USER MOD reduce.3.24.130724 H: found=0, std=0, add=1063, rem=0, adj=39 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 45 TYR OH : rot 104:sc= 1 USER MOD Set 1.2: A 135 LYS NZ :NH3+ -125:sc= 1.23 (180deg=-0.594) USER MOD Set 2.1: A 57 ASN : amide:sc= -1.17 K(o=0.4,f=-10!) USER MOD Set 2.2: A 60 ASN : amide:sc= 0.389 K(o=0.4,f=-1.1) USER MOD Set 2.3: A 62 SER OG : rot -105:sc= 1.18 USER MOD Set 3.1: A 55 SER OG : rot -7:sc= 0.232 USER MOD Set 3.2: A 66 TYR OH : rot 180:sc= 0 USER MOD Set 4.1: A 50 ASN : amide:sc= 0.981 K(o=1.5,f=-2.8) USER MOD Set 4.2: A 68 LYS NZ :NH3+ 154:sc= 0.478 (180deg=-0.265) USER MOD Set 5.1: A 29 SER OG : rot -75:sc= -0.617 USER MOD Set 5.2: A 58 THR OG1 : rot 180:sc= 0.0675 USER MOD Single : A 28 SER OG : rot 29:sc= 0.0999 USER MOD Single : A 30 SER OG : rot 44:sc= 0.359 USER MOD Single : A 31 ASN : amide:sc= 0 X(o=0,f=-0.016) USER MOD Single : A 32 SER OG : rot 89:sc= 1.02 USER MOD Single : A 34 LYS NZ :NH3+ 164:sc= 2.18 (180deg=1.88) USER MOD Single : A 37 HIS : no HD1:sc= -0.0349 X(o=-0.035,f=-0.35) USER MOD Single : A 42 SER OG : rot 128:sc= 0.341 USER MOD Single : A 43 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 47 SER OG : rot 180:sc= -0.777 USER MOD Single : A 59 THR OG1 : rot 135:sc= -0.238 USER MOD Single : A 61 LYS NZ :NH3+ 162:sc= 1.01 (180deg=0.18) USER MOD Single : A 64 ASN : amide:sc= -1.17! K(o=-1.2!,f=-0.031) USER MOD Single : A 67 SER OG : rot 180:sc= -3.14! 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 1:sc= 1.17 USER MOD Single : A 77 SER OG : rot 180:sc= -0.491 USER MOD Single : A 79 ASN : amide:sc= 0 X(o=0,f=-0.064) USER MOD Single : A 82 LYS NZ :NH3+ -121:sc= -0.547 (180deg=-4.02!) USER MOD Single : A 84 MET CE :methyl 141:sc= 0 (180deg=-1.01) USER MOD Single : A 86 ASN : amide:sc= 0 X(o=0,f=-0.41) USER MOD Single : A 88 ASN : amide:sc= -0.015 K(o=-0.015,f=-1.2!) USER MOD Single : A 90 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 97 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 100 GLN : amide:sc= -7.33! C(o=-7.3!,f=-8.6!) USER MOD Single : A 101 LYS NZ :NH3+ 165:sc= 1.14 (180deg=0.943) USER MOD Single : A 106 LYS NZ :NH3+ -173:sc= 1.29 (180deg=1.18) USER MOD Single : A 109 SER OG : rot 180:sc= 0 USER MOD Single : A 110 MET CE :methyl -170:sc= -7.9! (180deg=-8.47!) USER MOD Single : A 112 LYS NZ :NH3+ 153:sc= 0 (180deg=-0.156) USER MOD Single : A 118 LYS NZ :NH3+ 177:sc= 0.6 (180deg=0.571) USER MOD Single : A 120 ASN : amide:sc= -0.452 K(o=-0.45,f=-3.5!) USER MOD Single : A 121 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 123 ASN : amide:sc= -0.108 X(o=-0.11,f=-0.41) USER MOD Single : A 125 THR OG1 : rot 172:sc= 1.04 USER MOD Single : A 130 LYS NZ :NH3+ -163:sc= 1.22 (180deg=0.349) USER MOD Single : A 137 LYS NZ :NH3+ 141:sc= -1.77 (180deg=-5.29!) USER MOD Single : B 553 SER OG : rot 180:sc= 0 USER MOD Single : B 555 THR OG1 : rot 147:sc= 0.0437 USER MOD Single : B 556 THR OG1 : rot -99:sc= 0.273 USER MOD Single : B 562 LYS NZ :NH3+ 168:sc= -0.0287 (180deg=-0.206) USER MOD Single : B 563 SER OG : rot 125:sc= 1.18 USER MOD Single : B 566 SER OG : rot 89:sc= 1.23 USER MOD Single : B 567 TYR OH : rot -105:sc= 1.04 USER MOD Single : B 569 ASN : amide:sc= -3.45! C(o=-3.4!,f=-2.9!) USER MOD Single : B 570 TYR OH : rot 180:sc= -0.091 USER MOD ----------------------------------------------------------------- ATOM 1 N SER A 28 -14.808 8.216 12.074 1.00 2.50 N ATOM 2 CA SER A 28 -14.669 9.327 11.112 1.00 2.12 C ATOM 3 C SER A 28 -13.352 9.207 10.362 1.00 1.79 C ATOM 4 O SER A 28 -12.323 8.876 10.953 1.00 2.43 O ATOM 5 CB SER A 28 -14.729 10.662 11.850 1.00 3.05 C ATOM 6 OG SER A 28 -15.938 10.786 12.577 1.00 3.51 O ATOM 0 HA SER A 28 -15.488 9.279 10.395 1.00 2.12 H new ATOM 0 HB2 SER A 28 -13.881 10.744 12.530 1.00 3.05 H new ATOM 0 HB3 SER A 28 -14.645 11.481 11.135 1.00 3.05 H new ATOM 0 HG SER A 28 -16.250 9.897 12.848 1.00 3.51 H new ATOM 14 N SER A 29 -13.377 9.467 9.063 1.00 1.34 N ATOM 15 CA SER A 29 -12.175 9.362 8.255 1.00 1.18 C ATOM 16 C SER A 29 -11.303 10.601 8.422 1.00 1.01 C ATOM 17 O SER A 29 -11.164 11.410 7.503 1.00 1.64 O ATOM 18 CB SER A 29 -12.532 9.160 6.783 1.00 1.37 C ATOM 19 OG SER A 29 -11.368 8.952 6.000 1.00 2.03 O ATOM 0 H SER A 29 -14.212 9.750 8.550 1.00 1.34 H new ATOM 0 HA SER A 29 -11.611 8.494 8.598 1.00 1.18 H new ATOM 0 HB2 SER A 29 -13.200 8.305 6.682 1.00 1.37 H new ATOM 0 HB3 SER A 29 -13.072 10.032 6.413 1.00 1.37 H new ATOM 0 HG SER A 29 -10.900 9.804 5.878 1.00 2.03 H new ATOM 25 N SER A 30 -10.728 10.754 9.605 1.00 0.99 N ATOM 26 CA SER A 30 -9.833 11.861 9.869 1.00 0.94 C ATOM 27 C SER A 30 -8.924 11.564 11.056 1.00 1.16 C ATOM 28 O SER A 30 -9.306 11.735 12.214 1.00 1.79 O ATOM 29 CB SER A 30 -10.627 13.144 10.100 1.00 1.26 C ATOM 30 OG SER A 30 -11.600 12.970 11.117 1.00 1.64 O ATOM 0 H SER A 30 -10.868 10.124 10.395 1.00 0.99 H new ATOM 0 HA SER A 30 -9.199 12.000 8.994 1.00 0.94 H new ATOM 0 HB2 SER A 30 -9.948 13.950 10.377 1.00 1.26 H new ATOM 0 HB3 SER A 30 -11.116 13.444 9.173 1.00 1.26 H new ATOM 0 HG SER A 30 -11.202 12.488 11.872 1.00 1.64 H new ATOM 36 N ASN A 31 -7.723 11.117 10.723 1.00 1.04 N ATOM 37 CA ASN A 31 -6.684 10.774 11.681 1.00 1.33 C ATOM 38 C ASN A 31 -5.552 10.089 10.934 1.00 1.42 C ATOM 39 O ASN A 31 -4.405 10.524 10.988 1.00 2.38 O ATOM 40 CB ASN A 31 -7.204 9.847 12.787 1.00 1.72 C ATOM 41 CG ASN A 31 -6.133 9.503 13.805 1.00 2.16 C ATOM 42 OD1 ASN A 31 -5.429 8.502 13.671 1.00 2.49 O ATOM 43 ND2 ASN A 31 -6.001 10.331 14.827 1.00 2.79 N ATOM 0 H ASN A 31 -7.437 10.979 9.754 1.00 1.04 H new ATOM 0 HA ASN A 31 -6.339 11.690 12.161 1.00 1.33 H new ATOM 0 HB2 ASN A 31 -8.043 10.325 13.293 1.00 1.72 H new ATOM 0 HB3 ASN A 31 -7.584 8.929 12.339 1.00 1.72 H new ATOM 0 HD21 ASN A 31 -5.295 10.151 15.541 1.00 2.79 H new ATOM 0 HD22 ASN A 31 -6.605 11.150 14.901 1.00 2.79 H new ATOM 50 N SER A 32 -5.915 9.039 10.192 1.00 0.84 N ATOM 51 CA SER A 32 -4.957 8.212 9.468 1.00 0.94 C ATOM 52 C SER A 32 -3.876 7.689 10.426 1.00 0.96 C ATOM 53 O SER A 32 -4.156 6.825 11.256 1.00 1.46 O ATOM 54 CB SER A 32 -4.330 8.970 8.298 1.00 1.10 C ATOM 55 OG SER A 32 -3.320 8.202 7.666 1.00 1.41 O ATOM 0 H SER A 32 -6.884 8.741 10.079 1.00 0.84 H new ATOM 0 HA SER A 32 -5.495 7.361 9.050 1.00 0.94 H new ATOM 0 HB2 SER A 32 -5.102 9.226 7.573 1.00 1.10 H new ATOM 0 HB3 SER A 32 -3.906 9.908 8.656 1.00 1.10 H new ATOM 0 HG SER A 32 -3.720 7.654 6.959 1.00 1.41 H new ATOM 61 N GLU A 33 -2.663 8.258 10.313 1.00 0.85 N ATOM 62 CA GLU A 33 -1.502 7.915 11.131 1.00 0.86 C ATOM 63 C GLU A 33 -1.388 6.426 11.415 1.00 0.72 C ATOM 64 O GLU A 33 -0.949 6.009 12.486 1.00 0.83 O ATOM 65 CB GLU A 33 -1.526 8.716 12.423 1.00 1.05 C ATOM 66 CG GLU A 33 -1.346 10.211 12.219 1.00 1.38 C ATOM 67 CD GLU A 33 -1.318 10.979 13.525 1.00 1.93 C ATOM 68 OE1 GLU A 33 -0.232 11.085 14.133 1.00 2.24 O ATOM 69 OE2 GLU A 33 -2.381 11.480 13.954 1.00 2.56 O ATOM 0 H GLU A 33 -2.465 8.989 9.629 1.00 0.85 H new ATOM 0 HA GLU A 33 -0.614 8.178 10.556 1.00 0.86 H new ATOM 0 HB2 GLU A 33 -2.474 8.539 12.932 1.00 1.05 H new ATOM 0 HB3 GLU A 33 -0.738 8.351 13.081 1.00 1.05 H new ATOM 0 HG2 GLU A 33 -0.418 10.391 11.676 1.00 1.38 H new ATOM 0 HG3 GLU A 33 -2.157 10.589 11.597 1.00 1.38 H new ATOM 76 N LYS A 34 -1.790 5.638 10.444 1.00 0.62 N ATOM 77 CA LYS A 34 -1.662 4.220 10.501 1.00 0.54 C ATOM 78 C LYS A 34 -0.493 3.774 9.640 1.00 0.43 C ATOM 79 O LYS A 34 -0.590 3.761 8.413 1.00 0.53 O ATOM 80 CB LYS A 34 -2.967 3.630 10.014 1.00 0.66 C ATOM 81 CG LYS A 34 -3.754 2.997 11.130 1.00 0.83 C ATOM 82 CD LYS A 34 -5.118 3.626 11.303 1.00 0.84 C ATOM 83 CE LYS A 34 -5.859 2.989 12.466 1.00 0.90 C ATOM 84 NZ LYS A 34 -7.186 3.614 12.694 1.00 1.23 N ATOM 0 H LYS A 34 -2.220 5.980 9.585 1.00 0.62 H new ATOM 0 HA LYS A 34 -1.462 3.879 11.517 1.00 0.54 H new ATOM 0 HB2 LYS A 34 -3.566 4.412 9.547 1.00 0.66 H new ATOM 0 HB3 LYS A 34 -2.763 2.884 9.246 1.00 0.66 H new ATOM 0 HG2 LYS A 34 -3.871 1.932 10.930 1.00 0.83 H new ATOM 0 HG3 LYS A 34 -3.195 3.087 12.061 1.00 0.83 H new ATOM 0 HD2 LYS A 34 -5.011 4.697 11.476 1.00 0.84 H new ATOM 0 HD3 LYS A 34 -5.697 3.508 10.387 1.00 0.84 H new ATOM 0 HE2 LYS A 34 -5.989 1.924 12.273 1.00 0.90 H new ATOM 0 HE3 LYS A 34 -5.257 3.077 13.370 1.00 0.90 H new ATOM 0 HZ1 LYS A 34 -7.763 2.994 13.298 1.00 1.23 H new ATOM 0 HZ2 LYS A 34 -7.061 4.534 13.162 1.00 1.23 H new ATOM 0 HZ3 LYS A 34 -7.666 3.752 11.782 1.00 1.23 H new ATOM 98 N GLU A 35 0.621 3.429 10.279 1.00 0.43 N ATOM 99 CA GLU A 35 1.808 3.032 9.545 1.00 0.48 C ATOM 100 C GLU A 35 1.719 1.565 9.141 1.00 0.40 C ATOM 101 O GLU A 35 2.058 0.655 9.901 1.00 0.55 O ATOM 102 CB GLU A 35 3.095 3.311 10.352 1.00 0.75 C ATOM 103 CG GLU A 35 3.119 2.733 11.764 1.00 1.06 C ATOM 104 CD GLU A 35 2.309 3.544 12.755 1.00 1.35 C ATOM 105 OE1 GLU A 35 2.849 4.529 13.303 1.00 1.83 O ATOM 106 OE2 GLU A 35 1.127 3.203 12.982 1.00 1.86 O ATOM 0 H GLU A 35 0.722 3.418 11.294 1.00 0.43 H new ATOM 0 HA GLU A 35 1.859 3.635 8.639 1.00 0.48 H new ATOM 0 HB2 GLU A 35 3.945 2.910 9.799 1.00 0.75 H new ATOM 0 HB3 GLU A 35 3.237 4.390 10.417 1.00 0.75 H new ATOM 0 HG2 GLU A 35 2.735 1.713 11.739 1.00 1.06 H new ATOM 0 HG3 GLU A 35 4.151 2.676 12.109 1.00 1.06 H new ATOM 113 N TRP A 36 1.271 1.355 7.922 1.00 0.28 N ATOM 114 CA TRP A 36 1.145 0.014 7.366 1.00 0.25 C ATOM 115 C TRP A 36 2.503 -0.491 6.883 1.00 0.26 C ATOM 116 O TRP A 36 3.179 0.173 6.098 1.00 0.40 O ATOM 117 CB TRP A 36 0.158 -0.010 6.193 1.00 0.26 C ATOM 118 CG TRP A 36 -1.219 0.519 6.492 1.00 0.19 C ATOM 119 CD1 TRP A 36 -1.869 1.507 5.811 1.00 0.56 C ATOM 120 CD2 TRP A 36 -2.119 0.093 7.526 1.00 0.54 C ATOM 121 NE1 TRP A 36 -3.117 1.712 6.348 1.00 0.47 N ATOM 122 CE2 TRP A 36 -3.291 0.864 7.401 1.00 0.27 C ATOM 123 CE3 TRP A 36 -2.055 -0.862 8.544 1.00 1.19 C ATOM 124 CZ2 TRP A 36 -4.383 0.710 8.245 1.00 0.56 C ATOM 125 CZ3 TRP A 36 -3.141 -1.012 9.385 1.00 1.51 C ATOM 126 CH2 TRP A 36 -4.291 -0.229 9.231 1.00 1.19 C ATOM 0 H TRP A 36 0.984 2.100 7.287 1.00 0.28 H new ATOM 0 HA TRP A 36 0.770 -0.635 8.157 1.00 0.25 H new ATOM 0 HB2 TRP A 36 0.581 0.571 5.373 1.00 0.26 H new ATOM 0 HB3 TRP A 36 0.065 -1.037 5.841 1.00 0.26 H new ATOM 0 HD1 TRP A 36 -1.461 2.050 4.971 1.00 0.56 H new ATOM 0 HE1 TRP A 36 -3.802 2.389 6.013 1.00 0.47 H new ATOM 0 HE3 TRP A 36 -1.173 -1.472 8.671 1.00 1.19 H new ATOM 0 HZ2 TRP A 36 -5.272 1.311 8.125 1.00 0.56 H new ATOM 0 HZ3 TRP A 36 -3.102 -1.747 10.176 1.00 1.51 H new ATOM 0 HH2 TRP A 36 -5.122 -0.371 9.906 1.00 1.19 H new ATOM 137 N HIS A 37 2.902 -1.659 7.366 1.00 0.25 N ATOM 138 CA HIS A 37 4.138 -2.299 6.925 1.00 0.25 C ATOM 139 C HIS A 37 3.946 -2.968 5.572 1.00 0.24 C ATOM 140 O HIS A 37 3.263 -3.979 5.479 1.00 0.30 O ATOM 141 CB HIS A 37 4.568 -3.349 7.947 1.00 0.29 C ATOM 142 CG HIS A 37 5.166 -2.778 9.192 1.00 0.34 C ATOM 143 ND1 HIS A 37 4.624 -1.711 9.878 1.00 0.61 N ATOM 144 CD2 HIS A 37 6.272 -3.138 9.874 1.00 0.68 C ATOM 145 CE1 HIS A 37 5.381 -1.436 10.923 1.00 0.51 C ATOM 146 NE2 HIS A 37 6.385 -2.288 10.944 1.00 0.56 N ATOM 0 H HIS A 37 2.385 -2.188 8.069 1.00 0.25 H new ATOM 0 HA HIS A 37 4.907 -1.532 6.834 1.00 0.25 H new ATOM 0 HB2 HIS A 37 3.702 -3.954 8.217 1.00 0.29 H new ATOM 0 HB3 HIS A 37 5.292 -4.018 7.482 1.00 0.29 H new ATOM 0 HD2 HIS A 37 6.944 -3.946 9.624 1.00 0.68 H new ATOM 0 HE1 HIS A 37 5.207 -0.647 11.639 1.00 0.51 H new ATOM 0 HE2 HIS A 37 7.127 -2.312 11.643 1.00 0.56 H new ATOM 155 N ILE A 38 4.546 -2.418 4.528 1.00 0.20 N ATOM 156 CA ILE A 38 4.396 -2.995 3.199 1.00 0.20 C ATOM 157 C ILE A 38 5.162 -4.310 3.090 1.00 0.21 C ATOM 158 O ILE A 38 6.356 -4.385 3.390 1.00 0.27 O ATOM 159 CB ILE A 38 4.856 -2.029 2.092 1.00 0.20 C ATOM 160 CG1 ILE A 38 4.155 -0.684 2.244 1.00 0.21 C ATOM 161 CG2 ILE A 38 4.532 -2.610 0.730 1.00 0.21 C ATOM 162 CD1 ILE A 38 4.732 0.405 1.368 1.00 0.20 C ATOM 0 H ILE A 38 5.133 -1.585 4.571 1.00 0.20 H new ATOM 0 HA ILE A 38 3.332 -3.185 3.056 1.00 0.20 H new ATOM 0 HB ILE A 38 5.933 -1.887 2.180 1.00 0.20 H new ATOM 0 HG12 ILE A 38 3.098 -0.806 2.007 1.00 0.21 H new ATOM 0 HG13 ILE A 38 4.214 -0.369 3.286 1.00 0.21 H new ATOM 0 HG21 ILE A 38 4.861 -1.920 -0.047 1.00 0.21 H new ATOM 0 HG22 ILE A 38 5.046 -3.564 0.610 1.00 0.21 H new ATOM 0 HG23 ILE A 38 3.456 -2.764 0.647 1.00 0.21 H new ATOM 0 HD11 ILE A 38 4.182 1.332 1.531 1.00 0.20 H new ATOM 0 HD12 ILE A 38 5.782 0.556 1.620 1.00 0.20 H new ATOM 0 HD13 ILE A 38 4.648 0.113 0.321 1.00 0.20 H new ATOM 174 N VAL A 39 4.453 -5.342 2.675 1.00 0.19 N ATOM 175 CA VAL A 39 5.005 -6.681 2.561 1.00 0.18 C ATOM 176 C VAL A 39 5.047 -7.116 1.109 1.00 0.16 C ATOM 177 O VAL A 39 4.120 -6.850 0.366 1.00 0.18 O ATOM 178 CB VAL A 39 4.140 -7.682 3.344 1.00 0.20 C ATOM 179 CG1 VAL A 39 4.618 -9.114 3.168 1.00 0.23 C ATOM 180 CG2 VAL A 39 4.089 -7.306 4.800 1.00 0.26 C ATOM 0 H VAL A 39 3.471 -5.276 2.405 1.00 0.19 H new ATOM 0 HA VAL A 39 6.015 -6.663 2.969 1.00 0.18 H new ATOM 0 HB VAL A 39 3.131 -7.633 2.934 1.00 0.20 H new ATOM 0 HG11 VAL A 39 3.976 -9.785 3.740 1.00 0.23 H new ATOM 0 HG12 VAL A 39 4.577 -9.384 2.113 1.00 0.23 H new ATOM 0 HG13 VAL A 39 5.644 -9.202 3.525 1.00 0.23 H new ATOM 0 HG21 VAL A 39 3.473 -8.025 5.340 1.00 0.26 H new ATOM 0 HG22 VAL A 39 5.098 -7.311 5.213 1.00 0.26 H new ATOM 0 HG23 VAL A 39 3.659 -6.310 4.904 1.00 0.26 H new ATOM 190 N PRO A 40 6.121 -7.776 0.682 1.00 0.14 N ATOM 191 CA PRO A 40 6.201 -8.363 -0.639 1.00 0.14 C ATOM 192 C PRO A 40 5.694 -9.805 -0.649 1.00 0.16 C ATOM 193 O PRO A 40 6.175 -10.650 0.104 1.00 0.28 O ATOM 194 CB PRO A 40 7.694 -8.305 -0.953 1.00 0.17 C ATOM 195 CG PRO A 40 8.403 -8.077 0.353 1.00 0.15 C ATOM 196 CD PRO A 40 7.356 -7.992 1.433 1.00 0.14 C ATOM 0 HA PRO A 40 5.584 -7.841 -1.370 1.00 0.14 H new ATOM 0 HB2 PRO A 40 8.028 -9.233 -1.417 1.00 0.17 H new ATOM 0 HB3 PRO A 40 7.910 -7.501 -1.656 1.00 0.17 H new ATOM 0 HG2 PRO A 40 9.099 -8.891 0.558 1.00 0.15 H new ATOM 0 HG3 PRO A 40 8.989 -7.159 0.315 1.00 0.15 H new ATOM 0 HD2 PRO A 40 7.313 -8.906 2.025 1.00 0.14 H new ATOM 0 HD3 PRO A 40 7.556 -7.173 2.124 1.00 0.14 H new ATOM 204 N VAL A 41 4.707 -10.071 -1.490 1.00 0.14 N ATOM 205 CA VAL A 41 4.124 -11.403 -1.588 1.00 0.16 C ATOM 206 C VAL A 41 4.810 -12.209 -2.684 1.00 0.18 C ATOM 207 O VAL A 41 5.247 -13.338 -2.463 1.00 0.23 O ATOM 208 CB VAL A 41 2.612 -11.351 -1.894 1.00 0.17 C ATOM 209 CG1 VAL A 41 2.025 -12.753 -1.908 1.00 0.21 C ATOM 210 CG2 VAL A 41 1.870 -10.474 -0.897 1.00 0.20 C ATOM 0 H VAL A 41 4.291 -9.382 -2.116 1.00 0.14 H new ATOM 0 HA VAL A 41 4.271 -11.880 -0.619 1.00 0.16 H new ATOM 0 HB VAL A 41 2.489 -10.907 -2.882 1.00 0.17 H new ATOM 0 HG11 VAL A 41 0.958 -12.699 -2.125 1.00 0.21 H new ATOM 0 HG12 VAL A 41 2.522 -13.348 -2.675 1.00 0.21 H new ATOM 0 HG13 VAL A 41 2.174 -13.219 -0.934 1.00 0.21 H new ATOM 0 HG21 VAL A 41 0.808 -10.461 -1.144 1.00 0.20 H new ATOM 0 HG22 VAL A 41 2.004 -10.873 0.109 1.00 0.20 H new ATOM 0 HG23 VAL A 41 2.265 -9.459 -0.941 1.00 0.20 H new ATOM 220 N SER A 42 4.904 -11.617 -3.866 1.00 0.19 N ATOM 221 CA SER A 42 5.453 -12.307 -5.023 1.00 0.25 C ATOM 222 C SER A 42 6.976 -12.275 -4.987 