USER MOD reduce.3.24.130724 H: found=0, std=0, add=1751, rem=0, adj=75 USER MOD reduce.3.24.130724 removed 1751 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 204 LYS NZ :NH3+ 134:sc= 1.54 (180deg=-1.57) USER MOD Set 1.2: A 210 SER OG : rot -4:sc= 0.262! USER MOD Set 2.1: A 129 SER OG : rot 30:sc= 0.617 USER MOD Set 2.2: A 148 ASN : amide:sc= 1.16 K(o=3.4,f=-0.26) USER MOD Set 2.3: A 151 CYS SG : rot -49:sc= 1.95 USER MOD Set 2.4: A 173 THR OG1 : rot -92:sc= -0.339! USER MOD Set 3.1: A 82 ASN : amide:sc= -0.521 X(o=-2.3,f=-2.4) USER MOD Set 3.2: A 95 HIS :FLIP no HD1:sc= -1.2 F(o=-3.7,f=-2.3) USER MOD Set 3.3: A 137 TYR OH : rot 180:sc= -0.593 USER MOD Set 4.1: A 118 LYS NZ :NH3+ -172:sc= 0.848 (180deg=0) USER MOD Set 4.2: A 120 TYR OH : rot 165:sc= 0.746 USER MOD Set 5.1: A 100 SER OG : rot 180:sc= -0.0259 USER MOD Set 5.2: A 175 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Set 6.1: A 99 GLN : amide:sc= -1.32 K(o=-2.8,f=-3.7) USER MOD Set 6.2: A 215 HIS : no HE2:sc= -1.47! C(o=-2.8!,f=-2.5!) USER MOD Set 7.1: A 94 CYS SG : rot 180:sc= 0.503 USER MOD Set 7.2: A 96 THR OG1 : rot -24:sc= 0.568 USER MOD Set 8.1: A 79 GLN : amide:sc= -0.586 X(o=-0.52,f=-0.16) USER MOD Set 8.2: A 218 SER OG : rot -140:sc= 0.0682 USER MOD Set 9.1: A 77 SER OG : rot 180:sc= 0 USER MOD Set 9.2: A 198 ASN : amide:sc= -3.82 K(o=-3.8,f=-6.2!) USER MOD Set10.1: A 73 THR OG1 : rot 180:sc= 0 USER MOD Set10.2: A 216 HIS : no HD1:sc= -0.274 X(o=-0.27,f=-0.27) USER MOD Set11.1: A 67 GLN : amide:sc= -3.77! C(o=-4.1!,f=-7.6!) USER MOD Set11.2: A 83 MET CE :methyl -142:sc= -0.349 (180deg=-1.57) USER MOD Set12.1: A 62 SER OG : rot -81:sc= 0.64 USER MOD Set12.2: A 125 ASN :FLIP amide:sc= -2.11! C(o=-2.3!,f=-1.5!) USER MOD Set13.1: A 18 ASN :FLIP amide:sc= -0.249 F(o=-2.7,f=-1.6) USER MOD Set13.2: A 124 MET CE :methyl -179:sc= -1.38! (180deg=-1.31!) USER MOD Set14.1: A 8 GLN :FLIP amide:sc= -1.61 F(o=-1.1!,f=-0.36) USER MOD Set14.2: A 116 TYR OH : rot 62:sc= 1.26 USER MOD Single : A 1 MET CE :methyl -158:sc= -0.279 (180deg=-1) USER MOD Single : A 1 MET N :NH3+ -113:sc= 1.21 (180deg=-0.986) USER MOD Single : A 4 LYS NZ :NH3+ 138:sc= 1.22 (180deg=-0.687!) USER MOD Single : A 9 GLN : amide:sc= 0 K(o=0,f=-0.71) USER MOD Single : A 10 THR OG1 : rot 34:sc= -0.898 USER MOD Single : A 12 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 17 TYR OH : rot 180:sc= 0 USER MOD Single : A 21 THR OG1 : rot 45:sc= 0.147 USER MOD Single : A 22 SER OG : rot 180:sc= -0.0469 USER MOD Single : A 25 LYS NZ :NH3+ 162:sc= 0.556 (180deg=-0.0519) USER MOD Single : A 28 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 29 THR OG1 : rot 180:sc= 0 USER MOD Single : A 30 SER OG : rot 180:sc= 0 USER MOD Single : A 31 LYS NZ :NH3+ -161:sc= -1.35 (180deg=-2.25!) USER MOD Single : A 32 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 34 THR OG1 : rot 180:sc= -0.137 USER MOD Single : A 36 SER OG : rot 141:sc= -0.52! USER MOD Single : A 37 SER OG : rot 112:sc= 0.829 USER MOD Single : A 38 LYS NZ :NH3+ 172:sc= 0 (180deg=-0.0284) USER MOD Single : A 40 SER OG : rot 115:sc= 1.01 USER MOD Single : A 42 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 44 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 46 ASN : amide:sc= 1 K(o=1,f=0) USER MOD Single : A 48 TYR OH : rot 180:sc= 0 USER MOD Single : A 57 SER OG : rot 180:sc=0.000298 USER MOD Single : A 60 LYS NZ :NH3+ 137:sc= 0.142 (180deg=0) USER MOD Single : A 66 TYR OH : rot 180:sc= 0 USER MOD Single : A 68 THR OG1 : rot -6:sc= 0.32 USER MOD Single : A 76 LYS NZ :NH3+ -156:sc= 0 (180deg=-0.0095) USER MOD Single : A 81 TYR OH : rot 180:sc= 0 USER MOD Single : A 85 HIS : no HE2:sc= 1.08 K(o=1.1,f=-5.3!) USER MOD Single : A 89 SER OG : rot -28:sc= 0.103 USER MOD Single : A 91 THR OG1 : rot -69:sc= -1.01 USER MOD Single : A 98 THR OG1 : rot 143:sc= 0.626 USER MOD Single : A 105 SER OG : rot -170:sc=-0.00262 USER MOD Single : A 107 SER OG : rot 180:sc= 0 USER MOD Single : A 123 ASN : amide:sc= -0.56 X(o=-0.56,f=-0.22) USER MOD Single : A 128 SER OG : rot -110:sc= -2.32! USER MOD Single : A 130 LYS NZ :NH3+ -132:sc= -4.99! (180deg=-7.97!) USER MOD Single : A 131 SER OG : rot 43:sc= -0.122 USER MOD Single : A 140 SER OG : rot 180:sc= 0.243 USER MOD Single : A 141 SER OG : rot 180:sc= 0.00321 USER MOD Single : A 142 ASN : amide:sc= -0.528! X(o=-0.53!,f=-0.13) USER MOD Single : A 143 TYR OH : rot 180:sc= 0 USER MOD Single : A 147 TYR OH : rot 180:sc= 0 USER MOD Single : A 149 HIS : no HD1:sc= 0.51 K(o=0.51,f=-5!) USER MOD Single : A 155 CYS SG : rot 160:sc= -0.453 USER MOD Single : A 156 SER OG : rot 180:sc= 0 USER MOD Single : A 158 MET CE :methyl -159:sc= -0.198 (180deg=-0.724) USER MOD Single : A 161 ASN : amide:sc= -3.35! C(o=-3.3!,f=-5!) USER MOD Single : A 164 TYR OH : rot 180:sc= 0 USER MOD Single : A 165 SER OG : rot 18:sc= 0.0977 USER MOD Single : A 166 LYS NZ :NH3+ 164:sc= 1.22 (180deg=1.05) USER MOD Single : A 169 MET CE :methyl -160:sc= 0 (180deg=-0.58) USER MOD Single : A 172 GLN : amide:sc= 0 K(o=0,f=-0.65) USER MOD Single : A 178 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 180 SER OG : rot 180:sc= 0 USER MOD Single : A 182 SER OG : rot 180:sc= 0.0747 USER MOD Single : A 186 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 187 THR OG1 : rot 180:sc= 0 USER MOD Single : A 188 MET CE :methyl -123:sc= -3.33! (180deg=-5.33!) USER MOD Single : A 190 SER OG : rot 180:sc= 0 USER MOD Single : A 191 ASN : amide:sc= -0.219 X(o=-0.22,f=-0.02) USER MOD Single : A 194 ASN : amide:sc= 0.616 K(o=0.62,f=-0.71) USER MOD Single : A 200 LYS NZ :NH3+ 160:sc= -0.0494 (180deg=-0.364) USER MOD Single : A 206 HIS : +bothHN:sc= -1.74! C(o=-1.7!,f=-10!) USER MOD Single : A 208 THR OG1 : rot 180:sc=-0.00215 USER MOD Single : A 217 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 219 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 220 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 -6.246 -5.237 -22.313 1.00 1.81 N ATOM 2 CA MET A 1 -7.068 -5.876 -21.263 1.00 1.25 C ATOM 3 C MET A 1 -7.709 -4.839 -20.356 1.00 1.04 C ATOM 4 O MET A 1 -7.131 -3.777 -20.115 1.00 1.62 O ATOM 5 CB MET A 1 -6.254 -6.884 -20.435 1.00 1.61 C ATOM 6 CG MET A 1 -4.904 -6.377 -19.957 1.00 2.19 C ATOM 7 SD MET A 1 -3.675 -6.322 -21.275 1.00 2.82 S ATOM 8 CE MET A 1 -3.550 -8.062 -21.693 1.00 3.86 C ATOM 0 H1 MET A 1 -6.682 -5.401 -23.243 1.00 1.81 H new ATOM 0 H2 MET A 1 -6.187 -4.214 -22.134 1.00 1.81 H new ATOM 0 H3 MET A 1 -5.290 -5.646 -22.302 1.00 1.81 H new ATOM 0 HA MET A 1 -7.861 -6.425 -21.771 1.00 1.25 H new ATOM 0 HB2 MET A 1 -6.843 -7.179 -19.567 1.00 1.61 H new ATOM 0 HB3 MET A 1 -6.098 -7.781 -21.034 1.00 1.61 H new ATOM 0 HG2 MET A 1 -5.024 -5.379 -19.536 1.00 2.19 H new ATOM 0 HG3 MET A 1 -4.542 -7.020 -19.155 1.00 2.19 H new ATOM 0 HE1 MET A 1 -2.595 -8.251 -22.184 1.00 3.86 H new ATOM 0 HE2 MET A 1 -3.615 -8.660 -20.784 1.00 3.86 H new ATOM 0 HE3 MET A 1 -4.364 -8.334 -22.365 1.00 3.86 H new ATOM 20 N ASP A 2 -8.895 -5.164 -19.856 1.00 0.84 N ATOM 21 CA ASP A 2 -9.717 -4.253 -19.078 1.00 0.67 C ATOM 22 C ASP A 2 -8.948 -3.620 -17.939 1.00 0.52 C ATOM 23 O ASP A 2 -8.746 -2.408 -17.924 1.00 0.53 O ATOM 24 CB ASP A 2 -10.952 -4.981 -18.520 1.00 0.98 C ATOM 25 CG ASP A 2 -10.705 -6.443 -18.169 1.00 1.50 C ATOM 26 OD1 ASP A 2 -9.535 -6.805 -17.919 1.00 2.25 O ATOM 27 OD2 ASP A 2 -11.674 -7.237 -18.140 1.00 1.72 O ATOM 0 H ASP A 2 -9.317 -6.084 -19.983 1.00 0.84 H new ATOM 0 HA ASP A 2 -10.033 -3.458 -19.754 1.00 0.67 H new ATOM 0 HB2 ASP A 2 -11.297 -4.458 -17.628 1.00 0.98 H new ATOM 0 HB3 ASP A 2 -11.756 -4.925 -19.254 1.00 0.98 H new ATOM 32 N PHE A 3 -8.473 -4.453 -17.024 1.00 0.43 N ATOM 33 CA PHE A 3 -7.889 -3.991 -15.780 1.00 0.34 C ATOM 34 C PHE A 3 -6.680 -3.137 -16.054 1.00 0.37 C ATOM 35 O PHE A 3 -6.343 -2.252 -15.271 1.00 0.40 O ATOM 36 CB PHE A 3 -7.479 -5.167 -14.904 1.00 0.30 C ATOM 37 CG PHE A 3 -8.621 -5.968 -14.349 1.00 0.29 C ATOM 38 CD1 PHE A 3 -9.165 -7.017 -15.066 1.00 0.30 C ATOM 39 CD2 PHE A 3 -9.126 -5.689 -13.095 1.00 0.28 C ATOM 40 CE1 PHE A 3 -10.193 -7.768 -14.544 1.00 0.31 C ATOM 41 CE2 PHE A 3 -10.149 -6.440 -12.561 1.00 0.29 C ATOM 42 CZ PHE A 3 -10.684 -7.480 -13.289 1.00 0.29 C ATOM 0 H PHE A 3 -8.483 -5.468 -17.126 1.00 0.43 H new ATOM 0 HA PHE A 3 -8.642 -3.402 -15.257 1.00 0.34 H new ATOM 0 HB2 PHE A 3 -6.838 -5.829 -15.486 1.00 0.30 H new ATOM 0 HB3 PHE A 3 -6.880 -4.792 -14.074 1.00 0.30 H new ATOM 0 HD1 PHE A 3 -8.779 -7.250 -16.047 1.00 0.30 H new ATOM 0 HD2 PHE A 3 -8.713 -4.870 -12.525 1.00 0.28 H new ATOM 0 HE1 PHE A 3 -10.614 -8.581 -15.116 1.00 0.31 H new ATOM 0 HE2 PHE A 3 -10.530 -6.215 -11.576 1.00 0.29 H new ATOM 0 HZ PHE A 3 -11.489 -8.070 -12.876 1.00 0.29 H new ATOM 52 N LYS A 4 -6.054 -3.381 -17.189 1.00 0.40 N ATOM 53 CA LYS A 4 -4.873 -2.681 -17.540 1.00 0.47 C ATOM 54 C LYS A 4 -5.268 -1.283 -17.917 1.00 0.54 C ATOM 55 O LYS A 4 -4.691 -0.337 -17.448 1.00 0.95 O ATOM 56 CB LYS A 4 -4.117 -3.362 -18.683 1.00 0.54 C ATOM 57 CG LYS A 4 -2.618 -3.186 -18.542 1.00 0.68 C ATOM 58 CD LYS A 4 -1.824 -3.927 -19.605 1.00 0.83 C ATOM 59 CE LYS A 4 -0.331 -3.657 -19.448 1.00 1.10 C ATOM 60 NZ LYS A 4 0.494 -4.451 -20.395 1.00 1.51 N ATOM 0 H LYS A 4 -6.361 -4.068 -17.877 1.00 0.40 H new ATOM 0 HA LYS A 4 -4.191 -2.672 -16.690 1.00 0.47 H new ATOM 0 HB2 LYS A 4 -4.360 -4.425 -18.698 1.00 0.54 H new ATOM 0 HB3 LYS A 4 -4.445 -2.946 -19.636 1.00 0.54 H new ATOM 0 HG2 LYS A 4 -2.377 -2.124 -18.593 1.00 0.68 H new ATOM 0 HG3 LYS A 4 -2.309 -3.536 -17.557 1.00 0.68 H new ATOM 0 HD2 LYS A 4 -2.015 -4.997 -19.529 1.00 0.83 H new ATOM 0 HD3 LYS A 4 -2.153 -3.614 -20.596 1.00 0.83 H new ATOM 0 HE2 LYS A 4 -0.139 -2.596 -19.605 1.00 1.10 H new ATOM 0 HE3 LYS A 4 -0.029 -3.888 -18.426 1.00 1.10 H new ATOM 0 HZ1 LYS A 4 1.250 -3.852 -20.784 1.00 1.51 H new ATOM 0 HZ2 LYS A 4 0.916 -5.259 -19.895 1.00 1.51 H new ATOM 0 HZ3 LYS A 4 -0.105 -4.799 -21.171 1.00 1.51 H new ATOM 74 N ALA A 5 -6.318 -1.176 -18.710 1.00 0.45 N ATOM 75 CA ALA A 5 -6.863 0.111 -19.106 1.00 0.47 C ATOM 76 C ALA A 5 -7.120 1.004 -17.890 1.00 0.42 C ATOM 77 O ALA A 5 -6.814 2.196 -17.905 1.00 0.42 O ATOM 78 CB ALA A 5 -8.148 -0.110 -19.885 1.00 0.54 C ATOM 0 H ALA A 5 -6.817 -1.977 -19.098 1.00 0.45 H new ATOM 0 HA ALA A 5 -6.135 0.621 -19.737 1.00 0.47 H new ATOM 0 HB1 ALA A 5 -8.562 0.853 -20.185 1.00 0.54 H new ATOM 0 HB2 ALA A 5 -7.937 -0.707 -20.772 1.00 0.54 H new ATOM 0 HB3 ALA A 5 -8.868 -0.635 -19.257 1.00 0.54 H new ATOM 84 N ILE A 6 -7.624 0.406 -16.819 1.00 0.42 N ATOM 85 CA ILE A 6 -8.025 1.168 -15.640 1.00 0.43 C ATOM 86 C ILE A 6 -6.800 1.479 -14.793 1.00 0.37 C ATOM 87 O ILE A 6 -6.654 2.565 -14.238 1.00 0.38 O ATOM 88 CB ILE A 6 -9.054 0.403 -14.771 1.00 0.53 C ATOM 89 CG1 ILE A 6 -10.239 -0.074 -15.614 1.00 0.91 C ATOM 90 CG2 ILE A 6 -9.549 1.281 -13.629 1.00 1.07 C ATOM 91 CD1 ILE A 6 -10.338 -1.583 -15.706 1.00 0.65 C ATOM 0 H ILE A 6 -7.765 -0.601 -16.740 1.00 0.42 H new ATOM 0 HA ILE A 6 -8.495 2.086 -15.991 1.00 0.43 H new ATOM 0 HB ILE A 6 -8.553 -0.471 -14.354 1.00 0.53 H new ATOM 0 HG12 ILE A 6 -11.162 0.319 -15.187 1.00 0.91 H new ATOM 0 HG13 ILE A 6 -10.152 0.340 -16.619 1.00 0.91 H new ATOM 0 HG21 ILE A 6 -10.271 0.726 -13.030 1.00 1.07 H new ATOM 0 HG22 ILE A 6 -8.706 1.573 -13.003 1.00 1.07 H new ATOM 0 HG23 ILE A 6 -10.025 2.173 -14.036 1.00 1.07 H new ATOM 0 HD11 ILE A 6 -11.199 -1.855 -16.317 1.00 0.65 H new ATOM 0 HD12 ILE A 6 -9.430 -1.980 -16.161 1.00 0.65 H new ATOM 0 HD13 ILE A 6 -10.456 -2.001 -14.707 1.00 0.65 H new ATOM 103 N ALA A 7 -5.922 0.502 -14.723 1.00 0.33 N ATOM 104 CA ALA A 7 -4.703 0.583 -13.940 1.00 0.31 C ATOM 105 C ALA A 7 -3.663 1.455 -14.608 1.00 0.30 C ATOM 106 O ALA A 7 -2.935 2.184 -13.964 1.00 0.32 O ATOM 107 CB ALA A 7 -4.141 -0.793 -13.809 1.00 0.34 C ATOM 0 H ALA A 7 -6.034 -0.385 -15.215 1.00 0.33 H new ATOM 0 HA ALA A 7 -4.946 1.019 -12.971 1.00 0.31 H new ATOM 0 HB1 ALA A 7 -3.223 -0.757 -13.223 1.00 0.34 H new ATOM 0 HB2 ALA A 7 -4.865 -1.436 -13.309 1.00 0.34 H new ATOM 0 HB3 ALA A 7 -3.924 -1.193 -14.799 1.00 0.34 H new ATOM 113 N GLN A 8 -3.589 1.317 -15.903 1.00 0.31 N ATOM 114 CA GLN A 8 -2.675 2.067 -16.737 1.00 0.34 C ATOM 115 C GLN A 8 -3.001 3.533 -16.655 1.00 0.35 C ATOM 116 O GLN A 8 -2.123 4.391 -16.761 1.00 0.39 O ATOM 117 CB GLN A 8 -2.774 1.562 -18.173 1.00 0.38 C ATOM 118 CG GLN A 8 -1.896 0.373 -18.432 1.00 0.96 C ATOM 119 CD GLN A 8 -1.782 0.037 -19.906 1.00 1.04 C ATOM 120 OE1 GLN A 8 -0.630 -0.477 -20.306 1.00 1.59 O flip ATOM 121 NE2 GLN A 8 -2.716 0.250 -20.679 1.00 1.50 N flip ATOM 0 H GLN A 8 -4.174 0.665 -16.426 1.00 0.31 H new ATOM 0 HA GLN A 8 -1.652 1.927 -16.389 1.00 0.34 H new ATOM 0 HB2 GLN A 8 -3.809 1.298 -18.390 1.00 0.38 H new ATOM 0 HB3 GLN A 8 -2.500 2.366 -18.856 1.00 0.38 H new ATOM 0 HG2 GLN A 8 -0.901 0.567 -18.030 1.00 0.96 H new ATOM 0 HG3 GLN A 8 -2.293 -0.490 -17.897 1.00 0.96 H new ATOM 0 HE21 GLN A 8 -3.587 0.648 -20.329 1.00 1.50 H new ATOM 0 HE22 GLN A 8 -2.618 0.029 -21.670 1.00 1.50 H new ATOM 130 N GLN A 9 -4.269 3.807 -16.434 1.00 0.36 N ATOM 131 CA GLN A 9 -4.693 5.169 -16.160 1.00 0.40 C ATOM 132 C GLN A 9 -4.389 5.490 -14.706 1.00 0.38 C ATOM 133 O GLN A 9 -3.802 6.519 -14.389 1.00 0.45 O ATOM 134 CB GLN A 9 -6.184 5.362 -16.433 1.00 0.48 C ATOM 135 CG GLN A 9 -6.561 5.270 -17.903 1.00 0.74 C ATOM 136 CD GLN A 9 -8.039 5.519 -18.131 1.00 1.65 C ATOM 137 OE1 GLN A 9 -8.674 6.277 -17.394 1.00 2.47 O ATOM 138 NE2 GLN A 9 -8.597 4.887 -19.149 1.00 2.31 N ATOM 0 H GLN A 9 -5.019 3.116 -16.438 1.00 0.36 H new ATOM 0 HA GLN A 9 -4.150 5.843 -16.822 1.00 0.40 H new ATOM 0 HB2 GLN A 9 -6.745 4.611 -15.877 1.00 0.48 H new ATOM 0 HB3 GLN A 9 -6.490 6.336 -16.050 1.00 0.48 H new ATOM 0 HG2 GLN A 9 -5.980 5.996 -18.472 1.00 0.74 H new ATOM 0 HG3 GLN A 9 -6.298 4.283 -18.283 1.00 0.74 H new ATOM 0 HE21 GLN A 9 -8.036 4.268 -19.735 1.00 2.31 H new ATOM 0 HE22 GLN A 9 -9.589 5.018 -19.349 1.00 2.31 H new ATOM 147 N THR A 10 -4.757 4.559 -13.840 1.00 0.34 N ATOM 148 CA THR A 10 -4.608 4.716 -12.405 1.00 0.34 C ATOM 149 C THR A 10 -3.151 4.918 -11.984 1.00 0.30 C ATOM 150 O THR A 10 -2.880 5.674 -11.052 1.00 0.30 O ATOM 151 CB THR A 10 -5.218 3.503 -11.672 1.00 0.37 C ATOM 152 OG1 THR A 10 -6.279 3.934 -10.818 1.00 0.48 O ATOM 153 CG2 THR A 10 -4.179 2.735 -10.865 1.00 0.34 C ATOM 0 H THR A 10 -5.170 3.668 -14.117 1.00 0.34 H new ATOM 0 HA THR A 10 -5.147 5.620 -12.122 1.00 0.34 H new ATOM 0 HB THR A 10 -5.607 2.824 -12.431 1.00 0.37 H new ATOM 0 HG1 THR A 10 -6.738 4.697 -11.226 1.00 0.48 H new ATOM 0 HG21 THR A 10 -4.656 1.891 -10.367 1.00 0.34 H new ATOM 0 HG22 THR A 10 -3.398 2.369 -11.532 1.00 0.34 H new ATOM 0 HG23 THR A 10 -3.738 3.395 -10.118 1.00 0.34 H new ATOM 161 N ALA A 11 -2.219 4.233 -12.647 1.00 0.29 N ATOM 162 CA ALA A 11 -0.804 4.397 -12.333 1.00 0.28 C ATOM 163 C ALA A 11 -0.398 5.863 -12.339 1.00 0.30 C ATOM 164 O ALA A 11 0.186 6.359 -11.382 1.00 0.31 O ATOM 165 CB ALA A 11 0.051 3.627 -13.309 1.00 0.31 C ATOM 0 H ALA A 11 -2.417 3.568 -13.395 1.00 0.29 H new ATOM 0 HA ALA A 11 -0.646 4.002 -11.329 1.00 0.28 H new ATOM 0 HB1 ALA A 11 1.103 3.763 -13.057 1.00 0.31 H new ATOM 0 HB2 ALA A 11 -0.201 2.568 -13.257 1.00 0.31 H new ATOM 0 HB3 ALA A 11 -0.130 3.993 -14.319 1.00 0.31 H new ATOM 171 N GLN A 12 -0.723 6.553 -13.416 1.00 0.35 N ATOM 172 CA GLN A 12 -0.382 7.961 -13.548 1.00 0.40 C ATOM 173 C GLN A 12 -1.376 8.837 -12.789 1.00 0.40 C ATOM 174 O GLN A 12 -1.152 10.034 -12.631 1.00 0.45 O ATOM 175 CB GLN A 12 -0.350 8.359 -15.019 1.00 0.48 C ATOM 176 CG GLN A 12 -1.701 8.236 -15.683 1.00 0.98 C ATOM 177 CD GLN A 12 -1.645 8.476 -17.175 1.00 0.97 C ATOM 178 OE1 GLN A 12 -1.439 7.550 -17.958 1.00 1.30 O ATOM 179 NE2 GLN A 12 -1.837 9.719 -17.580 1.00 1.64 N ATOM 0 H GLN A 12 -1.223 6.163 -14.214 1.00 0.35 H new ATOM 0 HA GLN A 12 0.607 8.113 -13.116 1.00 0.40 H new ATOM 0 HB2 GLN A 12 0.001 9.387 -15.106 1.00 0.48 H new ATOM 0 HB3 GLN A 12 0.368 7.731 -15.546 1.00 0.48 H new ATOM 0 HG2 GLN A 12 -2.104 7.241 -15.495 1.00 0.98 H new ATOM 0 HG3 GLN A 12 -2.389 8.950 -15.230 1.00 0.98 H new ATOM 0 HE21 GLN A 12 -2.005 10.458 -16.897 1.00 1.64 H new ATOM 0 HE22 GLN A 12 -1.818 9.940 -18.576 1.00 1.64 H new ATOM 188 N GLU A 13 -2.477 8.244 -12.332 1.00 0.38 N ATOM 189 CA GLU A 13 -3.436 8.966 -11.492 1.00 0.39 C ATOM 190 C GLU A 13 -2.877 9.116 -10.092 1.00 0.37 C ATOM 191 O GLU A 13 -2.828 10.210 -9.537 1.00 0.42 O ATOM 192 CB GLU A 13 -4.785 8.247 -11.391 1.00 0.43 C ATOM 193 CG GLU A 13 -5.593 8.225 -12.671 1.00 1.10 C ATOM 194 CD GLU A 13 -6.976 7.641 -12.461 1.00 1.65 C ATOM 195 OE1 GLU A 13 -7.087 6.404 -12.292 1.00 2.54 O ATOM 196 OE2 GLU A 13 -7.961 8.408 -12.470 1.00 1.64 O ATOM 0 H GLU A 13 -2.728 7.274 -12.526 1.00 0.38 H new ATOM 0 HA GLU A 13 -3.597 9.937 -11.961 1.00 0.39 H new ATOM 0 HB2 GLU A 13 -4.610 7.220 -11.071 1.00 0.43 H new ATOM 0 HB3 GLU A 13 -5.378 8.726 -10.612 1.00 0.43 H new ATOM 0 HG2 GLU A 13 -5.683 9.239 -13.060 1.00 1.10 H new ATOM 0 HG3 GLU A 13 -5.064 7.641 -13.424 1.00 1.10 H new ATOM 203 N VAL A 14 -2.433 7.999 -9.539 1.00 0.34 N ATOM 204 CA VAL A 14 -1.918 7.975 -8.186 1.00 0.33 C ATOM 205 C VAL A 14 -0.567 8.662 -8.135 1.00 0.33 C ATOM 206 O VAL A 14 -0.235 9.391 -7.198 1.00 0.36 O ATOM 207 CB VAL A 14 -1.802 6.539 -7.654 1.00 0.32 C ATOM 208 CG1 VAL A 14 -0.752 5.728 -8.388 1.00 0.53 C ATOM 209 CG2 VAL A 14 -1.529 6.568 -6.180 1.00 0.49 C ATOM 0 H VAL A 14 -2.420 7.095 -10.011 1.00 0.34 H new ATOM 0 HA VAL A 14 -2.621 8.511 -7.548 1.00 0.33 H new ATOM 0 HB VAL A 14 -2.754 6.039 -7.836 1.00 0.32 H new ATOM 0 HG11 VAL A 14 -0.713 4.722 -7.971 1.00 0.53 H new ATOM 0 HG12 VAL A 14 -1.009 5.673 -9.446 1.00 0.53 H new ATOM 0 HG13 VAL A 14 0.221 6.206 -8.275 1.00 0.53 H new ATOM 0 HG21 VAL A 14 -1.447 5.548 -5.805 1.00 0.49 H new ATOM 0 HG22 VAL A 14 -0.596 7.099 -5.993 1.00 0.49 H new ATOM 0 HG23 VAL A 14 -2.345 7.078 -5.669 1.00 0.49 H new ATOM 219 N LEU A 15 0.196 8.443 -9.178 1.00 0.32 N ATOM 220 CA LEU A 15 1.443 9.105 -9.366 1.00 0.33 C ATOM 221 C LEU A 15 1.190 10.545 -9.723 1.00 0.39 C ATOM 222 O LEU A 15 2.037 11.415 -9.544 1.00 0.43 O ATOM 223 CB LEU A 15 2.167 8.360 -10.450 1.00 0.34 C ATOM 224 CG LEU A 15 3.301 9.088 -11.122 1.00 0.43 C ATOM 225 CD1 LEU A 15 4.414 8.107 -11.404 1.00 0.56 C ATOM 226 CD2 LEU A 15 2.837 9.729 -12.421 1.00 0.60 C ATOM 0 H LEU A 15 -0.044 7.790 -9.924 1.00 0.32 H new ATOM 0 HA LEU A 15 2.055 9.110 -8.464 1.00 0.33 H new ATOM 0 HB2 LEU A 15 2.559 7.435 -10.026 1.00 0.34 H new ATOM 0 HB3 LEU A 15 1.442 8.078 -11.214 1.00 0.34 H new ATOM 0 HG LEU A 15 3.658 9.878 -10.462 1.00 0.43 H new ATOM 0 HD11 LEU A 15 5.241 8.625 -11.891 1.00 0.56 H new ATOM 0 HD12 LEU A 15 4.761 7.671 -10.467 1.00 0.56 H new ATOM 0 HD13 LEU A 15 4.045 7.317 -12.058 1.00 0.56 H new ATOM 0 HD21 LEU A 15 3.673 10.249 -12.889 1.00 0.60 H new ATOM 0 HD22 LEU A 15 2.467 8.957 -13.096 1.00 0.60 H new ATOM 0 HD23 LEU A 15 2.039 10.441 -12.211 1.00 0.60 H new ATOM 238 N GLY A 16 -0.018 10.780 -10.196 1.00 0.43 N ATOM 239 CA GLY A 16 -0.473 12.127 -10.443 1.00 0.50 C ATOM 240 C GLY A 16 -0.594 12.881 -9.146 1.00 0.50 C ATOM 241 O GLY A 16 -0.603 14.104 -9.123 1.00 0.57 O ATOM 0 H GLY A 16 -0.699 10.054 -10.416 1.00 0.43 H new ATOM 0 HA2 GLY A 16 0.225 12.639 -11.106 1.00 0.50 H new ATOM 0 HA3 GLY A 16 -1.437 12.106 -10.951 1.00 0.50 H new ATOM 245 N TYR A 17 -0.651 12.128 -8.058 1.00 0.45 N ATOM 246 CA TYR A 17 -0.718 12.702 -6.730 1.00 0.48 C ATOM 247 C TYR A 17 0.677 12.928 -6.196 1.00 0.50 C ATOM 248 O TYR A 17 0.894 13.794 -5.353 1.00 0.64 O ATOM 249 CB TYR A 17 -1.484 11.795 -5.780 1.00 0.49 C ATOM 250 CG TYR A 17 -2.914 11.571 -6.187 1.00 0.96 C ATOM 251 CD1 TYR A 17 -3.758 12.640 -6.436 1.00 1.59 C ATOM 252 CD2 TYR A 17 -3.415 10.289 -6.323 1.00 1.41 C ATOM 253 CE1 TYR A 17 -5.073 12.436 -6.816 1.00 2.29 C ATOM 254 CE2 TYR A 17 -4.726 10.072 -6.700 1.00 2.13 C ATOM 255 CZ TYR A 17 -5.559 11.166 -6.930 1.00 2.49 C ATOM 256 OH TYR A 17 -6.858 10.940 -7.323 1.00 3.27 O ATOM 0 H TYR A 17 -0.652 11.108 -8.074 1.00 0.45 H new ATOM 0 HA TYR A 17 -1.244 13.654 -6.799 1.00 0.48 H new ATOM 0 HB2 TYR A 17 -0.976 10.832 -5.721 1.00 0.49 H new ATOM 0 HB3 TYR A 17 -1.463 12.228 -4.780 1.00 0.49 H new ATOM 0 HD1 TYR A 17 -3.385 13.648 -6.332 1.00 1.59 H new ATOM 0 HD2 TYR A 17 -2.771 9.444 -6.131 1.00 1.41 H new ATOM 0 HE1 TYR A 17 -5.714 13.281 -7.022 1.00 2.29 H new ATOM 0 HE2 TYR A 17 -5.102 9.066 -6.815 1.00 2.13 H new ATOM 0 HH TYR A 17 -7.029 9.975 -7.350 1.00 3.27 H new ATOM 266 N ASN A 18 1.635 12.142 -6.674 1.00 0.43 N ATOM 267 CA ASN A 18 3.024 12.395 -6.321 1.00 0.51 C ATOM 268 C ASN A 18 3.515 13.658 -7.027 1.00 0.62 C ATOM 269 O ASN A 18 4.462 14.312 -6.591 1.00 0.77 O ATOM 270 CB ASN A 18 3.886 11.178 -6.658 1.00 0.60 C ATOM 271 CG ASN A 18 5.378 11.464 -6.613 1.00 1.20 C ATOM 272 OD1 ASN A 18 5.986 11.255 -5.457 1.00 2.03 O flip ATOM 273 ND2 ASN A 18 5.979 11.860 -7.613 1.00 1.65 N flip ATOM 0 H ASN A 18 1.481 11.345 -7.291 1.00 0.43 H new ATOM 0 HA ASN A 18 3.104 12.561 -5.247 1.00 0.51 H new ATOM 0 HB2 ASN A 18 3.656 10.374 -5.958 1.00 0.60 H new ATOM 0 HB3 ASN A 18 3.622 10.819 -7.653 1.00 0.60 H new ATOM 0 HD21 ASN A 18 5.473 12.009 -8.486 1.00 1.65 H new ATOM 0 HD22 ASN A 18 6.982 12.039 -7.568 1.00 1.65 H new ATOM 280 N ARG A 19 2.815 14.024 -8.092 1.00 0.61 N ATOM 281 CA ARG A 19 3.152 15.216 -8.863 1.00 0.80 C ATOM 282 C ARG A 19 2.277 16.384 -8.441 1.00 0.90 C ATOM 283 O ARG A 19 2.605 17.547 -8.675 1.00 1.10 O ATOM 284 CB ARG A 19 2.937 14.947 -10.346 1.00 0.83 C ATOM 285 CG ARG A 19 3.751 13.787 -10.872 1.00 1.26 C ATOM 286 CD ARG A 19 3.004 13.052 -11.966 1.00 1.01 C ATOM 287 NE ARG A 19 2.436 13.964 -12.957 1.00 1.65 N ATOM 288 CZ ARG A 19 1.270 13.769 -13.570 1.00 1.85 C ATOM 289 NH1 ARG A 19 0.568 12.667 -13.342 1.00 1.70 N ATOM 290 NH2 ARG A 19 0.806 14.676 -14.416 1.00 2.72 N ATOM 0 H ARG A 19 2.007 13.511 -8.444 1.00 0.61 H new ATOM 0 HA ARG A 19 4.197 15.464 -8.678 1.00 0.80 H new ATOM 0 HB2 ARG A 19 1.880 14.748 -10.522 1.00 0.83 H new ATOM 0 HB3 ARG A 19 3.191 15.844 -10.911 1.00 0.83 H new ATOM 0 HG2 ARG A 19 4.703 14.151 -11.258 1.00 1.26 H new ATOM 0 HG3 ARG A 19 3.980 13.100 -10.058 1.00 1.26 H new ATOM 0 HD2 ARG A 19 3.681 12.356 -12.461 1.00 1.01 H new ATOM 0 HD3 ARG A 19 2.205 12.458 -11.522 1.00 1.01 H new ATOM 0 HE ARG A 19 2.966 14.803 -13.194 1.00 1.65 H new ATOM 0 HH11 ARG A 19 0.921 11.963 -12.694 1.00 1.70 H new ATOM 0 HH12 ARG A 19 -0.324 12.524 -13.815 1.00 1.70 H new ATOM 0 HH21 ARG A 19 1.342 15.525 -14.598 1.00 2.72 H new ATOM 0 HH22 ARG A 19 -0.087 14.526 -14.885 1.00 2.72 H new ATOM 304 N ASP A 20 1.153 16.058 -7.832 1.00 0.87 N ATOM 305 CA ASP A 20 0.195 17.066 -7.406 1.00 1.08 C ATOM 306 C ASP A 20 0.069 17.081 -5.899 1.00 0.94 C ATOM 307 O ASP A 20 -0.579 16.218 -5.301 1.00 1.32 O ATOM 308 CB ASP A 20 -1.174 16.801 -7.999 1.00 1.59 C ATOM 309 CG ASP A 20 -2.103 17.986 -7.840 1.00 1.74 C ATOM 310 OD1 ASP A 20 -2.053 18.902 -8.691 1.00 1.91 O ATOM 311 OD2 ASP A 20 -2.890 18.007 -6.871 1.00 2.16 O ATOM 0 H ASP A 20 0.878 15.099 -7.619 1.00 0.87 H new ATOM 0 HA ASP A 20 0.564 18.030 -7.757 1.00 1.08 H new ATOM 0 HB2 ASP A 20 -1.070 16.562 -9.057 1.00 1.59 H new ATOM 0 HB3 ASP A 20 -1.615 15.928 -7.517 1.00 1.59 H new ATOM 316 N THR A 21 0.685 18.054 -5.287 1.00 0.91 N ATOM 317 CA THR A 21 0.639 18.182 -3.857 1.00 1.05 C ATOM 318 C THR A 21 0.062 19.532 -3.479 1.00 1.13 C ATOM 319 O THR A 21 0.747 20.555 -3.498 1.00 1.46 O ATOM 320 CB THR A 21 2.037 17.954 -3.274 1.00 1.45 C ATOM 321 OG1 THR A 21 3.009 18.752 -3.967 1.00 1.82 O ATOM 322 CG2 THR A 21 2.382 16.478 -3.400 1.00 1.70 C ATOM 0 H THR A 21 1.229 18.775 -5.761 1.00 0.91 H new ATOM 0 HA THR A 21 -0.017 17.423 -3.432 1.00 1.05 H new ATOM 0 HB THR A 21 2.047 18.249 -2.225 1.00 1.45 H new ATOM 0 HG1 THR A 21 2.659 19.659 -4.092 1.00 1.82 H new ATOM 0 HG21 THR A 21 3.376 16.300 -2.989 1.00 1.70 H new ATOM 0 HG22 THR A 21 1.650 15.885 -2.851 1.00 1.70 H new ATOM 0 HG23 THR A 21 2.367 16.189 -4.451 1.00 1.70 H new ATOM 330 N SER A 22 -1.221 19.531 -3.145 1.00 1.05 N ATOM 331 CA SER A 22 -1.969 20.768 -3.077 1.00 1.30 C ATOM 332 C SER A 22 -3.051 20.696 -2.015 1.00 1.31 C ATOM 333 O SER A 22 -3.641 19.637 -1.788 1.00 2.15 O ATOM 334 CB SER A 22 -2.624 21.046 -4.434 1.00 1.67 C ATOM 335 OG SER A 22 -1.685 20.957 -5.497 1.00 2.19 O ATOM 0 H SER A 22 -1.757 18.693 -2.920 1.00 1.05 H new ATOM 0 HA SER A 22 -1.276 21.569 -2.818 1.00 1.30 H new ATOM 0 HB2 SER A 22 -3.432 20.334 -4.601 1.00 1.67 H new ATOM 0 HB3 SER A 22 -3.072 22.040 -4.426 1.00 1.67 H new ATOM 0 HG SER A 22 -2.136 21.138 -6.348 1.00 2.19 H new ATOM 341 N GLY A 23 -3.288 21.820 -1.357 1.00 0.96 N ATOM 342 CA GLY A 23 -4.432 21.950 -0.480 1.00 1.10 C ATOM 343 C GLY A 23 -4.235 21.334 0.890 1.00 0.89 C ATOM 344 O GLY A 23 -4.581 21.953 1.899 1.00 1.01 O ATOM 0 H GLY A 23 -2.702 22.653 -1.416 1.00 0.96 H new ATOM 0 HA2 GLY A 23 -4.666 23.008 -0.361 1.00 1.10 H new ATOM 0 HA3 GLY A 23 -5.295 21.484 -0.955 1.00 1.10 H new ATOM 348 N TRP A 24 -3.689 20.122 0.943 1.00 0.79 N ATOM 349 CA TRP A 24 -3.614 19.396 2.183 1.00 0.66 C ATOM 350 C TRP A 24 -2.433 19.798 3.036 1.00 0.67 C ATOM 351 O TRP A 24 -1.867 20.884 2.877 1.00 0.83 O ATOM 352 CB TRP