USER MOD reduce.3.24.130724 H: found=0, std=0, add=1306, rem=0, adj=49 USER MOD reduce.3.24.130724 removed 1309 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 56 THR OG1 : rot 92:sc= -0.311! USER MOD Set 1.2: A 159 SER OG : rot 26:sc= 1.26 USER MOD Set 2.1: A 42 ASN : amide:sc= -11.6! C(o=-13!,f=-15!) USER MOD Set 2.2: A 140 THR OG1 : rot 70:sc= -1.83! USER MOD Set 3.1: A 82 GLN : amide:sc= -1.12 K(o=-4.8,f=-9.9!) USER MOD Set 3.2: A 109 ASN : amide:sc= -3.71! K(o=-4.8!,f=-6.5) USER MOD Set 4.1: A 28 TYR OH : rot 30:sc= 0.933 USER MOD Set 4.2: A 33 HIS : +bothHN:sc= -4.92! C(o=-4!,f=-19!) USER MOD Single : A 11 MET CE :methyl -141:sc= -0.361 (180deg=-1.16) USER MOD Single : A 13 SER OG : rot 180:sc= 0 USER MOD Single : A 14 SER OG : rot 180:sc= 0 USER MOD Single : A 25 HIS : no HD1:sc= -3.56! C(o=-3.6!,f=-3.2!) USER MOD Single : A 26 LYS NZ :NH3+ 176:sc= 2.17 (180deg=2.09) USER MOD Single : A 29 ASN : amide:sc= -2.81! C(o=-2.8!,f=-2.9!) USER MOD Single : A 32 GLN : amide:sc= -0.293 X(o=-0.29,f=-0.00091) USER MOD Single : A 34 LYS NZ :NH3+ 152:sc= -0.908 (180deg=-2.09!) USER MOD Single : A 36 SER OG : rot 143:sc= 0.437 USER MOD Single : A 41 TYR OH : rot 0:sc= -1.23 USER MOD Single : A 45 SER OG : rot 170:sc= 0.00845 USER MOD Single : A 46 LYS NZ :NH3+ -169:sc= -0.0629 (180deg=-0.409!) USER MOD Single : A 47 CYS SG : rot 180:sc= 0 USER MOD Single : A 49 TYR OH : rot 180:sc= 0 USER MOD Single : A 50 THR OG1 : rot -140:sc= -0.575 USER MOD Single : A 51 LYS NZ :NH3+ 171:sc= -0.0108 (180deg=-0.118) USER MOD Single : A 54 TYR OH : rot 65:sc= 1.27 USER MOD Single : A 58 THR OG1 : rot 89:sc= 1.28 USER MOD Single : A 59 THR OG1 : rot 83:sc= 0.813 USER MOD Single : A 61 TYR OH : rot 180:sc= 0 USER MOD Single : A 62 ASN :FLIP amide:sc= 0 F(o=-0.51,f=0) USER MOD Single : A 63 LYS NZ :NH3+ -131:sc= 0.0534 (180deg=0) USER MOD Single : A 64 TYR OH : rot 180:sc= 1.25 USER MOD Single : A 65 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 66 SER OG : rot 180:sc= 0 USER MOD Single : A 67 GLN :FLIP amide:sc= -0.178 F(o=-1.4!,f=-0.18) USER MOD Single : A 70 THR OG1 : rot 48:sc= -0.771! USER MOD Single : A 76 SER OG : rot 180:sc= 0.0056 USER MOD Single : A 77 ASN : amide:sc= -0.929 K(o=-0.93,f=-3!) USER MOD Single : A 78 GLN :FLIP amide:sc= -0.0677 F(o=-1.1,f=-0.068) USER MOD Single : A 86 ASN : amide:sc= 1 K(o=1,f=-5.3!) USER MOD Single : A 91 LYS NZ :NH3+ 133:sc= 1.25 (180deg=0.441) USER MOD Single : A 95 CYS SG : rot -12:sc= -0.345 USER MOD Single : A 96 THR OG1 : rot 180:sc= -0.0268 USER MOD Single : A 97 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 99 LYS NZ :NH3+ -173:sc= -0.0178 (180deg=-0.0451) USER MOD Single : A 105 MET CE :methyl 166:sc= -9.2! (180deg=-9.54!) USER MOD Single : A 107 LYS NZ :NH3+ 172:sc= 0 (180deg=-0.0681) USER MOD Single : A 111 ASN : amide:sc= -5.15! C(o=-5.2!,f=-6.7!) USER MOD Single : A 114 ASN :FLIP amide:sc= -0.0204 F(o=-1.2,f=-0.02) USER MOD Single : A 116 HIS : no HD1:sc= -5.33! C(o=-5.3!,f=-11!) USER MOD Single : A 119 TYR OH : rot -158:sc= -3.84! USER MOD Single : A 121 TYR OH : rot 180:sc= 0 USER MOD Single : A 122 MET CE :methyl -147:sc= -11.6! (180deg=-13.3!) USER MOD Single : A 123 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 124 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 125 THR OG1 : rot 49:sc= 0.589 USER MOD Single : A 126 LYS NZ :NH3+ -169:sc=-0.00355 (180deg=-0.123) USER MOD Single : A 132 THR OG1 : rot 180:sc= -0.0615 USER MOD Single : A 133 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 136 LYS NZ :NH3+ 169:sc= 0 (180deg=-0.0657) USER MOD Single : A 138 ASN : amide:sc= -2.7! C(o=-2.7!,f=-5.1!) USER MOD Single : A 141 SER OG : rot -90:sc= 2.18 USER MOD Single : A 155 SER OG : rot 180:sc= 0 USER MOD Single : A 161 LYS NZ :NH3+ -105:sc= -0.0778 (180deg=-1.2) USER MOD Single : A 166 LYS NZ :NH3+ 172:sc= 0.626 (180deg=0.587) USER MOD Single : A 173 SER OG : rot 180:sc= -1.19 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 10 -10.928 16.590 -3.833 1.00 5.22 N ATOM 2 CA GLY A 10 -10.346 17.697 -4.630 1.00 4.42 C ATOM 3 C GLY A 10 -9.092 18.273 -3.998 1.00 3.29 C ATOM 4 O GLY A 10 -8.684 19.388 -4.328 1.00 3.60 O ATOM 0 HA2 GLY A 10 -10.111 17.335 -5.631 1.00 4.42 H new ATOM 0 HA3 GLY A 10 -11.088 18.488 -4.743 1.00 4.42 H new ATOM 10 N MET A 11 -8.485 17.506 -3.092 1.00 2.49 N ATOM 11 CA MET A 11 -7.247 17.899 -2.419 1.00 1.84 C ATOM 12 C MET A 11 -6.885 16.863 -1.361 1.00 1.40 C ATOM 13 O MET A 11 -5.713 16.644 -1.067 1.00 2.20 O ATOM 14 CB MET A 11 -7.350 19.286 -1.761 1.00 2.43 C ATOM 15 CG MET A 11 -8.306 19.357 -0.579 1.00 3.11 C ATOM 16 SD MET A 11 -8.231 20.948 0.269 1.00 4.02 S ATOM 17 CE MET A 11 -6.513 20.980 0.771 1.00 4.85 C ATOM 0 H MET A 11 -8.838 16.594 -2.804 1.00 2.49 H new ATOM 0 HA MET A 11 -6.469 17.953 -3.181 1.00 1.84 H new ATOM 0 HB2 MET A 11 -6.358 19.590 -1.428 1.00 2.43 H new ATOM 0 HB3 MET A 11 -7.669 20.008 -2.513 1.00 2.43 H new ATOM 0 HG2 MET A 11 -9.324 19.181 -0.927 1.00 3.11 H new ATOM 0 HG3 MET A 11 -8.068 18.561 0.126 1.00 3.11 H new ATOM 0 HE1 MET A 11 -6.434 21.411 1.769 1.00 4.85 H new ATOM 0 HE2 MET A 11 -6.118 19.964 0.782 1.00 4.85 H new ATOM 0 HE3 MET A 11 -5.940 21.584 0.068 1.00 4.85 H new ATOM 27 N GLY A 12 -7.903 16.231 -0.790 1.00 0.92 N ATOM 28 CA GLY A 12 -7.670 15.224 0.219 1.00 0.85 C ATOM 29 C GLY A 12 -8.949 14.769 0.890 1.00 0.79 C ATOM 30 O GLY A 12 -9.183 15.073 2.058 1.00 1.55 O ATOM 0 H GLY A 12 -8.885 16.400 -1.010 1.00 0.92 H new ATOM 0 HA2 GLY A 12 -7.177 14.365 -0.236 1.00 0.85 H new ATOM 0 HA3 GLY A 12 -6.989 15.620 0.972 1.00 0.85 H new ATOM 34 N SER A 13 -9.787 14.068 0.142 1.00 0.52 N ATOM 35 CA SER A 13 -11.008 13.479 0.691 1.00 0.53 C ATOM 36 C SER A 13 -11.174 12.055 0.181 1.00 0.41 C ATOM 37 O SER A 13 -12.152 11.373 0.485 1.00 0.53 O ATOM 38 CB SER A 13 -12.211 14.342 0.317 1.00 0.79 C ATOM 39 OG SER A 13 -12.005 15.686 0.731 1.00 1.58 O ATOM 0 H SER A 13 -9.646 13.890 -0.852 1.00 0.52 H new ATOM 0 HA SER A 13 -10.937 13.443 1.778 1.00 0.53 H new ATOM 0 HB2 SER A 13 -12.370 14.307 -0.761 1.00 0.79 H new ATOM 0 HB3 SER A 13 -13.111 13.944 0.785 1.00 0.79 H new ATOM 0 HG SER A 13 -12.783 16.228 0.483 1.00 1.58 H new ATOM 45 N SER A 14 -10.186 11.626 -0.582 1.00 0.32 N ATOM 46 CA SER A 14 -10.092 10.292 -1.095 1.00 0.22 C ATOM 47 C SER A 14 -8.803 10.244 -1.869 1.00 0.21 C ATOM 48 O SER A 14 -8.321 11.260 -2.376 1.00 0.35 O ATOM 49 CB SER A 14 -11.281 9.912 -1.986 1.00 0.25 C ATOM 50 OG SER A 14 -11.310 10.685 -3.177 1.00 1.17 O ATOM 0 H SER A 14 -9.408 12.222 -0.864 1.00 0.32 H new ATOM 0 HA SER A 14 -10.110 9.570 -0.278 1.00 0.22 H new ATOM 0 HB2 SER A 14 -11.222 8.854 -2.240 1.00 0.25 H new ATOM 0 HB3 SER A 14 -12.210 10.057 -1.435 1.00 0.25 H new ATOM 0 HG SER A 14 -12.079 10.417 -3.723 1.00 1.17 H new ATOM 56 N ILE A 15 -8.246 9.075 -1.925 1.00 0.18 N ATOM 57 CA ILE A 15 -6.933 8.865 -2.458 1.00 0.18 C ATOM 58 C ILE A 15 -6.892 9.086 -3.963 1.00 0.17 C ATOM 59 O ILE A 15 -5.819 9.241 -4.542 1.00 0.19 O ATOM 60 CB ILE A 15 -6.487 7.446 -2.115 1.00 0.17 C ATOM 61 CG1 ILE A 15 -7.487 6.432 -2.671 1.00 0.18 C ATOM 62 CG2 ILE A 15 -6.395 7.303 -0.608 1.00 0.23 C ATOM 63 CD1 ILE A 15 -6.874 5.104 -3.039 1.00 0.38 C ATOM 0 H ILE A 15 -8.698 8.222 -1.596 1.00 0.18 H new ATOM 0 HA ILE A 15 -6.253 9.591 -2.012 1.00 0.18 H new ATOM 0 HB ILE A 15 -5.511 7.256 -2.562 1.00 0.17 H new ATOM 0 HG12 ILE A 15 -8.270 6.266 -1.931 1.00 0.18 H new ATOM 0 HG13 ILE A 15 -7.966 6.856 -3.553 1.00 0.18 H new ATOM 0 HG21 ILE A 15 -6.077 6.291 -0.357 1.00 0.23 H new ATOM 0 HG22 ILE A 15 -5.671 8.018 -0.218 1.00 0.23 H new ATOM 0 HG23 ILE A 15 -7.371 7.497 -0.164 1.00 0.23 H new ATOM 0 HD11 ILE A 15 -7.648 4.441 -3.425 1.00 0.38 H new ATOM 0 HD12 ILE A 15 -6.111 5.255 -3.803 1.00 0.38 H new ATOM 0 HD13 ILE A 15 -6.420 4.656 -2.155 1.00 0.38 H new ATOM 75 N PHE A 16 -8.068 9.143 -4.582 1.00 0.18 N ATOM 76 CA PHE A 16 -8.170 9.292 -6.028 1.00 0.19 C ATOM 77 C PHE A 16 -7.904 10.725 -6.452 1.00 0.21 C ATOM 78 O PHE A 16 -7.900 11.040 -7.642 1.00 0.30 O ATOM 79 CB PHE A 16 -9.536 8.871 -6.520 1.00 0.20 C ATOM 80 CG PHE A 16 -9.878 7.469 -6.167 1.00 0.19 C ATOM 81 CD1 PHE A 16 -9.116 6.438 -6.664 1.00 0.22 C ATOM 82 CD2 PHE A 16 -10.970 7.174 -5.378 1.00 0.18 C ATOM 83 CE1 PHE A 16 -9.440 5.130 -6.396 1.00 0.22 C ATOM 84 CE2 PHE A 16 -11.289 5.864 -5.094 1.00 0.19 C ATOM 85 CZ PHE A 16 -10.524 4.843 -5.612 1.00 0.19 C ATOM 0 H PHE A 16 -8.966 9.088 -4.101 1.00 0.18 H new ATOM 0 HA PHE A 16 -7.414 8.645 -6.473 1.00 0.19 H new ATOM 0 HB2 PHE A 16 -10.288 9.539 -6.100 1.00 0.20 H new ATOM 0 HB3 PHE A 16 -9.577 8.987 -7.603 1.00 0.20 H new ATOM 0 HD1 PHE A 16 -8.252 6.659 -7.273 1.00 0.22 H new ATOM 0 HD2 PHE A 16 -11.578 7.973 -4.981 1.00 0.18 H new ATOM 0 HE1 PHE A 16 -8.840 4.330 -6.803 1.00 0.22 H new ATOM 0 HE2 PHE A 16 -12.138 5.638 -4.466 1.00 0.19 H new ATOM 0 HZ PHE A 16 -10.780 3.815 -5.399 1.00 0.19 H new ATOM 95 N ASP A 17 -7.698 11.593 -5.473 1.00 0.21 N ATOM 96 CA ASP A 17 -7.267 12.950 -5.746 1.00 0.26 C ATOM 97 C ASP A 17 -5.844 12.902 -6.257 1.00 0.25 C ATOM 98 O ASP A 17 -5.362 13.828 -6.913 1.00 0.32 O ATOM 99 CB ASP A 17 -7.335 13.826 -4.489 1.00 0.32 C ATOM 100 CG ASP A 17 -8.740 14.301 -4.157 1.00 1.13 C ATOM 101 OD1 ASP A 17 -9.636 14.194 -5.014 1.00 1.30 O ATOM 102 OD2 ASP A 17 -8.960 14.813 -3.036 1.00 2.11 O ATOM 0 H ASP A 17 -7.823 11.379 -4.484 1.00 0.21 H new ATOM 0 HA ASP A 17 -7.932 13.390 -6.489 1.00 0.26 H new ATOM 0 HB2 ASP A 17 -6.940 13.264 -3.642 1.00 0.32 H new ATOM 0 HB3 ASP A 17 -6.689 14.694 -4.625 1.00 0.32 H new ATOM 107 N PHE A 18 -5.178 11.799 -5.941 1.00 0.22 N ATOM 108 CA PHE A 18 -3.809 11.583 -6.344 1.00 0.23 C ATOM 109 C PHE A 18 -3.685 10.441 -7.313 1.00 0.26 C ATOM 110 O PHE A 18 -3.912 9.280 -6.971 1.00 0.29 O ATOM 111 CB PHE A 18 -2.956 11.322 -5.128 1.00 0.21 C ATOM 112 CG PHE A 18 -3.050 12.449 -4.168 1.00 0.22 C ATOM 113 CD1 PHE A 18 -2.653 13.711 -4.537 1.00 0.27 C ATOM 114 CD2 PHE A 18 -3.502 12.234 -2.880 1.00 0.23 C ATOM 115 CE1 PHE A 18 -2.711 14.746 -3.642 1.00 0.31 C ATOM 116 CE2 PHE A 18 -3.557 13.266 -1.973 1.00 0.29 C ATOM 117 CZ PHE A 18 -3.292 14.563 -2.408 1.00 0.31 C ATOM 0 H PHE A 18 -5.578 11.034 -5.398 1.00 0.22 H new ATOM 0 HA PHE A 18 -3.464 12.484 -6.851 1.00 0.23 H new ATOM 0 HB2 PHE A 18 -3.276 10.399 -4.645 1.00 0.21 H new ATOM 0 HB3 PHE A 18 -1.918 11.181 -5.430 1.00 0.21 H new ATOM 0 HD1 PHE A 18 -2.293 13.888 -5.540 1.00 0.27 H new ATOM 0 HD2 PHE A 18 -3.816 11.244 -2.582 1.00 0.23 H new ATOM 0 HE1 PHE A 18 -2.299 15.709 -3.906 1.00 0.31 H new ATOM 0 HE2 PHE A 18 -3.802 13.074 -0.939 1.00 0.29 H new ATOM 0 HZ PHE A 18 -3.539 15.411 -1.787 1.00 0.31 H new ATOM 127 N GLU A 19 -3.354 10.803 -8.529 1.00 0.35 N ATOM 128 CA GLU A 19 -2.980 9.843 -9.546 1.00 0.43 C ATOM 129 C GLU A 19 -1.909 8.896 -9.001 1.00 0.34 C ATOM 130 O GLU A 19 -1.094 9.269 -8.149 1.00 0.37 O ATOM 131 CB GLU A 19 -2.449 10.577 -10.784 1.00 0.63 C ATOM 132 CG GLU A 19 -2.277 9.686 -12.006 1.00 1.08 C ATOM 133 CD GLU A 19 -3.600 9.225 -12.581 1.00 2.04 C ATOM 134 OE1 GLU A 19 -4.309 8.447 -11.906 1.00 2.86 O ATOM 135 OE2 GLU A 19 -3.929 9.616 -13.718 1.00 2.30 O ATOM 0 H GLU A 19 -3.336 11.773 -8.844 1.00 0.35 H new ATOM 0 HA GLU A 19 -3.858 9.261 -9.826 1.00 0.43 H new ATOM 0 HB2 GLU A 19 -3.132 11.389 -11.033 1.00 0.63 H new ATOM 0 HB3 GLU A 19 -1.489 11.031 -10.540 1.00 0.63 H new ATOM 0 HG2 GLU A 19 -1.722 10.228 -12.771 1.00 1.08 H new ATOM 0 HG3 GLU A 19 -1.680 8.815 -11.735 1.00 1.08 H new ATOM 142 N VAL A 20 -1.907 7.684 -9.511 1.00 0.29 N ATOM 143 CA VAL A 20 -0.955 6.675 -9.087 1.00 0.26 C ATOM 144 C VAL A 20 0.001 6.393 -10.227 1.00 0.25 C ATOM 145 O VAL A 20 -0.247 6.806 -11.350 1.00 0.28 O ATOM 146 CB VAL A 20 -1.687 5.383 -8.626 1.00 0.31 C ATOM 147 CG1 VAL A 20 -0.756 4.193 -8.501 1.00 0.67 C ATOM 148 CG2 VAL A 20 -2.350 5.647 -7.304 1.00 0.49 C ATOM 0 H VAL A 20 -2.561 7.369 -10.228 1.00 0.29 H new ATOM 0 HA VAL A 20 -0.388 7.043 -8.231 1.00 0.26 H new ATOM 0 HB VAL A 20 -2.424 5.129 -9.388 1.00 0.31 H new ATOM 0 HG11 VAL A 20 -1.323 3.320 -8.176 1.00 0.67 H new ATOM 0 HG12 VAL A 20 -0.296 3.988 -9.468 1.00 0.67 H new ATOM 0 HG13 VAL A 20 0.021 4.414 -7.769 1.00 0.67 H new ATOM 0 HG21 VAL A 20 -2.867 4.747 -6.970 1.00 0.49 H new ATOM 0 HG22 VAL A 20 -1.596 5.926 -6.568 1.00 0.49 H new ATOM 0 HG23 VAL A 20 -3.069 6.459 -7.413 1.00 0.49 H new ATOM 158 N LEU A 21 1.117 5.756 -9.937 1.00 0.28 N ATOM 159 CA LEU A 21 2.110 5.509 -10.948 1.00 0.35 C ATOM 160 C LEU A 21 2.476 4.045 -11.024 1.00 0.38 C ATOM 161 O LEU A 21 3.067 3.511 -10.092 1.00 0.58 O ATOM 162 CB LEU A 21 3.357 6.334 -10.657 1.00 0.45 C ATOM 163 CG LEU A 21 3.119 7.836 -10.633 1.00 0.46 C ATOM 164 CD1 LEU A 21 4.376 8.578 -10.238 1.00 0.69 C ATOM 165 CD2 LEU A 21 2.634 8.298 -11.987 1.00 0.68 C ATOM 0 H LEU A 21 1.354 5.403 -9.010 1.00 0.28 H new ATOM 0 HA LEU A 21 1.688 5.800 -11.910 1.00 0.35 H new ATOM 0 HB2 LEU A 21 3.766 6.027 -9.694 1.00 0.45 H new ATOM 0 HB3 LEU A 21 4.112 6.109 -11.410 1.00 0.45 H new ATOM 0 HG LEU A 21 2.355 8.055 -9.887 1.00 0.46 H new ATOM 0 HD11 LEU A 21 4.178 9.650 -10.229 1.00 0.69 H new ATOM 0 HD12 LEU A 21 4.690 8.258 -9.244 1.00 0.69 H new ATOM 0 HD13 LEU A 21 5.167 8.361 -10.956 1.00 0.69 H new ATOM 0 HD21 LEU A 21 2.465 9.375 -11.965 1.00 0.68 H new ATOM 0 HD22 LEU A 21 3.385 8.064 -12.742 1.00 0.68 H new ATOM 0 HD23 LEU A 21 1.702 7.789 -12.233 1.00 0.68 H new ATOM 177 N ASP A 22 2.126 3.409 -12.142 1.00 0.33 N ATOM 178 CA ASP A 22 2.613 2.068 -12.458 1.00 0.37 C ATOM 179 C ASP A 22 4.126 2.081 -12.326 1.00 0.35 C ATOM 180 O ASP A 22 4.724 3.149 -12.380 1.00 0.40 O ATOM 181 CB ASP A 22 2.192 1.682 -13.881 1.00 0.50 C ATOM 182 CG ASP A 22 2.539 0.254 -14.253 1.00 1.16 C ATOM 183 OD1 ASP A 22 3.724 -0.023 -14.534 1.00 1.87 O ATOM 184 OD2 ASP A 22 1.623 -0.587 -14.300 1.00 1.48 O ATOM 0 H ASP A 22 1.504 3.804 -12.847 1.00 0.33 H new ATOM 0 HA ASP A 22 2.189 1.331 -11.776 1.00 0.37 H new ATOM 0 HB2 ASP A 22 1.116 1.823 -13.983 1.00 0.50 H new ATOM 0 HB3 ASP A 22 2.671 2.359 -14.588 1.00 0.50 H new ATOM 189 N ALA A 23 4.741 0.920 -12.176 1.00 0.39 N ATOM 190 CA ALA A 23 6.122 0.828 -11.701 1.00 0.42 C ATOM 191 C ALA A 23 7.126 1.660 -12.519 1.00 0.47 C ATOM 192 O ALA A 23 8.234 1.916 -12.053 1.00 0.59 O ATOM 193 CB ALA A 23 6.561 -0.627 -11.654 1.00 0.52 C ATOM 0 H ALA A 23 4.307 0.019 -12.376 1.00 0.39 H new ATOM 0 HA ALA A 23 6.125 1.257 -10.699 1.00 0.42 H new ATOM 0 HB1 ALA A 23 7.590 -0.685 -11.299 1.00 0.52 H new ATOM 0 HB2 ALA A 23 5.912 -1.181 -10.976 1.00 0.52 H new ATOM 0 HB3 ALA A 23 6.496 -1.059 -12.653 1.00 0.52 H new ATOM 199 N ASP A 24 6.745 2.082 -13.724 1.00 0.46 N ATOM 200 CA ASP A 24 7.605 2.907 -14.554 1.00 0.54 C ATOM 201 C ASP A 24 7.291 4.399 -14.414 1.00 0.51 C ATOM 202 O ASP A 24 7.835 5.209 -15.162 1.00 0.62 O ATOM 203 CB ASP A 24 7.443 2.514 -16.013 1.00 0.69 C ATOM 204 CG ASP A 24 8.018 1.156 -16.340 1.00 1.43 C ATOM 205 OD1 ASP A 24 9.259 1.014 -16.298 1.00 1.51 O ATOM 206 OD2 ASP A 24 7.232 0.231 -16.630 1.00 2.34 O ATOM 0 H ASP A 24 5.842 1.862 -14.144 1.00 0.46 H new ATOM 0 HA ASP A 24 8.628 2.740 -14.218 1.00 0.54 H new ATOM 0 HB2 ASP A 24 6.383 2.521 -16.267 1.00 0.69 H new ATOM 0 HB3 ASP A 