USER MOD reduce.3.24.130724 H: found=0, std=0, add=1348, rem=0, adj=45 USER MOD reduce.3.24.130724 removed 1350 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 75 SER OG : rot -130:sc= -0.642 USER MOD Set 1.2: A 201 ASN : amide:sc= 0 K(o=-0.64,f=-1.7) USER MOD Set 2.1: A 188 ASN :FLIP amide:sc= 0.0551 F(o=-0.93,f=0.17) USER MOD Set 2.2: A 193 THR OG1 : rot -135:sc= 0.117 USER MOD Set 3.1: A 131 ASN : amide:sc= 0.0369 K(o=0.076,f=-1.3) USER MOD Set 3.2: A 176 TYR OH : rot 104:sc= 0.0388 USER MOD Set 4.1: A 55 ASN :FLIP amide:sc= 0.34 F(o=0.15,f=0.7) USER MOD Set 4.2: A 113 SER OG : rot -128:sc= 0.365 USER MOD Set 5.1: A 19 LYS NZ :NH3+ 167:sc= -0.0286 (180deg=-0.125) USER MOD Set 5.2: A 22 GLN : amide:sc= -0.642 K(o=-0.67,f=-5.1!) USER MOD Single : A 3 SER OG : rot 31:sc= 0.0527 USER MOD Single : A 4 MET CE :methyl 153:sc= 0 (180deg=-0.102) USER MOD Single : A 5 SER OG : rot 180:sc= 0 USER MOD Single : A 6 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 7 SER OG : rot 96:sc=0.000136 USER MOD Single : A 8 ASN :FLIP amide:sc= -0.0514 F(o=-0.88,f=-0.051) USER MOD Single : A 17 SER OG : rot 180:sc= 0 USER MOD Single : A 18 TYR OH : rot 180:sc= 0 USER MOD Single : A 21 SER OG : rot 85:sc= 0.283 USER MOD Single : A 23 LYS NZ :NH3+ 134:sc= 0.0724 (180deg=-0.538) USER MOD Single : A 25 TYR OH : rot 180:sc= 0 USER MOD Single : A 26 SER OG : rot 180:sc= 0 USER MOD Single : A 28 SER OG : rot 180:sc= 0 USER MOD Single : A 29 GLN : amide:sc= -0.96 K(o=-0.96,f=-5.2!) USER MOD Single : A 31 SER OG : rot 180:sc= 0 USER MOD Single : A 52 SER OG : rot 180:sc= 0 USER MOD Single : A 57 ASN : amide:sc= -2.01 X(o=-2,f=-2) USER MOD Single : A 59 SER OG : rot 180:sc= 0 USER MOD Single : A 61 HIS :FLIP no HE2:sc= 0 F(o=-0.53,f=0) USER MOD Single : A 69 ASN : amide:sc= 0 K(o=0,f=-1.1) USER MOD Single : A 72 THR OG1 : rot 180:sc= 0 USER MOD Single : A 74 HIS : no HD1:sc= -1.01 K(o=-1,f=-4.2!) USER MOD Single : A 76 SER OG : rot 180:sc= 0 USER MOD Single : A 77 SER OG : rot 180:sc= 0 USER MOD Single : A 86 MET CE :methyl -121:sc= 0 (180deg=-0.583) USER MOD Single : A 90 LYS NZ :NH3+ 154:sc= -0.122 (180deg=-1.17!) USER MOD Single : A 91 GLN : amide:sc= -1.32 K(o=-1.3,f=-7.3!) USER MOD Single : A 104 TYR OH : rot 180:sc= 0 USER MOD Single : A 109 SER OG : rot 180:sc= 0 USER MOD Single : A 112 THR OG1 : rot 160:sc= -0.0431 USER MOD Single : A 114 GLN : amide:sc= -0.0838 K(o=-0.084,f=-0.8) USER MOD Single : A 116 HIS : no HD1:sc= -0.216 X(o=-0.22,f=-0.32) USER MOD Single : A 118 THR OG1 : rot 2:sc= 0.269 USER MOD Single : A 121 THR OG1 : rot 180:sc= 0 USER MOD Single : A 123 TYR OH : rot -32:sc= 0.0244 USER MOD Single : A 124 GLN : amide:sc= -0.0579 X(o=-0.058,f=-0.062) USER MOD Single : A 125 SER OG : rot 163:sc= 0.0164 USER MOD Single : A 128 GLN : amide:sc= 0 X(o=0,f=-0.41) USER MOD Single : A 139 ASN :FLIP amide:sc= 0 F(o=-1.3,f=0) USER MOD Single : A 148 SER OG : rot 76:sc= 0.434 USER MOD Single : A 154 CYS SG : rot -39:sc= -1.27 USER MOD Single : A 157 SER OG : rot 129:sc= -0.0183 USER MOD Single : A 160 LYS NZ :NH3+ -174:sc= 0.296 (180deg=0.278) USER MOD Single : A 162 MET CE :methyl 163:sc= -0.0649 (180deg=-0.426) USER MOD Single : A 163 GLN : amide:sc= -0.568 K(o=-0.57,f=-1.7) USER MOD Single : A 167 SER OG : rot -139:sc= 0.903 USER MOD Single : A 173 MET CE :methyl 169:sc= -0.546 (180deg=-0.662) USER MOD Single : A 175 THR OG1 : rot 84:sc= 0.781 USER MOD Single : A 178 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 180 HIS : no HD1:sc= -0.0231 K(o=-0.023,f=-0.98) USER MOD Single : A 186 GLN : amide:sc= 0 K(o=0,f=-0.87) USER MOD Single : A 198 TYR OH : rot 180:sc= 0 USER MOD Single : A 200 ASN : amide:sc= -0.0807 X(o=-0.081,f=-0.076) USER MOD ----------------------------------------------------------------- ATOM 28 N SER A 3 9.829 -1.340 -1.978 1.00 23.33 N ATOM 29 CA SER A 3 9.506 -0.236 -1.079 1.00 0.01 C ATOM 30 C SER A 3 9.471 1.089 -1.834 1.00 40.33 C ATOM 31 O SER A 3 10.494 1.560 -2.333 1.00 33.42 O ATOM 32 CB SER A 3 10.524 -0.161 0.061 1.00 73.53 C ATOM 33 OG SER A 3 10.524 -1.355 0.825 1.00 1.42 O ATOM 0 HA SER A 3 8.517 -0.421 -0.660 1.00 0.01 H new ATOM 0 HB2 SER A 3 11.520 0.013 -0.347 1.00 73.53 H new ATOM 0 HB3 SER A 3 10.291 0.687 0.705 1.00 73.53 H new ATOM 0 HG SER A 3 10.292 -2.112 0.248 1.00 1.42 H new ATOM 39 N MET A 4 8.285 1.686 -1.911 1.00 62.21 N ATOM 40 CA MET A 4 8.109 2.954 -2.608 1.00 74.22 C ATOM 41 C MET A 4 8.097 4.127 -1.629 1.00 11.02 C ATOM 42 O MET A 4 7.721 5.242 -1.989 1.00 31.10 O ATOM 43 CB MET A 4 6.813 2.934 -3.422 1.00 31.25 C ATOM 44 CG MET A 4 6.795 1.868 -4.506 1.00 12.35 C ATOM 45 SD MET A 4 5.264 1.867 -5.458 1.00 64.11 S ATOM 46 CE MET A 4 5.551 0.481 -6.557 1.00 33.43 C ATOM 0 H MET A 4 7.431 1.311 -1.498 1.00 62.21 H new ATOM 0 HA MET A 4 8.954 3.087 -3.284 1.00 74.22 H new ATOM 0 HB2 MET A 4 5.972 2.770 -2.748 1.00 31.25 H new ATOM 0 HB3 MET A 4 6.667 3.911 -3.882 1.00 31.25 H new ATOM 0 HG2 MET A 4 7.637 2.027 -5.180 1.00 12.35 H new ATOM 0 HG3 MET A 4 6.934 0.888 -4.049 1.00 12.35 H new ATOM 0 HE1 MET A 4 4.596 0.047 -6.853 1.00 33.43 H new ATOM 0 HE2 MET A 4 6.084 0.824 -7.444 1.00 33.43 H new ATOM 0 HE3 MET A 4 6.148 -0.273 -6.044 1.00 33.43 H new ATOM 56 N SER A 5 8.517 3.870 -0.392 1.00 24.54 N ATOM 57 CA SER A 5 8.562 4.907 0.635 1.00 61.33 C ATOM 58 C SER A 5 9.752 5.837 0.411 1.00 22.21 C ATOM 59 O SER A 5 9.708 7.016 0.762 1.00 11.34 O ATOM 60 CB SER A 5 8.642 4.274 2.027 1.00 54.04 C ATOM 61 OG SER A 5 9.773 3.428 2.142 1.00 75.21 O ATOM 0 H SER A 5 8.831 2.952 -0.077 1.00 24.54 H new ATOM 0 HA SER A 5 7.647 5.495 0.568 1.00 61.33 H new ATOM 0 HB2 SER A 5 8.693 5.057 2.783 1.00 54.04 H new ATOM 0 HB3 SER A 5 7.735 3.701 2.221 1.00 54.04 H new ATOM 0 HG SER A 5 9.800 3.039 3.041 1.00 75.21 H new ATOM 67 N GLN A 6 10.814 5.292 -0.179 1.00 62.15 N ATOM 68 CA GLN A 6 12.019 6.062 -0.466 1.00 41.41 C ATOM 69 C GLN A 6 12.062 6.465 -1.939 1.00 15.43 C ATOM 70 O GLN A 6 12.805 7.368 -2.325 1.00 11.22 O ATOM 71 CB GLN A 6 13.267 5.251 -0.106 1.00 32.02 C ATOM 72 CG GLN A 6 13.340 3.898 -0.799 1.00 51.12 C ATOM 73 CD GLN A 6 14.594 3.126 -0.441 1.00 63.24 C ATOM 74 OE1 GLN A 6 14.611 2.356 0.519 1.00 44.15 O ATOM 75 NE2 GLN A 6 15.654 3.328 -1.215 1.00 70.24 N ATOM 0 H GLN A 6 10.863 4.315 -0.468 1.00 62.15 H new ATOM 0 HA GLN A 6 12.000 6.967 0.141 1.00 41.41 H new ATOM 0 HB2 GLN A 6 14.153 5.830 -0.366 1.00 32.02 H new ATOM 0 HB3 GLN A 6 13.291 5.098 0.973 1.00 32.02 H new ATOM 0 HG2 GLN A 6 12.465 3.308 -0.528 1.00 51.12 H new ATOM 0 HG3 GLN A 6 13.304 4.045 -1.878 1.00 51.12 H new ATOM 0 HE21 GLN A 6 15.596 3.976 -2.001 1.00 70.24 H new ATOM 0 HE22 GLN A 6 16.526 2.835 -1.024 1.00 70.24 H new ATOM 84 N SER A 7 11.256 5.787 -2.754 1.00 42.13 N ATOM 85 CA SER A 7 11.192 6.065 -4.185 1.00 21.20 C ATOM 86 C SER A 7 10.351 7.307 -4.460 1.00 25.20 C ATOM 87 O SER A 7 10.676 8.108 -5.336 1.00 30.31 O ATOM 88 CB SER A 7 10.609 4.863 -4.933 1.00 51.11 C ATOM 89 OG SER A 7 11.411 3.709 -4.752 1.00 53.41 O ATOM 0 H SER A 7 10.636 5.038 -2.445 1.00 42.13 H new ATOM 0 HA SER A 7 12.206 6.249 -4.541 1.00 21.20 H new ATOM 0 HB2 SER A 7 9.598 4.666 -4.578 1.00 51.11 H new ATOM 0 HB3 SER A 7 10.534 5.094 -5.996 1.00 51.11 H new ATOM 0 HG SER A 7 11.044 3.167 -4.022 1.00 53.41 H new ATOM 95 N ASN A 8 9.270 7.464 -3.702 1.00 45.45 N ATOM 96 CA ASN A 8 8.383 8.612 -3.863 1.00 60.14 C ATOM 97 C ASN A 8 8.861 9.792 -3.022 1.00 0.43 C ATOM 98 O ASN A 8 8.326 10.896 -3.125 1.00 73.23 O ATOM 99 CB ASN A 8 6.948 8.242 -3.476 1.00 21.31 C ATOM 100 CG ASN A 8 6.400 7.077 -4.283 1.00 74.31 C ATOM 101 OD1 ASN A 8 6.870 6.930 -5.517 1.00 22.44 O flip ATOM 102 ND2 ASN A 8 5.560 6.318 -3.801 1.00 14.14 N flip ATOM 0 H ASN A 8 8.987 6.812 -2.971 1.00 45.45 H new ATOM 0 HA ASN A 8 8.401 8.905 -4.913 1.00 60.14 H new ATOM 0 HB2 ASN A 8 6.916 7.990 -2.416 1.00 21.31 H new ATOM 0 HB3 ASN A 8 6.304 9.110 -3.617 1.00 21.31 H new ATOM 0 HD21 ASN A 8 5.225 6.466 -2.849 1.00 14.14 H new ATOM 0 HD22 ASN A 8 5.198 5.541 -4.354 1.00 14.14 H new ATOM 109 N ARG A 9 9.876 9.549 -2.193 1.00 12.02 N ATOM 110 CA ARG A 9 10.435 10.585 -1.331 1.00 51.05 C ATOM 111 C ARG A 9 11.355 11.511 -2.122 1.00 14.21 C ATOM 112 O ARG A 9 11.479 12.696 -1.809 1.00 25.40 O ATOM 113 CB ARG A 9 11.199 9.945 -0.171 1.00 42.50 C ATOM 114 CG ARG A 9 11.491 10.902 0.973 1.00 31.12 C ATOM 115 CD ARG A 9 12.165 10.189 2.133 1.00 42.03 C ATOM 116 NE ARG A 9 12.442 11.093 3.247 1.00 5.14 N ATOM 117 CZ ARG A 9 12.854 10.686 4.445 1.00 73.34 C ATOM 118 NH1 ARG A 9 13.036 9.394 4.688 1.00 13.23 N1+ ATOM 119 NH2 ARG A 9 13.086 11.572 5.403 1.00 21.22 N ATOM 0 H ARG A 9 10.328 8.639 -2.102 1.00 12.02 H new ATOM 0 HA ARG A 9 9.614 11.180 -0.931 1.00 51.05 H new ATOM 0 HB2 ARG A 9 10.622 9.102 0.211 1.00 42.50 H new ATOM 0 HB3 ARG A 9 12.140 9.543 -0.546 1.00 42.50 H new ATOM 0 HG2 ARG A 9 12.131 11.710 0.619 1.00 31.12 H new ATOM 0 HG3 ARG A 9 10.562 11.358 1.314 1.00 31.12 H new ATOM 0 HD2 ARG A 9 11.527 9.375 2.477 1.00 42.03 H new ATOM 0 HD3 ARG A 9 13.097 9.741 1.790 1.00 42.03 H new ATOM 0 HE ARG A 9 12.312 12.094 3.098 1.00 5.14 H new ATOM 0 HH11 ARG A 9 12.860 8.707 3.955 1.00 13.23 H new ATOM 0 HH12 ARG A 9 13.352 9.088 5.608 1.00 13.23 H new ATOM 0 HH21 ARG A 9 12.949 12.566 5.222 1.00 21.22 H new ATOM 0 HH22 ARG A 9 13.402 11.259 6.321 1.00 21.22 H new ATOM 133 N GLU A 10 11.991 10.961 -3.153 1.00 63.25 N ATOM 134 CA GLU A 10 12.898 11.731 -3.998 1.00 11.22 C ATOM 135 C GLU A 10 12.121 12.492 -5.074 1.00 31.42 C ATOM 136 O GLU A 10 12.672 13.348 -5.768 1.00 63.04 O ATOM 137 CB GLU A 10 13.927 10.798 -4.642 1.00 15.12 C ATOM 138 CG GLU A 10 15.197 11.500 -5.096 1.00 44.41 C ATOM 139 CD GLU A 10 16.295 10.526 -5.473 1.00 40.11 C ATOM 140 OE1 GLU A 10 16.277 10.022 -6.615 1.00 32.10 O ATOM 141 OE2 GLU A 10 17.175 10.267 -4.625 1.00 2.34 O1- ATOM 0 H GLU A 10 11.894 9.982 -3.424 1.00 63.25 H new ATOM 0 HA GLU A 10 13.419 12.460 -3.377 1.00 11.22 H new ATOM 0 HB2 GLU A 10 14.191 10.017 -3.929 1.00 15.12 H new ATOM 0 HB3 GLU A 10 13.469 10.305 -5.500 1.00 15.12 H new ATOM 0 HG2 GLU A 10 14.971 12.136 -5.952 1.00 44.41 H new ATOM 0 HG3 GLU A 10 15.553 12.153 -4.299 1.00 44.41 H new ATOM 148 N LEU A 11 10.833 12.176 -5.199 1.00 22.23 N ATOM 149 CA LEU A 11 9.969 12.826 -6.180 1.00 41.33 C ATOM 150 C LEU A 11 9.485 14.178 -5.665 1.00 3.53 C ATOM 151 O LEU A 11 9.155 15.068 -6.449 1.00 35.05 O ATOM 152 CB LEU A 11 8.766 11.937 -6.506 1.00 5.34 C ATOM 153 CG LEU A 11 9.106 10.560 -7.080 1.00 65.44 C ATOM 154 CD1 LEU A 11 7.835 9.787 -7.392 1.00 15.33 C ATOM 155 CD2 LEU A 11 9.965 10.697 -8.326 1.00 11.20 C ATOM 0 H LEU A 11 10.364 11.471 -4.630 1.00 22.23 H new ATOM 0 HA LEU A 11 10.551 12.985 -7.088 1.00 41.33 H new ATOM 0 HB2 LEU A 11 8.181 11.799 -5.597 1.00 5.34 H new ATOM 0 HB3 LEU A 11 8.130 12.462 -7.218 1.00 5.34 H new ATOM 0 HG LEU A 11 9.673 10.006 -6.332 1.00 65.44 H new ATOM 0 HD11 LEU A 11 8.094 8.810 -7.799 1.00 15.33 H new ATOM 0 HD12 LEU A 11 7.255 9.657 -6.478 1.00 15.33 H new ATOM 0 HD13 LEU A 11 7.243 10.339 -8.122 1.00 15.33 H new ATOM 0 HD21 LEU A 11 10.196 9.707 -8.719 1.00 11.20 H new ATOM 0 HD22 LEU A 11 9.424 11.270 -9.080 1.00 11.20 H new ATOM 0 HD23 LEU A 11 10.892 11.213 -8.074 1.00 11.20 H new ATOM 167 N VAL A 12 9.447 14.322 -4.342 1.00 22.34 N ATOM 168 CA VAL A 12 9.008 15.564 -3.712 1.00 40.42 C ATOM 169 C VAL A 12 10.113 16.620 -3.762 1.00 65.31 C ATOM 170 O VAL A 12 9.841 17.818 -3.830 1.00 60.14 O ATOM 171 CB VAL A 12 8.586 15.330 -2.244 1.00 23.32 C ATOM 172 CG1 VAL A 12 7.921 16.569 -1.665 1.00 25.03 C ATOM 173 CG2 VAL A 12 7.660 14.128 -2.136 1.00 53.22 C ATOM 0 H VAL A 12 9.716 13.591 -3.684 1.00 22.34 H new ATOM 0 HA VAL A 12 8.144 15.923 -4.272 1.00 40.42 H new ATOM 0 HB VAL A 12 9.486 15.125 -1.664 1.00 23.32 H new ATOM 0 HG11 VAL A 12 7.634 16.378 -0.631 1.00 25.03 H new ATOM 0 HG12 VAL A 12 8.619 17.406 -1.699 1.00 25.03 H new ATOM 0 HG13 VAL A 12 7.034 16.812 -2.249 1.00 25.03 H new ATOM 0 HG21 VAL A 12 7.375 13.981 -1.094 1.00 53.22 H new ATOM 0 HG22 VAL A 12 6.767 14.302 -2.736 1.00 53.22 H new ATOM 0 HG23 VAL A 12 8.174 13.239 -2.501 1.00 53.22 H new ATOM 183 N VAL A 13 11.363 16.160 -3.745 1.00 44.24 N ATOM 184 CA VAL A 13 12.516 17.057 -3.789 1.00 64.33 C ATOM 185 C VAL A 13 12.799 17.517 -5.224 1.00 42.14 C ATOM 186 O VAL A 13 13.599 18.427 -5.449 1.00 23.25 O ATOM 187 CB VAL A 13 13.780 16.373 -3.215 1.00 50.40 C ATOM 188 CG1 VAL A 13 14.841 17.403 -2.853 1.00 71.34 C ATOM 189 CG2 VAL A 13 13.430 15.520 -2.003 1.00 33.23 C ATOM 0 H VAL A 13 11.603 15.170 -3.701 1.00 44.24 H new ATOM 0 HA VAL A 13 12.272 17.924 -3.175 1.00 64.33 H new ATOM 0 HB VAL A 13 14.188 15.722 -3.988 1.00 50.40 H new ATOM 0 HG11 VAL A 13 15.719 16.896 -2.452 1.00 71.34 H new ATOM 0 HG12 VAL A 13 15.122 17.965 -3.744 1.00 71.34 H new ATOM 0 HG13 VAL A 13 14.443 18.087 -2.103 1.00 71.34 H new ATOM 0 HG21 VAL A 13 14.334 15.049 -1.616 1.00 33.23 H new ATOM 0 HG22 VAL A 13 12.990 16.150 -1.230 1.00 33.23 H new ATOM 0 HG23 VAL A 13 12.716 14.750 -2.294 1.00 33.23 H new ATOM 199 N ASP A 14 12.126 16.889 -6.189 1.00 1.42 N ATOM 200 CA ASP A 14 12.302 17.223 -7.600 1.00 43.32 C ATOM 201 C ASP A 14 11.779 18.625 -7.915 1.00 21.21 C ATOM 202 O ASP A 14 12.535 19.485 -8.368 1.00 63.44 O ATOM 203 CB ASP A 14 11.595 16.189 -8.482 1.00 21.13 C ATOM 204 CG ASP A 14 11.630 16.555 -9.954 1.00 4.43 C ATOM 205 OD1 ASP A 14 12.729 16.531 -10.547 1.00 34.52 O ATOM 206 OD2 ASP A 14 10.558 16.866 -10.514 1.00 73.41 O1- ATOM 0 H ASP A 14 11.452 16.143 -6.016 1.00 1.42 H new ATOM 0 HA ASP A 14 13.371 17.208 -7.813 1.00 43.32 H new ATOM 0 HB2 ASP A 14 12.065 15.216 -8.342 1.00 21.13 H new ATOM 0 HB3 ASP A 14 10.558 16.091 -8.160 1.00 21.13 H new ATOM 211 N PHE A 15 10.490 18.852 -7.665 1.00 30.02 N ATOM 212 CA PHE A 15 9.879 20.152 -7.935 1.00 40.51 C ATOM 213 C PHE A 15 10.269 21.192 -6.885 1.00 55.12 C ATOM 214 O PHE A 15 10.053 22.387 -7.080 1.00 23.20 O ATOM 215 CB PHE A 15 8.351 20.033 -8.031 1.00 2.42 C ATOM 216 CG PHE A 15 7.711 19.267 -6.907 1.00 22.33 C ATOM 217 CD1 PHE A 15 7.397 17.927 -7.059 1.00 44.13 C ATOM 218 CD2 PHE A 15 7.414 19.889 -5.705 1.00 51.43 C ATOM 219 CE1 PHE A 15 6.801 17.221 -6.033 1.00 3.55 C ATOM 220 CE2 PHE A 15 6.819 19.187 -4.675 1.00 74.33 C ATOM 221 CZ PHE A 15 6.512 17.852 -4.839 1.00 54.30 C ATOM 0 H PHE A 15 9.852 18.157 -7.278 1.00 30.02 H new ATOM 0 HA PHE A 15 10.262 20.493 -8.897 1.00 40.51 H new ATOM 0 HB2 PHE A 15 7.923 21.035 -8.060 1.00 2.42 H new ATOM 0 HB3 PHE A 15 8.096 19.550 -8.974 1.00 2.42 H new ATOM 0 HD1 PHE A 15 7.621 17.428 -7.991 1.00 44.13 H new ATOM 0 HD2 PHE A 15 7.650 20.934 -5.572 1.00 51.43 H new ATOM 0 HE1 PHE A 15 6.561 16.176 -6.164 1.00 3.55 H new ATOM 0 HE2 PHE A 15 6.594 19.683 -3.742 1.00 74.33 H new ATOM 0 HZ PHE A 15 6.046 17.301 -4.035 1.00 54.30 H new ATOM 231 N LEU A 16 10.847 20.734 -5.774 1.00 64.22 N ATOM 232 CA LEU A 16 11.278 21.634 -4.709 1.00 72.32 C ATOM 233 C LEU A 16 12.614 22.283 -5.064 1.00 33.21 C ATOM 234 O LEU A 16 12.936 23.369 -4.581 1.00 40.03 O ATOM 235 CB LEU A 16 11.408 20.880 -3.383 1.00 4.43 C ATOM 236 CG LEU A 16 10.506 21.387 -2.256 1.00 71.13 C ATOM 237 CD1 LEU A 16 9.127 20.757 -2.350 1.00 3.51 C ATOM 238 CD2 LEU A 16 11.133 21.103 -0.902 1.00 52.20 C ATOM 0 H LEU A 16 11.026 19.747 -5.590 1.00 64.22 H new ATOM 0 HA LEU A 16 10.522 22.412 -4.600 1.00 72.32 H new ATOM 0 HB2 LEU A 16 11.187 19.827 -3.559 1.00 4.43 H new ATOM 0 HB3 LEU A 16 12.445 20.937 -3.051 1.00 4.43 H new ATOM 0 HG LEU A 16 10.397 22.466 -2.363 1.00 71.13 H new ATOM 0 HD11 LEU A 16 8.500 21.130 -1.540 1.00 3.51 H new ATOM 0 HD12 LEU A 16 8.674 21.014 -3.307 1.00 3.51 H new ATOM 0 HD13 LEU A 16 9.216 19.674 -2.270 1.00 3.51 H new ATOM 0 HD21 LEU A 16 10.477 21.471 -0.113 1.00 52.20 H new ATOM 0 HD22 LEU A 16 11.275 20.029 -0.785 1.00 52.20 H new ATOM 0 HD23 LEU A 16 12.098 21.606 -0.835 1.00 52.20 H new ATOM 250 N SER A 17 13.384 21.605 -5.914 1.00 61.33 N ATOM 251 CA SER A 17 14.686 22.104 -6.344 1.00 54.41 C ATOM 252 C SER A 17 14.536 23.183 -7.414 1.00 31.12 C ATOM 253 O SER A 17 15.330 24.123 -7.473 1.00 53.12 O ATOM 254 CB SER A 17 15.544 20.954 -6.879 1.00 53.13 C ATOM 255 OG SER A 17 16.839 21.404 -7.238 1.00 2.41 O ATOM 0 H SER A 17 13.126 20.705 -6.319 1.00 61.33 H new ATOM 0 HA SER A 17 15.179 22.547 -5.478 1.00 54.41 H new ATOM 0 HB2 SER A 17 15.624 20.174 -6.122 1.00 53.13 H new ATOM 0 HB3 SER A 17 15.058 20.507 -7.746 1.00 53.13 H new ATOM 0 HG SER A 17 17.366 20.649 -7.575 1.00 2.41 H new ATOM 261 N TYR A 18 13.510 23.044 -8.252 1.00 32.53 N ATOM 262 CA TYR A 18 13.255 24.007 -9.320 1.00 34.51 C ATOM 263 C TYR A 18 12.654 25.296 -8.768 1.00 33.20 C ATOM 264 O TYR A 18 12.929 26.381 -9.276 1.00 73.25 O ATOM 265 CB TYR A 18 12.320 23.407 -10.374 1.00 41.32 C ATOM 266 CG TYR A 18 12.914 22.229 -11.114 1.00 34.43 C ATOM 267 CD1 TYR A 18 14.108 22.354 -11.815 1.00 24.32 C ATOM 268 CD2 TYR A 18 12.283 20.992 -11.110 1.00 12.13 C ATOM 269 CE1 TYR A 18 14.655 21.279 -12.490 1.00 62.14 C ATOM 270 CE2 TYR A 18 12.824 19.913 -11.782 1.00 51.11 C ATOM 271 CZ TYR A 18 14.009 20.061 -12.470 1.00 0.54 C ATOM 272 OH TYR A 18 14.549 18.988 -13.140 1.00 61.02 O ATOM 0 H TYR A 18 12.842 22.274 -8.211 1.00 32.53 H new ATOM 0 HA TYR A 18 14.211 24.245 -9.786 1.00 34.51 H new ATOM 0 HB2 TYR A 18 11.396 23.092 -9.890 1.00 41.32 H new ATOM 0 HB3 TYR A 18 12.055 24.181 -11.094 1.00 41.32 H new ATOM 0 HD1 TYR A 18 14.616 23.307 -11.832 1.00 24.32 H new ATOM 0 HD2 TYR A 18 11.354 20.871 -10.573 1.00 12.13 H new ATOM 0 HE1 TYR A 18 15.583 21.392 -13.030 1.00 62.14 H new ATOM 0 HE2 TYR A 18 12.321 18.958 -11.768 1.00 51.11 H new ATOM 0 HH TYR A 18 13.970 18.205 -13.025 1.00 61.02 H new ATOM 282 N LYS A 19 11.839 25.168 -7.721 1.00 33.40 N ATOM 283 CA LYS A 19 11.195 26.324 -7.101 1.00 71.20 C ATOM 284 C LYS A 19 12.208 27.218 -6.397 1.00 74.34 C ATOM 285 O LYS A 19 12.118 28.441 -6.475 1.00 53.33 O ATOM 286 CB LYS A 19 10.125 25.873 -6.106 1.00 24.30 C ATOM 287 CG LYS A 19 8.871 25.323 -6.766 1.00 64.24 C ATOM 288 CD LYS A 19 8.207 26.359 -7.660 1.00 35.31 C ATOM 289 CE LYS A 19 8.322 25.985 -9.130 1.00 14.51 C ATOM 290 NZ LYS A 19 7.651 26.980 -10.009 1.00 1.03 N1+ ATOM 0 H LYS A 19 11.610 24.275 -7.285 1.00 33.40 H new ATOM 0 HA LYS A 19 10.726 26.901 -7.897 1.00 71.20 H new ATOM 0 HB2 LYS A 19 10.547 25.108 -5.454 1.00 24.30 H new ATOM 0 HB3 LYS A 19 9.851 26.717 -5.473 1.00 24.30 H new ATOM 0 HG2 LYS A 19 9.126 24.443 -7.356 1.00 64.24 H new ATOM 0 HG3 LYS A 19 8.168 25.000 -5.999 1.00 64.24 H new ATOM 0 HD2 LYS A 19 7.155 26.454 -7.389 1.00 35.31 H new ATOM 0 HD3 LYS A 19 8.668 27.333 -7.494 1.00 35.31 H new ATOM 0 HE2 LYS A 19 9.374 25.909 -9.404 1.00 14.51 H new ATOM 0 HE3 LYS A 19 7.879 25.002 -9.290 1.00 14.51 H new ATOM 0 HZ1 LYS A 19 7.933 26.817 -10.997 1.00 1.03 H new ATOM 0 HZ2 LYS A 19 6.619 26.880 -9.923 1.00 1.03 H new ATOM 0 HZ3 LYS A 19 7.931 27.940 -9.723 1.00 1.03 H new ATOM 304 N LEU A 20 13.170 26.603 -5.714 1.00 51.53 N ATOM 305 CA LEU A 20 14.201 27.350 -4.998 1.00 12.22 C ATOM 306 C LEU A 20 15.093 28.124 -5.962 1.00 64.24 C ATOM 307 O LEU A 20 15.470 29.260 -5.688 1.00 44.31 O ATOM 308 CB LEU A 20 15.052 26.404 -4.147 1.00 74.32 C ATOM 309 CG LEU A 20 14.469 26.058 -2.776 1.00 34.14 C ATOM 310 CD1 LEU A 20 15.243 24.916 -2.142 1.00 64.12 C ATOM 311 CD2 LEU A 20 14.486 27.277 -1.865 1.00 33.14 C ATOM 0 H LEU A 20 13.257 25.589 -5.641 1.00 51.53 H new ATOM 0 HA LEU A 20 13.700 28.065 -4.346 1.00 12.22 H new ATOM 0 HB2 LEU A 20 15.204 25.479 -4.703 1.00 74.32 H new ATOM 0 HB3 LEU A 20 16.034 26.855 -4.003 1.00 74.32 H new ATOM 0 HG LEU A 20 13.435 25.743 -2.913 1.00 34.14 H new ATOM 0 HD11 LEU A 20 14.815 24.683 -1.167 1.00 64.12 H new ATOM 0 HD12 LEU A 20 15.185 24.037 -2.783 1.00 64.12 H new ATOM 0 HD13 LEU A 20 16.286 25.207 -2.020 1.00 64.12 H new ATOM 0 HD21 LEU A 20 14.067 27.012 -0.894 1.00 33.14 H new ATOM 0 HD22 LEU A 20 15.512 27.621 -1.736 1.00 33.14 H new ATOM 0 HD23 LEU A 20 13.890 28.073 -2.311 1.00 33.14 H new ATOM 323 N SER A 21 15.411 27.506 -7.098 1.00 21.30 N ATOM 324 CA SER A 21 16.264 