USER MOD reduce.3.24.130724 H: found=0, std=0, add=1348, rem=0, adj=42 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 188 ASN : amide:sc= -0.101 K(o=-0.027,f=-1.4!) USER MOD Set 1.2: A 193 THR OG1 : rot -31:sc= 0.0733 USER MOD Set 2.1: A 176 TYR OH : rot 180:sc= 0 USER MOD Set 2.2: A 180 HIS : no HE2:sc= 0.505 K(o=0.51,f=-1.7!) USER MOD Set 3.1: A 55 ASN : amide:sc= 0 X(o=-0.049,f=-0.049) USER MOD Set 3.2: A 112 THR OG1 : rot -140:sc= -0.0489 USER MOD Set 4.1: A 25 TYR OH : rot 30:sc= 0.202 USER MOD Set 4.2: A 57 ASN : amide:sc= -0.375 K(o=0.046,f=-0.69) USER MOD Set 4.3: A 59 SER OG : rot -166:sc= 0.22 USER MOD Set 5.1: A 5 SER OG : rot 180:sc= 0 USER MOD Set 5.2: A 178 ASN : amide:sc= -0.93 K(o=-0.93,f=-2!) USER MOD Set 6.1: A 4 MET CE :methyl -161:sc= 0 (180deg=0) USER MOD Set 6.2: A 186 GLN : amide:sc= -0.0383 K(o=-0.038,f=-1.2!) USER MOD Single : A 3 SER OG : rot -30:sc= 0.0535 USER MOD Single : A 6 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 7 SER OG : rot 96:sc= 0.757 USER MOD Single : A 8 ASN : amide:sc= -0.869 K(o=-0.87,f=-0.16) USER MOD Single : A 17 SER OG : rot 71:sc= 0.22 USER MOD Single : A 18 TYR OH : rot -151:sc= 0.222 USER MOD Single : A 19 LYS NZ :NH3+ 171:sc= -0.0525 (180deg=-0.181) USER MOD Single : A 21 SER OG : rot 180:sc= 0 USER MOD Single : A 22 GLN : amide:sc= -0.469 X(o=-0.47,f=-0.52) USER MOD Single : A 23 LYS NZ :NH3+ -149:sc= -0.181 (180deg=-0.862) USER MOD Single : A 26 SER OG : rot 36:sc= 0.0357 USER MOD Single : A 28 SER OG : rot 180:sc= 0 USER MOD Single : A 29 GLN : amide:sc= -0.0877 X(o=-0.088,f=-0.046) USER MOD Single : A 31 SER OG : rot 29:sc= 0.355 USER MOD Single : A 52 SER OG : rot 34:sc= 0.055 USER MOD Single : A 61 HIS : no HD1:sc=-0.000633 K(o=-0.00063,f=-1.6!) USER MOD Single : A 69 ASN : amide:sc= -0.184 X(o=-0.18,f=-0.45) USER MOD Single : A 72 THR OG1 : rot -17:sc= 0.177 USER MOD Single : A 74 HIS : no HE2:sc= -0.344 K(o=-0.34,f=-2!) USER MOD Single : A 75 SER OG : rot -170:sc= -0.0277 USER MOD Single : A 76 SER OG : rot 180:sc= 0 USER MOD Single : A 77 SER OG : rot -81:sc= 0.236 USER MOD Single : A 86 MET CE :methyl 162:sc= -0.0719 (180deg=-0.438) USER MOD Single : A 90 LYS NZ :NH3+ 178:sc= 0.104 (180deg=0.103) USER MOD Single : A 91 GLN : amide:sc= -0.14 K(o=-0.14,f=-1.1) USER MOD Single : A 104 TYR OH : rot -164:sc= 0.855 USER MOD Single : A 109 SER OG : rot 180:sc= 0 USER MOD Single : A 113 SER OG : rot 180:sc= 0 USER MOD Single : A 114 GLN : amide:sc= -0.0448 K(o=-0.045,f=-0.71) USER MOD Single : A 116 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 118 THR OG1 : rot 180:sc= -1.04 USER MOD Single : A 121 THR OG1 : rot 180:sc= 0 USER MOD Single : A 123 TYR OH : rot 7:sc= 0.311 USER MOD Single : A 124 GLN : amide:sc= -0.143 K(o=-0.14,f=-0.82) USER MOD Single : A 125 SER OG : rot 180:sc= 0 USER MOD Single : A 128 GLN : amide:sc= -0.987 K(o=-0.99,f=0) USER MOD Single : A 131 ASN : amide:sc= -0.014 K(o=-0.014,f=-0.98) USER MOD Single : A 139 ASN : amide:sc= -1.94! K(o=-1.9!,f=0) USER MOD Single : A 148 SER OG : rot 83:sc= 0.595 USER MOD Single : A 154 CYS SG : rot -99:sc= 0.31 USER MOD Single : A 157 SER OG : rot 180:sc= 0 USER MOD Single : A 160 LYS NZ :NH3+ 162:sc= -0.0744 (180deg=-0.391) USER MOD Single : A 162 MET CE :methyl 145:sc= -0.211 (180deg=-2.9) USER MOD Single : A 163 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 167 SER OG : rot -10:sc= 0.286 USER MOD Single : A 173 MET CE :methyl -178:sc= -1.38 (180deg=-1.39) USER MOD Single : A 175 THR OG1 : rot 180:sc= 0 USER MOD Single : A 198 TYR OH : rot 180:sc= 0 USER MOD Single : A 200 ASN : amide:sc= -0.136 K(o=-0.14,f=-0.7) USER MOD Single : A 201 ASN : amide:sc= 0 X(o=0,f=0) USER MOD ----------------------------------------------------------------- ATOM 28 N SER A 3 9.852 -0.626 -4.018 1.00 23.33 N ATOM 29 CA SER A 3 8.752 -0.134 -3.193 1.00 0.01 C ATOM 30 C SER A 3 8.433 1.324 -3.514 1.00 40.33 C ATOM 31 O SER A 3 9.325 2.111 -3.832 1.00 33.42 O ATOM 32 CB SER A 3 9.094 -0.278 -1.708 1.00 73.53 C ATOM 33 OG SER A 3 10.257 0.462 -1.375 1.00 1.42 O ATOM 0 HA SER A 3 7.871 -0.735 -3.417 1.00 0.01 H new ATOM 0 HB2 SER A 3 8.255 0.067 -1.104 1.00 73.53 H new ATOM 0 HB3 SER A 3 9.248 -1.330 -1.468 1.00 73.53 H new ATOM 0 HG SER A 3 10.850 0.507 -2.154 1.00 1.42 H new ATOM 39 N MET A 4 7.152 1.676 -3.420 1.00 62.21 N ATOM 40 CA MET A 4 6.701 3.037 -3.700 1.00 74.22 C ATOM 41 C MET A 4 6.784 3.920 -2.454 1.00 11.02 C ATOM 42 O MET A 4 6.220 5.014 -2.418 1.00 31.10 O ATOM 43 CB MET A 4 5.266 3.027 -4.244 1.00 31.25 C ATOM 44 CG MET A 4 4.296 2.194 -3.418 1.00 12.35 C ATOM 45 SD MET A 4 4.324 0.445 -3.864 1.00 64.11 S ATOM 46 CE MET A 4 3.217 -0.240 -2.636 1.00 33.43 C ATOM 0 H MET A 4 6.406 1.035 -3.151 1.00 62.21 H new ATOM 0 HA MET A 4 7.365 3.456 -4.456 1.00 74.22 H new ATOM 0 HB2 MET A 4 4.899 4.052 -4.291 1.00 31.25 H new ATOM 0 HB3 MET A 4 5.278 2.646 -5.265 1.00 31.25 H new ATOM 0 HG2 MET A 4 4.542 2.299 -2.361 1.00 12.35 H new ATOM 0 HG3 MET A 4 3.286 2.582 -3.550 1.00 12.35 H new ATOM 0 HE1 MET A 4 3.384 -1.314 -2.555 1.00 33.43 H new ATOM 0 HE2 MET A 4 3.407 0.231 -1.672 1.00 33.43 H new ATOM 0 HE3 MET A 4 2.185 -0.054 -2.933 1.00 33.43 H new ATOM 56 N SER A 5 7.498 3.442 -1.438 1.00 24.54 N ATOM 57 CA SER A 5 7.661 4.186 -0.194 1.00 61.33 C ATOM 58 C SER A 5 8.745 5.251 -0.336 1.00 22.21 C ATOM 59 O SER A 5 8.567 6.392 0.092 1.00 11.34 O ATOM 60 CB SER A 5 8.012 3.234 0.951 1.00 54.04 C ATOM 61 OG SER A 5 7.012 2.243 1.115 1.00 75.21 O ATOM 0 H SER A 5 7.974 2.540 -1.453 1.00 24.54 H new ATOM 0 HA SER A 5 6.717 4.682 0.031 1.00 61.33 H new ATOM 0 HB2 SER A 5 8.971 2.757 0.751 1.00 54.04 H new ATOM 0 HB3 SER A 5 8.124 3.799 1.876 1.00 54.04 H new ATOM 0 HG SER A 5 7.260 1.646 1.852 1.00 75.21 H new ATOM 67 N GLN A 6 9.865 4.869 -0.945 1.00 62.15 N ATOM 68 CA GLN A 6 10.981 5.788 -1.148 1.00 41.41 C ATOM 69 C GLN A 6 10.978 6.353 -2.566 1.00 15.43 C ATOM 70 O GLN A 6 11.782 7.226 -2.896 1.00 11.22 O ATOM 71 CB GLN A 6 12.311 5.081 -0.874 1.00 32.02 C ATOM 72 CG GLN A 6 12.496 4.673 0.578 1.00 51.12 C ATOM 73 CD GLN A 6 13.793 3.924 0.813 1.00 63.24 C ATOM 74 OE1 GLN A 6 14.827 4.525 1.104 1.00 44.15 O ATOM 75 NE2 GLN A 6 13.745 2.603 0.686 1.00 70.24 N ATOM 0 H GLN A 6 10.023 3.928 -1.307 1.00 62.15 H new ATOM 0 HA GLN A 6 10.864 6.615 -0.448 1.00 41.41 H new ATOM 0 HB2 GLN A 6 12.377 4.193 -1.503 1.00 32.02 H new ATOM 0 HB3 GLN A 6 13.129 5.740 -1.165 1.00 32.02 H new ATOM 0 HG2 GLN A 6 12.476 5.563 1.207 1.00 51.12 H new ATOM 0 HG3 GLN A 6 11.658 4.047 0.885 1.00 51.12 H new ATOM 0 HE21 GLN A 6 12.866 2.146 0.443 1.00 70.24 H new ATOM 0 HE22 GLN A 6 14.587 2.046 0.831 1.00 70.24 H new ATOM 84 N SER A 7 10.070 5.851 -3.401 1.00 42.13 N ATOM 85 CA SER A 7 9.963 6.310 -4.782 1.00 21.20 C ATOM 86 C SER A 7 9.217 7.638 -4.863 1.00 25.20 C ATOM 87 O SER A 7 9.387 8.397 -5.817 1.00 30.31 O ATOM 88 CB SER A 7 9.257 5.262 -5.643 1.00 51.11 C ATOM 89 OG SER A 7 10.059 4.105 -5.800 1.00 53.41 O ATOM 0 H SER A 7 9.399 5.127 -3.144 1.00 42.13 H new ATOM 0 HA SER A 7 10.974 6.459 -5.162 1.00 21.20 H new ATOM 0 HB2 SER A 7 8.307 4.990 -5.183 1.00 51.11 H new ATOM 0 HB3 SER A 7 9.028 5.685 -6.621 1.00 51.11 H new ATOM 0 HG SER A 7 9.794 3.431 -5.140 1.00 53.41 H new ATOM 95 N ASN A 8 8.393 7.913 -3.856 1.00 45.45 N ATOM 96 CA ASN A 8 7.624 9.151 -3.813 1.00 60.14 C ATOM 97 C ASN A 8 8.360 10.222 -3.013 1.00 0.43 C ATOM 98 O ASN A 8 7.926 11.372 -2.957 1.00 73.23 O ATOM 99 CB ASN A 8 6.242 8.901 -3.205 1.00 21.31 C ATOM 100 CG ASN A 8 5.423 7.909 -4.010 1.00 74.31 C ATOM 101 OD1 ASN A 8 4.569 7.209 -3.467 1.00 22.44 O ATOM 102 ND2 ASN A 8 5.678 7.843 -5.311 1.00 14.14 N ATOM 0 H ASN A 8 8.241 7.295 -3.059 1.00 45.45 H new ATOM 0 HA ASN A 8 7.502 9.507 -4.836 1.00 60.14 H new ATOM 0 HB2 ASN A 8 6.358 8.529 -2.187 1.00 21.31 H new ATOM 0 HB3 ASN A 8 5.701 9.845 -3.140 1.00 21.31 H new ATOM 0 HD21 ASN A 8 5.157 7.194 -5.901 1.00 14.14 H new ATOM 0 HD22 ASN A 8 6.395 8.442 -5.721 1.00 14.14 H new ATOM 109 N ARG A 9 9.475 9.833 -2.400 1.00 12.02 N ATOM 110 CA ARG A 9 10.281 10.754 -1.605 1.00 51.05 C ATOM 111 C ARG A 9 11.070 11.698 -2.506 1.00 14.21 C ATOM 112 O ARG A 9 11.185 12.891 -2.224 1.00 25.40 O ATOM 113 CB ARG A 9 11.236 9.970 -0.701 1.00 42.50 C ATOM 114 CG ARG A 9 12.064 10.848 0.222 1.00 31.12 C ATOM 115 CD ARG A 9 13.171 10.055 0.897 1.00 42.03 C ATOM 116 NE ARG A 9 14.008 10.899 1.747 1.00 5.14 N ATOM 117 CZ ARG A 9 15.338 10.933 1.686 1.00 73.34 C ATOM 118 NH1 ARG A 9 15.993 10.174 0.816 1.00 13.23 N1+ ATOM 119 NH2 ARG A 9 16.017 11.730 2.499 1.00 21.22 N ATOM 0 H ARG A 9 9.842 8.882 -2.439 1.00 12.02 H new ATOM 0 HA ARG A 9 9.611 11.350 -0.985 1.00 51.05 H new ATOM 0 HB2 ARG A 9 10.658 9.269 -0.099 1.00 42.50 H new ATOM 0 HB3 ARG A 9 11.907 9.378 -1.323 1.00 42.50 H new ATOM 0 HG2 ARG A 9 12.498 11.669 -0.348 1.00 31.12 H new ATOM 0 HG3 ARG A 9 11.419 11.292 0.980 1.00 31.12 H new ATOM 0 HD2 ARG A 9 12.732 9.258 1.497 1.00 42.03 H new ATOM 0 HD3 ARG A 9 13.790 9.578 0.137 1.00 42.03 H new ATOM 0 HE ARG A 9 13.545 11.499 2.429 1.00 5.14 H new ATOM 0 HH11 ARG A 9 15.478 9.558 0.187 1.00 13.23 H new ATOM 0 HH12 ARG A 9 17.012 10.207 0.776 1.00 13.23 H new ATOM 0 HH21 ARG A 9 15.521 12.316 3.170 1.00 21.22 H new ATOM 0 HH22 ARG A 9 17.036 11.757 2.453 1.00 21.22 H new ATOM 133 N GLU A 10 11.602 11.152 -3.598 1.00 63.25 N ATOM 134 CA GLU A 10 12.382 11.934 -4.550 1.00 11.22 C ATOM 135 C GLU A 10 11.483 12.869 -5.355 1.00 31.42 C ATOM 136 O GLU A 10 11.913 13.942 -5.772 1.00 63.04 O ATOM 137 CB GLU A 10 13.147 11.002 -5.493 1.00 15.12 C ATOM 138 CG GLU A 10 14.196 11.707 -6.338 1.00 44.41 C ATOM 139 CD GLU A 10 14.762 10.817 -7.427 1.00 40.11 C ATOM 140 OE1 GLU A 10 15.609 9.955 -7.110 1.00 32.10 O ATOM 141 OE2 GLU A 10 14.359 10.981 -8.598 1.00 2.34 O1- ATOM 0 H GLU A 10 11.505 10.167 -3.844 1.00 63.25 H new ATOM 0 HA GLU A 10 13.094 12.541 -3.991 1.00 11.22 H new ATOM 0 HB2 GLU A 10 13.632 10.223 -4.904 1.00 15.12 H new ATOM 0 HB3 GLU A 10 12.436 10.506 -6.153 1.00 15.12 H new ATOM 0 HG2 GLU A 10 13.755 12.595 -6.792 1.00 44.41 H new ATOM 0 HG3 GLU A 10 15.007 12.048 -5.694 1.00 44.41 H new ATOM 148 N LEU A 11 10.229 12.461 -5.551 1.00 22.23 N ATOM 149 CA LEU A 11 9.265 13.255 -6.315 1.00 41.33 C ATOM 150 C LEU A 11 8.945 14.576 -5.618 1.00 3.53 C ATOM 151 O LEU A 11 8.663 15.579 -6.275 1.00 35.05 O ATOM 152 CB LEU A 11 7.977 12.458 -6.534 1.00 5.34 C ATOM 153 CG LEU A 11 8.161 11.089 -7.195 1.00 65.44 C ATOM 154 CD1 LEU A 11 6.812 10.458 -7.499 1.00 15.33 C ATOM 155 CD2 LEU A 11 8.991 11.213 -8.464 1.00 11.20 C ATOM 0 H LEU A 11 9.856 11.583 -5.190 1.00 22.23 H new ATOM 0 HA LEU A 11 9.718 13.484 -7.279 1.00 41.33 H new ATOM 0 HB2 LEU A 11 7.489 12.315 -5.570 1.00 5.34 H new ATOM 0 HB3 LEU A 11 7.301 13.052 -7.149 1.00 5.34 H new ATOM 0 HG LEU A 11 8.695 10.442 -6.499 1.00 65.44 H new ATOM 0 HD11 LEU A 11 6.963 9.486 -7.968 1.00 15.33 H new ATOM 0 HD12 LEU A 11 6.253 10.331 -6.572 1.00 15.33 H new ATOM 0 HD13 LEU A 11 6.252 11.104 -8.175 1.00 15.33 H new ATOM 0 HD21 LEU A 11 9.110 10.229 -8.918 1.00 11.20 H new ATOM 0 HD22 LEU A 11 8.487 11.878 -9.165 1.00 11.20 H new ATOM 0 HD23 LEU A 11 9.972 11.621 -8.219 1.00 11.20 H new ATOM 167 N VAL A 12 8.989 14.571 -4.288 1.00 22.34 N ATOM 168 CA VAL A 12 8.712 15.772 -3.507 1.00 40.42 C ATOM 169 C VAL A 12 9.903 16.726 -3.542 1.00 65.31 C ATOM 170 O VAL A 12 9.734 17.938 -3.673 1.00 60.14 O ATOM 171 CB VAL A 12 8.375 15.429 -2.038 1.00 23.32 C ATOM 172 CG1 VAL A 12 7.976 16.679 -1.267 1.00 25.03 C ATOM 173 CG2 VAL A 12 7.270 14.386 -1.972 1.00 53.22 C ATOM 0 H VAL A 12 9.214 13.748 -3.729 1.00 22.34 H new ATOM 0 HA VAL A 12 7.846 16.256 -3.959 1.00 40.42 H new ATOM 0 HB VAL A 12 9.269 15.014 -1.573 1.00 23.32 H new ATOM 0 HG11 VAL A 12 7.744 16.412 -0.236 1.00 25.03 H new ATOM 0 HG12 VAL A 12 8.800 17.393 -1.280 1.00 25.03 H new ATOM 0 HG13 VAL A 12 7.099 17.129 -1.732 1.00 25.03 H new ATOM 0 HG21 VAL A 12 7.047 14.158 -0.930 1.00 53.22 H new ATOM 0 HG22 VAL A 12 6.375 14.773 -2.458 1.00 53.22 H new ATOM 0 HG23 VAL A 12 7.595 13.478 -2.481 1.00 53.22 H new ATOM 183 N VAL A 13 11.108 16.166 -3.439 1.00 44.24 N ATOM 184 CA VAL A 13 12.336 16.958 -3.460 1.00 64.33 C ATOM 185 C VAL A 13 12.557 17.602 -4.831 1.00 42.14 C ATOM 186 O VAL A 13 13.039 18.732 -4.924 1.00 23.25 O ATOM 187 CB VAL A 13 13.566 16.095 -3.096 1.00 50.40 C ATOM 188 CG1 VAL A 13 14.824 16.947 -3.013 1.00 71.34 C ATOM 189 CG2 VAL A 13 13.333 15.357 -1.786 1.00 33.23 C ATOM 0 H VAL A 13 11.259 15.162 -3.340 1.00 44.24 H new ATOM 0 HA VAL A 13 12.221 17.744 -2.713 1.00 64.33 H new ATOM 0 HB VAL A 13 13.708 15.359 -3.887 1.00 50.40 H new ATOM 0 HG11 VAL A 13 15.675 16.316 -2.756 1.00 71.34 H new ATOM 0 HG12 VAL A 13 15.005 17.424 -3.976 1.00 71.34 H new ATOM 0 HG13 VAL A 13 14.695 17.712 -2.248 1.00 71.34 H new ATOM 0 HG21 VAL A 13 14.210 14.755 -1.547 1.00 33.23 H new ATOM 0 HG22 VAL A 13 13.159 16.079 -0.988 1.00 33.23 H new ATOM 0 HG23 VAL A 13 12.463 14.708 -1.884 1.00 33.23 H new ATOM 199 N ASP A 14 12.193 16.878 -5.890 1.00 1.42 N ATOM 200 CA ASP A 14 12.343 17.379 -7.254 1.00 43.32 C ATOM 201 C ASP A 14 11.402 18.550 -7.517 1.00 21.21 C ATOM 202 O ASP A 14 11.764 19.493 -8.217 1.00 63.44 O ATOM 203 CB ASP A 14 12.080 16.266 -8.271 1.00 21.13 C ATOM 204 CG ASP A 14 13.200 15.246 -8.323 1.00 4.43 C ATOM 205 OD1 ASP A 14 12.898 14.040 -8.433 1.00 34.52 O ATOM 206 OD2 ASP A 14 14.379 15.653 -8.254 1.00 73.41 O1- ATOM 0 H ASP A 14 11.792 15.942 -5.828 1.00 1.42 H new ATOM 0 HA ASP A 14 13.370 17.727 -7.365 1.00 43.32 H new ATOM 0 HB2 ASP A 14 11.147 15.762 -8.019 1.00 21.13 H new ATOM 0 HB3 ASP A 14 11.948 16.706 -9.259 1.00 21.13 H new ATOM 211 N PHE A 15 10.199 18.484 -6.945 1.00 30.02 N ATOM 212 CA PHE A 15 9.204 19.541 -7.116 1.00 40.51 C ATOM 213 C PHE A 15 9.689 20.851 -6.496 1.00 55.12 C ATOM 214 O PHE A 15 9.419 21.933 -7.019 1.00 23.20 O ATOM 215 CB PHE A 15 7.872 19.124 -6.485 1.00 2.42 C ATOM 216 CG PHE A 15 6.683 19.844 -7.055 1.00 22.33 C ATOM 217 CD1 PHE A 15 5.949 19.282 -8.088 1.00 44.13 C ATOM 218 CD2 PHE A 15 6.300 21.081 -6.562 1.00 51.43 C ATOM 219 CE1 PHE A 15 4.856 19.941 -8.617 1.00 3.55 C ATOM 220 CE2 PHE A 15 5.207 21.744 -7.087 1.00 74.33 C ATOM 221 CZ PHE A 15 4.485 21.173 -8.116 1.00 54.30 C ATOM 0 H PHE A 15 9.891 17.708 -6.359 1.00 30.02 H new ATOM 0 HA PHE A 15 9.057 19.699 -8.184 1.00 40.51 H new ATOM 0 HB2 PHE A 15 7.736 18.051 -6.621 1.00 2.42 H new ATOM 0 HB3 PHE A 15 7.916 19.306 -5.411 1.00 2.42 H new ATOM 0 HD1 PHE A 15 6.235 18.319 -8.484 1.00 44.13 H new ATOM 0 HD2 PHE A 15 6.862 21.532 -5.758 1.00 51.43 H new ATOM 0 HE1 PHE A 15 4.292 19.493 -9.422 1.00 3.55 H new ATOM 0 HE2 PHE A 15 4.918 22.707 -6.693 1.00 74.33 H new ATOM 0 HZ PHE A 15 3.631 21.689 -8.529 1.00 54.30 H new ATOM 231 N LEU A 16 10.411 20.741 -5.380 1.00 64.22 N ATOM 232 CA LEU A 16 10.946 21.911 -4.688 1.00 72.32 C ATOM 233 C LEU A 16 12.084 22.545 -5.483 1.00 33.21 C ATOM 234 O LEU A 16 12.319 23.748 -5.391 1.00 40.03 O ATOM 235 CB LEU A 16 11.449 21.524 -3.293 1.00 4.43 C ATOM 236 CG LEU A 16 10.452 21.733 -2.150 1.00 71.13 C ATOM 237 CD1 LEU A 16 9.377 20.658 -2.164 1.00 3.51 C ATOM 238 CD2 LEU A 16 11.173 21.749 -0.810 1.00 52.20 C ATOM 0 H LEU A 16 10.638 19.851 -4.936 1.00 64.22 H new ATOM 0 HA LEU A 16 10.140 22.638 -4.592 1.00 72.32 H new ATOM 0 HB2 LEU A 16 11.741 20.474 -3.310 1.00 4.43 H new ATOM 0 HB3 LEU A 16 12.348 22.101 -3.077 1.00 4.43 H new ATOM 0 HG LEU A 16 9.968 22.699 -2.295 1.00 71.13 H new ATOM 0 HD11 LEU A 16 8.681 20.829 -1.343 1.00 3.51 H new ATOM 0 HD12 LEU A 16 8.837 20.695 -3.110 1.00 3.51 H new ATOM 0 HD13 LEU A 16 9.841 19.678 -2.049 1.00 3.51 H new ATOM 0 HD21 LEU A 16 10.449 21.899 -0.009 1.00 52.20 H new ATOM 0 HD22 LEU A 16 11.687 20.799 -0.662 1.00 52.20 H new ATOM 0 HD23 LEU A 16 11.900 22.561 -0.798 1.00 52.20 H new ATOM 250 N SER A 17 12.781 21.725 -6.267 1.00 61.33 N ATOM 251 CA SER A 17 13.900 22.198 -7.077 1.00 54.41 C ATOM 252 C SER A 17 13.417 22.917 -8.337 1.00 31.12 C ATOM 253 O SER A 17 14.116 23.779 -8.869 1.00 53.12 O ATOM 254 CB SER A 17 14.803 21.026 -7.462 1.00 53.13 C ATOM 255 OG SER A 17 15.309 20.369 -6.312 1.00 2.41 O ATOM 0 H SER A 17 12.589 20.727 -6.358 1.00 61.33 H new ATOM 0 HA SER A 17 14.465 22.911 -6.478 1.00 54.41 H new ATOM 0 HB2 SER A 17 14.243 20.317 -8.072 1.00 53.13 H new ATOM 0 HB3 SER A 17 15.631 21.387 -8.072 1.00 53.13 H new ATOM 0 HG SER A 17 14.586 19.873 -5.874 1.00 2.41 H new ATOM 261 N TYR A 18 12.224 22.559 -8.811 1.00 32.53 N ATOM 262 CA TYR A 18 11.662 23.180 -10.009 1.00 34.51 C ATOM 263 C TYR A 18 11.011 24.519 -9.675 1.00 33.20 C ATOM 264 O TYR A 18 10.965 25.422 -10.511 1.00 73.25 O ATOM 265 CB TYR A 18 10.638 22.254 -10.672 1.00 41.32 C ATOM 266 CG TYR A 18 11.196 20.912 -11.093 1.00 34.43 C ATOM 267 CD1 TYR A 18 12.480 20.800 -11.614 1.00 24.32 C ATOM 268 CD2 TYR A 18 10.436 19.755 -10.969 1.00 12.13 C ATOM 269 CE1 TYR A 18 12.990 19.574 -11.996 1.00 62.14 C ATOM 270 CE2 TYR A 18 10.940 18.526 -11.348 1.00 51.11 C ATOM 271 CZ TYR A 18 12.216 18.442 -11.861 1.00 0.54 C ATOM 272 OH TYR A 18 12.722 17.221 -12.241 1.00 61.02 O ATOM 0 H TYR A 18 11.631 21.846 -8.386 1.00 32.53 H new ATOM 0 HA TYR A 18 12.481 23.355 -10.707 1.00 34.51 H new ATOM 0 HB2 TYR A 18 9.812 22.090 -9.980 1.00 41.32 H new ATOM 0 HB3 TYR A 18 10.226 22.755 -11.548 1.00 41.32 H new ATOM 0 HD1 TYR A 18 13.089 21.686 -11.722 1.00 24.32 H new ATOM 0 HD2 TYR A 18 9.435 19.818 -10.570 1.00 12.13 H new ATOM 0 HE1 TYR A 18 13.990 19.503 -12.398 1.00 62.14 H new ATOM 0 HE2 TYR A 18 10.337 17.636 -11.243 1.00 51.11 H new ATOM 0 HH TYR A 18 11.988 16.637 -12.525 1.00 61.02 H new ATOM 282 N LYS A 19 10.507 24.641 -8.448 1.00 33.40 N ATOM 283 CA LYS A 19 9.866 25.874 -8.005 1.00 71.20 C ATOM 284 C LYS A 19 10.908 26.915 -7.610 1.00 74.34 C ATOM 285 O LYS A 19 10.698 28.112 -7.791 1.00 53.33 O ATOM 286 CB LYS A 19 8.925 25.604 -6.826 1.00 24.30 C ATOM 287 CG LYS A 19 7.595 24.978 -7.227 1.00 64.24 C ATOM 288 CD LYS A 19 6.522 26.027 -7.497 1.00 35.31 C ATOM 289 CE LYS A 19 6.768 26.780 -8.797 1.00 14.51 C ATOM 290 NZ LYS A 19 5.622 27.660 -9.157 1.00 1.03 N1+ ATOM 0 H LYS A 19 10.531 23.902 -7.746 1.00 33.40 H new ATOM 0 HA LYS A 19 9.281 26.264 -8.838 1.00 71.20 H new ATOM 0 HB2 LYS A 19 9.426 24.945 -6.117 1.00 24.30 H new ATOM 0 HB3 LYS A 19 8.731 26.542 -6.306 1.00 24.30 H new ATOM 0 HG2 LYS A 19 7.737 24.368 -8.119 1.00 64.24 H new ATOM 0 HG3 LYS A 19 7.256 24.310 -6.435 1.00 64.24 H new ATOM 0 HD2 LYS A 19 5.546 25.544 -7.538 1.00 35.31 H new ATOM 0 HD3 LYS A 19 6.492 26.735 -6.669 1.00 35.31 H new ATOM 0 HE2 LYS A 19 7.672 27.382 -8.702 1.00 14.51 H new ATOM 0 HE3 LYS A 19 6.944 26.066 -9.602 1.00 14.51 H new ATOM 0 HZ1 LYS A 19 5.888 28.266 -9.959 1.00 1.03 H new ATOM 0 HZ2 LYS A 19 4.804 27.074 -9.422 1.00 1.03 H new ATOM 0 HZ3 LYS A 19 5.372 28.255 -8.342 1.00 1.03 H new ATOM 304 N LEU A 20 12.035 26.448 -7.079 1.00 51.53 N ATOM 305 CA LEU A 20 13.111 27.341 -6.662 1.00 12.22 C ATOM 306 C LEU A 20 14.039 27.668 -7.830 1.00 64.24 C ATOM 307 O LEU A 20 14.975 28.455 -7.688 1.00 44.31 O ATOM 308 CB LEU A 20 13.906 26.721 -5.513 1.00 74.32 C ATOM 309 CG LEU A 20 13.130 26.561 -4.203 1.00 34.14 C ATOM 310 CD1 LEU A 20 13.990 25.877 -3.157 1.00 64.12 C ATOM 311 CD2 LEU A 20 12.646 27.910 -3.693 1.00 33.14 C ATOM 0 H LEU A 20 12.226 25.458 -6.928 1.00 51.53 H new ATOM 0 HA LEU A 20 12.659 28.271 -6.316 1.00 12.22 H new ATOM 0 HB2 LEU A 20 14.266 25.741 -5.827 1.00 74.32 H new ATOM 0 HB3 LEU A 20 14.785 27.338 -5.324 1.00 74.32 H new ATOM 0 HG LEU A 20 12.258 25.937 -4.398 1.00 34.14 H new ATOM 0 HD11 LEU A 20 13.423 25.771 -2.232 1.00 64.12 H new ATOM 0 HD12 LEU A 20 14.285 24.891 -3.516 1.00 64.12 H new ATOM 0 HD13 LEU A 20 14.881 26.476 -2.970 1.00 64.12 H new ATOM 0 HD21 LEU A 20 12.097 27.771 -2.761 1.00 33.14 H new ATOM 0 HD22 LEU A 20 13.502 28.561 -3.516 1.00 33.14 H new ATOM 0 HD23 LEU A 20 11.991 28.366 -4.435 1.00 33.14 H new ATOM 323 N SER A 21 13.772 27.055 -8.982 1.00 21.30 N ATOM 324 CA SER A 21 14.567 27.293 -10.183 1.00 40.15 C ATOM 325 C SER A 21 