USER MOD reduce.3.24.130724 H: found=0, std=0, add=1063, rem=0, adj=40 USER MOD reduce.3.24.130724 removed 1066 hydrogens (3 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 97 MET CE :methyl 154:sc= -1.04 (180deg=-0.0254) USER MOD Set 1.2: A 100 GLN : amide:sc= -7.11! K(o=-8.1!,f=-3.8) USER MOD Set 2.1: A 86 ASN : amide:sc= -0.485 K(o=-0.44,f=-1.6) USER MOD Set 2.2: A 112 LYS NZ :NH3+ -128:sc= 0.0432 (180deg=0) USER MOD Set 3.1: A 57 ASN : amide:sc= -1.06! C(o=-2!,f=-13!) USER MOD Set 3.2: A 62 SER OG : rot 51:sc= 0.83 USER MOD Set 3.3: A 64 ASN : amide:sc= -1.72 K(o=-2,f=-10!) USER MOD Set 4.1: A 31 ASN : amide:sc= -4.44! C(o=-3.1!,f=-12!) USER MOD Set 4.2: A 34 LYS NZ :NH3+ -116:sc= 1.32 (180deg=0.458) USER MOD Set 5.1: A 32 SER OG : rot 83:sc= 0.839 USER MOD Set 5.2: A 55 SER OG : rot 57:sc= 1.17 USER MOD Set 6.1: A 28 SER OG : rot 180:sc= 0 USER MOD Set 6.2: A 29 SER OG : rot 51:sc= -0.387 USER MOD Single : A 30 SER OG : rot 180:sc= 0.0236 USER MOD Single : A 37 HIS : no HD1:sc= -0.153 X(o=-0.15,f=-0.00022) USER MOD Single : A 42 SER OG : rot 180:sc= -0.0117 USER MOD Single : A 43 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 45 TYR OH : rot 89:sc= 0.689 USER MOD Single : A 47 SER OG : rot 180:sc= 0 USER MOD Single : A 50 ASN : amide:sc= -0.0134 K(o=-0.013,f=-1) USER MOD Single : A 58 THR OG1 : rot 87:sc= 1.3 USER MOD Single : A 59 THR OG1 : rot 180:sc= -1.7! USER MOD Single : A 60 ASN : amide:sc= -0.0084 K(o=-0.0084,f=-0.92) USER MOD Single : A 61 LYS NZ :NH3+ 177:sc= 0.855 (180deg=0.798) USER MOD Single : A 66 TYR OH : rot 180:sc= 0 USER MOD Single : A 67 SER OG : rot -170:sc= -3.02! USER MOD Single : A 68 LYS NZ :NH3+ -144:sc= 1 (180deg=-0.0511) USER MOD Single : A 71 SER OG : rot 180:sc= 0 USER MOD Single : A 73 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 76 TYR OH : rot 60:sc= -0.228 USER MOD Single : A 77 SER OG : rot 180:sc= 0 USER MOD Single : A 79 ASN : amide:sc=-0.00993 K(o=-0.0099,f=-0.95) USER MOD Single : A 82 LYS NZ :NH3+ -120:sc= -0.472 (180deg=-3.47!) USER MOD Single : A 84 MET CE :methyl 148:sc= -0.012 (180deg=-1.53) USER MOD Single : A 88 ASN : amide:sc= 0 K(o=0,f=-3.3!) USER MOD Single : A 90 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 101 LYS NZ :NH3+ -163:sc= 1.13 (180deg=0.801) USER MOD Single : A 106 LYS NZ :NH3+ -109:sc= 1.49 (180deg=-0.123) USER MOD Single : A 109 SER OG : rot 180:sc= 0 USER MOD Single : A 110 MET CE :methyl -172:sc= -7.33! (180deg=-7.65!) USER MOD Single : A 118 LYS NZ :NH3+ -173:sc= 0 (180deg=-0.055) USER MOD Single : A 120 ASN : amide:sc= -0.071 K(o=-0.071,f=-2.8!) USER MOD Single : A 121 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 123 ASN : amide:sc= -0.0101 X(o=-0.01,f=-0.31) USER MOD Single : A 125 THR OG1 : rot 180:sc= -0.123 USER MOD Single : A 130 LYS NZ :NH3+ -153:sc= 1.11 (180deg=-0.265!) USER MOD Single : A 135 LYS NZ :NH3+ 138:sc= 2.35 (180deg=-1.16) USER MOD Single : A 137 LYS NZ :NH3+ -159:sc= 0.891 (180deg=0.545) USER MOD Single : B 553 SER OG : rot -9:sc= 0.914 USER MOD Single : B 555 THR OG1 : rot 20:sc= 1.03 USER MOD Single : B 556 THR OG1 : rot -89:sc= 0.491 USER MOD Single : B 562 LYS NZ :NH3+ -168:sc= -0.0315 (180deg=-0.172) USER MOD Single : B 563 SER OG : rot 180:sc= 0 USER MOD Single : B 566 SER OG : rot 96:sc= 1.21 USER MOD Single : B 567 TYR OH : rot 30:sc= 0 USER MOD Single : B 569 ASN : amide:sc= -5.59! K(o=-5.6!,f=-2.3) USER MOD Single : B 570 TYR OH : rot -18:sc= 0.348 USER MOD ----------------------------------------------------------------- ATOM 1 N SER A 28 -14.801 13.323 7.236 1.00 2.50 N ATOM 2 CA SER A 28 -14.779 11.947 6.695 1.00 2.12 C ATOM 3 C SER A 28 -13.419 11.297 6.911 1.00 1.79 C ATOM 4 O SER A 28 -12.437 11.658 6.260 1.00 2.43 O ATOM 5 CB SER A 28 -15.123 11.965 5.197 1.00 3.05 C ATOM 6 OG SER A 28 -15.161 10.653 4.647 1.00 3.51 O ATOM 0 HA SER A 28 -15.526 11.359 7.228 1.00 2.12 H new ATOM 0 HB2 SER A 28 -16.089 12.448 5.052 1.00 3.05 H new ATOM 0 HB3 SER A 28 -14.385 12.562 4.662 1.00 3.05 H new ATOM 0 HG SER A 28 -15.384 10.704 3.694 1.00 3.51 H new ATOM 14 N SER A 29 -13.372 10.357 7.858 1.00 1.34 N ATOM 15 CA SER A 29 -12.211 9.488 8.082 1.00 1.18 C ATOM 16 C SER A 29 -10.891 10.253 8.220 1.00 1.01 C ATOM 17 O SER A 29 -9.844 9.777 7.778 1.00 1.64 O ATOM 18 CB SER A 29 -12.100 8.442 6.965 1.00 1.37 C ATOM 19 OG SER A 29 -12.129 9.038 5.675 1.00 2.03 O ATOM 0 H SER A 29 -14.145 10.175 8.498 1.00 1.34 H new ATOM 0 HA SER A 29 -12.384 8.993 9.037 1.00 1.18 H new ATOM 0 HB2 SER A 29 -11.173 7.880 7.085 1.00 1.37 H new ATOM 0 HB3 SER A 29 -12.919 7.728 7.053 1.00 1.37 H new ATOM 0 HG SER A 29 -11.468 9.760 5.633 1.00 2.03 H new ATOM 25 N SER A 30 -10.931 11.416 8.849 1.00 0.99 N ATOM 26 CA SER A 30 -9.728 12.211 9.039 1.00 0.94 C ATOM 27 C SER A 30 -8.961 11.763 10.284 1.00 1.16 C ATOM 28 O SER A 30 -8.858 12.491 11.271 1.00 1.79 O ATOM 29 CB SER A 30 -10.082 13.695 9.110 1.00 1.26 C ATOM 30 OG SER A 30 -11.217 13.928 9.931 1.00 1.64 O ATOM 0 H SER A 30 -11.779 11.830 9.235 1.00 0.99 H new ATOM 0 HA SER A 30 -9.073 12.056 8.182 1.00 0.94 H new ATOM 0 HB2 SER A 30 -9.231 14.253 9.500 1.00 1.26 H new ATOM 0 HB3 SER A 30 -10.277 14.071 8.105 1.00 1.26 H new ATOM 0 HG SER A 30 -11.413 14.888 9.954 1.00 1.64 H new ATOM 36 N ASN A 31 -8.427 10.550 10.223 1.00 1.04 N ATOM 37 CA ASN A 31 -7.615 10.005 11.303 1.00 1.33 C ATOM 38 C ASN A 31 -6.648 8.958 10.756 1.00 1.42 C ATOM 39 O ASN A 31 -6.715 7.779 11.096 1.00 2.38 O ATOM 40 CB ASN A 31 -8.493 9.422 12.433 1.00 1.72 C ATOM 41 CG ASN A 31 -9.470 8.350 11.971 1.00 2.16 C ATOM 42 OD1 ASN A 31 -9.154 7.160 11.968 1.00 2.49 O ATOM 43 ND2 ASN A 31 -10.675 8.759 11.605 1.00 2.79 N ATOM 0 H ASN A 31 -8.543 9.920 9.429 1.00 1.04 H new ATOM 0 HA ASN A 31 -7.034 10.818 11.738 1.00 1.33 H new ATOM 0 HB2 ASN A 31 -7.845 9.001 13.201 1.00 1.72 H new ATOM 0 HB3 ASN A 31 -9.053 10.233 12.898 1.00 1.72 H new ATOM 0 HD21 ASN A 31 -11.376 8.080 11.308 1.00 2.79 H new ATOM 0 HD22 ASN A 31 -10.902 9.753 11.620 1.00 2.79 H new ATOM 50 N SER A 32 -5.741 9.401 9.893 1.00 0.84 N ATOM 51 CA SER A 32 -4.768 8.503 9.290 1.00 0.94 C ATOM 52 C SER A 32 -3.606 8.229 10.263 1.00 0.96 C ATOM 53 O SER A 32 -3.827 7.938 11.442 1.00 1.46 O ATOM 54 CB SER A 32 -4.254 9.089 7.970 1.00 1.10 C ATOM 55 OG SER A 32 -3.312 8.236 7.343 1.00 1.41 O ATOM 0 H SER A 32 -5.660 10.374 9.597 1.00 0.84 H new ATOM 0 HA SER A 32 -5.255 7.552 9.076 1.00 0.94 H new ATOM 0 HB2 SER A 32 -5.094 9.259 7.297 1.00 1.10 H new ATOM 0 HB3 SER A 32 -3.795 10.060 8.158 1.00 1.10 H new ATOM 0 HG SER A 32 -3.785 7.541 6.839 1.00 1.41 H new ATOM 61 N GLU A 33 -2.376 8.337 9.754 1.00 0.85 N ATOM 62 CA GLU A 33 -1.167 8.002 10.468 1.00 0.86 C ATOM 63 C GLU A 33 -1.171 6.543 10.915 1.00 0.72 C ATOM 64 O GLU A 33 -0.466 6.151 11.844 1.00 0.83 O ATOM 65 CB GLU A 33 -0.970 8.949 11.624 1.00 1.05 C ATOM 66 CG GLU A 33 -0.673 10.375 11.191 1.00 1.38 C ATOM 67 CD GLU A 33 -0.223 11.249 12.336 1.00 1.93 C ATOM 68 OE1 GLU A 33 -0.965 11.354 13.333 1.00 2.24 O ATOM 69 OE2 GLU A 33 0.884 11.823 12.257 1.00 2.56 O ATOM 0 H GLU A 33 -2.202 8.671 8.806 1.00 0.85 H new ATOM 0 HA GLU A 33 -0.319 8.116 9.793 1.00 0.86 H new ATOM 0 HB2 GLU A 33 -1.866 8.945 12.245 1.00 1.05 H new ATOM 0 HB3 GLU A 33 -0.150 8.587 12.245 1.00 1.05 H new ATOM 0 HG2 GLU A 33 0.100 10.364 10.422 1.00 1.38 H new ATOM 0 HG3 GLU A 33 -1.566 10.807 10.739 1.00 1.38 H new ATOM 76 N LYS A 34 -1.991 5.762 10.237 1.00 0.62 N ATOM 77 CA LYS A 34 -2.016 4.334 10.374 1.00 0.54 C ATOM 78 C LYS A 34 -0.835 3.726 9.627 1.00 0.43 C ATOM 79 O LYS A 34 -0.826 3.709 8.394 1.00 0.53 O ATOM 80 CB LYS A 34 -3.328 3.841 9.783 1.00 0.66 C ATOM 81 CG LYS A 34 -4.398 3.549 10.818 1.00 0.83 C ATOM 82 CD LYS A 34 -5.111 4.805 11.289 1.00 0.84 C ATOM 83 CE LYS A 34 -6.172 4.462 12.323 1.00 0.90 C ATOM 84 NZ LYS A 34 -6.850 5.670 12.866 1.00 1.23 N ATOM 0 H LYS A 34 -2.669 6.119 9.564 1.00 0.62 H new ATOM 0 HA LYS A 34 -1.941 4.041 11.421 1.00 0.54 H new ATOM 0 HB2 LYS A 34 -3.705 4.590 9.086 1.00 0.66 H new ATOM 0 HB3 LYS A 34 -3.138 2.936 9.206 1.00 0.66 H new ATOM 0 HG2 LYS A 34 -5.128 2.858 10.396 1.00 0.83 H new ATOM 0 HG3 LYS A 34 -3.944 3.050 11.674 1.00 0.83 H new ATOM 0 HD2 LYS A 34 -4.389 5.500 11.717 1.00 0.84 H new ATOM 0 HD3 LYS A 34 -5.573 5.308 10.439 1.00 0.84 H new ATOM 0 HE2 LYS A 34 -6.915 3.804 11.872 1.00 0.90 H new ATOM 0 HE3 LYS A 34 -5.712 3.909 13.142 1.00 0.90 H new ATOM 0 HZ1 LYS A 34 -6.646 5.755 13.882 1.00 1.23 H new ATOM 0 HZ2 LYS A 34 -6.501 6.516 12.371 1.00 1.23 H new ATOM 0 HZ3 LYS A 34 -7.877 5.585 12.725 1.00 1.23 H new ATOM 98 N GLU A 35 0.167 3.250 10.354 1.00 0.43 N ATOM 99 CA GLU A 35 1.377 2.756 9.712 1.00 0.48 C ATOM 100 C GLU A 35 1.224 1.296 9.280 1.00 0.40 C ATOM 101 O GLU A 35 1.248 0.368 10.091 1.00 0.55 O ATOM 102 CB GLU A 35 2.625 2.948 10.597 1.00 0.75 C ATOM 103 CG GLU A 35 2.638 2.166 11.902 1.00 1.06 C ATOM 104 CD GLU A 35 1.682 2.706 12.943 1.00 1.35 C ATOM 105 OE1 GLU A 35 2.005 3.727 13.583 1.00 1.83 O ATOM 106 OE2 GLU A 35 0.595 2.121 13.115 1.00 1.86 O ATOM 0 H GLU A 35 0.167 3.196 11.373 1.00 0.43 H new ATOM 0 HA GLU A 35 1.526 3.357 8.815 1.00 0.48 H new ATOM 0 HB2 GLU A 35 3.505 2.667 10.018 1.00 0.75 H new ATOM 0 HB3 GLU A 35 2.722 4.008 10.830 1.00 0.75 H new ATOM 0 HG2 GLU A 35 2.386 1.126 11.695 1.00 1.06 H new ATOM 0 HG3 GLU A 35 3.649 2.174 12.310 1.00 1.06 H new ATOM 113 N TRP A 36 1.050 1.110 7.987 1.00 0.28 N ATOM 114 CA TRP A 36 0.967 -0.213 7.406 1.00 0.25 C ATOM 115 C TRP A 36 2.356 -0.651 6.949 1.00 0.26 C ATOM 116 O TRP A 36 3.080 0.117 6.313 1.00 0.40 O ATOM 117 CB TRP A 36 -0.001 -0.222 6.219 1.00 0.26 C ATOM 118 CG TRP A 36 -1.357 0.356 6.519 1.00 0.19 C ATOM 119 CD1 TRP A 36 -1.916 1.460 5.941 1.00 0.56 C ATOM 120 CD2 TRP A 36 -2.321 -0.129 7.464 1.00 0.54 C ATOM 121 NE1 TRP A 36 -3.175 1.675 6.453 1.00 0.47 N ATOM 122 CE2 TRP A 36 -3.442 0.721 7.390 1.00 0.27 C ATOM 123 CE3 TRP A 36 -2.352 -1.198 8.361 1.00 1.19 C ATOM 124 CZ2 TRP A 36 -4.575 0.536 8.171 1.00 0.56 C ATOM 125 CZ3 TRP A 36 -3.480 -1.379 9.142 1.00 1.51 C ATOM 126 CH2 TRP A 36 -4.578 -0.518 9.041 1.00 1.19 C ATOM 0 H TRP A 36 0.962 1.870 7.312 1.00 0.28 H new ATOM 0 HA TRP A 36 0.592 -0.907 8.158 1.00 0.25 H new ATOM 0 HB2 TRP A 36 0.446 0.338 5.397 1.00 0.26 H new ATOM 0 HB3 TRP A 36 -0.125 -1.249 5.875 1.00 0.26 H new ATOM 0 HD1 TRP A 36 -1.439 2.075 5.192 1.00 0.56 H new ATOM 0 HE1 TRP A 36 -3.807 2.427 6.176 1.00 0.47 H new ATOM 0 HE3 TRP A 36 -1.512 -1.871 8.444 1.00 1.19 H new ATOM 0 HZ2 TRP A 36 -5.423 1.201 8.094 1.00 0.56 H new ATOM 0 HZ3 TRP A 36 -3.513 -2.200 9.843 1.00 1.51 H new ATOM 0 HH2 TRP A 36 -5.445 -0.689 9.662 1.00 1.19 H new ATOM 137 N HIS A 37 2.734 -1.872 7.283 1.00 0.25 N ATOM 138 CA HIS A 37 4.054 -2.382 6.926 1.00 0.25 C ATOM 139 C HIS A 37 3.966 -3.194 5.642 1.00 0.24 C ATOM 140 O HIS A 37 3.353 -4.253 5.620 1.00 0.30 O ATOM 141 CB HIS A 37 4.627 -3.232 8.064 1.00 0.29 C ATOM 142 CG HIS A 37 4.906 -2.454 9.312 1.00 0.34 C ATOM 143 ND1 HIS A 37 6.159 -2.353 9.874 1.00 0.61 N ATOM 144 CD2 HIS A 37 4.084 -1.728 10.103 1.00 0.68 C ATOM 145 CE1 HIS A 37 6.094 -1.595 10.951 1.00 0.51 C ATOM 146 NE2 HIS A 37 4.846 -1.201 11.113 1.00 0.56 N ATOM 0 H HIS A 37 2.151 -2.530 7.799 1.00 0.25 H new ATOM 0 HA HIS A 37 4.725 -1.539 6.762 1.00 0.25 H new ATOM 0 HB2 HIS A 37 3.926 -4.034 8.295 1.00 0.29 H new ATOM 0 HB3 HIS A 37 5.550 -3.703 7.725 1.00 0.29 H new ATOM 0 HD2 HIS A 37 3.022 -1.589 9.964 1.00 0.68 H new ATOM 0 HE1 HIS A 37 6.924 -1.340 11.593 1.00 0.51 H new ATOM 0 HE2 HIS A 37 4.504 -0.603 11.865 1.00 0.56 H new ATOM 155 N ILE A 38 4.569 -2.690 4.577 1.00 0.20 N ATOM 156 CA ILE A 38 4.421 -3.305 3.266 1.00 0.20 C ATOM 157 C ILE A 38 5.150 -4.644 3.179 1.00 0.21 C ATOM 158 O ILE A 38 6.338 -4.749 3.484 1.00 0.27 O ATOM 159 CB ILE A 38 4.911 -2.375 2.142 1.00 0.20 C ATOM 160 CG1 ILE A 38 4.208 -1.027 2.225 1.00 0.21 C ATOM 161 CG2 ILE A 38 4.628 -2.996 0.797 1.00 0.21 C ATOM 162 CD1 ILE A 38 4.778 0.015 1.287 1.00 0.20 C ATOM 0 H ILE A 38 5.163 -1.861 4.593 1.00 0.20 H new ATOM 0 HA ILE A 38 3.354 -3.483 3.131 1.00 0.20 H new ATOM 0 HB ILE A 38 5.985 -2.230 2.261 1.00 0.20 H new ATOM 0 HG12 ILE A 38 3.150 -1.165 2.001 1.00 0.21 H new ATOM 0 HG13 ILE A 38 4.272 -0.656 3.248 1.00 0.21 H new ATOM 0 HG21 ILE A 38 4.978 -2.330 0.008 1.00 0.21 H new ATOM 0 HG22 ILE A 38 5.146 -3.952 0.722 1.00 0.21 H new ATOM 0 HG23 ILE A 38 3.555 -3.155 0.688 1.00 0.21 H new ATOM 0 HD11 ILE A 38 4.227 0.948 1.402 1.00 0.20 H new ATOM 0 HD12 ILE A 38 5.829 0.182 1.524 1.00 0.20 H new ATOM 0 HD13 ILE A 38 4.689 -0.334 0.258 1.00 0.20 H new ATOM 174 N VAL A 39 4.406 -5.655 2.765 1.00 0.19 N ATOM 175 CA VAL A 39 4.913 -7.009 2.622 1.00 0.18 C ATOM 176 C VAL A 39 5.037 -7.386 1.156 1.00 0.16 C ATOM 177 O VAL A 39 4.113 -7.169 0.388 1.00 0.18 O ATOM 178 CB VAL A 39 3.959 -8.013 3.289 1.00 0.20 C ATOM 179 CG1 VAL A 39 4.349 -9.448 2.975 1.00 0.23 C ATOM 180 CG2 VAL A 39 3.899 -7.784 4.776 1.00 0.26 C ATOM 0 H VAL A 39 3.422 -5.558 2.516 1.00 0.19 H new ATOM 0 HA VAL A 39 5.892 -7.043 3.099 1.00 0.18 H new ATOM 0 HB VAL A 39 2.964 -7.848 2.876 1.00 0.20 H new ATOM 0 HG11 VAL A 39 3.652 -10.130 3.463 1.00 0.23 H new ATOM 0 HG12 VAL A 39 4.316 -9.606 1.897 1.00 0.23 H new ATOM 0 HG13 VAL A 39 5.358 -9.639 3.339 1.00 0.23 H new ATOM 0 HG21 VAL A 39 3.218 -8.505 5.228 1.00 0.26 H new ATOM 0 HG22 VAL A 39 4.894 -7.907 5.204 1.00 0.26 H new ATOM 0 HG23 VAL A 39 3.541 -6.774 4.974 1.00 0.26 H new ATOM 190 N PRO A 40 6.170 -7.955 0.751 1.00 0.14 N ATOM 191 CA PRO A 40 6.356 -8.457 -0.596 1.00 0.14 C ATOM 192 C PRO A 40 5.925 -9.920 -0.726 1.00 0.16 C ATOM 193 O PRO A 40 6.467 -10.801 -0.056 1.00 0.28 O ATOM 194 CB PRO A 40 7.862 -8.319 -0.813 1.00 0.17 C ATOM 195 CG PRO A 40 8.464 -7.977 0.523 1.00 0.15 C ATOM 196 CD PRO A 40 7.378 -8.137 1.548 1.00 0.14 C ATOM 0 HA PRO A 40 5.756 -7.916 -1.328 1.00 0.14 H new ATOM 0 HB2 PRO A 40 8.283 -9.246 -1.201 1.00 0.17 H new ATOM 0 HB3 PRO A 40 8.077 -7.540 -1.545 1.00 0.17 H new ATOM 0 HG2 PRO A 40 9.305 -8.634 0.746 1.00 0.15 H new ATOM 0 HG3 PRO A 40 8.847 -6.957 0.523 1.00 0.15 H new ATOM 0 HD2 PRO A 40 7.408 -9.118 2.023 1.00 0.14 H new ATOM 0 HD3 PRO A 40 7.456 -7.395 2.343 1.00 0.14 H new ATOM 204 N VAL A 41 4.943 -10.167 -1.584 1.00 0.14 N ATOM 205 CA VAL A 41 4.440 -11.520 -1.804 1.00 0.16 C ATOM 206 C VAL A 41 5.134 -12.165 -3.002 1.00 0.18 C ATOM 207 O VAL A 41 5.599 -13.302 -2.933 1.00 0.23 O ATOM 208 CB VAL A 41 2.916 -11.533 -2.060 1.00 0.17 C ATOM 209 CG1 VAL A 41 2.421 -12.959 -2.238 1.00 0.21 C ATOM 210 CG2 VAL A 41 2.152 -10.838 -0.943 1.00 0.20 C ATOM 0 H VAL A 41 4.478 -9.449 -2.140 1.00 0.14 H new ATOM 0 HA VAL A 41 4.653 -12.084 -0.896 1.00 0.16 H new ATOM 0 HB VAL A 41 2.730 -10.978 -2.979 1.00 0.17 H new ATOM 0 HG11 VAL A 41 1.346 -12.951 -2.417 1.00 0.21 H new ATOM 0 HG12 VAL A 41 2.927 -13.417 -3.088 1.00 0.21 H new ATOM 0 HG13 VAL A 41 2.634 -13.533 -1.336 1.00 0.21 H new ATOM 0 HG21 VAL A 41 1.084 -10.868 -1.159 1.00 0.20 H new ATOM 0 HG22 VAL A 41 2.345 -11.347 0.001 1.00 0.20 H new ATOM 0 HG23 VAL A 41 2.478 -9.801 -0.870 1.00 0.20 H new ATOM 220 N