1.00 0.24 C ATOM 223 O SER A 42 7.574 -11.524 -4.213 1.00 0.35 O ATOM 224 CB SER A 42 4.948 -11.668 -6.314 1.00 0.34 C ATOM 225 OG SER A 42 4.905 -12.606 -7.377 1.00 1.08 O ATOM 0 H SER A 42 4.606 -10.659 -4.049 1.00 0.19 H new ATOM 0 HA SER A 42 5.122 -13.345 -4.993 1.00 0.25 H new ATOM 0 HB2 SER A 42 3.952 -11.255 -6.151 1.00 0.34 H new ATOM 0 HB3 SER A 42 5.597 -10.836 -6.588 1.00 0.34 H new ATOM 0 HG SER A 42 4.018 -12.588 -7.793 1.00 1.08 H new ATOM 231 N LYS A 43 7.598 -13.061 -5.849 1.00 0.28 N ATOM 232 CA LYS A 43 9.045 -13.223 -5.821 1.00 0.31 C ATOM 233 C LYS A 43 9.752 -11.975 -6.336 1.00 0.26 C ATOM 234 O LYS A 43 10.820 -11.606 -5.844 1.00 0.32 O ATOM 235 CB LYS A 43 9.461 -14.437 -6.652 1.00 0.42 C ATOM 236 CG LYS A 43 8.597 -15.665 -6.425 1.00 1.02 C ATOM 237 CD LYS A 43 8.397 -15.942 -4.947 1.00 1.41 C ATOM 238 CE LYS A 43 7.619 -17.226 -4.720 1.00 2.09 C ATOM 239 NZ LYS A 43 7.492 -17.554 -3.275 1.00 2.95 N ATOM 0 H LYS A 43 7.126 -13.597 -6.577 1.00 0.28 H new ATOM 0 HA LYS A 43 9.342 -13.380 -4.784 1.00 0.31 H new ATOM 0 HB2 LYS A 43 9.426 -14.171 -7.708 1.00 0.42 H new ATOM 0 HB3 LYS A 43 10.497 -14.686 -6.420 1.00 0.42 H new ATOM 0 HG2 LYS A 43 7.628 -15.522 -6.903 1.00 1.02 H new ATOM 0 HG3 LYS A 43 9.062 -16.530 -6.898 1.00 1.02 H new ATOM 0 HD2 LYS A 43 9.367 -16.012 -4.455 1.00 1.41 H new ATOM 0 HD3 LYS A 43 7.866 -15.108 -4.488 1.00 1.41 H new ATOM 0 HE2 LYS A 43 6.626 -17.130 -5.158 1.00 2.09 H new ATOM 0 HE3 LYS A 43 8.117 -18.047 -5.236 1.00 2.09 H new ATOM 0 HZ1 LYS A 43 6.954 -18.437 -3.166 1.00 2.95 H new ATOM 0 HZ2 LYS A 43 8.439 -17.671 -2.861 1.00 2.95 H new ATOM 0 HZ3 LYS A 43 6.994 -16.783 -2.786 1.00 2.95 H new ATOM 253 N ASP A 44 9.133 -11.308 -7.304 1.00 0.23 N ATOM 254 CA ASP A 44 9.733 -10.136 -7.944 1.00 0.21 C ATOM 255 C ASP A 44 9.879 -8.985 -6.950 1.00 0.17 C ATOM 256 O ASP A 44 10.641 -8.050 -7.179 1.00 0.18 O ATOM 257 CB ASP A 44 8.877 -9.684 -9.132 1.00 0.25 C ATOM 258 CG ASP A 44 9.692 -9.092 -10.265 1.00 0.39 C ATOM 259 OD1 ASP A 44 10.689 -9.722 -10.671 1.00 0.44 O ATOM 260 OD2 ASP A 44 9.360 -7.984 -10.736 1.00 0.97 O ATOM 0 H ASP A 44 8.213 -11.558 -7.666 1.00 0.23 H new ATOM 0 HA ASP A 44 10.724 -10.417 -8.299 1.00 0.21 H new ATOM 0 HB2 ASP A 44 8.310 -10.536 -9.508 1.00 0.25 H new ATOM 0 HB3 ASP A 44 8.153 -8.945 -8.789 1.00 0.25 H new ATOM 265 N TYR A 45 9.146 -9.057 -5.841 1.00 0.15 N ATOM 266 CA TYR A 45 9.162 -7.987 -4.849 1.00 0.13 C ATOM 267 C TYR A 45 9.911 -8.396 -3.591 1.00 0.15 C ATOM 268 O TYR A 45 9.988 -7.629 -2.648 1.00 0.15 O ATOM 269 CB TYR A 45 7.735 -7.559 -4.478 1.00 0.12 C ATOM 270 CG TYR A 45 6.937 -7.035 -5.644 1.00 0.15 C ATOM 271 CD1 TYR A 45 6.448 -7.905 -6.609 1.00 0.23 C ATOM 272 CD2 TYR A 45 6.676 -5.677 -5.783 1.00 0.21 C ATOM 273 CE1 TYR A 45 5.722 -7.443 -7.686 1.00 0.29 C ATOM 274 CE2 TYR A 45 5.943 -5.206 -6.862 1.00 0.25 C ATOM 275 CZ TYR A 45 5.472 -6.097 -7.810 1.00 0.27 C ATOM 276 OH TYR A 45 4.746 -5.643 -8.890 1.00 0.35 O ATOM 0 H TYR A 45 8.537 -9.841 -5.608 1.00 0.15 H new ATOM 0 HA TYR A 45 9.684 -7.144 -5.303 1.00 0.13 H new ATOM 0 HB2 TYR A 45 7.211 -8.411 -4.044 1.00 0.12 H new ATOM 0 HB3 TYR A 45 7.785 -6.789 -3.708 1.00 0.12 H new ATOM 0 HD1 TYR A 45 6.640 -8.964 -6.514 1.00 0.23 H new ATOM 0 HD2 TYR A 45 7.047 -4.982 -5.044 1.00 0.21 H new ATOM 0 HE1 TYR A 45 5.352 -8.135 -8.428 1.00 0.29 H new ATOM 0 HE2 TYR A 45 5.741 -4.150 -6.962 1.00 0.25 H new ATOM 0 HH TYR A 45 3.837 -5.419 -8.602 1.00 0.35 H new ATOM 286 N PHE A 46 10.491 -9.585 -3.567 1.00 0.19 N ATOM 287 CA PHE A 46 11.190 -10.041 -2.363 1.00 0.23 C ATOM 288 C PHE A 46 12.362 -9.131 -1.996 1.00 0.22 C ATOM 289 O PHE A 46 12.907 -9.222 -0.896 1.00 0.26 O ATOM 290 CB PHE A 46 11.655 -11.492 -2.481 1.00 0.28 C ATOM 291 CG PHE A 46 10.680 -12.465 -1.879 1.00 0.36 C ATOM 292 CD1 PHE A 46 10.139 -12.251 -0.624 1.00 0.68 C ATOM 293 CD2 PHE A 46 10.304 -13.603 -2.580 1.00 0.68 C ATOM 294 CE1 PHE A 46 9.244 -13.153 -0.078 1.00 0.74 C ATOM 295 CE2 PHE A 46 9.410 -14.507 -2.040 1.00 0.76 C ATOM 296 CZ PHE A 46 8.873 -14.249 -0.746 1.00 0.57 C ATOM 0 H PHE A 46 10.496 -10.244 -4.346 1.00 0.19 H new ATOM 0 HA PHE A 46 10.461 -9.988 -1.554 1.00 0.23 H new ATOM 0 HB2 PHE A 46 11.804 -11.737 -3.533 1.00 0.28 H new ATOM 0 HB3 PHE A 46 12.621 -11.601 -1.988 1.00 0.28 H new ATOM 0 HD1 PHE A 46 10.418 -11.370 -0.065 1.00 0.68 H new ATOM 0 HD2 PHE A 46 10.716 -13.784 -3.562 1.00 0.68 H new ATOM 0 HE1 PHE A 46 8.838 -12.968 0.906 1.00 0.74 H new ATOM 0 HE2 PHE A 46 9.124 -15.392 -2.588 1.00 0.76 H new ATOM 0 HZ PHE A 46 8.167 -14.938 -0.306 1.00 0.57 H new ATOM 306 N SER A 47 12.738 -8.245 -2.909 1.00 0.19 N ATOM 307 CA SER A 47 13.825 -7.327 -2.676 1.00 0.23 C ATOM 308 C SER A 47 13.362 -6.065 -1.937 1.00 0.17 C ATOM 309 O SER A 47 14.194 -5.266 -1.533 1.00 0.20 O ATOM 310 CB SER A 47 14.458 -6.958 -4.015 1.00 0.31 C ATOM 311 OG SER A 47 13.464 -6.704 -4.998 1.00 1.19 O ATOM 0 H SER A 47 12.296 -8.149 -3.823 1.00 0.19 H new ATOM 0 HA SER A 47 14.560 -7.817 -2.037 1.00 0.23 H new ATOM 0 HB2 SER A 47 15.087 -6.076 -3.893 1.00 0.31 H new ATOM 0 HB3 SER A 47 15.106 -7.768 -4.350 1.00 0.31 H new ATOM 0 HG SER A 47 13.895 -6.468 -5.846 1.00 1.19 H new ATOM 317 N ILE A 48 12.042 -5.897 -1.752 1.00 0.17 N ATOM 318 CA ILE A 48 11.495 -4.688 -1.108 1.00 0.15 C ATOM 319 C ILE A 48 12.248 -4.384 0.200 1.00 0.17 C ATOM 320 O ILE A 48 12.486 -5.275 1.019 1.00 0.20 O ATOM 321 CB ILE A 48 9.968 -4.815 -0.834 1.00 0.17 C ATOM 322 CG1 ILE A 48 9.176 -5.024 -2.132 1.00 0.18 C ATOM 323 CG2 ILE A 48 9.449 -3.574 -0.138 1.00 0.18 C ATOM 324 CD1 ILE A 48 8.574 -3.764 -2.715 1.00 0.21 C ATOM 0 H ILE A 48 11.337 -6.577 -2.037 1.00 0.17 H new ATOM 0 HA ILE A 48 11.638 -3.859 -1.802 1.00 0.15 H new ATOM 0 HB ILE A 48 9.829 -5.686 -0.194 1.00 0.17 H new ATOM 0 HG12 ILE A 48 9.835 -5.473 -2.875 1.00 0.18 H new ATOM 0 HG13 ILE A 48 8.375 -5.739 -1.942 1.00 0.18 H new ATOM 0 HG21 ILE A 48 8.380 -3.680 0.046 1.00 0.18 H new ATOM 0 HG22 ILE A 48 9.969 -3.445 0.811 1.00 0.18 H new ATOM 0 HG23 ILE A 48 9.624 -2.703 -0.769 1.00 0.18 H new ATOM 0 HD11 ILE A 48 8.034 -4.008 -3.630 1.00 0.21 H new ATOM 0 HD12 ILE A 48 7.886 -3.322 -1.994 1.00 0.21 H new ATOM 0 HD13 ILE A 48 9.368 -3.053 -2.942 1.00 0.21 H new ATOM 336 N PRO A 49 12.643 -3.104 0.368 1.00 0.16 N ATOM 337 CA PRO A 49 13.623 -2.635 1.368 1.00 0.19 C ATOM 338 C PRO A 49 13.410 -2.990 2.832 1.00 0.15 C ATOM 339 O PRO A 49 12.475 -3.693 3.216 1.00 0.21 O ATOM 340 CB PRO A 49 13.581 -1.112 1.251 1.00 0.26 C ATOM 341 CG PRO A 49 12.394 -0.811 0.437 1.00 0.17 C ATOM 342 CD PRO A 49 12.194 -1.984 -0.463 1.00 0.16 C ATOM 0 HA PRO A 49 14.561 -3.138 1.133 1.00 0.19 H new ATOM 0 HB2 PRO A 49 13.511 -0.645 2.233 1.00 0.26 H new ATOM 0 HB3 PRO A 49 14.487 -0.730 0.780 1.00 0.26 H new ATOM 0 HG2 PRO A 49 11.520 -0.652 1.068 1.00 0.17 H new ATOM 0 HG3 PRO A 49 12.540 0.102 -0.141 1.00 0.17 H new ATOM 0 HD2 PRO A 49 11.151 -2.093 -0.761 1.00 0.16 H new ATOM 0 HD3 PRO A 49 12.780 -1.898 -1.378 1.00 0.16 H new ATOM 350 N ASN A 50 14.326 -2.443 3.629 1.00 0.17 N ATOM 351 CA ASN A 50 14.376 -2.603 5.074 1.00 0.22 C ATOM 352 C ASN A 50 13.000 -2.470 5.713 1.00 0.22 C ATOM 353 O ASN A 50 12.536 -3.379 6.405 1.00 0.34 O ATOM 354 CB ASN A 50 15.332 -1.542 5.645 1.00 0.35 C ATOM 355 CG ASN A 50 15.443 -1.571 7.157 1.00 0.58 C ATOM 356 OD1 ASN A 50 14.729 -0.848 7.855 1.00 1.23 O ATOM 357 ND2 ASN A 50 16.343 -2.395 7.673 1.00 0.83 N ATOM 0 H ASN A 50 15.079 -1.856 3.270 1.00 0.17 H new ATOM 0 HA ASN A 50 14.734 -3.607 5.303 1.00 0.22 H new ATOM 0 HB2 ASN A 50 16.322 -1.689 5.214 1.00 0.35 H new ATOM 0 HB3 ASN A 50 14.992 -0.554 5.334 1.00 0.35 H new ATOM 0 HD21 ASN A 50 16.465 -2.448 8.684 1.00 0.83 H new ATOM 0 HD22 ASN A 50 16.914 -2.976 7.059 1.00 0.83 H new ATOM 364 N ASP A 51 12.330 -1.358 5.442 1.00 0.24 N ATOM 365 CA ASP A 51 11.083 -1.045 6.131 1.00 0.34 C ATOM 366 C ASP A 51 10.417 0.165 5.508 1.00 0.27 C ATOM 367 O ASP A 51 10.878 1.294 5.675 1.00 0.36 O ATOM 368 CB ASP A 51 11.348 -0.788 7.619 1.00 0.51 C ATOM 369 CG ASP A 51 10.081 -0.533 8.412 1.00 1.20 C ATOM 370 OD1 ASP A 51 9.129 -1.331 8.289 1.00 1.90 O ATOM 371 OD2 ASP A 51 10.012 0.492 9.121 1.00 1.23 O ATOM 0 H ASP A 51 12.625 -0.662 4.757 1.00 0.24 H new ATOM 0 HA ASP A 51 10.414 -1.900 6.032 1.00 0.34 H new ATOM 0 HB2 ASP A 51 11.869 -1.647 8.043 1.00 0.51 H new ATOM 0 HB3 ASP A 51 12.013 0.070 7.721 1.00 0.51 H new ATOM 376 N LEU A 52 9.360 -0.080 4.758 1.00 0.22 N ATOM 377 CA LEU A 52 8.568 0.993 4.180 1.00 0.17 C ATOM 378 C LEU A 52 7.267 1.143 4.942 1.00 0.19 C ATOM 379 O LEU A 52 6.557 0.163 5.180 1.00 0.25 O ATOM 380 CB LEU A 52 8.254 0.719 2.710 1.00 0.18 C ATOM 381 CG LEU A 52 9.461 0.604 1.790 1.00 0.14 C ATOM 382 CD1 LEU A 52 9.018 0.205 0.391 1.00 0.17 C ATOM 383 CD2 LEU A 52 10.247 1.907 1.754 1.00 0.15 C ATOM 0 H LEU A 52 9.027 -1.017 4.533 1.00 0.22 H new ATOM 0 HA LEU A 52 9.151 1.912 4.249 1.00 0.17 H new ATOM 0 HB2 LEU A 52 7.681 -0.206 2.646 1.00 0.18 H new ATOM 0 HB3 LEU A 52 7.612 1.518 2.339 1.00 0.18 H new ATOM 0 HG LEU A 52 10.119 -0.171 2.183 1.00 0.14 H new ATOM 0 HD11 LEU A 52 9.890 0.126 -0.258 1.00 0.17 H new ATOM 0 HD12 LEU A 52 8.507 -0.757 0.432 1.00 0.17 H new ATOM 0 HD13 LEU A 52 8.339 0.960 -0.005 1.00 0.17 H new ATOM 0 HD21 LEU A 52 11.104 1.797 1.089 1.00 0.15 H new ATOM 0 HD22 LEU A 52 9.605 2.709 1.389 1.00 0.15 H new ATOM 0 HD23 LEU A 52 10.595 2.150 2.758 1.00 0.15 H new ATOM 395 N LEU A 53 6.955 2.367 5.316 1.00 0.16 N ATOM 396 CA LEU A 53 5.720 2.640 6.027 1.00 0.18 C ATOM 397 C LEU A 53 4.710 3.310 5.106 1.00 0.17 C ATOM 398 O LEU A 53 4.924 4.421 4.617 1.00 0.17 O ATOM 399 CB LEU A 53 5.979 3.521 7.254 1.00 0.21 C ATOM 400 CG LEU A 53 6.890 2.910 8.321 1.00 0.26 C ATOM 401 CD1 LEU A 53 7.068 3.878 9.479 1.00 0.32 C ATOM 402 CD2 LEU A 53 6.323 1.588 8.816 1.00 0.30 C ATOM 0 H LEU A 53 7.536 3.187 5.141 1.00 0.16 H new ATOM 0 HA LEU A 53 5.310 1.689 6.366 1.00 0.18 H new ATOM 0 HB2 LEU A 53 6.419 4.460 6.919 1.00 0.21 H new ATOM 0 HB3 LEU A 53 5.021 3.764 7.714 1.00 0.21 H new ATOM 0 HG LEU A 53 7.865 2.718 7.874 1.00 0.26 H new ATOM 0 HD11 LEU A 53 7.718 3.430 10.231 1.00 0.32 H new ATOM 0 HD12 LEU A 53 7.517 4.802 9.115 1.00 0.32 H new ATOM 0 HD13 LEU A 53 6.097 4.097 9.923 1.00 0.32 H new ATOM 0 HD21 LEU A 53 6.985 1.169 9.574 1.00 0.30 H new ATOM 0 HD22 LEU A 53 5.336 1.754 9.248 1.00 0.30 H new ATOM 0 HD23 LEU A 53 6.241 0.892 7.981 1.00 0.30 H new ATOM 414 N TRP A 54 3.611 2.626 4.878 1.00 0.18 N ATOM 415 CA TRP A 54 2.533 3.147 4.066 1.00 0.20 C ATOM 416 C TRP A 54 1.434 3.669 4.973 1.00 0.23 C ATOM 417 O TRP A 54 1.018 2.987 5.897 1.00 0.28 O ATOM 418 CB TRP A 54 1.984 2.036 3.160 1.00 0.22 C ATOM 419 CG TRP A 54 0.918 2.479 2.199 1.00 0.24 C ATOM 420 CD1 TRP A 54 -0.246 3.132 2.494 1.00 0.35 C ATOM 421 CD2 TRP A 54 0.902 2.263 0.785 1.00 0.24 C ATOM 422 NE1 TRP A 54 -0.960 3.365 1.351 1.00 0.35 N ATOM 423 CE2 TRP A 54 -0.285 2.831 0.291 1.00 0.26 C ATOM 424 CE3 TRP A 54 1.780 1.651 -0.113 1.00 0.34 C ATOM 425 CZ2 TRP A 54 -0.617 2.805 -1.056 1.00 0.27 C ATOM 426 CZ3 TRP A 54 1.443 1.624 -1.453 1.00 0.41 C ATOM 427 CH2 TRP A 54 0.252 2.199 -1.909 1.00 0.35 C ATOM 0 H TRP A 54 3.439 1.692 5.250 1.00 0.18 H new ATOM 0 HA TRP A 54 2.903 3.960 3.441 1.00 0.20 H new ATOM 0 HB2 TRP A 54 2.810 1.607 2.593 1.00 0.22 H new ATOM 0 HB3 TRP A 54 1.581 1.241 3.787 1.00 0.22 H new ATOM 0 HD1 TRP A 54 -0.557 3.422 3.487 1.00 0.35 H new ATOM 0 HE1 TRP A 54 -1.852 3.858 1.299 1.00 0.35 H new ATOM 0 HE3 TRP A 54 2.703 1.208 0.233 1.00 0.34 H new ATOM 0 HZ2 TRP A 54 -1.533 3.250 -1.415 1.00 0.27 H new ATOM 0 HZ3 TRP A 54 2.110 1.152 -2.159 1.00 0.41 H new ATOM 0 HH2 TRP A 54 0.017 2.161 -2.962 1.00 0.35 H new ATOM 438 N SER A 55 0.978 4.875 4.728 1.00 0.26 N ATOM 439 CA SER A 55 -0.160 5.393 5.444 1.00 0.33 C ATOM 440 C SER A 55 -1.072 6.127 4.483 1.00 0.25 C ATOM 441 O SER A 55 -0.679 7.129 3.884 1.00 0.22 O ATOM 442 CB SER A 55 0.296 6.317 6.578 1.00 0.44 C ATOM 443 OG SER A 55 1.180 7.322 6.102 1.00 1.11 O ATOM 0 H SER A 55 1.377 5.513 4.040 1.00 0.26 H new ATOM 0 HA SER A 55 -0.712 4.565 5.889 1.00 0.33 H new ATOM 0 HB2 SER A 55 -0.573 6.784 7.041 1.00 0.44 H new ATOM 0 HB3 SER A 55 0.792 5.730 7.351 1.00 0.44 H new ATOM 0 HG SER A 55 1.401 7.146 5.164 1.00 1.11 H new ATOM 449 N PHE A 56 -2.271 5.609 4.285 1.00 0.30 N ATOM 450 CA PHE A 56 -3.246 6.341 3.510 1.00 0.28 C ATOM 451 C PHE A 56 -3.713 7.499 4.363 1.00 0.27 C ATOM 452 O PHE A 56 -4.279 7.279 5.432 1.00 0.39 O ATOM 453 CB PHE A 56 -4.472 5.483 3.174 1.00 0.40 C ATOM 454 CG PHE A 56 -4.192 4.128 2.591 1.00 0.30 C ATOM 455 CD1 PHE A 56 -3.823 3.074 3.405 1.00 0.29 C ATOM 456 CD2 PHE A 56 -4.262 3.921 1.225 1.00 0.34 C ATOM 457 CE1 PHE A 56 -3.529 1.837 2.865 1.00 0.30 C ATOM 458 CE2 PHE A 56 -3.975 2.683 0.681 1.00 0.34 C ATOM 459 CZ PHE A 56 -3.741 1.605 1.523 1.00 0.27 C ATOM 0 H PHE A 56 -2.584 4.706 4.642 1.00 0.30 H new ATOM 0 HA PHE A 56 -2.786 6.660 2.575 1.00 0.28 H new ATOM 0 HB2 PHE A 56 -5.057 5.350 4.084 1.00 0.40 H new ATOM 0 HB3 PHE A 56 -5.095 6.036 2.472 1.00 0.40 H new ATOM 0 HD1 PHE A 56 -3.764 3.219 4.474 1.00 0.29 H new ATOM 0 HD2 PHE A 56 -4.544 4.737 0.576 1.00 0.34 H new ATOM 0 HE1 PHE A 56 -3.134 1.053 3.493 1.00 0.30 H new ATOM 0 HE2 PHE A 56 -3.933 2.556 -0.391 1.00 0.34 H new ATOM 0 HZ PHE A 56 -3.725 0.598 1.132 1.00 0.27 H new ATOM 469 N ASN A 57 -3.505 8.718 3.917 1.00 0.24 N ATOM 470 CA ASN A 57 -4.022 9.844 4.659 1.00 0.31 C ATOM 471 C ASN A 57 -5.372 10.208 4.088 1.00 0.33 C ATOM 472 O ASN A 57 -5.485 10.962 3.131 1.00 0.41 O ATOM 473 CB ASN A 57 -3.062 11.038 4.624 1.00 0.45 C ATOM 474 CG ASN A 57 -3.476 12.137 5.587 1.00 1.09 C ATOM 475 OD1 ASN A 57 -4.665 12.391 5.795 1.00 2.12 O ATOM 476 ND2 ASN A 57 -2.496 12.791 6.190 1.00 1.16 N ATOM 0 H ASN A 57 -2.994 8.951 3.065 1.00 0.24 H new ATOM 0 HA ASN A 57 -4.126 9.568 5.708 1.00 0.31 H new ATOM 0 HB2 ASN A 57 -2.056 10.700 4.872 1.00 0.45 H new ATOM 0 HB3 ASN A 57 -3.022 11.440 3.612 1.00 0.45 H new ATOM 0 HD21 ASN A 57 -2.712 13.535 6.854 1.00 1.16 H new ATOM 0 HD22 ASN A 57 -1.525 12.551 5.991 1.00 1.16 H new ATOM 483 N THR A 58 -6.390 9.673 4.717 1.00 0.34 N ATOM 484 CA THR A 58 -7.757 9.834 4.278 1.00 0.40 C ATOM 485 C THR A 58 -8.394 11.028 4.968 1.00 0.48 C ATOM 486 O THR A 58 -9.606 11.228 4.925 1.00 0.61 O ATOM 487 CB THR A 58 -8.526 8.550 4.616 1.00 0.40 C ATOM 488 OG1 THR A 58 -8.161 8.106 5.932 1.00 0.43 O ATOM 489 CG2 THR A 58 -8.229 7.455 3.599 1.00 0.48 C ATOM 0 H THR A 58 -6.292 9.106 5.559 1.00 0.34 H new ATOM 0 HA THR A 58 -7.785 10.012 3.203 1.00 0.40 H new ATOM 0 HB THR A 58 -9.594 8.765 4.584 1.00 0.40 H new ATOM 0 HG1 THR A 58 -8.653 7.287 6.149 1.00 0.43 H new ATOM 0 HG21 THR A 58 -8.786 6.555 3.860 1.00 0.48 H new ATOM 0 HG22 THR A 58 -8.527 7.790 2.606 1.00 0.48 H new ATOM 0 HG23 THR A 58 -7.161 7.235 3.603 1.00 0.48 H new ATOM 497 N THR A 59 -7.543 11.815 5.604 1.00 0.50 N ATOM 498 CA THR A 59 -7.957 12.956 6.368 1.00 0.63 C ATOM 499 C THR A 59 -7.841 14.234 5.531 1.00 0.67 C ATOM 500 O THR A 59 -8.691 15.121 5.616 1.00 0.77 O ATOM 501 CB THR A 59 -7.087 13.015 7.620 1.00 0.74 C ATOM 502 OG1 THR A 59 -7.119 11.729 8.247 1.00 0.86 O ATOM 503 CG2 THR A 59 -7.566 14.080 8.575 1.00 0.90 C ATOM 0 H THR A 59 -6.534 11.669 5.598 1.00 0.50 H new ATOM 0 HA THR A 59 -9.004 12.869 6.658 1.00 0.63 H new ATOM 0 HB THR A 59 -6.066 13.274 7.339 1.00 0.74 H new ATOM 0 HG1 THR A 59 -6.211 11.469 8.507 1.00 0.86 H new ATOM 0 HG21 THR A 59 -6.924 14.095 9.456 1.00 0.90 H new ATOM 0 HG22 THR A 59 -7.530 15.052 8.084 1.00 0.90 H new ATOM 0 HG23 THR A 59 -8.591 13.864 8.877 1.00 0.90 H new ATOM 511 N ASN A 60 -6.788 14.321 4.721 1.00 0.65 N ATOM 512 CA ASN A 60 -6.713 15.354 3.689 1.00 0.74 C ATOM 513 C ASN A 60 -6.665 14.698 2.314 1.00 0.72 C ATOM 514 O ASN A 60 -6.471 15.354 1.292 1.00 0.84 O ATOM 515 CB ASN A 60 -5.516 16.299 3.886 1.00 0.86 C ATOM 516 CG ASN A 60 -4.173 15.601 3.799 1.00 1.17 C ATOM 517 OD1 ASN A 60 -3.611 15.435 2.718 1.00 1.99 O ATOM 518 ND2 ASN A 60 -3.635 15.221 4.941 1.00 1.69 N ATOM 0 H ASN A 60 -5.983 13.696 4.758 1.00 0.65 H new ATOM 0 HA ASN A 60 -7.608 15.970 3.769 1.00 0.74 H new ATOM 0 HB2 ASN A 60 -5.557 17.086 3.133 1.00 0.86 H new ATOM 0 HB3 ASN A 60 -5.602 16.784 4.858 1.00 0.86 H new ATOM 0 HD21 ASN A 60 -2.720 14.771 4.949 1.00 1.69 H new ATOM 0 HD22 ASN A 60 -4.134 15.377 5.817 1.00 1.69 H new ATOM 525 N LYS A 61 -6.841 13.377 2.336 1.00 0.64 N ATOM 526 CA LYS A 61 -7.030 12.558 1.142 1.00 0.66 C ATOM 527 C LYS A 61 -5.801 12.527 0.230 1.00 0.65 C ATOM 528 O LYS A 61 -5.833 12.999 -0.909 1.00 0.94 O ATOM 529 CB LYS A 61 -8.267 13.004 0.394 1.00 0.84 C ATOM 530 CG LYS A 61 -9.499 13.000 1.277 1.00 0.96 C ATOM 531 CD LYS A 61 -10.570 13.885 0.710 1.00 0.99 C ATOM 532 CE LYS A 61 -11.299 13.238 -0.457 1.00 1.06 C ATOM 533 NZ LYS A 61 -12.106 12.064 -0.030 1.00 1.65 N ATOM 0 H LYS A 61 -6.856 12.837 3.201 1.00 0.64 H new ATOM 0 HA LYS A 61 -7.171 11.530 1.477 1.00 0.66 H new ATOM 0 HB2 LYS A 61 -8.109 14.007 -0.002 1.00 0.84 H new ATOM 0 HB3 LYS A 61 -8.431 12.346 -0.460 1.00 0.84 H new ATOM 0 HG2 LYS A 61 -9.877 11.982 1.375 1.00 0.96 H new ATOM 0 HG3 LYS A 61 -9.234 13.339 2.278 1.00 0.96 H new ATOM 0 HD2 LYS A 61 -11.288 14.129 1.493 1.00 0.99 H new ATOM 0 HD3 LYS A 61 -10.125 14.824 0.381 1.00 0.99 H new ATOM 0 HE2 LYS A 61 -11.951 13.973 -0.929 1.00 1.06 H new ATOM 0 HE3 LYS A 61 -10.574 12.925 -1.208 1.00 1.06 H new ATOM 0 HZ1 LYS A 61 -12.810 11.841 -0.763 1.00 1.65 H new ATOM 0 HZ2 LYS A 61 -11.480 11.245 0.110 1.00 1.65 H new ATOM 0 HZ3 LYS A 61 -12.593 12.284 0.862 1.00 1.65 H new ATOM 547 N SER A 62 -4.728 11.944 0.740 1.00 0.41 N ATOM 548 CA SER A 62 -3.502 11.739 -0.018 1.00 0.38 C ATOM 549 C SER A 62 -2.778 10.503 0.507 1.00 0.35 C ATOM 550 O SER A 62 -2.886 10.161 1.679 1.00 0.50 O ATOM 551 CB SER A 62 -2.594 12.967 0.080 1.00 0.47 C ATOM 552 OG SER A 62 -2.445 13.400 1.423 1.00 1.28 O ATOM 0 H SER A 62 -4.682 11.597 1.698 1.00 0.41 H new ATOM 0 HA SER A 62 -3.757 11.589 -1.067 1.00 0.38 H new ATOM 0 HB2 SER A 62 -1.615 12.731 -0.338 1.00 0.47 H new ATOM 0 HB3 SER A 62 -3.010 13.777 -0.520 1.00 0.47 H new ATOM 0 HG SER A 62 -2.980 14.209 1.567 1.00 1.28 H new ATOM 558 N ILE A 63 -2.071 9.820 -0.366 1.00 0.36 N ATOM 559 CA ILE A 63 -1.284 8.661 0.035 1.00 0.33 C ATOM 560 C ILE A 63 0.043 9.142 0.598 1.00 0.35 C ATOM 561 O ILE A 63 0.656 10.039 0.033 1.00 0.54 O ATOM 562 CB ILE A 63 -0.981 7.722 -1.153 1.00 0.34 C ATOM 563 CG1 ILE A 63 -2.248 7.397 -1.953 1.00 0.37 C ATOM 564 CG2 ILE A 63 -0.326 6.438 -0.657 1.00 0.39 C ATOM 565 CD1 ILE A 63 -3.177 6.440 -1.245 1.00 1.11 C ATOM 0 H ILE A 63 -2.021 10.042 -1.360 1.00 0.36 H new ATOM 0 HA ILE A 63 -1.864 8.109 0.774 1.00 0.33 H new ATOM 0 HB ILE A 63 -0.292 8.241 -1.819 1.00 0.34 H new ATOM 0 HG12 ILE A 63 -2.784 8.323 -2.163 1.00 0.37 H new ATOM 0 HG13 ILE A 63 -1.962 6.970 -2.914 1.00 0.37 H new ATOM 0 HG21 ILE A 63 -0.118 5.785 -1.504 1.00 0.39 H new ATOM 0 HG22 ILE A 63 0.607 6.679 -0.147 1.00 0.39 H new ATOM 0 HG23 ILE A 63 -0.998 5.931 0.035 1.00 0.39 H new ATOM 0 HD11 ILE A 63 -4.052 6.255 -1.868 1.00 1.11 H new ATOM 0 HD12 ILE A 63 -2.658 5.500 -1.059 1.00 1.11 H new ATOM 0 HD13 ILE A 63 -3.492 6.874 -0.296 1.00 1.11 H new ATOM 577 N ASN A 64 0.476 8.580 1.711 1.00 0.25 N ATOM 578 CA ASN A 64 1.776 8.918 2.274 1.00 0.25 C ATOM 579 C ASN A 64 2.589 7.660 2.520 1.00 0.21 C ATOM 580 O ASN A 64 2.319 6.906 3.456 1.00 0.24 O ATOM 581 CB ASN A 64 1.631 9.695 3.581 1.00 0.34 C ATOM 582 CG ASN A 64 1.541 11.202 3.392 1.00 0.57 C ATOM 583 OD1 ASN A 64 1.921 11.970 4.278 1.00 1.22 O ATOM 584 ND2 ASN A 64 1.063 11.643 2.239 1.00 0.53 N ATOM 0 H ASN A 64 -0.050 7.888 2.245 1.00 0.25 H new ATOM 0 HA ASN A 64 2.293 9.550 1.552 1.00 0.25 H new ATOM 0 HB2 ASN A 64 0.738 9.349 4.101 1.00 0.34 H new ATOM 0 HB3 ASN A 64 2.482 9.469 4.224 1.00 0.34 H new ATOM 0 HD21 ASN A 64 1.001 12.646 2.063 1.00 0.53 H new ATOM 0 HD22 ASN A 64 0.757 10.980 1.527 1.00 0.53 H new ATOM 591 N VAL A 65 3.568 7.426 1.667 1.00 0.20 N ATOM 592 CA VAL A 65 4.450 6.282 1.817 1.00 0.18 C ATOM 593 C VAL A 65 5.846 6.768 2.161 1.00 0.20 C ATOM 594 O VAL A 65 6.472 7.477 1.375 1.00 0.25 O ATOM 595 CB VAL A 65 4.519 5.433 0.532 1.00 0.18 C ATOM 596 CG1 VAL A 65 5.292 4.148 0.777 1.00 0.18 C ATOM 597 CG2 VAL A 65 3.131 5.130 -0.003 1.00 0.19 C ATOM 0 H VAL A 65 3.774 8.015 0.860 1.00 0.20 H new ATOM 0 HA VAL A 65 4.049 5.656 2.614 1.00 0.18 H new ATOM 0 HB VAL A 65 5.048 6.014 -0.223 1.00 0.18 H new ATOM 0 HG11 VAL A 65 5.328 3.564 -0.143 1.00 0.18 H new ATOM 0 HG12 VAL A 65 6.307 4.389 1.094 1.00 0.18 H new ATOM 0 HG13 VAL A 65 4.796 3.568 1.555 1.00 0.18 H new ATOM 0 HG21 VAL A 65 3.213 4.530 -0.909 1.00 0.19 H new ATOM 0 HG22 VAL A 65 2.564 4.578 0.747 1.00 0.19 H new ATOM 0 HG23 VAL A 65 2.617 6.064 -0.232 1.00 0.19 H new ATOM 607 N TYR A 66 6.328 6.401 3.333 1.00 0.19 N ATOM 608 CA TYR A 66 7.610 6.894 3.801 1.00 0.21 C ATOM 609 C TYR A 66 8.380 5.837 4.578 1.00 0.21 C ATOM 610 O TYR A 66 7.820 4.872 5.079 1.00 0.24 O ATOM 611 CB TYR A 66 7.421 8.148 4.661 1.00 0.27 C ATOM 612 CG TYR A 66 6.400 7.997 5.768 1.00 0.31 C ATOM 613 CD1 TYR A 66 6.769 7.549 7.031 1.00 0.40 C ATOM 614 CD2 TYR A 66 5.064 8.308 5.548 1.00 0.33 C ATOM 615 CE1 TYR A 66 5.835 7.412 8.042 1.00 0.50 C ATOM 616 CE2 TYR A 66 4.126 8.176 6.553 1.00 0.43 C ATOM 617 CZ TYR A 66 4.515 7.728 7.796 1.00 0.51 C ATOM 618 OH TYR A 66 3.580 7.597 8.797 1.00 0.63 O ATOM 0 H TYR A 66 5.854 5.766 3.976 1.00 0.19 H new ATOM 0 HA TYR A 66 8.199 7.148 2.920 1.00 0.21 H new ATOM 0 HB2 TYR A 66 8.380 8.420 5.102 1.00 0.27 H new ATOM 0 HB3 TYR A 66 7.121 8.974 4.017 1.00 0.27 H new ATOM 0 HD1 TYR A 66 7.802 7.304 7.226 1.00 0.40 H new ATOM 0 HD2 TYR A 66 4.754 8.659 4.575 1.00 0.33 H new ATOM 0 HE1 TYR A 66 6.137 7.060 9.017 1.00 0.50 H new ATOM 0 HE2 TYR A 66 3.092 8.423 6.365 1.00 0.43 H new ATOM 0 HH TYR A 66 2.699 7.862 8.459 1.00 0.63 H new ATOM 628 N SER A 67 9.676 6.038 4.640 1.00 0.21 N ATOM 629 CA SER A 67 10.575 5.200 5.402 1.00 0.24 C ATOM 630 C SER A 67 11.721 6.062 5.900 1.00 0.28 C ATOM 631 O SER A 67 11.653 7.290 5.816 1.00 0.30 O ATOM 632 CB SER A 67 11.116 4.047 4.553 1.00 0.26 C ATOM 633 OG SER A 67 12.093 4.493 3.623 1.00 0.29 O ATOM 0 H SER A 67 10.144 6.802 4.154 1.00 0.21 H new ATOM 0 HA SER A 67 10.034 4.762 6.240 1.00 0.24 H new ATOM 0 HB2 SER A 67 11.552 3.289 5.204 1.00 0.26 H new ATOM 0 HB3 SER A 67 10.294 3.572 4.018 1.00 0.26 H new ATOM 0 HG SER A 67 12.418 3.731 3.099 1.00 0.29 H new ATOM 639 N LYS A 68 12.751 5.425 6.434 1.00 0.33 N ATOM 640 CA LYS A 68 13.954 6.121 6.868 1.00 0.38 C ATOM 641 C LYS A 68 14.462 7.082 5.789 1.00 0.36 C ATOM 642 O LYS A 68 14.934 8.181 6.084 1.00 0.42 O ATOM 643 CB LYS A 68 15.065 5.122 7.185 1.00 0.47 C ATOM 644 CG LYS A 68 14.838 4.254 8.417 1.00 0.63 C ATOM 645 CD LYS A 68 13.777 3.176 8.224 1.00 1.00 C ATOM 646 CE LYS A 68 13.733 2.217 9.409 1.00 1.58 C ATOM 647 NZ LYS A 68 14.985 1.419 9.550 1.00 2.03 N ATOM 0 H LYS A 68 12.778 4.416 6.579 1.00 0.33 H new ATOM 0 HA LYS A 68 13.692 6.688 7.761 1.00 0.38 H new ATOM 0 HB2 LYS A 68 15.199 4.469 6.322 1.00 0.47 H new ATOM 0 HB3 LYS A 68 15.997 5.672 7.317 1.00 0.47 H new ATOM 0 HG2 LYS A 68 15.779 3.779 8.693 1.00 0.63 H new ATOM 0 HG3 LYS A 68 14.546 4.892 9.251 1.00 0.63 H new ATOM 0 HD2 LYS A 68 12.801 3.644 8.096 1.00 1.00 H new ATOM 0 HD3 LYS A 68 13.985 2.618 7.311 1.00 1.00 H new ATOM 0 HE2 LYS A 68 13.564 2.784 10.324 1.00 1.58 H new ATOM 0 HE3 LYS A 68 12.887 1.540 9.292 1.00 1.58 H new ATOM 0 HZ1 LYS A 68 15.106 1.135 10.543 1.00 2.03 H new ATOM 0 HZ2 LYS A 68 14.925 0.570 8.952 1.00 2.03 H new ATOM 0 HZ3 LYS A 68 15.799 1.995 9.253 1.00 2.03 H new ATOM 661 N CYS A 69 14.351 6.655 4.541 1.00 0.36 N ATOM 662 CA CYS A 69 14.959 7.382 3.426 1.00 0.37 C ATOM 663 C CYS A 69 13.959 7.826 2.345 1.00 0.41 C ATOM 664 O CYS A 69 14.223 8.795 1.632 1.00 0.74 O ATOM 665 CB CYS A 69 16.030 6.508 2.803 1.00 0.38 C ATOM 666 SG CYS A 69 17.327 5.985 3.971 1.00 0.38 S ATOM 0 H CYS A 69 13.847 5.810 4.270 1.00 0.36 H new ATOM 0 HA CYS A 69 15.379 8.300 3.837 1.00 0.37 H new ATOM 0 HB2 CYS A 69 15.560 5.622 2.377 1.00 0.38 H new ATOM 0 HB3 CYS A 69 16.494 7.050 1.979 1.00 0.38 H new ATOM 671 N ILE A 70 12.838 7.128 2.197 1.00 0.25 N ATOM 672 CA ILE A 70 11.860 7.484 1.163 1.00 0.22 C ATOM 673 C ILE A 70 10.682 8.217 1.793 1.00 0.23 C ATOM 674 O ILE A 70 10.398 8.040 2.977 1.00 0.27 O ATOM 675 CB ILE A 70 11.363 6.246 0.383 1.00 0.20 C ATOM 676 CG1 ILE A 70 10.583 6.653 -0.864 1.00 0.20 C ATOM 677 CG2 ILE A 70 10.500 5.350 1.255 1.00 0.22 C ATOM 678 CD1 ILE A 70 10.424 5.521 -1.839 1.00 0.23 C ATOM 0 H ILE A 70 12.582 6.323 2.769 1.00 0.25 H new ATOM 0 HA ILE A 70 12.358 8.139 0.449 1.00 0.22 H new ATOM 0 HB ILE A 70 12.248 5.688 0.077 1.00 0.20 H new ATOM 0 HG12 ILE A 70 9.598 7.016 -0.570 1.00 0.20 H new ATOM 0 HG13 ILE A 70 11.095 7.481 -1.354 1.00 0.20 H new ATOM 0 HG21 ILE A 70 10.167 4.489 0.675 1.00 0.22 H new ATOM 0 HG22 ILE A 70 11.080 5.008 2.112 1.00 0.22 H new ATOM 0 HG23 ILE A 70 9.632 5.909 1.604 1.00 0.22 H new ATOM 0 HD11 ILE A 70 9.862 5.865 -2.707 1.00 0.23 H new ATOM 0 HD12 ILE A 70 11.407 5.174 -2.157 1.00 0.23 H new ATOM 0 HD13 ILE A 70 9.887 4.702 -1.361 1.00 0.23 H new ATOM 690 N SER A 71 10.018 9.044 1.009 1.00 0.24 N ATOM 691 CA SER A 71 8.873 9.802 1.485 1.00 0.28 C ATOM 692 C SER A 71 8.111 10.361 0.296 1.00 0.29 C ATOM 693 O SER A 71 8.592 11.265 -0.389 1.00 0.39 O ATOM 694 CB SER A 71 9.326 10.937 2.410 1.00 0.42 C ATOM 695 OG SER A 71 8.217 11.634 2.954 1.00 1.12 O ATOM 0 H SER A 71 10.253 9.210 0.031 1.00 0.24 H new ATOM 0 HA SER A 71 8.219 9.142 2.055 1.00 0.28 H new ATOM 0 HB2 SER A 71 9.934 10.530 3.218 1.00 0.42 H new ATOM 0 HB3 SER A 71 9.957 11.631 1.855 1.00 0.42 H new ATOM 0 HG SER A 71 8.537 12.351 3.541 1.00 1.12 H new ATOM 701 N GLY A 72 6.942 9.809 0.027 1.00 0.30 N ATOM 702 CA GLY A 72 6.187 10.240 -1.122 1.00 0.42 C ATOM 703 C GLY A 72 4.708 10.317 -0.872 1.00 0.31 C ATOM 704 O GLY A 72 4.135 9.491 -0.159 1.00 0.40 O ATOM 0 H GLY A 72 6.505 9.073 0.582 1.00 0.30 H new ATOM 0 HA2 GLY A 72 6.546 11.220 -1.436 1.00 0.42 H new ATOM 0 HA3 GLY A 72 6.373 9.553 -1.948 1.00 0.42 H new ATOM 708 N LYS A 73 4.099 11.319 -1.470 1.00 0.24 N ATOM 709 CA LYS A 73 2.674 11.511 -1.407 1.00 0.23 C ATOM 710 C LYS A 73 2.035 11.002 -2.687 1.00 0.21 C ATOM 711 O LYS A 73 2.729 10.763 -3.668 1.00 0.27 O ATOM 712 CB LYS A 73 2.371 12.992 -1.226 1.00 0.35 C ATOM 713 CG LYS A 73 2.995 13.867 -2.278 1.00 1.00 C ATOM 714 CD LYS A 73 2.036 14.940 -2.715 1.00 0.70 C ATOM 715 CE LYS A 73 1.051 14.392 -3.716 1.00 0.43 C ATOM 716 NZ LYS A 73 0.258 15.471 -4.360 1.00 0.64 N ATOM 0 H LYS A 73 4.588 12.027 -2.017 1.00 0.24 H new ATOM 0 HA LYS A 73 2.266 10.956 -0.562 1.00 0.23 H new ATOM 0 HB2 LYS A 73 1.291 13.137 -1.238 1.00 0.35 H new ATOM 0 HB3 LYS A 73 2.724 13.309 -0.245 1.00 0.35 H new ATOM 0 HG2 LYS A 73 3.904 14.323 -1.886 1.00 1.00 H new ATOM 0 HG3 LYS A 73 3.286 13.261 -3.136 1.00 1.00 H new ATOM 0 HD2 LYS A 73 1.503 15.334 -1.850 1.00 0.70 H new ATOM 0 HD3 LYS A 73 2.587 15.771 -3.156 1.00 0.70 H new ATOM 0 HE2 LYS A 73 1.586 13.829 -4.481 1.00 0.43 H new ATOM 0 HE3 LYS A 73 0.378 13.694 -3.218 1.00 0.43 H new ATOM 0 HZ1 LYS A 73 -0.407 15.053 -5.041 1.00 0.64 H new ATOM 0 HZ2 LYS A 73 -0.272 15.993 -3.633 1.00 0.64 H new ATOM 0 HZ3 LYS A 73 0.898 16.123 -4.857 1.00 0.64 H new ATOM 730 N ALA A 74 0.726 10.841 -2.681 1.00 0.21 N ATOM 731 CA ALA A 74 0.014 10.410 -3.873 1.00 0.22 C ATOM 732 C ALA A 74 -1.444 10.821 -3.811 1.00 0.26 C ATOM 733 O ALA A 74 -1.999 10.980 -2.730 1.00 0.41 O ATOM 734 CB ALA A 74 0.115 8.900 -4.039 1.00 0.23 C ATOM 0 H ALA A 74 0.133 11.001 -1.867 1.00 0.21 H new ATOM 0 HA ALA A 74 0.478 10.895 -4.732 1.00 0.22 H new ATOM 0 HB1 ALA A 74 -0.424 8.596 -4.936 1.00 0.23 H new ATOM 0 HB2 ALA A 74 1.163 8.613 -4.130 1.00 0.23 H new ATOM 0 HB3 ALA A 74 -0.321 8.408 -3.170 1.00 0.23 H new ATOM 740 N VAL A 75 -2.050 11.021 -4.964 1.00 0.28 N ATOM 741 CA VAL A 75 -3.485 11.204 -5.028 1.00 0.33 C ATOM 742 C VAL A 75 -4.099 9.911 -5.521 1.00 0.29 C ATOM 743 O VAL A 75 -3.694 9.381 -6.559 1.00 0.29 O ATOM 744 CB VAL A 75 -3.893 12.353 -5.966 1.00 0.43 C ATOM 745 CG1 VAL A 75 -5.374 12.661 -5.832 1.00 0.81 C ATOM 746 CG2 VAL A 75 -3.051 13.593 -5.711 1.00 0.80 C ATOM 0 H VAL A 75 -1.574 11.061 -5.865 1.00 0.28 H new ATOM 0 HA VAL A 75 -3.843 11.465 -4.032 1.00 0.33 H new ATOM 0 HB VAL A 75 -3.708 12.032 -6.991 1.00 0.43 H new ATOM 0 HG11 VAL A 75 -5.638 13.477 -6.505 1.00 0.81 H new ATOM 0 HG12 VAL A 75 -5.955 11.775 -6.090 1.00 0.81 H new ATOM 0 HG13 VAL A 75 -5.594 12.952 -4.805 1.00 0.81 H new ATOM 0 HG21 VAL A 75 -3.361 14.389 -6.388 1.00 0.80 H new ATOM 0 HG22 VAL A 75 -3.187 13.920 -4.680 1.00 0.80 H new ATOM 0 HG23 VAL A 75 -2.000 13.360 -5.882 1.00 0.80 H new ATOM 756 N TYR A 76 -5.061 9.397 -4.787 1.00 0.29 N ATOM 757 CA TYR A 76 -5.583 8.068 -5.070 1.00 0.25 C ATOM 758 C TYR A 76 -6.874 8.121 -5.868 1.00 0.29 C ATOM 759 O TYR A 76 -7.645 9.075 -5.777 1.00 0.42 O ATOM 760 CB TYR A 76 -5.775 7.252 -3.785 1.00 0.29 C ATOM 761 CG TYR A 76 -6.532 7.954 -2.682 1.00 0.38 C ATOM 762 CD1 TYR A 76 -7.905 8.137 -2.776 1.00 0.46 C ATOM 763 CD2 TYR A 76 -5.877 8.453 -1.563 1.00 0.44 C ATOM 764 CE1 TYR A 76 -8.608 8.793 -1.782 1.00 0.57 C ATOM 765 CE2 TYR A 76 -6.571 9.108 -0.565 1.00 0.56 C ATOM 766 CZ TYR A 76 -7.913 9.218 -0.627 1.00 0.64 C ATOM 767 OH TYR A 76 -8.624 9.932 0.312 1.00 0.75 O ATOM 0 H TYR A 76 -5.498 9.870 -3.996 1.00 0.29 H new ATOM 0 HA TYR A 76 -4.836 7.564 -5.683 1.00 0.25 H new ATOM 0 HB2 TYR A 76 -6.301 6.330 -4.035 1.00 0.29 H new ATOM 0 HB3 TYR A 76 -4.794 6.967 -3.405 1.00 0.29 H new ATOM 0 HD1 TYR A 76 -8.433 7.761 -3.640 1.00 0.46 H new ATOM 0 HD2 TYR A 76 -4.808 8.327 -1.472 1.00 0.44 H new ATOM 0 HE1 TYR A 76 -9.667 8.977 -1.886 1.00 0.57 H new ATOM 0 HE2 TYR A 76 -6.035 9.535 0.270 1.00 0.56 H new ATOM 0 HH TYR A 76 -9.553 10.029 0.015 1.00 0.75 H new ATOM 777 N SER A 77 -7.090 7.081 -6.653 1.00 0.25 N ATOM 778 CA SER A 77 -8.282 6.950 -7.467 1.00 0.29 C ATOM 779 C SER A 77 -8.717 5.492 -7.497 1.00 0.23 C ATOM 780 O SER A 77 -7.930 4.602 -7.168 1.00 0.26 O