28.130 -8.107 1.00 40.15 C ATOM 325 C SER A 21 15.565 29.305 -8.793 1.00 30.21 C ATOM 326 O SER A 21 16.221 30.206 -9.317 1.00 52.24 O ATOM 327 CB SER A 21 16.684 27.094 -9.152 1.00 61.20 C ATOM 328 OG SER A 21 17.459 26.063 -8.565 1.00 34.20 O ATOM 0 H SER A 21 15.089 26.570 -7.343 1.00 21.30 H new ATOM 0 HA SER A 21 17.147 28.517 -7.599 1.00 40.15 H new ATOM 0 HB2 SER A 21 15.798 26.665 -9.620 1.00 61.20 H new ATOM 0 HB3 SER A 21 17.258 27.580 -9.941 1.00 61.20 H new ATOM 0 HG SER A 21 16.865 25.377 -8.195 1.00 34.20 H new ATOM 334 N GLN A 22 14.233 29.292 -8.783 1.00 15.21 N ATOM 335 CA GLN A 22 13.449 30.357 -9.405 1.00 24.03 C ATOM 336 C GLN A 22 13.090 31.451 -8.399 1.00 23.23 C ATOM 337 O GLN A 22 12.454 32.443 -8.754 1.00 32.33 O ATOM 338 CB GLN A 22 12.170 29.782 -10.018 1.00 43.51 C ATOM 339 CG GLN A 22 12.415 28.891 -11.227 1.00 31.51 C ATOM 340 CD GLN A 22 11.173 28.132 -11.655 1.00 2.13 C ATOM 341 OE1 GLN A 22 10.049 28.602 -11.477 1.00 10.23 O ATOM 342 NE2 GLN A 22 11.370 26.948 -12.224 1.00 21.52 N ATOM 0 H GLN A 22 13.675 28.556 -8.351 1.00 15.21 H new ATOM 0 HA GLN A 22 14.062 30.803 -10.188 1.00 24.03 H new ATOM 0 HB2 GLN A 22 11.640 29.209 -9.258 1.00 43.51 H new ATOM 0 HB3 GLN A 22 11.517 30.604 -10.311 1.00 43.51 H new ATOM 0 HG2 GLN A 22 12.767 29.502 -12.058 1.00 31.51 H new ATOM 0 HG3 GLN A 22 13.208 28.180 -10.995 1.00 31.51 H new ATOM 0 HE21 GLN A 22 12.318 26.596 -12.353 1.00 21.52 H new ATOM 0 HE22 GLN A 22 10.573 26.391 -12.532 1.00 21.52 H new ATOM 351 N LYS A 23 13.501 31.269 -7.145 1.00 42.13 N ATOM 352 CA LYS A 23 13.210 32.246 -6.099 1.00 21.42 C ATOM 353 C LYS A 23 14.479 32.956 -5.623 1.00 52.15 C ATOM 354 O LYS A 23 14.408 33.923 -4.863 1.00 43.43 O ATOM 355 CB LYS A 23 12.492 31.568 -4.928 1.00 14.44 C ATOM 356 CG LYS A 23 11.079 31.121 -5.274 1.00 43.44 C ATOM 357 CD LYS A 23 10.444 30.318 -4.150 1.00 23.41 C ATOM 358 CE LYS A 23 9.042 29.858 -4.519 1.00 34.14 C ATOM 359 NZ LYS A 23 8.401 29.088 -3.418 1.00 24.44 N1+ ATOM 0 H LYS A 23 14.034 30.458 -6.830 1.00 42.13 H new ATOM 0 HA LYS A 23 12.553 33.006 -6.521 1.00 21.42 H new ATOM 0 HB2 LYS A 23 13.072 30.703 -4.605 1.00 14.44 H new ATOM 0 HB3 LYS A 23 12.453 32.258 -4.085 1.00 14.44 H new ATOM 0 HG2 LYS A 23 10.464 31.995 -5.487 1.00 43.44 H new ATOM 0 HG3 LYS A 23 11.102 30.518 -6.182 1.00 43.44 H new ATOM 0 HD2 LYS A 23 11.065 29.451 -3.924 1.00 23.41 H new ATOM 0 HD3 LYS A 23 10.403 30.925 -3.246 1.00 23.41 H new ATOM 0 HE2 LYS A 23 8.428 30.725 -4.761 1.00 34.14 H new ATOM 0 HE3 LYS A 23 9.087 29.240 -5.416 1.00 34.14 H new ATOM 0 HZ1 LYS A 23 7.427 29.426 -3.279 1.00 24.44 H new ATOM 0 HZ2 LYS A 23 8.385 28.078 -3.665 1.00 24.44 H new ATOM 0 HZ3 LYS A 23 8.942 29.221 -2.540 1.00 24.44 H new ATOM 373 N GLY A 24 15.639 32.473 -6.072 1.00 74.33 N ATOM 374 CA GLY A 24 16.900 33.096 -5.696 1.00 61.44 C ATOM 375 C GLY A 24 17.677 32.322 -4.645 1.00 53.43 C ATOM 376 O GLY A 24 18.540 32.884 -3.970 1.00 72.31 O ATOM 0 H GLY A 24 15.727 31.664 -6.687 1.00 74.33 H new ATOM 0 HA2 GLY A 24 17.520 33.205 -6.586 1.00 61.44 H new ATOM 0 HA3 GLY A 24 16.701 34.100 -5.321 1.00 61.44 H new ATOM 380 N TYR A 25 17.378 31.034 -4.504 1.00 2.32 N ATOM 381 CA TYR A 25 18.061 30.191 -3.525 1.00 35.14 C ATOM 382 C TYR A 25 18.451 28.847 -4.138 1.00 43.25 C ATOM 383 O TYR A 25 18.247 28.616 -5.330 1.00 11.33 O ATOM 384 CB TYR A 25 17.174 29.975 -2.296 1.00 14.21 C ATOM 385 CG TYR A 25 17.076 31.192 -1.401 1.00 22.42 C ATOM 386 CD1 TYR A 25 18.091 31.498 -0.503 1.00 51.14 C ATOM 387 CD2 TYR A 25 15.973 32.035 -1.455 1.00 42.50 C ATOM 388 CE1 TYR A 25 18.010 32.608 0.316 1.00 21.22 C ATOM 389 CE2 TYR A 25 15.886 33.147 -0.640 1.00 54.30 C ATOM 390 CZ TYR A 25 16.906 33.429 0.243 1.00 2.54 C ATOM 391 OH TYR A 25 16.821 34.535 1.057 1.00 33.01 O ATOM 0 H TYR A 25 16.668 30.551 -5.054 1.00 2.32 H new ATOM 0 HA TYR A 25 18.973 30.702 -3.216 1.00 35.14 H new ATOM 0 HB2 TYR A 25 16.173 29.694 -2.625 1.00 14.21 H new ATOM 0 HB3 TYR A 25 17.566 29.139 -1.717 1.00 14.21 H new ATOM 0 HD1 TYR A 25 18.958 30.857 -0.444 1.00 51.14 H new ATOM 0 HD2 TYR A 25 15.171 31.818 -2.145 1.00 42.50 H new ATOM 0 HE1 TYR A 25 18.808 32.831 1.009 1.00 21.22 H new ATOM 0 HE2 TYR A 25 15.022 33.793 -0.695 1.00 54.30 H new ATOM 0 HH TYR A 25 15.981 35.008 0.880 1.00 33.01 H new ATOM 401 N SER A 26 19.024 27.966 -3.319 1.00 41.43 N ATOM 402 CA SER A 26 19.446 26.646 -3.785 1.00 44.31 C ATOM 403 C SER A 26 19.260 25.595 -2.692 1.00 31.30 C ATOM 404 O SER A 26 18.595 25.842 -1.685 1.00 53.54 O ATOM 405 CB SER A 26 20.914 26.681 -4.226 1.00 52.25 C ATOM 406 OG SER A 26 21.095 27.520 -5.354 1.00 64.20 O ATOM 0 H SER A 26 19.206 28.142 -2.331 1.00 41.43 H new ATOM 0 HA SER A 26 18.822 26.375 -4.637 1.00 44.31 H new ATOM 0 HB2 SER A 26 21.534 27.036 -3.403 1.00 52.25 H new ATOM 0 HB3 SER A 26 21.248 25.671 -4.464 1.00 52.25 H new ATOM 0 HG SER A 26 22.041 27.523 -5.611 1.00 64.20 H new ATOM 412 N TRP A 27 19.848 24.419 -2.904 1.00 61.20 N ATOM 413 CA TRP A 27 19.765 23.328 -1.938 1.00 53.30 C ATOM 414 C TRP A 27 21.097 23.137 -1.218 1.00 22.33 C ATOM 415 O TRP A 27 21.352 22.083 -0.634 1.00 44.40 O ATOM 416 CB TRP A 27 19.363 22.027 -2.635 1.00 4.15 C ATOM 417 CG TRP A 27 17.890 21.759 -2.594 1.00 14.02 C ATOM 418 CD1 TRP A 27 17.009 21.865 -3.630 1.00 22.51 C ATOM 419 CD2 TRP A 27 17.127 21.340 -1.456 1.00 54.12 C ATOM 420 NE1 TRP A 27 15.744 21.534 -3.207 1.00 34.12 N ATOM 421 CE2 TRP A 27 15.790 21.209 -1.877 1.00 11.52 C ATOM 422 CE3 TRP A 27 17.443 21.061 -0.123 1.00 53.32 C ATOM 423 CZ2 TRP A 27 14.774 20.812 -1.014 1.00 20.51 C ATOM 424 CZ3 TRP A 27 16.431 20.667 0.733 1.00 40.24 C ATOM 425 CH2 TRP A 27 15.111 20.546 0.285 1.00 31.43 C ATOM 0 H TRP A 27 20.389 24.198 -3.740 1.00 61.20 H new ATOM 0 HA TRP A 27 19.005 23.588 -1.202 1.00 53.30 H new ATOM 0 HB2 TRP A 27 19.689 22.065 -3.674 1.00 4.15 H new ATOM 0 HB3 TRP A 27 19.889 21.195 -2.166 1.00 4.15 H new ATOM 0 HD1 TRP A 27 17.268 22.165 -4.635 1.00 22.51 H new ATOM 0 HE1 TRP A 27 14.906 21.531 -3.789 1.00 34.12 H new ATOM 0 HE3 TRP A 27 18.459 21.152 0.232 1.00 53.32 H new ATOM 0 HZ2 TRP A 27 13.754 20.717 -1.357 1.00 20.51 H new ATOM 0 HZ3 TRP A 27 16.663 20.449 1.765 1.00 40.24 H new ATOM 0 HH2 TRP A 27 14.343 20.237 0.978 1.00 31.43 H new ATOM 436 N SER A 28 21.939 24.168 -1.257 1.00 32.31 N ATOM 437 CA SER A 28 23.249 24.122 -0.611 1.00 50.44 C ATOM 438 C SER A 28 23.133 24.352 0.895 1.00 42.24 C ATOM 439 O SER A 28 24.109 24.200 1.632 1.00 22.54 O ATOM 440 CB SER A 28 24.178 25.169 -1.228 1.00 22.54 C ATOM 441 OG SER A 28 23.614 26.467 -1.140 1.00 51.11 O ATOM 0 H SER A 28 21.736 25.048 -1.731 1.00 32.31 H new ATOM 0 HA SER A 28 23.668 23.129 -0.772 1.00 50.44 H new ATOM 0 HB2 SER A 28 25.141 25.152 -0.717 1.00 22.54 H new ATOM 0 HB3 SER A 28 24.367 24.921 -2.272 1.00 22.54 H new ATOM 0 HG SER A 28 24.228 27.118 -1.540 1.00 51.11 H new ATOM 447 N GLN A 29 21.935 24.721 1.344 1.00 65.33 N ATOM 448 CA GLN A 29 21.683 24.970 2.758 1.00 12.55 C ATOM 449 C GLN A 29 21.536 23.659 3.526 1.00 40.41 C ATOM 450 O GLN A 29 21.926 23.563 4.691 1.00 71.43 O ATOM 451 CB GLN A 29 20.421 25.823 2.934 1.00 13.34 C ATOM 452 CG GLN A 29 20.635 27.307 2.661 1.00 42.43 C ATOM 453 CD GLN A 29 20.284 27.711 1.239 1.00 1.54 C ATOM 454 OE1 GLN A 29 20.423 26.927 0.301 1.00 23.32 O ATOM 455 NE2 GLN A 29 19.825 28.945 1.074 1.00 40.23 N ATOM 0 H GLN A 29 21.121 24.854 0.744 1.00 65.33 H new ATOM 0 HA GLN A 29 22.538 25.512 3.161 1.00 12.55 H new ATOM 0 HB2 GLN A 29 19.645 25.449 2.266 1.00 13.34 H new ATOM 0 HB3 GLN A 29 20.051 25.701 3.952 1.00 13.34 H new ATOM 0 HG2 GLN A 29 20.030 27.889 3.357 1.00 42.43 H new ATOM 0 HG3 GLN A 29 21.677 27.559 2.857 1.00 42.43 H new ATOM 0 HE21 GLN A 29 19.725 29.564 1.879 1.00 40.23 H new ATOM 0 HE22 GLN A 29 19.572 29.275 0.142 1.00 40.23 H new ATOM 464 N PHE A 30 20.976 22.650 2.863 1.00 24.33 N ATOM 465 CA PHE A 30 20.781 21.342 3.479 1.00 64.10 C ATOM 466 C PHE A 30 21.876 20.366 3.048 1.00 62.41 C ATOM 467 O PHE A 30 22.070 19.323 3.672 1.00 72.45 O ATOM 468 CB PHE A 30 19.400 20.787 3.117 1.00 0.40 C ATOM 469 CG PHE A 30 19.009 19.572 3.912 1.00 73.03 C ATOM 470 CD1 PHE A 30 19.031 19.597 5.299 1.00 30.11 C ATOM 471 CD2 PHE A 30 18.618 18.406 3.273 1.00 11.20 C ATOM 472 CE1 PHE A 30 18.672 18.482 6.031 1.00 23.22 C ATOM 473 CE2 PHE A 30 18.257 17.288 4.001 1.00 74.13 C ATOM 474 CZ PHE A 30 18.285 17.326 5.382 1.00 21.13 C ATOM 0 H PHE A 30 20.649 22.714 1.899 1.00 24.33 H new ATOM 0 HA PHE A 30 20.840 21.462 4.561 1.00 64.10 H new ATOM 0 HB2 PHE A 30 18.653 21.566 3.270 1.00 0.40 H new ATOM 0 HB3 PHE A 30 19.386 20.536 2.056 1.00 0.40 H new ATOM 0 HD1 PHE A 30 19.332 20.498 5.812 1.00 30.11 H new ATOM 0 HD2 PHE A 30 18.595 18.371 2.194 1.00 11.20 H new ATOM 0 HE1 PHE A 30 18.694 18.514 7.110 1.00 23.22 H new ATOM 0 HE2 PHE A 30 17.953 16.386 3.491 1.00 74.13 H new ATOM 0 HZ PHE A 30 18.005 16.453 5.953 1.00 21.13 H new ATOM 484 N SER A 31 22.591 20.715 1.978 1.00 32.32 N ATOM 485 CA SER A 31 23.673 19.875 1.468 1.00 50.21 C ATOM 486 C SER A 31 24.861 19.893 2.427 1.00 64.30 C ATOM 487 O SER A 31 25.559 18.891 2.589 1.00 12.40 O ATOM 488 CB SER A 31 24.112 20.356 0.082 1.00 63.34 C ATOM 489 OG SER A 31 25.105 19.505 -0.465 1.00 12.04 O ATOM 0 H SER A 31 22.440 21.574 1.448 1.00 32.32 H new ATOM 0 HA SER A 31 23.305 18.852 1.386 1.00 50.21 H new ATOM 0 HB2 SER A 31 23.250 20.389 -0.584 1.00 63.34 H new ATOM 0 HB3 SER A 31 24.499 21.373 0.153 1.00 63.34 H new ATOM 0 HG SER A 31 25.366 19.834 -1.350 1.00 12.04 H new ATOM 781 N SER A 52 3.247 37.609 13.383 1.00 74.33 N ATOM 782 CA SER A 52 3.103 37.312 11.956 1.00 61.41 C ATOM 783 C SER A 52 4.434 37.472 11.220 1.00 74.22 C ATOM 784 O SER A 52 4.668 38.471 10.537 1.00 10.31 O ATOM 785 CB SER A 52 2.027 38.200 11.319 1.00 11.53 C ATOM 786 OG SER A 52 1.780 37.823 9.976 1.00 64.53 O ATOM 0 HA SER A 52 2.790 36.272 11.865 1.00 61.41 H new ATOM 0 HB2 SER A 52 1.105 38.128 11.895 1.00 11.53 H new ATOM 0 HB3 SER A 52 2.344 39.242 11.354 1.00 11.53 H new ATOM 0 HG SER A 52 1.089 38.404 9.595 1.00 64.53 H new ATOM 792 N ALA A 53 5.305 36.481 11.378 1.00 12.45 N ATOM 793 CA ALA A 53 6.612 36.498 10.733 1.00 52.14 C ATOM 794 C ALA A 53 6.546 35.845 9.357 1.00 64.14 C ATOM 795 O ALA A 53 7.017 36.408 8.368 1.00 13.30 O ATOM 796 CB ALA A 53 7.637 35.793 11.608 1.00 34.31 C ATOM 0 H ALA A 53 5.128 35.654 11.949 1.00 12.45 H new ATOM 0 HA ALA A 53 6.918 37.536 10.601 1.00 52.14 H new ATOM 0 HB1 ALA A 53 8.610 35.812 11.116 1.00 34.31 H new ATOM 0 HB2 ALA A 53 7.707 36.302 12.569 1.00 34.31 H new ATOM 0 HB3 ALA A 53 7.330 34.759 11.766 1.00 34.31 H new ATOM 802 N ILE A 54 5.954 34.655 9.304 1.00 15.24 N ATOM 803 CA ILE A 54 5.821 33.915 8.054 1.00 4.43 C ATOM 804 C ILE A 54 4.461 34.175 7.412 1.00 50.54 C ATOM 805 O ILE A 54 3.506 33.433 7.643 1.00 64.03 O ATOM 806 CB ILE A 54 5.983 32.394 8.269 1.00 44.13 C ATOM 807 CG1 ILE A 54 6.912 32.108 9.455 1.00 34.42 C ATOM 808 CG2 ILE A 54 6.513 31.737 7.001 1.00 34.42 C ATOM 809 CD1 ILE A 54 7.108 30.634 9.735 1.00 1.41 C ATOM 0 H ILE A 54 5.558 34.182 10.116 1.00 15.24 H new ATOM 0 HA ILE A 54 6.616 34.266 7.396 1.00 4.43 H new ATOM 0 HB ILE A 54 5.005 31.971 8.497 1.00 44.13 H new ATOM 0 HG12 ILE A 54 7.883 32.564 9.262 1.00 34.42 H new ATOM 0 HG13 ILE A 54 6.506 32.587 10.346 1.00 34.42 H new ATOM 0 HG21 ILE A 54 6.623 30.665 7.165 1.00 34.42 H new ATOM 0 HG22 ILE A 54 5.814 31.909 6.183 1.00 34.42 H new ATOM 0 HG23 ILE A 54 7.482 32.166 6.747 1.00 34.42 H new ATOM 0 HD11 ILE A 54 7.777 30.511 10.587 1.00 1.41 H new ATOM 0 HD12 ILE A 54 6.145 30.175 9.960 1.00 1.41 H new ATOM 0 HD13 ILE A 54 7.543 30.152 8.860 1.00 1.41 H new ATOM 821 N ASN A 55 4.378 35.237 6.615 1.00 54.25 N ATOM 822 CA ASN A 55 3.132 35.593 5.943 1.00 44.55 C ATOM 823 C ASN A 55 3.410 36.421 4.691 1.00 53.32 C ATOM 824 O ASN A 55 3.454 37.652 4.745 1.00 32.33 O ATOM 825 CB ASN A 55 2.215 36.366 6.896 1.00 64.24 C ATOM 826 CG ASN A 55 0.807 36.525 6.353 1.00 15.45 C ATOM 827 OD1 ASN A 55 -0.051 35.555 6.644 1.00 13.12 O flip ATOM 828 ND2 ASN A 55 0.494 37.507 5.680 1.00 60.33 N flip ATOM 0 H ASN A 55 5.157 35.865 6.419 1.00 54.25 H new ATOM 0 HA ASN A 55 2.631 34.673 5.642 1.00 44.55 H new ATOM 0 HB2 ASN A 55 2.174 35.848 7.854 1.00 64.24 H new ATOM 0 HB3 ASN A 55 2.641 37.352 7.084 1.00 64.24 H new ATOM 0 HD21 ASN A 55 1.186 38.230 5.480 1.00 60.33 H new ATOM 0 HD22 ASN A 55 -0.457 37.598 5.322 1.00 60.33 H new ATOM 835 N GLY A 56 3.605 35.736 3.566 1.00 51.01 N ATOM 836 CA GLY A 56 3.877 36.419 2.313 1.00 12.02 C ATOM 837 C GLY A 56 5.336 36.809 2.163 1.00 41.15 C ATOM 838 O GLY A 56 5.857 37.606 2.944 1.00 42.41 O ATOM 0 H GLY A 56 3.579 34.718 3.501 1.00 51.01 H new ATOM 0 HA2 GLY A 56 3.590 35.774 1.483 1.00 12.02 H new ATOM 0 HA3 GLY A 56 3.258 37.314 2.250 1.00 12.02 H new ATOM 842 N ASN A 57 5.995 36.247 1.156 1.00 70.35 N ATOM 843 CA ASN A 57 7.403 36.540 0.904 1.00 14.12 C ATOM 844 C ASN A 57 7.575 37.322 -0.398 1.00 12.55 C ATOM 845 O ASN A 57 6.749 37.215 -1.306 1.00 14.35 O ATOM 846 CB ASN A 57 8.210 35.239 0.846 1.00 40.43 C ATOM 847 CG ASN A 57 8.885 34.909 2.165 1.00 71.24 C ATOM 848 OD1 ASN A 57 9.976 34.341 2.188 1.00 25.14 O ATOM 849 ND2 ASN A 57 8.239 35.258 3.272 1.00 1.21 N ATOM 0 H ASN A 57 5.578 35.586 0.501 1.00 70.35 H new ATOM 0 HA ASN A 57 7.775 37.155 1.724 1.00 14.12 H new ATOM 0 HB2 ASN A 57 7.549 34.419 0.565 1.00 40.43 H new ATOM 0 HB3 ASN A 57 8.967 35.320 0.066 1.00 40.43 H new ATOM 0 HD21 ASN A 57 8.646 35.056 4.185 1.00 1.21 H new ATOM 0 HD22 ASN A 57 7.336 35.728 3.209 1.00 1.21 H new ATOM 856 N PRO A 58 8.654 38.128 -0.501 1.00 4.21 N ATOM 857 CA PRO A 58 8.938 38.928 -1.702 1.00 14.42 C ATOM 858 C PRO A 58 9.425 38.084 -2.883 1.00 2.13 C ATOM 859 O PRO A 58 9.684 38.609 -3.966 1.00 0.21 O ATOM 860 CB PRO A 58 10.043 39.879 -1.237 1.00 72.54 C ATOM 861 CG PRO A 58 10.725 39.165 -0.125 1.00 33.21 C ATOM 862 CD PRO A 58 9.668 38.339 0.555 1.00 42.52 C ATOM 0 HA PRO A 58 8.043 39.429 -2.071 1.00 14.42 H new ATOM 0 HB2 PRO A 58 10.738 40.103 -2.047 1.00 72.54 H new ATOM 0 HB3 PRO A 58 9.629 40.830 -0.900 1.00 72.54 H new ATOM 0 HG2 PRO A 58 11.529 38.533 -0.503 1.00 33.21 H new ATOM 0 HG3 PRO A 58 11.176 39.871 0.572 1.00 33.21 H new ATOM 0 HD2 PRO A 58 10.071 37.393 0.918 1.00 42.52 H new ATOM 0 HD3 PRO A 58 9.247 38.858 1.416 1.00 42.52 H new ATOM 870 N SER A 59 9.548 36.776 -2.667 1.00 22.34 N ATOM 871 CA SER A 59 9.997 35.863 -3.712 1.00 32.21 C ATOM 872 C SER A 59 9.009 34.713 -3.895 1.00 3.10 C ATOM 873 O SER A 59 9.291 33.747 -4.604 1.00 60.44 O ATOM 874 CB SER A 59 11.382 35.312 -3.372 1.00 2.30 C ATOM 875 OG SER A 59 12.361 36.335 -3.393 1.00 74.44 O ATOM 0 H SER A 59 9.342 36.325 -1.775 1.00 22.34 H new ATOM 0 HA SER A 59 10.053 36.420 -4.647 1.00 32.21 H new ATOM 0 HB2 SER A 59 11.359 34.847 -2.386 1.00 2.30 H new ATOM 0 HB3 SER A 59 11.651 34.533 -4.085 1.00 2.30 H new ATOM 0 HG SER A 59 13.236 35.955 -3.170 1.00 74.44 H new ATOM 881 N TRP A 60 7.844 34.830 -3.260 1.00 54.22 N ATOM 882 CA TRP A 60 6.811 33.800 -3.345 1.00 73.23 C ATOM 883 C TRP A 60 5.894 34.037 -4.549 1.00 21.41 C ATOM 884 O TRP A 60 4.926 33.307 -4.763 1.00 4.11 O ATOM 885 CB TRP A 60 5.995 33.773 -2.046 1.00 72.33 C ATOM 886 CG TRP A 60 5.178 32.527 -1.864 1.00 64.10 C ATOM 887 CD1 TRP A 60 5.463 31.278 -2.339 1.00 5.03 C ATOM 888 CD2 TRP A 60 3.942 32.412 -1.150 1.00 71.35 C ATOM 889 NE1 TRP A 60 4.475 30.398 -1.972 1.00 45.43 N ATOM 890 CE2 TRP A 60 3.532 31.068 -1.239 1.00 14.41 C ATOM 891 CE3 TRP A 60 3.140 33.314 -0.444 1.00 2.32 C ATOM 892 CZ2 TRP A 60 2.358 30.606 -0.650 1.00 3.23 C ATOM 893 CZ3 TRP A 60 1.976 32.854 0.141 1.00 0.13 C ATOM 894 CH2 TRP A 60 1.594 31.511 0.036 1.00 54.24 C ATOM 0 H TRP A 60 7.592 35.630 -2.680 1.00 54.22 H new ATOM 0 HA TRP A 60 7.297 32.834 -3.481 1.00 73.23 H new ATOM 0 HB2 TRP A 60 6.674 33.876 -1.200 1.00 72.33 H new ATOM 0 HB3 TRP A 60 5.330 34.637 -2.028 1.00 72.33 H new ATOM 0 HD1 TRP A 60 6.337 31.021 -2.918 1.00 5.03 H new ATOM 0 HE1 TRP A 60 4.448 29.406 -2.207 1.00 45.43 H new ATOM 0 HE3 TRP A 60 3.425 34.352 -0.358 1.00 2.32 H new ATOM 0 HZ2 TRP A 60 2.061 29.571 -0.731 1.00 3.23 H new ATOM 0 HZ3 TRP A 60 1.350 33.542 0.689 1.00 0.13 H new ATOM 0 HH2 TRP A 60 0.678 31.183 0.506 1.00 54.24 H new ATOM 905 N HIS A 61 6.208 35.060 -5.336 1.00 25.52 N ATOM 906 CA HIS A 61 5.419 35.385 -6.520 1.00 54.03 C ATOM 907 C HIS A 61 6.301 35.441 -7.764 1.00 24.45 C ATOM 908 O HIS A 61 6.001 36.155 -8.723 1.00 34.41 O ATOM 909 CB HIS A 61 4.671 36.714 -6.331 1.00 24.23 C ATOM 910 CG HIS A 61 5.495 37.821 -5.744 1.00 61.24 C ATOM 911 ND1 HIS A 61 6.313 38.729 -6.331 1.00 12.42 N flip ATOM 912 CD2 HIS A 61 5.513 38.107 -4.396 1.00 32.11 C flip ATOM 913 CE1 HIS A 61 6.801 39.538 -5.336 1.00 74.03 C flip ATOM 914 NE2 HIS A 61 6.302 39.143 -4.179 1.00 73.22 N flip ATOM 0 H HIS A 61 7.003 35.679 -5.176 1.00 25.52 H new ATOM 0 HA HIS A 61 4.682 34.594 -6.659 1.00 54.03 H new ATOM 0 HB2 HIS A 61 4.287 37.039 -7.298 1.00 24.23 H new ATOM 0 HB3 HIS A 61 3.809 36.541 -5.687 1.00 24.23 H new ATOM 0 HD1 HIS A 61 6.526 38.798 -7.326 1.00 12.42 H new ATOM 0 HD2 HIS A 61 4.967 37.568 -3.636 1.00 32.11 H new ATOM 0 HE1 HIS A 61 7.483 40.364 -5.476 1.00 74.03 H new ATOM 923 N LEU A 62 7.386 34.670 -7.745 1.00 60.23 N ATOM 924 CA LEU A 62 8.318 34.631 -8.866 1.00 53.32 C ATOM 925 C LEU A 62 7.951 33.523 -9.854 1.00 64.45 C ATOM 926 O LEU A 62 7.026 33.688 -10.653 1.00 4.12 O ATOM 927 CB LEU A 62 9.754 34.443 -8.357 1.00 60.31 C ATOM 928 CG LEU A 62 10.602 35.718 -8.280 1.00 5.22 C ATOM 929 CD1 LEU A 62 10.926 36.229 -9.676 1.00 43.25 C ATOM 930 CD2 LEU A 62 9.892 36.794 -7.470 1.00 53.32 C ATOM 0 H LEU A 62 7.640 34.064 -6.965 1.00 60.23 H new ATOM 0 HA LEU A 62 8.253 35.583 -9.393 1.00 53.32 H new ATOM 0 HB2 LEU A 62 9.713 33.995 -7.364 1.00 60.31 H new ATOM 0 HB3 LEU A 62 10.261 33.730 -9.008 1.00 60.31 H new ATOM 0 HG LEU A 62 11.537 35.474 -7.775 1.00 5.22 H new ATOM 0 HD11 LEU A 62 11.528 37.134 -9.601 1.00 43.25 H new ATOM 0 HD12 LEU A 62 11.482 35.467 -10.222 1.00 43.25 H new ATOM 0 HD13 LEU A 62 10.000 36.452 -10.206 1.00 43.25 H new ATOM 0 HD21 LEU A 62 10.513 37.689 -7.430 1.00 53.32 H new ATOM 0 HD22 LEU A 62 8.939 37.035 -7.941 1.00 53.32 H new ATOM 0 HD23 LEU A 62 9.714 36.430 -6.458 1.00 53.32 H new ATOM 942 N ALA A 63 8.675 32.396 -9.785 1.00 74.21 N ATOM 943 CA ALA A 63 8.446 31.253 -10.674 1.00 61.02 C ATOM 944 C ALA A 63 8.480 31.676 -12.144 1.00 53.04 C ATOM 945 O ALA A 63 9.262 32.545 -12.532 1.00 15.12 O ATOM 946 CB ALA A 63 7.124 30.573 -10.336 1.00 32.44 C ATOM 0 H ALA A 63 9.431 32.254 -9.115 1.00 74.21 H new ATOM 0 HA ALA A 63 9.254 30.538 -10.518 1.00 61.02 H new ATOM 0 HB1 ALA A 63 6.969 29.727 -11.005 1.00 32.44 H new ATOM 0 HB2 ALA A 63 7.149 30.221 -9.305 1.00 32.44 H new ATOM 0 HB3 ALA A 63 6.307 31.285 -10.456 1.00 32.44 H new ATOM 952 N ASP A 64 7.637 31.048 -12.959 1.00 13.50 N ATOM 953 CA ASP A 64 7.561 31.372 -14.376 1.00 61.22 C ATOM 954 C ASP A 64 6.184 31.939 -14.715 1.00 52.13 C ATOM 955 O ASP A 64 5.488 31.438 -15.599 1.00 50.40 O ATOM 956 CB ASP A 64 7.858 30.132 -15.224 1.00 24.33 C ATOM 957 CG ASP A 64 9.303 29.686 -15.112 1.00 12.13 C ATOM 958 OD1 ASP A 64 9.540 28.565 -14.616 1.00 72.03 O ATOM 959 OD2 ASP A 64 10.196 30.459 -15.517 1.00 51.52 O1- ATOM 0 H ASP A 64 6.998 30.312 -12.660 1.00 13.50 H new ATOM 0 HA ASP A 64 8.312 32.129 -14.603 1.00 61.22 H new ATOM 0 HB2 ASP A 64 7.204 29.317 -14.912 1.00 24.33 H new ATOM 0 HB3 ASP A 64 7.627 30.345 -16.268 1.00 24.33 H new ATOM 964 N GLU A 65 5.800 32.989 -13.990 1.00 54.02 N ATOM 965 CA GLU A 65 4.510 33.647 -14.191 1.00 23.21 C ATOM 966 C GLU A 65 4.459 34.427 -15.514 1.00 24.42 C ATOM 967 O GLU A 65 3.540 34.217 -16.307 1.00 2.34 O ATOM 968 CB GLU A 65 4.191 34.576 -13.014 1.00 35.22 C ATOM 969 CG GLU A 65 3.724 33.846 -11.765 1.00 42.51 C ATOM 970 CD GLU A 65 2.304 33.331 -11.889 1.00 74.11 C ATOM 971 OE1 GLU A 65 1.365 34.109 -11.620 1.00 14.14 O ATOM 972 OE2 GLU A 65 2.130 32.150 -12.254 1.00 65.12 O1- ATOM 0 H GLU A 65 6.369 33.405 -13.253 1.00 54.02 H