A 24 -3.644 17.922 1.873 1.00 0.71 C ATOM 353 CG TRP A 24 -2.481 17.314 1.170 1.00 0.81 C ATOM 354 CD1 TRP A 24 -2.480 16.036 0.767 1.00 1.34 C ATOM 355 CD2 TRP A 24 -1.196 17.861 0.778 1.00 0.87 C ATOM 356 NE1 TRP A 24 -1.307 15.726 0.191 1.00 1.41 N ATOM 357 CE2 TRP A 24 -0.497 16.807 0.175 1.00 0.99 C ATOM 358 CE3 TRP A 24 -0.554 19.102 0.874 1.00 1.36 C ATOM 359 CZ2 TRP A 24 0.787 16.937 -0.323 1.00 1.09 C ATOM 360 CZ3 TRP A 24 0.730 19.230 0.375 1.00 1.67 C ATOM 361 CH2 TRP A 24 1.386 18.146 -0.215 1.00 1.37 C ATOM 0 H TRP A 24 -3.296 19.633 0.138 1.00 0.79 H new ATOM 0 HA TRP A 24 -4.479 19.649 2.796 1.00 0.66 H new ATOM 0 HB2 TRP A 24 -3.776 17.389 2.815 1.00 0.71 H new ATOM 0 HB3 TRP A 24 -4.532 17.729 1.271 1.00 0.71 H new ATOM 0 HD1 TRP A 24 -3.306 15.351 0.888 1.00 1.34 H new ATOM 0 HE1 TRP A 24 -1.063 14.808 -0.180 1.00 1.41 H new ATOM 0 HE3 TRP A 24 -1.053 19.945 1.330 1.00 1.36 H new ATOM 0 HZ2 TRP A 24 1.295 16.102 -0.783 1.00 1.09 H new ATOM 0 HZ3 TRP A 24 1.234 20.183 0.442 1.00 1.67 H new ATOM 0 HH2 TRP A 24 2.390 18.275 -0.592 1.00 1.37 H new ATOM 372 N LYS A 25 -2.044 18.900 3.908 1.00 0.60 N ATOM 373 CA LYS A 25 -1.156 19.233 4.997 1.00 0.70 C ATOM 374 C LYS A 25 -0.897 18.024 5.836 1.00 0.61 C ATOM 375 O LYS A 25 -1.742 17.145 5.964 1.00 0.59 O ATOM 376 CB LYS A 25 -1.740 20.319 5.900 1.00 0.89 C ATOM 377 CG LYS A 25 -1.149 21.708 5.690 1.00 1.29 C ATOM 378 CD LYS A 25 0.361 21.765 5.915 1.00 1.62 C ATOM 379 CE LYS A 25 1.147 21.269 4.707 1.00 2.23 C ATOM 380 NZ LYS A 25 0.769 21.980 3.456 1.00 2.95 N ATOM 0 H LYS A 25 -2.332 17.922 3.884 1.00 0.60 H new ATOM 0 HA LYS A 25 -0.233 19.602 4.551 1.00 0.70 H new ATOM 0 HB2 LYS A 25 -2.816 20.369 5.736 1.00 0.89 H new ATOM 0 HB3 LYS A 25 -1.589 20.028 6.940 1.00 0.89 H new ATOM 0 HG2 LYS A 25 -1.371 22.039 4.676 1.00 1.29 H new ATOM 0 HG3 LYS A 25 -1.637 22.409 6.368 1.00 1.29 H new ATOM 0 HD2 LYS A 25 0.654 22.791 6.139 1.00 1.62 H new ATOM 0 HD3 LYS A 25 0.619 21.162 6.786 1.00 1.62 H new ATOM 0 HE2 LYS A 25 2.213 21.403 4.890 1.00 2.23 H new ATOM 0 HE3 LYS A 25 0.977 20.200 4.580 1.00 2.23 H new ATOM 0 HZ1 LYS A 25 1.512 21.843 2.741 1.00 2.95 H new ATOM 0 HZ2 LYS A 25 -0.130 21.599 3.099 1.00 2.95 H new ATOM 0 HZ3 LYS A 25 0.661 22.996 3.653 1.00 2.95 H new ATOM 394 N VAL A 26 0.276 18.005 6.406 1.00 0.63 N ATOM 395 CA VAL A 26 0.687 16.929 7.262 1.00 0.58 C ATOM 396 C VAL A 26 -0.217 16.779 8.455 1.00 0.66 C ATOM 397 O VAL A 26 -0.459 17.722 9.208 1.00 0.80 O ATOM 398 CB VAL A 26 2.122 17.113 7.735 1.00 0.64 C ATOM 399 CG1 VAL A 26 3.047 16.726 6.624 1.00 1.22 C ATOM 400 CG2 VAL A 26 2.381 18.542 8.162 1.00 1.56 C ATOM 0 H VAL A 26 0.975 18.738 6.289 1.00 0.63 H new ATOM 0 HA VAL A 26 0.622 16.020 6.664 1.00 0.58 H new ATOM 0 HB VAL A 26 2.295 16.477 8.603 1.00 0.64 H new ATOM 0 HG11 VAL A 26 4.080 16.853 6.949 1.00 1.22 H new ATOM 0 HG12 VAL A 26 2.877 15.683 6.355 1.00 1.22 H new ATOM 0 HG13 VAL A 26 2.859 17.359 5.757 1.00 1.22 H new ATOM 0 HG21 VAL A 26 3.414 18.641 8.494 1.00 1.56 H new ATOM 0 HG22 VAL A 26 2.205 19.211 7.320 1.00 1.56 H new ATOM 0 HG23 VAL A 26 1.710 18.805 8.980 1.00 1.56 H new ATOM 410 N VAL A 27 -0.726 15.584 8.596 1.00 0.62 N ATOM 411 CA VAL A 27 -1.509 15.230 9.742 1.00 0.73 C ATOM 412 C VAL A 27 -0.613 14.497 10.720 1.00 0.76 C ATOM 413 O VAL A 27 -0.846 14.517 11.929 1.00 0.90 O ATOM 414 CB VAL A 27 -2.728 14.358 9.360 1.00 0.75 C ATOM 415 CG1 VAL A 27 -2.282 13.019 8.793 1.00 1.21 C ATOM 416 CG2 VAL A 27 -3.650 14.157 10.553 1.00 1.22 C ATOM 0 H VAL A 27 -0.608 14.831 7.918 1.00 0.62 H new ATOM 0 HA VAL A 27 -1.906 16.137 10.197 1.00 0.73 H new ATOM 0 HB VAL A 27 -3.286 14.885 8.586 1.00 0.75 H new ATOM 0 HG11 VAL A 27 -3.158 12.424 8.532 1.00 1.21 H new ATOM 0 HG12 VAL A 27 -1.677 13.185 7.901 1.00 1.21 H new ATOM 0 HG13 VAL A 27 -1.691 12.487 9.538 1.00 1.21 H new ATOM 0 HG21 VAL A 27 -4.499 13.541 10.257 1.00 1.22 H new ATOM 0 HG22 VAL A 27 -3.104 13.661 11.356 1.00 1.22 H new ATOM 0 HG23 VAL A 27 -4.009 15.125 10.903 1.00 1.22 H new ATOM 426 N LYS A 28 0.449 13.870 10.203 1.00 0.65 N ATOM 427 CA LYS A 28 1.339 13.136 11.072 1.00 0.68 C ATOM 428 C LYS A 28 2.733 13.035 10.475 1.00 0.58 C ATOM 429 O LYS A 28 2.902 13.028 9.257 1.00 0.55 O ATOM 430 CB LYS A 28 0.783 11.736 11.353 1.00 0.77 C ATOM 431 CG LYS A 28 1.130 11.231 12.738 1.00 0.87 C ATOM 432 CD LYS A 28 0.552 12.165 13.778 1.00 1.45 C ATOM 433 CE LYS A 28 1.142 11.925 15.154 1.00 2.02 C ATOM 434 NZ LYS A 28 0.697 12.959 16.120 1.00 2.41 N ATOM 0 H LYS A 28 0.699 13.861 9.214 1.00 0.65 H new ATOM 0 HA LYS A 28 1.411 13.683 12.012 1.00 0.68 H new ATOM 0 HB2 LYS A 28 -0.301 11.751 11.238 1.00 0.77 H new ATOM 0 HB3 LYS A 28 1.172 11.040 10.610 1.00 0.77 H new ATOM 0 HG2 LYS A 28 0.735 10.225 12.879 1.00 0.87 H new ATOM 0 HG3 LYS A 28 2.212 11.168 12.853 1.00 0.87 H new ATOM 0 HD2 LYS A 28 0.737 13.197 13.480 1.00 1.45 H new ATOM 0 HD3 LYS A 28 -0.529 12.034 13.820 1.00 1.45 H new ATOM 0 HE2 LYS A 28 0.846 10.939 15.512 1.00 2.02 H new ATOM 0 HE3 LYS A 28 2.230 11.928 15.091 1.00 2.02 H new ATOM 0 HZ1 LYS A 28 1.117 12.767 17.052 1.00 2.41 H new ATOM 0 HZ2 LYS A 28 1.001 13.897 15.789 1.00 2.41 H new ATOM 0 HZ3 LYS A 28 -0.340 12.939 16.197 1.00 2.41 H new ATOM 448 N THR A 29 3.726 12.981 11.344 1.00 0.61 N ATOM 449 CA THR A 29 5.100 12.784 10.931 1.00 0.59 C ATOM 450 C THR A 29 5.836 11.951 11.972 1.00 0.72 C ATOM 451 O THR A 29 5.479 11.963 13.149 1.00 0.88 O ATOM 452 CB THR A 29 5.840 14.123 10.749 1.00 0.75 C ATOM 453 OG1 THR A 29 5.691 14.926 11.927 1.00 1.38 O ATOM 454 CG2 THR A 29 5.322 14.890 9.541 1.00 0.82 C ATOM 0 H THR A 29 3.602 13.072 12.352 1.00 0.61 H new ATOM 0 HA THR A 29 5.083 12.267 9.971 1.00 0.59 H new ATOM 0 HB THR A 29 6.894 13.901 10.582 1.00 0.75 H new ATOM 0 HG1 THR A 29 6.165 15.775 11.806 1.00 1.38 H new ATOM 0 HG21 THR A 29 5.868 15.829 9.445 1.00 0.82 H new ATOM 0 HG22 THR A 29 5.467 14.292 8.641 1.00 0.82 H new ATOM 0 HG23 THR A 29 4.260 15.099 9.671 1.00 0.82 H new ATOM 462 N SER A 30 6.839 11.213 11.540 1.00 0.80 N ATOM 463 CA SER A 30 7.663 10.452 12.465 1.00 1.04 C ATOM 464 C SER A 30 9.140 10.744 12.228 1.00 1.45 C ATOM 465 O SER A 30 9.954 9.830 12.124 1.00 2.37 O ATOM 466 CB SER A 30 7.372 8.955 12.344 1.00 1.24 C ATOM 467 OG SER A 30 5.998 8.692 12.574 1.00 1.93 O ATOM 0 H SER A 30 7.104 11.122 10.559 1.00 0.80 H new ATOM 0 HA SER A 30 7.416 10.759 13.481 1.00 1.04 H new ATOM 0 HB2 SER A 30 7.654 8.604 11.351 1.00 1.24 H new ATOM 0 HB3 SER A 30 7.978 8.402 13.062 1.00 1.24 H new ATOM 0 HG SER A 30 5.831 7.730 12.491 1.00 1.93 H new ATOM 473 N LYS A 31 9.442 12.038 12.071 1.00 1.32 N ATOM 474 CA LYS A 31 10.808 12.578 12.057 1.00 1.71 C ATOM 475 C LYS A 31 11.630 12.022 10.900 1.00 1.47 C ATOM 476 O LYS A 31 12.860 12.096 10.902 1.00 2.02 O ATOM 477 CB LYS A 31 11.510 12.358 13.412 1.00 2.29 C ATOM 478 CG LYS A 31 12.106 10.972 13.622 1.00 2.73 C ATOM 479 CD LYS A 31 12.517 10.750 15.068 1.00 3.59 C ATOM 480 CE LYS A 31 11.355 10.268 15.931 1.00 4.18 C ATOM 481 NZ LYS A 31 10.299 11.301 16.123 1.00 4.55 N ATOM 0 H LYS A 31 8.728 12.756 11.947 1.00 1.32 H new ATOM 0 HA LYS A 31 10.729 13.653 11.898 1.00 1.71 H new ATOM 0 HB2 LYS A 31 12.306 13.096 13.514 1.00 2.29 H new ATOM 0 HB3 LYS A 31 10.792 12.551 14.209 1.00 2.29 H new ATOM 0 HG2 LYS A 31 11.378 10.215 13.330 1.00 2.73 H new ATOM 0 HG3 LYS A 31 12.973 10.847 12.974 1.00 2.73 H new ATOM 0 HD2 LYS A 31 13.324 10.018 15.106 1.00 3.59 H new ATOM 0 HD3 LYS A 31 12.911 11.680 15.479 1.00 3.59 H new ATOM 0 HE2 LYS A 31 10.911 9.385 15.471 1.00 4.18 H new ATOM 0 HE3 LYS A 31 11.737 9.962 16.905 1.00 4.18 H new ATOM 0 HZ1 LYS A 31 9.717 11.053 16.948 1.00 4.55 H new ATOM 0 HZ2 LYS A 31 10.744 12.228 16.279 1.00 4.55 H new ATOM 0 HZ3 LYS A 31 9.698 11.344 15.276 1.00 4.55 H new ATOM 495 N LYS A 32 10.934 11.507 9.896 1.00 0.87 N ATOM 496 CA LYS A 32 11.572 11.020 8.685 1.00 0.69 C ATOM 497 C LYS A 32 10.513 10.614 7.669 1.00 0.51 C ATOM 498 O LYS A 32 10.781 10.494 6.466 1.00 0.59 O ATOM 499 CB LYS A 32 12.491 9.834 8.975 1.00 0.80 C ATOM 500 CG LYS A 32 13.593 9.674 7.939 1.00 1.00 C ATOM 501 CD LYS A 32 14.461 10.923 7.871 1.00 0.93 C ATOM 502 CE LYS A 32 15.514 10.830 6.777 1.00 1.14 C ATOM 503 NZ LYS A 32 16.299 12.087 6.667 1.00 1.42 N ATOM 0 H LYS A 32 9.918 11.416 9.899 1.00 0.87 H new ATOM 0 HA LYS A 32 12.181 11.828 8.279 1.00 0.69 H new ATOM 0 HB2 LYS A 32 12.940 9.961 9.960 1.00 0.80 H new ATOM 0 HB3 LYS A 32 11.897 8.921 9.011 1.00 0.80 H new ATOM 0 HG2 LYS A 32 14.210 8.811 8.189 1.00 1.00 H new ATOM 0 HG3 LYS A 32 13.153 9.479 6.961 1.00 1.00 H new ATOM 0 HD2 LYS A 32 13.830 11.793 7.693 1.00 0.93 H new ATOM 0 HD3 LYS A 32 14.951 11.076 8.833 1.00 0.93 H new ATOM 0 HE2 LYS A 32 16.186 9.998 6.987 1.00 1.14 H new ATOM 0 HE3 LYS A 32 15.031 10.617 5.823 1.00 1.14 H new ATOM 0 HZ1 LYS A 32 17.007 11.989 5.912 1.00 1.42 H new ATOM 0 HZ2 LYS A 32 15.660 12.877 6.442 1.00 1.42 H new ATOM 0 HZ3 LYS A 32 16.779 12.277 7.570 1.00 1.42 H new ATOM 517 N ILE A 33 9.318 10.359 8.183 1.00 0.37 N ATOM 518 CA ILE A 33 8.156 10.132 7.349 1.00 0.33 C ATOM 519 C ILE A 33 7.120 11.208 7.619 1.00 0.36 C ATOM 520 O ILE A 33 7.099 11.806 8.698 1.00 0.46 O ATOM 521 CB ILE A 33 7.537 8.744 7.579 1.00 0.41 C ATOM 522 CG1 ILE A 33 7.067 8.600 9.022 1.00 0.58 C ATOM 523 CG2 ILE A 33 8.551 7.664 7.242 1.00 0.76 C ATOM 524 CD1 ILE A 33 6.173 7.400 9.241 1.00 0.75 C ATOM 0 H ILE A 33 9.132 10.305 9.184 1.00 0.37 H new ATOM 0 HA ILE A 33 8.481 10.175 6.310 1.00 0.33 H new ATOM 0 HB ILE A 33 6.672 8.633 6.926 1.00 0.41 H new ATOM 0 HG12 ILE A 33 7.937 8.521 9.674 1.00 0.58 H new ATOM 0 HG13 ILE A 33 6.531 9.503 9.314 1.00 0.58 H new ATOM 0 HG21 ILE A 33 8.106 6.683 7.407 1.00 0.76 H new ATOM 0 HG22 ILE A 33 8.848 7.757 6.197 1.00 0.76 H new ATOM 0 HG23 ILE A 33 9.428 7.777 7.879 1.00 0.76 H new ATOM 0 HD11 ILE A 33 5.874 7.355 10.288 1.00 0.75 H new ATOM 0 HD12 ILE A 33 5.286 7.488 8.614 1.00 0.75 H new ATOM 0 HD13 ILE A 33 6.714 6.491 8.979 1.00 0.75 H new ATOM 536 N THR A 34 6.261 11.429 6.646 1.00 0.33 N ATOM 537 CA THR A 34 5.424 12.614 6.602 1.00 0.36 C ATOM 538 C THR A 34 4.122 12.319 5.861 1.00 0.36 C ATOM 539 O THR A 34 4.142 12.003 4.680 1.00 0.39 O ATOM 540 CB THR A 34 6.217 13.718 5.866 1.00 0.39 C ATOM 541 OG1 THR A 34 7.458 13.970 6.539 1.00 0.58 O ATOM 542 CG2 THR A 34 5.443 15.005 5.759 1.00 0.56 C ATOM 0 H THR A 34 6.122 10.792 5.861 1.00 0.33 H new ATOM 0 HA THR A 34 5.167 12.934 7.612 1.00 0.36 H new ATOM 0 HB THR A 34 6.404 13.353 4.856 1.00 0.39 H new ATOM 0 HG1 THR A 34 7.952 14.670 6.063 1.00 0.58 H new ATOM 0 HG21 THR A 34 6.043 15.748 5.234 1.00 0.56 H new ATOM 0 HG22 THR A 34 4.519 14.829 5.207 1.00 0.56 H new ATOM 0 HG23 THR A 34 5.205 15.371 6.758 1.00 0.56 H new ATOM 550 N VAL A 35 2.996 12.389 6.562 1.00 0.39 N ATOM 551 CA VAL A 35 1.703 12.128 5.935 1.00 0.40 C ATOM 552 C VAL A 35 0.835 13.379 5.874 1.00 0.40 C ATOM 553 O VAL A 35 0.483 13.958 6.899 1.00 0.44 O ATOM 554 CB VAL A 35 0.918 10.994 6.634 1.00 0.48 C ATOM 555 CG1 VAL A 35 1.521 9.646 6.306 1.00 0.82 C ATOM 556 CG2 VAL A 35 0.872 11.171 8.131 1.00 0.86 C ATOM 0 H VAL A 35 2.950 12.622 7.554 1.00 0.39 H new ATOM 0 HA VAL A 35 1.935 11.807 4.920 1.00 0.40 H new ATOM 0 HB VAL A 35 -0.103 11.041 6.256 1.00 0.48 H new ATOM 0 HG11 VAL A 35 0.954 8.862 6.808 1.00 0.82 H new ATOM 0 HG12 VAL A 35 1.488 9.485 5.228 1.00 0.82 H new ATOM 0 HG13 VAL A 35 2.557 9.618 6.645 1.00 0.82 H new ATOM 0 HG21 VAL A 35 0.310 10.350 8.577 1.00 0.86 H new ATOM 0 HG22 VAL A 35 1.887 11.174 8.528 1.00 0.86 H new ATOM 0 HG23 VAL A 35 0.385 12.116 8.371 1.00 0.86 H new ATOM 566 N SER A 36 0.511 13.789 4.661 1.00 0.42 N ATOM 567 CA SER A 36 -0.358 14.929 4.417 1.00 0.42 C ATOM 568 C SER A 36 -1.768 14.465 4.066 1.00 0.43 C ATOM 569 O SER A 36 -1.968 13.628 3.188 1.00 0.47 O ATOM 570 CB SER A 36 0.255 15.785 3.320 1.00 0.45 C ATOM 571 OG SER A 36 0.852 14.975 2.323 1.00 1.10 O ATOM 0 H SER A 36 0.846 13.337 3.810 1.00 0.42 H new ATOM 0 HA SER A 36 -0.446 15.534 5.320 1.00 0.42 H new ATOM 0 HB2 SER A 36 -0.514 16.414 2.871 1.00 0.45 H new ATOM 0 HB3 SER A 36 1.003 16.452 3.749 1.00 0.45 H new ATOM 0 HG SER A 36 0.683 15.365 1.440 1.00 1.10 H new ATOM 577 N SER A 37 -2.734 15.020 4.774 1.00 0.45 N ATOM 578 CA SER A 37 -4.111 14.563 4.705 1.00 0.48 C ATOM 579 C SER A 37 -4.978 15.552 3.937 1.00 0.53 C ATOM 580 O SER A 37 -4.977 16.746 4.232 1.00 0.59 O ATOM 581 CB SER A 37 -4.662 14.384 6.123 1.00 0.59 C ATOM 582 OG SER A 37 -6.023 13.986 6.113 1.00 1.27 O ATOM 0 H SER A 37 -2.587 15.801 5.414 1.00 0.45 H new ATOM 0 HA SER A 37 -4.132 13.610 4.177 1.00 0.48 H new ATOM 0 HB2 SER A 37 -4.069 13.638 6.652 1.00 0.59 H new ATOM 0 HB3 SER A 37 -4.561 15.320 6.673 1.00 0.59 H new ATOM 0 HG SER A 37 -6.098 13.068 6.448 1.00 1.27 H new ATOM 588 N LYS A 38 -5.711 15.051 2.954 1.00 0.59 N ATOM 589 CA LYS A 38 -6.617 15.884 2.169 1.00 0.76 C ATOM 590 C LYS A 38 -8.053 15.358 2.247 1.00 0.90 C ATOM 591 O LYS A 38 -8.783 15.674 3.186 1.00 1.69 O ATOM 592 CB LYS A 38 -6.164 15.962 0.705 1.00 0.99 C ATOM 593 CG LYS A 38 -6.779 17.124 -0.065 1.00 1.06 C ATOM 594 CD LYS A 38 -6.293 17.166 -1.507 1.00 1.11 C ATOM 595 CE LYS A 38 -7.011 16.148 -2.384 1.00 1.44 C ATOM 596 NZ LYS A 38 -8.401 16.571 -2.709 1.00 1.91 N ATOM 0 H LYS A 38 -5.698 14.069 2.678 1.00 0.59 H new ATOM 0 HA LYS A 38 -6.592 16.888 2.594 1.00 0.76 H new ATOM 0 HB2 LYS A 38 -5.078 16.051 0.674 1.00 0.99 H new ATOM 0 HB3 LYS A 38 -6.421 15.029 0.204 1.00 0.99 H new ATOM 0 HG2 LYS A 38 -7.865 17.036 -0.050 1.00 1.06 H new ATOM 0 HG3 LYS A 38 -6.528 18.062 0.431 1.00 1.06 H new ATOM 0 HD2 LYS A 38 -6.448 18.166 -1.912 1.00 1.11 H new ATOM 0 HD3 LYS A 38 -5.220 16.974 -1.533 1.00 1.11 H new ATOM 0 HE2 LYS A 38 -6.450 16.006 -3.308 1.00 1.44 H new ATOM 0 HE3 LYS A 38 -7.035 15.184 -1.875 1.00 1.44 H new ATOM 0 HZ1 LYS A 38 -8.806 15.922 -3.413 1.00 1.91 H new ATOM 0 HZ2 LYS A 38 -8.981 16.551 -1.846 1.00 1.91 H new ATOM 0 HZ3 LYS A 38 -8.389 17.537 -3.095 1.00 1.91 H new ATOM 610 N ALA A 39 -8.442 14.530 1.278 1.00 1.16 N ATOM 611 CA ALA A 39 -9.804 14.004 1.214 1.00 1.25 C ATOM 612 C ALA A 39 -9.885 12.831 0.243 1.00 1.19 C ATOM 613 O ALA A 39 -9.288 12.859 -0.829 1.00 1.50 O ATOM 614 CB ALA A 39 -10.776 15.097 0.797 1.00 1.68 C ATOM 0 H ALA A 39 -7.832 14.209 0.526 1.00 1.16 H new ATOM 0 HA ALA A 39 -10.079 13.650 2.208 1.00 1.25 H new ATOM 0 HB1 ALA A 39 -11.786 14.689 0.754 1.00 1.68 H new ATOM 0 HB2 ALA A 39 -10.743 15.909 1.523 1.00 1.68 H new ATOM 0 HB3 ALA A 39 -10.496 15.477 -0.186 1.00 1.68 H new ATOM 620 N SER A 40 -10.610 11.799 0.655 1.00 1.11 N ATOM 621 CA SER A 40 -10.799 10.589 -0.140 1.00 1.35 C ATOM 622 C SER A 40 -12.005 10.737 -1.041 1.00 1.53 C ATOM 623 O SER A 40 -11.933 11.300 -2.130 1.00 2.09 O ATOM 624 CB SER A 40 -11.002 9.413 0.811 1.00 1.66 C ATOM 625 OG SER A 40 -11.304 8.212 0.121 1.00 2.06 O ATOM 0 H SER A 40 -11.087 11.776 1.556 1.00 1.11 H new ATOM 0 HA SER A 40 -9.923 10.418 -0.766 1.00 1.35 H new ATOM 0 HB2 SER A 40 -10.101 9.271 1.407 1.00 1.66 H new ATOM 0 HB3 SER A 40 -11.810 9.644 1.505 1.00 1.66 H new ATOM 0 HG SER A 40 -10.578 7.567 0.254 1.00 2.06 H new ATOM 631 N ARG A 41 -13.125 10.240 -0.554 1.00 1.87 N ATOM 632 CA ARG A 41 -14.401 10.437 -1.191 1.00 2.15 C ATOM 633 C ARG A 41 -14.980 11.748 -0.683 1.00 1.92 C ATOM 634 O ARG A 41 -16.154 12.056 -0.879 1.00 2.12 O ATOM 635 CB ARG A 41 -15.313 9.262 -0.860 1.00 3.07 C ATOM 636 CG ARG A 41 -16.560 9.187 -1.727 1.00 3.62 C ATOM 637 CD ARG A 41 -17.611 8.257 -1.139 1.00 4.44 C ATOM 638 NE ARG A 41 -17.140 6.878 -0.996 1.00 4.95 N ATOM 639 CZ ARG A 41 -17.807 5.816 -1.454 1.00 5.91 C ATOM 640 NH1 ARG A 41 -18.920 5.983 -2.160 1.00 6.46 N ATOM 641 NH2 ARG A 41 -17.356 4.592 -1.208 1.00 6.61 N ATOM 0 H ARG A 41 -13.170 9.685 0.301 1.00 1.87 H new ATOM 0 HA ARG A 41 -14.300 10.487 -2.275 1.00 2.15 H new ATOM 0 HB2 ARG A 41 -14.750 8.335 -0.970 1.00 3.07 H new ATOM 0 HB3 ARG A 41 -15.613 9.331 0.186 1.00 3.07 H new ATOM 0 HG2 ARG A 41 -16.983 10.185 -1.840 1.00 3.62 H new ATOM 0 HG3 ARG A 41 -16.287 8.841 -2.724 1.00 3.62 H new ATOM 0 HD2 ARG A 41 -17.916 8.634 -0.163 1.00 4.44 H new ATOM 0 HD3 ARG A 41 -18.496 8.269 -1.776 1.00 4.44 H new ATOM 0 HE ARG A 41 -16.252 6.720 -0.520 1.00 4.95 H new ATOM 0 HH11 ARG A 41 -19.266 6.923 -2.353 1.00 6.46 H new ATOM 0 HH12 ARG A 41 -19.429 5.171 -2.510 1.00 6.46 H new ATOM 0 HH21 ARG A 41 -16.500 4.463 -0.669 1.00 6.61 H new ATOM 0 HH22 ARG A 41 -17.866 3.781 -1.558 1.00 6.61 H new ATOM 655 N LYS A 42 -14.085 12.504 -0.029 1.00 1.99 N ATOM 656 CA LYS A 42 -14.371 13.796 0.594 1.00 2.62 C ATOM 657 C LYS A 42 -15.749 13.846 1.235 1.00 2.59 C ATOM 658 O LYS A 42 -16.506 14.802 1.063 1.00 3.13 O ATOM 659 CB LYS A 42 -14.166 14.915 -0.422 1.00 3.24 C ATOM 660 CG LYS A 42 -14.938 14.735 -1.716 1.00 3.85 C ATOM 661 CD LYS A 42 -14.359 15.579 -2.834 1.00 4.70 C ATOM 662 CE LYS A 42 -14.954 15.187 -4.174 1.00 5.56 C ATOM 663 NZ LYS A 42 -14.304 15.902 -5.306 1.00 6.46 N ATOM 0 H LYS A 42 -13.112 12.219 0.082 1.00 1.99 H new ATOM 0 HA LYS A 42 -13.667 13.939 1.414 1.00 2.62 H new ATOM 0 HB2 LYS A 42 -14.459 15.861 0.033 1.00 3.24 H new ATOM 0 HB3 LYS A 42 -13.104 14.989 -0.654 1.00 3.24 H new ATOM 0 HG2 LYS A 42 -14.922 13.685 -2.007 1.00 3.85 H new ATOM 0 HG3 LYS A 42 -15.982 15.006 -1.558 1.00 3.85 H new ATOM 0 HD2 LYS A 42 -14.556 16.633 -2.639 1.00 4.70 H new ATOM 0 HD3 LYS A 42 -13.276 15.457 -2.863 1.00 4.70 H new ATOM 0 HE2 LYS A 42 -14.848 14.112 -4.316 1.00 5.56 H new ATOM 0 HE3 LYS A 42 -16.022 15.405 -4.174 1.00 5.56 H new ATOM 0 HZ1 LYS A 42 -14.741 15.604 -6.201 1.00 6.46 H new ATOM 0 HZ2 LYS A 42 -14.427 16.928 -5.185 1.00 6.46 H new ATOM 0 HZ3 LYS A 42 -13.289 15.674 -5.324 1.00 6.46 H new ATOM 677 N PHE A 43 -16.037 12.818 2.012 1.00 2.24 N ATOM 678 CA PHE A 43 -17.338 12.661 2.632 1.00 2.56 C ATOM 679 C PHE A 43 -17.214 11.745 3.837 1.00 2.44 C ATOM 680 O PHE A 43 -17.559 12.111 4.960 1.00 3.00 O ATOM 681 CB PHE A 43 -18.305 12.069 1.612 1.00 3.06 C ATOM 682 CG PHE A 43 -19.745 12.069 2.042 1.00 3.83 C ATOM 683 CD1 PHE A 43 -20.535 13.195 1.871 1.00 4.19 C ATOM 684 CD2 PHE A 43 -20.303 10.945 2.629 1.00 4.52 C ATOM 685 CE1 PHE A 43 -21.856 13.198 2.274 1.00 5.06 C ATOM 686 CE2 PHE A 43 -21.623 10.942 3.034 1.00 5.45 C ATOM 687 CZ PHE A 43 -22.413 12.068 2.816 1.00 5.65 C ATOM 0 H PHE A 43 -15.377 12.071 2.230 1.00 2.24 H new ATOM 0 HA PHE A 43 -17.716 13.628 2.964 1.00 2.56 H new ATOM 0 HB2 PHE A 43 -18.218 12.629 0.681 1.00 3.06 H new ATOM 0 HB3 PHE A 43 -18.003 11.044 1.397 1.00 3.06 H new ATOM 0 HD1 PHE A 43 -20.113 14.080 1.418 1.00 4.19 H new ATOM 0 HD2 PHE A 43 -19.699 10.061 2.771 1.00 4.52 H new ATOM 0 HE1 PHE A 43 -22.452 14.092 2.162 1.00 5.06 H new ATOM 0 HE2 PHE A 43 -22.041 10.071 3.517 1.00 5.45 H new ATOM 0 HZ PHE A 43 -23.462 12.051 3.073 1.00 5.65 H new ATOM 697 N HIS A 44 -16.710 10.548 3.584 1.00 2.18 N ATOM 698 CA HIS A 44 -16.456 9.578 4.632 1.00 2.43 C ATOM 699 C HIS A 44 -15.075 8.976 4.429 1.00 1.88 C ATOM 700 O HIS A 44 -14.938 7.850 3.953 1.00 2.06 O ATOM 701 CB HIS A 44 -17.532 8.486 4.620 1.00 3.27 C ATOM 702 CG HIS A 44 -17.445 7.528 5.771 1.00 4.01 C ATOM 703 ND1 HIS A 44 -17.819 7.859 7.053 1.00 4.55 N ATOM 704 CD2 HIS A 44 -17.040 6.238 5.822 1.00 4.75 C ATOM 705 CE1 HIS A 44 -17.649 6.815 7.843 1.00 5.43 C ATOM 706 NE2 HIS A 44 -17.178 5.815 7.120 1.00 5.56 N ATOM 0 H HIS A 44 -16.467 10.224 2.648 1.00 2.18 H new ATOM 0 HA HIS A 44 -16.491 10.072 5.603 1.00 2.43 H new ATOM 0 HB2 HIS A 44 -18.514 8.959 4.628 1.00 3.27 H new ATOM 0 HB3 HIS A 44 -17.455 7.926 3.688 1.00 3.27 H new ATOM 0 HD2 HIS A 44 -16.675 5.649 4.993 1.00 4.75 H new ATOM 0 HE1 HIS A 44 -17.860 6.784 8.902 1.00 5.43 H new ATOM 0 HE2 HIS A 44 -16.954 4.883 7.469 1.00 5.56 H new ATOM 715 N GLY A 45 -14.057 9.754 4.750 1.00 1.56 N ATOM 716 CA GLY A 45 -12.694 9.303 4.586 1.00 1.46 C ATOM 717 C GLY A 45 -11.815 10.364 3.961 1.00 1.27 C ATOM 718 O GLY A 45 -12.282 11.171 3.148 1.00 1.42 O ATOM 0 H GLY A 45 -14.151 10.698 5.124 1.00 1.56 H new ATOM 0 HA2 GLY A 45 -12.287 9.021 5.557 1.00 1.46 H new ATOM 0 HA3 GLY A 45 -12.681 8.409 3.963 1.00 1.46 H new ATOM 722 N ASN A 46 -10.543 10.364 4.329 1.00 1.06 N ATOM 723 CA ASN A 46 -9.584 11.337 3.816 1.00 0.90 C ATOM 724 C ASN A 46 -8.472 10.622 3.060 1.00 0.81 C ATOM 725 O ASN A 46 -8.234 9.438 3.276 1.00 0.95 O ATOM 726 CB ASN A 46 -8.987 12.160 4.966 1.00 0.91 C ATOM 727 CG ASN A 46 -10.011 13.029 5.673 1.00 1.32 C ATOM 728 OD1 ASN A 46 -10.654 12.598 6.630 1.00 2.05 O ATOM 729 ND2 ASN A 46 -10.154 14.267 5.226 1.00 1.87 N ATOM 0 H ASN A 46 -10.146 9.694 4.988 1.00 1.06 H new ATOM 0 HA ASN A 46 -10.104 12.012 3.136 1.00 0.90 H new ATOM 0 HB2 ASN A 46 -8.532 11.484 5.690 1.00 0.91 H new ATOM 0 HB3 ASN A 46 -8.190 12.793 4.576 1.00 0.91 H new ATOM 0 HD21 ASN A 46 -10.815 14.899 5.678 1.00 1.87 H new ATOM 0 HD22 ASN A 46 -9.603 14.589 4.430 1.00 1.87 H new ATOM 736 N LEU A 47 -7.815 11.340 2.159 1.00 0.70 N ATOM 737 CA LEU A 47 -6.697 10.788 1.405 1.00 0.62 C ATOM 738 C LEU A 47 -5.410 11.239 2.066 1.00 0.54 C ATOM 739 O LEU A 47 -5.268 12.411 2.411 1.00 0.58 O ATOM 740 CB LEU A 47 -6.743 11.261 -0.056 1.00 0.66 C ATOM 741 CG LEU A 47 -6.047 10.362 -1.095 1.00 0.70 C ATOM 742 CD1 LEU A 47 -6.302 10.891 -2.496 1.00 0.77 C ATOM 743 CD2 LEU A 47 -4.550 10.261 -0.852 1.00 0.87 C ATOM 0 H LEU A 47 -8.038 12.309 1.932 1.00 0.70 H new ATOM 0 HA LEU A 47 -6.755 9.700 1.402 1.00 0.62 H new ATOM 0 HB2 LEU A 47 -7.788 11.370 -0.346 1.00 0.66 H new ATOM 0 HB3 LEU A 47 -6.293 12.252 -0.107 1.00 0.66 H new ATOM 0 HG LEU A 47 -6.469 9.362 -0.994 1.00 0.70 H new ATOM 0 HD11 LEU A 47 -5.806 10.249 -3.223 1.00 0.77 H new ATOM 0 HD12 LEU A 47 -7.374 10.900 -2.692 1.00 0.77 H new ATOM 0 HD13 LEU A 47 -5.909 11.904 -2.579 1.00 0.77 H new ATOM 0 HD21 LEU A 47 -4.101 9.617 -1.609 1.00 0.87 H new ATOM 0 HD22 LEU A 47 -4.104 11.254 -0.910 1.00 0.87 H new ATOM 0 HD23 LEU A 47 -4.370 9.839 0.137 1.00 0.87 H new ATOM 755 N TYR A 48 -4.478 10.324 2.227 1.00 0.48 N ATOM 756 CA TYR A 48 -3.267 10.607 2.964 1.00 0.45 C ATOM 757 C TYR A 48 -2.052 10.359 2.095 1.00 0.46 C ATOM 758 O TYR A 48 -1.881 9.273 1.542 1.00 0.54 O ATOM 759 CB TYR A 48 -3.208 9.757 4.236 1.00 0.48 C ATOM 760 CG TYR A 48 -4.233 10.141 5.281 1.00 0.53 C ATOM 761 CD1 TYR A 48 -5.560 9.756 5.160 1.00 0.63 C ATOM 762 CD2 TYR A 48 -3.869 10.888 6.391 1.00 0.64 C ATOM 763 CE1 TYR A 48 -6.495 10.107 6.113 1.00 0.76 C ATOM 764 CE2 TYR A 48 -4.798 11.241 7.351 1.00 0.78 C ATOM 765 CZ TYR A 48 -6.109 10.848 7.208 1.00 0.82 C ATOM 766 OH TYR A 48 -7.036 11.201 8.161 1.00 0.99 O ATOM 0 H TYR A 48 -4.537 9.376 1.856 1.00 0.48 H new ATOM 0 HA TYR A 48 -3.271 11.658 3.254 1.00 0.45 H new ATOM 0 HB2 TYR A 48 -3.352 8.710 3.968 1.00 0.48 H new ATOM 0 HB3 TYR A 48 -2.212 9.841 4.671 1.00 0.48 H new ATOM 0 HD1 TYR A 48 -5.867 9.171 4.305 1.00 0.63 H new ATOM 0 HD2 TYR A 48 -2.841 11.199 6.507 1.00 0.64 H new ATOM 0 HE1 TYR A 48 -7.525 9.802 6.000 1.00 0.76 H new ATOM 0 HE2 TYR A 48 -4.497 11.823 8.210 1.00 0.78 H new ATOM 0 HH TYR A 48 -6.598 11.721 8.867 1.00 0.99 H new ATOM 776 N ARG A 49 -1.229 11.379 1.951 1.00 0.45 N ATOM 777 CA ARG A 49 -0.010 11.269 1.175 1.00 0.48 C ATOM 778 C ARG A 49 1.159 11.043 2.115 1.00 0.40 C ATOM 779 O ARG A 49 1.603 11.970 2.789 1.00 0.48 O ATOM 780 CB ARG A 49 0.224 12.536 0.349 1.00 0.59 C ATOM 781 CG ARG A 49 1.374 12.424 -0.649 1.00 0.71 C ATOM 782 CD ARG A 49 0.863 12.291 -2.070 1.00 1.32 C ATOM 783 NE ARG A 49 0.164 13.483 -2.556 1.00 1.69 N ATOM 784 CZ ARG A 49 -1.152 13.542 -2.768 1.00 2.18 C ATOM 785 NH1 ARG A 49 -1.939 12.542 -2.378 1.00 2.54 N ATOM 786 NH2 ARG A 49 -1.682 14.601 -3.366 1.00 2.92 N ATOM 0 H ARG A 49 -1.384 12.299 2.364 1.00 0.45 H new ATOM 0 HA ARG A 49 -0.102 10.427 0.489 1.00 0.48 H new ATOM 0 HB2 ARG A 49 -0.691 12.778 -0.192 1.00 0.59 H new ATOM 0 HB3 ARG A 49 0.424 13.367 1.026 1.00 0.59 H new ATOM 0 HG2 ARG A 49 2.012 13.304 -0.571 1.00 0.71 H new ATOM 0 HG3 ARG A 49 1.991 11.560 -0.400 1.00 0.71 H new ATOM 0 HD2 ARG A 49 1.703 12.078 -2.731 1.00 1.32 H new ATOM 0 HD3 ARG A 49 0.189 11.436 -2.126 1.00 1.32 H new ATOM 0 HE ARG A 49 0.717 14.319 -2.744 1.00 1.69 H new ATOM 0 HH11 ARG A 49 -1.537 11.727 -1.915 1.00 2.54 H new ATOM 0 HH12 ARG A 49 -2.945 12.591 -2.542 1.00 2.54 H new ATOM 0 HH21 ARG A 49 -1.083 15.371 -3.664 1.00 2.92 H new ATOM 0 HH22 ARG A 49 -2.688 14.645 -3.528 1.00 2.92 H new ATOM 800 N VAL A 50 1.632 9.813 2.188 1.00 0.37 N ATOM 801 CA VAL A 50 2.766 9.507 3.032 1.00 0.42 C ATOM 802 C VAL A 50 4.040 9.778 2.254 1.00 0.46 C ATOM 803 O VAL A 50 4.058 9.671 1.025 1.00 0.62 O ATOM 804 CB VAL A 50 2.767 8.043 3.552 1.00 0.63 C ATOM 805 CG1 VAL A 50 1.353 7.524 3.751 1.00 1.29 C ATOM 806 CG2 VAL A 50 3.555 7.123 2.641 1.00 1.33 C ATOM 0 H VAL A 50 1.251 9.017 1.677 1.00 0.37 H new ATOM 0 HA VAL A 50 2.701 10.146 3.913 1.00 0.42 H new ATOM 0 HB VAL A 50 3.263 8.051 4.523 1.00 0.63 H new ATOM 0 HG11 VAL A 50 1.390 6.497 4.115 1.00 1.29 H new ATOM 0 HG12 VAL A 50 0.835 8.149 4.479 1.00 1.29 H new ATOM 0 HG13 VAL A 50 0.818 7.553 2.802 1.00 1.29 H new ATOM 0 HG21 VAL A 50 3.531 6.109 3.040 1.00 1.33 H new ATOM 0 HG22 VAL A 50 3.113 7.132 1.645 1.00 1.33 H new