USER MOD reduce.3.24.130724 H: found=0, std=0, add=1522, rem=0, adj=71 USER MOD reduce.3.24.130724 removed 1514 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: B 87 ASN : amide:sc= 0.1 X(o=-0.14,f=-0.34) USER MOD Set 1.2: B 89 THR OG1 : rot -50:sc= -0.235 USER MOD Set 2.1: B 66 MET CE :methyl 137:sc= -3.99 (180deg=-9.47!) USER MOD Set 2.2: B 67 THR OG1 : rot 180:sc= -0.0774 USER MOD Set 3.1: B 60 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Set 3.2: B 61 TYR OH : rot 15:sc= -0.0803 USER MOD Set 4.1: B 51 ASN :FLIP amide:sc= 0 X(o=-1.2,f=-1.2) USER MOD Set 4.2: B 54 GLN :FLIP amide:sc= -1.18 F(o=-1.8,f=-1.2) USER MOD Set 5.1: B 19 SER OG : rot 180:sc= 0.0595 USER MOD Set 5.2: B 22 GLN : amide:sc= 0 X(o=0.06,f=0.017) USER MOD Set 6.1: A 66 MET CE :methyl -115:sc= -3.76 (180deg=-8.5!) USER MOD Set 6.2: A 67 THR OG1 : rot 180:sc= -0.135 USER MOD Set 7.1: A 51 ASN :FLIP amide:sc= 0 X(o=-1.6,f=-1.4) USER MOD Set 7.2: A 54 GLN :FLIP amide:sc= -1.4 X(o=-1.8,f=-1.4) USER MOD Set 8.1: A 50 MET CE :methyl -165:sc= -0.616 (180deg=-1.23) USER MOD Set 8.2: B 8 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Set 9.1: A 15 SER OG : rot -36:sc= -0.0288 USER MOD Set 9.2: A 60 LYS NZ :NH3+ -120:sc= -0.195 (180deg=-2.93!) USER MOD Set 9.3: A 61 TYR OH : rot 180:sc= 0.408 USER MOD Set10.1: A 8 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Set10.2: B 50 MET CE :methyl -162:sc= -0.438 (180deg=-1.09) USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ -120:sc= -0.0489 (180deg=-0.482) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 3 ASN : amide:sc= -0.636 K(o=-0.64,f=-1.6) USER MOD Single : A 4 THR OG1 : rot 180:sc= 0.042 USER MOD Single : A 6 SER OG : rot 99:sc= 1.05 USER MOD Single : A 12 MET CE :methyl -150:sc= -2.3 (180deg=-3.8!) USER MOD Single : A 14 LYS NZ :NH3+ 173:sc= -0.12 (180deg=-0.19) USER MOD Single : A 17 TYR OH : rot 180:sc= 0 USER MOD Single : A 19 SER OG : rot 180:sc= 0 USER MOD Single : A 21 GLN : amide:sc= -0.236 X(o=-0.24,f=0) USER MOD Single : A 22 GLN : amide:sc= -0.596 K(o=-0.6,f=-3.2!) USER MOD Single : A 27 THR OG1 : rot -120:sc=-0.00318 USER MOD Single : A 31 TYR OH : rot 180:sc= 0 USER MOD Single : A 33 THR OG1 : rot 180:sc= 0 USER MOD Single : A 35 SER OG : rot -84:sc= -0.265 USER MOD Single : A 36 TYR OH : rot 180:sc= 0 USER MOD Single : A 37 TYR OH : rot 180:sc= 0 USER MOD Single : A 39 SER OG : rot 102:sc= 1.23 USER MOD Single : A 42 SER OG : rot 180:sc= 0 USER MOD Single : A 43 THR OG1 : rot 81:sc= 0.143 USER MOD Single : A 46 THR OG1 : rot 59:sc= 0.241 USER MOD Single : A 49 MET CE :methyl 146:sc= -3.17 (180deg=-6.33!) USER MOD Single : A 55 THR OG1 : rot -93:sc= 0.231 USER MOD Single : A 57 GLN : amide:sc= -3.64! C(o=-3.6!,f=-4.4!) USER MOD Single : A 59 THR OG1 : rot 180:sc= 0 USER MOD Single : A 62 THR OG1 : rot 180:sc= -0.0417 USER MOD Single : A 68 ASN : amide:sc= -0.315 X(o=-0.32,f=-0.32) USER MOD Single : A 69 GLN : amide:sc= 0 X(o=0,f=-0.042) USER MOD Single : A 74 SER OG : rot 140:sc= -0.0128 USER MOD Single : A 76 GLN : amide:sc= -0.721 K(o=-0.72,f=-5.8!) USER MOD Single : A 83 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 86 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 87 ASN : amide:sc= -0.981 K(o=-0.98,f=-2.2!) USER MOD Single : A 89 THR OG1 : rot 180:sc= -0.415 USER MOD Single : A 90 THR OG1 : rot -151:sc= 1.26 USER MOD Single : A 91 SER OG : rot 180:sc= 0 USER MOD Single : A 93 HIS : no HD1:sc= -0.18 X(o=-0.18,f=-0.3) USER MOD Single : A 94 SER OG : rot 38:sc= 0.267 USER MOD Single : A 96 GLN : amide:sc= -0.008 K(o=-0.008,f=-1.4) USER MOD Single : A 97 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 98 THR OG1 : rot 180:sc= 0 USER MOD Single : B 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : B 1 MET N :NH3+ -178:sc= -0.887 (180deg=-0.889) USER MOD Single : B 2 SER OG : rot 180:sc= 0 USER MOD Single : B 3 ASN : amide:sc= -0.205 K(o=-0.21,f=-1.3) USER MOD Single : B 4 THR OG1 : rot 180:sc= 0.321 USER MOD Single : B 6 SER OG : rot 105:sc= 0.101 USER MOD Single : B 12 MET CE :methyl -129:sc= -1.37 (180deg=-4.21!) USER MOD Single : B 14 LYS NZ :NH3+ -148:sc= -0.0107 (180deg=-0.571) USER MOD Single : B 15 SER OG : rot 180:sc= 0 USER MOD Single : B 17 TYR OH : rot 180:sc= 0 USER MOD Single : B 21 GLN : amide:sc= -0.0847 K(o=-0.085,f=-0.64) USER MOD Single : B 27 THR OG1 : rot -63:sc= 0.176 USER MOD Single : B 31 TYR OH : rot 180:sc= 0 USER MOD Single : B 33 THR OG1 : rot 180:sc= 0 USER MOD Single : B 35 SER OG : rot 180:sc= 0 USER MOD Single : B 36 TYR OH : rot 180:sc= 0 USER MOD Single : B 37 TYR OH : rot 180:sc= 0 USER MOD Single : B 39 SER OG : rot 180:sc= -0.0172 USER MOD Single : B 42 SER OG : rot 180:sc= 0 USER MOD Single : B 43 THR OG1 : rot 180:sc= 0 USER MOD Single : B 46 THR OG1 : rot 170:sc= 0 USER MOD Single : B 49 MET CE :methyl -139:sc= -3.94! (180deg=-8.59!) USER MOD Single : B 55 THR OG1 : rot -89:sc= 0.757 USER MOD Single : B 57 GLN : amide:sc= -3.07 K(o=-3.1,f=-5.4!) USER MOD Single : B 59 THR OG1 : rot 180:sc= 0 USER MOD Single : B 62 THR OG1 : rot -67:sc= 0.524 USER MOD Single : B 68 ASN : amide:sc= -0.129 X(o=-0.13,f=-0.16) USER MOD Single : B 69 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 74 SER OG : rot -130:sc= -0.539 USER MOD Single : B 76 GLN : amide:sc= -1.5 K(o=-1.5,f=-4.7!) USER MOD Single : B 83 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : B 86 GLN : amide:sc=-0.00193 X(o=-0.0019,f=0) USER MOD Single : B 90 THR OG1 : rot 180:sc= -0.114 USER MOD Single : B 91 SER OG : rot 180:sc= 0 USER MOD Single : B 93 HIS : no HD1:sc= -0.082 X(o=-0.082,f=-0.0065) USER MOD Single : B 94 SER OG : rot 180:sc= 0 USER MOD Single : B 96 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 97 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 98 THR OG1 : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 3.302 -1.557 -1.496 1.00 52.20 N ATOM 2 CA MET A 1 2.331 -0.494 -1.727 1.00 50.55 C ATOM 3 C MET A 1 3.029 0.852 -1.898 1.00 74.40 C ATOM 4 O MET A 1 2.758 1.800 -1.160 1.00 64.45 O ATOM 5 CB MET A 1 1.336 -0.422 -0.568 1.00 3.44 C ATOM 6 CG MET A 1 0.440 -1.646 -0.459 1.00 12.32 C ATOM 7 SD MET A 1 -0.104 -1.959 1.231 1.00 41.14 S ATOM 8 CE MET A 1 0.108 -3.735 1.332 1.00 21.33 C ATOM 0 H1 MET A 1 3.222 -2.270 -2.249 1.00 52.20 H new ATOM 0 H2 MET A 1 4.262 -1.157 -1.499 1.00 52.20 H new ATOM 0 H3 MET A 1 3.116 -2.003 -0.575 1.00 52.20 H new ATOM 0 HA MET A 1 1.791 -0.723 -2.646 1.00 50.55 H new ATOM 0 HB2 MET A 1 1.886 -0.300 0.365 1.00 3.44 H new ATOM 0 HB3 MET A 1 0.713 0.464 -0.689 1.00 3.44 H new ATOM 0 HG2 MET A 1 -0.432 -1.511 -1.098 1.00 12.32 H new ATOM 0 HG3 MET A 1 0.976 -2.519 -0.832 1.00 12.32 H new ATOM 0 HE1 MET A 1 -0.188 -4.081 2.322 1.00 21.33 H new ATOM 0 HE2 MET A 1 -0.513 -4.219 0.578 1.00 21.33 H new ATOM 0 HE3 MET A 1 1.154 -3.987 1.157 1.00 21.33 H new ATOM 18 N SER A 2 3.928 0.928 -2.873 1.00 63.31 N ATOM 19 CA SER A 2 4.668 2.157 -3.137 1.00 1.32 C ATOM 20 C SER A 2 4.094 2.887 -4.348 1.00 12.31 C ATOM 21 O SER A 2 3.436 2.284 -5.196 1.00 62.31 O ATOM 22 CB SER A 2 6.148 1.847 -3.369 1.00 41.23 C ATOM 23 OG SER A 2 6.580 0.777 -2.545 1.00 50.11 O ATOM 0 H SER A 2 4.162 0.153 -3.494 1.00 63.31 H new ATOM 0 HA SER A 2 4.572 2.804 -2.265 1.00 1.32 H new ATOM 0 HB2 SER A 2 6.310 1.592 -4.416 1.00 41.23 H new ATOM 0 HB3 SER A 2 6.746 2.735 -3.161 1.00 41.23 H new ATOM 0 HG SER A 2 7.529 0.597 -2.713 1.00 50.11 H new ATOM 29 N ASN A 3 4.350 4.189 -4.422 1.00 52.21 N ATOM 30 CA ASN A 3 3.859 5.002 -5.528 1.00 14.51 C ATOM 31 C ASN A 3 4.875 6.075 -5.908 1.00 2.30 C ATOM 32 O ASN A 3 5.204 6.947 -5.103 1.00 44.20 O ATOM 33 CB ASN A 3 2.526 5.656 -5.156 1.00 31.41 C ATOM 34 CG ASN A 3 1.630 4.727 -4.359 1.00 63.51 C ATOM 35 OD1 ASN A 3 1.867 4.483 -3.176 1.00 34.44 O ATOM 36 ND2 ASN A 3 0.594 4.205 -5.006 1.00 13.33 N ATOM 0 H ASN A 3 4.894 4.703 -3.729 1.00 52.21 H new ATOM 0 HA ASN A 3 3.709 4.348 -6.387 1.00 14.51 H new ATOM 0 HB2 ASN A 3 2.717 6.559 -4.576 1.00 31.41 H new ATOM 0 HB3 ASN A 3 2.009 5.964 -6.065 1.00 31.41 H new ATOM 0 HD21 ASN A 3 -0.044 3.574 -4.522 1.00 13.33 H new ATOM 0 HD22 ASN A 3 0.437 4.436 -5.987 1.00 13.33 H new ATOM 43 N THR A 4 5.370 6.006 -7.139 1.00 55.11 N ATOM 44 CA THR A 4 6.349 6.969 -7.625 1.00 61.02 C ATOM 45 C THR A 4 5.813 8.393 -7.531 1.00 34.12 C ATOM 46 O THR A 4 4.616 8.603 -7.334 1.00 24.32 O ATOM 47 CB THR A 4 6.747 6.678 -9.085 1.00 65.03 C ATOM 48 OG1 THR A 4 6.650 5.274 -9.349 1.00 41.45 O ATOM 49 CG2 THR A 4 8.164 7.156 -9.365 1.00 24.23 C ATOM 0 H THR A 4 5.108 5.292 -7.819 1.00 55.11 H new ATOM 0 HA THR A 4 7.229 6.872 -6.990 1.00 61.02 H new ATOM 0 HB THR A 4 6.063 7.218 -9.740 1.00 65.03 H new ATOM 0 HG1 THR A 4 6.903 5.098 -10.279 1.00 41.45 H new ATOM 0 HG21 THR A 4 8.423 6.940 -10.402 1.00 24.23 H new ATOM 0 HG22 THR A 4 8.226 8.230 -9.192 1.00 24.23 H new ATOM 0 HG23 THR A 4 8.859 6.641 -8.702 1.00 24.23 H new ATOM 57 N ILE A 5 6.706 9.367 -7.673 1.00 21.33 N ATOM 58 CA ILE A 5 6.321 10.771 -7.606 1.00 1.35 C ATOM 59 C ILE A 5 5.154 11.067 -8.543 1.00 62.20 C ATOM 60 O ILE A 5 4.178 11.707 -8.152 1.00 53.40 O ATOM 61 CB ILE A 5 7.498 11.696 -7.962 1.00 73.54 C ATOM 62 CG1 ILE A 5 8.728 11.338 -7.126 1.00 25.20 C ATOM 63 CG2 ILE A 5 7.112 13.152 -7.750 1.00 34.15 C ATOM 64 CD1 ILE A 5 9.937 10.966 -7.956 1.00 64.05 C ATOM 0 H ILE A 5 7.701 9.209 -7.835 1.00 21.33 H new ATOM 0 HA ILE A 5 6.016 10.965 -6.578 1.00 1.35 H new ATOM 0 HB ILE A 5 7.744 11.556 -9.015 1.00 73.54 H new ATOM 0 HG12 ILE A 5 8.982 12.184 -6.488 1.00 25.20 H new ATOM 0 HG13 ILE A 5 8.480 10.506 -6.467 1.00 25.20 H new ATOM 0 HG21 ILE A 5 7.955 13.793 -8.006 1.00 34.15 H new ATOM 0 HG22 ILE A 5 6.262 13.399 -8.386 1.00 34.15 H new ATOM 0 HG23 ILE A 5 6.842 13.308 -6.706 1.00 34.15 H new ATOM 0 HD11 ILE A 5 10.771 10.725 -7.297 1.00 64.05 H new ATOM 0 HD12 ILE A 5 9.701 10.100 -8.575 1.00 64.05 H new ATOM 0 HD13 ILE A 5 10.211 11.805 -8.595 1.00 64.05 H new ATOM 76 N SER A 6 5.263 10.596 -9.781 1.00 63.44 N ATOM 77 CA SER A 6 4.219 10.812 -10.776 1.00 34.41 C ATOM 78 C SER A 6 2.856 10.394 -10.231 1.00 2.22 C ATOM 79 O SER A 6 1.863 11.099 -10.408 1.00 53.23 O ATOM 80 CB SER A 6 4.532 10.030 -12.053 1.00 71.40 C ATOM 81 OG SER A 6 3.678 8.908 -12.186 1.00 42.32 O ATOM 0 H SER A 6 6.064 10.062 -10.119 1.00 63.44 H new ATOM 0 HA SER A 6 4.188 11.876 -11.009 1.00 34.41 H new ATOM 0 HB2 SER A 6 4.419 10.682 -12.919 1.00 71.40 H new ATOM 0 HB3 SER A 6 5.571 9.700 -12.036 1.00 71.40 H new ATOM 0 HG SER A 6 2.948 9.124 -12.803 1.00 42.32 H new ATOM 87 N GLU A 7 2.818 9.242 -9.569 1.00 61.11 N ATOM 88 CA GLU A 7 1.577 8.729 -9.000 1.00 23.42 C ATOM 89 C GLU A 7 1.011 9.699 -7.966 1.00 40.04 C ATOM 90 O GLU A 7 -0.201 9.783 -7.774 1.00 33.31 O ATOM 91 CB GLU A 7 1.812 7.361 -8.357 1.00 72.32 C ATOM 92 CG GLU A 7 2.180 6.276 -9.355 1.00 53.22 C ATOM 93 CD GLU A 7 1.063 5.983 -10.338 1.00 62.25 C ATOM 94 OE1 GLU A 7 -0.062 6.481 -10.122 1.00 50.32 O ATOM 95 OE2 GLU A 7 1.313 5.256 -11.322 1.00 43.33 O ATOM 0 H GLU A 7 3.631 8.647 -9.413 1.00 61.11 H new ATOM 0 HA GLU A 7 0.853 8.623 -9.808 1.00 23.42 H new ATOM 0 HB2 GLU A 7 2.608 7.448 -7.617 1.00 72.32 H new ATOM 0 HB3 GLU A 7 0.911 7.061 -7.822 1.00 72.32 H new ATOM 0 HG2 GLU A 7 3.071 6.580 -9.904 1.00 53.22 H new ATOM 0 HG3 GLU A 7 2.433 5.363 -8.816 1.00 53.22 H new ATOM 102 N LYS A 8 1.900 10.430 -7.301 1.00 33.13 N ATOM 103 CA LYS A 8 1.493 11.394 -6.287 1.00 4.14 C ATOM 104 C LYS A 8 0.909 12.647 -6.930 1.00 74.14 C ATOM 105 O LYS A 8 0.422 13.543 -6.239 1.00 64.53 O ATOM 106 CB LYS A 8 2.684 11.770 -5.403 1.00 75.53 C ATOM 107 CG LYS A 8 3.565 10.588 -5.034 1.00 22.34 C ATOM 108 CD LYS A 8 4.463 10.909 -3.852 1.00 11.10 C ATOM 109 CE LYS A 8 4.120 10.052 -2.643 1.00 11.21 C ATOM 110 NZ LYS A 8 5.339 9.635 -1.895 1.00 5.33 N ATOM 0 H LYS A 8 2.908 10.372 -7.447 1.00 33.13 H new ATOM 0 HA LYS A 8 0.723 10.930 -5.671 1.00 4.14 H new ATOM 0 HB2 LYS A 8 3.288 12.515 -5.920 1.00 75.53 H new ATOM 0 HB3 LYS A 8 2.315 12.236 -4.490 1.00 75.53 H new ATOM 0 HG2 LYS A 8 2.940 9.728 -4.794 1.00 22.34 H new ATOM 0 HG3 LYS A 8 4.177 10.308 -5.891 1.00 22.34 H new ATOM 0 HD2 LYS A 8 5.504 10.747 -4.130 1.00 11.10 H new ATOM 0 HD3 LYS A 8 4.362 11.963 -3.593 1.00 11.10 H new ATOM 0 HE2 LYS A 8 3.459 10.609 -1.979 1.00 11.21 H new ATOM 0 HE3 LYS A 8 3.573 9.167 -2.968 1.00 11.21 H new ATOM 0 HZ1 LYS A 8 5.063 9.053 -1.079 1.00 5.33 H new ATOM 0 HZ2 LYS A 8 5.958 9.082 -2.521 1.00 5.33 H new ATOM 0 HZ3 LYS A 8 5.848 10.479 -1.562 1.00 5.33 H new ATOM 124 N ILE A 9 0.960 12.704 -8.257 1.00 15.20 N ATOM 125 CA ILE A 9 0.434 13.847 -8.993 1.00 41.10 C ATOM 126 C ILE A 9 -0.773 13.449 -9.837 1.00 71.21 C ATOM 127 O ILE A 9 -1.417 14.295 -10.457 1.00 5.21 O ATOM 128 CB ILE A 9 1.504 14.467 -9.910 1.00 42.44 C ATOM 129 CG1 ILE A 9 2.826 14.623 -9.154 1.00 3.22 C ATOM 130 CG2 ILE A 9 1.031 15.811 -10.443 1.00 73.14 C ATOM 131 CD1 ILE A 9 3.937 15.213 -9.995 1.00 55.24 C ATOM 0 H ILE A 9 1.360 11.972 -8.844 1.00 15.20 H new ATOM 0 HA ILE A 9 0.129 14.586 -8.252 1.00 41.10 H new ATOM 0 HB ILE A 9 1.667 13.800 -10.756 1.00 42.44 H new ATOM 0 HG12 ILE A 9 2.664 15.258 -8.283 1.00 3.22 H new ATOM 0 HG13 ILE A 9 3.141 13.647 -8.783 1.00 3.22 H new ATOM 0 HG21 ILE A 9 1.798 16.237 -11.090 1.00 73.14 H new ATOM 0 HG22 ILE A 9 0.112 15.673 -11.013 1.00 73.14 H new ATOM 0 HG23 ILE A 9 0.843 16.487 -9.609 1.00 73.14 H new ATOM 0 HD11 ILE A 9 4.843 15.295 -9.395 1.00 55.24 H new ATOM 0 HD12 ILE A 9 4.126 14.567 -10.853 1.00 55.24 H new ATOM 0 HD13 ILE A 9 3.643 16.203 -10.344 1.00 55.24 H new ATOM 143 N VAL A 10 -1.075 12.154 -9.855 1.00 4.30 N ATOM 144 CA VAL A 10 -2.206 11.644 -10.620 1.00 43.34 C ATOM 145 C VAL A 10 -3.432 11.460 -9.732 1.00 34.04 C ATOM 146 O VAL A 10 -4.513 11.968 -10.035 1.00 71.51 O ATOM 147 CB VAL A 10 -1.869 10.300 -11.293 1.00 22.34 C ATOM 148 CG1 VAL A 10 -3.047 9.804 -12.116 1.00 23.30 C ATOM 149 CG2 VAL A 10 -0.623 10.436 -12.156 1.00 51.14 C ATOM 0 H VAL A 10 -0.552 11.440 -9.348 1.00 4.30 H new ATOM 0 HA VAL A 10 -2.425 12.383 -11.390 1.00 43.34 H new ATOM 0 HB VAL A 10 -1.666 9.564 -10.515 1.00 22.34 H new ATOM 0 HG11 VAL A 10 -2.790 8.854 -12.584 1.00 23.30 H new ATOM 0 HG12 VAL A 10 -3.912 9.667 -11.467 1.00 23.30 H new ATOM 0 HG13 VAL A 10 -3.285 10.536 -12.888 1.00 23.30 H new ATOM 0 HG21 VAL A 10 -0.398 9.478 -12.624 1.00 51.14 H new ATOM 0 HG22 VAL A 10 -0.795 11.186 -12.928 1.00 51.14 H new ATOM 0 HG23 VAL A 10 0.218 10.742 -11.534 1.00 51.14 H new ATOM 159 N LEU A 11 -3.257 10.734 -8.633 1.00 33.50 N ATOM 160 CA LEU A 11 -4.349 10.484 -7.700 1.00 22.11 C ATOM 161 C LEU A 11 -5.033 11.787 -7.300 1.00 23.40 C ATOM 162 O LEU A 11 -6.259 11.884 -7.311 1.00 73.14 O ATOM 163 CB LEU A 11 -3.827 9.766 -6.453 1.00 73.11 C ATOM 164 CG LEU A 11 -2.540 10.325 -5.846 1.00 24.02 C ATOM 165 CD1 LEU A 11 -2.860 11.286 -4.712 1.00 11.31 C ATOM 166 CD2 LEU A 11 -1.647 9.196 -5.355 1.00 62.13 C ATOM 0 H LEU A 11 -2.369 10.308 -8.367 1.00 33.50 H new ATOM 0 HA LEU A 11 -5.081 9.849 -8.199 1.00 22.11 H new ATOM 0 HB2 LEU A 11 -4.606 9.792 -5.691 1.00 73.11 H new ATOM 0 HB3 LEU A 11 -3.661 8.718 -6.704 1.00 73.11 H new ATOM 0 HG LEU A 11 -2.004 10.874 -6.620 1.00 24.02 H new ATOM 0 HD11 LEU A 11 -1.932 11.674 -4.291 1.00 11.31 H new ATOM 0 HD12 LEU A 11 -3.459 12.113 -5.094 1.00 11.31 H new ATOM 0 HD13 LEU A 11 -3.418 10.761 -3.937 1.00 11.31 H new ATOM 0 HD21 LEU A 11 -0.736 9.613 -4.926 1.00 62.13 H new ATOM 0 HD22 LEU A 11 -2.174 8.619 -4.595 1.00 62.13 H new ATOM 0 HD23 LEU A 11 -1.390 8.546 -6.191 1.00 62.13 H new ATOM 178 N MET A 12 -4.231 12.787 -6.949 1.00 51.31 N ATOM 179 CA MET A 12 -4.759 14.085 -6.549 1.00 35.35 C ATOM 180 C MET A 12 -5.338 14.830 -7.748 1.00 14.33 C ATOM 181 O MET A 12 -6.354 15.516 -7.634 1.00 15.55 O ATOM 182 CB MET A 12 -3.663 14.926 -5.893 1.00 43.44 C ATOM 183 CG MET A 12 -2.336 14.880 -6.634 1.00 42.04 C ATOM 184 SD MET A 12 -1.318 16.336 -6.329 1.00 23.34 S ATOM 185 CE MET A 12 -1.197 17.018 -7.981 1.00 1.34 C ATOM 0 H MET A 12 -3.213 12.723 -6.934 1.00 51.31 H new ATOM 0 HA MET A 12 -5.558 13.916 -5.827 1.00 35.35 H new ATOM 0 HB2 MET A 12 -3.999 15.961 -5.830 1.00 43.44 H new ATOM 0 HB3 MET A 12 -3.512 14.578 -4.871 1.00 43.44 H new ATOM 0 HG2 MET A 12 -1.787 13.988 -6.332 1.00 42.04 H new ATOM 0 HG3 MET A 12 -2.525 14.791 -7.704 1.00 42.04 H new ATOM 0 HE1 MET A 12 -0.249 17.545 -8.089 1.00 1.34 H new ATOM 0 HE2 MET A 12 -1.249 16.211 -8.712 1.00 1.34 H new ATOM 0 HE3 MET A 12 -2.019 17.714 -8.149 1.00 1.34 H new ATOM 195 N ARG A 13 -4.685 14.690 -8.897 1.00 72.22 N ATOM 196 CA ARG A 13 -5.134 15.351 -10.117 1.00 43.34 C ATOM 197 C ARG A 13 -6.560 14.936 -10.466 1.00 25.20 C ATOM 198 O ARG A 13 -7.382 15.764 -10.859 1.00 32.00 O ATOM 199 CB ARG A 13 -4.195 15.018 -11.277 1.00 43.40 C ATOM 200 CG ARG A 13 -4.728 15.449 -12.634 1.00 23.54 C ATOM 201 CD ARG A 13 -3.607 15.598 -13.651 1.00 1.24 C ATOM 202 NE ARG A 13 -3.837 14.788 -14.843 1.00 13.15 N ATOM 203 CZ ARG A 13 -3.581 13.486 -14.908 1.00 62.43 C ATOM 204 NH1 ARG A 13 -3.086 12.852 -13.854 1.00 34.04 N ATOM 205 NH2 ARG A 13 -3.817 12.816 -16.029 1.00 3.12 N ATOM 0 H ARG A 13 -3.843 14.125 -9.009 1.00 72.22 H new ATOM 0 HA ARG A 13 -5.119 16.427 -9.945 1.00 43.34 H new ATOM 0 HB2 ARG A 13 -3.233 15.500 -11.104 1.00 43.40 H new ATOM 0 HB3 ARG A 13 -4.015 13.943 -11.291 1.00 43.40 H new ATOM 0 HG2 ARG A 13 -5.450 14.716 -12.992 1.00 23.54 H new ATOM 0 HG3 ARG A 13 -5.258 16.396 -12.534 1.00 23.54 H new ATOM 0 HD2 ARG A 13 -3.515 16.646 -13.937 1.00 1.24 H new ATOM 0 HD3 ARG A 13 -2.661 15.308 -13.193 1.00 1.24 H new ATOM 0 HE ARG A 13 -4.215 15.247 -15.672 1.00 13.15 H new ATOM 0 HH11 ARG A 13 -2.901 13.364 -12.991 1.00 34.04 H new ATOM 0 HH12 ARG A 13 -2.890 11.852 -13.906 1.00 34.04 H new ATOM 0 HH21 ARG A 13 -4.196 13.301 -16.843 1.00 3.12 H new ATOM 0 HH22 ARG A 13 -3.620 11.816 -16.077 1.00 3.12 H new ATOM 219 N LYS A 14 -6.848 13.647 -10.320 1.00 43.14 N ATOM 220 CA LYS A 14 -8.174 13.119 -10.619 1.00 24.33 C ATOM 221 C LYS A 14 -9.194 13.597 -9.589 1.00 14.43 C ATOM 222 O LYS A 14 -10.399 13.586 -9.843 1.00 20.12 O ATOM 223 CB LYS A 14 -8.143 11.590 -10.649 1.00 73.54 C ATOM 224 CG LYS A 14 -8.285 11.006 -12.044 1.00 21.53 C ATOM 225 CD LYS A 14 -6.936 10.862 -12.728 1.00 2.42 C ATOM 226 CE LYS A 14 -6.567 12.116 -13.504 1.00 1.21 C ATOM 227 NZ LYS A 14 -6.450 11.852 -14.965 1.00 3.32 N ATOM 0 H LYS A 14 -6.180 12.948 -9.996 1.00 43.14 H new ATOM 0 HA LYS A 14 -8.472 13.489 -11.600 1.00 24.33 H new ATOM 0 HB2 LYS A 14 -7.205 11.245 -10.214 1.00 73.54 H new ATOM 0 HB3 LYS A 14 -8.946 11.206 -10.020 1.00 73.54 H new ATOM 0 HG2 LYS A 14 -8.769 10.031 -11.984 1.00 21.53 H new ATOM 0 HG3 LYS A 14 -8.931 11.647 -12.644 1.00 21.53 H new ATOM 0 HD2 LYS A 14 -6.169 10.656 -11.982 1.00 2.42 H new ATOM 0 HD3 LYS A 14 -6.960 10.008 -13.405 1.00 2.42 H new ATOM 0 HE2 LYS A 14 -7.322 12.884 -13.333 1.00 1.21 H new ATOM 0 HE3 LYS A 14 -5.622 12.509 -13.130 1.00 1.21 H new ATOM 0 HZ1 LYS A 14 -6.315 12.751 -15.470 1.00 3.32 H new ATOM 0 HZ2 LYS A 14 -5.636 11.230 -15.141 1.00 3.32 H new ATOM 0 HZ3 LYS A 14 -7.318 11.391 -15.305 1.00 3.32 H new ATOM 241 N SER A 15 -8.704 14.018 -8.428 1.00 0.52 N ATOM 242 CA SER A 15 -9.572 14.498 -7.361 1.00 34.52 C ATOM 243 C SER A 15 -10.262 15.799 -7.764 1.00 4.13 C ATOM 244 O SER A 15 -11.387 16.071 -7.347 1.00 42.32 O ATOM 245 CB SER A 15 -8.769 14.710 -6.076 1.00 23.33 C ATOM 246 OG SER A 15 -9.602 14.629 -4.933 1.00 1.04 O ATOM 0 H SER A 15 -7.709 14.036 -8.203 1.00 0.52 H new ATOM 0 HA SER A 15 -10.337 13.742 -7.182 1.00 34.52 H new ATOM 0 HB2 SER A 15 -7.981 13.960 -6.009 1.00 23.33 H new ATOM 0 HB3 SER A 15 -8.281 15.684 -6.105 1.00 23.33 H new ATOM 0 HG SER A 15 -10.479 15.014 -5.140 1.00 1.04 H new ATOM 252 N GLU A 16 -9.578 16.596 -8.577 1.00 24.43 N ATOM 253 CA GLU A 16 -10.123 17.868 -9.036 1.00 22.34 C ATOM 254 C GLU A 16 -11.016 17.668 -10.257 1.00 32.11 C ATOM 255 O GLU A 16 -11.709 18.589 -10.690 1.00 43.32 O ATOM 256 CB GLU A 16 -8.992 18.842 -9.372 1.00 13.35 C ATOM 257 CG GLU A 16 -9.441 20.292 -9.454 1.00 62.31 C ATOM 258 CD GLU A 16 -9.872 20.845 -8.111 1.00 2.34 C ATOM 259 OE1 GLU A 16 -9.214 20.529 -7.098 1.00 14.23 O ATOM 260 OE2 GLU A 16 -10.870 21.596 -8.072 1.00 72.53 O ATOM 0 H GLU A 16 -8.645 16.384 -8.932 1.00 24.43 H new ATOM 0 HA GLU A 16 -10.726 18.287 -8.231 1.00 22.34 H new ATOM 0 HB2 GLU A 16 -8.212 18.754 -8.616 1.00 13.35 H new ATOM 0 HB3 GLU A 16 -8.547 18.554 -10.324 1.00 13.35 H new ATOM 0 HG2 GLU A 16 -8.626 20.899 -9.848 1.00 62.31 H new ATOM 0 HG3 GLU A 16 -10.269 20.373 -10.159 1.00 62.31 H new ATOM 267 N TYR A 17 -10.994 16.458 -10.807 1.00 34.24 N ATOM 268 CA TYR A 17 -11.799 16.138 -11.979 1.00 3.21 C ATOM 269 C TYR A 17 -11.391 16.997 -13.172 1.00 63.52 C ATOM 270 O TYR A 17 -12.234 17.429 -13.959 1.00 30.34 O ATOM 271 CB TYR A 17 -13.285 16.341 -11.675 1.00 21.42 C ATOM 272 CG TYR A 17 -13.728 15.713 -10.373 1.00 23.24 C ATOM 273 CD1 TYR A 17 -13.914 14.340 -10.270 1.00 54.02 C ATOM 274 CD2 TYR A 17 -13.962 16.491 -9.247 1.00 22.22 C ATOM 275 CE1 TYR A 17 -14.319 13.761 -9.083 1.00 50.43 C ATOM 276 CE2 TYR A 17 -14.366 15.921 -8.056 1.00 21.13 C ATOM 277 CZ TYR A 17 -14.543 14.556 -7.978 1.00 22.22 C ATOM 278 OH TYR A 17 -14.948 13.984 -6.794 1.00 41.24 O ATOM 0 H TYR A 17 -10.428 15.684 -10.460 1.00 34.24 H new ATOM 0 HA TYR A 17 -11.626 15.092 -12.231 1.00 3.21 H new ATOM 0 HB2 TYR A 17 -13.498 17.409 -11.644 1.00 21.42 H new ATOM 0 HB3 TYR A 17 -13.875 15.921 -12.490 1.00 21.42 H new ATOM 0 HD1 TYR A 17 -13.739 13.715 -11.133 1.00 54.02 H new ATOM 0 HD2 TYR A 17 -13.826 17.561 -9.304 1.00 22.22 H new ATOM 0 HE1 TYR A 17 -14.459 12.692 -9.020 1.00 50.43 H new ATOM 0 HE2 TYR A 17 -14.542 16.541 -7.190 1.00 21.13 H new ATOM 0 HH TYR A 17 -15.060 14.682 -6.115 1.00 41.24 H new ATOM 288 N LEU A 18 -10.091 17.239 -13.300 1.00 50.01 N ATOM 289 CA LEU A 18 -9.568 18.045 -14.398 1.00 55.21 C ATOM 290 C LEU A 18 -8.700 17.203 -15.327 1.00 11.42 C ATOM 291 O LEU A 18 -8.359 16.063 -15.011 1.00 23.51 O ATOM 292 CB LEU A 18 -8.757 19.221 -13.851 1.00 71.45 C ATOM 293 CG LEU A 18 -7.452 18.863 -13.137 1.00 20.12 C ATOM 294 CD1 LEU A 18 -6.314 18.737 -14.137 