14.103 28.571 -10.875 1.00 30.21 C ATOM 326 O SER A 21 14.876 29.235 -11.567 1.00 52.24 O ATOM 327 CB SER A 21 14.452 26.106 -11.143 1.00 61.20 C ATOM 328 OG SER A 21 15.268 26.290 -12.287 1.00 34.20 O ATOM 0 H SER A 21 13.010 26.389 -9.108 1.00 21.30 H new ATOM 0 HA SER A 21 15.611 27.407 -9.891 1.00 40.15 H new ATOM 0 HB2 SER A 21 14.743 25.190 -10.629 1.00 61.20 H new ATOM 0 HB3 SER A 21 13.413 25.983 -11.450 1.00 61.20 H new ATOM 0 HG SER A 21 15.176 25.517 -12.882 1.00 34.20 H new ATOM 334 N GLN A 22 12.831 28.907 -10.673 1.00 15.21 N ATOM 335 CA GLN A 22 12.245 30.105 -11.261 1.00 24.03 C ATOM 336 C GLN A 22 12.286 31.265 -10.263 1.00 23.23 C ATOM 337 O GLN A 22 12.097 32.425 -10.633 1.00 32.33 O ATOM 338 CB GLN A 22 10.803 29.822 -11.695 1.00 43.51 C ATOM 339 CG GLN A 22 10.265 30.791 -12.738 1.00 31.51 C ATOM 340 CD GLN A 22 11.062 30.775 -14.029 1.00 2.13 C ATOM 341 OE1 GLN A 22 10.800 29.970 -14.923 1.00 10.23 O ATOM 342 NE2 GLN A 22 12.034 31.674 -14.140 1.00 21.52 N ATOM 0 H GLN A 22 12.185 28.362 -10.103 1.00 15.21 H new ATOM 0 HA GLN A 22 12.827 30.388 -12.138 1.00 24.03 H new ATOM 0 HB2 GLN A 22 10.747 28.809 -12.093 1.00 43.51 H new ATOM 0 HB3 GLN A 22 10.158 29.855 -10.817 1.00 43.51 H new ATOM 0 HG2 GLN A 22 9.226 30.542 -12.956 1.00 31.51 H new ATOM 0 HG3 GLN A 22 10.271 31.800 -12.326 1.00 31.51 H new ATOM 0 HE21 GLN A 22 12.218 32.323 -13.375 1.00 21.52 H new ATOM 0 HE22 GLN A 22 12.596 31.715 -14.990 1.00 21.52 H new ATOM 351 N LYS A 23 12.539 30.939 -8.995 1.00 42.13 N ATOM 352 CA LYS A 23 12.620 31.945 -7.939 1.00 21.42 C ATOM 353 C LYS A 23 14.042 32.486 -7.819 1.00 52.15 C ATOM 354 O LYS A 23 14.267 33.693 -7.910 1.00 43.43 O ATOM 355 CB LYS A 23 12.178 31.352 -6.596 1.00 14.44 C ATOM 356 CG LYS A 23 10.737 31.669 -6.220 1.00 43.44 C ATOM 357 CD LYS A 23 9.747 31.015 -7.170 1.00 23.41 C ATOM 358 CE LYS A 23 8.314 31.162 -6.679 1.00 34.14 C ATOM 359 NZ LYS A 23 8.068 30.380 -5.436 1.00 24.44 N1+ ATOM 0 H LYS A 23 12.692 29.983 -8.675 1.00 42.13 H new ATOM 0 HA LYS A 23 11.952 32.765 -8.202 1.00 21.42 H new ATOM 0 HB2 LYS A 23 12.304 30.270 -6.630 1.00 14.44 H new ATOM 0 HB3 LYS A 23 12.837 31.725 -5.812 1.00 14.44 H new ATOM 0 HG2 LYS A 23 10.544 31.328 -5.203 1.00 43.44 H new ATOM 0 HG3 LYS A 23 10.589 32.749 -6.228 1.00 43.44 H new ATOM 0 HD2 LYS A 23 9.841 31.464 -8.159 1.00 23.41 H new ATOM 0 HD3 LYS A 23 9.989 29.957 -7.276 1.00 23.41 H new ATOM 0 HE2 LYS A 23 8.100 32.215 -6.493 1.00 34.14 H new ATOM 0 HE3 LYS A 23 7.628 30.830 -7.458 1.00 34.14 H new ATOM 0 HZ1 LYS A 23 7.077 30.064 -5.415 1.00 24.44 H new ATOM 0 HZ2 LYS A 23 8.696 29.551 -5.417 1.00 24.44 H new ATOM 0 HZ3 LYS A 23 8.259 30.978 -4.606 1.00 24.44 H new ATOM 373 N GLY A 24 14.997 31.581 -7.614 1.00 74.33 N ATOM 374 CA GLY A 24 16.388 31.979 -7.489 1.00 61.44 C ATOM 375 C GLY A 24 17.001 31.557 -6.167 1.00 53.43 C ATOM 376 O GLY A 24 17.546 32.386 -5.437 1.00 72.31 O ATOM 0 H GLY A 24 14.831 30.578 -7.532 1.00 74.33 H new ATOM 0 HA2 GLY A 24 16.961 31.542 -8.307 1.00 61.44 H new ATOM 0 HA3 GLY A 24 16.462 33.062 -7.590 1.00 61.44 H new ATOM 380 N TYR A 25 16.909 30.265 -5.858 1.00 2.32 N ATOM 381 CA TYR A 25 17.462 29.729 -4.616 1.00 35.14 C ATOM 382 C TYR A 25 18.257 28.454 -4.878 1.00 43.25 C ATOM 383 O TYR A 25 17.840 27.603 -5.665 1.00 11.33 O ATOM 384 CB TYR A 25 16.345 29.436 -3.610 1.00 14.21 C ATOM 385 CG TYR A 25 15.723 30.670 -2.995 1.00 22.42 C ATOM 386 CD1 TYR A 25 16.388 31.386 -2.008 1.00 51.14 C ATOM 387 CD2 TYR A 25 14.469 31.114 -3.395 1.00 42.50 C ATOM 388 CE1 TYR A 25 15.820 32.509 -1.437 1.00 21.22 C ATOM 389 CE2 TYR A 25 13.896 32.237 -2.830 1.00 54.30 C ATOM 390 CZ TYR A 25 14.575 32.930 -1.851 1.00 2.54 C ATOM 391 OH TYR A 25 14.007 34.046 -1.283 1.00 33.01 O ATOM 0 H TYR A 25 16.456 29.570 -6.451 1.00 2.32 H new ATOM 0 HA TYR A 25 18.131 30.482 -4.200 1.00 35.14 H new ATOM 0 HB2 TYR A 25 15.565 28.860 -4.108 1.00 14.21 H new ATOM 0 HB3 TYR A 25 16.745 28.809 -2.813 1.00 14.21 H new ATOM 0 HD1 TYR A 25 17.364 31.060 -1.682 1.00 51.14 H new ATOM 0 HD2 TYR A 25 13.933 30.572 -4.160 1.00 42.50 H new ATOM 0 HE1 TYR A 25 16.350 33.054 -0.670 1.00 21.22 H new ATOM 0 HE2 TYR A 25 12.921 32.570 -3.154 1.00 54.30 H new ATOM 0 HH TYR A 25 14.713 34.666 -1.004 1.00 33.01 H new ATOM 401 N SER A 26 19.403 28.328 -4.213 1.00 41.43 N ATOM 402 CA SER A 26 20.253 27.153 -4.368 1.00 44.31 C ATOM 403 C SER A 26 19.912 26.100 -3.318 1.00 31.30 C ATOM 404 O SER A 26 19.848 26.396 -2.124 1.00 53.54 O ATOM 405 CB SER A 26 21.731 27.540 -4.266 1.00 52.25 C ATOM 406 OG SER A 26 22.005 28.210 -3.046 1.00 64.20 O ATOM 0 H SER A 26 19.763 29.026 -3.562 1.00 41.43 H new ATOM 0 HA SER A 26 20.071 26.731 -5.356 1.00 44.31 H new ATOM 0 HB2 SER A 26 22.349 26.645 -4.339 1.00 52.25 H new ATOM 0 HB3 SER A 26 22.000 28.182 -5.105 1.00 52.25 H new ATOM 0 HG SER A 26 21.461 27.821 -2.330 1.00 64.20 H new ATOM 412 N TRP A 27 19.693 24.870 -3.772 1.00 61.20 N ATOM 413 CA TRP A 27 19.353 23.771 -2.874 1.00 53.30 C ATOM 414 C TRP A 27 20.488 22.753 -2.795 1.00 22.33 C ATOM 415 O TRP A 27 20.291 21.625 -2.344 1.00 44.40 O ATOM 416 CB TRP A 27 18.063 23.093 -3.342 1.00 4.15 C ATOM 417 CG TRP A 27 17.028 22.968 -2.264 1.00 14.02 C ATOM 418 CD1 TRP A 27 16.329 21.845 -1.927 1.00 22.51 C ATOM 419 CD2 TRP A 27 16.575 24.004 -1.381 1.00 54.12 C ATOM 420 NE1 TRP A 27 15.467 22.119 -0.894 1.00 34.12 N ATOM 421 CE2 TRP A 27 15.600 23.436 -0.540 1.00 11.52 C ATOM 422 CE3 TRP A 27 16.898 25.355 -1.219 1.00 53.32 C ATOM 423 CZ2 TRP A 27 14.947 24.173 0.446 1.00 20.51 C ATOM 424 CZ3 TRP A 27 16.249 26.083 -0.240 1.00 40.24 C ATOM 425 CH2 TRP A 27 15.283 25.491 0.582 1.00 31.43 C ATOM 0 H TRP A 27 19.745 24.609 -4.757 1.00 61.20 H new ATOM 0 HA TRP A 27 19.200 24.181 -1.876 1.00 53.30 H new ATOM 0 HB2 TRP A 27 17.644 23.661 -4.173 1.00 4.15 H new ATOM 0 HB3 TRP A 27 18.301 22.100 -3.723 1.00 4.15 H new ATOM 0 HD1 TRP A 27 16.438 20.882 -2.403 1.00 22.51 H new ATOM 0 HE1 TRP A 27 14.831 21.450 -0.460 1.00 34.12 H new ATOM 0 HE3 TRP A 27 17.642 25.821 -1.848 1.00 53.32 H new ATOM 0 HZ2 TRP A 27 14.201 23.718 1.081 1.00 20.51 H new ATOM 0 HZ3 TRP A 27 16.491 27.127 -0.107 1.00 40.24 H new ATOM 0 HH2 TRP A 27 14.794 26.087 1.338 1.00 31.43 H new ATOM 436 N SER A 28 21.678 23.166 -3.227 1.00 32.31 N ATOM 437 CA SER A 28 22.851 22.297 -3.206 1.00 50.44 C ATOM 438 C SER A 28 23.472 22.254 -1.812 1.00 42.24 C ATOM 439 O SER A 28 24.115 21.273 -1.438 1.00 22.54 O ATOM 440 CB SER A 28 23.889 22.781 -4.221 1.00 22.54 C ATOM 441 OG SER A 28 23.364 22.763 -5.537 1.00 51.11 O ATOM 0 H SER A 28 21.855 24.100 -3.597 1.00 32.31 H new ATOM 0 HA SER A 28 22.530 21.290 -3.474 1.00 50.44 H new ATOM 0 HB2 SER A 28 24.206 23.792 -3.967 1.00 22.54 H new ATOM 0 HB3 SER A 28 24.774 22.147 -4.171 1.00 22.54 H new ATOM 0 HG SER A 28 24.046 23.078 -6.166 1.00 51.11 H new ATOM 447 N GLN A 29 23.271 23.326 -1.049 1.00 65.33 N ATOM 448 CA GLN A 29 23.802 23.418 0.307 1.00 12.55 C ATOM 449 C GLN A 29 22.811 22.849 1.319 1.00 40.41 C ATOM 450 O GLN A 29 23.155 22.623 2.480 1.00 71.43 O ATOM 451 CB GLN A 29 24.120 24.876 0.653 1.00 13.34 C ATOM 452 CG GLN A 29 25.165 25.509 -0.254 1.00 42.43 C ATOM 453 CD GLN A 29 26.530 24.857 -0.124 1.00 1.54 C ATOM 454 OE1 GLN A 29 27.343 25.255 0.710 1.00 23.32 O ATOM 455 NE2 GLN A 29 26.789 23.853 -0.955 1.00 40.23 N ATOM 0 H GLN A 29 22.742 24.145 -1.349 1.00 65.33 H new ATOM 0 HA GLN A 29 24.719 22.831 0.353 1.00 12.55 H new ATOM 0 HB2 GLN A 29 23.202 25.461 0.598 1.00 13.34 H new ATOM 0 HB3 GLN A 29 24.469 24.927 1.684 1.00 13.34 H new ATOM 0 HG2 GLN A 29 24.831 25.439 -1.289 1.00 42.43 H new ATOM 0 HG3 GLN A 29 25.250 26.570 -0.018 1.00 42.43 H new ATOM 0 HE21 GLN A 29 26.085 23.556 -1.631 1.00 40.23 H new ATOM 0 HE22 GLN A 29 27.692 23.379 -0.917 1.00 40.23 H new ATOM 464 N PHE A 30 21.582 22.617 0.867 1.00 24.33 N ATOM 465 CA PHE A 30 20.535 22.077 1.726 1.00 64.10 C ATOM 466 C PHE A 30 20.264 20.606 1.411 1.00 62.41 C ATOM 467 O PHE A 30 19.250 20.049 1.833 1.00 72.45 O ATOM 468 CB PHE A 30 19.252 22.898 1.570 1.00 0.40 C ATOM 469 CG PHE A 30 19.403 24.329 2.003 1.00 73.03 C ATOM 470 CD1 PHE A 30 19.311 24.673 3.341 1.00 30.11 C ATOM 471 CD2 PHE A 30 19.640 25.329 1.073 1.00 11.20 C ATOM 472 CE1 PHE A 30 19.452 25.988 3.745 1.00 23.22 C ATOM 473 CE2 PHE A 30 19.781 26.645 1.470 1.00 74.13 C ATOM 474 CZ PHE A 30 19.687 26.975 2.808 1.00 21.13 C ATOM 0 H PHE A 30 21.287 22.796 -0.093 1.00 24.33 H new ATOM 0 HA PHE A 30 20.877 22.141 2.759 1.00 64.10 H new ATOM 0 HB2 PHE A 30 18.938 22.873 0.526 1.00 0.40 H new ATOM 0 HB3 PHE A 30 18.458 22.432 2.153 1.00 0.40 H new ATOM 0 HD1 PHE A 30 19.127 23.905 4.078 1.00 30.11 H new ATOM 0 HD2 PHE A 30 19.715 25.077 0.026 1.00 11.20 H new ATOM 0 HE1 PHE A 30 19.378 26.243 4.792 1.00 23.22 H new ATOM 0 HE2 PHE A 30 19.964 27.415 0.735 1.00 74.13 H new ATOM 0 HZ PHE A 30 19.797 28.003 3.121 1.00 21.13 H new ATOM 484 N SER A 31 21.181 19.982 0.672 1.00 32.32 N ATOM 485 CA SER A 31 21.049 18.574 0.307 1.00 50.21 C ATOM 486 C SER A 31 21.447 17.674 1.473 1.00 64.30 C ATOM 487 O SER A 31 20.790 16.669 1.748 1.00 12.40 O ATOM 488 CB SER A 31 21.919 18.254 -0.911 1.00 63.34 C ATOM 489 OG SER A 31 21.532 19.024 -2.035 1.00 12.04 O ATOM 0 H SER A 31 22.024 20.431 0.314 1.00 32.32 H new ATOM 0 HA SER A 31 20.004 18.386 0.059 1.00 50.21 H new ATOM 0 HB2 SER A 31 22.965 18.450 -0.675 1.00 63.34 H new ATOM 0 HB3 SER A 31 21.840 17.193 -1.149 1.00 63.34 H new ATOM 0 HG SER A 31 21.150 19.874 -1.733 1.00 12.04 H new ATOM 781 N SER A 52 4.296 36.982 12.582 1.00 74.33 N ATOM 782 CA SER A 52 5.095 38.200 12.673 1.00 61.41 C ATOM 783 C SER A 52 6.287 38.167 11.718 1.00 74.22 C ATOM 784 O SER A 52 6.790 39.215 11.311 1.00 10.31 O ATOM 785 CB SER A 52 5.588 38.400 14.109 1.00 11.53 C ATOM 786 OG SER A 52 4.501 38.512 15.011 1.00 64.53 O ATOM 0 HA SER A 52 4.456 39.035 12.385 1.00 61.41 H new ATOM 0 HB2 SER A 52 6.221 37.561 14.400 1.00 11.53 H new ATOM 0 HB3 SER A 52 6.204 39.298 14.164 1.00 11.53 H new ATOM 0 HG SER A 52 3.763 37.944 14.706 1.00 64.53 H new ATOM 792 N ALA A 53 6.735 36.967 11.358 1.00 12.45 N ATOM 793 CA ALA A 53 7.875 36.824 10.459 1.00 52.14 C ATOM 794 C ALA A 53 7.465 36.240 9.109 1.00 64.14 C ATOM 795 O ALA A 53 7.546 36.920 8.085 1.00 13.30 O ATOM 796 CB ALA A 53 8.948 35.965 11.108 1.00 34.31 C ATOM 0 H ALA A 53 6.329 36.086 11.673 1.00 12.45 H new ATOM 0 HA ALA A 53 8.278 37.819 10.273 1.00 52.14 H new ATOM 0 HB1 ALA A 53 9.794 35.865 10.428 1.00 34.31 H new ATOM 0 HB2 ALA A 53 9.280 36.435 12.034 1.00 34.31 H new ATOM 0 HB3 ALA A 53 8.540 34.978 11.328 1.00 34.31 H new ATOM 802 N ILE A 54 7.030 34.980 9.109 1.00 15.24 N ATOM 803 CA ILE A 54 6.614 34.316 7.875 1.00 4.43 C ATOM 804 C ILE A 54 5.169 34.655 7.516 1.00 50.54 C ATOM 805 O ILE A 54 4.231 33.982 7.946 1.00 64.03 O ATOM 806 CB ILE A 54 6.777 32.781 7.962 1.00 44.13 C ATOM 807 CG1 ILE A 54 6.414 32.274 9.362 1.00 34.42 C ATOM 808 CG2 ILE A 54 8.198 32.380 7.595 1.00 34.42 C ATOM 809 CD1 ILE A 54 6.324 30.767 9.461 1.00 1.41 C ATOM 0 H ILE A 54 6.957 34.401 9.946 1.00 15.24 H new ATOM 0 HA ILE A 54 7.271 34.690 7.089 1.00 4.43 H new ATOM 0 HB ILE A 54 6.093 32.320 7.250 1.00 44.13 H new ATOM 0 HG12 ILE A 54 7.159 32.632 10.072 1.00 34.42 H new ATOM 0 HG13 ILE A 54 5.458 32.706 9.658 1.00 34.42 H new ATOM 0 HG21 ILE A 54 8.299 31.297 7.660 1.00 34.42 H new ATOM 0 HG22 ILE A 54 8.416 32.704 6.577 1.00 34.42 H new ATOM 0 HG23 ILE A 54 8.899 32.852 8.284 1.00 34.42 H new ATOM 0 HD11 ILE A 54 6.063 30.484 10.481 1.00 1.41 H new ATOM 0 HD12 ILE A 54 5.558 30.402 8.776 1.00 1.41 H new ATOM 0 HD13 ILE A 54 7.286 30.327 9.197 1.00 1.41 H new ATOM 821 N ASN A 55 5.002 35.712 6.725 1.00 54.25 N ATOM 822 CA ASN A 55 3.681 36.158 6.298 1.00 44.55 C ATOM 823 C ASN A 55 3.792 37.019 5.041 1.00 53.32 C ATOM 824 O ASN A 55 4.083 38.214 5.118 1.00 32.33 O ATOM 825 CB ASN A 55 2.996 36.945 7.421 1.00 64.24 C ATOM 826 CG ASN A 55 1.494 37.048 7.233 1.00 15.45 C ATOM 827 OD1 ASN A 55 0.740 36.191 7.693 1.00 13.12 O ATOM 828 ND2 ASN A 55 1.052 38.101 6.557 1.00 60.33 N ATOM 0 H ASN A 55 5.771 36.278 6.366 1.00 54.25 H new ATOM 0 HA ASN A 55 3.076 35.281 6.068 1.00 44.55 H new ATOM 0 HB2 ASN A 55 3.206 36.464 8.376 1.00 64.24 H new ATOM 0 HB3 ASN A 55 3.422 37.947 7.468 1.00 64.24 H new ATOM 0 HD21 ASN A 55 0.051 38.224 6.401 1.00 60.33 H new ATOM 0 HD22 ASN A 55 1.713 38.788 6.193 1.00 60.33 H new ATOM 835 N GLY A 56 3.567 36.399 3.884 1.00 51.01 N ATOM 836 CA GLY A 56 3.653 37.116 2.623 1.00 12.02 C ATOM 837 C GLY A 56 5.070 37.160 2.083 1.00 41.15 C ATOM 838 O GLY A 56 5.785 38.144 2.279 1.00 42.41 O ATOM 0 H GLY A 56 3.326 35.412 3.798 1.00 51.01 H new ATOM 0 HA2 GLY A 56 3.002 36.639 1.891 1.00 12.02 H new ATOM 0 HA3 GLY A 56 3.287 38.133 2.760 1.00 12.02 H new ATOM 842 N ASN A 57 5.475 36.092 1.400 1.00 70.35 N ATOM 843 CA ASN A 57 6.818 36.006 0.833 1.00 14.12 C ATOM 844 C ASN A 57 6.907 36.754 -0.497 1.00 12.55 C ATOM 845 O ASN A 57 6.041 36.604 -1.361 1.00 14.35 O ATOM 846 CB ASN A 57 7.217 34.542 0.635 1.00 40.43 C ATOM 847 CG ASN A 57 8.314 34.106 1.587 1.00 71.24 C ATOM 848 OD1 ASN A 57 8.046 33.671 2.706 1.00 25.14 O ATOM 849 ND2 ASN A 57 9.561 34.221 1.143 1.00 1.21 N ATOM 0 H ASN A 57 4.892 35.274 1.226 1.00 70.35 H new ATOM 0 HA ASN A 57 7.508 36.475 1.535 1.00 14.12 H new ATOM 0 HB2 ASN A 57 6.342 33.908 0.779 1.00 40.43 H new ATOM 0 HB3 ASN A 57 7.552 34.396 -0.392 1.00 40.43 H new ATOM 0 HD21 ASN A 57 10.342 33.943 1.738 1.00 1.21 H new ATOM 0 HD22 ASN A 57 9.738 34.587 0.207 1.00 1.21 H new ATOM 856 N PRO A 58 7.963 37.573 -0.673 1.00 4.21 N ATOM 857 CA PRO A 58 8.175 38.347 -1.905 1.00 14.42 C ATOM 858 C PRO A 58 8.632 37.477 -3.078 1.00 2.13 C ATOM 859 O PRO A 58 8.630 37.918 -4.227 1.00 0.21 O ATOM 860 CB PRO A 58 9.274 39.335 -1.512 1.00 72.54 C ATOM 861 CG PRO A 58 10.026 38.664 -0.417 1.00 33.21 C ATOM 862 CD PRO A 58 9.027 37.818 0.324 1.00 42.52 C ATOM 0 HA PRO A 58 7.256 38.820 -2.251 1.00 14.42 H new ATOM 0 HB2 PRO A 58 9.924 39.558 -2.358 1.00 72.54 H new ATOM 0 HB3 PRO A 58 8.851 40.282 -1.177 1.00 72.54 H new ATOM 0 HG2 PRO A 58 10.833 38.051 -0.818 1.00 33.21 H new ATOM 0 HG3 PRO A 58 10.483 39.398 0.247 1.00 33.21 H new ATOM 0 HD2 PRO A 58 9.472 36.886 0.671 1.00 42.52 H new ATOM 0 HD3 PRO A 58 8.640 38.333 1.203 1.00 42.52 H new ATOM 870 N SER A 59 9.029 36.245 -2.777 1.00 22.34 N ATOM 871 CA SER A 59 9.478 35.311 -3.801 1.00 32.21 C ATOM 872 C SER A 59 8.552 34.099 -3.854 1.00 3.10 C ATOM 873 O SER A 59 9.004 32.957 -3.863 1.00 60.44 O ATOM 874 CB SER A 59 10.917 34.870 -3.523 1.00 2.30 C ATOM 875 OG SER A 59 11.040 34.316 -2.223 1.00 74.44 O ATOM 0 H SER A 59 9.049 35.870 -1.829 1.00 22.34 H new ATOM 0 HA SER A 59 9.449 35.813 -4.768 1.00 32.21 H new ATOM 0 HB2 SER A 59 11.225 34.134 -4.266 1.00 2.30 H new ATOM 0 HB3 SER A 59 11.588 35.723 -3.623 1.00 2.30 H new ATOM 0 HG SER A 59 11.988 34.254 -1.982 1.00 74.44 H new ATOM 881 N TRP A 60 7.251 34.360 -3.895 1.00 54.22 N ATOM 882 CA TRP A 60 6.257 33.294 -3.937 1.00 73.23 C ATOM 883 C TRP A 60 5.339 33.454 -5.151 1.00 21.41 C ATOM 884 O TRP A 60 4.369 32.714 -5.312 1.00 4.11 O ATOM 885 CB TRP A 60 5.438 33.310 -2.644 1.00 72.33 C ATOM 886 CG TRP A 60 4.921 31.967 -2.219 1.00 64.10 C ATOM 887 CD1 TRP A 60 5.108 30.767 -2.847 1.00 5.03 C ATOM 888 CD2 TRP A 60 4.129 31.693 -1.060 1.00 71.35 C ATOM 889 NE1 TRP A 60 4.476 29.767 -2.148 1.00 45.43 N ATOM 890 CE2 TRP A 60 3.869 30.311 -1.046 1.00 14.41 C ATOM 891 CE3 TRP A 60 3.614 32.486 -0.031 1.00 2.32 C ATOM 892 CZ2 TRP A 60 3.117 29.706 -0.042 1.00 3.23 C ATOM 893 CZ3 TRP A 60 2.869 31.885 0.963 1.00 0.13 C ATOM 894 CH2 TRP A 60 2.627 30.507 0.952 1.00 54.24 C ATOM 0 H TRP A 60 6.859 35.302 -3.900 1.00 54.22 H new ATOM 0 HA TRP A 60 6.770 32.337 -4.028 1.00 73.23 H new ATOM 0 HB2 TRP A 60 6.055 33.718 -1.843 1.00 72.33 H new ATOM 0 HB3 TRP A 60 4.593 33.987 -2.772 1.00 72.33 H new ATOM 0 HD1 TRP A 60 5.670 30.626 -3.758 1.00 5.03 H new ATOM 0 HE1 TRP A 60 4.461 28.781 -2.407 1.00 45.43 H new ATOM 0 HE3 TRP A 60 3.796 33.550 -0.014 1.00 2.32 H new ATOM 0 HZ2 TRP A 60 2.928 28.643 -0.048 1.00 3.23 H new ATOM 0 HZ3 TRP A 60 2.466 32.488 1.763 1.00 0.13 H new ATOM 0 HH2 TRP A 60 2.041 30.067 1.745 1.00 54.24 H new ATOM 905 N HIS A 61 5.658 34.423 -6.006 1.00 25.52 N ATOM 906 CA HIS A 61 4.861 34.680 -7.203 1.00 54.03 C ATOM 907 C HIS A 61 5.735 34.729 -8.457 1.00 24.45 C ATOM 908 O HIS A 61 5.318 35.241 -9.496 1.00 34.41 O ATOM 909 CB HIS A 61 4.070 35.989 -7.056 1.00 24.23 C ATOM 910 CG HIS A 61 4.880 37.153 -6.563 1.00 61.24 C ATOM 911 ND1 HIS A 61 4.843 37.593 -5.256 1.00 12.42 N ATOM 912 CD2 HIS A 61 5.744 37.973 -7.209 1.00 32.11 C ATOM 913 CE1 HIS A 61 5.645 38.633 -5.120 1.00 74.03 C ATOM 914 NE2 HIS A 61 6.204 38.882 -6.289 1.00 73.22 N ATOM 0 H HIS A 61 6.461 35.042 -5.893 1.00 25.52 H new ATOM 0 HA HIS A 61 4.158 33.854 -7.314 1.00 54.03 H new ATOM 0 HB2 HIS A 61 3.636 36.247 -8.022 1.00 24.23 H new ATOM 0 HB3 HIS A 61 3.241 35.822 -6.369 1.00 24.23 H new ATOM 0 HD2 HIS A 61 6.019 37.921 -8.252 1.00 32.11 H new ATOM 0 HE1 HIS A 61 5.815 39.186 -4.208 1.00 74.03 H new ATOM 0 HE2 HIS A 61 6.871 39.630 -6.479 1.00 73.22 H new ATOM 923 N LEU A 62 6.946 34.188 -8.356 1.00 60.23 N ATOM 924 CA LEU A 62 7.869 34.169 -9.487 1.00 53.32 C ATOM 925 C LEU A 62 7.749 32.859 -10.259 1.00 64.45 C ATOM 926 O LEU A 62 8.480 31.903 -10.000 1.00 4.12 O ATOM 927 CB LEU A 62 9.314 34.367 -9.014 1.00 60.31 C ATOM 928 CG LEU A 62 9.764 35.823 -8.870 1.00 5.22 C ATOM 929 CD1 LEU A 62 9.191 36.443 -7.606 1.00 43.25 C ATOM 930 CD2 LEU A 62 11.283 35.907 -8.866 1.00 53.32 C ATOM 0 H LEU A 62 7.310 33.758 -7.506 1.00 60.23 H new ATOM 0 HA LEU A 62 7.603 34.992 -10.150 1.00 53.32 H new ATOM 0 HB2 LEU A 62 9.435 33.870 -8.051 1.00 60.31 H new ATOM 0 HB3 LEU A 62 9.980 33.866 -9.717 1.00 60.31 H new ATOM 0 HG LEU A 62 9.386 36.386 -9.724 1.00 5.22 H new ATOM 0 HD11 LEU A 62 9.524 37.478 -7.525 1.00 43.25 H new ATOM 0 HD12 LEU A 62 8.102 36.415 -7.648 1.00 43.25 H new ATOM 0 HD13 LEU A 62 9.535 35.882 -6.737 1.00 43.25 H new ATOM 0 HD21 LEU A 62 11.590 36.948 -8.763 1.00 53.32 H new ATOM 0 HD22 LEU A 62 11.677 35.328 -8.031 1.00 53.32 H new ATOM 0 HD23 LEU A 62 11.672 35.505 -9.801 1.00 53.32 H new ATOM 942 N ALA A 63 6.818 32.824 -11.208 1.00 74.21 N ATOM 943 CA ALA A 63 6.598 31.634 -12.017 1.00 61.02 C ATOM 944 C ALA A 63 6.040 31.993 -13.390 1.00 53.04 C ATOM 945 O ALA A 63 6.594 31.603 -14.417 1.00 15.12 O ATOM 946 CB ALA A 63 5.660 30.679 -11.296 1.00 32.44 C ATOM 0 H ALA A 63 6.205 33.607 -11.434 1.00 74.21 H new ATOM 0 HA ALA A 63 7.560 31.143 -12.167 1.00 61.02 H new ATOM 0 HB1 ALA A 63 5.502 29.792 -11.909 1.00 32.44 H new ATOM 0 HB2 ALA A 63 6.100 30.387 -10.343 1.00 32.44 H new ATOM 0 HB3 ALA A 63 4.704 31.172 -11.118 1.00 32.44 H new ATOM 952 N ASP A 64 4.942 32.743 -13.399 1.00 13.50 N ATOM 953 CA ASP A 64 4.300 33.155 -14.643 1.00 61.22 C ATOM 954 C ASP A 64 4.829 34.514 -15.102 1.00 52.13 C ATOM 955 O ASP A 64 4.837 34.818 -16.296 1.00 50.40 O ATOM 956 CB ASP A 64 2.781 33.217 -14.448 1.00 24.33 C ATOM 957 CG ASP A 64 2.019 33.360 -15.751 1.00 12.13 C ATOM 958 OD1 ASP A 64 1.804 34.509 -16.191 1.00 72.03 O ATOM 959 OD2 ASP A 64 1.630 32.323 -16.327 1.00 51.52 O1- ATOM 0 H ASP A 64 4.477 33.079 -12.556 1.00 13.50 H new ATOM 0 HA ASP A 64 4.533 32.421 -15.414 1.00 61.22 H new ATOM 0 HB2 ASP A 64 2.449 32.313 -13.937 1.00 24.33 H new ATOM 0 HB3 ASP A 64 2.538 34.058 -13.798 1.00 24.33 H new ATOM 964 N GLU A 65 5.279 35.323 -14.144 1.00 54.02 N ATOM 965 CA GLU A 65 5.803 36.654 -14.442 1.00 23.21 C ATOM 966 C GLU A 65 7.188 36.602 -15.111 1.00 24.42 C ATOM 967 O GLU A 65 7.356 37.160 -16.196 1.00 2.34 O ATOM 968 CB GLU A 65 5.846 37.513 -13.172 1.00 35.22 C ATOM 969 CG GLU A 65 4.470 37.881 -12.641 1.00 42.51 C ATOM 970 CD GLU A 65 4.534 38.644 -11.333 1.00 74.11 C ATOM 971 OE1 GLU A 65 4.855 39.851 -11.364 1.00 14.14 O ATOM 972 OE2 GLU A 65 4.260 38.036 -10.277 1.00 65.12 O1- ATOM 0 H GLU A 65 5.291 35.079 -13.154 1.00 54.02 H new ATOM 0 HA GLU A 65 5.121 37.115 -15.157 1.00 23.21 H new ATOM 