24 7.926 3.264 -16.639 1.00 0.69 H new ATOM 211 N HIS A 25 6.379 4.749 -13.498 1.00 0.43 N ATOM 212 CA HIS A 25 5.977 6.139 -13.251 1.00 0.44 C ATOM 213 C HIS A 25 5.012 6.581 -14.341 1.00 0.47 C ATOM 214 O HIS A 25 4.746 7.766 -14.526 1.00 0.54 O ATOM 215 CB HIS A 25 7.175 7.104 -13.132 1.00 0.54 C ATOM 216 CG HIS A 25 8.023 6.880 -11.910 1.00 0.64 C ATOM 217 ND1 HIS A 25 7.866 7.582 -10.728 1.00 0.73 N ATOM 218 CD2 HIS A 25 9.031 6.008 -11.691 1.00 1.47 C ATOM 219 CE1 HIS A 25 8.733 7.134 -9.834 1.00 0.59 C ATOM 220 NE2 HIS A 25 9.454 6.185 -10.396 1.00 1.26 N ATOM 0 H HIS A 25 5.897 4.073 -12.905 1.00 0.43 H new ATOM 0 HA HIS A 25 5.478 6.176 -12.283 1.00 0.44 H new ATOM 0 HB2 HIS A 25 7.800 7.002 -14.019 1.00 0.54 H new ATOM 0 HB3 HIS A 25 6.803 8.129 -13.121 1.00 0.54 H new ATOM 0 HD2 HIS A 25 9.431 5.301 -12.403 1.00 1.47 H new ATOM 0 HE1 HIS A 25 8.833 7.486 -8.818 1.00 0.59 H new ATOM 0 HE2 HIS A 25 10.205 5.665 -9.942 1.00 1.26 H new ATOM 229 N LYS A 26 4.500 5.590 -15.058 1.00 0.48 N ATOM 230 CA LYS A 26 3.394 5.784 -15.983 1.00 0.53 C ATOM 231 C LYS A 26 2.123 5.817 -15.161 1.00 0.41 C ATOM 232 O LYS A 26 1.830 4.844 -14.467 1.00 0.38 O ATOM 233 CB LYS A 26 3.316 4.615 -16.965 1.00 0.67 C ATOM 234 CG LYS A 26 4.656 4.208 -17.548 1.00 1.00 C ATOM 235 CD LYS A 26 4.646 2.753 -18.008 1.00 2.12 C ATOM 236 CE LYS A 26 4.197 1.830 -16.881 1.00 3.15 C ATOM 237 NZ LYS A 26 4.543 0.400 -17.120 1.00 4.25 N ATOM 0 H LYS A 26 4.840 4.629 -15.014 1.00 0.48 H new ATOM 0 HA LYS A 26 3.531 6.706 -16.548 1.00 0.53 H new ATOM 0 HB2 LYS A 26 2.876 3.756 -16.457 1.00 0.67 H new ATOM 0 HB3 LYS A 26 2.643 4.883 -17.780 1.00 0.67 H new ATOM 0 HG2 LYS A 26 4.899 4.856 -18.390 1.00 1.00 H new ATOM 0 HG3 LYS A 26 5.437 4.349 -16.801 1.00 1.00 H new ATOM 0 HD2 LYS A 26 3.978 2.642 -18.862 1.00 2.12 H new ATOM 0 HD3 LYS A 26 5.643 2.466 -18.343 1.00 2.12 H new ATOM 0 HE2 LYS A 26 4.656 2.157 -15.948 1.00 3.15 H new ATOM 0 HE3 LYS A 26 3.118 1.920 -16.755 1.00 3.15 H new ATOM 0 HZ1 LYS A 26 4.273 -0.166 -16.290 1.00 4.25 H new ATOM 0 HZ2 LYS A 26 4.031 0.054 -17.957 1.00 4.25 H new ATOM 0 HZ3 LYS A 26 5.567 0.313 -17.280 1.00 4.25 H new ATOM 251 N PRO A 27 1.371 6.920 -15.186 1.00 0.41 N ATOM 252 CA PRO A 27 0.212 7.076 -14.310 1.00 0.37 C ATOM 253 C PRO A 27 -0.757 5.897 -14.380 1.00 0.32 C ATOM 254 O PRO A 27 -1.404 5.643 -15.401 1.00 0.36 O ATOM 255 CB PRO A 27 -0.433 8.363 -14.825 1.00 0.46 C ATOM 256 CG PRO A 27 0.716 9.135 -15.370 1.00 0.54 C ATOM 257 CD PRO A 27 1.593 8.110 -16.030 1.00 0.50 C ATOM 0 HA PRO A 27 0.494 7.115 -13.258 1.00 0.37 H new ATOM 0 HB2 PRO A 27 -1.179 8.158 -15.593 1.00 0.46 H new ATOM 0 HB3 PRO A 27 -0.938 8.906 -14.026 1.00 0.46 H new ATOM 0 HG2 PRO A 27 0.383 9.888 -16.084 1.00 0.54 H new ATOM 0 HG3 PRO A 27 1.250 9.661 -14.578 1.00 0.54 H new ATOM 0 HD2 PRO A 27 1.304 7.934 -17.066 1.00 0.50 H new ATOM 0 HD3 PRO A 27 2.640 8.414 -16.038 1.00 0.50 H new ATOM 265 N TYR A 28 -0.839 5.199 -13.260 1.00 0.28 N ATOM 266 CA TYR A 28 -1.771 4.101 -13.061 1.00 0.26 C ATOM 267 C TYR A 28 -3.168 4.611 -12.740 1.00 0.25 C ATOM 268 O TYR A 28 -3.339 5.625 -12.063 1.00 0.37 O ATOM 269 CB TYR A 28 -1.260 3.198 -11.935 1.00 0.30 C ATOM 270 CG TYR A 28 -2.239 2.155 -11.456 1.00 0.37 C ATOM 271 CD1 TYR A 28 -2.744 1.182 -12.309 1.00 0.50 C ATOM 272 CD2 TYR A 28 -2.645 2.140 -10.137 1.00 0.82 C ATOM 273 CE1 TYR A 28 -3.633 0.229 -11.853 1.00 0.64 C ATOM 274 CE2 TYR A 28 -3.523 1.199 -9.670 1.00 1.10 C ATOM 275 CZ TYR A 28 -4.018 0.240 -10.529 1.00 0.92 C ATOM 276 OH TYR A 28 -4.905 -0.703 -10.061 1.00 1.20 O ATOM 0 H TYR A 28 -0.249 5.383 -12.448 1.00 0.28 H new ATOM 0 HA TYR A 28 -1.836 3.529 -13.986 1.00 0.26 H new ATOM 0 HB2 TYR A 28 -0.355 2.695 -12.276 1.00 0.30 H new ATOM 0 HB3 TYR A 28 -0.977 3.824 -11.089 1.00 0.30 H new ATOM 0 HD1 TYR A 28 -2.437 1.171 -13.344 1.00 0.50 H new ATOM 0 HD2 TYR A 28 -2.262 2.887 -9.458 1.00 0.82 H new ATOM 0 HE1 TYR A 28 -4.023 -0.519 -12.528 1.00 0.64 H new ATOM 0 HE2 TYR A 28 -3.827 1.208 -8.634 1.00 1.10 H new ATOM 0 HH TYR A 28 -4.804 -1.531 -10.576 1.00 1.20 H new ATOM 286 N ASN A 29 -4.155 3.884 -13.232 1.00 0.34 N ATOM 287 CA ASN A 29 -5.546 4.200 -12.999 1.00 0.42 C ATOM 288 C ASN A 29 -5.958 3.735 -11.610 1.00 0.34 C ATOM 289 O ASN A 29 -6.472 2.629 -11.434 1.00 0.44 O ATOM 290 CB ASN A 29 -6.426 3.546 -14.069 1.00 0.67 C ATOM 291 CG ASN A 29 -7.901 3.867 -13.902 1.00 0.73 C ATOM 292 OD1 ASN A 29 -8.766 3.085 -14.292 1.00 1.18 O ATOM 293 ND2 ASN A 29 -8.200 5.012 -13.314 1.00 1.51 N ATOM 0 H ASN A 29 -4.010 3.054 -13.807 1.00 0.34 H new ATOM 0 HA ASN A 29 -5.679 5.280 -13.059 1.00 0.42 H new ATOM 0 HB2 ASN A 29 -6.097 3.877 -15.054 1.00 0.67 H new ATOM 0 HB3 ASN A 29 -6.289 2.465 -14.034 1.00 0.67 H new ATOM 0 HD21 ASN A 29 -9.176 5.272 -13.171 1.00 1.51 H new ATOM 0 HD22 ASN A 29 -7.455 5.636 -13.004 1.00 1.51 H new ATOM 300 N LEU A 30 -5.708 4.584 -10.632 1.00 0.25 N ATOM 301 CA LEU A 30 -6.048 4.296 -9.250 1.00 0.20 C ATOM 302 C LEU A 30 -7.554 4.155 -9.091 1.00 0.19 C ATOM 303 O LEU A 30 -8.053 3.246 -8.423 1.00 0.19 O ATOM 304 CB LEU A 30 -5.576 5.441 -8.351 1.00 0.22 C ATOM 305 CG LEU A 30 -6.021 5.379 -6.912 1.00 0.22 C ATOM 306 CD1 LEU A 30 -5.509 4.124 -6.239 1.00 0.23 C ATOM 307 CD2 LEU A 30 -5.564 6.615 -6.164 1.00 0.28 C ATOM 0 H LEU A 30 -5.264 5.492 -10.772 1.00 0.25 H new ATOM 0 HA LEU A 30 -5.559 3.364 -8.966 1.00 0.20 H new ATOM 0 HB2 LEU A 30 -4.487 5.468 -8.373 1.00 0.22 H new ATOM 0 HB3 LEU A 30 -5.927 6.380 -8.779 1.00 0.22 H new ATOM 0 HG LEU A 30 -7.110 5.347 -6.893 1.00 0.22 H new ATOM 0 HD11 LEU A 30 -5.844 4.104 -5.202 1.00 0.23 H new ATOM 0 HD12 LEU A 30 -5.894 3.248 -6.761 1.00 0.23 H new ATOM 0 HD13 LEU A 30 -4.419 4.114 -6.268 1.00 0.23 H new ATOM 0 HD21 LEU A 30 -5.893 6.555 -5.127 1.00 0.28 H new ATOM 0 HD22 LEU A 30 -4.476 6.679 -6.196 1.00 0.28 H new ATOM 0 HD23 LEU A 30 -5.993 7.502 -6.630 1.00 0.28 H new ATOM 319 N VAL A 31 -8.262 5.059 -9.753 1.00 0.20 N ATOM 320 CA VAL A 31 -9.687 5.281 -9.529 1.00 0.19 C ATOM 321 C VAL A 31 -10.542 4.111 -10.007 1.00 0.20 C ATOM 322 O VAL A 31 -11.761 4.132 -9.870 1.00 0.23 O ATOM 323 CB VAL A 31 -10.146 6.562 -10.239 1.00 0.22 C ATOM 324 CG1 VAL A 31 -11.386 7.153 -9.604 1.00 1.02 C ATOM 325 CG2 VAL A 31 -9.036 7.587 -10.282 1.00 0.87 C ATOM 0 H VAL A 31 -7.861 5.666 -10.468 1.00 0.20 H new ATOM 0 HA VAL A 31 -9.823 5.379 -8.452 1.00 0.19 H new ATOM 0 HB VAL A 31 -10.402 6.282 -11.261 1.00 0.22 H new ATOM 0 HG11 VAL A 31 -11.673 8.058 -10.140 1.00 1.02 H new ATOM 0 HG12 VAL A 31 -12.200 6.429 -9.652 1.00 1.02 H new ATOM 0 HG13 VAL A 31 -11.180 7.399 -8.562 1.00 1.02 H new ATOM 0 HG21 VAL A 31 -9.389 8.484 -10.790 1.00 0.87 H new ATOM 0 HG22 VAL A 31 -8.735 7.840 -9.265 1.00 0.87 H new ATOM 0 HG23 VAL A 31 -8.182 7.176 -10.821 1.00 0.87 H new ATOM 335 N GLN A 32 -9.914 3.086 -10.556 1.00 0.21 N ATOM 336 CA GLN A 32 -10.647 1.909 -10.981 1.00 0.23 C ATOM 337 C GLN A 32 -11.018 1.062 -9.786 1.00 0.22 C ATOM 338 O GLN A 32 -11.729 0.066 -9.900 1.00 0.28 O ATOM 339 CB GLN A 32 -9.856 1.101 -12.011 1.00 0.26 C ATOM 340 CG GLN A 32 -8.677 0.335 -11.432 1.00 0.29 C ATOM 341 CD GLN A 32 -7.928 -0.440 -12.494 1.00 0.35 C ATOM 342 OE1 GLN A 32 -8.256 -1.588 -12.790 1.00 1.02 O ATOM 343 NE2 GLN A 32 -6.910 0.181 -13.068 1.00 0.75 N ATOM 0 H GLN A 32 -8.908 3.045 -10.716 1.00 0.21 H new ATOM 0 HA GLN A 32 -11.566 2.237 -11.467 1.00 0.23 H new ATOM 0 HB2 GLN A 32 -10.530 0.395 -12.497 1.00 0.26 H new ATOM 0 HB3 GLN A 32 -9.491 1.777 -12.784 1.00 0.26 H new ATOM 0 HG2 GLN A 32 -7.996 1.032 -10.944 1.00 0.29 H new ATOM 0 HG3 GLN A 32 -9.033 -0.353 -10.665 1.00 0.29 H new ATOM 0 HE21 GLN A 32 -6.673 1.134 -12.792 1.00 0.75 H new ATOM 0 HE22 GLN A 32 -6.363 -0.293 -13.786 1.00 0.75 H new ATOM 352 N HIS A 33 -10.533 1.469 -8.633 1.00 0.17 N ATOM 353 CA HIS A 33 -10.918 0.831 -7.394 1.00 0.16 C ATOM 354 C HIS A 33 -11.962 1.676 -6.699 1.00 0.16 C ATOM 355 O HIS A 33 -12.129 1.629 -5.486 1.00 0.17 O ATOM 356 CB HIS A 33 -9.700 0.598 -6.514 1.00 0.16 C ATOM 357 CG HIS A 33 -8.630 -0.152 -7.235 1.00 0.16 C ATOM 358 ND1 HIS A 33 -8.817 -1.454 -7.624 1.00 0.21 N ATOM 359 CD2 HIS A 33 -7.398 0.213 -7.703 1.00 0.22 C ATOM 360 CE1 HIS A 33 -7.771 -1.869 -8.292 1.00 0.27 C ATOM 361 NE2 HIS A 33 -6.895 -0.880 -8.365 1.00 0.28 N ATOM 0 H HIS A 33 -9.872 2.238 -8.528 1.00 0.17 H new ATOM 0 HA HIS A 33 -11.353 -0.146 -7.603 1.00 0.16 H new ATOM 0 HB2 HIS A 33 -9.307 1.557 -6.176 1.00 0.16 H new ATOM 0 HB3 HIS A 33 -9.996 0.043 -5.624 1.00 0.16 H new ATOM 0 HD1 HIS A 33 -9.646 -2.014 -7.423 1.00 0.21 H new ATOM 0 HD2 HIS A 33 -6.916 1.171 -7.577 1.00 0.22 H new ATOM 0 HE1 HIS A 33 -7.644 -2.855 -8.714 1.00 0.27 H new ATOM 0 HE2 HIS A 33 -5.992 -0.923 -8.837 1.00 0.28 H new ATOM 370 N LYS A 34 -12.657 2.466 -7.500 1.00 0.19 N ATOM 371 CA LYS A 34 -13.802 3.202 -7.025 1.00 0.19 C ATOM 372 C LYS A 34 -15.020 2.299 -7.040 1.00 0.21 C ATOM 373 O LYS A 34 -15.509 1.913 -8.102 1.00 0.33 O ATOM 374 CB LYS A 34 -14.055 4.432 -7.886 1.00 0.22 C ATOM 375 CG LYS A 34 -13.252 5.632 -7.462 1.00 0.28 C ATOM 376 CD LYS A 34 -14.113 6.877 -7.289 1.00 0.69 C ATOM 377 CE LYS A 34 -14.675 7.377 -8.610 1.00 1.01 C ATOM 378 NZ LYS A 34 -15.895 6.640 -9.040 1.00 1.56 N ATOM 0 H LYS A 34 -12.442 2.610 -8.487 1.00 0.19 H new ATOM 0 HA LYS A 34 -13.605 3.538 -6.007 1.00 0.19 H new ATOM 0 HB2 LYS A 34 -13.820 4.195 -8.924 1.00 0.22 H new ATOM 0 HB3 LYS A 34 -15.115 4.681 -7.848 1.00 0.22 H new ATOM 0 HG2 LYS A 34 -12.744 5.412 -6.523 1.00 0.28 H new ATOM 0 HG3 LYS A 34 -12.479 5.829 -8.205 1.00 0.28 H new ATOM 0 HD2 LYS A 34 -14.934 6.656 -6.607 1.00 0.69 H new ATOM 0 HD3 LYS A 34 -13.519 7.666 -6.827 1.00 0.69 H new ATOM 0 HE2 LYS A 34 -14.911 8.437 -8.520 1.00 1.01 H new ATOM 0 HE3 LYS A 34 -13.911 7.285 -9.382 1.00 1.01 H new ATOM 0 HZ1 LYS A 34 -16.488 7.262 -9.625 1.00 1.56 H new ATOM 0 HZ2 LYS A 34 -15.619 5.804 -9.594 1.00 1.56 H new ATOM 0 HZ3 LYS A 34 -16.432 6.338 -8.202 1.00 1.56 H new ATOM 392 N GLY A 35 -15.487 1.947 -5.865 1.00 0.18 N ATOM 393 CA GLY A 35 -16.606 1.052 -5.753 1.00 0.20 C ATOM 394 C GLY A 35 -16.311 -0.087 -4.808 1.00 0.17 C ATOM 395 O GLY A 35 -17.187 -0.519 -4.057 1.00 0.20 O ATOM 0 H GLY A 35 -15.107 2.269 -4.975 1.00 0.18 H new ATOM 0 HA2 GLY A 35 -17.479 1.602 -5.401 1.00 0.20 H new ATOM 0 HA3 GLY A 35 -16.855 0.655 -6.737 1.00 0.20 H new ATOM 399 N SER A 36 -15.080 -0.580 -4.826 1.00 0.16 N ATOM 400 CA SER A 36 -14.666 -1.565 -3.868 1.00 0.16 C ATOM 401 C SER A 36 -13.335 -1.149 -3.294 1.00 0.14 C ATOM 402 O SER A 36 -12.441 -0.741 -4.031 1.00 0.16 O ATOM 403 CB SER A 36 -14.557 -2.930 -4.524 1.00 0.20 C ATOM 404 OG SER A 36 -15.757 -3.253 -5.200 1.00 0.29 O ATOM 0 H SER A 36 -14.361 -0.307 -5.496 1.00 0.16 H new ATOM 0 HA SER A 36 -15.405 -1.635 -3.070 1.00 0.16 H new ATOM 0 HB2 SER A 36 -13.724 -2.937 -5.227 1.00 0.20 H new ATOM 0 HB3 SER A 36 -14.343 -3.687 -3.769 1.00 0.20 H new ATOM 0 HG SER A 36 -15.547 -3.740 -6.024 1.00 0.29 H new ATOM 410 N PRO A 37 -13.217 -1.212 -1.966 1.00 0.12 N ATOM 411 CA PRO A 37 -11.998 -0.889 -1.238 1.00 0.12 C ATOM 412 C PRO A 37 -10.764 -1.476 -1.882 1.00 0.12 C ATOM 413 O PRO A 37 -10.822 -2.482 -2.577 1.00 0.15 O ATOM 414 CB PRO A 37 -12.234 -1.517 0.149 1.00 0.15 C ATOM 415 CG PRO A 37 -13.464 -2.328 -0.012 1.00 0.18 C ATOM 416 CD PRO A 37 -14.263 -1.609 -1.043 1.00 0.15 C ATOM 0 HA PRO A 37 -11.815 0.185 -1.211 1.00 0.12 H new ATOM 0 HB2 PRO A 37 -11.389 -2.135 0.453 1.00 0.15 H new ATOM 0 HB3 PRO A 37 -12.361 -0.751 0.914 1.00 0.15 H new ATOM 0 HG2 PRO A 37 -13.229 -3.343 -0.331 1.00 0.18 H new ATOM 0 HG3 PRO A 37 -14.011 -2.408 0.928 1.00 0.18 H new ATOM 0 HD2 PRO A 37 -15.007 -2.252 -1.513 1.00 0.15 H new ATOM 0 HD3 PRO A 37 -14.797 -0.753 -0.630 1.00 0.15 H new ATOM 424 N LEU A 38 -9.663 -0.819 -1.640 1.00 0.14 N ATOM 425 CA LEU A 38 -8.374 -1.204 -2.157 1.00 0.13 C ATOM 426 C LEU A 38 -7.364 -0.964 -1.054 1.00 0.13 C ATOM 427 O LEU A 38 -7.462 0.005 -0.334 1.00 0.20 O ATOM 428 CB LEU A 38 -8.001 -0.384 -3.399 1.00 0.16 C ATOM 429 CG LEU A 38 -8.138 1.134 -3.287 1.00 0.20 C ATOM 430 CD1 LEU A 38 -7.390 1.805 -4.417 1.00 0.31 C ATOM 431 CD2 LEU A 38 -9.596 1.576 -3.312 1.00 0.26 C ATOM 0 H LEU A 38 -9.634 0.021 -1.063 1.00 0.14 H new ATOM 0 HA LEU A 38 -8.391 -2.251 -2.460 1.00 0.13 H new ATOM 0 HB2 LEU A 38 -6.968 -0.614 -3.661 1.00 0.16 H new ATOM 0 HB3 LEU A 38 -8.623 -0.721 -4.228 1.00 0.16 H new ATOM 0 HG LEU A 38 -7.712 1.431 -2.329 1.00 0.20 H new ATOM 0 HD11 LEU A 38 -7.493 2.887 -4.330 1.00 0.31 H new ATOM 0 HD12 LEU A 38 -6.335 1.535 -4.366 1.00 0.31 H new ATOM 0 HD13 LEU A 38 -7.802 1.477 -5.371 1.00 0.31 H new ATOM 0 HD21 LEU A 38 -9.649 2.662 -3.230 1.00 0.26 H new ATOM 0 HD22 LEU A 38 -10.056 1.260 -4.248 1.00 0.26 H new ATOM 0 HD23 LEU A 38 -10.128 1.123 -2.475 1.00 0.26 H new ATOM 443 N LEU A 39 -6.432 -1.843 -0.881 1.00 0.18 N ATOM 444 CA LEU A 39 -5.406 -1.629 0.091 1.00 0.19 C ATOM 445 C LEU A 39 -4.125 -1.304 -0.602 1.00 0.18 C ATOM 446 O LEU A 39 -3.601 -2.101 -1.373 1.00 0.21 O ATOM 447 CB LEU A 39 -5.191 -2.832 0.976 1.00 0.23 C ATOM 448 CG LEU A 39 -5.804 -2.738 2.367 1.00 0.35 C ATOM 449 CD1 LEU A 39 -7.300 -2.946 2.309 1.00 1.10 C ATOM 450 CD2 LEU A 39 -5.164 -3.733 3.310 1.00 1.19 C ATOM 0 H LEU A 39 -6.358 -2.718 -1.400 1.00 0.18 H new ATOM 0 HA LEU A 39 -5.727 -0.802 0.724 1.00 0.19 H new ATOM 0 HB2 LEU A 39 -5.602 -3.708 0.475 1.00 0.23 H new ATOM 0 HB3 LEU A 39 -4.119 -2.998 1.080 1.00 0.23 H new ATOM 0 HG LEU A 39 -5.612 -1.736 2.751 1.00 0.35 H new ATOM 0 HD11 LEU A 39 -7.716 -2.875 3.314 1.00 1.10 H new ATOM 0 HD12 LEU A 39 -7.749 -2.182 1.675 1.00 1.10 H new ATOM 0 HD13 LEU A 39 -7.515 -3.932 1.897 1.00 1.10 H new ATOM 0 HD21 LEU A 39 -5.620 -3.645 4.296 1.00 1.19 H new ATOM 0 HD22 LEU A 39 -5.314 -4.743 2.930 1.00 1.19 H new ATOM 0 HD23 LEU A 39 -4.096 -3.529 3.385 1.00 1.19 H new ATOM 462 N ILE A 40 -3.645 -0.121 -0.366 1.00 0.19 N ATOM 463 CA ILE A 40 -2.379 0.272 -0.912 1.00 0.20 C ATOM 464 C ILE A 40 -1.282 0.044 0.117 1.00 0.18 C ATOM 465 O ILE A 40 -1.328 0.587 1.223 1.00 0.20 O ATOM 466 CB ILE A 40 -2.426 1.731 -1.355 1.00 0.23 C ATOM 467 CG1 ILE A 40 -3.804 2.037 -1.937 1.00 0.30 C ATOM 468 CG2 ILE A 40 -1.349 2.011 -2.386 1.00 0.37 C ATOM 469 CD1 ILE A 40 -3.853 3.386 -2.584 1.00 0.35 C ATOM 0 H ILE A 40 -4.109 0.589 0.200 1.00 0.19 H new ATOM 0 HA ILE A 40 -2.159 -0.337 -1.789 1.00 0.20 H new ATOM 0 HB ILE A 40 -2.245 2.371 -0.492 1.00 0.23 H new ATOM 0 HG12 ILE A 40 -4.066 1.274 -2.670 1.00 0.30 H new ATOM 0 HG13 ILE A 40 -4.551 1.988 -1.145 1.00 0.30 H new ATOM 0 HG21 ILE A 40 -1.399 3.057 -2.689 1.00 0.37 H new ATOM 0 HG22 ILE A 40 -0.370 1.805 -1.954 1.00 0.37 H new ATOM 0 HG23 ILE A 40 -1.504 1.373 -3.256 1.00 0.37 H new ATOM 0 HD11 ILE A 40 -4.852 3.562 -2.984 1.00 0.35 H new ATOM 0 HD12 ILE A 40 -3.618 4.152 -1.845 1.00 0.35 H new ATOM 0 HD13 ILE A 40 -3.125 3.428 -3.394 1.00 0.35 H new ATOM 481 N TYR A 41 -0.321 -0.788 -0.250 1.00 0.18 N ATOM 482 CA TYR A 41 0.733 -1.204 0.646 1.00 0.19 C ATOM 483 C TYR A 41 2.020 -0.473 0.310 1.00 0.20 C ATOM 484 O TYR A 41 2.480 -0.534 -0.822 1.00 0.27 O ATOM 485 CB TYR A 41 0.989 -2.728 0.533 1.00 0.20 C ATOM 486 CG TYR A 41 -0.168 -3.637 0.905 1.00 0.20 C ATOM 