ATOM 0 HG23 VAL A 50 4.588 7.466 2.583 1.00 1.33 H new ATOM 816 N GLU A 51 5.085 10.144 2.957 1.00 0.37 N ATOM 817 CA GLU A 51 6.347 10.449 2.329 1.00 0.37 C ATOM 818 C GLU A 51 7.473 10.327 3.340 1.00 0.38 C ATOM 819 O GLU A 51 7.605 11.148 4.246 1.00 0.56 O ATOM 820 CB GLU A 51 6.313 11.857 1.733 1.00 0.40 C ATOM 821 CG GLU A 51 7.588 12.227 1.004 1.00 0.47 C ATOM 822 CD GLU A 51 7.523 13.585 0.346 1.00 0.52 C ATOM 823 OE1 GLU A 51 6.664 14.400 0.749 1.00 1.07 O ATOM 824 OE2 GLU A 51 8.323 13.852 -0.572 1.00 1.02 O ATOM 0 H GLU A 51 5.085 10.238 3.973 1.00 0.37 H new ATOM 0 HA GLU A 51 6.523 9.737 1.523 1.00 0.37 H new ATOM 0 HB2 GLU A 51 5.473 11.932 1.043 1.00 0.40 H new ATOM 0 HB3 GLU A 51 6.136 12.578 2.531 1.00 0.40 H new ATOM 0 HG2 GLU A 51 8.420 12.211 1.708 1.00 0.47 H new ATOM 0 HG3 GLU A 51 7.798 11.472 0.246 1.00 0.47 H new ATOM 831 N GLY A 52 8.267 9.290 3.189 1.00 0.27 N ATOM 832 CA GLY A 52 9.402 9.095 4.059 1.00 0.29 C ATOM 833 C GLY A 52 10.549 8.478 3.311 1.00 0.25 C ATOM 834 O GLY A 52 10.334 7.682 2.403 1.00 0.29 O ATOM 0 H GLY A 52 8.147 8.572 2.474 1.00 0.27 H new ATOM 0 HA2 GLY A 52 9.710 10.051 4.482 1.00 0.29 H new ATOM 0 HA3 GLY A 52 9.120 8.454 4.894 1.00 0.29 H new ATOM 838 N ILE A 53 11.766 8.847 3.648 1.00 0.24 N ATOM 839 CA ILE A 53 12.911 8.309 2.934 1.00 0.23 C ATOM 840 C ILE A 53 13.401 7.020 3.571 1.00 0.23 C ATOM 841 O ILE A 53 13.665 6.971 4.773 1.00 0.30 O ATOM 842 CB ILE A 53 14.068 9.319 2.861 1.00 0.29 C ATOM 843 CG1 ILE A 53 13.588 10.612 2.203 1.00 0.37 C ATOM 844 CG2 ILE A 53 15.232 8.722 2.079 1.00 0.27 C ATOM 845 CD1 ILE A 53 14.638 11.696 2.160 1.00 0.58 C ATOM 0 H ILE A 53 11.989 9.504 4.396 1.00 0.24 H new ATOM 0 HA ILE A 53 12.574 8.099 1.919 1.00 0.23 H new ATOM 0 HB ILE A 53 14.409 9.547 3.871 1.00 0.29 H new ATOM 0 HG12 ILE A 53 13.263 10.393 1.186 1.00 0.37 H new ATOM 0 HG13 ILE A 53 12.717 10.983 2.743 1.00 0.37 H new ATOM 0 HG21 ILE A 53 16.047 9.444 2.032 1.00 0.27 H new ATOM 0 HG22 ILE A 53 15.578 7.816 2.576 1.00 0.27 H new ATOM 0 HG23 ILE A 53 14.904 8.478 1.068 1.00 0.27 H new ATOM 0 HD11 ILE A 53 14.226 12.583 1.679 1.00 0.58 H new ATOM 0 HD12 ILE A 53 14.947 11.944 3.176 1.00 0.58 H new ATOM 0 HD13 ILE A 53 15.501 11.345 1.594 1.00 0.58 H new ATOM 857 N ILE A 54 13.509 5.976 2.761 1.00 0.24 N ATOM 858 CA ILE A 54 14.039 4.710 3.219 1.00 0.26 C ATOM 859 C ILE A 54 15.441 4.503 2.656 1.00 0.29 C ATOM 860 O ILE A 54 15.614 4.388 1.446 1.00 0.31 O ATOM 861 CB ILE A 54 13.114 3.534 2.830 1.00 0.26 C ATOM 862 CG1 ILE A 54 11.706 3.815 3.356 1.00 0.32 C ATOM 863 CG2 ILE A 54 13.649 2.223 3.396 1.00 0.32 C ATOM 864 CD1 ILE A 54 10.708 2.730 3.068 1.00 0.35 C ATOM 0 H ILE A 54 13.234 5.987 1.779 1.00 0.24 H new ATOM 0 HA ILE A 54 14.092 4.735 4.307 1.00 0.26 H new ATOM 0 HB ILE A 54 13.082 3.439 1.745 1.00 0.26 H new ATOM 0 HG12 ILE A 54 11.758 3.967 4.434 1.00 0.32 H new ATOM 0 HG13 ILE A 54 11.347 4.747 2.919 1.00 0.32 H new ATOM 0 HG21 ILE A 54 12.985 1.406 3.112 1.00 0.32 H new ATOM 0 HG22 ILE A 54 14.646 2.035 2.998 1.00 0.32 H new ATOM 0 HG23 ILE A 54 13.699 2.289 4.483 1.00 0.32 H new ATOM 0 HD11 ILE A 54 9.737 3.011 3.476 1.00 0.35 H new ATOM 0 HD12 ILE A 54 10.623 2.591 1.990 1.00 0.35 H new ATOM 0 HD13 ILE A 54 11.039 1.799 3.529 1.00 0.35 H new ATOM 876 N PRO A 55 16.448 4.568 3.546 1.00 0.36 N ATOM 877 CA PRO A 55 17.870 4.290 3.261 1.00 0.44 C ATOM 878 C PRO A 55 18.105 2.944 2.578 1.00 0.47 C ATOM 879 O PRO A 55 18.693 2.022 3.153 1.00 0.62 O ATOM 880 CB PRO A 55 18.523 4.290 4.655 1.00 0.54 C ATOM 881 CG PRO A 55 17.386 4.271 5.620 1.00 0.53 C ATOM 882 CD PRO A 55 16.273 4.985 4.924 1.00 0.42 C ATOM 0 HA PRO A 55 18.279 5.026 2.569 1.00 0.44 H new ATOM 0 HB2 PRO A 55 19.167 3.421 4.788 1.00 0.54 H new ATOM 0 HB3 PRO A 55 19.146 5.173 4.798 1.00 0.54 H new ATOM 0 HG2 PRO A 55 17.101 3.250 5.874 1.00 0.53 H new ATOM 0 HG3 PRO A 55 17.652 4.769 6.552 1.00 0.53 H new ATOM 0 HD2 PRO A 55 15.298 4.696 5.315 1.00 0.42 H new ATOM 0 HD3 PRO A 55 16.353 6.066 5.034 1.00 0.42 H new ATOM 890 N GLU A 56 17.625 2.847 1.362 1.00 0.43 N ATOM 891 CA GLU A 56 17.841 1.700 0.515 1.00 0.49 C ATOM 892 C GLU A 56 17.474 2.086 -0.908 1.00 0.46 C ATOM 893 O GLU A 56 16.938 3.169 -1.135 1.00 0.60 O ATOM 894 CB GLU A 56 16.988 0.524 0.998 1.00 0.66 C ATOM 895 CG GLU A 56 17.205 -0.757 0.218 1.00 0.77 C ATOM 896 CD GLU A 56 18.639 -1.244 0.262 1.00 1.18 C ATOM 897 OE1 GLU A 56 18.990 -2.020 1.176 1.00 1.38 O ATOM 898 OE2 GLU A 56 19.425 -0.849 -0.621 1.00 1.68 O ATOM 0 H GLU A 56 17.063 3.577 0.925 1.00 0.43 H new ATOM 0 HA GLU A 56 18.885 1.390 0.552 1.00 0.49 H new ATOM 0 HB2 GLU A 56 17.206 0.338 2.050 1.00 0.66 H new ATOM 0 HB3 GLU A 56 15.936 0.802 0.935 1.00 0.66 H new ATOM 0 HG2 GLU A 56 16.552 -1.533 0.617 1.00 0.77 H new ATOM 0 HG3 GLU A 56 16.914 -0.597 -0.820 1.00 0.77 H new ATOM 905 N SER A 57 17.766 1.221 -1.859 1.00 0.45 N ATOM 906 CA SER A 57 17.433 1.475 -3.224 1.00 0.45 C ATOM 907 C SER A 57 15.969 1.146 -3.468 1.00 0.43 C ATOM 908 O SER A 57 15.425 0.186 -2.919 1.00 0.43 O ATOM 909 CB SER A 57 18.332 0.641 -4.145 1.00 0.53 C ATOM 910 OG SER A 57 18.160 -0.750 -3.912 1.00 1.18 O ATOM 0 H SER A 57 18.238 0.331 -1.697 1.00 0.45 H new ATOM 0 HA SER A 57 17.595 2.530 -3.443 1.00 0.45 H new ATOM 0 HB2 SER A 57 18.101 0.869 -5.186 1.00 0.53 H new ATOM 0 HB3 SER A 57 19.375 0.913 -3.983 1.00 0.53 H new ATOM 0 HG SER A 57 18.744 -1.257 -4.514 1.00 1.18 H new ATOM 916 N PRO A 58 15.319 1.979 -4.284 1.00 0.44 N ATOM 917 CA PRO A 58 13.961 1.758 -4.786 1.00 0.43 C ATOM 918 C PRO A 58 13.809 0.375 -5.416 1.00 0.46 C ATOM 919 O PRO A 58 12.698 -0.104 -5.636 1.00 0.46 O ATOM 920 CB PRO A 58 13.786 2.860 -5.848 1.00 0.44 C ATOM 921 CG PRO A 58 15.149 3.450 -6.048 1.00 0.49 C ATOM 922 CD PRO A 58 15.873 3.238 -4.756 1.00 0.52 C ATOM 0 HA PRO A 58 13.215 1.799 -3.993 1.00 0.43 H new ATOM 0 HB2 PRO A 58 13.397 2.448 -6.779 1.00 0.44 H new ATOM 0 HB3 PRO A 58 13.077 3.617 -5.514 1.00 0.44 H new ATOM 0 HG2 PRO A 58 15.669 2.964 -6.873 1.00 0.49 H new ATOM 0 HG3 PRO A 58 15.085 4.510 -6.292 1.00 0.49 H new ATOM 0 HD2 PRO A 58 16.952 3.177 -4.901 1.00 0.52 H new ATOM 0 HD3 PRO A 58 15.692 4.050 -4.052 1.00 0.52 H new ATOM 930 N ALA A 59 14.944 -0.253 -5.694 1.00 0.50 N ATOM 931 CA ALA A 59 14.980 -1.602 -6.218 1.00 0.54 C ATOM 932 C ALA A 59 14.680 -2.613 -5.135 1.00 0.50 C ATOM 933 O ALA A 59 13.913 -3.544 -5.345 1.00 0.51 O ATOM 934 CB ALA A 59 16.337 -1.892 -6.818 1.00 0.64 C ATOM 0 H ALA A 59 15.865 0.164 -5.560 1.00 0.50 H new ATOM 0 HA ALA A 59 14.216 -1.683 -6.991 1.00 0.54 H new ATOM 0 HB1 ALA A 59 16.352 -2.909 -7.209 1.00 0.64 H new ATOM 0 HB2 ALA A 59 16.535 -1.189 -7.628 1.00 0.64 H new ATOM 0 HB3 ALA A 59 17.104 -1.787 -6.051 1.00 0.64 H new ATOM 940 N LYS A 60 15.291 -2.431 -3.972 1.00 0.49 N ATOM 941 CA LYS A 60 15.043 -3.318 -2.857 1.00 0.49 C ATOM 942 C LYS A 60 13.629 -3.076 -2.371 1.00 0.42 C ATOM 943 O LYS A 60 12.954 -3.974 -1.872 1.00 0.43 O ATOM 944 CB LYS A 60 16.052 -3.066 -1.735 1.00 0.58 C ATOM 945 CG LYS A 60 15.950 -4.035 -0.559 1.00 0.65 C ATOM 946 CD LYS A 60 16.754 -5.302 -0.781 1.00 1.35 C ATOM 947 CE LYS A 60 16.308 -6.037 -2.026 1.00 2.45 C ATOM 948 NZ LYS A 60 17.008 -7.337 -2.203 1.00 3.30 N ATOM 0 H LYS A 60 15.956 -1.681 -3.782 1.00 0.49 H new ATOM 0 HA LYS A 60 15.156 -4.356 -3.170 1.00 0.49 H new ATOM 0 HB2 LYS A 60 17.058 -3.123 -2.150 1.00 0.58 H new ATOM 0 HB3 LYS A 60 15.917 -2.050 -1.364 1.00 0.58 H new ATOM 0 HG2 LYS A 60 16.300 -3.540 0.347 1.00 0.65 H new ATOM 0 HG3 LYS A 60 14.904 -4.296 -0.396 1.00 0.65 H new ATOM 0 HD2 LYS A 60 17.812 -5.052 -0.865 1.00 1.35 H new ATOM 0 HD3 LYS A 60 16.649 -5.956 0.085 1.00 1.35 H new ATOM 0 HE2 LYS A 60 15.233 -6.211 -1.976 1.00 2.45 H new ATOM 0 HE3 LYS A 60 16.489 -5.409 -2.899 1.00 2.45 H new ATOM 0 HZ1 LYS A 60 16.323 -8.063 -2.496 1.00 3.30 H new ATOM 0 HZ2 LYS A 60 17.742 -7.239 -2.933 1.00 3.30 H new ATOM 0 HZ3 LYS A 60 17.449 -7.619 -1.304 1.00 3.30 H new ATOM 962 N LEU A 61 13.199 -1.837 -2.541 1.00 0.37 N ATOM 963 CA LEU A 61 11.841 -1.437 -2.236 1.00 0.35 C ATOM 964 C LEU A 61 10.842 -2.201 -3.109 1.00 0.38 C ATOM 965 O LEU A 61 9.992 -2.937 -2.596 1.00 0.41 O ATOM 966 CB LEU A 61 11.708 0.078 -2.405 1.00 0.34 C ATOM 967 CG LEU A 61 12.497 0.901 -1.375 1.00 0.31 C ATOM 968 CD1 LEU A 61 12.399 2.385 -1.676 1.00 0.34 C ATOM 969 CD2 LEU A 61 11.978 0.619 0.016 1.00 0.30 C ATOM 0 H LEU A 61 13.785 -1.081 -2.895 1.00 0.37 H new ATOM 0 HA LEU A 61 11.611 -1.687 -1.200 1.00 0.35 H new ATOM 0 HB2 LEU A 61 12.044 0.351 -3.405 1.00 0.34 H new ATOM 0 HB3 LEU A 61 10.654 0.348 -2.338 1.00 0.34 H new ATOM 0 HG LEU A 61 13.546 0.610 -1.434 1.00 0.31 H new ATOM 0 HD11 LEU A 61 12.966 2.945 -0.932 1.00 0.34 H new ATOM 0 HD12 LEU A 61 12.806 2.583 -2.668 1.00 0.34 H new ATOM 0 HD13 LEU A 61 11.354 2.694 -1.644 1.00 0.34 H new ATOM 0 HD21 LEU A 61 12.542 1.206 0.741 1.00 0.30 H new ATOM 0 HD22 LEU A 61 10.923 0.889 0.073 1.00 0.30 H new ATOM 0 HD23 LEU A 61 12.094 -0.442 0.239 1.00 0.30 H new ATOM 981 N SER A 62 10.979 -2.091 -4.422 1.00 0.41 N ATOM 982 CA SER A 62 10.117 -2.839 -5.330 1.00 0.46 C ATOM 983 C SER A 62 10.356 -4.343 -5.179 1.00 0.46 C ATOM 984 O SER A 62 9.608 -5.166 -5.714 1.00 0.50 O ATOM 985 CB SER A 62 10.362 -2.401 -6.776 1.00 0.53 C ATOM 986 OG SER A 62 11.746 -2.400 -7.086 1.00 1.29 O ATOM 0 H SER A 62 11.671 -1.498 -4.881 1.00 0.41 H new ATOM 0 HA SER A 62 9.079 -2.629 -5.074 1.00 0.46 H new ATOM 0 HB2 SER A 62 9.835 -3.071 -7.456 1.00 0.53 H new ATOM 0 HB3 SER A 62 9.952 -1.403 -6.931 1.00 0.53 H new ATOM 0 HG SER A 62 12.157 -1.578 -6.746 1.00 1.29 H new ATOM 992 N ASP A 63 11.402 -4.692 -4.438 1.00 0.44 N ATOM 993 CA ASP A 63 11.757 -6.090 -4.227 1.00 0.48 C ATOM 994 C ASP A 63 11.053 -6.681 -3.002 1.00 0.49 C ATOM 995 O ASP A 63 10.739 -7.871 -2.982 1.00 0.60 O ATOM 996 CB ASP A 63 13.278 -6.228 -4.081 1.00 0.53 C ATOM 997 CG ASP A 63 13.740 -7.663 -3.932 1.00 0.87 C ATOM 998 OD1 ASP A 63 13.720 -8.407 -4.938 1.00 1.10 O ATOM 999 OD2 ASP A 63 14.150 -8.045 -2.815 1.00 1.32 O ATOM 0 H ASP A 63 12.019 -4.026 -3.973 1.00 0.44 H new ATOM 0 HA ASP A 63 11.422 -6.652 -5.099 1.00 0.48 H new ATOM 0 HB2 ASP A 63 13.761 -5.787 -4.953 1.00 0.53 H new ATOM 0 HB3 ASP A 63 13.606 -5.657 -3.213 1.00 0.53 H new ATOM 1004 N PHE A 64 10.779 -5.860 -1.987 1.00 0.44 N ATOM 1005 CA PHE A 64 10.256 -6.394 -0.732 1.00 0.48 C ATOM 1006 C PHE A 64 8.725 -6.448 -0.730 1.00 0.51 C ATOM 1007 O PHE A 64 8.142 -7.446 -0.303 1.00 0.61 O ATOM 1008 CB PHE A 64 10.776 -5.598 0.487 1.00 0.51 C ATOM 1009 CG PHE A 64 10.073 -4.293 0.718 1.00 0.46 C ATOM 1010 CD1 PHE A 64 10.528 -3.137 0.119 1.00 0.50 C ATOM 1011 CD2 PHE A 64 8.990 -4.217 1.553 1.00 0.59 C ATOM 1012 CE1 PHE A 64 9.922 -1.928 0.360 1.00 0.50 C ATOM 1013 CE2 PHE A 64 8.370 -3.011 1.795 1.00 0.59 C ATOM 1014 CZ PHE A 64 8.718 -1.911 1.082 1.00 0.47 C ATOM 0 H PHE A 64 10.907 -4.848 -2.007 1.00 0.44 H new ATOM 0 HA PHE A 64 10.625 -7.416 -0.648 1.00 0.48 H new ATOM 0 HB2 PHE A 64 10.674 -6.215 1.380 1.00 0.51 H new ATOM 0 HB3 PHE A 64 11.840 -5.405 0.353 1.00 0.51 H new ATOM 0 HD1 PHE A 64 11.374 -3.183 -0.550 1.00 0.50 H new ATOM 0 HD2 PHE A 64 8.618 -5.113 2.027 1.00 0.59 H new ATOM 0 HE1 PHE A 64 10.363 -1.009 0.001 1.00 0.50 H new ATOM 0 HE2 PHE A 64 7.605 -2.941 2.554 1.00 0.59 H new ATOM 0 HZ PHE A 64 8.081 -1.039 1.070 1.00 0.47 H new ATOM 1024 N LEU A 65 8.066 -5.393 -1.215 1.00 0.49 N ATOM 1025 CA LEU A 65 6.605 -5.321 -1.114 1.00 0.58 C ATOM 1026 C LEU A 65 5.918 -5.923 -2.330 1.00 0.64 C ATOM 1027 O LEU A 65 4.693 -5.913 -2.404 1.00 0.81 O ATOM 1028 CB LEU A 65 6.148 -3.858 -0.869 1.00 0.66 C ATOM 1029 CG LEU A 65 6.032 -2.894 -2.082 1.00 0.78 C ATOM 1030 CD1 LEU A 65 7.144 -3.091 -3.098 1.00 1.25 C ATOM 1031 CD2 LEU A 65 4.673 -3.000 -2.754 1.00 1.50 C ATOM 0 H LEU A 65 8.507 -4.594 -1.671 1.00 0.49 H new ATOM 0 HA LEU A 65 6.303 -5.922 -0.256 1.00 0.58 H new ATOM 0 HB2 LEU A 65 5.173 -3.894 -0.383 1.00 0.66 H new ATOM 0 HB3 LEU A 65 6.842 -3.411 -0.158 1.00 0.66 H new ATOM 0 HG LEU A 65 6.139 -1.888 -1.677 1.00 0.78 H new ATOM 0 HD11 LEU A 65 7.011 -2.391 -3.923 1.00 1.25 H new ATOM 0 HD12 LEU A 65 8.108 -2.912 -2.622 1.00 1.25 H new ATOM 0 HD13 LEU A 65 7.112 -4.112 -3.480 1.00 1.25 H new ATOM 0 HD21 LEU A 65 4.630 -2.311 -3.598 1.00 1.50 H new ATOM 0 HD22 LEU A 65 4.521 -4.019 -3.110 1.00 1.50 H new ATOM 0 HD23 LEU A 65 3.892 -2.746 -2.037 1.00 1.50 H new ATOM 1043 N TYR A 66 6.732 -6.512 -3.217 1.00 0.58 N ATOM 1044 CA TYR A 66 6.321 -6.913 -4.571 1.00 0.64 C ATOM 1045 C TYR A 66 4.829 -7.233 -4.675 1.00 0.72 C ATOM 1046 O TYR A 66 4.093 -6.466 -5.296 1.00 0.89 O ATOM 1047 CB TYR A 66 7.167 -8.093 -5.057 1.00 0.73 C ATOM 1048 CG TYR A 66 6.913 -8.481 -6.501 1.00 0.88 C ATOM 1049 CD1 TYR A 66 6.676 -7.509 -7.466 1.00 0.82 C ATOM 1050 CD2 TYR A 66 6.909 -9.815 -6.900 1.00 1.27 C ATOM 1051 CE1 TYR A 66 6.440 -7.852 -8.783 1.00 1.01 C ATOM 1052 CE2 TYR A 66 6.675 -10.164 -8.219 1.00 1.47 C ATOM 1053 CZ TYR A 66 6.454 -9.208 -9.149 1.00 1.29 C ATOM 1054 OH TYR A 66 6.207 -9.520 -10.468 1.00 1.52 O ATOM 0 H TYR A 66 7.708 -6.726 -3.012 1.00 0.58 H new ATOM 0 HA TYR A 66 6.495 -6.055 -5.220 1.00 0.64 H new ATOM 0 HB2 TYR A 66 8.222 -7.844 -4.939 1.00 0.73 H new ATOM 0 HB3 TYR A 66 6.970 -8.955 -4.420 1.00 0.73 H new ATOM 0 HD1 TYR A 66 6.676 -6.467 -7.181 1.00 0.82 H new ATOM 0 HD2 TYR A 66 7.091 -10.589 -6.169 1.00 1.27 H new ATOM 0 HE1 TYR A 66 6.247 -7.088 -9.521 1.00 1.01 H new ATOM 0 HE2 TYR A 66 6.669 -11.205 -8.506 1.00 1.47 H new ATOM 0 HH TYR A 66 6.247 -10.492 -10.587 1.00 1.52 H new ATOM 1064 N GLN A 67 4.372 -8.340 -4.067 1.00 0.89 N ATOM 1065 CA GLN A 67 2.930 -8.608 -4.014 1.00 1.13 C ATOM 1066 C GLN A 67 2.552 -9.843 -3.188 1.00 1.10 C ATOM 1067 O GLN A 67 1.574 -9.806 -2.444 1.00 1.76 O ATOM 1068 CB GLN A 67 2.351 -8.749 -5.425 1.00 1.54 C ATOM 1069 CG GLN A 67 0.832 -8.770 -5.452 1.00 2.13 C ATOM 1070 CD GLN A 67 0.272 -8.615 -6.850 1.00 2.94 C ATOM 1071 OE1 GLN A 67 -0.791 -9.140 -7.168 1.00 3.50 O ATOM 1072 NE2 GLN A 67 0.981 -7.882 -7.694 1.00 3.60 N ATOM 0 H GLN A 67 4.960 -9.042 -3.619 1.00 0.89 H new ATOM 0 HA GLN A 67 2.498 -7.744 -3.509 1.00 1.13 H new ATOM 0 HB2 GLN A 67 2.707 -7.923 -6.041 1.00 1.54 H new ATOM 0 HB3 GLN A 67 2.728 -9.667 -5.875 1.00 1.54 H new ATOM 0 HG2 GLN A 67 0.478 -9.708 -5.025 1.00 2.13 H new ATOM 0 HG3 GLN A 67 0.450 -7.968 -4.821 1.00 2.13 H new ATOM 0 HE21 GLN A 67 1.860 -7.462 -7.391 1.00 3.60 H new ATOM 0 HE22 GLN A 67 0.648 -7.737 -8.647 1.00 3.60 H new ATOM 1081 N THR A 68 3.304 -10.928 -3.291 1.00 0.83 N ATOM 1082 CA THR A 68 2.790 -12.208 -2.809 1.00 0.93 C ATOM 1083 C THR A 68 3.890 -13.203 -2.424 1.00 1.09 C ATOM 1084 O THR A 68 3.602 -14.354 -2.100 1.00 1.39 O ATOM 1085 CB THR A 68 1.914 -12.827 -3.928 1.00 1.18 C ATOM 1086 OG1 THR A 68 1.292 -14.032 -3.497 1.00 1.48 O ATOM 1087 CG2 THR A 68 2.755 -13.110 -5.165 1.00 1.29 C ATOM 0 H THR A 68 4.242 -10.955 -3.690 1.00 0.83 H new ATOM 0 HA THR A 68 2.218 -12.012 -1.902 1.00 0.93 H new ATOM 0 HB THR A 68 1.136 -12.103 -4.171 1.00 1.18 H new ATOM 0 HG1 THR A 68 1.629 -14.274 -2.609 1.00 1.48 H new ATOM 0 HG21 THR A 68 2.125 -13.544 -5.941 1.00 1.29 H new ATOM 0 HG22 THR A 68 3.191 -12.180 -5.529 1.00 1.29 H new ATOM 0 HG23 THR A 68 3.552 -13.809 -4.911 1.00 1.29 H new ATOM 1095 N GLY A 69 5.142 -12.777 -2.422 1.00 1.06 N ATOM 1096 CA GLY A 69 6.208 -13.750 -2.296 1.00 1.39 C ATOM 1097 C GLY A 69 7.055 -13.619 -1.052 1.00 1.17 C ATOM 1098 O GLY A 69 7.972 -14.414 -0.850 1.00 1.46 O ATOM 0 H GLY A 69 5.436 -11.804 -2.503 1.00 1.06 H new ATOM 0 HA2 GLY A 69 5.771 -14.748 -2.315 1.00 1.39 H new ATOM 0 HA3 GLY A 69 6.857 -13.669 -3.168 1.00 1.39 H new ATOM 1102 N ASP A 70 6.748 -12.651 -0.207 1.00 0.84 N ATOM 1103 CA ASP A 70 7.550 -12.419 0.994 1.00 0.83 C ATOM 1104 C ASP A 70 6.963 -11.283 1.817 1.00 0.65 C ATOM 1105 O ASP A 70 7.058 -11.271 3.035 1.00 0.61 O ATOM 1106 CB ASP A 70 8.999 -12.093 0.602 1.00 1.12 C ATOM 1107 CG ASP A 70 9.935 -11.962 1.788 1.00 1.45 C ATOM 1108 OD1 ASP A 70 10.145 -12.952 2.511 1.00 2.19 O ATOM 1109 OD2 ASP A 70 10.493 -10.867 1.978 1.00 1.68 O ATOM 0 H ASP A 70 5.959 -12.016 -0.323 1.00 0.84 H new ATOM 0 HA ASP A 70 7.540 -13.325 1.600 1.00 0.83 H new ATOM 0 HB2 ASP A 70 9.372 -12.875 -0.060 1.00 1.12 H new ATOM 0 HB3 ASP A 70 9.012 -11.162 0.035 1.00 1.12 H new ATOM 1114 N ARG A 71 6.284 -10.373 1.131 1.00 0.60 N ATOM 1115 CA ARG A 71 5.781 -9.145 1.721 1.00 0.51 C ATOM 1116 C ARG A 71 4.906 -9.431 2.927 1.00 0.43 C ATOM 1117 O ARG A 71 4.916 -8.689 3.889 1.00 0.49 O ATOM 1118 CB ARG A 71 4.982 -8.346 0.685 1.00 0.59 C ATOM 1119 CG ARG A 71 3.837 -9.121 0.092 1.00 0.83 C ATOM 1120 CD ARG A 71 2.592 -8.273 -0.029 1.00 0.87 C ATOM 1121 NE ARG A 71 2.718 -7.164 -0.980 1.00 1.77 N ATOM 1122 CZ ARG A 71 1.677 -6.583 -1.594 1.00 2.46 C ATOM 1123 NH1 ARG A 71 0.434 -6.995 -1.354 1.00 2.69 N ATOM 1124 NH2 ARG A 71 1.888 -5.599 -2.462 1.00 3.38 N ATOM 0 H ARG A 71 6.066 -10.470 0.139 1.00 0.60 H new ATOM 0 HA ARG A 71 6.640 -8.559 2.049 1.00 0.51 H new ATOM 0 HB2 ARG A 71 4.595 -7.441 1.153 1.00 0.59 H new ATOM 0 HB3 ARG A 71 5.651 -8.030 -0.115 1.00 0.59 H new ATOM 0 HG2 ARG A 71 4.121 -9.494 -0.892 1.00 0.83 H new ATOM 0 HG3 ARG A 71 3.626 -9.991 0.714 1.00 0.83 H new ATOM 0 HD2 ARG A 71 1.760 -8.908 -0.335 1.00 0.87 H new ATOM 0 HD3 ARG A 71 2.342 -7.870 0.953 1.00 0.87 H new ATOM 0 HE ARG A 71 3.653 -6.814 -1.187 1.00 1.77 H new ATOM 0 HH11 ARG A 71 0.267 -7.758 -0.698 1.00 2.69 H new ATOM 0 HH12 ARG A 71 -0.352 -6.547 -1.826 1.00 2.69 H new ATOM 0 HH21 ARG A 71 2.839 -5.288 -2.659 1.00 3.38 H new ATOM 0 HH22 ARG A 71 1.099 -5.155 -2.931 1.00 3.38 H new ATOM 1138 N ILE A 72 4.160 -10.524 2.876 1.00 0.44 N ATOM 1139 CA ILE A 72 3.222 -10.836 3.946 1.00 0.44 C ATOM 1140 C ILE A 72 3.862 -11.730 4.988 1.00 0.54 C ATOM 1141 O ILE A 72 3.282 -11.986 6.039 1.00 0.64 O ATOM 1142 CB ILE A 72 1.937 -11.522 3.425 1.00 0.45 C ATOM 1143 CG1 ILE A 72 2.207 -12.946 2.931 1.00 0.62 C ATOM 1144 CG2 ILE A 72 1.323 -10.708 2.315 1.00 0.47 C ATOM 1145 CD1 ILE A 72 2.943 -13.036 1.609 1.00 0.71 C ATOM 0 H ILE A 72 4.184 -11.203 2.115 1.00 0.44 H new ATOM 0 HA ILE A 72 2.947 -9.881 4.393 1.00 0.44 H new ATOM 0 HB ILE A 72 1.242 -11.584 4.262 1.00 0.45 H new ATOM 0 HG12 ILE A 72 2.786 -13.474 3.689 1.00 0.62 H new ATOM 0 HG13 ILE A 72 1.255 -13.468 2.836 1.00 0.62 H new ATOM 0 HG21 ILE A 72 0.420 -11.203 1.958 1.00 0.47 H new ATOM 0 HG22 ILE A 72 1.070 -9.716 2.689 1.00 0.47 H new ATOM 0 HG23 ILE A 72 2.035 -10.616 1.495 1.00 0.47 H new ATOM 0 HD11 ILE A 72 3.087 -14.083 1.343 1.00 0.71 H new ATOM 0 HD12 ILE A 72 2.359 -12.542 0.833 1.00 0.71 H new ATOM 0 HD13 ILE A 72 3.913 -12.548 1.699 1.00 0.71 H new ATOM 1157 N THR A 73 5.058 -12.205 4.705 1.00 0.59 N ATOM 1158 CA THR A 73 5.695 -13.128 5.606 1.00 0.72 C ATOM 1159 C THR A 73 6.489 -12.358 6.656 1.00 0.74 C ATOM 1160 O THR A 73 6.683 -12.825 7.782 1.00 0.88 O ATOM 1161 CB THR A 73 6.610 -14.134 4.866 1.00 0.81 C ATOM 1162 OG1 THR A 73 6.724 -15.353 5.618 1.00 0.97 O ATOM 1163 CG2 THR A 73 8.001 -13.561 4.641 1.00 0.80 C ATOM 0 H THR A 73 5.597 -11.969 3.872 1.00 0.59 H new ATOM 0 HA THR A 73 4.912 -13.709 6.093 1.00 0.72 H new ATOM 0 HB THR A 73 6.153 -14.336 3.897 1.00 0.81 H new ATOM 0 HG1 THR A 73 7.304 -15.980 5.138 1.00 0.97 H new ATOM 0 HG21 THR A 73 8.616 -14.294 4.119 1.00 0.80 H new ATOM 0 HG22 THR A 73 7.928 -12.655 4.040 1.00 0.80 H new ATOM 0 HG23 THR A 73 8.456 -13.323 5.602 1.00 0.80 H new ATOM 1171 N TRP A 74 6.945 -11.168 6.289 1.00 0.64 N ATOM 1172 CA TRP A 74 7.670 -10.335 7.242 1.00 0.66 C ATOM 1173 C TRP A 74 6.779 -9.239 7.807 1.00 0.63 C ATOM 1174 O TRP A 74 7.155 -8.558 8.764 1.00 0.75 O ATOM 1175 CB TRP A 74 8.924 -9.716 6.598 1.00 0.66 C ATOM 1176 CG TRP A 74 8.667 -9.009 5.297 1.00 0.59 C ATOM 1177 CD1 TRP A 74 8.989 -9.461 4.055 1.00 0.66 C ATOM 1178 CD2 TRP A 74 8.049 -7.728 5.103 1.00 0.53 C ATOM 1179 NE1 TRP A 74 8.593 -8.560 3.102 1.00 0.65 N ATOM 1180 CE2 TRP A 74 8.013 -7.490 3.719 1.00 0.58 C ATOM 1181 CE3 TRP A 74 7.512 -6.767 5.959 1.00 0.52 C ATOM 1182 CZ2 TRP A 74 7.469 -6.335 3.175 1.00 0.62 C ATOM 1183 CZ3 TRP A 74 6.975 -5.620 5.418 1.00 0.56 C ATOM 1184 CH2 TRP A 74 6.952 -5.411 4.036 1.00 0.61 C ATOM 0 H TRP A 74 6.830 -10.763 5.360 1.00 0.64 H new ATOM 0 HA TRP A 74 7.984 -10.981 8.062 1.00 0.66 H new ATOM 0 HB2 TRP A 74 9.368 -9.010 7.300 1.00 0.66 H new ATOM 0 HB3 TRP A 74 9.659 -10.504 6.431 1.00 0.66 H new ATOM 0 HD1 TRP A 74 9.486 -10.397 3.849 1.00 0.66 H new ATOM 0 HE1 TRP A 74 8.712 -8.671 2.095 1.00 0.65 H new ATOM 0 HE3 TRP A 74 7.517 -6.920 7.028 1.00 0.52 H new ATOM 0 HZ2 TRP A 74 7.455 -6.173 2.107 1.00 0.62 H new ATOM 0 HZ3 TRP A 74 6.564 -4.867 6.074 1.00 0.56 H new ATOM 0 HH2 TRP A 74 6.518 -4.503 3.643 1.00 0.61 H new ATOM 1195 N ASP A 75 5.587 -9.084 7.243 1.00 0.55 N ATOM 1196 CA ASP A 75 4.810 -7.880 7.492 1.00 0.58 C ATOM 1197 C ASP A 75 3.928 -7.950 8.726 1.00 0.58 C ATOM 1198 O ASP A 75 3.546 -9.015 9.209 1.00 0.73 O ATOM 1199 CB ASP A 75 3.948 -7.502 6.296 1.00 0.83 C ATOM 1200 CG ASP A 75 3.393 -6.115 6.491 1.00 1.44 C ATOM 1201 OD1 ASP A 75 4.122 -5.289 7.057 1.00 1.44 O ATOM 1202 OD2 ASP A 75 2.218 -5.868 6.171 1.00 2.19 O ATOM 0 H ASP A 75 5.146 -9.763 6.623 1.00 0.55 H new ATOM 0 HA ASP A 75 5.563 -7.112 7.669 1.00 0.58 H new ATOM 0 HB2 ASP A 75 4.539 -7.543 5.381 1.00 0.83 H new ATOM 0 HB3 ASP A 75 3.134 -8.218 6.181 1.00 0.83 H new ATOM 1207 N LYS A 76 3.585 -6.756 9.174 1.00 0.58 N ATOM 1208 CA LYS A 76 2.816 -6.510 10.373 1.00 0.65 C ATOM 1209 C LYS A 76 1.347 -6.263 10.047 1.00 0.62 C ATOM 1210 O LYS A 76 0.469 -6.503 10.877 1.00 0.75 O ATOM 1211 CB LYS A 76 3.372 -5.274 11.080 1.00 0.88 C ATOM 1212 CG LYS A 76 3.798 -4.158 10.138 1.00 0.78 C ATOM 1213 CD LYS A 76 5.279 -4.211 9.839 1.00 1.63 C ATOM 1214 CE LYS A 76 6.104 -3.817 11.038 1.00 1.97 C ATOM 1215 NZ LYS A 76 7.559 -3.863 10.742 1.00 3.19 N ATOM 0 H LYS A 76 3.847 -5.898 8.690 1.00 0.58 H new ATOM 0 HA LYS A 76 2.890 -7.390 11.012 1.00 0.65 H new ATOM 0 HB2 LYS A 76 2.615 -4.889 11.764 1.00 0.88 H new ATOM 0 HB3 LYS A 76 4.228 -5.570 11.686 1.00 0.88 H new ATOM 0 HG2 LYS A 76 3.236 -4.234 9.207 1.00 0.78 H new ATOM 0 HG3 LYS A 76 3.551 -3.194 10.582 1.00 0.78 H new ATOM 0 HD2 LYS A 76 5.551 -5.219 9.525 1.00 1.63 H new ATOM 0 HD3 LYS A 76 5.506 -3.546 9.006 1.00 1.63 H new ATOM 0 HE2 LYS A 76 5.829 -2.811 11.355 1.00 1.97 H new ATOM 0 HE3 LYS A 76 5.880 -4.485 11.869 1.00 1.97 H new ATOM 0 HZ1 LYS A 76 8.089 -3.992 11.627 1.00 3.19 H new ATOM 0 HZ2 LYS A 76 7.758 -4.657 10.100 1.00 3.19 H new ATOM 0 HZ3 LYS A 76 7.850 -2.972 10.291 1.00 3.19 H new ATOM 1229 N SER A 77 1.088 -5.782 8.839 1.00 0.61 N ATOM 1230 CA SER A 77 -0.242 -5.368 8.443 1.00 0.72 C ATOM 1231 C SER A 77 -0.821 -6.403 7.505 1.00 0.61 C ATOM 1232 O SER A 77 -1.975 -6.321 7.086 1.00 0.65 O ATOM 1233 CB SER A 77 -0.168 -4.009 7.741 1.00 0.91 C ATOM 1234 OG SER A 77 0.614 -3.090 8.487 1.00 1.58 O ATOM 0 H SER A 77 1.794 -5.670 8.112 1.00 0.61 H new ATOM 0 HA SER A 77 -0.880 -5.277 9.322 1.00 0.72 H new ATOM 0 HB2 SER A 77 0.261 -4.133 6.747 1.00 0.91 H new ATOM 0 HB3 SER A 77 -1.174 -3.610 7.607 1.00 0.91 H new ATOM 0 HG SER A 77 0.647 -2.231 8.016 1.00 1.58 H new ATOM 1240 N LEU A 78 -0.004 -7.390 7.195 1.00 0.54 N ATOM 1241 CA LEU A 78 -0.361 -8.392 6.214 1.00 0.50 C ATOM 1242 C LEU A 78 -0.598 -9.739 6.863 1.00 0.53 C ATOM 1243 O LEU A 78 -0.142 -10.005 7.979 1.00 0.71 O ATOM 1244 CB LEU A 78 0.720 -8.504 5.140 1.00 0.45 C ATOM 1245 CG LEU A 78 0.808 -7.302 4.196 1.00 0.45 C ATOM 1246 CD1 LEU A 78 1.934 -7.477 3.187 1.00 0.49 C ATOM 1247 CD2 LEU A 78 -0.524 -7.096 3.496 1.00 0.51 C ATOM 0 H LEU A 78 0.918 -7.519 7.612 1.00 0.54 H new ATOM 0 HA LEU A 78 -1.292 -8.076 5.743 1.00 0.50 H new ATOM 0 HB2 LEU A 78 1.686 -8.638 5.628 1.00 0.45 H new ATOM 0 HB3 LEU A 78 0.535 -9.401 4.549 1.00 0.45 H new ATOM 0 HG LEU A 78 1.034 -6.414 4.785 1.00 0.45 H new ATOM 0 HD11 LEU A 78 1.972 -6.608 2.530 1.00 0.49 H new ATOM 0 HD12 LEU A 78 2.883 -7.575 3.714 1.00 0.49 H new ATOM 0 HD13 LEU A 78 1.754 -8.373 2.593 1.00 0.49 H new ATOM 0 HD21 LEU A 78 -0.454 -6.239 2.826 1.00 0.51 H new ATOM 0 HD22 LEU A 78 -0.774 -7.987 2.921 1.00 0.51 H new ATOM 0 HD23 LEU A 78 -1.301 -6.914 4.239 1.00 0.51 H new ATOM 1259 N GLN A 79 -1.325 -10.581 6.150 1.00 0.46 N ATOM 1260 CA GLN A 79 -1.708 -11.885 6.649 1.00 0.50 C ATOM 1261 C GLN A 79 -1.594 -12.951 5.565 1.00 0.48 C ATOM 1262 O GLN A 79 -0.793 -13.878 5.676 1.00 0.55 O ATOM 1263 CB GLN A 79 -3.146 -11.839 7.176 1.00 0.56 C ATOM 1264 CG GLN A 79 -3.263 -11.473 8.634 1.00 0.55 C ATOM 1265 CD GLN A 79 -2.596 -12.479 9.556 1.00 1.03 C ATOM 1266 OE1 GLN A 79 -3.219 -13.445 9.995 1.00 1.66 O ATOM 1267 NE2 GLN A 79 -1.327 -12.253 9.861 1.00 1.73 N ATOM 0 H GLN A 79 -1.665 -10.378 5.210 1.00 0.46 H new ATOM 0 HA GLN A 79 -1.027 -12.148 7.458 1.00 0.50 H new ATOM 0 HB2 GLN A 79 -3.713 -11.119 6.586 1.00 0.56 H new ATOM 0 HB3 GLN A 79 -3.609 -12.814 7.020 1.00 0.56 H new ATOM 0 HG2 GLN A 79 -2.816 -10.491 8.793 1.00 0.55 H new ATOM 0 HG3 GLN A 79 -4.317 -11.390 8.898 1.00 0.55 H new ATOM 0 HE21 GLN A 79 -0.847 -11.440 9.475 1.00 1.73 H new ATOM 0 HE22 GLN A 79 -0.830 -12.892 10.481 1.00 