USER MOD reduce.3.24.130724 H: found=0, std=0, add=1334, rem=0, adj=43 USER MOD reduce.3.24.130724 removed 1334 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 63 TYR OH : rot 15:sc= 0.577 USER MOD Set 1.2: B 67 LYS NZ :NH3+ -153:sc= 0.987 (180deg=0) USER MOD Set 2.1: B 30 MET CE :methyl -155:sc= -0.212 (180deg=-1.06) USER MOD Set 2.2: B 31 ASN : amide:sc= -0.159 K(o=-0.37,f=-3.4!) USER MOD Set 3.1: B 16 GLN : amide:sc= -1.49 X(o=-3,f=-3.4) USER MOD Set 3.2: B 22 GLN :FLIP amide:sc= -1.55 F(o=-6.4!,f=-3) USER MOD Set 4.1: A 78 HIS : no HD1:sc= 0 K(o=0,f=-0.73) USER MOD Set 4.2: A 79 HIS : no HD1:sc= 0 X(o=0,f=0.0045) USER MOD Set 5.1: A 63 TYR OH : rot 180:sc= 0 USER MOD Set 5.2: A 67 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Set 6.1: A 45 GLN : amide:sc= -4.79! C(o=-5.3!,f=-11!) USER MOD Set 6.2: A 47 THR OG1 : rot 180:sc= -0.521 USER MOD Set 7.1: A 28 HIS : no HE2:sc= -0.682 K(o=-2.8,f=-7.8) USER MOD Set 7.2: A 31 ASN : amide:sc= -2.1! C(o=-2.8!,f=-7.2!) USER MOD Set 8.1: A 16 GLN : amide:sc= 0 K(o=-0.012,f=-1.6!) USER MOD Set 8.2: A 22 GLN : amide:sc= -0.012 K(o=-0.012,f=-1.8!) USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ -170:sc= -0.489 (180deg=-0.652) USER MOD Single : A 2 SER OG : rot -1:sc= 1.84 USER MOD Single : A 6 SER OG : rot 180:sc= 0.0207 USER MOD Single : A 9 TYR OH : rot 180:sc= 0 USER MOD Single : A 13 ASN : amide:sc= 0.408 K(o=0.41,f=-1.8!) USER MOD Single : A 15 LYS NZ :NH3+ 159:sc= -0.0753 (180deg=-0.511) USER MOD Single : A 17 HIS : no HD1:sc= -0.644 K(o=-0.64,f=-2) USER MOD Single : A 20 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 21 ASN : amide:sc= -0.868 K(o=-0.87,f=-3.2!) USER MOD Single : A 23 SER OG : rot 59:sc= 0.36 USER MOD Single : A 26 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 30 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 32 SER OG : rot -165:sc= -0.379 USER MOD Single : A 33 TYR OH : rot 17:sc= 1.48 USER MOD Single : A 34 TYR OH : rot 180:sc= -0.165 USER MOD Single : A 36 SER OG : rot 180:sc= 0 USER MOD Single : A 39 SER OG : rot 70:sc= 1.05 USER MOD Single : A 40 THR OG1 : rot 76:sc= 1.24 USER MOD Single : A 43 GLN : amide:sc= -0.0139 K(o=-0.014,f=-1.5!) USER MOD Single : A 48 LYS NZ :NH3+ 166:sc=-0.00124 (180deg=-0.14) USER MOD Single : A 49 ASN :FLIP amide:sc= -0.15 F(o=-1.3,f=-0.15) USER MOD Single : A 54 LYS NZ :NH3+ 157:sc= -0.196 (180deg=-0.942) USER MOD Single : A 57 GLN : amide:sc= -0.336 K(o=-0.34,f=-0.95) USER MOD Single : A 58 HIS : no HD1:sc= -1.93 X(o=-1.9,f=-1.5) USER MOD Single : A 64 ASN : amide:sc= 0 K(o=0,f=-0.82) USER MOD Single : A 65 LYS NZ :NH3+ 151:sc= -0.133 (180deg=-0.807) USER MOD Single : A 71 SER OG : rot 136:sc= -0.256 USER MOD Single : A 72 LYS NZ :NH3+ -166:sc= -0.0192 (180deg=-0.326) USER MOD Single : A 75 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 76 HIS : no HD1:sc= -0.096 K(o=-0.096,f=-0.8) USER MOD Single : A 77 HIS : no HD1:sc= -2.91! C(o=-2.9!,f=-4!) USER MOD Single : A 80 HIS : no HD1:sc= 0 X(o=0,f=-0.11) USER MOD Single : B 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : B 1 MET N :NH3+ -155:sc= -0.0691 (180deg=-0.709) USER MOD Single : B 2 SER OG : rot -26:sc= 0.537 USER MOD Single : B 6 SER OG : rot 180:sc= -0.293 USER MOD Single : B 9 TYR OH : rot 180:sc= 0 USER MOD Single : B 13 ASN :FLIP amide:sc= -1.05 F(o=-1.9,f=-1) USER MOD Single : B 15 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 17 HIS : no HD1:sc= -0.414 X(o=-0.41,f=-0.56) USER MOD Single : B 20 MET CE :methyl -166:sc= -1.03 (180deg=-1.91!) USER MOD Single : B 21 ASN : amide:sc= -1.01 X(o=-1,f=-1.5!) USER MOD Single : B 23 SER OG : rot -72:sc= 1.2 USER MOD Single : B 26 LYS NZ :NH3+ -127:sc= -1.14 (180deg=-3.35!) USER MOD Single : B 28 HIS : no HD1:sc=-0.00073 X(o=-0.00073,f=-0.092) USER MOD Single : B 32 SER OG : rot -149:sc= -1.46 USER MOD Single : B 33 TYR OH : rot 5:sc= 0.269 USER MOD Single : B 34 TYR OH : rot 180:sc= 0 USER MOD Single : B 36 SER OG : rot 180:sc= 0 USER MOD Single : B 39 SER OG : rot 82:sc= 1.07 USER MOD Single : B 40 THR OG1 : rot 95:sc= 1.07 USER MOD Single : B 43 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 45 GLN : amide:sc= -0.403 X(o=-0.4,f=-0.81) USER MOD Single : B 47 THR OG1 : rot 180:sc= 0 USER MOD Single : B 48 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 49 ASN : amide:sc= -5.04! C(o=-5!,f=-6.6!) USER MOD Single : B 54 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 57 GLN : amide:sc=-0.00835 K(o=-0.0083,f=-1.4) USER MOD Single : B 58 HIS :FLIP no HD1:sc= -1.01 F(o=-2.1!,f=-1) USER MOD Single : B 64 ASN : amide:sc= 0 X(o=0,f=-0.005) USER MOD Single : B 65 LYS NZ :NH3+ 159:sc= -0.113 (180deg=-0.775) USER MOD Single : B 71 SER OG : rot 180:sc= 0 USER MOD Single : B 72 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 75 HIS : no HD1:sc= -5.99! C(o=-6!,f=-11!) USER MOD Single : B 76 HIS : no HD1:sc= 0 X(o=0,f=-0.2) USER MOD Single : B 77 HIS : no HD1:sc= -0.564 K(o=-0.56,f=-1.4) USER MOD Single : B 78 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : B 79 HIS : no HD1:sc= 0.00341 X(o=0.0034,f=-0.31) USER MOD Single : B 80 HIS : no HD1:sc= -2.57 K(o=-2.6,f=-5.2!) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 -1.957 -1.900 -3.090 1.00 0.00 N ATOM 2 CA MET A 1 -0.939 -1.447 -4.080 1.00 0.00 C ATOM 3 C MET A 1 -0.032 -0.408 -3.428 1.00 0.00 C ATOM 4 O MET A 1 0.884 0.115 -4.063 1.00 0.00 O ATOM 5 CB MET A 1 -1.650 -0.833 -5.290 1.00 0.00 C ATOM 6 CG MET A 1 -2.424 -1.921 -6.039 1.00 0.00 C ATOM 7 SD MET A 1 -3.273 -1.191 -7.462 1.00 0.00 S ATOM 8 CE MET A 1 -4.276 -2.635 -7.889 1.00 0.00 C ATOM 0 H1 MET A 1 -2.467 -2.723 -3.469 1.00 0.00 H new ATOM 0 H2 MET A 1 -1.484 -2.164 -2.202 1.00 0.00 H new ATOM 0 H3 MET A 1 -2.631 -1.129 -2.908 1.00 0.00 H new ATOM 0 HA MET A 1 -0.337 -2.294 -4.409 1.00 0.00 H new ATOM 0 HB2 MET A 1 -2.331 -0.047 -4.964 1.00 0.00 H new ATOM 0 HB3 MET A 1 -0.922 -0.368 -5.955 1.00 0.00 H new ATOM 0 HG2 MET A 1 -1.742 -2.703 -6.372 1.00 0.00 H new ATOM 0 HG3 MET A 1 -3.147 -2.391 -5.373 1.00 0.00 H new ATOM 0 HE1 MET A 1 -4.892 -2.406 -8.758 1.00 0.00 H new ATOM 0 HE2 MET A 1 -3.623 -3.477 -8.119 1.00 0.00 H new ATOM 0 HE3 MET A 1 -4.918 -2.894 -7.047 1.00 0.00 H new ATOM 20 N SER A 2 -0.292 -0.114 -2.159 1.00 0.00 N ATOM 21 CA SER A 2 0.508 0.867 -1.431 1.00 0.00 C ATOM 22 C SER A 2 0.568 2.189 -2.202 1.00 0.00 C ATOM 23 O SER A 2 1.353 2.335 -3.139 1.00 0.00 O ATOM 24 CB SER A 2 1.927 0.320 -1.211 1.00 0.00 C ATOM 25 OG SER A 2 2.669 0.435 -2.417 1.00 0.00 O ATOM 0 H SER A 2 -1.044 -0.537 -1.615 1.00 0.00 H new ATOM 0 HA SER A 2 0.041 1.052 -0.464 1.00 0.00 H new ATOM 0 HB2 SER A 2 2.422 0.873 -0.412 1.00 0.00 H new ATOM 0 HB3 SER A 2 1.882 -0.723 -0.897 1.00 0.00 H new ATOM 0 HG SER A 2 2.099 0.816 -3.117 1.00 0.00 H new ATOM 31 N GLU A 3 -0.263 3.144 -1.797 1.00 0.00 N ATOM 32 CA GLU A 3 -0.302 4.463 -2.457 1.00 0.00 C ATOM 33 C GLU A 3 0.550 5.468 -1.678 1.00 0.00 C ATOM 34 O GLU A 3 0.272 5.784 -0.521 1.00 0.00 O ATOM 35 CB GLU A 3 -1.767 4.961 -2.564 1.00 0.00 C ATOM 36 CG GLU A 3 -1.908 6.034 -3.662 1.00 0.00 C ATOM 37 CD GLU A 3 -1.113 7.282 -3.292 1.00 0.00 C ATOM 38 OE1 GLU A 3 -1.142 7.658 -2.131 1.00 0.00 O ATOM 39 OE2 GLU A 3 -0.480 7.839 -4.173 1.00 0.00 O ATOM 0 H GLU A 3 -0.918 3.040 -1.022 1.00 0.00 H new ATOM 0 HA GLU A 3 0.108 4.368 -3.463 1.00 0.00 H new ATOM 0 HB2 GLU A 3 -2.425 4.121 -2.785 1.00 0.00 H new ATOM 0 HB3 GLU A 3 -2.086 5.372 -1.606 1.00 0.00 H new ATOM 0 HG2 GLU A 3 -1.553 5.638 -4.614 1.00 0.00 H new ATOM 0 HG3 GLU A 3 -2.959 6.291 -3.795 1.00 0.00 H new ATOM 46 N LEU A 4 1.592 5.968 -2.334 1.00 0.00 N ATOM 47 CA LEU A 4 2.498 6.940 -1.718 1.00 0.00 C ATOM 48 C LEU A 4 2.992 7.941 -2.755 1.00 0.00 C ATOM 49 O LEU A 4 3.812 8.804 -2.444 1.00 0.00 O ATOM 50 CB LEU A 4 3.703 6.216 -1.083 1.00 0.00 C ATOM 51 CG LEU A 4 4.319 5.195 -2.094 1.00 0.00 C ATOM 52 CD1 LEU A 4 5.851 5.156 -1.966 1.00 0.00 C ATOM 53 CD2 LEU A 4 3.770 3.784 -1.830 1.00 0.00 C ATOM 0 H LEU A 4 1.833 5.718 -3.293 1.00 0.00 H new ATOM 0 HA LEU A 4 1.950 7.475 -0.942 1.00 0.00 H new ATOM 0 HB2 LEU A 4 4.458 6.944 -0.786 1.00 0.00 H new ATOM 0 HB3 LEU A 4 3.388 5.697 -0.178 1.00 0.00 H new ATOM 0 HG LEU A 4 4.046 5.518 -3.098 1.00 0.00 H new ATOM 0 HD11 LEU A 4 6.258 4.439 -2.679 1.00 0.00 H new ATOM 0 HD12 LEU A 4 6.259 6.145 -2.174 1.00 0.00 H new ATOM 0 HD13 LEU A 4 6.124 4.856 -0.954 1.00 0.00 H new ATOM 0 HD21 LEU A 4 4.208 3.084 -2.542 1.00 0.00 H new ATOM 0 HD22 LEU A 4 4.026 3.478 -0.816 1.00 0.00 H new ATOM 0 HD23 LEU A 4 2.686 3.788 -1.945 1.00 0.00 H new ATOM 65 N PHE A 5 2.487 7.830 -3.979 1.00 0.00 N ATOM 66 CA PHE A 5 2.891 8.733 -5.046 1.00 0.00 C ATOM 67 C PHE A 5 2.510 10.165 -4.701 1.00 0.00 C ATOM 68 O PHE A 5 3.292 11.095 -4.897 1.00 0.00 O ATOM 69 CB PHE A 5 2.212 8.332 -6.356 1.00 0.00 C ATOM 70 CG PHE A 5 2.634 6.927 -6.735 1.00 0.00 C ATOM 71 CD1 PHE A 5 3.829 6.721 -7.435 1.00 0.00 C ATOM 72 CD2 PHE A 5 1.833 5.834 -6.382 1.00 0.00 C ATOM 73 CE1 PHE A 5 4.223 5.424 -7.782 1.00 0.00 C ATOM 74 CE2 PHE A 5 2.227 4.536 -6.728 1.00 0.00 C ATOM 75 CZ PHE A 5 3.422 4.331 -7.429 1.00 0.00 C ATOM 0 H PHE A 5 1.801 7.127 -4.254 1.00 0.00 H new ATOM 0 HA PHE A 5 3.973 8.668 -5.161 1.00 0.00 H new ATOM 0 HB2 PHE A 5 1.129 8.380 -6.246 1.00 0.00 H new ATOM 0 HB3 PHE A 5 2.484 9.031 -7.147 1.00 0.00 H new ATOM 0 HD1 PHE A 5 4.447 7.564 -7.707 1.00 0.00 H new ATOM 0 HD2 PHE A 5 0.911 5.992 -5.843 1.00 0.00 H new ATOM 0 HE1 PHE A 5 5.145 5.266 -8.322 1.00 0.00 H new ATOM 0 HE2 PHE A 5 1.610 3.693 -6.454 1.00 0.00 H new ATOM 0 HZ PHE A 5 3.726 3.330 -7.697 1.00 0.00 H new ATOM 85 N SER A 6 1.299 10.335 -4.179 1.00 0.00 N ATOM 86 CA SER A 6 0.804 11.655 -3.819 1.00 0.00 C ATOM 87 C SER A 6 1.541 12.178 -2.580 1.00 0.00 C ATOM 88 O SER A 6 1.687 11.458 -1.592 1.00 0.00 O ATOM 89 CB SER A 6 -0.712 11.546 -3.559 1.00 0.00 C ATOM 90 OG SER A 6 -1.266 10.598 -4.460 1.00 0.00 O ATOM 0 H SER A 6 0.644 9.574 -3.997 1.00 0.00 H new ATOM 0 HA SER A 6 0.984 12.362 -4.629 1.00 0.00 H new ATOM 0 HB2 SER A 6 -0.897 11.240 -2.529 1.00 0.00 H new ATOM 0 HB3 SER A 6 -1.188 12.517 -3.694 1.00 0.00 H new ATOM 0 HG SER A 6 -2.230 10.520 -4.301 1.00 0.00 H new ATOM 96 N VAL A 7 2.006 13.421 -2.645 1.00 0.00 N ATOM 97 CA VAL A 7 2.722 14.019 -1.517 1.00 0.00 C ATOM 98 C VAL A 7 1.803 14.081 -0.279 1.00 0.00 C ATOM 99 O VAL A 7 2.247 13.757 0.822 1.00 0.00 O ATOM 100 CB VAL A 7 3.267 15.450 -1.875 1.00 0.00 C ATOM 101 CG1 VAL A 7 4.650 15.698 -1.235 1.00 0.00 C ATOM 102 CG2 VAL A 7 3.394 15.601 -3.403 1.00 0.00 C ATOM 0 H VAL A 7 1.903 14.031 -3.456 1.00 0.00 H new ATOM 0 HA VAL A 7 3.581 13.388 -1.289 1.00 0.00 H new ATOM 0 HB VAL A 7 2.559 16.180 -1.483 1.00 0.00 H new ATOM 0 HG11 VAL A 7 5.000 16.695 -1.501 1.00 0.00 H new ATOM 0 HG12 VAL A 7 4.569 15.619 -0.151 1.00 0.00 H new ATOM 0 HG13 VAL A 7 5.359 14.955 -1.601 1.00 0.00 H new ATOM 0 HG21 VAL A 7 3.772 16.595 -3.640 1.00 0.00 H new ATOM 0 HG22 VAL A 7 4.084 14.849 -3.787 1.00 0.00 H new ATOM 0 HG23 VAL A 7 2.416 15.465 -3.865 1.00 0.00 H new ATOM 112 N PRO A 8 0.570 14.477 -0.440 1.00 0.00 N ATOM 113 CA PRO A 8 -0.372 14.560 0.718 1.00 0.00 C ATOM 114 C PRO A 8 -0.378 13.279 1.553 1.00 0.00 C ATOM 115 O PRO A 8 -0.675 13.320 2.747 1.00 0.00 O ATOM 116 CB PRO A 8 -1.748 14.807 0.059 1.00 0.00 C ATOM 117 CG PRO A 8 -1.421 15.507 -1.222 1.00 0.00 C ATOM 118 CD PRO A 8 -0.102 14.882 -1.698 1.00 0.00 C ATOM 0 HA PRO A 8 -0.089 15.345 1.419 1.00 0.00 H new ATOM 0 HB2 PRO A 8 -2.277 13.871 -0.122 1.00 0.00 H new ATOM 0 HB3 PRO A 8 -2.390 15.418 0.694 1.00 0.00 H new ATOM 0 HG2 PRO A 8 -2.211 15.368 -1.960 1.00 0.00 H new ATOM 0 HG3 PRO A 8 -1.315 16.581 -1.068 1.00 0.00 H new ATOM 0 HD2 PRO A 8 -0.277 14.027 -2.351 1.00 0.00 H new ATOM 0 HD3 PRO A 8 0.499 15.596 -2.261 1.00 0.00 H new ATOM 126 N TYR A 9 -0.067 12.151 0.923 1.00 0.00 N ATOM 127 CA TYR A 9 -0.052 10.866 1.621 1.00 0.00 C ATOM 128 C TYR A 9 0.995 10.873 2.734 1.00 0.00 C ATOM 129 O TYR A 9 0.745 10.385 3.836 1.00 0.00 O ATOM 130 CB TYR A 9 0.240 9.726 0.634 1.00 0.00 C ATOM 131 CG TYR A 9 0.216 8.397 1.368 1.00 0.00 C ATOM 132 CD1 TYR A 9 -1.012 7.877 1.794 1.00 0.00 C ATOM 133 CD2 TYR A 9 1.399 7.690 1.616 1.00 0.00 C ATOM 134 CE1 TYR A 9 -1.057 6.651 2.467 1.00 0.00 C ATOM 135 CE2 TYR A 9 1.354 6.464 2.290 1.00 0.00 C ATOM 136 CZ TYR A 9 0.126 5.944 2.715 1.00 0.00 C ATOM 137 OH TYR A 9 0.081 4.734 3.378 1.00 0.00 O ATOM 0 H TYR A 9 0.178 12.098 -0.066 1.00 0.00 H new ATOM 0 HA TYR A 9 -1.034 10.706 2.066 1.00 0.00 H new ATOM 0 HB2 TYR A 9 -0.501 9.725 -0.165 1.00 0.00 H new ATOM 0 HB3 TYR A 9 1.213 9.877 0.166 1.00 0.00 H new ATOM 0 HD1 TYR A 9 -1.925 8.422 1.603 1.00 0.00 H new ATOM 0 HD2 TYR A 9 2.346 8.091 1.287 1.00 0.00 H new ATOM 0 HE1 TYR A 9 -2.004 6.250 2.795 1.00 0.00 H new ATOM 0 HE2 TYR A 9 2.267 5.919 2.482 1.00 0.00 H new ATOM 0 HH TYR A 9 0.989 4.376 3.467 1.00 0.00 H new ATOM 147 N PHE A 10 2.166 11.428 2.437 1.00 0.00 N ATOM 148 CA PHE A 10 3.242 11.492 3.423 1.00 0.00 C ATOM 149 C PHE A 10 2.772 12.259 4.665 1.00 0.00 C ATOM 150 O PHE A 10 3.035 11.841 5.792 1.00 0.00 O ATOM 151 CB PHE A 10 4.499 12.178 2.789 1.00 0.00 C ATOM 152 CG PHE A 10 5.545 11.138 2.380 1.00 0.00 C ATOM 153 CD1 PHE A 10 5.143 9.980 1.703 1.00 0.00 C ATOM 154 CD2 PHE A 10 6.895 11.332 2.694 1.00 0.00 C ATOM 155 CE1 PHE A 10 6.091 9.016 1.341 1.00 0.00 C ATOM 156 CE2 PHE A 10 7.844 10.368 2.332 1.00 0.00 C ATOM 157 CZ PHE A 10 7.442 9.210 1.656 1.00 0.00 C ATOM 0 H PHE A 10 2.394 11.837 1.531 1.00 0.00 H new ATOM 0 HA PHE A 10 3.514 10.481 3.728 1.00 0.00 H new ATOM 0 HB2 PHE A 10 4.199 12.759 1.917 1.00 0.00 H new ATOM 0 HB3 PHE A 10 4.935 12.876 3.503 1.00 0.00 H new ATOM 0 HD1 PHE A 10 4.101 9.831 1.460 1.00 0.00 H new ATOM 0 HD2 PHE A 10 7.205 12.225 3.216 1.00 0.00 H new ATOM 0 HE1 PHE A 10 5.781 8.123 0.819 1.00 0.00 H new ATOM 0 HE2 PHE A 10 8.886 10.518 2.574 1.00 0.00 H new ATOM 0 HZ PHE A 10 8.174 8.466 1.377 1.00 0.00 H new ATOM 167 N ILE A 11 2.091 13.380 4.450 1.00 0.00 N ATOM 168 CA ILE A 11 1.602 14.197 5.563 1.00 0.00 C ATOM 169 C ILE A 11 0.509 13.455 6.336 1.00 0.00 C ATOM 170 O ILE A 11 0.486 13.454 7.567 1.00 0.00 O ATOM 171 CB ILE A 11 1.061 15.533 5.027 1.00 0.00 C ATOM 172 CG1 ILE A 11 2.133 16.187 4.135 1.00 0.00 C ATOM 173 CG2 ILE A 11 0.728 16.473 6.199 1.00 0.00 C ATOM 174 CD1 ILE A 11 1.604 17.496 3.544 1.00 0.00 C ATOM 0 H ILE A 11 1.865 13.744 3.524 1.00 0.00 H new ATOM 0 HA ILE A 11 2.429 14.393 6.245 1.00 0.00 H new ATOM 0 HB ILE A 11 0.155 15.351 4.448 1.00 0.00 H new ATOM 0 HG12 ILE A 11 3.033 16.381 4.719 1.00 0.00 H new ATOM 0 HG13 ILE A 11 2.414 15.505 3.333 1.00 0.00 H new ATOM 0 HG21 ILE A 11 0.345 17.417 5.811 1.00 0.00 H new ATOM 0 HG22 ILE A 11 -0.027 16.009 6.834 1.00 0.00 H new ATOM 0 HG23 ILE A 11 1.629 16.659 6.783 1.00 0.00 H new ATOM 0 HD11 ILE A 11 2.372 17.948 2.916 1.00 0.00 H new ATOM 0 HD12 ILE A 11 0.717 17.292 2.944 1.00 0.00 H new ATOM 0 HD13 ILE A 11 1.346 18.182 4.351 1.00 0.00 H new ATOM 186 N GLU A 12 -0.402 12.832 5.595 1.00 0.00 N ATOM 187 CA GLU A 12 -1.506 12.091 6.215 1.00 0.00 C ATOM 188 C GLU A 12 -0.969 11.096 7.255 1.00 0.00 C ATOM 189 O GLU A 12 -1.620 10.847 8.270 1.00 0.00 O ATOM 190 CB GLU A 12 -2.295 11.336 5.121 1.00 0.00 C ATOM 191 CG GLU A 12 -3.206 12.305 4.346 1.00 0.00 C ATOM 192 CD GLU A 12 -4.383 12.732 5.219 1.00 0.00 C ATOM 193 OE1 GLU A 12 -5.038 11.853 5.755 1.00 0.00 O ATOM 194 OE2 GLU A 12 -4.617 13.923 5.334 1.00 0.00 O ATOM 0 H GLU A 12 -0.403 12.822 4.575 1.00 0.00 H new ATOM 0 HA GLU A 12 -2.166 12.795 6.721 1.00 0.00 H new ATOM 0 HB2 GLU A 12 -1.602 10.851 4.434 1.00 0.00 H new ATOM 0 HB3 GLU A 12 -2.896 10.548 5.576 1.00 0.00 H new ATOM 0 HG2 GLU A 12 -2.637 13.181 4.036 1.00 0.00 H new ATOM 0 HG3 GLU A 12 -3.572 11.825 3.439 1.00 0.00 H new ATOM 201 N ASN A 13 0.213 10.545 7.001 1.00 0.00 N ATOM 202 CA ASN A 13 0.825 9.594 7.927 1.00 0.00 C ATOM 203 C ASN A 13 1.215 10.295 9.232 1.00 0.00 C ATOM 204 O ASN A 13 1.197 9.694 10.306 1.00 0.00 O ATOM 205 CB ASN A 13 2.066 8.957 7.279 1.00 0.00 C ATOM 206 CG ASN A 13 1.646 8.047 6.125 1.00 0.00 C ATOM 207 OD1 ASN A 13 0.493 7.620 6.061 1.00 0.00 O ATOM 208 ND2 ASN A 13 2.515 7.725 5.206 1.00 0.00 N ATOM 0 H ASN A 13 0.766 10.738 6.166 1.00 0.00 H new ATOM 0 HA ASN A 13 0.101 8.812 8.156 1.00 0.00 H new ATOM 0 HB2 ASN A 13 2.735 9.736 6.913 1.00 0.00 H new ATOM 0 HB3 ASN A 13 2.620 8.383 8.022 1.00 0.00 H new ATOM 0 HD21 ASN A 13 2.239 7.119 4.433 1.00 0.00 H new ATOM 0 HD22 ASN A 13 3.470 8.080 5.260 1.00 0.00 H new ATOM 215 N LEU A 14 1.578 11.569 9.122 1.00 0.00 N ATOM 216 CA LEU A 14 1.982 12.368 10.282 1.00 0.00 C ATOM 217 C LEU A 14 0.784 12.682 11.158 1.00 0.00 C ATOM 218 O LEU A 14 0.875 12.683 12.386 1.00 0.00 O ATOM 219 CB LEU A 14 2.624 13.679 9.805 1.00 0.00 C ATOM 220 CG LEU A 14 3.651 13.368 8.710 1.00 0.00 C ATOM 221 CD1 LEU A 14 4.298 14.659 8.186 1.00 0.00 C ATOM 222 CD2 LEU A 14 4.728 12.416 9.245 1.00 0.00 C ATOM 0 H LEU A 14 1.602 12.076 8.237 1.00 0.00 H new ATOM 0 HA LEU A 14 2.702 11.795 10.866 1.00 0.00 H new ATOM 0 HB2 LEU A 14 1.859 14.354 9.422 1.00 0.00 H new ATOM 0 HB3 LEU A 14 3.107 14.186 10.640 1.00 0.00 H new ATOM 0 HG LEU A 14 3.132 12.884 7.883 1.00 0.00 H new ATOM 0 HD11 LEU A 14 5.023 14.414 7.410 1.00 0.00 H new ATOM 0 HD12 LEU A 14 3.528 15.309 7.771 1.00 0.00 H new ATOM 0 HD13 LEU A 14 4.803 15.172 9.005 1.00 0.00 H new ATOM 0 HD21 LEU A 14 5.450 12.204 8.457 1.00 0.00 H new ATOM 0 HD22 LEU A 14 5.238 12.881 10.089 1.00 0.00 H new ATOM 0 HD23 LEU A 14 4.262 11.486 9.570 1.00 0.00 H new ATOM 234 N LYS A 15 -0.347 12.958 10.516 1.00 0.00 N ATOM 235 CA LYS A 15 -1.568 13.288 11.232 1.00 0.00 C ATOM 236 C LYS A 15 -1.887 12.198 12.253 1.00 0.00 C ATOM 237 O LYS A 15 -2.415 12.479 13.329 1.00 0.00 O ATOM 238 CB LYS A 15 -2.733 13.437 10.243 1.00 0.00 C ATOM 239 CG LYS A 15 -3.970 13.958 10.983 1.00 0.00 C ATOM 240 CD LYS A 15 -5.108 14.201 9.989 1.00 0.00 C ATOM 241 CE LYS A 15 -6.338 14.718 10.740 1.00 0.00 C ATOM 242 NZ LYS A 15 -6.028 16.038 11.360 1.00 0.00 N ATOM 0 H LYS A 15 -0.440 12.959 9.500 1.00 0.00 H new ATOM 0 HA LYS A 15 -1.425 14.233 11.756 1.00 0.00 H new ATOM 0 HB2 LYS A 15 -2.459 14.124 9.443 1.00 0.00 H new ATOM 0 HB3 LYS A 15 -2.953 12.477 9.777 1.00 0.00 H new ATOM 0 HG2 LYS A 15 -4.283 13.237 11.738 1.00 0.00 H new ATOM 0 HG3 LYS A 15 -3.729 14.883 11.506 1.00 0.00 H new ATOM 0 HD2 LYS A 15 -4.798 14.924 9.235 1.00 0.00 H new ATOM 0 HD3 LYS A 15 -5.351 13.277 9.464 1.00 0.00 H new ATOM 0 HE2 LYS A 15 -7.180 14.816 10.055 1.00 0.00 H new ATOM 0 HE3 LYS A 15 -6.634 14.004 11.509 1.00 0.00 H new ATOM 0 HZ1 LYS A 15 -6.914 16.547 11.554 1.00 0.00 H new ATOM 0 HZ2 LYS A 15 -5.512 15.891 12.251 1.00 0.00 H new ATOM 0 HZ3 LYS A 15 -5.442 16.598 10.709 1.00 0.00 H new ATOM 256 N GLN A 16 -1.566 10.955 11.908 1.00 0.00 N ATOM 257 CA GLN A 16 -1.813 9.831 12.804 1.00 0.00 C ATOM 258 C GLN A 16 -0.930 9.932 14.043 1.00 