USER MOD reduce.3.24.130724 H: found=0, std=0, add=1053, rem=0, adj=26 USER MOD reduce.3.24.130724 removed 1051 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 41 ASN : amide:sc= 2 K(o=4,f=0.91) USER MOD Set 1.2: A 124 THR OG1 : rot -111:sc= 2.04 USER MOD Set 2.1: A 65 GLN : amide:sc= 0.552! C(o=1.5!,f=-2.9!) USER MOD Set 2.2: A 68 THR OG1 : rot 100:sc= 0.929 USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ 162:sc= 1.32 (180deg=0.93) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 4 ASN : amide:sc= 0 X(o=0,f=-0.039) USER MOD Single : A 5 ASN : amide:sc= 0 K(o=0,f=-0.62) USER MOD Single : A 7 THR OG1 : rot 69:sc= 1.17 USER MOD Single : A 11 GLN : amide:sc= -0.164 K(o=-0.16,f=-1.8) USER MOD Single : A 14 THR OG1 : rot 180:sc= 0 USER MOD Single : A 15 THR OG1 : rot 41:sc= 0.201 USER MOD Single : A 16 SER OG : rot 180:sc= 0.00728 USER MOD Single : A 24 LYS NZ :NH3+ 136:sc= 0.385 (180deg=0) USER MOD Single : A 26 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 28 SER OG : rot 180:sc= 0 USER MOD Single : A 29 SER OG : rot 180:sc= 0 USER MOD Single : A 30 THR OG1 : rot 180:sc= 0 USER MOD Single : A 32 THR OG1 : rot 180:sc= 0.0771 USER MOD Single : A 36 SER OG : rot 180:sc= 0 USER MOD Single : A 37 THR OG1 : rot 180:sc= 0 USER MOD Single : A 46 SER OG : rot -119:sc= 0.449 USER MOD Single : A 52 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 56 ASN : amide:sc= -0.0356 K(o=-0.036,f=-5!) USER MOD Single : A 67 THR OG1 : rot 180:sc= 0 USER MOD Single : A 69 THR OG1 : rot 180:sc= 0.576 USER MOD Single : A 73 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 76 SER OG : rot 71:sc= 1.58 USER MOD Single : A 84 THR OG1 : rot -140:sc= -0.0885 USER MOD Single : A 86 SER OG : rot -117:sc= 0.893 USER MOD Single : A 89 HIS : no HD1:sc= -0.219 K(o=-0.22,f=-2.6!) USER MOD Single : A 95 ASN : amide:sc= 0.565 K(o=0.57,f=-8!) USER MOD Single : A 106 SER OG : rot -22:sc= 1.19 USER MOD Single : A 108 ASN : amide:sc= -1.39 K(o=-1.4,f=-2.1!) USER MOD Single : A 110 THR OG1 : rot 98:sc= 0.815 USER MOD Single : A 111 TYR OH : rot 74:sc= 1.17 USER MOD Single : A 113 ASN : amide:sc= 1.04 K(o=1,f=-0.28) USER MOD Single : A 118 ASN : amide:sc= 0.00675 X(o=0.0068,f=-0.0024) USER MOD Single : A 120 GLN : amide:sc= -1.07 K(o=-1.1,f=-7.2!) USER MOD Single : A 122 MET CE :methyl 169:sc= -2.75 (180deg=-2.83) USER MOD Single : A 123 GLN : amide:sc= -0.0355 X(o=-0.036,f=0) USER MOD Single : A 129 GLN : amide:sc= -0.105 K(o=-0.1,f=-1) USER MOD Single : A 132 LYS NZ :NH3+ -166:sc= -0.0239 (180deg=-0.264) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 -114.394 11.213 -23.589 1.00 11.00 N ATOM 2 CA MET A 1 -113.109 11.499 -24.231 1.00 43.05 C ATOM 3 C MET A 1 -112.457 10.202 -24.640 1.00 12.43 C ATOM 4 O MET A 1 -112.961 9.134 -24.291 1.00 51.13 O ATOM 5 CB MET A 1 -112.189 12.308 -23.293 1.00 35.14 C ATOM 6 CG MET A 1 -112.633 13.751 -23.028 1.00 12.22 C ATOM 7 SD MET A 1 -114.268 13.884 -22.260 1.00 13.40 S ATOM 8 CE MET A 1 -114.394 15.659 -22.033 1.00 10.23 C ATOM 0 H1 MET A 1 -114.701 12.043 -23.043 1.00 11.00 H new ATOM 0 H2 MET A 1 -115.105 10.995 -24.316 1.00 11.00 H new ATOM 0 H3 MET A 1 -114.290 10.398 -22.951 1.00 11.00 H new ATOM 0 HA MET A 1 -113.282 12.107 -25.119 1.00 43.05 H new ATOM 0 HB2 MET A 1 -112.119 11.785 -22.339 1.00 35.14 H new ATOM 0 HB3 MET A 1 -111.186 12.326 -23.720 1.00 35.14 H new ATOM 0 HG2 MET A 1 -111.899 14.235 -22.384 1.00 12.22 H new ATOM 0 HG3 MET A 1 -112.639 14.298 -23.971 1.00 12.22 H new ATOM 0 HE1 MET A 1 -115.350 15.899 -21.568 1.00 10.23 H new ATOM 0 HE2 MET A 1 -113.582 16.002 -21.392 1.00 10.23 H new ATOM 0 HE3 MET A 1 -114.326 16.155 -23.001 1.00 10.23 H new ATOM 20 N SER A 2 -111.366 10.276 -25.379 1.00 34.10 N ATOM 21 CA SER A 2 -110.657 9.088 -25.811 1.00 4.11 C ATOM 22 C SER A 2 -109.998 8.420 -24.611 1.00 32.02 C ATOM 23 O SER A 2 -110.126 7.206 -24.410 1.00 51.12 O ATOM 24 CB SER A 2 -109.608 9.479 -26.839 1.00 64.41 C ATOM 25 OG SER A 2 -110.200 10.236 -27.885 1.00 3.13 O ATOM 0 H SER A 2 -110.950 11.153 -25.694 1.00 34.10 H new ATOM 0 HA SER A 2 -111.356 8.384 -26.263 1.00 4.11 H new ATOM 0 HB2 SER A 2 -108.820 10.061 -26.361 1.00 64.41 H new ATOM 0 HB3 SER A 2 -109.140 8.584 -27.249 1.00 64.41 H new ATOM 0 HG SER A 2 -109.513 10.483 -28.539 1.00 3.13 H new ATOM 31 N ASP A 3 -109.315 9.248 -23.816 1.00 33.22 N ATOM 32 CA ASP A 3 -108.611 8.858 -22.588 1.00 51.43 C ATOM 33 C ASP A 3 -107.405 7.944 -22.918 1.00 40.32 C ATOM 34 O ASP A 3 -107.190 7.582 -24.082 1.00 40.43 O ATOM 35 CB ASP A 3 -109.590 8.209 -21.572 1.00 51.34 C ATOM 36 CG ASP A 3 -109.021 8.086 -20.183 1.00 43.22 C ATOM 37 OD1 ASP A 3 -109.053 9.069 -19.432 1.00 72.23 O ATOM 38 OD2 ASP A 3 -108.546 7.010 -19.821 1.00 52.32 O ATOM 0 H ASP A 3 -109.233 10.245 -24.016 1.00 33.22 H new ATOM 0 HA ASP A 3 -108.212 9.753 -22.111 1.00 51.43 H new ATOM 0 HB2 ASP A 3 -110.504 8.802 -21.530 1.00 51.34 H new ATOM 0 HB3 ASP A 3 -109.869 7.218 -21.931 1.00 51.34 H new ATOM 43 N ASN A 4 -106.610 7.608 -21.936 1.00 64.01 N ATOM 44 CA ASN A 4 -105.430 6.773 -22.168 1.00 13.20 C ATOM 45 C ASN A 4 -105.388 5.621 -21.187 1.00 52.20 C ATOM 46 O ASN A 4 -104.535 4.736 -21.307 1.00 31.02 O ATOM 47 CB ASN A 4 -104.125 7.593 -22.035 1.00 51.44 C ATOM 48 CG ASN A 4 -103.856 8.093 -20.612 1.00 2.15 C ATOM 49 OD1 ASN A 4 -103.207 7.419 -19.811 1.00 35.22 O ATOM 50 ND2 ASN A 4 -104.335 9.273 -20.295 1.00 71.22 N ATOM 0 H ASN A 4 -106.746 7.892 -20.966 1.00 64.01 H new ATOM 0 HA ASN A 4 -105.504 6.387 -23.184 1.00 13.20 H new ATOM 0 HB2 ASN A 4 -103.285 6.979 -22.360 1.00 51.44 H new ATOM 0 HB3 ASN A 4 -104.173 8.449 -22.709 1.00 51.44 H new ATOM 0 HD21 ASN A 4 -104.173 9.656 -19.363 1.00 71.22 H new ATOM 0 HD22 ASN A 4 -104.869 9.808 -20.980 1.00 71.22 H new ATOM 57 N ASN A 5 -106.332 5.630 -20.245 1.00 52.12 N ATOM 58 CA ASN A 5 -106.409 4.688 -19.127 1.00 40.10 C ATOM 59 C ASN A 5 -105.173 4.821 -18.256 1.00 30.12 C ATOM 60 O ASN A 5 -104.122 4.249 -18.571 1.00 31.24 O ATOM 61 CB ASN A 5 -106.583 3.232 -19.588 1.00 63.11 C ATOM 62 CG ASN A 5 -106.797 2.282 -18.427 1.00 71.11 C ATOM 63 OD1 ASN A 5 -107.420 2.628 -17.421 1.00 12.11 O ATOM 64 ND2 ASN A 5 -106.287 1.090 -18.545 1.00 1.25 N ATOM 0 H ASN A 5 -107.088 6.315 -20.239 1.00 52.12 H new ATOM 0 HA ASN A 5 -107.298 4.943 -18.550 1.00 40.10 H new ATOM 0 HB2 ASN A 5 -107.432 3.168 -20.268 1.00 63.11 H new ATOM 0 HB3 ASN A 5 -105.701 2.923 -20.149 1.00 63.11 H new ATOM 0 HD21 ASN A 5 -106.398 0.411 -17.792 1.00 1.25 H new ATOM 0 HD22 ASN A 5 -105.777 0.835 -19.391 1.00 1.25 H new ATOM 71 N GLY A 6 -105.290 5.617 -17.200 1.00 53.21 N ATOM 72 CA GLY A 6 -104.181 5.870 -16.294 1.00 64.12 C ATOM 73 C GLY A 6 -103.609 4.610 -15.699 1.00 54.23 C ATOM 74 O GLY A 6 -104.161 4.065 -14.742 1.00 4.12 O ATOM 0 H GLY A 6 -106.152 6.102 -16.950 1.00 53.21 H new ATOM 0 HA2 GLY A 6 -103.395 6.402 -16.830 1.00 64.12 H new ATOM 0 HA3 GLY A 6 -104.518 6.525 -15.490 1.00 64.12 H new ATOM 78 N THR A 7 -102.516 4.163 -16.253 1.00 22.11 N ATOM 79 CA THR A 7 -101.883 2.943 -15.850 1.00 3.40 C ATOM 80 C THR A 7 -100.471 3.245 -15.344 1.00 14.41 C ATOM 81 O THR A 7 -99.733 4.001 -15.989 1.00 2.31 O ATOM 82 CB THR A 7 -101.799 1.981 -17.063 1.00 61.21 C ATOM 83 OG1 THR A 7 -103.107 1.854 -17.660 1.00 5.33 O ATOM 84 CG2 THR A 7 -101.300 0.598 -16.642 1.00 75.04 C ATOM 0 H THR A 7 -102.034 4.647 -17.010 1.00 22.11 H new ATOM 0 HA THR A 7 -102.464 2.477 -15.054 1.00 3.40 H new ATOM 0 HB THR A 7 -101.092 2.396 -17.781 1.00 61.21 H new ATOM 0 HG1 THR A 7 -103.354 2.700 -18.089 1.00 5.33 H new ATOM 0 HG21 THR A 7 -101.252 -0.053 -17.515 1.00 75.04 H new ATOM 0 HG22 THR A 7 -100.307 0.688 -16.202 1.00 75.04 H new ATOM 0 HG23 THR A 7 -101.985 0.172 -15.909 1.00 75.04 H new ATOM 92 N PRO A 8 -100.091 2.726 -14.168 1.00 45.01 N ATOM 93 CA PRO A 8 -98.735 2.881 -13.668 1.00 34.13 C ATOM 94 C PRO A 8 -97.755 2.111 -14.556 1.00 70.54 C ATOM 95 O PRO A 8 -97.954 0.928 -14.825 1.00 3.34 O ATOM 96 CB PRO A 8 -98.789 2.266 -12.262 1.00 72.21 C ATOM 97 CG PRO A 8 -99.956 1.342 -12.291 1.00 25.23 C ATOM 98 CD PRO A 8 -100.944 1.952 -13.238 1.00 4.40 C ATOM 0 HA PRO A 8 -98.399 3.918 -13.659 1.00 34.13 H new ATOM 0 HB2 PRO A 8 -97.868 1.732 -12.029 1.00 72.21 H new ATOM 0 HB3 PRO A 8 -98.913 3.035 -11.499 1.00 72.21 H new ATOM 0 HG2 PRO A 8 -99.658 0.348 -12.625 1.00 25.23 H new ATOM 0 HG3 PRO A 8 -100.388 1.228 -11.297 1.00 25.23 H new ATOM 0 HD2 PRO A 8 -101.522 1.191 -13.762 1.00 4.40 H new ATOM 0 HD3 PRO A 8 -101.657 2.592 -12.718 1.00 4.40 H new ATOM 106 N GLU A 9 -96.734 2.772 -15.018 1.00 63.04 N ATOM 107 CA GLU A 9 -95.744 2.139 -15.862 1.00 1.43 C ATOM 108 C GLU A 9 -94.553 1.714 -15.002 1.00 4.32 C ATOM 109 O GLU A 9 -93.853 2.568 -14.448 1.00 72.13 O ATOM 110 CB GLU A 9 -95.327 3.092 -16.980 1.00 70.30 C ATOM 111 CG GLU A 9 -96.489 3.501 -17.878 1.00 71.32 C ATOM 112 CD GLU A 9 -96.116 4.544 -18.890 1.00 45.02 C ATOM 113 OE1 GLU A 9 -96.079 5.740 -18.535 1.00 64.23 O ATOM 114 OE2 GLU A 9 -95.871 4.203 -20.067 1.00 11.40 O ATOM 0 H GLU A 9 -96.558 3.758 -14.826 1.00 63.04 H new ATOM 0 HA GLU A 9 -96.162 1.249 -16.332 1.00 1.43 H new ATOM 0 HB2 GLU A 9 -94.882 3.985 -16.541 1.00 70.30 H new ATOM 0 HB3 GLU A 9 -94.556 2.617 -17.586 1.00 70.30 H new ATOM 0 HG2 GLU A 9 -96.867 2.620 -18.397 1.00 71.32 H new ATOM 0 HG3 GLU A 9 -97.302 3.879 -17.259 1.00 71.32 H new ATOM 121 N PRO A 10 -94.320 0.401 -14.873 1.00 62.31 N ATOM 122 CA PRO A 10 -93.300 -0.154 -13.971 1.00 1.24 C ATOM 123 C PRO A 10 -91.871 0.274 -14.314 1.00 72.32 C ATOM 124 O PRO A 10 -91.469 0.279 -15.484 1.00 13.04 O ATOM 125 CB PRO A 10 -93.459 -1.675 -14.136 1.00 62.24 C ATOM 126 CG PRO A 10 -94.125 -1.852 -15.449 1.00 22.11 C ATOM 127 CD PRO A 10 -95.013 -0.661 -15.626 1.00 74.33 C ATOM 0 HA PRO A 10 -93.447 0.204 -12.952 1.00 1.24 H new ATOM 0 HB2 PRO A 10 -92.492 -2.178 -14.113 1.00 62.24 H new ATOM 0 HB3 PRO A 10 -94.058 -2.099 -13.330 1.00 62.24 H new ATOM 0 HG2 PRO A 10 -93.392 -1.915 -16.253 1.00 22.11 H new ATOM 0 HG3 PRO A 10 -94.703 -2.776 -15.472 1.00 22.11 H new ATOM 0 HD2 PRO A 10 -95.127 -0.398 -16.678 1.00 74.33 H new ATOM 0 HD3 PRO A 10 -96.013 -0.844 -15.233 1.00 74.33 H new ATOM 135 N GLN A 11 -91.122 0.624 -13.301 1.00 2.43 N ATOM 136 CA GLN A 11 -89.743 1.013 -13.453 1.00 25.34 C ATOM 137 C GLN A 11 -88.929 0.157 -12.500 1.00 70.14 C ATOM 138 O GLN A 11 -89.052 0.289 -11.279 1.00 63.23 O ATOM 139 CB GLN A 11 -89.585 2.529 -13.138 1.00 43.22 C ATOM 140 CG GLN A 11 -88.246 3.192 -13.550 1.00 22.12 C ATOM 141 CD GLN A 11 -87.026 2.827 -12.698 1.00 22.44 C ATOM 142 OE1 GLN A 11 -87.131 2.542 -11.502 1.00 51.24 O ATOM 143 NE2 GLN A 11 -85.860 2.876 -13.292 1.00 0.14 N ATOM 0 H GLN A 11 -91.455 0.647 -12.337 1.00 2.43 H new ATOM 0 HA GLN A 11 -89.395 0.860 -14.474 1.00 25.34 H new ATOM 0 HB2 GLN A 11 -90.396 3.065 -13.632 1.00 43.22 H new ATOM 0 HB3 GLN A 11 -89.717 2.669 -12.065 1.00 43.22 H new ATOM 0 HG2 GLN A 11 -88.034 2.925 -14.585 1.00 22.12 H new ATOM 0 HG3 GLN A 11 -88.375 4.274 -13.520 1.00 22.12 H new ATOM 0 HE21 GLN A 11 -85.802 3.114 -14.282 1.00 0.14 H new ATOM 0 HE22 GLN A 11 -85.010 2.676 -12.765 1.00 0.14 H new ATOM 152 N VAL A 12 -88.164 -0.758 -13.038 1.00 15.43 N ATOM 153 CA VAL A 12 -87.332 -1.595 -12.213 1.00 54.53 C ATOM 154 C VAL A 12 -85.937 -0.981 -12.116 1.00 50.30 C ATOM 155 O VAL A 12 -85.366 -0.525 -13.119 1.00 43.34 O ATOM 156 CB VAL A 12 -87.282 -3.084 -12.715 1.00 31.35 C ATOM 157 CG1 VAL A 12 -86.705 -3.204 -14.116 1.00 61.11 C ATOM 158 CG2 VAL A 12 -86.525 -3.979 -11.735 1.00 70.22 C ATOM 0 H VAL A 12 -88.100 -0.942 -14.039 1.00 15.43 H new ATOM 0 HA VAL A 12 -87.773 -1.638 -11.217 1.00 54.53 H new ATOM 0 HB VAL A 12 -88.315 -3.430 -12.763 1.00 31.35 H new ATOM 0 HG11 VAL A 12 -86.692 -4.252 -14.416 1.00 61.11 H new ATOM 0 HG12 VAL A 12 -87.320 -2.635 -14.813 1.00 61.11 H new ATOM 0 HG13 VAL A 12 -85.688 -2.812 -14.126 1.00 61.11 H new ATOM 0 HG21 VAL A 12 -86.510 -5.001 -12.113 1.00 70.22 H new ATOM 0 HG22 VAL A 12 -85.503 -3.617 -11.627 1.00 70.22 H new ATOM 0 HG23 VAL A 12 -87.022 -3.958 -10.765 1.00 70.22 H new ATOM 168 N GLU A 13 -85.424 -0.911 -10.927 1.00 23.03 N ATOM 169 CA GLU A 13 -84.139 -0.337 -10.707 1.00 52.11 C ATOM 170 C GLU A 13 -83.189 -1.418 -10.218 1.00 34.34 C ATOM 171 O GLU A 13 -83.569 -2.277 -9.419 1.00 1.15 O ATOM 172 CB GLU A 13 -84.237 0.822 -9.708 1.00 33.44 C ATOM 173 CG GLU A 13 -82.974 1.654 -9.607 1.00 74.34 C ATOM 174 CD GLU A 13 -82.552 2.183 -10.958 1.00 13.44 C ATOM 175 OE1 GLU A 13 -83.113 3.194 -11.429 1.00 35.53 O ATOM 176 OE2 GLU A 13 -81.652 1.571 -11.593 1.00 51.03 O ATOM 0 H GLU A 13 -85.886 -1.251 -10.084 1.00 23.03 H new ATOM 0 HA GLU A 13 -83.750 0.071 -11.640 1.00 52.11 H new ATOM 0 HB2 GLU A 13 -85.065 1.469 -9.998 1.00 33.44 H new ATOM 0 HB3 GLU A 13 -84.476 0.421 -8.723 1.00 33.44 H new ATOM 0 HG2 GLU A 13 -83.139 2.487 -8.924 1.00 74.34 H new ATOM 0 HG3 GLU A 13 -82.171 1.050 -9.184 1.00 74.34 H new ATOM 183 N THR A 14 -81.984 -1.386 -10.709 1.00 74.13 N ATOM 184 CA THR A 14 -80.994 -2.370 -10.370 1.00 72.53 C ATOM 185 C THR A 14 -80.049 -1.776 -9.320 1.00 45.32 C ATOM 186 O THR A 14 -79.401 -0.763 -9.576 1.00 23.41 O ATOM 187 CB THR A 14 -80.191 -2.742 -11.632 1.00 14.21 C ATOM 188 OG1 THR A 14 -81.103 -3.044 -12.728 1.00 50.14 O ATOM 189 CG2 THR A 14 -79.307 -3.943 -11.370 1.00 71.14 C ATOM 0 H THR A 14 -81.657 -0.672 -11.360 1.00 74.13 H new ATOM 0 HA THR A 14 -81.476 -3.263 -9.973 1.00 72.53 H new ATOM 0 HB THR A 14 -79.562 -1.893 -11.900 1.00 14.21 H new ATOM 0 HG1 THR A 14 -80.587 -3.278 -13.528 1.00 50.14 H new ATOM 0 HG21 THR A 14 -78.749 -4.188 -12.274 1.00 71.14 H new ATOM 0 HG22 THR A 14 -78.610 -3.713 -10.565 1.00 71.14 H new ATOM 0 HG23 THR A 14 -79.925 -4.794 -11.083 1.00 71.14 H new ATOM 197 N THR A 15 -79.990 -2.360 -8.154 1.00 34.31 N ATOM 198 CA THR A 15 -79.152 -1.830 -7.117 1.00 35.33 C ATOM 199 C THR A 15 -78.031 -2.808 -6.732 1.00 73.11 C ATOM 200 O THR A 15 -78.266 -3.831 -6.076 1.00 64.35 O ATOM 201 CB THR A 15 -79.992 -1.423 -5.881 1.00 62.23 C ATOM 202 OG1 THR A 15 -80.805 -2.528 -5.451 1.00 11.55 O ATOM 203 CG2 THR A 15 -80.890 -0.238 -6.203 1.00 4.23 C ATOM 0 H THR A 15 -80.511 -3.200 -7.900 1.00 34.31 H new ATOM 0 HA THR A 15 -78.673 -0.933 -7.510 1.00 35.33 H new ATOM 0 HB THR A 15 -79.304 -1.140 -5.084 1.00 62.23 H new ATOM 0 HG1 THR A 15 -80.288 -3.358 -5.512 1.00 11.55 H new ATOM 0 HG21 THR A 15 -81.470 0.029 -5.320 1.00 4.23 H new ATOM 0 HG22 THR A 15 -80.277 0.611 -6.506 1.00 4.23 H new ATOM 0 HG23 THR A 15 -81.567 -0.504 -7.015 1.00 4.23 H new ATOM 211 N SER A 16 -76.843 -2.520 -7.186 1.00 61.13 N ATOM 212 CA SER A 16 -75.684 -3.274 -6.861 1.00 12.55 C ATOM 213 C SER A 16 -74.793 -2.392 -6.009 1.00 13.05 C ATOM 214 O SER A 16 -74.700 -1.187 -6.250 1.00 42.22 O ATOM 215 CB SER A 16 -74.996 -3.711 -8.158 1.00 41.51 C ATOM 216 OG SER A 16 -74.924 -2.626 -9.079 1.00 14.52 O ATOM 0 H SER A 16 -76.659 -1.733 -7.808 1.00 61.13 H new ATOM 0 HA SER A 16 -75.925 -4.177 -6.301 1.00 12.55 H new ATOM 0 HB2 SER A 16 -73.993 -4.076 -7.938 1.00 41.51 H new ATOM 0 HB3 SER A 16 -75.545 -4.539 -8.606 1.00 41.51 H new ATOM 0 HG SER A 16 -74.480 -2.923 -9.901 1.00 14.52 H new ATOM 222 N VAL A 17 -74.204 -2.945 -4.991 1.00 42.41 N ATOM 223 CA VAL A 17 -73.382 -2.167 -4.105 1.00 25.23 C ATOM 224 C VAL A 17 -71.954 -2.688 -4.052 1.00 74.10 C ATOM 225 O VAL A 17 -71.713 -3.897 -3.986 1.00 1.21 O ATOM 226 CB VAL A 17 -73.979 -2.075 -2.675 1.00 64.22 C ATOM 227 CG1 VAL A 17 -75.309 -1.341 -2.690 1.00 11.14 C ATOM 228 CG2 VAL A 17 -74.156 -3.452 -2.054 1.00 15.24 C ATOM 0 H VAL A 17 -74.276 -3.934 -4.751 1.00 42.41 H new ATOM 0 HA VAL A 17 -73.360 -1.159 -4.520 1.00 25.23 H new ATOM 0 HB VAL A 17 -73.271 -1.514 -2.065 1.00 64.22 H new ATOM 0 HG11 VAL A 17 -75.708 -1.289 -1.677 1.00 11.14 H new ATOM 0 HG12 VAL A 17 -75.163 -0.332 -3.075 1.00 11.14 H new ATOM 0 HG13 VAL A 17 -76.012 -1.875 -3.330 1.00 11.14 H new ATOM 0 HG21 VAL A 17 -74.576 -3.349 -1.053 1.00 15.24 H new ATOM 0 HG22 VAL A 17 -74.831 -4.045 -2.671 1.00 15.24 H new ATOM 0 HG23 VAL A 17 -73.188 -3.950 -1.992 1.00 15.24 H new ATOM 238 N PHE A 18 -71.024 -1.782 -4.111 1.00 41.10 N ATOM 239 CA PHE A 18 -69.623 -2.098 -4.018 1.00 11.14 C ATOM 240 C PHE A 18 -68.937 -0.850 -3.521 1.00 63.32 C ATOM 241 O PHE A 18 -69.270 0.246 -3.957 1.00 55.44 O ATOM 242 CB PHE A 18 -69.071 -2.551 -5.380 1.00 61.51 C ATOM 243 CG PHE A 18 -67.657 -3.054 -5.328 1.00 0.12 C ATOM 244 CD1 PHE A 18 -67.334 -4.170 -4.567 1.00 14.02 C ATOM 245 CD2 PHE A 18 -66.654 -2.415 -6.028 1.00 22.51 C ATOM 246 CE1 PHE A 18 -66.037 -4.634 -4.510 1.00 44.45 C ATOM 247 CE2 PHE A 18 -65.356 -2.874 -5.976 1.00 31.15 C ATOM 248 CZ PHE A 18 -65.047 -3.985 -5.215 1.00 35.24 C ATOM 0 H PHE A 18 -71.216 -0.787 -4.227 1.00 41.10 H new ATOM 0 HA PHE A 18 -69.447 -2.928 -3.333 1.00 11.14 H new ATOM 0 HB2 PHE A 18 -69.712 -3.338 -5.777 1.00 61.51 H new ATOM 0 HB3 PHE A 18 -69.123 -1.716 -6.078 1.00 61.51 H new ATOM 0 HD1 PHE A 18 -68.108 -4.680 -4.013 1.00 14.02 H new ATOM 0 HD2 PHE A 18 -66.889 -1.545 -6.623 1.00 22.51 H new ATOM 0 HE1 PHE A 18 -65.798 -5.503 -3.915 1.00 44.45 H new ATOM 0 HE2 PHE A 18 -64.581 -2.366 -6.530 1.00 31.15 H new ATOM 0 HZ PHE A 18 -64.030 -4.345 -5.173 1.00 35.24 H new ATOM 258 N ARG A 19 -68.037 -0.989 -2.587 1.00 52.20 N ATOM 259 CA ARG A 19 -67.431 0.161 -1.958 1.00 32.24 C ATOM 260 C ARG A 19 -65.953 0.140 -2.228 1.00 44.45 C ATOM 261 O ARG A 19 -65.491 -0.559 -3.148 1.00 24.31 O ATOM 262 CB ARG A 19 -67.641 0.122 -0.425 1.00 64.53 C ATOM 263 CG ARG A 19 -69.085 0.083 0.093 1.00 61.31 C ATOM 264 CD ARG A 19 -69.739 -1.287 -0.097 1.00 73.24 C ATOM 265 NE ARG A 19 -68.923 -2.358 0.493 1.00 62.42 N ATOM 266 CZ ARG A 19 -69.229 -3.052 1.597 1.00 53.20 C ATOM 267 NH1 ARG A 19 -70.342 -2.784 2.289 1.00 41.31 N ATOM 268 NH2 ARG A 19 -68.399 -3.984 2.024 1.00 31.30 N ATOM 0 H ARG A 19 -67.703 -1.889 -2.241 1.00 52.20 H new ATOM 0 HA ARG A 19 -67.893 1.062 -2.362 1.00 32.24 H new ATOM 0 HB2 ARG A 19 -67.121 -0.754 -0.037 1.00 64.53 H new ATOM 0 HB3 ARG A 19 -67.154 0.998 0.003 1.00 64.53 H new ATOM 0 HG2 ARG A 19 -69.095 0.343 1.151 1.00 61.31 H new ATOM 0 HG3 ARG A 19 -69.674 0.839 -0.426 1.00 61.31 H new ATOM 0 HD2 ARG A 19 -70.728 -1.286 0.362 1.00 73.24 H new ATOM 0 HD3 ARG A 19 -69.881 -1.480 -1.160 1.00 73.24 H new ATOM 0 HE ARG A 19 -68.049 -2.593 0.022 1.00 62.42 H new ATOM 0 HH11 ARG A 19 -70.970 -2.043 1.978 1.00 41.31 H new ATOM 0 HH12 ARG A 19 -70.563 -3.321 3.128 1.00 41.31 H new ATOM 0 HH21 ARG A 19 -67.535 -4.170 1.515 1.00 31.30 H new ATOM 0 HH22 ARG A 19 -68.621 -4.519 2.864 1.00 31.30 H new ATOM 282 N ALA A 20 -65.213 0.925 -1.476 1.00 74.41 N ATOM 283 CA ALA A 20 -63.783 0.850 -1.491 1.00 61.21 C ATOM 284 C ALA A 20 -63.409 -0.305 -0.573 1.00 14.11 C ATOM 285 O ALA A 20 -63.137 -0.129 0.616 1.00 50.01 O ATOM 286 CB ALA A 20 -63.163 2.163 -1.033 1.00 41.45 C ATOM 0 H ALA A 20 -65.592 1.628 -0.842 1.00 74.41 H new ATOM 0 HA ALA A 20 -63.402 0.678 -2.498 1.00 61.21 H new ATOM 0 HB1 ALA A 20 -62.076 2.079 -1.054 1.00 41.45 H new ATOM 0 HB2 ALA A 20 -63.478 2.966 -1.700 1.00 41.45 H new ATOM 0 HB3 ALA A 20 -63.490 2.385 -0.017 1.00 41.45 H new ATOM 292 N ASP A 21 -63.508 -1.485 -1.122 1.00 64.21 N ATOM 293 CA ASP A 21 -63.380 -2.728 -0.385 1.00 42.01 C ATOM 294 C ASP A 21 -61.966 -3.273 -0.336 1.00 22.13 C ATOM 295 O ASP A 21 -61.727 -4.320 0.273 1.00 22.34 O ATOM 296 CB ASP A 21 -64.375 -3.799 -0.902 1.00 43.42 C ATOM 297 CG ASP A 21 -65.797 -3.642 -0.357 1.00 73.23 C ATOM 298 OD1 ASP A 21 -66.646 -2.946 -0.972 1.00 53.42 O ATOM 299 OD2 ASP A 21 -66.097 -4.247 0.707 1.00 12.20 O ATOM 0 H ASP A 21 -63.684 -1.620 -2.118 1.00 64.21 H new ATOM 0 HA ASP A 21 -63.638 -2.482 0.645 1.00 42.01 H new ATOM 0 HB2 ASP A 21 -64.407 -3.755 -1.991 1.00 43.42 H new ATOM 0 HB3 ASP A 21 -64.001 -4.787 -0.634 1.00 43.42 H new ATOM 304 N LEU A 22 -61.034 -2.613 -0.986 1.00 35.22 N ATOM 305 CA LEU A 22 -59.656 -3.081 -0.954 1.00 2.12 C ATOM 306 C LEU A 22 -58.867 -2.411 0.163 1.00 4.03 C ATOM 307 O LEU A 22 -58.420 -1.263 0.032 1.00 63.12 O ATOM 308 CB LEU A 22 -58.927 -2.882 -2.290 1.00 61.14 C ATOM 309 CG LEU A 22 -57.457 -3.364 -2.309 1.00 11.31 C ATOM 310 CD1 LEU A 22 -57.359 -4.874 -2.130 1.00 45.21 C ATOM 311 CD2 LEU A 22 -56.744 -2.923 -3.572 1.00 74.54 C ATOM 0 H LEU A 22 -61.193 -1.768 -1.534 1.00 35.22 H new ATOM 0 HA LEU A 22 -59.712 -4.153 -0.763 1.00 2.12 H new ATOM 0 HB2 LEU A 22 -59.477 -3.410 -3.069 1.00 61.14 H new ATOM 0 HB3 LEU A 22 -58.950 -1.823 -2.545 1.00 61.14 H new ATOM 0 HG LEU A 22 -56.956 -2.896 -1.461 1.00 11.31 H new ATOM 0 HD11 LEU A 22 -56.312 -5.175 -2.149 1.00 45.21 H new ATOM 0 HD12 LEU A 22 -57.801 -5.157 -1.175 1.00 45.21 H new ATOM 0 HD13 LEU A 22 -57.894 -5.372 -2.939 1.00 45.21 H new ATOM 0 HD21 LEU A 22 -55.714 -3.279 -3.551 1.00 74.54 H new ATOM 0 HD22 LEU A 22 -57.254 -3.338 -4.441 1.00 74.54 H new ATOM 0 HD23 LEU A 22 -56.751 -1.835 -3.632 1.00 74.54 H new ATOM 323 N LEU A 23 -58.716 -3.101 1.246 1.00 34.12 N ATOM 324 CA LEU A 23 -57.928 -2.619 2.349 1.00 42.24 C ATOM 325 C LEU A 23 -56.539 -3.234 2.242 1.00 4.11 C ATOM 326 O LEU A 23 -56.394 -4.370 1.769 1.00 64.02 O ATOM 327 CB LEU A 23 -58.603 -2.977 3.683 1.00 32.44 C ATOM 328 CG LEU A 23 -57.919 -2.502 4.974 1.00 72.45 C ATOM 329 CD1 LEU A 23 -57.779 -0.985 5.004 1.00 52.51 C ATOM 330 CD2 LEU A 23 -58.707 -2.977 6.178 1.00 71.41 C ATOM 0 H LEU A 23 -59.134 -4.019 1.398 1.00 34.12 H new ATOM 0 HA LEU A 23 -57.845 -1.533 2.315 1.00 42.24 H new ATOM 0 HB2 LEU A 23 -59.614 -2.570 3.668 1.00 32.44 H new ATOM 0 HB3 LEU A 23 -58.697 -4.062 3.732 1.00 32.44 H new ATOM 0 HG LEU A 23 -56.917 -2.930 5.004 1.00 72.45 H new ATOM 0 HD11 LEU A 23 -57.291 -0.683 5.931 1.00 52.51 H new ATOM 0 HD12 LEU A 23 -57.179 -0.658 4.155 1.00 52.51 H new ATOM 0 HD13 LEU A 23 -58.767 -0.527 4.948 1.00 52.51 H new ATOM 0 HD21 LEU A 23 -58.217 -2.637 7.091 1.00 71.41 H new ATOM 0 HD22 LEU A 23 -59.717 -2.570 6.135 1.00 71.41 H new ATOM 0 HD23 LEU A 23 -58.754 -4.066 6.175 1.00 71.41 H new ATOM 342 N LYS A 24 -55.533 -2.496 2.632 1.00 32.35 N ATOM 343 CA LYS A 24 -54.165 -2.963 2.550 1.00 75.25 C ATOM 344 C LYS A 24 -53.402 -2.463 3.756 1.00 3.24 C ATOM 345 O LYS A 24 -53.953 -1.712 4.568 1.00 23.44 O ATOM 346 CB LYS A 24 -53.455 -2.492 1.242 1.00 34.41 C ATOM 347 CG LYS A 24 -53.122 -0.984 1.149 1.00 74.21 C ATOM 348 CD LYS A 24 -54.343 -0.079 0.984 1.00 42.31 C ATOM 349 CE LYS A 24 -55.043 -0.319 -0.342 1.00 24.31 C ATOM 350 NZ LYS A 24 -56.122 0.659 -0.584 1.00 72.01 N ATOM 0 H LYS A 24 -55.633 -1.556 3.015 1.00 32.35 H new ATOM 0 HA LYS A 24 -54.182 -4.053 2.531 1.00 75.25 H new ATOM 0 HB2 LYS A 24 -52.528 -3.055 1.134 1.00 34.41 H new ATOM 0 HB3 LYS A 24 -54.088 -2.756 0.395 1.00 34.41 H new ATOM 0 HG2 LYS A 24 -52.583 -0.687 2.049 1.00 74.21 H new ATOM 0 HG3 LYS A 24 -52.449 -0.824 0.307 1.00 74.21 H new ATOM 0 HD2 LYS A 24 -55.041 -0.257 1.802 1.00 42.31 H new ATOM 0 HD3 LYS A 24 -54.034 0.964 1.049 1.00 42.31 H new ATOM 0 HE2 LYS A 24 -54.315 -0.263 -1.151 1.00 24.31 H new ATOM 0 HE3 LYS A 24 -55.458 -1.327 -0.356 1.00 24.31 H new ATOM 0 HZ1 LYS A 24 -56.074 0.993 -1.568 1.00 72.01 H new ATOM 0 HZ2 LYS A 24 -57.044 0.207 -0.417 1.00 72.01 H new ATOM 0 HZ3 LYS A 24 -56.010 1.467 0.062 1.00 72.01 H new ATOM 364 N GLU A 25 -52.156 -2.848 3.860 1.00 12.22 N ATOM 365 CA GLU A 25 -51.309 -2.434 4.944 1.00 20.11 C ATOM 366 C GLU A 25 -49.976 -1.942 4.391 1.00 64.20 C ATOM 367 O GLU A 25 -49.785 -1.875 3.169 1.00 12.10 O ATOM 368 CB GLU A 25 -51.093 -3.580 5.980 1.00 54.25 C ATOM 369 CG GLU A 25 -50.324 -4.823 5.480 1.00 12.23 C ATOM 370 CD GLU A 25 -51.031 -5.597 4.392 1.00 64.43 C ATOM 371 OE1 GLU A 25 -51.932 -6.419 4.706 1.00 63.11 O ATOM 372 OE2 GLU A 25 -50.692 -5.418 3.202 1.00 41.23 O ATOM 0 H GLU A 25 -51.699 -3.463 3.187 1.00 12.22 H new ATOM 0 HA GLU A 25 -51.802 -1.618 5.472 1.00 20.11 H new ATOM 0 HB2 GLU A 25 -50.559 -3.170 6.837 1.00 54.25 H new ATOM 0 HB3 GLU A 25 -52.070 -3.904 6.339 1.00 54.25 H new ATOM 0 HG2 GLU A 25 -49.349 -4.507 5.110 1.00 12.23 H new ATOM 0 HG3 GLU A 25 -50.144 -5.488 6.325 1.00 12.23 H new ATOM 379 N MET A 26 -49.087 -1.580 5.269 1.00 14.10 N ATOM 380 CA MET A 26 -47.759 -1.143 4.907 1.00 35.42 C ATOM 381 C MET A 26 -46.769 -2.076 5.565 1.00 35.23 C ATOM 382 O MET A 26 -47.108 -2.737 6.547 1.00 71.23 O ATOM 383 CB MET A 26 -47.491 0.312 5.378 1.00 42.20 C ATOM 384 CG MET A 26 -47.475 0.518 6.905 1.00 30.42 C ATOM 385 SD MET A 26 -49.092 0.280 7.690 1.00 53.00 S ATOM 386 CE MET A 26 -48.655 0.478 9.421 1.00 63.15 C ATOM 0 H MET A 26 -49.261 -1.578 6.274 1.00 14.10 H new ATOM 0 HA MET A 26 -47.658 -1.162 3.822 1.00 35.42 H new ATOM 0 HB2 MET A 26 -46.532 0.636 4.974 1.00 42.20 H new ATOM 0 HB3 MET A 26 -48.254 0.962 4.948 1.00 42.20 H new ATOM 0 HG2 MET A 26 -46.760 -0.175 7.349 1.00 30.42 H new ATOM 0 HG3 MET A 26 -47.120 1.525 7.123 1.00 30.42 H new ATOM 0 HE1 MET A 26 -49.546 0.359 10.037 1.00 63.15 H new ATOM 0 HE2 MET A 26 -47.919 -0.276 9.699 1.00 63.15 H new ATOM 0 HE3 MET A 26 -48.234 1.471 9.579 1.00 63.15 H new ATOM 396 N GLU A 27 -45.583 -2.155 5.043 1.00 71.53 N ATOM 397 CA GLU A 27 -44.569 -2.988 5.642 1.00 41.11 C ATOM 398 C GLU A 27 -43.718 -2.207 6.624 1.00 70.32 C ATOM 399 O GLU A 27 -43.867 -0.992 6.775 1.00 23.34 O ATOM 400 CB GLU A 27 -43.683 -3.637 4.590 1.00 54.41 C ATOM 401 CG GLU A 27 -44.367 -4.710 3.780 1.00 0.34 C ATOM 402 CD GLU A 27 -43.439 -5.323 2.777 1.00 3.21 C ATOM 403 OE1 GLU A 27 -42.306 -5.719 3.145 1.00 52.11 O ATOM 404 OE2 GLU A 27 -43.823 -5.443 1.596 1.00 51.34 O ATOM 0 H GLU A 27 -45.287 -1.656 4.204 1.00 71.53 H new ATOM 0 HA GLU A 27 -45.091 -3.776 6.185 1.00 41.11 H new ATOM 0 HB2 GLU A 27 -43.317 -2.865 3.913 1.00 54.41 H new ATOM 0 HB3 GLU A 27 -42.812 -4.069 5.082 1.00 54.41 H new ATOM 0 HG2 GLU A 27 -44.745 -5.485 4.447 1.00 0.34 H new ATOM 0 HG3 GLU A 27 -45.229 -4.284 3.266 1.00 0.34 H new ATOM 411 N SER A 28 -42.852 -2.915 7.287 1.00 11.22 N ATOM 412 CA SER A 28 -41.925 -2.354 8.219 1.00 41.44 C ATOM 413 C SER A 28 -40.545 -2.404 7.554 1.00 20.33 C ATOM 414 O SER A 28 -40.440 -2.833 6.388 1.00 1.51 O ATOM 415 CB SER A 28 -41.958 -3.198 9.491 1.00 72.22 C ATOM 416 OG SER A 28 -43.302 -3.375 9.918 1.00 72.11 O ATOM 0 H SER A 28 -42.771 -3.927 7.190 1.00 11.22 H new ATOM 0 HA SER A 28 -42.167 -1.325 8.485 1.00 41.44 H new ATOM 0 HB2 SER A 28 -41.495 -4.167 9.307 1.00 72.22 H new ATOM 0 HB3 SER A 28 -41.379 -2.712 10.276 1.00 72.22 H new ATOM 0 HG SER A 28 -43.317 -3.919 10.733 1.00 72.11 H new ATOM 422 N SER A 29 -39.512 -2.003 8.241 1.00 61.53 N ATOM 423 CA SER A 29 -38.211 -2.011 7.652 1.00 21.22 C ATOM 424 C SER A 29 -37.253 -2.787 8.544 1.00 15.51 C ATOM 425 O SER A 29 -37.333 -2.695 9.771 1.00 73.43 O ATOM 426 CB SER A 29 -37.722 -0.571 7.432 1.00 34.44 C ATOM 427 OG SER A 29 -36.542 -0.533 6.634 1.00 73.44 O ATOM 0 H SER A 29 -39.549 -1.669 9.204 1.00 61.53 H new ATOM 0 HA SER A 29 -38.253 -2.503 6.680 1.00 21.22 H new ATOM 0 HB2 SER A 29 -38.507 0.011 6.949 1.00 34.44 H new ATOM 0 HB3 SER A 29 -37.525 -0.102 8.396 1.00 34.44 H new ATOM 0 HG SER A 29 -36.259 0.397 6.512 1.00 73.44 H new ATOM 433 N THR A 30 -36.397 -3.572 7.943 1.00 0.53 N ATOM 434 CA THR A 30 -35.408 -4.315 8.670 1.00 74.23 C ATOM 435 C THR A 30 -34.047 -4.135 7.974 1.00 14.12 C ATOM 436 O THR A 30 -33.936 -4.278 6.740 1.00 50.43 O ATOM 437 CB THR A 30 -35.816 -5.829 8.826 1.00 51.22 C ATOM 438 OG1 THR A 30 -34.886 -6.541 9.660 1.00 64.21 O ATOM 439 CG2 THR A 30 -35.945 -6.538 7.476 1.00 21.33 C ATOM 0 H THR A 30 -36.368 -3.713 6.933 1.00 0.53 H new ATOM 0 HA THR A 30 -35.332 -3.929 9.687 1.00 74.23 H new ATOM 0 HB THR A 30 -36.795 -5.832 9.304 1.00 51.22 H new ATOM 0 HG1 THR A 30 -35.167 -7.476 9.739 1.00 64.21 H new ATOM 0 HG21 THR A 30 -36.228 -7.578 7.637 1.00 21.33 H new ATOM 0 HG22 THR A 30 -36.709 -6.043 6.877 1.00 21.33 H new ATOM 0 HG23 THR A 30 -34.990 -6.498 6.952 1.00 21.33 H new ATOM 447 N GLY A 31 -33.051 -3.751 8.740 1.00 21.30 N ATOM 448 CA GLY A 31 -31.745 -3.502 8.199 1.00 3.44 C ATOM 449 C GLY A 31 -30.704 -4.346 8.871 1.00 13.14 C ATOM 450 O GLY A 31 -30.424 -4.177 10.068 1.00 22.34 O ATOM 0 H GLY A 31 -33.127 -3.605 9.747 1.00 21.30 H new ATOM 0 HA2 GLY A 31 -31.748 -3.708 7.129 1.00 3.44 H new ATOM 0 HA3 GLY A 31 -31.494 -2.448 8.320 1.00 3.44 H new ATOM 454 N THR A 32 -30.129 -5.239 8.117 1.00 31.20 N ATOM 455 CA THR A 32 -29.141 -6.162 8.603 1.00 42.13 C ATOM 456 C THR A 32 -27.827 -5.459 8.995 1.00 62.33 C ATOM 457 O THR A 32 -27.518 -4.350 8.507 1.00 61.33 O ATOM 458 CB THR A 32 -28.901 -7.248 7.540 1.00 12.31 C ATOM 459 OG1 THR A 32 -28.817 -6.623 6.240 1.00 22.51 O ATOM 460 CG2 THR A 32 -30.035 -8.267 7.543 1.00 73.43 C ATOM 0 H THR A 32 -30.338 -5.349 7.125 1.00 31.20 H new ATOM 0 HA THR A 32 -29.519 -6.624 9.515 1.00 42.13 H new ATOM 0 HB THR A 32 -27.971 -7.768 7.769 1.00 12.31 H new ATOM 0 HG1 THR A 32 -28.662 -7.308 5.557 1.00 22.51 H new ATOM 0 HG21 THR A 32 -29.845 -9.026 6.784 1.00 73.43 H new ATOM 0 HG22 THR A 32 -30.095 -8.741 8.523 1.00 73.43 H new ATOM 0 HG23 THR A 32 -30.977 -7.764 7.325 1.00 73.43 H new ATOM 468 N ALA A 33 -27.087 -6.073 9.887 1.00 63.00 N ATOM 469 CA ALA A 33 -25.835 -5.535 10.350 1.00 32.20 C ATOM 470 C ALA A 33 -24.720 -5.911 9.384 1.00 75.30 C ATOM 471 O ALA A 33 -24.620 -7.079 8.976 1.00 53.25 O ATOM 472 CB ALA A 33 -25.520 -6.059 11.745 1.00 33.50 C ATOM 0 H ALA A 33 -27.340 -6.965 10.313 1.00 63.00 H new ATOM 0 HA ALA A 33 -25.913 -4.449 10.395 1.00 32.20 H new ATOM 0 HB1 ALA A 33 -24.570 -5.644 12.084 1.00 33.50 H new ATOM 0 HB2 ALA A 33 -26.312 -5.762 12.433 1.00 33.50 H new ATOM 0 HB3 ALA A 33 -25.452 -7.147 11.718 1.00 33.50 H new ATOM 478 N PRO A 34 -23.892 -4.942 8.958 1.00 13.33 N ATOM 479 CA PRO A 34 -22.765 -5.217 8.099 1.00 11.21 C ATOM 480 C PRO A 34 -21.634 -5.848 8.890 1.00 42.55 C ATOM 481 O PRO A 34 -21.007 -5.201 9.745 1.00 12.12 O ATOM 482 CB PRO A 34 -22.335 -3.845 7.565 1.00 54.32 C ATOM 483 CG PRO A 34 -23.340 -2.870 8.089 1.00 5.20 C ATOM 484 CD PRO A 34 -23.980 -3.517 9.279 1.00 1.24 C ATOM 0 HA PRO A 34 -23.020 -5.913 7.300 1.00 11.21 H new ATOM 0 HB2 PRO A 34 -21.331 -3.591 7.904 1.00 54.32 H new ATOM 0 HB3 PRO A 34 -22.315 -3.838 6.475 1.00 54.32 H new ATOM 0 HG2 PRO A 34 -22.861 -1.932 8.368 1.00 5.20 H new ATOM 0 HG3 PRO A 34 -24.084 -2.634 7.329 1.00 5.20 H new ATOM 0 HD2 PRO A 34 -23.453 -3.277 10.202 1.00 1.24 H new ATOM 0 HD3 PRO A 34 -25.013 -3.194 9.408 1.00 1.24 H new ATOM 492 N ALA A 35 -21.414 -7.101 8.650 1.00 23.41 N ATOM 493 CA ALA A 35 -20.391 -7.834 9.324 1.00 54.34 C ATOM 494 C ALA A 35 -19.203 -8.001 8.402 1.00 12.13 C ATOM 