HB3 SER A 59 -8.203 -7.085 -4.466 1.00 43.02 H new ATOM 0 HG SER A 59 -8.600 -8.428 -6.474 1.00 54.40 H new ATOM 937 N GLN A 60 -11.974 -7.967 -5.132 1.00 42.13 N ATOM 938 CA GLN A 60 -13.255 -8.181 -5.821 1.00 44.31 C ATOM 939 C GLN A 60 -13.076 -8.392 -7.337 1.00 13.30 C ATOM 940 O GLN A 60 -13.959 -8.932 -8.002 1.00 71.43 O ATOM 941 CB GLN A 60 -14.200 -6.999 -5.555 1.00 20.22 C ATOM 942 CG GLN A 60 -14.587 -6.852 -4.085 1.00 23.51 C ATOM 943 CD GLN A 60 -15.485 -5.655 -3.820 1.00 1.02 C ATOM 944 OE1 GLN A 60 -14.888 -4.529 -3.492 1.00 31.13 O flip ATOM 945 NE2 GLN A 60 -16.705 -5.744 -3.900 1.00 43.53 N flip ATOM 0 H GLN A 60 -11.855 -7.027 -4.755 1.00 42.13 H new ATOM 0 HA GLN A 60 -13.693 -9.095 -5.419 1.00 44.31 H new ATOM 0 HB2 GLN A 60 -13.723 -6.079 -5.891 1.00 20.22 H new ATOM 0 HB3 GLN A 60 -15.104 -7.125 -6.150 1.00 20.22 H new ATOM 0 HG2 GLN A 60 -15.095 -7.759 -3.757 1.00 23.51 H new ATOM 0 HG3 GLN A 60 -13.682 -6.759 -3.485 1.00 23.51 H new ATOM 0 HE21 GLN A 60 -17.136 -6.632 -4.157 1.00 43.53 H new ATOM 0 HE22 GLN A 60 -17.289 -4.930 -3.710 1.00 43.53 H new ATOM 954 N ILE A 61 -11.934 -7.965 -7.878 1.00 62.14 N ATOM 955 CA ILE A 61 -11.623 -8.192 -9.299 1.00 11.52 C ATOM 956 C ILE A 61 -10.769 -9.459 -9.483 1.00 41.12 C ATOM 957 O ILE A 61 -10.507 -9.890 -10.608 1.00 51.41 O ATOM 958 CB ILE A 61 -10.878 -6.986 -9.932 1.00 33.33 C ATOM 959 CG1 ILE A 61 -9.499 -6.791 -9.278 1.00 22.25 C ATOM 960 CG2 ILE A 61 -11.720 -5.715 -9.813 1.00 72.40 C ATOM 961 CD1 ILE A 61 -8.653 -5.719 -9.932 1.00 72.30 C ATOM 0 H ILE A 61 -11.211 -7.463 -7.362 1.00 62.14 H new ATOM 0 HA ILE A 61 -12.579 -8.317 -9.807 1.00 11.52 H new ATOM 0 HB ILE A 61 -10.722 -7.196 -10.990 1.00 33.33 H new ATOM 0 HG12 ILE A 61 -9.639 -6.538 -8.227 1.00 22.25 H new ATOM 0 HG13 ILE A 61 -8.957 -7.736 -9.309 1.00 22.25 H new ATOM 0 HG21 ILE A 61 -11.183 -4.879 -10.262 1.00 72.40 H new ATOM 0 HG22 ILE A 61 -12.668 -5.857 -10.331 1.00 72.40 H new ATOM 0 HG23 ILE A 61 -11.910 -5.501 -8.761 1.00 72.40 H new ATOM 0 HD11 ILE A 61 -7.697 -5.643 -9.413 1.00 72.30 H new ATOM 0 HD12 ILE A 61 -8.479 -5.979 -10.976 1.00 72.30 H new ATOM 0 HD13 ILE A 61 -9.172 -4.762 -9.878 1.00 72.30 H new ATOM 973 N GLY A 62 -10.343 -10.051 -8.368 1.00 71.11 N ATOM 974 CA GLY A 62 -9.489 -11.232 -8.414 1.00 51.30 C ATOM 975 C GLY A 62 -8.211 -11.073 -7.594 1.00 52.34 C ATOM 976 O GLY A 62 -7.986 -10.035 -6.966 1.00 25.40 O ATOM 0 H GLY A 62 -10.575 -9.732 -7.427 1.00 71.11 H new ATOM 0 HA2 GLY A 62 -10.047 -12.092 -8.045 1.00 51.30 H new ATOM 0 HA3 GLY A 62 -9.226 -11.444 -9.450 1.00 51.30 H new ATOM 980 N THR A 63 -7.371 -12.104 -7.593 1.00 61.11 N ATOM 981 CA THR A 63 -6.097 -12.070 -6.861 1.00 4.32 C ATOM 982 C THR A 63 -5.023 -11.301 -7.644 1.00 12.31 C ATOM 983 O THR A 63 -4.823 -11.533 -8.836 1.00 72.32 O ATOM 984 CB THR A 63 -5.581 -13.500 -6.558 1.00 64.14 C ATOM 985 OG1 THR A 63 -6.580 -14.239 -5.836 1.00 32.24 O ATOM 986 CG2 THR A 63 -4.290 -13.467 -5.742 1.00 41.20 C ATOM 0 H THR A 63 -7.545 -12.977 -8.090 1.00 61.11 H new ATOM 0 HA THR A 63 -6.289 -11.555 -5.920 1.00 4.32 H new ATOM 0 HB THR A 63 -5.374 -13.987 -7.511 1.00 64.14 H new ATOM 0 HG1 THR A 63 -6.248 -15.142 -5.650 1.00 32.24 H new ATOM 0 HG21 THR A 63 -3.956 -14.486 -5.548 1.00 41.20 H new ATOM 0 HG22 THR A 63 -3.520 -12.933 -6.300 1.00 41.20 H new ATOM 0 HG23 THR A 63 -4.471 -12.958 -4.795 1.00 41.20 H new ATOM 994 N LEU A 64 -4.334 -10.383 -6.969 1.00 53.45 N ATOM 995 CA LEU A 64 -3.297 -9.563 -7.607 1.00 22.41 C ATOM 996 C LEU A 64 -2.103 -9.300 -6.670 1.00 52.34 C ATOM 997 O LEU A 64 -2.118 -9.678 -5.499 1.00 1.02 O ATOM 998 CB LEU A 64 -3.908 -8.237 -8.111 1.00 51.32 C ATOM 999 CG LEU A 64 -4.863 -7.506 -7.137 1.00 14.43 C ATOM 1000 CD1 LEU A 64 -4.119 -6.965 -5.916 1.00 63.32 C ATOM 1001 CD2 LEU A 64 -5.601 -6.375 -7.853 1.00 0.11 C ATOM 0 H LEU A 64 -4.473 -10.185 -5.978 1.00 53.45 H new ATOM 0 HA LEU A 64 -2.909 -10.122 -8.458 1.00 22.41 H new ATOM 0 HB2 LEU A 64 -3.093 -7.559 -8.363 1.00 51.32 H new ATOM 0 HB3 LEU A 64 -4.451 -8.440 -9.034 1.00 51.32 H new ATOM 0 HG LEU A 64 -5.592 -8.236 -6.786 1.00 14.43 H new ATOM 0 HD11 LEU A 64 -4.823 -6.459 -5.256 1.00 63.32 H new ATOM 0 HD12 LEU A 64 -3.649 -7.790 -5.381 1.00 63.32 H new ATOM 0 HD13 LEU A 64 -3.353 -6.260 -6.239 1.00 63.32 H new ATOM 0 HD21 LEU A 64 -6.267 -5.874 -7.151 1.00 0.11 H new ATOM 0 HD22 LEU A 64 -4.878 -5.658 -8.242 1.00 0.11 H new ATOM 0 HD23 LEU A 64 -6.185 -6.786 -8.677 1.00 0.11 H new ATOM 1013 N ARG A 65 -1.075 -8.649 -7.202 1.00 74.42 N ATOM 1014 CA ARG A 65 0.141 -8.331 -6.448 1.00 33.01 C ATOM 1015 C ARG A 65 0.425 -6.819 -6.488 1.00 25.23 C ATOM 1016 O ARG A 65 0.550 -6.235 -7.563 1.00 4.30 O ATOM 1017 CB ARG A 65 1.331 -9.102 -7.044 1.00 33.42 C ATOM 1018 CG ARG A 65 2.642 -8.913 -6.280 1.00 1.30 C ATOM 1019 CD ARG A 65 3.840 -9.473 -7.046 1.00 43.13 C ATOM 1020 NE ARG A 65 4.087 -8.743 -8.292 1.00 45.12 N ATOM 1021 CZ ARG A 65 5.269 -8.578 -8.832 1.00 2.40 C ATOM 1022 NH1 ARG A 65 6.323 -9.105 -8.294 1.00 73.31 N ATOM 1023 NH2 ARG A 65 5.388 -7.895 -9.925 1.00 71.24 N ATOM 0 H ARG A 65 -1.057 -8.325 -8.169 1.00 74.42 H new ATOM 0 HA ARG A 65 -0.003 -8.627 -5.409 1.00 33.01 H new ATOM 0 HB2 ARG A 65 1.087 -10.164 -7.068 1.00 33.42 H new ATOM 0 HB3 ARG A 65 1.476 -8.784 -8.077 1.00 33.42 H new ATOM 0 HG2 ARG A 65 2.799 -7.852 -6.088 1.00 1.30 H new ATOM 0 HG3 ARG A 65 2.570 -9.405 -5.310 1.00 1.30 H new ATOM 0 HD2 ARG A 65 4.728 -9.424 -6.416 1.00 43.13 H new ATOM 0 HD3 ARG A 65 3.666 -10.525 -7.271 1.00 43.13 H new ATOM 0 HE ARG A 65 3.284 -8.336 -8.772 1.00 45.12 H new ATOM 0 HH11 ARG A 65 6.238 -9.656 -7.440 1.00 73.31 H new ATOM 0 HH12 ARG A 65 7.238 -8.969 -8.725 1.00 73.31 H new ATOM 0 HH21 ARG A 65 4.563 -7.487 -10.364 1.00 71.24 H new ATOM 0 HH22 ARG A 65 6.307 -7.765 -10.348 1.00 71.24 H new ATOM 1037 N MET A 66 0.528 -6.193 -5.317 1.00 5.44 N ATOM 1038 CA MET A 66 0.795 -4.748 -5.227 1.00 74.31 C ATOM 1039 C MET A 66 2.122 -4.454 -4.510 1.00 0.35 C ATOM 1040 O MET A 66 2.613 -5.270 -3.731 1.00 61.33 O ATOM 1041 CB MET A 66 -0.360 -4.036 -4.508 1.00 41.32 C ATOM 1042 CG MET A 66 -1.676 -4.071 -5.276 1.00 2.25 C ATOM 1043 SD MET A 66 -3.004 -3.199 -4.420 1.00 44.43 S ATOM 1044 CE MET A 66 -4.316 -3.288 -5.638 1.00 33.52 C ATOM 0 H MET A 66 0.432 -6.658 -4.415 1.00 5.44 H new ATOM 0 HA MET A 66 0.877 -4.367 -6.245 1.00 74.31 H new ATOM 0 HB2 MET A 66 -0.507 -4.497 -3.531 1.00 41.32 H new ATOM 0 HB3 MET A 66 -0.081 -2.997 -4.331 1.00 41.32 H new ATOM 0 HG2 MET A 66 -1.530 -3.626 -6.260 1.00 2.25 H new ATOM 0 HG3 MET A 66 -1.971 -5.108 -5.436 1.00 2.25 H new ATOM 0 HE1 MET A 66 -4.786 -2.310 -5.739 1.00 33.52 H new ATOM 0 HE2 MET A 66 -3.901 -3.592 -6.599 1.00 33.52 H new ATOM 0 HE3 MET A 66 -5.061 -4.016 -5.318 1.00 33.52 H new ATOM 1054 N SER A 67 2.705 -3.286 -4.786 1.00 64.31 N ATOM 1055 CA SER A 67 3.961 -2.866 -4.133 1.00 51.40 C ATOM 1056 C SER A 67 4.157 -1.343 -4.193 1.00 70.20 C ATOM 1057 O SER A 67 3.433 -0.638 -4.902 1.00 44.41 O ATOM 1058 CB SER A 67 5.168 -3.562 -4.776 1.00 31.14 C ATOM 1059 OG SER A 67 6.372 -3.249 -4.086 1.00 14.05 O ATOM 0 H SER A 67 2.334 -2.611 -5.455 1.00 64.31 H new ATOM 0 HA SER A 67 3.887 -3.160 -3.086 1.00 51.40 H new ATOM 0 HB2 SER A 67 5.014 -4.641 -4.771 1.00 31.14 H new ATOM 0 HB3 SER A 67 5.254 -3.257 -5.819 1.00 31.14 H new ATOM 0 HG SER A 67 7.124 -3.707 -4.516 1.00 14.05 H new ATOM 1065 N LEU A 68 5.159 -0.846 -3.462 1.00 3.14 N ATOM 1066 CA LEU A 68 5.409 0.598 -3.339 1.00 40.32 C ATOM 1067 C LEU A 68 6.771 1.001 -3.937 1.00 71.34 C ATOM 1068 O LEU A 68 7.823 0.743 -3.349 1.00 65.34 O ATOM 1069 CB LEU A 68 5.368 1.018 -1.862 1.00 23.32 C ATOM 1070 CG LEU A 68 4.025 0.819 -1.137 1.00 4.54 C ATOM 1071 CD1 LEU A 68 4.145 1.211 0.336 1.00 13.31 C ATOM 1072 CD2 LEU A 68 2.922 1.624 -1.818 1.00 2.34 C ATOM 0 H LEU A 68 5.817 -1.426 -2.941 1.00 3.14 H new ATOM 0 HA LEU A 68 4.625 1.108 -3.898 1.00 40.32 H new ATOM 0 HB2 LEU A 68 6.134 0.458 -1.325 1.00 23.32 H new ATOM 0 HB3 LEU A 68 5.640 2.072 -1.798 1.00 23.32 H new ATOM 0 HG LEU A 68 3.761 -0.237 -1.190 1.00 4.54 H new ATOM 0 HD11 LEU A 68 3.185 1.063 0.831 1.00 13.31 H new ATOM 0 HD12 LEU A 68 4.901 0.590 0.817 1.00 13.31 H new ATOM 0 HD13 LEU A 68 4.434 2.259 0.411 1.00 13.31 H new ATOM 0 HD21 LEU A 68 1.981 1.470 -1.291 1.00 2.34 H new ATOM 0 HD22 LEU A 68 3.180 2.683 -1.799 1.00 2.34 H new ATOM 0 HD23 LEU A 68 2.817 1.295 -2.852 1.00 2.34 H new ATOM 1084 N VAL A 69 6.748 1.646 -5.102 1.00 32.33 N ATOM 1085 CA VAL A 69 7.974 2.156 -5.732 1.00 22.52 C ATOM 1086 C VAL A 69 7.979 3.689 -5.767 1.00 14.12 C ATOM 1087 O VAL A 69 6.938 4.321 -5.596 1.00 42.31 O ATOM 1088 CB VAL A 69 8.147 1.621 -7.179 1.00 11.01 C ATOM 1089 CG1 VAL A 69 8.295 0.108 -7.186 1.00 21.11 C ATOM 1090 CG2 VAL A 69 6.982 2.050 -8.067 1.00 34.13 C ATOM 0 H VAL A 69 5.896 1.830 -5.632 1.00 32.33 H new ATOM 0 HA VAL A 69 8.805 1.800 -5.124 1.00 22.52 H new ATOM 0 HB VAL A 69 9.060 2.055 -7.585 1.00 11.01 H new ATOM 0 HG11 VAL A 69 8.415 -0.241 -8.212 1.00 21.11 H new ATOM 0 HG12 VAL A 69 9.171 -0.175 -6.602 1.00 21.11 H new ATOM 0 HG13 VAL A 69 7.406 -0.347 -6.749 1.00 21.11 H new ATOM 0 HG21 VAL A 69 7.130 1.661 -9.074 1.00 34.13 H new ATOM 0 HG22 VAL A 69 6.050 1.657 -7.660 1.00 34.13 H new ATOM 0 HG23 VAL A 69 6.933 3.138 -8.102 1.00 34.13 H new ATOM 1100 N ASN A 70 9.161 4.281 -5.967 1.00 74.33 N ATOM 1101 CA ASN A 70 9.285 5.736 -6.161 1.00 3.43 C ATOM 1102 C ASN A 70 8.845 6.527 -4.913 1.00 52.05 C ATOM 1103 O ASN A 70 8.364 7.659 -5.014 1.00 41.31 O ATOM 1104 CB ASN A 70 8.456 6.155 -7.385 1.00 2.11 C ATOM 1105 CG ASN A 70 8.923 5.469 -8.656 1.00 21.13 C ATOM 1106 OD1 ASN A 70 7.996 4.916 -9.408 1.00 24.14 O flip ATOM 1107 ND2 ASN A 70 10.112 5.398 -8.940 1.00 10.42 N flip ATOM 0 H ASN A 70 10.048 3.778 -5.999 1.00 74.33 H new ATOM 0 HA ASN A 70 10.336 5.970 -6.328 1.00 3.43 H new ATOM 0 HB2 ASN A 70 7.407 5.917 -7.210 1.00 2.11 H new ATOM 0 HB3 ASN A 70 8.520 7.236 -7.513 1.00 2.11 H new ATOM 0 HD21 ASN A 70 10.808 5.837 -8.337 1.00 10.42 H new ATOM 0 HD22 ASN A 70 10.407 4.900 -9.780 1.00 10.42 H new ATOM 1114 N ILE A 71 9.044 5.934 -3.736 1.00 23.21 N ATOM 1115 CA ILE A 71 8.628 6.550 -2.467 1.00 2.43 C ATOM 1116 C ILE A 71 9.532 7.732 -2.071 1.00 14.21 C ATOM 1117 O ILE A 71 10.661 7.535 -1.613 1.00 21.54 O ATOM 1118 CB ILE A 71 8.635 5.514 -1.312 1.00 20.43 C ATOM 1119 CG1 ILE A 71 7.844 4.257 -1.706 1.00 3.35 C ATOM 1120 CG2 ILE A 71 8.062 6.133 -0.034 1.00 22.41 C ATOM 1121 CD1 ILE A 71 7.886 3.160 -0.662 1.00 3.21 C ATOM 0 H ILE A 71 9.492 5.024 -3.630 1.00 23.21 H new ATOM 0 HA ILE A 71 7.615 6.919 -2.628 1.00 2.43 H new ATOM 0 HB ILE A 71 9.667 5.221 -1.120 1.00 20.43 H new ATOM 0 HG12 ILE A 71 6.806 4.534 -1.888 1.00 3.35 H new ATOM 0 HG13 ILE A 71 8.239 3.869 -2.645 1.00 3.35 H new ATOM 0 HG21 ILE A 71 8.074 5.393 0.766 1.00 22.41 H new ATOM 0 HG22 ILE A 71 8.667 6.992 0.257 1.00 22.41 H new ATOM 0 HG23 ILE A 71 7.037 6.456 -0.214 1.00 22.41 H new ATOM 0 HD11 ILE A 71 7.306 2.305 -1.009 1.00 3.21 H new ATOM 0 HD12 ILE A 71 8.919 2.855 -0.496 1.00 3.21 H new ATOM 0 HD13 ILE A 71 7.463 3.530 0.272 1.00 3.21 H new ATOM 1133 N THR A 72 9.035 8.953 -2.258 1.00 31.30 N ATOM 1134 CA THR A 72 9.743 10.173 -1.822 1.00 71.51 C ATOM 1135 C THR A 72 8.782 11.184 -1.179 1.00 53.52 C ATOM 1136 O THR A 72 7.591 11.210 -1.491 1.00 62.43 O ATOM 1137 CB THR A 72 10.502 10.870 -2.986 1.00 12.44 C ATOM 1138 OG1 THR A 72 9.672 10.970 -4.151 1.00 60.24 O ATOM 1139 CG2 THR A 72 11.789 10.130 -3.325 1.00 25.33 C ATOM 0 H THR A 72 8.139 9.133 -2.711 1.00 31.30 H new ATOM 0 HA THR A 72 10.472 9.842 -1.083 1.00 71.51 H new ATOM 0 HB THR A 72 10.760 11.875 -2.653 1.00 12.44 H new ATOM 0 HG1 THR A 72 10.169 11.413 -4.870 1.00 60.24 H new ATOM 0 HG21 THR A 72 12.298 10.641 -4.142 1.00 25.33 H new ATOM 0 HG22 THR A 72 12.438 10.110 -2.450 1.00 25.33 H new ATOM 0 HG23 THR A 72 11.553 9.109 -3.626 1.00 25.33 H new ATOM 1147 N