USER MOD reduce.3.24.130724 H: found=0, std=0, add=1140, rem=0, adj=58 USER MOD reduce.3.24.130724 removed 1137 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 22 ASN : amide:sc= -0.211 X(o=2.2,f=1.7) USER MOD Set 1.2: A 25 SER OG : rot 101:sc= 0.771 USER MOD Set 1.3: A 143 LYS NZ :NH3+ 147:sc= 1.6 (180deg=-1.48!) USER MOD Set 2.1: A 126 SER OG : rot 2:sc= 0.768 USER MOD Set 2.2: A 135 SER OG : rot 99:sc= 0.24 USER MOD Set 3.1: A 113 HIS :FLIP no HD1:sc= -0.138 F(o=-1.1,f=-0.36) USER MOD Set 3.2: A 124 SER OG : rot 138:sc= -0.13 USER MOD Set 3.3: A 150 THR OG1 : rot 180:sc= -0.0947 USER MOD Set 4.1: A 57 SER OG : rot 180:sc= 0 USER MOD Set 4.2: A 59 THR OG1 : rot 60:sc= 0.725 USER MOD Set 5.1: A 7 ASN :FLIP amide:sc= -3.13! C(o=-5.2!,f=-2.2!) USER MOD Set 5.2: A 36 TYR OH : rot -34:sc= 0.892 USER MOD Set 6.1: A 6 THR OG1 : rot -81:sc= 0.0834 USER MOD Set 6.2: A 9 GLN : amide:sc= 0.154 X(o=0.24,f=-0.066) USER MOD Single : A 1 GLY N :NH3+ -136:sc= 0.0262 (180deg=0) USER MOD Single : A 4 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 5 MET CE :methyl 172:sc= -3.21 (180deg=-3.82!) USER MOD Single : A 12 LYS NZ :NH3+ 166:sc=-0.000442 (180deg=-0.329) USER MOD Single : A 13 LYS NZ :NH3+ -174:sc= 1.17 (180deg=1.12) USER MOD Single : A 15 LYS NZ :NH3+ -171:sc= 1.32 (180deg=1.15) USER MOD Single : A 17 SER OG : rot 72:sc= 0.279 USER MOD Single : A 21 SER OG : rot 34:sc= 0.56 USER MOD Single : A 27 ASN : amide:sc=-0.00468 X(o=-0.0047,f=-0.48) USER MOD Single : A 29 ASN : amide:sc= -0.636 K(o=-0.64,f=-2) USER MOD Single : A 33 THR OG1 : rot 180:sc= 0 USER MOD Single : A 35 THR OG1 : rot 180:sc= -0.0777 USER MOD Single : A 38 ASN : amide:sc= -1.1 K(o=-1.1,f=-2.4) USER MOD Single : A 39 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 40 THR OG1 : rot -170:sc= 0.0704 USER MOD Single : A 42 TYR OH : rot 180:sc= 0 USER MOD Single : A 43 SER OG : rot 180:sc= 0 USER MOD Single : A 44 SER OG : rot 180:sc= 0 USER MOD Single : A 45 SER OG : rot 180:sc= 0 USER MOD Single : A 47 SER OG : rot 180:sc= 0 USER MOD Single : A 49 TYR OH : rot 180:sc= 0 USER MOD Single : A 51 ASN : amide:sc=-0.00046 K(o=-0.00046,f=-2!) USER MOD Single : A 52 ASN :FLIP amide:sc= -0.371 F(o=-3.7!,f=-0.37) USER MOD Single : A 53 ASN : amide:sc= 0 X(o=0,f=-0.0038) USER MOD Single : A 58 SER OG : rot -44:sc= 0.391 USER MOD Single : A 61 SER OG : rot 130:sc= 0 USER MOD Single : A 62 ASN : amide:sc= -0.91 X(o=-0.91,f=-1.1) USER MOD Single : A 64 SER OG : rot -27:sc= 0.839 USER MOD Single : A 65 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 67 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 72 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 73 LYS NZ :NH3+ 160:sc= 1.15 (180deg=0.89) USER MOD Single : A 75 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 78 SER OG : rot 180:sc= 0.0432 USER MOD Single : A 82 ASN : amide:sc= -0.0583 X(o=-0.058,f=0) USER MOD Single : A 83 THR OG1 : rot -161:sc= 1.15 USER MOD Single : A 84 THR OG1 : rot 180:sc= 0 USER MOD Single : A 86 SER OG : rot 180:sc= 0.00944 USER MOD Single : A 90 SER OG : rot -29:sc= 0.539 USER MOD Single : A 92 LYS NZ :NH3+ -178:sc= 2.29 (180deg=2.25) USER MOD Single : A 93 THR OG1 : rot -160:sc= 0.161 USER MOD Single : A 95 THR OG1 : rot -73:sc= 1.17 USER MOD Single : A 96 SER OG : rot 180:sc= 0 USER MOD Single : A 97 LYS NZ :NH3+ -178:sc= 1.27 (180deg=1.15) USER MOD Single : A 99 LYS NZ :NH3+ 147:sc= 0.0145 (180deg=0) USER MOD Single : A 101 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 105 THR OG1 : rot 180:sc= 0.00102 USER MOD Single : A 108 GLN : amide:sc= -0.171 K(o=-0.17,f=-7.4!) USER MOD Single : A 109 THR OG1 : rot 70:sc= 0.809 USER MOD Single : A 111 THR OG1 : rot 180:sc= -0.0516 USER MOD Single : A 114 CYS SG : rot 16:sc= 0.26 USER MOD Single : A 115 ASN :FLIP amide:sc= 0 F(o=-1.6!,f=0) USER MOD Single : A 117 LYS NZ :NH3+ 170:sc= 1.24 (180deg=1.05) USER MOD Single : A 118 SER OG : rot 180:sc= 0 USER MOD Single : A 120 ASN : amide:sc= -0.0366 K(o=-0.037,f=-2.2!) USER MOD Single : A 121 THR OG1 : rot 180:sc= -0.0962 USER MOD Single : A 122 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 123 SER OG : rot 180:sc= 0 USER MOD Single : A 128 LYS NZ :NH3+ -161:sc= -0.0469 (180deg=-0.324) USER MOD Single : A 134 THR OG1 : rot 180:sc= 0 USER MOD Single : A 137 ASN : amide:sc= 0.516 K(o=0.52,f=-3.1!) USER MOD Single : A 139 THR OG1 : rot 16:sc= 0.701 USER MOD Single : A 140 THR OG1 : rot 180:sc= 0 USER MOD Single : A 142 LYS NZ :NH3+ -172:sc= 0 (180deg=-0.0729) USER MOD Single : A 148 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 27.774 2.154 11.394 1.00 24.55 N ATOM 2 CA GLY A 1 27.918 0.690 11.391 1.00 1.32 C ATOM 3 C GLY A 1 27.299 0.073 10.145 1.00 3.41 C ATOM 4 O GLY A 1 27.316 0.685 9.074 1.00 0.14 O ATOM 0 H1 GLY A 1 28.671 2.590 11.689 1.00 24.55 H new ATOM 0 H2 GLY A 1 27.528 2.481 10.438 1.00 24.55 H new ATOM 0 H3 GLY A 1 27.021 2.427 12.057 1.00 24.55 H new ATOM 0 HA2 GLY A 1 28.974 0.427 11.443 1.00 1.32 H new ATOM 0 HA3 GLY A 1 27.442 0.274 12.279 1.00 1.32 H new ATOM 8 N GLU A 2 26.798 -1.157 10.265 1.00 42.44 N ATOM 9 CA GLU A 2 26.314 -1.975 9.161 1.00 72.54 C ATOM 10 C GLU A 2 24.783 -1.951 9.140 1.00 42.42 C ATOM 11 O GLU A 2 24.149 -2.484 10.053 1.00 75.30 O ATOM 12 CB GLU A 2 26.777 -3.433 9.337 1.00 35.51 C ATOM 13 CG GLU A 2 28.287 -3.684 9.254 1.00 21.12 C ATOM 14 CD GLU A 2 28.544 -5.203 9.196 1.00 42.14 C ATOM 15 OE1 GLU A 2 28.447 -5.900 10.235 1.00 75.23 O ATOM 16 OE2 GLU A 2 28.731 -5.693 8.061 1.00 54.44 O ATOM 0 H GLU A 2 26.717 -1.625 11.168 1.00 42.44 H new ATOM 0 HA GLU A 2 26.712 -1.574 8.229 1.00 72.54 H new ATOM 0 HB2 GLU A 2 26.424 -3.789 10.305 1.00 35.51 H new ATOM 0 HB3 GLU A 2 26.287 -4.041 8.576 1.00 35.51 H new ATOM 0 HG2 GLU A 2 28.701 -3.199 8.370 1.00 21.12 H new ATOM 0 HG3 GLU A 2 28.788 -3.251 10.119 1.00 21.12 H new ATOM 23 N GLU A 3 24.165 -1.368 8.113 1.00 44.30 N ATOM 24 CA GLU A 3 22.726 -1.438 7.900 1.00 13.31 C ATOM 25 C GLU A 3 22.469 -1.385 6.393 1.00 22.31 C ATOM 26 O GLU A 3 23.042 -0.530 5.711 1.00 24.25 O ATOM 27 CB GLU A 3 22.056 -0.274 8.660 1.00 53.43 C ATOM 28 CG GLU A 3 20.782 -0.722 9.383 1.00 4.34 C ATOM 29 CD GLU A 3 19.575 -0.837 8.456 1.00 0.42 C ATOM 30 OE1 GLU A 3 19.057 0.225 8.033 1.00 51.41 O ATOM 31 OE2 GLU A 3 19.122 -1.965 8.157 1.00 41.21 O ATOM 0 H GLU A 3 24.657 -0.829 7.400 1.00 44.30 H new ATOM 0 HA GLU A 3 22.299 -2.365 8.284 1.00 13.31 H new ATOM 0 HB2 GLU A 3 22.758 0.139 9.384 1.00 53.43 H new ATOM 0 HB3 GLU A 3 21.814 0.525 7.960 1.00 53.43 H new ATOM 0 HG2 GLU A 3 20.961 -1.687 9.857 1.00 4.34 H new ATOM 0 HG3 GLU A 3 20.555 -0.013 10.179 1.00 4.34 H new ATOM 38 N LYS A 4 21.649 -2.296 5.866 1.00 52.11 N ATOM 39 CA LYS A 4 21.235 -2.347 4.466 1.00 33.13 C ATOM 40 C LYS A 4 19.828 -2.927 4.433 1.00 44.30 C ATOM 41 O LYS A 4 19.556 -3.923 5.110 1.00 52.43 O ATOM 42 CB LYS A 4 22.159 -3.255 3.626 1.00 53.33 C ATOM 43 CG LYS A 4 23.326 -2.505 2.961 1.00 52.10 C ATOM 44 CD LYS A 4 24.046 -3.360 1.901 1.00 0.45 C ATOM 45 CE LYS A 4 25.179 -4.203 2.501 1.00 4.02 C ATOM 46 NZ LYS A 4 25.236 -5.567 1.946 1.00 12.04 N ATOM 0 H LYS A 4 21.241 -3.045 6.425 1.00 52.11 H new ATOM 0 HA LYS A 4 21.281 -1.343 4.044 1.00 33.13 H new ATOM 0 HB2 LYS A 4 22.561 -4.040 4.266 1.00 53.33 H new ATOM 0 HB3 LYS A 4 21.567 -3.746 2.853 1.00 53.33 H new ATOM 0 HG2 LYS A 4 22.950 -1.594 2.495 1.00 52.10 H new ATOM 0 HG3 LYS A 4 24.041 -2.201 3.725 1.00 52.10 H new ATOM 0 HD2 LYS A 4 23.324 -4.018 1.417 1.00 0.45 H new ATOM 0 HD3 LYS A 4 24.452 -2.709 1.127 1.00 0.45 H new ATOM 0 HE2 LYS A 4 26.131 -3.703 2.321 1.00 4.02 H new ATOM 0 HE3 LYS A 4 25.048 -4.261 3.582 1.00 4.02 H new ATOM 0 HZ1 LYS A 4 26.019 -6.089 2.388 1.00 12.04 H new ATOM 0 HZ2 LYS A 4 24.340 -6.058 2.139 1.00 12.04 H new ATOM 0 HZ3 LYS A 4 25.389 -5.518 0.918 1.00 12.04 H new ATOM 60 N MET A 5 18.966 -2.346 3.605 1.00 34.23 N ATOM 61 CA MET A 5 17.654 -2.885 3.298 1.00 24.14 C ATOM 62 C MET A 5 17.750 -3.607 1.959 1.00 60.24 C ATOM 63 O MET A 5 18.555 -3.233 1.108 1.00 4.33 O ATOM 64 CB MET A 5 16.658 -1.717 3.235 1.00 1.32 C ATOM 65 CG MET A 5 15.199 -2.160 3.316 1.00 3.23 C ATOM 66 SD MET A 5 14.006 -0.808 3.460 1.00 32.23 S ATOM 67 CE MET A 5 14.382 0.085 1.935 1.00 55.20 C ATOM 0 H MET A 5 19.168 -1.471 3.121 1.00 34.23 H new ATOM 0 HA MET A 5 17.313 -3.590 4.056 1.00 24.14 H new ATOM 0 HB2 MET A 5 16.866 -1.027 4.052 1.00 1.32 H new ATOM 0 HB3 MET A 5 16.812 -1.167 2.307 1.00 1.32 H new ATOM 0 HG2 MET A 5 14.961 -2.744 2.427 1.00 3.23 H new ATOM 0 HG3 MET A 5 15.082 -2.823 4.173 1.00 3.23 H new ATOM 0 HE1 MET A 5 13.645 0.873 1.784 1.00 55.20 H new ATOM 0 HE2 MET A 5 15.376 0.527 2.008 1.00 55.20 H new ATOM 0 HE3 MET A 5 14.353 -0.606 1.092 1.00 55.20 H new ATOM 77 N THR A 6 16.866 -4.563 1.723 1.00 4.23 N ATOM 78 CA THR A 6 16.642 -5.227 0.448 1.00 53.34 C ATOM 79 C THR A 6 15.144 -5.132 0.132 1.00 23.51 C ATOM 80 O THR A 6 14.380 -4.585 0.931 1.00 43.11 O ATOM 81 CB THR A 6 17.087 -6.687 0.605 1.00 53.40 C ATOM 82 OG1 THR A 6 16.331 -7.232 1.669 1.00 42.44 O ATOM 83 CG2 THR A 6 18.584 -6.800 0.899 1.00 61.14 C ATOM 0 H THR A 6 16.251 -4.916 2.456 1.00 4.23 H new ATOM 0 HA THR A 6 17.204 -4.770 -0.367 1.00 53.34 H new ATOM 0 HB THR A 6 16.917 -7.230 -0.324 1.00 53.40 H new ATOM 0 HG1 THR A 6 16.737 -6.976 2.523 1.00 42.44 H new ATOM 0 HG21 THR A 6 18.856 -7.850 1.003 1.00 61.14 H new ATOM 0 HG22 THR A 6 19.150 -6.358 0.079 1.00 61.14 H new ATOM 0 HG23 THR A 6 18.814 -6.273 1.825 1.00 61.14 H new ATOM 91 N ASN A 7 14.679 -5.724 -0.972 1.00 15.12 N ATOM 92 CA ASN A 7 13.262 -6.057 -1.127 1.00 40.03 C ATOM 93 C ASN A 7 12.767 -6.846 0.076 1.00 60.40 C ATOM 94 O ASN A 7 11.806 -6.398 0.696 1.00 12.01 O ATOM 95 CB ASN A 7 13.017 -6.795 -2.454 1.00 22.22 C ATOM 96 CG ASN A 7 12.845 -5.875 -3.651 1.00 61.40 C ATOM 97 OD1 ASN A 7 13.006 -4.573 -3.467 1.00 13.43 O flip ATOM 98 ND2 ASN A 7 12.577 -6.332 -4.757 1.00 62.11 N flip ATOM 0 H ASN A 7 15.262 -5.981 -1.769 1.00 15.12 H new ATOM 0 HA ASN A 7 12.683 -5.134 -1.167 1.00 40.03 H new ATOM 0 HB2 ASN A 7 13.853 -7.468 -2.643 1.00 22.22 H new ATOM 0 HB3 ASN A 7 12.126 -7.415 -2.354 1.00 22.22 H new ATOM 0 HD21 ASN A 7 12.457 -7.338 -4.878 1.00 62.11 H new ATOM 0 HD22 ASN A 7 12.474 -5.706 -5.556 1.00 62.11 H new ATOM 105 N GLY A 8 13.489 -7.916 0.433 1.00 22.31 N ATOM 106 CA GLY A 8 13.291 -8.765 1.611 1.00 41.43 C ATOM 107 C GLY A 8 13.180 -8.045 2.960 1.00 42.30 C ATOM 108 O GLY A 8 12.937 -8.698 3.975 1.00 43.00 O ATOM 0 H GLY A 8 14.278 -8.231 -0.131 1.00 22.31 H new ATOM 0 HA2 GLY A 8 12.384 -9.351 1.461 1.00 41.43 H new ATOM 0 HA3 GLY A 8 14.121 -9.470 1.667 1.00 41.43 H new ATOM 112 N GLN A 9 13.403 -6.729 3.041 1.00 0.35 N ATOM 113 CA GLN A 9 13.024 -5.923 4.187 1.00 33.35 C ATOM 114 C GLN A 9 12.043 -4.809 3.793 1.00 4.33 C ATOM 115 O GLN A 9 11.122 -4.530 4.551 1.00 11.21 O ATOM 116 CB GLN A 9 14.314 -5.386 4.798 1.00 61.20 C ATOM 117 CG GLN A 9 15.192 -6.467 5.450 1.00 40.30 C ATOM 118 CD GLN A 9 16.633 -6.005 5.388 1.00 40.03 C ATOM 119 OE1 GLN A 9 17.433 -6.483 4.595 1.00 55.11 O ATOM 120 NE2 GLN A 9 16.976 -4.961 6.105 1.00 63.24 N ATOM 0 H GLN A 9 13.857 -6.196 2.300 1.00 0.35 H new ATOM 0 HA GLN A 9 12.489 -6.520 4.925 1.00 33.35 H new ATOM 0 HB2 GLN A 9 14.890 -4.883 4.021 1.00 61.20 H new ATOM 0 HB3 GLN A 9 14.064 -4.634 5.547 1.00 61.20 H new ATOM 0 HG2 GLN A 9 14.889 -6.630 6.484 1.00 40.30 H new ATOM 0 HG3 GLN A 9 15.075 -7.417 4.930 1.00 40.30 H new ATOM 0 HE21 GLN A 9 16.314 -4.558 6.768 1.00 63.24 H new ATOM 0 HE22 GLN A 9 17.905 -4.553 6.000 1.00 63.24 H new ATOM 129 N LEU A 10 12.213 -4.146 2.644 1.00 33.54 N ATOM 130 CA LEU A 10 11.376 -3.054 2.169 1.00 1.03 C ATOM 131 C LEU A 10 9.917 -3.462 2.077 1.00 51.23 C ATOM 132 O LEU A 10 9.053 -2.854 2.709 1.00 1.12 O ATOM 133 CB LEU A 10 11.876 -2.584 0.791 1.00 61.54 C ATOM 134 CG LEU A 10 11.050 -1.430 0.189 1.00 21.51 C ATOM 135 CD1 LEU A 10 10.770 -0.307 1.194 1.00 33.54 C ATOM 136 CD2 LEU A 10 11.801 -0.877 -1.024 1.00 55.34 C ATOM 0 H LEU A 10 12.970 -4.369 1.998 1.00 33.54 H new ATOM 0 HA LEU A 10 11.446 -2.238 2.888 1.00 1.03 H new ATOM 0 HB2 LEU A 10 12.915 -2.266 0.881 1.00 61.54 H new ATOM 0 HB3 LEU A 10 11.859 -3.428 0.102 1.00 61.54 H new ATOM 0 HG LEU A 10 10.078 -1.828 -0.103 1.00 21.51 H new ATOM 0 HD11 LEU A 10 10.185 0.476 0.711 1.00 33.54 H new ATOM 0 HD12 LEU A 10 10.212 -0.707 2.041 1.00 33.54 H new ATOM 0 HD13 LEU A 10 11.714 0.110 1.546 1.00 33.54 H new ATOM 0 HD21 LEU A 10 11.230 -0.059 -1.463 1.00 55.34 H new ATOM 0 HD22 LEU A 10 12.779 -0.511 -0.711 1.00 55.34 H new ATOM 0 HD23 LEU A 10 11.930 -1.667 -1.764 1.00 55.34 H new ATOM 148 N TRP A 11 9.643 -4.454 1.236 1.00 32.43 N ATOM 149 CA TRP A 11 8.274 -4.879 1.000 1.00 13.01 C ATOM 150 C TRP A 11 7.658 -5.355 2.311 1.00 24.14 C ATOM 151 O TRP A 11 6.520 -4.994 2.587 1.00 51.41 O ATOM 152 CB TRP A 11 8.212 -5.922 -0.113 1.00 53.41 C ATOM 153 CG TRP A 11 6.857 -6.503 -0.372 1.00 51.30 C ATOM 154 CD1 TRP A 11 5.973 -6.142 -1.327 1.00 52.24 C ATOM 155 CD2 TRP A 11 6.218 -7.581 0.358 1.00 24.43 C ATOM 156 NE1 TRP A 11 4.839 -6.923 -1.219 1.00 23.31 N ATOM 157 CE2 TRP A 11 4.923 -7.819 -0.175 1.00 2.13 C ATOM 158 CE3 TRP A 11 6.645 -8.380 1.425 1.00 11.05 C ATOM 159 CZ2 TRP A 11 4.075 -8.809 0.349 1.00 52.44 C ATOM 160 CZ3 TRP A 11 5.799 -9.345 1.998 1.00 11.21 C ATOM 161 CH2 TRP A 11 4.509 -9.549 1.470 1.00 44.05 C ATOM 0 H TRP A 11 10.347 -4.973 0.712 1.00 32.43 H new ATOM 0 HA TRP A 11 7.678 -4.037 0.649 1.00 13.01 H new ATOM 0 HB2 TRP A 11 8.576 -5.468 -1.034 1.00 53.41 H new ATOM 0 HB3 TRP A 11 8.896 -6.734 0.134 1.00 53.41 H new ATOM 0 HD1 TRP A 11 6.128 -5.364 -2.060 1.00 52.24 H new ATOM 0 HE1 TRP A 11 4.033 -6.846 -1.840 1.00 23.31 H new ATOM 0 HE3 TRP A 11 7.644 -8.252 1.815 1.00 11.05 H new ATOM 0 HZ2 TRP A 11 3.110 -9.000 -0.097 1.00 52.44 H new ATOM 0 HZ3 TRP A 11 6.137 -9.929 2.841 1.00 11.21 H new ATOM 0 HH2 TRP A 11 3.850 -10.274 1.924 1.00 44.05 H new ATOM 172 N LYS A 12 8.406 -6.060 3.168 1.00 31.34 N ATOM 173 CA LYS A 12 7.917 -6.454 4.489 1.00 62.22 C ATOM 174 C LYS A 12 7.519 -5.250 5.340 1.00 2.02 C ATOM 175 O LYS A 12 6.422 -5.241 5.891 1.00 35.25 O ATOM 176 CB LYS A 12 8.953 -7.327 5.208 1.00 61.31 C ATOM 177 CG LYS A 12 8.287 -8.543 5.871 1.00 15.01 C ATOM 178 CD LYS A 12 7.434 -8.276 7.116 1.00 1.02 C ATOM 179 CE LYS A 12 8.236 -8.298 8.419 1.00 41.01 C ATOM 180 NZ LYS A 12 9.148 -7.158 8.624 1.00 32.12 N ATOM 0 H LYS A 12 9.357 -6.369 2.966 1.00 31.34 H new ATOM 0 HA LYS A 12 7.012 -7.044 4.341 1.00 62.22 H new ATOM 0 HB2 LYS A 12 9.706 -7.664 4.496 1.00 61.31 H new ATOM 0 HB3 LYS A 12 9.471 -6.735 5.963 1.00 61.31 H new ATOM 0 HG2 LYS A 12 7.657 -9.032 5.127 1.00 15.01 H new ATOM 0 HG3 LYS A 12 9.069 -9.252 6.142 1.00 15.01 H new ATOM 0 HD2 LYS A 12 6.949 -7.305 7.013 1.00 1.02 H new ATOM 0 HD3 LYS A 12 6.643 -9.024 7.172 1.00 1.02 H new ATOM 0 HE2 LYS A 12 7.537 -8.336 9.254 1.00 41.01 H new ATOM 0 HE3 LYS A 12 8.820 -9.218 8.450 1.00 41.01 H new ATOM 0 HZ1 LYS A 12 9.460 -7.137 9.616 1.00 32.12 H new ATOM 0 HZ2 LYS A 12 9.976 -7.259 8.002 1.00 32.12 H new ATOM 0 HZ3 LYS A 12 8.652 -6.272 8.399 1.00 32.12 H new ATOM 194 N LYS A 13 8.383 -4.236 5.460 1.00 21.45 N ATOM 195 CA LYS A 13 8.070 -2.998 6.187 1.00 75.33 C ATOM 196 C LYS A 13 6.711 -2.463 5.735 1.00 3.02 C ATOM 197 O LYS A 13 5.844 -2.243 6.583 1.00 60.42 O ATOM 198 CB LYS A 13 9.173 -1.937 6.005 1.00 52.41 C ATOM 199 CG LYS A 13 10.472 -2.309 6.735 1.00 60.42 C ATOM 200 CD LYS A 13 11.699 -1.529 6.234 1.00 60.50 C ATOM 201 CE LYS A 13 12.945 -2.254 6.750 1.00 12.25 C ATOM 202 NZ LYS A 13 14.209 -1.494 6.626 1.00 4.04 N ATOM 0 H LYS A 13 9.320 -4.249 5.056 1.00 21.45 H new ATOM 0 HA LYS A 13 8.023 -3.227 7.252 1.00 75.33 H new ATOM 0 HB2 LYS A 13 9.380 -1.811 4.942 1.00 52.41 H new ATOM 0 HB3 LYS A 13 8.814 -0.977 6.375 1.00 52.41 H new ATOM 0 HG2 LYS A 13 10.345 -2.126 7.802 1.00 60.42 H new ATOM 0 HG3 LYS A 13 10.655 -3.377 6.614 1.00 60.42 H new ATOM 0 HD2 LYS A 13 11.706 -1.482 5.145 1.00 60.50 H new ATOM 0 HD3 LYS A 13 11.675 -0.501 6.597 1.00 60.50 H new ATOM 0 HE2 LYS A 13 12.792 -2.506 7.799 1.00 12.25 H new ATOM 0 HE3 LYS A 13 13.050 -3.194 6.209 1.00 12.25 H new ATOM 0 HZ1 LYS A 13 15.007 -2.100 6.905 1.00 4.04 H new ATOM 0 HZ2 LYS A 13 14.335 -1.188 5.640 1.00 4.04 H new ATOM 0 HZ3 LYS A 13 14.175 -0.660 7.246 1.00 4.04 H new ATOM 216 N VAL A 14 6.513 -2.308 4.423 1.00 3.41 N ATOM 217 CA VAL A 14 5.261 -1.830 3.843 1.00 0.41 C ATOM 218 C VAL A 14 4.118 -2.803 4.155 1.00 14.01 C ATOM 219 O VAL A 14 3.054 -2.359 4.573 1.00 61.32 O ATOM 220 CB VAL A 14 5.444 -1.577 2.330 1.00 62.12 C ATOM 221 CG1 VAL A 14 4.146 -1.124 1.645 1.00 21.55 C ATOM 222 CG2 VAL A 14 6.506 -0.493 2.087 1.00 75.44 C ATOM 0 