SER A 42 5.199 -11.426 -4.100 1.00 0.19 N ATOM 221 CA SER A 42 5.762 -11.944 -5.337 1.00 0.25 C ATOM 222 C SER A 42 7.287 -11.922 -5.297 1.00 0.24 C ATOM 223 O SER A 42 7.905 -11.114 -4.598 1.00 0.35 O ATOM 224 CB SER A 42 5.250 -11.136 -6.532 1.00 0.34 C ATOM 225 OG SER A 42 5.849 -11.566 -7.745 1.00 1.08 O ATOM 0 H SER A 42 4.868 -10.463 -4.159 1.00 0.19 H new ATOM 0 HA SER A 42 5.441 -12.980 -5.448 1.00 0.25 H new ATOM 0 HB2 SER A 42 4.167 -11.237 -6.604 1.00 0.34 H new ATOM 0 HB3 SER A 42 5.462 -10.078 -6.375 1.00 0.34 H new ATOM 0 HG SER A 42 5.500 -11.032 -8.489 1.00 1.08 H new ATOM 231 N LYS A 43 7.869 -12.819 -6.089 1.00 0.28 N ATOM 232 CA LYS A 43 9.309 -13.034 -6.147 1.00 0.31 C ATOM 233 C LYS A 43 10.032 -11.786 -6.610 1.00 0.26 C ATOM 234 O LYS A 43 11.182 -11.545 -6.246 1.00 0.32 O ATOM 235 CB LYS A 43 9.600 -14.176 -7.116 1.00 0.42 C ATOM 236 CG LYS A 43 8.690 -15.365 -6.899 1.00 1.02 C ATOM 237 CD LYS A 43 7.923 -15.732 -8.158 1.00 1.41 C ATOM 238 CE LYS A 43 8.853 -16.174 -9.275 1.00 2.09 C ATOM 239 NZ LYS A 43 8.098 -16.589 -10.487 1.00 2.95 N ATOM 0 H LYS A 43 7.343 -13.426 -6.718 1.00 0.28 H new ATOM 0 HA LYS A 43 9.665 -13.281 -5.147 1.00 0.31 H new ATOM 0 HB2 LYS A 43 9.487 -13.818 -8.139 1.00 0.42 H new ATOM 0 HB3 LYS A 43 10.637 -14.491 -7.001 1.00 0.42 H new ATOM 0 HG2 LYS A 43 9.282 -16.220 -6.573 1.00 1.02 H new ATOM 0 HG3 LYS A 43 7.986 -15.141 -6.098 1.00 1.02 H new ATOM 0 HD2 LYS A 43 7.218 -16.532 -7.934 1.00 1.41 H new ATOM 0 HD3 LYS A 43 7.337 -14.875 -8.490 1.00 1.41 H new ATOM 0 HE2 LYS A 43 9.530 -15.358 -9.529 1.00 2.09 H new ATOM 0 HE3 LYS A 43 9.470 -17.003 -8.929 1.00 2.09 H new ATOM 0 HZ1 LYS A 43 8.766 -16.884 -11.228 1.00 2.95 H new ATOM 0 HZ2 LYS A 43 7.471 -17.384 -10.250 1.00 2.95 H new ATOM 0 HZ3 LYS A 43 7.529 -15.790 -10.832 1.00 2.95 H new ATOM 253 N ASP A 44 9.338 -10.994 -7.406 1.00 0.23 N ATOM 254 CA ASP A 44 9.909 -9.789 -7.981 1.00 0.21 C ATOM 255 C ASP A 44 10.067 -8.703 -6.920 1.00 0.17 C ATOM 256 O ASP A 44 10.803 -7.735 -7.112 1.00 0.18 O ATOM 257 CB ASP A 44 9.017 -9.285 -9.115 1.00 0.25 C ATOM 258 CG ASP A 44 9.796 -8.968 -10.370 1.00 0.39 C ATOM 259 OD1 ASP A 44 11.037 -8.882 -10.298 1.00 0.44 O ATOM 260 OD2 ASP A 44 9.173 -8.811 -11.437 1.00 0.97 O ATOM 0 H ASP A 44 8.368 -11.166 -7.671 1.00 0.23 H new ATOM 0 HA ASP A 44 10.897 -10.028 -8.376 1.00 0.21 H new ATOM 0 HB2 ASP A 44 8.262 -10.038 -9.341 1.00 0.25 H new ATOM 0 HB3 ASP A 44 8.487 -8.391 -8.785 1.00 0.25 H new ATOM 265 N TYR A 45 9.367 -8.870 -5.800 1.00 0.15 N ATOM 266 CA TYR A 45 9.343 -7.862 -4.744 1.00 0.13 C ATOM 267 C TYR A 45 10.067 -8.343 -3.494 1.00 0.15 C ATOM 268 O TYR A 45 10.117 -7.636 -2.503 1.00 0.15 O ATOM 269 CB TYR A 45 7.897 -7.505 -4.388 1.00 0.12 C ATOM 270 CG TYR A 45 7.095 -7.002 -5.563 1.00 0.15 C ATOM 271 CD1 TYR A 45 6.538 -7.894 -6.470 1.00 0.23 C ATOM 272 CD2 TYR A 45 6.909 -5.644 -5.774 1.00 0.21 C ATOM 273 CE1 TYR A 45 5.823 -7.449 -7.562 1.00 0.29 C ATOM 274 CE2 TYR A 45 6.186 -5.190 -6.864 1.00 0.25 C ATOM 275 CZ TYR A 45 5.649 -6.100 -7.756 1.00 0.27 C ATOM 276 OH TYR A 45 4.943 -5.661 -8.850 1.00 0.35 O ATOM 0 H TYR A 45 8.806 -9.698 -5.600 1.00 0.15 H new ATOM 0 HA TYR A 45 9.859 -6.979 -5.121 1.00 0.13 H new ATOM 0 HB2 TYR A 45 7.406 -8.385 -3.973 1.00 0.12 H new ATOM 0 HB3 TYR A 45 7.900 -6.744 -3.608 1.00 0.12 H new ATOM 0 HD1 TYR A 45 6.667 -8.955 -6.317 1.00 0.23 H new ATOM 0 HD2 TYR A 45 7.333 -4.933 -5.080 1.00 0.21 H new ATOM 0 HE1 TYR A 45 5.402 -8.157 -8.261 1.00 0.29 H new ATOM 0 HE2 TYR A 45 6.042 -4.131 -7.017 1.00 0.25 H new ATOM 0 HH TYR A 45 3.991 -5.605 -8.624 1.00 0.35 H new ATOM 286 N PHE A 46 10.651 -9.529 -3.539 1.00 0.19 N ATOM 287 CA PHE A 46 11.289 -10.102 -2.350 1.00 0.23 C ATOM 288 C PHE A 46 12.414 -9.223 -1.802 1.00 0.22 C ATOM 289 O PHE A 46 12.880 -9.434 -0.684 1.00 0.26 O ATOM 290 CB PHE A 46 11.813 -11.507 -2.627 1.00 0.28 C ATOM 291 CG PHE A 46 10.751 -12.568 -2.550 1.00 0.36 C ATOM 292 CD1 PHE A 46 9.632 -12.391 -1.749 1.00 0.68 C ATOM 293 CD2 PHE A 46 10.876 -13.744 -3.268 1.00 0.68 C ATOM 294 CE1 PHE A 46 8.659 -13.368 -1.669 1.00 0.74 C ATOM 295 CE2 PHE A 46 9.905 -14.724 -3.191 1.00 0.76 C ATOM 296 CZ PHE A 46 8.796 -14.536 -2.391 1.00 0.57 C ATOM 0 H PHE A 46 10.700 -10.114 -4.373 1.00 0.19 H new ATOM 0 HA PHE A 46 10.513 -10.155 -1.586 1.00 0.23 H new ATOM 0 HB2 PHE A 46 12.266 -11.529 -3.618 1.00 0.28 H new ATOM 0 HB3 PHE A 46 12.601 -11.740 -1.911 1.00 0.28 H new ATOM 0 HD1 PHE A 46 9.521 -11.479 -1.182 1.00 0.68 H new ATOM 0 HD2 PHE A 46 11.742 -13.898 -3.895 1.00 0.68 H new ATOM 0 HE1 PHE A 46 7.792 -13.218 -1.042 1.00 0.74 H new ATOM 0 HE2 PHE A 46 10.014 -15.637 -3.757 1.00 0.76 H new ATOM 0 HZ PHE A 46 8.037 -15.302 -2.330 1.00 0.57 H new ATOM 306 N SER A 47 12.848 -8.238 -2.577 1.00 0.19 N ATOM 307 CA SER A 47 13.930 -7.386 -2.162 1.00 0.23 C ATOM 308 C SER A 47 13.441 -6.001 -1.744 1.00 0.17 C ATOM 309 O SER A 47 14.220 -5.064 -1.738 1.00 0.20 O ATOM 310 CB SER A 47 14.923 -7.268 -3.306 1.00 0.31 C ATOM 311 OG SER A 47 15.439 -8.541 -3.663 1.00 1.19 O ATOM 0 H SER A 47 12.461 -8.017 -3.495 1.00 0.19 H new ATOM 0 HA SER A 47 14.406 -7.832 -1.289 1.00 0.23 H new ATOM 0 HB2 SER A 47 14.437 -6.813 -4.169 1.00 0.31 H new ATOM 0 HB3 SER A 47 15.741 -6.608 -3.016 1.00 0.31 H new ATOM 0 HG SER A 47 16.075 -8.441 -4.402 1.00 1.19 H new ATOM 317 N ILE A 48 12.159 -5.866 -1.409 1.00 0.17 N ATOM 318 CA ILE A 48 11.622 -4.579 -0.950 1.00 0.15 C ATOM 319 C ILE A 48 12.367 -4.124 0.322 1.00 0.17 C ATOM 320 O ILE A 48 12.729 -4.955 1.150 1.00 0.20 O ATOM 321 CB ILE A 48 10.081 -4.666 -0.700 1.00 0.17 C ATOM 322 CG1 ILE A 48 9.333 -4.999 -1.998 1.00 0.18 C ATOM 323 CG2 ILE A 48 9.523 -3.380 -0.113 1.00 0.18 C ATOM 324 CD1 ILE A 48 8.526 -3.851 -2.583 1.00 0.21 C ATOM 0 H ILE A 48 11.475 -6.622 -1.445 1.00 0.17 H new ATOM 0 HA ILE A 48 11.781 -3.837 -1.732 1.00 0.15 H new ATOM 0 HB ILE A 48 9.928 -5.466 0.024 1.00 0.17 H new ATOM 0 HG12 ILE A 48 10.057 -5.332 -2.742 1.00 0.18 H new ATOM 0 HG13 ILE A 48 8.662 -5.837 -1.809 1.00 0.18 H new ATOM 0 HG21 ILE A 48 8.450 -3.487 0.044 1.00 0.18 H new ATOM 0 HG22 ILE A 48 10.010 -3.174 0.840 1.00 0.18 H new ATOM 0 HG23 ILE A 48 9.709 -2.555 -0.801 1.00 0.18 H new ATOM 0 HD11 ILE A 48 8.034 -4.181 -3.498 1.00 0.21 H new ATOM 0 HD12 ILE A 48 7.774 -3.530 -1.862 1.00 0.21 H new ATOM 0 HD13 ILE A 48 9.191 -3.017 -2.810 1.00 0.21 H new ATOM 336 N PRO A 49 12.638 -2.801 0.429 1.00 0.16 N ATOM 337 CA PRO A 49 13.456 -2.159 1.474 1.00 0.19 C ATOM 338 C PRO A 49 13.457 -2.755 2.879 1.00 0.15 C ATOM 339 O PRO A 49 12.580 -3.515 3.285 1.00 0.21 O ATOM 340 CB PRO A 49 12.845 -0.778 1.556 1.00 0.26 C ATOM 341 CG PRO A 49 12.398 -0.478 0.181 1.00 0.17 C ATOM 342 CD PRO A 49 12.184 -1.788 -0.531 1.00 0.16 C ATOM 0 HA PRO A 49 14.502 -2.254 1.184 1.00 0.19 H new ATOM 0 HB2 PRO A 49 12.010 -0.756 2.256 1.00 0.26 H new ATOM 0 HB3 PRO A 49 13.572 -0.044 1.904 1.00 0.26 H new ATOM 0 HG2 PRO A 49 11.476 0.103 0.198 1.00 0.17 H new ATOM 0 HG3 PRO A 49 13.143 0.123 -0.340 1.00 0.17 H new ATOM 0 HD2 PRO A 49 11.136 -1.931 -0.794 1.00 0.16 H new ATOM 0 HD3 PRO A 49 12.755 -1.835 -1.458 1.00 0.16 H new ATOM 350 N ASN A 50 14.463 -2.295 3.630 1.00 0.17 N ATOM 351 CA ASN A 50 14.665 -2.648 5.031 1.00 0.22 C ATOM 352 C ASN A 50 13.405 -2.361 5.849 1.00 0.22 C ATOM 353 O ASN A 50 13.122 -3.050 6.831 1.00 0.34 O ATOM 354 CB ASN A 50 15.840 -1.834 5.596 1.00 0.35 C ATOM 355 CG ASN A 50 16.367 -2.396 6.905 1.00 0.58 C ATOM 356 OD1 ASN A 50 16.304 -3.603 7.151 1.00 1.23 O ATOM 357 ND2 ASN A 50 16.895 -1.524 7.751 1.00 0.83 N ATOM 0 H ASN A 50 15.171 -1.655 3.270 1.00 0.17 H new ATOM 0 HA ASN A 50 14.885 -3.714 5.095 1.00 0.22 H new ATOM 0 HB2 ASN A 50 16.647 -1.812 4.864 1.00 0.35 H new ATOM 0 HB3 ASN A 50 15.522 -0.803 5.750 1.00 0.35 H new ATOM 0 HD21 ASN A 50 17.269 -1.843 8.645 1.00 0.83 H new ATOM 0 HD22 ASN A 50 16.928 -0.534 7.509 1.00 0.83 H new ATOM 364 N ASP A 51 12.673 -1.328 5.437 1.00 0.24 N ATOM 365 CA ASP A 51 11.398 -0.973 6.033 1.00 0.34 C ATOM 366 C ASP A 51 10.755 0.142 5.227 1.00 0.27 C ATOM 367 O ASP A 51 11.336 1.205 5.027 1.00 0.36 O ATOM 368 CB ASP A 51 11.515 -0.561 7.517 1.00 0.51 C ATOM 369 CG ASP A 51 12.346 0.689 7.764 1.00 1.20 C ATOM 370 OD1 ASP A 51 11.791 1.810 7.701 1.00 1.23 O ATOM 371 OD2 ASP A 51 13.550 0.550 8.074 1.00 1.90 O ATOM 0 H ASP A 51 12.955 -0.713 4.674 1.00 0.24 H new ATOM 0 HA ASP A 51 10.772 -1.865 6.010 1.00 0.34 H new ATOM 0 HB2 ASP A 51 10.513 -0.400 7.916 1.00 0.51 H new ATOM 0 HB3 ASP A 51 11.952 -1.388 8.077 1.00 0.51 H new ATOM 376 N LEU A 52 9.598 -0.154 4.683 1.00 0.22 N ATOM 377 CA LEU A 52 8.755 0.860 4.070 1.00 0.17 C ATOM 378 C LEU A 52 7.495 1.056 4.890 1.00 0.19 C ATOM 379 O LEU A 52 6.798 0.091 5.216 1.00 0.25 O ATOM 380 CB LEU A 52 8.368 0.476 2.643 1.00 0.18 C ATOM 381 CG LEU A 52 9.471 0.606 1.600 1.00 0.14 C ATOM 382 CD1 LEU A 52 8.932 0.206 0.237 1.00 0.17 C ATOM 383 CD2 LEU A 52 10.015 2.023 1.568 1.00 0.15 C ATOM 0 H LEU A 52 9.211 -1.097 4.650 1.00 0.22 H new ATOM 0 HA LEU A 52 9.326 1.788 4.038 1.00 0.17 H new ATOM 0 HB2 LEU A 52 8.017 -0.556 2.647 1.00 0.18 H new ATOM 0 HB3 LEU A 52 7.527 1.097 2.335 1.00 0.18 H new ATOM 0 HG LEU A 52 10.292 -0.060 1.866 1.00 0.14 H new ATOM 0 HD11 LEU A 52 9.722 0.299 -0.508 1.00 0.17 H new ATOM 0 HD12 LEU A 52 8.586 -0.827 0.271 1.00 0.17 H new ATOM 0 HD13 LEU A 52 8.101 0.858 -0.031 1.00 0.17 H new ATOM 0 HD21 LEU A 52 10.801 2.094 0.817 1.00 0.15 H new ATOM 0 HD22 LEU A 52 9.211 2.716 1.319 1.00 0.15 H new ATOM 0 HD23 LEU A 52 10.423 2.278 2.546 1.00 0.15 H new ATOM 395 N LEU A 53 7.200 2.298 5.226 1.00 0.16 N ATOM 396 CA LEU A 53 5.984 2.594 5.963 1.00 0.18 C ATOM 397 C LEU A 53 4.934 3.178 5.033 1.00 0.17 C ATOM 398 O LEU A 53 5.110 4.253 4.462 1.00 0.17 O ATOM 399 CB LEU A 53 6.265 3.557 7.119 1.00 0.21 C ATOM 400 CG LEU A 53 7.227 3.030 8.184 1.00 0.26 C ATOM 401 CD1 LEU A 53 7.499 4.105 9.221 1.00 0.32 C ATOM 402 CD2 LEU A 53 6.661 1.778 8.844 1.00 0.30 C ATOM 0 H LEU A 53 7.777 3.109 5.004 1.00 0.16 H new ATOM 0 HA LEU A 53 5.605 1.662 6.382 1.00 0.18 H new ATOM 0 HB2 LEU A 53 6.672 4.482 6.710 1.00 0.21 H new ATOM 0 HB3 LEU A 53 5.319 3.809 7.599 1.00 0.21 H new ATOM 0 HG LEU A 53 8.169 2.765 7.703 1.00 0.26 H new ATOM 0 HD11 LEU A 53 8.185 3.718 9.974 1.00 0.32 H new ATOM 0 HD12 LEU A 53 7.944 4.974 8.736 1.00 0.32 H new ATOM 0 HD13 LEU A 53 6.563 4.396 9.698 1.00 0.32 H new ATOM 0 HD21 LEU A 53 7.359 1.417 9.599 1.00 0.30 H new ATOM 0 HD22 LEU A 53 5.707 2.015 9.315 1.00 0.30 H new ATOM 0 HD23 LEU A 53 6.511 1.005 8.090 1.00 0.30 H new ATOM 414 N TRP A 54 3.846 2.455 4.891 1.00 0.18 N ATOM 415 CA TRP A 54 2.738 2.877 4.062 1.00 0.20 C ATOM 416 C TRP A 54 1.625 3.411 4.945 1.00 0.23 C ATOM 417 O TRP A 54 1.304 2.815 5.968 1.00 0.28 O ATOM 418 CB TRP A 54 2.235 1.683 3.243 1.00 0.22 C ATOM 419 CG TRP A 54 1.079 1.985 2.337 1.00 0.24 C ATOM 420 CD1 TRP A 54 -0.196 2.290 2.712 1.00 0.35 C ATOM 421 CD2 TRP A 54 1.080 1.974 0.906 1.00 0.24 C ATOM 422 NE1 TRP A 54 -0.975 2.500 1.609 1.00 0.35 N ATOM 423 CE2 TRP A 54 -0.223 2.300 0.489 1.00 0.26 C ATOM 424 CE3 TRP A 54 2.051 1.724 -0.066 1.00 0.34 C ATOM 425 CZ2 TRP A 54 -0.578 2.387 -0.849 1.00 0.27 C ATOM 426 CZ3 TRP A 54 1.691 1.809 -1.398 1.00 0.41 C ATOM 427 CH2 TRP A 54 0.384 2.136 -1.773 1.00 0.35 C ATOM 0 H TRP A 54 3.704 1.555 5.349 1.00 0.18 H new ATOM 0 HA TRP A 54 3.062 3.665 3.382 1.00 0.20 H new ATOM 0 HB2 TRP A 54 3.059 1.300 2.642 1.00 0.22 H new ATOM 0 HB3 TRP A 54 1.943 0.887 3.928 1.00 0.22 H new ATOM 0 HD1 TRP A 54 -0.541 2.356 3.733 1.00 0.35 H new ATOM 0 HE1 TRP A 54 -1.960 2.764 1.621 1.00 0.35 H new ATOM 0 HE3 TRP A 54 3.062 1.470 0.217 1.00 0.34 H new ATOM 0 HZ2 TRP A 54 -1.584 2.645 -1.145 1.00 0.27 H new ATOM 0 HZ3 TRP A 54 2.431 1.620 -2.161 1.00 0.41 H new ATOM 0 HH2 TRP A 54 0.134 2.190 -2.822 1.00 0.35 H new ATOM 438 N SER A 55 1.046 4.529 4.570 1.00 0.26 N ATOM 439 CA SER A 55 -0.086 5.049 5.292 1.00 0.33 C ATOM 440 C SER A 55 -1.014 5.765 4.330 1.00 0.25 C ATOM 441 O SER A 55 -0.636 6.767 3.722 1.00 0.22 O ATOM 442 CB SER A 55 0.387 6.003 6.392 1.00 0.44 C ATOM 443 OG SER A 55 -0.624 6.213 7.361 1.00 1.11 O ATOM 0 H SER A 55 1.341 5.092 3.772 1.00 0.26 H new ATOM 0 HA SER A 55 -0.627 4.227 5.760 1.00 0.33 H new ATOM 0 HB2 SER A 55 1.276 5.594 6.873 1.00 0.44 H new ATOM 0 HB3 SER A 55 0.674 6.957 5.950 1.00 0.44 H new ATOM 0 HG SER A 55 -0.900 5.351 7.737 1.00 1.11 H new ATOM 449 N PHE A 56 -2.216 5.237 4.152 1.00 0.30 N ATOM 450 CA PHE A 56 -3.204 5.947 3.367 1.00 0.28 C ATOM 451 C PHE A 56 -3.668 7.133 4.184 1.00 0.27 C ATOM 452 O PHE A 56 -4.207 6.959 5.278 1.00 0.39 O ATOM 453 CB PHE A 56 -4.433 5.086 3.062 1.00 0.40 C ATOM 454 CG PHE A 56 -4.174 3.696 2.548 1.00 0.30 C ATOM 455 CD1 PHE A 56 -3.827 2.674 3.412 1.00 0.29 C ATOM 456 CD2 PHE A 56 -4.229 3.426 1.190 1.00 0.34 C ATOM 457 CE1 PHE A 56 -3.545 1.408 2.931 1.00 0.30 C ATOM 458 CE2 PHE A 56 -3.953 2.162 0.704 1.00 0.34 C ATOM 459 CZ PHE A 56 -3.781 1.105 1.618 1.00 0.27 C ATOM 0 H PHE A 56 -2.522 4.341 4.532 1.00 0.30 H new ATOM 0 HA PHE A 56 -2.746 6.235 2.421 1.00 0.28 H new ATOM 0 HB2 PHE A 56 -5.027 5.007 3.972 1.00 0.40 H new ATOM 0 HB3 PHE A 56 -5.043 5.612 2.328 1.00 0.40 H new ATOM 0 HD1 PHE A 56 -3.776 2.866 4.474 1.00 0.29 H new ATOM 0 HD2 PHE A 56 -4.491 4.215 0.501 1.00 0.34 H new ATOM 0 HE1 PHE A 56 -3.138 0.658 3.593 1.00 0.30 H new ATOM 0 HE2 PHE A 56 -3.871 1.988 -0.359 1.00 0.34 H new ATOM 0 HZ PHE A 56 -3.834 0.077 1.290 1.00 0.27 H new ATOM 469 N ASN A 57 -3.488 8.322 3.668 1.00 0.24 N ATOM 470 CA ASN A 57 -3.965 9.502 4.357 1.00 0.31 C ATOM 471 C ASN A 57 -5.395 9.759 3.928 1.00 0.33 C ATOM 472 O ASN A 57 -5.641 10.429 2.941 1.00 0.41 O ATOM 473 CB ASN A 57 -3.071 10.703 4.028 1.00 0.45 C ATOM 474 CG ASN A 57 -3.420 11.956 4.815 1.00 1.09 C ATOM 475 OD1 ASN A 57 -4.579 12.200 5.154 1.00 2.12 O ATOM 476 ND2 ASN A 57 -2.411 12.758 5.112 1.00 1.16 N ATOM 0 H ASN A 57 -3.019 8.502 2.780 1.00 0.24 H new ATOM 0 HA ASN A 57 -3.930 9.349 5.436 1.00 0.31 H new ATOM 0 HB2 ASN A 57 -2.033 10.437 4.226 1.00 0.45 H new ATOM 0 HB3 ASN A 57 -3.147 10.920 2.963 1.00 0.45 H new ATOM 0 HD21 ASN A 57 -2.579 13.614 5.640 1.00 1.16 H new ATOM 0 HD22 ASN A 57 -1.465 12.520 4.813 1.00 1.16 H new ATOM 483 N THR A 58 -6.333 9.259 4.703 1.00 0.34 N ATOM 484 CA THR A 58 -7.744 9.333 4.355 1.00 0.40 C ATOM 485 C THR A 58 -8.341 10.664 4.792 1.00 0.48 C ATOM 486 O THR A 58 -9.530 10.926 4.612 1.00 0.61 O ATOM 487 CB THR A 58 -8.496 8.172 5.018 1.00 0.40 C ATOM 488 OG1 THR A 58 -8.160 8.119 6.411 1.00 0.43 O ATOM 489 CG2 THR A 58 -8.137 6.849 4.354 1.00 0.48 C ATOM 0 H THR A 58 -6.145 8.791 5.589 1.00 0.34 H new ATOM 0 HA THR A 58 -7.843 9.258 3.272 1.00 0.40 H new ATOM 0 HB THR A 58 -9.567 8.338 4.903 1.00 0.40 H new ATOM 0 HG1 THR A 58 -8.757 8.712 6.914 1.00 0.43 H new ATOM 0 HG21 THR A 58 -8.681 6.039 4.839 1.00 0.48 H new ATOM 0 HG22 THR A 58 -8.407 6.886 3.299 1.00 0.48 H new ATOM 0 HG23 THR A 58 -7.065 6.674 4.448 1.00 0.48 H new ATOM 497 N THR A 59 -7.489 11.504 5.354 1.00 0.50 N ATOM 498 CA THR A 59 -7.866 12.822 5.790 1.00 0.63 C ATOM 499 