0 HB2 GLU A 65 6.393 36.975 -12.398 1.00 35.22 H new ATOM 0 HB3 GLU A 65 6.403 38.427 -13.380 1.00 35.22 H new ATOM 0 HG2 GLU A 65 3.948 38.484 -13.384 1.00 42.51 H new ATOM 0 HG3 GLU A 65 3.885 36.973 -12.499 1.00 42.51 H new ATOM 979 N PRO A 66 8.205 35.946 -14.492 1.00 43.01 N ATOM 980 CA PRO A 66 9.550 35.861 -15.083 1.00 13.12 C ATOM 981 C PRO A 66 9.576 35.066 -16.391 1.00 4.25 C ATOM 982 O PRO A 66 9.856 35.620 -17.454 1.00 42.32 O ATOM 983 CB PRO A 66 10.379 35.152 -14.005 1.00 70.11 C ATOM 984 CG PRO A 66 9.393 34.436 -13.153 1.00 54.50 C ATOM 985 CD PRO A 66 8.140 35.262 -13.182 1.00 23.15 C ATOM 0 HA PRO A 66 9.930 36.847 -15.350 1.00 13.12 H new ATOM 0 HB2 PRO A 66 11.090 34.457 -14.451 1.00 70.11 H new ATOM 0 HB3 PRO A 66 10.957 35.868 -13.420 1.00 70.11 H new ATOM 0 HG2 PRO A 66 9.206 33.432 -13.533 1.00 54.50 H new ATOM 0 HG3 PRO A 66 9.765 34.327 -12.134 1.00 54.50 H new ATOM 0 HD2 PRO A 66 7.248 34.641 -13.098 1.00 23.15 H new ATOM 0 HD3 PRO A 66 8.111 35.975 -12.358 1.00 23.15 H new ATOM 993 N ALA A 67 9.281 33.770 -16.306 1.00 24.23 N ATOM 994 CA ALA A 67 9.271 32.906 -17.482 1.00 34.21 C ATOM 995 C ALA A 67 8.216 31.815 -17.346 1.00 64.33 C ATOM 996 O ALA A 67 8.403 30.843 -16.612 1.00 15.33 O ATOM 997 CB ALA A 67 10.647 32.293 -17.702 1.00 61.20 C ATOM 0 H ALA A 67 9.046 33.296 -15.434 1.00 24.23 H new ATOM 0 HA ALA A 67 9.018 33.515 -18.350 1.00 34.21 H new ATOM 0 HB1 ALA A 67 10.623 31.651 -18.583 1.00 61.20 H new ATOM 0 HB2 ALA A 67 11.379 33.087 -17.851 1.00 61.20 H new ATOM 0 HB3 ALA A 67 10.926 31.702 -16.830 1.00 61.20 H new ATOM 1003 N VAL A 68 7.106 31.983 -18.057 1.00 24.33 N ATOM 1004 CA VAL A 68 6.015 31.016 -18.015 1.00 52.42 C ATOM 1005 C VAL A 68 6.253 29.859 -18.989 1.00 54.54 C ATOM 1006 O VAL A 68 6.530 30.066 -20.172 1.00 22.13 O ATOM 1007 CB VAL A 68 4.651 31.691 -18.316 1.00 52.45 C ATOM 1008 CG1 VAL A 68 4.698 32.479 -19.618 1.00 33.15 C ATOM 1009 CG2 VAL A 68 3.530 30.660 -18.352 1.00 71.52 C ATOM 0 H VAL A 68 6.938 32.781 -18.670 1.00 24.33 H new ATOM 0 HA VAL A 68 5.986 30.613 -17.003 1.00 52.42 H new ATOM 0 HB VAL A 68 4.445 32.393 -17.508 1.00 52.45 H new ATOM 0 HG11 VAL A 68 3.727 32.939 -19.800 1.00 33.15 H new ATOM 0 HG12 VAL A 68 5.460 33.255 -19.546 1.00 33.15 H new ATOM 0 HG13 VAL A 68 4.941 31.807 -20.441 1.00 33.15 H new ATOM 0 HG21 VAL A 68 2.584 31.158 -18.565 1.00 71.52 H new ATOM 0 HG22 VAL A 68 3.736 29.925 -19.130 1.00 71.52 H new ATOM 0 HG23 VAL A 68 3.466 30.158 -17.387 1.00 71.52 H new ATOM 1019 N ASN A 69 6.160 28.639 -18.470 1.00 12.52 N ATOM 1020 CA ASN A 69 6.348 27.440 -19.277 1.00 62.31 C ATOM 1021 C ASN A 69 4.999 26.900 -19.743 1.00 52.35 C ATOM 1022 O ASN A 69 4.058 26.798 -18.956 1.00 12.14 O ATOM 1023 CB ASN A 69 7.093 26.371 -18.469 1.00 64.52 C ATOM 1024 CG ASN A 69 7.404 25.128 -19.282 1.00 44.03 C ATOM 1025 OD1 ASN A 69 7.707 25.206 -20.473 1.00 1.12 O ATOM 1026 ND2 ASN A 69 7.324 23.969 -18.640 1.00 14.02 N ATOM 0 H ASN A 69 5.954 28.455 -17.488 1.00 12.52 H new ATOM 0 HA ASN A 69 6.943 27.698 -20.153 1.00 62.31 H new ATOM 0 HB2 ASN A 69 8.023 26.793 -18.089 1.00 64.52 H new ATOM 0 HB3 ASN A 69 6.492 26.092 -17.603 1.00 64.52 H new ATOM 0 HD21 ASN A 69 7.517 23.098 -19.134 1.00 14.02 H new ATOM 0 HD22 ASN A 69 7.069 23.950 -17.652 1.00 14.02 H new ATOM 1033 N GLY A 70 4.909 26.564 -21.026 1.00 41.10 N ATOM 1034 CA GLY A 70 3.670 26.039 -21.570 1.00 22.11 C ATOM 1035 C GLY A 70 3.781 24.579 -21.965 1.00 22.11 C ATOM 1036 O GLY A 70 3.065 24.124 -22.858 1.00 72.54 O ATOM 0 H GLY A 70 5.672 26.646 -21.698 1.00 41.10 H new ATOM 0 HA2 GLY A 70 2.876 26.153 -20.832 1.00 22.11 H new ATOM 0 HA3 GLY A 70 3.382 26.627 -22.442 1.00 22.11 H new ATOM 1040 N ALA A 71 4.682 23.853 -21.291 1.00 32.52 N ATOM 1041 CA ALA A 71 4.913 22.429 -21.552 1.00 73.22 C ATOM 1042 C ALA A 71 5.343 22.185 -22.998 1.00 30.32 C ATOM 1043 O ALA A 71 4.526 21.837 -23.853 1.00 20.43 O ATOM 1044 CB ALA A 71 3.674 21.609 -21.211 1.00 43.24 C ATOM 0 H ALA A 71 5.270 24.237 -20.551 1.00 32.52 H new ATOM 0 HA ALA A 71 5.729 22.105 -20.907 1.00 73.22 H new ATOM 0 HB1 ALA A 71 3.868 20.556 -21.412 1.00 43.24 H new ATOM 0 HB2 ALA A 71 3.431 21.738 -20.156 1.00 43.24 H new ATOM 0 HB3 ALA A 71 2.835 21.946 -21.820 1.00 43.24 H new ATOM 1050 N THR A 72 6.633 22.369 -23.264 1.00 74.51 N ATOM 1051 CA THR A 72 7.173 22.173 -24.605 1.00 32.31 C ATOM 1052 C THR A 72 7.678 20.741 -24.798 1.00 34.30 C ATOM 1053 O THR A 72 7.885 20.293 -25.927 1.00 52.30 O ATOM 1054 CB THR A 72 8.312 23.175 -24.906 1.00 41.01 C ATOM 1055 OG1 THR A 72 8.778 23.004 -26.250 1.00 34.24 O ATOM 1056 CG2 THR A 72 9.475 23.001 -23.938 1.00 71.34 C ATOM 0 H THR A 72 7.323 22.653 -22.569 1.00 74.51 H new ATOM 0 HA THR A 72 6.358 22.353 -25.306 1.00 32.31 H new ATOM 0 HB THR A 72 7.910 24.181 -24.783 1.00 41.01 H new ATOM 0 HG1 THR A 72 8.485 22.133 -26.590 1.00 34.24 H new ATOM 0 HG21 THR A 72 10.258 23.720 -24.177 1.00 71.34 H new ATOM 0 HG22 THR A 72 9.128 23.168 -22.918 1.00 71.34 H new ATOM 0 HG23 THR A 72 9.872 21.990 -24.025 1.00 71.34 H new ATOM 1064 N GLY A 73 7.866 20.026 -23.691 1.00 71.44 N ATOM 1065 CA GLY A 73 8.340 18.656 -23.764 1.00 14.10 C ATOM 1066 C GLY A 73 8.768 18.112 -22.416 1.00 53.25 C ATOM 1067 O GLY A 73 9.893 18.347 -21.974 1.00 51.51 O ATOM 0 H GLY A 73 7.698 20.372 -22.746 1.00 71.44 H new ATOM 0 HA2 GLY A 73 7.551 18.024 -24.172 1.00 14.10 H new ATOM 0 HA3 GLY A 73 9.181 18.603 -24.456 1.00 14.10 H new ATOM 1071 N HIS A 74 7.869 17.376 -21.764 1.00 3.13 N ATOM 1072 CA HIS A 74 8.158 16.786 -20.458 1.00 25.33 C ATOM 1073 C HIS A 74 8.901 15.458 -20.610 1.00 21.44 C ATOM 1074 O HIS A 74 9.313 14.848 -19.624 1.00 51.01 O ATOM 1075 CB HIS A 74 6.863 16.582 -19.657 1.00 20.21 C ATOM 1076 CG HIS A 74 5.793 15.829 -20.393 1.00 74.00 C ATOM 1077 ND1 HIS A 74 4.791 16.453 -21.107 1.00 3.44 N ATOM 1078 CD2 HIS A 74 5.568 14.498 -20.518 1.00 2.52 C ATOM 1079 CE1 HIS A 74 3.997 15.540 -21.638 1.00 10.44 C ATOM 1080 NE2 HIS A 74 4.447 14.348 -21.296 1.00 13.23 N ATOM 0 H HIS A 74 6.934 17.174 -22.119 1.00 3.13 H new ATOM 0 HA HIS A 74 8.800 17.478 -19.912 1.00 25.33 H new ATOM 0 HB2 HIS A 74 7.099 16.048 -18.737 1.00 20.21 H new ATOM 0 HB3 HIS A 74 6.471 17.557 -19.368 1.00 20.21 H new ATOM 0 HD1 HIS A 74 4.680 17.462 -21.209 1.00 3.44 H new ATOM 0 HD2 HIS A 74 6.160 13.704 -20.086 1.00 2.52 H new ATOM 0 HE1 HIS A 74 3.128 15.736 -22.248 1.00 10.44 H new ATOM 1089 N SER A 75 9.064 15.021 -21.855 1.00 22.24 N ATOM 1090 CA SER A 75 9.760 13.776 -22.152 1.00 71.32 C ATOM 1091 C SER A 75 11.257 14.022 -22.298 1.00 3.04 C ATOM 1092 O SER A 75 12.077 13.202 -21.885 1.00 40.42 O ATOM 1093 CB SER A 75 9.203 13.159 -23.435 1.00 64.34 C ATOM 1094 OG SER A 75 9.950 12.020 -23.822 1.00 61.11 O ATOM 0 H SER A 75 8.721 15.515 -22.679 1.00 22.24 H new ATOM 0 HA SER A 75 9.602 13.084 -21.325 1.00 71.32 H new ATOM 0 HB2 SER A 75 8.160 12.879 -23.284 1.00 64.34 H new ATOM 0 HB3 SER A 75 9.222 13.899 -24.235 1.00 64.34 H new ATOM 0 HG SER A 75 9.677 11.739 -24.720 1.00 61.11 H new ATOM 1100 N SER A 76 11.603 15.163 -22.887 1.00 54.44 N ATOM 1101 CA SER A 76 12.999 15.530 -23.093 1.00 15.10 C ATOM 1102 C SER A 76 13.453 16.555 -22.055 1.00 53.35 C ATOM 1103 O SER A 76 14.474 17.222 -22.232 1.00 23.24 O ATOM 1104 CB SER A 76 13.195 16.085 -24.505 1.00 73.21 C ATOM 1105 OG SER A 76 12.855 15.120 -25.485 1.00 73.30 O ATOM 0 H SER A 76 10.933 15.851 -23.231 1.00 54.44 H new ATOM 0 HA SER A 76 13.609 14.634 -22.976 1.00 15.10 H new ATOM 0 HB2 SER A 76 12.580 16.975 -24.638 1.00 73.21 H new ATOM 0 HB3 SER A 76 14.232 16.392 -24.637 1.00 73.21 H new ATOM 0 HG SER A 76 12.987 15.500 -26.378 1.00 73.30 H new ATOM 1111 N SER A 77 12.691 16.670 -20.968 1.00 50.20 N ATOM 1112 CA SER A 77 13.015 17.608 -19.896 1.00 40.52 C ATOM 1113 C SER A 77 14.126 17.051 -19.007 1.00 25.42 C ATOM 1114 O SER A 77 14.915 17.805 -18.438 1.00 12.15 O ATOM 1115 CB SER A 77 11.769 17.912 -19.059 1.00 12.03 C ATOM 1116 OG SER A 77 11.298 16.752 -18.394 1.00 2.11 O ATOM 0 H SER A 77 11.844 16.124 -20.807 1.00 50.20 H new ATOM 0 HA SER A 77 13.368 18.535 -20.348 1.00 40.52 H new ATOM 0 HB2 SER A 77 12.001 18.685 -18.326 1.00 12.03 H new ATOM 0 HB3 SER A 77 10.984 18.308 -19.703 1.00 12.03 H new ATOM 0 HG SER A 77 10.764 16.214 -19.014 1.00 2.11 H new ATOM 1122 N LEU A 78 14.181 15.725 -18.897 1.00 45.32 N ATOM 1123 CA LEU A 78 15.198 15.058 -18.092 1.00 1.43 C ATOM 1124 C LEU A 78 15.831 13.914 -18.885 1.00 1.33 C ATOM 1125 O LEU A 78 16.893 14.079 -19.487 1.00 32.03 O ATOM 1126 CB LEU A 78 14.586 14.530 -16.785 1.00 62.23 C ATOM 1127 CG LEU A 78 15.398 14.790 -15.509 1.00 4.35 C ATOM 1128 CD1 LEU A 78 16.789 14.182 -15.609 1.00 12.55 C ATOM 1129 CD2 LEU A 78 15.486 16.280 -15.222 1.00 53.04 C ATOM 0 H LEU A 78 13.529 15.090 -19.358 1.00 45.32 H new ATOM 0 HA LEU A 78 15.974 15.781 -17.841 1.00 1.43 H new ATOM 0 HB2 LEU A 78 13.600 14.978 -16.662 1.00 62.23 H new ATOM 0 HB3 LEU A 78 14.438 13.455 -16.885 1.00 62.23 H new ATOM 0 HG LEU A 78 14.879 14.309 -14.680 1.00 4.35 H new ATOM 0 HD11 LEU A 78 17.341 14.382 -14.690 1.00 12.55 H new ATOM 0 HD12 LEU A 78 16.706 13.105 -15.755 1.00 12.55 H new ATOM 0 HD13 LEU A 78 17.319 14.622 -16.454 1.00 12.55 H new ATOM 0 HD21 LEU A 78 16.066 16.442 -14.313 1.00 53.04 H new ATOM 0 HD22 LEU A 78 15.973 16.783 -16.057 1.00 53.04 H new ATOM 0 HD23 LEU A 78 14.483 16.685 -15.089 1.00 53.04 H new ATOM 1141 N ASP A 79 15.162 12.760 -18.892 1.00 4.20 N ATOM 1142 CA ASP A 79 15.648 11.583 -19.610 1.00 44.32 C ATOM 1143 C ASP A 79 14.478 10.743 -20.119 1.00 33.32 C ATOM 1144 O ASP A 79 13.323 11.162 -20.044 1.00 63.14 O ATOM 1145 CB ASP A 79 16.542 10.729 -18.703 1.00 21.32 C ATOM 1146 CG ASP A 79 17.962 11.252 -18.611 1.00 24.35 C ATOM 1147 OD1 ASP A 79 18.736 11.039 -19.568 1.00 44.45 O ATOM 1148 OD2 ASP A 79 18.302 11.872 -17.582 1.00 14.03 O1- ATOM 0 H ASP A 79 14.277 12.616 -18.405 1.00 4.20 H new ATOM 0 HA ASP A 79 16.234 11.926 -20.462 1.00 44.32 H new ATOM 0 HB2 ASP A 79 16.108 10.693 -17.704 1.00 21.32 H new ATOM 0 HB3 ASP A 79 16.561 9.706 -19.079 1.00 21.32 H new ATOM 1153 N ALA A 80 14.787 9.557 -20.640 1.00 3.21 N ATOM 1154 CA ALA A 80 13.765 8.652 -21.159 1.00 40.04 C ATOM 1155 C ALA A 80 14.165 7.193 -20.950 1.00 24.34 C ATOM 1156 O ALA A 80 13.504 6.279 -21.444 1.00 30.50 O ATOM 1157 CB ALA A 80 13.521 8.928 -22.635 1.00 74.44 C ATOM 0 H ALA A 80 15.740 9.200 -20.714 1.00 3.21 H new ATOM 0 HA ALA A 80 12.841 8.830 -20.608 1.00 40.04 H new ATOM 0 HB1 ALA A 80 12.757 8.247 -23.011 1.00 74.44 H new ATOM 0 HB2 ALA A 80 13.184 9.957 -22.762 1.00 74.44 H new ATOM 0 HB3 ALA A 80 14.446 8.778 -23.191 1.00 74.44 H new ATOM 1163 N ARG A 81 15.248 6.985 -20.206 1.00 45.31 N ATOM 1164 CA ARG A 81 15.749 5.641 -19.931 1.00 23.14 C ATOM 1165 C ARG A 81 16.050 5.462 -18.443 1.00 60.05 C ATOM 1166 O ARG A 81 16.837 4.596 -18.057 1.00 31.14 O ATOM 1167 CB ARG A 81 17.012 5.376 -20.757 1.00 43.53 C ATOM 1168 CG ARG A 81 18.110 6.406 -20.538 1.00 62.34 C ATOM 1169 CD ARG A 81 19.380 6.038 -21.287 1.00 33.32 C ATOM 1170 NE ARG A 81 20.440 7.021 -21.072 1.00 51.30 N ATOM 1171 CZ ARG A 81 21.731 6.777 -21.281 1.00 65.54 C ATOM 1172 NH1 ARG A 81 22.127 5.586 -21.710 1.00 5.44 N1+ ATOM 1173 NH2 ARG A 81 22.630 7.728 -21.060 1.00 2.11 N ATOM 0 H ARG A 81 15.797 7.732 -19.781 1.00 45.31 H new ATOM 0 HA ARG A 81 14.977 4.924 -20.211 1.00 23.14 H new ATOM 0 HB2 ARG A 81 17.398 4.387 -20.508 1.00 43.53 H new ATOM 0 HB3 ARG A 81 16.748 5.358 -21.814 1.00 43.53 H new ATOM 0 HG2 ARG A 81 17.763 7.385 -20.869 1.00 62.34 H new ATOM 0 HG3 ARG A 81 18.326 6.488 -19.473 1.00 62.34 H new ATOM 0 HD2 ARG A 81 19.723 5.056 -20.961 1.00 33.32 H new ATOM 0 HD3 ARG A 81 19.165 5.963 -22.353 1.00 33.32 H new ATOM 0 HE ARG A 81 20.174 7.949 -20.742 1.00 51.30 H new ATOM 0 HH11 ARG A 81 21.440 4.851 -21.881 1.00 5.44 H new ATOM 0 HH12 ARG A 81 23.118 5.405 -21.869 1.00 5.44 H new ATOM 0 HH21 ARG A 81 22.331 8.646 -20.730 1.00 2.11 H new ATOM 0 HH22 ARG A 81 23.620 7.541 -21.220 1.00 2.11 H new ATOM 1187 N GLU A 82 15.411 6.280 -17.611 1.00 70.12 N ATOM 1188 CA GLU A 82 15.617 6.220 -16.168 1.00 23.31 C ATOM 1189 C GLU A 82 14.723 5.169 -15.515 1.00 4.31 C ATOM 1190 O GLU A 82 15.144 4.511 -14.563 1.00 72.35 O ATOM 1191 CB GLU A 82 15.351 7.587 -15.536 1.00 20.40 C ATOM 1192 CG GLU A 82 16.439 8.609 -15.813 1.00 15.22 C ATOM 1193 CD GLU A 82 16.223 9.906 -15.058 1.00 12.33 C ATOM 1194 OE1 GLU A 82 16.883 10.102 -14.017 1.00 34.55 O ATOM 1195 OE2 GLU A 82 15.392 10.723 -15.506 1.00 22.15 O1- ATOM 0 H GLU A 82 14.746 6.992 -17.912 1.00 70.12 H new ATOM 0 HA GLU A 82 16.655 5.936 -15.997 1.00 23.31 H new ATOM 0 HB2 GLU A 82 14.401 7.971 -15.908 1.00 20.40 H new ATOM 0 HB3 GLU A 82 15.245 7.465 -14.458 1.00 20.40 H new ATOM 0 HG2 GLU A 82 17.406 8.189 -15.538 1.00 15.22 H new ATOM 0 HG3 GLU A 82 16.474 8.816 -16.882 1.00 15.22 H new ATOM 1202 N VAL A 83 13.491 5.036 -16.039 1.00 0.31 N ATOM 1203 CA VAL A 83 12.471 4.083 -15.544 1.00 11.23 C ATOM 1204 C VAL A 83 12.277 4.155 -14.020 1.00 23.34 C ATOM 1205 O VAL A 83 12.807 5.054 -13.363 1.00 54.21 O ATOM 1206 CB VAL A 83 12.742 2.618 -15.999 1.00 21.33 C ATOM 1207 CG1 VAL A 83 12.991 2.566 -17.499 1.00 15.22 C ATOM 1208 CG2 VAL A 83 13.900 1.974 -15.245 1.00 54.14 C ATOM 0 H VAL A 83 13.168 5.594 -16.829 1.00 0.31 H new ATOM 0 HA VAL A 83 11.536 4.400 -16.007 1.00 11.23 H new ATOM 0 HB VAL A 83 11.848 2.041 -15.761 1.00 21.33 H new ATOM 0 HG11 VAL A 83 13.179 1.536 -17.801 1.00 15.22 H new ATOM 0 HG12 VAL A 83 12.116 2.945 -18.026 1.00 15.22 H new ATOM 0 HG13 VAL A 83 13.857 3.180 -17.746 1.00 15.22 H new ATOM 0 HG21 VAL A 83 14.045 0.954 -15.602 1.00 54.14 H new ATOM 0 HG22 VAL A 83 14.810 2.550 -15.414 1.00 54.14 H new ATOM 0 HG23 VAL A 83 13.675 1.956 -14.179 1.00 54.14 H new ATOM 1218 N ILE A 84 11.474 3.228 -13.470 1.00 35.11 N ATOM 1219 CA ILE A 84 11.194 3.185 -12.025 1.00 61.14 C ATOM 1220 C ILE A 84 10.274 4.347 -11.610 1.00 21.13 C ATOM 1221 O ILE A 84 10.430 5.468 -12.092 1.00 13.15 O ATOM 1222 CB ILE A 84 12.514 3.210 -11.199 1.00 74.23 C ATOM 1223 CG1 ILE A 84 13.242 1.870 -11.331 1.00 62.43 C ATOM 1224 CG2 ILE A 84 12.261 3.530 -9.730 1.00 74.14 C ATOM 1225 CD1 ILE A 84 14.699 1.929 -10.923 1.00 70.13 C ATOM 0 H ILE A 84 11.007 2.497 -14.006 1.00 35.11 H new ATOM 0 HA ILE A 84 10.679 2.248 -11.813 1.00 61.14 H new ATOM 0 HB ILE A 84 13.141 4.005 -11.603 1.00 74.23 H new ATOM 0 HG12 ILE A 84 12.732 1.127 -10.718 1.00 62.43 H new ATOM 0 HG13 ILE A 84 13.176 1.531 -12.365 1.00 62.43 H new ATOM 0 HG21 ILE A 84 13.208 3.537 -9.191 1.00 74.14 H new ATOM 0 HG22 ILE A 84 11.789 4.509 -9.647 1.00 74.14 H new ATOM 0 HG23 ILE A 84 11.605 2.773 -9.300 1.00 74.14 H new ATOM 0 HD11 ILE A 84 15.150 0.944 -11.043 1.00 70.13 H new ATOM 0 HD12 ILE A 84 15.224 2.648 -11.552 1.00 70.13 H new ATOM 0 HD13 ILE A 84 14.773 2.238 -9.880 1.00 70.13 H new ATOM 1237 N PRO A 85 9.278 4.088 -10.730 1.00 21.13 N ATOM 1238 CA PRO A 85 8.339 5.125 -10.252 1.00 73.14 C ATOM 1239 C PRO A 85 8.987 6.168 -9.326 1.00 50.23 C ATOM 1240 O PRO A 85 8.338 6.686 -8.416 1.00 4.23 O ATOM 1241 CB PRO A 85 7.289 4.319 -9.481 1.00 31.44 C ATOM 1242 CG PRO A 85 7.977 3.064 -9.074 1.00 53.42 C ATOM 1243 CD PRO A 85 8.963 2.759 -10.165 1.00 70.04 C ATOM 0 HA PRO A 85 7.945 5.709 -11.083 1.00 73.14 H new ATOM 0 HB2 PRO A 85 6.930 4.870 -8.612 1.00 31.44 H new ATOM 0 HB3 PRO A 85 6.420 4.107 -10.104 1.00 31.44 H new ATOM 0 HG2 PRO A 85 8.482 3.189 -8.116 1.00 53.42 H new ATOM 0 HG3 PRO A 85 7.263 2.249 -8.954 1.00 53.42 H new ATOM 0 HD2 PRO A 85 9.854 2.268 -9.774 1.00 70.04 H new ATOM 0 HD3 PRO A 85 8.537 2.095 -10.917 1.00 70.04 H new ATOM 1251 N MET A 86 10.254 6.488 -9.578 1.00 73.33 N ATOM 1252 CA MET A 86 10.982 7.463 -8.776 1.00 75.42 C ATOM 1253 C MET A 86 11.782 8.410 -9.669 1.00 34.14 C ATOM 1254 O MET A 86 11.770 9.625 -9.471 1.00 74.12 O ATOM 1255 CB MET A 86 11.921 6.746 -7.803 1.00 64.02 C ATOM 1256 CG MET A 86 12.639 7.678 -6.839 1.00 53.43 C ATOM 1257 SD MET A 86 13.703 6.797 -5.679 1.00 12.41 S ATOM 1258 CE MET A 86 14.929 6.111 -6.791 1.00 21.53 C ATOM 0 H MET A 86 10.800 6.082 -10.338 1.00 73.33 H new ATOM 0 HA MET A 86 10.259 8.050 -8.210 1.00 75.42 H new ATOM 0 HB2 MET A 86 11.347 6.018 -7.230 1.00 64.02 H new ATOM 0 HB3 MET A 86 12.663 6.188 -8.374 1.00 64.02 H new ATOM 0 HG2 MET A 86 13.239 8.389 -7.407 1.00 53.43 H new ATOM 0 HG3 MET A 86 11.902 8.256 -6.282 1.00 53.43 H new ATOM 0 HE1 MET A 86 15.812 5.819 -6.223 1.00 21.53 H new ATOM 0 HE2 MET A 86 14.516 5.237 -7.294 1.00 21.53 H new ATOM 0 HE3 MET A 86 15.206 6.859 -7.534 1.00 21.53 H new ATOM 1268 N ALA A 87 12.471 7.844 -10.657 1.00 54.22 N ATOM 1269 CA ALA A 87 13.287 8.632 -11.576 1.00 53.42 C ATOM 1270 C ALA A 87 12.544 8.934 -12.876 1.00 13.41 C ATOM 1271 O ALA A 87 12.880 9.884 -13.584 1.00 23.33 O ATOM 1272 CB ALA A 87 14.592 7.907 -11.867 1.00 24.21 C ATOM 0 H ALA A 87 12.480 6.841 -10.842 1.00 54.22 H new ATOM 0 HA ALA A 87 13.505 9.586 -11.095 1.00 53.42 H new ATOM 0 HB1 ALA A 87 15.194 8.503 -12.553 1.00 24.21 H new ATOM 0 HB2 ALA A 87 15.141 7.759 -10.937 1.00 24.21 H new ATOM 0 HB3 ALA A 87 14.377 6.939 -12.319 1.00 24.21 H new ATOM 1278 N ALA A 88 11.534 8.123 -13.189 1.00 61.15 N ATOM 1279 CA ALA A 88 10.749 8.313 -14.405 1.00 45.52 C ATOM 1280 C ALA A 88 9.653 9.354 -14.197 1.00 75.23 C ATOM 1281 O ALA A 88 9.240 10.029 -15.139 1.00 22.52 O ATOM 1282 CB ALA A 88 10.146 6.993 -14.861 1.00 71.22 C ATOM 0 H ALA A 88 11.242 7.330 -12.618 1.00 61.15 H new ATOM 0 HA ALA A 88 11.419 8.680 -15.183 1.00 45.52 H new ATOM 0 HB1 ALA A 88 9.564 7.153 -15.769 1.00 71.22 H new ATOM 0 HB2 ALA A 88 10.944 6.279 -15.063 1.00 71.22 H new ATOM 0 HB3 ALA A 88 9.497 6.600 -14.079 1.00 71.22 H new ATOM 1288 N VAL A 89 9.189 9.483 -12.956 1.00 43.51 N ATOM 1289 CA VAL A 89 8.146 10.452 -12.625 1.00 55.25 C ATOM 1290 C VAL A 89 8.762 11.827 -12.366 1.00 52.21 C ATOM 1291 O VAL A 89 8.054 12.811 -12.154 1.00 54.11 O ATOM 1292 CB VAL A 89 7.330 10.015 -11.388 1.00 14.41 C ATOM 1293 CG1 VAL A 89 5.938 10.630 -11.413 1.00 23.12 C ATOM 1294 CG2 VAL A 89 7.240 8.499 -11.304 1.00 12.30 C ATOM 0 H VAL A 89 9.518 8.930 -12.164 1.00 43.51 H new ATOM 0 HA VAL A 89 7.470 10.505 -13.479 1.00 55.25 H new ATOM 0 HB VAL A 89 7.849 10.376 -10.500 1.00 14.41 H new ATOM 0 HG11 VAL A 89 5.382 10.308 -10.532 1.00 23.12 H new ATOM 0 HG12 VAL A 89 6.020 11.717 -11.413 1.00 23.12 H new ATOM 0 HG13 VAL A 89 5.413 10.306 -12.312 1.00 23.12 H new ATOM 0 HG21 VAL A 89 6.661 8.217 -10.425 1.00 12.30 H new ATOM 0 HG22 VAL A 89 6.752 8.113 -12.199 1.00 12.30 H new ATOM 0 HG23 VAL A 89 8.243 8.079 -11.228 1.00 12.30 H new ATOM 1304 N LYS A 90 10.093 11.877 -12.392 1.00 23.33 N ATOM 1305 CA LYS A 90 10.832 13.115 -12.175 1.00 35.54 C ATOM 1306 C LYS A 90 10.636 14.070 -13.352 1.00 30.13 C ATOM 1307 O LYS A 90 10.463 15.276 -13.165 1.00 54.30 O ATOM 1308 CB LYS A 90 12.318 12.797 -11.978 1.00 23.43 C ATOM 1309 CG LYS A 90 13.214 14.023 -11.901 1.00 23.05 C ATOM 1310 CD LYS A 90 14.600 13.673 -11.378 1.00 34.41 C ATOM 1311 CE LYS A 90 15.278 12.616 -12.236 1.00 51.13 C ATOM 1312 NZ LYS A 90 16.627 12.266 -11.718 1.00 65.32 N1+ ATOM 0 H LYS A 90 10.685 11.064 -12.563 1.00 23.33 H new ATOM 0 HA LYS A 90 10.452 13.605 -11.278 1.00 35.54 H new ATOM 0 HB2 LYS A 90 12.435 12.217 -11.063 1.00 23.43 H new ATOM 0 HB3 LYS A 90 12.655 12.166 -12.800 1.00 23.43 H new ATOM 0 HG2 LYS A 90 13.301 14.473 -12.890 1.00 23.05 H new ATOM 0 HG3 LYS A 90 12.757 14.768 -11.250 1.00 23.05 H new ATOM 0 HD2 LYS A 90 15.217 14.571 -11.354 1.00 34.41 H new ATOM 0 HD3 LYS A 90 14.521 13.313 -10.352 1.00 34.41 H new ATOM 0 HE2 LYS A 90 14.657 11.721 -12.268 1.00 51.13 H new ATOM 0 HE3 LYS A 90 15.365 12.980 -13.260 1.00 51.13 H new ATOM 0 HZ1 LYS A 90 17.043 11.519 -12.310 1.00 65.32 H new ATOM 0 HZ2 LYS A 90 17.238 13.107 -11.743 1.00 65.32 H new ATOM 0 HZ3 LYS A 90 16.545 11.927 -10.738 1.00 65.32 H new ATOM 1326 N GLN A 91 10.652 13.517 -14.564 1.00 32.23 N ATOM 1327 CA GLN A 91 10.462 14.311 -15.774 1.00 13.32 C ATOM 1328 C GLN A 91 8.975 14.565 -16.022 1.00 4.30 C ATOM 1329 