USER MOD reduce.3.24.130724 H: found=0, std=0, add=1236, rem=0, adj=42 USER MOD reduce.3.24.130724 removed 1236 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 165 GLN :FLIP amide:sc= -0.138 F(o=-1.1,f=0.62) USER MOD Set 1.2: A 167 SER OG : rot -17:sc= 0.754 USER MOD Set 2.1: A 111 GLN : amide:sc= 0.104 X(o=-0.89,f=-0.59) USER MOD Set 2.2: A 113 GLN : amide:sc= -0.508 K(o=-0.89,f=-2.7) USER MOD Set 2.3: A 115 GLN : amide:sc= 0 X(o=-0.89,f=-0.59) USER MOD Set 2.4: A 147 GLN : amide:sc= -0.49 K(o=-0.89,f=-4.8!) USER MOD Set 3.1: A 110 ASN : amide:sc= -0.386 K(o=-0.21,f=-3.9!) USER MOD Set 3.2: A 144 GLN : amide:sc= 0.178 X(o=-0.21,f=-0.58) USER MOD Set 4.1: A 100 GLN : amide:sc= -0.672 X(o=-0.035,f=0.054) USER MOD Set 4.2: A 102 HIS : no HD1:sc= 0.637 K(o=-0.035,f=-5.4!) USER MOD Set 5.1: A 75 SER OG : rot 72:sc= -0.324 USER MOD Set 5.2: A 133 MET CE :methyl 163:sc= -2.61 (180deg=-2.86) USER MOD Set 6.1: A 68 HIS : no HD1:sc= -0.123 X(o=-0.38,f=-0.1) USER MOD Set 6.2: A 71 GLN : amide:sc= -0.258 K(o=-0.38,f=-2.2!) USER MOD Single : A 1 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 1 HIS N :NH3+ -98:sc= 0.0397 (180deg=0) USER MOD Single : A 2 MET CE :methyl 161:sc= -0.172 (180deg=-0.61) USER MOD Single : A 4 SER OG : rot 180:sc= 0 USER MOD Single : A 9 THR OG1 : rot 180:sc= 0 USER MOD Single : A 14 THR OG1 : rot 180:sc= 0.00668 USER MOD Single : A 23 THR OG1 : rot 180:sc= 0 USER MOD Single : A 24 SER OG : rot 180:sc= 0 USER MOD Single : A 26 LYS NZ :NH3+ -170:sc= -0.0251 (180deg=-0.153) USER MOD Single : A 31 SER OG : rot 180:sc= 0 USER MOD Single : A 37 THR OG1 : rot 36:sc= 0.279 USER MOD Single : A 38 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 42 MET CE :methyl -158:sc= -0.144 (180deg=-0.739) USER MOD Single : A 44 THR OG1 : rot 180:sc= 0 USER MOD Single : A 46 SER OG : rot 180:sc= 0 USER MOD Single : A 47 SER OG : rot 180:sc= 0 USER MOD Single : A 49 THR OG1 : rot 180:sc= 0 USER MOD Single : A 51 GLN : amide:sc= -0.703 X(o=-0.7,f=-0.61) USER MOD Single : A 57 SER OG : rot 180:sc= 0 USER MOD Single : A 62 SER OG : rot 180:sc= 0 USER MOD Single : A 67 SER OG : rot -157:sc= -0.224 USER MOD Single : A 72 GLN : amide:sc= -0.0492 K(o=-0.049,f=-1.1) USER MOD Single : A 73 THR OG1 : rot 79:sc= 1.2 USER MOD Single : A 76 GLN : amide:sc= -0.193 K(o=-0.19,f=-0.87) USER MOD Single : A 77 GLN : amide:sc= -2.03 K(o=-2,f=-3.2!) USER MOD Single : A 79 MET CE :methyl -109:sc= -0.0545 (180deg=-0.451) USER MOD Single : A 82 THR OG1 : rot 180:sc= 0 USER MOD Single : A 84 GLN : amide:sc= -0.0453 X(o=-0.045,f=-0.065) USER MOD Single : A 86 GLN : amide:sc= -0.0114 X(o=-0.011,f=0) USER MOD Single : A 87 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 88 SER OG : rot 180:sc= -0.0423 USER MOD Single : A 90 GLN : amide:sc= -0.637 X(o=-0.64,f=-0.25) USER MOD Single : A 94 HIS : no HD1:sc= -0.459 K(o=-0.46,f=-2.6!) USER MOD Single : A 104 SER OG : rot 180:sc= 0 USER MOD Single : A 106 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 116 MET CE :methyl -162:sc= -0.0124 (180deg=-0.588) USER MOD Single : A 118 SER OG : rot -11:sc= -0.423 USER MOD Single : A 120 HIS : no HD1:sc= -0.0823 X(o=-0.082,f=-0.026) USER MOD Single : A 121 SER OG : rot 180:sc= 0.0447 USER MOD Single : A 122 HIS : no HD1:sc=-0.00117 X(o=-0.0012,f=0) USER MOD Single : A 136 THR OG1 : rot 74:sc= 0.459 USER MOD Single : A 137 GLN : amide:sc= -0.0019 K(o=-0.0019,f=-0.71) USER MOD Single : A 141 SER OG : rot -19:sc= 0.22 USER MOD Single : A 148 SER OG : rot 180:sc= -0.0309 USER MOD Single : A 149 SER OG : rot 180:sc= -0.0112 USER MOD Single : A 151 SER OG : rot -93:sc= 1.3 USER MOD Single : A 152 SER OG : rot -27:sc= 0.101 USER MOD Single : A 154 SER OG : rot 180:sc= 0 USER MOD Single : A 158 GLN : amide:sc= 0 K(o=0,f=-0.71) USER MOD Single : A 159 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 160 GLN :FLIP amide:sc= -0.0128 F(o=-1.2!,f=-0.013) USER MOD Single : A 161 SER OG : rot 180:sc= 0 USER MOD Single : A 162 SER OG : rot 180:sc= 0 USER MOD Single : A 163 SER OG : rot 180:sc= 0 USER MOD Single : A 164 GLN : amide:sc= -0.941 K(o=-0.94,f=-5.2!) USER MOD Single : A 166 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 168 SER OG : rot 40:sc= 0.268 USER MOD ----------------------------------------------------------------- ATOM 1 N HIS A 1 -103.126 46.517 -36.666 1.00 1.53 N ATOM 2 CA HIS A 1 -102.844 45.099 -36.370 1.00 31.13 C ATOM 3 C HIS A 1 -101.385 44.903 -36.029 1.00 62.21 C ATOM 4 O HIS A 1 -100.521 45.619 -36.534 1.00 33.41 O ATOM 5 CB HIS A 1 -103.217 44.207 -37.564 1.00 35.43 C ATOM 6 CG HIS A 1 -104.687 44.085 -37.800 1.00 20.34 C ATOM 7 ND1 HIS A 1 -105.329 44.668 -38.866 1.00 21.11 N ATOM 8 CD2 HIS A 1 -105.642 43.432 -37.101 1.00 20.20 C ATOM 9 CE1 HIS A 1 -106.613 44.383 -38.811 1.00 75.45 C ATOM 10 NE2 HIS A 1 -106.830 43.634 -37.751 1.00 33.34 N ATOM 0 H1 HIS A 1 -103.521 46.976 -35.821 1.00 1.53 H new ATOM 0 H2 HIS A 1 -102.245 46.996 -36.940 1.00 1.53 H new ATOM 0 H3 HIS A 1 -103.811 46.579 -37.446 1.00 1.53 H new ATOM 0 HA HIS A 1 -103.451 44.813 -35.511 1.00 31.13 H new ATOM 0 HB2 HIS A 1 -102.748 44.607 -38.463 1.00 35.43 H new ATOM 0 HB3 HIS A 1 -102.802 43.212 -37.404 1.00 35.43 H new ATOM 0 HD2 HIS A 1 -105.495 42.858 -36.198 1.00 20.20 H new ATOM 0 HE1 HIS A 1 -107.362 44.709 -39.517 1.00 75.45 H new ATOM 0 HE2 HIS A 1 -107.735 43.264 -37.461 1.00 33.34 H new ATOM 21 N MET A 2 -101.112 43.943 -35.162 1.00 0.32 N ATOM 22 CA MET A 2 -99.750 43.620 -34.787 1.00 71.44 C ATOM 23 C MET A 2 -99.070 42.848 -35.900 1.00 23.13 C ATOM 24 O MET A 2 -99.472 41.727 -36.219 1.00 22.10 O ATOM 25 CB MET A 2 -99.718 42.794 -33.497 1.00 34.42 C ATOM 26 CG MET A 2 -98.329 42.275 -33.138 1.00 51.41 C ATOM 27 SD MET A 2 -98.304 41.301 -31.621 1.00 73.23 S ATOM 28 CE MET A 2 -99.432 39.969 -32.044 1.00 11.22 C ATOM 0 H MET A 2 -101.822 43.372 -34.703 1.00 0.32 H new ATOM 0 HA MET A 2 -99.217 44.555 -34.616 1.00 71.44 H new ATOM 0 HB2 MET A 2 -100.092 43.405 -32.675 1.00 34.42 H new ATOM 0 HB3 MET A 2 -100.397 41.948 -33.600 1.00 34.42 H new ATOM 0 HG2 MET A 2 -97.953 41.665 -33.960 1.00 51.41 H new ATOM 0 HG3 MET A 2 -97.649 43.120 -33.031 1.00 51.41 H new ATOM 0 HE1 MET A 2 -99.270 39.127 -31.370 1.00 11.22 H new ATOM 0 HE2 MET A 2 -100.460 40.318 -31.948 1.00 11.22 H new ATOM 0 HE3 MET A 2 -99.251 39.652 -33.071 1.00 11.22 H new ATOM 38 N ALA A 3 -98.062 43.454 -36.498 1.00 24.35 N ATOM 39 CA ALA A 3 -97.310 42.813 -37.560 1.00 4.54 C ATOM 40 C ALA A 3 -96.564 41.596 -37.027 1.00 21.13 C ATOM 41 O ALA A 3 -95.767 41.706 -36.087 1.00 72.45 O ATOM 42 CB ALA A 3 -96.340 43.800 -38.192 1.00 63.52 C ATOM 0 H ALA A 3 -97.744 44.395 -36.265 1.00 24.35 H new ATOM 0 HA ALA A 3 -98.009 42.478 -38.326 1.00 4.54 H new ATOM 0 HB1 ALA A 3 -95.783 43.304 -38.987 1.00 63.52 H new ATOM 0 HB2 ALA A 3 -96.896 44.641 -38.608 1.00 63.52 H new ATOM 0 HB3 ALA A 3 -95.645 44.163 -37.435 1.00 63.52 H new ATOM 48 N SER A 4 -96.829 40.446 -37.616 1.00 33.24 N ATOM 49 CA SER A 4 -96.192 39.212 -37.211 1.00 3.42 C ATOM 50 C SER A 4 -96.290 38.183 -38.335 1.00 30.41 C ATOM 51 O SER A 4 -97.120 37.267 -38.303 1.00 21.15 O ATOM 52 CB SER A 4 -96.830 38.670 -35.920 1.00 42.25 C ATOM 53 OG SER A 4 -96.074 37.597 -35.380 1.00 63.10 O ATOM 0 H SER A 4 -97.490 40.343 -38.386 1.00 33.24 H new ATOM 0 HA SER A 4 -95.140 39.410 -37.008 1.00 3.42 H new ATOM 0 HB2 SER A 4 -96.904 39.471 -35.185 1.00 42.25 H new ATOM 0 HB3 SER A 4 -97.846 38.333 -36.128 1.00 42.25 H new ATOM 0 HG SER A 4 -96.503 37.275 -34.560 1.00 63.10 H new ATOM 59 N ASP A 5 -95.454 38.364 -39.337 1.00 64.53 N ATOM 60 CA ASP A 5 -95.426 37.483 -40.496 1.00 53.01 C ATOM 61 C ASP A 5 -94.590 36.242 -40.222 1.00 22.21 C ATOM 62 O ASP A 5 -94.661 35.262 -40.966 1.00 60.41 O ATOM 63 CB ASP A 5 -94.901 38.229 -41.744 1.00 5.24 C ATOM 64 CG ASP A 5 -93.480 38.773 -41.596 1.00 75.33 C ATOM 65 OD1 ASP A 5 -92.918 38.723 -40.476 1.00 13.33 O ATOM 66 OD2 ASP A 5 -92.927 39.268 -42.602 1.00 70.34 O ATOM 0 H ASP A 5 -94.774 39.124 -39.375 1.00 64.53 H new ATOM 0 HA ASP A 5 -96.449 37.163 -40.694 1.00 53.01 H new ATOM 0 HB2 ASP A 5 -94.932 37.552 -42.598 1.00 5.24 H new ATOM 0 HB3 ASP A 5 -95.574 39.057 -41.969 1.00 5.24 H new ATOM 71 N ASP A 6 -93.796 36.301 -39.147 1.00 1.51 N ATOM 72 CA ASP A 6 -92.916 35.193 -38.733 1.00 51.11 C ATOM 73 C ASP A 6 -91.842 34.936 -39.792 1.00 51.23 C ATOM 74 O ASP A 6 -91.203 33.885 -39.822 1.00 34.45 O ATOM 75 CB ASP A 6 -93.729 33.918 -38.453 1.00 23.24 C ATOM 76 CG ASP A 6 -92.966 32.908 -37.621 1.00 53.33 C ATOM 77 OD1 ASP A 6 -92.786 33.148 -36.414 1.00 72.44 O ATOM 78 OD2 ASP A 6 -92.566 31.858 -38.156 1.00 32.31 O ATOM 0 H ASP A 6 -93.743 37.117 -38.537 1.00 1.51 H new ATOM 0 HA ASP A 6 -92.420 35.481 -37.806 1.00 51.11 H new ATOM 0 HB2 ASP A 6 -94.651 34.186 -37.936 1.00 23.24 H new ATOM 0 HB3 ASP A 6 -94.016 33.460 -39.400 1.00 23.24 H new ATOM 83 N ARG A 7 -91.645 35.916 -40.642 1.00 71.22 N ATOM 84 CA ARG A 7 -90.667 35.844 -41.702 1.00 35.55 C ATOM 85 C ARG A 7 -89.392 36.553 -41.263 1.00 60.42 C ATOM 86 O ARG A 7 -89.452 37.555 -40.547 1.00 0.43 O ATOM 87 CB ARG A 7 -91.272 36.462 -42.984 1.00 64.11 C ATOM 88 CG ARG A 7 -90.319 36.671 -44.164 1.00 51.21 C ATOM 89 CD ARG A 7 -89.524 37.968 -44.034 1.00 43.41 C ATOM 90 NE ARG A 7 -90.375 39.090 -43.627 1.00 61.32 N ATOM 91 CZ ARG A 7 -89.947 40.334 -43.429 1.00 61.53 C ATOM 92 NH1 ARG A 7 -88.679 40.661 -43.668 1.00 33.53 N ATOM 93 NH2 ARG A 7 -90.793 41.254 -42.999 1.00 5.41 N ATOM 0 H ARG A 7 -92.164 36.794 -40.617 1.00 71.22 H new ATOM 0 HA ARG A 7 -90.405 34.809 -41.921 1.00 35.55 H new ATOM 0 HB2 ARG A 7 -92.090 35.823 -43.316 1.00 64.11 H new ATOM 0 HB3 ARG A 7 -91.707 37.427 -42.724 1.00 64.11 H new ATOM 0 HG2 ARG A 7 -89.630 35.828 -44.228 1.00 51.21 H new ATOM 0 HG3 ARG A 7 -90.890 36.687 -45.093 1.00 51.21 H new ATOM 0 HD2 ARG A 7 -88.726 37.834 -43.304 1.00 43.41 H new ATOM 0 HD3 ARG A 7 -89.048 38.200 -44.987 1.00 43.41 H new ATOM 0 HE ARG A 7 -91.368 38.903 -43.485 1.00 61.32 H new ATOM 0 HH11 ARG A 7 -88.025 39.955 -44.006 1.00 33.53 H new ATOM 0 HH12 ARG A 7 -88.361 41.618 -43.513 1.00 33.53 H new ATOM 0 HH21 ARG A 7 -91.767 41.008 -42.821 1.00 5.41 H new ATOM 0 HH22 ARG A 7 -90.472 42.210 -42.845 1.00 5.41 H new ATOM 107 N ALA A 8 -88.246 36.043 -41.689 1.00 74.31 N ATOM 108 CA ALA A 8 -86.973 36.622 -41.293 1.00 4.12 C ATOM 109 C ALA A 8 -85.862 36.208 -42.243 1.00 24.50 C ATOM 110 O ALA A 8 -86.052 35.341 -43.104 1.00 63.41 O ATOM 111 CB ALA A 8 -86.626 36.190 -39.876 1.00 13.54 C ATOM 0 H ALA A 8 -88.172 35.234 -42.306 1.00 74.31 H new ATOM 0 HA ALA A 8 -87.068 37.707 -41.331 1.00 4.12 H new ATOM 0 HB1 ALA A 8 -85.671 36.628 -39.586 1.00 13.54 H new ATOM 0 HB2 ALA A 8 -87.403 36.529 -39.191 1.00 13.54 H new ATOM 0 HB3 ALA A 8 -86.555 35.103 -39.834 1.00 13.54 H new ATOM 117 N THR A 9 -84.710 36.829 -42.083 1.00 21.01 N ATOM 118 CA THR A 9 -83.558 36.539 -42.901 1.00 65.34 C ATOM 119 C THR A 9 -82.279 36.711 -42.083 1.00 43.22 C ATOM 120 O THR A 9 -82.246 37.486 -41.114 1.00 52.34 O ATOM 121 CB THR A 9 -83.510 37.448 -44.163 1.00 31.34 C ATOM 122 OG1 THR A 9 -82.416 37.065 -45.013 1.00 2.34 O ATOM 123 CG2 THR A 9 -83.367 38.918 -43.780 1.00 25.32 C ATOM 0 H THR A 9 -84.550 37.550 -41.379 1.00 21.01 H new ATOM 0 HA THR A 9 -83.638 35.505 -43.237 1.00 65.34 H new ATOM 0 HB THR A 9 -84.450 37.319 -44.700 1.00 31.34 H new ATOM 0 HG1 THR A 9 -82.398 37.643 -45.804 1.00 2.34 H new ATOM 0 HG21 THR A 9 -83.336 39.528 -44.683 1.00 25.32 H new ATOM 0 HG22 THR A 9 -84.217 39.219 -43.168 1.00 25.32 H new ATOM 0 HG23 THR A 9 -82.445 39.059 -43.215 1.00 25.32 H new ATOM 131 N GLY A 10 -81.250 35.982 -42.456 1.00 31.04 N ATOM 132 CA GLY A 10 -79.988 36.056 -41.752 1.00 61.40 C ATOM 133 C GLY A 10 -79.903 35.065 -40.603 1.00 32.11 C ATOM 134 O GLY A 10 -79.827 35.467 -39.443 1.00 50.30 O ATOM 0 H GLY A 10 -81.262 35.332 -43.242 1.00 31.04 H new ATOM 0 HA2 GLY A 10 -79.174 35.867 -42.452 1.00 61.40 H new ATOM 0 HA3 GLY A 10 -79.849 37.066 -41.367 1.00 61.40 H new ATOM 138 N PRO A 11 -79.928 33.752 -40.893 1.00 44.05 N ATOM 139 CA PRO A 11 -79.834 32.723 -39.879 1.00 63.24 C ATOM 140 C PRO A 11 -78.394 32.280 -39.643 1.00 53.41 C ATOM 141 O PRO A 11 -77.492 32.596 -40.432 1.00 63.45 O ATOM 142 CB PRO A 11 -80.651 31.588 -40.486 1.00 41.43 C ATOM 143 CG PRO A 11 -80.478 31.736 -41.971 1.00 50.25 C ATOM 144 CD PRO A 11 -80.059 33.168 -42.236 1.00 63.11 C ATOM 0 HA PRO A 11 -80.189 33.058 -38.904 1.00 63.24 H new ATOM 0 HB2 PRO A 11 -80.295 30.617 -40.142 1.00 41.43 H new ATOM 0 HB3 PRO A 11 -81.701 31.661 -40.202 1.00 41.43 H new ATOM 0 HG2 PRO A 11 -79.725 31.041 -42.341 1.00 50.25 H new ATOM 0 HG3 PRO A 11 -81.408 31.505 -42.491 1.00 50.25 H new ATOM 0 HD2 PRO A 11 -79.119 33.214 -42.785 1.00 63.11 H new ATOM 0 HD3 PRO A 11 -80.802 33.698 -42.832 1.00 63.11 H new ATOM 152 N ALA A 12 -78.186 31.557 -38.565 1.00 31.23 N ATOM 153 CA ALA A 12 -76.871 31.062 -38.213 1.00 15.10 C ATOM 154 C ALA A 12 -76.448 29.920 -39.138 1.00 65.33 C ATOM 155 O ALA A 12 -77.275 29.359 -39.873 1.00 2.44 O ATOM 156 CB ALA A 12 -76.863 30.608 -36.766 1.00 51.13 C ATOM 0 H ALA A 12 -78.921 31.295 -37.908 1.00 31.23 H new ATOM 0 HA ALA A 12 -76.152 31.872 -38.335 1.00 15.10 H new ATOM 0 HB1 ALA A 12 -75.872 30.237 -36.507 1.00 51.13 H new ATOM 0 HB2 ALA A 12 -77.116 31.448 -36.120 1.00 51.13 H new ATOM 0 HB3 ALA A 12 -77.595 29.812 -36.630 1.00 51.13 H new ATOM 162 N LEU A 13 -75.168 29.586 -39.108 1.00 42.24 N ATOM 163 CA LEU A 13 -74.630 28.513 -39.930 1.00 62.01 C ATOM 164 C LEU A 13 -73.322 28.011 -39.347 1.00 12.14 C ATOM 165 O LEU A 13 -72.645 28.736 -38.616 1.00 72.13 O ATOM 166 CB LEU A 13 -74.409 28.970 -41.392 1.00 75.31 C ATOM 167 CG LEU A 13 -73.271 29.981 -41.644 1.00 21.54 C ATOM 168 CD1 LEU A 13 -72.969 30.072 -43.130 1.00 41.23 C ATOM 169 CD2 LEU A 13 -73.630 31.359 -41.103 1.00 3.14 C ATOM 0 H LEU A 13 -74.476 30.047 -38.517 1.00 42.24 H new ATOM 0 HA LEU A 13 -75.361 27.705 -39.935 1.00 62.01 H new ATOM 0 HB2 LEU A 13 -74.217 28.085 -41.998 1.00 75.31 H new ATOM 0 HB3 LEU A 13 -75.339 29.409 -41.754 1.00 75.31 H new ATOM 0 HG LEU A 13 -72.385 29.627 -41.118 1.00 21.54 H new ATOM 0 HD11 LEU A 13 -72.164 30.789 -43.295 1.00 41.23 H new ATOM 0 HD12 LEU A 13 -72.664 29.093 -43.500 1.00 41.23 H new ATOM 0 HD13 LEU A 13 -73.861 30.400 -43.663 1.00 41.23 H new ATOM 0 HD21 LEU A 13 -72.809 32.050 -41.295 1.00 3.14 H new ATOM 0 HD22 LEU A 13 -74.532 31.720 -41.597 1.00 3.14 H new ATOM 0 HD23 LEU A 13 -73.806 31.294 -40.029 1.00 3.14 H new ATOM 181 N THR A 14 -72.968 26.786 -39.667 1.00 75.53 N ATOM 182 CA THR A 14 -71.732 26.202 -39.187 1.00 23.12 C ATOM 183 C THR A 14 -70.557 26.609 -40.088 1.00 55.21 C ATOM 184 O THR A 14 -70.750 26.892 -41.277 1.00 22.43 O ATOM 185 CB THR A 14 -71.836 24.664 -39.130 1.00 32.31 C ATOM 186 OG1 THR A 14 -72.323 24.155 -40.385 1.00 71.04 O ATOM 187 CG2 THR A 14 -72.767 24.226 -38.012 1.00 33.13 C ATOM 0 H THR A 14 -73.522 26.170 -40.262 1.00 75.53 H new ATOM 0 HA THR A 14 -71.554 26.578 -38.179 1.00 23.12 H new ATOM 0 HB THR A 14 -70.841 24.264 -38.935 1.00 32.31 H new ATOM 0 HG1 THR A 14 -72.384 23.178 -40.340 1.00 71.04 H new ATOM 0 HG21 THR A 14 -72.824 23.138 -37.992 1.00 33.13 H new ATOM 0 HG22 THR A 14 -72.384 24.587 -37.057 1.00 33.13 H new ATOM 0 HG23 THR A 14 -73.761 24.638 -38.184 1.00 33.13 H new ATOM 195 N PRO A 15 -69.329 26.665 -39.529 1.00 21.20 N ATOM 196 CA PRO A 15 -68.128 27.032 -40.291 1.00 64.42 C ATOM 197 C PRO A 15 -67.853 26.050 -41.419 1.00 44.43 C ATOM 198 O PRO A 15 -67.756 24.839 -41.194 1.00 73.41 O ATOM 199 CB PRO A 15 -67.000 26.963 -39.251 1.00 45.43 C ATOM 200 CG PRO A 15 -67.687 27.042 -37.933 1.00 70.22 C ATOM 201 CD PRO A 15 -69.017 26.383 -38.123 1.00 21.35 C ATOM 0 HA PRO A 15 -68.230 28.009 -40.763 1.00 64.42 H new ATOM 0 HB2 PRO A 15 -66.432 26.037 -39.345 1.00 45.43 H new ATOM 0 HB3 PRO A 15 -66.295 27.784 -39.378 1.00 45.43 H new ATOM 0 HG2 PRO A 15 -67.108 26.537 -37.160 1.00 70.22 H new ATOM 0 HG3 PRO A 15 -67.806 28.078 -37.616 1.00 70.22 H new ATOM 0 HD2 PRO A 15 -68.968 25.312 -37.928 1.00 21.35 H new ATOM 0 HD3 PRO A 15 -69.771 26.795 -37.452 1.00 21.35 H new ATOM 209 N LEU A 16 -67.740 26.563 -42.625 1.00 33.31 N ATOM 210 CA LEU A 16 -67.486 25.729 -43.781 1.00 51.30 C ATOM 211 C LEU A 16 -66.035 25.273 -43.801 1.00 10.00 C ATOM 212 O LEU A 16 -65.124 26.072 -44.020 1.00 65.15 O ATOM 213 CB LEU A 16 -67.830 26.481 -45.066 1.00 33.05 C ATOM 214 CG LEU A 16 -69.293 26.911 -45.214 1.00 71.52 C ATOM 215 CD1 LEU A 16 -69.505 27.643 -46.526 1.00 64.42 C ATOM 216 CD2 LEU A 16 -70.217 25.706 -45.123 1.00 0.55 C ATOM 0 H LEU A 16 -67.820 27.559 -42.832 1.00 33.31 H new ATOM 0 HA LEU A 16 -68.122 24.846 -43.717 1.00 51.30 H new ATOM 0 HB2 LEU A 16 -67.202 27.370 -45.124 1.00 33.05 H new ATOM 0 HB3 LEU A 16 -67.568 25.850 -45.915 1.00 33.05 H new ATOM 0 HG LEU A 16 -69.533 27.592 -44.397 1.00 71.52 H new ATOM 0 HD11 LEU A 16 -70.550 27.940 -46.612 1.00 64.42 H new ATOM 0 HD12 LEU A 16 -68.872 28.530 -46.554 1.00 64.42 H new ATOM 0 HD13 LEU A 16 -69.245 26.985 -47.356 1.00 64.42 H new ATOM 0 HD21 LEU A 16 -71.252 26.032 -45.230 1.00 0.55 H new ATOM 0 HD22 LEU A 16 -69.974 25.001 -45.918 1.00 0.55 H new ATOM 0 HD23 LEU A 16 -70.088 25.221 -44.155 1.00 0.55 H new ATOM 228 N VAL A 17 -65.827 23.989 -43.573 1.00 1.54 N ATOM 229 CA VAL A 17 -64.492 23.431 -43.534 1.00 10.21 C ATOM 230 C VAL A 17 -63.979 23.131 -44.943 1.00 41.20 C ATOM 231 O VAL A 17 -64.505 22.264 -45.652 1.00 73.15 O ATOM 232 CB VAL A 17 -64.424 22.155 -42.635 1.00 34.31 C ATOM 233 CG1 VAL A 17 -65.482 21.134 -43.033 1.00 4.32 C ATOM 234 CG2 VAL A 17 -63.031 21.535 -42.676 1.00 51.24 C ATOM 0 H VAL A 17 -66.572 23.311 -43.411 1.00 1.54 H new ATOM 0 HA VAL A 17 -63.841 24.183 -43.087 1.00 10.21 H new ATOM 0 HB VAL A 17 -64.632 22.464 -41.610 1.00 34.31 H new ATOM 0 HG11 VAL A 17 -65.405 20.260 -42.387 1.00 4.32 H new ATOM 0 HG12 VAL A 17 -66.473 21.577 -42.928 1.00 4.32 H new ATOM 0 HG13 VAL A 17 -65.326 20.834 -44.069 1.00 4.32 H new ATOM 0 HG21 VAL A 17 -63.009 20.648 -42.042 1.00 51.24 H new ATOM 0 HG22 VAL A 17 -62.787 21.255 -43.701 1.00 51.24 H new ATOM 0 HG23 VAL A 17 -62.300 22.258 -42.314 1.00 51.24 H new ATOM 244 N VAL A 18 -62.970 23.872 -45.347 1.00 31.21 N ATOM 245 CA VAL A 18 -62.373 23.714 -46.654 1.00 22.05 C ATOM 246 C VAL A 18 -60.908 24.143 -46.619 1.00 61.35 C ATOM 247 O VAL A 18 -60.582 25.237 -46.152 1.00 54.23 O ATOM 248 CB VAL A 18 -63.154 24.520 -47.740 1.00 73.12 C ATOM 249 CG1 VAL A 18 -63.234 26.003 -47.391 1.00 21.11 C ATOM 250 CG2 VAL A 18 -62.534 24.320 -49.117 1.00 44.24 C ATOM 0 H VAL A 18 -62.541 24.601 -44.778 1.00 31.21 H new ATOM 0 HA VAL A 18 -62.427 22.659 -46.924 1.00 22.05 H new ATOM 0 HB VAL A 18 -64.173 24.133 -47.764 1.00 73.12 H new ATOM 0 HG11 VAL A 18 -63.784 26.531 -48.170 1.00 21.11 H new ATOM 0 HG12 VAL A 18 -63.747 26.125 -46.437 1.00 21.11 H new ATOM 0 HG13 VAL A 18 -62.227 26.414 -47.316 1.00 21.11 H new ATOM 0 HG21 VAL A 18 -63.096 24.892 -49.856 1.00 44.24 H new ATOM 0 HG22 VAL A 18 -61.499 24.663 -49.103 1.00 44.24 H new ATOM 0 HG23 VAL A 18 -62.562 23.262 -49.379 1.00 44.24 H new ATOM 260 N ALA A 19 -60.029 23.266 -47.080 1.00 60.52 N ATOM 261 CA ALA A 19 -58.601 23.542 -47.103 1.00 31.05 C ATOM 262 C ALA A 19 -57.868 22.502 -47.933 1.00 44.31 C ATOM 263 O ALA A 19 -57.611 21.388 -47.467 1.00 73.44 O ATOM 264 CB ALA A 19 -58.035 23.578 -45.687 1.00 13.24 C ATOM 0 H ALA A 19 -60.283 22.349 -47.446 1.00 60.52 H new ATOM 0 HA ALA A 19 -58.454 24.520 -47.560 1.00 31.05 H new ATOM 0 HB1 ALA A 19 -56.966 23.786 -45.728 1.00 13.24 H new ATOM 0 HB2 ALA A 19 -58.535 24.360 -45.115 1.00 13.24 H new ATOM 0 HB3 ALA A 19 -58.199 22.614 -45.205 1.00 13.24 H new ATOM 270 N ALA A 20 -57.552 22.861 -49.164 1.00 64.10 N ATOM 271 CA ALA A 20 -56.841 21.971 -50.063 1.00 44.01 C ATOM 272 C ALA A 20 -55.418 21.756 -49.575 1.00 61.14 C ATOM 273 O ALA A 20 -54.764 22.700 -49.122 1.00 60.31 O ATOM 274 CB ALA A 20 -56.839 22.537 -51.474 1.00 5.22 C ATOM 0 H ALA A 20 -57.779 23.770 -49.566 1.00 64.10 H new ATOM 0 HA ALA A 20 -57.352 21.008 -50.077 1.00 44.01 H new ATOM 0 HB1 ALA A 20 -56.302 21.859 -52.137 1.00 5.22 H new ATOM 0 HB2 ALA A 20 -57.866 22.649 -51.823 1.00 5.22 H new ATOM 0 HB3 ALA A 20 -56.348 23.510 -51.475 1.00 5.22 H new ATOM 280 N ALA A 21 -54.941 20.525 -49.671 1.00 63.21 N ATOM 281 CA ALA A 21 -53.608 20.181 -49.212 1.00 51.22 C ATOM 282 C ALA A 21 -53.210 18.799 -49.697 1.00 22.34 C ATOM 283 O ALA A 21 -54.063 17.919 -49.866 1.00 14.35 O ATOM 284 CB ALA A 21 -53.534 20.241 -47.691 1.00 4.41 C ATOM 0 H ALA A 21 -55.463 19.743 -50.066 1.00 63.21 H new ATOM 0 HA ALA A 21 -52.911 20.909 -49.628 1.00 51.22 H new ATOM 0 HB1 ALA A 21 -52.527 19.980 -47.365 1.00 4.41 H new ATOM 0 HB2 ALA A 21 -53.774 21.250 -47.355 1.00 4.41 H new ATOM 0 HB3 ALA A 21 -54.248 19.536 -47.264 1.00 4.41 H new ATOM 290 N ALA A 22 -51.920 18.619 -49.922 1.00 33.34 N ATOM 291 CA ALA A 22 -51.364 17.355 -50.374 1.00 33.44 C ATOM 292 C ALA A 22 -49.850 17.373 -50.218 1.00 72.51 C ATOM 293 O ALA A 22 -49.194 18.345 -50.605 1.00 30.44 O ATOM 294 CB ALA A 22 -51.738 17.093 -51.829 1.00 42.53 C ATOM 0 H ALA A 22 -51.223 19.353 -49.795 1.00 33.34 H new ATOM 0 HA ALA A 22 -51.778 16.553 -49.763 1.00 33.44 H new ATOM 0 HB1 ALA A 22 -51.312 16.142 -52.149 1.00 42.53 H new ATOM 0 HB2 ALA A 22 -52.823 17.055 -51.925 1.00 42.53 H new ATOM 0 HB3 ALA A 22 -51.346 17.895 -52.455 1.00 42.53 H new ATOM 300 N THR A 23 -49.298 16.318 -49.649 1.00 60.11 N ATOM 301 CA THR A 23 -47.867 16.234 -49.446 1.00 54.20 C ATOM 302 C THR A 23 -47.400 14.778 -49.387 1.00 25.01 C ATOM 303 O THR A 23 -48.083 13.911 -48.827 1.00 41.02 O ATOM 304 CB THR A 23 -47.429 16.988 -48.159 1.00 2.43 C ATOM 305 OG1 THR A 23 -46.003 16.961 -48.027 1.00 55.54 O ATOM 306 CG2 THR A 23 -48.067 16.377 -46.915 1.00 31.45 C ATOM 0 H THR A 23 -49.821 15.507 -49.319 1.00 60.11 H new ATOM 0 HA THR A 23 -47.394 16.715 -50.302 1.00 54.20 H new ATOM 0 HB THR A 23 -47.767 18.020 -48.250 1.00 2.43 H new ATOM 0 HG1 THR A 23 -45.741 17.441 -47.214 1.00 55.54 H new ATOM 0 HG21 THR A 23 -47.741 16.926 -46.032 1.00 31.45 H new ATOM 0 HG22 THR A 23 -49.152 16.434 -46.998 1.00 31.45 H new ATOM 0 HG23 THR A 23 -47.764 15.334 -46.826 1.00 31.45 H new ATOM 314 N SER A 24 -46.253 14.516 -49.994 1.00 64.50 N ATOM 315 CA SER A 24 -45.658 13.196 -50.020 1.00 54.14 C ATOM 316 C SER A 24 -44.252 13.296 -50.591 1.00 21.44 C ATOM 317 O SER A 24 -44.022 14.050 -51.546 1.00 44.41 O ATOM 318 CB SER A 24 -46.509 12.237 -50.869 1.00 14.01 C ATOM 319 OG SER A 24 -46.043 10.901 -50.759 1.00 60.00 O ATOM 0 H SER A 24 -45.707 15.223 -50.486 1.00 64.50 H new ATOM 0 HA SER A 24 -45.614 12.801 -49.005 1.00 54.14 H new ATOM 0 HB2 SER A 24 -47.549 12.289 -50.548 1.00 14.01 H new ATOM 0 HB3 SER A 24 -46.481 12.550 -51.913 1.00 14.01 H new ATOM 0 HG SER A 24 -46.603 10.313 -51.307 1.00 60.00 H new ATOM 325 N ALA A 25 -43.318 12.551 -50.014 1.00 71.54 N ATOM 326 CA ALA A 25 -41.935 12.569 -50.465 1.00 40.14 C ATOM 327 C ALA A 25 -41.145 11.443 -49.824 1.00 51.12 C ATOM 328 O ALA A 25 -41.184 11.261 -48.606 1.00 52.42 O ATOM 329 CB ALA A 25 -41.281 13.912 -50.147 1.00 70.23 C ATOM 0 H ALA A 25 -43.496 11.924 -49.229 1.00 71.54 H new ATOM 0 HA ALA A 25 -41.933 12.425 -51.546 1.00 40.14 H new ATOM 0 HB1 ALA A 25 -40.247 13.904 -50.493 1.00 70.23 H new ATOM 0 HB2 ALA A 25 -41.826 14.710 -50.651 1.00 70.23 H new ATOM 0 HB3 ALA A 25 -41.302 14.081 -49.070 1.00 70.23 H new ATOM 335 N LYS A 26 -40.446 10.684 -50.647 1.00 42.24 N ATOM 336 CA LYS A 26 -39.614 9.591 -50.180 1.00 24.42 C ATOM 337 C LYS A 26 -38.594 9.217 -51.253 1.00 13.40 C ATOM 338 O LYS A 26 -38.957 8.904 -52.388 1.00 12.24 O ATOM 339 CB LYS A 26 -40.466 8.367 -49.781 1.00 74.04 C ATOM 340 CG LYS A 26 -41.289 7.772 -50.912 1.00 75.51 C ATOM 341 CD LYS A 26 -42.084 6.566 -50.443 1.00 45.14 C ATOM 342 CE LYS A 26 -42.794 5.883 -51.603 1.00 14.05 C ATOM 343 NZ LYS A 26 -43.700 6.806 -52.327 1.00 25.04 N ATOM 0 H LYS A 26 -40.439 10.808 -51.659 1.00 42.24 H new ATOM 0 HA LYS A 26 -39.082 9.922 -49.288 1.00 24.42 H new ATOM 0 HB2 LYS A 26 -39.806 7.595 -49.385 1.00 74.04 H new ATOM 0 HB3 LYS A 26 -41.138 8.657 -48.974 1.00 74.04 H new ATOM 0 HG2 LYS A 26 -41.969 8.527 -51.306 1.00 75.51 H new ATOM 0 HG3 LYS A 26 -40.630 7.480 -51.729 1.00 75.51 H new ATOM 0 HD2 LYS A 26 -41.417 5.856 -49.954 1.00 45.14 H new ATOM 0 HD3 LYS A 26 -42.817 6.878 -49.699 1.00 45.14 H new ATOM 0 HE2 LYS A 26 -42.053 5.485 -52.297 1.00 14.05 H new ATOM 0 HE3 LYS A 26 -43.367 5.035 -51.228 1.00 14.05 H new ATOM 0 HZ1 LYS A 26 -44.285 6.265 -52.995 1.00 25.04 H new ATOM 0 HZ2 LYS A 26 -44.315 7.295 -51.645 1.00 25.04 H new ATOM 0 HZ3 LYS A 26 -43.136 7.507 -52.850 1.00 25.04 H new ATOM 357 N VAL A 27 -37.328 9.280 -50.902 1.00 4.14 N ATOM 358 CA VAL A 27 -36.263 8.966 -51.833 1.00 15.01 C ATOM 359 C VAL A 27 -35.032 8.460 -51.084 1.00 13.53 C ATOM 360 O VAL A 27 -34.771 8.869 -49.949 1.00 40.44 O ATOM 361 CB VAL A 27 -35.889 10.206 -52.703 1.00 73.53 C ATOM 362 CG1 VAL A 27 -35.373 11.350 -51.840 1.00 62.44 C ATOM 363 CG2 VAL A 27 -34.874 9.840 -53.781 1.00 44.12 C ATOM 0 H VAL A 27 -37.008 9.548 -49.971 1.00 4.14 H new ATOM 0 HA VAL A 27 -36.622 8.180 -52.498 1.00 15.01 H new ATOM 0 HB VAL A 27 -36.799 10.543 -53.200 1.00 73.53 H new ATOM 0 HG11 VAL A 27 -35.121 12.199 -52.475 1.00 62.44 H new ATOM 0 HG12 VAL A 27 -36.144 11.645 -51.128 1.00 62.44 H new ATOM 0 HG13 VAL A 27 -34.484 11.025 -51.299 1.00 62.44 H new ATOM 0 HG21 VAL A 27 -34.634 10.725 -54.370 1.00 44.12 H new ATOM 0 HG22 VAL A 27 -33.967 9.459 -53.312 1.00 44.12 H new ATOM 0 HG23 VAL A 27 -35.295 9.074 -54.432 1.00 44.12 H new ATOM 373 N GLU A 28 -34.302 7.556 -51.708 1.00 3.45 N ATOM 374 CA GLU A 28 -33.091 7.008 -51.134 1.00 71.34 C ATOM 375 C GLU A 28 -32.179 6.476 -52.235 1.00 32.45 C ATOM 376 O GLU A 28 -32.457 5.445 -52.846 1.00 30.12 O ATOM 377 CB GLU A 28 -33.423 5.908 -50.106 1.00 42.41 C ATOM 378 CG GLU A 28 -34.418 4.865 -50.599 1.00 2.52 C ATOM 379 CD GLU A 28 -34.696 3.801 -49.568 1.00 62.11 C ATOM 380 OE1 GLU A 28 -33.967 2.789 -49.543 1.00 34.11 O ATOM 381 OE2 GLU A 28 -35.639 3.970 -48.768 1.00 42.21 O ATOM 0 H GLU A 28 -34.533 7.181 -52.628 1.00 3.45 H new ATOM 0 HA GLU A 28 -32.563 7.804 -50.609 1.00 71.34 H new ATOM 0 HB2 GLU A 28 -32.500 5.405 -49.820 1.00 42.41 H new ATOM 0 HB3 GLU A 28 -33.822 6.377 -49.207 1.00 42.41 H new ATOM 0 HG2 GLU A 28 -35.352 5.358 -50.869 1.00 2.52 H new ATOM 0 HG3 GLU A 28 -34.031 4.397 -51.504 1.00 2.52 H new ATOM 388 N VAL A 29 -31.110 7.203 -52.505 1.00 72.31 N ATOM 389 CA VAL A 29 -30.165 6.816 -53.537 1.00 23.41 C ATOM 390 C VAL A 29 -28.716 7.044 -53.082 1.00 52.23 C ATOM 391 O VAL A 29 -28.262 8.184 -52.923 1.00 24.10 O ATOM 392 CB VAL A 29 -30.446 7.553 -54.884 1.00 73.43 C ATOM 393 CG1 VAL A 29 -30.504 9.065 -54.696 1.00 20.20 C ATOM 394 CG2 VAL A 29 -29.410 7.177 -55.936 1.00 64.21 C ATOM 0 H VAL A 29 -30.874 8.069 -52.021 1.00 72.31 H new ATOM 0 HA VAL A 29 -30.300 5.748 -53.710 1.00 23.41 H new ATOM 0 HB VAL A 29 -31.425 7.228 -55.236 1.00 73.43 H new ATOM 0 HG11 VAL A 29 -30.701 9.544 -55.655 1.00 20.20 H new ATOM 0 HG12 VAL A 29 -31.301 9.314 -53.995 1.00 20.20 H new ATOM 0 HG13 VAL A 29 -29.551 9.420 -54.303 1.00 20.20 H new ATOM 0 HG21 VAL A 29 -29.628 7.703 -56.865 1.00 64.21 H new ATOM 0 HG22 VAL A 29 -28.417 7.456 -55.585 1.00 64.21 H new ATOM 0 HG23 VAL A 29 -29.444 6.102 -56.112 1.00 64.21 H new ATOM 404 N ASP A 30 -28.010 5.953 -52.849 1.00 14.02 N ATOM 405 CA ASP A 30 -26.620 5.997 -52.410 1.00 33.40 C ATOM 406 C ASP A 30 -25.968 4.645 -52.638 1.00 32.40 C ATOM 407 O ASP A 30 -26.659 3.631 -52.753 1.00 72.13 O ATOM 408 CB ASP A 30 -26.527 6.370 -50.922 1.00 30.02 C ATOM 409 CG ASP A 30 -27.044 5.277 -50.005 1.00 41.43 C ATOM 410 OD1 ASP A 30 -28.275 5.057 -49.962 1.00 33.42 O ATOM 411 OD2 ASP A 30 -26.226 4.638 -49.311 1.00 23.32 O ATOM 0 H ASP A 30 -28.381 5.009 -52.958 1.00 14.02 H new ATOM 0 HA ASP A 30 -26.100 6.759 -52.991 1.00 33.40 H new ATOM 0 HB2 ASP A 30 -25.489 6.586 -50.671 1.00 30.02 H new ATOM 0 HB3 ASP A 30 -27.095 7.284 -50.746 1.00 30.02 H new ATOM 416 N SER A 31 -24.653 4.629 -52.705 1.00 14.33 N ATOM 417 CA SER A 31 -23.914 3.400 -52.909 1.00 20.53 C ATOM 418 C SER A 31 -22.485 3.558 -52.388 1.00 4.24 C ATOM 419 O SER A 31 -21.760 4.460 -52.819 1.00 64.35 O ATOM 420 CB SER A 31 -23.902 3.026 -54.399 1.00 43.20 C ATOM 421 OG SER A 31 -23.330 1.744 -54.606 1.00 60.33 O ATOM 0 H SER A 31 -24.069 5.461 -52.620 1.00 14.33 H new ATOM 0 HA SER A 31 -24.403 2.598 -52.356 1.00 20.53 H new ATOM 0 HB2 SER A 31 -24.920 3.039 -54.787 1.00 43.20 H new ATOM 0 HB3 SER A 31 -23.338 3.772 -54.959 1.00 43.20 H new ATOM 0 HG SER A 31 -23.338 1.533 -55.563 1.00 60.33 H new ATOM 427 N PRO A 32 -22.073 2.704 -51.430 1.00 15.23 N ATOM 428 CA PRO A 32 -20.719 2.738 -50.854 1.00 44.33 C ATOM 429 C PRO A 32 -19.640 2.418 -51.893 1.00 51.11 C ATOM 430 O PRO A 32 -19.596 1.304 -52.435 1.00 44.33 O ATOM 431 CB PRO A 32 -20.752 1.639 -49.779 1.00 21.40 C ATOM 432 CG PRO A 32 -22.197 1.389 -49.524 1.00 25.43 C ATOM 433 CD PRO A 32 -22.895 1.650 -50.821 1.00 25.51 C ATOM 0 HA PRO A 32 -20.472 3.727 -50.467 1.00 44.33 H new ATOM 0 HB2 PRO A 32 -20.250 0.735 -50.124 1.00 21.40 H new ATOM 0 HB3 PRO A 32 -20.241 1.960 -48.871 1.00 21.40 H new ATOM 0 HG2 PRO A 32 -22.363 0.365 -49.191 1.00 25.43 H new ATOM 0 HG3 PRO A 32 -22.574 2.045 -48.739 1.00 25.43 H new ATOM 0 HD2 PRO A 32 -22.935 0.757 -51.445 1.00 25.51 H new ATOM 0 HD3 PRO A 32 -23.923 1.978 -50.668 1.00 25.51 H new ATOM 441 N PRO A 33 -18.768 3.388 -52.197 1.00 4.42 N ATOM 442 CA PRO A 33 -17.695 3.200 -53.153 1.00 71.20 C ATOM 443 C PRO A 33 -16.442 2.616 -52.499 1.00 45.44 C ATOM 444 O PRO A 33 -15.924 3.164 -51.523 1.00 75.24 O ATOM 445 CB PRO A 33 -17.428 4.615 -53.669 1.00 61.20 C ATOM 446 CG PRO A 33 -17.902 5.546 -52.586 1.00 44.02 C ATOM 447 CD PRO A 33 -18.768 4.746 -51.633 1.00 4.04 C ATOM 0 HA PRO A 33 -17.961 2.494 -53.940 1.00 71.20 H new ATOM 0 HB2 PRO A 33 -16.368 4.762 -53.874 1.00 61.20 H new ATOM 0 HB3 PRO A 33 -17.961 4.798 -54.602 1.00 61.20 H new ATOM 0 HG2 PRO A 33 -17.053 5.981 -52.058 1.00 44.02 H new ATOM 0 HG3 PRO A 33 -18.468 6.373 -53.014 1.00 44.02 H new ATOM 0 HD2 PRO A 33 -18.362 4.757 -50.622 1.00 4.04 H new ATOM 0 HD3 PRO A 33 -19.777 5.153 -51.575 1.00 4.04 H new ATOM 455 N ALA A 34 -15.975 1.497 -53.028 1.00 53.23 N ATOM 456 CA ALA A 34 -14.790 0.842 -52.502 1.00 32.25 C ATOM 457 C ALA A 34 -13.528 1.617 -52.879 1.00 43.43 C ATOM 458 O ALA A 34 -13.245 1.811 -54.063 1.00 2.35 O ATOM 459 CB ALA A 34 -14.708 -0.589 -53.011 1.00 4.33 C ATOM 0 H ALA A 34 -16.401 1.022 -53.824 1.00 53.23 H new ATOM 0 HA ALA A 34 -14.864 0.822 -51.415 1.00 32.25 H new ATOM 0 HB1 ALA A 34 -13.815 -1.068 -52.609 1.00 4.33 H new ATOM 0 HB2 ALA A 34 -15.591 -1.141 -52.690 1.00 4.33 H new ATOM 0 HB3 ALA A 34 -14.659 -0.586 -54.100 1.00 4.33 H new ATOM 465 N PRO A 35 -12.761 2.081 -51.879 1.00 42.22 N ATOM 466 CA PRO A 35 -11.534 2.837 -52.117 1.00 11.50 C ATOM 467 C PRO A 35 -10.428 1.967 -52.711 1.00 3.44 C ATOM 468 O PRO A 35 -9.988 0.993 -52.095 1.00 12.23 O ATOM 469 CB PRO A 35 -11.134 3.338 -50.726 1.00 24.25 C ATOM 470 CG PRO A 35 -11.777 2.390 -49.775 1.00 1.44 C ATOM 471 CD PRO A 35 -13.037 1.907 -50.440 1.00 53.43 C ATOM 0 HA PRO A 35 -11.687 3.640 -52.838 1.00 11.50 H new ATOM 0 HB2 PRO A 35 -10.051 3.344 -50.605 1.00 24.25 H new ATOM 0 HB3 PRO A 35 -11.479 4.359 -50.560 1.00 24.25 H new ATOM 0 HG2 PRO A 35 -11.113 1.556 -49.550 1.00 1.44 H new ATOM 0 HG3 PRO A 35 -12.002 2.882 -48.829 1.00 1.44 H new ATOM 0 HD2 PRO A 35 -13.245 0.865 -50.195 1.00 53.43 H new ATOM 0 HD3 PRO A 35 -13.904 2.488 -50.125 1.00 53.43 H new ATOM 479 N VAL A 36 -9.995 2.311 -53.912 1.00 41.11 N ATOM 480 CA VAL A 36 -8.938 1.564 -54.583 1.00 44.14 C ATOM 481 C VAL A 36 -7.563 2.087 -54.183 1.00 54.40 C ATOM 482 O VAL A 36 -6.551 1.402 -54.349 1.00 14.30 O ATOM 483 CB VAL A 36 -9.085 1.606 -56.125 1.00 70.10 C ATOM 484 CG1 VAL A 36 -10.406 0.989 -56.554 1.00 45.34 C ATOM 485 CG2 VAL A 36 -8.962 3.033 -56.650 1.00 15.44 C ATOM 0 H VAL A 36 -10.357 3.102 -54.444 1.00 41.11 H new ATOM 0 HA VAL A 36 -9.034 0.527 -54.263 1.00 44.14 H new ATOM 0 HB VAL A 36 -8.274 1.019 -56.556 1.00 70.10 H new ATOM 0 HG11 VAL A 36 -10.490 1.028 -57.640 1.00 45.34 H new ATOM 0 HG12 VAL A 36 -10.447 -0.049 -56.224 1.00 45.34 H new ATOM 0 HG13 VAL A 36 -11.230 1.545 -56.106 1.00 45.34 H new ATOM 0 HG21 VAL A 36 -9.069 3.032 -57.735 1.00 15.44 H new ATOM 0 HG22 VAL A 36 -9.743 3.652 -56.209 1.00 15.44 H new ATOM 0 HG23 VAL A 36 -7.985 3.436 -56.382 1.00 15.44 H new ATOM 495 N THR A 37 -7.534 3.295 -53.653 1.00 3.30 N ATOM 496 CA THR A 37 -6.299 3.910 -53.231 1.00 24.35 C ATOM 497 C THR A 37 -5.977 3.527 -51.792 1.00 4.32 C ATOM 498 O THR A 37 -6.744 3.823 -50.877 1.00 42.50 O ATOM 499 CB THR A 37 -6.386 5.441 -53.349 1.00 1.54 C ATOM 500 OG1 THR A 37 -7.580 5.904 -52.706 1.00 11.45 O ATOM 501 CG2 THR A 37 -6.395 5.872 -54.809 1.00 41.04 C ATOM 0 H THR A 37 -8.363 3.871 -53.505 1.00 3.30 H new ATOM 0 HA THR A 37 -5.504 3.550 -53.883 1.00 24.35 H new ATOM 0 HB THR A 37 -5.512 5.876 -52.865 1.00 1.54 H new ATOM 0 HG1 THR A 37 -7.756 5.358 -51.911 1.00 11.45 H new ATOM 0 HG21 THR A 37 -6.457 6.959 -54.867 1.00 41.04 H new ATOM 0 HG22 THR A 37 -5.479 5.534 -55.294 1.00 41.04 H new ATOM 0 HG23 THR A 37 -7.256 5.432 -55.313 1.00 41.04 H new ATOM 509 N HIS A 38 -4.866 2.847 -51.600 1.00 61.02 N ATOM 510 CA HIS A 38 -4.454 2.429 -50.272 1.00 23.14 C ATOM 511 C HIS A 38 -3.041 2.890 -49.980 1.00 42.31 C ATOM 512 O HIS A 38 -2.078 2.394 -50.575 1.00 54.34 O ATOM 513 CB HIS A 38 -4.555 0.911 -50.114 1.00 44.45 C ATOM 514 CG HIS A 38 -5.953 0.383 -50.172 1.00 55.04 C ATOM 515 ND1 HIS A 38 -6.396 -0.463 -51.160 1.00 23.41 N ATOM 516 CD2 HIS A 38 -7.006 0.572 -49.344 1.00 74.41 C ATOM 517 CE1 HIS A 38 -7.655 -0.772 -50.940 1.00 12.33 C ATOM 518 NE2 HIS A 38 -8.051 -0.158 -49.844 1.00 23.25 N ATOM 0 H HIS A 38 -4.229 2.570 -52.347 1.00 61.02 H new ATOM 0 HA HIS A 38 -5.130 2.893 -49.554 1.00 23.14 H new ATOM 0 HB2 HIS A 38 -3.965 0.435 -50.897 1.00 44.45 H new ATOM 0 HB3 HIS A 38 -4.109 0.625 -49.161 1.00 44.45 H new ATOM 0 HD2 HIS A 38 -7.020 1.184 -48.455 1.00 74.41 H new ATOM 0 HE1 HIS A 38 -8.262 -1.420 -51.555 1.00 12.33 H new ATOM 0 HE2 HIS A 38 -8.983 -0.217 -49.435 1.00 23.25 H new ATOM 527 N GLY A 39 -2.920 3.841 -49.083 1.00 21.24 N ATOM 528 CA GLY A 39 -1.626 4.353 -48.707 1.00 55.21 C ATOM 529 C GLY A 39 -1.454 4.373 -47.208 1.00 5.50 C ATOM 530 O GLY A 39 -1.461 5.437 -46.589 1.00 4.44 O ATOM 0 H GLY A 39 -3.706 4.276 -48.600 1.00 21.24 H new ATOM 0 HA2 GLY A 39 -0.846 3.738 -49.156 1.00 55.21 H new ATOM 0 HA3 GLY A 39 -1.504 5.362 -49.102 1.00 55.21 H new ATOM 534 N ALA A 40 -1.290 3.198 -46.627 1.00 11.35 N ATOM 535 CA ALA A 40 -1.137 3.055 -45.190 1.00 14.10 C ATOM 536 C ALA A 40 -0.594 1.675 -44.870 1.00 42.33 C ATOM 537 O ALA A 40 -0.277 0.909 -45.785 1.00 64.33 O ATOM 538 CB ALA A 40 -2.475 3.277 -44.489 1.00 1.13 C ATOM 0 H ALA A 40 -1.259 2.316 -47.138 1.00 11.35 H new ATOM 0 HA ALA A 40 -0.434 3.806 -44.830 1.00 14.10 H new ATOM 0 HB1 ALA A 40 -2.344 3.167 -43.412 1.00 1.13 H new ATOM 0 HB2 ALA A 40 -2.839 4.280 -44.709 1.00 1.13 H new ATOM 0 HB3 ALA A 40 -3.198 2.543 -44.844 1.00 1.13 H new ATOM 544 N ALA A 41 -0.488 1.363 -43.576 1.00 31.03 N ATOM 545 CA ALA A 41 0.042 0.081 -43.112 1.00 32.45 C ATOM 546 C ALA A 41 1.406 -0.205 -43.735 1.00 35.01 C ATOM 547 O ALA A 41 1.558 -1.115 -44.561 1.00 51.42 O ATOM 548 CB ALA A 41 -0.942 -1.053 -43.398 1.00 41.35 C ATOM 0 H ALA A 41 -0.767 1.991 -42.823 1.00 31.03 H new ATOM 0 HA ALA A 41 0.175 0.144 -42.032 1.00 32.45 H new ATOM 0 HB1 ALA A 41 -0.524 -1.995 -43.043 1.00 41.35 H new ATOM 0 HB2 ALA A 41 -1.883 -0.857 -42.884 1.00 41.35 H new ATOM 0 HB3 ALA A 41 -1.122 -1.117 -44.471 1.00 41.35 H new ATOM 554 N MET A 42 2.397 0.570 -43.333 1.00 71.52 N ATOM 555 CA MET A 42 3.743 0.451 -43.877 1.00 22.05 C ATOM 556 C MET A 42 4.772 0.726 -42.794 1.00 60.32 C ATOM 557 O MET A 42 4.822 1.826 -42.241 1.00 64.00 O ATOM 558 CB MET A 42 3.948 1.444 -45.034 1.00 31.02 C ATOM 559 CG MET A 42 3.090 1.171 -46.262 1.00 