0.00 C ATOM 259 O GLN A 16 -1.357 9.581 15.143 1.00 0.00 O ATOM 260 CB GLN A 16 -1.545 8.511 12.072 1.00 0.00 C ATOM 261 CG GLN A 16 -1.870 7.331 12.995 1.00 0.00 C ATOM 262 CD GLN A 16 -1.818 6.020 12.215 1.00 0.00 C ATOM 263 OE1 GLN A 16 -1.578 6.021 11.008 1.00 0.00 O ATOM 264 NE2 GLN A 16 -2.028 4.894 12.841 1.00 0.00 N ATOM 0 H GLN A 16 -1.136 10.701 11.018 1.00 0.00 H new ATOM 0 HA GLN A 16 -2.856 9.858 13.119 1.00 0.00 H new ATOM 0 HB2 GLN A 16 -2.152 8.456 11.168 1.00 0.00 H new ATOM 0 HB3 GLN A 16 -0.502 8.463 11.759 1.00 0.00 H new ATOM 0 HG2 GLN A 16 -1.159 7.300 13.821 1.00 0.00 H new ATOM 0 HG3 GLN A 16 -2.860 7.464 13.432 1.00 0.00 H new ATOM 0 HE21 GLN A 16 -2.227 4.896 13.841 1.00 0.00 H new ATOM 0 HE22 GLN A 16 -1.993 4.012 12.330 1.00 0.00 H new ATOM 273 N HIS A 17 0.299 10.406 13.861 1.00 0.00 N ATOM 274 CA HIS A 17 1.219 10.529 14.985 1.00 0.00 C ATOM 275 C HIS A 17 0.664 11.494 16.033 1.00 0.00 C ATOM 276 O HIS A 17 0.584 11.161 17.215 1.00 0.00 O ATOM 277 CB HIS A 17 2.575 11.036 14.483 1.00 0.00 C ATOM 278 CG HIS A 17 3.095 10.108 13.417 1.00 0.00 C ATOM 279 ND1 HIS A 17 4.080 10.491 12.520 1.00 0.00 N ATOM 280 CD2 HIS A 17 2.781 8.810 13.098 1.00 0.00 C ATOM 281 CE1 HIS A 17 4.323 9.443 11.712 1.00 0.00 C ATOM 282 NE2 HIS A 17 3.558 8.392 12.021 1.00 0.00 N ATOM 0 H HIS A 17 0.676 10.706 12.962 1.00 0.00 H new ATOM 0 HA HIS A 17 1.341 9.549 15.446 1.00 0.00 H new ATOM 0 HB2 HIS A 17 2.473 12.045 14.083 1.00 0.00 H new ATOM 0 HB3 HIS A 17 3.283 11.091 15.310 1.00 0.00 H new ATOM 0 HD2 HIS A 17 2.044 8.205 13.605 1.00 0.00 H new ATOM 0 HE1 HIS A 17 5.048 9.450 10.911 1.00 0.00 H new ATOM 0 HE2 HIS A 17 3.546 7.479 11.566 1.00 0.00 H new ATOM 291 N ILE A 18 0.284 12.688 15.590 1.00 0.00 N ATOM 292 CA ILE A 18 -0.272 13.696 16.497 1.00 0.00 C ATOM 293 C ILE A 18 -1.703 13.324 16.918 1.00 0.00 C ATOM 294 O ILE A 18 -2.069 13.440 18.087 1.00 0.00 O ATOM 295 CB ILE A 18 -0.248 15.081 15.813 1.00 0.00 C ATOM 296 CG1 ILE A 18 -1.168 15.068 14.582 1.00 0.00 C ATOM 297 CG2 ILE A 18 1.192 15.416 15.377 1.00 0.00 C ATOM 298 CD1 ILE A 18 -1.005 16.356 13.763 1.00 0.00 C ATOM 0 H ILE A 18 0.349 12.984 14.616 1.00 0.00 H new ATOM 0 HA ILE A 18 0.341 13.734 17.398 1.00 0.00 H new ATOM 0 HB ILE A 18 -0.599 15.836 16.517 1.00 0.00 H new ATOM 0 HG12 ILE A 18 -0.936 14.204 13.959 1.00 0.00 H new ATOM 0 HG13 ILE A 18 -2.205 14.963 14.899 1.00 0.00 H new ATOM 0 HG21 ILE A 18 1.208 16.393 14.895 1.00 0.00 H new ATOM 0 HG22 ILE A 18 1.842 15.432 16.252 1.00 0.00 H new ATOM 0 HG23 ILE A 18 1.545 14.660 14.676 1.00 0.00 H new ATOM 0 HD11 ILE A 18 -1.666 16.323 12.897 1.00 0.00 H new ATOM 0 HD12 ILE A 18 -1.261 17.216 14.382 1.00 0.00 H new ATOM 0 HD13 ILE A 18 0.028 16.445 13.427 1.00 0.00 H new ATOM 310 N GLU A 19 -2.500 12.882 15.950 1.00 0.00 N ATOM 311 CA GLU A 19 -3.890 12.509 16.237 1.00 0.00 C ATOM 312 C GLU A 19 -3.937 11.291 17.150 1.00 0.00 C ATOM 313 O GLU A 19 -4.604 11.309 18.184 1.00 0.00 O ATOM 314 CB GLU A 19 -4.630 12.204 14.923 1.00 0.00 C ATOM 315 CG GLU A 19 -6.129 11.958 15.174 1.00 0.00 C ATOM 316 CD GLU A 19 -6.804 13.250 15.626 1.00 0.00 C ATOM 317 OE1 GLU A 19 -6.251 14.304 15.358 1.00 0.00 O ATOM 318 OE2 GLU A 19 -7.862 13.167 16.228 1.00 0.00 O ATOM 0 H GLU A 19 -2.219 12.773 14.976 1.00 0.00 H new ATOM 0 HA GLU A 19 -4.378 13.343 16.742 1.00 0.00 H new ATOM 0 HB2 GLU A 19 -4.506 13.037 14.231 1.00 0.00 H new ATOM 0 HB3 GLU A 19 -4.189 11.327 14.449 1.00 0.00 H new ATOM 0 HG2 GLU A 19 -6.603 11.590 14.264 1.00 0.00 H new ATOM 0 HG3 GLU A 19 -6.257 11.187 15.934 1.00 0.00 H new ATOM 325 N MET A 20 -3.225 10.236 16.767 1.00 0.00 N ATOM 326 CA MET A 20 -3.187 9.002 17.559 1.00 0.00 C ATOM 327 C MET A 20 -1.861 8.897 18.301 1.00 0.00 C ATOM 328 O MET A 20 -1.160 9.890 18.496 1.00 0.00 O ATOM 329 CB MET A 20 -3.356 7.785 16.644 1.00 0.00 C ATOM 330 CG MET A 20 -4.651 7.930 15.843 1.00 0.00 C ATOM 331 SD MET A 20 -4.935 6.425 14.875 1.00 0.00 S ATOM 332 CE MET A 20 -5.932 7.170 13.558 1.00 0.00 C ATOM 0 H MET A 20 -2.666 10.206 15.915 1.00 0.00 H new ATOM 0 HA MET A 20 -4.003 9.027 18.281 1.00 0.00 H new ATOM 0 HB2 MET A 20 -2.505 7.703 15.969 1.00 0.00 H new ATOM 0 HB3 MET A 20 -3.382 6.871 17.237 1.00 0.00 H new ATOM 0 HG2 MET A 20 -5.490 8.106 16.516 1.00 0.00 H new ATOM 0 HG3 MET A 20 -4.587 8.794 15.181 1.00 0.00 H new ATOM 0 HE1 MET A 20 -6.219 6.402 12.840 1.00 0.00 H new ATOM 0 HE2 MET A 20 -6.828 7.617 13.989 1.00 0.00 H new ATOM 0 HE3 MET A 20 -5.350 7.940 13.052 1.00 0.00 H new ATOM 342 N ASN A 21 -1.528 7.682 18.723 1.00 0.00 N ATOM 343 CA ASN A 21 -0.281 7.450 19.450 1.00 0.00 C ATOM 344 C ASN A 21 0.172 6.009 19.273 1.00 0.00 C ATOM 345 O ASN A 21 0.455 5.316 20.250 1.00 0.00 O ATOM 346 CB ASN A 21 -0.487 7.746 20.936 1.00 0.00 C ATOM 347 CG ASN A 21 0.836 7.614 21.684 1.00 0.00 C ATOM 348 OD1 ASN A 21 1.888 7.452 21.066 1.00 0.00 O ATOM 349 ND2 ASN A 21 0.843 7.667 22.988 1.00 0.00 N ATOM 0 H ASN A 21 -2.097 6.848 18.577 1.00 0.00 H new ATOM 0 HA ASN A 21 0.487 8.113 19.051 1.00 0.00 H new ATOM 0 HB2 ASN A 21 -0.887 8.752 21.063 1.00 0.00 H new ATOM 0 HB3 ASN A 21 -1.221 7.057 21.354 1.00 0.00 H new ATOM 0 HD21 ASN A 21 1.722 7.574 23.497 1.00 0.00 H new ATOM 0 HD22 ASN A 21 -0.030 7.801 23.498 1.00 0.00 H new ATOM 356 N GLN A 22 0.249 5.564 18.023 1.00 0.00 N ATOM 357 CA GLN A 22 0.670 4.197 17.738 1.00 0.00 C ATOM 358 C GLN A 22 2.069 3.947 18.288 1.00 0.00 C ATOM 359 O GLN A 22 2.306 2.967 18.995 1.00 0.00 O ATOM 360 CB GLN A 22 0.668 3.959 16.226 1.00 0.00 C ATOM 361 CG GLN A 22 1.008 2.495 15.931 1.00 0.00 C ATOM 362 CD GLN A 22 0.831 2.205 14.445 1.00 0.00 C ATOM 363 OE1 GLN A 22 0.206 2.987 13.729 1.00 0.00 O ATOM 364 NE2 GLN A 22 1.339 1.115 13.938 1.00 0.00 N ATOM 0 H GLN A 22 0.028 6.123 17.199 1.00 0.00 H new ATOM 0 HA GLN A 22 -0.028 3.511 18.217 1.00 0.00 H new ATOM 0 HB2 GLN A 22 -0.309 4.206 15.811 1.00 0.00 H new ATOM 0 HB3 GLN A 22 1.394 4.615 15.744 1.00 0.00 H new ATOM 0 HG2 GLN A 22 2.035 2.285 16.231 1.00 0.00 H new ATOM 0 HG3 GLN A 22 0.364 1.839 16.517 1.00 0.00 H new ATOM 0 HE21 GLN A 22 1.857 0.469 14.534 1.00 0.00 H new ATOM 0 HE22 GLN A 22 1.219 0.910 12.946 1.00 0.00 H new ATOM 373 N SER A 23 2.995 4.842 17.959 1.00 0.00 N ATOM 374 CA SER A 23 4.374 4.717 18.424 1.00 0.00 C ATOM 375 C SER A 23 5.203 5.910 17.960 1.00 0.00 C ATOM 376 O SER A 23 6.052 5.773 17.080 1.00 0.00 O ATOM 377 CB SER A 23 5.011 3.428 17.887 1.00 0.00 C ATOM 378 OG SER A 23 4.850 3.380 16.476 1.00 0.00 O ATOM 0 H SER A 23 2.818 5.659 17.375 1.00 0.00 H new ATOM 0 HA SER A 23 4.358 4.686 19.513 1.00 0.00 H new ATOM 0 HB2 SER A 23 6.069 3.396 18.146 1.00 0.00 H new ATOM 0 HB3 SER A 23 4.544 2.558 18.348 1.00 0.00 H new ATOM 0 HG SER A 23 5.273 4.166 16.072 1.00 0.00 H new ATOM 384 N GLU A 24 4.959 7.074 18.555 1.00 0.00 N ATOM 385 CA GLU A 24 5.708 8.271 18.184 1.00 0.00 C ATOM 386 C GLU A 24 5.461 9.389 19.201 1.00 0.00 C ATOM 387 O GLU A 24 5.534 9.161 20.409 1.00 0.00 O ATOM 388 CB GLU A 24 5.311 8.723 16.755 1.00 0.00 C ATOM 389 CG GLU A 24 6.435 9.585 16.138 1.00 0.00 C ATOM 390 CD GLU A 24 7.623 8.696 15.765 1.00 0.00 C ATOM 391 OE1 GLU A 24 7.378 7.569 15.366 1.00 0.00 O ATOM 392 OE2 GLU A 24 8.748 9.156 15.863 1.00 0.00 O ATOM 0 H GLU A 24 4.260 7.214 19.285 1.00 0.00 H new ATOM 0 HA GLU A 24 6.773 8.040 18.188 1.00 0.00 H new ATOM 0 HB2 GLU A 24 5.125 7.851 16.128 1.00 0.00 H new ATOM 0 HB3 GLU A 24 4.383 9.293 16.791 1.00 0.00 H new ATOM 0 HG2 GLU A 24 6.065 10.103 15.253 1.00 0.00 H new ATOM 0 HG3 GLU A 24 6.750 10.350 16.847 1.00 0.00 H new ATOM 399 N ASP A 25 5.173 10.589 18.707 1.00 0.00 N ATOM 400 CA ASP A 25 4.932 11.734 19.580 1.00 0.00 C ATOM 401 C ASP A 25 4.070 12.766 18.874 1.00 0.00 C ATOM 402 O ASP A 25 3.474 12.490 17.833 1.00 0.00 O ATOM 403 CB ASP A 25 6.271 12.366 19.960 1.00 0.00 C ATOM 404 CG ASP A 25 7.090 11.385 20.792 1.00 0.00 C ATOM 405 OD1 ASP A 25 6.561 10.879 21.767 1.00 0.00 O ATOM 406 OD2 ASP A 25 8.230 11.143 20.431 1.00 0.00 O ATOM 0 H ASP A 25 5.101 10.794 17.710 1.00 0.00 H new ATOM 0 HA ASP A 25 4.411 11.395 20.475 1.00 0.00 H new ATOM 0 HB2 ASP A 25 6.821 12.641 19.060 1.00 0.00 H new ATOM 0 HB3 ASP A 25 6.103 13.283 20.524 1.00 0.00 H new ATOM 411 N LYS A 26 4.011 13.965 19.446 1.00 0.00 N ATOM 412 CA LYS A 26 3.219 15.040 18.864 1.00 0.00 C ATOM 413 C LYS A 26 4.024 15.758 17.774 1.00 0.00 C ATOM 414 O LYS A 26 4.166 15.228 16.672 1.00 0.00 O ATOM 415 CB LYS A 26 2.783 16.013 19.969 1.00 0.00 C ATOM 416 CG LYS A 26 1.728 16.979 19.419 1.00 0.00 C ATOM 417 CD LYS A 26 1.271 17.923 20.535 1.00 0.00 C ATOM 418 CE LYS A 26 0.085 18.759 20.051 1.00 0.00 C ATOM 419 NZ LYS A 26 -0.361 19.669 21.142 1.00 0.00 N ATOM 0 H LYS A 26 4.499 14.214 20.306 1.00 0.00 H new ATOM 0 HA LYS A 26 2.325 14.625 18.399 1.00 0.00 H new ATOM 0 HB2 LYS A 26 2.377 15.459 20.815 1.00 0.00 H new ATOM 0 HB3 LYS A 26 3.644 16.571 20.337 1.00 0.00 H new ATOM 0 HG2 LYS A 26 2.141 17.552 18.589 1.00 0.00 H new ATOM 0 HG3 LYS A 26 0.877 16.421 19.028 1.00 0.00 H new ATOM 0 HD2 LYS A 26 0.987 17.348 21.417 1.00 0.00 H new ATOM 0 HD3 LYS A 26 2.092 18.576 20.831 1.00 0.00 H new ATOM 0 HE2 LYS A 26 0.370 19.339 19.173 1.00 0.00 H new ATOM 0 HE3 LYS A 26 -0.734 18.106 19.750 1.00 0.00 H new ATOM 0 HZ1 LYS A 26 -1.167 20.237 20.812 1.00 0.00 H new ATOM 0 HZ2 LYS A 26 -0.649 19.106 21.968 1.00 0.00 H new ATOM 0 HZ3 LYS A 26 0.421 20.300 21.409 1.00 0.00 H new ATOM 433 N ILE A 27 4.531 16.949 18.075 1.00 0.00 N ATOM 434 CA ILE A 27 5.311 17.708 17.106 1.00 0.00 C ATOM 435 C ILE A 27 6.590 16.954 16.743 1.00 0.00 C ATOM 436 O ILE A 27 7.009 16.954 15.586 1.00 0.00 O ATOM 437 CB ILE A 27 5.659 19.086 17.683 1.00 0.00 C ATOM 438 CG1 ILE A 27 6.309 19.961 16.588 1.00 0.00 C ATOM 439 CG2 ILE A 27 6.614 18.940 18.878 1.00 0.00 C ATOM 440 CD1 ILE A 27 6.439 21.422 17.053 1.00 0.00 C ATOM 0 H ILE A 27 4.416 17.408 18.979 1.00 0.00 H new ATOM 0 HA ILE A 27 4.716 17.838 16.202 1.00 0.00 H new ATOM 0 HB ILE A 27 4.743 19.566 18.028 1.00 0.00 H new ATOM 0 HG12 ILE A 27 7.294 19.566 16.339 1.00 0.00 H new ATOM 0 HG13 ILE A 27 5.709 19.917 15.679 1.00 0.00 H new ATOM 0 HG21 ILE A 27 6.852 19.926 19.276 1.00 0.00 H new ATOM 0 HG22 ILE A 27 6.137 18.341 19.654 1.00 0.00 H new ATOM 0 HG23 ILE A 27 7.531 18.449 18.553 1.00 0.00 H new ATOM 0 HD11 ILE A 27 6.900 22.016 16.263 1.00 0.00 H new ATOM 0 HD12 ILE A 27 5.450 21.822 17.278 1.00 0.00 H new ATOM 0 HD13 ILE A 27 7.060 21.465 17.948 1.00 0.00 H new ATOM 452 N HIS A 28 7.209 16.326 17.738 1.00 0.00 N ATOM 453 CA HIS A 28 8.441 15.571 17.494 1.00 0.00 C ATOM 454 C HIS A 28 8.188 14.387 16.544 1.00 0.00 C ATOM 455 O HIS A 28 9.056 13.535 16.357 1.00 0.00 O ATOM 456 CB HIS A 28 9.018 15.080 18.823 1.00 0.00 C ATOM 457 CG HIS A 28 10.345 14.415 18.587 1.00 0.00 C ATOM 458 ND1 HIS A 28 10.505 13.038 18.617 1.00 0.00 N ATOM 459 CD2 HIS A 28 11.589 14.930 18.320 1.00 0.00 C ATOM 460 CE1 HIS A 28 11.802 12.775 18.374 1.00 0.00 C ATOM 461 NE2 HIS A 28 12.507 13.893 18.186 1.00 0.00 N ATOM 0 H HIS A 28 6.888 16.322 18.706 1.00 0.00 H new ATOM 0 HA HIS A 28 9.163 16.232 17.014 1.00 0.00 H new ATOM 0 HB2 HIS A 28 9.138 15.918 19.510 1.00 0.00 H new ATOM 0 HB3 HIS A 28 8.328 14.379 19.293 1.00 0.00 H new ATOM 0 HD1 HIS A 28 9.773 12.350 18.792 1.00 0.00 H new ATOM 0 HD2 HIS A 28 11.820 15.981 18.228 1.00 0.00 H new ATOM 0 HE1 HIS A 28 12.222 11.781 18.336 1.00 0.00 H new ATOM 470 N ALA A 29 7.001 14.355 15.946 1.00 0.00 N ATOM 471 CA ALA A 29 6.641 13.293 15.000 1.00 0.00 C ATOM 472 C ALA A 29 7.308 13.530 13.644 1.00 0.00 C ATOM 473 O ALA A 29 7.840 12.606 13.029 1.00 0.00 O ATOM 474 CB ALA A 29 5.121 13.247 14.822 1.00 0.00 C ATOM 0 H ALA A 29 6.270 15.050 16.097 1.00 0.00 H new ATOM 0 HA ALA A 29 6.990 12.342 15.401 1.00 0.00 H new ATOM 0 HB1 ALA A 29 4.861 12.456 14.118 1.00 0.00 H new ATOM 0 HB2 ALA A 29 4.648 13.047 15.783 1.00 0.00 H new ATOM 0 HB3 ALA A 29 4.771 14.205 14.437 1.00 0.00 H new ATOM 480 N MET A 30 7.263 14.775 13.183 1.00 0.00 N ATOM 481 CA MET A 30 7.858 15.135 11.904 1.00 0.00 C ATOM 482 C MET A 30 9.366 14.901 11.945 1.00 0.00 C ATOM 483 O MET A 30 9.917 14.314 11.014 1.00 0.00 O ATOM 484 CB MET A 30 7.566 16.629 11.578 1.00 0.00 C ATOM 485 CG MET A 30 7.506 17.448 12.887 1.00 0.00 C ATOM 486 SD MET A 30 7.947 19.183 12.566 1.00 0.00 S ATOM 487 CE MET A 30 9.553 19.205 13.416 1.00 0.00 C ATOM 0 H MET A 30 6.821 15.550 13.676 1.00 0.00 H new ATOM 0 HA MET A 30 7.420 14.510 11.126 1.00 0.00 H new ATOM 0 HB2 MET A 30 8.343 17.027 10.925 1.00 0.00 H new ATOM 0 HB3 MET A 30 6.622 16.716 11.040 1.00 0.00 H new ATOM 0 HG2 MET A 30 6.504 17.393 13.313 1.00 0.00 H new ATOM 0 HG3 MET A 30 8.189 17.022 13.622 1.00 0.00 H new ATOM 0 HE1 MET A 30 9.995 20.198 13.333 1.00 0.00 H new ATOM 0 HE2 MET A 30 9.411 18.957 14.468 1.00 0.00 H new ATOM 0 HE3 MET A 30 10.218 18.473 12.957 1.00 0.00 H new ATOM 497 N ASN A 31 10.025 15.352 13.008 1.00 0.00 N ATOM 498 CA ASN A 31 11.473 15.179 13.109 1.00 0.00 C ATOM 499 C ASN A 31 11.855 13.710 12.920 1.00 0.00 C ATOM 500 O ASN A 31 12.744 13.393 12.130 1.00 0.00 O ATOM 501 CB ASN A 31 11.949 15.653 14.485 1.00 0.00 C ATOM 502 CG ASN A 31 13.461 15.492 14.605 1.00 0.00 C ATOM 503 OD1 ASN A 31 14.180 15.640 13.617 1.00 0.00 O ATOM 504 ND2 ASN A 31 13.990 15.204 15.763 1.00 0.00 N ATOM 0 H ASN A 31 9.592 15.831 13.798 1.00 0.00 H new ATOM 0 HA ASN A 31 11.950 15.769 12.326 1.00 0.00 H new ATOM 0 HB2 ASN A 31 11.675 16.698 14.633 1.00 0.00 H new ATOM 0 HB3 ASN A 31 11.452 15.079 15.267 1.00 0.00 H new ATOM 0 HD21 ASN A 31 15.001 15.101 15.850 1.00 0.00 H new ATOM 0 HD22 ASN A 31 13.392 15.082 16.580 1.00 0.00 H new ATOM 511 N SER A 32 11.173 12.822 13.636 1.00 0.00 N ATOM 512 CA SER A 32 11.462 11.397 13.517 1.00 0.00 C ATOM 513 C SER A 32 11.133 10.889 12.113 1.00 0.00 C ATOM 514 O SER A 32 11.977 10.297 11.440 1.00 0.00 O ATOM 515 CB SER A 32 10.624 10.631 14.536 1.00 0.00 C ATOM 516 OG SER A 32 9.251 10.935 14.323 1.00 0.00 O ATOM 0 H SER A 32 10.429 13.057 14.293 1.00 0.00 H new ATOM 0 HA SER A 32 12.524 11.240 13.703 1.00 0.00 H new ATOM 0 HB2 SER A 32 10.793 9.559 14.434 1.00 0.00 H new ATOM 0 HB3 SER A 32 10.918 10.905 15.549 1.00 0.00 H new ATOM 0 HG SER A 32 8.728 10.647 15.100 1.00 0.00 H new ATOM 522 N TYR A 33 9.901 11.132 11.677 1.00 0.00 N ATOM 523 CA TYR A 33 9.458 10.703 10.356 1.00 0.00 C ATOM 524 C TYR A 33 10.310 11.363 9.267 1.00 0.00 C ATOM 525 O TYR A 33 10.710 10.725 8.293 1.00 0.00 O ATOM 526 CB TYR A 33 7.983 11.083 10.160 1.00 0.00 C ATOM 527 CG TYR A 33 7.548 10.697 8.761 1.00 0.00 C ATOM 528 CD1 TYR A 33 7.808 11.568 7.696 1.00 0.00 C ATOM 529 CD2 TYR A 33 6.905 9.476 8.525 1.00 0.00 C ATOM 530 CE1 TYR A 33 7.425 11.218 6.396 1.00 0.00 C ATOM 531 CE2 TYR A 33 6.522 9.127 7.225 1.00 0.00 C ATOM 532 CZ TYR A 33 6.782 9.998 6.160 1.00 0.00 C ATOM 533 OH TYR A 33 6.401 9.654 4.879 1.00 0.00 O ATOM 0 H TYR A 33 9.192 11.624 12.220 1.00 0.00 H new ATOM 0 HA TYR A 33 9.570 9.621 10.281 1.00 0.00 H new ATOM 0 HB2 TYR A 33 7.363 10.575 10.899 1.00 0.00 H new ATOM 0 HB3 TYR A 33 7.848 12.154 10.313 1.00 0.00 H new ATOM 0 HD1 TYR A 33 8.304 12.510 7.878 1.00 0.00 H new ATOM 0 HD2 TYR A 33 6.705 8.804 9.346 1.00 0.00 H new ATOM 0 HE1 TYR A 33 7.626 11.890 5.575 1.00 0.00 H new ATOM 0 HE2 TYR A 33 6.026 8.185 7.043 1.00 0.00 H new ATOM 0 HH TYR A 33 6.883 10.212 4.233 1.00 0.00 H new ATOM 543 N TYR A 34 10.578 12.652 9.447 1.00 0.00 N ATOM 544 CA TYR A 34 11.370 13.409 8.481 1.00 0.00 C ATOM 545 C TYR A 34 12.713 12.726 8.263 1.00 0.00 C ATOM 546 O TYR A 34 13.133 12.526 7.123 1.00 0.00 O ATOM 547 CB TYR A 34 11.579 14.857 8.981 1.00 0.00 C ATOM 548 CG TYR A 34 12.479 15.619 8.025 1.00 0.00 C ATOM 549 CD1 TYR A 34 13.869 15.530 8.162 1.00 0.00 C ATOM 550 CD2 TYR A 34 11.924 16.388 6.996 1.00 0.00 C ATOM 551 CE1 TYR A 34 14.705 16.212 7.269 1.00 0.00 C ATOM 552 CE2 TYR A 34 12.760 17.070 6.103 1.00 0.00 C ATOM 553 CZ TYR A 34 14.150 16.982 6.240 1.00 0.00 C ATOM 554 OH TYR A 34 14.974 17.657 5.362 1.00 0.00 O ATOM 0 H TYR A 34 10.260 13.194 10.250 1.00 0.00 H new ATOM 0 HA TYR A 34 10.834 13.443 7.532 1.00 0.00 H new ATOM 0 HB2 TYR A 34 10.617 15.362 9.066 1.00 0.00 H new ATOM 0 HB3 TYR A 34 12.022 14.845 9.977 1.00 0.00 H new ATOM 0 HD1 TYR A 34 14.297 14.936 8.956 1.00 0.00 H new ATOM 0 HD2 TYR A 34 10.851 16.456 6.890 1.00 0.00 H new ATOM 0 HE1 TYR A 34 15.778 16.144 7.374 1.00 0.00 H new ATOM 0 HE2 TYR A 34 12.332 17.664 5.309 1.00 0.00 H new ATOM 0 HH TYR A 34 14.428 18.142 4.708 1.00 0.00 H new ATOM 564 N ARG A 35 13.382 12.368 9.354 1.00 0.00 N ATOM 565 CA ARG A 35 14.670 11.692 9.289 1.00 0.00 C ATOM 566 C ARG A 35 14.485 10.226 8.901 1.00 0.00 C ATOM 567 O ARG A 35 15.425 9.571 8.451 1.00 0.00 O ATOM 568 CB ARG A 35 15.408 11.810 10.625 1.00 0.00 C ATOM 569 CG ARG A 35 16.816 11.216 10.484 1.00 0.00 C ATOM 570 CD ARG A 35 17.625 11.498 11.744 1.00 0.00 C ATOM 571 NE ARG A 35 19.005 11.066 11.558 1.00 0.00 N ATOM 572 CZ ARG A 35 19.911 11.261 12.510 1.00 0.00 C ATOM 573 NH1 ARG A 35 19.574 11.863 13.618 1.00 0.00 N ATOM 574 NH2 ARG A 35 21.138 10.851 12.338 1.00 0.00 N ATOM 0 H ARG A 35 13.048 12.538 10.303 1.00 0.00 H new ATOM 0 HA ARG A 35 15.275 12.175 8.522 1.00 0.00 H new ATOM 0 HB2 ARG A 35 15.471 12.855 10.927 1.00 0.00 H new ATOM 0 HB3 ARG A 35 14.857 11.285 11.405 1.00 0.00 H new ATOM 0 HG2 ARG A 35 16.752 10.141 10.315 1.00 0.00 H new ATOM 0 HG3 ARG A 35 17.316 11.645 9.616 1.00 0.00 H new ATOM 0 HD2 ARG A 35 17.597 12.563 11.973 1.00 0.00 H new ATOM 0 HD3 ARG A 35 17.184 10.977 12.594 1.00 0.00 H new ATOM 0 HE ARG A 35 19.278 10.609 10.688 1.00 0.00 H new ATOM 0 HH11 ARG A 35 18.615 12.184 13.753 1.00 0.00 H new ATOM 0 HH12 ARG A 35 20.269 12.013 14.349 1.00 0.00 H new ATOM 0 HH21 ARG A 35 21.402 10.381 11.472 1.00 0.00 H new ATOM 0 HH22 ARG A 35 21.833 11.001 13.069 1.00 0.00 H new ATOM 588 N SER A 36 13.275 9.713 9.101 1.00 0.00 N ATOM 589 CA SER A 36 12.994 8.315 8.780 1.00 0.00 C ATOM 590 C SER A 36 13.039 8.094 7.273 1.00 0.00 C ATOM 591 O SER A 36 13.703 7.176 6.792 1.00 0.00 O ATOM 592 CB SER A 36 11.615 7.901 9.311 1.00 0.00 C ATOM 593 OG SER A 36 11.488 6.486 9.226 1.00 0.00 O ATOM 0 H SER A 36 12.483 10.234 9.478 1.00 0.00 H new ATOM 0 HA SER A 36 13.759 7.703 9.258 1.00 0.00 H new ATOM 0 HB2 SER A 36 11.496 8.228 10.344 1.00 0.00 H new ATOM 0 HB3 SER A 36 10.828 8.384 8.732 1.00 0.00 H new ATOM 0 HG SER A 36 10.609 6.215 9.565 1.00 0.00 H new ATOM 599 N VAL A 37 12.318 8.931 6.534 1.00 0.00 N ATOM 600 CA VAL A 37 12.288 8.804 5.076 1.00 0.00 C ATOM 601 C VAL A 37 13.587 9.310 4.462 1.00 0.00 C ATOM 602 O VAL A 37 14.163 8.662 3.588 1.00 0.00 O ATOM 603 CB VAL A 37 11.090 9.573 4.482 1.00 0.00 C ATOM 604 CG1 VAL A 37 9.822 9.205 5.255 1.00 0.00 C ATOM 605 CG2 VAL A 37 11.332 11.096 4.552 1.00 0.00 C ATOM 0 H VAL A 37 11.754 9.693 6.910 1.00 0.00 H new ATOM 0 HA VAL A 37 12.177 7.747 4.836 1.00 0.00 H new ATOM 0 HB VAL A 37 10.973 9.296 3.434 1.00 0.00 H new ATOM 