487 CD1 TYR A 41 -1.446 -3.405 0.439 1.00 0.27 C ATOM 488 CD2 TYR A 41 0.040 -4.763 1.698 1.00 0.29 C ATOM 489 CE1 TYR A 41 -2.483 -4.257 0.750 1.00 0.32 C ATOM 490 CE2 TYR A 41 -1.000 -5.620 2.018 1.00 0.35 C ATOM 491 CZ TYR A 41 -2.258 -5.359 1.537 1.00 0.33 C ATOM 492 OH TYR A 41 -3.297 -6.207 1.833 1.00 0.42 O ATOM 0 H TYR A 41 -0.254 -1.193 -1.184 1.00 0.18 H new ATOM 0 HA TYR A 41 0.418 -0.966 1.662 1.00 0.19 H new ATOM 0 HB2 TYR A 41 1.281 -2.950 -0.493 1.00 0.20 H new ATOM 0 HB3 TYR A 41 1.839 -2.980 1.168 1.00 0.20 H new ATOM 0 HD1 TYR A 41 -1.637 -2.541 -0.180 1.00 0.27 H new ATOM 0 HD2 TYR A 41 1.032 -4.972 2.071 1.00 0.29 H new ATOM 0 HE1 TYR A 41 -3.475 -4.057 0.374 1.00 0.32 H new ATOM 0 HE2 TYR A 41 -0.822 -6.485 2.640 1.00 0.35 H new ATOM 0 HH TYR A 41 -4.116 -5.884 1.402 1.00 0.42 H new ATOM 502 N ASN A 42 2.607 0.199 1.286 1.00 0.28 N ATOM 503 CA ASN A 42 3.956 0.716 1.122 1.00 0.34 C ATOM 504 C ASN A 42 4.839 -0.497 1.260 1.00 0.37 C ATOM 505 O ASN A 42 4.708 -1.259 2.203 1.00 0.54 O ATOM 506 CB ASN A 42 4.292 1.751 2.205 1.00 0.46 C ATOM 507 CG ASN A 42 5.052 1.169 3.383 1.00 1.50 C ATOM 508 OD1 ASN A 42 4.459 0.681 4.330 1.00 2.27 O ATOM 509 ND2 ASN A 42 6.374 1.235 3.339 1.00 2.35 N ATOM 0 H ASN A 42 2.178 0.398 2.190 1.00 0.28 H new ATOM 0 HA ASN A 42 4.085 1.226 0.168 1.00 0.34 H new ATOM 0 HB2 ASN A 42 4.884 2.551 1.761 1.00 0.46 H new ATOM 0 HB3 ASN A 42 3.367 2.201 2.566 1.00 0.46 H new ATOM 0 HD21 ASN A 42 6.929 0.871 4.113 1.00 2.35 H new ATOM 0 HD22 ASN A 42 6.837 1.650 2.531 1.00 2.35 H new ATOM 516 N VAL A 43 5.680 -0.756 0.311 1.00 0.36 N ATOM 517 CA VAL A 43 6.344 -2.024 0.339 1.00 0.38 C ATOM 518 C VAL A 43 7.832 -1.919 0.107 1.00 0.42 C ATOM 519 O VAL A 43 8.293 -1.367 -0.891 1.00 0.50 O ATOM 520 CB VAL A 43 5.689 -3.003 -0.649 1.00 0.39 C ATOM 521 CG1 VAL A 43 5.532 -2.403 -2.025 1.00 1.03 C ATOM 522 CG2 VAL A 43 6.479 -4.272 -0.720 1.00 0.98 C ATOM 0 H VAL A 43 5.919 -0.138 -0.464 1.00 0.36 H new ATOM 0 HA VAL A 43 6.225 -2.418 1.348 1.00 0.38 H new ATOM 0 HB VAL A 43 4.688 -3.222 -0.276 1.00 0.39 H new ATOM 0 HG11 VAL A 43 5.065 -3.131 -2.688 1.00 1.03 H new ATOM 0 HG12 VAL A 43 4.906 -1.513 -1.965 1.00 1.03 H new ATOM 0 HG13 VAL A 43 6.512 -2.131 -2.417 1.00 1.03 H new ATOM 0 HG21 VAL A 43 6.005 -4.957 -1.423 1.00 0.98 H new ATOM 0 HG22 VAL A 43 7.492 -4.051 -1.056 1.00 0.98 H new ATOM 0 HG23 VAL A 43 6.516 -4.733 0.267 1.00 0.98 H new ATOM 532 N ALA A 44 8.586 -2.444 1.056 1.00 0.50 N ATOM 533 CA ALA A 44 10.008 -2.562 0.877 1.00 0.59 C ATOM 534 C ALA A 44 10.288 -3.701 -0.087 1.00 0.58 C ATOM 535 O ALA A 44 10.225 -4.875 0.277 1.00 0.88 O ATOM 536 CB ALA A 44 10.706 -2.790 2.209 1.00 0.83 C ATOM 0 H ALA A 44 8.234 -2.791 1.949 1.00 0.50 H new ATOM 0 HA ALA A 44 10.400 -1.633 0.462 1.00 0.59 H new ATOM 0 HB1 ALA A 44 11.780 -2.876 2.047 1.00 0.83 H new ATOM 0 HB2 ALA A 44 10.505 -1.950 2.873 1.00 0.83 H new ATOM 0 HB3 ALA A 44 10.333 -3.708 2.663 1.00 0.83 H new ATOM 542 N SER A 45 10.501 -3.311 -1.330 1.00 0.57 N ATOM 543 CA SER A 45 11.011 -4.176 -2.391 1.00 0.63 C ATOM 544 C SER A 45 12.237 -4.969 -1.947 1.00 1.01 C ATOM 545 O SER A 45 13.368 -4.581 -2.221 1.00 1.78 O ATOM 546 CB SER A 45 11.378 -3.315 -3.596 1.00 0.73 C ATOM 547 OG SER A 45 12.009 -2.111 -3.191 1.00 1.62 O ATOM 0 H SER A 45 10.320 -2.357 -1.644 1.00 0.57 H new ATOM 0 HA SER A 45 10.230 -4.892 -2.647 1.00 0.63 H new ATOM 0 HB2 SER A 45 12.042 -3.873 -4.256 1.00 0.73 H new ATOM 0 HB3 SER A 45 10.480 -3.084 -4.168 1.00 0.73 H new ATOM 0 HG SER A 45 12.377 -1.655 -3.976 1.00 1.62 H new ATOM 553 N LYS A 46 12.002 -6.070 -1.265 1.00 1.32 N ATOM 554 CA LYS A 46 13.069 -6.936 -0.803 1.00 1.69 C ATOM 555 C LYS A 46 13.174 -8.138 -1.725 1.00 1.14 C ATOM 556 O LYS A 46 12.252 -8.415 -2.492 1.00 1.47 O ATOM 557 CB LYS A 46 12.781 -7.383 0.632 1.00 2.68 C ATOM 558 CG LYS A 46 12.748 -6.228 1.626 1.00 3.45 C ATOM 559 CD LYS A 46 12.094 -6.624 2.944 1.00 4.39 C ATOM 560 CE LYS A 46 12.909 -7.651 3.716 1.00 5.19 C ATOM 561 NZ LYS A 46 14.191 -7.097 4.217 1.00 5.84 N ATOM 0 H LYS A 46 11.067 -6.391 -1.015 1.00 1.32 H new ATOM 0 HA LYS A 46 14.016 -6.397 -0.816 1.00 1.69 H new ATOM 0 HB2 LYS A 46 11.824 -7.904 0.658 1.00 2.68 H new ATOM 0 HB3 LYS A 46 13.542 -8.099 0.942 1.00 2.68 H new ATOM 0 HG2 LYS A 46 13.765 -5.884 1.815 1.00 3.45 H new ATOM 0 HG3 LYS A 46 12.204 -5.390 1.189 1.00 3.45 H new ATOM 0 HD2 LYS A 46 11.959 -5.735 3.560 1.00 4.39 H new ATOM 0 HD3 LYS A 46 11.101 -7.028 2.746 1.00 4.39 H new ATOM 0 HE2 LYS A 46 12.322 -8.018 4.558 1.00 5.19 H new ATOM 0 HE3 LYS A 46 13.113 -8.507 3.072 1.00 5.19 H new ATOM 0 HZ1 LYS A 46 14.789 -7.871 4.570 1.00 5.84 H new ATOM 0 HZ2 LYS A 46 14.682 -6.604 3.444 1.00 5.84 H new ATOM 0 HZ3 LYS A 46 14.001 -6.427 4.989 1.00 5.84 H new ATOM 575 N CYS A 47 14.282 -8.851 -1.654 1.00 1.21 N ATOM 576 CA CYS A 47 14.474 -10.020 -2.489 1.00 1.53 C ATOM 577 C CYS A 47 14.430 -11.280 -1.638 1.00 1.99 C ATOM 578 O CYS A 47 15.263 -11.475 -0.752 1.00 2.46 O ATOM 579 CB CYS A 47 15.803 -9.918 -3.246 1.00 2.04 C ATOM 580 SG CYS A 47 16.250 -11.401 -4.180 1.00 3.55 S ATOM 0 H CYS A 47 15.060 -8.642 -1.029 1.00 1.21 H new ATOM 0 HA CYS A 47 13.669 -10.071 -3.222 1.00 1.53 H new ATOM 0 HB2 CYS A 47 15.751 -9.073 -3.933 1.00 2.04 H new ATOM 0 HB3 CYS A 47 16.597 -9.700 -2.532 1.00 2.04 H new ATOM 0 HG CYS A 47 17.386 -11.209 -4.782 1.00 3.55 H new ATOM 586 N GLY A 48 13.442 -12.125 -1.909 1.00 2.39 N ATOM 587 CA GLY A 48 13.286 -13.365 -1.171 1.00 2.91 C ATOM 588 C GLY A 48 12.913 -13.138 0.284 1.00 2.40 C ATOM 589 O GLY A 48 13.177 -13.986 1.136 1.00 2.46 O ATOM 0 H GLY A 48 12.740 -11.971 -2.633 1.00 2.39 H new ATOM 0 HA2 GLY A 48 12.517 -13.973 -1.648 1.00 2.91 H new ATOM 0 HA3 GLY A 48 14.216 -13.931 -1.219 1.00 2.91 H new ATOM 593 N TYR A 49 12.291 -12.001 0.572 1.00 2.15 N ATOM 594 CA TYR A 49 11.936 -11.659 1.941 1.00 1.79 C ATOM 595 C TYR A 49 10.521 -11.092 2.027 1.00 1.42 C ATOM 596 O TYR A 49 10.125 -10.251 1.221 1.00 1.67 O ATOM 597 CB TYR A 49 12.936 -10.656 2.522 1.00 2.10 C ATOM 598 CG TYR A 49 13.875 -11.252 3.546 1.00 2.40 C ATOM 599 CD1 TYR A 49 13.388 -11.930 4.656 1.00 2.66 C ATOM 600 CD2 TYR A 49 15.252 -11.150 3.391 1.00 3.01 C ATOM 601 CE1 TYR A 49 14.247 -12.484 5.586 1.00 3.26 C ATOM 602 CE2 TYR A 49 16.116 -11.702 4.315 1.00 3.74 C ATOM 603 CZ TYR A 49 15.594 -12.327 5.449 1.00 3.76 C ATOM 604 OH TYR A 49 16.474 -12.921 6.331 1.00 4.63 O ATOM 0 H TYR A 49 12.023 -11.303 -0.122 1.00 2.15 H new ATOM 0 HA TYR A 49 11.970 -12.577 2.527 1.00 1.79 H new ATOM 0 HB2 TYR A 49 13.524 -10.231 1.708 1.00 2.10 H new ATOM 0 HB3 TYR A 49 12.387 -9.834 2.982 1.00 2.10 H new ATOM 0 HD1 TYR A 49 12.321 -12.026 4.795 1.00 2.66 H new ATOM 0 HD2 TYR A 49 15.653 -10.630 2.533 1.00 3.01 H new ATOM 0 HE1 TYR A 49 13.851 -13.042 6.422 1.00 3.26 H new ATOM 0 HE2 TYR A 49 17.184 -11.651 4.162 1.00 3.74 H new ATOM 0 HH TYR A 49 17.394 -12.699 6.075 1.00 4.63 H new ATOM 614 N THR A 50 9.773 -11.569 3.014 1.00 1.05 N ATOM 615 CA THR A 50 8.405 -11.122 3.259 1.00 0.81 C ATOM 616 C THR A 50 8.093 -11.175 4.758 1.00 0.77 C ATOM 617 O THR A 50 8.525 -12.097 5.447 1.00 1.44 O ATOM 618 CB THR A 50 7.386 -11.998 2.495 1.00 1.09 C ATOM 619 OG1 THR A 50 6.070 -11.820 3.040 1.00 1.93 O ATOM 620 CG2 THR A 50 7.768 -13.471 2.549 1.00 1.87 C ATOM 0 H THR A 50 10.098 -12.279 3.670 1.00 1.05 H new ATOM 0 HA THR A 50 8.321 -10.096 2.901 1.00 0.81 H new ATOM 0 HB THR A 50 7.394 -11.681 1.452 1.00 1.09 H new ATOM 0 HG1 THR A 50 5.609 -12.684 3.071 1.00 1.93 H new ATOM 0 HG21 THR A 50 7.030 -14.058 2.002 1.00 1.87 H new ATOM 0 HG22 THR A 50 8.750 -13.609 2.096 1.00 1.87 H new ATOM 0 HG23 THR A 50 7.797 -13.801 3.587 1.00 1.87 H new ATOM 628 N LYS A 51 7.355 -10.188 5.269 1.00 0.61 N ATOM 629 CA LYS A 51 6.951 -10.191 6.665 1.00 0.56 C ATOM 630 C LYS A 51 5.448 -10.369 6.776 1.00 0.76 C ATOM 631 O LYS A 51 4.782 -9.606 7.461 1.00 1.55 O ATOM 632 CB LYS A 51 7.387 -8.894 7.355 1.00 0.59 C ATOM 633 CG LYS A 51 8.876 -8.846 7.659 1.00 1.22 C ATOM 634 CD LYS A 51 9.250 -7.623 8.481 1.00 1.39 C ATOM 635 CE LYS A 51 8.561 -7.607 9.837 1.00 1.46 C ATOM 636 NZ LYS A 51 8.949 -8.768 10.680 1.00 2.01 N ATOM 0 H LYS A 51 7.029 -9.382 4.735 1.00 0.61 H new ATOM 0 HA LYS A 51 7.440 -11.027 7.165 1.00 0.56 H new ATOM 0 HB2 LYS A 51 7.125 -8.047 6.720 1.00 0.59 H new ATOM 0 HB3 LYS A 51 6.829 -8.780 8.285 1.00 0.59 H new ATOM 0 HG2 LYS A 51 9.165 -9.748 8.199 1.00 1.22 H new ATOM 0 HG3 LYS A 51 9.437 -8.840 6.724 1.00 1.22 H new ATOM 0 HD2 LYS A 51 10.330 -7.601 8.624 1.00 1.39 H new ATOM 0 HD3 LYS A 51 8.983 -6.722 7.929 1.00 1.39 H new ATOM 0 HE2 LYS A 51 8.811 -6.683 10.358 1.00 1.46 H new ATOM 0 HE3 LYS A 51 7.481 -7.610 9.693 1.00 1.46 H new ATOM 0 HZ1 LYS A 51 8.578 -8.637 11.643 1.00 2.01 H new ATOM 0 HZ2 LYS A 51 8.555 -9.640 10.273 1.00 2.01 H new ATOM 0 HZ3 LYS A 51 9.986 -8.840 10.715 1.00 2.01 H new ATOM 650 N GLY A 52 4.913 -11.355 6.064 1.00 0.45 N ATOM 651 CA GLY A 52 3.484 -11.603 6.096 1.00 0.51 C ATOM 652 C GLY A 52 2.744 -10.807 5.040 1.00 0.41 C ATOM 653 O GLY A 52 1.849 -11.329 4.377 1.00 0.41 O ATOM 0 H GLY A 52 5.444 -11.987 5.465 1.00 0.45 H new ATOM 0 HA2 GLY A 52 3.297 -12.666 5.945 1.00 0.51 H new ATOM 0 HA3 GLY A 52 3.094 -11.348 7.081 1.00 0.51 H new ATOM 657 N GLY A 53 3.139 -9.544 4.887 1.00 0.44 N ATOM 658 CA GLY A 53 2.530 -8.646 3.915 1.00 0.50 C ATOM 659 C GLY A 53 2.379 -9.254 2.536 1.00 0.36 C ATOM 660 O GLY A 53 1.328 -9.138 1.920 1.00 0.32 O ATOM 0 H GLY A 53 3.888 -9.118 5.433 1.00 0.44 H new ATOM 0 HA2 GLY A 53 1.548 -8.343 4.279 1.00 0.50 H new ATOM 0 HA3 GLY A 53 3.135 -7.742 3.840 1.00 0.50 H new ATOM 664 N TYR A 54 3.425 -9.914 2.059 1.00 0.37 N ATOM 665 CA TYR A 54 3.469 -10.408 0.692 1.00 0.36 C ATOM 666 C TYR A 54 2.359 -11.422 0.412 1.00 0.26 C ATOM 667 O TYR A 54 1.486 -11.177 -0.417 1.00 0.25 O ATOM 668 CB TYR A 54 4.832 -11.038 0.452 1.00 0.45 C ATOM 669 CG TYR A 54 5.147 -11.341 -0.984 1.00 0.41 C ATOM 670 CD1 TYR A 54 4.270 -10.951 -1.974 1.00 0.45 C ATOM 671 CD2 TYR A 54 6.296 -12.027 -1.347 1.00 0.53 C ATOM 672 CE1 TYR A 54 4.521 -11.226 -3.294 1.00 0.46 C ATOM 673 CE2 TYR A 54 6.565 -12.310 -2.670 1.00 0.65 C ATOM 674 CZ TYR A 54 5.788 -11.897 -3.622 1.00 0.56 C ATOM 675 OH TYR A 54 5.930 -12.171 -4.971 1.00 0.70 O ATOM 0 H TYR A 54 4.261 -10.121 2.605 1.00 0.37 H new ATOM 0 HA TYR A 54 3.310 -9.571 0.012 1.00 0.36 H new ATOM 0 HB2 TYR A 54 5.599 -10.369 0.843 1.00 0.45 H new ATOM 0 HB3 TYR A 54 4.894 -11.963 1.025 1.00 0.45 H new ATOM 0 HD1 TYR A 54 3.369 -10.419 -1.705 1.00 0.45 H new ATOM 0 HD2 TYR A 54 6.990 -12.344 -0.583 1.00 0.53 H new ATOM 0 HE1 TYR A 54 3.813 -10.959 -4.065 1.00 0.46 H new ATOM 0 HE2 TYR A 54 7.443 -12.889 -2.918 1.00 0.65 H new ATOM 0 HH TYR A 54 5.981 -11.330 -5.472 1.00 0.70 H new ATOM 685 N GLU A 55 2.394 -12.544 1.114 1.00 0.25 N ATOM 686 CA GLU A 55 1.413 -13.613 0.928 1.00 0.27 C ATOM 687 C GLU A 55 -0.008 -13.110 1.194 1.00 0.22 C ATOM 688 O GLU A 55 -0.952 -13.454 0.478 1.00 0.25 O ATOM 689 CB GLU A 55 1.759 -14.780 1.851 1.00 0.36 C ATOM 690 CG GLU A 55 2.136 -14.334 3.251 1.00 1.14 C ATOM 691 CD GLU A 55 2.408 -15.490 4.188 1.00 1.92 C ATOM 692 OE1 GLU A 55 3.518 -16.055 4.141 1.00 2.39 O ATOM 693 OE2 GLU A 55 1.502 -15.843 4.971 1.00 2.61 O ATOM 0 H GLU A 55 3.097 -12.743 1.826 1.00 0.25 H new ATOM 0 HA GLU A 55 1.449 -13.951 -0.108 1.00 0.27 H new ATOM 0 HB2 GLU A 55 0.906 -15.457 1.908 1.00 0.36 H new ATOM 0 HB3 GLU A 55 2.586 -15.345 1.420 1.00 0.36 H new ATOM 0 HG2 GLU A 55 3.022 -13.701 3.198 1.00 1.14 H new ATOM 0 HG3 GLU A 55 1.331 -13.723 3.661 1.00 1.14 H new ATOM 700 N THR A 56 -0.130 -12.285 2.223 1.00 0.25 N ATOM 701 CA THR A 56 -1.369 -11.615 2.568 1.00 0.24 C ATOM 702 C THR A 56 -1.913 -10.830 1.392 1.00 0.21 C ATOM 703 O THR A 56 -3.002 -11.110 0.893 1.00 0.22 O ATOM 704 CB THR A 56 -1.102 -10.668 3.749 1.00 0.26 C ATOM 705 OG1 THR A 56 -0.782 -11.440 4.915 1.00 0.33 O ATOM 706 CG2 THR A 56 -2.279 -9.753 4.024 1.00 0.25 C ATOM 0 H THR A 56 0.643 -12.061 2.850 1.00 0.25 H new ATOM 0 HA THR A 56 -2.113 -12.363 2.842 1.00 0.24 H new ATOM 0 HB THR A 56 -0.259 -10.029 3.487 1.00 0.26 H new ATOM 0 HG1 THR A 56 0.189 -11.563 4.970 1.00 0.33 H new ATOM 0 HG21 THR A 56 -2.045 -9.102 4.866 1.00 0.25 H new ATOM 0 HG22 THR A 56 -2.482 -9.146 3.142 1.00 0.25 H new ATOM 0 HG23 THR A 56 -3.158 -10.352 4.262 1.00 0.25 H new ATOM 714 N ALA A 57 -1.122 -9.888 0.928 1.00 0.19 N ATOM 715 CA ALA A 57 -1.524 -9.008 -0.140 1.00 0.20 C ATOM 716 C ALA A 57 -1.804 -9.785 -1.414 1.00 0.19 C ATOM 717 O ALA A 57 -2.786 -9.513 -2.106 1.00 0.22 O ATOM 718 CB ALA A 57 -0.441 -7.979 -0.376 1.00 0.22 C ATOM 0 H ALA A 57 -0.182 -9.713 1.283 1.00 0.19 H new ATOM 0 HA ALA A 57 -2.447 -8.505 0.149 1.00 0.20 H new ATOM 0 HB1 ALA A 57 -0.743 -7.312 -1.184 1.00 0.22 H new ATOM 0 HB2 ALA A 57 -0.285 -7.400 0.534 1.00 0.22 H new ATOM 0 HB3 ALA A 57 0.486 -8.483 -0.649 1.00 0.22 H new ATOM 724 N THR A 58 -0.937 -10.755 -1.716 1.00 0.17 N ATOM 725 CA THR A 58 -1.060 -11.548 -2.935 1.00 0.17 C ATOM 726 C THR A 58 -2.447 -12.189 -2.999 1.00 0.17 C ATOM 727 O THR A 58 -3.177 -12.063 -3.986 1.00 0.19 O ATOM 728 CB THR A 58 -0.009 -12.669 -2.986 1.00 0.20 C ATOM 729 OG1 THR A 58 1.313 -12.124 -2.861 1.00 0.24 O ATOM 730 CG2 THR A 58 -0.113 -13.456 -4.285 1.00 0.26 C ATOM 0 H THR A 58 -0.142 -11.008 -1.130 1.00 0.17 H new ATOM 0 HA THR A 58 -0.906 -10.876 -3.779 1.00 0.17 H new ATOM 0 HB THR A 58 -0.202 -13.343 -2.151 1.00 0.20 H new ATOM 0 HG1 THR A 58 1.558 -12.074 -1.913 1.00 0.24 H new ATOM 0 HG21 THR A 58 0.642 -14.243 -4.295 1.00 0.26 H new ATOM 0 HG22 THR A 58 -1.104 -13.903 -4.361 1.00 0.26 H new ATOM 0 HG23 THR A 58 0.049 -12.787 -5.130 1.00 0.26 H new ATOM 738 N THR A 59 -2.797 -12.848 -1.903 1.00 0.16 N ATOM 739 CA THR A 59 -4.050 -13.567 -1.792 1.00 0.17 C ATOM 740 C THR A 59 -5.230 -12.606 -1.677 1.00 0.16 C ATOM 741 O THR A 59 -6.301 -12.859 -2.220 1.00 0.19 O ATOM 742 CB THR A 59 -4.017 -14.500 -0.566 1.00 0.20 C ATOM 743 OG1 THR A 59 -2.835 -15.312 -0.614 1.00 0.48 O ATOM 744 CG2 THR A 59 -5.246 -15.392 -0.524 1.00 0.46 C ATOM 0 H THR A 59 -2.216 -12.897 -1.066 1.00 0.16 H new ATOM 0 HA THR A 59 -4.179 -14.160 -2.697 1.00 0.17 H new ATOM 0 HB THR A 59 -4.010 -13.885 0.334 1.00 0.20 H new ATOM 0 HG1 THR A 59 -2.077 -14.809 -0.249 1.00 0.48 H new ATOM 0 HG21 THR A 59 -5.196 -16.040 0.351 1.00 0.46 H new ATOM 0 HG22 THR A 59 -6.142 -14.774 -0.467 1.00 0.46 H new ATOM 0 HG23 THR A 59 -5.283 -16.003 -1.426 1.00 0.46 H new ATOM 752 N LEU A 60 -5.013 -11.487 -1.004 1.00 0.13 N ATOM 753 CA LEU A 60 -6.067 -10.522 -0.758 1.00 0.13 C ATOM 754 C LEU A 60 -6.497 -9.875 -2.046 1.00 0.13 C ATOM 755 O LEU A 60 -7.683 -9.819 -2.370 1.00 0.15 O ATOM 756 CB LEU A 60 -5.577 -9.465 0.212 1.00 0.13 C ATOM 757 CG LEU A 60 -5.716 -9.847 1.670 1.00 0.14 C ATOM 758 CD1 LEU A 60 -5.082 -8.797 2.553 1.00 0.43 C ATOM 759 CD2 LEU A 60 -7.183 -10.004 2.007 1.00 0.35 C ATOM 0 H LEU A 60 -4.107 -11.225 -0.616 1.00 0.13 H new ATOM 0 HA LEU A 60 -6.923 -11.040 -0.325 1.00 0.13 H new ATOM 0 HB2 LEU A 60 -4.529 -9.254 0.002 1.00 0.13 H new ATOM 0 HB3 LEU A 60 -6.130 -8.542 0.036 1.00 0.13 H new ATOM 0 HG LEU A 60 -5.203 -10.792 1.845 1.00 0.14 H new ATOM 0 HD11 LEU