C THR A 59 -7.832 13.782 4.597 1.00 0.67 C ATOM 500 O THR A 59 -8.688 14.658 4.449 1.00 0.77 O ATOM 501 CB THR A 59 -6.902 13.282 6.896 1.00 0.74 C ATOM 502 OG1 THR A 59 -6.979 12.399 8.021 1.00 0.86 O ATOM 503 CG2 THR A 59 -7.188 14.702 7.331 1.00 0.90 C ATOM 0 H THR A 59 -6.508 11.280 5.519 1.00 0.50 H new ATOM 0 HA THR A 59 -8.879 12.811 6.193 1.00 0.63 H new ATOM 0 HB THR A 59 -5.893 13.255 6.485 1.00 0.74 H new ATOM 0 HG1 THR A 59 -6.359 12.702 8.717 1.00 0.86 H new ATOM 0 HG21 THR A 59 -6.486 14.991 8.114 1.00 0.90 H new ATOM 0 HG22 THR A 59 -7.078 15.373 6.479 1.00 0.90 H new ATOM 0 HG23 THR A 59 -8.206 14.767 7.715 1.00 0.90 H new ATOM 511 N ASN A 60 -6.840 13.582 3.737 1.00 0.65 N ATOM 512 CA ASN A 60 -6.724 14.333 2.490 1.00 0.74 C ATOM 513 C ASN A 60 -7.024 13.426 1.309 1.00 0.72 C ATOM 514 O ASN A 60 -7.012 13.856 0.154 1.00 0.84 O ATOM 515 CB ASN A 60 -5.312 14.910 2.333 1.00 0.86 C ATOM 516 CG ASN A 60 -5.027 16.045 3.292 1.00 1.17 C ATOM 517 OD1 ASN A 60 -5.918 16.815 3.641 1.00 1.99 O ATOM 518 ND2 ASN A 60 -3.782 16.159 3.722 1.00 1.69 N ATOM 0 H ASN A 60 -6.097 12.899 3.882 1.00 0.65 H new ATOM 0 HA ASN A 60 -7.442 15.153 2.519 1.00 0.74 H new ATOM 0 HB2 ASN A 60 -4.582 14.116 2.491 1.00 0.86 H new ATOM 0 HB3 ASN A 60 -5.182 15.264 1.310 1.00 0.86 H new ATOM 0 HD21 ASN A 60 -3.532 16.908 4.368 1.00 1.69 H new ATOM 0 HD22 ASN A 60 -3.071 15.498 3.408 1.00 1.69 H new ATOM 525 N LYS A 61 -7.320 12.173 1.639 1.00 0.64 N ATOM 526 CA LYS A 61 -7.439 11.088 0.671 1.00 0.66 C ATOM 527 C LYS A 61 -6.186 11.015 -0.204 1.00 0.65 C ATOM 528 O LYS A 61 -6.246 10.993 -1.433 1.00 0.94 O ATOM 529 CB LYS A 61 -8.703 11.206 -0.175 1.00 0.84 C ATOM 530 CG LYS A 61 -9.989 11.279 0.638 1.00 0.96 C ATOM 531 CD LYS A 61 -10.511 12.699 0.742 1.00 0.99 C ATOM 532 CE LYS A 61 -10.819 13.278 -0.629 1.00 1.06 C ATOM 533 NZ LYS A 61 -11.850 12.487 -1.357 1.00 1.65 N ATOM 0 H LYS A 61 -7.487 11.878 2.601 1.00 0.64 H new ATOM 0 HA LYS A 61 -7.526 10.156 1.229 1.00 0.66 H new ATOM 0 HB2 LYS A 61 -8.629 12.097 -0.798 1.00 0.84 H new ATOM 0 HB3 LYS A 61 -8.759 10.350 -0.848 1.00 0.84 H new ATOM 0 HG2 LYS A 61 -10.747 10.646 0.176 1.00 0.96 H new ATOM 0 HG3 LYS A 61 -9.810 10.884 1.638 1.00 0.96 H new ATOM 0 HD2 LYS A 61 -11.412 12.713 1.355 1.00 0.99 H new ATOM 0 HD3 LYS A 61 -9.773 13.324 1.245 1.00 0.99 H new ATOM 0 HE2 LYS A 61 -11.164 14.306 -0.518 1.00 1.06 H new ATOM 0 HE3 LYS A 61 -9.904 13.311 -1.221 1.00 1.06 H new ATOM 0 HZ1 LYS A 61 -12.064 12.948 -2.265 1.00 1.65 H new ATOM 0 HZ2 LYS A 61 -11.491 11.527 -1.532 1.00 1.65 H new ATOM 0 HZ3 LYS A 61 -12.716 12.434 -0.783 1.00 1.65 H new ATOM 547 N SER A 62 -5.058 10.945 0.476 1.00 0.41 N ATOM 548 CA SER A 62 -3.744 10.922 -0.133 1.00 0.38 C ATOM 549 C SER A 62 -3.051 9.605 0.213 1.00 0.35 C ATOM 550 O SER A 62 -3.495 8.881 1.097 1.00 0.50 O ATOM 551 CB SER A 62 -2.936 12.113 0.405 1.00 0.47 C ATOM 552 OG SER A 62 -1.596 12.103 -0.047 1.00 1.28 O ATOM 0 H SER A 62 -5.031 10.901 1.495 1.00 0.41 H new ATOM 0 HA SER A 62 -3.823 10.999 -1.217 1.00 0.38 H new ATOM 0 HB2 SER A 62 -3.414 13.042 0.096 1.00 0.47 H new ATOM 0 HB3 SER A 62 -2.949 12.095 1.495 1.00 0.47 H new ATOM 0 HG SER A 62 -1.580 12.003 -1.022 1.00 1.28 H new ATOM 558 N ILE A 63 -1.986 9.284 -0.496 1.00 0.36 N ATOM 559 CA ILE A 63 -1.155 8.149 -0.128 1.00 0.33 C ATOM 560 C ILE A 63 0.160 8.669 0.422 1.00 0.35 C ATOM 561 O ILE A 63 0.879 9.397 -0.260 1.00 0.54 O ATOM 562 CB ILE A 63 -0.823 7.188 -1.302 1.00 0.34 C ATOM 563 CG1 ILE A 63 -1.978 7.063 -2.318 1.00 0.37 C ATOM 564 CG2 ILE A 63 -0.453 5.819 -0.745 1.00 0.39 C ATOM 565 CD1 ILE A 63 -1.878 5.839 -3.201 1.00 1.11 C ATOM 0 H ILE A 63 -1.675 9.789 -1.326 1.00 0.36 H new ATOM 0 HA ILE A 63 -1.730 7.579 0.602 1.00 0.33 H new ATOM 0 HB ILE A 63 0.021 7.612 -1.846 1.00 0.34 H new ATOM 0 HG12 ILE A 63 -2.924 7.035 -1.778 1.00 0.37 H new ATOM 0 HG13 ILE A 63 -1.996 7.953 -2.946 1.00 0.37 H new ATOM 0 HG21 ILE A 63 -0.220 5.143 -1.567 1.00 0.39 H new ATOM 0 HG22 ILE A 63 0.417 5.914 -0.095 1.00 0.39 H new ATOM 0 HG23 ILE A 63 -1.291 5.420 -0.174 1.00 0.39 H new ATOM 0 HD11 ILE A 63 -2.723 5.817 -3.889 1.00 1.11 H new ATOM 0 HD12 ILE A 63 -0.948 5.875 -3.769 1.00 1.11 H new ATOM 0 HD13 ILE A 63 -1.891 4.942 -2.582 1.00 1.11 H new ATOM 577 N ASN A 64 0.471 8.324 1.655 1.00 0.25 N ATOM 578 CA ASN A 64 1.723 8.749 2.254 1.00 0.25 C ATOM 579 C ASN A 64 2.616 7.548 2.514 1.00 0.21 C ATOM 580 O ASN A 64 2.416 6.802 3.473 1.00 0.24 O ATOM 581 CB ASN A 64 1.488 9.528 3.549 1.00 0.34 C ATOM 582 CG ASN A 64 0.733 10.836 3.341 1.00 0.57 C ATOM 583 OD1 ASN A 64 0.033 11.311 4.237 1.00 1.22 O ATOM 584 ND2 ASN A 64 0.859 11.428 2.159 1.00 0.53 N ATOM 0 H ASN A 64 -0.121 7.754 2.260 1.00 0.25 H new ATOM 0 HA ASN A 64 2.221 9.416 1.550 1.00 0.25 H new ATOM 0 HB2 ASN A 64 0.930 8.902 4.245 1.00 0.34 H new ATOM 0 HB3 ASN A 64 2.450 9.743 4.015 1.00 0.34 H new ATOM 0 HD21 ASN A 64 0.368 12.302 1.972 1.00 0.53 H new ATOM 0 HD22 ASN A 64 1.447 11.008 1.439 1.00 0.53 H new ATOM 591 N VAL A 65 3.586 7.347 1.641 1.00 0.20 N ATOM 592 CA VAL A 65 4.517 6.243 1.790 1.00 0.18 C ATOM 593 C VAL A 65 5.889 6.788 2.143 1.00 0.20 C ATOM 594 O VAL A 65 6.455 7.595 1.400 1.00 0.25 O ATOM 595 CB VAL A 65 4.620 5.394 0.506 1.00 0.18 C ATOM 596 CG1 VAL A 65 5.302 4.064 0.791 1.00 0.18 C ATOM 597 CG2 VAL A 65 3.250 5.178 -0.119 1.00 0.19 C ATOM 0 H VAL A 65 3.750 7.933 0.822 1.00 0.20 H new ATOM 0 HA VAL A 65 4.144 5.598 2.586 1.00 0.18 H new ATOM 0 HB VAL A 65 5.231 5.942 -0.211 1.00 0.18 H new ATOM 0 HG11 VAL A 65 5.364 3.482 -0.129 1.00 0.18 H new ATOM 0 HG12 VAL A 65 6.306 4.245 1.174 1.00 0.18 H new ATOM 0 HG13 VAL A 65 4.725 3.511 1.532 1.00 0.18 H new ATOM 0 HG21 VAL A 65 3.353 4.577 -1.022 1.00 0.19 H new ATOM 0 HG22 VAL A 65 2.604 4.660 0.590 1.00 0.19 H new ATOM 0 HG23 VAL A 65 2.810 6.142 -0.373 1.00 0.19 H new ATOM 607 N TYR A 66 6.415 6.367 3.278 1.00 0.19 N ATOM 608 CA TYR A 66 7.661 6.912 3.774 1.00 0.21 C ATOM 609 C TYR A 66 8.474 5.875 4.534 1.00 0.21 C ATOM 610 O TYR A 66 7.950 4.891 5.034 1.00 0.24 O ATOM 611 CB TYR A 66 7.390 8.124 4.675 1.00 0.27 C ATOM 612 CG TYR A 66 6.293 7.900 5.699 1.00 0.31 C ATOM 613 CD1 TYR A 66 4.964 8.155 5.381 1.00 0.33 C ATOM 614 CD2 TYR A 66 6.584 7.437 6.975 1.00 0.40 C ATOM 615 CE1 TYR A 66 3.956 7.955 6.306 1.00 0.43 C ATOM 616 CE2 TYR A 66 5.580 7.234 7.907 1.00 0.50 C ATOM 617 CZ TYR A 66 4.269 7.495 7.566 1.00 0.51 C ATOM 618 OH TYR A 66 3.267 7.291 8.489 1.00 0.63 O ATOM 0 H TYR A 66 5.998 5.650 3.872 1.00 0.19 H new ATOM 0 HA TYR A 66 8.246 7.224 2.909 1.00 0.21 H new ATOM 0 HB2 TYR A 66 8.310 8.389 5.196 1.00 0.27 H new ATOM 0 HB3 TYR A 66 7.121 8.975 4.050 1.00 0.27 H new ATOM 0 HD1 TYR A 66 4.714 8.516 4.394 1.00 0.33 H new ATOM 0 HD2 TYR A 66 7.609 7.232 7.245 1.00 0.40 H new ATOM 0 HE1 TYR A 66 2.929 8.158 6.042 1.00 0.43 H new ATOM 0 HE2 TYR A 66 5.822 6.873 8.896 1.00 0.50 H new ATOM 0 HH TYR A 66 3.656 6.964 9.327 1.00 0.63 H new ATOM 628 N SER A 67 9.763 6.110 4.576 1.00 0.21 N ATOM 629 CA SER A 67 10.690 5.341 5.379 1.00 0.24 C ATOM 630 C SER A 67 11.778 6.276 5.861 1.00 0.28 C ATOM 631 O SER A 67 11.644 7.492 5.731 1.00 0.30 O ATOM 632 CB SER A 67 11.305 4.177 4.602 1.00 0.26 C ATOM 633 OG SER A 67 12.181 4.631 3.577 1.00 0.29 O ATOM 0 H SER A 67 10.209 6.856 4.043 1.00 0.21 H new ATOM 0 HA SER A 67 10.148 4.904 6.218 1.00 0.24 H new ATOM 0 HB2 SER A 67 11.852 3.531 5.288 1.00 0.26 H new ATOM 0 HB3 SER A 67 10.511 3.574 4.161 1.00 0.26 H new ATOM 0 HG SER A 67 12.431 3.877 3.003 1.00 0.29 H new ATOM 639 N LYS A 68 12.842 5.730 6.421 1.00 0.33 N ATOM 640 CA LYS A 68 13.940 6.553 6.908 1.00 0.38 C ATOM 641 C LYS A 68 14.671 7.238 5.740 1.00 0.36 C ATOM 642 O LYS A 68 15.587 8.030 5.950 1.00 0.42 O ATOM 643 CB LYS A 68 14.930 5.703 7.716 1.00 0.47 C ATOM 644 CG LYS A 68 14.280 4.671 8.637 1.00 0.63 C ATOM 645 CD LYS A 68 13.066 5.230 9.363 1.00 1.00 C ATOM 646 CE LYS A 68 12.578 4.301 10.465 1.00 1.58 C ATOM 647 NZ LYS A 68 12.341 2.910 9.989 1.00 2.03 N ATOM 0 H LYS A 68 12.972 4.727 6.551 1.00 0.33 H new ATOM 0 HA LYS A 68 13.522 7.323 7.556 1.00 0.38 H new ATOM 0 HB2 LYS A 68 15.594 5.185 7.023 1.00 0.47 H new ATOM 0 HB3 LYS A 68 15.552 6.366 8.317 1.00 0.47 H new ATOM 0 HG2 LYS A 68 13.982 3.801 8.052 1.00 0.63 H new ATOM 0 HG3 LYS A 68 15.012 4.328 9.368 1.00 0.63 H new ATOM 0 HD2 LYS A 68 13.316 6.200 9.792 1.00 1.00 H new ATOM 0 HD3 LYS A 68 12.261 5.396 8.647 1.00 1.00 H new ATOM 0 HE2 LYS A 68 13.313 4.284 11.270 1.00 1.58 H new ATOM 0 HE3 LYS A 68 11.654 4.698 10.885 1.00 1.58 H new ATOM 0 HZ1 LYS A 68 11.518 2.510 10.482 1.00 2.03 H new ATOM 0 HZ2 LYS A 68 12.160 2.920 8.965 1.00 2.03 H new ATOM 0 HZ3 LYS A 68 13.180 2.328 10.187 1.00 2.03 H new ATOM 661 N CYS A 69 14.254 6.935 4.510 1.00 0.36 N ATOM 662 CA CYS A 69 14.904 7.487 3.323 1.00 0.37 C ATOM 663 C CYS A 69 13.892 7.973 2.281 1.00 0.41 C ATOM 664 O CYS A 69 14.046 9.062 1.726 1.00 0.74 O ATOM 665 CB CYS A 69 15.831 6.441 2.713 1.00 0.38 C ATOM 666 SG CYS A 69 17.172 5.906 3.823 1.00 0.38 S ATOM 0 H CYS A 69 13.471 6.312 4.311 1.00 0.36 H new ATOM 0 HA CYS A 69 15.483 8.356 3.635 1.00 0.37 H new ATOM 0 HB2 CYS A 69 15.241 5.570 2.426 1.00 0.38 H new ATOM 0 HB3 CYS A 69 16.268 6.845 1.800 1.00 0.38 H new ATOM 671 N ILE A 70 12.868 7.170 2.004 1.00 0.25 N ATOM 672 CA ILE A 70 11.843 7.549 1.031 1.00 0.22 C ATOM 673 C ILE A 70 10.719 8.292 1.741 1.00 0.23 C ATOM 674 O ILE A 70 10.485 8.081 2.927 1.00 0.27 O ATOM 675 CB ILE A 70 11.293 6.319 0.281 1.00 0.20 C ATOM 676 CG1 ILE A 70 10.404 6.738 -0.881 1.00 0.20 C ATOM 677 CG2 ILE A 70 10.529 5.394 1.210 1.00 0.22 C ATOM 678 CD1 ILE A 70 10.162 5.621 -1.852 1.00 0.23 C ATOM 0 H ILE A 70 12.725 6.257 2.436 1.00 0.25 H new ATOM 0 HA ILE A 70 12.297 8.204 0.288 1.00 0.22 H new ATOM 0 HB ILE A 70 12.152 5.775 -0.113 1.00 0.20 H new ATOM 0 HG12 ILE A 70 9.448 7.092 -0.494 1.00 0.20 H new ATOM 0 HG13 ILE A 70 10.866 7.576 -1.404 1.00 0.20 H new ATOM 0 HG21 ILE A 70 10.156 4.539 0.646 1.00 0.22 H new ATOM 0 HG22 ILE A 70 11.192 5.046 2.002 1.00 0.22 H new ATOM 0 HG23 ILE A 70 9.689 5.932 1.650 1.00 0.22 H new ATOM 0 HD11 ILE A 70 9.522 5.974 -2.661 1.00 0.23 H new ATOM 0 HD12 ILE A 70 11.114 5.284 -2.263 1.00 0.23 H new ATOM 0 HD13 ILE A 70 9.674 4.792 -1.339 1.00 0.23 H new ATOM 690 N SER A 71 10.046 9.169 1.024 1.00 0.24 N ATOM 691 CA SER A 71 8.996 9.985 1.613 1.00 0.28 C ATOM 692 C SER A 71 8.204 10.668 0.508 1.00 0.29 C ATOM 693 O SER A 71 8.695 11.601 -0.130 1.00 0.39 O ATOM 694 CB SER A 71 9.617 11.026 2.560 1.00 0.42 C ATOM 695 OG SER A 71 8.641 11.597 3.415 1.00 1.12 O ATOM 0 H SER A 71 10.206 9.337 0.031 1.00 0.24 H new ATOM 0 HA SER A 71 8.320 9.354 2.189 1.00 0.28 H new ATOM 0 HB2 SER A 71 10.397 10.555 3.159 1.00 0.42 H new ATOM 0 HB3 SER A 71 10.095 11.812 1.975 1.00 0.42 H new ATOM 0 HG SER A 71 9.067 12.253 4.006 1.00 1.12 H new ATOM 701 N GLY A 72 6.994 10.192 0.254 1.00 0.30 N ATOM 702 CA GLY A 72 6.226 10.736 -0.841 1.00 0.42 C ATOM 703 C GLY A 72 4.749 10.845 -0.563 1.00 0.31 C ATOM 704 O GLY A 72 4.223 10.241 0.373 1.00 0.40 O ATOM 0 H GLY A 72 6.537 9.448 0.781 1.00 0.30 H new ATOM 0 HA2 GLY A 72 6.613 11.725 -1.085 1.00 0.42 H new ATOM 0 HA3 GLY A 72 6.374 10.110 -1.721 1.00 0.42 H new ATOM 708 N LYS A 73 4.093 11.619 -1.401 1.00 0.24 N ATOM 709 CA LYS A 73 2.667 11.840 -1.315 1.00 0.23 C ATOM 710 C LYS A 73 2.018 11.336 -2.594 1.00 0.21 C ATOM 711 O LYS A 73 2.677 11.220 -3.612 1.00 0.27 O ATOM 712 CB LYS A 73 2.402 13.336 -1.149 1.00 0.35 C ATOM 713 CG LYS A 73 0.952 13.713 -0.949 1.00 1.00 C ATOM 714 CD LYS A 73 0.611 14.923 -1.775 1.00 0.70 C ATOM 715 CE LYS A 73 0.422 14.536 -3.219 1.00 0.43 C ATOM 716 NZ LYS A 73 -0.136 15.659 -4.017 1.00 0.64 N ATOM 0 H LYS A 73 4.541 12.118 -2.170 1.00 0.24 H new ATOM 0 HA LYS A 73 2.250 11.307 -0.460 1.00 0.23 H new ATOM 0 HB2 LYS A 73 2.976 13.698 -0.296 1.00 0.35 H new ATOM 0 HB3 LYS A 73 2.778 13.856 -2.030 1.00 0.35 H new ATOM 0 HG2 LYS A 73 0.310 12.879 -1.231 1.00 1.00 H new ATOM 0 HG3 LYS A 73 0.764 13.918 0.105 1.00 1.00 H new ATOM 0 HD2 LYS A 73 -0.299 15.387 -1.394 1.00 0.70 H new ATOM 0 HD3 LYS A 73 1.406 15.664 -1.691 1.00 0.70 H new ATOM 0 HE2 LYS A 73 1.378 14.228 -3.642 1.00 0.43 H new ATOM 0 HE3 LYS A 73 -0.246 13.677 -3.282 1.00 0.43 H new ATOM 0 HZ1 LYS A 73 -0.253 15.358 -5.006 1.00 0.64 H new ATOM 0 HZ2 LYS A 73 -1.060 15.936 -3.628 1.00 0.64 H new ATOM 0 HZ3 LYS A 73 0.514 16.470 -3.977 1.00 0.64 H new ATOM 730 N ALA A 74 0.746 11.027 -2.539 1.00 0.21 N ATOM 731 CA ALA A 74 0.002 10.613 -3.719 1.00 0.22 C ATOM 732 C ALA A 74 -1.468 10.898 -3.500 1.00 0.26 C ATOM 733 O ALA A 74 -1.878 11.124 -2.378 1.00 0.41 O ATOM 734 CB ALA A 74 0.220 9.130 -3.997 1.00 0.23 C ATOM 0 H ALA A 74 0.193 11.053 -1.683 1.00 0.21 H new ATOM 0 HA ALA A 74 0.357 11.173 -4.584 1.00 0.22 H new ATOM 0 HB1 ALA A 74 -0.344 8.839 -4.883 1.00 0.23 H new ATOM 0 HB2 ALA A 74 1.281 8.943 -4.165 1.00 0.23 H new ATOM 0 HB3 ALA A 74 -0.120 8.546 -3.142 1.00 0.23 H new ATOM 740 N VAL A 75 -2.255 10.931 -4.554 1.00 0.28 N ATOM 741 CA VAL A 75 -3.697 11.002 -4.400 1.00 0.33 C ATOM 742 C VAL A 75 -4.300 9.763 -5.023 1.00 0.29 C ATOM 743 O VAL A 75 -3.938 9.394 -6.143 1.00 0.29 O ATOM 744 CB VAL A 75 -4.302 12.251 -5.061 1.00 0.43 C ATOM 745 CG1 VAL A 75 -5.787 12.367 -4.756 1.00 0.81 C ATOM 746 CG2 VAL A 75 -3.562 13.505 -4.627 1.00 0.80 C ATOM 0 H VAL A 75 -1.927 10.910 -5.520 1.00 0.28 H new ATOM 0 HA VAL A 75 -3.923 11.065 -3.335 1.00 0.33 H new ATOM 0 HB VAL A 75 -4.189 12.146 -6.140 1.00 0.43 H new ATOM 0 HG11 VAL A 75 -6.188 13.259 -5.236 1.00 0.81 H new ATOM 0 HG12 VAL A 75 -6.306 11.487 -5.135 1.00 0.81 H new ATOM 0 HG13 VAL A 75 -5.933 12.438 -3.678 1.00 0.81 H new ATOM 0 HG21 VAL A 75 -4.008 14.376 -5.108 1.00 0.80 H new ATOM 0 HG22 VAL A 75 -3.632 13.613 -3.545 1.00 0.80 H new ATOM 0 HG23 VAL A 75 -2.514 13.428 -4.917 1.00 0.80 H new ATOM 756 N TYR A 76 -5.194 9.111 -4.314 1.00 0.29 N ATOM 757 CA TYR A 76 -5.692 7.834 -4.775 1.00 0.25 C ATOM 758 C TYR A 76 -7.052 7.948 -5.446 1.00 0.29 C ATOM 759 O TYR A 76 -7.921 8.715 -5.031 1.00 0.42 O ATOM 760 CB TYR A 76 -5.701 6.775 -3.661 1.00 0.29 C ATOM 761 CG TYR A 76 -6.478 7.120 -2.408 1.00 0.38 C ATOM 762 CD1 TYR A 76 -7.866 7.125 -2.403 1.00 0.46 C ATOM 763 CD2 TYR A 76 -5.817 7.406 -1.221 1.00 0.44 C ATOM 764 CE1 TYR A 76 -8.575 7.414 -1.251 1.00 0.57 C ATOM 765 CE2 TYR A 76 -6.517 7.689 -0.063 1.00 0.56 C ATOM 766 CZ TYR A 76 -7.896 7.693 -0.085 1.00 0.64 C ATOM 767 OH TYR A 76 -8.597 7.979 1.063 1.00 0.75 O ATOM 0 H TYR A 76 -5.586 9.436 -3.430 1.00 0.29 H new ATOM 0 HA TYR A 76 -4.990 7.494 -5.536 1.00 0.25 H new ATOM 0 HB2 TYR A 76 -6.108 5.851 -4.072 1.00 0.29 H new ATOM 0 HB3 TYR A 76 -4.669 6.570 -3.377 1.00 0.29 H new ATOM 0 HD1 TYR A 76 -8.401 6.900 -3.314 1.00 0.46 H new ATOM 0 HD2 TYR A 76 -4.737 7.407 -1.202 1.00 0.44 H new ATOM 0 HE1 TYR A 76 -9.655 7.421 -1.265 1.00 0.57 H new ATOM 0 HE2 TYR A 76 -5.987 7.906 0.853 1.00 0.56 H new ATOM 0 HH TYR A 76 -9.168 7.217 1.296 1.00 0.75 H new ATOM 777 N SER A 77 -7.196 7.188 -6.512 1.00 0.25 N ATOM 778 CA SER A 77 -8.430 7.097 -7.260 1.00 0.29 C