O GLN A 91 8.607 15.470 -16.771 1.00 74.41 O ATOM 1330 CB GLN A 91 11.086 13.605 -16.983 1.00 31.23 C ATOM 1331 CG GLN A 91 10.529 12.213 -17.240 1.00 63.44 C ATOM 1332 CD GLN A 91 11.581 11.128 -17.112 1.00 72.42 C ATOM 1333 OE1 GLN A 91 12.544 11.264 -16.358 1.00 73.13 O ATOM 1334 NE2 GLN A 91 11.398 10.039 -17.849 1.00 22.03 N ATOM 0 H GLN A 91 10.795 12.521 -14.733 1.00 32.23 H new ATOM 0 HA GLN A 91 10.960 15.270 -15.634 1.00 13.32 H new ATOM 0 HB2 GLN A 91 10.928 14.218 -17.870 1.00 31.23 H new ATOM 0 HB3 GLN A 91 12.163 13.532 -16.833 1.00 31.23 H new ATOM 0 HG2 GLN A 91 9.721 12.014 -16.536 1.00 63.44 H new ATOM 0 HG3 GLN A 91 10.097 12.178 -18.240 1.00 63.44 H new ATOM 0 HE21 GLN A 91 10.585 9.968 -18.461 1.00 22.03 H new ATOM 0 HE22 GLN A 91 12.070 9.273 -17.803 1.00 22.03 H new ATOM 1343 N ALA A 92 8.128 13.761 -15.378 1.00 50.43 N ATOM 1344 CA ALA A 92 6.682 13.893 -15.515 1.00 24.00 C ATOM 1345 C ALA A 92 6.133 14.948 -14.557 1.00 22.41 C ATOM 1346 O ALA A 92 4.965 15.327 -14.639 1.00 10.13 O ATOM 1347 CB ALA A 92 6.005 12.552 -15.269 1.00 21.40 C ATOM 0 H ALA A 92 8.423 13.009 -14.755 1.00 50.43 H new ATOM 0 HA ALA A 92 6.466 14.217 -16.533 1.00 24.00 H new ATOM 0 HB1 ALA A 92 4.926 12.664 -15.374 1.00 21.40 H new ATOM 0 HB2 ALA A 92 6.366 11.823 -15.995 1.00 21.40 H new ATOM 0 HB3 ALA A 92 6.237 12.207 -14.262 1.00 21.40 H new ATOM 1353 N LEU A 93 6.983 15.413 -13.644 1.00 71.20 N ATOM 1354 CA LEU A 93 6.589 16.432 -12.677 1.00 55.44 C ATOM 1355 C LEU A 93 7.398 17.710 -12.879 1.00 13.40 C ATOM 1356 O LEU A 93 7.377 18.609 -12.038 1.00 52.35 O ATOM 1357 CB LEU A 93 6.773 15.918 -11.245 1.00 70.05 C ATOM 1358 CG LEU A 93 5.808 14.807 -10.817 1.00 1.23 C ATOM 1359 CD1 LEU A 93 6.157 14.310 -9.423 1.00 33.44 C ATOM 1360 CD2 LEU A 93 4.367 15.300 -10.858 1.00 51.40 C ATOM 0 H LEU A 93 7.949 15.099 -13.555 1.00 71.20 H new ATOM 0 HA LEU A 93 5.534 16.657 -12.837 1.00 55.44 H new ATOM 0 HB2 LEU A 93 7.794 15.551 -11.137 1.00 70.05 H new ATOM 0 HB3 LEU A 93 6.662 16.757 -10.559 1.00 70.05 H new ATOM 0 HG LEU A 93 5.907 13.978 -11.518 1.00 1.23 H new ATOM 0 HD11 LEU A 93 5.463 13.521 -9.133 1.00 33.44 H new ATOM 0 HD12 LEU A 93 7.174 13.917 -9.421 1.00 33.44 H new ATOM 0 HD13 LEU A 93 6.085 15.135 -8.714 1.00 33.44 H new ATOM 0 HD21 LEU A 93 3.698 14.496 -10.551 1.00 51.40 H new ATOM 0 HD22 LEU A 93 4.252 16.146 -10.180 1.00 51.40 H new ATOM 0 HD23 LEU A 93 4.118 15.611 -11.872 1.00 51.40 H new ATOM 1372 N ARG A 94 8.107 17.784 -14.003 1.00 75.25 N ATOM 1373 CA ARG A 94 8.922 18.950 -14.320 1.00 35.44 C ATOM 1374 C ARG A 94 8.145 19.935 -15.190 1.00 1.44 C ATOM 1375 O ARG A 94 7.905 21.075 -14.790 1.00 14.23 O ATOM 1376 CB ARG A 94 10.214 18.521 -15.023 1.00 13.12 C ATOM 1377 CG ARG A 94 11.128 19.681 -15.385 1.00 23.13 C ATOM 1378 CD ARG A 94 12.550 19.214 -15.655 1.00 73.14 C ATOM 1379 NE ARG A 94 13.362 20.268 -16.259 1.00 61.42 N ATOM 1380 CZ ARG A 94 14.666 20.420 -16.040 1.00 60.12 C ATOM 1381 NH1 ARG A 94 15.313 19.592 -15.232 1.00 11.13 N1+ ATOM 1382 NH2 ARG A 94 15.326 21.406 -16.631 1.00 5.33 N ATOM 0 H ARG A 94 8.132 17.048 -14.709 1.00 75.25 H new ATOM 0 HA ARG A 94 9.181 19.450 -13.387 1.00 35.44 H new ATOM 0 HB2 ARG A 94 10.756 17.831 -14.377 1.00 13.12 H new ATOM 0 HB3 ARG A 94 9.959 17.974 -15.931 1.00 13.12 H new ATOM 0 HG2 ARG A 94 10.738 20.190 -16.267 1.00 23.13 H new ATOM 0 HG3 ARG A 94 11.132 20.408 -14.573 1.00 23.13 H new ATOM 0 HD2 ARG A 94 13.010 18.891 -14.721 1.00 73.14 H new ATOM 0 HD3 ARG A 94 12.529 18.348 -16.316 1.00 73.14 H new ATOM 0 HE ARG A 94 12.902 20.927 -16.887 1.00 61.42 H new ATOM 0 HH11 ARG A 94 14.811 18.832 -14.773 1.00 11.13 H new ATOM 0 HH12 ARG A 94 16.312 19.715 -15.069 1.00 11.13 H new ATOM 0 HH21 ARG A 94 14.835 22.048 -17.253 1.00 5.33 H new ATOM 0 HH22 ARG A 94 16.325 21.523 -16.464 1.00 5.33 H new ATOM 1396 N GLU A 95 7.751 19.489 -16.380 1.00 71.54 N ATOM 1397 CA GLU A 95 7.000 20.334 -17.303 1.00 74.44 C ATOM 1398 C GLU A 95 5.549 19.875 -17.414 1.00 64.42 C ATOM 1399 O GLU A 95 4.790 20.380 -18.242 1.00 2.11 O ATOM 1400 CB GLU A 95 7.655 20.327 -18.686 1.00 55.34 C ATOM 1401 CG GLU A 95 9.019 20.997 -18.719 1.00 74.24 C ATOM 1402 CD GLU A 95 9.505 21.256 -20.131 1.00 22.21 C ATOM 1403 OE1 GLU A 95 8.755 21.878 -20.911 1.00 32.21 O ATOM 1404 OE2 GLU A 95 10.638 20.842 -20.454 1.00 30.22 O1- ATOM 0 H GLU A 95 7.939 18.549 -16.727 1.00 71.54 H new ATOM 0 HA GLU A 95 7.010 21.350 -16.908 1.00 74.44 H new ATOM 0 HB2 GLU A 95 7.758 19.296 -19.024 1.00 55.34 H new ATOM 0 HB3 GLU A 95 6.996 20.830 -19.393 1.00 55.34 H new ATOM 0 HG2 GLU A 95 8.970 21.941 -18.176 1.00 74.24 H new ATOM 0 HG3 GLU A 95 9.742 20.368 -18.199 1.00 74.24 H new ATOM 1411 N ALA A 96 5.167 18.918 -16.572 1.00 33.44 N ATOM 1412 CA ALA A 96 3.807 18.392 -16.578 1.00 21.51 C ATOM 1413 C ALA A 96 3.212 18.379 -15.172 1.00 5.24 C ATOM 1414 O ALA A 96 2.020 18.122 -14.997 1.00 14.11 O ATOM 1415 CB ALA A 96 3.787 16.994 -17.178 1.00 50.44 C ATOM 0 H ALA A 96 5.781 18.492 -15.878 1.00 33.44 H new ATOM 0 HA ALA A 96 3.193 19.049 -17.193 1.00 21.51 H new ATOM 0 HB1 ALA A 96 2.766 16.612 -17.177 1.00 50.44 H new ATOM 0 HB2 ALA A 96 4.159 17.032 -18.202 1.00 50.44 H new ATOM 0 HB3 ALA A 96 4.422 16.335 -16.586 1.00 50.44 H new ATOM 1421 N GLY A 97 4.048 18.657 -14.174 1.00 51.23 N ATOM 1422 CA GLY A 97 3.587 18.672 -12.797 1.00 64.12 C ATOM 1423 C GLY A 97 3.819 20.009 -12.122 1.00 64.21 C ATOM 1424 O GLY A 97 2.949 20.512 -11.412 1.00 64.15 O ATOM 0 H GLY A 97 5.038 18.872 -14.296 1.00 51.23 H new ATOM 0 HA2 GLY A 97 2.523 18.435 -12.771 1.00 64.12 H new ATOM 0 HA3 GLY A 97 4.101 17.891 -12.236 1.00 64.12 H new ATOM 1428 N ASP A 98 4.997 20.586 -12.345 1.00 64.45 N ATOM 1429 CA ASP A 98 5.345 21.875 -11.755 1.00 40.24 C ATOM 1430 C ASP A 98 4.753 23.021 -12.573 1.00 72.42 C ATOM 1431 O ASP A 98 4.728 24.169 -12.129 1.00 34.33 O ATOM 1432 CB ASP A 98 6.866 22.022 -11.666 1.00 73.55 C ATOM 1433 CG ASP A 98 7.292 23.059 -10.645 1.00 23.02 C ATOM 1434 OD1 ASP A 98 7.404 22.703 -9.454 1.00 60.34 O ATOM 1435 OD2 ASP A 98 7.521 24.223 -11.036 1.00 62.31 O1- ATOM 0 H ASP A 98 5.727 20.181 -12.931 1.00 64.45 H new ATOM 0 HA ASP A 98 4.926 21.917 -10.750 1.00 40.24 H new ATOM 0 HB2 ASP A 98 7.306 21.059 -11.406 1.00 73.55 H new ATOM 0 HB3 ASP A 98 7.259 22.298 -12.645 1.00 73.55 H new ATOM 1440 N GLU A 99 4.267 22.691 -13.769 1.00 50.25 N ATOM 1441 CA GLU A 99 3.665 23.673 -14.665 1.00 71.44 C ATOM 1442 C GLU A 99 2.305 24.135 -14.132 1.00 10.12 C ATOM 1443 O GLU A 99 1.816 25.204 -14.496 1.00 3.14 O ATOM 1444 CB GLU A 99 3.514 23.063 -16.064 1.00 22.22 C ATOM 1445 CG GLU A 99 3.454 24.086 -17.190 1.00 23.45 C ATOM 1446 CD GLU A 99 2.034 24.428 -17.602 1.00 43.13 C ATOM 1447 OE1 GLU A 99 1.615 25.585 -17.387 1.00 65.24 O ATOM 1448 OE2 GLU A 99 1.342 23.538 -18.140 1.00 35.21 O1- ATOM 0 H GLU A 99 4.280 21.741 -14.141 1.00 50.25 H new ATOM 0 HA GLU A 99 4.316 24.546 -14.721 1.00 71.44 H new ATOM 0 HB2 GLU A 99 4.351 22.388 -16.246 1.00 22.22 H new ATOM 0 HB3 GLU A 99 2.607 22.459 -16.088 1.00 22.22 H new ATOM 0 HG2 GLU A 99 3.965 24.996 -16.875 1.00 23.45 H new ATOM 0 HG3 GLU A 99 3.995 23.700 -18.054 1.00 23.45 H new ATOM 1455 N PHE A 100 1.709 23.324 -13.259 1.00 20.03 N ATOM 1456 CA PHE A 100 0.410 23.637 -12.668 1.00 64.44 C ATOM 1457 C PHE A 100 0.528 24.775 -11.654 1.00 22.54 C ATOM 1458 O PHE A 100 -0.233 25.741 -11.703 1.00 41.45 O ATOM 1459 CB PHE A 100 -0.172 22.390 -11.997 1.00 12.52 C ATOM 1460 CG PHE A 100 -1.591 22.551 -11.528 1.00 21.12 C ATOM 1461 CD1 PHE A 100 -1.934 22.280 -10.213 1.00 14.31 C ATOM 1462 CD2 PHE A 100 -2.582 22.969 -12.402 1.00 41.04 C ATOM 1463 CE1 PHE A 100 -3.238 22.424 -9.778 1.00 1.24 C ATOM 1464 CE2 PHE A 100 -3.887 23.114 -11.973 1.00 62.11 C ATOM 1465 CZ PHE A 100 -4.216 22.841 -10.660 1.00 65.43 C ATOM 0 H PHE A 100 2.109 22.440 -12.944 1.00 20.03 H new ATOM 0 HA PHE A 100 -0.260 23.962 -13.464 1.00 64.44 H new ATOM 0 HB2 PHE A 100 -0.125 21.557 -12.699 1.00 12.52 H new ATOM 0 HB3 PHE A 100 0.453 22.124 -11.145 1.00 12.52 H new ATOM 0 HD1 PHE A 100 -1.173 21.952 -9.520 1.00 14.31 H new ATOM 0 HD2 PHE A 100 -2.331 23.184 -13.430 1.00 41.04 H new ATOM 0 HE1 PHE A 100 -3.492 22.211 -8.750 1.00 1.24 H new ATOM 0 HE2 PHE A 100 -4.650 23.441 -12.664 1.00 62.11 H new ATOM 0 HZ PHE A 100 -5.236 22.953 -10.323 1.00 65.43 H new ATOM 1475 N GLU A 101 1.492 24.655 -10.740 1.00 63.54 N ATOM 1476 CA GLU A 101 1.721 25.674 -9.716 1.00 30.42 C ATOM 1477 C GLU A 101 2.344 26.930 -10.331 1.00 53.33 C ATOM 1478 O GLU A 101 2.236 28.025 -9.781 1.00 41.41 O ATOM 1479 CB GLU A 101 2.627 25.108 -8.613 1.00 4.52 C ATOM 1480 CG GLU A 101 2.873 26.058 -7.447 1.00 13.13 C ATOM 1481 CD GLU A 101 1.603 26.443 -6.710 1.00 41.05 C ATOM 1482 OE1 GLU A 101 0.885 25.534 -6.245 1.00 32.01 O ATOM 1483 OE2 GLU A 101 1.331 27.655 -6.591 1.00 62.54 O1- ATOM 0 H GLU A 101 2.128 23.859 -10.689 1.00 63.54 H new ATOM 0 HA GLU A 101 0.762 25.953 -9.279 1.00 30.42 H new ATOM 0 HB2 GLU A 101 2.181 24.190 -8.229 1.00 4.52 H new ATOM 0 HB3 GLU A 101 3.587 24.836 -9.053 1.00 4.52 H new ATOM 0 HG2 GLU A 101 3.565 25.591 -6.746 1.00 13.13 H new ATOM 0 HG3 GLU A 101 3.357 26.961 -7.819 1.00 13.13 H new ATOM 1490 N LEU A 102 2.985 26.757 -11.485 1.00 23.43 N ATOM 1491 CA LEU A 102 3.626 27.862 -12.193 1.00 61.22 C ATOM 1492 C LEU A 102 2.603 28.682 -12.985 1.00 34.41 C ATOM 1493 O LEU A 102 2.810 29.871 -13.239 1.00 44.11 O ATOM 1494 CB LEU A 102 4.716 27.308 -13.125 1.00 62.35 C ATOM 1495 CG LEU A 102 5.182 28.240 -14.249 1.00 14.24 C ATOM 1496 CD1 LEU A 102 6.693 28.175 -14.405 1.00 55.42 C ATOM 1497 CD2 LEU A 102 4.501 27.873 -15.560 1.00 62.43 C ATOM 0 H LEU A 102 3.074 25.855 -11.952 1.00 23.43 H new ATOM 0 HA LEU A 102 4.082 28.529 -11.461 1.00 61.22 H new ATOM 0 HB2 LEU A 102 5.582 27.042 -12.519 1.00 62.35 H new ATOM 0 HB3 LEU A 102 4.346 26.387 -13.575 1.00 62.35 H new ATOM 0 HG LEU A 102 4.905 29.261 -13.985 1.00 14.24 H new ATOM 0 HD11 LEU A 102 7.005 28.843 -15.208 1.00 55.42 H new ATOM 0 HD12 LEU A 102 7.168 28.481 -13.473 1.00 55.42 H new ATOM 0 HD13 LEU A 102 6.990 27.154 -14.646 1.00 55.42 H new ATOM 0 HD21 LEU A 102 4.843 28.544 -16.348 1.00 62.43 H new ATOM 0 HD22 LEU A 102 4.751 26.846 -15.825 1.00 62.43 H new ATOM 0 HD23 LEU A 102 3.421 27.966 -15.447 1.00 62.43 H new ATOM 1509 N ARG A 103 1.498 28.038 -13.359 1.00 62.12 N ATOM 1510 CA ARG A 103 0.439 28.683 -14.136 1.00 60.12 C ATOM 1511 C ARG A 103 -0.180 29.871 -13.394 1.00 41.31 C ATOM 1512 O ARG A 103 -0.237 30.979 -13.928 1.00 34.42 O ATOM 1513 CB ARG A 103 -0.644 27.656 -14.491 1.00 62.14 C ATOM 1514 CG ARG A 103 -1.792 28.222 -15.314 1.00 32.00 C ATOM 1515 CD ARG A 103 -3.057 28.365 -14.481 1.00 31.41 C ATOM 1516 NE ARG A 103 -4.133 29.017 -15.224 1.00 2.15 N ATOM 1517 CZ ARG A 103 -5.225 29.521 -14.653 1.00 70.25 C ATOM 1518 NH1 ARG A 103 -5.388 29.450 -13.339 1.00 55.11 N1+ ATOM 1519 NH2 ARG A 103 -6.157 30.099 -15.399 1.00 32.41 N ATOM 0 H ARG A 103 1.312 27.061 -13.134 1.00 62.12 H new ATOM 0 HA ARG A 103 0.889 29.072 -15.049 1.00 60.12 H new ATOM 0 HB2 ARG A 103 -0.185 26.836 -15.043 1.00 62.14 H new ATOM 0 HB3 ARG A 103 -1.045 27.234 -13.570 1.00 62.14 H new ATOM 0 HG2 ARG A 103 -1.508 29.194 -15.716 1.00 32.00 H new ATOM 0 HG3 ARG A 103 -1.987 27.570 -16.165 1.00 32.00 H new ATOM 0 HD2 ARG A 103 -3.388 27.380 -14.154 1.00 31.41 H new ATOM 0 HD3 ARG A 103 -2.836 28.942 -13.583 1.00 31.41 H new ATOM 0 HE ARG A 103 -4.042 29.090 -16.237 1.00 2.15 H new ATOM 0 HH11 ARG A 103 -4.675 29.007 -12.760 1.00 55.11 H new ATOM 0 HH12 ARG A 103 -6.227 29.838 -12.907 1.00 55.11 H new ATOM 0 HH21 ARG A 103 -6.037 30.157 -16.410 1.00 32.41 H new ATOM 0 HH22 ARG A 103 -6.994 30.485 -14.961 1.00 32.41 H new ATOM 1533 N TYR A 104 -0.639 29.641 -12.165 1.00 52.42 N ATOM 1534 CA TYR A 104 -1.263 30.703 -11.378 1.00 13.30 C ATOM 1535 C TYR A 104 -0.286 31.333 -10.384 1.00 63.24 C ATOM 1536 O TYR A 104 -0.671 32.230 -9.632 1.00 72.05 O ATOM 1537 CB TYR A 104 -2.501 30.175 -10.641 1.00 1.53 C ATOM 1538 CG TYR A 104 -2.328 28.800 -10.030 1.00 74.53 C ATOM 1539 CD1 TYR A 104 -1.514 28.606 -8.922 1.00 43.20 C ATOM 1540 CD2 TYR A 104 -2.987 27.698 -10.560 1.00 44.51 C ATOM 1541 CE1 TYR A 104 -1.361 27.354 -8.361 1.00 12.51 C ATOM 1542 CE2 TYR A 104 -2.839 26.442 -10.003 1.00 64.31 C ATOM 1543 CZ TYR A 104 -2.024 26.276 -8.904 1.00 25.55 C ATOM 1544 OH TYR A 104 -1.873 25.029 -8.344 1.00 54.23 O ATOM 0 H TYR A 104 -0.591 28.737 -11.696 1.00 52.42 H new ATOM 0 HA TYR A 104 -1.569 31.481 -12.077 1.00 13.30 H new ATOM 0 HB2 TYR A 104 -2.766 30.879 -9.852 1.00 1.53 H new ATOM 0 HB3 TYR A 104 -3.339 30.147 -11.338 1.00 1.53 H new ATOM 0 HD1 TYR A 104 -0.992 29.448 -8.492 1.00 43.20 H new ATOM 0 HD2 TYR A 104 -3.626 27.825 -11.422 1.00 44.51 H new ATOM 0 HE1 TYR A 104 -0.724 27.220 -7.499 1.00 12.51 H new ATOM 0 HE2 TYR A 104 -3.359 25.595 -10.426 1.00 64.31 H new ATOM 0 HH TYR A 104 -2.188 24.347 -8.974 1.00 54.23 H new ATOM 1554 N ARG A 105 0.968 30.854 -10.393 1.00 42.41 N ATOM 1555 CA ARG A 105 2.032 31.357 -9.505 1.00 15.40 C ATOM 1556 C ARG A 105 1.836 30.909 -8.055 1.00 65.40 C ATOM 1557 O ARG A 105 2.632 30.131 -7.528 1.00 0.05 O ATOM 1558 CB ARG A 105 2.137 32.886 -9.575 1.00 1.02 C ATOM 1559 CG ARG A 105 2.734 33.397 -10.874 1.00 42.53 C ATOM 1560 CD ARG A 105 2.372 34.853 -11.121 1.00 64.23 C ATOM 1561 NE ARG A 105 0.933 35.034 -11.306 1.00 15.05 N ATOM 1562 CZ ARG A 105 0.395 35.823 -12.234 1.00 3.35 C ATOM 1563 NH1 ARG A 105 1.170 36.508 -13.065 1.00 74.31 N1+ ATOM 1564 NH2 ARG A 105 -0.922 35.927 -12.331 1.00 64.40 N ATOM 0 H ARG A 105 1.275 30.107 -11.016 1.00 42.41 H new ATOM 0 HA ARG A 105 2.966 30.924 -9.863 1.00 15.40 H new ATOM 0 HB2 ARG A 105 1.143 33.316 -9.448 1.00 1.02 H new ATOM 0 HB3 ARG A 105 2.746 33.238 -8.742 1.00 1.02 H new ATOM 0 HG2 ARG A 105 3.818 33.291 -10.843 1.00 42.53 H new ATOM 0 HG3 ARG A 105 2.378 32.787 -11.704 1.00 42.53 H new ATOM 0 HD2 ARG A 105 2.709 35.458 -10.279 1.00 64.23 H new ATOM 0 HD3 ARG A 105 2.900 35.213 -12.004 1.00 64.23 H new ATOM 0 HE ARG A 105 0.303 34.525 -10.686 1.00 15.05 H new ATOM 0 HH11 ARG A 105 2.185 36.432 -12.995 1.00 74.31 H new ATOM 0 HH12 ARG A 105 0.751 37.110 -13.773 1.00 74.31 H new ATOM 0 HH21 ARG A 105 -1.523 35.403 -11.695 1.00 64.40 H new ATOM 0 HH22 ARG A 105 -1.335 36.531 -13.042 1.00 64.40 H new ATOM 1578 N ARG A 106 0.784 31.410 -7.412 1.00 33.45 N ATOM 1579 CA ARG A 106 0.495 31.067 -6.025 1.00 65.14 C ATOM 1580 C ARG A 106 -0.983 30.722 -5.846 1.00 44.23 C ATOM 1581 O ARG A 106 -1.857 31.385 -6.405 1.00 1.42 O ATOM 1582 CB ARG A 106 0.869 32.236 -5.110 1.00 72.31 C ATOM 1583 CG ARG A 106 0.922 31.872 -3.634 1.00 51.11 C ATOM 1584 CD ARG A 106 0.961 33.112 -2.754 1.00 13.11 C ATOM 1585 NE ARG A 106 2.083 33.988 -3.086 1.00 34.31 N ATOM 1586 CZ ARG A 106 2.184 35.252 -2.679 1.00 13.22 C ATOM 1587 NH1 ARG A 106 1.234 35.791 -1.927 1.00 71.44 N1+ ATOM 1588 NH2 ARG A 106 3.237 35.978 -3.025 1.00 33.14 N ATOM 0 H ARG A 106 0.117 32.057 -7.832 1.00 33.45 H new ATOM 0 HA ARG A 106 1.088 30.193 -5.757 1.00 65.14 H new ATOM 0 HB2 ARG A 106 1.841 32.625 -5.413 1.00 72.31 H new ATOM 0 HB3 ARG A 106 0.146 33.040 -5.250 1.00 72.31 H new ATOM 0 HG2 ARG A 106 0.052 31.269 -3.376 1.00 51.11 H new ATOM 0 HG3 ARG A 106 1.803 31.260 -3.441 1.00 51.11 H new ATOM 0 HD2 ARG A 106 0.027 33.663 -2.864 1.00 13.11 H new ATOM 0 HD3 ARG A 106 1.033 32.812 -1.709 1.00 13.11 H new ATOM 0 HE ARG A 106 2.833 33.609 -3.664 1.00 34.31 H new ATOM 0 HH11 ARG A 106 0.421 35.237 -1.658 1.00 71.44 H new ATOM 0 HH12 ARG A 106 1.316 36.760 -1.618 1.00 71.44 H new ATOM 0 HH21 ARG A 106 3.971 35.569 -3.603 1.00 33.14 H new ATOM 0 HH22 ARG A 106 3.314 36.946 -2.713 1.00 33.14 H new ATOM 1602 N ALA A 107 -1.254 29.678 -5.066 1.00 61.14 N ATOM 1603 CA ALA A 107 -2.624 29.252 -4.804 1.00 3.22 C ATOM 1604 C ALA A 107 -3.010 29.538 -3.358 1.00 74.33 C ATOM 1605 O ALA A 107 -4.122 29.986 -3.077 1.00 23.20 O ATOM 1606 CB ALA A 107 -2.791 27.772 -5.113 1.00 13.05 C ATOM 0 H ALA A 107 -0.542 29.112 -4.605 1.00 61.14 H new ATOM 0 HA ALA A 107 -3.288 29.820 -5.456 1.00 3.22 H new ATOM 0 HB1 ALA A 107 -3.819 27.472 -4.912 1.00 13.05 H new ATOM 0 HB2 ALA A 107 -2.559 27.591 -6.163 1.00 13.05 H new ATOM 0 HB3 ALA A 107 -2.114 27.191 -4.487 1.00 13.05 H new ATOM 1612 N PHE A 108 -2.080 29.276 -2.444 1.00 42.23 N ATOM 1613 CA PHE A 108 -2.312 29.504 -1.023 1.00 73.30 C ATOM 1614 C PHE A 108 -1.444 30.652 -0.515 1.00 1.24 C ATOM 1615 O PHE A 108 -0.217 30.562 -0.519 1.00 50.31 O ATOM 1616 CB PHE A 108 -2.018 28.231 -0.224 1.00 12.43 C ATOM 1617 CG PHE A 108 -2.869 27.057 -0.620 1.00 2.32 C ATOM 1618 CD1 PHE A 108 -4.183 26.961 -0.191 1.00 33.21 C ATOM 1619 CD2 PHE A 108 -2.354 26.049 -1.421 1.00 53.41 C ATOM 1620 CE1 PHE A 108 -4.968 25.882 -0.554 1.00 23.13 C ATOM 1621 CE2 PHE A 108 -3.135 24.969 -1.787 1.00 60.34 C ATOM 1622 CZ PHE A 108 -4.443 24.885 -1.352 1.00 45.21 C ATOM 0 H PHE A 108 -1.156 28.904 -2.664 1.00 42.23 H new ATOM 0 HA PHE A 108 -3.360 29.772 -0.886 1.00 73.30 H new ATOM 0 HB2 PHE A 108 -0.968 27.967 -0.352 1.00 12.43 H new ATOM 0 HB3 PHE A 108 -2.168 28.436 0.836 1.00 12.43 H new ATOM 0 HD1 PHE A 108 -4.599 27.738 0.434 1.00 33.21 H new ATOM 0 HD2 PHE A 108 -1.331 26.109 -1.763 1.00 53.41 H new ATOM 0 HE1 PHE A 108 -5.991 25.819 -0.214 1.00 23.13 H new ATOM 0 HE2 PHE A 108 -2.723 24.191 -2.413 1.00 60.34 H new ATOM 0 HZ PHE A 108 -5.054 24.041 -1.636 1.00 45.21 H new ATOM 1632 N SER A 109 -2.090 31.731 -0.082 1.00 33.32 N ATOM 1633 CA SER A 109 -1.376 32.901 0.424 1.00 73.01 C ATOM 1634 C SER A 109 -1.498 33.007 1.942 1.00 62.34 C ATOM 1635 O SER A 109 -0.614 33.545 2.609 1.00 14.24 O ATOM 1636 CB SER A 109 -1.916 34.173 -0.233 1.00 45.41 C ATOM 1637 OG SER A 109 -1.184 35.314 0.180 1.00 51.10 O ATOM 0 H SER A 109 -3.106 31.820 -0.071 1.00 33.32 H new ATOM 0 HA SER A 109 -0.321 32.787 0.174 1.00 73.01 H new ATOM 0 HB2 SER A 109 -1.862 34.076 -1.317 1.00 45.41 H new ATOM 0 HB3 SER A 109 -2.968 34.300 0.024 1.00 45.41 H new ATOM 0 HG SER A 109 -1.549 36.112 -0.256 1.00 51.10 H new ATOM 1643 N ASP A 110 -2.597 32.485 2.481 1.00 62.34 N ATOM 1644 CA ASP A 110 -2.840 32.523 3.920 1.00 11.32 C ATOM 1645 C ASP A 110 -2.337 31.252 4.602 1.00 55.22 C ATOM 1646 O ASP A 110 -2.725 30.949 5.731 1.00 21.41 O ATOM 1647 CB ASP A 110 -4.334 32.706 4.198 1.00 3.34 C ATOM 1648 CG ASP A 110 -4.864 34.023 3.667 1.00 41.24 C ATOM 1649 OD1 ASP A 110 -4.748 35.040 4.381 1.00 44.25 O ATOM 1650 OD2 ASP A 110 -5.393 34.036 2.536 1.00 1.11 O1- ATOM 0 H ASP A 110 -3.334 32.030 1.942 1.00 62.34 H new ATOM 0 HA ASP A 110 -2.289 33.370 4.330 1.00 11.32 H new ATOM 0 HB2 ASP A 110 -4.888 31.885 3.744 1.00 3.34 H new ATOM 0 HB3 ASP A 110 -4.510 32.654 5.272 1.00 3.34 H new ATOM 1655 N LEU A 111 -1.462 30.519 3.916 1.00 60.21 N ATOM 1656 CA LEU A 111 -0.905 29.282 4.455 1.00 54.45 C ATOM 1657 C LEU A 111 0.397 29.545 5.206 1.00 1.24 C ATOM 1658 O LEU A 111 1.112 28.613 5.578 1.00 0.51 O ATOM 1659 CB LEU A 111 -0.669 28.274 3.328 1.00 14.15 C ATOM 1660 CG LEU A 111 -1.552 27.023 3.372 1.00 11.22 C ATOM 1661 CD1 LEU A 111 -1.181 26.149 4.559 1.00 12.31 C ATOM 1662 CD2 LEU A 111 -3.026 27.403 3.427 1.00 51.45 C ATOM 0 H LEU A 111 -1.124 30.762 2.985 1.00 60.21 H new ATOM 0 HA LEU A 111 -1.625 28.867 5.160 1.00 54.45 H new ATOM 0 HB2 LEU A 111 -0.828 28.777 2.374 1.00 14.15 H new ATOM 0 HB3 LEU A 111 0.375 27.963 3.354 1.00 14.15 H new ATOM 0 HG LEU A 111 -1.381 26.454 2.458 1.00 11.22 H new ATOM 0 HD11 LEU A 111 -1.819 25.265 4.574 1.00 12.31 H new ATOM 0 HD12 LEU A 111 -0.138 25.843 4.473 1.00 12.31 H new ATOM 0 HD13 LEU A 111 -1.319 26.712 5.482 1.00 12.31 H new ATOM 0 HD21 LEU A 111 -3.634 26.499 3.458 1.00 51.45 H new ATOM 0 HD22 LEU A 111 -3.215 27.998 4.320 1.00 51.45 H new ATOM 0 HD23 LEU A 111 -3.285 27.985 2.542 1.00 51.45 H new ATOM 1674 N THR A 112 0.697 30.821 5.429 1.00 23.41 N ATOM 1675 CA THR A 112 1.905 31.212 6.142 1.00 54.11 C ATOM 1676 C THR A 112 1.708 31.096 7.650 1.00 2.10 C ATOM 1677 O THR A 112 2.652 30.823 8.390 1.00 21.10 O ATOM 1678 CB THR A 112 2.317 32.657 5.802 1.00 