A 60 -5.191 -9.087 3.598 1.00 0.43 H new ATOM 0 HD12 LEU A 60 -4.023 -8.708 2.309 1.00 0.43 H new ATOM 0 HD13 LEU A 60 -5.574 -7.838 2.389 1.00 0.43 H new ATOM 0 HD21 LEU A 60 -7.288 -10.279 3.056 1.00 0.35 H new ATOM 0 HD22 LEU A 60 -7.701 -9.062 1.825 1.00 0.35 H new ATOM 0 HD23 LEU A 60 -7.618 -10.784 1.382 1.00 0.35 H new ATOM 771 N TYR A 61 -5.516 -9.403 -2.785 1.00 0.14 N ATOM 772 CA TYR A 61 -5.767 -8.767 -4.048 1.00 0.15 C ATOM 773 C TYR A 61 -6.478 -9.725 -4.996 1.00 0.17 C ATOM 774 O TYR A 61 -7.464 -9.381 -5.597 1.00 0.22 O ATOM 775 CB TYR A 61 -4.464 -8.296 -4.672 1.00 0.17 C ATOM 776 CG TYR A 61 -4.684 -7.620 -5.991 1.00 0.18 C ATOM 777 CD1 TYR A 61 -5.805 -6.861 -6.222 1.00 0.16 C ATOM 778 CD2 TYR A 61 -3.758 -7.751 -7.008 1.00 0.28 C ATOM 779 CE1 TYR A 61 -6.015 -6.244 -7.441 1.00 0.18 C ATOM 780 CE2 TYR A 61 -3.953 -7.143 -8.230 1.00 0.31 C ATOM 781 CZ TYR A 61 -5.094 -6.345 -8.420 1.00 0.23 C ATOM 782 OH TYR A 61 -5.286 -5.781 -9.663 1.00 0.28 O ATOM 0 H TYR A 61 -4.531 -9.452 -2.525 1.00 0.14 H new ATOM 0 HA TYR A 61 -6.409 -7.903 -3.874 1.00 0.15 H new ATOM 0 HB2 TYR A 61 -3.964 -7.607 -3.991 1.00 0.17 H new ATOM 0 HB3 TYR A 61 -3.799 -9.149 -4.808 1.00 0.17 H new ATOM 0 HD1 TYR A 61 -6.537 -6.744 -5.436 1.00 0.16 H new ATOM 0 HD2 TYR A 61 -2.867 -8.339 -6.843 1.00 0.28 H new ATOM 0 HE1 TYR A 61 -6.920 -5.679 -7.610 1.00 0.18 H new ATOM 0 HE2 TYR A 61 -3.239 -7.278 -9.029 1.00 0.31 H new ATOM 0 HH TYR A 61 -4.507 -5.963 -10.229 1.00 0.28 H new ATOM 792 N ASN A 62 -5.984 -10.936 -5.092 1.00 0.18 N ATOM 793 CA ASN A 62 -6.496 -11.907 -6.042 1.00 0.22 C ATOM 794 C ASN A 62 -7.834 -12.454 -5.624 1.00 0.20 C ATOM 795 O ASN A 62 -8.605 -12.930 -6.456 1.00 0.24 O ATOM 796 CB ASN A 62 -5.496 -13.030 -6.253 1.00 0.27 C ATOM 797 CG ASN A 62 -4.714 -12.800 -7.517 1.00 0.75 C ATOM 798 OD1 ASN A 62 -3.858 -11.797 -7.492 1.00 1.21 O flip ATOM 799 ND2 ASN A 62 -4.921 -13.475 -8.525 1.00 1.12 N flip ATOM 0 H ASN A 62 -5.216 -11.281 -4.516 1.00 0.18 H new ATOM 0 HA ASN A 62 -6.642 -11.388 -6.990 1.00 0.22 H new ATOM 0 HB2 ASN A 62 -4.817 -13.087 -5.402 1.00 0.27 H new ATOM 0 HB3 ASN A 62 -6.018 -13.985 -6.309 1.00 0.27 H new ATOM 0 HD21 ASN A 62 -5.593 -14.242 -8.496 1.00 1.12 H new ATOM 0 HD22 ASN A 62 -4.420 -13.268 -9.389 1.00 1.12 H new ATOM 806 N LYS A 63 -8.114 -12.407 -4.341 1.00 0.18 N ATOM 807 CA LYS A 63 -9.372 -12.912 -3.860 1.00 0.20 C ATOM 808 C LYS A 63 -10.425 -11.837 -3.994 1.00 0.18 C ATOM 809 O LYS A 63 -11.611 -12.133 -4.141 1.00 0.22 O ATOM 810 CB LYS A 63 -9.257 -13.378 -2.405 1.00 0.26 C ATOM 811 CG LYS A 63 -10.570 -13.874 -1.811 1.00 0.29 C ATOM 812 CD LYS A 63 -10.346 -14.875 -0.690 1.00 0.64 C ATOM 813 CE LYS A 63 -9.644 -14.251 0.500 1.00 0.91 C ATOM 814 NZ LYS A 63 -9.519 -15.210 1.623 1.00 1.54 N ATOM 0 H LYS A 63 -7.495 -12.029 -3.624 1.00 0.18 H new ATOM 0 HA LYS A 63 -9.660 -13.776 -4.460 1.00 0.20 H new ATOM 0 HB2 LYS A 63 -8.518 -14.177 -2.347 1.00 0.26 H new ATOM 0 HB3 LYS A 63 -8.883 -12.553 -1.798 1.00 0.26 H new ATOM 0 HG2 LYS A 63 -11.139 -13.026 -1.431 1.00 0.29 H new ATOM 0 HG3 LYS A 63 -11.171 -14.336 -2.595 1.00 0.29 H new ATOM 0 HD2 LYS A 63 -11.305 -15.283 -0.372 1.00 0.64 H new ATOM 0 HD3 LYS A 63 -9.753 -15.710 -1.063 1.00 0.64 H new ATOM 0 HE2 LYS A 63 -8.653 -13.909 0.201 1.00 0.91 H new ATOM 0 HE3 LYS A 63 -10.198 -13.373 0.831 1.00 0.91 H new ATOM 0 HZ1 LYS A 63 -9.843 -14.759 2.502 1.00 1.54 H new ATOM 0 HZ2 LYS A 63 -10.102 -16.049 1.429 1.00 1.54 H new ATOM 0 HZ3 LYS A 63 -8.524 -15.495 1.727 1.00 1.54 H new ATOM 828 N TYR A 64 -9.997 -10.579 -3.980 1.00 0.16 N ATOM 829 CA TYR A 64 -10.957 -9.510 -3.871 1.00 0.16 C ATOM 830 C TYR A 64 -10.912 -8.487 -4.991 1.00 0.17 C ATOM 831 O TYR A 64 -11.788 -7.623 -5.066 1.00 0.17 O ATOM 832 CB TYR A 64 -10.834 -8.880 -2.503 1.00 0.15 C ATOM 833 CG TYR A 64 -11.300 -9.830 -1.434 1.00 0.17 C ATOM 834 CD1 TYR A 64 -12.569 -10.380 -1.514 1.00 0.19 C ATOM 835 CD2 TYR A 64 -10.490 -10.192 -0.370 1.00 0.19 C ATOM 836 CE1 TYR A 64 -13.026 -11.263 -0.569 1.00 0.23 C ATOM 837 CE2 TYR A 64 -10.939 -11.077 0.590 1.00 0.23 C ATOM 838 CZ TYR A 64 -12.210 -11.612 0.486 1.00 0.24 C ATOM 839 OH TYR A 64 -12.656 -12.509 1.430 1.00 0.31 O ATOM 0 H TYR A 64 -9.021 -10.289 -4.041 1.00 0.16 H new ATOM 0 HA TYR A 64 -11.946 -9.954 -3.988 1.00 0.16 H new ATOM 0 HB2 TYR A 64 -9.797 -8.599 -2.319 1.00 0.15 H new ATOM 0 HB3 TYR A 64 -11.424 -7.964 -2.465 1.00 0.15 H new ATOM 0 HD1 TYR A 64 -13.212 -10.108 -2.338 1.00 0.19 H new ATOM 0 HD2 TYR A 64 -9.496 -9.777 -0.291 1.00 0.19 H new ATOM 0 HE1 TYR A 64 -14.018 -11.682 -0.651 1.00 0.23 H new ATOM 0 HE2 TYR A 64 -10.301 -11.350 1.418 1.00 0.23 H new ATOM 0 HH TYR A 64 -11.959 -12.647 2.105 1.00 0.31 H new ATOM 849 N LYS A 65 -9.945 -8.592 -5.884 1.00 0.20 N ATOM 850 CA LYS A 65 -9.947 -7.744 -7.065 1.00 0.23 C ATOM 851 C LYS A 65 -11.135 -8.105 -7.906 1.00 0.20 C ATOM 852 O LYS A 65 -11.676 -7.272 -8.630 1.00 0.22 O ATOM 853 CB LYS A 65 -8.649 -7.841 -7.876 1.00 0.34 C ATOM 854 CG LYS A 65 -8.283 -9.221 -8.400 1.00 0.29 C ATOM 855 CD LYS A 65 -6.962 -9.166 -9.150 1.00 0.38 C ATOM 856 CE LYS A 65 -6.816 -10.325 -10.126 1.00 0.80 C ATOM 857 NZ LYS A 65 -5.578 -10.211 -10.948 1.00 1.35 N ATOM 0 H LYS A 65 -9.162 -9.242 -5.819 1.00 0.20 H new ATOM 0 HA LYS A 65 -10.012 -6.705 -6.740 1.00 0.23 H new ATOM 0 HB2 LYS A 65 -8.725 -7.162 -8.725 1.00 0.34 H new ATOM 0 HB3 LYS A 65 -7.829 -7.483 -7.253 1.00 0.34 H new ATOM 0 HG2 LYS A 65 -8.209 -9.925 -7.571 1.00 0.29 H new ATOM 0 HG3 LYS A 65 -9.069 -9.587 -9.060 1.00 0.29 H new ATOM 0 HD2 LYS A 65 -6.891 -8.223 -9.692 1.00 0.38 H new ATOM 0 HD3 LYS A 65 -6.138 -9.186 -8.437 1.00 0.38 H new ATOM 0 HE2 LYS A 65 -6.799 -11.264 -9.573 1.00 0.80 H new ATOM 0 HE3 LYS A 65 -7.685 -10.358 -10.783 1.00 0.80 H new ATOM 0 HZ1 LYS A 65 -5.518 -11.020 -11.599 1.00 1.35 H new ATOM 0 HZ2 LYS A 65 -5.605 -9.327 -11.496 1.00 1.35 H new ATOM 0 HZ3 LYS A 65 -4.746 -10.206 -10.324 1.00 1.35 H new ATOM 871 N SER A 66 -11.555 -9.351 -7.755 1.00 0.23 N ATOM 872 CA SER A 66 -12.785 -9.829 -8.378 1.00 0.26 C ATOM 873 C SER A 66 -13.940 -8.844 -8.129 1.00 0.25 C ATOM 874 O SER A 66 -14.721 -8.553 -9.038 1.00 0.31 O ATOM 875 CB SER A 66 -13.141 -11.218 -7.838 1.00 0.32 C ATOM 876 OG SER A 66 -14.287 -11.750 -8.484 1.00 1.28 O ATOM 0 H SER A 66 -11.062 -10.054 -7.205 1.00 0.23 H new ATOM 0 HA SER A 66 -12.625 -9.899 -9.454 1.00 0.26 H new ATOM 0 HB2 SER A 66 -12.296 -11.892 -7.980 1.00 0.32 H new ATOM 0 HB3 SER A 66 -13.323 -11.157 -6.765 1.00 0.32 H new ATOM 0 HG SER A 66 -14.487 -12.637 -8.118 1.00 1.28 H new ATOM 882 N GLN A 67 -14.037 -8.317 -6.904 1.00 0.21 N ATOM 883 CA GLN A 67 -15.038 -7.297 -6.590 1.00 0.20 C ATOM 884 C GLN A 67 -14.578 -5.896 -7.016 1.00 0.20 C ATOM 885 O GLN A 67 -15.379 -5.095 -7.496 1.00 0.27 O ATOM 886 CB GLN A 67 -15.367 -7.315 -5.096 1.00 0.21 C ATOM 887 CG GLN A 67 -16.134 -8.555 -4.667 1.00 0.38 C ATOM 888 CD GLN A 67 -16.325 -8.638 -3.168 1.00 0.52 C ATOM 889 OE1 GLN A 67 -15.393 -9.290 -2.497 1.00 1.11 O flip ATOM 890 NE2 GLN A 67 -17.304 -8.134 -2.620 1.00 0.46 N flip ATOM 0 H GLN A 67 -13.439 -8.579 -6.120 1.00 0.21 H new ATOM 0 HA GLN A 67 -15.938 -7.536 -7.157 1.00 0.20 H new ATOM 0 HB2 GLN A 67 -14.440 -7.253 -4.526 1.00 0.21 H new ATOM 0 HB3 GLN A 67 -15.953 -6.430 -4.849 1.00 0.21 H new ATOM 0 HG2 GLN A 67 -17.109 -8.560 -5.154 1.00 0.38 H new ATOM 0 HG3 GLN A 67 -15.602 -9.442 -5.010 1.00 0.38 H new ATOM 0 HE21 GLN A 67 -18.001 -7.639 -3.176 1.00 0.46 H new ATOM 0 HE22 GLN A 67 -17.419 -8.211 -1.609 1.00 0.46 H new ATOM 899 N GLY A 68 -13.289 -5.612 -6.859 1.00 0.17 N ATOM 900 CA GLY A 68 -12.761 -4.297 -7.161 1.00 0.18 C ATOM 901 C GLY A 68 -11.557 -3.966 -6.298 1.00 0.15 C ATOM 902 O GLY A 68 -10.874 -2.964 -6.522 1.00 0.17 O ATOM 0 H GLY A 68 -12.594 -6.279 -6.524 1.00 0.17 H new ATOM 0 HA2 GLY A 68 -12.479 -4.250 -8.213 1.00 0.18 H new ATOM 0 HA3 GLY A 68 -13.538 -3.548 -7.006 1.00 0.18 H new ATOM 906 N PHE A 69 -11.296 -4.835 -5.322 1.00 0.14 N ATOM 907 CA PHE A 69 -10.197 -4.656 -4.377 1.00 0.13 C ATOM 908 C PHE A 69 -8.862 -4.712 -5.087 1.00 0.14 C ATOM 909 O PHE A 69 -8.698 -5.459 -6.038 1.00 0.18 O ATOM 910 CB PHE A 69 -10.239 -5.758 -3.306 1.00 0.14 C ATOM 911 CG PHE A 69 -9.222 -5.595 -2.219 1.00 0.12 C ATOM 912 CD1 PHE A 69 -8.951 -4.361 -1.640 1.00 0.14 C ATOM 913 CD2 PHE A 69 -8.536 -6.690 -1.785 1.00 0.14 C ATOM 914 CE1 PHE A 69 -7.996 -4.248 -0.643 1.00 0.16 C ATOM 915 CE2 PHE A 69 -7.597 -6.598 -0.811 1.00 0.16 C ATOM 916 CZ PHE A 69 -7.375 -5.218 -0.193 1.00 0.14 C ATOM 0 H PHE A 69 -11.841 -5.683 -5.165 1.00 0.14 H new ATOM 0 HA PHE A 69 -10.311 -3.678 -3.909 1.00 0.13 H new ATOM 0 HB2 PHE A 69 -11.233 -5.777 -2.859 1.00 0.14 H new ATOM 0 HB3 PHE A 69 -10.088 -6.724 -3.788 1.00 0.14 H new ATOM 0 HD1 PHE A 69 -9.489 -3.484 -1.970 1.00 0.14 H new ATOM 0 HD2 PHE A 69 -8.745 -7.653 -2.227 1.00 0.14 H new ATOM 0 HE1 PHE A 69 -7.784 -3.268 -0.241 1.00 0.16 H new ATOM 0 HE2 PHE A 69 -7.032 -7.460 -0.487 1.00 0.16 H new ATOM 0 HZ PHE A 69 -6.684 -5.091 0.627 1.00 0.14 H new ATOM 926 N THR A 70 -7.915 -3.909 -4.656 1.00 0.13 N ATOM 927 CA THR A 70 -6.580 -4.065 -5.103 1.00 0.12 C ATOM 928 C THR A 70 -5.671 -4.018 -3.927 1.00 0.12 C ATOM 929 O THR A 70 -5.965 -3.382 -2.936 1.00 0.19 O ATOM 930 CB THR A 70 -6.157 -2.977 -6.091 1.00 0.15 C ATOM 931 OG1 THR A 70 -4.991 -3.386 -6.802 1.00 0.20 O ATOM 932 CG2 THR A 70 -5.868 -1.667 -5.388 1.00 0.19 C ATOM 0 H THR A 70 -8.061 -3.145 -3.996 1.00 0.13 H new ATOM 0 HA THR A 70 -6.519 -5.023 -5.620 1.00 0.12 H new ATOM 0 HB THR A 70 -6.986 -2.826 -6.783 1.00 0.15 H new ATOM 0 HG1 THR A 70 -5.116 -4.298 -7.137 1.00 0.20 H new ATOM 0 HG21 THR A 70 -5.571 -0.918 -6.122 1.00 0.19 H new ATOM 0 HG22 THR A 70 -6.763 -1.329 -4.867 1.00 0.19 H new ATOM 0 HG23 THR A 70 -5.062 -1.810 -4.669 1.00 0.19 H new ATOM 940 N VAL A 71 -4.608 -4.728 -4.014 1.00 0.13 N ATOM 941 CA VAL A 71 -3.483 -4.435 -3.215 1.00 0.13 C ATOM 942 C VAL A 71 -2.513 -3.675 -4.075 1.00 0.13 C ATOM 943 O VAL A 71 -1.827 -4.251 -4.904 1.00 0.15 O ATOM 944 CB VAL A 71 -2.858 -5.718 -2.673 1.00 0.15 C ATOM 945 CG1 VAL A 71 -1.451 -5.466 -2.176 1.00 0.16 C ATOM 946 CG2 VAL A 71 -3.717 -6.263 -1.549 1.00 0.17 C ATOM 0 H VAL A 71 -4.495 -5.526 -4.640 1.00 0.13 H new ATOM 0 HA VAL A 71 -3.767 -3.836 -2.350 1.00 0.13 H new ATOM 0 HB VAL A 71 -2.806 -6.449 -3.480 1.00 0.15 H new ATOM 0 HG11 VAL A 71 -1.028 -6.395 -1.795 1.00 0.16 H new ATOM 0 HG12 VAL A 71 -0.836 -5.097 -2.997 1.00 0.16 H new ATOM 0 HG13 VAL A 71 -1.474 -4.724 -1.378 1.00 0.16 H new ATOM 0 HG21 VAL A 71 -3.271 -7.179 -1.162 1.00 0.17 H new ATOM 0 HG22 VAL A 71 -3.782 -5.525 -0.750 1.00 0.17 H new ATOM 0 HG23 VAL A 71 -4.717 -6.478 -1.926 1.00 0.17 H new ATOM 956 N LEU A 72 -2.484 -2.374 -3.917 1.00 0.17 N ATOM 957 CA LEU A 72 -1.545 -1.594 -4.686 1.00 0.22 C ATOM 958 C LEU A 72 -0.236 -1.623 -3.946 1.00 0.19 C ATOM 959 O LEU A 72 -0.160 -1.166 -2.825 1.00 0.28 O ATOM 960 CB LEU A 72 -1.980 -0.132 -4.844 1.00 0.43 C ATOM 961 CG LEU A 72 -3.220 0.159 -5.663 1.00 0.34 C ATOM 962 CD1 LEU A 72 -3.473 1.650 -5.697 1.00 1.04 C ATOM 963 CD2 LEU A 72 -3.069 -0.367 -7.064 1.00 1.00 C ATOM 0 H LEU A 72 -3.081 -1.845 -3.282 1.00 0.17 H new ATOM 0 HA LEU A 72 -1.475 -2.021 -5.686 1.00 0.22 H new ATOM 0 HB2 LEU A 72 -2.135 0.279 -3.847 1.00 0.43 H new ATOM 0 HB3 LEU A 72 -1.150 0.417 -5.289 1.00 0.43 H new ATOM 0 HG LEU A 72 -4.069 -0.342 -5.197 1.00 0.34 H new ATOM 0 HD11 LEU A 72 -4.366 1.854 -6.287 1.00 1.04 H new ATOM 0 HD12 LEU A 72 -3.618 2.018 -4.681 1.00 1.04 H new ATOM 0 HD13 LEU A 72 -2.618 2.154 -6.147 1.00 1.04 H new ATOM 0 HD21 LEU A 72 -3.971 -0.147 -7.634 1.00 1.00 H new ATOM 0 HD22 LEU A 72 -2.213 0.110 -7.541 1.00 1.00 H new ATOM 0 HD23 LEU A 72 -2.913 -1.445 -7.033 1.00 1.00 H new ATOM 975 N ALA A 73 0.788 -2.146 -4.558 1.00 0.22 N ATOM 976 CA ALA A 73 2.068 -2.200 -3.900 1.00 0.30 C ATOM 977 C ALA A 73 2.915 -1.023 -4.328 1.00 0.23 C ATOM 978 O ALA A 73 3.320 -0.917 -5.474 1.00 0.32 O ATOM 979 CB ALA A 73 2.763 -3.514 -4.190 1.00 0.51 C ATOM 0 H ALA A 73 0.766 -2.537 -5.500 1.00 0.22 H new ATOM 0 HA ALA A 73 1.917 -2.140 -2.822 1.00 0.30 H new ATOM 0 HB1 ALA A 73 3.728 -3.535 -3.684 1.00 0.51 H new ATOM 0 HB2 ALA A 73 2.147 -4.338 -3.831 1.00 0.51 H new ATOM 0 HB3 ALA A 73 2.915 -3.616 -5.265 1.00 0.51 H new ATOM 985 N PHE A 74 3.184 -0.148 -3.394 1.00 0.29 N ATOM 986 CA PHE A 74 3.928 1.050 -3.650 1.00 0.33 C ATOM 987 C PHE A 74 5.268 0.890 -3.002 1.00 0.35 C ATOM 988 O PHE A 74 5.420 1.136 -1.804 1.00 0.37 O ATOM 989 CB PHE A 74 3.216 2.268 -3.072 1.00 0.44 C ATOM 990 CG PHE A 74 2.249 2.936 -4.005 1.00 0.36 C ATOM 991 CD1 PHE A 74 1.237 2.190 -4.581 1.00 0.43 C ATOM 992 CD2 PHE A 74 2.361 4.279 -4.336 1.00 0.41 C ATOM 993 CE1 PHE A 74 0.349 2.766 -5.471 1.00 0.41 C ATOM 994 CE2 PHE A 74 1.482 4.855 -5.222 1.00 0.43 C ATOM 995 CZ PHE A 74 0.449 4.231 -5.665 1.00 0.35 C ATOM 0 H PHE A 74 2.887 -0.252 -2.424 1.00 0.29 H new ATOM 0 HA PHE A 74 4.027 1.206 -4.724 1.00 0.33 H new ATOM 0 HB2 PHE A 74 2.680 1.965 -2.173 1.00 0.44 H new ATOM 0 HB3 PHE A 74 3.966 2.998 -2.766 1.00 0.44 H new ATOM 0 HD1 PHE A 74 1.139 1.144 -4.332 1.00 0.43 H new ATOM 0 HD2 PHE A 74 3.145 4.876 -3.894 1.00 0.41 H new ATOM 0 HE1 PHE A 74 -0.384 2.175 -6.000 1.00 0.41 H new ATOM 0 HE2 PHE A 74 1.665 5.865 -5.557 1.00 0.43 H new ATOM 0 HZ PHE A 74 -0.337 4.769 -6.173 1.00 0.35 H new ATOM 1005 N PRO A 75 6.259 0.450 -3.763 1.00 0.37 N ATOM 1006 CA PRO A 75 7.536 0.150 -3.197 1.00 0.46 C ATOM 1007 C PRO A 75 8.174 1.424 -2.721 1.00 0.61 C ATOM 1008 O PRO A 75 7.896 2.503 -3.226 1.00 1.30 O ATOM 1009 CB PRO A 75 8.333 -0.516 -4.317 1.00 0.54 C ATOM 1010 CG PRO A 75 7.502 -0.425 -5.552 1.00 0.44 C ATOM 1011 CD PRO A 75 6.232 0.317 -5.219 1.00 0.38 C ATOM 0 HA PRO A 75 7.480 -0.512 -2.333 1.00 0.46 H new ATOM 0 HB2 PRO A 75 9.292 -0.017 -4.459 1.00 0.54 H new ATOM 0 HB3 PRO A 75 8.548 -1.556 -4.072 1.00 0.54 H new ATOM 0 HG2 PRO A 75 8.049 0.094 -6.339 1.00 0.44 H new ATOM 0 HG3 PRO A 75 7.271 -1.422 -5.928 1.00 0.44 H new ATOM 0 HD2 PRO A 75 6.202 1.291 -5.706 1.00 0.38 H new ATOM 0 HD3 PRO A 75 5.352 -0.233 -5.551 1.00 0.38 H new ATOM 1019 N SER A 76 8.941 1.314 -1.693 1.00 0.41 N ATOM 1020 CA SER A 76 9.564 2.478 -1.125 1.00 0.37 C ATOM 1021 C SER A 76 10.732 2.966 -1.935 1.00 0.50 C ATOM 1022 O SER A 76 11.501 2.188 -2.509 1.00 0.74 O ATOM 1023 CB SER A 76 9.977 2.184 0.319 1.00 0.53 C ATOM 1024 OG SER A 76 10.748 0.995 0.396 1.00 1.44 O ATOM 0 H SER A 76 9.157 0.435 -1.222 1.00 0.41 H new ATOM 0 HA SER A 76 8.832 3.286 -1.136 1.00 0.37 H new ATOM 0 HB2 SER A 76 10.553 3.021 0.714 1.00 0.53 H new ATOM 0 HB3 SER A 76 9.088 2.086 0.942 1.00 0.53 H new ATOM 0 HG SER A 76 11.001 0.829 1.328 1.00 1.44 H new ATOM 1030 N ASN A 77 10.815 4.285 -2.002 1.00 0.52 N ATOM 1031 CA ASN A 77 11.965 4.968 -2.547 1.00 0.72 C ATOM 1032 C ASN A 77 13.139 4.775 -1.599 1.00 0.70 C ATOM 1033 O ASN A 77 13.659 5.727 -1.016 1.00 0.75 O ATOM 1034 CB ASN A 77 11.675 6.462 -2.736 1.00 0.93 C ATOM 1035 CG ASN A 77 12.795 7.186 -3.462 1.00 0.96 C ATOM 1036 OD1 ASN A 77 13.453 6.621 -4.334 1.00 1.81 O ATOM 1037 ND2 ASN A 77 13.022 8.443 -3.104 1.00 1.46 N ATOM 0 H ASN A 77 10.079 4.911 -1.676 1.00 