0 HG11 VAL A 37 8.972 9.746 4.839 1.00 0.00 H new ATOM 0 HG12 VAL A 37 9.645 8.133 5.173 1.00 0.00 H new ATOM 0 HG13 VAL A 37 9.945 9.474 6.304 1.00 0.00 H new ATOM 0 HG21 VAL A 37 10.476 11.620 4.128 1.00 0.00 H new ATOM 0 HG22 VAL A 37 11.463 11.396 5.592 1.00 0.00 H new ATOM 0 HG23 VAL A 37 12.229 11.348 3.986 1.00 0.00 H new ATOM 615 N VAL A 38 14.041 10.473 4.919 1.00 0.00 N ATOM 616 CA VAL A 38 15.267 11.053 4.382 1.00 0.00 C ATOM 617 C VAL A 38 16.416 10.065 4.535 1.00 0.00 C ATOM 618 O VAL A 38 17.149 9.828 3.575 1.00 0.00 O ATOM 619 CB VAL A 38 15.584 12.370 5.124 1.00 0.00 C ATOM 620 CG1 VAL A 38 17.002 12.872 4.771 1.00 0.00 C ATOM 621 CG2 VAL A 38 14.550 13.438 4.731 1.00 0.00 C ATOM 0 H VAL A 38 13.588 11.024 5.647 1.00 0.00 H new ATOM 0 HA VAL A 38 15.134 11.269 3.322 1.00 0.00 H new ATOM 0 HB VAL A 38 15.539 12.184 6.197 1.00 0.00 H new ATOM 0 HG11 VAL A 38 17.203 13.801 5.305 1.00 0.00 H new ATOM 0 HG12 VAL A 38 17.737 12.121 5.061 1.00 0.00 H new ATOM 0 HG13 VAL A 38 17.068 13.049 3.698 1.00 0.00 H new ATOM 0 HG21 VAL A 38 14.772 14.369 5.253 1.00 0.00 H new ATOM 0 HG22 VAL A 38 14.592 13.607 3.655 1.00 0.00 H new ATOM 0 HG23 VAL A 38 13.552 13.097 5.006 1.00 0.00 H new ATOM 631 N SER A 39 16.573 9.493 5.725 1.00 0.00 N ATOM 632 CA SER A 39 17.632 8.533 5.959 1.00 0.00 C ATOM 633 C SER A 39 17.458 7.326 5.046 1.00 0.00 C ATOM 634 O SER A 39 18.434 6.821 4.491 1.00 0.00 O ATOM 635 CB SER A 39 17.616 8.084 7.421 1.00 0.00 C ATOM 636 OG SER A 39 17.821 9.212 8.261 1.00 0.00 O ATOM 0 H SER A 39 15.981 9.680 6.534 1.00 0.00 H new ATOM 0 HA SER A 39 18.589 9.006 5.741 1.00 0.00 H new ATOM 0 HB2 SER A 39 16.664 7.609 7.657 1.00 0.00 H new ATOM 0 HB3 SER A 39 18.395 7.341 7.594 1.00 0.00 H new ATOM 0 HG SER A 39 17.030 9.790 8.231 1.00 0.00 H new ATOM 642 N THR A 40 16.222 6.860 4.900 1.00 0.00 N ATOM 643 CA THR A 40 15.947 5.705 4.053 1.00 0.00 C ATOM 644 C THR A 40 16.154 6.053 2.579 1.00 0.00 C ATOM 645 O THR A 40 16.793 5.306 1.839 1.00 0.00 O ATOM 646 CB THR A 40 14.506 5.225 4.267 1.00 0.00 C ATOM 647 OG1 THR A 40 14.321 4.890 5.636 1.00 0.00 O ATOM 648 CG2 THR A 40 14.245 3.986 3.404 1.00 0.00 C ATOM 0 H THR A 40 15.401 7.261 5.353 1.00 0.00 H new ATOM 0 HA THR A 40 16.640 4.910 4.328 1.00 0.00 H new ATOM 0 HB THR A 40 13.813 6.018 3.985 1.00 0.00 H new ATOM 0 HG1 THR A 40 14.230 5.710 6.164 1.00 0.00 H new ATOM 0 HG21 THR A 40 13.221 3.645 3.557 1.00 0.00 H new ATOM 0 HG22 THR A 40 14.391 4.237 2.353 1.00 0.00 H new ATOM 0 HG23 THR A 40 14.937 3.193 3.687 1.00 0.00 H new ATOM 656 N LEU A 41 15.607 7.190 2.163 1.00 0.00 N ATOM 657 CA LEU A 41 15.734 7.628 0.777 1.00 0.00 C ATOM 658 C LEU A 41 17.204 7.872 0.428 1.00 0.00 C ATOM 659 O LEU A 41 17.614 7.703 -0.721 1.00 0.00 O ATOM 660 CB LEU A 41 14.916 8.910 0.557 1.00 0.00 C ATOM 661 CG LEU A 41 13.399 8.612 0.605 1.00 0.00 C ATOM 662 CD1 LEU A 41 12.635 9.948 0.639 1.00 0.00 C ATOM 663 CD2 LEU A 41 12.961 7.772 -0.629 1.00 0.00 C ATOM 0 H LEU A 41 15.075 7.822 2.761 1.00 0.00 H new ATOM 0 HA LEU A 41 15.349 6.845 0.124 1.00 0.00 H new ATOM 0 HB2 LEU A 41 15.171 9.644 1.321 1.00 0.00 H new ATOM 0 HB3 LEU A 41 15.174 9.350 -0.406 1.00 0.00 H new ATOM 0 HG LEU A 41 13.173 8.032 1.499 1.00 0.00 H new ATOM 0 HD11 LEU A 41 11.563 9.753 0.673 1.00 0.00 H new ATOM 0 HD12 LEU A 41 12.929 10.513 1.523 1.00 0.00 H new ATOM 0 HD13 LEU A 41 12.871 10.525 -0.255 1.00 0.00 H new ATOM 0 HD21 LEU A 41 11.890 7.575 -0.573 1.00 0.00 H new ATOM 0 HD22 LEU A 41 13.181 8.325 -1.542 1.00 0.00 H new ATOM 0 HD23 LEU A 41 13.504 6.827 -0.637 1.00 0.00 H new ATOM 675 N VAL A 42 17.987 8.271 1.425 1.00 0.00 N ATOM 676 CA VAL A 42 19.427 8.531 1.216 1.00 0.00 C ATOM 677 C VAL A 42 20.233 7.234 1.343 1.00 0.00 C ATOM 678 O VAL A 42 21.197 7.022 0.607 1.00 0.00 O ATOM 679 CB VAL A 42 19.926 9.580 2.235 1.00 0.00 C ATOM 680 CG1 VAL A 42 21.463 9.719 2.163 1.00 0.00 C ATOM 681 CG2 VAL A 42 19.273 10.944 1.921 1.00 0.00 C ATOM 0 H VAL A 42 17.663 8.423 2.380 1.00 0.00 H new ATOM 0 HA VAL A 42 19.570 8.922 0.209 1.00 0.00 H new ATOM 0 HB VAL A 42 19.651 9.255 3.239 1.00 0.00 H new ATOM 0 HG11 VAL A 42 21.795 10.462 2.888 1.00 0.00 H new ATOM 0 HG12 VAL A 42 21.926 8.759 2.389 1.00 0.00 H new ATOM 0 HG13 VAL A 42 21.753 10.034 1.161 1.00 0.00 H new ATOM 0 HG21 VAL A 42 19.622 11.688 2.637 1.00 0.00 H new ATOM 0 HG22 VAL A 42 19.547 11.255 0.913 1.00 0.00 H new ATOM 0 HG23 VAL A 42 18.189 10.853 1.991 1.00 0.00 H new ATOM 691 N GLN A 43 19.836 6.380 2.281 1.00 0.00 N ATOM 692 CA GLN A 43 20.530 5.111 2.491 1.00 0.00 C ATOM 693 C GLN A 43 20.325 4.191 1.289 1.00 0.00 C ATOM 694 O GLN A 43 20.925 3.118 1.222 1.00 0.00 O ATOM 695 CB GLN A 43 20.021 4.432 3.784 1.00 0.00 C ATOM 696 CG GLN A 43 20.678 5.077 5.021 1.00 0.00 C ATOM 697 CD GLN A 43 19.973 4.617 6.294 1.00 0.00 C ATOM 698 OE1 GLN A 43 19.013 3.849 6.231 1.00 0.00 O ATOM 699 NE2 GLN A 43 20.400 5.038 7.454 1.00 0.00 N ATOM 0 H GLN A 43 19.044 6.540 2.904 1.00 0.00 H new ATOM 0 HA GLN A 43 21.597 5.308 2.599 1.00 0.00 H new ATOM 0 HB2 GLN A 43 18.937 4.525 3.849 1.00 0.00 H new ATOM 0 HB3 GLN A 43 20.248 3.366 3.757 1.00 0.00 H new ATOM 0 HG2 GLN A 43 21.733 4.807 5.063 1.00 0.00 H new ATOM 0 HG3 GLN A 43 20.630 6.163 4.942 1.00 0.00 H new ATOM 0 HE21 GLN A 43 21.196 5.674 7.504 1.00 0.00 H new ATOM 0 HE22 GLN A 43 19.938 4.730 8.310 1.00 0.00 H new ATOM 708 N ASP A 44 19.481 4.608 0.352 1.00 0.00 N ATOM 709 CA ASP A 44 19.202 3.806 -0.834 1.00 0.00 C ATOM 710 C ASP A 44 18.886 4.701 -2.019 1.00 0.00 C ATOM 711 O ASP A 44 18.626 5.893 -1.859 1.00 0.00 O ATOM 712 CB ASP A 44 18.011 2.882 -0.546 1.00 0.00 C ATOM 713 CG ASP A 44 16.737 3.688 -0.285 1.00 0.00 C ATOM 714 OD1 ASP A 44 16.751 4.885 -0.525 1.00 0.00 O ATOM 715 OD2 ASP A 44 15.772 3.095 0.169 1.00 0.00 O ATOM 0 H ASP A 44 18.979 5.495 0.390 1.00 0.00 H new ATOM 0 HA ASP A 44 20.081 3.210 -1.078 1.00 0.00 H new ATOM 0 HB2 ASP A 44 17.854 2.212 -1.391 1.00 0.00 H new ATOM 0 HB3 ASP A 44 18.233 2.257 0.319 1.00 0.00 H new ATOM 720 N GLN A 45 18.901 4.117 -3.213 1.00 0.00 N ATOM 721 CA GLN A 45 18.593 4.876 -4.451 1.00 0.00 C ATOM 722 C GLN A 45 19.832 5.625 -4.942 1.00 0.00 C ATOM 723 O GLN A 45 20.450 5.236 -5.933 1.00 0.00 O ATOM 724 CB GLN A 45 17.431 5.880 -4.220 1.00 0.00 C ATOM 725 CG GLN A 45 16.918 6.420 -5.545 1.00 0.00 C ATOM 726 CD GLN A 45 15.734 7.348 -5.298 1.00 0.00 C ATOM 727 OE1 GLN A 45 15.099 7.271 -4.246 1.00 0.00 O ATOM 728 NE2 GLN A 45 15.396 8.222 -6.206 1.00 0.00 N ATOM 0 H GLN A 45 19.119 3.132 -3.364 1.00 0.00 H new ATOM 0 HA GLN A 45 18.283 4.158 -5.211 1.00 0.00 H new ATOM 0 HB2 GLN A 45 16.620 5.388 -3.683 1.00 0.00 H new ATOM 0 HB3 GLN A 45 17.774 6.704 -3.594 1.00 0.00 H new ATOM 0 HG2 GLN A 45 17.713 6.958 -6.061 1.00 0.00 H new ATOM 0 HG3 GLN A 45 16.618 5.596 -6.193 1.00 0.00 H new ATOM 0 HE21 GLN A 45 15.924 8.283 -7.076 1.00 0.00 H new ATOM 0 HE22 GLN A 45 14.604 8.844 -6.045 1.00 0.00 H new ATOM 737 N LEU A 46 20.191 6.694 -4.239 1.00 0.00 N ATOM 738 CA LEU A 46 21.365 7.491 -4.612 1.00 0.00 C ATOM 739 C LEU A 46 21.413 7.722 -6.129 1.00 0.00 C ATOM 740 O LEU A 46 22.470 7.628 -6.754 1.00 0.00 O ATOM 741 CB LEU A 46 22.634 6.761 -4.148 1.00 0.00 C ATOM 742 CG LEU A 46 22.696 6.706 -2.594 1.00 0.00 C ATOM 743 CD1 LEU A 46 23.549 5.510 -2.149 1.00 0.00 C ATOM 744 CD2 LEU A 46 23.337 7.981 -2.023 1.00 0.00 C ATOM 0 H LEU A 46 19.694 7.030 -3.414 1.00 0.00 H new ATOM 0 HA LEU A 46 21.301 8.465 -4.127 1.00 0.00 H new ATOM 0 HB2 LEU A 46 22.647 5.750 -4.554 1.00 0.00 H new ATOM 0 HB3 LEU A 46 23.516 7.272 -4.535 1.00 0.00 H new ATOM 0 HG LEU A 46 21.675 6.612 -2.225 1.00 0.00 H new ATOM 0 HD11 LEU A 46 23.589 5.477 -1.060 1.00 0.00 H new ATOM 0 HD12 LEU A 46 23.106 4.587 -2.524 1.00 0.00 H new ATOM 0 HD13 LEU A 46 24.559 5.615 -2.546 1.00 0.00 H new ATOM 0 HD21 LEU A 46 23.368 7.917 -0.935 1.00 0.00 H new ATOM 0 HD22 LEU A 46 24.351 8.083 -2.410 1.00 0.00 H new ATOM 0 HD23 LEU A 46 22.747 8.849 -2.319 1.00 0.00 H new ATOM 756 N THR A 47 20.254 8.020 -6.707 1.00 0.00 N ATOM 757 CA THR A 47 20.165 8.251 -8.138 1.00 0.00 C ATOM 758 C THR A 47 21.007 9.451 -8.529 1.00 0.00 C ATOM 759 O THR A 47 21.629 9.480 -9.590 1.00 0.00 O ATOM 760 CB THR A 47 18.695 8.472 -8.535 1.00 0.00 C ATOM 761 OG1 THR A 47 17.977 7.260 -8.359 1.00 0.00 O ATOM 762 CG2 THR A 47 18.581 8.913 -9.997 1.00 0.00 C ATOM 0 H THR A 47 19.369 8.106 -6.207 1.00 0.00 H new ATOM 0 HA THR A 47 20.547 7.378 -8.667 1.00 0.00 H new ATOM 0 HB THR A 47 18.280 9.256 -7.902 1.00 0.00 H new ATOM 0 HG1 THR A 47 17.039 7.396 -8.609 1.00 0.00 H new ATOM 0 HG21 THR A 47 17.532 9.062 -10.251 1.00 0.00 H new ATOM 0 HG22 THR A 47 19.125 9.847 -10.139 1.00 0.00 H new ATOM 0 HG23 THR A 47 19.005 8.144 -10.643 1.00 0.00 H new ATOM 770 N LYS A 48 21.003 10.461 -7.665 1.00 0.00 N ATOM 771 CA LYS A 48 21.752 11.685 -7.931 1.00 0.00 C ATOM 772 C LYS A 48 21.606 12.665 -6.769 1.00 0.00 C ATOM 773 O LYS A 48 20.547 12.746 -6.147 1.00 0.00 O ATOM 774 CB LYS A 48 21.234 12.349 -9.214 1.00 0.00 C ATOM 775 CG LYS A 48 22.087 13.563 -9.541 1.00 0.00 C ATOM 776 CD LYS A 48 21.643 14.166 -10.871 1.00 0.00 C ATOM 777 CE LYS A 48 22.507 15.392 -11.185 1.00 0.00 C ATOM 778 NZ LYS A 48 23.862 14.938 -11.605 1.00 0.00 N ATOM 0 H LYS A 48 20.494 10.457 -6.781 1.00 0.00 H new ATOM 0 HA LYS A 48 22.803 11.423 -8.050 1.00 0.00 H new ATOM 0 HB2 LYS A 48 21.263 11.639 -10.040 1.00 0.00 H new ATOM 0 HB3 LYS A 48 20.193 12.647 -9.086 1.00 0.00 H new ATOM 0 HG2 LYS A 48 21.998 14.305 -8.748 1.00 0.00 H new ATOM 0 HG3 LYS A 48 23.137 13.277 -9.594 1.00 0.00 H new ATOM 0 HD2 LYS A 48 21.736 13.428 -11.667 1.00 0.00 H new ATOM 0 HD3 LYS A 48 20.592 14.451 -10.822 1.00 0.00 H new ATOM 0 HE2 LYS A 48 22.047 15.984 -11.976 1.00 0.00 H new ATOM 0 HE3 LYS A 48 22.581 16.035 -10.308 1.00 0.00 H new ATOM 0 HZ1 LYS A 48 24.374 15.731 -12.042 1.00 0.00 H new ATOM 0 HZ2 LYS A 48 24.389 14.602 -10.774 1.00 0.00 H new ATOM 0 HZ3 LYS A 48 23.771 14.163 -12.293 1.00 0.00 H new ATOM 792 N ASN A 49 22.670 13.411 -6.490 1.00 0.00 N ATOM 793 CA ASN A 49 22.636 14.385 -5.399 1.00 0.00 C ATOM 794 C ASN A 49 21.504 15.391 -5.609 1.00 0.00 C ATOM 795 O ASN A 49 20.811 15.763 -4.662 1.00 0.00 O ATOM 796 CB ASN A 49 23.965 15.137 -5.323 1.00 0.00 C ATOM 797 CG ASN A 49 25.113 14.149 -5.158 1.00 0.00 C ATOM 798 OD1 ASN A 49 24.927 13.055 -4.472 1.00 0.00 O flip ATOM 799 ND2 ASN A 49 26.208 14.378 -5.673 1.00 0.00 N flip ATOM 0 H ASN A 49 23.555 13.364 -6.994 1.00 0.00 H new ATOM 0 HA ASN A 49 22.466 13.844 -4.468 1.00 0.00 H new ATOM 0 HB2 ASN A 49 24.110 15.728 -6.227 1.00 0.00 H new ATOM 0 HB3 ASN A 49 23.951 15.834 -4.485 1.00 0.00 H new ATOM 0 HD21 ASN A 49 26.351 15.234 -6.209 1.00 0.00 H new ATOM 0 HD22 ASN A 49 26.972 13.711 -5.564 1.00 0.00 H new ATOM 806 N ALA A 50 21.320 15.821 -6.853 1.00 0.00 N ATOM 807 CA ALA A 50 20.258 16.779 -7.158 1.00 0.00 C ATOM 808 C ALA A 50 18.873 16.154 -6.939 1.00 0.00 C ATOM 809 O ALA A 50 18.003 16.749 -6.302 1.00 0.00 O ATOM 810 CB ALA A 50 20.375 17.249 -8.612 1.00 0.00 C ATOM 0 H ALA A 50 21.880 15.529 -7.654 1.00 0.00 H new ATOM 0 HA ALA A 50 20.370 17.629 -6.485 1.00 0.00 H new ATOM 0 HB1 ALA A 50 19.580 17.962 -8.829 1.00 0.00 H new ATOM 0 HB2 ALA A 50 21.343 17.728 -8.763 1.00 0.00 H new ATOM 0 HB3 ALA A 50 20.286 16.392 -9.280 1.00 0.00 H new ATOM 816 N VAL A 51 18.684 14.952 -7.471 1.00 0.00 N ATOM 817 CA VAL A 51 17.383 14.284 -7.334 1.00 0.00 C ATOM 818 C VAL A 51 16.952 14.207 -5.870 1.00 0.00 C ATOM 819 O VAL A 51 15.967 14.826 -5.467 1.00 0.00 O ATOM 820 CB VAL A 51 17.500 12.853 -7.923 1.00 0.00 C ATOM 821 CG1 VAL A 51 16.314 11.955 -7.492 1.00 0.00 C ATOM 822 CG2 VAL A 51 17.548 12.929 -9.460 1.00 0.00 C ATOM 0 H VAL A 51 19.389 14.427 -7.988 1.00 0.00 H new ATOM 0 HA VAL A 51 16.629 14.859 -7.873 1.00 0.00 H new ATOM 0 HB VAL A 51 18.418 12.409 -7.537 1.00 0.00 H new ATOM 0 HG11 VAL A 51 16.433 10.962 -7.925 1.00 0.00 H new ATOM 0 HG12 VAL A 51 16.293 11.877 -6.405 1.00 0.00 H new ATOM 0 HG13 VAL A 51 15.380 12.394 -7.842 1.00 0.00 H new ATOM 0 HG21 VAL A 51 17.630 11.923 -9.872 1.00 0.00 H new ATOM 0 HG22 VAL A 51 16.637 13.399 -9.830 1.00 0.00 H new ATOM 0 HG23 VAL A 51 18.411 13.519 -9.768 1.00 0.00 H new ATOM 832 N VAL A 52 17.709 13.456 -5.077 1.00 0.00 N ATOM 833 CA VAL A 52 17.374 13.307 -3.660 1.00 0.00 C ATOM 834 C VAL A 52 17.104 14.673 -3.013 1.00 0.00 C ATOM 835 O VAL A 52 16.278 14.795 -2.108 1.00 0.00 O ATOM 836 CB VAL A 52 18.532 12.623 -2.920 1.00 0.00 C ATOM 837 CG1 VAL A 52 18.823 11.253 -3.540 1.00 0.00 C ATOM 838 CG2 VAL A 52 19.791 13.487 -3.030 1.00 0.00 C ATOM 0 H VAL A 52 18.541 12.950 -5.379 1.00 0.00 H new ATOM 0 HA VAL A 52 16.473 12.698 -3.588 1.00 0.00 H new ATOM 0 HB VAL A 52 18.251 12.497 -1.875 1.00 0.00 H new ATOM 0 HG11 VAL A 52 19.646 10.779 -3.005 1.00 0.00 H new ATOM 0 HG12 VAL A 52 17.935 10.625 -3.468 1.00 0.00 H new ATOM 0 HG13 VAL A 52 19.095 11.378 -4.588 1.00 0.00 H new ATOM 0 HG21 VAL A 52 20.613 13.001 -2.504 1.00 0.00 H new ATOM 0 HG22 VAL A 52 20.055 13.613 -4.080 1.00 0.00 H new ATOM 0 HG23 VAL A 52 19.602 14.464 -2.584 1.00 0.00 H new ATOM 848 N LEU A 53 17.797 15.695 -3.503 1.00 0.00 N ATOM 849 CA LEU A 53 17.628 17.041 -2.959 1.00 0.00 C ATOM 850 C LEU A 53 16.180 17.502 -3.150 1.00 0.00 C ATOM 851 O LEU A 53 15.589 18.115 -2.261 1.00 0.00 O ATOM 852 CB LEU A 53 18.619 18.026 -3.660 1.00 0.00 C ATOM 853 CG LEU A 53 19.502 18.803 -2.650 1.00 0.00 C ATOM 854 CD1 LEU A 53 18.632 19.731 -1.780 1.00 0.00 C ATOM 855 CD2 LEU A 53 20.326 17.825 -1.762 1.00 0.00 C ATOM 0 H LEU A 53 18.472 15.622 -4.264 1.00 0.00 H new ATOM 0 HA LEU A 53 17.849 17.030 -1.892 1.00 0.00 H new ATOM 0 HB2 LEU A 53 19.260 17.467 -4.342 1.00 0.00 H new ATOM 0 HB3 LEU A 53 18.054 18.736 -4.264 1.00 0.00 H new ATOM 0 HG LEU A 53 20.206 19.416 -3.213 1.00 0.00 H new ATOM 0 HD11 LEU A 53 19.266 20.270 -1.076 1.00 0.00 H new ATOM 0 HD12 LEU A 53 18.111 20.445 -2.418 1.00 0.00 H new ATOM 0 HD13 LEU A 53 17.903 19.136 -1.230 1.00 0.00 H new ATOM 0 HD21 LEU A 53 20.937 18.396 -1.062 1.00 0.00 H new ATOM 0 HD22 LEU A 53 19.647 17.178 -1.207 1.00 0.00 H new ATOM 0 HD23 LEU A 53 20.972 17.216 -2.394 1.00 0.00 H new ATOM 867 N LYS A 54 15.619 17.202 -4.317 1.00 0.00 N ATOM 868 CA LYS A 54 14.249 17.597 -4.626 1.00 0.00 C ATOM 869 C LYS A 54 13.291 16.988 -3.619 1.00 0.00 C ATOM 870 O LYS A 54 12.360 17.648 -3.155 1.00 0.00 O ATOM 871 CB LYS A 54 13.883 17.109 -6.032 1.00 0.00 C ATOM 872 CG LYS A 54 14.803 17.784 -7.061 1.00 0.00 C ATOM 873 CD LYS A 54 14.651 17.119 -8.444 1.00 0.00 C ATOM 874 CE LYS A 54 13.339 17.543 -9.123 1.00 0.00 C ATOM 875 NZ LYS A 54 13.240 19.031 -9.183 1.00 0.00 N ATOM 0 H LYS A 54 16.090 16.689 -5.062 1.00 0.00 H new ATOM 0 HA LYS A 54 14.173 18.683 -4.580 1.00 0.00 H new ATOM 0 HB2 LYS A 54 13.986 16.025 -6.091 1.00 0.00 H new ATOM 0 HB3 LYS A 54 12.841 17.343 -6.251 1.00 0.00 H new ATOM 0 HG2 LYS A 54 14.561 18.844 -7.133 1.00 0.00 H new ATOM 0 HG3 LYS A 54 15.839 17.715 -6.730 1.00 0.00 H new ATOM 0 HD2 LYS A 54 15.496 17.392 -9.077 1.00 0.00 H new ATOM 0 HD3 LYS A 54 14.673 16.035 -8.334 1.00 0.00 H new ATOM 0 HE2 LYS A 54 13.293 17.128 -10.130 1.00 0.00 H new ATOM 0 HE3 LYS A 54 12.490 17.138 -8.572 1.00 0.00 H new ATOM 0 HZ1 LYS A 54 12.593 19.305 -9.949 1.00 0.00 H new ATOM 0 HZ2 LYS A 54 12.877 19.392 -8.278 1.00 0.00 H new ATOM 0 HZ3 LYS A 54 14.181 19.435 -9.364 1.00 0.00 H new ATOM 889 N ARG A 55 13.521 15.724 -3.279 1.00 0.00 N ATOM 890 CA ARG A 55 12.677 15.033 -2.329 1.00 0.00 C ATOM 891 C ARG A 55 12.801 15.678 -0.954 1.00 0.00 C ATOM 892 O ARG A 55 11.804 15.853 -0.253 1.00 0.00 O ATOM 893 CB ARG A 55 13.092 13.558 -2.253 1.00 0.00 C ATOM 894 CG ARG A 55 12.748 12.856 -3.572 1.00 0.00 C ATOM 895 CD ARG A 55 13.155 11.385 -3.491 1.00 0.00 C ATOM 896 NE ARG A 55 12.857 10.704 -4.750 1.00 0.00 N ATOM 897 CZ ARG A 55 12.807 9.378 -4.823 1.00 0.00 C ATOM 898 NH1 ARG A 55 13.019 8.656 -3.757 1.00 0.00 N ATOM 899 NH2 ARG A 55 12.546 8.797 -5.963 1.00 0.00 N ATOM 0 H ARG A 55 14.287 15.163 -3.651 1.00 0.00 H new ATOM 0 HA ARG A 55 11.639 15.100 -2.656 1.00 0.00 H new ATOM 0 HB2 ARG A 55 14.161 13.481 -2.057 1.00 0.00 H new ATOM 0 HB3 ARG A 55 12.580 13.068 -1.425 1.00 0.00 H new ATOM 0 HG2 ARG A 55 11.679 12.938 -3.771 1.00 0.00 H new ATOM 0 HG3 ARG A 55 13.265 13.342 -4.400 1.00 0.00 H new ATOM 0 HD2 ARG A 55 14.220 11.307 -3.271 1.00 0.00 H new ATOM 0 HD3 ARG A 55 12.624 10.899 -2.673 1.00 0.00 H new ATOM 0 HE ARG A 55 12.684 11.258 -5.589 1.00 0.00 H new ATOM 0 HH11 ARG A 55 13.223 9.109 -2.866 1.00 0.00 H new ATOM 0 HH12 ARG A 55 12.980 7.638 -3.814 1.00 0.00 H new ATOM 0 HH21 ARG A 55 12.381 9.361 -6.797 1.00 0.00 H new ATOM 0 HH22 ARG A 55 12.508 7.779 -6.020 1.00 0.00 H new ATOM 913 N ILE A 56 14.025 16.027 -0.571 1.00 0.00 N ATOM 914 CA ILE A 56 14.263 16.651 0.726 1.00 0.00 C ATOM 915 C ILE A 56 13.650 18.044 0.766 1.00 0.00 C ATOM 916 O ILE A 56 12.900 18.373 1.685 1.00 0.00 O ATOM 917 CB ILE A 56 15.775 16.744 0.979 1.00 0.00 C ATOM 918 CG1 ILE A 56 16.365 15.326 1.036 1.00 0.00 C ATOM 919 CG2 ILE A 56 16.046 17.463 2.313 1.00 0.00 C ATOM 920 CD1 ILE A 56 17.888 15.408 1.015 1.00 0.00 C ATOM 0 H ILE A 56 14.863 15.890 -1.136 1.00 0.00 H new ATOM 0 HA ILE A 56 13.798 16.042 1.501 1.00 0.00 H new ATOM 0 HB ILE A 56 16.239 17.309 0.171 1.00 0.00 H new ATOM 0 HG12 ILE A 56 16.030 14.817 1.940 1.00 0.00 H new ATOM 0 HG13 ILE A 56 16.010 14.739 0.189 1.00 0.00 H new ATOM 0 HG21 ILE A 56 17.121 17.523 2.482 1.00 0.00 H new ATOM 0 HG22 ILE A 56 15.628 18.469 2.276 1.00 0.00 H new ATOM 0 HG23 ILE A 56 15.581 16.907 3.127 1.00 0.00 H new ATOM 0 HD11 ILE A 56 18.307 14.403 1.055 1.00 0.00 H new ATOM 0 HD12 ILE A 56 18.213 15.900 0.098 1.00 0.00 H new ATOM 0 HD13 ILE A 56 18.233 15.980 1.876 1.00 0.00 H new ATOM 932 N GLN A 57 13.971 18.859 -0.234 1.00 0.00 N ATOM 933 CA GLN A 57 13.453 20.215 -0.304 1.00 0.00 C ATOM 934 C GLN A 57 11.940 20.190 -0.288 1.00 0.00 C ATOM 935 O GLN A 57 11.310 21.017 0.371 1.00 0.00 O ATOM 936 CB GLN A 57 13.946 20.903 -1.586 1.00 0.00 C ATOM 937 CG GLN A 57 15.458 21.148 -1.495 1.00 0.00 C ATOM 938 CD GLN A 57 15.755 22.271 -0.503 1.00 0.00 C ATOM 939 OE1 GLN A 57 15.867 22.032 0.700 1.00 0.00 O ATOM 940 NE2 GLN A 57 15.889 23.491 -0.944 1.00 0.00 N ATOM 0 H GLN A 57 14.587 18.601 -1.005 1.00 0.00 H new ATOM 0 HA GLN A 57 13.812 20.774 0.560 1.00 0.00 H new ATOM 0 HB2 GLN A 57 13.720 20.282 -2.453 1.00 0.00 H new ATOM 0 HB3 GLN A 57 13.423 21.849 -1.727 1.00 0.00 H new ATOM 0 HG2 GLN A 57 15.963 20.234 -1.182 1.00 0.00 H new ATOM 0 HG3 GLN A 57 15.851 21.409 -2.478 1.00 0.00 H new ATOM 0 HE21 GLN A 57 15.796 23.686 -1.941 1.00 0.00 H new ATOM 0 HE22 GLN A 57 16.087 24.250 -0.292 1.00 0.00 H new ATOM 949 N HIS A 58 11.353 19.244 -1.014 1.00 0.00 N ATOM 950 CA HIS A 58 9.902 19.130 -1.068 1.00 0.00 C ATOM 951 C HIS A 58 9.359 18.618 0.265 1.00 0.00 C ATOM 952 O HIS A 58 8.337 19.100 0.754 1.00 0.00 O ATOM 953 CB