H VAL A 14 7.229 -2.515 3.727 1.00 3.41 H new ATOM 0 HA VAL A 14 4.986 -0.877 4.295 1.00 0.41 H new ATOM 0 HB VAL A 14 5.755 -2.530 1.902 1.00 62.12 H new ATOM 0 HG11 VAL A 14 4.333 -0.961 0.584 1.00 21.55 H new ATOM 0 HG12 VAL A 14 3.383 -1.893 1.765 1.00 21.55 H new ATOM 0 HG13 VAL A 14 3.800 -0.196 2.099 1.00 21.55 H new ATOM 0 HG21 VAL A 14 6.620 -0.329 1.015 1.00 75.44 H new ATOM 0 HG22 VAL A 14 6.194 0.436 2.565 1.00 75.44 H new ATOM 0 HG23 VAL A 14 7.458 -0.816 2.508 1.00 75.44 H new ATOM 232 N LYS A 15 4.313 -4.115 3.998 1.00 23.42 N ATOM 233 CA LYS A 15 3.301 -5.148 4.221 1.00 23.23 C ATOM 234 C LYS A 15 2.689 -4.948 5.599 1.00 12.15 C ATOM 235 O LYS A 15 1.472 -4.797 5.730 1.00 32.23 O ATOM 236 CB LYS A 15 3.941 -6.548 4.074 1.00 72.10 C ATOM 237 CG LYS A 15 2.974 -7.703 4.375 1.00 35.24 C ATOM 238 CD LYS A 15 3.619 -8.807 5.223 1.00 42.22 C ATOM 239 CE LYS A 15 2.554 -9.901 5.362 1.00 74.12 C ATOM 240 NZ LYS A 15 3.072 -11.238 5.713 1.00 55.04 N ATOM 0 H LYS A 15 5.210 -4.499 3.702 1.00 23.42 H new ATOM 0 HA LYS A 15 2.507 -5.071 3.478 1.00 23.23 H new ATOM 0 HB2 LYS A 15 4.321 -6.659 3.059 1.00 72.10 H new ATOM 0 HB3 LYS A 15 4.797 -6.619 4.745 1.00 72.10 H new ATOM 0 HG2 LYS A 15 2.100 -7.313 4.897 1.00 35.24 H new ATOM 0 HG3 LYS A 15 2.621 -8.130 3.436 1.00 35.24 H new ATOM 0 HD2 LYS A 15 4.518 -9.194 4.743 1.00 42.22 H new ATOM 0 HD3 LYS A 15 3.918 -8.426 6.199 1.00 42.22 H new ATOM 0 HE2 LYS A 15 1.838 -9.594 6.124 1.00 74.12 H new ATOM 0 HE3 LYS A 15 2.007 -9.976 4.422 1.00 74.12 H new ATOM 0 HZ1 LYS A 15 2.307 -11.938 5.636 1.00 55.04 H new ATOM 0 HZ2 LYS A 15 3.842 -11.494 5.063 1.00 55.04 H new ATOM 0 HZ3 LYS A 15 3.432 -11.226 6.688 1.00 55.04 H new ATOM 254 N ASP A 16 3.551 -4.929 6.612 1.00 15.14 N ATOM 255 CA ASP A 16 3.186 -4.812 8.016 1.00 61.42 C ATOM 256 C ASP A 16 2.418 -3.518 8.310 1.00 43.23 C ATOM 257 O ASP A 16 1.620 -3.490 9.246 1.00 40.30 O ATOM 258 CB ASP A 16 4.445 -4.897 8.889 1.00 71.31 C ATOM 259 CG ASP A 16 4.670 -6.245 9.568 1.00 42.03 C ATOM 260 OD1 ASP A 16 3.712 -6.853 10.096 1.00 34.13 O ATOM 261 OD2 ASP A 16 5.853 -6.651 9.652 1.00 40.13 O ATOM 0 H ASP A 16 4.559 -4.997 6.470 1.00 15.14 H new ATOM 0 HA ASP A 16 2.519 -5.640 8.255 1.00 61.42 H new ATOM 0 HB2 ASP A 16 5.313 -4.669 8.271 1.00 71.31 H new ATOM 0 HB3 ASP A 16 4.389 -4.125 9.657 1.00 71.31 H new ATOM 266 N SER A 17 2.616 -2.452 7.527 1.00 13.32 N ATOM 267 CA SER A 17 1.922 -1.180 7.714 1.00 53.32 C ATOM 268 C SER A 17 0.423 -1.279 7.463 1.00 13.02 C ATOM 269 O SER A 17 -0.345 -0.613 8.151 1.00 34.24 O ATOM 270 CB SER A 17 2.540 -0.125 6.791 1.00 22.53 C ATOM 271 OG SER A 17 3.911 0.018 7.129 1.00 33.34 O ATOM 0 H SER A 17 3.267 -2.451 6.742 1.00 13.32 H new ATOM 0 HA SER A 17 2.045 -0.892 8.758 1.00 53.32 H new ATOM 0 HB2 SER A 17 2.436 -0.425 5.748 1.00 22.53 H new ATOM 0 HB3 SER A 17 2.021 0.827 6.902 1.00 22.53 H new ATOM 0 HG SER A 17 4.406 -0.774 6.832 1.00 33.34 H new ATOM 277 N LEU A 18 -0.006 -2.093 6.493 1.00 13.43 N ATOM 278 CA LEU A 18 -1.428 -2.219 6.202 1.00 14.14 C ATOM 279 C LEU A 18 -2.135 -3.025 7.285 1.00 75.34 C ATOM 280 O LEU A 18 -3.321 -2.781 7.484 1.00 54.41 O ATOM 281 CB LEU A 18 -1.703 -2.784 4.799 1.00 15.23 C ATOM 282 CG LEU A 18 -1.347 -1.865 3.604 1.00 31.55 C ATOM 283 CD1 LEU A 18 -1.443 -0.359 3.901 1.00 3.15 C ATOM 284 CD2 LEU A 18 0.050 -2.157 3.052 1.00 42.03 C ATOM 0 H LEU A 18 0.604 -2.664 5.907 1.00 13.43 H new ATOM 0 HA LEU A 18 -1.843 -1.211 6.205 1.00 14.14 H new ATOM 0 HB2 LEU A 18 -1.147 -3.715 4.691 1.00 15.23 H new ATOM 0 HB3 LEU A 18 -2.762 -3.035 4.733 1.00 15.23 H new ATOM 0 HG LEU A 18 -2.109 -2.105 2.863 1.00 31.55 H new ATOM 0 HD11 LEU A 18 -1.176 0.206 3.008 1.00 3.15 H new ATOM 0 HD12 LEU A 18 -2.462 -0.111 4.196 1.00 3.15 H new ATOM 0 HD13 LEU A 18 -0.758 -0.103 4.710 1.00 3.15 H new ATOM 0 HD21 LEU A 18 0.258 -1.490 2.216 1.00 42.03 H new ATOM 0 HD22 LEU A 18 0.791 -1.998 3.835 1.00 42.03 H new ATOM 0 HD23 LEU A 18 0.098 -3.191 2.711 1.00 42.03 H new ATOM 296 N ILE A 19 -1.422 -3.921 7.983 1.00 75.30 N ATOM 297 CA ILE A 19 -1.981 -4.879 8.940 1.00 64.14 C ATOM 298 C ILE A 19 -2.721 -4.183 10.083 1.00 23.44 C ATOM 299 O ILE A 19 -3.754 -4.686 10.522 1.00 1.20 O ATOM 300 CB ILE A 19 -0.862 -5.777 9.521 1.00 64.53 C ATOM 301 CG1 ILE A 19 -0.035 -6.560 8.480 1.00 0.00 C ATOM 302 CG2 ILE A 19 -1.395 -6.720 10.610 1.00 4.04 C ATOM 303 CD1 ILE A 19 -0.746 -7.734 7.812 1.00 54.31 C ATOM 0 H ILE A 19 -0.409 -3.999 7.892 1.00 75.30 H new ATOM 0 HA ILE A 19 -2.700 -5.492 8.396 1.00 64.14 H new ATOM 0 HB ILE A 19 -0.164 -5.069 9.967 1.00 64.53 H new ATOM 0 HG12 ILE A 19 0.287 -5.866 7.704 1.00 0.00 H new ATOM 0 HG13 ILE A 19 0.865 -6.935 8.967 1.00 0.00 H new ATOM 0 HG21 ILE A 19 -0.579 -7.333 10.992 1.00 4.04 H new ATOM 0 HG22 ILE A 19 -1.819 -6.133 11.424 1.00 4.04 H new ATOM 0 HG23 ILE A 19 -2.166 -7.365 10.188 1.00 4.04 H new ATOM 0 HD11 ILE A 19 -0.072 -8.210 7.100 1.00 54.31 H new ATOM 0 HD12 ILE A 19 -1.044 -8.458 8.570 1.00 54.31 H new ATOM 0 HD13 ILE A 19 -1.631 -7.373 7.288 1.00 54.31 H new ATOM 315 N ASP A 20 -2.149 -3.100 10.609 1.00 41.41 N ATOM 316 CA ASP A 20 -2.718 -2.305 11.700 1.00 43.20 C ATOM 317 C ASP A 20 -4.079 -1.754 11.289 1.00 22.44 C ATOM 318 O ASP A 20 -5.060 -1.806 12.033 1.00 41.44 O ATOM 319 CB ASP A 20 -1.777 -1.136 12.031 1.00 54.12 C ATOM 320 CG ASP A 20 -2.254 -0.279 13.206 1.00 43.11 C ATOM 321 OD1 ASP A 20 -3.071 -0.730 14.036 1.00 60.53 O ATOM 322 OD2 ASP A 20 -1.809 0.884 13.310 1.00 74.14 O ATOM 0 H ASP A 20 -1.253 -2.741 10.280 1.00 41.41 H new ATOM 0 HA ASP A 20 -2.837 -2.941 12.577 1.00 43.20 H new ATOM 0 HB2 ASP A 20 -0.787 -1.531 12.259 1.00 54.12 H new ATOM 0 HB3 ASP A 20 -1.673 -0.503 11.149 1.00 54.12 H new ATOM 327 N SER A 21 -4.145 -1.236 10.070 1.00 14.44 N ATOM 328 CA SER A 21 -5.382 -0.819 9.432 1.00 61.13 C ATOM 329 C SER A 21 -6.124 -2.032 8.826 1.00 61.32 C ATOM 330 O SER A 21 -5.728 -3.181 9.027 1.00 55.21 O ATOM 331 CB SER A 21 -5.035 0.269 8.419 1.00 43.04 C ATOM 332 OG SER A 21 -3.828 -0.005 7.717 1.00 11.12 O ATOM 0 H SER A 21 -3.321 -1.092 9.486 1.00 14.44 H new ATOM 0 HA SER A 21 -6.083 -0.399 10.154 1.00 61.13 H new ATOM 0 HB2 SER A 21 -5.852 0.370 7.705 1.00 43.04 H new ATOM 0 HB3 SER A 21 -4.943 1.225 8.935 1.00 43.04 H new ATOM 0 HG SER A 21 -3.734 -0.973 7.593 1.00 11.12 H new ATOM 338 N ASN A 22 -7.183 -1.807 8.045 1.00 62.23 N ATOM 339 CA ASN A 22 -8.014 -2.847 7.437 1.00 53.04 C ATOM 340 C ASN A 22 -8.058 -2.677 5.911 1.00 63.44 C ATOM 341 O ASN A 22 -9.121 -2.667 5.292 1.00 0.44 O ATOM 342 CB ASN A 22 -9.391 -2.811 8.116 1.00 63.53 C ATOM 343 CG ASN A 22 -10.314 -3.964 7.722 1.00 61.52 C ATOM 344 OD1 ASN A 22 -9.891 -5.015 7.244 1.00 71.43 O ATOM 345 ND2 ASN A 22 -11.616 -3.767 7.894 1.00 62.24 N ATOM 0 H ASN A 22 -7.495 -0.865 7.811 1.00 62.23 H new ATOM 0 HA ASN A 22 -7.594 -3.840 7.597 1.00 53.04 H new ATOM 0 HB2 ASN A 22 -9.251 -2.825 9.197 1.00 63.53 H new ATOM 0 HB3 ASN A 22 -9.880 -1.868 7.870 1.00 63.53 H new ATOM 0 HD21 ASN A 22 -12.281 -4.493 7.628 1.00 62.24 H new ATOM 0 HD22 ASN A 22 -11.951 -2.890 8.292 1.00 62.24 H new ATOM 352 N ILE A 23 -6.910 -2.443 5.277 1.00 42.04 N ATOM 353 CA ILE A 23 -6.822 -2.317 3.826 1.00 43.03 C ATOM 354 C ILE A 23 -6.872 -3.714 3.206 1.00 61.25 C ATOM 355 O ILE A 23 -7.632 -3.946 2.268 1.00 3.50 O ATOM 356 CB ILE A 23 -5.546 -1.552 3.427 1.00 22.53 C ATOM 357 CG1 ILE A 23 -5.640 -0.046 3.728 1.00 11.33 C ATOM 358 CG2 ILE A 23 -5.244 -1.627 1.917 1.00 12.22 C ATOM 359 CD1 ILE A 23 -5.950 0.347 5.160 1.00 35.51 C ATOM 0 H ILE A 23 -6.016 -2.336 5.756 1.00 42.04 H new ATOM 0 HA ILE A 23 -7.666 -1.740 3.447 1.00 43.03 H new ATOM 0 HB ILE A 23 -4.768 -2.038 4.016 1.00 22.53 H new ATOM 0 HG12 ILE A 23 -4.694 0.417 3.446 1.00 11.33 H new ATOM 0 HG13 ILE A 23 -6.409 0.382 3.084 1.00 11.33 H new ATOM 0 HG21 ILE A 23 -4.333 -1.069 1.700 1.00 12.22 H new ATOM 0 HG22 ILE A 23 -5.110 -2.668 1.624 1.00 12.22 H new ATOM 0 HG23 ILE A 23 -6.075 -1.197 1.358 1.00 12.22 H new ATOM 0 HD11 ILE A 23 -5.989 1.433 5.239 1.00 35.51 H new ATOM 0 HD12 ILE A 23 -6.913 -0.073 5.452 1.00 35.51 H new ATOM 0 HD13 ILE A 23 -5.172 -0.037 5.819 1.00 35.51 H new ATOM 371 N ILE A 24 -6.035 -4.611 3.716 1.00 20.53 N ATOM 372 CA ILE A 24 -5.798 -5.949 3.198 1.00 14.02 C ATOM 373 C ILE A 24 -6.600 -6.951 4.017 1.00 73.52 C ATOM 374 O ILE A 24 -7.375 -6.576 4.896 1.00 55.41 O ATOM 375 CB ILE A 24 -4.282 -6.245 3.148 1.00 44.11 C ATOM 376 CG1 ILE A 24 -3.513 -5.973 4.460 1.00 23.53 C ATOM 377 CG2 ILE A 24 -3.620 -5.325 2.096 1.00 63.53 C ATOM 378 CD1 ILE A 24 -3.688 -6.998 5.576 1.00 34.43 C ATOM 0 H ILE A 24 -5.476 -4.412 4.545 1.00 20.53 H new ATOM 0 HA ILE A 24 -6.146 -6.033 2.168 1.00 14.02 H new ATOM 0 HB ILE A 24 -4.221 -7.310 2.925 1.00 44.11 H new ATOM 0 HG12 ILE A 24 -2.451 -5.903 4.225 1.00 23.53 H new ATOM 0 HG13 ILE A 24 -3.821 -4.999 4.840 1.00 23.53 H new ATOM 0 HG21 ILE A 24 -2.550 -5.529 2.056 1.00 63.53 H new ATOM 0 HG22 ILE A 24 -4.062 -5.514 1.118 1.00 63.53 H new ATOM 0 HG23 ILE A 24 -3.780 -4.283 2.372 1.00 63.53 H new ATOM 0 HD11 ILE A 24 -3.100 -6.696 6.443 1.00 34.43 H new ATOM 0 HD12 ILE A 24 -4.740 -7.057 5.854 1.00 34.43 H new ATOM 0 HD13 ILE A 24 -3.349 -7.974 5.230 1.00 34.43 H new ATOM 390 N SER A 25 -6.443 -8.232 3.710 1.00 60.13 N ATOM 391 CA SER A 25 -6.805 -9.357 4.555 1.00 13.20 C ATOM 392 C SER A 25 -5.562 -10.010 5.183 1.00 21.13 C ATOM 393 O SER A 25 -5.639 -10.473 6.322 1.00 42.31 O ATOM 394 CB SER A 25 -7.575 -10.361 3.701 1.00 33.30 C ATOM 395 OG SER A 25 -8.968 -10.080 3.726 1.00 23.31 O ATOM 0 H SER A 25 -6.040 -8.527 2.821 1.00 60.13 H new ATOM 0 HA SER A 25 -7.427 -9.010 5.380 1.00 13.20 H new ATOM 0 HB2 SER A 25 -7.211 -10.327 2.674 1.00 33.30 H new ATOM 0 HB3 SER A 25 -7.396 -11.371 4.069 1.00 33.30 H new ATOM 0 HG SER A 25 -9.222 -9.611 2.904 1.00 23.31 H new ATOM 401 N GLY A 26 -4.405 -9.988 4.521 1.00 42.03 N ATOM 402 CA GLY A 26 -3.178 -10.633 4.966 1.00 4.11 C ATOM 403 C GLY A 26 -3.069 -12.103 4.571 1.00 32.24 C ATOM 404 O GLY A 26 -2.369 -12.852 5.256 1.00 53.45 O ATOM 0 H GLY A 26 -4.297 -9.503 3.630 1.00 42.03 H new ATOM 0 HA2 GLY A 26 -2.326 -10.093 4.554 1.00 4.11 H new ATOM 0 HA3 GLY A 26 -3.111 -10.553 6.051 1.00 4.11 H new ATOM 408 N ASN A 27 -3.743 -12.532 3.504 1.00 1.20 N ATOM 409 CA ASN A 27 -3.909 -13.945 3.163 1.00 22.31 C ATOM 410 C ASN A 27 -3.252 -14.259 1.819 1.00 1.31 C ATOM 411 O ASN A 27 -2.589 -13.404 1.229 1.00 41.14 O ATOM 412 CB ASN A 27 -5.398 -14.316 3.177 1.00 61.43 C ATOM 413 CG ASN A 27 -6.051 -14.204 4.547 1.00 64.55 C ATOM 414 OD1 ASN A 27 -5.411 -14.261 5.594 1.00 42.12 O ATOM 415 ND2 ASN A 27 -7.355 -14.027 4.577 1.00 23.23 N ATOM 0 H ASN A 27 -4.195 -11.900 2.844 1.00 1.20 H new ATOM 0 HA ASN A 27 -3.406 -14.556 3.913 1.00 22.31 H new ATOM 0 HB2 ASN A 27 -5.930 -13.670 2.479 1.00 61.43 H new ATOM 0 HB3 ASN A 27 -5.511 -15.338 2.815 1.00 61.43 H new ATOM 0 HD21 ASN A 27 -7.837 -13.937 5.471 1.00 23.23 H new ATOM 0 HD22 ASN A 27 -7.883 -13.980 3.706 1.00 23.23 H new ATOM 422 N GLU A 28 -3.382 -15.504 1.345 1.00 43.13 N ATOM 423 CA GLU A 28 -2.805 -15.949 0.068 1.00 54.11 C ATOM 424 C GLU A 28 -3.526 -15.307 -1.115 1.00 51.11 C ATOM 425 O GLU A 28 -3.000 -15.227 -2.221 1.00 61.23 O ATOM 426 CB GLU A 28 -2.848 -17.491 -0.027 1.00 22.24 C ATOM 427 CG GLU A 28 -4.229 -18.104 -0.374 1.00 74.04 C ATOM 428 CD GLU A 28 -4.565 -18.149 -1.872 1.00 63.42 C ATOM 429 OE1 GLU A 28 -3.893 -18.861 -2.653 1.00 23.30 O ATOM 430 OE2 GLU A 28 -5.591 -17.556 -2.284 1.00 32.01 O ATOM 0 H GLU A 28 -3.893 -16.236 1.838 1.00 43.13 H new ATOM 0 HA GLU A 28 -1.764 -15.629 0.030 1.00 54.11 H new ATOM 0 HB2 GLU A 28 -2.129 -17.811 -0.781 1.00 22.24 H new ATOM 0 HB3 GLU A 28 -2.516 -17.905 0.925 1.00 22.24 H new ATOM 0 HG2 GLU A 28 -4.268 -19.119 0.022 1.00 74.04 H new ATOM 0 HG3 GLU A 28 -5.002 -17.532 0.139 1.00 74.04 H new ATOM 437 N ASN A 29 -4.747 -14.840 -0.879 1.00 20.31 N ATOM 438 CA ASN A 29 -5.680 -14.447 -1.916 1.00 44.45 C ATOM 439 C ASN A 29 -5.561 -12.957 -2.235 1.00 24.02 C ATOM 440 O ASN A 29 -6.533 -12.319 -2.634 1.00 53.45 O ATOM 441 CB ASN A 29 -7.091 -14.890 -1.510 1.00 41.51 C ATOM 442 CG ASN A 29 -7.730 -14.069 -0.402 1.00 21.03 C ATOM 443 OD1 ASN A 29 -7.078 -13.363 0.356 1.00 44.41 O ATOM 444 ND2 ASN A 29 -9.023 -14.243 -0.199 1.00 34.10 N ATOM 0 H ASN A 29 -5.120 -14.723 0.063 1.00 20.31 H new ATOM 0 HA ASN A 29 -5.439 -14.950 -2.852 1.00 44.45 H new ATOM 0 HB2 ASN A 29 -7.735 -14.849 -2.389 1.00 41.51 H new ATOM 0 HB3 ASN A 29 -7.051 -15.932 -1.192 1.00 41.51 H new ATOM 0 HD21 ASN A 29 -9.481 -13.789 0.591 1.00 34.10 H new ATOM 0 HD22 ASN A 29 -9.564 -14.832 -0.832 1.00 34.10 H new ATOM 451 N GLU A 30 -4.360 -12.407 -2.064 1.00 1.50 N ATOM 452 CA GLU A 30 -3.982 -11.040 -2.377 1.00 74.11 C ATOM 453 C GLU A 30 -2.587 -11.057 -2.987 1.00 23.41 C ATOM 454 O GLU A 30 -1.865 -12.054 -2.872 1.00 72.44 O ATOM 455 CB GLU A 30 -3.966 -10.191 -1.099 1.00 4.33 C ATOM 456 CG GLU A 30 -5.317 -10.136 -0.386 1.00 35.31 C ATOM 457 CD GLU A 30 -5.249 -9.163 0.780 1.00 13.51 C ATOM 458 OE1 GLU A 30 -4.796 -9.577 1.873 1.00 52.11 O ATOM 459 OE2 GLU A 30 -5.642 -7.986 0.611 1.00 20.41 O ATOM 0 H GLU A 30 -3.581 -12.941 -1.679 1.00 1.50 H new ATOM 0 HA GLU A 30 -4.700 -10.610 -3.075 1.00 74.11 H new ATOM 0 HB2 GLU A 30 -3.219 -10.593 -0.415 1.00 4.33 H new ATOM 0 HB3 GLU A 30 -3.655 -9.177 -1.350 1.00 4.33 H new ATOM 0 HG2 GLU A 30 -6.094 -9.826 -1.085 1.00 35.31 H new ATOM 0 HG3 GLU A 30 -5.589 -11.129 -0.027 1.00 35.31 H new ATOM 466 N GLU A 31 -2.170 -9.945 -3.584 1.00 31.34 N ATOM 467 CA GLU A 31 -0.784 -9.690 -3.920 1.00 74.04 C ATOM 468 C GLU A 31 -0.551 -8.184 -3.793 1.00 24.12 C ATOM 469 O GLU A 31 -1.485 -7.389 -3.946 1.00 42.24 O ATOM 470 CB GLU A 31 -0.488 -10.275 -5.310 1.00 1.10 C ATOM 471 CG GLU A 31 1.013 -10.463 -5.539 1.00 1.44 C ATOM 472 CD GLU A 31 1.676 -9.230 -6.145 1.00 74.22 C ATOM 473 OE1 GLU A 31 1.397 -8.914 -7.325 1.00 20.42 O ATOM 474 OE2 GLU A 31 2.511 -8.622 -5.458 1.00 35.43 O ATOM 0 H GLU A 31 -2.799 -9.188 -3.850 1.00 31.34 H new ATOM 0 HA GLU A 31 -0.083 -10.181 -3.245 1.00 74.04 H new ATOM 0 HB2 GLU A 31 -0.995 -11.234 -5.416 1.00 1.10 H new ATOM 0 HB3 GLU A 31 -0.893 -9.614 -6.076 1.00 1.10 H new ATOM 0 HG2 GLU A 31 1.494 -10.700 -4.590 1.00 1.44 H new ATOM 0 HG3 GLU A 31 1.172 -11.316 -6.198 1.00 1.44 H new ATOM 481 N ILE A 32 0.669 -7.802 -3.419 1.00 23.12 N ATOM 482 CA ILE A 32 1.025 -6.448 -3.024 1.00 13.43 C ATOM 483 C ILE A 32 2.223 -6.033 -3.865 1.00 72.01 C ATOM 484 O ILE A 32 3.372 -6.144 -3.434 1.00 54.50 O ATOM 485 CB ILE A 32 1.241 -6.368 -1.491 1.00 42.14 C ATOM 486 CG1 ILE A 32 0.007 -6.843 -0.689 1.00 3.31 C ATOM 487 CG2 ILE A 32 1.549 -4.928 -1.042 1.00 14.33 C ATOM 488 CD1 ILE A 32 0.383 -7.632 0.570 1.00 23.12 C ATOM 0 H ILE A 32 1.457 -8.448 -3.383 1.00 23.12 H new ATOM 0 HA ILE A 32 0.223 -5.735 -3.217 1.00 13.43 H new ATOM 0 HB ILE A 32 2.084 -7.028 -1.287 1.00 42.14 H new ATOM 0 HG12 ILE A 32 -0.591 -5.977 -0.404 1.00 3.31 H new ATOM 0 HG13 ILE A 32 -0.619 -7.466 -1.329 1.00 3.31 H new ATOM 0 HG21 ILE A 32 1.695 -4.907 0.038 1.00 14.33 H new ATOM 0 HG22 ILE A 32 2.455 -4.578 -1.538 1.00 14.33 H new ATOM 0 HG23 ILE A 32 0.716 -4.278 -1.308 1.00 14.33 H new ATOM 0 HD11 ILE A 32 -0.524 -7.939 1.091 1.00 23.12 H new ATOM 0 HD12 ILE A 32 0.956 -8.515 0.288 1.00 23.12 H new ATOM 0 HD13 ILE A 32 0.984 -7.004 1.227 1.00 23.12 H new ATOM 500 N THR A 33 1.949 -5.533 -5.066 1.00 52.23 N ATOM 501 CA THR A 33 2.980 -4.919 -5.888 1.00 42.34 C ATOM 502 C THR A 33 3.330 -3.539 -5.315 1.00 44.21 C ATOM 503 O THR A 33 2.451 -2.695 -5.132 1.00 12.53 O ATOM 504 CB THR A 33 2.554 -4.865 -7.358 1.00 3.22 C ATOM 505 OG1 THR A 33 2.252 -6.165 -7.827 1.00 32.45 O ATOM 506 CG2 THR A 33 3.672 -4.327 -8.256 1.00 54.20 C ATOM 0 H THR A 33 1.021 -5.542 -5.489 1.00 52.23 H new ATOM 0 HA THR A 33 3.883 -5.529 -5.863 1.00 42.34 H new ATOM 0 HB THR A 33 1.686 -4.207 -7.404 1.00 3.22 H new ATOM 0 HG1 THR A 33 1.979 -6.118 -8.767 1.00 32.45 H new ATOM 0 HG21 THR A 33 3.329 -4.305 -9.290 1.00 54.20 H new ATOM 0 HG22 THR A 33 3.939 -3.318 -7.940 1.00 54.20 H new ATOM 0 HG23 THR A 33 4.545 -4.974 -8.177 1.00 54.20 H new ATOM 514 N VAL A 34 4.609 -3.314 -5.014 1.00 41.54 N ATOM 515 CA VAL A 34 5.151 -2.074 -4.455 1.00 33.22 C ATOM 516 C VAL A 34 6.267 -1.574 -5.376 1.00 72.04 C ATOM 517 O VAL A 34 7.384 -2.099 -5.318 1.00 23.23 O ATOM 518 CB VAL A 34 5.647 -2.316 -3.008 1.00 42.40 C ATOM 519 CG1 VAL A 34 6.179 -1.033 -2.355 1.00 4.03 C ATOM 520 CG2 VAL A 34 4.544 -2.875 -2.105 1.00 41.33 C ATOM 0 H VAL A 34 5.328 -4.022 -5.159 1.00 41.54 H new ATOM 0 HA VAL A 34 4.380 -1.306 -4.399 1.00 33.22 H new ATOM 0 HB VAL A 34 6.453 -3.044 -3.102 1.00 42.40 H new ATOM 0 HG11 VAL A 