PRO A 73 9.291 12.032 -0.262 1.00 3.21 N ATOM 1148 CA PRO A 73 8.464 13.023 0.455 1.00 51.43 C ATOM 1149 C PRO A 73 7.849 14.093 -0.468 1.00 35.02 C ATOM 1150 O PRO A 73 8.212 14.218 -1.641 1.00 13.34 O ATOM 1151 CB PRO A 73 9.447 13.662 1.449 1.00 23.03 C ATOM 1152 CG PRO A 73 10.796 13.419 0.864 1.00 30.14 C ATOM 1153 CD PRO A 73 10.708 12.098 0.149 1.00 15.41 C ATOM 0 HA PRO A 73 7.602 12.551 0.926 1.00 51.43 H new ATOM 0 HB2 PRO A 73 9.253 14.728 1.566 1.00 23.03 H new ATOM 0 HB3 PRO A 73 9.358 13.212 2.438 1.00 23.03 H new ATOM 0 HG2 PRO A 73 11.072 14.217 0.175 1.00 30.14 H new ATOM 0 HG3 PRO A 73 11.559 13.391 1.642 1.00 30.14 H new ATOM 0 HD2 PRO A 73 11.379 12.059 -0.709 1.00 15.41 H new ATOM 0 HD3 PRO A 73 10.977 11.268 0.802 1.00 15.41 H new ATOM 1161 N ASP A 74 6.919 14.866 0.083 1.00 61.32 N ATOM 1162 CA ASP A 74 6.193 15.886 -0.677 1.00 54.24 C ATOM 1163 C ASP A 74 5.920 17.126 0.196 1.00 14.41 C ATOM 1164 O ASP A 74 6.147 17.103 1.406 1.00 72.53 O ATOM 1165 CB ASP A 74 4.880 15.279 -1.191 1.00 35.52 C ATOM 1166 CG ASP A 74 4.018 16.272 -1.949 1.00 43.14 C ATOM 1167 OD1 ASP A 74 4.371 16.624 -3.092 1.00 12.45 O ATOM 1168 OD2 ASP A 74 3.002 16.728 -1.392 1.00 61.23 O ATOM 0 H ASP A 74 6.646 14.806 1.064 1.00 61.32 H new ATOM 0 HA ASP A 74 6.798 16.210 -1.524 1.00 54.24 H new ATOM 0 HB2 ASP A 74 5.108 14.435 -1.842 1.00 35.52 H new ATOM 0 HB3 ASP A 74 4.314 14.887 -0.346 1.00 35.52 H new ATOM 1173 N ALA A 75 5.440 18.206 -0.420 1.00 24.14 N ATOM 1174 CA ALA A 75 5.091 19.425 0.318 1.00 70.12 C ATOM 1175 C ALA A 75 3.968 19.170 1.339 1.00 51.13 C ATOM 1176 O ALA A 75 4.046 19.618 2.486 1.00 53.45 O ATOM 1177 CB ALA A 75 4.684 20.533 -0.648 1.00 12.20 C ATOM 0 H ALA A 75 5.283 18.264 -1.426 1.00 24.14 H new ATOM 0 HA ALA A 75 5.976 19.740 0.870 1.00 70.12 H new ATOM 0 HB1 ALA A 75 4.428 21.431 -0.085 1.00 12.20 H new ATOM 0 HB2 ALA A 75 5.513 20.751 -1.322 1.00 12.20 H new ATOM 0 HB3 ALA A 75 3.820 20.210 -1.229 1.00 12.20 H new ATOM 1183 N ASP A 76 2.928 18.457 0.913 1.00 52.14 N ATOM 1184 CA ASP A 76 1.802 18.115 1.792 1.00 41.04 C ATOM 1185 C ASP A 76 2.093 16.856 2.627 1.00 40.05 C ATOM 1186 O ASP A 76 1.643 16.741 3.766 1.00 51.12 O ATOM 1187 CB ASP A 76 0.532 17.905 0.961 1.00 32.23 C ATOM 1188 CG ASP A 76 0.063 19.182 0.288 1.00 61.31 C ATOM 1189 OD1 ASP A 76 0.517 19.471 -0.838 1.00 2.34 O ATOM 1190 OD2 ASP A 76 -0.771 19.903 0.874 1.00 52.22 O ATOM 0 H ASP A 76 2.838 18.102 -0.039 1.00 52.14 H new ATOM 0 HA ASP A 76 1.656 18.947 2.481 1.00 41.04 H new ATOM 0 HB2 ASP A 76 0.719 17.145 0.202 1.00 32.23 H new ATOM 0 HB3 ASP A 76 -0.261 17.524 1.604 1.00 32.23 H new ATOM 1195 N GLY A 77 2.829 15.905 2.055 1.00 64.44 N ATOM 1196 CA GLY A 77 3.154 14.681 2.787 1.00 62.53 C ATOM 1197 C GLY A 77 4.202 13.805 2.105 1.00 22.04 C ATOM 1198 O GLY A 77 5.400 14.068 2.199 1.00 40.24 O ATOM 0 H GLY A 77 3.205 15.954 1.108 1.00 64.44 H new ATOM 0 HA2 GLY A 77 3.512 14.949 3.781 1.00 62.53 H new ATOM 0 HA3 GLY A 77 2.242 14.099 2.923 1.00 62.53 H new ATOM 1202 N THR A 78 3.747 12.747 1.433 1.00 4.04 N ATOM 1203 CA THR A 78 4.649 11.786 0.779 1.00 41.43 C ATOM 1204 C THR A 78 4.038 11.228 -0.515 1.00 73.15 C ATOM 1205 O THR A 78 2.887 10.795 -0.533 1.00 62.23 O ATOM 1206 CB THR A 78 4.995 10.605 1.722 1.00 42.11 C ATOM 1207 OG1 THR A 78 5.634 11.093 2.912 1.00 63.04 O ATOM 1208 CG2 THR A 78 5.912 9.596 1.035 1.00 24.41 C ATOM 0 H THR A 78 2.756 12.530 1.325 1.00 4.04 H new ATOM 0 HA THR A 78 5.560 12.332 0.536 1.00 41.43 H new ATOM 0 HB THR A 78 4.062 10.105 1.982 1.00 42.11 H new ATOM 0 HG1 THR A 78 4.961 11.479 3.510 1.00 63.04 H new ATOM 0 HG21 THR A 78 6.136 8.781 1.723 1.00 24.41 H new ATOM 0 HG22 THR A 78 5.417 9.198 0.149 1.00 24.41 H new ATOM 0 HG23 THR A 78 6.839 10.088 0.742 1.00 24.41 H new ATOM 1216 N THR A 79 4.815 11.239 -1.596 1.00 54.05 N ATOM 1217 CA THR A 79 4.355 10.718 -2.893 1.00 53.35 C ATOM 1218 C THR A 79 5.067 9.412 -3.261 1.00 31.02 C ATOM 1219 O THR A 79 6.278 9.280 -3.082 1.00 62.20 O ATOM 1220 CB THR A 79 4.591 11.731 -4.038 1.00 10.50 C ATOM 1221 OG1 THR A 79 5.998 12.009 -4.186 1.00 51.50 O ATOM 1222 CG2 THR A 79 3.837 13.032 -3.784 1.00 62.52 C ATOM 0 H THR A 79 5.768 11.602 -1.605 1.00 54.05 H new ATOM 0 HA THR A 79 3.286 10.538 -2.779 1.00 53.35 H new ATOM 0 HB THR A 79 4.215 11.284 -4.958 1.00 10.50 H new ATOM 0 HG1 THR A 79 6.482 11.676 -3.401 1.00 51.50 H new ATOM 0 HG21 THR A 79 4.021 13.725 -4.605 1.00 62.52 H new ATOM 0 HG22 THR A 79 2.769 12.826 -3.716 1.00 62.52 H new ATOM 0 HG23 THR A 79 4.181 13.476 -2.850 1.00 62.52 H new ATOM 1230 N LEU A 80 4.308 8.452 -3.783 1.00 4.14 N ATOM 1231 CA LEU A 80 4.869 7.170 -4.228 1.00 1.23 C ATOM 1232 C LEU A 80 4.063 6.585 -5.400 1.00 23.13 C ATOM 1233 O LEU A 80 3.087 7.182 -5.857 1.00 43.52 O ATOM 1234 CB LEU A 80 4.944 6.182 -3.043 1.00 41.50 C ATOM 1235 CG LEU A 80 3.647 5.986 -2.227 1.00 44.24 C ATOM 1236 CD1 LEU A 80 2.648 5.097 -2.965 1.00 21.24 C ATOM 1237 CD2 LEU A 80 3.958 5.409 -0.846 1.00 2.23 C ATOM 0 H LEU A 80 3.299 8.534 -3.910 1.00 4.14 H new ATOM 0 HA LEU A 80 5.882 7.344 -4.592 1.00 1.23 H new ATOM 0 HB2 LEU A 80 5.255 5.211 -3.428 1.00 41.50 H new ATOM 0 HB3 LEU A 80 5.726 6.522 -2.364 1.00 41.50 H new ATOM 0 HG LEU A 80 3.189 6.967 -2.100 1.00 44.24 H new ATOM 0 HD11 LEU A 80 1.748 4.982 -2.361 1.00 21.24 H new ATOM 0 HD12 LEU A 80 2.388 5.556 -3.919 1.00 21.24 H new ATOM 0 HD13 LEU A 80 3.094 4.118 -3.143 1.00 21.24 H new ATOM 0 HD21 LEU A 80 3.030 5.279 -0.289 1.00 2.23 H new ATOM 0 HD22 LEU A 80 4.452 4.444 -0.958 1.00 2.23 H new ATOM 0 HD23 LEU A 80 4.614 6.092 -0.306 1.00 2.23 H new ATOM 1249 N THR A 81 4.475 5.420 -5.880 1.00 34.43 N ATOM 1250 CA THR A 81 3.801 4.761 -7.004 1.00 42.42 C ATOM 1251 C THR A 81 3.357 3.341 -6.631 1.00 62.31 C ATOM 1252 O THR A 81 4.184 2.479 -6.324 1.00 64.44 O ATOM 1253 CB THR A 81 4.719 4.678 -8.249 1.00 54.40 C ATOM 1254 OG1 THR A 81 5.295 5.961 -8.544 1.00 35.31 O ATOM 1255 CG2 THR A 81 3.955 4.178 -9.473 1.00 13.35 C ATOM 0 H THR A 81 5.275 4.906 -5.511 1.00 34.43 H new ATOM 0 HA THR A 81 2.927 5.368 -7.240 1.00 42.42 H new ATOM 0 HB THR A 81 5.513 3.968 -8.016 1.00 54.40 H new ATOM 0 HG1 THR A 81 6.174 5.837 -8.959 1.00 35.31 H new ATOM 0 HG21 THR A 81 4.629 4.132 -10.329 1.00 13.35 H new ATOM 0 HG22 THR A 81 3.556 3.184 -9.272 1.00 13.35 H new ATOM 0 HG23 THR A 81 3.135 4.861 -9.694 1.00 13.35 H new ATOM 1263 N LEU A 82 2.050 3.107 -6.663 1.00 70.40 N ATOM 1264 CA LEU A 82 1.483 1.787 -6.376 1.00 32.41 C ATOM 1265 C LEU A 82 1.533 0.906 -7.642 1.00 41.42 C ATOM 1266 O LEU A 82 0.865 1.192 -8.636 1.00 63.34 O ATOM 1267 CB LEU A 82 0.027 1.947 -5.872 1.00 44.45 C ATOM 1268 CG LEU A 82 -0.545 0.798 -5.009 1.00 12.23 C ATOM 1269 CD1 LEU A 82 -0.581 -0.520 -5.770 1.00 31.22 C ATOM 1270 CD2 LEU A 82 0.245 0.650 -3.712 1.00 5.52 C ATOM 0 H LEU A 82 1.355 3.819 -6.887 1.00 70.40 H new ATOM 0 HA LEU A 82 2.069 1.299 -5.598 1.00 32.41 H new ATOM 0 HB2 LEU A 82 -0.032 2.868 -5.292 1.00 44.45 H new ATOM 0 HB3 LEU A 82 -0.620 2.074 -6.740 1.00 44.45 H new ATOM 0 HG LEU A 82 -1.574 1.060 -4.762 1.00 12.23 H new ATOM 0 HD11 LEU A 82 -0.989 -1.300 -5.127 1.00 31.22 H new ATOM 0 HD12 LEU A 82 -1.209 -0.413 -6.654 1.00 31.22 H new ATOM 0 HD13 LEU A 82 0.430 -0.792 -6.074 1.00 31.22 H new ATOM 0 HD21 LEU A 82 -0.175 -0.164 -3.121 1.00 5.52 H new ATOM 0 HD22 LEU A 82 1.287 0.430 -3.944 1.00 5.52 H new ATOM 0 HD23 LEU A 82 0.188 1.578 -3.143 1.00 5.52 H new ATOM 1282 N ARG A 83 2.338 -0.154 -7.604 1.00 73.01 N ATOM 1283 CA ARG A 83 2.454 -1.084 -8.738 1.00 72.03 C ATOM 1284 C ARG A 83 1.545 -2.300 -8.548 1.00 75.42 C ATOM 1285 O ARG A 83 1.475 -2.870 -7.462 1.00 11.15 O ATOM 1286 CB ARG A 83 3.908 -1.539 -8.950 1.00 15.00 C ATOM 1287 CG ARG A 83 4.761 -0.532 -9.717 1.00 4.12 C ATOM 1288 CD ARG A 83 6.101 -1.129 -10.137 1.00 23.44 C ATOM 1289 NE ARG A 83 6.810 -0.279 -11.093 1.00 1.13 N ATOM 1290 CZ ARG A 83 7.800 -0.684 -11.845 1.00 15.14 C ATOM 1291 NH1 ARG A 83 8.216 -1.911 -11.790 1.00 51.01 N ATOM 1292 NH2 ARG A 83 8.361 0.138 -12.668 1.00 42.40 N ATOM 0 H ARG A 83 2.922 -0.395 -6.803 1.00 73.01 H new ATOM 0 HA ARG A 83 2.133 -0.544 -9.629 1.00 72.03 H new ATOM 0 HB2 ARG A 83 4.366 -1.725 -7.979 1.00 15.00 H new ATOM 0 HB3 ARG A 83 3.908 -2.487 -9.489 1.00 15.00 H new ATOM 0 HG2 ARG A 83 4.220 -0.196 -10.601 1.00 4.12 H new ATOM 0 HG3 ARG A 83 4.933 0.347 -9.095 1.00 4.12 H new ATOM 0 HD2 ARG A 83 6.723 -1.277 -9.254 1.00 23.44 H new ATOM 0 HD3 ARG A 83 5.936 -2.111 -10.580 1.00 23.44 H new ATOM 0 HE ARG A 83 6.513 0.693 -11.179 1.00 1.13 H new ATOM 0 HH11 ARG A 83 7.770 -2.573 -11.155 1.00 51.01 H new ATOM 0 HH12 ARG A 83 8.989 -2.214 -12.382 1.00 51.01 H new ATOM 0 HH21 ARG A 83 8.032 1.101 -12.731 1.00 42.40 H new ATOM 0 HH22 ARG A 83 9.133 -0.176 -13.255 1.00 42.40 H new ATOM 1306 N ILE A 84 0.862 -2.691 -9.620 1.00 13.31 N ATOM 1307 CA ILE A 84 -0.161 -3.739 -9.567 1.00 52.23 C ATOM 1308 C ILE A 84 0.036 -4.776 -10.683 1.00 32.42 C ATOM 1309 O ILE A 84 0.267 -4.421 -11.834 1.00 63.33 O ATOM 1310 CB ILE A 84 -1.567 -3.093 -9.702 1.00 22.41 C ATOM 1311 CG1 ILE A 84 -1.775 -2.074 -8.565 1.00 2.53 C ATOM 1312 CG2 ILE A 84 -2.668 -4.158 -9.701 1.00 74.14 C ATOM 1313 CD1 ILE A 84 -2.829 -1.026 -8.841 1.00 63.22 C ATOM 0 H ILE A 84 0.999 -2.293 -10.549 1.00 13.31 H new ATOM 0 HA ILE A 84 -0.072 -4.253 -8.610 1.00 52.23 H new ATOM 0 HB ILE A 84 -1.627 -2.572 -10.658 1.00 22.41 H new ATOM 0 HG12 ILE A 84 -2.047 -2.613 -7.658 1.00 2.53 H new ATOM 0 HG13 ILE A 84 -0.827 -1.573 -8.366 1.00 2.53 H new ATOM 0 HG21 ILE A 84 -3.641 -3.676 -9.797 1.00 74.14 H new ATOM 0 HG22 ILE A 84 -2.516 -4.839 -10.539 1.00 74.14 H new ATOM 0 HG23 ILE A 84 -2.631 -4.718 -8.767 1.00 74.14 H new ATOM 0 HD11 ILE A 84 -2.906 -0.353 -7.987 1.00 63.22 H new ATOM 0 HD12 ILE A 84 -2.552 -0.456 -9.728 1.00 63.22 H new ATOM 0 HD13 ILE A 84 -3.790 -1.512 -9.008 1.00 63.22 H new ATOM 1325 N GLN A 85 -0.048 -6.056 -10.332 1.00 35.02 N ATOM 1326 CA GLN A 85 0.056 -7.145 -11.316 1.00 73.15 C ATOM 1327 C GLN A 85 -0.907 -8.288 -10.964 1.00 60.24 C ATOM 1328 O GLN A 85 -0.863 -8.823 -9.858 1.00 1.12 O ATOM 1329 CB GLN A 85 1.495 -7.680 -11.371 1.00 50.31 C ATOM 1330 CG GLN A 85 1.719 -8.755 -12.433 1.00 50.12 C ATOM 1331 CD GLN A 85 3.128 -9.321 -12.402 1.00 63.34 C ATOM 1332 OE1 GLN A 85 3.754 -9.387 -11.353 1.00 63.10 O ATOM 1333 NE2 GLN A 85 3.642 -9.721 -13.546 1.00 24.33 N ATOM 0 H GLN A 85 -0.188 -6.372 -9.372 1.00 35.02 H new ATOM 0 HA GLN A 85 -0.215 -6.745 -12.293 1.00 73.15 H new ATOM 0 HB2 GLN A 85 2.174 -6.849 -11.562 1.00 50.31 H new ATOM 0 HB3 GLN A 85 1.757 -8.088 -10.395 1.00 50.31 H new ATOM 0 HG2 GLN A 85 1.003 -9.563 -12.283 1.00 50.12 H new ATOM 0 HG3 GLN A 85 1.522 -8.333 -13.419 1.00 50.12 H new ATOM 0 HE21 GLN A 85 3.093 -9.653 -14.403 1.00 24.33 H new ATOM 0 HE22 GLN A 85 4.589 -10.099 -13.575 1.00 24.33 H new ATOM 1342 N GLY A 86 -1.770 -8.666 -11.901 1.00 12.33 N ATOM 1343 CA GLY A 86 -2.766 -9.701 -11.629 1.00 65.11 C ATOM 1344 C GLY A 86 -2.197 -11.122 -11.615 1.00 62.14 C ATOM 1345 O GLY A 86 -1.264 -11.434 -12.356 1.00 74.14 O ATOM 0 H GLY A 86 -1.802 -8.279 -12.844 1.00 12.33 H new ATOM 0 HA2 GLY A 86 -3.233 -9.498 -10.665 1.00 65.11 H new ATOM 0 HA3 GLY A 86 -3.552 -9.642 -12.382 1.00 65.11 H new ATOM 1349 N GLU A 87 -2.756 -11.985 -10.757 1.00 50.01 N ATOM 1350 CA GLU A 87 -2.397 -13.411 -10.738 1.00 4.52 C ATOM 1351 C GLU A 87 -2.694 -14.044 -12.106 1.00 33.32 C ATOM 1352 O GLU A 87 -1.943 -14.882 -12.610 1.00 33.42 O ATOM 1353 CB GLU A 87 -3.188 -14.140 -9.638 1.00 64.22 C ATOM 1354 CG GLU A 87 -2.749 -15.582 -9.391 1.00 24.02 C ATOM 1355 CD GLU A 87 -1.373 -15.676 -8.747 1.00 23.13 C ATOM 1356 OE1 GLU A 87 -1.291 -15.662 -7.500 1.00 23.35 O ATOM 1357 OE2 GLU A 87 -0.366 -15.750 -9.482 1.00 75.20 O ATOM 0 H GLU A 87 -3.459 -11.722 -10.066 1.00 50.01 H new ATOM 0 HA GLU A 87 -1.332 -13.505 -10.527 1.00 4.52 H new ATOM 0 HB2 GLU A 87 -3.092 -13.580 -8.708 1.00 64.22 H new