1.73 H new ATOM 1276 N VAL A 80 -2.377 -12.800 4.502 1.00 0.41 N ATOM 1277 CA VAL A 80 -2.565 -13.879 3.542 1.00 0.43 C ATOM 1278 C VAL A 80 -2.599 -13.343 2.116 1.00 0.39 C ATOM 1279 O VAL A 80 -3.376 -12.446 1.805 1.00 0.45 O ATOM 1280 CB VAL A 80 -3.883 -14.644 3.814 1.00 0.48 C ATOM 1281 CG1 VAL A 80 -3.988 -15.871 2.925 1.00 0.78 C ATOM 1282 CG2 VAL A 80 -4.006 -15.033 5.286 1.00 0.74 C ATOM 0 H VAL A 80 -2.889 -11.945 4.285 1.00 0.41 H new ATOM 0 HA VAL A 80 -1.720 -14.558 3.657 1.00 0.43 H new ATOM 0 HB VAL A 80 -4.709 -13.975 3.575 1.00 0.48 H new ATOM 0 HG11 VAL A 80 -4.922 -16.393 3.134 1.00 0.78 H new ATOM 0 HG12 VAL A 80 -3.969 -15.565 1.879 1.00 0.78 H new ATOM 0 HG13 VAL A 80 -3.148 -16.537 3.123 1.00 0.78 H new ATOM 0 HG21 VAL A 80 -4.942 -15.569 5.444 1.00 0.74 H new ATOM 0 HG22 VAL A 80 -3.170 -15.674 5.564 1.00 0.74 H new ATOM 0 HG23 VAL A 80 -3.994 -14.134 5.902 1.00 0.74 H new ATOM 1292 N TYR A 81 -1.733 -13.877 1.273 1.00 0.42 N ATOM 1293 CA TYR A 81 -1.694 -13.540 -0.142 1.00 0.46 C ATOM 1294 C TYR A 81 -2.492 -14.552 -0.969 1.00 0.51 C ATOM 1295 O TYR A 81 -2.554 -15.730 -0.614 1.00 0.78 O ATOM 1296 CB TYR A 81 -0.235 -13.580 -0.585 1.00 0.74 C ATOM 1297 CG TYR A 81 0.373 -14.976 -0.474 1.00 1.91 C ATOM 1298 CD1 TYR A 81 0.909 -15.431 0.724 1.00 3.05 C ATOM 1299 CD2 TYR A 81 0.388 -15.844 -1.561 1.00 2.02 C ATOM 1300 CE1 TYR A 81 1.445 -16.700 0.833 1.00 4.21 C ATOM 1301 CE2 TYR A 81 0.923 -17.110 -1.461 1.00 3.15 C ATOM 1302 CZ TYR A 81 1.448 -17.536 -0.263 1.00 4.24 C ATOM 1303 OH TYR A 81 1.977 -18.803 -0.161 1.00 5.40 O ATOM 0 H TYR A 81 -1.031 -14.562 1.552 1.00 0.42 H new ATOM 0 HA TYR A 81 -2.133 -12.554 -0.294 1.00 0.46 H new ATOM 0 HB2 TYR A 81 -0.163 -13.237 -1.617 1.00 0.74 H new ATOM 0 HB3 TYR A 81 0.345 -12.886 0.023 1.00 0.74 H new ATOM 0 HD1 TYR A 81 0.907 -14.781 1.586 1.00 3.05 H new ATOM 0 HD2 TYR A 81 -0.028 -15.519 -2.503 1.00 2.02 H new ATOM 0 HE1 TYR A 81 1.860 -17.035 1.772 1.00 4.21 H new ATOM 0 HE2 TYR A 81 0.930 -17.765 -2.320 1.00 3.15 H new ATOM 0 HH TYR A 81 1.899 -19.261 -1.024 1.00 5.40 H new ATOM 1313 N ASN A 82 -3.081 -14.089 -2.072 1.00 0.42 N ATOM 1314 CA ASN A 82 -3.684 -14.968 -3.077 1.00 0.46 C ATOM 1315 C ASN A 82 -3.747 -14.248 -4.414 1.00 0.44 C ATOM 1316 O ASN A 82 -4.538 -13.322 -4.593 1.00 0.45 O ATOM 1317 CB ASN A 82 -5.102 -15.444 -2.713 1.00 0.50 C ATOM 1318 CG ASN A 82 -5.137 -16.514 -1.633 1.00 0.93 C ATOM 1319 OD1 ASN A 82 -5.329 -16.219 -0.454 1.00 1.69 O ATOM 1320 ND2 ASN A 82 -4.940 -17.763 -2.027 1.00 1.40 N ATOM 0 H ASN A 82 -3.154 -13.096 -2.295 1.00 0.42 H new ATOM 0 HA ASN A 82 -3.047 -15.851 -3.126 1.00 0.46 H new ATOM 0 HB2 ASN A 82 -5.688 -14.587 -2.380 1.00 0.50 H new ATOM 0 HB3 ASN A 82 -5.585 -15.831 -3.610 1.00 0.50 H new ATOM 0 HD21 ASN A 82 -4.944 -18.520 -1.343 1.00 1.40 H new ATOM 0 HD22 ASN A 82 -4.784 -17.968 -3.014 1.00 1.40 H new ATOM 1327 N MET A 83 -2.907 -14.669 -5.339 1.00 0.47 N ATOM 1328 CA MET A 83 -2.896 -14.116 -6.687 1.00 0.48 C ATOM 1329 C MET A 83 -4.199 -14.494 -7.389 1.00 0.47 C ATOM 1330 O MET A 83 -4.370 -15.641 -7.806 1.00 0.57 O ATOM 1331 CB MET A 83 -1.704 -14.698 -7.448 1.00 0.58 C ATOM 1332 CG MET A 83 -0.864 -13.686 -8.214 1.00 0.63 C ATOM 1333 SD MET A 83 -0.091 -12.463 -7.142 1.00 1.66 S ATOM 1334 CE MET A 83 1.026 -11.675 -8.297 1.00 2.05 C ATOM 0 H MET A 83 -2.214 -15.401 -5.183 1.00 0.47 H new ATOM 0 HA MET A 83 -2.809 -13.030 -6.652 1.00 0.48 H new ATOM 0 HB2 MET A 83 -1.060 -15.217 -6.739 1.00 0.58 H new ATOM 0 HB3 MET A 83 -2.072 -15.446 -8.151 1.00 0.58 H new ATOM 0 HG2 MET A 83 -0.090 -14.212 -8.773 1.00 0.63 H new ATOM 0 HG3 MET A 83 -1.494 -13.176 -8.943 1.00 0.63 H new ATOM 0 HE1 MET A 83 1.963 -11.439 -7.793 1.00 2.05 H new ATOM 0 HE2 MET A 83 1.222 -12.349 -9.131 1.00 2.05 H new ATOM 0 HE3 MET A 83 0.574 -10.756 -8.671 1.00 2.05 H new ATOM 1344 N VAL A 84 -5.128 -13.544 -7.506 1.00 0.38 N ATOM 1345 CA VAL A 84 -6.455 -13.865 -8.033 1.00 0.39 C ATOM 1346 C VAL A 84 -6.426 -13.920 -9.548 1.00 0.42 C ATOM 1347 O VAL A 84 -6.289 -14.986 -10.143 1.00 0.64 O ATOM 1348 CB VAL A 84 -7.558 -12.852 -7.621 1.00 0.38 C ATOM 1349 CG1 VAL A 84 -8.827 -13.571 -7.185 1.00 0.55 C ATOM 1350 CG2 VAL A 84 -7.082 -11.894 -6.543 1.00 0.42 C ATOM 0 H VAL A 84 -4.991 -12.566 -7.249 1.00 0.38 H new ATOM 0 HA VAL A 84 -6.705 -14.833 -7.600 1.00 0.39 H new ATOM 0 HB VAL A 84 -7.787 -12.256 -8.504 1.00 0.38 H new ATOM 0 HG11 VAL A 84 -9.582 -12.837 -6.902 1.00 0.55 H new ATOM 0 HG12 VAL A 84 -9.202 -14.179 -8.008 1.00 0.55 H new ATOM 0 HG13 VAL A 84 -8.607 -14.212 -6.332 1.00 0.55 H new ATOM 0 HG21 VAL A 84 -7.887 -11.205 -6.287 1.00 0.42 H new ATOM 0 HG22 VAL A 84 -6.792 -12.458 -5.657 1.00 0.42 H new ATOM 0 HG23 VAL A 84 -6.224 -11.330 -6.910 1.00 0.42 H new ATOM 1360 N HIS A 85 -6.516 -12.756 -10.161 1.00 0.30 N ATOM 1361 CA HIS A 85 -6.653 -12.656 -11.599 1.00 0.31 C ATOM 1362 C HIS A 85 -5.568 -11.748 -12.143 1.00 0.32 C ATOM 1363 O HIS A 85 -5.625 -10.536 -11.975 1.00 0.38 O ATOM 1364 CB HIS A 85 -8.044 -12.105 -11.933 1.00 0.37 C ATOM 1365 CG HIS A 85 -8.466 -12.263 -13.361 1.00 0.80 C ATOM 1366 ND1 HIS A 85 -9.371 -13.217 -13.765 1.00 1.36 N ATOM 1367 CD2 HIS A 85 -8.145 -11.557 -14.470 1.00 1.71 C ATOM 1368 CE1 HIS A 85 -9.591 -13.091 -15.059 1.00 1.75 C ATOM 1369 NE2 HIS A 85 -8.858 -12.093 -15.514 1.00 1.96 N ATOM 0 H HIS A 85 -6.496 -11.858 -9.678 1.00 0.30 H new ATOM 0 HA HIS A 85 -6.546 -13.638 -12.059 1.00 0.31 H new ATOM 0 HB2 HIS A 85 -8.777 -12.602 -11.297 1.00 0.37 H new ATOM 0 HB3 HIS A 85 -8.068 -11.045 -11.679 1.00 0.37 H new ATOM 0 HD1 HIS A 85 -9.804 -13.913 -13.158 1.00 1.36 H new ATOM 0 HD2 HIS A 85 -7.456 -10.727 -14.524 1.00 1.71 H new ATOM 0 HE1 HIS A 85 -10.259 -13.702 -15.648 1.00 1.75 H new ATOM 1378 N ARG A 86 -4.565 -12.335 -12.762 1.00 0.34 N ATOM 1379 CA ARG A 86 -3.464 -11.568 -13.315 1.00 0.36 C ATOM 1380 C ARG A 86 -3.753 -11.247 -14.774 1.00 0.38 C ATOM 1381 O ARG A 86 -3.857 -12.142 -15.612 1.00 0.52 O ATOM 1382 CB ARG A 86 -2.162 -12.344 -13.150 1.00 0.40 C ATOM 1383 CG ARG A 86 -1.948 -12.833 -11.723 1.00 0.45 C ATOM 1384 CD ARG A 86 -0.592 -13.493 -11.560 1.00 0.69 C ATOM 1385 NE ARG A 86 -0.616 -14.895 -11.966 1.00 1.15 N ATOM 1386 CZ ARG A 86 0.375 -15.752 -11.721 1.00 1.68 C ATOM 1387 NH1 ARG A 86 1.488 -15.325 -11.139 1.00 1.98 N ATOM 1388 NH2 ARG A 86 0.257 -17.026 -12.070 1.00 2.44 N ATOM 0 H ARG A 86 -4.488 -13.343 -12.896 1.00 0.34 H new ATOM 0 HA ARG A 86 -3.356 -10.625 -12.779 1.00 0.36 H new ATOM 0 HB2 ARG A 86 -2.165 -13.199 -13.826 1.00 0.40 H new ATOM 0 HB3 ARG A 86 -1.325 -11.709 -13.442 1.00 0.40 H new ATOM 0 HG2 ARG A 86 -2.031 -11.993 -11.033 1.00 0.45 H new ATOM 0 HG3 ARG A 86 -2.733 -13.541 -11.458 1.00 0.45 H new ATOM 0 HD2 ARG A 86 0.147 -12.956 -12.154 1.00 0.69 H new ATOM 0 HD3 ARG A 86 -0.277 -13.422 -10.519 1.00 0.69 H new ATOM 0 HE ARG A 86 -1.437 -15.238 -12.465 1.00 1.15 H new ATOM 0 HH11 ARG A 86 1.584 -14.343 -10.880 1.00 1.98 H new ATOM 0 HH12 ARG A 86 2.248 -15.979 -10.950 1.00 1.98 H new ATOM 0 HH21 ARG A 86 -0.594 -17.353 -12.527 1.00 2.44 H new ATOM 0 HH22 ARG A 86 1.017 -17.679 -11.881 1.00 2.44 H new ATOM 1402 N ILE A 87 -3.906 -9.962 -15.055 1.00 0.35 N ATOM 1403 CA ILE A 87 -4.400 -9.504 -16.347 1.00 0.36 C ATOM 1404 C ILE A 87 -3.292 -9.512 -17.385 1.00 0.39 C ATOM 1405 O ILE A 87 -3.503 -9.893 -18.539 1.00 0.47 O ATOM 1406 CB ILE A 87 -4.990 -8.071 -16.277 1.00 0.38 C ATOM 1407 CG1 ILE A 87 -5.011 -7.522 -14.840 1.00 0.32 C ATOM 1408 CG2 ILE A 87 -6.388 -8.047 -16.873 1.00 0.44 C ATOM 1409 CD1 ILE A 87 -5.995 -8.202 -13.910 1.00 0.27 C ATOM 0 H ILE A 87 -3.693 -9.210 -14.399 1.00 0.35 H new ATOM 0 HA ILE A 87 -5.191 -10.198 -16.632 1.00 0.36 H new ATOM 0 HB ILE A 87 -4.339 -7.422 -16.862 1.00 0.38 H new ATOM 0 HG12 ILE A 87 -4.011 -7.614 -14.417 1.00 0.32 H new ATOM 0 HG13 ILE A 87 -5.244 -6.458 -14.877 1.00 0.32 H new ATOM 0 HG21 ILE A 87 -6.790 -7.035 -16.817 1.00 0.44 H new ATOM 0 HG22 ILE A 87 -6.345 -8.363 -17.915 1.00 0.44 H new ATOM 0 HG23 ILE A 87 -7.033 -8.725 -16.315 1.00 0.44 H new ATOM 0 HD11 ILE A 87 -5.936 -7.746 -12.922 1.00 0.27 H new ATOM 0 HD12 ILE A 87 -7.005 -8.088 -14.303 1.00 0.27 H new ATOM 0 HD13 ILE A 87 -5.752 -9.262 -13.836 1.00 0.27 H new ATOM 1421 N ASP A 88 -2.113 -9.093 -16.965 1.00 0.42 N ATOM 1422 CA ASP A 88 -0.977 -8.993 -17.858 1.00 0.56 C ATOM 1423 C ASP A 88 0.304 -9.184 -17.055 1.00 0.67 C ATOM 1424 O ASP A 88 0.248 -9.663 -15.922 1.00 1.18 O ATOM 1425 CB ASP A 88 -0.993 -7.637 -18.578 1.00 0.65 C ATOM 1426 CG ASP A 88 -0.076 -7.593 -19.786 1.00 1.16 C ATOM 1427 OD1 ASP A 88 -0.456 -8.114 -20.852 1.00 1.35 O ATOM 1428 OD2 ASP A 88 1.029 -7.029 -19.679 1.00 1.86 O ATOM 0 H ASP A 88 -1.918 -8.815 -16.003 1.00 0.42 H new ATOM 0 HA ASP A 88 -1.029 -9.771 -18.620 1.00 0.56 H new ATOM 0 HB2 ASP A 88 -2.012 -7.412 -18.894 1.00 0.65 H new ATOM 0 HB3 ASP A 88 -0.698 -6.857 -17.877 1.00 0.65 H new ATOM 1433 N SER A 89 1.440 -8.791 -17.600 1.00 0.65 N ATOM 1434 CA SER A 89 2.712 -9.037 -16.944 1.00 0.70 C ATOM 1435 C SER A 89 2.934 -8.072 -15.780 1.00 0.53 C ATOM 1436 O SER A 89 3.765 -8.328 -14.908 1.00 0.59 O ATOM 1437 CB SER A 89 3.860 -8.922 -17.954 1.00 0.94 C ATOM 1438 OG SER A 89 5.109 -9.231 -17.356 1.00 1.44 O ATOM 0 H SER A 89 1.509 -8.302 -18.492 1.00 0.65 H new ATOM 0 HA SER A 89 2.691 -10.049 -16.541 1.00 0.70 H new ATOM 0 HB2 SER A 89 3.679 -9.596 -18.791 1.00 0.94 H new ATOM 0 HB3 SER A 89 3.890 -7.911 -18.360 1.00 0.94 H new ATOM 0 HG SER A 89 5.074 -9.024 -16.399 1.00 1.44 H new ATOM 1444 N ASP A 90 2.184 -6.976 -15.755 1.00 0.47 N ATOM 1445 CA ASP A 90 2.388 -5.947 -14.750 1.00 0.48 C ATOM 1446 C ASP A 90 1.059 -5.470 -14.189 1.00 0.39 C ATOM 1447 O ASP A 90 0.983 -4.416 -13.555 1.00 0.41 O ATOM 1448 CB ASP A 90 3.172 -4.765 -15.337 1.00 0.73 C ATOM 1449 CG ASP A 90 2.548 -4.190 -16.600 1.00 1.21 C ATOM 1450 OD1 ASP A 90 1.395 -4.543 -16.924 1.00 1.87 O ATOM 1451 OD2 ASP A 90 3.219 -3.376 -17.276 1.00 1.70 O ATOM 0 H ASP A 90 1.433 -6.780 -16.417 1.00 0.47 H new ATOM 0 HA ASP A 90 2.970 -6.380 -13.937 1.00 0.48 H new ATOM 0 HB2 ASP A 90 3.244 -3.978 -14.586 1.00 0.73 H new ATOM 0 HB3 ASP A 90 4.189 -5.088 -15.558 1.00 0.73 H new ATOM 1456 N THR A 91 0.011 -6.256 -14.402 1.00 0.35 N ATOM 1457 CA THR A 91 -1.300 -5.890 -13.948 1.00 0.32 C ATOM 1458 C THR A 91 -1.886 -7.062 -13.186 1.00 0.28 C ATOM 1459 O THR A 91 -2.234 -8.087 -13.778 1.00 0.30 O ATOM 1460 CB THR A 91 -2.210 -5.525 -15.132 1.00 0.36 C ATOM 1461 OG1 THR A 91 -1.415 -5.138 -16.263 1.00 0.46 O ATOM 1462 CG2 THR A 91 -3.140 -4.385 -14.763 1.00 0.35 C ATOM 0 H THR A 91 0.057 -7.151 -14.889 1.00 0.35 H new ATOM 0 HA THR A 91 -1.228 -5.015 -13.302 1.00 0.32 H new ATOM 0 HB THR A 91 -2.806 -6.402 -15.385 1.00 0.36 H new ATOM 0 HG1 THR A 91 -0.978 -4.280 -16.078 1.00 0.46 H new ATOM 0 HG21 THR A 91 -3.775 -4.143 -15.615 1.00 0.35 H new ATOM 0 HG22 THR A 91 -3.763 -4.682 -13.919 1.00 0.35 H new ATOM 0 HG23 THR A 91 -2.551 -3.509 -14.489 1.00 0.35 H new ATOM 1470 N PHE A 92 -1.958 -6.932 -11.879 1.00 0.25 N ATOM 1471 CA PHE A 92 -2.357 -8.043 -11.043 1.00 0.25 C ATOM 1472 C PHE A 92 -3.517 -7.669 -10.161 1.00 0.22 C ATOM 1473 O PHE A 92 -3.902 -6.507 -10.072 1.00 0.21 O ATOM 1474 CB PHE A 92 -1.210 -8.486 -10.140 1.00 0.30 C ATOM 1475 CG PHE A 92 0.088 -8.696 -10.846 1.00 0.32 C ATOM 1476 CD1 PHE A 92 0.941 -7.638 -11.082 1.00 0.33 C ATOM 1477 CD2 PHE A 92 0.442 -9.957 -11.286 1.00 0.39 C ATOM 1478 CE1 PHE A 92 2.131 -7.830 -11.746 1.00 0.38 C ATOM 1479 CE2 PHE A 92 1.626 -10.164 -11.946 1.00 0.43 C ATOM 1480 CZ PHE A 92 2.511 -9.074 -12.131 1.00 0.41 C ATOM 0 H PHE A 92 -1.746 -6.072 -11.374 1.00 0.25 H new ATOM 0 HA PHE A 92 -2.643 -8.854 -11.713 1.00 0.25 H new ATOM 0 HB2 PHE A 92 -1.068 -7.737 -9.360 1.00 0.30 H new ATOM 0 HB3 PHE A 92 -1.493 -9.414 -9.643 1.00 0.30 H new ATOM 0 HD1 PHE A 92 0.672 -6.649 -10.742 1.00 0.33 H new ATOM 0 HD2 PHE A 92 -0.222 -10.790 -11.108 1.00 0.39 H new ATOM 0 HE1 PHE A 92 2.767 -6.984 -11.962 1.00 0.38 H new ATOM 0 HE2 PHE A 92 1.880 -11.145 -12.320 1.00 0.43 H new ATOM 0 HZ PHE A 92 3.482 -9.232 -12.576 1.00 0.41 H new ATOM 1490 N ILE A 93 -4.059 -8.669 -9.509 1.00 0.23 N ATOM 1491 CA ILE A 93 -5.041 -8.475 -8.473 1.00 0.23 C ATOM 1492 C ILE A 93 -4.696 -9.417 -7.340 1.00 0.28 C ATOM 1493 O ILE A 93 -4.601 -10.629 -7.557 1.00 0.33 O ATOM 1494 CB ILE A 93 -6.467 -8.773 -8.961 1.00 0.23 C ATOM 1495 CG1 ILE A 93 -6.727 -8.130 -10.314 1.00 0.24 C ATOM 1496 CG2 ILE A 93 -7.477 -8.266 -7.958 1.00 0.26 C ATOM 1497 CD1 ILE A 93 -8.103 -8.406 -10.848 1.00 0.41 C ATOM 0 H ILE A 93 -3.828 -9.647 -9.685 1.00 0.23 H new ATOM 0 HA ILE A 93 -5.021 -7.432 -8.157 1.00 0.23 H new ATOM 0 HB ILE A 93 -6.568 -9.853 -9.065 1.00 0.23 H new ATOM 0 HG12 ILE A 93 -6.587 -7.052 -10.229 1.00 0.24 H new ATOM 0 HG13 ILE A 93 -5.988 -8.492 -11.029 1.00 0.24 H new ATOM 0 HG21 ILE A 93 -8.484 -8.483 -8.314 1.00 0.26 H new ATOM 0 HG22 ILE A 93 -7.317 -8.760 -6.999 1.00 0.26 H new ATOM 0 HG23 ILE A 93 -7.359 -7.189 -7.836 1.00 0.26 H new ATOM 0 HD11 ILE A 93 -8.222 -7.918 -11.816 1.00 0.41 H new ATOM 0 HD12 ILE A 93 -8.239 -9.481 -10.964 1.00 0.41 H new ATOM 0 HD13 ILE A 93 -8.848 -8.019 -10.152 1.00 0.41 H new ATOM 1509 N CYS A 94 -4.467 -8.883 -6.161 1.00 0.36 N ATOM 1510 CA CYS A 94 -4.065 -9.716 -5.046 1.00 0.48 C ATOM 1511 C CYS A 94 -5.154 -9.781 -3.985 1.00 0.39 C ATOM 1512 O CYS A 94 -5.684 -8.760 -3.552 1.00 0.47 O ATOM 1513 CB CYS A 94 -2.760 -9.206 -4.431 1.00 0.74 C ATOM 1514 SG CYS A 94 -1.974 -10.378 -3.297 1.00 2.01 S ATOM 0 H CYS A 94 -4.550 -7.889 -5.949 1.00 0.36 H new ATOM 0 HA CYS A 94 -3.902 -10.723 -5.429 1.00 0.48 H new ATOM 0 HB2 CYS A 94 -2.061 -8.968 -5.233 1.00 0.74 H new ATOM 0 HB3 CYS A 94 -2.961 -8.278 -3.896 1.00 0.74 H new ATOM 0 HG CYS A 94 -0.877 -9.860 -2.829 1.00 2.01 H new ATOM 1520 N HIS A 95 -5.514 -10.997 -3.608 1.00 0.37 N ATOM 1521 CA HIS A 95 -6.367 -11.220 -2.459 1.00 0.36 C ATOM 1522 C HIS A 95 -5.520 -11.171 -1.196 1.00 0.39 C ATOM 1523 O HIS A 95 -5.066 -12.193 -0.680 1.00 0.56 O ATOM 1524 CB HIS A 95 -7.127 -12.548 -2.587 1.00 0.41 C ATOM 1525 CG HIS A 95 -7.765 -13.033 -1.312 1.00 0.50 C ATOM 1526 ND1 HIS A 95 -7.605 -14.200 -0.645 1.00 1.20 N flip ATOM 1527 CD2 HIS A 95 -8.674 -12.301 -0.576 1.00 1.23 C flip ATOM 1528 CE1 HIS A 95 -8.409 -14.158 0.461 1.00 0.99 C flip ATOM 1529 NE2 HIS A 95 -9.041 -13.003 0.480 1.00 0.95 N flip ATOM 0 H HIS A 95 -5.224 -11.849 -4.088 1.00 0.37 H new ATOM 0 HA HIS A 95 -7.120 -10.434 -2.405 1.00 0.36 H new ATOM 0 HB2 HIS A 95 -7.902 -12.436 -3.345 1.00 0.41 H new ATOM 0 HB3 HIS A 95 -6.438 -13.312 -2.946 1.00 0.41 H new ATOM 0 HD2 HIS A 95 -9.029 -11.312 -0.824 1.00 1.23 H new ATOM 0 HE1 HIS A 95 -8.509 -14.942 1.197 1.00 0.99 H new ATOM 0 HE2 HIS A 95 -9.705 -12.701 1.193 1.00 0.95 H new ATOM 1538 N THR A 96 -5.292 -9.964 -0.739 1.00 0.35 N ATOM 1539 CA THR A 96 -4.465 -9.705 0.409 1.00 0.38 C ATOM 1540 C THR A 96 -5.299 -9.611 1.685 1.00 0.36 C ATOM 1541 O THR A 96 -6.089 -8.687 1.849 1.00 0.41 O ATOM 1542 CB THR A 96 -3.712 -8.377 0.214 1.00 0.43 C ATOM 1543 OG1 THR A 96 -3.075 -8.350 -1.072 1.00 0.50 O ATOM 1544 CG2 THR A 96 -2.669 -8.197 1.296 1.00 0.47 C ATOM 0 H THR A 96 -5.683 -9.122 -1.162 1.00 0.35 H new ATOM 0 HA THR A 96 -3.763 -10.533 0.508 1.00 0.38 H new ATOM 0 HB THR A 96 -4.434 -7.563 0.275 1.00 0.43 H new ATOM 0 HG1 THR A 96 -2.921 -9.267 -1.380 1.00 0.50 H new ATOM 0 HG21 THR A 96 -2.146 -7.253 1.143 1.00 0.47 H new ATOM 0 HG22 THR A 96 -3.155 -8.189 2.272 1.00 0.47 H new ATOM 0 HG23 THR A 96 -1.955 -9.019 1.253 1.00 0.47 H new ATOM 1552 N ILE A 97 -5.130 -10.558 2.591 1.00 0.38 N ATOM 1553 CA ILE A 97 -5.757 -10.435 3.894 1.00 0.40 C ATOM 1554 C ILE A 97 -4.959 -9.445 4.725 1.00 0.41 C ATOM 1555 O ILE A 97 -3.760 -9.618 4.947 1.00 0.42 O ATOM 1556 CB ILE A 97 -5.877 -11.780 4.640 1.00 0.47 C ATOM 1557 CG1 ILE A 97 -6.780 -12.742 3.859 1.00 0.56 C ATOM 1558 CG2 ILE A 97 -6.426 -11.558 6.048 1.00 0.51 C ATOM 1559 CD1 ILE A 97 -8.209 -12.261 3.723 1.00 1.03 C ATOM 0 H ILE A 97 -4.576 -11.403 2.453 1.00 0.38 H new ATOM 0 HA ILE A 97 -6.777 -10.082 3.740 1.00 0.40 H new ATOM 0 HB ILE A 97 -4.885 -12.224 4.721 1.00 0.47 H new ATOM 0 HG12 ILE A 97 -6.361 -12.893 2.864 1.00 0.56 H new ATOM 0 HG13 ILE A 97 -6.778 -13.712 4.356 1.00 0.56 H new ATOM 0 HG21 ILE A 97 -6.505 -12.516 6.563 1.00 0.51 H new ATOM 0 HG22 ILE A 97 -5.753 -10.903 6.602 1.00 0.51 H new ATOM 0 HG23 ILE A 97 -7.412 -11.097 5.986 1.00 0.51 H new ATOM 0 HD11 ILE A 97 -8.787 -12.993 3.159 1.00 1.03 H new ATOM 0 HD12 ILE A 97 -8.647 -12.137 4.713 1.00 1.03 H new ATOM 0 HD13 ILE A 97 -8.223 -11.306 3.198 1.00 1.03 H new ATOM 1571 N THR A 98 -5.635 -8.399 5.144 1.00 0.49 N ATOM 1572 CA THR A 98 -5.009 -7.271 5.785 1.00 0.56 C ATOM 1573 C THR A 98 -5.388 -7.194 7.259 1.00 0.63 C ATOM 1574 O THR A 98 -6.567 -7.235 7.617 1.00 0.77 O ATOM 1575 CB THR A 98 -5.426 -5.974 5.072 1.00 0.71 C ATOM 1576 OG1 THR A 98 -5.073 -6.055 3.686 1.00 1.38 O ATOM 1577 CG2 THR A 98 -4.764 -4.762 5.698 1.00 0.86 C ATOM 0 H THR A 98 -6.646 -8.309 5.047 1.00 0.49 H new ATOM 0 HA THR A 98 -3.928 -7.397 5.719 1.00 0.56 H new ATOM 0 HB THR A 98 -6.505 -5.860 5.175 1.00 0.71 H new ATOM 0 HG1 THR A 98 -5.768 -5.624 3.146 1.00 1.38 H new ATOM 0 HG21 THR A 98 -5.080 -3.862 5.171 1.00 0.86 H new ATOM 0 HG22 THR A 98 -5.055 -4.689 6.746 1.00 0.86 H new ATOM 0 HG23 THR A 98 -3.681 -4.862 5.628 1.00 0.86 H new ATOM 1585 N GLN A 99 -4.388 -7.078 8.106 1.00 0.59 N ATOM 1586 CA GLN A 99 -4.612 -6.932 9.526 1.00 0.72 C ATOM 1587 C GLN A 99 -4.591 -5.457 9.926 1.00 0.99 C ATOM 1588 O GLN A 99 -3.644 -4.986 10.558 1.00 1.32 O ATOM 1589 CB GLN A 99 -3.576 -7.704 10.348 1.00 0.61 C ATOM 1590 CG GLN A 99 -4.047 -9.092 10.752 1.00 0.80 C ATOM 1591 CD GLN A 99 -3.131 -9.752 11.765 1.00 1.04 C ATOM 1592 OE1 GLN A 99 -1.931 -9.493 11.799 1.00 1.62 O ATOM 1593 NE2 GLN A 99 -3.694 -10.617 12.594 1.00 1.82 N ATOM 0 H GLN A 99 -3.405 -7.082 7.832 1.00 0.59 H new ATOM 0 HA GLN A 99 -5.595 -7.351 9.740 1.00 0.72 H new ATOM 0 HB2 GLN A 99 -2.656 -7.793 9.770 1.00 0.61 H new ATOM 0 HB3 GLN A 99 -3.335 -7.134 11.245 1.00 0.61 H new ATOM 0 HG2 GLN A 99 -5.052 -9.023 11.169 1.00 0.80 H new ATOM 0 HG3 GLN A 99 -4.113 -9.721 9.864 1.00 0.80 H new ATOM 0 HE21 GLN A 99 -4.695 -10.804 12.533 1.00 1.82 H new ATOM 0 HE22 GLN A 99 -3.127 -11.096 13.294 1.00 1.82 H new ATOM 1602 N SER A 100 -5.618 -4.719 9.536 1.00 1.67 N ATOM 1603 CA SER A 100 -5.778 -3.341 9.986 1.00 2.03 C ATOM 1604 C SER A 100 -6.485 -3.341 11.334 1.00 1.60 C ATOM 1605 O SER A 100 -7.601 -2.845 11.472 1.00 2.41 O ATOM 1606 CB SER A 100 -6.579 -2.532 8.962 1.00 3.23 C ATOM 1607 OG SER A 100 -5.936 -2.529 7.698 1.00 3.91 O ATOM 0 H SER A 100 -6.353 -5.048 8.910 1.00 1.67 H new ATOM 0 HA SER A 100 -4.798 -2.876 10.088 1.00 2.03 H new ATOM 0 HB2 SER A 100 -7.580 -2.953 8.864 1.00 3.23 H new ATOM 0 HB3 SER A 100 -6.698 -1.508 9.316 1.00 3.23 H new ATOM 0 HG SER A 100 -6.468 -2.007 7.062 1.00 3.91 H new ATOM 1613 N PHE A 101 -5.824 -3.911 12.324 1.00 0.91 N ATOM 1614 CA PHE A 101 -6.471 -4.210 13.585 1.00 1.37 C ATOM 1615 C PHE A 101 -6.654 -2.989 14.481 1.00 1.09 C ATOM 1616 O PHE A 101 -5.731 -2.516 15.144 1.00 1.69 O ATOM 1617 CB PHE A 101 -5.749 -5.339 14.336 1.00 2.29 C ATOM 1618 CG PHE A 101 -4.254 -5.181 14.470 1.00 2.99 C ATOM 1619 CD1 PHE A 101 -3.400 -5.643 13.480 1.00 3.48 C ATOM 1620 CD2 PHE A 101 -3.707 -4.554 15.578 1.00 3.67 C ATOM 1621 CE1 PHE A 101 -2.032 -5.489 13.597 1.00 4.58 C ATOM 1622 CE2 PHE A 101 -2.339 -4.397 15.700 1.00 4.71 C ATOM 1623 CZ PHE A 101 -1.497 -4.913 14.727 1.00 5.16 C ATOM 0 H PHE A 101 -4.840 -4.176 12.278 1.00 0.91 H new ATOM 0 HA PHE A 101 -7.473 -4.552 13.326 1.00 1.37 H new ATOM 0 HB2 PHE A 101 -6.179 -5.420 15.334 1.00 2.29 H new ATOM 0 HB3 PHE A 101 -5.953 -6.280 13.824 1.00 2.29 H new ATOM 0 HD1 PHE A 101 -3.809 -6.129 12.607 1.00 3.48 H new ATOM 0 HD2 PHE A 101 -4.358 -4.183 16.356 1.00 3.67 H new ATOM 0 HE1 PHE A 101 -1.382 -5.821 12.801 1.00 4.58 H new ATOM 0 HE2 PHE A 101 -1.927 -3.874 16.551 1.00 4.71 H new ATOM 0 HZ PHE A 101 -0.426 -4.863 14.855 1.00 5.16 H new ATOM 1633 N ALA A 102 -7.861 -2.469 14.435 1.00 1.17 N ATOM 1634 CA ALA A 102 -8.401 -1.648 15.501 1.00 1.07 C ATOM 1635 C ALA A 102 -9.627 -2.380 16.017 1.00 1.42 C ATOM 1636 O ALA A 102 -10.761 -2.096 15.620 1.00 1.98 O ATOM 1637 CB ALA A 102 -8.738 -0.239 15.030 1.00 0.98 C ATOM 0 H ALA A 102 -8.501 -2.604 13.652 1.00 1.17 H new ATOM 0 HA ALA A 102 -7.664 -1.509 16.292 1.00 1.07 H new ATOM 0 HB1 ALA A 102 -9.139 0.337 15.864 1.00 0.98 H new ATOM 0 HB2 ALA A 102 -7.836 0.245 14.655 1.00 0.98 H new ATOM 0 HB3 ALA A 102 -9.480 -0.289 14.234 1.00 0.98 H new ATOM 1643 N VAL A 103 -9.373 -3.349 16.892 1.00 1.54 N ATOM 1644 CA VAL A 103 -10.335 -4.408 17.207 1.00 2.05 C ATOM 1645 C VAL A 103 -11.500 -3.913 18.072 1.00 1.79 C ATOM 1646 O VAL A 103 -12.219 -4.704 18.689 1.00 2.21 O ATOM 1647 CB VAL A 103 -9.626 -5.594 17.905 1.00 2.56 C ATOM 1648 CG1 VAL A 103 -10.472 -6.859 17.837 1.00 3.03 C ATOM 1649 CG2 VAL A 103 -8.251 -5.843 17.294 1.00 3.17 C ATOM 0 H VAL A 103 -8.494 -3.425 17.405 1.00 1.54 H new ATOM 0 HA VAL A 103 -10.756 -4.740 16.258 1.00 2.05 H new ATOM 0 HB VAL A 103 -9.495 -5.328 18.954 1.00 2.56 H new ATOM 0 HG11 VAL A 103 -9.948 -7.674 18.335 1.00 3.03 H new ATOM 0 HG12 VAL A 103 -11.427 -6.685 18.332 1.00 3.03 H new ATOM 0 HG13 VAL A 103 -10.647 -7.124 16.794 1.00 3.03 H new ATOM 0 HG21 VAL A 103 -7.774 -6.681 17.802 1.00 3.17 H new ATOM 0 HG22 VAL A 103 -8.360 -6.075 16.235 1.00 3.17 H new ATOM 0 HG23 VAL A 103 -7.635 -4.951 17.408 1.00 3.17 H new ATOM 1659 N GLY A 104 -11.707 -2.612 18.100 1.00 1.47 N ATOM 1660 CA GLY A 104 -12.868 -2.080 18.775 1.00 1.84 C ATOM 1661 C GLY A 104 -14.063 -2.114 17.855 1.00 1.67 C ATOM 1662 O GLY A 104 -15.212 -2.035 18.286 1.00 1.96 O ATOM 0 H GLY A 104 -11.097 -1.916 17.671 1.00 1.47 H new ATOM 0 HA2 GLY A 104 -13.074 -2.662 19.673 1.00 1.84 H new ATOM 0 HA3 GLY A 104 -12.675 -1.056 19.095 1.00 1.84 H new ATOM 1666 N SER A 105 -13.775 -2.250 16.571 1.00 1.38 N ATOM 1667 CA SER A 105 -14.802 -2.321 15.548 1.00 1.39 C ATOM 1668 C SER A 105 -14.309 -3.144 14.363 1.00 1.19 C ATOM 1669 O SER A 105 -15.014 -4.018 13.858 1.00 1.34 O ATOM 1670 CB SER A 105 -15.176 -0.909 15.090 1.00 1.59 C ATOM 1671 OG SER A 105 -15.741 -0.162 16.157 1.00 1.88 O ATOM 0 H SER A 105 -12.823 -2.314 16.210 1.00 1.38 H new ATOM 0 HA SER A 105 -15.685 -2.805 15.965 1.00 1.39 H new ATOM 0 HB2 SER A 105 -14.290 -0.398 14.713 1.00 1.59 H new ATOM 0 HB3 SER A 105 -15.886 -0.966 14.265 1.00 1.59 H new ATOM 0 HG SER A 105 -16.115 0.674 15.809 1.00 1.88 H new ATOM 1677 N ILE A 106 -13.070 -2.888 13.966 1.00 1.05 N ATOM 1678 CA ILE A 106 -12.492 -3.490 12.772 1.00 0.96 C ATOM 1679 C ILE A 106 -12.198 -4.972 12.965 1.00 0.94 C ATOM 1680 O ILE A 106 -11.622 -5.380 13.976 1.00 1.12 O ATOM 1681 CB ILE A 106 -11.185 -2.770 12.385 1.00 0.93 C ATOM 1682 CG1 ILE A 106 -11.450 -1.285 12.153 1.00 1.01 C ATOM 1683 CG2 ILE A 106 -10.567 -3.401 11.146 1.00 0.98 C ATOM 1684 CD1 ILE A 106 -10.192 -0.469 11.983 1.00 0.94 C ATOM 0 H ILE A 106 -12.438 -2.259 14.461 1.00 1.05 H new ATOM 0 HA ILE A 106 -13.229 -3.384 11.976 1.00 0.96 H new ATOM 0 HB ILE A 106 -10.477 -2.875 13.207 1.00 0.93 H new ATOM 0 HG12 ILE A 106 -12.072 -1.169 11.265 1.00 1.01 H new ATOM 0 HG13 ILE A 106 -12.019 -0.890 12.994 1.00 1.01 H new ATOM 0 HG21 ILE A 106 -9.646 -2.877 10.892 1.00 0.98 H new ATOM 0 HG22 ILE A 106 -10.345 -4.450 11.344 1.00 0.98 H new ATOM 0 HG23 ILE A 106 -11.267 -3.329 10.314 1.00 0.98 H new ATOM 0 HD11 ILE A 106 -10.455 0.576 11.822 1.00 0.94 H new ATOM 0 HD12 ILE A 106 -9.579 -0.555 12.880 1.00 0.94 H new ATOM 0 HD13 ILE A 106 -9.632 -0.838 11.124 1.00 0.94 H new ATOM 1696 N SER A 107 -12.628 -5.770 12.003 1.00 0.84 N ATOM 1697 CA SER A 107 -12.250 -7.171 11.924 1.00 0.86 C ATOM 1698 C SER A 107 -11.136 -7.316 10.886 1.00 0.79 C ATOM 1699 O SER A 107 -10.886 -6.367 10.136 1.00 0.77 O ATOM 1700 CB SER A 107 -13.470 -8.011 11.530 1.00 0.97 C ATOM 1701 OG SER A 107 -14.579 -7.707 12.362 1.00 1.35 O ATOM 0 H SER A 107 -13.250 -5.465 11.254 1.00 0.84 H new ATOM 0 HA SER A 107 -11.890 -7.523 12.891 1.00 0.86 H new ATOM 0 HB2 SER A 107 -13.728 -7.820 10.488 1.00 0.97 H new ATOM 0 HB3 SER A 107 -13.229 -9.071 11.610 1.00 0.97 H new ATOM 0 HG SER A 107 -15.348 -8.252 12.094 1.00 1.35 H new ATOM 1707 N PRO A 108 -10.433 -8.467 10.832 1.00 0.82 N ATOM 1708 CA PRO A 108 -9.444 -8.727 9.778 1.00 0.82 C ATOM 1709 C PRO A 108 -10.003 -8.364 8.406 1.00 0.73 C ATOM 1710 O PRO A 108 -11.068 -8.847 8.014 1.00 0.81 O ATOM 1711 CB PRO A 108 -9.204 -10.231 9.889 1.00 0.91 C ATOM 1712 CG PRO A 108 -9.458 -10.544 11.325 1.00 1.07 C ATOM 1713 CD PRO A 108 -10.534 -9.592 11.782 1.00 0.92 C ATOM 0 HA PRO A 108 -8.533 -8.139 9.891 1.00 0.82 H new ATOM 0 HB2 PRO A 108 -9.875 -10.789 9.236 1.00 0.91 H new ATOM 0 HB3 PRO A 108 -8.186 -10.493 9.599 1.00 0.91 H new ATOM 0 HG2 PRO A 108 -9.777 -11.579 11.447 1.00 1.07 H new ATOM 0 HG3 PRO A 108 -8.551 -10.419 11.917 1.00 1.07 H new ATOM 0 HD2 PRO A 108 -11.520 -10.056 11.749 1.00 0.92 H new ATOM 0 HD3 PRO A 108 -10.370 -9.265 12.809 1.00 0.92 H new ATOM 1721 N ARG A 109 -9.297 -7.517 7.673 