ATOM 779 C SER A 77 -8.759 5.626 -7.470 1.00 0.23 C ATOM 780 O SER A 77 -7.907 4.765 -7.245 1.00 0.26 O ATOM 781 CB SER A 77 -8.288 7.809 -8.598 1.00 0.39 C ATOM 782 OG SER A 77 -7.695 9.091 -8.441 1.00 0.98 O ATOM 0 H SER A 77 -6.446 6.608 -6.888 1.00 0.25 H new ATOM 0 HA SER A 77 -9.237 7.579 -6.708 1.00 0.29 H new ATOM 0 HB2 SER A 77 -7.680 7.205 -9.271 1.00 0.39 H new ATOM 0 HB3 SER A 77 -9.269 7.914 -9.062 1.00 0.39 H new ATOM 0 HG SER A 77 -7.615 9.524 -9.317 1.00 0.98 H new ATOM 788 N PHE A 78 -9.975 5.332 -7.895 1.00 0.20 N ATOM 789 CA PHE A 78 -10.398 3.951 -8.044 1.00 0.20 C ATOM 790 C PHE A 78 -10.925 3.666 -9.434 1.00 0.22 C ATOM 791 O PHE A 78 -11.526 4.529 -10.073 1.00 0.28 O ATOM 792 CB PHE A 78 -11.476 3.607 -7.022 1.00 0.24 C ATOM 793 CG PHE A 78 -10.943 3.394 -5.641 1.00 0.29 C ATOM 794 CD1 PHE A 78 -10.414 2.167 -5.284 1.00 0.36 C ATOM 795 CD2 PHE A 78 -10.970 4.410 -4.701 1.00 0.37 C ATOM 796 CE1 PHE A 78 -9.923 1.955 -4.016 1.00 0.46 C ATOM 797 CE2 PHE A 78 -10.478 4.204 -3.431 1.00 0.47 C ATOM 798 CZ PHE A 78 -9.955 2.973 -3.089 1.00 0.50 C ATOM 0 H PHE A 78 -10.682 6.025 -8.141 1.00 0.20 H new ATOM 0 HA PHE A 78 -9.517 3.331 -7.876 1.00 0.20 H new ATOM 0 HB2 PHE A 78 -12.213 4.410 -6.999 1.00 0.24 H new ATOM 0 HB3 PHE A 78 -11.997 2.706 -7.345 1.00 0.24 H new ATOM 0 HD1 PHE A 78 -10.386 1.366 -6.008 1.00 0.36 H new ATOM 0 HD2 PHE A 78 -11.381 5.373 -4.966 1.00 0.37 H new ATOM 0 HE1 PHE A 78 -9.513 0.992 -3.748 1.00 0.46 H new ATOM 0 HE2 PHE A 78 -10.501 5.003 -2.705 1.00 0.47 H new ATOM 0 HZ PHE A 78 -9.570 2.808 -2.093 1.00 0.50 H new ATOM 808 N ASN A 79 -10.683 2.453 -9.899 1.00 0.21 N ATOM 809 CA ASN A 79 -11.302 1.974 -11.119 1.00 0.23 C ATOM 810 C ASN A 79 -11.692 0.517 -10.945 1.00 0.26 C ATOM 811 O ASN A 79 -10.826 -0.354 -10.897 1.00 0.31 O ATOM 812 CB ASN A 79 -10.354 2.106 -12.307 1.00 0.31 C ATOM 813 CG ASN A 79 -11.056 1.834 -13.624 1.00 0.45 C ATOM 814 OD1 ASN A 79 -12.242 2.129 -13.780 1.00 0.77 O ATOM 815 ND2 ASN A 79 -10.341 1.256 -14.575 1.00 0.59 N ATOM 0 H ASN A 79 -10.061 1.782 -9.448 1.00 0.21 H new ATOM 0 HA ASN A 79 -12.186 2.580 -11.317 1.00 0.23 H new ATOM 0 HB2 ASN A 79 -9.929 3.110 -12.323 1.00 0.31 H new ATOM 0 HB3 ASN A 79 -9.524 1.410 -12.188 1.00 0.31 H new ATOM 0 HD21 ASN A 79 -10.769 1.040 -15.475 1.00 0.59 H new ATOM 0 HD22 ASN A 79 -9.361 1.027 -14.408 1.00 0.59 H new ATOM 822 N ALA A 80 -12.993 0.266 -10.841 1.00 0.28 N ATOM 823 CA ALA A 80 -13.524 -1.091 -10.708 1.00 0.38 C ATOM 824 C ALA A 80 -12.817 -1.878 -9.599 1.00 0.46 C ATOM 825 O ALA A 80 -12.431 -3.033 -9.792 1.00 0.95 O ATOM 826 CB ALA A 80 -13.418 -1.828 -12.036 1.00 0.45 C ATOM 0 H ALA A 80 -13.709 0.993 -10.846 1.00 0.28 H new ATOM 0 HA ALA A 80 -14.574 -1.009 -10.427 1.00 0.38 H new ATOM 0 HB1 ALA A 80 -13.816 -2.837 -11.925 1.00 0.45 H new ATOM 0 HB2 ALA A 80 -13.989 -1.294 -12.795 1.00 0.45 H new ATOM 0 HB3 ALA A 80 -12.373 -1.882 -12.340 1.00 0.45 H new ATOM 832 N GLY A 81 -12.634 -1.241 -8.447 1.00 0.24 N ATOM 833 CA GLY A 81 -12.016 -1.905 -7.317 1.00 0.21 C ATOM 834 C GLY A 81 -10.514 -1.711 -7.261 1.00 0.21 C ATOM 835 O GLY A 81 -9.876 -2.028 -6.261 1.00 0.31 O ATOM 0 H GLY A 81 -12.905 -0.272 -8.277 1.00 0.24 H new ATOM 0 HA2 GLY A 81 -12.459 -1.528 -6.395 1.00 0.21 H new ATOM 0 HA3 GLY A 81 -12.237 -2.971 -7.365 1.00 0.21 H new ATOM 839 N LYS A 82 -9.943 -1.189 -8.332 1.00 0.19 N ATOM 840 CA LYS A 82 -8.508 -1.009 -8.409 1.00 0.20 C ATOM 841 C LYS A 82 -8.089 0.339 -7.832 1.00 0.20 C ATOM 842 O LYS A 82 -8.481 1.395 -8.330 1.00 0.26 O ATOM 843 CB LYS A 82 -8.047 -1.156 -9.856 1.00 0.23 C ATOM 844 CG LYS A 82 -8.269 -2.554 -10.401 1.00 0.26 C ATOM 845 CD LYS A 82 -7.435 -3.564 -9.639 1.00 0.23 C ATOM 846 CE LYS A 82 -7.780 -4.988 -10.031 1.00 0.41 C ATOM 847 NZ LYS A 82 -6.718 -5.944 -9.627 1.00 1.32 N ATOM 0 H LYS A 82 -10.454 -0.883 -9.160 1.00 0.19 H new ATOM 0 HA LYS A 82 -8.027 -1.780 -7.808 1.00 0.20 H new ATOM 0 HB2 LYS A 82 -8.582 -0.439 -10.478 1.00 0.23 H new ATOM 0 HB3 LYS A 82 -6.988 -0.908 -9.923 1.00 0.23 H new ATOM 0 HG2 LYS A 82 -9.324 -2.816 -10.326 1.00 0.26 H new ATOM 0 HG3 LYS A 82 -8.008 -2.583 -11.459 1.00 0.26 H new ATOM 0 HD2 LYS A 82 -6.378 -3.380 -9.830 1.00 0.23 H new ATOM 0 HD3 LYS A 82 -7.593 -3.433 -8.569 1.00 0.23 H new ATOM 0 HE2 LYS A 82 -8.723 -5.275 -9.566 1.00 0.41 H new ATOM 0 HE3 LYS A 82 -7.927 -5.043 -11.110 1.00 0.41 H new ATOM 0 HZ1 LYS A 82 -6.344 -6.424 -10.470 1.00 1.32 H new ATOM 0 HZ2 LYS A 82 -5.949 -5.429 -9.153 1.00 1.32 H new ATOM 0 HZ3 LYS A 82 -7.116 -6.649 -8.975 1.00 1.32 H new ATOM 861 N PHE A 83 -7.293 0.274 -6.776 1.00 0.16 N ATOM 862 CA PHE A 83 -6.831 1.447 -6.050 1.00 0.16 C ATOM 863 C PHE A 83 -5.521 1.959 -6.640 1.00 0.16 C ATOM 864 O PHE A 83 -4.531 1.230 -6.711 1.00 0.17 O ATOM 865 CB PHE A 83 -6.696 1.069 -4.558 1.00 0.15 C ATOM 866 CG PHE A 83 -5.644 1.806 -3.771 1.00 0.16 C ATOM 867 CD1 PHE A 83 -5.918 3.036 -3.196 1.00 0.18 C ATOM 868 CD2 PHE A 83 -4.382 1.249 -3.588 1.00 0.19 C ATOM 869 CE1 PHE A 83 -4.954 3.698 -2.461 1.00 0.20 C ATOM 870 CE2 PHE A 83 -3.416 1.910 -2.851 1.00 0.22 C ATOM 871 CZ PHE A 83 -3.706 3.135 -2.288 1.00 0.22 C ATOM 0 H PHE A 83 -6.945 -0.606 -6.394 1.00 0.16 H new ATOM 0 HA PHE A 83 -7.548 2.263 -6.141 1.00 0.16 H new ATOM 0 HB2 PHE A 83 -7.660 1.233 -4.076 1.00 0.15 H new ATOM 0 HB3 PHE A 83 -6.485 0.002 -4.494 1.00 0.15 H new ATOM 0 HD1 PHE A 83 -6.894 3.481 -3.323 1.00 0.18 H new ATOM 0 HD2 PHE A 83 -4.154 0.289 -4.027 1.00 0.19 H new ATOM 0 HE1 PHE A 83 -5.177 4.658 -2.021 1.00 0.20 H new ATOM 0 HE2 PHE A 83 -2.439 1.469 -2.717 1.00 0.22 H new ATOM 0 HZ PHE A 83 -2.955 3.654 -1.711 1.00 0.22 H new ATOM 881 N MET A 84 -5.539 3.209 -7.093 1.00 0.19 N ATOM 882 CA MET A 84 -4.390 3.806 -7.766 1.00 0.19 C ATOM 883 C MET A 84 -3.989 5.109 -7.103 1.00 0.24 C ATOM 884 O MET A 84 -4.838 5.831 -6.601 1.00 0.44 O ATOM 885 CB MET A 84 -4.737 4.073 -9.226 1.00 0.22 C ATOM 886 CG MET A 84 -5.408 2.903 -9.895 1.00 0.21 C ATOM 887 SD MET A 84 -5.925 3.251 -11.578 1.00 0.25 S ATOM 888 CE MET A 84 -6.448 1.610 -12.026 1.00 0.23 C ATOM 0 H MET A 84 -6.342 3.832 -7.005 1.00 0.19 H new ATOM 0 HA MET A 84 -3.554 3.109 -7.700 1.00 0.19 H new ATOM 0 HB2 MET A 84 -5.392 4.942 -9.285 1.00 0.22 H new ATOM 0 HB3 MET A 84 -3.826 4.322 -9.770 1.00 0.22 H new ATOM 0 HG2 MET A 84 -4.724 2.055 -9.900 1.00 0.21 H new ATOM 0 HG3 MET A 84 -6.278 2.607 -9.308 1.00 0.21 H new ATOM 0 HE1 MET A 84 -7.274 1.672 -12.734 1.00 0.23 H new ATOM 0 HE2 MET A 84 -5.616 1.076 -12.485 1.00 0.23 H new ATOM 0 HE3 MET A 84 -6.774 1.076 -11.134 1.00 0.23 H new ATOM 898 N GLY A 85 -2.702 5.416 -7.123 1.00 0.19 N ATOM 899 CA GLY A 85 -2.222 6.641 -6.511 1.00 0.23 C ATOM 900 C GLY A 85 -0.975 7.165 -7.179 1.00 0.30 C ATOM 901 O GLY A 85 0.097 6.607 -6.994 1.00 0.61 O ATOM 0 H GLY A 85 -1.978 4.839 -7.552 1.00 0.19 H new ATOM 0 HA2 GLY A 85 -3.004 7.399 -6.560 1.00 0.23 H new ATOM 0 HA3 GLY A 85 -2.018 6.461 -5.455 1.00 0.23 H new ATOM 905 N ASN A 86 -1.108 8.228 -7.962 1.00 0.27 N ATOM 906 CA ASN A 86 0.047 8.812 -8.641 1.00 0.30 C ATOM 907 C ASN A 86 0.939 9.503 -7.618 1.00 0.24 C ATOM 908 O ASN A 86 0.479 10.370 -6.875 1.00 0.23 O ATOM 909 CB ASN A 86 -0.390 9.807 -9.721 1.00 0.41 C ATOM 910 CG ASN A 86 0.751 10.193 -10.644 1.00 0.58 C ATOM 911 OD1 ASN A 86 0.953 9.577 -11.692 1.00 1.51 O ATOM 912 ND2 ASN A 86 1.506 11.205 -10.261 1.00 0.93 N ATOM 0 H ASN A 86 -1.993 8.701 -8.143 1.00 0.27 H new ATOM 0 HA ASN A 86 0.603 8.013 -9.131 1.00 0.30 H new ATOM 0 HB2 ASN A 86 -1.198 9.371 -10.308 1.00 0.41 H new ATOM 0 HB3 ASN A 86 -0.789 10.703 -9.246 1.00 0.41 H new ATOM 0 HD21 ASN A 86 2.291 11.504 -10.840 1.00 0.93 H new ATOM 0 HD22 ASN A 86 1.305 11.689 -9.386 1.00 0.93 H new ATOM 919 N PHE A 87 2.210 9.134 -7.595 1.00 0.23 N ATOM 920 CA PHE A 87 3.080 9.486 -6.485 1.00 0.20 C ATOM 921 C PHE A 87 3.923 10.728 -6.714 1.00 0.22 C ATOM 922 O PHE A 87 4.241 11.110 -7.843 1.00 0.30 O ATOM 923 CB PHE A 87 3.997 8.322 -6.140 1.00 0.24 C ATOM 924 CG PHE A 87 3.348 7.302 -5.261 1.00 0.20 C ATOM 925 CD1 PHE A 87 3.326 7.466 -3.890 1.00 0.23 C ATOM 926 CD2 PHE A 87 2.775 6.168 -5.811 1.00 0.23 C ATOM 927 CE1 PHE A 87 2.743 6.517 -3.076 1.00 0.27 C ATOM 928 CE2 PHE A 87 2.188 5.214 -5.006 1.00 0.27 C ATOM 929 CZ PHE A 87 2.115 5.430 -3.621 1.00 0.28 C ATOM 0 H PHE A 87 2.661 8.592 -8.332 1.00 0.23 H new ATOM 0 HA PHE A 87 2.407 9.714 -5.658 1.00 0.20 H new ATOM 0 HB2 PHE A 87 4.326 7.842 -7.061 1.00 0.24 H new ATOM 0 HB3 PHE A 87 4.889 8.705 -5.644 1.00 0.24 H new ATOM 0 HD1 PHE A 87 3.770 8.347 -3.450 1.00 0.23 H new ATOM 0 HD2 PHE A 87 2.788 6.029 -6.882 1.00 0.23 H new ATOM 0 HE1 PHE A 87 2.782 6.632 -2.003 1.00 0.27 H new ATOM 0 HE2 PHE A 87 1.788 4.308 -5.438 1.00 0.27 H new ATOM 0 HZ PHE A 87 1.568 4.744 -2.991 1.00 0.28 H new ATOM 939 N ASN A 88 4.263 11.328 -5.585 1.00 0.21 N ATOM 940 CA ASN A 88 5.170 12.459 -5.481 1.00 0.26 C ATOM 941 C ASN A 88 6.238 12.118 -4.444 1.00 0.27 C ATOM 942 O ASN A 88 6.325 12.768 -3.402 1.00 0.42 O ATOM 943 CB ASN A 88 4.446 13.716 -5.005 1.00 0.34 C ATOM 944 CG ASN A 88 3.520 14.342 -6.031 1.00 1.15 C ATOM 945 OD1 ASN A 88 2.928 13.664 -6.869 1.00 2.02 O ATOM 946 ND2 ASN A 88 3.376 15.656 -5.953 1.00 1.66 N ATOM 0 H ASN A 88 3.900 11.028 -4.680 1.00 0.21 H new ATOM 0 HA ASN A 88 5.597 12.650 -6.465 1.00 0.26 H new ATOM 0 HB2 ASN A 88 3.867 13.470 -4.115 1.00 0.34 H new ATOM 0 HB3 ASN A 88 5.189 14.456 -4.707 1.00 0.34 H new ATOM 0 HD21 ASN A 88 2.756 16.141 -6.602 1.00 1.66 H new ATOM 0 HD22 ASN A 88 3.885 16.184 -5.243 1.00 1.66 H new ATOM 953 N VAL A 89 7.019 11.083 -4.704 1.00 0.24 N ATOM 954 CA VAL A 89 7.913 10.538 -3.683 1.00 0.24 C ATOM 955 C VAL A 89 9.310 11.140 -3.758 1.00 0.30 C ATOM 956 O VAL A 89 9.842 11.391 -4.839 1.00 0.34 O ATOM 957 CB VAL A 89 8.060 8.999 -3.762 1.00 0.24 C ATOM 958 CG1 VAL A 89 8.203 8.406 -2.379 1.00 0.28 C ATOM 959 CG2 VAL A 89 6.893 8.350 -4.491 1.00 0.25 C ATOM 0 H VAL A 89 7.056 10.603 -5.603 1.00 0.24 H new ATOM 0 HA VAL A 89 7.439 10.806 -2.739 1.00 0.24 H new ATOM 0 HB VAL A 89 8.964 8.793 -4.335 1.00 0.24 H new ATOM 0 HG11 VAL A 89 8.305 7.324 -2.456 1.00 0.28 H new ATOM 0 HG12 VAL A 89 9.087 8.820 -1.895 1.00 0.28 H new ATOM 0 HG13 VAL A 89 7.320 8.646 -1.787 1.00 0.28 H new ATOM 0 HG21 VAL A 89 7.039 7.270 -4.522 1.00 0.25 H new ATOM 0 HG22 VAL A 89 5.965 8.576 -3.966 1.00 0.25 H new ATOM 0 HG23 VAL A 89 6.838 8.738 -5.508 1.00 0.25 H new ATOM 969 N LYS A 90 9.886 11.368 -2.589 1.00 0.33 N ATOM 970 CA LYS A 90 11.279 11.756 -2.464 1.00 0.41 C ATOM 971 C LYS A 90 12.078 10.506 -2.120 1.00 0.33 C ATOM 972 O LYS A 90 11.838 9.880 -1.088 1.00 0.35 O ATOM 973 CB LYS A 90 11.425 12.824 -1.378 1.00 0.54 C ATOM 974 CG LYS A 90 12.715 13.628 -1.445 1.00 0.99 C ATOM 975 CD LYS A 90 13.908 12.858 -0.903 1.00 1.48 C ATOM 976 CE LYS A 90 15.147 13.739 -0.836 1.00 2.27 C ATOM 977 NZ LYS A 90 16.349 12.989 -0.379 1.00 2.81 N ATOM 0 H LYS A 90 9.397 11.288 -1.697 1.00 0.33 H new ATOM 0 HA LYS A 90 11.651 12.184 -3.395 1.00 0.41 H new ATOM 0 HB2 LYS A 90 10.581 13.511 -1.447 1.00 0.54 H new ATOM 0 HB3 LYS A 90 11.364 12.341 -0.403 1.00 0.54 H new ATOM 0 HG2 LYS A 90 12.909 13.912 -2.479 1.00 0.99 H new ATOM 0 HG3 LYS A 90 12.594 14.551 -0.878 1.00 0.99 H new ATOM 0 HD2 LYS A 90 13.676 12.476 0.091 1.00 1.48 H new ATOM 0 HD3 LYS A 90 14.106 11.995 -1.538 1.00 1.48 H new ATOM 0 HE2 LYS A 90 15.340 14.166 -1.820 1.00 2.27 H new ATOM 0 HE3 LYS A 90 14.962 14.572 -0.158 1.00 2.27 H new ATOM 0 HZ1 LYS A 90 17.167 13.630 -0.349 1.00 2.81 H new ATOM 0 HZ2 LYS A 90 16.177 12.603 0.571 1.00 2.81 H new ATOM 0 HZ3 LYS A 90 16.544 12.210 -1.039 1.00 2.81 H new ATOM 991 N GLU A 91 13.005 10.134 -2.982 1.00 0.41 N ATOM 992 CA GLU A 91 13.669 8.846 -2.866 1.00 0.44 C ATOM 993 C GLU A 91 15.180 8.986 -2.997 1.00 0.46 C ATOM 994 O GLU A 91 15.683 9.854 -3.709 1.00 0.62 O ATOM 995 CB GLU A 91 13.142 7.908 -3.936 1.00 0.72 C ATOM 996 CG GLU A 91 13.250 6.436 -3.612 1.00 0.52 C ATOM 997 CD GLU A 91 12.754 5.570 -4.753 1.00 1.20 C ATOM 998 OE1 GLU A 91 11.527 5.378 -4.870 1.00 1.57 O ATOM 999 OE2 GLU A 91 13.584 5.104 -5.557 1.00 1.68 O ATOM 0 H GLU A 91 13.316 10.703 -3.769 1.00 0.41 H new ATOM 0 HA GLU A 91 13.456 8.438 -1.878 1.00 0.44 H new ATOM 0 HB2 GLU A 91 12.095 8.147 -4.122 1.00 0.72 H new ATOM 0 HB3 GLU A 91 13.682 8.100 -4.863 1.00 0.72 H new ATOM 0 HG2 GLU A 91 14.288 6.188 -3.392 1.00 0.52 H new ATOM 0 HG3 GLU A 91 12.673 6.218 -2.713 1.00 0.52 H new ATOM 1006 N VAL A 92 15.881 8.131 -2.284 1.00 0.45 N ATOM 1007 CA VAL A 92 17.336 8.115 -2.272 1.00 0.43 C ATOM 1008 C VAL A 92 17.843 6.855 -2.959 1.00 0.41 C ATOM 1009 O VAL A 92 17.119 5.875 -3.086 1.00 0.40 O ATOM 1010 CB VAL A 92 17.891 8.151 -0.830 1.00 0.44 C ATOM 1011 CG1 VAL A 92 17.350 9.339 -0.087 1.00 0.53 C ATOM 1012 CG2 VAL A 92 17.563 6.884 -0.087 1.00 0.40 C ATOM 0 H VAL A 92 15.457 7.419 -1.689 1.00 0.45 H new ATOM 0 HA VAL A 92 17.680 9.003 -2.802 1.00 0.43 H new ATOM 0 HB VAL A 92 18.976 8.237 -0.894 1.00 0.44 H new ATOM 0 HG11 VAL A 92 17.751 9.348 0.926 1.00 0.53 H new ATOM 0 HG12 VAL A 92 17.643 10.254 -0.602 1.00 0.53 H new ATOM 0 HG13 VAL A 92 16.262 9.278 -0.046 1.00 0.53 H new ATOM 0 HG21 VAL A 92 17.967 6.940 0.924 1.00 0.40 H new ATOM 0 HG22 VAL A 92 16.481 6.760 -0.039 1.00 0.40 H new ATOM 0 HG23 VAL A 92 18.003 6.033 -0.607 1.00 0.40 H new ATOM 1022 N ASP A 93 19.067 6.881 -3.428 1.00 0.44 N ATOM 1023 CA ASP A 93 19.695 5.689 -3.948 1.00 0.45 C ATOM 1024 C ASP A 93 20.784 5.231 -2.988 1.00 0.46 C ATOM 1025 O ASP A 93 21.516 6.050 -2.432 1.00 0.57 O ATOM 1026 CB ASP A 93 20.247 5.968 -5.341 1.00 0.56 C ATOM 1027 CG ASP A 93 21.516 6.797 -5.341 1.00 1.17 C ATOM 1028 OD1 ASP A 93 21.421 8.036 -5.210 1.00 1.78 O ATOM 1029 OD2 ASP A 93 22.611 6.213 -5.493 1.00 1.83 O ATOM 0 H ASP A 93 19.650 7.717 -3.461 1.00 0.44 H new ATOM 0 HA ASP A 93 18.964 4.885 -4.035 1.00 0.45 H new ATOM 0 HB2 ASP A 93 20.444 5.019 -5.840 1.00 0.56 H new ATOM 0 HB3 ASP A 93 19.486 6.485 -5.926 1.00 0.56 H new ATOM 1034 N GLY A 94 20.859 3.930 -2.760 1.00 0.42 N ATOM 1035 CA GLY A 94 21.791 3.415 -1.779 1.00 0.43 C ATOM 1036 C GLY A 94 21.092 2.919 -0.524 1.00 0.40 C ATOM 1037 O GLY A 94 21.562 1.993 0.134 1.00 0.48 O ATOM 0 H GLY A 94 20.295 3.224 -3.233 1.00 0.42 H new ATOM 0 HA2 GLY A 94 22.365 2.599 -2.219 1.00 0.43 H new ATOM 0 HA3 GLY A 94 22.502 4.197 -1.511 1.00 0.43 H new ATOM 1041 N CYS A 95 19.958 3.526 -0.197 1.00 0.33 N ATOM 1042 CA CYS A 95 19.201 3.150 0.998 1.00 0.31 C ATOM 1043 C CYS A 95 18.240 2.032 0.650 1.00 0.27 C ATOM 1044 O CYS A 95 18.015 1.109 1.428 1.00 0.32 O ATOM 1045 CB CYS A 95 18.432 4.353 1.548 1.00 0.33 C ATOM 1046 SG CYS A 95 17.642 4.051 3.162 1.00 0.42 S ATOM 0 H CYS A 95 19.539 4.281 -0.740 1.00 0.33 H new ATOM 0 HA CYS A 95 19.895 2.809 1.766 1.00 0.31 H new ATOM 0 HB2 CYS A 95 19.116 5.197 1.642 1.00 0.33 H new ATOM 0 HB3 CYS A 95 17.666 4.642 0.828 1.00 0.33 H new ATOM 1051 N PHE A 96 17.691 2.113 -0.547 1.00 0.24 N ATOM 1052 CA PHE A 96 16.881 1.038 -1.082 1.00 0.23 C ATOM 1053 C PHE A 96 17.786 0.156 -1.931 1.00 0.24 C ATOM 1054 O PHE A 96 17.352 -0.421 -2.923 1.00 0.23 O ATOM 1055 