ATOM 0 HB3 GLU A 87 -4.245 -14.136 -9.905 1.00 64.22 H new ATOM 0 HG2 GLU A 87 -3.480 -16.075 -8.750 1.00 24.02 H new ATOM 0 HG3 GLU A 87 -2.740 -16.122 -10.338 1.00 24.02 H new ATOM 1364 N SER A 88 -3.815 -13.635 -12.690 1.00 73.12 N ATOM 1365 CA SER A 88 -4.152 -13.979 -14.073 1.00 25.45 C ATOM 1366 C SER A 88 -3.680 -12.863 -15.012 1.00 44.14 C ATOM 1367 O SER A 88 -4.213 -11.755 -14.985 1.00 2.13 O ATOM 1368 CB SER A 88 -5.668 -14.188 -14.231 1.00 1.31 C ATOM 1369 OG SER A 88 -6.139 -15.238 -13.398 1.00 72.10 O ATOM 0 H SER A 88 -4.515 -13.058 -12.223 1.00 73.12 H new ATOM 0 HA SER A 88 -3.648 -14.910 -14.331 1.00 25.45 H new ATOM 0 HB2 SER A 88 -6.191 -13.264 -13.984 1.00 1.31 H new ATOM 0 HB3 SER A 88 -5.898 -14.417 -15.272 1.00 1.31 H new ATOM 0 HG SER A 88 -7.105 -15.344 -13.521 1.00 72.10 H new ATOM 1375 N ASN A 89 -2.684 -13.160 -15.841 1.00 1.14 N ATOM 1376 CA ASN A 89 -2.073 -12.153 -16.725 1.00 31.41 C ATOM 1377 C ASN A 89 -3.064 -11.612 -17.775 1.00 24.50 C ATOM 1378 O ASN A 89 -2.758 -10.668 -18.503 1.00 63.42 O ATOM 1379 CB ASN A 89 -0.845 -12.752 -17.417 1.00 45.12 C ATOM 1380 CG ASN A 89 -1.190 -13.987 -18.225 1.00 4.25 C ATOM 1381 OD1 ASN A 89 -1.515 -13.902 -19.404 1.00 2.14 O ATOM 1382 ND2 ASN A 89 -1.121 -15.147 -17.605 1.00 75.23 N ATOM 0 H ASN A 89 -2.276 -14.091 -15.925 1.00 1.14 H new ATOM 0 HA ASN A 89 -1.775 -11.309 -16.104 1.00 31.41 H new ATOM 0 HB2 ASN A 89 -0.398 -12.004 -18.072 1.00 45.12 H new ATOM 0 HB3 ASN A 89 -0.096 -13.008 -16.667 1.00 45.12 H new ATOM 0 HD21 ASN A 89 -1.341 -16.007 -18.107 1.00 75.23 H new ATOM 0 HD22 ASN A 89 -0.847 -15.185 -16.623 1.00 75.23 H new ATOM 1389 N ASP A 90 -4.242 -12.224 -17.842 1.00 30.40 N ATOM 1390 CA ASP A 90 -5.303 -11.808 -18.762 1.00 41.31 C ATOM 1391 C ASP A 90 -5.828 -10.396 -18.422 1.00 2.53 C ATOM 1392 O ASP A 90 -5.719 -9.943 -17.280 1.00 32.40 O ATOM 1393 CB ASP A 90 -6.441 -12.829 -18.696 1.00 54.32 C ATOM 1394 CG ASP A 90 -5.931 -14.246 -18.866 1.00 64.15 C ATOM 1395 OD1 ASP A 90 -5.469 -14.838 -17.867 1.00 3.23 O ATOM 1396 OD2 ASP A 90 -5.965 -14.770 -19.998 1.00 44.10 O ATOM 0 H ASP A 90 -4.491 -13.024 -17.260 1.00 30.40 H new ATOM 0 HA ASP A 90 -4.896 -11.766 -19.772 1.00 41.31 H new ATOM 0 HB2 ASP A 90 -6.956 -12.739 -17.739 1.00 54.32 H new ATOM 0 HB3 ASP A 90 -7.173 -12.610 -19.473 1.00 54.32 H new ATOM 1401 N PRO A 91 -6.419 -9.688 -19.411 1.00 54.01 N ATOM 1402 CA PRO A 91 -6.921 -8.312 -19.228 1.00 61.13 C ATOM 1403 C PRO A 91 -7.841 -8.142 -18.000 1.00 23.20 C ATOM 1404 O PRO A 91 -8.860 -8.828 -17.864 1.00 12.50 O ATOM 1405 CB PRO A 91 -7.696 -8.027 -20.531 1.00 5.41 C ATOM 1406 CG PRO A 91 -7.840 -9.353 -21.209 1.00 44.15 C ATOM 1407 CD PRO A 91 -6.644 -10.156 -20.788 1.00 2.32 C ATOM 0 HA PRO A 91 -6.099 -7.621 -19.040 1.00 61.13 H new ATOM 0 HB2 PRO A 91 -8.670 -7.587 -20.320 1.00 5.41 H new ATOM 0 HB3 PRO A 91 -7.157 -7.320 -21.162 1.00 5.41 H new ATOM 0 HG2 PRO A 91 -8.766 -9.846 -20.913 1.00 44.15 H new ATOM 0 HG3 PRO A 91 -7.872 -9.237 -22.292 1.00 44.15 H new ATOM 0 HD2 PRO A 91 -6.840 -11.228 -20.826 1.00 2.32 H new ATOM 0 HD3 PRO A 91 -5.782 -9.967 -21.428 1.00 2.32 H new ATOM 1415 N LEU A 92 -7.466 -7.222 -17.108 1.00 51.42 N ATOM 1416 CA LEU A 92 -8.250 -6.924 -15.900 1.00 2.53 C ATOM 1417 C LEU A 92 -9.100 -5.651 -16.083 1.00 23.55 C ATOM 1418 O LEU A 92 -8.699 -4.727 -16.793 1.00 23.34 O ATOM 1419 CB LEU A 92 -7.314 -6.744 -14.690 1.00 2.12 C ATOM 1420 CG LEU A 92 -6.531 -7.996 -14.261 1.00 14.20 C ATOM 1421 CD1 LEU A 92 -5.554 -7.657 -13.136 1.00 73.41 C ATOM 1422 CD2 LEU A 92 -7.486 -9.105 -13.826 1.00 34.23 C ATOM 0 H LEU A 92 -6.617 -6.664 -17.199 1.00 51.42 H new ATOM 0 HA LEU A 92 -8.920 -7.765 -15.724 1.00 2.53 H new ATOM 0 HB2 LEU A 92 -6.600 -5.953 -14.920 1.00 2.12 H new ATOM 0 HB3 LEU A 92 -7.908 -6.401 -13.843 1.00 2.12 H new ATOM 0 HG LEU A 92 -5.959 -8.353 -15.117 1.00 14.20 H new ATOM 0 HD11 LEU A 92 -5.009 -8.555 -12.845 1.00 73.41 H new ATOM 0 HD12 LEU A 92 -4.850 -6.900 -13.482 1.00 73.41 H new ATOM 0 HD13 LEU A 92 -6.106 -7.274 -12.278 1.00 73.41 H new ATOM 0 HD21 LEU A 92 -6.913 -9.982 -13.526 1.00 34.23 H new ATOM 0 HD22 LEU A 92 -8.086 -8.759 -12.985 1.00 34.23 H new ATOM 0 HD23 LEU A 92 -8.142 -9.367 -14.656 1.00 34.23 H new ATOM 1434 N PRO A 93 -10.285 -5.584 -15.444 1.00 52.13 N ATOM 1435 CA PRO A 93 -11.161 -4.401 -15.523 1.00 0.41 C ATOM 1436 C PRO A 93 -10.642 -3.212 -14.694 1.00 53.51 C ATOM 1437 O PRO A 93 -9.668 -3.334 -13.951 1.00 65.32 O ATOM 1438 CB PRO A 93 -12.489 -4.921 -14.955 1.00 11.44 C ATOM 1439 CG PRO A 93 -12.091 -5.998 -14.002 1.00 13.10 C ATOM 1440 CD PRO A 93 -10.869 -6.650 -14.601 1.00 53.04 C ATOM 0 HA PRO A 93 -11.231 -4.012 -16.539 1.00 0.41 H new ATOM 0 HB2 PRO A 93 -13.042 -4.129 -14.450 1.00 11.44 H new ATOM 0 HB3 PRO A 93 -13.134 -5.308 -15.744 1.00 11.44 H new ATOM 0 HG2 PRO A 93 -11.871 -5.586 -13.017 1.00 13.10 H new ATOM 0 HG3 PRO A 93 -12.896 -6.722 -13.872 1.00 13.10 H new ATOM 0 HD2 PRO A 93 -10.172 -6.979 -13.831 1.00 53.04 H new ATOM 0 HD3 PRO A 93 -11.131 -7.529 -15.190 1.00 53.04 H new ATOM 1448 N ALA A 94 -11.298 -2.060 -14.832 1.00 41.22 N ATOM 1449 CA ALA A 94 -10.933 -0.868 -14.059 1.00 11.41 C ATOM 1450 C ALA A 94 -11.404 -0.990 -12.603 1.00 33.33 C ATOM 1451 O ALA A 94 -12.507 -1.472 -12.334 1.00 11.21 O ATOM 1452 CB ALA A 94 -11.519 0.382 -14.706 1.00 64.45 C ATOM 0 H ALA A 94 -12.083 -1.925 -15.469 1.00 41.22 H new ATOM 0 HA ALA A 94 -9.846 -0.784 -14.056 1.00 11.41 H new ATOM 0 HB1 ALA A 94 -11.240 1.259 -14.122 1.00 64.45 H new ATOM 0 HB2 ALA A 94 -11.131 0.483 -15.720 1.00 64.45 H new ATOM 0 HB3 ALA A 94 -12.605 0.299 -14.740 1.00 64.45 H new ATOM 1458 N PHE A 95 -10.577 -0.534 -11.668 1.00 4.11 N ATOM 1459 CA PHE A 95 -10.856 -0.721 -10.240 1.00 72.33 C ATOM 1460 C PHE A 95 -10.356 0.458 -9.389 1.00 10.45 C ATOM 1461 O PHE A 95 -9.532 1.261 -9.828 1.00 1.23 O ATOM 1462 CB PHE A 95 -10.214 -2.030 -9.750 1.00 50.24 C ATOM 1463 CG PHE A 95 -8.722 -2.104 -9.979 1.00 52.11 C ATOM 1464 CD1 PHE A 95 -8.213 -2.414 -11.234 1.00 71.12 C ATOM 1465 CD2 PHE A 95 -7.827 -1.868 -8.942 1.00 2.11 C ATOM 1466 CE1 PHE A 95 -6.851 -2.485 -11.450 1.00 22.35 C ATOM 1467 CE2 PHE A 95 -6.462 -1.940 -9.156 1.00 42.43 C ATOM 1468 CZ PHE A 95 -5.974 -2.249 -10.412 1.00 33.32 C ATOM 0 H PHE A 95 -9.711 -0.034 -11.867 1.00 4.11 H new ATOM 0 HA PHE A 95 -11.938 -0.771 -10.122 1.00 72.33 H new ATOM 0 HB2 PHE A 95 -10.414 -2.145 -8.685 1.00 50.24 H new ATOM 0 HB3 PHE A 95 -10.691 -2.869 -10.256 1.00 50.24 H new ATOM 0 HD1 PHE A 95 -8.892 -2.602 -12.052 1.00 71.12 H new ATOM 0 HD2 PHE A 95 -8.201 -1.626 -7.958 1.00 2.11 H new ATOM 0 HE1 PHE A 95 -6.472 -2.725 -12.432 1.00 22.35 H new ATOM 0 HE2 PHE A 95 -5.777 -1.755 -8.341 1.00 42.43 H new ATOM 0 HZ PHE A 95 -4.909 -2.305 -10.580 1.00 33.32 H new ATOM 1478 N SER A 96 -10.874 0.555 -8.169 1.00 35.54 N ATOM 1479 CA SER A 96 -10.444 1.576 -7.203 1.00 52.05 C ATOM 1480 C SER A 96 -10.522 1.025 -5.778 1.00 53.22 C ATOM 1481 O SER A 96 -11.334 0.146 -5.492 1.00 2.21 O ATOM 1482 CB SER A 96 -11.306 2.845 -7.322 1.00 34.25 C ATOM 1483 OG SER A 96 -11.186 3.434 -8.611 1.00 4.22 O ATOM 0 H SER A 96 -11.602 -0.067 -7.817 1.00 35.54 H new ATOM 0 HA SER A 96 -9.410 1.839 -7.428 1.00 52.05 H new ATOM 0 HB2 SER A 96 -12.350 2.597 -7.129 1.00 34.25 H new ATOM 0 HB3 SER A 96 -11.004 3.565 -6.562 1.00 34.25 H new ATOM 0 HG SER A 96 -11.176 4.410 -8.525 1.00 4.22 H new ATOM 1489 N GLY A 97 -9.678 1.531 -4.884 1.00 4.33 N ATOM 1490 CA GLY A 97 -9.665 1.029 -3.513 1.00 0.15 C ATOM 1491 C GLY A 97 -9.247 2.070 -2.482 1.00 52.02 C ATOM 1492 O GLY A 97 -8.786 3.154 -2.830 1.00 55.41 O ATOM 0 H GLY A 97 -9.006 2.274 -5.078 1.00 4.33 H new ATOM 0 HA2 GLY A 97 -10.659 0.661 -3.261 1.00 0.15 H new ATOM 0 HA3 GLY A 97 -8.986 0.179 -3.453 1.00 0.15 H new ATOM 1496 N THR A 98 -9.402 1.730 -1.205 1.00 71.42 N ATOM 1497 CA THR A 98 -9.054 2.638 -0.103 1.00 4.31 C ATOM 1498 C THR A 98 -7.749 2.201 0.579 1.00 54.44 C ATOM 1499 O THR A 98 -7.574 1.027 0.909 1.00 64.44 O ATOM 1500 CB THR A 98 -10.179 2.690 0.962 1.00 1.10 C ATOM 1501 OG1 THR A 98 -11.443 2.986 0.344 1.00 44.42 O ATOM 1502 CG2 THR A 98 -9.884 3.743 2.028 1.00 75.13 C ATOM 0 H THR A 98 -9.768 0.828 -0.901 1.00 71.42 H new ATOM 0 HA THR A 98 -8.925 3.629 -0.538 1.00 4.31 H new ATOM 0 HB THR A 98 -10.224 1.711 1.438 1.00 1.10 H new ATOM 0 HG1 THR A 98 -12.143 3.014 1.029 1.00 44.42 H new ATOM 0 HG21 THR A 98 -10.691 3.755 2.760 1.00 75.13 H new ATOM 0 HG22 THR A 98 -8.945 3.503 2.527 1.00 75.13 H new ATOM 0 HG23 THR A 98 -9.805 4.724 1.559 1.00 75.13 H new ATOM 1510 N VAL A 99 -6.835 3.144 0.790 1.00 40.44 N ATOM 1511 CA VAL A 99 -5.552 2.848 1.434 1.00 75.35 C ATOM 1512 C VAL A 99 -5.463 3.478 2.837 1.00 25.32 C ATOM 1513 O VAL A 99 -5.759 4.660 3.021 1.00 52.35 O ATOM 1514 CB VAL A 99 -4.358 3.332 0.564 1.00 34.42 C ATOM 1515 CG1 VAL A 99 -4.411 2.687 -0.818 1.00 60.10 C ATOM 1516 CG2 VAL A 99 -4.329 4.856 0.449 1.00 72.24 C ATOM 0 H VAL A 99 -6.956 4.122 0.525 1.00 40.44 H new ATOM 0 HA VAL A 99 -5.494 1.765 1.538 1.00 75.35 H new ATOM 0 HB VAL A 99 -3.437 3.023 1.059 1.00 34.42 H new ATOM 0 HG11 VAL A 99 -3.568 3.036 -1.415 1.00 60.10 H new ATOM 0 HG12 VAL A 99 -4.359 1.603 -0.716 1.00 60.10 H new ATOM 0 HG13 VAL A 99 -5.343 2.961 -1.312 1.00 60.10 H new ATOM 0 HG21 VAL A 99 -3.481 5.158 -0.166 1.00 72.24 H new ATOM 0 HG22 VAL A 99 -5.254 5.204 -0.011 1.00 72.24 H new ATOM 0 HG23 VAL A 99 -4.231 5.294 1.442 1.00 72.24 H new ATOM 1526 N GLU A 100 -5.074 2.671 3.822 1.00 22.23 N ATOM 1527 CA GLU A 100 -4.911 3.140 5.203 1.00 52.35 C ATOM 1528 C GLU A 100 -3.443 3.458 5.500 1.00 15.23 C ATOM 1529 O GLU A 100 -2.610 2.556 5.553 1.00 64.02 O ATOM 1530 CB GLU A 100 -5.403 2.074 6.198 1.00 41.34 C ATOM 1531 CG GLU A 100 -6.852 1.657 6.005 1.00 55.13 C ATOM 1532 CD GLU A 100 -7.822 2.825 6.088 1.00 2.44 C ATOM 1533 OE1 GLU A 100 -8.005 3.372 7.195 1.00 43.23 O ATOM 1534 OE2 GLU A 100 -8.417 3.178 5.051 1.00 63.10 O ATOM 0 H GLU A 100 -4.864 1.682 3.691 1.00 22.23 H new ATOM 0 HA GLU A 100 -5.506 4.046 5.316 1.00 52.35 H new ATOM 0 HB2 GLU A 100 -4.769 1.192 6.110 1.00 41.34 H new ATOM 0 HB3 GLU A 100 -5.279 2.456 7.211 1.00 41.34 H new ATOM 0 HG2 GLU A 100 -6.959 1.172 5.035 1.00 55.13 H new ATOM 0 HG3 GLU A 100 -7.116 0.918 6.762 1.00 55.13 H new ATOM 1541 N TYR A 101 -3.125 4.731 5.697 1.00 2.51 N ATOM 1542 CA TYR A 101 -1.746 5.130 5.994 1.00 12.13 C ATOM 1543 C TYR A 101 -1.646 5.895 7.321 1.00 3.01 C ATOM 1544 O TYR A 101 -2.273 6.942 7.505 1.00 71.43 O ATOM 1545 CB TYR A 101 -1.150 5.950 4.838 1.00 1.45 C ATOM 1546 CG TYR A 101 -1.902 7.226 4.485 1.00 10.15 C ATOM 1547 CD1 TYR A 101 -3.118 7.181 3.806 1.00 32.24 C ATOM 1548 CD2 TYR A 101 -1.380 8.476 4.806 1.00 65.01 C ATOM 1549 CE1 TYR A 101 -3.784 8.342 3.459 1.00 31.31 C ATOM 1550 CE2 TYR A 101 -2.038 9.639 4.455 1.00 74.41 C ATOM 1551 CZ TYR A 101 -3.240 9.567 3.784 1.00 74.11 C ATOM 1552 OH TYR A 101 -3.891 10.725 3.423 1.00 75.35 O ATOM 0 H TYR A 101 -3.792 5.502 5.658 1.00 2.51 H new ATOM 0 HA TYR A 101 -1.160 4.217 6.102 1.00 12.13 H new ATOM 0 HB2 TYR A 101 -0.123 6.213 5.093 1.00 1.45 H new ATOM 0 HB3 TYR A 101 -1.106 5.317 3.951 1.00 1.45 H new ATOM 0 HD1 TYR A 101 -3.547 6.224 3.547 1.00 32.24 H new ATOM 0 HD2 TYR A 101 -0.443 8.538 5.339 1.00 65.01 H new ATOM 0 HE1 TYR A 101 -4.727 8.290 2.935 1.00 31.31 H new ATOM 0 HE2 TYR A 101 -1.613 10.600 4.705 1.00 74.41 H new ATOM 0 HH TYR A 101 -3.374 11.500 3.729 1.00 75.35 H new ATOM 1562 N GLY A 102 -0.851 5.356 8.243 1.00 33.32 N ATOM 1563 CA GLY A 102 -0.700 5.958 9.564 1.00 14.34 C ATOM 1564 C GLY A 102 0.546 5.482 10.303 1.00 55.41 C ATOM 1565 O GLY A 102 1.560 5.153 9.681 1.00 13.40 O ATOM 0 H GLY A 102 -0.304 4.507 8.100 1.00 33.32 H new ATOM 0 HA2 GLY A 102 -0.660 7.042 9.460 1.00 14.34 H new ATOM 0 HA3 GLY A 102 -1.580 5.728 10.164 1.00 14.34 H new ATOM 1569 N GLN A 103 0.470 5.434 11.633 1.00 61.32 N ATOM 1570 CA GLN A 103 1.625 5.084 12.474 