HIS A 58 9.489 18.181 -2.205 1.00 0.00 C ATOM 954 CG HIS A 58 9.808 18.812 -3.537 1.00 0.00 C ATOM 955 ND1 HIS A 58 9.714 20.180 -3.742 1.00 0.00 N ATOM 956 CD2 HIS A 58 10.213 18.280 -4.737 1.00 0.00 C ATOM 957 CE1 HIS A 58 10.054 20.423 -5.021 1.00 0.00 C ATOM 958 NE2 HIS A 58 10.368 19.299 -5.672 1.00 0.00 N ATOM 0 H HIS A 58 11.856 18.551 -1.568 1.00 0.00 H new ATOM 0 HA HIS A 58 9.482 20.117 -1.260 1.00 0.00 H new ATOM 0 HB2 HIS A 58 10.014 17.231 -2.107 1.00 0.00 H new ATOM 0 HB3 HIS A 58 8.423 17.964 -2.141 1.00 0.00 H new ATOM 0 HD2 HIS A 58 10.385 17.231 -4.926 1.00 0.00 H new ATOM 0 HE1 HIS A 58 10.071 21.406 -5.467 1.00 0.00 H new ATOM 0 HE2 HIS A 58 10.659 19.208 -6.645 1.00 0.00 H new ATOM 967 N LEU A 59 10.044 17.636 0.841 1.00 0.00 N ATOM 968 CA LEU A 59 9.597 17.076 2.114 1.00 0.00 C ATOM 969 C LEU A 59 9.408 18.185 3.154 1.00 0.00 C ATOM 970 O LEU A 59 8.675 18.007 4.127 1.00 0.00 O ATOM 971 CB LEU A 59 10.616 16.052 2.625 1.00 0.00 C ATOM 972 CG LEU A 59 10.107 15.328 3.888 1.00 0.00 C ATOM 973 CD1 LEU A 59 8.808 14.531 3.602 1.00 0.00 C ATOM 974 CD2 LEU A 59 11.211 14.378 4.352 1.00 0.00 C ATOM 0 H LEU A 59 10.892 17.218 0.459 1.00 0.00 H new ATOM 0 HA LEU A 59 8.639 16.580 1.955 1.00 0.00 H new ATOM 0 HB2 LEU A 59 10.821 15.321 1.843 1.00 0.00 H new ATOM 0 HB3 LEU A 59 11.558 16.554 2.847 1.00 0.00 H new ATOM 0 HG LEU A 59 9.871 16.062 4.659 1.00 0.00 H new ATOM 0 HD11 LEU A 59 8.478 14.034 4.514 1.00 0.00 H new ATOM 0 HD12 LEU A 59 8.030 15.214 3.259 1.00 0.00 H new ATOM 0 HD13 LEU A 59 9.001 13.785 2.831 1.00 0.00 H new ATOM 0 HD21 LEU A 59 10.883 13.848 5.246 1.00 0.00 H new ATOM 0 HD22 LEU A 59 11.427 13.658 3.563 1.00 0.00 H new ATOM 0 HD23 LEU A 59 12.111 14.949 4.578 1.00 0.00 H new ATOM 986 N ASP A 60 10.076 19.315 2.948 1.00 0.00 N ATOM 987 CA ASP A 60 9.969 20.431 3.882 1.00 0.00 C ATOM 988 C ASP A 60 8.502 20.861 4.026 1.00 0.00 C ATOM 989 O ASP A 60 8.099 21.354 5.079 1.00 0.00 O ATOM 990 CB ASP A 60 10.823 21.634 3.398 1.00 0.00 C ATOM 991 CG ASP A 60 10.101 22.411 2.291 1.00 0.00 C ATOM 992 OD1 ASP A 60 9.396 21.779 1.522 1.00 0.00 O ATOM 993 OD2 ASP A 60 10.243 23.622 2.248 1.00 0.00 O ATOM 0 H ASP A 60 10.691 19.482 2.152 1.00 0.00 H new ATOM 0 HA ASP A 60 10.344 20.103 4.852 1.00 0.00 H new ATOM 0 HB2 ASP A 60 11.031 22.298 4.237 1.00 0.00 H new ATOM 0 HB3 ASP A 60 11.784 21.277 3.029 1.00 0.00 H new ATOM 998 N GLU A 61 7.724 20.687 2.963 1.00 0.00 N ATOM 999 CA GLU A 61 6.318 21.070 2.981 1.00 0.00 C ATOM 1000 C GLU A 61 5.573 20.291 4.057 1.00 0.00 C ATOM 1001 O GLU A 61 4.628 20.798 4.662 1.00 0.00 O ATOM 1002 CB GLU A 61 5.689 20.812 1.592 1.00 0.00 C ATOM 1003 CG GLU A 61 5.402 19.307 1.382 1.00 0.00 C ATOM 1004 CD GLU A 61 5.207 19.003 -0.101 1.00 0.00 C ATOM 1005 OE1 GLU A 61 6.201 18.749 -0.761 1.00 0.00 O ATOM 1006 OE2 GLU A 61 4.073 19.010 -0.551 1.00 0.00 O ATOM 0 H GLU A 61 8.042 20.285 2.081 1.00 0.00 H new ATOM 0 HA GLU A 61 6.240 22.133 3.211 1.00 0.00 H new ATOM 0 HB2 GLU A 61 4.763 21.379 1.498 1.00 0.00 H new ATOM 0 HB3 GLU A 61 6.362 21.169 0.813 1.00 0.00 H new ATOM 0 HG2 GLU A 61 6.228 18.715 1.775 1.00 0.00 H new ATOM 0 HG3 GLU A 61 4.510 19.019 1.939 1.00 0.00 H new ATOM 1013 N ALA A 62 5.992 19.049 4.280 1.00 0.00 N ATOM 1014 CA ALA A 62 5.364 18.204 5.282 1.00 0.00 C ATOM 1015 C ALA A 62 5.741 18.658 6.691 1.00 0.00 C ATOM 1016 O ALA A 62 4.863 18.968 7.496 1.00 0.00 O ATOM 1017 CB ALA A 62 5.793 16.754 5.066 1.00 0.00 C ATOM 0 H ALA A 62 6.764 18.608 3.779 1.00 0.00 H new ATOM 0 HA ALA A 62 4.282 18.284 5.179 1.00 0.00 H new ATOM 0 HB1 ALA A 62 5.322 16.120 5.817 1.00 0.00 H new ATOM 0 HB2 ALA A 62 5.486 16.428 4.072 1.00 0.00 H new ATOM 0 HB3 ALA A 62 6.877 16.678 5.154 1.00 0.00 H new ATOM 1023 N TYR A 63 7.037 18.697 6.982 1.00 0.00 N ATOM 1024 CA TYR A 63 7.523 19.118 8.302 1.00 0.00 C ATOM 1025 C TYR A 63 6.846 20.435 8.704 1.00 0.00 C ATOM 1026 O TYR A 63 6.508 20.643 9.869 1.00 0.00 O ATOM 1027 CB TYR A 63 9.088 19.281 8.265 1.00 0.00 C ATOM 1028 CG TYR A 63 9.522 20.599 8.907 1.00 0.00 C ATOM 1029 CD1 TYR A 63 9.454 21.773 8.148 1.00 0.00 C ATOM 1030 CD2 TYR A 63 9.937 20.652 10.243 1.00 0.00 C ATOM 1031 CE1 TYR A 63 9.801 23.001 8.725 1.00 0.00 C ATOM 1032 CE2 TYR A 63 10.283 21.880 10.820 1.00 0.00 C ATOM 1033 CZ TYR A 63 10.215 23.054 10.061 1.00 0.00 C ATOM 1034 OH TYR A 63 10.553 24.263 10.630 1.00 0.00 O ATOM 0 H TYR A 63 7.774 18.443 6.325 1.00 0.00 H new ATOM 0 HA TYR A 63 7.273 18.360 9.044 1.00 0.00 H new ATOM 0 HB2 TYR A 63 9.556 18.447 8.789 1.00 0.00 H new ATOM 0 HB3 TYR A 63 9.436 19.244 7.233 1.00 0.00 H new ATOM 0 HD1 TYR A 63 9.134 21.732 7.117 1.00 0.00 H new ATOM 0 HD2 TYR A 63 9.990 19.746 10.828 1.00 0.00 H new ATOM 0 HE1 TYR A 63 9.749 23.907 8.139 1.00 0.00 H new ATOM 0 HE2 TYR A 63 10.602 21.921 11.851 1.00 0.00 H new ATOM 0 HH TYR A 63 10.817 24.123 11.563 1.00 0.00 H new ATOM 1044 N ASN A 64 6.676 21.325 7.731 1.00 0.00 N ATOM 1045 CA ASN A 64 6.057 22.619 7.989 1.00 0.00 C ATOM 1046 C ASN A 64 4.567 22.464 8.266 1.00 0.00 C ATOM 1047 O ASN A 64 4.009 23.136 9.134 1.00 0.00 O ATOM 1048 CB ASN A 64 6.258 23.537 6.785 1.00 0.00 C ATOM 1049 CG ASN A 64 5.684 24.917 7.084 1.00 0.00 C ATOM 1050 OD1 ASN A 64 5.767 25.389 8.218 1.00 0.00 O ATOM 1051 ND2 ASN A 64 5.102 25.595 6.133 1.00 0.00 N ATOM 0 H ASN A 64 6.957 21.174 6.762 1.00 0.00 H new ATOM 0 HA ASN A 64 6.530 23.055 8.869 1.00 0.00 H new ATOM 0 HB2 ASN A 64 7.320 23.618 6.551 1.00 0.00 H new ATOM 0 HB3 ASN A 64 5.770 23.113 5.908 1.00 0.00 H new ATOM 0 HD21 ASN A 64 4.715 26.518 6.328 1.00 0.00 H new ATOM 0 HD22 ASN A 64 5.034 25.202 5.194 1.00 0.00 H new ATOM 1058 N LYS A 65 3.924 21.577 7.513 1.00 0.00 N ATOM 1059 CA LYS A 65 2.489 21.368 7.673 1.00 0.00 C ATOM 1060 C LYS A 65 2.177 20.889 9.098 1.00 0.00 C ATOM 1061 O LYS A 65 1.265 21.402 9.747 1.00 0.00 O ATOM 1062 CB LYS A 65 2.003 20.332 6.630 1.00 0.00 C ATOM 1063 CG LYS A 65 0.525 20.554 6.251 1.00 0.00 C ATOM 1064 CD LYS A 65 -0.372 20.564 7.501 1.00 0.00 C ATOM 1065 CE LYS A 65 -1.835 20.383 7.084 1.00 0.00 C ATOM 1066 NZ LYS A 65 -2.021 19.009 6.537 1.00 0.00 N ATOM 0 H LYS A 65 4.365 21.000 6.797 1.00 0.00 H new ATOM 0 HA LYS A 65 1.965 22.310 7.510 1.00 0.00 H new ATOM 0 HB2 LYS A 65 2.622 20.399 5.735 1.00 0.00 H new ATOM 0 HB3 LYS A 65 2.129 19.326 7.030 1.00 0.00 H new ATOM 0 HG2 LYS A 65 0.421 21.499 5.718 1.00 0.00 H new ATOM 0 HG3 LYS A 65 0.198 19.767 5.572 1.00 0.00 H new ATOM 0 HD2 LYS A 65 -0.075 19.765 8.180 1.00 0.00 H new ATOM 0 HD3 LYS A 65 -0.251 21.503 8.041 1.00 0.00 H new ATOM 0 HE2 LYS A 65 -2.492 20.539 7.940 1.00 0.00 H new ATOM 0 HE3 LYS A 65 -2.107 21.126 6.334 1.00 0.00 H new ATOM 0 HZ1 LYS A 65 -2.998 18.697 6.707 1.00 0.00 H new ATOM 0 HZ2 LYS A 65 -1.832 19.014 5.514 1.00 0.00 H new ATOM 0 HZ3 LYS A 65 -1.362 18.356 7.007 1.00 0.00 H new ATOM 1080 N VAL A 66 2.942 19.911 9.572 1.00 0.00 N ATOM 1081 CA VAL A 66 2.706 19.379 10.907 1.00 0.00 C ATOM 1082 C VAL A 66 2.730 20.502 11.936 1.00 0.00 C ATOM 1083 O VAL A 66 1.783 20.683 12.701 1.00 0.00 O ATOM 1084 CB VAL A 66 3.790 18.336 11.252 1.00 0.00 C ATOM 1085 CG1 VAL A 66 3.582 17.815 12.686 1.00 0.00 C ATOM 1086 CG2 VAL A 66 3.714 17.168 10.255 1.00 0.00 C ATOM 0 H VAL A 66 3.714 19.479 9.064 1.00 0.00 H new ATOM 0 HA VAL A 66 1.725 18.904 10.927 1.00 0.00 H new ATOM 0 HB VAL A 66 4.772 18.804 11.186 1.00 0.00 H new ATOM 0 HG11 VAL A 66 4.351 17.079 12.921 1.00 0.00 H new ATOM 0 HG12 VAL A 66 3.648 18.646 13.388 1.00 0.00 H new ATOM 0 HG13 VAL A 66 2.599 17.350 12.765 1.00 0.00 H new ATOM 0 HG21 VAL A 66 4.480 16.431 10.499 1.00 0.00 H new ATOM 0 HG22 VAL A 66 2.730 16.702 10.314 1.00 0.00 H new ATOM 0 HG23 VAL A 66 3.878 17.541 9.244 1.00 0.00 H new ATOM 1096 N LYS A 67 3.826 21.254 11.949 1.00 0.00 N ATOM 1097 CA LYS A 67 3.962 22.351 12.894 1.00 0.00 C ATOM 1098 C LYS A 67 2.864 23.384 12.698 1.00 0.00 C ATOM 1099 O LYS A 67 2.235 23.827 13.659 1.00 0.00 O ATOM 1100 CB LYS A 67 5.318 23.018 12.698 1.00 0.00 C ATOM 1101 CG LYS A 67 6.458 21.970 12.891 1.00 0.00 C ATOM 1102 CD LYS A 67 7.579 22.513 13.791 1.00 0.00 C ATOM 1103 CE LYS A 67 8.281 23.721 13.141 1.00 0.00 C ATOM 1104 NZ LYS A 67 9.522 24.046 13.912 1.00 0.00 N ATOM 0 H LYS A 67 4.622 21.125 11.324 1.00 0.00 H new ATOM 0 HA LYS A 67 3.880 21.947 13.903 1.00 0.00 H new ATOM 0 HB2 LYS A 67 5.378 23.454 11.701 1.00 0.00 H new ATOM 0 HB3 LYS A 67 5.438 23.834 13.410 1.00 0.00 H new ATOM 0 HG2 LYS A 67 6.047 21.061 13.330 1.00 0.00 H new ATOM 0 HG3 LYS A 67 6.870 21.697 11.920 1.00 0.00 H new ATOM 0 HD2 LYS A 67 7.165 22.806 14.756 1.00 0.00 H new ATOM 0 HD3 LYS A 67 8.308 21.726 13.983 1.00 0.00 H new ATOM 0 HE2 LYS A 67 8.532 23.496 12.104 1.00 0.00 H new ATOM 0 HE3 LYS A 67 7.612 24.581 13.128 1.00 0.00 H new ATOM 0 HZ1 LYS A 67 9.998 24.861 13.476 1.00 0.00 H new ATOM 0 HZ2 LYS A 67 9.270 24.277 14.894 1.00 0.00 H new ATOM 0 HZ3 LYS A 67 10.161 23.226 13.903 1.00 0.00 H new ATOM 1118 N ARG A 68 2.625 23.754 11.444 1.00 0.00 N ATOM 1119 CA ARG A 68 1.603 24.725 11.129 1.00 0.00 C ATOM 1120 C ARG A 68 0.256 24.237 11.641 1.00 0.00 C ATOM 1121 O ARG A 68 -0.702 25.008 11.710 1.00 0.00 O ATOM 1122 CB ARG A 68 1.556 24.949 9.601 1.00 0.00 C ATOM 1123 CG ARG A 68 0.855 26.287 9.258 1.00 0.00 C ATOM 1124 CD ARG A 68 1.872 27.443 9.238 1.00 0.00 C ATOM 1125 NE ARG A 68 1.179 28.725 9.107 1.00 0.00 N ATOM 1126 CZ ARG A 68 0.622 29.325 10.153 1.00 0.00 C ATOM 1127 NH1 ARG A 68 0.676 28.766 11.331 1.00 0.00 N ATOM 1128 NH2 ARG A 68 0.021 30.474 10.003 1.00 0.00 N ATOM 0 H ARG A 68 3.129 23.392 10.635 1.00 0.00 H new ATOM 0 HA ARG A 68 1.836 25.673 11.614 1.00 0.00 H new ATOM 0 HB2 ARG A 68 2.569 24.951 9.199 1.00 0.00 H new ATOM 0 HB3 ARG A 68 1.026 24.124 9.125 1.00 0.00 H new ATOM 0 HG2 ARG A 68 0.366 26.209 8.287 1.00 0.00 H new ATOM 0 HG3 ARG A 68 0.076 26.494 9.992 1.00 0.00 H new ATOM 0 HD2 ARG A 68 2.463 27.433 10.154 1.00 0.00 H new ATOM 0 HD3 ARG A 68 2.567 27.311 8.409 1.00 0.00 H new ATOM 0 HE ARG A 68 1.122 29.169 8.190 1.00 0.00 H new ATOM 0 HH11 ARG A 68 1.146 27.868 11.448 1.00 0.00 H new ATOM 0 HH12 ARG A 68 0.248 29.227 12.134 1.00 0.00 H new ATOM 0 HH21 ARG A 68 -0.021 30.911 9.082 1.00 0.00 H new ATOM 0 HH22 ARG A 68 -0.407 30.935 10.806 1.00 0.00 H new ATOM 1142 N GLY A 69 0.183 22.958 11.995 1.00 0.00 N ATOM 1143 CA GLY A 69 -1.045 22.351 12.503 1.00 0.00 C ATOM 1144 C GLY A 69 -1.006 22.240 14.023 1.00 0.00 C ATOM 1145 O GLY A 69 -2.052 22.191 14.671 1.00 0.00 O ATOM 0 H GLY A 69 0.971 22.313 11.938 1.00 0.00 H new ATOM 0 HA2 GLY A 69 -1.904 22.949 12.200 1.00 0.00 H new ATOM 0 HA3 GLY A 69 -1.175 21.361 12.065 1.00 0.00 H new ATOM 1149 N GLU A 70 0.197 22.193 14.585 1.00 0.00 N ATOM 1150 CA GLU A 70 0.355 22.090 16.032 1.00 0.00 C ATOM 1151 C GLU A 70 -0.409 23.213 16.729 1.00 0.00 C ATOM 1152 O GLU A 70 -1.634 23.159 16.842 1.00 0.00 O ATOM 1153 CB GLU A 70 1.850 22.158 16.402 1.00 0.00 C ATOM 1154 CG GLU A 70 2.554 20.851 16.012 1.00 0.00 C ATOM 1155 CD GLU A 70 2.147 19.739 16.971 1.00 0.00 C ATOM 1156 OE1 GLU A 70 2.405 19.899 18.153 1.00 0.00 O ATOM 1157 OE2 GLU A 70 1.596 18.748 16.522 1.00 0.00 O ATOM 0 H GLU A 70 1.073 22.224 14.064 1.00 0.00 H new ATOM 0 HA GLU A 70 -0.051 21.134 16.364 1.00 0.00 H new ATOM 0 HB2 GLU A 70 2.320 22.999 15.892 1.00 0.00 H new ATOM 0 HB3 GLU A 70 1.959 22.333 17.472 1.00 0.00 H new ATOM 0 HG2 GLU A 70 2.291 20.577 14.990 1.00 0.00 H new ATOM 0 HG3 GLU A 70 3.635 20.988 16.037 1.00 0.00 H new ATOM 1164 N SER A 71 0.317 24.219 17.205 1.00 0.00 N ATOM 1165 CA SER A 71 -0.305 25.339 17.891 1.00 0.00 C ATOM 1166 C SER A 71 0.686 26.496 18.046 1.00 0.00 C ATOM 1167 O SER A 71 1.310 26.931 17.078 1.00 0.00 O ATOM 1168 CB SER A 71 -0.810 24.871 19.255 1.00 0.00 C ATOM 1169 OG SER A 71 0.300 24.559 20.087 1.00 0.00 O ATOM 0 H SER A 71 1.332 24.279 17.128 1.00 0.00 H new ATOM 0 HA SER A 71 -1.147 25.702 17.301 1.00 0.00 H new ATOM 0 HB2 SER A 71 -1.418 25.649 19.717 1.00 0.00 H new ATOM 0 HB3 SER A 71 -1.449 23.995 19.138 1.00 0.00 H new ATOM 0 HG SER A 71 0.152 24.930 20.982 1.00 0.00 H new ATOM 1175 N LYS A 72 0.824 26.984 19.275 1.00 0.00 N ATOM 1176 CA LYS A 72 1.730 28.097 19.550 1.00 0.00 C ATOM 1177 C LYS A 72 2.081 28.142 21.040 1.00 0.00 C ATOM 1178 O LYS A 72 1.470 28.882 21.811 1.00 0.00 O ATOM 1179 CB LYS A 72 1.065 29.420 19.105 1.00 0.00 C ATOM 1180 CG LYS A 72 -0.411 29.433 19.530 1.00 0.00 C ATOM 1181 CD LYS A 72 -1.034 30.786 19.185 1.00 0.00 C ATOM 1182 CE LYS A 72 -2.465 30.839 19.723 1.00 0.00 C ATOM 1183 NZ LYS A 72 -3.300 29.830 19.013 1.00 0.00 N ATOM 0 H LYS A 72 0.325 26.631 20.091 1.00 0.00 H new ATOM 0 HA LYS A 72 2.655 27.958 18.990 1.00 0.00 H new ATOM 0 HB2 LYS A 72 1.588 30.267 19.549 1.00 0.00 H new ATOM 0 HB3 LYS A 72 1.142 29.530 18.023 1.00 0.00 H new ATOM 0 HG2 LYS A 72 -0.952 28.633 19.025 1.00 0.00 H new ATOM 0 HG3 LYS A 72 -0.493 29.246 20.601 1.00 0.00 H new ATOM 0 HD2 LYS A 72 -0.441 31.592 19.617 1.00 0.00 H new ATOM 0 HD3 LYS A 72 -1.034 30.934 18.105 1.00 0.00 H new ATOM 0 HE2 LYS A 72 -2.469 30.641 20.795 1.00 0.00 H new ATOM 0 HE3 LYS A 72 -2.882 31.836 19.581 1.00 0.00 H new ATOM 0 HZ1 LYS A 72 -4.306 30.019 19.198 1.00 0.00 H new ATOM 0 HZ2 LYS A 72 -3.119 29.888 17.990 1.00 0.00 H new ATOM 0 HZ3 LYS A 72 -3.059 28.878 19.354 1.00 0.00 H new ATOM 1197 N LEU A 73 3.069 27.345 21.431 1.00 0.00 N ATOM 1198 CA LEU A 73 3.495 27.294 22.822 1.00 0.00 C ATOM 1199 C LEU A 73 4.756 26.441 22.958 1.00 0.00 C ATOM 1200 O LEU A 73 4.807 25.535 23.790 1.00 0.00 O ATOM 1201 CB LEU A 73 2.373 26.691 23.703 1.00 0.00 C ATOM 1202 CG LEU A 73 2.633 27.005 25.206 1.00 0.00 C ATOM 1203 CD1 LEU A 73 2.044 28.374 25.583 1.00 0.00 C ATOM 1204 CD2 LEU A 73 1.985 25.930 26.094 1.00 0.00 C ATOM 0 H LEU A 73 3.588 26.728 20.806 1.00 0.00 H new ATOM 0 HA LEU A 73 3.709 28.310 23.154 1.00 0.00 H new ATOM 0 HB2 LEU A 73 1.408 27.098 23.402 1.00 0.00 H new ATOM 0 HB3 LEU A 73 2.325 25.612 23.554 1.00 0.00 H new ATOM 0 HG LEU A 73 3.711 27.016 25.364 1.00 0.00 H new ATOM 0 HD11 LEU A 73 2.236 28.575 26.637 1.00 0.00 H new ATOM 0 HD12 LEU A 73 2.509 29.150 24.975 1.00 0.00 H new ATOM 0 HD13 LEU A 73 0.969 28.369 25.405 1.00 0.00 H new ATOM 0 HD21 LEU A 73 2.174 26.161 27.142 1.00 0.00 H new ATOM 0 HD22 LEU A 73 0.910 25.910 25.915 1.00 0.00 H new ATOM 0 HD23 LEU A 73 2.411 24.955 25.855 1.00 0.00 H new ATOM 1216 N GLU A 74 5.767 26.736 22.147 1.00 0.00 N ATOM 1217 CA GLU A 74 7.021 25.978 22.187 1.00 0.00 C ATOM 1218 C GLU A 74 7.988 26.612 23.180 1.00 0.00 C ATOM 1219 O GLU A 74 9.054 27.098 22.803 1.00 0.00 O ATOM 1220 CB GLU A 74 7.651 25.948 20.788 1.00 0.00 C ATOM 1221 CG GLU A 74 6.589 25.536 19.760 1.00 0.00 C ATOM 1222 CD GLU A 74 7.238 25.331 18.394 1.00 0.00 C ATOM 1223 OE1 GLU A 74 8.025 26.177 18.002 1.00 0.00 O ATOM 1224 OE2 GLU A 74 6.952 24.324 17.769 1.00 0.00 O ATOM 0 H GLU A 74 5.747 27.488 21.458 1.00 0.00 H new ATOM 0 HA GLU A 74 6.809 24.958 22.508 1.00 0.00 H new ATOM 0 HB2 GLU A 74 8.054 26.929 20.538 1.00 0.00 H new ATOM 0 HB3 GLU A 74 8.485 25.246 20.767 1.00 0.00 H new ATOM 0 HG2 GLU A 74 6.098 24.617 20.080 1.00 0.00 H new ATOM 0 HG3 GLU A 74 5.818 26.303 19.694 1.00 0.00 H new ATOM 1231 N HIS A 75 7.605 26.607 24.453 1.00 0.00 N ATOM 1232 CA HIS A 75 8.431 27.184 25.509 1.00 0.00 C ATOM 1233 C HIS A 75 8.694 28.658 25.233 1.00 0.00 C ATOM 1234 O HIS A 75 9.773 29.031 24.773 1.00 0.00 O ATOM 1235 CB HIS A 75 9.761 26.432 25.625 1.00 0.00 C ATOM 1236 CG HIS A 75 9.491 24.966 25.834 1.00 0.00 C ATOM 1237 ND1 HIS A 75 9.068 24.463 27.054 1.00 0.00 N ATOM 1238 CD2 HIS A 75 9.589 23.883 24.996 1.00 0.00 C ATOM 1239 CE1 HIS A 75 8.928 23.132 26.917 1.00 0.00 C ATOM 1240 NE2 HIS A 75 9.233 22.726 25.682 1.00 0.00 N ATOM 0 H HIS A 75 6.725 26.208 24.779 1.00 0.00 H new ATOM 0 HA HIS A 75 7.891 27.091 26.451 1.00 0.00 H new ATOM 0 HB2 HIS A 75 10.354 26.579 24.722 1.00 0.00 H new ATOM 0 HB3 HIS A 75 10.344 26.828 26.457 1.00 0.00 H new ATOM 0 HD2 HIS A 75 9.896 23.923 23.961 1.00 0.00 H new ATOM 0 HE1 HIS A 75 8.608 22.472 27.710 1.00 0.00 H new ATOM 0 HE2 HIS A 75 9.210 21.773 25.320 1.00 0.00 H new ATOM 1249 N HIS A 76 7.699 29.494 25.511 1.00 0.00 N ATOM 1250 CA HIS A 76 7.825 30.931 25.290 1.00 0.00 C ATOM 1251 C HIS A 76 8.236 31.211 23.849 1.00 0.00 C ATOM 1252 O HIS A 76 9.424 31.316 23.543 1.00 0.00 O ATOM 1253 CB HIS A 76 8.863 31.519 26.248 1.00 0.00 C ATOM 1254 CG HIS A 76 8.460 31.225 27.668 1.00 0.00 C ATOM 1255 ND1 HIS A 76 8.686 29.992 28.259 1.00 0.00 N ATOM 1256 CD2 HIS A 76 7.849 31.994 28.628 1.00 0.00 C ATOM 1257 CE1 HIS A 76 8.219 30.054 29.519 1.00 0.00 C ATOM 1258 NE2 HIS A 76 7.698 31.252 29.796 1.00 0.00 N ATOM 0 H HIS A 76 6.798 29.202 25.889 1.00 0.00 H new ATOM 0 HA HIS A 76 6.858 31.398 25.478 1.00 0.00 H new ATOM 0 HB2 HIS A 76 9.845 31.094 26.042 1.00 0.00 H new ATOM 0 HB3 HIS A 76 8.944 32.595 26.097 1.00 0.00 H new ATOM 0 HD2 HIS A 76 7.534 33.019 28.497 1.00 0.00 H new ATOM 0 HE1 HIS A 76 8.260 29.235 30.221 1.00 0.00 H new ATOM 0 HE2 HIS A 76 7.279 31.558 30.675 1.00 0.00 H new ATOM 1267 N HIS A 77 7.249 31.330 22.967 1.00 0.00 N ATOM 1268 CA HIS A 77 7.521 31.594 21.555 1.00 0.00 C ATOM 1269 C HIS A 77 7.916 33.054 21.355 1.00 0.00 C ATOM 1270 O HIS A 77 7.080 33.954 21.441 1.00 0.00 O ATOM 1271 CB HIS A 77 6.279 31.270 20.712 1.00 0.00 C ATOM 1272 CG HIS A 77 6.630 31.317 19.248 1.00 0.00 C ATOM 1273 ND1 HIS A 77 5.859 31.997 18.319 1.00 0.00 N ATOM 1274 CD2 HIS A 77 7.676 30.774 18.543 1.00 0.00 C ATOM 1275 CE1 HIS A 77 6.446 31.848 17.117 1.00 0.00 C ATOM 1276 NE2 HIS A 77 7.557 31.110 17.197 1.00 0.00 N ATOM 0 H HIS A 77 6.259 31.249 23.201 1.00 0.00 H new ATOM 0 HA HIS A 77 8.347 30.959 21.234 1.00 0.00 H new ATOM 0 HB2 HIS A 77 5.899 30.282 20.973 1.00 0.00 H new ATOM 0 HB3 HIS A 77 5.485 31.985 20.928 1.00 0.00 H new ATOM 0 HD2 HIS A 77 8.470 30.177 18.968 1.00 0.00 H new ATOM 0 HE1 HIS A 77 6.066 32.273 16.200 1.00 0.00 H new ATOM 0 HE2 HIS A 77 8.183 30.849 16.436 1.00 0.00 H new ATOM 1285 N HIS A 78 9.197 33.280 21.085 1.00 0.00 N ATOM 1286 CA HIS A 78 9.697 34.635 20.873 1.00 0.00 C ATOM 1287 C HIS A 78 8.891 35.340 19.785 1.00 0.00 C ATOM 1288 O HIS A 78 8.039 36.180 20.075 1.00 0.00 O ATOM 1289 CB HIS A 78 11.175 34.590 20.474 1.00 0.00 C ATOM 1290 CG HIS A 78 11.702 35.991 20.324 1.00 0.00 C ATOM 1291 ND1 HIS A 78 12.400 36.403 19.199 1.00 0.00 N ATOM 1292 CD2 HIS A 78 11.634 37.090 21.145 1.00 0.00 C ATOM 1293 CE1 HIS A 78 12.721 37.698 19.373 1.00 0.00 C ATOM 1294 NE2 HIS A 78 12.278 38.166 20.542 1.00 0.00 N ATOM 0 H HIS A 78 9.904 32.549 21.008 1.00 0.00 H new ATOM 0 HA HIS A 78 9.591 35.192 21.804 1.00 0.00 H new ATOM 0 HB2 HIS A 78 11.749 34.054 21.229 1.00 0.00 H new ATOM 0 HB3 HIS A 78 11.293 34.045 19.538 1.00 0.00 H new ATOM 0 HD2 HIS A 78 11.154 37.115 22.112 1.00 0.00 H new ATOM 0 HE1 HIS A 78 13.271 38.287 18.654 1.00 0.00 H new ATOM 0 HE2 HIS A 78 12.388 39.110 20.913 1.00 0.00 H new ATOM 1303 N HIS A 79 9.166 34.990 