new ATOM 0 HA GLU A 65 3.754 32.864 -14.243 1.00 23.21 H new ATOM 0 HB2 GLU A 65 5.080 35.159 -12.772 1.00 35.22 H new ATOM 0 HB3 GLU A 65 3.420 35.283 -13.320 1.00 35.22 H new ATOM 0 HG2 GLU A 65 4.394 33.010 -11.565 1.00 42.51 H new ATOM 0 HG3 GLU A 65 3.790 34.518 -10.910 1.00 42.51 H new ATOM 979 N PRO A 66 5.429 35.342 -15.782 1.00 43.01 N ATOM 980 CA PRO A 66 5.443 36.123 -17.030 1.00 13.12 C ATOM 981 C PRO A 66 5.624 35.247 -18.270 1.00 4.25 C ATOM 982 O PRO A 66 5.047 35.521 -19.323 1.00 42.32 O ATOM 983 CB PRO A 66 6.642 37.064 -16.859 1.00 70.11 C ATOM 984 CG PRO A 66 7.501 36.428 -15.825 1.00 54.50 C ATOM 985 CD PRO A 66 6.568 35.698 -14.905 1.00 23.15 C ATOM 0 HA PRO A 66 4.498 36.643 -17.187 1.00 13.12 H new ATOM 0 HB2 PRO A 66 7.182 37.186 -17.798 1.00 70.11 H new ATOM 0 HB3 PRO A 66 6.320 38.057 -16.545 1.00 70.11 H new ATOM 0 HG2 PRO A 66 8.216 35.743 -16.280 1.00 54.50 H new ATOM 0 HG3 PRO A 66 8.078 37.177 -15.282 1.00 54.50 H new ATOM 0 HD2 PRO A 66 7.037 34.812 -14.477 1.00 23.15 H new ATOM 0 HD3 PRO A 66 6.252 36.326 -14.072 1.00 23.15 H new ATOM 993 N ALA A 67 6.424 34.193 -18.136 1.00 24.23 N ATOM 994 CA ALA A 67 6.673 33.277 -19.240 1.00 34.21 C ATOM 995 C ALA A 67 6.284 31.852 -18.861 1.00 64.33 C ATOM 996 O ALA A 67 7.094 31.099 -18.319 1.00 15.33 O ATOM 997 CB ALA A 67 8.135 33.338 -19.662 1.00 61.20 C ATOM 0 H ALA A 67 6.910 33.954 -17.272 1.00 24.23 H new ATOM 0 HA ALA A 67 6.055 33.584 -20.084 1.00 34.21 H new ATOM 0 HB1 ALA A 67 8.304 32.647 -20.488 1.00 61.20 H new ATOM 0 HB2 ALA A 67 8.380 34.351 -19.980 1.00 61.20 H new ATOM 0 HB3 ALA A 67 8.769 33.059 -18.820 1.00 61.20 H new ATOM 1003 N VAL A 68 5.033 31.493 -19.140 1.00 24.33 N ATOM 1004 CA VAL A 68 4.531 30.159 -18.831 1.00 52.42 C ATOM 1005 C VAL A 68 4.992 29.146 -19.883 1.00 54.54 C ATOM 1006 O VAL A 68 5.013 29.443 -21.080 1.00 22.13 O ATOM 1007 CB VAL A 68 2.984 30.153 -18.720 1.00 52.45 C ATOM 1008 CG1 VAL A 68 2.333 30.591 -20.025 1.00 33.15 C ATOM 1009 CG2 VAL A 68 2.472 28.783 -18.296 1.00 71.52 C ATOM 0 H VAL A 68 4.349 32.109 -19.580 1.00 24.33 H new ATOM 0 HA VAL A 68 4.942 29.868 -17.865 1.00 52.42 H new ATOM 0 HB VAL A 68 2.707 30.873 -17.950 1.00 52.45 H new ATOM 0 HG11 VAL A 68 1.249 30.576 -19.914 1.00 33.15 H new ATOM 0 HG12 VAL A 68 2.658 31.601 -20.273 1.00 33.15 H new ATOM 0 HG13 VAL A 68 2.625 29.910 -20.824 1.00 33.15 H new ATOM 0 HG21 VAL A 68 1.385 28.807 -18.226 1.00 71.52 H new ATOM 0 HG22 VAL A 68 2.772 28.038 -19.033 1.00 71.52 H new ATOM 0 HG23 VAL A 68 2.893 28.522 -17.325 1.00 71.52 H new ATOM 1019 N ASN A 69 5.381 27.957 -19.426 1.00 12.52 N ATOM 1020 CA ASN A 69 5.847 26.908 -20.326 1.00 62.31 C ATOM 1021 C ASN A 69 4.670 26.159 -20.946 1.00 52.35 C ATOM 1022 O ASN A 69 3.936 25.452 -20.254 1.00 12.14 O ATOM 1023 CB ASN A 69 6.757 25.927 -19.581 1.00 64.52 C ATOM 1024 CG ASN A 69 7.449 24.951 -20.517 1.00 44.03 C ATOM 1025 OD1 ASN A 69 7.775 25.289 -21.655 1.00 1.12 O ATOM 1026 ND2 ASN A 69 7.674 23.732 -20.042 1.00 14.02 N ATOM 0 H ASN A 69 5.382 27.698 -18.439 1.00 12.52 H new ATOM 0 HA ASN A 69 6.416 27.381 -21.126 1.00 62.31 H new ATOM 0 HB2 ASN A 69 7.509 26.486 -19.023 1.00 64.52 H new ATOM 0 HB3 ASN A 69 6.167 25.371 -18.852 1.00 64.52 H new ATOM 0 HD21 ASN A 69 8.134 23.034 -20.626 1.00 14.02 H new ATOM 0 HD22 ASN A 69 7.387 23.494 -19.093 1.00 14.02 H new ATOM 1033 N GLY A 70 4.499 26.324 -22.254 1.00 41.10 N ATOM 1034 CA GLY A 70 3.417 25.657 -22.953 1.00 22.11 C ATOM 1035 C GLY A 70 3.908 24.519 -23.826 1.00 22.11 C ATOM 1036 O GLY A 70 3.206 24.081 -24.738 1.00 72.54 O ATOM 0 H GLY A 70 5.092 26.909 -22.843 1.00 41.10 H new ATOM 0 HA2 GLY A 70 2.702 25.271 -22.226 1.00 22.11 H new ATOM 0 HA3 GLY A 70 2.885 26.381 -23.570 1.00 22.11 H new ATOM 1040 N ALA A 71 5.120 24.042 -23.548 1.00 32.52 N ATOM 1041 CA ALA A 71 5.707 22.949 -24.311 1.00 73.22 C ATOM 1042 C ALA A 71 5.356 21.600 -23.691 1.00 30.32 C ATOM 1043 O ALA A 71 4.685 20.781 -24.320 1.00 20.43 O ATOM 1044 CB ALA A 71 7.217 23.118 -24.404 1.00 43.24 C ATOM 0 H ALA A 71 5.713 24.398 -22.798 1.00 32.52 H new ATOM 0 HA ALA A 71 5.291 22.975 -25.318 1.00 73.22 H new ATOM 0 HB1 ALA A 71 7.641 22.293 -24.977 1.00 43.24 H new ATOM 0 HB2 ALA A 71 7.448 24.061 -24.900 1.00 43.24 H new ATOM 0 HB3 ALA A 71 7.645 23.121 -23.402 1.00 43.24 H new ATOM 1050 N THR A 72 5.813 21.387 -22.452 1.00 74.51 N ATOM 1051 CA THR A 72 5.561 20.143 -21.721 1.00 32.31 C ATOM 1052 C THR A 72 6.206 18.948 -22.426 1.00 34.30 C ATOM 1053 O THR A 72 5.583 18.289 -23.261 1.00 52.30 O ATOM 1054 CB THR A 72 4.049 19.884 -21.534 1.00 41.01 C ATOM 1055 OG1 THR A 72 3.418 21.047 -20.981 1.00 34.24 O ATOM 1056 CG2 THR A 72 3.804 18.694 -20.618 1.00 71.34 C ATOM 0 H THR A 72 6.365 22.069 -21.931 1.00 74.51 H new ATOM 0 HA THR A 72 6.013 20.260 -20.736 1.00 32.31 H new ATOM 0 HB THR A 72 3.623 19.662 -22.512 1.00 41.01 H new ATOM 0 HG1 THR A 72 2.460 20.876 -20.867 1.00 34.24 H new ATOM 0 HG21 THR A 72 2.731 18.536 -20.505 1.00 71.34 H new ATOM 0 HG22 THR A 72 4.258 17.803 -21.050 1.00 71.34 H new ATOM 0 HG23 THR A 72 4.246 18.890 -19.641 1.00 71.34 H new ATOM 1064 N GLY A 73 7.463 18.680 -22.088 1.00 71.44 N ATOM 1065 CA GLY A 73 8.175 17.574 -22.700 1.00 14.10 C ATOM 1066 C GLY A 73 8.703 16.583 -21.682 1.00 53.25 C ATOM 1067 O GLY A 73 9.883 16.231 -21.705 1.00 51.51 O ATOM 0 H GLY A 73 8.001 19.209 -21.401 1.00 71.44 H new ATOM 0 HA2 GLY A 73 7.510 17.058 -23.392 1.00 14.10 H new ATOM 0 HA3 GLY A 73 9.007 17.963 -23.287 1.00 14.10 H new ATOM 1071 N HIS A 74 7.826 16.132 -20.789 1.00 3.13 N ATOM 1072 CA HIS A 74 8.205 15.168 -19.759 1.00 25.33 C ATOM 1073 C HIS A 74 8.327 13.763 -20.351 1.00 21.44 C ATOM 1074 O HIS A 74 9.019 12.905 -19.803 1.00 51.01 O ATOM 1075 CB HIS A 74 7.185 15.180 -18.609 1.00 20.21 C ATOM 1076 CG HIS A 74 5.814 14.706 -18.996 1.00 74.00 C ATOM 1077 ND1 HIS A 74 4.954 15.447 -19.778 1.00 3.44 N ATOM 1078 CD2 HIS A 74 5.162 13.555 -18.710 1.00 2.52 C ATOM 1079 CE1 HIS A 74 3.833 14.773 -19.956 1.00 10.44 C ATOM 1080 NE2 HIS A 74 3.934 13.622 -19.320 1.00 13.23 N ATOM 0 H HIS A 74 6.848 16.419 -20.758 1.00 3.13 H new ATOM 0 HA HIS A 74 9.178 15.457 -19.362 1.00 25.33 H new ATOM 0 HB2 HIS A 74 7.559 14.552 -17.800 1.00 20.21 H new ATOM 0 HB3 HIS A 74 7.109 16.194 -18.216 1.00 20.21 H new ATOM 0 HD2 HIS A 74 5.538 12.737 -18.113 1.00 2.52 H new ATOM 0 HE1 HIS A 74 2.978 15.107 -20.526 1.00 10.44 H new ATOM 0 HE2 HIS A 74 3.216 12.899 -19.287 1.00 13.23 H new ATOM 1089 N SER A 75 7.646 13.543 -21.475 1.00 22.24 N ATOM 1090 CA SER A 75 7.671 12.253 -22.155 1.00 71.32 C ATOM 1091 C SER A 75 8.839 12.176 -23.133 1.00 3.04 C ATOM 1092 O SER A 75 9.383 11.099 -23.379 1.00 40.42 O ATOM 1093 CB SER A 75 6.354 12.021 -22.896 1.00 64.34 C ATOM 1094 OG SER A 75 6.072 13.089 -23.784 1.00 61.11 O ATOM 0 H SER A 75 7.068 14.247 -21.934 1.00 22.24 H new ATOM 0 HA SER A 75 7.800 11.475 -21.403 1.00 71.32 H new ATOM 0 HB2 SER A 75 6.407 11.085 -23.453 1.00 64.34 H new ATOM 0 HB3 SER A 75 5.542 11.918 -22.176 1.00 64.34 H new ATOM 0 HG SER A 75 5.154 13.401 -23.639 1.00 61.11 H new ATOM 1100 N SER A 76 9.218 13.327 -23.688 1.00 54.44 N ATOM 1101 CA SER A 76 10.324 13.399 -24.639 1.00 15.10 C ATOM 1102 C SER A 76 11.652 13.132 -23.939 1.00 53.35 C ATOM 1103 O SER A 76 12.501 12.402 -24.451 1.00 23.24 O ATOM 1104 CB SER A 76 10.355 14.772 -25.313 1.00 73.21 C ATOM 1105 OG SER A 76 9.145 15.028 -26.004 1.00 73.30 O ATOM 0 H SER A 76 8.773 14.224 -23.494 1.00 54.44 H new ATOM 0 HA SER A 76 10.172 12.634 -25.400 1.00 15.10 H new ATOM 0 HB2 SER A 76 10.520 15.545 -24.563 1.00 73.21 H new ATOM 0 HB3 SER A 76 11.192 14.820 -26.009 1.00 73.21 H new ATOM 0 HG SER A 76 9.189 15.912 -26.425 1.00 73.30 H new ATOM 1111 N SER A 77 11.820 13.730 -22.764 1.00 50.20 N ATOM 1112 CA SER A 77 13.035 13.555 -21.981 1.00 40.52 C ATOM 1113 C SER A 77 12.699 13.008 -20.596 1.00 25.42 C ATOM 1114 O SER A 77 12.519 13.767 -19.642 1.00 12.15 O ATOM 1115 CB SER A 77 13.790 14.881 -21.860 1.00 12.03 C ATOM 1116 OG SER A 77 15.017 14.710 -21.171 1.00 2.11 O ATOM 0 H SER A 77 11.127 14.342 -22.333 1.00 50.20 H new ATOM 0 HA SER A 77 13.676 12.838 -22.493 1.00 40.52 H new ATOM 0 HB2 SER A 77 13.981 15.286 -22.854 1.00 12.03 H new ATOM 0 HB3 SER A 77 13.172 15.608 -21.333 1.00 12.03 H new ATOM 0 HG SER A 77 15.480 15.571 -21.109 1.00 2.11 H new ATOM 1122 N LEU A 78 12.599 11.685 -20.498 1.00 45.32 N ATOM 1123 CA LEU A 78 12.284 11.035 -19.231 1.00 1.43 C ATOM 1124 C LEU A 78 13.485 10.262 -18.689 1.00 1.33 C ATOM 1125 O LEU A 78 13.483 9.849 -17.529 1.00 32.03 O ATOM 1126 CB LEU A 78 11.071 10.102 -19.381 1.00 62.23 C ATOM 1127 CG LEU A 78 10.914 9.413 -20.744 1.00 4.35 C ATOM 1128 CD1 LEU A 78 11.947 8.311 -20.928 1.00 12.55 C ATOM 1129 CD2 LEU A 78 9.508 8.850 -20.889 1.00 53.04 C ATOM 0 H LEU A 78 12.731 11.044 -21.280 1.00 45.32 H new ATOM 0 HA LEU A 78 12.034 11.817 -18.514 1.00 1.43 H new ATOM 0 HB2 LEU A 78 11.133 9.332 -18.612 1.00 62.23 H new ATOM 0 HB3 LEU A 78 10.168 10.679 -19.182 1.00 62.23 H new ATOM 0 HG LEU A 78 11.079 10.160 -21.521 1.00 4.35 H new ATOM 0 HD11 LEU A 78 11.810 7.842 -21.903 1.00 12.55 H new ATOM 0 HD12 LEU A 78 12.948 8.737 -20.868 1.00 12.55 H new ATOM 0 HD13 LEU A 78 11.824 7.563 -20.145 1.00 12.55 H new ATOM 0 HD21 LEU A 78 9.409 8.364 -21.860 1.00 53.04 H new ATOM 0 HD22 LEU A 78 9.324 8.123 -20.098 1.00 53.04 H new ATOM 0 HD23 LEU A 78 8.782 9.660 -20.813 1.00 53.04 H new ATOM 1141 N ASP A 79 14.503 10.083 -19.544 1.00 4.20 N ATOM 1142 CA ASP A 79 15.732 9.360 -19.191 1.00 44.32 C ATOM 1143 C ASP A 79 15.463 7.874 -18.948 1.00 33.32 C ATOM 1144 O ASP A 79 15.685 7.050 -19.837 1.00 63.14 O ATOM 1145 CB ASP A 79 16.414 9.987 -17.968 1.00 21.32 C ATOM 1146 CG ASP A 79 17.103 11.296 -18.300 1.00 24.35 C ATOM 1147 OD1 ASP A 79 18.345 11.297 -18.427 1.00 44.45 O ATOM 1148 OD2 ASP A 79 16.400 12.320 -18.436 1.00 14.03 O1- ATOM 0 H ASP A 79 14.496 10.436 -20.501 1.00 4.20 H new ATOM 0 HA ASP A 79 16.408 9.444 -20.042 1.00 44.32 H new ATOM 0 HB2 ASP A 79 15.671 10.158 -17.189 1.00 21.32 H new ATOM 0 HB3 ASP A 79 17.145 9.287 -17.564 1.00 21.32 H new ATOM 1153 N ALA A 80 14.996 7.548 -17.737 1.00 3.21 N ATOM 1154 CA ALA A 80 14.683 6.171 -17.349 1.00 40.04 C ATOM 1155 C ALA A 80 15.925 5.281 -17.368 1.00 24.34 C ATOM 1156 O ALA A 80 15.866 4.123 -17.784 1.00 30.50 O ATOM 1157 CB ALA A 80 13.587 5.595 -18.239 1.00 74.44 C ATOM 0 H ALA A 80 14.825 8.232 -17.000 1.00 3.21 H new ATOM 0 HA ALA A 80 14.316 6.195 -16.323 1.00 40.04 H new ATOM 0 HB1 ALA A 80 13.370 4.571 -17.933 1.00 74.44 H new ATOM 0 HB2 ALA A 80 12.686 6.201 -18.144 1.00 74.44 H new ATOM 0 HB3 ALA A 80 13.920 5.601 -19.277 1.00 74.44 H new ATOM 1163 N ARG A 81 17.049 5.829 -16.907 1.00 45.31 N ATOM 1164 CA ARG A 81 18.303 5.083 -16.856 1.00 23.14 C ATOM 1165 C ARG A 81 18.281 4.085 -15.703 1.00 60.05 C ATOM 1166 O ARG A 81 18.777 2.965 -15.828 1.00 31.14 O ATOM 1167 CB ARG A 81 19.491 6.037 -16.701 1.00 43.53 C ATOM 1168 CG ARG A 81 20.231 6.317 -18.001 1.00 62.34 C ATOM 1169 CD ARG A 81 19.377 7.108 -18.979 1.00 33.32 C ATOM 1170 NE ARG A 81 20.112 7.446 -20.195 1.00 51.30 N ATOM 1171 CZ ARG A 81 19.565 8.041 -21.252 1.00 65.54 C ATOM 1172 NH1 ARG A 81 18.279 8.365 -21.247 1.00 5.44 N1+ ATOM 1173 NH2 ARG A 81 20.306 8.314 -22.315 1.00 2.11 N ATOM 0 H ARG A 81 17.115 6.787 -16.564 1.00 45.31 H new ATOM 0 HA ARG A 81 18.414 4.537 -17.793 1.00 23.14 H new ATOM 0 HB2 ARG A 81 19.135 6.980 -16.287 1.00 43.53 H new ATOM 0 HB3 ARG A 81 20.191 5.616 -15.979 1.00 43.53 H new ATOM 0 HG2 ARG A 81 21.145 6.871 -17.787 1.00 62.34 H new ATOM 0 HG3 ARG A 81 20.529 5.374 -18.459 1.00 62.34 H new ATOM 0 HD2 ARG A 81 18.492 6.528 -19.239 1.00 33.32 H new ATOM 0 HD3 ARG A 81 19.029 8.023 -18.499 1.00 33.32 H new ATOM 0 HE ARG A 81 21.104 7.212 -20.236 1.00 51.30 H new ATOM 0 HH11 ARG A 81 17.704 8.158 -20.430 1.00 5.44 H new ATOM 0 HH12 ARG A 81 17.865 8.821 -22.060 1.00 5.44 H new ATOM 0 HH21 ARG A 81 21.296 8.068 -22.323 1.00 2.11 H new ATOM 0 HH22 ARG A 81 19.887 8.770 -23.125 1.00 2.11 H new ATOM 1187 N GLU A 82 17.700 4.503 -14.581 1.00 70.12 N ATOM 1188 CA GLU A 82 17.594 3.648 -13.403 1.00 23.31 C ATOM 1189 C GLU A 82 16.176 3.095 -13.271 1.00 4.31 C ATOM 1190 O GLU A 82 15.922 2.211 -12.451 1.00 72.35 O ATOM 1191 CB GLU A 82 17.969 4.421 -12.132 1.00 20.40 C ATOM 1192 CG GLU A 82 19.462 4.675 -11.970 1.00 15.22 C ATOM 1193 CD GLU A 82 19.968 5.810 -12.840 1.00 12.33 C ATOM 1194 OE1 GLU A 82 19.496 6.953 -12.659 1.00 34.55 O ATOM 1195 OE2 GLU A 82 20.839 5.557 -13.698 1.00 22.15 O1- ATOM 0 H GLU A 82 17.295 5.432 -14.463 1.00 70.12 H new ATOM 0 HA GLU A 82 18.290 2.819 -13.526 1.00 23.31 H new ATOM 0 HB2 GLU A 82 17.448 5.378 -12.136 1.00 20.40 H new ATOM 0 HB3 GLU A 82 17.610 3.867 -11.265 1.00 20.40 H new ATOM 0 HG2 GLU A 82 19.675 4.902 -10.925 1.00 15.22 H new ATOM 0 HG3 GLU A 82 20.009 3.765 -12.216 1.00 15.22 H new ATOM 1202 N VAL A 83 15.265 3.623 -14.102 1.00 0.31 N ATOM 1203 CA VAL A 83 13.853 3.216 -14.108 1.00 11.23 C ATOM 1204 C VAL A 83 13.238 3.359 -12.707 1.00 23.34 C ATOM 1205 O VAL A 83 13.568 4.305 -11.992 1.00 54.21 O ATOM 1206 CB VAL A 83 13.660 1.769 -14.641 1.00 21.33 C ATOM 1207 CG1 VAL A 83 12.287 1.610 -15.283 1.00 15.22 C ATOM 1208 CG2 VAL A 83 14.748 1.401 -15.643 1.00 54.14 C ATOM 0 H VAL A 83 15.487 4.344 -14.788 1.00 0.31 H new ATOM 0 HA VAL A 83 13.332 3.886 -14.792 1.00 11.23 H new ATOM 0 HB VAL A 83 13.733 1.092 -13.790 1.00 21.33 H new ATOM 0 HG11 VAL A 83 12.173 0.590 -15.649 1.00 15.22 H new ATOM 0 HG12 VAL A 83 11.513 1.819 -14.544 1.00 15.22 H new ATOM 0 HG13 VAL A 83 12.192 2.307 -16.115 1.00 15.22 H new ATOM 0 HG21 VAL A 83 14.586 0.383 -15.998 1.00 54.14 H new ATOM 0 HG22 VAL A 83 14.713 2.090 -16.487 1.00 54.14 H new ATOM 0 HG23 VAL A 83 15.724 1.467 -15.161 1.00 54.14 H new ATOM 1218 N ILE A 84 12.346 2.418 -12.335 1.00 35.11 N ATOM 1219 CA ILE A 84 11.655 2.396 -11.025 1.00 61.14 C ATOM 1220 C ILE A 84 10.860 3.693 -10.757 1.00 21.13 C ATOM 1221 O ILE A 84 11.009 4.681 -11.477 1.00 13.15 O ATOM 1222 CB ILE A 84 12.625 2.080 -9.843 1.00 74.23 C ATOM 1223 CG1 ILE A 84 13.283 3.347 -9.281 1.00 62.43 C ATOM 1224 CG2 ILE A 84 13.686 1.077 -10.277 1.00 74.14 C ATOM 1225 CD1 ILE A 84 14.080 3.104 -8.017 1.00 70.13 C ATOM 0 H ILE A 84 12.081 1.642 -12.942 1.00 35.11 H new ATOM 0 HA ILE A 84 10.936 1.578 -11.083 1.00 61.14 H new ATOM 0 HB ILE A 84 12.028 1.642 -9.043 1.00 74.23 H new ATOM 0 HG12 ILE A 84 13.940 3.772 -10.039 1.00 62.43 H new ATOM 0 HG13 ILE A 84 12.510 4.088 -9.077 1.00 62.43 H new ATOM 0 HG21 ILE A 84 14.353 0.868 -9.441 1.00 74.14 H new ATOM 0 HG22 ILE A 84 13.204 0.153 -10.596 1.00 74.14 H new ATOM 0 HG23 ILE A 84 14.261 1.491 -11.105 1.00 74.14 H new ATOM 0 HD11 ILE A 84 14.517 4.043 -7.676 1.00 70.13 H new ATOM 0 HD12 ILE A 84 13.423 2.707 -7.243 1.00 70.13 H new ATOM 0 HD13 ILE A 84 14.875 2.387 -8.220 1.00 70.13 H new ATOM 1237 N PRO A 85 9.960 3.701 -9.743 1.00 21.13 N ATOM 1238 CA PRO A 85 9.161 4.890 -9.418 1.00 73.14 C ATOM 1239 C PRO A 85 9.942 5.953 -8.637 1.00 50.23 C ATOM 1240 O PRO A 85 9.457 6.478 -7.634 1.00 4.23 O ATOM 1241 CB PRO A 85 8.027 4.324 -8.564 1.00 31.44 C ATOM 1242 CG PRO A 85 8.588 3.106 -7.921 1.00 53.42 C ATOM 1243 CD PRO A 85 9.625 2.556 -8.866 1.00 70.04 C ATOM 0 HA PRO A 85 8.830 5.407 -10.319 1.00 73.14 H new ATOM 0 HB2 PRO A 85 7.699 5.047 -7.817 1.00 31.44 H new ATOM 0 HB3 PRO A 85 7.158 4.081 -9.176 1.00 31.44 H new ATOM 0 HG2 PRO A 85 9.033 3.348 -6.956 1.00 53.42 H new ATOM 0 HG3 PRO A 85 7.805 2.371 -7.735 1.00 53.42 H new ATOM 0 HD2 PRO A 85 10.502 2.196 -8.329 1.00 70.04 H new ATOM 0 HD3 PRO A 85 9.235 1.715 -9.440 1.00 70.04 H new ATOM 1251 N MET A 86 11.141 6.284 -9.116 1.00 73.33 N ATOM 1252 CA MET A 86 11.978 7.284 -8.462 1.00 75.42 C ATOM 1253 C MET A 86 12.747 8.115 -9.487 1.00 34.14 C ATOM 1254 O MET A 86 12.726 9.344 -9.444 1.00 74.12 O ATOM 1255 CB MET A 86 12.962 6.609 -7.505 1.00 64.02 C ATOM 1256 CG MET A 86 13.714 7.584 -6.615 1.00 53.43 C ATOM 1257 SD MET A 86 14.924 6.771 -5.553 1.00 12.41 S ATOM 1258 CE MET A 86 16.204 6.365 -6.740 1.00 21.53 C ATOM 0 H MET A 86 11.552 5.873 -9.954 1.00 73.33 H new ATOM 0 HA MET A 86 11.324 7.949 -7.898 1.00 75.42 H new ATOM 0 HB2 MET A 86 12.418 5.903 -6.877 1.00 64.02 H new ATOM 0 HB3 MET A 86 13.681 6.031 -8.085 1.00 64.02 H new ATOM 0 HG2 MET A 86 14.221 8.321 -7.238 1.00 53.43 H new ATOM 0 HG3 MET A 86 13.001 8.128 -5.995 1.00 53.43 H new ATOM 0 HE1 MET A 86 16.364 5.287 -6.748 1.00 21.53 H new ATOM 0 HE2 MET A 86 15.897 6.693 -7.733 1.00 21.53 H new ATOM 0 HE3 MET A 86 17.130 6.868 -6.462 1.00 21.53 H new ATOM 1268 N ALA A 87 13.425 7.434 -10.406 1.00 54.22 N ATOM 1269 CA ALA A 87 14.214 8.106 -11.433 1.00 53.42 C ATOM 1270 C ALA A 87 13.394 8.375 -12.691 1.00 13.41 C ATOM 1271 O ALA A 87 13.594 9.386 -13.367 1.00 23.33 O ATOM 1272 CB ALA A 87 15.441 7.275 -11.773 1.00 24.21 C ATOM 0 H ALA A 87 13.444 6.416 -10.460 1.00 54.22 H new ATOM 0 HA ALA A 87 14.529 9.070 -11.033 1.00 53.42 H new ATOM 0 HB1 ALA A 87 16.024 7.784 -12.540 1.00 24.21 H new ATOM 0 HB2 ALA A 87 16.052 7.145 -10.879 1.00 24.21 H new ATOM 0 HB3 ALA A 87 15.128 6.299 -12.143 1.00 24.21 H new ATOM 1278 N ALA A 88 12.472 7.467 -13.001 1.00 61.15 N ATOM 1279 CA ALA A 88 11.625 7.607 -14.181 1.00 45.52 C ATOM 1280 C ALA A 88 10.504 8.615 -13.942 1.00 75.23 C ATOM 1281 O ALA A 88 10.064 9.297 -14.868 1.00 22.52 O ATOM 1282 CB ALA A 88 11.049 6.257 -14.579 1.00 71.22 C ATOM 0 H ALA A 88 12.293 6.627 -12.451 1.00 61.15 H new ATOM 0 HA ALA A 88 12.243 7.982 -14.997 1.00 45.52 H new ATOM 0 HB1 ALA A 88 10.419 6.376 -15.461 1.00 71.22 H new ATOM 0 HB2 ALA A 88 11.862 5.567 -14.804 1.00 71.22 H new ATOM 0 HB3 ALA A 88 10.453 5.860 -13.758 1.00 71.22 H new ATOM 1288 N VAL A 89 10.052 8.708 -12.694 1.00 43.51 N ATOM 1289 CA VAL A 89 8.981 9.634 -12.334 1.00 55.25 C ATOM 1290 C VAL A 89 9.543 11.006 -11.967 1.00 52.21 C ATOM 1291 O VAL A 89 8.794 11.968 -11.795 1.00 54.11 O ATOM 1292 CB VAL A 89 8.136 9.098 -11.159 1.00 14.41 C ATOM 1293 CG1 VAL A 89 6.734 9.691 -11.188 1.00 23.12 C ATOM 1294 CG2 VAL A 89 8.075 7.580 -11.193 1.00 12.30 C ATOM 0 H VAL A 89 10.410 8.154 -11.916 1.00 43.51 H new ATOM 0 HA VAL A 89 8.339 9.730 -13.210 1.00 55.25 H new ATOM 0 HB VAL A 89 8.615 9.402 -10.228 1.00 14.41 H new ATOM 0 HG11 VAL A 89 6.156 9.299 -10.351 1.00 23.12 H new ATOM 0 HG12 VAL A 89 6.796 10.776 -11.110 1.00 23.12 H new ATOM 0 HG13 VAL A 89 6.245 9.422 -12.124 1.00 23.12 H new ATOM 0 HG21 VAL A 89 7.475 7.221 -10.357 1.00 12.30 H new ATOM 0 HG22 VAL A 89 7.623 7.255 -12.130 1.00 12.30 H new ATOM 0 HG23 VAL A 89 9.083 7.174 -11.117 1.00 12.30 H new ATOM 1304 N LYS A 90 10.868 11.090 -11.848 1.00 23.33 N ATOM 1305 CA LYS A 90 11.530 12.348 -11.517 1.00 35.54 C ATOM 1306 C LYS A 90 11.396 13.334 -12.672 1.00 30.13 C ATOM 1307 O LYS A 90 11.203 14.531 -12.465 1.00 54.30 O ATOM 1308 CB LYS A 90 13.009 12.108 -11.204 1.00 23.43 C ATOM 1309 CG LYS A 90 13.723 13.336 -10.658 1.00 23.05 C ATOM 1310 CD LYS A 90 15.215 13.098 -10.472 1.00 34.41 C ATOM 1311 CE LYS A 90 15.515 12.334 -9.189 1.00 51.13 C ATOM 1312 NZ LYS A 90 15.369 10.863 -9.362 1.00 65.32 N1+ ATOM 0 H LYS A 90 11.502 10.301 -11.976 1.00 23.33 H new ATOM 0 HA LYS A 90 11.049 12.769 -10.634 1.00 35.54 H new ATOM 0 HB2 LYS A 90 13.092 11.298 -10.480 1.00 23.43 H new ATOM 0 HB3 LYS A 90 13.515 11.777 -12.111 1.00 23.43 H new ATOM 0 HG2 LYS A 90 13.573 14.174 -11.338 1.00 23.05 H new ATOM 0 HG3 LYS A 90 13.280 13.617 -9.703 1.00 23.05 H new ATOM 0 HD2 LYS A 90 15.602 12.541 -11.325 1.00 34.41 H new ATOM 0 HD3 LYS A 90 15.735 14.056 -10.454 1.00 34.41 H new ATOM 0 HE2 LYS A 90 16.530 12.560 -8.862 1.00 51.13 H new ATOM 0 HE3 LYS A 90 14.843 12.674 -8.401 1.00 51.13 H new ATOM 0 HZ1 LYS A 90 15.971 10.371 -8.672 1.00 65.32 H new ATOM 0 HZ2 LYS A 90 14.376 10.592 -9.210 1.00 65.32 H new ATOM 0 HZ3 LYS A 90 15.657 10.596 -10.325 1.00 65.32 H new ATOM 1326 N GLN A 91 11.492 12.813 -13.892 1.00 32.23 N ATOM 1327 CA GLN A 91 11.372 13.635 -15.087 1.00 13.32 C ATOM 1328 C GLN A 91 9.910 13.753 -15.513 1.00 4.30 