1.00 43.00 C ATOM 1571 C GLN A 103 1.317 3.907 13.418 1.00 14.52 C ATOM 1572 O GLN A 103 0.161 3.633 13.740 1.00 52.25 O ATOM 1573 CB GLN A 103 2.059 6.306 13.298 1.00 30.03 C ATOM 1574 CG GLN A 103 2.501 7.497 12.453 1.00 41.12 C ATOM 1575 CD GLN A 103 2.871 8.703 13.298 1.00 53.30 C ATOM 1576 OE1 GLN A 103 2.322 8.916 14.373 1.00 53.33 O ATOM 1577 NE2 GLN A 103 3.806 9.498 12.825 1.00 13.33 N ATOM 0 H GLN A 103 -0.382 5.633 12.157 1.00 61.32 H new ATOM 0 HA GLN A 103 2.432 4.775 11.810 1.00 43.00 H new ATOM 0 HB2 GLN A 103 1.231 6.614 13.937 1.00 30.03 H new ATOM 0 HB3 GLN A 103 2.878 6.016 13.956 1.00 30.03 H new ATOM 0 HG2 GLN A 103 3.357 7.208 11.843 1.00 41.12 H new ATOM 0 HG3 GLN A 103 1.699 7.770 11.767 1.00 41.12 H new ATOM 0 HE21 GLN A 103 4.244 9.293 11.927 1.00 13.33 H new ATOM 0 HE22 GLN A 103 4.094 10.320 13.356 1.00 13.33 H new ATOM 1586 N ILE A 104 2.370 3.216 13.862 1.00 74.21 N ATOM 1587 CA ILE A 104 2.230 2.081 14.786 1.00 41.34 C ATOM 1588 C ILE A 104 3.016 2.318 16.088 1.00 34.25 C ATOM 1589 O ILE A 104 4.232 2.512 16.065 1.00 64.12 O ATOM 1590 CB ILE A 104 2.724 0.758 14.136 1.00 75.21 C ATOM 1591 CG1 ILE A 104 1.893 0.428 12.883 1.00 42.32 C ATOM 1592 CG2 ILE A 104 2.669 -0.398 15.138 1.00 50.42 C ATOM 1593 CD1 ILE A 104 2.318 -0.845 12.176 1.00 21.32 C ATOM 0 H ILE A 104 3.333 3.422 13.597 1.00 74.21 H new ATOM 0 HA ILE A 104 1.168 1.995 15.017 1.00 41.34 H new ATOM 0 HB ILE A 104 3.763 0.896 13.835 1.00 75.21 H new ATOM 0 HG12 ILE A 104 0.845 0.340 13.168 1.00 42.32 H new ATOM 0 HG13 ILE A 104 1.964 1.261 12.183 1.00 42.32 H new ATOM 0 HG21 ILE A 104 3.020 -1.312 14.659 1.00 50.42 H new ATOM 0 HG22 ILE A 104 3.306 -0.169 15.993 1.00 50.42 H new ATOM 0 HG23 ILE A 104 1.642 -0.537 15.477 1.00 50.42 H new ATOM 0 HD11 ILE A 104 1.684 -1.006 11.304 1.00 21.32 H new ATOM 0 HD12 ILE A 104 3.356 -0.755 11.857 1.00 21.32 H new ATOM 0 HD13 ILE A 104 2.220 -1.690 12.858 1.00 21.32 H new ATOM 1605 N GLN A 105 2.313 2.301 17.220 1.00 73.32 N ATOM 1606 CA GLN A 105 2.950 2.471 18.540 1.00 45.12 C ATOM 1607 C GLN A 105 3.041 1.137 19.303 1.00 52.25 C ATOM 1608 O GLN A 105 3.448 1.100 20.466 1.00 35.41 O ATOM 1609 CB GLN A 105 2.168 3.492 19.379 1.00 52.52 C ATOM 1610 CG GLN A 105 0.708 3.113 19.597 1.00 11.23 C ATOM 1611 CD GLN A 105 -0.028 4.041 20.553 1.00 44.40 C ATOM 1612 OE1 GLN A 105 0.377 5.293 20.611 1.00 64.15 O flip ATOM 1613 NE2 GLN A 105 -0.958 3.631 21.232 1.00 61.21 N flip ATOM 0 H GLN A 105 1.302 2.172 17.257 1.00 73.32 H new ATOM 0 HA GLN A 105 3.963 2.835 18.371 1.00 45.12 H new ATOM 0 HB2 GLN A 105 2.655 3.602 20.348 1.00 52.52 H new ATOM 0 HB3 GLN A 105 2.213 4.464 18.888 1.00 52.52 H new ATOM 0 HG2 GLN A 105 0.194 3.114 18.636 1.00 11.23 H new ATOM 0 HG3 GLN A 105 0.660 2.095 19.983 1.00 11.23 H new ATOM 0 HE21 GLN A 105 -1.248 2.655 21.164 1.00 61.21 H new ATOM 0 HE22 GLN A 105 -1.444 4.265 21.866 1.00 61.21 H new ATOM 1622 N GLY A 106 2.664 0.047 18.639 1.00 73.43 N ATOM 1623 CA GLY A 106 2.667 -1.268 19.277 1.00 3.53 C ATOM 1624 C GLY A 106 3.692 -2.225 18.676 1.00 1.54 C ATOM 1625 O GLY A 106 4.438 -1.861 17.767 1.00 45.23 O ATOM 0 H GLY A 106 2.355 0.047 17.667 1.00 73.43 H new ATOM 0 HA2 GLY A 106 2.872 -1.148 20.341 1.00 3.53 H new ATOM 0 HA3 GLY A 106 1.674 -1.709 19.191 1.00 3.53 H new ATOM 1629 N THR A 107 3.722 -3.458 19.179 1.00 52.43 N ATOM 1630 CA THR A 107 4.660 -4.480 18.685 1.00 32.32 C ATOM 1631 C THR A 107 4.044 -5.291 17.538 1.00 41.45 C ATOM 1632 O THR A 107 2.900 -5.065 17.154 1.00 22.04 O ATOM 1633 CB THR A 107 5.077 -5.460 19.810 1.00 43.35 C ATOM 1634 OG1 THR A 107 3.939 -6.220 20.254 1.00 12.23 O ATOM 1635 CG2 THR A 107 5.684 -4.711 20.992 1.00 2.40 C ATOM 0 H THR A 107 3.110 -3.779 19.929 1.00 52.43 H new ATOM 0 HA THR A 107 5.540 -3.946 18.326 1.00 32.32 H new ATOM 0 HB THR A 107 5.829 -6.136 19.404 1.00 43.35 H new ATOM 0 HG1 THR A 107 4.214 -6.837 20.964 1.00 12.23 H new ATOM 0 HG21 THR A 107 5.968 -5.423 21.767 1.00 2.40 H new ATOM 0 HG22 THR A 107 6.567 -4.164 20.661 1.00 2.40 H new ATOM 0 HG23 THR A 107 4.952 -4.010 21.393 1.00 2.40 H new ATOM 1643 N ILE A 108 4.800 -6.242 16.995 1.00 31.51 N ATOM 1644 CA ILE A 108 4.273 -7.129 15.949 1.00 13.22 C ATOM 1645 C ILE A 108 3.206 -8.075 16.528 1.00 14.13 C ATOM 1646 O ILE A 108 2.300 -8.523 15.823 1.00 53.12 O ATOM 1647 CB ILE A 108 5.404 -7.958 15.285 1.00 63.14 C ATOM 1648 CG1 ILE A 108 6.497 -7.028 14.735 1.00 14.41 C ATOM 1649 CG2 ILE A 108 4.847 -8.846 14.170 1.00 32.54 C ATOM 1650 CD1 ILE A 108 5.991 -6.014 13.728 1.00 74.33 C ATOM 0 H ILE A 108 5.770 -6.421 17.255 1.00 31.51 H new ATOM 0 HA ILE A 108 3.817 -6.499 15.186 1.00 13.22 H new ATOM 0 HB ILE A 108 5.845 -8.603 16.045 1.00 63.14 H new ATOM 0 HG12 ILE A 108 6.962 -6.499 15.567 1.00 14.41 H new ATOM 0 HG13 ILE A 108 7.274 -7.633 14.268 1.00 14.41 H new ATOM 0 HG21 ILE A 108 5.659 -9.417 13.720 1.00 32.54 H new ATOM 0 HG22 ILE A 108 4.108 -9.531 14.585 1.00 32.54 H new ATOM 0 HG23 ILE A 108 4.377 -8.223 13.409 1.00 32.54 H new ATOM 0 HD11 ILE A 108 6.821 -5.395 13.387 1.00 74.33 H new ATOM 0 HD12 ILE A 108 5.552 -6.534 12.877 1.00 74.33 H new ATOM 0 HD13 ILE A 108 5.236 -5.382 14.196 1.00 74.33 H new ATOM 1662 N ASP A 109 3.325 -8.366 17.821 1.00 44.31 N ATOM 1663 CA ASP A 109 2.355 -9.207 18.530 1.00 43.51 C ATOM 1664 C ASP A 109 1.064 -8.432 18.843 1.00 74.32 C ATOM 1665 O ASP A 109 -0.027 -9.003 18.885 1.00 22.14 O ATOM 1666 CB ASP A 109 2.982 -9.730 19.824 1.00 20.33 C ATOM 1667 CG ASP A 109 4.236 -10.540 19.561 1.00 23.23 C ATOM 1668 OD1 ASP A 109 5.317 -9.939 19.390 1.00 31.12 O ATOM 1669 OD2 ASP A 109 4.152 -11.787 19.528 1.00 11.24 O ATOM 0 H ASP A 109 4.090 -8.030 18.406 1.00 44.31 H new ATOM 0 HA ASP A 109 2.091 -10.045 17.885 1.00 43.51 H new ATOM 0 HB2 ASP A 109 3.223 -8.890 20.475 1.00 20.33 H new ATOM 0 HB3 ASP A 109 2.257 -10.347 20.355 1.00 20.33 H new ATOM 1674 N ASN A 110 1.198 -7.128 19.079 1.00 0.14 N ATOM 1675 CA ASN A 110 0.044 -6.257 19.314 1.00 31.42 C ATOM 1676 C ASN A 110 0.328 -4.821 18.843 1.00 13.32 C ATOM 1677 O ASN A 110 0.855 -3.993 19.592 1.00 4.52 O ATOM 1678 CB ASN A 110 -0.372 -6.292 20.798 1.00 61.34 C ATOM 1679 CG ASN A 110 0.787 -6.046 21.749 1.00 41.02 C ATOM 1680 OD1 ASN A 110 0.986 -4.805 22.137 1.00 5.32 O flip ATOM 1681 ND2 ASN A 110 1.494 -6.971 22.144 1.00 30.23 N flip ATOM 0 H ASN A 110 2.098 -6.648 19.113 1.00 0.14 H new ATOM 0 HA ASN A 110 -0.792 -6.633 18.724 1.00 31.42 H new ATOM 0 HB2 ASN A 110 -1.142 -5.540 20.971 1.00 61.34 H new ATOM 0 HB3 ASN A 110 -0.818 -7.261 21.021 1.00 61.34 H new ATOM 0 HD21 ASN A 110 1.314 -7.923 21.825 1.00 30.23 H new ATOM 0 HD22 ASN A 110 2.261 -6.787 22.791 1.00 30.23 H new ATOM 1688 N PHE A 111 0.000 -4.541 17.583 1.00 52.12 N ATOM 1689 CA PHE A 111 0.272 -3.229 16.987 1.00 31.23 C ATOM 1690 C PHE A 111 -0.953 -2.301 17.050 1.00 54.33 C ATOM 1691 O PHE A 111 -2.004 -2.586 16.476 1.00 1.52 O ATOM 1692 CB PHE A 111 0.771 -3.386 15.537 1.00 24.44 C ATOM 1693 CG PHE A 111 -0.083 -4.279 14.664 1.00 53.50 C ATOM 1694 CD1 PHE A 111 0.167 -5.642 14.594 1.00 30.04 C ATOM 1695 CD2 PHE A 111 -1.122 -3.755 13.907 1.00 65.22 C ATOM 1696 CE1 PHE A 111 -0.603 -6.462 13.793 1.00 70.31 C ATOM 1697 CE2 PHE A 111 -1.896 -4.570 13.105 1.00 12.31 C ATOM 1698 CZ PHE A 111 -1.635 -5.926 13.047 1.00 14.51 C ATOM 0 H PHE A 111 -0.454 -5.203 16.953 1.00 52.12 H new ATOM 0 HA PHE A 111 1.059 -2.759 17.577 1.00 31.23 H new ATOM 0 HB2 PHE A 111 0.826 -2.399 15.078 1.00 24.44 H new ATOM 0 HB3 PHE A 111 1.785 -3.785 15.558 1.00 24.44 H new ATOM 0 HD1 PHE A 111 0.974 -6.067 15.173 1.00 30.04 H new ATOM 0 HD2 PHE A 111 -1.328 -2.695 13.946 1.00 65.22 H new ATOM 0 HE1 PHE A 111 -0.399 -7.522 13.750 1.00 70.31 H new ATOM 0 HE2 PHE A 111 -2.703 -4.149 12.524 1.00 12.31 H new ATOM 0 HZ PHE A 111 -2.237 -6.566 12.419 1.00 14.51 H new ATOM 1708 N GLN A 112 -0.810 -1.192 17.770 1.00 51.20 N ATOM 1709 CA GLN A 112 -1.864 -0.179 17.854 1.00 52.05 C ATOM 1710 C GLN A 112 -1.750 0.818 16.692 1.00 11.41 C ATOM 1711 O GLN A 112 -0.790 1.593 16.620 1.00 44.44 O ATOM 1712 CB GLN A 112 -1.774 0.566 19.192 1.00 71.52 C ATOM 1713 CG GLN A 112 -1.855 -0.345 20.410 1.00 42.12 C ATOM 1714 CD GLN A 112 -1.687 0.407 21.720 1.00 63.42 C ATOM 1715 OE1 GLN A 112 -0.580 0.557 22.229 1.00 43.44 O ATOM 1716 NE2 GLN A 112 -2.780 0.890 22.274 1.00 11.52 N ATOM 0 H GLN A 112 0.028 -0.969 18.307 1.00 51.20 H new ATOM 0 HA GLN A 112 -2.829 -0.681 17.788 1.00 52.05 H new ATOM 0 HB2 GLN A 112 -0.836 1.120 19.226 1.00 71.52 H new ATOM 0 HB3 GLN A 112 -2.579 1.299 19.244 1.00 71.52 H new ATOM 0 HG2 GLN A 112 -2.817 -0.858 20.411 1.00 42.12 H new ATOM 0 HG3 GLN A 112 -1.085 -1.113 20.336 1.00 42.12 H new ATOM 0 HE21 GLN A 112 -3.685 0.748 21.825 1.00 11.52 H new ATOM 0 HE22 GLN A 112 -2.722 1.406 23.152 1.00 11.52 H new ATOM 1725 N GLU A 113 -2.723 0.786 15.785 1.00 52.12 N ATOM 1726 CA GLU A 113 -2.724 1.658 14.606 1.00 63.45 C ATOM 1727 C GLU A 113 -3.238 3.067 14.960 1.00 51.54 C ATOM 1728 O GLU A 113 -4.441 3.276 15.147 1.00 4.44 O ATOM 1729 CB GLU A 113 -3.586 1.031 13.495 1.00 14.22 C ATOM 1730 CG GLU A 113 -3.192 -0.407 13.163 1.00 72.32 C ATOM 1731 CD GLU A 113 -4.025 -1.008 12.040 1.00 5.31 C ATOM 1732 OE1 GLU A 113 -5.124 -1.547 12.318 1.00 11.32 O ATOM 1733 OE2 GLU A 113 -3.591 -0.952 10.877 1.00 72.34 O ATOM 0 H GLU A 113 -3.528 0.162 15.842 1.00 52.12 H new ATOM 0 HA GLU A 113 -1.699 1.758 14.248 1.00 63.45 H new ATOM 0 HB2 GLU A 113 -4.632 1.052 13.801 1.00 14.22 H new ATOM 0 HB3 GLU A 113 -3.505 1.640 12.594 1.00 14.22 H new ATOM 0 HG2 GLU A 113 -2.139 -0.434 12.881 1.00 72.32 H new ATOM 0 HG3 GLU A 113 -3.299 -1.022 14.056 1.00 72.32 H new ATOM 1740 N ILE A 114 -2.318 4.026 15.066 1.00 1.34 N ATOM 1741 CA ILE A 114 -2.665 5.406 15.441 1.00 61.33 C ATOM 1742 C ILE A 114 -2.421 6.388 14.283 1.00 35.22 C ATOM 1743 O ILE A 114 -1.561 6.154 13.432 1.00 23.25 O ATOM 1744 CB ILE A 114 -1.854 5.879 16.677 1.00 31.14 C ATOM 1745 CG1 ILE A 114 -0.343 5.848 16.381 1.00 61.40 C ATOM 1746 CG2 ILE A 114 -2.187 5.022 17.897 1.00 62.45 C ATOM 1747 CD1 ILE A 114 0.519 6.400 17.500 1.00 63.35 C ATOM 0 H ILE A 114 -1.323 3.877 14.898 1.00 1.34 H new ATOM 0 HA ILE A 114 -3.727 5.400 15.686 1.00 61.33 H new ATOM 0 HB ILE A 114 -2.134 6.909 16.898 1.00 31.14 H new ATOM 0 HG12 ILE A 114 -0.044 4.819 16.180 1.00 61.40 H new ATOM 0 HG13 ILE A 114 -0.150 6.419 15.473 1.00 61.40 H new ATOM 0 HG21 ILE A 114 -1.609 5.368 18.754 1.00 62.45 H new ATOM 0 HG22 ILE A 114 -3.251 5.104 18.120 1.00 62.45 H new ATOM 0 HG23 ILE A 114 -1.939 3.981 17.689 1.00 62.45 H new ATOM 0 HD11 ILE A 114 1.569 6.342 17.213 1.00 63.35 H new ATOM 0 HD12 ILE A 114 0.251 7.440 17.687 1.00 63.35 H new ATOM 0 HD13 ILE A 114 0.358 5.815 18.406 1.00 63.35 H new ATOM 1759 N ASN A 115 -3.191 7.481 14.254 1.00 40.13 N ATOM 1760 CA ASN A 115 -3.009 8.550 13.256 1.00 32.02 C ATOM 1761 C ASN A 115 -3.138 8.017 11.817 1.00 4.12 C ATOM 1762 O ASN A 115 -2.470 8.496 10.899 1.00 40.14 O ATOM 1763 CB ASN A 115 -1.639 9.222 13.454 1.00 55.11 C ATOM 1764 CG ASN A 115 -1.447 9.755 14.864 1.00 13.24 C ATOM 1765 OD1 ASN A 115 -2.402 10.136 15.535 1.00 40.15 O ATOM 1766 ND2 ASN A 115 -0.214 9.787 15.329 1.00 51.33 N ATOM 0 H ASN A 115 -3.951 7.652 14.912 1.00 40.13 H new ATOM 0 HA ASN A 115 -3.800 9.285 13.405 1.00 32.02 H new ATOM 0 HB2 ASN A 115 -0.850 8.503 13.231 1.00 55.11 H new ATOM 0 HB3 ASN A 115 -1.534 10.041 12.743 1.00 55.11 H new ATOM 0 HD21 ASN A 115 -0.033 10.135 16.270 1.00 51.33 H new ATOM 0 HD22 ASN A 115 0.559 9.463 14.747 1.00 51.33 H new ATOM 1773 N VAL A 116 -4.013 7.033 11.624 1.00 22.33 N ATOM 1774 CA VAL A 116 -4.197 6.411 10.308 1.00 25.32 C ATOM 1775 C VAL A 116 -5.301 7.105 9.480 1.00 73.41 C ATOM 1776 O VAL A 116 -6.474 7.123 9.862 1.00 43.33 O ATOM 1777 CB VAL A 116 -4.506 4.894 10.440 1.00 35.12 C ATOM 1778 CG1 VAL A 116 -5.672 4.647 11.394 1.00 63.13 C ATOM 1779 CG2 VAL A 116 -4.779 4.271 9.068 1.00 1.44 C ATOM 0 H VAL A 116 -4.606 6.647 