34 6.515 -1.253 -1.342 1.00 4.03 H new ATOM 0 HG12 VAL A 34 7.015 -0.647 -2.939 1.00 4.03 H new ATOM 0 HG13 VAL A 34 5.385 -0.287 -2.320 1.00 4.03 H new ATOM 0 HG21 VAL A 34 4.939 -3.028 -1.101 1.00 41.33 H new ATOM 0 HG22 VAL A 34 3.714 -2.169 -2.065 1.00 41.33 H new ATOM 0 HG23 VAL A 34 4.193 -3.826 -2.506 1.00 41.33 H new ATOM 530 N THR A 35 5.991 -0.585 -6.236 1.00 12.55 N ATOM 531 CA THR A 35 7.021 0.030 -7.069 1.00 35.14 C ATOM 532 C THR A 35 7.748 1.110 -6.258 1.00 40.34 C ATOM 533 O THR A 35 7.119 1.861 -5.513 1.00 60.50 O ATOM 534 CB THR A 35 6.434 0.544 -8.402 1.00 40.20 C ATOM 535 OG1 THR A 35 5.505 -0.374 -8.940 1.00 74.44 O ATOM 536 CG2 THR A 35 7.544 0.685 -9.451 1.00 13.35 C ATOM 0 H THR A 35 5.058 -0.196 -6.370 1.00 12.55 H new ATOM 0 HA THR A 35 7.762 -0.716 -7.355 1.00 35.14 H new ATOM 0 HB THR A 35 5.956 1.499 -8.186 1.00 40.20 H new ATOM 0 HG1 THR A 35 5.148 -0.023 -9.782 1.00 74.44 H new ATOM 0 HG21 THR A 35 7.117 1.048 -10.386 1.00 13.35 H new ATOM 0 HG22 THR A 35 8.293 1.392 -9.095 1.00 13.35 H new ATOM 0 HG23 THR A 35 8.012 -0.285 -9.618 1.00 13.35 H new ATOM 544 N TYR A 36 9.070 1.231 -6.391 1.00 32.44 N ATOM 545 CA TYR A 36 9.875 2.267 -5.744 1.00 22.21 C ATOM 546 C TYR A 36 11.089 2.602 -6.612 1.00 74.40 C ATOM 547 O TYR A 36 11.246 2.040 -7.695 1.00 12.42 O ATOM 548 CB TYR A 36 10.292 1.834 -4.332 1.00 75.10 C ATOM 549 CG TYR A 36 11.353 0.751 -4.303 1.00 75.40 C ATOM 550 CD1 TYR A 36 11.011 -0.577 -4.625 1.00 35.55 C ATOM 551 CD2 TYR A 36 12.691 1.085 -4.013 1.00 33.42 C ATOM 552 CE1 TYR A 36 12.004 -1.566 -4.679 1.00 24.13 C ATOM 553 CE2 TYR A 36 13.687 0.095 -4.047 1.00 12.25 C ATOM 554 CZ TYR A 36 13.346 -1.232 -4.383 1.00 75.23 C ATOM 555 OH TYR A 36 14.298 -2.200 -4.394 1.00 43.02 O ATOM 0 H TYR A 36 9.623 0.596 -6.966 1.00 32.44 H new ATOM 0 HA TYR A 36 9.272 3.169 -5.639 1.00 22.21 H new ATOM 0 HB2 TYR A 36 10.663 2.705 -3.791 1.00 75.10 H new ATOM 0 HB3 TYR A 36 9.411 1.478 -3.798 1.00 75.10 H new ATOM 0 HD1 TYR A 36 9.982 -0.834 -4.831 1.00 35.55 H new ATOM 0 HD2 TYR A 36 12.951 2.103 -3.764 1.00 33.42 H new ATOM 0 HE1 TYR A 36 11.745 -2.580 -4.946 1.00 24.13 H new ATOM 0 HE2 TYR A 36 14.711 0.349 -3.817 1.00 12.25 H new ATOM 0 HH TYR A 36 13.910 -3.044 -4.083 1.00 43.02 H new ATOM 565 N VAL A 37 11.921 3.546 -6.167 1.00 14.03 N ATOM 566 CA VAL A 37 12.988 4.174 -6.943 1.00 75.42 C ATOM 567 C VAL A 37 14.279 4.210 -6.102 1.00 52.21 C ATOM 568 O VAL A 37 14.232 4.297 -4.871 1.00 21.35 O ATOM 569 CB VAL A 37 12.533 5.602 -7.332 1.00 25.42 C ATOM 570 CG1 VAL A 37 13.348 6.211 -8.477 1.00 4.24 C ATOM 571 CG2 VAL A 37 11.041 5.740 -7.719 1.00 24.12 C ATOM 0 H VAL A 37 11.866 3.908 -5.215 1.00 14.03 H new ATOM 0 HA VAL A 37 13.193 3.607 -7.851 1.00 75.42 H new ATOM 0 HB VAL A 37 12.705 6.144 -6.402 1.00 25.42 H new ATOM 0 HG11 VAL A 37 12.975 7.211 -8.697 1.00 4.24 H new ATOM 0 HG12 VAL A 37 14.397 6.271 -8.186 1.00 4.24 H new ATOM 0 HG13 VAL A 37 13.253 5.585 -9.364 1.00 4.24 H new ATOM 0 HG21 VAL A 37 10.826 6.778 -7.974 1.00 24.12 H new ATOM 0 HG22 VAL A 37 10.828 5.104 -8.578 1.00 24.12 H new ATOM 0 HG23 VAL A 37 10.417 5.436 -6.878 1.00 24.12 H new ATOM 581 N ASN A 38 15.441 4.173 -6.756 1.00 61.13 N ATOM 582 CA ASN A 38 16.757 4.246 -6.112 1.00 3.42 C ATOM 583 C ASN A 38 17.314 5.666 -6.191 1.00 34.23 C ATOM 584 O ASN A 38 16.661 6.560 -6.728 1.00 70.43 O ATOM 585 CB ASN A 38 17.705 3.213 -6.751 1.00 35.53 C ATOM 586 CG ASN A 38 17.369 1.789 -6.332 1.00 33.41 C ATOM 587 OD1 ASN A 38 16.591 1.542 -5.418 1.00 0.42 O ATOM 588 ND2 ASN A 38 17.979 0.796 -6.949 1.00 54.22 N ATOM 0 H ASN A 38 15.496 4.090 -7.771 1.00 61.13 H new ATOM 0 HA ASN A 38 16.660 4.001 -5.054 1.00 3.42 H new ATOM 0 HB2 ASN A 38 17.649 3.293 -7.837 1.00 35.53 H new ATOM 0 HB3 ASN A 38 18.732 3.441 -6.467 1.00 35.53 H new ATOM 0 HD21 ASN A 38 17.801 -0.167 -6.664 1.00 54.22 H new ATOM 0 HD22 ASN A 38 18.628 0.991 -7.711 1.00 54.22 H new ATOM 595 N LYS A 39 18.541 5.877 -5.693 1.00 34.52 N ATOM 596 CA LYS A 39 19.318 7.099 -5.940 1.00 21.51 C ATOM 597 C LYS A 39 19.532 7.318 -7.436 1.00 44.14 C ATOM 598 O LYS A 39 19.641 8.455 -7.894 1.00 52.21 O ATOM 599 CB LYS A 39 20.680 7.039 -5.207 1.00 51.20 C ATOM 600 CG LYS A 39 20.906 8.261 -4.321 1.00 1.43 C ATOM 601 CD LYS A 39 22.306 8.236 -3.691 1.00 44.10 C ATOM 602 CE LYS A 39 22.420 9.354 -2.653 1.00 40.12 C ATOM 603 NZ LYS A 39 23.675 9.268 -1.867 1.00 71.51 N ATOM 0 H LYS A 39 19.025 5.200 -5.104 1.00 34.52 H new ATOM 0 HA LYS A 39 18.749 7.942 -5.548 1.00 21.51 H new ATOM 0 HB2 LYS A 39 20.725 6.136 -4.598 1.00 51.20 H new ATOM 0 HB3 LYS A 39 21.484 6.969 -5.940 1.00 51.20 H new ATOM 0 HG2 LYS A 39 20.786 9.169 -4.911 1.00 1.43 H new ATOM 0 HG3 LYS A 39 20.151 8.289 -3.535 1.00 1.43 H new ATOM 0 HD2 LYS A 39 22.487 7.269 -3.221 1.00 44.10 H new ATOM 0 HD3 LYS A 39 23.066 8.363 -4.462 1.00 44.10 H new ATOM 0 HE2 LYS A 39 22.375 10.320 -3.156 1.00 40.12 H new ATOM 0 HE3 LYS A 39 21.567 9.307 -1.977 1.00 40.12 H new ATOM 0 HZ1 LYS A 39 23.707 10.046 -1.177 1.00 71.51 H new ATOM 0 HZ2 LYS A 39 23.708 8.358 -1.364 1.00 71.51 H new ATOM 0 HZ3 LYS A 39 24.491 9.340 -2.507 1.00 71.51 H new ATOM 617 N THR A 40 19.637 6.236 -8.199 1.00 45.22 N ATOM 618 CA THR A 40 19.695 6.242 -9.652 1.00 30.54 C ATOM 619 C THR A 40 18.268 6.201 -10.201 1.00 3.21 C ATOM 620 O THR A 40 17.346 5.782 -9.499 1.00 5.34 O ATOM 621 CB THR A 40 20.530 5.030 -10.102 1.00 21.22 C ATOM 622 OG1 THR A 40 20.155 3.852 -9.402 1.00 64.50 O ATOM 623 CG2 THR A 40 22.011 5.288 -9.815 1.00 43.34 C ATOM 0 H THR A 40 19.686 5.296 -7.806 1.00 45.22 H new ATOM 0 HA THR A 40 20.170 7.145 -10.036 1.00 30.54 H new ATOM 0 HB THR A 40 20.353 4.891 -11.169 1.00 21.22 H new ATOM 0 HG1 THR A 40 20.801 3.140 -9.591 1.00 64.50 H new ATOM 0 HG21 THR A 40 22.599 4.428 -10.135 1.00 43.34 H new ATOM 0 HG22 THR A 40 22.338 6.174 -10.359 1.00 43.34 H new ATOM 0 HG23 THR A 40 22.152 5.447 -8.746 1.00 43.34 H new ATOM 631 N GLY A 41 18.071 6.538 -11.479 1.00 14.41 N ATOM 632 CA GLY A 41 16.769 6.468 -12.143 1.00 24.24 C ATOM 633 C GLY A 41 16.383 5.029 -12.485 1.00 70.03 C ATOM 634 O GLY A 41 16.067 4.731 -13.639 1.00 31.44 O ATOM 0 H GLY A 41 18.820 6.870 -12.087 1.00 14.41 H new ATOM 0 HA2 GLY A 41 16.008 6.905 -11.497 1.00 24.24 H new ATOM 0 HA3 GLY A 41 16.794 7.064 -13.055 1.00 24.24 H new ATOM 638 N TYR A 42 16.441 4.131 -11.505 1.00 42.32 N ATOM 639 CA TYR A 42 16.186 2.711 -11.614 1.00 45.13 C ATOM 640 C TYR A 42 15.155 2.366 -10.562 1.00 45.21 C ATOM 641 O TYR A 42 15.330 2.691 -9.383 1.00 33.53 O ATOM 642 CB TYR A 42 17.484 1.914 -11.446 1.00 41.24 C ATOM 643 CG TYR A 42 18.529 2.124 -12.528 1.00 74.20 C ATOM 644 CD1 TYR A 42 18.134 2.342 -13.860 1.00 13.42 C ATOM 645 CD2 TYR A 42 19.902 2.037 -12.227 1.00 23.33 C ATOM 646 CE1 TYR A 42 19.089 2.498 -14.866 1.00 62.33 C ATOM 647 CE2 TYR A 42 20.869 2.157 -13.246 1.00 71.21 C ATOM 648 CZ TYR A 42 20.459 2.382 -14.580 1.00 31.11 C ATOM 649 OH TYR A 42 21.338 2.451 -15.616 1.00 74.33 O ATOM 0 H TYR A 42 16.684 4.402 -10.552 1.00 42.32 H new ATOM 0 HA TYR A 42 15.803 2.450 -12.600 1.00 45.13 H new ATOM 0 HB2 TYR A 42 17.926 2.173 -10.484 1.00 41.24 H new ATOM 0 HB3 TYR A 42 17.235 0.853 -11.407 1.00 41.24 H new ATOM 0 HD1 TYR A 42 17.084 2.389 -14.106 1.00 13.42 H new ATOM 0 HD2 TYR A 42 20.217 1.877 -11.206 1.00 23.33 H new ATOM 0 HE1 TYR A 42 18.771 2.710 -15.876 1.00 62.33 H new ATOM 0 HE2 TYR A 42 21.919 2.077 -13.008 1.00 71.21 H new ATOM 0 HH TYR A 42 22.252 2.357 -15.276 1.00 74.33 H new ATOM 659 N SER A 43 14.067 1.758 -11.013 1.00 62.42 N ATOM 660 CA SER A 43 12.864 1.524 -10.270 1.00 74.44 C ATOM 661 C SER A 43 12.498 0.043 -10.361 1.00 72.11 C ATOM 662 O SER A 43 12.371 -0.503 -11.461 1.00 3.32 O ATOM 663 CB SER A 43 11.760 2.372 -10.889 1.00 34.14 C ATOM 664 OG SER A 43 12.205 3.619 -11.414 1.00 63.41 O ATOM 0 H SER A 43 14.010 1.398 -11.966 1.00 62.42 H new ATOM 0 HA SER A 43 12.997 1.790 -9.221 1.00 74.44 H new ATOM 0 HB2 SER A 43 11.285 1.803 -11.688 1.00 34.14 H new ATOM 0 HB3 SER A 43 10.996 2.560 -10.135 1.00 34.14 H new ATOM 0 HG SER A 43 11.443 4.104 -11.794 1.00 63.41 H new ATOM 670 N SER A 44 12.279 -0.594 -9.224 1.00 53.30 N ATOM 671 CA SER A 44 11.881 -1.991 -9.097 1.00 21.01 C ATOM 672 C SER A 44 10.462 -2.034 -8.539 1.00 2.32 C ATOM 673 O SER A 44 10.014 -1.070 -7.914 1.00 71.01 O ATOM 674 CB SER A 44 12.868 -2.732 -8.182 1.00 60.51 C ATOM 675 OG SER A 44 14.107 -2.928 -8.841 1.00 44.11 O ATOM 0 H SER A 44 12.378 -0.132 -8.320 1.00 53.30 H new ATOM 0 HA SER A 44 11.898 -2.488 -10.067 1.00 21.01 H new ATOM 0 HB2 SER A 44 13.023 -2.161 -7.267 1.00 60.51 H new ATOM 0 HB3 SER A 44 12.449 -3.695 -7.890 1.00 60.51 H new ATOM 0 HG SER A 44 14.724 -3.400 -8.244 1.00 44.11 H new ATOM 681 N SER A 45 9.774 -3.153 -8.749 1.00 20.24 N ATOM 682 CA SER A 45 8.468 -3.441 -8.190 1.00 42.32 C ATOM 683 C SER A 45 8.596 -4.774 -7.477 1.00 3.55 C ATOM 684 O SER A 45 8.785 -5.795 -8.135 1.00 23.12 O ATOM 685 CB SER A 45 7.358 -3.406 -9.255 1.00 0.53 C ATOM 686 OG SER A 45 7.812 -3.561 -10.598 1.00 40.14 O ATOM 0 H SER A 45 10.129 -3.908 -9.336 1.00 20.24 H new ATOM 0 HA SER A 45 8.160 -2.673 -7.480 1.00 42.32 H new ATOM 0 HB2 SER A 45 6.639 -4.195 -9.036 1.00 0.53 H new ATOM 0 HB3 SER A 45 6.826 -2.458 -9.174 1.00 0.53 H new ATOM 0 HG SER A 45 7.046 -3.529 -11.208 1.00 40.14 H new ATOM 692 N VAL A 46 8.573 -4.755 -6.142 1.00 11.45 N ATOM 693 CA VAL A 46 8.478 -6.006 -5.395 1.00 73.44 C ATOM 694 C VAL A 46 7.041 -6.498 -5.580 1.00 15.35 C ATOM 695 O VAL A 46 6.142 -5.668 -5.747 1.00 20.01 O ATOM 696 CB VAL A 46 8.770 -5.836 -3.888 1.00 63.10 C ATOM 697 CG1 VAL A 46 9.284 -7.172 -3.338 1.00 21.32 C ATOM 698 CG2 VAL A 46 9.712 -4.690 -3.513 1.00 62.34 C ATOM 0 H VAL A 46 8.618 -3.911 -5.571 1.00 11.45 H new ATOM 0 HA VAL A 46 9.223 -6.708 -5.769 1.00 73.44 H new ATOM 0 HB VAL A 46 7.825 -5.548 -3.427 1.00 63.10 H new ATOM 0 HG11 VAL A 46 9.496 -7.070 -2.274 1.00 21.32 H new ATOM 0 HG12 VAL A 46 8.526 -7.942 -3.485 1.00 21.32 H new ATOM 0 HG13 VAL A 46 10.196 -7.455 -3.864 1.00 21.32 H new ATOM 0 HG21 VAL A 46 9.844 -4.667 -2.431 1.00 62.34 H new ATOM 0 HG22 VAL A 46 10.679 -4.842 -3.993 1.00 62.34 H new ATOM 0 HG23 VAL A 46 9.285 -3.744 -3.847 1.00 62.34 H new ATOM 708 N SER A 47 6.812 -7.806 -5.508 1.00 55.53 N ATOM 709 CA SER A 47 5.490 -8.397 -5.608 1.00 14.31 C ATOM 710 C SER A 47 5.496 -9.714 -4.825 1.00 23.21 C ATOM 711 O SER A 47 6.404 -10.528 -5.017 1.00 14.02 O ATOM 712 CB SER A 47 5.140 -8.545 -7.099 1.00 63.00 C ATOM 713 OG SER A 47 6.204 -9.110 -7.854 1.00 1.23 O ATOM 0 H SER A 47 7.555 -8.492 -5.376 1.00 55.53 H new ATOM 0 HA SER A 47 4.711 -7.775 -5.167 1.00 14.31 H new ATOM 0 HB2 SER A 47 4.254 -9.172 -7.201 1.00 63.00 H new ATOM 0 HB3 SER A 47 4.887 -7.567 -7.509 1.00 63.00 H new ATOM 0 HG SER A 47 5.934 -9.186 -8.793 1.00 1.23 H new ATOM 719 N ALA A 48 4.544 -9.914 -3.908 1.00 34.51 N ATOM 720 CA ALA A 48 4.429 -11.078 -3.025 1.00 33.43 C ATOM 721 C ALA A 48 3.031 -11.114 -2.383 1.00 12.12 C ATOM 722 O ALA A 48 2.329 -10.097 -2.360 1.00 14.40 O ATOM 723 CB ALA A 48 5.528 -11.031 -1.951 1.00 15.42 C ATOM 0 H ALA A 48 3.797 -9.236 -3.754 1.00 34.51 H new ATOM 0 HA ALA A 48 4.560 -11.989 -3.609 1.00 33.43 H new ATOM 0 HB1 ALA A 48 5.436 -11.899 -1.298 1.00 15.42 H new ATOM 0 HB2 ALA A 48 6.507 -11.040 -2.431 1.00 15.42 H new ATOM 0 HB3 ALA A 48 5.421 -10.121 -1.361 1.00 15.42 H new ATOM 729 N TYR A 49 2.616 -12.289 -1.895 1.00 12.31 N ATOM 730 CA TYR A 49 1.314 -12.515 -1.266 1.00 34.13 C ATOM 731 C TYR A 49 1.343 -12.024 0.185 1.00 13.00 C ATOM 732 O TYR A 49 2.405 -11.913 0.797 1.00 52.05 O ATOM 733 CB TYR A 49 0.977 -14.020 -1.245 1.00 75.12 C ATOM 734 CG TYR A 49 0.566 -14.723 -2.532 1.00 22.12 C ATOM 735 CD1 TYR A 49 0.715 -14.145 -3.809 1.00 33.02 C ATOM 736 CD2 TYR A 49 -0.012 -16.003 -2.420 1.00 63.44 C ATOM 737 CE1 TYR A 49 0.284 -14.840 -4.955 1.00 4.11 C ATOM 738 CE2 TYR A 49 -0.488 -16.682 -3.555 1.00 11.33 C ATOM 739 CZ TYR A 49 -0.325 -16.111 -4.834 1.00 71.32 C ATOM 740 OH TYR A 49 -0.794 -16.764 -5.935 1.00 32.32 O ATOM 0 H TYR A 49 3.193 -13.129 -1.929 1.00 12.31 H new ATOM 0 HA TYR A 49 0.565 -11.971 -1.842 1.00 34.13 H new ATOM 0 HB2 TYR A 49 1.850 -14.543 -0.854 1.00 75.12 H new ATOM 0 HB3 TYR A 49 0.171 -14.162 -0.525 1.00 75.12 H new ATOM 0 HD1 TYR A 49 1.161 -13.166 -3.909 1.00 33.02 H new ATOM 0 HD2 TYR A 49 -0.090 -16.469 -1.449 1.00 63.44 H new ATOM 0 HE1 TYR A 49 0.419 -14.400 -5.932 1.00 4.11 H new ATOM 0 HE2 TYR A 49 -0.977 -17.639 -3.448 1.00 11.33 H new ATOM 0 HH TYR A 49 -1.180 -17.624 -5.666 1.00 32.32 H new ATOM 750 N GLY A 50 0.168 -11.823 0.787 1.00 4.44 N ATOM 751 CA GLY A 50 0.079 -11.369 2.167 1.00 14.30 C ATOM 752 C GLY A 50 0.369 -12.467 3.192 1.00 21.24 C ATOM 753 O GLY A 50 0.777 -12.138 4.306 1.00 24.11 O ATOM 0 H GLY A 50 -0.734 -11.969 0.334 1.00 4.44 H new ATOM 0 HA2 GLY A 50 0.781 -10.549 2.317 1.00 14.30 H new ATOM 0 HA3 GLY A 50 -0.920 -10.971 2.346 1.00 14.30 H new ATOM 757 N ASN A 51 0.173 -13.752 2.871 1.00 73.42 N ATOM 758 CA ASN A 51 0.172 -14.831 3.872 1.00 1.32 C ATOM 759 C ASN A 51 1.545 -15.284 4.362 1.00 62.25 C ATOM 760 O ASN A 51 1.602 -16.211 5.178 1.00 1.21 O ATOM 761 CB ASN A 51 -0.581 -16.082 3.390 1.00 15.42 C ATOM 762 CG ASN A 51 0.174 -16.831 2.299 1.00 35.11 C ATOM 763 OD1 ASN A 51 0.389 -16.292 1.221 1.00 32.13 O ATOM 764 ND2 ASN A 51 0.586 -18.062 2.545 1.00 24.14 N ATOM 0 H ASN A 51 0.011 -14.074 1.917 1.00 73.42 H new ATOM 0 HA ASN A 51 -0.340 -14.360 4.711 1.00 1.32 H new ATOM 0 HB2 ASN A 51 -0.749 -16.749 4.235 1.00 15.42 H new ATOM 0 HB3 ASN A 51 -1.562 -15.790 3.014 1.00 15.42 H new ATOM 0 HD21 ASN A 51 1.094 -18.582 1.830 1.00 24.14 H new ATOM 0 HD22 ASN A 51 0.396 -18.492 3.450 1.00 24.14 H new ATOM 771 N ASN A 52 2.643 -14.713 3.866 1.00 40.03 N ATOM 772 CA ASN A 52 3.971 -15.245 4.116 1.00 23.41 C ATOM 773 C ASN A 52 5.025 -14.160 4.345 1.00 51.23 C ATOM 774 O ASN A 52 4.726 -12.964 4.292 1.00 41.03 O ATOM 775 CB ASN A 52 4.346 -16.221 2.982 1.00 44.45 C ATOM 776 CG ASN A 52 5.410 -17.236 3.377 1.00 14.21 C ATOM 777 OD1 ASN A 52 5.622 -17.471 4.656 1.00 32.30 O flip ATOM 778 ND2 ASN A 52 6.049 -17.836 2.530 1.00 20.51 N flip ATOM 0 H ASN A 52 2.631 -13.875 3.285 1.00 40.03 H new ATOM 0 HA ASN A 52 3.949 -15.795 5.057 1.00 23.41 H new ATOM 0 HB2 ASN A 52 3.450 -16.753 2.661 1.00 44.45 H new ATOM 0 HB3 ASN A 52 4.702 -15.649 2.125 1.00 44.45 H new ATOM 0 HD21 ASN A 52 5.883 -17.652 1.541 1.00 20.51 H new ATOM 0 HD22 ASN A 52 6.750 -18.522 2.811 1.00 20.51 H new ATOM 785 N ASN A 53 6.246 -14.583 4.681 1.00 33.14 N ATOM 786 CA ASN A 53 7.434 -13.753 4.826 1.00 1.40 C ATOM 787 C ASN A 53 8.112 -13.643 3.457 1.00 75.51 C ATOM 788 O ASN A 53 7.798 -14.404 2.532 1.00 75.13 O ATOM 789 CB ASN A 53 8.443 -14.398 5.809 1.00 51.34 C ATOM 790 CG ASN A 53 7.825 -14.994 7.070 1.00 15.34 C ATOM 791 OD1 ASN A 53 7.464 -16.164 7.103 1.00 2.34 O ATOM 792 ND2 ASN A 53 7.590 -14.216 8.111 1.00 4.21 N ATOM 0 H ASN A 53 6.438 -15.567 4.868 1.00 33.14 H new ATOM 0 HA ASN A 53 7.137 -12.777 5.209 1.00 1.40 H new ATOM 0 HB2 ASN A 53 8.988 -15.183 5.284 1.00 51.34 H new ATOM 0 HB3 ASN A 53 9.174 -13.644 6.102 1.00 51.34 H new ATOM 0 HD21 ASN A 53 7.113 -14.591 8.931 1.00 4.21 H new ATOM 0 HD22 ASN A 53 7.886 -13.240 8.095 1.00 4.21 H new ATOM 799 N ASP A 54 9.081 -12.739 3.354 1.00 11.00 N ATOM 800 CA ASP A 54 9.837 -12.472 2.137 1.00 52.25 C ATOM 801 C ASP A 54 11.329 -12.377 2.449 1.00 1.15 C ATOM 802 O ASP A 54 11.756 -11.627 3.327 1.00 74.13 O ATOM 803 CB ASP A 54 9.330 -11.184 1.470 1.00 61.34 C ATOM 804 CG ASP A 54 9.598 -9.916 2.295 1.00 64.14 C ATOM 805 OD1 ASP A 54 9.277 -9.940 3.502 1.00 15.44 O ATOM 806 OD2 ASP A 54 10.062 -8.912 1.711 1.00 22.12 O ATOM 0 H ASP A 54 9.370 -12.155 4.139 1.00 11.00 H new ATOM 0 HA ASP A 54 9.689 -13.297 1.441 1.00 52.25 H new ATOM 0 HB2 ASP A 54 9.805 -11.079 0.494 1.00 61.34 H new ATOM 0 HB3 ASP A 54 8.258 -11.273 1.295 1.00 61.34 H new ATOM 811 N ASP A 55 12.134 -13.151 1.721 1.00 44.32 N ATOM 812 CA ASP A 55 13.589 -13.037 1.638 1.00 21.45 C ATOM 813 C ASP A 55 14.003 -13.938 0.473 1.00 4.31 C ATOM 814 O ASP A 55 14.127 -15.148 0.653 1.00 11.33 O ATOM 815 CB ASP A 55 14.289 -13.443 2.952 1.00 62.10 C ATOM 816 CG ASP A 55 15.697 -12.865 2.979 1.00 52.11 C ATOM 817 OD1 ASP A 55 15.845 -11.674 3.329 1.00 41.33 O ATOM 818 OD2 ASP A 55 16.666 -13.562 2.605 1.00 55.43 O ATOM 0 H ASP A 55 11.771 -13.911 1.146 1.00 44.32 H new ATOM 0 HA ASP A 55 13.891 -12.002 1.475 1.00 21.45 H new ATOM 0 HB2 ASP A 55 13.719 -13.079 3.807 1.00 62.10 H new ATOM 0 HB3 ASP A 55 14.329 -14.529 3.034 1.00 62.10 H new ATOM 823 N PHE A 56 14.040 -13.400 -0.751 1.00 35.34 N ATOM 824 CA PHE A 56 14.049 -14.185 -1.991 1.00 53.20 C ATOM 825 C PHE A 