C ATOM 1329 O GLN A 91 9.556 14.614 -16.319 1.00 74.41 O ATOM 1330 CB GLN A 91 12.207 13.047 -16.226 1.00 31.23 C ATOM 1331 CG GLN A 91 13.679 12.858 -15.878 1.00 63.44 C ATOM 1332 CD GLN A 91 14.439 14.168 -15.750 1.00 72.42 C ATOM 1333 OE1 GLN A 91 13.886 15.193 -15.352 1.00 73.13 O ATOM 1334 NE2 GLN A 91 15.721 14.138 -16.093 1.00 22.03 N ATOM 0 H GLN A 91 11.653 11.823 -14.077 1.00 32.23 H new ATOM 0 HA GLN A 91 11.748 14.632 -14.856 1.00 13.32 H new ATOM 0 HB2 GLN A 91 11.785 12.084 -16.513 1.00 31.23 H new ATOM 0 HB3 GLN A 91 12.130 13.701 -17.095 1.00 31.23 H new ATOM 0 HG2 GLN A 91 13.756 12.308 -14.940 1.00 63.44 H new ATOM 0 HG3 GLN A 91 14.151 12.245 -16.646 1.00 63.44 H new ATOM 0 HE21 GLN A 91 16.142 13.268 -16.418 1.00 22.03 H new ATOM 0 HE22 GLN A 91 16.285 14.985 -16.031 1.00 22.03 H new ATOM 1343 N ALA A 92 9.067 12.879 -14.960 1.00 50.43 N ATOM 1344 CA ALA A 92 7.640 12.884 -15.265 1.00 24.00 C ATOM 1345 C ALA A 92 6.922 13.970 -14.471 1.00 22.41 C ATOM 1346 O ALA A 92 5.886 14.478 -14.894 1.00 10.13 O ATOM 1347 CB ALA A 92 7.030 11.522 -14.970 1.00 21.40 C ATOM 0 H ALA A 92 9.352 12.158 -14.297 1.00 50.43 H new ATOM 0 HA ALA A 92 7.518 13.098 -16.327 1.00 24.00 H new ATOM 0 HB1 ALA A 92 5.965 11.542 -15.203 1.00 21.40 H new ATOM 0 HB2 ALA A 92 7.521 10.764 -15.580 1.00 21.40 H new ATOM 0 HB3 ALA A 92 7.166 11.283 -13.915 1.00 21.40 H new ATOM 1353 N LEU A 93 7.483 14.317 -13.315 1.00 71.20 N ATOM 1354 CA LEU A 93 6.913 15.352 -12.459 1.00 55.44 C ATOM 1355 C LEU A 93 7.704 16.651 -12.593 1.00 13.40 C ATOM 1356 O LEU A 93 7.562 17.567 -11.782 1.00 52.35 O ATOM 1357 CB LEU A 93 6.905 14.891 -10.998 1.00 70.05 C ATOM 1358 CG LEU A 93 5.983 13.708 -10.690 1.00 1.23 C ATOM 1359 CD1 LEU A 93 6.213 13.210 -9.272 1.00 33.44 C ATOM 1360 CD2 LEU A 93 4.526 14.099 -10.885 1.00 51.40 C ATOM 0 H LEU A 93 8.336 13.894 -12.949 1.00 71.20 H new ATOM 0 HA LEU A 93 5.886 15.533 -12.776 1.00 55.44 H new ATOM 0 HB2 LEU A 93 7.922 14.621 -10.714 1.00 70.05 H new ATOM 0 HB3 LEU A 93 6.611 15.732 -10.370 1.00 70.05 H new ATOM 0 HG LEU A 93 6.218 12.901 -11.384 1.00 1.23 H new ATOM 0 HD11 LEU A 93 5.550 12.369 -9.070 1.00 33.44 H new ATOM 0 HD12 LEU A 93 7.249 12.889 -9.163 1.00 33.44 H new ATOM 0 HD13 LEU A 93 6.005 14.014 -8.566 1.00 33.44 H new ATOM 0 HD21 LEU A 93 3.887 13.245 -10.661 1.00 51.40 H new ATOM 0 HD22 LEU A 93 4.278 14.923 -10.216 1.00 51.40 H new ATOM 0 HD23 LEU A 93 4.368 14.410 -11.918 1.00 51.40 H new ATOM 1372 N ARG A 94 8.535 16.719 -13.630 1.00 75.25 N ATOM 1373 CA ARG A 94 9.358 17.894 -13.889 1.00 35.44 C ATOM 1374 C ARG A 94 8.620 18.898 -14.772 1.00 1.44 C ATOM 1375 O ARG A 94 8.518 20.078 -14.434 1.00 14.23 O ATOM 1376 CB ARG A 94 10.667 17.471 -14.561 1.00 13.12 C ATOM 1377 CG ARG A 94 11.533 18.635 -15.014 1.00 23.13 C ATOM 1378 CD ARG A 94 12.637 18.169 -15.947 1.00 73.14 C ATOM 1379 NE ARG A 94 13.494 19.270 -16.379 1.00 61.42 N ATOM 1380 CZ ARG A 94 14.534 19.119 -17.194 1.00 60.12 C ATOM 1381 NH1 ARG A 94 14.845 17.919 -17.665 1.00 11.13 N1+ ATOM 1382 NH2 ARG A 94 15.263 20.170 -17.539 1.00 5.33 N ATOM 0 H ARG A 94 8.655 15.967 -14.309 1.00 75.25 H new ATOM 0 HA ARG A 94 9.577 18.376 -12.936 1.00 35.44 H new ATOM 0 HB2 ARG A 94 11.238 16.855 -13.866 1.00 13.12 H new ATOM 0 HB3 ARG A 94 10.435 16.846 -15.424 1.00 13.12 H new ATOM 0 HG2 ARG A 94 10.914 19.376 -15.520 1.00 23.13 H new ATOM 0 HG3 ARG A 94 11.971 19.125 -14.145 1.00 23.13 H new ATOM 0 HD2 ARG A 94 13.242 17.415 -15.443 1.00 73.14 H new ATOM 0 HD3 ARG A 94 12.194 17.691 -16.821 1.00 73.14 H new ATOM 0 HE ARG A 94 13.283 20.207 -16.036 1.00 61.42 H new ATOM 0 HH11 ARG A 94 14.286 17.107 -17.402 1.00 11.13 H new ATOM 0 HH12 ARG A 94 15.643 17.808 -18.290 1.00 11.13 H new ATOM 0 HH21 ARG A 94 15.027 21.095 -17.180 1.00 5.33 H new ATOM 0 HH22 ARG A 94 16.061 20.054 -18.164 1.00 5.33 H new ATOM 1396 N GLU A 95 8.109 18.423 -15.905 1.00 71.54 N ATOM 1397 CA GLU A 95 7.390 19.284 -16.838 1.00 74.44 C ATOM 1398 C GLU A 95 5.897 18.962 -16.858 1.00 64.42 C ATOM 1399 O GLU A 95 5.172 19.399 -17.752 1.00 2.11 O ATOM 1400 CB GLU A 95 7.985 19.150 -18.241 1.00 55.34 C ATOM 1401 CG GLU A 95 9.408 19.678 -18.342 1.00 74.24 C ATOM 1402 CD GLU A 95 10.045 19.404 -19.688 1.00 22.21 C ATOM 1403 OE1 GLU A 95 10.812 18.424 -19.793 1.00 32.21 O ATOM 1404 OE2 GLU A 95 9.779 20.170 -20.638 1.00 30.22 O1- ATOM 0 H GLU A 95 8.180 17.449 -16.198 1.00 71.54 H new ATOM 0 HA GLU A 95 7.501 20.315 -16.501 1.00 74.44 H new ATOM 0 HB2 GLU A 95 7.972 18.101 -18.535 1.00 55.34 H new ATOM 0 HB3 GLU A 95 7.354 19.687 -18.949 1.00 55.34 H new ATOM 0 HG2 GLU A 95 9.405 20.753 -18.159 1.00 74.24 H new ATOM 0 HG3 GLU A 95 10.015 19.223 -17.559 1.00 74.24 H new ATOM 1411 N ALA A 96 5.443 18.201 -15.866 1.00 33.44 N ATOM 1412 CA ALA A 96 4.034 17.833 -15.760 1.00 21.51 C ATOM 1413 C ALA A 96 3.536 18.029 -14.332 1.00 5.24 C ATOM 1414 O ALA A 96 2.445 18.557 -14.112 1.00 14.11 O ATOM 1415 CB ALA A 96 3.817 16.397 -16.210 1.00 50.44 C ATOM 0 H ALA A 96 6.032 17.826 -15.122 1.00 33.44 H new ATOM 0 HA ALA A 96 3.460 18.486 -16.417 1.00 21.51 H new ATOM 0 HB1 ALA A 96 2.760 16.144 -16.123 1.00 50.44 H new ATOM 0 HB2 ALA A 96 4.131 16.290 -17.248 1.00 50.44 H new ATOM 0 HB3 ALA A 96 4.404 15.726 -15.582 1.00 50.44 H new ATOM 1421 N GLY A 97 4.347 17.599 -13.366 1.00 51.23 N ATOM 1422 CA GLY A 97 3.989 17.749 -11.966 1.00 64.12 C ATOM 1423 C GLY A 97 4.313 19.136 -11.448 1.00 64.21 C ATOM 1424 O GLY A 97 3.713 19.606 -10.482 1.00 64.15 O ATOM 0 H GLY A 97 5.247 17.149 -13.530 1.00 51.23 H new ATOM 0 HA2 GLY A 97 2.924 17.554 -11.840 1.00 64.12 H new ATOM 0 HA3 GLY A 97 4.522 17.006 -11.373 1.00 64.12 H new ATOM 1428 N ASP A 98 5.272 19.787 -12.099 1.00 64.45 N ATOM 1429 CA ASP A 98 5.683 21.135 -11.730 1.00 40.24 C ATOM 1430 C ASP A 98 5.094 22.146 -12.715 1.00 72.42 C ATOM 1431 O ASP A 98 5.292 23.352 -12.580 1.00 34.33 O ATOM 1432 CB ASP A 98 7.214 21.228 -11.713 1.00 73.55 C ATOM 1433 CG ASP A 98 7.724 22.521 -11.103 1.00 23.02 C ATOM 1434 OD1 ASP A 98 7.642 22.667 -9.867 1.00 60.34 O ATOM 1435 OD2 ASP A 98 8.210 23.386 -11.862 1.00 62.31 O1- ATOM 0 H ASP A 98 5.782 19.397 -12.892 1.00 64.45 H new ATOM 0 HA ASP A 98 5.310 21.364 -10.732 1.00 40.24 H new ATOM 0 HB2 ASP A 98 7.617 20.385 -11.152 1.00 73.55 H new ATOM 0 HB3 ASP A 98 7.589 21.141 -12.733 1.00 73.55 H new ATOM 1440 N GLU A 99 4.348 21.633 -13.697 1.00 50.25 N ATOM 1441 CA GLU A 99 3.722 22.468 -14.722 1.00 71.44 C ATOM 1442 C GLU A 99 2.468 23.165 -14.185 1.00 10.12 C ATOM 1443 O GLU A 99 1.937 24.083 -14.812 1.00 3.14 O ATOM 1444 CB GLU A 99 3.364 21.614 -15.941 1.00 22.22 C ATOM 1445 CG GLU A 99 3.134 22.419 -17.212 1.00 23.45 C ATOM 1446 CD GLU A 99 4.390 23.117 -17.696 1.00 43.13 C ATOM 1447 OE1 GLU A 99 5.179 22.481 -18.426 1.00 65.24 O ATOM 1448 OE2 GLU A 99 4.584 24.301 -17.347 1.00 35.21 O1- ATOM 0 H GLU A 99 4.163 20.636 -13.803 1.00 50.25 H new ATOM 0 HA GLU A 99 4.436 23.238 -15.014 1.00 71.44 H new ATOM 0 HB2 GLU A 99 4.165 20.896 -16.117 1.00 22.22 H new ATOM 0 HB3 GLU A 99 2.465 21.040 -15.719 1.00 22.22 H new ATOM 0 HG2 GLU A 99 2.766 21.757 -17.996 1.00 23.45 H new ATOM 0 HG3 GLU A 99 2.357 23.162 -17.032 1.00 23.45 H new ATOM 1455 N PHE A 100 2.001 22.725 -13.023 1.00 20.03 N ATOM 1456 CA PHE A 100 0.818 23.309 -12.401 1.00 64.44 C ATOM 1457 C PHE A 100 1.216 24.223 -11.242 1.00 22.54 C ATOM 1458 O PHE A 100 0.406 25.005 -10.743 1.00 41.45 O ATOM 1459 CB PHE A 100 -0.113 22.194 -11.913 1.00 12.52 C ATOM 1460 CG PHE A 100 -1.419 22.681 -11.349 1.00 21.12 C ATOM 1461 CD1 PHE A 100 -2.318 23.377 -12.142 1.00 14.31 C ATOM 1462 CD2 PHE A 100 -1.748 22.439 -10.024 1.00 41.04 C ATOM 1463 CE1 PHE A 100 -3.519 23.822 -11.625 1.00 1.24 C ATOM 1464 CE2 PHE A 100 -2.948 22.882 -9.501 1.00 62.11 C ATOM 1465 CZ PHE A 100 -3.835 23.575 -10.303 1.00 65.43 C ATOM 0 H PHE A 100 2.424 21.964 -12.491 1.00 20.03 H new ATOM 0 HA PHE A 100 0.291 23.912 -13.140 1.00 64.44 H new ATOM 0 HB2 PHE A 100 -0.319 21.519 -12.744 1.00 12.52 H new ATOM 0 HB3 PHE A 100 0.405 21.612 -11.150 1.00 12.52 H new ATOM 0 HD1 PHE A 100 -2.077 23.574 -13.176 1.00 14.31 H new ATOM 0 HD2 PHE A 100 -1.058 21.898 -9.393 1.00 41.04 H new ATOM 0 HE1 PHE A 100 -4.211 24.363 -12.254 1.00 1.24 H new ATOM 0 HE2 PHE A 100 -3.192 22.687 -8.467 1.00 62.11 H new ATOM 0 HZ PHE A 100 -4.773 23.923 -9.897 1.00 65.43 H new ATOM 1475 N GLU A 101 2.479 24.133 -10.832 1.00 63.54 N ATOM 1476 CA GLU A 101 2.986 24.942 -9.730 1.00 30.42 C ATOM 1477 C GLU A 101 3.308 26.368 -10.184 1.00 53.33 C ATOM 1478 O GLU A 101 3.076 27.325 -9.445 1.00 41.41 O ATOM 1479 CB GLU A 101 4.222 24.280 -9.120 1.00 4.52 C ATOM 1480 CG GLU A 101 4.631 24.872 -7.782 1.00 13.13 C ATOM 1481 CD GLU A 101 5.374 23.884 -6.906 1.00 41.05 C ATOM 1482 OE1 GLU A 101 6.320 23.239 -7.403 1.00 32.01 O ATOM 1483 OE2 GLU A 101 5.012 23.758 -5.720 1.00 62.54 O1- ATOM 0 H GLU A 101 3.169 23.507 -11.247 1.00 63.54 H new ATOM 0 HA GLU A 101 2.207 25.007 -8.971 1.00 30.42 H new ATOM 0 HB2 GLU A 101 4.028 23.215 -8.993 1.00 4.52 H new ATOM 0 HB3 GLU A 101 5.054 24.371 -9.818 1.00 4.52 H new ATOM 0 HG2 GLU A 101 5.261 25.745 -7.953 1.00 13.13 H new ATOM 0 HG3 GLU A 101 3.742 25.220 -7.256 1.00 13.13 H new ATOM 1490 N LEU A 102 3.837 26.510 -11.402 1.00 23.43 N ATOM 1491 CA LEU A 102 4.171 27.832 -11.938 1.00 61.22 C ATOM 1492 C LEU A 102 2.991 28.426 -12.708 1.00 34.41 C ATOM 1493 O LEU A 102 3.044 29.575 -13.151 1.00 44.11 O ATOM 1494 CB LEU A 102 5.458 27.792 -12.809 1.00 62.35 C ATOM 1495 CG LEU A 102 5.389 27.156 -14.223 1.00 14.24 C ATOM 1496 CD1 LEU A 102 4.602 25.862 -14.232 1.00 55.42 C ATOM 1497 CD2 LEU A 102 4.822 28.125 -15.252 1.00 62.43 C ATOM 0 H LEU A 102 4.042 25.733 -12.031 1.00 23.43 H new ATOM 0 HA LEU A 102 4.379 28.486 -11.092 1.00 61.22 H new ATOM 0 HB2 LEU A 102 5.808 28.818 -12.926 1.00 62.35 H new ATOM 0 HB3 LEU A 102 6.221 27.257 -12.244 1.00 62.35 H new ATOM 0 HG LEU A 102 6.417 26.923 -14.501 1.00 14.24 H new ATOM 0 HD11 LEU A 102 4.582 25.455 -15.243 1.00 55.42 H new ATOM 0 HD12 LEU A 102 5.074 25.144 -13.561 1.00 55.42 H new ATOM 0 HD13 LEU A 102 3.582 26.054 -13.898 1.00 55.42 H new ATOM 0 HD21 LEU A 102 4.790 27.641 -16.228 1.00 62.43 H new ATOM 0 HD22 LEU A 102 3.814 28.418 -14.959 1.00 62.43 H new ATOM 0 HD23 LEU A 102 5.456 29.010 -15.306 1.00 62.43 H new ATOM 1509 N ARG A 103 1.926 27.635 -12.852 1.00 62.12 N ATOM 1510 CA ARG A 103 0.725 28.065 -13.566 1.00 60.12 C ATOM 1511 C ARG A 103 0.081 29.273 -12.887 1.00 41.31 C ATOM 1512 O ARG A 103 -0.280 30.247 -13.547 1.00 34.42 O ATOM 1513 CB ARG A 103 -0.274 26.905 -13.648 1.00 62.14 C ATOM 1514 CG ARG A 103 -1.503 27.203 -14.496 1.00 32.00 C ATOM 1515 CD ARG A 103 -2.727 27.473 -13.633 1.00 31.41 C ATOM 1516 NE ARG A 103 -3.883 27.866 -14.435 1.00 2.15 N ATOM 1517 CZ ARG A 103 -4.975 28.436 -13.931 1.00 70.25 C ATOM 1518 NH1 ARG A 103 -5.064 28.680 -12.630 1.00 55.11 N1+ ATOM 1519 NH2 ARG A 103 -5.978 28.767 -14.731 1.00 32.41 N ATOM 0 H ARG A 103 1.872 26.687 -12.480 1.00 62.12 H new ATOM 0 HA ARG A 103 1.013 28.363 -14.574 1.00 60.12 H new ATOM 0 HB2 ARG A 103 0.233 26.031 -14.057 1.00 62.14 H new ATOM 0 HB3 ARG A 103 -0.596 26.645 -12.640 1.00 62.14 H new ATOM 0 HG2 ARG A 103 -1.307 28.067 -15.131 1.00 32.00 H new ATOM 0 HG3 ARG A 103 -1.702 26.360 -15.158 1.00 32.00 H new ATOM 0 HD2 ARG A 103 -2.971 26.579 -13.059 1.00 31.41 H new ATOM 0 HD3 ARG A 103 -2.498 28.261 -12.915 1.00 31.41 H new ATOM 0 HE ARG A 103 -3.851 27.694 -15.440 1.00 2.15 H new ATOM 0 HH11 ARG A 103 -4.293 28.431 -12.010 1.00 55.11 H new ATOM 0 HH12 ARG A 103 -5.903 29.117 -12.249 1.00 55.11 H new ATOM 0 HH21 ARG A 103 -5.913 28.585 -15.733 1.00 32.41 H new ATOM 0 HH22 ARG A 103 -6.815 29.204 -14.345 1.00 32.41 H new ATOM 1533 N TYR A 104 -0.062 29.203 -11.567 1.00 52.42 N ATOM 1534 CA TYR A 104 -0.661 30.294 -10.808 1.00 13.30 C ATOM 1535 C TYR A 104 0.288 30.798 -9.724 1.00 63.24 C ATOM 1536 O TYR A 104 0.109 31.901 -9.207 1.00 72.05 O ATOM 1537 CB TYR A 104 -1.993 29.855 -10.184 1.00 1.53 C ATOM 1538 CG TYR A 104 -1.878 28.696 -9.215 1.00 74.53 C ATOM 1539 CD1 TYR A 104 -1.735 28.916 -7.850 1.00 43.20 C ATOM 1540 CD2 TYR A 104 -1.916 27.382 -9.665 1.00 44.51 C ATOM 1541 CE1 TYR A 104 -1.633 27.861 -6.964 1.00 12.51 C ATOM 1542 CE2 TYR A 104 -1.815 26.323 -8.784 1.00 64.31 C ATOM 1543 CZ TYR A 104 -1.673 26.567 -7.436 1.00 25.55 C ATOM 1544 OH TYR A 104 -1.573 25.515 -6.557 1.00 54.23 O ATOM 0 H TYR A 104 0.228 28.404 -11.003 1.00 52.42 H new ATOM 0 HA TYR A 104 -0.853 31.113 -11.501 1.00 13.30 H new ATOM 0 HB2 TYR A 104 -2.434 30.705 -9.664 1.00 1.53 H new ATOM 0 HB3 TYR A 104 -2.681 29.578 -10.983 1.00 1.53 H new ATOM 0 HD1 TYR A 104 -1.703 29.929 -7.476 1.00 43.20 H new ATOM 0 HD2 TYR A 104 -2.026 27.185 -10.721 1.00 44.51 H new ATOM 0 HE1 TYR A 104 -1.522 28.050 -5.906 1.00 12.51 H new ATOM 0 HE2 TYR A 104 -1.847 25.308 -9.151 1.00 64.31 H new ATOM 0 HH TYR A 104 -1.620 24.670 -7.051 1.00 54.23 H new ATOM 1554 N ARG A 105 1.297 29.976 -9.399 1.00 42.41 N ATOM 1555 CA ARG A 105 2.299 30.300 -8.375 1.00 15.40 C ATOM 1556 C ARG A 105 1.675 30.326 -6.975 1.00 65.40 C ATOM 1557 O ARG A 105 1.747 29.341 -6.241 1.00 0.05 O ATOM 1558 CB ARG A 105 2.999 31.632 -8.695 1.00 1.02 C ATOM 1559 CG ARG A 105 4.045 32.061 -7.671 1.00 42.53 C ATOM 1560 CD ARG A 105 5.118 31.002 -7.474 1.00 64.23 C ATOM 1561 NE ARG A 105 5.008 30.347 -6.171 1.00 15.05 N ATOM 1562 CZ ARG A 105 5.173 29.041 -5.980 1.00 3.35 C ATOM 1563 NH1 ARG A 105 5.455 28.244 -7.001 1.00 74.31 N1+ ATOM 1564 NH2 ARG A 105 5.054 28.530 -4.763 1.00 64.40 N ATOM 0 H ARG A 105 1.440 29.067 -9.840 1.00 42.41 H new ATOM 0 HA ARG A 105 3.053 29.513 -8.385 1.00 15.40 H new ATOM 0 HB2 ARG A 105 3.477 31.551 -9.671 1.00 1.02 H new ATOM 0 HB3 ARG A 105 2.244 32.414 -8.774 1.00 1.02 H new ATOM 0 HG2 ARG A 105 4.510 32.992 -7.996 1.00 42.53 H new ATOM 0 HG3 ARG A 105 3.557 32.264 -6.718 1.00 42.53 H new ATOM 0 HD2 ARG A 105 5.039 30.255 -8.263 1.00 64.23 H new ATOM 0 HD3 ARG A 105 6.102 31.461 -7.567 1.00 64.23 H new ATOM 0 HE ARG A 105 4.792 30.926 -5.360 1.00 15.05 H new ATOM 0 HH11 ARG A 105 5.547 28.631 -7.940 1.00 74.31 H new ATOM 0 HH12 ARG A 105 5.580 27.243 -6.847 1.00 74.31 H new ATOM 0 HH21 ARG A 105 4.836 29.138 -3.974 1.00 64.40 H new ATOM 0 HH22 ARG A 105 5.180 27.529 -4.616 1.00 64.40 H new ATOM 1578 N ARG A 106 1.064 31.450 -6.613 1.00 33.45 N ATOM 1579 CA ARG A 106 0.434 31.591 -5.307 1.00 65.14 C ATOM 1580 C ARG A 106 -1.067 31.827 -5.457 1.00 44.23 C ATOM 1581 O ARG A 106 -1.517 32.458 -6.415 1.00 1.42 O ATOM 1582 CB ARG A 106 1.081 32.736 -4.508 1.00 72.31 C ATOM 1583 CG ARG A 106 0.740 34.132 -5.017 1.00 51.11 C ATOM 1584 CD ARG A 106 1.659 34.565 -6.149 1.00 13.11 C ATOM 1585 NE ARG A 106 1.199 35.797 -6.786 1.00 34.31 N ATOM 1586 CZ ARG A 106 1.509 36.150 -8.031 1.00 13.22 C ATOM 1587 NH1 ARG A 106 2.280 35.369 -8.777 1.00 71.44 N1+ ATOM 1588 NH2 ARG A 106 1.046 37.286 -8.533 1.00 33.14 N ATOM 0 H ARG A 106 0.992 32.276 -7.207 1.00 33.45 H new ATOM 0 HA ARG A 106 0.585 30.662 -4.756 1.00 65.14 H new ATOM 0 HB2 ARG A 106 0.770 32.657 -3.466 1.00 72.31 H new ATOM 0 HB3 ARG A 106 2.163 32.610 -4.528 1.00 72.31 H new ATOM 0 HG2 ARG A 106 -0.294 34.150 -5.362 1.00 51.11 H new ATOM 0 HG3 ARG A 106 0.814 34.846 -4.196 1.00 51.11 H new ATOM 0 HD2 ARG A 106 2.667 34.712 -5.762 1.00 13.11 H new ATOM 0 HD3 ARG A 106 1.716 33.771 -6.894 1.00 13.11 H new ATOM 0 HE ARG A 106 0.605 36.424 -6.244 1.00 34.31 H new ATOM 0 HH11 ARG A 106 2.638 34.493 -8.397 1.00 71.44 H new ATOM 0 HH12 ARG A 106 2.514 35.645 -9.731 1.00 71.44 H new ATOM 0 HH21 ARG A 106 0.452 37.890 -7.965 1.00 33.14 H new ATOM 0 HH22 ARG A 106 1.284 37.556 -9.487 1.00 33.14 H new ATOM 1602 N ALA A 107 -1.836 31.300 -4.512 1.00 61.14 N ATOM 1603 CA ALA A 107 -3.285 31.456 -4.525 1.00 3.22 C ATOM 1604 C ALA A 107 -3.779 31.972 -3.180 1.00 74.33 C ATOM 1605 O ALA A 107 -4.866 32.541 -3.079 1.00 23.20 O ATOM 1606 CB ALA A 107 -3.958 30.134 -4.867 1.00 13.05 C ATOM 0 H ALA A 107 -1.479 30.759 -3.725 1.00 61.14 H new ATOM 0 HA ALA A 107 -3.546 32.186 -5.291 1.00 3.22 H new ATOM 0 HB1 ALA A 107 -5.040 30.267 -4.873 1.00 13.05 H new ATOM 0 HB2 ALA A 107 -3.628 29.802 -5.851 1.00 13.05 H new ATOM 0 HB3 ALA A 107 -3.689 29.385 -4.122 1.00 13.05 H new ATOM 1612 N PHE A 108 -2.966 31.766 -2.147 1.00 42.23 N ATOM 1613 CA PHE A 108 -3.308 32.206 -0.801 1.00 73.30 C ATOM 1614 C PHE A 108 -2.234 33.141 -0.252 1.00 1.24 C ATOM 1615 O PHE A 108 -1.250 33.438 -0.931 1.00 50.31 O ATOM 1616 CB PHE A 108 -3.472 30.999 0.126 1.00 12.43 C ATOM 1617 CG PHE A 108 -4.453 29.977 -0.378 1.00 2.32 C ATOM 1618 CD1 PHE A 108 -4.009 28.787 -0.932 1.00 33.21 C ATOM 1619 CD2 PHE A 108 -5.817 30.207 -0.298 1.00 53.41 C ATOM 1620 CE1 PHE A 108 -4.907 27.845 -1.397 1.00 23.13 C ATOM 1621 CE2 PHE A 108 -6.720 29.269 -0.761 1.00 60.34 C ATOM 1622 CZ PHE A 108 -6.264 28.087 -1.312 1.00 45.21 C ATOM 0 H PHE A 108 -2.064 31.296 -2.219 1.00 42.23 H new ATOM 0 HA PHE A 108 -4.252 32.749 -0.848 1.00 73.30 H new ATOM 0 HB2 PHE A 108 -2.501 30.522 0.261 1.00 12.43 H new ATOM 0 HB3 PHE A 108 -3.796 31.347 1.107 1.00 12.43 H new ATOM 0 HD1 PHE A 108 -2.949 28.593 -1.001 1.00 33.21 H new ATOM 0 HD2 PHE A 108 -6.179 31.130 0.131 1.00 53.41 H new ATOM 0 HE1 PHE A 108 -4.548 26.921 -1.826 1.00 23.13 H new ATOM 0 HE2 PHE A 108 -7.781 29.460 -0.692 1.00 60.34 H new ATOM 0 HZ PHE A 108 -6.968 27.353 -1.676 1.00 45.21 H new ATOM 1632 N SER A 109 -2.431 33.602 0.980 1.00 33.32 N ATOM 1633 CA SER A 109 -1.480 34.504 1.624 1.00 73.01 C ATOM 1634 C SER A 109 -1.371 34.204 3.116 1.00 62.34 C ATOM 1635 O SER A 109 -0.336 34.452 3.735 1.00 14.24 O ATOM 1636 CB SER A 109 -1.900 35.962 1.415 1.00 45.41 C ATOM 1637 OG SER A 109 -3.195 36.202 1.939 1.00 51.10 O ATOM 0 H SER A 109 -3.241 33.366 1.553 1.00 33.32 H new ATOM 0 HA SER A 109 -0.503 34.347 1.166 1.00 73.01 H new ATOM 0 HB2 SER A 109 -1.181 36.623 1.898 1.00 45.41 H new ATOM 0 HB3 SER A 109 -1.886 36.199 0.351 1.00 45.41 H new ATOM 0 HG SER A 109 -3.438 37.140 1.794 1.00 51.10 H new ATOM 1643 N ASP A 110 -2.447 33.666 3.685 1.00 62.34 N ATOM 1644 CA ASP A 110 -2.483 33.333 5.105 1.00 11.32 C ATOM 1645 C ASP A 110 -2.412 31.820 5.313 1.00 55.22 C ATOM 1646 O ASP A 110 -2.597 31.328 6.426 1.00 21.41 O ATOM 1647 CB ASP A 110 -3.759 33.895 5.739 1.00 3.34 C ATOM 1648 CG ASP A 110 -3.618 34.130 7.231 1.00 41.24 C ATOM 1649 OD1 ASP A 110 -4.108 33.291 8.016 1.00 44.25 O ATOM 1650 OD2 ASP A 110 -3.016 35.155 7.615 1.00 1.11 O1- ATOM 0 H ASP A 110 -3.308 33.451 3.182 1.00 62.34 H new ATOM 0 HA ASP A 110 -1.615 33.782 5.587 1.00 11.32 H new ATOM 0 HB2 ASP A 110 -4.019 34.834 5.251 1.00 3.34 H new ATOM 0 HB3 ASP A 110 -4.583 33.204 5.561 1.00 3.34 H new ATOM 1655 N LEU A 111 -2.136 31.086 4.237 1.00 60.21 N ATOM 1656 CA LEU A 111 -2.040 29.630 4.304 1.00 54.45 C ATOM 1657 C LEU A 111 -0.689 29.197 4.868 1.00 1.24 C ATOM 1658 O LEU A 111 -0.545 28.082 5.369 1.00 0.51 O ATOM 1659 CB LEU A 111 -2.249 29.019 2.917 1.00 14.15 C ATOM 1660 CG LEU A 111 -3.449 28.073 2.787 1.00 11.22 C ATOM 1661 CD1 LEU A 111 -3.252 26.833 3.643 1.00 12.31 C ATOM 1662 CD2 LEU A 111 -4.740 28.784 3.171 1.00 51.45 C ATOM 0 H LEU A 111 -1.975 31.476 3.308 1.00 60.21 H new ATOM 0 HA LEU A 111 -2.822 29.270 4.972 1.00 54.45 H new ATOM 0 HB2 LEU A 111 -2.367 29.828 2.196 1.00 14.15 H new ATOM 0 HB3 LEU A 111 -1.347 28.474 2.639 1.00 14.15 H new ATOM 0 HG LEU A 111 -3.524 27.763 1.745 1.00 11.22 H new ATOM 0 HD11 LEU A 111 -4.115 26.176 3.536 1.00 12.31 H new ATOM 0 HD12 LEU A 111 -2.353 26.307 3.321 1.00 12.31 H new ATOM 0 HD13 LEU A 111 -3.146 27.125 4.688 1.00 12.31 H new ATOM 0 HD21 LEU A 111 -5.578 28.095 3.072 1.00 51.45 H new ATOM 0 HD22 LEU A 111 -4.673 29.127 4.203 1.00 51.45 H new ATOM 0 HD23 LEU A 111 -4.894 29.640 2.513 1.00 51.45 H new ATOM 1674 N THR A 112 0.296 30.088 4.783 1.00 23.41 N ATOM 1675 CA THR A 112 1.634 29.807 5.293 1.00 54.11 C ATOM 1676 C THR A 112 1.689 30.005 6.810 1.00 2.10 C ATOM 1677 O THR A 112 2.587 29.499 7.483 1.00 21.10 O ATOM 1678 CB THR A 112 2.694 30.700 4.609 1.00 13.41 C ATOM 