12.358 1.00 22.33 H new ATOM 0 HA VAL A 116 -3.254 6.534 9.775 1.00 25.32 H new ATOM 0 HB VAL A 116 -3.625 4.411 10.862 1.00 35.12 H new ATOM 0 HG11 VAL A 116 -5.864 3.576 11.465 1.00 63.13 H new ATOM 0 HG12 VAL A 116 -5.424 5.037 12.381 1.00 63.13 H new ATOM 0 HG13 VAL A 116 -6.563 5.151 11.018 1.00 63.13 H new ATOM 0 HG21 VAL A 116 -4.993 3.209 9.187 1.00 1.44 H new ATOM 0 HG22 VAL A 116 -5.635 4.764 8.608 1.00 1.44 H new ATOM 0 HG23 VAL A 116 -3.903 4.396 8.431 1.00 1.44 H new ATOM 1789 N GLN A 117 -4.910 7.687 8.345 1.00 50.54 N ATOM 1790 CA GLN A 117 -5.862 8.317 7.417 1.00 5.13 C ATOM 1791 C GLN A 117 -6.186 7.382 6.241 1.00 63.44 C ATOM 1792 O GLN A 117 -5.544 6.347 6.063 1.00 13.32 O ATOM 1793 CB GLN A 117 -5.316 9.653 6.873 1.00 33.01 C ATOM 1794 CG GLN A 117 -5.125 10.748 7.928 1.00 14.44 C ATOM 1795 CD GLN A 117 -4.006 10.459 8.925 1.00 32.32 C ATOM 1796 OE1 GLN A 117 -2.968 9.770 8.487 1.00 40.32 O flip ATOM 1797 NE2 GLN A 117 -4.069 10.867 10.081 1.00 61.15 N flip ATOM 0 H GLN A 117 -3.937 7.737 8.042 1.00 50.54 H new ATOM 0 HA GLN A 117 -6.775 8.514 7.980 1.00 5.13 H new ATOM 0 HB2 GLN A 117 -4.359 9.467 6.386 1.00 33.01 H new ATOM 0 HB3 GLN A 117 -5.997 10.022 6.106 1.00 33.01 H new ATOM 0 HG2 GLN A 117 -4.914 11.691 7.424 1.00 14.44 H new ATOM 0 HG3 GLN A 117 -6.059 10.880 8.474 1.00 14.44 H new ATOM 0 HE21 GLN A 117 -4.884 11.397 10.391 1.00 61.15 H new ATOM 0 HE22 GLN A 117 -3.307 10.676 10.731 1.00 61.15 H new ATOM 1806 N ASN A 118 -7.162 7.772 5.426 1.00 1.11 N ATOM 1807 CA ASN A 118 -7.606 6.951 4.293 1.00 23.21 C ATOM 1808 C ASN A 118 -7.645 7.758 2.979 1.00 61.42 C ATOM 1809 O ASN A 118 -7.988 8.942 2.968 1.00 11.15 O ATOM 1810 CB ASN A 118 -8.988 6.362 4.600 1.00 33.14 C ATOM 1811 CG ASN A 118 -9.959 7.408 5.116 1.00 10.44 C ATOM 1812 OD1 ASN A 118 -10.078 7.629 6.317 1.00 55.03 O ATOM 1813 ND2 ASN A 118 -10.645 8.074 4.217 1.00 10.32 N ATOM 0 H ASN A 118 -7.665 8.654 5.526 1.00 1.11 H new ATOM 0 HA ASN A 118 -6.886 6.145 4.154 1.00 23.21 H new ATOM 0 HB2 ASN A 118 -9.395 5.906 3.697 1.00 33.14 H new ATOM 0 HB3 ASN A 118 -8.886 5.568 5.340 1.00 33.14 H new ATOM 0 HD21 ASN A 118 -11.300 8.799 4.509 1.00 10.32 H new ATOM 0 HD22 ASN A 118 -10.523 7.866 3.226 1.00 10.32 H new ATOM 1820 N GLN A 119 -7.289 7.106 1.874 1.00 60.03 N ATOM 1821 CA GLN A 119 -7.300 7.747 0.549 1.00 2.50 C ATOM 1822 C GLN A 119 -7.713 6.749 -0.548 1.00 72.23 C ATOM 1823 O GLN A 119 -7.427 5.558 -0.449 1.00 62.25 O ATOM 1824 CB GLN A 119 -5.914 8.334 0.236 1.00 3.35 C ATOM 1825 CG GLN A 119 -5.856 9.104 -1.079 1.00 31.42 C ATOM 1826 CD GLN A 119 -4.471 9.631 -1.411 1.00 33.21 C ATOM 1827 OE1 GLN A 119 -4.097 9.734 -2.574 1.00 71.50 O ATOM 1828 NE2 GLN A 119 -3.706 9.991 -0.399 1.00 11.41 N ATOM 0 H GLN A 119 -6.988 6.132 1.864 1.00 60.03 H new ATOM 0 HA GLN A 119 -8.035 8.552 0.567 1.00 2.50 H new ATOM 0 HB2 GLN A 119 -5.619 8.998 1.049 1.00 3.35 H new ATOM 0 HB3 GLN A 119 -5.185 7.524 0.205 1.00 3.35 H new ATOM 0 HG2 GLN A 119 -6.192 8.454 -1.887 1.00 31.42 H new ATOM 0 HG3 GLN A 119 -6.553 9.941 -1.032 1.00 31.42 H new ATOM 0 HE21 GLN A 119 -4.046 9.893 0.558 1.00 11.41 H new ATOM 0 HE22 GLN A 119 -2.774 10.368 -0.573 1.00 11.41 H new ATOM 1837 N LEU A 120 -8.388 7.235 -1.590 1.00 12.13 N ATOM 1838 CA LEU A 120 -8.832 6.370 -2.695 1.00 62.22 C ATOM 1839 C LEU A 120 -7.811 6.326 -3.846 1.00 44.34 C ATOM 1840 O LEU A 120 -7.410 7.362 -4.381 1.00 54.53 O ATOM 1841 CB LEU A 120 -10.191 6.844 -3.231 1.00 1.54 C ATOM 1842 CG LEU A 120 -11.362 6.754 -2.238 1.00 34.02 C ATOM 1843 CD1 LEU A 120 -12.643 7.308 -2.861 1.00 0.23 C ATOM 1844 CD2 LEU A 120 -11.566 5.311 -1.781 1.00 74.53 C ATOM 0 H LEU A 120 -8.641 8.217 -1.697 1.00 12.13 H new ATOM 0 HA LEU A 120 -8.925 5.361 -2.293 1.00 62.22 H new ATOM 0 HB2 LEU A 120 -10.092 7.880 -3.557 1.00 1.54 H new ATOM 0 HB3 LEU A 120 -10.440 6.255 -4.114 1.00 1.54 H new ATOM 0 HG LEU A 120 -11.119 7.360 -1.365 1.00 34.02 H new ATOM 0 HD11 LEU A 120 -13.459 7.235 -2.142 1.00 0.23 H new ATOM 0 HD12 LEU A 120 -12.493 8.353 -3.134 1.00 0.23 H new ATOM 0 HD13 LEU A 120 -12.893 6.732 -3.752 1.00 0.23 H new ATOM 0 HD21 LEU A 120 -12.398 5.266 -1.079 1.00 74.53 H new ATOM 0 HD22 LEU A 120 -11.785 4.683 -2.645 1.00 74.53 H new ATOM 0 HD23 LEU A 120 -10.660 4.952 -1.293 1.00 74.53 H new ATOM 1856 N ILE A 121 -7.394 5.118 -4.219 1.00 60.44 N ATOM 1857 CA ILE A 121 -6.523 4.915 -5.381 1.00 21.51 C ATOM 1858 C ILE A 121 -7.327 4.409 -6.593 1.00 0.14 C ATOM 1859 O ILE A 121 -7.973 3.361 -6.533 1.00 72.15 O ATOM 1860 CB ILE A 121 -5.368 3.925 -5.067 1.00 55.33 C ATOM 1861 CG1 ILE A 121 -5.908 2.577 -4.546 1.00 20.31 C ATOM 1862 CG2 ILE A 121 -4.410 4.543 -4.052 1.00 51.41 C ATOM 1863 CD1 ILE A 121 -4.835 1.524 -4.336 1.00 65.30 C ATOM 0 H ILE A 121 -7.646 4.258 -3.732 1.00 60.44 H new ATOM 0 HA ILE A 121 -6.087 5.884 -5.624 1.00 21.51 H new ATOM 0 HB ILE A 121 -4.828 3.730 -5.994 1.00 55.33 H new ATOM 0 HG12 ILE A 121 -6.428 2.745 -3.603 1.00 20.31 H new ATOM 0 HG13 ILE A 121 -6.645 2.195 -5.252 1.00 20.31 H new ATOM 0 HG21 ILE A 121 -3.604 3.841 -3.838 1.00 51.41 H new ATOM 0 HG22 ILE A 121 -3.992 5.463 -4.460 1.00 51.41 H new ATOM 0 HG23 ILE A 121 -4.950 4.767 -3.132 1.00 51.41 H new ATOM 0 HD11 ILE A 121 -5.293 0.606 -3.969 1.00 65.30 H new ATOM 0 HD12 ILE A 121 -4.330 1.325 -5.281 1.00 65.30 H new ATOM 0 HD13 ILE A 121 -4.110 1.884 -3.606 1.00 65.30 H new ATOM 1875 N ASN A 122 -7.296 5.167 -7.685 1.00 21.54 N ATOM 1876 CA ASN A 122 -8.066 4.830 -8.888 1.00 44.12 C ATOM 1877 C ASN A 122 -7.153 4.323 -10.018 1.00 3.21 C ATOM 1878 O ASN A 122 -6.235 5.023 -10.452 1.00 12.53 O ATOM 1879 CB ASN A 122 -8.855 6.057 -9.360 1.00 31.12 C ATOM 1880 CG ASN A 122 -9.733 6.632 -8.263 1.00 14.43 C ATOM 1881 OD1 ASN A 122 -10.944 6.127 -8.144 1.00 71.14 O flip ATOM 1882 ND2 ASN A 122 -9.319 7.509 -7.515 1.00 33.40 N flip ATOM 0 H ASN A 122 -6.746 6.022 -7.766 1.00 21.54 H new ATOM 0 HA ASN A 122 -8.758 4.027 -8.633 1.00 44.12 H new ATOM 0 HB2 ASN A 122 -8.160 6.823 -9.705 1.00 31.12 H new ATOM 0 HB3 ASN A 122 -9.476 5.782 -10.213 1.00 31.12 H new ATOM 0 HD21 ASN A 122 -8.376 7.878 -7.635 1.00 33.40 H new ATOM 0 HD22 ASN A 122 -9.917 7.870 -6.772 1.00 33.40 H new ATOM 1889 N ALA A 123 -7.417 3.109 -10.498 1.00 42.33 N ATOM 1890 CA ALA A 123 -6.615 2.501 -11.568 1.00 24.13 C ATOM 1891 C ALA A 123 -7.468 2.203 -12.814 1.00 24.12 C ATOM 1892 O ALA A 123 -8.605 1.728 -12.703 1.00 12.34 O ATOM 1893 CB ALA A 123 -5.951 1.224 -11.060 1.00 54.52 C ATOM 0 H ALA A 123 -8.182 2.522 -10.164 1.00 42.33 H new ATOM 0 HA ALA A 123 -5.845 3.215 -11.860 1.00 24.13 H new ATOM 0 HB1 ALA A 123 -5.358 0.779 -11.859 1.00 54.52 H new ATOM 0 HB2 ALA A 123 -5.303 1.462 -10.217 1.00 54.52 H new ATOM 0 HB3 ALA A 123 -6.717 0.518 -10.741 1.00 54.52 H new ATOM 1899 N PRO A 124 -6.931 2.478 -14.022 1.00 54.40 N ATOM 1900 CA PRO A 124 -7.656 2.253 -15.287 1.00 10.23 C ATOM 1901 C PRO A 124 -7.766 0.765 -15.673 1.00 70.23 C ATOM 1902 O PRO A 124 -7.127 -0.102 -15.070 1.00 14.41 O ATOM 1903 CB PRO A 124 -6.805 3.017 -16.311 1.00 72.51 C ATOM 1904 CG PRO A 124 -5.421 2.976 -15.752 1.00 10.11 C ATOM 1905 CD PRO A 124 -5.579 3.034 -14.251 1.00 54.15 C ATOM 0 HA PRO A 124 -8.691 2.588 -15.223 1.00 10.23 H new ATOM 0 HB2 PRO A 124 -6.850 2.548 -17.294 1.00 72.51 H new ATOM 0 HB3 PRO A 124 -7.154 4.042 -16.431 1.00 72.51 H new ATOM 0 HG2 PRO A 124 -4.904 2.066 -16.055 1.00 10.11 H new ATOM 0 HG3 PRO A 124 -4.828 3.815 -16.115 1.00 10.11 H new ATOM 0 HD2 PRO A 124 -4.813 2.447 -13.744 1.00 54.15 H new ATOM 0 HD3 PRO A 124 -5.497 4.055 -13.878 1.00 54.15 H new ATOM 1913 N ALA A 125 -8.575 0.481 -16.692 1.00 11.13 N ATOM 1914 CA ALA A 125 -8.798 -0.893 -17.153 1.00 13.02 C ATOM 1915 C ALA A 125 -7.521 -1.520 -17.741 1.00 43.05 C ATOM 1916 O ALA A 125 -6.989 -1.052 -18.752 1.00 33.13 O ATOM 1917 CB ALA A 125 -9.927 -0.921 -18.179 1.00 22.44 C ATOM 0 H ALA A 125 -9.091 1.186 -17.218 1.00 11.13 H new ATOM 0 HA ALA A 125 -9.081 -1.491 -16.287 1.00 13.02 H new ATOM 0 HB1 ALA A 125 -10.087 -1.945 -18.517 1.00 22.44 H new ATOM 0 HB2 ALA A 125 -10.842 -0.542 -17.724 1.00 22.44 H new ATOM 0 HB3 ALA A 125 -9.660 -0.296 -19.031 1.00 22.44 H new ATOM 1923 N SER A 126 -7.047 -2.592 -17.109 1.00 44.23 N ATOM 1924 CA SER A 126 -5.837 -3.302 -17.558 1.00 53.23 C ATOM 1925 C SER A 126 -6.152 -4.231 -18.740 1.00 1.13 C ATOM 1926 O SER A 126 -6.014 -5.449 -18.643 1.00 74.43 O ATOM 1927 CB SER A 126 -5.244 -4.122 -16.399 1.00 25.40 C ATOM 1928 OG SER A 126 -4.985 -3.309 -15.265 1.00 25.34 O ATOM 0 H SER A 126 -7.481 -2.995 -16.279 1.00 44.23 H new ATOM 0 HA SER A 126 -5.110 -2.559 -17.885 1.00 53.23 H new ATOM 0 HB2 SER A 126 -5.935 -4.920 -16.126 1.00 25.40 H new ATOM 0 HB3 SER A 126 -4.319 -4.599 -16.725 1.00 25.40 H new ATOM 0 HG SER A 126 -4.611 -3.860 -14.546 1.00 25.34 H new ATOM 1934 N VAL A 127 -6.563 -3.640 -19.858 1.00 72.00 N ATOM 1935 CA VAL A 127 -7.049 -4.402 -21.018 1.00 65.43 C ATOM 1936 C VAL A 127 -5.923 -5.081 -21.821 1.00 1.41 C ATOM 1937 O VAL A 127 -6.193 -5.919 -22.679 1.00 15.22 O ATOM 1938 CB VAL A 127 -7.874 -3.500 -21.972 1.00 10.44 C ATOM 1939 CG1 VAL A 127 -9.107 -2.950 -21.257 1.00 34.31 C ATOM 1940 CG2 VAL A 127 -7.014 -2.364 -22.528 1.00 22.41 C ATOM 0 H VAL A 127 -6.571 -2.629 -19.991 1.00 72.00 H new ATOM 0 HA VAL A 127 -7.680 -5.188 -20.603 1.00 65.43 H new ATOM 0 HB VAL A 127 -8.209 -4.108 -22.812 1.00 10.44 H new ATOM 0 HG11 VAL A 127 -9.674 -2.319 -21.942 1.00 34.31 H new ATOM 0 HG12 VAL A 127 -9.733 -3.777 -20.923 1.00 34.31 H new ATOM 0 HG13 VAL A 127 -8.795 -2.360 -20.395 1.00 34.31 H new ATOM 0 HG21 VAL A 127 -7.615 -1.745 -23.194 1.00 22.41 H new ATOM 0 HG22 VAL A 127 -6.640 -1.754 -21.705 1.00 22.41 H new ATOM 0 HG23 VAL A 127 -6.173 -2.782 -23.081 1.00 22.41 H new ATOM 1950 N LEU A 128 -4.671 -4.729 -21.549 1.00 1.13 N ATOM 1951 CA LEU A 128 -3.535 -5.297 -22.290 1.00 24.03 C ATOM 1952 C LEU A 128 -2.817 -6.383 -21.471 1.00 4.43 C ATOM 1953 O LEU A 128 -2.329 -6.117 -20.372 1.00 45.10 O ATOM 1954 CB LEU A 128 -2.545 -4.185 -22.672 1.00 11.22 C ATOM 1955 CG LEU A 128 -3.140 -3.018 -23.482 1.00 40.12 C ATOM 1956 CD1 LEU A 128 -2.067 -1.981 -23.807 1.00 73.21 C ATOM 1957 CD2 LEU A 128 -3.806 -3.532 -24.756 1.00 72.13 C ATOM 0 H LEU A 128 -4.411 -4.058 -20.826 1.00 1.13 H new ATOM 0 HA LEU A 128 -3.924 -5.761 -23.196 1.00 24.03 H new ATOM 0 HB2 LEU A 128 -2.106 -3.784 -21.759 1.00 11.22 H new ATOM 0 HB3 LEU A 128 -1.733 -4.628 -23.248 1.00 11.22 H new ATOM 0 HG LEU A 128 -3.903 -2.533 -22.873 1.00 40.12 H new ATOM 0 HD11 LEU A 128 -2.510 -1.166 -24.379 1.00 73.21 H new ATOM 0 HD12 LEU A 128 -1.648 -1.588 -22.881 1.00 73.21 H new ATOM 0 HD13 LEU A 128 -1.276 -2.448 -24.393 1.00 73.21 H new ATOM 0 HD21 LEU A 128 -4.220 -2.692 -25.314 1.00 72.13 H new ATOM 0 HD22 LEU A 128 -3.067 -4.047 -25.370 1.00 72.13 H new ATOM 0 HD23 LEU A 128 -4.607 -4.224 -24.494 1.00 72.13 H new ATOM 1969 N ALA A 129 -2.761 -7.605 -22.009 1.00 21.30 N ATOM 1970 CA ALA A 129 -2.062 -8.720 -21.350 1.00 64.30 C ATOM 1971 C ALA A 129 -0.565 -8.762 -21.731 1.00 72.22 C ATOM 1972 O ALA A 129 -0.214 -8.550 -22.893 1.00 0.04 O ATOM 1973 CB ALA A 129 -2.733 -10.043 -21.708 1.00 43.03 C ATOM 0 H ALA A 129 -3.191 -7.851 -22.901 1.00 21.30 H new ATOM 0 HA ALA A 129 -2.125 -8.562 -20.273 1.00 64.30 H new ATOM 0 HB1 ALA A 129 -2.209 -10.862 -21.216 1.00 43.03 H new ATOM 0 HB2 ALA A 129 -3.771 -10.026 -21.377 1.00 43.03 H new ATOM 0 HB3 ALA A 129 -2.699 -10.188 -22.788 1.00 43.03 H new ATOM 1979 N PRO A 130 0.348 -9.042 -20.769 1.00 72.20 N ATOM 1980 CA PRO A 130 0.007 -9.315 -19.356 1.00 72.52 C ATOM 1981 C PRO A 130 -0.479 -8.070 -18.592 1.00 61.33 C ATOM 1982 O PRO A 130 -0.021 -6.951 -18.835 1.00 64.02 O ATOM 1983 CB PRO A 130 1.328 -9.828 -18.768 1.00 35.20 C ATOM 1984 CG PRO A 130 2.383 -9.207 -19.617 1.00 33.10 C ATOM 1985 CD PRO A 130 1.802 -9.130 -21.005 1.00 74.21 C ATOM 0 HA PRO A 130 -0.821 -10.019 -19.275 1.00 72.52 H new ATOM 0 HB2 PRO A 