CB PHE A 96 15.713 1.588 -1.919 1.00 0.24 C ATOM 1056 CG PHE A 96 15.074 2.807 -1.322 1.00 0.23 C ATOM 1057 CD1 PHE A 96 15.648 4.027 -1.541 1.00 0.30 C ATOM 1058 CD2 PHE A 96 13.937 2.744 -0.530 1.00 0.21 C ATOM 1059 CE1 PHE A 96 15.122 5.171 -0.989 1.00 0.35 C ATOM 1060 CE2 PHE A 96 13.403 3.885 0.020 1.00 0.24 C ATOM 1061 CZ PHE A 96 14.005 5.099 -0.206 1.00 0.31 C ATOM 0 H PHE A 96 17.792 2.915 -1.168 1.00 0.24 H new ATOM 0 HA PHE A 96 16.443 0.460 -0.268 1.00 0.23 H new ATOM 0 HB2 PHE A 96 16.074 1.829 -2.919 1.00 0.24 H new ATOM 0 HB3 PHE A 96 14.958 0.810 -2.032 1.00 0.24 H new ATOM 0 HD1 PHE A 96 16.531 4.094 -2.159 1.00 0.30 H new ATOM 0 HD2 PHE A 96 13.467 1.790 -0.344 1.00 0.21 H new ATOM 0 HE1 PHE A 96 15.592 6.126 -1.174 1.00 0.35 H new ATOM 0 HE2 PHE A 96 12.512 3.827 0.628 1.00 0.24 H new ATOM 0 HZ PHE A 96 13.595 5.996 0.235 1.00 0.31 H new ATOM 1071 N MET A 97 19.055 0.068 -1.511 1.00 0.27 N ATOM 1072 CA MET A 97 20.084 -0.661 -2.239 1.00 0.29 C ATOM 1073 C MET A 97 19.941 -0.441 -3.741 1.00 0.31 C ATOM 1074 O MET A 97 20.002 0.695 -4.212 1.00 0.40 O ATOM 1075 CB MET A 97 20.029 -2.147 -1.877 1.00 0.29 C ATOM 1076 CG MET A 97 20.370 -2.420 -0.421 1.00 0.33 C ATOM 1077 SD MET A 97 20.972 -4.100 -0.139 1.00 0.45 S ATOM 1078 CE MET A 97 19.561 -5.072 -0.662 1.00 1.22 C ATOM 0 H MET A 97 19.391 0.505 -0.653 1.00 0.27 H new ATOM 0 HA MET A 97 21.063 -0.279 -1.948 1.00 0.29 H new ATOM 0 HB2 MET A 97 19.030 -2.529 -2.088 1.00 0.29 H new ATOM 0 HB3 MET A 97 20.722 -2.696 -2.515 1.00 0.29 H new ATOM 0 HG2 MET A 97 21.127 -1.709 -0.092 1.00 0.33 H new ATOM 0 HG3 MET A 97 19.485 -2.250 0.192 1.00 0.33 H new ATOM 0 HE1 MET A 97 19.898 -6.057 -0.987 1.00 1.22 H new ATOM 0 HE2 MET A 97 18.866 -5.182 0.171 1.00 1.22 H new ATOM 0 HE3 MET A 97 19.059 -4.569 -1.489 1.00 1.22 H new ATOM 1088 N ASP A 98 19.737 -1.516 -4.482 1.00 0.30 N ATOM 1089 CA ASP A 98 19.398 -1.413 -5.891 1.00 0.31 C ATOM 1090 C ASP A 98 18.094 -2.127 -6.150 1.00 0.26 C ATOM 1091 O ASP A 98 17.176 -1.572 -6.748 1.00 0.25 O ATOM 1092 CB ASP A 98 20.496 -2.018 -6.771 1.00 0.40 C ATOM 1093 CG ASP A 98 21.802 -1.253 -6.716 1.00 1.01 C ATOM 1094 OD1 ASP A 98 21.857 -0.126 -7.253 1.00 1.64 O ATOM 1095 OD2 ASP A 98 22.774 -1.767 -6.124 1.00 1.19 O ATOM 0 H ASP A 98 19.800 -2.472 -4.131 1.00 0.30 H new ATOM 0 HA ASP A 98 19.301 -0.357 -6.143 1.00 0.31 H new ATOM 0 HB2 ASP A 98 20.674 -3.048 -6.461 1.00 0.40 H new ATOM 0 HB3 ASP A 98 20.147 -2.052 -7.803 1.00 0.40 H new ATOM 1100 N ALA A 99 17.994 -3.338 -5.635 1.00 0.24 N ATOM 1101 CA ALA A 99 16.868 -4.192 -5.937 1.00 0.24 C ATOM 1102 C ALA A 99 15.671 -3.795 -5.101 1.00 0.20 C ATOM 1103 O ALA A 99 14.530 -4.025 -5.481 1.00 0.20 O ATOM 1104 CB ALA A 99 17.225 -5.649 -5.717 1.00 0.28 C ATOM 0 H ALA A 99 18.682 -3.750 -5.005 1.00 0.24 H new ATOM 0 HA ALA A 99 16.609 -4.067 -6.988 1.00 0.24 H new ATOM 0 HB1 ALA A 99 16.363 -6.274 -5.950 1.00 0.28 H new ATOM 0 HB2 ALA A 99 18.057 -5.922 -6.366 1.00 0.28 H new ATOM 0 HB3 ALA A 99 17.512 -5.800 -4.676 1.00 0.28 H new ATOM 1110 N GLN A 100 15.948 -3.186 -3.961 1.00 0.18 N ATOM 1111 CA GLN A 100 14.900 -2.680 -3.092 1.00 0.16 C ATOM 1112 C GLN A 100 14.239 -1.492 -3.764 1.00 0.14 C ATOM 1113 O GLN A 100 13.027 -1.319 -3.718 1.00 0.13 O ATOM 1114 CB GLN A 100 15.466 -2.246 -1.743 1.00 0.19 C ATOM 1115 CG GLN A 100 16.434 -3.241 -1.117 1.00 0.23 C ATOM 1116 CD GLN A 100 16.802 -2.896 0.316 1.00 0.29 C ATOM 1117 OE1 GLN A 100 17.087 -3.773 1.125 1.00 0.83 O ATOM 1118 NE2 GLN A 100 16.797 -1.611 0.642 1.00 1.27 N ATOM 0 H GLN A 100 16.895 -3.030 -3.615 1.00 0.18 H new ATOM 0 HA GLN A 100 14.175 -3.475 -2.918 1.00 0.16 H new ATOM 0 HB2 GLN A 100 15.976 -1.291 -1.867 1.00 0.19 H new ATOM 0 HB3 GLN A 100 14.639 -2.079 -1.053 1.00 0.19 H new ATOM 0 HG2 GLN A 100 15.989 -4.236 -1.142 1.00 0.23 H new ATOM 0 HG3 GLN A 100 17.342 -3.283 -1.719 1.00 0.23 H new ATOM 0 HE21 GLN A 100 16.555 -0.909 -0.057 1.00 1.27 H new ATOM 0 HE22 GLN A 100 17.035 -1.325 1.592 1.00 1.27 H new ATOM 1127 N LYS A 101 15.074 -0.673 -4.379 1.00 0.16 N ATOM 1128 CA LYS A 101 14.626 0.471 -5.150 1.00 0.17 C ATOM 1129 C LYS A 101 13.765 0.002 -6.313 1.00 0.17 C ATOM 1130 O LYS A 101 12.658 0.492 -6.522 1.00 0.17 O ATOM 1131 CB LYS A 101 15.841 1.235 -5.668 1.00 0.23 C ATOM 1132 CG LYS A 101 15.487 2.553 -6.296 1.00 0.28 C ATOM 1133 CD LYS A 101 16.716 3.281 -6.813 1.00 0.50 C ATOM 1134 CE LYS A 101 16.429 4.754 -7.054 1.00 1.21 C ATOM 1135 NZ LYS A 101 15.094 4.971 -7.675 1.00 1.85 N ATOM 0 H LYS A 101 16.088 -0.785 -4.357 1.00 0.16 H new ATOM 0 HA LYS A 101 14.031 1.130 -4.518 1.00 0.17 H new ATOM 0 HB2 LYS A 101 16.533 1.407 -4.843 1.00 0.23 H new ATOM 0 HB3 LYS A 101 16.364 0.620 -6.400 1.00 0.23 H new ATOM 0 HG2 LYS A 101 14.790 2.388 -7.118 1.00 0.28 H new ATOM 0 HG3 LYS A 101 14.975 3.178 -5.564 1.00 0.28 H new ATOM 0 HD2 LYS A 101 17.529 3.180 -6.094 1.00 0.50 H new ATOM 0 HD3 LYS A 101 17.051 2.818 -7.741 1.00 0.50 H new ATOM 0 HE2 LYS A 101 16.480 5.292 -6.107 1.00 1.21 H new ATOM 0 HE3 LYS A 101 17.201 5.172 -7.700 1.00 1.21 H new ATOM 0 HZ1 LYS A 101 15.052 5.927 -8.082 1.00 1.85 H new ATOM 0 HZ2 LYS A 101 14.942 4.268 -8.426 1.00 1.85 H new ATOM 0 HZ3 LYS A 101 14.354 4.870 -6.951 1.00 1.85 H new ATOM 1149 N ILE A 102 14.305 -0.939 -7.073 1.00 0.17 N ATOM 1150 CA ILE A 102 13.549 -1.637 -8.107 1.00 0.18 C ATOM 1151 C ILE A 102 12.231 -2.183 -7.556 1.00 0.15 C ATOM 1152 O ILE A 102 11.177 -1.992 -8.158 1.00 0.15 O ATOM 1153 CB ILE A 102 14.375 -2.789 -8.691 1.00 0.20 C ATOM 1154 CG1 ILE A 102 15.674 -2.231 -9.255 1.00 0.23 C ATOM 1155 CG2 ILE A 102 13.598 -3.530 -9.773 1.00 0.21 C ATOM 1156 CD1 ILE A 102 16.714 -3.286 -9.545 1.00 0.25 C ATOM 0 H ILE A 102 15.276 -1.241 -6.992 1.00 0.17 H new ATOM 0 HA ILE A 102 13.326 -0.917 -8.894 1.00 0.18 H new ATOM 0 HB ILE A 102 14.596 -3.505 -7.899 1.00 0.20 H new ATOM 0 HG12 ILE A 102 15.456 -1.686 -10.174 1.00 0.23 H new ATOM 0 HG13 ILE A 102 16.087 -1.511 -8.548 1.00 0.23 H new ATOM 0 HG21 ILE A 102 14.209 -4.341 -10.169 1.00 0.21 H new ATOM 0 HG22 ILE A 102 12.682 -3.940 -9.347 1.00 0.21 H new ATOM 0 HG23 ILE A 102 13.347 -2.839 -10.578 1.00 0.21 H new ATOM 0 HD11 ILE A 102 17.611 -2.813 -9.944 1.00 0.25 H new ATOM 0 HD12 ILE A 102 16.962 -3.815 -8.625 1.00 0.25 H new ATOM 0 HD13 ILE A 102 16.321 -3.993 -10.276 1.00 0.25 H new ATOM 1168 N ALA A 103 12.305 -2.856 -6.408 1.00 0.13 N ATOM 1169 CA ALA A 103 11.121 -3.361 -5.711 1.00 0.11 C ATOM 1170 C ALA A 103 10.089 -2.255 -5.528 1.00 0.10 C ATOM 1171 O ALA A 103 8.891 -2.463 -5.699 1.00 0.10 O ATOM 1172 CB ALA A 103 11.516 -3.902 -4.350 1.00 0.11 C ATOM 0 H ALA A 103 13.184 -3.066 -5.936 1.00 0.13 H new ATOM 0 HA ALA A 103 10.684 -4.157 -6.314 1.00 0.11 H new ATOM 0 HB1 ALA A 103 10.631 -4.276 -3.836 1.00 0.11 H new ATOM 0 HB2 ALA A 103 12.233 -4.713 -4.475 1.00 0.11 H new ATOM 0 HB3 ALA A 103 11.969 -3.106 -3.759 1.00 0.11 H new ATOM 1178 N ILE A 104 10.585 -1.078 -5.194 1.00 0.10 N ATOM 1179 CA ILE A 104 9.756 0.077 -4.906 1.00 0.11 C ATOM 1180 C ILE A 104 9.180 0.668 -6.177 1.00 0.12 C ATOM 1181 O ILE A 104 8.020 1.075 -6.216 1.00 0.13 O ATOM 1182 CB ILE A 104 10.593 1.119 -4.156 1.00 0.11 C ATOM 1183 CG1 ILE A 104 10.900 0.604 -2.769 1.00 0.14 C ATOM 1184 CG2 ILE A 104 9.924 2.473 -4.063 1.00 0.15 C ATOM 1185 CD1 ILE A 104 11.378 1.685 -1.849 1.00 0.17 C ATOM 0 H ILE A 104 11.585 -0.895 -5.114 1.00 0.10 H new ATOM 0 HA ILE A 104 8.917 -0.234 -4.283 1.00 0.11 H new ATOM 0 HB ILE A 104 11.509 1.266 -4.728 1.00 0.11 H new ATOM 0 HG12 ILE A 104 10.005 0.144 -2.350 1.00 0.14 H new ATOM 0 HG13 ILE A 104 11.659 -0.175 -2.834 1.00 0.14 H new ATOM 0 HG21 ILE A 104 10.571 3.162 -3.520 1.00 0.15 H new ATOM 0 HG22 ILE A 104 9.743 2.859 -5.066 1.00 0.15 H new ATOM 0 HG23 ILE A 104 8.975 2.375 -3.536 1.00 0.15 H new ATOM 0 HD11 ILE A 104 11.584 1.261 -0.866 1.00 0.17 H new ATOM 0 HD12 ILE A 104 12.289 2.129 -2.251 1.00 0.17 H new ATOM 0 HD13 ILE A 104 10.609 2.453 -1.759 1.00 0.17 H new ATOM 1197 N ASP A 105 9.996 0.701 -7.214 1.00 0.13 N ATOM 1198 CA ASP A 105 9.548 1.134 -8.530 1.00 0.16 C ATOM 1199 C ASP A 105 8.415 0.236 -8.993 1.00 0.14 C ATOM 1200 O ASP A 105 7.380 0.698 -9.478 1.00 0.17 O ATOM 1201 CB ASP A 105 10.696 1.059 -9.522 1.00 0.21 C ATOM 1202 CG ASP A 105 10.359 1.693 -10.854 1.00 0.36 C ATOM 1203 OD1 ASP A 105 10.510 2.924 -10.990 1.00 0.53 O ATOM 1204 OD2 ASP A 105 9.952 0.965 -11.777 1.00 0.44 O ATOM 0 H ASP A 105 10.979 0.432 -7.172 1.00 0.13 H new ATOM 0 HA ASP A 105 9.200 2.165 -8.470 1.00 0.16 H new ATOM 0 HB2 ASP A 105 11.569 1.555 -9.099 1.00 0.21 H new ATOM 0 HB3 ASP A 105 10.967 0.015 -9.679 1.00 0.21 H new ATOM 1209 N LYS A 106 8.637 -1.057 -8.812 1.00 0.13 N ATOM 1210 CA LYS A 106 7.639 -2.076 -9.105 1.00 0.13 C ATOM 1211 C LYS A 106 6.378 -1.863 -8.267 1.00 0.12 C ATOM 1212 O LYS A 106 5.271 -1.819 -8.804 1.00 0.14 O ATOM 1213 CB LYS A 106 8.214 -3.464 -8.810 1.00 0.14 C ATOM 1214 CG LYS A 106 9.323 -3.890 -9.743 1.00 0.16 C ATOM 1215 CD LYS A 106 10.175 -4.994 -9.131 1.00 0.18 C ATOM 1216 CE LYS A 106 11.082 -5.635 -10.168 1.00 0.22 C ATOM 1217 NZ LYS A 106 12.073 -6.568 -9.568 1.00 0.29 N ATOM 0 H LYS A 106 9.517 -1.431 -8.457 1.00 0.13 H new ATOM 0 HA LYS A 106 7.375 -2.001 -10.160 1.00 0.13 H new ATOM 0 HB2 LYS A 106 8.590 -3.478 -7.787 1.00 0.14 H new ATOM 0 HB3 LYS A 106 7.409 -4.197 -8.864 1.00 0.14 H new ATOM 0 HG2 LYS A 106 8.895 -4.238 -10.683 1.00 0.16 H new ATOM 0 HG3 LYS A 106 9.952 -3.031 -9.978 1.00 0.16 H new ATOM 0 HD2 LYS A 106 10.779 -4.583 -8.322 1.00 0.18 H new ATOM 0 HD3 LYS A 106 9.528 -5.754 -8.692 1.00 0.18 H new ATOM 0 HE2 LYS A 106 10.473 -6.176 -10.892 1.00 0.22 H new ATOM 0 HE3 LYS A 106 11.610 -4.854 -10.715 1.00 0.22 H new ATOM 0 HZ1 LYS A 106 13.023 -6.149 -9.624 1.00 0.29 H new ATOM 0 HZ2 LYS A 106 11.829 -6.740 -8.572 1.00 0.29 H new ATOM 0 HZ3 LYS A 106 12.061 -7.469 -10.088 1.00 0.29 H new ATOM 1231 N LEU A 107 6.565 -1.710 -6.956 1.00 0.10 N ATOM 1232 CA LEU A 107 5.456 -1.552 -6.022 1.00 0.11 C ATOM 1233 C LEU A 107 4.647 -0.294 -6.323 1.00 0.10 C ATOM 1234 O LEU A 107 3.422 -0.345 -6.384 1.00 0.11 O ATOM 1235 CB LEU A 107 5.999 -1.548 -4.569 1.00 0.13 C ATOM 1236 CG LEU A 107 5.702 -0.304 -3.718 1.00 0.11 C ATOM 1237 CD1 LEU A 107 4.276 -0.305 -3.200 1.00 0.13 C ATOM 1238 CD2 LEU A 107 6.685 -0.212 -2.564 1.00 0.15 C ATOM 0 H LEU A 107 7.485 -1.692 -6.516 1.00 0.10 H new ATOM 0 HA LEU A 107 4.775 -2.395 -6.138 1.00 0.11 H new ATOM 0 HB2 LEU A 107 5.592 -2.417 -4.053 1.00 0.13 H new ATOM 0 HB3 LEU A 107 7.080 -1.680 -4.611 1.00 0.13 H new ATOM 0 HG LEU A 107 5.818 0.571 -4.357 1.00 0.11 H new ATOM 0 HD11 LEU A 107 4.105 0.591 -2.603 1.00 0.13 H new ATOM 0 HD12 LEU A 107 3.583 -0.318 -4.041 1.00 0.13 H new ATOM 0 HD13 LEU A 107 4.114 -1.189 -2.583 1.00 0.13 H new ATOM 0 HD21 LEU A 107 6.465 0.674 -1.968 1.00 0.15 H new ATOM 0 HD22 LEU A 107 6.597 -1.101 -1.939 1.00 0.15 H new ATOM 0 HD23 LEU A 107 7.700 -0.143 -2.955 1.00 0.15 H new ATOM 1250 N PHE A 108 5.328 0.819 -6.535 1.00 0.10 N ATOM 1251 CA PHE A 108 4.652 2.092 -6.765 1.00 0.11 C ATOM 1252 C PHE A 108 3.889 2.106 -8.084 1.00 0.12 C ATOM 1253 O PHE A 108 2.842 2.745 -8.194 1.00 0.14 O ATOM 1254 CB PHE A 108 5.636 3.259 -6.692 1.00 0.12 C ATOM 1255 CG PHE A 108 5.930 3.701 -5.282 1.00 0.12 C ATOM 1256 CD1 PHE A 108 5.115 3.302 -4.233 1.00 0.15 C ATOM 1257 CD2 PHE A 108 7.006 4.527 -5.008 1.00 0.17 C ATOM 1258 CE1 PHE A 108 5.368 3.717 -2.942 1.00 0.16 C ATOM 1259 CE2 PHE A 108 7.265 4.942 -3.716 1.00 0.17 C ATOM 1260 CZ PHE A 108 6.443 4.537 -2.681 1.00 0.14 C ATOM 0 H PHE A 108 6.347 0.871 -6.553 1.00 0.10 H new ATOM 0 HA PHE A 108 3.919 2.212 -5.967 1.00 0.11 H new ATOM 0 HB2 PHE A 108 6.568 2.970 -7.177 1.00 0.12 H new ATOM 0 HB3 PHE A 108 5.232 4.102 -7.253 1.00 0.12 H new ATOM 0 HD1 PHE A 108 4.271 2.658 -4.430 1.00 0.15 H new ATOM 0 HD2 PHE A 108 7.650 4.851 -5.812 1.00 0.17 H new ATOM 0 HE1 PHE A 108 4.723 3.399 -2.136 1.00 0.16 H new ATOM 0 HE2 PHE A 108 8.110 5.583 -3.514 1.00 0.17 H new ATOM 0 HZ PHE A 108 6.643 4.863 -1.671 1.00 0.14 H new ATOM 1270 N SER A 109 4.397 1.398 -9.080 1.00 0.13 N ATOM 1271 CA SER A 109 3.705 1.301 -10.352 1.00 0.14 C ATOM 1272 C SER A 109 2.467 0.418 -10.206 1.00 0.14 C ATOM 1273 O SER A 109 1.480 0.601 -10.911 1.00 0.16 O ATOM 1274 CB SER A 109 4.644 0.747 -11.425 1.00 0.17 C ATOM 1275 OG SER A 109 4.033 0.749 -12.707 1.00 1.14 O ATOM 0 H SER A 109 5.278 0.887 -9.032 1.00 0.13 H new ATOM 0 HA SER A 109 3.386 2.296 -10.660 1.00 0.14 H new ATOM 0 HB2 SER A 109 5.555 1.344 -11.455 1.00 0.17 H new ATOM 0 HB3 SER A 109 4.937 -0.270 -11.163 1.00 0.17 H new ATOM 0 HG SER A 109 4.660 0.390 -13.369 1.00 1.14 H new ATOM 1281 N MET A 110 2.521 -0.524 -9.265 1.00 0.13 N ATOM 1282 CA MET A 110 1.407 -1.439 -9.022 1.00 0.14 C ATOM 1283 C MET A 110 0.132 -0.701 -8.661 1.00 0.14 C ATOM 1284 O MET A 110 -0.910 -0.935 -9.270 1.00 0.16 O ATOM 1285 CB MET A 110 1.719 -2.386 -7.883 1.00 0.13 C ATOM 1286 CG MET A 110 2.746 -3.448 -8.185 1.00 0.17 C ATOM 1287 SD MET A 110 2.741 -4.702 -6.902 1.00 0.23 S ATOM 1288 CE MET A 110 2.278 -3.694 -5.501 1.00 0.14 C ATOM 0 H MET A 110 3.326 -0.673 -8.657 1.00 0.13 H new ATOM 0 HA MET A 110 1.263 -1.989 -9.952 1.00 0.14 H new ATOM 0 HB2 MET A 110 2.067 -1.801 -7.032 1.00 0.13 H new ATOM 0 HB3 MET A 110 0.795 -2.876 -7.577 1.00 0.13 H new ATOM 0 HG2 MET A 110 2.533 -3.906 -9.151 1.00 0.17 H new ATOM 0 HG3 MET A 110 3.735 -2.996 -8.258 1.00 0.17 H new ATOM 0 HE1 MET A 110 2.364 -4.281 -4.586 1.00 0.14 H new ATOM 0 HE2 MET A 110 2.939 -2.829 -5.441 1.00 0.14 H new ATOM 0 HE3 MET A 110 1.249 -3.356 -5.620 1.00 0.14 H new ATOM 1298 N LEU A 111 0.204 0.180 -7.660 1.00 0.14 N ATOM 1299 CA LEU A 111 -0.986 0.889 -7.209 1.00 0.15 C ATOM 1300 C LEU A 111 -1.536 1.687 -8.365 1.00 0.17 C ATOM 1301 O LEU A 111 -2.716 1.652 -8.664 1.00 0.18 O ATOM 1302 CB LEU A 111 -0.716 1.873 -6.059 1.00 0.17 C ATOM 1303 CG LEU A 111 0.221 1.431 -4.927 1.00 0.15 C ATOM 1304 CD1 LEU A 111 0.073 -0.048 -4.603 1.00 0.17 C ATOM 1305 CD2 LEU A 111 1.659 1.792 -5.257 1.00 0.15 C ATOM 0 H LEU A 111 1.060 0.414 -7.157 1.00 0.14 H new ATOM 0 HA LEU A 111 -1.682 0.133 -6.846 1.00 0.15 H new ATOM 0 HB2 LEU A 111 -0.307 2.786 -6.492 1.00 0.17 H new ATOM 0 HB3 LEU A 111 -1.676 2.134 -5.613 1.00 0.17 H new ATOM 0 HG LEU A 111 -0.069 1.973 -4.027 1.00 0.15 H new ATOM 0 HD11 LEU A 111 0.756 -0.314 -3.796 1.00 0.17 H new ATOM 0 HD12 LEU A 111 -0.952 -0.252 -4.293 1.00 0.17 H new ATOM 0 HD13 LEU A 111 0.309 -0.640 -5.488 1.00 0.17 H new ATOM 0 HD21 LEU A 111 2.310 1.472 -4.444 1.00 0.15 H new ATOM 0 HD22 LEU A 111 1.957 1.293 -6.179 1.00 0.15 H new ATOM 0 HD23 LEU A 111 1.743 2.871 -5.385 1.00 0.15 H new ATOM 1317 N LYS A 112 -0.636 2.372 -9.035 1.00 0.19 N ATOM 1318 CA LYS A 112 -0.989 3.263 -10.114 1.00 0.22 C ATOM 1319 C LYS A 112 -1.527 2.493 -11.312 1.00 0.21 C ATOM 1320 O LYS A 112 -2.265 3.039 -12.126 1.00 0.24 O ATOM 1321 CB LYS A 112 0.238 4.071 -10.508 1.00 0.29 C ATOM 1322 CG LYS A 112 0.655 5.106 -9.476 1.00 0.36 C ATOM 1323 CD LYS A 112 1.917 5.806 -9.916 1.00 0.47 C ATOM 1324 CE LYS A 112 1.662 6.556 -11.202 1.00 1.22 C ATOM 1325 