56 14.640 -13.431 -3.193 1.00 21.42 C ATOM 826 O PHE A 56 14.258 -13.684 -4.338 1.00 35.55 O ATOM 827 CB PHE A 56 12.629 -14.723 -2.279 1.00 20.44 C ATOM 828 CG PHE A 56 11.563 -13.751 -2.771 1.00 55.05 C ATOM 829 CD1 PHE A 56 11.101 -12.691 -1.966 1.00 44.04 C ATOM 830 CD2 PHE A 56 10.960 -13.965 -4.025 1.00 44.04 C ATOM 831 CE1 PHE A 56 10.043 -11.872 -2.407 1.00 3.43 C ATOM 832 CE2 PHE A 56 9.910 -13.145 -4.472 1.00 0.03 C ATOM 833 CZ PHE A 56 9.445 -12.099 -3.658 1.00 23.30 C ATOM 0 H PHE A 56 14.065 -12.393 -0.911 1.00 35.34 H new ATOM 0 HA PHE A 56 14.722 -15.029 -1.837 1.00 53.20 H new ATOM 0 HB2 PHE A 56 12.720 -15.516 -3.021 1.00 20.44 H new ATOM 0 HB3 PHE A 56 12.258 -15.184 -1.363 1.00 20.44 H new ATOM 0 HD1 PHE A 56 11.560 -12.505 -1.006 1.00 44.04 H new ATOM 0 HD2 PHE A 56 11.310 -14.771 -4.653 1.00 44.04 H new ATOM 0 HE1 PHE A 56 9.690 -11.066 -1.781 1.00 3.43 H new ATOM 0 HE2 PHE A 56 9.462 -13.319 -5.439 1.00 0.03 H new ATOM 0 HZ PHE A 56 8.632 -11.472 -3.992 1.00 23.30 H new ATOM 843 N SER A 57 15.512 -12.450 -2.943 1.00 15.11 N ATOM 844 CA SER A 57 15.965 -11.509 -3.957 1.00 75.41 C ATOM 845 C SER A 57 17.403 -11.055 -3.678 1.00 23.51 C ATOM 846 O SER A 57 17.982 -11.377 -2.635 1.00 2.03 O ATOM 847 CB SER A 57 14.933 -10.375 -3.976 1.00 73.14 C ATOM 848 OG SER A 57 15.169 -9.403 -4.975 1.00 43.13 O ATOM 0 H SER A 57 15.923 -12.290 -2.023 1.00 15.11 H new ATOM 0 HA SER A 57 16.018 -11.955 -4.950 1.00 75.41 H new ATOM 0 HB2 SER A 57 13.941 -10.802 -4.125 1.00 73.14 H new ATOM 0 HB3 SER A 57 14.926 -9.886 -3.002 1.00 73.14 H new ATOM 0 HG SER A 57 14.474 -8.713 -4.931 1.00 43.13 H new ATOM 854 N SER A 58 18.017 -10.334 -4.618 1.00 15.03 N ATOM 855 CA SER A 58 19.395 -9.850 -4.578 1.00 60.22 C ATOM 856 C SER A 58 19.434 -8.335 -4.813 1.00 53.10 C ATOM 857 O SER A 58 20.442 -7.804 -5.301 1.00 55.11 O ATOM 858 CB SER A 58 20.232 -10.633 -5.600 1.00 3.23 C ATOM 859 OG SER A 58 21.620 -10.356 -5.470 1.00 72.50 O ATOM 0 H SER A 58 17.538 -10.058 -5.475 1.00 15.03 H new ATOM 0 HA SER A 58 19.829 -10.021 -3.593 1.00 60.22 H new ATOM 0 HB2 SER A 58 20.061 -11.701 -5.468 1.00 3.23 H new ATOM 0 HB3 SER A 58 19.904 -10.380 -6.608 1.00 3.23 H new ATOM 0 HG SER A 58 21.753 -9.391 -5.365 1.00 72.50 H new ATOM 865 N THR A 59 18.334 -7.635 -4.533 1.00 35.54 N ATOM 866 CA THR A 59 18.145 -6.231 -4.835 1.00 73.30 C ATOM 867 C THR A 59 19.236 -5.354 -4.207 1.00 21.32 C ATOM 868 O THR A 59 19.792 -5.712 -3.159 1.00 61.34 O ATOM 869 CB THR A 59 16.750 -5.811 -4.337 1.00 14.21 C ATOM 870 OG1 THR A 59 16.307 -6.640 -3.269 1.00 15.12 O ATOM 871 CG2 THR A 59 15.768 -5.854 -5.511 1.00 20.53 C ATOM 0 H THR A 59 17.525 -8.053 -4.073 1.00 35.54 H new ATOM 0 HA THR A 59 18.219 -6.088 -5.913 1.00 73.30 H new ATOM 0 HB THR A 59 16.804 -4.795 -3.947 1.00 14.21 H new ATOM 0 HG1 THR A 59 16.937 -6.575 -2.521 1.00 15.12 H new ATOM 0 HG21 THR A 59 14.777 -5.558 -5.167 1.00 20.53 H new ATOM 0 HG22 THR A 59 16.102 -5.168 -6.290 1.00 20.53 H new ATOM 0 HG23 THR A 59 15.725 -6.866 -5.913 1.00 20.53 H new ATOM 879 N PRO A 60 19.521 -4.187 -4.813 1.00 34.24 N ATOM 880 CA PRO A 60 20.337 -3.152 -4.196 1.00 51.04 C ATOM 881 C PRO A 60 19.678 -2.654 -2.904 1.00 53.42 C ATOM 882 O PRO A 60 18.533 -3.000 -2.592 1.00 41.42 O ATOM 883 CB PRO A 60 20.495 -2.043 -5.248 1.00 13.22 C ATOM 884 CG PRO A 60 19.331 -2.271 -6.207 1.00 1.44 C ATOM 885 CD PRO A 60 19.004 -3.746 -6.097 1.00 63.33 C ATOM 0 HA PRO A 60 21.319 -3.523 -3.902 1.00 51.04 H new ATOM 0 HB2 PRO A 60 20.449 -1.053 -4.794 1.00 13.22 H new ATOM 0 HB3 PRO A 60 21.454 -2.114 -5.761 1.00 13.22 H new ATOM 0 HG2 PRO A 60 18.472 -1.657 -5.936 1.00 1.44 H new ATOM 0 HG3 PRO A 60 19.605 -2.004 -7.228 1.00 1.44 H new ATOM 0 HD2 PRO A 60 17.928 -3.911 -6.160 1.00 63.33 H new ATOM 0 HD3 PRO A 60 19.461 -4.307 -6.913 1.00 63.33 H new ATOM 893 N SER A 61 20.398 -1.813 -2.165 1.00 42.31 N ATOM 894 CA SER A 61 19.955 -1.252 -0.896 1.00 11.25 C ATOM 895 C SER A 61 19.708 0.255 -0.960 1.00 52.32 C ATOM 896 O SER A 61 19.211 0.848 -0.005 1.00 24.33 O ATOM 897 CB SER A 61 20.983 -1.600 0.179 1.00 42.34 C ATOM 898 OG SER A 61 22.277 -1.157 -0.196 1.00 72.11 O ATOM 0 H SER A 61 21.328 -1.497 -2.441 1.00 42.31 H new ATOM 0 HA SER A 61 18.990 -1.693 -0.648 1.00 11.25 H new ATOM 0 HB2 SER A 61 20.696 -1.140 1.125 1.00 42.34 H new ATOM 0 HB3 SER A 61 20.996 -2.678 0.340 1.00 42.34 H new ATOM 0 HG SER A 61 22.675 -0.648 0.541 1.00 72.11 H new ATOM 904 N ASN A 62 20.032 0.877 -2.087 1.00 41.23 N ATOM 905 CA ASN A 62 20.032 2.309 -2.372 1.00 24.25 C ATOM 906 C ASN A 62 18.655 2.816 -2.817 1.00 20.53 C ATOM 907 O ASN A 62 18.573 3.629 -3.738 1.00 1.34 O ATOM 908 CB ASN A 62 21.152 2.655 -3.388 1.00 62.10 C ATOM 909 CG ASN A 62 21.411 1.550 -4.408 1.00 22.54 C ATOM 910 OD1 ASN A 62 22.171 0.622 -4.137 1.00 24.52 O ATOM 911 ND2 ASN A 62 20.811 1.586 -5.578 1.00 3.04 N ATOM 0 H ASN A 62 20.330 0.342 -2.903 1.00 41.23 H new ATOM 0 HA ASN A 62 20.250 2.837 -1.444 1.00 24.25 H new ATOM 0 HB2 ASN A 62 20.883 3.570 -3.916 1.00 62.10 H new ATOM 0 HB3 ASN A 62 22.074 2.860 -2.844 1.00 62.10 H new ATOM 0 HD21 ASN A 62 20.976 0.845 -6.259 1.00 3.04 H new ATOM 0 HD22 ASN A 62 20.180 2.355 -5.804 1.00 3.04 H new ATOM 918 N PHE A 63 17.576 2.370 -2.161 1.00 2.14 N ATOM 919 CA PHE A 63 16.261 3.024 -2.262 1.00 20.53 C ATOM 920 C PHE A 63 16.429 4.519 -1.965 1.00 22.15 C ATOM 921 O PHE A 63 17.199 4.856 -1.061 1.00 44.00 O ATOM 922 CB PHE A 63 15.242 2.393 -1.292 1.00 2.02 C ATOM 923 CG PHE A 63 15.354 2.766 0.187 1.00 42.20 C ATOM 924 CD1 PHE A 63 16.576 2.676 0.886 1.00 44.10 C ATOM 925 CD2 PHE A 63 14.209 3.203 0.881 1.00 21.43 C ATOM 926 CE1 PHE A 63 16.649 2.970 2.256 1.00 54.00 C ATOM 927 CE2 PHE A 63 14.285 3.513 2.251 1.00 73.40 C ATOM 928 CZ PHE A 63 15.497 3.377 2.943 1.00 23.35 C ATOM 0 H PHE A 63 17.587 1.553 -1.550 1.00 2.14 H new ATOM 0 HA PHE A 63 15.874 2.886 -3.272 1.00 20.53 H new ATOM 0 HB2 PHE A 63 14.242 2.662 -1.632 1.00 2.02 H new ATOM 0 HB3 PHE A 63 15.326 1.309 -1.373 1.00 2.02 H new ATOM 0 HD1 PHE A 63 17.469 2.376 0.358 1.00 44.10 H new ATOM 0 HD2 PHE A 63 13.269 3.301 0.359 1.00 21.43 H new ATOM 0 HE1 PHE A 63 17.590 2.883 2.779 1.00 54.00 H new ATOM 0 HE2 PHE A 63 13.405 3.858 2.773 1.00 73.40 H new ATOM 0 HZ PHE A 63 15.543 3.585 4.002 1.00 23.35 H new ATOM 938 N SER A 64 15.810 5.425 -2.726 1.00 41.21 N ATOM 939 CA SER A 64 15.917 6.864 -2.458 1.00 55.23 C ATOM 940 C SER A 64 14.735 7.695 -2.972 1.00 74.50 C ATOM 941 O SER A 64 14.719 8.902 -2.736 1.00 63.42 O ATOM 942 CB SER A 64 17.238 7.432 -3.002 1.00 15.41 C ATOM 943 OG SER A 64 18.358 6.660 -2.595 1.00 11.43 O ATOM 0 H SER A 64 15.230 5.190 -3.532 1.00 41.21 H new ATOM 0 HA SER A 64 15.898 6.950 -1.372 1.00 55.23 H new ATOM 0 HB2 SER A 64 17.197 7.465 -4.091 1.00 15.41 H new ATOM 0 HB3 SER A 64 17.361 8.458 -2.656 1.00 15.41 H new ATOM 0 HG SER A 64 18.154 6.209 -1.749 1.00 11.43 H new ATOM 949 N LYS A 65 13.735 7.111 -3.642 1.00 71.50 N ATOM 950 CA LYS A 65 12.456 7.774 -3.879 1.00 23.33 C ATOM 951 C LYS A 65 11.368 6.710 -3.901 1.00 32.52 C ATOM 952 O LYS A 65 11.656 5.536 -4.151 1.00 0.35 O ATOM 953 CB LYS A 65 12.505 8.619 -5.178 1.00 33.24 C ATOM 954 CG LYS A 65 12.073 10.075 -4.952 1.00 10.21 C ATOM 955 CD LYS A 65 10.769 10.488 -5.652 1.00 1.23 C ATOM 956 CE LYS A 65 10.989 11.257 -6.963 1.00 53.10 C ATOM 957 NZ LYS A 65 9.767 12.002 -7.357 1.00 64.42 N ATOM 0 H LYS A 65 13.793 6.170 -4.032 1.00 71.50 H new ATOM 0 HA LYS A 65 12.232 8.479 -3.079 1.00 23.33 H new ATOM 0 HB2 LYS A 65 13.518 8.603 -5.580 1.00 33.24 H new ATOM 0 HB3 LYS A 65 11.858 8.164 -5.928 1.00 33.24 H new ATOM 0 HG2 LYS A 65 11.960 10.241 -3.881 1.00 10.21 H new ATOM 0 HG3 LYS A 65 12.873 10.732 -5.293 1.00 10.21 H new ATOM 0 HD2 LYS A 65 10.180 9.595 -5.860 1.00 1.23 H new ATOM 0 HD3 LYS A 65 10.182 11.106 -4.973 1.00 1.23 H new ATOM 0 HE2 LYS A 65 11.820 11.952 -6.845 1.00 53.10 H new ATOM 0 HE3 LYS A 65 11.265 10.561 -7.755 1.00 53.10 H new ATOM 0 HZ1 LYS A 65 9.943 12.513 -8.246 1.00 64.42 H new ATOM 0 HZ2 LYS A 65 8.981 11.334 -7.491 1.00 64.42 H new ATOM 0 HZ3 LYS A 65 9.519 12.682 -6.610 1.00 64.42 H new ATOM 971 N LEU A 66 10.113 7.085 -3.667 1.00 1.24 N ATOM 972 CA LEU A 66 9.004 6.133 -3.709 1.00 64.23 C ATOM 973 C LEU A 66 8.298 6.220 -5.057 1.00 22.44 C ATOM 974 O LEU A 66 8.480 7.180 -5.808 1.00 12.43 O ATOM 975 CB LEU A 66 8.035 6.359 -2.532 1.00 15.25 C ATOM 976 CG LEU A 66 8.450 5.668 -1.216 1.00 0.43 C ATOM 977 CD1 LEU A 66 8.501 4.151 -1.361 1.00 22.11 C ATOM 978 CD2 LEU A 66 9.780 6.171 -0.639 1.00 60.53 C ATOM 0 H LEU A 66 9.837 8.042 -3.446 1.00 1.24 H new ATOM 0 HA LEU A 66 9.398 5.123 -3.600 1.00 64.23 H new ATOM 0 HB2 LEU A 66 7.946 7.430 -2.352 1.00 15.25 H new ATOM 0 HB3 LEU A 66 7.046 6.001 -2.819 1.00 15.25 H new ATOM 0 HG LEU A 66 7.668 5.940 -0.507 1.00 0.43 H new ATOM 0 HD11 LEU A 66 8.797 3.705 -0.412 1.00 22.11 H new ATOM 0 HD12 LEU A 66 7.517 3.779 -1.645 1.00 22.11 H new ATOM 0 HD13 LEU A 66 9.226 3.883 -2.130 1.00 22.11 H new ATOM 0 HD21 LEU A 66 10.001 5.637 0.285 1.00 60.53 H new ATOM 0 HD22 LEU A 66 10.579 5.996 -1.360 1.00 60.53 H new ATOM 0 HD23 LEU A 66 9.706 7.239 -0.432 1.00 60.53 H new ATOM 990 N LYS A 67 7.505 5.193 -5.365 1.00 72.22 N ATOM 991 CA LYS A 67 6.630 5.153 -6.526 1.00 61.12 C ATOM 992 C LYS A 67 5.313 4.474 -6.137 1.00 3.15 C ATOM 993 O LYS A 67 5.120 4.101 -4.981 1.00 3.22 O ATOM 994 CB LYS A 67 7.337 4.443 -7.695 1.00 54.13 C ATOM 995 CG LYS A 67 6.978 5.094 -9.037 1.00 24.44 C ATOM 996 CD LYS A 67 7.195 4.125 -10.201 1.00 23.03 C ATOM 997 CE LYS A 67 6.658 4.748 -11.483 1.00 64.34 C ATOM 998 NZ LYS A 67 7.511 4.524 -12.666 1.00 22.23 N ATOM 0 H LYS A 67 7.456 4.347 -4.797 1.00 72.22 H new ATOM 0 HA LYS A 67 6.398 6.163 -6.863 1.00 61.12 H new ATOM 0 HB2 LYS A 67 8.416 4.480 -7.547 1.00 54.13 H new ATOM 0 HB3 LYS A 67 7.053 3.391 -7.710 1.00 54.13 H new ATOM 0 HG2 LYS A 67 5.937 5.418 -9.020 1.00 24.44 H new ATOM 0 HG3 LYS A 67 7.587 5.986 -9.185 1.00 24.44 H new ATOM 0 HD2 LYS A 67 8.256 3.901 -10.309 1.00 23.03 H new ATOM 0 HD3 LYS A 67 6.688 3.181 -10.002 1.00 23.03 H new ATOM 0 HE2 LYS A 67 5.666 4.344 -11.682 1.00 64.34 H new ATOM 0 HE3 LYS A 67 6.541 5.821 -11.331 1.00 64.34 H new ATOM 0 HZ1 LYS A 67 7.079 4.977 -13.496 1.00 22.23 H new ATOM 0 HZ2 LYS A 67 8.452 4.934 -12.498 1.00 22.23 H new ATOM 0 HZ3 LYS A 67 7.604 3.503 -12.839 1.00 22.23 H new ATOM 1012 N GLU A 68 4.397 4.375 -7.094 1.00 63.10 N ATOM 1013 CA GLU A 68 3.047 3.837 -6.954 1.00 43.53 C ATOM 1014 C GLU A 68 3.016 2.331 -6.651 1.00 21.22 C ATOM 1015 O GLU A 68 4.044 1.646 -6.649 1.00 11.25 O ATOM 1016 CB GLU A 68 2.274 4.190 -8.229 1.00 54.30 C ATOM 1017 CG GLU A 68 2.801 3.442 -9.459 1.00 11.51 C ATOM 1018 CD GLU A 68 2.735 4.329 -10.700 1.00 12.12 C ATOM 1019 OE1 GLU A 68 3.714 5.078 -10.947 1.00 71.14 O ATOM 1020 OE2 GLU A 68 1.720 4.288 -11.424 1.00 31.33 O ATOM 0 H GLU A 68 4.588 4.687 -8.046 1.00 63.10 H new ATOM 0 HA GLU A 68 2.571 4.291 -6.085 1.00 43.53 H new ATOM 0 HB2 GLU A 68 1.219 3.954 -8.088 1.00 54.30 H new ATOM 0 HB3 GLU A 68 2.340 5.264 -8.405 1.00 54.30 H new ATOM 0 HG2 GLU A 68 3.830 3.127 -9.286 1.00 11.51 H new ATOM 0 HG3 GLU A 68 2.214 2.538 -9.620 1.00 11.51 H new ATOM 1027 N ILE A 69 1.821 1.839 -6.323 1.00 33.45 N ATOM 1028 CA ILE A 69 1.579 0.578 -5.637 1.00 54.24 C ATOM 1029 C ILE A 69 0.279 0.013 -6.218 1.00 60.02 C ATOM 1030 O ILE A 69 -0.767 0.666 -6.169 1.00 54.12 O ATOM 1031 CB ILE A 69 1.461 0.870 -4.123 1.00 71.30 C ATOM 1032 CG1 ILE A 69 2.757 1.476 -3.528 1.00 22.11 C ATOM 1033 CG2 ILE A 69 1.052 -0.348 -3.285 1.00 21.45 C ATOM 1034 CD1 ILE A 69 2.569 2.044 -2.123 1.00 24.43 C ATOM 0 H ILE A 69 0.957 2.336 -6.541 1.00 33.45 H new ATOM 0 HA ILE A 69 2.381 -0.147 -5.773 1.00 54.24 H new ATOM 0 HB ILE A 69 0.658 1.605 -4.062 1.00 71.30 H new ATOM 0 HG12 ILE A 69 3.530 0.708 -3.501 1.00 22.11 H new ATOM 0 HG13 ILE A 69 3.116 2.267 -4.187 1.00 22.11 H new ATOM 0 HG21 ILE A 69 0.991 -0.063 -2.235 1.00 21.45 H new ATOM 0 HG22 ILE A 69 0.080 -0.710 -3.620 1.00 21.45 H new ATOM 0 HG23 ILE A 69 1.794 -1.137 -3.404 1.00 21.45 H new ATOM 0 HD11 ILE A 69 3.515 2.452 -1.766 1.00 24.43 H new ATOM 0 HD12 ILE A 69 1.819 2.834 -2.147 1.00 24.43 H new ATOM 0 HD13 ILE A 69 2.239 1.251 -1.451 1.00 24.43 H new ATOM 1046 N ASP A 70 0.337 -1.201 -6.759 1.00 4.34 N ATOM 1047 CA ASP A 70 -0.810 -1.897 -7.326 1.00 74.43 C ATOM 1048 C ASP A 70 -1.171 -3.031 -6.370 1.00 75.20 C ATOM 1049 O ASP A 70 -0.366 -3.940 -6.166 1.00 63.34 O ATOM 1050 CB ASP A 70 -0.493 -2.408 -8.745 1.00 14.25 C ATOM 1051 CG ASP A 70 -0.584 -1.315 -9.813 1.00 64.20 C ATOM 1052 OD1 ASP A 70 -1.712 -0.911 -10.168 1.00 2.12 O ATOM 1053 OD2 ASP A 70 0.461 -0.885 -10.363 1.00 23.23 O ATOM 0 H ASP A 70 1.202 -1.738 -6.816 1.00 4.34 H new ATOM 0 HA ASP A 70 -1.662 -1.225 -7.433 1.00 74.43 H new ATOM 0 HB2 ASP A 70 0.510 -2.834 -8.755 1.00 14.25 H new ATOM 0 HB3 ASP A 70 -1.184 -3.212 -8.997 1.00 14.25 H new ATOM 1058 N LEU A 71 -2.321 -2.964 -5.692 1.00 55.21 N ATOM 1059 CA LEU A 71 -2.847 -4.116 -4.950 1.00 41.31 C ATOM 1060 C LEU A 71 -3.627 -5.013 -5.890 1.00 75.13 C ATOM 1061 O LEU A 71 -4.246 -4.558 -6.856 1.00 4.42 O ATOM 1062 CB LEU A 71 -3.803 -3.692 -3.817 1.00 4.50 C ATOM 1063 CG LEU A 71 -3.055 -3.209 -2.577 1.00 2.54 C ATOM 1064 CD1 LEU A 71 -4.030 -2.488 -1.637 1.00 43.24 C ATOM 1065 CD2 LEU A 71 -2.371 -4.340 -1.810 1.00 73.01 C ATOM 0 H LEU A 71 -2.904 -2.129 -5.641 1.00 55.21 H new ATOM 0 HA LEU A 71 -1.990 -4.633 -4.518 1.00 41.31 H new ATOM 0 HB2 LEU A 71 -4.458 -2.898 -4.176 1.00 4.50 H new ATOM 0 HB3 LEU A 71 -4.441 -4.534 -3.549 1.00 4.50 H new ATOM 0 HG LEU A 71 -2.274 -2.533 -2.925 1.00 2.54 H new ATOM 0 HD11 LEU A 71 -3.495 -2.144 -0.752 1.00 43.24 H new ATOM 0 HD12 LEU A 71 -4.467 -1.633 -2.152 1.00 43.24 H new ATOM 0 HD13 LEU A 71 -4.822 -3.175 -1.338 1.00 43.24 H new ATOM 0 HD21 LEU A 71 -1.857 -3.931 -0.940 1.00 73.01 H new ATOM 0 HD22 LEU A 71 -3.119 -5.062 -1.483 1.00 73.01 H new ATOM 0 HD23 LEU A 71 -1.648 -4.835 -2.459 1.00 73.01 H new ATOM 1077 N LYS A 72 -3.723 -6.273 -5.488 1.00 73.31 N ATOM 1078 CA LYS A 72 -4.746 -7.204 -5.953 1.00 1.13 C ATOM 1079 C LYS A 72 -5.292 -7.996 -4.776 1.00 3.34 C ATOM 1080 O LYS A 72 -4.672 -8.062 -3.707 1.00 72.31 O ATOM 1081 CB LYS A 72 -4.207 -8.110 -7.074 1.00 61.41 C ATOM 1082 CG LYS A 72 -4.395 -7.419 -8.433 1.00 23.00 C ATOM 1083 CD LYS A 72 -4.043 -8.302 -9.627 1.00 72.35 C ATOM 1084 CE LYS A 72 -2.530 -8.388 -9.810 1.00 53.43 C ATOM 1085 NZ LYS A 72 -2.171 -9.096 -11.046 1.00 60.45 N ATOM 0 H LYS A 72 -3.078 -6.687 -4.815 1.00 73.31 H new ATOM 0 HA LYS A 72 -5.572 -6.641 -6.388 1.00 1.13 H new ATOM 0 HB2 LYS A 72 -3.151 -8.323 -6.906 1.00 61.41 H new ATOM 0 HB3 LYS A 72 -4.731 -9.066 -7.066 1.00 61.41 H new ATOM 0 HG2 LYS A 72 -5.432 -7.096 -8.525 1.00 23.00 H new ATOM 0 HG3 LYS A 72 -3.777 -6.521 -8.462 1.00 23.00 H new ATOM 0 HD2 LYS A 72 -4.453 -9.301 -9.480 1.00 72.35 H new ATOM 0 HD3 LYS A 72 -4.501 -7.899 -10.530 1.00 72.35 H new ATOM 0 HE2 LYS A 72 -2.108 -7.383 -9.831 1.00 53.43 H new ATOM 0 HE3 LYS A 72 -2.089 -8.901 -8.956 1.00 53.43 H new ATOM 0 HZ1 LYS A 72 -1.136 -9.134 -11.136 1.00 60.45 H new ATOM 0 HZ2 LYS A 72 -2.552 -10.063 -11.015 1.00 60.45 H new ATOM 0 HZ3 LYS A 72 -2.571 -8.592 -11.863 1.00 60.45 H new ATOM 1099 N LYS A 73 -6.502 -8.523 -4.949 1.00 31.43 N ATOM 1100 CA LYS A 73 -7.243 -9.275 -3.950 1.00 24.00 C ATOM 1101 C LYS A 73 -8.339 -10.061 -4.642 1.00 74.21 C ATOM 1102 O LYS A 73 -8.824 -9.661 -5.705 1.00 64.33 O ATOM 1103 CB LYS A 73 -7.835 -8.346 -2.878 1.00 41.54 C ATOM 1104 CG LYS A 73 -8.540 -7.104 -3.453 1.00 1.40 C ATOM 1105 CD LYS A 73 -9.155 -6.234 -2.361 1.00 21.33 C ATOM 1106 CE LYS A 73 -8.136 -5.715 -1.337 1.00 60.25 C ATOM 1107 NZ LYS A 73 -7.242 -4.671 -1.863 1.00 63.35 N ATOM 0 H LYS A 73 -7.011 -8.431 -5.828 1.00 31.43 H new ATOM 0 HA LYS A 73 -6.563 -9.960 -3.443 1.00 24.00 H new ATOM 0 HB2 LYS A 73 -8.547 -8.910 -2.275 1.00 41.54 H new ATOM 0 HB3 LYS A 73 -7.037 -8.023 -2.210 1.00 41.54 H new ATOM 0 HG2 LYS A 73 -7.824 -6.514 -4.025 1.00 1.40 H new ATOM 0 HG3 LYS A 73 -9.320 -7.419 -4.146 1.00 1.40 H new ATOM 0 HD2 LYS A 73 -9.655 -5.384 -2.825 1.00 21.33 H new ATOM 0 HD3 LYS A 73 -9.920 -6.809 -1.839 1.00 21.33 H new ATOM 0 HE2 LYS A 73 -8.672 -5.320 -0.474 1.00 60.25 H new ATOM 0 HE3 LYS A 73 -7.533 -6.551 -0.983 1.00 60.25 H new ATOM 0 HZ1 LYS A 73 -6.828 -4.138 -1.072 1.00 63.35 H new ATOM 0 HZ2 LYS A 73 -6.482 -5.113 -2.419 1.00 63.35 H new ATOM 0 HZ3 LYS A 73 -7.784 -4.024 -2.471 1.00 63.35 H new ATOM 1121 N ASP A 74 -8.788 -11.117 -3.982 1.00 0.20 N ATOM 1122 CA ASP A 74 -9.746 -12.088 -4.482 1.00 1.13 C ATOM 1123 C ASP A 74 -11.028 -12.067 -3.649 1.00 51.31 C ATOM 1124 O ASP A 74 -11.247 -11.193 -2.806 1.00 24.23 O ATOM 1125 CB ASP A 74 -9.085 -13.471 -4.440 1.00 13.44 C ATOM 1126 CG ASP A 74 -9.695 -14.438 -5.444 1.00 41.12 C ATOM 1127 OD1 ASP A 74 -9.276 -14.455 -6.622 1.00 32.31 O ATOM 1128 OD2 ASP A 74 -10.597 -15.211 -5.051 1.00 35.13 O ATOM 0 H ASP A 74 -8.477 -11.330 -3.034 1.00 0.20 H new ATOM 0 HA ASP A 74 -10.028 -11.842 -5.506 1.00 1.13 H new ATOM 0 HB2 ASP A 74 -8.019 -13.367 -4.642 1.00 13.44 H new ATOM 0 HB3 ASP A 74 -9.181 -13.886 -3.436 1.00 13.44 H new ATOM 1133 N ASN A 75 -11.899 -13.037 -3.901 1.00 60.21 N ATOM 1134 CA ASN A 75 -13.141 -13.315 -3.217 1.00 34.11 C ATOM 1135 C ASN A 75 -12.844 -13.977 -1.880 1.00 24.43 C ATOM 1136 O ASN A 75 -12.833 -15.207 -1.749 1.00 21.44 O ATOM 1137 CB ASN A 75 -14.008 -14.195 -4.125 1.00 12.10 C ATOM 1138 CG ASN A 75 -15.146 -13.386 -4.693 1.00 72.21 C ATOM 1139 OD1 ASN A 75 -16.311 -13.674 -4.439 1.00 23.33 O ATOM 1140 ND2 ASN A 75 -14.846 -12.334 -5.432 1.00 42.33 N ATOM 0 H ASN A 75 -11.733 -13.703 -4.656 1.00 60.21 H new ATOM 0 HA ASN A 75 -13.691 -12.397 -3.007 1.00 34.11 H new ATOM 0 HB2 ASN A 75 -13.403 -14.604 -4.934 1.00 12.10 H new ATOM 0 HB3 ASN A 75 -14.399 -15.041 -3.560 1.00 12.10 H new ATOM 0 HD21 ASN A 75 -15.590 -11.743 -5.804 1.00 42.33 H new ATOM 0 HD22 ASN A 75 -13.871 -12.112 -5.631 1.00 42.33 H new ATOM 1147 N VAL A 76 -12.572 -13.133 -0.894 1.00 63.05 N ATOM 1148 CA VAL A 76 -12.423 -13.510 0.505 1.00 54.24 C ATOM 1149 C VAL A 76 -13.707 -14.226 0.997 1.00 4.21 C ATOM 1150 O VAL A 76 -14.773 -14.000 0.422 1.00 32.20 O ATOM 1151 CB VAL A 76 -12.057 -12.245 1.323 1.00 4.13 C ATOM 1152 CG1 VAL A 76 -10.981 -11.361 0.656 1.00 34.32 C ATOM 1153 CG2 VAL A 76 -13.274 -11.375 1.605 1.00 40.55 C ATOM 0 H VAL A 76 -12.445 -12.133 -1.051 1.00 63.05 H new ATOM 0 HA VAL A 76 -11.612 -14.226 0.640 1.00 54.24 H new ATOM 0 HB VAL A 76 -11.650 -12.639 2.254 1.00 4.13 H new ATOM 0 HG11 VAL A 76 -10.778 -10.496 1.287 1.00 34.32 H new ATOM 0 HG12 VAL A 76 -10.065 -11.938 0.526 1.00 34.32 H new ATOM 0 HG13 VAL A 76 -11.339 -11.024 -0.317 1.00 34.32 H new ATOM 0 HG21 VAL A 76 -12.971 -10.500 2.180 1.00 40.55 H new ATOM 0 HG22 VAL A 76 -13.718 -11.054 0.663 1.00 40.55 H new ATOM 0 HG23 VAL A 76 -14.006 -11.947 2.174 1.00 40.55 H new ATOM 1163 N PRO A 77 -13.637 -15.053 2.053 1.00 53.33 N ATOM 1164 CA PRO A 77 -14.778 -15.747 2.636 1.00 72.04 C ATOM 1165 C PRO A 77 -15.616 -14.793 3.489 1.00 53.35 C ATOM 1166 O PRO A 77 -15.329 -13.596 3.584 1.00 22.40 O ATOM 1167 CB PRO A 77 -14.155 -16.861 3.482 1.00 73.33 C ATOM 1168 CG PRO A 77 -12.878 -16.200 3.981 1.00 44.22 C ATOM 1169 CD PRO A 77 -12.434 -15.354 2.801 1.00 23.32 C ATOM 0 HA PRO A 77 -15.459 -16.142 1.883 1.00 72.04 H new ATOM 0 HB2 PRO A 77 -14.806 -17.163 4.302 1.00 73.33 H new ATOM 0 HB3 PRO A 77 -13.949 -17.755 2.893 1.00 73.33 H new ATOM 0 HG2 PRO A 77 -13.061 -15.590 4.866 1.00 44.22 H new ATOM 0 HG3 PRO A 77 -12.123 -16.938 4.253 1.00 44.22 H new ATOM 0 HD2 PRO A 77 -11.945 -14.440 3.138 1.00 23.32 H new ATOM 0 HD3 PRO A 77 -11.715 -15.892 2.184 1.00 23.32 H new ATOM 1177 N SER A 78 -16.643 -15.333 4.150 1.00 40.31 N ATOM 1178 CA SER A 78 -17.597 -14.610 4.988 1.00 32.42 C ATOM 1179 C SER A 78 -16.927 -13.627 5.954 1.00 32.13 C ATOM 1180 O SER A 78 -17.486 -12.561 6.225 1.00 54.43 O ATOM 1181 CB SER A 78 -18.415 -15.629 5.791 1.00 52.31 C ATOM 1182 OG SER A 78 -18.849 -16.717 4.983 1.00 41.24 O ATOM 0 H SER A 78 -16.839 -16.333 4.112 1.00 40.31 H new ATOM 0 HA SER A 78 -18.231 -14.020 4.327 1.00 32.42 H new ATOM 0 HB2 SER A 78 -17.813 -16.008 6.617 1.00 52.31 H new ATOM 0 HB3 SER A 78 -19.282 -15.134 6.229 1.00 52.31 H new ATOM 0 HG SER A 78 -19.365 -17.345 5.530 1.00 41.24 H new ATOM 1188 N ASP A 79 -15.730 -13.988 6.416 1.00 12.51 N ATOM 1189 CA ASP A 79 -14.828 -13.279 7.309 1.00 74.44 C ATOM 1190 C ASP A 79 -14.687 -11.812 6.932 1.00 2.53 C ATOM 1191 O ASP A 79 -14.634 -10.960 7.816 1.00 32.52 O ATOM 1192 CB ASP A 79 -13.426 -13.911 7.223 1.00 41.32 C ATOM 1193 CG ASP A 79 -13.331 -15.408 7.518 1.00 43.05 C ATOM 1194 OD1 ASP A 79 -14.366 -16.093 7.662 1.00 4.44 O ATOM 1195 OD2 ASP A 79 -12.198 -15.942 7.482 1.00 0.40 O ATOM 0 H ASP A 79 -15.329 -14.884 6.140 1.00 12.51 H new ATOM 0 HA ASP A 79 -15.246 -13.352 8.313 1.00 74.44 H new ATOM 0 HB2 ASP A 79 -13.034 -13.736 6.221 1.00 41.32 H new ATOM 0 HB3 ASP A 79 -12.772 -13.385 7.918 1.00 41.32 H new ATOM 1200 N ASP A 80 -14.615 -11.503 5.634 1.00 31.13 N ATOM 1201 CA ASP A 80 -14.372 -10.146 5.146 1.00 72.04 C ATOM 1202 C ASP A 80 -15.142 -9.834 3.864 1.00 55.52 C ATOM 1203 O ASP A 80 -14.921 -8.792 3.236 1.00 3.31 O ATOM 1204 CB ASP A 80 -12.864 -9.911 4.961 1.00 35.20 C ATOM 1205 CG ASP A 80 -12.258 -9.082 6.086 1.00 62.23 C ATOM 1206 OD1 ASP A 80 -12.744 -7.952 6.326 1.00 11.31 O ATOM 1207 OD2 ASP A 80 -11.181 -9.453 6.593 1.00 35.34 O ATOM 0 H ASP A 80 -14.724 -12.192 4.890 1.00 31.13 H new ATOM 0 HA ASP A 80 -14.747 -9.456 5.902 1.00 72.04 H new ATOM 0 HB2 ASP A 80 -12.354 -10.873 4.908 1.00 35.20 H new ATOM 0 HB3 ASP A 80 -12.693 -9.407 4.010 1.00 35.20 H new ATOM 1212 N PHE A 81 -16.046 -10.728 3.453 1.00 41.21 N ATOM 1213 CA PHE A 81 -16.824 -10.596 2.231 1.00 71.31 C ATOM 1214 C PHE A 81 -17.542 -9.246 2.219 1.00 23.02 C ATOM 1215 O PHE A 81 -17.598 -8.568 1.194 1.00 42.45 O ATOM 1216 CB PHE A 81 -17.833 -11.751 2.137 1.00 40.53 C ATOM 1217 CG PHE A 81 -18.079 -12.224 0.721 1.00 42.15 C ATOM 1218 CD1 PHE A 81 -18.522 -11.331 -0.273 1.00 64.34 C ATOM 1219 CD2 PHE A 81 -17.818 -13.562 0.380 1.00 73.25 C ATOM 1220 CE1 PHE A 81 -18.668 -11.764 -1.598 1.00 52.34 C ATOM 1221 CE2 PHE A 81 -17.991 -14.001 -0.941 1.00 34.43 C ATOM 1222 CZ PHE A 81 -18.421 -13.106 -1.933 1.00 51.45 C ATOM 0 H PHE A 81 -16.257 -11.578 3.975 1.00 41.21 H new ATOM 0 HA PHE A 81 -16.161 -10.641 1.367 1.00 71.31 H new ATOM 0 HB2 PHE A 81 -17.471 -12.588 2.734 1.00 40.53 H new ATOM 0 HB3 PHE A 81 -18.779 -11.433 2.575 1.00 40.53 H new ATOM 0 HD1 PHE A 81 -18.750 -10.308 -0.013 1.00 64.34 H new ATOM 0 HD2 PHE A 81 -17.483 -14.255 1.138 1.00 73.25 H new ATOM 0 HE1 PHE A 81 -18.971 -11.065 -2.363 1.00 52.34 H new ATOM 0 HE2 PHE A 81 -17.793 -15.032 -1.196 1.00 34.43 H new ATOM 0 HZ PHE A 81 -18.561 -13.447 -2.948 1.00 51.45 H new ATOM 1232 N ASN A 82 -18.075 -8.834 3.370 1.00 53.22 N ATOM 1233 CA ASN A 82 -18.983 -7.710 3.483 1.00 71.21 C ATOM 1234 C ASN A 82 -18.328 -6.656 4.363 1.00 12.54 C ATOM 1235 O ASN A 82 -18.901 -6.249 5.375 1.00 21.24 O ATOM 1236 CB ASN A 82 -20.335 -8.217 4.009 1.00 15.33 C ATOM 1237 CG ASN A 82 -21.058 -9.092 2.994 1.00 4.52 C ATOM 1238 OD1 ASN A 82 -21.526 -8.599 1.966 1.00 21.02 O ATOM 1239 ND2 ASN A 82 -21.126 -10.395 3.207 1.00 23.20 N ATOM 0 H ASN A 82 -17.879 -9.286 4.263 1.00 53.22 H new ATOM 0 HA ASN A 82 -19.185 -7.239 2.521 1.00 71.21 H new ATOM 0 HB2 ASN A 82 -20.176 -8.784 4.926 1.00 15.33 H new ATOM 0 HB3 ASN A 82 -20.965 -7.365 4.266 1.00 15.33 H new ATOM 0 HD21 ASN A 82 -21.569 -11.002 2.517 1.00 23.20 H new ATOM 0 HD22 ASN A 82 -20.736 -10.793 4.061 1.00 23.20 H new ATOM 1246 N THR A 83 -17.109 -6.236 4.025 1.00 41.11 N ATOM 1247 CA THR A 83 -16.312 -5.307 4.817 1.00 21.11 C ATOM 1248 C THR A 83 -16.207 -3.936 4.132 1.00 31.40 C ATOM 1249 O THR A 83 -16.234 -3.831 2.901 1.00 71.31 O ATOM 1250 CB THR A 83 -14.970 -5.991 5.136 1.00 75.41 C ATOM 1251 OG1 THR A 83 -15.200 -7.022 6.072 1.00 22.31 O ATOM 1252 CG2 THR A 83 -13.958 -5.029 5.741 1.00 71.45 C ATOM 0 H THR A 83 -16.640 -6.541 3.172 1.00 41.11 H new ATOM 0 HA THR A 83 -16.791 -5.077 5.769 1.00 21.11 H new ATOM 0 HB THR A 83 -14.564 -6.371 4.198 1.00 75.41 H new ATOM 0 HG1 THR A 83 -14.356 -7.260 6.510 1.00 22.31 H new ATOM 0 HG21 THR A 83 -13.029 -5.561 5.948 1.00 71.45 H new ATOM 0 HG22 THR A 83 -13.763 -4.217 5.040 1.00 71.45 H new ATOM 0 HG23 THR A 83 -14.356 -4.619 6.669 1.00 71.45 H new ATOM 1260 N THR A 84 -16.085 -2.878 4.941 1.00 20.00 N ATOM 1261 CA THR A 84 -15.931 -1.488 4.517 1.00 72.02 C ATOM 1262 C THR A 84 -14.889 -0.772 5.396 1.00 62.04 C ATOM 1263 O THR A 84 -14.673 -1.156 6.551 1.00 0.51 O ATOM 1264 CB THR A 84 -17.298 -0.774 4.578 1.00 14.23 C ATOM 1265 OG1 THR A 84 -18.054 -1.150 5.714 1.00 34.10 O ATOM 1266 CG2 THR A 84 -18.164 -1.098 3.363 1.00 42.35 C ATOM 0 H THR A 84 -16.092 -2.976 5.956 1.00 20.00 H new ATOM 0 HA THR A 84 -15.572 -1.461 3.488 1.00 72.02 H new ATOM 0 HB THR A 84 -17.055 0.288 4.615 1.00 14.23 H new ATOM 0 HG1 THR A 84 -18.909 -0.672 5.711 1.00 34.10 H new ATOM 0 HG21 THR A 84 -19.117 -0.575 3.446 1.00 42.35 H new ATOM 0 HG22 THR A 84 -17.652 -0.778 2.456 1.00 42.35 H new ATOM 0 HG23 THR A 84 -18.342 -2.172 3.319 1.00 42.35 H new ATOM 1274 N VAL A 85 -14.266 0.278 4.849 1.00 53.11 N ATOM 1275 CA VAL A 85 -13.370 1.189 5.556 1.00 14.40 C ATOM 1276 C VAL A 85 -13.681 2.619 5.137 1.00 62.15 C ATOM 1277 O VAL A 85 -13.866 2.906 3.948 1.00 34.34 O ATOM 1278 CB VAL A 85 -11.874 0.889 5.296 1.00 55.53 C ATOM 1279 CG1 VAL A 85 -11.302 -0.077 6.325 1.00 32.30 C ATOM 1280 CG2 VAL A 85 -11.516 0.441 3.863 1.00 55.25 C ATOM 0 H VAL A 85 -14.379 0.522 3.865 1.00 53.11 H new ATOM 0 HA VAL A 85 -13.541 1.049 6.623 1.00 14.40 H new ATOM 0 HB VAL A 85 -11.396 1.862 5.409 1.00 55.53 H new ATOM 0 HG11 VAL A 85 -10.250 -0.261 6.106 1.00 32.30 H new ATOM 0 HG12 VAL A 85 -11.395 0.355 7.321 1.00 32.30 H new ATOM 0 HG13 VAL A 85 -11.851 -1.018 6.285 1.00 32.30 H new ATOM 0 HG21 VAL A 85 -10.443 0.259 3.796 1.00 55.25 H new ATOM 0 HG22 VAL A 85 -12.055 -0.475 3.623 1.00 55.25 H new ATOM 0 HG23 VAL A 85 -11.796 1.223 3.157 1.00 55.25 H new ATOM 1290 N SER A 86 -13.663 3.526 6.107 1.00 42.13 N ATOM 1291 CA SER A 86 -13.719 4.953 5.895 1.00 0.33 C ATOM 1292 C SER A 86 -12.540 5.365 5.004 1.00 42.52 C ATOM 1293 O SER A 86 -11.469 4.753 5.054 1.00 51.41 O ATOM 1294 CB SER A 86 -13.731 5.629 7.267 1.00 42.03 C ATOM 1295 OG SER A 86 -14.756 5.047 8.057 1.00 4.24 O ATOM 0 H SER A 86 -13.607 3.271 7.093 1.00 42.13 H new ATOM 0 HA SER A 86 -14.622 5.267 5.372 1.00 0.33 H new ATOM 0 HB2 SER A 86 -12.764 5.508 7.755 1.00 42.03 H new ATOM 0 HB3 SER A 86 -13.901 6.700 7.158 1.00 42.03 H new ATOM 0 HG SER A 86 -14.770 5.473 8.940 1.00 4.24 H new ATOM 1301 N GLY A 87 -12.722 6.382 4.164 1.00 44.11 N ATOM 1302 CA GLY A 87 -11.710 6.834 3.217 1.00 21.25 C ATOM 1303 C GLY A 87 -10.485 7.329 3.975 1.00 61.10 C ATOM 1304 O GLY A 87 -9.372 6.866 3.738 1.00 15.11 O ATOM 0 H GLY A 87 -13.587 6.920 4.123 1.00 44.11 H new ATOM 0 HA2 GLY A 87 -11.432 6.018 2.550 1.00 21.25 H new ATOM 0 HA3 GLY A 87 -12.112 7.633 2.594 1.00 21.25 H new ATOM 1308 N GLU A 88 -10.738 8.214 4.936 1.00 55.30 N ATOM 1309 CA GLU A 88 -9.750 8.845 5.806 1.00 2.22 C ATOM 1310 C GLU A 88 -8.908 7.788 6.524 1.00 75.20 C ATOM 1311 O GLU A 88 -7.681 7.825 6.529 1.00 64.52 O ATOM 1312 CB GLU A 88 -10.505 9.713 6.828 1.00 51.02 C ATOM 1313 CG GLU A 88 -9.587 10.651 7.635 1.00 2.24 C ATOM 1314 CD GLU A 88 -9.989 10.893 9.095 1.00 33.15 C ATOM 1315 OE1 GLU A 88 -11.028 10.389 9.581 1.00 44.33 O ATOM 1316 OE2 GLU A 88 -9.216 11.601 9.780 1.00 34.34 O ATOM 0 H GLU A 88 -11.688 8.526 5.139 1.00 55.30 H new ATOM 0 HA GLU A 88 -9.071 9.460 5.215 1.00 2.22 H new ATOM 0 HB2 GLU A 88 -11.251 10.310 6.304 1.00 51.02 H new ATOM 0 HB3 GLU A 88 -11.043 9.063 7.518 1.00 51.02 H new ATOM 0 HG2 GLU A 88 -8.578 10.240 7.620 1.00 2.24 H new ATOM 0 HG3 GLU A 88 -9.547 11.614 7.126 1.00 2.24 H new ATOM 1323 N ASP A 89 -9.594 6.834 7.143 1.00 61.11 N ATOM 1324 CA ASP A 89 -9.021 5.793 7.990 1.00 34.25 C ATOM 1325 C ASP A 89 -8.148 4.838 7.186 1.00 62.41 C ATOM 1326 O ASP A 89 -7.097 4.394 7.639 1.00 51.24 O ATOM 1327 CB ASP A 89 -10.212 5.036 8.578 1.00 11.14 C ATOM 1328 CG ASP A 89 -9.837 4.029 9.656 1.00 40.22 C ATOM 1329 OD1 ASP A 89 -9.841 4.413 10.846 1.00 32.33 O ATOM 1330 OD2 ASP A 89 -9.713 2.828 9.333 1.00 71.43 O ATOM 0 H ASP A 89 -10.608 6.761 7.065 1.00 61.11 H new ATOM 0 HA ASP A 89 -8.384 6.228 8.760 1.00 34.25 H new ATOM 0 HB2 ASP A 89 -10.915 5.756 8.997 1.00 11.14 H new ATOM 0 HB3 ASP A 89 -10.731 4.515 7.773 1.00 11.14 H new ATOM 1335 N SER A 90 -8.540 4.600 5.937 1.00 24.24 N ATOM 1336 CA SER A 90 -7.796 3.808 4.964 1.00 71.24 C ATOM 1337 C SER A 90 -6.530 4.534 4.457 1.00 72.42 C ATOM 1338 O SER A 90 -5.822 3.965 3.615 1.00 35.35 O ATOM 1339 CB SER A 90 -8.752 3.487 3.816 1.00 23.13 C ATOM 1340 OG SER A 90 -8.166 2.599 2.891 1.00 23.15 O ATOM 0 H SER A 90 -9.415 4.967 5.562 1.00 24.24 H new ATOM 0 HA SER A 90 -7.436 2.893 5.434 1.00 71.24 H new ATOM 0 HB2 SER A 90 -9.667 3.048 4.214 1.00 23.13 H new ATOM 0 HB3 SER A 90 -9.035 4.409 3.308 1.00 23.13 H new ATOM 0 HG SER A 90 -7.195 2.728 2.884 1.00 23.15 H new ATOM 1346 N TRP A 91 -6.262 5.762 4.916 1.00 51.03 N ATOM 1347 CA TRP A 91 -5.125 6.595 4.540 1.00 53.40 C ATOM 1348 C TRP A 91 -4.275 6.950 5.764 1.00 53.02 C ATOM 1349 O TRP A 91 -3.045 6.978 5.667 1.00 63.32 O ATOM 1350 CB TRP A 91 -5.665 7.855 3.839 1.00 23.21 C ATOM 1351 CG TRP A 91 -4.648 8.846 3.363 1.00 13.24 C ATOM 1352 CD1 TRP A 91 -4.169 8.928 2.104 1.00 64.51 C ATOM 1353 CD2 TRP A 91 -4.009 9.936 4.101 1.00 74.42 C ATOM 1354 NE1 TRP A 91 -3.278 9.971 2.009 1.00 55.10 N ATOM 1355 CE2 TRP A 91 -3.140 10.628 3.208 1.00 32.44 C ATOM 1356 CE3 TRP A 91 -4.077 10.418 5.427 1.00 74.23 C ATOM 1357 CZ2 TRP A 91 -2.371 11.724 3.609 1.00 21.15 C ATOM 1358 CZ3 TRP A 91 -3.345 11.553 5.825 1.00 42.00 C ATOM 1359 CH2 TRP A 91 -2.508 12.214 4.915 1.00 41.22 C ATOM 0 H TRP A 91 -6.868 6.221 5.596 1.00 51.03 H new ATOM 0 HA TRP A 91 -4.472 6.051 3.857 1.00 53.40 H new ATOM 0 HB2 TRP A 91 -6.260 7.539 2.982 1.00 23.21 H new ATOM 0 HB3 TRP A 91 -6.341 8.364 4.526 1.00 23.21 H new ATOM 0 HD1 TRP A 91 -4.445 8.272 1.292 1.00 64.51 H new ATOM 0 HE1 TRP A 91 -2.781 10.225 1.155 1.00 55.10 H new ATOM 0 HE3 TRP A 91 -4.700 9.908 6.147 1.00 74.23 H new ATOM 0 HZ2 TRP A 91 -1.680 12.188 2.921 1.00 21.15 H new ATOM 0 HZ3 TRP A 91 -3.429 11.917 6.838 1.00 42.00 H new ATOM 0 HH2 TRP A 91 -1.970 13.099 5.220 1.00 41.22 H new ATOM 1370 N LYS A 92 -4.908 7.234 6.909 1.00 55.24 N ATOM 1371 CA LYS A 92 -4.268 7.708 8.126 1.00 51.30 C ATOM 1372 C LYS A 92 -3.157 6.767 8.587 1.00 44.21 C ATOM 1373 O LYS A 92 -1.992 7.173 8.603 1.00 11.42 O ATOM 1374 CB LYS A 92 -5.334 7.907 9.224 1.00 62.21 C ATOM 1375 CG LYS A 92 -6.047 9.260 9.057 1.00 43.11 C ATOM 1376 CD LYS A 92 -5.161 10.408 9.528 1.00 35.44 C ATOM 1377 CE LYS A 92 -5.478 11.697 8.780 1.00 64.54 C ATOM 1378 NZ LYS A 92 -6.668 12.400 9.295 1.00 75.31 N ATOM 0 H LYS A 92 -5.918 7.134 7.009 1.00 55.24 H new ATOM 0 HA LYS A 92 -3.793 8.667 7.918 1.00 51.30 H new ATOM 0 HB2 LYS A 92 -6.064 7.099 9.179 1.00 62.21 H new ATOM 0 HB3 LYS A 92 -4.864 7.858 10.206 1.00 62.21 H new ATOM 0 HG2 LYS A 92 -6.313 9.408 8.010 1.00 43.11 H new ATOM 0 HG3 LYS A 92 -6.977 9.257 9.625 1.00 43.11 H new ATOM 0 HD2 LYS A 92 -5.301 10.562 10.598 1.00 35.44 H new ATOM 0 HD3 LYS A 92 -4.114 10.147 9.378 1.00 35.44 H new ATOM 0 HE2 LYS A 92 -4.618 12.364 8.841 1.00 64.54 H new ATOM 0 HE3 LYS A 92 -5.630 11.468 7.725 1.00 64.54 H new ATOM 0 HZ1 LYS A 92 -6.846 13.249 8.721 1.00 75.31 H new ATOM 0 HZ2 LYS A 92 -7.493 11.769 9.245 1.00 75.31 H new ATOM 0 HZ3 LYS A 92 -6.506 12.679 10.284 1.00 75.31 H new ATOM 1392 N THR A 93 -3.516 5.545 8.962 1.00 43.14 N ATOM 1393 CA THR A 93 -2.638 4.510 9.492 1.00 52.20 C ATOM 1394 C THR A 93 -1.522 4.246 8.477 1.00 15.24 C ATOM 1395 O THR A 93 -0.339 4.325 8.806 1.00 32.55 O ATOM 1396 CB THR A 93 -3.486 3.247 9.795 1.00 2.32 C ATOM 1397 OG1 THR A 93 -4.866 3.580 9.898 1.00 34.23 O ATOM 1398 CG2 THR A 93 -3.086 2.495 11.058 1.00 53.34 C ATOM 0 H THR A 93 -4.485 5.232 8.900 1.00 43.14 H new ATOM 0 HA THR A 93 -2.166 4.820 10.424 1.00 52.20 H new ATOM 0 HB THR A 93 -3.294 2.584 8.951 1.00 2.32 H new ATOM 0 HG1 THR A 93 -5.337 2.874 10.388 1.00 34.23 H new ATOM 0 HG21 THR A 93 -3.735 1.628 11.186 1.00 53.34 H new ATOM 0 HG22 THR A 93 -2.051 2.164 10.972 1.00 53.34 H new ATOM 0 HG23 THR A 93 -3.186 3.154 11.921 1.00 53.34 H new ATOM 1406 N LEU A 94 -1.902 4.007 7.219 1.00 2.24 N ATOM 1407 CA LEU A 94 -1.027 3.740 6.087 1.00 51.22 C ATOM 1408 C LEU A 94 0.070 4.796 5.999 1.00 14.03 C ATOM 1409 O LEU A 94 1.247 4.451 6.068 1.00 63.12 O ATOM 1410 CB LEU A 94 -1.916 3.653 4.826 1.00 31.41 C ATOM 1411 CG LEU A 94 -1.233 3.394 3.466 1.00 54.33 C ATOM 1412 CD1 LEU A 94 -2.321 3.003 2.451 1.00 51.10 C ATOM 1413 CD2 LEU A 94 -0.501 4.618 2.893 1.00 33.55 C ATOM 0 H LEU A 94 -2.887 3.995 6.954 1.00 2.24 H new ATOM 0 HA LEU A 94 -0.499 2.793 6.198 1.00 51.22 H new ATOM 0 HB2 LEU A 94 -2.646 2.860 4.988 1.00 31.41 H new ATOM 0 HB3 LEU A 94 -2.472 4.587 4.746 1.00 31.41 H new ATOM 0 HG LEU A 94 -0.492 2.612 3.633 1.00 54.33 H new ATOM 0 HD11 LEU A 94 -1.862 2.815 1.480 1.00 51.10 H new ATOM 0 HD12 LEU A 94 -2.830 2.102 2.793 1.00 51.10 