ATOM 781 CB SER A 77 -8.013 7.466 -8.880 1.00 0.39 C ATOM 782 OG SER A 77 -6.850 6.872 -9.434 1.00 0.98 O ATOM 0 H SER A 77 -6.440 6.300 -6.743 1.00 0.25 H new ATOM 0 HA SER A 77 -9.085 7.547 -7.036 1.00 0.29 H new ATOM 0 HB2 SER A 77 -8.871 7.252 -9.517 1.00 0.39 H new ATOM 0 HB3 SER A 77 -7.895 8.549 -8.857 1.00 0.39 H new ATOM 0 HG SER A 77 -6.704 7.220 -10.339 1.00 0.98 H new ATOM 788 N PHE A 78 -9.964 5.245 -7.863 1.00 0.20 N ATOM 789 CA PHE A 78 -10.485 3.887 -7.889 1.00 0.20 C ATOM 790 C PHE A 78 -11.074 3.543 -9.245 1.00 0.22 C ATOM 791 O PHE A 78 -11.827 4.327 -9.827 1.00 0.28 O ATOM 792 CB PHE A 78 -11.541 3.698 -6.800 1.00 0.24 C ATOM 793 CG PHE A 78 -10.971 3.740 -5.417 1.00 0.29 C ATOM 794 CD1 PHE A 78 -10.430 2.604 -4.838 1.00 0.36 C ATOM 795 CD2 PHE A 78 -10.984 4.920 -4.695 1.00 0.37 C ATOM 796 CE1 PHE A 78 -9.911 2.647 -3.560 1.00 0.46 C ATOM 797 CE2 PHE A 78 -10.468 4.971 -3.419 1.00 0.47 C ATOM 798 CZ PHE A 78 -9.903 3.804 -2.860 1.00 0.50 C ATOM 0 H PHE A 78 -10.632 5.963 -8.145 1.00 0.20 H new ATOM 0 HA PHE A 78 -9.651 3.212 -7.700 1.00 0.20 H new ATOM 0 HB2 PHE A 78 -12.299 4.475 -6.898 1.00 0.24 H new ATOM 0 HB3 PHE A 78 -12.043 2.742 -6.951 1.00 0.24 H new ATOM 0 HD1 PHE A 78 -10.414 1.677 -5.391 1.00 0.36 H new ATOM 0 HD2 PHE A 78 -11.404 5.812 -5.137 1.00 0.37 H new ATOM 0 HE1 PHE A 78 -9.508 1.749 -3.115 1.00 0.46 H new ATOM 0 HE2 PHE A 78 -10.495 5.891 -2.854 1.00 0.47 H new ATOM 0 HZ PHE A 78 -9.465 3.835 -1.874 1.00 0.50 H new ATOM 808 N ASN A 79 -10.720 2.369 -9.747 1.00 0.21 N ATOM 809 CA ASN A 79 -11.282 1.865 -10.990 1.00 0.23 C ATOM 810 C ASN A 79 -11.919 0.506 -10.738 1.00 0.26 C ATOM 811 O ASN A 79 -11.211 -0.478 -10.524 1.00 0.31 O ATOM 812 CB ASN A 79 -10.188 1.748 -12.054 1.00 0.31 C ATOM 813 CG ASN A 79 -10.700 1.202 -13.374 1.00 0.45 C ATOM 814 OD1 ASN A 79 -10.736 -0.010 -13.587 1.00 0.77 O ATOM 815 ND2 ASN A 79 -11.078 2.090 -14.277 1.00 0.59 N ATOM 0 H ASN A 79 -10.042 1.745 -9.309 1.00 0.21 H new ATOM 0 HA ASN A 79 -12.042 2.558 -11.352 1.00 0.23 H new ATOM 0 HB2 ASN A 79 -9.745 2.730 -12.221 1.00 0.31 H new ATOM 0 HB3 ASN A 79 -9.395 1.099 -11.682 1.00 0.31 H new ATOM 0 HD21 ASN A 79 -11.414 1.779 -15.188 1.00 0.59 H new ATOM 0 HD22 ASN A 79 -11.033 3.086 -14.062 1.00 0.59 H new ATOM 822 N ALA A 80 -13.253 0.463 -10.767 1.00 0.28 N ATOM 823 CA ALA A 80 -14.019 -0.743 -10.437 1.00 0.38 C ATOM 824 C ALA A 80 -13.817 -1.129 -8.973 1.00 0.46 C ATOM 825 O ALA A 80 -14.666 -0.865 -8.126 1.00 0.95 O ATOM 826 CB ALA A 80 -13.663 -1.899 -11.370 1.00 0.45 C ATOM 0 H ALA A 80 -13.833 1.263 -11.020 1.00 0.28 H new ATOM 0 HA ALA A 80 -15.076 -0.520 -10.583 1.00 0.38 H new ATOM 0 HB1 ALA A 80 -14.248 -2.778 -11.099 1.00 0.45 H new ATOM 0 HB2 ALA A 80 -13.886 -1.618 -12.399 1.00 0.45 H new ATOM 0 HB3 ALA A 80 -12.601 -2.127 -11.278 1.00 0.45 H new ATOM 832 N GLY A 81 -12.694 -1.756 -8.699 1.00 0.24 N ATOM 833 CA GLY A 81 -12.293 -2.057 -7.346 1.00 0.21 C ATOM 834 C GLY A 81 -10.797 -1.896 -7.178 1.00 0.21 C ATOM 835 O GLY A 81 -10.226 -2.269 -6.159 1.00 0.31 O ATOM 0 H GLY A 81 -12.034 -2.071 -9.410 1.00 0.24 H new ATOM 0 HA2 GLY A 81 -12.814 -1.397 -6.653 1.00 0.21 H new ATOM 0 HA3 GLY A 81 -12.584 -3.077 -7.095 1.00 0.21 H new ATOM 839 N LYS A 82 -10.164 -1.334 -8.196 1.00 0.19 N ATOM 840 CA LYS A 82 -8.727 -1.151 -8.206 1.00 0.20 C ATOM 841 C LYS A 82 -8.347 0.189 -7.601 1.00 0.20 C ATOM 842 O LYS A 82 -8.847 1.234 -8.016 1.00 0.26 O ATOM 843 CB LYS A 82 -8.207 -1.247 -9.638 1.00 0.23 C ATOM 844 CG LYS A 82 -8.399 -2.621 -10.247 1.00 0.26 C ATOM 845 CD LYS A 82 -7.526 -3.650 -9.556 1.00 0.23 C ATOM 846 CE LYS A 82 -7.859 -5.058 -10.025 1.00 0.41 C ATOM 847 NZ LYS A 82 -6.807 -6.039 -9.654 1.00 1.32 N ATOM 0 H LYS A 82 -10.634 -0.994 -9.035 1.00 0.19 H new ATOM 0 HA LYS A 82 -8.273 -1.937 -7.602 1.00 0.20 H new ATOM 0 HB2 LYS A 82 -8.718 -0.508 -10.255 1.00 0.23 H new ATOM 0 HB3 LYS A 82 -7.147 -0.995 -9.651 1.00 0.23 H new ATOM 0 HG2 LYS A 82 -9.446 -2.915 -10.167 1.00 0.26 H new ATOM 0 HG3 LYS A 82 -8.157 -2.589 -11.309 1.00 0.26 H new ATOM 0 HD2 LYS A 82 -6.477 -3.435 -9.758 1.00 0.23 H new ATOM 0 HD3 LYS A 82 -7.663 -3.581 -8.477 1.00 0.23 H new ATOM 0 HE2 LYS A 82 -8.810 -5.367 -9.592 1.00 0.41 H new ATOM 0 HE3 LYS A 82 -7.987 -5.057 -11.107 1.00 0.41 H new ATOM 0 HZ1 LYS A 82 -6.432 -6.488 -10.514 1.00 1.32 H new ATOM 0 HZ2 LYS A 82 -6.037 -5.550 -9.155 1.00 1.32 H new ATOM 0 HZ3 LYS A 82 -7.215 -6.767 -9.033 1.00 1.32 H new ATOM 861 N PHE A 83 -7.461 0.143 -6.629 1.00 0.16 N ATOM 862 CA PHE A 83 -7.005 1.330 -5.931 1.00 0.16 C ATOM 863 C PHE A 83 -5.703 1.833 -6.540 1.00 0.16 C ATOM 864 O PHE A 83 -4.763 1.067 -6.751 1.00 0.17 O ATOM 865 CB PHE A 83 -6.849 1.004 -4.433 1.00 0.15 C ATOM 866 CG PHE A 83 -5.814 1.815 -3.705 1.00 0.16 C ATOM 867 CD1 PHE A 83 -6.142 3.026 -3.120 1.00 0.18 C ATOM 868 CD2 PHE A 83 -4.508 1.354 -3.603 1.00 0.19 C ATOM 869 CE1 PHE A 83 -5.186 3.763 -2.452 1.00 0.20 C ATOM 870 CE2 PHE A 83 -3.549 2.088 -2.935 1.00 0.22 C ATOM 871 CZ PHE A 83 -3.891 3.293 -2.359 1.00 0.22 C ATOM 0 H PHE A 83 -7.034 -0.722 -6.298 1.00 0.16 H new ATOM 0 HA PHE A 83 -7.739 2.130 -6.035 1.00 0.16 H new ATOM 0 HB2 PHE A 83 -7.812 1.150 -3.944 1.00 0.15 H new ATOM 0 HB3 PHE A 83 -6.597 -0.052 -4.332 1.00 0.15 H new ATOM 0 HD1 PHE A 83 -7.154 3.397 -3.187 1.00 0.18 H new ATOM 0 HD2 PHE A 83 -4.239 0.409 -4.052 1.00 0.19 H new ATOM 0 HE1 PHE A 83 -5.451 4.708 -2.002 1.00 0.20 H new ATOM 0 HE2 PHE A 83 -2.536 1.720 -2.864 1.00 0.22 H new ATOM 0 HZ PHE A 83 -3.145 3.870 -1.834 1.00 0.22 H new ATOM 881 N MET A 84 -5.665 3.120 -6.844 1.00 0.19 N ATOM 882 CA MET A 84 -4.504 3.720 -7.475 1.00 0.19 C ATOM 883 C MET A 84 -3.982 4.886 -6.668 1.00 0.24 C ATOM 884 O MET A 84 -4.602 5.301 -5.696 1.00 0.44 O ATOM 885 CB MET A 84 -4.859 4.195 -8.877 1.00 0.22 C ATOM 886 CG MET A 84 -5.538 3.131 -9.692 1.00 0.21 C ATOM 887 SD MET A 84 -5.949 3.665 -11.353 1.00 0.25 S ATOM 888 CE MET A 84 -6.556 2.108 -11.967 1.00 0.23 C ATOM 0 H MET A 84 -6.429 3.771 -6.662 1.00 0.19 H new ATOM 0 HA MET A 84 -3.724 2.960 -7.529 1.00 0.19 H new ATOM 0 HB2 MET A 84 -5.511 5.066 -8.808 1.00 0.22 H new ATOM 0 HB3 MET A 84 -3.952 4.516 -9.389 1.00 0.22 H new ATOM 0 HG2 MET A 84 -4.889 2.257 -9.749 1.00 0.21 H new ATOM 0 HG3 MET A 84 -6.449 2.819 -9.182 1.00 0.21 H new ATOM 0 HE1 MET A 84 -7.423 2.281 -12.604 1.00 0.23 H new ATOM 0 HE2 MET A 84 -5.774 1.615 -12.545 1.00 0.23 H new ATOM 0 HE3 MET A 84 -6.843 1.473 -11.129 1.00 0.23 H new ATOM 898 N GLY A 85 -2.843 5.410 -7.088 1.00 0.19 N ATOM 899 CA GLY A 85 -2.268 6.561 -6.433 1.00 0.23 C ATOM 900 C GLY A 85 -1.043 7.068 -7.157 1.00 0.30 C ATOM 901 O GLY A 85 -0.005 6.426 -7.125 1.00 0.61 O ATOM 0 H GLY A 85 -2.304 5.055 -7.877 1.00 0.19 H new ATOM 0 HA2 GLY A 85 -3.012 7.356 -6.377 1.00 0.23 H new ATOM 0 HA3 GLY A 85 -2.002 6.301 -5.408 1.00 0.23 H new ATOM 905 N ASN A 86 -1.159 8.210 -7.819 1.00 0.27 N ATOM 906 CA ASN A 86 -0.023 8.776 -8.537 1.00 0.30 C ATOM 907 C ASN A 86 0.921 9.445 -7.547 1.00 0.24 C ATOM 908 O ASN A 86 0.539 10.398 -6.868 1.00 0.23 O ATOM 909 CB ASN A 86 -0.487 9.778 -9.591 1.00 0.41 C ATOM 910 CG ASN A 86 0.602 10.098 -10.593 1.00 0.58 C ATOM 911 OD1 ASN A 86 0.714 9.447 -11.629 1.00 1.51 O ATOM 912 ND2 ASN A 86 1.409 11.100 -10.296 1.00 0.93 N ATOM 0 H ASN A 86 -2.017 8.759 -7.875 1.00 0.27 H new ATOM 0 HA ASN A 86 0.503 7.972 -9.051 1.00 0.30 H new ATOM 0 HB2 ASN A 86 -1.354 9.376 -10.115 1.00 0.41 H new ATOM 0 HB3 ASN A 86 -0.808 10.697 -9.100 1.00 0.41 H new ATOM 0 HD21 ASN A 86 2.159 11.358 -10.937 1.00 0.93 H new ATOM 0 HD22 ASN A 86 1.283 11.616 -9.425 1.00 0.93 H new ATOM 919 N PHE A 87 2.148 8.950 -7.477 1.00 0.23 N ATOM 920 CA PHE A 87 3.057 9.317 -6.399 1.00 0.20 C ATOM 921 C PHE A 87 3.994 10.458 -6.739 1.00 0.22 C ATOM 922 O PHE A 87 4.365 10.686 -7.892 1.00 0.30 O ATOM 923 CB PHE A 87 3.894 8.118 -5.965 1.00 0.24 C ATOM 924 CG PHE A 87 3.155 7.161 -5.086 1.00 0.20 C ATOM 925 CD1 PHE A 87 3.132 7.331 -3.717 1.00 0.23 C ATOM 926 CD2 PHE A 87 2.494 6.079 -5.639 1.00 0.23 C ATOM 927 CE1 PHE A 87 2.463 6.437 -2.907 1.00 0.27 C ATOM 928 CE2 PHE A 87 1.821 5.183 -4.839 1.00 0.27 C ATOM 929 CZ PHE A 87 1.763 5.411 -3.444 1.00 0.28 C ATOM 0 H PHE A 87 2.538 8.293 -8.153 1.00 0.23 H new ATOM 0 HA PHE A 87 2.410 9.656 -5.590 1.00 0.20 H new ATOM 0 HB2 PHE A 87 4.243 7.589 -6.852 1.00 0.24 H new ATOM 0 HB3 PHE A 87 4.779 8.475 -5.437 1.00 0.24 H new ATOM 0 HD1 PHE A 87 3.643 8.173 -3.275 1.00 0.23 H new ATOM 0 HD2 PHE A 87 2.506 5.936 -6.709 1.00 0.23 H new ATOM 0 HE1 PHE A 87 2.498 6.557 -1.834 1.00 0.27 H new ATOM 0 HE2 PHE A 87 1.343 4.316 -5.271 1.00 0.27 H new ATOM 0 HZ PHE A 87 1.165 4.771 -2.812 1.00 0.28 H new ATOM 939 N ASN A 88 4.365 11.149 -5.679 1.00 0.21 N ATOM 940 CA ASN A 88 5.411 12.153 -5.686 1.00 0.26 C ATOM 941 C ASN A 88 6.390 11.823 -4.569 1.00 0.27 C ATOM 942 O ASN A 88 6.303 12.377 -3.471 1.00 0.42 O ATOM 943 CB ASN A 88 4.838 13.552 -5.469 1.00 0.34 C ATOM 944 CG ASN A 88 4.131 14.104 -6.695 1.00 1.15 C ATOM 945 OD1 ASN A 88 4.456 13.752 -7.828 1.00 2.02 O ATOM 946 ND2 ASN A 88 3.179 14.997 -6.479 1.00 1.66 N ATOM 0 H ASN A 88 3.935 11.024 -4.763 1.00 0.21 H new ATOM 0 HA ASN A 88 5.910 12.146 -6.655 1.00 0.26 H new ATOM 0 HB2 ASN A 88 4.137 13.526 -4.634 1.00 0.34 H new ATOM 0 HB3 ASN A 88 5.645 14.229 -5.187 1.00 0.34 H new ATOM 0 HD21 ASN A 88 2.687 15.419 -7.267 1.00 1.66 H new ATOM 0 HD22 ASN A 88 2.937 15.264 -5.525 1.00 1.66 H new ATOM 953 N VAL A 89 7.302 10.900 -4.840 1.00 0.24 N ATOM 954 CA VAL A 89 8.161 10.347 -3.801 1.00 0.24 C ATOM 955 C VAL A 89 9.558 10.954 -3.851 1.00 0.30 C ATOM 956 O VAL A 89 10.108 11.196 -4.927 1.00 0.34 O ATOM 957 CB VAL A 89 8.313 8.808 -3.908 1.00 0.24 C ATOM 958 CG1 VAL A 89 8.358 8.185 -2.534 1.00 0.28 C ATOM 959 CG2 VAL A 89 7.198 8.179 -4.739 1.00 0.25 C ATOM 0 H VAL A 89 7.467 10.518 -5.771 1.00 0.24 H new ATOM 0 HA VAL A 89 7.670 10.595 -2.860 1.00 0.24 H new ATOM 0 HB VAL A 89 9.254 8.610 -4.421 1.00 0.24 H new ATOM 0 HG11 VAL A 89 8.465 7.104 -2.628 1.00 0.28 H new ATOM 0 HG12 VAL A 89 9.206 8.587 -1.980 1.00 0.28 H new ATOM 0 HG13 VAL A 89 7.435 8.413 -2.001 1.00 0.28 H new ATOM 0 HG21 VAL A 89 7.345 7.100 -4.787 1.00 0.25 H new ATOM 0 HG22 VAL A 89 6.234 8.394 -4.277 1.00 0.25 H new ATOM 0 HG23 VAL A 89 7.218 8.593 -5.747 1.00 0.25 H new ATOM 969 N LYS A 90 10.107 11.201 -2.677 1.00 0.33 N ATOM 970 CA LYS A 90 11.488 11.614 -2.532 1.00 0.41 C ATOM 971 C LYS A 90 12.295 10.396 -2.096 1.00 0.33 C ATOM 972 O LYS A 90 12.031 9.820 -1.039 1.00 0.35 O ATOM 973 CB LYS A 90 11.574 12.743 -1.504 1.00 0.54 C ATOM 974 CG LYS A 90 12.894 13.495 -1.488 1.00 0.99 C ATOM 975 CD LYS A 90 13.956 12.779 -0.670 1.00 1.48 C ATOM 976 CE LYS A 90 15.162 13.671 -0.433 1.00 2.27 C ATOM 977 NZ LYS A 90 16.166 13.027 0.454 1.00 2.81 N ATOM 0 H LYS A 90 9.604 11.120 -1.793 1.00 0.33 H new ATOM 0 HA LYS A 90 11.891 11.992 -3.472 1.00 0.41 H new ATOM 0 HB2 LYS A 90 10.770 13.453 -1.698 1.00 0.54 H new ATOM 0 HB3 LYS A 90 11.398 12.326 -0.512 1.00 0.54 H new ATOM 0 HG2 LYS A 90 13.250 13.621 -2.510 1.00 0.99 H new ATOM 0 HG3 LYS A 90 12.736 14.493 -1.080 1.00 0.99 H new ATOM 0 HD2 LYS A 90 13.535 12.471 0.287 1.00 1.48 H new ATOM 0 HD3 LYS A 90 14.268 11.872 -1.188 1.00 1.48 H new ATOM 0 HE2 LYS A 90 15.626 13.915 -1.389 1.00 2.27 H new ATOM 0 HE3 LYS A 90 14.836 14.611 0.012 1.00 2.27 H new ATOM 0 HZ1 LYS A 90 16.972 13.670 0.590 1.00 2.81 H new ATOM 0 HZ2 LYS A 90 15.732 12.818 1.375 1.00 2.81 H new ATOM 0 HZ3 LYS A 90 16.497 12.143 0.019 1.00 2.81 H new ATOM 991 N GLU A 91 13.255 9.992 -2.911 1.00 0.41 N ATOM 992 CA GLU A 91 13.898 8.699 -2.739 1.00 0.44 C ATOM 993 C GLU A 91 15.414 8.798 -2.857 1.00 0.46 C ATOM 994 O GLU A 91 15.950 9.622 -3.594 1.00 0.62 O ATOM 995 CB GLU A 91 13.366 7.730 -3.780 1.00 0.72 C ATOM 996 CG GLU A 91 13.569 6.270 -3.456 1.00 0.52 C ATOM 997 CD GLU A 91 13.248 5.382 -4.640 1.00 1.20 C ATOM 998 OE1 GLU A 91 12.053 5.099 -4.860 1.00 1.57 O ATOM 999 OE2 GLU A 91 14.185 4.942 -5.339 1.00 1.68 O ATOM 0 H GLU A 91 13.606 10.539 -3.697 1.00 0.41 H new ATOM 0 HA GLU A 91 13.668 8.339 -1.736 1.00 0.44 H new ATOM 0 HB2 GLU A 91 12.300 7.912 -3.913 1.00 0.72 H new ATOM 0 HB3 GLU A 91 13.847 7.945 -4.734 1.00 0.72 H new ATOM 0 HG2 GLU A 91 14.602 6.106 -3.148 1.00 0.52 H new ATOM 0 HG3 GLU A 91 12.937 5.993 -2.612 1.00 0.52 H new ATOM 1006 N VAL A 92 16.076 7.943 -2.108 1.00 0.45 N ATOM 1007 CA VAL A 92 17.534 7.880 -2.049 1.00 0.43 C ATOM 1008 C VAL A 92 18.010 6.572 -2.668 1.00 0.41 C ATOM 1009 O VAL A 92 17.226 5.641 -2.837 1.00 0.40 O ATOM 1010 CB VAL A 92 18.052 7.949 -0.597 1.00 0.44 C ATOM 1011 CG1 VAL A 92 17.461 9.127 0.129 1.00 0.53 C ATOM 1012 CG2 VAL A 92 17.757 6.673 0.136 1.00 0.40 C ATOM 0 H VAL A 92 15.615 7.257 -1.510 1.00 0.45 H new ATOM 0 HA VAL A 92 17.923 8.737 -2.599 1.00 0.43 H new ATOM 0 HB VAL A 92 19.134 8.080 -0.632 1.00 0.44 H new ATOM 0 HG11 VAL A 92 17.842 9.153 1.150 1.00 0.53 H new ATOM 0 HG12 VAL A 92 17.737 10.047 -0.385 1.00 0.53 H new ATOM 0 HG13 VAL A 92 16.375 9.035 0.149 1.00 0.53 H new ATOM 0 HG21 VAL A 92 18.131 6.745 1.157 1.00 0.40 H new ATOM 0 HG22 VAL A 92 16.680 6.505 0.155 1.00 0.40 H new ATOM 0 HG23 VAL A 92 18.245 5.841 -0.371 1.00 0.40 H new ATOM 1022 N ASP A 93 19.265 6.503 -3.041 1.00 0.44 N ATOM 1023 CA ASP A 93 19.841 5.241 -3.468 1.00 0.45 C ATOM 1024 C ASP A 93 20.811 4.764 -2.398 1.00 0.46 C ATOM 1025 O ASP A 93 21.329 5.570 -1.628 1.00 0.57 O ATOM 1026 CB ASP A 93 20.539 5.384 -4.822 1.00 0.56 C ATOM 1027 CG ASP A 93 22.053 5.417 -4.724 1.00 1.17 C ATOM 1028 OD1 ASP A 93 22.615 6.507 -4.467 1.00 1.83 O ATOM 1029 OD2 ASP A 93 22.686 4.353 -4.886 1.00 1.78 O ATOM 0 H ASP A 93 19.906 7.296 -3.059 1.00 0.44 H new ATOM 0 HA ASP A 93 19.049 4.503 -3.596 1.00 0.45 H new ATOM 0 HB2 ASP A 93 20.243 4.554 -5.464 1.00 0.56 H new ATOM 0 HB3 ASP A 93 20.194 6.299 -5.304 1.00 0.56 H new ATOM 1034 N GLY A 94 21.023 3.460 -2.313 1.00 0.42 N ATOM 1035 CA GLY A 94 21.918 2.935 -1.301 1.00 0.43 C ATOM 1036 C GLY A 94 21.194 2.576 -0.017 1.00 0.40 C ATOM 1037 O GLY A 94 21.659 1.740 0.755 1.00 0.48 O ATOM 0 H GLY A 94 20.596 2.760 -2.920 1.00 0.42 H new ATOM 0 HA2 GLY A 94 22.422 2.050 -1.690 1.00 0.43 H new ATOM 0 HA3 GLY A 94 22.690 3.673 -1.085 1.00 0.43 H new ATOM 1041 N CYS A 95 20.044 3.197 0.205 1.00 0.33 N ATOM 1042 CA CYS A 95 19.249 2.929 1.395 1.00 0.31 C ATOM 1043 C CYS A 95 18.262 1.820 1.081 1.00 0.27 C ATOM 1044 O CYS A 95 18.008 0.942 1.899 1.00 0.32 O ATOM 1045 CB CYS A 95 18.519 4.196 1.843 1.00 0.33 C ATOM 1046 SG CYS A 95 17.693 4.058 3.461 1.00 0.42 S ATOM 0 H CYS A 95 19.640 3.891 -0.424 1.00 0.33 H new ATOM 0 HA CYS A 95 19.899 2.614 2.212 1.00 0.31 H new ATOM 0 HB2 CYS A 95 19.234 5.018 1.883 1.00 0.33 H new ATOM 0 HB3 CYS A 95 17.775 4.457 1.090 1.00 0.33 H new ATOM 1051 N PHE A 96 17.729 1.868 -0.132 1.00 0.24 N ATOM 1052 CA PHE A 96 16.922 0.783 -0.671 1.00 0.23 C ATOM 1053 C PHE A 96 17.823 -0.028 -1.591 1.00 0.24 C ATOM 1054 O PHE A 96 17.396 -0.492 -2.649 1.00 0.23 O ATOM 1055 CB PHE A 96 15.722 1.327 -1.474 1.00 0.24 C ATOM 1056 CG PHE A 96 15.127 2.590 -0.917 1.00 0.23 C ATOM 1057 CD1 PHE A 96 15.758 3.782 -1.149 1.00 0.30 C ATOM 1058 CD2 PHE A 96 13.964 2.594 -0.161 1.00 0.21 C ATOM 1059 CE1 PHE A 96 15.262 4.960 -0.642 1.00 0.35 C ATOM 1060 CE2 PHE A 96 13.459 3.769 0.343 1.00 0.24 C ATOM 1061 CZ PHE A 96 14.118 4.953 0.108 1.00 0.31 C ATOM 0 H PHE A 96 17.843 2.657 -0.768 1.00 0.24 H new ATOM 0 HA PHE A 96 16.525 0.175 0.142 1.00 0.23 H new ATOM 0 HB2 PHE A 96 16.040 1.511 -2.500 1.00 0.24 H new ATOM 0 HB3 PHE A 96 14.948 0.561 -1.512 1.00 0.24 H new ATOM 0 HD1 PHE A 96 16.661 3.798 -1.741 1.00 0.30 H new ATOM 0 HD2 PHE A 96 13.450 1.664 0.034 1.00 0.21 H new ATOM 0 HE1 PHE A 96 15.775 5.890 -0.836 1.00 0.35 H new ATOM 0 HE2 PHE A 96 12.547 3.762 0.922 1.00 0.24 H new ATOM 0 HZ PHE A 96 13.733 5.876 0.515 1.00 0.31 H new ATOM 1071 N MET A 97 19.088 -0.163 -1.171 1.00 0.27 N ATOM 1072 CA MET A 97 20.147 -0.729 -1.998 1.00 0.29 C ATOM 1073 C MET A 97 20.010 -0.259 -3.439 1.00 0.31 C ATOM 1074 O MET A 97 20.110 0.937 -3.723 1.00 0.40 O ATOM 1075 CB MET A 97 20.131 -2.254 -1.929 1.00 0.29 C ATOM 1076 CG MET A 97 20.182 -2.798 -0.519 1.00 0.33 C ATOM 1077 SD MET A 97 20.419 -4.584 -0.482 1.00 0.45 S ATOM 1078 CE MET A 97 20.196 -4.899 1.263 1.00 1.22 C ATOM 0 H MET A 97 19.401 0.121 -0.242 1.00 0.27 H new ATOM 0 HA MET A 97 21.104 -0.380 -1.611 1.00 0.29 H new ATOM 0 HB2 MET A 97 19.229 -2.622 -2.419 1.00 0.29 H new ATOM 0 HB3 MET A 97 20.980 -2.643 -2.490 1.00 0.29 H new ATOM 0 HG2 MET A 97 20.994 -2.315 0.025 1.00 0.33 H new ATOM 0 HG3 MET A 97 19.257 -2.546 -0.001 1.00 0.33 H new ATOM 0 HE1 MET A 97 20.311 -5.965 1.458 1.00 1.22 H new ATOM 0 HE2 MET A 97 20.942 -4.344 1.831 1.00 1.22 H new ATOM 0 HE3 MET A 97 19.198 -4.581 1.566 1.00 1.22 H new ATOM 1088 N ASP A 98 19.762 -1.203 -4.334 1.00 0.30 N ATOM 1089 CA ASP A 98 19.446 -0.886 -5.717 1.00 0.31 C ATOM 1090 C ASP A 98 18.269 -1.708 -6.189 1.00 0.26 C ATOM 1091 O ASP A 98 17.388 -1.207 -6.885 1.00 0.25 O ATOM 1092 CB ASP A 98 20.645 -1.137 -6.620 1.00 0.40 C ATOM 1093 CG ASP A 98 21.077 0.118 -7.350 1.00 1.01 C ATOM 1094 OD1 ASP A 98 20.406 0.503 -8.331 1.00 1.64 O ATOM 1095 OD2 ASP A 98 22.086 0.734 -6.940 1.00 1.19 O ATOM 0 H ASP A 98 19.774 -2.201 -4.124 1.00 0.30 H new ATOM 0 HA ASP A 98 19.188 0.172 -5.769 1.00 0.31 H new ATOM 0 HB2 ASP A 98 21.476 -1.514 -6.023 1.00 0.40 H new ATOM 0 HB3 ASP A 98 20.397 -1.911 -7.346 1.00 0.40 H new ATOM 1100 N ALA A 99 18.231 -2.959 -5.769 1.00 0.24 N ATOM 1101 CA ALA A 99 17.200 -3.869 -6.217 1.00 0.24 C ATOM 1102 C ALA A 99 15.948 -3.693 -5.381 1.00 0.20 C ATOM 1103 O ALA A 99 14.835 -3.980 -5.823 1.00 0.20 O ATOM 1104 CB ALA A 99 17.688 -5.305 -6.173 1.00 0.28 C ATOM 0 H ALA A 99 18.903 -3.366 -5.118 1.00 0.24 H new ATOM 0 HA ALA A 99 16.957 -3.635 -7.254 1.00 0.24 H new ATOM 0 HB1 ALA A 99 16.894 -5.970 -6.515 1.00 0.28 H new ATOM 0 HB2 ALA A 99 18.557 -5.414 -6.822 1.00 0.28 H new ATOM 0 HB3 ALA A 99 17.964 -5.564 -5.151 1.00 0.28 H new ATOM 1110 N GLN A 100 16.142 -3.214 -4.164 1.00 0.18 N ATOM 1111 CA GLN A 100 15.031 -2.888 -3.290 1.00 0.16 C ATOM 1112 C GLN A 100 14.311 -1.678 -3.852 1.00 0.14 C ATOM 1113 O GLN A 100 13.091 -1.588 -3.828 1.00 0.13 O ATOM 1114 CB GLN A 100 15.522 -2.584 -1.888 1.00 0.19 C ATOM 1115 CG GLN A 100 16.590 -3.541 -1.407 1.00 0.23 C ATOM 1116 CD GLN A 100 16.725 -3.535 0.093 1.00 0.29 C ATOM 1117 OE1 GLN A 100 17.452 -2.725 0.667 1.00 0.83 O ATOM 1118 NE2 GLN A 100 16.026 -4.443 0.738 1.00 1.27 N ATOM 0 H GLN A 100 17.062 -3.042 -3.759 1.00 0.18 H new ATOM 0 HA GLN A 100 14.354 -3.740 -3.237 1.00 0.16 H new ATOM 0 HB2 GLN A 100 15.916 -1.568 -1.861 1.00 0.19 H new ATOM 0 HB3 GLN A 100 14.678 -2.617 -1.200 1.00 0.19 H new ATOM 0 HG2 GLN A 100 16.351 -4.549 -1.745 1.00 0.23 H new ATOM 0 HG3 GLN A 100 17.546 -3.273 -1.857 1.00 0.23 H new ATOM 0 HE21 GLN A 100 15.436 -5.095 0.221 1.00 1.27 H new ATOM 0 HE22 GLN A 100 16.074 -4.496 1.756 1.00 1.27 H new ATOM 1127 N LYS A 101 15.106 -0.744 -4.349 1.00 0.16 N ATOM 1128 CA LYS A 101 14.602 0.399 -5.095 1.00 0.17 C ATOM 1129 C LYS A 101 13.768 -0.066 -6.285 1.00 0.17 C ATOM 1130 O LYS A 101 12.670 0.441 -6.525 1.00 0.17 O ATOM 1131 CB LYS A 101 15.775 1.254 -5.573 1.00 0.23 C ATOM 1132 CG LYS A 101 15.388 2.308 -6.584 1.00 0.28 C ATOM 1133 CD LYS A 101 16.606 3.056 -7.105 1.00 0.50 C ATOM 1134 CE LYS A 101 17.637 2.099 -7.686 1.00 1.21 C ATOM 1135 NZ LYS A 101 18.833 2.808 -8.212 1.00 1.85 N ATOM 0 H LYS A 101 16.121 -0.757 -4.247 1.00 0.16 H new ATOM 0 HA LYS A 101 13.964 0.996 -4.443 1.00 0.17 H new ATOM 0 HB2 LYS A 101 16.233 1.740 -4.712 1.00 0.23 H new ATOM 0 HB3 LYS A 101 16.532 0.604 -6.011 1.00 0.23 H new ATOM 0 HG2 LYS A 101 14.864 1.839 -7.417 1.00 0.28 H new ATOM 0 HG3 LYS A 101 14.694 3.014 -6.128 1.00 0.28 H new ATOM 0 HD2 LYS A 101 16.298 3.769 -7.869 1.00 0.50 H new ATOM 0 HD3 LYS A 101 17.056 3.631 -6.296 1.00 0.50 H new ATOM 0 HE2 LYS A 101 17.946 1.391 -6.917 1.00 1.21 H new ATOM 0 HE3 LYS A 101 17.180 1.519 -8.488 1.00 1.21 H new ATOM 0 HZ1 LYS A 101 19.604 2.126 -8.361 1.00 1.85 H new ATOM 0 HZ2 LYS A 101 18.596 3.265 -9.116 1.00 1.85 H new ATOM 0 HZ3 LYS A 101 19.137 3.530 -7.528 1.00 1.85 H new ATOM 1149 N ILE A 102 14.306 -1.023 -7.041 1.00 0.17 N ATOM 1150 CA ILE A 102 13.560 -1.679 -8.104 1.00 0.18 C ATOM 1151 C ILE A 102 12.236 -2.224 -7.581 1.00 0.15 C ATOM 1152 O ILE A 102 11.188 -1.999 -8.183 1.00 0.15 O ATOM 1153 CB ILE A 102 14.387 -2.824 -8.704 1.00 0.20 C ATOM 1154 CG1 ILE A 102 15.694 -2.260 -9.251 1.00 0.23 C ATOM 1155 CG2 ILE A 102 13.608 -3.555 -9.795 1.00 0.21 C ATOM 1156 CD1 ILE A 102 16.699 -3.316 -9.639 1.00 0.25 C ATOM 0 H ILE A 102 15.263 -1.360 -6.932 1.00 0.17 H new ATOM 0 HA ILE A 102 13.353 -0.939 -8.877 1.00 0.18 H new ATOM 0 HB ILE A 102 14.607 -3.553 -7.924 1.00 0.20 H new ATOM 0 HG12 ILE A 102 15.476 -1.642 -10.122 1.00 0.23 H new ATOM 0 HG13 ILE A 102 16.139 -1.607 -8.500 1.00 0.23 H new ATOM 0 HG21 ILE A 102 14.220 -4.361 -10.201 1.00 0.21 H new ATOM 0 HG22 ILE A 102 12.694 -3.971 -9.372 1.00 0.21 H new ATOM 0 HG23 ILE A 102 13.354 -2.856 -10.591 1.00 0.21 H new ATOM 0 HD11 ILE A 102 17.602 -2.837 -10.019 1.00 0.25 H new ATOM 0 HD12 ILE A 102 16.948 -3.919 -8.766 1.00 0.25 H new ATOM 0 HD13 ILE A 102 16.274 -3.955 -10.413 1.00 0.25 H new ATOM 1168 N ALA A 103 12.297 -2.929 -6.451 1.00 0.13 N ATOM 1169 CA ALA A 103 11.105 -3.439 -5.775 1.00 0.11 C ATOM 1170 C ALA A 103 10.094 -2.326 -5.533 1.00 0.10 C ATOM 1171 O ALA A 103 8.890 -2.508 -5.698 1.00 0.10 O ATOM 1172 CB ALA A 103 11.488 -4.058 -4.444 1.00 0.11 C ATOM 0 H ALA A 103 13.171 -3.162 -5.980 1.00 0.13 H new ATOM 0 HA ALA A 103 10.652 -4.193 -6.419 1.00 0.11 H new ATOM 0 HB1 ALA A 103 10.594 -4.435 -3.947 1.00 0.11 H new ATOM 0 HB2 ALA A 103 12.184 -4.880 -4.612 1.00 0.11 H new ATOM 0 HB3 ALA A 103 11.962 -3.304 -3.815 1.00 0.11 H new ATOM 1178 N ILE A 104 10.610 -1.173 -5.155 1.00 0.10 N ATOM 1179 CA ILE A 104 9.797 -0.025 -4.808 1.00 0.11 C ATOM 1180 C ILE A 104 9.171 0.582 -6.047 1.00 0.12 C ATOM 1181 O ILE A 104 8.005 0.973 -6.042 1.00 0.13 O ATOM 1182 CB ILE A 104 10.661 1.009 -4.075 1.00 0.11 C ATOM 1183 CG1 ILE A 104 11.078 0.450 -2.738 1.00 0.14 C ATOM 1184 CG2 ILE A 104 9.961 2.340 -3.875 1.00 0.15 C ATOM 1185 CD1 ILE A 104 11.692 1.490 -1.862 1.00 0.17 C ATOM 0 H ILE A 104 11.613 -1.006 -5.080 1.00 0.10 H new ATOM 0 HA ILE A 104 8.989 -0.346 -4.150 1.00 0.11 H new ATOM 0 HB ILE A 104 11.530 1.204 -4.703 1.00 0.11 H new ATOM 0 HG12 ILE A 104 10.209 0.022 -2.238 1.00 0.14 H new ATOM 0 HG13 ILE A 104 11.790 -0.361 -2.891 1.00 0.14 H new ATOM 0 HG21 ILE A 104 10.626 3.026 -3.351 1.00 0.15 H new ATOM 0 HG22 ILE A 104 9.696 2.761 -4.845 1.00 0.15 H new ATOM 0 HG23 ILE A 104 9.057 2.190 -3.285 1.00 0.15 H new ATOM 0 HD11 ILE A 104 11.977 1.042 -0.910 1.00 0.17 H new ATOM 0 HD12 ILE A 104 12.577 1.900 -2.349 1.00 0.17 H new ATOM 0 HD13 ILE A 104 10.972 2.289 -1.686 1.00 0.17 H new ATOM 1197 N ASP A 105 9.953 0.634 -7.110 1.00 0.13 N ATOM 1198 CA ASP A 105 9.451 1.074 -8.404 1.00 0.16 C ATOM 1199 C ASP A 105 8.326 0.164 -8.842 1.00 0.14 C ATOM 1200 O ASP A 105 7.270 0.611 -9.292 1.00 0.17 O ATOM 1201 CB ASP A 105 10.555 1.030 -9.444 1.00 0.21 C ATOM 1202 CG ASP A 105 10.072 1.477 -10.808 1.00 0.36 C ATOM 1203 OD1 ASP A 105 9.936 2.704 -11.019 1.00 0.53 O ATOM 1204 OD2 ASP A 105 9.833 0.609 -11.674 1.00 0.44 O ATOM 0 H ASP A 105 10.940 0.377 -7.105 1.00 0.13 H new ATOM 0 HA ASP A 105 9.091 2.098 -8.309 1.00 0.16 H new ATOM 0 HB2 ASP A 105 11.379 1.668 -9.125 1.00 0.21 H new ATOM 0 HB3 ASP A 105 10.947 0.015 -9.513 1.00 0.21 H new ATOM 1209 N LYS A 106 8.586 -1.124 -8.689 1.00 0.13 N ATOM 1210 CA LYS A 106 7.604 -2.163 -8.954 1.00 0.13 C ATOM 1211 C LYS A 106 6.328 -1.916 -8.148 1.00 0.12 C ATOM 1212 O LYS A 106 5.232 -1.895 -8.700 1.00 0.14 O ATOM 1213 CB LYS A 106 8.181 -3.531 -8.574 1.00 0.14 C ATOM 1214 CG LYS A 106 9.309 -4.007 -9.460 1.00 0.16 C ATOM 1215 CD LYS A 106 10.164 -5.049 -8.750 1.00 0.18 C ATOM 1216 CE LYS A 106 11.030 -5.822 -9.726 1.00 0.22 C ATOM 1217 NZ LYS A 106 12.009 -6.708 -9.039 1.00 0.29 N ATOM 0 H LYS A 106 9.489 -1.480 -8.376 1.00 0.13 H new ATOM 0 HA LYS A 106 7.363 -2.145 -10.017 1.00 0.13 H new ATOM 0 HB2 LYS A 106 8.539 -3.487 -7.545 1.00 0.14 H new ATOM 0 HB3 LYS A 106 7.379 -4.269 -8.601 1.00 0.14 H new ATOM 0 HG2 LYS A 106 8.900 -4.431 -10.377 1.00 0.16 H new ATOM 0 HG3 LYS A 106 9.930 -3.159 -9.750 1.00 0.16 H new ATOM 0 HD2 LYS A 106 10.797 -4.558 -8.011 1.00 0.18 H new ATOM 0 HD3 LYS A 106 9.519 -5.741 -8.208 1.00 0.18 H new ATOM 0 HE2 LYS A 106 10.393 -6.423 -10.375 1.00 0.22 H new ATOM 0 HE3 LYS A 106 11.566 -5.121 -10.366 1.00 0.22 H new ATOM 0 HZ1 LYS A 106 12.654 -7.123 -9.741 1.00 0.29 H new ATOM 0 HZ2 LYS A 106 12.557 -6.153 -8.351 1.00 0.29 H new ATOM 0 HZ3 LYS A 106 11.501 -7.468 -8.544 1.00 0.29 H new ATOM 1231 N LEU A 107 6.492 -1.701 -6.844 1.00 0.10 N ATOM 1232 CA LEU A 107 5.368 -1.493 -5.945 1.00 0.11 C ATOM 1233 C LEU A 107 4.599 -0.221 -6.295 1.00 0.10 C ATOM 1234 O LEU A 107 3.376 -0.250 -6.400 1.00 0.11 O ATOM 1235 CB LEU A 107 5.877 -1.471 -4.484 1.00 0.13 C ATOM 1236 CG LEU A 107 5.694 -0.165 -3.698 1.00 0.11 C ATOM 1237 CD1 LEU A 107 4.269 -0.016 -3.188 1.00 0.13 C ATOM 1238 CD2 LEU A 107 6.681 -0.105 -2.546 1.00 0.15 C ATOM 0 H LEU A 107 7.403 -1.667 -6.387 1.00 0.10 H new ATOM 0 HA LEU A 107 4.666 -2.319 -6.059 1.00 0.11 H new ATOM 0 HB2 LEU A 107 5.372 -2.268 -3.938 1.00 0.13 H new ATOM 0 HB3 LEU A 107 6.939 -1.714 -4.492 1.00 0.13 H new ATOM 0 HG LEU A 107 5.889 0.666 -4.376 1.00 0.11 H new ATOM 0 HD11 LEU A 107 4.176 0.919 -2.636 1.00 0.13 H new ATOM 0 HD12 LEU A 107 3.579 -0.010 -4.032 1.00 0.13 H new ATOM 0 HD13 LEU A 107 4.029 -0.851 -2.530 1.00 0.13 H new ATOM 0 HD21 LEU A 107 6.542 0.826 -1.996 1.00 0.15 H new ATOM 0 HD22 LEU A 107 6.513 -0.950 -1.878 1.00 0.15 H new ATOM 0 HD23 LEU A 107 7.698 -0.147 -2.936 1.00 0.15 H new ATOM 1250 N PHE A 108 5.310 0.875 -6.510 1.00 0.10 N ATOM 1251 CA PHE A 108 4.666 2.164 -6.751 1.00 0.11 C ATOM 1252 C PHE A 108 3.949 2.214 -8.096 1.00 0.12 C ATOM 1253 O PHE A 108 2.919 2.875 -8.228 1.00 0.14 O ATOM 1254 CB PHE A 108 5.670 3.309 -6.632 1.00 0.12 C ATOM 1255 CG PHE A 108 5.922 3.724 -5.207 1.00 0.12 C ATOM 1256 CD1 PHE A 108 4.968 3.521 -4.224 1.00 0.15 C ATOM 1257 CD2 PHE A 108 7.125 4.318 -4.853 1.00 0.17 C ATOM 1258 CE1 PHE A 108 5.212 3.899 -2.916 1.00 0.16 C ATOM 1259 CE2 PHE A 108 7.370 4.699 -3.552 1.00 0.17 C ATOM 1260 CZ PHE A 108 6.358 4.492 -2.573 1.00 0.14 C ATOM 0 H PHE A 108 6.330 0.902 -6.523 1.00 0.10 H new ATOM 0 HA PHE A 108 3.907 2.285 -5.978 1.00 0.11 H new ATOM 0 HB2 PHE A 108 6.613 3.008 -7.089 1.00 0.12 H new ATOM 0 HB3 PHE A 108 5.303 4.167 -7.195 1.00 0.12 H new ATOM 0 HD1 PHE A 108 4.024 3.063 -4.481 1.00 0.15 H new ATOM 0 HD2 PHE A 108 7.880 4.484 -5.608 1.00 0.17 H new ATOM 0 HE1 PHE A 108 4.464 3.711 -2.160 1.00 0.16 H new ATOM 0 HE2 PHE A 108 8.314 5.147 -3.280 1.00 0.17 H new ATOM 0 HZ PHE A 108 6.517 4.814 -1.554 1.00 0.14 H new ATOM 1270 N SER A 109 4.476 1.516 -9.086 1.00 0.13 N ATOM 1271 CA SER A 109 3.829 1.450 -10.387 1.00 0.14 C ATOM 1272 C SER A 109 2.551 0.615 -10.293 1.00 0.14 C ATOM 1273 O SER A 109 1.592 0.840 -11.033 1.00 0.16 O ATOM 1274 CB SER A 109 4.790 0.862 -11.421 1.00 0.17 C ATOM 1275 OG SER A 109 4.230 0.880 -12.722 1.00 1.14 O ATOM 0 H SER A 109 5.346 0.989 -9.016 1.00 0.13 H new ATOM 0 HA SER A 109 3.559 2.457 -10.705 1.00 0.14 H new ATOM 0 HB2 SER A 109 5.721 1.429 -11.417 1.00 0.17 H new ATOM 0 HB3 SER A 109 5.039 -0.163 -11.146 1.00 0.17 H new ATOM 0 HG SER A 109 4.870 0.499 -13.359 1.00 1.14 H new ATOM 1281 N MET A 110 2.538 -0.326 -9.351 1.00 0.13 N ATOM 1282 CA MET A 110 1.400 -1.226 -9.165 1.00 0.14 C ATOM 1283 C MET A 110 0.123 -0.483 -8.830 1.00 0.14 C ATOM 1284 O MET A 110 -0.899 -0.684 -9.482 1.00 0.16 O ATOM 1285 CB MET A 110 1.657 -2.190 -8.025 1.00 0.13 C ATOM 1286 CG MET A 110 2.648 -3.285 -8.309 1.00 0.17 C ATOM 1287 SD MET A 110 2.555 -4.548 -7.040 1.00 0.23 S ATOM 1288 CE MET A 110 2.241 -3.525 -5.608 1.00 0.14 C ATOM 0 H MET A 110 3.307 -0.486 -8.701 1.00 0.13 H new ATOM 0 HA MET A 110 1.283 -1.752 -10.113 1.00 0.14 H new ATOM 0 HB2 MET A 110 2.009 -1.621 -7.164 1.00 0.13 H new ATOM 0 HB3 MET A 110 0.710 -2.647 -7.739 1.00 0.13 H new ATOM 0 HG2 MET A 110 2.445 -3.725 -9.286 1.00 0.17 H new ATOM 0 HG3 MET A 110 3.656 -2.872 -8.348 1.00 0.17 H new ATOM 0 HE1 MET A 110 2.331 -4.127 -4.704 1.00 0.14 H new ATOM 0 HE2 MET A 110 2.966 -2.712 -5.576 1.00 0.14 H new ATOM 0 HE3 MET A 110 1.234 -3.111 -5.670 1.00 0.14 H new ATOM 1298 N LEU A 111 0.180 0.363 -7.800 1.00 0.14 N ATOM 1299 CA LEU A 111 -1.013 1.065 -7.345 1.00 0.15 C ATOM 1300 C LEU A 111 -1.561 1.870 -8.494 1.00 0.17 C ATOM 1301 O LEU A 111 -2.751 1.899 -8.750 1.00 0.18 O ATOM 1302 CB LEU A 111 -0.739 2.043 -6.190 1.00 0.17 C ATOM 1303 CG LEU A 111 0.177 1.580 -5.055 1.00 0.15 C ATOM 1304 CD1 LEU A 111 -0.016 0.106 -4.739 1.00 0.17 C ATOM 1305 CD2 LEU A 111 1.630 1.902 -5.372 1.00 0.15 C ATOM 0 H LEU A 111 1.028 0.574 -7.274 1.00 0.14 H new ATOM 0 HA LEU A 111 -1.710 0.307 -6.988 1.00 0.15 H new ATOM 0 HB2 LEU A 111 -0.310 2.950 -6.616 1.00 0.17 H new ATOM 0 HB3 LEU A 111 -1.698 2.319 -5.752 1.00 0.17 H new ATOM 0 HG LEU A 111 -0.101 2.132 -4.157 1.00 0.15 H new ATOM 0 HD11 LEU A 111 0.653 -0.183 -3.928 1.00 0.17 H new ATOM 0 HD12 LEU A 111 -1.049 -0.069 -4.438 1.00 0.17 H new ATOM 0 HD13 LEU A 111 0.210 -0.488 -5.624 1.00 0.17 H new ATOM 0 HD21 LEU A 111 2.265 1.565 -4.552 1.00 0.15 H new ATOM 0 HD22 LEU A 111 1.923 1.394 -6.291 1.00 0.15 H new ATOM 0 HD23 LEU A 111 1.745 2.978 -5.500 1.00 0.15 H new ATOM 1317 N LYS A 112 -0.640 2.488 -9.204 1.00 0.19 N ATOM 1318 CA LYS A 112 -0.959 3.391 -10.284 1.00 0.22 C ATOM 1319 C LYS A 112 -1.582 2.651 -11.462 1.00 0.21 C ATOM 1320 O LYS A 112 -2.298 3.246 -12.264 1.00 0.24 O ATOM 1321 CB LYS A 112 0.317 4.111 -10.696 1.00 0.29 C ATOM 1322 CG LYS A 112 0.782 5.122 -9.663 1.00 0.36 C ATOM 1323 CD LYS A 112 2.114 5.746 -10.033 1.00 0.47 C ATOM 1324 CE LYS A 112 1.991 6.592 -11.284 1.00 1.22 C ATOM 1325 NZ LYS A 112 2.459 5.871 -12.499 1.00 1.82 N ATOM 0 H LYS A 112 