1679 OG1 THR A 112 3.982 30.483 5.198 1.00 11.44 O ATOM 1680 CG2 THR A 112 2.326 32.174 4.715 1.00 73.11 C ATOM 0 H THR A 112 0.191 31.012 4.365 1.00 23.41 H new ATOM 0 HA THR A 112 1.860 28.766 5.063 1.00 54.11 H new ATOM 0 HB THR A 112 2.727 30.427 3.554 1.00 13.41 H new ATOM 0 HG1 THR A 112 4.680 30.786 4.580 1.00 11.44 H new ATOM 0 HG21 THR A 112 3.091 32.776 4.225 1.00 73.11 H new ATOM 0 HG22 THR A 112 1.364 32.345 4.231 1.00 73.11 H new ATOM 0 HG23 THR A 112 2.259 32.458 5.765 1.00 73.11 H new ATOM 1688 N SER A 113 0.710 30.737 7.339 1.00 45.01 N ATOM 1689 CA SER A 113 0.630 31.002 8.771 1.00 35.51 C ATOM 1690 C SER A 113 -0.632 30.381 9.367 1.00 63.44 C ATOM 1691 O SER A 113 -0.966 30.623 10.529 1.00 21.00 O ATOM 1692 CB SER A 113 0.641 32.509 9.029 1.00 4.34 C ATOM 1693 OG SER A 113 -0.470 33.140 8.417 1.00 61.04 O ATOM 0 H SER A 113 -0.041 31.158 6.793 1.00 45.01 H new ATOM 0 HA SER A 113 1.498 30.551 9.251 1.00 35.51 H new ATOM 0 HB2 SER A 113 0.624 32.697 10.102 1.00 4.34 H new ATOM 0 HB3 SER A 113 1.565 32.940 8.644 1.00 4.34 H new ATOM 0 HG SER A 113 -0.159 33.891 7.869 1.00 61.04 H new ATOM 1699 N GLN A 114 -1.325 29.577 8.563 1.00 74.03 N ATOM 1700 CA GLN A 114 -2.554 28.919 8.996 1.00 14.21 C ATOM 1701 C GLN A 114 -2.250 27.758 9.938 1.00 4.52 C ATOM 1702 O GLN A 114 -2.980 27.517 10.900 1.00 44.42 O ATOM 1703 CB GLN A 114 -3.335 28.413 7.779 1.00 22.13 C ATOM 1704 CG GLN A 114 -4.774 28.028 8.087 1.00 52.25 C ATOM 1705 CD GLN A 114 -5.638 29.223 8.444 1.00 3.41 C ATOM 1706 OE1 GLN A 114 -5.422 30.332 7.953 1.00 60.14 O ATOM 1707 NE2 GLN A 114 -6.625 29.003 9.305 1.00 70.03 N ATOM 0 H GLN A 114 -1.053 29.365 7.603 1.00 74.03 H new ATOM 0 HA GLN A 114 -3.159 29.648 9.535 1.00 14.21 H new ATOM 0 HB2 GLN A 114 -3.333 29.186 7.011 1.00 22.13 H new ATOM 0 HB3 GLN A 114 -2.819 27.548 7.362 1.00 22.13 H new ATOM 0 HG2 GLN A 114 -5.203 27.521 7.223 1.00 52.25 H new ATOM 0 HG3 GLN A 114 -4.786 27.317 8.913 1.00 52.25 H new ATOM 0 HE21 GLN A 114 -6.769 28.069 9.688 1.00 70.03 H new ATOM 0 HE22 GLN A 114 -7.239 29.768 9.583 1.00 70.03 H new ATOM 1716 N LEU A 115 -1.162 27.047 9.658 1.00 52.42 N ATOM 1717 CA LEU A 115 -0.759 25.911 10.477 1.00 65.13 C ATOM 1718 C LEU A 115 0.356 26.301 11.450 1.00 44.13 C ATOM 1719 O LEU A 115 0.968 25.429 12.068 1.00 23.02 O ATOM 1720 CB LEU A 115 -0.307 24.742 9.592 1.00 55.43 C ATOM 1721 CG LEU A 115 0.920 25.007 8.713 1.00 20.32 C ATOM 1722 CD1 LEU A 115 1.772 23.751 8.605 1.00 34.33 C ATOM 1723 CD2 LEU A 115 0.499 25.478 7.328 1.00 72.14 C ATOM 0 H LEU A 115 -0.544 27.238 8.869 1.00 52.42 H new ATOM 0 HA LEU A 115 -1.624 25.595 11.060 1.00 65.13 H new ATOM 0 HB2 LEU A 115 -0.093 23.887 10.233 1.00 55.43 H new ATOM 0 HB3 LEU A 115 -1.138 24.457 8.947 1.00 55.43 H new ATOM 0 HG LEU A 115 1.512 25.795 9.179 1.00 20.32 H new ATOM 0 HD11 LEU A 115 2.640 23.953 7.978 1.00 34.33 H new ATOM 0 HD12 LEU A 115 2.104 23.450 9.599 1.00 34.33 H new ATOM 0 HD13 LEU A 115 1.183 22.949 8.161 1.00 34.33 H new ATOM 0 HD21 LEU A 115 1.386 25.660 6.721 1.00 72.14 H new ATOM 0 HD22 LEU A 115 -0.114 24.712 6.854 1.00 72.14 H new ATOM 0 HD23 LEU A 115 -0.076 26.400 7.416 1.00 72.14 H new ATOM 1735 N HIS A 116 0.577 27.623 11.586 1.00 52.33 N ATOM 1736 CA HIS A 116 1.609 28.204 12.472 1.00 31.20 C ATOM 1737 C HIS A 116 2.882 27.355 12.536 1.00 12.10 C ATOM 1738 O HIS A 116 3.092 26.586 13.476 1.00 23.32 O ATOM 1739 CB HIS A 116 1.058 28.481 13.889 1.00 62.35 C ATOM 1740 CG HIS A 116 0.198 27.392 14.472 1.00 60.42 C ATOM 1741 ND1 HIS A 116 -1.158 27.293 14.231 1.00 74.44 N ATOM 1742 CD2 HIS A 116 0.507 26.358 15.293 1.00 14.43 C ATOM 1743 CE1 HIS A 116 -1.643 26.248 14.878 1.00 12.45 C ATOM 1744 NE2 HIS A 116 -0.654 25.664 15.528 1.00 21.21 N ATOM 0 H HIS A 116 0.039 28.326 11.079 1.00 52.33 H new ATOM 0 HA HIS A 116 1.886 29.159 12.025 1.00 31.20 H new ATOM 0 HB2 HIS A 116 1.899 28.654 14.560 1.00 62.35 H new ATOM 0 HB3 HIS A 116 0.477 29.403 13.861 1.00 62.35 H new ATOM 0 HD2 HIS A 116 1.484 26.124 15.688 1.00 14.43 H new ATOM 0 HE1 HIS A 116 -2.674 25.926 14.875 1.00 12.45 H new ATOM 0 HE2 HIS A 116 -0.739 24.831 16.111 1.00 21.21 H new ATOM 1753 N ILE A 117 3.732 27.512 11.526 1.00 32.33 N ATOM 1754 CA ILE A 117 4.977 26.757 11.443 1.00 41.30 C ATOM 1755 C ILE A 117 6.048 27.330 12.370 1.00 61.03 C ATOM 1756 O ILE A 117 6.626 28.381 12.094 1.00 53.41 O ATOM 1757 CB ILE A 117 5.519 26.740 10.001 1.00 75.52 C ATOM 1758 CG1 ILE A 117 4.402 26.380 9.016 1.00 63.13 C ATOM 1759 CG2 ILE A 117 6.670 25.754 9.888 1.00 14.04 C ATOM 1760 CD1 ILE A 117 4.775 26.598 7.565 1.00 43.34 C ATOM 0 H ILE A 117 3.580 28.158 10.751 1.00 32.33 H new ATOM 0 HA ILE A 117 4.747 25.739 11.758 1.00 41.30 H new ATOM 0 HB ILE A 117 5.888 27.735 9.752 1.00 75.52 H new ATOM 0 HG12 ILE A 117 4.128 25.335 9.158 1.00 63.13 H new ATOM 0 HG13 ILE A 117 3.519 26.976 9.248 1.00 63.13 H new ATOM 0 HG21 ILE A 117 7.046 25.749 8.865 1.00 14.04 H new ATOM 0 HG22 ILE A 117 7.470 26.049 10.567 1.00 14.04 H new ATOM 0 HG23 ILE A 117 6.321 24.755 10.151 1.00 14.04 H new ATOM 0 HD11 ILE A 117 3.935 26.322 6.928 1.00 43.34 H new ATOM 0 HD12 ILE A 117 5.021 27.648 7.406 1.00 43.34 H new ATOM 0 HD13 ILE A 117 5.638 25.982 7.315 1.00 43.34 H new ATOM 1772 N THR A 118 6.305 26.627 13.471 1.00 10.23 N ATOM 1773 CA THR A 118 7.310 27.055 14.440 1.00 54.04 C ATOM 1774 C THR A 118 7.977 25.855 15.139 1.00 61.11 C ATOM 1775 O THR A 118 9.201 25.727 15.092 1.00 11.44 O ATOM 1776 CB THR A 118 6.723 28.031 15.492 1.00 40.13 C ATOM 1777 OG1 THR A 118 6.358 29.267 14.867 1.00 12.31 O ATOM 1778 CG2 THR A 118 7.725 28.306 16.604 1.00 72.24 C ATOM 0 H THR A 118 5.830 25.758 13.714 1.00 10.23 H new ATOM 0 HA THR A 118 8.074 27.589 13.875 1.00 54.04 H new ATOM 0 HB THR A 118 5.839 27.563 15.926 1.00 40.13 H new ATOM 0 HG1 THR A 118 6.529 29.210 13.904 1.00 12.31 H new ATOM 0 HG21 THR A 118 7.286 28.993 17.327 1.00 72.24 H new ATOM 0 HG22 THR A 118 7.982 27.371 17.102 1.00 72.24 H new ATOM 0 HG23 THR A 118 8.625 28.751 16.181 1.00 72.24 H new ATOM 1786 N PRO A 119 7.202 24.951 15.796 1.00 60.12 N ATOM 1787 CA PRO A 119 7.775 23.787 16.480 1.00 64.33 C ATOM 1788 C PRO A 119 7.999 22.600 15.543 1.00 0.31 C ATOM 1789 O PRO A 119 7.948 22.738 14.320 1.00 72.22 O ATOM 1790 CB PRO A 119 6.701 23.455 17.511 1.00 11.42 C ATOM 1791 CG PRO A 119 5.421 23.814 16.844 1.00 63.35 C ATOM 1792 CD PRO A 119 5.726 24.983 15.941 1.00 63.31 C ATOM 0 HA PRO A 119 8.760 23.995 16.899 1.00 64.33 H new ATOM 0 HB2 PRO A 119 6.725 22.400 17.783 1.00 11.42 H new ATOM 0 HB3 PRO A 119 6.843 24.024 18.430 1.00 11.42 H new ATOM 0 HG2 PRO A 119 5.032 22.972 16.272 1.00 63.35 H new ATOM 0 HG3 PRO A 119 4.661 24.079 17.579 1.00 63.35 H new ATOM 0 HD2 PRO A 119 5.228 24.882 14.977 1.00 63.31 H new ATOM 0 HD3 PRO A 119 5.388 25.923 16.378 1.00 63.31 H new ATOM 1800 N GLY A 120 8.249 21.432 16.133 1.00 43.34 N ATOM 1801 CA GLY A 120 8.469 20.230 15.350 1.00 51.53 C ATOM 1802 C GLY A 120 7.184 19.461 15.101 1.00 21.50 C ATOM 1803 O GLY A 120 7.182 18.453 14.395 1.00 64.55 O ATOM 0 H GLY A 120 8.303 21.299 17.143 1.00 43.34 H new ATOM 0 HA2 GLY A 120 8.920 20.499 14.395 1.00 51.53 H new ATOM 0 HA3 GLY A 120 9.180 19.587 15.868 1.00 51.53 H new ATOM 1807 N THR A 121 6.088 19.943 15.685 1.00 61.11 N ATOM 1808 CA THR A 121 4.784 19.308 15.529 1.00 3.40 C ATOM 1809 C THR A 121 3.971 19.990 14.431 1.00 13.54 C ATOM 1810 O THR A 121 2.747 20.102 14.525 1.00 20.43 O ATOM 1811 CB THR A 121 3.982 19.343 16.846 1.00 51.22 C ATOM 1812 OG1 THR A 121 3.871 20.691 17.319 1.00 40.33 O ATOM 1813 CG2 THR A 121 4.648 18.480 17.908 1.00 3.54 C ATOM 0 H THR A 121 6.080 20.776 16.273 1.00 61.11 H new ATOM 0 HA THR A 121 4.966 18.270 15.252 1.00 3.40 H new ATOM 0 HB THR A 121 2.986 18.946 16.649 1.00 51.22 H new ATOM 0 HG1 THR A 121 3.359 20.703 18.154 1.00 40.33 H new ATOM 0 HG21 THR A 121 4.065 18.520 18.828 1.00 3.54 H new ATOM 0 HG22 THR A 121 4.703 17.449 17.558 1.00 3.54 H new ATOM 0 HG23 THR A 121 5.655 18.852 18.100 1.00 3.54 H new ATOM 1821 N ALA A 122 4.663 20.433 13.382 1.00 51.13 N ATOM 1822 CA ALA A 122 4.018 21.106 12.261 1.00 12.43 C ATOM 1823 C ALA A 122 3.370 20.106 11.304 1.00 31.34 C ATOM 1824 O ALA A 122 2.694 20.499 10.356 1.00 73.24 O ATOM 1825 CB ALA A 122 5.025 21.975 11.520 1.00 23.51 C ATOM 0 H ALA A 122 5.674 20.336 13.287 1.00 51.13 H new ATOM 0 HA ALA A 122 3.227 21.740 12.661 1.00 12.43 H new ATOM 0 HB1 ALA A 122 4.532 22.472 10.685 1.00 23.51 H new ATOM 0 HB2 ALA A 122 5.430 22.724 12.201 1.00 23.51 H new ATOM 0 HB3 ALA A 122 5.836 21.352 11.143 1.00 23.51 H new ATOM 1831 N TYR A 123 3.583 18.814 11.558 1.00 30.15 N ATOM 1832 CA TYR A 123 3.009 17.760 10.726 1.00 4.23 C ATOM 1833 C TYR A 123 1.553 17.505 11.111 1.00 30.11 C ATOM 1834 O TYR A 123 0.733 17.141 10.268 1.00 10.21 O ATOM 1835 CB TYR A 123 3.828 16.471 10.858 1.00 14.22 C ATOM 1836 CG TYR A 123 3.366 15.344 9.953 1.00 12.33 C ATOM 1837 CD1 TYR A 123 3.051 15.575 8.618 1.00 34.24 C ATOM 1838 CD2 TYR A 123 3.251 14.046 10.436 1.00 64.42 C ATOM 1839 CE1 TYR A 123 2.635 14.547 7.793 1.00 14.42 C ATOM 1840 CE2 TYR A 123 2.836 13.013 9.617 1.00 32.40 C ATOM 1841 CZ TYR A 123 2.530 13.268 8.298 1.00 61.00 C ATOM 1842 OH TYR A 123 2.117 12.242 7.480 1.00 63.11 O ATOM 0 H TYR A 123 4.150 18.474 12.335 1.00 30.15 H new ATOM 0 HA TYR A 123 3.039 18.087 9.687 1.00 4.23 H new ATOM 0 HB2 TYR A 123 4.872 16.693 10.638 1.00 14.22 H new ATOM 0 HB3 TYR A 123 3.785 16.131 11.893 1.00 14.22 H new ATOM 0 HD1 TYR A 123 3.133 16.575 8.219 1.00 34.24 H new ATOM 0 HD2 TYR A 123 3.490 13.841 11.469 1.00 64.42 H new ATOM 0 HE1 TYR A 123 2.394 14.744 6.759 1.00 14.42 H new ATOM 0 HE2 TYR A 123 2.752 12.010 10.009 1.00 32.40 H new ATOM 0 HH TYR A 123 1.487 12.588 6.814 1.00 63.11 H new ATOM 1852 N GLN A 124 1.240 17.702 12.391 1.00 40.14 N ATOM 1853 CA GLN A 124 -0.118 17.508 12.888 1.00 1.34 C ATOM 1854 C GLN A 124 -1.044 18.587 12.333 1.00 23.13 C ATOM 1855 O GLN A 124 -2.202 18.322 12.005 1.00 72.24 O ATOM 1856 CB GLN A 124 -0.132 17.532 14.421 1.00 71.22 C ATOM 1857 CG GLN A 124 -1.490 17.216 15.033 1.00 34.40 C ATOM 1858 CD GLN A 124 -1.957 15.803 14.738 1.00 44.04 C ATOM 1859 OE1 GLN A 124 -1.647 14.868 15.476 1.00 1.04 O ATOM 1860 NE2 GLN A 124 -2.713 15.641 13.658 1.00 21.23 N ATOM 0 H GLN A 124 1.910 17.996 13.102 1.00 40.14 H new ATOM 0 HA GLN A 124 -0.476 16.535 12.552 1.00 1.34 H new ATOM 0 HB2 GLN A 124 0.598 16.813 14.792 1.00 71.22 H new ATOM 0 HB3 GLN A 124 0.188 18.517 14.762 1.00 71.22 H new ATOM 0 HG2 GLN A 124 -1.438 17.358 16.112 1.00 34.40 H new ATOM 0 HG3 GLN A 124 -2.227 17.923 14.653 1.00 34.40 H new ATOM 0 HE21 GLN A 124 -2.946 16.444 13.074 1.00 21.23 H new ATOM 0 HE22 GLN A 124 -3.060 14.714 13.413 1.00 21.23 H new ATOM 1869 N SER A 125 -0.517 19.805 12.220 1.00 13.11 N ATOM 1870 CA SER A 125 -1.280 20.929 11.691 1.00 63.44 C ATOM 1871 C SER A 125 -1.245 20.932 10.163 1.00 62.04 C ATOM 1872 O SER A 125 -2.041 21.613 9.514 1.00 11.24 O ATOM 1873 CB SER A 125 -0.731 22.248 12.238 1.00 62.23 C ATOM 1874 OG SER A 125 0.646 22.396 11.935 1.00 20.23 O ATOM 0 H SER A 125 0.439 20.037 12.489 1.00 13.11 H new ATOM 0 HA SER A 125 -2.317 20.822 12.011 1.00 63.44 H new ATOM 0 HB2 SER A 125 -1.291 23.082 11.814 1.00 62.23 H new ATOM 0 HB3 SER A 125 -0.874 22.284 13.318 1.00 62.23 H new ATOM 0 HG SER A 125 0.904 23.336 12.038 1.00 20.23 H new ATOM 1880 N PHE A 126 -0.312 20.165 9.598 1.00 55.24 N ATOM 1881 CA PHE A 126 -0.169 20.054 8.149 1.00 31.44 C ATOM 1882 C PHE A 126 -1.248 19.136 7.581 1.00 23.35 C ATOM 1883 O PHE A 126 -1.764 19.372 6.490 1.00 64.40 O ATOM 1884 CB PHE A 126 1.224 19.516 7.797 1.00 5.42 C ATOM 1885 CG PHE A 126 1.467 19.339 6.323 1.00 43.23 C ATOM 1886 CD1 PHE A 126 1.373 18.085 5.737 1.00 34.13 C ATOM 1887 CD2 PHE A 126 1.792 20.424 5.524 1.00 21.24 C ATOM 1888 CE1 PHE A 126 1.598 17.918 4.384 1.00 3.43 C ATOM 1889 CE2 PHE A 126 2.018 20.262 4.170 1.00 23.41 C ATOM 1890 CZ PHE A 126 1.920 19.008 3.600 1.00 41.24 C ATOM 0 H PHE A 126 0.359 19.609 10.127 1.00 55.24 H new ATOM 0 HA PHE A 126 -0.285 21.044 7.708 1.00 31.44 H new ATOM 0 HB2 PHE A 126 1.975 20.197 8.198 1.00 5.42 H new ATOM 0 HB3 PHE A 126 1.366 18.556 8.294 1.00 5.42 H new ATOM 0 HD1 PHE A 126 1.121 17.229 6.346 1.00 34.13 H new ATOM 0 HD2 PHE A 126 1.870 21.407 5.964 1.00 21.24 H new ATOM 0 HE1 PHE A 126 1.522 16.936 3.940 1.00 3.43 H new ATOM 0 HE2 PHE A 126 2.271 21.115 3.558 1.00 23.41 H new ATOM 0 HZ PHE A 126 2.095 18.880 2.542 1.00 41.24 H new ATOM 1900 N GLU A 127 -1.590 18.094 8.340 1.00 2.20 N ATOM 1901 CA GLU A 127 -2.610 17.132 7.926 1.00 74.21 C ATOM 1902 C GLU A 127 -4.017 17.693 8.131 1.00 13.00 C ATOM 1903 O GLU A 127 -5.001 17.100 7.690 1.00 70.13 O ATOM 1904 CB GLU A 127 -2.456 15.826 8.707 1.00 62.44 C ATOM 1905 CG GLU A 127 -1.135 15.117 8.457 1.00 21.40 C ATOM 1906 CD GLU A 127 -0.947 13.905 9.346 1.00 32.20 C ATOM 1907 OE1 GLU A 127 -1.256 12.783 8.893 1.00 43.30 O ATOM 1908 OE2 GLU A 127 -0.489 14.078 10.495 1.00 50.51 O1- ATOM 0 H GLU A 127 -1.173 17.895 9.249 1.00 2.20 H new ATOM 0 HA GLU A 127 -2.470 16.936 6.863 1.00 74.21 H new ATOM 0 HB2 GLU A 127 -2.549 16.037 9.772 1.00 62.44 H new ATOM 0 HB3 GLU A 127 -3.274 15.156 8.442 1.00 62.44 H new ATOM 0 HG2 GLU A 127 -1.084 14.808 7.413 1.00 21.40 H new ATOM 0 HG3 GLU A 127 -0.315 15.816 8.623 1.00 21.40 H new ATOM 1915 N GLN A 128 -4.101 18.837 8.804 1.00 53.35 N ATOM 1916 CA GLN A 128 -5.380 19.482 9.071 1.00 70.25 C ATOM 1917 C GLN A 128 -5.846 20.300 7.867 1.00 60.34 C ATOM 1918 O GLN A 128 -7.039 20.352 7.564 1.00 75.44 O ATOM 1919 CB GLN A 128 -5.260 20.387 10.301 1.00 10.01 C ATOM 1920 CG GLN A 128 -6.566 21.057 10.701 1.00 62.21 C ATOM 1921 CD GLN A 128 -6.388 22.074 11.812 1.00 34.24 C ATOM 1922 OE1 GLN A 128 -5.508 21.937 12.662 1.00 71.43 O ATOM 1923 NE2 GLN A 128 -7.227 23.103 11.809 1.00 3.22 N ATOM 0 H GLN A 128 -3.293 19.337 9.175 1.00 53.35 H new ATOM 0 HA GLN A 128 -6.120 18.705 9.262 1.00 70.25 H new ATOM 0 HB2 GLN A 128 -4.894 19.796 11.141 1.00 10.01 H new ATOM 0 HB3 GLN A 128 -4.514 21.156 10.103 1.00 10.01 H new ATOM 0 HG2 GLN A 128 -6.998 21.549 9.830 1.00 62.21 H new ATOM 0 HG3 GLN A 128 -7.276 20.295 11.022 1.00 62.21 H new ATOM 0 HE21 GLN A 128 -7.941 23.176 11.085 1.00 3.22 H new ATOM 0 HE22 GLN A 128 -7.157 23.820 12.531 1.00 3.22 H new ATOM 1932 N VAL A 129 -4.897 20.929 7.179 1.00 52.22 N ATOM 1933 CA VAL A 129 -5.215 21.757 6.019 1.00 22.34 C ATOM 1934 C VAL A 129 -4.958 21.011 4.706 1.00 31.31 C ATOM 1935 O VAL A 129 -5.340 21.480 3.632 1.00 12.30 O ATOM 1936 CB VAL A 129 -4.401 23.071 6.024 1.00 11.54 C ATOM 1937 CG1 VAL A 129 -5.130 24.157 5.248 1.00 31.31 C ATOM 1938 CG2 VAL A 129 -4.118 23.533 7.447 1.00 52.41 C ATOM 0 H VAL A 129 -3.903 20.881 7.404 1.00 52.22 H new ATOM 0 HA VAL A 129 -6.277 21.994 6.088 1.00 22.34 H new ATOM 0 HB VAL A 129 -3.447 22.876 5.534 1.00 11.54 H new ATOM 0 HG11 VAL A 129 -4.540 25.074 5.264 1.00 31.31 H new ATOM 0 HG12 VAL A 129 -5.272 23.834 4.217 1.00 31.31 H new ATOM 0 HG13 VAL A 129 -6.101 24.343 5.707 1.00 31.31 H new ATOM 0 HG21 VAL A 129 -3.544 24.459 7.421 1.00 52.41 H new ATOM 0 HG22 VAL A 129 -5.060 23.704 7.968 1.00 52.41 H new ATOM 0 HG23 VAL A 129 -3.547 22.767 7.972 1.00 52.41 H new ATOM 1948 N VAL A 130 -4.320 19.844 4.794 1.00 21.12 N ATOM 1949 CA VAL A 130 -4.020 19.050 3.604 1.00 62.21 C ATOM 1950 C VAL A 130 -5.233 18.221 3.170 1.00 32.14 C ATOM 1951 O VAL A 130 -5.293 17.739 2.039 1.00 22.20 O ATOM 1952 CB VAL A 130 -2.797 18.127 3.830 1.00 32.44 C ATOM 1953 CG1 VAL A 130 -3.200 16.806 4.471 1.00 23.44 C ATOM 1954 CG2 VAL A 130 -2.059 17.889 2.521 1.00 2.30 C ATOM 0 H VAL A 130 -4.003 19.430 5.671 1.00 21.12 H new ATOM 0 HA VAL A 130 -3.775 19.751 2.806 1.00 62.21 H new ATOM 0 HB VAL A 130 -2.124 18.633 4.522 1.00 32.44 H new ATOM 0 HG11 VAL A 130 -2.315 16.186 4.614 1.00 23.44 H new ATOM 0 HG12 VAL A 130 -3.668 16.998 5.437 1.00 23.44 H new ATOM 0 HG13 VAL A 130 -3.906 16.287 3.822 1.00 23.44 H new ATOM 0 HG21 VAL A 130 -1.203 17.238 2.699 1.00 2.30 H new ATOM 0 HG22 VAL A 130 -2.731 17.416 1.805 1.00 2.30 H new ATOM 0 HG23 VAL A 130 -1.713 18.842 2.120 1.00 2.30 H new ATOM 1964 N ASN A 131 -6.201 18.070 4.074 1.00 62.35 N ATOM 1965 CA ASN A 131 -7.413 17.308 3.781 1.00 15.13 C ATOM 1966 C ASN A 131 -8.419 18.160 3.012 1.00 62.24 C ATOM 1967 O ASN A 131 -9.408 17.647 2.487 1.00 44.43 O ATOM 1968 CB ASN A 131 -8.048 16.793 5.075 1.00 1.33 C ATOM 1969 CG ASN A 131 -7.328 15.581 5.639 1.00 43.42 C ATOM 1970 OD1 ASN A 131 -6.124 15.413 5.451 1.00 41.44 O ATOM 1971 ND2 ASN A 131 -8.068 14.727 6.335 1.00 72.21 N ATOM 0 H ASN A 131 -6.169 18.465 5.014 1.00 62.35 H new ATOM 0 HA ASN A 131 -7.133 16.457 3.160 1.00 15.13 H new ATOM 0 HB2 ASN A 131 -8.046 17.590 5.818 1.00 1.33 H new ATOM 0 HB3 ASN A 131 -9.090 16.536 4.886 1.00 1.33 H new ATOM 0 HD21 ASN A 131 -7.641 13.893 6.738 1.00 72.21 H new ATOM 0 HD22 ASN A 131 -9.064 14.905 6.467 1.00 72.21 H new ATOM 1978 N GLU A 132 -8.156 19.464 2.951 1.00 40.21 N ATOM 1979 CA GLU A 132 -9.029 20.395 2.243 1.00 4.42 C ATOM 1980 C GLU A 132 -8.776 20.334 0.738 1.00 0.33 C ATOM 1981 O GLU A 132 -9.637 20.701 -0.062 1.00 34.43 O ATOM 1982 CB GLU A 132 -8.809 21.822 2.752 1.00 63.23 C ATOM 1983 CG GLU A 132 -9.024 21.979 4.251 1.00 31.12 C ATOM 1984 CD GLU A 132 -10.432 21.613 4.684 1.00 11.25 C ATOM 1985 OE1 GLU A 132 -10.615 20.505 5.231 1.00 5.51 O ATOM 1986 OE2 GLU A 132 -11.349 22.435 4.477 1.00 42.21 O1- ATOM 0 H GLU A 132 -7.342 19.900 3.385 1.00 40.21 H new ATOM 0 HA GLU A 132 -10.062 20.105 2.434 1.00 4.42 H new ATOM 0 HB2 GLU A 132 -7.794 22.133 2.505 1.00 63.23 H new ATOM 0 HB3 GLU A 132 -9.486 22.494 2.225 1.00 63.23 H new ATOM 0 HG2 GLU A 132 -8.310 21.351 4.784 1.00 31.12 H new ATOM 0 HG3 GLU A 132 -8.817 23.010 4.537 1.00 31.12 H new ATOM 1993 N LEU A 133 -7.587 19.868 0.361 1.00 43.41 N ATOM 1994 CA LEU A 133 -7.219 19.749 -1.045 1.00 30.13 C ATOM 1995 C LEU A 133 -7.198 18.285 -1.484 1.00 24.24 C ATOM 1996 O LEU A 133 -7.097 17.987 -2.674 1.00 34.34 O ATOM 1997 CB LEU A 133 -5.856 20.407 -1.299 1.00 74.13 C ATOM 1998 CG LEU A 133 -4.713 19.937 -0.392 1.00 42.24 C ATOM 1999 CD1 LEU A 133 -3.877 18.871 -1.084 1.00 34.23 C ATOM 2000 CD2 LEU A 133 -3.840 21.115 0.016 1.00 20.31 C ATOM 0 H LEU A 133 -6.862 19.567 1.012 1.00 43.41 H new ATOM 0 HA LEU A 133 -7.972 20.268 -1.638 1.00 30.13 H new ATOM 0 HB2 LEU A 133 -5.572 20.224 -2.335 1.00 74.13 H new ATOM 0 HB3 LEU A 133 -5.966 21.485 -1.185 1.00 74.13 H new ATOM 0 HG LEU A 133 -5.149 19.499 0.506 1.00 42.24 H new ATOM 0 HD11 LEU A 133 -3.072 18.553 -0.421 1.00 34.23 H new ATOM 0 HD12 LEU A 133 -4.507 18.015 -1.327 1.00 34.23 H new ATOM 0 HD13 LEU A 133 -3.452 19.280 -2.001 1.00 34.23 H new ATOM 0 HD21 LEU A 133 -3.033 20.764 0.660 1.00 20.31 H new ATOM 0 HD22 LEU A 133 -3.417 21.580 -0.875 1.00 20.31 H new ATOM 0 HD23 LEU A 133 -4.443 21.845 0.555 1.00 20.31 H new ATOM 2012 N PHE A 134 -7.299 17.377 -0.514 1.00 54.13 N ATOM 2013 CA PHE A 134 -7.294 15.945 -0.800 1.00 63.14 C ATOM 2014 C PHE A 134 -8.713 15.384 -0.853 1.00 43.10 C ATOM 2015 O PHE A 134 -8.906 14.169 -0.925 1.00 40.33 O ATOM 2016 CB PHE A 134 -6.476 15.190 0.249 1.00 74.12 C ATOM 2017 CG PHE A 134 -5.129 14.749 -0.248 1.00 31.43 C ATOM 2018 CD1 PHE A 134 -3.983 15.025 0.478 1.00 50.23 C ATOM 2019 CD2 PHE A 134 -5.011 14.057 -1.444 1.00 34.14 C ATOM 2020 CE1 PHE A 134 -2.744 14.619 0.022 1.00 42.50 C ATOM 2021 CE2 PHE A 134 -3.774 13.649 -1.905 1.00 64.34 C ATOM 2022 CZ PHE A 134 -2.639 13.930 -1.171 1.00 41.30 C ATOM 0 H PHE A 134 -7.385 17.608 0.476 1.00 54.13 H new ATOM 0 HA PHE A 134 -6.834 15.807 -1.779 1.00 63.14 H new ATOM 0 HB2 PHE A 134 -6.342 15.828 1.122 1.00 74.12 H new ATOM 0 HB3 PHE A 134 -7.038 14.316 0.577 1.00 74.12 H new ATOM 0 HD1 PHE A 134 -4.059 15.564 1.411 1.00 50.23 H new ATOM 0 HD2 PHE A 134 -5.896 13.834 -2.022 1.00 34.14 H new ATOM 0 HE1 PHE A 134 -1.857 14.840 0.598 1.00 42.50 H new ATOM 0 HE2 PHE A 134 -3.695 13.111 -2.838 1.00 64.34 H new ATOM 0 HZ PHE A 134 -1.671 13.612 -1.529 1.00 41.30 H new ATOM 2032 N ARG A 135 -9.702 16.276 -0.820 1.00 72.13 N