0.52 H new ATOM 0 HA ASN A 77 12.203 4.550 -3.525 1.00 0.72 H new ATOM 0 HB2 ASN A 77 10.748 6.580 -3.296 1.00 0.93 H new ATOM 0 HB3 ASN A 77 11.520 6.925 -1.761 1.00 0.93 H new ATOM 0 HD21 ASN A 77 13.764 8.976 -3.557 1.00 1.46 H new ATOM 0 HD22 ASN A 77 12.454 8.876 -2.376 1.00 1.46 H new ATOM 1044 N GLN A 78 13.525 3.508 -1.445 1.00 0.85 N ATOM 1045 CA GLN A 78 14.700 3.099 -0.681 1.00 0.98 C ATOM 1046 C GLN A 78 15.933 3.873 -1.116 1.00 0.98 C ATOM 1047 O GLN A 78 16.961 3.861 -0.445 1.00 1.12 O ATOM 1048 CB GLN A 78 14.937 1.587 -0.825 1.00 1.35 C ATOM 1049 CG GLN A 78 14.461 0.972 -2.145 1.00 2.07 C ATOM 1050 CD GLN A 78 15.124 1.555 -3.386 1.00 2.74 C ATOM 1051 OE1 GLN A 78 14.457 2.510 -4.023 1.00 3.34 O flip ATOM 1052 NE2 GLN A 78 16.195 1.117 -3.797 1.00 3.30 N flip ATOM 0 H GLN A 78 13.019 2.724 -1.856 1.00 0.85 H new ATOM 0 HA GLN A 78 14.513 3.325 0.369 1.00 0.98 H new ATOM 0 HB2 GLN A 78 16.004 1.391 -0.716 1.00 1.35 H new ATOM 0 HB3 GLN A 78 14.434 1.077 -0.003 1.00 1.35 H new ATOM 0 HG2 GLN A 78 14.647 -0.102 -2.119 1.00 2.07 H new ATOM 0 HG3 GLN A 78 13.382 1.107 -2.227 1.00 2.07 H new ATOM 0 HE21 GLN A 78 16.678 0.383 -3.280 1.00 3.30 H new ATOM 0 HE22 GLN A 78 16.602 1.488 -4.656 1.00 3.30 H new ATOM 1061 N PHE A 79 15.801 4.543 -2.248 1.00 0.98 N ATOM 1062 CA PHE A 79 16.883 5.332 -2.819 1.00 1.19 C ATOM 1063 C PHE A 79 17.203 6.532 -1.923 1.00 1.20 C ATOM 1064 O PHE A 79 18.234 7.181 -2.076 1.00 1.54 O ATOM 1065 CB PHE A 79 16.495 5.793 -4.227 1.00 1.32 C ATOM 1066 CG PHE A 79 17.626 6.382 -5.019 1.00 1.57 C ATOM 1067 CD1 PHE A 79 18.602 5.568 -5.568 1.00 1.82 C ATOM 1068 CD2 PHE A 79 17.716 7.752 -5.210 1.00 2.02 C ATOM 1069 CE1 PHE A 79 19.646 6.106 -6.292 1.00 2.25 C ATOM 1070 CE2 PHE A 79 18.758 8.297 -5.935 1.00 2.64 C ATOM 1071 CZ PHE A 79 19.715 7.469 -6.493 1.00 2.68 C ATOM 0 H PHE A 79 14.942 4.556 -2.798 1.00 0.98 H new ATOM 0 HA PHE A 79 17.779 4.715 -2.885 1.00 1.19 H new ATOM 0 HB2 PHE A 79 16.087 4.944 -4.775 1.00 1.32 H new ATOM 0 HB3 PHE A 79 15.699 6.533 -4.148 1.00 1.32 H new ATOM 0 HD1 PHE A 79 18.545 4.499 -5.428 1.00 1.82 H new ATOM 0 HD2 PHE A 79 16.963 8.401 -4.787 1.00 2.02 H new ATOM 0 HE1 PHE A 79 20.409 5.460 -6.701 1.00 2.25 H new ATOM 0 HE2 PHE A 79 18.825 9.367 -6.066 1.00 2.64 H new ATOM 0 HZ PHE A 79 20.515 7.889 -7.085 1.00 2.68 H new ATOM 1081 N GLY A 80 16.311 6.814 -0.984 1.00 1.10 N ATOM 1082 CA GLY A 80 16.544 7.873 -0.020 1.00 1.22 C ATOM 1083 C GLY A 80 17.290 7.376 1.206 1.00 1.24 C ATOM 1084 O GLY A 80 18.266 6.634 1.084 1.00 1.98 O ATOM 0 H GLY A 80 15.423 6.325 -0.872 1.00 1.10 H new ATOM 0 HA2 GLY A 80 17.115 8.673 -0.492 1.00 1.22 H new ATOM 0 HA3 GLY A 80 15.589 8.301 0.286 1.00 1.22 H new ATOM 1088 N GLY A 81 16.835 7.781 2.385 1.00 1.18 N ATOM 1089 CA GLY A 81 17.458 7.336 3.618 1.00 1.21 C ATOM 1090 C GLY A 81 16.530 7.474 4.810 1.00 1.14 C ATOM 1091 O GLY A 81 16.868 8.128 5.799 1.00 1.49 O ATOM 0 H GLY A 81 16.043 8.412 2.510 1.00 1.18 H new ATOM 0 HA2 GLY A 81 17.762 6.294 3.515 1.00 1.21 H new ATOM 0 HA3 GLY A 81 18.364 7.916 3.796 1.00 1.21 H new ATOM 1095 N GLN A 82 15.344 6.889 4.703 1.00 0.86 N ATOM 1096 CA GLN A 82 14.363 6.935 5.783 1.00 0.82 C ATOM 1097 C GLN A 82 13.432 5.745 5.713 1.00 0.77 C ATOM 1098 O GLN A 82 12.521 5.603 6.514 1.00 0.91 O ATOM 1099 CB GLN A 82 13.526 8.241 5.744 1.00 0.80 C ATOM 1100 CG GLN A 82 12.783 8.498 4.425 1.00 0.75 C ATOM 1101 CD GLN A 82 13.701 8.757 3.240 1.00 1.09 C ATOM 1102 OE1 GLN A 82 14.742 9.397 3.365 1.00 1.74 O ATOM 1103 NE2 GLN A 82 13.346 8.208 2.093 1.00 1.14 N ATOM 0 H GLN A 82 15.036 6.375 3.877 1.00 0.86 H new ATOM 0 HA GLN A 82 14.920 6.908 6.719 1.00 0.82 H new ATOM 0 HB2 GLN A 82 12.797 8.212 6.554 1.00 0.80 H new ATOM 0 HB3 GLN A 82 14.188 9.085 5.941 1.00 0.80 H new ATOM 0 HG2 GLN A 82 12.152 7.638 4.202 1.00 0.75 H new ATOM 0 HG3 GLN A 82 12.121 9.355 4.553 1.00 0.75 H new ATOM 0 HE21 GLN A 82 12.474 7.683 2.027 1.00 1.14 H new ATOM 0 HE22 GLN A 82 13.944 8.308 1.273 1.00 1.14 H new ATOM 1112 N GLU A 83 13.728 4.854 4.802 1.00 0.75 N ATOM 1113 CA GLU A 83 12.744 3.919 4.311 1.00 0.74 C ATOM 1114 C GLU A 83 12.504 2.720 5.221 1.00 0.72 C ATOM 1115 O GLU A 83 13.422 2.133 5.790 1.00 0.88 O ATOM 1116 CB GLU A 83 13.156 3.499 2.919 1.00 0.87 C ATOM 1117 CG GLU A 83 13.251 4.703 2.005 1.00 1.16 C ATOM 1118 CD GLU A 83 11.896 5.339 1.748 1.00 2.33 C ATOM 1119 OE1 GLU A 83 11.187 4.878 0.830 1.00 3.07 O ATOM 1120 OE2 GLU A 83 11.537 6.300 2.456 1.00 2.83 O ATOM 0 H GLU A 83 14.652 4.755 4.381 1.00 0.75 H new ATOM 0 HA GLU A 83 11.778 4.424 4.292 1.00 0.74 H new ATOM 0 HB2 GLU A 83 14.118 2.988 2.957 1.00 0.87 H new ATOM 0 HB3 GLU A 83 12.433 2.788 2.519 1.00 0.87 H new ATOM 0 HG2 GLU A 83 13.918 5.442 2.449 1.00 1.16 H new ATOM 0 HG3 GLU A 83 13.695 4.402 1.056 1.00 1.16 H new ATOM 1127 N PRO A 84 11.213 2.392 5.357 1.00 0.63 N ATOM 1128 CA PRO A 84 10.676 1.246 6.103 1.00 0.75 C ATOM 1129 C PRO A 84 11.517 -0.017 6.099 1.00 1.00 C ATOM 1130 O PRO A 84 12.203 -0.337 5.123 1.00 1.75 O ATOM 1131 CB PRO A 84 9.433 0.984 5.295 1.00 1.02 C ATOM 1132 CG PRO A 84 8.904 2.336 5.105 1.00 0.72 C ATOM 1133 CD PRO A 84 10.101 3.164 4.764 1.00 0.61 C ATOM 0 HA PRO A 84 10.581 1.475 7.164 1.00 0.75 H new ATOM 0 HB2 PRO A 84 9.658 0.497 4.346 1.00 1.02 H new ATOM 0 HB3 PRO A 84 8.730 0.341 5.825 1.00 1.02 H new ATOM 0 HG2 PRO A 84 8.163 2.363 4.306 1.00 0.72 H new ATOM 0 HG3 PRO A 84 8.414 2.701 6.008 1.00 0.72 H new ATOM 0 HD2 PRO A 84 10.219 3.280 3.687 1.00 0.61 H new ATOM 0 HD3 PRO A 84 10.033 4.166 5.187 1.00 0.61 H new ATOM 1141 N GLY A 85 11.427 -0.747 7.195 1.00 1.45 N ATOM 1142 CA GLY A 85 11.950 -2.089 7.242 1.00 1.82 C ATOM 1143 C GLY A 85 13.425 -2.161 7.540 1.00 1.61 C ATOM 1144 O GLY A 85 13.840 -2.946 8.390 1.00 2.20 O ATOM 0 H GLY A 85 10.995 -0.428 8.062 1.00 1.45 H new ATOM 0 HA2 GLY A 85 11.408 -2.653 8.001 1.00 1.82 H new ATOM 0 HA3 GLY A 85 11.759 -2.576 6.286 1.00 1.82 H new ATOM 1148 N ASN A 86 14.226 -1.347 6.863 1.00 1.49 N ATOM 1149 CA ASN A 86 15.679 -1.519 6.958 1.00 2.04 C ATOM 1150 C ASN A 86 16.479 -0.398 6.294 1.00 1.94 C ATOM 1151 O ASN A 86 17.566 -0.064 6.771 1.00 2.70 O ATOM 1152 CB ASN A 86 16.087 -2.868 6.345 1.00 2.78 C ATOM 1153 CG ASN A 86 17.579 -3.136 6.436 1.00 3.58 C ATOM 1154 OD1 ASN A 86 18.340 -2.755 5.551 1.00 4.07 O ATOM 1155 ND2 ASN A 86 18.002 -3.806 7.497 1.00 4.20 N ATOM 0 H ASN A 86 13.914 -0.585 6.261 1.00 1.49 H new ATOM 0 HA ASN A 86 15.918 -1.487 8.021 1.00 2.04 H new ATOM 0 HB2 ASN A 86 15.548 -3.669 6.852 1.00 2.78 H new ATOM 0 HB3 ASN A 86 15.783 -2.892 5.299 1.00 2.78 H new ATOM 0 HD21 ASN A 86 18.993 -4.023 7.601 1.00 4.20 H new ATOM 0 HD22 ASN A 86 17.337 -4.105 8.210 1.00 4.20 H new ATOM 1162 N GLU A 87 15.959 0.153 5.188 1.00 1.52 N ATOM 1163 CA GLU A 87 16.651 1.207 4.418 1.00 1.46 C ATOM 1164 C GLU A 87 17.790 0.633 3.566 1.00 1.60 C ATOM 1165 O GLU A 87 17.747 0.688 2.337 1.00 2.15 O ATOM 1166 CB GLU A 87 17.224 2.304 5.328 1.00 1.61 C ATOM 1167 CG GLU A 87 16.183 3.116 6.068 1.00 2.19 C ATOM 1168 CD GLU A 87 16.804 4.102 7.030 1.00 2.58 C ATOM 1169 OE1 GLU A 87 17.674 4.891 6.603 1.00 3.02 O ATOM 1170 OE2 GLU A 87 16.416 4.098 8.215 1.00 2.84 O ATOM 0 H GLU A 87 15.054 -0.114 4.801 1.00 1.52 H new ATOM 0 HA GLU A 87 15.895 1.644 3.766 1.00 1.46 H new ATOM 0 HB2 GLU A 87 17.891 1.842 6.056 1.00 1.61 H new ATOM 0 HB3 GLU A 87 17.830 2.979 4.724 1.00 1.61 H new ATOM 0 HG2 GLU A 87 15.565 3.653 5.348 1.00 2.19 H new ATOM 0 HG3 GLU A 87 15.523 2.444 6.616 1.00 2.19 H new ATOM 1177 N GLU A 88 18.787 0.067 4.237 1.00 1.57 N ATOM 1178 CA GLU A 88 20.053 -0.317 3.608 1.00 1.77 C ATOM 1179 C GLU A 88 19.919 -1.481 2.629 1.00 1.62 C ATOM 1180 O GLU A 88 20.451 -1.420 1.521 1.00 1.62 O ATOM 1181 CB GLU A 88 21.072 -0.681 4.686 1.00 2.18 C ATOM 1182 CG GLU A 88 21.428 0.478 5.600 1.00 2.68 C ATOM 1183 CD GLU A 88 21.991 1.653 4.833 1.00 3.33 C ATOM 1184 OE1 GLU A 88 23.145 1.567 4.371 1.00 3.92 O ATOM 1185 OE2 GLU A 88 21.271 2.660 4.667 1.00 3.66 O ATOM 0 H GLU A 88 18.744 -0.140 5.235 1.00 1.57 H new ATOM 0 HA GLU A 88 20.386 0.546 3.031 1.00 1.77 H new ATOM 0 HB2 GLU A 88 20.676 -1.499 5.288 1.00 2.18 H new ATOM 0 HB3 GLU A 88 21.980 -1.048 4.207 1.00 2.18 H new ATOM 0 HG2 GLU A 88 20.540 0.794 6.147 1.00 2.68 H new ATOM 0 HG3 GLU A 88 22.156 0.146 6.340 1.00 2.68 H new ATOM 1192 N GLU A 89 19.196 -2.521 3.036 1.00 1.62 N ATOM 1193 CA GLU A 89 19.172 -3.797 2.315 1.00 1.59 C ATOM 1194 C GLU A 89 18.943 -3.623 0.817 1.00 1.49 C ATOM 1195 O GLU A 89 19.746 -4.080 0.014 1.00 1.59 O ATOM 1196 CB GLU A 89 18.082 -4.710 2.889 1.00 1.70 C ATOM 1197 CG GLU A 89 17.990 -6.069 2.205 1.00 1.75 C ATOM 1198 CD GLU A 89 16.860 -6.911 2.741 1.00 2.11 C ATOM 1199 OE1 GLU A 89 17.051 -7.567 3.783 1.00 2.45 O ATOM 1200 OE2 GLU A 89 15.783 -6.937 2.122 1.00 2.65 O ATOM 0 H GLU A 89 18.611 -2.507 3.872 1.00 1.62 H new ATOM 0 HA GLU A 89 20.154 -4.250 2.450 1.00 1.59 H new ATOM 0 HB2 GLU A 89 18.271 -4.861 3.952 1.00 1.70 H new ATOM 0 HB3 GLU A 89 17.119 -4.206 2.805 1.00 1.70 H new ATOM 0 HG2 GLU A 89 17.854 -5.924 1.133 1.00 1.75 H new ATOM 0 HG3 GLU A 89 18.931 -6.603 2.337 1.00 1.75 H new ATOM 1207 N ILE A 90 17.879 -2.934 0.451 1.00 1.43 N ATOM 1208 CA ILE A 90 17.467 -2.860 -0.947 1.00 1.39 C ATOM 1209 C ILE A 90 18.494 -2.118 -1.809 1.00 1.49 C ATOM 1210 O ILE A 90 18.597 -2.357 -3.011 1.00 1.57 O ATOM 1211 CB ILE A 90 16.091 -2.175 -1.092 1.00 1.45 C ATOM 1212 CG1 ILE A 90 15.058 -2.783 -0.130 1.00 1.74 C ATOM 1213 CG2 ILE A 90 15.593 -2.270 -2.526 1.00 1.76 C ATOM 1214 CD1 ILE A 90 14.961 -2.070 1.202 1.00 2.15 C ATOM 0 H ILE A 90 17.282 -2.417 1.097 1.00 1.43 H new ATOM 0 HA ILE A 90 17.395 -3.889 -1.301 1.00 1.39 H new ATOM 0 HB ILE A 90 16.217 -1.124 -0.832 1.00 1.45 H new ATOM 0 HG12 ILE A 90 14.079 -2.770 -0.609 1.00 1.74 H new ATOM 0 HG13 ILE A 90 15.313 -3.828 0.047 1.00 1.74 H new ATOM 0 HG21 ILE A 90 14.622 -1.781 -2.607 1.00 1.76 H new ATOM 0 HG22 ILE A 90 16.303 -1.779 -3.191 1.00 1.76 H new ATOM 0 HG23 ILE A 90 15.496 -3.318 -2.809 1.00 1.76 H new ATOM 0 HD11 ILE A 90 14.211 -2.560 1.823 1.00 2.15 H new ATOM 0 HD12 ILE A 90 15.927 -2.105 1.705 1.00 2.15 H new ATOM 0 HD13 ILE A 90 14.675 -1.031 1.039 1.00 2.15 H new ATOM 1226 N LYS A 91 19.261 -1.232 -1.194 1.00 1.71 N ATOM 1227 CA LYS A 91 20.247 -0.448 -1.927 1.00 1.89 C ATOM 1228 C LYS A 91 21.510 -1.261 -2.160 1.00 1.98 C ATOM 1229 O LYS A 91 22.150 -1.159 -3.206 1.00 2.17 O ATOM 1230 CB LYS A 91 20.619 0.815 -1.155 1.00 2.00 C ATOM 1231 CG LYS A 91 19.434 1.654 -0.713 1.00 2.10 C ATOM 1232 CD LYS A 91 19.889 2.857 0.100 1.00 2.33 C ATOM 1233 CE LYS A 91 20.789 2.442 1.255 1.00 2.39 C ATOM 1234 NZ LYS A 91 21.094 3.582 2.161 1.00 2.79 N ATOM 0 H LYS A 91 19.222 -1.037 -0.194 1.00 1.71 H new ATOM 0 HA LYS A 91 19.802 -0.174 -2.883 1.00 1.89 H new ATOM 0 HB2 LYS A 91 21.196 0.531 -0.275 1.00 2.00 H new ATOM 0 HB3 LYS A 91 21.270 1.428 -1.778 1.00 2.00 H new ATOM 0 HG2 LYS A 91 18.877 1.991 -1.587 1.00 2.10 H new ATOM 0 HG3 LYS A 91 18.754 1.044 -0.117 1.00 2.10 H new ATOM 0 HD2 LYS A 91 20.423 3.553 -0.547 1.00 2.33 H new ATOM 0 HD3 LYS A 91 19.018 3.386 0.488 1.00 2.33 H new ATOM 0 HE2 LYS A 91 20.306 1.647 1.823 1.00 2.39 H new ATOM 0 HE3 LYS A 91 21.719 2.033 0.861 1.00 2.39 H new ATOM 0 HZ1 LYS A 91 20.958 3.286 3.149 1.00 2.79 H new ATOM 0 HZ2 LYS A 91 22.080 3.882 2.022 1.00 2.79 H new ATOM 0 HZ3 LYS A 91 20.457 4.376 1.947 1.00 2.79 H new ATOM 1248 N GLU A 92 21.865 -2.059 -1.169 1.00 2.07 N ATOM 1249 CA GLU A 92 23.123 -2.788 -1.180 1.00 2.27 C ATOM 1250 C GLU A 92 22.946 -4.151 -1.829 1.00 2.10 C ATOM 1251 O GLU A 92 23.809 -4.627 -2.570 1.00 2.26 O ATOM 1252 CB GLU A 92 23.617 -2.952 0.254 1.00 2.54 C ATOM 1253 CG GLU A 92 23.534 -1.674 1.063 1.00 2.47 C ATOM 1254 CD GLU A 92 24.305 -0.529 0.440 1.00 2.96 C ATOM 1255 OE1 GLU A 92 25.508 -0.700 0.168 1.00 3.29 O ATOM 1256 OE2 GLU A 92 23.709 0.547 0.209 1.00 3.20 O ATOM 0 H GLU A 92 21.295 -2.220 -0.339 1.00 2.07 H new ATOM 0 HA GLU A 92 23.856 -2.228 -1.760 1.00 2.27 H new ATOM 0 HB2 GLU A 92 23.029 -3.726 0.748 1.00 2.54 H new ATOM 0 HB3 GLU A 92 24.650 -3.298 0.238 1.00 2.54 H new ATOM 0 HG2 GLU A 92 22.488 -1.385 1.170 1.00 2.47 H new ATOM 0 HG3 GLU A 92 23.917 -1.860 2.066 1.00 2.47 H new ATOM 1263 N PHE A 93 21.818 -4.768 -1.535 1.00 1.86 N ATOM 1264 CA PHE A 93 21.472 -6.065 -2.081 1.00 1.75 C ATOM 1265 C PHE A 93 20.737 -5.880 -3.392 1.00 1.59 C ATOM 1266 O PHE A 93 20.242 -4.794 -3.681 1.00 1.69 O ATOM 1267 CB PHE A 93 20.572 -6.822 -1.102 1.00 1.73 C ATOM 1268 CG PHE A 93 21.266 -7.230 0.169 1.00 2.09 C ATOM 1269 CD1 PHE A 93 21.407 -6.339 1.222 1.00 2.65 C ATOM 1270 CD2 PHE A 93 21.774 -8.511 0.311 1.00 2.34 C ATOM 1271 CE1 PHE A 93 22.041 -6.716 2.389 1.00 3.40 C ATOM 1272 CE2 PHE A 93 22.410 -8.894 1.476 1.00 2.87 C ATOM 1273 CZ PHE A 93 22.543 -7.995 2.516 1.00 3.42 C ATOM 0 H PHE A 93 21.113 -4.381 -0.908 1.00 1.86 H new ATOM 0 HA PHE A 93 22.385 -6.637 -2.246 1.00 1.75 H new ATOM 0 HB2 PHE A 93 19.715 -6.196 -0.852 1.00 1.73 H new ATOM 0 HB3 PHE A 93 20.183 -7.713 -1.595 1.00 1.73 H new ATOM 0 HD1 PHE A 93 21.016 -5.337 1.128 1.00 2.65 H new ATOM 0 HD2 PHE A 93 21.672 -9.218 -0.499 1.00 2.34 H new ATOM 0 HE1 PHE A 93 22.144 -6.011 3.201 1.00 3.40 H new ATOM 0 HE2 PHE A 93 22.803 -9.895 1.573 1.00 2.87 H new ATOM 0 HZ PHE A 93 23.039 -8.293 3.428 1.00 3.42 H new ATOM 1283 N VAL A 94 20.670 -6.929 -4.188 1.00 1.62 N ATOM 1284 CA VAL A 94 19.876 -6.867 -5.393 1.00 1.68 C ATOM 1285 C VAL A 94 18.418 -7.063 -5.032 1.00 1.54 C ATOM 1286 O VAL A 94 17.990 -8.165 -4.681 1.00 1.74 O ATOM 1287 CB VAL A 94 20.304 -7.928 -6.429 1.00 2.11 C ATOM 1288 CG1 VAL A 94 19.353 -7.930 -7.615 1.00 2.63 C ATOM 1289 CG2 VAL A 94 21.734 -7.680 -6.887 1.00 2.56 C ATOM 0 H VAL A 94 21.146 -7.816 -4.025 1.00 1.62 H new ATOM 0 HA VAL A 94 20.030 -5.889 -5.849 1.00 1.68 H new ATOM 0 HB VAL A 94 20.262 -8.909 -5.956 1.00 2.11 H new ATOM 0 HG11 VAL A 94 19.671 -8.684 -8.335 1.00 2.63 H new ATOM 0 HG12 VAL A 94 18.344 -8.158 -7.272 1.00 2.63 H new ATOM 0 HG13 VAL A 94 19.362 -6.949 -8.090 1.00 2.63 H new ATOM 0 HG21 VAL A 94 22.019 -8.438 -7.617 1.00 2.56 H new ATOM 0 HG22 VAL A 94 21.804 -6.692 -7.343 1.00 2.56 H new ATOM 0 HG23 VAL A 94 22.405 -7.732 -6.030 1.00 2.56 H new ATOM 1299 N CYS A 95 17.669 -5.980 -5.112 1.00 1.47 N ATOM 1300 CA CYS A 95 16.247 -5.996 -4.838 1.00 1.46 C ATOM 1301 C CYS A 95 15.584 -4.879 -5.622 1.00 1.37 C ATOM 1302 O CYS A 95 15.968 -3.717 -5.503 1.00 1.52 O ATOM 1303 CB CYS A 95 15.970 -5.789 -3.342 1.00 1.77 C ATOM 1304 SG CYS A 95 16.907 -6.870 -2.233 1.00 2.83 S ATOM 0 H CYS A 95 18.032 -5.062 -5.370 1.00 1.47 H new ATOM 0 HA CYS A 95 15.846 -6.966 -5.133 1.00 1.46 H new ATOM 0 HB2 CYS A 95 16.191 -4.753 -3.087 1.00 1.77 H new ATOM 0 HB3 CYS A 95 14.906 -5.942 -3.160 1.00 1.77 H new ATOM 0 HG CYS A 95 17.478 -7.811 -2.925 1.00 2.83 H new ATOM 1310 N THR A 96 14.626 -5.218 -6.455 1.00 1.52 N ATOM 1311 CA THR A 96 13.861 -4.203 -7.146 1.00 1.59 C ATOM 1312 C THR A 96 12.442 -4.657 -7.340 1.00 1.08 C ATOM 1313 O THR A 96 12.196 -5.725 -7.896 1.00 1.31 O ATOM 1314 CB THR A 96 14.426 -3.872 -8.525 1.00 2.27 C ATOM 1315 OG1 THR A 96 15.859 -3.957 -8.505 1.00 2.76 O ATOM 1316 CG2 THR A 96 14.005 -2.476 -8.956 1.00 2.98 C ATOM 0 H THR A 96 14.359 -6.179 -6.670 1.00 1.52 H new ATOM 0 HA THR A 96 13.913 -3.313 -6.519 1.00 1.59 H new ATOM 0 HB THR A 96 14.031 -4.595 -9.239 1.00 2.27 H new ATOM 0 HG1 THR A 96 16.212 -3.745 -9.394 1.00 2.76 H new ATOM 0 HG21 THR A 96 14.418 -2.259 -9.941 1.00 2.98 H new ATOM 0 HG22 THR A 96 12.917 -2.421 -8.998 1.00 2.98 H new ATOM 0 HG23 THR A 96 14.378 -1.746 -8.238 1.00 2.98 H new ATOM 1324 N LYS A 97 11.526 -3.849 -6.849 1.00 1.14 N ATOM 1325 CA LYS A 97 10.101 -4.032 -7.064 1.00 1.11 C ATOM 1326 C LYS A 97 9.519 -5.200 -6.274 1.00 1.04 C ATOM 1327 O LYS A 97 8.330 -5.203 -6.003 1.00 1.76 O ATOM 1328 CB LYS A 97 9.768 -4.225 -8.540 1.00 1.47 C ATOM 1329 CG LYS A 97 10.025 -3.009 -9.409 1.00 1.47 C ATOM 1330 CD LYS A 97 9.736 -3.319 -10.866 1.00 1.89 C ATOM 1331 CE LYS A 97 10.028 -2.134 -11.767 1.00 2.34 C ATOM 1332 NZ LYS A 97 9.833 -2.483 -13.198 1.00 2.72 N ATOM 0 H LYS A 97 11.751 -3.033 -6.280 1.00 1.14 H new ATOM 0 HA LYS A 97 9.643 -3.112 -6.702 1.00 1.11 H new ATOM 0 HB2 LYS A 97 10.353 -5.060 -8.925 1.00 1.47 H new ATOM 0 HB3 LYS A 97 8.718 -4.503 -8.629 1.00 1.47 H new ATOM 0 HG2 LYS A 97 9.399 -2.180 -9.077 1.00 1.47 H new ATOM 0 HG3 LYS A 97 11.061 -2.690 -9.299 1.00 1.47 H new ATOM 0 HD2 LYS A 97 10.337 -4.171 -11.182 1.00 1.89 H new ATOM 0 HD3 LYS A 97 8.691 -3.609 -10.975 1.00 1.89 H new ATOM 0 HE2 LYS A 97 9.375 -1.303 -11.501 1.00 2.34 H new ATOM 0 HE3 LYS A 97 11.053 -1.798 -11.609 1.00 2.34 H new ATOM 0 HZ1 LYS A 97 10.040 -1.653 -13.789 1.00 2.72 H new ATOM 0 HZ2 LYS A 97 10.474 -3.260 -13.456 1.00 2.72 H new ATOM 0 HZ3 LYS A 97 8.848 -2.780 -13.352 1.00 2.72 H new ATOM 1346 N PHE A 98 10.365 -6.192 -5.962 1.00 0.89 N ATOM 1347 CA PHE A 98 9.985 -7.443 -5.276 1.00 0.92 C ATOM 1348 C PHE A 98 9.090 -8.315 -6.178 1.00 1.11 C ATOM 1349 O PHE A 98 9.274 -9.530 -6.239 1.00 2.12 O ATOM 1350 CB PHE A 98 9.373 -7.186 -3.870 1.00 1.15 C ATOM 1351 CG PHE A 98 7.869 -7.173 -3.770 1.00 0.75 C ATOM 1352 CD1 PHE A 98 7.151 -8.355 -3.757 1.00 1.02 C ATOM 1353 CD2 PHE A 98 7.177 -5.978 -3.672 1.00 0.96 C ATOM 1354 CE1 PHE A 98 5.778 -8.342 -3.656 1.00 0.94 C ATOM 1355 CE2 PHE A 98 5.805 -5.964 -3.571 1.00 0.87 C ATOM 1356 CZ PHE A 98 5.109 -7.148 -3.564 1.00 0.45 C ATOM 0 H PHE A 98 11.360 -6.149 -6.184 1.00 0.89 H new ATOM 0 HA PHE A 98 10.897 -8.011 -5.091 1.00 0.92 H new ATOM 0 HB2 PHE A 98 9.751 -7.951 -3.191 1.00 1.15 H new ATOM 0 HB3 PHE A 98 9.745 -6.227 -3.509 1.00 1.15 H new ATOM 0 HD1 PHE A 98 7.673 -9.298 -3.827 1.00 1.02 H new ATOM 0 HD2 PHE A 98 7.721 -5.045 -3.675 1.00 0.96 H new ATOM 0 HE1 PHE A 98 5.228 -9.271 -3.649 1.00 0.94 H new ATOM 0 HE2 PHE A 98 5.277 -5.025 -3.497 1.00 0.87 H new ATOM 0 HZ PHE A 98 4.032 -7.139 -3.486 1.00 0.45 H new ATOM 1366 N LYS A 99 8.154 -7.674 -6.885 1.00 0.80 N ATOM 1367 CA LYS A 99 7.299 -8.313 -7.895 1.00 0.78 C ATOM 1368 C LYS A 99 6.337 -9.331 -7.305 1.00 0.79 C ATOM 1369 O LYS A 99 6.666 -10.071 -6.378 1.00 1.43 O ATOM 1370 CB LYS A 99 8.110 -8.918 -9.038 1.00 1.02 C ATOM 1371 CG LYS A 99 8.678 -7.857 -9.960 1.00 1.34 C ATOM 1372 CD LYS A 99 10.083 -7.446 -9.555 1.00 1.63 C ATOM 1373 CE LYS A 99 11.146 -8.168 -10.370 1.00 2.05 C ATOM 1374 NZ LYS A 99 11.039 -9.645 -10.267 1.00 2.69 N ATOM 0 H LYS A 99 7.965 -6.678 -6.771 1.00 0.80 H new ATOM 0 HA LYS A 99 6.689 -7.511 -8.310 1.00 0.78 H new ATOM 0 HB2 LYS A 99 8.925 -9.514 -8.627 1.00 1.02 H new ATOM 0 HB3 LYS A 99 7.477 -9.595 -9.612 1.00 1.02 H new ATOM 0 HG2 LYS A 99 8.691 -8.234 -10.983 1.00 1.34 H new ATOM 0 HG3 LYS A 99 8.027 -6.983 -9.951 1.00 1.34 H new ATOM 0 HD2 LYS A 99 10.197 -6.370 -9.683 1.00 1.63 H new ATOM 0 HD3 LYS A 99 10.232 -7.658 -8.496 1.00 1.63 H new ATOM 0 HE2 LYS A 99 11.059 -7.873 -11.416 1.00 2.05 H new ATOM 0 HE3 LYS A 99 12.133 -7.854 -10.031 1.00 2.05 H new ATOM 0 HZ1 LYS A 99 11.853 -10.086 -10.741 1.00 2.69 H new ATOM 0 HZ2 LYS A 99 11.030 -9.923 -9.265 1.00 2.69 H new ATOM 0 HZ3 LYS A 99 10.159 -9.962 -10.723 1.00 2.69 H new ATOM 1388 N ALA A 100 5.136 -9.366 -7.869 1.00 0.51 N ATOM 1389 CA ALA A 100 4.032 -10.090 -7.273 1.00 0.43 C ATOM 1390 C ALA A 100 2.806 -10.054 -8.154 1.00 0.40 C ATOM 1391 O ALA A 100 2.858 -9.629 -9.306 1.00 0.55 O ATOM 1392 CB ALA A 100 3.665 -9.454 -5.957 1.00 0.43 C ATOM 0 H ALA A 100 4.906 -8.896 -8.745 1.00 0.51 H new ATOM 0 HA ALA A 100 4.352 -11.123 -7.140 1.00 0.43 H new ATOM 0 HB1 ALA A 100 2.834 -9.999 -5.509 1.00 0.43 H new ATOM 0 HB2 ALA A 100 4.523 -9.485 -5.286 1.00 0.43 H new ATOM 0 HB3 ALA A 100 3.371 -8.417 -6.123 1.00 0.43 H new ATOM 1398 N GLU A 101 1.697 -10.466 -7.571 1.00 0.34 N ATOM 1399 CA GLU A 101 0.418 -10.421 -8.237 1.00 0.40 C ATOM 1400 C GLU A 101 -0.395 -9.222 -7.768 1.00 0.43 C ATOM 1401 O GLU A 101 -1.553 -9.370 -7.400 1.00 0.67 O ATOM 1402 CB GLU A 101 -0.354 -11.713 -7.983 1.00 0.50 C ATOM 1403 CG GLU A 101 0.196 -12.901 -8.747 1.00 0.67 C ATOM 1404 CD GLU A 101 0.129 -12.695 -10.243 1.00 1.24 C ATOM 1405 OE1 GLU A 101 -0.993 -12.581 -10.782 1.00 1.57 O ATOM 1406 OE2 GLU A 101 1.201 -12.654 -10.882 1.00 1.99 O ATOM 0 H GLU A 101 1.661 -10.840 -6.623 1.00 0.34 H new ATOM 0 HA GLU A 101 0.593 -10.318 -9.308 1.00 0.40 H new ATOM 0 HB2 GLU A 101 -0.335 -11.936 -6.916 1.00 0.50 H new ATOM 0 HB3 GLU A 101 -1.398 -11.564 -8.259 1.00 0.50 H new ATOM 0 HG2 GLU A 101 1.231 -13.074 -8.451 1.00 0.67 H new ATOM 0 HG3 GLU A 101 -0.366 -13.796 -8.479 1.00 0.67 H new ATOM 1413 N PHE A 102 0.232 -8.045 -7.744 1.00 0.38 N ATOM 1414 CA PHE A 102 -0.471 -6.806 -7.469 1.00 0.40 C ATOM 1415 C PHE A 102 -0.164 -5.795 -8.549 1.00 0.45 C ATOM 1416 O PHE A 102 0.662 -6.028 -9.431 1.00 0.80 O ATOM 1417 CB PHE A 102 -0.023 -6.128 -6.190 1.00 0.84 C ATOM 1418 CG PHE A 102 0.449 -7.022 -5.149 1.00 0.45 C ATOM 1419 CD1 PHE A 102 -0.397 -7.918 -4.563 1.00 0.52 C ATOM 1420 CD2 PHE A 102 1.752 -6.952 -4.751 1.00 0.62 C ATOM 1421 CE1 PHE A 102 0.063 -8.747 -3.594 1.00 0.59 C ATOM 1422 CE2 PHE A 102 2.217 -7.774 -3.782 1.00 0.58 C ATOM 1423 CZ PHE A 102 1.371 -8.680 -3.199 1.00 0.44 C ATOM 0 H PHE A 102 1.231 -7.931 -7.914 1.00 0.38 H new ATOM 0 HA PHE A 102 -1.522 -7.087 -7.405 1.00 0.40 H new ATOM 0 HB2 PHE A 102 0.774 -5.424 -6.431 1.00 0.84 H new ATOM 0 HB3 PHE A 102 -0.855 -5.545 -5.796 1.00 0.84 H new ATOM 0 HD1 PHE A 102 -1.431 -7.967 -4.871 1.00 0.52 H new ATOM 0 HD2 PHE A 102 2.416 -6.236 -5.212 1.00 0.62 H new ATOM 0 HE1 PHE A 102 -0.604 -9.461 -3.133 1.00 0.59 H new ATOM 0 HE2 PHE A 102 3.249 -7.716 -3.470 1.00 0.58 H new ATOM 0 HZ PHE A 102 1.737 -9.341 -2.427 1.00 0.44 H new ATOM 1433 N PRO A 103 -0.812 -4.646 -8.458 1.00 0.33 N ATOM 1434 CA PRO A 103 -0.359 -3.420 -9.084 1.00 0.39 C ATOM 1435 C PRO A 103 0.796 -2.823 -8.284 1.00 0.41 C ATOM 1436 O PRO A 103 0.609 -1.897 -7.494 1.00 0.62 O ATOM 1437 CB PRO A 103 -1.615 -2.528 -9.055 1.00 0.42 C ATOM 1438 CG PRO A 103 -2.727 -3.464 -8.692 1.00 0.58 C ATOM 1439 CD PRO A 103 -2.088 -4.453 -7.787 1.00 0.27 C ATOM 0 HA PRO A 103 0.026 -3.549 -10.096 1.00 0.39 H new ATOM 0 HB2 PRO A 103 -1.516 -1.726 -8.324 1.00 0.42 H new ATOM 0 HB3 PRO A 103 -1.791 -2.058 -10.022 1.00 0.42 H new ATOM 0 HG2 PRO A 103 -3.544 -2.939 -8.196 1.00 0.58 H new ATOM 0 HG3 PRO A 103 -3.147 -3.945 -9.575 1.00 0.58 H new ATOM 0 HD2 PRO A 103 -1.969 -4.070 -6.773 1.00 0.27 H new ATOM 0 HD3 PRO A 103 -2.661 -5.377 -7.713 1.00 0.27 H new ATOM 1447 N ILE A 104 1.989 -3.402 -8.460 1.00 0.35 N ATOM 1448 CA ILE A 104 3.192 -2.893 -7.810 1.00 0.35 C ATOM 1449 C ILE A 104 3.693 -1.714 -8.613 1.00 0.33 C ATOM 1450 O ILE A 104 3.908 -1.821 -9.820 1.00 0.44 O ATOM 1451 CB ILE A 104 4.330 -3.929 -7.700 1.00 0.41 C ATOM 1452 CG1 ILE A 104 3.933 -5.159 -6.891 1.00 0.52 C ATOM 1453 CG2 ILE A 104 5.563 -3.277 -7.078 1.00 0.45 C ATOM 1454 CD1 ILE A 104 4.905 -6.272 -7.091 1.00 1.34 C ATOM 0 H ILE A 104 2.143 -4.222 -9.047 1.00 0.35 H new ATOM 0 HA ILE A 104 2.917 -2.622 -6.791 1.00 0.35 H new ATOM 0 HB ILE A 104 4.552 -4.269 -8.711 1.00 0.41 H new ATOM 0 HG12 ILE A 104 3.884 -4.901 -5.833 1.00 0.52 H new ATOM 0 HG13 ILE A 104 2.936 -5.486 -7.186 1.00 0.52 H new ATOM 0 HG21 ILE A 104 6.364 -4.012 -7.002 1.00 0.45 H new ATOM 0 HG22 ILE A 104 5.890 -2.447 -7.704 1.00 0.45 H new ATOM 0 HG23 ILE A 104 5.316 -2.906 -6.083 1.00 0.45 H new ATOM 0 HD11 ILE A 104 4.596 -7.135 -6.502 1.00 1.34 H new ATOM 0 HD12 ILE A 104 4.934 -6.544 -8.146 1.00 1.34 H new ATOM 0 HD13 ILE A 104 5.896 -5.951 -6.772 1.00 1.34 H new ATOM 1466 N MET A 105 3.886 -0.604 -7.948 1.00 0.29 N ATOM 1467 CA MET A 105 4.011 0.653 -8.632 1.00 0.30 C ATOM 1468 C MET A 105 5.448 1.171 -8.673 1.00 0.27 C ATOM 1469 O MET A 105 6.403 0.458 -8.360 1.00 0.35 O ATOM 1470 CB MET A 105 3.092 1.665 -7.959 1.00 0.43 C ATOM 1471 CG MET A 105 1.663 1.184 -7.812 1.00 1.50 C ATOM 1472 SD MET A 105 0.680 1.325 -9.323 1.00 2.49 S ATOM 1473 CE MET A 105 1.263 -0.054 -10.302 1.00 3.03 C ATOM 0 H MET A 105 3.960 -0.547 -6.932 1.00 0.29 H new ATOM 0 HA MET A 105 3.719 0.504 -9.671 1.00 0.30 H new ATOM 0 HB2 MET A 105 3.489 1.904 -6.972 1.00 0.43 H new ATOM 0 HB3 MET A 105 3.098 2.589 -8.537 1.00 0.43 H new ATOM 0 HG2 MET A 105 1.672 0.142 -7.493 1.00 1.50 H new ATOM 0 HG3 MET A 105 1.178 1.755 -7.021 1.00 1.50 H new ATOM 0 HE1 MET A 105 0.578 -0.227 -11.132 1.00 3.03 H new ATOM 0 HE2 MET A 105 2.256 0.171 -10.692 1.00 3.03 H new ATOM 0 HE3 MET A 105 1.311 -0.947 -9.680 1.00 3.03 H new ATOM 1483 N ALA A 106 5.571 2.434 -9.072 1.00 0.33 N ATOM 1484 CA ALA A 106 6.850 3.051 -9.428 1.00 0.52 C ATOM 1485 C ALA A 106 7.707 3.418 -8.229 1.00 0.66 C ATOM 1486 O ALA A 106 8.759 4.036 -8.388 1.00 1.46 O ATOM 1487 CB ALA A 106 6.577 4.297 -10.238 1.00 0.70 C ATOM 0 H ALA A 106 4.776 3.068 -9.159 1.00 0.33 H new ATOM 0 HA ALA A 106 7.412 2.311 -9.998 1.00 0.52 H new ATOM 0 HB1 ALA A 106 7.521 4.768 -10.511 1.00 0.70 H new ATOM 0 HB2 ALA A 106 6.030 4.030 -11.142 1.00 0.70 H new ATOM 0 HB3 ALA A 106 5.982 4.993 -9.646 1.00 0.70 H new ATOM 1493 N LYS A 107 7.260 3.012 -7.050 1.00 0.40 N ATOM 1494 CA LYS A 107 7.835 3.458 -5.782 1.00 0.36 C ATOM 1495 C LYS A 107 7.601 4.916 -5.577 1.00 0.38 C ATOM 1496 O LYS A 107 7.710 5.738 -6.487 1.00 0.59 O ATOM 1497 CB LYS A 107 9.354 3.258 -5.651 1.00 0.49 C ATOM 1498 CG LYS A 107 9.860 1.869 -5.908 1.00 0.84 C ATOM 1499 CD LYS A 107 11.351 1.785 -5.656 1.00 0.83 C ATOM 1500 CE LYS A 107 11.878 0.397 -5.941 1.00 0.95 C ATOM 1501 NZ LYS A 107 11.890 0.104 -7.399 1.00 1.76 N ATOM 0 H LYS A 107 6.483 2.360 -6.942 1.00 0.40 H new ATOM 0 HA LYS A 107 7.333 2.835 -5.042 1.00 0.36 H new ATOM 0 HB2 LYS A 107 9.851 3.938 -6.343 1.00 0.49 H new ATOM 0 HB3 LYS A 107 9.654 3.552 -4.645 1.00 0.49 H new ATOM 0 HG2 LYS A 107 9.337 1.162 -5.264 1.00 0.84 H new ATOM 0 HG3 LYS A 107 9.644 1.583 -6.937 1.00 0.84 H new ATOM 0 HD2 LYS A 107 11.870 2.509 -6.284 1.00 0.83 H new ATOM 0 HD3 LYS A 107 11.563 2.051 -4.620 1.00 0.83 H new ATOM 0 HE2 LYS A 107 12.888 0.302 -5.542 1.00 0.95 H new ATOM 0 HE3 LYS A 107 11.261 -0.340 -5.426 1.00 0.95 H new ATOM 0 HZ1 LYS A 107 12.380 -0.797 -7.568 1.00 1.76 H new ATOM 0 HZ2 LYS A 107 10.912 0.037 -7.748 1.00 1.76 H new ATOM 0 HZ3 LYS A 107 12.386 0.867 -7.902 1.00 1.76 H new ATOM 1515 N ILE A 108 7.284 5.231 -4.363 1.00 0.31 N ATOM 1516 CA ILE A 108 7.311 6.565 -3.915 1.00 0.35 C ATOM 1517 C ILE A 108 7.913 6.538 -2.524 1.00 0.36 C ATOM 1518 O ILE A 108 8.017 5.473 -1.910 1.00 0.42 O ATOM 1519 CB ILE A 108 5.908 7.206 -3.919 1.00 0.48 C ATOM 1520 CG1 ILE A 108 5.101 6.827 -2.671 1.00 0.82 C ATOM 1521 CG2 ILE A 108 5.142 6.811 -5.190 1.00 0.68 C ATOM 1522 CD1 ILE A 108 4.865 5.353 -2.512 1.00 0.64 C ATOM 0 H ILE A 108 6.998 4.555 -3.655 1.00 0.31 H new ATOM 0 HA ILE A 108 7.908 7.183 -4.585 1.00 0.35 H new ATOM 0 HB ILE A 108 6.044 8.287 -3.906 1.00 0.48 H new ATOM 0 HG12 ILE A 108 5.623 7.197 -1.789 1.00 0.82 H new ATOM 0 HG13 ILE A 108 4.138 7.336 -2.707 1.00 0.82 H new ATOM 0 HG21 ILE A 108 4.154 7.271 -5.177 1.00 0.68 H new ATOM 0 HG22 ILE A 108 5.691 7.154 -6.067 1.00 0.68 H new ATOM 0 HG23 ILE A 108 5.036 5.727 -5.229 1.00 0.68 H new ATOM 0 HD11 ILE A 108 4.288 5.173 -1.605 1.00 0.64 H new ATOM 0 HD12 ILE A 108 4.313 4.978 -3.374 1.00 0.64 H new ATOM 0 HD13 ILE A 108 5.822 4.837 -2.441 1.00 0.64 H new ATOM 1534 N ASN A 109 8.335 7.671 -2.045 1.00 0.38 N ATOM 1535 CA ASN A 109 8.978 7.745 -0.745 1.00 0.44 C ATOM 1536 C ASN A 109 7.956 7.568 0.360 1.00 0.47 C ATOM 1537 O ASN A 109 7.457 8.545 0.913 1.00 0.76 O ATOM 1538 CB ASN A 109 9.711 9.077 -0.632 1.00 0.53 C ATOM 1539 CG ASN A 109 10.614 9.215 0.582 1.00 0.98 C ATOM 1540 OD1 ASN A 109 11.663 9.836 0.487 1.00 1.73 O ATOM 1541 ND2 ASN A 109 10.218 8.678 1.726 1.00 1.16 N ATOM 0 H ASN A 109 8.250 8.565 -2.529 1.00 0.38 H new ATOM 0 HA ASN A 109 9.704 6.939 -0.640 1.00 0.44 H new ATOM 0 HB2 ASN A 109 10.311 9.221 -1.530 1.00 0.53 H new ATOM 0 HB3 ASN A 109 8.973 9.879 -0.610 1.00 0.53 H new ATOM 0 HD21 ASN A 109 10.794 8.777 2.562 1.00 1.16 H new ATOM 0 HD22 ASN A 109 9.337 8.166 1.771 1.00 1.16 H new ATOM 1548 N VAL A 110 7.634 6.322 0.684 1.00 0.41 N ATOM 1549 CA VAL A 110 6.721 6.078 1.778 1.00 0.42 C ATOM 1550 C VAL A 110 7.470 6.184 3.087 1.00 0.44 C ATOM 1551 O VAL A 110 7.969 5.201 3.630 1.00 0.48 O ATOM 1552 CB VAL A 110 6.092 4.684 1.650 1.00 0.43 C ATOM 1553 CG1 VAL A 110 4.979 4.733 0.639 1.00 0.60 C ATOM 1554 CG2 VAL A 110 7.132 3.656 1.236 1.00 0.77 C ATOM 0 H VAL A 110 7.985 5.487 0.214 1.00 0.41 H new ATOM 0 HA VAL A 110 5.924 6.822 1.749 1.00 0.42 H new ATOM 0 HB VAL A 110 5.693 4.386 2.620 1.00 0.43 H new ATOM 0 HG11 VAL A 110 4.529 3.745 0.545 1.00 0.60 H new ATOM 0 HG12 VAL A 110 4.222 5.446 0.965 1.00 0.60 H new ATOM 0 HG13 VAL A 110 5.378 5.044 -0.327 1.00 0.60 H new ATOM 0 HG21 VAL A 110 6.662 2.676 1.152 1.00 0.77 H new ATOM 0 HG22 VAL A 110 7.559 3.937 0.273 1.00 0.77 H new ATOM 0 HG23 VAL A 110 7.923 3.616 1.985 1.00 0.77 H new ATOM 1564 N ASN A 111 7.481 7.393 3.605 1.00 0.48 N ATOM 1565 CA ASN A 111 8.139 7.704 4.847 1.00 0.56 C ATOM 1566 C ASN A 111 8.055 9.195 5.058 1.00 0.62 C ATOM 1567 O ASN A 111 7.453 9.903 4.251 1.00 0.67 O ATOM 1568 CB ASN A 111 9.589 7.245 4.874 1.00 0.65 C ATOM 1569 CG ASN A 111 10.028 6.958 6.296 1.00 1.20 C ATOM 1570 OD1 ASN A 111 10.532 7.839 6.995 1.00 1.90 O ATOM 1571 ND2 ASN A 111 9.800 5.735 6.750 1.00 1.72 N ATOM 0 H ASN A 111 7.027 8.194 3.167 1.00 0.48 H new ATOM 0 HA ASN A 111 7.637 7.167 5.651 1.00 0.56 H new ATOM 0 HB2 ASN A 111 9.705 6.349 4.264 1.00 0.65 H new ATOM 0 HB3 ASN A 111 10.228 8.013 4.438 1.00 0.65 H new ATOM 0 HD21 ASN A 111 10.044 5.494 7.711 1.00 1.72 H new ATOM 0 HD22 ASN A 111 9.381 5.034 6.139 1.00 1.72 H new ATOM 1578 N GLY A 112 8.657 9.677 6.123 1.00 0.73 N ATOM 1579 CA GLY A 112 8.582 11.079 6.420 1.00 0.85 C ATOM 1580 C GLY A 112 9.699 11.899 5.840 1.00 0.93 C ATOM 1581 O GLY A 112 10.165 12.840 6.482 1.00 1.47 O ATOM 0 H GLY A 112 9.196 9.122 6.787 1.00 0.73 H new ATOM 0 HA2 GLY A 112 7.633 11.466 6.048 1.00 0.85 H new ATOM 0 HA3 GLY A 112 8.577 11.209 7.502 1.00 0.85 H new ATOM 1585 N GLU A 113 10.144 11.576 4.637 1.00 0.88 N ATOM 1586 CA GLU A 113 11.069 12.463 3.972 1.00 1.23 C ATOM 1587 C GLU A 113 10.374 13.235 2.858 1.00 1.10 C ATOM 1588 O GLU A 113 10.451 14.462 2.825 1.00 1.39 O ATOM 1589 CB GLU A 113 12.264 11.677 3.435 1.00 1.61 C