13.41 C ATOM 1679 OG1 THR A 112 1.270 33.566 6.162 1.00 11.44 O ATOM 1680 CG2 THR A 112 2.623 32.798 4.320 1.00 73.11 C ATOM 0 H THR A 112 0.117 31.603 5.124 1.00 23.41 H new ATOM 0 HA THR A 112 2.696 30.533 5.823 1.00 54.11 H new ATOM 0 HB THR A 112 3.217 32.895 6.370 1.00 13.41 H new ATOM 0 HG1 THR A 112 1.186 34.257 5.473 1.00 11.44 H new ATOM 0 HG21 THR A 112 2.911 33.827 4.104 1.00 73.11 H new ATOM 0 HG22 THR A 112 3.440 32.128 4.052 1.00 73.11 H new ATOM 0 HG23 THR A 112 1.737 32.540 3.739 1.00 73.11 H new ATOM 1688 N SER A 113 0.469 31.300 8.094 1.00 45.01 N ATOM 1689 CA SER A 113 0.136 31.224 9.512 1.00 35.51 C ATOM 1690 C SER A 113 -0.853 30.093 9.789 1.00 63.44 C ATOM 1691 O SER A 113 -1.159 29.795 10.944 1.00 21.00 O ATOM 1692 CB SER A 113 -0.446 32.555 9.990 1.00 4.34 C ATOM 1693 OG SER A 113 -1.614 32.893 9.261 1.00 61.04 O ATOM 0 H SER A 113 -0.322 31.520 7.489 1.00 45.01 H new ATOM 0 HA SER A 113 1.054 31.015 10.061 1.00 35.51 H new ATOM 0 HB2 SER A 113 -0.682 32.491 11.052 1.00 4.34 H new ATOM 0 HB3 SER A 113 0.298 33.343 9.876 1.00 4.34 H new ATOM 0 HG SER A 113 -1.967 33.747 9.587 1.00 61.04 H new ATOM 1699 N GLN A 114 -1.349 29.466 8.725 1.00 74.03 N ATOM 1700 CA GLN A 114 -2.304 28.370 8.856 1.00 14.21 C ATOM 1701 C GLN A 114 -1.583 27.046 9.096 1.00 4.52 C ATOM 1702 O GLN A 114 -2.080 26.179 9.815 1.00 44.42 O ATOM 1703 CB GLN A 114 -3.175 28.274 7.599 1.00 22.13 C ATOM 1704 CG GLN A 114 -4.345 27.308 7.727 1.00 52.25 C ATOM 1705 CD GLN A 114 -5.380 27.766 8.737 1.00 3.41 C ATOM 1706 OE1 GLN A 114 -5.583 28.964 8.939 1.00 60.14 O ATOM 1707 NE2 GLN A 114 -6.042 26.812 9.380 1.00 70.03 N ATOM 0 H GLN A 114 -1.105 29.699 7.762 1.00 74.03 H new ATOM 0 HA GLN A 114 -2.942 28.575 9.716 1.00 14.21 H new ATOM 0 HB2 GLN A 114 -3.560 29.265 7.360 1.00 22.13 H new ATOM 0 HB3 GLN A 114 -2.551 27.964 6.760 1.00 22.13 H new ATOM 0 HG2 GLN A 114 -4.821 27.191 6.754 1.00 52.25 H new ATOM 0 HG3 GLN A 114 -3.970 26.327 8.018 1.00 52.25 H new ATOM 0 HE21 GLN A 114 -5.843 25.831 9.183 1.00 70.03 H new ATOM 0 HE22 GLN A 114 -6.750 27.060 10.072 1.00 70.03 H new ATOM 1716 N LEU A 115 -0.406 26.900 8.494 1.00 52.42 N ATOM 1717 CA LEU A 115 0.380 25.682 8.641 1.00 65.13 C ATOM 1718 C LEU A 115 1.270 25.744 9.880 1.00 44.13 C ATOM 1719 O LEU A 115 1.496 24.725 10.536 1.00 23.02 O ATOM 1720 CB LEU A 115 1.239 25.453 7.396 1.00 55.43 C ATOM 1721 CG LEU A 115 1.823 24.045 7.259 1.00 20.32 C ATOM 1722 CD1 LEU A 115 0.713 23.025 7.059 1.00 34.33 C ATOM 1723 CD2 LEU A 115 2.814 23.986 6.108 1.00 72.14 C ATOM 0 H LEU A 115 0.023 27.610 7.901 1.00 52.42 H new ATOM 0 HA LEU A 115 -0.313 24.849 8.759 1.00 65.13 H new ATOM 0 HB2 LEU A 115 0.636 25.667 6.513 1.00 55.43 H new ATOM 0 HB3 LEU A 115 2.059 26.171 7.403 1.00 55.43 H new ATOM 0 HG LEU A 115 2.353 23.802 8.180 1.00 20.32 H new ATOM 0 HD11 LEU A 115 1.147 22.029 6.963 1.00 34.33 H new ATOM 0 HD12 LEU A 115 0.040 23.047 7.916 1.00 34.33 H new ATOM 0 HD13 LEU A 115 0.156 23.266 6.154 1.00 34.33 H new ATOM 0 HD21 LEU A 115 3.218 22.977 6.027 1.00 72.14 H new ATOM 0 HD22 LEU A 115 2.309 24.250 5.179 1.00 72.14 H new ATOM 0 HD23 LEU A 115 3.627 24.689 6.291 1.00 72.14 H new ATOM 1735 N HIS A 116 1.767 26.949 10.188 1.00 52.33 N ATOM 1736 CA HIS A 116 2.641 27.175 11.345 1.00 31.20 C ATOM 1737 C HIS A 116 3.935 26.368 11.218 1.00 12.10 C ATOM 1738 O HIS A 116 4.046 25.258 11.742 1.00 23.32 O ATOM 1739 CB HIS A 116 1.913 26.828 12.652 1.00 62.35 C ATOM 1740 CG HIS A 116 2.562 27.393 13.880 1.00 60.42 C ATOM 1741 ND1 HIS A 116 2.182 28.590 14.449 1.00 74.44 N ATOM 1742 CD2 HIS A 116 3.566 26.915 14.653 1.00 14.43 C ATOM 1743 CE1 HIS A 116 2.924 28.824 15.516 1.00 12.45 C ATOM 1744 NE2 HIS A 116 3.772 27.823 15.663 1.00 21.21 N ATOM 0 H HIS A 116 1.575 27.791 9.645 1.00 52.33 H new ATOM 0 HA HIS A 116 2.902 28.233 11.369 1.00 31.20 H new ATOM 0 HB2 HIS A 116 0.888 27.195 12.594 1.00 62.35 H new ATOM 0 HB3 HIS A 116 1.858 25.744 12.749 1.00 62.35 H new ATOM 0 HD2 HIS A 116 4.105 25.991 14.503 1.00 14.43 H new ATOM 0 HE1 HIS A 116 2.850 29.688 16.160 1.00 12.45 H new ATOM 0 HE2 HIS A 116 4.467 27.738 16.405 1.00 21.21 H new ATOM 1753 N ILE A 117 4.909 26.936 10.516 1.00 32.33 N ATOM 1754 CA ILE A 117 6.191 26.271 10.310 1.00 41.30 C ATOM 1755 C ILE A 117 7.331 27.025 10.994 1.00 61.03 C ATOM 1756 O ILE A 117 7.980 27.879 10.390 1.00 53.41 O ATOM 1757 CB ILE A 117 6.506 26.107 8.806 1.00 75.52 C ATOM 1758 CG1 ILE A 117 6.120 27.371 8.028 1.00 63.13 C ATOM 1759 CG2 ILE A 117 5.781 24.893 8.244 1.00 14.04 C ATOM 1760 CD1 ILE A 117 6.610 27.377 6.596 1.00 43.34 C ATOM 0 H ILE A 117 4.836 27.855 10.080 1.00 32.33 H new ATOM 0 HA ILE A 117 6.108 25.282 10.761 1.00 41.30 H new ATOM 0 HB ILE A 117 7.580 25.954 8.695 1.00 75.52 H new ATOM 0 HG12 ILE A 117 5.035 27.472 8.032 1.00 63.13 H new ATOM 0 HG13 ILE A 117 6.523 28.242 8.544 1.00 63.13 H new ATOM 0 HG21 ILE A 117 6.012 24.790 7.184 1.00 14.04 H new ATOM 0 HG22 ILE A 117 6.105 23.998 8.775 1.00 14.04 H new ATOM 0 HG23 ILE A 117 4.706 25.021 8.370 1.00 14.04 H new ATOM 0 HD11 ILE A 117 6.299 28.301 6.109 1.00 43.34 H new ATOM 0 HD12 ILE A 117 7.698 27.308 6.583 1.00 43.34 H new ATOM 0 HD13 ILE A 117 6.186 26.526 6.063 1.00 43.34 H new ATOM 1772 N THR A 118 7.566 26.708 12.266 1.00 10.23 N ATOM 1773 CA THR A 118 8.630 27.356 13.030 1.00 54.04 C ATOM 1774 C THR A 118 9.361 26.382 13.965 1.00 61.11 C ATOM 1775 O THR A 118 10.582 26.256 13.874 1.00 11.44 O ATOM 1776 CB THR A 118 8.113 28.562 13.843 1.00 40.13 C ATOM 1777 OG1 THR A 118 6.683 28.539 13.921 1.00 12.31 O ATOM 1778 CG2 THR A 118 8.568 29.869 13.214 1.00 72.24 C ATOM 0 H THR A 118 7.036 26.009 12.787 1.00 10.23 H new ATOM 0 HA THR A 118 9.342 27.716 12.287 1.00 54.04 H new ATOM 0 HB THR A 118 8.526 28.491 14.849 1.00 40.13 H new ATOM 0 HG1 THR A 118 6.371 29.309 14.441 1.00 12.31 H new ATOM 0 HG21 THR A 118 8.193 30.706 13.803 1.00 72.24 H new ATOM 0 HG22 THR A 118 9.657 29.902 13.190 1.00 72.24 H new ATOM 0 HG23 THR A 118 8.181 29.938 12.197 1.00 72.24 H new ATOM 1786 N PRO A 119 8.649 25.676 14.881 1.00 60.12 N ATOM 1787 CA PRO A 119 9.287 24.737 15.806 1.00 64.33 C ATOM 1788 C PRO A 119 9.464 23.339 15.215 1.00 0.31 C ATOM 1789 O PRO A 119 9.898 22.415 15.905 1.00 72.22 O ATOM 1790 CB PRO A 119 8.305 24.707 16.974 1.00 11.42 C ATOM 1791 CG PRO A 119 6.965 24.928 16.359 1.00 63.35 C ATOM 1792 CD PRO A 119 7.186 25.735 15.101 1.00 63.31 C ATOM 0 HA PRO A 119 10.298 25.045 16.072 1.00 64.33 H new ATOM 0 HB2 PRO A 119 8.346 23.753 17.499 1.00 11.42 H new ATOM 0 HB3 PRO A 119 8.537 25.482 17.704 1.00 11.42 H new ATOM 0 HG2 PRO A 119 6.485 23.977 16.128 1.00 63.35 H new ATOM 0 HG3 PRO A 119 6.307 25.459 17.047 1.00 63.35 H new ATOM 0 HD2 PRO A 119 6.640 25.314 14.257 1.00 63.31 H new ATOM 0 HD3 PRO A 119 6.843 26.763 15.222 1.00 63.31 H new ATOM 1800 N GLY A 120 9.127 23.190 13.936 1.00 43.34 N ATOM 1801 CA GLY A 120 9.252 21.903 13.277 1.00 51.53 C ATOM 1802 C GLY A 120 7.935 21.156 13.215 1.00 21.50 C ATOM 1803 O GLY A 120 7.681 20.412 12.267 1.00 64.55 O ATOM 0 H GLY A 120 8.769 23.940 13.344 1.00 43.34 H new ATOM 0 HA2 GLY A 120 9.631 22.051 12.266 1.00 51.53 H new ATOM 0 HA3 GLY A 120 9.986 21.296 13.807 1.00 51.53 H new ATOM 1807 N THR A 121 7.095 21.355 14.229 1.00 61.11 N ATOM 1808 CA THR A 121 5.794 20.700 14.291 1.00 3.40 C ATOM 1809 C THR A 121 4.804 21.372 13.344 1.00 13.54 C ATOM 1810 O THR A 121 4.242 22.423 13.655 1.00 20.43 O ATOM 1811 CB THR A 121 5.221 20.718 15.723 1.00 51.22 C ATOM 1812 OG1 THR A 121 6.218 20.280 16.655 1.00 40.33 O ATOM 1813 CG2 THR A 121 3.997 19.819 15.829 1.00 3.54 C ATOM 0 H THR A 121 7.295 21.967 15.020 1.00 61.11 H new ATOM 0 HA THR A 121 5.941 19.664 13.986 1.00 3.40 H new ATOM 0 HB THR A 121 4.925 21.740 15.958 1.00 51.22 H new ATOM 0 HG1 THR A 121 5.847 20.296 17.562 1.00 40.33 H new ATOM 0 HG21 THR A 121 3.611 19.848 16.848 1.00 3.54 H new ATOM 0 HG22 THR A 121 3.228 20.168 15.140 1.00 3.54 H new ATOM 0 HG23 THR A 121 4.274 18.796 15.575 1.00 3.54 H new ATOM 1821 N ALA A 122 4.606 20.758 12.183 1.00 51.13 N ATOM 1822 CA ALA A 122 3.690 21.287 11.182 1.00 12.43 C ATOM 1823 C ALA A 122 2.889 20.169 10.525 1.00 31.34 C ATOM 1824 O ALA A 122 2.102 20.416 9.614 1.00 73.24 O ATOM 1825 CB ALA A 122 4.458 22.075 10.133 1.00 23.51 C ATOM 0 H ALA A 122 5.070 19.891 11.912 1.00 51.13 H new ATOM 0 HA ALA A 122 2.988 21.954 11.682 1.00 12.43 H new ATOM 0 HB1 ALA A 122 3.763 22.466 9.390 1.00 23.51 H new ATOM 0 HB2 ALA A 122 4.981 22.903 10.611 1.00 23.51 H new ATOM 0 HB3 ALA A 122 5.182 21.422 9.645 1.00 23.51 H new ATOM 1831 N TYR A 123 3.097 18.940 10.997 1.00 30.15 N ATOM 1832 CA TYR A 123 2.393 17.776 10.461 1.00 4.23 C ATOM 1833 C TYR A 123 0.956 17.721 10.976 1.00 30.11 C ATOM 1834 O TYR A 123 0.057 17.239 10.286 1.00 10.21 O ATOM 1835 CB TYR A 123 3.137 16.489 10.838 1.00 14.22 C ATOM 1836 CG TYR A 123 2.396 15.219 10.471 1.00 12.33 C ATOM 1837 CD1 TYR A 123 2.044 14.949 9.154 1.00 34.24 C ATOM 1838 CD2 TYR A 123 2.048 14.292 11.446 1.00 64.42 C ATOM 1839 CE1 TYR A 123 1.365 13.793 8.819 1.00 14.42 C ATOM 1840 CE2 TYR A 123 1.370 13.133 11.118 1.00 32.40 C ATOM 1841 CZ TYR A 123 1.031 12.889 9.805 1.00 61.00 C ATOM 1842 OH TYR A 123 0.355 11.737 9.476 1.00 63.11 O ATOM 0 H TYR A 123 3.749 18.725 11.751 1.00 30.15 H new ATOM 0 HA TYR A 123 2.363 17.866 9.375 1.00 4.23 H new ATOM 0 HB2 TYR A 123 4.109 16.486 10.345 1.00 14.22 H new ATOM 0 HB3 TYR A 123 3.324 16.491 11.912 1.00 14.22 H new ATOM 0 HD1 TYR A 123 2.306 15.655 8.379 1.00 34.24 H new ATOM 0 HD2 TYR A 123 2.311 14.480 12.476 1.00 64.42 H new ATOM 0 HE1 TYR A 123 1.098 13.599 7.791 1.00 14.42 H new ATOM 0 HE2 TYR A 123 1.107 12.422 11.887 1.00 32.40 H new ATOM 0 HH TYR A 123 0.286 11.665 8.501 1.00 63.11 H new ATOM 1852 N GLN A 124 0.749 18.225 12.190 1.00 40.14 N ATOM 1853 CA GLN A 124 -0.576 18.235 12.805 1.00 1.34 C ATOM 1854 C GLN A 124 -1.521 19.183 12.063 1.00 23.13 C ATOM 1855 O GLN A 124 -2.741 19.018 12.108 1.00 72.24 O ATOM 1856 CB GLN A 124 -0.467 18.641 14.277 1.00 71.22 C ATOM 1857 CG GLN A 124 -1.640 18.180 15.129 1.00 34.40 C ATOM 1858 CD GLN A 124 -1.730 16.668 15.234 1.00 44.04 C ATOM 1859 OE1 GLN A 124 -0.717 15.968 15.202 1.00 1.04 O ATOM 1860 NE2 GLN A 124 -2.949 16.157 15.359 1.00 21.23 N ATOM 0 H GLN A 124 1.483 18.633 12.769 1.00 40.14 H new ATOM 0 HA GLN A 124 -0.990 17.229 12.741 1.00 1.34 H new ATOM 0 HB2 GLN A 124 0.454 18.230 14.690 1.00 71.22 H new ATOM 0 HB3 GLN A 124 -0.388 19.726 14.340 1.00 71.22 H new ATOM 0 HG2 GLN A 124 -1.547 18.605 16.129 1.00 34.40 H new ATOM 0 HG3 GLN A 124 -2.566 18.566 14.704 1.00 34.40 H new ATOM 0 HE21 GLN A 124 -3.761 16.774 15.381 1.00 21.23 H new ATOM 0 HE22 GLN A 124 -3.074 15.147 15.433 1.00 21.23 H new ATOM 1869 N SER A 125 -0.949 20.170 11.378 1.00 13.11 N ATOM 1870 CA SER A 125 -1.736 21.137 10.620 1.00 63.44 C ATOM 1871 C SER A 125 -1.646 20.858 9.121 1.00 62.04 C ATOM 1872 O SER A 125 -2.406 21.417 8.330 1.00 11.24 O ATOM 1873 CB SER A 125 -1.256 22.560 10.915 1.00 62.23 C ATOM 1874 OG SER A 125 -1.458 22.894 12.277 1.00 20.23 O ATOM 0 H SER A 125 0.059 20.321 11.333 1.00 13.11 H new ATOM 0 HA SER A 125 -2.777 21.041 10.927 1.00 63.44 H new ATOM 0 HB2 SER A 125 -0.198 22.649 10.669 1.00 62.23 H new ATOM 0 HB3 SER A 125 -1.791 23.267 10.281 1.00 62.23 H new ATOM 0 HG SER A 125 -1.142 23.807 12.440 1.00 20.23 H new ATOM 1880 N PHE A 126 -0.714 19.986 8.739 1.00 55.24 N ATOM 1881 CA PHE A 126 -0.515 19.629 7.337 1.00 31.44 C ATOM 1882 C PHE A 126 -1.593 18.661 6.861 1.00 23.35 C ATOM 1883 O PHE A 126 -2.122 18.807 5.763 1.00 64.40 O ATOM 1884 CB PHE A 126 0.869 19.000 7.141 1.00 5.42 C ATOM 1885 CG PHE A 126 1.334 18.973 5.710 1.00 43.23 C ATOM 1886 CD1 PHE A 126 2.122 19.995 5.207 1.00 34.13 C ATOM 1887 CD2 PHE A 126 0.988 17.924 4.872 1.00 21.24 C ATOM 1888 CE1 PHE A 126 2.556 19.973 3.895 1.00 3.43 C ATOM 1889 CE2 PHE A 126 1.418 17.897 3.559 1.00 23.41 C ATOM 1890 CZ PHE A 126 2.203 18.923 3.070 1.00 41.24 C ATOM 0 H PHE A 126 -0.083 19.512 9.385 1.00 55.24 H new ATOM 0 HA PHE A 126 -0.583 20.541 6.744 1.00 31.44 H new ATOM 0 HB2 PHE A 126 1.595 19.552 7.737 1.00 5.42 H new ATOM 0 HB3 PHE A 126 0.851 17.980 7.525 1.00 5.42 H new ATOM 0 HD1 PHE A 126 2.401 20.819 5.848 1.00 34.13 H new ATOM 0 HD2 PHE A 126 0.375 17.119 5.250 1.00 21.24 H new ATOM 0 HE1 PHE A 126 3.170 20.776 3.515 1.00 3.43 H new ATOM 0 HE2 PHE A 126 1.141 17.075 2.916 1.00 23.41 H new ATOM 0 HZ PHE A 126 2.540 18.904 2.044 1.00 41.24 H new ATOM 1900 N GLU A 127 -1.918 17.683 7.705 1.00 2.20 N ATOM 1901 CA GLU A 127 -2.926 16.675 7.376 1.00 74.21 C ATOM 1902 C GLU A 127 -4.342 17.256 7.369 1.00 13.00 C ATOM 1903 O GLU A 127 -5.276 16.620 6.882 1.00 70.13 O ATOM 1904 CB GLU A 127 -2.846 15.512 8.369 1.00 62.44 C ATOM 1905 CG GLU A 127 -3.032 15.934 9.819 1.00 21.40 C ATOM 1906 CD GLU A 127 -2.921 14.771 10.785 1.00 32.20 C ATOM 1907 OE1 GLU A 127 -3.947 14.100 11.026 1.00 43.30 O ATOM 1908 OE2 GLU A 127 -1.810 14.533 11.302 1.00 50.51 O1- ATOM 0 H GLU A 127 -1.496 17.567 8.626 1.00 2.20 H new ATOM 0 HA GLU A 127 -2.713 16.317 6.369 1.00 74.21 H new ATOM 0 HB2 GLU A 127 -3.607 14.774 8.114 1.00 62.44 H new ATOM 0 HB3 GLU A 127 -1.878 15.021 8.264 1.00 62.44 H new ATOM 0 HG2 GLU A 127 -2.284 16.685 10.073 1.00 21.40 H new ATOM 0 HG3 GLU A 127 -4.008 16.405 9.934 1.00 21.40 H new ATOM 1915 N GLN A 128 -4.494 18.465 7.904 1.00 53.35 N ATOM 1916 CA GLN A 128 -5.798 19.120 7.962 1.00 70.25 C ATOM 1917 C GLN A 128 -6.059 19.966 6.717 1.00 60.34 C ATOM 1918 O GLN A 128 -7.168 19.966 6.181 1.00 75.44 O ATOM 1919 CB GLN A 128 -5.892 19.998 9.211 1.00 10.01 C ATOM 1920 CG GLN A 128 -5.828 19.217 10.516 1.00 62.21 C ATOM 1921 CD GLN A 128 -5.908 20.109 11.743 1.00 34.24 C ATOM 1922 OE1 GLN A 128 -6.427 19.704 12.783 1.00 71.43 O ATOM 1923 NE2 GLN A 128 -5.387 21.327 11.631 1.00 3.22 N ATOM 0 H GLN A 128 -3.730 19.011 8.303 1.00 53.35 H new ATOM 0 HA GLN A 128 -6.557 18.339 8.006 1.00 70.25 H new ATOM 0 HB2 GLN A 128 -5.081 20.726 9.194 1.00 10.01 H new ATOM 0 HB3 GLN A 128 -6.826 20.560 9.180 1.00 10.01 H new ATOM 0 HG2 GLN A 128 -6.645 18.496 10.543 1.00 62.21 H new ATOM 0 HG3 GLN A 128 -4.899 18.647 10.547 1.00 62.21 H new ATOM 0 HE21 GLN A 128 -4.966 21.623 10.750 1.00 3.22 H new ATOM 0 HE22 GLN A 128 -5.408 21.966 12.426 1.00 3.22 H new ATOM 1932 N VAL A 129 -5.035 20.683 6.259 1.00 52.22 N ATOM 1933 CA VAL A 129 -5.168 21.545 5.086 1.00 22.34 C ATOM 1934 C VAL A 129 -4.990 20.762 3.784 1.00 31.31 C ATOM 1935 O VAL A 129 -5.592 21.100 2.763 1.00 12.30 O ATOM 1936 CB VAL A 129 -4.156 22.712 5.125 1.00 11.54 C ATOM 1937 CG1 VAL A 129 -4.450 23.720 4.023 1.00 31.31 C ATOM 1938 CG2 VAL A 129 -4.173 23.393 6.486 1.00 52.41 C ATOM 0 H VAL A 129 -4.106 20.685 6.681 1.00 52.22 H new ATOM 0 HA VAL A 129 -6.179 21.951 5.113 1.00 22.34 H new ATOM 0 HB VAL A 129 -3.160 22.301 4.957 1.00 11.54 H new ATOM 0 HG11 VAL A 129 -3.725 24.532 4.070 1.00 31.31 H new ATOM 0 HG12 VAL A 129 -4.382 23.228 3.053 1.00 31.31 H new ATOM 0 HG13 VAL A 129 -5.454 24.122 4.156 1.00 31.31 H new ATOM 0 HG21 VAL A 129 -3.453 24.212 6.492 1.00 52.41 H new ATOM 0 HG22 VAL A 129 -5.171 23.785 6.684 1.00 52.41 H new ATOM 0 HG23 VAL A 129 -3.907 22.671 7.258 1.00 52.41 H new ATOM 1948 N VAL A 130 -4.174 19.708 3.822 1.00 21.12 N ATOM 1949 CA VAL A 130 -3.932 18.889 2.636 1.00 62.21 C ATOM 1950 C VAL A 130 -5.145 18.009 2.321 1.00 32.14 C ATOM 1951 O VAL A 130 -5.287 17.509 1.206 1.00 22.20 O ATOM 1952 CB VAL A 130 -2.666 18.009 2.795 1.00 32.44 C ATOM 1953 CG1 VAL A 130 -2.975 16.703 3.518 1.00 23.44 C ATOM 1954 CG2 VAL A 130 -2.031 17.737 1.439 1.00 2.30 C ATOM 0 H VAL A 130 -3.673 19.403 4.656 1.00 21.12 H new ATOM 0 HA VAL A 130 -3.766 19.573 1.804 1.00 62.21 H new ATOM 0 HB VAL A 130 -1.954 18.562 3.409 1.00 32.44 H new ATOM 0 HG11 VAL A 130 -2.063 16.114 3.610 1.00 23.44 H new ATOM 0 HG12 VAL A 130 -3.368 16.921 4.511 1.00 23.44 H new ATOM 0 HG13 VAL A 130 -3.715 16.139 2.950 1.00 23.44 H new ATOM 0 HG21 VAL A 130 -1.144 17.118 1.570 1.00 2.30 H new ATOM 0 HG22 VAL A 130 -2.745 17.217 0.801 1.00 2.30 H new ATOM 0 HG23 VAL A 130 -1.749 18.681 0.973 1.00 2.30 H new ATOM 1964 N ASN A 131 -6.020 17.837 3.312 1.00 62.35 N ATOM 1965 CA ASN A 131 -7.225 17.031 3.148 1.00 15.13 C ATOM 1966 C ASN A 131 -8.324 17.844 2.463 1.00 62.24 C ATOM 1967 O ASN A 131 -9.238 17.286 1.854 1.00 44.43 O ATOM 1968 CB ASN A 131 -7.707 16.532 4.512 1.00 1.33 C ATOM 1969 CG ASN A 131 -8.747 15.433 4.403 1.00 43.42 C ATOM 1970 OD1 ASN A 131 -8.728 14.633 3.467 1.00 41.44 O ATOM 1971 ND2 ASN A 131 -9.661 15.389 5.365 1.00 72.21 N ATOM 0 H ASN A 131 -5.914 18.248 4.240 1.00 62.35 H new ATOM 0 HA ASN A 131 -6.990 16.173 2.519 1.00 15.13 H new ATOM 0 HB2 ASN A 131 -6.854 16.163 5.081 1.00 1.33 H new ATOM 0 HB3 ASN A 131 -8.126 17.368 5.072 1.00 1.33 H new ATOM 0 HD21 ASN A 131 -10.386 14.672 5.347 1.00 72.21 H new ATOM 0 HD22 ASN A 131 -9.638 16.073 6.122 1.00 72.21 H new ATOM 1978 N GLU A 132 -8.218 19.169 2.564 1.00 40.21 N ATOM 1979 CA GLU A 132 -9.192 20.072 1.957 1.00 4.42 C ATOM 1980 C GLU A 132 -9.001 20.142 0.443 1.00 0.33 C ATOM 1981 O GLU A 132 -9.937 20.450 -0.296 1.00 34.43 O ATOM 1982 CB GLU A 132 -9.069 21.471 2.564 1.00 63.23 C ATOM 1983 CG GLU A 132 -9.330 21.511 4.061 1.00 31.12 C ATOM 1984 CD GLU A 132 -9.146 22.897 4.647 1.00 11.25 C ATOM 1985 OE1 GLU A 132 -10.117 23.683 4.628 1.00 5.51 O ATOM 1986 OE2 GLU A 132 -8.032 23.197 5.125 1.00 42.21 O1- ATOM 0 H GLU A 132 -7.464 19.641 3.063 1.00 40.21 H new ATOM 0 HA GLU A 132 -10.189 19.681 2.161 1.00 4.42 H new ATOM 0 HB2 GLU A 132 -8.068 21.856 2.368 1.00 63.23 H new ATOM 0 HB3 GLU A 132 -9.771 22.138 2.063 1.00 63.23 H new ATOM 0 HG2 GLU A 132 -10.346 21.169 4.258 1.00 31.12 H new ATOM 0 HG3 GLU A 132 -8.656 20.816 4.562 1.00 31.12 H new ATOM 1993 N LEU A 133 -7.782 19.860 -0.012 1.00 43.41 N ATOM 1994 CA LEU A 133 -7.473 19.881 -1.437 1.00 30.13 C ATOM 1995 C LEU A 133 -7.432 18.463 -2.006 1.00 24.24 C ATOM 1996 O LEU A 133 -7.335 18.273 -3.219 1.00 34.34 O ATOM 1997 CB LEU A 133 -6.140 20.599 -1.688 1.00 74.13 C ATOM 1998 CG LEU A 133 -4.936 20.055 -0.912 1.00 42.24 C ATOM 1999 CD1 LEU A 133 -4.112 19.114 -1.779 1.00 34.23 C ATOM 2000 CD2 LEU A 133 -4.074 21.198 -0.402 1.00 20.31 C ATOM 0 H LEU A 133 -6.993 19.615 0.587 1.00 43.41 H new ATOM 0 HA LEU A 133 -8.264 20.430 -1.948 1.00 30.13 H new ATOM 0 HB2 LEU A 133 -5.916 20.548 -2.753 1.00 74.13 H new ATOM 0 HB3 LEU A 133 -6.264 21.653 -1.439 1.00 74.13 H new ATOM 0 HG LEU A 133 -5.309 19.491 -0.057 1.00 42.24 H new ATOM 0 HD11 LEU A 133 -3.263 18.741 -1.206 1.00 34.23 H new ATOM 0 HD12 LEU A 133 -4.732 18.276 -2.097 1.00 34.23 H new ATOM 0 HD13 LEU A 133 -3.750 19.651 -2.656 1.00 34.23 H new ATOM 0 HD21 LEU A 133 -3.223 20.795 0.147 1.00 20.31 H new ATOM 0 HD22 LEU A 133 -3.715 21.788 -1.246 1.00 20.31 H new ATOM 0 HD23 LEU A 133 -4.665 21.832 0.259 1.00 20.31 H new ATOM 2012 N PHE A 134 -7.512 17.471 -1.121 1.00 54.13 N ATOM 2013 CA PHE A 134 -7.485 16.072 -1.535 1.00 63.14 C ATOM 2014 C PHE A 134 -8.885 15.461 -1.490 1.00 43.10 C ATOM 2015 O PHE A 134 -9.045 14.244 -1.591 1.00 40.33 O ATOM 2016 CB PHE A 134 -6.531 15.270 -0.646 1.00 74.12 C ATOM 2017 CG PHE A 134 -5.794 14.183 -1.379 1.00 31.43 C ATOM 2018 CD1 PHE A 134 -4.666 14.479 -2.128 1.00 50.23 C ATOM 2019 CD2 PHE A 134 -6.228 12.868 -1.321 1.00 34.14 C ATOM 2020 CE1 PHE A 134 -3.986 13.485 -2.804 1.00 42.50 C ATOM 2021 CE2 PHE A 134 -5.552 11.870 -1.996 1.00 64.34 C ATOM 2022 CZ PHE A 134 -4.429 12.178 -2.739 1.00 41.30 C ATOM 0 H PHE A 134 -7.596 17.611 -0.114 1.00 54.13 H new ATOM 0 HA PHE A 134 -7.127 16.032 -2.564 1.00 63.14 H new ATOM 0 HB2 PHE A 134 -5.806 15.950 -0.199 1.00 74.12 H new ATOM 0 HB3 PHE A 134 -7.098 14.825 0.172 1.00 74.12 H new ATOM 0 HD1 PHE A 134 -4.315 15.499 -2.184 1.00 50.23 H new ATOM 0 HD2 PHE A 134 -7.105 12.621 -0.741 1.00 34.14 H new ATOM 0 HE1 PHE A 134 -3.108 13.729 -3.383 1.00 42.50 H new ATOM 0 HE2 PHE A 134 -5.901 10.849 -1.943 1.00 64.34 H new ATOM 0 HZ PHE A 134 -3.899 11.399 -3.267 1.00 41.30 H new ATOM 2032 N ARG A 135 -9.898 16.314 -1.342 1.00 