130 1.437 -9.536 -17.723 1.00 35.20 H new ATOM 0 HB3 PRO A 130 1.381 -10.916 -18.802 1.00 35.20 H new ATOM 0 HG2 PRO A 130 2.648 -8.216 -19.249 1.00 33.10 H new ATOM 0 HG3 PRO A 130 3.294 -9.805 -19.607 1.00 33.10 H new ATOM 0 HD2 PRO A 130 2.173 -8.260 -21.547 1.00 74.21 H new ATOM 0 HD3 PRO A 130 2.060 -10.008 -21.597 1.00 74.21 H new ATOM 1993 N SER A 131 -1.412 -8.285 -17.668 1.00 42.23 N ATOM 1994 CA SER A 131 -2.050 -7.194 -16.920 1.00 34.51 C ATOM 1995 C SER A 131 -1.227 -6.739 -15.701 1.00 24.42 C ATOM 1996 O SER A 131 -1.302 -7.329 -14.617 1.00 33.11 O ATOM 1997 CB SER A 131 -3.460 -7.618 -16.477 1.00 62.31 C ATOM 1998 OG SER A 131 -3.435 -8.857 -15.780 1.00 52.04 O ATOM 0 H SER A 131 -1.749 -9.214 -17.414 1.00 42.23 H new ATOM 0 HA SER A 131 -2.111 -6.340 -17.594 1.00 34.51 H new ATOM 0 HB2 SER A 131 -3.889 -6.847 -15.836 1.00 62.31 H new ATOM 0 HB3 SER A 131 -4.107 -7.703 -17.350 1.00 62.31 H new ATOM 0 HG SER A 131 -4.135 -9.445 -16.133 1.00 52.04 H new ATOM 2004 N ASP A 132 -0.428 -5.689 -15.894 1.00 54.23 N ATOM 2005 CA ASP A 132 0.270 -5.023 -14.788 1.00 32.40 C ATOM 2006 C ASP A 132 0.264 -3.492 -14.981 1.00 12.54 C ATOM 2007 O ASP A 132 0.635 -2.983 -16.042 1.00 40.52 O ATOM 2008 CB ASP A 132 1.703 -5.562 -14.634 1.00 11.20 C ATOM 2009 CG ASP A 132 2.571 -5.304 -15.849 1.00 15.14 C ATOM 2010 OD1 ASP A 132 2.443 -6.043 -16.848 1.00 15.34 O ATOM 2011 OD2 ASP A 132 3.394 -4.368 -15.810 1.00 41.24 O ATOM 0 H ASP A 132 -0.246 -5.278 -16.810 1.00 54.23 H new ATOM 0 HA ASP A 132 -0.266 -5.246 -13.865 1.00 32.40 H new ATOM 0 HB2 ASP A 132 2.165 -5.102 -13.761 1.00 11.20 H new ATOM 0 HB3 ASP A 132 1.663 -6.635 -14.445 1.00 11.20 H new ATOM 2016 N VAL A 133 -0.192 -2.769 -13.958 1.00 71.14 N ATOM 2017 CA VAL A 133 -0.358 -1.310 -14.036 1.00 34.35 C ATOM 2018 C VAL A 133 0.239 -0.604 -12.810 1.00 22.43 C ATOM 2019 O VAL A 133 0.107 -1.079 -11.682 1.00 14.44 O ATOM 2020 CB VAL A 133 -1.861 -0.929 -14.149 1.00 13.20 C ATOM 2021 CG1 VAL A 133 -2.057 0.586 -14.161 1.00 52.05 C ATOM 2022 CG2 VAL A 133 -2.486 -1.561 -15.388 1.00 72.54 C ATOM 0 H VAL A 133 -0.456 -3.170 -13.058 1.00 71.14 H new ATOM 0 HA VAL A 133 0.175 -0.981 -14.928 1.00 34.35 H new ATOM 0 HB VAL A 133 -2.367 -1.321 -13.267 1.00 13.20 H new ATOM 0 HG11 VAL A 133 -3.120 0.815 -14.241 1.00 52.05 H new ATOM 0 HG12 VAL A 133 -1.663 1.011 -13.238 1.00 52.05 H new ATOM 0 HG13 VAL A 133 -1.529 1.015 -15.013 1.00 52.05 H new ATOM 0 HG21 VAL A 133 -3.538 -1.282 -15.448 1.00 72.54 H new ATOM 0 HG22 VAL A 133 -1.966 -1.208 -16.278 1.00 72.54 H new ATOM 0 HG23 VAL A 133 -2.402 -2.646 -15.325 1.00 72.54 H new ATOM 2032 N ASP A 134 0.901 0.528 -13.036 1.00 64.52 N ATOM 2033 CA ASP A 134 1.433 1.347 -11.945 1.00 34.42 C ATOM 2034 C ASP A 134 0.725 2.715 -11.887 1.00 45.41 C ATOM 2035 O ASP A 134 0.536 3.382 -12.908 1.00 41.52 O ATOM 2036 CB ASP A 134 2.949 1.518 -12.107 1.00 10.25 C ATOM 2037 CG ASP A 134 3.334 2.263 -13.374 1.00 1.12 C ATOM 2038 OD1 ASP A 134 2.797 1.938 -14.454 1.00 21.45 O ATOM 2039 OD2 ASP A 134 4.193 3.165 -13.296 1.00 54.23 O ATOM 0 H ASP A 134 1.083 0.902 -13.967 1.00 64.52 H new ATOM 0 HA ASP A 134 1.241 0.837 -11.001 1.00 34.42 H new ATOM 0 HB2 ASP A 134 3.342 2.055 -11.244 1.00 10.25 H new ATOM 0 HB3 ASP A 134 3.421 0.535 -12.113 1.00 10.25 H new ATOM 2044 N ILE A 135 0.321 3.124 -10.686 1.00 64.34 N ATOM 2045 CA ILE A 135 -0.398 4.392 -10.493 1.00 54.23 C ATOM 2046 C ILE A 135 0.227 5.229 -9.361 1.00 34.23 C ATOM 2047 O ILE A 135 0.633 4.689 -8.331 1.00 71.43 O ATOM 2048 CB ILE A 135 -1.900 4.144 -10.183 1.00 70.11 C ATOM 2049 CG1 ILE A 135 -2.059 3.178 -8.993 1.00 72.15 C ATOM 2050 CG2 ILE A 135 -2.625 3.603 -11.417 1.00 22.20 C ATOM 2051 CD1 ILE A 135 -3.499 2.928 -8.587 1.00 22.14 C ATOM 0 H ILE A 135 0.478 2.597 -9.827 1.00 64.34 H new ATOM 0 HA ILE A 135 -0.314 4.948 -11.427 1.00 54.23 H new ATOM 0 HB ILE A 135 -2.353 5.098 -9.911 1.00 70.11 H new ATOM 0 HG12 ILE A 135 -1.594 2.226 -9.247 1.00 72.15 H new ATOM 0 HG13 ILE A 135 -1.516 3.580 -8.138 1.00 72.15 H new ATOM 0 HG21 ILE A 135 -3.675 3.436 -11.178 1.00 22.20 H new ATOM 0 HG22 ILE A 135 -2.548 4.325 -12.230 1.00 22.20 H new ATOM 0 HG23 ILE A 135 -2.169 2.662 -11.723 1.00 22.20 H new ATOM 0 HD11 ILE A 135 -3.525 2.238 -7.743 1.00 22.14 H new ATOM 0 HD12 ILE A 135 -3.965 3.871 -8.299 1.00 22.14 H new ATOM 0 HD13 ILE A 135 -4.044 2.495 -9.426 1.00 22.14 H new ATOM 2063 N PRO A 136 0.318 6.564 -9.536 1.00 0.45 N ATOM 2064 CA PRO A 136 0.867 7.460 -8.504 1.00 64.33 C ATOM 2065 C PRO A 136 -0.062 7.591 -7.286 1.00 31.11 C ATOM 2066 O PRO A 136 -1.270 7.371 -7.380 1.00 12.05 O ATOM 2067 CB PRO A 136 1.001 8.803 -9.236 1.00 72.51 C ATOM 2068 CG PRO A 136 -0.033 8.749 -10.308 1.00 21.10 C ATOM 2069 CD PRO A 136 -0.108 7.306 -10.740 1.00 22.50 C ATOM 0 HA PRO A 136 1.807 7.088 -8.097 1.00 64.33 H new ATOM 0 HB2 PRO A 136 0.830 9.642 -8.561 1.00 72.51 H new ATOM 0 HB3 PRO A 136 2.000 8.929 -9.654 1.00 72.51 H new ATOM 0 HG2 PRO A 136 -0.998 9.096 -9.938 1.00 21.10 H new ATOM 0 HG3 PRO A 136 0.238 9.393 -11.144 1.00 21.10 H new ATOM 0 HD2 PRO A 136 -1.117 7.030 -11.045 1.00 22.50 H new ATOM 0 HD3 PRO A 136 0.547 7.106 -11.588 1.00 22.50 H new ATOM 2077 N LEU A 137 0.509 7.946 -6.141 1.00 10.30 N ATOM 2078 CA LEU A 137 -0.257 8.079 -4.899 1.00 32.24 C ATOM 2079 C LEU A 137 0.315 9.223 -4.043 1.00 34.31 C ATOM 2080 O LEU A 137 1.463 9.165 -3.600 1.00 50.12 O ATOM 2081 CB LEU A 137 -0.217 6.746 -4.122 1.00 32.24 C ATOM 2082 CG LEU A 137 -1.431 6.440 -3.220 1.00 74.20 C ATOM 2083 CD1 LEU A 137 -1.232 5.119 -2.478 1.00 20.21 C ATOM 2084 CD2 LEU A 137 -1.701 7.568 -2.230 1.00 75.02 C ATOM 0 H LEU A 137 1.504 8.149 -6.043 1.00 10.30 H new ATOM 0 HA LEU A 137 -1.294 8.317 -5.138 1.00 32.24 H new ATOM 0 HB2 LEU A 137 -0.113 5.934 -4.842 1.00 32.24 H new ATOM 0 HB3 LEU A 137 0.679 6.739 -3.502 1.00 32.24 H new ATOM 0 HG LEU A 137 -2.303 6.353 -3.868 1.00 74.20 H new ATOM 0 HD11 LEU A 137 -2.099 4.922 -1.848 1.00 20.21 H new ATOM 0 HD12 LEU A 137 -1.116 4.310 -3.200 1.00 20.21 H new ATOM 0 HD13 LEU A 137 -0.338 5.182 -1.857 1.00 20.21 H new ATOM 0 HD21 LEU A 137 -2.563 7.313 -1.614 1.00 75.02 H new ATOM 0 HD22 LEU A 137 -0.828 7.709 -1.592 1.00 75.02 H new ATOM 0 HD23 LEU A 137 -1.904 8.490 -2.775 1.00 75.02 H new ATOM 2096 N GLN A 138 -0.490 10.262 -3.814 1.00 40.13 N ATOM 2097 CA GLN A 138 -0.055 11.423 -3.025 1.00 54.10 C ATOM 2098 C GLN A 138 -0.642 11.400 -1.602 1.00 21.01 C ATOM 2099 O GLN A 138 -1.785 11.808 -1.375 1.00 1.01 O ATOM 2100 CB GLN A 138 -0.458 12.727 -3.736 1.00 74.14 C ATOM 2101 CG GLN A 138 -0.057 13.995 -2.982 1.00 2.15 C ATOM 2102 CD GLN A 138 -0.523 15.273 -3.665 1.00 54.40 C ATOM 2103 OE1 GLN A 138 -1.646 15.215 -4.353 1.00 2.22 O flip ATOM 2104 NE2 GLN A 138 0.120 16.313 -3.565 1.00 2.23 N flip ATOM 0 H GLN A 138 -1.447 10.326 -4.162 1.00 40.13 H new ATOM 0 HA GLN A 138 1.030 11.374 -2.939 1.00 54.10 H new ATOM 0 HB2 GLN A 138 -0.002 12.745 -4.726 1.00 74.14 H new ATOM 0 HB3 GLN A 138 -1.538 12.730 -3.883 1.00 74.14 H new ATOM 0 HG2 GLN A 138 -0.472 13.957 -1.975 1.00 2.15 H new ATOM 0 HG3 GLN A 138 1.028 14.021 -2.879 1.00 2.15 H new ATOM 0 HE21 GLN A 138 0.986 16.328 -3.026 1.00 2.23 H new ATOM 0 HE22 GLN A 138 -0.211 17.163 -4.021 1.00 2.23 H new ATOM 2113 N LEU A 139 0.137 10.907 -0.647 1.00 33.10 N ATOM 2114 CA LEU A 139 -0.271 10.907 0.759 1.00 50.12 C ATOM 2115 C LEU A 139 -0.091 12.305 1.364 1.00 1.44 C ATOM 2116 O LEU A 139 0.968 12.914 1.238 1.00 33.43 O ATOM 2117 CB LEU A 139 0.549 9.878 1.547 1.00 23.34 C ATOM 2118 CG LEU A 139 0.438 8.431 1.038 1.00 74.23 C ATOM 2119 CD1 LEU A 139 1.347 7.505 1.840 1.00 25.32 C ATOM 2120 CD2 LEU A 139 -1.007 7.947 1.088 1.00 23.13 C ATOM 0 H LEU A 139 1.057 10.501 -0.817 1.00 33.10 H new ATOM 0 HA LEU A 139 -1.325 10.635 0.818 1.00 50.12 H new ATOM 0 HB2 LEU A 139 1.597 10.176 1.523 1.00 23.34 H new ATOM 0 HB3 LEU A 139 0.233 9.906 2.590 1.00 23.34 H new ATOM 0 HG LEU A 139 0.765 8.412 -0.002 1.00 74.23 H new ATOM 0 HD11 LEU A 139 1.253 6.487 1.463 1.00 25.32 H new ATOM 0 HD12 LEU A 139 2.381 7.834 1.740 1.00 25.32 H new ATOM 0 HD13 LEU A 139 1.058 7.531 2.891 1.00 25.32 H new ATOM 0 HD21 LEU A 139 -1.060 6.921 0.723 1.00 23.13 H new ATOM 0 HD22 LEU A 139 -1.368 7.986 2.116 1.00 23.13 H new ATOM 0 HD23 LEU A 139 -1.627 8.588 0.461 1.00 23.13 H new ATOM 2132 N LYS A 140 -1.127 12.810 2.020 1.00 23.50 N ATOM 2133 CA LYS A 140 -1.123 14.188 2.523 1.00 13.22 C ATOM 2134 C LYS A 140 -1.196 14.236 4.059 1.00 45.24 C ATOM 2135 O LYS A 140 -1.929 13.467 4.682 1.00 25.23 O ATOM 2136 CB LYS A 140 -2.298 14.958 1.904 1.00 22.14 C ATOM 2137 CG LYS A 140 -2.217 15.071 0.378 1.00 14.44 C ATOM 2138 CD LYS A 140 -3.473 15.700 -0.220 1.00 34.01 C ATOM 2139 CE LYS A 140 -4.686 14.780 -0.110 1.00 1.00 C ATOM 2140 NZ LYS A 140 -4.569 13.583 -0.991 1.00 35.30 N ATOM 0 H LYS A 140 -1.983 12.291 2.219 1.00 23.50 H new ATOM 0 HA LYS A 140 -0.183 14.657 2.232 1.00 13.22 H new ATOM 0 HB2 LYS A 140 -3.230 14.462 2.175 1.00 22.14 H new ATOM 0 HB3 LYS A 140 -2.333 15.959 2.333 1.00 22.14 H new ATOM 0 HG2 LYS A 140 -1.348 15.669 0.105 1.00 14.44 H new ATOM 0 HG3 LYS A 140 -2.069 14.080 -0.051 1.00 14.44 H new ATOM 0 HD2 LYS A 140 -3.685 16.640 0.290 1.00 34.01 H new ATOM 0 HD3 LYS A 140 -3.294 15.939 -1.268 1.00 34.01 H new ATOM 0 HE2 LYS A 140 -4.802 14.457 0.925 1.00 1.00 H new ATOM 0 HE3 LYS A 140 -5.586 15.336 -0.373 1.00 1.00 H new ATOM 0 HZ1 LYS A 140 -5.478 13.078 -1.013 1.00 35.30 H new ATOM 0 HZ2 LYS A 140 -4.316 13.884 -1.954 1.00 35.30 H new ATOM 0 HZ3 LYS A 140 -3.831 12.950 -0.621 1.00 35.30 H new ATOM 2154 N GLY A 141 -0.430 15.144 4.658 1.00 24.32 N ATOM 2155 CA GLY A 141 -0.424 15.299 6.111 1.00 70.42 C ATOM 2156 C GLY A 141 0.494 14.311 6.834 1.00 61.22 C ATOM 2157 O GLY A 141 0.339 14.084 8.039 1.00 62.01 O ATOM 0 H GLY A 141 0.193 15.782 4.162 1.00 24.32 H new ATOM 0 HA2 GLY A 141 -0.115 16.315 6.357 1.00 70.42 H new ATOM 0 HA3 GLY A 141 -1.441 15.176 6.484 1.00 70.42 H new ATOM 2161 N ILE A 142 1.462 13.735 6.116 1.00 62.43 N ATOM 2162 CA ILE A 142 2.377 12.746 6.711 1.00 71.42 C ATOM 2163 C ILE A 142 3.675 12.580 5.890 1.00 63.32 C ATOM 2164 O ILE A 142 3.642 12.289 4.693 1.00 60.41 O ATOM 2165 CB ILE A 142 1.676 11.368 6.874 1.00 23.11 C ATOM 2166 CG1 ILE A 142 2.566 10.391 7.662 1.00 73.22 C ATOM 2167 CG2 ILE A 142 1.299 10.783 5.509 1.00 0.01 C ATOM 2168 CD1 ILE A 142 1.858 9.115 8.072 1.00 4.52 C ATOM 0 H ILE A 142 1.635 13.931 5.130 1.00 62.43 H new ATOM 0 HA ILE A 142 2.652 13.128 7.694 1.00 71.42 H new ATOM 0 HB ILE A 142 0.758 11.521 7.441 1.00 23.11 H new ATOM 0 HG12 ILE A 142 3.435 10.135 7.055 1.00 73.22 H new ATOM 0 HG13 ILE A 142 2.938 10.893 8.555 1.00 73.22 H new ATOM 0 HG21 ILE A 142 0.810 9.819 5.649 1.00 0.01 H new ATOM 0 HG22 ILE A 142 0.619 11.464 4.997 1.00 0.01 H new ATOM 0 HG23 ILE A 142 2.199 10.650 4.909 1.00 0.01 H new ATOM 0 HD11 ILE A 142 2.549 8.477 8.623 1.00 4.52 H new ATOM 0 HD12 ILE A 142 1.006 9.359 8.706 1.00 4.52 H new ATOM 0 HD13 ILE A 142 1.510 8.590 7.182 1.00 4.52 H new ATOM 2180 N SER A 143 4.822 12.769 6.544 1.00 14.51 N ATOM 2181 CA SER A 143 6.133 12.588 5.898 1.00 64.12 C ATOM 2182 C SER A 143 6.600 11.124 5.965 1.00 14.44 C ATOM 2183 O SER A 143 6.331 10.422 6.939 1.00 1.22 O ATOM 2184 CB SER A 143 7.187 13.490 6.557 1.00 71.14 C ATOM 2185 OG SER A 143 6.838 14.863 6.450 1.00 72.02 O ATOM 0 H SER A 143 4.875 13.048 7.524 1.00 14.51 H new ATOM 0 HA SER A 143 6.018 12.866 4.850 1.00 64.12 H new ATOM 0 HB2 SER A 143 7.292 13.221 7.608 1.00 71.14 H new ATOM 0 HB3 SER A 143 8.156 13.322 6.087 1.00 71.14 H new ATOM 0 HG SER A 143 7.528 15.410 6.880 1.00 72.02 H new ATOM 2191 N VAL A 144 7.318 10.680 4.932 1.00 25.32 N ATOM 2192 CA VAL A 144 7.805 9.291 4.840 1.00 72.04 C ATOM 2193 C VAL A 144 8.634 8.865 6.074 1.00 32.31 C ATOM 2194 O VAL A 144 8.570 7.714 6.511 1.00 3.20 O ATOM 2195 CB VAL A 144 8.647 9.080 3.553 1.00 22.12 C ATOM 2196 CG1 VAL A 144 9.865 10.003 3.529 