1.00 2.31 C ATOM 295 CD2 LEU A 18 -7.121 19.903 -12.077 1.00 52.43 C ATOM 0 H LEU A 18 -9.380 16.889 -12.658 1.00 50.01 H new ATOM 0 HA LEU A 18 -10.413 18.428 -14.970 1.00 55.21 H new ATOM 0 HB2 LEU A 18 -8.523 19.891 -14.678 1.00 71.45 H new ATOM 0 HB3 LEU A 18 -9.386 19.779 -13.157 1.00 71.45 H new ATOM 0 HG LEU A 18 -7.583 17.900 -12.643 1.00 20.12 H new ATOM 0 HD11 LEU A 18 -5.394 18.482 -13.611 1.00 2.31 H new ATOM 0 HD12 LEU A 18 -6.548 17.954 -14.858 1.00 2.31 H new ATOM 0 HD13 LEU A 18 -6.182 19.684 -14.660 1.00 2.31 H new ATOM 0 HD21 LEU A 18 -6.190 19.632 -11.580 1.00 52.43 H new ATOM 0 HD22 LEU A 18 -7.010 20.880 -12.548 1.00 52.43 H new ATOM 0 HD23 LEU A 18 -7.926 19.943 -11.343 1.00 52.43 H new ATOM 307 N SER A 19 -8.344 17.773 -16.474 1.00 75.14 N ATOM 308 CA SER A 19 -7.516 17.073 -17.450 1.00 42.32 C ATOM 309 C SER A 19 -6.101 17.644 -17.473 1.00 72.22 C ATOM 310 O SER A 19 -5.862 18.754 -16.997 1.00 2.13 O ATOM 311 CB SER A 19 -8.141 17.172 -18.844 1.00 3.34 C ATOM 312 OG SER A 19 -9.329 16.405 -18.926 1.00 61.02 O ATOM 0 H SER A 19 -8.616 18.717 -16.750 1.00 75.14 H new ATOM 0 HA SER A 19 -7.461 16.025 -17.157 1.00 42.32 H new ATOM 0 HB2 SER A 19 -8.361 18.214 -19.074 1.00 3.34 H new ATOM 0 HB3 SER A 19 -7.428 16.824 -19.591 1.00 3.34 H new ATOM 0 HG SER A 19 -9.709 16.486 -19.825 1.00 61.02 H new ATOM 318 N ARG A 20 -5.169 16.877 -18.028 1.00 71.01 N ATOM 319 CA ARG A 20 -3.778 17.306 -18.112 1.00 24.20 C ATOM 320 C ARG A 20 -3.674 18.698 -18.728 1.00 73.30 C ATOM 321 O ARG A 20 -2.780 19.472 -18.387 1.00 23.14 O ATOM 322 CB ARG A 20 -2.965 16.309 -18.939 1.00 14.35 C ATOM 323 CG ARG A 20 -2.202 15.299 -18.097 1.00 64.12 C ATOM 324 CD ARG A 20 -0.993 14.753 -18.840 1.00 52.12 C ATOM 325 NE ARG A 20 -1.219 13.398 -19.332 1.00 31.03 N ATOM 326 CZ ARG A 20 -1.261 12.327 -18.547 1.00 33.21 C ATOM 327 NH1 ARG A 20 -1.095 12.456 -17.237 1.00 13.10 N ATOM 328 NH2 ARG A 20 -1.471 11.126 -19.069 1.00 51.12 N ATOM 0 H ARG A 20 -5.351 15.956 -18.426 1.00 71.01 H new ATOM 0 HA ARG A 20 -3.374 17.345 -17.100 1.00 24.20 H new ATOM 0 HB2 ARG A 20 -3.636 15.775 -19.612 1.00 14.35 H new ATOM 0 HB3 ARG A 20 -2.259 16.857 -19.562 1.00 14.35 H new ATOM 0 HG2 ARG A 20 -1.878 15.769 -17.168 1.00 64.12 H new ATOM 0 HG3 ARG A 20 -2.864 14.477 -17.824 1.00 64.12 H new ATOM 0 HD2 ARG A 20 -0.757 15.408 -19.678 1.00 52.12 H new ATOM 0 HD3 ARG A 20 -0.128 14.758 -18.177 1.00 52.12 H new ATOM 0 HE ARG A 20 -1.352 13.266 -20.335 1.00 31.03 H new ATOM 0 HH11 ARG A 20 -0.935 13.378 -16.832 1.00 13.10 H new ATOM 0 HH12 ARG A 20 -1.127 11.633 -16.635 1.00 13.10 H new ATOM 0 HH21 ARG A 20 -1.601 11.023 -20.075 1.00 51.12 H new ATOM 0 HH22 ARG A 20 -1.503 10.305 -18.464 1.00 51.12 H new ATOM 342 N GLN A 21 -4.594 19.008 -19.636 1.00 33.24 N ATOM 343 CA GLN A 21 -4.605 20.306 -20.300 1.00 62.13 C ATOM 344 C GLN A 21 -5.007 21.411 -19.329 1.00 32.54 C ATOM 345 O GLN A 21 -4.421 22.494 -19.330 1.00 15.25 O ATOM 346 CB GLN A 21 -5.561 20.285 -21.492 1.00 31.45 C ATOM 347 CG GLN A 21 -6.988 19.916 -21.121 1.00 12.41 C ATOM 348 CD GLN A 21 -7.891 19.781 -22.331 1.00 73.14 C ATOM 349 OE1 GLN A 21 -8.647 18.816 -22.452 1.00 3.42 O ATOM 350 NE2 GLN A 21 -7.816 20.749 -23.236 1.00 2.12 N ATOM 0 H GLN A 21 -5.341 18.378 -19.928 1.00 33.24 H new ATOM 0 HA GLN A 21 -3.596 20.511 -20.657 1.00 62.13 H new ATOM 0 HB2 GLN A 21 -5.560 21.267 -21.965 1.00 31.45 H new ATOM 0 HB3 GLN A 21 -5.191 19.574 -22.231 1.00 31.45 H new ATOM 0 HG2 GLN A 21 -6.984 18.976 -20.569 1.00 12.41 H new ATOM 0 HG3 GLN A 21 -7.394 20.676 -20.453 1.00 12.41 H new ATOM 0 HE21 GLN A 21 -7.175 21.530 -23.095 1.00 2.12 H new ATOM 0 HE22 GLN A 21 -8.399 20.712 -24.072 1.00 2.12 H new ATOM 359 N GLN A 22 -6.008 21.130 -18.502 1.00 51.23 N ATOM 360 CA GLN A 22 -6.489 22.101 -17.527 1.00 0.45 C ATOM 361 C GLN A 22 -5.360 22.555 -16.609 1.00 51.31 C ATOM 362 O GLN A 22 -5.125 23.753 -16.441 1.00 43.21 O ATOM 363 CB GLN A 22 -7.627 21.502 -16.697 1.00 11.44 C ATOM 364 CG GLN A 22 -8.034 22.364 -15.513 1.00 2.14 C ATOM 365 CD GLN A 22 -8.573 23.716 -15.934 1.00 62.24 C ATOM 366 OE1 GLN A 22 -8.713 23.999 -17.123 1.00 71.22 O ATOM 367 NE2 GLN A 22 -8.879 24.562 -14.956 1.00 62.52 N ATOM 0 H GLN A 22 -6.502 20.238 -18.488 1.00 51.23 H new ATOM 0 HA GLN A 22 -6.863 22.969 -18.070 1.00 0.45 H new ATOM 0 HB2 GLN A 22 -8.494 21.350 -17.340 1.00 11.44 H new ATOM 0 HB3 GLN A 22 -7.323 20.520 -16.334 1.00 11.44 H new ATOM 0 HG2 GLN A 22 -8.792 21.840 -14.931 1.00 2.14 H new ATOM 0 HG3 GLN A 22 -7.173 22.508 -14.860 1.00 2.14 H new ATOM 0 HE21 GLN A 22 -8.747 24.286 -13.983 1.00 62.52 H new ATOM 0 HE22 GLN A 22 -9.246 25.487 -15.178 1.00 62.52 H new ATOM 376 N LEU A 23 -4.662 21.593 -16.015 1.00 1.25 N ATOM 377 CA LEU A 23 -3.556 21.894 -15.113 1.00 22.42 C ATOM 378 C LEU A 23 -2.372 22.476 -15.878 1.00 63.10 C ATOM 379 O LEU A 23 -1.736 23.428 -15.428 1.00 73.44 O ATOM 380 CB LEU A 23 -3.124 20.631 -14.366 1.00 64.12 C ATOM 381 CG LEU A 23 -1.721 20.658 -13.757 1.00 63.23 C ATOM 382 CD1 LEU A 23 -1.531 21.904 -12.907 1.00 72.12 C ATOM 383 CD2 LEU A 23 -1.473 19.404 -12.933 1.00 24.14 C ATOM 0 H LEU A 23 -4.843 20.597 -16.142 1.00 1.25 H new ATOM 0 HA LEU A 23 -3.899 22.636 -14.392 1.00 22.42 H new ATOM 0 HB2 LEU A 23 -3.841 20.442 -13.567 1.00 64.12 H new ATOM 0 HB3 LEU A 23 -3.184 19.788 -15.054 1.00 64.12 H new ATOM 0 HG LEU A 23 -0.994 20.684 -14.569 1.00 63.23 H new ATOM 0 HD11 LEU A 23 -0.527 21.905 -12.482 1.00 72.12 H new ATOM 0 HD12 LEU A 23 -1.664 22.791 -13.527 1.00 72.12 H new ATOM 0 HD13 LEU A 23 -2.266 21.911 -12.102 1.00 72.12 H new ATOM 0 HD21 LEU A 23 -0.470 19.441 -12.508 1.00 24.14 H new ATOM 0 HD22 LEU A 23 -2.206 19.346 -12.129 1.00 24.14 H new ATOM 0 HD23 LEU A 23 -1.564 18.525 -13.571 1.00 24.14 H new ATOM 395 N ALA A 24 -2.083 21.897 -17.040 1.00 40.14 N ATOM 396 CA ALA A 24 -0.978 22.360 -17.870 1.00 33.11 C ATOM 397 C ALA A 24 -1.122 23.843 -18.199 1.00 23.23 C ATOM 398 O ALA A 24 -0.138 24.523 -18.488 1.00 34.43 O ATOM 399 CB ALA A 24 -0.898 21.539 -19.149 1.00 43.12 C ATOM 0 H ALA A 24 -2.599 21.107 -17.427 1.00 40.14 H new ATOM 0 HA ALA A 24 -0.054 22.227 -17.308 1.00 33.11 H new ATOM 0 HB1 ALA A 24 -0.068 21.896 -19.759 1.00 43.12 H new ATOM 0 HB2 ALA A 24 -0.739 20.490 -18.899 1.00 43.12 H new ATOM 0 HB3 ALA A 24 -1.829 21.642 -19.706 1.00 43.12 H new ATOM 405 N ASP A 25 -2.356 24.336 -18.155 1.00 0.02 N ATOM 406 CA ASP A 25 -2.629 25.738 -18.448 1.00 72.22 C ATOM 407 C ASP A 25 -2.674 26.563 -17.166 1.00 62.10 C ATOM 408 O ASP A 25 -2.582 27.791 -17.201 1.00 11.21 O ATOM 409 CB ASP A 25 -3.952 25.874 -19.203 1.00 75.11 C ATOM 410 CG ASP A 25 -3.750 26.167 -20.677 1.00 52.02 C ATOM 411 OD1 ASP A 25 -3.620 25.204 -21.460 1.00 32.35 O ATOM 412 OD2 ASP A 25 -3.722 27.360 -21.046 1.00 73.30 O ATOM 0 H ASP A 25 -3.182 23.786 -17.919 1.00 0.02 H new ATOM 0 HA ASP A 25 -1.821 26.117 -19.074 1.00 72.22 H new ATOM 0 HB2 ASP A 25 -4.526 24.954 -19.094 1.00 75.11 H new ATOM 0 HB3 ASP A 25 -4.543 26.673 -18.754 1.00 75.11 H new ATOM 417 N LEU A 26 -2.815 25.880 -16.035 1.00 11.45 N ATOM 418 CA LEU A 26 -2.872 26.550 -14.740 1.00 42.33 C ATOM 419 C LEU A 26 -1.472 26.894 -14.242 1.00 31.40 C ATOM 420 O LEU A 26 -1.296 27.799 -13.425 1.00 63.25 O ATOM 421 CB LEU A 26 -3.586 25.664 -13.717 1.00 5.25 C ATOM 422 CG LEU A 26 -4.942 26.169 -13.223 1.00 72.31 C ATOM 423 CD1 LEU A 26 -6.048 25.201 -13.616 1.00 51.25 C ATOM 424 CD2 LEU A 26 -4.919 26.371 -11.715 1.00 64.15 C ATOM 0 H LEU A 26 -2.892 24.864 -15.988 1.00 11.45 H new ATOM 0 HA LEU A 26 -3.432 27.477 -14.863 1.00 42.33 H new ATOM 0 HB2 LEU A 26 -3.727 24.677 -14.157 1.00 5.25 H new ATOM 0 HB3 LEU A 26 -2.931 25.539 -12.855 1.00 5.25 H new ATOM 0 HG LEU A 26 -5.144 27.130 -13.695 1.00 72.31 H new ATOM 0 HD11 LEU A 26 -7.006 25.577 -13.256 1.00 51.25 H new ATOM 0 HD12 LEU A 26 -6.080 25.107 -14.701 1.00 51.25 H new ATOM 0 HD13 LEU A 26 -5.852 24.225 -13.173 1.00 51.25 H new ATOM 0 HD21 LEU A 26 -5.892 26.731 -11.381 1.00 64.15 H new ATOM 0 HD22 LEU A 26 -4.694 25.424 -11.224 1.00 64.15 H new ATOM 0 HD23 LEU A 26 -4.154 27.103 -11.458 1.00 64.15 H new ATOM 436 N THR A 27 -0.477 26.166 -14.740 1.00 4.14 N ATOM 437 CA THR A 27 0.907 26.394 -14.346 1.00 54.35 C ATOM 438 C THR A 27 1.776 26.720 -15.556 1.00 0.33 C ATOM 439 O THR A 27 2.994 26.848 -15.442 1.00 41.53 O ATOM 440 CB THR A 27 1.495 25.169 -13.622 1.00 71.31 C ATOM 441 OG1 THR A 27 1.741 24.116 -14.560 1.00 70.12 O ATOM 442 CG2 THR A 27 0.549 24.678 -12.536 1.00 31.12 C ATOM 0 H THR A 27 -0.605 25.414 -15.417 1.00 4.14 H new ATOM 0 HA THR A 27 0.905 27.243 -13.663 1.00 54.35 H new ATOM 0 HB THR A 27 2.435 25.466 -13.157 1.00 71.31 H new ATOM 0 HG1 THR A 27 1.219 23.326 -14.309 1.00 70.12 H new ATOM 0 HG21 THR A 27 0.985 23.812 -12.038 1.00 31.12 H new ATOM 0 HG22 THR A 27 0.388 25.473 -11.807 1.00 31.12 H new ATOM 0 HG23 THR A 27 -0.404 24.397 -12.984 1.00 31.12 H new ATOM 450 N GLY A 28 1.141 26.851 -16.717 1.00 71.14 N ATOM 451 CA GLY A 28 1.872 27.160 -17.932 1.00 55.42 C ATOM 452 C GLY A 28 2.752 26.013 -18.387 1.00 63.01 C ATOM 453 O GLY A 28 3.630 26.191 -19.231 1.00 24.43 O ATOM 0 H GLY A 28 0.133 26.749 -16.838 1.00 71.14 H new ATOM 0 HA2 GLY A 28 1.166 27.408 -18.724 1.00 55.42 H new ATOM 0 HA3 GLY A 28 2.489 28.043 -17.767 1.00 55.42 H new ATOM 457 N VAL A 29 2.517 24.830 -17.827 1.00 50.12 N ATOM 458 CA VAL A 29 3.294 23.649 -18.180 1.00 54.03 C ATOM 459 C VAL A 29 2.898 23.120 -19.554 1.00 24.12 C ATOM 460 O VAL A 29 1.720 23.058 -19.906 1.00 11.23 O ATOM 461 CB VAL A 29 3.116 22.527 -17.140 1.00 3.24 C ATOM 462 CG1 VAL A 29 3.198 21.163 -17.806 1.00 14.34 C ATOM 463 CG2 VAL A 29 4.155 22.655 -16.036 1.00 50.23 C ATOM 0 H VAL A 29 1.794 24.665 -17.127 1.00 50.12 H new ATOM 0 HA VAL A 29 4.340 23.954 -18.199 1.00 54.03 H new ATOM 0 HB VAL A 29 2.128 22.625 -16.691 1.00 3.24 H new ATOM 0 HG11 VAL A 29 3.070 20.383 -17.055 1.00 14.34 H new ATOM 0 HG12 VAL A 29 2.412 21.077 -18.556 1.00 14.34 H new ATOM 0 HG13 VAL A 29 4.171 21.050 -18.285 1.00 14.34 H new ATOM 0 HG21 VAL A 29 4.015 21.854 -15.310 1.00 50.23 H new ATOM 0 HG22 VAL A 29 5.154 22.584 -16.466 1.00 50.23 H new ATOM 0 HG23 VAL A 29 4.042 23.619 -15.540 1.00 50.23 H new ATOM 473 N PRO A 30 3.904 22.729 -20.350 1.00 5.34 N ATOM 474 CA PRO A 30 3.685 22.197 -21.699 1.00 54.13 C ATOM 475 C PRO A 30 3.034 20.819 -21.679 1.00 3.43 C ATOM 476 O PRO A 30 3.609 19.856 -21.171 1.00 5.21 O ATOM 477 CB PRO A 30 5.098 22.113 -22.280 1.00 44.23 C ATOM 478 CG PRO A 30 5.989 21.986 -21.094 1.00 71.13 C ATOM 479 CD PRO A 30 5.332 22.775 -19.995 1.00 14.15 C ATOM 0 HA PRO A 30 3.007 22.823 -22.280 1.00 54.13 H new ATOM 0 HB2 PRO A 30 5.202 21.257 -22.946 1.00 44.23 H new ATOM 0 HB3 PRO A 30 5.340 23.002 -22.863 1.00 44.23 H new ATOM 0 HG2 PRO A 30 6.109 20.942 -20.806 1.00 71.13 H new ATOM 0 HG3 PRO A 30 6.985 22.373 -21.311 1.00 71.13 H new ATOM 0 HD2 PRO A 30 5.517 22.332 -19.016 1.00 14.15 H new ATOM 0 HD3 PRO A 30 5.704 23.799 -19.957 1.00 14.15 H new ATOM 487 N TYR A 31 1.832 20.729 -22.237 1.00 25.44 N ATOM 488 CA TYR A 31 1.102 19.468 -22.282 1.00 32.30 C ATOM 489 C TYR A 31 1.900 18.402 -23.027 1.00 14.22 C ATOM 490 O TYR A 31 1.780 17.211 -22.746 1.00 34.33 O ATOM 491 CB TYR A 31 -0.257 19.665 -22.955 1.00 63.02 C ATOM 492 CG TYR A 31 -1.119 18.423 -22.956 1.00 1.51 C ATOM 493 CD1 TYR A 31 -0.903 17.404 -23.875 1.00 32.10 C ATOM 494 CD2 TYR A 31 -2.148 18.266 -22.035 1.00 12.33 C ATOM 495 CE1 TYR A 31 -1.689 16.268 -23.880 1.00 35.12 C ATOM 496 CE2 TYR A 31 -2.938 17.132 -22.031 1.00 62.12 C ATOM 497 CZ TYR A 31 -2.703 16.136 -22.956 1.00 32.41 C ATOM 498 OH TYR A 31 -3.488 15.005 -22.956 1.00 11.03 O ATOM 0 H TYR A 31 1.342 21.515 -22.665 1.00 25.44 H new ATOM 0 HA TYR A 31 0.948 19.131 -21.257 1.00 32.30 H new ATOM 0 HB2 TYR A 31 -0.792 20.467 -22.447 1.00 63.02 H new ATOM 0 HB3 TYR A 31 -0.100 19.989 -23.984 1.00 63.02 H new ATOM 0 HD1 TYR A 31 -0.107 17.502 -24.598 1.00 32.10 H new ATOM 0 HD2 TYR A 31 -2.334 19.044 -21.309 1.00 12.33 H new ATOM 0 HE1 TYR A 31 -1.510 15.487 -24.604 1.00 35.12 H new ATOM 0 HE2 TYR A 31 -3.734 17.026 -21.309 1.00 62.12 H new ATOM 0 HH TYR A 31 -4.155 15.070 -22.241 1.00 11.03 H new ATOM 508 N GLY A 32 2.719 18.843 -23.978 1.00 2.44 N ATOM 509 CA GLY A 32 3.526 17.915 -24.749 1.00 73.33 C ATOM 510 C GLY A 32 4.489 17.127 -23.883 1.00 15.40 C ATOM 511 O GLY A 32 4.809 15.976 -24.185 1.00 5.33 O ATOM 0 H GLY A 32 2.838 19.825 -24.228 1.00 2.44 H new ATOM 0 HA2 GLY A 32 2.872 17.224 -25.281 1.00 73.33 H new ATOM 0 HA3 GLY A 32 4.088 18.466 -25.503 1.00 73.33 H new ATOM 515 N THR A 33 4.955 17.747 -22.804 1.00 2.10 N ATOM 516 CA THR A 33 5.890 17.097 -21.893 1.00 33.22 C ATOM 517 C THR A 33 5.183 16.623 -20.627 1.00 41.20 C ATOM 518 O THR A 33 5.605 15.652 -19.997 1.00 25.30 O ATOM 519 CB THR A 33 7.041 18.042 -21.501 1.00 51.23 C ATOM 520 OG1 THR A 33 7.479 18.781 -22.646 1.00 63.51 O ATOM 521 CG2 THR A 33 8.209 17.260 -20.919 1.00 43.02 C ATOM 0 H THR A 33 4.701 18.699 -22.539 1.00 2.10 H new ATOM 0 HA THR A 33 6.301 16.237 -22.421 1.00 33.22 H new ATOM 0 HB THR A 33 6.673 18.732 -20.742 1.00 51.23 H new ATOM 0 HG1 THR A 33 8.210 19.381 -22.388 1.00 63.51 H new ATOM 0 HG21 THR A 33 9.010 17.949 -20.650 1.00 43.02 H new ATOM 0 HG22 THR A 33 7.880 16.721 -20.031 1.00 43.02 H new ATOM 0 HG23 THR A 33 8.576 16.549 -21.659 1.00 43.02 H new ATOM 529 N LEU A 34 4.109 17.313 -20.261 1.00 24.43 N ATOM 530 CA LEU A 34 3.344 16.961 -19.070 1.00 43.23 C ATOM 531 C LEU A 34 2.905 15.501 -19.116 1.00 50.10 C ATOM 532 O LEU A 34 2.913 14.808 -18.099 1.00 64.13 O ATOM 533 CB LEU A 34 2.120 17.870 -18.939 1.00 34.41 C ATOM 534 CG LEU A 34 1.142 17.520 -17.818 1.00 14.43 C ATOM 535 CD1 LEU A 34 1.716 17.914 -16.466 1.00 3.32 C ATOM 536 CD2 LEU A 34 -0.200 18.201 -18.049 1.00 12.32 C ATOM 0 H LEU A 34 3.748 18.119 -20.771 1.00 24.43 H new ATOM 0 HA LEU A 34 3.987 17.100 -18.201 1.00 43.23 H new ATOM 0 HB2 LEU A 34 2.466 18.892 -18.786 1.00 34.41 H new ATOM 0 HB3 LEU A 34 1.578 17.855 -19.885 1.00 34.41 H new ATOM 0 HG LEU A 34 0.985 16.441 -17.822 1.00 14.43 H new ATOM 0 HD11 LEU A 34 1.006 17.657 -15.680 1.00 3.32 H new ATOM 0 HD12 LEU A 34 2.651 17.380 -16.298 1.00 3.32 H new ATOM 0 HD13 LEU A 34 1.903 18.988 -16.449 1.00 3.32 H new ATOM 0 HD21 LEU A 34 -0.884 17.941 -17.241 1.00 12.32 H new ATOM 0 HD22 LEU A 34 -0.060 19.282 -18.072 1.00 12.32 H new ATOM 0 HD23 LEU A 34 -0.618 17.869 -18.999 1.00 12.32 H new ATOM 548 N SER A 35 2.524 15.040 -20.303 1.00 63.13 N ATOM 549 CA SER A 35 2.081 13.663 -20.482 1.00 73.31 C ATOM 550 C SER A 35 3.098 12.685 -19.903 1.00 51.22 C ATOM 551 O SER A 35 2.734 11.644 -19.354 1.00 50.40 O ATOM 552 CB SER A 35 1.858 13.365 -21.966 1.00 42.24 C ATOM 553 OG SER A 35 2.921 12.594 -22.497 1.00 24.01 O ATOM 0 H SER A 35 2.513 15.600 -21.155 1.00 63.13 H new ATOM 0 HA SER A 35 1.139 13.539 -19.948 1.00 73.31 H new ATOM 0 HB2 SER A 35 0.917 12.830 -22.095 1.00 42.24 H new ATOM 0 HB3 SER A 35 1.772 14.300 -22.519 1.00 42.24 H new ATOM 0 HG SER A 35 3.656 13.187 -22.759 1.00 24.01 H new ATOM 559 N TYR A 36 4.376 13.026 -20.029 1.00 24.31 N ATOM 560 CA TYR A 36 5.448 12.178 -19.522 1.00 24.32 C ATOM 561 C TYR A 36 5.740 12.489 -18.057 1.00 10.31 C ATOM 562 O TYR A 36 6.275 11.654 -17.328 1.00 72.52 O ATOM 563 CB TYR A 36 6.715 12.366 -20.358 1.00 60.32 C ATOM 564 CG TYR A 36 6.462 12.361 -21.848 1.00 21.33 C ATOM 565 CD1 TYR A 36 5.674 11.380 -22.436 1.00 33.34 C ATOM 566 CD2 TYR A 36 7.013 13.339 -22.668 1.00 21.51 C ATOM 567 CE1 TYR A 36 5.442 11.372 -23.798 1.00 14.13 C ATOM 568 CE2 TYR A 36 6.785 13.339 -24.032 1.00 11.33 C ATOM 569 CZ TYR A 36 5.999 12.353 -24.591 1.00 3.04 C ATOM 570 OH TYR A 36 5.770 12.349 -25.948 1.00 45.51 O ATOM 0 H TYR A 36 4.695 13.884 -20.478 1.00 24.31 H new ATOM 0 HA TYR A 36 5.123 11.140 -19.597 1.00 24.32 H new ATOM 0 HB2 TYR A 36 7.187 13.309 -20.081 1.00 60.32 H new ATOM 0 HB3 TYR A 36 7.422 11.573 -20.115 1.00 60.32 H new ATOM 0 HD1 TYR A 36 5.235 10.610 -21.818 1.00 33.34 H new ATOM 0 HD2 TYR A 36 7.629 14.112 -22.233 1.00 21.51 H new ATOM 0 HE1 TYR A 36 4.827 10.601 -24.239 1.00 14.13 H new ATOM 0 HE2 TYR A 36 7.220 14.106 -24.656 1.00 11.33 H new ATOM 0 HH TYR A 36 6.233 13.108 -26.360 1.00 45.51 H new ATOM 580 N TYR A 37 5.386 13.697 -17.633 1.00 54.21 N ATOM 581 CA TYR A 37 5.611 14.121 -16.256 1.00 5.01 C ATOM 582 C TYR A 37 4.781 13.286 -15.286 1.00 44.23 C ATOM 583 O TYR A 37 5.320 12.484 -14.524 1.00 51.30 O ATOM 584 CB TYR A 37 5.267 15.603 -16.094 1.00 11.33 C ATOM 585 CG TYR A 37 6.412 16.530 -16.436 1.00 63.44 C ATOM 586 CD1 TYR A 37 7.354 16.179 -17.394 1.00 74.01 C ATOM 587 CD2 TYR A 37 6.549 17.757 -15.799 1.00 44.14 C ATOM 588 CE1 TYR A 37 8.402 17.024 -17.708 1.00 44.51 C ATOM 589 CE2 TYR A 37 7.594 18.609 -16.108 1.00 1.34 C ATOM 590 CZ TYR A 37 8.517 18.237 -17.062 1.00 71.32 C ATOM 591 OH TYR A 37 9.558 19.082 -17.374 1.00 40.12 O ATOM 0 H TYR A 37 4.942 14.400 -18.223 1.00 54.21 H new ATOM 0 HA TYR A 37 6.666 13.972 -16.025 1.00 5.01 H new ATOM 0 HB2 TYR A 37 4.415 15.841 -16.730 1.00 11.33 H new ATOM 0 HB3 TYR A 37 4.957 15.785 -15.065 1.00 11.33 H new ATOM 0 HD1 TYR A 37 7.266 15.230 -17.902 1.00 74.01 H new ATOM 0 HD2 TYR A 37 5.828 18.050 -15.050 1.00 44.14 H new ATOM 0 HE1 TYR A 37 9.127 16.736 -18.455 1.00 44.51 H new ATOM 0 HE2 TYR A 37 7.686 19.560 -15.605 1.00 1.34 H new ATOM 0 HH TYR A 37 9.494 19.895 -16.831 1.00 40.12 H new ATOM 601 N GLU A 38 3.467 13.481 -15.322 1.00 3.11 N ATOM 602 CA GLU A 38 2.561 12.745 -14.446 1.00 5.14 C ATOM 603 C GLU A 38 2.668 11.243 -14.692 1.00 64.14 C ATOM 604 O GLU A 38 2.290 10.436 -13.842 1.00 41.42 O ATOM 605 CB GLU A 38 1.119 13.208 -14.663 1.00 45.31 C ATOM 606 CG GLU A 38 0.968 14.719 -14.732 1.00 24.31 C ATOM 607 CD GLU A 38 -0.218 15.224 -13.934 1.00 34.22 C ATOM 608 OE1 GLU A 38 -0.497 14.654 -12.859 1.00 25.54 O ATOM 609 OE2 GLU A 38 -0.869 16.189 -14.386 1.00 33.41 O ATOM 0 H GLU A 38 3.006 14.142 -15.947 1.00 3.11 H new ATOM 0 HA GLU A 38 2.848 12.948 -13.414 1.00 5.14 H new ATOM 0 HB2 GLU A 38 0.741 12.771 -15.587 1.00 45.31 H new ATOM 0 HB3 GLU A 38 0.498 12.826 -13.853 1.00 45.31 H new ATOM 0 HG2 GLU A 38 1.878 15.189 -14.359 1.00 24.31 H new ATOM 0 HG3 GLU A 38 0.856 15.022 -15.773 1.00 24.31 H new ATOM 616 N SER A 39 3.184 10.875 -15.860 1.00 60.13 N ATOM 617 CA SER A 39 3.336 9.471 -16.220 1.00 34.13 C ATOM 618 C SER A 39 4.550 8.861 -15.526 1.00 11.41 C ATOM 619 O SER A 39 4.687 7.641 -15.449 1.00 14.05 O ATOM 620 CB SER A 39 3.472 9.322 -17.736 1.00 51.23 C ATOM 621 OG SER A 39 2.200 9.263 -18.359 1.00 13.01 O ATOM 0 H SER A 39 3.504 11.530 -16.573 1.00 60.13 H new ATOM 0 HA SER A 39 2.444 8.938 -15.889 1.00 34.13 H new ATOM 0 HB2 SER A 39 4.039 10.162 -18.138 1.00 51.23 H new ATOM 0 HB3 SER A 39 4.036 8.418 -17.967 1.00 51.23 H new ATOM 0 HG SER A 39 1.994 10.131 -18.765 1.00 13.01 H new ATOM 627 N GLY A 40 5.431 9.721 -15.024 1.00 14.52 N ATOM 628 CA GLY A 40 6.623 9.249 -14.344 1.00 24.23 C ATOM 629 C GLY A 40 7.702 8.799 -15.310 1.00 45.11 C ATOM 630 O GLY A 40 8.625 8.080 -14.927 1.00 74.53 O ATOM 0 H GLY A 40 5.341 10.736 -15.076 1.00 14.52 H new ATOM 0 HA2 GLY A 40 7.015 10.045 -13.711 1.00 24.23 H new ATOM 0 HA3 GLY A 40 6.359 8.420 -13.687 1.00 24.23 H new ATOM 634 N ARG A 41 7.584 9.220 -16.564 1.00 4.24 N ATOM 635 CA ARG A 41 8.555 8.853 -17.587 1.00 13.35 C ATOM 636 C ARG A 41 9.934 9.418 -17.257 1.00 52.13 C ATOM 637 O ARG A 41 10.956 8.833 -17.613 1.00 61.34 O ATOM 638 CB ARG A 41 8.100 9.359 -18.957 1.00 40.30 C ATOM 639 CG ARG A 41 8.406 8.398 -20.095 1.00 52.51 C ATOM 640 CD ARG A 41 7.164 7.638 -20.532 1.00 42.11 C ATOM 641 NE ARG A 41 7.419 6.796 -21.698 1.00 62.55 N ATOM 642 CZ ARG A 41 8.003 5.605 -21.630 1.00 34.51 C ATOM 643 NH1 ARG A 41 8.390 5.118 -20.459 1.00 62.54 N ATOM 644 NH2 ARG A 41 8.200 4.898 -22.736 1.00 43.33 N ATOM 0 H ARG A 41 6.826 9.816 -16.896 1.00 4.24 H new ATOM 0 HA ARG A 41 8.624 7.765 -17.613 1.00 13.35 H new ATOM 0 HB2 ARG A 41 7.026 9.544 -18.928 1.00 40.30 H new ATOM 0 HB3 ARG A 41 8.583 10.315 -19.160 1.00 40.30 H new ATOM 0 HG2 ARG A 41 8.811 8.952 -20.942 1.00 52.51 H new ATOM 0 HG3 ARG A 41 9.174 7.692 -19.780 1.00 52.51 H new ATOM 0 HD2 ARG A 41 6.810 7.018 -19.708 1.00 42.11 H new ATOM 0 HD3 ARG A 41 6.368 8.346 -20.763 1.00 42.11 H new ATOM 0 HE ARG A 41 7.133 7.141 -22.614 1.00 62.55 H new ATOM 0 HH11 ARG A 41 8.239 5.658 -19.607 1.00 62.54 H new ATOM 0 HH12 ARG A 41 8.838 4.203 -20.410 1.00 62.54 H new ATOM 0 HH21 ARG A 41 7.903 5.269 -23.638 1.00 43.33 H new ATOM 0 HH22 ARG A 41 8.649 3.983 -22.684 1.00 43.33 H new ATOM 658 N SER A 42 9.951 10.559 -16.576 1.00 70.41 N ATOM 659 CA SER A 42 11.204 11.205 -16.201 1.00 61.23 C ATOM 660 C SER A 42 10.987 12.185 -15.052 1.00 5.23 C ATOM 661 O SER A 42 10.064 13.001 -15.080 1.00 13.14 O ATOM 662 CB SER A 42 11.804 11.938 -17.403 1.00 24.10 C ATOM 663 OG SER A 42 13.093 11.437 -17.713 1.00 12.30 O ATOM 0 H SER A 42 9.113 11.055 -16.273 1.00 70.41 H new ATOM 0 HA SER A 42 11.898 10.432 -15.871 1.00 61.23 H new ATOM 0 HB2 SER A 42 11.149 11.825 -18.267 1.00 24.10 H new ATOM 0 HB3 SER A 42 11.867 13.005 -17.188 1.00 24.10 H new ATOM 0 HG SER A 42 13.455 11.920 -18.485 1.00 12.30 H new ATOM 669 N THR A 43 11.844 12.098 -14.040 1.00 12.02 N ATOM 670 CA THR A 43 11.747 12.974 -12.879 1.00 14.23 C ATOM 671 C THR A 43 11.901 14.437 -13.279 1.00 53.01 C ATOM 672 O THR A 43 12.967 14.881 -13.705 1.00 0.33 O ATOM 673 CB THR A 43 12.815 12.629 -11.823 1.00 21.52 C ATOM 674 OG1 THR A 43 13.493 11.422 -12.189 1.00 2.04 O ATOM 675 CG2 THR A 43 12.184 12.466 -10.449 1.00 51.25 C ATOM 0 H THR A 43 12.613 11.430 -14.001 1.00 12.02 H new ATOM 0 HA THR A 43 10.757 12.819 -12.449 1.00 14.23 H new ATOM 0 HB THR A 43 13.532 13.449 -11.781 1.00 21.52 H new ATOM 0 HG1 THR A 43 14.181 11.623 -12.857 1.00 2.04 H new ATOM 0 HG21 THR A 43 12.957 12.223 -9.720 1.00 51.25 H new ATOM 0 HG22 THR A 43 11.694 13.396 -10.161 1.00 51.25 H new ATOM 0 HG23 THR A 43 11.448 11.662 -10.479 1.00 51.25 H new ATOM 683 N PRO A 44 10.810 15.207 -13.142 1.00 21.02 N ATOM 684 CA PRO A 44 10.799 16.632 -13.483 1.00 52.42 C ATOM 685 C PRO A 44 11.631 17.467 -12.516 1.00 70.25 C ATOM 686 O PRO