72.13 N ATOM 2033 CA ARG A 135 -11.285 15.857 -1.299 1.00 14.02 C ATOM 2034 C ARG A 135 -11.732 15.380 -2.680 1.00 12.25 C ATOM 2035 O ARG A 135 -12.592 14.507 -2.801 1.00 25.54 O ATOM 2036 CB ARG A 135 -12.207 16.975 -0.803 1.00 51.01 C ATOM 2037 CG ARG A 135 -12.060 18.279 -1.570 1.00 3.33 C ATOM 2038 CD ARG A 135 -13.217 19.224 -1.294 1.00 41.35 C ATOM 2039 NE ARG A 135 -13.033 20.514 -1.956 1.00 15.33 N ATOM 2040 CZ ARG A 135 -14.004 21.178 -2.581 1.00 70.32 C ATOM 2041 NH1 ARG A 135 -15.232 20.679 -2.634 1.00 54.21 N1+ ATOM 2042 NH2 ARG A 135 -13.745 22.344 -3.157 1.00 54.11 N ATOM 0 H ARG A 135 -9.784 17.323 -1.250 1.00 72.13 H new ATOM 0 HA ARG A 135 -11.348 15.021 -0.602 1.00 14.02 H new ATOM 0 HB2 ARG A 135 -13.241 16.638 -0.873 1.00 51.01 H new ATOM 0 HB3 ARG A 135 -12.003 17.160 0.252 1.00 51.01 H new ATOM 0 HG2 ARG A 135 -11.122 18.761 -1.293 1.00 3.33 H new ATOM 0 HG3 ARG A 135 -12.008 18.069 -2.638 1.00 3.33 H new ATOM 0 HD2 ARG A 135 -14.147 18.770 -1.635 1.00 41.35 H new ATOM 0 HD3 ARG A 135 -13.313 19.377 -0.219 1.00 41.35 H new ATOM 0 HE ARG A 135 -12.103 20.932 -1.938 1.00 15.33 H new ATOM 0 HH11 ARG A 135 -15.437 19.782 -2.195 1.00 54.21 H new ATOM 0 HH12 ARG A 135 -15.971 21.193 -3.114 1.00 54.21 H new ATOM 0 HH21 ARG A 135 -12.802 22.732 -3.121 1.00 54.11 H new ATOM 0 HH22 ARG A 135 -14.488 22.853 -3.636 1.00 54.11 H new ATOM 2056 N ASP A 136 -11.135 15.965 -3.715 1.00 34.00 N ATOM 2057 CA ASP A 136 -11.444 15.606 -5.093 1.00 23.21 C ATOM 2058 C ASP A 136 -10.194 15.078 -5.793 1.00 12.24 C ATOM 2059 O ASP A 136 -10.129 15.040 -7.022 1.00 13.01 O ATOM 2060 CB ASP A 136 -11.995 16.816 -5.853 1.00 12.15 C ATOM 2061 CG ASP A 136 -13.272 17.359 -5.240 1.00 41.24 C ATOM 2062 OD1 ASP A 136 -13.288 18.548 -4.858 1.00 31.33 O ATOM 2063 OD2 ASP A 136 -14.254 16.594 -5.138 1.00 31.34 O1- ATOM 0 H ASP A 136 -10.429 16.695 -3.622 1.00 34.00 H new ATOM 0 HA ASP A 136 -12.203 14.824 -5.083 1.00 23.21 H new ATOM 0 HB2 ASP A 136 -11.241 17.603 -5.870 1.00 12.15 H new ATOM 0 HB3 ASP A 136 -12.185 16.534 -6.889 1.00 12.15 H new ATOM 2068 N GLY A 137 -9.209 14.662 -4.995 1.00 44.32 N ATOM 2069 CA GLY A 137 -7.963 14.147 -5.540 1.00 35.12 C ATOM 2070 C GLY A 137 -8.022 12.667 -5.867 1.00 75.04 C ATOM 2071 O GLY A 137 -7.181 11.891 -5.413 1.00 42.11 O ATOM 0 H GLY A 137 -9.254 14.673 -3.976 1.00 44.32 H new ATOM 0 HA2 GLY A 137 -7.712 14.703 -6.443 1.00 35.12 H new ATOM 0 HA3 GLY A 137 -7.160 14.323 -4.824 1.00 35.12 H new ATOM 2075 N VAL A 138 -9.020 12.275 -6.655 1.00 35.22 N ATOM 2076 CA VAL A 138 -9.185 10.883 -7.057 1.00 35.12 C ATOM 2077 C VAL A 138 -8.758 10.703 -8.515 1.00 75.24 C ATOM 2078 O VAL A 138 -8.546 9.584 -8.985 1.00 74.33 O ATOM 2079 CB VAL A 138 -10.648 10.408 -6.885 1.00 14.54 C ATOM 2080 CG1 VAL A 138 -10.736 8.888 -6.949 1.00 12.53 C ATOM 2081 CG2 VAL A 138 -11.231 10.919 -5.574 1.00 54.32 C ATOM 0 H VAL A 138 -9.729 12.906 -7.029 1.00 35.22 H new ATOM 0 HA VAL A 138 -8.552 10.276 -6.409 1.00 35.12 H new ATOM 0 HB VAL A 138 -11.234 10.820 -7.707 1.00 14.54 H new ATOM 0 HG11 VAL A 138 -11.774 8.578 -6.826 1.00 12.53 H new ATOM 0 HG12 VAL A 138 -10.366 8.542 -7.914 1.00 12.53 H new ATOM 0 HG13 VAL A 138 -10.131 8.455 -6.153 1.00 12.53 H new ATOM 0 HG21 VAL A 138 -12.260 10.573 -5.474 1.00 54.32 H new ATOM 0 HG22 VAL A 138 -10.639 10.541 -4.741 1.00 54.32 H new ATOM 0 HG23 VAL A 138 -11.212 12.009 -5.568 1.00 54.32 H new ATOM 2091 N ASN A 139 -8.622 11.822 -9.221 1.00 21.43 N ATOM 2092 CA ASN A 139 -8.216 11.803 -10.621 1.00 1.11 C ATOM 2093 C ASN A 139 -6.704 11.984 -10.742 1.00 63.12 C ATOM 2094 O ASN A 139 -6.047 12.442 -9.806 1.00 35.44 O ATOM 2095 CB ASN A 139 -8.942 12.908 -11.392 1.00 32.13 C ATOM 2096 CG ASN A 139 -9.244 12.519 -12.826 1.00 40.14 C ATOM 2097 OD1 ASN A 139 -10.263 11.887 -13.107 1.00 63.25 O ATOM 2098 ND2 ASN A 139 -8.364 12.901 -13.743 1.00 74.42 N ATOM 0 H ASN A 139 -8.788 12.755 -8.844 1.00 21.43 H new ATOM 0 HA ASN A 139 -8.484 10.837 -11.048 1.00 1.11 H new ATOM 0 HB2 ASN A 139 -9.874 13.150 -10.881 1.00 32.13 H new ATOM 0 HB3 ASN A 139 -8.332 13.811 -11.386 1.00 32.13 H new ATOM 0 HD21 ASN A 139 -8.519 12.672 -14.725 1.00 74.42 H new ATOM 0 HD22 ASN A 139 -7.533 13.423 -13.466 1.00 74.42 H new ATOM 2105 N TRP A 140 -6.161 11.624 -11.903 1.00 54.33 N ATOM 2106 CA TRP A 140 -4.726 11.739 -12.157 1.00 61.13 C ATOM 2107 C TRP A 140 -4.317 13.196 -12.375 1.00 40.24 C ATOM 2108 O TRP A 140 -3.147 13.549 -12.221 1.00 42.12 O ATOM 2109 CB TRP A 140 -4.336 10.899 -13.377 1.00 54.30 C ATOM 2110 CG TRP A 140 -4.393 9.420 -13.130 1.00 12.32 C ATOM 2111 CD1 TRP A 140 -3.347 8.605 -12.801 1.00 2.44 C ATOM 2112 CD2 TRP A 140 -5.552 8.579 -13.192 1.00 0.43 C ATOM 2113 NE1 TRP A 140 -3.785 7.312 -12.653 1.00 60.20 N ATOM 2114 CE2 TRP A 140 -5.134 7.269 -12.887 1.00 11.14 C ATOM 2115 CE3 TRP A 140 -6.903 8.805 -13.473 1.00 43.34 C ATOM 2116 CZ2 TRP A 140 -6.017 6.193 -12.856 1.00 33.21 C ATOM 2117 CZ3 TRP A 140 -7.778 7.736 -13.442 1.00 62.13 C ATOM 2118 CH2 TRP A 140 -7.333 6.445 -13.135 1.00 55.42 C ATOM 0 H TRP A 140 -6.696 11.248 -12.686 1.00 54.33 H new ATOM 0 HA TRP A 140 -4.199 11.365 -11.279 1.00 61.13 H new ATOM 0 HB2 TRP A 140 -5.000 11.147 -14.205 1.00 54.30 H new ATOM 0 HB3 TRP A 140 -3.326 11.169 -13.686 1.00 54.30 H new ATOM 0 HD1 TRP A 140 -2.325 8.930 -12.676 1.00 2.44 H new ATOM 0 HE1 TRP A 140 -3.200 6.513 -12.408 1.00 60.20 H new ATOM 0 HE3 TRP A 140 -7.256 9.798 -13.710 1.00 43.34 H new ATOM 0 HZ2 TRP A 140 -5.676 5.196 -12.620 1.00 33.21 H new ATOM 0 HZ3 TRP A 140 -8.823 7.899 -13.658 1.00 62.13 H new ATOM 0 HH2 TRP A 140 -8.043 5.631 -13.118 1.00 55.42 H new ATOM 2129 N GLY A 141 -5.286 14.035 -12.731 1.00 64.25 N ATOM 2130 CA GLY A 141 -5.008 15.441 -12.959 1.00 31.02 C ATOM 2131 C GLY A 141 -5.391 16.314 -11.778 1.00 22.22 C ATOM 2132 O GLY A 141 -5.195 17.529 -11.809 1.00 14.23 O ATOM 0 H GLY A 141 -6.260 13.765 -12.866 1.00 64.25 H new ATOM 0 HA2 GLY A 141 -3.946 15.567 -13.169 1.00 31.02 H new ATOM 0 HA3 GLY A 141 -5.550 15.775 -13.843 1.00 31.02 H new ATOM 2136 N ARG A 142 -5.938 15.696 -10.733 1.00 73.43 N ATOM 2137 CA ARG A 142 -6.349 16.429 -9.538 1.00 35.51 C ATOM 2138 C ARG A 142 -5.366 16.218 -8.389 1.00 65.42 C ATOM 2139 O ARG A 142 -5.473 16.863 -7.345 1.00 75.45 O ATOM 2140 CB ARG A 142 -7.753 16.002 -9.103 1.00 24.11 C ATOM 2141 CG ARG A 142 -8.866 16.876 -9.664 1.00 21.43 C ATOM 2142 CD ARG A 142 -9.098 16.616 -11.144 1.00 70.43 C ATOM 2143 NE ARG A 142 -10.167 17.453 -11.685 1.00 22.41 N ATOM 2144 CZ ARG A 142 -11.314 16.977 -12.166 1.00 12.10 C ATOM 2145 NH1 ARG A 142 -11.550 15.671 -12.178 1.00 44.31 N1+ ATOM 2146 NH2 ARG A 142 -12.230 17.812 -12.636 1.00 70.32 N ATOM 0 H ARG A 142 -6.107 14.691 -10.690 1.00 73.43 H new ATOM 0 HA ARG A 142 -6.358 17.489 -9.790 1.00 35.51 H new ATOM 0 HB2 ARG A 142 -7.922 14.971 -9.415 1.00 24.11 H new ATOM 0 HB3 ARG A 142 -7.806 16.018 -8.014 1.00 24.11 H new ATOM 0 HG2 ARG A 142 -9.788 16.688 -9.113 1.00 21.43 H new ATOM 0 HG3 ARG A 142 -8.614 17.926 -9.515 1.00 21.43 H new ATOM 0 HD2 ARG A 142 -8.176 16.804 -11.694 1.00 70.43 H new ATOM 0 HD3 ARG A 142 -9.349 15.566 -11.293 1.00 70.43 H new ATOM 0 HE ARG A 142 -10.026 18.463 -11.695 1.00 22.41 H new ATOM 0 HH11 ARG A 142 -10.850 15.023 -11.817 1.00 44.31 H new ATOM 0 HH12 ARG A 142 -12.431 15.315 -12.548 1.00 44.31 H new ATOM 0 HH21 ARG A 142 -12.056 18.817 -12.629 1.00 70.32 H new ATOM 0 HH22 ARG A 142 -13.109 17.450 -13.005 1.00 70.32 H new ATOM 2160 N ILE A 143 -4.408 15.316 -8.585 1.00 31.43 N ATOM 2161 CA ILE A 143 -3.408 15.029 -7.562 1.00 43.20 C ATOM 2162 C ILE A 143 -2.165 15.906 -7.750 1.00 53.11 C ATOM 2163 O ILE A 143 -1.199 15.821 -6.989 1.00 4.22 O ATOM 2164 CB ILE A 143 -3.016 13.532 -7.566 1.00 72.55 C ATOM 2165 CG1 ILE A 143 -2.252 13.176 -6.287 1.00 22.11 C ATOM 2166 CG2 ILE A 143 -2.192 13.191 -8.803 1.00 61.31 C ATOM 2167 CD1 ILE A 143 -2.094 11.691 -6.062 1.00 62.43 C ATOM 0 H ILE A 143 -4.304 14.772 -9.442 1.00 31.43 H new ATOM 0 HA ILE A 143 -3.852 15.262 -6.594 1.00 43.20 H new ATOM 0 HB ILE A 143 -3.929 12.938 -7.597 1.00 72.55 H new ATOM 0 HG12 ILE A 143 -1.264 13.635 -6.326 1.00 22.11 H new ATOM 0 HG13 ILE A 143 -2.771 13.610 -5.433 1.00 22.11 H new ATOM 0 HG21 ILE A 143 -1.928 12.134 -8.784 1.00 61.31 H new ATOM 0 HG22 ILE A 143 -2.776 13.403 -9.699 1.00 61.31 H new ATOM 0 HG23 ILE A 143 -1.283 13.792 -8.811 1.00 61.31 H new ATOM 0 HD11 ILE A 143 -1.543 11.520 -5.137 1.00 62.43 H new ATOM 0 HD12 ILE A 143 -3.078 11.227 -5.989 1.00 62.43 H new ATOM 0 HD13 ILE A 143 -1.547 11.253 -6.897 1.00 62.43 H new ATOM 2179 N VAL A 144 -2.206 16.764 -8.767 1.00 42.22 N ATOM 2180 CA VAL A 144 -1.098 17.668 -9.055 1.00 70.12 C ATOM 2181 C VAL A 144 -1.029 18.778 -8.005 1.00 13.34 C ATOM 2182 O VAL A 144 0.038 19.333 -7.740 1.00 50.21 O ATOM 2183 CB VAL A 144 -1.232 18.294 -10.460 1.00 63.44 C ATOM 2184 CG1 VAL A 144 0.072 18.954 -10.882 1.00 60.24 C ATOM 2185 CG2 VAL A 144 -1.656 17.246 -11.480 1.00 34.33 C ATOM 0 H VAL A 144 -2.997 16.851 -9.406 1.00 42.22 H new ATOM 0 HA VAL A 144 -0.180 17.082 -9.025 1.00 70.12 H new ATOM 0 HB VAL A 144 -2.005 19.061 -10.417 1.00 63.44 H new ATOM 0 HG11 VAL A 144 -0.045 19.389 -11.875 1.00 60.24 H new ATOM 0 HG12 VAL A 144 0.330 19.739 -10.170 1.00 60.24 H new ATOM 0 HG13 VAL A 144 0.867 18.208 -10.904 1.00 60.24 H new ATOM 0 HG21 VAL A 144 -1.744 17.709 -12.463 1.00 34.33 H new ATOM 0 HG22 VAL A 144 -0.909 16.453 -11.519 1.00 34.33 H new ATOM 0 HG23 VAL A 144 -2.618 16.824 -11.190 1.00 34.33 H new ATOM 2195 N ALA A 145 -2.179 19.080 -7.399 1.00 72.13 N ATOM 2196 CA ALA A 145 -2.266 20.110 -6.367 1.00 54.42 C ATOM 2197 C ALA A 145 -1.697 19.610 -5.039 1.00 14.40 C ATOM 2198 O ALA A 145 -1.410 20.402 -4.140 1.00 71.23 O ATOM 2199 CB ALA A 145 -3.711 20.555 -6.192 1.00 2.45 C ATOM 0 H ALA A 145 -3.066 18.622 -7.608 1.00 72.13 H new ATOM 0 HA ALA A 145 -1.669 20.964 -6.687 1.00 54.42 H new ATOM 0 HB1 ALA A 145 -3.764 21.323 -5.420 1.00 2.45 H new ATOM 0 HB2 ALA A 145 -4.084 20.960 -7.133 1.00 2.45 H new ATOM 0 HB3 ALA A 145 -4.321 19.701 -5.897 1.00 2.45 H new ATOM 2205 N PHE A 146 -1.542 18.290 -4.926 1.00 2.20 N ATOM 2206 CA PHE A 146 -0.998 17.671 -3.719 1.00 62.11 C ATOM 2207 C PHE A 146 0.497 17.963 -3.596 1.00 64.51 C ATOM 2208 O PHE A 146 0.988 18.286 -2.513 1.00 35.24 O ATOM 2209 CB PHE A 146 -1.250 16.158 -3.750 1.00 1.14 C ATOM 2210 CG PHE A 146 -0.551 15.388 -2.661 1.00 4.25 C ATOM 2211 CD1 PHE A 146 0.527 14.567 -2.960 1.00 50.41 C ATOM 2212 CD2 PHE A 146 -0.973 15.479 -1.345 1.00 20.52 C ATOM 2213 CE1 PHE A 146 1.169 13.854 -1.967 1.00 22.33 C ATOM 2214 CE2 PHE A 146 -0.333 14.768 -0.347 1.00 10.24 C ATOM 2215 CZ PHE A 146 0.739 13.955 -0.659 1.00 73.52 C ATOM 0 H PHE A 146 -1.787 17.627 -5.661 1.00 2.20 H new ATOM 0 HA PHE A 146 -1.500 18.093 -2.849 1.00 62.11 H new ATOM 0 HB2 PHE A 146 -2.322 15.979 -3.674 1.00 1.14 H new ATOM 0 HB3 PHE A 146 -0.930 15.768 -4.716 1.00 1.14 H new ATOM 0 HD1 PHE A 146 0.868 14.485 -3.981 1.00 50.41 H new ATOM 0 HD2 PHE A 146 -1.811 16.112 -1.096 1.00 20.52 H new ATOM 0 HE1 PHE A 146 2.006 13.218 -2.213 1.00 22.33 H new ATOM 0 HE2 PHE A 146 -0.671 14.848 0.676 1.00 10.24 H new ATOM 0 HZ PHE A 146 1.240 13.399 0.119 1.00 73.52 H new ATOM 2225 N PHE A 147 1.210 17.854 -4.716 1.00 11.32 N ATOM 2226 CA PHE A 147 2.646 18.117 -4.743 1.00 1.21 C ATOM 2227 C PHE A 147 2.917 19.618 -4.769 1.00 32.03 C ATOM 2228 O PHE A 147 4.006 20.067 -4.414 1.00 20.42 O ATOM 2229 CB PHE A 147 3.291 17.441 -5.954 1.00 1.02 C ATOM 2230 CG PHE A 147 3.404 15.950 -5.814 1.00 34.05 C ATOM 2231 CD1 PHE A 147 2.439 15.114 -6.352 1.00 44.02 C ATOM 2232 CD2 PHE A 147 4.475 15.384 -5.140 1.00 43.44 C ATOM 2233 CE1 PHE A 147 2.540 13.743 -6.220 1.00 2.22 C ATOM 2234 CE2 PHE A 147 4.582 14.013 -5.006 1.00 75.23 C ATOM 2235 CZ PHE A 147 3.612 13.191 -5.546 1.00 20.24 C ATOM 0 H PHE A 147 0.815 17.585 -5.617 1.00 11.32 H new ATOM 0 HA PHE A 147 3.087 17.702 -3.837 1.00 1.21 H new ATOM 0 HB2 PHE A 147 2.706 17.672 -6.844 1.00 1.02 H new ATOM 0 HB3 PHE A 147 4.285 17.861 -6.108 1.00 1.02 H new ATOM 0 HD1 PHE A 147 1.599 15.539 -6.880 1.00 44.02 H new ATOM 0 HD2 PHE A 147 5.235 16.022 -4.714 1.00 43.44 H new ATOM 0 HE1 PHE A 147 1.781 13.102 -6.644 1.00 2.22 H new ATOM 0 HE2 PHE A 147 5.422 13.585 -4.480 1.00 75.23 H new ATOM 0 HZ PHE A 147 3.692 12.119 -5.441 1.00 20.24 H new ATOM 2245 N SER A 148 1.911 20.385 -5.189 1.00 44.32 N ATOM 2246 CA SER A 148 2.020 21.839 -5.250 1.00 41.34 C ATOM 2247 C SER A 148 1.894 22.445 -3.855 1.00 63.02 C ATOM 2248 O SER A 148 2.370 23.552 -3.602 1.00 11.15 O ATOM 2249 CB SER A 148 0.938 22.411 -6.167 1.00 15.04 C ATOM 2250 OG SER A 148 1.157 22.035 -7.514 1.00 33.54 O ATOM 0 H SER A 148 1.008 20.020 -5.493 1.00 44.32 H new ATOM 0 HA SER A 148 3.000 22.094 -5.654 1.00 41.34 H new ATOM 0 HB2 SER A 148 -0.041 22.058 -5.843 1.00 15.04 H new ATOM 0 HB3 SER A 148 0.927 23.498 -6.087 1.00 15.04 H new ATOM 0 HG SER A 148 0.792 21.139 -7.667 1.00 33.54 H new ATOM 2256 N PHE A 149 1.246 21.706 -2.955 1.00 60.53 N ATOM 2257 CA PHE A 149 1.055 22.151 -1.579 1.00 53.25 C ATOM 2258 C PHE A 149 2.327 21.925 -0.763 1.00 43.24 C ATOM 2259 O PHE A 149 2.667 22.723 0.111 1.00 32.13 O ATOM 2260 CB PHE A 149 -0.124 21.405 -0.948 1.00 71.21 C ATOM 2261 CG PHE A 149 -0.460 21.862 0.444 1.00 41.30 C ATOM 2262 CD1 PHE A 149 -1.010 23.114 0.662 1.00 34.43 C ATOM 2263 CD2 PHE A 149 -0.230 21.036 1.533 1.00 11.54 C ATOM 2264 CE1 PHE A 149 -1.322 23.534 1.939 1.00 1.15 C ATOM 2265 CE2 PHE A 149 -0.541 21.452 2.813 1.00 32.33 C ATOM 2266 CZ PHE A 149 -1.087 22.703 3.016 1.00 71.42 C ATOM 0 H PHE A 149 0.843 20.791 -3.158 1.00 60.53 H new ATOM 0 HA PHE A 149 0.835 23.219 -1.582 1.00 53.25 H new ATOM 0 HB2 PHE A 149 -1.002 21.530 -1.582 1.00 71.21 H new ATOM 0 HB3 PHE A 149 0.104 20.339 -0.925 1.00 71.21 H new ATOM 0 HD1 PHE A 149 -1.197 23.769 -0.176 1.00 34.43 H new ATOM 0 HD2 PHE A 149 0.197 20.056 1.379 1.00 11.54 H new ATOM 0 HE1 PHE A 149 -1.750 24.513 2.096 1.00 1.15 H new ATOM 0 HE2 PHE A 149 -0.357 20.799 3.654 1.00 32.33 H new ATOM 0 HZ PHE A 149 -1.330 23.031 4.016 1.00 71.42 H new ATOM 2276 N GLY A 150 3.027 20.831 -1.061 1.00 53.35 N ATOM 2277 CA GLY A 150 4.259 20.518 -0.359 1.00 14.43 C ATOM 2278 C GLY A 150 5.442 21.300 -0.899 1.00 20.20 C ATOM 2279 O GLY A 150 6.463 21.440 -0.225 1.00 21.02 O ATOM 0 H GLY A 150 2.761 20.156 -1.778 1.00 53.35 H new ATOM 0 HA2 GLY A 150 4.136 20.736 0.702 1.00 14.43 H new ATOM 0 HA3 GLY A 150 4.462 19.450 -0.444 1.00 14.43 H new ATOM 2283 N GLY A 151 5.300 21.812 -2.120 1.00 22.22 N ATOM 2284 CA GLY A 151 6.362 22.586 -2.737 1.00 54.03 C ATOM 2285 C GLY A 151 6.079 24.076 -2.715 1.00 31.24 C ATOM 2286 O GLY A 151 6.485 24.806 -3.620 1.00 21.32 O ATOM 0 H GLY A 151 4.464 21.703 -2.694 1.00 22.22 H new ATOM 0 HA2 GLY A 151 7.300 22.389 -2.218 1.00 54.03 H new ATOM 0 HA3 GLY A 151 6.494 22.259 -3.768 1.00 54.03 H new ATOM 2290 N ALA A 152 5.380 24.525 -1.677 1.00 51.32 N ATOM 2291 CA ALA A 152 5.038 25.935 -1.529 1.00 32.42 C ATOM 2292 C ALA A 152 5.753 26.550 -0.329 1.00 3.21 C ATOM 2293 O ALA A 152 5.904 27.768 -0.241 1.00 11.44 O ATOM 2294 CB ALA A 152 3.532 26.098 -1.388 1.00 63.13 C ATOM 0 H ALA A 152 5.038 23.929 -0.923 1.00 51.32 H new ATOM 0 HA ALA A 152 5.369 26.461 -2.425 1.00 32.42 H new ATOM 0 HB1 ALA A 152 3.289 27.155 -1.278 1.00 63.13 H new ATOM 0 HB2 ALA A 152 3.039 25.703 -2.276 1.00 63.13 H new ATOM 0 HB3 ALA A 152 3.188 25.553 -0.509 1.00 63.13 H new ATOM 2300 N LEU A 153 6.197 25.696 0.590 1.00 32.11 N ATOM 2301 CA LEU A 153 6.898 26.149 1.789 1.00 31.34 C ATOM 2302 C LEU A 153 8.410 26.122 1.573 1.00 2.33 C ATOM 2303 O LEU A 153 9.186 26.134 2.529 1.00 22.33 O ATOM 2304 CB LEU A 153 6.531 25.272 2.996 1.00 45.23 C ATOM 2305 CG LEU A 153 5.064 25.321 3.452 1.00 11.41 C ATOM 2306 CD1 LEU A 153 4.526 26.743 3.414 1.00 2.13 C ATOM 2307 CD2 LEU A 153 4.199 24.396 2.607 1.00 42.32 C ATOM 0 H LEU A 153 6.083 24.684 0.527 1.00 32.11 H new ATOM 0 HA LEU A 153 6.589 27.175 1.991 1.00 31.34 H new ATOM 0 HB2 LEU A 153 6.781 24.238 2.756 1.00 45.23 H new ATOM 0 HB3 LEU A 153 7.160 25.565 3.836 1.00 45.23 H new ATOM 0 HG LEU A 153 5.026 24.973 4.484 1.00 11.41 H new ATOM 0 HD11 LEU A 153 3.486 26.748 3.742 1.00 2.13 H new ATOM 0 HD12 LEU A 153 5.118 27.374 4.077 1.00 2.13 H new ATOM 0 HD13 LEU A 153 4.587 27.128 2.396 1.00 2.13 H new ATOM 0 HD21 LEU A 153 3.166 24.450 2.950 1.00 42.32 H new ATOM 0 HD22 LEU A 153 4.251 24.703 1.562 1.00 42.32 H new ATOM 0 HD23 LEU A 153 4.560 23.372 2.702 1.00 42.32 H new ATOM 2319 N CYS A 154 8.817 26.095 0.305 1.00 22.54 N ATOM 2320 CA CYS A 154 10.231 26.063 -0.055 1.00 61.42 C ATOM 2321 C CYS A 154 10.855 27.454 0.014 1.00 64.22 C ATOM 2322 O CYS A 154 12.077 27.592 0.064 1.00 65.43 O ATOM 2323 CB CYS A 154 10.398 25.486 -1.461 1.00 71.15 C ATOM 2324 SG CYS A 154 9.435 26.340 -2.732 1.00 10.33 S ATOM 0 H CYS A 154 8.182 26.095 -0.493 1.00 22.54 H new ATOM 0 HA CYS A 154 10.747 25.426 0.664 1.00 61.42 H new ATOM 0 HB2 CYS A 154 11.453 25.523 -1.734 1.00 71.15 H new ATOM 0 HB3 CYS A 154 10.109 24.435 -1.447 1.00 71.15 H new ATOM 0 HG CYS A 154 8.341 25.678 -2.966 1.00 10.33 H new ATOM 2330 N VAL A 155 10.011 28.483 0.011 1.00 23.04 N ATOM 2331 CA VAL A 155 10.484 29.861 0.077 1.00 44.04 C ATOM 2332 C VAL A 155 10.401 30.403 1.502 1.00 23.14 C ATOM 2333 O VAL A 155 11.057 31.390 1.840 1.00 14.41 O ATOM 2334 CB VAL A 155 9.691 30.781 -0.872 1.00 33.00 C ATOM 2335 CG1 VAL A 155 9.985 30.425 -2.320 1.00 31.42 C ATOM 2336 CG2 VAL A 155 8.196 30.697 -0.591 1.00 51.41 C ATOM 0 H VAL A 155 8.997 28.387 -0.036 1.00 23.04 H new ATOM 0 HA VAL A 155 11.527 29.853 -0.241 1.00 44.04 H new ATOM 0 HB VAL A 155 10.008 31.809 -0.695 1.00 33.00 H new ATOM 0 HG11 VAL A 155 9.418 31.083 -2.979 1.00 31.42 H new ATOM 0 HG12 VAL A 155 11.050 30.546 -2.515 1.00 31.42 H new ATOM 0 HG13 VAL A 155 9.698 29.390 -2.506 1.00 31.42 H new ATOM 0 HG21 VAL A 155 7.660 31.356 -1.274 1.00 51.41 H new ATOM 0 HG22 VAL A 155 7.856 29.671 -0.734 1.00 51.41 H new ATOM 0 HG23 VAL A 155 8.001 31.004 0.437 1.00 51.41 H new ATOM 2346 N GLU A 156 9.593 29.749 2.334 1.00 62.51 N ATOM 2347 CA GLU A 156 9.433 30.153 3.726 1.00 15.51 C ATOM 2348 C GLU A 156 10.489 29.486 4.601 1.00 32.42 C ATOM 2349 O GLU A 156 10.683 29.864 5.758 1.00 14.41 O ATOM 2350 CB GLU A 156 8.031 29.806 4.229 1.00 12.22 C ATOM 2351 CG GLU A 156 6.941 30.689 3.642 1.00 20.13 C ATOM 2352 CD GLU A 156 5.583 30.437 4.266 1.00 71.11 C ATOM 2353 OE1 GLU A 156 5.431 30.685 5.481 1.00 11.52 O ATOM 2354 OE2 GLU A 156 4.668 29.999 3.538 1.00 0.55 O1- ATOM 0 H GLU A 156 9.039 28.936 2.066 1.00 62.51 H new ATOM 0 HA GLU A 156 9.564 31.233 3.786 1.00 15.51 H new ATOM 0 HB2 GLU A 156 7.814 28.765 3.988 1.00 12.22 H new ATOM 0 HB3 GLU A 156 8.012 29.892 5.315 1.00 12.22 H new ATOM 0 HG2 GLU A 156 7.212 31.735 3.783 1.00 20.13 H new ATOM 0 HG3 GLU A 156 6.880 30.517 2.567 1.00 20.13 H new ATOM 2361 N SER A 157 11.170 28.490 4.035 1.00 45.42 N ATOM 2362 CA SER A 157 12.222 27.773 4.746 1.00 1.41 C ATOM 2363 C SER A 157 13.553 28.508 4.606 1.00 64.54 C ATOM 2364 O SER A 157 14.550 28.137 5.224 1.00 24.21 O ATOM 2365 CB SER A 157 12.350 26.343 4.214 1.00 1.31 C ATOM 2366 OG SER A 157 12.674 26.336 2.835 1.00 12.43 O ATOM 0 H SER A 157 11.009 28.162 3.083 1.00 45.42 H new ATOM 0 HA SER A 157 11.956 27.728 5.802 1.00 1.41 H new ATOM 0 HB2 SER A 157 13.120 25.812 4.774 1.00 1.31 H new ATOM 0 HB3 SER A 157 11.414 25.808 4.373 1.00 1.31 H new ATOM 0 HG SER A 157 12.751 25.411 2.522 1.00 12.43 H new ATOM 2372 N VAL A 158 13.556 29.549 3.776 1.00 63.31 N ATOM 2373 CA VAL A 158 14.749 30.356 3.552 1.00 40.11 C ATOM 2374 C VAL A 158 14.555 31.754 4.139 1.00 3.02 C ATOM 2375 O VAL A 158 15.516 32.500 4.332 1.00 52.11 O ATOM 2376 CB VAL A 158 15.084 30.480 2.048 1.00 34.21 C ATOM 2377 CG1 VAL A 158 16.558 30.803 1.852 1.00 14.34 C ATOM 2378 CG2 VAL A 158 14.712 29.210 1.298 1.00 34.44 C ATOM 0 H VAL A 158 12.740 29.853 3.246 1.00 63.31 H new ATOM 0 HA VAL A 158 15.579 29.853 4.048 1.00 40.11 H new ATOM 0 HB VAL A 158 14.493 31.299 1.639 1.00 34.21 H new ATOM 0 