NZ LYS A 112 2.897 7.158 -11.763 1.00 1.82 N ATOM 0 H LYS A 112 0.365 2.325 -8.845 1.00 0.19 H new ATOM 0 HA LYS A 112 -1.779 3.933 -9.776 1.00 0.22 H new ATOM 0 HB2 LYS A 112 1.070 3.388 -10.679 1.00 0.29 H new ATOM 0 HB3 LYS A 112 0.040 4.575 -11.454 1.00 0.29 H new ATOM 0 HG2 LYS A 112 -0.144 5.835 -9.339 1.00 0.36 H new ATOM 0 HG3 LYS A 112 0.816 4.624 -8.512 1.00 0.36 H new ATOM 0 HD2 LYS A 112 2.250 6.496 -9.141 1.00 0.47 H new ATOM 0 HD3 LYS A 112 2.716 5.079 -10.060 1.00 0.47 H new ATOM 0 HE2 LYS A 112 1.227 5.876 -11.935 1.00 1.22 H new ATOM 0 HE3 LYS A 112 0.928 7.342 -11.021 1.00 1.22 H new ATOM 0 HZ1 LYS A 112 2.736 8.168 -11.953 1.00 1.82 H new ATOM 0 HZ2 LYS A 112 3.675 7.054 -11.080 1.00 1.82 H new ATOM 0 HZ3 LYS A 112 3.147 6.675 -12.649 1.00 1.82 H new ATOM 1339 N ASP A 113 -1.164 1.222 -11.408 1.00 0.20 N ATOM 1340 CA ASP A 113 -1.658 0.378 -12.476 1.00 0.22 C ATOM 1341 C ASP A 113 -2.991 -0.197 -12.046 1.00 0.21 C ATOM 1342 O ASP A 113 -3.801 -0.653 -12.856 1.00 0.24 O ATOM 1343 CB ASP A 113 -0.647 -0.728 -12.728 1.00 0.25 C ATOM 1344 CG ASP A 113 -0.859 -1.457 -14.038 1.00 0.35 C ATOM 1345 OD1 ASP A 113 -0.439 -0.937 -15.090 1.00 0.51 O ATOM 1346 OD2 ASP A 113 -1.478 -2.546 -14.021 1.00 0.46 O ATOM 0 H ASP A 113 -0.530 0.757 -10.758 1.00 0.20 H new ATOM 0 HA ASP A 113 -1.794 0.943 -13.398 1.00 0.22 H new ATOM 0 HB2 ASP A 113 0.356 -0.301 -12.718 1.00 0.25 H new ATOM 0 HB3 ASP A 113 -0.696 -1.447 -11.910 1.00 0.25 H new ATOM 1351 N GLY A 114 -3.198 -0.140 -10.746 1.00 0.18 N ATOM 1352 CA GLY A 114 -4.453 -0.512 -10.152 1.00 0.17 C ATOM 1353 C GLY A 114 -4.320 -1.711 -9.244 1.00 0.15 C ATOM 1354 O GLY A 114 -4.497 -2.849 -9.678 1.00 0.18 O ATOM 0 H GLY A 114 -2.494 0.168 -10.075 1.00 0.18 H new ATOM 0 HA2 GLY A 114 -4.848 0.330 -9.584 1.00 0.17 H new ATOM 0 HA3 GLY A 114 -5.175 -0.732 -10.939 1.00 0.17 H new ATOM 1358 N VAL A 115 -4.008 -1.464 -7.982 1.00 0.14 N ATOM 1359 CA VAL A 115 -3.879 -2.529 -7.016 1.00 0.12 C ATOM 1360 C VAL A 115 -5.133 -2.577 -6.154 1.00 0.12 C ATOM 1361 O VAL A 115 -5.629 -1.547 -5.713 1.00 0.13 O ATOM 1362 CB VAL A 115 -2.608 -2.351 -6.142 1.00 0.12 C ATOM 1363 CG1 VAL A 115 -2.939 -2.170 -4.674 1.00 0.12 C ATOM 1364 CG2 VAL A 115 -1.654 -3.509 -6.348 1.00 0.14 C ATOM 0 H VAL A 115 -3.840 -0.530 -7.607 1.00 0.14 H new ATOM 0 HA VAL A 115 -3.770 -3.475 -7.546 1.00 0.12 H new ATOM 0 HB VAL A 115 -2.117 -1.434 -6.467 1.00 0.12 H new ATOM 0 HG11 VAL A 115 -2.017 -2.050 -4.105 1.00 0.12 H new ATOM 0 HG12 VAL A 115 -3.561 -1.284 -4.548 1.00 0.12 H new ATOM 0 HG13 VAL A 115 -3.477 -3.046 -4.312 1.00 0.12 H new ATOM 0 HG21 VAL A 115 -0.769 -3.366 -5.727 1.00 0.14 H new ATOM 0 HG22 VAL A 115 -2.147 -4.440 -6.069 1.00 0.14 H new ATOM 0 HG23 VAL A 115 -1.358 -3.555 -7.396 1.00 0.14 H new ATOM 1374 N VAL A 116 -5.673 -3.756 -5.960 1.00 0.12 N ATOM 1375 CA VAL A 116 -6.835 -3.915 -5.117 1.00 0.13 C ATOM 1376 C VAL A 116 -6.447 -4.529 -3.786 1.00 0.10 C ATOM 1377 O VAL A 116 -5.694 -5.503 -3.724 1.00 0.15 O ATOM 1378 CB VAL A 116 -7.932 -4.753 -5.805 1.00 0.19 C ATOM 1379 CG1 VAL A 116 -7.361 -6.025 -6.392 1.00 0.22 C ATOM 1380 CG2 VAL A 116 -9.080 -5.056 -4.842 1.00 0.23 C ATOM 0 H VAL A 116 -5.326 -4.621 -6.375 1.00 0.12 H new ATOM 0 HA VAL A 116 -7.248 -2.923 -4.937 1.00 0.13 H new ATOM 0 HB VAL A 116 -8.335 -4.161 -6.627 1.00 0.19 H new ATOM 0 HG11 VAL A 116 -8.158 -6.595 -6.870 1.00 0.22 H new ATOM 0 HG12 VAL A 116 -6.600 -5.775 -7.131 1.00 0.22 H new ATOM 0 HG13 VAL A 116 -6.913 -6.623 -5.598 1.00 0.22 H new ATOM 0 HG21 VAL A 116 -9.838 -5.648 -5.355 1.00 0.23 H new ATOM 0 HG22 VAL A 116 -8.700 -5.615 -3.987 1.00 0.23 H new ATOM 0 HG23 VAL A 116 -9.522 -4.121 -4.497 1.00 0.23 H new ATOM 1390 N LEU A 117 -6.928 -3.908 -2.733 1.00 0.11 N ATOM 1391 CA LEU A 117 -6.723 -4.386 -1.383 1.00 0.11 C ATOM 1392 C LEU A 117 -7.732 -5.493 -1.114 1.00 0.12 C ATOM 1393 O LEU A 117 -8.923 -5.235 -1.132 1.00 0.16 O ATOM 1394 CB LEU A 117 -6.891 -3.215 -0.408 1.00 0.15 C ATOM 1395 CG LEU A 117 -5.683 -2.263 -0.291 1.00 0.13 C ATOM 1396 CD1 LEU A 117 -4.976 -2.055 -1.621 1.00 0.26 C ATOM 1397 CD2 LEU A 117 -6.124 -0.924 0.267 1.00 0.24 C ATOM 0 H LEU A 117 -7.477 -3.050 -2.789 1.00 0.11 H new ATOM 0 HA LEU A 117 -5.719 -4.789 -1.251 1.00 0.11 H new ATOM 0 HB2 LEU A 117 -7.760 -2.633 -0.714 1.00 0.15 H new ATOM 0 HB3 LEU A 117 -7.110 -3.618 0.581 1.00 0.15 H new ATOM 0 HG LEU A 117 -4.972 -2.733 0.389 1.00 0.13 H new ATOM 0 HD11 LEU A 117 -4.134 -1.377 -1.483 1.00 0.26 H new ATOM 0 HD12 LEU A 117 -4.614 -3.013 -1.994 1.00 0.26 H new ATOM 0 HD13 LEU A 117 -5.673 -1.626 -2.340 1.00 0.26 H new ATOM 0 HD21 LEU A 117 -5.263 -0.261 0.345 1.00 0.24 H new ATOM 0 HD22 LEU A 117 -6.865 -0.479 -0.397 1.00 0.24 H new ATOM 0 HD23 LEU A 117 -6.562 -1.068 1.255 1.00 0.24 H new ATOM 1409 N LYS A 118 -7.251 -6.725 -0.896 1.00 0.14 N ATOM 1410 CA LYS A 118 -8.112 -7.918 -0.848 1.00 0.18 C ATOM 1411 C LYS A 118 -7.284 -9.183 -1.033 1.00 0.22 C ATOM 1412 O LYS A 118 -6.198 -9.155 -1.610 1.00 0.27 O ATOM 1413 CB LYS A 118 -9.211 -7.878 -1.933 1.00 0.20 C ATOM 1414 CG LYS A 118 -10.593 -7.531 -1.383 1.00 0.19 C ATOM 1415 CD LYS A 118 -11.452 -6.769 -2.383 1.00 0.34 C ATOM 1416 CE LYS A 118 -12.358 -7.676 -3.197 1.00 0.39 C ATOM 1417 NZ LYS A 118 -11.613 -8.562 -4.125 1.00 0.80 N ATOM 0 H LYS A 118 -6.261 -6.923 -0.749 1.00 0.14 H new ATOM 0 HA LYS A 118 -8.589 -7.925 0.132 1.00 0.18 H new ATOM 0 HB2 LYS A 118 -8.936 -7.146 -2.692 1.00 0.20 H new ATOM 0 HB3 LYS A 118 -9.258 -8.848 -2.428 1.00 0.20 H new ATOM 0 HG2 LYS A 118 -11.106 -8.449 -1.096 1.00 0.19 H new ATOM 0 HG3 LYS A 118 -10.479 -6.933 -0.479 1.00 0.19 H new ATOM 0 HD2 LYS A 118 -12.061 -6.040 -1.849 1.00 0.34 H new ATOM 0 HD3 LYS A 118 -10.805 -6.210 -3.058 1.00 0.34 H new ATOM 0 HE2 LYS A 118 -12.953 -8.288 -2.519 1.00 0.39 H new ATOM 0 HE3 LYS A 118 -13.055 -7.064 -3.769 1.00 0.39 H new ATOM 0 HZ1 LYS A 118 -12.285 -9.070 -4.735 1.00 0.80 H new ATOM 0 HZ2 LYS A 118 -10.975 -7.990 -4.714 1.00 0.80 H new ATOM 0 HZ3 LYS A 118 -11.056 -9.248 -3.577 1.00 0.80 H new ATOM 1431 N GLY A 119 -7.809 -10.281 -0.522 1.00 0.31 N ATOM 1432 CA GLY A 119 -7.205 -11.580 -0.711 1.00 0.38 C ATOM 1433 C GLY A 119 -8.262 -12.662 -0.695 1.00 0.53 C ATOM 1434 O GLY A 119 -9.343 -12.484 -1.260 1.00 0.85 O ATOM 0 H GLY A 119 -8.664 -10.294 0.034 1.00 0.31 H new ATOM 0 HA2 GLY A 119 -6.667 -11.603 -1.658 1.00 0.38 H new ATOM 0 HA3 GLY A 119 -6.474 -11.766 0.076 1.00 0.38 H new ATOM 1438 N ASN A 120 -7.973 -13.775 -0.047 1.00 0.81 N ATOM 1439 CA ASN A 120 -8.953 -14.847 0.105 1.00 1.02 C ATOM 1440 C ASN A 120 -8.720 -15.597 1.408 1.00 1.10 C ATOM 1441 O ASN A 120 -9.304 -16.653 1.644 1.00 1.88 O ATOM 1442 CB ASN A 120 -8.873 -15.828 -1.075 1.00 1.16 C ATOM 1443 CG ASN A 120 -7.580 -16.628 -1.098 1.00 1.84 C ATOM 1444 OD1 ASN A 120 -6.533 -16.168 -0.632 1.00 2.57 O ATOM 1445 ND2 ASN A 120 -7.639 -17.830 -1.651 1.00 2.43 N ATOM 0 H ASN A 120 -7.069 -13.965 0.385 1.00 0.81 H new ATOM 0 HA ASN A 120 -9.946 -14.397 0.123 1.00 1.02 H new ATOM 0 HB2 ASN A 120 -9.718 -16.515 -1.027 1.00 1.16 H new ATOM 0 HB3 ASN A 120 -8.967 -15.273 -2.008 1.00 1.16 H new ATOM 0 HD21 ASN A 120 -6.801 -18.409 -1.702 1.00 2.43 H new ATOM 0 HD22 ASN A 120 -8.522 -18.176 -2.025 1.00 2.43 H new ATOM 1452 N LYS A 121 -7.879 -15.032 2.261 1.00 1.04 N ATOM 1453 CA LYS A 121 -7.409 -15.737 3.443 1.00 1.09 C ATOM 1454 C LYS A 121 -7.288 -14.783 4.636 1.00 0.92 C ATOM 1455 O LYS A 121 -6.864 -15.174 5.722 1.00 1.18 O ATOM 1456 CB LYS A 121 -6.051 -16.378 3.111 1.00 1.36 C ATOM 1457 CG LYS A 121 -5.487 -17.292 4.188 1.00 2.03 C ATOM 1458 CD LYS A 121 -4.144 -17.885 3.772 1.00 2.73 C ATOM 1459 CE LYS A 121 -3.127 -16.800 3.447 1.00 3.45 C ATOM 1460 NZ LYS A 121 -1.774 -17.357 3.195 1.00 4.18 N ATOM 0 H LYS A 121 -7.508 -14.088 2.157 1.00 1.04 H new ATOM 0 HA LYS A 121 -8.124 -16.510 3.723 1.00 1.09 H new ATOM 0 HB2 LYS A 121 -6.153 -16.949 2.188 1.00 1.36 H new ATOM 0 HB3 LYS A 121 -5.330 -15.584 2.916 1.00 1.36 H new ATOM 0 HG2 LYS A 121 -5.367 -16.732 5.115 1.00 2.03 H new ATOM 0 HG3 LYS A 121 -6.194 -18.097 4.391 1.00 2.03 H new ATOM 0 HD2 LYS A 121 -3.760 -18.515 4.574 1.00 2.73 H new ATOM 0 HD3 LYS A 121 -4.283 -18.526 2.902 1.00 2.73 H new ATOM 0 HE2 LYS A 121 -3.459 -16.245 2.570 1.00 3.45 H new ATOM 0 HE3 LYS A 121 -3.078 -16.091 4.273 1.00 3.45 H new ATOM 0 HZ1 LYS A 121 -1.115 -16.583 2.978 1.00 4.18 H new ATOM 0 HZ2 LYS A 121 -1.445 -17.865 4.041 1.00 4.18 H new ATOM 0 HZ3 LYS A 121 -1.813 -18.014 2.390 1.00 4.18 H new ATOM 1474 N ILE A 122 -7.694 -13.536 4.448 1.00 0.77 N ATOM 1475 CA ILE A 122 -7.463 -12.517 5.462 1.00 0.69 C ATOM 1476 C ILE A 122 -8.778 -11.859 5.893 1.00 0.99 C ATOM 1477 O ILE A 122 -9.815 -12.069 5.264 1.00 1.44 O ATOM 1478 CB ILE A 122 -6.466 -11.450 4.944 1.00 0.74 C ATOM 1479 CG1 ILE A 122 -5.951 -10.591 6.096 1.00 1.04 C ATOM 1480 CG2 ILE A 122 -7.110 -10.579 3.868 1.00 0.55 C ATOM 1481 CD1 ILE A 122 -5.317 -11.390 7.216 1.00 1.60 C ATOM 0 H ILE A 122 -8.179 -13.207 3.613 1.00 0.77 H new ATOM 0 HA ILE A 122 -7.028 -13.004 6.335 1.00 0.69 H new ATOM 0 HB ILE A 122 -5.618 -11.968 4.496 1.00 0.74 H new ATOM 0 HG12 ILE A 122 -5.220 -9.881 5.709 1.00 1.04 H new ATOM 0 HG13 ILE A 122 -6.778 -10.008 6.501 1.00 1.04 H new ATOM 0 HG21 ILE A 122 -6.390 -9.838 3.521 1.00 0.55 H new ATOM 0 HG22 ILE A 122 -7.420 -11.204 3.031 1.00 0.55 H new ATOM 0 HG23 ILE A 122 -7.981 -10.072 4.283 1.00 0.55 H new ATOM 0 HD11 ILE A 122 -4.975 -10.712 7.998 1.00 1.60 H new ATOM 0 HD12 ILE A 122 -6.051 -12.081 7.630 1.00 1.60 H new ATOM 0 HD13 ILE A 122 -4.468 -11.952 6.827 1.00 1.60 H new ATOM 1493 N ASN A 123 -8.735 -11.095 6.985 1.00 1.13 N ATOM 1494 CA ASN A 123 -9.910 -10.371 7.471 1.00 1.52 C ATOM 1495 C ASN A 123 -9.480 -9.120 8.244 1.00 1.43 C ATOM 1496 O ASN A 123 -10.097 -8.065 8.132 1.00 2.17 O ATOM 1497 CB ASN A 123 -10.766 -11.278 8.368 1.00 1.98 C ATOM 1498 CG ASN A 123 -12.206 -10.799 8.512 1.00 2.54 C ATOM 1499 OD1 ASN A 123 -12.501 -9.608 8.435 1.00 2.76 O ATOM 1500 ND2 ASN A 123 -13.117 -11.736 8.729 1.00 3.41 N ATOM 0 H ASN A 123 -7.897 -10.961 7.551 1.00 1.13 H new ATOM 0 HA ASN A 123 -10.508 -10.066 6.612 1.00 1.52 H new ATOM 0 HB2 ASN A 123 -10.766 -12.288 7.957 1.00 1.98 H new ATOM 0 HB3 ASN A 123 -10.309 -11.336 9.356 1.00 1.98 H new ATOM 0 HD21 ASN A 123 -14.098 -11.478 8.838 1.00 3.41 H new ATOM 0 HD22 ASN A 123 -12.838 -12.715 8.787 1.00 3.41 H new ATOM 1507 N ASP A 124 -8.402 -9.240 9.017 1.00 0.91 N ATOM 1508 CA ASP A 124 -7.924 -8.128 9.842 1.00 0.83 C ATOM 1509 C ASP A 124 -6.613 -7.562 9.309 1.00 0.67 C ATOM 1510 O ASP A 124 -5.818 -6.995 10.060 1.00 0.85 O ATOM 1511 CB ASP A 124 -7.720 -8.577 11.295 1.00 1.15 C ATOM 1512 CG ASP A 124 -8.989 -9.099 11.931 1.00 1.69 C ATOM 1513 OD1 ASP A 124 -9.776 -8.285 12.460 1.00 2.29 O ATOM 1514 OD2 ASP A 124 -9.202 -10.327 11.916 1.00 2.09 O ATOM 0 H ASP A 124 -7.844 -10.091 9.090 1.00 0.91 H new ATOM 0 HA ASP A 124 -8.686 -7.350 9.803 1.00 0.83 H new ATOM 0 HB2 ASP A 124 -6.957 -9.355 11.326 1.00 1.15 H new ATOM 0 HB3 ASP A 124 -7.344 -7.738 11.880 1.00 1.15 H new ATOM 1519 N THR A 125 -6.382 -7.717 8.015 1.00 0.54 N ATOM 1520 CA THR A 125 -5.142 -7.264 7.401 1.00 0.40 C ATOM 1521 C THR A 125 -5.376 -6.912 5.930 1.00 0.29 C ATOM 1522 O THR A 125 -6.257 -7.482 5.282 1.00 0.34 O ATOM 1523 CB THR A 125 -4.043 -8.348 7.528 1.00 0.39 C ATOM 1524 OG1 THR A 125 -3.849 -8.702 8.907 1.00 0.51 O ATOM 1525 CG2 THR A 125 -2.728 -7.873 6.943 1.00 0.37 C ATOM 0 H THR A 125 -7.038 -8.154 7.368 1.00 0.54 H new ATOM 0 HA THR A 125 -4.804 -6.370 7.925 1.00 0.40 H new ATOM 0 HB THR A 125 -4.377 -9.221 6.968 1.00 0.39 H new ATOM 0 HG1 THR A 125 -3.153 -9.389 8.974 1.00 0.51 H new ATOM 0 HG21 THR A 125 -1.978 -8.657 7.048 1.00 0.37 H new ATOM 0 HG22 THR A 125 -2.863 -7.639 5.887 1.00 0.37 H new ATOM 0 HG23 THR A 125 -2.396 -6.980 7.472 1.00 0.37 H new ATOM 1533 N ILE A 126 -4.596 -5.968 5.412 1.00 0.22 N ATOM 1534 CA ILE A 126 -4.778 -5.485 4.050 1.00 0.15 C ATOM 1535 C ILE A 126 -3.795 -6.164 3.103 1.00 0.14 C ATOM 1536 O ILE A 126 -2.626 -6.334 3.434 1.00 0.19 O ATOM 1537 CB ILE A 126 -4.577 -3.958 3.958 1.00 0.13 C ATOM 1538 CG1 ILE A 126 -5.168 -3.269 5.197 1.00 0.16 C ATOM 1539 CG2 ILE A 126 -5.232 -3.435 2.691 1.00 0.12 C ATOM 1540 CD1 ILE A 126 -5.105 -1.753 5.171 1.00 0.16 C ATOM 0 H ILE A 126 -3.830 -5.522 5.918 1.00 0.22 H new ATOM 0 HA ILE A 126 -5.801 -5.727 3.761 1.00 0.15 H new ATOM 0 HB ILE A 126 -3.510 -3.736 3.922 1.00 0.13 H new ATOM 0 HG12 ILE A 126 -6.209 -3.574 5.303 1.00 0.16 H new ATOM 0 HG13 ILE A 126 -4.639 -3.626 6.081 1.00 0.16 H new ATOM 0 HG21 ILE A 126 -5.090 -2.356 2.626 1.00 0.12 H new ATOM 0 HG22 ILE A 126 -4.779 -3.913 1.823 1.00 0.12 H new ATOM 0 HG23 ILE A 126 -6.298 -3.660 2.713 1.00 0.12 H new ATOM 0 HD11 ILE A 126 -5.545 -1.355 6.085 1.00 0.16 H new ATOM 0 HD12 ILE A 126 -4.065 -1.433 5.099 1.00 0.16 H new ATOM 0 HD13 ILE A 126 -5.659 -1.381 4.310 1.00 0.16 H new ATOM 1552 N LEU A 127 -4.268 -6.547 1.928 1.00 0.12 N ATOM 1553 CA LEU A 127 -3.423 -7.220 0.950 1.00 0.12 C ATOM 1554 C LEU A 127 -3.418 -6.455 -0.362 1.00 0.11 C ATOM 1555 O LEU A 127 -4.433 -5.898 -0.759 1.00 0.12 O ATOM 1556 CB LEU A 127 -3.898 -8.651 0.721 1.00 0.15 C ATOM 1557 CG LEU A 127 -4.200 -9.438 1.988 1.00 0.19 C ATOM 1558 CD1 LEU A 127 -4.709 -10.824 1.640 1.00 0.26 C ATOM 1559 CD2 LEU A 127 -2.957 -9.516 2.852 1.00 0.20 C ATOM 0 H LEU A 127 -5.232 -6.404 1.627 1.00 0.12 H new ATOM 0 HA LEU A 127 -2.407 -7.251 1.342 1.00 0.12 H new ATOM 0 HB2 LEU A 127 -4.796 -8.626 0.104 1.00 0.15 H new ATOM 0 HB3 LEU A 127 -3.136 -9.184 0.153 1.00 0.15 H new ATOM 0 HG LEU A 127 -4.981 -8.926 2.550 1.00 0.19 H new ATOM 0 HD11 LEU A 127 -4.921 -11.375 2.557 1.00 0.26 H new ATOM 0 HD12 LEU A 127 -5.621 -10.739 1.049 1.00 0.26 H new ATOM 0 HD13 LEU A 127 -3.952 -11.356 1.064 1.00 0.26 H new ATOM 0 HD21 LEU A 127 -3.178 -10.080 3.758 1.00 0.20 H new ATOM 0 HD22 LEU A 127 -2.161 -10.014 2.299 1.00 0.20 H new ATOM 0 HD23 LEU A 127 -2.637 -8.509 3.121 1.00 0.20 H new ATOM 1571 N ILE A 128 -2.273 -6.428 -1.017 1.00 0.11 N ATOM 1572 CA ILE A 128 -2.098 -5.663 -2.253 1.00 0.11 C ATOM 1573 C ILE A 128 -1.999 -6.592 -3.472 1.00 0.13 C ATOM 1574 O ILE A 128 -1.031 -7.345 -3.619 1.00 0.15 O ATOM 1575 CB ILE A 128 -0.832 -4.777 -2.177 1.00 0.10 C ATOM 1576 CG1 ILE A 128 -0.973 -3.727 -1.078 1.00 0.12 C ATOM 1577 CG2 ILE A 128 -0.549 -4.112 -3.511 1.00 0.11 C ATOM 1578 CD1 ILE A 128 0.226 -2.813 -0.961 1.00 0.12 C ATOM 0 H ILE A 128 -1.438 -6.930 -0.716 1.00 0.11 H new ATOM 0 HA ILE A 128 -2.975 -5.026 -2.367 1.00 0.11 H new ATOM 0 HB ILE A 128 0.012 -5.422 -1.934 1.00 0.10 H new ATOM 0 HG12 ILE A 128 -1.861 -3.126 -1.273 1.00 0.12 H new ATOM 0 HG13 ILE A 128 -1.131 -4.230 -0.124 1.00 0.12 H new ATOM 0 HG21 ILE A 128 0.346 -3.496 -3.428 1.00 0.11 H new ATOM 0 HG22 ILE A 128 -0.394 -4.876 -4.273 1.00 0.11 H new ATOM 0 HG23 ILE A 128 -1.396 -3.486 -3.792 1.00 0.11 H new ATOM 0 HD11 ILE A 128 0.057 -2.092 -0.161 1.00 0.12 H new ATOM 0 HD12 ILE A 128 1.114 -3.404 -0.736 1.00 0.12 H new ATOM 0 HD13 ILE A 128 0.373 -2.283 -1.902 1.00 0.12 H new ATOM 1590 N