A 44 12.039 17.003 -11.450 1.00 3.54 O ATOM 687 CB PRO A 44 9.320 17.010 -13.380 1.00 71.00 C ATOM 688 CG PRO A 44 8.742 16.022 -12.427 1.00 72.24 C ATOM 689 CD PRO A 44 9.505 14.745 -12.641 1.00 61.30 C ATOM 0 HA PRO A 44 11.234 16.819 -14.465 1.00 52.42 H new ATOM 0 HB2 PRO A 44 9.197 18.030 -13.016 1.00 71.00 H new ATOM 0 HB3 PRO A 44 8.829 16.957 -14.352 1.00 71.00 H new ATOM 0 HG2 PRO A 44 8.841 16.368 -11.398 1.00 72.24 H new ATOM 0 HG3 PRO A 44 7.678 15.877 -12.613 1.00 72.24 H new ATOM 0 HD2 PRO A 44 9.608 14.178 -11.716 1.00 61.30 H new ATOM 0 HD3 PRO A 44 9.006 14.094 -13.359 1.00 61.30 H new ATOM 697 N PRO A 45 11.890 18.727 -12.891 1.00 71.15 N ATOM 698 CA PRO A 45 12.675 19.654 -12.070 1.00 45.31 C ATOM 699 C PRO A 45 11.934 20.079 -10.807 1.00 45.42 C ATOM 700 O PRO A 45 10.796 19.668 -10.574 1.00 14.40 O ATOM 701 CB PRO A 45 12.888 20.855 -12.995 1.00 13.01 C ATOM 702 CG PRO A 45 11.747 20.805 -13.950 1.00 51.14 C ATOM 703 CD PRO A 45 11.435 19.347 -14.148 1.00 25.43 C ATOM 0 HA PRO A 45 13.602 19.201 -11.717 1.00 45.31 H new ATOM 0 HB2 PRO A 45 12.894 21.790 -12.435 1.00 13.01 H new ATOM 0 HB3 PRO A 45 13.843 20.789 -13.516 1.00 13.01 H new ATOM 0 HG2 PRO A 45 10.883 21.338 -13.554 1.00 51.14 H new ATOM 0 HG3 PRO A 45 12.009 21.280 -14.896 1.00 51.14 H new ATOM 0 HD2 PRO A 45 10.370 19.183 -14.315 1.00 25.43 H new ATOM 0 HD3 PRO A 45 11.960 18.937 -15.011 1.00 25.43 H new ATOM 711 N THR A 46 12.584 20.906 -9.994 1.00 13.11 N ATOM 712 CA THR A 46 11.988 21.386 -8.754 1.00 31.11 C ATOM 713 C THR A 46 11.217 22.682 -8.981 1.00 24.32 C ATOM 714 O THR A 46 10.238 22.962 -8.290 1.00 10.01 O ATOM 715 CB THR A 46 13.056 21.619 -7.670 1.00 23.32 C ATOM 716 OG1 THR A 46 13.807 20.419 -7.456 1.00 51.14 O ATOM 717 CG2 THR A 46 12.413 22.060 -6.363 1.00 20.13 C ATOM 0 H THR A 46 13.525 21.258 -10.173 1.00 13.11 H new ATOM 0 HA THR A 46 11.300 20.612 -8.413 1.00 31.11 H new ATOM 0 HB THR A 46 13.724 22.409 -8.013 1.00 23.32 H new ATOM 0 HG1 THR A 46 14.227 20.142 -8.297 1.00 51.14 H new ATOM 0 HG21 THR A 46 13.187 22.219 -5.612 1.00 20.13 H new ATOM 0 HG22 THR A 46 11.866 22.989 -6.522 1.00 20.13 H new ATOM 0 HG23 THR A 46 11.725 21.288 -6.018 1.00 20.13 H new ATOM 725 N ASP A 47 11.665 23.468 -9.953 1.00 42.22 N ATOM 726 CA ASP A 47 11.017 24.735 -10.272 1.00 11.00 C ATOM 727 C ASP A 47 9.611 24.504 -10.817 1.00 64.31 C ATOM 728 O ASP A 47 8.707 25.310 -10.593 1.00 65.11 O ATOM 729 CB ASP A 47 11.849 25.516 -11.291 1.00 53.22 C ATOM 730 CG ASP A 47 11.573 25.085 -12.717 1.00 65.03 C ATOM 731 OD1 ASP A 47 12.119 24.044 -13.139 1.00 21.44 O ATOM 732 OD2 ASP A 47 10.810 25.787 -13.412 1.00 61.13 O ATOM 0 H ASP A 47 12.475 23.250 -10.534 1.00 42.22 H new ATOM 0 HA ASP A 47 10.941 25.317 -9.353 1.00 11.00 H new ATOM 0 HB2 ASP A 47 11.637 26.580 -11.189 1.00 53.22 H new ATOM 0 HB3 ASP A 47 12.908 25.379 -11.072 1.00 53.22 H new ATOM 737 N VAL A 48 9.433 23.397 -11.533 1.00 60.11 N ATOM 738 CA VAL A 48 8.137 23.060 -12.109 1.00 45.24 C ATOM 739 C VAL A 48 7.299 22.241 -11.135 1.00 11.34 C ATOM 740 O VAL A 48 6.114 22.510 -10.940 1.00 1.53 O ATOM 741 CB VAL A 48 8.296 22.271 -13.422 1.00 14.52 C ATOM 742 CG1 VAL A 48 6.936 21.860 -13.966 1.00 74.34 C ATOM 743 CG2 VAL A 48 9.062 23.093 -14.447 1.00 62.30 C ATOM 0 H VAL A 48 10.170 22.719 -11.727 1.00 60.11 H new ATOM 0 HA VAL A 48 7.628 24.001 -12.318 1.00 45.24 H new ATOM 0 HB VAL A 48 8.867 21.366 -13.215 1.00 14.52 H new ATOM 0 HG11 VAL A 48 7.068 21.304 -14.894 1.00 74.34 H new ATOM 0 HG12 VAL A 48 6.427 21.231 -13.235 1.00 74.34 H new ATOM 0 HG13 VAL A 48 6.337 22.750 -14.159 1.00 74.34 H new ATOM 0 HG21 VAL A 48 9.165 22.520 -15.369 1.00 62.30 H new ATOM 0 HG22 VAL A 48 8.520 24.016 -14.652 1.00 62.30 H new ATOM 0 HG23 VAL A 48 10.051 23.332 -14.056 1.00 62.30 H new ATOM 753 N MET A 49 7.923 21.240 -10.523 1.00 23.51 N ATOM 754 CA MET A 49 7.234 20.382 -9.565 1.00 32.02 C ATOM 755 C MET A 49 6.455 21.213 -8.551 1.00 43.12 C ATOM 756 O MET A 49 5.270 20.978 -8.322 1.00 54.11 O ATOM 757 CB MET A 49 8.237 19.481 -8.842 1.00 51.33 C ATOM 758 CG MET A 49 7.614 18.641 -7.739 1.00 21.11 C ATOM 759 SD MET A 49 8.406 18.896 -6.140 1.00 71.53 S ATOM 760 CE MET A 49 7.536 20.348 -5.557 1.00 52.32 C ATOM 0 H MET A 49 8.904 21.003 -10.673 1.00 23.51 H new ATOM 0 HA MET A 49 6.528 19.760 -10.115 1.00 32.02 H new ATOM 0 HB2 MET A 49 8.709 18.820 -9.569 1.00 51.33 H new ATOM 0 HB3 MET A 49 9.026 20.099 -8.415 1.00 51.33 H new ATOM 0 HG2 MET A 49 6.554 18.883 -7.658 1.00 21.11 H new ATOM 0 HG3 MET A 49 7.680 17.587 -8.009 1.00 21.11 H new ATOM 0 HE1 MET A 49 7.426 20.296 -4.474 1.00 52.32 H new ATOM 0 HE2 MET A 49 8.101 21.242 -5.822 1.00 52.32 H new ATOM 0 HE3 MET A 49 6.550 20.392 -6.020 1.00 52.32 H new ATOM 770 N MET A 50 7.131 22.186 -7.947 1.00 13.33 N ATOM 771 CA MET A 50 6.501 23.053 -6.958 1.00 63.34 C ATOM 772 C MET A 50 5.446 23.942 -7.608 1.00 13.15 C ATOM 773 O MET A 50 4.469 24.331 -6.968 1.00 31.51 O ATOM 774 CB MET A 50 7.554 23.917 -6.262 1.00 63.11 C ATOM 775 CG MET A 50 8.050 25.075 -7.113 1.00 51.43 C ATOM 776 SD MET A 50 9.603 25.764 -6.511 1.00 41.12 S ATOM 777 CE MET A 50 9.318 25.749 -4.742 1.00 52.14 C ATOM 0 H MET A 50 8.114 22.393 -8.125 1.00 13.33 H new ATOM 0 HA MET A 50 6.012 22.421 -6.217 1.00 63.34 H new ATOM 0 HB2 MET A 50 7.135 24.311 -5.336 1.00 63.11 H new ATOM 0 HB3 MET A 50 8.402 23.290 -5.986 1.00 63.11 H new ATOM 0 HG2 MET A 50 8.182 24.735 -8.140 1.00 51.43 H new ATOM 0 HG3 MET A 50 7.292 25.858 -7.131 1.00 51.43 H new ATOM 0 HE1 MET A 50 10.058 26.379 -4.249 1.00 52.14 H new ATOM 0 HE2 MET A 50 8.319 26.130 -4.531 1.00 52.14 H new ATOM 0 HE3 MET A 50 9.403 24.729 -4.368 1.00 52.14 H new ATOM 787 N ASN A 51 5.648 24.259 -8.882 1.00 65.21 N ATOM 788 CA ASN A 51 4.714 25.103 -9.618 1.00 34.45 C ATOM 789 C ASN A 51 3.375 24.396 -9.808 1.00 20.22 C ATOM 790 O ASN A 51 2.372 25.025 -10.147 1.00 30.14 O ATOM 791 CB ASN A 51 5.300 25.483 -10.979 1.00 31.11 C ATOM 792 CG ASN A 51 5.895 26.878 -10.984 1.00 2.32 C ATOM 793 OD1 ASN A 51 6.687 27.187 -9.964 1.00 22.00 O flip ATOM 794 ND2 ASN A 51 5.646 27.668 -11.895 1.00 22.11 N flip ATOM 0 H ASN A 51 6.451 23.944 -9.427 1.00 65.21 H new ATOM 0 HA ASN A 51 4.547 26.009 -9.036 1.00 34.45 H new ATOM 0 HB2 ASN A 51 6.070 24.762 -11.254 1.00 31.11 H new ATOM 0 HB3 ASN A 51 4.520 25.421 -11.737 1.00 31.11 H new ATOM 0 HD21 ASN A 51 5.032 27.388 -12.659 1.00 22.11 H new ATOM 0 HD22 ASN A 51 6.054 28.603 -11.885 1.00 22.11 H new ATOM 801 N ILE A 52 3.368 23.087 -9.586 1.00 3.55 N ATOM 802 CA ILE A 52 2.153 22.295 -9.731 1.00 73.42 C ATOM 803 C ILE A 52 1.387 22.217 -8.415 1.00 71.13 C ATOM 804 O ILE A 52 0.156 22.255 -8.396 1.00 32.44 O ATOM 805 CB ILE A 52 2.466 20.866 -10.214 1.00 62.11 C ATOM 806 CG1 ILE A 52 3.401 20.907 -11.425 1.00 74.14 C ATOM 807 CG2 ILE A 52 1.180 20.128 -10.556 1.00 33.12 C ATOM 808 CD1 ILE A 52 3.076 22.016 -12.401 1.00 62.23 C ATOM 0 H ILE A 52 4.190 22.552 -9.305 1.00 3.55 H new ATOM 0 HA ILE A 52 1.538 22.796 -10.478 1.00 73.42 H new ATOM 0 HB ILE A 52 2.967 20.328 -9.409 1.00 62.11 H new ATOM 0 HG12 ILE A 52 4.427 21.028 -11.078 1.00 74.14 H new ATOM 0 HG13 ILE A 52 3.352 19.950 -11.945 1.00 74.14 H new ATOM 0 HG21 ILE A 52 1.418 19.120 -10.896 1.00 33.12 H new ATOM 0 HG22 ILE A 52 0.546 20.072 -9.671 1.00 33.12 H new ATOM 0 HG23 ILE A 52 0.653 20.662 -11.347 1.00 33.12 H new ATOM 0 HD11 ILE A 52 3.778 21.985 -13.234 1.00 62.23 H new ATOM 0 HD12 ILE A 52 2.061 21.884 -12.777 1.00 62.23 H new ATOM 0 HD13 ILE A 52 3.154 22.979 -11.896 1.00 62.23 H new ATOM 820 N LEU A 53 2.123 22.111 -7.314 1.00 51.45 N ATOM 821 CA LEU A 53 1.514 22.030 -5.991 1.00 74.54 C ATOM 822 C LEU A 53 1.178 23.419 -5.460 1.00 34.01 C ATOM 823 O LEU A 53 0.219 23.593 -4.709 1.00 42.22 O ATOM 824 CB LEU A 53 2.453 21.313 -5.018 1.00 74.22 C ATOM 825 CG LEU A 53 2.024 19.912 -4.582 1.00 41.43 C ATOM 826 CD1 LEU A 53 1.597 19.085 -5.785 1.00 53.22 C ATOM 827 CD2 LEU A 53 3.152 19.219 -3.831 1.00 13.23 C ATOM 0 H LEU A 53 3.142 22.079 -7.311 1.00 51.45 H new ATOM 0 HA LEU A 53 0.588 21.461 -6.079 1.00 74.54 H new ATOM 0 HB2 LEU A 53 3.438 21.243 -5.480 1.00 74.22 H new ATOM 0 HB3 LEU A 53 2.562 21.932 -4.127 1.00 74.22 H new ATOM 0 HG LEU A 53 1.170 20.007 -3.911 1.00 41.43 H new ATOM 0 HD11 LEU A 53 1.295 18.091 -5.455 1.00 53.22 H new ATOM 0 HD12 LEU A 53 0.758 19.572 -6.282 1.00 53.22 H new ATOM 0 HD13 LEU A 53 2.431 18.998 -6.481 1.00 53.22 H new ATOM 0 HD21 LEU A 53 2.829 18.223 -3.528 1.00 13.23 H new ATOM 0 HD22 LEU A 53 4.024 19.136 -4.480 1.00 13.23 H new ATOM 0 HD23 LEU A 53 3.412 19.801 -2.947 1.00 13.23 H new ATOM 839 N GLN A 54 1.973 24.407 -5.858 1.00 35.22 N ATOM 840 CA GLN A 54 1.759 25.783 -5.424 1.00 5.24 C ATOM 841 C GLN A 54 0.370 26.270 -5.824 1.00 40.02 C ATOM 842 O GLN A 54 -0.179 27.186 -5.212 1.00 11.30 O ATOM 843 CB GLN A 54 2.826 26.701 -6.021 1.00 13.40 C ATOM 844 CG GLN A 54 2.633 26.974 -7.504 1.00 75.21 C ATOM 845 CD GLN A 54 3.566 28.050 -8.025 1.00 20.35 C ATOM 846 OE1 GLN A 54 4.832 27.978 -7.632 1.00 45.45 O flip ATOM 847 NE2 GLN A 54 3.152 28.936 -8.774 1.00 73.44 N flip ATOM 0 H GLN A 54 2.771 24.280 -6.480 1.00 35.22 H new ATOM 0 HA GLN A 54 1.835 25.810 -4.337 1.00 5.24 H new ATOM 0 HB2 GLN A 54 2.821 27.648 -5.482 1.00 13.40 H new ATOM 0 HB3 GLN A 54 3.807 26.252 -5.867 1.00 13.40 H new ATOM 0 HG2 GLN A 54 2.798 26.053 -8.064 1.00 75.21 H new ATOM 0 HG3 GLN A 54 1.601 27.275 -7.683 1.00 75.21 H new ATOM 0 HE21 GLN A 54 2.170 28.953 -9.051 1.00 73.44 H new ATOM 0 HE22 GLN A 54 3.791 29.653 -9.118 1.00 73.44 H new ATOM 856 N THR A 55 -0.194 25.651 -6.857 1.00 23.53 N ATOM 857 CA THR A 55 -1.517 26.022 -7.340 1.00 24.25 C ATOM 858 C THR A 55 -2.549 25.959 -6.220 1.00 71.25 C ATOM 859 O THR A 55 -2.421 25.191 -5.266 1.00 30.33 O ATOM 860 CB THR A 55 -1.971 25.107 -8.492 1.00 54.30 C ATOM 861 OG1 THR A 55 -2.187 23.777 -8.007 1.00 42.52 O ATOM 862 CG2 THR A 55 -0.936 25.083 -9.605 1.00 51.14 C ATOM 0 H THR A 55 0.246 24.890 -7.375 1.00 23.53 H new ATOM 0 HA THR A 55 -1.444 27.046 -7.706 1.00 24.25 H new ATOM 0 HB THR A 55 -2.904 25.503 -8.893 1.00 54.30 H new ATOM 0 HG1 THR A 55 -1.370 23.248 -8.127 1.00 42.52 H new ATOM 0 HG21 THR A 55 -1.279 24.430 -10.407 1.00 51.14 H new ATOM 0 HG22 THR A 55 -0.796 26.092 -9.993 1.00 51.14 H new ATOM 0 HG23 THR A 55 0.011 24.710 -9.214 1.00 51.14 H new ATOM 870 N PRO A 56 -3.600 26.786 -6.335 1.00 53.52 N ATOM 871 CA PRO A 56 -4.676 26.842 -5.341 1.00 12.33 C ATOM 872 C PRO A 56 -5.539 25.584 -5.349 1.00 31.34 C ATOM 873 O PRO A 56 -6.127 25.219 -4.332 1.00 43.31 O ATOM 874 CB PRO A 56 -5.498 28.058 -5.776 1.00 41.51 C ATOM 875 CG PRO A 56 -5.235 28.190 -7.236 1.00 31.12 C ATOM 876 CD PRO A 56 -3.819 27.728 -7.445 1.00 2.04 C ATOM 0 HA PRO A 56 -4.289 26.914 -4.325 1.00 12.33 H new ATOM 0 HB2 PRO A 56 -6.559 27.910 -5.577 1.00 41.51 H new ATOM 0 HB3 PRO A 56 -5.194 28.955 -5.236 1.00 41.51 H new ATOM 0 HG2 PRO A 56 -5.933 27.584 -7.815 1.00 31.12 H new ATOM 0 HG3 PRO A 56 -5.361 29.222 -7.564 1.00 31.12 H new ATOM 0 HD2 PRO A 56 -3.693 27.244 -8.413 1.00 2.04 H new ATOM 0 HD3 PRO A 56 -3.116 28.560 -7.411 1.00 2.04 H new ATOM 884 N GLN A 57 -5.609 24.928 -6.503 1.00 54.13 N ATOM 885 CA GLN A 57 -6.401 23.712 -6.642 1.00 35.45 C ATOM 886 C GLN A 57 -5.691 22.524 -6.003 1.00 15.23 C ATOM 887 O GLN A 57 -6.332 21.607 -5.488 1.00 55.15 O ATOM 888 CB GLN A 57 -6.676 23.423 -8.119 1.00 31.22 C ATOM 889 CG GLN A 57 -5.484 22.831 -8.855 1.00 70.00 C ATOM 890 CD GLN A 57 -5.596 22.977 -10.359 1.00 22.24 C ATOM 891 OE1 GLN A 57 -4.632 23.341 -11.032 1.00 74.05 O ATOM 892 NE2 GLN A 57 -6.778 22.693 -10.896 1.00 50.03 N ATOM 0 H GLN A 57 -5.127 25.218 -7.354 1.00 54.13 H new ATOM 0 HA GLN A 57 -7.349 23.865 -6.127 1.00 35.45 H new ATOM 0 HB2 GLN A 57 -7.518 22.735 -8.195 1.00 31.22 H new ATOM 0 HB3 GLN A 57 -6.974 24.348 -8.612 1.00 31.22 H new ATOM 0 HG2 GLN A 57 -4.572 23.320 -8.513 1.00 70.00 H new ATOM 0 HG3 GLN A 57 -5.394 21.775 -8.602 1.00 70.00 H new ATOM 0 HE21 GLN A 57 -7.550 22.395 -10.300 1.00 50.03 H new ATOM 0 HE22 GLN A 57 -6.913 22.773 -11.904 1.00 50.03 H new ATOM 901 N PHE A 58 -4.363 22.545 -6.040 1.00 44.33 N ATOM 902 CA PHE A 58 -3.565 21.469 -5.464 1.00 12.11 C ATOM 903 C PHE A 58 -2.911 21.912 -4.158 1.00 32.20 C ATOM 904 O PHE A 58 -1.887 21.368 -3.746 1.00 14.11 O ATOM 905 CB PHE A 58 -2.491 21.015 -6.456 1.00 65.32 C ATOM 906 CG PHE A 58 -3.051 20.369 -7.691 1.00 64.12 C ATOM 907 CD1 PHE A 58 -3.964 19.332 -7.593 1.00 14.53 C ATOM 908 CD2 PHE A 58 -2.664 20.799 -8.950 1.00 54.23 C ATOM 909 CE1 PHE A 58 -4.480 18.735 -8.728 1.00 51.05 C ATOM 910 CE2 PHE A 58 -3.177 20.207 -10.089 1.00 13.32 C ATOM 911 CZ PHE A 58 -4.087 19.175 -9.977 1.00 14.14 C ATOM 0 H PHE A 58 -3.817 23.295 -6.463 1.00 44.33 H new ATOM 0 HA PHE A 58 -4.231 20.633 -5.250 1.00 12.11 H new ATOM 0 HB2 PHE A 58 -1.889 21.876 -6.747 1.00 65.32 H new ATOM 0 HB3 PHE A 58 -1.822 20.312 -5.959 1.00 65.32 H new ATOM 0 HD1 PHE A 58 -4.276 18.986 -6.619 1.00 14.53 H new ATOM 0 HD2 PHE A 58 -1.953 21.607 -9.043 1.00 54.23 H new ATOM 0 HE1 PHE A 58 -5.189 17.926 -8.638 1.00 51.05 H new ATOM 0 HE2 PHE A 58 -2.866 20.551 -11.064 1.00 13.32 H new ATOM 0 HZ PHE A 58 -4.491 18.712 -10.865 1.00 14.14 H new ATOM 921 N THR A 59 -3.512 22.907 -3.512 1.00 4.20 N ATOM 922 CA THR A 59 -2.990 23.427 -2.254 1.00 22.31 C ATOM 923 C THR A 59 -3.271 22.468 -1.104 1.00 21.11 C ATOM 924 O THR A 59 -2.486 22.364 -0.162 1.00 21.14 O ATOM 925 CB THR A 59 -3.596 24.803 -1.920 1.00 62.34 C ATOM 926 OG1 THR A 59 -2.958 25.351 -0.762 1.00 4.22 O ATOM 927 CG2 THR A 59 -5.093 24.691 -1.676 1.00 32.12 C ATOM 0 H THR A 59 -4.361 23.369 -3.839 1.00 4.20 H new ATOM 0 HA THR A 59 -1.912 23.534 -2.379 1.00 22.31 H new ATOM 0 HB THR A 59 -3.432 25.464 -2.771 1.00 62.34 H new ATOM 0 HG1 THR A 59 -3.348 26.226 -0.557 1.00 4.22 H new ATOM 0 HG21 THR A 59 -5.498 25.675 -1.442 1.00 32.12 H new ATOM 0 HG22 THR A 59 -5.579 24.302 -2.570 1.00 32.12 H new ATOM 0 HG23 THR A 59 -5.276 24.015 -0.840 1.00 32.12 H new ATOM 935 N LYS A 60 -4.397 21.766 -1.187 1.00 35.52 N ATOM 936 CA LYS A 60 -4.781 20.812 -0.153 1.00 52.53 C ATOM 937 C LYS A 60 -3.910 19.562 -0.214 1.00 41.24 C ATOM 938 O LYS A 60 -3.973 18.706 0.668 1.00 22.22 O ATOM 939 CB LYS A 60 -6.255 20.428 -0.308 1.00 75.42 C ATOM 940 CG LYS A 60 -7.154 21.599 -0.666 1.00 41.34 C ATOM 941 CD LYS A 60 -8.622 21.251 -0.483 1.00 60.34 C ATOM 942 CE LYS A 60 -9.130 20.369 -1.613 1.00 4.52 C ATOM 943 NZ LYS A 60 -9.782 19.132 -1.099 1.00 64.02 N ATOM 0 H LYS A 60 -5.059 21.840 -1.959 1.00 35.52 H new ATOM 0 HA LYS A 60 -4.635 21.287 0.817 1.00 52.53 H new ATOM 0 HB2 LYS A 60 -6.343 19.664 -1.080 1.00 75.42 H new ATOM 0 HB3 LYS A 60 -6.606 19.983 0.623 1.00 75.42 H new ATOM 0 HG2 LYS A 60 -6.902 22.457 -0.042 1.00 41.34 H new ATOM 0 HG3 LYS A 60 -6.975 21.894 -1.700 1.00 41.34 H new ATOM 0 HD2 LYS A 60 -8.760 20.739 0.470 1.00 60.34 H new ATOM 0 HD3 LYS A 60 -9.212 22.167 -0.441 1.00 60.34 H new ATOM 0 HE2 LYS A 60 -9.841 20.929 -2.220 1.00 4.52 H new ATOM 0 HE3 LYS A 60 -8.299 20.098 -2.264 1.00 4.52 H new ATOM 0 HZ1 LYS A 60 -9.277 18.298 -1.461 1.00 64.02 H new ATOM 0 HZ2 LYS A 60 -9.753 19.131 -0.059 1.00 64.02 H new ATOM 0 HZ3 LYS A 60 -10.772 19.103 -1.418 1.00 64.02 H new ATOM 957 N TYR A 61 -3.099 19.462 -1.262 1.00 14.05 N ATOM 958 CA TYR A 61 -2.216 18.316 -1.438 1.00 71.14 C ATOM 959 C TYR A 61 -0.792 18.768 -1.747 1.00 30.13 C ATOM 960 O TYR A 61 -0.324 18.657 -2.881 1.00 60.54 O ATOM 961 CB TYR A 61 -2.732 17.417 -2.562 1.00 71.25 C ATOM 962 CG TYR A 61 -4.239 17.418 -2.695 1.00 2.03 C ATOM 963 CD1 TYR A 61 -4.886 18.355 -3.489 1.00 71.04 C ATOM 964 CD2 TYR A 61 -5.015 16.478 -2.026 1.00 2.40 C ATOM 965 CE1 TYR A 61 -6.262 18.360 -3.612 1.00 44.31 C ATOM 966 CE2 TYR A 61 -6.392 16.475 -2.144 1.00 73.23 C ATOM 967 CZ TYR A 61 -7.010 17.418 -2.938 1.00 4.15 C ATOM 968 OH TYR A 61 -8.380 17.418 -3.060 1.00 1.43 O ATOM 0 H TYR A 61 -3.035 20.161 -2.002 1.00 14.05 H new ATOM 0 HA TYR A 61 -2.205 17.751 -0.506 1.00 71.14 H new ATOM 0 HB2 TYR A 61 -2.292 17.740 -3.505 1.00 71.25 H new ATOM 0 HB3 TYR A 61 -2.392 16.397 -2.385 1.00 71.25 H new ATOM 0 HD1 TYR A 61 -4.303 19.093 -4.020 1.00 71.04 H new ATOM 0 HD2 TYR A 61 -4.534 15.738 -1.404 1.00 2.40 H new ATOM 0 HE1 TYR A 61 -6.749 19.098 -4.233 1.00 44.31 H new ATOM 0 HE2 TYR A 61 -6.981 15.738 -1.617 1.00 73.23 H new ATOM 0 HH TYR A 61 -8.756 16.690 -2.523 1.00 1.43 H new ATOM 978 N THR A 62 -0.107 19.278 -0.729 1.00 71.44 N ATOM 979 CA THR A 62 1.264 19.747 -0.889 1.00 10.10 C ATOM 980 C THR A 62 2.255 18.781 -0.249 1.00 71.52 C ATOM 981 O THR A 62 3.163 18.278 -0.912 1.00 70.23 O ATOM 982 CB THR A 62 1.456 21.145 -0.270 1.00 54.41 C ATOM 983 OG1 THR A 62 0.183 21.771 -0.073 1.00 54.14 O ATOM 984 CG2 THR A 62 2.323 22.019 -1.165 1.00 32.11 C ATOM 0 H THR A 62 -0.479 19.377 0.216 1.00 71.44 H new ATOM 0 HA THR A 62 1.455 19.802 -1.961 1.00 10.10 H new ATOM 0 HB THR A 62 1.957 21.028 0.691 1.00 54.41 H new ATOM 0 HG1 THR A 62 0.313 22.658 0.322 1.00 54.14 H new ATOM 0 HG21 THR A 62 2.444 23.001 -0.707 1.00 32.11 H new ATOM 0 HG22 THR A 62 3.301 21.554 -1.291 1.00 32.11 H new ATOM 0 HG23 THR A 62 1.846 22.129 -2.139 1.00 32.11 H new ATOM 992 N LEU A 63 2.074 18.526 1.041 1.00 70.40 N ATOM 993 CA LEU A 63 2.953 17.618 1.772 1.00 22.45 C ATOM 994 C LEU A 63 2.201 16.362 2.203 1.00 21.32 C ATOM 995 O LEU A 63 2.780 15.456 2.802 1.00 24.35 O ATOM 996 CB LEU A 63 3.540 18.320 2.997 1.00 14.53 C ATOM 997 CG LEU A 63 2.739 18.192 4.292 1.00 33.33 C ATOM 998 CD1 LEU A 63 3.293 17.069 5.155 1.00 44.54 C ATOM 999 CD2 LEU A 63 2.748 19.508 5.057 1.00 34.14 C ATOM 0 H LEU A 63 1.327 18.934 1.603 1.00 70.40 H new ATOM 0 HA LEU A 63 3.765 17.323 1.107 1.00 22.45 H new ATOM 0 HB2 LEU A 63 4.541 17.925 3.172 1.00 14.53 H new ATOM 0 HB3 LEU A 63 3.651 19.379 2.765 1.00 14.53 H new ATOM 0 HG LEU A 63 1.708 17.950 4.035 1.00 33.33 H new ATOM 0 HD11 LEU A 63 2.710 16.994 6.073 1.00 44.54 H new ATOM 0 HD12 LEU A 63 3.234 16.127 4.609 1.00 44.54 H new ATOM 0 HD13 LEU A 63 4.333 17.280 5.403 1.00 44.54 H new ATOM 0 HD21 LEU A 63 2.173 19.398 5.976 1.00 34.14 H new ATOM 0 HD22 LEU A 63 3.775 19.780 5.302 1.00 34.14 H new ATOM 0 HD23 LEU A 63 2.303 20.290 4.442 1.00 34.14 H new ATOM 1011 N TRP A 64 0.911 16.315 1.892 1.00 4.53 N ATOM 1012 CA TRP A 64 0.081 15.169 2.246 1.00 50.12 C ATOM 1013 C TRP A 64 0.708 13.870 1.753 1.00 52.11 C ATOM 1014 O TRP A 64 0.454 12.799 2.304 1.00 52.14 O ATOM 1015 CB TRP A 64 -1.322 15.329 1.657 1.00 45.11 C ATOM 1016 CG TRP A 64 -1.500 14.625 0.346 1.00 5.32 C ATOM 1017 CD1 TRP A 64 -2.317 13.560 0.092 1.00 25.31 C ATOM 1018 CD2 TRP A 64 -0.842 14.931 -0.888 1.00 40.31 C ATOM 1019 NE1 TRP A 64 -2.209 13.189 -1.227 1.00 23.33 N ATOM 1020 CE2 TRP A 64 -1.311 14.014 -1.850 1.00 24.22 C ATOM 1021 CE3 TRP A 64 0.094 15.894 -1.276 1.00 53.41 C ATOM 1022 CZ2 TRP A 64 -0.872 14.033 -3.171 1.00 70.32 C ATOM 1023 CZ3 TRP A 64 0.528 15.911 -2.587 1.00 55.11 C ATOM 1024 CH2 TRP A 64 0.045 14.985 -3.523 1.00 13.15 C ATOM 0 H TRP A 64 0.417 17.057 1.396 1.00 4.53 H new ATOM 0 HA TRP A 64 0.009 15.125 3.333 1.00 50.12 H new ATOM 0 HB2 TRP A 64 -2.053 14.946 2.369 1.00 45.11 H new ATOM 0 HB3 TRP A 64 -1.533 16.390 1.523 1.00 45.11 H new ATOM 0 HD1 TRP A 64 -2.954 13.080 0.820 1.00 25.31 H new ATOM 0 HE1 TRP A 64 -2.716 12.423 -1.670 1.00 23.33 H new ATOM 0 HE3 TRP A 64 0.471 16.612 -0.563 1.00 53.41 H new ATOM 0 HZ2 TRP A 64 -1.243 13.321 -3.893 1.00 70.32 H new ATOM 0 HZ3 TRP A 64 1.252 16.650 -2.897 1.00 55.11 H new ATOM 0 HH2 TRP A 64 0.404 15.024 -4.541 1.00 13.15 H new ATOM 1035 N PHE A 65 1.528 13.972 0.713 1.00 21.42 N ATOM 1036 CA PHE A 65 2.191 12.803 0.145 1.00 54.41 C ATOM 1037 C PHE A 65 3.708 12.972 0.172 1.00 55.14 C ATOM 1038 O PHE A 65 4.450 11.993 0.235 1.00 43.01 O ATOM 1039 CB PHE A 65 1.718 12.569 -1.290 1.00 0.51 C ATOM 1040 CG PHE A 65 0.802 11.387 -1.434 1.00 35.13 C ATOM 1041 CD1 PHE A 65 -0.159 11.118 -0.474 1.00 1.23 C ATOM 1042 CD2 PHE A 65 0.903 10.545 -2.531 1.00 72.04 C ATOM 1043 CE1 PHE A 65 -1.004 10.031 -0.603 1.00 74.41 C ATOM 1044 CE2 PHE A 65 0.061 9.458 -2.666 1.00 63.43 C ATOM 1045 CZ PHE A 65 -0.893 9.200 -1.701 1.00 12.20 C ATOM 0 H PHE A 65 1.750 14.851 0.246 1.00 21.42 H new ATOM 0 HA PHE A 65 1.928 11.937 0.752 1.00 54.41 H new ATOM 0 HB2 PHE A 65 1.204 13.462 -1.645 1.00 0.51 H new ATOM 0 HB3 PHE A 65 2.587 12.425 -1.932 1.00 0.51 H new ATOM 0 HD1 PHE A 65 -0.250 11.765 0.386 1.00 1.23 H new ATOM 0 HD2 PHE A 65 1.648 10.741 -3.288 1.00 72.04 H new ATOM 0 HE1 PHE A 65 -1.749 9.832 0.153 1.00 74.41 H new ATOM 0 HE2 PHE A 65 0.149 8.810 -3.526 1.00 63.43 H new ATOM 0 HZ PHE A 65 -1.551 8.350 -1.805 1.00 12.20 H new ATOM 1055 N MET A 66 4.159 14.221 0.123 1.00 21.31 N ATOM 1056 CA MET A 66 5.586 14.519 0.141 1.00 54.24 C ATOM 1057 C MET A 66 6.258 13.888 1.357 1.00 62.12 C ATOM 1058 O MET A 66 7.403 13.441 1.286 1.00 43.23 O ATOM 1059 CB MET A 66 5.814 16.032 0.147 1.00 0.42 C ATOM 1060 CG MET A 66 7.027 16.468 -0.657 1.00 60.21 C ATOM 1061 SD MET A 66 8.121 17.558 0.272 1.00 74.33 S ATOM 1062 CE MET A 66 8.905 16.389 1.378 1.00 12.21 C ATOM 0 H MET A 66 3.557 15.043 0.071 1.00 21.31 H new ATOM 0 HA MET A 66 6.031 14.095 -0.759 1.00 54.24 H new ATOM 0 HB2 MET A 66 4.928 16.526 -0.251 1.00 0.42 H new ATOM 0 HB3 MET A 66 5.931 16.369 1.177 1.00 0.42 H new ATOM 0 HG2 MET A 66 7.583 15.586 -0.975 1.00 60.21 H new ATOM 0 HG3 MET A 66 6.695 16.978 -1.561 1.00 60.21 H new ATOM 0 HE1 MET A 66 8.622 16.615 2.406 1.00 12.21 H new ATOM 0 HE2 MET A 66 8.583 15.378 1.127 1.00 12.21 H new ATOM 0 HE3 MET A 66 9.988 16.461 1.275 1.00 12.21 H new ATOM 1072 N THR A 67 5.537 13.852 2.473 1.00 35.53 N ATOM 1073 CA THR A 67 6.063 13.277 3.705 1.00 25.30 C ATOM 1074 C THR A 67 5.062 12.316 4.334 1.00 54.02 C ATOM 1075 O THR A 67 5.284 11.801 5.430 1.00 4.44 O ATOM 1076 CB THR A 67 6.420 14.371 4.729 1.00 34.44 C ATOM 1077 OG1 THR A 67 7.089 15.456 4.074 1.00 54.41 O ATOM 1078 CG2 THR A 67 7.309 13.813 5.831 1.00 3.14 C ATOM 0 H THR A 67 4.587 14.214 2.549 1.00 35.53 H new ATOM 0 HA THR A 67 6.968 12.731 3.437 1.00 25.30 H new ATOM 0 HB THR A 67 5.495 14.732 5.178 1.00 34.44 H new ATOM 0 HG1 