HG11 VAL A 158 16.774 30.886 0.787 1.00 14.34 H new ATOM 0 HG12 VAL A 158 16.792 31.747 2.344 1.00 14.34 H new ATOM 0 HG13 VAL A 158 17.165 30.008 2.284 1.00 14.34 H new ATOM 0 HG21 VAL A 158 14.959 29.325 0.243 1.00 34.44 H new ATOM 0 HG22 VAL A 158 15.268 28.368 1.711 1.00 34.44 H new ATOM 0 HG23 VAL A 158 13.643 29.025 1.403 1.00 34.44 H new ATOM 2388 N ASP A 159 13.295 32.095 4.424 1.00 12.13 N ATOM 2389 CA ASP A 159 12.949 33.396 4.992 1.00 21.34 C ATOM 2390 C ASP A 159 13.514 33.538 6.405 1.00 45.21 C ATOM 2391 O ASP A 159 14.201 34.512 6.714 1.00 12.42 O ATOM 2392 CB ASP A 159 11.427 33.572 5.009 1.00 61.11 C ATOM 2393 CG ASP A 159 11.001 34.946 5.491 1.00 53.33 C ATOM 2394 OD1 ASP A 159 10.600 35.065 6.669 1.00 4.41 O ATOM 2395 OD2 ASP A 159 11.066 35.902 4.691 1.00 41.43 O1- ATOM 0 H ASP A 159 12.495 31.482 4.268 1.00 12.13 H new ATOM 0 HA ASP A 159 13.390 34.174 4.369 1.00 21.34 H new ATOM 0 HB2 ASP A 159 11.035 33.406 4.006 1.00 61.11 H new ATOM 0 HB3 ASP A 159 10.985 32.812 5.654 1.00 61.11 H new ATOM 2400 N LYS A 160 13.219 32.558 7.256 1.00 11.13 N ATOM 2401 CA LYS A 160 13.708 32.561 8.631 1.00 64.02 C ATOM 2402 C LYS A 160 14.930 31.657 8.768 1.00 30.45 C ATOM 2403 O LYS A 160 15.481 31.505 9.861 1.00 60.11 O ATOM 2404 CB LYS A 160 12.610 32.099 9.589 1.00 1.33 C ATOM 2405 CG LYS A 160 11.511 33.126 9.804 1.00 4.22 C ATOM 2406 CD LYS A 160 10.459 32.624 10.783 1.00 42.21 C ATOM 2407 CE LYS A 160 11.011 32.507 12.198 1.00 13.43 C ATOM 2408 NZ LYS A 160 11.535 33.807 12.704 1.00 74.41 N1+ ATOM 0 H LYS A 160 12.643 31.751 7.016 1.00 11.13 H new ATOM 0 HA LYS A 160 13.995 33.581 8.888 1.00 64.02 H new ATOM 0 HB2 LYS A 160 12.166 31.181 9.203 1.00 1.33 H new ATOM 0 HB3 LYS A 160 13.060 31.855 10.551 1.00 1.33 H new ATOM 0 HG2 LYS A 160 11.946 34.052 10.180 1.00 4.22 H new ATOM 0 HG3 LYS A 160 11.039 33.360 8.850 1.00 4.22 H new ATOM 0 HD2 LYS A 160 9.607 33.304 10.781 1.00 42.21 H new ATOM 0 HD3 LYS A 160 10.092 31.652 10.455 1.00 42.21 H new ATOM 0 HE2 LYS A 160 10.226 32.149 12.864 1.00 13.43 H new ATOM 0 HE3 LYS A 160 11.808 31.764 12.216 1.00 13.43 H new ATOM 0 HZ1 LYS A 160 11.615 33.769 13.740 1.00 74.41 H new ATOM 0 HZ2 LYS A 160 12.472 33.988 12.291 1.00 74.41 H new ATOM 0 HZ3 LYS A 160 10.884 34.572 12.435 1.00 74.41 H new ATOM 2422 N GLU A 161 15.338 31.064 7.641 1.00 71.31 N ATOM 2423 CA GLU A 161 16.490 30.163 7.581 1.00 20.23 C ATOM 2424 C GLU A 161 16.284 28.931 8.462 1.00 72.33 C ATOM 2425 O GLU A 161 16.768 28.865 9.594 1.00 44.00 O ATOM 2426 CB GLU A 161 17.784 30.892 7.968 1.00 1.23 C ATOM 2427 CG GLU A 161 19.048 30.111 7.639 1.00 54.31 C ATOM 2428 CD GLU A 161 19.153 29.760 6.166 1.00 52.11 C ATOM 2429 OE1 GLU A 161 18.763 28.633 5.795 1.00 22.53 O ATOM 2430 OE2 GLU A 161 19.624 30.613 5.385 1.00 51.41 O1- ATOM 0 H GLU A 161 14.875 31.197 6.742 1.00 71.31 H new ATOM 0 HA GLU A 161 16.583 29.825 6.549 1.00 20.23 H new ATOM 0 HB2 GLU A 161 17.817 31.853 7.454 1.00 1.23 H new ATOM 0 HB3 GLU A 161 17.766 31.103 9.037 1.00 1.23 H new ATOM 0 HG2 GLU A 161 19.919 30.697 7.932 1.00 54.31 H new ATOM 0 HG3 GLU A 161 19.068 29.195 8.229 1.00 54.31 H new ATOM 2437 N MET A 162 15.549 27.961 7.930 1.00 44.15 N ATOM 2438 CA MET A 162 15.275 26.720 8.642 1.00 73.01 C ATOM 2439 C MET A 162 15.437 25.523 7.709 1.00 60.45 C ATOM 2440 O MET A 162 14.521 25.164 6.965 1.00 1.01 O ATOM 2441 CB MET A 162 13.869 26.743 9.257 1.00 1.23 C ATOM 2442 CG MET A 162 12.806 27.354 8.355 1.00 15.50 C ATOM 2443 SD MET A 162 11.187 27.444 9.145 1.00 71.12 S ATOM 2444 CE MET A 162 11.542 28.514 10.537 1.00 73.54 C ATOM 0 H MET A 162 15.130 28.012 7.001 1.00 44.15 H new ATOM 0 HA MET A 162 15.996 26.624 9.453 1.00 73.01 H new ATOM 0 HB2 MET A 162 13.576 25.723 9.506 1.00 1.23 H new ATOM 0 HB3 MET A 162 13.902 27.302 10.192 1.00 1.23 H new ATOM 0 HG2 MET A 162 13.118 28.356 8.061 1.00 15.50 H new ATOM 0 HG3 MET A 162 12.727 26.764 7.442 1.00 15.50 H new ATOM 0 HE1 MET A 162 10.678 29.147 10.739 1.00 73.54 H new ATOM 0 HE2 MET A 162 11.761 27.907 11.416 1.00 73.54 H new ATOM 0 HE3 MET A 162 12.403 29.140 10.304 1.00 73.54 H new ATOM 2454 N GLN A 163 16.619 24.916 7.749 1.00 24.22 N ATOM 2455 CA GLN A 163 16.919 23.761 6.909 1.00 61.45 C ATOM 2456 C GLN A 163 16.378 22.473 7.526 1.00 64.20 C ATOM 2457 O GLN A 163 16.321 21.436 6.864 1.00 74.23 O ATOM 2458 CB GLN A 163 18.428 23.654 6.672 1.00 74.13 C ATOM 2459 CG GLN A 163 19.261 23.712 7.942 1.00 15.51 C ATOM 2460 CD GLN A 163 20.696 24.117 7.670 1.00 30.44 C ATOM 2461 OE1 GLN A 163 21.028 25.302 7.667 1.00 62.41 O ATOM 2462 NE2 GLN A 163 21.555 23.133 7.437 1.00 71.13 N ATOM 0 H GLN A 163 17.386 25.205 8.355 1.00 24.22 H new ATOM 0 HA GLN A 163 16.423 23.903 5.949 1.00 61.45 H new ATOM 0 HB2 GLN A 163 18.638 22.718 6.155 1.00 74.13 H new ATOM 0 HB3 GLN A 163 18.739 24.461 6.009 1.00 74.13 H new ATOM 0 HG2 GLN A 163 18.811 24.421 8.637 1.00 15.51 H new ATOM 0 HG3 GLN A 163 19.247 22.737 8.428 1.00 15.51 H new ATOM 0 HE21 GLN A 163 21.236 22.164 7.449 1.00 71.13 H new ATOM 0 HE22 GLN A 163 22.534 23.345 7.246 1.00 71.13 H new ATOM 2471 N VAL A 164 15.978 22.549 8.795 1.00 72.04 N ATOM 2472 CA VAL A 164 15.420 21.397 9.496 1.00 23.43 C ATOM 2473 C VAL A 164 14.003 21.108 8.992 1.00 40.03 C ATOM 2474 O VAL A 164 13.530 19.973 9.042 1.00 42.33 O ATOM 2475 CB VAL A 164 15.403 21.623 11.029 1.00 13.21 C ATOM 2476 CG1 VAL A 164 14.551 22.830 11.397 1.00 10.33 C ATOM 2477 CG2 VAL A 164 14.920 20.377 11.761 1.00 5.43 C ATOM 0 H VAL A 164 16.031 23.398 9.358 1.00 72.04 H new ATOM 0 HA VAL A 164 16.058 20.538 9.289 1.00 23.43 H new ATOM 0 HB VAL A 164 16.426 21.825 11.345 1.00 13.21 H new ATOM 0 HG11 VAL A 164 14.558 22.964 12.479 1.00 10.33 H new ATOM 0 HG12 VAL A 164 14.957 23.721 10.918 1.00 10.33 H new ATOM 0 HG13 VAL A 164 13.528 22.670 11.058 1.00 10.33 H new ATOM 0 HG21 VAL A 164 14.918 20.564 12.835 1.00 5.43 H new ATOM 0 HG22 VAL A 164 13.910 20.131 11.434 1.00 5.43 H new ATOM 0 HG23 VAL A 164 15.586 19.543 11.539 1.00 5.43 H new ATOM 2487 N LEU A 165 13.345 22.150 8.482 1.00 11.00 N ATOM 2488 CA LEU A 165 11.992 22.031 7.952 1.00 54.21 C ATOM 2489 C LEU A 165 12.005 21.355 6.583 1.00 41.30 C ATOM 2490 O LEU A 165 11.022 20.740 6.175 1.00 30.23 O ATOM 2491 CB LEU A 165 11.351 23.416 7.843 1.00 22.24 C ATOM 2492 CG LEU A 165 9.895 23.427 7.372 1.00 24.21 C ATOM 2493 CD1 LEU A 165 8.973 22.909 8.466 1.00 43.24 C ATOM 2494 CD2 LEU A 165 9.488 24.828 6.945 1.00 5.12 C ATOM 0 H LEU A 165 13.734 23.091 8.426 1.00 11.00 H new ATOM 0 HA LEU A 165 11.407 21.416 8.635 1.00 54.21 H new ATOM 0 HB2 LEU A 165 11.404 23.901 8.818 1.00 22.24 H new ATOM 0 HB3 LEU A 165 11.943 24.019 7.155 1.00 22.24 H new ATOM 0 HG LEU A 165 9.805 22.764 6.511 1.00 24.21 H new ATOM 0 HD11 LEU A 165 7.943 22.925 8.111 1.00 43.24 H new ATOM 0 HD12 LEU A 165 9.252 21.887 8.724 1.00 43.24 H new ATOM 0 HD13 LEU A 165 9.063 23.543 9.348 1.00 43.24 H new ATOM 0 HD21 LEU A 165 8.450 24.820 6.613 1.00 5.12 H new ATOM 0 HD22 LEU A 165 9.594 25.510 7.788 1.00 5.12 H new ATOM 0 HD23 LEU A 165 10.128 25.160 6.128 1.00 5.12 H new ATOM 2506 N VAL A 166 13.131 21.475 5.884 1.00 1.44 N ATOM 2507 CA VAL A 166 13.286 20.884 4.558 1.00 34.13 C ATOM 2508 C VAL A 166 13.560 19.382 4.651 1.00 22.41 C ATOM 2509 O VAL A 166 13.201 18.616 3.755 1.00 71.24 O ATOM 2510 CB VAL A 166 14.437 21.559 3.779 1.00 61.42 C ATOM 2511 CG1 VAL A 166 14.438 21.116 2.323 1.00 52.35 C ATOM 2512 CG2 VAL A 166 14.340 23.074 3.880 1.00 62.24 C ATOM 0 H VAL A 166 13.953 21.979 6.216 1.00 1.44 H new ATOM 0 HA VAL A 166 12.349 21.045 4.025 1.00 34.13 H new ATOM 0 HB VAL A 166 15.379 21.247 4.229 1.00 61.42 H new ATOM 0 HG11 VAL A 166 15.257 21.604 1.795 1.00 52.35 H new ATOM 0 HG12 VAL A 166 14.566 20.035 2.272 1.00 52.35 H new ATOM 0 HG13 VAL A 166 13.491 21.391 1.858 1.00 52.35 H new ATOM 0 HG21 VAL A 166 15.160 23.529 3.324 1.00 62.24 H new ATOM 0 HG22 VAL A 166 13.390 23.406 3.462 1.00 62.24 H new ATOM 0 HG23 VAL A 166 14.400 23.374 4.926 1.00 62.24 H new ATOM 2522 N SER A 167 14.185 18.965 5.750 1.00 65.41 N ATOM 2523 CA SER A 167 14.513 17.558 5.959 1.00 54.41 C ATOM 2524 C SER A 167 13.340 16.789 6.570 1.00 30.23 C ATOM 2525 O SER A 167 13.454 15.594 6.850 1.00 51.44 O ATOM 2526 CB SER A 167 15.745 17.433 6.859 1.00 60.24 C ATOM 2527 OG SER A 167 15.509 18.006 8.133 1.00 60.50 O ATOM 0 H SER A 167 14.474 19.582 6.509 1.00 65.41 H new ATOM 0 HA SER A 167 14.728 17.120 4.984 1.00 54.41 H new ATOM 0 HB2 SER A 167 16.010 16.382 6.974 1.00 60.24 H new ATOM 0 HB3 SER A 167 16.595 17.926 6.387 1.00 60.24 H new ATOM 0 HG SER A 167 14.668 18.509 8.115 1.00 60.50 H new ATOM 2533 N ARG A 168 12.215 17.472 6.772 1.00 53.43 N ATOM 2534 CA ARG A 168 11.035 16.838 7.351 1.00 2.12 C ATOM 2535 C ARG A 168 9.777 17.146 6.539 1.00 54.24 C ATOM 2536 O ARG A 168 8.708 16.600 6.814 1.00 40.52 O ATOM 2537 CB ARG A 168 10.849 17.289 8.804 1.00 74.33 C ATOM 2538 CG ARG A 168 10.468 18.754 8.950 1.00 13.34 C ATOM 2539 CD ARG A 168 10.616 19.232 10.386 1.00 12.20 C ATOM 2540 NE ARG A 168 9.862 18.405 11.325 1.00 40.14 N ATOM 2541 CZ ARG A 168 10.207 18.230 12.599 1.00 63.01 C ATOM 2542 NH1 ARG A 168 11.291 18.820 13.087 1.00 32.13 N1+ ATOM 2543 NH2 ARG A 168 9.465 17.464 13.387 1.00 4.11 N ATOM 0 H ARG A 168 12.097 18.459 6.544 1.00 53.43 H new ATOM 0 HA ARG A 168 11.192 15.760 7.328 1.00 2.12 H new ATOM 0 HB2 ARG A 168 10.078 16.675 9.269 1.00 74.33 H new ATOM 0 HB3 ARG A 168 11.774 17.108 9.352 1.00 74.33 H new ATOM 0 HG2 ARG A 168 11.096 19.360 8.298 1.00 13.34 H new ATOM 0 HG3 ARG A 168 9.438 18.897 8.623 1.00 13.34 H new ATOM 0 HD2 ARG A 168 11.670 19.223 10.663 1.00 12.20 H new ATOM 0 HD3 ARG A 168 10.275 20.265 10.460 1.00 12.20 H new ATOM 0 HE ARG A 168 9.023 17.935 10.985 1.00 40.14 H new ATOM 0 HH11 ARG A 168 11.865 19.411 12.485 1.00 32.13 H new ATOM 0 HH12 ARG A 168 11.551 18.682 14.064 1.00 32.13 H new ATOM 0 HH21 ARG A 168 8.630 17.009 13.017 1.00 4.11 H new ATOM 0 HH22 ARG A 168 9.729 17.330 14.363 1.00 4.11 H new ATOM 2557 N ILE A 169 9.908 18.014 5.535 1.00 23.34 N ATOM 2558 CA ILE A 169 8.773 18.385 4.694 1.00 34.51 C ATOM 2559 C ILE A 169 8.468 17.288 3.669 1.00 22.24 C ATOM 2560 O ILE A 169 7.346 17.179 3.175 1.00 44.21 O ATOM 2561 CB ILE A 169 9.015 19.736 3.975 1.00 35.12 C ATOM 2562 CG1 ILE A 169 7.704 20.278 3.394 1.00 13.21 C ATOM 2563 CG2 ILE A 169 10.068 19.595 2.881 1.00 24.50 C ATOM 2564 CD1 ILE A 169 7.807 21.701 2.885 1.00 21.34 C ATOM 0 H ILE A 169 10.785 18.471 5.286 1.00 23.34 H new ATOM 0 HA ILE A 169 7.910 18.500 5.349 1.00 34.51 H new ATOM 0 HB ILE A 169 9.389 20.447 4.711 1.00 35.12 H new ATOM 0 HG12 ILE A 169 7.384 19.631 2.577 1.00 13.21 H new ATOM 0 HG13 ILE A 169 6.930 20.230 4.160 1.00 13.21 H new ATOM 0 HG21 ILE A 169 10.217 20.558 2.393 1.00 24.50 H new ATOM 0 HG22 ILE A 169 11.008 19.262 3.321 1.00 24.50 H new ATOM 0 HG23 ILE A 169 9.733 18.864 2.145 1.00 24.50 H new ATOM 0 HD11 ILE A 169 6.842 22.016 2.489 1.00 21.34 H new ATOM 0 HD12 ILE A 169 8.096 22.360 3.703 1.00 21.34 H new ATOM 0 HD13 ILE A 169 8.557 21.752 2.096 1.00 21.34 H new ATOM 2576 N ALA A 170 9.475 16.470 3.366 1.00 32.15 N ATOM 2577 CA ALA A 170 9.313 15.376 2.416 1.00 73.20 C ATOM 2578 C ALA A 170 8.975 14.077 3.143 1.00 4.01 C ATOM 2579 O ALA A 170 8.799 13.031 2.519 1.00 62.31 O ATOM 2580 CB ALA A 170 10.575 15.207 1.581 1.00 14.01 C ATOM 0 H ALA A 170 10.410 16.546 3.766 1.00 32.15 H new ATOM 0 HA ALA A 170 8.486 15.620 1.749 1.00 73.20 H new ATOM 0 HB1 ALA A 170 10.438 14.386 0.877 1.00 14.01 H new ATOM 0 HB2 ALA A 170 10.774 16.127 1.032 1.00 14.01 H new ATOM 0 HB3 ALA A 170 11.418 14.986 2.236 1.00 14.01 H new ATOM 2586 N ALA A 171 8.884 14.159 4.470 1.00 0.42 N ATOM 2587 CA ALA A 171 8.564 13.000 5.295 1.00 51.34 C ATOM 2588 C ALA A 171 7.058 12.769 5.353 1.00 22.10 C ATOM 2589 O ALA A 171 6.594 11.632 5.277 1.00 62.35 O ATOM 2590 CB ALA A 171 9.130 13.175 6.697 1.00 4.32 C ATOM 0 H ALA A 171 9.028 15.021 4.996 1.00 0.42 H new ATOM 0 HA ALA A 171 9.023 12.122 4.840 1.00 51.34 H new ATOM 0 HB1 ALA A 171 8.883 12.302 7.301 1.00 4.32 H new ATOM 0 HB2 ALA A 171 10.213 13.283 6.641 1.00 4.32 H new ATOM 0 HB3 ALA A 171 8.700 14.066 7.154 1.00 4.32 H new ATOM 2596 N TRP A 172 6.298 13.854 5.486 1.00 33.33 N ATOM 2597 CA TRP A 172 4.842 13.760 5.544 1.00 74.00 C ATOM 2598 C TRP A 172 4.223 13.943 4.158 1.00 12.01 C ATOM 2599 O TRP A 172 3.008 14.094 4.022 1.00 42.00 O ATOM 2600 CB TRP A 172 4.266 14.784 6.533 1.00 34.11 C ATOM 2601 CG TRP A 172 4.758 16.192 6.342 1.00 62.31 C ATOM 2602 CD1 TRP A 172 4.607 16.975 5.234 1.00 71.03 C ATOM 2603 CD2 TRP A 172 5.462 16.991 7.302 1.00 55.35 C ATOM 2604 NE1 TRP A 172 5.181 18.205 5.442 1.00 0.01 N ATOM 2605 CE2 TRP A 172 5.710 18.241 6.704 1.00 53.41 C ATOM 2606 CE3 TRP A 172 5.909 16.771 8.609 1.00 72.15 C ATOM 2607 CZ2 TRP A 172 6.383 19.265 7.368 1.00 74.34 C ATOM 2608 CZ3 TRP A 172 6.576 17.788 9.266 1.00 52.31 C ATOM 2609 CH2 TRP A 172 6.806 19.021 8.645 1.00 5.14 C ATOM 0 H TRP A 172 6.664 14.803 5.555 1.00 33.33 H new ATOM 0 HA TRP A 172 4.587 12.761 5.899 1.00 74.00 H new ATOM 0 HB2 TRP A 172 3.179 14.779 6.447 1.00 34.11 H new ATOM 0 HB3 TRP A 172 4.507 14.464 7.547 1.00 34.11 H new ATOM 0 HD1 TRP A 172 4.108 16.671 4.325 1.00 71.03 H new ATOM 0 HE1 TRP A 172 5.209 18.968 4.766 1.00 0.01 H new ATOM 0 HE3 TRP A 172 5.736 15.823 9.096 1.00 72.15 H new ATOM 0 HZ2 TRP A 172 6.564 20.217 6.891 1.00 74.34 H new ATOM 0 HZ3 TRP A 172 6.925 17.628 10.275 1.00 52.31 H new ATOM 0 HH2 TRP A 172 7.329 19.796 9.186 1.00 5.14 H new ATOM 2620 N MET A 173 5.070 13.925 3.134 1.00 11.14 N ATOM 2621 CA MET A 173 4.620 14.079 1.756 1.00 24.41 C ATOM 2622 C MET A 173 4.905 12.818 0.946 1.00 12.32 C ATOM 2623 O MET A 173 4.409 12.659 -0.171 1.00 15.53 O ATOM 2624 CB MET A 173 5.308 15.279 1.104 1.00 55.20 C ATOM 2625 CG MET A 173 4.566 16.591 1.298 1.00 44.41 C ATOM 2626 SD MET A 173 3.036 16.672 0.349 1.00 75.35 S ATOM 2627 CE MET A 173 3.671 16.623 -1.325 1.00 63.34 C ATOM 0 H MET A 173 6.078 13.804 3.234 1.00 11.14 H new ATOM 0 HA MET A 173 3.543 14.247 1.770 1.00 24.41 H new ATOM 0 HB2 MET A 173 6.313 15.377 1.514 1.00 55.20 H new ATOM 0 HB3 MET A 173 5.416 15.088 0.036 1.00 55.20 H new ATOM 0 HG2 MET A 173 4.340 16.723 2.356 1.00 44.41 H new ATOM 0 HG3 MET A 173 5.214 17.417 1.005 1.00 44.41 H new ATOM 0 HE1 MET A 173 2.844 16.701 -2.030 1.00 63.34 H new ATOM 0 HE2 MET A 173 4.358 17.455 -1.478 1.00 63.34 H new ATOM 0 HE3 MET A 173 4.198 15.683 -1.487 1.00 63.34 H new ATOM 2637 N ALA A 174 5.706 11.922 1.518 1.00 44.34 N ATOM 2638 CA ALA A 174 6.065 10.676 0.850 1.00 53.00 C ATOM 2639 C ALA A 174 5.604 9.462 1.647 1.00 24.42 C ATOM 2640 O ALA A 174 4.932 8.582 1.112 1.00 44.33 O ATOM 2641 CB ALA A 174 7.566 10.617 0.620 1.00 53.31 C ATOM 0 H ALA A 174 6.119 12.037 2.444 1.00 44.34 H new ATOM 0 HA ALA A 174 5.555 10.654 -0.113 1.00 53.00 H new ATOM 0 HB1 ALA A 174 7.821 9.682 0.121 1.00 53.31 H new ATOM 0 HB2 ALA A 174 7.872 11.457 -0.004 1.00 53.31 H new ATOM 0 HB3 ALA A 174 8.083 10.670 1.578 1.00 53.31 H new ATOM 2647 N THR A 175 5.972 9.423 2.929 1.00 55.35 N ATOM 2648 CA THR A 175 5.602 8.316 3.810 1.00 0.41 C ATOM 2649 C THR A 175 4.099 8.309 4.081 1.00 52.20 C ATOM 2650 O THR A 175 3.487 7.250 4.217 1.00 40.55 O ATOM 2651 CB THR A 175 6.360 8.393 5.151 1.00 63.53 C ATOM 2652 OG1 THR A 175 7.750 8.643 4.912 1.00 0.43 O ATOM 2653 CG2 THR A 175 6.208 7.101 5.940 1.00 41.12 C ATOM 0 H THR A 175 6.528 10.149 3.381 1.00 55.35 H new ATOM 0 HA THR A 175 5.878 7.393 3.299 1.00 0.41 H new ATOM 0 HB THR A 175 5.933 9.209 5.734 1.00 63.53 H new ATOM 0 HG1 THR A 175 8.225 8.692 5.768 1.00 0.43 H new ATOM 0 HG21 THR A 175 6.752 7.183 6.881 1.00 41.12 H new ATOM 0 HG22 THR A 175 5.153 6.922 6.146 1.00 41.12 H new ATOM 0 HG23 THR A 175 6.610 6.271 5.359 1.00 41.12 H new ATOM 2661 N TYR A 176 3.515 9.502 4.148 1.00 35.14 N ATOM 2662 CA TYR A 176 2.084 9.653 4.391 1.00 72.13 C ATOM 2663 C TYR A 176 1.286 9.300 3.135 1.00 73.55 C ATOM 2664 O TYR A 176 0.108 8.946 3.211 1.00 41.31 O ATOM 2665 CB TYR A 176 1.785 11.091 4.832 1.00 14.44 C ATOM 2666 CG TYR A 176 0.330 11.359 5.147 1.00 65.24 C ATOM 2667 CD1 TYR A 176 -0.272 10.803 6.269 1.00 23.40 C ATOM 2668 CD2 TYR A 176 -0.440 12.172 4.324 1.00 52.23 C ATOM 2669 CE1 TYR A 176 -1.600 11.050 6.561 1.00 75.44 C ATOM 2670 CE2 TYR A 176 -1.768 12.423 4.610 1.00 31.02 C ATOM 2671 CZ TYR A 176 -2.343 11.860 5.729 1.00 13.10 C ATOM 2672 OH TYR A 176 -3.665 12.109 6.017 1.00 40.41 O ATOM 0 H TYR A 176 4.015 10.384 4.036 1.00 35.14 H new ATOM 0 HA TYR A 176 1.785 8.969 5.185 1.00 72.13 H new ATOM 0 HB2 TYR A 176 2.383 11.319 5.714 1.00 14.44 H new ATOM 0 HB3 TYR A 176 2.105 11.773 4.045 1.00 14.44 H new ATOM 0 HD1 TYR A 176 0.307 10.168 6.923 1.00 23.40 H new ATOM 0 HD2 TYR A 176 0.007 12.615 3.446 1.00 52.23 H new ATOM 0 HE1 TYR A 176 -2.054 10.610 7.437 1.00 75.44 H new ATOM 0 HE2 TYR A 176 -2.353 13.057 3.960 1.00 31.02 H new ATOM 0 HH TYR A 176 -4.043 12.699 5.332 1.00 40.41 H new ATOM 2682 N LEU A 177 1.946 9.385 1.981 1.00 5.13 N ATOM 2683 CA LEU A 177 1.312 9.080 0.704 1.00 35.34 C ATOM 2684 C LEU A 177 1.136 7.572 0.517 1.00 63.42 C ATOM 2685 O LEU A 177 0.056 7.113 0.150 1.00 33.43 O ATOM 2686 CB LEU A 177 2.139 9.665 -0.447 1.00 70.13 C ATOM 2687 CG LEU A 177 1.533 9.501 -1.846 1.00 13.23 C ATOM 2688 CD1 LEU A 177 0.189 10.208 -1.939 1.00 2.41 C ATOM 2689 CD2 LEU A 177 2.488 10.033 -2.904 1.00 41.03 C ATOM 0 H LEU A 177 2.924 9.664 1.907 1.00 5.13 H new ATOM 0 HA LEU A 177 0.322 9.535 0.701 1.00 35.34 H new ATOM 0 HB2 LEU A 177 2.291 10.728 -0.258 1.00 70.13 H new ATOM 0 HB3 LEU A 177 3.123 9.196 -0.439 1.00 70.13 H new ATOM 0 HG LEU A 177 1.372 8.438 -2.026 1.00 13.23 H new ATOM 0 HD11 LEU A 177 -0.222 10.078 -2.940 1.00 2.41 H new ATOM 0 HD12 LEU A 177 -0.497 9.782 -1.207 1.00 2.41 H new ATOM 0 HD13 LEU A 177 0.322 11.271 -1.737 1.00 2.41 H new ATOM 0 HD21 LEU A 177 2.043 9.909 -3.891 1.00 41.03 H new ATOM 0 HD22 LEU A 177 2.680 11.091 -2.722 1.00 41.03 H new ATOM 0 HD23 LEU A 177 3.427 9.481 -2.857 1.00 41.03 H new ATOM 2701 N ASN A 178 2.192 6.803 0.788 1.00 13.43 N ATOM 2702 CA ASN A 178 2.134 5.348 0.633 1.00 60.41 C ATOM 2703 C ASN A 178 1.525 4.670 1.861 1.00 24.14 C ATOM 2704 O ASN A 178 1.374 3.447 1.889 1.00 73.02 O ATOM 2705 CB ASN A 178 3.531 4.775 0.351 1.00 2.51 C ATOM 2706 CG ASN A 178 4.477 4.889 1.534 1.00 24.32 C ATOM 2707 OD1 ASN A 178 5.180 5.885 1.688 1.00 42.42 O ATOM 2708 ND2 ASN A 178 4.510 3.858 2.371 1.00 0.14 N ATOM 0 H ASN A 178 3.091 7.159 1.113 1.00 13.43 H new ATOM 0 HA ASN A 178 1.487 5.140 -0.219 1.00 60.41 H new ATOM 0 HB2 ASN A 178 3.436 3.726 0.070 1.00 2.51 H new ATOM 0 HB3 ASN A 178 3.964 5.296 -0.503 1.00 2.51 H new ATOM 0 HD21 ASN A 178 5.135 3.875 3.177 1.00 0.14 H new ATOM 0 HD22 ASN A 178 3.910 3.049 2.208 1.00 0.14 H new ATOM 2715 N ASP A 179 1.174 5.464 2.870 1.00 25.03 N ATOM 2716 CA ASP A 179 0.585 4.930 4.093 1.00 73.14 C ATOM 2717 C ASP A 179 -0.861 4.498 3.859 1.00 61.13 C ATOM 2718 O ASP A 179 -1.206 3.332 4.051 1.00 73.23 O ATOM 2719 CB ASP A 179 0.645 5.973 5.211 1.00 71.40 C ATOM 2720 CG ASP A 179 0.684 5.344 6.590 1.00 53.21 C ATOM 2721 OD1 ASP A 179 1.794 5.199 7.143 1.00 52.15 O ATOM 2722 OD2 ASP A 179 -0.393 4.995 7.117 1.00 32.10 O1- ATOM 0 H ASP A 179 1.287 6.478 2.864 1.00 25.03 H new ATOM 0 HA ASP A 179 1.162 4.055 4.392 1.00 73.14 H new ATOM 0 HB2 ASP A 179 1.528 6.597 5.075 1.00 71.40 H new ATOM 0 HB3 ASP A 179 -0.223 6.629 5.139 1.00 71.40 H new ATOM 2727 N HIS A 180 -1.698 5.446 3.441 1.00 63.24 N ATOM 2728 CA HIS A 180 -3.109 5.166 3.182 1.00 62.21 C ATOM 2729 C HIS A 180 -3.712 6.200 2.232 1.00 61.34 C ATOM 2730 O HIS A 180 -4.928 6.247 2.042 1.00 34.15 O ATOM 2731 CB HIS A 180 -3.900 5.132 4.500 1.00 1.12 C ATOM 2732 CG HIS A 180 -3.787 6.384 5.322 1.00 33.40 C ATOM 2733 ND1 HIS A 180 -2.819 6.567 6.287 1.00 4.30 N ATOM 2734 CD2 HIS A 180 -4.532 7.516 5.322 1.00 52.43 C ATOM 2735 CE1 HIS A 180 -2.974 7.754 6.845 1.00 11.21 C ATOM 2736 NE2 HIS A 180 -4.005 8.350 6.277 1.00 50.12 N ATOM 0 H HIS A 180 -1.424 6.414 3.275 1.00 63.24 H new ATOM 0 HA HIS A 180 -3.174 4.188 