495 O ALA A 35 -19.316 -8.617 7.334 1.00 44.21 O ATOM 496 CB ALA A 35 -20.926 -9.181 9.759 1.00 65.13 C ATOM 0 H ALA A 35 -21.945 -7.650 7.974 1.00 23.41 H new ATOM 0 HA ALA A 35 -20.072 -7.289 10.212 1.00 54.34 H new ATOM 0 HB1 ALA A 35 -20.141 -9.736 10.273 1.00 65.13 H new ATOM 0 HB2 ALA A 35 -21.769 -9.037 10.434 1.00 65.13 H new ATOM 0 HB3 ALA A 35 -21.254 -9.742 8.884 1.00 65.13 H new ATOM 502 N SER A 36 -18.089 -7.447 8.777 1.00 52.14 N ATOM 503 CA SER A 36 -16.916 -7.535 7.968 1.00 65.02 C ATOM 504 C SER A 36 -15.700 -7.804 8.846 1.00 3.23 C ATOM 505 O SER A 36 -15.432 -7.072 9.804 1.00 1.01 O ATOM 506 CB SER A 36 -16.740 -6.241 7.156 1.00 64.35 C ATOM 507 OG SER A 36 -15.705 -6.370 6.184 1.00 64.44 O ATOM 0 H SER A 36 -17.970 -6.926 9.646 1.00 52.14 H new ATOM 0 HA SER A 36 -17.020 -8.363 7.267 1.00 65.02 H new ATOM 0 HB2 SER A 36 -17.678 -5.992 6.659 1.00 64.35 H new ATOM 0 HB3 SER A 36 -16.507 -5.416 7.830 1.00 64.35 H new ATOM 0 HG SER A 36 -15.620 -5.532 5.684 1.00 64.44 H new ATOM 513 N THR A 37 -15.005 -8.849 8.532 1.00 41.51 N ATOM 514 CA THR A 37 -13.827 -9.248 9.228 1.00 33.44 C ATOM 515 C THR A 37 -12.702 -9.439 8.194 1.00 31.15 C ATOM 516 O THR A 37 -12.982 -9.575 7.007 1.00 2.33 O ATOM 517 CB THR A 37 -14.135 -10.565 9.990 1.00 11.15 C ATOM 518 OG1 THR A 37 -15.245 -10.332 10.875 1.00 34.22 O ATOM 519 CG2 THR A 37 -12.954 -11.065 10.808 1.00 4.02 C ATOM 0 H THR A 37 -15.250 -9.468 7.759 1.00 41.51 H new ATOM 0 HA THR A 37 -13.508 -8.498 9.952 1.00 33.44 H new ATOM 0 HB THR A 37 -14.363 -11.330 9.247 1.00 11.15 H new ATOM 0 HG1 THR A 37 -15.453 -11.156 11.363 1.00 34.22 H new ATOM 0 HG21 THR A 37 -13.229 -11.988 11.318 1.00 4.02 H new ATOM 0 HG22 THR A 37 -12.108 -11.254 10.147 1.00 4.02 H new ATOM 0 HG23 THR A 37 -12.677 -10.312 11.546 1.00 4.02 H new ATOM 527 N GLY A 38 -11.461 -9.378 8.609 1.00 53.14 N ATOM 528 CA GLY A 38 -10.382 -9.611 7.681 1.00 22.23 C ATOM 529 C GLY A 38 -10.153 -11.088 7.479 1.00 21.11 C ATOM 530 O GLY A 38 -10.129 -11.582 6.363 1.00 31.34 O ATOM 0 H GLY A 38 -11.175 -9.173 9.566 1.00 53.14 H new ATOM 0 HA2 GLY A 38 -10.612 -9.141 6.725 1.00 22.23 H new ATOM 0 HA3 GLY A 38 -9.470 -9.145 8.054 1.00 22.23 H new ATOM 534 N ALA A 39 -10.074 -11.796 8.584 1.00 0.41 N ATOM 535 CA ALA A 39 -9.816 -13.239 8.630 1.00 44.22 C ATOM 536 C ALA A 39 -10.818 -14.077 7.815 1.00 75.55 C ATOM 537 O ALA A 39 -10.522 -15.209 7.448 1.00 33.43 O ATOM 538 CB ALA A 39 -9.784 -13.711 10.072 1.00 2.34 C ATOM 0 H ALA A 39 -10.189 -11.382 9.509 1.00 0.41 H new ATOM 0 HA ALA A 39 -8.845 -13.394 8.160 1.00 44.22 H new ATOM 0 HB1 ALA A 39 -9.592 -14.784 10.100 1.00 2.34 H new ATOM 0 HB2 ALA A 39 -8.993 -13.187 10.609 1.00 2.34 H new ATOM 0 HB3 ALA A 39 -10.744 -13.502 10.545 1.00 2.34 H new ATOM 544 N GLU A 40 -11.977 -13.508 7.520 1.00 4.35 N ATOM 545 CA GLU A 40 -13.040 -14.222 6.839 1.00 64.34 C ATOM 546 C GLU A 40 -12.665 -14.614 5.402 1.00 33.34 C ATOM 547 O GLU A 40 -13.151 -15.619 4.899 1.00 60.32 O ATOM 548 CB GLU A 40 -14.359 -13.436 6.849 1.00 14.23 C ATOM 549 CG GLU A 40 -14.339 -12.149 6.055 1.00 43.30 C ATOM 550 CD GLU A 40 -15.698 -11.513 5.965 1.00 4.20 C ATOM 551 OE1 GLU A 40 -16.514 -11.959 5.149 1.00 4.21 O ATOM 552 OE2 GLU A 40 -15.978 -10.551 6.697 1.00 41.31 O ATOM 0 H GLU A 40 -12.204 -12.540 7.747 1.00 4.35 H new ATOM 0 HA GLU A 40 -13.185 -15.143 7.404 1.00 64.34 H new ATOM 0 HB2 GLU A 40 -15.149 -14.076 6.457 1.00 14.23 H new ATOM 0 HB3 GLU A 40 -14.620 -13.205 7.882 1.00 14.23 H new ATOM 0 HG2 GLU A 40 -13.643 -11.450 6.518 1.00 43.30 H new ATOM 0 HG3 GLU A 40 -13.967 -12.350 5.050 1.00 43.30 H new ATOM 559 N ASN A 41 -11.799 -13.835 4.732 1.00 74.34 N ATOM 560 CA ASN A 41 -11.425 -14.197 3.354 1.00 21.32 C ATOM 561 C ASN A 41 -10.327 -15.226 3.372 1.00 74.13 C ATOM 562 O ASN A 41 -10.070 -15.888 2.363 1.00 60.22 O ATOM 563 CB ASN A 41 -10.984 -12.998 2.484 1.00 3.24 C ATOM 564 CG ASN A 41 -9.592 -12.438 2.795 1.00 43.24 C ATOM 565 OD1 ASN A 41 -9.438 -11.535 3.594 1.00 61.02 O ATOM 566 ND2 ASN A 41 -8.578 -12.961 2.140 1.00 52.45 N ATOM 0 H ASN A 41 -11.362 -12.990 5.099 1.00 74.34 H new ATOM 0 HA ASN A 41 -12.329 -14.598 2.897 1.00 21.32 H new ATOM 0 HB2 ASN A 41 -11.010 -13.301 1.437 1.00 3.24 H new ATOM 0 HB3 ASN A 41 -11.714 -12.197 2.602 1.00 3.24 H new ATOM 0 HD21 ASN A 41 -7.634 -12.609 2.297 1.00 52.45 H new ATOM 0 HD22 ASN A 41 -8.736 -13.718 1.475 1.00 52.45 H new ATOM 573 N LEU A 42 -9.702 -15.333 4.534 1.00 74.33 N ATOM 574 CA LEU A 42 -8.596 -16.230 4.823 1.00 34.22 C ATOM 575 C LEU A 42 -7.292 -15.691 4.203 1.00 54.32 C ATOM 576 O LEU A 42 -7.110 -15.704 2.976 1.00 51.35 O ATOM 577 CB LEU A 42 -8.962 -17.697 4.433 1.00 20.34 C ATOM 578 CG LEU A 42 -7.967 -18.866 4.720 1.00 1.33 C ATOM 579 CD1 LEU A 42 -6.763 -18.869 3.786 1.00 71.42 C ATOM 580 CD2 LEU A 42 -7.513 -18.852 6.172 1.00 64.20 C ATOM 0 H LEU A 42 -9.966 -14.768 5.341 1.00 74.33 H new ATOM 0 HA LEU A 42 -8.408 -16.265 5.896 1.00 34.22 H new ATOM 0 HB2 LEU A 42 -9.897 -17.940 4.937 1.00 20.34 H new ATOM 0 HB3 LEU A 42 -9.166 -17.704 3.362 1.00 20.34 H new ATOM 0 HG LEU A 42 -8.517 -19.787 4.528 1.00 1.33 H new ATOM 0 HD11 LEU A 42 -6.110 -19.705 4.037 1.00 71.42 H new ATOM 0 HD12 LEU A 42 -7.102 -18.970 2.755 1.00 71.42 H new ATOM 0 HD13 LEU A 42 -6.214 -17.934 3.897 1.00 71.42 H new ATOM 0 HD21 LEU A 42 -6.821 -19.676 6.345 1.00 64.20 H new ATOM 0 HD22 LEU A 42 -7.014 -17.908 6.388 1.00 64.20 H new ATOM 0 HD23 LEU A 42 -8.379 -18.962 6.825 1.00 64.20 H new ATOM 592 N PRO A 43 -6.409 -15.138 5.055 1.00 73.02 N ATOM 593 CA PRO A 43 -5.135 -14.572 4.617 1.00 13.33 C ATOM 594 C PRO A 43 -4.059 -15.645 4.378 1.00 4.01 C ATOM 595 O PRO A 43 -4.248 -16.822 4.704 1.00 62.43 O ATOM 596 CB PRO A 43 -4.744 -13.669 5.785 1.00 73.05 C ATOM 597 CG PRO A 43 -5.336 -14.321 6.984 1.00 51.32 C ATOM 598 CD PRO A 43 -6.591 -15.012 6.521 1.00 53.32 C ATOM 0 HA PRO A 43 -5.223 -14.054 3.662 1.00 13.33 H new ATOM 0 HB2 PRO A 43 -3.661 -13.585 5.875 1.00 73.05 H new ATOM 0 HB3 PRO A 43 -5.132 -12.659 5.652 1.00 73.05 H new ATOM 0 HG2 PRO A 43 -4.638 -15.036 7.421 1.00 51.32 H new ATOM 0 HG3 PRO A 43 -5.561 -13.584 7.755 1.00 51.32 H new ATOM 0 HD2 PRO A 43 -6.708 -15.987 6.994 1.00 53.32 H new ATOM 0 HD3 PRO A 43 -7.480 -14.431 6.765 1.00 53.32 H new ATOM 606 N ALA A 44 -2.926 -15.227 3.845 1.00 44.24 N ATOM 607 CA ALA A 44 -1.839 -16.131 3.519 1.00 75.25 C ATOM 608 C ALA A 44 -0.505 -15.483 3.876 1.00 61.34 C ATOM 609 O ALA A 44 -0.475 -14.457 4.575 1.00 64.12 O ATOM 610 CB ALA A 44 -1.881 -16.477 2.036 1.00 10.04 C ATOM 0 H ALA A 44 -2.733 -14.250 3.626 1.00 44.24 H new ATOM 0 HA ALA A 44 -1.948 -17.050 4.095 1.00 75.25 H new ATOM 0 HB1 ALA A 44 -1.062 -17.156 1.797 1.00 10.04 H new ATOM 0 HB2 ALA A 44 -2.831 -16.957 1.801 1.00 10.04 H new ATOM 0 HB3 ALA A 44 -1.780 -15.566 1.447 1.00 10.04 H new ATOM 616 N GLY A 45 0.589 -16.069 3.407 1.00 1.34 N ATOM 617 CA GLY A 45 1.914 -15.531 3.678 1.00 71.22 C ATOM 618 C GLY A 45 2.259 -14.411 2.729 1.00 71.41 C ATOM 619 O GLY A 45 3.238 -13.686 2.919 1.00 53.53 O ATOM 0 H GLY A 45 0.584 -16.916 2.838 1.00 1.34 H new ATOM 0 HA2 GLY A 45 1.957 -15.166 4.704 1.00 71.22 H new ATOM 0 HA3 GLY A 45 2.655 -16.325 3.591 1.00 71.22 H new ATOM 623 N SER A 46 1.464 -14.288 1.701 1.00 10.13 N ATOM 624 CA SER A 46 1.613 -13.249 0.739 1.00 5.22 C ATOM 625 C SER A 46 0.433 -12.312 0.851 1.00 62.12 C ATOM 626 O SER A 46 -0.666 -12.717 1.280 1.00 3.44 O ATOM 627 CB SER A 46 1.665 -13.830 -0.658 1.00 34.11 C ATOM 628 OG SER A 46 2.635 -14.863 -0.747 1.00 75.14 O ATOM 0 H SER A 46 0.686 -14.920 1.512 1.00 10.13 H new ATOM 0 HA SER A 46 2.542 -12.711 0.928 1.00 5.22 H new ATOM 0 HB2 SER A 46 0.685 -14.223 -0.928 1.00 34.11 H new ATOM 0 HB3 SER A 46 1.901 -13.043 -1.374 1.00 34.11 H new ATOM 0 HG SER A 46 3.317 -14.616 -1.406 1.00 75.14 H new ATOM 634 N ALA A 47 0.644 -11.100 0.466 1.00 51.10 N ATOM 635 CA ALA A 47 -0.352 -10.085 0.545 1.00 31.15 C ATOM 636 C ALA A 47 -0.074 -9.054 -0.507 1.00 51.02 C ATOM 637 O ALA A 47 1.094 -8.794 -0.829 1.00 44.14 O ATOM 638 CB ALA A 47 -0.334 -9.455 1.914 1.00 43.55 C ATOM 0 H ALA A 47 1.532 -10.780 0.079 1.00 51.10 H new ATOM 0 HA ALA A 47 -1.339 -10.518 0.379 1.00 31.15 H new ATOM 0 HB1 ALA A 47 -1.098 -8.680 1.968 1.00 43.55 H new ATOM 0 HB2 ALA A 47 -0.536 -10.216 2.668 1.00 43.55 H new ATOM 0 HB3 ALA A 47 0.645 -9.013 2.098 1.00 43.55 H new ATOM 644 N LEU A 48 -1.107 -8.480 -1.042 1.00 15.22 N ATOM 645 CA LEU A 48 -0.973 -7.491 -2.078 1.00 0.32 C ATOM 646 C LEU A 48 -1.792 -6.281 -1.725 1.00 3.13 C ATOM 647 O LEU A 48 -2.701 -6.357 -0.892 1.00 72.12 O ATOM 648 CB LEU A 48 -1.367 -8.024 -3.488 1.00 52.35 C ATOM 649 CG LEU A 48 -2.856 -8.350 -3.767 1.00 33.11 C ATOM 650 CD1 LEU A 48 -3.055 -8.629 -5.245 1.00 41.43 C ATOM 651 CD2 LEU A 48 -3.333 -9.552 -2.966 1.00 0.12 C ATOM 0 H LEU A 48 -2.071 -8.681 -0.775 1.00 15.22 H new ATOM 0 HA LEU A 48 0.082 -7.225 -2.137 1.00 0.32 H new ATOM 0 HB2 LEU A 48 -1.046 -7.286 -4.223 1.00 52.35 H new ATOM 0 HB3 LEU A 48 -0.789 -8.930 -3.673 1.00 52.35 H new ATOM 0 HG LEU A 48 -3.442 -7.483 -3.463 1.00 33.11 H new ATOM 0 HD11 LEU A 48 -4.104 -8.857 -5.434 1.00 41.43 H new ATOM 0 HD12 LEU A 48 -2.765 -7.752 -5.823 1.00 41.43 H new ATOM 0 HD13 LEU A 48 -2.440 -9.479 -5.541 1.00 41.43 H new ATOM 0 HD21 LEU A 48 -4.382 -9.746 -3.191 1.00 0.12 H new ATOM 0 HD22 LEU A 48 -2.737 -10.425 -3.231 1.00 0.12 H new ATOM 0 HD23 LEU A 48 -3.222 -9.347 -1.901 1.00 0.12 H new ATOM 663 N LEU A 49 -1.479 -5.186 -2.322 1.00 24.33 N ATOM 664 CA LEU A 49 -2.192 -3.985 -2.060 1.00 64.43 C ATOM 665 C LEU A 49 -2.538 -3.282 -3.344 1.00 52.32 C ATOM 666 O LEU A 49 -1.813 -3.400 -4.350 1.00 53.33 O ATOM 667 CB LEU A 49 -1.427 -3.096 -1.049 1.00 54.34 C ATOM 668 CG LEU A 49 0.040 -2.733 -1.361 1.00 44.53 C ATOM 669 CD1 LEU A 49 0.155 -1.682 -2.452 1.00 51.03 C ATOM 670 CD2 LEU A 49 0.761 -2.287 -0.097 1.00 11.22 C ATOM 0 H LEU A 49 -0.725 -5.096 -3.003 1.00 24.33 H new ATOM 0 HA LEU A 49 -3.141 -4.228 -1.583 1.00 64.43 H new ATOM 0 HB2 LEU A 49 -1.983 -2.166 -0.936 1.00 54.34 H new ATOM 0 HB3 LEU A 49 -1.447 -3.599 -0.082 1.00 54.34 H new ATOM 0 HG LEU A 49 0.522 -3.634 -1.739 1.00 44.53 H new ATOM 0 HD11 LEU A 49 1.207 -1.461 -2.635 1.00 51.03 H new ATOM 0 HD12 LEU A 49 -0.302 -2.057 -3.368 1.00 51.03 H new ATOM 0 HD13 LEU A 49 -0.357 -0.773 -2.137 1.00 51.03 H new ATOM 0 HD21 LEU A 49 1.794 -2.035 -0.337 1.00 11.22 H new ATOM 0 HD22 LEU A 49 0.261 -1.412 0.317 1.00 11.22 H new ATOM 0 HD23 LEU A 49 0.745 -3.094 0.635 1.00 11.22 H new ATOM 682 N VAL A 50 -3.652 -2.613 -3.337 1.00 42.43 N ATOM 683 CA VAL A 50 -4.112 -1.890 -4.485 1.00 53.22 C ATOM 684 C VAL A 50 -4.173 -0.402 -4.143 1.00 14.35 C ATOM 685 O VAL A 50 -4.699 -0.015 -3.089 1.00 21.41 O ATOM 686 CB VAL A 50 -5.517 -2.407 -5.000 1.00 20.14 C ATOM 687 CG1 VAL A 50 -5.460 -3.883 -5.358 1.00 3.53 C ATOM 688 CG2 VAL A 50 -6.622 -2.187 -3.980 1.00 43.02 C ATOM 0 H VAL A 50 -4.272 -2.553 -2.529 1.00 42.43 H new ATOM 0 HA VAL A 50 -3.407 -2.056 -5.299 1.00 53.22 H new ATOM 0 HB VAL A 50 -5.749 -1.822 -5.890 1.00 20.14 H new ATOM 0 HG11 VAL A 50 -6.439 -4.210 -5.708 1.00 3.53 H new ATOM 0 HG12 VAL A 50 -4.722 -4.038 -6.145 1.00 3.53 H new ATOM 0 HG13 VAL A 50 -5.178 -4.460 -4.477 1.00 3.53 H new ATOM 0 HG21 VAL A 50 -7.566 -2.558 -4.380 1.00 43.02 H new ATOM 0 HG22 VAL A 50 -6.381 -2.723 -3.062 1.00 43.02 H new ATOM 0 HG23 VAL A 50 -6.713 -1.122 -3.766 1.00 43.02 H new ATOM 698 N VAL A 51 -3.584 0.417 -4.972 1.00 43.23 N ATOM 699 CA VAL A 51 -3.648 1.846 -4.763 1.00 33.34 C ATOM 700 C VAL A 51 -4.754 2.393 -5.644 1.00 31.12 C ATOM 701 O VAL A 51 -4.721 2.242 -6.871 1.00 45.13 O ATOM 702 CB VAL A 51 -2.298 2.556 -5.054 1.00 13.52 C ATOM 703 CG1 VAL A 51 -2.393 4.041 -4.711 1.00 22.12 C ATOM 704 CG2 VAL A 51 -1.175 1.904 -4.257 1.00 2.12 C ATOM 0 H VAL A 51 -3.056 0.126 -5.795 1.00 43.23 H new ATOM 0 HA VAL A 51 -3.860 2.042 -3.712 1.00 33.34 H new ATOM 0 HB VAL A 51 -2.077 2.457 -6.117 1.00 13.52 H new ATOM 0 HG11 VAL A 51 -1.439 4.525 -4.920 1.00 22.12 H new ATOM 0 HG12 VAL A 51 -3.175 4.504 -5.313 1.00 22.12 H new ATOM 0 HG13 VAL A 51 -2.634 4.156 -3.654 1.00 22.12 H new ATOM 0 HG21 VAL A 51 -0.235 2.412 -4.471 1.00 2.12 H new ATOM 0 HG22 VAL A 51 -1.394 1.979 -3.192 1.00 2.12 H new ATOM 0 HG23 VAL A 51 -1.092 0.854 -4.537 1.00 2.12 H new ATOM 714 N LYS A 52 -5.745 2.981 -5.018 1.00 31.34 N ATOM 715 CA LYS A 52 -6.941 3.419 -5.718 1.00 34.42 C ATOM 716 C LYS A 52 -7.056 4.937 -5.789 1.00 71.32 C ATOM 717 O LYS A 52 -7.883 5.484 -6.539 1.00 4.22 O ATOM 718 CB LYS A 52 -8.152 2.817 -5.039 1.00 24.15 C ATOM 719 CG LYS A 52 -8.188 1.293 -5.109 1.00 53.13 C ATOM 720 CD LYS A 52 -9.331 0.704 -4.302 1.00 74.34 C ATOM 721 CE LYS A 52 -10.680 1.156 -4.817 1.00 24.54 C ATOM 722 NZ LYS A 52 -11.790 0.572 -4.042 1.00 43.52 N ATOM 0 H LYS A 52 -5.751 3.171 -4.016 1.00 31.34 H new ATOM 0 HA LYS A 52 -6.879 3.072 -6.750 1.00 34.42 H new ATOM 0 HB2 LYS A 52 -8.165 3.126 -3.994 1.00 24.15 H new ATOM 0 HB3 LYS A 52 -9.055 3.216 -5.501 1.00 24.15 H new ATOM 0 HG2 LYS A 52 -8.283 0.982 -6.149 1.00 53.13 H new ATOM 0 HG3 LYS A 52 -7.243 0.893 -4.742 1.00 53.13 H new ATOM 0 HD2 LYS A 52 -9.276 -0.384 -4.336 1.00 74.34 H new ATOM 0 HD3 LYS A 52 -9.225 0.996 -3.257 1.00 74.34 H new ATOM 0 HE2 LYS A 52 -10.739 2.243 -4.773 1.00 24.54 H new ATOM 0 HE3 LYS A 52 -10.781 0.874 -5.865 1.00 24.54 H new ATOM 0 HZ1 LYS A 52 -12.696 0.907 -4.427 1.00 43.52 H new ATOM 0 HZ2 LYS A 52 -11.749 -0.465 -4.105 1.00 43.52 H new ATOM 0 HZ3 LYS A 52 -11.709 0.862 -3.047 1.00 43.52 H new ATOM 736 N ARG A 53 -6.262 5.603 -5.010 1.00 20.44 N ATOM 737 CA ARG A 53 -6.200 7.053 -5.020 1.00 53.22 C ATOM 738 C ARG A 53 -4.804 7.485 -4.634 1.00 13.22 C ATOM 739 O ARG A 53 -4.294 7.050 -3.605 1.00 34.21 O ATOM 740 CB ARG A 53 -7.215 7.659 -4.026 1.00 71.13 C ATOM 741 CG ARG A 53 -7.213 9.193 -3.969 1.00 1.30 C ATOM 742 CD ARG A 53 -7.761 9.829 -5.247 1.00 63.11 C ATOM 743 NE ARG A 53 -9.199 9.560 -5.427 1.00 52.20 N ATOM 744 CZ ARG A 53 -10.022 10.227 -6.262 1.00 70.13 C ATOM 745 NH1 ARG A 53 -9.553 11.177 -7.074 1.00 11.43 N ATOM 746 NH2 ARG A 53 -11.314 9.932 -6.276 1.00 62.02 N ATOM 0 H ARG A 53 -5.630 5.164 -4.341 1.00 20.44 H new ATOM 0 HA ARG A 53 -6.447 7.407 -6.021 1.00 53.22 H new ATOM 0 HB2 ARG A 53 -8.215 7.319 -4.295 1.00 71.13 H new ATOM 0 HB3 ARG A 53 -7.004 7.271 -3.029 1.00 71.13 H new ATOM 0 HG2 ARG A 53 -7.810 9.522 -3.119 1.00 1.30 H new ATOM 0 HG3 ARG A 53 -6.196 9.545 -3.799 1.00 1.30 H new ATOM 0 HD2 ARG A 53 -7.595 10.906 -5.216 1.00 63.11 H new ATOM 0 HD3 ARG A 53 -7.211 9.447 -6.107 1.00 63.11 H new ATOM 0 HE ARG A 53 -9.606 8.806 -4.874 1.00 52.20 H new ATOM 0 HH11 ARG A 53 -8.559 11.408 -7.069 1.00 11.43 H new ATOM 0 HH12 ARG A 53 -10.188 11.672 -7.700 1.00 11.43 H new ATOM 0 HH21 ARG A 53 -11.678 9.206 -5.659 1.00 62.02 H new ATOM 0 HH22 ARG A 53 -11.944 10.431 -6.904 1.00 62.02 H new ATOM 760 N GLY A 54 -4.185 8.295 -5.459 1.00 11.00 N ATOM 761 CA GLY A 54 -2.888 8.814 -5.140 1.00 54.54 C ATOM 762 C GLY A 54 -1.969 8.855 -6.343 1.00 32.33 C ATOM 763 O GLY A 54 -1.957 7.931 -7.118 1.00 43.50 O ATOM 0 H GLY A 54 -4.563 8.606 -6.354 1.00 11.00 H new ATOM 0 HA2 GLY A 54 -2.993 9.819 -4.732 1.00 54.54 H new ATOM 0 HA3 GLY A 54 -2.435 8.200 -4.362 1.00 54.54 H new ATOM 767 N PRO A 55 -1.216 9.955 -6.558 1.00 42.35 N ATOM 768 CA PRO A 55 -0.199 10.044 -7.635 1.00 0.10 C ATOM 769 C PRO A 55 1.006 9.115 -7.401 1.00 75.43 C ATOM 770 O PRO A 55 1.876 8.984 -8.259 1.00 2.34 O ATOM 771 CB PRO A 55 0.260 11.503 -7.577 1.00 2.40 C ATOM 772 CG PRO A 55 -0.823 12.211 -6.856 1.00 34.21 C ATOM 773 CD PRO A 55 -1.342 11.232 -5.853 1.00 74.13 C ATOM 0 HA PRO A 55 -0.616 9.740 -8.595 1.00 0.10 H new ATOM 0 HB2 PRO A 55 1.212 11.598 -7.054 1.00 2.40 H new ATOM 0 HB3 PRO A 55 0.404 11.913 -8.577 1.00 2.40 H new ATOM 0 HG2 PRO A 55 -0.447 13.110 -6.368 1.00 34.21 H new ATOM 0 HG3 PRO A 55 -1.610 12.525 -7.541 1.00 34.21 H new ATOM 0 HD2 PRO A 55 -0.758 11.246 -4.933 1.00 74.13 H new ATOM 0 HD3 PRO A 55 -2.375 11.443 -5.578 1.00 74.13 H new ATOM 781 N ASN A 56 1.062 8.518 -6.225 1.00 25.32 N ATOM 782 CA ASN A 56 2.135 7.602 -5.856 1.00 14.41 C ATOM 783 C ASN A 56 2.086 6.338 -6.717 1.00 73.54 C ATOM 784 O ASN A 56 3.120 5.842 -7.165 1.00 3.32 O ATOM 785 CB ASN A 56 2.081 7.234 -4.344 1.00 32.42 C ATOM 786 CG ASN A 56 0.799 6.529 -3.893 1.00 25.11 C ATOM 787 OD1 ASN A 56 -0.274 6.754 -4.427 1.00 31.13 O ATOM 788 ND2 ASN A 56 0.910 5.688 -2.896 1.00 41.21 N ATOM 0 H ASN A 56 0.364 8.653 -5.493 1.00 25.32 H new ATOM 0 HA ASN A 56 3.080 8.113 -6.039 1.00 14.41 H new ATOM 0 HB2 ASN A 56 2.931 6.593 -4.111 1.00 32.42 H new ATOM 0 HB3 ASN A 56 2.201 8.146 -3.759 1.00 32.42 H new ATOM 0 HD21 ASN A 56 0.085 5.200 -2.546 1.00 41.21 H new ATOM 0 HD22 ASN A 56 1.821 5.520 -2.469 1.00 41.21 H new ATOM 795 N ALA A 57 0.881 5.846 -6.973 1.00 31.22 N ATOM 796 CA ALA A 57 0.671 4.663 -7.779 1.00 43.14 C ATOM 797 C ALA A 57 -0.805 4.528 -8.093 1.00 63.31 C ATOM 798 O ALA A 57 -1.620 5.274 -7.581 1.00 24.43 O ATOM 799 CB ALA A 57 1.166 3.409 -7.053 1.00 62.14 C ATOM 0 H ALA A 57 0.019 6.264 -6.622 1.00 31.22 H new ATOM 0 HA ALA A 57 1.239 4.764 -8.704 1.00 43.14 H new ATOM 0 HB1 ALA A 57 0.996 2.534 -7.681 1.00 62.14 H new ATOM 0 HB2 ALA A 57 2.232 3.505 -6.846 1.00 62.14 H new ATOM 0 HB3 ALA A 57 0.623 3.293 -6.115 1.00 62.14 H new ATOM 805 N GLY A 58 -1.137 3.583 -8.919 1.00 44.20 N ATOM 806 CA GLY A 58 -2.513 3.343 -9.272 1.00 30.33 C ATOM 807 C GLY A 58 -2.637 1.971 -9.831 1.00 22.33 C ATOM 808 O GLY A 58 -3.293 1.746 -10.836 1.00 10.24 O ATOM 0 H GLY A 58 -0.469 2.956 -9.368 1.00 44.20 H new ATOM 0 HA2 GLY A 58 -3.151 3.451 -8.395 1.00 30.33 H new ATOM 0 HA3 GLY A 58 -2.848 4.079 -10.003 1.00 30.33 H new ATOM 812 N ALA A 59 -1.985 1.051 -9.180 1.00 24.22 N ATOM 813 CA ALA A 59 -1.904 -0.304 -9.640 1.00 35.12 C ATOM 814 C ALA A 59 -1.850 -1.219 -8.443 1.00 0.22 C ATOM 815 O ALA A 59 -2.000 -0.755 -7.296 1.00 53.41 O ATOM 816 CB ALA A 59 -0.655 -0.474 -10.493 1.00 70.33 C ATOM 0 H ALA A 59 -1.489 1.223 -8.305 1.00 24.22 H new ATOM 0 HA ALA A 59 -2.776 -0.551 -10.245 1.00 35.12 H new ATOM 0 HB1 ALA A 59 -0.591 -1.504 -10.844 1.00 70.33 H new ATOM 0 HB2 ALA A 59 -0.705 0.199 -11.349 1.00 70.33 H new ATOM 0 HB3 ALA A 59 0.227 -0.239 -9.898 1.00 70.33 H new ATOM 822 N ARG A 60 -1.635 -2.485 -8.691 1.00 73.41 N ATOM 823 CA ARG A 60 -1.545 -3.458 -7.641 1.00 34.54 C ATOM 824 C ARG A 60 -0.212 -4.155 -7.694 1.00 3.53 C ATOM 825 O ARG A 60 0.319 -4.410 -8.781 1.00 13.04 O ATOM 826 CB ARG A 60 -2.688 -4.484 -7.732 1.00 62.42 C ATOM 827 CG ARG A 60 -2.789 -5.237 -9.054 1.00 22.33 C ATOM 828 CD ARG A 60 -3.822 -6.345 -8.973 1.00 54.03 C ATOM 829 NE ARG A 60 -4.122 -6.933 -10.288 1.00 55.44 N ATOM 830 CZ ARG A 60 -4.024 -8.237 -10.598 1.00 25.30 C ATOM 831 NH1 ARG A 60 -3.372 -9.083 -9.794 1.00 0.03 N ATOM 832 NH2 ARG A 60 -4.543 -8.677 -11.738 1.00 31.44 N ATOM 0 H ARG A 60 -1.518 -2.868 -9.629 1.00 73.41 H new ATOM 0 HA ARG A 60 -1.637 -2.937 -6.688 1.00 34.54 H new ATOM 0 HB2 ARG A 60 -2.566 -5.210 -6.928 1.00 62.42 H new ATOM 0 HB3 ARG A 60 -3.631 -3.968 -7.555 1.00 62.42 H new ATOM 0 HG2 ARG A 60 -3.056 -4.544 -9.852 1.00 22.33 H new ATOM 0 HG3 ARG A 60 -1.817 -5.659 -9.311 1.00 22.33 H new ATOM 0 HD2 ARG A 60 -3.461 -7.126 -8.303 1.00 54.03 H new ATOM 0 HD3 ARG A 60 -4.740 -5.950 -8.537 1.00 54.03 H new ATOM 0 HE ARG A 60 -4.430 -6.299 -11.025 1.00 55.44 H new ATOM 0 HH11 ARG A 60 -2.942 -8.741 -8.935 1.00 0.03 H new ATOM 0 HH12 ARG A 60 -3.304 -10.071 -10.040 1.00 0.03 H new ATOM 0 HH21 ARG A 60 -5.011 -8.027 -12.370 1.00 31.44 H new ATOM 0 HH22 ARG A 60 -4.474 -9.665 -11.982 1.00 31.44 H new ATOM 846 N PHE A 61 0.342 -4.422 -6.549 1.00 11.33 N ATOM 847 CA PHE A 61 1.570 -5.166 -6.449 1.00 1.21 C ATOM 848 C PHE A 61 1.573 -5.937 -5.157 1.00 53.05 C ATOM 849 O PHE A 61 0.906 -5.535 -4.182 1.00 4.31 O ATOM 850 CB PHE A 61 2.837 -4.276 -6.609 1.00 31.33 C ATOM 851 CG PHE A 61 3.009 -3.156 -5.611 1.00 74.10 C ATOM 852 CD1 PHE A 61 3.693 -3.368 -4.419 1.00 42.22 C ATOM 853 CD2 PHE A 61 2.513 -1.887 -5.876 1.00 21.14 C ATOM 854 CE1 PHE A 61 3.878 -2.340 -3.518 1.00 51.42 C ATOM 855 CE2 PHE A 61 2.693 -0.854 -4.975 1.00 12.15 C ATOM 856 CZ PHE A 61 3.375 -1.083 -3.794 1.00 3.42 C ATOM 0 H PHE A 61 -0.044 -4.130 -5.651 1.00 11.33 H new ATOM 0 HA PHE A 61 1.615 -5.866 -7.283 1.00 1.21 H new ATOM 0 HB2 PHE A 61 3.715 -4.920 -6.552 1.00 31.33 H new ATOM 0 HB3 PHE A 61 2.824 -3.842 -7.609 1.00 31.33 H new ATOM 0 HD1 PHE A 61 4.084 -4.350 -4.196 1.00 42.22 H new ATOM 0 HD2 PHE A 61 1.980 -1.704 -6.797 1.00 21.14 H new ATOM 0 HE1 PHE A 61 4.415 -2.517 -2.598 1.00 51.42 H new ATOM 0 HE2 PHE A 61 2.302 0.129 -5.193 1.00 12.15 H new ATOM 0 HZ PHE A 61 3.515 -0.279 -3.087 1.00 3.42 H new ATOM 866 N LEU A 62 2.274 -7.030 -5.147 1.00 52.43 N ATOM 867 CA LEU A 62 2.318 -7.898 -4.008 1.00 62.31 C ATOM 868 C LEU A 62 3.589 -7.635 -3.214 1.00 2.55 C ATOM 869 O LEU A 62 4.647 -7.346 -3.790 1.00 32.55 O ATOM 870 CB LEU A 62 2.150 -9.366 -4.462 1.00 63.23 C ATOM 871 CG LEU A 62 1.953 -10.439 -3.371 1.00 10.35 C ATOM 872 CD1 LEU A 62 1.234 -11.625 -3.961 1.00 20.13 C ATOM 873 CD2 LEU A 62 3.285 -10.903 -2.807 1.00 31.32 C ATOM 0 H LEU A 62 2.837 -7.348 -5.936 1.00 52.43 H new ATOM 0 HA LEU A 62 1.488 -7.694 -3.332 1.00 62.31 H new ATOM 0 HB2 LEU A 62 1.294 -9.412 -5.135 1.00 63.23 H new ATOM 0 HB3 LEU A 62 3.030 -9.639 -5.045 1.00 63.23 H new ATOM 0 HG LEU A 62 1.368 -9.999 -2.564 1.00 10.35 H new ATOM 0 HD11 LEU A 62 1.094 -12.385 -3.192 1.00 20.13 H new ATOM 0 HD12 LEU A 62 0.262 -11.309 -4.341 1.00 20.13 H new ATOM 0 HD13 LEU A 62 1.825 -12.040 -4.777 1.00 20.13 H new ATOM 0 HD21 LEU A 62 3.112 -11.659 -2.041 1.00 31.32 H new ATOM 0 HD22 LEU A 62 3.890 -11.329 -3.607 1.00 31.32 H new ATOM 0 HD23 LEU A 62 3.810 -10.054 -2.368 1.00 31.32 H new ATOM 885 N LEU A 63 3.467 -7.661 -1.905 1.00 1.23 N ATOM 886 CA LEU A 63 4.572 -7.355 -1.035 1.00 14.45 C ATOM 887 C LEU A 63 5.487 -8.560 -0.873 1.00 30.02 C ATOM 888 O LEU A 63 5.097 -9.595 -0.305 1.00 22.54 O ATOM 889 CB LEU A 63 4.059 -6.918 0.344 1.00 30.23 C ATOM 890 CG LEU A 63 3.108 -5.713 0.382 1.00 62.40 C ATOM 891 CD1 LEU A 63 2.658 -5.443 1.809 1.00 41.31 C ATOM 892 CD2 LEU A 63 3.777 -4.478 -0.195 1.00 24.54 C ATOM 0 H LEU A 63 2.601 -7.894 -1.419 1.00 1.23 H new ATOM 0 HA LEU A 63 5.138 -6.541 -1.488 1.00 14.45 H new ATOM 0 HB2 LEU A 63 3.550 -7.767 0.801 1.00 30.23 H new ATOM 0 HB3 LEU A 63 4.922 -6.689 0.970 1.00 30.23 H new ATOM 0 HG LEU A 63 2.236 -5.948 -0.228 1.00 62.40 H new ATOM 0 HD11 LEU A 63 1.984 -4.586 1.822 1.00 41.31 H new ATOM 0 HD12 LEU A 63 2.139 -6.319 2.199 1.00 41.31 H new ATOM 0 HD13 LEU A 63 3.528 -5.230 2.431 1.00 41.31 H new ATOM 0 HD21 LEU A 63 3.084 -3.638 -0.157 1.00 24.54 H new ATOM 0 HD22 LEU A 63 4.667 -4.241 0.388 1.00 24.54 H new ATOM 0 HD23 LEU A 63 4.061 -4.668 -1.230 1.00 24.54 H new ATOM 904 N ASP A 64 6.687 -8.418 -1.368 1.00 63.10 N ATOM 905 CA ASP A 64 7.731 -9.426 -1.205 1.00 1.11 C ATOM 906 C ASP A 64 8.904 -8.782 -0.531 1.00 63.35 C ATOM 907 O ASP A 64 9.596 -9.404 0.279 1.00 21.32 O ATOM 908 CB ASP A 64 8.192 -10.026 -2.542 1.00 74.13 C ATOM 909 CG ASP A 64 7.162 -10.886 -3.245 1.00 53.22 C ATOM 910 OD1 ASP A 64 6.387 -10.350 -4.035 1.00 33.04 O ATOM 911 OD2 ASP A 64 7.167 -12.146 -3.057 1.00 4.24 O ATOM 0 H ASP A 64 6.982 -7.600 -1.901 1.00 63.10 H new ATOM 0 HA ASP A 64 7.320 -10.242 -0.610 1.00 1.11 H new ATOM 0 HB2 ASP A 64 8.480 -9.213 -3.208 1.00 74.13 H new ATOM 0 HB3 ASP A 64 9.085 -10.626 -2.366 1.00 74.13 H new ATOM 916 N GLN A 65 9.137 -7.531 -0.891 1.00 52.25 N ATOM 917 CA GLN A 65 10.159 -6.720 -0.291 1.00 22.43 C ATOM 918 C GLN A 65 9.838 -6.481 1.192 1.00 74.22 C ATOM 919 O GLN A 65 8.718 -6.084 1.535 1.00 54.40 O ATOM 920 CB GLN A 65 10.370 -5.385 -1.075 1.00 71.53 C ATOM 921 CG GLN A 65 9.172 -4.404 -1.153 1.00 61.54 C ATOM 922 CD GLN A 65 7.937 -4.948 -1.877 1.00 73.12 C ATOM 923 OE1 GLN A 65 8.026 -5.797 -2.764 1.00 33.11 O ATOM 924 NE2 GLN A 65 6.789 -4.470 -1.514 1.00 12.51 N ATOM 0 H GLN A 65 8.608 -7.052 -1.620 1.00 52.25 H new ATOM 0 HA GLN A 65 11.106 -7.257 -0.346 1.00 22.43 H new ATOM 0 HB2 GLN A 65 11.208 -4.857 -0.621 1.00 71.53 H new ATOM 0 HB3 GLN A 65 10.666 -5.636 -2.094 1.00 71.53 H new ATOM 0 HG2 GLN A 65 8.886 -4.122 -0.140 1.00 61.54 H new ATOM 0 HG3 GLN A 65 9.499 -3.494 -1.657 1.00 61.54 H new ATOM 0 HE21 GLN A 65 6.739 -3.767 -0.777 1.00 12.51 H new ATOM 0 HE22 GLN A 65 5.935 -4.797 -1.966 1.00 12.51 H new ATOM 933 N PRO A 66 10.825 -6.720 2.082 1.00 63.44 N ATOM 934 CA PRO A 66 10.641 -6.672 3.549 1.00 75.12 C ATOM 935 C PRO A 66 10.190 -5.309 4.060 1.00 42.43 C ATOM 936 O PRO A 66 9.501 -5.198 5.082 1.00 72.21 O ATOM 937 CB PRO A 66 12.027 -7.017 4.105 1.00 53.24 C ATOM 938 CG PRO A 66 12.968 -6.771 2.980 1.00 2.33 C ATOM 939 CD PRO A 66 12.212 -7.065 1.726 1.00 32.24 C ATOM 0 HA PRO A 66 9.854 -7.356 3.865 1.00 75.12 H new ATOM 0 HB2 PRO A 66 12.272 -6.396 4.967 1.00 53.24 H new ATOM 0 HB3 PRO A 66 12.072 -8.054 4.437 1.00 53.24 H new ATOM 0 HG2 PRO A 66 13.321 -5.740 2.988 1.00 2.33 H new ATOM 0 HG3 PRO A 66 13.847 -7.410 3.062 1.00 2.33 H new ATOM 0 HD2 PRO A 66 12.573 -6.468 0.888 1.00 32.24 H new ATOM 0 HD3 PRO A 66 12.305 -8.111 1.435 1.00 32.24 H new ATOM 947 N THR A 67 10.596 -4.287 3.379 1.00 75.22 N ATOM 948 CA THR A 67 10.228 -2.962 3.716 1.00 62.55 C ATOM 949 C THR A 67 9.843 -2.199 2.459 1.00 35.22 C ATOM 950 O THR A 67 10.649 -2.031 1.549 1.00 11.11 O ATOM 951 CB THR A 67 11.375 -2.248 4.470 1.00 12.20 C ATOM 952 OG1 THR A 67 11.634 -2.946 5.704 1.00 73.23 O ATOM 953 CG2 THR A 67 11.014 -0.805 4.776 1.00 25.43 C ATOM 0 H THR A 67 11.202 -4.357 2.561 1.00 75.22 H new ATOM 0 HA THR A 67 9.366 -2.994 4.382 1.00 62.55 H new ATOM 0 HB THR A 67 12.262 -2.253 3.837 1.00 12.20 H new ATOM 0 HG1 THR A 67 12.361 -2.499 6.186 1.00 73.23 H new ATOM 0 HG21 THR A 67 11.838 -0.328 5.306 1.00 25.43 H new ATOM 0 HG22 THR A 67 10.825 -0.272 3.844 1.00 25.43 H new ATOM 0 HG23 THR A 67 10.119 -0.778 5.398 1.00 25.43 H new ATOM 961 N THR A 68 8.608 -1.800 2.388 1.00 14.21 N ATOM 962 CA THR A 68 8.143 -1.005 1.291 1.00 64.22 C ATOM 963 C THR A 68 8.098 0.435 1.782 1.00 70.04 C ATOM 964 O THR A 68 7.376 0.747 2.738 1.00 54.30 O ATOM 965 CB THR A 68 6.750 -1.468 0.860 1.00 72.42 C ATOM 966 OG1 THR A 68 6.765 -2.900 0.744 1.00 52.12 O ATOM 967 CG2 THR A 68 6.363 -0.864 -0.483 1.00 14.05 C ATOM 0 H THR A 68 7.897 -2.016 3.086 1.00 14.21 H new ATOM 0 HA THR A 68 8.802 -1.100 0.428 1.00 64.22 H new ATOM 0 HB THR A 68 6.022 -1.143 1.604 1.00 72.42 H new ATOM 0 HG1 THR A 68 6.369 -3.297 1.548 1.00 52.12 H new ATOM 0 HG21 THR A 68 5.369 -1.210 -0.765 1.00 14.05 H new ATOM 0 HG22 THR A 68 6.360 0.223 -0.406 1.00 14.05 H new ATOM 0 HG23 THR A 68 7.083 -1.172 -1.241 1.00 14.05 H new ATOM 975 N THR A 69 8.906 1.275 1.207 1.00 72.43 N ATOM 976 CA THR A 69 9.003 2.627 1.648 1.00 4.43 C ATOM 977 C THR A 69 8.140 3.569 0.812 1.00 14.12 C ATOM 978 O THR A 69 8.415 3.818 -0.376 1.00 13.41 O ATOM 979 CB THR A 69 10.475 3.099 1.651 1.00 53.21 C ATOM 980 OG1 THR A 69 11.087 2.820 0.378 1.00 62.14 O ATOM 981 CG2 THR A 69 11.264 2.406 2.751 1.00 33.22 C ATOM 0 H THR A 69 9.513 1.040 0.422 1.00 72.43 H new ATOM 0 HA THR A 69 8.622 2.658 2.669 1.00 4.43 H new ATOM 0 HB THR A 69 10.484 4.173 1.834 1.00 53.21 H new ATOM 0 HG1 THR A 69 12.019 3.124 0.389 1.00 62.14 H new ATOM 0 HG21 THR A 69 12.297 2.754 2.733 1.00 33.22 H new ATOM 0 HG22 THR A 69 10.820 2.638 3.719 1.00 33.22 H new ATOM 0 HG23 THR A 69 11.242 1.328 2.591 1.00 33.22 H new ATOM 989 N ALA A 70 7.080 4.048 1.405 1.00 54.42 N ATOM 990 CA ALA A 70 6.253 5.021 0.773 1.00 71.32 C ATOM 991 C ALA A 70 6.579 6.366 1.375 1.00 71.54 C ATOM 992 O ALA A 70 6.064 6.735 2.429 1.00 62.22 O ATOM 993 CB ALA A 70 4.775 4.683 0.932 1.00 51.21 C ATOM 0 H ALA A 70 6.772 3.771 2.337 1.00 54.42 H new ATOM 0 HA ALA A 70 6.449 5.036 -0.299 1.00 71.32 H new ATOM 0 HB1 ALA A 70 4.172 5.445 0.438 1.00 51.21 H new ATOM 0 HB2 ALA A 70 4.573 3.712 0.480 1.00 51.21 H new ATOM 0 HB3 ALA A 70 4.521 4.650 1.992 1.00 51.21 H new ATOM 999 N GLY A 71 7.489 7.055 0.746 1.00 5.20 N ATOM 1000 CA GLY A 71 7.908 8.326 1.244 1.00 34.25 C ATOM 1001 C GLY A 71 9.203 8.197 1.990 1.00 42.10 C ATOM 1002 O GLY A 71 9.227 7.713 3.120 1.00 23.42 O ATOM 0 H GLY A 71 7.952 6.755 -0.112 1.00 5.20 H new ATOM 0 HA2 GLY A 71 8.026 9.026 0.417 1.00 34.25 H new ATOM 0 HA3 GLY A 71 7.142 8.736 1.902 1.00 34.25 H new ATOM 1006 N ARG A 72 10.267 8.581 1.337 1.00 2.53 N ATOM 1007 CA ARG A 72 11.632 8.548 1.867 1.00 1.22 C ATOM 1008 C ARG A 72 12.453 9.579 1.137 1.00 71.10 C ATOM 1009 O ARG A 72 12.973 10.518 1.714 1.00 62.23 O ATOM 1010 CB ARG A 72 12.292 7.166 1.640 1.00 1.14 C ATOM 1011 CG ARG A 72 11.964 6.080 2.648 1.00 5.03 C ATOM 1012 CD ARG A 72 12.635 6.344 3.981 1.00 54.03 C ATOM 1013 NE ARG A 72 12.527 5.197 4.894 1.00 4.40 N ATOM 1014 CZ ARG A 72 13.558 4.414 5.283 1.00 32.45 C ATOM 1015 NH1 ARG A 72 14.789 4.650 4.851 1.00 72.42 N ATOM 1016 NH2 ARG A 72 13.341 3.390 6.084 1.00 0.04 N ATOM 0 H ARG A 72 10.221 8.941 0.384 1.00 2.53 H new ATOM 0 HA ARG A 72 11.590 8.748 2.938 1.00 1.22 H new ATOM 0 HB2 ARG A 72 12.004 6.810 0.651 1.00 1.14 H new ATOM 0 HB3 ARG A 72 13.373 7.303 1.628 1.00 1.14 H new ATOM 0 HG2 ARG A 72 10.884 6.024 2.787 1.00 5.03 H new ATOM 0 HG3 ARG A 72 12.286 5.113 2.262 1.00 5.03 H new ATOM 0 HD2 ARG A 72 13.687 6.577 3.816 1.00 54.03 H new ATOM 0 HD3 ARG A 72 12.183 7.220 4.446 1.00 54.03 H new ATOM 0 HE ARG A 72 11.602 4.975 5.263 1.00 4.40 H new ATOM 0 HH11 ARG A 72 14.967 5.430 4.218 1.00 72.42 H new ATOM 0 HH12 ARG A 72 15.559 4.052 5.152 1.00 72.42 H new ATOM 0 HH21 ARG A 72 12.396 3.189 6.410 1.00 0.04 H new ATOM 0 HH22 ARG A 72 14.118 2.799 6.378 1.00 0.04 H new ATOM 1030 N HIS A 73 12.549 9.387 -0.140 1.00 1.51 N ATOM 1031 CA HIS A 73 13.320 10.237 -1.015 1.00 14.41 C ATOM 1032 C HIS A 73 12.588 10.278 -2.340 1.00 52.53 C ATOM 1033 O HIS A 73 11.539 9.626 -2.465 1.00 43.24 O ATOM 1034 CB HIS A 73 14.752 9.635 -1.219 1.00 34.05 C ATOM 1035 CG HIS A 73 15.644 9.663 -0.007 1.00 10.33 C ATOM 1036 ND1 HIS A 73 16.334 10.778 0.416 1.00 62.22 N ATOM 1037 CD2 HIS A 73 15.950 8.681 0.874 1.00 3.44 C ATOM 1038 CE1 HIS A 73 17.021 10.451 1.508 1.00 63.42 C ATOM 1039 NE2 HIS A 73 16.824 9.183 1.834 1.00 11.13 N ATOM 0 H HIS A 73 12.085 8.618 -0.623 1.00 1.51 H new ATOM 0 HA HIS A 73 13.429 11.236 -0.594 1.00 14.41 H new ATOM 0 HB2 HIS A 73 14.649 8.601 -1.549 1.00 34.05 H new ATOM 0 HB3 HIS A 73 15.245 10.180 -2.024 1.00 34.05 H new ATOM 0 HD2 HIS A 73 15.575 7.669 0.837 1.00 3.44 H new ATOM 0 HE1 HIS A 73 