GLU A 129 -2.987 -6.517 -4.356 1.00 0.15 N ATOM 1591 CA GLU A 129 -3.063 -7.400 -5.503 1.00 0.19 C ATOM 1592 C GLU A 129 -3.287 -6.611 -6.797 1.00 0.17 C ATOM 1593 O GLU A 129 -4.095 -5.688 -6.845 1.00 0.19 O ATOM 1594 CB GLU A 129 -4.217 -8.386 -5.300 1.00 0.27 C ATOM 1595 CG GLU A 129 -4.873 -8.788 -6.604 1.00 0.34 C ATOM 1596 CD GLU A 129 -6.002 -9.784 -6.438 1.00 0.80 C ATOM 1597 OE1 GLU A 129 -5.726 -10.936 -6.038 1.00 1.62 O ATOM 1598 OE2 GLU A 129 -7.164 -9.414 -6.685 1.00 0.71 O ATOM 0 H GLU A 129 -3.752 -5.845 -4.295 1.00 0.15 H new ATOM 0 HA GLU A 129 -2.118 -7.936 -5.591 1.00 0.19 H new ATOM 0 HB2 GLU A 129 -3.844 -9.277 -4.795 1.00 0.27 H new ATOM 0 HB3 GLU A 129 -4.963 -7.937 -4.645 1.00 0.27 H new ATOM 0 HG2 GLU A 129 -5.258 -7.895 -7.097 1.00 0.34 H new ATOM 0 HG3 GLU A 129 -4.118 -9.215 -7.263 1.00 0.34 H new ATOM 1605 N LYS A 130 -2.575 -6.995 -7.843 1.00 0.18 N ATOM 1606 CA LYS A 130 -2.820 -6.486 -9.186 1.00 0.21 C ATOM 1607 C LYS A 130 -2.294 -7.505 -10.190 1.00 0.29 C ATOM 1608 O LYS A 130 -1.380 -8.261 -9.872 1.00 0.31 O ATOM 1609 CB LYS A 130 -2.263 -5.048 -9.405 1.00 0.16 C ATOM 1610 CG LYS A 130 -0.748 -4.848 -9.312 1.00 0.19 C ATOM 1611 CD LYS A 130 -0.039 -5.256 -10.583 1.00 0.25 C ATOM 1612 CE LYS A 130 -0.266 -4.220 -11.669 1.00 0.25 C ATOM 1613 NZ LYS A 130 0.313 -4.630 -12.974 1.00 0.39 N ATOM 0 H LYS A 130 -1.811 -7.668 -7.787 1.00 0.18 H new ATOM 0 HA LYS A 130 -3.893 -6.369 -9.337 1.00 0.21 H new ATOM 0 HB2 LYS A 130 -2.586 -4.710 -10.390 1.00 0.16 H new ATOM 0 HB3 LYS A 130 -2.733 -4.391 -8.673 1.00 0.16 H new ATOM 0 HG2 LYS A 130 -0.534 -3.801 -9.099 1.00 0.19 H new ATOM 0 HG3 LYS A 130 -0.357 -5.430 -8.477 1.00 0.19 H new ATOM 0 HD2 LYS A 130 1.029 -5.365 -10.393 1.00 0.25 H new ATOM 0 HD3 LYS A 130 -0.405 -6.227 -10.916 1.00 0.25 H new ATOM 0 HE2 LYS A 130 -1.336 -4.050 -11.787 1.00 0.25 H new ATOM 0 HE3 LYS A 130 0.175 -3.272 -11.361 1.00 0.25 H new ATOM 0 HZ1 LYS A 130 0.550 -3.784 -13.530 1.00 0.39 H new ATOM 0 HZ2 LYS A 130 1.174 -5.190 -12.811 1.00 0.39 H new ATOM 0 HZ3 LYS A 130 -0.380 -5.204 -13.496 1.00 0.39 H new ATOM 1627 N ASP A 131 -2.924 -7.560 -11.363 1.00 0.38 N ATOM 1628 CA ASP A 131 -2.697 -8.622 -12.360 1.00 0.49 C ATOM 1629 C ASP A 131 -3.358 -9.916 -11.903 1.00 0.47 C ATOM 1630 O ASP A 131 -2.972 -11.006 -12.323 1.00 0.52 O ATOM 1631 CB ASP A 131 -1.209 -8.900 -12.633 1.00 0.55 C ATOM 1632 CG ASP A 131 -0.428 -7.676 -13.048 1.00 0.76 C ATOM 1633 OD1 ASP A 131 -0.946 -6.865 -13.842 1.00 1.03 O ATOM 1634 OD2 ASP A 131 0.714 -7.516 -12.571 1.00 1.13 O ATOM 0 H ASP A 131 -3.612 -6.867 -11.656 1.00 0.38 H new ATOM 0 HA ASP A 131 -3.138 -8.262 -13.289 1.00 0.49 H new ATOM 0 HB2 ASP A 131 -0.757 -9.321 -11.735 1.00 0.55 H new ATOM 0 HB3 ASP A 131 -1.127 -9.655 -13.415 1.00 0.55 H new ATOM 1639 N GLY A 132 -4.347 -9.790 -11.028 1.00 0.48 N ATOM 1640 CA GLY A 132 -5.061 -10.955 -10.543 1.00 0.51 C ATOM 1641 C GLY A 132 -4.245 -11.791 -9.569 1.00 0.45 C ATOM 1642 O GLY A 132 -4.455 -13.001 -9.457 1.00 0.52 O ATOM 0 H GLY A 132 -4.668 -8.901 -10.645 1.00 0.48 H new ATOM 0 HA2 GLY A 132 -5.981 -10.633 -10.054 1.00 0.51 H new ATOM 0 HA3 GLY A 132 -5.351 -11.575 -11.391 1.00 0.51 H new ATOM 1646 N GLU A 133 -3.310 -11.156 -8.874 1.00 0.47 N ATOM 1647 CA GLU A 133 -2.513 -11.839 -7.862 1.00 0.45 C ATOM 1648 C GLU A 133 -2.023 -10.848 -6.822 1.00 0.33 C ATOM 1649 O GLU A 133 -1.817 -9.666 -7.121 1.00 0.30 O ATOM 1650 CB GLU A 133 -1.299 -12.544 -8.470 1.00 0.54 C ATOM 1651 CG GLU A 133 -0.105 -11.621 -8.652 1.00 0.56 C ATOM 1652 CD GLU A 133 1.045 -12.241 -9.411 1.00 0.76 C ATOM 1653 OE1 GLU A 133 1.541 -13.295 -8.967 1.00 1.31 O ATOM 1654 OE2 GLU A 133 1.439 -11.704 -10.463 1.00 1.24 O ATOM 0 H GLU A 133 -3.084 -10.168 -8.992 1.00 0.47 H new ATOM 0 HA GLU A 133 -3.158 -12.587 -7.402 1.00 0.45 H new ATOM 0 HB2 GLU A 133 -1.012 -13.378 -7.830 1.00 0.54 H new ATOM 0 HB3 GLU A 133 -1.577 -12.965 -9.436 1.00 0.54 H new ATOM 0 HG2 GLU A 133 -0.431 -10.723 -9.177 1.00 0.56 H new ATOM 0 HG3 GLU A 133 0.250 -11.306 -7.671 1.00 0.56 H new ATOM 1661 N VAL A 134 -1.844 -11.332 -5.614 1.00 0.32 N ATOM 1662 CA VAL A 134 -1.262 -10.531 -4.551 1.00 0.24 C ATOM 1663 C VAL A 134 0.257 -10.584 -4.655 1.00 0.22 C ATOM 1664 O VAL A 134 0.854 -11.657 -4.744 1.00 0.27 O ATOM 1665 CB VAL A 134 -1.717 -10.995 -3.148 1.00 0.24 C ATOM 1666 CG1 VAL A 134 -1.423 -12.455 -2.963 1.00 0.26 C ATOM 1667 CG2 VAL A 134 -1.069 -10.167 -2.048 1.00 0.21 C ATOM 0 H VAL A 134 -2.093 -12.282 -5.338 1.00 0.32 H new ATOM 0 HA VAL A 134 -1.611 -9.506 -4.675 1.00 0.24 H new ATOM 0 HB VAL A 134 -2.794 -10.844 -3.076 1.00 0.24 H new ATOM 0 HG11 VAL A 134 -1.748 -12.769 -1.971 1.00 0.26 H new ATOM 0 HG12 VAL A 134 -1.956 -13.032 -3.719 1.00 0.26 H new ATOM 0 HG13 VAL A 134 -0.351 -12.626 -3.064 1.00 0.26 H new ATOM 0 HG21 VAL A 134 -1.412 -10.521 -1.076 1.00 0.21 H new ATOM 0 HG22 VAL A 134 0.015 -10.266 -2.109 1.00 0.21 H new ATOM 0 HG23 VAL A 134 -1.345 -9.120 -2.170 1.00 0.21 H new ATOM 1677 N LYS A 135 0.871 -9.423 -4.692 1.00 0.19 N ATOM 1678 CA LYS A 135 2.318 -9.325 -4.789 1.00 0.21 C ATOM 1679 C LYS A 135 2.859 -8.470 -3.660 1.00 0.17 C ATOM 1680 O LYS A 135 4.071 -8.370 -3.464 1.00 0.18 O ATOM 1681 CB LYS A 135 2.727 -8.746 -6.147 1.00 0.29 C ATOM 1682 CG LYS A 135 1.742 -7.727 -6.684 1.00 0.34 C ATOM 1683 CD LYS A 135 0.982 -8.278 -7.873 1.00 0.29 C ATOM 1684 CE LYS A 135 1.847 -8.281 -9.131 1.00 0.52 C ATOM 1685 NZ LYS A 135 1.186 -8.969 -10.272 1.00 1.03 N ATOM 0 H LYS A 135 0.390 -8.524 -4.656 1.00 0.19 H new ATOM 0 HA LYS A 135 2.743 -10.325 -4.703 1.00 0.21 H new ATOM 0 HB2 LYS A 135 3.708 -8.280 -6.055 1.00 0.29 H new ATOM 0 HB3 LYS A 135 2.827 -9.559 -6.866 1.00 0.29 H new ATOM 0 HG2 LYS A 135 1.041 -7.446 -5.899 1.00 0.34 H new ATOM 0 HG3 LYS A 135 2.274 -6.821 -6.976 1.00 0.34 H new ATOM 0 HD2 LYS A 135 0.649 -9.293 -7.656 1.00 0.29 H new ATOM 0 HD3 LYS A 135 0.088 -7.679 -8.045 1.00 0.29 H new ATOM 0 HE2 LYS A 135 2.076 -7.253 -9.413 1.00 0.52 H new ATOM 0 HE3 LYS A 135 2.796 -8.772 -8.915 1.00 0.52 H new ATOM 0 HZ1 LYS A 135 1.342 -8.424 -11.144 1.00 1.03 H new ATOM 0 HZ2 LYS A 135 1.588 -9.922 -10.383 1.00 1.03 H new ATOM 0 HZ3 LYS A 135 0.165 -9.043 -10.088 1.00 1.03 H new ATOM 1699 N LEU A 136 1.946 -7.878 -2.909 1.00 0.14 N ATOM 1700 CA LEU A 136 2.293 -7.014 -1.807 1.00 0.14 C ATOM 1701 C LEU A 136 1.195 -7.095 -0.756 1.00 0.14 C ATOM 1702 O LEU A 136 0.100 -7.553 -1.050 1.00 0.14 O ATOM 1703 CB LEU A 136 2.416 -5.591 -2.330 1.00 0.14 C ATOM 1704 CG LEU A 136 3.535 -4.737 -1.744 1.00 0.13 C ATOM 1705 CD1 LEU A 136 4.906 -5.344 -2.014 1.00 0.16 C ATOM 1706 CD2 LEU A 136 3.447 -3.343 -2.332 1.00 0.14 C ATOM 0 H LEU A 136 0.942 -7.987 -3.051 1.00 0.14 H new ATOM 0 HA LEU A 136 3.239 -7.318 -1.359 1.00 0.14 H new ATOM 0 HB2 LEU A 136 2.554 -5.637 -3.410 1.00 0.14 H new ATOM 0 HB3 LEU A 136 1.470 -5.080 -2.151 1.00 0.14 H new ATOM 0 HG LEU A 136 3.412 -4.693 -0.662 1.00 0.13 H new ATOM 0 HD11 LEU A 136 5.678 -4.707 -1.581 1.00 0.16 H new ATOM 0 HD12 LEU A 136 4.960 -6.336 -1.565 1.00 0.16 H new ATOM 0 HD13 LEU A 136 5.063 -5.424 -3.090 1.00 0.16 H new ATOM 0 HD21 LEU A 136 4.243 -2.723 -1.920 1.00 0.14 H new ATOM 0 HD22 LEU A 136 3.554 -3.398 -3.415 1.00 0.14 H new ATOM 0 HD23 LEU A 136 2.480 -2.904 -2.085 1.00 0.14 H new ATOM 1718 N LYS A 137 1.484 -6.698 0.469 1.00 0.17 N ATOM 1719 CA LYS A 137 0.463 -6.643 1.515 1.00 0.20 C ATOM 1720 C LYS A 137 0.757 -5.495 2.463 1.00 0.18 C ATOM 1721 O LYS A 137 1.867 -4.977 2.487 1.00 0.22 O ATOM 1722 CB LYS A 137 0.410 -7.939 2.336 1.00 0.31 C ATOM 1723 CG LYS A 137 0.610 -9.215 1.536 1.00 0.35 C ATOM 1724 CD LYS A 137 0.364 -10.453 2.373 1.00 0.28 C ATOM 1725 CE LYS A 137 1.126 -10.386 3.695 1.00 0.31 C ATOM 1726 NZ LYS A 137 1.454 -11.731 4.233 1.00 0.76 N ATOM 0 H LYS A 137 2.414 -6.408 0.771 1.00 0.17 H new ATOM 0 HA LYS A 137 -0.497 -6.503 1.017 1.00 0.20 H new ATOM 0 HB2 LYS A 137 1.174 -7.891 3.112 1.00 0.31 H new ATOM 0 HB3 LYS A 137 -0.554 -7.992 2.841 1.00 0.31 H new ATOM 0 HG2 LYS A 137 -0.065 -9.216 0.680 1.00 0.35 H new ATOM 0 HG3 LYS A 137 1.626 -9.240 1.141 1.00 0.35 H new ATOM 0 HD2 LYS A 137 -0.703 -10.556 2.570 1.00 0.28 H new ATOM 0 HD3 LYS A 137 0.672 -11.338 1.817 1.00 0.28 H new ATOM 0 HE2 LYS A 137 2.047 -9.822 3.551 1.00 0.31 H new ATOM 0 HE3 LYS A 137 0.530 -9.841 4.427 1.00 0.31 H new ATOM 0 HZ1 LYS A 137 1.637 -11.661 5.254 1.00 0.76 H new ATOM 0 HZ2 LYS A 137 0.655 -12.375 4.068 1.00 0.76 H new ATOM 0 HZ3 LYS A 137 2.301 -12.099 3.754 1.00 0.76 H new ATOM 1740 N LEU A 138 -0.243 -5.088 3.221 1.00 0.18 N ATOM 1741 CA LEU A 138 -0.028 -4.172 4.325 1.00 0.20 C ATOM 1742 C LEU A 138 -0.139 -4.955 5.619 1.00 0.21 C ATOM 1743 O LEU A 138 -1.193 -5.517 5.913 1.00 0.22 O ATOM 1744 CB LEU A 138 -1.018 -2.995 4.320 1.00 0.19 C ATOM 1745 CG LEU A 138 -1.008 -2.079 3.080 1.00 0.19 C ATOM 1746 CD1 LEU A 138 0.411 -1.772 2.593 1.00 0.21 C ATOM 1747 CD2 LEU A 138 -1.848 -2.677 1.966 1.00 0.17 C ATOM 0 H LEU A 138 -1.213 -5.377 3.093 1.00 0.18 H new ATOM 0 HA LEU A 138 0.965 -3.733 4.223 1.00 0.20 H new ATOM 0 HB2 LEU A 138 -2.024 -3.398 4.436 1.00 0.19 H new ATOM 0 HB3 LEU A 138 -0.818 -2.380 5.197 1.00 0.19 H new ATOM 0 HG LEU A 138 -1.451 -1.129 3.379 1.00 0.19 H new ATOM 0 HD11 LEU A 138 0.363 -1.124 1.718 1.00 0.21 H new ATOM 0 HD12 LEU A 138 0.967 -1.272 3.386 1.00 0.21 H new ATOM 0 HD13 LEU A 138 0.914 -2.702 2.328 1.00 0.21 H new ATOM 0 HD21 LEU A 138 -1.828 -2.015 1.100 1.00 0.17 H new ATOM 0 HD22 LEU A 138 -1.444 -3.651 1.688 1.00 0.17 H new ATOM 0 HD23 LEU A 138 -2.876 -2.795 2.309 1.00 0.17 H new ATOM 1759 N ILE A 139 0.972 -4.993 6.360 1.00 0.27 N ATOM 1760 CA ILE A 139 1.133 -5.770 7.581 1.00 0.30 C ATOM 1761 C ILE A 139 1.604 -7.191 7.264 1.00 0.37 C ATOM 1762 O ILE A 139 1.136 -7.819 6.311 1.00 0.42 O ATOM 1763 CB ILE A 139 -0.139 -5.855 8.435 1.00 0.27 C ATOM 1764 CG1 ILE A 139 -0.736 -4.482 8.731 1.00 0.31 C ATOM 1765 CG2 ILE A 139 0.198 -6.550 9.720 1.00 0.35 C ATOM 1766 CD1 ILE A 139 -2.139 -4.565 9.269 1.00 0.41 C ATOM 0 H ILE A 139 1.809 -4.464 6.114 1.00 0.27 H new ATOM 0 HA ILE A 139 1.884 -5.235 8.162 1.00 0.30 H new ATOM 0 HB ILE A 139 -0.890 -6.412 7.875 1.00 0.27 H new ATOM 0 HG12 ILE A 139 -0.104 -3.963 9.452 1.00 0.31 H new ATOM 0 HG13 ILE A 139 -0.735 -3.885 7.819 1.00 0.31 H new ATOM 0 HG21 ILE A 139 -0.695 -6.620 10.341 1.00 0.35 H new ATOM 0 HG22 ILE A 139 0.570 -7.552 9.505 1.00 0.35 H new ATOM 0 HG23 ILE A 139 0.965 -5.984 10.249 1.00 0.35 H new ATOM 0 HD11 ILE A 139 -2.515 -3.560 9.462 1.00 0.41 H new ATOM 0 HD12 ILE A 139 -2.780 -5.058 8.538 1.00 0.41 H new ATOM 0 HD13 ILE A 139 -2.140 -5.137 10.197 1.00 0.41 H new ATOM 1778 N ARG A 140 2.524 -7.692 8.080 1.00 0.48 N ATOM 1779 CA ARG A 140 3.063 -9.039 7.917 1.00 0.67 C ATOM 1780 C ARG A 140 2.082 -10.067 8.474 1.00 0.78 C ATOM 1781 O ARG A 140 2.321 -10.681 9.513 1.00 1.21 O ATOM 1782 CB ARG A 140 4.427 -9.152 8.619 1.00 0.85 C ATOM 1783 CG ARG A 140 5.114 -10.506 8.455 1.00 1.60 C ATOM 1784 CD ARG A 140 5.501 -10.782 7.008 1.00 1.87 C ATOM 1785 NE ARG A 140 6.454 -9.801 6.490 1.00 2.73 N ATOM 1786 CZ ARG A 140 7.151 -9.959 5.364 1.00 3.53 C ATOM 1787 NH1 ARG A 140 7.068 -11.091 4.676 1.00 3.68 N ATOM 1788 NH2 ARG A 140 7.946 -8.990 4.932 1.00 4.55 N ATOM 0 H ARG A 140 2.916 -7.180 8.870 1.00 0.48 H new ATOM 0 HA ARG A 140 3.206 -9.239 6.855 1.00 0.67 H new ATOM 0 HB2 ARG A 140 5.086 -8.375 8.232 1.00 0.85 H new ATOM 0 HB3 ARG A 140 4.292 -8.954 9.682 1.00 0.85 H new ATOM 0 HG2 ARG A 140 6.006 -10.537 9.080 1.00 1.60 H new ATOM 0 HG3 ARG A 140 4.449 -11.294 8.808 1.00 1.60 H new ATOM 0 HD2 ARG A 140 5.934 -11.780 6.934 1.00 1.87 H new ATOM 0 HD3 ARG A 140 4.605 -10.777 6.388 1.00 1.87 H new ATOM 0 HE ARG A 140 6.594 -8.943 7.023 1.00 2.73 H new ATOM 0 HH11 ARG A 140 6.468 -11.847 5.008 1.00 3.68 H new ATOM 0 HH12 ARG A 140 7.604 -11.205 3.816 1.00 3.68 H new ATOM 0 HH21 ARG A 140 8.025 -8.122 5.461 1.00 4.55 H new ATOM 0 HH22 ARG A 140 8.478 -9.113 4.071 1.00 4.55 H new ATOM 1802 N GLY A 141 0.957 -10.213 7.791 1.00 1.19 N ATOM 1803 CA GLY A 141 -0.026 -11.203 8.177 1.00 1.54 C ATOM 1804 C GLY A 141 0.067 -12.466 7.344 1.00 1.15 C ATOM 1805 O GLY A 141 1.157 -13.005 7.154 1.00 1.76 O ATOM 0 H GLY A 141 0.706 -9.660 6.971 1.00 1.19 H new ATOM 0 HA2 GLY A 141 0.109 -11.454 9.229 1.00 1.54 H new ATOM 0 HA3 GLY A 141 -1.025 -10.778 8.077 1.00 1.54 H new ATOM 1809 N ILE A 142 -1.082 -12.885 6.809 1.00 1.02 N ATOM 1810 CA ILE A 142 -1.244 -14.147 6.092 1.00 0.99 C ATOM 1811 C ILE A 142 -0.061 -14.501 5.190 1.00 1.77 C ATOM 1812 O ILE A 142 0.112 -13.860 4.142 1.00 2.58 O ATOM 1813 CB ILE A 142 -2.553 -14.120 5.273 1.00 0.74 C ATOM 1814 CG1 ILE A 142 -2.697 -12.810 4.485 1.00 0.77 C ATOM 1815 CG2 ILE A 142 -3.745 -14.321 6.190 1.00 0.92 C ATOM 1816 CD1 ILE A 142 -2.385 -12.945 3.008 1.00 0.84 C ATOM 1817 OXT ILE A 142 0.684 -15.439 5.532 1.00 2.21 O ATOM 0 H ILE A 142 -1.944 -12.342 6.865 1.00 1.02 H new ATOM 0 HA ILE A 142 -1.288 -14.930 6.849 1.00 0.99 H new ATOM 0 HB ILE A 142 -2.516 -14.936 4.552 1.00 0.74 H new ATOM 0 HG12 ILE A 142 -3.716 -12.439 4.599 1.00 0.77 H new ATOM 0 HG13 ILE A 142 -2.035 -12.061 4.919 1.00 0.77 H new ATOM 0 HG21 ILE A 142 -4.663 -14.300 5.603 1.00 0.92 H new ATOM 0 HG22 ILE A 142 -3.658 -15.284 6.694 1.00 0.92 H new ATOM 0 HG23 ILE A 142 -3.771 -13.524 6.933 1.00 0.92 H new ATOM 0 HD11 ILE A 142 -2.509 -11.978 2.520 1.00 0.84 H new ATOM 0 HD12 ILE A 142 -1.357 -13.285 2.883 1.00 0.84 H new ATOM 0 HD13 ILE A 142 -3.064 -13.669 2.557 1.00 0.84 H new TER 1829 ILE A 142 HETATM 1830 C ACE B 552 -16.916 -4.327 5.341 1.00 0.85 C HETATM 1831 O ACE B 552 -18.081 -3.924 5.364 1.00 1.24 O HETATM 1832 CH3 ACE B 552 -15.886 -3.766 6.288 1.00 1.00 C HETATM 0 H1 ACE B 552 -15.487 -4.568 6.909 1.00 1.00 H new HETATM 0 H2 ACE B 552 -15.076 -3.312 5.717 1.00 1.00 H new HETATM 0 H3 ACE B 552 -16.349 -3.012 6.924 1.00 1.00 H new ATOM 1836 N SER B 553 -16.490 -5.267 4.503 1.00 0.66 N ATOM 1837 CA SER B 553 -17.376 -5.898 3.529 1.00 0.51 C ATOM 1838 C SER B 553 -16.781 -7.215 3.026 1.00 0.44 C ATOM 1839 O SER B 553 -17.471 -8.231 2.940 1.00 0.54 O ATOM 1840 CB SER B 553 -17.632 -4.968 2.335 1.00 0.54 C ATOM 1841 OG SER B 553 -18.252 -3.755 2.732 1.00 1.14 O ATOM 0 H SER B 553 -15.530 -5.611 4.479 1.00 0.66 H new ATOM 0 HA SER B 553 -18.322 -6.100 4.031 1.00 0.51 H new ATOM 0 HB2 SER B 553 -16.687 -4.747 1.838 1.00 0.54 H new ATOM 0 HB3 SER B 553 -18.264 -5.477 1.607 1.00 0.54 H new ATOM 0 HG SER B 553 -18.529 -3.821 3.670 1.00 1.14 H new ATOM 1847 N GLU B 554 -15.490 -7.189 2.717 1.00 0.36 N ATOM 1848 CA GLU B 554 -14.823 -8.313 2.070 1.00 0.33 C ATOM 1849 C GLU B 554 -13.631 -8.782 2.914 1.00 0.35 C ATOM 1850 O GLU B 554 -13.407 -8.251 4.000 1.00 0.40 O ATOM 1851 CB GLU B 554 -14.391 -7.868 0.667 1.00 0.32 C ATOM 1852 CG GLU B 554 -13.974 -8.989 -0.267 1.00 0.29 C ATOM 1853 CD GLU B 554 -14.862 -10.211 -0.171 1.00 0.46 C ATOM 1854 OE1 GLU B 554 -15.992 -10.161 -0.698 1.00 0.65 O ATOM 1855 OE2 GLU B 554 -14.439 -11.218 0.424 1.00 0.63 O ATOM 0 H GLU B 554 -14.879 -6.394 2.906 1.00 0.36 H new ATOM 0 HA GLU B 554 -15.500 -9.163 1.981 