18.533 1.00 0.00 N ATOM 1304 CA HIS A 79 8.463 35.595 17.409 1.00 0.00 C ATOM 1305 C HIS A 79 6.968 35.303 17.496 1.00 0.00 C ATOM 1306 O HIS A 79 6.547 34.369 18.178 1.00 0.00 O ATOM 1307 CB HIS A 79 9.014 35.044 16.092 1.00 0.00 C ATOM 1308 CG HIS A 79 10.462 35.425 15.953 1.00 0.00 C ATOM 1309 ND1 HIS A 79 11.490 34.557 16.285 1.00 0.00 N ATOM 1310 CD2 HIS A 79 11.070 36.579 15.524 1.00 0.00 C ATOM 1311 CE1 HIS A 79 12.652 35.195 16.052 1.00 0.00 C ATOM 1312 NE2 HIS A 79 12.453 36.431 15.587 1.00 0.00 N ATOM 0 H HIS A 79 9.866 34.295 18.273 1.00 0.00 H new ATOM 0 HA HIS A 79 8.616 36.674 17.445 1.00 0.00 H new ATOM 0 HB2 HIS A 79 8.909 33.959 16.067 1.00 0.00 H new ATOM 0 HB3 HIS A 79 8.441 35.439 15.253 1.00 0.00 H new ATOM 0 HD2 HIS A 79 10.554 37.466 15.189 1.00 0.00 H new ATOM 0 HE1 HIS A 79 13.626 34.760 16.220 1.00 0.00 H new ATOM 0 HE2 HIS A 79 13.162 37.119 15.333 1.00 0.00 H new ATOM 1321 N HIS A 80 6.172 36.109 16.801 1.00 0.00 N ATOM 1322 CA HIS A 80 4.725 35.928 16.810 1.00 0.00 C ATOM 1323 C HIS A 80 4.349 34.604 16.152 1.00 0.00 C ATOM 1324 O HIS A 80 3.196 34.218 16.259 1.00 0.00 O ATOM 1325 CB HIS A 80 4.049 37.080 16.064 1.00 0.00 C ATOM 1326 CG HIS A 80 4.331 38.374 16.777 1.00 0.00 C ATOM 1327 ND1 HIS A 80 5.370 39.212 16.403 1.00 0.00 N ATOM 1328 CD2 HIS A 80 3.721 38.986 17.844 1.00 0.00 C ATOM 1329 CE1 HIS A 80 5.354 40.272 17.232 1.00 0.00 C ATOM 1330 NE2 HIS A 80 4.369 40.185 18.130 1.00 0.00 N ATOM 0 H HIS A 80 6.501 36.887 16.229 1.00 0.00 H new ATOM 0 HA HIS A 80 4.385 35.918 17.846 1.00 0.00 H new ATOM 0 HB2 HIS A 80 4.417 37.129 15.039 1.00 0.00 H new ATOM 0 HB3 HIS A 80 2.974 36.910 16.008 1.00 0.00 H new ATOM 0 HD2 HIS A 80 2.868 38.597 18.380 1.00 0.00 H new ATOM 0 HE1 HIS A 80 6.053 41.094 17.178 1.00 0.00 H new ATOM 0 HE2 HIS A 80 4.141 40.853 18.866 1.00 0.00 H new TER 1339 HIS A 80 ATOM 1340 N MET B 1 41.543 33.544 12.127 1.00 0.00 N ATOM 1341 CA MET B 1 40.496 32.548 11.761 1.00 0.00 C ATOM 1342 C MET B 1 40.709 32.100 10.320 1.00 0.00 C ATOM 1343 O MET B 1 40.490 32.866 9.382 1.00 0.00 O ATOM 1344 CB MET B 1 39.112 33.190 11.908 1.00 0.00 C ATOM 1345 CG MET B 1 38.858 33.561 13.376 1.00 0.00 C ATOM 1346 SD MET B 1 38.672 32.047 14.368 1.00 0.00 S ATOM 1347 CE MET B 1 37.147 32.471 15.259 1.00 0.00 C ATOM 0 H1 MET B 1 41.683 33.538 13.158 1.00 0.00 H new ATOM 0 H2 MET B 1 42.437 33.298 11.655 1.00 0.00 H new ATOM 0 H3 MET B 1 41.241 34.492 11.824 1.00 0.00 H new ATOM 0 HA MET B 1 40.562 31.683 12.420 1.00 0.00 H new ATOM 0 HB2 MET B 1 39.047 34.081 11.283 1.00 0.00 H new ATOM 0 HB3 MET B 1 38.343 32.500 11.561 1.00 0.00 H new ATOM 0 HG2 MET B 1 39.685 34.159 13.759 1.00 0.00 H new ATOM 0 HG3 MET B 1 37.959 34.173 13.456 1.00 0.00 H new ATOM 0 HE1 MET B 1 36.874 31.651 15.924 1.00 0.00 H new ATOM 0 HE2 MET B 1 37.308 33.376 15.845 1.00 0.00 H new ATOM 0 HE3 MET B 1 36.343 32.641 14.543 1.00 0.00 H new ATOM 1359 N SER B 2 41.139 30.853 10.151 1.00 0.00 N ATOM 1360 CA SER B 2 41.382 30.307 8.814 1.00 0.00 C ATOM 1361 C SER B 2 41.309 28.786 8.836 1.00 0.00 C ATOM 1362 O SER B 2 41.374 28.139 7.790 1.00 0.00 O ATOM 1363 CB SER B 2 42.759 30.749 8.316 1.00 0.00 C ATOM 1364 OG SER B 2 42.872 32.158 8.449 1.00 0.00 O ATOM 0 H SER B 2 41.326 30.204 10.915 1.00 0.00 H new ATOM 0 HA SER B 2 40.613 30.684 8.140 1.00 0.00 H new ATOM 0 HB2 SER B 2 43.543 30.253 8.889 1.00 0.00 H new ATOM 0 HB3 SER B 2 42.893 30.458 7.274 1.00 0.00 H new ATOM 0 HG SER B 2 41.980 32.563 8.413 1.00 0.00 H new ATOM 1370 N GLU B 3 41.177 28.219 10.031 1.00 0.00 N ATOM 1371 CA GLU B 3 41.094 26.771 10.175 1.00 0.00 C ATOM 1372 C GLU B 3 39.755 26.263 9.660 1.00 0.00 C ATOM 1373 O GLU B 3 39.409 26.451 8.493 1.00 0.00 O ATOM 1374 CB GLU B 3 41.281 26.388 11.650 1.00 0.00 C ATOM 1375 CG GLU B 3 42.697 26.745 12.112 1.00 0.00 C ATOM 1376 CD GLU B 3 42.858 26.431 13.600 1.00 0.00 C ATOM 1377 OE1 GLU B 3 41.928 25.890 14.175 1.00 0.00 O ATOM 1378 OE2 GLU B 3 43.909 26.737 14.139 1.00 0.00 O ATOM 0 H GLU B 3 41.126 28.737 10.908 1.00 0.00 H new ATOM 0 HA GLU B 3 41.885 26.308 9.585 1.00 0.00 H new ATOM 0 HB2 GLU B 3 40.547 26.909 12.265 1.00 0.00 H new ATOM 0 HB3 GLU B 3 41.106 25.320 11.781 1.00 0.00 H new ATOM 0 HG2 GLU B 3 43.430 26.183 11.532 1.00 0.00 H new ATOM 0 HG3 GLU B 3 42.891 27.802 11.932 1.00 0.00 H new ATOM 1385 N LEU B 4 39.003 25.611 10.541 1.00 0.00 N ATOM 1386 CA LEU B 4 37.704 25.069 10.173 1.00 0.00 C ATOM 1387 C LEU B 4 37.848 24.013 9.067 1.00 0.00 C ATOM 1388 O LEU B 4 36.881 23.346 8.698 1.00 0.00 O ATOM 1389 CB LEU B 4 36.774 26.197 9.701 1.00 0.00 C ATOM 1390 CG LEU B 4 36.780 27.353 10.713 1.00 0.00 C ATOM 1391 CD1 LEU B 4 35.899 28.485 10.173 1.00 0.00 C ATOM 1392 CD2 LEU B 4 36.251 26.875 12.083 1.00 0.00 C ATOM 0 H LEU B 4 39.271 25.447 11.511 1.00 0.00 H new ATOM 0 HA LEU B 4 37.271 24.593 11.053 1.00 0.00 H new ATOM 0 HB2 LEU B 4 37.096 26.558 8.724 1.00 0.00 H new ATOM 0 HB3 LEU B 4 35.760 25.815 9.581 1.00 0.00 H new ATOM 0 HG LEU B 4 37.800 27.711 10.850 1.00 0.00 H new ATOM 0 HD11 LEU B 4 35.895 29.313 10.882 1.00 0.00 H new ATOM 0 HD12 LEU B 4 36.294 28.829 9.217 1.00 0.00 H new ATOM 0 HD13 LEU B 4 34.881 28.120 10.035 1.00 0.00 H new ATOM 0 HD21 LEU B 4 36.262 27.707 12.788 1.00 0.00 H new ATOM 0 HD22 LEU B 4 35.231 26.508 11.971 1.00 0.00 H new ATOM 0 HD23 LEU B 4 36.886 26.073 12.458 1.00 0.00 H new ATOM 1404 N PHE B 5 39.065 23.868 8.553 1.00 0.00 N ATOM 1405 CA PHE B 5 39.332 22.889 7.500 1.00 0.00 C ATOM 1406 C PHE B 5 39.270 21.470 8.068 1.00 0.00 C ATOM 1407 O PHE B 5 38.862 20.535 7.380 1.00 0.00 O ATOM 1408 CB PHE B 5 40.717 23.148 6.857 1.00 0.00 C ATOM 1409 CG PHE B 5 40.630 24.305 5.876 1.00 0.00 C ATOM 1410 CD1 PHE B 5 39.993 24.098 4.647 1.00 0.00 C ATOM 1411 CD2 PHE B 5 41.173 25.560 6.181 1.00 0.00 C ATOM 1412 CE1 PHE B 5 39.898 25.144 3.722 1.00 0.00 C ATOM 1413 CE2 PHE B 5 41.078 26.606 5.256 1.00 0.00 C ATOM 1414 CZ PHE B 5 40.440 26.399 4.027 1.00 0.00 C ATOM 0 H PHE B 5 39.878 24.411 8.844 1.00 0.00 H new ATOM 0 HA PHE B 5 38.568 22.993 6.730 1.00 0.00 H new ATOM 0 HB2 PHE B 5 41.450 23.373 7.632 1.00 0.00 H new ATOM 0 HB3 PHE B 5 41.061 22.251 6.343 1.00 0.00 H new ATOM 0 HD1 PHE B 5 39.574 23.130 4.412 1.00 0.00 H new ATOM 0 HD2 PHE B 5 41.665 25.720 7.129 1.00 0.00 H new ATOM 0 HE1 PHE B 5 39.407 24.984 2.774 1.00 0.00 H new ATOM 0 HE2 PHE B 5 41.497 27.573 5.490 1.00 0.00 H new ATOM 0 HZ PHE B 5 40.366 27.207 3.314 1.00 0.00 H new ATOM 1424 N SER B 6 39.688 21.319 9.320 1.00 0.00 N ATOM 1425 CA SER B 6 39.701 20.011 9.962 1.00 0.00 C ATOM 1426 C SER B 6 38.283 19.583 10.322 1.00 0.00 C ATOM 1427 O SER B 6 37.516 20.367 10.881 1.00 0.00 O ATOM 1428 CB SER B 6 40.583 20.088 11.230 1.00 0.00 C ATOM 1429 OG SER B 6 39.767 20.324 12.373 1.00 0.00 O ATOM 0 H SER B 6 40.021 22.083 9.908 1.00 0.00 H new ATOM 0 HA SER B 6 40.111 19.269 9.277 1.00 0.00 H new ATOM 0 HB2 SER B 6 41.139 19.158 11.354 1.00 0.00 H new ATOM 0 HB3 SER B 6 41.317 20.887 11.125 1.00 0.00 H new ATOM 0 HG SER B 6 40.331 20.370 13.173 1.00 0.00 H new ATOM 1435 N VAL B 7 37.938 18.341 9.997 1.00 0.00 N ATOM 1436 CA VAL B 7 36.608 17.822 10.308 1.00 0.00 C ATOM 1437 C VAL B 7 36.482 17.571 11.819 1.00 0.00 C ATOM 1438 O VAL B 7 35.420 17.828 12.386 1.00 0.00 O ATOM 1439 CB VAL B 7 36.323 16.513 9.514 1.00 0.00 C ATOM 1440 CG1 VAL B 7 34.805 16.284 9.351 1.00 0.00 C ATOM 1441 CG2 VAL B 7 36.966 16.606 8.122 1.00 0.00 C ATOM 0 H VAL B 7 38.553 17.680 9.523 1.00 0.00 H new ATOM 0 HA VAL B 7 35.869 18.565 10.010 1.00 0.00 H new ATOM 0 HB VAL B 7 36.747 15.677 10.071 1.00 0.00 H new ATOM 0 HG11 VAL B 7 34.634 15.363 8.793 1.00 0.00 H new ATOM 0 HG12 VAL B 7 34.341 16.204 10.334 1.00 0.00 H new ATOM 0 HG13 VAL B 7 34.366 17.123 8.810 1.00 0.00 H new ATOM 0 HG21 VAL B 7 36.766 15.689 7.567 1.00 0.00 H new ATOM 0 HG22 VAL B 7 36.546 17.455 7.583 1.00 0.00 H new ATOM 0 HG23 VAL B 7 38.043 16.739 8.227 1.00 0.00 H new ATOM 1451 N PRO B 8 37.511 17.089 12.461 1.00 0.00 N ATOM 1452 CA PRO B 8 37.454 16.816 13.926 1.00 0.00 C ATOM 1453 C PRO B 8 36.998 18.040 14.713 1.00 0.00 C ATOM 1454 O PRO B 8 36.415 17.900 15.788 1.00 0.00 O ATOM 1455 CB PRO B 8 38.907 16.423 14.290 1.00 0.00 C ATOM 1456 CG PRO B 8 39.473 15.891 13.013 1.00 0.00 C ATOM 1457 CD PRO B 8 38.852 16.763 11.920 1.00 0.00 C ATOM 0 HA PRO B 8 36.733 16.037 14.172 1.00 0.00 H new ATOM 0 HB2 PRO B 8 39.474 17.282 14.650 1.00 0.00 H new ATOM 0 HB3 PRO B 8 38.931 15.672 15.080 1.00 0.00 H new ATOM 0 HG2 PRO B 8 40.561 15.959 13.003 1.00 0.00 H new ATOM 0 HG3 PRO B 8 39.218 14.840 12.874 1.00 0.00 H new ATOM 0 HD2 PRO B 8 39.442 17.662 11.740 1.00 0.00 H new ATOM 0 HD3 PRO B 8 38.784 16.230 10.971 1.00 0.00 H new ATOM 1465 N TYR B 9 37.276 19.229 14.190 1.00 0.00 N ATOM 1466 CA TYR B 9 36.900 20.468 14.867 1.00 0.00 C ATOM 1467 C TYR B 9 35.383 20.540 15.040 1.00 0.00 C ATOM 1468 O TYR B 9 34.889 20.899 16.109 1.00 0.00 O ATOM 1469 CB TYR B 9 37.393 21.685 14.062 1.00 0.00 C ATOM 1470 CG TYR B 9 37.046 22.958 14.812 1.00 0.00 C ATOM 1471 CD1 TYR B 9 37.834 23.344 15.903 1.00 0.00 C ATOM 1472 CD2 TYR B 9 35.957 23.746 14.423 1.00 0.00 C ATOM 1473 CE1 TYR B 9 37.533 24.517 16.605 1.00 0.00 C ATOM 1474 CE2 TYR B 9 35.655 24.920 15.124 1.00 0.00 C ATOM 1475 CZ TYR B 9 36.444 25.305 16.215 1.00 0.00 C ATOM 1476 OH TYR B 9 36.145 26.463 16.906 1.00 0.00 O ATOM 0 H TYR B 9 37.759 19.363 13.302 1.00 0.00 H new ATOM 0 HA TYR B 9 37.368 20.480 15.851 1.00 0.00 H new ATOM 0 HB2 TYR B 9 38.470 21.622 13.909 1.00 0.00 H new ATOM 0 HB3 TYR B 9 36.931 21.694 13.075 1.00 0.00 H new ATOM 0 HD1 TYR B 9 38.675 22.736 16.203 1.00 0.00 H new ATOM 0 HD2 TYR B 9 35.349 23.448 13.581 1.00 0.00 H new ATOM 0 HE1 TYR B 9 38.141 24.814 17.447 1.00 0.00 H new ATOM 0 HE2 TYR B 9 34.814 25.528 14.824 1.00 0.00 H new ATOM 0 HH TYR B 9 35.360 26.890 16.504 1.00 0.00 H new ATOM 1486 N PHE B 10 34.653 20.197 13.984 1.00 0.00 N ATOM 1487 CA PHE B 10 33.192 20.224 14.032 1.00 0.00 C ATOM 1488 C PHE B 10 32.683 19.309 15.154 1.00 0.00 C ATOM 1489 O PHE B 10 31.702 19.630 15.825 1.00 0.00 O ATOM 1490 CB PHE B 10 32.612 19.779 12.648 1.00 0.00 C ATOM 1491 CG PHE B 10 32.092 20.984 11.868 1.00 0.00 C ATOM 1492 CD1 PHE B 10 32.901 22.118 11.726 1.00 0.00 C ATOM 1493 CD2 PHE B 10 30.810 20.965 11.305 1.00 0.00 C ATOM 1494 CE1 PHE B 10 32.429 23.232 11.022 1.00 0.00 C ATOM 1495 CE2 PHE B 10 30.337 22.079 10.601 1.00 0.00 C ATOM 1496 CZ PHE B 10 31.147 23.212 10.459 1.00 0.00 C ATOM 0 H PHE B 10 35.043 19.899 13.090 1.00 0.00 H new ATOM 0 HA PHE B 10 32.856 21.240 14.242 1.00 0.00 H new ATOM 0 HB2 PHE B 10 33.385 19.272 12.070 1.00 0.00 H new ATOM 0 HB3 PHE B 10 31.805 19.062 12.800 1.00 0.00 H new ATOM 0 HD1 PHE B 10 33.890 22.133 12.160 1.00 0.00 H new ATOM 0 HD2 PHE B 10 30.186 20.090 11.414 1.00 0.00 H new ATOM 0 HE1 PHE B 10 33.053 24.107 10.913 1.00 0.00 H new ATOM 0 HE2 PHE B 10 29.348 22.064 10.168 1.00 0.00 H new ATOM 0 HZ PHE B 10 30.783 24.071 9.915 1.00 0.00 H new ATOM 1506 N ILE B 11 33.350 18.175 15.343 1.00 0.00 N ATOM 1507 CA ILE B 11 32.946 17.227 16.380 1.00 0.00 C ATOM 1508 C ILE B 11 33.226 17.796 17.770 1.00 0.00 C ATOM 1509 O ILE B 11 32.384 17.743 18.666 1.00 0.00 O ATOM 1510 CB ILE B 11 33.703 15.904 16.192 1.00 0.00 C ATOM 1511 CG1 ILE B 11 33.511 15.420 14.744 1.00 0.00 C ATOM 1512 CG2 ILE B 11 33.154 14.847 17.162 1.00 0.00 C ATOM 1513 CD1 ILE B 11 34.286 14.122 14.509 1.00 0.00 C ATOM 0 H ILE B 11 34.164 17.890 14.799 1.00 0.00 H new ATOM 0 HA ILE B 11 31.874 17.048 16.292 1.00 0.00 H new ATOM 0 HB ILE B 11 34.763 16.057 16.395 1.00 0.00 H new ATOM 0 HG12 ILE B 11 32.451 15.260 14.545 1.00 0.00 H new ATOM 0 HG13 ILE B 11 33.854 16.187 14.049 1.00 0.00 H new ATOM 0 HG21 ILE B 11 33.695 13.911 17.024 1.00 0.00 H new ATOM 0 HG22 ILE B 11 33.283 15.193 18.188 1.00 0.00 H new ATOM 0 HG23 ILE B 11 32.094 14.687 16.964 1.00 0.00 H new ATOM 0 HD11 ILE B 11 34.140 13.792 13.480 1.00 0.00 H new ATOM 0 HD12 ILE B 11 35.347 14.294 14.688 1.00 0.00 H new ATOM 0 HD13 ILE B 11 33.923 13.353 15.191 1.00 0.00 H new ATOM 1525 N GLU B 12 34.430 18.332 17.939 1.00 0.00 N ATOM 1526 CA GLU B 12 34.830 18.906 19.230 1.00 0.00 C ATOM 1527 C GLU B 12 33.775 19.904 19.725 1.00 0.00 C ATOM 1528 O GLU B 12 33.641 20.121 20.929 1.00 0.00 O ATOM 1529 CB GLU B 12 36.185 19.623 19.092 1.00 0.00 C ATOM 1530 CG GLU B 12 37.307 18.597 18.881 1.00 0.00 C ATOM 1531 CD GLU B 12 38.624 19.310 18.576 1.00 0.00 C ATOM 1532 OE1 GLU B 12 38.634 20.530 18.598 1.00 0.00 O ATOM 1533 OE2 GLU B 12 39.599 18.625 18.316 1.00 0.00 O ATOM 0 H GLU B 12 35.142 18.384 17.211 1.00 0.00 H new ATOM 0 HA GLU B 12 34.919 18.095 19.953 1.00 0.00 H new ATOM 0 HB2 GLU B 12 36.154 20.317 18.252 1.00 0.00 H new ATOM 0 HB3 GLU B 12 36.385 20.213 19.986 1.00 0.00 H new ATOM 0 HG2 GLU B 12 37.417 17.980 19.772 1.00 0.00 H new ATOM 0 HG3 GLU B 12 37.048 17.928 18.060 1.00 0.00 H new ATOM 1540 N ASN B 13 33.027 20.489 18.796 1.00 0.00 N ATOM 1541 CA ASN B 13 31.982 21.447 19.156 1.00 0.00 C ATOM 1542 C ASN B 13 30.819 20.733 19.838 1.00 0.00 C ATOM 1543 O ASN B 13 30.136 21.300 20.691 1.00 0.00 O ATOM 1544 CB ASN B 13 31.480 22.183 17.911 1.00 0.00 C ATOM 1545 CG ASN B 13 30.425 23.217 18.300 1.00 0.00 C ATOM 1546 OD1 ASN B 13 30.392 23.680 19.520 1.00 0.00 O flip ATOM 1547 ND2 ASN B 13 29.607 23.609 17.468 1.00 0.00 N flip ATOM 0 H ASN B 13 33.122 20.320 17.795 1.00 0.00 H new ATOM 0 HA ASN B 13 32.407 22.173 19.849 1.00 0.00 H new ATOM 0 HB2 ASN B 13 32.314 22.674 17.409 1.00 0.00 H new ATOM 0 HB3 ASN B 13 31.057 21.470 17.203 1.00 0.00 H new ATOM 0 HD21 ASN B 13 29.635 23.246 16.515 1.00 0.00 H new ATOM 0 HD22 ASN B 13 28.902 24.297 17.731 1.00 0.00 H new ATOM 1554 N LEU B 14 30.595 19.484 19.444 1.00 0.00 N ATOM 1555 CA LEU B 14 29.516 18.679 20.006 1.00 0.00 C ATOM 1556 C LEU B 14 29.849 18.251 21.426 1.00 0.00 C ATOM 1557 O LEU B 14 28.985 18.237 22.303 1.00 0.00 O ATOM 1558 CB LEU B 14 29.297 17.439 19.134 1.00 0.00 C ATOM 1559 CG LEU B 14 29.237 17.844 17.659 1.00 0.00 C ATOM 1560 CD1 LEU B 14 28.975 16.600 16.805 1.00 0.00 C ATOM 1561 CD2 LEU B 14 28.129 18.885 17.430 1.00 0.00 C ATOM 0 H LEU B 14 31.149 19.005 18.734 1.00 0.00 H new ATOM 0 HA LEU B 14 28.607 19.280 20.029 1.00 0.00 H new ATOM 0 HB2 LEU B 14 30.106 16.725 19.292 1.00 0.00 H new ATOM 0 HB3 LEU B 14 28.371 16.940 19.421 1.00 0.00 H new ATOM 0 HG LEU B 14 30.189 18.290 17.372 1.00 0.00 H new ATOM 0 HD11 LEU B 14 28.931 16.883 15.753 1.00 0.00 H new ATOM 0 HD12 LEU B 14 29.780 15.880 16.954 1.00 0.00 H new ATOM 0 HD13 LEU B 14 28.027 16.150 17.099 1.00 0.00 H new ATOM 0 HD21 LEU B 14 28.101 19.161 16.376 1.00 0.00 H new ATOM 0 HD22 LEU B 14 27.167 18.462 17.720 1.00 0.00 H new ATOM 0 HD23 LEU B 14 28.332 19.771 18.032 1.00 0.00 H new ATOM 1573 N LYS B 15 31.111 17.898 21.648 1.00 0.00 N ATOM 1574 CA LYS B 15 31.561 17.461 22.958 1.00 0.00 C ATOM 1575 C LYS B 15 31.288 18.550 23.996 1.00 0.00 C ATOM 1576 O LYS B 15 31.017 18.260 25.162 1.00 0.00 O ATOM 1577 CB LYS B 15 33.061 17.135 22.918 1.00 0.00 C ATOM 1578 CG LYS B 15 33.295 15.895 22.046 1.00 0.00 C ATOM 1579 CD LYS B 15 34.785 15.558 22.019 1.00 0.00 C ATOM 1580 CE LYS B 15 35.008 14.311 21.163 1.00 0.00 C ATOM 1581 NZ LYS B 15 36.461 13.988 21.133 1.00 0.00 N ATOM 0 H LYS B 15 31.839 17.907 20.934 1.00 0.00 H new ATOM 0 HA LYS B 15 31.012 16.562 23.238 1.00 0.00 H new ATOM 0 HB2 LYS B 15 33.617 17.983 22.519 1.00 0.00 H new ATOM 0 HB3 LYS B 15 33.432 16.957 23.927 1.00 0.00 H new ATOM 0 HG2 LYS B 15 32.728 15.051 22.438 1.00 0.00 H new ATOM 0 HG3 LYS B 15 32.935 16.077 21.033 1.00 0.00 H new ATOM 0 HD2 LYS B 15 35.352 16.397 21.614 1.00 0.00 H new ATOM 0 HD3 LYS B 15 35.149 15.387 23.032 1.00 0.00 H new ATOM 0 HE2 LYS B 15 34.445 13.471 21.570 1.00 0.00 H new ATOM 0 HE3 LYS B 15 34.640 14.480 20.151 1.00 0.00 H new ATOM 0 HZ1 LYS B 15 36.616 13.140 20.551 1.00 0.00 H new ATOM 0 HZ2 LYS B 15 36.986 14.788 20.726 1.00 0.00 H new ATOM 0 HZ3 LYS B 15 36.797 13.810 22.101 1.00 0.00 H new ATOM 1595 N GLN B 16 31.371 19.803 23.562 1.00 0.00 N ATOM 1596 CA GLN B 16 31.127 20.934 24.456 1.00 0.00 C ATOM 1597 C GLN B 16 29.669 20.961 24.900 1.00 0.00 C ATOM 1598 O GLN B 16 29.362 21.415 26.003 1.00 0.00 O ATOM 1599 CB GLN B 16 31.490 22.241 23.745 1.00 0.00 C ATOM 1600 CG GLN B 16 31.296 23.423 24.701 1.00 0.00 C ATOM 1601 CD GLN B 16 31.865 24.696 24.084 1.00 0.00 C ATOM 1602 OE1 GLN B 16 31.449 25.105 22.999 1.00 0.00 O ATOM 1603 NE2 GLN B 16 32.793 25.357 24.721 1.00 0.00 N ATOM 0 H GLN B 16 31.604 20.062 22.603 1.00 0.00 H new ATOM 0 HA GLN B 16 31.752 20.824 25.343 1.00 0.00 H new ATOM 0 HB2 GLN B 16 32.524 22.204 23.403 1.00 0.00 H new ATOM 0 HB3 GLN B 16 30.866 22.370 22.861 1.00 0.00 H new ATOM 0 HG2 GLN B 16 30.236 23.556 24.916 1.00 0.00 H new ATOM 0 HG3 GLN B 16 31.790 23.218 25.650 1.00 0.00 H new ATOM 0 HE21 GLN B 16 33.136 25.017 25.619 1.00 0.00 H new ATOM 0 HE22 GLN B 16 33.175 26.214 24.321 1.00 0.00 H new ATOM 1612 N HIS B 17 28.777 20.481 24.041 1.00 0.00 N ATOM 1613 CA HIS B 17 27.353 20.468 24.376 1.00 0.00 C ATOM 1614 C HIS B 17 27.068 19.457 25.489 1.00 0.00 C ATOM 1615 O HIS B 17 26.446 19.792 26.497 1.00 0.00 O ATOM 1616 CB HIS B 17 26.520 20.114 23.139 1.00 0.00 C ATOM 1617 CG HIS B 17 26.710 21.170 22.084 1.00 0.00 C ATOM 1618 ND1 HIS B 17 26.000 21.163 20.894 1.00 0.00 N ATOM 1619 CD2 HIS B 17 27.511 22.284 22.036 1.00 0.00 C ATOM 1620 CE1 HIS B 17 26.384 22.241 20.186 1.00 0.00 C ATOM 1621 NE2 HIS B 17 27.303 22.959 20.837 1.00 0.00 N ATOM 0 H HIS B 17 29.006 20.101 23.122 1.00 0.00 H new ATOM 0 HA HIS B 17 27.078 21.464 24.724 1.00 0.00 H new ATOM 0 HB2 HIS B 17 26.821 19.140 22.752 1.00 0.00 H new ATOM 0 HB3 HIS B 17 25.466 20.039 23.407 1.00 0.00 H new ATOM 0 HD2 HIS B 17 28.198 22.590 22.811 1.00 0.00 H new ATOM 0 HE1 HIS B 17 25.996 22.495 19.210 1.00 0.00 H new ATOM 0 HE2 HIS B 17 27.755 23.818 20.523 1.00 0.00 H new ATOM 1630 N ILE B 18 27.525 18.224 25.296 1.00 0.00 N ATOM 1631 CA ILE B 18 27.316 17.170 26.292 1.00 0.00 C ATOM 1632 C ILE B 18 28.209 17.396 27.515 1.00 0.00 C ATOM 1633 O ILE B 18 27.766 17.269 28.657 1.00 0.00 O ATOM 1634 CB ILE B 18 27.602 15.788 25.657 1.00 0.00 C ATOM 1635 CG1 ILE B 18 29.097 15.676 25.308 1.00 0.00 C ATOM 1636 CG2 ILE B 18 26.754 15.627 24.381 1.00 0.00 C ATOM 1637 CD1 ILE B 18 29.376 14.448 24.425 1.00 0.00 C ATOM 0 H ILE B 18 28.039 17.928 24.466 1.00 0.00 H new ATOM 0 HA ILE B 18 26.278 17.200 26.624 1.00 0.00 H new ATOM 0 HB ILE B 18 27.343 15.001 26.366 1.00 0.00 H new ATOM 0 HG12 ILE B 18 29.420 16.579 24.790 1.00 0.00 H new ATOM 0 HG13 ILE B 18 29.682 15.607 26.225 1.00 0.00 H new ATOM 0 HG21 ILE B 18 26.954 14.654 23.932 1.00 0.00 H new ATOM 0 HG22 ILE B 18 25.697 15.699 24.635 1.00 0.00 H new ATOM 0 HG23 ILE B 18 27.011 16.414 23.672 1.00 0.00 H new ATOM 0 HD11 ILE B 18 30.441 14.398 24.197 1.00 0.00 H new ATOM 0 HD12 ILE B 18 29.076 13.544 24.954 1.00 0.00 H new ATOM 0 HD13 ILE B 18 28.810 14.531 23.497 1.00 0.00 H new