THR A 67 7.311 16.148 4.731 1.00 54.41 H new ATOM 0 HG21 THR A 67 7.548 14.604 6.542 1.00 3.14 H new ATOM 0 HG22 THR A 67 6.787 13.007 6.347 1.00 3.14 H new ATOM 0 HG23 THR A 67 8.230 13.427 5.395 1.00 3.14 H new ATOM 1086 N ASN A 68 3.957 12.076 3.634 1.00 30.33 N ATOM 1087 CA ASN A 68 2.921 11.175 4.125 1.00 74.32 C ATOM 1088 C ASN A 68 2.298 11.712 5.410 1.00 52.13 C ATOM 1089 O ASN A 68 2.134 10.979 6.384 1.00 64.53 O ATOM 1090 CB ASN A 68 3.503 9.781 4.371 1.00 33.53 C ATOM 1091 CG ASN A 68 4.535 9.393 3.331 1.00 60.54 C ATOM 1092 OD1 ASN A 68 4.223 9.264 2.148 1.00 41.20 O ATOM 1093 ND2 ASN A 68 5.776 9.207 3.770 1.00 22.32 N ATOM 0 H ASN A 68 3.757 12.493 2.725 1.00 30.33 H new ATOM 0 HA ASN A 68 2.143 11.108 3.365 1.00 74.32 H new ATOM 0 HB2 ASN A 68 3.959 9.750 5.360 1.00 33.53 H new ATOM 0 HB3 ASN A 68 2.696 9.048 4.369 1.00 33.53 H new ATOM 0 HD21 ASN A 68 6.514 8.946 3.116 1.00 22.32 H new ATOM 0 HD22 ASN A 68 5.990 9.325 4.760 1.00 22.32 H new ATOM 1100 N GLN A 69 1.952 12.995 5.401 1.00 44.34 N ATOM 1101 CA GLN A 69 1.346 13.630 6.566 1.00 22.34 C ATOM 1102 C GLN A 69 0.270 14.625 6.145 1.00 11.24 C ATOM 1103 O GLN A 69 0.568 15.666 5.559 1.00 12.43 O ATOM 1104 CB GLN A 69 2.414 14.339 7.400 1.00 24.40 C ATOM 1105 CG GLN A 69 1.867 15.001 8.655 1.00 53.41 C ATOM 1106 CD GLN A 69 1.742 14.035 9.816 1.00 3.24 C ATOM 1107 OE1 GLN A 69 2.724 13.429 10.245 1.00 30.13 O ATOM 1108 NE2 GLN A 69 0.527 13.886 10.333 1.00 3.22 N ATOM 0 H GLN A 69 2.081 13.615 4.601 1.00 44.34 H new ATOM 0 HA GLN A 69 0.880 12.852 7.171 1.00 22.34 H new ATOM 0 HB2 GLN A 69 3.179 13.617 7.684 1.00 24.40 H new ATOM 0 HB3 GLN A 69 2.902 15.095 6.784 1.00 24.40 H new ATOM 0 HG2 GLN A 69 2.521 15.825 8.941 1.00 53.41 H new ATOM 0 HG3 GLN A 69 0.889 15.431 8.438 1.00 53.41 H new ATOM 0 HE21 GLN A 69 -0.259 14.408 9.946 1.00 3.22 H new ATOM 0 HE22 GLN A 69 0.381 13.249 11.116 1.00 3.22 H new ATOM 1117 N ILE A 70 -0.982 14.298 6.448 1.00 53.02 N ATOM 1118 CA ILE A 70 -2.103 15.163 6.101 1.00 1.12 C ATOM 1119 C ILE A 70 -2.252 16.299 7.107 1.00 5.32 C ATOM 1120 O ILE A 70 -2.333 16.067 8.314 1.00 35.42 O ATOM 1121 CB ILE A 70 -3.423 14.374 6.035 1.00 22.12 C ATOM 1122 CG1 ILE A 70 -3.664 13.628 7.349 1.00 23.30 C ATOM 1123 CG2 ILE A 70 -3.403 13.402 4.864 1.00 74.23 C ATOM 1124 CD1 ILE A 70 -4.871 14.123 8.114 1.00 41.24 C ATOM 0 H ILE A 70 -1.245 13.440 6.933 1.00 53.02 H new ATOM 0 HA ILE A 70 -1.888 15.579 5.116 1.00 1.12 H new ATOM 0 HB ILE A 70 -4.241 15.078 5.883 1.00 22.12 H new ATOM 0 HG12 ILE A 70 -3.789 12.566 7.137 1.00 23.30 H new ATOM 0 HG13 ILE A 70 -2.780 13.725 7.979 1.00 23.30 H new ATOM 0 HG21 ILE A 70 -4.344 12.852 4.832 1.00 74.23 H new ATOM 0 HG22 ILE A 70 -3.274 13.955 3.934 1.00 74.23 H new ATOM 0 HG23 ILE A 70 -2.577 12.701 4.987 1.00 74.23 H new ATOM 0 HD11 ILE A 70 -4.980 13.548 9.034 1.00 41.24 H new ATOM 0 HD12 ILE A 70 -4.740 15.177 8.358 1.00 41.24 H new ATOM 0 HD13 ILE A 70 -5.765 14.001 7.502 1.00 41.24 H new ATOM 1136 N ALA A 71 -2.289 17.528 6.603 1.00 53.21 N ATOM 1137 CA ALA A 71 -2.433 18.700 7.458 1.00 71.32 C ATOM 1138 C ALA A 71 -3.771 19.391 7.221 1.00 23.44 C ATOM 1139 O ALA A 71 -3.849 20.451 6.601 1.00 55.01 O ATOM 1140 CB ALA A 71 -1.286 19.671 7.217 1.00 72.44 C ATOM 0 H ALA A 71 -2.221 17.738 5.607 1.00 53.21 H new ATOM 0 HA ALA A 71 -2.404 18.369 8.496 1.00 71.32 H new ATOM 0 HB1 ALA A 71 -1.405 20.542 7.861 1.00 72.44 H new ATOM 0 HB2 ALA A 71 -0.340 19.179 7.443 1.00 72.44 H new ATOM 0 HB3 ALA A 71 -1.291 19.988 6.174 1.00 72.44 H new ATOM 1146 N PRO A 72 -4.852 18.777 7.727 1.00 32.32 N ATOM 1147 CA PRO A 72 -6.207 19.315 7.583 1.00 40.23 C ATOM 1148 C PRO A 72 -6.419 20.580 8.408 1.00 33.14 C ATOM 1149 O PRO A 72 -7.296 21.389 8.106 1.00 11.03 O ATOM 1150 CB PRO A 72 -7.096 18.182 8.103 1.00 14.40 C ATOM 1151 CG PRO A 72 -6.225 17.416 9.038 1.00 21.53 C ATOM 1152 CD PRO A 72 -4.833 17.510 8.477 1.00 55.43 C ATOM 0 HA PRO A 72 -6.423 19.607 6.555 1.00 40.23 H new ATOM 0 HB2 PRO A 72 -7.977 18.572 8.613 1.00 14.40 H new ATOM 0 HB3 PRO A 72 -7.452 17.552 7.288 1.00 14.40 H new ATOM 0 HG2 PRO A 72 -6.270 17.834 10.044 1.00 21.53 H new ATOM 0 HG3 PRO A 72 -6.548 16.377 9.110 1.00 21.53 H new ATOM 0 HD2 PRO A 72 -4.082 17.522 9.267 1.00 55.43 H new ATOM 0 HD3 PRO A 72 -4.603 16.664 7.830 1.00 55.43 H new ATOM 1160 N GLU A 73 -5.609 20.744 9.450 1.00 23.32 N ATOM 1161 CA GLU A 73 -5.711 21.911 10.318 1.00 5.13 C ATOM 1162 C GLU A 73 -5.583 23.202 9.513 1.00 20.24 C ATOM 1163 O GLU A 73 -6.082 24.251 9.918 1.00 42.23 O ATOM 1164 CB GLU A 73 -4.629 21.864 11.400 1.00 31.42 C ATOM 1165 CG GLU A 73 -4.604 20.559 12.179 1.00 1.34 C ATOM 1166 CD GLU A 73 -3.887 20.689 13.509 1.00 12.40 C ATOM 1167 OE1 GLU A 73 -4.381 21.436 14.379 1.00 62.13 O ATOM 1168 OE2 GLU A 73 -2.832 20.042 13.680 1.00 50.44 O ATOM 0 H GLU A 73 -4.876 20.085 9.713 1.00 23.32 H new ATOM 0 HA GLU A 73 -6.692 21.895 10.792 1.00 5.13 H new ATOM 0 HB2 GLU A 73 -3.655 22.019 10.935 1.00 31.42 H new ATOM 0 HB3 GLU A 73 -4.785 22.689 12.095 1.00 31.42 H new ATOM 0 HG2 GLU A 73 -5.627 20.224 12.353 1.00 1.34 H new ATOM 0 HG3 GLU A 73 -4.114 19.791 11.580 1.00 1.34 H new ATOM 1175 N SER A 74 -4.912 23.114 8.369 1.00 3.44 N ATOM 1176 CA SER A 74 -4.715 24.274 7.507 1.00 51.31 C ATOM 1177 C SER A 74 -5.539 24.148 6.231 1.00 0.10 C ATOM 1178 O SER A 74 -5.880 25.147 5.597 1.00 72.23 O ATOM 1179 CB SER A 74 -3.234 24.431 7.158 1.00 74.54 C ATOM 1180 OG SER A 74 -2.432 23.544 7.921 1.00 24.41 O ATOM 0 H SER A 74 -4.496 22.252 8.017 1.00 3.44 H new ATOM 0 HA SER A 74 -5.049 25.159 8.049 1.00 51.31 H new ATOM 0 HB2 SER A 74 -3.085 24.238 6.096 1.00 74.54 H new ATOM 0 HB3 SER A 74 -2.921 25.459 7.342 1.00 74.54 H new ATOM 0 HG SER A 74 -1.724 23.173 7.354 1.00 24.41 H new ATOM 1186 N GLY A 75 -5.857 22.913 5.857 1.00 44.22 N ATOM 1187 CA GLY A 75 -6.639 22.678 4.657 1.00 41.33 C ATOM 1188 C GLY A 75 -5.956 21.725 3.697 1.00 61.32 C ATOM 1189 O GLY A 75 -6.115 21.838 2.482 1.00 21.02 O ATOM 0 H GLY A 75 -5.587 22.070 6.364 1.00 44.22 H new ATOM 0 HA2 GLY A 75 -7.612 22.273 4.935 1.00 41.33 H new ATOM 0 HA3 GLY A 75 -6.821 23.628 4.154 1.00 41.33 H new ATOM 1193 N GLN A 76 -5.191 20.785 4.243 1.00 43.44 N ATOM 1194 CA GLN A 76 -4.479 19.810 3.425 1.00 71.34 C ATOM 1195 C GLN A 76 -4.875 18.387 3.805 1.00 22.20 C ATOM 1196 O GLN A 76 -4.706 17.971 4.951 1.00 15.14 O ATOM 1197 CB GLN A 76 -2.968 19.989 3.580 1.00 1.44 C ATOM 1198 CG GLN A 76 -2.416 21.184 2.819 1.00 0.22 C ATOM 1199 CD GLN A 76 -2.496 22.472 3.615 1.00 70.30 C ATOM 1200 OE1 GLN A 76 -2.305 22.476 4.831 1.00 4.14 O ATOM 1201 NE2 GLN A 76 -2.781 23.574 2.931 1.00 55.24 N ATOM 0 H GLN A 76 -5.048 20.678 5.247 1.00 43.44 H new ATOM 0 HA GLN A 76 -4.753 19.978 2.384 1.00 71.34 H new ATOM 0 HB2 GLN A 76 -2.730 20.101 4.638 1.00 1.44 H new ATOM 0 HB3 GLN A 76 -2.466 19.085 3.235 1.00 1.44 H new ATOM 0 HG2 GLN A 76 -1.377 20.991 2.551 1.00 0.22 H new ATOM 0 HG3 GLN A 76 -2.968 21.303 1.887 1.00 0.22 H new ATOM 0 HE21 GLN A 76 -2.932 23.524 1.923 1.00 55.24 H new ATOM 0 HE22 GLN A 76 -2.849 24.470 3.413 1.00 55.24 H new ATOM 1210 N ILE A 77 -5.403 17.647 2.837 1.00 35.21 N ATOM 1211 CA ILE A 77 -5.823 16.270 3.070 1.00 50.55 C ATOM 1212 C ILE A 77 -5.566 15.402 1.844 1.00 25.22 C ATOM 1213 O ILE A 77 -5.127 15.892 0.803 1.00 5.00 O ATOM 1214 CB ILE A 77 -7.316 16.192 3.437 1.00 45.42 C ATOM 1215 CG1 ILE A 77 -8.180 16.330 2.182 1.00 11.52 C ATOM 1216 CG2 ILE A 77 -7.670 17.269 4.451 1.00 62.31 C ATOM 1217 CD1 ILE A 77 -7.962 17.628 1.438 1.00 65.21 C ATOM 0 H ILE A 77 -5.551 17.977 1.883 1.00 35.21 H new ATOM 0 HA ILE A 77 -5.232 15.897 3.906 1.00 50.55 H new ATOM 0 HB ILE A 77 -7.514 15.219 3.886 1.00 45.42 H new ATOM 0 HG12 ILE A 77 -7.969 15.497 1.512 1.00 11.52 H new ATOM 0 HG13 ILE A 77 -9.230 16.254 2.464 1.00 11.52 H new ATOM 0 HG21 ILE A 77 -8.729 17.200 4.700 1.00 62.31 H new ATOM 0 HG22 ILE A 77 -7.075 17.129 5.354 1.00 62.31 H new ATOM 0 HG23 ILE A 77 -7.460 18.251 4.027 1.00 62.31 H new ATOM 0 HD11 ILE A 77 -8.607 17.657 0.560 1.00 65.21 H new ATOM 0 HD12 ILE A 77 -8.201 18.467 2.092 1.00 65.21 H new ATOM 0 HD13 ILE A 77 -6.920 17.698 1.125 1.00 65.21 H new ATOM 1229 N ALA A 78 -5.843 14.108 1.973 1.00 44.32 N ATOM 1230 CA ALA A 78 -5.645 13.171 0.874 1.00 35.42 C ATOM 1231 C ALA A 78 -6.937 12.967 0.088 1.00 61.12 C ATOM 1232 O ALA A 78 -8.032 12.916 0.648 1.00 40.31 O ATOM 1233 CB ALA A 78 -5.132 11.840 1.402 1.00 72.54 C ATOM 0 H ALA A 78 -6.205 13.685 2.828 1.00 44.32 H new ATOM 0 HA ALA A 78 -4.901 13.593 0.198 1.00 35.42 H new ATOM 0 HB1 ALA A 78 -4.989 11.150 0.571 1.00 72.54 H new ATOM 0 HB2 ALA A 78 -4.182 11.993 1.914 1.00 72.54 H new ATOM 0 HB3 ALA A 78 -5.857 11.422 2.100 1.00 72.54 H new ATOM 1239 N PRO A 79 -6.808 12.850 -1.242 1.00 45.11 N ATOM 1240 CA PRO A 79 -7.955 12.650 -2.133 1.00 73.10 C ATOM 1241 C PRO A 79 -8.580 11.269 -1.973 1.00 74.34 C ATOM 1242 O PRO A 79 -8.251 10.532 -1.044 1.00 72.43 O ATOM 1243 CB PRO A 79 -7.348 12.804 -3.531 1.00 3.43 C ATOM 1244 CG PRO A 79 -5.911 12.449 -3.361 1.00 4.55 C ATOM 1245 CD PRO A 79 -5.533 12.902 -1.978 1.00 54.14 C ATOM 0 HA PRO A 79 -8.762 13.352 -1.923 1.00 73.10 H new ATOM 0 HB2 PRO A 79 -7.836 12.145 -4.249 1.00 3.43 H new ATOM 0 HB3 PRO A 79 -7.463 13.822 -3.903 1.00 3.43 H new ATOM 0 HG2 PRO A 79 -5.758 11.376 -3.475 1.00 4.55 H new ATOM 0 HG3 PRO A 79 -5.296 12.941 -4.114 1.00 4.55 H new ATOM 0 HD2 PRO A 79 -4.784 12.248 -1.531 1.00 54.14 H new ATOM 0 HD3 PRO A 79 -5.114 13.908 -1.985 1.00 54.14 H new ATOM 1253 N ALA A 80 -9.482 10.923 -2.887 1.00 1.11 N ATOM 1254 CA ALA A 80 -10.151 9.629 -2.847 1.00 34.34 C ATOM 1255 C ALA A 80 -9.372 8.584 -3.641 1.00 51.31 C ATOM 1256 O ALA A 80 -9.516 7.382 -3.412 1.00 70.35 O ATOM 1257 CB ALA A 80 -11.570 9.752 -3.383 1.00 63.50 C ATOM 0 H ALA A 80 -9.765 11.521 -3.663 1.00 1.11 H new ATOM 0 HA ALA A 80 -10.194 9.301 -1.808 1.00 34.34 H new ATOM 0 HB1 ALA A 80 -12.058 8.778 -3.347 1.00 63.50 H new ATOM 0 HB2 ALA A 80 -12.129 10.461 -2.772 1.00 63.50 H new ATOM 0 HB3 ALA A 80 -11.540 10.105 -4.414 1.00 63.50 H new ATOM 1263 N LEU A 81 -8.550 9.050 -4.574 1.00 5.22 N ATOM 1264 CA LEU A 81 -7.749 8.155 -5.403 1.00 2.43 C ATOM 1265 C LEU A 81 -6.430 7.814 -4.718 1.00 54.42 C ATOM 1266 O LEU A 81 -5.840 6.764 -4.972 1.00 41.41 O ATOM 1267 CB LEU A 81 -7.479 8.795 -6.766 1.00 34.21 C ATOM 1268 CG LEU A 81 -8.712 9.213 -7.567 1.00 32.21 C ATOM 1269 CD1 LEU A 81 -8.972 10.703 -7.408 1.00 11.43 C ATOM 1270 CD2 LEU A 81 -8.542 8.854 -9.035 1.00 41.44 C ATOM 0 H LEU A 81 -8.420 10.041 -4.776 1.00 5.22 H new ATOM 0 HA LEU A 81 -8.311 7.233 -5.547 1.00 2.43 H new ATOM 0 HB2 LEU A 81 -6.854 9.675 -6.614 1.00 34.21 H new ATOM 0 HB3 LEU A 81 -6.901 8.093 -7.367 1.00 34.21 H new ATOM 0 HG LEU A 81 -9.574 8.671 -7.179 1.00 32.21 H new ATOM 0 HD11 LEU A 81 -9.853 10.982 -7.985 1.00 11.43 H new ATOM 0 HD12 LEU A 81 -9.140 10.933 -6.356 1.00 11.43 H new ATOM 0 HD13 LEU A 81 -8.110 11.263 -7.769 1.00 11.43 H new ATOM 0 HD21 LEU A 81 -9.430 9.159 -9.589 1.00 41.44 H new ATOM 0 HD22 LEU A 81 -7.669 9.368 -9.437 1.00 41.44 H new ATOM 0 HD23 LEU A 81 -8.406 7.777 -9.133 1.00 41.44 H new ATOM 1282 N ALA A 82 -5.973 8.708 -3.846 1.00 61.40 N ATOM 1283 CA ALA A 82 -4.726 8.499 -3.121 1.00 42.42 C ATOM 1284 C ALA A 82 -4.704 7.132 -2.448 1.00 41.25 C ATOM 1285 O ALA A 82 -3.729 6.388 -2.559 1.00 1.31 O ATOM 1286 CB ALA A 82 -4.523 9.601 -2.092 1.00 60.33 C ATOM 0 H ALA A 82 -6.448 9.583 -3.625 1.00 61.40 H new ATOM 0 HA ALA A 82 -3.907 8.533 -3.839 1.00 42.42 H new ATOM 0 HB1 ALA A 82 -3.588 9.432 -1.558 1.00 60.33 H new ATOM 0 HB2 ALA A 82 -4.484 10.567 -2.596 1.00 60.33 H new ATOM 0 HB3 ALA A 82 -5.352 9.595 -1.384 1.00 60.33 H new ATOM 1292 N HIS A 83 -5.785 6.806 -1.747 1.00 52.44 N ATOM 1293 CA HIS A 83 -5.891 5.526 -1.054 1.00 62.14 C ATOM 1294 C HIS A 83 -4.826 5.408 0.033 1.00 43.04 C ATOM 1295 O HIS A 83 -4.522 4.311 0.501 1.00 74.24 O ATOM 1296 CB HIS A 83 -5.753 4.371 -2.047 1.00 52.01 C ATOM 1297 CG HIS A 83 -7.010 3.577 -2.220 1.00 71.45 C ATOM 1298 ND1 HIS A 83 -7.447 2.649 -1.298 1.00 72.31 N ATOM 1299 CD2 HIS A 83 -7.927 3.577 -3.215 1.00 33.10 C ATOM 1300 CE1 HIS A 83 -8.578 2.111 -1.719 1.00 41.15 C ATOM 1301 NE2 HIS A 83 -8.892 2.657 -2.880 1.00 35.44 N ATOM 0 H HIS A 83 -6.600 7.410 -1.643 1.00 52.44 H new ATOM 0 HA HIS A 83 -6.873 5.475 -0.584 1.00 62.14 H new ATOM 0 HB2 HIS A 83 -5.448 4.769 -3.015 1.00 52.01 H new ATOM 0 HB3 HIS A 83 -4.957 3.707 -1.711 1.00 52.01 H new ATOM 0 HD2 HIS A 83 -7.905 4.186 -4.106 1.00 33.10 H new ATOM 0 HE1 HIS A 83 -9.149 1.354 -1.202 1.00 41.15 H new ATOM 0 HE2 HIS A 83 -9.716 2.433 -3.437 1.00 35.44 H new ATOM 1309 N PHE A 84 -4.263 6.545 0.429 1.00 61.54 N ATOM 1310 CA PHE A 84 -3.231 6.569 1.459 1.00 21.02 C ATOM 1311 C PHE A 84 -3.779 7.137 2.764 1.00 45.34 C ATOM 1312 O PHE A 84 -3.963 6.412 3.742 1.00 11.55 O ATOM 1313 CB PHE A 84 -2.033 7.398 0.991 1.00 72.42 C ATOM 1314 CG PHE A 84 -0.770 6.599 0.851 1.00 14.02 C ATOM 1315 CD1 PHE A 84 -0.689 5.560 -0.062 1.00 20.34 C ATOM 1316 CD2 PHE A 84 0.339 6.887 1.631 1.00 43.32 C ATOM 1317 CE1 PHE A 84 0.473 4.822 -0.195 1.00 14.32 C ATOM 1318 CE2 PHE A 84 1.503 6.154 1.503 1.00 15.34 C ATOM 1319 CZ PHE A 84 1.569 5.119 0.590 1.00 4.42 C ATOM 0 H PHE A 84 -4.504 7.462 0.052 1.00 61.54 H new ATOM 0 HA PHE A 84 -2.907 5.544 1.638 1.00 21.02 H new ATOM 0 HB2 PHE A 84 -2.271 7.857 0.032 1.00 72.42 H new ATOM 0 HB3 PHE A 84 -1.864 8.209 1.699 1.00 72.42 H new ATOM 0 HD1 PHE A 84 -1.544 5.323 -0.678 1.00 20.34 H new ATOM 0 HD2 PHE A 84 0.293 7.694 2.347 1.00 43.32 H new ATOM 0 HE1 PHE A 84 0.523 4.015 -0.911 1.00 14.32 H new ATOM 0 HE2 PHE A 84 2.360 6.390 2.116 1.00 15.34 H new ATOM 0 HZ PHE A 84 2.477 4.543 0.491 1.00 4.42 H new ATOM 1329 N GLY A 85 -4.038 8.441 2.773 1.00 64.22 N ATOM 1330 CA GLY A 85 -4.562 9.086 3.964 1.00 5.30 C ATOM 1331 C GLY A 85 -6.062 8.913 4.104 1.00 2.52 C ATOM 1332 O GLY A 85 -6.694 8.246 3.287 1.00 22.04 O ATOM 0 H GLY A 85 -3.894 9.063 1.977 1.00 64.22 H new ATOM 0 HA2 GLY A 85 -4.068 8.674 4.844 1.00 5.30 H new ATOM 0 HA3 GLY A 85 -4.323 10.149 3.933 1.00 5.30 H new ATOM 1336 N GLN A 86 -6.630 9.515 5.144 1.00 42.43 N ATOM 1337 CA GLN A 86 -8.063 9.423 5.390 1.00 52.01 C ATOM 1338 C GLN A 86 -8.856 9.829 4.151 1.00 63.41 C ATOM 1339 O GLN A 86 -8.415 10.672 3.370 1.00 73.22 O ATOM 1340 CB GLN A 86 -8.458 10.306 6.575 1.00 35.20 C ATOM 1341 CG GLN A 86 -9.390 9.620 7.561 1.00 10.42 C ATOM 1342 CD GLN A 86 -9.211 10.125 8.979 1.00 73.52 C ATOM 1343 OE1 GLN A 86 -9.696 11.199 9.333 1.00 42.32 O ATOM 1344 NE2 GLN A 86 -8.513 9.350 9.800 1.00 61.55 N ATOM 0 H GLN A 86 -6.119 10.071 5.829 1.00 42.43 H new ATOM 0 HA GLN A 86 -8.299 8.385 5.626 1.00 52.01 H new ATOM 0 HB2 GLN A 86 -7.556 10.621 7.099 1.00 35.20 H new ATOM 0 HB3 GLN A 86 -8.940 11.209 6.200 1.00 35.20 H new ATOM 0 HG2 GLN A 86 -10.423 9.779 7.250 1.00 10.42 H new ATOM 0 HG3 GLN A 86 -9.211 8.545 7.537 1.00 10.42 H new ATOM 0 HE21 GLN A 86 -8.129 8.467 9.464 1.00 61.55 H new ATOM 0 HE22 GLN A 86 -8.361 9.638 10.767 1.00 61.55 H new ATOM 1353 N ASN A 87 -10.026 9.225 3.979 1.00 31.20 N ATOM 1354 CA ASN A 87 -10.879 9.525 2.834 1.00 45.35 C ATOM 1355 C ASN A 87 -12.253 8.880 2.995 1.00 15.25 C ATOM 1356 O ASN A 87 -12.541 8.261 4.019 1.00 4.03 O ATOM 1357 CB ASN A 87 -10.223 9.035 1.541 1.00 34.33 C ATOM 1358 CG ASN A 87 -10.005 7.535 1.534 1.00 11.22 C ATOM 1359 OD1 ASN A 87 -9.429 6.976 2.468 1.00 22.11 O ATOM 1360 ND2 ASN A 87 -10.467 6.874 0.479 1.00 35.51 N ATOM 0 H ASN A 87 -10.406 8.525 4.617 1.00 31.20 H new ATOM 0 HA ASN A 87 -11.008 10.606 2.782 1.00 45.35 H new ATOM 0 HB2 ASN A 87 -10.848 9.312 0.692 1.00 34.33 H new ATOM 0 HB3 ASN A 87 -9.265 9.539 1.409 1.00 34.33 H new ATOM 0 HD21 ASN A 87 -10.351 5.862 0.420 1.00 35.51 H new ATOM 0 HD22 ASN A 87 -10.938 7.378 -0.272 1.00 35.51 H new ATOM 1367 N GLU A 88 -13.094 9.030 1.978 1.00 63.12 N ATOM 1368 CA GLU A 88 -14.438 8.463 2.009 1.00 73.11 C ATOM 1369 C GLU A 88 -14.502 7.174 1.194 1.00 72.51 C ATOM 1370 O GLU A 88 -15.557 6.805 0.677 1.00 5.10 O ATOM 1371 CB GLU A 88 -15.454 9.472 1.469 1.00 3.53 C ATOM 1372 CG GLU A 88 -15.880 10.512 2.491 1.00 14.52 C ATOM 1373 CD GLU A 88 -15.513 11.923 2.074 1.00 25.53 C ATOM 1374 OE1 GLU A 88 -14.304 12.227 2.005 1.00 1.34 O ATOM 1375 OE2 GLU A 88 -16.436 12.725 1.817 1.00 74.22 O ATOM 0 H GLU A 88 -12.870 9.539 1.123 1.00 63.12 H new ATOM 0 HA GLU A 88 -14.684 8.231 3.045 1.00 73.11 H new ATOM 0 HB2 GLU A 88 -15.026 9.979 0.604 1.00 3.53 H new ATOM 0 HB3 GLU A 88 -16.336 8.935 1.120 1.00 3.53 H new ATOM 0 HG2 GLU A 88 -16.958 10.450 2.640 1.00 14.52 H new ATOM 0 HG3 GLU A 88 -15.412 10.287 3.450 1.00 14.52 H new ATOM 1382 N THR A 89 -13.366 6.493 1.083 1.00 42.12 N ATOM 1383 CA THR A 89 -13.292 5.247 0.331 1.00 64.33 C ATOM 1384 C THR A 89 -13.592 5.478 -1.146 1.00 65.52 C ATOM 1385 O THR A 89 -14.034 6.558 -1.540 1.00 3.15 O ATOM 1386 CB THR A 89 -14.273 4.197 0.885 1.00 3.44 C ATOM 1387 OG1 THR A 89 -14.671 4.552 2.214 1.00 34.35 O ATOM 1388 CG2 THR A 89 -13.639 2.815 0.891 1.00 35.32 C ATOM 0 H THR A 89 -12.484 6.784 1.505 1.00 42.12 H new ATOM 0 HA THR A 89 -12.274 4.873 0.438 1.00 64.33 H new ATOM 0 HB THR A 89 -15.150 4.174 0.238 1.00 3.44 H new ATOM 0 HG1 THR A 89 -15.296 3.880 2.559 1.00 34.35 H new ATOM 0 HG21 THR A 89 -14.350 2.090 1.286 1.00 35.32 H new ATOM 0 HG22 THR A 89 -13.364 2.536 -0.126 1.00 35.32 H new ATOM 0 HG23 THR A 89 -12.747 2.827 1.517 1.00 35.32 H new ATOM 1396 N THR A 90 -13.349 4.456 -1.962 1.00 53.34 N ATOM 1397 CA THR A 90 -13.593 4.549 -3.395 1.00 64.10 C ATOM 1398 C THR A 90 -13.754 3.165 -4.015 1.00 11.52 C ATOM 1399 O THR A 90 -13.332 2.163 -3.438 1.00 4.22 O ATOM 1400 CB THR A 90 -12.451 5.291 -4.114 1.00 4.33 C ATOM 1401 OG1 THR A 90 -11.403 5.594 -3.185 1.00 0.33 O ATOM 1402 CG2 THR A 90 -12.957 6.576 -4.751 1.00 44.52 C ATOM 0 H THR A 90 -12.983 3.555 -1.654 1.00 53.34 H new ATOM 0 HA THR A 90 -14.517 5.112 -3.522 1.00 64.10 H new ATOM 0 HB THR A 90 -12.064 4.642 -4.900 1.00 4.33 H new ATOM 0 HG1 THR A 90 -10.933 6.404 -3.475 1.00 0.33 H new ATOM 0 HG21 THR A 90 -12.133 7.083 -5.253 1.00 44.52 H new ATOM 0 HG22 THR A 90 -13.734 6.340 -5.478 1.00 44.52 H new ATOM 0 HG23 THR A 90 -13.367 7.228 -3.979 1.00 44.52 H new ATOM 1410 N SER A 91 -14.366 3.117 -5.194 1.00 52.22 N ATOM 1411 CA SER A 91 -14.584 1.855 -5.891 1.00 23.32 C ATOM 1412 C SER A 91 -14.393 2.025 -7.395 1.00 73.34 C ATOM 1413 O SER A 91 -15.346 2.009 -8.174 1.00 65.30 O ATOM 1414 CB SER A 91 -15.990 1.325 -5.602 1.00 10.52 C ATOM 1415 OG SER A 91 -16.093 -0.051 -5.925 1.00 22.30 O ATOM 0 H SER A 91 -14.720 3.937 -5.686 1.00 52.22 H new ATOM 0 HA SER A 91 -13.850 1.136 -5.527 1.00 23.32 H new ATOM 0 HB2 SER A 91 -16.229 1.473 -4.549 1.00 10.52 H new ATOM 0 HB3 SER A 91 -16.721 1.893 -6.177 1.00 10.52 H new ATOM 0 HG SER A 91 -17.000 -0.366 -5.730 1.00 22.30 H new ATOM 1421 N PRO A 92 -13.130 2.192 -7.815 1.00 60.30 N ATOM 1422 CA PRO A 92 -12.781 2.368 -9.228 1.00 30.11 C ATOM 1423 C PRO A 92 -12.986 1.092 -10.038 1.00 60.04 C ATOM 1424 O PRO A 92 -13.404 0.065 -9.503 1.00 32.42 O ATOM 1425 CB PRO A 92 -11.298 2.743 -9.184 1.00 33.35 C ATOM 1426 CG PRO A 92 -10.797 2.153 -7.910 1.00 55.04 C ATOM 1427 CD PRO A 92 -11.945 2.222 -6.942 1.00 64.13 C ATOM 0 HA PRO A 92 -13.408 3.116 -9.713 1.00 30.11 H new ATOM 0 HB2 PRO A 92 -10.762 2.342 -10.044 1.00 33.35 H new ATOM 0 HB3 PRO A 92 -11.162 3.824 -9.200 1.00 33.35 H new ATOM 0 HG2 PRO A 92 -10.473 1.123 -8.058 1.00 55.04 H new ATOM 0 HG3 PRO A 92 -9.937 2.707 -7.535 1.00 55.04 H new ATOM 0 HD2 PRO A 92 -11.936 1.382 -6.248 1.00 64.13 H new ATOM 0 HD3 PRO A 92 -11.911 3.132 -6.342 1.00 64.13 H new ATOM 1435 N HIS A 93 -12.687 1.164 -11.331 1.00 62.43 N ATOM 1436 CA HIS A 93 -12.836 0.014 -12.216 1.00 33.42 C ATOM 1437 C HIS A 93 -11.617 -0.898 -12.132 1.00 14.13 C ATOM 1438 O HIS A 93 -10.733 -0.694 -11.301 1.00 3.43 O ATOM 1439 CB HIS A 93 -13.045 0.477 -13.658 1.00 33.41 C ATOM 1440 CG HIS A 93 -14.169 -0.226 -14.355 1.00 64.35 C ATOM 1441 ND1 HIS A 93 -15.399 -0.441 -13.772 1.00 62.41 N ATOM 1442 CD2 HIS A 93 -14.244 -0.760 -15.597 1.00 34.41 C ATOM 1443 CE1 HIS A 93 -16.182 -1.080 -14.623 1.00 44.51 C ATOM 1444 NE2 HIS A 93 -15.506 -1.285 -15.739 1.00 24.32 N ATOM 0 H HIS A 93 -12.340 2.007 -11.789 1.00 62.43 H new ATOM 0 HA HIS A 93 -13.711 -0.550 -11.894 1.00 33.42 H new ATOM 0 HB2 HIS A 93 -13.240 1.549 -13.662 1.00 33.41 H new ATOM 0 HB3 HIS A 93 -12.124 0.318 -14.219 1.00 33.41 H new ATOM 0 HD2 HIS A 93 -13.458 -0.771 -16.338 1.00 34.41 H new ATOM 0 HE1 HIS A 93 -17.202 -1.383 -14.438 1.00 44.51 H new ATOM 0 HE2 HIS A 93 -15.862 -1.756 -16.571 1.00 24.32 H new ATOM 1452 N SER A 94 -11.576 -1.904 -12.999 1.00 52.11 N ATOM 1453 CA SER A 94 -10.465 -2.850 -13.020 1.00 70.32 C ATOM 1454 C SER A 94 -9.389 -2.404 -14.006 1.00 14.44 C ATOM 1455 O SER A 94 -9.613 -2.371 -15.214 1.00 10.43 O ATOM 1456 CB SER A 94 -10.966 -4.248 -13.394 1.00 51.10 C ATOM 1457 OG SER A 94 -11.749 -4.211 -14.574 1.00 3.42 O ATOM 0 H SER A 94 -12.298 -2.086 -13.696 1.00 52.11 H new ATOM 0 HA SER A 94 -10.028 -2.881 -12.022 1.00 70.32 H new ATOM 0 HB2 SER A 94 -10.116 -4.915 -13.539 1.00 51.10 H new ATOM 0 HB3 SER A 94 -11.557 -4.657 -12.575 1.00 51.10 H new ATOM 0 HG SER A 94 -11.359 -3.571 -15.206 1.00 3.42 H new ATOM 1463 N GLY A 95 -8.220 -2.059 -13.477 1.00 21.35 N ATOM 1464 CA GLY A 95 -7.124 -1.618 -14.322 1.00 44.10 C ATOM 1465 C GLY A 95 -6.065 -2.686 -14.504 1.00 74.11 C ATOM 1466 O GLY A 95 -6.385 -3.863 -14.670 1.00 73.43 O ATOM 0 H GLY A 95 -8.011 -2.077 -12.479 1.00 21.35 H new ATOM 0 HA2 GLY A 95 -7.515 -1.329 -15.297 1.00 44.10 H new ATOM 0 HA3 GLY A 95 -6.668 -0.729 -13.886 1.00 44.10 H new ATOM 1470 N GLN A 96 -4.802 -2.276 -14.472 1.00 10.41 N ATOM 1471 CA GLN A 96 -3.692 -3.207 -14.636 1.00 71.33 C ATOM 1472 C GLN A 96 -3.130 -3.629 -13.283 1.00 34.40 C ATOM 1473 O GLN A 96 -2.915 -4.814 -13.029 1.00 15.22 O ATOM 1474 CB GLN A 96 -2.589 -2.574 -15.485 1.00 73.40 C ATOM 1475 CG GLN A 96 -2.307 -3.327 -16.775 1.00 74.35 C ATOM 1476 CD GLN A 96 -1.201 -4.354 -16.623 1.00 20.51 C ATOM 1477 OE1 GLN A 96 -0.918 -4.817 -15.518 1.00 20.51 O ATOM 1478 NE2 GLN A 96 -0.570 -4.715 -17.734 1.00 12.22 N ATOM 0 H GLN A 96 -4.521 -1.305 -14.334 1.00 10.41 H new ATOM 0 HA GLN A 96 -4.068 -4.095 -15.145 1.00 71.33 H new ATOM 0 HB2 GLN A 96 -2.871 -1.549 -15.726 1.00 73.40 H new ATOM 0 HB3 GLN A 96 -1.673 -2.523 -14.896 1.00 73.40 H new ATOM 0 HG2 GLN A 96 -3.218 -3.826 -17.106 1.00 74.35 H new ATOM 0 HG3 GLN A 96 -2.032 -2.616 -17.554 1.00 74.35 H new ATOM 0 HE21 GLN A 96 -0.838 -4.305 -18.629 1.00 12.22 H new ATOM 0 HE22 GLN A 96 0.183 -5.402 -17.693 1.00 12.22 H new ATOM 1487 N LYS A 97 -2.891 -2.650 -12.416 1.00 3.33 N ATOM 1488 CA LYS A 97 -2.354 -2.918 -11.087 1.00 3.12 C ATOM 1489 C LYS A 97 -2.737 -1.810 -10.111 1.00 51.43 C ATOM 1490 O LYS A 97 -2.669 -0.626 -10.442 1.00 55.44 O ATOM 1491 CB LYS A 97 -0.831 -3.055 -11.148 1.00 25.30 C ATOM 1492 CG LYS A 97 -0.262 -3.999 -10.104 1.00 72.12 C ATOM 1493 CD LYS A 97 1.083 -4.561 -10.533 1.00 72.33 C ATOM 1494 CE LYS A 97 1.164 -6.060 -10.290 1.00 74.13 C ATOM 1495 NZ LYS A 97 2.005 -6.744 -11.309 1.00 13.31 N ATOM 0 H LYS A 97 -3.061 -1.663 -12.610 1.00 3.33 H new ATOM 0 HA LYS A 97 -2.783 -3.855 -10.731 1.00 3.12 H new ATOM 0 HB2 LYS A 97 -0.546 -3.409 -12.139 1.00 25.30 H new ATOM 0 HB3 LYS A 97 -0.381 -2.071 -11.019 1.00 25.30 H new ATOM 0 HG2 LYS A 97 -0.151 -3.471 -9.157 1.00 72.12 H new ATOM 0 HG3 LYS A 97 -0.961 -4.817 -9.933 1.00 72.12 H new ATOM 0 HD2 LYS A 97 1.244 -4.354 -11.591 1.00 72.33 H new ATOM 0 HD3 LYS A 97 1.880 -4.059 -9.985 1.00 72.33 H new ATOM 0 HE2 LYS A 97 1.575 -6.245 -9.297 1.00 74.13 H new ATOM 0 HE3 LYS A 97 0.160 -6.485 -10.304 1.00 74.13 H new ATOM 0 HZ1 LYS A 97 2.034 -7.764 -11.107 1.00 13.31 H new ATOM 0 HZ2 LYS A 97 1.600 -6.590 -12.254 1.00 13.31 H new ATOM 0 HZ3 LYS A 97 2.970 -6.357 -11.279 1.00 13.31 H new ATOM 1509 N THR A 98 -3.140 -2.202 -8.907 1.00 53.15 N ATOM 1510 CA THR A 98 -3.533 -1.242 -7.883 1.00 52.21 C ATOM 1511 C THR A 98 -2.664 -1.378 -6.638 1.00 33.53 C ATOM 1512 O THR A 98 -3.128 -1.830 -5.592 1.00 23.30 O ATOM 1513 CB THR A 98 -5.011 -1.418 -7.485 1.00 34.33 C ATOM 1514 OG1 THR A 98 -5.375 -2.801 -7.556 1.00 75.54 O ATOM 1515 CG2 THR A 98 -5.917 -0.602 -8.395 1.00 31.14 C ATOM 0 H THR A 98 -3.203 -3.178 -8.617 1.00 53.15 H new ATOM 0 HA THR A 98 -3.395 -0.249 -8.312 1.00 52.21 H new ATOM 0 HB THR A 98 -5.135 -1.062 -6.462 1.00 34.33 H new ATOM 0 HG1 THR A 98 -6.315 -2.905 -7.300 1.00 75.54 H new ATOM 0 HG21 THR A 98 -6.955 -0.742 -8.095 1.00 31.14 H new ATOM 0 HG22 THR A 98 -5.656 0.453 -8.317 1.00 31.14 H new ATOM 0 HG23 THR A 98 -5.790 -0.932 -9.426 1.00 31.14 H new ATOM 1523 N GLY A 99 -1.401 -0.983 -6.758 1.00 2.33 N ATOM 1524 CA GLY A 99 -0.486 -1.069 -5.634 1.00 43.31 C ATOM 1525 C GLY A 99 0.744 -0.203 -5.819 1.00 74.10 C ATOM 1526 O GLY A 99 1.759 -0.460 -5.175 1.00 11.42 O ATOM 0 H GLY A 99 -0.994 -0.605 -7.613 1.00 2.33 H new ATOM 0 HA2 GLY A 99 -1.005 -0.768 -4.724 1.00 43.31 H new ATOM 0 HA3 GLY A 99 -0.179 -2.106 -5.498 1.00 43.31 H new TER 1530 GLY A 99 ATOM 1531 N MET B 1 14.649 38.675 -1.043 1.00 51.11 N ATOM 1532 CA MET B 1 13.557 38.682 -2.010 1.00 63.42 C ATOM 1533 C MET B 1 13.815 37.679 -3.129 1.00 24.41 C ATOM 1534 O MET B 1 12.880 37.177 -3.753 1.00 25.51 O ATOM 1535 CB MET B 1 13.377 40.083 -2.596 1.00 75.14 C ATOM 1536 CG MET B 1 14.667 40.697 -3.115 1.00 44.22 C ATOM 1537 SD MET B 1 15.174 42.148 -2.173 1.00 21.25 S ATOM 1538 CE MET B 1 14.737 43.460 -3.311 1.00 23.32 C ATOM 0 H1 MET B 1 14.435 39.341 -0.273 1.00 51.11 H new ATOM 0 H2 MET B 1 14.760 37.718 -0.652 1.00 51.11 H new ATOM 0 H3 MET B 1 15.531 38.962 -1.513 1.00 51.11 H new ATOM 0 HA MET B 1 12.643 38.392 -1.491 1.00 63.42 H new ATOM 0 HB2 MET B 1 12.653 40.037 -3.410 1.00 75.14 H new ATOM 0 HB3 MET B 1 12.956 40.736 -1.832 1.00 75.14 H new ATOM 0 HG2 MET B 1 15.460 39.950 -3.079 1.00 44.22 H new ATOM 0 HG3 MET B 1 14.537 40.975 -4.161 1.00 44.22 H new ATOM 0 HE1 MET B 1 14.991 44.424 -2.870 1.00 23.32 H new ATOM 0 HE2 MET B 1 15.287 43.331 -4.243 1.00 23.32 H new ATOM 0 HE3 MET B 1 13.667 43.424 -3.514 1.00 23.32 H new ATOM 1548 N SER B 2 15.089 37.393 -3.379 1.00 52.41 N ATOM 1549 CA SER B 2 15.469 36.453 -4.427 1.00 52.31 C ATOM 1550 C SER B 2 15.961 35.139 -3.826 1.00 72.12 C ATOM 1551 O SER B 2 17.162 34.882 -3.768 1.00 1.24 O ATOM 1552 CB SER B 2 16.558 37.059 -5.315 1.00 33.21 C ATOM 1553 OG SER B 2 15.992 37.779 -6.396 1.00 21.32 O ATOM 0 H SER B 2 15.875 37.798 -2.870 1.00 52.41 H new ATOM 0 HA SER B 2 14.587 36.248 -5.034 1.00 52.31 H new ATOM 0 HB2 SER B 2 17.188 37.722 -4.722 1.00 33.21 H new ATOM 0 HB3 SER B 2 17.201 36.267 -5.699 1.00 33.21 H new ATOM 0 HG SER B 2 16.708 38.158 -6.947 1.00 21.32 H new ATOM 1559 N ASN B 3 15.022 34.312 -3.380 1.00 61.32 N ATOM 1560 CA ASN B 3 15.357 33.024 -2.783 1.00 34.05 C ATOM 1561 C ASN B 3 14.931 31.875 -3.692 1.00 13.43 C ATOM 1562 O ASN B 3 13.844 31.317 -3.538 1.00 63.53 O ATOM 1563 CB ASN B 3 14.687 32.883 -1.414 1.00 35.42 C ATOM 1564 CG ASN B 3 14.787 34.150 -0.588 1.00 24.34 C ATOM 1565 OD1 ASN B 3 13.782 34.662 -0.092 1.00 34.54 O ATOM 1566 ND2 ASN B 3 16.002 34.664 -0.438 1.00 22.22 N ATOM 0 H ASN B 3 14.022 34.510 -3.421 1.00 61.32 H new ATOM 0 HA ASN B 3 16.439 32.981 -2.657 1.00 34.05 H new ATOM 0 HB2 ASN B 3 13.637 32.624 -1.551 1.00 35.42 H new ATOM 0 HB3 ASN B 3 15.150 32.060 -0.869 1.00 35.42 H new ATOM 0 HD21 ASN B 3 16.131 35.517 0.106 1.00 22.22 H new ATOM 0 HD22 ASN B 3 16.806 34.206 -0.867 1.00 22.22 H new ATOM 1573 N THR B 4 15.795 31.526 -4.639 1.00 72.34 N ATOM 1574 CA THR B 4 15.510 30.444 -5.574 1.00 42.42 C ATOM 1575 C THR B 4 15.292 29.127 -4.839 1.00 52.45 C ATOM 1576 O THR B 4 15.205 29.098 -3.611 1.00 62.33 O ATOM 1577 CB THR B 4 16.650 30.268 -6.594 1.00 14.31 C ATOM 1578 OG1 THR B 4 16.179 29.543 -7.735 1.00 24.44 O ATOM 1579 CG2 THR B 4 17.826 29.530 -5.969 1.00 44.11 C ATOM 0 H THR B 4 16.699 31.977 -4.779 1.00 72.34 H new ATOM 0 HA THR B 4 14.598 30.716 -6.105 1.00 42.42 H new ATOM 0 HB THR B 4 16.985 31.257 -6.905 1.00 14.31 H new ATOM 0 HG1 THR B 4 16.910 29.437 -8.380 1.00 24.44 H new ATOM 0 HG21 THR B 4 18.619 29.417 -6.708 1.00 44.11 H new ATOM 0 HG22 THR B 4 18.201 30.098 -5.118 1.00 44.11 H new ATOM 0 HG23 THR B 4 17.501 28.545 -5.633 1.00 44.11 H new ATOM 1587 N ILE B 5 15.205 28.039 -5.597 1.00 72.43 N ATOM 1588 CA ILE B 5 14.998 26.718 -5.016 1.00 60.40 C ATOM 1589 C ILE B 5 16.113 26.368 -4.036 1.00 73.52 C ATOM 1590 O ILE B 5 15.856 26.050 -2.875 1.00 14.01 O ATOM 1591 CB ILE B 5 14.927 25.630 -6.104 1.00 41.35 C ATOM 1592 CG1 ILE B 5 13.935 26.036 -7.197 1.00 41.00 C ATOM 1593 CG2 ILE B 5 14.531 24.295 -5.491 1.00 64.43 C ATOM 1594 CD1 ILE B 5 13.753 24.983 -8.267 1.00 71.13 C ATOM 0 H ILE B 5 15.275 28.046 -6.615 1.00 72.43 H new ATOM 0 HA ILE B 5 14.047 26.752 -4.484 1.00 60.40 H new ATOM 0 HB ILE B 5 15.913 25.522 -6.556 1.00 41.35 H new ATOM 0 HG12 ILE B 5 12.969 26.248 -6.739 1.00 41.00 H new ATOM 0 HG13 ILE B 5 14.277 26.960 -7.662 1.00 41.00 H new ATOM 0 HG21 ILE B 5 14.485 23.536 -6.272 1.00 64.43 H new ATOM 0 HG22 ILE B 5 15.270 24.004 -4.745 1.00 64.43 H new ATOM 0 HG23 ILE B 5 13.554 24.388 -5.017 1.00 64.43 H new ATOM 0 HD11 ILE B 5 13.037 25.338 -9.008 1.00 71.13 H new ATOM 0 HD12 ILE B 5 14.710 24.787 -8.751 1.00 71.13 H new ATOM 0 HD13 ILE B 5 13.381 24.064 -7.814 1.00 71.13 H new ATOM 1606 N SER B 6 17.353 26.432 -4.511 1.00 1.32 N ATOM 1607 CA SER B 6 18.508 26.119 -3.678 1.00 35.53 C ATOM 1608 C SER B 6 18.522 26.987 -2.423 1.00 22.31 C ATOM 1609 O SER B 6 19.095 26.611 -1.401 1.00 0.21 O ATOM 1610 CB SER B 6 19.803 26.322 -4.466 1.00 41.32 C ATOM 1611 OG SER B 6 20.362 27.598 -4.210 1.00 21.35 O ATOM 0 H SER B 6 17.583 26.698 -5.468 1.00 1.32 H new ATOM 0 HA SER B 6 18.435 25.074 -3.377 1.00 35.53 H new ATOM 0 HB2 SER B 6 20.521 25.547 -4.198 1.00 41.32 H new ATOM 0 HB3 SER B 6 19.604 26.216 -5.532 1.00 41.32 H new ATOM 0 HG SER B 6 21.133 27.503 -3.612 1.00 21.35 H new ATOM 1617 N GLU B 7 17.888 28.153 -2.510 1.00 32.11 N ATOM 1618 CA GLU B 7 17.829 29.075 -1.383 1.00 62.35 C ATOM 1619 C GLU B 7 16.850 28.579 -0.323 1.00 42.41 C ATOM 1620 O GLU B 7 16.963 28.922 0.854 1.00 11.21 O ATOM 1621 CB GLU B 7 17.419 30.471 -1.857 1.00 23.21 C ATOM 1622 CG GLU B 7 18.586 31.433 -2.000 1.00 1.43 C ATOM 1623 CD GLU B 7 18.654 32.441 -0.869 1.00 1.34 C ATOM 1624 OE1 GLU B 7 18.598 32.019 0.305 1.00 64.22 O ATOM 1625 OE2 GLU B 7 18.765 33.650 -1.159 1.00 2.32 O ATOM 0 H GLU B 7 17.409 28.480 -3.349 1.00 32.11 H new ATOM 0 HA GLU B 7 18.823 29.127 -0.939 1.00 62.35 H new ATOM 0 HB2 GLU B 7 16.911 30.385 -2.817 1.00 23.21 H new ATOM 0 HB3 GLU B 7 16.700 30.888 -1.152 1.00 23.21 H new ATOM 0 HG2 GLU B 7 19.517 30.867 -2.033 1.00 1.43 H new ATOM 0 HG3 GLU B 7 18.501 31.963 -2.949 1.00 1.43 H new ATOM 1632 N LYS B 8 15.888 27.768 -0.750 1.00 33.03 N ATOM 1633 CA LYS B 8 14.888 27.222 0.159 1.00 74.20 C ATOM 1634 C LYS B 8 15.420 25.984 0.875 1.00 72.42 C ATOM 1635 O LYS B 8 14.711 25.359 1.663 1.00 55.43 O ATOM 1636 CB LYS B 8 13.610 26.870 -0.606 1.00 61.22 C ATOM 1637 CG LYS B 8 13.341 27.783 -1.790 1.00 10.12 C ATOM 1638 CD LYS B 8 11.887 27.711 -2.230 1.00 72.53 C ATOM 1639 CE LYS B 8 11.214 29.073 -2.152 1.00 74.45 C ATOM 1640 NZ LYS B 8 10.430 29.375 -3.381 1.00 44.13 N ATOM 0 H LYS B 8 15.780 27.474 -1.721 1.00 33.03 H new ATOM 0 HA LYS B 8 14.660 27.983 0.906 1.00 74.20 H new ATOM 0 HB2 LYS B 8 13.679 25.841 -0.959 1.00 61.22 H new ATOM 0 HB3 LYS B 8 12.762 26.916 0.078 1.00 61.22 H new ATOM 0 HG2 LYS B 8 13.591 28.810 -1.523 1.00 10.12 H new ATOM 0 HG3 LYS B 8 13.988 27.503 -2.621 1.00 10.12 H new ATOM 0 HD2 LYS B 8 11.833 27.335 -3.252 1.00 72.53 H new ATOM 0 HD3 LYS B 8 11.350 27.002 -1.600 1.00 72.53 H new ATOM 0 HE2 LYS B 8 10.555 29.103 -1.284 1.00 74.45 H new ATOM 0 HE3 LYS B 8 11.970 29.844 -2.005 1.00 74.45 H new ATOM 0 HZ1 LYS B 8 9.987 30.311 -3.289 1.00 44.13 H new ATOM 0 HZ2 LYS B 8 11.063 29.371 -4.206 1.00 44.13 H new ATOM 0 HZ3 LYS B 8 9.692 28.654 -3.508 1.00 44.13 H new ATOM 1654 N ILE B 9 16.672 25.637 0.594 1.00 12.54 N ATOM 1655 CA ILE B 9 17.299 24.476 1.213 1.00 14.12 C ATOM 1656 C ILE B 9 18.577 24.868 1.947 1.00 2.44 C ATOM 1657 O ILE B 9 19.262 24.020 2.520 1.00 32.42 O ATOM 1658 CB ILE B 9 17.631 23.393 0.169 1.00 61.41 C ATOM 1659 CG1 ILE B 9 16.472 23.231 -0.815 1.00 2.42 C ATOM 1660 CG2 ILE B 9 17.937 22.071 0.858 1.00 21.54 C ATOM 1661 CD1 ILE B 9 16.729 22.192 -1.885 1.00 4.43 C ATOM 0 H ILE B 9 17.271 26.143 -0.058 1.00 12.54 H new ATOM 0 HA ILE B 9 16.582 24.073 1.928 1.00 14.12 H new ATOM 0 HB ILE B 9 18.515 23.704 -0.388 1.00 61.41 H new ATOM 0 HG12 ILE B 9 15.573 22.958 -0.263 1.00 2.42 H new ATOM 0 HG13 ILE B 9 16.274 24.191 -1.292 1.00 2.42 H new ATOM 0 HG21 ILE B 9 18.170 21.315 0.108 1.00 21.54 H new ATOM 0 HG22 ILE B 9 18.791 22.197 1.524 1.00 21.54 H new ATOM 0 HG23 ILE B 9 17.070 21.753 1.437 1.00 21.54 H new ATOM 0 HD11 ILE B 9 15.865 22.130 -2.547 1.00 4.43 H new ATOM 0 HD12 ILE B 9 17.610 22.474 -2.462 1.00 4.43 H new ATOM 0 HD13 ILE B 9 16.897 21.222 -1.417 1.00 4.43 H new ATOM 1673 N VAL B 10 18.893 26.159 1.926 1.00 31.43 N ATOM 1674 CA VAL B 10 20.087 26.665 2.593 1.00 4.14 C ATOM 1675 C VAL B 10 19.723 27.516 3.804 1.00 20.24 C ATOM 1676 O VAL B 10 20.434 27.520 4.810 1.00 25.00 O ATOM 1677 CB VAL B 10 20.953 27.502 1.633 1.00 14.00 C ATOM 1678 CG1 VAL B 10 21.374 26.670 0.430 1.00 0.51 C ATOM 1679 CG2 VAL B 10 20.205 28.751 1.193 1.00 13.31 C ATOM 0 H VAL B 10 18.339 26.874 1.454 1.00 31.43 H new ATOM 0 HA VAL B 10 20.657 25.796 2.922 1.00 4.14 H new ATOM 0 HB VAL B 10 21.854 27.813 2.162 1.00 14.00 H new ATOM 0 HG11 VAL B 10 21.985 27.278 -0.237 1.00 0.51 H new ATOM 0 HG12 VAL B 10 21.951 25.809 0.767 1.00 0.51 H new ATOM 0 HG13 VAL B 10 20.487 26.326 -0.103 1.00 0.51 H new ATOM 0 HG21 VAL B 10 20.832 29.331 0.515 1.00 13.31 H new ATOM 0 HG22 VAL B 10 19.286 28.464 0.682 1.00 13.31 H new ATOM 0 HG23 VAL B 10 19.960 29.355 2.067 1.00 13.31 H new ATOM 1689 N LEU B 11 18.611 28.235 3.701 1.00 4.44 N ATOM 1690 CA LEU B 11 18.150 29.091 4.789 1.00 2.34 C ATOM 1691 C LEU B 11 17.573 28.258 5.930 1.00 45.43 C ATOM 1692 O LEU B 11 17.612 28.666 7.090 1.00 75.44 O ATOM 1693 CB LEU B 11 17.097 30.076 4.278 1.00 4.21 C ATOM 1694 CG LEU B 11 15.877 29.459 3.592 1.00 62.10 C ATOM 1695 CD1 LEU B 11 14.850 29.021 4.624 1.00 1.11 C ATOM 1696 CD2 LEU B 11 15.262 30.445 2.611 1.00 42.24 C ATOM 0 H LEU B 11 18.012 28.243 2.876 1.00 4.44 H new ATOM 0 HA LEU B 11 19.006 29.649 5.168 1.00 2.34 H new ATOM 0 HB2 LEU B 11 16.751 30.676 5.120 1.00 4.21 H new ATOM 0 HB3 LEU B 11 17.577 30.758 3.576 1.00 4.21 H new ATOM 0 HG LEU B 11 16.202 28.579 3.037 1.00 62.10 H new ATOM 0 HD11 LEU B 11 13.989 28.584 4.118 1.00 1.11 H new ATOM 0 HD12 LEU B 11 15.295 28.280 5.288 1.00 1.11 H new ATOM 0 HD13 LEU B 11 14.529 29.884 5.207 1.00 1.11 H new ATOM 0 HD21 LEU B 11 14.395 29.989 2.132 1.00 42.24 H new ATOM 0 HD22 LEU B 11 14.951 31.343 3.145 1.00 42.24 H new ATOM 0 HD23 LEU B 11 15.998 30.710 1.852 1.00 42.24 H new ATOM 1708 N MET B 12 17.039 27.089 5.591 1.00 15.32 N ATOM 1709 CA MET B 12 16.457 26.198 6.587 1.00 4.44 C ATOM 1710 C MET B 12 17.481 25.174 7.065 1.00 75.53 C ATOM 1711 O MET B 12 17.467 24.763 8.226 1.00 31.24 O ATOM 1712 CB MET B 12 15.234 25.482 6.011 1.00 24.25 C ATOM 1713 CG MET B 12 15.449 24.950 4.603 1.00 13.14 C ATOM 1714 SD MET B 12 14.525 23.435 4.285 1.00 25.25 S ATOM 1715 CE MET B 12 15.852 22.318 3.836 1.00 64.33 C ATOM 0 H MET B 12 16.997 26.737 4.634 1.00 15.32 H new ATOM 0 HA MET B 12 16.147 26.802 7.440 1.00 4.44 H new ATOM 0 HB2 MET B 12 14.966 24.654 6.667 1.00 24.25 H new ATOM 0 HB3 MET B 12 14.389 26.171 6.005 1.00 24.25 H new ATOM 0 HG2 MET B 12 15.151 25.711 3.882 1.00 13.14 H new ATOM 0 HG3 MET B 12 16.511 24.762 4.448 1.00 13.14 H new ATOM 0 HE1 MET B 12 15.610 21.826 2.894 1.00 64.33 H new ATOM 0 HE2 MET B 12 16.779 22.880 3.724 1.00 64.33 H new ATOM 0 HE3 MET B 12 15.975 21.567 4.616 1.00 64.33 H new ATOM 1725 N ARG B 13 18.368 24.766 6.164 1.00 31.24 N ATOM 1726 CA ARG B 13 19.399 23.788 6.494 1.00 74.51 C ATOM 1727 C ARG B 13 20.384 24.360 7.510 1.00 20.12 C ATOM 1728 O ARG B 13 20.655 23.744 8.541 1.00 41.34 O ATOM 1729 CB ARG B 13 20.145 23.356 5.231 1.00 32.34 C ATOM 1730 CG ARG B 13 21.211 22.302 5.483 1.00 45.45 C ATOM 1731 CD ARG B 13 22.593 22.924 5.598 1.00 63.05 C ATOM 1732 NE ARG B 13 23.072 23.435 4.317 1.00 42.01 N ATOM 1733 CZ ARG B 13 24.352 23.668 4.051 1.00 41.31 C ATOM 1734 NH1 ARG B 13 25.277 23.438 4.972 1.00 23.35 N ATOM 1735 NH2 ARG B 13 24.709 24.134 2.860 1.00 12.23 N ATOM 0 H ARG B 13 18.394 25.097 5.200 1.00 31.24 H new ATOM 0 HA ARG B 13 18.912 22.918 6.935 1.00 74.51 H new ATOM 0 HB2 ARG B 13 19.426 22.968 4.510 1.00 32.34 H new ATOM 0 HB3 ARG B 13 20.611 24.231 4.778 1.00 32.34 H new ATOM 0 HG2 ARG B 13 20.978 21.759 6.399 1.00 45.45 H new ATOM 0 HG3 ARG B 13 21.204 21.575 4.671 1.00 45.45 H new ATOM 0 HD2 ARG B 13 22.566 23.736 6.325 1.00 63.05 H new ATOM 0 HD3 ARG B 13 23.295 22.181 5.977 1.00 63.05 H new ATOM 0 HE ARG B 13 22.386 23.623 3.586 1.00 42.01 H new ATOM 0 HH11 ARG B 13 25.007 23.081 5.888 1.00 23.35 H new ATOM 0 HH12 ARG B 13 26.259 23.618 4.764 1.00 23.35 H new ATOM 0 HH21 ARG B 13 24.000 24.313 2.149 1.00 12.23 H new ATOM 0 HH22 ARG B 13 25.692 24.313 2.656 1.00 12.23 H new ATOM 1749 N LYS B 14 20.918 25.538 7.210 1.00 12.22 N ATOM 1750 CA LYS B 14 21.873 26.194 8.095 1.00 65.30 C ATOM 1751 C LYS B 14 21.224 26.544 9.431 1.00 55.42 C ATOM 1752 O LYS B 14 21.905 26.660 10.450 1.00 72.04 O ATOM 1753 CB LYS B 14 22.425 27.460 7.436 1.00 13.55 C ATOM 1754 CG LYS B 14 23.786 27.266 6.791 1.00 13.50 C ATOM 1755 CD LYS B 14 23.691 26.422 5.530 1.00 31.23 C ATOM 1756 CE LYS B 14 23.254 27.255 4.335 1.00 22.12 C ATOM 1757 NZ LYS B 14 24.334 27.371 3.316 1.00 72.34 N ATOM 0 H LYS B 14 20.705 26.059 6.359 1.00 12.22 H new ATOM 0 HA LYS B 14 22.694 25.502 8.280 1.00 65.30 H new ATOM 0 HB2 LYS B 14 21.719 27.803 6.679 1.00 13.55 H new ATOM 0 HB3 LYS B 14 22.497 28.248 8.186 1.00 13.55 H new ATOM 0 HG2 LYS B 14 24.216 28.238 6.548 1.00 13.50 H new ATOM 0 HG3 LYS B 14 24.461 26.787 7.500 1.00 13.50 H new ATOM 0 HD2 LYS B 14 24.659 25.965 5.322 1.00 31.23 H new ATOM 0 HD3 LYS B 14 22.982 25.609 5.687 1.00 31.23 H new ATOM 0 HE2 LYS B 14 22.372 26.803 3.880 1.00 22.12 H new ATOM 0 HE3 LYS B 14 22.964 28.250 4.672 1.00 22.12 H new ATOM 0 HZ1 LYS B 14 24.262 28.292 2.837 1.00 72.34 H new ATOM 0 HZ2 LYS B 14 25.261 27.294 3.782 1.00 72.34 H new ATOM 0 HZ3 LYS B 14 24.234 26.608 2.616 1.00 72.34 H new ATOM 1771 N SER B 15 19.906 26.712 9.417 1.00 70.12 N ATOM 1772 CA SER B 15 19.166 27.052 10.627 1.00 60.13 C ATOM 1773 C SER B 15 19.276 25.935 11.662 1.00 64.13 C ATOM 1774 O SER B 15 19.164 26.176 12.864 1.00 73.31 O ATOM 1775 CB SER B 15 17.696 27.313 10.296 1.00 63.31 C ATOM 1776 OG SER B 15 17.011 27.861 11.408 1.00 42.11 O ATOM 0 H SER B 15 19.328 26.618 8.582 1.00 70.12 H new ATOM 0 HA SER B 15 19.602 27.958 11.047 1.00 60.13 H new ATOM 0 HB2 SER B 15 17.627 27.996 9.450 1.00 63.31 H new ATOM 0 HB3 SER B 15 17.217 26.382 9.993 1.00 63.31 H new ATOM 0 HG SER B 15 16.074 28.020 11.169 1.00 42.11 H new ATOM 1782 N GLU B 16 19.494 24.714 11.185 1.00 40.41 N ATOM 1783 CA GLU B 16 19.618 23.560 12.068 1.00 13.44 C ATOM 1784 C GLU B 16 21.011 23.495 12.687 1.00 32.01 C ATOM 1785 O GLU B 16 21.285 22.650 13.539 1.00 23.44 O ATOM 1786 CB GLU B 16 19.328 22.269 11.301 1.00 54.12 C ATOM 1787 CG GLU B 16 19.225 21.042 12.191 1.00 50.43 C ATOM 1788 CD GLU B 16 18.205 21.211 13.300 1.00 43.22 C ATOM 1789 OE1 GLU B 16 17.219 21.950 13.094 1.00 51.44 O ATOM 1790 OE2 GLU B 16 18.392 20.603 14.375 1.00 35.53 O ATOM 0 H GLU B 16 19.588 24.498 10.193 1.00 40.41 H new ATOM 0 HA GLU B 16 18.888 23.669 12.870 1.00 13.44 H new ATOM 0 HB2 GLU B 16 18.396 22.386 10.749 1.00 54.12 H new ATOM 0 HB3 GLU B 16 20.116 22.109 10.565 1.00 54.12 H new ATOM 0 HG2 GLU B 16 18.956 20.178 11.583 1.00 50.43 H new ATOM 0 HG3 GLU B 16 20.201 20.832 12.629 1.00 50.43 H new ATOM 1797 N TYR B 17 21.887 24.394 12.253 1.00 34.32 N ATOM 1798 CA TYR B 17 23.253 24.439 12.761 1.00 12.14 C ATOM 1799 C TYR B 17 24.003 23.155 12.419 1.00 53.41 C ATOM 1800 O TYR B 17 24.988 22.804 13.072 1.00 71.22 O ATOM 1801 CB TYR B 17 23.249 24.651 14.276 1.00 12.25 C ATOM 1802 CG TYR B 17 23.497 26.085 14.686 1.00 11.31 C ATOM 1803 CD1 TYR B 17 22.551 27.074 14.441 1.00 24.11 C ATOM 1804 CD2 TYR B 17 24.678 26.452 15.321 1.00 4.33 C ATOM 1805 CE1 TYR B 17 22.774 28.385 14.813 1.00 12.34 C ATOM 1806 CE2 TYR B 17 24.908 27.761 15.699 1.00 21.33 C ATOM 1807 CZ TYR B 17 23.954 28.724 15.441 1.00 21.44 C ATOM 1808 OH TYR B 17 24.179 30.029 15.815 1.00 40.42 O ATOM 0 H TYR B 17 21.675 25.102 11.550 1.00 34.32 H new ATOM 0 HA TYR B 17 23.764 25.276 12.285 1.00 12.14 H new ATOM 0 HB2 TYR B 17 22.288 24.328 14.677 1.00 12.25 H new ATOM 0 HB3 TYR B 17 24.012 24.016 14.726 1.00 12.25 H new ATOM 0 HD1 TYR B 17 21.625 26.812 13.951 1.00 24.11 H new ATOM 0 HD2 TYR B 17 25.428 25.702 15.522 1.00 4.33 H new ATOM 0 HE1 TYR B 17 22.029 29.141 14.613 1.00 12.34 H new ATOM 0 HE2 TYR B 17 25.830 28.029 16.194 1.00 21.33 H new ATOM 0 HH TYR B 17 25.056 30.099 16.246 1.00 40.42 H new ATOM 1818 N LEU B 18 23.531 22.458 11.391 1.00 12.20 N ATOM 1819 CA LEU B 18 24.156 21.212 10.960 1.00 24.40 C ATOM 1820 C LEU B 18 25.002 21.432 9.709 1.00 52.21 C ATOM 1821 O LEU B 18 24.806 22.404 8.979 1.00 53.11 O ATOM 1822 CB LEU B 18 23.090 20.151 10.688 1.00 20.43 C ATOM 1823 CG LEU B 18 22.169 20.414 9.495 1.00 13.14 C ATOM 1824 CD1 LEU B 18 22.804 19.907 8.210 1.00 73.11 C ATOM 1825 CD2 LEU B 18 20.812 19.762 9.715 1.00 4.13 C ATOM 0 H LEU B 18 22.718 22.734 10.841 1.00 12.20 H new ATOM 0 HA LEU B 18 24.808 20.865 11.762 1.00 24.40 H new ATOM 0 HB2 LEU B 18 23.589 19.195 10.532 1.00 20.43 H new ATOM 0 HB3 LEU B 18 22.474 20.047 11.581 1.00 20.43 H new ATOM 0 HG LEU B 18 22.022 21.490 9.404 1.00 13.14 H new ATOM 0 HD11 LEU B 18 22.135 20.102 7.372 1.00 73.11 H new ATOM 0 HD12 LEU B 18 23.751 20.420 8.045 1.00 73.11 H new ATOM 0 HD13 LEU B 18 22.981 18.835 8.290 1.00 73.11 H new ATOM 0 HD21 LEU B 18 20.170 19.959 8.857 1.00 4.13 H new ATOM 0 HD22 LEU B 18 20.940 18.686 9.832 1.00 4.13 H new ATOM 0 HD23 LEU B 18 20.352 20.173 10.614 1.00 4.13 H new ATOM 1837 N SER B 19 25.939 20.522 9.467 1.00 12.41 N ATOM 1838 CA SER B 19 26.815 20.617 8.306 1.00 64.34 C ATOM 1839 C SER B 19 26.228 19.861 7.118 1.00 33.32 C ATOM 1840 O SER B 19 25.384 18.979 7.287 1.00 1.23 O ATOM 1841 CB SER B 19 28.203 20.066 8.640 1.00 15.24 C ATOM 1842 OG SER B 19 28.140 19.142 9.713 1.00 63.44 O ATOM 0 H SER B 19 26.111 19.710 10.060 1.00 12.41 H new ATOM 0 HA SER B 19 26.905 21.669 8.036 1.00 64.34 H new ATOM 0 HB2 SER B 19 28.626 19.579 7.761 1.00 15.24 H new ATOM 0 HB3 SER B 19 28.870 20.887 8.902 1.00 15.24 H new ATOM 0 HG SER B 19 29.039 18.803 9.906 1.00 63.44 H new ATOM 1848 N ARG B 20 26.679 20.211 5.919 1.00 0.34 N ATOM 1849 CA ARG B 20 26.197 19.567 4.703 1.00 13.34 C ATOM 1850 C ARG B 20 26.300 18.048 4.815 1.00 61.45 C ATOM 1851 O ARG B 20 25.505 17.319 4.225 1.00 32.35 O ATOM 1852 CB ARG B 20 26.995 20.055 3.491 1.00 32.01 C ATOM 1853 CG ARG B 20 26.222 21.013 2.599 1.00 12.30 C ATOM 1854 CD ARG B 20 26.980 21.310 1.315 1.00 43.42 C ATOM 1855 NE ARG B 20 27.521 22.667 1.301 1.00 33.34 N ATOM 1856 CZ ARG B 20 28.525 23.049 0.520 1.00 13.22 C ATOM 1857 NH1 ARG B 20 29.094 22.182 -0.307 1.00 45.34 N ATOM 1858 NH2 ARG B 20 28.962 24.301 0.564 1.00 44.43 N ATOM 0 H ARG B 20 27.378 20.937 5.763 1.00 0.34 H new ATOM 0 HA ARG B 20 25.149 19.835 4.571 1.00 13.34 H new ATOM 0 HB2 ARG B 20 27.903 20.548 3.839 1.00 32.01 H new ATOM 0 HB3 ARG B 20 27.306 19.193 2.901 1.00 32.01 H new ATOM 0 HG2 ARG B 20 25.250 20.584 2.358 1.00 12.30 H new ATOM 0 HG3 ARG B 20 26.036 21.943 3.137 1.00 12.30 H new ATOM 0 HD2 ARG B 20 27.794 20.594 1.200 1.00 43.42 H new ATOM 0 HD3 ARG B 20 26.315 21.176 0.462 1.00 43.42 H new ATOM 0 HE ARG B 20 27.105 23.359 1.925 1.00 33.34 H new ATOM 0 HH11 ARG B 20 28.761 21.219 -0.344 1.00 45.34 H new ATOM 0 HH12 ARG B 20 29.865 22.479 -0.906 1.00 45.34 H new ATOM 0 HH21 ARG B 20 28.527 24.971 1.198 1.00 44.43 H new ATOM 0 HH22 ARG B 20 29.733 24.593 -0.036 1.00 44.43 H new ATOM 1872 N GLN B 21 