61.23 C ATOM 560 SD MET A 42 3.235 2.460 -47.520 1.00 32.14 S ATOM 561 CE MET A 42 2.550 3.869 -46.646 1.00 73.15 C ATOM 0 H MET A 42 2.296 1.297 -42.624 1.00 71.52 H new ATOM 0 HA MET A 42 3.870 -0.565 -44.251 1.00 22.05 H new ATOM 0 HB2 MET A 42 3.734 2.450 -44.674 1.00 31.02 H new ATOM 0 HB3 MET A 42 4.997 1.427 -45.329 1.00 31.02 H new ATOM 0 HG2 MET A 42 3.378 0.213 -46.695 1.00 61.23 H new ATOM 0 HG3 MET A 42 2.047 1.082 -45.958 1.00 61.23 H new ATOM 0 HE1 MET A 42 2.209 4.613 -47.366 1.00 73.15 H new ATOM 0 HE2 MET A 42 1.709 3.544 -46.034 1.00 73.15 H new ATOM 0 HE3 MET A 42 3.316 4.308 -46.006 1.00 73.15 H new ATOM 571 N PRO A 43 5.605 -0.270 -42.473 1.00 60.20 N ATOM 572 CA PRO A 43 6.624 -0.143 -41.437 1.00 33.13 C ATOM 573 C PRO A 43 7.853 0.618 -41.923 1.00 74.31 C ATOM 574 O PRO A 43 8.117 0.690 -43.128 1.00 53.15 O ATOM 575 CB PRO A 43 6.985 -1.592 -41.127 1.00 34.02 C ATOM 576 CG PRO A 43 6.757 -2.319 -42.409 1.00 50.44 C ATOM 577 CD PRO A 43 5.623 -1.609 -43.106 1.00 53.20 C ATOM 0 HA PRO A 43 6.265 0.419 -40.575 1.00 33.13 H new ATOM 0 HB2 PRO A 43 8.021 -1.681 -40.800 1.00 34.02 H new ATOM 0 HB3 PRO A 43 6.362 -1.993 -40.327 1.00 34.02 H new ATOM 0 HG2 PRO A 43 7.656 -2.312 -43.025 1.00 50.44 H new ATOM 0 HG3 PRO A 43 6.506 -3.363 -42.224 1.00 50.44 H new ATOM 0 HD2 PRO A 43 5.793 -1.542 -44.181 1.00 53.20 H new ATOM 0 HD3 PRO A 43 4.677 -2.131 -42.965 1.00 53.20 H new ATOM 585 N THR A 44 8.580 1.206 -40.989 1.00 15.32 N ATOM 586 CA THR A 44 9.789 1.930 -41.308 1.00 52.21 C ATOM 587 C THR A 44 10.657 2.087 -40.056 1.00 32.24 C ATOM 588 O THR A 44 10.133 2.180 -38.940 1.00 1.54 O ATOM 589 CB THR A 44 9.476 3.321 -41.927 1.00 33.22 C ATOM 590 OG1 THR A 44 10.686 3.959 -42.352 1.00 50.32 O ATOM 591 CG2 THR A 44 8.757 4.218 -40.928 1.00 52.23 C ATOM 0 H THR A 44 8.348 1.193 -39.996 1.00 15.32 H new ATOM 0 HA THR A 44 10.337 1.353 -42.052 1.00 52.21 H new ATOM 0 HB THR A 44 8.825 3.163 -42.787 1.00 33.22 H new ATOM 0 HG1 THR A 44 10.475 4.833 -42.742 1.00 50.32 H new ATOM 0 HG21 THR A 44 8.551 5.184 -41.389 1.00 52.23 H new ATOM 0 HG22 THR A 44 7.818 3.751 -40.629 1.00 52.23 H new ATOM 0 HG23 THR A 44 9.386 4.362 -40.050 1.00 52.23 H new ATOM 599 N LEU A 45 11.977 2.082 -40.251 1.00 72.15 N ATOM 600 CA LEU A 45 12.948 2.250 -39.166 1.00 1.41 C ATOM 601 C LEU A 45 12.847 1.122 -38.129 1.00 31.33 C ATOM 602 O LEU A 45 12.209 0.086 -38.372 1.00 24.24 O ATOM 603 CB LEU A 45 12.777 3.621 -38.493 1.00 33.12 C ATOM 604 CG LEU A 45 12.903 4.838 -39.414 1.00 63.42 C ATOM 605 CD1 LEU A 45 12.736 6.121 -38.622 1.00 31.54 C ATOM 606 CD2 LEU A 45 14.239 4.830 -40.143 1.00 2.43 C ATOM 0 H LEU A 45 12.405 1.961 -41.169 1.00 72.15 H new ATOM 0 HA LEU A 45 13.943 2.199 -39.608 1.00 1.41 H new ATOM 0 HB2 LEU A 45 11.797 3.650 -38.016 1.00 33.12 H new ATOM 0 HB3 LEU A 45 13.520 3.711 -37.701 1.00 33.12 H new ATOM 0 HG LEU A 45 12.110 4.785 -40.160 1.00 63.42 H new ATOM 0 HD11 LEU A 45 12.828 6.976 -39.291 1.00 31.54 H new ATOM 0 HD12 LEU A 45 11.753 6.133 -38.152 1.00 31.54 H new ATOM 0 HD13 LEU A 45 13.507 6.177 -37.853 1.00 31.54 H new ATOM 0 HD21 LEU A 45 14.305 5.704 -40.791 1.00 2.43 H new ATOM 0 HD22 LEU A 45 15.050 4.855 -39.416 1.00 2.43 H new ATOM 0 HD23 LEU A 45 14.320 3.925 -40.745 1.00 2.43 H new ATOM 618 N SER A 46 13.481 1.327 -36.984 1.00 21.44 N ATOM 619 CA SER A 46 13.493 0.349 -35.917 1.00 1.41 C ATOM 620 C SER A 46 13.982 1.002 -34.629 1.00 23.31 C ATOM 621 O SER A 46 15.176 1.246 -34.459 1.00 63.43 O ATOM 622 CB SER A 46 14.397 -0.838 -36.293 1.00 53.23 C ATOM 623 OG SER A 46 14.395 -1.841 -35.285 1.00 75.11 O ATOM 0 H SER A 46 14.001 2.179 -36.773 1.00 21.44 H new ATOM 0 HA SER A 46 12.481 -0.025 -35.763 1.00 1.41 H new ATOM 0 HB2 SER A 46 14.059 -1.269 -37.235 1.00 53.23 H new ATOM 0 HB3 SER A 46 15.416 -0.484 -36.452 1.00 53.23 H new ATOM 0 HG SER A 46 14.978 -2.580 -35.558 1.00 75.11 H new ATOM 629 N SER A 47 13.059 1.306 -33.744 1.00 21.15 N ATOM 630 CA SER A 47 13.393 1.948 -32.490 1.00 2.53 C ATOM 631 C SER A 47 13.046 1.048 -31.309 1.00 33.01 C ATOM 632 O SER A 47 12.275 0.089 -31.451 1.00 71.20 O ATOM 633 CB SER A 47 12.658 3.282 -32.371 1.00 31.52 C ATOM 634 OG SER A 47 12.969 4.131 -33.468 1.00 24.25 O ATOM 0 H SER A 47 12.064 1.118 -33.870 1.00 21.15 H new ATOM 0 HA SER A 47 14.467 2.132 -32.474 1.00 2.53 H new ATOM 0 HB2 SER A 47 11.583 3.108 -32.334 1.00 31.52 H new ATOM 0 HB3 SER A 47 12.934 3.772 -31.437 1.00 31.52 H new ATOM 0 HG SER A 47 12.487 4.979 -33.373 1.00 24.25 H new ATOM 640 N ALA A 48 13.618 1.361 -30.155 1.00 33.33 N ATOM 641 CA ALA A 48 13.387 0.604 -28.936 1.00 2.45 C ATOM 642 C ALA A 48 13.798 1.432 -27.728 1.00 74.03 C ATOM 643 O ALA A 48 14.710 2.263 -27.818 1.00 0.51 O ATOM 644 CB ALA A 48 14.164 -0.707 -28.967 1.00 64.23 C ATOM 0 H ALA A 48 14.256 2.148 -30.039 1.00 33.33 H new ATOM 0 HA ALA A 48 12.325 0.372 -28.863 1.00 2.45 H new ATOM 0 HB1 ALA A 48 13.980 -1.261 -28.047 1.00 64.23 H new ATOM 0 HB2 ALA A 48 13.839 -1.302 -29.820 1.00 64.23 H new ATOM 0 HB3 ALA A 48 15.230 -0.496 -29.056 1.00 64.23 H new ATOM 650 N THR A 49 13.133 1.209 -26.607 1.00 24.44 N ATOM 651 CA THR A 49 13.418 1.942 -25.384 1.00 61.11 C ATOM 652 C THR A 49 13.174 1.080 -24.149 1.00 33.43 C ATOM 653 O THR A 49 12.027 0.808 -23.780 1.00 11.02 O ATOM 654 CB THR A 49 12.579 3.245 -25.284 1.00 12.33 C ATOM 655 OG1 THR A 49 11.310 3.068 -25.938 1.00 60.20 O ATOM 656 CG2 THR A 49 13.316 4.425 -25.903 1.00 22.03 C ATOM 0 H THR A 49 12.386 0.520 -26.518 1.00 24.44 H new ATOM 0 HA THR A 49 14.473 2.213 -25.423 1.00 61.11 H new ATOM 0 HB THR A 49 12.417 3.459 -24.228 1.00 12.33 H new ATOM 0 HG1 THR A 49 10.788 3.894 -25.868 1.00 60.20 H new ATOM 0 HG21 THR A 49 12.703 5.322 -25.817 1.00 22.03 H new ATOM 0 HG22 THR A 49 14.260 4.579 -25.380 1.00 22.03 H new ATOM 0 HG23 THR A 49 13.513 4.219 -26.955 1.00 22.03 H new ATOM 664 N ALA A 50 14.259 0.648 -23.529 1.00 4.24 N ATOM 665 CA ALA A 50 14.214 -0.164 -22.323 1.00 11.21 C ATOM 666 C ALA A 50 15.587 -0.190 -21.676 1.00 53.32 C ATOM 667 O ALA A 50 16.413 -1.053 -21.974 1.00 74.03 O ATOM 668 CB ALA A 50 13.741 -1.581 -22.630 1.00 25.24 C ATOM 0 H ALA A 50 15.205 0.852 -23.851 1.00 4.24 H new ATOM 0 HA ALA A 50 13.498 0.280 -21.631 1.00 11.21 H new ATOM 0 HB1 ALA A 50 13.718 -2.164 -21.709 1.00 25.24 H new ATOM 0 HB2 ALA A 50 12.741 -1.545 -23.062 1.00 25.24 H new ATOM 0 HB3 ALA A 50 14.426 -2.048 -23.338 1.00 25.24 H new ATOM 674 N GLN A 51 15.833 0.782 -20.820 1.00 25.32 N ATOM 675 CA GLN A 51 17.119 0.930 -20.156 1.00 13.24 C ATOM 676 C GLN A 51 17.206 0.077 -18.887 1.00 31.25 C ATOM 677 O GLN A 51 16.473 0.306 -17.924 1.00 33.03 O ATOM 678 CB GLN A 51 17.371 2.409 -19.824 1.00 21.20 C ATOM 679 CG GLN A 51 16.218 3.078 -19.087 1.00 4.24 C ATOM 680 CD GLN A 51 16.509 4.509 -18.704 1.00 45.54 C ATOM 681 OE1 GLN A 51 17.252 5.212 -19.387 1.00 13.13 O ATOM 682 NE2 GLN A 51 15.917 4.953 -17.617 1.00 65.24 N ATOM 0 H GLN A 51 15.149 1.493 -20.563 1.00 25.32 H new ATOM 0 HA GLN A 51 17.890 0.577 -20.840 1.00 13.24 H new ATOM 0 HB2 GLN A 51 18.273 2.487 -19.216 1.00 21.20 H new ATOM 0 HB3 GLN A 51 17.562 2.952 -20.749 1.00 21.20 H new ATOM 0 HG2 GLN A 51 15.328 3.051 -19.716 1.00 4.24 H new ATOM 0 HG3 GLN A 51 15.990 2.507 -18.187 1.00 4.24 H new ATOM 0 HE21 GLN A 51 15.308 4.336 -17.080 1.00 65.24 H new ATOM 0 HE22 GLN A 51 16.067 5.915 -17.311 1.00 65.24 H new ATOM 691 N PRO A 52 18.092 -0.932 -18.876 1.00 64.21 N ATOM 692 CA PRO A 52 18.314 -1.766 -17.699 1.00 2.22 C ATOM 693 C PRO A 52 19.037 -0.981 -16.609 1.00 3.11 C ATOM 694 O PRO A 52 20.233 -0.688 -16.728 1.00 54.44 O ATOM 695 CB PRO A 52 19.206 -2.912 -18.211 1.00 54.12 C ATOM 696 CG PRO A 52 19.204 -2.788 -19.701 1.00 74.15 C ATOM 697 CD PRO A 52 18.930 -1.348 -20.004 1.00 51.03 C ATOM 0 HA PRO A 52 17.381 -2.120 -17.260 1.00 2.22 H new ATOM 0 HB2 PRO A 52 20.217 -2.830 -17.812 1.00 54.12 H new ATOM 0 HB3 PRO A 52 18.818 -3.881 -17.898 1.00 54.12 H new ATOM 0 HG2 PRO A 52 20.163 -3.097 -20.118 1.00 74.15 H new ATOM 0 HG3 PRO A 52 18.442 -3.430 -20.143 1.00 74.15 H new ATOM 0 HD2 PRO A 52 19.849 -0.765 -20.062 1.00 51.03 H new ATOM 0 HD3 PRO A 52 18.415 -1.226 -20.957 1.00 51.03 H new ATOM 705 N LEU A 53 18.313 -0.628 -15.564 1.00 34.22 N ATOM 706 CA LEU A 53 18.870 0.161 -14.480 1.00 31.04 C ATOM 707 C LEU A 53 19.212 -0.712 -13.280 1.00 44.00 C ATOM 708 O LEU A 53 18.345 -1.396 -12.733 1.00 2.33 O ATOM 709 CB LEU A 53 17.889 1.258 -14.056 1.00 43.22 C ATOM 710 CG LEU A 53 17.507 2.272 -15.137 1.00 64.21 C ATOM 711 CD1 LEU A 53 16.483 3.257 -14.599 1.00 3.10 C ATOM 712 CD2 LEU A 53 18.740 3.010 -15.643 1.00 4.53 C ATOM 0 H LEU A 53 17.331 -0.877 -15.442 1.00 34.22 H new ATOM 0 HA LEU A 53 19.788 0.621 -14.845 1.00 31.04 H new ATOM 0 HB2 LEU A 53 16.978 0.782 -13.694 1.00 43.22 H new ATOM 0 HB3 LEU A 53 18.322 1.799 -13.215 1.00 43.22 H new ATOM 0 HG LEU A 53 17.065 1.732 -15.974 1.00 64.21 H new ATOM 0 HD11 LEU A 53 16.221 3.972 -15.379 1.00 3.10 H new ATOM 0 HD12 LEU A 53 15.589 2.718 -14.286 1.00 3.10 H new ATOM 0 HD13 LEU A 53 16.903 3.789 -13.746 1.00 3.10 H new ATOM 0 HD21 LEU A 53 18.446 3.726 -16.411 1.00 4.53 H new ATOM 0 HD22 LEU A 53 19.213 3.539 -14.815 1.00 4.53 H new ATOM 0 HD23 LEU A 53 19.445 2.294 -16.065 1.00 4.53 H new ATOM 724 N PRO A 54 20.484 -0.711 -12.867 1.00 62.02 N ATOM 725 CA PRO A 54 20.930 -1.459 -11.699 1.00 51.31 C ATOM 726 C PRO A 54 20.662 -0.686 -10.405 1.00 52.45 C ATOM 727 O PRO A 54 20.500 0.542 -10.435 1.00 41.44 O ATOM 728 CB PRO A 54 22.429 -1.596 -11.936 1.00 14.04 C ATOM 729 CG PRO A 54 22.804 -0.367 -12.695 1.00 50.13 C ATOM 730 CD PRO A 54 21.596 0.011 -13.519 1.00 60.02 C ATOM 0 HA PRO A 54 20.414 -2.412 -11.584 1.00 51.31 H new ATOM 0 HB2 PRO A 54 22.975 -1.663 -10.995 1.00 14.04 H new ATOM 0 HB3 PRO A 54 22.660 -2.498 -12.503 1.00 14.04 H new ATOM 0 HG2 PRO A 54 23.079 0.440 -12.016 1.00 50.13 H new ATOM 0 HG3 PRO A 54 23.667 -0.554 -13.334 1.00 50.13 H new ATOM 0 HD2 PRO A 54 21.430 1.088 -13.515 1.00 60.02 H new ATOM 0 HD3 PRO A 54 21.712 -0.290 -14.560 1.00 60.02 H new ATOM 738 N VAL A 55 20.618 -1.407 -9.280 1.00 74.04 N ATOM 739 CA VAL A 55 20.365 -0.816 -7.953 1.00 33.34 C ATOM 740 C VAL A 55 18.895 -0.393 -7.800 1.00 2.14 C ATOM 741 O VAL A 55 18.271 0.090 -8.748 1.00 53.02 O ATOM 742 CB VAL A 55 21.303 0.398 -7.660 1.00 3.35 C ATOM 743 CG1 VAL A 55 21.043 0.981 -6.275 1.00 52.44 C ATOM 744 CG2 VAL A 55 22.760 -0.013 -7.792 1.00 23.44 C ATOM 0 H VAL A 55 20.756 -2.417 -9.259 1.00 74.04 H new ATOM 0 HA VAL A 55 20.585 -1.594 -7.222 1.00 33.34 H new ATOM 0 HB VAL A 55 21.085 1.171 -8.396 1.00 3.35 H new ATOM 0 HG11 VAL A 55 21.713 1.824 -6.103 1.00 52.44 H new ATOM 0 HG12 VAL A 55 20.009 1.320 -6.211 1.00 52.44 H new ATOM 0 HG13 VAL A 55 21.221 0.216 -5.519 1.00 52.44 H new ATOM 0 HG21 VAL A 55 23.400 0.845 -7.585 1.00 23.44 H new ATOM 0 HG22 VAL A 55 22.979 -0.810 -7.081 1.00 23.44 H new ATOM 0 HG23 VAL A 55 22.947 -0.369 -8.805 1.00 23.44 H new ATOM 754 N ALA A 56 18.354 -0.571 -6.601 1.00 23.43 N ATOM 755 CA ALA A 56 16.970 -0.228 -6.318 1.00 45.21 C ATOM 756 C ALA A 56 16.736 -0.128 -4.818 1.00 71.33 C ATOM 757 O ALA A 56 17.236 -0.945 -4.042 1.00 71.21 O ATOM 758 CB ALA A 56 16.030 -1.263 -6.924 1.00 63.22 C ATOM 0 H ALA A 56 18.861 -0.955 -5.803 1.00 23.43 H new ATOM 0 HA ALA A 56 16.763 0.743 -6.768 1.00 45.21 H new ATOM 0 HB1 ALA A 56 14.998 -0.991 -6.703 1.00 63.22 H new ATOM 0 HB2 ALA A 56 16.173 -1.296 -8.004 1.00 63.22 H new ATOM 0 HB3 ALA A 56 16.246 -2.243 -6.499 1.00 63.22 H new ATOM 764 N SER A 57 15.984 0.876 -4.424 1.00 61.22 N ATOM 765 CA SER A 57 15.666 1.122 -3.031 1.00 11.20 C ATOM 766 C SER A 57 14.456 2.037 -2.964 1.00 33.45 C ATOM 767 O SER A 57 14.264 2.865 -3.852 1.00 14.23 O ATOM 768 CB SER A 57 16.870 1.768 -2.321 1.00 4.43 C ATOM 769 OG SER A 57 16.594 2.037 -0.953 1.00 10.04 O ATOM 0 H SER A 57 15.571 1.552 -5.066 1.00 61.22 H new ATOM 0 HA SER A 57 15.440 0.181 -2.528 1.00 11.20 H new ATOM 0 HB2 SER A 57 17.733 1.106 -2.394 1.00 4.43 H new ATOM 0 HB3 SER A 57 17.136 2.696 -2.827 1.00 4.43 H new ATOM 0 HG SER A 57 17.381 2.445 -0.535 1.00 10.04 H new ATOM 775 N ALA A 58 13.625 1.869 -1.942 1.00 75.34 N ATOM 776 CA ALA A 58 12.430 2.686 -1.798 1.00 54.25 C ATOM 777 C ALA A 58 12.786 4.109 -1.379 1.00 14.21 C ATOM 778 O ALA A 58 13.273 4.338 -0.263 1.00 65.01 O ATOM 779 CB ALA A 58 11.475 2.061 -0.791 1.00 22.32 C ATOM 0 H ALA A 58 13.757 1.177 -1.204 1.00 75.34 H new ATOM 0 HA ALA A 58 11.935 2.732 -2.768 1.00 54.25 H new ATOM 0 HB1 ALA A 58 10.587 2.685 -0.696 1.00 22.32 H new ATOM 0 HB2 ALA A 58 11.185 1.067 -1.133 1.00 22.32 H new ATOM 0 HB3 ALA A 58 11.968 1.982 0.178 1.00 22.32 H new ATOM 785 N PRO A 59 12.560 5.083 -2.266 1.00 65.04 N ATOM 786 CA PRO A 59 12.822 6.473 -1.997 1.00 43.40 C ATOM 787 C PRO A 59 11.542 7.228 -1.656 1.00 22.43 C ATOM 788 O PRO A 59 10.442 6.661 -1.688 1.00 5.31 O ATOM 789 CB PRO A 59 13.356 6.943 -3.346 1.00 72.11 C ATOM 790 CG PRO A 59 12.579 6.143 -4.360 1.00 5.35 C ATOM 791 CD PRO A 59 12.063 4.905 -3.642 1.00 25.44 C ATOM 0 HA PRO A 59 13.491 6.635 -1.152 1.00 43.40 H new ATOM 0 HB2 PRO A 59 13.202 8.013 -3.483 1.00 72.11 H new ATOM 0 HB3 PRO A 59 14.427 6.761 -3.434 1.00 72.11 H new ATOM 0 HG2 PRO A 59 11.753 6.728 -4.763 1.00 5.35 H new ATOM 0 HG3 PRO A 59 13.214 5.865 -5.202 1.00 5.35 H new ATOM 0 HD2 PRO A 59 10.975 4.846 -3.673 1.00 25.44 H new ATOM 0 HD3 PRO A 59 12.445 3.989 -4.093 1.00 25.44 H new ATOM 799 N VAL A 60 11.677 8.493 -1.325 1.00 23.30 N ATOM 800 CA VAL A 60 10.517 9.319 -1.078 1.00 43.04 C ATOM 801 C VAL A 60 10.061 9.933 -2.386 1.00 12.24 C ATOM 802 O VAL A 60 10.877 10.170 -3.283 1.00 22.14 O ATOM 803 CB VAL A 60 10.785 10.428 -0.033 1.00 22.34 C ATOM 804 CG1 VAL A 60 11.097 9.815 1.320 1.00 40.23 C ATOM 805 CG2 VAL A 60 11.915 11.342 -0.480 1.00 31.42 C ATOM 0 H VAL A 60 12.573 8.970 -1.221 1.00 23.30 H new ATOM 0 HA VAL A 60 9.736 8.682 -0.663 1.00 43.04 H new ATOM 0 HB VAL A 60 9.883 11.033 0.058 1.00 22.34 H new ATOM 0 HG11 VAL A 60 11.283 10.608 2.044 1.00 40.23 H new ATOM 0 HG12 VAL A 60 10.251 9.213 1.651 1.00 40.23 H new ATOM 0 HG13 VAL A 60 11.982 9.183 1.238 1.00 40.23 H new ATOM 0 HG21 VAL A 60 12.081 12.111 0.274 1.00 31.42 H new ATOM 0 HG22 VAL A 60 12.826 10.758 -0.609 1.00 31.42 H new ATOM 0 HG23 VAL A 60 11.649 11.813 -1.426 1.00 31.42 H new ATOM 815 N LEU A 61 8.783 10.178 -2.513 1.00 11.30 N ATOM 816 CA LEU A 61 8.259 10.695 -3.749 1.00 10.21 C ATOM 817 C LEU A 61 8.228 12.218 -3.741 1.00 33.00 C ATOM 818 O LEU A 61 7.241 12.842 -3.345 1.00 5.15 O ATOM 819 CB LEU A 61 6.874 10.096 -4.029 1.00 41.14 C ATOM 820 CG LEU A 61 6.202 10.501 -5.345 1.00 31.50 C ATOM 821 CD1 LEU A 61 7.161 10.345 -6.513 1.00 43.12 C ATOM 822 CD2 LEU A 61 4.960 9.655 -5.574 1.00 4.10 C ATOM 0 H LEU A 61 8.090 10.029 -1.780 1.00 11.30 H new ATOM 0 HA LEU A 61 8.923 10.397 -4.560 1.00 10.21 H new ATOM 0 HB2 LEU A 61 6.964 9.010 -4.013 1.00 41.14 H new ATOM 0 HB3 LEU A 61 6.211 10.373 -3.209 1.00 41.14 H new ATOM 0 HG LEU A 61 5.915 11.550 -5.276 1.00 31.50 H new ATOM 0 HD11 LEU A 61 6.661 10.639 -7.436 1.00 43.12 H new ATOM 0 HD12 LEU A 61 8.033 10.980 -6.355 1.00 43.12 H new ATOM 0 HD13 LEU A 61 7.478 9.305 -6.587 1.00 43.12 H new ATOM 0 HD21 LEU A 61 4.488 9.949 -6.511 1.00 4.10 H new ATOM 0 HD22 LEU A 61 5.240 8.603 -5.623 1.00 4.10 H new ATOM 0 HD23 LEU A 61 4.260 9.806 -4.752 1.00 4.10 H new ATOM 834 N SER A 62 9.330 12.808 -4.159 1.00 75.13 N ATOM 835 CA SER A 62 9.434 14.240 -4.247 1.00 53.24 C ATOM 836 C SER A 62 9.432 14.672 -5.707 1.00 65.23 C ATOM 837 O SER A 62 10.473 14.992 -6.279 1.00 31.03 O ATOM 838 CB SER A 62 10.694 14.738 -3.539 1.00 64.12 C ATOM 839 OG SER A 62 10.725 14.310 -2.185 1.00 62.34 O ATOM 0 H SER A 62 10.171 12.306 -4.444 1.00 75.13 H new ATOM 0 HA SER A 62 8.572 14.683 -3.748 1.00 53.24 H new ATOM 0 HB2 SER A 62 11.577 14.369 -4.060 1.00 64.12 H new ATOM 0 HB3 SER A 62 10.731 15.827 -3.580 1.00 64.12 H new ATOM 0 HG SER A 62 11.542 14.641 -1.756 1.00 62.34 H new ATOM 845 N ALA A 63 8.265 14.624 -6.311 1.00 31.41 N ATOM 846 CA ALA A 63 8.088 15.016 -7.694 1.00 14.22 C ATOM 847 C ALA A 63 6.819 15.849 -7.818 1.00 24.50 C ATOM 848 O ALA A 63 6.007 15.861 -6.886 1.00 32.41 O ATOM 849 CB ALA A 63 8.016 13.769 -8.579 1.00 54.32 C ATOM 0 H ALA A 63 7.408 14.311 -5.856 1.00 31.41 H new ATOM 0 HA ALA A 63 8.935 15.617 -8.024 1.00 14.22 H new ATOM 0 HB1 ALA A 63 7.883 14.068 -9.619 1.00 54.32 H new ATOM 0 HB2 ALA A 63 8.940 13.199 -8.481 1.00 54.32 H new ATOM 0 HB3 ALA A 63 7.174 13.151 -8.269 1.00 54.32 H new ATOM 855 N PRO A 64 6.642 16.596 -8.928 1.00 62.53 N ATOM 856 CA PRO A 64 5.413 17.362 -9.170 1.00 40.55 C ATOM 857 C PRO A 64 4.190 16.449 -9.132 1.00 61.15 C ATOM 858 O PRO A 64 4.050 15.551 -9.960 1.00 14.02 O ATOM 859 CB PRO A 64 5.612 17.944 -10.581 1.00 53.11 C ATOM 860 CG PRO A 64 6.752 17.175 -11.167 1.00 14.53 C ATOM 861 CD PRO A 64 7.617 16.778 -10.013 1.00 24.20 C ATOM 0 HA PRO A 64 5.242 18.131 -8.416 1.00 40.55 H new ATOM 0 HB2 PRO A 64 4.711 17.832 -11.184 1.00 53.11 H new ATOM 0 HB3 PRO A 64 5.837 19.010 -10.539 1.00 53.11 H new ATOM 0 HG2 PRO A 64 6.395 16.298 -11.707 1.00 14.53 H new ATOM 0 HG3 PRO A 64 7.308 17.784 -11.880 1.00 14.53 H new ATOM 0 HD2 PRO A 64 8.171 15.862 -10.218 1.00 24.20 H new ATOM 0 HD3 PRO A 64 8.351 17.547 -9.773 1.00 24.20 H new ATOM 869 N LEU A 65 3.302 16.694 -8.182 1.00 31.41 N ATOM 870 CA LEU A 65 2.150 15.826 -7.969 1.00 42.23 C ATOM 871 C LEU A 65 1.181 15.876 -9.145 1.00 12.44 C ATOM 872 O LEU A 65 0.918 16.938 -9.709 1.00 41.43 O ATOM 873 CB LEU A 65 1.442 16.193 -6.649 1.00 23.53 C ATOM 874 CG LEU A 65 0.866 17.615 -6.554 1.00 62.45 C ATOM 875 CD1 LEU A 65 -0.591 17.652 -6.995 1.00 75.43 C ATOM 876 CD2 LEU A 65 1.013 18.160 -5.144 1.00 1.04 C ATOM 0 H LEU A 65 3.355 17.488 -7.544 1.00 31.41 H new ATOM 0 HA LEU A 65 2.511 14.800 -7.896 1.00 42.23 H new ATOM 0 HB2 LEU A 65 0.630 15.484 -6.489 1.00 23.53 H new ATOM 0 HB3 LEU A 65 2.150 16.056 -5.832 1.00 23.53 H new ATOM 0 HG LEU A 65 1.436 18.251 -7.231 1.00 62.45 H new ATOM 0 HD11 LEU A 65 -0.969 18.671 -6.916 1.00 75.43 H new ATOM 0 HD12 LEU A 65 -0.667 17.316 -8.029 1.00 75.43 H new ATOM 0 HD13 LEU A 65 -1.181 16.996 -6.356 1.00 75.43 H new ATOM 0 HD21 LEU A 65 0.599 19.167 -5.098 1.00 1.04 H new ATOM 0 HD22 LEU A 65 0.477 17.516 -4.447 1.00 1.04 H new ATOM 0 HD23 LEU A 65 2.068 18.189 -4.873 1.00 1.04 H new ATOM 888 N GLY A 66 0.680 14.712 -9.527 1.00 74.23 N ATOM 889 CA GLY A 66 -0.265 14.627 -10.621 1.00 64.43 C ATOM 890 C GLY A 66 0.406 14.311 -11.940 1.00 74.02 C ATOM 891 O GLY A 66 -0.176 13.646 -12.797 1.00 32.24 O ATOM 0 H GLY A 66 0.913 13.818 -9.095 1.00 74.23 H new ATOM 0 HA2 GLY A 66 -1.005 13.858 -10.399 1.00 64.43 H new ATOM 0 HA3 GLY A 66 -0.803 15.571 -10.707 1.00 64.43 H new ATOM 895 N SER A 67 1.624 14.798 -12.102 1.00 0.24 N ATOM 896 CA SER A 67 2.394 14.583 -13.313 1.00 41.15 C ATOM 897 C SER A 67 2.673 13.089 -13.550 1.00 62.13 C ATOM 898 O SER A 67 2.767 12.309 -12.602 1.00 43.20 O ATOM 899 CB SER A 67 3.692 15.368 -13.227 1.00 71.41 C ATOM 900 OG SER A 67 3.430 16.723 -12.897 1.00 33.13 O ATOM 0 H SER A 67 2.107 15.354 -11.396 1.00 0.24 H new ATOM 0 HA SER A 67 1.811 14.937 -14.164 1.00 41.15 H new ATOM 0 HB2 SER A 67 4.344 14.924 -12.475 1.00 71.41 H new ATOM 0 HB3 SER A 67 4.220 15.315 -14.179 1.00 71.41 H new ATOM 0 HG SER A 67 4.179 17.282 -13.193 1.00 33.13 H new ATOM 906 N HIS A 68 2.820 12.708 -14.819 1.00 34.32 N ATOM 907 CA HIS A 68 3.066 11.311 -15.193 1.00 31.20 C ATOM 908 C HIS A 68 4.358 10.799 -14.573 1.00 75.33 C ATOM 909 O HIS A 68 4.434 9.651 -14.141 1.00 53.11 O ATOM 910 CB HIS A 68 3.112 11.157 -16.719 1.00 74.53 C ATOM 911 CG HIS A 68 1.823 11.508 -17.401 1.00 4.14 C ATOM 912 ND1 HIS A 68 1.750 12.352 -18.485 1.00 10.20 N ATOM 913 CD2 HIS A 68 0.552 11.119 -17.147 1.00 1.14 C ATOM 914 CE1 HIS A 68 0.493 12.469 -18.864 1.00 64.33 C ATOM 915 NE2 HIS A 68 -0.252 11.731 -18.071 1.00 41.23 N ATOM 0 H HIS A 68 2.773 13.349 -15.611 1.00 34.32 H new ATOM 0 HA HIS A 68 2.240 10.713 -14.808 1.00 31.20 H new ATOM 0 HB2 HIS A 68 3.906 11.790 -17.115 1.00 74.53 H new ATOM 0 HB3 HIS A 68 3.373 10.127 -16.963 1.00 74.53 H new ATOM 0 HD2 HIS A 68 0.232 10.450 -16.362 1.00 1.14 H new ATOM 0 HE1 HIS A 68 0.135 13.070 -19.687 1.00 64.33 H new ATOM 0 HE2 HIS A 68 -1.265 11.631 -18.134 1.00 41.23 H new ATOM 924 N GLU A 69 5.368 11.662 -14.540 1.00 4.22 N ATOM 925 CA GLU A 69 6.655 11.337 -13.926 1.00 71.04 C ATOM 926 C GLU A 69 6.459 10.954 -12.452 1.00 32.03 C ATOM 927 O GLU A 69 7.087 10.021 -11.944 1.00 5.00 O ATOM 928 CB GLU A 69 7.593 12.539 -14.047 1.00 21.12 C ATOM 929 CG GLU A 69 8.988 12.314 -13.498 1.00 54.33 C ATOM 930 CD GLU A 69 9.852 13.550 -13.621 1.00 60.02 C ATOM 931 OE1 GLU A 69 9.700 14.470 -12.790 1.00 34.11 O ATOM 932 OE2 GLU A 69 10.681 13.614 -14.547 1.00 53.23 O ATOM 0 H GLU A 69 5.321 12.601 -14.935 1.00 4.22 H new ATOM 0 HA GLU A 69 7.097 10.486 -14.443 1.00 71.04 H new ATOM 0 HB2 GLU A 69 7.672 12.816 -15.098 1.00 21.12 H new ATOM 0 HB3 GLU A 69 7.145 13.386 -13.527 1.00 21.12 H new ATOM 0 HG2 GLU A 69 8.922 12.021 -12.450 1.00 54.33 H new ATOM 0 HG3 GLU A 69 9.459 11.488 -14.031 1.00 54.33 H new ATOM 939 N TRP A 70 5.560 11.665 -11.790 1.00 43.21 N ATOM 940 CA TRP A 70 5.233 11.421 -10.394 1.00 71.40 C ATOM 941 C TRP A 70 4.447 10.125 -10.258 1.00 33.11 C ATOM 942 O TRP A 70 4.697 9.331 -9.350 1.00 73.44 O ATOM 943 CB TRP A 70 4.403 12.610 -9.882 1.00 64.31 C ATOM 944 CG TRP A 70 3.887 12.501 -8.474 1.00 14.43 C ATOM 945 CD1 TRP A 70 4.513 12.919 -7.337 1.00 44.43 C ATOM 946 CD2 TRP A 70 2.618 11.972 -8.059 1.00 61.54 C ATOM 947 NE1 TRP A 70 3.721 12.673 -6.245 1.00 30.12 N ATOM 948 CE2 TRP A 70 2.554 12.091 -6.661 1.00 0.14 C ATOM 949 CE3 TRP A 70 1.536 11.405 -8.736 1.00 11.24 C ATOM 950 CZ2 TRP A 70 1.450 11.667 -5.926 1.00 75.01 C ATOM 951 CZ3 TRP A 70 0.442 10.983 -8.007 1.00 40.54 C ATOM 952 CH2 TRP A 70 0.407 11.117 -6.615 1.00 14.23 C ATOM 0 H TRP A 70 5.034 12.432 -12.208 1.00 43.21 H new ATOM 0 HA TRP A 70 6.145 11.323 -9.805 1.00 71.40 H new ATOM 0 HB2 TRP A 70 5.013 13.510 -9.955 1.00 64.31 H new ATOM 0 HB3 TRP A 70 3.552 12.747 -10.549 1.00 64.31 H new ATOM 0 HD1 TRP A 70 5.490 13.377 -7.302 1.00 44.43 H new ATOM 0 HE1 TRP A 70 3.963 12.889 -5.278 1.00 30.12 H new ATOM 0 HE3 TRP A 70 1.555 11.299 -9.811 1.00 11.24 H new ATOM 0 HZ2 TRP A 70 1.420 11.769 -4.851 1.00 75.01 H new ATOM 0 HZ3 TRP A 70 -0.400 10.542 -8.520 1.00 40.54 H new ATOM 0 HH2 TRP A 70 -0.464 10.778 -6.073 1.00 14.23 H new ATOM 963 N GLN A 71 3.519 9.902 -11.174 1.00 63.32 N ATOM 964 CA GLN A 71 2.703 8.699 -11.165 1.00 1.32 C ATOM 965 C GLN A 71 3.567 7.456 -11.396 1.00 5.21 C ATOM 966 O GLN A 71 3.452 6.471 -10.670 1.00 53.45 O ATOM 967 CB GLN A 71 1.609 8.801 -12.224 1.00 41.41 C ATOM 968 CG GLN A 71 0.689 9.992 -12.021 1.00 42.30 C ATOM 969 CD GLN A 71 -0.344 10.123 -13.111 1.00 71.23 C ATOM 970 OE1 GLN A 71 -0.111 10.770 -14.128 1.00 20.14 O ATOM 971 NE2 GLN A 71 -1.494 9.523 -12.904 1.00 71.44 N ATOM 0 H GLN A 71 3.311 10.544 -11.939 1.00 63.32 H new ATOM 0 HA GLN A 71 2.233 8.604 -10.186 1.00 1.32 H new ATOM 0 HB2 GLN A 71 2.071 8.871 -13.209 1.00 41.41 H new ATOM 0 HB3 GLN A 71 1.016 7.886 -12.214 1.00 41.41 H new ATOM 0 HG2 GLN A 71 0.186 9.897 -11.059 1.00 42.30 H new ATOM 0 HG3 GLN A 71 1.285 10.903 -11.980 1.00 42.30 H new ATOM 0 HE21 GLN A 71 -1.646 8.995 -12.045 1.00 71.44 H new ATOM 0 HE22 GLN A 71 -2.235 9.585 -13.603 1.00 71.44 H new ATOM 980 N GLN A 72 4.411 7.504 -12.428 1.00 60.43 N ATOM 981 CA GLN A 72 5.347 6.414 -12.724 1.00 74.10 C ATOM 982 C GLN A 72 6.198 6.070 -11.508 1.00 60.32 C ATOM 983 O GLN A 72 6.330 4.901 -11.145 1.00 13.34 O ATOM 984 CB GLN A 72 6.247 6.787 -13.902 1.00 33.23 C ATOM 985 CG GLN A 72 5.606 6.576 -15.266 1.00 23.03 C ATOM 986 CD GLN A 72 5.497 5.106 -15.635 1.00 21.11 C ATOM 987 OE1 GLN A 72 6.315 4.284 -15.218 1.00 4.02 O ATOM 988 NE2 GLN A 72 4.499 4.768 -16.423 1.00 54.53 N ATOM 0 H GLN A 72 4.467 8.289 -13.077 1.00 60.43 H new ATOM 0 HA GLN A 72 4.759 5.535 -12.989 1.00 74.10 H new ATOM 0 HB2 GLN A 72 6.537 7.833 -13.807 1.00 33.23 H new ATOM 0 HB3 GLN A 72 7.162 6.197 -13.847 1.00 33.23 H new ATOM 0 HG2 GLN A 72 4.612 7.023 -15.270 1.00 23.03 H new ATOM 0 HG3 GLN A 72 6.192 7.095 -16.024 1.00 23.03 H new ATOM 0 HE21 GLN A 72 3.842 5.478 -16.747 1.00 54.53 H new ATOM 0 HE22 GLN A 72 4.382 3.796 -16.709 1.00 54.53 H new ATOM 997 N THR A 73 6.751 7.093 -10.872 1.00 72.15 N ATOM 998 CA THR A 73 7.571 6.889 -9.692 1.00 3.11 C ATOM 999 C THR A 73 6.729 6.278 -8.565 1.00 21.34 C ATOM 1000 O THR A 73 7.197 5.404 -7.826 1.00 1.23 O ATOM 1001 CB THR A 73 8.210 8.209 -9.213 1.00 33.13 C ATOM 1002 OG1 THR A 73 8.885 8.842 -10.313 1.00 51.31 O ATOM 1003 CG2 THR A 73 9.214 7.947 -8.097 1.00 30.35 C ATOM 0 H THR A 73 6.646 8.068 -11.154 1.00 72.15 H new ATOM 0 HA THR A 73 8.375 6.203 -9.959 1.00 3.11 H new ATOM 0 HB THR A 73 7.421 8.858 -8.834 1.00 33.13 H new ATOM 0 HG1 THR A 73 8.228 9.293 -10.884 1.00 51.31 H new ATOM 0 HG21 THR A 73 9.653 8.891 -7.774 1.00 30.35 H new ATOM 0 HG22 THR A 73 8.707 7.475 -7.255 1.00 30.35 H new ATOM 0 HG23 THR A 73 10.001 7.287 -8.463 1.00 30.35 H new ATOM 1011 N PHE A 74 5.484 6.737 -8.454 1.00 55.44 N ATOM 1012 CA PHE A 74 4.548 6.196 -7.483 1.00 44.25 C ATOM 1013 C PHE A 74 4.354 4.699 -7.711 1.00 44.22 C ATOM 1014 O PHE A 74 4.442 3.912 -6.781 1.00 73.51 O ATOM 1015 CB PHE A 74 3.200 6.932 -7.564 1.00 4.23 C ATOM 1016 CG PHE A 74 2.142 6.379 -6.647 1.00 14.33 C ATOM 1017 CD1 PHE A 74 2.166 6.656 -5.291 1.00 12.23 C ATOM 1018 CD2 PHE A 74 1.120 5.585 -7.145 1.00 54.33 C ATOM 1019 CE1 PHE A 74 1.193 6.151 -4.448 1.00 61.43 C ATOM 1020 CE2 PHE A 74 0.145 5.077 -6.308 1.00 74.20 C ATOM 1021 CZ PHE A 74 0.183 5.360 -4.958 1.00 53.13 C ATOM 0 H PHE A 74 5.103 7.487 -9.031 1.00 55.44 H new ATOM 0 HA PHE A 74 4.960 6.345 -6.485 1.00 44.25 H new ATOM 0 HB2 PHE A 74 3.358 7.984 -7.326 1.00 4.23 H new ATOM 0 HB3 PHE A 74 2.835 6.888 -8.590 1.00 4.23 H new ATOM 0 HD1 PHE A 74 2.954 7.274 -4.887 1.00 12.23 H new ATOM 0 HD2 PHE A 74 1.086 5.361 -8.201 1.00 54.33 H new ATOM 0 HE1 PHE A 74 1.223 6.375 -3.392 1.00 61.43 H new ATOM 0 HE2 PHE A 74 -0.645 4.460 -6.710 1.00 74.20 H new ATOM 0 HZ PHE A 74 -0.577 4.963 -4.301 1.00 53.13 H new ATOM 1031 N SER A 75 4.086 4.312 -8.949 1.00 52.55 N ATOM 1032 CA SER A 75 3.917 2.910 -9.282 1.00 71.22 C ATOM 1033 C SER A 75 5.151 2.085 -8.907 1.00 53.40 C ATOM 1034 O SER A 75 5.029 1.032 -8.284 1.00 21.14 O ATOM 1035 CB SER A 75 3.602 2.756 -10.770 1.00 72.14 C ATOM 1036 OG SER A 75 2.420 3.463 -11.107 1.00 54.51 O ATOM 0 H SER A 75 3.981 4.950 -9.738 1.00 52.55 H new ATOM 0 HA SER A 75 3.079 2.528 -8.699 1.00 71.22 H new ATOM 0 HB2 SER A 75 4.437 3.128 -11.364 1.00 72.14 H new ATOM 0 HB3 SER A 75 3.483 1.700 -11.014 1.00 72.14 H new ATOM 0 HG SER A 75 2.596 4.427 -11.080 1.00 54.51 H new ATOM 1042 N GLN A 76 6.333 2.574 -9.278 1.00 31.14 N ATOM 1043 CA GLN A 76 7.584 1.866 -8.990 1.00 70.30 C ATOM 1044 C GLN A 76 7.752 1.584 -7.491 1.00 72.40 C ATOM 1045 O GLN A 76 8.105 0.464 -7.100 1.00 34.21 O ATOM 1046 CB GLN A 76 8.795 2.647 -9.513 1.00 3.10 C ATOM 1047 CG GLN A 76 8.741 2.964 -11.002 1.00 32.20 C ATOM 1048 CD GLN A 76 8.513 1.738 -11.874 1.00 5.15 C ATOM 1049 OE1 GLN A 76 8.905 0.622 -11.524 1.00 24.45 O ATOM 1050 NE2 GLN A 76 7.886 1.942 -13.017 1.00 62.54 N ATOM 0 H GLN A 76 6.453 3.455 -9.778 1.00 31.14 H new ATOM 0 HA GLN A 76 7.529 0.909 -9.510 1.00 70.30 H new ATOM 0 HB2 GLN A 76 8.878 3.581 -8.957 1.00 3.10 H new ATOM 0 HB3 GLN A 76 9.699 2.073 -9.308 1.00 3.10 H new ATOM 0 HG2 GLN A 76 7.943 3.683 -11.184 1.00 32.20 H new ATOM 0 HG3 GLN A 76 9.675 3.442 -11.298 1.00 32.20 H new ATOM 0 HE21 GLN A 76 7.578 2.881 -13.269 1.00 62.54 H new ATOM 0 HE22 GLN A 76 7.709 1.161 -13.648 1.00 62.54 H new ATOM 1059 N GLN A 77 7.503 2.597 -6.658 1.00 43.11 N ATOM 1060 CA GLN A 77 7.638 2.435 -5.207 1.00 12.31 C ATOM 1061 C GLN A 77 6.632 1.407 -4.665 1.00 75.12 C ATOM 1062 O GLN A 77 6.939 0.655 -3.740 1.00 42.03 O ATOM 1063 CB GLN A 77 7.537 3.791 -4.464 1.00 33.31 C ATOM 1064 CG GLN A 77 6.157 4.421 -4.461 1.00 4.15 C ATOM 1065 CD GLN A 77 5.373 4.143 -3.189 1.00 41.33 C ATOM 1066 OE1 GLN A 77 5.579 3.142 -2.516 1.00 14.12 O ATOM 1067 NE2 GLN A 77 4.458 5.020 -2.873 1.00 14.21 N ATOM 0 H GLN A 77 7.210 3.527 -6.957 1.00 43.11 H new ATOM 0 HA GLN A 77 8.637 2.045 -5.013 1.00 12.31 H new ATOM 0 HB2 GLN A 77 7.856 3.647 -3.432 1.00 33.31 H new ATOM 0 HB3 GLN A 77 8.238 4.491 -4.920 1.00 33.31 H new ATOM 0 HG2 GLN A 77 6.257 5.499 -4.590 1.00 4.15 H new ATOM 0 HG3 GLN A 77 5.593 4.048 -5.316 1.00 4.15 H new ATOM 0 HE21 GLN A 77 4.316 5.842 -3.459 1.00 14.21 H new ATOM 0 HE22 GLN A 77 3.886 4.882 -2.040 1.00 14.21 H new ATOM 1076 N VAL A 78 5.452 1.343 -5.288 1.00 31.11 N ATOM 1077 CA VAL A 78 4.406 0.421 -4.849 1.00 32.41 C ATOM 1078 C VAL A 78 4.720 -0.995 -5.319 1.00 50.12 C ATOM 1079 O VAL A 78 4.436 -1.973 -4.618 1.00 13.42 O ATOM 1080 CB VAL A 78 3.005 0.848 -5.372 1.00 5.01 C ATOM 1081 CG1 VAL A 78 1.937 -0.160 -4.961 1.00 61.13 C ATOM 1082 CG2 VAL A 78 2.642 2.231 -4.856 1.00 40.31 C ATOM 0 H VAL A 78 5.200 1.916 -6.093 1.00 31.11 H new ATOM 0 HA VAL A 78 4.382 0.448 -3.760 1.00 32.41 H new ATOM 0 HB VAL A 78 3.049 0.878 -6.461 1.00 5.01 H new ATOM 0 HG11 VAL A 78 0.967 0.163 -5.340 1.00 61.13 H new ATOM 0 HG12 VAL A 78 2.181 -1.138 -5.376 1.00 61.13 H new ATOM 0 HG13 VAL A 78 1.898 -0.226 -3.874 1.00 61.13 H new ATOM 0 HG21 VAL A 78 1.659 2.513 -5.232 1.00 40.31 H new ATOM 0 HG22 VAL A 78 2.624 2.220 -3.766 1.00 40.31 H new ATOM 0 HG23 VAL A 78 3.383 2.953 -5.199 1.00 40.31 H new ATOM 1092 N MET A 79 5.324 -1.105 -6.496 1.00 40.24 N ATOM 1093 CA MET A 79 5.731 -2.402 -7.009 1.00 43.41 C ATOM 1094 C MET A 79 6.751 -3.018 -6.067 1.00 31.05 C ATOM 1095 O MET A 79 6.650 -4.180 -5.706 1.00 32.13 O ATOM 1096 CB MET A 79 6.306 -2.288 -8.429 1.00 30.31 C ATOM 1097 CG MET A 79 5.297 -1.806 -9.464 1.00 3.53 C ATOM 1098 SD MET A 79 5.964 -1.769 -11.143 1.00 62.13 S ATOM 1099 CE MET A 79 6.176 -3.519 -11.466 1.00 34.51 C ATOM 0 H MET A 79 5.540 -0.317 -7.107 1.00 40.24 H new ATOM 0 HA MET A 79 4.853 -3.046 -7.065 1.00 43.41 H new ATOM 0 HB2 MET A 79 7.153 -1.602 -8.414 1.00 30.31 H new ATOM 0 HB3 MET A 79 6.690 -3.261 -8.735 1.00 30.31 H new ATOM 0 HG2 MET A 79 4.423 -2.457 -9.441 1.00 3.53 H new ATOM 0 HG3 MET A 79 4.957 -0.807 -9.193 1.00 3.53 H new ATOM 0 HE1 MET A 79 7.239 -3.761 -11.477 1.00 34.51 H new ATOM 0 HE2 MET A 79 5.681 -4.096 -10.685 1.00 34.51 H new ATOM 0 HE3 MET A 79 5.737 -3.766 -12.433 1.00 34.51 H new ATOM 1109 N LEU A 80 7.726 -2.216 -5.658 1.00 40.14 N ATOM 1110 CA LEU A 80 8.730 -2.663 -4.700 1.00 42.43 C ATOM 1111 C LEU A 80 8.066 -3.009 -3.364 1.00 21.15 C ATOM 1112 O LEU A 80 8.391 -4.018 -2.737 1.00 25.45 O ATOM 1113 CB LEU A 80 9.803 -1.586 -4.503 1.00 54.53 C ATOM 1114 CG LEU A 80 10.942 -1.945 -3.543 1.00 72.43 C ATOM 1115 CD1 LEU A 80 11.679 -3.189 -4.015 1.00 63.45 C ATOM 1116 CD2 LEU A 80 11.905 -0.779 -3.408 1.00 33.13 C ATOM 0 H LEU A 80 7.843 -1.253 -5.974 1.00 40.14 H new ATOM 0 HA LEU A 80 9.213 -3.558 -5.093 1.00 42.43 H new ATOM 0 HB2 LEU A 80 10.234 -1.348 -5.475 1.00 54.53 H new ATOM 0 HB3 LEU A 80 9.319 -0.680 -4.139 1.00 54.53 H new ATOM 0 HG LEU A 80 10.509 -2.158 -2.565 1.00 72.43 H new ATOM 0 HD11 LEU A 80 12.483 -3.423 -3.317 1.00 63.45 H new ATOM 0 HD12 LEU A 80 10.984 -4.027 -4.063 1.00 63.45 H new ATOM 0 HD13 LEU A 80 12.099 -3.009 -5.005 1.00 63.45 H new ATOM 0 HD21 LEU A 80 12.709 -1.048 -2.723 1.00 33.13 H new ATOM 0 HD22 LEU A 80 12.326 -0.539 -4.385 1.00 33.13 H new ATOM 0 HD23 LEU A 80 11.373 0.089 -3.019 1.00 33.13 H new ATOM 1128 N PHE A 81 7.131 -2.164 -2.950 1.00 61.32 N ATOM 1129 CA PHE A 81 6.372 -2.360 -1.715 1.00 30.23 C ATOM 1130 C PHE A 81 5.695 -3.740 -1.675 1.00 34.45 C ATOM 1131 O PHE A 81 5.815 -4.472 -0.682 1.00 22.34 O ATOM 1132 CB PHE A 81 5.334 -1.235 -1.571 1.00 5.25 C ATOM 1133 CG PHE A 81 4.334 -1.431 -0.467 1.00 3.03 C ATOM 1134 CD1 PHE A 81 4.740 -1.550 0.851 1.00 2.35 C ATOM 1135 CD2 PHE A 81 2.979 -1.480 -0.752 1.00 0.14 C ATOM 1136 CE1 PHE A 81 3.813 -1.719 1.860 1.00 73.44 C ATOM 1137 CE2 PHE A 81 2.051 -1.648 0.252 1.00 70.11 C ATOM 1138 CZ PHE A 81 2.467 -1.767 1.560 1.00 72.01 C ATOM 0 H PHE A 81 6.874 -1.319 -3.461 1.00 61.32 H new ATOM 0 HA PHE A 81 7.064 -2.323 -0.874 1.00 30.23 H new ATOM 0 HB2 PHE A 81 5.860 -0.295 -1.402 1.00 5.25 H new ATOM 0 HB3 PHE A 81 4.797 -1.134 -2.514 1.00 5.25 H new ATOM 0 HD1 PHE A 81 5.792 -1.510 1.092 1.00 2.35 H new ATOM 0 HD2 PHE A 81 2.646 -1.385 -1.775 1.00 0.14 H new ATOM 0 HE1 PHE A 81 4.141 -1.814 2.884 1.00 73.44 H new ATOM 0 HE2 PHE A 81 0.998 -1.686 0.014 1.00 70.11 H new ATOM 0 HZ PHE A 81 1.741 -1.898 2.349 1.00 72.01 H new ATOM 1148 N THR A 82 5.009 -4.103 -2.754 1.00 42.02 N ATOM 1149 CA THR A 82 4.316 -5.383 -2.807 1.00 1.04 C ATOM 1150 C THR A 82 5.305 -6.555 -2.949 1.00 53.53 C ATOM 1151 O THR A 82 4.974 -7.697 -2.620 1.00 65.23 O ATOM 1152 CB THR A 82 3.245 -5.430 -3.939 1.00 43.23 C ATOM 1153 OG1 THR A 82 2.425 -6.595 -3.792 1.00 31.15 O ATOM 1154 CG2 THR A 82 3.889 -5.444 -5.316 1.00 43.53 C ATOM 0 H THR A 82 4.919 -3.534 -3.596 1.00 42.02 H new ATOM 0 HA THR A 82 3.792 -5.490 -1.857 1.00 1.04 H new ATOM 0 HB THR A 82 2.635 -4.531 -3.852 1.00 43.23 H new ATOM 0 HG1 THR A 82 1.754 -6.615 -4.506 1.00 31.15 H new ATOM 0 HG21 THR A 82 3.113 -5.477 -6.080 1.00 43.53 H new ATOM 0 HG22 THR A 82 4.489 -4.543 -5.446 1.00 43.53 H new ATOM 0 HG23 THR A 82 4.528 -6.322 -5.410 1.00 43.53 H new ATOM 1162 N ARG A 83 6.521 -6.263 -3.423 1.00 62.34 N ATOM 1163 CA ARG A 83 7.563 -7.289 -3.555 1.00 50.01 C ATOM 1164 C ARG A 83 8.072 -7.700 -2.185 1.00 25.41 C ATOM 1165 O ARG A 83 8.476 -8.839 -1.976 1.00 25.03 O ATOM 1166 CB ARG A 83 8.743 -6.782 -4.386 1.00 41.35 C ATOM 1167 CG ARG A 83 8.434 -6.530 -5.844 1.00 71.01 C ATOM 1168 CD ARG A 83 9.659 -6.001 -6.569 1.00 4.34 C ATOM 1169 NE ARG A 83 9.334 -5.465 -7.888 1.00 13.41 N ATOM 1170 CZ ARG A 83 9.969 -4.435 -8.457 1.00 72.44 C ATOM 1171 NH1 ARG A 83 11.002 -3.864 -7.843 1.00 61.54 N ATOM 1172 NH2 ARG A 83 9.590 -3.997 -9.650 1.00 44.41 N ATOM 0 H ARG A 83 6.808 -5.330 -3.720 1.00 62.34 H new ATOM 0 HA ARG A 83 7.116 -8.145 -4.061 1.00 50.01 H new ATOM 0 HB2 ARG A 83 9.110 -5.856 -3.942 1.00 41.35 H new ATOM 0 HB3 ARG A 83 9.553 -7.509 -4.322 1.00 41.35 H new ATOM 0 HG2 ARG A 83 8.098 -7.454 -6.314 1.00 71.01 H new ATOM 0 HG3 ARG A 83 7.617 -5.813 -5.929 1.00 71.01 H new ATOM 0 HD2 ARG A 83 10.126 -5.221 -5.967 1.00 4.34 H new ATOM 0 HD3 ARG A 83 10.390 -6.803 -6.675 1.00 4.34 H new ATOM 0 HE ARG A 83 8.574 -5.904 -8.408 1.00 13.41 H new ATOM 0 HH11 ARG A 83 11.312 -4.212 -6.936 1.00 61.54 H new ATOM 0 HH12 ARG A 83 11.484 -3.078 -8.280 1.00 61.54 H new ATOM 0 HH21 ARG A 83 8.813 -4.446 -10.135 1.00 44.41 H new ATOM 0 HH22 ARG A 83 10.075 -3.211 -10.083 1.00 44.41 H new ATOM 1186 N GLN A 84 8.037 -6.758 -1.251 1.00 12.31 N ATOM 1187 CA GLN A 84 8.504 -7.004 0.104 1.00 54.41 C ATOM 1188 C GLN A 84 7.507 -7.865 0.862 1.00 31.04 C ATOM 1189 O GLN A 84 7.864 -8.552 1.813 1.00 72.25 O ATOM 1190 CB GLN A 84 8.701 -5.675 0.842 1.00 44.23 C ATOM 1191 CG GLN A 84 9.729 -4.753 0.204 1.00 45.30 C ATOM 1192 CD GLN A 84 11.130 -5.322 0.249 1.00 2.32 C ATOM 1193 OE1 GLN A 84 11.558 -6.032 -0.660 1.00 44.00 O ATOM 1194 NE2 GLN A 84 11.855 -5.012 1.306 1.00 12.13 N ATOM 0 H GLN A 84 7.688 -5.813 -1.410 1.00 12.31 H new ATOM 0 HA GLN A 84 9.457 -7.531 0.050 1.00 54.41 H new ATOM 0 HB2 GLN A 84 7.744 -5.155 0.892 1.00 44.23 H new ATOM 0 HB3 GLN A 84 9.004 -5.884 1.868 1.00 44.23 H new ATOM 0 HG2 GLN A 84 9.450 -4.567 -0.833 1.00 45.30 H new ATOM 0 HG3 GLN A 84 9.715 -3.791 0.716 1.00 45.30 H new ATOM 0 HE21 GLN A 84 11.462 -4.420 2.038 1.00 12.13 H new ATOM 0 HE22 GLN A 84 12.808 -5.364 1.392 1.00 12.13 H new ATOM 1203 N GLY A 85 6.259 -7.824 0.428 1.00 11.34 N ATOM 1204 CA GLY A 85 5.227 -8.601 1.075 1.00 63.32 C ATOM 1205 C GLY A 85 4.713 -7.923 2.322 1.00 25.30 C ATOM 1206 O GLY A 85 4.273 -8.585 3.265 1.00 41.02 O ATOM 0 H GLY A 85 5.942 -7.264 -0.364 1.00 11.34 H new ATOM 0 HA2 GLY A 85 4.402 -8.759 0.381 1.00 63.32 H new ATOM 0 HA3 GLY A 85 5.620 -9.585 1.332 1.00 63.32 H new ATOM 1210 N GLN A 86 4.778 -6.601 2.328 1.00 51.31 N ATOM 1211 CA GLN A 86 4.315 -5.808 3.459 1.00 25.01 C ATOM 1212 C GLN A 86 2.803 -5.640 3.411 1.00 61.02 C ATOM 1213 O GLN A 86 2.112 -6.369 2.699 1.00 41.41 O ATOM 1214 CB GLN A 86 4.994 -4.439 3.456 1.00 32.54 C ATOM 1215 CG GLN A 86 6.481 -4.495 3.714 1.00 73.41 C ATOM 1216 CD GLN A 86 7.121 -3.121 3.743 1.00 54.13 C ATOM 1217 OE1 GLN A 86 7.201 -2.483 4.790 1.00 3.05 O ATOM 1218 NE2 GLN A 86 7.584 -2.657 2.597 1.00 72.50 N ATOM 0 H GLN A 86 5.150 -6.049 1.555 1.00 51.31 H new ATOM 0 HA GLN A 86 4.577 -6.332 4.378 1.00 25.01 H new ATOM 0 HB2 GLN A 86 4.820 -3.960 2.493 1.00 32.54 H new ATOM 0 HB3 GLN A 86 4.527 -3.810 4.214 1.00 32.54 H new ATOM 0 HG2 GLN A 86 6.662 -4.996 4.665 1.00 73.41 H new ATOM 0 HG3 GLN A 86 6.958 -5.097 2.941 1.00 73.41 H new ATOM 0 HE21 GLN A 86 7.499 -3.217 1.749 1.00 72.50 H new ATOM 0 HE22 GLN A 86 8.027 -1.739 2.560 1.00 72.50 H new ATOM 1227 N GLN A 87 2.293 -4.670 4.152 1.00 13.31 N ATOM 1228 CA GLN A 87 0.867 -4.424 4.175 1.00 11.23 C ATOM 1229 C GLN A 87 0.542 -2.991 4.595 1.00 43.21 C ATOM 1230 O GLN A 87 -0.617 -2.583 4.567 1.00 43.05 O ATOM 1231 CB GLN A 87 0.151 -5.428 5.087 1.00 44.30 C ATOM 1232 CG GLN A 87 0.630 -5.412 6.530 1.00 75.21 C ATOM 1233 CD GLN A 87 -0.075 -6.442 7.384 1.00 64.44 C ATOM 1234 OE1 GLN A 87 -1.114 -6.167 7.979 1.00 71.30 O ATOM 1235 NE2 GLN A 87 0.476 -7.633 7.447 1.00 21.11 N ATOM 0 H GLN A 87 2.844 -4.045 4.741 1.00 13.31 H new ATOM 0 HA GLN A 87 0.502 -4.559 3.157 1.00 11.23 H new ATOM 0 HB2 GLN A 87 -0.919 -5.219 5.069 1.00 44.30 H new ATOM 0 HB3 GLN A 87 0.287 -6.431 4.682 1.00 44.30 H new ATOM 0 HG2 GLN A 87 1.704 -5.597 6.555 1.00 75.21 H new ATOM 0 HG3 GLN A 87 0.467 -4.421 6.953 1.00 75.21 H new ATOM 0 HE21 GLN A 87 1.340 -7.823 6.938 1.00 21.11 H new ATOM 0 HE22 GLN A 87 0.040 -8.368 8.004 1.00 21.11 H new ATOM 1244 N SER A 88 1.549 -2.241 5.012 1.00 74.31 N ATOM 1245 CA SER A 88 1.370 -0.837 5.344 1.00 31.42 C ATOM 1246 C SER A 88 2.659 -0.063 5.056 1.00 41.31 C ATOM 1247 O SER A 88 3.759 -0.561 5.320 1.00 33.43 O ATOM 1248 CB SER A 88 0.967 -0.688 6.814 1.00 13.34 C ATOM 1249 OG SER A 88 -0.217 -1.431 7.093 1.00 3.35 O ATOM 0 H SER A 88 2.503 -2.583 5.129 1.00 74.31 H new ATOM 0 HA SER A 88 0.572 -0.425 4.726 1.00 31.42 H new ATOM 0 HB2 SER A 88 1.778 -1.034 7.455 1.00 13.34 H new ATOM 0 HB3 SER A 88 0.804 0.364 7.046 1.00 13.34 H new ATOM 0 HG SER A 88 -0.456 -1.323 8.037 1.00 3.35 H new ATOM 1255 N ALA A 89 2.526 1.142 4.515 1.00 24.04 N ATOM 1256 CA ALA A 89 3.682 1.956 4.167 1.00 34.44 C ATOM 1257 C ALA A 89 3.342 3.435 4.199 1.00 41.55 C ATOM 1258 O ALA A 89 2.240 3.841 3.818 1.00 13.23 O ATOM 1259 CB ALA A 89 4.207 1.578 2.791 1.00 24.44 C ATOM 0 H ALA A 89 1.627 1.577 4.308 1.00 24.04 H new ATOM 0 HA ALA A 89 4.457 1.764 4.910 1.00 34.44 H new ATOM 0 HB1 ALA A 89 5.071 2.197 2.548 1.00 24.44 H new ATOM 0 HB2 ALA A 89 4.501 0.528 2.789 1.00 24.44 H new ATOM 0 HB3 ALA A 89 3.426 1.737 2.047 1.00 24.44 H new ATOM 1265 N GLN A 90 4.286 4.232 4.667 1.00 71.32 N ATOM 1266 CA GLN A 90 4.114 5.668 4.734 1.00 73.42 C ATOM 1267 C GLN A 90 4.847 6.324 3.573 1.00 40.14 C ATOM 1268 O GLN A 90 6.065 6.177 3.434 1.00 61.41 O ATOM 1269 CB GLN A 90 4.650 6.236 6.063 1.00 52.13 C ATOM 1270 CG GLN A 90 3.922 5.765 7.326 1.00 1.41 C ATOM 1271 CD GLN A 90 4.313 4.359 7.767 1.00 24.30 C ATOM 1272 OE1 GLN A 90 5.284 4.175 8.496 1.00 72.44 O ATOM 1273 NE2 GLN A 90 3.541 3.370 7.367 1.00 54.25 N ATOM 0 H GLN A 90 5.188 3.902 5.009 1.00 71.32 H new ATOM 0 HA GLN A 90 3.047 5.884 4.674 1.00 73.42 H new ATOM 0 HB2 GLN A 90 5.703 5.971 6.152 1.00 52.13 H new ATOM 0 HB3 GLN A 90 4.598 7.324 6.020 1.00 52.13 H new ATOM 0 HG2 GLN A 90 4.131 6.462 8.137 1.00 1.41 H new ATOM 0 HG3 GLN A 90 2.847 5.795 7.148 1.00 1.41 H new ATOM 0 HE21 GLN A 90 2.742 3.559 6.761 1.00 54.25 H new ATOM 0 HE22 GLN A 90 3.742 2.415 7.663 1.00 54.25 H new ATOM 1282 N LEU A 91 4.116 7.028 2.739 1.00 42.33 N ATOM 1283 CA LEU A 91 4.713 7.702 1.600 1.00 55.05 C ATOM 1284 C LEU A 91 4.842 9.192 1.858 1.00 70.31 C ATOM 1285 O LEU A 91 3.852 9.868 2.124 1.00 32.01 O ATOM 1286 CB LEU A 91 3.887 7.470 0.336 1.00 71.42 C ATOM 1287 CG LEU A 91 4.369 8.213 -0.914 1.00 43.15 C ATOM 1288 CD1 LEU A 91 5.742 7.719 -1.345 1.00 63.45 C ATOM 1289 CD2 LEU A 91 3.363 8.068 -2.042 1.00 74.13 C ATOM 0 H LEU A 91 3.107 7.151 2.825 1.00 42.33 H new ATOM 0 HA LEU A 91 5.708 7.282 1.454 1.00 55.05 H new ATOM 0 HB2 LEU A 91 3.877 6.402 0.121 1.00 71.42 H new ATOM 0 HB3 LEU A 91 2.857 7.764 0.537 1.00 71.42 H new ATOM 0 HG LEU A 91 4.456 9.271 -0.668 1.00 43.15 H new ATOM 0 HD11 LEU A 91 6.061 8.262 -2.234 1.00 63.45 H new ATOM 0 HD12 LEU A 91 6.458 7.887 -0.541 1.00 63.45 H new ATOM 0 HD13 LEU A 91 5.691 6.654 -1.569 1.00 63.45 H new ATOM 0 HD21 LEU A 91 3.723 8.602 -2.921 1.00 74.13 H new ATOM 0 HD22 LEU A 91 3.238 7.013 -2.285 1.00 74.13 H new ATOM 0 HD23 LEU A 91 2.405 8.485 -1.731 1.00 74.13 H new ATOM 1301 N ARG A 92 6.064 9.690 1.799 1.00 40.50 N ATOM 1302 CA ARG A 92 6.336 11.109 1.966 1.00 11.12 C ATOM 1303 C ARG A 92 5.909 11.863 0.704 1.00 50.35 C ATOM 1304 O ARG A 92 6.258 11.471 -0.410 1.00 74.43 O ATOM 1305 CB ARG A 92 7.852 11.277 2.201 1.00 43.35 C ATOM 1306 CG ARG A 92 8.308 12.584 2.857 1.00 32.20 C ATOM 1307 CD ARG A 92 8.126 13.795 1.957 1.00 41.45 C ATOM 1308 NE ARG A 92 9.009 14.902 2.343 1.00 74.51 N ATOM 1309 CZ ARG A 92 8.783 15.749 3.350 1.00 21.25 C ATOM 1310 NH1 ARG A 92 7.727 15.598 4.139 1.00 64.52 N ATOM 1311 NH2 ARG A 92 9.635 16.738 3.584 1.00 23.22 N ATOM 0 H ARG A 92 6.896 9.124 1.634 1.00 40.50 H new ATOM 0 HA ARG A 92 5.780 11.512 2.813 1.00 11.12 H new ATOM 0 HB2 ARG A 92 8.194 10.448 2.821 1.00 43.35 H new ATOM 0 HB3 ARG A 92 8.357 11.185 1.240 1.00 43.35 H new ATOM 0 HG2 ARG A 92 7.747 12.736 3.779 1.00 32.20 H new ATOM 0 HG3 ARG A 92 9.359 12.498 3.133 1.00 32.20 H new ATOM 0 HD2 ARG A 92 8.328 13.513 0.924 1.00 41.45 H new ATOM 0 HD3 ARG A 92 7.088 14.126 2.000 1.00 41.45 H new ATOM 0 HE ARG A 92 9.862 15.035 1.800 1.00 74.51 H new ATOM 0 HH11 ARG A 92 7.077 14.828 3.979 1.00 64.52 H new ATOM 0 HH12 ARG A 92 7.565 16.252 4.905 1.00 64.52 H new ATOM 0 HH21 ARG A 92 10.460 16.850 2.995 1.00 23.22 H new ATOM 0 HH22 ARG A 92 9.465 17.387 4.353 1.00 23.22 H new ATOM 1325 N LEU A 93 5.169 12.950 0.897 1.00 72.14 N ATOM 1326 CA LEU A 93 4.655 13.745 -0.216 1.00 31.33 C ATOM 1327 C LEU A 93 4.618 15.225 0.108 1.00 64.43 C ATOM 1328 O LEU A 93 4.493 15.624 1.268 1.00 23.41 O ATOM 1329 CB LEU A 93 3.256 13.281 -0.641 1.00 34.35 C ATOM 1330 CG LEU A 93 3.192 12.022 -1.511 1.00 74.02 C ATOM 1331 CD1 LEU A 93 1.757 11.710 -1.885 1.00 24.14 C ATOM 1332 CD2 LEU A 93 4.032 12.197 -2.766 1.00 54.22 C ATOM 0 H LEU A 93 4.910 13.303 1.818 1.00 72.14 H new ATOM 0 HA LEU A 93 5.348 13.591 -1.043 1.00 31.33 H new ATOM 0 HB2 LEU A 93 2.666 13.105 0.259 1.00 34.35 H new ATOM 0 HB3 LEU A 93 2.776 14.096 -1.183 1.00 34.35 H new ATOM 0 HG LEU A 93 3.594 11.188 -0.936 1.00 74.02 H new ATOM 0 HD11 LEU A 93 1.729 10.813 -2.503 1.00 24.14 H new ATOM 0 HD12 LEU A 93 1.173 11.545 -0.980 1.00 24.14 H new ATOM 0 HD13 LEU A 93 1.336 12.547 -2.442 1.00 24.14 H new ATOM 0 HD21 LEU A 93 3.974 11.293 -3.372 1.00 54.22 H new ATOM 0 HD22 LEU A 93 3.655 13.043 -3.341 1.00 54.22 H new ATOM 0 HD23 LEU A 93 5.069 12.381 -2.487 1.00 54.22 H new ATOM 1344 N HIS A 94 4.754 16.029 -0.930 1.00 21.15 N ATOM 1345 CA HIS A 94 4.677 17.474 -0.812 1.00 21.54 C ATOM 1346 C HIS A 94 3.545 18.020 -1.698 1.00 71.31 C ATOM 1347 O HIS A 94 3.206 17.408 -2.711 1.00 1.34 O ATOM 1348 CB HIS A 94 6.037 18.145 -1.153 1.00 43.11 C ATOM 1349 CG HIS A 94 6.590 17.846 -2.528 1.00 1.25 C ATOM 1350 ND1 HIS A 94 7.890 18.124 -2.887 1.00 40.22 N ATOM 1351 CD2 HIS A 94 6.016 17.305 -3.626 1.00 23.41 C ATOM 1352 CE1 HIS A 94 8.087 17.772 -4.139 1.00 55.35 C ATOM 1353 NE2 HIS A 94 6.965 17.269 -4.612 1.00 73.40 N ATOM 0 H HIS A 94 4.921 15.698 -1.880 1.00 21.15 H new ATOM 0 HA HIS A 94 4.450 17.721 0.225 1.00 21.54 H new ATOM 0 HB2 HIS A 94 5.923 19.225 -1.054 1.00 43.11 H new ATOM 0 HB3 HIS A 94 6.771 17.833 -0.411 1.00 43.11 H new ATOM 0 HD2 HIS A 94 4.995 16.963 -3.710 1.00 23.41 H new ATOM 0 HE1 HIS A 94 9.012 17.877 -4.687 1.00 55.35 H new ATOM 0 HE2 HIS A 94 6.826 16.912 -5.557 1.00 73.40 H new ATOM 1362 N PRO A 95 2.934 19.161 -1.321 1.00 14.55 N ATOM 1363 CA PRO A 95 3.299 19.910 -0.116 1.00 40.33 C ATOM 1364 C PRO A 95 2.947 19.137 1.147 1.00 34.23 C ATOM 1365 O PRO A 95 1.936 18.429 1.189 1.00 33.43 O ATOM 1366 CB PRO A 95 2.464 21.188 -0.219 1.00 2.14 C ATOM 1367 CG PRO A 95 1.305 20.814 -1.071 1.00 71.23 C ATOM 1368 CD PRO A 95 1.821 19.797 -2.046 1.00 41.13 C ATOM 0 HA PRO A 95 4.370 20.102 -0.053 1.00 40.33 H new ATOM 0 HB2 PRO A 95 2.139 21.529 0.764 1.00 2.14 H new ATOM 0 HB3 PRO A 95 3.037 22.001 -0.665 1.00 2.14 H new ATOM 0 HG2 PRO A 95 0.495 20.402 -0.469 1.00 71.23 H new ATOM 0 HG3 PRO A 95 0.905 21.685 -1.590 1.00 71.23 H new ATOM 0 HD2 PRO A 95 1.052 19.073 -2.316 1.00 41.13 H new ATOM 0 HD3 PRO A 95 2.159 20.263 -2.971 1.00 41.13 H new ATOM 1376 N GLU A 96 3.796 19.250 2.165 1.00 62.35 N ATOM 1377 CA GLU A 96 3.647 18.521 3.428 1.00 51.51 C ATOM 1378 C GLU A 96 2.364 18.837 4.225 1.00 2.32 C ATOM 1379 O GLU A 96 2.281 18.495 5.405 1.00 73.04 O ATOM 1380 CB GLU A 96 4.870 18.785 4.295 1.00 55.33 C ATOM 1381 CG GLU A 96 6.177 18.450 3.604 1.00 12.02 C ATOM 1382 CD GLU A 96 7.385 18.787 4.441 1.00 20.33 C ATOM 1383 OE1 GLU A 96 7.659 18.057 5.415 1.00 61.44 O ATOM 1384 OE2 GLU A 96 8.079 19.772 4.120 1.00 72.14 O ATOM 0 H GLU A 96 4.616 19.856 2.139 1.00 62.35 H new ATOM 0 HA GLU A 96 3.558 17.469 3.158 1.00 51.51 H new ATOM 0 HB2 GLU A 96 4.880 19.835 4.587 1.00 55.33 H new ATOM 0 HB3 GLU A 96 4.791 18.200 5.211 1.00 55.33 H new ATOM 0 HG2 GLU A 96 6.193 17.387 3.363 1.00 12.02 H new ATOM 0 HG3 GLU A 96 6.233 18.992 2.660 1.00 12.02 H new ATOM 1391 N GLU A 97 1.386 19.481 3.606 1.00 70.02 N ATOM 1392 CA GLU A 97 0.112 19.695 4.265 1.00 64.10 C ATOM 1393 C GLU A 97 -0.488 18.332 4.603 1.00 44.45 C ATOM 1394 O GLU A 97 -0.731 18.015 5.771 1.00 42.43 O ATOM 1395 CB GLU A 97 -0.840 20.501 3.381 1.00 61.44 C ATOM 1396 CG GLU A 97 -2.132 20.895 4.082 1.00 74.34 C ATOM 1397 CD GLU A 97 -1.885 21.716 5.333 1.00 14.11 C ATOM 1398 OE1 GLU A 97 -1.820 22.958 5.230 1.00 12.44 O ATOM 1399 OE2 GLU A 97 -1.752 21.121 6.424 1.00 3.11 O ATOM 0 H GLU A 97 1.450 19.859 2.661 1.00 70.02 H new ATOM 0 HA GLU A 97 0.266 20.272 5.177 1.00 64.10 H new ATOM 0 HB2 GLU A 97 -0.331 21.403 3.040 1.00 61.44 H new ATOM 0 HB3 GLU A 97 -1.081 19.917 2.493 1.00 61.44 H new ATOM 0 HG2 GLU A 97 -2.756 21.465 3.394 1.00 74.34 H new ATOM 0 HG3 GLU A 97 -2.688 19.995 4.345 1.00 74.34 H new ATOM 1406 N LEU A 98 -0.716 17.522 3.571 1.00 2.35 N ATOM 1407 CA LEU A 98 -1.154 16.145 3.763 1.00 45.20 C ATOM 1408 C LEU A 98 -0.059 15.370 4.490 1.00 12.44 C ATOM 1409 O LEU A 98 -0.331 14.473 5.288 1.00 34.13 O ATOM 1410 CB LEU A 98 -1.443 15.487 2.408 1.00 14.23 C ATOM 1411 CG LEU A 98 -2.316 16.294 1.437 1.00 32.53 C ATOM 1412 CD1 LEU A 98 -2.548 15.514 0.156 1.00 14.41 C ATOM 1413 CD2 LEU A 98 -3.641 16.671 2.078 1.00 41.53 C ATOM 0 H LEU A 98 -0.604 17.797 2.595 1.00 2.35 H new ATOM 0 HA LEU A 98 -2.068 16.136 4.357 1.00 45.20 H new ATOM 0 HB2 LEU A 98 -0.492 15.276 1.919 1.00 14.23 H new ATOM 0 HB3 LEU A 98 -1.928 14.528 2.589 1.00 14.23 H new ATOM 0 HG LEU A 98 -1.786 17.214 1.192 1.00 32.53 H new ATOM 0 HD11 LEU A 98 -3.169 16.102 -0.520 1.00 14.41 H new ATOM 0 HD12 LEU A 98 -1.590 15.304 -0.321 1.00 14.41 H new ATOM 0 HD13 LEU A 98 -3.052 14.575 0.388 1.00 14.41 H new ATOM 0 HD21 LEU A 98 -4.239 17.242 1.368 1.00 41.53 H new ATOM 0 HD22 LEU A 98 -4.179 15.766 2.361 1.00 41.53 H new ATOM 0 HD23 LEU A 98 -3.457 17.276 2.966 1.00 41.53 H new ATOM 1425 N GLY A 99 1.183 15.757 4.212 1.00 51.22 N ATOM 1426 CA GLY A 99 2.355 15.179 4.850 1.00 33.13 C ATOM 1427 C GLY A 99 2.718 13.777 4.397 1.00 71.24 C ATOM 1428 O GLY A 99 3.891 13.502 4.119 1.00 3.25 O ATOM 0 H GLY A 99 1.403 16.486 3.533 1.00 51.22 H new ATOM 0 HA2 GLY A 99 3.207 15.834 4.667 1.00 33.13 H new ATOM 0 HA3 GLY A 99 2.191 15.163 5.927 1.00 33.13 H new ATOM 1432 N GLN A 100 1.743 12.896 4.294 1.00 33.22 N ATOM 1433 CA GLN A 100 2.025 11.522 3.941 1.00 33.24 C ATOM 1434 C GLN A 100 0.794 10.821 3.401 1.00 12.42 C ATOM 1435 O GLN A 100 -0.295 11.396 3.349 1.00 72.15 O ATOM 1436 CB GLN A 100 2.596 10.754 5.142 1.00 72.55 C ATOM 1437 CG GLN A 100 1.679 10.711 6.353 1.00 24.22 C ATOM 1438 CD GLN A 100 2.305 9.997 7.542 1.00 33.14 C ATOM 1439 OE1 GLN A 100 1.608 9.403 8.362 1.00 55.22 O ATOM 1440 NE2 GLN A 100 3.621 10.038 7.636 1.00 23.04 N ATOM 0 H GLN A 100 0.757 13.106 4.449 1.00 33.22 H new ATOM 0 HA GLN A 100 2.775 11.537 3.150 1.00 33.24 H new ATOM 0 HB2 GLN A 100 2.817 9.733 4.833 1.00 72.55 H new ATOM 0 HB3 GLN A 100 3.542 11.211 5.434 1.00 72.55 H new ATOM 0 HG2 GLN A 100 1.419 11.729 6.642 1.00 24.22 H new ATOM 0 HG3 GLN A 100 0.750 10.209 6.082 1.00 24.22 H new ATOM 0 HE21 GLN A 100 4.167 10.541 6.936 1.00 23.04 H new ATOM 0 HE22 GLN A 100 4.092 9.567 8.408 1.00 23.04 H new ATOM 1449 N VAL A 101 0.983 9.577 3.024 1.00 34.01 N ATOM 1450 CA VAL A 101 -0.081 8.724 2.538 1.00 52.20 C ATOM 1451 C VAL A 101 0.065 7.359 3.182 1.00 33.51 C ATOM 1452 O VAL A 101 1.177 6.828 3.271 1.00 11.21 O ATOM 1453 CB VAL A 101 -0.045 8.573 0.989 1.00 25.41 C ATOM 1454 CG1 VAL A 101 -1.095 7.576 0.509 1.00 23.12 C ATOM 1455 CG2 VAL A 101 -0.257 9.917 0.317 1.00 41.02 C ATOM 0 H VAL A 101 1.895 9.121 3.046 1.00 34.01 H new ATOM 0 HA VAL A 101 -1.036 9.180 2.800 1.00 52.20 H new ATOM 0 HB VAL A 101 0.939 8.193 0.714 1.00 25.41 H new ATOM 0 HG11 VAL A 101 -1.047 7.491 -0.577 1.00 23.12 H new ATOM 0 HG12 VAL A 101 -0.904 6.601 0.958 1.00 23.12 H new ATOM 0 HG13 VAL A 101 -2.086 7.922 0.802 1.00 23.12 H new ATOM 0 HG21 VAL A 101 -0.229 9.791 -0.765 1.00 41.02 H new ATOM 0 HG22 VAL A 101 -1.226 10.321 0.610 1.00 41.02 H new ATOM 0 HG23 VAL A 101 0.531 10.605 0.623 1.00 41.02 H new ATOM 1465 N HIS A 102 -1.031 6.810 3.668 1.00 2.42 N ATOM 1466 CA HIS A 102 -1.000 5.498 4.294 1.00 42.02 C ATOM 1467 C HIS A 102 -1.432 4.444 3.299 1.00 24.21 C ATOM 1468 O HIS A 102 -2.625 4.297 3.024 1.00 31.24 O ATOM 1469 CB HIS A 102 -1.924 5.452 5.515 1.00 10.13 C ATOM 1470 CG HIS A 102 -1.438 6.218 6.709 1.00 14.30 C ATOM 1471 ND1 HIS A 102 -1.692 5.824 8.001 1.00 54.10 N ATOM 1472 CD2 HIS A 102 -0.731 7.369 6.806 1.00 53.33 C ATOM 1473 CE1 HIS A 102 -1.167 6.695 8.838 1.00 24.34 C ATOM 1474 NE2 HIS A 102 -0.577 7.642 8.140 1.00 23.15 N ATOM 0 H HIS A 102 -1.952 7.248 3.643 1.00 2.42 H new ATOM 0 HA HIS A 102 0.021 5.301 4.621 1.00 42.02 H new ATOM 0 HB2 HIS A 102 -2.901 5.840 5.227 1.00 10.13 H new ATOM 0 HB3 HIS A 102 -2.067 4.411 5.804 1.00 10.13 H new ATOM 0 HD2 HIS A 102 -0.358 7.962 5.984 1.00 53.33 H new ATOM 0 HE1 HIS A 102 -1.213 6.641 9.916 1.00 24.34 H new ATOM 0 HE2 HIS A 102 -0.086 8.447 8.528 1.00 23.15 H new ATOM 1483 N ILE A 103 -0.474 3.732 2.741 1.00 45.41 N ATOM 1484 CA ILE A 103 -0.782 2.686 1.788 1.00 4.12 C ATOM 1485 C ILE A 103 -0.881 1.338 2.477 1.00 21.12 C ATOM 1486 O ILE A 103 0.104 0.822 3.003 1.00 24.40 O ATOM 1487 CB ILE A 103 0.280 2.581 0.647 1.00 1.04 C ATOM 1488 CG1 ILE A 103 0.454 3.915 -0.094 1.00 64.01 C ATOM 1489 CG2 ILE A 103 -0.100 1.484 -0.341 1.00 53.52 C ATOM 1490 CD1 ILE A 103 1.417 4.873 0.574 1.00 73.25 C ATOM 0 H ILE A 103 0.520 3.858 2.930 1.00 45.41 H new ATOM 0 HA ILE A 103 -1.741 2.957 1.345 1.00 4.12 H new ATOM 0 HB ILE A 103 1.232 2.329 1.114 1.00 1.04 H new ATOM 0 HG12 ILE A 103 0.803 3.713 -1.106 1.00 64.01 H new ATOM 0 HG13 ILE A 103 -0.519 4.398 -0.183 1.00 64.01 H new ATOM 0 HG21 ILE A 103 0.652 1.427 -1.128 1.00 53.52 H new ATOM 0 HG22 ILE A 103 -0.154 0.528 0.180 1.00 53.52 H new ATOM 0 HG23 ILE A 103 -1.070 1.712 -0.782 1.00 53.52 H new ATOM 0 HD11 ILE A 103 1.483 5.790 -0.012 1.00 73.25 H new ATOM 0 HD12 ILE A 103 1.060 5.108 1.577 1.00 73.25 H new ATOM 0 HD13 ILE A 103 2.403 4.412 0.639 1.00 73.25 H new ATOM 1502 N SER A 104 -2.073 0.796 2.503 1.00 65.11 N ATOM 1503 CA SER A 104 -2.289 -0.525 3.030 1.00 52.12 C ATOM 1504 C SER A 104 -2.331 -1.512 1.867 1.00 0.02 C ATOM 1505 O SER A 104 -2.425 -1.097 0.709 1.00 22.12 O ATOM 1506 CB SER A 104 -3.577 -0.564 3.846 1.00 12.24 C ATOM 1507 OG SER A 104 -3.555 0.441 4.853 1.00 75.43 O ATOM 0 H SER A 104 -2.916 1.257 2.161 1.00 65.11 H new ATOM 0 HA SER A 104 -1.475 -0.802 3.699 1.00 52.12 H new ATOM 0 HB2 SER A 104 -4.435 -0.413 3.191 1.00 12.24 H new ATOM 0 HB3 SER A 104 -3.695 -1.546 4.305 1.00 12.24 H new ATOM 0 HG SER A 104 -4.388 0.406 5.368 1.00 75.43 H new ATOM 1513 N LEU A 105 -2.287 -2.797 2.153 1.00 0.44 N ATOM 1514 CA LEU A 105 -2.197 -3.777 1.089 1.00 0.43 C ATOM 1515 C LEU A 105 -2.821 -5.094 1.498 1.00 1.25 C ATOM 1516 O LEU A 105 -2.780 -5.478 2.666 1.00 14.32 O ATOM 1517 CB LEU A 105 -0.737 -3.996 0.679 1.00 53.31 C ATOM 1518 CG LEU A 105 -0.507 -4.875 -0.555 1.00 52.41 C ATOM 1519 CD1 LEU A 105 -1.054 -4.203 -1.805 1.00 54.53 C ATOM 1520 CD2 LEU A 105 0.973 -5.188 -0.718 1.00 1.21 C ATOM 0 H LEU A 105 -2.312 -3.183 3.097 1.00 0.44 H new ATOM 0 HA LEU A 105 -2.751 -3.387 0.235 1.00 0.43 H new ATOM 0 HB2 LEU A 105 -0.282 -3.022 0.496 1.00 53.31 H new ATOM 0 HB3 LEU A 105 -0.208 -4.442 1.521 1.00 53.31 H new ATOM 0 HG LEU A 105 -1.043 -5.813 -0.412 1.00 52.41 H new ATOM 0 HD11 LEU A 105 -0.880 -4.845 -2.669 1.00 54.53 H new ATOM 0 HD12 LEU A 105 -2.124 -4.034 -1.688 1.00 54.53 H new ATOM 0 HD13 LEU A 105 -0.550 -3.248 -1.955 1.00 54.53 H new ATOM 0 HD21 LEU A 105 1.118 -5.813 -1.599 1.00 1.21 H new ATOM 0 HD22 LEU A 105 1.530 -4.259 -0.837 1.00 1.21 H new ATOM 0 HD23 LEU A 105 1.332 -5.717 0.165 1.00 1.21 H new ATOM 1532 N LYS A 106 -3.409 -5.760 0.542 1.00 53.13 N ATOM 1533 CA LYS A 106 -3.948 -7.088 0.731 1.00 64.03 C ATOM 1534 C LYS A 106 -3.474 -7.934 -0.422 1.00 74.00 C ATOM 1535 O LYS A 106 -3.618 -7.535 -1.568 1.00 14.12 O ATOM 1536 CB LYS A 106 -5.475 -7.058 0.762 1.00 65.34 C ATOM 1537 CG LYS A 106 -6.121 -8.409 1.021 1.00 74.14 C ATOM 1538 CD LYS A 106 -7.637 -8.310 0.987 1.00 53.13 C ATOM 1539 CE LYS A 106 -8.290 -9.664 1.206 1.00 23.35 C ATOM 1540 NZ LYS A 106 -9.769 -9.565 1.241 1.00 5.24 N ATOM 0 H LYS A 106 -3.531 -5.395 -0.403 1.00 53.13 H new ATOM 0 HA LYS A 106 -3.609 -7.497 1.683 1.00 64.03 H new ATOM 0 HB2 LYS A 106 -5.798 -6.360 1.534 1.00 65.34 H new ATOM 0 HB3 LYS A 106 -5.839 -6.671 -0.190 1.00 65.34 H new ATOM 0 HG2 LYS A 106 -5.784 -9.126 0.272 1.00 74.14 H new ATOM 0 HG3 LYS A 106 -5.801 -8.788 1.991 1.00 74.14 H new ATOM 0 HD2 LYS A 106 -7.974 -7.614 1.755 1.00 53.13 H new ATOM 0 HD3 LYS A 106 -7.954 -7.903 0.027 1.00 53.13 H new ATOM 0 HE2 LYS A 106 -7.990 -10.345 0.409 1.00 23.35 H new ATOM 0 HE3 LYS A 106 -7.932 -10.092 2.142 1.00 23.35 H new ATOM 0 HZ1 LYS A 106 -10.177 -10.510 1.392 1.00 5.24 H new ATOM 0 HZ2 LYS A 106 -10.057 -8.936 2.017 1.00 5.24 H new ATOM 0 HZ3 LYS A 106 -10.113 -9.180 0.338 1.00 5.24 H new ATOM 1554 N LEU A 107 -2.903 -9.073 -0.133 1.00 12.05 N ATOM 1555 CA LEU A 107 -2.373 -9.918 -1.175 1.00 21.12 C ATOM 1556 C LEU A 107 -2.814 -11.353 -0.965 1.00 54.11 C ATOM 1557 O LEU A 107 -2.272 -12.072 -0.115 1.00 31.21 O ATOM 1558 CB LEU A 107 -0.844 -9.810 -1.234 1.00 51.53 C ATOM 1559 CG LEU A 107 -0.170 -10.467 -2.446 1.00 32.24 C ATOM 1560 CD1 LEU A 107 -0.695 -9.872 -3.746 1.00 24.11 C ATOM 1561 CD2 LEU A 107 1.340 -10.306 -2.362 1.00 14.40 C ATOM 0 H LEU A 107 -2.792 -9.438 0.813 1.00 12.05 H new ATOM 0 HA LEU A 107 -2.767 -9.580 -2.133 1.00 21.12 H new ATOM 0 HB2 LEU A 107 -0.573 -8.754 -1.221 1.00 51.53 H new ATOM 0 HB3 LEU A 107 -0.433 -10.256 -0.328 1.00 51.53 H new ATOM 0 HG LEU A 107 -0.410 -11.530 -2.436 1.00 32.24 H new ATOM 0 HD11 LEU A 107 -0.203 -10.353 -4.591 1.00 24.11 H new ATOM 0 HD12 LEU A 107 -1.771 -10.034 -3.812 1.00 24.11 H new ATOM 0 HD13 LEU A 107 -0.488 -8.802 -3.766 1.00 24.11 H new ATOM 0 HD21 LEU A 107 1.805 -10.777 -3.228 1.00 14.40 H new ATOM 0 HD22 LEU A 107 1.593 -9.246 -2.346 1.00 14.40 H new ATOM 0 HD23 LEU A 107 1.706 -10.780 -1.451 1.00 14.40 H new ATOM 1573 N ASP A 108 -3.801 -11.760 -1.729 1.00 11.34 N ATOM 1574 CA ASP A 108 -4.348 -13.105 -1.636 1.00 23.15 C ATOM 1575 C ASP A 108 -4.651 -13.620 -3.028 1.00 62.23 C ATOM 1576 O ASP A 108 -5.032 -12.841 -3.902 1.00 75.42 O ATOM 1577 CB ASP A 108 -5.618 -13.099 -0.771 1.00 25.12 C ATOM 1578 CG ASP A 108 -6.187 -14.486 -0.527 1.00 10.11 C ATOM 1579 OD1 ASP A 108 -5.592 -15.251 0.266 1.00 55.54 O ATOM 1580 OD2 ASP A 108 -7.243 -14.816 -1.117 1.00 30.53 O ATOM 0 H ASP A 108 -4.250 -11.174 -2.433 1.00 11.34 H new ATOM 0 HA ASP A 108 -3.619 -13.764 -1.165 1.00 23.15 H new ATOM 0 HB2 ASP A 108 -5.393 -12.632 0.188 1.00 25.12 H new ATOM 0 HB3 ASP A 108 -6.376 -12.483 -1.255 1.00 25.12 H new ATOM 1585 N ASP A 109 -4.473 -14.930 -3.233 1.00 43.42 N ATOM 1586 CA ASP A 109 -4.653 -15.559 -4.548 1.00 73.23 C ATOM 1587 C ASP A 109 -3.714 -14.922 -5.573 1.00 43.31 C ATOM 1588 O ASP A 109 -2.555 -15.321 -5.693 1.00 44.25 O ATOM 1589 CB ASP A 109 -6.118 -15.475 -5.006 1.00 32.43 C ATOM 1590 CG ASP A 109 -6.402 -16.297 -6.250 1.00 23.22 C ATOM 1591 OD1 ASP A 109 -6.350 -17.542 -6.170 1.00 71.43 O ATOM 1592 OD2 ASP A 109 -6.698 -15.708 -7.301 1.00 23.34 O ATOM 0 H ASP A 109 -4.202 -15.582 -2.497 1.00 43.42 H new ATOM 0 HA ASP A 109 -4.399 -16.615 -4.462 1.00 73.23 H new ATOM 0 HB2 ASP A 109 -6.765 -15.815 -4.198 1.00 32.43 H new ATOM 0 HB3 ASP A 109 -6.372 -14.433 -5.201 1.00 32.43 H new ATOM 1597 N ASN A 110 -4.208 -13.931 -6.289 1.00 45.44 N ATOM 1598 CA ASN A 110 -3.400 -13.188 -7.237 1.00 75.12 C ATOM 1599 C ASN A 110 -3.924 -11.769 -7.359 1.00 62.34 C ATOM 1600 O ASN A 110 -3.764 -11.114 -8.393 1.00 71.12 O ATOM 1601 CB ASN A 110 -3.382 -13.882 -8.618 1.00 12.35 C ATOM 1602 CG ASN A 110 -4.760 -14.042 -9.255 1.00 62.25 C ATOM 1603 OD1 ASN A 110 -5.665 -13.233 -9.058 1.00 10.23 O ATOM 1604 ND2 ASN A 110 -4.922 -15.087 -10.032 1.00 61.22 N ATOM 0 H ASN A 110 -5.177 -13.619 -6.231 1.00 45.44 H new ATOM 0 HA ASN A 110 -2.375 -13.158 -6.868 1.00 75.12 H new ATOM 0 HB2 ASN A 110 -2.747 -13.308 -9.292 1.00 12.35 H new ATOM 0 HB3 ASN A 110 -2.927 -14.867 -8.512 1.00 12.35 H new ATOM 0 HD21 ASN A 110 -5.818 -15.246 -10.492 1.00 61.22 H new ATOM 0 HD22 ASN A 110 -4.152 -15.740 -10.176 1.00 61.22 H new ATOM 1611 N GLN A 111 -4.499 -11.271 -6.274 1.00 65.31 N ATOM 1612 CA GLN A 111 -5.093 -9.960 -6.279 1.00 72.33 C ATOM 1613 C GLN A 111 -4.571 -9.129 -5.128 1.00 64.32 C ATOM 1614 O GLN A 111 -4.358 -9.639 -4.024 1.00 1.13 O ATOM 1615 CB GLN A 111 -6.640 -10.041 -6.266 1.00 74.13 C ATOM 1616 CG GLN A 111 -7.262 -10.679 -5.020 1.00 21.44 C ATOM 1617 CD GLN A 111 -7.702 -9.656 -3.974 1.00 62.14 C ATOM 1618 OE1 GLN A 111 -6.955 -9.307 -3.065 1.00 73.34 O ATOM 1619 NE2 GLN A 111 -8.922 -9.165 -4.110 1.00 51.01 N ATOM 0 H GLN A 111 -4.562 -11.763 -5.382 1.00 65.31 H new ATOM 0 HA GLN A 111 -4.804 -9.464 -7.206 1.00 72.33 H new ATOM 0 HB2 GLN A 111 -7.039 -9.032 -6.373 1.00 74.13 H new ATOM 0 HB3 GLN A 111 -6.963 -10.606 -7.140 1.00 74.13 H new ATOM 0 HG2 GLN A 111 -8.123 -11.277 -5.318 1.00 21.44 H new ATOM 0 HG3 GLN A 111 -6.540 -11.361 -4.570 1.00 21.44 H new ATOM 0 HE21 GLN A 111 -9.515 -9.479 -4.878 1.00 51.01 H new ATOM 0 HE22 GLN A 111 -9.270 -8.473 -3.447 1.00 51.01 H new ATOM 1628 N ALA A 112 -4.304 -7.870 -5.404 1.00 64.53 N ATOM 1629 CA ALA A 112 -3.851 -6.951 -4.394 1.00 30.14 C ATOM 1630 C ALA A 112 -4.855 -5.829 -4.204 1.00 64.21 C ATOM 1631 O ALA A 112 -5.252 -5.167 -5.165 1.00 2.31 O ATOM 1632 CB ALA A 112 -2.487 -6.390 -4.763 1.00 40.43 C ATOM 0 H ALA A 112 -4.396 -7.460 -6.334 1.00 64.53 H new ATOM 0 HA ALA A 112 -3.760 -7.491 -3.452 1.00 30.14 H new ATOM 0 HB1 ALA A 112 -2.157 -5.696 -3.989 1.00 40.43 H new ATOM 0 HB2 ALA A 112 -1.769 -7.206 -4.849 1.00 40.43 H new ATOM 0 HB3 ALA A 112 -2.555 -5.865 -5.716 1.00 40.43 H new ATOM 1638 N GLN A 113 -5.273 -5.628 -2.976 1.00 53.50 N ATOM 1639 CA GLN A 113 -6.224 -4.578 -2.653 1.00 13.04 C ATOM 1640 C GLN A 113 -5.482 -3.331 -2.203 1.00 43.31 C ATOM 1641 O GLN A 113 -4.786 -3.346 -1.183 1.00 30.14 O ATOM 1642 CB GLN A 113 -7.166 -5.047 -1.549 1.00 42.43 C ATOM 1643 CG GLN A 113 -8.340 -4.126 -1.297 1.00 61.10 C ATOM 1644 CD GLN A 113 -9.223 -4.622 -0.173 1.00 41.13 C ATOM 1645 OE1 GLN A 113 -9.028 -4.268 0.987 1.00 44.14 O ATOM 1646 NE2 GLN A 113 -10.184 -5.462 -0.502 1.00 21.21 N ATOM 0 H GLN A 113 -4.969 -6.181 -2.174 1.00 53.50 H new ATOM 0 HA GLN A 113 -6.810 -4.345 -3.542 1.00 13.04 H new ATOM 0 HB2 GLN A 113 -7.544 -6.036 -1.807 1.00 42.43 H new ATOM 0 HB3 GLN A 113 -6.598 -5.154 -0.625 1.00 42.43 H new ATOM 0 HG2 GLN A 113 -7.972 -3.129 -1.055 1.00 61.10 H new ATOM 0 HG3 GLN A 113 -8.931 -4.035 -2.208 1.00 61.10 H new ATOM 0 HE21 GLN A 113 -10.314 -5.732 -1.477 1.00 21.21 H new ATOM 0 HE22 GLN A 113 -10.798 -5.842 0.218 1.00 21.21 H new ATOM 1655 N LEU A 114 -5.621 -2.263 -2.965 1.00 34.33 N ATOM 1656 CA LEU A 114 -4.941 -1.018 -2.656 1.00 74.13 C ATOM 1657 C LEU A 114 -5.834 -0.076 -1.879 1.00 12.33 C ATOM 1658 O LEU A 114 -6.787 0.493 -2.417 1.00 35.31 O ATOM 1659 CB LEU A 114 -4.425 -0.329 -3.930 1.00 10.30 C ATOM 1660 CG LEU A 114 -3.055 -0.795 -4.454 1.00 34.41 C ATOM 1661 CD1 LEU A 114 -1.958 -0.497 -3.441 1.00 25.04 C ATOM 1662 CD2 LEU A 114 -3.075 -2.274 -4.791 1.00 12.53 C ATOM 0 H LEU A 114 -6.200 -2.232 -3.804 1.00 34.33 H new ATOM 0 HA LEU A 114 -4.085 -1.271 -2.031 1.00 74.13 H new ATOM 0 HB2 LEU A 114 -5.161 -0.477 -4.720 1.00 10.30 H new ATOM 0 HB3 LEU A 114 -4.372 0.743 -3.741 1.00 10.30 H new ATOM 0 HG LEU A 114 -2.842 -0.240 -5.367 1.00 34.41 H new ATOM 0 HD11 LEU A 114 -0.999 -0.835 -3.833 1.00 25.04 H new ATOM 0 HD12 LEU A 114 -1.916 0.576 -3.255 1.00 25.04 H new ATOM 0 HD13 LEU A 114 -2.173 -1.018 -2.508 1.00 25.04 H new ATOM 0 HD21 LEU A 114 -2.095 -2.577 -5.159 1.00 12.53 H new ATOM 0 HD22 LEU A 114 -3.320 -2.848 -3.897 1.00 12.53 H new ATOM 0 HD23 LEU A 114 -3.825 -2.462 -5.560 1.00 12.53 H new ATOM 1674 N GLN A 115 -5.538 0.061 -0.612 1.00 30.14 N ATOM 1675 CA GLN A 115 -6.250 0.974 0.250 1.00 61.22 C ATOM 1676 C GLN A 115 -5.318 2.112 0.605 1.00 42.21 C ATOM 1677 O GLN A 115 -4.156 1.877 0.941 1.00 13.33 O ATOM 1678 CB GLN A 115 -6.708 0.260 1.515 1.00 13.30 C ATOM 1679 CG GLN A 115 -7.500 -1.008 1.258 1.00 33.22 C ATOM 1680 CD GLN A 115 -7.852 -1.728 2.536 1.00 72.52 C ATOM 1681 OE1 GLN A 115 -8.906 -1.495 3.124 1.00 44.31 O ATOM 1682 NE2 GLN A 115 -6.971 -2.602 2.981 1.00 74.11 N ATOM 0 H GLN A 115 -4.794 -0.458 -0.146 1.00 30.14 H new ATOM 0 HA GLN A 115 -7.134 1.356 -0.261 1.00 61.22 H new ATOM 0 HB2 GLN A 115 -5.833 0.014 2.117 1.00 13.30 H new ATOM 0 HB3 GLN A 115 -7.319 0.944 2.105 1.00 13.30 H new ATOM 0 HG2 GLN A 115 -8.414 -0.760 0.719 1.00 33.22 H new ATOM 0 HG3 GLN A 115 -6.921 -1.672 0.616 1.00 33.22 H new ATOM 0 HE21 GLN A 115 -6.108 -2.766 2.462 1.00 74.11 H new ATOM 0 HE22 GLN A 115 -7.152 -3.115 3.844 1.00 74.11 H new ATOM 1691 N MET A 116 -5.804 3.327 0.543 1.00 75.43 N ATOM 1692 CA MET A 116 -4.968 4.478 0.800 1.00 24.30 C ATOM 1693 C MET A 116 -5.704 5.525 1.606 1.00 63.21 C ATOM 1694 O MET A 116 -6.716 6.075 1.168 1.00 12.22 O ATOM 1695 CB MET A 116 -4.418 5.083 -0.504 1.00 63.32 C ATOM 1696 CG MET A 116 -3.319 4.246 -1.151 1.00 20.42 C ATOM 1697 SD MET A 116 -2.580 5.033 -2.600 1.00 45.21 S ATOM 1698 CE MET A 116 -3.960 5.027 -3.738 1.00 32.01 C ATOM 0 H MET A 116 -6.774 3.547 0.317 1.00 75.43 H new ATOM 0 HA MET A 116 -4.120 4.131 1.390 1.00 24.30 H new ATOM 0 HB2 MET A 116 -5.237 5.202 -1.213 1.00 63.32 H new ATOM 0 HB3 MET A 116 -4.029 6.080 -0.296 1.00 63.32 H new ATOM 0 HG2 MET A 116 -2.539 4.051 -0.415 1.00 20.42 H new ATOM 0 HG3 MET A 116 -3.731 3.280 -1.442 1.00 20.42 H new ATOM 0 HE1 MET A 116 -3.594 5.176 -4.754 1.00 32.01 H new ATOM 0 HE2 MET A 116 -4.479 4.071 -3.675 1.00 32.01 H new ATOM 0 HE3 MET A 116 -4.649 5.831 -3.479 1.00 32.01 H new ATOM 1708 N VAL A 117 -5.196 5.786 2.786 1.00 54.05 N ATOM 1709 CA VAL A 117 -5.770 6.796 3.644 1.00 63.41 C ATOM 1710 C VAL A 117 -5.052 8.114 3.430 1.00 5.42 C ATOM 1711 O VAL A 117 -3.829 8.212 3.617 1.00 71.44 O ATOM 1712 CB VAL A 117 -5.717 6.400 5.139 1.00 42.34 C ATOM 1713 CG1 VAL A 117 -6.264 7.518 6.009 1.00 43.01 C ATOM 1714 CG2 VAL A 117 -6.500 5.122 5.376 1.00 63.32 C ATOM 0 H VAL A 117 -4.382 5.311 3.176 1.00 54.05 H new ATOM 0 HA VAL A 117 -6.822 6.896 3.376 1.00 63.41 H new ATOM 0 HB VAL A 117 -4.675 6.228 5.410 1.00 42.34 H new ATOM 0 HG11 VAL A 117 -6.218 7.220 7.056 1.00 43.01 H new ATOM 0 HG12 VAL A 117 -5.668 8.419 5.862 1.00 43.01 H new ATOM 0 HG13 VAL A 117 -7.299 7.719 5.734 1.00 43.01 H new ATOM 0 HG21 VAL A 117 -6.453 4.857 6.432 1.00 63.32 H new ATOM 0 HG22 VAL A 117 -7.540 5.273 5.086 1.00 63.32 H new ATOM 0 HG23 VAL A 117 -6.071 4.316 4.780 1.00 63.32 H new ATOM 1724 N SER A 118 -5.812 9.114 3.029 1.00 41.24 N ATOM 1725 CA SER A 118 -5.287 10.434 2.721 1.00 2.00 C ATOM 1726 C SER A 118 -6.419 11.453 2.740 1.00 11.13 C ATOM 1727 O SER A 118 -7.559 11.118 2.406 1.00 63.40 O ATOM 1728 CB SER A 118 -4.620 10.439 1.333 1.00 71.22 C ATOM 1729 OG SER A 118 -3.547 9.522 1.276 1.00 44.51 O ATOM 0 H SER A 118 -6.821 9.034 2.906 1.00 41.24 H new ATOM 0 HA SER A 118 -4.542 10.696 3.472 1.00 2.00 H new ATOM 0 HB2 SER A 118 -5.358 10.186 0.572 1.00 71.22 H new ATOM 0 HB3 SER A 118 -4.257 11.441 1.105 1.00 71.22 H new ATOM 0 HG SER A 118 -3.337 9.207 2.180 1.00 44.51 H new ATOM 1735 N PRO A 119 -6.136 12.700 3.155 1.00 51.00 N ATOM 1736 CA PRO A 119 -7.135 13.772 3.163 1.00 15.21 C ATOM 1737 C PRO A 119 -7.603 14.112 1.744 1.00 74.14 C ATOM 1738 O PRO A 119 -7.018 13.652 0.757 1.00 5.42 O ATOM 1739 CB PRO A 119 -6.392 14.964 3.786 1.00 1.23 C ATOM 1740 CG PRO A 119 -5.203 14.370 4.463 1.00 32.05 C ATOM 1741 CD PRO A 119 -4.834 13.163 3.659 1.00 53.13 C ATOM 0 HA PRO A 119 -8.034 13.494 3.713 1.00 15.21 H new ATOM 0 HB2 PRO A 119 -6.093 15.684 3.024 1.00 1.23 H new ATOM 0 HB3 PRO A 119 -7.025 15.496 4.496 1.00 1.23 H new ATOM 0 HG2 PRO A 119 -4.378 15.082 4.500 1.00 32.05 H new ATOM 0 HG3 PRO A 119 -5.435 14.098 5.493 1.00 32.05 H new ATOM 0 HD2 PRO A 119 -4.150 13.411 2.847 1.00 53.13 H new ATOM 0 HD3 PRO A 119 -4.343 12.405 4.269 1.00 53.13 H new ATOM 1749 N HIS A 120 -8.629 14.931 1.637 1.00 61.41 N ATOM 1750 CA HIS A 120 -9.165 15.272 0.333 1.00 64.13 C ATOM 1751 C HIS A 120 -8.438 16.469 -0.264 1.00 30.33 C ATOM 1752 O HIS A 120 -8.334 17.529 0.359 1.00 54.14 O ATOM 1753 CB HIS A 120 -10.699 15.496 0.379 1.00 75.14 C ATOM 1754 CG HIS A 120 -11.174 16.557 1.335 1.00 21.42 C ATOM 1755 ND1 HIS A 120 -11.716 16.271 2.569 1.00 75.23 N ATOM 1756 CD2 HIS A 120 -11.215 17.903 1.216 1.00 73.23 C ATOM 1757 CE1 HIS A 120 -12.067 17.394 3.163 1.00 13.15 C ATOM 1758 NE2 HIS A 120 -11.774 18.399 2.364 1.00 53.32 N ATOM 0 H HIS A 120 -9.104 15.369 2.426 1.00 61.41 H new ATOM 0 HA HIS A 120 -8.991 14.420 -0.324 1.00 64.13 H new ATOM 0 HB2 HIS A 120 -11.040 15.756 -0.623 1.00 75.14 H new ATOM 0 HB3 HIS A 120 -11.178 14.553 0.644 1.00 75.14 H new ATOM 0 HD2 HIS A 120 -10.870 18.481 0.371 1.00 73.23 H new ATOM 0 HE1 HIS A 120 -12.519 17.476 4.140 1.00 13.15 H new ATOM 0 HE2 HIS A 120 -11.937 19.385 2.567 1.00 53.32 H new ATOM 1767 N SER A 121 -7.917 16.275 -1.466 1.00 43.15 N ATOM 1768 CA SER A 121 -7.158 17.294 -2.164 1.00 50.43 C ATOM 1769 C SER A 121 -6.872 16.814 -3.592 1.00 22.41 C ATOM 1770 O SER A 121 -7.331 15.735 -3.986 1.00 52.01 O ATOM 1771 CB SER A 121 -5.840 17.570 -1.414 1.00 54.44 C ATOM 1772 OG SER A 121 -5.193 18.731 -1.907 1.00 3.43 O ATOM 0 H SER A 121 -8.011 15.402 -1.984 1.00 43.15 H new ATOM 0 HA SER A 121 -7.731 18.220 -2.205 1.00 50.43 H new ATOM 0 HB2 SER A 121 -6.044 17.691 -0.350 1.00 54.44 H new ATOM 0 HB3 SER A 121 -5.176 16.712 -1.516 1.00 54.44 H new ATOM 0 HG SER A 121 -4.362 18.879 -1.409 1.00 3.43 H new ATOM 1778 N HIS A 122 -6.111 17.596 -4.355 1.00 1.12 N ATOM 1779 CA HIS A 122 -5.785 17.238 -5.734 1.00 61.33 C ATOM 1780 C HIS A 122 -4.936 15.967 -5.777 1.00 33.33 C ATOM 1781 O HIS A 122 -5.054 15.167 -6.704 1.00 22.33 O ATOM 1782 CB HIS A 122 -5.063 18.396 -6.453 1.00 33.23 C ATOM 1783 CG HIS A 122 -4.904 18.192 -7.939 1.00 22.50 C ATOM 1784 ND1 HIS A 122 -5.759 18.738 -8.871 1.00 11.05 N ATOM 1785 CD2 HIS A 122 -3.982 17.493 -8.647 1.00 31.22 C ATOM 1786 CE1 HIS A 122 -5.373 18.383 -10.080 1.00 53.51 C ATOM 1787 NE2 HIS A 122 -4.298 17.629 -9.972 1.00 50.33 N ATOM 0 H HIS A 122 -5.709 18.480 -4.043 1.00 1.12 H new ATOM 0 HA HIS A 122 -6.721 17.046 -6.259 1.00 61.33 H new ATOM 0 HB2 HIS A 122 -5.617 19.319 -6.281 1.00 33.23 H new ATOM 0 HB3 HIS A 122 -4.077 18.528 -6.007 1.00 33.23 H new ATOM 0 HD2 HIS A 122 -3.153 16.933 -8.241 1.00 31.22 H new ATOM 0 HE1 HIS A 122 -5.857 18.663 -11.004 1.00 53.51 H new ATOM 0 HE2 HIS A 122 -3.785 17.214 -10.749 1.00 50.33 H new ATOM 1796 N VAL A 123 -4.083 15.781 -4.765 1.00 32.24 N ATOM 1797 CA VAL A 123 -3.247 14.583 -4.678 1.00 63.14 C ATOM 1798 C VAL A 123 -4.117 13.329 -4.600 1.00 44.13 C ATOM 1799 O VAL A 123 -3.771 12.293 -5.147 1.00 10.41 O ATOM 1800 CB VAL A 123 -2.303 14.630 -3.447 1.00 75.52 C ATOM 1801 CG1 VAL A 123 -1.447 13.373 -3.366 1.00 12.14 C ATOM 1802 CG2 VAL A 123 -1.421 15.864 -3.496 1.00 65.24 C ATOM 0 H VAL A 123 -3.955 16.442 -3.999 1.00 32.24 H new ATOM 0 HA VAL A 123 -2.635 14.550 -5.580 1.00 63.14 H new ATOM 0 HB VAL A 123 -2.923 14.679 -2.552 1.00 75.52 H new ATOM 0 HG11 VAL A 123 -0.795 13.432 -2.494 1.00 12.14 H new ATOM 0 HG12 VAL A 123 -2.092 12.499 -3.278 1.00 12.14 H new ATOM 0 HG13 VAL A 123 -0.841 13.287 -4.268 1.00 12.14 H new ATOM 0 HG21 VAL A 123 -0.767 15.878 -2.624 1.00 65.24 H new ATOM 0 HG22 VAL A 123 -0.817 15.844 -4.403 1.00 65.24 H new ATOM 0 HG23 VAL A 123 -2.045 16.758 -3.496 1.00 65.24 H new ATOM 1812 N ARG A 124 -5.263 13.452 -3.938 1.00 54.15 N ATOM 1813 CA ARG A 124 -6.196 12.339 -3.796 1.00 64.40 C ATOM 1814 C ARG A 124 -6.679 11.897 -5.184 1.00 11.13 C ATOM 1815 O ARG A 124 -6.764 10.701 -5.477 1.00 51.13 O ATOM 1816 CB ARG A 124 -7.383 12.771 -2.902 1.00 71.11 C ATOM 1817 CG ARG A 124 -8.276 11.636 -2.376 1.00 71.35 C ATOM 1818 CD ARG A 124 -9.144 11.019 -3.467 1.00 4.00 C ATOM 1819 NE ARG A 124 -9.862 12.037 -4.239 1.00 32.51 N ATOM 1820 CZ ARG A 124 -10.426 11.824 -5.428 1.00 13.53 C ATOM 1821 NH1 ARG A 124 -10.441 10.600 -5.947 1.00 63.11 N ATOM 1822 NH2 ARG A 124 -10.991 12.830 -6.084 1.00 4.01 N ATOM 0 H ARG A 124 -5.569 14.315 -3.489 1.00 54.15 H new ATOM 0 HA ARG A 124 -5.700 11.493 -3.320 1.00 64.40 H new ATOM 0 HB2 ARG A 124 -6.988 13.322 -2.048 1.00 71.11 H new ATOM 0 HB3 ARG A 124 -8.005 13.464 -3.468 1.00 71.11 H new ATOM 0 HG2 ARG A 124 -7.650 10.861 -1.934 1.00 71.35 H new ATOM 0 HG3 ARG A 124 -8.916 12.021 -1.582 1.00 71.35 H new ATOM 0 HD2 ARG A 124 -8.519 10.430 -4.138 1.00 4.00 H new ATOM 0 HD3 ARG A 124 -9.861 10.334 -3.015 1.00 4.00 H new ATOM 0 HE ARG A 124 -9.935 12.973 -3.839 1.00 32.51 H new ATOM 0 HH11 ARG A 124 -10.021 9.824 -5.435 1.00 63.11 H new ATOM 0 HH12 ARG A 124 -10.873 10.437 -6.857 1.00 63.11 H new ATOM 0 HH21 ARG A 124 -10.994 13.766 -5.678 1.00 4.01 H new ATOM 0 HH22 ARG A 124 -11.423 12.667 -6.994 1.00 4.01 H new ATOM 1836 N ALA A 125 -6.972 12.873 -6.034 1.00 14.52 N ATOM 1837 CA ALA A 125 -7.413 12.600 -7.394 1.00 15.14 C ATOM 1838 C ALA A 125 -6.273 12.001 -8.208 1.00 52.53 C ATOM 1839 O ALA A 125 -6.481 11.105 -9.027 1.00 14.41 O ATOM 1840 CB ALA A 125 -7.927 13.872 -8.048 1.00 1.31 C ATOM 0 H ALA A 125 -6.911 13.865 -5.803 1.00 14.52 H new ATOM 0 HA ALA A 125 -8.229 11.878 -7.359 1.00 15.14 H new ATOM 0 HB1 ALA A 125 -8.253 13.652 -9.065 1.00 1.31 H new ATOM 0 HB2 ALA A 125 -8.767 14.263 -7.474 1.00 1.31 H new ATOM 0 HB3 ALA A 125 -7.130 14.615 -8.075 1.00 1.31 H new ATOM 1846 N ALA A 126 -5.071 12.505 -7.971 1.00 0.34 N ATOM 1847 CA ALA A 126 -3.879 12.001 -8.640 1.00 63.43 C ATOM 1848 C ALA A 126 -3.583 10.561 -8.222 1.00 74.50 C ATOM 1849 O ALA A 126 -3.154 9.749 -9.040 1.00 24.41 O ATOM 1850 CB ALA A 126 -2.687 12.897 -8.341 1.00 3.05 C ATOM 0 H ALA A 126 -4.894 13.267 -7.317 1.00 0.34 H new ATOM 0 HA ALA A 126 -4.063 12.009 -9.714 1.00 63.43 H new ATOM 0 HB1 ALA A 126 -1.804 12.508 -8.847 1.00 3.05 H new ATOM 0 HB2 ALA A 126 -2.893 13.907 -8.695 1.00 3.05 H new ATOM 0 HB3 ALA A 126 -2.509 12.919 -7.266 1.00 