1.00 0.61 N ATOM 1722 CA ARG A 109 -9.882 -6.918 6.494 1.00 0.56 C ATOM 1723 C ARG A 109 -9.360 -7.602 5.248 1.00 0.52 C ATOM 1724 O ARG A 109 -8.256 -8.137 5.234 1.00 0.66 O ATOM 1725 CB ARG A 109 -9.630 -5.403 6.469 1.00 0.64 C ATOM 1726 CG ARG A 109 -10.251 -4.700 5.275 1.00 1.05 C ATOM 1727 CD ARG A 109 -10.521 -3.230 5.548 1.00 0.88 C ATOM 1728 NE ARG A 109 -11.467 -3.031 6.645 1.00 1.89 N ATOM 1729 CZ ARG A 109 -11.227 -2.282 7.718 1.00 2.34 C ATOM 1730 NH1 ARG A 109 -10.040 -1.706 7.882 1.00 2.06 N ATOM 1731 NH2 ARG A 109 -12.184 -2.103 8.625 1.00 3.45 N ATOM 0 H ARG A 109 -8.337 -7.236 7.872 1.00 0.61 H new ATOM 0 HA ARG A 109 -10.962 -7.060 6.522 1.00 0.56 H new ATOM 0 HB2 ARG A 109 -10.025 -4.963 7.384 1.00 0.64 H new ATOM 0 HB3 ARG A 109 -8.555 -5.223 6.467 1.00 0.64 H new ATOM 0 HG2 ARG A 109 -9.586 -4.792 4.416 1.00 1.05 H new ATOM 0 HG3 ARG A 109 -11.185 -5.196 5.010 1.00 1.05 H new ATOM 0 HD2 ARG A 109 -9.583 -2.729 5.786 1.00 0.88 H new ATOM 0 HD3 ARG A 109 -10.912 -2.762 4.645 1.00 0.88 H new ATOM 0 HE ARG A 109 -12.372 -3.498 6.583 1.00 1.89 H new ATOM 0 HH11 ARG A 109 -9.308 -1.837 7.183 1.00 2.06 H new ATOM 0 HH12 ARG A 109 -9.861 -1.133 8.706 1.00 2.06 H new ATOM 0 HH21 ARG A 109 -13.097 -2.539 8.496 1.00 3.45 H new ATOM 0 HH22 ARG A 109 -12.005 -1.530 9.449 1.00 3.45 H new ATOM 1745 N ASP A 110 -10.164 -7.589 4.212 1.00 0.46 N ATOM 1746 CA ASP A 110 -9.875 -8.349 3.017 1.00 0.47 C ATOM 1747 C ASP A 110 -9.591 -7.396 1.872 1.00 0.44 C ATOM 1748 O ASP A 110 -10.374 -6.487 1.611 1.00 0.64 O ATOM 1749 CB ASP A 110 -11.069 -9.246 2.685 1.00 0.62 C ATOM 1750 CG ASP A 110 -10.740 -10.365 1.719 1.00 0.83 C ATOM 1751 OD1 ASP A 110 -9.960 -10.115 0.779 1.00 1.37 O ATOM 1752 OD2 ASP A 110 -11.223 -11.498 1.911 1.00 1.32 O ATOM 0 H ASP A 110 -11.032 -7.055 4.172 1.00 0.46 H new ATOM 0 HA ASP A 110 -8.998 -8.977 3.178 1.00 0.47 H new ATOM 0 HB2 ASP A 110 -11.456 -9.677 3.608 1.00 0.62 H new ATOM 0 HB3 ASP A 110 -11.865 -8.634 2.261 1.00 0.62 H new ATOM 1757 N PHE A 111 -8.470 -7.576 1.210 1.00 0.39 N ATOM 1758 CA PHE A 111 -8.104 -6.710 0.111 1.00 0.43 C ATOM 1759 C PHE A 111 -8.105 -7.461 -1.206 1.00 0.41 C ATOM 1760 O PHE A 111 -7.612 -8.582 -1.307 1.00 0.54 O ATOM 1761 CB PHE A 111 -6.728 -6.080 0.340 1.00 0.61 C ATOM 1762 CG PHE A 111 -6.756 -4.796 1.129 1.00 0.94 C ATOM 1763 CD1 PHE A 111 -7.739 -4.561 2.079 1.00 1.36 C ATOM 1764 CD2 PHE A 111 -5.792 -3.826 0.915 1.00 1.60 C ATOM 1765 CE1 PHE A 111 -7.758 -3.381 2.798 1.00 2.01 C ATOM 1766 CE2 PHE A 111 -5.806 -2.644 1.632 1.00 2.30 C ATOM 1767 CZ PHE A 111 -6.790 -2.422 2.575 1.00 2.41 C ATOM 0 H PHE A 111 -7.796 -8.314 1.413 1.00 0.39 H new ATOM 0 HA PHE A 111 -8.852 -5.919 0.064 1.00 0.43 H new ATOM 0 HB2 PHE A 111 -6.095 -6.799 0.860 1.00 0.61 H new ATOM 0 HB3 PHE A 111 -6.264 -5.888 -0.627 1.00 0.61 H new ATOM 0 HD1 PHE A 111 -8.498 -5.308 2.259 1.00 1.36 H new ATOM 0 HD2 PHE A 111 -5.020 -3.995 0.179 1.00 1.60 H new ATOM 0 HE1 PHE A 111 -8.530 -3.209 3.534 1.00 2.01 H new ATOM 0 HE2 PHE A 111 -5.048 -1.895 1.455 1.00 2.30 H new ATOM 0 HZ PHE A 111 -6.802 -1.500 3.137 1.00 2.41 H new ATOM 1777 N ILE A 112 -8.704 -6.836 -2.195 1.00 0.34 N ATOM 1778 CA ILE A 112 -8.584 -7.255 -3.576 1.00 0.33 C ATOM 1779 C ILE A 112 -8.080 -6.064 -4.360 1.00 0.35 C ATOM 1780 O ILE A 112 -8.842 -5.354 -5.022 1.00 0.43 O ATOM 1781 CB ILE A 112 -9.911 -7.763 -4.191 1.00 0.34 C ATOM 1782 CG1 ILE A 112 -10.423 -8.990 -3.451 1.00 0.40 C ATOM 1783 CG2 ILE A 112 -9.713 -8.108 -5.644 1.00 0.36 C ATOM 1784 CD1 ILE A 112 -9.540 -10.206 -3.616 1.00 0.42 C ATOM 0 H ILE A 112 -9.294 -6.015 -2.063 1.00 0.34 H new ATOM 0 HA ILE A 112 -7.898 -8.101 -3.619 1.00 0.33 H new ATOM 0 HB ILE A 112 -10.647 -6.964 -4.100 1.00 0.34 H new ATOM 0 HG12 ILE A 112 -10.509 -8.755 -2.390 1.00 0.40 H new ATOM 0 HG13 ILE A 112 -11.425 -9.228 -3.808 1.00 0.40 H new ATOM 0 HG21 ILE A 112 -10.653 -8.464 -6.065 1.00 0.36 H new ATOM 0 HG22 ILE A 112 -9.385 -7.222 -6.187 1.00 0.36 H new ATOM 0 HG23 ILE A 112 -8.957 -8.888 -5.733 1.00 0.36 H new ATOM 0 HD11 ILE A 112 -9.966 -11.043 -3.062 1.00 0.42 H new ATOM 0 HD12 ILE A 112 -9.473 -10.467 -4.672 1.00 0.42 H new ATOM 0 HD13 ILE A 112 -8.543 -9.987 -3.233 1.00 0.42 H new ATOM 1796 N ASP A 113 -6.801 -5.805 -4.219 1.00 0.36 N ATOM 1797 CA ASP A 113 -6.198 -4.656 -4.844 1.00 0.42 C ATOM 1798 C ASP A 113 -5.787 -4.994 -6.263 1.00 0.33 C ATOM 1799 O ASP A 113 -4.973 -5.884 -6.491 1.00 0.35 O ATOM 1800 CB ASP A 113 -5.000 -4.153 -4.020 1.00 0.58 C ATOM 1801 CG ASP A 113 -3.972 -5.233 -3.709 1.00 1.23 C ATOM 1802 OD1 ASP A 113 -4.285 -6.139 -2.905 1.00 1.32 O ATOM 1803 OD2 ASP A 113 -2.849 -5.165 -4.251 1.00 1.86 O ATOM 0 H ASP A 113 -6.157 -6.379 -3.674 1.00 0.36 H new ATOM 0 HA ASP A 113 -6.931 -3.850 -4.883 1.00 0.42 H new ATOM 0 HB2 ASP A 113 -4.511 -3.344 -4.563 1.00 0.58 H new ATOM 0 HB3 ASP A 113 -5.366 -3.732 -3.083 1.00 0.58 H new ATOM 1808 N LEU A 114 -6.410 -4.332 -7.229 1.00 0.28 N ATOM 1809 CA LEU A 114 -5.927 -4.418 -8.598 1.00 0.23 C ATOM 1810 C LEU A 114 -4.768 -3.484 -8.768 1.00 0.22 C ATOM 1811 O LEU A 114 -4.914 -2.258 -8.780 1.00 0.24 O ATOM 1812 CB LEU A 114 -6.979 -4.106 -9.634 1.00 0.23 C ATOM 1813 CG LEU A 114 -6.413 -3.794 -11.026 1.00 0.22 C ATOM 1814 CD1 LEU A 114 -6.010 -5.070 -11.749 1.00 0.21 C ATOM 1815 CD2 LEU A 114 -7.411 -2.999 -11.846 1.00 0.26 C ATOM 0 H LEU A 114 -7.232 -3.743 -7.095 1.00 0.28 H new ATOM 0 HA LEU A 114 -5.629 -5.454 -8.763 1.00 0.23 H new ATOM 0 HB2 LEU A 114 -7.660 -4.954 -9.712 1.00 0.23 H new ATOM 0 HB3 LEU A 114 -7.568 -3.254 -9.294 1.00 0.23 H new ATOM 0 HG LEU A 114 -5.518 -3.185 -10.898 1.00 0.22 H new ATOM 0 HD11 LEU A 114 -5.612 -4.821 -12.733 1.00 0.21 H new ATOM 0 HD12 LEU A 114 -5.247 -5.591 -11.170 1.00 0.21 H new ATOM 0 HD13 LEU A 114 -6.882 -5.714 -11.863 1.00 0.21 H new ATOM 0 HD21 LEU A 114 -6.989 -2.789 -12.829 1.00 0.26 H new ATOM 0 HD22 LEU A 114 -8.329 -3.576 -11.961 1.00 0.26 H new ATOM 0 HD23 LEU A 114 -7.633 -2.060 -11.338 1.00 0.26 H new ATOM 1827 N VAL A 115 -3.638 -4.082 -8.949 1.00 0.23 N ATOM 1828 CA VAL A 115 -2.382 -3.421 -8.787 1.00 0.23 C ATOM 1829 C VAL A 115 -1.591 -3.418 -10.065 1.00 0.23 C ATOM 1830 O VAL A 115 -1.369 -4.460 -10.687 1.00 0.24 O ATOM 1831 CB VAL A 115 -1.609 -4.120 -7.670 1.00 0.24 C ATOM 1832 CG1 VAL A 115 -2.092 -5.564 -7.554 1.00 0.25 C ATOM 1833 CG2 VAL A 115 -0.106 -4.053 -7.885 1.00 0.26 C ATOM 0 H VAL A 115 -3.558 -5.062 -9.219 1.00 0.23 H new ATOM 0 HA VAL A 115 -2.556 -2.378 -8.523 1.00 0.23 H new ATOM 0 HB VAL A 115 -1.805 -3.598 -6.733 1.00 0.24 H new ATOM 0 HG11 VAL A 115 -1.544 -6.068 -6.758 1.00 0.25 H new ATOM 0 HG12 VAL A 115 -3.157 -5.574 -7.323 1.00 0.25 H new ATOM 0 HG13 VAL A 115 -1.920 -6.082 -8.498 1.00 0.25 H new ATOM 0 HG21 VAL A 115 0.402 -4.563 -7.066 1.00 0.26 H new ATOM 0 HG22 VAL A 115 0.149 -4.537 -8.828 1.00 0.26 H new ATOM 0 HG23 VAL A 115 0.211 -3.011 -7.915 1.00 0.26 H new ATOM 1843 N TYR A 116 -1.203 -2.238 -10.475 1.00 0.25 N ATOM 1844 CA TYR A 116 -0.316 -2.120 -11.595 1.00 0.25 C ATOM 1845 C TYR A 116 1.083 -1.774 -11.117 1.00 0.26 C ATOM 1846 O TYR A 116 1.321 -0.681 -10.594 1.00 0.28 O ATOM 1847 CB TYR A 116 -0.824 -1.068 -12.574 1.00 0.31 C ATOM 1848 CG TYR A 116 -0.205 -1.148 -13.953 1.00 0.83 C ATOM 1849 CD1 TYR A 116 1.097 -0.720 -14.167 1.00 1.10 C ATOM 1850 CD2 TYR A 116 -0.917 -1.646 -15.037 1.00 1.31 C ATOM 1851 CE1 TYR A 116 1.674 -0.787 -15.417 1.00 1.65 C ATOM 1852 CE2 TYR A 116 -0.345 -1.715 -16.293 1.00 1.87 C ATOM 1853 CZ TYR A 116 0.909 -1.303 -16.493 1.00 1.99 C ATOM 1854 OH TYR A 116 1.524 -1.345 -17.729 1.00 2.57 O ATOM 0 H TYR A 116 -1.486 -1.354 -10.052 1.00 0.25 H new ATOM 0 HA TYR A 116 -0.281 -3.077 -12.115 1.00 0.25 H new ATOM 0 HB2 TYR A 116 -1.905 -1.168 -12.668 1.00 0.31 H new ATOM 0 HB3 TYR A 116 -0.630 -0.079 -12.159 1.00 0.31 H new ATOM 0 HD1 TYR A 116 1.669 -0.327 -13.339 1.00 1.10 H new ATOM 0 HD2 TYR A 116 -1.933 -1.984 -14.896 1.00 1.31 H new ATOM 0 HE1 TYR A 116 2.689 -0.453 -15.574 1.00 1.65 H new ATOM 0 HE2 TYR A 116 -0.918 -2.106 -17.121 1.00 1.87 H new ATOM 0 HH TYR A 116 2.309 -1.930 -17.684 1.00 2.57 H new ATOM 1864 N ILE A 117 1.996 -2.711 -11.296 1.00 0.30 N ATOM 1865 CA ILE A 117 3.372 -2.526 -10.878 1.00 0.33 C ATOM 1866 C ILE A 117 4.193 -2.005 -12.044 1.00 0.38 C ATOM 1867 O ILE A 117 4.598 -2.766 -12.925 1.00 0.46 O ATOM 1868 CB ILE A 117 3.983 -3.844 -10.355 1.00 0.42 C ATOM 1869 CG1 ILE A 117 3.165 -4.368 -9.172 1.00 0.45 C ATOM 1870 CG2 ILE A 117 5.436 -3.637 -9.944 1.00 0.52 C ATOM 1871 CD1 ILE A 117 3.479 -5.796 -8.795 1.00 0.89 C ATOM 0 H ILE A 117 1.807 -3.614 -11.731 1.00 0.30 H new ATOM 0 HA ILE A 117 3.386 -1.802 -10.064 1.00 0.33 H new ATOM 0 HB ILE A 117 3.957 -4.582 -11.157 1.00 0.42 H new ATOM 0 HG12 ILE A 117 3.342 -3.727 -8.308 1.00 0.45 H new ATOM 0 HG13 ILE A 117 2.105 -4.291 -9.414 1.00 0.45 H new ATOM 0 HG21 ILE A 117 5.848 -4.577 -9.578 1.00 0.52 H new ATOM 0 HG22 ILE A 117 6.013 -3.298 -10.805 1.00 0.52 H new ATOM 0 HG23 ILE A 117 5.488 -2.887 -9.155 1.00 0.52 H new ATOM 0 HD11 ILE A 117 2.859 -6.094 -7.949 1.00 0.89 H new ATOM 0 HD12 ILE A 117 3.274 -6.450 -9.643 1.00 0.89 H new ATOM 0 HD13 ILE A 117 4.531 -5.877 -8.520 1.00 0.89 H new ATOM 1883 N LYS A 118 4.421 -0.706 -12.054 1.00 0.42 N ATOM 1884 CA LYS A 118 5.154 -0.076 -13.135 1.00 0.52 C ATOM 1885 C LYS A 118 6.421 0.562 -12.596 1.00 0.39 C ATOM 1886 O LYS A 118 6.420 1.143 -11.510 1.00 0.34 O ATOM 1887 CB LYS A 118 4.297 0.988 -13.826 1.00 0.70 C ATOM 1888 CG LYS A 118 4.873 1.458 -15.154 1.00 0.93 C ATOM 1889 CD LYS A 118 4.202 2.729 -15.655 1.00 0.94 C ATOM 1890 CE LYS A 118 2.701 2.560 -15.841 1.00 0.72 C ATOM 1891 NZ LYS A 118 2.079 3.772 -16.444 1.00 1.20 N ATOM 0 H LYS A 118 4.109 -0.065 -11.324 1.00 0.42 H new ATOM 0 HA LYS A 118 5.413 -0.842 -13.866 1.00 0.52 H new ATOM 0 HB2 LYS A 118 3.298 0.587 -13.993 1.00 0.70 H new ATOM 0 HB3 LYS A 118 4.189 1.845 -13.161 1.00 0.70 H new ATOM 0 HG2 LYS A 118 5.943 1.634 -15.042 1.00 0.93 H new ATOM 0 HG3 LYS A 118 4.756 0.670 -15.898 1.00 0.93 H new ATOM 0 HD2 LYS A 118 4.389 3.538 -14.948 1.00 0.94 H new ATOM 0 HD3 LYS A 118 4.652 3.024 -16.603 1.00 0.94 H new ATOM 0 HE2 LYS A 118 2.508 1.697 -16.479 1.00 0.72 H new ATOM 0 HE3 LYS A 118 2.236 2.354 -14.877 1.00 0.72 H new ATOM 0 HZ1 LYS A 118 1.044 3.674 -16.431 1.00 1.20 H new ATOM 0 HZ2 LYS A 118 2.354 4.612 -15.897 1.00 1.20 H new ATOM 0 HZ3 LYS A 118 2.404 3.877 -17.426 1.00 1.20 H new ATOM 1905 N ARG A 119 7.494 0.459 -13.352 1.00 0.52 N ATOM 1906 CA ARG A 119 8.740 1.067 -12.960 1.00 0.52 C ATOM 1907 C ARG A 119 9.136 2.083 -13.997 1.00 0.49 C ATOM 1908 O ARG A 119 9.663 1.744 -15.055 1.00 0.58 O ATOM 1909 CB ARG A 119 9.838 0.013 -12.769 1.00 0.79 C ATOM 1910 CG ARG A 119 11.179 0.598 -12.338 1.00 1.00 C ATOM 1911 CD ARG A 119 12.107 0.826 -13.521 1.00 1.25 C ATOM 1912 NE ARG A 119 12.660 -0.431 -14.022 1.00 1.68 N ATOM 1913 CZ ARG A 119 13.374 -0.548 -15.139 1.00 2.18 C ATOM 1914 NH1 ARG A 119 13.600 0.507 -15.907 1.00 2.57 N ATOM 1915 NH2 ARG A 119 13.846 -1.732 -15.492 1.00 2.80 N ATOM 0 H ARG A 119 7.525 -0.041 -14.241 1.00 0.52 H new ATOM 0 HA ARG A 119 8.609 1.565 -11.999 1.00 0.52 H new ATOM 0 HB2 ARG A 119 9.510 -0.710 -12.022 1.00 0.79 H new ATOM 0 HB3 ARG A 119 9.973 -0.532 -13.703 1.00 0.79 H new ATOM 0 HG2 ARG A 119 11.013 1.543 -11.820 1.00 1.00 H new ATOM 0 HG3 ARG A 119 11.657 -0.076 -11.627 1.00 1.00 H new ATOM 0 HD2 ARG A 119 11.562 1.328 -14.320 1.00 1.25 H new ATOM 0 HD3 ARG A 119 12.920 1.489 -13.224 1.00 1.25 H new ATOM 0 HE ARG A 119 12.487 -1.276 -13.478 1.00 1.68 H new ATOM 0 HH11 ARG A 119 13.226 1.419 -15.644 1.00 2.57 H new ATOM 0 HH12 ARG A 119 14.148 0.408 -16.761 1.00 2.57 H new ATOM 0 HH21 ARG A 119 13.662 -2.549 -14.909 1.00 2.80 H new ATOM 0 HH22 ARG A 119 14.394 -1.828 -16.347 1.00 2.80 H new ATOM 1929 N TYR A 120 8.830 3.328 -13.706 1.00 0.43 N ATOM 1930 CA TYR A 120 9.293 4.420 -14.519 1.00 0.46 C ATOM 1931 C TYR A 120 10.807 4.461 -14.415 1.00 0.50 C ATOM 1932 O TYR A 120 11.339 4.646 -13.322 1.00 0.48 O ATOM 1933 CB TYR A 120 8.667 5.739 -14.053 1.00 0.46 C ATOM 1934 CG TYR A 120 7.168 5.796 -14.237 1.00 0.51 C ATOM 1935 CD1 TYR A 120 6.311 5.344 -13.242 1.00 0.58 C ATOM 1936 CD2 TYR A 120 6.611 6.299 -15.406 1.00 0.76 C ATOM 1937 CE1 TYR A 120 4.942 5.389 -13.408 1.00 0.66 C ATOM 1938 CE2 TYR A 120 5.240 6.349 -15.579 1.00 0.83 C ATOM 1939 CZ TYR A 120 4.412 5.892 -14.576 1.00 0.70 C ATOM 1940 OH TYR A 120 3.043 5.935 -14.738 1.00 0.81 O ATOM 0 H TYR A 120 8.259 3.606 -12.907 1.00 0.43 H new ATOM 0 HA TYR A 120 8.997 4.278 -15.558 1.00 0.46 H new ATOM 0 HB2 TYR A 120 8.901 5.890 -12.999 1.00 0.46 H new ATOM 0 HB3 TYR A 120 9.124 6.562 -14.602 1.00 0.46 H new ATOM 0 HD1 TYR A 120 6.723 4.951 -12.324 1.00 0.58 H new ATOM 0 HD2 TYR A 120 7.259 6.657 -16.192 1.00 0.76 H new ATOM 0 HE1 TYR A 120 4.289 5.031 -12.626 1.00 0.66 H new ATOM 0 HE2 TYR A 120 4.821 6.743 -16.493 1.00 0.83 H new ATOM 0 HH TYR A 120 2.821 6.523 -15.490 1.00 0.81 H new ATOM 1950 N GLU A 121 11.465 4.188 -15.538 1.00 0.61 N ATOM 1951 CA GLU A 121 12.926 4.130 -15.646 1.00 0.73 C ATOM 1952 C GLU A 121 13.618 5.179 -14.795 1.00 0.70 C ATOM 1953 O GLU A 121 13.727 6.347 -15.171 1.00 0.79 O ATOM 1954 CB GLU A 121 13.368 4.285 -17.101 1.00 0.96 C ATOM 1955 CG GLU A 121 13.140 3.051 -17.970 1.00 1.06 C ATOM 1956 CD GLU A 121 11.679 2.694 -18.139 1.00 1.69 C ATOM 1957 OE1 GLU A 121 10.960 3.443 -18.832 1.00 2.27 O ATOM 1958 OE2 GLU A 121 11.240 1.676 -17.572 1.00 2.28 O ATOM 0 H GLU A 121 10.990 3.996 -16.420 1.00 0.61 H new ATOM 0 HA GLU A 121 13.222 3.150 -15.272 1.00 0.73 H new ATOM 0 HB2 GLU A 121 12.834 5.127 -17.541 1.00 0.96 H new ATOM 0 HB3 GLU A 121 14.429 4.535 -17.120 1.00 0.96 H new ATOM 0 HG2 GLU A 121 13.580 3.222 -18.952 1.00 1.06 H new ATOM 0 HG3 GLU A 121 13.664 2.203 -17.529 1.00 1.06 H new ATOM 1965 N GLY A 122 14.070 4.726 -13.641 1.00 0.67 N ATOM 1966 CA GLY A 122 14.773 5.571 -12.696 1.00 0.71 C ATOM 1967 C GLY A 122 13.971 6.782 -12.289 1.00 0.66 C ATOM 1968 O GLY A 122 14.519 7.857 -12.039 1.00 0.76 O ATOM 0 H GLY A 122 13.960 3.760 -13.332 1.00 0.67 H new ATOM 0 HA2 GLY A 122 15.020 4.989 -11.808 1.00 0.71 H new ATOM 0 HA3 GLY A 122 15.716 5.896 -13.137 1.00 0.71 H new ATOM 1972 N ASN A 123 12.672 6.594 -12.217 1.00 0.57 N ATOM 1973 CA ASN A 123 11.754 7.659 -11.890 1.00 0.54 C ATOM 1974 C ASN A 123 10.850 7.241 -10.739 1.00 0.45 C ATOM 1975 O ASN A 123 10.703 7.979 -9.767 1.00 0.45 O ATOM 1976 CB ASN A 123 10.915 8.018 -13.115 1.00 0.60 C ATOM 1977 CG ASN A 123 9.945 9.161 -12.859 1.00 1.01 C ATOM 1978 OD1 ASN A 123 8.824 9.155 -13.362 1.00 1.65 O ATOM 1979 ND2 ASN A 123 10.379 10.164 -12.106 1.00 1.61 N ATOM 0 H ASN A 123 12.222 5.694 -12.385 1.00 0.57 H new ATOM 0 HA ASN A 123 12.326 8.535 -11.583 1.00 0.54 H new ATOM 0 HB2 ASN A 123 11.579 8.290 -13.936 1.00 0.60 H new ATOM 0 HB3 ASN A 123 10.355 7.139 -13.435 1.00 0.60 H new ATOM 0 HD21 ASN A 123 9.775 10.966 -11.928 1.00 1.61 H new ATOM 0 HD22 ASN A 123 11.317 10.133 -11.706 1.00 1.61 H new ATOM 1986 N MET A 124 10.249 6.050 -10.833 1.00 0.39 N ATOM 1987 CA MET A 124 9.351 5.591 -9.775 1.00 0.34 C ATOM 1988 C MET A 124 9.098 4.091 -9.848 1.00 0.33 C ATOM 1989 O MET A 124 8.825 3.547 -10.915 1.00 0.40 O ATOM 1990 CB MET A 124 8.021 6.355 -9.819 1.00 0.34 C ATOM 1991 CG MET A 124 7.589 6.866 -8.459 1.00 0.56 C ATOM 1992 SD MET A 124 6.307 8.124 -8.565 1.00 1.09 S ATOM 1993 CE MET A 124 7.187 9.401 -9.457 1.00 1.12 C ATOM 0 H MET A 124 10.365 5.402 -11.612 1.00 0.39 H new ATOM 0 HA MET A 124 9.847 5.796 -8.826 1.00 0.34 H new ATOM 0 HB2 MET A 124 8.114 7.197 -10.505 1.00 0.34 H new ATOM 0 HB3 MET A 124 7.246 5.702 -10.219 1.00 0.34 H new ATOM 0 HG2 MET A 124 7.224 6.031 -7.861 1.00 0.56 H new ATOM 0 HG3 MET A 124 8.454 7.277 -7.938 1.00 0.56 H new ATOM 0 HE1 MET A 124 6.536 10.265 -9.592 1.00 1.12 H new ATOM 0 HE2 MET A 124 8.071 9.697 -8.892 1.00 1.12 H new ATOM 0 HE3 MET A 124 7.491 9.020 -10.432 1.00 1.12 H new ATOM 2003 N ASN A 125 9.189 3.439 -8.698 1.00 0.34 N ATOM 2004 CA ASN A 125 8.859 2.027 -8.565 1.00 0.37 C ATOM 2005 C ASN A 125 7.511 1.917 -7.871 1.00 0.32 C ATOM 2006 O ASN A 125 7.429 1.683 -6.668 1.00 0.37 O ATOM 2007 CB ASN A 125 9.935 1.288 -7.759 1.00 0.50 C ATOM 2008 CG ASN A 125 11.236 1.119 -8.524 1.00 0.95 C ATOM 2009 OD1 ASN A 125 12.100 2.122 -8.463 1.00 1.58 O flip ATOM 2010 ND2 ASN A 125 11.463 0.096 -9.165 1.00 1.62 N flip ATOM 0 H ASN A 125 9.495 3.875 -7.828 1.00 0.34 H new ATOM 0 HA ASN A 125 8.813 1.566 -9.552 1.00 0.37 H new ATOM 0 HB2 ASN A 125 10.130 1.835 -6.837 1.00 0.50 H new ATOM 0 HB3 ASN A 125 9.557 0.306 -7.473 1.00 0.50 H new ATOM 0 HD21 ASN A 125 10.773 -0.655 -9.188 1.00 1.62 H new ATOM 0 HD22 ASN A 125 12.341 -0.003 -9.674 1.00 1.62 H new ATOM 2017 N ILE A 126 6.463 2.131 -8.639 1.00 0.26 N ATOM 2018 CA ILE A 126 5.123 2.292 -8.099 1.00 0.23 C ATOM 2019 C ILE A 126 4.242 1.058 -8.285 1.00 0.27 C ATOM 2020 O ILE A 126 4.266 0.412 -9.334 1.00 0.30 O ATOM 2021 CB ILE A 126 4.426 3.495 -8.777 1.00 0.22 C ATOM 2022 CG1 ILE A 126 2.908 3.413 -8.601 1.00 0.24 C ATOM 2023 CG2 ILE A 126 4.810 3.587 -10.243 1.00 0.24 C ATOM 2024 CD1 ILE A 126 2.130 4.445 -9.395 1.00 0.26 C ATOM 0 H ILE A 126 6.513 2.199 -9.656 1.00 0.26 H new ATOM 0 HA ILE A 126 5.244 2.454 -7.028 1.00 0.23 H new ATOM 0 HB ILE A 126 4.768 4.408 -8.289 1.00 0.22 H new ATOM 0 HG12 ILE A 126 2.573 2.418 -8.895 1.00 0.24 H new ATOM 0 HG13 ILE A 126 2.670 3.530 -7.544 1.00 0.24 H new ATOM 0 HG21 ILE A 126 4.307 4.441 -10.698 1.00 0.24 H new ATOM 0 HG22 ILE A 126 5.889 3.713 -10.329 1.00 0.24 H new ATOM 0 HG23 ILE A 126 4.509 2.673 -10.756 1.00 0.24 H new ATOM 0 HD11 ILE A 126 1.063 4.316 -9.213 1.00 0.26 H new ATOM 0 HD12 ILE A 126 2.433 5.446 -9.086 1.00 0.26 H new ATOM 0 HD13 ILE A 126 2.334 4.316 -10.458 1.00 0.26 H new ATOM 2036 N ILE A 127 3.459 0.743 -7.258 1.00 0.30 N ATOM 2037 CA ILE A 127 2.335 -0.162 -7.418 1.00 0.34 C ATOM 2038 C ILE A 127 1.031 0.641 -7.313 1.00 0.38 C ATOM 2039 O ILE A 127 0.706 1.215 -6.272 1.00 0.45 O ATOM 2040 CB ILE A 127 2.337 -1.330 -6.395 1.00 0.41 C ATOM 2041 CG1 ILE A 127 2.140 -0.823 -4.965 1.00 0.42 C ATOM 2042 CG2 ILE A 127 3.634 -2.123 -6.498 1.00 0.50 C ATOM 2043 CD1 ILE A 127 1.726 -1.903 -3.992 1.00 0.59 C ATOM 0 H ILE A 127 3.584 1.101 -6.311 1.00 0.30 H new ATOM 0 HA ILE A 127 2.422 -0.625 -8.401 1.00 0.34 H new ATOM 0 HB ILE A 127 1.499 -1.984 -6.637 1.00 0.41 H new ATOM 0 HG12 ILE A 127 3.068 -0.369 -4.618 1.00 0.42 H new ATOM 0 HG13 ILE A 127 1.383 -0.038 -4.968 1.00 0.42 H new ATOM 0 HG21 ILE A 127 3.620 -2.938 -5.775 1.00 0.50 H new ATOM 0 HG22 ILE A 127 3.732 -2.532 -7.504 1.00 0.50 H new ATOM 0 HG23 ILE A 127 4.479 -1.467 -6.289 1.00 0.50 H new ATOM 0 HD11 ILE A 127 1.605 -1.471 -2.999 1.00 0.59 H new ATOM 0 HD12 ILE A 127 0.782 -2.341 -4.315 1.00 0.59 H new ATOM 0 HD13 ILE A 127 2.493 -2.677 -3.960 1.00 0.59 H new ATOM 2055 N SER A 128 0.330 0.752 -8.421 1.00 0.39 N ATOM 2056 CA SER A 128 -0.932 1.476 -8.458 1.00 0.50 C ATOM 2057 C SER A 128 -2.117 0.517 -8.329 1.00 0.55 C ATOM 2058 O SER A 128 -2.444 -0.227 -9.252 1.00 1.00 O ATOM 2059 CB SER A 128 -1.019 2.290 -9.744 1.00 0.68 C ATOM 2060 OG SER A 128 -0.681 1.504 -10.873 1.00 1.18 O ATOM 0 H SER A 128 0.611 0.349 -9.315 1.00 0.39 H new ATOM 0 HA SER A 128 -0.973 2.159 -7.609 1.00 0.50 H new ATOM 0 HB2 SER A 128 -2.029 2.683 -9.861 1.00 0.68 H new ATOM 0 HB3 SER A 128 -0.349 3.147 -9.681 1.00 0.68 H new ATOM 0 HG SER A 128 0.180 1.803 -11.234 1.00 1.18 H new ATOM 2066 N SER A 129 -2.780 0.573 -7.190 1.00 0.30 N ATOM 2067 CA SER A 129 -3.770 -0.421 -6.823 1.00 0.31 C ATOM 2068 C SER A 129 -5.175 0.171 -6.765 1.00 0.31 C ATOM 2069 O SER A 129 -5.344 1.377 -6.606 1.00 0.43 O ATOM 2070 CB SER A 129 -3.387 -1.020 -5.469 1.00 0.40 C ATOM 2071 OG SER A 129 -2.975 -0.002 -4.567 1.00 1.24 O ATOM 0 H SER A 129 -2.648 1.307 -6.494 1.00 0.30 H new ATOM 0 HA SER A 129 -3.784 -1.198 -7.587 1.00 0.31 H new ATOM 0 HB2 SER A 129 -4.237 -1.560 -5.052 1.00 0.40 H new ATOM 0 HB3 SER A 129 -2.582 -1.744 -5.600 1.00 0.40 H new ATOM 0 HG SER A 129 -3.444 0.832 -4.779 1.00 1.24 H new ATOM 2077 N LYS A 130 -6.180 -0.679 -6.934 1.00 0.27 N ATOM 2078 CA LYS A 130 -7.560 -0.276 -6.770 1.00 0.32 C ATOM 2079 C LYS A 130 -8.295 -1.393 -6.086 1.00 0.37 C ATOM 2080 O LYS A 130 -8.117 -2.547 -6.451 1.00 0.41 O ATOM 2081 CB LYS A 130 -8.212 -0.008 -8.125 1.00 0.40 C ATOM 2082 CG LYS A 130 -7.671 1.208 -8.844 1.00 0.90 C ATOM 2083 CD LYS A 130 -7.898 1.102 -10.338 1.00 0.80 C ATOM 2084 CE LYS A 130 -7.022 0.027 -10.953 1.00 1.42 C ATOM 2085 NZ LYS A 130 -5.644 0.023 -10.388 1.00 2.26 N ATOM 0 H LYS A 130 -6.057 -1.659 -7.187 1.00 0.27 H new ATOM 0 HA LYS A 130 -7.601 0.640 -6.180 1.00 0.32 H new ATOM 0 HB2 LYS A 130 -8.075 -0.883 -8.761 1.00 0.40 H new ATOM 0 HB3 LYS A 130 -9.285 0.117 -7.981 1.00 0.40 H new ATOM 0 HG2 LYS A 130 -8.156 2.106 -8.462 1.00 0.90 H new ATOM 0 HG3 LYS A 130 -6.605 1.310 -8.641 1.00 0.90 H new ATOM 0 HD2 LYS A 130 -8.946 0.876 -10.534 1.00 0.80 H new ATOM 0 HD3 LYS A 130 -7.685 2.061 -10.809 1.00 0.80 H new ATOM 0 HE2 LYS A 130 -7.481 -0.948 -10.790 1.00 1.42 H new ATOM 0 HE3 LYS A 130 -6.969 0.179 -12.031 1.00 1.42 H new ATOM 0 HZ1 LYS A 130 -4.951 -0.012 -11.163 1.00 2.26 H new ATOM 0 HZ2 LYS A 130 -5.495 0.887 -9.829 1.00 2.26 H new ATOM 0 HZ3 LYS A 130 -5.522 -0.810 -9.777 1.00 2.26 H new ATOM 2099 N SER A 131 -9.090 -1.077 -5.092 1.00 0.41 N ATOM 2100 CA SER A 131 -9.906 -2.083 -4.472 1.00 0.44 C ATOM 2101 C SER A 131 -10.971 -2.484 -5.452 1.00 0.41 C ATOM 2102 O SER A 131 -12.010 -1.830 -5.590 1.00 0.47 O ATOM 2103 CB SER A 131 -10.497 -1.561 -3.187 1.00 0.56 C ATOM 2104 OG SER A 131 -11.186 -0.341 -3.405 1.00 1.39 O ATOM 0 H SER A 131 -9.187 -0.140 -4.701 1.00 0.41 H new ATOM 0 HA SER A 131 -9.309 -2.957 -4.212 1.00 0.44 H new ATOM 0 HB2 SER A 131 -11.181 -2.300 -2.770 1.00 0.56 H new ATOM 0 HB3 SER A 131 -9.705 -1.410 -2.453 1.00 0.56 H new ATOM 0 HG SER A 131 -11.714 -0.406 -4.228 1.00 1.39 H new ATOM 2110 N VAL A 132 -10.694 -3.551 -6.145 1.00 0.35 N ATOM 2111 CA VAL A 132 -11.411 -3.857 -7.332 1.00 0.36 C ATOM 2112 C VAL A 132 -12.341 -5.024 -7.110 1.00 0.37 C ATOM 2113 O VAL A 132 -11.946 -6.113 -6.697 1.00 0.46 O ATOM 2114 CB VAL A 132 -10.430 -4.060 -8.499 1.00 0.40 C ATOM 2115 CG1 VAL A 132 -10.928 -5.013 -9.544 1.00 0.88 C ATOM 2116 CG2 VAL A 132 -10.162 -2.729 -9.148 1.00 1.05 C ATOM 0 H VAL A 132 -9.968 -4.224 -5.899 1.00 0.35 H new ATOM 0 HA VAL A 132 -12.051 -3.018 -7.605 1.00 0.36 H new ATOM 0 HB VAL A 132 -9.524 -4.496 -8.077 1.00 0.40 H new ATOM 0 HG11 VAL A 132 -10.184 -5.107 -10.335 1.00 0.88 H new ATOM 0 HG12 VAL A 132 -11.102 -5.990 -9.092 1.00 0.88 H new ATOM 0 HG13 VAL A 132 -11.860 -4.637 -9.965 1.00 0.88 H new ATOM 0 HG21 VAL A 132 -9.467 -2.862 -9.977 1.00 1.05 H new ATOM 0 HG22 VAL A 132 -11.097 -2.311 -9.521 1.00 1.05 H new ATOM 0 HG23 VAL A 132 -9.727 -2.048 -8.416 1.00 1.05 H new ATOM 2126 N ASP A 133 -13.588 -4.753 -7.398 1.00 0.39 N ATOM 2127 CA ASP A 133 -14.696 -5.591 -6.991 1.00 0.43 C ATOM 2128 C ASP A 133 -15.100 -6.495 -8.135 1.00 0.43 C ATOM 2129 O ASP A 133 -16.276 -6.648 -8.480 1.00 0.59 O ATOM 2130 CB ASP A 133 -15.839 -4.690 -6.530 1.00 0.54 C ATOM 2131 CG ASP A 133 -16.335 -3.748 -7.615 1.00 1.27 C ATOM 2132 OD1 ASP A 133 -15.610 -2.796 -7.961 1.00 2.17 O ATOM 2133 OD2 ASP A 133 -17.447 -3.977 -8.142 1.00 1.39 O ATOM 0 H ASP A 133 -13.871 -3.931 -7.931 1.00 0.39 H new ATOM 0 HA ASP A 133 -14.413 -6.237 -6.160 1.00 0.43 H new ATOM 0 HB2 ASP A 133 -16.668 -5.311 -6.190 1.00 0.54 H new ATOM 0 HB3 ASP A 133 -15.508 -4.104 -5.673 1.00 0.54 H new ATOM 2138 N PHE A 134 -14.085 -7.116 -8.691 1.00 0.35 N ATOM 2139 CA PHE A 134 -14.207 -7.894 -9.902 1.00 0.40 C ATOM 2140 C PHE A 134 -14.742 -9.301 -9.588 1.00 0.46 C ATOM 2141 O PHE A 134 -14.645 -9.758 -8.449 1.00 0.50 O ATOM 2142 CB PHE A 134 -12.830 -7.958 -10.575 1.00 0.39 C ATOM 2143 CG PHE A 134 -11.917 -8.960 -9.942 1.00 0.38 C ATOM 2144 CD1 PHE A 134 -11.608 -8.867 -8.604 1.00 0.36 C ATOM 2145 CD2 PHE A 134 -11.329 -9.964 -10.695 1.00 0.51 C ATOM 2146 CE1 PHE A 134 -10.729 -9.750 -8.028 1.00 0.42 C ATOM 2147 CE2 PHE A 134 -10.454 -10.854 -10.120 1.00 0.53 C ATOM 2148 CZ PHE A 134 -10.312 -10.876 -8.758 1.00 0.45 C ATOM 0 H PHE A 134 -13.139 -7.095 -8.310 1.00 0.35 H new ATOM 0 HA PHE A 134 -14.919 -7.424 -10.580 1.00 0.40 H new ATOM 0 HB2 PHE A 134 -12.958 -8.206 -11.629 1.00 0.39 H new ATOM 0 HB3 PHE A 134 -12.365 -6.973 -10.533 1.00 0.39 H new ATOM 0 HD1 PHE A 134 -12.061 -8.093 -8.002 1.00 0.36 H new ATOM 0 HD2 PHE A 134 -11.561 -10.048 -11.746 1.00 0.51 H new ATOM 0 HE1 PHE A 134 -10.362 -9.581 -7.026 1.00 0.42 H new ATOM 0 HE2 PHE A 134 -9.883 -11.531 -10.738 1.00 0.53 H new ATOM 0 HZ PHE A 134 -9.891 -11.736 -8.258 1.00 0.45 H new ATOM 2158 N PRO A 135 -15.313 -9.999 -10.583 1.00 0.61 N ATOM 2159 CA PRO A 135 -16.007 -11.284 -10.386 1.00 0.75 C ATOM 2160 C PRO A 135 -15.256 -12.324 -9.543 1.00 0.92 C ATOM 2161 O PRO A 135 -15.853 -12.977 -8.683 1.00 1.13 O ATOM 2162 CB PRO A 135 -16.161 -11.842 -11.803 1.00 1.28 C ATOM 2163 CG PRO A 135 -15.432 -10.902 -12.710 1.00 1.19 C ATOM 2164 CD PRO A 135 -15.356 -9.590 -11.990 1.00 0.76 C ATOM 0 HA PRO A 135 -16.931 -11.101 -9.838 1.00 0.75 H new ATOM 0 HB2 PRO A 135 -15.746 -12.848 -11.871 1.00 1.28 H new ATOM 0 HB3 PRO A 135 -17.213 -11.912 -12.081 1.00 1.28 H new ATOM 0 HG2 PRO A 135 -14.435 -11.278 -12.938 1.00 1.19 H new ATOM 0 HG3 PRO A 135 -15.956 -10.794 -13.659 1.00 1.19 H new ATOM 0 HD2 PRO A 135 -14.470 -9.022 -12.274 1.00 0.76 H new ATOM 0 HD3 PRO A 135 -16.220 -8.960 -12.203 1.00 0.76 H new ATOM 2172 N GLU A 136 -13.950 -12.453 -9.769 1.00 1.10 N ATOM 2173 CA GLU A 136 -13.202 -13.624 -9.342 1.00 1.59 C ATOM 2174 C GLU A 136 -13.050 -13.677 -7.833 1.00 1.68 C ATOM 2175 O GLU A 136 -12.661 -14.706 -7.276 1.00 2.17 O ATOM 2176 CB GLU A 136 -11.848 -13.635 -10.049 1.00 1.78 C ATOM 2177 CG GLU A 136 -11.015 -14.862 -9.776 1.00 2.38 C ATOM 2178 CD GLU A 136 -10.047 -15.174 -10.900 1.00 3.03 C ATOM 2179 OE1 GLU A 136 -10.414 -14.985 -12.081 1.00 3.50 O ATOM 2180 OE2 GLU A 136 -8.919 -15.613 -10.613 1.00 3.30 O ATOM 0 H GLU A 136 -13.388 -11.751 -10.250 1.00 1.10 H new ATOM 0 HA GLU A 136 -13.756 -14.520 -9.621 1.00 1.59 H new ATOM 0 HB2 GLU A 136 -12.012 -13.553 -11.124 1.00 1.78 H new ATOM 0 HB3 GLU A 136 -11.285 -12.753 -9.744 1.00 1.78 H new ATOM 0 HG2 GLU A 136 -10.457 -14.719 -8.851 1.00 2.38 H new ATOM 0 HG3 GLU A 136 -11.674 -15.717 -9.622 1.00 2.38 H new ATOM 2187 N TYR A 137 -13.377 -12.589 -7.159 1.00 1.38 N ATOM 2188 CA TYR A 137 -13.308 -12.601 -5.713 1.00 1.79 C ATOM 2189 C TYR A 137 -14.198 -11.542 -5.052 1.00 1.42 C ATOM 2190 O TYR A 137 -13.832 -10.372 -4.965 1.00 1.58 O ATOM 2191 CB TYR A 137 -11.862 -12.423 -5.280 1.00 2.49 C ATOM 2192 CG TYR A 137 -11.488 -13.315 -4.122 1.00 3.43 C ATOM 2193 CD1 TYR A 137 -11.912 -13.012 -2.835 1.00 3.49 C ATOM 2194 CD2 TYR A 137 -10.693 -14.435 -4.304 1.00 4.47 C ATOM 2195 CE1 TYR A 137 -11.561 -13.804 -1.763 1.00 4.37 C ATOM 2196 CE2 TYR A 137 -10.333 -15.231 -3.235 1.00 5.35 C ATOM 2197 CZ TYR A 137 -10.833 -14.998 -2.014 1.00 5.22 C ATOM 2198 OH TYR A 137 -10.409 -15.699 -0.902 1.00 6.12 O ATOM 0 H TYR A 137 -13.684 -11.711 -7.576 1.00 1.38 H new ATOM 0 HA TYR A 137 -13.690 -13.566 -5.379 1.00 1.79 H new ATOM 0 HB2 TYR A 137 -11.205 -12.635 -6.124 1.00 2.49 H new ATOM 0 HB3 TYR A 137 -11.696 -11.383 -5.001 1.00 2.49 H new ATOM 0 HD1 TYR A 137 -12.528 -12.140 -2.671 1.00 3.49 H new ATOM 0 HD2 TYR A 137 -10.350 -14.689 -5.296 1.00 4.47 H new ATOM 0 HE1 TYR A 137 -11.833 -13.524 -0.756 1.00 4.37 H new ATOM 0 HE2 TYR A 137 -9.643 -16.048 -3.384 1.00 5.35 H new ATOM 0 HH TYR A 137 -9.921 -16.500 -1.187 1.00 6.12 H new ATOM 2208 N PRO A 138 -15.383 -11.960 -4.571 1.00 1.33 N ATOM 2209 CA PRO A 138 -16.270 -11.135 -3.751 1.00 1.10 C ATOM 2210 C PRO A 138 -15.965 -11.301 -2.251 1.00 0.99 C ATOM 2211 O PRO A 138 -15.298 -12.258 -1.854 1.00 0.99 O ATOM 2212 CB PRO A 138 -17.667 -11.689 -4.083 1.00 0.97 C ATOM 2213 CG PRO A 138 -17.453 -12.955 -4.864 1.00 1.56 C ATOM 2214 CD PRO A 138 -15.983 -13.273 -4.813 1.00 1.77 C ATOM 0 HA PRO A 138 -16.163 -10.070 -3.955 1.00 1.10 H new ATOM 0 HB2 PRO A 138 -18.232 -11.887 -3.172 1.00 0.97 H new ATOM 0 HB3 PRO A 138 -18.242 -10.968 -4.664 1.00 0.97 H new ATOM 0 HG2 PRO A 138 -18.037 -13.771 -4.439 1.00 1.56 H new ATOM 0 HG3 PRO A 138 -17.783 -12.830 -5.895 1.00 1.56 H new ATOM 0 HD2 PRO A 138 -15.748 -13.979 -4.017 1.00 1.77 H new ATOM 0 HD3 PRO A 138 -15.631 -13.715 -5.745 1.00 1.77 H new ATOM 2222 N PRO A 139 -16.403 -10.349 -1.401 1.00 0.96 N ATOM 2223 CA PRO A 139 -16.195 -10.418 0.044 1.00 0.91 C ATOM 2224 C PRO A 139 -17.372 -11.032 0.796 1.00 1.00 C ATOM 2225 O PRO A 139 -18.225 -11.698 0.205 1.00 1.25 O ATOM 2226 CB PRO A 139 -16.053 -8.950 0.420 1.00 0.82 C ATOM 2227 CG PRO A 139 -16.925 -8.216 -0.554 1.00 0.89 C ATOM 2228 CD PRO A 139 -17.101 -9.107 -1.771 1.00 1.06 C ATOM 0 HA PRO A 139 -15.345 -11.049 0.302 1.00 0.91 H new ATOM 0 HB2 PRO A 139 -16.372 -8.773 1.447 1.00 0.82 H new ATOM 0 HB3 PRO A 139 -15.016 -8.622 0.347 1.00 0.82 H new ATOM 0 HG2 PRO A 139 -17.891 -7.985 -0.105 1.00 0.89 H new ATOM 0 HG3 PRO A 139 -16.470 -7.267 -0.836 1.00 0.89 H new ATOM 0 HD2 PRO A 139 -18.154 -9.289 -1.985 1.00 1.06 H new ATOM 0 HD3 PRO A 139 -16.668 -8.655 -2.663 1.00 1.06 H new ATOM 2236 N SER A 140 -17.415 -10.780 2.098 1.00 0.90 N ATOM 2237 CA SER A 140 -18.448 -11.318 2.959 1.00 1.01 C ATOM 2238 C SER A 140 -18.711 -10.321 4.085 1.00 1.01 C ATOM 2239 O SER A 140 -18.404 -9.136 3.939 1.00 1.13 O ATOM 2240 CB SER A 140 -18.003 -12.675 3.515 1.00 1.09 C ATOM 2241 OG SER A 140 -19.076 -13.372 4.123 1.00 1.60 O ATOM 0 H SER A 140 -16.733 -10.196 2.582 1.00 0.90 H new ATOM 0 HA SER A 140 -19.370 -11.472 2.398 1.00 1.01 H new ATOM 0 HB2 SER A 140 -17.587 -13.279 2.709 1.00 1.09 H new ATOM 0 HB3 SER A 140 -17.207 -12.526 4.244 1.00 1.09 H new ATOM 0 HG SER A 140 -18.755 -14.233 4.464 1.00 1.60 H new ATOM 2247 N SER A 141 -19.254 -10.774 5.201 1.00 1.07 N ATOM 2248 CA SER A 141 -19.542 -9.872 6.303 1.00 1.19 C ATOM 2249 C SER A 141 -18.354 -9.764 7.261 1.00 1.07 C ATOM 2250 O SER A 141 -18.075 -8.691 7.799 1.00 1.22 O ATOM 2251 CB SER A 141 -20.802 -10.326 7.044 1.00 1.47 C ATOM 2252 OG SER A 141 -20.747 -11.709 7.358 1.00 1.97 O ATOM 0 H SER A 141 -19.502 -11.749 5.368 1.00 1.07 H new ATOM 0 HA SER A 141 -19.720 -8.879 5.890 1.00 1.19 H new ATOM 0 HB2 SER A 141 -20.915 -9.747 7.961 1.00 1.47 H new ATOM 0 HB3 SER A 141 -21.680 -10.125 6.430 1.00 1.47 H new ATOM 0 HG SER A 141 -21.564 -11.970 7.832 1.00 1.97 H new ATOM 2258 N ASN A 142 -17.654 -10.874 7.471 1.00 0.97 N ATOM 2259 CA ASN A 142 -16.492 -10.889 8.358 1.00 0.95 C ATOM 2260 C ASN A 142 -15.294 -10.248 7.666 1.00 0.86 C ATOM 2261 O ASN A 142 -14.491 -9.565 8.298 1.00 1.07 O ATOM 2262 CB ASN A 142 -16.155 -12.330 8.768 1.00 1.01 C ATOM 2263 CG ASN A 142 -15.296 -12.434 10.024 1.00 1.37 C ATOM 2264 OD1 ASN A 142 -15.387 -13.418 10.759 1.00 2.18 O ATOM 2265 ND2 ASN A 142 -14.464 -11.437 10.286 1.00 1.73 N ATOM 0 H ASN A 142 -17.869 -11.774 7.041 1.00 0.97 H new ATOM 0 HA ASN A 142 -16.729 -10.316 9.254 1.00 0.95 H new ATOM 0 HB2 ASN A 142 -17.084 -12.877 8.929 1.00 1.01 H new ATOM 0 HB3 ASN A 142 -15.636 -12.819 7.944 1.00 1.01 H new ATOM 0 HD21 ASN A 142 -13.874 -11.470 11.117 1.00 1.73 H new ATOM 0 HD22 ASN A 142 -14.413 -10.636 9.656 1.00 1.73 H new ATOM 2272 N TYR A 143 -15.189 -10.459 6.363 1.00 0.71 N ATOM 2273 CA TYR A 143 -14.076 -9.939 5.591 1.00 0.67 C ATOM 2274 C TYR A 143 -14.551 -8.804 4.728 1.00 0.61 C ATOM 2275 O TYR A 143 -15.307 -9.012 3.774 1.00 0.67 O ATOM 2276 CB TYR A 143 -13.453 -11.036 4.727 1.00 0.76 C ATOM 2277 CG TYR A 143 -12.858 -12.169 5.532 1.00 0.84 C ATOM 2278 CD1 TYR A 143 -11.563 -12.096 6.030 1.00 0.91 C ATOM 2279 CD2 TYR A 143 -13.593 -13.321 5.787 1.00 0.97 C ATOM 2280 CE1 TYR A 143 -11.019 -13.139 6.757 1.00 1.02 C ATOM 2281 CE2 TYR A 143 -13.057 -14.366 6.516 1.00 1.09 C ATOM 2282 CZ TYR A 143 -11.756 -14.238 7.033 1.00 1.09 C ATOM 2283 OH TYR A 143 -11.231 -15.313 7.720 1.00 1.23 O ATOM 0 H TYR A 143 -15.867 -10.991 5.817 1.00 0.71 H new ATOM 0 HA TYR A 143 -13.311 -9.576 6.278 1.00 0.67 H new ATOM 0 HB2 TYR A 143 -14.214 -11.437 4.057 1.00 0.76 H new ATOM 0 HB3 TYR A 143 -12.676 -10.598 4.101 1.00 0.76 H new ATOM 0 HD1 TYR A 143 -10.972 -11.211 5.846 1.00 0.91 H new ATOM 0 HD2 TYR A 143 -14.601 -13.401 5.409 1.00 0.97 H new ATOM 0 HE1 TYR A 143 -9.999 -13.075 7.106 1.00 1.02 H new ATOM 0 HE2 TYR A 143 -13.629 -15.266 6.686 1.00 1.09 H new ATOM 0 HH TYR A 143 -11.918 -16.004 7.820 1.00 1.23 H new ATOM 2293 N ILE A 144 -14.107 -7.602 5.046 1.00 0.56 N ATOM 2294 CA ILE A 144 -14.571 -6.453 4.322 1.00 0.53 C ATOM 2295 C ILE A 144 -13.549 -6.090 3.278 1.00 0.46 C ATOM 2296 O ILE A 144 -12.416 -5.746 3.600 1.00 0.47 O ATOM 2297 CB ILE A 144 -14.876 -5.240 5.241 1.00 0.61 C ATOM 2298 CG1 ILE A 144 -14.935 -3.945 4.421 1.00 0.62 C ATOM 2299 CG2 ILE A 144 -13.861 -5.123 6.362 1.00 0.68 C ATOM 2300 CD1 ILE A 144 -16.092 -3.897 3.445 1.00 0.82 C ATOM 0 H ILE A 144 -13.437 -7.406 5.790 1.00 0.56 H new ATOM 0 HA ILE A 144 -15.517 -6.714 3.848 1.00 0.53 H new ATOM 0 HB ILE A 144 -15.852 -5.405 5.698 1.00 0.61 H new ATOM 0 HG12 ILE A 144 -15.010 -3.097 5.102 1.00 0.62 H new ATOM 0 HG13 ILE A 144 -14.001 -3.831 3.870 1.00 0.62 H new ATOM 0 HG21 ILE A 144 -14.105 -4.263 6.986 1.00 0.68 H new ATOM 0 HG22 ILE A 144 -13.882 -6.029 6.968 1.00 0.68 H new ATOM 0 HG23 ILE A 144 -12.865 -4.993 5.939 1.00 0.68 H new ATOM 0 HD11 ILE A 144 -16.070 -2.953 2.901 1.00 0.82 H new ATOM 0 HD12 ILE A 144 -16.008 -4.724 2.740 1.00 0.82 H new ATOM 0 HD13 ILE A 144 -17.032 -3.979 3.991 1.00 0.82 H new ATOM 2312 N ARG A 145 -13.933 -6.257 2.029 1.00 0.43 N ATOM 2313 CA ARG A 145 -13.102 -5.827 0.922 1.00 0.41 C ATOM 2314 C ARG A 145 -12.886 -4.322 1.041 1.00 0.45 C ATOM 2315 O ARG A 145 -13.738 -3.527 0.649 1.00 0.48 O ATOM 2316 CB ARG A 145 -13.765 -6.203 -0.410 1.00 0.44 C ATOM 2317 CG ARG A 145 -12.785 -6.645 -1.491 1.00 0.81 C ATOM 2318 CD ARG A 145 -11.769 -7.638 -0.956 1.00 2.08 C ATOM 2319 NE ARG A 145 -12.368 -8.819 -0.325 1.00 2.70 N ATOM 2320 CZ ARG A 145 -12.892 -9.854 -0.986 1.00 3.63 C ATOM 2321 NH1 ARG A 145 -13.127 -9.776 -2.289 1.00 4.14 N ATOM 2322 NH2 ARG A 145 -13.199 -10.967 -0.329 1.00 4.42 N ATOM 0 H ARG A 145 -14.816 -6.688 1.754 1.00 0.43 H new ATOM 0 HA ARG A 145 -12.133 -6.326 0.951 1.00 0.41 H new ATOM 0 HB2 ARG A 145 -14.481 -7.006 -0.233 1.00 0.44 H new ATOM 0 HB3 ARG A 145 -14.331 -5.346 -0.776 1.00 0.44 H new ATOM 0 HG2 ARG A 145 -13.334 -7.096 -2.318 1.00 0.81 H new ATOM 0 HG3 ARG A 145 -12.266 -5.773 -1.891 1.00 0.81 H new ATOM 0 HD2 ARG A 145 -11.126 -7.962 -1.775 1.00 2.08 H new ATOM 0 HD3 ARG A 145 -11.131 -7.134 -0.230 1.00 2.08 H new ATOM 0 HE ARG A 145 -12.386 -8.852 0.694 1.00 2.70 H new ATOM 0 HH11 ARG A 145 -12.907 -8.919 -2.796 1.00 4.14 H new ATOM 0 HH12 ARG A 145 -13.528 -10.573 -2.784 1.00 4.14 H new ATOM 0 HH21 ARG A 145 -13.034 -11.028 0.676 1.00 4.42 H new ATOM 0 HH22 ARG A 145 -13.600 -11.761 -0.829 1.00 4.42 H new ATOM 2336 N GLY A 146 -11.747 -3.950 1.612 1.00 0.62 N ATOM 2337 CA GLY A 146 -11.490 -2.566 1.944 1.00 0.79 C ATOM 2338 C GLY A 146 -11.418 -1.691 0.724 1.00 0.57 C ATOM 2339 O GLY A 146 -10.743 -2.035 -0.245 1.00 0.62 O ATOM 0 H GLY A 146 -10.991 -4.591 1.852 1.00 0.62 H new ATOM 0 HA2 GLY A 146 -12.277 -2.201 2.604 1.00 0.79 H new ATOM 0 HA3 GLY A 146 -10.552 -2.495 2.495 1.00 0.79 H new ATOM 2343 N TYR A 147 -12.089 -0.550 0.771 1.00 0.58 N ATOM 2344 CA TYR A 147 -12.138 0.320 -0.390 1.00 0.56 C ATOM 2345 C TYR A 147 -10.926 1.217 -0.480 1.00 0.54 C ATOM 2346 O TYR A 147 -10.949 2.394 -0.115 1.00 0.67 O ATOM 2347 CB TYR A 147 -13.427 1.131 -0.448 1.00 0.86 C ATOM 2348 CG TYR A 147 -14.548 0.381 -1.121 1.00 1.69 C ATOM 2349 CD1 TYR A 147 -14.288 -0.422 -2.222 1.00 2.19 C ATOM 2350 CD2 TYR A 147 -15.851 0.467 -0.662 1.00 2.23 C ATOM 2351 CE1 TYR A 147 -15.298 -1.126 -2.847 1.00 3.07 C ATOM 2352 CE2 TYR A 147 -16.871 -0.231 -1.282 1.00 3.13 C ATOM 2353 CZ TYR A 147 -16.587 -1.028 -2.374 1.00 3.51 C ATOM 2354 OH TYR A 147 -17.598 -1.731 -2.989 1.00 4.44 O ATOM 0 H TYR A 147 -12.599 -0.210 1.587 1.00 0.58 H new ATOM 0 HA TYR A 147 -12.126 -0.334 -1.262 1.00 0.56 H new ATOM 0 HB2 TYR A 147 -13.730 1.400 0.564 1.00 0.86 H new ATOM 0 HB3 TYR A 147 -13.243 2.062 -0.984 1.00 0.86 H new ATOM 0 HD1 TYR A 147 -13.278 -0.498 -2.597 1.00 2.19 H new ATOM 0 HD2 TYR A 147 -16.074 1.088 0.193 1.00 2.23 H new ATOM 0 HE1 TYR A 147 -15.078 -1.749 -3.701 1.00 3.07 H new ATOM 0 HE2 TYR A 147 -17.884 -0.154 -0.915 1.00 3.13 H new ATOM 0 HH TYR A 147 -18.446 -1.552 -2.531 1.00 4.44 H new ATOM 2364 N ASN A 148 -9.861 0.612 -0.964 1.00 0.46 N ATOM 2365 CA ASN A 148 -8.677 1.321 -1.377 1.00 0.47 C ATOM 2366 C ASN A 148 -8.913 1.878 -2.773 1.00 0.45 C ATOM 2367 O ASN A 148 -8.562 1.244 -3.771 1.00 0.58 O ATOM 2368 CB ASN A 148 -7.468 0.376 -1.384 1.00 0.49 C ATOM 2369 CG ASN A 148 -6.153 1.100 -1.600 1.00 1.08 C ATOM 2370 OD1 ASN A 148 -5.498 1.499 -0.644 1.00 1.45 O ATOM 2371 ND2 ASN A 148 -5.764 1.278 -2.852 1.00 1.62 N ATOM 0 H ASN A 148 -9.797 -0.399 -1.081 1.00 0.46 H new ATOM 0 HA ASN A 148 -8.470 2.134 -0.681 1.00 0.47 H new ATOM 0 HB2 ASN A 148 -7.429 -0.163 -0.437 1.00 0.49 H new ATOM 0 HB3 ASN A 148 -7.600 -0.369 -2.169 1.00 0.49 H new ATOM 0 HD21 ASN A 148 -4.889 1.763 -3.050 1.00 1.62 H new ATOM 0 HD22 ASN A 148 -6.339 0.930 -3.619 1.00 1.62 H new ATOM 2378 N HIS A 149 -9.567 3.040 -2.834 1.00 0.43 N ATOM 2379 CA HIS A 149 -9.788 3.753 -4.098 1.00 0.45 C ATOM 2380 C HIS A 149 -8.473 3.869 -4.861 1.00 0.40 C ATOM 2381 O HIS A 149 -7.430 3.681 -4.259 1.00 0.69 O ATOM 2382 CB HIS A 149 -10.365 5.149 -3.825 1.00 0.60 C ATOM 2383 CG HIS A 149 -11.725 5.136 -3.194 1.00 1.08 C ATOM 2384 ND1 HIS A 149 -12.887 4.990 -3.917 1.00 1.67 N ATOM 2385 CD2 HIS A 149 -12.104 5.245 -1.899 1.00 1.88 C ATOM 2386 CE1 HIS A 149 -13.920 5.012 -3.097 1.00 2.14 C ATOM 2387 NE2 HIS A 149 -13.473 5.164 -1.866 1.00 2.32 N ATOM 0 H HIS A 149 -9.956 3.511 -2.017 1.00 0.43 H new ATOM 0 HA HIS A 149 -10.502 3.193 -4.702 1.00 0.45 H new ATOM 0 HB2 HIS A 149 -9.680 5.693 -3.175 1.00 0.60 H new ATOM 0 HB3 HIS A 149 -10.417 5.699 -4.765 1.00 0.60 H new ATOM 0 HD2 HIS A 149 -11.450 5.372 -1.049 1.00 1.88 H new ATOM 0 HE1 HIS A 149 -14.957 4.921 -3.385 1.00 2.14 H new ATOM 0 HE2 HIS A 149 -14.050 5.213 -1.027 1.00 2.32 H new ATOM 2396 N PRO A 150 -8.516 4.138 -6.190 1.00 0.32 N ATOM 2397 CA PRO A 150 -7.321 4.223 -7.064 1.00 0.32 C ATOM 2398 C PRO A 150 -6.191 5.073 -6.494 1.00 0.36 C ATOM 2399 O PRO A 150 -5.947 6.201 -6.919 1.00 0.47 O ATOM 2400 CB PRO A 150 -7.850 4.862 -8.354 1.00 0.41 C ATOM 2401 CG PRO A 150 -9.254 5.283 -8.056 1.00 0.53 C ATOM 2402 CD PRO A 150 -9.736 4.380 -6.964 1.00 0.46 C ATOM 0 HA PRO A 150 -6.880 3.235 -7.196 1.00 0.32 H new ATOM 0 HB2 PRO A 150 -7.239 5.717 -8.646 1.00 0.41 H new ATOM 0 HB3 PRO A 150 -7.822 4.153 -9.181 1.00 0.41 H new ATOM 0 HG2 PRO A 150 -9.290 6.326 -7.743 1.00 0.53 H new ATOM 0 HG3 PRO A 150 -9.884 5.194 -8.941 1.00 0.53 H new ATOM 0 HD2 PRO A 150 -10.512 4.851 -6.361 1.00 0.46 H new ATOM 0 HD3 PRO A 150 -10.156 3.455 -7.358 1.00 0.46 H new ATOM 2410 N CYS A 151 -5.518 4.497 -5.535 1.00 0.38 N ATOM 2411 CA CYS A 151 -4.356 5.071 -4.922 1.00 0.48 C ATOM 2412 C CYS A 151 -3.355 3.951 -4.732 1.00 0.43 C ATOM 2413 O CYS A 151 -3.700 2.775 -4.884 1.00 0.77 O ATOM 2414 CB CYS A 151 -4.726 5.739 -3.597 1.00 0.84 C ATOM 2415 SG CYS A 151 -5.513 4.635 -2.400 1.00 1.58 S ATOM 0 H CYS A 151 -5.773 3.588 -5.149 1.00 0.38 H new ATOM 0 HA CYS A 151 -3.922 5.851 -5.548 1.00 0.48 H new ATOM 0 HB2 CYS A 151 -3.824 6.157 -3.150 1.00 0.84 H new ATOM 0 HB3 CYS A 151 -5.397 6.574 -3.799 1.00 0.84 H new ATOM 0 HG CYS A 151 -6.484 3.992 -2.976 1.00 1.58 H new ATOM 2421 N GLY A 152 -2.129 4.282 -4.418 1.00 0.34 N ATOM 2422 CA GLY A 152 -1.103 3.286 -4.505 1.00 0.39 C ATOM 2423 C GLY A 152 0.051 3.536 -3.586 1.00 0.36 C ATOM 2424 O GLY A 152 -0.116 3.986 -2.455 1.00 0.43 O ATOM 0 H GLY A 152 -1.826 5.206 -4.109 1.00 0.34 H new ATOM 0 HA2 GLY A 152 -1.534 2.311 -4.277 1.00 0.39 H new ATOM 0 HA3 GLY A 152 -0.737 3.241 -5.531 1.00 0.39 H new ATOM 2428 N PHE A 153 1.225 3.299 -4.115 1.00 0.32 N ATOM 2429 CA PHE A 153 2.413 3.149 -3.310 1.00 0.31 C ATOM 2430 C PHE A 153 3.609 3.308 -4.213 1.00 0.30 C ATOM 2431 O PHE A 153 4.033 2.353 -4.863 1.00 0.38 O ATOM 2432 CB PHE A 153 2.403 1.763 -2.647 1.00 0.36 C ATOM 2433 CG PHE A 153 3.530 1.500 -1.683 1.00 0.38 C ATOM 2434 CD1 PHE A 153 3.410 1.838 -0.345 1.00 0.54 C ATOM 2435 CD2 PHE A 153 4.699 0.893 -2.113 1.00 0.49 C ATOM 2436 CE1 PHE A 153 4.436 1.579 0.543 1.00 0.60 C ATOM 2437 CE2 PHE A 153 5.725 0.629 -1.228 1.00 0.55 C ATOM 2438 CZ PHE A 153 5.595 0.973 0.101 1.00 0.52 C ATOM 0 H PHE A 153 1.385 3.204 -5.118 1.00 0.32 H new ATOM 0 HA PHE A 153 2.452 3.901 -2.522 1.00 0.31 H new ATOM 0 HB2 PHE A 153 1.458 1.639 -2.118 1.00 0.36 H new ATOM 0 HB3 PHE A 153 2.432 1.005 -3.429 1.00 0.36 H new ATOM 0 HD1 PHE A 153 2.504 2.309 0.008 1.00 0.54 H new ATOM 0 HD2 PHE A 153 4.809 0.623 -3.153 1.00 0.49 H new ATOM 0 HE1 PHE A 153 4.331 1.851 1.583 1.00 0.60 H new ATOM 0 HE2 PHE A 153 6.630 0.153 -1.577 1.00 0.55 H new ATOM 0 HZ PHE A 153 6.398 0.769 0.794 1.00 0.52 H new ATOM 2448 N VAL A 154 4.122 4.512 -4.308 1.00 0.25 N ATOM 2449 CA VAL A 154 5.211 4.750 -5.214 1.00 0.25 C ATOM 2450 C VAL A 154 6.524 4.836 -4.461 1.00 0.24 C ATOM 2451 O VAL A 154 6.613 5.403 -3.372 1.00 0.31 O ATOM 2452 CB VAL A 154 5.021 6.014 -6.080 1.00 0.25 C ATOM 2453 CG1 VAL A 154 3.668 6.040 -6.768 1.00 0.27 C ATOM 2454 CG2 VAL A 154 5.234 7.291 -5.289 1.00 0.26 C ATOM 0 H VAL A 154 3.808 5.325 -3.779 1.00 0.25 H new ATOM 0 HA VAL A 154 5.229 3.898 -5.894 1.00 0.25 H new ATOM 0 HB VAL A 154 5.790 5.965 -6.851 1.00 0.25 H new ATOM 0 HG11 VAL A 154 3.581 6.948 -7.365 1.00 0.27 H new ATOM 0 HG12 VAL A 154 3.572 5.169 -7.416 1.00 0.27 H new ATOM 0 HG13 VAL A 154 2.878 6.022 -6.017 1.00 0.27 H new ATOM 0 HG21 VAL A 154 5.089 8.152 -5.942 1.00 0.26 H new ATOM 0 HG22 VAL A 154 4.518 7.334 -4.468 1.00 0.26 H new ATOM 0 HG23 VAL A 154 6.248 7.306 -4.888 1.00 0.26 H new ATOM 2464 N CYS A 155 7.532 4.230 -5.028 1.00 0.21 N ATOM 2465 CA CYS A 155 8.868 4.305 -4.463 1.00 0.23 C ATOM 2466 C CYS A 155 9.762 5.107 -5.393 1.00 0.27 C ATOM 2467 O CYS A 155 10.092 4.657 -6.491 1.00 0.42 O ATOM 2468 CB CYS A 155 9.425 2.908 -4.250 1.00 0.27 C ATOM 2469 SG CYS A 155 8.487 1.912 -3.073 1.00 1.55 S ATOM 0 H CYS A 155 7.462 3.676 -5.882 1.00 0.21 H new ATOM 0 HA CYS A 155 8.828 4.804 -3.495 1.00 0.23 H new ATOM 0 HB2 CYS A 155 9.452 2.389 -5.208 1.00 0.27 H new ATOM 0 HB3 CYS A 155 10.455 2.988 -3.902 1.00 0.27 H new ATOM 0 HG CYS A 155 8.750 0.653 -3.263 1.00 1.55 H new ATOM 2475 N SER A 156 10.150 6.291 -4.962 1.00 0.25 N ATOM 2476 CA SER A 156 10.817 7.220 -5.855 1.00 0.29 C ATOM 2477 C SER A 156 12.320 7.224 -5.624 1.00 0.30 C ATOM 2478 O SER A 156 12.786 7.443 -4.509 1.00 0.29 O ATOM 2479 CB SER A 156 10.248 8.627 -5.667 1.00 0.32 C ATOM 2480 OG SER A 156 8.832 8.621 -5.776 1.00 1.06 O ATOM 0 H SER A 156 10.017 6.631 -4.009 1.00 0.25 H new ATOM 0 HA SER A 156 10.637 6.895 -6.880 1.00 0.29 H new ATOM 0 HB2 SER A 156 10.540 9.014 -4.691 1.00 0.32 H new ATOM 0 HB3 SER A 156 10.671 9.297 -6.415 1.00 0.32 H new ATOM 0 HG SER A 156 8.490 9.531 -5.651 1.00 1.06 H new ATOM 2486 N PRO A 157 13.098 6.929 -6.667 1.00 0.36 N ATOM 2487 CA PRO A 157 14.544 7.093 -6.625 1.00 0.39 C ATOM 2488 C PRO A 157 14.913 8.522 -6.245 1.00 0.40 C ATOM 2489 O PRO A 157 14.621 9.461 -6.986 1.00 0.49 O ATOM 2490 CB PRO A 157 14.983 6.783 -8.061 1.00 0.51 C ATOM 2491 CG PRO A 157 13.901 5.924 -8.611 1.00 0.56 C ATOM 2492 CD PRO A 157 12.635 6.396 -7.958 1.00 0.45 C ATOM 0 HA PRO A 157 15.023 6.451 -5.886 1.00 0.39 H new ATOM 0 HB2 PRO A 157 15.099 7.696 -8.645 1.00 0.51 H new ATOM 0 HB3 PRO A 157 15.944 6.269 -8.079 1.00 0.51 H new ATOM 0 HG2 PRO A 157 13.840 6.017 -9.695 1.00 0.56 H new ATOM 0 HG3 PRO A 157 14.086 4.873 -8.391 1.00 0.56 H new ATOM 0 HD2 PRO A 157 12.136 7.161 -8.553 1.00 0.45 H new ATOM 0 HD3 PRO A 157 11.923 5.581 -7.825 1.00 0.45 H new ATOM 2500 N MET A 158 15.547 8.687 -5.088 1.00 0.37 N ATOM 2501 CA MET A 158 15.890 10.025 -4.607 1.00 0.43 C ATOM 2502 C MET A 158 17.060 10.583 -5.372 1.00 0.48 C ATOM 2503 O MET A 158 17.517 9.989 -6.346 1.00 0.49 O ATOM 2504 CB MET A 158 16.269 10.022 -3.134 1.00 0.43 C ATOM 2505 CG MET A 158 15.094 9.997 -2.187 1.00 0.50 C ATOM 2506 SD MET A 158 14.098 11.501 -2.246 1.00 0.95 S ATOM 2507 CE MET A 158 15.291 12.724 -1.702 1.00 1.16 C ATOM 0 H MET A 158 15.831 7.925 -4.473 1.00 0.37 H new ATOM 0 HA MET A 158 15.001 10.638 -4.754 1.00 0.43 H new ATOM 0 HB2 MET A 158 16.899 9.155 -2.935 1.00 0.43 H new ATOM 0 HB3 MET A 158 16.870 10.907 -2.924 1.00 0.43 H new ATOM 0 HG2 MET A 158 14.462 9.141 -2.425 1.00 0.50 H new ATOM 0 HG3 MET A 158 15.459 9.851 -1.170 1.00 0.50 H new ATOM 0 HE1 MET A 158 14.766 13.604 -1.331 1.00 1.16 H new ATOM 0 HE2 MET A 158 15.904 12.304 -0.905 1.00 1.16 H new ATOM 0 HE3 MET A 158 15.929 13.008 -2.539 1.00 1.16 H new ATOM 2517 N GLU A 159 17.566 11.713 -4.927 1.00 0.57 N ATOM 2518 CA GLU A 159 18.805 12.197 -5.468 1.00 0.62 C ATOM 2519 C GLU A 159 19.929 11.283 -4.997 1.00 0.54 C ATOM 2520 O GLU A 159 20.901 11.041 -5.708 1.00 0.59 O ATOM 2521 CB GLU A 159 19.063 13.647 -5.064 1.00 0.76 C ATOM 2522 CG GLU A 159 20.110 14.334 -5.924 1.00 1.38 C ATOM 2523 CD GLU A 159 19.684 14.424 -7.373 1.00 1.87 C ATOM 2524 OE1 GLU A 159 18.851 15.296 -7.705 1.00 2.09 O ATOM 2525 OE2 GLU A 159 20.193 13.636 -8.193 1.00 2.63 O ATOM 0 H GLU A 159 17.145 12.299 -4.207 1.00 0.57 H new ATOM 0 HA GLU A 159 18.755 12.183 -6.557 1.00 0.62 H new ATOM 0 HB2 GLU A 159 18.129 14.206 -5.126 1.00 0.76 H new ATOM 0 HB3 GLU A 159 19.383 13.675 -4.022 1.00 0.76 H new ATOM 0 HG2 GLU A 159 20.295 15.336 -5.538 1.00 1.38 H new ATOM 0 HG3 GLU A 159 21.050 13.787 -5.856 1.00 1.38 H new ATOM 2532 N GLU A 160 19.744 10.740 -3.801 1.00 0.52 N ATOM 2533 CA GLU A 160 20.659 9.762 -3.227 1.00 0.55 C ATOM 2534 C GLU A 160 20.094 8.366 -3.459 1.00 0.58 C ATOM 2535 O GLU A 160 20.349 7.449 -2.685 1.00 0.76 O ATOM 2536 CB GLU A 160 20.792 9.970 -1.725 1.00 0.63 C ATOM 2537 CG GLU A 160 20.667 11.414 -1.263 1.00 0.77 C ATOM 2538 CD GLU A 160 21.696 12.335 -1.879 1.00 1.32 C ATOM 2539 OE1 GLU A 160 22.862 12.304 -1.441 1.00 1.61 O ATOM 2540 OE2 GLU A 160 21.331 13.115 -2.779 1.00 2.05 O ATOM 0 H GLU A 160 18.952 10.966 -3.199 1.00 0.52 H new ATOM 0 HA GLU A 160 21.635 9.878 -3.699 1.00 0.55 H new ATOM 0 HB2 GLU A 160 20.029 9.376 -1.222 1.00 0.63 H new ATOM 0 HB3 GLU A 160 21.759 9.584 -1.404 1.00 0.63 H new ATOM 0 HG2 GLU A 160 19.670 11.781 -1.508 1.00 0.77 H new ATOM 0 HG3 GLU A 160 20.762 11.450 -0.178 1.00 0.77 H new ATOM 2547 N ASN A 161 19.322 8.247 -4.531 1.00 0.51 N ATOM 2548 CA ASN A 161 18.453 7.087 -4.807 1.00 0.65 C ATOM 2549 C ASN A 161 19.002 5.715 -4.394 1.00 0.53 C ATOM 2550 O ASN A 161 18.264 4.951 -3.776 1.00 0.53 O ATOM 2551 CB ASN A 161 17.972 7.053 -6.274 1.00 0.92 C ATOM 2552 CG ASN A 161 19.069 7.125 -7.320 1.00 1.07 C ATOM 2553 OD1 ASN A 161 19.589 6.103 -7.759 1.00 1.93 O ATOM 2554 ND2 ASN A 161 19.401 8.332 -7.753 1.00 1.62 N ATOM 0 H ASN A 161 19.274 8.964 -5.255 1.00 0.51 H new ATOM 0 HA ASN A 161 17.603 7.261 -4.147 1.00 0.65 H new ATOM 0 HB2 ASN A 161 17.403 6.137 -6.431 1.00 0.92 H new ATOM 0 HB3 ASN A 161 17.286 7.885 -6.433 1.00 0.92 H new ATOM 0 HD21 ASN A 161 20.112 8.436 -8.477 1.00 1.62 H new ATOM 0 HD22 ASN A 161 18.945 9.157 -7.363 1.00 1.62 H new ATOM 2561 N PRO A 162 20.258 5.336 -4.699 1.00 0.55 N ATOM 2562 CA PRO A 162 20.711 3.992 -4.389 1.00 0.57 C ATOM 2563 C PRO A 162 21.009 3.784 -2.903 1.00 0.55 C ATOM 2564 O PRO A 162 21.143 2.650 -2.440 1.00 0.63 O ATOM 2565 CB PRO A 162 21.977 3.839 -5.220 1.00 0.71 C ATOM 2566 CG PRO A 162 22.510 5.222 -5.331 1.00 0.73 C ATOM 2567 CD PRO A 162 21.305 6.116 -5.386 1.00 0.67 C ATOM 0 HA PRO A 162 19.944 3.252 -4.616 1.00 0.57 H new ATOM 0 HB2 PRO A 162 22.693 3.174 -4.737 1.00 0.71 H new ATOM 0 HB3 PRO A 162 21.761 3.416 -6.201 1.00 0.71 H new ATOM 0 HG2 PRO A 162 23.142 5.468 -4.478 1.00 0.73 H new ATOM 0 HG3 PRO A 162 23.123 5.335 -6.225 1.00 0.73 H new ATOM 0 HD2 PRO A 162 21.489 7.067 -4.886 1.00 0.67 H new ATOM 0 HD3 PRO A 162 21.024 6.346 -6.414 1.00 0.67 H new ATOM 2575 N ALA A 163 21.112 4.879 -2.166 1.00 0.53 N ATOM 2576 CA ALA A 163 21.406 4.827 -0.740 1.00 0.59 C ATOM 2577 C ALA A 163 20.198 5.276 0.075 1.00 0.53 C ATOM 2578 O ALA A 163 20.027 4.878 1.225 1.00 0.58 O ATOM 2579 CB ALA A 163 22.611 5.701 -0.422 1.00 0.68 C ATOM 0 H ALA A 163 20.995 5.823 -2.535 1.00 0.53 H new ATOM 0 HA ALA A 163 21.637 3.796 -0.472 1.00 0.59 H new ATOM 0 HB1 ALA A 163 22.822 5.655 0.646 1.00 0.68 H new ATOM 0 HB2 ALA A 163 23.477 5.343 -0.979 1.00 0.68 H new ATOM 0 HB3 ALA A 163 22.398 6.732 -0.706 1.00 0.68 H new ATOM 2585 N TYR A 164 19.379 6.121 -0.536 1.00 0.45 N ATOM 2586 CA TYR A 164 18.162 6.632 0.081 1.00 0.40 C ATOM 2587 C TYR A 164 17.054 6.700 -0.959 1.00 0.32 C ATOM 2588 O TYR A 164 17.263 7.227 -2.049 1.00 0.38 O ATOM 2589 CB TYR A 164 18.390 8.036 0.646 1.00 0.46 C ATOM 2590 CG TYR A 164 19.206 8.081 1.920 1.00 0.56 C ATOM 2591 CD1 TYR A 164 18.626 7.835 3.159 1.00 0.61 C ATOM 2592 CD2 TYR A 164 20.567 8.353 1.875 1.00 0.67 C ATOM 2593 CE1 TYR A 164 19.380 7.865 4.316 1.00 0.73 C ATOM 2594 CE2 TYR A 164 21.326 8.381 3.027 1.00 0.78 C ATOM 2595 CZ TYR A 164 20.681 8.188 4.273 1.00 0.79 C ATOM 2596 OH TYR A 164 21.488 8.162 5.391 1.00 0.93 O ATOM 0 H TYR A 164 19.541 6.474 -1.479 1.00 0.45 H new ATOM 0 HA TYR A 164 17.881 5.960 0.892 1.00 0.40 H new ATOM 0 HB2 TYR A 164 18.890 8.641 -0.111 1.00 0.46 H new ATOM 0 HB3 TYR A 164 17.421 8.499 0.835 1.00 0.46 H new ATOM 0 HD1 TYR A 164 17.570 7.617 3.218 1.00 0.61 H new ATOM 0 HD2 TYR A 164 21.039 8.546 0.923 1.00 0.67 H new ATOM 0 HE1 TYR A 164 18.918 7.626 5.263 1.00 0.73 H new ATOM 0 HE2 TYR A 164 22.392 8.547 2.979 1.00 0.78 H new ATOM 0 HH TYR A 164 22.398 8.430 5.144 1.00 0.93 H new ATOM 2606 N SER A 165 15.876 6.192 -0.642 1.00 0.26 N ATOM 2607 CA SER A 165 14.795 6.219 -1.608 1.00 0.24 C ATOM 2608 C SER A 165 13.548 6.850 -1.016 1.00 0.23 C ATOM 2609 O SER A 165 13.335 6.828 0.195 1.00 0.26 O ATOM 2610 CB SER A 165 14.493 4.817 -2.119 1.00 