27.286 17.582 5.575 1.00 14.43 N ATOM 1873 CA GLN B 21 27.492 16.151 5.763 1.00 43.34 C ATOM 1874 C GLN B 21 26.440 15.567 6.698 1.00 62.14 C ATOM 1875 O GLN B 21 25.990 14.436 6.512 1.00 41.54 O ATOM 1876 CB GLN B 21 28.892 15.886 6.321 1.00 2.32 C ATOM 1877 CG GLN B 21 29.151 16.561 7.658 1.00 23.52 C ATOM 1878 CD GLN B 21 30.590 17.009 7.816 1.00 53.34 C ATOM 1879 OE1 GLN B 21 31.189 17.555 6.888 1.00 14.14 O ATOM 1880 NE2 GLN B 21 31.156 16.781 8.996 1.00 71.20 N ATOM 0 H GLN B 21 27.954 18.174 6.070 1.00 14.43 H new ATOM 0 HA GLN B 21 27.397 15.665 4.792 1.00 43.34 H new ATOM 0 HB2 GLN B 21 29.032 14.811 6.433 1.00 2.32 H new ATOM 0 HB3 GLN B 21 29.633 16.231 5.600 1.00 2.32 H new ATOM 0 HG2 GLN B 21 28.493 17.424 7.759 1.00 23.52 H new ATOM 0 HG3 GLN B 21 28.898 15.872 8.464 1.00 23.52 H new ATOM 0 HE21 GLN B 21 30.624 16.326 9.738 1.00 71.20 H new ATOM 0 HE22 GLN B 21 32.123 17.061 9.160 1.00 71.20 H new ATOM 1889 N GLN B 22 26.050 16.345 7.703 1.00 33.40 N ATOM 1890 CA GLN B 22 25.050 15.903 8.668 1.00 53.02 C ATOM 1891 C GLN B 22 23.739 15.555 7.972 1.00 53.44 C ATOM 1892 O GLN B 22 23.172 14.484 8.194 1.00 72.23 O ATOM 1893 CB GLN B 22 24.812 16.988 9.719 1.00 4.03 C ATOM 1894 CG GLN B 22 24.930 16.486 11.150 1.00 5.22 C ATOM 1895 CD GLN B 22 25.760 17.406 12.025 1.00 40.14 C ATOM 1896 OE1 GLN B 22 26.969 17.539 11.834 1.00 24.31 O ATOM 1897 NE2 GLN B 22 25.112 18.046 12.991 1.00 70.34 N ATOM 0 H GLN B 22 26.411 17.284 7.870 1.00 33.40 H new ATOM 0 HA GLN B 22 25.427 15.007 9.161 1.00 53.02 H new ATOM 0 HB2 GLN B 22 25.529 17.794 9.565 1.00 4.03 H new ATOM 0 HB3 GLN B 22 23.819 17.412 9.572 1.00 4.03 H new ATOM 0 HG2 GLN B 22 23.933 16.385 11.579 1.00 5.22 H new ATOM 0 HG3 GLN B 22 25.378 15.492 11.147 1.00 5.22 H new ATOM 0 HE21 GLN B 22 24.109 17.905 13.112 1.00 70.34 H new ATOM 0 HE22 GLN B 22 25.617 18.679 13.612 1.00 70.34 H new ATOM 1906 N LEU B 23 23.262 16.466 7.131 1.00 15.24 N ATOM 1907 CA LEU B 23 22.016 16.256 6.403 1.00 60.42 C ATOM 1908 C LEU B 23 22.197 15.216 5.302 1.00 74.31 C ATOM 1909 O LEU B 23 21.317 14.389 5.063 1.00 34.01 O ATOM 1910 CB LEU B 23 21.526 17.573 5.799 1.00 62.13 C ATOM 1911 CG LEU B 23 20.407 17.463 4.763 1.00 44.52 C ATOM 1912 CD1 LEU B 23 19.188 18.256 5.208 1.00 33.53 C ATOM 1913 CD2 LEU B 23 20.890 17.940 3.402 1.00 12.23 C ATOM 0 H LEU B 23 23.719 17.357 6.937 1.00 15.24 H new ATOM 0 HA LEU B 23 21.271 15.887 7.108 1.00 60.42 H new ATOM 0 HB2 LEU B 23 21.181 18.215 6.610 1.00 62.13 H new ATOM 0 HB3 LEU B 23 22.375 18.074 5.335 1.00 62.13 H new ATOM 0 HG LEU B 23 20.121 16.415 4.676 1.00 44.52 H new ATOM 0 HD11 LEU B 23 18.402 18.166 4.458 1.00 33.53 H new ATOM 0 HD12 LEU B 23 18.828 17.866 6.160 1.00 33.53 H new ATOM 0 HD13 LEU B 23 19.459 19.305 5.325 1.00 33.53 H new ATOM 0 HD21 LEU B 23 20.080 17.854 2.678 1.00 12.23 H new ATOM 0 HD22 LEU B 23 21.205 18.981 3.472 1.00 12.23 H new ATOM 0 HD23 LEU B 23 21.732 17.327 3.079 1.00 12.23 H new ATOM 1925 N ALA B 24 23.346 15.262 4.635 1.00 31.24 N ATOM 1926 CA ALA B 24 23.646 14.322 3.563 1.00 75.43 C ATOM 1927 C ALA B 24 23.492 12.880 4.037 1.00 63.14 C ATOM 1928 O ALA B 24 23.220 11.980 3.242 1.00 31.23 O ATOM 1929 CB ALA B 24 25.052 14.557 3.031 1.00 65.45 C ATOM 0 H ALA B 24 24.084 15.941 4.819 1.00 31.24 H new ATOM 0 HA ALA B 24 22.932 14.490 2.757 1.00 75.43 H new ATOM 0 HB1 ALA B 24 25.262 13.847 2.231 1.00 65.45 H new ATOM 0 HB2 ALA B 24 25.130 15.573 2.644 1.00 65.45 H new ATOM 0 HB3 ALA B 24 25.773 14.419 3.836 1.00 65.45 H new ATOM 1935 N ASP B 25 23.667 12.669 5.336 1.00 53.33 N ATOM 1936 CA ASP B 25 23.548 11.337 5.917 1.00 63.20 C ATOM 1937 C ASP B 25 22.152 11.118 6.492 1.00 41.34 C ATOM 1938 O ASP B 25 21.696 9.982 6.629 1.00 55.50 O ATOM 1939 CB ASP B 25 24.600 11.137 7.009 1.00 35.03 C ATOM 1940 CG ASP B 25 25.441 9.896 6.782 1.00 31.34 C ATOM 1941 OD1 ASP B 25 26.475 9.998 6.090 1.00 75.51 O ATOM 1942 OD2 ASP B 25 25.065 8.822 7.299 1.00 43.25 O ATOM 0 H ASP B 25 23.892 13.403 6.007 1.00 53.33 H new ATOM 0 HA ASP B 25 23.714 10.606 5.125 1.00 63.20 H new ATOM 0 HB2 ASP B 25 25.250 12.011 7.048 1.00 35.03 H new ATOM 0 HB3 ASP B 25 24.105 11.065 7.977 1.00 35.03 H new ATOM 1947 N LEU B 26 21.478 12.212 6.829 1.00 71.41 N ATOM 1948 CA LEU B 26 20.134 12.140 7.391 1.00 64.24 C ATOM 1949 C LEU B 26 19.105 11.841 6.305 1.00 43.13 C ATOM 1950 O LEU B 26 17.999 11.384 6.592 1.00 10.22 O ATOM 1951 CB LEU B 26 19.783 13.453 8.093 1.00 4.31 C ATOM 1952 CG LEU B 26 19.739 13.405 9.621 1.00 10.30 C ATOM 1953 CD1 LEU B 26 20.849 14.258 10.215 1.00 61.54 C ATOM 1954 CD2 LEU B 26 18.380 13.867 10.130 1.00 62.25 C ATOM 0 H LEU B 26 21.840 13.160 6.723 1.00 71.41 H new ATOM 0 HA LEU B 26 20.114 11.329 8.119 1.00 64.24 H new ATOM 0 HB2 LEU B 26 20.510 14.208 7.794 1.00 4.31 H new ATOM 0 HB3 LEU B 26 18.810 13.787 7.732 1.00 4.31 H new ATOM 0 HG LEU B 26 19.893 12.373 9.937 1.00 10.30 H new ATOM 0 HD11 LEU B 26 20.801 14.211 11.303 1.00 61.54 H new ATOM 0 HD12 LEU B 26 21.816 13.884 9.878 1.00 61.54 H new ATOM 0 HD13 LEU B 26 20.727 15.291 9.891 1.00 61.54 H new ATOM 0 HD21 LEU B 26 18.366 13.826 11.219 1.00 62.25 H new ATOM 0 HD22 LEU B 26 18.198 14.891 9.803 1.00 62.25 H new ATOM 0 HD23 LEU B 26 17.602 13.215 9.733 1.00 62.25 H new ATOM 1966 N THR B 27 19.479 12.100 5.056 1.00 72.41 N ATOM 1967 CA THR B 27 18.590 11.858 3.927 1.00 53.05 C ATOM 1968 C THR B 27 19.164 10.800 2.992 1.00 51.22 C ATOM 1969 O THR B 27 18.432 10.159 2.239 1.00 32.24 O ATOM 1970 CB THR B 27 18.333 13.149 3.126 1.00 52.21 C ATOM 1971 OG1 THR B 27 19.560 13.629 2.565 1.00 2.43 O ATOM 1972 CG2 THR B 27 17.720 14.223 4.013 1.00 64.34 C ATOM 0 H THR B 27 20.392 12.477 4.801 1.00 72.41 H new ATOM 0 HA THR B 27 17.646 11.501 4.340 1.00 53.05 H new ATOM 0 HB THR B 27 17.632 12.920 2.323 1.00 52.21 H new ATOM 0 HG1 THR B 27 20.181 13.861 3.287 1.00 2.43 H new ATOM 0 HG21 THR B 27 17.548 15.125 3.426 1.00 64.34 H new ATOM 0 HG22 THR B 27 16.772 13.865 4.415 1.00 64.34 H new ATOM 0 HG23 THR B 27 18.401 14.449 4.834 1.00 64.34 H new ATOM 1980 N GLY B 28 20.481 10.622 3.045 1.00 31.12 N ATOM 1981 CA GLY B 28 21.131 9.639 2.198 1.00 0.51 C ATOM 1982 C GLY B 28 21.718 10.253 0.943 1.00 21.43 C ATOM 1983 O GLY B 28 22.353 9.564 0.144 1.00 31.15 O ATOM 0 H GLY B 28 21.109 11.141 3.659 1.00 31.12 H new ATOM 0 HA2 GLY B 28 21.922 9.145 2.762 1.00 0.51 H new ATOM 0 HA3 GLY B 28 20.410 8.870 1.920 1.00 0.51 H new ATOM 1987 N VAL B 29 21.506 11.554 0.767 1.00 41.33 N ATOM 1988 CA VAL B 29 22.018 12.262 -0.400 1.00 64.40 C ATOM 1989 C VAL B 29 23.542 12.306 -0.391 1.00 1.32 C ATOM 1990 O VAL B 29 24.174 12.533 0.641 1.00 12.41 O ATOM 1991 CB VAL B 29 21.473 13.700 -0.468 1.00 61.44 C ATOM 1992 CG1 VAL B 29 22.503 14.633 -1.086 1.00 50.43 C ATOM 1993 CG2 VAL B 29 20.169 13.740 -1.251 1.00 55.14 C ATOM 0 H VAL B 29 20.983 12.139 1.419 1.00 41.33 H new ATOM 0 HA VAL B 29 21.679 11.712 -1.278 1.00 64.40 H new ATOM 0 HB VAL B 29 21.271 14.041 0.547 1.00 61.44 H new ATOM 0 HG11 VAL B 29 22.100 15.645 -1.126 1.00 50.43 H new ATOM 0 HG12 VAL B 29 23.409 14.627 -0.480 1.00 50.43 H new ATOM 0 HG13 VAL B 29 22.739 14.297 -2.096 1.00 50.43 H new ATOM 0 HG21 VAL B 29 19.798 14.764 -1.289 1.00 55.14 H new ATOM 0 HG22 VAL B 29 20.342 13.379 -2.265 1.00 55.14 H new ATOM 0 HG23 VAL B 29 19.431 13.105 -0.761 1.00 55.14 H new ATOM 2003 N PRO B 30 24.147 12.086 -1.566 1.00 64.31 N ATOM 2004 CA PRO B 30 25.605 12.097 -1.721 1.00 44.21 C ATOM 2005 C PRO B 30 26.194 13.496 -1.568 1.00 55.44 C ATOM 2006 O PRO B 30 25.771 14.434 -2.244 1.00 52.10 O ATOM 2007 CB PRO B 30 25.815 11.581 -3.146 1.00 72.05 C ATOM 2008 CG PRO B 30 24.552 11.917 -3.861 1.00 25.14 C ATOM 2009 CD PRO B 30 23.456 11.809 -2.838 1.00 2.43 C ATOM 0 HA PRO B 30 26.100 11.496 -0.959 1.00 44.21 H new ATOM 0 HB2 PRO B 30 26.675 12.057 -3.617 1.00 72.05 H new ATOM 0 HB3 PRO B 30 26.001 10.507 -3.155 1.00 72.05 H new ATOM 0 HG2 PRO B 30 24.597 12.922 -4.281 1.00 25.14 H new ATOM 0 HG3 PRO B 30 24.380 11.232 -4.691 1.00 25.14 H new ATOM 0 HD2 PRO B 30 22.658 12.527 -3.027 1.00 2.43 H new ATOM 0 HD3 PRO B 30 23.000 10.819 -2.840 1.00 2.43 H new ATOM 2017 N TYR B 31 27.170 13.628 -0.678 1.00 55.04 N ATOM 2018 CA TYR B 31 27.816 14.913 -0.436 1.00 73.24 C ATOM 2019 C TYR B 31 28.524 15.412 -1.692 1.00 50.10 C ATOM 2020 O TYR B 31 28.623 16.616 -1.926 1.00 14.12 O ATOM 2021 CB TYR B 31 28.816 14.797 0.715 1.00 71.51 C ATOM 2022 CG TYR B 31 29.480 16.106 1.075 1.00 71.30 C ATOM 2023 CD1 TYR B 31 30.599 16.553 0.383 1.00 11.35 C ATOM 2024 CD2 TYR B 31 28.988 16.898 2.106 1.00 4.21 C ATOM 2025 CE1 TYR B 31 31.210 17.749 0.708 1.00 75.30 C ATOM 2026 CE2 TYR B 31 29.592 18.096 2.437 1.00 23.24 C ATOM 2027 CZ TYR B 31 30.702 18.516 1.736 1.00 13.24 C ATOM 2028 OH TYR B 31 31.308 19.708 2.063 1.00 2.20 O ATOM 0 H TYR B 31 27.532 12.861 -0.111 1.00 55.04 H new ATOM 0 HA TYR B 31 27.044 15.633 -0.166 1.00 73.24 H new ATOM 0 HB2 TYR B 31 28.302 14.406 1.593 1.00 71.51 H new ATOM 0 HB3 TYR B 31 29.584 14.072 0.446 1.00 71.51 H new ATOM 0 HD1 TYR B 31 30.998 15.955 -0.423 1.00 11.35 H new ATOM 0 HD2 TYR B 31 28.119 16.571 2.658 1.00 4.21 H new ATOM 0 HE1 TYR B 31 32.080 18.081 0.161 1.00 75.30 H new ATOM 0 HE2 TYR B 31 29.197 18.700 3.240 1.00 23.24 H new ATOM 0 HH TYR B 31 30.827 20.126 2.807 1.00 2.20 H new ATOM 2038 N GLY B 32 29.017 14.476 -2.497 1.00 45.13 N ATOM 2039 CA GLY B 32 29.710 14.838 -3.719 1.00 74.01 C ATOM 2040 C GLY B 32 28.846 15.659 -4.655 1.00 73.43 C ATOM 2041 O GLY B 32 29.349 16.494 -5.407 1.00 1.33 O ATOM 0 H GLY B 32 28.949 13.473 -2.324 1.00 45.13 H new ATOM 0 HA2 GLY B 32 30.608 15.403 -3.470 1.00 74.01 H new ATOM 0 HA3 GLY B 32 30.035 13.932 -4.231 1.00 74.01 H new ATOM 2045 N THR B 33 27.538 15.421 -4.612 1.00 10.04 N ATOM 2046 CA THR B 33 26.601 16.141 -5.464 1.00 11.04 C ATOM 2047 C THR B 33 25.845 17.204 -4.675 1.00 2.51 C ATOM 2048 O THR B 33 25.478 18.248 -5.214 1.00 23.25 O ATOM 2049 CB THR B 33 25.586 15.185 -6.118 1.00 3.23 C ATOM 2050 OG1 THR B 33 26.209 13.927 -6.398 1.00 14.15 O ATOM 2051 CG2 THR B 33 25.032 15.780 -7.403 1.00 42.22 C ATOM 0 H THR B 33 27.104 14.734 -3.995 1.00 10.04 H new ATOM 0 HA THR B 33 27.190 16.622 -6.245 1.00 11.04 H new ATOM 0 HB THR B 33 24.761 15.034 -5.422 1.00 3.23 H new ATOM 0 HG1 THR B 33 25.557 13.324 -6.812 1.00 14.15 H new ATOM 0 HG21 THR B 33 24.317 15.087 -7.847 1.00 42.22 H new ATOM 0 HG22 THR B 33 24.533 16.723 -7.182 1.00 42.22 H new ATOM 0 HG23 THR B 33 25.848 15.957 -8.103 1.00 42.22 H new ATOM 2059 N LEU B 34 25.616 16.932 -3.395 1.00 5.42 N ATOM 2060 CA LEU B 34 24.904 17.866 -2.529 1.00 11.23 C ATOM 2061 C LEU B 34 25.523 19.258 -2.605 1.00 53.41 C ATOM 2062 O LEU B 34 24.813 20.264 -2.605 1.00 25.43 O ATOM 2063 CB LEU B 34 24.922 17.366 -1.084 1.00 44.11 C ATOM 2064 CG LEU B 34 24.357 18.326 -0.035 1.00 20.43 C ATOM 2065 CD1 LEU B 34 22.836 18.291 -0.044 1.00 30.33 C ATOM 2066 CD2 LEU B 34 24.892 17.981 1.346 1.00 54.42 C ATOM 0 H LEU B 34 25.913 16.072 -2.934 1.00 5.42 H new ATOM 0 HA LEU B 34 23.872 17.928 -2.873 1.00 11.23 H new ATOM 0 HB2 LEU B 34 24.359 16.434 -1.036 1.00 44.11 H new ATOM 0 HB3 LEU B 34 25.952 17.130 -0.815 1.00 44.11 H new ATOM 0 HG LEU B 34 24.678 19.337 -0.285 1.00 20.43 H new ATOM 0 HD11 LEU B 34 22.452 18.980 0.708 1.00 30.33 H new ATOM 0 HD12 LEU B 34 22.471 18.587 -1.027 1.00 30.33 H new ATOM 0 HD13 LEU B 34 22.494 17.281 0.181 1.00 30.33 H new ATOM 0 HD21 LEU B 34 24.480 18.674 2.079 1.00 54.42 H new ATOM 0 HD22 LEU B 34 24.601 16.963 1.605 1.00 54.42 H new ATOM 0 HD23 LEU B 34 25.979 18.058 1.345 1.00 54.42 H new ATOM 2078 N SER B 35 26.850 19.308 -2.671 1.00 61.31 N ATOM 2079 CA SER B 35 27.564 20.577 -2.747 1.00 34.14 C ATOM 2080 C SER B 35 27.016 21.443 -3.877 1.00 4.52 C ATOM 2081 O SER B 35 27.042 22.672 -3.802 1.00 30.41 O ATOM 2082 CB SER B 35 29.060 20.333 -2.954 1.00 14.21 C ATOM 2083 OG SER B 35 29.691 21.476 -3.503 1.00 62.41 O ATOM 0 H SER B 35 27.452 18.485 -2.673 1.00 61.31 H new ATOM 0 HA SER B 35 27.417 21.105 -1.805 1.00 34.14 H new ATOM 0 HB2 SER B 35 29.525 20.079 -2.002 1.00 14.21 H new ATOM 0 HB3 SER B 35 29.204 19.480 -3.617 1.00 14.21 H new ATOM 0 HG SER B 35 30.647 21.296 -3.624 1.00 62.41 H new ATOM 2089 N TYR B 36 26.522 20.793 -4.925 1.00 41.34 N ATOM 2090 CA TYR B 36 25.969 21.501 -6.073 1.00 34.30 C ATOM 2091 C TYR B 36 24.462 21.686 -5.927 1.00 45.21 C ATOM 2092 O TYR B 36 23.872 22.578 -6.537 1.00 45.01 O ATOM 2093 CB TYR B 36 26.279 20.742 -7.364 1.00 40.31 C ATOM 2094 CG TYR B 36 27.738 20.375 -7.517 1.00 34.30 C ATOM 2095 CD1 TYR B 36 28.726 21.351 -7.478 1.00 32.43 C ATOM 2096 CD2 TYR B 36 28.128 19.055 -7.702 1.00 45.14 C ATOM 2097 CE1 TYR B 36 30.060 21.021 -7.618 1.00 62.53 C ATOM 2098 CE2 TYR B 36 29.459 18.716 -7.842 1.00 64.54 C ATOM 2099 CZ TYR B 36 30.422 19.703 -7.799 1.00 62.20 C ATOM 2100 OH TYR B 36 31.749 19.369 -7.939 1.00 51.03 O ATOM 0 H TYR B 36 26.493 19.776 -5.003 1.00 41.34 H new ATOM 0 HA TYR B 36 26.434 22.486 -6.118 1.00 34.30 H new ATOM 0 HB2 TYR B 36 25.679 19.832 -7.393 1.00 40.31 H new ATOM 0 HB3 TYR B 36 25.975 21.351 -8.215 1.00 40.31 H new ATOM 0 HD1 TYR B 36 28.446 22.384 -7.336 1.00 32.43 H new ATOM 0 HD2 TYR B 36 27.377 18.280 -7.737 1.00 45.14 H new ATOM 0 HE1 TYR B 36 30.816 21.792 -7.586 1.00 62.53 H new ATOM 0 HE2 TYR B 36 29.745 17.684 -7.984 1.00 64.54 H new ATOM 0 HH TYR B 36 31.832 18.400 -8.057 1.00 51.03 H new ATOM 2110 N TYR B 37 23.846 20.837 -5.112 1.00 23.03 N ATOM 2111 CA TYR B 37 22.407 20.904 -4.885 1.00 71.53 C ATOM 2112 C TYR B 37 22.022 22.215 -4.207 1.00 1.34 C ATOM 2113 O TYR B 37 21.408 23.087 -4.821 1.00 12.02 O ATOM 2114 CB TYR B 37 21.949 19.721 -4.030 1.00 44.25 C ATOM 2115 CG TYR B 37 21.634 18.479 -4.834 1.00 22.43 C ATOM 2116 CD1 TYR B 37 22.319 18.197 -6.009 1.00 52.14 C ATOM 2117 CD2 TYR B 37 20.655 17.588 -4.416 1.00 15.42 C ATOM 2118 CE1 TYR B 37 22.035 17.063 -6.746 1.00 2.53 C ATOM 2119 CE2 TYR B 37 20.364 16.451 -5.146 1.00 0.41 C ATOM 2120 CZ TYR B 37 21.057 16.194 -6.310 1.00 71.12 C ATOM 2121 OH TYR B 37 20.772 15.063 -7.042 1.00 2.50 O ATOM 0 H TYR B 37 24.320 20.095 -4.598 1.00 23.03 H new ATOM 0 HA TYR B 37 21.910 20.858 -5.854 1.00 71.53 H new ATOM 0 HB2 TYR B 37 22.727 19.486 -3.304 1.00 44.25 H new ATOM 0 HB3 TYR B 37 21.063 20.013 -3.466 1.00 44.25 H new ATOM 0 HD1 TYR B 37 23.086 18.875 -6.352 1.00 52.14 H new ATOM 0 HD2 TYR B 37 20.111 17.787 -3.504 1.00 15.42 H new ATOM 0 HE1 TYR B 37 22.576 16.859 -7.658 1.00 2.53 H new ATOM 0 HE2 TYR B 37 19.599 15.768 -4.807 1.00 0.41 H new ATOM 0 HH TYR B 37 20.060 14.557 -6.598 1.00 2.50 H new ATOM 2131 N GLU B 38 22.391 22.347 -2.937 1.00 43.22 N ATOM 2132 CA GLU B 38 22.085 23.551 -2.174 1.00 44.31 C ATOM 2133 C GLU B 38 22.735 24.778 -2.809 1.00 24.45 C ATOM 2134 O GLU B 38 22.301 25.907 -2.589 1.00 42.22 O ATOM 2135 CB GLU B 38 22.559 23.400 -0.727 1.00 11.21 C ATOM 2136 CG GLU B 38 24.043 23.100 -0.602 1.00 54.50 C ATOM 2137 CD GLU B 38 24.875 24.350 -0.391 1.00 35.11 C ATOM 2138 OE1 GLU B 38 24.392 25.278 0.291 1.00 70.20 O ATOM 2139 OE2 GLU B 38 26.011 24.400 -0.909 1.00 63.32 O ATOM 0 H GLU B 38 22.902 21.635 -2.415 1.00 43.22 H new ATOM 0 HA GLU B 38 21.004 23.689 -2.181 1.00 44.31 H new ATOM 0 HB2 GLU B 38 22.335 24.317 -0.182 1.00 11.21 H new ATOM 0 HB3 GLU B 38 21.993 22.600 -0.250 1.00 11.21 H new ATOM 0 HG2 GLU B 38 24.203 22.417 0.232 1.00 54.50 H new ATOM 0 HG3 GLU B 38 24.384 22.589 -1.502 1.00 54.50 H new ATOM 2146 N SER B 39 23.780 24.543 -3.596 1.00 53.34 N ATOM 2147 CA SER B 39 24.495 25.628 -4.260 1.00 70.11 C ATOM 2148 C SER B 39 23.686 26.174 -5.432 1.00 24.54 C ATOM 2149 O SER B 39 23.999 27.231 -5.979 1.00 41.42 O ATOM 2150 CB SER B 39 25.860 25.143 -4.750 1.00 1.22 C ATOM 2151 OG SER B 39 26.473 26.106 -5.590 1.00 11.15 O ATOM 0 H SER B 39 24.150 23.613 -3.790 1.00 53.34 H new ATOM 0 HA SER B 39 24.641 26.430 -3.537 1.00 70.11 H new ATOM 0 HB2 SER B 39 26.505 24.938 -3.895 1.00 1.22 H new ATOM 0 HB3 SER B 39 25.743 24.205 -5.292 1.00 1.22 H new ATOM 0 HG SER B 39 27.345 25.772 -5.888 1.00 11.15 H new ATOM 2157 N GLY B 40 22.641 25.445 -5.813 1.00 41.23 N ATOM 2158 CA GLY B 40 21.802 25.871 -6.918 1.00 73.32 C ATOM 2159 C GLY B 40 22.475 25.681 -8.263 1.00 71.50 C ATOM 2160 O GLY B 40 22.051 26.260 -9.264 1.00 64.32 O ATOM 0 H GLY B 40 22.361 24.567 -5.376 1.00 41.23 H new ATOM 0 HA2 GLY B 40 20.869 25.308 -6.899 1.00 73.32 H new ATOM 0 HA3 GLY B 40 21.543 26.922 -6.790 1.00 73.32 H new ATOM 2164 N ARG B 41 23.528 24.871 -8.287 1.00 73.33 N ATOM 2165 CA ARG B 41 24.262 24.609 -9.519 1.00 73.31 C ATOM 2166 C ARG B 41 23.348 24.003 -10.579 1.00 30.24 C ATOM 2167 O ARG B 41 23.550 24.202 -11.777 1.00 23.15 O ATOM 2168 CB ARG B 41 25.438 23.669 -9.247 1.00 2.45 C ATOM 2169 CG ARG B 41 26.660 23.959 -10.105 1.00 71.20 C ATOM 2170 CD ARG B 41 27.359 25.235 -9.665 1.00 3.45 C ATOM 2171 NE ARG B 41 28.457 25.594 -10.559 1.00 73.34 N ATOM 2172 CZ ARG B 41 28.286 26.217 -11.720 1.00 44.45 C ATOM 2173 NH1 ARG B 41 27.069 26.548 -12.125 1.00 73.10 N ATOM 2174 NH2 ARG B 41 29.335 26.509 -12.478 1.00 72.43 N ATOM 0 H ARG B 41 23.892 24.385 -7.467 1.00 73.33 H new ATOM 0 HA ARG B 41 24.643 25.559 -9.893 1.00 73.31 H new ATOM 0 HB2 ARG B 41 25.716 23.744 -8.196 1.00 2.45 H new ATOM 0 HB3 ARG B 41 25.118 22.641 -9.420 1.00 2.45 H new ATOM 0 HG2 ARG B 41 27.356 23.122 -10.044 1.00 71.20 H new ATOM 0 HG3 ARG B 41 26.360 24.049 -11.149 1.00 71.20 H new ATOM 0 HD2 ARG B 41 26.637 26.051 -9.632 1.00 3.45 H new ATOM 0 HD3 ARG B 41 27.743 25.108 -8.653 1.00 3.45 H new ATOM 0 HE ARG B 41 29.407 25.353 -10.276 1.00 73.34 H new ATOM 0 HH11 ARG B 41 26.260 26.325 -11.545 1.00 73.10 H new ATOM 0 HH12 ARG B 41 26.941 27.026 -13.017 1.00 73.10 H new ATOM 0 HH21 ARG B 41 30.274 26.255 -12.170 1.00 72.43 H new ATOM 0 HH22 ARG B 41 29.203 26.987 -13.369 1.00 72.43 H new ATOM 2188 N SER B 42 22.341 23.259 -10.130 1.00 53.33 N ATOM 2189 CA SER B 42 21.397 22.621 -11.040 1.00 23.23 C ATOM 2190 C SER B 42 20.086 22.301 -10.327 1.00 3.44 C ATOM 2191 O SER B 42 19.994 22.390 -9.102 1.00 55.33 O ATOM 2192 CB SER B 42 22.002 21.340 -11.617 1.00 33.02 C ATOM 2193 OG SER B 42 21.860 21.298 -13.026 1.00 14.24 O ATOM 0 H SER B 42 22.158 23.084 -9.142 1.00 53.33 H new ATOM 0 HA SER B 42 21.187 23.316 -11.854 1.00 23.23 H new ATOM 0 HB2 SER B 42 23.058 21.282 -11.353 1.00 33.02 H new ATOM 0 HB3 SER B 42 21.514 20.472 -11.173 1.00 33.02 H new ATOM 0 HG SER B 42 22.256 20.470 -13.370 1.00 14.24 H new ATOM 2199 N THR B 43 19.074 21.930 -11.103 1.00 54.02 N ATOM 2200 CA THR B 43 17.767 21.598 -10.548 1.00 44.13 C ATOM 2201 C THR B 43 17.631 20.097 -10.322 1.00 62.42 C ATOM 2202 O THR B 43 17.521 19.310 -11.262 1.00 42.45 O ATOM 2203 CB THR B 43 16.628 22.072 -11.470 1.00 15.34 C ATOM 2204 OG1 THR B 43 17.129 23.020 -12.419 1.00 15.25 O ATOM 2205 CG2 THR B 43 15.504 22.702 -10.661 1.00 51.13 C ATOM 0 H THR B 43 19.133 21.852 -12.118 1.00 54.02 H new ATOM 0 HA THR B 43 17.689 22.115 -9.592 1.00 44.13 H new ATOM 0 HB THR B 43 16.232 21.204 -11.998 1.00 15.34 H new ATOM 0 HG1 THR B 43 16.399 23.315 -13.003 1.00 15.25 H new ATOM 0 HG21 THR B 43 14.711 23.029 -11.333 1.00 51.13 H new ATOM 0 HG22 THR B 43 15.106 21.969 -9.959 1.00 51.13 H new ATOM 0 HG23 THR B 43 15.889 23.560 -10.110 1.00 51.13 H new ATOM 2213 N PRO B 44 17.635 19.687 -9.044 1.00 34.10 N ATOM 2214 CA PRO B 44 17.511 18.277 -8.665 1.00 64.22 C ATOM 2215 C PRO B 44 16.118 17.723 -8.939 1.00 65.12 C ATOM 2216 O PRO B 44 15.166 18.464 -9.185 1.00 43.23 O ATOM 2217 CB PRO B 44 17.796 18.288 -7.161 1.00 42.35 C ATOM 2218 CG PRO B 44 17.435 19.664 -6.717 1.00 43.14 C ATOM 2219 CD PRO B 44 17.761 20.570 -7.872 1.00 4.14 C ATOM 0 HA PRO B 44 18.187 17.641 -9.236 1.00 64.22 H new ATOM 0 HB2 PRO B 44 17.203 17.536 -6.640 1.00 42.35 H new ATOM 0 HB3 PRO B 44 18.843 18.068 -6.955 1.00 42.35 H new ATOM 0 HG2 PRO B 44 16.378 19.726 -6.459 1.00 43.14 H new ATOM 0 HG3 PRO B 44 17.998 19.947 -5.828 1.00 43.14 H new ATOM 0 HD2 PRO B 44 17.072 21.413 -7.928 1.00 4.14 H new ATOM 0 HD3 PRO B 44 18.766 20.984 -7.787 1.00 4.14 H new ATOM 2227 N PRO B 45 15.991 16.388 -8.898 1.00 22.42 N ATOM 2228 CA PRO B 45 14.717 15.705 -9.139 1.00 43.51 C ATOM 2229 C PRO B 45 13.715 15.933 -8.012 1.00 62.05 C ATOM 2230 O PRO B 45 13.996 16.654 -7.053 1.00 14.40 O ATOM 2231 CB PRO B 45 15.114 14.229 -9.211 1.00 65.34 C ATOM 2232 CG PRO B 45 16.369 14.135 -8.415 1.00 42.52 C ATOM 2233 CD PRO B 45 17.084 15.442 -8.612 1.00 44.51 C ATOM 0 HA PRO B 45 14.222 16.071 -10.038 1.00 43.51 H new ATOM 0 HB2 PRO B 45 14.334 13.589 -8.798 1.00 65.34 H new ATOM 0 HB3 PRO B 45 15.274 13.912 -10.242 1.00 65.34 H new ATOM 0 HG2 PRO B 45 16.150 13.965 -7.361 1.00 42.52 H new ATOM 0 HG3 PRO B 45 16.983 13.300 -8.752 1.00 42.52 H new ATOM 0 HD2 PRO B 45 17.644 15.732 -7.723 1.00 44.51 H new ATOM 0 HD3 PRO B 45 17.797 15.390 -9.435 1.00 44.51 H new ATOM 2241 N THR B 46 12.544 15.315 -8.133 1.00 11.44 N ATOM 2242 CA THR B 46 11.500 15.451 -7.125 1.00 63.42 C ATOM 2243 C THR B 46 11.606 14.354 -6.072 1.00 5.13 C ATOM 2244 O THR B 46 11.212 14.544 -4.922 1.00 4.01 O ATOM 2245 CB THR B 46 10.098 15.403 -7.759 1.00 52.33 C ATOM 2246 OG1 THR B 46 9.945 16.480 -8.691 1.00 33.31 O ATOM 2247 CG2 THR B 46 9.017 15.493 -6.693 1.00 3.02 C ATOM 0 H THR B 46 12.295 14.715 -8.920 1.00 11.44 H new ATOM 0 HA THR B 46 11.644 16.422 -6.651 1.00 63.42 H new ATOM 0 HB THR B 46 9.993 14.452 -8.281 1.00 52.33 H new ATOM 0 HG1 THR B 46 9.121 16.352 -9.206 1.00 33.31 H new ATOM 0 HG21 THR B 46 8.036 15.457 -7.166 1.00 3.02 H new ATOM 0 HG22 THR B 46 9.117 14.656 -6.001 1.00 3.02 H new ATOM 0 HG23 THR B 46 9.122 16.430 -6.146 1.00 3.02 H new ATOM 2255 N ASP B 47 12.142 13.206 -6.473 1.00 1.43 N ATOM 2256 CA ASP B 47 12.302 12.077 -5.562 1.00 54.30 C ATOM 2257 C ASP B 47 13.334 12.392 -4.484 1.00 63.03 C ATOM 2258 O ASP B 47 13.285 11.841 -3.384 1.00 32.00 O ATOM 2259 CB ASP B 47 12.719 10.826 -6.336 1.00 61.00 C ATOM 2260 CG ASP B 47 12.025 9.576 -5.831 1.00 74.43 C ATOM 2261 OD1 ASP B 47 11.575 9.576 -4.667 1.00 4.34 O ATOM 2262 OD2 ASP B 47 11.933 8.597 -6.602 1.00 53.32 O ATOM 0 H ASP B 47 12.473 13.032 -7.422 1.00 1.43 H new ATOM 0 HA ASP B 47 11.343 11.892 -5.078 1.00 54.30 H new ATOM 0 HB2 ASP B 47 12.491 