3.05 H new ATOM 1856 N LEU A 127 -3.823 10.252 -6.951 1.00 3.22 N ATOM 1857 CA LEU A 127 -3.639 8.894 -6.447 1.00 2.13 C ATOM 1858 C LEU A 127 -4.622 7.951 -7.120 1.00 34.10 C ATOM 1859 O LEU A 127 -4.270 6.838 -7.503 1.00 4.12 O ATOM 1860 CB LEU A 127 -3.826 8.841 -4.924 1.00 50.24 C ATOM 1861 CG LEU A 127 -2.766 9.565 -4.088 1.00 63.45 C ATOM 1862 CD1 LEU A 127 -3.159 9.561 -2.620 1.00 32.15 C ATOM 1863 CD2 LEU A 127 -1.404 8.914 -4.272 1.00 3.35 C ATOM 0 H LEU A 127 -4.145 10.922 -6.252 1.00 3.22 H new ATOM 0 HA LEU A 127 -2.621 8.581 -6.679 1.00 2.13 H new ATOM 0 HB2 LEU A 127 -4.801 9.265 -4.683 1.00 50.24 H new ATOM 0 HB3 LEU A 127 -3.849 7.795 -4.618 1.00 50.24 H new ATOM 0 HG LEU A 127 -2.703 10.598 -4.430 1.00 63.45 H new ATOM 0 HD11 LEU A 127 -2.397 10.079 -2.038 1.00 32.15 H new ATOM 0 HD12 LEU A 127 -4.116 10.069 -2.498 1.00 32.15 H new ATOM 0 HD13 LEU A 127 -3.247 8.533 -2.270 1.00 32.15 H new ATOM 0 HD21 LEU A 127 -0.664 9.442 -3.670 1.00 3.35 H new ATOM 0 HD22 LEU A 127 -1.453 7.872 -3.955 1.00 3.35 H new ATOM 0 HD23 LEU A 127 -1.117 8.960 -5.323 1.00 3.35 H new ATOM 1875 N GLU A 128 -5.855 8.415 -7.271 1.00 23.13 N ATOM 1876 CA GLU A 128 -6.890 7.639 -7.929 1.00 24.02 C ATOM 1877 C GLU A 128 -6.530 7.429 -9.395 1.00 64.21 C ATOM 1878 O GLU A 128 -6.602 6.312 -9.910 1.00 11.13 O ATOM 1879 CB GLU A 128 -8.244 8.341 -7.793 1.00 75.42 C ATOM 1880 CG GLU A 128 -9.397 7.612 -8.463 1.00 74.51 C ATOM 1881 CD GLU A 128 -10.732 8.248 -8.159 1.00 33.05 C ATOM 1882 OE1 GLU A 128 -10.896 9.458 -8.426 1.00 13.51 O ATOM 1883 OE2 GLU A 128 -11.632 7.545 -7.645 1.00 1.21 O ATOM 0 H GLU A 128 -6.161 9.331 -6.943 1.00 23.13 H new ATOM 0 HA GLU A 128 -6.964 6.663 -7.450 1.00 24.02 H new ATOM 0 HB2 GLU A 128 -8.472 8.462 -6.734 1.00 75.42 H new ATOM 0 HB3 GLU A 128 -8.166 9.341 -8.219 1.00 75.42 H new ATOM 0 HG2 GLU A 128 -9.239 7.601 -9.541 1.00 74.51 H new ATOM 0 HG3 GLU A 128 -9.408 6.573 -8.132 1.00 74.51 H new ATOM 1890 N ALA A 129 -6.143 8.512 -10.064 1.00 72.01 N ATOM 1891 CA ALA A 129 -5.714 8.463 -11.459 1.00 22.22 C ATOM 1892 C ALA A 129 -4.489 7.576 -11.659 1.00 75.44 C ATOM 1893 O ALA A 129 -4.224 7.115 -12.769 1.00 41.50 O ATOM 1894 CB ALA A 129 -5.428 9.866 -11.965 1.00 73.34 C ATOM 0 H ALA A 129 -6.118 9.446 -9.655 1.00 72.01 H new ATOM 0 HA ALA A 129 -6.530 8.023 -12.033 1.00 22.22 H new ATOM 0 HB1 ALA A 129 -5.109 9.819 -13.006 1.00 73.34 H new ATOM 0 HB2 ALA A 129 -6.331 10.471 -11.889 1.00 73.34 H new ATOM 0 HB3 ALA A 129 -4.638 10.316 -11.363 1.00 73.34 H new ATOM 1900 N ALA A 130 -3.732 7.349 -10.600 1.00 74.41 N ATOM 1901 CA ALA A 130 -2.554 6.508 -10.683 1.00 33.04 C ATOM 1902 C ALA A 130 -2.918 5.027 -10.682 1.00 14.52 C ATOM 1903 O ALA A 130 -2.106 4.186 -11.058 1.00 52.25 O ATOM 1904 CB ALA A 130 -1.597 6.816 -9.544 1.00 75.41 C ATOM 0 H ALA A 130 -3.913 7.736 -9.674 1.00 74.41 H new ATOM 0 HA ALA A 130 -2.060 6.729 -11.629 1.00 33.04 H new ATOM 0 HB1 ALA A 130 -0.719 6.175 -9.623 1.00 75.41 H new ATOM 0 HB2 ALA A 130 -1.290 7.860 -9.599 1.00 75.41 H new ATOM 0 HB3 ALA A 130 -2.095 6.634 -8.591 1.00 75.41 H new ATOM 1910 N LEU A 131 -4.149 4.715 -10.291 1.00 2.45 N ATOM 1911 CA LEU A 131 -4.587 3.324 -10.193 1.00 43.41 C ATOM 1912 C LEU A 131 -4.702 2.639 -11.574 1.00 75.24 C ATOM 1913 O LEU A 131 -4.212 1.519 -11.739 1.00 64.23 O ATOM 1914 CB LEU A 131 -5.907 3.202 -9.413 1.00 61.24 C ATOM 1915 CG LEU A 131 -5.865 3.653 -7.949 1.00 65.01 C ATOM 1916 CD1 LEU A 131 -7.242 3.532 -7.317 1.00 33.22 C ATOM 1917 CD2 LEU A 131 -4.846 2.839 -7.162 1.00 41.02 C ATOM 0 H LEU A 131 -4.859 5.402 -10.037 1.00 2.45 H new ATOM 0 HA LEU A 131 -3.811 2.798 -9.637 1.00 43.41 H new ATOM 0 HB2 LEU A 131 -6.668 3.786 -9.931 1.00 61.24 H new ATOM 0 HB3 LEU A 131 -6.229 2.161 -9.443 1.00 61.24 H new ATOM 0 HG LEU A 131 -5.560 4.699 -7.923 1.00 65.01 H new ATOM 0 HD11 LEU A 131 -7.195 3.856 -6.277 1.00 33.22 H new ATOM 0 HD12 LEU A 131 -7.948 4.159 -7.861 1.00 33.22 H new ATOM 0 HD13 LEU A 131 -7.572 2.494 -7.359 1.00 33.22 H new ATOM 0 HD21 LEU A 131 -4.833 3.176 -6.126 1.00 41.02 H new ATOM 0 HD22 LEU A 131 -5.118 1.784 -7.197 1.00 41.02 H new ATOM 0 HD23 LEU A 131 -3.857 2.973 -7.600 1.00 41.02 H new ATOM 1929 N PRO A 132 -5.351 3.290 -12.595 1.00 75.51 N ATOM 1930 CA PRO A 132 -5.471 2.714 -13.942 1.00 2.03 C ATOM 1931 C PRO A 132 -4.115 2.340 -14.525 1.00 21.24 C ATOM 1932 O PRO A 132 -3.988 1.355 -15.245 1.00 35.12 O ATOM 1933 CB PRO A 132 -6.098 3.844 -14.766 1.00 52.45 C ATOM 1934 CG PRO A 132 -6.835 4.665 -13.776 1.00 73.15 C ATOM 1935 CD PRO A 132 -6.032 4.601 -12.512 1.00 54.22 C ATOM 0 HA PRO A 132 -6.057 1.795 -13.938 1.00 2.03 H new ATOM 0 HB2 PRO A 132 -5.336 4.431 -15.278 1.00 52.45 H new ATOM 0 HB3 PRO A 132 -6.767 3.452 -15.532 1.00 52.45 H new ATOM 0 HG2 PRO A 132 -6.939 5.694 -14.121 1.00 73.15 H new ATOM 0 HG3 PRO A 132 -7.842 4.278 -13.619 1.00 73.15 H new ATOM 0 HD2 PRO A 132 -5.316 5.421 -12.450 1.00 54.22 H new ATOM 0 HD3 PRO A 132 -6.668 4.666 -11.630 1.00 54.22 H new ATOM 1943 N MET A 133 -3.100 3.126 -14.196 1.00 43.22 N ATOM 1944 CA MET A 133 -1.761 2.887 -14.700 1.00 30.34 C ATOM 1945 C MET A 133 -1.073 1.809 -13.863 1.00 64.33 C ATOM 1946 O MET A 133 -0.325 0.973 -14.379 1.00 41.33 O ATOM 1947 CB MET A 133 -0.945 4.175 -14.675 1.00 25.54 C ATOM 1948 CG MET A 133 0.368 4.079 -15.433 1.00 64.20 C ATOM 1949 SD MET A 133 1.398 5.539 -15.233 1.00 53.45 S ATOM 1950 CE MET A 133 1.758 5.445 -13.488 1.00 74.42 C ATOM 0 H MET A 133 -3.182 3.936 -13.581 1.00 43.22 H new ATOM 0 HA MET A 133 -1.831 2.543 -15.732 1.00 30.34 H new ATOM 0 HB2 MET A 133 -1.542 4.982 -15.100 1.00 25.54 H new ATOM 0 HB3 MET A 133 -0.738 4.444 -13.639 1.00 25.54 H new ATOM 0 HG2 MET A 133 0.917 3.203 -15.089 1.00 64.20 H new ATOM 0 HG3 MET A 133 0.160 3.929 -16.492 1.00 64.20 H new ATOM 0 HE1 MET A 133 2.612 6.082 -13.258 1.00 74.42 H new ATOM 0 HE2 MET A 133 0.891 5.780 -12.919 1.00 74.42 H new ATOM 0 HE3 MET A 133 1.992 4.415 -13.220 1.00 74.42 H new ATOM 1960 N LEU A 134 -1.360 1.830 -12.565 1.00 13.20 N ATOM 1961 CA LEU A 134 -0.757 0.915 -11.606 1.00 14.04 C ATOM 1962 C LEU A 134 -1.174 -0.523 -11.901 1.00 24.53 C ATOM 1963 O LEU A 134 -0.344 -1.431 -11.918 1.00 72.41 O ATOM 1964 CB LEU A 134 -1.174 1.308 -10.180 1.00 1.54 C ATOM 1965 CG LEU A 134 -0.469 0.578 -9.034 1.00 14.02 C ATOM 1966 CD1 LEU A 134 1.011 0.910 -9.017 1.00 71.33 C ATOM 1967 CD2 LEU A 134 -1.109 0.937 -7.701 1.00 44.01 C ATOM 0 H LEU A 134 -2.021 2.486 -12.148 1.00 13.20 H new ATOM 0 HA LEU A 134 0.328 0.981 -11.692 1.00 14.04 H new ATOM 0 HB2 LEU A 134 -1.004 2.378 -10.058 1.00 1.54 H new ATOM 0 HB3 LEU A 134 -2.247 1.142 -10.081 1.00 1.54 H new ATOM 0 HG LEU A 134 -0.578 -0.495 -9.194 1.00 14.02 H new ATOM 0 HD11 LEU A 134 1.493 0.381 -8.195 1.00 71.33 H new ATOM 0 HD12 LEU A 134 1.463 0.604 -9.960 1.00 71.33 H new ATOM 0 HD13 LEU A 134 1.141 1.984 -8.883 1.00 71.33 H new ATOM 0 HD21 LEU A 134 -0.596 0.409 -6.897 1.00 44.01 H new ATOM 0 HD22 LEU A 134 -1.031 2.012 -7.538 1.00 44.01 H new ATOM 0 HD23 LEU A 134 -2.160 0.647 -7.712 1.00 44.01 H new ATOM 1979 N ARG A 135 -2.467 -0.717 -12.153 1.00 14.25 N ATOM 1980 CA ARG A 135 -2.999 -2.047 -12.459 1.00 24.53 C ATOM 1981 C ARG A 135 -2.432 -2.594 -13.767 1.00 3.30 C ATOM 1982 O ARG A 135 -2.537 -3.781 -14.041 1.00 33.45 O ATOM 1983 CB ARG A 135 -4.536 -2.045 -12.482 1.00 54.42 C ATOM 1984 CG ARG A 135 -5.155 -1.176 -13.564 1.00 1.45 C ATOM 1985 CD ARG A 135 -6.671 -1.135 -13.436 1.00 40.42 C ATOM 1986 NE ARG A 135 -7.278 -2.468 -13.554 1.00 55.31 N ATOM 1987 CZ ARG A 135 -8.522 -2.767 -13.158 1.00 23.23 C ATOM 1988 NH1 ARG A 135 -9.284 -1.842 -12.585 1.00 52.24 N ATOM 1989 NH2 ARG A 135 -8.996 -3.998 -13.328 1.00 32.43 N ATOM 0 H ARG A 135 -3.165 0.026 -12.152 1.00 14.25 H new ATOM 0 HA ARG A 135 -2.678 -2.713 -11.658 1.00 24.53 H new ATOM 0 HB2 ARG A 135 -4.885 -3.069 -12.614 1.00 54.42 H new ATOM 0 HB3 ARG A 135 -4.900 -1.707 -11.512 1.00 54.42 H new ATOM 0 HG2 ARG A 135 -4.754 -0.165 -13.496 1.00 1.45 H new ATOM 0 HG3 ARG A 135 -4.880 -1.562 -14.546 1.00 1.45 H new ATOM 0 HD2 ARG A 135 -6.940 -0.700 -12.474 1.00 40.42 H new ATOM 0 HD3 ARG A 135 -7.081 -0.482 -14.207 1.00 40.42 H new ATOM 0 HE ARG A 135 -6.716 -3.214 -13.964 1.00 55.31 H new ATOM 0 HH11 ARG A 135 -8.922 -0.899 -12.445 1.00 52.24 H new ATOM 0 HH12 ARG A 135 -10.231 -2.075 -12.285 1.00 52.24 H new ATOM 0 HH21 ARG A 135 -8.412 -4.714 -13.760 1.00 32.43 H new ATOM 0 HH22 ARG A 135 -9.943 -4.226 -13.026 1.00 32.43 H new ATOM 2003 N THR A 136 -1.830 -1.728 -14.562 1.00 54.31 N ATOM 2004 CA THR A 136 -1.203 -2.148 -15.798 1.00 24.14 C ATOM 2005 C THR A 136 0.205 -2.657 -15.508 1.00 10.20 C ATOM 2006 O THR A 136 0.607 -3.715 -15.983 1.00 14.04 O ATOM 2007 CB THR A 136 -1.125 -0.985 -16.800 1.00 60.32 C ATOM 2008 OG1 THR A 136 -2.392 -0.326 -16.861 1.00 74.14 O ATOM 2009 CG2 THR A 136 -0.754 -1.490 -18.188 1.00 24.41 C ATOM 0 H THR A 136 -1.763 -0.728 -14.372 1.00 54.31 H new ATOM 0 HA THR A 136 -1.807 -2.943 -16.235 1.00 24.14 H new ATOM 0 HB THR A 136 -0.356 -0.289 -16.465 1.00 60.32 H new ATOM 0 HG1 THR A 136 -2.521 0.210 -16.051 1.00 74.14 H new ATOM 0 HG21 THR A 136 -0.705 -0.649 -18.880 1.00 24.41 H new ATOM 0 HG22 THR A 136 0.217 -1.984 -18.148 1.00 24.41 H new ATOM 0 HG23 THR A 136 -1.508 -2.199 -18.531 1.00 24.41 H new ATOM 2017 N GLN A 137 0.932 -1.908 -14.681 1.00 2.31 N ATOM 2018 CA GLN A 137 2.301 -2.256 -14.313 1.00 32.13 C ATOM 2019 C GLN A 137 2.324 -3.547 -13.507 1.00 12.13 C ATOM 2020 O GLN A 137 3.172 -4.415 -13.720 1.00 54.24 O ATOM 2021 CB GLN A 137 2.923 -1.127 -13.483 1.00 61.11 C ATOM 2022 CG GLN A 137 2.978 0.217 -14.195 1.00 13.01 C ATOM 2023 CD GLN A 137 3.941 0.224 -15.364 1.00 3.21 C ATOM 2024 OE1 GLN A 137 4.945 -0.486 -15.363 1.00 75.03 O ATOM 2025 NE2 GLN A 137 3.644 1.023 -16.370 1.00 42.30 N ATOM 0 H GLN A 137 0.591 -1.049 -14.250 1.00 2.31 H new ATOM 0 HA GLN A 137 2.878 -2.397 -15.227 1.00 32.13 H new ATOM 0 HB2 GLN A 137 2.353 -1.013 -12.561 1.00 61.11 H new ATOM 0 HB3 GLN A 137 3.935 -1.416 -13.199 1.00 61.11 H new ATOM 0 HG2 GLN A 137 1.981 0.476 -14.551 1.00 13.01 H new ATOM 0 HG3 GLN A 137 3.272 0.988 -13.483 1.00 13.01 H new ATOM 0 HE21 GLN A 137 2.802 1.597 -16.334 1.00 42.30 H new ATOM 0 HE22 GLN A 137 4.257 1.067 -17.184 1.00 42.30 H new ATOM 2034 N LEU A 138 1.380 -3.674 -12.591 1.00 41.04 N ATOM 2035 CA LEU A 138 1.296 -4.856 -11.753 1.00 72.15 C ATOM 2036 C LEU A 138 0.829 -6.070 -12.544 1.00 74.34 C ATOM 2037 O LEU A 138 1.233 -7.192 -12.255 1.00 62.04 O ATOM 2038 CB LEU A 138 0.392 -4.615 -10.536 1.00 34.55 C ATOM 2039 CG LEU A 138 1.064 -3.969 -9.306 1.00 51.40 C ATOM 2040 CD1 LEU A 138 2.185 -4.851 -8.777 1.00 44.23 C ATOM 2041 CD2 LEU A 138 1.593 -2.584 -9.634 1.00 45.11 C ATOM 0 H LEU A 138 0.661 -2.973 -12.409 1.00 41.04 H new ATOM 0 HA LEU A 138 2.302 -5.065 -11.388 1.00 72.15 H new ATOM 0 HB2 LEU A 138 -0.438 -3.980 -10.846 1.00 34.55 H new ATOM 0 HB3 LEU A 138 -0.034 -5.571 -10.231 1.00 34.55 H new ATOM 0 HG LEU A 138 0.306 -3.868 -8.530 1.00 51.40 H new ATOM 0 HD11 LEU A 138 2.644 -4.375 -7.910 1.00 44.23 H new ATOM 0 HD12 LEU A 138 1.779 -5.820 -8.487 1.00 44.23 H new ATOM 0 HD13 LEU A 138 2.936 -4.990 -9.555 1.00 44.23 H new ATOM 0 HD21 LEU A 138 2.061 -2.154 -8.748 1.00 45.11 H new ATOM 0 HD22 LEU A 138 2.329 -2.656 -10.435 1.00 45.11 H new ATOM 0 HD23 LEU A 138 0.769 -1.946 -9.955 1.00 45.11 H new ATOM 2053 N ALA A 139 0.001 -5.848 -13.559 1.00 41.12 N ATOM 2054 CA ALA A 139 -0.493 -6.941 -14.388 1.00 2.04 C ATOM 2055 C ALA A 139 0.655 -7.591 -15.149 1.00 41.14 C ATOM 2056 O ALA A 139 0.696 -8.812 -15.320 1.00 43.15 O ATOM 2057 CB ALA A 139 -1.559 -6.441 -15.350 1.00 40.30 C ATOM 0 H ALA A 139 -0.341 -4.925 -13.827 1.00 41.12 H new ATOM 0 HA ALA A 139 -0.944 -7.692 -13.739 1.00 2.04 H new ATOM 0 HB1 ALA A 139 -1.916 -7.270 -15.961 1.00 40.30 H new ATOM 0 HB2 ALA A 139 -2.391 -6.022 -14.785 1.00 40.30 H new ATOM 0 HB3 ALA A 139 -1.135 -5.672 -15.995 1.00 40.30 H new ATOM 2063 N GLU A 140 1.610 -6.764 -15.563 1.00 23.41 N ATOM 2064 CA GLU A 140 2.787 -7.232 -16.289 1.00 65.54 C ATOM 2065 C GLU A 140 3.759 -7.937 -15.343 1.00 43.52 C ATOM 2066 O GLU A 140 4.747 -8.533 -15.775 1.00 4.51 O ATOM 2067 CB GLU A 140 3.488 -6.066 -16.980 1.00 12.33 C ATOM 2068 CG GLU A 140 2.610 -5.313 -17.962 1.00 74.52 C ATOM 2069 CD GLU A 140 3.328 -4.151 -18.604 1.00 50.14 C ATOM 2070 OE1 GLU A 140 3.602 -3.160 -17.907 1.00 24.42 O ATOM 2071 OE2 GLU A 140 3.614 -4.218 -19.824 1.00 54.22 O ATOM 0 H GLU A 140 1.591 -5.756 -15.406 1.00 23.41 H new ATOM 0 HA GLU A 140 2.457 -7.944 -17.046 1.00 65.54 H new ATOM 0 HB2 GLU A 140 3.847 -5.370 -16.222 1.00 12.33 H new ATOM 0 HB3 GLU A 140 4.364 -6.443 -17.507 1.00 12.33 H new ATOM 0 HG2 GLU A 140 2.267 -5.998 -18.738 1.00 74.52 H new ATOM 0 HG3 GLU A 140 1.723 -4.947 -17.445 1.00 74.52 H new ATOM 2078 N SER A 141 3.482 -7.846 -14.053 1.00 3.05 N ATOM 2079 CA SER A 141 4.299 -8.486 -13.048 1.00 62.03 C ATOM 2080 C SER A 141 3.588 -9.722 -12.494 1.00 0.23 C ATOM 2081 O SER A 141 4.180 -10.515 -11.763 1.00 51.35 O ATOM 2082 CB SER A 141 4.618 -7.498 -11.919 1.00 51.23 C ATOM 2083 OG SER A 141 5.474 -8.077 -10.944 1.00 2.14 O ATOM 0 H SER A 141 2.687 -7.328 -13.679 1.00 3.05 H new ATOM 0 HA SER A 141 5.235 -8.804 -13.506 1.00 62.03 H new ATOM 0 HB2 SER A 141 5.090 -6.608 -12.336 1.00 51.23 H new ATOM 0 HB3 SER A 141 3.691 -7.175 -11.445 1.00 51.23 H new ATOM 0 HG SER A 141 5.437 -9.054 -11.015 1.00 2.14 H new ATOM 2089 N GLY A 142 2.320 -9.877 -12.851 1.00 65.15 N ATOM 2090 CA GLY A 142 1.553 -11.018 -12.389 1.00 44.22 C ATOM 2091 C GLY A 142 0.751 -10.713 -11.140 1.00 42.34 C ATOM 2092 O GLY A 142 0.646 -11.550 -10.245 1.00 61.13 O ATOM 0 H GLY A 142 1.808 -9.232 -13.453 1.00 65.15 H new ATOM 0 HA2 GLY A 142 0.877 -11.341 -13.181 1.00 44.22 H new ATOM 0 HA3 GLY A 142 2.229 -11.849 -12.188 1.00 44.22 H new ATOM 2096 N ILE A 143 0.194 -9.513 -11.079 1.00 75.41 N ATOM 2097 CA ILE A 143 -0.610 -9.081 -9.941 1.00 4.53 C ATOM 2098 C ILE A 143 -1.870 -8.374 -10.446 1.00 72.11 C ATOM 2099 O ILE A 143 -1.803 -7.557 -11.363 1.00 21.35 O ATOM 2100 CB ILE A 143 0.175 -8.124 -8.971 1.00 13.03 C ATOM 2101 CG1 ILE A 143 1.315 -8.857 -8.238 1.00 35.44 C ATOM 2102 CG2 ILE A 143 -0.764 -7.483 -7.956 1.00 73.24 C ATOM 2103 CD1 ILE A 143 2.610 -8.939 -9.018 1.00 53.24 C ATOM 0 H ILE A 143 0.285 -8.811 -11.814 1.00 75.41 H new ATOM 0 HA ILE A 143 -0.872 -9.973 -9.373 1.00 4.53 H new ATOM 0 HB ILE A 143 0.617 -7.343 -9.589 1.00 13.03 H new ATOM 0 HG12 ILE A 143 1.507 -8.351 -7.292 1.00 35.44 H new ATOM 0 HG13 ILE A 143 0.985 -9.868 -7.998 1.00 35.44 H new ATOM 0 HG21 ILE A 143 -0.195 -6.826 -7.298 1.00 73.24 H new ATOM 0 HG22 ILE A 143 -1.524 -6.903 -8.479 1.00 73.24 H new ATOM 0 HG23 ILE A 143 -1.246 -8.261 -7.364 1.00 73.24 H new ATOM 0 HD11 ILE A 143 3.357 -9.470 -8.428 1.00 53.24 H new ATOM 0 HD12 ILE A 143 2.439 -9.473 -9.953 1.00 53.24 H new ATOM 0 HD13 ILE A 143 2.968 -7.933 -9.236 1.00 53.24 H new ATOM 2115 N GLN A 144 -3.007 -8.688 -9.854 1.00 42.52 N ATOM 2116 CA GLN A 144 -4.259 -8.062 -10.247 1.00 11.11 C ATOM 2117 C GLN A 144 -4.786 -7.204 -9.121 1.00 34.32 C ATOM 2118 O GLN A 144 -5.147 -7.711 -8.072 1.00 23.05 O ATOM 2119 CB GLN A 144 -5.307 -9.102 -10.625 1.00 54.50 C ATOM 2120 CG GLN A 144 -4.909 -10.005 -11.771 1.00 62.45 C ATOM 2121 CD GLN A 144 -6.057 -10.870 -12.233 1.00 13.30 C ATOM 2122 OE1 GLN A 144 -6.810 -10.495 -13.134 1.00 54.34 O ATOM 2123 NE2 GLN A 144 -6.215 -12.016 -11.610 1.00 13.43 N ATOM 0 H GLN A 144 -3.091 -9.371 -9.101 1.00 42.52 H new ATOM 0 HA GLN A 144 -4.059 -7.442 -11.121 1.00 11.11 H new ATOM 0 HB2 GLN A 144 -5.521 -9.718 -9.751 1.00 54.50 H new ATOM 0 HB3 GLN A 144 -6.232 -8.589 -10.888 1.00 54.50 H new ATOM 0 HG2 GLN A 144 -4.554 -9.399 -12.604 1.00 62.45 H new ATOM 0 HG3 GLN A 144 -4.078 -10.639 -11.461 1.00 62.45 H new ATOM 0 HE21 GLN A 144 -5.568 -12.287 -10.870 1.00 13.43 H new ATOM 0 HE22 GLN A 144 -6.985 -12.634 -11.867 1.00 13.43 H new ATOM 2132 N LEU A 145 -4.798 -5.908 -9.315 1.00 23.24 N ATOM 2133 CA LEU A 145 -5.324 -5.013 -8.299 1.00 13.40 C ATOM 2134 C LEU A 145 -6.830 -5.178 -8.189 1.00 13.52 C ATOM 2135 O LEU A 145 -7.572 -4.760 -9.077 1.00 20.24 O ATOM 2136 CB LEU A 145 -4.974 -3.561 -8.613 1.00 13.42 C ATOM 2137 CG LEU A 145 -3.497 -3.268 -8.881 1.00 42.42 C ATOM 2138 CD1 LEU A 145 -3.257 -1.774 -8.914 1.00 71.32 C ATOM 2139 CD2 LEU A 145 -2.607 -3.937 -7.845 1.00 70.23 C ATOM 0 H LEU A 145 -4.454 -5.447 -10.157 1.00 23.24 H new ATOM 0 HA LEU A 145 -4.866 -5.273 -7.345 1.00 13.40 H new ATOM 0 HB2 LEU A 145 -5.549 -3.250 -9.485 1.00 13.42 H new ATOM 0 HB3 LEU A 145 -5.301 -2.941 -7.778 1.00 13.42 H new ATOM 0 HG LEU A 145 -3.238 -3.683 -9.855 1.00 42.42 H new ATOM 0 HD11 LEU A 145 -2.202 -1.579 -9.106 1.00 71.32 H new ATOM 0 HD12 LEU A 145 -3.858 -1.326 -9.705 1.00 71.32 H new ATOM 0 HD13 LEU A 145 -3.538 -1.339 -7.955 1.00 71.32 H new ATOM 0 HD21 LEU A 145 -1.563 -3.711 -8.062 1.00 70.23 H new ATOM 0 HD22 LEU A 145 -2.861 -3.565 -6.852 1.00 70.23 H new ATOM 0 HD23 LEU A 145 -2.759 -5.016 -7.877 1.00 70.23 H new ATOM 2151 N GLY A 146 -7.271 -5.797 -7.107 1.00 1.50 N ATOM 2152 CA GLY A 146 -8.684 -6.040 -6.914 1.00 14.22 C ATOM 2153 C GLY A 146 -9.418 -4.802 -6.461 1.00 73.41 C ATOM 2154 O GLY A 146 -9.505 -3.816 -7.198 1.00 13.25 O ATOM 0 H GLY A 146 -6.672 -6.137 -6.355 1.00 1.50 H new ATOM 0 HA2 GLY A 146 -9.120 -6.398 -7.847 1.00 14.22 H new ATOM 0 HA3 GLY A 146 -8.818 -6.830 -6.175 1.00 14.22 H new ATOM 2158 N GLN A 147 -9.943 -4.838 -5.249 1.00 43.25 N ATOM 2159 CA GLN A 147 -10.667 -3.702 -4.711 1.00 64.34 C ATOM 2160 C GLN A 147 -9.703 -2.560 -4.422 1.00 24.21 C ATOM 2161 O GLN A 147 -8.489 -2.770 -4.297 1.00 54.02 O ATOM 2162 CB GLN A 147 -11.440 -4.073 -3.430 1.00 32.42 C ATOM 2163 CG GLN A 147 -12.449 -5.210 -3.585 1.00 65.50 C ATOM 2164 CD GLN A 147 -11.790 -6.574 -3.700 1.00 31.33 C ATOM 2165 OE1 GLN A 147 -10.697 -6.798 -3.168 1.00 51.41 O ATOM 2166 NE2 GLN A 147 -12.443 -7.487 -4.385 1.00 32.13 N ATOM 0 H GLN A 147 -9.881 -5.639 -4.621 1.00 43.25 H new ATOM 0 HA GLN A 147 -11.394 -3.387 -5.460 1.00 64.34 H new ATOM 0 HB2 GLN