ATOM 1649 N GLU B 19 29.470 17.729 27.261 1.00 0.00 N ATOM 1650 CA GLU B 19 30.417 17.959 28.351 1.00 0.00 C ATOM 1651 C GLU B 19 29.989 19.156 29.193 1.00 0.00 C ATOM 1652 O GLU B 19 29.859 19.041 30.412 1.00 0.00 O ATOM 1653 CB GLU B 19 31.817 18.200 27.777 1.00 0.00 C ATOM 1654 CG GLU B 19 32.847 18.280 28.909 1.00 0.00 C ATOM 1655 CD GLU B 19 34.255 18.414 28.330 1.00 0.00 C ATOM 1656 OE1 GLU B 19 34.408 18.205 27.138 1.00 0.00 O ATOM 1657 OE2 GLU B 19 35.160 18.711 29.092 1.00 0.00 O ATOM 0 H GLU B 19 29.858 17.845 26.325 1.00 0.00 H new ATOM 0 HA GLU B 19 30.433 17.076 28.990 1.00 0.00 H new ATOM 0 HB2 GLU B 19 32.081 17.394 27.092 1.00 0.00 H new ATOM 0 HB3 GLU B 19 31.827 19.125 27.200 1.00 0.00 H new ATOM 0 HG2 GLU B 19 32.627 19.133 29.552 1.00 0.00 H new ATOM 0 HG3 GLU B 19 32.785 17.387 29.531 1.00 0.00 H new ATOM 1664 N MET B 20 29.756 20.292 28.545 1.00 0.00 N ATOM 1665 CA MET B 20 29.326 21.504 29.255 1.00 0.00 C ATOM 1666 C MET B 20 27.806 21.630 29.193 1.00 0.00 C ATOM 1667 O MET B 20 27.084 20.633 29.187 1.00 0.00 O ATOM 1668 CB MET B 20 29.984 22.759 28.641 1.00 0.00 C ATOM 1669 CG MET B 20 31.451 22.472 28.335 1.00 0.00 C ATOM 1670 SD MET B 20 32.283 21.864 29.819 1.00 0.00 S ATOM 1671 CE MET B 20 33.880 21.546 29.038 1.00 0.00 C ATOM 0 H MET B 20 29.855 20.405 27.536 1.00 0.00 H new ATOM 0 HA MET B 20 29.639 21.425 30.296 1.00 0.00 H new ATOM 0 HB2 MET B 20 29.461 23.046 27.729 1.00 0.00 H new ATOM 0 HB3 MET B 20 29.904 23.598 29.332 1.00 0.00 H new ATOM 0 HG2 MET B 20 31.527 21.734 27.537 1.00 0.00 H new ATOM 0 HG3 MET B 20 31.941 23.378 27.979 1.00 0.00 H new ATOM 0 HE1 MET B 20 34.492 20.932 29.699 1.00 0.00 H new ATOM 0 HE2 MET B 20 33.726 21.021 28.095 1.00 0.00 H new ATOM 0 HE3 MET B 20 34.387 22.492 28.848 1.00 0.00 H new ATOM 1681 N ASN B 21 27.327 22.870 29.158 1.00 0.00 N ATOM 1682 CA ASN B 21 25.894 23.114 29.105 1.00 0.00 C ATOM 1683 C ASN B 21 25.627 24.586 28.856 1.00 0.00 C ATOM 1684 O ASN B 21 24.772 25.187 29.507 1.00 0.00 O ATOM 1685 CB ASN B 21 25.237 22.693 30.422 1.00 0.00 C ATOM 1686 CG ASN B 21 23.719 22.808 30.314 1.00 0.00 C ATOM 1687 OD1 ASN B 21 23.132 23.765 30.819 1.00 0.00 O ATOM 1688 ND2 ASN B 21 23.046 21.885 29.684 1.00 0.00 N ATOM 0 H ASN B 21 27.904 23.711 29.165 1.00 0.00 H new ATOM 0 HA ASN B 21 25.471 22.527 28.290 1.00 0.00 H new ATOM 0 HB2 ASN B 21 25.515 21.667 30.664 1.00 0.00 H new ATOM 0 HB3 ASN B 21 25.600 23.322 31.235 1.00 0.00 H new ATOM 0 HD21 ASN B 21 22.031 21.955 29.609 1.00 0.00 H new ATOM 0 HD22 ASN B 21 23.535 21.093 29.266 1.00 0.00 H new ATOM 1695 N GLN B 22 26.357 25.167 27.910 1.00 0.00 N ATOM 1696 CA GLN B 22 26.183 26.580 27.596 1.00 0.00 C ATOM 1697 C GLN B 22 24.723 26.882 27.261 1.00 0.00 C ATOM 1698 O GLN B 22 24.150 27.855 27.752 1.00 0.00 O ATOM 1699 CB GLN B 22 27.071 26.954 26.406 1.00 0.00 C ATOM 1700 CG GLN B 22 28.544 26.885 26.811 1.00 0.00 C ATOM 1701 CD GLN B 22 29.423 27.306 25.640 1.00 0.00 C ATOM 1702 OE1 GLN B 22 29.864 26.400 24.810 1.00 0.00 O flip ATOM 1703 NE2 GLN B 22 29.723 28.489 25.480 1.00 0.00 N flip ATOM 0 H GLN B 22 27.066 24.689 27.354 1.00 0.00 H new ATOM 0 HA GLN B 22 26.469 27.169 28.468 1.00 0.00 H new ATOM 0 HB2 GLN B 22 26.882 26.276 25.573 1.00 0.00 H new ATOM 0 HB3 GLN B 22 26.827 27.959 26.061 1.00 0.00 H new ATOM 0 HG2 GLN B 22 28.726 27.536 27.666 1.00 0.00 H new ATOM 0 HG3 GLN B 22 28.798 25.872 27.122 1.00 0.00 H new ATOM 0 HE21 GLN B 22 29.377 29.195 26.130 1.00 0.00 H new ATOM 0 HE22 GLN B 22 30.317 28.763 24.698 1.00 0.00 H new ATOM 1712 N SER B 23 24.128 26.037 26.425 1.00 0.00 N ATOM 1713 CA SER B 23 22.731 26.222 26.033 1.00 0.00 C ATOM 1714 C SER B 23 22.308 25.142 25.044 1.00 0.00 C ATOM 1715 O SER B 23 22.066 25.425 23.871 1.00 0.00 O ATOM 1716 CB SER B 23 22.536 27.603 25.388 1.00 0.00 C ATOM 1717 OG SER B 23 21.334 27.603 24.629 1.00 0.00 O ATOM 0 H SER B 23 24.584 25.225 26.008 1.00 0.00 H new ATOM 0 HA SER B 23 22.115 26.151 26.929 1.00 0.00 H new ATOM 0 HB2 SER B 23 22.493 28.374 26.158 1.00 0.00 H new ATOM 0 HB3 SER B 23 23.385 27.840 24.746 1.00 0.00 H new ATOM 0 HG SER B 23 21.458 27.065 23.819 1.00 0.00 H new ATOM 1723 N GLU B 24 22.222 23.905 25.522 1.00 0.00 N ATOM 1724 CA GLU B 24 21.822 22.796 24.658 1.00 0.00 C ATOM 1725 C GLU B 24 21.344 21.607 25.501 1.00 0.00 C ATOM 1726 O GLU B 24 20.524 21.771 26.403 1.00 0.00 O ATOM 1727 CB GLU B 24 23.009 22.393 23.753 1.00 0.00 C ATOM 1728 CG GLU B 24 22.496 21.641 22.506 1.00 0.00 C ATOM 1729 CD GLU B 24 21.829 22.626 21.547 1.00 0.00 C ATOM 1730 OE1 GLU B 24 22.345 23.724 21.415 1.00 0.00 O ATOM 1731 OE2 GLU B 24 20.819 22.272 20.961 1.00 0.00 O ATOM 0 H GLU B 24 22.420 23.645 26.488 1.00 0.00 H new ATOM 0 HA GLU B 24 20.992 23.111 24.026 1.00 0.00 H new ATOM 0 HB2 GLU B 24 23.562 23.282 23.449 1.00 0.00 H new ATOM 0 HB3 GLU B 24 23.702 21.761 24.309 1.00 0.00 H new ATOM 0 HG2 GLU B 24 23.324 21.137 22.007 1.00 0.00 H new ATOM 0 HG3 GLU B 24 21.785 20.869 22.802 1.00 0.00 H new ATOM 1738 N ASP B 25 21.860 20.420 25.199 1.00 0.00 N ATOM 1739 CA ASP B 25 21.475 19.210 25.921 1.00 0.00 C ATOM 1740 C ASP B 25 22.521 18.123 25.728 1.00 0.00 C ATOM 1741 O ASP B 25 23.591 18.356 25.165 1.00 0.00 O ATOM 1742 CB ASP B 25 20.119 18.706 25.403 1.00 0.00 C ATOM 1743 CG ASP B 25 19.011 19.672 25.812 1.00 0.00 C ATOM 1744 OD1 ASP B 25 18.911 19.953 26.995 1.00 0.00 O ATOM 1745 OD2 ASP B 25 18.298 20.135 24.938 1.00 0.00 O ATOM 0 H ASP B 25 22.546 20.269 24.459 1.00 0.00 H new ATOM 0 HA ASP B 25 21.399 19.447 26.982 1.00 0.00 H new ATOM 0 HB2 ASP B 25 20.148 18.612 24.317 1.00 0.00 H new ATOM 0 HB3 ASP B 25 19.914 17.714 25.804 1.00 0.00 H new ATOM 1750 N LYS B 26 22.197 16.923 26.198 1.00 0.00 N ATOM 1751 CA LYS B 26 23.111 15.796 26.069 1.00 0.00 C ATOM 1752 C LYS B 26 23.051 15.227 24.643 1.00 0.00 C ATOM 1753 O LYS B 26 23.580 15.840 23.715 1.00 0.00 O ATOM 1754 CB LYS B 26 22.757 14.728 27.113 1.00 0.00 C ATOM 1755 CG LYS B 26 23.830 13.631 27.130 1.00 0.00 C ATOM 1756 CD LYS B 26 23.518 12.614 28.242 1.00 0.00 C ATOM 1757 CE LYS B 26 22.181 11.887 27.966 1.00 0.00 C ATOM 1758 NZ LYS B 26 21.051 12.691 28.519 1.00 0.00 N ATOM 0 H LYS B 26 21.317 16.708 26.667 1.00 0.00 H new ATOM 0 HA LYS B 26 24.133 16.129 26.251 1.00 0.00 H new ATOM 0 HB2 LYS B 26 22.677 15.185 28.099 1.00 0.00 H new ATOM 0 HB3 LYS B 26 21.784 14.293 26.884 1.00 0.00 H new ATOM 0 HG2 LYS B 26 23.864 13.128 26.164 1.00 0.00 H new ATOM 0 HG3 LYS B 26 24.813 14.073 27.294 1.00 0.00 H new ATOM 0 HD2 LYS B 26 24.325 11.885 28.311 1.00 0.00 H new ATOM 0 HD3 LYS B 26 23.467 13.125 29.204 1.00 0.00 H new ATOM 0 HE2 LYS B 26 22.048 11.743 26.894 1.00 0.00 H new ATOM 0 HE3 LYS B 26 22.193 10.897 28.421 1.00 0.00 H new ATOM 0 HZ1 LYS B 26 20.471 12.092 29.141 1.00 0.00 H new ATOM 0 HZ2 LYS B 26 21.429 13.492 29.064 1.00 0.00 H new ATOM 0 HZ3 LYS B 26 20.465 13.049 27.738 1.00 0.00 H new ATOM 1772 N ILE B 27 22.428 14.065 24.482 1.00 0.00 N ATOM 1773 CA ILE B 27 22.321 13.442 23.170 1.00 0.00 C ATOM 1774 C ILE B 27 21.476 14.299 22.234 1.00 0.00 C ATOM 1775 O ILE B 27 21.713 14.329 21.026 1.00 0.00 O ATOM 1776 CB ILE B 27 21.709 12.048 23.312 1.00 0.00 C ATOM 1777 CG1 ILE B 27 21.706 11.344 21.941 1.00 0.00 C ATOM 1778 CG2 ILE B 27 20.276 12.157 23.849 1.00 0.00 C ATOM 1779 CD1 ILE B 27 21.404 9.856 22.127 1.00 0.00 C ATOM 0 H ILE B 27 21.992 13.539 25.239 1.00 0.00 H new ATOM 0 HA ILE B 27 23.319 13.353 22.740 1.00 0.00 H new ATOM 0 HB ILE B 27 22.304 11.464 24.014 1.00 0.00 H new ATOM 0 HG12 ILE B 27 20.959 11.798 21.290 1.00 0.00 H new ATOM 0 HG13 ILE B 27 22.673 11.471 21.454 1.00 0.00 H new ATOM 0 HG21 ILE B 27 19.847 11.160 23.947 1.00 0.00 H new ATOM 0 HG22 ILE B 27 20.289 12.644 24.824 1.00 0.00 H new ATOM 0 HG23 ILE B 27 19.672 12.745 23.158 1.00 0.00 H new ATOM 0 HD11 ILE B 27 21.403 9.361 21.156 1.00 0.00 H new ATOM 0 HD12 ILE B 27 22.167 9.406 22.762 1.00 0.00 H new ATOM 0 HD13 ILE B 27 20.427 9.739 22.595 1.00 0.00 H new ATOM 1791 N HIS B 28 20.488 14.988 22.795 1.00 0.00 N ATOM 1792 CA HIS B 28 19.620 15.846 21.996 1.00 0.00 C ATOM 1793 C HIS B 28 20.412 17.028 21.418 1.00 0.00 C ATOM 1794 O HIS B 28 19.832 17.937 20.826 1.00 0.00 O ATOM 1795 CB HIS B 28 18.456 16.352 22.860 1.00 0.00 C ATOM 1796 CG HIS B 28 17.526 15.211 23.189 1.00 0.00 C ATOM 1797 ND1 HIS B 28 16.840 14.513 22.208 1.00 0.00 N ATOM 1798 CD2 HIS B 28 17.146 14.651 24.383 1.00 0.00 C ATOM 1799 CE1 HIS B 28 16.089 13.581 22.823 1.00 0.00 C ATOM 1800 NE2 HIS B 28 16.238 13.622 24.150 1.00 0.00 N ATOM 0 H HIS B 28 20.269 14.970 23.791 1.00 0.00 H new ATOM 0 HA HIS B 28 19.220 15.267 21.164 1.00 0.00 H new ATOM 0 HB2 HIS B 28 18.840 16.796 23.779 1.00 0.00 H new ATOM 0 HB3 HIS B 28 17.912 17.135 22.331 1.00 0.00 H new ATOM 0 HD2 HIS B 28 17.498 14.962 25.356 1.00 0.00 H new ATOM 0 HE1 HIS B 28 15.445 12.885 22.307 1.00 0.00 H new ATOM 0 HE2 HIS B 28 15.784 13.027 24.843 1.00 0.00 H new ATOM 1809 N ALA B 29 21.730 16.999 21.586 1.00 0.00 N ATOM 1810 CA ALA B 29 22.601 18.059 21.066 1.00 0.00 C ATOM 1811 C ALA B 29 22.801 17.899 19.563 1.00 0.00 C ATOM 1812 O ALA B 29 22.771 18.871 18.807 1.00 0.00 O ATOM 1813 CB ALA B 29 23.965 18.007 21.765 1.00 0.00 C ATOM 0 H ALA B 29 22.223 16.254 22.078 1.00 0.00 H new ATOM 0 HA ALA B 29 22.125 19.020 21.262 1.00 0.00 H new ATOM 0 HB1 ALA B 29 24.605 18.797 21.373 1.00 0.00 H new ATOM 0 HB2 ALA B 29 23.830 18.148 22.837 1.00 0.00 H new ATOM 0 HB3 ALA B 29 24.431 17.039 21.582 1.00 0.00 H new ATOM 1819 N MET B 30 23.018 16.659 19.139 1.00 0.00 N ATOM 1820 CA MET B 30 23.230 16.365 17.734 1.00 0.00 C ATOM 1821 C MET B 30 22.024 16.801 16.914 1.00 0.00 C ATOM 1822 O MET B 30 22.182 17.452 15.881 1.00 0.00 O ATOM 1823 CB MET B 30 23.470 14.852 17.547 1.00 0.00 C ATOM 1824 CG MET B 30 22.165 14.066 17.811 1.00 0.00 C ATOM 1825 SD MET B 30 22.539 12.328 18.151 1.00 0.00 S ATOM 1826 CE MET B 30 20.839 11.778 18.484 1.00 0.00 C ATOM 0 H MET B 30 23.051 15.844 19.751 1.00 0.00 H new ATOM 0 HA MET B 30 24.106 16.915 17.389 1.00 0.00 H new ATOM 0 HB2 MET B 30 23.823 14.655 16.535 1.00 0.00 H new ATOM 0 HB3 MET B 30 24.251 14.514 18.228 1.00 0.00 H new ATOM 0 HG2 MET B 30 21.633 14.503 18.656 1.00 0.00 H new ATOM 0 HG3 MET B 30 21.506 14.141 16.946 1.00 0.00 H new ATOM 0 HE1 MET B 30 20.861 10.897 19.125 1.00 0.00 H new ATOM 0 HE2 MET B 30 20.289 12.576 18.983 1.00 0.00 H new ATOM 0 HE3 MET B 30 20.346 11.530 17.544 1.00 0.00 H new ATOM 1836 N ASN B 31 20.827 16.450 17.372 1.00 0.00 N ATOM 1837 CA ASN B 31 19.617 16.812 16.640 1.00 0.00 C ATOM 1838 C ASN B 31 19.577 18.316 16.384 1.00 0.00 C ATOM 1839 O ASN B 31 19.253 18.751 15.279 1.00 0.00 O ATOM 1840 CB ASN B 31 18.386 16.408 17.452 1.00 0.00 C ATOM 1841 CG ASN B 31 18.429 14.915 17.759 1.00 0.00 C ATOM 1842 OD1 ASN B 31 18.534 14.521 18.920 1.00 0.00 O ATOM 1843 ND2 ASN B 31 18.343 14.057 16.780 1.00 0.00 N ATOM 0 H ASN B 31 20.668 15.924 18.232 1.00 0.00 H new ATOM 0 HA ASN B 31 19.620 16.289 15.684 1.00 0.00 H new ATOM 0 HB2 ASN B 31 18.350 16.977 18.381 1.00 0.00 H new ATOM 0 HB3 ASN B 31 17.479 16.647 16.896 1.00 0.00 H new ATOM 0 HD21 ASN B 31 18.363 13.056 16.976 1.00 0.00 H new ATOM 0 HD22 ASN B 31 18.256 14.387 15.819 1.00 0.00 H new ATOM 1850 N SER B 32 19.922 19.102 17.398 1.00 0.00 N ATOM 1851 CA SER B 32 19.925 20.552 17.241 1.00 0.00 C ATOM 1852 C SER B 32 21.070 20.995 16.332 1.00 0.00 C ATOM 1853 O SER B 32 20.852 21.674 15.328 1.00 0.00 O ATOM 1854 CB SER B 32 20.099 21.206 18.605 1.00 0.00 C ATOM 1855 OG SER B 32 21.323 20.762 19.172 1.00 0.00 O ATOM 0 H SER B 32 20.198 18.768 18.321 1.00 0.00 H new ATOM 0 HA SER B 32 18.978 20.854 16.792 1.00 0.00 H new ATOM 0 HB2 SER B 32 20.101 22.291 18.506 1.00 0.00 H new ATOM 0 HB3 SER B 32 19.265 20.947 19.257 1.00 0.00 H new ATOM 0 HG SER B 32 21.240 20.733 20.148 1.00 0.00 H new ATOM 1861 N TYR B 33 22.288 20.603 16.691 1.00 0.00 N ATOM 1862 CA TYR B 33 23.468 20.959 15.908 1.00 0.00 C ATOM 1863 C TYR B 33 23.349 20.419 14.476 1.00 0.00 C ATOM 1864 O TYR B 33 23.612 21.126 13.504 1.00 0.00 O ATOM 1865 CB TYR B 33 24.720 20.371 16.576 1.00 0.00 C ATOM 1866 CG TYR B 33 25.933 20.705 15.736 1.00 0.00 C ATOM 1867 CD1 TYR B 33 26.265 19.893 14.644 1.00 0.00 C ATOM 1868 CD2 TYR B 33 26.714 21.827 16.036 1.00 0.00 C ATOM 1869 CE1 TYR B 33 27.378 20.204 13.854 1.00 0.00 C ATOM 1870 CE2 TYR B 33 27.827 22.138 15.246 1.00 0.00 C ATOM 1871 CZ TYR B 33 28.159 21.326 14.154 1.00 0.00 C ATOM 1872 OH TYR B 33 29.256 21.634 13.379 1.00 0.00 O ATOM 0 H TYR B 33 22.485 20.039 17.518 1.00 0.00 H new ATOM 0 HA TYR B 33 23.546 22.045 15.866 1.00 0.00 H new ATOM 0 HB2 TYR B 33 24.835 20.777 17.581 1.00 0.00 H new ATOM 0 HB3 TYR B 33 24.619 19.290 16.678 1.00 0.00 H new ATOM 0 HD1 TYR B 33 25.663 19.027 14.412 1.00 0.00 H new ATOM 0 HD2 TYR B 33 26.458 22.453 16.878 1.00 0.00 H new ATOM 0 HE1 TYR B 33 27.634 19.578 13.012 1.00 0.00 H new ATOM 0 HE2 TYR B 33 28.429 23.004 15.478 1.00 0.00 H new ATOM 0 HH TYR B 33 29.302 21.018 12.618 1.00 0.00 H new ATOM 1882 N TYR B 34 22.948 19.157 14.366 1.00 0.00 N ATOM 1883 CA TYR B 34 22.800 18.517 13.060 1.00 0.00 C ATOM 1884 C TYR B 34 21.856 19.332 12.184 1.00 0.00 C ATOM 1885 O TYR B 34 22.168 19.623 11.030 1.00 0.00 O ATOM 1886 CB TYR B 34 22.246 17.089 13.233 1.00 0.00 C ATOM 1887 CG TYR B 34 22.062 16.436 11.878 1.00 0.00 C ATOM 1888 CD1 TYR B 34 20.854 16.601 11.189 1.00 0.00 C ATOM 1889 CD2 TYR B 34 23.096 15.685 11.307 1.00 0.00 C ATOM 1890 CE1 TYR B 34 20.681 16.016 9.930 1.00 0.00 C ATOM 1891 CE2 TYR B 34 22.923 15.099 10.047 1.00 0.00 C ATOM 1892 CZ TYR B 34 21.715 15.265 9.359 1.00 0.00 C ATOM 1893 OH TYR B 34 21.544 14.685 8.117 1.00 0.00 O ATOM 0 H TYR B 34 22.720 18.558 15.160 1.00 0.00 H new ATOM 0 HA TYR B 34 23.777 18.466 12.580 1.00 0.00 H new ATOM 0 HB2 TYR B 34 22.929 16.496 13.842 1.00 0.00 H new ATOM 0 HB3 TYR B 34 21.294 17.121 13.762 1.00 0.00 H new ATOM 0 HD1 TYR B 34 20.056 17.180 11.630 1.00 0.00 H new ATOM 0 HD2 TYR B 34 24.028 15.557 11.838 1.00 0.00 H new ATOM 0 HE1 TYR B 34 19.750 16.144 9.399 1.00 0.00 H new ATOM 0 HE2 TYR B 34 23.721 14.519 9.606 1.00 0.00 H new ATOM 0 HH TYR B 34 22.358 14.200 7.867 1.00 0.00 H new ATOM 1903 N ARG B 35 20.704 19.699 12.737 1.00 0.00 N ATOM 1904 CA ARG B 35 19.724 20.486 11.999 1.00 0.00 C ATOM 1905 C ARG B 35 20.220 21.918 11.817 1.00 0.00 C ATOM 1906 O ARG B 35 19.799 22.613 10.892 1.00 0.00 O ATOM 1907 CB ARG B 35 18.386 20.489 12.740 1.00 0.00 C ATOM 1908 CG ARG B 35 17.334 21.216 11.896 1.00 0.00 C ATOM 1909 CD ARG B 35 15.967 21.088 12.565 1.00 0.00 C ATOM 1910 NE ARG B 35 15.535 19.696 12.562 1.00 0.00 N ATOM 1911 CZ ARG B 35 14.426 19.321 13.192 1.00 0.00 C ATOM 1912 NH1 ARG B 35 13.701 20.206 13.819 1.00 0.00 N ATOM 1913 NH2 ARG B 35 14.063 18.068 13.183 1.00 0.00 N ATOM 0 H ARG B 35 20.428 19.465 13.690 1.00 0.00 H new ATOM 0 HA ARG B 35 19.586 20.035 11.016 1.00 0.00 H new ATOM 0 HB2 ARG B 35 18.065 19.466 12.937 1.00 0.00 H new ATOM 0 HB3 ARG B 35 18.495 20.981 13.707 1.00 0.00 H new ATOM 0 HG2 ARG B 35 17.601 22.267 11.789 1.00 0.00 H new ATOM 0 HG3 ARG B 35 17.301 20.792 10.893 1.00 0.00 H new ATOM 0 HD2 ARG B 35 16.019 21.458 13.589 1.00 0.00 H new ATOM 0 HD3 ARG B 35 15.237 21.704 12.040 1.00 0.00 H new ATOM 0 HE ARG B 35 16.092 18.999 12.069 1.00 0.00 H new ATOM 0 HH11 ARG B 35 13.985 21.186 13.826 1.00 0.00 H new ATOM 0 HH12 ARG B 35 12.850 19.918 14.302 1.00 0.00 H new ATOM 0 HH21 ARG B 35 14.630 17.376 12.693 1.00 0.00 H new ATOM 0 HH22 ARG B 35 13.212 17.780 13.666 1.00 0.00 H new ATOM 1927 N SER B 36 21.110 22.353 12.702 1.00 0.00 N ATOM 1928 CA SER B 36 21.647 23.709 12.626 1.00 0.00 C ATOM 1929 C SER B 36 22.565 23.852 11.419 1.00 0.00 C ATOM 1930 O SER B 36 22.418 24.776 10.619 1.00 0.00 O ATOM 1931 CB SER B 36 22.421 24.047 13.904 1.00 0.00 C ATOM 1932 OG SER B 36 22.769 25.425 13.888 1.00 0.00 O ATOM 0 H SER B 36 21.473 21.794 13.474 1.00 0.00 H new ATOM 0 HA SER B 36 20.812 24.402 12.520 1.00 0.00 H new ATOM 0 HB2 SER B 36 21.814 23.823 14.781 1.00 0.00 H new ATOM 0 HB3 SER B 36 23.319 23.433 13.973 1.00 0.00 H new ATOM 0 HG SER B 36 23.263 25.647 14.705 1.00 0.00 H new ATOM 1938 N VAL B 37 23.516 22.931 11.294 1.00 0.00 N ATOM 1939 CA VAL B 37 24.446 22.984 10.173 1.00 0.00 C ATOM 1940 C VAL B 37 23.717 22.686 8.855 1.00 0.00 C ATOM 1941 O VAL B 37 23.754 23.491 7.925 1.00 0.00 O ATOM 1942 CB VAL B 37 25.580 21.950 10.383 1.00 0.00 C ATOM 1943 CG1 VAL B 37 26.383 21.765 9.073 1.00 0.00 C ATOM 1944 CG2 VAL B 37 26.517 22.425 11.510 1.00 0.00 C ATOM 0 H VAL B 37 23.661 22.155 11.940 1.00 0.00 H new ATOM 0 HA VAL B 37 24.871 23.986 10.121 1.00 0.00 H new ATOM 0 HB VAL B 37 25.139 20.993 10.663 1.00 0.00 H new ATOM 0 HG11 VAL B 37 27.177 21.036 9.233 1.00 0.00 H new ATOM 0 HG12 VAL B 37 25.718 21.410 8.286 1.00 0.00 H new ATOM 0 HG13 VAL B 37 26.820 22.718 8.776 1.00 0.00 H new ATOM 0 HG21 VAL B 37 27.313 21.694 11.654 1.00 0.00 H new ATOM 0 HG22 VAL B 37 26.952 23.387 11.240 1.00 0.00 H new ATOM 0 HG23 VAL B 37 25.950 22.530 12.435 1.00 0.00 H new ATOM 1954 N VAL B 38 23.067 21.529 8.786 1.00 0.00 N ATOM 1955 CA VAL B 38 22.354 21.142 7.565 1.00 0.00 C ATOM 1956 C VAL B 38 21.473 22.294 7.076 1.00 0.00 C ATOM 1957 O VAL B 38 21.531 22.657 5.901 1.00 0.00 O ATOM 1958 CB VAL B 38 21.497 19.894 7.848 1.00 0.00 C ATOM 1959 CG1 VAL B 38 20.610 19.556 6.634 1.00 0.00 C ATOM 1960 CG2 VAL B 38 22.424 18.711 8.147 1.00 0.00 C ATOM 0 H VAL B 38 23.016 20.850 9.545 1.00 0.00 H new ATOM 0 HA VAL B 38 23.078 20.911 6.784 1.00 0.00 H new ATOM 0 HB VAL B 38 20.852 20.093 8.703 1.00 0.00 H new ATOM 0 HG11 VAL B 38 20.013 18.671 6.855 1.00 0.00 H new ATOM 0 HG12 VAL B 38 19.949 20.396 6.421 1.00 0.00 H new ATOM 0 HG13 VAL B 38 21.240 19.361 5.766 1.00 0.00 H new ATOM 0 HG21 VAL B 38 21.826 17.822 8.349 1.00 0.00 H new ATOM 0 HG22 VAL B 38 23.068 18.527 7.287 1.00 0.00 H new ATOM 0 HG23 VAL B 38 23.038 18.941 9.018 1.00 0.00 H new ATOM 1970 N SER B 39 20.674 22.865 7.972 1.00 0.00 N ATOM 1971 CA SER B 39 19.810 23.976 7.608 1.00 0.00 C ATOM 1972 C SER B 39 20.640 25.133 7.047 1.00 0.00 C ATOM 1973 O SER B 39 20.204 25.831 6.132 1.00 0.00 O ATOM 1974 CB SER B 39 19.028 24.443 8.838 1.00 0.00 C ATOM 1975 OG SER B 39 18.163 23.399 9.269 1.00 0.00 O ATOM 0 H SER B 39 20.609 22.577 8.948 1.00 0.00 H new ATOM 0 HA SER B 39 19.111 23.644 6.840 1.00 0.00 H new ATOM 0 HB2 SER B 39 19.716 24.715 9.639 1.00 0.00 H new ATOM 0 HB3 SER B 39 18.449 25.335 8.598 1.00 0.00 H new ATOM 0 HG SER B 39 18.668 22.761 9.815 1.00 0.00 H new ATOM 1981 N THR B 40 21.829 25.334 7.607 1.00 0.00 N ATOM 1982 CA THR B 40 22.714 26.410 7.151 1.00 0.00 C ATOM 1983 C THR B 40 23.300 26.101 5.773 1.00 0.00 C ATOM 1984 O THR B 40 23.249 26.929 4.863 1.00 0.00 O ATOM 1985 CB THR B 40 23.862 26.598 8.151 1.00 0.00 C ATOM 1986 OG1 THR B 40 23.336 26.744 9.462 1.00 0.00 O ATOM 1987 CG2 THR B 40 24.680 27.834 7.779 1.00 0.00 C ATOM 0 H THR B 40 22.203 24.773 8.372 1.00 0.00 H new ATOM 0 HA THR B 40 