1.00 74.35 C ATOM 2197 CG2 VAL A 144 9.065 7.616 3.406 1.00 22.01 C ATOM 0 H VAL A 144 7.580 11.264 4.138 1.00 25.32 H new ATOM 0 HA VAL A 144 6.916 8.661 4.803 1.00 72.04 H new ATOM 0 HB VAL A 144 8.019 9.338 2.700 1.00 22.12 H new ATOM 0 HG11 VAL A 144 10.434 9.831 2.615 1.00 74.35 H new ATOM 0 HG12 VAL A 144 9.535 11.041 3.561 1.00 74.35 H new ATOM 0 HG13 VAL A 144 10.496 9.796 4.394 1.00 74.35 H new ATOM 0 HG21 VAL A 144 9.654 7.495 2.497 1.00 22.01 H new ATOM 0 HG22 VAL A 144 9.664 7.320 4.268 1.00 22.01 H new ATOM 0 HG23 VAL A 144 8.176 6.988 3.349 1.00 22.01 H new ATOM 2207 N ASP A 145 9.405 9.799 6.631 1.00 24.00 N ATOM 2208 CA ASP A 145 10.207 9.532 7.835 1.00 23.10 C ATOM 2209 C ASP A 145 9.312 9.252 9.059 1.00 51.22 C ATOM 2210 O ASP A 145 9.734 8.612 10.025 1.00 64.03 O ATOM 2211 CB ASP A 145 11.131 10.726 8.114 1.00 52.53 C ATOM 2212 CG ASP A 145 11.975 10.529 9.361 1.00 15.04 C ATOM 2213 OD1 ASP A 145 12.991 9.807 9.291 1.00 40.34 O ATOM 2214 OD2 ASP A 145 11.618 11.081 10.421 1.00 10.20 O ATOM 0 H ASP A 145 9.494 10.749 6.271 1.00 24.00 H new ATOM 0 HA ASP A 145 10.808 8.640 7.655 1.00 23.10 H new ATOM 0 HB2 ASP A 145 11.786 10.883 7.257 1.00 52.53 H new ATOM 0 HB3 ASP A 145 10.530 11.628 8.225 1.00 52.53 H new ATOM 2219 N GLN A 146 8.078 9.739 9.003 1.00 64.22 N ATOM 2220 CA GLN A 146 7.114 9.579 10.096 1.00 43.03 C ATOM 2221 C GLN A 146 5.989 8.598 9.718 1.00 40.44 C ATOM 2222 O GLN A 146 5.007 8.458 10.447 1.00 62.03 O ATOM 2223 CB GLN A 146 6.512 10.948 10.446 1.00 40.12 C ATOM 2224 CG GLN A 146 7.541 11.998 10.869 1.00 13.23 C ATOM 2225 CD GLN A 146 8.183 11.695 12.213 1.00 44.50 C ATOM 2226 OE1 GLN A 146 7.669 12.083 13.257 1.00 61.34 O ATOM 2227 NE2 GLN A 146 9.317 11.019 12.204 1.00 75.43 N ATOM 0 H GLN A 146 7.714 10.256 8.202 1.00 64.22 H new ATOM 0 HA GLN A 146 7.639 9.168 10.958 1.00 43.03 H new ATOM 0 HB2 GLN A 146 5.963 11.322 9.582 1.00 40.12 H new ATOM 0 HB3 GLN A 146 5.789 10.819 11.252 1.00 40.12 H new ATOM 0 HG2 GLN A 146 8.319 12.063 10.108 1.00 13.23 H new ATOM 0 HG3 GLN A 146 7.058 12.974 10.916 1.00 13.23 H new ATOM 0 HE21 GLN A 146 9.719 10.710 11.319 1.00 75.43 H new ATOM 0 HE22 GLN A 146 9.791 10.806 13.082 1.00 75.43 H new ATOM 2236 N LEU A 147 6.140 7.919 8.583 1.00 71.12 N ATOM 2237 CA LEU A 147 5.099 7.020 8.066 1.00 25.44 C ATOM 2238 C LEU A 147 5.315 5.579 8.573 1.00 14.12 C ATOM 2239 O LEU A 147 6.392 5.001 8.401 1.00 70.23 O ATOM 2240 CB LEU A 147 5.097 7.059 6.524 1.00 4.43 C ATOM 2241 CG LEU A 147 3.716 6.939 5.841 1.00 61.13 C ATOM 2242 CD1 LEU A 147 3.861 7.036 4.324 1.00 10.51 C ATOM 2243 CD2 LEU A 147 3.002 5.642 6.231 1.00 61.24 C ATOM 0 H LEU A 147 6.974 7.972 7.999 1.00 71.12 H new ATOM 0 HA LEU A 147 4.130 7.360 8.431 1.00 25.44 H new ATOM 0 HB2 LEU A 147 5.557 7.994 6.204 1.00 4.43 H new ATOM 0 HB3 LEU A 147 5.731 6.250 6.160 1.00 4.43 H new ATOM 0 HG LEU A 147 3.102 7.769 6.190 1.00 61.13 H new ATOM 0 HD11 LEU A 147 2.879 6.950 3.858 1.00 10.51 H new ATOM 0 HD12 LEU A 147 4.304 7.997 4.062 1.00 10.51 H new ATOM 0 HD13 LEU A 147 4.504 6.231 3.968 1.00 10.51 H new ATOM 0 HD21 LEU A 147 2.035 5.595 5.731 1.00 61.24 H new ATOM 0 HD22 LEU A 147 3.609 4.788 5.930 1.00 61.24 H new ATOM 0 HD23 LEU A 147 2.854 5.619 7.311 1.00 61.24 H new ATOM 2255 N GLY A 148 4.280 5.009 9.186 1.00 73.13 N ATOM 2256 CA GLY A 148 4.380 3.668 9.755 1.00 32.02 C ATOM 2257 C GLY A 148 3.975 2.557 8.786 1.00 63.25 C ATOM 2258 O GLY A 148 4.795 1.706 8.433 1.00 4.43 O ATOM 0 H GLY A 148 3.368 5.452 9.301 1.00 73.13 H new ATOM 0 HA2 GLY A 148 5.406 3.497 10.081 1.00 32.02 H new ATOM 0 HA3 GLY A 148 3.750 3.612 10.642 1.00 32.02 H new ATOM 2262 N PHE A 149 2.713 2.561 8.349 1.00 64.34 N ATOM 2263 CA PHE A 149 2.188 1.475 7.501 1.00 22.51 C ATOM 2264 C PHE A 149 1.242 1.989 6.402 1.00 30.54 C ATOM 2265 O PHE A 149 0.702 3.093 6.493 1.00 34.22 O ATOM 2266 CB PHE A 149 1.443 0.443 8.366 1.00 44.23 C ATOM 2267 CG PHE A 149 0.154 0.963 8.963 1.00 21.45 C ATOM 2268 CD1 PHE A 149 0.166 1.736 10.118 1.00 44.40 C ATOM 2269 CD2 PHE A 149 -1.071 0.685 8.366 1.00 32.00 C ATOM 2270 CE1 PHE A 149 -1.010 2.216 10.661 1.00 31.05 C ATOM 2271 CE2 PHE A 149 -2.248 1.163 8.907 1.00 4.12 C ATOM 2272 CZ PHE A 149 -2.217 1.932 10.055 1.00 24.51 C ATOM 0 H PHE A 149 2.037 3.294 8.563 1.00 64.34 H new ATOM 0 HA PHE A 149 3.046 1.013 7.013 1.00 22.51 H new ATOM 0 HB2 PHE A 149 1.223 -0.435 7.759 1.00 44.23 H new ATOM 0 HB3 PHE A 149 2.100 0.116 9.172 1.00 44.23 H new ATOM 0 HD1 PHE A 149 1.107 1.964 10.597 1.00 44.40 H new ATOM 0 HD2 PHE A 149 -1.102 0.087 7.467 1.00 32.00 H new ATOM 0 HE1 PHE A 149 -0.985 2.814 11.560 1.00 31.05 H new ATOM 0 HE2 PHE A 149 -3.192 0.936 8.434 1.00 4.12 H new ATOM 0 HZ PHE A 149 -3.136 2.310 10.477 1.00 24.51 H new ATOM 2282 N VAL A 150 1.054 1.164 5.369 1.00 20.31 N ATOM 2283 CA VAL A 150 0.091 1.435 4.292 1.00 21.13 C ATOM 2284 C VAL A 150 -0.725 0.164 3.969 1.00 51.21 C ATOM 2285 O VAL A 150 -0.236 -0.746 3.301 1.00 12.51 O ATOM 2286 CB VAL A 150 0.806 1.931 3.001 1.00 1.52 C ATOM 2287 CG1 VAL A 150 -0.207 2.225 1.895 1.00 25.51 C ATOM 2288 CG2 VAL A 150 1.665 3.165 3.287 1.00 43.54 C ATOM 0 H VAL A 150 1.564 0.288 5.253 1.00 20.31 H new ATOM 0 HA VAL A 150 -0.578 2.221 4.641 1.00 21.13 H new ATOM 0 HB VAL A 150 1.464 1.133 2.658 1.00 1.52 H new ATOM 0 HG11 VAL A 150 0.317 2.570 1.004 1.00 25.51 H new ATOM 0 HG12 VAL A 150 -0.763 1.317 1.660 1.00 25.51 H new ATOM 0 HG13 VAL A 150 -0.899 2.998 2.231 1.00 25.51 H new ATOM 0 HG21 VAL A 150 2.153 3.490 2.368 1.00 43.54 H new ATOM 0 HG22 VAL A 150 1.033 3.968 3.666 1.00 43.54 H new ATOM 0 HG23 VAL A 150 2.422 2.917 4.031 1.00 43.54 H new ATOM 2298 N ARG A 151 -1.961 0.092 4.465 1.00 23.23 N ATOM 2299 CA ARG A 151 -2.814 -1.089 4.260 1.00 61.35 C ATOM 2300 C ARG A 151 -3.805 -0.892 3.097 1.00 51.51 C ATOM 2301 O ARG A 151 -4.688 -0.035 3.156 1.00 34.32 O ATOM 2302 CB ARG A 151 -3.580 -1.422 5.549 1.00 40.33 C ATOM 2303 CG ARG A 151 -4.564 -2.585 5.407 1.00 22.44 C ATOM 2304 CD ARG A 151 -5.256 -2.910 6.730 1.00 51.23 C ATOM 2305 NE ARG A 151 -5.934 -1.746 7.299 1.00 44.41 N ATOM 2306 CZ ARG A 151 -5.982 -1.480 8.580 1.00 53.12 C ATOM 2307 NH1 ARG A 151 -5.452 -2.288 9.443 1.00 60.42 N ATOM 2308 NH2 ARG A 151 -6.579 -0.415 8.996 1.00 54.42 N ATOM 0 H ARG A 151 -2.397 0.835 5.012 1.00 23.23 H new ATOM 0 HA ARG A 151 -2.159 -1.921 3.999 1.00 61.35 H new ATOM 0 HB2 ARG A 151 -2.863 -1.661 6.334 1.00 40.33 H new ATOM 0 HB3 ARG A 151 -4.125 -0.536 5.874 1.00 40.33 H new ATOM 0 HG2 ARG A 151 -5.314 -2.336 4.656 1.00 22.44 H new ATOM 0 HG3 ARG A 151 -4.034 -3.467 5.048 1.00 22.44 H new ATOM 0 HD2 ARG A 151 -5.980 -3.709 6.573 1.00 51.23 H new ATOM 0 HD3 ARG A 151 -4.519 -3.283 7.441 1.00 51.23 H new ATOM 0 HE ARG A 151 -6.398 -1.102 6.659 1.00 44.41 H new ATOM 0 HH11 ARG A 151 -4.991 -3.141 9.127 1.00 60.42 H new ATOM 0 HH12 ARG A 151 -5.495 -2.071 10.439 1.00 60.42 H new ATOM 0 HH21 ARG A 151 -7.014 0.220 8.327 1.00 54.42 H new ATOM 0 HH22 ARG A 151 -6.616 -0.208 9.994 1.00 54.42 H new ATOM 2322 N ILE A 152 -3.666 -1.708 2.056 1.00 25.12 N ATOM 2323 CA ILE A 152 -4.548 -1.642 0.881 1.00 24.35 C ATOM 2324 C ILE A 152 -5.832 -2.470 1.100 1.00 62.53 C ATOM 2325 O ILE A 152 -5.758 -3.631 1.502 1.00 0.12 O ATOM 2326 CB ILE A 152 -3.830 -2.179 -0.386 1.00 1.31 C ATOM 2327 CG1 ILE A 152 -2.412 -1.587 -0.510 1.00 32.02 C ATOM 2328 CG2 ILE A 152 -4.651 -1.878 -1.640 1.00 24.15 C ATOM 2329 CD1 ILE A 152 -2.376 -0.079 -0.642 1.00 64.40 C ATOM 0 H ILE A 152 -2.947 -2.430 1.997 1.00 25.12 H new ATOM 0 HA ILE A 152 -4.809 -0.593 0.740 1.00 24.35 H new ATOM 0 HB ILE A 152 -3.737 -3.261 -0.287 1.00 1.31 H new ATOM 0 HG12 ILE A 152 -1.832 -1.877 0.366 1.00 32.02 H new ATOM 0 HG13 ILE A 152 -1.921 -2.028 -1.378 1.00 32.02 H new ATOM 0 HG21 ILE A 152 -4.130 -2.263 -2.517 1.00 24.15 H new ATOM 0 HG22 ILE A 152 -5.627 -2.356 -1.559 1.00 24.15 H new ATOM 0 HG23 ILE A 152 -4.782 -0.800 -1.739 1.00 24.15 H new ATOM 0 HD11 ILE A 152 -1.342 0.254 -0.724 1.00 64.40 H new ATOM 0 HD12 ILE A 152 -2.926 0.221 -1.534 1.00 64.40 H new ATOM 0 HD13 ILE A 152 -2.835 0.374 0.237 1.00 64.40 H new ATOM 2341 N HIS A 153 -7.003 -1.878 0.836 1.00 2.25 N ATOM 2342 CA HIS A 153 -8.285 -2.598 0.968 1.00 53.32 C ATOM 2343 C HIS A 153 -9.400 -1.929 0.137 1.00 63.22 C ATOM 2344 O HIS A 153 -9.164 -0.918 -0.521 1.00 62.34 O ATOM 2345 CB HIS A 153 -8.707 -2.682 2.447 1.00 72.34 C ATOM 2346 CG HIS A 153 -9.029 -1.355 3.069 1.00 3.53 C ATOM 2347 ND1 HIS A 153 -10.296 -1.005 3.476 1.00 30.42 N ATOM 2348 CD2 HIS A 153 -8.241 -0.295 3.362 1.00 24.14 C ATOM 2349 CE1 HIS A 153 -10.276 0.206 3.990 1.00 23.32 C ATOM 2350 NE2 HIS A 153 -9.044 0.659 3.931 1.00 65.21 N ATOM 0 H HIS A 153 -7.094 -0.909 0.531 1.00 2.25 H new ATOM 0 HA HIS A 153 -8.136 -3.606 0.581 1.00 53.32 H new ATOM 0 HB2 HIS A 153 -9.579 -3.330 2.528 1.00 72.34 H new ATOM 0 HB3 HIS A 153 -7.905 -3.153 3.016 1.00 72.34 H new ATOM 0 HD1 HIS A 153 -11.124 -1.594 3.392 1.00 30.42 H new ATOM 0 HD2 HIS A 153 -7.179 -0.215 3.182 1.00 24.14 H new ATOM 0 HE1 HIS A 153 -11.127 0.737 4.392 1.00 23.32 H new ATOM 0 HE2 HIS A 153 -8.735 1.575 4.257 1.00 65.21 H new ATOM 2359 N ASP A 154 -10.610 -2.506 0.174 1.00 34.10 N ATOM 2360 CA ASP A 154 -11.779 -1.960 -0.548 1.00 55.02 C ATOM 2361 C ASP A 154 -11.561 -1.894 -2.072 1.00 45.55 C ATOM 2362 O ASP A 154 -12.133 -1.036 -2.753 1.00 74.13 O ATOM 2363 CB ASP A 154 -12.154 -0.572 -0.004 1.00 51.11 C ATOM 2364 CG ASP A 154 -12.989 -0.653 1.261 1.00 13.25 C ATOM 2365 OD1 ASP A 154 -12.620 -1.414 2.178 1.00 60.00 O ATOM 2366 OD2 ASP A 154 -14.017 0.049 1.345 1.00 60.30 O ATOM 0 H ASP A 154 -10.810 -3.357 0.699 1.00 34.10 H new ATOM 0 HA ASP A 154 -12.604 -2.651 -0.372 1.00 55.02 H new ATOM 0 HB2 ASP A 154 -11.245 -0.007 0.200 1.00 51.11 H new ATOM 0 HB3 ASP A 154 -12.707 -0.023 -0.766 1.00 51.11 H new ATOM 2371 N ILE A 155 -10.769 -2.823 -2.603 1.00 43.43 N ATOM 2372 CA ILE A 155 -10.516 -2.894 -4.044 1.00 4.54 C ATOM 2373 C ILE A 155 -11.764 -3.396 -4.791 1.00 70.44 C ATOM 2374 O ILE A 155 -12.117 -4.578 -4.731 1.00 43.13 O ATOM 2375 CB ILE A 155 -9.309 -3.815 -4.360 1.00 64.33 C ATOM 2376 CG1 ILE A 155 -8.046 -3.318 -3.635 1.00 21.04 C ATOM 2377 CG2 ILE A 155 -9.063 -3.896 -5.868 1.00 71.55 C ATOM 2378 CD1 ILE A 155 -7.589 -1.936 -4.060 1.00 62.43 C ATOM 0 H ILE A 155 -10.290 -3.539 -2.057 1.00 43.43 H new ATOM 0 HA ILE A 155 -10.278 -1.886 -4.385 1.00 4.54 H new ATOM 0 HB ILE A 155 -9.545 -4.816 -4.000 1.00 64.33 H new ATOM 0 HG12 ILE A 155 -8.236 -3.312 -2.562 1.00 21.04 H new ATOM 0 HG13 ILE A 155 -7.237 -4.026 -3.812 1.00 21.04 H new ATOM 0 HG21 ILE A 155 -8.211 -4.548 -6.063 1.00 71.55 H new ATOM 0 HG22 ILE A 155 -9.948 -4.299 -6.360 1.00 71.55 H new ATOM 0 HG23 ILE A 155 -8.854 -2.899 -6.257 1.00 71.55 H new ATOM 0 HD11 ILE A 155 -6.694 -1.661 -3.502 1.00 62.43 H new ATOM 0 HD12 ILE A 155 -7.365 -1.939 -5.127 1.00 62.43 H new ATOM 0 HD13 ILE A 155 -8.379 -1.213 -3.857 1.00 62.43 H new ATOM 2390 N GLN A 156 -12.430 -2.478 -5.482 1.00 42.13 N ATOM 2391 CA GLN A 156 -13.708 -2.762 -6.144 1.00 22.13 C ATOM 2392 C GLN A 156 -13.705 -2.308 -7.614 1.00 70.43 C ATOM 2393 O GLN A 156 -13.033 -1.338 -7.968 1.00 53.24 O ATOM 2394 CB GLN A 156 -14.829 -2.051 -5.379 1.00 73.53 C ATOM 2395 CG GLN A 156 -14.624 -0.543 -5.266 1.00 32.25 C ATOM 2396 CD GLN A 156 -15.474 0.087 -4.178 1.00 33.15 C ATOM 2397 OE1 GLN A 156 -16.598 0.513 -4.413 1.00 70.21 O ATOM 2398 NE2 GLN A 156 -14.943 0.146 -2.975 1.00 33.51 N ATOM 0 H GLN A 156 -12.105 -1.519 -5.602 1.00 42.13 H new ATOM 0 HA GLN A 156 -13.868 -3.840 -6.138 1.00 22.13 H new ATOM 0 HB2 GLN A 156 -15.779 -2.245 -5.878 1.00 73.53 H new ATOM 0 HB3 GLN A 156 -14.902 -2.476 -4.378 1.00 73.53 H new ATOM 0 HG2 GLN A 156 -13.573 -0.338 -5.064 1.00 32.25 H new ATOM 0 HG3 GLN A 156 -14.861 -0.076 -6.222 1.00 32.25 H new ATOM 0 HE21 GLN A 156 -14.004 -0.218 -2.814 1.00 33.51 H new ATOM 0 HE22 GLN A 156 -15.471 0.556 -2.204 1.00 33.51 H new ATOM 