0.361 2.375 -9.044 1.00 0.19 H new ATOM 0 HA LYS A 112 -1.699 4.117 -9.948 1.00 0.22 H new ATOM 0 HB2 LYS A 112 1.106 3.377 -10.860 1.00 0.29 H new ATOM 0 HB3 LYS A 112 0.151 4.619 -11.646 1.00 0.29 H new ATOM 0 HG2 LYS A 112 0.031 5.906 -9.560 1.00 0.36 H new ATOM 0 HG3 LYS A 112 0.868 4.634 -8.692 1.00 0.36 H new ATOM 0 HD2 LYS A 112 2.473 6.361 -9.208 1.00 0.47 H new ATOM 0 HD3 LYS A 112 2.855 4.962 -10.192 1.00 0.47 H new ATOM 0 HE2 LYS A 112 0.951 6.890 -11.418 1.00 1.22 H new ATOM 0 HE3 LYS A 112 2.571 7.507 -11.160 1.00 1.22 H new ATOM 0 HZ1 LYS A 112 1.968 6.246 -13.336 1.00 1.82 H new ATOM 0 HZ2 LYS A 112 3.484 6.006 -12.610 1.00 1.82 H new ATOM 0 HZ3 LYS A 112 2.252 4.856 -12.402 1.00 1.82 H new ATOM 1339 N ASP A 113 -1.316 1.354 -11.559 1.00 0.20 N ATOM 1340 CA ASP A 113 -1.936 0.534 -12.588 1.00 0.22 C ATOM 1341 C ASP A 113 -3.280 0.042 -12.093 1.00 0.21 C ATOM 1342 O ASP A 113 -4.160 -0.353 -12.859 1.00 0.24 O ATOM 1343 CB ASP A 113 -1.049 -0.658 -12.895 1.00 0.25 C ATOM 1344 CG ASP A 113 -1.538 -1.451 -14.093 1.00 0.35 C ATOM 1345 OD1 ASP A 113 -1.634 -0.880 -15.198 1.00 0.51 O ATOM 1346 OD2 ASP A 113 -1.832 -2.655 -13.936 1.00 0.46 O ATOM 0 H ASP A 113 -0.679 0.851 -10.941 1.00 0.20 H new ATOM 0 HA ASP A 113 -2.070 1.128 -13.492 1.00 0.22 H new ATOM 0 HB2 ASP A 113 -0.032 -0.312 -13.082 1.00 0.25 H new ATOM 0 HB3 ASP A 113 -1.008 -1.311 -12.023 1.00 0.25 H new ATOM 1351 N GLY A 114 -3.414 0.091 -10.788 1.00 0.18 N ATOM 1352 CA GLY A 114 -4.638 -0.297 -10.135 1.00 0.17 C ATOM 1353 C GLY A 114 -4.448 -1.525 -9.274 1.00 0.15 C ATOM 1354 O GLY A 114 -4.586 -2.653 -9.745 1.00 0.18 O ATOM 0 H GLY A 114 -2.679 0.400 -10.152 1.00 0.18 H new ATOM 0 HA2 GLY A 114 -4.999 0.527 -9.519 1.00 0.17 H new ATOM 0 HA3 GLY A 114 -5.404 -0.494 -10.885 1.00 0.17 H new ATOM 1358 N VAL A 115 -4.122 -1.307 -8.015 1.00 0.14 N ATOM 1359 CA VAL A 115 -3.908 -2.398 -7.089 1.00 0.12 C ATOM 1360 C VAL A 115 -5.134 -2.538 -6.203 1.00 0.12 C ATOM 1361 O VAL A 115 -5.648 -1.557 -5.680 1.00 0.13 O ATOM 1362 CB VAL A 115 -2.625 -2.189 -6.234 1.00 0.12 C ATOM 1363 CG1 VAL A 115 -2.930 -1.935 -4.767 1.00 0.12 C ATOM 1364 CG2 VAL A 115 -1.689 -3.362 -6.396 1.00 0.14 C ATOM 0 H VAL A 115 -3.999 -0.379 -7.610 1.00 0.14 H new ATOM 0 HA VAL A 115 -3.758 -3.316 -7.657 1.00 0.12 H new ATOM 0 HB VAL A 115 -2.135 -1.289 -6.607 1.00 0.12 H new ATOM 0 HG11 VAL A 115 -1.997 -1.797 -4.220 1.00 0.12 H new ATOM 0 HG12 VAL A 115 -3.542 -1.038 -4.673 1.00 0.12 H new ATOM 0 HG13 VAL A 115 -3.469 -2.788 -4.355 1.00 0.12 H new ATOM 0 HG21 VAL A 115 -0.796 -3.201 -5.792 1.00 0.14 H new ATOM 0 HG22 VAL A 115 -2.189 -4.274 -6.069 1.00 0.14 H new ATOM 0 HG23 VAL A 115 -1.405 -3.459 -7.444 1.00 0.14 H new ATOM 1374 N VAL A 116 -5.631 -3.742 -6.070 1.00 0.12 N ATOM 1375 CA VAL A 116 -6.802 -3.962 -5.258 1.00 0.13 C ATOM 1376 C VAL A 116 -6.427 -4.592 -3.929 1.00 0.10 C ATOM 1377 O VAL A 116 -5.698 -5.585 -3.871 1.00 0.15 O ATOM 1378 CB VAL A 116 -7.851 -4.818 -5.993 1.00 0.19 C ATOM 1379 CG1 VAL A 116 -7.256 -6.117 -6.485 1.00 0.22 C ATOM 1380 CG2 VAL A 116 -9.062 -5.078 -5.109 1.00 0.23 C ATOM 0 H VAL A 116 -5.247 -4.579 -6.509 1.00 0.12 H new ATOM 0 HA VAL A 116 -7.252 -2.989 -5.062 1.00 0.13 H new ATOM 0 HB VAL A 116 -8.183 -4.253 -6.864 1.00 0.19 H new ATOM 0 HG11 VAL A 116 -8.023 -6.697 -6.999 1.00 0.22 H new ATOM 0 HG12 VAL A 116 -6.439 -5.905 -7.174 1.00 0.22 H new ATOM 0 HG13 VAL A 116 -6.877 -6.688 -5.637 1.00 0.22 H new ATOM 0 HG21 VAL A 116 -9.786 -5.684 -5.653 1.00 0.23 H new ATOM 0 HG22 VAL A 116 -8.749 -5.607 -4.209 1.00 0.23 H new ATOM 0 HG23 VAL A 116 -9.520 -4.129 -4.831 1.00 0.23 H new ATOM 1390 N LEU A 117 -6.893 -3.963 -2.868 1.00 0.11 N ATOM 1391 CA LEU A 117 -6.696 -4.453 -1.521 1.00 0.11 C ATOM 1392 C LEU A 117 -7.698 -5.580 -1.270 1.00 0.12 C ATOM 1393 O LEU A 117 -8.897 -5.379 -1.450 1.00 0.16 O ATOM 1394 CB LEU A 117 -6.869 -3.289 -0.533 1.00 0.15 C ATOM 1395 CG LEU A 117 -5.675 -2.309 -0.414 1.00 0.13 C ATOM 1396 CD1 LEU A 117 -4.822 -2.277 -1.674 1.00 0.26 C ATOM 1397 CD2 LEU A 117 -6.167 -0.901 -0.109 1.00 0.24 C ATOM 0 H LEU A 117 -7.422 -3.092 -2.918 1.00 0.11 H new ATOM 0 HA LEU A 117 -5.691 -4.852 -1.383 1.00 0.11 H new ATOM 0 HB2 LEU A 117 -7.751 -2.720 -0.825 1.00 0.15 H new ATOM 0 HB3 LEU A 117 -7.071 -3.705 0.454 1.00 0.15 H new ATOM 0 HG LEU A 117 -5.055 -2.673 0.405 1.00 0.13 H new ATOM 0 HD11 LEU A 117 -3.999 -1.575 -1.539 1.00 0.26 H new ATOM 0 HD12 LEU A 117 -4.422 -3.272 -1.868 1.00 0.26 H new ATOM 0 HD13 LEU A 117 -5.433 -1.961 -2.519 1.00 0.26 H new ATOM 0 HD21 LEU A 117 -5.314 -0.227 -0.029 1.00 0.24 H new ATOM 0 HD22 LEU A 117 -6.823 -0.563 -0.911 1.00 0.24 H new ATOM 0 HD23 LEU A 117 -6.717 -0.904 0.832 1.00 0.24 H new ATOM 1409 N LYS A 118 -7.189 -6.762 -0.886 1.00 0.14 N ATOM 1410 CA LYS A 118 -7.954 -8.016 -0.841 1.00 0.18 C ATOM 1411 C LYS A 118 -6.993 -9.179 -1.037 1.00 0.22 C ATOM 1412 O LYS A 118 -6.050 -9.083 -1.822 1.00 0.27 O ATOM 1413 CB LYS A 118 -9.041 -8.096 -1.930 1.00 0.20 C ATOM 1414 CG LYS A 118 -10.449 -7.812 -1.417 1.00 0.19 C ATOM 1415 CD LYS A 118 -11.502 -8.033 -2.488 1.00 0.34 C ATOM 1416 CE LYS A 118 -11.474 -6.953 -3.550 1.00 0.39 C ATOM 1417 NZ LYS A 118 -12.214 -7.356 -4.778 1.00 0.80 N ATOM 0 H LYS A 118 -6.218 -6.873 -0.594 1.00 0.14 H new ATOM 0 HA LYS A 118 -8.453 -8.057 0.127 1.00 0.18 H new ATOM 0 HB2 LYS A 118 -8.802 -7.385 -2.721 1.00 0.20 H new ATOM 0 HB3 LYS A 118 -9.021 -9.090 -2.378 1.00 0.20 H new ATOM 0 HG2 LYS A 118 -10.660 -8.456 -0.563 1.00 0.19 H new ATOM 0 HG3 LYS A 118 -10.504 -6.783 -1.062 1.00 0.19 H new ATOM 0 HD2 LYS A 118 -11.343 -9.005 -2.956 1.00 0.34 H new ATOM 0 HD3 LYS A 118 -12.488 -8.059 -2.025 1.00 0.34 H new ATOM 0 HE2 LYS A 118 -11.910 -6.038 -3.148 1.00 0.39 H new ATOM 0 HE3 LYS A 118 -10.440 -6.726 -3.809 1.00 0.39 H new ATOM 0 HZ1 LYS A 118 -12.213 -6.569 -5.458 1.00 0.80 H new ATOM 0 HZ2 LYS A 118 -11.752 -8.184 -5.206 1.00 0.80 H new ATOM 0 HZ3 LYS A 118 -13.195 -7.597 -4.529 1.00 0.80 H new ATOM 1431 N GLY A 119 -7.221 -10.266 -0.328 1.00 0.31 N ATOM 1432 CA GLY A 119 -6.385 -11.434 -0.488 1.00 0.38 C ATOM 1433 C GLY A 119 -7.193 -12.709 -0.525 1.00 0.53 C ATOM 1434 O GLY A 119 -8.312 -12.722 -1.037 1.00 0.85 O ATOM 0 H GLY A 119 -7.970 -10.363 0.357 1.00 0.31 H new ATOM 0 HA2 GLY A 119 -5.809 -11.344 -1.409 1.00 0.38 H new ATOM 0 HA3 GLY A 119 -5.669 -11.482 0.333 1.00 0.38 H new ATOM 1438 N ASN A 120 -6.635 -13.777 0.022 1.00 0.81 N ATOM 1439 CA ASN A 120 -7.317 -15.062 0.046 1.00 1.02 C ATOM 1440 C ASN A 120 -8.151 -15.177 1.316 1.00 1.10 C ATOM 1441 O ASN A 120 -9.307 -14.753 1.347 1.00 1.88 O ATOM 1442 CB ASN A 120 -6.316 -16.226 -0.049 1.00 1.16 C ATOM 1443 CG ASN A 120 -5.439 -16.158 -1.290 1.00 1.84 C ATOM 1444 OD1 ASN A 120 -5.090 -15.079 -1.768 1.00 2.57 O ATOM 1445 ND2 ASN A 120 -5.077 -17.312 -1.821 1.00 2.43 N ATOM 0 H ASN A 120 -5.712 -13.780 0.455 1.00 0.81 H new ATOM 0 HA ASN A 120 -7.974 -15.121 -0.822 1.00 1.02 H new ATOM 0 HB2 ASN A 120 -5.682 -16.225 0.837 1.00 1.16 H new ATOM 0 HB3 ASN A 120 -6.863 -17.169 -0.049 1.00 1.16 H new ATOM 0 HD21 ASN A 120 -4.489 -17.328 -2.654 1.00 2.43 H new ATOM 0 HD22 ASN A 120 -5.385 -18.187 -1.398 1.00 2.43 H new ATOM 1452 N LYS A 121 -7.558 -15.703 2.379 1.00 1.04 N ATOM 1453 CA LYS A 121 -8.262 -15.818 3.646 1.00 1.09 C ATOM 1454 C LYS A 121 -7.671 -14.848 4.662 1.00 0.92 C ATOM 1455 O LYS A 121 -6.745 -15.185 5.400 1.00 1.18 O ATOM 1456 CB LYS A 121 -8.205 -17.253 4.180 1.00 1.36 C ATOM 1457 CG LYS A 121 -9.138 -17.493 5.357 1.00 2.03 C ATOM 1458 CD LYS A 121 -10.586 -17.260 4.962 1.00 2.73 C ATOM 1459 CE LYS A 121 -11.507 -17.267 6.169 1.00 3.45 C ATOM 1460 NZ LYS A 121 -12.924 -17.032 5.785 1.00 4.18 N ATOM 0 H LYS A 121 -6.600 -16.053 2.389 1.00 1.04 H new ATOM 0 HA LYS A 121 -9.309 -15.564 3.480 1.00 1.09 H new ATOM 0 HB2 LYS A 121 -8.460 -17.943 3.376 1.00 1.36 H new ATOM 0 HB3 LYS A 121 -7.183 -17.481 4.483 1.00 1.36 H new ATOM 0 HG2 LYS A 121 -9.016 -18.514 5.720 1.00 2.03 H new ATOM 0 HG3 LYS A 121 -8.870 -16.829 6.179 1.00 2.03 H new ATOM 0 HD2 LYS A 121 -10.672 -16.305 4.444 1.00 2.73 H new ATOM 0 HD3 LYS A 121 -10.900 -18.033 4.260 1.00 2.73 H new ATOM 0 HE2 LYS A 121 -11.424 -18.224 6.684 1.00 3.45 H new ATOM 0 HE3 LYS A 121 -11.189 -16.498 6.873 1.00 3.45 H new ATOM 0 HZ1 LYS A 121 -13.521 -17.044 6.636 1.00 4.18 H new ATOM 0 HZ2 LYS A 121 -13.008 -16.107 5.316 1.00 4.18 H new ATOM 0 HZ3 LYS A 121 -13.236 -17.780 5.133 1.00 4.18 H new ATOM 1474 N ILE A 122 -8.198 -13.637 4.669 1.00 0.77 N ATOM 1475 CA ILE A 122 -7.770 -12.612 5.605 1.00 0.69 C ATOM 1476 C ILE A 122 -8.990 -11.785 6.017 1.00 0.99 C ATOM 1477 O ILE A 122 -10.065 -11.951 5.437 1.00 1.44 O ATOM 1478 CB ILE A 122 -6.662 -11.709 4.979 1.00 0.74 C ATOM 1479 CG1 ILE A 122 -6.008 -10.822 6.042 1.00 1.04 C ATOM 1480 CG2 ILE A 122 -7.210 -10.855 3.835 1.00 0.55 C ATOM 1481 CD1 ILE A 122 -5.280 -11.601 7.117 1.00 1.60 C ATOM 0 H ILE A 122 -8.933 -13.336 4.028 1.00 0.77 H new ATOM 0 HA ILE A 122 -7.336 -13.082 6.488 1.00 0.69 H new ATOM 0 HB ILE A 122 -5.901 -12.372 4.567 1.00 0.74 H new ATOM 0 HG12 ILE A 122 -5.305 -10.145 5.556 1.00 1.04 H new ATOM 0 HG13 ILE A 122 -6.775 -10.204 6.509 1.00 1.04 H new ATOM 0 HG21 ILE A 122 -6.409 -10.240 3.424 1.00 0.55 H new ATOM 0 HG22 ILE A 122 -7.606 -11.504 3.054 1.00 0.55 H new ATOM 0 HG23 ILE A 122 -8.006 -10.212 4.210 1.00 0.55 H new ATOM 0 HD11 ILE A 122 -4.842 -10.908 7.835 1.00 1.60 H new ATOM 0 HD12 ILE A 122 -5.983 -12.258 7.629 1.00 1.60 H new ATOM 0 HD13 ILE A 122 -4.490 -12.199 6.662 1.00 1.60 H new ATOM 1493 N ASN A 123 -8.850 -10.958 7.049 1.00 1.13 N ATOM 1494 CA ASN A 123 -9.908 -10.021 7.438 1.00 1.52 C ATOM 1495 C ASN A 123 -9.360 -9.018 8.447 1.00 1.43 C ATOM 1496 O ASN A 123 -10.092 -8.434 9.249 1.00 2.17 O ATOM 1497 CB ASN A 123 -11.114 -10.773 8.015 1.00 1.98 C ATOM 1498 CG ASN A 123 -12.377 -9.931 8.040 1.00 2.54 C ATOM 1499 OD1 ASN A 123 -12.702 -9.292 9.042 1.00 2.76 O ATOM 1500 ND2 ASN A 123 -13.100 -9.921 6.931 1.00 3.41 N ATOM 0 H ASN A 123 -8.015 -10.915 7.633 1.00 1.13 H new ATOM 0 HA ASN A 123 -10.246 -9.481 6.553 1.00 1.52 H new ATOM 0 HB2 ASN A 123 -11.293 -11.671 7.423 1.00 1.98 H new ATOM 0 HB3 ASN A 123 -10.881 -11.100 9.028 1.00 1.98 H new ATOM 0 HD21 ASN A 123 -13.958 -9.371 6.887 1.00 3.41 H new ATOM 0 HD22 ASN A 123 -12.799 -10.463 6.121 1.00 3.41 H new ATOM 1507 N ASP A 124 -8.057 -8.818 8.391 1.00 0.91 N ATOM 1508 CA ASP A 124 -7.367 -7.959 9.341 1.00 0.83 C ATOM 1509 C ASP A 124 -6.267 -7.214 8.616 1.00 0.67 C ATOM 1510 O ASP A 124 -6.168 -5.987 8.680 1.00 0.85 O ATOM 1511 CB ASP A 124 -6.751 -8.783 10.483 1.00 1.15 C ATOM 1512 CG ASP A 124 -7.729 -9.747 11.131 1.00 1.69 C ATOM 1513 OD1 ASP A 124 -8.405 -9.361 12.104 1.00 2.09 O ATOM 1514 OD2 ASP A 124 -7.809 -10.908 10.675 1.00 2.29 O ATOM 0 H ASP A 124 -7.448 -9.242 7.691 1.00 0.91 H new ATOM 0 HA ASP A 124 -8.086 -7.261 9.769 1.00 0.83 H new ATOM 0 HB2 ASP A 124 -5.901 -9.345 10.097 1.00 1.15 H new ATOM 0 HB3 ASP A 124 -6.365 -8.104 11.243 1.00 1.15 H new ATOM 1519 N THR A 125 -5.452 -7.977 7.915 1.00 0.54 N ATOM 1520 CA THR A 125 -4.356 -7.438 7.143 1.00 0.40 C ATOM 1521 C THR A 125 -4.822 -7.000 5.752 1.00 0.29 C ATOM 1522 O THR A 125 -5.677 -7.643 5.137 1.00 0.34 O ATOM 1523 CB THR A 125 -3.241 -8.490 7.007 1.00 0.39 C ATOM 1524 OG1 THR A 125 -2.837 -8.949 8.304 1.00 0.51 O ATOM 1525 CG2 THR A 125 -2.051 -7.914 6.273 1.00 0.37 C ATOM 0 H THR A 125 -5.534 -8.993 7.866 1.00 0.54 H new ATOM 0 HA THR A 125 -3.972 -6.563 7.668 1.00 0.40 H new ATOM 0 HB THR A 125 -3.630 -9.331 6.433 1.00 0.39 H new ATOM 0 HG1 THR A 125 -2.228 -9.710 8.206 1.00 0.51 H new ATOM 0 HG21 THR A 125 -1.274 -8.673 6.187 1.00 0.37 H new ATOM 0 HG22 THR A 125 -2.358 -7.595 5.277 1.00 0.37 H new ATOM 0 HG23 THR A 125 -1.663 -7.058 6.825 1.00 0.37 H new ATOM 1533 N ILE A 126 -4.257 -5.901 5.264 1.00 0.22 N ATOM 1534 CA ILE A 126 -4.589 -5.395 3.941 1.00 0.15 C ATOM 1535 C ILE A 126 -3.637 -6.009 2.922 1.00 0.14 C ATOM 1536 O ILE A 126 -2.433 -6.028 3.140 1.00 0.19 O ATOM 1537 CB ILE A 126 -4.482 -3.855 3.874 1.00 0.13 C ATOM 1538 CG1 ILE A 126 -4.967 -3.232 5.192 1.00 0.16 C ATOM 1539 CG2 ILE A 126 -5.298 -3.332 2.705 1.00 0.12 C ATOM 1540 CD1 ILE A 126 -4.981 -1.711 5.210 1.00 0.16 C ATOM 0 H ILE A 126 -3.566 -5.344 5.767 1.00 0.22 H new ATOM 0 HA ILE A 126 -5.620 -5.670 3.720 1.00 0.15 H new ATOM 0 HB ILE A 126 -3.439 -3.576 3.725 1.00 0.13 H new ATOM 0 HG12 ILE A 126 -5.974 -3.593 5.400 1.00 0.16 H new ATOM 0 HG13 ILE A 126 -4.328 -3.585 6.002 1.00 0.16 H new ATOM 0 HG21 ILE A 126 -5.219 -2.246 2.663 1.00 0.12 H new ATOM 0 HG22 ILE A 126 -4.919 -3.760 1.777 1.00 0.12 H new ATOM 0 HG23 ILE A 126 -6.343 -3.615 2.835 1.00 0.12 H new ATOM 0 HD11 ILE A 126 -5.337 -1.362 6.179 1.00 0.16 H new ATOM 0 HD12 ILE A 126 -3.972 -1.336 5.037 1.00 0.16 H new ATOM 0 HD13 ILE A 126 -5.644 -1.344 4.426 1.00 0.16 H new ATOM 1552 N LEU A 127 -4.158 -6.522 1.822 1.00 0.12 N ATOM 1553 CA LEU A 127 -3.311 -7.209 0.857 1.00 0.12 C ATOM 1554 C LEU A 127 -3.380 -6.525 -0.502 1.00 0.11 C ATOM 1555 O LEU A 127 -4.446 -6.117 -0.943 1.00 0.12 O ATOM 1556 CB LEU A 127 -3.708 -8.687 0.770 1.00 0.15 C ATOM 1557 CG LEU A 127 -3.850 -9.374 2.129 1.00 0.19 C ATOM 1558 CD1 LEU A 127 -4.353 -10.800 1.980 1.00 0.26 C ATOM 1559 CD2 LEU A 127 -2.521 -9.350 2.849 1.00 0.20 C ATOM 0 H LEU A 127 -5.147 -6.479 1.575 1.00 0.12 H new ATOM 0 HA LEU A 127 -2.275 -7.158 1.192 1.00 0.12 H new ATOM 0 HB2 LEU A 127 -4.653 -8.768 0.233 1.00 0.15 H new ATOM 0 HB3 LEU A 127 -2.961 -9.219 0.182 1.00 0.15 H new ATOM 0 HG LEU A 127 -4.588 -8.829 2.717 1.00 0.19 H new ATOM 0 HD11 LEU A 127 -4.442 -11.259 2.965 1.00 0.26 H new ATOM 0 HD12 LEU A 127 -5.328 -10.793 1.493 1.00 0.26 H new ATOM 0 HD13 LEU A 127 -3.650 -11.373 1.375 1.00 0.26 H new ATOM 0 HD21 LEU A 127 -2.623 -9.840 3.817 1.00 0.20 H new ATOM 0 HD22 LEU A 127 -1.775 -9.876 2.253 1.00 0.20 H new ATOM 0 HD23 LEU A 127 -2.206 -8.317 2.996 1.00 0.20 H new ATOM 1571 N ILE A 128 -2.229 -6.405 -1.145 1.00 0.11 N ATOM 1572 CA ILE A 128 -2.081 -5.618 -2.374 1.00 0.11 C ATOM 1573 C ILE A 128 -1.918 -6.519 -3.604 1.00 0.13 C ATOM 1574 O ILE A 128 -0.929 -7.251 -3.721 1.00 0.15 O ATOM 1575 CB ILE A 128 -0.850 -4.689 -2.269 1.00 0.10 C ATOM 1576 CG1 ILE A 128 -1.005 -3.697 -1.120 1.00 0.12 C ATOM 1577 CG2 ILE A 128 -0.599 -3.954 -3.570 1.00 0.11 C ATOM 1578 CD1 ILE A 128 0.159 -2.741 -0.992 1.00 0.12 C ATOM 0 H ILE A 128 -1.365 -6.849 -0.834 1.00 0.11 H new ATOM 0 HA ILE A 128 -2.989 -5.026 -2.491 1.00 0.11 H new ATOM 0 HB ILE A 128 0.015 -5.320 -2.064 1.00 0.10 H new ATOM 0 HG12 ILE A 128 -1.921 -3.125 -1.265 1.00 0.12 H new ATOM 0 HG13 ILE A 128 -1.117 -4.248 -0.186 1.00 0.12 H new ATOM 0 HG21 ILE A 128 0.273 -3.310 -3.461 1.00 0.11 H new ATOM 0 HG22 ILE A 128 -0.420 -4.676 -4.367 1.00 0.11 H new ATOM 0 HG23 ILE A 128 -1.470 -3.347 -3.819 1.00 0.11 H new ATOM 0 HD11 ILE A 128 -0.016 -2.064 -0.156 1.00 0.12 H new ATOM 0 HD12 ILE A 128 1.075 -3.305 -0.816 1.00 0.12 H new ATOM 0 HD13 ILE A 128 0.259 -2.164 -1.911 1.00 0.12 H new ATOM 1590 N GLU A 129 -2.862 -6.433 -4.539 1.00 0.15 