ATOM 1590 CG GLU A 113 12.739 12.125 2.068 1.00 1.83 C ATOM 1591 CD GLU A 113 13.487 13.443 2.080 1.00 2.29 C ATOM 1592 OE1 GLU A 113 14.623 13.482 2.592 1.00 2.81 O ATOM 1593 OE2 GLU A 113 12.933 14.453 1.604 1.00 2.65 O ATOM 0 H GLU A 113 9.888 10.735 4.119 1.00 0.88 H new ATOM 0 HA GLU A 113 11.436 13.189 4.698 1.00 1.23 H new ATOM 0 HB2 GLU A 113 13.090 11.766 4.141 1.00 1.61 H new ATOM 0 HB3 GLU A 113 11.998 10.621 3.387 1.00 1.61 H new ATOM 0 HG2 GLU A 113 13.386 11.355 1.649 1.00 1.83 H new ATOM 0 HG3 GLU A 113 11.878 12.213 1.406 1.00 1.83 H new ATOM 1600 N ASN A 114 9.651 12.553 1.969 1.00 0.79 N ATOM 1601 CA ASN A 114 8.988 13.279 0.905 1.00 0.79 C ATOM 1602 C ASN A 114 7.541 12.863 0.766 1.00 0.79 C ATOM 1603 O ASN A 114 6.674 13.732 0.691 1.00 1.22 O ATOM 1604 CB ASN A 114 9.720 13.041 -0.418 1.00 0.87 C ATOM 1605 CG ASN A 114 9.277 13.987 -1.522 1.00 1.45 C ATOM 1606 OD1 ASN A 114 8.954 15.221 -1.164 1.00 2.06 O flip ATOM 1607 ND2 ASN A 114 9.247 13.613 -2.695 1.00 2.16 N flip ATOM 0 H ASN A 114 9.517 11.542 1.967 1.00 0.79 H new ATOM 0 HA ASN A 114 9.012 14.339 1.157 1.00 0.79 H new ATOM 0 HB2 ASN A 114 10.792 13.155 -0.259 1.00 0.87 H new ATOM 0 HB3 ASN A 114 9.553 12.013 -0.739 1.00 0.87 H new ATOM 0 HD21 ASN A 114 9.503 12.654 -2.931 1.00 2.16 H new ATOM 0 HD22 ASN A 114 8.966 14.262 -3.430 1.00 2.16 H new ATOM 1614 N ALA A 115 7.277 11.547 0.857 1.00 0.59 N ATOM 1615 CA ALA A 115 5.936 11.004 0.673 1.00 0.61 C ATOM 1616 C ALA A 115 5.329 11.437 -0.668 1.00 0.68 C ATOM 1617 O ALA A 115 5.477 12.570 -1.116 1.00 1.26 O ATOM 1618 CB ALA A 115 5.041 11.394 1.838 1.00 0.86 C ATOM 0 H ALA A 115 7.986 10.842 1.059 1.00 0.59 H new ATOM 0 HA ALA A 115 6.013 9.917 0.651 1.00 0.61 H new ATOM 0 HB1 ALA A 115 4.044 10.981 1.685 1.00 0.86 H new ATOM 0 HB2 ALA A 115 5.458 11.001 2.765 1.00 0.86 H new ATOM 0 HB3 ALA A 115 4.978 12.480 1.901 1.00 0.86 H new ATOM 1624 N HIS A 116 4.646 10.538 -1.337 1.00 0.42 N ATOM 1625 CA HIS A 116 4.022 10.899 -2.582 1.00 0.35 C ATOM 1626 C HIS A 116 2.656 11.430 -2.266 1.00 0.29 C ATOM 1627 O HIS A 116 2.042 10.929 -1.346 1.00 0.29 O ATOM 1628 CB HIS A 116 3.975 9.669 -3.481 1.00 0.35 C ATOM 1629 CG HIS A 116 2.929 9.678 -4.536 1.00 0.31 C ATOM 1630 ND1 HIS A 116 1.624 9.476 -4.223 1.00 0.33 N ATOM 1631 CD2 HIS A 116 2.971 9.886 -5.873 1.00 0.31 C ATOM 1632 CE1 HIS A 116 0.895 9.573 -5.296 1.00 0.32 C ATOM 1633 NE2 HIS A 116 1.678 9.819 -6.322 1.00 0.32 N ATOM 0 H HIS A 116 4.511 9.570 -1.045 1.00 0.42 H new ATOM 0 HA HIS A 116 4.579 11.670 -3.115 1.00 0.35 H new ATOM 0 HB2 HIS A 116 4.947 9.556 -3.961 1.00 0.35 H new ATOM 0 HB3 HIS A 116 3.825 8.790 -2.854 1.00 0.35 H new ATOM 0 HD2 HIS A 116 3.852 10.069 -6.470 1.00 0.31 H new ATOM 0 HE1 HIS A 116 -0.179 9.468 -5.337 1.00 0.32 H new ATOM 0 HE2 HIS A 116 1.375 9.940 -7.288 1.00 0.32 H new ATOM 1642 N PRO A 117 2.187 12.454 -2.999 1.00 0.31 N ATOM 1643 CA PRO A 117 0.871 13.055 -2.836 1.00 0.31 C ATOM 1644 C PRO A 117 -0.166 12.115 -2.219 1.00 0.26 C ATOM 1645 O PRO A 117 -0.830 12.475 -1.258 1.00 0.27 O ATOM 1646 CB PRO A 117 0.512 13.404 -4.279 1.00 0.37 C ATOM 1647 CG PRO A 117 1.820 13.645 -4.975 1.00 0.40 C ATOM 1648 CD PRO A 117 2.919 13.160 -4.057 1.00 0.38 C ATOM 0 HA PRO A 117 0.881 13.899 -2.146 1.00 0.31 H new ATOM 0 HB2 PRO A 117 -0.040 12.592 -4.753 1.00 0.37 H new ATOM 0 HB3 PRO A 117 -0.123 14.289 -4.322 1.00 0.37 H new ATOM 0 HG2 PRO A 117 1.852 13.113 -5.926 1.00 0.40 H new ATOM 0 HG3 PRO A 117 1.946 14.704 -5.198 1.00 0.40 H new ATOM 0 HD2 PRO A 117 3.614 12.499 -4.575 1.00 0.38 H new ATOM 0 HD3 PRO A 117 3.504 13.988 -3.658 1.00 0.38 H new ATOM 1656 N LEU A 118 -0.248 10.892 -2.745 1.00 0.24 N ATOM 1657 CA LEU A 118 -1.198 9.902 -2.276 1.00 0.23 C ATOM 1658 C LEU A 118 -0.852 9.402 -0.875 1.00 0.27 C ATOM 1659 O LEU A 118 -1.717 9.323 -0.024 1.00 0.28 O ATOM 1660 CB LEU A 118 -1.246 8.746 -3.266 1.00 0.24 C ATOM 1661 CG LEU A 118 -2.000 7.508 -2.811 1.00 0.25 C ATOM 1662 CD1 LEU A 118 -3.462 7.837 -2.630 1.00 0.39 C ATOM 1663 CD2 LEU A 118 -1.829 6.385 -3.818 1.00 0.27 C ATOM 0 H LEU A 118 0.346 10.567 -3.508 1.00 0.24 H new ATOM 0 HA LEU A 118 -2.181 10.369 -2.211 1.00 0.23 H new ATOM 0 HB2 LEU A 118 -1.700 9.104 -4.190 1.00 0.24 H new ATOM 0 HB3 LEU A 118 -0.223 8.456 -3.505 1.00 0.24 H new ATOM 0 HG LEU A 118 -1.593 7.176 -1.856 1.00 0.25 H new ATOM 0 HD11 LEU A 118 -3.998 6.946 -2.304 1.00 0.39 H new ATOM 0 HD12 LEU A 118 -3.569 8.620 -1.879 1.00 0.39 H new ATOM 0 HD13 LEU A 118 -3.877 8.184 -3.577 1.00 0.39 H new ATOM 0 HD21 LEU A 118 -2.375 5.505 -3.478 1.00 0.27 H new ATOM 0 HD22 LEU A 118 -2.218 6.702 -4.786 1.00 0.27 H new ATOM 0 HD23 LEU A 118 -0.771 6.141 -3.914 1.00 0.27 H new ATOM 1675 N TYR A 119 0.420 9.082 -0.638 1.00 0.32 N ATOM 1676 CA TYR A 119 0.835 8.495 0.632 1.00 0.42 C ATOM 1677 C TYR A 119 1.038 9.551 1.665 1.00 0.40 C ATOM 1678 O TYR A 119 0.845 9.333 2.856 1.00 0.41 O ATOM 1679 CB TYR A 119 2.093 7.672 0.482 1.00 0.57 C ATOM 1680 CG TYR A 119 1.780 6.248 0.187 1.00 0.54 C ATOM 1681 CD1 TYR A 119 1.388 5.856 -1.081 1.00 0.92 C ATOM 1682 CD2 TYR A 119 1.893 5.293 1.172 1.00 1.09 C ATOM 1683 CE1 TYR A 119 1.105 4.541 -1.357 1.00 1.74 C ATOM 1684 CE2 TYR A 119 1.620 3.979 0.911 1.00 1.88 C ATOM 1685 CZ TYR A 119 1.176 3.612 -0.358 1.00 2.20 C ATOM 1686 OH TYR A 119 0.925 2.296 -0.636 1.00 3.04 O ATOM 0 H TYR A 119 1.177 9.219 -1.307 1.00 0.32 H new ATOM 0 HA TYR A 119 0.033 7.832 0.956 1.00 0.42 H new ATOM 0 HB2 TYR A 119 2.706 8.085 -0.319 1.00 0.57 H new ATOM 0 HB3 TYR A 119 2.681 7.734 1.397 1.00 0.57 H new ATOM 0 HD1 TYR A 119 1.303 6.595 -1.864 1.00 0.92 H new ATOM 0 HD2 TYR A 119 2.202 5.586 2.165 1.00 1.09 H new ATOM 0 HE1 TYR A 119 0.828 4.243 -2.357 1.00 1.74 H new ATOM 0 HE2 TYR A 119 1.747 3.232 1.681 1.00 1.88 H new ATOM 0 HH TYR A 119 0.669 1.831 0.188 1.00 3.04 H new ATOM 1696 N GLU A 120 1.462 10.684 1.188 1.00 0.40 N ATOM 1697 CA GLU A 120 1.563 11.855 1.992 1.00 0.42 C ATOM 1698 C GLU A 120 0.178 12.213 2.419 1.00 0.37 C ATOM 1699 O GLU A 120 -0.045 12.633 3.544 1.00 0.43 O ATOM 1700 CB GLU A 120 2.199 12.944 1.144 1.00 0.50 C ATOM 1701 CG GLU A 120 2.534 14.211 1.871 1.00 0.76 C ATOM 1702 CD GLU A 120 1.478 15.286 1.706 1.00 1.58 C ATOM 1703 OE1 GLU A 120 1.334 15.821 0.584 1.00 2.44 O ATOM 1704 OE2 GLU A 120 0.783 15.599 2.691 1.00 1.93 O ATOM 0 H GLU A 120 1.749 10.817 0.218 1.00 0.40 H new ATOM 0 HA GLU A 120 2.179 11.713 2.880 1.00 0.42 H new ATOM 0 HB2 GLU A 120 3.112 12.548 0.699 1.00 0.50 H new ATOM 0 HB3 GLU A 120 1.523 13.184 0.324 1.00 0.50 H new ATOM 0 HG2 GLU A 120 2.659 13.992 2.931 1.00 0.76 H new ATOM 0 HG3 GLU A 120 3.490 14.590 1.508 1.00 0.76 H new ATOM 1711 N TYR A 121 -0.764 11.966 1.523 1.00 0.29 N ATOM 1712 CA TYR A 121 -2.158 12.079 1.899 1.00 0.28 C ATOM 1713 C TYR A 121 -2.556 10.919 2.805 1.00 0.27 C ATOM 1714 O TYR A 121 -3.441 11.056 3.639 1.00 0.29 O ATOM 1715 CB TYR A 121 -3.061 12.109 0.672 1.00 0.28 C ATOM 1716 CG TYR A 121 -4.503 11.803 0.979 1.00 0.30 C ATOM 1717 CD1 TYR A 121 -5.330 12.779 1.506 1.00 0.39 C ATOM 1718 CD2 TYR A 121 -5.040 10.552 0.722 1.00 0.33 C ATOM 1719 CE1 TYR A 121 -6.650 12.521 1.774 1.00 0.46 C ATOM 1720 CE2 TYR A 121 -6.366 10.284 0.984 1.00 0.41 C ATOM 1721 CZ TYR A 121 -7.142 11.208 1.573 1.00 0.46 C ATOM 1722 OH TYR A 121 -8.492 11.007 1.769 1.00 0.56 O ATOM 0 H TYR A 121 -0.593 11.693 0.555 1.00 0.29 H new ATOM 0 HA TYR A 121 -2.283 13.018 2.438 1.00 0.28 H new ATOM 0 HB2 TYR A 121 -2.998 13.093 0.208 1.00 0.28 H new ATOM 0 HB3 TYR A 121 -2.692 11.388 -0.058 1.00 0.28 H new ATOM 0 HD1 TYR A 121 -4.929 13.761 1.710 1.00 0.39 H new ATOM 0 HD2 TYR A 121 -4.411 9.776 0.311 1.00 0.33 H new ATOM 0 HE1 TYR A 121 -7.302 13.304 2.132 1.00 0.46 H new ATOM 0 HE2 TYR A 121 -6.784 9.325 0.714 1.00 0.41 H new ATOM 0 HH TYR A 121 -8.711 10.067 1.600 1.00 0.56 H new ATOM 1732 N MET A 122 -1.866 9.796 2.669 1.00 0.27 N ATOM 1733 CA MET A 122 -2.279 8.565 3.336 1.00 0.29 C ATOM 1734 C MET A 122 -2.023 8.663 4.822 1.00 0.33 C ATOM 1735 O MET A 122 -2.920 8.489 5.644 1.00 0.35 O ATOM 1736 CB MET A 122 -1.517 7.362 2.795 1.00 0.33 C ATOM 1737 CG MET A 122 -2.041 6.842 1.486 1.00 0.71 C ATOM 1738 SD MET A 122 -3.684 6.158 1.627 1.00 0.56 S ATOM 1739 CE MET A 122 -3.813 5.461 -0.004 1.00 0.55 C ATOM 0 H MET A 122 -1.020 9.709 2.105 1.00 0.27 H new ATOM 0 HA MET A 122 -3.344 8.433 3.144 1.00 0.29 H new ATOM 0 HB2 MET A 122 -0.469 7.635 2.672 1.00 0.33 H new ATOM 0 HB3 MET A 122 -1.553 6.561 3.533 1.00 0.33 H new ATOM 0 HG2 MET A 122 -2.050 7.651 0.755 1.00 0.71 H new ATOM 0 HG3 MET A 122 -1.364 6.077 1.106 1.00 0.71 H new ATOM 0 HE1 MET A 122 -4.848 5.515 -0.342 1.00 0.55 H new ATOM 0 HE2 MET A 122 -3.178 6.021 -0.690 1.00 0.55 H new ATOM 0 HE3 MET A 122 -3.492 4.419 0.019 1.00 0.55 H new ATOM 1749 N LYS A 123 -0.778 8.942 5.161 1.00 0.37 N ATOM 1750 CA LYS A 123 -0.391 9.095 6.544 1.00 0.45 C ATOM 1751 C LYS A 123 -0.920 10.398 7.103 1.00 0.47 C ATOM 1752 O LYS A 123 -1.115 10.528 8.310 1.00 0.54 O ATOM 1753 CB LYS A 123 1.115 8.934 6.737 1.00 0.53 C ATOM 1754 CG LYS A 123 1.961 9.434 5.588 1.00 0.48 C ATOM 1755 CD LYS A 123 2.240 10.935 5.676 1.00 1.00 C ATOM 1756 CE LYS A 123 3.021 11.303 6.930 1.00 1.05 C ATOM 1757 NZ LYS A 123 3.333 12.758 6.987 1.00 1.46 N ATOM 0 H LYS A 123 -0.018 9.067 4.492 1.00 0.37 H new ATOM 0 HA LYS A 123 -0.849 8.289 7.117 1.00 0.45 H new ATOM 0 HB2 LYS A 123 1.409 9.464 7.643 1.00 0.53 H new ATOM 0 HB3 LYS A 123 1.335 7.879 6.899 1.00 0.53 H new ATOM 0 HG2 LYS A 123 2.907 8.892 5.575 1.00 0.48 H new ATOM 0 HG3 LYS A 123 1.456 9.216 4.647 1.00 0.48 H new ATOM 0 HD2 LYS A 123 2.800 11.251 4.796 1.00 1.00 H new ATOM 0 HD3 LYS A 123 1.296 11.479 5.665 1.00 1.00 H new ATOM 0 HE2 LYS A 123 2.445 11.021 7.811 1.00 1.05 H new ATOM 0 HE3 LYS A 123 3.949 10.732 6.960 1.00 1.05 H new ATOM 0 HZ1 LYS A 123 3.865 12.965 7.856 1.00 1.46 H new ATOM 0 HZ2 LYS A 123 3.905 13.023 6.160 1.00 1.46 H new ATOM 0 HZ3 LYS A 123 2.447 13.303 6.985 1.00 1.46 H new ATOM 1771 N LYS A 124 -1.144 11.367 6.221 1.00 0.43 N ATOM 1772 CA LYS A 124 -1.861 12.564 6.600 1.00 0.50 C ATOM 1773 C LYS A 124 -3.261 12.182 7.054 1.00 0.49 C ATOM 1774 O LYS A 124 -3.799 12.744 8.009 1.00 0.57 O ATOM 1775 CB LYS A 124 -1.926 13.551 5.436 1.00 0.56 C ATOM 1776 CG LYS A 124 -3.214 14.342 5.380 1.00 0.59 C ATOM 1777 CD LYS A 124 -3.244 15.279 4.193 1.00 0.97 C ATOM 1778 CE LYS A 124 -4.614 15.906 4.043 1.00 1.41 C ATOM 1779 NZ LYS A 124 -4.669 16.880 2.926 1.00 1.99 N ATOM 0 H LYS A 124 -0.839 11.341 5.248 1.00 0.43 H new ATOM 0 HA LYS A 124 -1.333 13.053 7.419 1.00 0.50 H new ATOM 0 HB2 LYS A 124 -1.088 14.244 5.511 1.00 0.56 H new ATOM 0 HB3 LYS A 124 -1.805 13.004 4.501 1.00 0.56 H new ATOM 0 HG2 LYS A 124 -4.060 13.657 5.324 1.00 0.59 H new ATOM 0 HG3 LYS A 124 -3.329 14.916 6.300 1.00 0.59 H new ATOM 0 HD2 LYS A 124 -2.493 16.059 4.320 1.00 0.97 H new ATOM 0 HD3 LYS A 124 -2.987 14.733 3.285 1.00 0.97 H new ATOM 0 HE2 LYS A 124 -5.353 15.123 3.875 1.00 1.41 H new ATOM 0 HE3 LYS A 124 -4.885 16.407 4.972 1.00 1.41 H new ATOM 0 HZ1 LYS A 124 -5.626 17.282 2.863 1.00 1.99 H new ATOM 0 HZ2 LYS A 124 -3.983 17.643 3.097 1.00 1.99 H new ATOM 0 HZ3 LYS A 124 -4.436 16.399 2.034 1.00 1.99 H new ATOM 1793 N THR A 125 -3.836 11.208 6.360 1.00 0.42 N ATOM 1794 CA THR A 125 -5.151 10.700 6.711 1.00 0.44 C ATOM 1795 C THR A 125 -5.117 10.016 8.073 1.00 0.44 C ATOM 1796 O THR A 125 -5.855 10.395 8.983 1.00 0.56 O ATOM 1797 CB THR A 125 -5.702 9.720 5.661 1.00 0.49 C ATOM 1798 OG1 THR A 125 -5.821 10.379 4.395 1.00 0.57 O ATOM 1799 CG2 THR A 125 -7.065 9.190 6.085 1.00 0.59 C ATOM 0 H THR A 125 -3.410 10.756 5.551 1.00 0.42 H new ATOM 0 HA THR A 125 -5.818 11.562 6.747 1.00 0.44 H new ATOM 0 HB THR A 125 -5.009 8.883 5.575 1.00 0.49 H new ATOM 0 HG1 THR A 125 -4.988 10.855 4.195 1.00 0.57 H new ATOM 0 HG21 THR A 125 -7.438 8.499 5.329 1.00 0.59 H new ATOM 0 HG22 THR A 125 -6.973 8.670 7.039 1.00 0.59 H new ATOM 0 HG23 THR A 125 -7.762 10.021 6.191 1.00 0.59 H new ATOM 1807 N LYS A 126 -4.238 9.029 8.232 1.00 0.44 N ATOM 1808 CA LYS A 126 -4.226 8.255 9.460 1.00 0.54 C ATOM 1809 C LYS A 126 -2.874 7.608 9.756 1.00 0.57 C ATOM 1810 O LYS A 126 -2.335 6.845 8.949 1.00 0.68 O ATOM 1811 CB LYS A 126 -5.315 7.189 9.391 1.00 0.78 C ATOM 1812 CG LYS A 126 -5.559 6.474 10.704 1.00 1.26 C ATOM 1813 CD LYS A 126 -6.712 5.501 10.579 1.00 0.92 C ATOM 1814 CE LYS A 126 -8.045 6.215 10.402 1.00 1.27 C ATOM 1815 NZ LYS A 126 -8.454 6.958 11.622 1.00 1.85 N ATOM 0 H LYS A 126 -3.541 8.754 7.540 1.00 0.44 H new ATOM 0 HA LYS A 126 -4.417 8.947 10.280 1.00 0.54 H new ATOM 0 HB2 LYS A 126 -6.245 7.654 9.064 1.00 0.78 H new ATOM 0 HB3 LYS A 126 -5.043 6.454 8.634 1.00 0.78 H new ATOM 0 HG2 LYS A 126 -4.658 5.940 11.006 1.00 1.26 H new ATOM 0 HG3 LYS A 126 -5.775 7.202 11.486 1.00 1.26 H new ATOM 0 HD2 LYS A 126 -6.539 4.841 9.729 1.00 0.92 H new ATOM 0 HD3 LYS A 126 -6.753 4.872 11.468 1.00 0.92 H new ATOM 0 HE2 LYS A 126 -7.975 6.908 9.564 1.00 1.27 H new ATOM 0 HE3 LYS A 126 -8.814 5.486 10.149 1.00 1.27 H new ATOM 0 HZ1 LYS A 126 -9.441 7.270 11.524 1.00 1.85 H new ATOM 0 HZ2 LYS A 126 -8.368 6.337 12.452 1.00 1.85 H new ATOM 0 HZ3 LYS A 126 -7.839 7.788 11.745 1.00 1.85 H new ATOM 1829 N PRO A 127 -2.313 7.935 10.933 1.00 0.77 N ATOM 1830 CA PRO A 127 -1.185 7.237 11.536 1.00 1.04 C ATOM 1831 C PRO A 127 -1.700 6.080 12.385 1.00 1.27 C ATOM 1832 O PRO A 127 -1.521 6.047 13.602 1.00 1.69 O ATOM 1833 CB PRO A 127 -0.519 8.318 12.412 1.00 1.28 C ATOM 1834 CG PRO A 127 -1.411 9.527 12.321 1.00 1.22 C ATOM 1835 CD PRO A 127 -2.730 9.039 11.789 1.00 0.95 C ATOM 0 HA PRO A 127 -0.492 6.808 10.812 1.00 1.04 H new ATOM 0 HB2 PRO A 127 -0.422 7.980 13.444 1.00 1.28 H new ATOM 0 HB3 PRO A 127 0.486 8.546 12.056 1.00 1.28 H new ATOM 0 HG2 PRO A 127 -1.535 9.994 13.298 1.00 1.22 H new ATOM 0 HG3 PRO A 127 -0.980 10.280 11.661 1.00 1.22 H new ATOM 0 HD2 PRO A 127 -3.396 8.710 12.586 1.00 0.95 H new ATOM 0 HD3 PRO A 127 -3.258 9.813 11.231 1.00 0.95 H new ATOM 1843 N GLY A 128 -2.379 5.151 11.718 1.00 1.55 N ATOM 1844 CA GLY A 128 -3.058 4.067 12.398 1.00 1.96 C ATOM 1845 C GLY A 128 -2.122 3.159 13.154 1.00 2.13 C ATOM 1846 O GLY A 128 -1.034 2.845 12.668 1.00 2.59 O ATOM 0 H GLY A 128 -2.470 5.133 10.702 1.00 1.55 H new ATOM 0 HA2 GLY A 128 -3.789 4.483 13.092 1.00 1.96 H new ATOM 0 HA3 GLY A 128 -3.612 3.479 11.667 1.00 1.96 H new ATOM 1850 N ILE A 129 -2.554 2.753 14.351 1.00 2.17 N ATOM 1851 CA ILE A 129 -1.800 1.843 15.219 1.00 2.46 C ATOM 1852 C ILE A 129 -0.583 2.536 15.838 1.00 2.36 C ATOM 1853 O ILE A 129 -0.298 2.368 17.023 1.00 2.70 O ATOM 1854 CB ILE A 129 -1.358 0.559 14.469 1.00 2.91 C ATOM 1855 CG1 ILE A 129 -2.587 -0.195 13.948 1.00 3.06 C ATOM 1856 CG2 ILE A 129 -0.524 -0.339 15.377 1.00 3.44 C ATOM 1857 CD1 ILE A 129 -2.253 -1.437 13.147 1.00 3.58 C ATOM 0 H ILE A 129 -3.445 3.049 14.749 1.00 2.17 H new ATOM 0 HA ILE A 129 -2.476 1.549 16.022 1.00 2.46 H new ATOM 0 HB ILE A 129 -0.738 0.849 13.621 1.00 2.91 H new ATOM 0 HG12 ILE A 129 -3.213 -0.478 14.794 1.00 3.06 H new ATOM 0 HG13 ILE A 129 -3.177 0.478 13.326 1.00 3.06 H new ATOM 0 HG21 ILE A 129 -0.225 -1.233 14.830 1.00 3.44 H new ATOM 0 HG22 ILE A 129 0.365 0.200 15.704 1.00 3.44 H new