17.656 11.131 2.056 1.00 63.42 H new ATOM 0 HE2 HIS A 73 17.228 8.679 2.624 1.00 11.13 H new ATOM 1047 N PRO A 74 13.057 11.053 -3.345 1.00 65.40 N ATOM 1048 CA PRO A 74 12.513 10.970 -4.708 1.00 21.32 C ATOM 1049 C PRO A 74 12.565 9.523 -5.221 1.00 64.33 C ATOM 1050 O PRO A 74 11.703 9.082 -5.972 1.00 74.44 O ATOM 1051 CB PRO A 74 13.457 11.865 -5.536 1.00 61.44 C ATOM 1052 CG PRO A 74 14.593 12.214 -4.623 1.00 71.12 C ATOM 1053 CD PRO A 74 14.043 12.150 -3.238 1.00 0.21 C ATOM 0 HA PRO A 74 11.471 11.283 -4.766 1.00 21.32 H new ATOM 0 HB2 PRO A 74 13.815 11.341 -6.423 1.00 61.44 H new ATOM 0 HB3 PRO A 74 12.943 12.762 -5.881 1.00 61.44 H new ATOM 0 HG2 PRO A 74 15.421 11.516 -4.746 1.00 71.12 H new ATOM 0 HG3 PRO A 74 14.979 13.209 -4.844 1.00 71.12 H new ATOM 0 HD2 PRO A 74 14.817 11.932 -2.502 1.00 0.21 H new ATOM 0 HD3 PRO A 74 13.577 13.089 -2.941 1.00 0.21 H new ATOM 1061 N GLU A 75 13.557 8.797 -4.749 1.00 63.14 N ATOM 1062 CA GLU A 75 13.759 7.418 -5.070 1.00 51.30 C ATOM 1063 C GLU A 75 13.415 6.554 -3.862 1.00 61.11 C ATOM 1064 O GLU A 75 14.290 6.098 -3.130 1.00 32.11 O ATOM 1065 CB GLU A 75 15.205 7.168 -5.492 1.00 51.04 C ATOM 1066 CG GLU A 75 15.623 7.873 -6.766 1.00 52.24 C ATOM 1067 CD GLU A 75 14.964 7.306 -7.996 1.00 43.51 C ATOM 1068 OE1 GLU A 75 15.381 6.216 -8.455 1.00 42.24 O ATOM 1069 OE2 GLU A 75 14.067 7.950 -8.559 1.00 25.14 O ATOM 0 H GLU A 75 14.261 9.171 -4.113 1.00 63.14 H new ATOM 0 HA GLU A 75 13.107 7.155 -5.903 1.00 51.30 H new ATOM 0 HB2 GLU A 75 15.865 7.485 -4.684 1.00 51.04 H new ATOM 0 HB3 GLU A 75 15.351 6.096 -5.621 1.00 51.04 H new ATOM 0 HG2 GLU A 75 15.379 8.932 -6.685 1.00 52.24 H new ATOM 0 HG3 GLU A 75 16.705 7.803 -6.875 1.00 52.24 H new ATOM 1076 N SER A 76 12.151 6.447 -3.582 1.00 35.04 N ATOM 1077 CA SER A 76 11.685 5.543 -2.541 1.00 21.22 C ATOM 1078 C SER A 76 11.386 4.197 -3.201 1.00 64.12 C ATOM 1079 O SER A 76 11.674 4.040 -4.394 1.00 44.40 O ATOM 1080 CB SER A 76 10.433 6.112 -1.868 1.00 54.31 C ATOM 1081 OG SER A 76 10.684 7.402 -1.333 1.00 34.23 O ATOM 0 H SER A 76 11.413 6.970 -4.053 1.00 35.04 H new ATOM 0 HA SER A 76 12.443 5.420 -1.767 1.00 21.22 H new ATOM 0 HB2 SER A 76 9.620 6.167 -2.592 1.00 54.31 H new ATOM 0 HB3 SER A 76 10.107 5.442 -1.073 1.00 54.31 H new ATOM 0 HG SER A 76 10.780 8.047 -2.065 1.00 34.23 H new ATOM 1087 N ASP A 77 10.843 3.230 -2.465 1.00 72.34 N ATOM 1088 CA ASP A 77 10.475 1.933 -3.072 1.00 51.45 C ATOM 1089 C ASP A 77 9.433 2.189 -4.154 1.00 0.24 C ATOM 1090 O ASP A 77 9.525 1.674 -5.279 1.00 32.43 O ATOM 1091 CB ASP A 77 9.926 0.970 -2.020 1.00 11.53 C ATOM 1092 CG ASP A 77 9.642 -0.401 -2.579 1.00 51.02 C ATOM 1093 OD1 ASP A 77 10.577 -1.239 -2.627 1.00 55.55 O ATOM 1094 OD2 ASP A 77 8.504 -0.673 -2.948 1.00 65.51 O ATOM 0 H ASP A 77 10.647 3.307 -1.467 1.00 72.34 H new ATOM 0 HA ASP A 77 11.361 1.470 -3.506 1.00 51.45 H new ATOM 0 HB2 ASP A 77 10.642 0.884 -1.203 1.00 11.53 H new ATOM 0 HB3 ASP A 77 9.010 1.383 -1.598 1.00 11.53 H new ATOM 1099 N ILE A 78 8.484 3.027 -3.804 1.00 24.12 N ATOM 1100 CA ILE A 78 7.503 3.562 -4.717 1.00 3.31 C ATOM 1101 C ILE A 78 7.552 5.066 -4.532 1.00 53.41 C ATOM 1102 O ILE A 78 7.783 5.534 -3.408 1.00 41.41 O ATOM 1103 CB ILE A 78 6.055 3.033 -4.444 1.00 63.21 C ATOM 1104 CG1 ILE A 78 5.614 3.315 -2.988 1.00 63.12 C ATOM 1105 CG2 ILE A 78 5.954 1.547 -4.774 1.00 4.23 C ATOM 1106 CD1 ILE A 78 4.172 2.951 -2.689 1.00 53.42 C ATOM 0 H ILE A 78 8.371 3.364 -2.848 1.00 24.12 H new ATOM 0 HA ILE A 78 7.736 3.251 -5.735 1.00 3.31 H new ATOM 0 HB ILE A 78 5.372 3.573 -5.099 1.00 63.21 H new ATOM 0 HG12 ILE A 78 6.264 2.761 -2.311 1.00 63.12 H new ATOM 0 HG13 ILE A 78 5.760 4.374 -2.775 1.00 63.12 H new ATOM 0 HG21 ILE A 78 4.940 1.199 -4.577 1.00 4.23 H new ATOM 0 HG22 ILE A 78 6.194 1.391 -5.826 1.00 4.23 H new ATOM 0 HG23 ILE A 78 6.656 0.988 -4.155 1.00 4.23 H new ATOM 0 HD11 ILE A 78 3.947 3.181 -1.648 1.00 53.42 H new ATOM 0 HD12 ILE A 78 3.510 3.524 -3.338 1.00 53.42 H new ATOM 0 HD13 ILE A 78 4.021 1.886 -2.866 1.00 53.42 H new ATOM 1118 N PHE A 79 7.389 5.829 -5.572 1.00 51.53 N ATOM 1119 CA PHE A 79 7.524 7.246 -5.410 1.00 75.22 C ATOM 1120 C PHE A 79 6.186 7.934 -5.288 1.00 24.01 C ATOM 1121 O PHE A 79 5.281 7.743 -6.096 1.00 30.11 O ATOM 1122 CB PHE A 79 8.425 7.908 -6.485 1.00 64.33 C ATOM 1123 CG PHE A 79 7.896 7.923 -7.899 1.00 15.14 C ATOM 1124 CD1 PHE A 79 8.099 6.853 -8.746 1.00 3.22 C ATOM 1125 CD2 PHE A 79 7.218 9.035 -8.382 1.00 71.43 C ATOM 1126 CE1 PHE A 79 7.637 6.887 -10.045 1.00 65.12 C ATOM 1127 CE2 PHE A 79 6.750 9.072 -9.676 1.00 1.23 C ATOM 1128 CZ PHE A 79 6.961 7.996 -10.510 1.00 11.31 C ATOM 0 H PHE A 79 7.169 5.508 -6.515 1.00 51.53 H new ATOM 0 HA PHE A 79 8.046 7.385 -4.463 1.00 75.22 H new ATOM 0 HB2 PHE A 79 8.615 8.938 -6.182 1.00 64.33 H new ATOM 0 HB3 PHE A 79 9.386 7.394 -6.487 1.00 64.33 H new ATOM 0 HD1 PHE A 79 8.625 5.980 -8.388 1.00 3.22 H new ATOM 0 HD2 PHE A 79 7.056 9.883 -7.733 1.00 71.43 H new ATOM 0 HE1 PHE A 79 7.805 6.044 -10.699 1.00 65.12 H new ATOM 0 HE2 PHE A 79 6.220 9.941 -10.036 1.00 1.23 H new ATOM 0 HZ PHE A 79 6.598 8.021 -11.527 1.00 11.31 H new ATOM 1138 N LEU A 80 6.059 8.684 -4.247 1.00 1.45 N ATOM 1139 CA LEU A 80 4.911 9.494 -4.005 1.00 31.12 C ATOM 1140 C LEU A 80 5.141 10.782 -4.737 1.00 24.14 C ATOM 1141 O LEU A 80 5.793 11.684 -4.225 1.00 74.31 O ATOM 1142 CB LEU A 80 4.687 9.731 -2.484 1.00 43.54 C ATOM 1143 CG LEU A 80 4.188 8.520 -1.636 1.00 34.32 C ATOM 1144 CD1 LEU A 80 5.117 7.326 -1.725 1.00 13.11 C ATOM 1145 CD2 LEU A 80 4.005 8.923 -0.180 1.00 53.51 C ATOM 0 H LEU A 80 6.770 8.754 -3.519 1.00 1.45 H new ATOM 0 HA LEU A 80 4.006 9.001 -4.360 1.00 31.12 H new ATOM 0 HB2 LEU A 80 5.627 10.079 -2.055 1.00 43.54 H new ATOM 0 HB3 LEU A 80 3.966 10.541 -2.372 1.00 43.54 H new ATOM 0 HG LEU A 80 3.227 8.221 -2.055 1.00 34.32 H new ATOM 0 HD11 LEU A 80 4.723 6.512 -1.117 1.00 13.11 H new ATOM 0 HD12 LEU A 80 5.192 7.000 -2.762 1.00 13.11 H new ATOM 0 HD13 LEU A 80 6.105 7.606 -1.360 1.00 13.11 H new ATOM 0 HD21 LEU A 80 3.657 8.064 0.394 1.00 53.51 H new ATOM 0 HD22 LEU A 80 4.957 9.268 0.224 1.00 53.51 H new ATOM 0 HD23 LEU A 80 3.270 9.726 -0.114 1.00 53.51 H new ATOM 1157 N ASP A 81 4.703 10.791 -5.982 1.00 74.01 N ATOM 1158 CA ASP A 81 4.935 11.888 -6.933 1.00 12.13 C ATOM 1159 C ASP A 81 4.692 13.268 -6.340 1.00 70.00 C ATOM 1160 O ASP A 81 5.607 14.077 -6.276 1.00 20.00 O ATOM 1161 CB ASP A 81 4.120 11.681 -8.205 1.00 10.44 C ATOM 1162 CG ASP A 81 4.352 12.766 -9.230 1.00 1.52 C ATOM 1163 OD1 ASP A 81 5.452 12.816 -9.820 1.00 12.13 O ATOM 1164 OD2 ASP A 81 3.414 13.557 -9.496 1.00 43.40 O ATOM 0 H ASP A 81 4.162 10.023 -6.380 1.00 74.01 H new ATOM 0 HA ASP A 81 5.995 11.857 -7.185 1.00 12.13 H new ATOM 0 HB2 ASP A 81 4.374 10.715 -8.641 1.00 10.44 H new ATOM 0 HB3 ASP A 81 3.061 11.647 -7.951 1.00 10.44 H new ATOM 1169 N ASP A 82 3.497 13.513 -5.862 1.00 44.32 N ATOM 1170 CA ASP A 82 3.171 14.799 -5.268 1.00 22.50 C ATOM 1171 C ASP A 82 1.909 14.597 -4.461 1.00 23.30 C ATOM 1172 O ASP A 82 1.526 13.440 -4.214 1.00 34.52 O ATOM 1173 CB ASP A 82 2.947 15.856 -6.366 1.00 54.22 C ATOM 1174 CG ASP A 82 3.250 17.288 -5.914 1.00 53.30 C ATOM 1175 OD1 ASP A 82 2.538 17.819 -5.027 1.00 21.23 O ATOM 1176 OD2 ASP A 82 4.220 17.904 -6.429 1.00 1.44 O ATOM 0 H ASP A 82 2.729 12.842 -5.870 1.00 44.32 H new ATOM 0 HA ASP A 82 3.984 15.156 -4.636 1.00 22.50 H new ATOM 0 HB2 ASP A 82 3.575 15.615 -7.224 1.00 54.22 H new ATOM 0 HB3 ASP A 82 1.912 15.802 -6.704 1.00 54.22 H new ATOM 1181 N VAL A 83 1.276 15.686 -4.043 1.00 10.41 N ATOM 1182 CA VAL A 83 0.038 15.696 -3.248 1.00 61.10 C ATOM 1183 C VAL A 83 0.276 15.303 -1.778 1.00 43.45 C ATOM 1184 O VAL A 83 -0.291 15.909 -0.858 1.00 72.35 O ATOM 1185 CB VAL A 83 -1.102 14.839 -3.894 1.00 71.15 C ATOM 1186 CG1 VAL A 83 -2.327 14.760 -2.993 1.00 11.30 C ATOM 1187 CG2 VAL A 83 -1.491 15.420 -5.248 1.00 64.22 C ATOM 0 H VAL A 83 1.617 16.624 -4.252 1.00 10.41 H new ATOM 0 HA VAL A 83 -0.304 16.731 -3.250 1.00 61.10 H new ATOM 0 HB VAL A 83 -0.719 13.827 -4.028 1.00 71.15 H new ATOM 0 HG11 VAL A 83 -3.096 14.157 -3.476 1.00 11.30 H new ATOM 0 HG12 VAL A 83 -2.051 14.303 -2.043 1.00 11.30 H new ATOM 0 HG13 VAL A 83 -2.712 15.764 -2.814 1.00 11.30 H new ATOM 0 HG21 VAL A 83 -2.285 14.816 -5.689 1.00 64.22 H new ATOM 0 HG22 VAL A 83 -1.843 16.443 -5.117 1.00 64.22 H new ATOM 0 HG23 VAL A 83 -0.624 15.417 -5.908 1.00 64.22 H new ATOM 1197 N THR A 84 1.089 14.308 -1.555 1.00 32.34 N ATOM 1198 CA THR A 84 1.390 13.856 -0.204 1.00 54.11 C ATOM 1199 C THR A 84 2.776 13.176 -0.162 1.00 40.22 C ATOM 1200 O THR A 84 2.888 11.956 -0.167 1.00 4.23 O ATOM 1201 CB THR A 84 0.277 12.883 0.345 1.00 13.12 C ATOM 1202 OG1 THR A 84 -1.018 13.514 0.279 1.00 34.32 O ATOM 1203 CG2 THR A 84 0.543 12.478 1.782 1.00 45.20 C ATOM 0 H THR A 84 1.564 13.784 -2.290 1.00 32.34 H new ATOM 0 HA THR A 84 1.408 14.732 0.444 1.00 54.11 H new ATOM 0 HB THR A 84 0.296 11.991 -0.282 1.00 13.12 H new ATOM 0 HG1 THR A 84 -1.531 13.294 1.085 1.00 34.32 H new ATOM 0 HG21 THR A 84 -0.246 11.808 2.123 1.00 45.20 H new ATOM 0 HG22 THR A 84 1.504 11.968 1.844 1.00 45.20 H new ATOM 0 HG23 THR A 84 0.562 13.367 2.413 1.00 45.20 H new ATOM 1211 N VAL A 85 3.822 13.965 -0.279 1.00 43.24 N ATOM 1212 CA VAL A 85 5.155 13.419 -0.176 1.00 33.11 C ATOM 1213 C VAL A 85 5.912 13.944 1.064 1.00 65.05 C ATOM 1214 O VAL A 85 6.251 15.136 1.152 1.00 13.34 O ATOM 1215 CB VAL A 85 5.994 13.563 -1.494 1.00 14.11 C ATOM 1216 CG1 VAL A 85 6.188 15.011 -1.912 1.00 75.35 C ATOM 1217 CG2 VAL A 85 7.334 12.846 -1.374 1.00 75.42 C ATOM 0 H VAL A 85 3.777 14.971 -0.443 1.00 43.24 H new ATOM 0 HA VAL A 85 5.020 12.347 -0.032 1.00 33.11 H new ATOM 0 HB VAL A 85 5.415 13.084 -2.283 1.00 14.11 H new ATOM 0 HG11 VAL A 85 6.775 15.049 -2.829 1.00 75.35 H new ATOM 0 HG12 VAL A 85 5.216 15.473 -2.084 1.00 75.35 H new ATOM 0 HG13 VAL A 85 6.712 15.550 -1.123 1.00 75.35 H new ATOM 0 HG21 VAL A 85 7.894 12.963 -2.302 1.00 75.42 H new ATOM 0 HG22 VAL A 85 7.904 13.275 -0.550 1.00 75.42 H new ATOM 0 HG23 VAL A 85 7.164 11.786 -1.184 1.00 75.42 H new ATOM 1227 N SER A 86 6.113 13.095 2.035 1.00 2.31 N ATOM 1228 CA SER A 86 6.914 13.448 3.190 1.00 54.12 C ATOM 1229 C SER A 86 8.352 12.897 2.986 1.00 72.40 C ATOM 1230 O SER A 86 8.596 12.129 2.043 1.00 4.12 O ATOM 1231 CB SER A 86 6.256 12.881 4.465 1.00 73.43 C ATOM 1232 OG SER A 86 6.961 13.238 5.649 1.00 53.41 O ATOM 0 H SER A 86 5.734 12.148 2.055 1.00 2.31 H new ATOM 0 HA SER A 86 6.974 14.530 3.304 1.00 54.12 H new ATOM 0 HB2 SER A 86 5.231 13.245 4.533 1.00 73.43 H new ATOM 0 HB3 SER A 86 6.204 11.795 4.391 1.00 73.43 H new ATOM 0 HG SER A 86 7.296 12.428 6.087 1.00 53.41 H new ATOM 1238 N ARG A 87 9.301 13.288 3.852 1.00 50.24 N ATOM 1239 CA ARG A 87 10.711 12.827 3.738 1.00 11.05 C ATOM 1240 C ARG A 87 10.827 11.395 4.293 1.00 3.45 C ATOM 1241 O ARG A 87 11.852 10.736 4.221 1.00 1.45 O ATOM 1242 CB ARG A 87 11.655 13.815 4.467 1.00 54.10 C ATOM 1243 CG ARG A 87 13.146 13.502 4.329 1.00 72.30 C ATOM 1244 CD ARG A 87 14.007 14.572 4.987 1.00 42.31 C ATOM 1245 NE ARG A 87 15.442 14.255 4.910 1.00 14.24 N ATOM 1246 CZ ARG A 87 16.442 15.148 4.970 1.00 2.22 C ATOM 1247 NH1 ARG A 87 16.186 16.444 5.095 1.00 12.31 N ATOM 1248 NH2 ARG A 87 17.696 14.729 4.912 1.00 1.12 N ATOM 0 H ARG A 87 9.128 13.917 4.636 1.00 50.24 H new ATOM 0 HA ARG A 87 11.014 12.806 2.691 1.00 11.05 H new ATOM 0 HB2 ARG A 87 11.472 14.819 4.084 1.00 54.10 H new ATOM 0 HB3 ARG A 87 11.398 13.826 5.526 1.00 54.10 H new ATOM 0 HG2 ARG A 87 13.358 12.534 4.782 1.00 72.30 H new ATOM 0 HG3 ARG A 87 13.406 13.424 3.273 1.00 72.30 H new ATOM 0 HD2 ARG A 87 13.822 15.532 4.505 1.00 42.31 H new ATOM 0 HD3 ARG A 87 13.716 14.679 6.032 1.00 42.31 H new ATOM 0 HE ARG A 87 15.698 13.274 4.802 1.00 14.24 H new ATOM 0 HH11 ARG A 87 15.221 16.771 5.147 1.00 12.31 H new ATOM 0 HH12 ARG A 87 16.954 17.114 5.140 1.00 12.31 H new ATOM 0 HH21 ARG A 87 17.897 13.733 4.822 1.00 1.12 H new ATOM 0 HH22 ARG A 87 18.461 15.402 4.957 1.00 1.12 H new ATOM 1262 N ARG A 88 9.756 10.978 4.876 1.00 65.33 N ATOM 1263 CA ARG A 88 9.514 9.658 5.361 1.00 10.31 C ATOM 1264 C ARG A 88 8.074 9.661 5.718 1.00 43.03 C ATOM 1265 O ARG A 88 7.627 10.601 6.380 1.00 34.23 O ATOM 1266 CB ARG A 88 10.463 9.203 6.532 1.00 3.11 C ATOM 1267 CG ARG A 88 10.442 9.966 7.880 1.00 72.15 C ATOM 1268 CD ARG A 88 10.735 11.448 7.737 1.00 24.02 C ATOM 1269 NE ARG A 88 11.268 12.044 8.959 1.00 1.24 N ATOM 1270 CZ ARG A 88 10.558 12.586 9.959 1.00 3.31 C ATOM 1271 NH1 ARG A 88 9.242 12.360 10.070 1.00 20.11 N ATOM 1272 NH2 ARG A 88 11.186 13.283 10.891 1.00 55.01 N ATOM 0 H ARG A 88 8.963 11.598 5.040 1.00 65.33 H new ATOM 0 HA ARG A 88 9.747 8.909 4.604 1.00 10.31 H new ATOM 0 HB2 ARG A 88 10.238 8.158 6.746 1.00 3.11 H new ATOM 0 HB3 ARG A 88 11.485 9.238 6.155 1.00 3.11 H new ATOM 0 HG2 ARG A 88 9.465 9.840 8.346 1.00 72.15 H new ATOM 0 HG3 ARG A 88 11.175 9.521 8.553 1.00 72.15 H new ATOM 0 HD2 ARG A 88 11.448 11.595 6.926 1.00 24.02 H new ATOM 0 HD3 ARG A 88 9.820 11.968 7.455 1.00 24.02 H new ATOM 0 HE ARG A 88 12.283 12.048 9.062 1.00 1.24 H new ATOM 0 HH11 ARG A 88 8.767 11.769 9.388 1.00 20.11 H new ATOM 0 HH12 ARG A 88 8.715 12.779 10.836 1.00 20.11 H new ATOM 0 HH21 ARG A 88 12.198 13.403 10.843 1.00 55.01 H new ATOM 0 HH22 ARG A 88 10.659 13.701 11.657 1.00 55.01 H new ATOM 1286 N HIS A 89 7.308 8.735 5.188 1.00 74.51 N ATOM 1287 CA HIS A 89 5.874 8.811 5.389 1.00 13.02 C ATOM 1288 C HIS A 89 5.280 7.513 5.915 1.00 74.52 C ATOM 1289 O HIS A 89 4.984 7.398 7.093 1.00 61.10 O ATOM 1290 CB HIS A 89 5.169 9.263 4.100 1.00 3.33 C ATOM 1291 CG HIS A 89 3.763 9.733 4.308 1.00 41.41 C ATOM 1292 ND1 HIS A 89 3.477 11.069 4.411 1.00 4.10 N ATOM 1293 CD2 HIS A 89 2.617 9.025 4.425 1.00 35.20 C ATOM 1294 CE1 HIS A 89 2.181 11.147 4.584 1.00 42.11 C ATOM 1295 NE2 HIS A 89 1.612 9.936 4.604 1.00 43.00 N ATOM 0 H HIS A 89 7.636 7.945 4.632 1.00 74.51 H new ATOM 0 HA HIS A 89 5.703 9.560 6.162 1.00 13.02 H new ATOM 0 HB2 HIS A 89 5.747 10.068 3.645 1.00 3.33 H new ATOM 0 HB3 HIS A 89 5.163 8.435 3.391 1.00 3.33 H new ATOM 0 HD2 HIS A 89 2.515 7.951 4.385 1.00 35.20 H new ATOM 0 HE1 HIS A 89 1.639 12.074 4.697 1.00 42.11 H new ATOM 0 HE2 HIS A 89 0.621 9.732 4.729 1.00 43.00 H new ATOM 1303 N ALA A 90 5.119 6.549 5.064 1.00 72.13 N ATOM 1304 CA ALA A 90 4.507 5.316 5.458 1.00 43.00 C ATOM 1305 C ALA A 90 5.384 4.177 5.071 1.00 34.33 C ATOM 1306 O ALA A 90 5.704 3.987 3.898 1.00 0.14 O ATOM 1307 CB ALA A 90 3.136 5.170 4.825 1.00 13.12 C ATOM 0 H ALA A 90 5.404 6.591 4.086 1.00 72.13 H new ATOM 0 HA ALA A 90 4.379 5.316 6.540 1.00 43.00 H new ATOM 0 HB1 ALA A 90 2.689 4.226 5.138 1.00 13.12 H new ATOM 0 HB2 ALA A 90 2.499 5.996 5.142 1.00 13.12 H new ATOM 0 HB3 ALA A 90 3.233 5.183 3.739 1.00 13.12 H new ATOM 1313 N GLU A 91 5.805 3.441 6.025 1.00 62.22 N ATOM 1314 CA GLU A 91 6.631 2.333 5.749 1.00 31.25 C ATOM 1315 C GLU A 91 5.927 1.061 6.087 1.00 11.02 C ATOM 1316 O GLU A 91 5.401 0.887 7.195 1.00 52.04 O ATOM 1317 CB GLU A 91 7.966 2.458 6.442 1.00 33.14 C ATOM 1318 CG GLU A 91 8.800 3.603 5.903 1.00 35.12 C ATOM 1319 CD GLU A 91 10.143 3.674 6.538 1.00 50.34 C ATOM 1320 OE1 GLU A 91 10.854 2.660 6.549 1.00 61.41 O ATOM 1321 OE2 GLU A 91 10.555 4.748 6.987 1.00 32.53 O ATOM 0 H