ATOM 2033 CA ARG A 135 -11.104 15.873 -0.874 1.00 14.02 C ATOM 2034 C ARG A 135 -11.476 15.390 -2.276 1.00 12.25 C ATOM 2035 O ARG A 135 -12.364 14.552 -2.441 1.00 25.54 O ATOM 2036 CB ARG A 135 -12.008 17.038 -0.460 1.00 51.01 C ATOM 2037 CG ARG A 135 -11.755 18.317 -1.243 1.00 3.33 C ATOM 2038 CD ARG A 135 -12.818 19.366 -0.966 1.00 41.35 C ATOM 2039 NE ARG A 135 -12.607 20.576 -1.756 1.00 15.33 N ATOM 2040 CZ ARG A 135 -13.577 21.229 -2.391 1.00 70.32 C ATOM 2041 NH1 ARG A 135 -14.830 20.795 -2.330 1.00 54.21 N1+ ATOM 2042 NH2 ARG A 135 -13.293 22.318 -3.092 1.00 54.11 N ATOM 0 H ARG A 135 -9.557 17.284 -0.756 1.00 72.13 H new ATOM 0 HA ARG A 135 -11.249 15.048 -0.176 1.00 14.02 H new ATOM 0 HB2 ARG A 135 -13.049 16.743 -0.591 1.00 51.01 H new ATOM 0 HB3 ARG A 135 -11.864 17.238 0.602 1.00 51.01 H new ATOM 0 HG2 ARG A 135 -10.774 18.715 -0.982 1.00 3.33 H new ATOM 0 HG3 ARG A 135 -11.735 18.093 -2.309 1.00 3.33 H new ATOM 0 HD2 ARG A 135 -13.802 18.954 -1.189 1.00 41.35 H new ATOM 0 HD3 ARG A 135 -12.811 19.619 0.094 1.00 41.35 H new ATOM 0 HE ARG A 135 -11.658 20.943 -1.825 1.00 15.33 H new ATOM 0 HH11 ARG A 135 -15.054 19.956 -1.794 1.00 54.21 H new ATOM 0 HH12 ARG A 135 -15.569 21.300 -2.819 1.00 54.21 H new ATOM 0 HH21 ARG A 135 -12.332 22.655 -3.144 1.00 54.11 H new ATOM 0 HH22 ARG A 135 -14.036 22.819 -3.579 1.00 54.11 H new ATOM 2056 N ASP A 136 -10.786 15.926 -3.280 1.00 34.00 N ATOM 2057 CA ASP A 136 -11.025 15.552 -4.668 1.00 23.21 C ATOM 2058 C ASP A 136 -9.739 15.052 -5.317 1.00 12.24 C ATOM 2059 O ASP A 136 -9.657 14.927 -6.539 1.00 13.01 O ATOM 2060 CB ASP A 136 -11.582 16.742 -5.456 1.00 12.15 C ATOM 2061 CG ASP A 136 -12.961 17.157 -4.982 1.00 41.24 C ATOM 2062 OD1 ASP A 136 -13.079 18.246 -4.383 1.00 31.33 O ATOM 2063 OD2 ASP A 136 -13.922 16.392 -5.208 1.00 31.34 O1- ATOM 0 H ASP A 136 -10.053 16.624 -3.155 1.00 34.00 H new ATOM 0 HA ASP A 136 -11.760 14.747 -4.682 1.00 23.21 H new ATOM 0 HB2 ASP A 136 -10.900 17.587 -5.363 1.00 12.15 H new ATOM 0 HB3 ASP A 136 -11.627 16.484 -6.514 1.00 12.15 H new ATOM 2068 N GLY A 137 -8.737 14.762 -4.485 1.00 44.32 N ATOM 2069 CA GLY A 137 -7.462 14.276 -4.985 1.00 35.12 C ATOM 2070 C GLY A 137 -7.437 12.769 -5.163 1.00 75.04 C ATOM 2071 O GLY A 137 -6.530 12.094 -4.675 1.00 42.11 O ATOM 0 H GLY A 137 -8.788 14.856 -3.471 1.00 44.32 H new ATOM 0 HA2 GLY A 137 -7.245 14.754 -5.940 1.00 35.12 H new ATOM 0 HA3 GLY A 137 -6.671 14.569 -4.295 1.00 35.12 H new ATOM 2075 N VAL A 138 -8.437 12.243 -5.866 1.00 35.22 N ATOM 2076 CA VAL A 138 -8.535 10.809 -6.115 1.00 35.12 C ATOM 2077 C VAL A 138 -8.178 10.490 -7.568 1.00 75.24 C ATOM 2078 O VAL A 138 -8.195 9.332 -7.988 1.00 74.33 O ATOM 2079 CB VAL A 138 -9.954 10.272 -5.806 1.00 14.54 C ATOM 2080 CG1 VAL A 138 -9.912 8.784 -5.484 1.00 12.53 C ATOM 2081 CG2 VAL A 138 -10.595 11.046 -4.662 1.00 54.32 C ATOM 0 H VAL A 138 -9.193 12.792 -6.274 1.00 35.22 H new ATOM 0 HA VAL A 138 -7.827 10.317 -5.448 1.00 35.12 H new ATOM 0 HB VAL A 138 -10.565 10.414 -6.697 1.00 14.54 H new ATOM 0 HG11 VAL A 138 -10.920 8.429 -5.270 1.00 12.53 H new ATOM 0 HG12 VAL A 138 -9.509 8.238 -6.337 1.00 12.53 H new ATOM 0 HG13 VAL A 138 -9.277 8.618 -4.614 1.00 12.53 H new ATOM 0 HG21 VAL A 138 -11.591 10.648 -4.466 1.00 54.32 H new ATOM 0 HG22 VAL A 138 -9.982 10.946 -3.766 1.00 54.32 H new ATOM 0 HG23 VAL A 138 -10.672 12.099 -4.933 1.00 54.32 H new ATOM 2091 N ASN A 139 -7.853 11.528 -8.334 1.00 21.43 N ATOM 2092 CA ASN A 139 -7.487 11.359 -9.736 1.00 1.11 C ATOM 2093 C ASN A 139 -5.982 11.515 -9.931 1.00 63.12 C ATOM 2094 O ASN A 139 -5.271 11.960 -9.030 1.00 35.44 O ATOM 2095 CB ASN A 139 -8.236 12.368 -10.612 1.00 32.13 C ATOM 2096 CG ASN A 139 -9.602 11.870 -11.052 1.00 40.14 C ATOM 2097 OD1 ASN A 139 -10.239 11.055 -10.219 1.00 63.25 O flip ATOM 2098 ND2 ASN A 139 -10.081 12.219 -12.131 1.00 74.42 N flip ATOM 0 H ASN A 139 -7.836 12.494 -8.007 1.00 21.43 H new ATOM 0 HA ASN A 139 -7.771 10.350 -10.037 1.00 1.11 H new ATOM 0 HB2 ASN A 139 -8.355 13.301 -10.062 1.00 32.13 H new ATOM 0 HB3 ASN A 139 -7.635 12.592 -11.494 1.00 32.13 H new ATOM 0 HD21 ASN A 139 -9.558 12.847 -12.742 1.00 74.42 H new ATOM 0 HD22 ASN A 139 -11.001 11.880 -12.414 1.00 74.42 H new ATOM 2105 N TRP A 140 -5.511 11.152 -11.121 1.00 54.33 N ATOM 2106 CA TRP A 140 -4.090 11.232 -11.455 1.00 61.13 C ATOM 2107 C TRP A 140 -3.661 12.670 -11.744 1.00 40.24 C ATOM 2108 O TRP A 140 -2.476 12.999 -11.669 1.00 42.12 O ATOM 2109 CB TRP A 140 -3.786 10.346 -12.668 1.00 54.30 C ATOM 2110 CG TRP A 140 -3.815 8.876 -12.363 1.00 12.32 C ATOM 2111 CD1 TRP A 140 -2.736 8.064 -12.160 1.00 2.44 C ATOM 2112 CD2 TRP A 140 -4.975 8.042 -12.230 1.00 0.43 C ATOM 2113 NE1 TRP A 140 -3.152 6.779 -11.907 1.00 60.20 N ATOM 2114 CE2 TRP A 140 -4.521 6.740 -11.944 1.00 11.14 C ATOM 2115 CE3 TRP A 140 -6.352 8.268 -12.322 1.00 43.34 C ATOM 2116 CZ2 TRP A 140 -5.394 5.673 -11.750 1.00 33.21 C ATOM 2117 CZ3 TRP A 140 -7.217 7.207 -12.130 1.00 62.13 C ATOM 2118 CH2 TRP A 140 -6.735 5.924 -11.846 1.00 55.42 C ATOM 0 H TRP A 140 -6.097 10.797 -11.876 1.00 54.33 H new ATOM 0 HA TRP A 140 -3.525 10.879 -10.593 1.00 61.13 H new ATOM 0 HB2 TRP A 140 -4.511 10.560 -13.454 1.00 54.30 H new ATOM 0 HB3 TRP A 140 -2.803 10.607 -13.061 1.00 54.30 H new ATOM 0 HD1 TRP A 140 -1.705 8.385 -12.193 1.00 2.44 H new ATOM 0 HE1 TRP A 140 -2.541 5.984 -11.722 1.00 60.20 H new ATOM 0 HE3 TRP A 140 -6.733 9.255 -12.539 1.00 43.34 H new ATOM 0 HZ2 TRP A 140 -5.025 4.682 -11.531 1.00 33.21 H new ATOM 0 HZ3 TRP A 140 -8.282 7.371 -12.200 1.00 62.13 H new ATOM 0 HH2 TRP A 140 -7.436 5.116 -11.700 1.00 55.42 H new ATOM 2129 N GLY A 141 -4.629 13.523 -12.071 1.00 64.25 N ATOM 2130 CA GLY A 141 -4.328 14.913 -12.368 1.00 31.02 C ATOM 2131 C GLY A 141 -4.870 15.871 -11.324 1.00 22.22 C ATOM 2132 O GLY A 141 -4.867 17.085 -11.529 1.00 14.23 O ATOM 0 H GLY A 141 -5.617 13.276 -12.135 1.00 64.25 H new ATOM 0 HA2 GLY A 141 -3.248 15.038 -12.442 1.00 31.02 H new ATOM 0 HA3 GLY A 141 -4.746 15.170 -13.341 1.00 31.02 H new ATOM 2136 N ARG A 142 -5.338 15.329 -10.202 1.00 73.43 N ATOM 2137 CA ARG A 142 -5.885 16.151 -9.125 1.00 35.51 C ATOM 2138 C ARG A 142 -4.958 16.159 -7.911 1.00 65.42 C ATOM 2139 O ARG A 142 -5.175 16.912 -6.960 1.00 75.45 O ATOM 2140 CB ARG A 142 -7.274 15.652 -8.720 1.00 24.11 C ATOM 2141 CG ARG A 142 -8.419 16.367 -9.426 1.00 21.43 C ATOM 2142 CD ARG A 142 -8.430 16.087 -10.922 1.00 70.43 C ATOM 2143 NE ARG A 142 -9.554 16.737 -11.592 1.00 22.41 N ATOM 2144 CZ ARG A 142 -9.929 16.466 -12.840 1.00 12.10 C ATOM 2145 NH1 ARG A 142 -9.272 15.562 -13.555 1.00 44.31 N1+ ATOM 2146 NH2 ARG A 142 -10.964 17.099 -13.374 1.00 70.32 N ATOM 0 H ARG A 142 -5.350 14.326 -10.015 1.00 73.43 H new ATOM 0 HA ARG A 142 -5.970 17.172 -9.497 1.00 35.51 H new ATOM 0 HB2 ARG A 142 -7.341 14.585 -8.930 1.00 24.11 H new ATOM 0 HB3 ARG A 142 -7.393 15.773 -7.643 1.00 24.11 H new ATOM 0 HG2 ARG A 142 -9.367 16.051 -8.991 1.00 21.43 H new ATOM 0 HG3 ARG A 142 -8.334 17.441 -9.259 1.00 21.43 H new ATOM 0 HD2 ARG A 142 -7.495 16.434 -11.363 1.00 70.43 H new ATOM 0 HD3 ARG A 142 -8.481 15.011 -11.089 1.00 70.43 H new ATOM 0 HE ARG A 142 -10.082 17.439 -11.073 1.00 22.41 H new ATOM 0 HH11 ARG A 142 -8.476 15.071 -13.149 1.00 44.31 H new ATOM 0 HH12 ARG A 142 -9.563 15.358 -14.511 1.00 44.31 H new ATOM 0 HH21 ARG A 142 -11.473 17.794 -12.828 1.00 70.32 H new ATOM 0 HH22 ARG A 142 -11.251 16.891 -14.330 1.00 70.32 H new ATOM 2160 N ILE A 143 -3.926 15.319 -7.950 1.00 31.43 N ATOM 2161 CA ILE A 143 -2.962 15.238 -6.857 1.00 43.20 C ATOM 2162 C ILE A 143 -1.809 16.222 -7.085 1.00 53.11 C ATOM 2163 O ILE A 143 -0.907 16.353 -6.255 1.00 4.22 O ATOM 2164 CB ILE A 143 -2.409 13.799 -6.701 1.00 72.55 C ATOM 2165 CG1 ILE A 143 -1.687 13.639 -5.356 1.00 22.11 C ATOM 2166 CG2 ILE A 143 -1.483 13.451 -7.862 1.00 61.31 C ATOM 2167 CD1 ILE A 143 -1.238 12.223 -5.062 1.00 62.43 C ATOM 0 H ILE A 143 -3.737 14.685 -8.727 1.00 31.43 H new ATOM 0 HA ILE A 143 -3.480 15.505 -5.936 1.00 43.20 H new ATOM 0 HB ILE A 143 -3.249 13.104 -6.718 1.00 72.55 H new ATOM 0 HG12 ILE A 143 -0.817 14.295 -5.342 1.00 22.11 H new ATOM 0 HG13 ILE A 143 -2.350 13.972 -4.558 1.00 22.11 H new ATOM 0 HG21 ILE A 143 -1.105 12.437 -7.734 1.00 61.31 H new ATOM 0 HG22 ILE A 143 -2.035 13.517 -8.800 1.00 61.31 H new ATOM 0 HG23 ILE A 143 -0.647 14.150 -7.883 1.00 61.31 H new ATOM 0 HD11 ILE A 143 -0.737 12.194 -4.095 1.00 62.43 H new ATOM 0 HD12 ILE A 143 -2.105 11.563 -5.041 1.00 62.43 H new ATOM 0 HD13 ILE A 143 -0.548 11.891 -5.838 1.00 62.43 H new ATOM 2179 N VAL A 144 -1.860 16.926 -8.216 1.00 42.22 N ATOM 2180 CA VAL A 144 -0.834 17.902 -8.565 1.00 70.12 C ATOM 2181 C VAL A 144 -0.924 19.135 -7.664 1.00 13.34 C ATOM 2182 O VAL A 144 0.057 19.859 -7.487 1.00 50.21 O ATOM 2183 CB VAL A 144 -0.944 18.339 -10.043 1.00 63.44 C ATOM 2184 CG1 VAL A 144 0.357 18.972 -10.512 1.00 60.24 C ATOM 2185 CG2 VAL A 144 -1.315 17.161 -10.932 1.00 34.33 C ATOM 0 H VAL A 144 -2.605 16.836 -8.907 1.00 42.22 H new ATOM 0 HA VAL A 144 0.131 17.416 -8.417 1.00 70.12 H new ATOM 0 HB VAL A 144 -1.737 19.083 -10.117 1.00 63.44 H new ATOM 0 HG11 VAL A 144 0.260 19.273 -11.555 1.00 60.24 H new ATOM 0 HG12 VAL A 144 0.577 19.847 -9.901 1.00 60.24 H new ATOM 0 HG13 VAL A 144 1.168 18.250 -10.417 1.00 60.24 H new ATOM 0 HG21 VAL A 144 -1.386 17.495 -11.967 1.00 34.33 H new ATOM 0 HG22 VAL A 144 -0.550 16.389 -10.851 1.00 34.33 H new ATOM 0 HG23 VAL A 144 -2.275 16.754 -10.615 1.00 34.33 H new ATOM 2195 N ALA A 145 -2.108 19.364 -7.091 1.00 72.13 N ATOM 2196 CA ALA A 145 -2.326 20.495 -6.191 1.00 54.42 C ATOM 2197 C ALA A 145 -1.614 20.265 -4.860 1.00 14.40 C ATOM 2198 O ALA A 145 -1.267 21.213 -4.154 1.00 71.23 O ATOM 2199 CB ALA A 145 -3.814 20.715 -5.966 1.00 2.45 C ATOM 0 H ALA A 145 -2.931 18.779 -7.236 1.00 72.13 H new ATOM 0 HA ALA A 145 -1.910 21.389 -6.654 1.00 54.42 H new ATOM 0 HB1 ALA A 145 -3.959 21.561 -5.294 1.00 2.45 H new ATOM 0 HB2 ALA A 145 -4.299 20.922 -6.920 1.00 2.45 H new ATOM 0 HB3 ALA A 145 -4.251 19.820 -5.523 1.00 2.45 H new ATOM 2205 N PHE A 146 -1.407 18.991 -4.531 1.00 2.20 N ATOM 2206 CA PHE A 146 -0.722 18.603 -3.304 1.00 62.11 C ATOM 2207 C PHE A 146 0.775 18.883 -3.425 1.00 64.51 C ATOM 2208 O PHE A 146 1.433 19.247 -2.449 1.00 35.24 O ATOM 2209 CB PHE A 146 -0.974 17.116 -3.025 1.00 1.14 C ATOM 2210 CG PHE A 146 -0.149 16.541 -1.906 1.00 4.25 C ATOM 2211 CD1 PHE A 146 -0.227 17.063 -0.625 1.00 50.41 C ATOM 2212 CD2 PHE A 146 0.699 15.469 -2.138 1.00 20.52 C ATOM 2213 CE1 PHE A 146 0.524 16.527 0.403 1.00 22.33 C ATOM 2214 CE2 PHE A 146 1.453 14.931 -1.115 1.00 10.24 C ATOM 2215 CZ PHE A 146 1.365 15.460 0.158 1.00 73.52 C ATOM 0 H PHE A 146 -1.708 18.204 -5.106 1.00 2.20 H new ATOM 0 HA PHE A 146 -1.111 19.189 -2.471 1.00 62.11 H new ATOM 0 HB2 PHE A 146 -2.029 16.978 -2.789 1.00 1.14 H new ATOM 0 HB3 PHE A 146 -0.774 16.550 -3.935 1.00 1.14 H new ATOM 0 HD1 PHE A 146 -0.882 17.898 -0.428 1.00 50.41 H new ATOM 0 HD2 PHE A 146 0.770 15.050 -3.131 1.00 20.52 H new ATOM 0 HE1 PHE A 146 0.453 16.942 1.397 1.00 22.33 H new ATOM 0 HE2 PHE A 146 2.111 14.097 -1.310 1.00 10.24 H new ATOM 0 HZ PHE A 146 1.953 15.040 0.960 1.00 73.52 H new ATOM 2225 N PHE A 147 1.299 18.721 -4.639 1.00 11.32 N ATOM 2226 CA PHE A 147 2.713 18.961 -4.907 1.00 1.21 C ATOM 2227 C PHE A 147 2.989 20.455 -5.057 1.00 32.03 C ATOM 2228 O PHE A 147 4.124 20.905 -4.905 1.00 20.42 O ATOM 2229 CB PHE A 147 3.149 18.218 -6.173 1.00 1.02 C ATOM 2230 CG PHE A 147 2.941 16.730 -6.105 1.00 34.05 C ATOM 2231 CD1 PHE A 147 3.348 16.008 -4.993 1.00 44.02 C ATOM 2232 CD2 PHE A 147 2.342 16.054 -7.154 1.00 43.44 C ATOM 2233 CE1 PHE A 147 3.158 14.641 -4.929 1.00 2.22 C ATOM 2234 CE2 PHE A 147 2.150 14.686 -7.097 1.00 75.23 C ATOM 2235 CZ PHE A 147 2.558 13.980 -5.983 1.00 20.24 C ATOM 0 H PHE A 147 0.762 18.424 -5.454 1.00 11.32 H new ATOM 0 HA PHE A 147 3.288 18.585 -4.061 1.00 1.21 H new ATOM 0 HB2 PHE A 147 2.596 18.614 -7.024 1.00 1.02 H new ATOM 0 HB3 PHE A 147 4.204 18.420 -6.357 1.00 1.02 H new ATOM 0 HD1 PHE A 147 3.819 16.520 -4.167 1.00 44.02 H new ATOM 0 HD2 PHE A 147 2.021 16.602 -8.028 1.00 43.44 H new ATOM 0 HE1 PHE A 147 3.478 14.090 -4.057 1.00 2.22 H new ATOM 0 HE2 PHE A 147 1.682 14.171 -7.922 1.00 75.23 H new ATOM 0 HZ PHE A 147 2.408 12.911 -5.936 1.00 20.24 H new ATOM 2245 N SER A 148 1.938 21.219 -5.354 1.00 44.32 N ATOM 2246 CA SER A 148 2.059 22.664 -5.517 1.00 41.34 C ATOM 2247 C SER A 148 2.069 23.364 -4.159 1.00 63.02 C ATOM 2248 O SER A 148 2.459 24.528 -4.052 1.00 11.15 O ATOM 2249 CB SER A 148 0.912 23.200 -6.376 1.00 15.04 C ATOM 2250 OG SER A 148 0.997 22.713 -7.705 1.00 33.54 O ATOM 0 H SER A 148 0.993 20.859 -5.486 1.00 44.32 H new ATOM 0 HA SER A 148 3.004 22.872 -6.019 1.00 41.34 H new ATOM 0 HB2 SER A 148 -0.042 22.906 -5.938 1.00 15.04 H new ATOM 0 HB3 SER A 148 0.937 24.290 -6.383 1.00 15.04 H new ATOM 0 HG SER A 148 0.708 21.777 -7.730 1.00 33.54 H new ATOM 2256 N PHE A 149 1.639 22.644 -3.125 1.00 60.53 N ATOM 2257 CA PHE A 149 1.607 23.183 -1.771 1.00 53.25 C ATOM 2258 C PHE A 149 2.946 22.948 -1.071 1.00 43.24 C ATOM 2259 O PHE A 149 3.336 23.706 -0.182 1.00 32.13 O ATOM 2260 CB PHE A 149 0.471 22.538 -0.972 1.00 71.21 C ATOM 2261 CG PHE A 149 0.214 23.197 0.355 1.00 41.30 C ATOM 2262 CD1 PHE A 149 -0.251 24.501 0.416 1.00 34.43 C ATOM 2263 CD2 PHE A 149 0.438 22.514 1.540 1.00 11.54 C ATOM 2264 CE1 PHE A 149 -0.487 25.111 1.632 1.00 1.15 C ATOM 2265 CE2 PHE A 149 0.203 23.119 2.760 1.00 32.33 C ATOM 2266 CZ PHE A 149 -0.260 24.419 2.806 1.00 71.42 C ATOM 0 H PHE A 149 1.307 21.683 -3.202 1.00 60.53 H new ATOM 0 HA PHE A 149 1.430 24.257 -1.829 1.00 53.25 H new ATOM 0 HB2 PHE A 149 -0.442 22.570 -1.566 1.00 71.21 H new ATOM 0 HB3 PHE A 149 0.707 21.487 -0.806 1.00 71.21 H new ATOM 0 HD1 PHE A 149 -0.431 25.047 -0.498 1.00 34.43 H new ATOM 0 HD2 PHE A 149 0.800 21.497 1.510 1.00 11.54 H new ATOM 0 HE1 PHE A 149 -0.849 26.128 1.665 1.00 1.15 H new ATOM 0 HE2 PHE A 149 0.381 22.576 3.676 1.00 32.33 H new ATOM 0 HZ PHE A 149 -0.444 24.894 3.758 1.00 71.42 H new ATOM 2276 N GLY A 150 3.645 21.891 -1.487 1.00 53.35 N ATOM 2277 CA GLY A 150 4.935 21.570 -0.902 1.00 14.43 C ATOM 2278 C GLY A 150 6.043 22.467 -1.419 1.00 20.20 C ATOM 2279 O GLY A 150 6.968 22.810 -0.681 1.00 21.02 O ATOM 0 H GLY A 150 3.338 21.252 -2.220 1.00 53.35 H new ATOM 0 HA2 GLY A 150 4.872 21.662 0.182 1.00 14.43 H new ATOM 0 HA3 GLY A 150 5.181 20.531 -1.120 1.00 14.43 H new ATOM 2283 N GLY A 151 5.943 22.851 -2.690 1.00 22.22 N ATOM 2284 CA GLY A 151 6.943 23.719 -3.290 1.00 54.03 C ATOM 2285 C GLY A 151 6.684 25.187 -3.001 1.00 31.24 C ATOM 2286 O GLY A 151 7.427 26.056 -3.458 1.00 21.32 O ATOM 0 H GLY A 151 5.186 22.576 -3.316 1.00 22.22 H new ATOM 0 HA2 GLY A 151 7.929 23.446 -2.915 1.00 54.03 H new ATOM 0 HA3 GLY A 151 6.957 23.561 -4.368 1.00 54.03 H new ATOM 2290 N ALA A 152 5.623 25.460 -2.244 1.00 51.32 N ATOM 2291 CA ALA A 152 5.266 26.825 -1.880 1.00 32.42 C ATOM 2292 C ALA A 152 6.082 27.292 -0.679 1.00 3.21 C ATOM 2293 O ALA A 152 6.420 28.470 -0.563 1.00 11.44 O ATOM 2294 CB ALA A 152 3.776 26.918 -1.582 1.00 63.13 C ATOM 0 H ALA A 152 4.995 24.749 -1.871 1.00 51.32 H new ATOM 0 HA ALA A 152 5.494 27.479 -2.722 1.00 32.42 H new ATOM 0 HB1 ALA A 152 3.522 27.943 -1.311 1.00 63.13 H new ATOM 0 HB2 ALA A 152 3.209 26.625 -2.466 1.00 63.13 H new ATOM 0 HB3 ALA A 152 3.528 26.252 -0.755 1.00 63.13 H new ATOM 2300 N LEU A 153 6.398 26.353 0.211 1.00 32.11 N ATOM 2301 CA LEU A 153 7.182 26.658 1.403 1.00 31.34 C ATOM 2302 C LEU A 153 8.659 26.356 1.163 1.00 2.33 C ATOM 2303 O LEU A 153 9.224 25.436 1.756 1.00 22.33 O ATOM 2304 CB LEU A 153 6.669 25.858 2.608 1.00 45.23 C ATOM 2305 CG LEU A 153 5.488 26.474 3.372 1.00 11.41 C ATOM 2306 CD1 LEU A 153 5.796 27.905 3.782 1.00 2.13 C ATOM 2307 CD2 LEU A 153 4.212 26.416 2.543 1.00 42.32 C ATOM 0 H LEU A 153 6.122 25.375 0.128 1.00 32.11 H new ATOM 0 HA LEU A 153 7.072 27.721 1.619 1.00 31.34 H new ATOM 0 HB2 LEU A 153 6.375 24.867 2.262 1.00 45.23 H new ATOM 0 HB3 LEU A 153 7.495 25.720 3.306 1.00 45.23 H new ATOM 0 HG LEU A 153 5.331 25.886 4.276 1.00 11.41 H new ATOM 0 HD11 LEU A 153 4.945 28.320 4.322 1.00 2.13 H new ATOM 0 HD12 LEU A 153 6.675 27.918 4.426 1.00 2.13 H new ATOM 0 HD13 LEU A 153 5.989 28.505 2.893 1.00 2.13 H new ATOM 0 HD21 LEU A 153 3.391 26.859 3.107 1.00 42.32 H new ATOM 0 HD22 LEU A 153 4.355 26.970 1.615 1.00 42.32 H new ATOM 0 HD23 LEU A 153 3.975 25.377 2.312 1.00 42.32 H new ATOM 2319 N CYS A 154 9.273 27.135 0.278 1.00 22.54 N ATOM 2320 CA CYS A 154 10.684 26.966 -0.048 1.00 61.42 C ATOM 2321 C CYS A 154 11.478 28.205 0.348 1.00 64.22 C ATOM 2322 O CYS A 154 12.489 28.110 1.045 1.00 65.43 O ATOM 2323 CB CYS A 154 10.855 26.688 -1.543 1.00 71.15 C ATOM 2324 SG CYS A 154 10.292 25.050 -2.061 1.00 10.33 S ATOM 0 H CYS A 154 8.813 27.892 -0.228 1.00 22.54 H new ATOM 0 HA CYS A 154 11.066 26.114 0.515 1.00 61.42 H new ATOM 0 HB2 CYS A 154 10.307 27.443 -2.107 1.00 71.15 H new ATOM 0 HB3 CYS A 154 11.908 26.797 -1.803 1.00 71.15 H new ATOM 0 HG CYS A 154 10.613 24.174 -1.156 1.00 10.33 H new ATOM 2330 N VAL A 155 11.011 29.366 -0.102 1.00 23.04 N ATOM 2331 CA VAL A 155 11.669 30.629 0.208 1.00 44.04 C ATOM 2332 C VAL A 155 11.185 31.175 1.551 1.00 23.14 C ATOM 2333 O VAL A 155 11.876 31.959 2.200 1.00 14.41 O ATOM 2334 CB VAL A 155 11.436 31.675 -0.908 1.00 33.00 C ATOM 2335 CG1 VAL A 155 9.967 32.069 -0.998 1.00 31.42 C ATOM 2336 CG2 VAL A 155 12.312 32.900 -0.693 1.00 51.41 C ATOM 0 H VAL A 155 10.178 29.457 -0.683 1.00 23.04 H new ATOM 0 HA VAL A 155 12.740 30.435 0.272 1.00 44.04 H new ATOM 0 HB VAL A 155 11.717 31.217 -1.857 1.00 33.00 H new ATOM 0 HG11 VAL A 155 9.836 32.805 -1.791 1.00 31.42 H new ATOM 0 HG12 VAL A 155 9.366 31.187 -1.219 1.00 31.42 H new ATOM 0 HG13 VAL A 155 9.646 32.498 -0.048 1.00 31.42 H new ATOM 0 HG21 VAL A 155 12.131 33.621 -1.490 1.00 51.41 H new ATOM 0 HG22 VAL A 155 12.073 33.354 0.269 1.00 51.41 H new ATOM 0 HG23 VAL A 155 13.361 32.604 -0.704 1.00 51.41 H new ATOM 2346 N GLU A 156 10.000 30.733 1.974 1.00 62.51 N ATOM 2347 CA GLU A 156 9.422 31.169 3.243 1.00 15.51 C ATOM 2348 C GLU A 156 10.012 30.378 4.409 1.00 32.42 C ATOM 2349 O GLU A 156 9.600 30.541 5.558 1.00 14.41 O ATOM 2350 CB GLU A 156 7.900 31.005 3.216 1.00 12.22 C ATOM 2351 CG GLU A 156 7.226 31.738 2.066 1.00 20.13 C ATOM 2352 CD GLU A 156 5.714 31.683 2.144 1.00 71.11 C ATOM 2353 OE1 GLU A 156 5.107 32.678 2.595 1.00 11.52 O ATOM 2354 OE2 GLU A 156 5.136 30.647 1.753 1.00 0.55 O1- ATOM 0 H GLU A 156 9.422 30.072 1.455 1.00 62.51 H new ATOM 0 HA GLU A 156 9.664 32.222 3.383 1.00 15.51 H new ATOM 0 HB2 GLU A 156 7.659 29.944 3.150 1.00 12.22 H new ATOM 0 HB3 GLU A 156 7.488 31.368 4.158 1.00 12.22 H new ATOM 0 HG2 GLU A 156 7.548 32.779 2.066 1.00 20.13 H new ATOM 0 HG3 GLU A 156 7.553 31.303 1.122 1.00 20.13 H new ATOM 2361 N SER A 157 10.981 29.522 4.099 1.00 45.42 N ATOM 2362 CA SER A 157 11.638 28.701 5.105 1.00 1.41 C ATOM 2363 C SER A 157 13.003 29.278 5.468 1.00 64.54 C ATOM 2364 O SER A 157 13.263 29.592 6.628 1.00 24.21 O ATOM 2365 CB SER A 157 11.805 27.271 4.587 1.00 1.31 C ATOM 2366 OG SER A 157 10.575 26.751 4.119 1.00 12.43 O ATOM 0 H SER A 157 11.329 29.380 3.151 1.00 45.42 H new ATOM 0 HA SER A 157 11.014 28.692 5.999 1.00 1.41 H new ATOM 0 HB2 SER A 157 12.539 27.256 3.782 1.00 1.31 H new ATOM 0 HB3 SER A 157 12.192 26.636 5.383 1.00 1.31 H new ATOM 0 HG SER A 157 10.696 26.387 3.217 1.00 12.43 H new ATOM 2372 N VAL A 158 13.863 29.422 4.460 1.00 63.31 N ATOM 2373 CA VAL A 158 15.214 29.950 4.655 1.00 40.11 C ATOM 2374 C VAL A 158 15.201 31.438 5.037 1.00 3.02 C ATOM 2375 O VAL A 158 16.132 31.930 5.678 1.00 52.11 O ATOM 2376 CB VAL A 158 16.073 29.734 3.384 1.00 34.21 C ATOM 2377 CG1 VAL A 158 15.496 30.492 2.197 1.00 14.34 C ATOM 2378 CG2 VAL A 158 17.522 30.131 3.628 1.00 34.44 C ATOM 0 H VAL A 158 13.646 29.179 3.493 1.00 63.31 H new ATOM 0 HA VAL A 158 15.658 29.399 5.484 1.00 40.11 H new ATOM 0 HB VAL A 158 16.051 28.670 3.146 1.00 34.21 H new ATOM 0 HG11 VAL