N ATOM 1591 CA GLU A 129 -2.873 -7.303 -5.697 1.00 0.19 C ATOM 1592 C GLU A 129 -3.121 -6.518 -6.990 1.00 0.17 C ATOM 1593 O GLU A 129 -3.985 -5.642 -7.049 1.00 0.19 O ATOM 1594 CB GLU A 129 -3.961 -8.360 -5.513 1.00 0.27 C ATOM 1595 CG GLU A 129 -4.537 -8.844 -6.823 1.00 0.34 C ATOM 1596 CD GLU A 129 -5.550 -9.955 -6.656 1.00 0.80 C ATOM 1597 OE1 GLU A 129 -5.189 -11.019 -6.116 1.00 1.62 O ATOM 1598 OE2 GLU A 129 -6.718 -9.763 -7.052 1.00 0.71 O ATOM 0 H GLU A 129 -3.631 -5.763 -4.510 1.00 0.15 H new ATOM 0 HA GLU A 129 -1.896 -7.778 -5.783 1.00 0.19 H new ATOM 0 HB2 GLU A 129 -3.548 -9.209 -4.968 1.00 0.27 H new ATOM 0 HB3 GLU A 129 -4.762 -7.947 -4.900 1.00 0.27 H new ATOM 0 HG2 GLU A 129 -5.008 -8.006 -7.337 1.00 0.34 H new ATOM 0 HG3 GLU A 129 -3.726 -9.194 -7.462 1.00 0.34 H new ATOM 1605 N LYS A 130 -2.362 -6.854 -8.023 1.00 0.18 N ATOM 1606 CA LYS A 130 -2.561 -6.314 -9.365 1.00 0.21 C ATOM 1607 C LYS A 130 -1.877 -7.240 -10.359 1.00 0.29 C ATOM 1608 O LYS A 130 -0.943 -7.943 -9.985 1.00 0.31 O ATOM 1609 CB LYS A 130 -2.105 -4.836 -9.502 1.00 0.16 C ATOM 1610 CG LYS A 130 -0.608 -4.550 -9.354 1.00 0.19 C ATOM 1611 CD LYS A 130 0.175 -4.856 -10.612 1.00 0.25 C ATOM 1612 CE LYS A 130 -0.139 -3.849 -11.697 1.00 0.25 C ATOM 1613 NZ LYS A 130 0.560 -4.156 -12.972 1.00 0.39 N ATOM 0 H LYS A 130 -1.586 -7.512 -7.956 1.00 0.18 H new ATOM 0 HA LYS A 130 -3.629 -6.281 -9.580 1.00 0.21 H new ATOM 0 HB2 LYS A 130 -2.423 -4.473 -10.479 1.00 0.16 H new ATOM 0 HB3 LYS A 130 -2.637 -4.247 -8.755 1.00 0.16 H new ATOM 0 HG2 LYS A 130 -0.467 -3.502 -9.090 1.00 0.19 H new ATOM 0 HG3 LYS A 130 -0.209 -5.142 -8.530 1.00 0.19 H new ATOM 0 HD2 LYS A 130 1.243 -4.842 -10.394 1.00 0.25 H new ATOM 0 HD3 LYS A 130 -0.066 -5.860 -10.961 1.00 0.25 H new ATOM 0 HE2 LYS A 130 -1.215 -3.829 -11.871 1.00 0.25 H new ATOM 0 HE3 LYS A 130 0.147 -2.853 -11.359 1.00 0.25 H new ATOM 0 HZ1 LYS A 130 0.555 -3.314 -13.582 1.00 0.39 H new ATOM 0 HZ2 LYS A 130 1.542 -4.432 -12.772 1.00 0.39 H new ATOM 0 HZ3 LYS A 130 0.073 -4.937 -13.456 1.00 0.39 H new ATOM 1627 N ASP A 131 -2.389 -7.273 -11.590 1.00 0.38 N ATOM 1628 CA ASP A 131 -1.978 -8.241 -12.627 1.00 0.49 C ATOM 1629 C ASP A 131 -2.739 -9.542 -12.453 1.00 0.47 C ATOM 1630 O ASP A 131 -2.573 -10.479 -13.230 1.00 0.52 O ATOM 1631 CB ASP A 131 -0.466 -8.550 -12.640 1.00 0.55 C ATOM 1632 CG ASP A 131 0.406 -7.344 -12.904 1.00 0.76 C ATOM 1633 OD1 ASP A 131 0.153 -6.629 -13.898 1.00 1.03 O ATOM 1634 OD2 ASP A 131 1.350 -7.100 -12.124 1.00 1.13 O ATOM 0 H ASP A 131 -3.110 -6.624 -11.906 1.00 0.38 H new ATOM 0 HA ASP A 131 -2.214 -7.767 -13.580 1.00 0.49 H new ATOM 0 HB2 ASP A 131 -0.186 -8.985 -11.680 1.00 0.55 H new ATOM 0 HB3 ASP A 131 -0.266 -9.304 -13.402 1.00 0.55 H new ATOM 1639 N GLY A 132 -3.575 -9.592 -11.431 1.00 0.48 N ATOM 1640 CA GLY A 132 -4.360 -10.783 -11.173 1.00 0.51 C ATOM 1641 C GLY A 132 -3.795 -11.618 -10.041 1.00 0.45 C ATOM 1642 O GLY A 132 -4.261 -12.729 -9.790 1.00 0.52 O ATOM 0 H GLY A 132 -3.726 -8.828 -10.772 1.00 0.48 H new ATOM 0 HA2 GLY A 132 -5.383 -10.494 -10.932 1.00 0.51 H new ATOM 0 HA3 GLY A 132 -4.405 -11.388 -12.079 1.00 0.51 H new ATOM 1646 N GLU A 133 -2.784 -11.092 -9.363 1.00 0.47 N ATOM 1647 CA GLU A 133 -2.180 -11.780 -8.230 1.00 0.45 C ATOM 1648 C GLU A 133 -1.699 -10.774 -7.202 1.00 0.33 C ATOM 1649 O GLU A 133 -1.390 -9.626 -7.532 1.00 0.30 O ATOM 1650 CB GLU A 133 -1.005 -12.658 -8.663 1.00 0.54 C ATOM 1651 CG GLU A 133 0.240 -11.869 -9.009 1.00 0.56 C ATOM 1652 CD GLU A 133 1.324 -12.717 -9.640 1.00 0.76 C ATOM 1653 OE1 GLU A 133 1.159 -13.130 -10.808 1.00 1.31 O ATOM 1654 OE2 GLU A 133 2.352 -12.972 -8.975 1.00 1.24 O ATOM 0 H GLU A 133 -2.364 -10.188 -9.579 1.00 0.47 H new ATOM 0 HA GLU A 133 -2.946 -12.421 -7.793 1.00 0.45 H new ATOM 0 HB2 GLU A 133 -0.771 -13.359 -7.862 1.00 0.54 H new ATOM 0 HB3 GLU A 133 -1.303 -13.250 -9.528 1.00 0.54 H new ATOM 0 HG2 GLU A 133 -0.026 -11.063 -9.692 1.00 0.56 H new ATOM 0 HG3 GLU A 133 0.631 -11.404 -8.104 1.00 0.56 H new ATOM 1661 N VAL A 134 -1.681 -11.202 -5.960 1.00 0.32 N ATOM 1662 CA VAL A 134 -1.167 -10.385 -4.872 1.00 0.24 C ATOM 1663 C VAL A 134 0.352 -10.473 -4.838 1.00 0.22 C ATOM 1664 O VAL A 134 0.930 -11.555 -4.929 1.00 0.27 O ATOM 1665 CB VAL A 134 -1.755 -10.800 -3.502 1.00 0.24 C ATOM 1666 CG1 VAL A 134 -1.552 -12.274 -3.270 1.00 0.26 C ATOM 1667 CG2 VAL A 134 -1.154 -9.984 -2.370 1.00 0.21 C ATOM 0 H VAL A 134 -2.019 -12.120 -5.671 1.00 0.32 H new ATOM 0 HA VAL A 134 -1.474 -9.356 -5.057 1.00 0.24 H new ATOM 0 HB VAL A 134 -2.826 -10.596 -3.518 1.00 0.24 H new ATOM 0 HG11 VAL A 134 -1.971 -12.551 -2.303 1.00 0.26 H new ATOM 0 HG12 VAL A 134 -2.052 -12.838 -4.057 1.00 0.26 H new ATOM 0 HG13 VAL A 134 -0.486 -12.501 -3.282 1.00 0.26 H new ATOM 0 HG21 VAL A 134 -1.589 -10.301 -1.422 1.00 0.21 H new ATOM 0 HG22 VAL A 134 -0.075 -10.138 -2.344 1.00 0.21 H new ATOM 0 HG23 VAL A 134 -1.366 -8.927 -2.531 1.00 0.21 H new ATOM 1677 N LYS A 135 0.995 -9.327 -4.740 1.00 0.19 N ATOM 1678 CA LYS A 135 2.445 -9.274 -4.714 1.00 0.21 C ATOM 1679 C LYS A 135 2.930 -8.338 -3.623 1.00 0.17 C ATOM 1680 O LYS A 135 4.133 -8.195 -3.414 1.00 0.18 O ATOM 1681 CB LYS A 135 3.000 -8.835 -6.070 1.00 0.29 C ATOM 1682 CG LYS A 135 2.287 -7.640 -6.668 1.00 0.34 C ATOM 1683 CD LYS A 135 1.195 -8.071 -7.629 1.00 0.29 C ATOM 1684 CE LYS A 135 1.786 -8.656 -8.903 1.00 0.52 C ATOM 1685 NZ LYS A 135 2.520 -7.639 -9.708 1.00 1.03 N ATOM 0 H LYS A 135 0.537 -8.418 -4.677 1.00 0.19 H new ATOM 0 HA LYS A 135 2.811 -10.278 -4.500 1.00 0.21 H new ATOM 0 HB2 LYS A 135 4.058 -8.596 -5.958 1.00 0.29 H new ATOM 0 HB3 LYS A 135 2.934 -9.671 -6.766 1.00 0.29 H new ATOM 0 HG2 LYS A 135 1.854 -7.036 -5.870 1.00 0.34 H new ATOM 0 HG3 LYS A 135 3.006 -7.010 -7.191 1.00 0.34 H new ATOM 0 HD2 LYS A 135 0.555 -8.811 -7.149 1.00 0.29 H new ATOM 0 HD3 LYS A 135 0.565 -7.216 -7.876 1.00 0.29 H new ATOM 0 HE2 LYS A 135 2.464 -9.470 -8.645 1.00 0.52 H new ATOM 0 HE3 LYS A 135 0.987 -9.086 -9.507 1.00 0.52 H new ATOM 0 HZ1 LYS A 135 2.136 -7.618 -10.674 1.00 1.03 H new ATOM 0 HZ2 LYS A 135 2.407 -6.702 -9.270 1.00 1.03 H new ATOM 0 HZ3 LYS A 135 3.530 -7.886 -9.742 1.00 1.03 H new ATOM 1699 N LEU A 136 1.996 -7.722 -2.918 1.00 0.14 N ATOM 1700 CA LEU A 136 2.330 -6.803 -1.852 1.00 0.14 C ATOM 1701 C LEU A 136 1.254 -6.868 -0.774 1.00 0.14 C ATOM 1702 O LEU A 136 0.180 -7.410 -1.010 1.00 0.14 O ATOM 1703 CB LEU A 136 2.418 -5.394 -2.421 1.00 0.14 C ATOM 1704 CG LEU A 136 3.500 -4.496 -1.834 1.00 0.13 C ATOM 1705 CD1 LEU A 136 4.893 -5.068 -2.080 1.00 0.16 C ATOM 1706 CD2 LEU A 136 3.375 -3.114 -2.439 1.00 0.14 C ATOM 0 H LEU A 136 0.995 -7.845 -3.069 1.00 0.14 H new ATOM 0 HA LEU A 136 3.290 -7.073 -1.411 1.00 0.14 H new ATOM 0 HB2 LEU A 136 2.581 -5.469 -3.496 1.00 0.14 H new ATOM 0 HB3 LEU A 136 1.454 -4.906 -2.278 1.00 0.14 H new ATOM 0 HG LEU A 136 3.363 -4.437 -0.754 1.00 0.13 H new ATOM 0 HD11 LEU A 136 5.641 -4.403 -1.648 1.00 0.16 H new ATOM 0 HD12 LEU A 136 4.970 -6.051 -1.615 1.00 0.16 H new ATOM 0 HD13 LEU A 136 5.065 -5.160 -3.153 1.00 0.16 H new ATOM 0 HD21 LEU A 136 4.146 -2.464 -2.024 1.00 0.14 H new ATOM 0 HD22 LEU A 136 3.497 -3.178 -3.520 1.00 0.14 H new ATOM 0 HD23 LEU A 136 2.392 -2.703 -2.209 1.00 0.14 H new ATOM 1718 N LYS A 137 1.550 -6.363 0.416 1.00 0.17 N ATOM 1719 CA LYS A 137 0.554 -6.267 1.478 1.00 0.20 C ATOM 1720 C LYS A 137 0.799 -5.031 2.329 1.00 0.18 C ATOM 1721 O LYS A 137 1.889 -4.469 2.316 1.00 0.22 O ATOM 1722 CB LYS A 137 0.601 -7.485 2.407 1.00 0.31 C ATOM 1723 CG LYS A 137 0.954 -8.791 1.724 1.00 0.35 C ATOM 1724 CD LYS A 137 0.669 -9.984 2.611 1.00 0.28 C ATOM 1725 CE LYS A 137 1.412 -9.877 3.935 1.00 0.31 C ATOM 1726 NZ LYS A 137 1.395 -11.154 4.689 1.00 0.76 N ATOM 0 H LYS A 137 2.473 -6.013 0.672 1.00 0.17 H new ATOM 0 HA LYS A 137 -0.419 -6.214 0.990 1.00 0.20 H new ATOM 0 HB2 LYS A 137 1.329 -7.295 3.196 1.00 0.31 H new ATOM 0 HB3 LYS A 137 -0.370 -7.594 2.889 1.00 0.31 H new ATOM 0 HG2 LYS A 137 0.386 -8.882 0.798 1.00 0.35 H new ATOM 0 HG3 LYS A 137 2.009 -8.785 1.451 1.00 0.35 H new ATOM 0 HD2 LYS A 137 -0.403 -10.054 2.797 1.00 0.28 H new ATOM 0 HD3 LYS A 137 0.964 -10.900 2.099 1.00 0.28 H new ATOM 0 HE2 LYS A 137 2.444 -9.581 3.748 1.00 0.31 H new ATOM 0 HE3 LYS A 137 0.960 -9.092 4.542 1.00 0.31 H new ATOM 0 HZ1 LYS A 137 2.319 -11.301 5.144 1.00 0.76 H new ATOM 0 HZ2 LYS A 137 0.652 -11.118 5.416 1.00 0.76 H new ATOM 0 HZ3 LYS A 137 1.202 -11.940 4.036 1.00 0.76 H new ATOM 1740 N LEU A 138 -0.227 -4.614 3.050 1.00 0.18 N ATOM 1741 CA LEU A 138 -0.067 -3.680 4.151 1.00 0.20 C ATOM 1742 C LEU A 138 -0.215 -4.475 5.428 1.00 0.21 C ATOM 1743 O LEU A 138 -1.223 -5.151 5.612 1.00 0.22 O ATOM 1744 CB LEU A 138 -1.095 -2.536 4.122 1.00 0.19 C ATOM 1745 CG LEU A 138 -1.085 -1.616 2.889 1.00 0.19 C ATOM 1746 CD1 LEU A 138 0.333 -1.312 2.414 1.00 0.21 C ATOM 1747 CD2 LEU A 138 -1.924 -2.211 1.771 1.00 0.17 C ATOM 0 H LEU A 138 -1.190 -4.911 2.890 1.00 0.18 H new ATOM 0 HA LEU A 138 0.911 -3.205 4.075 1.00 0.20 H new ATOM 0 HB2 LEU A 138 -2.090 -2.973 4.210 1.00 0.19 H new ATOM 0 HB3 LEU A 138 -0.939 -1.918 5.006 1.00 0.19 H new ATOM 0 HG LEU A 138 -1.530 -0.666 3.184 1.00 0.19 H new ATOM 0 HD11 LEU A 138 0.293 -0.660 1.542 1.00 0.21 H new ATOM 0 HD12 LEU A 138 0.886 -0.817 3.212 1.00 0.21 H new ATOM 0 HD13 LEU A 138 0.835 -2.242 2.148 1.00 0.21 H new ATOM 0 HD21 LEU A 138 -1.904 -1.546 0.908 1.00 0.17 H new ATOM 0 HD22 LEU A 138 -1.518 -3.183 1.489 1.00 0.17 H new ATOM 0 HD23 LEU A 138 -2.952 -2.332 2.112 1.00 0.17 H new ATOM 1759 N ILE A 139 0.793 -4.383 6.290 1.00 0.27 N ATOM 1760 CA ILE A 139 0.946 -5.236 7.465 1.00 0.30 C ATOM 1761 C ILE A 139 1.411 -6.627 7.043 1.00 0.37 C ATOM 1762 O ILE A 139 1.183 -7.061 5.911 1.00 0.42 O ATOM 1763 CB ILE A 139 -0.332 -5.401 8.306 1.00 0.27 C ATOM 1764 CG1 ILE A 139 -1.169 -4.130 8.362 1.00 0.31 C ATOM 1765 CG2 ILE A 139 0.065 -5.803 9.701 1.00 0.35 C ATOM 1766 CD1 ILE A 139 -2.640 -4.428 8.449 1.00 0.41 C ATOM 0 H ILE A 139 1.543 -3.699 6.189 1.00 0.27 H new ATOM 0 HA ILE A 139 1.682 -4.729 8.089 1.00 0.30 H new ATOM 0 HB ILE A 139 -0.949 -6.165 7.834 1.00 0.27 H new ATOM 0 HG12 ILE A 139 -0.868 -3.535 9.224 1.00 0.31 H new ATOM 0 HG13 ILE A 139 -0.973 -3.527 7.475 1.00 0.31 H new ATOM 0 HG21 ILE A 139 -0.829 -5.925 10.313 1.00 0.35 H new ATOM 0 HG22 ILE A 139 0.612 -6.745 9.666 1.00 0.35 H new ATOM 0 HG23 ILE A 139 0.700 -5.031 10.136 1.00 0.35 H new ATOM 0 HD11 ILE A 139 -3.199 -3.493 8.487 1.00 0.41 H new ATOM 0 HD12 ILE A 139 -2.948 -5.000 7.573 1.00 0.41 H new ATOM 0 HD13 ILE A 139 -2.841 -5.008 9.350 1.00 0.41 H new ATOM 1778 N ARG A 140 2.060 -7.331 7.957 1.00 0.48 N ATOM 1779 CA ARG A 140 2.554 -8.664 7.673 1.00 0.67 C ATOM 1780 C ARG A 140 1.718 -9.723 8.380 1.00 0.78 C ATOM 1781 O ARG A 140 1.054 -9.447 9.378 1.00 1.21 O ATOM 1782 CB ARG A 140 4.032 -8.785 8.053 1.00 0.85 C ATOM 1783 CG ARG A 140 4.356 -8.349 9.473 1.00 1.60 C ATOM 1784 CD ARG A 140 5.857 -8.329 9.702 1.00 1.87 C ATOM 1785 NE ARG A 140 6.212 -7.897 11.051 1.00 2.73 N ATOM 1786 CZ ARG A 140 7.447 -7.549 11.416 1.00 3.53 C ATOM 1787 NH1 ARG A 140 8.422 -7.501 10.517 1.00 3.68 N ATOM 1788 NH2 ARG A 140 7.707 -7.220 12.672 1.00 4.55 N ATOM 0 H ARG A 140 2.256 -6.999 8.901 1.00 0.48 H new ATOM 0 HA ARG A 140 2.464 -8.836 6.600 1.00 0.67 H new ATOM 0 HB2 ARG A 140 4.343 -9.822 7.925 1.00 0.85 H new ATOM 0 HB3 ARG A 140 4.623 -8.187 7.359 1.00 0.85 H new ATOM 0 HG2 ARG A 140 3.942 -7.357 9.657 1.00 1.60 H new ATOM 0 HG3 ARG A 140 3.884 -9.028 10.183 1.00 1.60 H new ATOM 0 HD2 ARG A 140 6.261 -9.326 9.525 1.00 1.87 H new ATOM 0 HD3 ARG A 140 6.323 -7.662 8.976 1.00 1.87 H new ATOM 0 HE ARG A 140 5.474 -7.859 11.754 1.00 2.73 H new ATOM 0 HH11 ARG A 140 8.229 -7.731 9.542 1.00 3.68 H new ATOM 0 HH12 ARG A 140 9.365 -7.234 10.801 1.00 3.68 H new ATOM 0 HH21 ARG A 140 6.961 -7.232 13.367 1.00 4.55 H new ATOM 0 HH22 ARG A 140 8.654 -6.955 12.944 1.00 4.55 H new ATOM 1802 N GLY A 141 1.773 -10.933 7.849 1.00 1.19 N ATOM 1803 CA GLY A 141 0.971 -12.030 8.357 1.00 1.54 C ATOM 1804 C GLY A 141 -0.409 -12.101 7.744 1.00 1.15 C ATOM 1805 O GLY A 141 -1.159 -11.124 7.724 1.00 1.76 O ATOM 0 H GLY A 141 2.370 -11.180 7.060 1.00 1.19 H new ATOM 0 HA2 GLY A 141 1.492 -12.969 8.169 1.00 1.54 H new ATOM 0 HA3 GLY A 141 0.875 -11.930 9.438 1.00 1.54 H new ATOM 1809 N ILE A 142 -0.703 -13.262 7.208 1.00 1.02 N ATOM 1810 CA ILE A 142 -2.015 -13.602 6.706 1.00 0.99 C ATOM 1811 C ILE A 142 -2.553 -14.796 7.479 1.00 1.77 C ATOM 1812 O ILE A 142 -3.400 -14.604 8.370 1.00 2.58 O ATOM 1813 CB ILE A 142 -1.971 -13.960 5.220 1.00 0.74 C ATOM 1814 CG1 ILE A 142 -1.246 -12.872 4.432 1.00 0.77 C ATOM 1815 CG2 ILE A 142 -3.377 -14.170 4.692 1.00 0.92 C ATOM 1816 CD1 ILE A 142 -1.271 -13.080 2.931 1.00 0.84 C ATOM 1817 OXT ILE A 142 -2.082 -15.926 7.219 1.00 2.21 O ATOM 0 H ILE A 142 -0.022 -14.014 7.106 1.00 1.02 H new ATOM 0 HA ILE A 142 -2.661 -12.733 6.835 1.00 0.99 H new ATOM 0 HB ILE A 142 -1.417 -14.891 5.096 1.00 0.74 H new ATOM 0 HG12 ILE A 142 -1.698 -11.908 4.663 1.00 0.77 H new ATOM 0 HG13 ILE A 142 -0.209 -12.826 4.765 1.00 0.77 H new ATOM 0 HG21 ILE A 142 -3.334 -14.424 3.633 1.00 0.92 H new ATOM 0 HG22 ILE A 142 -3.854 -14.982 5.241 1.00 0.92 H new ATOM 0 HG23 ILE A 142 -3.955 -13.255 4.822 1.00 0.92 H new ATOM 0 HD11 ILE A 142 -0.736 -12.266 2.442 1.00 0.84 H new ATOM 0 HD12 ILE A 142 -0.792 -14.028 2.687 1.00 0.84 H new ATOM 0 HD13 ILE A 142 -2.304 -13.096 2.583 1.00 0.84 H new TER 1829 ILE A 142 HETATM 1830 C ACE B 552 -15.982 -4.449 5.316 1.00 0.85 C HETATM 1831 O ACE B 552 -17.045 -3.843 5.446 1.00 1.24 O HETATM 1832 CH3 ACE B 552 -14.773 -4.073 6.135 1.00 1.00 C HETATM 0 H1 ACE B 552 -14.460 -4.927 6.735 1.00 1.00 H new HETATM 0 H2 ACE B 552 -13.960 -3.779 5.471 1.00 1.00 H new HETATM 0 H3 ACE B 552 -15.023 -3.240 6.792 1.00 1.00 H new ATOM 1836 N SER B 553 -15.819 -5.468 4.478 1.00 0.66 N ATOM 1837 CA SER B 553 -16.892 -5.954 3.615 1.00 0.51 C ATOM 1838 C SER B 553 -16.449 -7.244 2.932 1.00 0.44 C ATOM 1839 O SER B 553 -17.240 -8.165 2.714 1.00 0.54 O ATOM 1840 CB SER B 553 -17.258 -4.890 2.573 1.00 0.54 C ATOM 1841 OG SER B 553 -18.264 -5.347 1.687 1.00 1.14 O ATOM 0 H SER B 553 -14.942 -5.979 4.378 1.00 0.66 H new ATOM 0 HA SER B 553 -17.777 -6.158 4.218 1.00 0.51 H new ATOM 0 HB2 SER B 553 -17.602 -3.988 3.079 1.00 0.54 H new ATOM 0 HB3 SER B 553 -16.369 -4.617 2.004 1.00 0.54 H new ATOM 0 HG SER B 553 -18.473 -4.643 1.038 1.00 1.14 H new ATOM 1847 N GLU B 554 -15.163 -7.300 2.626 1.00 0.36 N ATOM 1848 CA GLU B 554 -14.565 -8.439 1.951 1.00 0.33 C ATOM 1849 C GLU B 554 -13.412 -8.982 2.799 1.00 0.35 C ATOM 1850 O GLU B 554 -13.227 -8.538 3.934 1.00 0.40 O ATOM 1851 CB GLU B 554 -14.101 -7.983 0.565 1.00 0.32 C ATOM 1852 CG GLU B 554 -13.811 -9.099 -0.418 1.00 0.29 C ATOM 1853 CD GLU B 554 -14.813 -10.231 -0.354 1.00 0.46 C ATOM 1854 OE1 GLU B 554 -14.669 -11.105 0.518 1.00 0.63 O ATOM 1855 OE2 GLU B 554 -15.752 -10.243 -1.179 1.00 0.65 O ATOM 0 H GLU B 554 -14.502 -6.553 2.840 1.00 0.36 H new ATOM 0 HA GLU B 554 -15.283 -9.249 1.825 1.00 0.33 H new ATOM 