2.705 1.00 62.21 H new ATOM 0 HB2 HIS A 180 -4.951 4.953 4.274 1.00 1.12 H new ATOM 0 HB3 HIS A 180 -3.554 4.288 5.096 1.00 1.12 H new ATOM 0 HD1 HIS A 180 -2.096 5.891 6.532 1.00 4.30 H new ATOM 0 HD2 HIS A 180 -5.382 7.724 4.689 1.00 52.43 H new ATOM 0 HE1 HIS A 180 -2.361 8.167 7.633 1.00 11.21 H new ATOM 2745 N LEU A 181 -2.854 7.019 1.628 1.00 53.34 N ATOM 2746 CA LEU A 181 -3.309 8.056 0.708 1.00 23.13 C ATOM 2747 C LEU A 181 -3.109 7.634 -0.751 1.00 50.43 C ATOM 2748 O LEU A 181 -3.102 8.472 -1.654 1.00 72.33 O ATOM 2749 CB LEU A 181 -2.565 9.364 0.987 1.00 73.23 C ATOM 2750 CG LEU A 181 -3.358 10.642 0.701 1.00 43.11 C ATOM 2751 CD1 LEU A 181 -4.514 10.789 1.680 1.00 20.25 C ATOM 2752 CD2 LEU A 181 -2.447 11.857 0.765 1.00 55.23 C ATOM 0 H LEU A 181 -1.843 6.984 1.759 1.00 53.34 H new ATOM 0 HA LEU A 181 -4.376 8.207 0.868 1.00 23.13 H new ATOM 0 HB2 LEU A 181 -2.259 9.373 2.033 1.00 73.23 H new ATOM 0 HB3 LEU A 181 -1.654 9.380 0.388 1.00 73.23 H new ATOM 0 HG LEU A 181 -3.771 10.571 -0.305 1.00 43.11 H new ATOM 0 HD11 LEU A 181 -5.064 11.704 1.459 1.00 20.25 H new ATOM 0 HD12 LEU A 181 -5.181 9.932 1.586 1.00 20.25 H new ATOM 0 HD13 LEU A 181 -4.125 10.836 2.697 1.00 20.25 H new ATOM 0 HD21 LEU A 181 -3.026 12.757 0.559 1.00 55.23 H new ATOM 0 HD22 LEU A 181 -2.005 11.929 1.759 1.00 55.23 H new ATOM 0 HD23 LEU A 181 -1.655 11.758 0.023 1.00 55.23 H new ATOM 2764 N GLU A 182 -2.953 6.330 -0.974 1.00 1.44 N ATOM 2765 CA GLU A 182 -2.769 5.796 -2.324 1.00 24.31 C ATOM 2766 C GLU A 182 -3.771 4.675 -2.610 1.00 4.44 C ATOM 2767 O GLU A 182 -3.408 3.499 -2.626 1.00 11.01 O ATOM 2768 CB GLU A 182 -1.341 5.269 -2.508 1.00 71.32 C ATOM 2769 CG GLU A 182 -0.324 6.343 -2.855 1.00 74.35 C ATOM 2770 CD GLU A 182 1.051 5.776 -3.152 1.00 10.35 C ATOM 2771 OE1 GLU A 182 1.178 5.004 -4.125 1.00 32.40 O ATOM 2772 OE2 GLU A 182 2.001 6.109 -2.417 1.00 75.54 O1- ATOM 0 H GLU A 182 -2.950 5.624 -0.238 1.00 1.44 H new ATOM 0 HA GLU A 182 -2.942 6.610 -3.028 1.00 24.31 H new ATOM 0 HB2 GLU A 182 -1.028 4.770 -1.591 1.00 71.32 H new ATOM 0 HB3 GLU A 182 -1.342 4.516 -3.296 1.00 71.32 H new ATOM 0 HG2 GLU A 182 -0.676 6.904 -3.721 1.00 74.35 H new ATOM 0 HG3 GLU A 182 -0.250 7.048 -2.027 1.00 74.35 H new ATOM 2779 N PRO A 183 -5.054 5.024 -2.832 1.00 53.10 N ATOM 2780 CA PRO A 183 -6.107 4.048 -3.114 1.00 20.14 C ATOM 2781 C PRO A 183 -6.165 3.651 -4.589 1.00 34.23 C ATOM 2782 O PRO A 183 -6.067 2.472 -4.929 1.00 5.13 O ATOM 2783 CB PRO A 183 -7.396 4.786 -2.709 1.00 72.12 C ATOM 2784 CG PRO A 183 -6.989 6.169 -2.294 1.00 61.43 C ATOM 2785 CD PRO A 183 -5.595 6.385 -2.809 1.00 53.45 C ATOM 0 HA PRO A 183 -5.943 3.114 -2.577 1.00 20.14 H new ATOM 0 HB2 PRO A 183 -8.099 4.823 -3.542 1.00 72.12 H new ATOM 0 HB3 PRO A 183 -7.898 4.268 -1.891 1.00 72.12 H new ATOM 0 HG2 PRO A 183 -7.672 6.912 -2.705 1.00 61.43 H new ATOM 0 HG3 PRO A 183 -7.020 6.272 -1.209 1.00 61.43 H new ATOM 0 HD2 PRO A 183 -5.594 6.839 -3.800 1.00 53.45 H new ATOM 0 HD3 PRO A 183 -5.018 7.041 -2.157 1.00 53.45 H new ATOM 2793 N TRP A 184 -6.322 4.648 -5.455 1.00 1.53 N ATOM 2794 CA TRP A 184 -6.407 4.426 -6.896 1.00 33.41 C ATOM 2795 C TRP A 184 -5.023 4.409 -7.543 1.00 11.53 C ATOM 2796 O TRP A 184 -4.870 3.974 -8.685 1.00 40.15 O ATOM 2797 CB TRP A 184 -7.267 5.520 -7.539 1.00 72.21 C ATOM 2798 CG TRP A 184 -6.858 6.909 -7.140 1.00 2.40 C ATOM 2799 CD1 TRP A 184 -7.271 7.600 -6.036 1.00 43.23 C ATOM 2800 CD2 TRP A 184 -5.957 7.776 -7.840 1.00 32.22 C ATOM 2801 NE1 TRP A 184 -6.676 8.837 -6.003 1.00 51.34 N ATOM 2802 CE2 TRP A 184 -5.867 8.970 -7.100 1.00 11.02 C ATOM 2803 CE3 TRP A 184 -5.214 7.658 -9.019 1.00 24.34 C ATOM 2804 CZ2 TRP A 184 -5.067 10.036 -7.501 1.00 5.52 C ATOM 2805 CZ3 TRP A 184 -4.421 8.717 -9.415 1.00 1.45 C ATOM 2806 CH2 TRP A 184 -4.352 9.892 -8.658 1.00 64.43 C ATOM 0 H TRP A 184 -6.394 5.628 -5.180 1.00 1.53 H new ATOM 0 HA TRP A 184 -6.867 3.451 -7.060 1.00 33.41 H new ATOM 0 HB2 TRP A 184 -7.207 5.429 -8.624 1.00 72.21 H new ATOM 0 HB3 TRP A 184 -8.310 5.362 -7.263 1.00 72.21 H new ATOM 0 HD1 TRP A 184 -7.965 7.227 -5.297 1.00 43.23 H new ATOM 0 HE1 TRP A 184 -6.814 9.542 -5.279 1.00 51.34 H new ATOM 0 HE3 TRP A 184 -5.260 6.755 -9.609 1.00 24.34 H new ATOM 0 HZ2 TRP A 184 -5.013 10.944 -6.919 1.00 5.52 H new ATOM 0 HZ3 TRP A 184 -3.844 8.637 -10.325 1.00 1.45 H new ATOM 0 HH2 TRP A 184 -3.721 10.702 -8.994 1.00 64.43 H new ATOM 2817 N ILE A 185 -4.023 4.887 -6.809 1.00 2.34 N ATOM 2818 CA ILE A 185 -2.655 4.939 -7.313 1.00 1.34 C ATOM 2819 C ILE A 185 -2.021 3.550 -7.340 1.00 24.15 C ATOM 2820 O ILE A 185 -1.504 3.119 -8.370 1.00 41.21 O ATOM 2821 CB ILE A 185 -1.789 5.893 -6.465 1.00 10.52 C ATOM 2822 CG1 ILE A 185 -2.397 7.297 -6.473 1.00 70.51 C ATOM 2823 CG2 ILE A 185 -0.360 5.927 -6.987 1.00 44.33 C ATOM 2824 CD1 ILE A 185 -1.780 8.237 -5.463 1.00 3.13 C ATOM 0 H ILE A 185 -4.135 5.245 -5.860 1.00 2.34 H new ATOM 0 HA ILE A 185 -2.700 5.319 -8.334 1.00 1.34 H new ATOM 0 HB ILE A 185 -1.766 5.526 -5.439 1.00 10.52 H new ATOM 0 HG12 ILE A 185 -2.285 7.725 -7.469 1.00 70.51 H new ATOM 0 HG13 ILE A 185 -3.467 7.220 -6.277 1.00 70.51 H new ATOM 0 HG21 ILE A 185 0.235 6.606 -6.375 1.00 44.33 H new ATOM 0 HG22 ILE A 185 0.069 4.926 -6.940 1.00 44.33 H new ATOM 0 HG23 ILE A 185 -0.358 6.274 -8.020 1.00 44.33 H new ATOM 0 HD11 ILE A 185 -2.264 9.211 -5.530 1.00 3.13 H new ATOM 0 HD12 ILE A 185 -1.915 7.833 -4.460 1.00 3.13 H new ATOM 0 HD13 ILE A 185 -0.715 8.346 -5.670 1.00 3.13 H new ATOM 2836 N GLN A 186 -2.074 2.851 -6.207 1.00 53.43 N ATOM 2837 CA GLN A 186 -1.510 1.507 -6.105 1.00 34.11 C ATOM 2838 C GLN A 186 -2.391 0.485 -6.824 1.00 73.11 C ATOM 2839 O GLN A 186 -1.957 -0.631 -7.110 1.00 14.34 O ATOM 2840 CB GLN A 186 -1.338 1.113 -4.636 1.00 1.23 C ATOM 2841 CG GLN A 186 -0.302 1.950 -3.902 1.00 30.32 C ATOM 2842 CD GLN A 186 -0.335 1.744 -2.399 1.00 25.25 C ATOM 2843 OE1 GLN A 186 -1.367 1.391 -1.829 1.00 13.33 O ATOM 2844 NE2 GLN A 186 0.797 1.979 -1.746 1.00 63.31 N ATOM 0 H GLN A 186 -2.502 3.194 -5.347 1.00 53.43 H new ATOM 0 HA GLN A 186 -0.533 1.514 -6.588 1.00 34.11 H new ATOM 0 HB2 GLN A 186 -2.297 1.208 -4.128 1.00 1.23 H new ATOM 0 HB3 GLN A 186 -1.051 0.063 -4.581 1.00 1.23 H new ATOM 0 HG2 GLN A 186 0.691 1.701 -4.276 1.00 30.32 H new ATOM 0 HG3 GLN A 186 -0.471 3.004 -4.123 1.00 30.32 H new ATOM 0 HE21 GLN A 186 1.630 2.270 -2.258 1.00 63.31 H new ATOM 0 HE22 GLN A 186 0.834 1.868 -0.733 1.00 63.31 H new ATOM 2853 N GLU A 187 -3.630 0.880 -7.115 1.00 43.33 N ATOM 2854 CA GLU A 187 -4.577 0.011 -7.806 1.00 30.12 C ATOM 2855 C GLU A 187 -4.312 0.010 -9.312 1.00 61.14 C ATOM 2856 O GLU A 187 -4.539 -0.992 -9.992 1.00 33.41 O ATOM 2857 CB GLU A 187 -6.010 0.473 -7.528 1.00 71.25 C ATOM 2858 CG GLU A 187 -7.077 -0.477 -8.048 1.00 62.51 C ATOM 2859 CD GLU A 187 -8.481 0.051 -7.835 1.00 70.11 C ATOM 2860 OE1 GLU A 187 -9.060 -0.217 -6.761 1.00 35.40 O ATOM 2861 OE2 GLU A 187 -9.003 0.734 -8.741 1.00 42.34 O1- ATOM 0 H GLU A 187 -4.001 1.801 -6.881 1.00 43.33 H new ATOM 0 HA GLU A 187 -4.448 -1.005 -7.432 1.00 30.12 H new ATOM 0 HB2 GLU A 187 -6.139 0.595 -6.453 1.00 71.25 H new ATOM 0 HB3 GLU A 187 -6.159 1.453 -7.980 1.00 71.25 H new ATOM 0 HG2 GLU A 187 -6.916 -0.651 -9.112 1.00 62.51 H new ATOM 0 HG3 GLU A 187 -6.975 -1.440 -7.548 1.00 62.51 H new ATOM 2868 N ASN A 188 -3.822 1.138 -9.821 1.00 64.33 N ATOM 2869 CA ASN A 188 -3.527 1.276 -11.244 1.00 0.22 C ATOM 2870 C ASN A 188 -2.157 0.685 -11.579 1.00 20.40 C ATOM 2871 O ASN A 188 -1.988 0.040 -12.614 1.00 51.34 O ATOM 2872 CB ASN A 188 -3.583 2.750 -11.652 1.00 45.15 C ATOM 2873 CG ASN A 188 -3.753 2.935 -13.149 1.00 2.31 C ATOM 2874 OD1 ASN A 188 -4.323 2.083 -13.831 1.00 43.24 O ATOM 2875 ND2 ASN A 188 -3.265 4.055 -13.666 1.00 12.32 N ATOM 0 H ASN A 188 -3.621 1.971 -9.268 1.00 64.33 H new ATOM 0 HA ASN A 188 -4.281 0.723 -11.805 1.00 0.22 H new ATOM 0 HB2 ASN A 188 -4.410 3.236 -11.133 1.00 45.15 H new ATOM 0 HB3 ASN A 188 -2.668 3.247 -11.330 1.00 45.15 H new ATOM 0 HD21 ASN A 188 -3.355 4.237 -14.666 1.00 12.32 H new ATOM 0 HD22 ASN A 188 -2.800 4.734 -13.064 1.00 12.32 H new ATOM 2882 N GLY A 189 -1.184 0.908 -10.698 1.00 64.31 N ATOM 2883 CA GLY A 189 0.153 0.384 -10.921 1.00 21.13 C ATOM 2884 C GLY A 189 1.242 1.303 -10.402 1.00 55.40 C ATOM 2885 O GLY A 189 2.246 1.527 -11.080 1.00 3.12 O ATOM 0 H GLY A 189 -1.297 1.441 -9.836 1.00 64.31 H new ATOM 0 HA2 GLY A 189 0.243 -0.588 -10.435 1.00 21.13 H new ATOM 0 HA3 GLY A 189 0.300 0.221 -11.989 1.00 21.13 H new ATOM 2889 N GLY A 190 1.044 1.835 -9.196 1.00 71.53 N ATOM 2890 CA GLY A 190 2.025 2.729 -8.601 1.00 43.35 C ATOM 2891 C GLY A 190 2.075 4.081 -9.286 1.00 55.20 C ATOM 2892 O GLY A 190 1.050 4.599 -9.729 1.00 70.51 O ATOM 0 H GLY A 190 0.220 1.662 -8.620 1.00 71.53 H new ATOM 0 HA2 GLY A 190 1.790 2.869 -7.546 1.00 43.35 H new ATOM 0 HA3 GLY A 190 3.010 2.265 -8.649 1.00 43.35 H new ATOM 2896 N TRP A 191 3.272 4.655 -9.372 1.00 31.40 N ATOM 2897 CA TRP A 191 3.452 5.952 -10.013 1.00 3.01 C ATOM 2898 C TRP A 191 4.171 5.809 -11.352 1.00 65.13 C ATOM 2899 O TRP A 191 4.418 6.798 -12.042 1.00 43.01 O ATOM 2900 CB TRP A 191 4.224 6.902 -9.097 1.00 35.44 C ATOM 2901 CG TRP A 191 3.337 7.656 -8.154 1.00 11.12 C ATOM 2902 CD1 TRP A 191 3.004 7.302 -6.878 1.00 63.50 C ATOM 2903 CD2 TRP A 191 2.662 8.890 -8.418 1.00 32.32 C ATOM 2904 NE1 TRP A 191 2.170 8.246 -6.330 1.00 10.42 N ATOM 2905 CE2 TRP A 191 1.943 9.230 -7.257 1.00 53.30 C ATOM 2906 CE3 TRP A 191 2.598 9.744 -9.524 1.00 23.32 C ATOM 2907 CZ2 TRP A 191 1.171 10.384 -7.171 1.00 22.20 C ATOM 2908 CZ3 TRP A 191 1.830 10.890 -9.437 1.00 32.41 C ATOM 2909 CH2 TRP A 191 1.126 11.201 -8.268 1.00 4.25 C ATOM 0 H TRP A 191 4.130 4.242 -9.006 1.00 31.40 H new ATOM 0 HA TRP A 191 2.464 6.372 -10.200 1.00 3.01 H new ATOM 0 HB2 TRP A 191 4.954 6.331 -8.523 1.00 35.44 H new ATOM 0 HB3 TRP A 191 4.783 7.612 -9.707 1.00 35.44 H new ATOM 0 HD1 TRP A 191 3.346 6.410 -6.374 1.00 63.50 H new ATOM 0 HE1 TRP A 191 1.783 8.219 -5.387 1.00 10.42 H new ATOM 0 HE3 TRP A 191 3.139 9.512 -10.430 1.00 23.32 H new ATOM 0 HZ2 TRP A 191 0.626 10.627 -6.270 1.00 22.20 H new ATOM 0 HZ3 TRP A 191 1.772 11.556 -10.285 1.00 32.41 H new ATOM 0 HH2 TRP A 191 0.535 12.104 -8.231 1.00 4.25 H new ATOM 2920 N ASP A 192 4.499 4.570 -11.714 1.00 41.32 N ATOM 2921 CA ASP A 192 5.176 4.293 -12.976 1.00 2.15 C ATOM 2922 C ASP A 192 4.175 4.331 -14.129 1.00 61.14 C ATOM 2923 O ASP A 192 4.543 4.570 -15.281 1.00 53.44 O ATOM 2924 CB ASP A 192 5.871 2.930 -12.919 1.00 51.33 C ATOM 2925 CG ASP A 192 6.885 2.749 -14.032 1.00 31.41 C ATOM 2926 OD1 ASP A 192 7.989 3.324 -13.928 1.00 40.54 O ATOM 2927 OD2 ASP A 192 6.577 2.030 -15.005 1.00 63.14 O1- ATOM 0 H ASP A 192 4.306 3.743 -11.150 1.00 41.32 H new ATOM 0 HA ASP A 192 5.932 5.060 -13.144 1.00 2.15 H new ATOM 0 HB2 ASP A 192 6.370 2.820 -11.956 1.00 51.33 H new ATOM 0 HB3 ASP A 192 5.122 2.141 -12.982 1.00 51.33 H new ATOM 2932 N THR A 193 2.904 4.099 -13.800 1.00 42.11 N ATOM 2933 CA THR A 193 1.831 4.115 -14.789 1.00 71.11 C ATOM 2934 C THR A 193 1.455 5.552 -15.158 1.00 34.14 C ATOM 2935 O THR A 193 0.817 5.795 -16.183 1.00 21.35 O ATOM 2936 CB THR A 193 0.583 3.366 -14.272 1.00 72.23 C ATOM 2937 OG1 THR A 193 -0.466 3.414 -15.247 1.00 64.13 O ATOM 2938 CG2 THR A 193 0.090 3.961 -12.959 1.00 41.42 C ATOM 0 H THR A 193 2.593 3.897 -12.850 1.00 42.11 H new ATOM 0 HA THR A 193 2.198 3.604 -15.679 1.00 71.11 H new ATOM 0 HB THR A 193 0.866 2.328 -14.097 1.00 72.23 H new ATOM 0 HG1 THR A 193 -0.399 4.247 -15.758 1.00 64.13 H new ATOM 0 HG21 THR A 193 -0.789 3.414 -12.619 1.00 41.42 H new ATOM 0 HG22 THR A 193 0.876 3.887 -12.208 1.00 41.42 H new ATOM 0 HG23 THR A 193 -0.170 5.009 -13.109 1.00 41.42 H new ATOM 2946 N PHE A 194 1.863 6.498 -14.312 1.00 63.35 N ATOM 2947 CA PHE A 194 1.593 7.913 -14.542 1.00 21.42 C ATOM 2948 C PHE A 194 2.523 8.457 -15.624 1.00 74.44 C ATOM 2949 O PHE A 194 2.197 9.422 -16.314 1.00 44.25 O ATOM 2950 CB PHE A 194 1.773 8.699 -13.237 1.00 54.02 C ATOM 2951 CG PHE A 194 1.468 10.169 -13.355 1.00 70.10 C ATOM 2952 CD1 PHE A 194 2.492 11.104 -13.362 1.00 43.25 C ATOM 2953 CD2 PHE A 194 0.159 10.614 -13.455 1.00 14.52 C ATOM 2954 CE1 PHE A 194 2.216 12.454 -13.467 1.00 65.11 C ATOM 2955 CE2 PHE A 194 -0.122 11.963 -13.561 1.00 41.11 C ATOM 2956 CZ PHE A 194 0.908 12.884 -13.567 1.00 53.34 C ATOM 0 H PHE A 194 2.385 6.306 -13.457 1.00 63.35 H new ATOM 0 HA PHE A 194 0.563 8.027 -14.881 1.00 21.42 H new ATOM 0 HB2 PHE A 194 1.128 8.266 -12.473 1.00 54.02 H new ATOM 0 HB3 PHE A 194 2.800 8.579 -12.892 1.00 54.02 H new ATOM 0 HD1 PHE A 194 3.517 10.773 -13.284 1.00 43.25 H new ATOM 0 HD2 PHE A 194 -0.650 9.899 -13.450 1.00 14.52 H new ATOM 0 HE1 PHE A 194 3.023 13.172 -13.471 1.00 65.11 H new ATOM 0 HE2 PHE A 194 -1.146 12.297 -13.639 1.00 41.11 H new ATOM 0 HZ PHE A 194 0.690 13.939 -13.650 1.00 53.34 H new ATOM 2966 N VAL A 195 3.681 7.817 -15.771 1.00 52.33 N ATOM 2967 CA VAL A 195 4.665 8.217 -16.770 1.00 53.41 C ATOM 2968 C VAL A 195 4.298 7.652 -18.143 1.00 43.43 C ATOM 2969 O VAL A 195 4.856 8.053 -19.163 1.00 30.33 O ATOM 2970 CB VAL A 195 6.082 7.739 -16.387 1.00 21.41 C ATOM 2971 CG1 VAL A 195 7.142 8.513 -17.157 1.00 2.30 C ATOM 2972 CG2 VAL A 195 6.307 7.868 -14.888 1.00 34.35 C ATOM 0 H VAL A 195 3.960 7.015 -15.206 1.00 52.33 H new ATOM 0 HA VAL A 195 4.661 9.306 -16.811 1.00 53.41 H new ATOM 0 HB VAL A 195 6.168 6.686 -16.657 1.00 21.41 H new ATOM 0 HG11 VAL A 195 8.132 8.158 -16.870 1.00 2.30 H new ATOM 0 HG12 VAL A 195 6.998 8.361 -18.227 1.00 2.30 H new ATOM 0 HG13 VAL A 195 7.056 9.575 -16.927 1.00 2.30 H new ATOM 0 HG21 VAL A 195 7.312 7.526 -14.640 1.00 34.35 H new ATOM 0 HG22 VAL A 195 6.196 8.911 -14.592 1.00 34.35 H new ATOM 0 HG23 VAL A 195 5.575 7.260 -14.357 1.00 34.35 H new ATOM 2982 N GLU A 196 3.353 6.716 -18.155 1.00 14.11 N ATOM 2983 CA GLU A 196 2.900 6.093 -19.394 1.00 4.20 C ATOM 2984 C GLU A 196 1.640 6.781 -19.916 1.00 15.34 C ATOM 2985 O GLU A 196 1.476 6.966 -21.122 1.00 61.15 O ATOM 2986 CB GLU A 196 2.625 4.604 -19.167 1.00 31.43 C ATOM 2987 CG GLU A 196 3.836 3.829 -18.670 1.00 74.41 C ATOM 2988 CD GLU A 196 3.509 2.387 -18.337 1.00 3.32 C ATOM 2989 OE1 GLU A 196 3.229 2.098 -17.155 1.00 41.21 O ATOM 2990 OE2 GLU A 196 3.534 1.545 -19.260 1.00 23.14 O1- ATOM 0 H GLU A 196 2.885 6.372 -17.317 1.00 14.11 H new ATOM 0 HA GLU A 196 3.688 6.201 -20.139 1.00 4.20 H new ATOM 0 HB2 GLU A 196 1.815 4.499 -18.445 1.00 31.43 H new ATOM 0 HB3 GLU A 196 2.279 4.161 -20.101 1.00 31.43 H new ATOM 0 HG2 GLU A 196 4.616 3.854 -19.431 1.00 74.41 H new ATOM 0 HG3 GLU A 196 4.239 4.320 -17.784 1.00 74.41 H new ATOM 2997 N LEU A 197 0.757 7.160 -18.993 1.00 55.40 N ATOM 2998 CA LEU A 197 -0.493 7.827 -19.347 1.00 12.03 C ATOM 2999 C LEU A 197 -0.255 9.301 -19.667 1.00 31.24 C ATOM 3000 O LEU A 197 -0.617 9.777 -20.744 1.00 54.02 O ATOM 3001 CB LEU A 197 -1.503 7.692 -18.202 1.00 14.21 C ATOM 3002 CG LEU A 197 -2.870 8.335 -18.454 1.00 25.45 C ATOM 3003 CD1 LEU A 197 -3.608 7.612 -19.571 1.00 53.33 C ATOM 3004 CD2 LEU A 197 -3.697 8.334 -17.178 1.00 52.21 C ATOM 0 H LEU A 197 0.886 7.015 -17.992 1.00 55.40 H new ATOM 0 HA LEU A 197 -0.896 7.346 -20.238 1.00 12.03 H new ATOM 0 HB2 LEU A 197 -1.651 6.632 -17.994 1.00 14.21 H new ATOM 0 HB3 LEU A 197 -1.071 8.136 -17.305 1.00 14.21 H new ATOM 0 HG LEU A 197 -2.713 9.368 -18.765 1.00 25.45 H new ATOM 0 HD11 LEU A 197 -4.576 8.085 -19.733 1.00 53.33 H new ATOM 0 HD12 LEU A 197 -3.021 7.664 -20.488 1.00 53.33 H new ATOM 0 HD13 LEU A 197 -3.756 6.568 -19.293 1.00 53.33 H new ATOM 0 HD21 LEU A 197 -4.666 8.794 -17.372 1.00 52.21 H new ATOM 0 HD22 LEU A 197 -3.843 7.308 -16.840 1.00 52.21 H new ATOM 0 HD23 LEU A 197 -3.175 8.899 -16.406 1.00 52.21 H new ATOM 3016 N TYR A 198 0.357 10.018 -18.726 1.00 22.15 N ATOM 3017 CA TYR A 198 0.643 11.437 -18.908 1.00 72.53 C ATOM 3018 C TYR A 198 1.849 11.633 -19.822 1.00 33.44 C ATOM 3019 O TYR A 198 1.909 12.595 -20.589 1.00 45.13 O ATOM 3020 CB TYR A 198 0.898 12.105 -17.555 1.00 14.44 C ATOM 3021 CG TYR A 198 0.249 13.464 -17.416 1.00 73.14 C ATOM 3022 CD1 TYR A 198 0.876 14.607 -17.897 1.00 23.14 C ATOM 3023 CD2 TYR A 198 -0.990 13.604 -16.803 1.00 61.30 C ATOM 3024 CE1 TYR A 198 0.285 15.850 -17.772 1.00 24.53 C ATOM 3025 CE2 TYR A 198 -1.586 14.844 -16.674 1.00 60.02 C ATOM 3026 CZ TYR A 198 -0.944 15.964 -17.160 1.00 12.25 C ATOM 3027 OH TYR A 198 -1.535 17.200 -17.033 1.00 15.10 O ATOM 0 H TYR A 198 0.664 9.638 -17.830 1.00 22.15 H new ATOM 0 HA TYR A 198 -0.225 11.902 -19.375 1.00 72.53 H new ATOM 0 HB2 TYR A 198 0.529 11.453 -16.763 1.00 14.44 H new ATOM 0 HB3 TYR A 198 1.973 12.209 -17.408 1.00 14.44 H new ATOM 0 HD1 TYR A 198 1.840 14.523 -18.376 1.00 23.14 H new ATOM 0 HD2 TYR A 198 -1.496 12.729 -16.421 1.00 61.30 H new ATOM 0 HE1 TYR A 198 0.785 16.729 -18.153 1.00 24.53 H new ATOM 0 HE2 TYR A 198 -2.550 14.936 -16.195 1.00 60.02 H new ATOM 0 HH TYR A 198 -2.399 17.105 -16.580 1.00 15.10 H new ATOM 3037 N GLY A 199 2.806 10.712 -19.735 1.00 13.15 N ATOM 3038 CA GLY A 199 3.994 10.792 -20.563 1.00 63.12 C ATOM 3039 C GLY A 199 3.905 9.896 -21.784 1.00 2.40 C ATOM 3040 O GLY A 199 4.643 8.918 -21.900 1.00 44.54 O ATOM 0 H GLY A 199 2.778 9.911 -19.104 1.00 13.15 H new ATOM 0 HA2 GLY A 199 4.143 11.824 -20.882 1.00 63.12 H new ATOM 0 HA3 GLY A 199 4.866 10.512 -19.972 1.00 63.12 H new ATOM 3044 N ASN A 200 2.998 10.236 -22.697 1.00 12.22 N ATOM 3045 CA ASN A 200 2.806 9.461 -23.920 1.00 31.11 C ATOM 3046 C ASN A 200 3.900 9.765 -24.943 1.00 31.33 C ATOM 3047 O ASN A 200 4.051 9.050 -25.934 1.00 41.40 O ATOM 3048 CB ASN A 200 1.424 9.747 -24.518 1.00 4.43 C ATOM 3049 CG ASN A 200 1.154 11.231 -24.694 1.00 42.43 C ATOM 3050 OD1 ASN A 200 0.675 11.900 -23.778 1.00 1.41 O ATOM 3051 ND2 ASN A 200 1.454 11.753 -25.878 1.00 21.30 N ATOM 0 H ASN A 200 2.383 11.045 -22.612 1.00 12.22 H new ATOM 0 HA ASN A 200 2.869 8.403 -23.664 1.00 31.11 H new ATOM 0 HB2 ASN A 200 1.342 9.250 -25.485 1.00 4.43 H new ATOM 0 HB3 ASN A 200 0.658 9.317 -23.873 1.00 4.43 H new ATOM 0 HD21 ASN A 200 1.289 12.744 -26.055 1.00 21.30 H new ATOM 0 HD22 ASN A 200 1.850 11.163 -26.610 1.00 21.30 H new ATOM 3058 N ASN A 201 4.660 10.829 -24.692 1.00 60.41 N ATOM 3059 CA ASN A 201 5.744 11.229 -25.581 1.00 21.42 C ATOM 3060 C ASN A 201 7.017 10.449 -25.263 1.00 33.55 C ATOM 3061 O ASN A 201 7.875 10.262 -26.127 1.00 43.22 O ATOM 3062 CB ASN A 201 6.005 12.732 -25.459 1.00 50.22 C ATOM 3063 CG ASN A 201 4.783 13.565 -25.797 1.00 13.05 C ATOM 3064 OD1 ASN A 201 4.557 13.913 -26.956 1.00 53.41 O ATOM 3065 ND2 ASN A 201 3.990 13.893 -24.784 1.00 4.34 N ATOM 0 H ASN A 201 4.543 11.430 -23.877 1.00 60.41 H new ATOM 0 HA ASN A 201 5.446 11.005 -26.605 1.00 21.42 H new ATOM 0 HB2 ASN A 201 6.326 12.960 -24.443 1.00 50.22 H new ATOM 0 HB3 ASN A 201 6.824 13.010 -26.122 1.00 50.22 H new ATOM 0 HD21 ASN A 201 3.155 14.455 -24.951 1.00 4.34 H new ATOM 0 HD22 ASN A 201 4.215 13.583 -23.839 1.00 4.34 H new ATOM 3072 N ALA A 202 7.130 9.994 -24.016 1.00 2.13 N ATOM 3073 CA ALA A 202 8.290 9.227 -23.577 1.00 20.24 C ATOM 3074 C ALA A 202 8.161 7.764 -23.990 1.00 63.21 C ATOM 3075 O ALA A 202 9.161 7.067 -24.170 1.00 33.22 O ATOM 3076 CB ALA A 202 8.460 9.342 -22.069 1.00 72.15 C ATOM 0 H ALA A 202 6.428 10.145 -23.291 1.00 2.13 H new ATOM 0 HA ALA A 202 9.176 9.639 -24.060 1.00 20.24 H new ATOM 0 HB1 ALA A 202 9.330 8.764 -21.756 1.00 72.15 H new ATOM 0 HB2 ALA A 202 8.602 10.388 -21.798 1.00 72.15 H new ATOM 0 HB3 ALA A 202 7.570 8.956 -21.572 1.00 72.15 H new ATOM 3082 N ALA A 203 6.919 7.310 -24.145 1.00 51.11 N ATOM 3083 CA ALA A 203 6.644 5.935 -24.544 1.00 63.14 C ATOM 3084 C ALA A 203 6.642 5.796 -26.064 1.00 5.14 C ATOM 3085 O ALA A 203 6.663 4.685 -26.595 1.00 43.34 O ATOM 3086 CB ALA A 203 5.311 5.479 -23.968 1.00 2.14 C ATOM 0 H ALA A 203 6.085 7.879 -23.999 1.00 51.11 H new ATOM 0 HA ALA A 203 7.436 5.299 -24.149 1.00 63.14 H new ATOM 0 HB1 ALA A 203 5.116 4.451 -24.272 1.00 2.14 H new ATOM 0 HB2 ALA A 203 5.347 5.535 -22.880 1.00 2.14 H new ATOM 0 HB3 ALA A 203 4.515 6.124 -24.339 1.00 2.14 H new