2407 N PRO A 157 -14.460 -3.003 -8.490 1.00 0.34 N ATOM 2408 CA PRO A 157 -14.580 -2.626 -9.909 1.00 60.11 C ATOM 2409 C PRO A 157 -15.407 -1.342 -10.114 1.00 24.43 C ATOM 2410 O PRO A 157 -16.454 -1.154 -9.487 1.00 70.14 O ATOM 2411 CB PRO A 157 -15.293 -3.834 -10.559 1.00 65.05 C ATOM 2412 CG PRO A 157 -15.306 -4.909 -9.516 1.00 74.53 C ATOM 2413 CD PRO A 157 -15.249 -4.208 -8.185 1.00 20.53 C ATOM 0 HA PRO A 157 -13.605 -2.409 -10.345 1.00 60.11 H new ATOM 0 HB2 PRO A 157 -16.306 -3.572 -10.864 1.00 65.05 H new ATOM 0 HB3 PRO A 157 -14.766 -4.164 -11.454 1.00 65.05 H new ATOM 0 HG2 PRO A 157 -16.207 -5.518 -9.596 1.00 74.53 H new ATOM 0 HG3 PRO A 157 -14.456 -5.580 -9.639 1.00 74.53 H new ATOM 0 HD2 PRO A 157 -16.244 -3.958 -7.815 1.00 20.53 H new ATOM 0 HD3 PRO A 157 -14.771 -4.823 -7.423 1.00 20.53 H new ATOM 2421 N VAL A 158 -14.932 -0.460 -10.992 1.00 32.01 N ATOM 2422 CA VAL A 158 -15.662 0.771 -11.318 1.00 52.34 C ATOM 2423 C VAL A 158 -16.463 0.601 -12.621 1.00 55.21 C ATOM 2424 O VAL A 158 -16.108 -0.210 -13.479 1.00 3.33 O ATOM 2425 CB VAL A 158 -14.712 1.989 -11.446 1.00 21.00 C ATOM 2426 CG1 VAL A 158 -13.903 2.182 -10.163 1.00 31.13 C ATOM 2427 CG2 VAL A 158 -13.793 1.841 -12.654 1.00 52.11 C ATOM 0 H VAL A 158 -14.049 -0.571 -11.490 1.00 32.01 H new ATOM 0 HA VAL A 158 -16.349 0.961 -10.494 1.00 52.34 H new ATOM 0 HB VAL A 158 -15.322 2.879 -11.598 1.00 21.00 H new ATOM 0 HG11 VAL A 158 -13.243 3.042 -10.275 1.00 31.13 H new ATOM 0 HG12 VAL A 158 -14.582 2.352 -9.327 1.00 31.13 H new ATOM 0 HG13 VAL A 158 -13.307 1.290 -9.971 1.00 31.13 H new ATOM 0 HG21 VAL A 158 -13.137 2.709 -12.721 1.00 52.11 H new ATOM 0 HG22 VAL A 158 -13.191 0.939 -12.545 1.00 52.11 H new ATOM 0 HG23 VAL A 158 -14.393 1.769 -13.561 1.00 52.11 H new ATOM 2437 N MET A 159 -17.543 1.366 -12.765 1.00 3.02 N ATOM 2438 CA MET A 159 -18.427 1.237 -13.933 1.00 30.54 C ATOM 2439 C MET A 159 -19.404 2.416 -14.047 1.00 60.31 C ATOM 2440 O MET A 159 -19.648 3.137 -13.076 1.00 51.34 O ATOM 2441 CB MET A 159 -19.225 -0.076 -13.844 1.00 23.24 C ATOM 2442 CG MET A 159 -20.127 -0.163 -12.616 1.00 74.01 C ATOM 2443 SD MET A 159 -21.040 -1.717 -12.524 1.00 54.03 S ATOM 2444 CE MET A 159 -19.700 -2.900 -12.402 1.00 61.23 C ATOM 0 H MET A 159 -17.830 2.079 -12.095 1.00 3.02 H new ATOM 0 HA MET A 159 -17.795 1.234 -14.821 1.00 30.54 H new ATOM 0 HB2 MET A 159 -19.836 -0.181 -14.741 1.00 23.24 H new ATOM 0 HB3 MET A 159 -18.528 -0.914 -13.832 1.00 23.24 H new ATOM 0 HG2 MET A 159 -19.521 -0.050 -11.717 1.00 74.01 H new ATOM 0 HG3 MET A 159 -20.833 0.667 -12.631 1.00 74.01 H new ATOM 0 HE1 MET A 159 -20.077 -3.836 -11.990 1.00 61.23 H new ATOM 0 HE2 MET A 159 -19.284 -3.082 -13.393 1.00 61.23 H new ATOM 0 HE3 MET A 159 -18.923 -2.503 -11.749 1.00 61.23 H new ATOM 2454 N GLN A 160 -19.962 2.606 -15.241 1.00 53.44 N ATOM 2455 CA GLN A 160 -21.044 3.570 -15.439 1.00 14.40 C ATOM 2456 C GLN A 160 -22.366 2.959 -14.948 1.00 63.54 C ATOM 2457 O GLN A 160 -22.817 1.935 -15.468 1.00 4.25 O ATOM 2458 CB GLN A 160 -21.141 3.973 -16.920 1.00 33.30 C ATOM 2459 CG GLN A 160 -22.209 5.025 -17.210 1.00 75.41 C ATOM 2460 CD GLN A 160 -22.174 5.522 -18.647 1.00 3.14 C ATOM 2461 OE1 GLN A 160 -21.794 4.798 -19.562 1.00 15.30 O ATOM 2462 NE2 GLN A 160 -22.564 6.762 -18.855 1.00 4.13 N ATOM 0 H GLN A 160 -19.684 2.106 -16.085 1.00 53.44 H new ATOM 0 HA GLN A 160 -20.836 4.471 -14.863 1.00 14.40 H new ATOM 0 HB2 GLN A 160 -20.173 4.354 -17.246 1.00 33.30 H new ATOM 0 HB3 GLN A 160 -21.351 3.084 -17.515 1.00 33.30 H new ATOM 0 HG2 GLN A 160 -23.193 4.605 -17.000 1.00 75.41 H new ATOM 0 HG3 GLN A 160 -22.073 5.870 -16.535 1.00 75.41 H new ATOM 0 HE21 GLN A 160 -22.874 7.337 -18.072 1.00 4.13 H new ATOM 0 HE22 GLN A 160 -22.556 7.148 -19.799 1.00 4.13 H new ATOM 2471 N LEU A 161 -22.972 3.587 -13.944 1.00 64.13 N ATOM 2472 CA LEU A 161 -24.111 2.997 -13.225 1.00 51.52 C ATOM 2473 C LEU A 161 -25.302 2.662 -14.145 1.00 4.42 C ATOM 2474 O LEU A 161 -25.722 3.475 -14.973 1.00 15.21 O ATOM 2475 CB LEU A 161 -24.565 3.937 -12.099 1.00 2.21 C ATOM 2476 CG LEU A 161 -25.682 3.385 -11.191 1.00 52.44 C ATOM 2477 CD1 LEU A 161 -25.246 2.089 -10.506 1.00 63.55 C ATOM 2478 CD2 LEU A 161 -26.096 4.425 -10.152 1.00 44.13 C ATOM 0 H LEU A 161 -22.696 4.508 -13.605 1.00 64.13 H new ATOM 0 HA LEU A 161 -23.763 2.052 -12.807 1.00 51.52 H new ATOM 0 HB2 LEU A 161 -23.701 4.178 -11.479 1.00 2.21 H new ATOM 0 HB3 LEU A 161 -24.909 4.871 -12.544 1.00 2.21 H new ATOM 0 HG LEU A 161 -26.544 3.161 -11.820 1.00 52.44 H new ATOM 0 HD11 LEU A 161 -26.054 1.723 -9.872 1.00 63.55 H new ATOM 0 HD12 LEU A 161 -25.010 1.340 -11.262 1.00 63.55 H new ATOM 0 HD13 LEU A 161 -24.363 2.279 -9.895 1.00 63.55 H new ATOM 0 HD21 LEU A 161 -26.885 4.015 -9.522 1.00 44.13 H new ATOM 0 HD22 LEU A 161 -25.236 4.685 -9.534 1.00 44.13 H new ATOM 0 HD23 LEU A 161 -26.462 5.318 -10.658 1.00 44.13 H new ATOM 2490 N GLU A 162 -25.843 1.454 -13.980 1.00 25.14 N ATOM 2491 CA GLU A 162 -27.032 1.012 -14.721 1.00 71.53 C ATOM 2492 C GLU A 162 -28.195 0.699 -13.767 1.00 53.54 C ATOM 2493 O GLU A 162 -28.071 0.845 -12.550 1.00 33.21 O ATOM 2494 CB GLU A 162 -26.705 -0.219 -15.580 1.00 23.05 C ATOM 2495 CG GLU A 162 -25.797 0.088 -16.769 1.00 44.35 C ATOM 2496 CD GLU A 162 -25.513 -1.128 -17.639 1.00 54.42 C ATOM 2497 OE1 GLU A 162 -26.479 -1.812 -18.045 1.00 42.44 O ATOM 2498 OE2 GLU A 162 -24.324 -1.405 -17.920 1.00 50.12 O ATOM 0 H GLU A 162 -25.474 0.756 -13.334 1.00 25.14 H new ATOM 0 HA GLU A 162 -27.339 1.827 -15.376 1.00 71.53 H new ATOM 0 HB2 GLU A 162 -26.227 -0.972 -14.954 1.00 23.05 H new ATOM 0 HB3 GLU A 162 -27.635 -0.653 -15.947 1.00 23.05 H new ATOM 0 HG2 GLU A 162 -26.260 0.863 -17.380 1.00 44.35 H new ATOM 0 HG3 GLU A 162 -24.853 0.492 -16.402 1.00 44.35 H new ATOM 2505 N HIS A 163 -29.321 0.254 -14.323 1.00 10.13 N ATOM 2506 CA HIS A 163 -30.529 -0.002 -13.526 1.00 24.12 C ATOM 2507 C HIS A 163 -31.018 -1.450 -13.690 1.00 20.05 C ATOM 2508 O HIS A 163 -30.858 -2.054 -14.751 1.00 31.23 O ATOM 2509 CB HIS A 163 -31.641 0.998 -13.897 1.00 2.30 C ATOM 2510 CG HIS A 163 -32.003 1.024 -15.358 1.00 15.34 C ATOM 2511 ND1 HIS A 163 -31.229 1.122 -16.468 1.00 73.13 N flip ATOM 2512 CD2 HIS A 163 -33.303 0.981 -15.813 1.00 72.53 C flip ATOM 2513 CE1 HIS A 163 -32.070 1.136 -17.551 1.00 14.11 C flip ATOM 2514 NE2 HIS A 163 -33.312 1.049 -17.130 1.00 5.24 N flip ATOM 0 H HIS A 163 -29.426 0.062 -15.319 1.00 10.13 H new ATOM 0 HA HIS A 163 -30.272 0.138 -12.476 1.00 24.12 H new ATOM 0 HB2 HIS A 163 -32.534 0.758 -13.320 1.00 2.30 H new ATOM 0 HB3 HIS A 163 -31.327 1.998 -13.597 1.00 2.30 H new ATOM 0 HD2 HIS A 163 -34.180 0.904 -15.187 1.00 72.53 H new ATOM 0 HE1 HIS A 163 -31.761 1.207 -18.584 1.00 14.11 H new ATOM 0 HE2 HIS A 163 -34.143 1.036 -17.722 1.00 5.24 H new ATOM 2523 N HIS A 164 -31.626 -1.996 -12.635 1.00 52.20 N ATOM 2524 CA HIS A 164 -32.014 -3.412 -12.609 1.00 74.02 C ATOM 2525 C HIS A 164 -33.304 -3.626 -11.792 1.00 0.14 C ATOM 2526 O HIS A 164 -33.456 -3.073 -10.701 1.00 4.04 O ATOM 2527 CB HIS A 164 -30.856 -4.238 -12.017 1.00 60.31 C ATOM 2528 CG HIS A 164 -31.005 -5.725 -12.157 1.00 51.13 C ATOM 2529 ND1 HIS A 164 -30.596 -6.424 -13.270 1.00 24.04 N ATOM 2530 CD2 HIS A 164 -31.500 -6.650 -11.303 1.00 62.32 C ATOM 2531 CE1 HIS A 164 -30.829 -7.707 -13.097 1.00 3.13 C ATOM 2532 NE2 HIS A 164 -31.376 -7.873 -11.913 1.00 2.04 N ATOM 0 H HIS A 164 -31.861 -1.481 -11.786 1.00 52.20 H new ATOM 0 HA HIS A 164 -32.218 -3.741 -13.628 1.00 74.02 H new ATOM 0 HB2 HIS A 164 -29.928 -3.933 -12.500 1.00 60.31 H new ATOM 0 HB3 HIS A 164 -30.759 -3.995 -10.959 1.00 60.31 H new ATOM 0 HD2 HIS A 164 -31.915 -6.461 -10.324 1.00 62.32 H new ATOM 0 HE1 HIS A 164 -30.609 -8.491 -13.807 1.00 3.13 H new ATOM 0 HE2 HIS A 164 -31.662 -8.766 -11.513 1.00 2.04 H new ATOM 2541 N HIS A 165 -34.232 -4.422 -12.327 1.00 71.43 N ATOM 2542 CA HIS A 165 -35.490 -4.737 -11.628 1.00 54.41 C ATOM 2543 C HIS A 165 -36.039 -6.122 -12.037 1.00 33.13 C ATOM 2544 O HIS A 165 -36.117 -6.444 -13.223 1.00 4.14 O ATOM 2545 CB HIS A 165 -36.547 -3.651 -11.902 1.00 24.51 C ATOM 2546 CG HIS A 165 -36.990 -3.564 -13.335 1.00 54.42 C ATOM 2547 ND1 HIS A 165 -38.012 -4.333 -13.851 1.00 54.22 N ATOM 2548 CD2 HIS A 165 -36.553 -2.793 -14.362 1.00 71.41 C ATOM 2549 CE1 HIS A 165 -38.184 -4.043 -15.123 1.00 23.22 C ATOM 2550 NE2 HIS A 165 -37.315 -3.113 -15.460 1.00 10.51 N ATOM 0 H HIS A 165 -34.141 -4.863 -13.242 1.00 71.43 H new ATOM 0 HA HIS A 165 -35.271 -4.763 -10.560 1.00 54.41 H new ATOM 0 HB2 HIS A 165 -37.418 -3.843 -11.276 1.00 24.51 H new ATOM 0 HB3 HIS A 165 -36.144 -2.684 -11.600 1.00 24.51 H new ATOM 0 HD2 HIS A 165 -35.756 -2.065 -14.324 1.00 71.41 H new ATOM 0 HE1 HIS A 165 -38.915 -4.492 -15.780 1.00 23.22 H new ATOM 0 HE2 HIS A 165 -37.222 -2.697 -16.387 1.00 10.51 H new ATOM 2559 N HIS A 166 -36.424 -6.934 -11.053 1.00 64.31 N ATOM 2560 CA HIS A 166 -36.979 -8.274 -11.321 1.00 13.15 C ATOM 2561 C HIS A 166 -38.435 -8.386 -10.838 1.00 61.25 C ATOM 2562 O HIS A 166 -38.892 -7.586 -10.021 1.00 4.31 O ATOM 2563 CB HIS A 166 -36.116 -9.356 -10.652 1.00 61.40 C ATOM 2564 CG HIS A 166 -36.035 -9.239 -9.156 1.00 21.55 C ATOM 2565 ND1 HIS A 166 -34.997 -8.613 -8.501 1.00 34.34 N ATOM 2566 CD2 HIS A 166 -36.869 -9.684 -8.183 1.00 14.13 C ATOM 2567 CE1 HIS A 166 -35.192 -8.682 -7.199 1.00 52.31 C ATOM 2568 NE2 HIS A 166 -36.318 -9.325 -6.981 1.00 44.51 N ATOM 0 H HIS A 166 -36.365 -6.695 -10.063 1.00 64.31 H new ATOM 0 HA HIS A 166 -36.969 -8.427 -12.400 1.00 13.15 H new ATOM 0 HB2 HIS A 166 -36.519 -10.336 -10.908 1.00 61.40 H new ATOM 0 HB3 HIS A 166 -35.108 -9.308 -11.064 1.00 61.40 H new ATOM 0 HD2 HIS A 166 -37.795 -10.221 -8.329 1.00 14.13 H new ATOM 0 HE1 HIS A 166 -34.538 -8.279 -6.440 1.00 52.31 H new ATOM 0 HE2 HIS A 166 -36.717 -9.525 -6.064 1.00 44.51 H new ATOM 2577 N HIS A 167 -39.160 -9.381 -11.343 1.00 4.20 N ATOM 2578 CA HIS A 167 -40.559 -9.599 -10.945 1.00 70.11 C ATOM 2579 C HIS A 167 -40.666 -10.494 -9.697 1.00 3.45 C ATOM 2580 O HIS A 167 -41.409 -10.188 -8.762 1.00 34.44 O ATOM 2581 CB HIS A 167 -41.359 -10.214 -12.103 1.00 34.45 C ATOM 2582 CG HIS A 167 -41.494 -9.306 -13.292 1.00 74.11 C ATOM 2583 ND1 HIS A 167 -41.262 -9.716 -14.587 1.00 71.21 N ATOM 2584 CD2 HIS A 167 -41.860 -8.005 -13.379 1.00 1.03 C ATOM 2585 CE1 HIS A 167 -41.477 -8.714 -15.413 1.00 45.42 C ATOM 2586 NE2 HIS A 167 -41.841 -7.665 -14.709 1.00 43.52 N ATOM 0 H HIS A 167 -38.808 -10.051 -12.027 1.00 4.20 H new ATOM 0 HA HIS A 167 -40.981 -8.625 -10.695 1.00 70.11 H new ATOM 0 HB2 HIS A 167 -40.875 -11.139 -12.416 1.00 34.45 H new ATOM 0 HB3 HIS A 167 -42.354 -10.480 -11.745 1.00 34.45 H new ATOM 0 HD2 HIS A 167 -42.119 -7.356 -12.556 1.00 1.03 H new ATOM 0 HE1 HIS A 167 -41.372 -8.748 -16.487 1.00 45.42 H new ATOM 0 HE2 HIS A 167 -42.072 -6.747 -15.089 1.00 43.52 H new ATOM 2595 N HIS A 168 -39.930 -11.604 -9.689 1.00 74.41 N ATOM 2596 CA HIS A 168 -39.956 -12.550 -8.562 1.00 4.05 C ATOM 2597 C HIS A 168 -38.597 -12.599 -7.831 1.00 70.51 C ATOM 2598 O HIS A 168 -38.482 -12.003 -6.738 1.00 37.43 O ATOM 2599 CB HIS A 168 -40.343 -13.950 -9.061 1.00 2.00 C ATOM 2600 CG HIS A 168 -40.539 -14.947 -7.958 1.00 52.52 C ATOM 2601 ND1 HIS A 168 -39.495 -15.505 -7.258 1.00 1.23 N ATOM 2602 CD2 HIS A 168 -41.667 -15.481 -7.432 1.00 42.33 C ATOM 2603 CE1 HIS A 168 -39.966 -16.337 -6.354 1.00 54.24 C ATOM 2604 NE2 HIS A 168 -41.282 -16.345 -6.436 1.00 71.41 N ATOM 2605 OXT HIS A 168 -37.654 -13.234 -8.353 1.00 37.43 O ATOM 0 H HIS A 168 -39.306 -11.875 -10.449 1.00 74.41 H new ATOM 0 HA HIS A 168 -40.703 -12.203 -7.848 1.00 4.05 H new ATOM 0 HB2 HIS A 168 -41.262 -13.878 -9.642 1.00 2.00 H new ATOM 0 HB3 HIS A 168 -39.567 -14.314 -9.735 1.00 2.00 H new ATOM 0 HD2 HIS A 168 -42.680 -15.267 -7.739 1.00 42.33 H new ATOM 0 HE1 HIS A 168 -39.374 -16.916 -5.661 1.00 54.24 H new ATOM 0 HE2 HIS A 168 -41.910 -16.901 -5.856 1.00 71.41 H new TER 2614 HIS A 168