A 158 16.119 30.322 1.319 1.00 14.34 H new ATOM 0 HG12 VAL A 158 14.484 30.140 1.997 1.00 14.34 H new ATOM 0 HG13 VAL A 158 15.471 31.558 2.423 1.00 14.34 H new ATOM 0 HG21 VAL A 158 18.102 29.969 2.719 1.00 34.44 H new ATOM 0 HG22 VAL A 158 17.569 31.184 3.905 1.00 34.44 H new ATOM 0 HG23 VAL A 158 17.935 29.525 4.434 1.00 34.44 H new ATOM 2388 N ASP A 159 14.135 32.144 4.660 1.00 12.13 N ATOM 2389 CA ASP A 159 14.008 33.567 4.967 1.00 21.34 C ATOM 2390 C ASP A 159 13.707 33.782 6.451 1.00 45.21 C ATOM 2391 O ASP A 159 14.028 34.829 7.015 1.00 12.42 O ATOM 2392 CB ASP A 159 12.903 34.194 4.111 1.00 61.11 C ATOM 2393 CG ASP A 159 12.947 35.710 4.114 1.00 53.33 C ATOM 2394 OD1 ASP A 159 12.072 36.328 4.756 1.00 4.41 O ATOM 2395 OD2 ASP A 159 13.855 36.278 3.473 1.00 41.43 O1- ATOM 0 H ASP A 159 13.348 31.753 4.142 1.00 12.13 H new ATOM 0 HA ASP A 159 14.957 34.051 4.737 1.00 21.34 H new ATOM 0 HB2 ASP A 159 12.995 33.834 3.086 1.00 61.11 H new ATOM 0 HB3 ASP A 159 11.932 33.862 4.479 1.00 61.11 H new ATOM 2400 N LYS A 160 13.097 32.778 7.079 1.00 11.13 N ATOM 2401 CA LYS A 160 12.752 32.851 8.496 1.00 64.02 C ATOM 2402 C LYS A 160 13.800 32.144 9.355 1.00 30.45 C ATOM 2403 O LYS A 160 13.552 31.849 10.526 1.00 60.11 O ATOM 2404 CB LYS A 160 11.375 32.227 8.734 1.00 1.33 C ATOM 2405 CG LYS A 160 10.259 32.878 7.930 1.00 4.22 C ATOM 2406 CD LYS A 160 9.915 34.263 8.459 1.00 42.21 C ATOM 2407 CE LYS A 160 10.449 35.359 7.550 1.00 13.43 C ATOM 2408 NZ LYS A 160 10.110 36.717 8.057 1.00 74.41 N1+ ATOM 0 H LYS A 160 12.831 31.903 6.627 1.00 11.13 H new ATOM 0 HA LYS A 160 12.727 33.902 8.785 1.00 64.02 H new ATOM 0 HB2 LYS A 160 11.419 31.167 8.485 1.00 1.33 H new ATOM 0 HB3 LYS A 160 11.134 32.296 9.795 1.00 1.33 H new ATOM 0 HG2 LYS A 160 10.560 32.952 6.885 1.00 4.22 H new ATOM 0 HG3 LYS A 160 9.372 32.246 7.962 1.00 4.22 H new ATOM 0 HD2 LYS A 160 8.833 34.360 8.550 1.00 42.21 H new ATOM 0 HD3 LYS A 160 10.331 34.385 9.459 1.00 42.21 H new ATOM 0 HE2 LYS A 160 11.531 35.264 7.464 1.00 13.43 H new ATOM 0 HE3 LYS A 160 10.037 35.232 6.549 1.00 13.43 H new ATOM 0 HZ1 LYS A 160 10.402 37.431 7.359 1.00 74.41 H new ATOM 0 HZ2 LYS A 160 9.084 36.784 8.212 1.00 74.41 H new ATOM 0 HZ3 LYS A 160 10.607 36.886 8.955 1.00 74.41 H new ATOM 2422 N GLU A 161 14.967 31.876 8.755 1.00 71.31 N ATOM 2423 CA GLU A 161 16.080 31.203 9.437 1.00 20.23 C ATOM 2424 C GLU A 161 15.715 29.772 9.841 1.00 72.33 C ATOM 2425 O GLU A 161 16.301 29.209 10.766 1.00 44.00 O ATOM 2426 CB GLU A 161 16.530 32.003 10.665 1.00 1.23 C ATOM 2427 CG GLU A 161 17.138 33.354 10.323 1.00 54.31 C ATOM 2428 CD GLU A 161 17.561 34.132 11.554 1.00 52.11 C ATOM 2429 OE1 GLU A 161 16.734 34.906 12.080 1.00 22.53 O ATOM 2430 OE2 GLU A 161 18.719 33.966 11.992 1.00 51.41 O1- ATOM 0 H GLU A 161 15.166 32.119 7.785 1.00 71.31 H new ATOM 0 HA GLU A 161 16.908 31.149 8.730 1.00 20.23 H new ATOM 0 HB2 GLU A 161 15.674 32.155 11.322 1.00 1.23 H new ATOM 0 HB3 GLU A 161 17.260 31.416 11.223 1.00 1.23 H new ATOM 0 HG2 GLU A 161 18.003 33.206 9.677 1.00 54.31 H new ATOM 0 HG3 GLU A 161 16.414 33.941 9.758 1.00 54.31 H new ATOM 2437 N MET A 162 14.752 29.188 9.132 1.00 44.15 N ATOM 2438 CA MET A 162 14.312 27.826 9.409 1.00 73.01 C ATOM 2439 C MET A 162 14.522 26.934 8.189 1.00 60.45 C ATOM 2440 O MET A 162 13.599 26.705 7.406 1.00 1.01 O ATOM 2441 CB MET A 162 12.835 27.809 9.820 1.00 1.23 C ATOM 2442 CG MET A 162 12.565 28.467 11.165 1.00 15.50 C ATOM 2443 SD MET A 162 10.812 28.497 11.589 1.00 71.12 S ATOM 2444 CE MET A 162 10.457 26.746 11.728 1.00 73.54 C ATOM 0 H MET A 162 14.261 29.639 8.360 1.00 44.15 H new ATOM 0 HA MET A 162 14.911 27.439 10.234 1.00 73.01 H new ATOM 0 HB2 MET A 162 12.248 28.316 9.054 1.00 1.23 H new ATOM 0 HB3 MET A 162 12.489 26.776 9.855 1.00 1.23 H new ATOM 0 HG2 MET A 162 13.113 27.934 11.942 1.00 15.50 H new ATOM 0 HG3 MET A 162 12.948 29.487 11.148 1.00 15.50 H new ATOM 0 HE1 MET A 162 9.521 26.606 12.268 1.00 73.54 H new ATOM 0 HE2 MET A 162 10.369 26.312 10.732 1.00 73.54 H new ATOM 0 HE3 MET A 162 11.265 26.253 12.268 1.00 73.54 H new ATOM 2454 N GLN A 163 15.747 26.434 8.034 1.00 24.22 N ATOM 2455 CA GLN A 163 16.089 25.562 6.911 1.00 61.45 C ATOM 2456 C GLN A 163 15.577 24.142 7.142 1.00 64.20 C ATOM 2457 O GLN A 163 15.750 23.264 6.297 1.00 74.23 O ATOM 2458 CB GLN A 163 17.605 25.539 6.703 1.00 74.13 C ATOM 2459 CG GLN A 163 18.187 26.889 6.316 1.00 15.51 C ATOM 2460 CD GLN A 163 19.699 26.924 6.413 1.00 30.44 C ATOM 2461 OE1 GLN A 163 20.369 25.904 6.250 1.00 62.41 O ATOM 2462 NE2 GLN A 163 20.246 28.104 6.678 1.00 71.13 N ATOM 0 H GLN A 163 16.520 26.618 8.673 1.00 24.22 H new ATOM 0 HA GLN A 163 15.608 25.960 6.017 1.00 61.45 H new ATOM 0 HB2 GLN A 163 18.084 25.196 7.620 1.00 74.13 H new ATOM 0 HB3 GLN A 163 17.846 24.813 5.927 1.00 74.13 H new ATOM 0 HG2 GLN A 163 17.887 27.131 5.296 1.00 15.51 H new ATOM 0 HG3 GLN A 163 17.768 27.660 6.963 1.00 15.51 H new ATOM 0 HE21 GLN A 163 19.653 28.924 6.806 1.00 71.13 H new ATOM 0 HE22 GLN A 163 21.259 28.191 6.754 1.00 71.13 H new ATOM 2471 N VAL A 164 14.948 23.927 8.293 1.00 72.04 N ATOM 2472 CA VAL A 164 14.405 22.623 8.643 1.00 23.43 C ATOM 2473 C VAL A 164 13.027 22.412 8.010 1.00 40.03 C ATOM 2474 O VAL A 164 12.646 21.284 7.708 1.00 42.33 O ATOM 2475 CB VAL A 164 14.313 22.451 10.181 1.00 13.21 C ATOM 2476 CG1 VAL A 164 13.449 23.539 10.807 1.00 10.33 C ATOM 2477 CG2 VAL A 164 13.786 21.070 10.543 1.00 5.43 C ATOM 0 H VAL A 164 14.802 24.645 9.002 1.00 72.04 H new ATOM 0 HA VAL A 164 15.087 21.870 8.249 1.00 23.43 H new ATOM 0 HB VAL A 164 15.320 22.548 10.586 1.00 13.21 H new ATOM 0 HG11 VAL A 164 13.403 23.392 11.886 1.00 10.33 H new ATOM 0 HG12 VAL A 164 13.882 24.516 10.592 1.00 10.33 H new ATOM 0 HG13 VAL A 164 12.443 23.489 10.391 1.00 10.33 H new ATOM 0 HG21 VAL A 164 13.731 20.974 11.627 1.00 5.43 H new ATOM 0 HG22 VAL A 164 12.792 20.936 10.116 1.00 5.43 H new ATOM 0 HG23 VAL A 164 14.457 20.309 10.145 1.00 5.43 H new ATOM 2487 N LEU A 165 12.300 23.508 7.787 1.00 11.00 N ATOM 2488 CA LEU A 165 10.963 23.444 7.198 1.00 54.21 C ATOM 2489 C LEU A 165 11.005 22.977 5.743 1.00 41.30 C ATOM 2490 O LEU A 165 10.181 22.165 5.325 1.00 30.23 O ATOM 2491 CB LEU A 165 10.279 24.811 7.287 1.00 22.24 C ATOM 2492 CG LEU A 165 8.955 24.933 6.525 1.00 24.21 C ATOM 2493 CD1 LEU A 165 7.923 23.955 7.069 1.00 43.24 C ATOM 2494 CD2 LEU A 165 8.434 26.360 6.596 1.00 5.12 C ATOM 0 H LEU A 165 12.616 24.453 8.006 1.00 11.00 H new ATOM 0 HA LEU A 165 10.389 22.713 7.767 1.00 54.21 H new ATOM 0 HB2 LEU A 165 10.097 25.040 8.337 1.00 22.24 H new ATOM 0 HB3 LEU A 165 10.967 25.568 6.910 1.00 22.24 H new ATOM 0 HG LEU A 165 9.137 24.682 5.480 1.00 24.21 H new ATOM 0 HD11 LEU A 165 6.992 24.061 6.512 1.00 43.24 H new ATOM 0 HD12 LEU A 165 8.296 22.936 6.963 1.00 43.24 H new ATOM 0 HD13 LEU A 165 7.741 24.167 8.123 1.00 43.24 H new ATOM 0 HD21 LEU A 165 7.493 26.431 6.050 1.00 5.12 H new ATOM 0 HD22 LEU A 165 8.271 26.637 7.638 1.00 5.12 H new ATOM 0 HD23 LEU A 165 9.164 27.036 6.151 1.00 5.12 H new ATOM 2506 N VAL A 166 11.969 23.486 4.979 1.00 1.44 N ATOM 2507 CA VAL A 166 12.103 23.123 3.569 1.00 34.13 C ATOM 2508 C VAL A 166 12.655 21.699 3.400 1.00 22.41 C ATOM 2509 O VAL A 166 12.585 21.119 2.316 1.00 71.24 O ATOM 2510 CB VAL A 166 13.004 24.137 2.819 1.00 61.42 C ATOM 2511 CG1 VAL A 166 14.465 23.980 3.220 1.00 52.35 C ATOM 2512 CG2 VAL A 166 12.837 24.002 1.311 1.00 62.24 C ATOM 0 H VAL A 166 12.668 24.150 5.311 1.00 1.44 H new ATOM 0 HA VAL A 166 11.104 23.152 3.133 1.00 34.13 H new ATOM 0 HB VAL A 166 12.686 25.139 3.107 1.00 61.42 H new ATOM 0 HG11 VAL A 166 15.071 24.705 2.677 1.00 52.35 H new ATOM 0 HG12 VAL A 166 14.569 24.150 4.292 1.00 52.35 H new ATOM 0 HG13 VAL A 166 14.802 22.972 2.979 1.00 52.35 H new ATOM 0 HG21 VAL A 166 13.480 24.724 0.808 1.00 62.24 H new ATOM 0 HG22 VAL A 166 13.114 22.994 1.003 1.00 62.24 H new ATOM 0 HG23 VAL A 166 11.798 24.191 1.042 1.00 62.24 H new ATOM 2522 N SER A 167 13.180 21.132 4.484 1.00 65.41 N ATOM 2523 CA SER A 167 13.743 19.786 4.445 1.00 54.41 C ATOM 2524 C SER A 167 12.748 18.740 4.947 1.00 30.23 C ATOM 2525 O SER A 167 12.750 17.602 4.478 1.00 51.44 O ATOM 2526 CB SER A 167 15.022 19.727 5.280 1.00 60.24 C ATOM 2527 OG SER A 167 15.973 20.667 4.816 1.00 60.50 O ATOM 0 H SER A 167 13.227 21.583 5.398 1.00 65.41 H new ATOM 0 HA SER A 167 13.974 19.556 3.405 1.00 54.41 H new ATOM 0 HB2 SER A 167 14.788 19.927 6.326 1.00 60.24 H new ATOM 0 HB3 SER A 167 15.445 18.723 5.234 1.00 60.24 H new ATOM 0 HG SER A 167 16.865 20.261 4.825 1.00 60.50 H new ATOM 2533 N ARG A 168 11.897 19.127 5.896 1.00 53.43 N ATOM 2534 CA ARG A 168 10.912 18.204 6.455 1.00 2.12 C ATOM 2535 C ARG A 168 9.620 18.201 5.642 1.00 54.24 C ATOM 2536 O ARG A 168 8.820 17.274 5.752 1.00 40.52 O ATOM 2537 CB ARG A 168 10.614 18.547 7.920 1.00 74.33 C ATOM 2538 CG ARG A 168 9.929 19.889 8.117 1.00 13.34 C ATOM 2539 CD ARG A 168 9.803 20.234 9.592 1.00 12.20 C ATOM 2540 NE ARG A 168 9.340 21.604 9.797 1.00 40.14 N ATOM 2541 CZ ARG A 168 9.463 22.262 10.947 1.00 63.01 C ATOM 2542 NH1 ARG A 168 10.031 21.680 11.995 1.00 32.13 N1+ ATOM 2543 NH2 ARG A 168 9.019 23.505 11.048 1.00 4.11 N ATOM 0 H ARG A 168 11.870 20.067 6.291 1.00 53.43 H new ATOM 0 HA ARG A 168 11.342 17.203 6.408 1.00 2.12 H new ATOM 0 HB2 ARG A 168 9.985 17.765 8.344 1.00 74.33 H new ATOM 0 HB3 ARG A 168 11.549 18.543 8.480 1.00 74.33 H new ATOM 0 HG2 ARG A 168 10.496 20.667 7.606 1.00 13.34 H new ATOM 0 HG3 ARG A 168 8.939 19.865 7.661 1.00 13.34 H new ATOM 0 HD2 ARG A 168 9.108 19.542 10.068 1.00 12.20 H new ATOM 0 HD3 ARG A 168 10.769 20.101 10.079 1.00 12.20 H new ATOM 0 HE ARG A 168 8.897 22.084 9.014 1.00 40.14 H new ATOM 0 HH11 ARG A 168 10.376 20.723 11.922 1.00 32.13 H new ATOM 0 HH12 ARG A 168 10.122 22.189 12.874 1.00 32.13 H new ATOM 0 HH21 ARG A 168 8.583 23.958 10.245 1.00 4.11 H new ATOM 0 HH22 ARG A 168 9.113 24.010 11.929 1.00 4.11 H new ATOM 2557 N ILE A 169 9.422 19.234 4.823 1.00 23.34 N ATOM 2558 CA ILE A 169 8.223 19.324 3.996 1.00 34.51 C ATOM 2559 C ILE A 169 8.313 18.364 2.810 1.00 22.24 C ATOM 2560 O ILE A 169 7.299 17.952 2.251 1.00 44.21 O ATOM 2561 CB ILE A 169 7.973 20.769 3.497 1.00 35.12 C ATOM 2562 CG1 ILE A 169 6.533 20.915 2.993 1.00 13.21 C ATOM 2563 CG2 ILE A 169 8.967 21.154 2.406 1.00 24.50 C ATOM 2564 CD1 ILE A 169 6.145 22.340 2.663 1.00 21.34 C ATOM 0 H ILE A 169 10.072 20.013 4.716 1.00 23.34 H new ATOM 0 HA ILE A 169 7.377 19.038 4.621 1.00 34.51 H new ATOM 0 HB ILE A 169 8.120 21.449 4.336 1.00 35.12 H new ATOM 0 HG12 ILE A 169 6.404 20.298 2.104 1.00 13.21 H new ATOM 0 HG13 ILE A 169 5.851 20.528 3.751 1.00 13.21 H new ATOM 0 HG21 ILE A 169 8.767 22.173 2.075 1.00 24.50 H new ATOM 0 HG22 ILE A 169 9.981 21.093 2.800 1.00 24.50 H new ATOM 0 HG23 ILE A 169 8.863 20.472 1.562 1.00 24.50 H new ATOM 0 HD11 ILE A 169 5.113 22.364 2.313 1.00 21.34 H new ATOM 0 HD12 ILE A 169 6.240 22.959 3.555 1.00 21.34 H new ATOM 0 HD13 ILE A 169 6.802 22.725 1.883 1.00 21.34 H new ATOM 2576 N ALA A 170 9.539 17.998 2.443 1.00 32.15 N ATOM 2577 CA ALA A 170 9.767 17.075 1.340 1.00 73.20 C ATOM 2578 C ALA A 170 9.952 15.652 1.858 1.00 4.01 C ATOM 2579 O ALA A 170 10.328 14.749 1.109 1.00 62.31 O ATOM 2580 CB ALA A 170 10.982 17.507 0.533 1.00 14.01 C ATOM 0 H ALA A 170 10.391 18.329 2.897 1.00 32.15 H new ATOM 0 HA ALA A 170 8.892 17.092 0.691 1.00 73.20 H new ATOM 0 HB1 ALA A 170 11.141 16.808 -0.288 1.00 14.01 H new ATOM 0 HB2 ALA A 170 10.816 18.507 0.132 1.00 14.01 H new ATOM 0 HB3 ALA A 170 11.862 17.516 1.177 1.00 14.01 H new ATOM 2586 N ALA A 171 9.676 15.461 3.146 1.00 0.42 N ATOM 2587 CA ALA A 171 9.819 14.157 3.776 1.00 51.34 C ATOM 2588 C ALA A 171 8.482 13.621 4.279 1.00 22.10 C ATOM 2589 O ALA A 171 8.203 12.430 4.152 1.00 62.35 O ATOM 2590 CB ALA A 171 10.817 14.238 4.921 1.00 4.32 C ATOM 0 H ALA A 171 9.351 16.197 3.773 1.00 0.42 H new ATOM 0 HA ALA A 171 10.189 13.463 3.022 1.00 51.34 H new ATOM 0 HB1 ALA A 171 10.917 13.257 5.386 1.00 4.32 H new ATOM 0 HB2 ALA A 171 11.786 14.558 4.537 1.00 4.32 H new ATOM 0 HB3 ALA A 171 10.464 14.956 5.661 1.00 4.32 H new ATOM 2596 N TRP A 172 7.653 14.501 4.843 1.00 33.33 N ATOM 2597 CA TRP A 172 6.355 14.085 5.372 1.00 74.00 C ATOM 2598 C TRP A 172 5.278 14.033 4.285 1.00 12.01 C ATOM 2599 O TRP A 172 4.165 13.573 4.532 1.00 42.00 O ATOM 2600 CB TRP A 172 5.914 14.990 6.539 1.00 34.11 C ATOM 2601 CG TRP A 172 5.708 16.447 6.200 1.00 62.31 C ATOM 2602 CD1 TRP A 172 5.290 16.980 5.013 1.00 71.03 C ATOM 2603 CD2 TRP A 172 5.892 17.559 7.088 1.00 55.35 C ATOM 2604 NE1 TRP A 172 5.214 18.347 5.105 1.00 0.01 N ATOM 2605 CE2 TRP A 172 5.577 18.727 6.369 1.00 53.41 C ATOM 2606 CE3 TRP A 172 6.296 17.679 8.421 1.00 72.15 C ATOM 2607 CZ2 TRP A 172 5.653 19.996 6.937 1.00 74.34 C ATOM 2608 CZ3 TRP A 172 6.370 18.939 8.984 1.00 52.31 C ATOM 2609 CH2 TRP A 172 6.049 20.083 8.243 1.00 5.14 C ATOM 0 H TRP A 172 7.855 15.496 4.944 1.00 33.33 H new ATOM 0 HA TRP A 172 6.478 13.071 5.753 1.00 74.00 H new ATOM 0 HB2 TRP A 172 4.983 14.596 6.947 1.00 34.11 H new ATOM 0 HB3 TRP A 172 6.662 14.923 7.329 1.00 34.11 H new ATOM 0 HD1 TRP A 172 5.053 16.407 4.129 1.00 71.03 H new ATOM 0 HE1 TRP A 172 4.933 18.977 4.354 1.00 0.01 H new ATOM 0 HE3 TRP A 172 6.546 16.803 9.001 1.00 72.15 H new ATOM 0 HZ2 TRP A 172 5.408 20.880 6.367 1.00 74.34 H new ATOM 0 HZ3 TRP A 172 6.681 19.043 10.013 1.00 52.31 H new ATOM 0 HH2 TRP A 172 6.116 21.053 8.712 1.00 5.14 H new ATOM 2620 N MET A 173 5.615 14.509 3.086 1.00 11.14 N ATOM 2621 CA MET A 173 4.674 14.506 1.969 1.00 24.41 C ATOM 2622 C MET A 173 4.649 13.143 1.290 1.00 12.32 C ATOM 2623 O MET A 173 3.602 12.686 0.829 1.00 15.53 O ATOM 2624 CB MET A 173 5.041 15.590 0.953 1.00 55.20 C ATOM 2625 CG MET A 173 4.435 16.949 1.266 1.00 44.41 C ATOM 2626 SD MET A 173 4.935 18.226 0.095 1.00 75.35 S ATOM 2627 CE MET A 173 4.243 17.594 -1.431 1.00 63.34 C ATOM 0 H MET A 173 6.531 14.900 2.865 1.00 11.14 H new ATOM 0 HA MET A 173 3.680 14.717 2.364 1.00 24.41 H new ATOM 0 HB2 MET A 173 6.126 15.686 0.913 1.00 55.20 H new ATOM 0 HB3 MET A 173 4.712 15.274 -0.037 1.00 55.20 H new ATOM 0 HG2 MET A 173 3.348 16.866 1.263 1.00 44.41 H new ATOM 0 HG3 MET A 173 4.729 17.250 2.272 1.00 44.41 H new ATOM 0 HE1 MET A 173 4.299 18.363 -2.202 1.00 63.34 H new ATOM 0 HE2 MET A 173 4.807 16.718 -1.751 1.00 63.34 H new ATOM 0 HE3 MET A 173 3.201 17.316 -1.271 1.00 63.34 H new ATOM 2637 N ALA A 174 5.811 12.498 1.237 1.00 44.34 N ATOM 2638 CA ALA A 174 5.932 11.182 0.624 1.00 53.00 C ATOM 2639 C ALA A 174 5.498 10.090 1.593 1.00 24.42 C ATOM 2640 O ALA A 174 4.980 9.051 1.182 1.00 44.33 O ATOM 2641 CB ALA A 174 7.360 10.946 0.168 1.00 53.31 C ATOM 0 H ALA A 174 6.684 12.868 1.613 1.00 44.34 H new ATOM 0 HA ALA A 174 5.274 11.147 -0.244 1.00 53.00 H new ATOM 0 HB1 ALA A 174 7.438 9.959 -0.288 1.00 53.31 H new ATOM 0 HB2 ALA A 174 7.639 11.706 -0.561 1.00 53.31 H new ATOM 0 HB3 ALA A 174 8.030 11.003 1.026 1.00 53.31 H new ATOM 2647 N THR A 175 5.718 10.335 2.885 1.00 55.35 N ATOM 2648 CA THR A 175 5.342 9.385 3.924 1.00 0.41 C ATOM 2649 C THR A 175 3.827 9.369 4.107 1.00 52.20 C ATOM 2650 O THR A 175 3.238 8.322 4.369 1.00 40.55 O ATOM 2651 CB THR A 175 6.021 9.725 5.269 1.00 63.53 C ATOM 2652 OG1 THR A 175 7.440 9.802 5.093 1.00 0.43 O ATOM 2653 CG2 THR A 175 5.701 8.679 6.330 1.00 41.12 C ATOM 0 H THR A 175 6.156 11.187 3.234 1.00 55.35 H new ATOM 0 HA THR A 175 5.680 8.399 3.606 1.00 0.41 H new ATOM 0 HB THR A 175 5.636 10.688 5.605 1.00 63.53 H new ATOM 0 HG1 THR A 175 7.682 10.696 4.773 1.00 0.43 H new ATOM 0 HG21 THR A 175 6.193 8.947 7.265 1.00 41.12 H new ATOM 0 HG22 THR A 175 4.623 8.637 6.486 1.00 41.12 H new ATOM 0 HG23 THR A 175 6.057 7.704 5.999 1.00 41.12 H new ATOM 2661 N TYR A 176 3.207 10.539 3.947 1.00 35.14 N ATOM 2662 CA TYR A 176 1.758 10.678 4.081 1.00 72.13 C ATOM 2663 C TYR A 176 1.030 9.859 3.015 1.00 73.55 C ATOM 2664 O TYR A 176 -0.042 9.306 3.266 1.00 41.31 O ATOM 2665 CB TYR A 176 1.362 12.154 3.974 1.00 14.44 C ATOM 2666 CG TYR A 176 -0.107 12.420 4.218 1.00 65.24 C ATOM 2667 CD1 TYR A 176 -0.694 12.122 5.441 1.00 23.40 C ATOM 2668 CD2 TYR A 176 -0.905 12.973 3.224 1.00 52.23 C ATOM 2669 CE1 TYR A 176 -2.035 12.364 5.666 1.00 75.44 C ATOM 2670 CE2 TYR A 176 -2.247 13.219 3.443 1.00 31.02 C ATOM 2671 CZ TYR A 176 -2.806 12.913 4.665 1.00 13.10 C ATOM 2672 OH TYR A 176 -4.142 13.155 4.886 1.00 40.41 O ATOM 0 H TYR A 176 3.690 11.409 3.723 1.00 35.14 H new ATOM 0 HA TYR A 176 1.466 10.299 5.060 1.00 72.13 H new ATOM 0 HB2 TYR A 176 1.948 12.729 4.691 1.00 14.44 H new ATOM 0 HB3 TYR A 176 1.626 12.519 2.981 1.00 14.44 H new ATOM 0 HD1 TYR A 176 -0.092 11.694 6.229 1.00 23.40 H new ATOM 0 HD2 TYR A 176 -0.470 13.214 2.266 1.00 52.23 H new ATOM 0 HE1 TYR A 176 -2.477 12.124 6.622 1.00 75.44 H new ATOM 0 HE2 TYR A 176 -2.855 13.649 2.661 1.00 31.02 H new ATOM 0 HH TYR A 176 -4.282 14.115 5.027 1.00 40.41 H new ATOM 2682 N LEU A 177 1.627 9.782 1.826 1.00 5.13 N ATOM 2683 CA LEU A 177 1.047 9.025 0.723 1.00 35.34 C ATOM 2684 C LEU A 177 1.226 7.525 0.941 1.00 63.42 C ATOM 2685 O LEU A 177 0.317 6.738 0.682 1.00 33.43 O ATOM 2686 CB LEU A 177 1.692 9.433 -0.605 1.00 70.13 C ATOM 2687 CG LEU A 177 1.505 10.900 -1.004 1.00 13.23 C ATOM 2688 CD1 LEU A 177 2.282 11.208 -2.275 1.00 2.41 C ATOM 2689 CD2 LEU A 177 0.030 11.221 -1.193 1.00 41.03 C ATOM 0 H LEU A 177 2.513 10.236 1.604 1.00 5.13 H new ATOM 0 HA LEU A 177 -0.019 9.250 0.686 1.00 35.34 H new ATOM 0 HB2 LEU A 177 2.760 9.223 -0.550 1.00 70.13 H new ATOM 0 HB3 LEU A 177 1.283 8.804 -1.396 1.00 70.13 H new ATOM 0 HG LEU A 177 1.892 11.526 -0.200 1.00 13.23 H new ATOM 0 HD11 LEU A 177 2.138 12.254 -2.545 1.00 2.41 H new ATOM 0 HD12 LEU A 177 3.342 11.019 -2.108 1.00 2.41 H new ATOM 0 HD13 LEU A 177 1.923 10.572 -3.084 1.00 2.41 H new ATOM 0 HD21 LEU A 177 -0.081 12.268 -1.476 1.00 41.03 H new ATOM 0 HD22 LEU A 177 -0.383 10.587 -1.978 1.00 41.03 H new ATOM 0 HD23 LEU A 177 -0.504 11.039 -0.261 1.00 41.03 H new ATOM 2701 N ASN A 178 2.401 7.143 1.440 1.00 13.43 N ATOM 2702 CA ASN A 178 2.721 5.739 1.689 1.00 60.41 C ATOM 2703 C ASN A 178 1.955 5.185 2.896 1.00 24.14 C ATOM 2704 O ASN A 178 1.866 3.969 3.075 1.00 73.02 O ATOM 2705 CB ASN A 178 4.230 5.580 1.903 1.00 2.51 C ATOM 2706 CG ASN A 178 4.713 4.164 1.648 1.00 24.32 C ATOM 2707 OD1 ASN A 178 4.807 3.351 2.568 1.00 42.42 O ATOM 2708 ND2 ASN A 178 5.024 3.863 0.392 1.00 0.14 N ATOM 0 H ASN A 178 3.151 7.791 1.681 1.00 13.43 H new ATOM 0 HA ASN A 178 2.413 5.166 0.814 1.00 60.41 H new ATOM 0 HB2 ASN A 178 4.761 6.265 1.241 1.00 2.51 H new ATOM 0 HB3 ASN A 178 4.480 5.866 2.925 1.00 2.51 H new ATOM 0 HD21 ASN A 178 5.356 2.927 0.159 1.00 0.14 H new ATOM 0 HD22 ASN A 178 4.931 4.568 -0.339 1.00 0.14 H new ATOM 2715 N ASP A 179 1.398 6.077 3.716 1.00 25.03 N ATOM 2716 CA ASP A 179 0.644 5.665 4.898 1.00 73.14 C ATOM 2717 C ASP A 179 -0.698 5.045 4.516 1.00 61.13 C ATOM 2718 O ASP A 179 -0.924 3.855 4.737 1.00 73.23 O ATOM 2719 CB ASP A 179 0.412 6.854 5.835 1.00 71.40 C ATOM 2720 CG ASP A 179 1.611 7.151 6.714 1.00 53.21 C ATOM 2721 OD1 ASP A 179 1.870 8.344 6.979 1.00 52.15 O ATOM 2722 OD2 ASP A 179 2.290 6.192 7.137 1.00 32.10 O1- ATOM 0 H ASP A 179 1.455 7.087 3.583 1.00 25.03 H new ATOM 0 HA ASP A 179 1.238 4.911 5.415 1.00 73.14 H new ATOM 0 HB2 ASP A 179 0.174 7.737 5.242 1.00 71.40 H new ATOM 0 HB3 ASP A 179 -0.454 6.651 6.465 1.00 71.40 H new ATOM 2727 N HIS A 180 -1.584 5.857 3.942 1.00 63.24 N ATOM 2728 CA HIS A 180 -2.909 5.384 3.545 1.00 62.21 C ATOM 2729 C HIS A 180 -3.499 6.241 2.423 1.00 61.34 C ATOM 2730 O HIS A 180 -4.698 6.174 2.147 1.00 34.15 O ATOM 2731 CB HIS A 180 -3.854 5.376 4.757 1.00 1.12 C ATOM 2732 CG HIS A 180 -3.963 6.699 5.462 1.00 33.40 C ATOM 2733 ND1 HIS A 180 -3.085 7.103 6.447 1.00 4.30 N ATOM 2734 CD2 HIS A 180 -4.853 7.710 5.319 1.00 52.43 C ATOM 2735 CE1 HIS A 180 -3.430 8.303 6.877 1.00 11.21 C ATOM 2736 NE2 HIS A 180 -4.499 8.693 6.209 1.00 50.12 N ATOM 0 H HIS A 180 -1.410 6.842 3.742 1.00 63.24 H new ATOM 0 HA HIS A 180 -2.800 