10.963 -7.393 1.00 61.00 H new ATOM 0 HB3 ASP B 47 13.798 10.696 -6.257 1.00 61.00 H new ATOM 2267 N VAL B 48 14.268 13.281 -4.807 1.00 74.22 N ATOM 2268 CA VAL B 48 15.312 13.669 -3.865 1.00 22.51 C ATOM 2269 C VAL B 48 14.903 14.901 -3.068 1.00 4.50 C ATOM 2270 O VAL B 48 14.990 14.916 -1.840 1.00 11.21 O ATOM 2271 CB VAL B 48 16.641 13.957 -4.589 1.00 0.11 C ATOM 2272 CG1 VAL B 48 17.696 14.430 -3.601 1.00 24.23 C ATOM 2273 CG2 VAL B 48 17.117 12.723 -5.340 1.00 54.21 C ATOM 0 H VAL B 48 14.323 13.746 -5.713 1.00 74.22 H new ATOM 0 HA VAL B 48 15.452 12.830 -3.184 1.00 22.51 H new ATOM 0 HB VAL B 48 16.474 14.753 -5.314 1.00 0.11 H new ATOM 0 HG11 VAL B 48 18.628 14.628 -4.131 1.00 24.23 H new ATOM 0 HG12 VAL B 48 17.354 15.343 -3.113 1.00 24.23 H new ATOM 0 HG13 VAL B 48 17.863 13.658 -2.850 1.00 24.23 H new ATOM 0 HG21 VAL B 48 18.057 12.945 -5.845 1.00 54.21 H new ATOM 0 HG22 VAL B 48 17.268 11.904 -4.636 1.00 54.21 H new ATOM 0 HG23 VAL B 48 16.368 12.434 -6.077 1.00 54.21 H new ATOM 2283 N MET B 49 14.454 15.935 -3.774 1.00 33.43 N ATOM 2284 CA MET B 49 14.029 17.172 -3.131 1.00 40.22 C ATOM 2285 C MET B 49 12.983 16.895 -2.056 1.00 4.22 C ATOM 2286 O MET B 49 12.805 17.687 -1.131 1.00 1.31 O ATOM 2287 CB MET B 49 13.465 18.144 -4.169 1.00 44.14 C ATOM 2288 CG MET B 49 11.991 17.924 -4.470 1.00 51.34 C ATOM 2289 SD MET B 49 10.922 19.070 -3.580 1.00 51.12 S ATOM 2290 CE MET B 49 9.912 17.929 -2.638 1.00 51.15 C ATOM 0 H MET B 49 14.376 15.940 -4.791 1.00 33.43 H new ATOM 0 HA MET B 49 14.901 17.623 -2.657 1.00 40.22 H new ATOM 0 HB2 MET B 49 13.606 19.165 -3.813 1.00 44.14 H new ATOM 0 HB3 MET B 49 14.035 18.047 -5.093 1.00 44.14 H new ATOM 0 HG2 MET B 49 11.823 18.034 -5.541 1.00 51.34 H new ATOM 0 HG3 MET B 49 11.719 16.902 -4.208 1.00 51.34 H new ATOM 0 HE1 MET B 49 8.877 18.271 -2.641 1.00 51.15 H new ATOM 0 HE2 MET B 49 9.967 16.938 -3.088 1.00 51.15 H new ATOM 0 HE3 MET B 49 10.276 17.883 -1.612 1.00 51.15 H new ATOM 2300 N MET B 50 12.293 15.767 -2.186 1.00 73.41 N ATOM 2301 CA MET B 50 11.265 15.386 -1.224 1.00 53.21 C ATOM 2302 C MET B 50 11.869 14.603 -0.063 1.00 3.12 C ATOM 2303 O MET B 50 11.374 14.662 1.061 1.00 20.05 O ATOM 2304 CB MET B 50 10.180 14.551 -1.908 1.00 34.20 C ATOM 2305 CG MET B 50 10.540 13.079 -2.041 1.00 34.23 C ATOM 2306 SD MET B 50 9.346 12.159 -3.030 1.00 14.43 S ATOM 2307 CE MET B 50 7.804 12.783 -2.368 1.00 65.11 C ATOM 0 H MET B 50 12.427 15.101 -2.947 1.00 73.41 H new ATOM 0 HA MET B 50 10.817 16.298 -0.829 1.00 53.21 H new ATOM 0 HB2 MET B 50 9.253 14.640 -1.342 1.00 34.20 H new ATOM 0 HB3 MET B 50 9.988 14.961 -2.900 1.00 34.20 H new ATOM 0 HG2 MET B 50 11.527 12.990 -2.495 1.00 34.23 H new ATOM 0 HG3 MET B 50 10.604 12.633 -1.048 1.00 34.23 H new ATOM 0 HE1 MET B 50 6.993 12.104 -2.632 1.00 65.11 H new ATOM 0 HE2 MET B 50 7.877 12.856 -1.283 1.00 65.11 H new ATOM 0 HE3 MET B 50 7.602 13.769 -2.785 1.00 65.11 H new ATOM 2317 N ASN B 51 12.942 13.871 -0.344 1.00 10.42 N ATOM 2318 CA ASN B 51 13.613 13.076 0.677 1.00 73.03 C ATOM 2319 C ASN B 51 14.345 13.972 1.671 1.00 51.31 C ATOM 2320 O ASN B 51 14.716 13.535 2.760 1.00 61.22 O ATOM 2321 CB ASN B 51 14.600 12.102 0.029 1.00 41.34 C ATOM 2322 CG ASN B 51 14.045 10.694 -0.066 1.00 53.40 C ATOM 2323 OD1 ASN B 51 12.841 10.568 -0.611 1.00 40.12 O flip ATOM 2324 ND2 ASN B 51 14.692 9.731 0.347 1.00 25.24 N flip ATOM 0 H ASN B 51 13.365 13.812 -1.270 1.00 10.42 H new ATOM 0 HA ASN B 51 12.854 12.509 1.216 1.00 73.03 H new ATOM 0 HB2 ASN B 51 14.854 12.457 -0.970 1.00 41.34 H new ATOM 0 HB3 ASN B 51 15.524 12.087 0.607 1.00 41.34 H new ATOM 0 HD21 ASN B 51 15.614 9.875 0.759 1.00 25.24 H new ATOM 0 HD22 ASN B 51 14.306 8.789 0.277 1.00 25.24 H new ATOM 2331 N ILE B 52 14.549 15.228 1.287 1.00 15.14 N ATOM 2332 CA ILE B 52 15.235 16.186 2.145 1.00 71.33 C ATOM 2333 C ILE B 52 14.260 16.869 3.097 1.00 63.34 C ATOM 2334 O ILE B 52 14.623 17.240 4.214 1.00 22.32 O ATOM 2335 CB ILE B 52 15.964 17.262 1.317 1.00 0.12 C ATOM 2336 CG1 ILE B 52 16.817 16.607 0.229 1.00 22.15 C ATOM 2337 CG2 ILE B 52 16.825 18.133 2.220 1.00 64.33 C ATOM 2338 CD1 ILE B 52 17.521 15.349 0.687 1.00 3.43 C ATOM 0 H ILE B 52 14.249 15.605 0.388 1.00 15.14 H new ATOM 0 HA ILE B 52 15.969 15.623 2.722 1.00 71.33 H new ATOM 0 HB ILE B 52 15.219 17.896 0.837 1.00 0.12 H new ATOM 0 HG12 ILE B 52 16.182 16.368 -0.624 1.00 22.15 H new ATOM 0 HG13 ILE B 52 17.561 17.324 -0.118 1.00 22.15 H new ATOM 0 HG21 ILE B 52 17.333 18.888 1.620 1.00 64.33 H new ATOM 0 HG22 ILE B 52 16.194 18.623 2.962 1.00 64.33 H new ATOM 0 HG23 ILE B 52 17.565 17.513 2.726 1.00 64.33 H new ATOM 0 HD11 ILE B 52 18.107 14.940 -0.136 1.00 3.43 H new ATOM 0 HD12 ILE B 52 18.182 15.585 1.521 1.00 3.43 H new ATOM 0 HD13 ILE B 52 16.782 14.614 1.007 1.00 3.43 H new ATOM 2350 N LEU B 53 13.019 17.028 2.650 1.00 63.51 N ATOM 2351 CA LEU B 53 11.989 17.665 3.463 1.00 30.02 C ATOM 2352 C LEU B 53 11.217 16.627 4.273 1.00 3.01 C ATOM 2353 O LEU B 53 10.732 16.915 5.367 1.00 32.54 O ATOM 2354 CB LEU B 53 11.026 18.455 2.576 1.00 71.32 C ATOM 2355 CG LEU B 53 11.150 19.978 2.641 1.00 24.34 C ATOM 2356 CD1 LEU B 53 12.601 20.402 2.483 1.00 64.42 C ATOM 2357 CD2 LEU B 53 10.283 20.629 1.573 1.00 70.41 C ATOM 0 H LEU B 53 12.702 16.725 1.729 1.00 63.51 H new ATOM 0 HA LEU B 53 12.479 18.350 4.155 1.00 30.02 H new ATOM 0 HB2 LEU B 53 11.176 18.142 1.543 1.00 71.32 H new ATOM 0 HB3 LEU B 53 10.006 18.182 2.847 1.00 71.32 H new ATOM 0 HG LEU B 53 10.800 20.311 3.618 1.00 24.34 H new ATOM 0 HD11 LEU B 53 12.670 21.489 2.532 1.00 64.42 H new ATOM 0 HD12 LEU B 53 13.197 19.964 3.284 1.00 64.42 H new ATOM 0 HD13 LEU B 53 12.978 20.057 1.520 1.00 64.42 H new ATOM 0 HD21 LEU B 53 10.383 21.713 1.634 1.00 70.41 H new ATOM 0 HD22 LEU B 53 10.603 20.290 0.588 1.00 70.41 H new ATOM 0 HD23 LEU B 53 9.241 20.352 1.731 1.00 70.41 H new ATOM 2369 N GLN B 54 11.108 15.420 3.728 1.00 45.30 N ATOM 2370 CA GLN B 54 10.396 14.340 4.400 1.00 4.44 C ATOM 2371 C GLN B 54 10.990 14.074 5.781 1.00 73.55 C ATOM 2372 O GLN B 54 10.319 13.535 6.663 1.00 22.03 O ATOM 2373 CB GLN B 54 10.446 13.064 3.557 1.00 31.43 C ATOM 2374 CG GLN B 54 11.793 12.361 3.594 1.00 54.24 C ATOM 2375 CD GLN B 54 11.765 11.007 2.914 1.00 53.44 C ATOM 2376 OE1 GLN B 54 11.104 10.935 1.764 1.00 62.11 O flip ATOM 2377 NE2 GLN B 54 12.329 10.035 3.417 1.00 32.34 N flip ATOM 0 H GLN B 54 11.504 15.165 2.823 1.00 45.30 H new ATOM 0 HA GLN B 54 9.357 14.645 4.523 1.00 4.44 H new ATOM 0 HB2 GLN B 54 9.677 12.376 3.909 1.00 31.43 H new ATOM 0 HB3 GLN B 54 10.203 13.312 2.524 1.00 31.43 H new ATOM 0 HG2 GLN B 54 12.540 12.990 3.110 1.00 54.24 H new ATOM 0 HG3 GLN B 54 12.105 12.236 4.631 1.00 54.24 H new ATOM 0 HE21 GLN B 54 12.826 10.135 4.302 1.00 32.34 H new ATOM 0 HE22 GLN B 54 12.300 9.129 2.948 1.00 32.34 H new ATOM 2386 N THR B 55 12.250 14.453 5.961 1.00 55.12 N ATOM 2387 CA THR B 55 12.934 14.254 7.232 1.00 13.51 C ATOM 2388 C THR B 55 12.165 14.903 8.377 1.00 42.11 C ATOM 2389 O THR B 55 11.446 15.885 8.196 1.00 72.25 O ATOM 2390 CB THR B 55 14.362 14.829 7.198 1.00 53.41 C ATOM 2391 OG1 THR B 55 14.367 16.092 6.522 1.00 50.54 O ATOM 2392 CG2 THR B 55 15.315 13.871 6.499 1.00 63.21 C ATOM 0 H THR B 55 12.819 14.900 5.242 1.00 55.12 H new ATOM 0 HA THR B 55 12.988 13.178 7.397 1.00 13.51 H new ATOM 0 HB THR B 55 14.698 14.966 8.226 1.00 53.41 H new ATOM 0 HG1 THR B 55 14.505 15.949 5.562 1.00 50.54 H new ATOM 0 HG21 THR B 55 16.317 14.299 6.487 1.00 63.21 H new ATOM 0 HG22 THR B 55 15.332 12.921 7.033 1.00 63.21 H new ATOM 0 HG23 THR B 55 14.979 13.706 5.475 1.00 63.21 H new ATOM 2400 N PRO B 56 12.319 14.343 9.586 1.00 31.25 N ATOM 2401 CA PRO B 56 11.647 14.852 10.785 1.00 41.22 C ATOM 2402 C PRO B 56 12.200 16.201 11.232 1.00 3.50 C ATOM 2403 O PRO B 56 11.506 16.983 11.881 1.00 61.54 O ATOM 2404 CB PRO B 56 11.939 13.779 11.838 1.00 43.23 C ATOM 2405 CG PRO B 56 13.199 13.132 11.379 1.00 22.11 C ATOM 2406 CD PRO B 56 13.161 13.170 9.876 1.00 60.25 C ATOM 0 HA PRO B 56 10.584 15.024 10.614 1.00 41.22 H new ATOM 0 HB2 PRO B 56 12.057 14.218 12.829 1.00 43.23 H new ATOM 0 HB3 PRO B 56 11.125 13.057 11.904 1.00 43.23 H new ATOM 0 HG2 PRO B 56 14.071 13.662 11.761 1.00 22.11 H new ATOM 0 HG3 PRO B 56 13.266 12.106 11.742 1.00 22.11 H new ATOM 0 HD2 PRO B 56 14.159 13.277 9.451 1.00 60.25 H new ATOM 0 HD3 PRO B 56 12.734 12.257 9.462 1.00 60.25 H new ATOM 2414 N GLN B 57 13.453 16.468 10.878 1.00 42.31 N ATOM 2415 CA GLN B 57 14.100 17.723 11.243 1.00 55.32 C ATOM 2416 C GLN B 57 13.533 18.883 10.430 1.00 1.51 C ATOM 2417 O GLN B 57 13.362 19.989 10.942 1.00 23.51 O ATOM 2418 CB GLN B 57 15.611 17.624 11.031 1.00 61.00 C ATOM 2419 CG GLN B 57 16.384 18.798 11.609 1.00 72.54 C ATOM 2420 CD GLN B 57 17.185 18.421 12.839 1.00 74.05 C ATOM 2421 OE1 GLN B 57 18.412 18.319 12.789 1.00 63.42 O ATOM 2422 NE2 GLN B 57 16.495 18.211 13.954 1.00 41.13 N ATOM 0 H GLN B 57 14.040 15.832 10.339 1.00 42.31 H new ATOM 0 HA GLN B 57 13.902 17.912 12.298 1.00 55.32 H new ATOM 0 HB2 GLN B 57 15.974 16.702 11.485 1.00 61.00 H new ATOM 0 HB3 GLN B 57 15.816 17.555 9.963 1.00 61.00 H new ATOM 0 HG2 GLN B 57 17.058 19.194 10.849 1.00 72.54 H new ATOM 0 HG3 GLN B 57 15.687 19.596 11.865 1.00 72.54 H new ATOM 0 HE21 GLN B 57 15.479 18.306 13.951 1.00 41.13 H new ATOM 0 HE22 GLN B 57 16.981 17.954 14.814 1.00 41.13 H new ATOM 2431 N PHE B 58 13.247 18.622 9.159 1.00 72.25 N ATOM 2432 CA PHE B 58 12.702 19.645 8.273 1.00 73.52 C ATOM 2433 C PHE B 58 11.252 19.336 7.914 1.00 1.21 C ATOM 2434 O PHE B 58 10.870 19.363 6.743 1.00 54.13 O ATOM 2435 CB PHE B 58 13.544 19.748 7.000 1.00 21.34 C ATOM 2436 CG PHE B 58 15.001 19.996 7.264 1.00 1.42 C ATOM 2437 CD1 PHE B 58 15.478 21.286 7.437 1.00 54.32 C ATOM 2438 CD2 PHE B 58 15.895 18.941 7.338 1.00 51.33 C ATOM 2439 CE1 PHE B 58 16.819 21.517 7.678 1.00 23.24 C ATOM 2440 CE2 PHE B 58 17.238 19.166 7.581 1.00 4.43 C ATOM 2441 CZ PHE B 58 17.699 20.456 7.752 1.00 13.33 C ATOM 0 H PHE B 58 13.383 17.712 8.719 1.00 72.25 H new ATOM 0 HA PHE B 58 12.732 20.600 8.798 1.00 73.52 H new ATOM 0 HB2 PHE B 58 13.438 18.826 6.428 1.00 21.34 H new ATOM 0 HB3 PHE B 58 13.153 20.554 6.379 1.00 21.34 H new ATOM 0 HD1 PHE B 58 14.794 22.120 7.383 1.00 54.32 H new ATOM 0 HD2 PHE B 58 15.539 17.930 7.204 1.00 51.33 H new ATOM 0 HE1 PHE B 58 17.178 22.527 7.808 1.00 23.24 H new ATOM 0 HE2 PHE B 58 17.925 18.334 7.637 1.00 4.43 H new ATOM 0 HZ PHE B 58 18.747 20.635 7.943 1.00 13.33 H new ATOM 2451 N THR B 59 10.446 19.040 8.929 1.00 3.42 N ATOM 2452 CA THR B 59 9.038 18.725 8.723 1.00 32.14 C ATOM 2453 C THR B 59 8.189 19.990 8.697 1.00 21.44 C ATOM 2454 O THR B 59 7.188 20.064 7.983 1.00 24.22 O ATOM 2455 CB THR B 59 8.506 17.784 9.820 1.00 53.35 C ATOM 2456 OG1 THR B 59 7.138 17.452 9.559 1.00 50.44 O ATOM 2457 CG2 THR B 59 8.625 18.432 11.191 1.00 63.52 C ATOM 0 H THR B 59 10.745 19.012 9.904 1.00 3.42 H new ATOM 0 HA THR B 59 8.965 18.223 7.758 1.00 32.14 H new ATOM 0 HB THR B 59 9.107 16.875 9.812 1.00 53.35 H new ATOM 0 HG1 THR B 59 6.807 16.852 10.260 1.00 50.44 H new ATOM 0 HG21 THR B 59 8.243 17.750 11.950 1.00 63.52 H new ATOM 0 HG22 THR B 59 9.671 18.656 11.398 1.00 63.52 H new ATOM 0 HG23 THR B 59 8.046 19.355 11.209 1.00 63.52 H new ATOM 2465 N LYS B 60 8.594 20.984 9.480 1.00 13.34 N ATOM 2466 CA LYS B 60 7.870 22.249 9.547 1.00 2.41 C ATOM 2467 C LYS B 60 8.140 23.096 8.307 1.00 33.42 C ATOM 2468 O LYS B 60 7.394 24.028 8.006 1.00 21.23 O ATOM 2469 CB LYS B 60 8.273 23.024 10.804 1.00 14.22 C ATOM 2470 CG LYS B 60 9.766 23.278 10.909 1.00 61.42 C ATOM 2471 CD LYS B 60 10.131 23.920 12.238 1.00 54.34 C ATOM 2472 CE LYS B 60 11.249 23.160 12.934 1.00 31.41 C ATOM 2473 NZ LYS B 60 11.672 23.830 14.196 1.00 31.11 N ATOM 0 H LYS B 60 9.420 20.939 10.077 1.00 13.34 H new ATOM 0 HA LYS B 60 6.804 22.028 9.590 1.00 2.41 H new ATOM 0 HB2 LYS B 60 7.749 23.980 10.815 1.00 14.22 H new ATOM 0 HB3 LYS B 60 7.944 22.470 11.683 1.00 14.22 H new ATOM 0 HG2 LYS B 60 10.305 22.337 10.799 1.00 61.42 H new ATOM 0 HG3 LYS B 60 10.084 23.925 10.092 1.00 61.42 H new ATOM 0 HD2 LYS B 60 10.439 24.952 12.072 1.00 54.34 H new ATOM 0 HD3 LYS B 60 9.253 23.949 12.883 1.00 54.34 H new ATOM 0 HE2 LYS B 60 10.916 22.146 13.155 1.00 31.41 H new ATOM 0 HE3 LYS B 60 12.104 23.076 12.263 1.00 31.41 H new ATOM 0 HZ1 LYS B 60 12.436 23.282 14.641 1.00 31.11 H new ATOM 0 HZ2 LYS B 60 12.013 24.789 13.982 1.00 31.11 H new ATOM 0 HZ3 LYS B 60 10.863 23.888 14.847 1.00 31.11 H new ATOM 2487 N TYR B 61 9.207 22.764 7.590 1.00 63.31 N ATOM 2488 CA TYR B 61 9.574 23.494 6.383 1.00 12.35 C ATOM 2489 C TYR B 61 9.298 22.660 5.135 1.00 43.03 C ATOM 2490 O TYR B 61 10.209 22.337 4.374 1.00 15.42 O ATOM 2491 CB TYR B 61 11.052 23.887 6.429 1.00 51.41 C ATOM 2492 CG TYR B 61 11.529 24.289 7.806 1.00 52.31 C ATOM 2493 CD1 TYR B 61 11.218 25.536 8.334 1.00 43.25 C ATOM 2494 CD2 TYR B 61 12.289 23.421 8.580 1.00 24.22 C ATOM 2495 CE1 TYR B 61 11.653 25.907 9.592 1.00 20.34 C ATOM 2496 CE2 TYR B 61 12.727 23.783 9.839 1.00 72.43 C ATOM 2497 CZ TYR B 61 12.406 25.027 10.340 1.00 62.03 C ATOM 2498 OH TYR B 61 12.839 25.393 11.595 1.00 73.32 O ATOM 0 H TYR B 61 9.833 21.994 7.824 1.00 63.31 H new ATOM 0 HA TYR B 61 8.965 24.397 6.337 1.00 12.35 H new ATOM 0 HB2 TYR B 61 11.653 23.049 6.076 1.00 51.41 H new ATOM 0 HB3 TYR B 61 11.221 24.714 5.739 1.00 51.41 H new ATOM 0 HD1 TYR B 61 10.626 26.227 7.752 1.00 43.25 H new ATOM 0 HD2 TYR B 61 12.542 22.446 8.190 1.00 24.22 H new ATOM 0 HE1 TYR B 61 11.405 26.881 9.987 1.00 20.34 H new ATOM 0 HE2 TYR B 61 13.317 23.096 10.427 1.00 72.43 H new ATOM 0 HH TYR B 61 12.342 26.182 11.895 1.00 73.32 H new ATOM 2508 N THR B 62 8.030 22.313 4.933 1.00 34.42 N ATOM 2509 CA THR B 62 7.630 21.517 3.780 1.00 72.42 C ATOM 2510 C THR B 62 7.089 22.400 2.662 1.00 31.24 C ATOM 2511 O THR B 62 7.701 22.518 1.599 1.00 31.52 O ATOM 2512 CB THR B 62 6.559 20.476 4.160 1.00 33.53 C ATOM 2513 OG1 THR B 62 6.333 20.500 5.573 1.00 23.01 O ATOM 2514 CG2 THR B 62 6.987 19.080 3.732 1.00 4.41 C ATOM 0 H THR B 62 7.263 22.571 5.554 1.00 34.42 H new ATOM 0 HA THR B 62 8.523 20.999 3.430 1.00 72.42 H new ATOM 0 HB THR B 62 5.635 20.730 3.641 1.00 33.53 H new ATOM 0 HG1 THR B 62 7.136 20.186 6.038 1.00 23.01 H new ATOM 0 HG21 THR B 62 6.216 18.362 4.010 1.00 4.41 H new ATOM 0 HG22 THR B 62 7.130 19.058 2.652 1.00 4.41 H new ATOM 0 HG23 THR B 62 7.922 18.818 4.227 1.00 4.41 H new ATOM 2522 N LEU B 63 5.940 23.020 2.906 1.00 12.13 N ATOM 2523 CA LEU B 63 5.317 23.895 1.920 1.00 1.11 C ATOM 2524 C LEU B 63 5.455 25.359 2.325 1.00 22.24 C ATOM 2525 O LEU B 63 5.018 26.256 1.606 1.00 42.13 O ATOM 2526 CB LEU B 63 3.839 23.537 1.753 1.00 73.21 C ATOM 2527 CG LEU B 63 2.862 24.277 2.667 1.00 75.31 C ATOM 2528 CD1 LEU B 63 2.257 25.471 1.947 1.00 21.21 C ATOM 2529 CD2 LEU B 63 1.770 23.335 3.154 1.00 54.43 C ATOM 0 H LEU B 63 5.420 22.933 3.779 1.00 12.13 H new ATOM 0 HA LEU B 63 5.829 23.751 0.969 1.00 1.11 H new ATOM 0 HB2 LEU B 63 3.554 23.729 0.719 1.00 73.21 H new ATOM 0 HB3 LEU B 63 3.724 22.466 1.922 1.00 73.21 H new ATOM 0 HG LEU B 63 3.412 24.643 3.534 1.00 75.31 H new ATOM 0 HD11 LEU B 63 1.564 25.985 2.613 1.00 21.21 H new ATOM 0 HD12 LEU B 63 3.050 26.157 1.649 1.00 21.21 H new ATOM 0 HD13 LEU B 63 1.722 25.129 1.061 1.00 21.21 H new ATOM 0 HD21 LEU B 63 1.084 23.878 3.803 1.00 54.43 H new ATOM 0 HD22 LEU B 63 1.223 22.939 2.298 1.00 54.43 H new ATOM 0 HD23 LEU B 63 2.220 22.512 3.710 1.00 54.43 H new ATOM 2541 N TRP B 64 6.067 25.592 3.481 1.00 1.21 N ATOM 2542 CA TRP B 64 6.265 26.947 3.981 1.00 43.23 C ATOM 2543 C TRP B 64 6.897 27.834 2.916 1.00 72.02 C ATOM 2544 O TRP B 64 6.727 29.053 2.927 1.00 64.33 O ATOM 2545 CB TRP B 64 7.143 26.928 5.234 1.00 62.22 C ATOM 2546 CG TRP B 64 8.579 27.254 4.956 1.00 4.30 C ATOM 2547 CD1 TRP B 64 9.261 28.365 5.367 1.00 74.40 C ATOM 2548 CD2 TRP B 64 9.509 26.465 4.206 1.00 4.15 C ATOM 2549 NE1 TRP B 64 10.558 28.313 4.917 1.00 54.00 N ATOM 2550 CE2 TRP B 64 10.735 27.157 4.204 1.00 33.35 C ATOM 2551 CE3 TRP B 64 9.425 25.240 3.539 1.00 30.31 C ATOM 2552 CZ2 TRP B 64 11.867 26.664 3.558 1.00 50.25 C ATOM 2553 CZ3 TRP B 64 10.547 24.753 2.899 1.00 42.23 C ATOM 2554 CH2 TRP B 64 11.755 25.463 2.913 1.00 30.42 C ATOM 0 H TRP B 64 6.434 24.860 4.089 1.00 1.21 H new ATOM 0 HA TRP B 64 5.289 27.359 4.237 1.00 43.23 H new ATOM 0 HB2 TRP B 64 6.749 27.643 5.957 1.00 62.22 H new ATOM 0 HB3 TRP B 64 7.084 25.942 5.696 1.00 62.22 H new ATOM 0 HD1 TRP B 64 8.842 29.166 5.958 1.00 74.40 H new ATOM 0 HE1 TRP B 64 11.273 29.020 5.086 1.00 54.00 H new ATOM 0 HE3 TRP B 64 8.499 24.684 3.524 1.00 30.31 H new ATOM 0 HZ2 TRP B 64 12.799 27.210 3.566 1.00 50.25 H new ATOM 0 HZ3 TRP B 64 10.493 23.808 2.378 1.00 42.23 H new ATOM 0 HH2 TRP B 64 12.615 25.054 2.404 1.00 30.42 H new ATOM 2565 N PHE B 65 7.629 27.216 1.994 1.00 3.22 N ATOM 2566 CA PHE B 65 8.288 27.950 0.921 1.00 51.24 C ATOM 2567 C PHE B 65 7.833 27.443 -0.444 1.00 44.13 C ATOM 2568 O PHE B 65 7.755 28.206 -1.407 1.00 61.53 O ATOM 2569 CB PHE B 65 9.808 27.821 1.044 1.00 33.14 C ATOM 2570 CG PHE B 65 10.481 29.081 1.507 1.00 11.11 C ATOM 2571 CD1 PHE B 65 9.884 29.891 2.460 1.00 22.30 C ATOM 2572 CD2 PHE B 65 11.709 29.458 0.989 1.00 2.15 C ATOM 2573 CE1 PHE B 65 10.500 31.051 2.889 1.00 2.32 C ATOM 2574 CE2 PHE B 65 12.330 30.616 1.414 1.00 4.54 C ATOM 2575 CZ PHE B 65 11.725 31.415 2.364 1.00 1.24 C ATOM 0 H PHE B 65 7.780 26.208 1.969 1.00 3.22 H new ATOM 0 HA PHE B 65 8.011 29.000 1.010 1.00 51.24 H new ATOM 0 HB2 PHE B 65 10.041 27.017 1.742 1.00 33.14 H new ATOM 0 HB3 PHE B 65 10.220 27.533 0.077 1.00 33.14 H new ATOM 0 HD1 PHE B 65 8.926 29.612 2.872 1.00 22.30 H new ATOM 0 HD2 PHE B 65 12.187 28.839 0.244 1.00 2.15 H new ATOM 0 HE1 PHE B 65 10.025 31.672 3.634 1.00 2.32 H new ATOM 0 HE2 PHE B 65 13.289 30.897 1.003 1.00 4.54 H new ATOM 0 HZ PHE B 65 12.208 32.322 2.696 1.00 1.24 H new ATOM 2585 N MET B 66 7.533 26.150 -0.519 1.00 55.55 N ATOM 2586 CA MET B 66 7.085 25.540 -1.766 1.00 63.34 C ATOM 2587 C MET B 66 5.931 26.332 -2.374 1.00 2.10 C ATOM 2588 O MET B 66 5.825 26.457 -3.595 1.00 23.20 O ATOM 2589 CB MET B 66 6.655 24.092 -1.525 1.00 52.14 C ATOM 2590 CG MET B 66 7.040 23.148 -2.652 1.00 45.22 C ATOM 2591 SD MET B 66 5.651 22.157 -3.233 1.00 33.32 S ATOM 2592 CE MET B 66 4.665 23.407 -4.055 1.00 54.53 C ATOM 0 H MET B 66 7.592 25.505 0.269 1.00 55.55 H new ATOM 0 HA MET B 66 7.919 25.551 -2.467 1.00 63.34 H new ATOM 0 HB2 MET B 66 7.103 23.738 -0.597 1.00 52.14 H new ATOM 0 HB3 MET B 66 5.574 24.061 -1.389 1.00 52.14 H new ATOM 0 HG2 MET B 66 7.442 23.726 -3.484 1.00 45.22 H new ATOM 0 HG3 MET B 66 7.836 22.486 -2.310 1.00 45.22 H new ATOM 0 HE1 MET B 66 4.295 23.014 -5.002 1.00 54.53 H new ATOM 0 HE2 MET B 66 3.822 23.680 -3.421 1.00 54.53 H new ATOM 0 HE3 MET B 66 5.278 24.288 -4.243 1.00 54.53 H new ATOM 2602 N THR B 67 5.067 26.865 -1.514 1.00 4.01 N ATOM 2603 CA THR B 67 3.921 27.642 -1.967 1.00 64.01 C ATOM 2604 C THR B 67 3.883 29.009 -1.293 1.00 4.11 C ATOM 2605 O THR B 67 2.959 29.793 -1.510 1.00 25.32 O ATOM 2606 CB THR B 67 2.596 26.907 -1.685 1.00 50.32 C ATOM 2607 OG1 THR B 67 2.720 25.524 -2.039 1.00 43.04 O ATOM 2608 CG2 THR B 67 1.451 27.535 -2.465 1.00 73.01 C ATOM 0 H THR B 67 5.140 26.772 -0.501 1.00 4.01 H new ATOM 0 HA THR B 67 4.034 27.773 -3.043 1.00 64.01 H new ATOM 0 HB THR B 67 2.378 26.992 -0.621 1.00 50.32 H new ATOM 0 HG1 THR B 67 1.875 25.062 -1.856 1.00 43.04 H new ATOM 0 HG21 THR B 67 0.527 26.999 -2.249 1.00 73.01 H new ATOM 0 HG22 THR B 67 1.341 28.579 -2.173 1.00 73.01 H new ATOM 0 HG23 THR B 67 1.663 27.477 -3.533 1.00 73.01 H new ATOM 2616 N ASN B 68 4.893 29.289 -0.477 1.00 11.41 N ATOM 2617 CA ASN B 68 4.975 30.563 0.228 1.00 74.22 C ATOM 2618 C ASN B 68 3.807 30.724 1.197 1.00 14.40 C ATOM 2619 O ASN B 68 3.214 31.798 1.295 1.00 0.14 O ATOM 2620 CB ASN B 68 4.988 31.723 -0.770 1.00 72.14 C ATOM 2621 CG ASN B 68 5.851 31.431 -1.983 1.00 24.42 C ATOM 2622 OD1 ASN B 68 6.985 30.970 -1.855 1.00 31.00 O ATOM 2623 ND2 ASN B 68 5.314 31.699 -3.167 1.00 25.24 N ATOM 0 H ASN B 68 5.666 28.651 -0.287 1.00 11.41 H new ATOM 0 HA ASN B 68 5.903 30.574 0.799 1.00 74.22 H new ATOM 0 HB2 ASN B 68 3.968 31.931 -1.094 1.00 72.14 H new ATOM 0 HB3 ASN B 68 5.355 32.622 -0.274 1.00 72.14 H new ATOM 0 HD21 ASN B 68 5.846 31.523 -4.020 1.00 25.24 H new ATOM 0 HD22 ASN B 68 4.370 32.081 -3.224 1.00 25.24 H new ATOM 2630 N GLN B 69 3.484 29.650 1.910 1.00 42.21 N ATOM 2631 CA GLN B 69 2.388 29.674 2.871 1.00 70.13 C ATOM 2632 C GLN B 69 2.749 28.888 4.128 1.00 10.34 C ATOM 2633 O GLN B 69 2.833 27.660 4.101 1.00 41.40 O ATOM 2634 CB GLN B 69 1.119 29.097 2.241 1.00 35.41 C ATOM 2635 CG GLN B 69 -0.153 29.467 2.989 1.00 60.42 C ATOM 2636 CD GLN B 69 -0.751 30.774 2.511 1.00 22.34 C ATOM 2637 OE1 GLN B 69 -1.260 30.866 1.393 1.00 42.13 O ATOM 2638 NE2 GLN B 69 -0.694 31.796 3.357 1.00 14.11 N ATOM 0 H GLN B 69 3.965 28.753 1.840 1.00 42.21 H new ATOM 0 HA GLN B 69 2.207 30.711 3.153 1.00 70.13 H new ATOM 0 HB2 GLN B 69 1.041 29.449 1.212 1.00 35.41 H new ATOM 0 HB3 GLN B 69 1.204 28.011 2.201 1.00 35.41 H new ATOM 0 HG2 GLN B 69 -0.887 28.670 2.867 1.00 60.42 H new ATOM 0 HG3 GLN B 69 0.065 29.540 4.055 1.00 60.42 H new ATOM 0 HE21 GLN B 69 -0.263 31.676 4.274 1.00 14.11 H new ATOM 0 HE22 GLN B 69 -1.081 32.701 3.090 1.00 14.11 H new ATOM 2647 N ILE B 70 2.960 29.604 5.227 1.00 24.34 N ATOM 2648 CA ILE B 70 3.311 28.975 6.493 1.00 24.43 C ATOM 2649 C ILE B 70 2.083 28.372 7.166 1.00 41.10 C ATOM 2650 O ILE B 70 1.082 29.056 7.381 1.00 43.13 O ATOM 2651 CB ILE B 70 3.972 29.978 7.458 1.00 12.12 C ATOM 2652 CG1 ILE B 70 3.064 31.192 7.665 1.00 1.24 C ATOM 2653 CG2 ILE B 70 5.330 30.410 6.924 1.00 40.03 C ATOM 2654 CD1 ILE B 70 2.538 31.319 9.077 1.00 23.21 C ATOM 0 H ILE B 70 2.894 30.621 5.266 1.00 24.34 H new ATOM 0 HA ILE B 70 4.023 28.182 6.264 1.00 24.43 H new ATOM 0 HB ILE B 70 4.121 29.490 8.421 1.00 12.12 H new ATOM 0 HG12 ILE B 70 3.616 32.096 7.409 1.00 1.24 H new ATOM 0 HG13 ILE B 70 2.221 31.127 6.976 1.00 1.24 H new ATOM 0 HG21 ILE B 70 5.785 31.118 7.616 1.00 40.03 H new ATOM 0 HG22 ILE B 70 5.975 29.537 6.822 1.00 40.03 H new ATOM 0 HG23 ILE B 70 5.204 30.884 