H new ATOM 0 HD13 LEU A 94 -3.042 3.815 2.360 1.00 51.10 H new ATOM 0 HD21 LEU A 94 -0.047 4.356 1.937 1.00 33.55 H new ATOM 0 HD22 LEU A 94 -1.212 5.431 2.747 1.00 33.55 H new ATOM 0 HD23 LEU A 94 0.276 4.936 3.588 1.00 33.55 H new ATOM 1425 N THR A 95 -0.287 6.074 5.860 1.00 63.12 N ATOM 1426 CA THR A 95 0.710 7.121 5.664 1.00 34.12 C ATOM 1427 C THR A 95 1.619 7.293 6.868 1.00 71.30 C ATOM 1428 O THR A 95 2.828 7.461 6.690 1.00 32.45 O ATOM 1429 CB THR A 95 0.065 8.462 5.320 1.00 42.00 C ATOM 1430 OG1 THR A 95 -1.045 8.784 6.141 1.00 52.20 O ATOM 1431 CG2 THR A 95 -0.336 8.504 3.852 1.00 20.54 C ATOM 0 H THR A 95 -1.252 6.405 5.880 1.00 63.12 H new ATOM 0 HA THR A 95 1.318 6.793 4.821 1.00 34.12 H new ATOM 0 HB THR A 95 0.824 9.220 5.514 1.00 42.00 H new ATOM 0 HG1 THR A 95 -1.811 8.226 5.889 1.00 52.20 H new ATOM 0 HG21 THR A 95 -0.794 9.467 3.627 1.00 20.54 H new ATOM 0 HG22 THR A 95 0.548 8.368 3.229 1.00 20.54 H new ATOM 0 HG23 THR A 95 -1.050 7.707 3.647 1.00 20.54 H new ATOM 1439 N SER A 96 1.053 7.227 8.073 1.00 42.10 N ATOM 1440 CA SER A 96 1.806 7.273 9.307 1.00 21.21 C ATOM 1441 C SER A 96 2.916 6.222 9.235 1.00 12.33 C ATOM 1442 O SER A 96 4.105 6.543 9.314 1.00 54.11 O ATOM 1443 CB SER A 96 0.819 7.023 10.454 1.00 42.24 C ATOM 1444 OG SER A 96 1.379 7.305 11.709 1.00 55.10 O ATOM 0 H SER A 96 0.046 7.139 8.211 1.00 42.10 H new ATOM 0 HA SER A 96 2.286 8.237 9.474 1.00 21.21 H new ATOM 0 HB2 SER A 96 -0.068 7.639 10.308 1.00 42.24 H new ATOM 0 HB3 SER A 96 0.493 5.983 10.430 1.00 42.24 H new ATOM 0 HG SER A 96 0.715 7.134 12.409 1.00 55.10 H new ATOM 1450 N LYS A 97 2.530 4.972 8.974 1.00 55.22 N ATOM 1451 CA LYS A 97 3.387 3.808 9.153 1.00 22.43 C ATOM 1452 C LYS A 97 4.529 3.735 8.138 1.00 4.12 C ATOM 1453 O LYS A 97 5.458 2.937 8.317 1.00 42.32 O ATOM 1454 CB LYS A 97 2.499 2.552 9.148 1.00 64.44 C ATOM 1455 CG LYS A 97 2.048 2.139 10.558 1.00 54.42 C ATOM 1456 CD LYS A 97 1.157 3.121 11.339 1.00 0.04 C ATOM 1457 CE LYS A 97 1.254 2.909 12.855 1.00 74.14 C ATOM 1458 NZ LYS A 97 0.811 1.568 13.280 1.00 13.02 N ATOM 0 H LYS A 97 1.599 4.741 8.627 1.00 55.22 H new ATOM 0 HA LYS A 97 3.897 3.887 10.113 1.00 22.43 H new ATOM 0 HB2 LYS A 97 1.621 2.735 8.529 1.00 64.44 H new ATOM 0 HB3 LYS A 97 3.045 1.728 8.690 1.00 64.44 H new ATOM 0 HG2 LYS A 97 1.513 1.193 10.476 1.00 54.42 H new ATOM 0 HG3 LYS A 97 2.941 1.949 11.154 1.00 54.42 H new ATOM 0 HD2 LYS A 97 1.447 4.144 11.097 1.00 0.04 H new ATOM 0 HD3 LYS A 97 0.121 3.000 11.022 1.00 0.04 H new ATOM 0 HE2 LYS A 97 2.286 3.062 13.172 1.00 74.14 H new ATOM 0 HE3 LYS A 97 0.650 3.662 13.361 1.00 74.14 H new ATOM 0 HZ1 LYS A 97 0.867 1.496 14.316 1.00 13.02 H new ATOM 0 HZ2 LYS A 97 -0.171 1.414 12.975 1.00 13.02 H new ATOM 0 HZ3 LYS A 97 1.424 0.847 12.849 1.00 13.02 H new ATOM 1472 N LEU A 98 4.506 4.560 7.090 1.00 20.41 N ATOM 1473 CA LEU A 98 5.594 4.701 6.135 1.00 3.13 C ATOM 1474 C LEU A 98 6.752 5.490 6.747 1.00 21.12 C ATOM 1475 O LEU A 98 7.910 5.074 6.622 1.00 52.42 O ATOM 1476 CB LEU A 98 5.084 5.400 4.865 1.00 55.01 C ATOM 1477 CG LEU A 98 4.079 4.568 4.046 1.00 34.14 C ATOM 1478 CD1 LEU A 98 3.490 5.434 2.930 1.00 20.42 C ATOM 1479 CD2 LEU A 98 4.699 3.295 3.454 1.00 42.43 C ATOM 0 H LEU A 98 3.709 5.161 6.881 1.00 20.41 H new ATOM 0 HA LEU A 98 5.960 3.708 5.873 1.00 3.13 H new ATOM 0 HB2 LEU A 98 4.614 6.342 5.146 1.00 55.01 H new ATOM 0 HB3 LEU A 98 5.937 5.645 4.232 1.00 55.01 H new ATOM 0 HG LEU A 98 3.293 4.244 4.729 1.00 34.14 H new ATOM 0 HD11 LEU A 98 2.779 4.846 2.350 1.00 20.42 H new ATOM 0 HD12 LEU A 98 2.980 6.293 3.367 1.00 20.42 H new ATOM 0 HD13 LEU A 98 4.291 5.781 2.277 1.00 20.42 H new ATOM 0 HD21 LEU A 98 3.943 2.751 2.888 1.00 42.43 H new ATOM 0 HD22 LEU A 98 5.522 3.565 2.793 1.00 42.43 H new ATOM 0 HD23 LEU A 98 5.073 2.664 4.260 1.00 42.43 H new ATOM 1491 N LYS A 99 6.487 6.636 7.391 1.00 43.34 N ATOM 1492 CA LYS A 99 7.535 7.519 7.876 1.00 3.04 C ATOM 1493 C LYS A 99 8.403 6.820 8.933 1.00 54.22 C ATOM 1494 O LYS A 99 9.600 7.097 9.003 1.00 34.35 O ATOM 1495 CB LYS A 99 6.894 8.824 8.389 1.00 71.10 C ATOM 1496 CG LYS A 99 7.679 10.089 8.006 1.00 15.33 C ATOM 1497 CD LYS A 99 9.099 10.047 8.557 1.00 61.10 C ATOM 1498 CE LYS A 99 9.872 11.350 8.361 1.00 74.21 C ATOM 1499 NZ LYS A 99 10.328 11.504 6.960 1.00 12.35 N ATOM 0 H LYS A 99 5.542 6.968 7.585 1.00 43.34 H new ATOM 0 HA LYS A 99 8.212 7.775 7.061 1.00 3.04 H new ATOM 0 HB2 LYS A 99 5.881 8.901 7.993 1.00 71.10 H new ATOM 0 HB3 LYS A 99 6.809 8.774 9.475 1.00 71.10 H new ATOM 0 HG2 LYS A 99 7.710 10.186 6.921 1.00 15.33 H new ATOM 0 HG3 LYS A 99 7.164 10.970 8.390 1.00 15.33 H new ATOM 0 HD2 LYS A 99 9.060 9.815 9.621 1.00 61.10 H new ATOM 0 HD3 LYS A 99 9.643 9.236 8.073 1.00 61.10 H new ATOM 0 HE2 LYS A 99 9.239 12.194 8.634 1.00 74.21 H new ATOM 0 HE3 LYS A 99 10.733 11.368 9.029 1.00 74.21 H new ATOM 0 HZ1 LYS A 99 10.327 12.512 6.703 1.00 12.35 H new ATOM 0 HZ2 LYS A 99 11.291 11.123 6.865 1.00 12.35 H new ATOM 0 HZ3 LYS A 99 9.686 10.985 6.327 1.00 12.35 H new ATOM 1513 N GLU A 100 7.870 5.838 9.662 1.00 20.55 N ATOM 1514 CA GLU A 100 8.631 4.967 10.564 1.00 34.32 C ATOM 1515 C GLU A 100 9.936 4.447 9.954 1.00 20.34 C ATOM 1516 O GLU A 100 10.925 4.272 10.665 1.00 2.31 O ATOM 1517 CB GLU A 100 7.800 3.740 10.927 1.00 54.30 C ATOM 1518 CG GLU A 100 6.952 3.909 12.189 1.00 71.42 C ATOM 1519 CD GLU A 100 7.238 2.755 13.146 1.00 1.43 C ATOM 1520 OE1 GLU A 100 6.915 1.600 12.804 1.00 62.43 O ATOM 1521 OE2 GLU A 100 7.947 2.978 14.162 1.00 4.41 O ATOM 0 H GLU A 100 6.874 5.620 9.642 1.00 20.55 H new ATOM 0 HA GLU A 100 8.868 5.583 11.432 1.00 34.32 H new ATOM 0 HB2 GLU A 100 7.143 3.499 10.091 1.00 54.30 H new ATOM 0 HB3 GLU A 100 8.468 2.890 11.063 1.00 54.30 H new ATOM 0 HG2 GLU A 100 7.180 4.860 12.670 1.00 71.42 H new ATOM 0 HG3 GLU A 100 5.893 3.928 11.930 1.00 71.42 H new ATOM 1528 N LYS A 101 9.946 4.182 8.646 1.00 71.52 N ATOM 1529 CA LYS A 101 11.081 3.615 7.926 1.00 61.23 C ATOM 1530 C LYS A 101 11.573 4.582 6.846 1.00 21.55 C ATOM 1531 O LYS A 101 12.146 4.168 5.841 1.00 23.14 O ATOM 1532 CB LYS A 101 10.697 2.208 7.430 1.00 42.30 C ATOM 1533 CG LYS A 101 10.489 1.197 8.574 1.00 75.13 C ATOM 1534 CD LYS A 101 11.783 0.917 9.351 1.00 11.31 C ATOM 1535 CE LYS A 101 11.629 -0.305 10.261 1.00 22.52 C ATOM 1536 NZ LYS A 101 12.873 -0.576 11.016 1.00 71.44 N ATOM 0 H LYS A 101 9.142 4.362 8.045 1.00 71.52 H new ATOM 0 HA LYS A 101 11.944 3.484 8.579 1.00 61.23 H new ATOM 0 HB2 LYS A 101 9.782 2.274 6.842 1.00 42.30 H new ATOM 0 HB3 LYS A 101 11.478 1.839 6.765 1.00 42.30 H new ATOM 0 HG2 LYS A 101 9.732 1.579 9.259 1.00 75.13 H new ATOM 0 HG3 LYS A 101 10.105 0.263 8.164 1.00 75.13 H new ATOM 0 HD2 LYS A 101 12.602 0.752 8.651 1.00 11.31 H new ATOM 0 HD3 LYS A 101 12.047 1.789 9.950 1.00 11.31 H new ATOM 0 HE2 LYS A 101 10.807 -0.140 10.958 1.00 22.52 H new ATOM 0 HE3 LYS A 101 11.368 -1.177 9.661 1.00 22.52 H new ATOM 0 HZ1 LYS A 101 12.736 -1.409 11.623 1.00 71.44 H new ATOM 0 HZ2 LYS A 101 13.651 -0.757 10.350 1.00 71.44 H new ATOM 0 HZ3 LYS A 101 13.107 0.247 11.606 1.00 71.44 H new ATOM 1550 N GLY A 102 11.327 5.880 7.038 1.00 14.12 N ATOM 1551 CA GLY A 102 11.747 6.941 6.139 1.00 15.42 C ATOM 1552 C GLY A 102 11.043 6.890 4.786 1.00 35.12 C ATOM 1553 O GLY A 102 11.431 7.612 3.871 1.00 54.40 O ATOM 0 H GLY A 102 10.814 6.225 7.849 1.00 14.12 H new ATOM 0 HA2 GLY A 102 11.552 7.905 6.608 1.00 15.42 H new ATOM 0 HA3 GLY A 102 12.824 6.874 5.985 1.00 15.42 H new ATOM 1557 N LEU A 103 10.003 6.064 4.629 1.00 15.41 N ATOM 1558 CA LEU A 103 9.420 5.734 3.331 1.00 75.33 C ATOM 1559 C LEU A 103 8.510 6.842 2.770 1.00 14.14 C ATOM 1560 O LEU A 103 7.741 6.560 1.855 1.00 35.33 O ATOM 1561 CB LEU A 103 8.648 4.396 3.387 1.00 24.11 C ATOM 1562 CG LEU A 103 9.369 3.170 3.980 1.00 62.34 C ATOM 1563 CD1 LEU A 103 8.428 1.962 3.981 1.00 62.33 C ATOM 1564 CD2 LEU A 103 10.654 2.774 3.248 1.00 11.13 C ATOM 0 H LEU A 103 9.539 5.602 5.411 1.00 15.41 H new ATOM 0 HA LEU A 103 10.263 5.636 2.647 1.00 75.33 H new ATOM 0 HB2 LEU A 103 7.738 4.559 3.964 1.00 24.11 H new ATOM 0 HB3 LEU A 103 8.341 4.144 2.372 1.00 24.11 H new ATOM 0 HG LEU A 103 9.654 3.465 4.990 1.00 62.34 H new ATOM 0 HD11 LEU A 103 8.944 1.099 4.401 1.00 62.33 H new ATOM 0 HD12 LEU A 103 7.548 2.187 4.583 1.00 62.33 H new ATOM 0 HD13 LEU A 103 8.121 1.739 2.959 1.00 62.33 H new ATOM 0 HD21 LEU A 103 11.095 1.903 3.732 1.00 11.13 H new ATOM 0 HD22 LEU A 103 10.422 2.534 2.210 1.00 11.13 H new ATOM 0 HD23 LEU A 103 11.361 3.603 3.280 1.00 11.13 H new ATOM 1576 N VAL A 104 8.544 8.062 3.316 1.00 3.33 N ATOM 1577 CA VAL A 104 7.928 9.232 2.696 1.00 54.42 C ATOM 1578 C VAL A 104 8.715 10.507 3.026 1.00 63.23 C ATOM 1579 O VAL A 104 9.417 10.565 4.050 1.00 62.10 O ATOM 1580 CB VAL A 104 6.449 9.426 3.102 1.00 74.50 C ATOM 1581 CG1 VAL A 104 5.476 8.412 2.496 1.00 35.52 C ATOM 1582 CG2 VAL A 104 6.218 9.468 4.619 1.00 23.14 C ATOM 0 H VAL A 104 9.003 8.263 4.205 1.00 3.33 H new ATOM 0 HA VAL A 104 7.954 9.047 1.622 1.00 54.42 H new ATOM 0 HB VAL A 104 6.229 10.406 2.677 1.00 74.50 H new ATOM 0 HG11 VAL A 104 4.464 8.629 2.838 1.00 35.52 H new ATOM 0 HG12 VAL A 104 5.513 8.477 1.409 1.00 35.52 H new ATOM 0 HG13 VAL A 104 5.757 7.406 2.809 1.00 35.52 H new ATOM 0 HG21 VAL A 104 5.156 9.607 4.822 1.00 23.14 H new ATOM 0 HG22 VAL A 104 6.553 8.531 5.064 1.00 23.14 H new ATOM 0 HG23 VAL A 104 6.781 10.296 5.050 1.00 23.14 H new ATOM 1592 N THR A 105 8.522 11.531 2.189 1.00 1.35 N ATOM 1593 CA THR A 105 9.068 12.873 2.325 1.00 20.24 C ATOM 1594 C THR A 105 8.012 13.849 2.855 1.00 15.14 C ATOM 1595 O THR A 105 6.810 13.580 2.809 1.00 42.44 O ATOM 1596 CB THR A 105 9.676 13.322 0.975 1.00 22.22 C ATOM 1597 OG1 THR A 105 8.844 13.054 -0.147 1.00 51.30 O ATOM 1598 CG2 THR A 105 10.960 12.548 0.705 1.00 0.34 C ATOM 0 H THR A 105 7.947 11.434 1.352 1.00 1.35 H new ATOM 0 HA THR A 105 9.869 12.867 3.065 1.00 20.24 H new ATOM 0 HB THR A 105 9.823 14.397 1.077 1.00 22.22 H new ATOM 0 HG1 THR A 105 9.287 13.364 -0.964 1.00 51.30 H new ATOM 0 HG21 THR A 105 11.384 12.868 -0.247 1.00 0.34 H new ATOM 0 HG22 THR A 105 11.676 12.740 1.504 1.00 0.34 H new ATOM 0 HG23 THR A 105 10.740 11.481 0.664 1.00 0.34 H new ATOM 1606 N ASP A 106 8.445 15.009 3.349 1.00 23.24 N ATOM 1607 CA ASP A 106 7.574 16.017 3.925 1.00 62.51 C ATOM 1608 C ASP A 106 6.707 16.584 2.815 1.00 42.41 C ATOM 1609 O ASP A 106 7.224 17.113 1.830 1.00 21.43 O ATOM 1610 CB ASP A 106 8.395 17.158 4.543 1.00 23.25 C ATOM 1611 CG ASP A 106 8.851 16.941 5.981 1.00 14.34 C ATOM 1612 OD1 ASP A 106 8.274 16.092 6.690 1.00 33.15 O ATOM 1613 OD2 ASP A 106 9.794 17.643 6.417 1.00 15.32 O ATOM 0 H ASP A 106 9.430 15.273 3.357 1.00 23.24 H new ATOM 0 HA ASP A 106 6.966 15.562 4.707 1.00 62.51 H new ATOM 0 HB2 ASP A 106 9.276 17.324 3.923 1.00 23.25 H new ATOM 0 HB3 ASP A 106 7.801 18.071 4.504 1.00 23.25 H new ATOM 1618 N GLY A 107 5.387 16.528 2.968 1.00 34.41 N ATOM 1619 CA GLY A 107 4.460 17.106 2.005 1.00 42.13 C ATOM 1620 C GLY A 107 4.188 16.216 0.789 1.00 71.24 C ATOM 1621 O GLY A 107 3.469 16.667 -0.105 1.00 61.14 O ATOM 0 H GLY A 107 4.932 16.080 3.763 1.00 34.41 H new ATOM 0 HA2 GLY A 107 3.515 17.316 2.507 1.00 42.13 H new ATOM 0 HA3 GLY A 107 4.858 18.061 1.661 1.00 42.13 H new ATOM 1625 N GLN A 108 4.710 14.981 0.732 1.00 74.42 N ATOM 1626 CA GLN A 108 4.318 14.013 -0.280 1.00 63.24 C ATOM 1627 C GLN A 108 2.814 13.801 -0.232 1.00 14.35 C ATOM 1628 O GLN A 108 2.231 13.674 0.853 1.00 73.52 O ATOM 1629 CB GLN A 108 5.011 12.672 -0.010 1.00 75.20 C ATOM 1630 CG GLN A 108 5.719 12.135 -1.244 1.00 11.44 C ATOM 1631 CD GLN A 108 6.437 10.823 -0.952 1.00 2.44 C ATOM 1632 OE1 GLN A 108 6.663 10.454 0.188 1.00 14.11 O ATOM 1633 NE2 GLN A 108 6.844 10.076 -1.953 1.00 72.41 N ATOM 0 H GLN A 108 5.412 14.636 1.387 1.00 74.42 H new ATOM 0 HA GLN A 108 4.609 14.391 -1.260 1.00 63.24 H new ATOM 0 HB2 GLN A 108 5.733 12.794 0.797 1.00 75.20 H new ATOM 0 HB3 GLN A 108 4.273 11.945 0.329 1.00 75.20 H new ATOM 0 HG2 GLN A 108 4.994 11.983 -2.043 1.00 11.44 H new ATOM 0 HG3 GLN A 108 6.438 12.872 -1.601 1.00 11.44 H new ATOM 0 HE21 GLN A 108 6.664 10.368 -2.914 1.00 72.41 H new ATOM 0 HE22 GLN A 108 7.340 9.204 -1.770 1.00 72.41 H new ATOM 1642 N THR A 109 2.210 13.657 -1.401 1.00 53.12 N ATOM 1643 CA THR A 109 0.765 13.525 -1.533 1.00 62.34 C ATOM 1644 C THR A 109 0.454 12.070 -1.895 1.00 34.22 C ATOM 1645 O THR A 109 0.558 11.661 -3.056 1.00 24.43 O ATOM 1646 CB THR A 109 0.203 14.594 -2.494 1.00 31.02 C ATOM 1647 OG1 THR A 109 0.994 15.774 -2.458 1.00 74.40 O ATOM 1648 CG2 THR A 109 -1.211 15.002 -2.098 1.00 5.13 C ATOM 0 H THR A 109 2.709 13.628 -2.290 1.00 53.12 H new ATOM 0 HA THR A 109 0.247 13.729 -0.596 1.00 62.34 H new ATOM 0 HB THR A 109 0.211 14.149 -3.489 1.00 31.02 H new ATOM 0 HG1 THR A 109 1.861 15.599 -2.879 1.00 74.40 H new ATOM 0 HG21 THR A 109 -1.580 15.756 -2.793 1.00 5.13 H new ATOM 0 HG22 THR A 109 -1.864 14.129 -2.129 1.00 5.13 H new ATOM 0 HG23 THR A 109 -1.202 15.413 -1.088 1.00 5.13 H new ATOM 1656 N VAL A 110 0.170 11.253 -0.881 1.00 62.30 N ATOM 1657 CA VAL A 110 -0.199 9.861 -1.088 1.00 71.40 C ATOM 1658 C VAL A 110 -1.684 9.880 -1.426 1.00 15.55 C ATOM 1659 O VAL A 110 -2.476 10.423 -0.651 1.00 22.03 O ATOM 1660 CB VAL A 110 0.140 9.022 0.161 1.00 61.11 C ATOM 1661 CG1 VAL A 110 -0.243 7.548 -0.036 1.00 52.23 C ATOM 1662 CG2 VAL A 110 1.644 9.099 0.486 1.00 3.23 C ATOM 0 H VAL A 110 0.190 11.538 0.098 1.00 62.30 H new ATOM 0 HA VAL A 110 0.357 9.389 -1.898 1.00 71.40 H new ATOM 0 HB VAL A 110 -0.436 9.438 0.987 1.00 61.11 H new ATOM 0 HG11 VAL A 110 0.009 6.984 0.862 1.00 52.23 H new ATOM 0 HG12 VAL A 110 -1.314 7.472 -0.224 1.00 52.23 H new ATOM 0 HG13 VAL A 110 0.304 7.140 -0.886 1.00 52.23 H new ATOM 0 HG21 VAL A 110 1.856 8.499 1.371 1.00 3.23 H new ATOM 0 HG22 VAL A 110 2.219 8.717 -0.358 1.00 3.23 H new ATOM 0 HG23 VAL A 110 1.923 10.136 0.675 1.00 3.23 H new ATOM 1672 N THR A 111 -2.058 9.268 -2.545 1.00 42.20 N ATOM 1673 CA THR A 111 -3.428 9.168 -3.018 1.00 54.20 C ATOM 1674 C THR A 111 -3.808 7.687 -3.149 1.00 4.25 C ATOM 1675 O THR A 111 -2.977 6.829 -3.451 1.00 73.01 O ATOM 1676 CB THR A 111 -3.561 9.963 -4.329 1.00 63.00 C ATOM 1677 OG1 THR A 111 -3.252 11.322 -4.079 1.00 64.14 O ATOM 1678 CG2 THR A 111 -4.962 9.917 -4.950 1.00 62.43 C ATOM 0 H THR A 111 -1.390 8.813 -3.167 1.00 42.20 H new ATOM 0 HA THR A 111 -4.132 9.607 -2.311 1.00 54.20 H new ATOM 0 HB THR A 111 -2.873 9.496 -5.033 1.00 63.00 H new ATOM 0 HG1 THR A 111 -3.333 11.834 -4.911 1.00 64.14 H new ATOM 0 HG21 THR A 111 -4.972 10.501 -5.870 1.00 62.43 H new ATOM 0 HG22 THR A 111 -5.227 8.884 -5.174 1.00 62.43 H new ATOM 0 HG23 THR A 111 -5.685 10.333 -4.248 1.00 62.43 H new ATOM 1686 N ILE A 112 -5.070 7.368 -2.874 1.00 34.42 N ATOM 1687 CA ILE A 112 -5.642 6.023 -2.917 1.00 40.14 C ATOM 1688 C ILE A 112 -6.833 6.151 -3.844 1.00 14.13 C ATOM 1689 O ILE A 112 -7.713 6.966 -3.562 1.00 32.33 O ATOM 1690 CB ILE A 112 -6.097 5.551 -1.518 1.00 13.23 C ATOM 1691 CG1 ILE A 112 -5.149 6.070 -0.421 1.00 40.54 C ATOM 1692 CG2 ILE A 112 -6.266 4.024 -1.472 1.00 41.43 C ATOM 1693 CD1 ILE A 112 -5.446 5.538 0.977 1.00 61.30 C ATOM 0 H ILE A 112 -5.755 8.073 -2.602 1.00 34.42 H new ATOM 0 HA ILE A 112 -4.915 5.286 -3.258 1.00 40.14 H new ATOM 0 HB ILE A 112 -7.078 5.981 -1.318 1.00 13.23 H new ATOM 0 HG12 ILE A 112 -4.126 5.804 -0.687 1.00 40.54 H new ATOM 0 HG13 ILE A 112 -5.200 7.159 -0.400 1.00 40.54 H new ATOM 0 HG21 ILE A 112 -6.587 3.723 -0.475 1.00 41.43 H new ATOM 0 HG22 ILE A 112 -7.016 3.719 -2.202 1.00 41.43 H new ATOM 0 HG23 ILE A 112 -5.315 3.545 -1.707 1.00 41.43 H new ATOM 0 HD11 ILE A 112 -4.730 5.956 1.685 1.00 61.30 H new ATOM 0 HD12 ILE A 112 -6.456 5.827 1.269 1.00 61.30 H new ATOM 0 HD13 ILE A 112 -5.365 4.451 0.977 1.00 61.30 H new ATOM 1705 N HIS A 113 -6.827 5.432 -4.958 1.00 63.34 N ATOM 1706 CA HIS A 113 -7.944 5.421 -5.880 1.00 1.42 C ATOM 1707 C HIS A 113 -8.831 4.252 -5.506 1.00 72.33 C ATOM 1708 O HIS A 113 -8.362 3.118 -5.414 1.00 35.25 O ATOM 1709 CB HIS A 113 -7.442 5.300 -7.320 1.00 62.14 C ATOM 1710 CG HIS A 113 -7.022 6.620 -7.912 1.00 10.53 C ATOM 1711 ND1 HIS A 113 -7.831 7.397 -8.693 1.00 32.25 N flip ATOM 1712 CD2 HIS A 113 -5.867 7.337 -7.653 1.00 51.12 C flip ATOM 1713 CE1 HIS A 113 -7.208 8.635 -8.843 1.00 51.41 C flip ATOM 1714 NE2 HIS A 113 -6.020 8.550 -8.214 1.00 5.32 N flip ATOM 0 H HIS A 113 -6.046 4.842 -5.244 1.00 63.34 H new ATOM 0 HA HIS A 113 -8.510 6.350 -5.816 1.00 1.42 H new ATOM 0 HB2 HIS A 113 -6.598 4.611 -7.347 1.00 62.14 H new ATOM 0 HB3 HIS A 113 -8.228 4.865 -7.937 1.00 62.14 H new ATOM 0 HD2 HIS A 113 -5.005 6.988 -7.104 1.00 51.12 H new ATOM 0 HE1 HIS A 113 -7.602 9.496 -9.363 1.00 51.41 H