A 147 -10.721 -4.349 -2.658 1.00 32.42 H new ATOM 0 HB3 GLN A 147 -11.966 -3.188 -3.073 1.00 32.42 H new ATOM 0 HG2 GLN A 147 -13.124 -5.209 -2.729 1.00 65.50 H new ATOM 0 HG3 GLN A 147 -13.058 -5.030 -4.471 1.00 65.50 H new ATOM 0 HE21 GLN A 147 -13.343 -7.260 -4.808 1.00 32.13 H new ATOM 0 HE22 GLN A 147 -12.050 -8.422 -4.493 1.00 32.13 H new ATOM 2175 N SER A 148 -10.226 -1.366 -4.330 1.00 64.52 N ATOM 2176 CA SER A 148 -9.413 -0.203 -4.061 1.00 13.33 C ATOM 2177 C SER A 148 -10.205 0.812 -3.255 1.00 12.42 C ATOM 2178 O SER A 148 -11.429 0.896 -3.379 1.00 61.43 O ATOM 2179 CB SER A 148 -8.919 0.412 -5.375 1.00 42.33 C ATOM 2180 OG SER A 148 -8.182 -0.545 -6.128 1.00 31.40 O ATOM 0 H SER A 148 -11.221 -1.170 -4.438 1.00 64.52 H new ATOM 0 HA SER A 148 -8.544 -0.504 -3.476 1.00 13.33 H new ATOM 0 HB2 SER A 148 -9.768 0.767 -5.959 1.00 42.33 H new ATOM 0 HB3 SER A 148 -8.292 1.279 -5.165 1.00 42.33 H new ATOM 0 HG SER A 148 -7.875 -0.137 -6.965 1.00 31.40 H new ATOM 2186 N SER A 149 -9.520 1.552 -2.409 1.00 45.54 N ATOM 2187 CA SER A 149 -10.161 2.558 -1.587 1.00 3.41 C ATOM 2188 C SER A 149 -9.209 3.709 -1.319 1.00 0.44 C ATOM 2189 O SER A 149 -8.024 3.496 -1.077 1.00 61.23 O ATOM 2190 CB SER A 149 -10.624 1.945 -0.262 1.00 5.02 C ATOM 2191 OG SER A 149 -11.522 0.863 -0.484 1.00 43.43 O ATOM 0 H SER A 149 -8.512 1.475 -2.272 1.00 45.54 H new ATOM 0 HA SER A 149 -11.030 2.939 -2.124 1.00 3.41 H new ATOM 0 HB2 SER A 149 -9.760 1.594 0.302 1.00 5.02 H new ATOM 0 HB3 SER A 149 -11.112 2.708 0.344 1.00 5.02 H new ATOM 0 HG SER A 149 -11.802 0.488 0.377 1.00 43.43 H new ATOM 2197 N ILE A 150 -9.729 4.923 -1.376 1.00 52.50 N ATOM 2198 CA ILE A 150 -8.946 6.119 -1.112 1.00 0.13 C ATOM 2199 C ILE A 150 -9.815 7.101 -0.344 1.00 4.32 C ATOM 2200 O ILE A 150 -10.626 7.824 -0.939 1.00 35.33 O ATOM 2201 CB ILE A 150 -8.441 6.803 -2.414 1.00 1.31 C ATOM 2202 CG1 ILE A 150 -7.698 5.801 -3.306 1.00 43.13 C ATOM 2203 CG2 ILE A 150 -7.529 7.978 -2.072 1.00 43.24 C ATOM 2204 CD1 ILE A 150 -7.223 6.386 -4.617 1.00 11.32 C ATOM 0 H ILE A 150 -10.705 5.108 -1.606 1.00 52.50 H new ATOM 0 HA ILE A 150 -8.067 5.825 -0.538 1.00 0.13 H new ATOM 0 HB ILE A 150 -9.307 7.173 -2.963 1.00 1.31 H new ATOM 0 HG12 ILE A 150 -6.839 5.411 -2.761 1.00 43.13 H new ATOM 0 HG13 ILE A 150 -8.355 4.956 -3.513 1.00 43.13 H new ATOM 0 HG21 ILE A 150 -7.182 8.449 -2.992 1.00 43.24 H new ATOM 0 HG22 ILE A 150 -8.081 8.706 -1.478 1.00 43.24 H new ATOM 0 HG23 ILE A 150 -6.672 7.619 -1.502 1.00 43.24 H new ATOM 0 HD11 ILE A 150 -6.707 5.618 -5.193 1.00 11.32 H new ATOM 0 HD12 ILE A 150 -8.079 6.751 -5.184 1.00 11.32 H new ATOM 0 HD13 ILE A 150 -6.540 7.212 -4.420 1.00 11.32 H new ATOM 2216 N SER A 151 -9.683 7.112 0.962 1.00 33.32 N ATOM 2217 CA SER A 151 -10.515 7.977 1.769 1.00 2.44 C ATOM 2218 C SER A 151 -9.747 8.597 2.932 1.00 41.21 C ATOM 2219 O SER A 151 -8.691 8.103 3.343 1.00 22.54 O ATOM 2220 CB SER A 151 -11.735 7.193 2.275 1.00 32.11 C ATOM 2221 OG SER A 151 -12.729 8.058 2.800 1.00 55.24 O ATOM 0 H SER A 151 -9.018 6.541 1.484 1.00 33.32 H new ATOM 0 HA SER A 151 -10.850 8.803 1.141 1.00 2.44 H new ATOM 0 HB2 SER A 151 -12.156 6.607 1.458 1.00 32.11 H new ATOM 0 HB3 SER A 151 -11.422 6.488 3.045 1.00 32.11 H new ATOM 0 HG SER A 151 -12.596 8.161 3.765 1.00 55.24 H new ATOM 2227 N SER A 152 -10.285 9.687 3.450 1.00 62.11 N ATOM 2228 CA SER A 152 -9.688 10.394 4.554 1.00 74.15 C ATOM 2229 C SER A 152 -10.138 9.792 5.883 1.00 65.15 C ATOM 2230 O SER A 152 -11.283 9.983 6.305 1.00 3.10 O ATOM 2231 CB SER A 152 -10.079 11.865 4.486 1.00 21.32 C ATOM 2232 OG SER A 152 -9.862 12.380 3.184 1.00 20.24 O ATOM 0 H SER A 152 -11.152 10.103 3.111 1.00 62.11 H new ATOM 0 HA SER A 152 -8.604 10.304 4.487 1.00 74.15 H new ATOM 0 HB2 SER A 152 -11.128 11.981 4.758 1.00 21.32 H new ATOM 0 HB3 SER A 152 -9.497 12.435 5.210 1.00 21.32 H new ATOM 0 HG SER A 152 -9.145 11.875 2.748 1.00 20.24 H new ATOM 2238 N GLU A 153 -9.227 9.060 6.520 1.00 24.02 N ATOM 2239 CA GLU A 153 -9.469 8.405 7.812 1.00 41.21 C ATOM 2240 C GLU A 153 -10.502 7.282 7.691 1.00 44.34 C ATOM 2241 O GLU A 153 -10.143 6.107 7.583 1.00 73.24 O ATOM 2242 CB GLU A 153 -9.889 9.422 8.881 1.00 72.51 C ATOM 2243 CG GLU A 153 -8.897 10.554 9.065 1.00 13.42 C ATOM 2244 CD GLU A 153 -9.236 11.436 10.237 1.00 54.42 C ATOM 2245 OE1 GLU A 153 -10.065 12.353 10.080 1.00 51.33 O ATOM 2246 OE2 GLU A 153 -8.674 11.218 11.331 1.00 64.30 O ATOM 0 H GLU A 153 -8.289 8.901 6.153 1.00 24.02 H new ATOM 0 HA GLU A 153 -8.528 7.954 8.127 1.00 41.21 H new ATOM 0 HB2 GLU A 153 -10.859 9.840 8.612 1.00 72.51 H new ATOM 0 HB3 GLU A 153 -10.018 8.905 9.832 1.00 72.51 H new ATOM 0 HG2 GLU A 153 -7.899 10.139 9.204 1.00 13.42 H new ATOM 0 HG3 GLU A 153 -8.867 11.157 8.158 1.00 13.42 H new ATOM 2253 N SER A 154 -11.767 7.641 7.693 1.00 30.44 N ATOM 2254 CA SER A 154 -12.838 6.674 7.570 1.00 54.23 C ATOM 2255 C SER A 154 -13.284 6.599 6.113 1.00 42.33 C ATOM 2256 O SER A 154 -12.958 7.480 5.320 1.00 73.32 O ATOM 2257 CB SER A 154 -14.012 7.071 8.479 1.00 44.12 C ATOM 2258 OG SER A 154 -15.012 6.061 8.516 1.00 22.12 O ATOM 0 H SER A 154 -12.082 8.607 7.780 1.00 30.44 H new ATOM 0 HA SER A 154 -12.483 5.692 7.882 1.00 54.23 H new ATOM 0 HB2 SER A 154 -13.644 7.257 9.488 1.00 44.12 H new ATOM 0 HB3 SER A 154 -14.449 8.004 8.122 1.00 44.12 H new ATOM 0 HG SER A 154 -15.742 6.345 9.104 1.00 22.12 H new ATOM 2264 N PHE A 155 -14.023 5.561 5.763 1.00 71.32 N ATOM 2265 CA PHE A 155 -14.486 5.384 4.395 1.00 42.31 C ATOM 2266 C PHE A 155 -15.683 6.289 4.130 1.00 43.41 C ATOM 2267 O PHE A 155 -16.672 6.252 4.861 1.00 52.42 O ATOM 2268 CB PHE A 155 -14.859 3.914 4.150 1.00 72.12 C ATOM 2269 CG PHE A 155 -15.227 3.597 2.723 1.00 63.32 C ATOM 2270 CD1 PHE A 155 -14.245 3.312 1.788 1.00 41.33 C ATOM 2271 CD2 PHE A 155 -16.555 3.575 2.321 1.00 30.12 C ATOM 2272 CE1 PHE A 155 -14.578 3.013 0.480 1.00 41.44 C ATOM 2273 CE2 PHE A 155 -16.894 3.278 1.016 1.00 52.31 C ATOM 2274 CZ PHE A 155 -15.904 2.997 0.094 1.00 34.00 C ATOM 0 H PHE A 155 -14.316 4.826 6.407 1.00 71.32 H new ATOM 0 HA PHE A 155 -13.684 5.657 3.709 1.00 42.31 H new ATOM 0 HB2 PHE A 155 -14.020 3.284 4.445 1.00 72.12 H new ATOM 0 HB3 PHE A 155 -15.697 3.651 4.796 1.00 72.12 H new ATOM 0 HD1 PHE A 155 -13.207 3.324 2.085 1.00 41.33 H new ATOM 0 HD2 PHE A 155 -17.333 3.793 3.038 1.00 30.12 H new ATOM 0 HE1 PHE A 155 -13.803 2.792 -0.239 1.00 41.44 H new ATOM 0 HE2 PHE A 155 -17.931 3.265 0.716 1.00 52.31 H new ATOM 0 HZ PHE A 155 -16.167 2.765 -0.928 1.00 34.00 H new ATOM 2284 N ALA A 156 -15.580 7.110 3.098 1.00 63.35 N ATOM 2285 CA ALA A 156 -16.650 8.027 2.748 1.00 34.44 C ATOM 2286 C ALA A 156 -17.733 7.314 1.955 1.00 4.23 C ATOM 2287 O ALA A 156 -17.465 6.733 0.900 1.00 13.21 O ATOM 2288 CB ALA A 156 -16.101 9.208 1.961 1.00 52.05 C ATOM 0 H ALA A 156 -14.764 7.160 2.487 1.00 63.35 H new ATOM 0 HA ALA A 156 -17.095 8.402 3.670 1.00 34.44 H new ATOM 0 HB1 ALA A 156 -16.916 9.886 1.706 1.00 52.05 H new ATOM 0 HB2 ALA A 156 -15.364 9.737 2.565 1.00 52.05 H new ATOM 0 HB3 ALA A 156 -15.629 8.848 1.047 1.00 52.05 H new ATOM 2294 N GLY A 157 -18.947 7.349 2.471 1.00 51.55 N ATOM 2295 CA GLY A 157 -20.059 6.708 1.806 1.00 14.53 C ATOM 2296 C GLY A 157 -20.997 7.708 1.173 1.00 20.45 C ATOM 2297 O GLY A 157 -20.682 8.897 1.093 1.00 54.05 O ATOM 0 H GLY A 157 -19.185 7.814 3.347 1.00 51.55 H new ATOM 0 HA2 GLY A 157 -19.681 6.031 1.040 1.00 14.53 H new ATOM 0 HA3 GLY A 157 -20.609 6.101 2.525 1.00 14.53 H new ATOM 2301 N GLN A 158 -22.149 7.238 0.739 1.00 63.14 N ATOM 2302 CA GLN A 158 -23.139 8.083 0.096 1.00 55.14 C ATOM 2303 C GLN A 158 -24.513 7.440 0.168 1.00 21.01 C ATOM 2304 O GLN A 158 -24.647 6.293 0.603 1.00 10.35 O ATOM 2305 CB GLN A 158 -22.751 8.343 -1.366 1.00 44.33 C ATOM 2306 CG GLN A 158 -22.381 7.083 -2.137 1.00 63.23 C ATOM 2307 CD GLN A 158 -22.073 7.355 -3.593 1.00 61.34 C ATOM 2308 OE1 GLN A 158 -22.649 8.255 -4.205 1.00 71.43 O ATOM 2309 NE2 GLN A 158 -21.157 6.589 -4.153 1.00 64.14 N ATOM 0 H GLN A 158 -22.427 6.260 0.821 1.00 63.14 H new ATOM 0 HA GLN A 158 -23.173 9.036 0.623 1.00 55.14 H new ATOM 0 HB2 GLN A 158 -23.582 8.836 -1.871 1.00 44.33 H new ATOM 0 HB3 GLN A 158 -21.908 9.034 -1.391 1.00 44.33 H new ATOM 0 HG2 GLN A 158 -21.514 6.617 -1.668 1.00 63.23 H new ATOM 0 HG3 GLN A 158 -23.201 6.368 -2.071 1.00 63.23 H new ATOM 0 HE21 GLN A 158 -20.704 5.854 -3.609 1.00 64.14 H new ATOM 0 HE22 GLN A 158 -20.901 6.731 -5.130 1.00 64.14 H new ATOM 2318 N GLN A 159 -25.525 8.170 -0.263 1.00 0.23 N ATOM 2319 CA GLN A 159 -26.892 7.684 -0.248 1.00 24.21 C ATOM 2320 C GLN A 159 -27.730 8.467 -1.247 1.00 15.33 C ATOM 2321 O GLN A 159 -27.428 9.626 -1.545 1.00 12.03 O ATOM 2322 CB GLN A 159 -27.497 7.801 1.157 1.00 21.32 C ATOM 2323 CG GLN A 159 -27.591 9.225 1.682 1.00 2.41 C ATOM 2324 CD GLN A 159 -28.250 9.296 3.042 1.00 51.21 C ATOM 2325 OE1 GLN A 159 -27.583 9.234 4.074 1.00 61.24 O ATOM 2326 NE2 GLN A 159 -29.560 9.408 3.054 1.00 44.44 N ATOM 0 H GLN A 159 -25.423 9.115 -0.633 1.00 0.23 H new ATOM 0 HA GLN A 159 -26.888 6.631 -0.531 1.00 24.21 H new ATOM 0 HB2 GLN A 159 -28.495 7.363 1.147 1.00 21.32 H new ATOM 0 HB3 GLN A 159 -26.896 7.210 1.849 1.00 21.32 H new ATOM 0 HG2 GLN A 159 -26.591 9.654 1.743 1.00 2.41 H new ATOM 0 HG3 GLN A 159 -28.156 9.833 0.975 1.00 2.41 H new ATOM 0 HE21 GLN A 159 -30.076 9.456 2.175 1.00 44.44 H new ATOM 0 HE22 GLN A 159 -30.060 9.447 3.942 1.00 44.44 H new ATOM 2335 N GLN A 160 -28.777 7.851 -1.757 1.00 30.12 N ATOM 2336 CA GLN A 160 -29.609 8.496 -2.754 1.00 10.35 C ATOM 2337 C GLN A 160 -31.050 8.018 -2.660 1.00 10.50 C ATOM 2338 O GLN A 160 -31.350 7.057 -1.946 1.00 74.35 O ATOM 2339 CB GLN A 160 -29.047 8.242 -4.154 1.00 43.34 C ATOM 2340 CG GLN A 160 -29.060 6.783 -4.584 1.00 42.11 C ATOM 2341 CD GLN A 160 -28.388 6.567 -5.925 1.00 4.44 C ATOM 2342 OE1 GLN A 160 -27.354 7.338 -6.204 1.00 30.25 O flip ATOM 2343 NE2 GLN A 160 -28.783 5.696 -6.696 1.00 40.24 N flip ATOM 0 H GLN A 160 -29.072 6.909 -1.500 1.00 30.12 H new ATOM 0 HA GLN A 160 -29.602 9.569 -2.562 1.00 10.35 H new ATOM 0 HB2 GLN A 160 -29.622 8.825 -4.874 1.00 43.34 H new ATOM 0 HB3 GLN A 160 -28.022 8.610 -4.192 1.00 43.34 H new ATOM 0 HG2 GLN A 160 -28.557 6.180 -3.828 1.00 42.11 H new ATOM 0 HG3 GLN A 160 -30.091 6.432 -4.637 1.00 42.11 H new ATOM 0 HE21 GLN A 160 -29.586 5.119 -6.446 1.00 40.24 H new ATOM 0 HE22 GLN A 160 -28.308 5.550 -7.587 1.00 40.24 H new ATOM 2352 N SER A 161 -31.935 8.692 -3.374 1.00 0.11 N ATOM 2353 CA SER A 161 -33.346 8.365 -3.358 1.00 71.13 C ATOM 2354 C SER A 161 -34.043 8.912 -4.605 1.00 0.04 C ATOM 2355 O SER A 161 -33.474 9.737 -5.328 1.00 53.13 O ATOM 2356 CB SER A 161 -33.987 8.931 -2.082 1.00 53.04 C ATOM 2357 OG SER A 161 -33.587 10.281 -1.865 1.00 63.55 O ATOM 0 H SER A 161 -31.695 9.478 -3.978 1.00 0.11 H new ATOM 0 HA SER A 161 -33.461 7.281 -3.363 1.00 71.13 H new ATOM 0 HB2 SER A 161 -35.073 8.878 -2.162 1.00 53.04 H new ATOM 0 HB3 SER A 161 -33.700 8.321 -1.225 1.00 53.04 H new ATOM 0 HG SER A 161 -34.009 10.620 -1.048 1.00 63.55 H new ATOM 2363 N SER A 162 -35.265 8.448 -4.852 1.00 10.10 N ATOM 2364 CA SER A 162 -36.052 8.890 -5.997 1.00 42.25 C ATOM 2365 C SER A 162 -37.480 8.360 -5.893 1.00 43.14 C ATOM 2366 O SER A 162 -37.699 7.213 -5.489 1.00 41.22 O ATOM 2367 CB SER A 162 -35.404 8.425 -7.309 1.00 44.22 C ATOM 2368 OG SER A 162 -35.128 7.031 -7.278 1.00 14.25 O ATOM 0 H SER A 162 -35.735 7.758 -4.266 1.00 10.10 H new ATOM 0 HA SER A 162 -36.082 9.980 -5.996 1.00 42.25 H new ATOM 0 HB2 SER A 162 -36.067 8.649 -8.145 1.00 44.22 H new ATOM 0 HB3 SER A 162 -34.480 8.978 -7.478 1.00 44.22 H new ATOM 0 HG SER A 162 -34.717 6.760 -8.126 1.00 14.25 H new ATOM 2374 N SER A 163 -38.443 9.190 -6.243 1.00 74.35 N ATOM 2375 CA SER A 163 -39.835 8.800 -6.178 1.00 44.54 C ATOM 2376 C SER A 163 -40.594 9.294 -7.405 1.00 55.34 C ATOM 2377 O SER A 163 -40.034 9.994 -8.248 1.00 44.35 O ATOM 2378 CB SER A 163 -40.469 9.345 -4.895 1.00 4.41 C ATOM 2379 OG SER A 163 -40.216 10.737 -4.754 1.00 73.12 O ATOM 0 H SER A 163 -38.285 10.141 -6.576 1.00 74.35 H new ATOM 0 HA SER A 163 -39.893 7.712 -6.165 1.00 44.54 H new ATOM 0 HB2 SER A 163 -41.544 9.167 -4.912 1.00 4.41 H new ATOM 0 HB3 SER A 163 -40.071 8.810 -4.033 1.00 4.41 H new ATOM 0 HG SER A 163 -40.632 11.063 -3.929 1.00 73.12 H new ATOM 2385 N GLN A 164 -41.865 8.942 -7.485 1.00 54.34 N ATOM 2386 CA GLN A 164 -42.728 9.332 -8.596 1.00 63.45 C ATOM 2387 C GLN A 164 -44.155 9.447 -8.102 1.00 70.41 C ATOM 2388 O GLN A 164 -44.456 9.054 -6.975 1.00 32.33 O ATOM 2389 CB GLN A 164 -42.661 8.294 -9.735 1.00 33.32 C ATOM 2390 CG GLN A 164 -41.364 8.308 -10.543 1.00 52.11 C ATOM 2391 CD GLN A 164 -41.228 9.538 -11.426 1.00 21.11 C ATOM 2392 OE1 GLN A 164 -41.735 10.616 -11.105 1.00 32.41 O ATOM 2393 NE2 GLN A 164 -40.550 9.386 -12.545 1.00 4.12 N ATOM 0 H GLN A 164 -42.334 8.374 -6.779 1.00 54.34 H new ATOM 0 HA GLN A 164 -42.386 10.292 -8.983 1.00 63.45 H new ATOM 0 HB2 GLN A 164 -42.796 7.300 -9.309 1.00 33.32 H new ATOM 0 HB3 GLN A 164 -43.497 8.466 -10.413 1.00 33.32 H new ATOM 0 HG2 GLN A 164 -40.516 8.263 -9.860 1.00 52.11 H new ATOM 0 HG3 GLN A 164 -41.320 7.414 -11.165 1.00 52.11 H new ATOM 0 HE21 GLN A 164 -40.145 8.479 -12.777 1.00 4.12 H new ATOM 0 HE22 GLN A 164 -40.430 10.175 -13.180 1.00 4.12 H new ATOM 2402 N GLN A 165 -45.032 9.974 -8.935 1.00 72.13 N ATOM 2403 CA GLN A 165 -46.423 10.146 -8.560 1.00 0.42 C ATOM 2404 C GLN A 165 -47.275 10.287 -9.809 1.00 31.23 C ATOM 2405 O GLN A 165 -47.360 11.364 -10.403 1.00 5.42 O ATOM 2406 CB GLN A 165 -46.585 11.381 -7.648 1.00 13.21 C ATOM 2407 CG GLN A 165 -47.796 11.335 -6.707 1.00 23.02 C ATOM 2408 CD GLN A 165 -49.138 11.547 -7.398 1.00 71.24 C ATOM 2409 OE1 GLN A 165 -49.158 12.363 -8.435 1.00 71.03 O flip ATOM 2410 NE2 GLN A 165 -50.154 10.994 -6.977 1.00 63.45 N flip ATOM 0 H GLN A 165 -44.806 10.291 -9.878 1.00 72.13 H new ATOM 0 HA GLN A 165 -46.755 9.269 -8.005 1.00 0.42 H new ATOM 0 HB2 GLN A 165 -45.682 11.493 -7.049 1.00 13.21 H new ATOM 0 HB3 GLN A 165 -46.664 12.269 -8.275 1.00 13.21 H new ATOM 0 HG2 GLN A 165 -47.810 10.370 -6.200 1.00 23.02 H new ATOM 0 HG3 GLN A 165 -47.672 12.097 -5.938 1.00 23.02 H new ATOM 0 HE21 GLN A 165 -50.099 10.370 -6.172 1.00 63.45 H new ATOM 0 HE22 GLN A 165 -51.051 11.160 -7.433 1.00 63.45 H new ATOM 2419 N GLN A 166 -47.874 9.196 -10.217 1.00 32.22 N ATOM 2420 CA GLN A 166 -48.732 9.192 -11.377 1.00 44.32 C ATOM 2421 C GLN A 166 -50.190 9.228 -10.928 1.00 34.23 C ATOM 2422 O GLN A 166 -50.494 8.931 -9.766 1.00 33.23 O ATOM 2423 CB GLN A 166 -48.451 7.951 -12.228 1.00 42.11 C ATOM 2424 CG GLN A 166 -49.098 7.974 -13.600 1.00 43.21 C ATOM 2425 CD GLN A 166 -48.730 6.770 -14.432 1.00 15.32 C ATOM 2426 OE1 GLN A 166 -49.406 5.742 -14.394 1.00 51.31 O ATOM 2427 NE2 GLN A 166 -47.647 6.878 -15.178 1.00 14.32 N ATOM 0 H GLN A 166 -47.782 8.290 -9.758 1.00 32.22 H new ATOM 0 HA GLN A 166 -48.533 10.073 -11.986 1.00 44.32 H new ATOM 0 HB2 GLN A 166 -47.373 7.845 -12.350 1.00 42.11 H new ATOM 0 HB3 GLN A 166 -48.799 7.069 -11.690 1.00 42.11 H new ATOM 0 HG2 GLN A 166 -50.181 8.016 -13.487 1.00 43.21 H new ATOM 0 HG3 GLN A 166 -48.797 8.880 -14.125 1.00 43.21 H new ATOM 0 HE21 GLN A 166 -47.115 7.748 -15.181 1.00 14.32 H new ATOM 0 HE22 GLN A 166 -47.342 6.092 -15.752 1.00 14.32 H new ATOM 2436 N SER A 167 -51.085 9.588 -11.834 1.00 40.41 N ATOM 2437 CA SER A 167 -52.508 9.683 -11.530 1.00 52.03 C ATOM 2438 C SER A 167 -53.323 9.615 -12.821 1.00 71.21 C ATOM 2439 O SER A 167 -52.776 9.777 -13.919 1.00 44.44 O ATOM 2440 CB SER A 167 -52.808 10.998 -10.793 1.00 22.05 C ATOM 2441 OG SER A 167 -52.064 11.094 -9.585 1.00 74.25 O ATOM 0 H SER A 167 -50.849 9.822 -12.798 1.00 40.41 H new ATOM 0 HA SER A 167 -52.785 8.847 -10.887 1.00 52.03 H new ATOM 0 HB2 SER A 167 -52.568 11.842 -11.439 1.00 22.05 H new ATOM 0 HB3 SER A 167 -53.874 11.059 -10.572 1.00 22.05 H new ATOM 0 HG SER A 167 -51.725 10.208 -9.338 1.00 74.25 H new ATOM 2447 N SER A 168 -54.618 9.369 -12.691 1.00 11.42 N ATOM 2448 CA SER A 168 -55.496 9.238 -13.842 1.00 72.02 C ATOM 2449 C SER A 168 -56.956 9.405 -13.405 1.00 13.44 C ATOM 2450 O SER A 168 -57.229 9.816 -12.276 1.00 3.23 O ATOM 2451 CB SER A 168 -55.280 7.858 -14.506 1.00 34.31 C ATOM 2452 OG SER A 168 -56.008 7.732 -15.726 1.00 61.54 O ATOM 0 H SER A 168 -55.086 9.255 -11.792 1.00 11.42 H new ATOM 0 HA SER A 168 -55.262 10.016 -14.569 1.00 72.02 H new ATOM 0 HB2 SER A 168 -54.218 7.712 -14.701 1.00 34.31 H new ATOM 0 HB3 SER A 168 -55.589 7.072 -13.817 1.00 34.31 H new ATOM 0 HG SER A 168 -55.964 8.576 -16.222 1.00 61.54 H new ATOM 2458 N ARG A 169 -57.877 9.098 -14.299 1.00 32.44 N ATOM 2459 CA ARG A 169 -59.293 9.192 -14.001 1.00 32.42 C ATOM 2460 C ARG A 169 -59.778 7.907 -13.338 1.00 12.12 C ATOM 2461 O ARG A 169 -60.297 7.979 -12.208 1.00 0.00 O ATOM 2462 CB ARG A 169 -60.111 9.501 -15.271 1.00 63.11 C ATOM 2463 CG ARG A 169 -59.924 8.505 -16.411 1.00 51.23 C ATOM 2464 CD ARG A 169 -60.811 8.848 -17.601 1.00 20.42 C ATOM 2465 NE ARG A 169 -60.503 10.167 -18.158 1.00 35.14 N ATOM 2466 CZ ARG A 169 -61.354 10.898 -18.887 1.00 53.22 C ATOM 2467 NH1 ARG A 169 -62.563 10.425 -19.179 1.00 34.10 N ATOM 2468 NH2 ARG A 169 -60.990 12.095 -19.328 1.00 43.34 N ATOM 2469 OXT ARG A 169 -59.589 6.824 -13.931 1.00 0.00 O ATOM 0 H ARG A 169 -57.667 8.779 -15.245 1.00 32.44 H new ATOM 0 HA ARG A 169 -59.443 10.018 -13.306 1.00 32.42 H new ATOM 0 HB2 ARG A 169 -61.168 9.534 -15.006 1.00 63.11 H new ATOM 0 HB3 ARG A 169 -59.840 10.495 -15.628 1.00 63.11 H new ATOM 0 HG2 ARG A 169 -58.880 8.499 -16.723 1.00 51.23 H new ATOM 0 HG3 ARG A 169 -60.157 7.500 -16.060 1.00 51.23 H new ATOM 0 HD2 ARG A 169 -60.687 8.091 -18.375 1.00 20.42 H new ATOM 0 HD3 ARG A 169 -61.856 8.821 -17.293 1.00 20.42 H new ATOM 0 HE ARG A 169 -59.577 10.555 -17.978 1.00 35.14 H new ATOM 0 HH11 ARG A 169 -62.844 9.502 -18.847 1.00 34.10 H new ATOM 0 HH12 ARG A 169 -63.209 10.985 -19.735 1.00 34.10 H new ATOM 0 HH21 ARG A 169 -60.062 12.458 -19.111 1.00 43.34 H new ATOM 0 HH22 ARG A 169 -61.638 12.653 -19.884 1.00 43.34 H new TER 2483 ARG A 169