1.00 0.33 H new ATOM 0 HB2 GLU B 554 -15.214 -7.321 0.207 1.00 0.32 H new ATOM 0 HB3 GLU B 554 -13.560 -7.170 0.765 1.00 0.32 H new ATOM 0 HG2 GLU B 554 -13.985 -8.621 -1.293 1.00 0.29 H new ATOM 0 HG3 GLU B 554 -12.947 -9.276 -0.042 1.00 0.29 H new ATOM 1862 N THR B 555 -12.893 -9.777 2.417 1.00 0.33 N ATOM 1863 CA THR B 555 -11.691 -10.299 3.064 1.00 0.35 C ATOM 1864 C THR B 555 -10.792 -9.156 3.536 1.00 0.34 C ATOM 1865 O THR B 555 -10.187 -9.207 4.604 1.00 0.45 O ATOM 1866 CB THR B 555 -10.936 -11.216 2.071 1.00 0.36 C ATOM 1867 OG1 THR B 555 -9.732 -11.726 2.649 1.00 0.45 O ATOM 1868 CG2 THR B 555 -10.620 -10.465 0.783 1.00 0.30 C ATOM 0 H THR B 555 -13.118 -10.248 1.541 1.00 0.33 H new ATOM 0 HA THR B 555 -11.978 -10.879 3.941 1.00 0.35 H new ATOM 0 HB THR B 555 -11.587 -12.059 1.839 1.00 0.36 H new ATOM 0 HG1 THR B 555 -9.783 -11.657 3.625 1.00 0.45 H new ATOM 0 HG21 THR B 555 -10.089 -11.126 0.097 1.00 0.30 H new ATOM 0 HG22 THR B 555 -11.548 -10.131 0.319 1.00 0.30 H new ATOM 0 HG23 THR B 555 -9.996 -9.600 1.010 1.00 0.30 H new ATOM 1876 N THR B 556 -10.744 -8.123 2.726 1.00 0.26 N ATOM 1877 CA THR B 556 -10.087 -6.891 3.079 1.00 0.23 C ATOM 1878 C THR B 556 -10.936 -5.740 2.592 1.00 0.21 C ATOM 1879 O THR B 556 -11.261 -4.819 3.340 1.00 0.22 O ATOM 1880 CB THR B 556 -8.701 -6.778 2.432 1.00 0.20 C ATOM 1881 OG1 THR B 556 -7.860 -7.856 2.849 1.00 0.24 O ATOM 1882 CG2 THR B 556 -8.063 -5.454 2.794 1.00 0.20 C ATOM 0 H THR B 556 -11.164 -8.117 1.797 1.00 0.26 H new ATOM 0 HA THR B 556 -9.962 -6.869 4.162 1.00 0.23 H new ATOM 0 HB THR B 556 -8.822 -6.831 1.350 1.00 0.20 H new ATOM 0 HG1 THR B 556 -7.383 -7.602 3.667 1.00 0.24 H new ATOM 0 HG21 THR B 556 -7.080 -5.385 2.329 1.00 0.20 H new ATOM 0 HG22 THR B 556 -8.691 -4.638 2.437 1.00 0.20 H new ATOM 0 HG23 THR B 556 -7.958 -5.385 3.877 1.00 0.20 H new ATOM 1890 N LEU B 557 -11.307 -5.845 1.318 1.00 0.20 N ATOM 1891 CA LEU B 557 -12.074 -4.832 0.629 1.00 0.19 C ATOM 1892 C LEU B 557 -11.233 -3.585 0.441 1.00 0.17 C ATOM 1893 O LEU B 557 -10.016 -3.674 0.468 1.00 0.18 O ATOM 1894 CB LEU B 557 -13.362 -4.510 1.379 1.00 0.21 C ATOM 1895 CG LEU B 557 -14.587 -4.375 0.492 1.00 0.21 C ATOM 1896 CD1 LEU B 557 -15.306 -3.098 0.843 1.00 0.23 C ATOM 1897 CD2 LEU B 557 -14.200 -4.417 -0.983 1.00 0.20 C ATOM 0 H LEU B 557 -11.076 -6.650 0.735 1.00 0.20 H new ATOM 0 HA LEU B 557 -12.353 -5.218 -0.351 1.00 0.19 H new ATOM 0 HB2 LEU B 557 -13.545 -5.293 2.114 1.00 0.21 H new ATOM 0 HB3 LEU B 557 -13.224 -3.580 1.931 1.00 0.21 H new ATOM 0 HG LEU B 557 -15.258 -5.216 0.664 1.00 0.21 H new ATOM 0 HD11 LEU B 557 -16.188 -2.991 0.211 1.00 0.23 H new ATOM 0 HD12 LEU B 557 -15.611 -3.128 1.889 1.00 0.23 H new ATOM 0 HD13 LEU B 557 -14.640 -2.250 0.683 1.00 0.23 H new ATOM 0 HD21 LEU B 557 -15.095 -4.318 -1.597 1.00 0.20 H new ATOM 0 HD22 LEU B 557 -13.517 -3.597 -1.203 1.00 0.20 H new ATOM 0 HD23 LEU B 557 -13.711 -5.366 -1.204 1.00 0.20 H new ATOM 1909 N LEU B 558 -11.899 -2.438 0.291 1.00 0.18 N ATOM 1910 CA LEU B 558 -11.249 -1.153 0.020 1.00 0.18 C ATOM 1911 C LEU B 558 -11.108 -0.967 -1.475 1.00 0.19 C ATOM 1912 O LEU B 558 -10.035 -0.669 -1.998 1.00 0.23 O ATOM 1913 CB LEU B 558 -9.889 -1.005 0.735 1.00 0.16 C ATOM 1914 CG LEU B 558 -9.933 -0.805 2.258 1.00 0.16 C ATOM 1915 CD1 LEU B 558 -10.915 -1.745 2.921 1.00 0.17 C ATOM 1916 CD2 LEU B 558 -8.554 -1.016 2.845 1.00 0.16 C ATOM 0 H LEU B 558 -12.915 -2.374 0.355 1.00 0.18 H new ATOM 0 HA LEU B 558 -11.884 -0.366 0.427 1.00 0.18 H new ATOM 0 HB2 LEU B 558 -9.295 -1.894 0.525 1.00 0.16 H new ATOM 0 HB3 LEU B 558 -9.363 -0.158 0.295 1.00 0.16 H new ATOM 0 HG LEU B 558 -10.266 0.216 2.447 1.00 0.16 H new ATOM 0 HD11 LEU B 558 -10.915 -1.571 3.997 1.00 0.17 H new ATOM 0 HD12 LEU B 558 -11.914 -1.566 2.524 1.00 0.17 H new ATOM 0 HD13 LEU B 558 -10.624 -2.776 2.720 1.00 0.17 H new ATOM 0 HD21 LEU B 558 -8.592 -0.873 3.925 1.00 0.16 H new ATOM 0 HD22 LEU B 558 -8.216 -2.029 2.625 1.00 0.16 H new ATOM 0 HD23 LEU B 558 -7.859 -0.299 2.408 1.00 0.16 H new ATOM 1928 N GLU B 559 -12.229 -1.147 -2.146 1.00 0.19 N ATOM 1929 CA GLU B 559 -12.314 -0.979 -3.585 1.00 0.21 C ATOM 1930 C GLU B 559 -13.009 0.325 -3.902 1.00 0.24 C ATOM 1931 O GLU B 559 -13.110 0.744 -5.052 1.00 0.31 O ATOM 1932 CB GLU B 559 -13.071 -2.146 -4.200 1.00 0.22 C ATOM 1933 CG GLU B 559 -12.285 -3.439 -4.186 1.00 0.25 C ATOM 1934 CD GLU B 559 -13.052 -4.593 -4.792 1.00 0.29 C ATOM 1935 OE1 GLU B 559 -14.034 -5.052 -4.175 1.00 0.33 O ATOM 1936 OE2 GLU B 559 -12.679 -5.046 -5.894 1.00 0.38 O ATOM 0 H GLU B 559 -13.110 -1.415 -1.707 1.00 0.19 H new ATOM 0 HA GLU B 559 -11.309 -0.956 -4.007 1.00 0.21 H new ATOM 0 HB2 GLU B 559 -14.006 -2.290 -3.658 1.00 0.22 H new ATOM 0 HB3 GLU B 559 -13.334 -1.899 -5.229 1.00 0.22 H new ATOM 0 HG2 GLU B 559 -11.353 -3.299 -4.734 1.00 0.25 H new ATOM 0 HG3 GLU B 559 -12.017 -3.686 -3.159 1.00 0.25 H new ATOM 1943 N ASP B 560 -13.494 0.953 -2.851 1.00 0.25 N ATOM 1944 CA ASP B 560 -14.112 2.257 -2.936 1.00 0.31 C ATOM 1945 C ASP B 560 -13.620 3.087 -1.774 1.00 0.25 C ATOM 1946 O ASP B 560 -13.306 2.529 -0.723 1.00 0.26 O ATOM 1947 CB ASP B 560 -15.641 2.167 -2.895 1.00 0.45 C ATOM 1948 CG ASP B 560 -16.208 1.263 -3.971 1.00 0.74 C ATOM 1949 OD1 ASP B 560 -16.423 1.745 -5.105 1.00 0.90 O ATOM 1950 OD2 ASP B 560 -16.449 0.072 -3.688 1.00 0.95 O ATOM 0 H ASP B 560 -13.469 0.568 -1.907 1.00 0.25 H new ATOM 0 HA ASP B 560 -13.840 2.715 -3.887 1.00 0.31 H new ATOM 0 HB2 ASP B 560 -15.952 1.799 -1.917 1.00 0.45 H new ATOM 0 HB3 ASP B 560 -16.062 3.166 -3.008 1.00 0.45 H new ATOM 1955 N GLU B 561 -13.551 4.391 -1.948 1.00 0.26 N ATOM 1956 CA GLU B 561 -12.948 5.266 -0.959 1.00 0.26 C ATOM 1957 C GLU B 561 -13.606 5.091 0.406 1.00 0.26 C ATOM 1958 O GLU B 561 -12.933 4.818 1.398 1.00 0.29 O ATOM 1959 CB GLU B 561 -13.067 6.710 -1.427 1.00 0.30 C ATOM 1960 CG GLU B 561 -12.632 7.723 -0.394 1.00 0.35 C ATOM 1961 CD GLU B 561 -12.979 9.138 -0.809 1.00 0.45 C ATOM 1962 OE1 GLU B 561 -14.172 9.505 -0.734 1.00 0.68 O ATOM 1963 OE2 GLU B 561 -12.071 9.884 -1.224 1.00 0.69 O ATOM 0 H GLU B 561 -13.908 4.873 -2.773 1.00 0.26 H new ATOM 0 HA GLU B 561 -11.896 5.003 -0.852 1.00 0.26 H new ATOM 0 HB2 GLU B 561 -12.466 6.841 -2.327 1.00 0.30 H new ATOM 0 HB3 GLU B 561 -14.102 6.908 -1.704 1.00 0.30 H new ATOM 0 HG2 GLU B 561 -13.109 7.497 0.560 1.00 0.35 H new ATOM 0 HG3 GLU B 561 -11.556 7.644 -0.239 1.00 0.35 H new ATOM 1970 N LYS B 562 -14.921 5.210 0.435 1.00 0.30 N ATOM 1971 CA LYS B 562 -15.686 5.119 1.667 1.00 0.39 C ATOM 1972 C LYS B 562 -15.390 3.825 2.421 1.00 0.34 C ATOM 1973 O LYS B 562 -15.142 3.848 3.618 1.00 0.40 O ATOM 1974 CB LYS B 562 -17.177 5.187 1.350 1.00 0.51 C ATOM 1975 CG LYS B 562 -18.065 5.336 2.579 1.00 0.74 C ATOM 1976 CD LYS B 562 -17.811 6.653 3.297 1.00 1.73 C ATOM 1977 CE LYS B 562 -18.684 6.803 4.535 1.00 2.39 C ATOM 1978 NZ LYS B 562 -20.134 6.759 4.209 1.00 3.03 N ATOM 0 H LYS B 562 -15.490 5.373 -0.396 1.00 0.30 H new ATOM 0 HA LYS B 562 -15.396 5.956 2.302 1.00 0.39 H new ATOM 0 HB2 LYS B 562 -17.358 6.027 0.680 1.00 0.51 H new ATOM 0 HB3 LYS B 562 -17.466 4.283 0.813 1.00 0.51 H new ATOM 0 HG2 LYS B 562 -19.112 5.279 2.281 1.00 0.74 H new ATOM 0 HG3 LYS B 562 -17.883 4.507 3.263 1.00 0.74 H new ATOM 0 HD2 LYS B 562 -16.761 6.713 3.584 1.00 1.73 H new ATOM 0 HD3 LYS B 562 -18.003 7.481 2.615 1.00 1.73 H new ATOM 0 HE2 LYS B 562 -18.448 6.008 5.242 1.00 2.39 H new ATOM 0 HE3 LYS B 562 -18.453 7.747 5.028 1.00 2.39 H new ATOM 0 HZ1 LYS B 562 -20.685 7.065 5.036 1.00 3.03 H new ATOM 0 HZ2 LYS B 562 -20.329 7.394 3.409 1.00 3.03 H new ATOM 0 HZ3 LYS B 562 -20.403 5.787 3.954 1.00 3.03 H new ATOM 1992 N SER B 563 -15.374 2.710 1.710 1.00 0.27 N ATOM 1993 CA SER B 563 -15.153 1.414 2.334 1.00 0.24 C ATOM 1994 C SER B 563 -13.677 1.206 2.640 1.00 0.21 C ATOM 1995 O SER B 563 -13.310 0.373 3.464 1.00 0.20 O ATOM 1996 CB SER B 563 -15.686 0.309 1.429 1.00 0.27 C ATOM 1997 OG SER B 563 -17.028 0.578 1.057 1.00 0.91 O ATOM 0 H SER B 563 -15.511 2.675 0.700 1.00 0.27 H new ATOM 0 HA SER B 563 -15.693 1.381 3.280 1.00 0.24 H new ATOM 0 HB2 SER B 563 -15.064 0.229 0.537 1.00 0.27 H new ATOM 0 HB3 SER B 563 -15.630 -0.650 1.944 1.00 0.27 H new ATOM 0 HG SER B 563 -17.356 -0.139 0.475 1.00 0.91 H new ATOM 2003 N LEU B 564 -12.846 1.992 1.983 1.00 0.20 N ATOM 2004 CA LEU B 564 -11.416 1.931 2.169 1.00 0.19 C ATOM 2005 C LEU B 564 -11.109 2.593 3.489 1.00 0.21 C ATOM 2006 O LEU B 564 -10.445 2.039 4.362 1.00 0.21 O ATOM 2007 CB LEU B 564 -10.710 2.688 1.051 1.00 0.19 C ATOM 2008 CG LEU B 564 -9.245 2.318 0.785 1.00 0.17 C ATOM 2009 CD1 LEU B 564 -8.648 3.282 -0.205 1.00 0.21 C ATOM 2010 CD2 LEU B 564 -8.390 2.306 2.038 1.00 0.18 C ATOM 0 H LEU B 564 -13.148 2.691 1.305 1.00 0.20 H new ATOM 0 HA LEU B 564 -11.073 0.896 2.156 1.00 0.19 H new ATOM 0 HB2 LEU B 564 -11.272 2.536 0.130 1.00 0.19 H new ATOM 0 HB3 LEU B 564 -10.756 3.753 1.280 1.00 0.19 H new ATOM 0 HG LEU B 564 -9.251 1.303 0.388 1.00 0.17 H new ATOM 0 HD11 LEU B 564 -7.608 3.015 -0.391 1.00 0.21 H new ATOM 0 HD12 LEU B 564 -9.207 3.236 -1.140 1.00 0.21 H new ATOM 0 HD13 LEU B 564 -8.697 4.294 0.198 1.00 0.21 H new ATOM 0 HD21 LEU B 564 -7.366 2.037 1.777 1.00 0.18 H new ATOM 0 HD22 LEU B 564 -8.400 3.296 2.495 1.00 0.18 H new ATOM 0 HD23 LEU B 564 -8.789 1.577 2.744 1.00 0.18 H new ATOM 2022 N VAL B 565 -11.655 3.784 3.634 1.00 0.23 N ATOM 2023 CA VAL B 565 -11.413 4.587 4.802 1.00 0.26 C ATOM 2024 C VAL B 565 -12.157 4.039 5.992 1.00 0.28 C ATOM 2025 O VAL B 565 -11.633 4.053 7.083 1.00 0.32 O ATOM 2026 CB VAL B 565 -11.792 6.050 4.545 1.00 0.29 C ATOM 2027 CG1 VAL B 565 -11.230 6.445 3.208 1.00 0.28 C ATOM 2028 CG2 VAL B 565 -13.298 6.266 4.575 1.00 0.30 C ATOM 0 H VAL B 565 -12.274 4.215 2.947 1.00 0.23 H new ATOM 0 HA VAL B 565 -10.347 4.549 5.025 1.00 0.26 H new ATOM 0 HB VAL B 565 -11.376 6.671 5.338 1.00 0.29 H new ATOM 0 HG11 VAL B 565 -11.485 7.484 2.999 1.00 0.28 H new ATOM 0 HG12 VAL B 565 -10.146 6.333 3.222 1.00 0.28 H new ATOM 0 HG13 VAL B 565 -11.651 5.805 2.433 1.00 0.28 H new ATOM 0 HG21 VAL B 565 -13.519 7.317 4.388 1.00 0.30 H new ATOM 0 HG22 VAL B 565 -13.769 5.654 3.806 1.00 0.30 H new ATOM 0 HG23 VAL B 565 -13.687 5.982 5.553 1.00 0.30 H new ATOM 2038 N SER B 566 -13.350 3.508 5.765 1.00 0.28 N ATOM 2039 CA SER B 566 -14.129 2.869 6.822 1.00 0.30 C ATOM 2040 C SER B 566 -13.367 1.691 7.413 1.00 0.30 C ATOM 2041 O SER B 566 -13.658 1.211 8.510 1.00 0.35 O ATOM 2042 CB SER B 566 -15.460 2.401 6.256 1.00 0.31 C ATOM 2043 OG SER B 566 -16.280 3.506 5.924 1.00 0.75 O ATOM 0 H SER B 566 -13.804 3.506 4.852 1.00 0.28 H new ATOM 0 HA SER B 566 -14.307 3.593 7.617 1.00 0.30 H new ATOM 0 HB2 SER B 566 -15.289 1.790 5.370 1.00 0.31 H new ATOM 0 HB3 SER B 566 -15.969 1.770 6.985 1.00 0.31 H new ATOM 0 HG SER B 566 -16.181 3.712 4.971 1.00 0.75 H new ATOM 2049 N TYR B 567 -12.379 1.248 6.672 1.00 0.26 N ATOM 2050 CA TYR B 567 -11.533 0.152 7.085 1.00 0.25 C ATOM 2051 C TYR B 567 -10.265 0.684 7.731 1.00 0.26 C ATOM 2052 O TYR B 567 -9.662 0.021 8.558 1.00 0.28 O ATOM 2053 CB TYR B 567 -11.201 -0.678 5.862 1.00 0.23 C ATOM 2054 CG TYR B 567 -10.400 -1.920 6.133 1.00 0.22 C ATOM 2055 CD1 TYR B 567 -11.025 -3.107 6.483 1.00 0.23 C ATOM 2056 CD2 TYR B 567 -9.018 -1.891 6.068 1.00 0.24 C ATOM 2057 CE1 TYR B 567 -10.281 -4.240 6.756 1.00 0.25 C ATOM 2058 CE2 TYR B 567 -8.268 -3.015 6.337 1.00 0.25 C ATOM 2059 CZ TYR B 567 -8.944 -4.238 6.583 1.00 0.24 C ATOM 2060 OH TYR B 567 -8.158 -5.315 6.953 1.00 0.29 O ATOM 0 H TYR B 567 -12.138 1.639 5.761 1.00 0.26 H new ATOM 0 HA TYR B 567 -12.049 -0.466 7.820 1.00 0.25 H new ATOM 0 HB2 TYR B 567 -12.132 -0.964 5.373 1.00 0.23 H new ATOM 0 HB3 TYR B 567 -10.649 -0.055 5.158 1.00 0.23 H new ATOM 0 HD1 TYR B 567 -12.103 -3.147 6.543 1.00 0.23 H new ATOM 0 HD2 TYR B 567 -8.519 -0.971 5.802 1.00 0.24 H new ATOM 0 HE1 TYR B 567 -10.774 -5.133 7.110 1.00 0.25 H new ATOM 0 HE2 TYR B 567 -7.189 -2.966 6.360 1.00 0.25 H new ATOM 0 HH TYR B 567 -8.678 -6.142 6.875 1.00 0.29 H new ATOM 2070 N LEU B 568 -9.862 1.875 7.312 1.00 0.26 N ATOM 2071 CA LEU B 568 -8.659 2.529 7.819 1.00 0.29 C ATOM 2072 C LEU B 568 -8.921 3.390 9.055 1.00 0.35 C ATOM 2073 O LEU B 568 -8.091 3.464 9.957 1.00 0.39 O ATOM 2074 CB LEU B 568 -8.093 3.412 6.730 1.00 0.28 C ATOM 2075 CG LEU B 568 -7.042 2.782 5.840 1.00 0.25 C ATOM 2076 CD1 LEU B 568 -7.371 1.335 5.504 1.00 0.23 C ATOM 2077 CD2 LEU B 568 -6.960 3.603 4.590 1.00 0.26 C ATOM 0 H LEU B 568 -10.361 2.419 6.608 1.00 0.26 H new ATOM 0 HA LEU B 568 -7.962 1.744 8.110 1.00 0.29 H new ATOM 0 HB2 LEU B 568 -8.916 3.752 6.101 1.00 0.28 H new ATOM 0 HB3 LEU B 568 -7.662 4.298 7.196 1.00 0.28 H new ATOM 0 HG LEU B 568 -6.086 2.767 6.363 1.00 0.25 H new ATOM 0 HD11 LEU B 568 -6.590 0.924 4.864 1.00 0.23 H new ATOM 0 HD12 LEU B 568 -7.431 0.753 6.423 1.00 0.23 H new ATOM 0 HD13 LEU B 568 -8.328 1.291 4.983 1.00 0.23 H new ATOM 0 HD21 LEU B 568 -6.210 3.177 3.923 1.00 0.26 H new ATOM 0 HD22 LEU B 568 -7.929 3.605 4.092 1.00 0.26 H new ATOM 0 HD23 LEU B 568 -6.681 4.626 4.844 1.00 0.26 H new ATOM 2089 N ASN B 569 -10.065 4.054 9.082 1.00 0.38 N ATOM 2090 CA ASN B 569 -10.392 4.977 10.172 1.00 0.46 C ATOM 2091 C ASN B 569 -11.078 4.244 11.319 1.00 0.50 C ATOM 2092 O ASN B 569 -11.735 4.857 12.163 1.00 0.74 O ATOM 2093 CB ASN B 569 -11.284 6.132 9.684 1.00 0.52 C ATOM 2094 CG ASN B 569 -12.764 5.774 9.581 1.00 0.54 C ATOM 2095 OD1 ASN B 569 -13.620 6.593 9.904 1.00 0.68 O ATOM 2096 ND2 ASN B 569 -13.083 4.588 9.086 1.00 0.44 N ATOM 0 H ASN B 569 -10.786 3.976 8.365 1.00 0.38 H new ATOM 0 HA ASN B 569 -9.452 5.397 10.531 1.00 0.46 H new ATOM 0 HB2 ASN B 569 -11.172 6.976 10.364 1.00 0.52 H new ATOM 0 HB3 ASN B 569 -10.932 6.461 8.706 1.00 0.52 H new ATOM 0 HD21 ASN B 569 -14.063 4.333 8.964 1.00 0.44 H new ATOM 0 HD22 ASN B 569 -12.349 3.929 8.827 1.00 0.44 H new ATOM 2103 N TYR B 570 -10.922 2.930 11.321 1.00 0.50 N ATOM 2104 CA TYR B 570 -11.516 2.058 12.324 1.00 0.59 C ATOM 2105 C TYR B 570 -11.117 2.492 13.740 1.00 0.90 C ATOM 2106 O TYR B 570 -12.016 2.886 14.513 1.00 1.34 O ATOM 2107 CB TYR B 570 -11.110 0.597 12.052 1.00 0.39 C ATOM 2108 CG TYR B 570 -9.616 0.345 12.094 1.00 0.42 C ATOM 2109 CD1 TYR B 570 -8.795 0.726 11.042 1.00 0.36 C ATOM 2110 CD2 TYR B 570 -9.026 -0.268 13.191 1.00 0.66 C ATOM 2111 CE1 TYR B 570 -7.436 0.507 11.079 1.00 0.53 C ATOM 2112 CE2 TYR B 570 -7.666 -0.488 13.239 1.00 0.87 C ATOM 2113 CZ TYR B 570 -6.875 -0.101 12.182 1.00 0.79 C ATOM 2114 OH TYR B 570 -5.520 -0.325 12.229 1.00 1.04 O ATOM 2115 OXT TYR B 570 -9.910 2.480 14.062 1.00 1.66 O ATOM 0 H TYR B 570 -10.374 2.433 10.619 1.00 0.50 H new ATOM 0 HA TYR B 570 -12.601 2.135 12.257 1.00 0.59 H new ATOM 0 HB2 TYR B 570 -11.595 -0.045 12.787 1.00 0.39 H new ATOM 0 HB3 TYR B 570 -11.488 0.304 11.073 1.00 0.39 H new ATOM 0 HD1 TYR B 570 -9.231 1.204 10.177 1.00 0.36 H new ATOM 0 HD2 TYR B 570 -9.643 -0.578 14.021 1.00 0.66 H new ATOM 0 HE1 TYR B 570 -6.814 0.809 10.250 1.00 0.53 H new ATOM 0 HE2 TYR B 570 -7.223 -0.962 14.103 1.00 0.87 H new ATOM 0 HH TYR B 570 -5.148 -0.270 11.324 1.00 1.04 H new TER 2125 TYR B 570