22.122 27.323 7.082 1.00 0.00 H new ATOM 0 HB THR B 40 24.510 25.722 8.120 1.00 0.00 H new ATOM 0 HG1 THR B 40 23.337 25.874 9.914 1.00 0.00 H new ATOM 0 HG21 THR B 40 25.493 27.961 8.494 1.00 0.00 H new ATOM 0 HG22 THR B 40 25.093 27.709 6.778 1.00 0.00 H new ATOM 0 HG23 THR B 40 24.038 28.715 7.800 1.00 0.00 H new ATOM 1995 N LEU B 41 23.852 24.901 5.629 1.00 0.00 N ATOM 1996 CA LEU B 41 24.460 24.491 4.363 1.00 0.00 C ATOM 1997 C LEU B 41 23.469 24.681 3.212 1.00 0.00 C ATOM 1998 O LEU B 41 23.853 25.065 2.107 1.00 0.00 O ATOM 1999 CB LEU B 41 24.885 23.023 4.448 1.00 0.00 C ATOM 2000 CG LEU B 41 25.977 22.824 5.518 1.00 0.00 C ATOM 2001 CD1 LEU B 41 26.239 21.323 5.674 1.00 0.00 C ATOM 2002 CD2 LEU B 41 27.292 23.536 5.119 1.00 0.00 C ATOM 0 H LEU B 41 23.892 24.197 6.366 1.00 0.00 H new ATOM 0 HA LEU B 41 25.337 25.110 4.174 1.00 0.00 H new ATOM 0 HB2 LEU B 41 24.020 22.404 4.687 1.00 0.00 H new ATOM 0 HB3 LEU B 41 25.257 22.692 3.478 1.00 0.00 H new ATOM 0 HG LEU B 41 25.632 23.256 6.457 1.00 0.00 H new ATOM 0 HD11 LEU B 41 27.010 21.165 6.428 1.00 0.00 H new ATOM 0 HD12 LEU B 41 25.321 20.824 5.983 1.00 0.00 H new ATOM 0 HD13 LEU B 41 26.573 20.911 4.722 1.00 0.00 H new ATOM 0 HD21 LEU B 41 28.042 23.377 5.894 1.00 0.00 H new ATOM 0 HD22 LEU B 41 27.654 23.129 4.175 1.00 0.00 H new ATOM 0 HD23 LEU B 41 27.108 24.604 5.007 1.00 0.00 H new ATOM 2014 N VAL B 42 22.195 24.422 3.486 1.00 0.00 N ATOM 2015 CA VAL B 42 21.140 24.582 2.473 1.00 0.00 C ATOM 2016 C VAL B 42 20.743 26.045 2.347 1.00 0.00 C ATOM 2017 O VAL B 42 20.480 26.537 1.249 1.00 0.00 O ATOM 2018 CB VAL B 42 19.915 23.737 2.843 1.00 0.00 C ATOM 2019 CG1 VAL B 42 18.806 23.916 1.791 1.00 0.00 C ATOM 2020 CG2 VAL B 42 20.337 22.265 2.901 1.00 0.00 C ATOM 0 H VAL B 42 21.862 24.101 4.395 1.00 0.00 H new ATOM 0 HA VAL B 42 21.528 24.240 1.514 1.00 0.00 H new ATOM 0 HB VAL B 42 19.529 24.057 3.811 1.00 0.00 H new ATOM 0 HG11 VAL B 42 17.942 23.311 2.066 1.00 0.00 H new ATOM 0 HG12 VAL B 42 18.514 24.965 1.745 1.00 0.00 H new ATOM 0 HG13 VAL B 42 19.175 23.599 0.816 1.00 0.00 H new ATOM 0 HG21 VAL B 42 19.476 21.650 3.163 1.00 0.00 H new ATOM 0 HG22 VAL B 42 20.720 21.958 1.928 1.00 0.00 H new ATOM 0 HG23 VAL B 42 21.116 22.139 3.653 1.00 0.00 H new ATOM 2030 N GLN B 43 20.694 26.737 3.480 1.00 0.00 N ATOM 2031 CA GLN B 43 20.316 28.153 3.517 1.00 0.00 C ATOM 2032 C GLN B 43 21.485 28.997 4.000 1.00 0.00 C ATOM 2033 O GLN B 43 21.529 29.434 5.151 1.00 0.00 O ATOM 2034 CB GLN B 43 19.108 28.356 4.446 1.00 0.00 C ATOM 2035 CG GLN B 43 18.614 29.806 4.344 1.00 0.00 C ATOM 2036 CD GLN B 43 17.362 30.002 5.195 1.00 0.00 C ATOM 2037 OE1 GLN B 43 17.408 29.853 6.416 1.00 0.00 O ATOM 2038 NE2 GLN B 43 16.240 30.334 4.618 1.00 0.00 N ATOM 0 H GLN B 43 20.912 26.340 4.394 1.00 0.00 H new ATOM 0 HA GLN B 43 20.045 28.466 2.509 1.00 0.00 H new ATOM 0 HB2 GLN B 43 18.307 27.669 4.172 1.00 0.00 H new ATOM 0 HB3 GLN B 43 19.386 28.128 5.475 1.00 0.00 H new ATOM 0 HG2 GLN B 43 19.397 30.488 4.675 1.00 0.00 H new ATOM 0 HG3 GLN B 43 18.397 30.051 3.304 1.00 0.00 H new ATOM 0 HE21 GLN B 43 16.204 30.457 3.606 1.00 0.00 H new ATOM 0 HE22 GLN B 43 15.399 30.471 5.179 1.00 0.00 H new ATOM 2047 N ASP B 44 22.430 29.240 3.098 1.00 0.00 N ATOM 2048 CA ASP B 44 23.613 30.063 3.421 1.00 0.00 C ATOM 2049 C ASP B 44 24.515 30.215 2.199 1.00 0.00 C ATOM 2050 O ASP B 44 24.649 31.294 1.623 1.00 0.00 O ATOM 2051 CB ASP B 44 24.444 29.434 4.557 1.00 0.00 C ATOM 2052 CG ASP B 44 25.527 30.408 5.019 1.00 0.00 C ATOM 2053 OD1 ASP B 44 25.191 31.551 5.278 1.00 0.00 O ATOM 2054 OD2 ASP B 44 26.666 29.988 5.138 1.00 0.00 O ATOM 0 H ASP B 44 22.410 28.886 2.141 1.00 0.00 H new ATOM 0 HA ASP B 44 23.243 31.038 3.739 1.00 0.00 H new ATOM 0 HB2 ASP B 44 23.794 29.177 5.394 1.00 0.00 H new ATOM 0 HB3 ASP B 44 24.901 28.507 4.212 1.00 0.00 H new ATOM 2059 N GLN B 45 25.146 29.108 1.820 1.00 0.00 N ATOM 2060 CA GLN B 45 26.056 29.105 0.668 1.00 0.00 C ATOM 2061 C GLN B 45 25.282 28.866 -0.625 1.00 0.00 C ATOM 2062 O GLN B 45 25.067 29.789 -1.411 1.00 0.00 O ATOM 2063 CB GLN B 45 27.111 28.003 0.850 1.00 0.00 C ATOM 2064 CG GLN B 45 28.096 27.992 -0.331 1.00 0.00 C ATOM 2065 CD GLN B 45 28.874 29.306 -0.378 1.00 0.00 C ATOM 2066 OE1 GLN B 45 29.242 29.836 0.671 1.00 0.00 O ATOM 2067 NE2 GLN B 45 29.133 29.873 -1.524 1.00 0.00 N ATOM 0 H GLN B 45 25.049 28.206 2.286 1.00 0.00 H new ATOM 0 HA GLN B 45 26.547 30.076 0.606 1.00 0.00 H new ATOM 0 HB2 GLN B 45 27.654 28.163 1.781 1.00 0.00 H new ATOM 0 HB3 GLN B 45 26.621 27.033 0.930 1.00 0.00 H new ATOM 0 HG2 GLN B 45 28.787 27.155 -0.231 1.00 0.00 H new ATOM 0 HG3 GLN B 45 27.554 27.848 -1.266 1.00 0.00 H new ATOM 0 HE21 GLN B 45 28.827 29.432 -2.392 1.00 0.00 H new ATOM 0 HE22 GLN B 45 29.641 30.757 -1.552 1.00 0.00 H new ATOM 2076 N LEU B 46 24.869 27.622 -0.839 1.00 0.00 N ATOM 2077 CA LEU B 46 24.125 27.257 -2.040 1.00 0.00 C ATOM 2078 C LEU B 46 25.041 27.332 -3.275 1.00 0.00 C ATOM 2079 O LEU B 46 24.642 27.837 -4.325 1.00 0.00 O ATOM 2080 CB LEU B 46 22.887 28.191 -2.186 1.00 0.00 C ATOM 2081 CG LEU B 46 21.673 27.434 -2.753 1.00 0.00 C ATOM 2082 CD1 LEU B 46 20.465 28.373 -2.793 1.00 0.00 C ATOM 2083 CD2 LEU B 46 21.975 26.940 -4.172 1.00 0.00 C ATOM 0 H LEU B 46 25.037 26.848 -0.196 1.00 0.00 H new ATOM 0 HA LEU B 46 23.770 26.230 -1.957 1.00 0.00 H new ATOM 0 HB2 LEU B 46 22.632 28.614 -1.214 1.00 0.00 H new ATOM 0 HB3 LEU B 46 23.135 29.026 -2.841 1.00 0.00 H new ATOM 0 HG LEU B 46 21.458 26.577 -2.114 1.00 0.00 H new ATOM 0 HD11 LEU B 46 19.603 27.840 -3.194 1.00 0.00 H new ATOM 0 HD12 LEU B 46 20.240 28.720 -1.784 1.00 0.00 H new ATOM 0 HD13 LEU B 46 20.690 29.229 -3.429 1.00 0.00 H new ATOM 0 HD21 LEU B 46 21.109 26.406 -4.563 1.00 0.00 H new ATOM 0 HD22 LEU B 46 22.196 27.792 -4.815 1.00 0.00 H new ATOM 0 HD23 LEU B 46 22.835 26.270 -4.149 1.00 0.00 H new ATOM 2095 N THR B 47 26.258 26.818 -3.136 1.00 0.00 N ATOM 2096 CA THR B 47 27.222 26.828 -4.248 1.00 0.00 C ATOM 2097 C THR B 47 26.937 25.684 -5.212 1.00 0.00 C ATOM 2098 O THR B 47 27.246 25.757 -6.401 1.00 0.00 O ATOM 2099 CB THR B 47 28.662 26.700 -3.721 1.00 0.00 C ATOM 2100 OG1 THR B 47 29.548 26.502 -4.815 1.00 0.00 O ATOM 2101 CG2 THR B 47 28.778 25.506 -2.772 1.00 0.00 C ATOM 0 H THR B 47 26.605 26.392 -2.277 1.00 0.00 H new ATOM 0 HA THR B 47 27.116 27.777 -4.773 1.00 0.00 H new ATOM 0 HB THR B 47 28.920 27.613 -3.185 1.00 0.00 H new ATOM 0 HG1 THR B 47 30.466 26.422 -4.482 1.00 0.00 H new ATOM 0 HG21 THR B 47 29.802 25.429 -2.408 1.00 0.00 H new ATOM 0 HG22 THR B 47 28.102 25.645 -1.928 1.00 0.00 H new ATOM 0 HG23 THR B 47 28.512 24.592 -3.303 1.00 0.00 H new ATOM 2109 N LYS B 48 26.353 24.615 -4.680 1.00 0.00 N ATOM 2110 CA LYS B 48 26.029 23.439 -5.496 1.00 0.00 C ATOM 2111 C LYS B 48 25.337 22.367 -4.653 1.00 0.00 C ATOM 2112 O LYS B 48 25.655 22.205 -3.475 1.00 0.00 O ATOM 2113 CB LYS B 48 27.309 22.838 -6.101 1.00 0.00 C ATOM 2114 CG LYS B 48 26.939 21.732 -7.087 1.00 0.00 C ATOM 2115 CD LYS B 48 28.201 21.242 -7.793 1.00 0.00 C ATOM 2116 CE LYS B 48 27.831 20.170 -8.815 1.00 0.00 C ATOM 2117 NZ LYS B 48 29.070 19.700 -9.497 1.00 0.00 N ATOM 0 H LYS B 48 26.094 24.534 -3.697 1.00 0.00 H new ATOM 0 HA LYS B 48 25.359 23.763 -6.292 1.00 0.00 H new ATOM 0 HB2 LYS B 48 27.883 23.614 -6.608 1.00 0.00 H new ATOM 0 HB3 LYS B 48 27.944 22.437 -5.311 1.00 0.00 H new ATOM 0 HG2 LYS B 48 26.459 20.907 -6.562 1.00 0.00 H new ATOM 0 HG3 LYS B 48 26.222 22.105 -7.818 1.00 0.00 H new ATOM 0 HD2 LYS B 48 28.700 22.075 -8.289 1.00 0.00 H new ATOM 0 HD3 LYS B 48 28.904 20.838 -7.065 1.00 0.00 H new ATOM 0 HE2 LYS B 48 27.333 19.335 -8.321 1.00 0.00 H new ATOM 0 HE3 LYS B 48 27.129 20.573 -9.545 1.00 0.00 H new ATOM 0 HZ1 LYS B 48 28.826 18.969 -10.195 1.00 0.00 H new ATOM 0 HZ2 LYS B 48 29.526 20.501 -9.979 1.00 0.00 H new ATOM 0 HZ3 LYS B 48 29.724 19.302 -8.793 1.00 0.00 H new ATOM 2131 N ASN B 49 24.410 21.634 -5.261 1.00 0.00 N ATOM 2132 CA ASN B 49 23.700 20.575 -4.547 1.00 0.00 C ATOM 2133 C ASN B 49 24.667 19.467 -4.127 1.00 0.00 C ATOM 2134 O ASN B 49 24.626 18.983 -2.996 1.00 0.00 O ATOM 2135 CB ASN B 49 22.604 19.974 -5.435 1.00 0.00 C ATOM 2136 CG ASN B 49 23.222 19.389 -6.700 1.00 0.00 C ATOM 2137 OD1 ASN B 49 23.957 20.078 -7.407 1.00 0.00 O ATOM 2138 ND2 ASN B 49 22.963 18.154 -7.033 1.00 0.00 N ATOM 0 H ASN B 49 24.134 21.750 -6.236 1.00 0.00 H new ATOM 0 HA ASN B 49 23.248 21.014 -3.658 1.00 0.00 H new ATOM 0 HB2 ASN B 49 22.067 19.198 -4.890 1.00 0.00 H new ATOM 0 HB3 ASN B 49 21.875 20.741 -5.697 1.00 0.00 H new ATOM 0 HD21 ASN B 49 23.370 17.758 -7.880 1.00 0.00 H new ATOM 0 HD22 ASN B 49 22.354 17.585 -6.446 1.00 0.00 H new ATOM 2145 N ALA B 50 25.534 19.070 -5.053 1.00 0.00 N ATOM 2146 CA ALA B 50 26.499 18.016 -4.755 1.00 0.00 C ATOM 2147 C ALA B 50 27.397 18.416 -3.582 1.00 0.00 C ATOM 2148 O ALA B 50 27.719 17.590 -2.728 1.00 0.00 O ATOM 2149 CB ALA B 50 27.371 17.725 -5.981 1.00 0.00 C ATOM 0 H ALA B 50 25.590 19.452 -5.997 1.00 0.00 H new ATOM 0 HA ALA B 50 25.940 17.120 -4.486 1.00 0.00 H new ATOM 0 HB1 ALA B 50 28.085 16.937 -5.741 1.00 0.00 H new ATOM 0 HB2 ALA B 50 26.739 17.403 -6.809 1.00 0.00 H new ATOM 0 HB3 ALA B 50 27.910 18.628 -6.267 1.00 0.00 H new ATOM 2155 N VAL B 51 27.798 19.683 -3.550 1.00 0.00 N ATOM 2156 CA VAL B 51 28.679 20.142 -2.470 1.00 0.00 C ATOM 2157 C VAL B 51 28.033 19.904 -1.101 1.00 0.00 C ATOM 2158 O VAL B 51 28.561 19.146 -0.287 1.00 0.00 O ATOM 2159 CB VAL B 51 28.971 21.657 -2.666 1.00 0.00 C ATOM 2160 CG1 VAL B 51 29.479 22.305 -1.354 1.00 0.00 C ATOM 2161 CG2 VAL B 51 30.031 21.846 -3.775 1.00 0.00 C ATOM 0 H VAL B 51 27.540 20.394 -4.234 1.00 0.00 H new ATOM 0 HA VAL B 51 29.610 19.577 -2.505 1.00 0.00 H new ATOM 0 HB VAL B 51 28.040 22.146 -2.954 1.00 0.00 H new ATOM 0 HG11 VAL B 51 29.674 23.364 -1.523 1.00 0.00 H new ATOM 0 HG12 VAL B 51 28.722 22.195 -0.577 1.00 0.00 H new ATOM 0 HG13 VAL B 51 30.398 21.813 -1.037 1.00 0.00 H new ATOM 0 HG21 VAL B 51 30.232 22.909 -3.909 1.00 0.00 H new ATOM 0 HG22 VAL B 51 30.951 21.336 -3.490 1.00 0.00 H new ATOM 0 HG23 VAL B 51 29.658 21.427 -4.710 1.00 0.00 H new ATOM 2171 N VAL B 52 26.893 20.544 -0.861 1.00 0.00 N ATOM 2172 CA VAL B 52 26.213 20.376 0.413 1.00 0.00 C ATOM 2173 C VAL B 52 25.969 18.889 0.702 1.00 0.00 C ATOM 2174 O VAL B 52 26.000 18.460 1.856 1.00 0.00 O ATOM 2175 CB VAL B 52 24.876 21.136 0.394 1.00 0.00 C ATOM 2176 CG1 VAL B 52 25.130 22.641 0.302 1.00 0.00 C ATOM 2177 CG2 VAL B 52 24.061 20.710 -0.825 1.00 0.00 C ATOM 0 H VAL B 52 26.430 21.171 -1.519 1.00 0.00 H new ATOM 0 HA VAL B 52 26.845 20.781 1.203 1.00 0.00 H new ATOM 0 HB VAL B 52 24.332 20.907 1.311 1.00 0.00 H new ATOM 0 HG11 VAL B 52 24.177 23.171 0.289 1.00 0.00 H new ATOM 0 HG12 VAL B 52 25.714 22.965 1.164 1.00 0.00 H new ATOM 0 HG13 VAL B 52 25.680 22.862 -0.613 1.00 0.00 H new ATOM 0 HG21 VAL B 52 23.114 21.250 -0.836 1.00 0.00 H new ATOM 0 HG22 VAL B 52 24.619 20.937 -1.733 1.00 0.00 H new ATOM 0 HG23 VAL B 52 23.867 19.638 -0.777 1.00 0.00 H new ATOM 2187 N LEU B 53 25.725 18.117 -0.351 1.00 0.00 N ATOM 2188 CA LEU B 53 25.456 16.693 -0.174 1.00 0.00 C ATOM 2189 C LEU B 53 26.609 16.013 0.569 1.00 0.00 C ATOM 2190 O LEU B 53 26.414 15.469 1.656 1.00 0.00 O ATOM 2191 CB LEU B 53 25.256 16.033 -1.563 1.00 0.00 C ATOM 2192 CG LEU B 53 24.320 14.807 -1.476 1.00 0.00 C ATOM 2193 CD1 LEU B 53 24.856 13.815 -0.429 1.00 0.00 C ATOM 2194 CD2 LEU B 53 22.870 15.242 -1.116 1.00 0.00 C ATOM 0 H LEU B 53 25.707 18.443 -1.317 1.00 0.00 H new ATOM 0 HA LEU B 53 24.551 16.575 0.421 1.00 0.00 H new ATOM 0 HB2 LEU B 53 24.839 16.762 -2.257 1.00 0.00 H new ATOM 0 HB3 LEU B 53 26.222 15.727 -1.965 1.00 0.00 H new ATOM 0 HG LEU B 53 24.295 14.319 -2.450 1.00 0.00 H new ATOM 0 HD11 LEU B 53 24.192 12.952 -0.372 1.00 0.00 H new ATOM 0 HD12 LEU B 53 25.854 13.486 -0.717 1.00 0.00 H new ATOM 0 HD13 LEU B 53 24.902 14.303 0.545 1.00 0.00 H new ATOM 0 HD21 LEU B 53 22.229 14.362 -1.060 1.00 0.00 H new ATOM 0 HD22 LEU B 53 22.872 15.751 -0.152 1.00 0.00 H new ATOM 0 HD23 LEU B 53 22.492 15.918 -1.883 1.00 0.00 H new ATOM 2206 N LYS B 54 27.803 16.058 -0.014 1.00 0.00 N ATOM 2207 CA LYS B 54 28.966 15.430 0.616 1.00 0.00 C ATOM 2208 C LYS B 54 29.192 16.026 2.000 1.00 0.00 C ATOM 2209 O LYS B 54 29.601 15.325 2.926 1.00 0.00 O ATOM 2210 CB LYS B 54 30.223 15.620 -0.261 1.00 0.00 C ATOM 2211 CG LYS B 54 30.336 17.096 -0.649 1.00 0.00 C ATOM 2212 CD LYS B 54 31.607 17.413 -1.441 1.00 0.00 C ATOM 2213 CE LYS B 54 31.623 16.679 -2.785 1.00 0.00 C ATOM 2214 NZ LYS B 54 32.653 17.305 -3.665 1.00 0.00 N ATOM 0 H LYS B 54 27.993 16.514 -0.907 1.00 0.00 H new ATOM 0 HA LYS B 54 28.776 14.362 0.718 1.00 0.00 H new ATOM 0 HB2 LYS B 54 31.113 15.303 0.282 1.00 0.00 H new ATOM 0 HB3 LYS B 54 30.157 14.999 -1.154 1.00 0.00 H new ATOM 0 HG2 LYS B 54 29.466 17.377 -1.242 1.00 0.00 H new ATOM 0 HG3 LYS B 54 30.316 17.706 0.254 1.00 0.00 H new ATOM 0 HD2 LYS B 54 31.674 18.488 -1.610 1.00 0.00 H new ATOM 0 HD3 LYS B 54 32.482 17.127 -0.858 1.00 0.00 H new ATOM 0 HE2 LYS B 54 31.847 15.623 -2.635 1.00 0.00 H new ATOM 0 HE3 LYS B 54 30.641 16.733 -3.256 1.00 0.00 H new ATOM 0 HZ1 LYS B 54 32.672 16.813 -4.581 1.00 0.00 H new ATOM 0 HZ2 LYS B 54 32.419 18.307 -3.815 1.00 0.00 H new ATOM 0 HZ3 LYS B 54 33.587 17.231 -3.213 1.00 0.00 H new ATOM 2228 N ARG B 55 28.925 17.320 2.136 1.00 0.00 N ATOM 2229 CA ARG B 55 29.102 18.006 3.404 1.00 0.00 C ATOM 2230 C ARG B 55 28.167 17.415 4.454 1.00 0.00 C ATOM 2231 O ARG B 55 28.526 17.320 5.628 1.00 0.00 O ATOM 2232 CB ARG B 55 28.832 19.508 3.235 1.00 0.00 C ATOM 2233 CG ARG B 55 29.255 20.281 4.498 1.00 0.00 C ATOM 2234 CD ARG B 55 30.780 20.186 4.738 1.00 0.00 C ATOM 2235 NE ARG B 55 31.258 21.385 5.422 1.00 0.00 N ATOM 2236 CZ ARG B 55 31.315 22.557 4.799 1.00 0.00 C ATOM 2237 NH1 ARG B 55 30.916 22.658 3.560 1.00 0.00 N ATOM 2238 NH2 ARG B 55 31.769 23.608 5.425 1.00 0.00 N ATOM 0 H ARG B 55 28.584 17.914 1.380 1.00 0.00 H new ATOM 0 HA ARG B 55 30.131 17.872 3.737 1.00 0.00 H new ATOM 0 HB2 ARG B 55 29.378 19.886 2.371 1.00 0.00 H new ATOM 0 HB3 ARG B 55 27.772 19.673 3.039 1.00 0.00 H new ATOM 0 HG2 ARG B 55 28.966 21.327 4.399 1.00 0.00 H new ATOM 0 HG3 ARG B 55 28.724 19.884 5.363 1.00 0.00 H new ATOM 0 HD2 ARG B 55 31.007 19.303 5.335 1.00 0.00 H new ATOM 0 HD3 ARG B 55 31.299 20.070 3.786 1.00 0.00 H new ATOM 0 HE ARG B 55 31.554 21.321 6.396 1.00 0.00 H new ATOM 0 HH11 ARG B 55 30.560 21.837 3.070 1.00 0.00 H new ATOM 0 HH12 ARG B 55 30.960 23.558 3.082 1.00 0.00 H new ATOM 0 HH21 ARG B 55 32.080 23.530 6.393 1.00 0.00 H new ATOM 0 HH22 ARG B 55 31.813 24.508 4.946 1.00 0.00 H new ATOM 2252 N ILE B 56 26.972 17.021 4.028 1.00 0.00 N ATOM 2253 CA ILE B 56 26.000 16.430 4.942 1.00 0.00 C ATOM 2254 C ILE B 56 26.441 15.033 5.359 1.00 0.00 C ATOM 2255 O ILE B 56 26.392 14.687 6.540 1.00 0.00 O ATOM 2256 CB ILE B 56 24.615 16.378 4.264 1.00 0.00 C ATOM 2257 CG1 ILE B 56 24.074 17.810 4.102 1.00 0.00 C ATOM 2258 CG2 ILE B 56 23.626 15.551 5.110 1.00 0.00 C ATOM 2259 CD1 ILE B 56 22.876 17.796 3.162 1.00 0.00 C ATOM 0 H ILE B 56 26.654 17.099 3.062 1.00 0.00 H new ATOM 0 HA ILE B 56 25.934 17.047 5.838 1.00 0.00 H new ATOM 0 HB ILE B 56 24.720 15.905 3.288 1.00 0.00 H new ATOM 0 HG12 ILE B 56 23.784 18.213 5.072 1.00 0.00 H new ATOM 0 HG13 ILE B 56 24.853 18.462 3.706 1.00 0.00 H new ATOM 0 HG21 ILE B 56 22.655 15.527 4.615 1.00 0.00 H new ATOM 0 HG22 ILE B 56 24.003 14.534 5.220 1.00 0.00 H new ATOM 0 HG23 ILE B 56 23.520 16.007 6.094 1.00 0.00 H new ATOM 0 HD11 ILE B 56 22.492 18.810 3.047 1.00 0.00 H new ATOM 0 HD12 ILE B 56 23.181 17.411 2.189 1.00 0.00 H new ATOM 0 HD13 ILE B 56 22.096 17.158 3.576 1.00 0.00 H new ATOM 2271 N GLN B 57 26.862 14.231 4.387 1.00 0.00 N ATOM 2272 CA GLN B 57 27.303 12.870 4.651 1.00 0.00 C ATOM 2273 C GLN B 57 28.399 12.870 5.704 1.00 0.00 C ATOM 2274 O GLN B 57 28.592 11.879 6.409 1.00 0.00 O ATOM 2275 CB GLN B 57 27.825 12.229 3.359 1.00 0.00 C ATOM 2276 CG GLN B 57 26.672 12.072 2.367 1.00 0.00 C ATOM 2277 CD GLN B 57 27.197 11.517 1.051 1.00 0.00 C ATOM 2278 OE1 GLN B 57 28.321 11.826 0.654 1.00 0.00 O ATOM 2279 NE2 GLN B 57 26.451 10.712 0.345 1.00 0.00 N ATOM 0 H GLN B 57 26.906 14.504 3.405 1.00 0.00 H new ATOM 0 HA GLN B 57 26.456 12.292 5.021 1.00 0.00 H new ATOM 0 HB2 GLN B 57 28.611 12.847 2.925 1.00 0.00 H new ATOM 0 HB3 GLN B 57 28.268 11.257 3.576 1.00 0.00 H new ATOM 0 HG2 GLN B 57 25.915 11.404 2.778 1.00 0.00 H new ATOM 0 HG3 GLN B 57 26.190 13.035 2.200 1.00 0.00 H new ATOM 0 HE21 GLN B 57 25.520 10.457 0.676 1.00 0.00 H new ATOM 0 HE22 GLN B 57 26.799 10.337 -0.538 1.00 0.00 H new ATOM 2288 N HIS B 58 29.113 13.985 5.811 1.00 0.00 N ATOM 2289 CA HIS B 58 30.186 14.097 6.789 1.00 0.00 C ATOM 2290 C HIS B 58 29.610 14.159 8.197 1.00 0.00 C ATOM 2291 O HIS B 58 30.105 13.497 9.109 1.00 0.00 O ATOM 2292 CB HIS B 58 31.028 15.353 6.523 1.00 0.00 C ATOM 2293 CG HIS B 58 31.672 15.251 5.164 1.00 0.00 C ATOM 2294 ND1 HIS B 58 31.683 14.237 4.238 1.00 0.00 N flip ATOM 2295 CD2 HIS B 58 32.425 16.275 4.612 1.00 0.00 C flip ATOM 2296 CE1 HIS B 58 32.430 14.624 3.129 1.00 0.00 C flip ATOM 2297 NE2 HIS B 58 32.854 15.859 3.406 1.00 0.00 N flip ATOM 0 H HIS B 58 28.970 14.816 5.238 1.00 0.00 H new ATOM 0 HA HIS B 58 30.824 13.217 6.699 1.00 0.00 H new ATOM 0 HB2 HIS B 58 30.399 16.242 6.573 1.00 0.00 H new ATOM 0 HB3 HIS B 58 31.793 15.460 7.292 1.00 0.00 H new ATOM 0 HD2 HIS B 58 32.630 17.233 5.067 1.00 0.00 H new ATOM 0 HE1 HIS B 58 32.625 14.049 2.236 1.00 0.00 H new ATOM 0 HE2 HIS B 58 33.433 16.419 2.780 1.00 0.00 H new ATOM 2306 N LEU B 59 28.569 14.966 8.371 1.00 0.00 N ATOM 2307 CA LEU B 59 27.949 15.107 9.695 1.00 0.00 C ATOM 2308 C LEU B 59 27.612 13.731 10.282 1.00 0.00 C ATOM 2309 O LEU B 59 27.450 13.593 11.495 1.00 0.00 O ATOM 2310 CB LEU B 59 26.673 15.991 9.594 1.00 0.00 C ATOM 2311 CG LEU B 59 26.831 17.310 10.387 1.00 0.00 C ATOM 2312 CD1 LEU B 59 26.969 17.021 11.914 1.00 0.00 C ATOM 2313 CD2 LEU B 59 28.054 18.101 9.856 1.00 0.00 C ATOM 0 H LEU B 59 28.140 15.524 7.633 1.00 0.00 H new ATOM 0 HA LEU B 59 28.658 15.595 10.364 1.00 0.00 H new ATOM 0 HB2 LEU B 59 26.468 16.217 8.548 1.00 0.00 H new ATOM 0 HB3 LEU B 59 25.815 15.437 9.975 1.00 0.00 H new ATOM 0 HG LEU B 59 25.938 17.918 10.245 1.00 0.00 H new ATOM 0 HD11 LEU B 59 27.079 17.962 12.454 1.00 0.00 H new ATOM 0 HD12 LEU B 59 26.078 16.502 12.268 1.00 0.00 H new ATOM 0 HD13 LEU B 59 27.846 16.398 12.089 1.00 0.00 H new ATOM 0 HD21 LEU B 59 28.160 19.029 10.419 1.00 0.00 H new ATOM 0 HD22 LEU B 59 28.956 17.500 9.975 1.00 0.00 H new ATOM 0 HD23 LEU B 59 27.908 18.331 8.801 1.00 0.00 H new ATOM 2325 N ASP B 60 27.506 12.727 9.418 1.00 0.00 N ATOM 2326 CA ASP B 60 27.178 11.390 9.892 1.00 0.00 C ATOM 2327 C ASP B 60 28.235 10.909 10.887 1.00 0.00 C ATOM 2328 O ASP B 60 27.898 10.356 11.934 1.00 0.00 O ATOM 2329 CB ASP B 60 27.088 10.404 8.718 1.00 0.00 C ATOM 2330 CG