GLU A 91 5.590 3.587 7.011 1.00 62.22 H new ATOM 0 HA GLU A 91 6.841 2.313 4.680 1.00 31.25 H new ATOM 0 HB2 GLU A 91 7.804 2.603 7.510 1.00 33.14 H new ATOM 0 HB3 GLU A 91 8.519 1.526 6.327 1.00 33.14 H new ATOM 0 HG2 GLU A 91 8.916 3.488 4.825 1.00 35.12 H new ATOM 0 HG3 GLU A 91 8.273 4.542 6.069 1.00 35.12 H new ATOM 1328 N PHE A 92 5.909 0.181 5.140 1.00 13.01 N ATOM 1329 CA PHE A 92 5.252 -1.077 5.287 1.00 65.41 C ATOM 1330 C PHE A 92 6.288 -2.101 5.668 1.00 14.43 C ATOM 1331 O PHE A 92 7.291 -2.281 4.951 1.00 20.34 O ATOM 1332 CB PHE A 92 4.572 -1.491 3.973 1.00 14.42 C ATOM 1333 CG PHE A 92 3.626 -0.454 3.395 1.00 24.52 C ATOM 1334 CD1 PHE A 92 4.088 0.529 2.531 1.00 4.14 C ATOM 1335 CD2 PHE A 92 2.283 -0.469 3.712 1.00 21.12 C ATOM 1336 CE1 PHE A 92 3.227 1.468 2.005 1.00 33.02 C ATOM 1337 CE2 PHE A 92 1.417 0.468 3.190 1.00 64.31 C ATOM 1338 CZ PHE A 92 1.891 1.438 2.336 1.00 4.31 C ATOM 0 H PHE A 92 6.355 0.316 4.233 1.00 13.01 H new ATOM 0 HA PHE A 92 4.483 -1.003 6.056 1.00 65.41 H new ATOM 0 HB2 PHE A 92 5.343 -1.712 3.235 1.00 14.42 H new ATOM 0 HB3 PHE A 92 4.018 -2.415 4.141 1.00 14.42 H new ATOM 0 HD1 PHE A 92 5.135 0.559 2.268 1.00 4.14 H new ATOM 0 HD2 PHE A 92 1.904 -1.228 4.380 1.00 21.12 H new ATOM 0 HE1 PHE A 92 3.600 2.227 1.333 1.00 33.02 H new ATOM 0 HE2 PHE A 92 0.369 0.441 3.450 1.00 64.31 H new ATOM 0 HZ PHE A 92 1.216 2.175 1.926 1.00 4.31 H new ATOM 1348 N ARG A 93 6.091 -2.717 6.791 1.00 40.45 N ATOM 1349 CA ARG A 93 6.980 -3.726 7.282 1.00 2.21 C ATOM 1350 C ARG A 93 6.337 -5.057 7.086 1.00 42.01 C ATOM 1351 O ARG A 93 5.175 -5.254 7.481 1.00 52.04 O ATOM 1352 CB ARG A 93 7.242 -3.559 8.782 1.00 0.53 C ATOM 1353 CG ARG A 93 7.960 -2.297 9.208 1.00 41.21 C ATOM 1354 CD ARG A 93 9.320 -2.179 8.553 1.00 24.32 C ATOM 1355 NE ARG A 93 10.182 -1.254 9.286 1.00 71.22 N ATOM 1356 CZ ARG A 93 10.680 -0.106 8.835 1.00 51.43 C ATOM 1357 NH1 ARG A 93 10.285 0.379 7.676 1.00 63.34 N ATOM 1358 NH2 ARG A 93 11.544 0.566 9.578 1.00 65.35 N ATOM 0 H ARG A 93 5.296 -2.531 7.403 1.00 40.45 H new ATOM 0 HA ARG A 93 7.923 -3.642 6.742 1.00 2.21 H new ATOM 0 HB2 ARG A 93 6.285 -3.598 9.301 1.00 0.53 H new ATOM 0 HB3 ARG A 93 7.825 -4.414 9.123 1.00 0.53 H new ATOM 0 HG2 ARG A 93 7.355 -1.429 8.949 1.00 41.21 H new ATOM 0 HG3 ARG A 93 8.076 -2.292 10.292 1.00 41.21 H new ATOM 0 HD2 ARG A 93 9.791 -3.161 8.508 1.00 24.32 H new ATOM 0 HD3 ARG A 93 9.203 -1.834 7.526 1.00 24.32 H new ATOM 0 HE ARG A 93 10.427 -1.515 10.241 1.00 71.22 H new ATOM 0 HH11 ARG A 93 9.595 -0.126 7.120 1.00 63.34 H new ATOM 0 HH12 ARG A 93 10.669 1.260 7.334 1.00 63.34 H new ATOM 0 HH21 ARG A 93 11.824 0.203 10.489 1.00 65.35 H new ATOM 0 HH22 ARG A 93 11.931 1.447 9.240 1.00 65.35 H new ATOM 1372 N ILE A 94 7.035 -5.970 6.496 1.00 32.53 N ATOM 1373 CA ILE A 94 6.502 -7.278 6.411 1.00 2.41 C ATOM 1374 C ILE A 94 7.394 -8.196 7.200 1.00 71.00 C ATOM 1375 O ILE A 94 8.632 -8.130 7.124 1.00 64.53 O ATOM 1376 CB ILE A 94 6.260 -7.826 4.972 1.00 70.22 C ATOM 1377 CG1 ILE A 94 7.554 -8.173 4.261 1.00 53.35 C ATOM 1378 CG2 ILE A 94 5.486 -6.800 4.145 1.00 72.03 C ATOM 1379 CD1 ILE A 94 7.339 -9.106 3.104 1.00 32.13 C ATOM 0 H ILE A 94 7.955 -5.835 6.076 1.00 32.53 H new ATOM 0 HA ILE A 94 5.496 -7.231 6.829 1.00 2.41 H new ATOM 0 HB ILE A 94 5.680 -8.743 5.072 1.00 70.22 H new ATOM 0 HG12 ILE A 94 8.026 -7.258 3.903 1.00 53.35 H new ATOM 0 HG13 ILE A 94 8.244 -8.631 4.970 1.00 53.35 H new ATOM 0 HG21 ILE A 94 5.321 -7.191 3.141 1.00 72.03 H new ATOM 0 HG22 ILE A 94 4.525 -6.601 4.619 1.00 72.03 H new ATOM 0 HG23 ILE A 94 6.059 -5.875 4.084 1.00 72.03 H new ATOM 0 HD11 ILE A 94 8.296 -9.323 2.629 1.00 32.13 H new ATOM 0 HD12 ILE A 94 6.893 -10.034 3.463 1.00 32.13 H new ATOM 0 HD13 ILE A 94 6.672 -8.639 2.379 1.00 32.13 H new ATOM 1391 N ASN A 95 6.780 -8.953 8.012 1.00 54.32 N ATOM 1392 CA ASN A 95 7.435 -9.837 8.920 1.00 63.42 C ATOM 1393 C ASN A 95 6.964 -11.230 8.579 1.00 34.13 C ATOM 1394 O ASN A 95 5.817 -11.395 8.145 1.00 61.14 O ATOM 1395 CB ASN A 95 7.000 -9.453 10.354 1.00 25.44 C ATOM 1396 CG ASN A 95 7.715 -10.171 11.491 1.00 20.33 C ATOM 1397 OD1 ASN A 95 8.226 -11.276 11.347 1.00 64.45 O ATOM 1398 ND2 ASN A 95 7.674 -9.579 12.651 1.00 74.11 N ATOM 0 H ASN A 95 5.763 -8.986 8.077 1.00 54.32 H new ATOM 0 HA ASN A 95 8.521 -9.780 8.853 1.00 63.42 H new ATOM 0 HB2 ASN A 95 7.147 -8.380 10.480 1.00 25.44 H new ATOM 0 HB3 ASN A 95 5.931 -9.641 10.449 1.00 25.44 H new ATOM 0 HD21 ASN A 95 8.074 -10.035 13.471 1.00 74.11 H new ATOM 0 HD22 ASN A 95 7.242 -8.659 12.739 1.00 74.11 H new ATOM 1405 N GLU A 96 7.829 -12.220 8.719 1.00 10.43 N ATOM 1406 CA GLU A 96 7.433 -13.621 8.538 1.00 63.24 C ATOM 1407 C GLU A 96 6.318 -13.997 9.543 1.00 21.24 C ATOM 1408 O GLU A 96 5.599 -14.989 9.366 1.00 10.34 O ATOM 1409 CB GLU A 96 8.640 -14.558 8.698 1.00 24.50 C ATOM 1410 CG GLU A 96 9.359 -14.425 10.035 1.00 61.51 C ATOM 1411 CD GLU A 96 10.441 -15.453 10.216 1.00 64.53 C ATOM 1412 OE1 GLU A 96 11.529 -15.298 9.642 1.00 12.11 O ATOM 1413 OE2 GLU A 96 10.224 -16.443 10.955 1.00 62.03 O ATOM 0 H GLU A 96 8.812 -12.088 8.957 1.00 10.43 H new ATOM 0 HA GLU A 96 7.046 -13.739 7.526 1.00 63.24 H new ATOM 0 HB2 GLU A 96 8.305 -15.588 8.579 1.00 24.50 H new ATOM 0 HB3 GLU A 96 9.350 -14.359 7.895 1.00 24.50 H new ATOM 0 HG2 GLU A 96 9.794 -13.428 10.112 1.00 61.51 H new ATOM 0 HG3 GLU A 96 8.634 -14.520 10.844 1.00 61.51 H new ATOM 1420 N GLY A 97 6.219 -13.213 10.602 1.00 31.21 N ATOM 1421 CA GLY A 97 5.171 -13.366 11.553 1.00 42.32 C ATOM 1422 C GLY A 97 3.861 -12.780 11.043 1.00 55.12 C ATOM 1423 O GLY A 97 2.892 -13.517 10.836 1.00 63.55 O ATOM 0 H GLY A 97 6.871 -12.457 10.813 1.00 31.21 H new ATOM 0 HA2 GLY A 97 5.034 -14.424 11.777 1.00 42.32 H new ATOM 0 HA3 GLY A 97 5.451 -12.876 12.486 1.00 42.32 H new ATOM 1427 N GLU A 98 3.832 -11.474 10.783 1.00 42.30 N ATOM 1428 CA GLU A 98 2.608 -10.805 10.364 1.00 45.25 C ATOM 1429 C GLU A 98 2.969 -9.499 9.608 1.00 72.14 C ATOM 1430 O GLU A 98 4.139 -9.224 9.389 1.00 74.00 O ATOM 1431 CB GLU A 98 1.698 -10.587 11.613 1.00 63.10 C ATOM 1432 CG GLU A 98 0.277 -10.101 11.334 1.00 3.32 C ATOM 1433 CD GLU A 98 -0.650 -10.311 12.509 1.00 72.54 C ATOM 1434 OE1 GLU A 98 -0.523 -9.603 13.531 1.00 41.41 O ATOM 1435 OE2 GLU A 98 -1.533 -11.191 12.425 1.00 52.31 O ATOM 0 H GLU A 98 4.644 -10.861 10.856 1.00 42.30 H new ATOM 0 HA GLU A 98 2.037 -11.414 9.663 1.00 45.25 H new ATOM 0 HB2 GLU A 98 1.637 -11.527 12.161 1.00 63.10 H new ATOM 0 HB3 GLU A 98 2.184 -9.866 12.270 1.00 63.10 H new ATOM 0 HG2 GLU A 98 0.303 -9.041 11.081 1.00 3.32 H new ATOM 0 HG3 GLU A 98 -0.119 -10.627 10.465 1.00 3.32 H new ATOM 1442 N PHE A 99 1.987 -8.740 9.186 1.00 61.33 N ATOM 1443 CA PHE A 99 2.210 -7.537 8.397 1.00 12.02 C ATOM 1444 C PHE A 99 1.889 -6.277 9.229 1.00 4.01 C ATOM 1445 O PHE A 99 0.811 -6.186 9.841 1.00 62.31 O ATOM 1446 CB PHE A 99 1.332 -7.597 7.137 1.00 1.33 C ATOM 1447 CG PHE A 99 1.667 -8.712 6.171 1.00 72.10 C ATOM 1448 CD1 PHE A 99 1.201 -10.006 6.380 1.00 4.04 C ATOM 1449 CD2 PHE A 99 2.449 -8.467 5.061 1.00 12.55 C ATOM 1450 CE1 PHE A 99 1.511 -11.021 5.496 1.00 70.23 C ATOM 1451 CE2 PHE A 99 2.762 -9.479 4.173 1.00 43.22 C ATOM 1452 CZ PHE A 99 2.295 -10.757 4.394 1.00 11.42 C ATOM 0 H PHE A 99 1.004 -8.934 9.377 1.00 61.33 H new ATOM 0 HA PHE A 99 3.258 -7.482 8.103 1.00 12.02 H new ATOM 0 HB2 PHE A 99 0.291 -7.704 7.443 1.00 1.33 H new ATOM 0 HB3 PHE A 99 1.413 -6.646 6.611 1.00 1.33 H new ATOM 0 HD1 PHE A 99 0.589 -10.220 7.244 1.00 4.04 H new ATOM 0 HD2 PHE A 99 2.822 -7.469 4.883 1.00 12.55 H new ATOM 0 HE1 PHE A 99 1.139 -12.020 5.668 1.00 70.23 H new ATOM 0 HE2 PHE A 99 3.372 -9.269 3.307 1.00 43.22 H new ATOM 0 HZ PHE A 99 2.543 -11.550 3.704 1.00 11.42 H new ATOM 1462 N GLU A 100 2.811 -5.313 9.246 1.00 54.55 N ATOM 1463 CA GLU A 100 2.667 -4.106 10.069 1.00 12.51 C ATOM 1464 C GLU A 100 2.972 -2.826 9.255 1.00 44.15 C ATOM 1465 O GLU A 100 3.934 -2.784 8.491 1.00 52.32 O ATOM 1466 CB GLU A 100 3.611 -4.200 11.275 1.00 14.12 C ATOM 1467 CG GLU A 100 3.486 -3.058 12.274 1.00 74.40 C ATOM 1468 CD GLU A 100 4.459 -3.190 13.414 1.00 23.23 C ATOM 1469 OE1 GLU A 100 4.211 -3.992 14.338 1.00 2.31 O ATOM 1470 OE2 GLU A 100 5.512 -2.510 13.404 1.00 51.34 O ATOM 0 H GLU A 100 3.670 -5.343 8.697 1.00 54.55 H new ATOM 0 HA GLU A 100 1.634 -4.042 10.410 1.00 12.51 H new ATOM 0 HB2 GLU A 100 3.423 -5.140 11.794 1.00 14.12 H new ATOM 0 HB3 GLU A 100 4.638 -4.236 10.913 1.00 14.12 H new ATOM 0 HG2 GLU A 100 3.655 -2.110 11.763 1.00 74.40 H new ATOM 0 HG3 GLU A 100 2.470 -3.031 12.667 1.00 74.40 H new ATOM 1477 N VAL A 101 2.157 -1.806 9.400 1.00 3.41 N ATOM 1478 CA VAL A 101 2.414 -0.538 8.729 1.00 24.32 C ATOM 1479 C VAL A 101 2.703 0.555 9.763 1.00 31.24 C ATOM 1480 O VAL A 101 1.971 0.700 10.756 1.00 24.31 O ATOM 1481 CB VAL A 101 1.266 -0.112 7.746 1.00 33.32 C ATOM 1482 CG1 VAL A 101 -0.068 0.058 8.451 1.00 3.01 C ATOM 1483 CG2 VAL A 101 1.639 1.154 6.975 1.00 21.04 C ATOM 0 H VAL A 101 1.313 -1.822 9.972 1.00 3.41 H new ATOM 0 HA VAL A 101 3.296 -0.679 8.104 1.00 24.32 H new ATOM 0 HB VAL A 101 1.148 -0.927 7.032 1.00 33.32 H new ATOM 0 HG11 VAL A 101 -0.827 0.353 7.727 1.00 3.01 H new ATOM 0 HG12 VAL A 101 -0.357 -0.885 8.916 1.00 3.01 H new ATOM 0 HG13 VAL A 101 0.021 0.828 9.217 1.00 3.01 H new ATOM 0 HG21 VAL A 101 0.825 1.424 6.303 1.00 21.04 H new ATOM 0 HG22 VAL A 101 1.815 1.969 7.677 1.00 21.04 H new ATOM 0 HG23 VAL A 101 2.544 0.973 6.395 1.00 21.04 H new ATOM 1493 N VAL A 102 3.790 1.274 9.565 1.00 41.30 N ATOM 1494 CA VAL A 102 4.199 2.309 10.495 1.00 75.25 C ATOM 1495 C VAL A 102 4.234 3.685 9.818 1.00 33.32 C ATOM 1496 O VAL A 102 4.824 3.849 8.731 1.00 42.32 O ATOM 1497 CB VAL A 102 5.598 1.999 11.119 1.00 25.15 C ATOM 1498 CG1 VAL A 102 6.018 3.077 12.115 1.00 30.31 C ATOM 1499 CG2 VAL A 102 5.602 0.633 11.793 1.00 12.02 C ATOM 0 H VAL A 102 4.410 1.160 8.763 1.00 41.30 H new ATOM 0 HA VAL A 102 3.457 2.326 11.293 1.00 75.25 H new ATOM 0 HB VAL A 102 6.321 1.990 10.304 1.00 25.15 H new ATOM 0 HG11 VAL A 102 6.995 2.829 12.529 1.00 30.31 H new ATOM 0 HG12 VAL A 102 6.073 4.040 11.607 1.00 30.31 H new ATOM 0 HG13 VAL A 102 5.286 3.133 12.921 1.00 30.31 H new ATOM 0 HG21 VAL A 102 6.586 0.441 12.219 1.00 12.02 H new ATOM 0 HG22 VAL A 102 4.854 0.616 12.585 1.00 12.02 H new ATOM 0 HG23 VAL A 102 5.369 -0.136 11.057 1.00 12.02 H new ATOM 1509 N ASP A 103 3.586 4.642 10.442 1.00 4.31 N ATOM 1510 CA ASP A 103 3.615 6.027 10.020 1.00 62.22 C ATOM 1511 C ASP A 103 4.842 6.691 10.584 1.00 13.43 C ATOM 1512 O ASP A 103 5.045 6.740 11.794 1.00 43.53 O ATOM 1513 CB ASP A 103 2.354 6.790 10.479 1.00 14.33 C ATOM 1514 CG ASP A 103 2.463 8.315 10.318 1.00 61.40 C ATOM 1515 OD1 ASP A 103 2.487 8.822 9.173 1.00 53.04 O ATOM 1516 OD2 ASP A 103 2.494 9.033 11.339 1.00 3.44 O ATOM 0 H ASP A 103 3.014 4.479 11.271 1.00 4.31 H new ATOM 0 HA ASP A 103 3.639 6.051 8.931 1.00 62.22 H new ATOM 0 HB2 ASP A 103 1.496 6.433 9.908 1.00 14.33 H new ATOM 0 HB3 ASP A 103 2.160 6.557 11.526 1.00 14.33 H new ATOM 1521 N VAL A 104 5.678 7.136 9.720 1.00 64.24 N ATOM 1522 CA VAL A 104 6.863 7.872 10.090 1.00 11.20 C ATOM 1523 C VAL A 104 6.770 9.255 9.485 1.00 11.14 C ATOM 1524 O VAL A 104 7.707 10.056 9.531 1.00 14.23 O ATOM 1525 CB VAL A 104 8.181 7.156 9.650 1.00 22.41 C ATOM 1526 CG1 VAL A 104 8.388 5.878 10.447 1.00 44.12 C ATOM 1527 CG2 VAL A 104 8.158 6.833 8.163 1.00 73.24 C ATOM 0 H VAL A 104 5.570 7.005 8.714 1.00 64.24 H new ATOM 0 HA VAL A 104 6.909 7.934 11.177 1.00 11.20 H new ATOM 0 HB VAL A 104 9.009 7.838 9.846 1.00 22.41 H new ATOM 0 HG11 VAL A 104 9.311 5.394 10.126 1.00 44.12 H new ATOM 0 HG12 VAL A 104 8.454 6.118 11.508 1.00 44.12 H new ATOM 0 HG13 VAL A 104 7.548 5.204 10.279 1.00 44.12 H new ATOM 0 HG21 VAL A 104 9.087 6.335 7.884 1.00 73.24 H new ATOM 0 HG22 VAL A 104 7.315 6.176 7.946 1.00 73.24 H new ATOM 0 HG23 VAL A 104 8.055 7.756 7.592 1.00 73.24 H new ATOM 1537 N GLY A 105 5.617 9.530 8.930 1.00 63.34 N ATOM 1538 CA GLY A 105 5.381 10.779 8.333 1.00 3.45 C ATOM 1539 C GLY A 105 4.804 11.728 9.300 1.00 63.31 C ATOM 1540 O GLY A 105 5.427 12.743 9.629 1.00 25.14 O ATOM 0 H GLY A 105 4.830 8.883 8.890 1.00 63.34 H new ATOM 0 HA2 GLY A 105 6.315 11.179 7.939 1.00 3.45 H new ATOM 0 HA3 GLY A 105 4.703 10.659 7.488 1.00 3.45 H new ATOM 1544 N SER A 106 3.580 11.421 9.734 1.00 50.02 N ATOM 1545 CA SER A 106 2.815 12.231 10.689 1.00 43.01 C ATOM 1546 C SER A 106 2.551 13.681 10.160 1.00 55.20 C ATOM 1547 O SER A 106 1.928 14.501 10.836 1.00 44.10 O ATOM 1548 CB SER A 106 3.550 12.252 12.040 1.00 62.41 C ATOM 1549 OG SER A 106 3.891 10.923 12.455 1.00 42.21 O ATOM 0 H SER A 106 3.081 10.586 9.426 1.00 50.02 H new ATOM 0 HA SER A 106 1.834 11.773 10.819 1.00 43.01 H new ATOM 0 HB2 SER A 106 4.454 12.855 11.958 1.00 62.41 H new ATOM 0 HB3 SER A 106 2.920 12.723 12.795 1.00 62.41 H new ATOM 0 HG SER A 106 3.308 10.279 12.001 1.00 42.21 H new ATOM 1555 N LEU A 107 3.014 13.961 8.945 1.00 31.43 N ATOM 1556 CA LEU A 107 2.903 15.262 8.312 1.00 32.42 C ATOM 1557 C LEU A 107 1.468 15.501 7.886 1.00 0.54 C ATOM 1558 O LEU A 107 0.877 16.542 8.176 1.00 64.31 O ATOM 1559 CB LEU A 107 3.837 15.305 7.091 1.00 54.44 C ATOM 1560 CG LEU A 107 3.918 16.630 6.333 1.00 70.31 C ATOM 1561 CD1 LEU A 107 4.541 17.715 7.198 1.00 54.44 C ATOM 1562 CD2 LEU A 107 4.695 16.461 5.036 1.00 23.04 C ATOM 0 H LEU A 107 3.487 13.270 8.363 1.00 31.43 H new ATOM 0 HA LEU A 107 3.192 16.044 9.014 1.00 32.42 H new ATOM 0 HB2 LEU A 107 4.841 15.041 7.422 1.00 54.44 H new ATOM 0 HB3 LEU A 107 3.518 14.532 6.392 1.00 54.44 H new ATOM 0 HG LEU A 107 2.903 16.940 6.085 1.00 70.31 H new ATOM 0 HD11 LEU A 107 4.587 18.647 6.635 1.00 54.44 H new ATOM 0 HD12 LEU A 107 3.935 17.860 8.092 1.00 54.44 H new ATOM 0 HD13 LEU A 107 5.548 17.416 7.487 1.00 54.44 H new ATOM 0 HD21 LEU A 107 4.741 17.416 4.512 1.00 23.04 H new ATOM 0 HD22 LEU A 107 5.706 16.121 5.259 1.00 23.04 H new ATOM 0 HD23 LEU A 107 4.196 15.725 4.406 1.00 23.04 H new ATOM 1574 N ASN A 108 0.929 14.537 7.186 1.00 64.12 N ATOM 1575 CA ASN A 108 -0.459 14.568 6.748 1.00 44.10 C ATOM 1576 C ASN A 108 -1.295 13.735 7.679 1.00 13.33 C ATOM 1577 O ASN A 108 -2.440 14.063 7.981 1.00 64.23 O ATOM 1578 CB ASN A 108 -0.583 14.028 5.320 1.00 24.41 C ATOM 1579 CG ASN A 108 0.000 14.956 4.277 1.00 33.00 C ATOM 1580 OD1 ASN A 108 1.201 14.921 3.993 1.00 52.12 O ATOM 1581 ND2 ASN A 108 -0.843 15.747 3.670 1.00 14.24 N ATOM 0 H ASN A 108 1.436 13.700 6.898 1.00 64.12 H new ATOM 0 HA ASN A 108 -0.811 15.600 6.761 1.00 44.10 H new ATOM 0 HB2 ASN A 108 -0.081 13.063 5.259 1.00 24.41 H new ATOM 0 HB3 ASN A 108 -1.635 13.854 5.095 1.00 24.41 H new ATOM 0 HD21 ASN A 108 -0.517 16.368 2.929 1.00 14.24 H new ATOM 0 HD22 ASN A 108 -1.828 15.744 3.936 1.00 14.24 H new ATOM 1588 N GLY A 109 -0.704 12.664 8.148 1.00 0.42 N ATOM 1589 CA GLY A 109 -1.391 11.772 9.024 1.00 33.32 C ATOM 1590 C GLY A 109 -1.809 10.532 8.292 1.00 4.33 C ATOM 1591 O GLY A 109 -2.308 10.606 7.162 1.00 14.13 O ATOM 0 H GLY A 109 0.256 12.395 7.932 1.00 0.42 H new ATOM 0 HA2 GLY A 109 -0.745 11.507 9.861 1.00 33.32 H new ATOM 0 HA3 GLY A 109 -2.268 12.267 9.442 1.00 33.32 H new ATOM 1595 N THR A 110 -1.574 9.418 8.880 1.00 15.34 N ATOM 1596 CA THR A 110 -1.952 8.180 8.303 1.00 75.10 C ATOM 1597 C THR A 110 -3.223 7.685 8.987 1.00 64.24 C ATOM 1598 O THR A 110 -3.263 7.495 10.216 1.00 64.01 O ATOM 1599 CB THR A 110 -0.788 7.177 8.424 1.00 1.42 C ATOM 1600 OG1 THR A 110 0.354 7.716 7.703 1.00 35.24 O ATOM 1601 CG2 THR A 110 -1.167 5.812 7.849 1.00 11.43 C ATOM 0 H THR A 110 -1.109 9.338 9.784 1.00 15.34 H new ATOM 0 HA THR A 110 -2.167 8.296 7.241 1.00 75.10 H new ATOM 0 HB THR A 110 -0.547 7.034 9.477 1.00 1.42 H new ATOM 0 HG1 THR A 110 0.965 8.150 8.335 1.00 35.24 H new ATOM 0 HG21 THR A 110 -0.324 5.128 7.950 1.00 11.43 H new ATOM 0 HG22 THR A 110 -2.024 5.414 8.392 1.00 11.43 H new ATOM 0 HG23 THR A 110 -1.423 5.920 6.795 1.00 11.43 H new ATOM 1609 N TYR A 111 -4.266 7.523 8.207 1.00 73.25 N ATOM 1610 CA TYR A 111 -5.531 7.121 8.732 1.00 72.33 C ATOM 1611 C TYR A 111 -5.779 5.728 8.227 1.00 73.51 C ATOM 1612 O TYR A 111 -5.583 5.451 7.059 1.00 24.21 O ATOM 1613 CB TYR A 111 -6.642 8.050 8.195 1.00 30.05 C ATOM 1614 CG TYR A 111 -6.227 9.510 8.005 1.00 63.12 C ATOM 1615 CD1 TYR A 111 -6.021 10.363 9.083 1.00 72.45 C ATOM 1616 CD2 TYR A 111 -6.044 10.023 6.727 1.00 13.00 C ATOM 1617 CE1 TYR A 111 -5.641 11.688 8.888 1.00 23.54 C ATOM 1618 CE2 TYR A 111 -5.668 11.335 6.527 1.00 62.11 C ATOM 1619 CZ TYR A 111 -5.466 12.165 7.601 1.00 3.45 C ATOM 1620 OH TYR A 111 -5.087 13.485 7.385 1.00 20.25 O ATOM 0 H TYR A 111 -4.253 7.667 7.197 1.00 73.25 H new ATOM 0 HA TYR A 111 -5.533 7.167 9.821 1.00 72.33 H new ATOM 0 HB2 TYR A 111 -6.991 7.660 7.239 1.00 30.05 H new ATOM 0 HB3 TYR A 111 -7.488 8.015 8.882 1.00 30.05 H new ATOM 0 HD1 TYR A 111 -6.158 9.992 10.088 1.00 72.45 H new ATOM 0 HD2 TYR A 111 -6.199 9.381 5.872 1.00 13.00 H new ATOM 0 HE1 TYR A 111 -5.484 12.339 9.735 1.00 23.54 H new ATOM 0 HE2 TYR A 111 -5.532 11.710 5.523 1.00 62.11 H new ATOM 0 HH TYR A 111 -4.139 13.593 7.607 1.00 20.25 H new ATOM 1630 N VAL A 112 -6.165 4.856 9.069 1.00 31.32 N ATOM 1631 CA VAL A 112 -6.438 3.528 8.641 1.00 63.12 C ATOM 1632 C VAL A 112 -7.774 3.063 9.165 1.00 61.34 C ATOM 1633 O VAL A 112 -8.080 3.252 10.359 1.00 22.43 O ATOM 1634 CB VAL A 112 -5.271 2.566 8.960 1.00 73.14 C ATOM 1635 CG1 VAL A 112 -4.942 2.573 10.426 1.00 61.14 C ATOM 1636 CG2 VAL A 112 -5.555 1.163 8.460 1.00 43.02 C ATOM 0 H VAL A 112 -6.303 5.029 10.065 1.00 31.32 H new ATOM 0 HA VAL A 112 -6.516 3.524 7.554 1.00 63.12 H new ATOM 0 HB VAL A 112 -4.392 2.928 8.426 1.00 73.14 H new ATOM 0 HG11 VAL A 112 -4.117 1.886 10.617 1.00 61.14 H new ATOM 0 HG12 VAL A 112 -4.654 3.579 10.729 1.00 61.14 H new ATOM 0 HG13 VAL A 112 -5.816 2.258 10.997 1.00 61.14 H new ATOM 0 HG21 VAL A 112 -4.714 0.513 8.701 1.00 43.02 H new ATOM 0 HG22 VAL A 112 -6.457 0.782 8.939 1.00 43.02 H new ATOM 0 HG23 VAL A 112 -5.699 1.184 7.380 1.00 43.02 H new ATOM 1646 N ASN A 113 -8.572 2.500 8.271 1.00 73.01 N ATOM 1647 CA ASN A 113 -9.931 2.014 8.529 1.00 52.25 C ATOM 1648 C ASN A 113 -10.864 3.166 8.852 1.00 71.12 C ATOM 1649 O ASN A 113 -11.697 3.554 8.031 1.00 1.44 O ATOM 1650 CB ASN A 113 -9.970 0.950 9.644 1.00 43.42 C ATOM 1651 CG ASN A 113 -11.351 0.352 9.840 1.00 13.15 C ATOM 1652 OD1 ASN A 113 -12.169 0.851 10.617 1.00 42.53 O ATOM 1653 ND2 ASN A 113 -11.610 -0.716 9.160 1.00 64.02 N ATOM 0 H ASN A 113 -8.284 2.360 7.303 1.00 73.01 H new ATOM 0 HA ASN A 113 -10.276 1.532 7.614 1.00 52.25 H new ATOM 0 HB2 ASN A 113 -9.265 0.154 9.405 1.00 43.42 H new ATOM 0 HB3 ASN A 113 -9.638 1.399 10.580 1.00 43.42 H new ATOM 0 HD21 ASN A 113 -12.516 -1.175 9.256 1.00 64.02 H new ATOM 0 HD22 ASN A 113 -10.909 -1.100 8.527 1.00 64.02 H new ATOM 1660 N ARG A 114 -10.701 3.723 10.029 1.00 61.11 N ATOM 1661 CA ARG A 114 -11.501 4.831 10.482 1.00 1.21 C ATOM 1662 C ARG A 114 -10.710 5.642 11.536 1.00 53.34 C ATOM 1663 O ARG A 114 -11.223 6.599 12.113 1.00 12.00 O ATOM 1664 CB ARG A 114 -12.795 4.282 11.117 1.00 61.11 C ATOM 1665 CG ARG A 114 -13.912 5.298 11.301 1.00 53.30 C ATOM 1666 CD ARG A 114 -14.444 5.769 9.958 1.00 23.01 C ATOM 1667 NE ARG A 114 -15.562 6.700 10.104 1.00 3.21 N ATOM 1668 CZ ARG A 114 -16.772 6.528 9.561 1.00 11.23 C ATOM 1669 NH1 ARG A 114 -17.021 5.466 8.797 1.00 34.44 N ATOM 1670 NH2 ARG A 114 -17.724 7.423 9.775 1.00 30.14 N ATOM 0 H ARG A 114 -10.001 3.415 10.704 1.00 61.11 H new ATOM 0 HA ARG A 114 -11.747 5.480 9.642 1.00 1.21 H new ATOM 0 HB2 ARG A 114 -13.167 3.467 10.496 1.00 61.11 H new ATOM 0 HB3 ARG A 114 -12.550 3.856 12.090 1.00 61.11 H new ATOM 0 HG2 ARG A 114 -14.721 4.854 11.881 1.00 53.30 H new ATOM 0 HG3 ARG A 114 -13.543 6.151 11.870 1.00 53.30 H new ATOM 0 HD2 ARG A 114 -13.642 6.252 9.400 1.00 23.01 H new ATOM 0 HD3 ARG A 114 -14.765 4.907 9.373 1.00 23.01 H new ATOM 0 HE ARG A 114 -15.408 7.541 10.660 1.00 3.21 H new ATOM 0 HH11 ARG A 114 -16.287 4.779 8.624 1.00 34.44 H new ATOM 0 HH12 ARG A 114 -17.946 5.339 8.385 1.00 34.44 H new ATOM 0 HH21 ARG A 114 -17.534 8.242 10.353 1.00 30.14 H new ATOM 0 HH22 ARG A 114 -18.648 7.294 9.362 1.00 30.14 H new ATOM 1684 N GLU A 115 -9.457 5.276 11.785 1.00 12.35 N ATOM 1685 CA GLU A 115 -8.704 5.920 12.846 1.00 53.42 C ATOM 1686 C GLU A 115 -7.312 6.328 12.404 1.00 12.45 C ATOM 1687 O GLU A 115 -6.617 5.556 11.732 1.00 44.31 O ATOM 1688 CB GLU A 115 -8.560 5.008 14.061 1.00 64.40 C ATOM 1689 CG GLU A 115 -9.855 4.604 14.725 1.00 3.20 C ATOM 1690 CD GLU A 115 -9.602 3.849 15.991 1.00 5.11 C ATOM 1691 OE1 GLU A 115 -9.431 2.625 15.934 1.00 64.10 O ATOM 1692 OE2 GLU A 115 -9.540 4.475 17.076 1.00 12.10 O ATOM 0 H GLU A 115 -8.952 4.551 11.276 1.00 12.35 H new ATOM 0 HA GLU A 115 -9.274 6.812 13.107 1.00 53.42 H new ATOM 0 HB2 GLU A 115 -8.031 4.105 13.756 1.00 64.40 H new ATOM 0 HB3 GLU A 115 -7.934 5.510 14.799 1.00 64.40 H new ATOM 0 HG2 GLU A 115 -10.448 5.492 14.941 1.00 3.20 H new ATOM 0 HG3 GLU A 115 -10.440 3.988 14.042 1.00 3.20 H new ATOM 1699 N PRO A 116 -6.890 7.549 12.739 1.00 33.11 N ATOM 1700 CA PRO A 116 -5.516 7.971 12.557 1.00 34.44 C ATOM 1701 C PRO A 116 -4.666 7.363 13.669 1.00 35.51 C ATOM 1702 O PRO A 116 -4.883 7.649 14.849 1.00 3.22 O ATOM 1703 CB PRO A 116 -5.562 9.504 12.712 1.00 52.24 C ATOM 1704 CG PRO A 116 -7.008 9.864 12.825 1.00 21.54 C ATOM 1705 CD PRO A 116 -7.717 8.632 13.295 1.00 10.45 C ATOM 0 HA PRO A 116 -5.094 7.665 11.600 1.00 34.44 H new ATOM 0 HB2 PRO A 116 -5.010 9.823 13.596 1.00 52.24 H new ATOM 0 HB3 PRO A 116 -5.103 9.997 11.855 1.00 52.24 H new ATOM 0 HG2 PRO A 116 -7.150 10.685 13.528 1.00 21.54 H new ATOM 0 HG3 PRO A 116 -7.402 10.195 11.864 1.00 21.54 H new ATOM 0 HD2 PRO A 116 -7.768 8.585 14.383 1.00 10.45 H new ATOM 0 HD3 PRO A 116 -8.742 8.589 12.926 1.00 10.45 H new ATOM 1713 N ARG A 117 -3.745 6.515 13.311 1.00 42.41 N ATOM 1714 CA ARG A 117 -2.907 5.852 14.285 1.00 11.45 C ATOM 1715 C ARG A 117 -1.521 5.704 13.691 1.00 42.50 C ATOM 1716 O ARG A 117 -1.386 5.616 12.470 1.00 3.21 O ATOM 1717 CB ARG A 117 -3.502 4.481 14.695 1.00 74.24 C ATOM 1718 CG ARG A 117 -3.588 3.479 13.559 1.00 72.14 C ATOM 1719 CD ARG A 117 -4.227 2.158 13.978 1.00 23.12 C ATOM 1720 NE ARG A 117 -5.686 2.252 14.259 1.00 11.31 N ATOM 1721 CZ ARG A 117 -6.619 1.405 13.742 1.00 62.11 C ATOM 1722 NH1 ARG A 117 -6.274 0.524 12.814 1.00 3.22 N ATOM 1723 NH2 ARG A 117 -7.883 1.442 14.150 1.00 4.14 N ATOM 0 H ARG A 117 -3.549 6.260 12.343 1.00 42.41 H new ATOM 0 HA ARG A 117 -2.852 6.448 15.196 1.00 11.45 H new ATOM 0 HB2 ARG A 117 -2.894 4.057 15.494 1.00 74.24 H new ATOM 0 HB3 ARG A 117 -4.500 4.638 15.104 1.00 74.24 H new ATOM 0 HG2 ARG A 117 -4.165 3.913 12.742 1.00 72.14 H new ATOM 0 HG3 ARG A 117 -2.586 3.286 13.175 1.00 72.14 H new ATOM 0 HD2 ARG A 117 -4.066 1.423 13.190 1.00 23.12 H new ATOM 0 HD3 ARG A 117 -3.719 1.787 14.868 1.00 23.12 H new ATOM 0 HE ARG A 117 -6.007 2.997 14.877 1.00 11.31 H new ATOM 0 HH11 ARG A 117 -5.309 0.480 12.486 1.00 3.22 H new ATOM 0 HH12 ARG A 117 -6.973 -0.110 12.427 1.00 3.22 H new ATOM 0 HH21 ARG A 117 -8.169 2.113 14.863 1.00 4.14 H new ATOM 0 HH22 ARG A 117 -8.567 0.799 13.751 1.00 4.14 H new ATOM 1737 N ASN A 118 -0.516 5.680 14.530 1.00 22.43 N ATOM 1738 CA ASN A 118 0.869 5.652 14.069 1.00 74.35 C ATOM 1739 C ASN A 118 1.289 4.274 13.561 1.00 62.25 C ATOM 1740 O ASN A 118 1.955 4.151 12.544 1.00 40.52 O ATOM 1741 CB ASN A 118 1.803 6.128 15.181 1.00 51.14 C ATOM 1742 CG ASN A 118 3.239 6.246 14.734 1.00 73.32 C ATOM 1743 OD1 ASN A 118 4.027 5.305 14.859 1.00 41.41 O ATOM 1744 ND2 ASN A 118 3.590 7.392 14.217 1.00 24.03 N ATOM 0 H ASN A 118 -0.622 5.679 15.544 1.00 22.43 H new ATOM 0 HA ASN A 118 0.944 6.333 13.221 1.00 74.35 H new ATOM 0 HB2 ASN A 118 1.461 7.097 15.546 1.00 51.14 H new ATOM 0 HB3 ASN A 118 1.745 5.433 16.019 1.00 51.14 H new ATOM 0 HD21 ASN A 118 4.548 7.535 13.898 1.00 24.03 H new ATOM 0 HD22 ASN A 118 2.906 8.144 14.132 1.00 24.03 H new ATOM 1751 N ALA A 119 0.904 3.249 14.253 1.00 33.31 N ATOM 1752 CA ALA A 119 1.243 1.913 13.834 1.00 75.15 C ATOM 1753 C ALA A 119 -0.006 1.094 13.731 1.00 23.40 C ATOM 1754 O ALA A 119 -0.916 1.226 14.566 1.00 75.54 O ATOM 1755 CB ALA A 119 2.227 1.275 14.796 1.00 3.24 C ATOM 0 H ALA A 119 0.355 3.304 15.111 1.00 33.31 H new ATOM 0 HA ALA A 119 1.723 1.959 12.857 1.00 75.15 H new ATOM 0 HB1 ALA A 119 2.466 0.267 14.457 1.00 3.24 H new ATOM 0 HB2 ALA A 119 3.139 1.871 14.833 1.00 3.24 H new ATOM 0 HB3 ALA A 119 1.784 1.227 15.791 1.00 3.24 H new ATOM 1761 N GLN A 120 -0.075 0.272 12.733 1.00 64.01 N ATOM 1762 CA GLN A 120 -1.230 -0.536 12.510 1.00 55.31 C ATOM 1763 C GLN A 120 -0.826 -1.941 12.089 1.00 65.34 C ATOM 1764 O GLN A 120 0.221 -2.134 11.462 1.00 12.04 O ATOM 1765 CB GLN A 120 -2.186 0.153 11.500 1.00 71.42 C ATOM 1766 CG GLN A 120 -3.484 -0.598 11.259 1.00 41.24 C ATOM 1767 CD GLN A 120 -3.461 -1.495 10.051 1.00 21.30 C ATOM 1768 OE1 GLN A 120 -2.424 -1.940 9.595 1.00 64.32 O ATOM 1769 NE2 GLN A 120 -4.595 -1.838 9.584 1.00 21.42 N ATOM 0 H GLN A 120 0.670 0.142 12.048 1.00 64.01 H new ATOM 0 HA GLN A 120 -1.785 -0.641 13.442 1.00 55.31 H new ATOM 0 HB2 GLN A 120 -2.420 1.154 11.863 1.00 71.42 H new ATOM 0 HB3 GLN A 120 -1.667 0.273 10.549 1.00 71.42 H new ATOM 0 HG2 GLN A 120 -3.712 -1.198 12.140 1.00 41.24 H new ATOM 0 HG3 GLN A 120 -4.293 0.124 11.147 1.00 41.24 H new ATOM 0 HE21 GLN A 120 -5.450 -1.451 9.984 1.00 21.42 H new ATOM 0 HE22 GLN A 120 -4.649 -2.500 8.810 1.00 21.42 H new ATOM 1778 N VAL A 121 -1.653 -2.904 12.436 1.00 61.24 N ATOM 1779 CA VAL A 121 -1.414 -4.283 12.119 1.00 75.32 C ATOM 1780 C VAL A 121 -2.345 -4.608 10.987 1.00 42.34 C ATOM 1781 O VAL A 121 -3.578 -4.499 11.139 1.00 61.35 O ATOM 1782 CB VAL A 121 -1.686 -5.216 13.322 1.00 53.35 C ATOM 1783 CG1 VAL A 121 -1.442 -6.660 12.933 1.00 34.25 C ATOM 1784 CG2 VAL A 121 -0.805 -4.838 14.507 1.00 24.33 C ATOM 0 H VAL A 121 -2.518 -2.742 12.952 1.00 61.24 H new ATOM 0 HA VAL A 121 -0.368 -4.436 11.853 1.00 75.32 H new ATOM 0 HB VAL A 121 -2.729 -5.100 13.615 1.00 53.35 H new ATOM 0 HG11 VAL A 121 -1.637 -7.305 13.789 1.00 34.25 H new ATOM 0 HG12 VAL A 121 -2.107 -6.933 12.114 1.00 34.25 H new ATOM 0 HG13 VAL A 121 -0.406 -6.781 12.616 1.00 34.25 H new ATOM 0 HG21 VAL A 121 -1.012 -5.507 15.342 1.00 24.33 H new ATOM 0 HG22 VAL A 121 0.244 -4.926 14.223 1.00 24.33 H new ATOM 0 HG23 VAL A 121 -1.016 -3.811 14.804 1.00 24.33 H new ATOM 1794 N MET A 122 -1.769 -4.959 9.866 1.00 15.30 N ATOM 1795 CA MET A 122 -2.496 -5.085 8.623 1.00 30.31 C ATOM 1796 C MET A 122 -3.607 -6.101 8.667 1.00 31.44 C ATOM 1797 O MET A 122 -3.422 -7.257 9.081 1.00 34.33 O ATOM 1798 CB MET A 122 -1.563 -5.356 7.464 1.00 14.05 C ATOM 1799 CG MET A 122 -0.576 -4.241 7.192 1.00 65.12 C ATOM 1800 SD MET A 122 0.533 -4.640 5.839 1.00 14.32 S ATOM 1801 CE MET A 122 1.564 -3.205 5.820 1.00 1.22 C ATOM 0 H MET A 122 -0.774 -5.168 9.787 1.00 15.30 H new ATOM 0 HA MET A 122 -2.977 -4.119 8.468 1.00 30.31 H new ATOM 0 HB2 MET A 122 -1.011 -6.275 7.663 1.00 14.05 H new ATOM 0 HB3 MET A 122 -2.157 -5.528 6.566 1.00 14.05 H new ATOM 0 HG2 MET A 122 -1.119 -3.325 6.958 1.00 65.12 H new ATOM 0 HG3 MET A 122 0.006 -4.045 8.092 1.00 65.12 H new ATOM 0 HE1 MET A 122 2.421 -3.381 5.170 1.00 1.22 H new ATOM 0 HE2 MET A 122 0.995 -2.353 5.447 1.00 1.22 H new ATOM 0 HE3 MET A 122 1.913 -2.994 6.831 1.00 1.22 H new ATOM 1811 N GLN A 123 -4.759 -5.650 8.253 1.00 41.14 N ATOM 1812 CA GLN A 123 -5.922 -6.458 8.178 1.00 64.41 C ATOM 1813 C GLN A 123 -6.250 -6.627 6.717 1.00 74.33 C ATOM 1814 O GLN A 123 -6.150 -5.669 5.949 1.00 33.05 O ATOM 1815 CB GLN A 123 -7.085 -5.785 8.904 1.00 51.52 C ATOM 1816 CG GLN A 123 -8.355 -6.622 8.946 1.00 73.43 C ATOM 1817 CD GLN A 123 -9.506 -5.903 9.601 1.00 41.21 C ATOM 1818 OE1 GLN A 123 -9.691 -5.973 10.808 1.00 12.54 O ATOM 1819 NE2 GLN A 123 -10.308 -5.242 8.812 1.00 54.11 N ATOM 0 H GLN A 123 -4.908 -4.686 7.954 1.00 41.14 H new ATOM 0 HA GLN A 123 -5.751 -7.424 8.653 1.00 64.41 H new ATOM 0 HB2 GLN A 123 -6.779 -5.556 9.925 1.00 51.52 H new ATOM 0 HB3 GLN A 123 -7.304 -4.835 8.416 1.00 51.52 H new ATOM 0 HG2 GLN A 123 -8.636 -6.899 7.930 1.00 73.43 H new ATOM 0 HG3 GLN A 123 -8.157 -7.548 9.485 1.00 73.43 H new ATOM 0 HE21 GLN A 123 -10.122 -5.206 7.810 1.00 54.11 H new ATOM 0 HE22 GLN A 123 -11.121 -4.762 9.197 1.00 54.11 H new ATOM 1828 N THR A 124 -6.609 -7.805 6.327 1.00 41.02 N ATOM 1829 CA THR A 124 -6.934 -8.054 4.960 1.00 60.42 C ATOM 1830 C THR A 124 -8.349 -7.574 4.642 1.00 33.43 C ATOM 1831 O THR A 124 -9.299 -7.836 5.386 1.00 51.41 O ATOM 1832 CB THR A 124 -6.697 -9.538 4.557 1.00 14.41 C ATOM 1833 OG1 THR A 124 -7.248 -9.829 3.267 1.00 54.13 O ATOM 1834 CG2 THR A 124 -7.212 -10.515 5.596 1.00 31.21 C ATOM 0 H THR A 124 -6.685 -8.617 6.940 1.00 41.02 H new ATOM 0 HA THR A 124 -6.249 -7.471 4.345 1.00 60.42 H new ATOM 0 HB THR A 124 -5.616 -9.669 4.503 1.00 14.41 H new ATOM 0 HG1 THR A 124 -8.017 -10.428 3.367 1.00 54.13 H new ATOM 0 HG21 THR A 124 -7.020 -11.535 5.263 1.00 31.21 H new ATOM 0 HG22 THR A 124 -6.702 -10.341 6.544 1.00 31.21 H new ATOM 0 HG23 THR A 124 -8.284 -10.372 5.729 1.00 31.21 H new ATOM 1842 N GLY A 125 -8.452 -6.810 3.578 1.00 54.52 N ATOM 1843 CA GLY A 125 -9.701 -6.259 3.172 1.00 71.11 C ATOM 1844 C GLY A 125 -9.976 -5.000 3.931 1.00 11.11 C ATOM 1845 O GLY A 125 -11.109 -4.737 4.315 1.00 40.23 O ATOM 0 H GLY A 125 -7.666 -6.560 2.978 1.00 54.52 H new ATOM 0 HA2 GLY A 125 -9.686 -6.052 2.102 1.00 71.11 H new ATOM 0 HA3 GLY A 125 -10.500 -6.980 3.346 1.00 71.11 H new ATOM 1849 N ASP A 126 -8.940 -4.217 4.163 1.00 0.44 N ATOM 1850 CA ASP A 126 -9.089 -3.002 4.941 1.00 1.53 C ATOM 1851 C ASP A 126 -8.573 -1.786 4.164 1.00 61.52 C ATOM 1852 O ASP A 126 -7.852 -1.944 3.166 1.00 54.42 O ATOM 1853 CB ASP A 126 -8.407 -3.144 6.315 1.00 73.35 C ATOM 1854 CG ASP A 126 -8.779 -2.030 7.261 1.00 21.23 C ATOM 1855 OD1 ASP A 126 -9.984 -1.690 7.326 1.00 70.21 O ATOM 1856 OD2 ASP A 126 -7.914 -1.501 7.953 1.00 45.41 O ATOM 0 H ASP A 126 -7.994 -4.398 3.827 1.00 0.44 H new ATOM 0 HA ASP A 126 -10.151 -2.838 5.123 1.00 1.53 H new ATOM 0 HB2 ASP A 126 -8.685 -4.101 6.758 1.00 73.35 H new ATOM 0 HB3 ASP A 126 -7.325 -3.157 6.181 1.00 73.35 H new ATOM 1861 N GLU A 127 -8.898 -0.601 4.649 1.00 63.13 N ATOM 1862 CA GLU A 127 -8.632 0.651 3.953 1.00 10.15 C ATOM 1863 C GLU A 127 -7.485 1.391 4.664 1.00 32.43 C ATOM 1864 O GLU A 127 -7.594 1.731 5.843 1.00 1.34 O ATOM 1865 CB GLU A 127 -9.921 1.490 4.083 1.00 11.20 C ATOM 1866 CG GLU A 127 -9.983 2.825 3.346 1.00 55.45 C ATOM 1867 CD