5.951 1.00 40.03 H new ATOM 0 HD11 ILE B 70 1.902 32.201 9.150 1.00 23.21 H new ATOM 0 HD12 ILE B 70 1.958 30.432 9.330 1.00 23.21 H new ATOM 0 HD13 ILE B 70 3.374 31.416 9.769 1.00 23.21 H new ATOM 2666 N ALA B 71 2.167 27.088 7.500 1.00 31.41 N ATOM 2667 CA ALA B 71 1.064 26.395 8.152 1.00 42.14 C ATOM 2668 C ALA B 71 1.429 26.007 9.581 1.00 13.21 C ATOM 2669 O ALA B 71 1.694 24.844 9.886 1.00 44.11 O ATOM 2670 CB ALA B 71 0.669 25.162 7.353 1.00 21.42 C ATOM 0 H ALA B 71 2.988 26.507 7.329 1.00 31.41 H new ATOM 0 HA ALA B 71 0.213 27.075 8.193 1.00 42.14 H new ATOM 0 HB1 ALA B 71 -0.156 24.654 7.852 1.00 21.42 H new ATOM 0 HB2 ALA B 71 0.359 25.461 6.352 1.00 21.42 H new ATOM 0 HB3 ALA B 71 1.521 24.486 7.282 1.00 21.42 H new ATOM 2676 N PRO B 72 1.443 27.003 10.481 1.00 64.10 N ATOM 2677 CA PRO B 72 1.773 26.790 11.893 1.00 11.04 C ATOM 2678 C PRO B 72 0.691 26.009 12.630 1.00 33.42 C ATOM 2679 O PRO B 72 0.960 25.367 13.645 1.00 25.43 O ATOM 2680 CB PRO B 72 1.881 28.211 12.449 1.00 2.43 C ATOM 2681 CG PRO B 72 1.026 29.036 11.551 1.00 51.11 C ATOM 2682 CD PRO B 72 1.137 28.413 10.187 1.00 31.23 C ATOM 0 HA PRO B 72 2.681 26.200 12.015 1.00 11.04 H new ATOM 0 HB2 PRO B 72 1.533 28.260 13.481 1.00 2.43 H new ATOM 0 HB3 PRO B 72 2.913 28.561 12.444 1.00 2.43 H new ATOM 0 HG2 PRO B 72 -0.009 29.042 11.894 1.00 51.11 H new ATOM 0 HG3 PRO B 72 1.363 30.073 11.535 1.00 51.11 H new ATOM 0 HD2 PRO B 72 0.210 28.514 9.622 1.00 31.23 H new ATOM 0 HD3 PRO B 72 1.924 28.880 9.595 1.00 31.23 H new ATOM 2690 N GLU B 73 -0.531 26.067 12.111 1.00 4.23 N ATOM 2691 CA GLU B 73 -1.654 25.364 12.722 1.00 61.34 C ATOM 2692 C GLU B 73 -1.361 23.871 12.841 1.00 54.44 C ATOM 2693 O GLU B 73 -1.924 23.183 13.694 1.00 31.22 O ATOM 2694 CB GLU B 73 -2.928 25.581 11.903 1.00 60.13 C ATOM 2695 CG GLU B 73 -3.265 27.046 11.680 1.00 64.33 C ATOM 2696 CD GLU B 73 -3.489 27.797 12.977 1.00 11.13 C ATOM 2697 OE1 GLU B 73 -4.563 27.619 13.588 1.00 41.10 O ATOM 2698 OE2 GLU B 73 -2.590 28.564 13.383 1.00 33.02 O ATOM 0 H GLU B 73 -0.769 26.593 11.270 1.00 4.23 H new ATOM 0 HA GLU B 73 -1.801 25.769 13.723 1.00 61.34 H new ATOM 0 HB2 GLU B 73 -2.816 25.091 10.936 1.00 60.13 H new ATOM 0 HB3 GLU B 73 -3.763 25.098 12.410 1.00 60.13 H new ATOM 0 HG2 GLU B 73 -2.456 27.521 11.125 1.00 64.33 H new ATOM 0 HG3 GLU B 73 -4.161 27.119 11.063 1.00 64.33 H new ATOM 2705 N SER B 74 -0.478 23.377 11.979 1.00 3.13 N ATOM 2706 CA SER B 74 -0.114 21.965 11.984 1.00 54.43 C ATOM 2707 C SER B 74 1.324 21.777 12.462 1.00 41.34 C ATOM 2708 O SER B 74 1.685 20.717 12.971 1.00 62.25 O ATOM 2709 CB SER B 74 -0.279 21.369 10.585 1.00 12.33 C ATOM 2710 OG SER B 74 -1.633 21.035 10.329 1.00 21.43 O ATOM 0 H SER B 74 -0.002 23.933 11.269 1.00 3.13 H new ATOM 0 HA SER B 74 -0.780 21.446 12.673 1.00 54.43 H new ATOM 0 HB2 SER B 74 0.070 22.083 9.839 1.00 12.33 H new ATOM 0 HB3 SER B 74 0.343 20.479 10.490 1.00 12.33 H new ATOM 0 HG SER B 74 -1.685 20.117 9.990 1.00 21.43 H new ATOM 2716 N GLY B 75 2.138 22.814 12.295 1.00 32.12 N ATOM 2717 CA GLY B 75 3.525 22.744 12.713 1.00 40.12 C ATOM 2718 C GLY B 75 4.488 23.069 11.589 1.00 61.53 C ATOM 2719 O GLY B 75 5.524 22.421 11.445 1.00 74.03 O ATOM 0 H GLY B 75 1.861 23.702 11.877 1.00 32.12 H new ATOM 0 HA2 GLY B 75 3.688 23.437 13.538 1.00 40.12 H new ATOM 0 HA3 GLY B 75 3.737 21.744 13.091 1.00 40.12 H new ATOM 2723 N GLN B 76 4.143 24.073 10.789 1.00 5.14 N ATOM 2724 CA GLN B 76 4.984 24.481 9.670 1.00 30.43 C ATOM 2725 C GLN B 76 5.189 25.991 9.665 1.00 1.04 C ATOM 2726 O GLN B 76 4.235 26.756 9.512 1.00 20.13 O ATOM 2727 CB GLN B 76 4.361 24.033 8.346 1.00 34.10 C ATOM 2728 CG GLN B 76 4.660 22.586 7.991 1.00 32.22 C ATOM 2729 CD GLN B 76 4.045 21.605 8.970 1.00 51.40 C ATOM 2730 OE1 GLN B 76 2.993 21.870 9.554 1.00 11.02 O ATOM 2731 NE2 GLN B 76 4.700 20.465 9.155 1.00 72.22 N ATOM 0 H GLN B 76 3.288 24.618 10.895 1.00 5.14 H new ATOM 0 HA GLN B 76 5.956 24.002 9.786 1.00 30.43 H new ATOM 0 HB2 GLN B 76 3.281 24.170 8.398 1.00 34.10 H new ATOM 0 HB3 GLN B 76 4.726 24.677 7.546 1.00 34.10 H new ATOM 0 HG2 GLN B 76 4.285 22.377 6.989 1.00 32.22 H new ATOM 0 HG3 GLN B 76 5.740 22.438 7.964 1.00 32.22 H new ATOM 0 HE21 GLN B 76 5.568 20.288 8.650 1.00 72.22 H new ATOM 0 HE22 GLN B 76 4.335 19.766 9.802 1.00 72.22 H new ATOM 2740 N ILE B 77 6.437 26.415 9.831 1.00 41.52 N ATOM 2741 CA ILE B 77 6.766 27.835 9.845 1.00 50.31 C ATOM 2742 C ILE B 77 8.115 28.093 9.183 1.00 5.22 C ATOM 2743 O ILE B 77 8.831 27.159 8.825 1.00 61.33 O ATOM 2744 CB ILE B 77 6.796 28.392 11.282 1.00 44.11 C ATOM 2745 CG1 ILE B 77 8.116 28.026 11.965 1.00 70.24 C ATOM 2746 CG2 ILE B 77 5.615 27.863 12.080 1.00 64.41 C ATOM 2747 CD1 ILE B 77 8.372 26.537 12.026 1.00 2.32 C ATOM 0 H ILE B 77 7.237 25.795 9.958 1.00 41.52 H new ATOM 0 HA ILE B 77 5.985 28.346 9.282 1.00 50.31 H new ATOM 0 HB ILE B 77 6.720 29.478 11.237 1.00 44.11 H new ATOM 0 HG12 ILE B 77 8.937 28.506 11.432 1.00 70.24 H new ATOM 0 HG13 ILE B 77 8.115 28.428 12.978 1.00 70.24 H new ATOM 0 HG21 ILE B 77 5.650 28.265 13.092 1.00 64.41 H new ATOM 0 HG22 ILE B 77 4.685 28.169 11.600 1.00 64.41 H new ATOM 0 HG23 ILE B 77 5.661 26.775 12.120 1.00 64.41 H new ATOM 0 HD11 ILE B 77 9.324 26.352 12.523 1.00 2.32 H new ATOM 0 HD12 ILE B 77 7.571 26.053 12.585 1.00 2.32 H new ATOM 0 HD13 ILE B 77 8.405 26.132 11.015 1.00 2.32 H new ATOM 2759 N ALA B 78 8.455 29.368 9.024 1.00 60.23 N ATOM 2760 CA ALA B 78 9.720 29.750 8.408 1.00 30.33 C ATOM 2761 C ALA B 78 10.805 29.949 9.461 1.00 42.43 C ATOM 2762 O ALA B 78 10.551 30.428 10.566 1.00 1.45 O ATOM 2763 CB ALA B 78 9.543 31.016 7.583 1.00 22.31 C ATOM 0 H ALA B 78 7.872 30.154 9.313 1.00 60.23 H new ATOM 0 HA ALA B 78 10.035 28.941 7.749 1.00 30.33 H new ATOM 0 HB1 ALA B 78 10.495 31.290 7.129 1.00 22.31 H new ATOM 0 HB2 ALA B 78 8.805 30.840 6.801 1.00 22.31 H new ATOM 0 HB3 ALA B 78 9.202 31.826 8.228 1.00 22.31 H new ATOM 2769 N PRO B 79 12.045 29.574 9.112 1.00 54.52 N ATOM 2770 CA PRO B 79 13.194 29.702 10.013 1.00 53.33 C ATOM 2771 C PRO B 79 13.593 31.156 10.241 1.00 52.42 C ATOM 2772 O PRO B 79 12.855 32.074 9.885 1.00 11.10 O ATOM 2773 CB PRO B 79 14.307 28.951 9.279 1.00 0.21 C ATOM 2774 CG PRO B 79 13.924 29.019 7.840 1.00 1.12 C ATOM 2775 CD PRO B 79 12.420 28.996 7.810 1.00 63.55 C ATOM 0 HA PRO B 79 12.978 29.307 11.006 1.00 53.33 H new ATOM 0 HB2 PRO B 79 15.278 29.414 9.453 1.00 0.21 H new ATOM 0 HB3 PRO B 79 14.380 27.919 9.621 1.00 0.21 H new ATOM 0 HG2 PRO B 79 14.310 29.927 7.376 1.00 1.12 H new ATOM 0 HG3 PRO B 79 14.338 28.177 7.286 1.00 1.12 H new ATOM 0 HD2 PRO B 79 12.025 29.583 6.981 1.00 63.55 H new ATOM 0 HD3 PRO B 79 12.036 27.983 7.694 1.00 63.55 H new ATOM 2783 N ALA B 80 14.763 31.356 10.837 1.00 25.42 N ATOM 2784 CA ALA B 80 15.261 32.700 11.110 1.00 0.54 C ATOM 2785 C ALA B 80 16.080 33.230 9.938 1.00 35.22 C ATOM 2786 O ALA B 80 16.228 34.441 9.769 1.00 62.14 O ATOM 2787 CB ALA B 80 16.093 32.705 12.383 1.00 73.13 C ATOM 0 H ALA B 80 15.384 30.606 11.140 1.00 25.42 H new ATOM 0 HA ALA B 80 14.403 33.358 11.247 1.00 0.54 H new ATOM 0 HB1 ALA B 80 16.458 33.714 12.575 1.00 73.13 H new ATOM 0 HB2 ALA B 80 15.478 32.376 13.221 1.00 73.13 H new ATOM 0 HB3 ALA B 80 16.940 32.028 12.267 1.00 73.13 H new ATOM 2793 N LEU B 81 16.610 32.317 9.131 1.00 30.02 N ATOM 2794 CA LEU B 81 17.414 32.693 7.974 1.00 34.04 C ATOM 2795 C LEU B 81 16.536 32.915 6.748 1.00 42.43 C ATOM 2796 O LEU B 81 16.903 33.650 5.833 1.00 23.42 O ATOM 2797 CB LEU B 81 18.457 31.613 7.680 1.00 64.45 C ATOM 2798 CG LEU B 81 18.976 30.834 8.890 1.00 64.45 C ATOM 2799 CD1 LEU B 81 20.043 29.837 8.465 1.00 35.40 C ATOM 2800 CD2 LEU B 81 19.524 31.788 9.943 1.00 62.22 C ATOM 0 H LEU B 81 16.497 31.311 9.257 1.00 30.02 H new ATOM 0 HA LEU B 81 17.923 33.628 8.206 1.00 34.04 H new ATOM 0 HB2 LEU B 81 18.027 30.903 6.973 1.00 64.45 H new ATOM 0 HB3 LEU B 81 19.306 32.082 7.183 1.00 64.45 H new ATOM 0 HG LEU B 81 18.144 30.281 9.326 1.00 64.45 H new ATOM 0 HD11 LEU B 81 20.400 29.292 9.339 1.00 35.40 H new ATOM 0 HD12 LEU B 81 19.619 29.134 7.747 1.00 35.40 H new ATOM 0 HD13 LEU B 81 20.875 30.369 8.004 1.00 35.40 H new ATOM 0 HD21 LEU B 81 19.889 31.217 10.797 1.00 62.22 H new ATOM 0 HD22 LEU B 81 20.343 32.368 9.518 1.00 62.22 H new ATOM 0 HD23 LEU B 81 18.733 32.463 10.269 1.00 62.22 H new ATOM 2812 N ALA B 82 15.370 32.275 6.738 1.00 60.51 N ATOM 2813 CA ALA B 82 14.437 32.405 5.626 1.00 44.45 C ATOM 2814 C ALA B 82 14.207 33.870 5.271 1.00 20.32 C ATOM 2815 O ALA B 82 14.341 34.268 4.113 1.00 2.23 O ATOM 2816 CB ALA B 82 13.116 31.728 5.963 1.00 40.20 C ATOM 0 H ALA B 82 15.050 31.662 7.488 1.00 60.51 H new ATOM 0 HA ALA B 82 14.874 31.912 4.758 1.00 44.45 H new ATOM 0 HB1 ALA B 82 12.429 31.833 5.123 1.00 40.20 H new ATOM 0 HB2 ALA B 82 13.289 30.670 6.160 1.00 40.20 H new ATOM 0 HB3 ALA B 82 12.683 32.196 6.847 1.00 40.20 H new ATOM 2822 N HIS B 83 13.859 34.670 6.274 1.00 22.34 N ATOM 2823 CA HIS B 83 13.610 36.092 6.068 1.00 63.42 C ATOM 2824 C HIS B 83 12.415 36.305 5.143 1.00 41.50 C ATOM 2825 O HIS B 83 12.375 37.268 4.376 1.00 61.44 O ATOM 2826 CB HIS B 83 14.850 36.769 5.482 1.00 44.31 C ATOM 2827 CG HIS B 83 15.205 38.058 6.158 1.00 73.22 C ATOM 2828 ND1 HIS B 83 14.490 39.223 5.977 1.00 55.33 N ATOM 2829 CD2 HIS B 83 16.204 38.359 7.019 1.00 3.54 C ATOM 2830 CE1 HIS B 83 15.037 40.187 6.698 1.00 61.52 C ATOM 2831 NE2 HIS B 83 16.078 39.688 7.340 1.00 31.24 N ATOM 0 H HIS B 83 13.743 34.357 7.238 1.00 22.34 H new ATOM 0 HA HIS B 83 13.384 36.540 7.035 1.00 63.42 H new ATOM 0 HB2 HIS B 83 15.696 36.085 5.555 1.00 44.31 H new ATOM 0 HB3 HIS B 83 14.684 36.958 4.422 1.00 44.31 H new ATOM 0 HD2 HIS B 83 16.960 37.680 7.386 1.00 3.54 H new ATOM 0 HE1 HIS B 83 14.691 41.209 6.753 1.00 61.52 H new ATOM 0 HE2 HIS B 83 16.689 40.206 7.972 1.00 31.24 H new ATOM 2839 N PHE B 84 11.445 35.401 5.220 1.00 53.42 N ATOM 2840 CA PHE B 84 10.250 35.490 4.389 1.00 42.43 C ATOM 2841 C PHE B 84 8.989 35.489 5.248 1.00 52.55 C ATOM 2842 O PHE B 84 8.290 36.497 5.344 1.00 52.41 O ATOM 2843 CB PHE B 84 10.205 34.325 3.397 1.00 71.00 C ATOM 2844 CG PHE B 84 10.229 34.760 1.960 1.00 12.12 C ATOM 2845 CD1 PHE B 84 11.180 35.663 1.511 1.00 2.13 C ATOM 2846 CD2 PHE B 84 9.301 34.267 1.057 1.00 61.02 C ATOM 2847 CE1 PHE B 84 11.204 36.065 0.189 1.00 63.12 C ATOM 2848 CE2 PHE B 84 9.322 34.665 -0.266 1.00 75.43 C ATOM 2849 CZ PHE B 84 10.274 35.567 -0.701 1.00 4.43 C ATOM 0 H PHE B 84 11.463 34.598 5.849 1.00 53.42 H new ATOM 0 HA PHE B 84 10.292 36.428 3.836 1.00 42.43 H new ATOM 0 HB2 PHE B 84 11.054 33.667 3.583 1.00 71.00 H new ATOM 0 HB3 PHE B 84 9.303 33.740 3.576 1.00 71.00 H new ATOM 0 HD1 PHE B 84 11.910 36.057 2.202 1.00 2.13 H new ATOM 0 HD2 PHE B 84 8.553 33.564 1.391 1.00 61.02 H new ATOM 0 HE1 PHE B 84 11.951 36.769 -0.148 1.00 63.12 H new ATOM 0 HE2 PHE B 84 8.594 34.271 -0.960 1.00 75.43 H new ATOM 0 HZ PHE B 84 10.290 35.881 -1.734 1.00 4.43 H new ATOM 2859 N GLY B 85 8.704 34.349 5.871 1.00 21.14 N ATOM 2860 CA GLY B 85 7.528 34.238 6.712 1.00 12.21 C ATOM 2861 C GLY B 85 7.557 35.204 7.880 1.00 31.01 C ATOM 2862 O GLY B 85 8.507 35.213 8.662 1.00 44.13 O ATOM 0 H GLY B 85 9.267 33.501 5.808 1.00 21.14 H new ATOM 0 HA2 GLY B 85 6.637 34.425 6.112 1.00 12.21 H new ATOM 0 HA3 GLY B 85 7.450 33.218 7.090 1.00 12.21 H new ATOM 2866 N GLN B 86 6.515 36.021 7.997 1.00 3.43 N ATOM 2867 CA GLN B 86 6.427 36.997 9.076 1.00 12.21 C ATOM 2868 C GLN B 86 5.254 36.683 10.000 1.00 13.14 C ATOM 2869 O GLN B 86 5.265 37.041 11.177 1.00 55.43 O ATOM 2870 CB GLN B 86 6.278 38.407 8.506 1.00 53.42 C ATOM 2871 CG GLN B 86 5.002 38.608 7.703 1.00 53.00 C ATOM 2872 CD GLN B 86 5.046 39.854 6.840 1.00 33.32 C ATOM 2873 OE1 GLN B 86 5.237 40.963 7.341 1.00 54.14 O ATOM 2874 NE2 GLN B 86 4.867 39.678 5.537 1.00 34.34 N ATOM 0 H GLN B 86 5.720 36.026 7.358 1.00 3.43 H new ATOM 0 HA GLN B 86 7.348 36.943 9.656 1.00 12.21 H new ATOM 0 HB2 GLN B 86 6.298 39.125 9.326 1.00 53.42 H new ATOM 0 HB3 GLN B 86 7.136 38.625 7.870 1.00 53.42 H new ATOM 0 HG2 GLN B 86 4.835 37.737 7.069 1.00 53.00 H new ATOM 0 HG3 GLN B 86 4.154 38.673 8.385 1.00 53.00 H new ATOM 0 HE21 GLN B 86 4.712 38.741 5.166 1.00 34.34 H new ATOM 0 HE22 GLN B 86 4.885 40.480 4.907 1.00 34.34 H new ATOM 2883 N ASN B 87 4.244 36.011 9.458 1.00 61.14 N ATOM 2884 CA ASN B 87 3.062 35.650 10.234 1.00 22.41 C ATOM 2885 C ASN B 87 3.314 34.388 11.054 1.00 34.44 C ATOM 2886 O ASN B 87 4.218 33.610 10.749 1.00 43.53 O ATOM 2887 CB ASN B 87 1.863 35.439 9.307 1.00 1.54 C ATOM 2888 CG ASN B 87 0.541 35.697 10.004 1.00 64.20 C ATOM 2889 OD1 ASN B 87 -0.216 34.768 10.288 1.00 64.54 O ATOM 2890 ND2 ASN B 87 0.258 36.963 10.282 1.00 70.15 N ATOM 0 H ASN B 87 4.220 35.705 8.485 1.00 61.14 H new ATOM 0 HA ASN B 87 2.843 36.469 10.919 1.00 22.41 H new ATOM 0 HB2 ASN B 87 1.952 36.101 8.446 1.00 1.54 H new ATOM 0 HB3 ASN B 87 1.877 34.418 8.926 1.00 1.54 H new ATOM 0 HD21 ASN B 87 -0.617 37.199 10.750 1.00 70.15 H new ATOM 0 HD22 ASN B 87 0.916 37.700 10.028 1.00 70.15 H new ATOM 2897 N GLU B 88 2.510 34.194 12.093 1.00 72.14 N ATOM 2898 CA GLU B 88 2.647 33.027 12.957 1.00 60.50 C ATOM 2899 C GLU B 88 1.295 32.613 13.530 1.00 51.31 C ATOM 2900 O GLU B 88 0.945 31.432 13.536 1.00 64.11 O ATOM 2901 CB GLU B 88 3.627 33.319 14.094 1.00 11.22 C ATOM 2902 CG GLU B 88 4.708 32.262 14.253 1.00 72.12 C ATOM 2903 CD GLU B 88 5.868 32.736 15.106 1.00 70.14 C ATOM 2904 OE1 GLU B 88 6.492 33.756 14.747 1.00 31.35 O ATOM 2905 OE2 GLU B 88 6.151 32.086 16.134 1.00 44.44 O ATOM 0 H GLU B 88 1.757 34.829 12.358 1.00 72.14 H new ATOM 0 HA GLU B 88 3.035 32.205 12.355 1.00 60.50 H new ATOM 0 HB2 GLU B 88 4.099 34.285 13.916 1.00 11.22 H new ATOM 0 HB3 GLU B 88 3.072 33.402 15.028 1.00 11.22 H new ATOM 0 HG2 GLU B 88 4.274 31.369 14.702 1.00 72.12 H new ATOM 0 HG3 GLU B 88 5.079 31.976 13.269 1.00 72.12 H new ATOM 2912 N THR B 89 0.537 33.593 14.011 1.00 72.22 N ATOM 2913 CA THR B 89 -0.775 33.331 14.588 1.00 72.03 C ATOM 2914 C THR B 89 -0.663 32.471 15.842 1.00 64.32 C ATOM 2915 O THR B 89 0.358 31.824 16.074 1.00 11.41 O ATOM 2916 CB THR B 89 -1.704 32.630 13.579 1.00 44.43 C ATOM 2917 OG1 THR B 89 -1.221 32.834 12.247 1.00 72.23 O ATOM 2918 CG2 THR B 89 -3.125 33.157 13.695 1.00 55.41 C ATOM 0 H THR B 89 0.810 34.576 14.012 1.00 72.22 H new ATOM 0 HA THR B 89 -1.202 34.298 14.852 1.00 72.03 H new ATOM 0 HB THR B 89 -1.710 31.563 13.804 1.00 44.43 H new ATOM 0 HG1 THR B 89 -1.054 33.789 12.102 1.00 72.23 H new ATOM 0 HG21 THR B 89 -3.762 32.647 12.973 1.00 55.41 H new ATOM 0 HG22 THR B 89 -3.500 32.974 14.702 1.00 55.41 H new ATOM 0 HG23 THR B 89 -3.133 34.228 13.494 1.00 55.41 H new ATOM 2926 N THR B 90 -1.722 32.467 16.647 1.00 33.34 N ATOM 2927 CA THR B 90 -1.741 31.685 17.878 1.00 70.14 C ATOM 2928 C THR B 90 -2.663 30.478 17.748 1.00 13.32 C ATOM 2929 O THR B 90 -3.553 30.453 16.896 1.00 24.44 O ATOM 2930 CB THR B 90 -2.196 32.538 19.077 1.00 21.30 C ATOM 2931 OG1 THR B 90 -2.249 31.731 20.260 1.00 24.01 O ATOM 2932 CG2 THR B 90 -3.562 33.154 18.816 1.00 74.34 C ATOM 0 H THR B 90 -2.576 32.995 16.469 1.00 33.34 H new ATOM 0 HA THR B 90 -0.721 31.342 18.051 1.00 70.14 H new ATOM 0 HB THR B 90 -1.474 33.342 19.218 1.00 21.30 H new ATOM 0 HG1 THR B 90 -2.537 32.281 21.018 1.00 24.01 H new ATOM 0 HG21 THR B 90 -3.862 33.752 19.677 1.00 74.34 H new ATOM 0 HG22 THR B 90 -3.511 33.790 17.932 1.00 74.34 H new ATOM 0 HG23 THR B 90 -4.293 32.362 18.652 1.00 74.34 H new ATOM 2940 N SER B 91 -2.448 29.479 18.598 1.00 21.33 N ATOM 2941 CA SER B 91 -3.258 28.268 18.575 1.00 52.45 C ATOM 2942 C SER B 91 -3.015 27.428 19.826 1.00 40.41 C ATOM 2943 O SER B 91 -2.007 27.575 20.517 1.00 20.02 O ATOM 2944 CB SER B 91 -2.947 27.443 17.325 1.00 73.32 C ATOM 2945 OG SER B 91 -2.121 26.335 17.638 1.00 4.32 O ATOM 0 H SER B 91 -1.719 29.485 19.311 1.00 21.33 H new ATOM 0 HA SER B 91 -4.307 28.563 18.554 1.00 52.45 H new ATOM 0 HB2 SER B 91 -3.876 27.092 16.876 1.00 73.32 H new ATOM 0 HB3 SER B 91 -2.453 28.071 16.584 1.00 73.32 H new ATOM 0 HG SER B 91 -1.938 25.823 16.823 1.00 4.32 H new ATOM 2951 N PRO B 92 -3.961 26.526 20.124 1.00 53.44 N ATOM 2952 CA PRO B 92 -3.873 25.644 21.292 1.00 21.04 C ATOM 2953 C PRO B 92 -2.778 24.592 21.143 1.00 43.21 C ATOM 2954 O PRO B 92 -2.521 24.101 20.044 1.00 61.11 O ATOM 2955 CB PRO B 92 -5.250 24.979 21.339 1.00 71.35 C ATOM 2956 CG PRO B 92 -5.743 25.028 19.933 1.00 30.20 C ATOM 2957 CD PRO B 92 -5.189 26.296 19.345 1.00 2.15 C ATOM 0 HA PRO B 92 -3.618 26.193 22.199 1.00 21.04 H new ATOM 0 HB2 PRO B 92 -5.182 23.952 21.699 1.00 71.35 H new ATOM 0 HB3 PRO B 92 -5.923 25.509 22.013 1.00 71.35 H new ATOM 0 HG2 PRO B 92 -5.406 24.157 19.371 1.00 30.20 H new ATOM 0 HG3 PRO B 92 -6.833 25.026 19.901 1.00 30.20 H new ATOM 0 HD2 PRO B 92 -4.976 26.186 18.282 1.00 2.15 H new ATOM 0 HD3 PRO B 92 -5.890 27.125 19.445 1.00 2.15 H new ATOM 2965 N HIS B 93 -2.137 24.251 22.256 1.00 34.50 N ATOM 2966 CA HIS B 93 -1.070 23.256 22.249 1.00 54.15 C ATOM 2967 C HIS B 93 -1.641 21.846 22.355 1.00 12.25 C ATOM 2968 O HIS B 93 -2.844 21.666 22.544 1.00 33.42 O ATOM 2969 CB HIS B 93 -0.097 23.513 23.400 1.00 0.42 C ATOM 2970 CG HIS B 93 -0.677 23.224 24.750 1.00 62.42 C ATOM 2971 ND1 HIS B 93 -0.431 22.056 25.441 1.00 13.24 N ATOM 2972 CD2 HIS B 93 -1.494 23.961 25.539 1.00 50.12 C ATOM 2973 CE1 HIS B 93 -1.075 22.086 26.595 1.00 55.53 C ATOM 2974 NE2 HIS B 93 -1.727 23.232 26.679 1.00 23.02 N ATOM 0 H HIS B 93 -2.337 24.648 23.174 1.00 34.50 H new ATOM 0 HA HIS B 93 -0.534 23.341 21.304 1.00 54.15 H new ATOM 0 HB2 HIS B 93 0.792 22.899 23.257 1.00 0.42 H new ATOM 0 HB3 HIS B 93 0.225 24.554 23.367 1.00 0.42 H new ATOM 0 HD2 HIS B 93 -1.889 24.941 25.314 1.00 50.12 H new ATOM 0 HE1 HIS B 93 -1.069 21.306 27.342 1.00 55.53 H new ATOM 0 HE2 HIS B 93 -2.309 23.527 27.463 1.00 23.02 H new ATOM 2982 N SER B 94 -0.771 20.849 22.232 1.00 3.43 N ATOM 2983 CA SER B 94 -1.190 19.454 22.310 1.00 1.32 C ATOM 2984 C SER B 94 -0.047 18.571 22.800 1.00 64.45 C ATOM 2985 O SER B 94 1.074 18.653 22.303 1.00 61.34 O ATOM 2986 CB SER B 94 -1.675 18.969 20.942 1.00 12.44 C ATOM 2987 OG SER B 94 -0.721 19.251 19.933 1.00 54.11 O ATOM 0 H SER B 94 0.229 20.981 22.078 1.00 3.43 H new ATOM 0 HA SER B 94 -2.011 19.385 23.024 1.00 1.32 H new ATOM 0 HB2 SER B 94 -1.863 17.896 20.979 1.00 12.44 H new ATOM 0 HB3 SER B 94 -2.622 19.451 20.697 1.00 12.44 H new ATOM 0 HG SER B 94 -1.054 18.930 19.069 1.00 54.11 H new ATOM 2993 N GLY B 95 -0.343 17.723 23.782 1.00 1.35 N ATOM 2994 CA GLY B 95 0.669 16.836 24.324 1.00 64.00 C ATOM 2995 C GLY B 95 1.301 15.958 23.263 1.00 62.35 C ATOM 2996 O GLY B 95 0.643 15.568 22.298 1.00 43.33 O ATOM 0 H GLY B 95 -1.264 17.635 24.211 1.00 1.35 H new ATOM 0 HA2 GLY B 95 1.444 17.429 24.809 1.00 64.00 H new ATOM 0 HA3 GLY B 95 0.221 16.206 25.093 1.00 64.00 H new ATOM 3000 N GLN B 96 2.582 15.648 23.438 1.00 50.51 N ATOM 3001 CA GLN B 96 3.302 14.813 22.485 1.00 72.12 C ATOM 3002 C GLN B 96 4.448 14.073 23.167 1.00 65.24 C ATOM 3003 O GLN B 96 4.714 14.275 24.351 1.00 63.21 O ATOM 3004 CB GLN B 96 3.843 15.665 21.335 1.00 43.41 C ATOM 3005 CG GLN B 96 4.526 16.943 21.794 1.00 33.45 C ATOM 3006 CD GLN B 96 5.018 17.790 20.637 1.00 33.12 C ATOM 3007 OE1 GLN B 96 6.024 17.470 20.003 1.00 74.24 O ATOM 3008 NE2 GLN B 96 4.310 18.877 20.355 1.00 2.42 N ATOM 0 H GLN B 96 3.142 15.963 24.231 1.00 50.51 H new ATOM 0 HA GLN B 96 2.604 14.077 22.086 1.00 72.12 H new ATOM 0 HB2 GLN B 96 4.551 15.072 20.756 1.00 43.41 H new ATOM 0 HB3 GLN B 96 3.021 15.922 20.666 1.00 43.41 H new ATOM 0 HG2 GLN B 96 3.829 17.527 22.396 1.00 33.45 H new ATOM 0 HG3 GLN B 96 5.368 16.689 22.437 1.00 33.45 H new ATOM 0 HE21 GLN B 96 3.483 19.104 20.907 1.00 2.42 H new ATOM 0 HE22 GLN B 96 4.593 19.485 19.587 1.00 2.42 H new ATOM 3017 N LYS B 97 5.124 13.213 22.411 1.00 34.32 N ATOM 3018 CA LYS B 97 6.241 12.443 22.941 1.00 14.32 C ATOM 3019 C LYS B 97 7.288 13.360 23.567 1.00 71.32 C ATOM 3020 O LYS B 97 7.574 14.439 23.046 1.00 33.34 O ATOM 3021 CB LYS B 97 6.881 11.604 21.833 1.00 35.20 C ATOM 3022 CG LYS B 97 6.739 10.107 22.043 1.00 51.33 C ATOM 3023 CD LYS B 97 6.935 9.339 20.747 1.00 44.12 C ATOM 3024 CE LYS B 97 5.627 8.745 20.249 1.00 74.43 C ATOM 3025 NZ LYS B 97 4.723 9.785 19.685 1.00 5.41 N ATOM 0 H LYS B 97 4.916 13.033 21.429 1.00 34.32 H new ATOM 0 HA LYS B 97 5.856 11.779 23.715 1.00 14.32 H new ATOM 0 HB2 LYS B 97 6.429 11.873 20.878 1.00 35.20 H new ATOM 0 HB3 LYS B 97 7.940 11.854 21.766 1.00 35.20 H new ATOM 0 HG2 LYS B 97 7.469 9.772 22.779 1.00 51.33 H new ATOM 0 HG3 LYS B 97 5.752 9.888 22.450 1.00 51.33 H new ATOM 0 HD2 LYS B 97 7.347 10.004 19.987 1.00 44.12 H new ATOM 0 HD3 LYS B 97 7.662 8.542 20.901 1.00 44.12 H new ATOM 0 HE2 LYS B 97 5.836 7.994 19.487 1.00 74.43 H new ATOM 0 HE3 LYS B 97 5.124 8.234 21.070 1.00 74.43 H new ATOM 0 HZ1 LYS B 97 3.843 9.339 19.357 1.00 5.41 H new ATOM 0 HZ2 LYS B 97 4.502 10.488 20.419 1.00 5.41 H new ATOM 0 HZ3 LYS B 97 5.192 10.256 18.885 1.00 5.41 H new ATOM 3039 N THR B 98 7.856 12.925 24.687 1.00 34.52 N ATOM 3040 CA THR B 98 8.870 13.707 25.383 1.00 3.20 C ATOM 3041 C THR B 98 10.077 12.848 25.741 1.00 4.23 C ATOM 3042 O THR B 98 9.932 11.732 26.239 1.00 73.42 O ATOM 3043 CB THR B 98 8.306 14.341 26.669 1.00 33.41 C ATOM 3044 OG1 THR B 98 6.892 14.128 26.741 1.00 41.12 O ATOM 3045 CG2 THR B 98 8.603 15.833 26.712 1.00 31.23 C ATOM 0 H THR B 98 7.631 12.035 25.132 1.00 34.52 H new ATOM 0 HA THR B 98 9.180 14.499 24.702 1.00 3.20 H new ATOM 0 HB THR B 98 8.788 13.866 27.524 1.00 33.41 H new ATOM 0 HG1 THR B 98 6.542 14.533 27.562 1.00 41.12 H new ATOM 0 HG21 THR B 98 8.195 16.259 27.629 1.00 31.23 H new ATOM 0 HG22 THR B 98 9.681 15.990 26.687 1.00 31.23 H new ATOM 0 HG23 THR B 98 8.145 16.320 25.851 1.00 31.23 H new ATOM 3053 N GLY B 99 11.270 13.376 25.485 1.00 24.23 N ATOM 3054 CA GLY B 99 12.486 12.643 25.788 1.00 5.30 C ATOM 3055 C GLY B 99 13.004 12.929 27.183 1.00 13.10 C ATOM 3056 O GLY B 99 12.721 13.983 27.753 1.00 22.51 O ATOM 0 H GLY B 99 11.416 14.298 25.073 1.00 24.23 H new ATOM 0 HA2 GLY B 99 12.297 11.574 25.686 1.00 5.30 H new ATOM 0 HA3 GLY B 99 13.254 12.902 25.059 1.00 5.30 H new TER 3060 GLY B 99