0.30 C ATOM 2611 OG SER A 165 13.588 4.855 -3.216 1.00 1.41 O ATOM 0 H SER A 165 15.647 5.765 0.256 1.00 0.26 H new ATOM 0 HA SER A 165 15.116 6.831 -2.451 1.00 0.24 H new ATOM 0 HB2 SER A 165 15.419 4.331 -2.425 1.00 0.30 H new ATOM 0 HB3 SER A 165 14.069 4.217 -1.314 1.00 0.30 H new ATOM 0 HG SER A 165 13.573 5.758 -3.597 1.00 1.41 H new ATOM 2617 N LYS A 166 12.737 7.423 -1.881 1.00 0.24 N ATOM 2618 CA LYS A 166 11.554 8.133 -1.466 1.00 0.26 C ATOM 2619 C LYS A 166 10.339 7.221 -1.435 1.00 0.28 C ATOM 2620 O LYS A 166 9.772 6.871 -2.463 1.00 0.43 O ATOM 2621 CB LYS A 166 11.327 9.342 -2.380 1.00 0.36 C ATOM 2622 CG LYS A 166 9.984 10.030 -2.203 1.00 0.32 C ATOM 2623 CD LYS A 166 9.647 10.260 -0.740 1.00 0.37 C ATOM 2624 CE LYS A 166 10.654 11.167 -0.057 1.00 0.47 C ATOM 2625 NZ LYS A 166 10.725 12.508 -0.696 1.00 0.74 N ATOM 0 H LYS A 166 12.883 7.407 -2.890 1.00 0.24 H new ATOM 0 HA LYS A 166 11.703 8.491 -0.448 1.00 0.26 H new ATOM 0 HB2 LYS A 166 12.119 10.069 -2.200 1.00 0.36 H new ATOM 0 HB3 LYS A 166 11.420 9.019 -3.417 1.00 0.36 H new ATOM 0 HG2 LYS A 166 9.995 10.986 -2.726 1.00 0.32 H new ATOM 0 HG3 LYS A 166 9.204 9.424 -2.663 1.00 0.32 H new ATOM 0 HD2 LYS A 166 8.653 10.700 -0.662 1.00 0.37 H new ATOM 0 HD3 LYS A 166 9.613 9.302 -0.221 1.00 0.37 H new ATOM 0 HE2 LYS A 166 10.385 11.280 0.993 1.00 0.47 H new ATOM 0 HE3 LYS A 166 11.639 10.700 -0.085 1.00 0.47 H new ATOM 0 HZ1 LYS A 166 11.205 13.173 -0.056 1.00 0.74 H new ATOM 0 HZ2 LYS A 166 11.257 12.440 -1.587 1.00 0.74 H new ATOM 0 HZ3 LYS A 166 9.763 12.850 -0.892 1.00 0.74 H new ATOM 2639 N LEU A 167 9.954 6.849 -0.238 1.00 0.20 N ATOM 2640 CA LEU A 167 8.753 6.080 -0.017 1.00 0.21 C ATOM 2641 C LEU A 167 7.571 7.028 0.065 1.00 0.20 C ATOM 2642 O LEU A 167 7.358 7.673 1.094 1.00 0.24 O ATOM 2643 CB LEU A 167 8.879 5.286 1.282 1.00 0.23 C ATOM 2644 CG LEU A 167 8.030 4.018 1.368 1.00 0.24 C ATOM 2645 CD1 LEU A 167 6.545 4.330 1.354 1.00 0.27 C ATOM 2646 CD2 LEU A 167 8.392 3.081 0.227 1.00 0.25 C ATOM 0 H LEU A 167 10.468 7.072 0.614 1.00 0.20 H new ATOM 0 HA LEU A 167 8.604 5.381 -0.840 1.00 0.21 H new ATOM 0 HB2 LEU A 167 9.925 5.011 1.418 1.00 0.23 H new ATOM 0 HB3 LEU A 167 8.610 5.938 2.113 1.00 0.23 H new ATOM 0 HG LEU A 167 8.245 3.530 2.319 1.00 0.24 H new ATOM 0 HD11 LEU A 167 5.978 3.401 1.417 1.00 0.27 H new ATOM 0 HD12 LEU A 167 6.298 4.964 2.206 1.00 0.27 H new ATOM 0 HD13 LEU A 167 6.291 4.849 0.430 1.00 0.27 H new ATOM 0 HD21 LEU A 167 7.785 2.178 0.291 1.00 0.25 H new ATOM 0 HD22 LEU A 167 8.204 3.577 -0.725 1.00 0.25 H new ATOM 0 HD23 LEU A 167 9.447 2.815 0.296 1.00 0.25 H new ATOM 2658 N VAL A 168 6.816 7.138 -1.013 1.00 0.19 N ATOM 2659 CA VAL A 168 5.639 7.996 -0.995 1.00 0.20 C ATOM 2660 C VAL A 168 4.394 7.214 -1.389 1.00 0.23 C ATOM 2661 O VAL A 168 4.359 6.529 -2.405 1.00 0.28 O ATOM 2662 CB VAL A 168 5.826 9.276 -1.856 1.00 0.20 C ATOM 2663 CG1 VAL A 168 6.837 9.050 -2.960 1.00 0.21 C ATOM 2664 CG2 VAL A 168 4.505 9.780 -2.427 1.00 0.26 C ATOM 0 H VAL A 168 6.988 6.657 -1.896 1.00 0.19 H new ATOM 0 HA VAL A 168 5.502 8.342 0.029 1.00 0.20 H new ATOM 0 HB VAL A 168 6.211 10.051 -1.193 1.00 0.20 H new ATOM 0 HG11 VAL A 168 6.947 9.963 -3.545 1.00 0.21 H new ATOM 0 HG12 VAL A 168 7.799 8.781 -2.523 1.00 0.21 H new ATOM 0 HG13 VAL A 168 6.494 8.243 -3.607 1.00 0.21 H new ATOM 0 HG21 VAL A 168 4.684 10.676 -3.022 1.00 0.26 H new ATOM 0 HG22 VAL A 168 4.063 9.008 -3.057 1.00 0.26 H new ATOM 0 HG23 VAL A 168 3.822 10.017 -1.611 1.00 0.26 H new ATOM 2674 N MET A 169 3.371 7.321 -0.566 1.00 0.29 N ATOM 2675 CA MET A 169 2.191 6.501 -0.703 1.00 0.32 C ATOM 2676 C MET A 169 0.967 7.386 -0.611 1.00 0.34 C ATOM 2677 O MET A 169 1.039 8.520 -0.144 1.00 0.45 O ATOM 2678 CB MET A 169 2.170 5.410 0.380 1.00 0.35 C ATOM 2679 CG MET A 169 1.004 4.438 0.291 1.00 0.40 C ATOM 2680 SD MET A 169 1.002 3.233 1.634 1.00 0.74 S ATOM 2681 CE MET A 169 -0.405 2.224 1.172 1.00 1.24 C ATOM 0 H MET A 169 3.337 7.978 0.214 1.00 0.29 H new ATOM 0 HA MET A 169 2.197 6.002 -1.672 1.00 0.32 H new ATOM 0 HB2 MET A 169 3.100 4.844 0.323 1.00 0.35 H new ATOM 0 HB3 MET A 169 2.149 5.891 1.358 1.00 0.35 H new ATOM 0 HG2 MET A 169 0.068 4.996 0.307 1.00 0.40 H new ATOM 0 HG3 MET A 169 1.045 3.913 -0.663 1.00 0.40 H new ATOM 0 HE1 MET A 169 -0.761 1.675 2.044 1.00 1.24 H new ATOM 0 HE2 MET A 169 -1.203 2.864 0.796 1.00 1.24 H new ATOM 0 HE3 MET A 169 -0.108 1.519 0.395 1.00 1.24 H new ATOM 2691 N PHE A 170 -0.142 6.867 -1.063 1.00 0.36 N ATOM 2692 CA PHE A 170 -1.357 7.623 -1.173 1.00 0.42 C ATOM 2693 C PHE A 170 -2.478 6.731 -0.738 1.00 0.37 C ATOM 2694 O PHE A 170 -2.807 5.767 -1.427 1.00 0.38 O ATOM 2695 CB PHE A 170 -1.606 8.078 -2.610 1.00 0.69 C ATOM 2696 CG PHE A 170 -0.351 8.375 -3.387 1.00 1.26 C ATOM 2697 CD1 PHE A 170 0.446 7.356 -3.860 1.00 1.74 C ATOM 2698 CD2 PHE A 170 0.025 9.686 -3.649 1.00 2.02 C ATOM 2699 CE1 PHE A 170 1.595 7.631 -4.575 1.00 2.73 C ATOM 2700 CE2 PHE A 170 1.169 9.965 -4.363 1.00 3.07 C ATOM 2701 CZ PHE A 170 1.970 8.909 -4.814 1.00 3.37 C ATOM 0 H PHE A 170 -0.227 5.897 -1.368 1.00 0.36 H new ATOM 0 HA PHE A 170 -1.286 8.516 -0.552 1.00 0.42 H new ATOM 0 HB2 PHE A 170 -2.169 7.305 -3.132 1.00 0.69 H new ATOM 0 HB3 PHE A 170 -2.230 8.971 -2.594 1.00 0.69 H new ATOM 0 HD1 PHE A 170 0.169 6.330 -3.669 1.00 1.74 H new ATOM 0 HD2 PHE A 170 -0.588 10.498 -3.288 1.00 2.02 H new ATOM 0 HE1 PHE A 170 2.200 6.818 -4.947 1.00 2.73 H new ATOM 0 HE2 PHE A 170 1.445 10.988 -4.573 1.00 3.07 H new ATOM 0 HZ PHE A 170 2.884 9.114 -5.351 1.00 3.37 H new ATOM 2711 N VAL A 171 -3.015 7.022 0.415 1.00 0.43 N ATOM 2712 CA VAL A 171 -4.077 6.228 0.963 1.00 0.50 C ATOM 2713 C VAL A 171 -5.393 6.980 0.855 1.00 0.49 C ATOM 2714 O VAL A 171 -5.690 7.874 1.646 1.00 0.50 O ATOM 2715 CB VAL A 171 -3.745 5.829 2.419 1.00 0.66 C ATOM 2716 CG1 VAL A 171 -4.953 5.313 3.169 1.00 1.28 C ATOM 2717 CG2 VAL A 171 -2.665 4.764 2.416 1.00 1.40 C ATOM 0 H VAL A 171 -2.731 7.810 0.996 1.00 0.43 H new ATOM 0 HA VAL A 171 -4.181 5.305 0.392 1.00 0.50 H new ATOM 0 HB VAL A 171 -3.400 6.727 2.932 1.00 0.66 H new ATOM 0 HG11 VAL A 171 -4.664 5.047 4.186 1.00 1.28 H new ATOM 0 HG12 VAL A 171 -5.720 6.087 3.200 1.00 1.28 H new ATOM 0 HG13 VAL A 171 -5.347 4.432 2.662 1.00 1.28 H new ATOM 0 HG21 VAL A 171 -2.430 4.482 3.442 1.00 1.40 H new ATOM 0 HG22 VAL A 171 -3.018 3.889 1.871 1.00 1.40 H new ATOM 0 HG23 VAL A 171 -1.770 5.155 1.933 1.00 1.40 H new ATOM 2727 N GLN A 172 -6.146 6.637 -0.179 1.00 0.57 N ATOM 2728 CA GLN A 172 -7.495 7.144 -0.371 1.00 0.65 C ATOM 2729 C GLN A 172 -8.445 6.060 0.101 1.00 0.65 C ATOM 2730 O GLN A 172 -9.651 6.084 -0.140 1.00 0.95 O ATOM 2731 CB GLN A 172 -7.730 7.483 -1.850 1.00 0.80 C ATOM 2732 CG GLN A 172 -9.013 8.258 -2.120 1.00 1.01 C ATOM 2733 CD GLN A 172 -9.196 8.596 -3.587 1.00 1.54 C ATOM 2734 OE1 GLN A 172 -8.229 8.751 -4.330 1.00 2.17 O ATOM 2735 NE2 GLN A 172 -10.441 8.720 -4.014 1.00 2.15 N ATOM 0 H GLN A 172 -5.837 5.997 -0.911 1.00 0.57 H new ATOM 0 HA GLN A 172 -7.657 8.061 0.195 1.00 0.65 H new ATOM 0 HB2 GLN A 172 -6.884 8.065 -2.216 1.00 0.80 H new ATOM 0 HB3 GLN A 172 -7.752 6.557 -2.424 1.00 0.80 H new ATOM 0 HG2 GLN A 172 -9.866 7.671 -1.778 1.00 1.01 H new ATOM 0 HG3 GLN A 172 -9.005 9.179 -1.538 1.00 1.01 H new ATOM 0 HE21 GLN A 172 -11.218 8.584 -3.367 1.00 2.15 H new ATOM 0 HE22 GLN A 172 -10.625 8.952 -4.990 1.00 2.15 H new ATOM 2744 N THR A 173 -7.843 5.097 0.770 1.00 0.59 N ATOM 2745 CA THR A 173 -8.537 3.959 1.326 1.00 0.66 C ATOM 2746 C THR A 173 -9.568 4.411 2.352 1.00 0.75 C ATOM 2747 O THR A 173 -9.235 5.151 3.276 1.00 1.01 O ATOM 2748 CB THR A 173 -7.526 3.030 2.016 1.00 0.93 C ATOM 2749 OG1 THR A 173 -6.277 3.087 1.315 1.00 1.65 O ATOM 2750 CG2 THR A 173 -8.031 1.597 2.048 1.00 1.12 C ATOM 0 H THR A 173 -6.838 5.086 0.944 1.00 0.59 H new ATOM 0 HA THR A 173 -9.043 3.432 0.517 1.00 0.66 H new ATOM 0 HB THR A 173 -7.393 3.365 3.045 1.00 0.93 H new ATOM 0 HG1 THR A 173 -6.250 2.380 0.637 1.00 1.65 H new ATOM 0 HG21 THR A 173 -7.295 0.963 2.542 1.00 1.12 H new ATOM 0 HG22 THR A 173 -8.972 1.555 2.596 1.00 1.12 H new ATOM 0 HG23 THR A 173 -8.189 1.244 1.029 1.00 1.12 H new ATOM 2758 N GLU A 174 -10.815 3.979 2.206 1.00 0.69 N ATOM 2759 CA GLU A 174 -11.813 4.311 3.208 1.00 0.87 C ATOM 2760 C GLU A 174 -11.941 3.141 4.160 1.00 0.99 C ATOM 2761 O GLU A 174 -12.479 3.273 5.260 1.00 1.32 O ATOM 2762 CB GLU A 174 -13.164 4.652 2.569 1.00 0.97 C ATOM 2763 CG GLU A 174 -13.834 3.484 1.872 1.00 1.10 C ATOM 2764 CD GLU A 174 -15.118 3.882 1.169 1.00 1.80 C ATOM 2765 OE1 GLU A 174 -15.039 4.549 0.111 1.00 2.30 O ATOM 2766 OE2 GLU A 174 -16.208 3.530 1.662 1.00 2.45 O ATOM 0 H GLU A 174 -11.150 3.414 1.426 1.00 0.69 H new ATOM 0 HA GLU A 174 -11.495 5.200 3.753 1.00 0.87 H new ATOM 0 HB2 GLU A 174 -13.833 5.032 3.341 1.00 0.97 H new ATOM 0 HB3 GLU A 174 -13.020 5.457 1.848 1.00 0.97 H new ATOM 0 HG2 GLU A 174 -13.144 3.055 1.145 1.00 1.10 H new ATOM 0 HG3 GLU A 174 -14.051 2.705 2.603 1.00 1.10 H new ATOM 2773 N MET A 175 -11.405 1.996 3.711 1.00 1.04 N ATOM 2774 CA MET A 175 -11.428 0.745 4.466 1.00 1.36 C ATOM 2775 C MET A 175 -12.846 0.213 4.573 1.00 1.31 C ATOM 2776 O MET A 175 -13.170 -0.822 3.997 1.00 1.63 O ATOM 2777 CB MET A 175 -10.829 0.936 5.863 1.00 1.69 C ATOM 2778 CG MET A 175 -9.323 1.136 5.870 1.00 2.10 C ATOM 2779 SD MET A 175 -8.425 -0.332 5.328 1.00 3.24 S ATOM 2780 CE MET A 175 -6.732 0.237 5.476 1.00 3.74 C ATOM 0 H MET A 175 -10.941 1.917 2.806 1.00 1.04 H new ATOM 0 HA MET A 175 -10.820 0.018 3.929 1.00 1.36 H new ATOM 0 HB2 MET A 175 -11.301 1.798 6.334 1.00 1.69 H new ATOM 0 HB3 MET A 175 -11.072 0.066 6.473 1.00 1.69 H new ATOM 0 HG2 MET A 175 -9.068 1.973 5.220 1.00 2.10 H new ATOM 0 HG3 MET A 175 -9.001 1.404 6.876 1.00 2.10 H new ATOM 0 HE1 MET A 175 -6.053 -0.561 5.176 1.00 3.74 H new ATOM 0 HE2 MET A 175 -6.582 1.103 4.832 1.00 3.74 H new ATOM 0 HE3 MET A 175 -6.531 0.515 6.511 1.00 3.74 H new ATOM 2790 N ARG A 176 -13.666 0.968 5.290 1.00 1.20 N ATOM 2791 CA ARG A 176 -15.057 0.638 5.596 1.00 1.41 C ATOM 2792 C ARG A 176 -15.174 -0.738 6.252 1.00 1.43 C ATOM 2793 O ARG A 176 -14.175 -1.422 6.495 1.00 2.27 O ATOM 2794 CB ARG A 176 -15.962 0.751 4.353 1.00 1.92 C ATOM 2795 CG ARG A 176 -16.025 -0.493 3.485 1.00 2.40 C ATOM 2796 CD ARG A 176 -16.972 -0.312 2.311 1.00 3.21 C ATOM 2797 NE ARG A 176 -18.301 0.141 2.727 1.00 3.99 N ATOM 2798 CZ ARG A 176 -19.446 -0.406 2.314 1.00 4.83 C ATOM 2799 NH1 ARG A 176 -19.439 -1.451 1.493 1.00 5.05 N ATOM 2800 NH2 ARG A 176 -20.602 0.091 2.728 1.00 5.78 N ATOM 0 H ARG A 176 -13.374 1.859 5.690 1.00 1.20 H new ATOM 0 HA ARG A 176 -15.411 1.376 6.316 1.00 1.41 H new ATOM 0 HB2 ARG A 176 -16.972 0.998 4.680 1.00 1.92 H new ATOM 0 HB3 ARG A 176 -15.612 1.583 3.743 1.00 1.92 H new ATOM 0 HG2 ARG A 176 -15.027 -0.729 3.115 1.00 2.40 H new ATOM 0 HG3 ARG A 176 -16.350 -1.341 4.088 1.00 2.40 H new ATOM 0 HD2 ARG A 176 -16.547 0.410 1.614 1.00 3.21 H new ATOM 0 HD3 ARG A 176 -17.065 -1.256 1.774 1.00 3.21 H new ATOM 0 HE ARG A 176 -18.355 0.927 3.375 1.00 3.99 H new ATOM 0 HH11 ARG A 176 -18.553 -1.842 1.173 1.00 5.05 H new ATOM 0 HH12 ARG A 176 -20.320 -1.862 1.183 1.00 5.05 H new ATOM 0 HH21 ARG A 176 -20.616 0.890 3.361 1.00 5.78 H new ATOM 0 HH22 ARG A 176 -21.478 -0.326 2.413 1.00 5.78 H new ATOM 2814 N GLY A 177 -16.390 -1.125 6.576 1.00 1.09 N ATOM 2815 CA GLY A 177 -16.608 -2.402 7.200 1.00 1.32 C ATOM 2816 C GLY A 177 -16.491 -2.330 8.702 1.00 1.51 C ATOM 2817 O GLY A 177 -15.518 -2.827 9.275 1.00 2.26 O ATOM 0 H GLY A 177 -17.234 -0.574 6.417 1.00 1.09 H new ATOM 0 HA2 GLY A 177 -17.598 -2.771 6.932 1.00 1.32 H new ATOM 0 HA3 GLY A 177 -15.885 -3.121 6.815 1.00 1.32 H new ATOM 2821 N LYS A 178 -17.466 -1.668 9.323 1.00 1.79 N ATOM 2822 CA LYS A 178 -17.626 -1.670 10.774 1.00 2.45 C ATOM 2823 C LYS A 178 -16.507 -0.894 11.475 1.00 2.04 C ATOM 2824 O LYS A 178 -15.611 -1.478 12.086 1.00 2.30 O ATOM 2825 CB LYS A 178 -17.698 -3.119 11.265 1.00 3.40 C ATOM 2826 CG LYS A 178 -18.204 -3.295 12.685 1.00 4.30 C ATOM 2827 CD LYS A 178 -18.577 -4.745 12.923 1.00 4.79 C ATOM 2828 CE LYS A 178 -19.047 -5.003 14.341 1.00 5.70 C ATOM 2829 NZ LYS A 178 -19.575 -6.386 14.481 1.00 6.23 N ATOM 0 H LYS A 178 -18.168 -1.114 8.832 1.00 1.79 H new ATOM 0 HA LYS A 178 -18.554 -1.157 11.026 1.00 2.45 H new ATOM 0 HB2 LYS A 178 -18.346 -3.682 10.593 1.00 3.40 H new ATOM 0 HB3 LYS A 178 -16.704 -3.560 11.193 1.00 3.40 H new ATOM 0 HG2 LYS A 178 -17.436 -2.987 13.395 1.00 4.30 H new ATOM 0 HG3 LYS A 178 -19.070 -2.655 12.854 1.00 4.30 H new ATOM 0 HD2 LYS A 178 -19.364 -5.033 12.226 1.00 4.79 H new ATOM 0 HD3 LYS A 178 -17.715 -5.377 12.709 1.00 4.79 H new ATOM 0 HE2 LYS A 178 -18.220 -4.853 15.035 1.00 5.70 H new ATOM 0 HE3 LYS A 178 -19.822 -4.285 14.608 1.00 5.70 H new ATOM 0 HZ1 LYS A 178 -19.891 -6.540 15.460 1.00 6.23 H new ATOM 0 HZ2 LYS A 178 -20.378 -6.518 13.833 1.00 6.23 H new ATOM 0 HZ3 LYS A 178 -18.826 -7.069 14.248 1.00 6.23 H new ATOM 2843 N LEU A 179 -16.558 0.432 11.355 1.00 1.64 N ATOM 2844 CA LEU A 179 -15.657 1.322 12.074 1.00 1.35 C ATOM 2845 C LEU A 179 -16.273 2.715 12.218 1.00 1.40 C ATOM 2846 O LEU A 179 -17.063 3.155 11.381 1.00 1.56 O ATOM 2847 CB LEU A 179 -14.277 1.414 11.401 1.00 1.23 C ATOM 2848 CG LEU A 179 -14.177 0.897 9.963 1.00 1.17 C ATOM 2849 CD1 LEU A 179 -15.077 1.680 9.026 1.00 1.61 C ATOM 2850 CD2 LEU A 179 -12.747 0.974 9.480 1.00 1.15 C ATOM 0 H LEU A 179 -17.226 0.916 10.756 1.00 1.64 H new ATOM 0 HA LEU A 179 -15.510 0.896 13.067 1.00 1.35 H new ATOM 0 HB2 LEU A 179 -13.963 2.458 11.410 1.00 1.23 H new ATOM 0 HB3 LEU A 179 -13.563 0.861 12.012 1.00 1.23 H new ATOM 0 HG LEU A 179 -14.507 -0.142 9.961 1.00 1.17 H new ATOM 0 HD11 LEU A 179 -14.980 1.286 8.014 1.00 1.61 H new ATOM 0 HD12 LEU A 179 -16.112 1.587 9.354 1.00 1.61 H new ATOM 0 HD13 LEU A 179 -14.786 2.730 9.035 1.00 1.61 H new ATOM 0 HD21 LEU A 179 -12.688 0.604 8.456 1.00 1.15 H new ATOM 0 HD22 LEU A 179 -12.408 2.009 9.511 1.00 1.15 H new ATOM 0 HD23 LEU A 179 -12.112 0.364 10.123 1.00 1.15 H new ATOM 2862 N SER A 180 -15.908 3.392 13.293 1.00 1.31 N ATOM 2863 CA SER A 180 -16.425 4.716 13.608 1.00 1.39 C ATOM 2864 C SER A 180 -15.294 5.735 13.491 1.00 1.32 C ATOM 2865 O SER A 180 -14.137 5.335 13.418 1.00 1.19 O ATOM 2866 CB SER A 180 -17.005 4.718 15.028 1.00 1.41 C ATOM 2867 OG SER A 180 -17.952 3.675 15.196 1.00 2.04 O ATOM 0 H SER A 180 -15.240 3.038 13.978 1.00 1.31 H new ATOM 0 HA SER A 180 -17.218 4.982 12.909 1.00 1.39 H new ATOM 0 HB2 SER A 180 -16.199 4.602 15.753 1.00 1.41 H new ATOM 0 HB3 SER A 180 -17.479 5.679 15.229 1.00 1.41 H new ATOM 0 HG SER A 180 -18.305 3.698 16.110 1.00 2.04 H new ATOM 2873 N PRO A 181 -15.587 7.051 13.477 1.00 1.45 N ATOM 2874 CA PRO A 181 -14.549 8.092 13.378 1.00 1.44 C ATOM 2875 C PRO A 181 -13.357 7.842 14.309 1.00 1.30 C ATOM 2876 O PRO A 181 -12.205 7.954 13.893 1.00 1.20 O ATOM 2877 CB PRO A 181 -15.296 9.358 13.790 1.00 1.65 C ATOM 2878 CG PRO A 181 -16.700 9.116 13.360 1.00 1.74 C ATOM 2879 CD PRO A 181 -16.942 7.638 13.530 1.00 1.64 C ATOM 0 HA PRO A 181 -14.110 8.135 12.381 1.00 1.44 H new ATOM 0 HB2 PRO A 181 -15.233 9.524 14.865 1.00 1.65 H new ATOM 0 HB3 PRO A 181 -14.879 10.241 13.306 1.00 1.65 H new ATOM 0 HG2 PRO A 181 -17.398 9.697 13.963 1.00 1.74 H new ATOM 0 HG3 PRO A 181 -16.847 9.418 12.323 1.00 1.74 H new ATOM 0 HD2 PRO A 181 -17.436 7.420 14.477 1.00 1.64 H new ATOM 0 HD3 PRO A 181 -17.580 7.243 12.739 1.00 1.64 H new ATOM 2887 N SER A 182 -13.648 7.455 15.551 1.00 1.34 N ATOM 2888 CA SER A 182 -12.616 7.186 16.553 1.00 1.28 C ATOM 2889 C SER A 182 -11.736 5.996 16.152 1.00 1.11 C ATOM 2890 O SER A 182 -10.626 5.833 16.646 1.00 1.09 O ATOM 2891 CB SER A 182 -13.289 6.893 17.892 1.00 1.40 C ATOM 2892 OG SER A 182 -14.530 7.574 17.989 1.00 2.14 O ATOM 0 H SER A 182 -14.600 7.320 15.890 1.00 1.34 H new ATOM 0 HA SER A 182 -11.975 8.064 16.631 1.00 1.28 H new ATOM 0 HB2 SER A 182 -13.448 5.820 17.998 1.00 1.40 H new ATOM 0 HB3 SER A 182 -12.635 7.200 18.708 1.00 1.40 H new ATOM 0 HG SER A 182 -14.947 7.373 18.853 1.00 2.14 H new ATOM 2898 N ILE A 183 -12.247 5.179 15.244 1.00 1.04 N ATOM 2899 CA ILE A 183 -11.570 3.965 14.807 1.00 0.90 C ATOM 2900 C ILE A 183 -10.714 4.288 13.600 1.00 0.79 C ATOM 2901 O ILE A 183 -9.565 3.883 13.482 1.00 0.69 O ATOM 2902 CB ILE A 183 -12.598 2.891 14.391 1.00 0.96 C ATOM 2903 CG1 ILE A 183 -13.668 2.720 15.466 1.00 1.09 C ATOM 2904 CG2 ILE A 183 -11.922 1.568 14.096 1.00 0.92 C ATOM 2905 CD1 ILE A 183 -13.129 2.287 16.812 1.00 1.12 C ATOM 0 H ILE A 183 -13.145 5.338 14.787 1.00 1.04 H new ATOM 0 HA ILE A 183 -10.963 3.588 15.630 1.00 0.90 H new ATOM 0 HB ILE A 183 -13.081 3.232 13.475 1.00 0.96 H new ATOM 0 HG12 ILE A 183 -14.201 3.663 15.586 1.00 1.09 H new ATOM 0 HG13 ILE A 183 -14.396 1.984 15.125 1.00 1.09 H new ATOM 0 HG21 ILE A 183 -12.672 0.833 13.806 1.00 0.92 H new ATOM 0 HG22 ILE A 183 -11.208 1.698 13.283 1.00 0.92 H new ATOM 0 HG23 ILE A 183 -11.399 1.220 14.987 1.00 0.92 H new ATOM 0 HD11 ILE A 183 -13.953 2.188 17.519 1.00 1.12 H new ATOM 0 HD12 ILE A 183 -12.622 1.328 16.709 1.00 1.12 H new ATOM 0 HD13 ILE A 183 -12.423 3.033 17.178 1.00 1.12 H new ATOM 2917 N ILE A 184 -11.331 5.036 12.718 1.00 0.87 N ATOM 2918 CA ILE A 184 -10.767 5.452 11.463 1.00 0.83 C ATOM 2919 C ILE A 184 -9.618 6.429 11.663 1.00 0.81 C ATOM 2920 O ILE A 184 -8.610 6.375 10.952 1.00 0.75 O ATOM 2921 CB ILE A 184 -11.871 6.085 10.595 1.00 0.96 C ATOM 2922 CG1 ILE A 184 -12.682 5.005 9.888 1.00 0.98 C ATOM 2923 CG2 ILE A 184 -11.309 7.079 9.584 1.00 1.00 C ATOM 2924 CD1 ILE A 184 -14.013 4.739 10.542 1.00 1.13 C ATOM 0 H ILE A 184 -12.279 5.384 12.864 1.00 0.87 H new ATOM 0 HA ILE A 184 -10.361 4.576 10.957 1.00 0.83 H new ATOM 0 HB ILE A 184 -12.528 6.641 11.264 1.00 0.96 H new ATOM 0 HG12 ILE A 184 -12.846 5.303 8.852 1.00 0.98 H new ATOM 0 HG13 ILE A 184 -12.104 4.081 9.866 1.00 0.98 H new ATOM 0 HG21 ILE A 184 -12.124 7.499 8.995 1.00 1.00 H new ATOM 0 HG22 ILE A 184 -10.791 7.881 10.111 1.00 1.00 H new ATOM 0 HG23 ILE A 184 -10.609 6.569 8.922 1.00 1.00 H new ATOM 0 HD11 ILE A 184 -14.540 3.961 9.990 1.00 1.13 H new ATOM 0 HD12 ILE A 184 -13.855 4.412 11.570 1.00 1.13 H new ATOM 0 HD13 ILE A 184 -14.608 5.652 10.540 1.00 1.13 H new ATOM 2936 N GLU A 185 -9.757 7.292 12.656 1.00 0.91 N ATOM 2937 CA GLU A 185 -8.705 8.243 12.985 1.00 0.99 C ATOM 2938 C GLU A 185 -7.474 7.483 13.445 1.00 0.91 C ATOM 2939 O GLU A 185 -6.371 8.021 13.494 1.00 0.99 O ATOM 2940 CB GLU A 185 -9.154 9.235 14.062 1.00 1.17 C ATOM 2941 CG GLU A 185 -9.475 8.598 15.403 1.00 1.58 C ATOM 2942 CD GLU A 185 -9.778 9.627 16.474 1.00 2.26 C ATOM 2943 OE1 GLU A 185 -10.942 10.060 16.575 1.00 2.89 O ATOM 2944 OE2 GLU A 185 -8.848 10.020 17.214 1.00 2.46 O ATOM 0 H GLU A 185 -10.585 7.355 13.248 1.00 0.91 H new ATOM 0 HA GLU A 185 -8.470 8.822 12.092 1.00 0.99 H new ATOM 0 HB2 GLU A 185 -8.370 9.978 14.204 1.00 1.17 H new ATOM 0 HB3 GLU A 185 -10.036 9.767 13.705 1.00 1.17 H new ATOM 0 HG2 GLU A 185 -10.331 7.932 15.290 1.00 1.58 H new ATOM 0 HG3 GLU A 185 -8.633 7.984 15.721 1.00 1.58 H new ATOM 2951 N LYS A 186 -7.686 6.228 13.813 1.00 0.82 N ATOM 2952 CA LYS A 186 -6.596 5.338 14.111 1.00 0.79 C ATOM 2953 C LYS A 186 -6.213 4.556 12.869 1.00 0.70 C ATOM 2954 O LYS A 186 -5.036 4.457 12.540 1.00 0.86 O ATOM 2955 CB LYS A 186 -6.975 4.382 15.234 1.00 0.80 C ATOM 2956 CG LYS A 186 -7.437 5.096 16.485 1.00 1.27 C ATOM 2957 CD LYS A 186 -7.729 4.120 17.606 1.00 1.28 C ATOM 2958 CE LYS A 186 -8.934 3.256 17.288 1.00 0.96 C ATOM 2959 NZ LYS A 186 -9.211 2.296 18.385 1.00 1.09 N ATOM 0 H LYS A 186 -8.611 5.810 13.910 1.00 0.82 H new ATOM 0 HA LYS A 186 -5.742 5.932 14.438 1.00 0.79 H new ATOM 0 HB2 LYS A 186 -7.767 3.718 14.887 1.00 0.80 H new ATOM 0 HB3 LYS A 186 -6.117 3.755 15.476 1.00 0.80 H new ATOM 0 HG2 LYS A 186 -6.671 5.802 16.806 1.00 1.27 H new ATOM 0 HG3 LYS A 186 -8.333 5.676 16.264 1.00 1.27 H new ATOM 0 HD2 LYS A 186 -6.859 3.486 17.774 1.00 1.28 H new ATOM 0 HD3 LYS A 186 -7.907 4.669 18.531 1.00 1.28 H new ATOM 0 HE2 LYS A 186 -9.806 3.889 17.127 1.00 0.96 H new ATOM 0 HE3 LYS A 186 -8.759 2.711 16.360 1.00 0.96 H new ATOM 0 HZ1 LYS A 186 -10.040 1.718 18.140 1.00 1.09 H new ATOM 0 HZ2 LYS A 186 -8.386 1.677 18.521 1.00 1.09 H new ATOM 0 HZ3 LYS A 186 -9.401 2.819 19.264 1.00 1.09 H new ATOM 2973 N THR A 187 -7.218 4.036 12.156 1.00 0.59 N ATOM 2974 CA THR A 187 -6.952 3.076 11.083 1.00 0.54 C ATOM 2975 C THR A 187 -6.132 3.690 9.942 1.00 0.50 C ATOM 2976 O THR A 187 -5.360 2.986 9.292 1.00 0.53 O ATOM 2977 CB THR A 187 -8.254 2.450 10.524 1.00 0.58 C ATOM 2978 OG1 THR A 187 -7.943 1.295 9.732 1.00 0.62 O ATOM 2979 CG2 THR A 187 -9.019 3.442 9.671 1.00 0.60 C ATOM 0 H THR A 187 -8.203 4.259 12.299 1.00 0.59 H new ATOM 0 HA THR A 187 -6.358 2.282 11.536 1.00 0.54 H new ATOM 0 HB THR A 187 -8.876 2.165 11.373 1.00 0.58 H new ATOM 0 HG1 THR A 187 -8.772 0.904 9.384 1.00 0.62 H new ATOM 0 HG21 THR A 187 -9.927 2.973 9.293 1.00 0.60 H new ATOM 0 HG22 THR A 187 -9.283 4.312 10.273 1.00 0.60 H new ATOM 0 HG23 THR A 187 -8.398 3.756 8.832 1.00 0.60 H new ATOM 2987 N MET A 188 -6.279 4.991 9.706 1.00 0.52 N ATOM 2988 CA MET A 188 -5.525 5.652 8.643 1.00 0.53 C ATOM 2989 C MET A 188 -4.065 5.857 9.056 1.00 0.54 C ATOM 2990 O MET A 188 -3.173 5.270 8.449 1.00 0.54 O ATOM 2991 CB MET A 188 -6.180 6.978 8.234 1.00 0.62 C ATOM 2992 CG MET A 188 -7.078 6.897 7.002 1.00 0.80 C ATOM 2993 SD MET A 188 -8.391 5.666 7.126 1.00 1.06 S ATOM 2994 CE MET A 188 -7.575 4.224 6.442 1.00 0.83 C ATOM 0 H MET A 188 -6.905 5.603 10.229 1.00 0.52 H new ATOM 0 HA MET A 188 -5.538 5.000 7.770 1.00 0.53 H new ATOM 0 HB2 MET A 188 -6.770 7.349 9.072 1.00 0.62 H new ATOM 0 HB3 MET A 188 -5.396 7.712 8.047 1.00 0.62 H new ATOM 0 HG2 MET A 188 -7.527 7.875 6.828 1.00 0.80 H new ATOM 0 HG3 MET A 188 -6.463 6.670 6.132 1.00 0.80 H new ATOM 0 HE1 MET A 188 -8.151 3.846 5.597 1.00 0.83 H new ATOM 0 HE2 MET A 188 -6.575 4.497 6.106 1.00 0.83 H new ATOM 0 HE3 MET A 188 -7.502 3.450 7.206 1.00 0.83 H new ATOM 3004 N PRO A 189 -3.785 6.657 10.109 1.00 0.60 N ATOM 3005 CA PRO A 189 -2.408 6.912 10.557 1.00 0.71 C ATOM 3006 C PRO A 189 -1.676 5.628 10.947 1.00 0.74 C ATOM 3007 O PRO A 189 -0.472 5.501 10.731 1.00 0.91 O ATOM 3008 CB PRO A 189 -2.583 7.821 11.779 1.00 0.84 C ATOM 3009 CG PRO A 189 -3.935 8.423 11.615 1.00 0.83 C ATOM 3010 CD PRO A 189 -4.765 7.376 10.942 1.00 0.63 C ATOM 0 HA PRO A 189 -1.803 7.357 9.767 1.00 0.71 H new ATOM 0 HB2 PRO A 189 -2.513 7.254 12.707 1.00 0.84 H new ATOM 0 HB3 PRO A 189 -1.810 8.589 11.815 1.00 0.84 H new ATOM 0 HG2 PRO A 189 -4.360 8.699 12.580 1.00 0.83 H new ATOM 0 HG3 PRO A 189 -3.889 9.332 11.015 1.00 0.83 H new ATOM 0 HD2 PRO A 189 -5.243 6.714 11.665 1.00 0.63 H new ATOM 0 HD3 PRO A 189 -5.559 7.817 10.340 1.00 0.63 H new ATOM 3018 N SER A 190 -2.414 4.669 11.495 1.00 0.66 N ATOM 3019 CA SER A 190 -1.824 3.410 11.929 1.00 0.76 C ATOM 3020 C SER A 190 -1.421 2.573 10.729 1.00 0.72 C ATOM 3021 O SER A 190 -0.577 1.694 10.833 1.00 0.90 O ATOM 3022 CB SER A 190 -2.799 2.625 12.814 1.00 0.84 C ATOM 3023 OG SER A 190 -2.150 1.551 13.480 1.00 1.50 O ATOM 0 H SER A 190 -3.420 4.740 11.649 1.00 0.66 H new ATOM 0 HA SER A 190 -0.934 3.639 12.516 1.00 0.76 H new ATOM 0 HB2 SER A 190 -3.244 3.295 13.550 1.00 0.84 H new ATOM 0 HB3 SER A 190 -3.614 2.236 12.203 1.00 0.84 H new ATOM 0 HG SER A 190 -2.799 1.072 14.037 1.00 1.50 H new ATOM 3029 N ASN A 191 -2.044 2.844 9.599 1.00 0.57 N ATOM 3030 CA ASN A 191 -1.763 2.094 8.380 1.00 0.61 C ATOM 3031 C ASN A 191 -0.669 2.775 7.568 1.00 0.51 C ATOM 3032 O ASN A 191 0.251 2.121 7.086 1.00 0.52 O ATOM 3033 CB ASN A 191 -3.036 1.933 7.543 1.00 0.70 C ATOM 3034 CG ASN A 191 -2.803 1.162 6.255 1.00 1.08 C ATOM 3035 OD1 ASN A 191 -2.513 1.744 5.214 1.00 1.88 O ATOM 3036 ND2 ASN A 191 -2.935 -0.155 6.316 1.00 1.46 N ATOM 0 H ASN A 191 -2.747 3.575 9.494 1.00 0.57 H new ATOM 0 HA ASN A 191 -1.409 1.102 8.662 1.00 0.61 H new ATOM 0 HB2 ASN A 191 -3.792 1.419 8.136 1.00 0.70 H new ATOM 0 HB3 ASN A 191 -3.434 2.919 7.303 1.00 0.70 H new ATOM 0 HD21 ASN A 191 -2.795 -0.721 5.479 1.00 1.46 H new ATOM 0 HD22 ASN A 191 -3.177 -0.603 7.200 1.00 1.46 H new ATOM 3043 N LEU A 192 -0.773 4.092 7.459 1.00 0.45 N ATOM 3044 CA LEU A 192 0.167 4.902 6.682 1.00 0.42 C ATOM 3045 C LEU A 192 1.603 4.641 7.091 1.00 0.36 C ATOM 3046 O LEU A 192 2.436 4.220 6.287 1.00 0.35 O ATOM 3047 CB LEU A 192 -0.113 6.386 6.904 1.00 0.48 C ATOM 3048 CG LEU A 192 -1.538 6.840 6.612 1.00 0.62 C ATOM 3049 CD1 LEU A 192 -1.736 8.273 7.074 1.00 1.04 C ATOM 3050 CD2 LEU A 192 -1.848 6.708 5.135 1.00 1.09 C ATOM 0 H LEU A 192 -1.512 4.634 7.906 1.00 0.45 H new ATOM 0 HA LEU A 192 0.032 4.629 5.635 1.00 0.42 H new ATOM 0 HB2 LEU A 192 0.122 6.630 7.940 1.00 0.48 H new ATOM 0 HB3 LEU A 192 0.568 6.963 6.278 1.00 0.48 H new ATOM 0 HG LEU A 192 -2.227 6.199 7.162 1.00 0.62 H new ATOM 0 HD11 LEU A 192 -2.758 8.586 6.860 1.00 1.04 H new ATOM 0 HD12 LEU A 192 -1.554 8.338 8.147 1.00 1.04 H new ATOM 0 HD13 LEU A 192 -1.039 8.925 6.547 1.00 1.04 H new ATOM 0 HD21 LEU A 192 -2.870 7.037 4.947 1.00 1.09 H new ATOM 0 HD22 LEU A 192 -1.157 7.325 4.562 1.00 1.09 H new ATOM 0 HD23 