GLU A 127 -10.257 2.702 1.863 1.00 50.34 C ATOM 1868 OE1 GLU A 127 -11.134 1.901 1.466 1.00 65.15 O ATOM 1869 OE2 GLU A 127 -9.684 3.480 1.086 1.00 75.03 O ATOM 0 H GLU A 127 -9.361 -0.477 5.550 1.00 63.13 H new ATOM 0 HA GLU A 127 -8.355 0.483 2.912 1.00 10.15 H new ATOM 0 HB2 GLU A 127 -10.754 0.878 3.737 1.00 11.20 H new ATOM 0 HB3 GLU A 127 -10.087 1.685 5.142 1.00 11.20 H new ATOM 0 HG2 GLU A 127 -10.760 3.441 3.798 1.00 55.45 H new ATOM 0 HG3 GLU A 127 -9.038 3.350 3.487 1.00 55.45 H new ATOM 1876 N ILE A 128 -6.411 1.649 3.951 1.00 25.44 N ATOM 1877 CA ILE A 128 -5.263 2.360 4.493 1.00 43.32 C ATOM 1878 C ILE A 128 -5.134 3.682 3.749 1.00 72.02 C ATOM 1879 O ILE A 128 -4.943 3.706 2.533 1.00 23.42 O ATOM 1880 CB ILE A 128 -3.941 1.542 4.334 1.00 1.45 C ATOM 1881 CG1 ILE A 128 -4.071 0.162 5.013 1.00 64.11 C ATOM 1882 CG2 ILE A 128 -2.754 2.320 4.918 1.00 33.51 C ATOM 1883 CD1 ILE A 128 -2.842 -0.722 4.883 1.00 44.43 C ATOM 0 H ILE A 128 -6.304 1.373 2.975 1.00 25.44 H new ATOM 0 HA ILE A 128 -5.420 2.519 5.560 1.00 43.32 H new ATOM 0 HB ILE A 128 -3.760 1.385 3.271 1.00 1.45 H new ATOM 0 HG12 ILE A 128 -4.286 0.311 6.071 1.00 64.11 H new ATOM 0 HG13 ILE A 128 -4.926 -0.361 4.584 1.00 64.11 H new ATOM 0 HG21 ILE A 128 -1.842 1.735 4.799 1.00 33.51 H new ATOM 0 HG22 ILE A 128 -2.648 3.270 4.393 1.00 33.51 H new ATOM 0 HG23 ILE A 128 -2.928 2.508 5.977 1.00 33.51 H new ATOM 0 HD11 ILE A 128 -3.021 -1.671 5.389 1.00 44.43 H new ATOM 0 HD12 ILE A 128 -2.636 -0.906 3.829 1.00 44.43 H new ATOM 0 HD13 ILE A 128 -1.986 -0.224 5.339 1.00 44.43 H new ATOM 1895 N GLN A 129 -5.261 4.768 4.454 1.00 41.13 N ATOM 1896 CA GLN A 129 -5.250 6.062 3.830 1.00 12.15 C ATOM 1897 C GLN A 129 -4.045 6.862 4.320 1.00 60.11 C ATOM 1898 O GLN A 129 -3.972 7.259 5.483 1.00 54.24 O ATOM 1899 CB GLN A 129 -6.550 6.798 4.182 1.00 24.42 C ATOM 1900 CG GLN A 129 -7.807 5.948 3.979 1.00 62.45 C ATOM 1901 CD GLN A 129 -9.083 6.652 4.385 1.00 70.23 C ATOM 1902 OE1 GLN A 129 -9.087 7.501 5.265 1.00 51.12 O ATOM 1903 NE2 GLN A 129 -10.179 6.273 3.780 1.00 73.21 N ATOM 0 H GLN A 129 -5.374 4.785 5.468 1.00 41.13 H new ATOM 0 HA GLN A 129 -5.178 5.949 2.748 1.00 12.15 H new ATOM 0 HB2 GLN A 129 -6.504 7.123 5.222 1.00 24.42 H new ATOM 0 HB3 GLN A 129 -6.626 7.697 3.570 1.00 24.42 H new ATOM 0 HG2 GLN A 129 -7.877 5.662 2.930 1.00 62.45 H new ATOM 0 HG3 GLN A 129 -7.710 5.027 4.554 1.00 62.45 H new ATOM 0 HE21 GLN A 129 -10.139 5.562 3.050 1.00 73.21 H new ATOM 0 HE22 GLN A 129 -11.074 6.689 4.038 1.00 73.21 H new ATOM 1912 N ILE A 130 -3.112 7.104 3.450 1.00 0.23 N ATOM 1913 CA ILE A 130 -1.947 7.868 3.813 1.00 4.23 C ATOM 1914 C ILE A 130 -2.093 9.286 3.294 1.00 74.24 C ATOM 1915 O ILE A 130 -1.892 9.570 2.108 1.00 73.42 O ATOM 1916 CB ILE A 130 -0.597 7.197 3.369 1.00 54.22 C ATOM 1917 CG1 ILE A 130 -0.558 6.891 1.858 1.00 71.33 C ATOM 1918 CG2 ILE A 130 -0.354 5.930 4.177 1.00 13.21 C ATOM 1919 CD1 ILE A 130 0.743 6.265 1.374 1.00 65.03 C ATOM 0 H ILE A 130 -3.130 6.785 2.481 1.00 0.23 H new ATOM 0 HA ILE A 130 -1.889 7.896 4.901 1.00 4.23 H new ATOM 0 HB ILE A 130 0.202 7.912 3.566 1.00 54.22 H new ATOM 0 HG12 ILE A 130 -1.382 6.220 1.615 1.00 71.33 H new ATOM 0 HG13 ILE A 130 -0.728 7.817 1.308 1.00 71.33 H new ATOM 0 HG21 ILE A 130 0.584 5.472 3.862 1.00 13.21 H new ATOM 0 HG22 ILE A 130 -0.298 6.179 5.237 1.00 13.21 H new ATOM 0 HG23 ILE A 130 -1.173 5.230 4.011 1.00 13.21 H new ATOM 0 HD11 ILE A 130 0.682 6.084 0.301 1.00 65.03 H new ATOM 0 HD12 ILE A 130 1.572 6.942 1.582 1.00 65.03 H new ATOM 0 HD13 ILE A 130 0.907 5.321 1.893 1.00 65.03 H new ATOM 1931 N GLY A 131 -2.513 10.164 4.177 1.00 63.32 N ATOM 1932 CA GLY A 131 -2.785 11.521 3.797 1.00 61.43 C ATOM 1933 C GLY A 131 -4.025 11.588 2.936 1.00 3.40 C ATOM 1934 O GLY A 131 -5.145 11.519 3.439 1.00 33.43 O ATOM 0 H GLY A 131 -2.672 9.957 5.163 1.00 63.32 H new ATOM 0 HA2 GLY A 131 -2.919 12.135 4.688 1.00 61.43 H new ATOM 0 HA3 GLY A 131 -1.934 11.931 3.253 1.00 61.43 H new ATOM 1938 N LYS A 132 -3.830 11.683 1.646 1.00 24.44 N ATOM 1939 CA LYS A 132 -4.942 11.740 0.719 1.00 60.32 C ATOM 1940 C LYS A 132 -4.953 10.514 -0.179 1.00 62.20 C ATOM 1941 O LYS A 132 -5.827 10.363 -1.034 1.00 62.05 O ATOM 1942 CB LYS A 132 -4.868 13.017 -0.121 1.00 33.31 C ATOM 1943 CG LYS A 132 -4.956 14.280 0.708 1.00 2.35 C ATOM 1944 CD LYS A 132 -4.869 15.526 -0.144 1.00 75.02 C ATOM 1945 CE LYS A 132 -4.966 16.777 0.712 1.00 0.51 C ATOM 1946 NZ LYS A 132 -6.253 16.857 1.447 1.00 50.24 N ATOM 0 H LYS A 132 -2.910 11.723 1.208 1.00 24.44 H new ATOM 0 HA LYS A 132 -5.869 11.753 1.292 1.00 60.32 H new ATOM 0 HB2 LYS A 132 -3.933 13.022 -0.682 1.00 33.31 H new ATOM 0 HB3 LYS A 132 -5.677 13.012 -0.851 1.00 33.31 H new ATOM 0 HG2 LYS A 132 -5.895 14.285 1.262 1.00 2.35 H new ATOM 0 HG3 LYS A 132 -4.152 14.287 1.444 1.00 2.35 H new ATOM 0 HD2 LYS A 132 -3.928 15.530 -0.695 1.00 75.02 H new ATOM 0 HD3 LYS A 132 -5.671 15.523 -0.882 1.00 75.02 H new ATOM 0 HE2 LYS A 132 -4.141 16.792 1.425 1.00 0.51 H new ATOM 0 HE3 LYS A 132 -4.856 17.657 0.079 1.00 0.51 H new ATOM 0 HZ1 LYS A 132 -6.379 17.818 1.823 1.00 50.24 H new ATOM 0 HZ2 LYS A 132 -7.036 16.633 0.801 1.00 50.24 H new ATOM 0 HZ3 LYS A 132 -6.247 16.176 2.233 1.00 50.24 H new ATOM 1960 N PHE A 133 -3.999 9.630 0.022 1.00 2.31 N ATOM 1961 CA PHE A 133 -3.881 8.463 -0.828 1.00 52.44 C ATOM 1962 C PHE A 133 -4.632 7.318 -0.198 1.00 61.33 C ATOM 1963 O PHE A 133 -4.595 7.154 1.017 1.00 45.44 O ATOM 1964 CB PHE A 133 -2.413 8.044 -1.018 1.00 42.25 C ATOM 1965 CG PHE A 133 -1.468 9.111 -1.526 1.00 45.31 C ATOM 1966 CD1 PHE A 133 -1.931 10.270 -2.124 1.00 12.11 C ATOM 1967 CD2 PHE A 133 -0.105 8.935 -1.405 1.00 72.51 C ATOM 1968 CE1 PHE A 133 -1.058 11.220 -2.582 1.00 11.23 C ATOM 1969 CE2 PHE A 133 0.772 9.886 -1.868 1.00 31.41 C ATOM 1970 CZ PHE A 133 0.296 11.027 -2.457 1.00 2.43 C ATOM 0 H PHE A 133 -3.298 9.695 0.761 1.00 2.31 H new ATOM 0 HA PHE A 133 -4.296 8.714 -1.804 1.00 52.44 H new ATOM 0 HB2 PHE A 133 -2.035 7.680 -0.062 1.00 42.25 H new ATOM 0 HB3 PHE A 133 -2.385 7.204 -1.712 1.00 42.25 H new ATOM 0 HD1 PHE A 133 -2.994 10.427 -2.231 1.00 12.11 H new ATOM 0 HD2 PHE A 133 0.278 8.038 -0.940 1.00 72.51 H new ATOM 0 HE1 PHE A 133 -1.434 12.122 -3.042 1.00 11.23 H new ATOM 0 HE2 PHE A 133 1.836 9.734 -1.767 1.00 31.41 H new ATOM 0 HZ PHE A 133 0.985 11.774 -2.823 1.00 2.43 H new ATOM 1980 N ARG A 134 -5.300 6.528 -0.994 1.00 61.32 N ATOM 1981 CA ARG A 134 -6.035 5.408 -0.463 1.00 20.23 C ATOM 1982 C ARG A 134 -5.566 4.113 -1.069 1.00 60.52 C ATOM 1983 O ARG A 134 -5.554 3.928 -2.309 1.00 21.31 O ATOM 1984 CB ARG A 134 -7.552 5.575 -0.559 1.00 74.33 C ATOM 1985 CG ARG A 134 -8.079 6.758 0.241 1.00 21.55 C ATOM 1986 CD ARG A 134 -9.566 6.637 0.528 1.00 64.32 C ATOM 1987 NE ARG A 134 -10.416 6.706 -0.660 1.00 72.23 N ATOM 1988 CZ ARG A 134 -11.547 5.991 -0.821 1.00 35.43 C ATOM 1989 NH1 ARG A 134 -11.742 4.874 -0.112 1.00 4.43 N ATOM 1990 NH2 ARG A 134 -12.409 6.319 -1.773 1.00 23.30 N ATOM 0 H ARG A 134 -5.352 6.636 -2.007 1.00 61.32 H new ATOM 0 HA ARG A 134 -5.817 5.375 0.604 1.00 20.23 H new ATOM 0 HB2 ARG A 134 -7.831 5.699 -1.605 1.00 74.33 H new ATOM 0 HB3 ARG A 134 -8.034 4.663 -0.206 1.00 74.33 H new ATOM 0 HG2 ARG A 134 -7.533 6.831 1.182 1.00 21.55 H new ATOM 0 HG3 ARG A 134 -7.890 7.680 -0.309 1.00 21.55 H new ATOM 0 HD2 ARG A 134 -9.750 5.691 1.038 1.00 64.32 H new ATOM 0 HD3 ARG A 134 -9.857 7.431 1.215 1.00 64.32 H new ATOM 0 HE ARG A 134 -10.136 7.334 -1.413 1.00 72.23 H new ATOM 0 HH11 ARG A 134 -11.034 4.562 0.552 1.00 4.43 H new ATOM 0 HH12 ARG A 134 -12.599 4.335 -0.236 1.00 4.43 H new ATOM 0 HH21 ARG A 134 -12.216 7.113 -2.384 1.00 23.30 H new ATOM 0 HH22 ARG A 134 -13.265 5.778 -1.895 1.00 23.30 H new ATOM 2004 N LEU A 135 -5.155 3.250 -0.199 1.00 61.33 N ATOM 2005 CA LEU A 135 -4.598 1.983 -0.523 1.00 11.35 C ATOM 2006 C LEU A 135 -5.395 0.896 0.199 1.00 23.42 C ATOM 2007 O LEU A 135 -5.660 1.007 1.388 1.00 0.43 O ATOM 2008 CB LEU A 135 -3.105 2.032 -0.097 1.00 64.52 C ATOM 2009 CG LEU A 135 -2.214 0.796 -0.269 1.00 70.20 C ATOM 2010 CD1 LEU A 135 -0.762 1.247 -0.242 1.00 14.02 C ATOM 2011 CD2 LEU A 135 -2.433 -0.194 0.876 1.00 54.24 C ATOM 0 H LEU A 135 -5.202 3.420 0.806 1.00 61.33 H new ATOM 0 HA LEU A 135 -4.650 1.752 -1.587 1.00 11.35 H new ATOM 0 HB2 LEU A 135 -2.638 2.847 -0.650 1.00 64.52 H new ATOM 0 HB3 LEU A 135 -3.078 2.306 0.958 1.00 64.52 H new ATOM 0 HG LEU A 135 -2.461 0.308 -1.212 1.00 70.20 H new ATOM 0 HD11 LEU A 135 -0.110 0.382 -0.363 1.00 14.02 H new ATOM 0 HD12 LEU A 135 -0.585 1.951 -1.055 1.00 14.02 H new ATOM 0 HD13 LEU A 135 -0.549 1.731 0.711 1.00 14.02 H new ATOM 0 HD21 LEU A 135 -1.791 -1.063 0.733 1.00 54.24 H new ATOM 0 HD22 LEU A 135 -2.189 0.286 1.824 1.00 54.24 H new ATOM 0 HD23 LEU A 135 -3.476 -0.511 0.888 1.00 54.24 H new ATOM 2023 N VAL A 136 -5.790 -0.117 -0.512 1.00 15.33 N ATOM 2024 CA VAL A 136 -6.521 -1.214 0.084 1.00 24.52 C ATOM 2025 C VAL A 136 -5.612 -2.426 0.148 1.00 73.12 C ATOM 2026 O VAL A 136 -4.981 -2.794 -0.850 1.00 52.03 O ATOM 2027 CB VAL A 136 -7.827 -1.547 -0.698 1.00 71.31 C ATOM 2028 CG1 VAL A 136 -8.592 -2.697 -0.048 1.00 3.35 C ATOM 2029 CG2 VAL A 136 -8.716 -0.320 -0.791 1.00 15.22 C ATOM 0 H VAL A 136 -5.621 -0.214 -1.513 1.00 15.33 H new ATOM 0 HA VAL A 136 -6.828 -0.921 1.088 1.00 24.52 H new ATOM 0 HB VAL A 136 -7.539 -1.858 -1.702 1.00 71.31 H new ATOM 0 HG11 VAL A 136 -9.497 -2.901 -0.620 1.00 3.35 H new ATOM 0 HG12 VAL A 136 -7.964 -3.588 -0.031 1.00 3.35 H new ATOM 0 HG13 VAL A 136 -8.862 -2.424 0.972 1.00 3.35 H new ATOM 0 HG21 VAL A 136 -9.624 -0.569 -1.340 1.00 15.22 H new ATOM 0 HG22 VAL A 136 -8.979 0.016 0.212 1.00 15.22 H new ATOM 0 HG23 VAL A 136 -8.184 0.476 -1.312 1.00 15.22 H new ATOM 2039 N PHE A 137 -5.518 -3.008 1.311 1.00 34.43 N ATOM 2040 CA PHE A 137 -4.643 -4.138 1.554 1.00 24.34 C ATOM 2041 C PHE A 137 -5.439 -5.441 1.542 1.00 24.15 C ATOM 2042 O PHE A 137 -6.475 -5.542 2.208 1.00 73.23 O ATOM 2043 CB PHE A 137 -3.942 -3.946 2.908 1.00 72.22 C ATOM 2044 CG PHE A 137 -3.038 -5.073 3.316 1.00 54.11 C ATOM 2045 CD1 PHE A 137 -1.759 -5.171 2.808 1.00 44.32 C ATOM 2046 CD2 PHE A 137 -3.474 -6.035 4.214 1.00 23.12 C ATOM 2047 CE1 PHE A 137 -0.934 -6.203 3.187 1.00 5.13 C ATOM 2048 CE2 PHE A 137 -2.654 -7.068 4.597 1.00 64.33 C ATOM 2049 CZ PHE A 137 -1.383 -7.153 4.086 1.00 62.15 C ATOM 0 H PHE A 137 -6.049 -2.714 2.130 1.00 34.43 H new ATOM 0 HA PHE A 137 -3.894 -4.195 0.764 1.00 24.34 H new ATOM 0 HB2 PHE A 137 -3.358 -3.026 2.872 1.00 72.22 H new ATOM 0 HB3 PHE A 137 -4.701 -3.811 3.678 1.00 72.22 H new ATOM 0 HD1 PHE A 137 -1.403 -4.431 2.107 1.00 44.32 H new ATOM 0 HD2 PHE A 137 -4.473 -5.971 4.618 1.00 23.12 H new ATOM 0 HE1 PHE A 137 0.065 -6.272 2.783 1.00 5.13 H new ATOM 0 HE2 PHE A 137 -3.008 -7.810 5.297 1.00 64.33 H new ATOM 0 HZ PHE A 137 -0.733 -7.962 4.386 1.00 62.15 H new ATOM 2059 N LEU A 138 -4.972 -6.424 0.787 1.00 70.33 N ATOM 2060 CA LEU A 138 -5.632 -7.716 0.709 1.00 15.25 C ATOM 2061 C LEU A 138 -4.609 -8.830 0.920 1.00 43.43 C ATOM 2062 O LEU A 138 -3.556 -8.846 0.286 1.00 60.24 O ATOM 2063 CB LEU A 138 -6.345 -7.950 -0.660 1.00 74.12 C ATOM 2064 CG LEU A 138 -7.446 -6.957 -1.106 1.00 25.23 C ATOM 2065 CD1 LEU A 138 -6.862 -5.652 -1.632 1.00 12.42 C ATOM 2066 CD2 LEU A 138 -8.350 -7.593 -2.150 1.00 62.44 C ATOM 0 H LEU A 138 -4.131 -6.349 0.215 1.00 70.33 H new ATOM 0 HA LEU A 138 -6.393 -7.727 1.490 1.00 15.25 H new ATOM 0 HB2 LEU A 138 -5.578 -7.962 -1.434 1.00 74.12 H new ATOM 0 HB3 LEU A 138 -6.788 -8.945 -0.635 1.00 74.12 H new ATOM 0 HG LEU A 138 -8.039 -6.716 -0.224 1.00 25.23 H new ATOM 0 HD11 LEU A 138 -7.671 -4.987 -1.933 1.00 12.42 H new ATOM 0 HD12 LEU A 138 -6.273 -5.175 -0.849 1.00 12.42 H new ATOM 0 HD13 LEU A 138 -6.224 -5.859 -2.491 1.00 12.42 H new ATOM 0 HD21 LEU A 138 -9.117 -6.879 -2.450 1.00 62.44 H new ATOM 0 HD22 LEU A 138 -7.758 -7.877 -3.020 1.00 62.44 H new ATOM 0 HD23 LEU A 138 -8.824 -8.480 -1.729 1.00 62.44 H new ATOM 2078 N ALA A 139 -4.907 -9.744 1.785 1.00 44.52 N ATOM 2079 CA ALA A 139 -4.045 -10.870 2.025 1.00 20.41 C ATOM 2080 C ALA A 139 -4.831 -12.120 1.769 1.00 2.53 C ATOM 2081 O ALA A 139 -5.839 -12.372 2.428 1.00 73.21 O ATOM 2082 CB ALA A 139 -3.480 -10.858 3.440 1.00 13.10 C ATOM 0 H ALA A 139 -5.756 -9.737 2.350 1.00 44.52 H new ATOM 0 HA ALA A 139 -3.188 -10.821 1.353 1.00 20.41 H new ATOM 0 HB1 ALA A 139 -2.834 -11.725 3.581 1.00 13.10 H new ATOM 0 HB2 ALA A 139 -2.903 -9.946 3.594 1.00 13.10 H new ATOM 0 HB3 ALA A 139 -4.298 -10.894 4.159 1.00 13.10 H new ATOM 2088 N GLY A 140 -4.406 -12.880 0.812 1.00 10.32 N ATOM 2089 CA GLY A 140 -5.140 -14.062 0.449 1.00 61.14 C ATOM 2090 C GLY A 140 -4.424 -14.897 -0.584 1.00 62.51 C ATOM 2091 O GLY A 140 -4.146 -16.066 -0.328 1.00 73.32 O ATOM 0 H GLY A 140 -3.561 -12.710 0.267 1.00 10.32 H new ATOM 0 HA2 GLY A 140 -5.314 -14.665 1.340 1.00 61.14 H new ATOM 0 HA3 GLY A 140 -6.118 -13.774 0.063 1.00 61.14 H new ATOM 2095 N PRO A 141 -4.138 -14.349 -1.793 1.00 61.13 N ATOM 2096 CA PRO A 141 -3.389 -15.079 -2.815 1.00 53.22 C ATOM 2097 C PRO A 141 -1.989 -15.421 -2.322 1.00 61.32 C ATOM 2098 O PRO A 141 -1.214 -14.541 -1.923 1.00 62.53 O ATOM 2099 CB PRO A 141 -3.312 -14.119 -3.989 1.00 22.02 C ATOM 2100 CG PRO A 141 -4.392 -13.119 -3.754 1.00 63.30 C ATOM 2101 CD PRO A 141 -4.548 -13.017 -2.269 1.00 12.53 C ATOM 0 HA PRO A 141 -3.866 -16.024 -3.075 1.00 53.22 H new ATOM 0 HB2 PRO A 141 -2.335 -13.638 -4.040 1.00 22.02 H new ATOM 0 HB3 PRO A 141 -3.459 -14.642 -4.934 1.00 22.02 H new ATOM 0 HG2 PRO A 141 -4.129 -12.153 -4.185 1.00 63.30 H new ATOM 0 HG3 PRO A 141 -5.324 -13.435 -4.223 1.00 63.30 H new ATOM 0 HD2 PRO A 141 -3.920 -12.230 -1.852 1.00 12.53 H new ATOM 0 HD3 PRO A 141 -5.576 -12.788 -1.987 1.00 12.53 H new ATOM 2109 N ALA A 142 -1.688 -16.674 -2.344 1.00 21.24 N ATOM 2110 CA ALA A 142 -0.453 -17.188 -1.823 1.00 55.13 C ATOM 2111 C ALA A 142 0.565 -17.373 -2.923 1.00 53.53 C ATOM 2112 O ALA A 142 0.415 -18.241 -3.785 1.00 14.01 O ATOM 2113 CB ALA A 142 -0.694 -18.505 -1.093 1.00 32.20 C ATOM 0 H ALA A 142 -2.302 -17.391 -2.731 1.00 21.24 H new ATOM 0 HA ALA A 142 -0.055 -16.462 -1.114 1.00 55.13 H new ATOM 0 HB1 ALA A 142 0.251 -18.883 -0.703 1.00 32.20 H new ATOM 0 HB2 ALA A 142 -1.388 -18.342 -0.268 1.00 32.20 H new ATOM 0 HB3 ALA A 142 -1.118 -19.232 -1.785 1.00 32.20 H new ATOM 2119 N GLU A 143 1.563 -16.540 -2.906 1.00 63.11 N ATOM 2120 CA GLU A 143 2.637 -16.596 -3.815 1.00 22.43 C ATOM 2121 C GLU A 143 3.868 -17.038 -3.062 1.00 1.03 C ATOM 2122 O GLU A 143 4.656 -16.168 -2.620 1.00 38.60 O ATOM 2123 CB GLU A 143 2.862 -15.220 -4.415 1.00 33.45 C ATOM 2124 CG GLU A 143 1.837 -14.790 -5.441 1.00 64.24 C ATOM 2125 CD GLU A 143 1.854 -15.657 -6.664 1.00 53.52 C ATOM 2126 OE1 GLU A 143 2.882 -15.691 -7.373 1.00 33.42 O ATOM 2127 OE2 GLU A 143 0.844 -16.282 -6.976 1.00 13.02 O ATOM 2128 OXT GLU A 143 4.036 -18.238 -2.837 1.00 38.60 O ATOM 0 H GLU A 143 1.641 -15.781 -2.229 1.00 63.11 H new ATOM 0 HA GLU A 143 2.421 -17.298 -4.620 1.00 22.43 H new ATOM 0 HB2 GLU A 143 2.875 -14.487 -3.608 1.00 33.45 H new ATOM 0 HB3 GLU A 143 3.848 -15.200 -4.879 1.00 33.45 H new ATOM 0 HG2 GLU A 143 0.844 -14.819 -4.993 1.00 64.24 H new ATOM 0 HG3 GLU A 143 2.027 -13.756 -5.729 1.00 64.24 H new TER 2135 GLU A 143