0 HB2 GLU B 554 -14.866 -7.335 0.138 1.00 0.32 H new ATOM 0 HB3 GLU B 554 -13.201 -7.380 0.681 1.00 0.32 H new ATOM 0 HG2 GLU B 554 -13.800 -8.690 -1.428 1.00 0.29 H new ATOM 0 HG3 GLU B 554 -12.814 -9.495 -0.224 1.00 0.29 H new ATOM 1862 N THR B 555 -12.671 -9.946 2.261 1.00 0.33 N ATOM 1863 CA THR B 555 -11.486 -10.507 2.904 1.00 0.35 C ATOM 1864 C THR B 555 -10.574 -9.374 3.394 1.00 0.34 C ATOM 1865 O THR B 555 -9.999 -9.425 4.474 1.00 0.45 O ATOM 1866 CB THR B 555 -10.764 -11.442 1.895 1.00 0.36 C ATOM 1867 OG1 THR B 555 -9.663 -12.128 2.495 1.00 0.45 O ATOM 1868 CG2 THR B 555 -10.284 -10.663 0.680 1.00 0.30 C ATOM 0 H THR B 555 -12.879 -10.365 1.355 1.00 0.33 H new ATOM 0 HA THR B 555 -11.766 -11.097 3.777 1.00 0.35 H new ATOM 0 HB THR B 555 -11.494 -12.187 1.577 1.00 0.36 H new ATOM 0 HG1 THR B 555 -9.568 -13.014 2.087 1.00 0.45 H new ATOM 0 HG21 THR B 555 -9.782 -11.340 -0.011 1.00 0.30 H new ATOM 0 HG22 THR B 555 -11.138 -10.203 0.182 1.00 0.30 H new ATOM 0 HG23 THR B 555 -9.588 -9.887 0.997 1.00 0.30 H new ATOM 1876 N THR B 556 -10.499 -8.326 2.602 1.00 0.26 N ATOM 1877 CA THR B 556 -9.863 -7.096 3.015 1.00 0.23 C ATOM 1878 C THR B 556 -10.708 -5.940 2.532 1.00 0.21 C ATOM 1879 O THR B 556 -11.095 -5.058 3.297 1.00 0.22 O ATOM 1880 CB THR B 556 -8.458 -6.943 2.420 1.00 0.20 C ATOM 1881 OG1 THR B 556 -7.611 -8.023 2.825 1.00 0.24 O ATOM 1882 CG2 THR B 556 -7.856 -5.621 2.848 1.00 0.20 C ATOM 0 H THR B 556 -10.877 -8.304 1.655 1.00 0.26 H new ATOM 0 HA THR B 556 -9.772 -7.111 4.101 1.00 0.23 H new ATOM 0 HB THR B 556 -8.541 -6.964 1.333 1.00 0.20 H new ATOM 0 HG1 THR B 556 -7.052 -7.736 3.577 1.00 0.24 H new ATOM 0 HG21 THR B 556 -6.858 -5.520 2.421 1.00 0.20 H new ATOM 0 HG22 THR B 556 -8.485 -4.804 2.496 1.00 0.20 H new ATOM 0 HG23 THR B 556 -7.791 -5.586 3.935 1.00 0.20 H new ATOM 1890 N LEU B 557 -10.997 -5.999 1.238 1.00 0.20 N ATOM 1891 CA LEU B 557 -11.775 -4.994 0.548 1.00 0.19 C ATOM 1892 C LEU B 557 -10.962 -3.729 0.373 1.00 0.17 C ATOM 1893 O LEU B 557 -9.740 -3.785 0.374 1.00 0.18 O ATOM 1894 CB LEU B 557 -13.082 -4.699 1.276 1.00 0.21 C ATOM 1895 CG LEU B 557 -14.297 -4.615 0.374 1.00 0.21 C ATOM 1896 CD1 LEU B 557 -15.025 -3.320 0.649 1.00 0.23 C ATOM 1897 CD2 LEU B 557 -13.895 -4.744 -1.094 1.00 0.20 C ATOM 0 H LEU B 557 -10.689 -6.761 0.634 1.00 0.20 H new ATOM 0 HA LEU B 557 -12.031 -5.386 -0.436 1.00 0.19 H new ATOM 0 HB2 LEU B 557 -13.251 -5.476 2.022 1.00 0.21 H new ATOM 0 HB3 LEU B 557 -12.979 -3.757 1.815 1.00 0.21 H new ATOM 0 HG LEU B 557 -14.971 -5.445 0.587 1.00 0.21 H new ATOM 0 HD11 LEU B 557 -15.901 -3.251 0.004 1.00 0.23 H new ATOM 0 HD12 LEU B 557 -15.339 -3.294 1.692 1.00 0.23 H new ATOM 0 HD13 LEU B 557 -14.360 -2.479 0.449 1.00 0.23 H new ATOM 0 HD21 LEU B 557 -14.784 -4.681 -1.722 1.00 0.20 H new ATOM 0 HD22 LEU B 557 -13.208 -3.939 -1.355 1.00 0.20 H new ATOM 0 HD23 LEU B 557 -13.405 -5.705 -1.254 1.00 0.20 H new ATOM 1909 N LEU B 558 -11.666 -2.599 0.257 1.00 0.18 N ATOM 1910 CA LEU B 558 -11.071 -1.287 -0.011 1.00 0.18 C ATOM 1911 C LEU B 558 -10.989 -1.064 -1.508 1.00 0.19 C ATOM 1912 O LEU B 558 -9.929 -0.812 -2.075 1.00 0.23 O ATOM 1913 CB LEU B 558 -9.701 -1.102 0.671 1.00 0.16 C ATOM 1914 CG LEU B 558 -9.723 -0.892 2.193 1.00 0.16 C ATOM 1915 CD1 LEU B 558 -10.661 -1.863 2.881 1.00 0.17 C ATOM 1916 CD2 LEU B 558 -8.328 -1.045 2.762 1.00 0.16 C ATOM 0 H LEU B 558 -12.682 -2.570 0.348 1.00 0.18 H new ATOM 0 HA LEU B 558 -11.719 -0.528 0.427 1.00 0.18 H new ATOM 0 HB2 LEU B 558 -9.090 -1.978 0.455 1.00 0.16 H new ATOM 0 HB3 LEU B 558 -9.204 -0.246 0.214 1.00 0.16 H new ATOM 0 HG LEU B 558 -10.087 0.119 2.378 1.00 0.16 H new ATOM 0 HD11 LEU B 558 -10.648 -1.682 3.956 1.00 0.17 H new ATOM 0 HD12 LEU B 558 -11.673 -1.722 2.502 1.00 0.17 H new ATOM 0 HD13 LEU B 558 -10.338 -2.885 2.681 1.00 0.17 H new ATOM 0 HD21 LEU B 558 -8.357 -0.894 3.841 1.00 0.16 H new ATOM 0 HD22 LEU B 558 -7.954 -2.046 2.545 1.00 0.16 H new ATOM 0 HD23 LEU B 558 -7.667 -0.305 2.310 1.00 0.16 H new ATOM 1928 N GLU B 559 -12.155 -1.167 -2.125 1.00 0.19 N ATOM 1929 CA GLU B 559 -12.311 -0.957 -3.558 1.00 0.21 C ATOM 1930 C GLU B 559 -12.974 0.385 -3.803 1.00 0.24 C ATOM 1931 O GLU B 559 -13.115 0.844 -4.937 1.00 0.31 O ATOM 1932 CB GLU B 559 -13.143 -2.079 -4.178 1.00 0.22 C ATOM 1933 CG GLU B 559 -12.437 -3.418 -4.213 1.00 0.25 C ATOM 1934 CD GLU B 559 -13.284 -4.498 -4.849 1.00 0.29 C ATOM 1935 OE1 GLU B 559 -14.338 -4.853 -4.277 1.00 0.33 O ATOM 1936 OE2 GLU B 559 -12.922 -4.979 -5.939 1.00 0.38 O ATOM 0 H GLU B 559 -13.025 -1.400 -1.645 1.00 0.19 H new ATOM 0 HA GLU B 559 -11.327 -0.964 -4.027 1.00 0.21 H new ATOM 0 HB2 GLU B 559 -14.071 -2.183 -3.616 1.00 0.22 H new ATOM 0 HB3 GLU B 559 -13.416 -1.796 -5.195 1.00 0.22 H new ATOM 0 HG2 GLU B 559 -11.503 -3.319 -4.766 1.00 0.25 H new ATOM 0 HG3 GLU B 559 -12.176 -3.715 -3.197 1.00 0.25 H new ATOM 1943 N ASP B 560 -13.386 0.991 -2.708 1.00 0.25 N ATOM 1944 CA ASP B 560 -13.947 2.330 -2.710 1.00 0.31 C ATOM 1945 C ASP B 560 -13.321 3.080 -1.570 1.00 0.25 C ATOM 1946 O ASP B 560 -12.852 2.449 -0.624 1.00 0.26 O ATOM 1947 CB ASP B 560 -15.466 2.338 -2.498 1.00 0.45 C ATOM 1948 CG ASP B 560 -16.129 1.001 -2.756 1.00 0.74 C ATOM 1949 OD1 ASP B 560 -16.178 0.167 -1.832 1.00 0.95 O ATOM 1950 OD2 ASP B 560 -16.595 0.781 -3.898 1.00 0.90 O ATOM 0 H ASP B 560 -13.341 0.565 -1.782 1.00 0.25 H new ATOM 0 HA ASP B 560 -13.745 2.781 -3.681 1.00 0.31 H new ATOM 0 HB2 ASP B 560 -15.678 2.646 -1.474 1.00 0.45 H new ATOM 0 HB3 ASP B 560 -15.911 3.086 -3.155 1.00 0.45 H new ATOM 1955 N GLU B 561 -13.319 4.394 -1.618 1.00 0.26 N ATOM 1956 CA GLU B 561 -12.774 5.158 -0.515 1.00 0.26 C ATOM 1957 C GLU B 561 -13.619 4.931 0.730 1.00 0.26 C ATOM 1958 O GLU B 561 -13.095 4.669 1.808 1.00 0.29 O ATOM 1959 CB GLU B 561 -12.714 6.645 -0.842 1.00 0.30 C ATOM 1960 CG GLU B 561 -12.122 7.471 0.283 1.00 0.35 C ATOM 1961 CD GLU B 561 -12.235 8.955 0.038 1.00 0.45 C ATOM 1962 OE1 GLU B 561 -13.369 9.472 0.004 1.00 0.68 O ATOM 1963 OE2 GLU B 561 -11.186 9.619 -0.108 1.00 0.69 O ATOM 0 H GLU B 561 -13.681 4.949 -2.393 1.00 0.26 H new ATOM 0 HA GLU B 561 -11.755 4.816 -0.334 1.00 0.26 H new ATOM 0 HB2 GLU B 561 -12.120 6.790 -1.744 1.00 0.30 H new ATOM 0 HB3 GLU B 561 -13.719 7.005 -1.061 1.00 0.30 H new ATOM 0 HG2 GLU B 561 -12.627 7.222 1.216 1.00 0.35 H new ATOM 0 HG3 GLU B 561 -11.072 7.207 0.409 1.00 0.35 H new ATOM 1970 N LYS B 562 -14.932 4.991 0.546 1.00 0.30 N ATOM 1971 CA LYS B 562 -15.891 4.773 1.623 1.00 0.39 C ATOM 1972 C LYS B 562 -15.568 3.514 2.418 1.00 0.34 C ATOM 1973 O LYS B 562 -15.522 3.539 3.642 1.00 0.40 O ATOM 1974 CB LYS B 562 -17.290 4.633 1.026 1.00 0.51 C ATOM 1975 CG LYS B 562 -18.389 4.467 2.063 1.00 0.74 C ATOM 1976 CD LYS B 562 -19.732 4.190 1.406 1.00 1.73 C ATOM 1977 CE LYS B 562 -20.841 4.024 2.435 1.00 2.39 C ATOM 1978 NZ LYS B 562 -21.030 5.247 3.259 1.00 3.03 N ATOM 0 H LYS B 562 -15.363 5.193 -0.356 1.00 0.30 H new ATOM 0 HA LYS B 562 -15.839 5.627 2.298 1.00 0.39 H new ATOM 0 HB2 LYS B 562 -17.506 5.513 0.420 1.00 0.51 H new ATOM 0 HB3 LYS B 562 -17.304 3.774 0.356 1.00 0.51 H new ATOM 0 HG2 LYS B 562 -18.136 3.648 2.737 1.00 0.74 H new ATOM 0 HG3 LYS B 562 -18.458 5.370 2.670 1.00 0.74 H new ATOM 0 HD2 LYS B 562 -19.982 5.008 0.731 1.00 1.73 H new ATOM 0 HD3 LYS B 562 -19.661 3.287 0.800 1.00 1.73 H new ATOM 0 HE2 LYS B 562 -21.774 3.783 1.925 1.00 2.39 H new ATOM 0 HE3 LYS B 562 -20.607 3.182 3.086 1.00 2.39 H new ATOM 0 HZ1 LYS B 562 -21.915 5.168 3.800 1.00 3.03 H new ATOM 0 HZ2 LYS B 562 -20.231 5.350 3.916 1.00 3.03 H new ATOM 0 HZ3 LYS B 562 -21.077 6.080 2.638 1.00 3.03 H new ATOM 1992 N SER B 563 -15.299 2.432 1.711 1.00 0.27 N ATOM 1993 CA SER B 563 -15.036 1.148 2.343 1.00 0.24 C ATOM 1994 C SER B 563 -13.575 1.026 2.746 1.00 0.21 C ATOM 1995 O SER B 563 -13.213 0.196 3.576 1.00 0.20 O ATOM 1996 CB SER B 563 -15.419 0.021 1.390 1.00 0.27 C ATOM 1997 OG SER B 563 -16.724 0.218 0.871 1.00 0.91 O ATOM 0 H SER B 563 -15.256 2.415 0.692 1.00 0.27 H new ATOM 0 HA SER B 563 -15.639 1.076 3.248 1.00 0.24 H new ATOM 0 HB2 SER B 563 -14.701 -0.028 0.571 1.00 0.27 H new ATOM 0 HB3 SER B 563 -15.372 -0.934 1.913 1.00 0.27 H new ATOM 0 HG SER B 563 -16.691 0.209 -0.108 1.00 0.91 H new ATOM 2003 N LEU B 564 -12.753 1.874 2.159 1.00 0.20 N ATOM 2004 CA LEU B 564 -11.325 1.841 2.370 1.00 0.19 C ATOM 2005 C LEU B 564 -11.046 2.496 3.704 1.00 0.21 C ATOM 2006 O LEU B 564 -10.367 1.949 4.566 1.00 0.21 O ATOM 2007 CB LEU B 564 -10.614 2.613 1.264 1.00 0.19 C ATOM 2008 CG LEU B 564 -9.148 2.245 1.009 1.00 0.17 C ATOM 2009 CD1 LEU B 564 -8.581 3.104 -0.088 1.00 0.21 C ATOM 2010 CD2 LEU B 564 -8.281 2.399 2.236 1.00 0.18 C ATOM 0 H LEU B 564 -13.061 2.607 1.520 1.00 0.20 H new ATOM 0 HA LEU B 564 -10.964 0.813 2.359 1.00 0.19 H new ATOM 0 HB2 LEU B 564 -11.168 2.469 0.337 1.00 0.19 H new ATOM 0 HB3 LEU B 564 -10.663 3.675 1.503 1.00 0.19 H new ATOM 0 HG LEU B 564 -9.142 1.194 0.722 1.00 0.17 H new ATOM 0 HD11 LEU B 564 -7.539 2.834 -0.260 1.00 0.21 H new ATOM 0 HD12 LEU B 564 -9.152 2.949 -1.003 1.00 0.21 H new ATOM 0 HD13 LEU B 564 -8.640 4.153 0.204 1.00 0.21 H new ATOM 0 HD21 LEU B 564 -7.255 2.124 1.993 1.00 0.18 H new ATOM 0 HD22 LEU B 564 -8.309 3.435 2.574 1.00 0.18 H new ATOM 0 HD23 LEU B 564 -8.653 1.749 3.028 1.00 0.18 H new ATOM 2022 N VAL B 565 -11.628 3.669 3.870 1.00 0.23 N ATOM 2023 CA VAL B 565 -11.441 4.442 5.072 1.00 0.26 C ATOM 2024 C VAL B 565 -12.223 3.840 6.213 1.00 0.28 C ATOM 2025 O VAL B 565 -11.754 3.849 7.329 1.00 0.32 O ATOM 2026 CB VAL B 565 -11.830 5.913 4.861 1.00 0.29 C ATOM 2027 CG1 VAL B 565 -11.312 6.356 3.521 1.00 0.28 C ATOM 2028 CG2 VAL B 565 -13.332 6.134 4.946 1.00 0.30 C ATOM 0 H VAL B 565 -12.238 4.105 3.179 1.00 0.23 H new ATOM 0 HA VAL B 565 -10.381 4.416 5.325 1.00 0.26 H new ATOM 0 HB VAL B 565 -11.384 6.505 5.660 1.00 0.29 H new ATOM 0 HG11 VAL B 565 -11.580 7.399 3.354 1.00 0.28 H new ATOM 0 HG12 VAL B 565 -10.227 6.251 3.497 1.00 0.28 H new ATOM 0 HG13 VAL B 565 -11.753 5.739 2.738 1.00 0.28 H new ATOM 0 HG21 VAL B 565 -13.554 7.190 4.790 1.00 0.30 H new ATOM 0 HG22 VAL B 565 -13.831 5.541 4.179 1.00 0.30 H new ATOM 0 HG23 VAL B 565 -13.689 5.830 5.930 1.00 0.30 H new ATOM 2038 N SER B 566 -13.386 3.268 5.915 1.00 0.28 N ATOM 2039 CA SER B 566 -14.170 2.551 6.918 1.00 0.30 C ATOM 2040 C SER B 566 -13.367 1.394 7.491 1.00 0.30 C ATOM 2041 O SER B 566 -13.666 0.868 8.562 1.00 0.35 O ATOM 2042 CB SER B 566 -15.456 2.029 6.295 1.00 0.31 C ATOM 2043 OG SER B 566 -16.365 3.087 6.042 1.00 0.75 O ATOM 0 H SER B 566 -13.807 3.287 4.986 1.00 0.28 H new ATOM 0 HA SER B 566 -14.416 3.240 7.726 1.00 0.30 H new ATOM 0 HB2 SER B 566 -15.228 1.510 5.364 1.00 0.31 H new ATOM 0 HB3 SER B 566 -15.917 1.300 6.962 1.00 0.31 H new ATOM 0 HG SER B 566 -16.198 3.455 5.149 1.00 0.75 H new ATOM 2049 N TYR B 567 -12.345 1.020 6.757 1.00 0.26 N ATOM 2050 CA TYR B 567 -11.454 -0.053 7.140 1.00 0.25 C ATOM 2051 C TYR B 567 -10.198 0.520 7.787 1.00 0.26 C ATOM 2052 O TYR B 567 -9.561 -0.128 8.602 1.00 0.28 O ATOM 2053 CB TYR B 567 -11.109 -0.839 5.890 1.00 0.23 C ATOM 2054 CG TYR B 567 -10.262 -2.061 6.107 1.00 0.22 C ATOM 2055 CD1 TYR B 567 -10.842 -3.280 6.410 1.00 0.23 C ATOM 2056 CD2 TYR B 567 -8.883 -1.979 6.045 1.00 0.24 C ATOM 2057 CE1 TYR B 567 -10.058 -4.394 6.645 1.00 0.25 C ATOM 2058 CE2 TYR B 567 -8.092 -3.084 6.272 1.00 0.25 C ATOM 2059 CZ TYR B 567 -8.715 -4.336 6.439 1.00 0.24 C ATOM 2060 OH TYR B 567 -7.898 -5.395 6.813 1.00 0.29 O ATOM 0 H TYR B 567 -12.105 1.457 5.867 1.00 0.26 H new ATOM 0 HA TYR B 567 -11.931 -0.709 7.868 1.00 0.25 H new ATOM 0 HB2 TYR B 567 -12.037 -1.143 5.405 1.00 0.23 H new ATOM 0 HB3 TYR B 567 -10.590 -0.177 5.197 1.00 0.23 H new ATOM 0 HD1 TYR B 567 -11.918 -3.362 6.463 1.00 0.23 H new ATOM 0 HD2 TYR B 567 -8.418 -1.032 5.815 1.00 0.24 H new ATOM 0 HE1 TYR B 567 -10.512 -5.310 6.992 1.00 0.25 H new ATOM 0 HE2 TYR B 567 -7.017 -2.992 6.321 1.00 0.25 H new ATOM 0 HH TYR B 567 -7.410 -5.159 7.630 1.00 0.29 H new ATOM 2070 N LEU B 568 -9.842 1.732 7.385 1.00 0.26 N ATOM 2071 CA LEU B 568 -8.669 2.428 7.904 1.00 0.29 C ATOM 2072 C LEU B 568 -8.947 3.208 9.190 1.00 0.35 C ATOM 2073 O LEU B 568 -8.122 3.225 10.101 1.00 0.39 O ATOM 2074 CB LEU B 568 -8.178 3.395 6.853 1.00 0.28 C ATOM 2075 CG LEU B 568 -7.022 2.920 5.994 1.00 0.25 C ATOM 2076 CD1 LEU B 568 -7.180 1.463 5.587 1.00 0.23 C ATOM 2077 CD2 LEU B 568 -6.965 3.803 4.778 1.00 0.26 C ATOM 0 H LEU B 568 -10.360 2.264 6.686 1.00 0.26 H new ATOM 0 HA LEU B 568 -7.924 1.669 8.142 1.00 0.29 H new ATOM 0 HB2 LEU B 568 -9.013 3.642 6.197 1.00 0.28 H new ATOM 0 HB3 LEU B 568 -7.879 4.318 7.350 1.00 0.28 H new ATOM 0 HG LEU B 568 -6.095 2.984 6.564 1.00 0.25 H new ATOM 0 HD11 LEU B 568 -6.331 1.163 4.973 1.00 0.23 H new ATOM 0 HD12 LEU B 568 -7.221 0.838 6.479 1.00 0.23 H new ATOM 0 HD13 LEU B 568 -8.101 1.342 5.017 1.00 0.23 H new ATOM 0 HD21 LEU B 568 -6.142 3.487 4.137 1.00 0.26 H new ATOM 0 HD22 LEU B 568 -7.903 3.726 4.228 1.00 0.26 H new ATOM 0 HD23 LEU B 568 -6.809 4.837 5.086 1.00 0.26 H new ATOM 2089 N ASN B 569 -10.093 3.874 9.259 1.00 0.38 N ATOM 2090 CA ASN B 569 -10.401 4.731 10.408 1.00 0.46 C ATOM 2091 C ASN B 569 -10.961 3.911 11.565 1.00 0.50 C ATOM 2092 O ASN B 569 -11.493 4.462 12.527 1.00 0.74 O ATOM 2093 CB ASN B 569 -11.385 5.867 10.052 1.00 0.52 C ATOM 2094 CG ASN B 569 -12.845 5.422 9.980 1.00 0.54 C ATOM 2095 OD1 ASN B 569 -13.741 6.157 10.394 1.00 0.68 O ATOM 2096 ND2 ASN B 569 -13.109 4.252 9.419 1.00 0.44 N ATOM 0 H ASN B 569 -10.820 3.842 8.544 1.00 0.38 H new ATOM 0 HA ASN B 569 -9.460 5.189 10.711 1.00 0.46 H new ATOM 0 HB2 ASN B 569 -11.293 6.660 10.794 1.00 0.52 H new ATOM 0 HB3 ASN B 569 -11.098 6.295 9.092 1.00 0.52 H new ATOM 0 HD21 ASN B 569 -14.075 3.940 9.321 1.00 0.44 H new ATOM 0 HD22 ASN B 569 -12.346 3.663 9.085 1.00 0.44 H new ATOM 2103 N TYR B 570 -10.847 2.598 11.452 1.00 0.50 N ATOM 2104 CA TYR B 570 -11.269 1.689 12.505 1.00 0.59 C ATOM 2105 C TYR B 570 -10.569 2.041 13.819 1.00 0.90 C ATOM 2106 O TYR B 570 -11.264 2.194 14.841 1.00 1.34 O ATOM 2107 CB TYR B 570 -10.985 0.234 12.099 1.00 0.39 C ATOM 2108 CG TYR B 570 -9.514 -0.135 12.074 1.00 0.42 C ATOM 2109 CD1 TYR B 570 -8.654 0.399 11.123 1.00 0.36 C ATOM 2110 CD2 TYR B 570 -8.988 -1.018 13.009 1.00 0.66 C ATOM 2111 CE1 TYR B 570 -7.317 0.066 11.102 1.00 0.53 C ATOM 2112 CE2 TYR B 570 -7.652 -1.355 12.996 1.00 0.87 C ATOM 2113 CZ TYR B 570 -6.819 -0.813 12.042 1.00 0.79 C ATOM 2114 OH TYR B 570 -5.484 -1.154 12.032 1.00 1.04 O ATOM 2115 OXT TYR B 570 -9.328 2.223 13.810 1.00 1.66 O ATOM 0 H TYR B 570 -10.461 2.133 10.630 1.00 0.50 H new ATOM 0 HA TYR B 570 -12.344 1.794 12.654 1.00 0.59 H new ATOM 0 HB2 TYR B 570 -11.502 -0.431 12.791 1.00 0.39 H new ATOM 0 HB3 TYR B 570 -11.408 0.056 11.110 1.00 0.39 H new ATOM 0 HD1 TYR B 570 -9.040 1.088 10.386 1.00 0.36 H new ATOM 0 HD2 TYR B 570 -9.637 -1.447 13.758 1.00 0.66 H new ATOM 0 HE1 TYR B 570 -6.663 0.490 10.355 1.00 0.53 H new ATOM 0 HE2 TYR B 570 -7.259 -2.042 13.731 1.00 0.87 H new ATOM 0 HH TYR B 570 -5.301 -1.782 12.762 1.00 1.04 H new TER 2125 TYR B 570