LEU A 192 -1.741 5.666 4.832 1.00 1.09 H new ATOM 3062 N VAL A 193 1.878 4.889 8.358 1.00 0.36 N ATOM 3063 CA VAL A 193 3.239 4.870 8.856 1.00 0.36 C ATOM 3064 C VAL A 193 3.715 3.443 8.954 1.00 0.39 C ATOM 3065 O VAL A 193 4.894 3.140 8.786 1.00 0.42 O ATOM 3066 CB VAL A 193 3.349 5.561 10.232 1.00 0.44 C ATOM 3067 CG1 VAL A 193 2.385 6.736 10.305 1.00 0.68 C ATOM 3068 CG2 VAL A 193 3.092 4.603 11.390 1.00 0.59 C ATOM 0 H VAL A 193 1.173 5.107 9.063 1.00 0.36 H new ATOM 0 HA VAL A 193 3.868 5.423 8.158 1.00 0.36 H new ATOM 0 HB VAL A 193 4.374 5.918 10.331 1.00 0.44 H new ATOM 0 HG11 VAL A 193 2.470 7.217 11.280 1.00 0.68 H new ATOM 0 HG12 VAL A 193 2.628 7.455 9.523 1.00 0.68 H new ATOM 0 HG13 VAL A 193 1.365 6.379 10.165 1.00 0.68 H new ATOM 0 HG21 VAL A 193 3.182 5.141 12.334 1.00 0.59 H new ATOM 0 HG22 VAL A 193 2.088 4.188 11.303 1.00 0.59 H new ATOM 0 HG23 VAL A 193 3.822 3.794 11.362 1.00 0.59 H new ATOM 3078 N ASN A 194 2.762 2.578 9.208 1.00 0.43 N ATOM 3079 CA ASN A 194 3.020 1.170 9.319 1.00 0.48 C ATOM 3080 C ASN A 194 3.417 0.605 7.983 1.00 0.45 C ATOM 3081 O ASN A 194 4.377 -0.128 7.911 1.00 0.49 O ATOM 3082 CB ASN A 194 1.800 0.455 9.862 1.00 0.58 C ATOM 3083 CG ASN A 194 2.078 -0.231 11.187 1.00 1.28 C ATOM 3084 OD1 ASN A 194 3.163 -0.770 11.408 1.00 1.80 O ATOM 3085 ND2 ASN A 194 1.112 -0.185 12.091 1.00 2.07 N ATOM 0 H ASN A 194 1.784 2.836 9.343 1.00 0.43 H new ATOM 0 HA ASN A 194 3.846 1.018 10.014 1.00 0.48 H new ATOM 0 HB2 ASN A 194 0.988 1.171 9.989 1.00 0.58 H new ATOM 0 HB3 ASN A 194 1.462 -0.285 9.136 1.00 0.58 H new ATOM 0 HD21 ASN A 194 1.253 -0.606 13.010 1.00 2.07 H new ATOM 0 HD22 ASN A 194 0.227 0.271 11.869 1.00 2.07 H new ATOM 3092 N PHE A 195 2.712 0.983 6.922 1.00 0.44 N ATOM 3093 CA PHE A 195 3.074 0.531 5.581 1.00 0.44 C ATOM 3094 C PHE A 195 4.488 0.980 5.223 1.00 0.36 C ATOM 3095 O PHE A 195 5.179 0.334 4.434 1.00 0.36 O ATOM 3096 CB PHE A 195 2.076 1.032 4.541 1.00 0.47 C ATOM 3097 CG PHE A 195 1.177 -0.054 4.022 1.00 0.73 C ATOM 3098 CD1 PHE A 195 0.092 -0.489 4.768 1.00 1.06 C ATOM 3099 CD2 PHE A 195 1.410 -0.634 2.786 1.00 1.51 C ATOM 3100 CE1 PHE A 195 -0.740 -1.484 4.292 1.00 1.43 C ATOM 3101 CE2 PHE A 195 0.580 -1.630 2.305 1.00 2.00 C ATOM 3102 CZ PHE A 195 -0.478 -2.072 3.065 1.00 1.76 C ATOM 0 H PHE A 195 1.896 1.594 6.961 1.00 0.44 H new ATOM 0 HA PHE A 195 3.045 -0.559 5.579 1.00 0.44 H new ATOM 0 HB2 PHE A 195 1.467 1.822 4.981 1.00 0.47 H new ATOM 0 HB3 PHE A 195 2.620 1.476 3.707 1.00 0.47 H new ATOM 0 HD1 PHE A 195 -0.105 -0.045 5.732 1.00 1.06 H new ATOM 0 HD2 PHE A 195 2.249 -0.305 2.191 1.00 1.51 H new ATOM 0 HE1 PHE A 195 -1.592 -1.802 4.874 1.00 1.43 H new ATOM 0 HE2 PHE A 195 0.763 -2.061 1.332 1.00 2.00 H new ATOM 0 HZ PHE A 195 -1.103 -2.876 2.706 1.00 1.76 H new ATOM 3112 N ILE A 196 4.923 2.080 5.814 1.00 0.31 N ATOM 3113 CA ILE A 196 6.287 2.522 5.651 1.00 0.27 C ATOM 3114 C ILE A 196 7.236 1.734 6.550 1.00 0.28 C ATOM 3115 O ILE A 196 8.390 1.510 6.206 1.00 0.28 O ATOM 3116 CB ILE A 196 6.405 4.018 5.939 1.00 0.25 C ATOM 3117 CG1 ILE A 196 5.718 4.801 4.825 1.00 0.25 C ATOM 3118 CG2 ILE A 196 7.859 4.422 6.098 1.00 0.29 C ATOM 3119 CD1 ILE A 196 5.859 6.289 4.969 1.00 0.26 C ATOM 0 H ILE A 196 4.349 2.678 6.408 1.00 0.31 H new ATOM 0 HA ILE A 196 6.573 2.340 4.615 1.00 0.27 H new ATOM 0 HB ILE A 196 5.907 4.249 6.881 1.00 0.25 H new ATOM 0 HG12 ILE A 196 6.135 4.495 3.865 1.00 0.25 H new ATOM 0 HG13 ILE A 196 4.659 4.543 4.809 1.00 0.25 H new ATOM 0 HG21 ILE A 196 7.919 5.491 6.302 1.00 0.29 H new ATOM 0 HG22 ILE A 196 8.302 3.869 6.926 1.00 0.29 H new ATOM 0 HG23 ILE A 196 8.402 4.197 5.180 1.00 0.29 H new ATOM 0 HD11 ILE A 196 5.347 6.784 4.144 1.00 0.26 H new ATOM 0 HD12 ILE A 196 5.417 6.607 5.913 1.00 0.26 H new ATOM 0 HD13 ILE A 196 6.915 6.557 4.955 1.00 0.26 H new ATOM 3131 N LEU A 197 6.742 1.304 7.693 1.00 0.33 N ATOM 3132 CA LEU A 197 7.522 0.476 8.601 1.00 0.37 C ATOM 3133 C LEU A 197 7.601 -0.930 8.076 1.00 0.36 C ATOM 3134 O LEU A 197 8.554 -1.656 8.342 1.00 0.38 O ATOM 3135 CB LEU A 197 6.897 0.462 9.982 1.00 0.50 C ATOM 3136 CG LEU A 197 6.918 1.796 10.695 1.00 0.52 C ATOM 3137 CD1 LEU A 197 6.182 1.679 12.013 1.00 1.00 C ATOM 3138 CD2 LEU A 197 8.358 2.236 10.888 1.00 1.03 C ATOM 0 H LEU A 197 5.799 1.514 8.020 1.00 0.33 H new ATOM 0 HA LEU A 197 8.525 0.897 8.671 1.00 0.37 H new ATOM 0 HB2 LEU A 197 5.863 0.127 9.896 1.00 0.50 H new ATOM 0 HB3 LEU A 197 7.420 -0.272 10.596 1.00 0.50 H new ATOM 0 HG LEU A 197 6.410 2.554 10.099 1.00 0.52 H new ATOM 0 HD11 LEU A 197 6.198 2.641 12.525 1.00 1.00 H new ATOM 0 HD12 LEU A 197 5.149 1.384 11.828 1.00 1.00 H new ATOM 0 HD13 LEU A 197 6.668 0.928 12.636 1.00 1.00 H new ATOM 0 HD21 LEU A 197 8.379 3.197 11.402 1.00 1.03 H new ATOM 0 HD22 LEU A 197 8.888 1.494 11.485 1.00 1.03 H new ATOM 0 HD23 LEU A 197 8.842 2.333 9.916 1.00 1.03 H new ATOM 3150 N ASN A 198 6.557 -1.315 7.378 1.00 0.38 N ATOM 3151 CA ASN A 198 6.609 -2.466 6.500 1.00 0.43 C ATOM 3152 C ASN A 198 7.860 -2.359 5.667 1.00 0.31 C ATOM 3153 O ASN A 198 8.638 -3.289 5.555 1.00 0.32 O ATOM 3154 CB ASN A 198 5.441 -2.485 5.514 1.00 0.65 C ATOM 3155 CG ASN A 198 4.074 -2.738 6.121 1.00 1.05 C ATOM 3156 OD1 ASN A 198 3.843 -2.527 7.309 1.00 1.90 O ATOM 3157 ND2 ASN A 198 3.141 -3.164 5.285 1.00 1.61 N ATOM 0 H ASN A 198 5.653 -0.844 7.401 1.00 0.38 H new ATOM 0 HA ASN A 198 6.577 -3.361 7.121 1.00 0.43 H new ATOM 0 HB2 ASN A 198 5.415 -1.529 4.991 1.00 0.65 H new ATOM 0 HB3 ASN A 198 5.634 -3.253 4.765 1.00 0.65 H new ATOM 0 HD21 ASN A 198 2.192 -3.328 5.621 1.00 1.61 H new ATOM 0 HD22 ASN A 198 3.371 -3.328 4.305 1.00 1.61 H new ATOM 3164 N ALA A 199 8.063 -1.182 5.118 1.00 0.29 N ATOM 3165 CA ALA A 199 9.123 -0.962 4.183 1.00 0.25 C ATOM 3166 C ALA A 199 10.460 -0.831 4.887 1.00 0.23 C ATOM 3167 O ALA A 199 11.448 -1.420 4.464 1.00 0.26 O ATOM 3168 CB ALA A 199 8.787 0.267 3.395 1.00 0.26 C ATOM 0 H ALA A 199 7.495 -0.358 5.312 1.00 0.29 H new ATOM 0 HA ALA A 199 9.218 -1.816 3.512 1.00 0.25 H new ATOM 0 HB1 ALA A 199 9.578 0.463 2.671 1.00 0.26 H new ATOM 0 HB2 ALA A 199 7.844 0.116 2.870 1.00 0.26 H new ATOM 0 HB3 ALA A 199 8.694 1.118 4.070 1.00 0.26 H new ATOM 3174 N LYS A 200 10.478 -0.062 5.968 1.00 0.26 N ATOM 3175 CA LYS A 200 11.666 0.071 6.803 1.00 0.29 C ATOM 3176 C LYS A 200 12.157 -1.291 7.258 1.00 0.31 C ATOM 3177 O LYS A 200 13.356 -1.566 7.287 1.00 0.36 O ATOM 3178 CB LYS A 200 11.341 0.889 8.043 1.00 0.34 C ATOM 3179 CG LYS A 200 10.963 2.338 7.770 1.00 0.57 C ATOM 3180 CD LYS A 200 12.039 3.053 6.969 1.00 0.54 C ATOM 3181 CE LYS A 200 11.877 4.562 7.037 1.00 0.64 C ATOM 3182 NZ LYS A 200 12.131 5.091 8.405 1.00 0.97 N ATOM 0 H LYS A 200 9.678 0.483 6.289 1.00 0.26 H new ATOM 0 HA LYS A 200 12.436 0.564 6.210 1.00 0.29 H new ATOM 0 HB2 LYS A 200 10.520 0.408 8.574 1.00 0.34 H new ATOM 0 HB3 LYS A 200 12.204 0.872 8.709 1.00 0.34 H new ATOM 0 HG2 LYS A 200 10.019 2.373 7.226 1.00 0.57 H new ATOM 0 HG3 LYS A 200 10.805 2.858 8.715 1.00 0.57 H new ATOM 0 HD2 LYS A 200 13.022 2.775 7.349 1.00 0.54 H new ATOM 0 HD3 LYS A 200 11.996 2.728 5.929 1.00 0.54 H new ATOM 0 HE2 LYS A 200 12.564 5.032 6.334 1.00 0.64 H new ATOM 0 HE3 LYS A 200 10.868 4.832 6.726 1.00 0.64 H new ATOM 0 HZ1 LYS A 200 12.345 6.107 8.350 1.00 0.97 H new ATOM 0 HZ2 LYS A 200 11.287 4.946 8.995 1.00 0.97 H new ATOM 0 HZ3 LYS A 200 12.939 4.590 8.827 1.00 0.97 H new ATOM 3196 N ASP A 201 11.209 -2.129 7.629 1.00 0.30 N ATOM 3197 CA ASP A 201 11.520 -3.432 8.189 1.00 0.33 C ATOM 3198 C ASP A 201 11.755 -4.431 7.080 1.00 0.31 C ATOM 3199 O ASP A 201 12.749 -5.134 7.092 1.00 0.36 O ATOM 3200 CB ASP A 201 10.387 -3.916 9.096 1.00 0.40 C ATOM 3201 CG ASP A 201 10.879 -4.759 10.255 1.00 1.10 C ATOM 3202 OD1 ASP A 201 11.401 -5.864 10.021 1.00 1.94 O ATOM 3203 OD2 ASP A 201 10.747 -4.308 11.414 1.00 1.18 O ATOM 0 H ASP A 201 10.211 -1.930 7.553 1.00 0.30 H new ATOM 0 HA ASP A 201 12.427 -3.341 8.787 1.00 0.33 H new ATOM 0 HB2 ASP A 201 9.846 -3.053 9.485 1.00 0.40 H new ATOM 0 HB3 ASP A 201 9.679 -4.497 8.506 1.00 0.40 H new ATOM 3208 N GLY A 202 10.859 -4.457 6.102 1.00 0.31 N ATOM 3209 CA GLY A 202 10.980 -5.412 5.005 1.00 0.37 C ATOM 3210 C GLY A 202 12.233 -5.195 4.184 1.00 0.37 C ATOM 3211 O GLY A 202 12.781 -6.137 3.614 1.00 0.47 O ATOM 0 H GLY A 202 10.051 -3.838 6.044 1.00 0.31 H new ATOM 0 HA2 GLY A 202 10.984 -6.425 5.408 1.00 0.37 H new ATOM 0 HA3 GLY A 202 10.107 -5.330 4.358 1.00 0.37 H new ATOM 3215 N ILE A 203 12.692 -3.954 4.125 1.00 0.30 N ATOM 3216 CA ILE A 203 13.867 -3.617 3.352 1.00 0.37 C ATOM 3217 C ILE A 203 15.114 -4.198 4.000 1.00 0.47 C ATOM 3218 O ILE A 203 16.006 -4.701 3.315 1.00 0.61 O ATOM 3219 CB ILE A 203 14.012 -2.082 3.161 1.00 0.32 C ATOM 3220 CG1 ILE A 203 14.582 -1.782 1.799 1.00 0.41 C ATOM 3221 CG2 ILE A 203 14.908 -1.443 4.196 1.00 0.38 C ATOM 3222 CD1 ILE A 203 13.630 -2.060 0.684 1.00 0.52 C ATOM 0 H ILE A 203 12.263 -3.164 4.607 1.00 0.30 H new ATOM 0 HA ILE A 203 13.748 -4.058 2.362 1.00 0.37 H new ATOM 0 HB ILE A 203 13.011 -1.665 3.270 1.00 0.32 H new ATOM 0 HG12 ILE A 203 14.879 -0.734 1.760 1.00 0.41 H new ATOM 0 HG13 ILE A 203 15.485 -2.375 1.652 1.00 0.41 H new ATOM 0 HG21 ILE A 203 14.971 -0.371 4.011 1.00 0.38 H new ATOM 0 HG22 ILE A 203 14.496 -1.616 5.190 1.00 0.38 H new ATOM 0 HG23 ILE A 203 15.904 -1.881 4.135 1.00 0.38 H new ATOM 0 HD11 ILE A 203 14.105 -1.822 -0.268 1.00 0.52 H new ATOM 0 HD12 ILE A 203 13.352 -3.114 0.697 1.00 0.52 H new ATOM 0 HD13 ILE A 203 12.737 -1.447 0.807 1.00 0.52 H new ATOM 3234 N LYS A 204 15.163 -4.168 5.326 1.00 0.47 N ATOM 3235 CA LYS A 204 16.282 -4.750 6.028 1.00 0.63 C ATOM 3236 C LYS A 204 15.979 -6.197 6.337 1.00 0.64 C ATOM 3237 O LYS A 204 16.860 -6.955 6.662 1.00 0.78 O ATOM 3238 CB LYS A 204 16.661 -3.974 7.295 1.00 0.74 C ATOM 3239 CG LYS A 204 15.533 -3.729 8.280 1.00 1.21 C ATOM 3240 CD LYS A 204 15.270 -4.970 9.091 1.00 1.55 C ATOM 3241 CE LYS A 204 14.379 -4.706 10.287 1.00 2.41 C ATOM 3242 NZ LYS A 204 13.897 -5.974 10.893 1.00 3.37 N ATOM 0 H LYS A 204 14.448 -3.752 5.923 1.00 0.47 H new ATOM 0 HA LYS A 204 17.154 -4.692 5.376 1.00 0.63 H new ATOM 0 HB2 LYS A 204 17.455 -4.518 7.808 1.00 0.74 H new ATOM 0 HB3 LYS A 204 17.075 -3.010 6.998 1.00 0.74 H new ATOM 0 HG2 LYS A 204 15.792 -2.902 8.941 1.00 1.21 H new ATOM 0 HG3 LYS A 204 14.630 -3.438 7.744 1.00 1.21 H new ATOM 0 HD2 LYS A 204 14.805 -5.723 8.455 1.00 1.55 H new ATOM 0 HD3 LYS A 204 16.219 -5.384 9.433 1.00 1.55 H new ATOM 0 HE2 LYS A 204 14.928 -4.130 11.032 1.00 2.41 H new ATOM 0 HE3 LYS A 204 13.526 -4.100 9.981 1.00 2.41 H new ATOM 0 HZ1 LYS A 204 14.005 -5.928 11.926 1.00 3.37 H new ATOM 0 HZ2 LYS A 204 12.894 -6.113 10.655 1.00 3.37 H new ATOM 0 HZ3 LYS A 204 14.454 -6.770 10.522 1.00 3.37 H new ATOM 3256 N ALA A 205 14.715 -6.562 6.261 1.00 0.57 N ATOM 3257 CA ALA A 205 14.331 -7.958 6.297 1.00 0.69 C ATOM 3258 C ALA A 205 14.820 -8.642 5.034 1.00 0.87 C ATOM 3259 O ALA A 205 15.026 -9.855 5.004 1.00 1.02 O ATOM 3260 CB ALA A 205 12.826 -8.090 6.419 1.00 0.68 C ATOM 0 H ALA A 205 13.936 -5.910 6.174 1.00 0.57 H new ATOM 0 HA ALA A 205 14.785 -8.435 7.166 1.00 0.69 H new ATOM 0 HB1 ALA A 205 12.554 -9.145 6.445 1.00 0.68 H new ATOM 0 HB2 ALA A 205 12.492 -7.607 7.337 1.00 0.68 H new ATOM 0 HB3 ALA A 205 12.348 -7.613 5.563 1.00 0.68 H new ATOM 3266 N HIS A 206 14.964 -7.850 3.976 1.00 0.89 N ATOM 3267 CA HIS A 206 15.542 -8.347 2.730 1.00 1.11 C ATOM 3268 C HIS A 206 17.073 -8.338 2.736 1.00 1.21 C ATOM 3269 O HIS A 206 17.692 -9.302 2.291 1.00 1.52 O ATOM 3270 CB HIS A 206 15.002 -7.564 1.532 1.00 1.29 C ATOM 3271 CG HIS A 206 13.721 -8.139 1.015 1.00 2.13 C ATOM 3272 ND1 HIS A 206 13.513 -8.489 -0.302 1.00 2.83 N ATOM 3273 CD2 HIS A 206 12.591 -8.477 1.669 1.00 2.92 C ATOM 3274 CE1 HIS A 206 12.315 -9.020 -0.427 1.00 3.56 C ATOM 3275 NE2 HIS A 206 11.731 -9.027 0.756 1.00 3.63 N ATOM 0 H HIS A 206 14.691 -6.868 3.955 1.00 0.89 H new ATOM 0 HA HIS A 206 15.237 -9.390 2.640 1.00 1.11 H new ATOM 0 HB2 HIS A 206 14.842 -6.525 1.821 1.00 1.29 H new ATOM 0 HB3 HIS A 206 15.746 -7.563 0.735 1.00 1.29 H new ATOM 0 HD1 HIS A 206 14.182 -8.357 -1.060 1.00 2.83 H new ATOM 0 HD2 HIS A 206 12.399 -8.339 2.723 1.00 2.92 H new ATOM 0 HE1 HIS A 206 11.882 -9.389 -1.345 1.00 3.56 H new ATOM 0 HE2 HIS A 206 10.796 -9.382 0.957 1.00 3.63 H new ATOM 3284 N ARG A 207 17.695 -7.274 3.235 1.00 1.11 N ATOM 3285 CA ARG A 207 19.160 -7.190 3.199 1.00 1.23 C ATOM 3286 C ARG A 207 19.778 -7.831 4.440 1.00 1.36 C ATOM 3287 O ARG A 207 20.783 -8.535 4.366 1.00 1.67 O ATOM 3288 CB ARG A 207 19.623 -5.737 3.062 1.00 1.20 C ATOM 3289 CG ARG A 207 19.152 -4.828 4.179 1.00 1.41 C ATOM 3290 CD ARG A 207 19.801 -3.461 4.082 1.00 1.49 C ATOM 3291 NE ARG A 207 19.291 -2.523 5.085 1.00 1.73 N ATOM 3292 CZ ARG A 207 18.932 -1.264 4.815 1.00 2.04 C ATOM 3293 NH1 ARG A 207 18.918 -0.823 3.563 1.00 2.47 N ATOM 3294 NH2 ARG A 207 18.557 -0.451 5.798 1.00 2.59 N ATOM 0 H ARG A 207 17.226 -6.474 3.660 1.00 1.11 H new ATOM 0 HA ARG A 207 19.501 -7.743 2.324 1.00 1.23 H new ATOM 0 HB2 ARG A 207 20.712 -5.716 3.026 1.00 1.20 H new ATOM 0 HB3 ARG A 207 19.265 -5.341 2.111 1.00 1.20 H new ATOM 0 HG2 ARG A 207 18.068 -4.723 4.134 1.00 1.41 H new ATOM 0 HG3 ARG A 207 19.389 -5.279 5.143 1.00 1.41 H new ATOM 0 HD2 ARG A 207 20.879 -3.565 4.203 1.00 1.49 H new ATOM 0 HD3 ARG A 207 19.630 -3.051 3.087 1.00 1.49 H new ATOM 0 HE ARG A 207 19.205 -2.850 6.047 1.00 1.73 H new ATOM 0 HH11 ARG A 207 19.182 -1.446 2.800 1.00 2.47 H new ATOM 0 HH12 ARG A 207 18.643 0.139 3.364 1.00 2.47 H new ATOM 0 HH21 ARG A 207 18.543 -0.788 6.761 1.00 2.59 H new ATOM 0 HH22 ARG A 207 18.284 0.509 5.589 1.00 2.59 H new ATOM 3308 N THR A 208 19.151 -7.584 5.564 1.00 1.20 N ATOM 3309 CA THR A 208 19.588 -8.076 6.853 1.00 1.41 C ATOM 3310 C THR A 208 18.734 -9.291 7.241 1.00 1.48 C ATOM 3311 O THR A 208 17.651 -9.474 6.682 1.00 1.35 O ATOM 3312 CB THR A 208 19.429 -6.919 7.877 1.00 1.37 C ATOM 3313 OG1 THR A 208 20.266 -5.819 7.488 1.00 1.84 O ATOM 3314 CG2 THR A 208 19.751 -7.318 9.304 1.00 1.53 C ATOM 0 H THR A 208 18.301 -7.022 5.612 1.00 1.20 H new ATOM 0 HA THR A 208 20.630 -8.394 6.830 1.00 1.41 H new ATOM 0 HB THR A 208 18.377 -6.635 7.864 1.00 1.37 H new ATOM 0 HG1 THR A 208 20.165 -5.088 8.132 1.00 1.84 H new ATOM 0 HG21 THR A 208 19.617 -6.459 9.961 1.00 1.53 H new ATOM 0 HG22 THR A 208 19.084 -8.121 9.617 1.00 1.53 H new ATOM 0 HG23 THR A 208 20.784 -7.662 9.362 1.00 1.53 H new ATOM 3322 N PRO A 209 19.209 -10.187 8.119 1.00 1.78 N ATOM 3323 CA PRO A 209 18.331 -11.181 8.727 1.00 1.95 C ATOM 3324 C PRO A 209 17.199 -10.494 9.500 1.00 1.87 C ATOM 3325 O PRO A 209 16.175 -10.135 8.914 1.00 2.12 O ATOM 3326 CB PRO A 209 19.253 -11.975 9.664 1.00 2.33 C ATOM 3327 CG PRO A 209 20.493 -11.151 9.800 1.00 2.35 C ATOM 3328 CD PRO A 209 20.610 -10.351 8.534 1.00 2.03 C ATOM 0 HA PRO A 209 17.844 -11.824 7.994 1.00 1.95 H new ATOM 0 HB2 PRO A 209 18.782 -12.137 10.633 1.00 2.33 H new ATOM 0 HB3 PRO A 209 19.479 -12.958 9.251 1.00 2.33 H new ATOM 0 HG2 PRO A 209 20.431 -10.496 10.669 1.00 2.35 H new ATOM 0 HG3 PRO A 209 21.368 -11.786 9.941 1.00 2.35 H new ATOM 0 HD2 PRO A 209 21.095 -9.390 8.706 1.00 2.03 H new ATOM 0 HD3 PRO A 209 21.197 -10.874 7.779 1.00 2.03 H new ATOM 3336 N SER A 210 17.402 -10.291 10.801 1.00 1.76 N ATOM 3337 CA SER A 210 16.490 -9.515 11.651 1.00 1.78 C ATOM 3338 C SER A 210 15.019 -9.928 11.504 1.00 1.74 C ATOM 3339 O SER A 210 14.114 -9.135 11.764 1.00 2.01 O ATOM 3340 CB SER A 210 16.650 -8.014 11.376 1.00 1.85 C ATOM 3341 OG SER A 210 16.291 -7.682 10.043 1.00 2.31 O ATOM 0 H SER A 210 18.209 -10.662 11.302 1.00 1.76 H new ATOM 0 HA SER A 210 16.771 -9.733 12.681 1.00 1.78 H new ATOM 0 HB2 SER A 210 16.029 -7.449 12.071 1.00 1.85 H new ATOM 0 HB3 SER A 210 17.683 -7.719 11.559 1.00 1.85 H new ATOM 0 HG SER A 210 16.075 -8.500 9.549 1.00 2.31 H new ATOM 3347 N ARG A 211 14.780 -11.170 11.106 1.00 1.75 N ATOM 3348 CA ARG A 211 13.424 -11.696 11.037 1.00 1.94 C ATOM 3349 C ARG A 211 13.137 -12.467 12.311 1.00 2.32 C ATOM 3350 O ARG A 211 12.338 -13.401 12.335 1.00 2.55 O ATOM 3351 CB ARG A 211 13.231 -12.582 9.800 1.00 2.31 C ATOM 3352 CG ARG A 211 13.390 -11.830 8.484 1.00 2.60 C ATOM 3353 CD ARG A 211 12.970 -12.681 7.295 1.00 3.06 C ATOM 3354 NE ARG A 211 13.154 -11.980 6.022 1.00 3.80 N ATOM 3355 CZ ARG A 211 12.324 -12.082 4.980 1.00 4.56 C ATOM 3356 NH1 ARG A 211 11.240 -12.846 5.048 1.00 4.78 N ATOM 3357 NH2 ARG A 211 12.581 -11.415 3.861 1.00 5.45 N ATOM 0 H ARG A 211 15.505 -11.830 10.827 1.00 1.75 H new ATOM 0 HA ARG A 211 12.721 -10.869 10.945 1.00 1.94 H new ATOM 0 HB2 ARG A 211 13.952 -13.399 9.832 1.00 2.31 H new ATOM 0 HB3 ARG A 211 12.238 -13.031 9.835 1.00 2.31 H new ATOM 0 HG2 ARG A 211 12.790 -10.920 8.510 1.00 2.60 H new ATOM 0 HG3 ARG A 211 14.429 -11.524 8.363 1.00 2.60 H new ATOM 0 HD2 ARG A 211 13.550 -13.604 7.287 1.00 3.06 H new ATOM 0 HD3 ARG A 211 11.923 -12.964 7.404 1.00 3.06 H new ATOM 0 HE ARG A 211 13.969 -11.374 5.925 1.00 3.80 H new ATOM 0 HH11 ARG A 211 11.033 -13.363 5.903 1.00 4.78 H new ATOM 0 HH12 ARG A 211 10.614 -12.916 4.246 1.00 4.78 H new ATOM 0 HH21 ARG A 211 13.411 -10.826 3.798 1.00 5.45 H new ATOM 0 HH22 ARG A 211 11.948 -11.492 3.065 1.00 5.45 H new ATOM 3371 N ARG A 212 13.821 -12.057 13.374 1.00 2.62 N ATOM 3372 CA ARG A 212 13.622 -12.629 14.701 1.00 3.26 C ATOM 3373 C ARG A 212 12.211 -12.324 15.199 1.00 3.32 C ATOM 3374 O ARG A 212 11.657 -13.052 16.018 1.00 3.71 O ATOM 3375 CB ARG A 212 14.668 -12.074 15.677 1.00 3.80 C ATOM 3376 CG ARG A 212 14.585 -10.568 15.868 1.00 4.37 C ATOM 3377 CD ARG A 212 15.755 -10.032 16.675 1.00 4.99 C ATOM 3378 NE ARG A 212 15.862 -10.663 17.987 1.00 5.44 N ATOM 3379 CZ ARG A 212 16.196 -10.015 19.099 1.00 6.24 C ATOM 3380 NH1 ARG A 212 16.434 -8.709 19.074 1.00 6.66 N ATOM 3381 NH2 ARG A 212 16.294 -10.679 20.235 1.00 6.86 N ATOM 0 H ARG A 212 14.527 -11.321 13.340 1.00 2.62 H new ATOM 0 HA ARG A 212 13.742 -13.711 14.642 1.00 3.26 H new ATOM 0 HB2 ARG A 212 14.545 -12.562 16.644 1.00 3.80 H new ATOM 0 HB3 ARG A 212 15.663 -12.331 15.315 1.00 3.80 H new ATOM 0 HG2 ARG A 212 14.562 -10.080 14.894 1.00 4.37 H new ATOM 0 HG3 ARG A 212 13.652 -10.317 16.372 1.00 4.37 H new ATOM 0 HD2 ARG A 212 16.680 -10.194 16.121 1.00 4.99 H new ATOM 0 HD3 ARG A 212 15.643 -8.955 16.801 1.00 4.99 H new ATOM 0 HE ARG A 212 15.669 -11.662 18.055 1.00 5.44 H new ATOM 0 HH11 ARG A 212 16.361 -8.194 18.197 1.00 6.66 H new ATOM 0 HH12 ARG A 212 16.690 -8.221 19.932 1.00 6.66 H new ATOM 0 HH21 ARG A 212 16.114 -11.683 20.256 1.00 6.86 H new ATOM 0 HH22 ARG A 212 16.550 -10.189 21.092 1.00 6.86 H new ATOM 3395 N GLY A 213 11.642 -11.239 14.687 1.00 3.12 N ATOM 3396 CA GLY A 213 10.283 -10.878 15.023 1.00 3.37 C ATOM 3397 C GLY A 213 9.360 -11.016 13.831 1.00 2.92 C ATOM 3398 O GLY A 213 8.456 -10.202 13.641 1.00 3.19 O ATOM 0 H GLY A 213 12.104 -10.600 14.040 1.00 3.12 H new ATOM 0 HA2 GLY A 213 9.927 -11.512 15.835 1.00 3.37 H new ATOM 0 HA3 GLY A 213 10.258 -9.851 15.387 1.00 3.37 H new ATOM 3402 N PHE A 214 9.609 -12.046 13.019 1.00 2.56 N ATOM 3403 CA PHE A 214 8.789 -12.320 11.843 1.00 2.44 C ATOM 3404 C PHE A 214 7.321 -12.458 12.252 1.00 2.70 C ATOM 3405 O PHE A 214 7.010 -13.063 13.278 1.00 3.00 O ATOM 3406 CB PHE A 214 9.274 -13.590 11.124 1.00 2.65 C ATOM 3407 CG PHE A 214 9.103 -14.861 11.913 1.00 3.21 C ATOM 3408 CD1 PHE A 214 9.833 -15.088 13.069 1.00 3.82 C ATOM 3409 CD2 PHE A 214 8.207 -15.830 11.491 1.00 3.73 C ATOM 3410 CE1 PHE A 214 9.670 -16.255 13.790 1.00 4.85 C ATOM 3411 CE2 PHE A 214 8.039 -16.996 12.210 1.00 4.67 C ATOM 3412 CZ PHE A 214 8.772 -17.210 13.360 1.00 5.21 C ATOM 0 H PHE A 214 10.375 -12.705 13.158 1.00 2.56 H new ATOM 0 HA PHE A 214 8.883 -11.485 11.149 1.00 2.44 H new ATOM 0 HB2 PHE A 214 8.734 -13.687 10.182 1.00 2.65 H new ATOM 0 HB3 PHE A 214 10.329 -13.471 10.876 1.00 2.65 H new ATOM 0 HD1 PHE A 214 10.537 -14.344 13.410 1.00 3.82 H new ATOM 0 HD2 PHE A 214 7.634 -15.671 10.590 1.00 3.73 H new ATOM 0 HE1 PHE A 214 10.245 -16.420 14.689 1.00 4.85 H new ATOM 0 HE2 PHE A 214 7.334 -17.741 11.873 1.00 4.67 H new ATOM 0 HZ PHE A 214 8.643 -18.123 13.922 1.00 5.21 H new ATOM 3422 N HIS A 215 6.424 -11.892 11.461 1.00 2.97 N ATOM 3423 CA HIS A 215 5.030 -11.804 11.870 1.00 3.39 C ATOM 3424 C HIS A 215 4.141 -12.818 11.145 1.00 3.17 C ATOM 3425 O HIS A 215 2.969 -12.977 11.494 1.00 3.66 O ATOM 3426 CB HIS A 215 4.518 -10.376 11.659 1.00 4.23 C ATOM 3427 CG HIS A 215 3.151 -10.133 12.228 1.00 4.93 C ATOM 3428 ND1 HIS A 215 2.083 -9.722 11.465 1.00 5.70 N ATOM 3429 CD2 HIS A 215 2.686 -10.249 13.494 1.00 5.40 C ATOM 3430 CE1 HIS A 215 1.018 -9.599 12.233 1.00 6.46 C ATOM 3431 NE2 HIS A 215 1.353 -9.914 13.471 1.00 6.32 N ATOM 0 H HIS A 215 6.630 -11.492 10.546 1.00 2.97 H new ATOM 0 HA HIS A 215 4.979 -12.053 12.930 1.00 3.39 H new ATOM 0 HB2 HIS A 215 5.220 -9.677 12.114 1.00 4.23 H new ATOM 0 HB3 HIS A 215 4.500 -10.160 10.591 1.00 4.23 H new ATOM 0 HD1 HIS A 215 2.110 -9.541 10.462 1.00 5.70 H new ATOM 0 HD2 HIS A 215 3.256 -10.549 14.361 1.00 5.40 H new ATOM 0 HE1 HIS A 215 0.036 -9.292 11.904 1.00 6.46 H new ATOM 3440 N HIS A 216 4.682 -13.521 10.154 1.00 2.99 N ATOM 3441 CA HIS A 216 3.911 -14.559 9.471 1.00 3.27 C ATOM 3442 C HIS A 216 3.904 -15.825 10.321 1.00 3.26 C ATOM 3443 O HIS A 216 4.388 -16.881 9.915 1.00 3.78 O ATOM 3444 CB HIS A 216 4.476 -14.855 8.082 1.00 3.92 C ATOM 3445 CG HIS A 216 3.559 -15.667 7.217 1.00 4.66 C ATOM 3446 ND1 HIS A 216 3.832 -16.964 6.845 1.00 5.31 N ATOM 3447 CD2 HIS A 216 2.373 -15.355 6.639 1.00 5.27 C ATOM 3448 CE1 HIS A 216 2.861 -17.414 6.074 1.00 6.09 C ATOM 3449 NE2 HIS A 216 1.963 -16.458 5.936 1.00 6.09 N ATOM 0 H HIS A 216 5.634 -13.396 9.809 1.00 2.99 H new ATOM 0 HA HIS A 216 2.890 -14.200 9.339 1.00 3.27 H new ATOM 0 HB2 HIS A 216 4.694 -13.912 7.580 1.00 3.92 H new ATOM 0 HB3 HIS A 216 5.422 -15.385 8.190 1.00 3.92 H new ATOM 0 HD2 HIS A 216 1.849 -14.414 6.718 1.00 5.27 H new ATOM 0 HE1 HIS A 216 2.810 -18.398 5.631 1.00 6.09 H new ATOM 0 HE2 HIS A 216 1.102 -16.528 5.394 1.00 6.09 H new ATOM 3458 N ASN A 217 3.362 -15.688 11.513 1.00 3.18 N ATOM 3459 CA ASN A 217 3.332 -16.762 12.490 1.00 3.63 C ATOM 3460 C ASN A 217 2.250 -16.453 13.514 1.00 4.03 C ATOM 3461 O ASN A 217 2.494 -16.412 14.718 1.00 4.27 O ATOM 3462 CB ASN A 217 4.702 -16.888 13.166 1.00 3.95 C ATOM 3463 CG ASN A 217 4.948 -18.260 13.764 1.00 4.57 C ATOM 3464 OD1 ASN A 217 4.673 -18.507 14.938 1.00 5.00 O ATOM 3465 ND2 ASN A 217 5.480 -19.161 12.952 1.00 5.12 N ATOM 0 H ASN A 217 2.927 -14.824 11.836 1.00 3.18 H new ATOM 0 HA ASN A 217 3.108 -17.711 12.003 1.00 3.63 H new ATOM 0 HB2 ASN A 217 5.482 -16.672 12.436 1.00 3.95 H new ATOM 0 HB3 ASN A 217 4.783 -16.136 13.951 1.00 3.95 H new ATOM 0 HD21 ASN A 217 5.677 -20.102 13.293 1.00 5.12 H new ATOM 0 HD22 ASN A 217 5.693 -18.914 11.985 1.00 5.12 H new ATOM 3472 N SER A 218 1.051 -16.202 13.007 1.00 4.58 N ATOM 3473 CA SER A 218 -0.069 -15.793 13.840 1.00 5.38 C ATOM 3474 C SER A 218 -0.860 -17.011 14.307 1.00 5.75 C ATOM 3475 O SER A 218 -1.865 -16.888 15.008 1.00 6.25 O ATOM 3476 CB SER A 218 -0.967 -14.842 13.050 1.00 6.28 C ATOM 3477 OG SER A 218 -0.197 -13.819 12.434 1.00 6.76 O ATOM 0 H SER A 218 0.829 -16.276 12.014 1.00 4.58 H new ATOM 0 HA SER A 218 0.310 -15.278 14.723 1.00 5.38 H new ATOM 0 HB2 SER A 218 -1.515 -15.399 12.290 1.00 6.28 H new ATOM 0 HB3 SER A 218 -1.707 -14.397 13.715 1.00 6.28 H new ATOM 0 HG SER A 218 -0.675 -12.966 12.498 1.00 6.76 H new ATOM 3483 N HIS A 219 -0.401 -18.186 13.904 1.00 5.79 N ATOM 3484 CA HIS A 219 -1.031 -19.439 14.286 1.00 6.41 C ATOM 3485 C HIS A 219 0.026 -20.483 14.604 1.00 6.51 C ATOM 3486 O HIS A 219 1.012 -20.614 13.876 1.00 6.61 O ATOM 3487 CB HIS A 219 -1.956 -19.954 13.178 1.00 7.04 C ATOM 3488 CG HIS A 219 -3.341 -19.384 13.231 1.00 7.61 C ATOM 3489 ND1 HIS A 219 -4.399 -20.050 13.808 1.00 8.17 N ATOM 3490 CD2 HIS A 219 -3.844 -18.208 12.780 1.00 8.02 C ATOM 3491 CE1 HIS A 219 -5.489 -19.312 13.711 1.00 8.82 C ATOM 3492 NE2 HIS A 219 -5.182 -18.188 13.093 1.00 8.76 N ATOM 0 H HIS A 219 0.417 -18.297 13.304 1.00 5.79 H new ATOM 0 HA HIS A 219 -1.633 -19.254 15.176 1.00 6.41 H new ATOM 0 HB2 HIS A 219 -1.513 -19.719 12.210 1.00 7.04 H new ATOM 0 HB3 HIS A 219 -2.018 -21.040 13.245 1.00 7.04 H new ATOM 0 HD2 HIS A 219 -3.295 -17.431 12.269 1.00 8.02 H new ATOM 0 HE1 HIS A 219 -6.468 -19.583 14.077 1.00 8.82 H new ATOM 0 HE2 HIS A 219 -5.830 -17.429 12.882 1.00 8.76 H new ATOM 3501 N SER A 220 -0.194 -21.211 15.696 1.00 6.83 N ATOM 3502 CA SER A 220 0.716 -22.256 16.147 1.00 7.31 C ATOM 3503 C SER A 220 2.071 -21.665 16.545 1.00 7.98 C ATOM 3504 O SER A 220 2.105 -20.832 17.478 1.00 8.48 O ATOM 3505 CB SER A 220 0.884 -23.316 15.056 1.00 7.71 C ATOM 3506 OG SER A 220 -0.376 -23.828 14.642 1.00 7.85 O ATOM 3507 OXT SER A 220 3.098 -22.059 15.952 1.00 8.25 O ATOM 0 H SER A 220 -1.012 -21.091 16.294 1.00 6.83 H new ATOM 0 HA SER A 220 0.287 -22.731 17.029 1.00 7.31 H new ATOM 0 HB2 SER A 220 1.403 -22.883 14.201 1.00 7.71 H new ATOM 0 HB3 SER A 220 1.506 -24.130 15.428 1.00 7.71 H new ATOM 0 HG SER A 220 -0.242 -24.502 13.943 1.00 7.85 H new TER 3513 SER A 220