ASP B 60 25.975 10.828 7.762 1.00 0.00 C ATOM 2331 OD1 ASP B 60 25.101 11.561 8.194 1.00 0.00 O ATOM 2332 OD2 ASP B 60 26.022 10.427 6.611 1.00 0.00 O ATOM 0 H ASP B 60 27.639 12.810 8.410 1.00 0.00 H new ATOM 0 HA ASP B 60 26.209 11.433 10.388 1.00 0.00 H new ATOM 0 HB2 ASP B 60 28.040 10.369 8.188 1.00 0.00 H new ATOM 0 HB3 ASP B 60 26.894 9.398 9.091 1.00 0.00 H new ATOM 2337 N GLU B 61 29.504 11.108 10.550 1.00 0.00 N ATOM 2338 CA GLU B 61 30.603 10.689 11.420 1.00 0.00 C ATOM 2339 C GLU B 61 30.557 11.445 12.750 1.00 0.00 C ATOM 2340 O GLU B 61 30.858 10.890 13.807 1.00 0.00 O ATOM 2341 CB GLU B 61 31.959 10.929 10.702 1.00 0.00 C ATOM 2342 CG GLU B 61 32.435 12.395 10.855 1.00 0.00 C ATOM 2343 CD GLU B 61 33.540 12.710 9.846 1.00 0.00 C ATOM 2344 OE1 GLU B 61 33.233 12.796 8.668 1.00 0.00 O ATOM 2345 OE2 GLU B 61 34.670 12.885 10.271 1.00 0.00 O ATOM 0 H GLU B 61 29.800 11.556 9.683 1.00 0.00 H new ATOM 0 HA GLU B 61 30.498 9.625 11.634 1.00 0.00 H new ATOM 0 HB2 GLU B 61 32.712 10.257 11.113 1.00 0.00 H new ATOM 0 HB3 GLU B 61 31.859 10.687 9.644 1.00 0.00 H new ATOM 0 HG2 GLU B 61 31.595 13.073 10.706 1.00 0.00 H new ATOM 0 HG3 GLU B 61 32.802 12.560 11.868 1.00 0.00 H new ATOM 2352 N ALA B 62 30.193 12.722 12.682 1.00 0.00 N ATOM 2353 CA ALA B 62 30.113 13.552 13.873 1.00 0.00 C ATOM 2354 C ALA B 62 28.908 13.166 14.726 1.00 0.00 C ATOM 2355 O ALA B 62 29.051 12.884 15.915 1.00 0.00 O ATOM 2356 CB ALA B 62 30.012 15.017 13.459 1.00 0.00 C ATOM 0 H ALA B 62 29.950 13.201 11.815 1.00 0.00 H new ATOM 0 HA ALA B 62 31.012 13.399 14.470 1.00 0.00 H new ATOM 0 HB1 ALA B 62 29.952 15.643 14.349 1.00 0.00 H new ATOM 0 HB2 ALA B 62 30.893 15.293 12.880 1.00 0.00 H new ATOM 0 HB3 ALA B 62 29.119 15.163 12.852 1.00 0.00 H new ATOM 2362 N TYR B 63 27.727 13.153 14.116 1.00 0.00 N ATOM 2363 CA TYR B 63 26.494 12.801 14.820 1.00 0.00 C ATOM 2364 C TYR B 63 26.699 11.487 15.609 1.00 0.00 C ATOM 2365 O TYR B 63 26.179 11.320 16.712 1.00 0.00 O ATOM 2366 CB TYR B 63 25.322 12.662 13.783 1.00 0.00 C ATOM 2367 CG TYR B 63 24.452 11.457 14.111 1.00 0.00 C ATOM 2368 CD1 TYR B 63 24.849 10.193 13.659 1.00 0.00 C ATOM 2369 CD2 TYR B 63 23.300 11.590 14.896 1.00 0.00 C ATOM 2370 CE1 TYR B 63 24.094 9.062 13.992 1.00 0.00 C ATOM 2371 CE2 TYR B 63 22.546 10.459 15.229 1.00 0.00 C ATOM 2372 CZ TYR B 63 22.943 9.195 14.777 1.00 0.00 C ATOM 2373 OH TYR B 63 22.199 8.082 15.112 1.00 0.00 O ATOM 0 H TYR B 63 27.595 13.383 13.131 1.00 0.00 H new ATOM 0 HA TYR B 63 26.236 13.586 15.530 1.00 0.00 H new ATOM 0 HB2 TYR B 63 24.715 13.567 13.790 1.00 0.00 H new ATOM 0 HB3 TYR B 63 25.730 12.559 12.778 1.00 0.00 H new ATOM 0 HD1 TYR B 63 25.737 10.090 13.054 1.00 0.00 H new ATOM 0 HD2 TYR B 63 22.993 12.565 15.244 1.00 0.00 H new ATOM 0 HE1 TYR B 63 24.400 8.087 13.643 1.00 0.00 H new ATOM 0 HE2 TYR B 63 21.658 10.561 15.835 1.00 0.00 H new ATOM 0 HH TYR B 63 22.723 7.273 14.935 1.00 0.00 H new ATOM 2383 N ASN B 64 27.446 10.563 15.013 1.00 0.00 N ATOM 2384 CA ASN B 64 27.710 9.271 15.640 1.00 0.00 C ATOM 2385 C ASN B 64 28.544 9.447 16.903 1.00 0.00 C ATOM 2386 O ASN B 64 28.346 8.744 17.894 1.00 0.00 O ATOM 2387 CB ASN B 64 28.447 8.358 14.657 1.00 0.00 C ATOM 2388 CG ASN B 64 28.723 7.003 15.302 1.00 0.00 C ATOM 2389 OD1 ASN B 64 29.829 6.754 15.782 1.00 0.00 O ATOM 2390 ND2 ASN B 64 27.770 6.114 15.356 1.00 0.00 N ATOM 0 H ASN B 64 27.879 10.684 14.098 1.00 0.00 H new ATOM 0 HA ASN B 64 26.757 8.817 15.913 1.00 0.00 H new ATOM 0 HB2 ASN B 64 27.849 8.225 13.755 1.00 0.00 H new ATOM 0 HB3 ASN B 64 29.385 8.822 14.352 1.00 0.00 H new ATOM 0 HD21 ASN B 64 27.940 5.210 15.797 1.00 0.00 H new ATOM 0 HD22 ASN B 64 26.855 6.323 14.958 1.00 0.00 H new ATOM 2397 N LYS B 65 29.481 10.389 16.860 1.00 0.00 N ATOM 2398 CA LYS B 65 30.337 10.636 18.009 1.00 0.00 C ATOM 2399 C LYS B 65 29.498 10.928 19.257 1.00 0.00 C ATOM 2400 O LYS B 65 29.826 10.486 20.358 1.00 0.00 O ATOM 2401 CB LYS B 65 31.257 11.840 17.728 1.00 0.00 C ATOM 2402 CG LYS B 65 32.435 11.865 18.743 1.00 0.00 C ATOM 2403 CD LYS B 65 33.628 11.061 18.203 1.00 0.00 C ATOM 2404 CE LYS B 65 34.744 11.065 19.242 1.00 0.00 C ATOM 2405 NZ LYS B 65 34.266 10.369 20.468 1.00 0.00 N ATOM 0 H LYS B 65 29.664 10.985 16.053 1.00 0.00 H new ATOM 0 HA LYS B 65 30.937 9.743 18.185 1.00 0.00 H new ATOM 0 HB2 LYS B 65 31.645 11.781 16.711 1.00 0.00 H new ATOM 0 HB3 LYS B 65 30.687 12.767 17.798 1.00 0.00 H new ATOM 0 HG2 LYS B 65 32.738 12.895 18.932 1.00 0.00 H new ATOM 0 HG3 LYS B 65 32.110 11.449 19.697 1.00 0.00 H new ATOM 0 HD2 LYS B 65 33.323 10.038 17.983 1.00 0.00 H new ATOM 0 HD3 LYS B 65 33.983 11.496 17.269 1.00 0.00 H new ATOM 0 HE2 LYS B 65 35.629 10.566 18.846 1.00 0.00 H new ATOM 0 HE3 LYS B 65 35.034 12.089 19.479 1.00 0.00 H new ATOM 0 HZ1 LYS B 65 35.083 10.051 21.028 1.00 0.00 H new ATOM 0 HZ2 LYS B 65 33.690 11.023 21.036 1.00 0.00 H new ATOM 0 HZ3 LYS B 65 33.690 9.546 20.198 1.00 0.00 H new ATOM 2419 N VAL B 66 28.419 11.680 19.071 1.00 0.00 N ATOM 2420 CA VAL B 66 27.544 12.042 20.178 1.00 0.00 C ATOM 2421 C VAL B 66 26.851 10.813 20.731 1.00 0.00 C ATOM 2422 O VAL B 66 26.660 10.663 21.938 1.00 0.00 O ATOM 2423 CB VAL B 66 26.514 13.076 19.710 1.00 0.00 C ATOM 2424 CG1 VAL B 66 25.572 13.442 20.868 1.00 0.00 C ATOM 2425 CG2 VAL B 66 27.255 14.328 19.243 1.00 0.00 C ATOM 0 H VAL B 66 28.130 12.050 18.165 1.00 0.00 H new ATOM 0 HA VAL B 66 28.145 12.480 20.975 1.00 0.00 H new ATOM 0 HB VAL B 66 25.924 12.661 18.893 1.00 0.00 H new ATOM 0 HG11 VAL B 66 24.844 14.177 20.526 1.00 0.00 H new ATOM 0 HG12 VAL B 66 25.051 12.548 21.210 1.00 0.00 H new ATOM 0 HG13 VAL B 66 26.152 13.861 21.690 1.00 0.00 H new ATOM 0 HG21 VAL B 66 26.534 15.073 18.907 1.00 0.00 H new ATOM 0 HG22 VAL B 66 27.839 14.735 20.069 1.00 0.00 H new ATOM 0 HG23 VAL B 66 27.921 14.071 18.420 1.00 0.00 H new ATOM 2435 N LYS B 67 26.456 9.930 19.820 1.00 0.00 N ATOM 2436 CA LYS B 67 25.758 8.714 20.181 1.00 0.00 C ATOM 2437 C LYS B 67 26.646 7.809 20.998 1.00 0.00 C ATOM 2438 O LYS B 67 26.248 7.283 22.038 1.00 0.00 O ATOM 2439 CB LYS B 67 25.365 8.028 18.894 1.00 0.00 C ATOM 2440 CG LYS B 67 24.483 8.994 18.059 1.00 0.00 C ATOM 2441 CD LYS B 67 22.987 8.852 18.411 1.00 0.00 C ATOM 2442 CE LYS B 67 22.424 7.463 18.006 1.00 0.00 C ATOM 2443 NZ LYS B 67 21.015 7.630 17.526 1.00 0.00 N ATOM 0 H LYS B 67 26.612 10.041 18.818 1.00 0.00 H new ATOM 0 HA LYS B 67 24.882 8.946 20.786 1.00 0.00 H new ATOM 0 HB2 LYS B 67 26.254 7.747 18.330 1.00 0.00 H new ATOM 0 HB3 LYS B 67 24.819 7.109 19.108 1.00 0.00 H new ATOM 0 HG2 LYS B 67 24.802 10.021 18.235 1.00 0.00 H new ATOM 0 HG3 LYS B 67 24.628 8.793 16.998 1.00 0.00 H new ATOM 0 HD2 LYS B 67 22.851 9.000 19.482 1.00 0.00 H new ATOM 0 HD3 LYS B 67 22.420 9.634 17.906 1.00 0.00 H new ATOM 0 HE2 LYS B 67 23.039 7.021 17.222 1.00 0.00 H new ATOM 0 HE3 LYS B 67 22.454 6.782 18.856 1.00 0.00 H new ATOM 0 HZ1 LYS B 67 20.487 6.748 17.685 1.00 0.00 H new ATOM 0 HZ2 LYS B 67 20.560 8.405 18.049 1.00 0.00 H new ATOM 0 HZ3 LYS B 67 21.018 7.853 16.510 1.00 0.00 H new ATOM 2457 N ARG B 68 27.875 7.634 20.524 1.00 0.00 N ATOM 2458 CA ARG B 68 28.852 6.793 21.211 1.00 0.00 C ATOM 2459 C ARG B 68 29.592 7.602 22.281 1.00 0.00 C ATOM 2460 O ARG B 68 30.293 7.038 23.121 1.00 0.00 O ATOM 2461 CB ARG B 68 29.844 6.246 20.162 1.00 0.00 C ATOM 2462 CG ARG B 68 29.297 4.960 19.481 1.00 0.00 C ATOM 2463 CD ARG B 68 29.600 3.710 20.328 1.00 0.00 C ATOM 2464 NE ARG B 68 31.034 3.453 20.331 1.00 0.00 N ATOM 2465 CZ ARG B 68 31.560 2.449 21.026 1.00 0.00 C ATOM 2466 NH1 ARG B 68 30.790 1.681 21.747 1.00 0.00 N ATOM 2467 NH2 ARG B 68 32.846 2.232 20.987 1.00 0.00 N ATOM 0 H ARG B 68 28.220 8.064 19.666 1.00 0.00 H new ATOM 0 HA ARG B 68 28.348 5.965 21.709 1.00 0.00 H new ATOM 0 HB2 ARG B 68 30.033 7.008 19.406 1.00 0.00 H new ATOM 0 HB3 ARG B 68 30.799 6.028 20.641 1.00 0.00 H new ATOM 0 HG2 ARG B 68 28.221 5.052 19.336 1.00 0.00 H new ATOM 0 HG3 ARG B 68 29.744 4.850 18.493 1.00 0.00 H new ATOM 0 HD2 ARG B 68 29.245 3.856 21.348 1.00 0.00 H new ATOM 0 HD3 ARG B 68 29.067 2.848 19.925 1.00 0.00 H new ATOM 0 HE ARG B 68 31.649 4.058 19.787 1.00 0.00 H new ATOM 0 HH11 ARG B 68 29.785 1.851 21.777 1.00 0.00 H new ATOM 0 HH12 ARG B 68 31.193 0.911 22.280 1.00 0.00 H new ATOM 0 HH21 ARG B 68 33.448 2.833 20.423 1.00 0.00 H new ATOM 0 HH22 ARG B 68 33.250 1.462 21.520 1.00 0.00 H new ATOM 2481 N GLY B 69 29.430 8.920 22.240 1.00 0.00 N ATOM 2482 CA GLY B 69 30.085 9.820 23.210 1.00 0.00 C ATOM 2483 C GLY B 69 29.177 10.095 24.407 1.00 0.00 C ATOM 2484 O GLY B 69 29.639 10.195 25.544 1.00 0.00 O ATOM 0 H GLY B 69 28.852 9.399 21.549 1.00 0.00 H new ATOM 0 HA2 GLY B 69 31.018 9.373 23.553 1.00 0.00 H new ATOM 0 HA3 GLY B 69 30.343 10.760 22.722 1.00 0.00 H new ATOM 2488 N GLU B 70 27.881 10.215 24.140 1.00 0.00 N ATOM 2489 CA GLU B 70 26.911 10.481 25.198 1.00 0.00 C ATOM 2490 C GLU B 70 26.810 9.281 26.134 1.00 0.00 C ATOM 2491 O GLU B 70 27.659 8.389 26.116 1.00 0.00 O ATOM 2492 CB GLU B 70 25.531 10.792 24.585 1.00 0.00 C ATOM 2493 CG GLU B 70 24.966 9.533 23.869 1.00 0.00 C ATOM 2494 CD GLU B 70 23.862 8.855 24.688 1.00 0.00 C ATOM 2495 OE1 GLU B 70 23.050 9.558 25.268 1.00 0.00 O ATOM 2496 OE2 GLU B 70 23.857 7.636 24.722 1.00 0.00 O ATOM 0 H GLU B 70 27.479 10.133 23.206 1.00 0.00 H new ATOM 0 HA GLU B 70 27.246 11.346 25.771 1.00 0.00 H new ATOM 0 HB2 GLU B 70 24.842 11.115 25.366 1.00 0.00 H new ATOM 0 HB3 GLU B 70 25.617 11.615 23.876 1.00 0.00 H new ATOM 0 HG2 GLU B 70 24.571 9.817 22.893 1.00 0.00 H new ATOM 0 HG3 GLU B 70 25.774 8.823 23.692 1.00 0.00 H new ATOM 2503 N SER B 71 25.766 9.269 26.956 1.00 0.00 N ATOM 2504 CA SER B 71 25.562 8.168 27.903 1.00 0.00 C ATOM 2505 C SER B 71 25.798 6.810 27.233 1.00 0.00 C ATOM 2506 O SER B 71 25.010 6.374 26.394 1.00 0.00 O ATOM 2507 CB SER B 71 24.139 8.215 28.454 1.00 0.00 C ATOM 2508 OG SER B 71 23.908 7.061 29.249 1.00 0.00 O ATOM 0 H SER B 71 25.053 9.998 26.990 1.00 0.00 H new ATOM 0 HA SER B 71 26.280 8.285 28.714 1.00 0.00 H new ATOM 0 HB2 SER B 71 23.997 9.116 29.050 1.00 0.00 H new ATOM 0 HB3 SER B 71 23.420 8.257 27.635 1.00 0.00 H new ATOM 0 HG SER B 71 22.996 7.087 29.606 1.00 0.00 H new ATOM 2514 N LYS B 72 26.895 6.157 27.605 1.00 0.00 N ATOM 2515 CA LYS B 72 27.223 4.848 27.021 1.00 0.00 C ATOM 2516 C LYS B 72 28.534 4.316 27.607 1.00 0.00 C ATOM 2517 O LYS B 72 29.111 3.356 27.098 1.00 0.00 O ATOM 2518 CB LYS B 72 27.338 4.958 25.462 1.00 0.00 C ATOM 2519 CG LYS B 72 26.407 3.946 24.780 1.00 0.00 C ATOM 2520 CD LYS B 72 26.434 4.162 23.273 1.00 0.00 C ATOM 2521 CE LYS B 72 25.529 3.137 22.599 1.00 0.00 C ATOM 2522 NZ LYS B 72 25.542 3.363 21.129 1.00 0.00 N ATOM 0 H LYS B 72 27.564 6.499 28.294 1.00 0.00 H new ATOM 0 HA LYS B 72 26.421 4.152 27.265 1.00 0.00 H new ATOM 0 HB2 LYS B 72 27.082 5.968 25.143 1.00 0.00 H new ATOM 0 HB3 LYS B 72 28.368 4.778 25.154 1.00 0.00 H new ATOM 0 HG2 LYS B 72 26.722 2.930 25.018 1.00 0.00 H new ATOM 0 HG3 LYS B 72 25.390 4.061 25.156 1.00 0.00 H new ATOM 0 HD2 LYS B 72 26.100 5.172 23.033 1.00 0.00 H new ATOM 0 HD3 LYS B 72 27.453 4.066 22.899 1.00 0.00 H new ATOM 0 HE2 LYS B 72 25.871 2.127 22.827 1.00 0.00 H new ATOM 0 HE3 LYS B 72 24.513 3.224 22.983 1.00 0.00 H new ATOM 0 HZ1 LYS B 72 24.926 2.666 20.665 1.00 0.00 H new ATOM 0 HZ2 LYS B 72 25.197 4.322 20.922 1.00 0.00 H new ATOM 0 HZ3 LYS B 72 26.513 3.260 20.770 1.00 0.00 H new ATOM 2536 N LEU B 73 28.999 4.958 28.673 1.00 0.00 N ATOM 2537 CA LEU B 73 30.240 4.550 29.310 1.00 0.00 C ATOM 2538 C LEU B 73 30.448 5.358 30.589 1.00 0.00 C ATOM 2539 O LEU B 73 29.889 5.039 31.638 1.00 0.00 O ATOM 2540 CB LEU B 73 31.434 4.743 28.333 1.00 0.00 C ATOM 2541 CG LEU B 73 32.748 4.200 28.944 1.00 0.00 C ATOM 2542 CD1 LEU B 73 32.690 2.657 29.096 1.00 0.00 C ATOM 2543 CD2 LEU B 73 33.926 4.598 28.033 1.00 0.00 C ATOM 0 H LEU B 73 28.538 5.756 29.109 1.00 0.00 H new ATOM 0 HA LEU B 73 30.183 3.493 29.569 1.00 0.00 H new ATOM 0 HB2 LEU B 73 31.226 4.229 27.394 1.00 0.00 H new ATOM 0 HB3 LEU B 73 31.549 5.801 28.099 1.00 0.00 H new ATOM 0 HG LEU B 73 32.885 4.631 29.936 1.00 0.00 H new ATOM 0 HD11 LEU B 73 33.625 2.299 29.527 1.00 0.00 H new ATOM 0 HD12 LEU B 73 31.861 2.387 29.750 1.00 0.00 H new ATOM 0 HD13 LEU B 73 32.543 2.200 28.117 1.00 0.00 H new ATOM 0 HD21 LEU B 73 34.857 4.220 28.456 1.00 0.00 H new ATOM 0 HD22 LEU B 73 33.778 4.172 27.041 1.00 0.00 H new ATOM 0 HD23 LEU B 73 33.977 5.684 27.958 1.00 0.00 H new ATOM 2555 N GLU B 74 31.273 6.395 30.494 1.00 0.00 N ATOM 2556 CA GLU B 74 31.579 7.259 31.664 1.00 0.00 C ATOM 2557 C GLU B 74 31.677 6.430 32.957 1.00 0.00 C ATOM 2558 O GLU B 74 31.479 6.939 34.060 1.00 0.00 O ATOM 2559 CB GLU B 74 30.509 8.377 31.824 1.00 0.00 C ATOM 2560 CG GLU B 74 29.102 7.780 32.006 1.00 0.00 C ATOM 2561 CD GLU B 74 28.080 8.870 32.331 1.00 0.00 C ATOM 2562 OE1 GLU B 74 28.438 9.845 32.970 1.00 0.00 O ATOM 2563 OE2 GLU B 74 26.936 8.687 31.947 1.00 0.00 O ATOM 0 H GLU B 74 31.746 6.669 29.633 1.00 0.00 H new ATOM 0 HA GLU B 74 32.547 7.727 31.482 1.00 0.00 H new ATOM 0 HB2 GLU B 74 30.756 9.000 32.683 1.00 0.00 H new ATOM 0 HB3 GLU B 74 30.522 9.024 30.947 1.00 0.00 H new ATOM 0 HG2 GLU B 74 28.805 7.258 31.097 1.00 0.00 H new ATOM 0 HG3 GLU B 74 29.118 7.041 32.807 1.00 0.00 H new ATOM 2570 N HIS B 75 31.952 5.140 32.794 1.00 0.00 N ATOM 2571 CA HIS B 75 32.053 4.219 33.926 1.00 0.00 C ATOM 2572 C HIS B 75 32.896 4.833 35.038 1.00 0.00 C ATOM 2573 O HIS B 75 32.366 5.479 35.941 1.00 0.00 O ATOM 2574 CB HIS B 75 32.668 2.880 33.453 1.00 0.00 C ATOM 2575 CG HIS B 75 33.824 3.144 32.520 1.00 0.00 C ATOM 2576 ND1 HIS B 75 34.336 4.416 32.320 1.00 0.00 N ATOM 2577 CD2 HIS B 75 34.576 2.309 31.730 1.00 0.00 C ATOM 2578 CE1 HIS B 75 35.350 4.312 31.441 1.00 0.00 C ATOM 2579 NE2 HIS B 75 35.538 3.049 31.050 1.00 0.00 N ATOM 0 H HIS B 75 32.110 4.705 31.885 1.00 0.00 H new ATOM 0 HA HIS B 75 31.055 4.030 34.322 1.00 0.00 H new ATOM 0 HB2 HIS B 75 33.008 2.303 34.313 1.00 0.00 H new ATOM 0 HB3 HIS B 75 31.911 2.281 32.947 1.00 0.00 H new ATOM 0 HD2 HIS B 75 34.441 1.241 31.649 1.00 0.00 H new ATOM 0 HE1 HIS B 75 35.940 5.148 31.094 1.00 0.00 H new ATOM 0 HE2 HIS B 75 36.237 2.701 30.394 1.00 0.00 H new ATOM 2588 N HIS B 76 34.208 4.631 34.966 1.00 0.00 N ATOM 2589 CA HIS B 76 35.124 5.171 35.968 1.00 0.00 C ATOM 2590 C HIS B 76 35.746 6.470 35.470 1.00 0.00 C ATOM 2591 O HIS B 76 35.781 6.741 34.270 1.00 0.00 O ATOM 2592 CB HIS B 76 36.222 4.147 36.254 1.00 0.00 C ATOM 2593 CG HIS B 76 35.603 2.916 36.858 1.00 0.00 C ATOM 2594 ND1 HIS B 76 35.134 1.869 36.079 1.00 0.00 N ATOM 2595 CD2 HIS B 76 35.374 2.547 38.160 1.00 0.00 C ATOM 2596 CE1 HIS B 76 34.651 0.929 36.912 1.00 0.00 C ATOM 2597 NE2 HIS B 76 34.773 1.292 38.192 1.00 0.00 N ATOM 0 H HIS B 76 34.662 4.097 34.225 1.00 0.00 H new ATOM 0 HA HIS B 76 34.570 5.379 36.883 1.00 0.00 H new ATOM 0 HB2 HIS B 76 36.746 3.891 35.333 1.00 0.00 H new ATOM 0 HB3 HIS B 76 36.961 4.569 36.935 1.00 0.00 H new ATOM 0 HD2 HIS B 76 35.622 3.140 39.028 1.00 0.00 H new ATOM 0 HE1 HIS B 76 34.218 -0.005 36.586 1.00 0.00 H new ATOM 0 HE2 HIS B 76 34.487 0.763 39.016 1.00 0.00 H new ATOM 2606 N HIS B 77 36.242 7.272 36.407 1.00 0.00 N ATOM 2607 CA HIS B 77 36.862 8.548 36.053 1.00 0.00 C ATOM 2608 C HIS B 77 37.694 9.069 37.212 1.00 0.00 C ATOM 2609 O HIS B 77 37.278 9.006 38.368 1.00 0.00 O ATOM 2610 CB HIS B 77 35.781 9.573 35.685 1.00 0.00 C ATOM 2611 CG HIS B 77 36.429 10.835 35.179 1.00 0.00 C ATOM 2612 ND1 HIS B 77 36.517 11.982 35.952 1.00 0.00 N ATOM 2613 CD2 HIS B 77 37.036 11.140 33.986 1.00 0.00 C ATOM 2614 CE1 HIS B 77 37.155 12.915 35.222 1.00 0.00 C ATOM 2615 NE2 HIS B 77 37.494 12.453 34.015 1.00 0.00 N ATOM 0 H HIS B 77 36.228 7.066 37.406 1.00 0.00 H new ATOM 0 HA HIS B 77 37.514 8.393 35.194 1.00 0.00 H new ATOM 0 HB2 HIS B 77 35.120 9.161 34.922 1.00 0.00 H new ATOM 0 HB3 HIS B 77 35.164 9.794 36.556 1.00 0.00 H new ATOM 0 HD2 HIS B 77 37.142 10.463 33.151 1.00 0.00 H new ATOM 0 HE1 HIS B 77 37.367 13.915 35.569 1.00 0.00 H new ATOM 0 HE2 HIS B 77 37.983 12.955 33.274 1.00 0.00 H new ATOM 2624 N HIS B 78 38.879 9.581 36.895 1.00 0.00 N ATOM 2625 CA HIS B 78 39.772 10.109 37.914 1.00 0.00 C ATOM 2626 C HIS B 78 39.227 11.420 38.466 1.00 0.00 C ATOM 2627 O HIS B 78 38.563 12.179 37.760 1.00 0.00 O ATOM 2628 CB HIS B 78 41.163 10.336 37.315 1.00 0.00 C ATOM 2629 CG HIS B 78 41.754 9.016 36.895 1.00 0.00 C ATOM 2630 ND1 HIS B 78 41.696 8.561 35.586 1.00 0.00 N ATOM 2631 CD2 HIS B 78 42.419 8.044 37.600 1.00 0.00 C ATOM 2632 CE1 HIS B 78 42.310 7.365 35.546 1.00 0.00 C ATOM 2633 NE2 HIS B 78 42.769 7.002 36.747 1.00 0.00 N ATOM 0 H HIS B 78 39.240 9.640 35.943 1.00 0.00 H new ATOM 0 HA HIS B 78 39.843 9.388 38.728 1.00 0.00 H new ATOM 0 HB2 HIS B 78 41.096 11.005 36.457 1.00 0.00 H new ATOM 0 HB3 HIS B 78 41.810 10.820 38.046 1.00 0.00 H new ATOM 0 HD2 HIS B 78 42.638 8.082 38.657 1.00 0.00 H new ATOM 0 HE1 HIS B 78 42.419 6.770 34.651 1.00 0.00 H new ATOM 0 HE2 HIS B 78 43.268 6.146 36.987 1.00 0.00 H new ATOM 2642 N HIS B 79 39.516 11.680 39.737 1.00 0.00 N ATOM 2643 CA HIS B 79 39.045 12.901 40.378 1.00 0.00 C ATOM 2644 C HIS B 79 39.565 14.128 39.635 1.00 0.00 C ATOM 2645 O HIS B 79 38.832 15.093 39.419 1.00 0.00 O ATOM 2646 CB HIS B 79 39.523 12.937 41.833 1.00 0.00 C ATOM 2647 CG HIS B 79 38.875 11.818 42.606 1.00 0.00 C ATOM 2648 ND1 HIS B 79 39.465 10.570 42.732 1.00 0.00 N ATOM 2649 CD2 HIS B 79 37.691 11.744 43.297 1.00 0.00 C ATOM 2650 CE1 HIS B 79 38.643 9.805 43.473 1.00 0.00 C ATOM 2651 NE2 HIS B 79 37.546 10.472 43.843 1.00 0.00 N ATOM 0 H HIS B 79 40.068 11.068 40.338 1.00 0.00 H new ATOM 0 HA HIS B 79 37.955 12.912 40.352 1.00 0.00 H new ATOM 0 HB2 HIS B 79 40.608 12.839 41.872 1.00 0.00 H new ATOM 0 HB3 HIS B 79 39.273 13.897 42.285 1.00 0.00 H new ATOM 0 HD2 HIS B 79 36.980 12.550 43.401 1.00 0.00 H new ATOM 0 HE1 HIS B 79 38.845 8.777 43.737 1.00 0.00 H new ATOM 0 HE2 HIS B 79 36.769 10.124 44.405 1.00 0.00 H new ATOM 2660 N HIS B 80 40.836 14.084 39.247 1.00 0.00 N ATOM 2661 CA HIS B 80 41.449 15.198 38.525 1.00 0.00 C ATOM 2662 C HIS B 80 40.968 15.229 37.076 1.00 0.00 C ATOM 2663 O HIS B 80 40.835 14.165 36.494 1.00 0.00 O ATOM 2664 CB HIS B 80 42.972 15.062 38.557 1.00 0.00 C ATOM 2665 CG HIS B 80 43.376 13.757 37.928 1.00 0.00 C ATOM 2666 ND1 HIS B 80 43.376 13.566 36.555 1.00 0.00 N ATOM 2667 CD2 HIS B 80 43.797 12.568 38.471 1.00 0.00 C ATOM 2668 CE1 HIS B 80 43.786 12.306 36.320 1.00 0.00 C ATOM 2669 NE2 HIS B 80 44.055 11.654 37.454 1.00 0.00 N ATOM 0 H HIS B 80 41.460 13.295 39.418 1.00 0.00 H new ATOM 0 HA HIS B 80 41.156 16.128 39.011 1.00 0.00 H new ATOM 0 HB2 HIS B 80 43.433 15.893 38.022 1.00 0.00 H new ATOM 0 HB3 HIS B 80 43.330 15.107 39.586 1.00 0.00 H new ATOM 0 HD2 HIS B 80 43.911 12.372 39.527 1.00 0.00 H new ATOM 0 HE1 HIS B 80 43.885 11.875 35.335 1.00 0.00 H new ATOM 0 HE2 HIS B 80 44.380 10.692 37.553 1.00 0.00 H new TER 2678 HIS B 80