new ATOM 0 HE2 HIS A 113 -5.332 9.301 -8.169 1.00 5.32 H new ATOM 1722 N CYS A 114 -10.125 4.495 -5.346 1.00 33.25 N ATOM 1723 CA CYS A 114 -11.114 3.414 -5.339 1.00 35.23 C ATOM 1724 C CYS A 114 -11.548 3.141 -6.780 1.00 23.04 C ATOM 1725 O CYS A 114 -11.472 4.024 -7.634 1.00 61.32 O ATOM 1726 CB CYS A 114 -12.274 3.776 -4.390 1.00 73.41 C ATOM 1727 SG CYS A 114 -13.449 2.409 -4.179 1.00 34.24 S ATOM 0 H CYS A 114 -10.518 5.428 -5.219 1.00 33.25 H new ATOM 0 HA CYS A 114 -10.692 2.486 -4.952 1.00 35.23 H new ATOM 0 HB2 CYS A 114 -11.870 4.057 -3.418 1.00 73.41 H new ATOM 0 HB3 CYS A 114 -12.801 4.647 -4.780 1.00 73.41 H new ATOM 0 HG CYS A 114 -12.907 1.303 -4.594 1.00 34.24 H new ATOM 1733 N ASN A 115 -11.931 1.903 -7.097 1.00 72.01 N ATOM 1734 CA ASN A 115 -12.361 1.448 -8.418 1.00 24.11 C ATOM 1735 C ASN A 115 -13.548 0.510 -8.180 1.00 64.14 C ATOM 1736 O ASN A 115 -13.353 -0.692 -7.969 1.00 60.11 O ATOM 1737 CB ASN A 115 -11.255 0.664 -9.164 1.00 53.31 C ATOM 1738 CG ASN A 115 -10.039 1.382 -9.734 1.00 3.21 C ATOM 1739 OD1 ASN A 115 -9.546 2.453 -9.138 1.00 11.44 O flip ATOM 1740 ND2 ASN A 115 -9.445 0.898 -10.693 1.00 51.32 N flip ATOM 0 H ASN A 115 -11.950 1.154 -6.404 1.00 72.01 H new ATOM 0 HA ASN A 115 -12.611 2.311 -9.035 1.00 24.11 H new ATOM 0 HB2 ASN A 115 -10.885 -0.098 -8.478 1.00 53.31 H new ATOM 0 HB3 ASN A 115 -11.735 0.142 -9.991 1.00 53.31 H new ATOM 0 HD21 ASN A 115 -9.818 0.071 -11.160 1.00 51.32 H new ATOM 0 HD22 ASN A 115 -8.578 1.323 -11.023 1.00 51.32 H new ATOM 1747 N ASP A 116 -14.764 1.047 -8.128 1.00 14.11 N ATOM 1748 CA ASP A 116 -15.930 0.311 -7.648 1.00 1.10 C ATOM 1749 C ASP A 116 -16.502 -0.618 -8.708 1.00 73.22 C ATOM 1750 O ASP A 116 -16.107 -0.553 -9.876 1.00 22.24 O ATOM 1751 CB ASP A 116 -16.987 1.300 -7.180 1.00 23.02 C ATOM 1752 CG ASP A 116 -17.720 0.792 -5.950 1.00 15.34 C ATOM 1753 OD1 ASP A 116 -18.701 0.044 -6.098 1.00 74.41 O ATOM 1754 OD2 ASP A 116 -17.316 1.162 -4.825 1.00 4.44 O ATOM 0 H ASP A 116 -14.969 2.004 -8.417 1.00 14.11 H new ATOM 0 HA ASP A 116 -15.615 -0.319 -6.816 1.00 1.10 H new ATOM 0 HB2 ASP A 116 -16.517 2.257 -6.955 1.00 23.02 H new ATOM 0 HB3 ASP A 116 -17.702 1.477 -7.983 1.00 23.02 H new ATOM 1759 N LYS A 117 -17.464 -1.463 -8.331 1.00 24.43 N ATOM 1760 CA LYS A 117 -18.296 -2.219 -9.269 1.00 41.54 C ATOM 1761 C LYS A 117 -19.726 -2.426 -8.749 1.00 4.41 C ATOM 1762 O LYS A 117 -20.437 -3.312 -9.227 1.00 31.24 O ATOM 1763 CB LYS A 117 -17.619 -3.540 -9.689 1.00 43.51 C ATOM 1764 CG LYS A 117 -17.808 -3.819 -11.193 1.00 0.31 C ATOM 1765 CD LYS A 117 -16.951 -2.928 -12.106 1.00 22.24 C ATOM 1766 CE LYS A 117 -15.463 -3.281 -11.976 1.00 11.54 C ATOM 1767 NZ LYS A 117 -14.646 -2.101 -11.640 1.00 75.02 N ATOM 0 H LYS A 117 -17.690 -1.644 -7.353 1.00 24.43 H new ATOM 0 HA LYS A 117 -18.393 -1.614 -10.170 1.00 41.54 H new ATOM 0 HB2 LYS A 117 -16.555 -3.494 -9.457 1.00 43.51 H new ATOM 0 HB3 LYS A 117 -18.036 -4.364 -9.110 1.00 43.51 H new ATOM 0 HG2 LYS A 117 -17.567 -4.863 -11.391 1.00 0.31 H new ATOM 0 HG3 LYS A 117 -18.858 -3.680 -11.449 1.00 0.31 H new ATOM 0 HD2 LYS A 117 -17.269 -3.050 -13.142 1.00 22.24 H new ATOM 0 HD3 LYS A 117 -17.104 -1.881 -11.847 1.00 22.24 H new ATOM 0 HE2 LYS A 117 -15.336 -4.042 -11.206 1.00 11.54 H new ATOM 0 HE3 LYS A 117 -15.109 -3.713 -12.912 1.00 11.54 H new ATOM 0 HZ1 LYS A 117 -13.682 -2.405 -11.395 1.00 75.02 H new ATOM 0 HZ2 LYS A 117 -14.610 -1.459 -12.458 1.00 75.02 H new ATOM 0 HZ3 LYS A 117 -15.069 -1.605 -10.829 1.00 75.02 H new ATOM 1781 N SER A 118 -20.154 -1.649 -7.753 1.00 13.21 N ATOM 1782 CA SER A 118 -21.552 -1.563 -7.379 1.00 0.13 C ATOM 1783 C SER A 118 -22.241 -0.655 -8.399 1.00 52.23 C ATOM 1784 O SER A 118 -23.007 -1.158 -9.216 1.00 51.44 O ATOM 1785 CB SER A 118 -21.677 -1.084 -5.927 1.00 21.42 C ATOM 1786 OG SER A 118 -22.891 -1.526 -5.348 1.00 51.15 O ATOM 0 H SER A 118 -19.537 -1.066 -7.188 1.00 13.21 H new ATOM 0 HA SER A 118 -22.048 -2.533 -7.404 1.00 0.13 H new ATOM 0 HB2 SER A 118 -20.835 -1.457 -5.344 1.00 21.42 H new ATOM 0 HB3 SER A 118 -21.630 0.004 -5.894 1.00 21.42 H new ATOM 0 HG SER A 118 -22.946 -1.209 -4.422 1.00 51.15 H new ATOM 1792 N ASP A 119 -21.978 0.659 -8.376 1.00 11.42 N ATOM 1793 CA ASP A 119 -22.734 1.643 -9.166 1.00 72.35 C ATOM 1794 C ASP A 119 -21.829 2.521 -10.018 1.00 1.11 C ATOM 1795 O ASP A 119 -22.070 3.710 -10.215 1.00 12.34 O ATOM 1796 CB ASP A 119 -23.708 2.433 -8.279 1.00 41.15 C ATOM 1797 CG ASP A 119 -25.113 2.257 -8.831 1.00 21.41 C ATOM 1798 OD1 ASP A 119 -25.687 1.178 -8.568 1.00 4.13 O ATOM 1799 OD2 ASP A 119 -25.609 3.136 -9.570 1.00 44.44 O ATOM 0 H ASP A 119 -21.236 1.070 -7.810 1.00 11.42 H new ATOM 0 HA ASP A 119 -23.347 1.097 -9.883 1.00 72.35 H new ATOM 0 HB2 ASP A 119 -23.658 2.077 -7.250 1.00 41.15 H new ATOM 0 HB3 ASP A 119 -23.436 3.488 -8.264 1.00 41.15 H new ATOM 1804 N ASN A 120 -20.759 1.917 -10.528 1.00 22.12 N ATOM 1805 CA ASN A 120 -19.900 2.450 -11.569 1.00 64.32 C ATOM 1806 C ASN A 120 -19.220 3.712 -11.042 1.00 61.44 C ATOM 1807 O ASN A 120 -19.175 4.737 -11.728 1.00 45.11 O ATOM 1808 CB ASN A 120 -20.679 2.680 -12.882 1.00 13.23 C ATOM 1809 CG ASN A 120 -21.469 1.483 -13.402 1.00 3.22 C ATOM 1810 OD1 ASN A 120 -22.355 0.962 -12.736 1.00 54.32 O ATOM 1811 ND2 ASN A 120 -21.195 1.014 -14.609 1.00 10.50 N ATOM 0 H ASN A 120 -20.457 0.997 -10.207 1.00 22.12 H new ATOM 0 HA ASN A 120 -19.125 1.726 -11.821 1.00 64.32 H new ATOM 0 HB2 ASN A 120 -21.369 3.510 -12.732 1.00 13.23 H new ATOM 0 HB3 ASN A 120 -19.972 2.988 -13.653 1.00 13.23 H new ATOM 0 HD21 ASN A 120 -21.721 0.223 -14.980 1.00 10.50 H new ATOM 0 HD22 ASN A 120 -20.458 1.444 -15.168 1.00 10.50 H new ATOM 1818 N THR A 121 -18.709 3.643 -9.810 1.00 64.45 N ATOM 1819 CA THR A 121 -18.143 4.769 -9.098 1.00 62.21 C ATOM 1820 C THR A 121 -16.620 4.640 -9.095 1.00 73.21 C ATOM 1821 O THR A 121 -16.053 3.544 -9.091 1.00 33.32 O ATOM 1822 CB THR A 121 -18.795 4.896 -7.698 1.00 45.54 C ATOM 1823 OG1 THR A 121 -18.742 3.728 -6.903 1.00 53.35 O ATOM 1824 CG2 THR A 121 -20.292 5.146 -7.832 1.00 73.13 C ATOM 0 H THR A 121 -18.681 2.775 -9.275 1.00 64.45 H new ATOM 0 HA THR A 121 -18.366 5.712 -9.598 1.00 62.21 H new ATOM 0 HB THR A 121 -18.227 5.702 -7.233 1.00 45.54 H new ATOM 0 HG1 THR A 121 -19.174 3.900 -6.040 1.00 53.35 H new ATOM 0 HG21 THR A 121 -20.737 5.233 -6.841 1.00 73.13 H new ATOM 0 HG22 THR A 121 -20.458 6.069 -8.387 1.00 73.13 H new ATOM 0 HG23 THR A 121 -20.753 4.315 -8.365 1.00 73.13 H new ATOM 1832 N LYS A 122 -15.952 5.784 -9.101 1.00 33.42 N ATOM 1833 CA LYS A 122 -14.516 5.956 -8.961 1.00 5.31 C ATOM 1834 C LYS A 122 -14.321 7.272 -8.234 1.00 32.11 C ATOM 1835 O LYS A 122 -14.642 8.347 -8.750 1.00 23.24 O ATOM 1836 CB LYS A 122 -13.808 5.972 -10.321 1.00 64.42 C ATOM 1837 CG LYS A 122 -13.272 4.581 -10.674 1.00 13.42 C ATOM 1838 CD LYS A 122 -12.585 4.542 -12.035 1.00 14.44 C ATOM 1839 CE LYS A 122 -13.605 4.811 -13.142 1.00 63.23 C ATOM 1840 NZ LYS A 122 -13.141 4.309 -14.444 1.00 54.44 N ATOM 0 H LYS A 122 -16.433 6.677 -9.211 1.00 33.42 H new ATOM 0 HA LYS A 122 -14.080 5.123 -8.409 1.00 5.31 H new ATOM 0 HB2 LYS A 122 -14.502 6.306 -11.093 1.00 64.42 H new ATOM 0 HB3 LYS A 122 -12.987 6.688 -10.300 1.00 64.42 H new ATOM 0 HG2 LYS A 122 -12.567 4.263 -9.906 1.00 13.42 H new ATOM 0 HG3 LYS A 122 -14.095 3.866 -10.667 1.00 13.42 H new ATOM 0 HD2 LYS A 122 -11.790 5.287 -12.072 1.00 14.44 H new ATOM 0 HD3 LYS A 122 -12.117 3.569 -12.188 1.00 14.44 H new ATOM 0 HE2 LYS A 122 -14.553 4.337 -12.886 1.00 63.23 H new ATOM 0 HE3 LYS A 122 -13.793 5.882 -13.211 1.00 63.23 H new ATOM 0 HZ1 LYS A 122 -13.859 4.510 -15.169 1.00 54.44 H new ATOM 0 HZ2 LYS A 122 -12.249 4.779 -14.700 1.00 54.44 H new ATOM 0 HZ3 LYS A 122 -12.986 3.282 -14.385 1.00 54.44 H new ATOM 1854 N SER A 123 -13.836 7.169 -7.012 1.00 51.42 N ATOM 1855 CA SER A 123 -13.458 8.293 -6.172 1.00 34.05 C ATOM 1856 C SER A 123 -12.185 7.884 -5.435 1.00 54.51 C ATOM 1857 O SER A 123 -11.776 6.728 -5.532 1.00 22.42 O ATOM 1858 CB SER A 123 -14.611 8.653 -5.230 1.00 45.24 C ATOM 1859 OG SER A 123 -15.711 9.177 -5.949 1.00 30.41 O ATOM 0 H SER A 123 -13.688 6.267 -6.558 1.00 51.42 H new ATOM 0 HA SER A 123 -13.258 9.194 -6.752 1.00 34.05 H new ATOM 0 HB2 SER A 123 -14.923 7.767 -4.677 1.00 45.24 H new ATOM 0 HB3 SER A 123 -14.271 9.384 -4.496 1.00 45.24 H new ATOM 0 HG SER A 123 -16.434 9.397 -5.326 1.00 30.41 H new ATOM 1865 N SER A 124 -11.527 8.815 -4.753 1.00 14.52 N ATOM 1866 CA SER A 124 -10.193 8.592 -4.211 1.00 52.50 C ATOM 1867 C SER A 124 -10.051 9.356 -2.892 1.00 71.23 C ATOM 1868 O SER A 124 -10.955 10.116 -2.529 1.00 24.04 O ATOM 1869 CB SER A 124 -9.176 9.082 -5.252 1.00 65.31 C ATOM 1870 OG SER A 124 -9.383 8.544 -6.544 1.00 30.11 O ATOM 0 H SER A 124 -11.903 9.744 -4.561 1.00 14.52 H new ATOM 0 HA SER A 124 -10.018 7.536 -4.006 1.00 52.50 H new ATOM 0 HB2 SER A 124 -9.222 10.170 -5.309 1.00 65.31 H new ATOM 0 HB3 SER A 124 -8.172 8.823 -4.916 1.00 65.31 H new ATOM 0 HG SER A 124 -9.262 9.248 -7.215 1.00 30.11 H new ATOM 1876 N VAL A 125 -8.935 9.208 -2.176 1.00 35.32 N ATOM 1877 CA VAL A 125 -8.613 10.076 -1.049 1.00 60.44 C ATOM 1878 C VAL A 125 -7.155 10.522 -1.161 1.00 62.12 C ATOM 1879 O VAL A 125 -6.348 9.792 -1.742 1.00 53.42 O ATOM 1880 CB VAL A 125 -8.947 9.380 0.286 1.00 20.43 C ATOM 1881 CG1 VAL A 125 -10.423 8.977 0.396 1.00 20.31 C ATOM 1882 CG2 VAL A 125 -8.096 8.139 0.576 1.00 43.43 C ATOM 0 H VAL A 125 -8.236 8.488 -2.361 1.00 35.32 H new ATOM 0 HA VAL A 125 -9.228 10.975 -1.072 1.00 60.44 H new ATOM 0 HB VAL A 125 -8.713 10.143 1.029 1.00 20.43 H new ATOM 0 HG11 VAL A 125 -10.597 8.492 1.356 1.00 20.31 H new ATOM 0 HG12 VAL A 125 -11.049 9.866 0.319 1.00 20.31 H new ATOM 0 HG13 VAL A 125 -10.673 8.287 -0.410 1.00 20.31 H new ATOM 0 HG21 VAL A 125 -8.394 7.709 1.532 1.00 43.43 H new ATOM 0 HG22 VAL A 125 -8.244 7.403 -0.214 1.00 43.43 H new ATOM 0 HG23 VAL A 125 -7.044 8.421 0.616 1.00 43.43 H new ATOM 1892 N SER A 126 -6.821 11.707 -0.638 1.00 53.24 N ATOM 1893 CA SER A 126 -5.513 12.328 -0.762 1.00 34.01 C ATOM 1894 C SER A 126 -5.292 13.320 0.383 1.00 0.35 C ATOM 1895 O SER A 126 -6.220 14.012 0.808 1.00 44.21 O ATOM 1896 CB SER A 126 -5.395 13.002 -2.140 1.00 11.41 C ATOM 1897 OG SER A 126 -6.530 13.795 -2.491 1.00 24.32 O ATOM 0 H SER A 126 -7.480 12.272 -0.101 1.00 53.24 H new ATOM 0 HA SER A 126 -4.732 11.571 -0.690 1.00 34.01 H new ATOM 0 HB2 SER A 126 -4.505 13.632 -2.151 1.00 11.41 H new ATOM 0 HB3 SER A 126 -5.251 12.233 -2.899 1.00 11.41 H new ATOM 0 HG SER A 126 -7.175 13.788 -1.753 1.00 24.32 H new ATOM 1903 N GLY A 127 -4.055 13.424 0.856 1.00 1.54 N ATOM 1904 CA GLY A 127 -3.604 14.360 1.879 1.00 21.35 C ATOM 1905 C GLY A 127 -2.084 14.444 1.786 1.00 1.45 C ATOM 1906 O GLY A 127 -1.497 13.790 0.920 1.00 53.10 O ATOM 0 H GLY A 127 -3.301 12.826 0.518 1.00 1.54 H new ATOM 0 HA2 GLY A 127 -4.052 15.342 1.725 1.00 21.35 H new ATOM 0 HA3 GLY A 127 -3.909 14.022 2.869 1.00 21.35 H new ATOM 1910 N LYS A 128 -1.431 15.210 2.662 1.00 72.13 N ATOM 1911 CA LYS A 128 0.023 15.362 2.656 1.00 20.11 C ATOM 1912 C LYS A 128 0.621 14.807 3.936 1.00 60.53 C ATOM 1913 O LYS A 128 -0.022 14.849 4.978 1.00 14.02 O ATOM 1914 CB LYS A 128 0.420 16.835 2.497 1.00 71.34 C ATOM 1915 CG LYS A 128 0.517 17.287 1.035 1.00 73.34 C ATOM 1916 CD LYS A 128 -0.797 17.827 0.465 1.00 12.35 C ATOM 1917 CE LYS A 128 -0.553 18.423 -0.927 1.00 12.12 C ATOM 1918 NZ LYS A 128 0.268 19.653 -0.871 1.00 71.11 N ATOM 0 H LYS A 128 -1.897 15.743 3.396 1.00 72.13 H new ATOM 0 HA LYS A 128 0.413 14.801 1.807 1.00 20.11 H new ATOM 0 HB2 LYS A 128 -0.310 17.458 3.014 1.00 71.34 H new ATOM 0 HB3 LYS A 128 1.381 16.999 2.984 1.00 71.34 H new ATOM 0 HG2 LYS A 128 1.282 18.059 0.954 1.00 73.34 H new ATOM 0 HG3 LYS A 128 0.848 16.446 0.426 1.00 73.34 H new ATOM 0 HD2 LYS A 128 -1.534 17.026 0.404 1.00 12.35 H new ATOM 0 HD3 LYS A 128 -1.207 18.587 1.130 1.00 12.35 H new ATOM 0 HE2 LYS A 128 -0.055 17.684 -1.555 1.00 12.12 H new ATOM 0 HE3 LYS A 128 -1.510 18.648 -1.397 1.00 12.12 H new ATOM 0 HZ1 LYS A 128 0.145 20.193 -1.752 1.00 71.11 H new ATOM 0 HZ2 LYS A 128 -0.033 20.235 -0.064 1.00 71.11 H new ATOM 0 HZ3 LYS A 128 1.270 19.397 -0.758 1.00 71.11 H new ATOM 1932 N VAL A 129 1.879 14.366 3.868 1.00 15.15 N ATOM 1933 CA VAL A 129 2.639 13.904 5.023 1.00 21.43 C ATOM 1934 C VAL A 129 2.679 15.032 6.046 1.00 31.55 C ATOM 1935 O VAL A 129 3.272 16.083 5.792 1.00 63.23 O ATOM 1936 CB VAL A 129 4.020 13.380 4.590 1.00 54.04 C ATOM 1937 CG1 VAL A 129 4.901 12.907 5.757 1.00 74.50 C ATOM 1938 CG2 VAL A 129 3.842 12.200 3.625 1.00 60.50 C ATOM 0 H VAL A 129 2.403 14.321 2.994 1.00 15.15 H new ATOM 0 HA VAL A 129 2.160 13.050 5.502 1.00 21.43 H new ATOM 0 HB VAL A 129 4.524 14.223 4.118 1.00 54.04 H new ATOM 0 HG11 VAL A 129 5.857 12.553 5.371 1.00 74.50 H new ATOM 0 HG12 VAL A 129 5.072 13.736 6.443 1.00 74.50 H new ATOM 0 HG13 VAL A 129 4.400 12.096 6.286 1.00 74.50 H new ATOM 0 HG21 VAL A 129 4.820 11.830 3.319 1.00 60.50 H new ATOM 0 HG22 VAL A 129 3.292 11.402 4.124 1.00 60.50 H new ATOM 0 HG23 VAL A 129 3.287 12.529 2.746 1.00 60.50 H new ATOM 1948 N GLY A 130 1.985 14.812 7.162 1.00 4.12 N ATOM 1949 CA GLY A 130 1.892 15.704 8.299 1.00 51.10 C ATOM 1950 C GLY A 130 0.455 16.140 8.550 1.00 24.13 C ATOM 1951 O GLY A 130 0.048 16.218 9.708 1.00 3.03 O ATOM 0 H GLY A 130 1.445 13.957 7.297 1.00 4.12 H new ATOM 0 HA2 GLY A 130 2.282 15.206 9.186 1.00 51.10 H new ATOM 0 HA3 GLY A 130 2.515 16.582 8.126 1.00 51.10 H new ATOM 1955 N ALA A 131 -0.333 16.351 7.495 1.00 33.44 N ATOM 1956 CA ALA A 131 -1.593 17.079 7.554 1.00 22.53 C ATOM 1957 C ALA A 131 -2.766 16.204 7.119 1.00 20.13 C ATOM 1958 O ALA A 131 -2.586 15.106 6.593 1.00 22.53 O ATOM 1959 CB ALA A 131 -1.470 18.314 6.660 1.00 34.24 C ATOM 0 H ALA A 131 -0.106 16.013 6.560 1.00 33.44 H new ATOM 0 HA ALA A 131 -1.793 17.379 8.583 1.00 22.53 H new ATOM 0 HB1 ALA A 131 -2.403 18.877 6.687 1.00 34.24 H new ATOM 0 HB2 ALA A 131 -0.656 18.943 7.019 1.00 34.24 H new ATOM 0 HB3 ALA A 131 -1.264 18.003 5.636 1.00 34.24 H new ATOM 1965 N ASP A 132 -3.982 16.703 7.332 1.00 40.23 N ATOM 1966 CA ASP A 132 -5.195 15.949 7.052 1.00 34.15 C ATOM 1967 C ASP A 132 -5.506 15.938 5.551 1.00 43.34 C ATOM 1968 O ASP A 132 -4.897 16.629 4.721 1.00 24.35 O ATOM 1969 CB ASP A 132 -6.376 16.554 7.840 1.00 73.51 C ATOM 1970 CG ASP A 132 -7.522 15.577 8.135 1.00 44.31 C ATOM 1971 OD1 ASP A 132 -7.495 14.423 7.663 1.00 61.50 O ATOM 1972 OD2 ASP A 132 -8.456 15.977 8.865 1.00 44.43 O ATOM 0 H ASP A 132 -4.150 17.638 7.702 1.00 40.23 H new ATOM 0 HA ASP A 132 -5.041 14.917 7.368 1.00 34.15 H new ATOM 0 HB2 ASP A 132 -6.000 16.947 8.785 1.00 73.51 H new ATOM 0 HB3 ASP A 132 -6.774 17.399 7.279 1.00 73.51 H new ATOM 1977 N LEU A 133 -6.533 15.173 5.224 1.00 63.22 N ATOM 1978 CA LEU A 133 -7.212 15.072 3.954 1.00 11.41 C ATOM 1979 C LEU A 133 -8.085 16.304 3.775 1.00 13.45 C ATOM 1980 O LEU A 133 -9.209 16.367 4.283 1.00 43.13 O ATOM 1981 CB LEU A 133 -8.057 13.800 3.941 1.00 2.25 C ATOM 1982 CG LEU A 133 -7.146 12.557 3.872 1.00 21.13 C ATOM 1983 CD1 LEU A 133 -7.239 11.761 5.163 1.00 21.54 C ATOM 1984 CD2 LEU A 133 -7.583 11.650 2.739 1.00 40.54 C ATOM 0 H LEU A 133 -6.949 14.547 5.913 1.00 63.22 H new ATOM 0 HA LEU A 133 -6.496 15.021 3.133 1.00 11.41 H new ATOM 0 HB2 LEU A 133 -8.676 13.757 4.837 1.00 2.25 H new ATOM 0 HB3 LEU A 133 -8.733 13.812 3.086 1.00 2.25 H new ATOM 0 HG LEU A 133 -6.124 12.901 3.712 1.00 21.13 H new ATOM 0 HD11 LEU A 133 -6.591 10.887 5.099 1.00 21.54 H new ATOM 0 HD12 LEU A 133 -6.925 12.386 5.999 1.00 21.54 H new ATOM 0 HD13 LEU A 133 -8.269 11.438 5.318 1.00 21.54 H new ATOM 0 HD21 LEU A 133 -6.932 10.776 2.701 1.00 40.54 H new ATOM 0 HD22 LEU A 133 -8.611 11.329 2.906 1.00 40.54 H new ATOM 0 HD23 LEU A 133 -7.520 12.191 1.795 1.00 40.54 H new ATOM 1996 N THR A 134 -7.579 17.281 3.031 1.00 64.34 N ATOM 1997 CA THR A 134 -8.393 18.324 2.417 1.00 73.00 C ATOM 1998 C THR A 134 -9.265 17.740 1.290 1.00 52.54 C ATOM 1999 O THR A 134 -10.266 18.356 0.917 1.00 4.54 O ATOM 2000 CB THR A 134 -7.471 19.477 1.975 1.00 13.15 C ATOM 2001 OG1 THR A 134 -8.146 20.578 1.391 1.00 62.20 O ATOM 2002 CG2 THR A 134 -6.382 19.041 0.995 1.00 45.52 C ATOM 0 H THR A 134 -6.582 17.372 2.835 1.00 64.34 H new ATOM 0 HA THR A 134 -9.101 18.739 3.134 1.00 73.00 H new ATOM 0 HB THR A 134 -7.025 19.793 2.918 1.00 13.15 H new ATOM 0 HG1 THR A 134 -7.494 21.265 1.140 1.00 62.20 H new ATOM 0 HG21 THR A 134 -5.769 19.901 0.725 1.00 45.52 H new ATOM 0 HG22 THR A 134 -5.755 18.281 1.462 1.00 45.52 H new ATOM 0 HG23 THR A 134 -6.844 18.629 0.098 1.00 45.52 H new ATOM 2010 N SER A 135 -8.938 16.555 0.765 1.00 33.43 N ATOM 2011 CA SER A 135 -9.525 16.014 -0.449 1.00 