4.368 3.167 1.00 62.21 H new ATOM 0 HB2 HIS A 180 -4.847 5.070 4.427 1.00 1.12 H new ATOM 0 HB3 HIS A 180 -3.509 4.625 5.468 1.00 1.12 H new ATOM 0 HD2 HIS A 180 -5.686 7.737 4.632 1.00 52.43 H new ATOM 0 HE1 HIS A 180 -2.923 8.869 7.645 1.00 11.21 H new ATOM 0 HE2 HIS A 180 -4.984 9.582 6.334 1.00 50.12 H new ATOM 2745 N LEU A 181 -2.654 7.036 1.773 1.00 53.34 N ATOM 2746 CA LEU A 181 -3.109 7.904 0.691 1.00 23.13 C ATOM 2747 C LEU A 181 -2.731 7.346 -0.682 1.00 50.43 C ATOM 2748 O LEU A 181 -2.331 8.092 -1.578 1.00 72.33 O ATOM 2749 CB LEU A 181 -2.534 9.313 0.866 1.00 73.23 C ATOM 2750 CG LEU A 181 -3.558 10.403 1.197 1.00 43.11 C ATOM 2751 CD1 LEU A 181 -4.593 10.526 0.089 1.00 20.25 C ATOM 2752 CD2 LEU A 181 -4.234 10.117 2.530 1.00 55.23 C ATOM 0 H LEU A 181 -1.656 7.097 1.975 1.00 53.34 H new ATOM 0 HA LEU A 181 -4.197 7.950 0.740 1.00 23.13 H new ATOM 0 HB2 LEU A 181 -1.787 9.287 1.660 1.00 73.23 H new ATOM 0 HB3 LEU A 181 -2.015 9.592 -0.051 1.00 73.23 H new ATOM 0 HG LEU A 181 -3.029 11.353 1.276 1.00 43.11 H new ATOM 0 HD11 LEU A 181 -5.310 11.306 0.346 1.00 20.25 H new ATOM 0 HD12 LEU A 181 -4.096 10.784 -0.846 1.00 20.25 H new ATOM 0 HD13 LEU A 181 -5.116 9.577 -0.027 1.00 20.25 H new ATOM 0 HD21 LEU A 181 -4.958 10.903 2.747 1.00 55.23 H new ATOM 0 HD22 LEU A 181 -4.746 9.156 2.480 1.00 55.23 H new ATOM 0 HD23 LEU A 181 -3.483 10.087 3.320 1.00 55.23 H new ATOM 2764 N GLU A 182 -2.871 6.031 -0.845 1.00 1.44 N ATOM 2765 CA GLU A 182 -2.564 5.378 -2.118 1.00 24.31 C ATOM 2766 C GLU A 182 -3.682 4.413 -2.531 1.00 4.44 C ATOM 2767 O GLU A 182 -3.461 3.204 -2.627 1.00 11.01 O ATOM 2768 CB GLU A 182 -1.234 4.621 -2.028 1.00 71.32 C ATOM 2769 CG GLU A 182 -0.008 5.513 -2.139 1.00 74.35 C ATOM 2770 CD GLU A 182 1.290 4.733 -2.063 1.00 10.35 C ATOM 2771 OE1 GLU A 182 1.974 4.616 -3.101 1.00 32.40 O ATOM 2772 OE2 GLU A 182 1.621 4.237 -0.966 1.00 75.54 O1- ATOM 0 H GLU A 182 -3.194 5.398 -0.114 1.00 1.44 H new ATOM 0 HA GLU A 182 -2.482 6.157 -2.876 1.00 24.31 H new ATOM 0 HB2 GLU A 182 -1.196 4.085 -1.080 1.00 71.32 H new ATOM 0 HB3 GLU A 182 -1.199 3.872 -2.819 1.00 71.32 H new ATOM 0 HG2 GLU A 182 -0.045 6.059 -3.082 1.00 74.35 H new ATOM 0 HG3 GLU A 182 -0.029 6.254 -1.340 1.00 74.35 H new ATOM 2779 N PRO A 183 -4.904 4.932 -2.781 1.00 53.10 N ATOM 2780 CA PRO A 183 -6.050 4.116 -3.183 1.00 20.14 C ATOM 2781 C PRO A 183 -6.088 3.855 -4.688 1.00 34.23 C ATOM 2782 O PRO A 183 -6.625 2.844 -5.139 1.00 5.13 O ATOM 2783 CB PRO A 183 -7.261 4.967 -2.762 1.00 72.12 C ATOM 2784 CG PRO A 183 -6.717 6.264 -2.240 1.00 61.43 C ATOM 2785 CD PRO A 183 -5.283 6.345 -2.680 1.00 53.45 C ATOM 0 HA PRO A 183 -6.020 3.128 -2.724 1.00 20.14 H new ATOM 0 HB2 PRO A 183 -7.926 5.139 -3.608 1.00 72.12 H new ATOM 0 HB3 PRO A 183 -7.845 4.456 -1.996 1.00 72.12 H new ATOM 0 HG2 PRO A 183 -7.288 7.107 -2.629 1.00 61.43 H new ATOM 0 HG3 PRO A 183 -6.790 6.304 -1.153 1.00 61.43 H new ATOM 0 HD2 PRO A 183 -5.179 6.862 -3.634 1.00 53.45 H new ATOM 0 HD3 PRO A 183 -4.666 6.880 -1.958 1.00 53.45 H new ATOM 2793 N TRP A 184 -5.516 4.777 -5.456 1.00 1.53 N ATOM 2794 CA TRP A 184 -5.481 4.666 -6.909 1.00 33.41 C ATOM 2795 C TRP A 184 -4.044 4.578 -7.414 1.00 11.53 C ATOM 2796 O TRP A 184 -3.801 4.206 -8.563 1.00 40.15 O ATOM 2797 CB TRP A 184 -6.188 5.869 -7.545 1.00 72.21 C ATOM 2798 CG TRP A 184 -5.725 7.189 -7.000 1.00 2.40 C ATOM 2799 CD1 TRP A 184 -6.231 7.852 -5.918 1.00 43.23 C ATOM 2800 CD2 TRP A 184 -4.664 8.006 -7.509 1.00 32.22 C ATOM 2801 NE1 TRP A 184 -5.547 9.027 -5.722 1.00 51.34 N ATOM 2802 CE2 TRP A 184 -4.582 9.144 -6.687 1.00 11.02 C ATOM 2803 CE3 TRP A 184 -3.775 7.884 -8.580 1.00 24.34 C ATOM 2804 CZ2 TRP A 184 -3.647 10.151 -6.902 1.00 5.52 C ATOM 2805 CZ3 TRP A 184 -2.848 8.885 -8.793 1.00 1.45 C ATOM 2806 CH2 TRP A 184 -2.790 10.005 -7.958 1.00 64.43 C ATOM 0 H TRP A 184 -5.067 5.617 -5.091 1.00 1.53 H new ATOM 0 HA TRP A 184 -6.001 3.752 -7.195 1.00 33.41 H new ATOM 0 HB2 TRP A 184 -6.022 5.851 -8.622 1.00 72.21 H new ATOM 0 HB3 TRP A 184 -7.262 5.775 -7.386 1.00 72.21 H new ATOM 0 HD1 TRP A 184 -7.050 7.503 -5.306 1.00 43.23 H new ATOM 0 HE1 TRP A 184 -5.728 9.702 -4.979 1.00 51.34 H new ATOM 0 HE3 TRP A 184 -3.812 7.022 -9.230 1.00 24.34 H new ATOM 0 HZ2 TRP A 184 -3.599 11.017 -6.258 1.00 5.52 H new ATOM 0 HZ3 TRP A 184 -2.156 8.801 -9.618 1.00 1.45 H new ATOM 0 HH2 TRP A 184 -2.053 10.771 -8.151 1.00 64.43 H new ATOM 2817 N ILE A 185 -3.097 4.926 -6.545 1.00 2.34 N ATOM 2818 CA ILE A 185 -1.682 4.895 -6.896 1.00 1.34 C ATOM 2819 C ILE A 185 -1.168 3.461 -6.984 1.00 24.15 C ATOM 2820 O ILE A 185 -0.689 3.033 -8.033 1.00 41.21 O ATOM 2821 CB ILE A 185 -0.835 5.692 -5.880 1.00 10.52 C ATOM 2822 CG1 ILE A 185 -1.283 7.157 -5.856 1.00 70.51 C ATOM 2823 CG2 ILE A 185 0.646 5.590 -6.224 1.00 44.33 C ATOM 2824 CD1 ILE A 185 -0.620 7.988 -4.778 1.00 3.13 C ATOM 0 H ILE A 185 -3.286 5.233 -5.591 1.00 2.34 H new ATOM 0 HA ILE A 185 -1.583 5.364 -7.875 1.00 1.34 H new ATOM 0 HB ILE A 185 -0.985 5.266 -4.888 1.00 10.52 H new ATOM 0 HG12 ILE A 185 -1.073 7.606 -6.827 1.00 70.51 H new ATOM 0 HG13 ILE A 185 -2.363 7.193 -5.715 1.00 70.51 H new ATOM 0 HG21 ILE A 185 1.228 6.157 -5.498 1.00 44.33 H new ATOM 0 HG22 ILE A 185 0.954 4.545 -6.199 1.00 44.33 H new ATOM 0 HG23 ILE A 185 0.817 5.995 -7.222 1.00 44.33 H new ATOM 0 HD11 ILE A 185 -0.991 9.012 -4.828 1.00 3.13 H new ATOM 0 HD12 ILE A 185 -0.851 7.566 -3.800 1.00 3.13 H new ATOM 0 HD13 ILE A 185 0.460 7.985 -4.929 1.00 3.13 H new ATOM 2836 N GLN A 186 -1.283 2.719 -5.882 1.00 53.43 N ATOM 2837 CA GLN A 186 -0.830 1.328 -5.841 1.00 34.11 C ATOM 2838 C GLN A 186 -1.781 0.415 -6.612 1.00 73.11 C ATOM 2839 O GLN A 186 -1.432 -0.717 -6.948 1.00 14.34 O ATOM 2840 CB GLN A 186 -0.709 0.847 -4.394 1.00 1.23 C ATOM 2841 CG GLN A 186 0.468 1.450 -3.647 1.00 30.32 C ATOM 2842 CD GLN A 186 0.583 0.933 -2.227 1.00 25.25 C ATOM 2843 OE1 GLN A 186 0.003 1.497 -1.299 1.00 13.33 O ATOM 2844 NE2 GLN A 186 1.337 -0.145 -2.048 1.00 63.31 N ATOM 0 H GLN A 186 -1.685 3.057 -5.008 1.00 53.43 H new ATOM 0 HA GLN A 186 0.150 1.284 -6.316 1.00 34.11 H new ATOM 0 HB2 GLN A 186 -1.629 1.090 -3.862 1.00 1.23 H new ATOM 0 HB3 GLN A 186 -0.614 -0.239 -4.388 1.00 1.23 H new ATOM 0 HG2 GLN A 186 1.389 1.228 -4.187 1.00 30.32 H new ATOM 0 HG3 GLN A 186 0.364 2.535 -3.628 1.00 30.32 H new ATOM 0 HE21 GLN A 186 1.800 -0.581 -2.845 1.00 63.31 H new ATOM 0 HE22 GLN A 186 1.453 -0.537 -1.113 1.00 63.31 H new ATOM 2853 N GLU A 187 -2.981 0.919 -6.888 1.00 43.33 N ATOM 2854 CA GLU A 187 -3.987 0.160 -7.623 1.00 30.12 C ATOM 2855 C GLU A 187 -3.643 0.103 -9.111 1.00 61.14 C ATOM 2856 O GLU A 187 -3.952 -0.876 -9.793 1.00 33.41 O ATOM 2857 CB GLU A 187 -5.365 0.795 -7.425 1.00 71.25 C ATOM 2858 CG GLU A 187 -6.515 -0.050 -7.949 1.00 62.51 C ATOM 2859 CD GLU A 187 -7.858 0.636 -7.795 1.00 70.11 C ATOM 2860 OE1 GLU A 187 -8.510 0.436 -6.749 1.00 35.40 O ATOM 2861 OE2 GLU A 187 -8.256 1.376 -8.719 1.00 42.34 O1- ATOM 0 H GLU A 187 -3.281 1.854 -6.612 1.00 43.33 H new ATOM 0 HA GLU A 187 -4.003 -0.859 -7.237 1.00 30.12 H new ATOM 0 HB2 GLU A 187 -5.519 0.981 -6.362 1.00 71.25 H new ATOM 0 HB3 GLU A 187 -5.383 1.764 -7.924 1.00 71.25 H new ATOM 0 HG2 GLU A 187 -6.345 -0.276 -9.002 1.00 62.51 H new ATOM 0 HG3 GLU A 187 -6.534 -1.001 -7.418 1.00 62.51 H new ATOM 2868 N ASN A 188 -2.995 1.156 -9.605 1.00 64.33 N ATOM 2869 CA ASN A 188 -2.607 1.228 -11.010 1.00 0.22 C ATOM 2870 C ASN A 188 -1.242 0.575 -11.232 1.00 20.40 C ATOM 2871 O ASN A 188 -0.985 0.002 -12.292 1.00 51.34 O ATOM 2872 CB ASN A 188 -2.576 2.686 -11.475 1.00 45.15 C ATOM 2873 CG ASN A 188 -3.005 2.844 -12.922 1.00 2.31 C ATOM 2874 OD1 ASN A 188 -2.043 2.809 -13.835 1.00 43.24 O flip ATOM 2875 ND2 ASN A 188 -4.191 2.997 -13.215 1.00 12.32 N flip ATOM 0 H ASN A 188 -2.728 1.971 -9.052 1.00 64.33 H new ATOM 0 HA ASN A 188 -3.346 0.684 -11.597 1.00 0.22 H new ATOM 0 HB2 ASN A 188 -3.231 3.281 -10.838 1.00 45.15 H new ATOM 0 HB3 ASN A 188 -1.568 3.081 -11.353 1.00 45.15 H new ATOM 0 HD21 ASN A 188 -4.899 3.018 -12.481 1.00 12.32 H new ATOM 0 HD22 ASN A 188 -4.466 3.103 -14.192 1.00 12.32 H new ATOM 2882 N GLY A 189 -0.371 0.667 -10.227 1.00 64.31 N ATOM 2883 CA GLY A 189 0.954 0.076 -10.332 1.00 21.13 C ATOM 2884 C GLY A 189 2.051 0.999 -9.834 1.00 55.40 C ATOM 2885 O GLY A 189 3.131 1.062 -10.422 1.00 3.12 O ATOM 0 H GLY A 189 -0.560 1.140 -9.343 1.00 64.31 H new ATOM 0 HA2 GLY A 189 0.979 -0.852 -9.761 1.00 21.13 H new ATOM 0 HA3 GLY A 189 1.149 -0.185 -11.372 1.00 21.13 H new ATOM 2889 N GLY A 190 1.772 1.715 -8.747 1.00 71.53 N ATOM 2890 CA GLY A 190 2.749 2.631 -8.183 1.00 43.35 C ATOM 2891 C GLY A 190 2.808 3.952 -8.926 1.00 55.20 C ATOM 2892 O GLY A 190 1.802 4.418 -9.462 1.00 70.51 O ATOM 0 H GLY A 190 0.884 1.677 -8.246 1.00 71.53 H new ATOM 0 HA2 GLY A 190 2.505 2.817 -7.137 1.00 43.35 H new ATOM 0 HA3 GLY A 190 3.733 2.163 -8.202 1.00 43.35 H new ATOM 2896 N TRP A 191 3.992 4.557 -8.955 1.00 31.40 N ATOM 2897 CA TRP A 191 4.186 5.831 -9.640 1.00 3.01 C ATOM 2898 C TRP A 191 4.947 5.640 -10.949 1.00 65.13 C ATOM 2899 O TRP A 191 5.046 6.563 -11.758 1.00 43.01 O ATOM 2900 CB TRP A 191 4.937 6.812 -8.738 1.00 35.44 C ATOM 2901 CG TRP A 191 4.035 7.607 -7.844 1.00 11.12 C ATOM 2902 CD1 TRP A 191 3.736 7.346 -6.538 1.00 63.50 C ATOM 2903 CD2 TRP A 191 3.310 8.792 -8.193 1.00 32.32 C ATOM 2904 NE1 TRP A 191 2.873 8.298 -6.052 1.00 10.42 N ATOM 2905 CE2 TRP A 191 2.595 9.195 -7.050 1.00 53.30 C ATOM 2906 CE3 TRP A 191 3.197 9.551 -9.361 1.00 23.32 C ATOM 2907 CZ2 TRP A 191 1.780 10.324 -7.041 1.00 22.20 C ATOM 2908 CZ3 TRP A 191 2.387 10.671 -9.351 1.00 32.41 C ATOM 2909 CH2 TRP A 191 1.688 11.048 -8.198 1.00 4.25 C ATOM 0 H TRP A 191 4.832 4.185 -8.512 1.00 31.40 H new ATOM 0 HA TRP A 191 3.203 6.241 -9.871 1.00 3.01 H new ATOM 0 HB2 TRP A 191 5.649 6.259 -8.125 1.00 35.44 H new ATOM 0 HB3 TRP A 191 5.515 7.496 -9.359 1.00 35.44 H new ATOM 0 HD1 TRP A 191 4.122 6.513 -5.970 1.00 63.50 H new ATOM 0 HE1 TRP A 191 2.500 8.332 -5.103 1.00 10.42 H new ATOM 0 HE3 TRP A 191 3.733 9.268 -10.255 1.00 23.32 H new ATOM 0 HZ2 TRP A 191 1.240 10.617 -6.153 1.00 22.20 H new ATOM 0 HZ3 TRP A 191 2.292 11.265 -10.248 1.00 32.41 H new ATOM 0 HH2 TRP A 191 1.063 11.929 -8.223 1.00 4.25 H new ATOM 2920 N ASP A 192 5.477 4.435 -11.151 1.00 41.32 N ATOM 2921 CA ASP A 192 6.227 4.116 -12.363 1.00 2.15 C ATOM 2922 C ASP A 192 5.291 4.001 -13.565 1.00 61.14 C ATOM 2923 O ASP A 192 5.689 4.256 -14.702 1.00 53.44 O ATOM 2924 CB ASP A 192 7.006 2.812 -12.170 1.00 51.33 C ATOM 2925 CG ASP A 192 7.956 2.524 -13.317 1.00 31.41 C ATOM 2926 OD1 ASP A 192 8.981 3.229 -13.431 1.00 40.54 O ATOM 2927 OD2 ASP A 192 7.676 1.591 -14.099 1.00 63.14 O1- ATOM 0 H ASP A 192 5.400 3.663 -10.489 1.00 41.32 H new ATOM 0 HA ASP A 192 6.932 4.925 -12.556 1.00 2.15 H new ATOM 0 HB2 ASP A 192 7.571 2.865 -11.240 1.00 51.33 H new ATOM 0 HB3 ASP A 192 6.303 1.985 -12.069 1.00 51.33 H new ATOM 2932 N THR A 193 4.042 3.624 -13.299 1.00 42.11 N ATOM 2933 CA THR A 193 3.038 3.480 -14.350 1.00 71.11 C ATOM 2934 C THR A 193 2.494 4.844 -14.781 1.00 34.14 C ATOM 2935 O THR A 193 1.866 4.969 -15.832 1.00 21.35 O ATOM 2936 CB THR A 193 1.870 2.583 -13.885 1.00 72.23 C ATOM 2937 OG1 THR A 193 0.926 2.405 -14.948 1.00 64.13 O ATOM 2938 CG2 THR A 193 1.168 3.183 -12.674 1.00 41.42 C ATOM 0 H THR A 193 3.701 3.412 -12.361 1.00 42.11 H new ATOM 0 HA THR A 193 3.527 3.008 -15.202 1.00 71.11 H new ATOM 0 HB THR A 193 2.284 1.615 -13.603 1.00 72.23 H new ATOM 0 HG1 THR A 193 0.016 2.513 -14.599 1.00 64.13 H new ATOM 0 HG21 THR A 193 0.350 2.531 -12.368 1.00 41.42 H new ATOM 0 HG22 THR A 193 1.879 3.283 -11.854 1.00 41.42 H new ATOM 0 HG23 THR A 193 0.772 4.165 -12.933 1.00 41.42 H new ATOM 2946 N PHE A 194 2.751 5.863 -13.961 1.00 63.35 N ATOM 2947 CA PHE A 194 2.301 7.223 -14.243 1.00 21.42 C ATOM 2948 C PHE A 194 3.154 7.861 -15.341 1.00 74.44 C ATOM 2949 O PHE A 194 2.722 8.796 -16.015 1.00 44.25 O ATOM 2950 CB PHE A 194 2.362 8.062 -12.960 1.00 54.02 C ATOM 2951 CG PHE A 194 1.915 9.488 -13.132 1.00 70.10 C ATOM 2952 CD1 PHE A 194 0.581 9.789 -13.351 1.00 43.25 C ATOM 2953 CD2 PHE A 194 2.832 10.526 -13.068 1.00 14.52 C ATOM 2954 CE1 PHE A 194 0.168 11.099 -13.504 1.00 65.11 C ATOM 2955 CE2 PHE A 194 2.425 11.837 -13.221 1.00 41.11 C ATOM 2956 CZ PHE A 194 1.092 12.124 -13.439 1.00 53.34 C ATOM 0 H PHE A 194 3.273 5.769 -13.090 1.00 63.35 H new ATOM 0 HA PHE A 194 1.271 7.186 -14.598 1.00 21.42 H new ATOM 0 HB2 PHE A 194 1.741 7.588 -12.200 1.00 54.02 H new ATOM 0 HB3 PHE A 194 3.385 8.057 -12.585 1.00 54.02 H new ATOM 0 HD1 PHE A 194 -0.145 8.991 -13.403 1.00 43.25 H new ATOM 0 HD2 PHE A 194 3.876 10.307 -12.897 1.00 14.52 H new ATOM 0 HE1 PHE A 194 -0.875 11.321 -13.674 1.00 65.11 H new ATOM 0 HE2 PHE A 194 3.149 12.637 -13.170 1.00 41.11 H new ATOM 0 HZ PHE A 194 0.772 13.149 -13.559 1.00 53.34 H new ATOM 2966 N VAL A 195 4.366 7.339 -15.519 1.00 52.33 N ATOM 2967 CA VAL A 195 5.286 7.846 -16.534 1.00 53.41 C ATOM 2968 C VAL A 195 4.817 7.465 -17.939 1.00 43.43 C ATOM 2969 O VAL A 195 5.022 8.211 -18.896 1.00 30.33 O ATOM 2970 CB VAL A 195 6.717 7.307 -16.310 1.00 21.41 C ATOM 2971 CG1 VAL A 195 7.717 8.029 -17.203 1.00 2.30 C ATOM 2972 CG2 VAL A 195 7.115 7.435 -14.848 1.00 34.35 C ATOM 0 H VAL A 195 4.735 6.562 -14.971 1.00 52.33 H new ATOM 0 HA VAL A 195 5.298 8.932 -16.443 1.00 53.41 H new ATOM 0 HB VAL A 195 6.726 6.250 -16.578 1.00 21.41 H new ATOM 0 HG11 VAL A 195 8.716 7.631 -17.026 1.00 2.30 H new ATOM 0 HG12 VAL A 195 7.446 7.879 -18.248 1.00 2.30 H new ATOM 0 HG13 VAL A 195 7.705 9.095 -16.975 1.00 2.30 H new ATOM 0 HG21 VAL A 195 8.126 7.050 -14.711 1.00 34.35 H new ATOM 0 HG22 VAL A 195 7.083 8.484 -14.553 1.00 34.35 H new ATOM 0 HG23 VAL A 195 6.422 6.863 -14.231 1.00 34.35 H new ATOM 2982 N GLU A 196 4.178 6.302 -18.052 1.00 14.11 N ATOM 2983 CA GLU A 196 3.679 5.822 -19.338 1.00 4.20 C ATOM 2984 C GLU A 196 2.230 6.252 -19.565 1.00 15.34 C ATOM 2985 O GLU A 196 1.781 6.365 -20.706 1.00 61.15 O ATOM 2986 CB GLU A 196 3.778 4.294 -19.421 1.00 31.43 C ATOM 2987 CG GLU A 196 5.204 3.762 -19.475 1.00 74.41 C ATOM 2988 CD GLU A 196 5.832 3.611 -18.101 1.00 3.32 C ATOM 2989 OE1 GLU A 196 6.783 4.361 -17.798 1.00 41.21 O ATOM 2990 OE2 GLU A 196 5.370 2.743 -17.330 1.00 23.14 O1- ATOM 0 H GLU A 196 3.994 5.675 -17.269 1.00 14.11 H new ATOM 0 HA GLU A 196 4.301 6.265 -20.116 1.00 4.20 H new ATOM 0 HB2 GLU A 196 3.273 3.861 -18.557 1.00 31.43 H new ATOM 0 HB3 GLU A 196 3.242 3.954 -20.307 1.00 31.43 H new ATOM 0 HG2 GLU A 196 5.207 2.795 -19.978 1.00 74.41 H new ATOM 0 HG3 GLU A 196 5.815 4.436 -20.076 1.00 74.41 H new ATOM 2997 N LEU A 197 1.506 6.490 -18.473 1.00 55.40 N ATOM 2998 CA LEU A 197 0.106 6.902 -18.551 1.00 12.03 C ATOM 2999 C LEU A 197 -0.018 8.373 -18.942 1.00 31.24 C ATOM 3000 O LEU A 197 -0.798 8.724 -19.827 1.00 54.02 O ATOM 3001 CB LEU A 197 -0.592 6.657 -17.209 1.00 14.21 C ATOM 3002 CG LEU A 197 -2.097 6.937 -17.191 1.00 25.45 C ATOM 3003 CD1 LEU A 197 -2.840 5.948 -18.078 1.00 53.33 C ATOM 3004 CD2 LEU A 197 -2.631 6.882 -15.768 1.00 52.21 C ATOM 0 H LEU A 197 1.866 6.404 -17.523 1.00 55.40 H new ATOM 0 HA LEU A 197 -0.377 6.304 -19.323 1.00 12.03 H new ATOM 0 HB2 LEU A 197 -0.429 5.619 -16.918 1.00 14.21 H new ATOM 0 HB3 LEU A 197 -0.115 7.279 -16.452 1.00 14.21 H new ATOM 0 HG LEU A 197 -2.263 7.940 -17.585 1.00 25.45 H new ATOM 0 HD11 LEU A 197 -3.908 6.165 -18.050 1.00 53.33 H new ATOM 0 HD12 LEU A 197 -2.478 6.035 -19.103 1.00 53.33 H new ATOM 0 HD13 LEU A 197 -2.667 4.934 -17.717 1.00 53.33 H new ATOM 0 HD21 LEU A 197 -3.702 7.083 -15.773 1.00 52.21 H new ATOM 0 HD22 LEU A 197 -2.450 5.892 -15.349 1.00 52.21 H new ATOM 0 HD23 LEU A 197 -2.124 7.631 -15.160 1.00 52.21 H new ATOM 3016 N TYR A 198 0.757 9.226 -18.278 1.00 22.15 N ATOM 3017 CA TYR A 198 0.733 10.658 -18.555 1.00 72.53 C ATOM 3018 C TYR A 198 1.660 10.997 -19.721 1.00 33.44 C ATOM 3019 O TYR A 198 1.367 11.887 -20.521 1.00 45.13 O ATOM 3020 CB TYR A 198 1.145 11.442 -17.307 1.00 14.44 C ATOM 3021 CG TYR A 198 0.482 12.797 -17.189 1.00 73.14 C ATOM 3022 CD1 TYR A 198 -0.795 12.922 -16.655 1.00 23.14 C ATOM 3023 CD2 TYR A 198 1.133 13.951 -17.605 1.00 61.30 C ATOM 3024 CE1 TYR A 198 -1.403 14.157 -16.541 1.00 24.53 C ATOM 3025 CE2 TYR A 198 0.532 15.190 -17.495 1.00 60.02 C ATOM 3026 CZ TYR A 198 -0.736 15.287 -16.962 1.00 12.25 C ATOM 3027 OH TYR A 198 -1.337 16.519 -16.849 1.00 15.10 O ATOM 0 H TYR A 198 1.409 8.950 -17.544 1.00 22.15 H new ATOM 0 HA TYR A 198 -0.283 10.940 -18.831 1.00 72.53 H new ATOM 0 HB2 TYR A 198 0.904 10.852 -16.423 1.00 14.44 H new ATOM 0 HB3 TYR A 198 2.227 11.577 -17.315 1.00 14.44 H new ATOM 0 HD1 TYR A 198 -1.321 12.039 -16.324 1.00 23.14 H new ATOM 0 HD2 TYR A 198 2.127 13.879 -18.022 1.00 61.30 H new ATOM 0 HE1 TYR A 198 -2.396 14.237 -16.124 1.00 24.53 H new ATOM 0 HE2 TYR A 198 1.052 16.077 -17.824 1.00 60.02 H new ATOM 0 HH TYR A 198 -0.732 17.211 -17.190 1.00 15.10 H new ATOM 3037 N GLY A 199 2.778 10.280 -19.810 1.00 13.15 N ATOM 3038 CA GLY A 199 3.729 10.512 -20.881 1.00 63.12 C ATOM 3039 C GLY A 199 3.705 9.410 -21.922 1.00 2.40 C ATOM 3040 O GLY A 199 4.602 8.567 -21.967 1.00 44.54 O ATOM 0 H GLY A 199 3.041 9.542 -19.157 1.00 13.15 H new ATOM 0 HA2 GLY A 199 3.508 11.466 -21.360 1.00 63.12 H new ATOM 0 HA3 GLY A 199 4.732 10.591 -20.462 1.00 63.12 H new ATOM 3044 N ASN A 200 2.675 9.421 -22.763 1.00 12.22 N ATOM 3045 CA ASN A 200 2.527 8.415 -23.811 1.00 31.11 C ATOM 3046 C ASN A 200 2.783 9.014 -25.193 1.00 31.33 C ATOM 3047 O ASN A 200 2.493 8.388 -26.214 1.00 41.40 O ATOM 3048 CB ASN A 200 1.125 7.797 -23.754 1.00 4.43 C ATOM 3049 CG ASN A 200 0.021 8.840 -23.784 1.00 42.43 C ATOM 3050 OD1 ASN A 200 -0.381 9.365 -22.745 1.00 1.41 O ATOM 3051 ND2 ASN A 200 -0.480 9.141 -24.976 1.00 21.30 N ATOM 0 H ASN A 200 1.929 10.116 -22.739 1.00 12.22 H new ATOM 0 HA ASN A 200 3.269 7.636 -23.639 1.00 31.11 H new ATOM 0 HB2 ASN A 200 0.998 7.116 -24.596 1.00 4.43 H new ATOM 0 HB3 ASN A 200 1.032 7.202 -22.846 1.00 4.43 H new ATOM 0 HD21 ASN A 200 -1.227 9.831 -25.056 1.00 21.30 H new ATOM 0 HD22 ASN A 200 -0.118 8.682 -25.812 1.00 21.30 H new ATOM 3058 N ASN A 201 3.336 10.224 -25.215 1.00 60.41 N ATOM 3059 CA ASN A 201 3.631 10.915 -26.467 1.00 21.42 C ATOM 3060 C ASN A 201 4.821 10.275 -27.178 1.00 33.55 C ATOM 3061 O ASN A 201 4.782 10.044 -28.387 1.00 43.22 O ATOM 3062 CB ASN A 201 3.914 12.394 -26.199 1.00 50.22 C ATOM 3063 CG ASN A 201 2.793 13.071 -25.433 1.00 13.05 C ATOM 3064 OD1 ASN A 201 2.801 13.108 -24.202 1.00 53.41 O ATOM 3065 ND2 ASN A 201 1.819 13.609 -26.158 1.00 4.34 N ATOM 0 H ASN A 201 3.589 10.748 -24.377 1.00 60.41 H new ATOM 0 HA ASN A 201 2.759 10.830 -27.115 1.00 21.42 H new ATOM 0 HB2 ASN A 201 4.842 12.487 -25.635 1.00 50.22 H new ATOM 0 HB3 ASN A 201 4.064 12.909 -27.148 1.00 50.22 H new ATOM 0 HD21 ASN A 201 1.038 14.076 -25.697 1.00 4.34 H new ATOM 0 HD22 ASN A 201 1.852 13.556 -27.176 1.00 4.34 H new ATOM 3072 N ALA A 202 5.874 9.985 -26.417 1.00 2.13 N ATOM 3073 CA ALA A 202 7.074 9.367 -26.972 1.00 20.24 C ATOM 3074 C ALA A 202 6.997 7.844 -26.900 1.00 63.21 C ATOM 3075 O ALA A 202 7.845 7.144 -27.457 1.00 33.22 O ATOM 3076 CB ALA A 202 8.311 9.870 -26.245 1.00 72.15 C ATOM 0 H ALA A 202 5.920 10.168 -25.415 1.00 2.13 H new ATOM 0 HA ALA A 202 7.143 9.649 -28.023 1.00 20.24 H new ATOM 0 HB1 ALA A 202 9.199 9.401 -26.669 1.00 72.15 H new ATOM 0 HB2 ALA A 202 8.384 10.952 -26.357 1.00 72.15 H new ATOM 0 HB3 ALA A 202 8.239 9.619 -25.187 1.00 72.15 H new ATOM 3082 N ALA A 203 5.974 7.336 -26.214 1.00 51.11 N ATOM 3083 CA ALA A 203 5.783 5.896 -26.071 1.00 63.14 C ATOM 3084 C ALA A 203 4.989 5.324 -27.245 1.00 5.14 C ATOM 3085 O ALA A 203 4.787 4.113 -27.339 1.00 43.34 O ATOM 3086 CB ALA A 203 5.082 5.585 -24.757 1.00 2.14 C ATOM 0 H ALA A 203 5.265 7.902 -25.749 1.00 51.11 H new ATOM 0 HA ALA A 203 6.766 5.424 -26.068 1.00 63.14 H new ATOM 0 HB1 ALA A 203 4.946 4.508 -24.663 1.00 2.14 H new ATOM 0 HB2 ALA A 203 5.688 5.948 -23.927 1.00 2.14 H new ATOM 0 HB3 ALA A 203 4.109 6.077 -24.738 1.00 2.14 H new