54.40 C ATOM 2012 C SER A 135 -9.676 14.501 -0.298 1.00 14.53 C ATOM 2013 O SER A 135 -8.776 13.735 -0.645 1.00 53.20 O ATOM 2014 CB SER A 135 -8.666 16.438 -1.651 1.00 1.13 C ATOM 2015 OG SER A 135 -7.279 16.554 -1.370 1.00 52.40 O ATOM 0 H SER A 135 -8.243 15.938 1.186 1.00 33.43 H new ATOM 0 HA SER A 135 -10.525 16.410 -0.625 1.00 54.40 H new ATOM 0 HB2 SER A 135 -8.802 15.713 -2.453 1.00 1.13 H new ATOM 0 HB3 SER A 135 -9.030 17.396 -2.022 1.00 1.13 H new ATOM 0 HG SER A 135 -6.817 15.739 -1.659 1.00 52.40 H new ATOM 2021 N GLY A 136 -10.803 14.076 0.277 1.00 45.23 N ATOM 2022 CA GLY A 136 -11.100 12.674 0.536 1.00 34.11 C ATOM 2023 C GLY A 136 -11.399 12.391 2.004 1.00 60.14 C ATOM 2024 O GLY A 136 -11.248 11.252 2.445 1.00 31.13 O ATOM 0 H GLY A 136 -11.543 14.709 0.579 1.00 45.23 H new ATOM 0 HA2 GLY A 136 -11.955 12.372 -0.068 1.00 34.11 H new ATOM 0 HA3 GLY A 136 -10.254 12.064 0.219 1.00 34.11 H new ATOM 2028 N ASN A 137 -11.775 13.407 2.783 1.00 24.25 N ATOM 2029 CA ASN A 137 -12.229 13.228 4.163 1.00 61.41 C ATOM 2030 C ASN A 137 -13.649 12.652 4.180 1.00 63.41 C ATOM 2031 O ASN A 137 -14.246 12.458 3.120 1.00 62.34 O ATOM 2032 CB ASN A 137 -12.161 14.571 4.905 1.00 15.24 C ATOM 2033 CG ASN A 137 -11.660 14.364 6.324 1.00 31.21 C ATOM 2034 OD1 ASN A 137 -12.355 13.771 7.141 1.00 12.33 O ATOM 2035 ND2 ASN A 137 -10.450 14.811 6.611 1.00 4.35 N ATOM 0 H ASN A 137 -11.773 14.379 2.474 1.00 24.25 H new ATOM 0 HA ASN A 137 -11.577 12.520 4.674 1.00 61.41 H new ATOM 0 HB2 ASN A 137 -11.498 15.254 4.374 1.00 15.24 H new ATOM 0 HB3 ASN A 137 -13.148 15.034 4.924 1.00 15.24 H new ATOM 0 HD21 ASN A 137 -10.061 14.667 7.543 1.00 4.35 H new ATOM 0 HD22 ASN A 137 -9.905 15.300 5.901 1.00 4.35 H new ATOM 2042 N GLY A 138 -14.184 12.361 5.364 1.00 75.12 N ATOM 2043 CA GLY A 138 -15.605 12.169 5.625 1.00 72.01 C ATOM 2044 C GLY A 138 -16.356 11.309 4.607 1.00 63.22 C ATOM 2045 O GLY A 138 -17.337 11.770 4.031 1.00 61.02 O ATOM 0 H GLY A 138 -13.613 12.248 6.202 1.00 75.12 H new ATOM 0 HA2 GLY A 138 -15.717 11.715 6.610 1.00 72.01 H new ATOM 0 HA3 GLY A 138 -16.083 13.148 5.669 1.00 72.01 H new ATOM 2049 N THR A 139 -15.875 10.106 4.287 1.00 14.34 N ATOM 2050 CA THR A 139 -16.424 9.205 3.265 1.00 55.53 C ATOM 2051 C THR A 139 -16.038 7.759 3.641 1.00 4.12 C ATOM 2052 O THR A 139 -15.258 7.552 4.581 1.00 62.12 O ATOM 2053 CB THR A 139 -15.883 9.686 1.890 1.00 31.41 C ATOM 2054 OG1 THR A 139 -16.581 10.856 1.518 1.00 32.01 O ATOM 2055 CG2 THR A 139 -15.986 8.738 0.692 1.00 51.14 C ATOM 0 H THR A 139 -15.056 9.714 4.752 1.00 14.34 H new ATOM 0 HA THR A 139 -17.512 9.221 3.204 1.00 55.53 H new ATOM 0 HB THR A 139 -14.816 9.804 2.079 1.00 31.41 H new ATOM 0 HG1 THR A 139 -17.041 11.225 2.301 1.00 32.01 H new ATOM 0 HG21 THR A 139 -15.566 9.220 -0.191 1.00 51.14 H new ATOM 0 HG22 THR A 139 -15.433 7.823 0.904 1.00 51.14 H new ATOM 0 HG23 THR A 139 -17.033 8.495 0.509 1.00 51.14 H new ATOM 2063 N THR A 140 -16.572 6.752 2.946 1.00 34.21 N ATOM 2064 CA THR A 140 -16.170 5.356 3.078 1.00 42.25 C ATOM 2065 C THR A 140 -16.156 4.699 1.697 1.00 74.13 C ATOM 2066 O THR A 140 -16.819 5.184 0.777 1.00 14.13 O ATOM 2067 CB THR A 140 -17.115 4.655 4.084 1.00 2.34 C ATOM 2068 OG1 THR A 140 -16.777 3.300 4.324 1.00 53.12 O ATOM 2069 CG2 THR A 140 -18.593 4.701 3.675 1.00 63.12 C ATOM 0 H THR A 140 -17.314 6.892 2.260 1.00 34.21 H new ATOM 0 HA THR A 140 -15.158 5.270 3.474 1.00 42.25 H new ATOM 0 HB THR A 140 -16.975 5.234 4.997 1.00 2.34 H new ATOM 0 HG1 THR A 140 -17.408 2.914 4.967 1.00 53.12 H new ATOM 0 HG21 THR A 140 -19.195 4.190 4.427 1.00 63.12 H new ATOM 0 HG22 THR A 140 -18.916 5.739 3.595 1.00 63.12 H new ATOM 0 HG23 THR A 140 -18.720 4.206 2.712 1.00 63.12 H new ATOM 2077 N PHE A 141 -15.436 3.582 1.579 1.00 14.51 N ATOM 2078 CA PHE A 141 -15.373 2.705 0.412 1.00 11.53 C ATOM 2079 C PHE A 141 -15.302 1.242 0.885 1.00 43.34 C ATOM 2080 O PHE A 141 -15.235 0.977 2.092 1.00 44.21 O ATOM 2081 CB PHE A 141 -14.146 3.053 -0.453 1.00 1.11 C ATOM 2082 CG PHE A 141 -14.081 4.432 -1.091 1.00 13.51 C ATOM 2083 CD1 PHE A 141 -15.205 5.021 -1.704 1.00 60.24 C ATOM 2084 CD2 PHE A 141 -12.852 5.115 -1.113 1.00 1.45 C ATOM 2085 CE1 PHE A 141 -15.116 6.315 -2.246 1.00 52.11 C ATOM 2086 CE2 PHE A 141 -12.752 6.389 -1.691 1.00 1.54 C ATOM 2087 CZ PHE A 141 -13.892 7.005 -2.227 1.00 1.41 C ATOM 0 H PHE A 141 -14.847 3.247 2.341 1.00 14.51 H new ATOM 0 HA PHE A 141 -16.266 2.844 -0.197 1.00 11.53 H new ATOM 0 HB2 PHE A 141 -13.257 2.931 0.166 1.00 1.11 H new ATOM 0 HB3 PHE A 141 -14.082 2.314 -1.252 1.00 1.11 H new ATOM 0 HD1 PHE A 141 -16.137 4.477 -1.757 1.00 60.24 H new ATOM 0 HD2 PHE A 141 -11.976 4.654 -0.680 1.00 1.45 H new ATOM 0 HE1 PHE A 141 -15.990 6.780 -2.678 1.00 52.11 H new ATOM 0 HE2 PHE A 141 -11.798 6.895 -1.723 1.00 1.54 H new ATOM 0 HZ PHE A 141 -13.829 8.007 -2.624 1.00 1.41 H new ATOM 2097 N LYS A 142 -15.284 0.278 -0.045 1.00 44.32 N ATOM 2098 CA LYS A 142 -15.283 -1.151 0.286 1.00 40.12 C ATOM 2099 C LYS A 142 -13.971 -1.819 -0.076 1.00 3.53 C ATOM 2100 O LYS A 142 -13.392 -1.551 -1.129 1.00 42.52 O ATOM 2101 CB LYS A 142 -16.414 -1.900 -0.442 1.00 44.11 C ATOM 2102 CG LYS A 142 -17.747 -1.144 -0.466 1.00 63.43 C ATOM 2103 CD LYS A 142 -18.954 -2.085 -0.506 1.00 63.02 C ATOM 2104 CE LYS A 142 -20.240 -1.274 -0.663 1.00 20.01 C ATOM 2105 NZ LYS A 142 -20.511 -0.379 0.484 1.00 43.44 N ATOM 0 H LYS A 142 -15.270 0.468 -1.047 1.00 44.32 H new ATOM 0 HA LYS A 142 -15.433 -1.205 1.364 1.00 40.12 H new ATOM 0 HB2 LYS A 142 -16.103 -2.100 -1.467 1.00 44.11 H new ATOM 0 HB3 LYS A 142 -16.565 -2.866 0.039 1.00 44.11 H new ATOM 0 HG2 LYS A 142 -17.816 -0.507 0.416 1.00 63.43 H new ATOM 0 HG3 LYS A 142 -17.773 -0.488 -1.336 1.00 63.43 H new ATOM 0 HD2 LYS A 142 -18.852 -2.786 -1.334 1.00 63.02 H new ATOM 0 HD3 LYS A 142 -18.996 -2.676 0.409 1.00 63.02 H new ATOM 0 HE2 LYS A 142 -20.176 -0.678 -1.573 1.00 20.01 H new ATOM 0 HE3 LYS A 142 -21.080 -1.958 -0.788 1.00 20.01 H new ATOM 0 HZ1 LYS A 142 -21.458 0.039 0.382 1.00 43.44 H new ATOM 0 HZ2 LYS A 142 -20.467 -0.925 1.368 1.00 43.44 H new ATOM 0 HZ3 LYS A 142 -19.799 0.378 0.509 1.00 43.44 H new ATOM 2119 N LYS A 143 -13.578 -2.793 0.744 1.00 12.13 N ATOM 2120 CA LYS A 143 -12.298 -3.492 0.623 1.00 51.34 C ATOM 2121 C LYS A 143 -12.128 -4.072 -0.777 1.00 13.42 C ATOM 2122 O LYS A 143 -11.139 -3.783 -1.452 1.00 44.13 O ATOM 2123 CB LYS A 143 -12.080 -4.507 1.779 1.00 35.40 C ATOM 2124 CG LYS A 143 -11.063 -5.632 1.502 1.00 11.22 C ATOM 2125 CD LYS A 143 -10.183 -6.067 2.695 1.00 73.14 C ATOM 2126 CE LYS A 143 -10.903 -6.847 3.801 1.00 33.03 C ATOM 2127 NZ LYS A 143 -9.948 -7.542 4.697 1.00 60.25 N ATOM 0 H LYS A 143 -14.148 -3.124 1.523 1.00 12.13 H new ATOM 0 HA LYS A 143 -11.490 -2.770 0.742 1.00 51.34 H new ATOM 0 HB2 LYS A 143 -11.754 -3.958 2.662 1.00 35.40 H new ATOM 0 HB3 LYS A 143 -13.040 -4.963 2.023 1.00 35.40 H new ATOM 0 HG2 LYS A 143 -11.608 -6.505 1.142 1.00 11.22 H new ATOM 0 HG3 LYS A 143 -10.408 -5.309 0.693 1.00 11.22 H new ATOM 0 HD2 LYS A 143 -9.366 -6.681 2.316 1.00 73.14 H new ATOM 0 HD3 LYS A 143 -9.735 -5.177 3.136 1.00 73.14 H new ATOM 0 HE2 LYS A 143 -11.518 -6.163 4.386 1.00 33.03 H new ATOM 0 HE3 LYS A 143 -11.576 -7.577 3.352 1.00 33.03 H new ATOM 0 HZ1 LYS A 143 -10.335 -7.570 5.662 1.00 60.25 H new ATOM 0 HZ2 LYS A 143 -9.796 -8.513 4.356 1.00 60.25 H new ATOM 0 HZ3 LYS A 143 -9.042 -7.031 4.702 1.00 60.25 H new ATOM 2141 N ARG A 144 -13.131 -4.823 -1.229 1.00 73.45 N ATOM 2142 CA ARG A 144 -13.226 -5.477 -2.535 1.00 64.11 C ATOM 2143 C ARG A 144 -13.189 -4.553 -3.764 1.00 15.22 C ATOM 2144 O ARG A 144 -13.310 -5.054 -4.883 1.00 20.03 O ATOM 2145 CB ARG A 144 -14.469 -6.383 -2.525 1.00 72.02 C ATOM 2146 CG ARG A 144 -15.816 -5.666 -2.317 1.00 21.43 C ATOM 2147 CD ARG A 144 -16.895 -6.662 -1.862 1.00 60.22 C ATOM 2148 NE ARG A 144 -17.117 -7.734 -2.847 1.00 34.01 N ATOM 2149 CZ ARG A 144 -17.833 -7.623 -3.968 1.00 71.24 C ATOM 2150 NH1 ARG A 144 -18.434 -6.483 -4.283 1.00 24.31 N ATOM 2151 NH2 ARG A 144 -17.954 -8.646 -4.802 1.00 0.12 N ATOM 0 H ARG A 144 -13.954 -5.003 -0.655 1.00 73.45 H new ATOM 0 HA ARG A 144 -12.313 -6.059 -2.662 1.00 64.11 H new ATOM 0 HB2 ARG A 144 -14.509 -6.925 -3.470 1.00 72.02 H new ATOM 0 HB3 ARG A 144 -14.348 -7.126 -1.737 1.00 72.02 H new ATOM 0 HG2 ARG A 144 -15.703 -4.878 -1.572 1.00 21.43 H new ATOM 0 HG3 ARG A 144 -16.125 -5.185 -3.245 1.00 21.43 H new ATOM 0 HD2 ARG A 144 -16.601 -7.102 -0.909 1.00 60.22 H new ATOM 0 HD3 ARG A 144 -17.830 -6.129 -1.692 1.00 60.22 H new ATOM 0 HE ARG A 144 -16.687 -8.639 -2.656 1.00 34.01 H new ATOM 0 HH11 ARG A 144 -18.352 -5.676 -3.665 1.00 24.31 H new ATOM 0 HH12 ARG A 144 -18.978 -6.414 -5.143 1.00 24.31 H new ATOM 0 HH21 ARG A 144 -17.497 -9.533 -4.591 1.00 0.12 H new ATOM 0 HH22 ARG A 144 -18.504 -8.546 -5.655 1.00 0.12 H new ATOM 2165 N PHE A 145 -13.029 -3.238 -3.599 1.00 11.24 N ATOM 2166 CA PHE A 145 -13.038 -2.263 -4.684 1.00 12.41 C ATOM 2167 C PHE A 145 -11.822 -1.327 -4.659 1.00 54.15 C ATOM 2168 O PHE A 145 -11.809 -0.329 -5.380 1.00 43.21 O ATOM 2169 CB PHE A 145 -14.362 -1.482 -4.625 1.00 15.10 C ATOM 2170 CG PHE A 145 -15.620 -2.263 -4.986 1.00 54.21 C ATOM 2171 CD1 PHE A 145 -15.623 -3.212 -6.030 1.00 54.42 C ATOM 2172 CD2 PHE A 145 -16.823 -1.997 -4.305 1.00 51.52 C ATOM 2173 CE1 PHE A 145 -16.799 -3.911 -6.351 1.00 52.24 C ATOM 2174 CE2 PHE A 145 -18.005 -2.679 -4.641 1.00 72.44 C ATOM 2175 CZ PHE A 145 -17.995 -3.635 -5.669 1.00 72.12 C ATOM 0 H PHE A 145 -12.886 -2.814 -2.682 1.00 11.24 H new ATOM 0 HA PHE A 145 -12.964 -2.796 -5.632 1.00 12.41 H new ATOM 0 HB2 PHE A 145 -14.482 -1.086 -3.616 1.00 15.10 H new ATOM 0 HB3 PHE A 145 -14.285 -0.626 -5.296 1.00 15.10 H new ATOM 0 HD1 PHE A 145 -14.717 -3.402 -6.585 1.00 54.42 H new ATOM 0 HD2 PHE A 145 -16.838 -1.260 -3.515 1.00 51.52 H new ATOM 0 HE1 PHE A 145 -16.783 -4.664 -7.125 1.00 52.24 H new ATOM 0 HE2 PHE A 145 -18.921 -2.468 -4.109 1.00 72.44 H new ATOM 0 HZ PHE A 145 -18.903 -4.156 -5.934 1.00 72.12 H new ATOM 2185 N ILE A 146 -10.793 -1.604 -3.854 1.00 31.30 N ATOM 2186 CA ILE A 146 -9.608 -0.755 -3.771 1.00 41.13 C ATOM 2187 C ILE A 146 -8.413 -1.610 -4.194 1.00 3.11 C ATOM 2188 O ILE A 146 -8.085 -2.618 -3.559 1.00 11.54 O ATOM 2189 CB ILE A 146 -9.483 -0.093 -2.381 1.00 13.22 C ATOM 2190 CG1 ILE A 146 -10.771 0.676 -1.992 1.00 60.45 C ATOM 2191 CG2 ILE A 146 -8.276 0.865 -2.354 1.00 23.03 C ATOM 2192 CD1 ILE A 146 -10.868 0.939 -0.488 1.00 60.11 C ATOM 0 H ILE A 146 -10.760 -2.421 -3.244 1.00 31.30 H new ATOM 0 HA ILE A 146 -9.669 0.097 -4.448 1.00 41.13 H new ATOM 0 HB ILE A 146 -9.334 -0.889 -1.652 1.00 13.22 H new ATOM 0 HG12 ILE A 146 -10.798 1.626 -2.526 1.00 60.45 H new ATOM 0 HG13 ILE A 146 -11.642 0.105 -2.314 1.00 60.45 H new ATOM 0 HG21 ILE A 146 -8.199 1.325 -1.369 1.00 23.03 H new ATOM 0 HG22 ILE A 146 -7.364 0.307 -2.566 1.00 23.03 H new ATOM 0 HG23 ILE A 146 -8.410 1.641 -3.108 1.00 23.03 H new ATOM 0 HD11 ILE A 146 -11.789 1.480 -0.272 1.00 60.11 H new ATOM 0 HD12 ILE A 146 -10.871 -0.010 0.048 1.00 60.11 H new ATOM 0 HD13 ILE A 146 -10.013 1.535 -0.167 1.00 60.11 H new ATOM 2204 N ASP A 147 -7.806 -1.223 -5.313 1.00 63.05 N ATOM 2205 CA ASP A 147 -6.709 -1.906 -5.988 1.00 42.52 C ATOM 2206 C ASP A 147 -5.637 -0.930 -6.533 1.00 51.10 C ATOM 2207 O ASP A 147 -4.535 -1.377 -6.840 1.00 74.23 O ATOM 2208 CB ASP A 147 -7.222 -2.916 -7.050 1.00 2.24 C ATOM 2209 CG ASP A 147 -8.633 -2.707 -7.622 1.00 3.14 C ATOM 2210 OD1 ASP A 147 -9.602 -3.286 -7.065 1.00 74.44 O ATOM 2211 OD2 ASP A 147 -8.789 -2.037 -8.669 1.00 44.31 O ATOM 0 H ASP A 147 -8.085 -0.372 -5.801 1.00 63.05 H new ATOM 0 HA ASP A 147 -6.193 -2.498 -5.232 1.00 42.52 H new ATOM 0 HB2 ASP A 147 -6.520 -2.910 -7.883 1.00 2.24 H new ATOM 0 HB3 ASP A 147 -7.185 -3.912 -6.609 1.00 2.24 H new ATOM 2216 N LYS A 148 -5.867 0.395 -6.565 1.00 73.02 N ATOM 2217 CA LYS A 148 -4.914 1.406 -7.062 1.00 24.32 C ATOM 2218 C LYS A 148 -4.470 2.366 -5.968 1.00 40.21 C ATOM 2219 O LYS A 148 -5.315 2.981 -5.318 1.00 2.52 O ATOM 2220 CB LYS A 148 -5.517 2.196 -8.237 1.00 12.12 C ATOM 2221 CG LYS A 148 -4.976 1.682 -9.564 1.00 15.33 C ATOM 2222 CD LYS A 148 -3.800 2.564 -10.015 1.00 51.12 C ATOM 2223 CE LYS A 148 -2.743 1.887 -10.876 1.00 32.44 C ATOM 2224 NZ LYS A 148 -3.291 1.013 -11.933 1.00 5.25 N ATOM 0 H LYS A 148 -6.743 0.803 -6.238 1.00 73.02 H new ATOM 0 HA LYS A 148 -4.033 0.864 -7.407 1.00 24.32 H new ATOM 0 HB2 LYS A 148 -6.603 2.107 -8.222 1.00 12.12 H new ATOM 0 HB3 LYS A 148 -5.282 3.255 -8.128 1.00 12.12 H new ATOM 0 HG2 LYS A 148 -4.649 0.647 -9.459 1.00 15.33 H new ATOM 0 HG3 LYS A 148 -5.763 1.693 -10.318 1.00 15.33 H new ATOM 0 HD2 LYS A 148 -4.201 3.413 -10.569 1.00 51.12 H new ATOM 0 HD3 LYS A 148 -3.312 2.965 -9.127 1.00 51.12 H new ATOM 0 HE2 LYS A 148 -2.123 2.654 -11.340 1.00 32.44 H new ATOM 0 HE3 LYS A 148 -2.091 1.296 -10.233 1.00 32.44 H new ATOM 0 HZ1 LYS A 148 -2.510 0.590 -12.474 1.00 5.25 H new ATOM 0 HZ2 LYS A 148 -3.860 0.258 -11.499 1.00 5.25 H new ATOM 0 HZ3 LYS A 148 -3.890 1.574 -12.571 1.00 5.25 H new ATOM 2238 N ILE A 149 -3.160 2.564 -5.823 1.00 41.14 N ATOM 2239 CA ILE A 149 -2.557 3.554 -4.925 1.00 72.02 C ATOM 2240 C ILE A 149 -1.437 4.255 -5.695 1.00 0.25 C ATOM 2241 O ILE A 149 -0.663 3.606 -6.399 1.00 22.01 O ATOM 2242 CB ILE A 149 -2.074 2.869 -3.622 1.00 71.03 C ATOM 2243 CG1 ILE A 149 -3.273 2.356 -2.792 1.00 62.01 C ATOM 2244 CG2 ILE A 149 -1.228 3.802 -2.734 1.00 52.20 C ATOM 2245 CD1 ILE A 149 -3.546 0.859 -2.953 1.00 60.43 C ATOM 0 H ILE A 149 -2.467 2.025 -6.342 1.00 41.14 H new ATOM 0 HA ILE A 149 -3.280 4.307 -4.611 1.00 72.02 H new ATOM 0 HB ILE A 149 -1.447 2.036 -3.939 1.00 71.03 H new ATOM 0 HG12 ILE A 149 -3.091 2.571 -1.739 1.00 62.01 H new ATOM 0 HG13 ILE A 149 -4.166 2.911 -3.081 1.00 62.01 H new ATOM 0 HG21 ILE A 149 -0.918 3.267 -1.836 1.00 52.20 H new ATOM 0 HG22 ILE A 149 -0.346 4.127 -3.285 1.00 52.20 H new ATOM 0 HG23 ILE A 149 -1.821 4.672 -2.452 1.00 52.20 H new ATOM 0 HD11 ILE A 149 -4.402 0.577 -2.339 1.00 60.43 H new ATOM 0 HD12 ILE A 149 -3.761 0.639 -3.999 1.00 60.43 H new ATOM 0 HD13 ILE A 149 -2.670 0.293 -2.636 1.00 60.43 H new ATOM 2257 N THR A 150 -1.356 5.579 -5.584 1.00 74.34 N ATOM 2258 CA THR A 150 -0.537 6.410 -6.450 1.00 74.32 C ATOM 2259 C THR A 150 0.010 7.570 -5.616 1.00 33.35 C ATOM 2260 O THR A 150 -0.677 8.098 -4.741 1.00 61.04 O ATOM 2261 CB THR A 150 -1.374 6.849 -7.674 1.00 52.31 C ATOM 2262 OG1 THR A 150 -2.729 7.133 -7.348 1.00 11.55 O ATOM 2263 CG2 THR A 150 -1.379 5.770 -8.762 1.00 52.44 C ATOM 0 H THR A 150 -1.867 6.108 -4.878 1.00 74.34 H new ATOM 0 HA THR A 150 0.321 5.870 -6.851 1.00 74.32 H new ATOM 0 HB THR A 150 -0.895 7.760 -8.033 1.00 52.31 H new ATOM 0 HG1 THR A 150 -3.210 7.406 -8.157 1.00 11.55 H new ATOM 0 HG21 THR A 150 -1.976 6.110 -9.608 1.00 52.44 H new ATOM 0 HG22 THR A 150 -0.357 5.581 -9.091 1.00 52.44 H new ATOM 0 HG23 THR A 150 -1.807 4.851 -8.361 1.00 52.44 H new ATOM 2271 N ILE A 151 1.273 7.947 -5.824 1.00 62.42 N ATOM 2272 CA ILE A 151 1.970 8.918 -4.982 1.00 41.10 C ATOM 2273 C ILE A 151 2.442 10.060 -5.879 1.00 5.25 C ATOM 2274 O ILE A 151 2.726 9.867 -7.064 1.00 63.01 O ATOM 2275 CB ILE A 151 3.100 8.205 -4.208 1.00 14.32 C ATOM 2276 CG1 ILE A 151 2.522 7.186 -3.195 1.00 12.34 C ATOM 2277 CG2 ILE A 151 4.013 9.173 -3.440 1.00 20.31 C ATOM 2278 CD1 ILE A 151 3.313 5.885 -3.211 1.00 1.04 C ATOM 0 H ILE A 151 1.844 7.584 -6.587 1.00 62.42 H new ATOM 0 HA ILE A 151 1.322 9.352 -4.221 1.00 41.10 H new ATOM 0 HB ILE A 151 3.695 7.699 -4.969 1.00 14.32 H new ATOM 0 HG12 ILE A 151 2.542 7.614 -2.193 1.00 12.34 H new ATOM 0 HG13 ILE A 151 1.478 6.983 -3.435 1.00 12.34 H new ATOM 0 HG21 ILE A 151 4.785 8.608 -2.918 1.00 20.31 H new ATOM 0 HG22 ILE A 151 4.480 9.865 -4.140 1.00 20.31 H new ATOM 0 HG23 ILE A 151 3.422 9.734 -2.716 1.00 20.31 H new ATOM 0 HD11 ILE A 151 2.884 5.189 -2.490 1.00 1.04 H new ATOM 0 HD12 ILE A 151 3.271 5.446 -4.208 1.00 1.04 H new ATOM 0 HD13 ILE A 151 4.351 6.087 -2.947 1.00 1.04 H new ATOM 2290 N ASP A 152 2.409 11.266 -5.327 1.00 72.14 N ATOM 2291 CA ASP A 152 2.926 12.525 -5.862 1.00 31.35 C ATOM 2292 C ASP A 152 4.438 12.534 -5.734 1.00 54.44 C ATOM 2293 O ASP A 152 5.112 12.420 -6.783 1.00 10.25 O ATOM 2294 CB ASP A 152 2.286 13.642 -5.039 1.00 14.45 C ATOM 2295 CG ASP A 152 3.055 14.955 -4.932 1.00 71.04 C ATOM 2296 OD1 ASP A 152 3.127 15.724 -5.917 1.00 73.03 O ATOM 2297 OD2 ASP A 152 3.303 15.356 -3.769 1.00 71.30 O ATOM 0 H ASP A 152 1.982 11.403 -4.411 1.00 72.14 H new ATOM 0 HA ASP A 152 2.687 12.657 -6.917 1.00 31.35 H new ATOM 0 HB2 ASP A 152 1.306 13.858 -5.466 1.00 14.45 H new ATOM 0 HB3 ASP A 152 2.118 13.265 -4.030 1.00 14.45 H new TER 2302 ASP A 152