ATOM 0 HG23 ILE A 129 -1.115 -0.626 16.247 1.00 3.44 H new ATOM 0 HD11 ILE A 129 -3.175 -1.914 12.814 1.00 3.58 H new ATOM 0 HD12 ILE A 129 -1.654 -1.160 12.280 1.00 3.58 H new ATOM 0 HD13 ILE A 129 -1.690 -2.132 13.770 1.00 3.58 H new ATOM 1869 N LEU A 130 0.118 3.325 15.041 1.00 2.12 N ATOM 1870 CA LEU A 130 1.308 4.017 15.506 1.00 2.29 C ATOM 1871 C LEU A 130 1.258 5.494 15.137 1.00 2.20 C ATOM 1872 O LEU A 130 1.337 5.856 13.961 1.00 2.44 O ATOM 1873 CB LEU A 130 2.577 3.378 14.927 1.00 2.58 C ATOM 1874 CG LEU A 130 2.612 3.239 13.399 1.00 2.89 C ATOM 1875 CD1 LEU A 130 4.032 3.389 12.888 1.00 3.36 C ATOM 1876 CD2 LEU A 130 2.045 1.894 12.968 1.00 3.47 C ATOM 0 H LEU A 130 -0.118 3.503 14.065 1.00 2.12 H new ATOM 0 HA LEU A 130 1.337 3.928 16.592 1.00 2.29 H new ATOM 0 HB2 LEU A 130 3.436 3.972 15.240 1.00 2.58 H new ATOM 0 HB3 LEU A 130 2.697 2.388 15.367 1.00 2.58 H new ATOM 0 HG LEU A 130 1.996 4.030 12.971 1.00 2.89 H new ATOM 0 HD11 LEU A 130 4.041 3.288 11.803 1.00 3.36 H new ATOM 0 HD12 LEU A 130 4.416 4.371 13.164 1.00 3.36 H new ATOM 0 HD13 LEU A 130 4.661 2.616 13.329 1.00 3.36 H new ATOM 0 HD21 LEU A 130 2.079 1.816 11.881 1.00 3.47 H new ATOM 0 HD22 LEU A 130 2.637 1.092 13.408 1.00 3.47 H new ATOM 0 HD23 LEU A 130 1.012 1.810 13.306 1.00 3.47 H new ATOM 1888 N ALA A 131 1.147 6.351 16.147 1.00 2.45 N ATOM 1889 CA ALA A 131 1.133 7.797 15.933 1.00 2.67 C ATOM 1890 C ALA A 131 2.550 8.327 15.720 1.00 2.55 C ATOM 1891 O ALA A 131 2.908 9.406 16.191 1.00 3.21 O ATOM 1892 CB ALA A 131 0.468 8.498 17.107 1.00 3.28 C ATOM 0 H ALA A 131 1.065 6.070 17.124 1.00 2.45 H new ATOM 0 HA ALA A 131 0.555 8.006 15.033 1.00 2.67 H new ATOM 0 HB1 ALA A 131 0.465 9.574 16.934 1.00 3.28 H new ATOM 0 HB2 ALA A 131 -0.558 8.144 17.209 1.00 3.28 H new ATOM 0 HB3 ALA A 131 1.020 8.279 18.021 1.00 3.28 H new ATOM 1898 N THR A 132 3.346 7.551 15.006 1.00 2.02 N ATOM 1899 CA THR A 132 4.721 7.900 14.716 1.00 2.10 C ATOM 1900 C THR A 132 4.790 8.948 13.608 1.00 1.56 C ATOM 1901 O THR A 132 5.009 10.132 13.864 1.00 2.12 O ATOM 1902 CB THR A 132 5.494 6.644 14.274 1.00 2.73 C ATOM 1903 OG1 THR A 132 5.314 5.603 15.242 1.00 3.34 O ATOM 1904 CG2 THR A 132 6.978 6.935 14.101 1.00 3.56 C ATOM 0 H THR A 132 3.053 6.658 14.610 1.00 2.02 H new ATOM 0 HA THR A 132 5.169 8.312 15.620 1.00 2.10 H new ATOM 0 HB THR A 132 5.099 6.325 13.309 1.00 2.73 H new ATOM 0 HG1 THR A 132 5.805 4.804 14.958 1.00 3.34 H new ATOM 0 HG21 THR A 132 7.493 6.026 13.789 1.00 3.56 H new ATOM 0 HG22 THR A 132 7.111 7.707 13.343 1.00 3.56 H new ATOM 0 HG23 THR A 132 7.394 7.281 15.047 1.00 3.56 H new ATOM 1912 N LYS A 133 4.588 8.489 12.380 1.00 1.29 N ATOM 1913 CA LYS A 133 4.613 9.345 11.203 1.00 1.47 C ATOM 1914 C LYS A 133 3.743 8.728 10.123 1.00 1.14 C ATOM 1915 O LYS A 133 2.608 9.136 9.887 1.00 1.58 O ATOM 1916 CB LYS A 133 6.028 9.472 10.621 1.00 2.24 C ATOM 1917 CG LYS A 133 7.067 10.114 11.523 1.00 3.04 C ATOM 1918 CD LYS A 133 8.405 10.217 10.804 1.00 3.81 C ATOM 1919 CE LYS A 133 9.464 10.900 11.655 1.00 4.63 C ATOM 1920 NZ LYS A 133 10.759 11.017 10.933 1.00 5.17 N ATOM 0 H LYS A 133 4.401 7.508 12.172 1.00 1.29 H new ATOM 0 HA LYS A 133 4.256 10.329 11.507 1.00 1.47 H new ATOM 0 HB2 LYS A 133 6.378 8.476 10.350 1.00 2.24 H new ATOM 0 HB3 LYS A 133 5.969 10.051 9.699 1.00 2.24 H new ATOM 0 HG2 LYS A 133 6.732 11.106 11.825 1.00 3.04 H new ATOM 0 HG3 LYS A 133 7.181 9.525 12.433 1.00 3.04 H new ATOM 0 HD2 LYS A 133 8.748 9.218 10.533 1.00 3.81 H new ATOM 0 HD3 LYS A 133 8.274 10.772 9.875 1.00 3.81 H new ATOM 0 HE2 LYS A 133 9.116 11.893 11.941 1.00 4.63 H new ATOM 0 HE3 LYS A 133 9.611 10.336 12.576 1.00 4.63 H new ATOM 0 HZ1 LYS A 133 11.456 11.488 11.545 1.00 5.17 H new ATOM 0 HZ2 LYS A 133 11.103 10.068 10.682 1.00 5.17 H new ATOM 0 HZ3 LYS A 133 10.624 11.577 10.067 1.00 5.17 H new ATOM 1934 N ALA A 134 4.295 7.698 9.502 1.00 0.92 N ATOM 1935 CA ALA A 134 3.683 7.063 8.357 1.00 0.77 C ATOM 1936 C ALA A 134 3.754 5.554 8.496 1.00 0.81 C ATOM 1937 O ALA A 134 3.998 5.041 9.587 1.00 1.59 O ATOM 1938 CB ALA A 134 4.391 7.516 7.087 1.00 1.02 C ATOM 0 H ALA A 134 5.183 7.281 9.782 1.00 0.92 H new ATOM 0 HA ALA A 134 2.634 7.352 8.301 1.00 0.77 H new ATOM 0 HB1 ALA A 134 3.930 7.037 6.223 1.00 1.02 H new ATOM 0 HB2 ALA A 134 4.307 8.598 6.990 1.00 1.02 H new ATOM 0 HB3 ALA A 134 5.443 7.237 7.138 1.00 1.02 H new ATOM 1944 N ILE A 135 3.529 4.873 7.378 1.00 0.69 N ATOM 1945 CA ILE A 135 3.604 3.417 7.286 1.00 0.74 C ATOM 1946 C ILE A 135 4.814 2.850 8.063 1.00 1.09 C ATOM 1947 O ILE A 135 4.642 2.065 8.992 1.00 2.00 O ATOM 1948 CB ILE A 135 3.684 2.967 5.815 1.00 0.86 C ATOM 1949 CG1 ILE A 135 4.504 3.945 4.946 1.00 0.88 C ATOM 1950 CG2 ILE A 135 2.286 2.790 5.252 1.00 1.54 C ATOM 1951 CD1 ILE A 135 3.735 5.155 4.440 1.00 0.89 C ATOM 0 H ILE A 135 3.285 5.323 6.496 1.00 0.69 H new ATOM 0 HA ILE A 135 2.693 3.024 7.739 1.00 0.74 H new ATOM 0 HB ILE A 135 4.207 2.011 5.790 1.00 0.86 H new ATOM 0 HG12 ILE A 135 5.359 4.293 5.526 1.00 0.88 H new ATOM 0 HG13 ILE A 135 4.900 3.401 4.089 1.00 0.88 H new ATOM 0 HG21 ILE A 135 2.350 2.472 4.211 1.00 1.54 H new ATOM 0 HG22 ILE A 135 1.754 2.035 5.830 1.00 1.54 H new ATOM 0 HG23 ILE A 135 1.748 3.736 5.309 1.00 1.54 H new ATOM 0 HD11 ILE A 135 4.396 5.781 3.840 1.00 0.89 H new ATOM 0 HD12 ILE A 135 2.896 4.823 3.829 1.00 0.89 H new ATOM 0 HD13 ILE A 135 3.361 5.729 5.288 1.00 0.89 H new ATOM 1963 N LYS A 136 6.029 3.255 7.646 1.00 0.85 N ATOM 1964 CA LYS A 136 7.283 3.037 8.406 1.00 1.14 C ATOM 1965 C LYS A 136 7.823 1.599 8.289 1.00 0.75 C ATOM 1966 O LYS A 136 9.027 1.377 8.417 1.00 0.78 O ATOM 1967 CB LYS A 136 7.092 3.410 9.884 1.00 1.71 C ATOM 1968 CG LYS A 136 8.280 4.113 10.538 1.00 2.72 C ATOM 1969 CD LYS A 136 9.472 3.183 10.715 1.00 3.21 C ATOM 1970 CE LYS A 136 10.582 3.827 11.532 1.00 4.09 C ATOM 1971 NZ LYS A 136 10.214 3.976 12.968 1.00 4.81 N ATOM 0 H LYS A 136 6.173 3.748 6.764 1.00 0.85 H new ATOM 0 HA LYS A 136 8.029 3.692 7.956 1.00 1.14 H new ATOM 0 HB2 LYS A 136 6.217 4.055 9.969 1.00 1.71 H new ATOM 0 HB3 LYS A 136 6.874 2.502 10.446 1.00 1.71 H new ATOM 0 HG2 LYS A 136 8.575 4.967 9.929 1.00 2.72 H new ATOM 0 HG3 LYS A 136 7.979 4.504 11.510 1.00 2.72 H new ATOM 0 HD2 LYS A 136 9.146 2.266 11.206 1.00 3.21 H new ATOM 0 HD3 LYS A 136 9.860 2.900 9.736 1.00 3.21 H new ATOM 0 HE2 LYS A 136 11.486 3.223 11.452 1.00 4.09 H new ATOM 0 HE3 LYS A 136 10.815 4.807 11.115 1.00 4.09 H new ATOM 0 HZ1 LYS A 136 11.056 4.243 13.516 1.00 4.81 H new ATOM 0 HZ2 LYS A 136 9.489 4.715 13.066 1.00 4.81 H new ATOM 0 HZ3 LYS A 136 9.839 3.074 13.326 1.00 4.81 H new ATOM 1985 N TRP A 137 6.949 0.635 8.067 1.00 0.69 N ATOM 1986 CA TRP A 137 7.358 -0.764 7.927 1.00 0.45 C ATOM 1987 C TRP A 137 7.321 -1.183 6.480 1.00 0.43 C ATOM 1988 O TRP A 137 7.024 -0.376 5.604 1.00 0.55 O ATOM 1989 CB TRP A 137 6.471 -1.729 8.732 1.00 0.42 C ATOM 1990 CG TRP A 137 6.840 -1.850 10.164 1.00 0.62 C ATOM 1991 CD1 TRP A 137 7.272 -2.952 10.842 1.00 0.93 C ATOM 1992 CD2 TRP A 137 6.808 -0.796 11.090 1.00 1.00 C ATOM 1993 NE1 TRP A 137 7.531 -2.608 12.148 1.00 1.11 N ATOM 1994 CE2 TRP A 137 7.252 -1.285 12.316 1.00 1.16 C ATOM 1995 CE3 TRP A 137 6.448 0.521 10.976 1.00 1.47 C ATOM 1996 CZ2 TRP A 137 7.351 -0.479 13.438 1.00 1.59 C ATOM 1997 CZ3 TRP A 137 6.546 1.329 12.073 1.00 1.97 C ATOM 1998 CH2 TRP A 137 6.999 0.834 13.299 1.00 1.97 C ATOM 0 H TRP A 137 5.945 0.789 7.978 1.00 0.69 H new ATOM 0 HA TRP A 137 8.373 -0.822 8.320 1.00 0.45 H new ATOM 0 HB2 TRP A 137 5.436 -1.395 8.663 1.00 0.42 H new ATOM 0 HB3 TRP A 137 6.519 -2.716 8.272 1.00 0.42 H new ATOM 0 HD1 TRP A 137 7.392 -3.939 10.420 1.00 0.93 H new ATOM 0 HE1 TRP A 137 7.875 -3.239 12.872 1.00 1.11 H new ATOM 0 HE3 TRP A 137 6.093 0.914 10.035 1.00 1.47 H new ATOM 0 HZ2 TRP A 137 7.692 -0.872 14.384 1.00 1.59 H new ATOM 0 HZ3 TRP A 137 6.268 2.370 11.991 1.00 1.97 H new ATOM 0 HH2 TRP A 137 7.072 1.498 14.148 1.00 1.97 H new ATOM 2009 N ASN A 138 7.741 -2.422 6.258 1.00 0.37 N ATOM 2010 CA ASN A 138 7.431 -3.208 5.053 1.00 0.38 C ATOM 2011 C ASN A 138 5.977 -2.988 4.594 1.00 0.31 C ATOM 2012 O ASN A 138 5.402 -1.954 4.812 1.00 0.30 O ATOM 2013 CB ASN A 138 7.669 -4.700 5.320 1.00 0.41 C ATOM 2014 CG ASN A 138 9.004 -4.975 5.979 1.00 1.06 C ATOM 2015 OD1 ASN A 138 9.140 -4.849 7.192 1.00 2.04 O ATOM 2016 ND2 ASN A 138 9.993 -5.368 5.191 1.00 1.40 N ATOM 0 H ASN A 138 8.323 -2.929 6.925 1.00 0.37 H new ATOM 0 HA ASN A 138 8.094 -2.869 4.257 1.00 0.38 H new ATOM 0 HB2 ASN A 138 6.870 -5.082 5.956 1.00 0.41 H new ATOM 0 HB3 ASN A 138 7.615 -5.246 4.378 1.00 0.41 H new ATOM 0 HD21 ASN A 138 10.909 -5.578 5.588 1.00 1.40 H new ATOM 0 HD22 ASN A 138 9.839 -5.460 4.187 1.00 1.40 H new ATOM 2023 N PHE A 139 5.429 -3.967 3.904 1.00 0.34 N ATOM 2024 CA PHE A 139 4.125 -3.885 3.220 1.00 0.36 C ATOM 2025 C PHE A 139 3.027 -2.965 3.854 1.00 0.32 C ATOM 2026 O PHE A 139 2.137 -2.583 3.117 1.00 0.57 O ATOM 2027 CB PHE A 139 3.579 -5.296 3.128 1.00 0.55 C ATOM 2028 CG PHE A 139 3.754 -5.968 1.799 1.00 0.55 C ATOM 2029 CD1 PHE A 139 5.011 -6.267 1.277 1.00 0.61 C ATOM 2030 CD2 PHE A 139 2.635 -6.344 1.087 1.00 1.23 C ATOM 2031 CE1 PHE A 139 5.122 -6.927 0.068 1.00 1.22 C ATOM 2032 CE2 PHE A 139 2.744 -7.007 -0.111 1.00 1.93 C ATOM 2033 CZ PHE A 139 3.987 -7.302 -0.622 1.00 1.89 C ATOM 0 H PHE A 139 5.880 -4.875 3.792 1.00 0.34 H new ATOM 0 HA PHE A 139 4.335 -3.411 2.261 1.00 0.36 H new ATOM 0 HB2 PHE A 139 4.064 -5.905 3.891 1.00 0.55 H new ATOM 0 HB3 PHE A 139 2.516 -5.272 3.367 1.00 0.55 H new ATOM 0 HD1 PHE A 139 5.901 -5.982 1.819 1.00 0.61 H new ATOM 0 HD2 PHE A 139 1.655 -6.113 1.478 1.00 1.23 H new ATOM 0 HE1 PHE A 139 6.098 -7.150 -0.337 1.00 1.22 H new ATOM 0 HE2 PHE A 139 1.855 -7.296 -0.651 1.00 1.93 H new ATOM 0 HZ PHE A 139 4.074 -7.826 -1.562 1.00 1.89 H new ATOM 2043 N THR A 140 3.046 -2.684 5.185 1.00 0.25 N ATOM 2044 CA THR A 140 2.184 -1.664 5.841 1.00 0.25 C ATOM 2045 C THR A 140 1.133 -1.041 4.912 1.00 0.22 C ATOM 2046 O THR A 140 1.423 -0.144 4.114 1.00 0.29 O ATOM 2047 CB THR A 140 3.026 -0.535 6.449 1.00 0.37 C ATOM 2048 OG1 THR A 140 4.247 -1.073 6.948 1.00 0.48 O ATOM 2049 CG2 THR A 140 2.282 0.149 7.585 1.00 0.60 C ATOM 0 H THR A 140 3.666 -3.164 5.838 1.00 0.25 H new ATOM 0 HA THR A 140 1.653 -2.211 6.620 1.00 0.25 H new ATOM 0 HB THR A 140 3.227 0.202 5.671 1.00 0.37 H new ATOM 0 HG1 THR A 140 4.811 -1.355 6.198 1.00 0.48 H new ATOM 0 HG21 THR A 140 2.901 0.945 7.998 1.00 0.60 H new ATOM 0 HG22 THR A 140 1.351 0.572 7.208 1.00 0.60 H new ATOM 0 HG23 THR A 140 2.060 -0.579 8.365 1.00 0.60 H new ATOM 2057 N SER A 141 -0.087 -1.515 5.048 1.00 0.19 N ATOM 2058 CA SER A 141 -1.159 -1.190 4.111 1.00 0.20 C ATOM 2059 C SER A 141 -1.910 0.061 4.513 1.00 0.22 C ATOM 2060 O SER A 141 -1.645 0.631 5.553 1.00 0.39 O ATOM 2061 CB SER A 141 -2.149 -2.323 4.089 1.00 0.26 C ATOM 2062 OG SER A 141 -1.490 -3.566 4.031 1.00 0.62 O ATOM 0 H SER A 141 -0.371 -2.135 5.806 1.00 0.19 H new ATOM 0 HA SER A 141 -0.700 -1.027 3.136 1.00 0.20 H new ATOM 0 HB2 SER A 141 -2.776 -2.281 4.980 1.00 0.26 H new ATOM 0 HB3 SER A 141 -2.810 -2.217 3.229 1.00 0.26 H new ATOM 0 HG SER A 141 -1.351 -3.819 3.095 1.00 0.62 H new ATOM 2068 N PHE A 142 -2.849 0.474 3.671 1.00 0.19 N ATOM 2069 CA PHE A 142 -3.895 1.392 4.062 1.00 0.18 C ATOM 2070 C PHE A 142 -5.169 0.833 3.525 1.00 0.18 C ATOM 2071 O PHE A 142 -5.275 0.559 2.343 1.00 0.21 O ATOM 2072 CB PHE A 142 -3.690 2.799 3.493 1.00 0.22 C ATOM 2073 CG PHE A 142 -2.577 3.590 4.117 1.00 0.26 C ATOM 2074 CD1 PHE A 142 -2.819 4.379 5.229 1.00 0.35 C ATOM 2075 CD2 PHE A 142 -1.302 3.569 3.579 1.00 0.42 C ATOM 2076 CE1 PHE A 142 -1.809 5.131 5.794 1.00 0.50 C ATOM 2077 CE2 PHE A 142 -0.289 4.317 4.142 1.00 0.55 C ATOM 2078 CZ PHE A 142 -0.542 5.098 5.250 1.00 0.57 C ATOM 0 H PHE A 142 -2.901 0.177 2.697 1.00 0.19 H new ATOM 0 HA PHE A 142 -3.898 1.491 5.148 1.00 0.18 H new ATOM 0 HB2 PHE A 142 -3.498 2.716 2.423 1.00 0.22 H new ATOM 0 HB3 PHE A 142 -4.619 3.358 3.608 1.00 0.22 H new ATOM 0 HD1 PHE A 142 -3.809 4.406 5.659 1.00 0.35 H new ATOM 0 HD2 PHE A 142 -1.098 2.961 2.710 1.00 0.42 H new ATOM 0 HE1 PHE A 142 -2.010 5.744 6.660 1.00 0.50 H new ATOM 0 HE2 PHE A 142 0.703 4.291 3.715 1.00 0.55 H new ATOM 0 HZ PHE A 142 0.251 5.683 5.691 1.00 0.57 H new ATOM 2088 N LEU A 143 -6.131 0.626 4.368 1.00 0.17 N ATOM 2089 CA LEU A 143 -7.373 0.139 3.874 1.00 0.16 C ATOM 2090 C LEU A 143 -8.140 1.292 3.311 1.00 0.15 C ATOM 2091 O LEU A 143 -8.679 2.127 4.028 1.00 0.18 O ATOM 2092 CB LEU A 143 -8.152 -0.579 4.948 1.00 0.21 C ATOM 2093 CG LEU A 143 -9.663 -0.608 4.729 1.00 0.23 C ATOM 2094 CD1 LEU A 143 -10.050 -1.606 3.649 1.00 0.41 C ATOM 2095 CD2 LEU A 143 -10.388 -0.908 6.026 1.00 0.43 C ATOM 0 H LEU A 143 -6.082 0.782 5.375 1.00 0.17 H new ATOM 0 HA LEU A 143 -7.193 -0.595 3.088 1.00 0.16 H new ATOM 0 HB2 LEU A 143 -7.789 -1.604 5.017 1.00 0.21 H new ATOM 0 HB3 LEU A 143 -7.947 -0.103 5.907 1.00 0.21 H new ATOM 0 HG LEU A 143 -9.967 0.381 4.387 1.00 0.23 H new ATOM 0 HD11 LEU A 143 -11.132 -1.600 3.519 1.00 0.41 H new ATOM 0 HD12 LEU A 143 -9.571 -1.330 2.710 1.00 0.41 H new ATOM 0 HD13 LEU A 143 -9.725 -2.604 3.943 1.00 0.41 H new ATOM 0 HD21 LEU A 143 -11.463 -0.924 5.847 1.00 0.43 H new ATOM 0 HD22 LEU A 143 -10.069 -1.879 6.405 1.00 0.43 H new ATOM 0 HD23 LEU A 143 -10.154 -0.137 6.760 1.00 0.43 H new ATOM 2107 N ILE A 144 -8.137 1.329 2.016 1.00 0.14 N ATOM 2108 CA ILE A 144 -8.799 2.347 1.275 1.00 0.14 C ATOM 2109 C ILE A 144 -10.202 1.870 0.995 1.00 0.15 C ATOM 2110 O ILE A 144 -10.403 0.691 0.731 1.00 0.19 O ATOM 2111 CB ILE A 144 -8.048 2.596 -0.034 1.00 0.15 C ATOM 2112 CG1 ILE A 144 -6.604 2.986 0.236 1.00 0.17 C ATOM 2113 CG2 ILE A 144 -8.748 3.646 -0.853 1.00 0.17 C ATOM 2114 CD1 ILE A 144 -6.471 4.069 1.256 1.00 0.19 C ATOM 0 H ILE A 144 -7.664 0.637 1.436 1.00 0.14 H new ATOM 0 HA ILE A 144 -8.827 3.282 1.835 1.00 0.14 H new ATOM 0 HB ILE A 144 -8.041 1.669 -0.607 1.00 0.15 H new ATOM 0 HG12 ILE A 144 -6.054 2.108 0.573 1.00 0.17 H new ATOM 0 HG13 ILE A 144 -6.142 3.313 -0.695 1.00 0.17 H new ATOM 0 HG21 ILE A 144 -8.199 3.810 -1.780 1.00 0.17 H new ATOM 0 HG22 ILE A 144 -9.760 3.313 -1.084 1.00 0.17 H new ATOM 0 HG23 ILE A 144 -8.793 4.578 -0.289 1.00 0.17 H new ATOM 0 HD11 ILE A 144 -5.417 4.302 1.404 1.00 0.19 H new ATOM 0 HD12 ILE A 144 -6.995 4.960 0.911 1.00 0.19 H new ATOM 0 HD13 ILE A 144 -6.905 3.736 2.199 1.00 0.19 H new ATOM 2126 N ASP A 145 -11.167 2.758 1.060 1.00 0.14 N ATOM 2127 CA ASP A 145 -12.559 2.314 1.018 1.00 0.15 C ATOM 2128 C ASP A 145 -13.112 2.368 -0.398 1.00 0.14 C ATOM 2129 O ASP A 145 -12.370 2.626 -1.343 1.00 0.15 O ATOM 2130 CB ASP A 145 -13.431 3.117 1.996 1.00 0.19 C ATOM 2131 CG ASP A 145 -14.231 4.231 1.342 1.00 0.58 C ATOM 2132 OD1 ASP A 145 -13.603 5.113 0.716 1.00 0.98 O ATOM 2133 OD2 ASP A 145 -15.466 4.246 1.477 1.00 0.75 O ATOM 0 H ASP A 145 -11.031 3.766 1.140 1.00 0.14 H new ATOM 0 HA ASP A 145 -12.585 1.273 1.339 1.00 0.15 H new ATOM 0 HB2 ASP A 145 -14.119 2.436 2.496 1.00 0.19 H new ATOM 0 HB3 ASP A 145 -12.792 3.547 2.767 1.00 0.19 H new ATOM 2138 N ARG A 146 -14.408 2.111 -0.541 1.00 0.17 N ATOM 2139 CA ARG A 146 -15.046 2.069 -1.849 1.00 0.17 C ATOM 2140 C ARG A 146 -14.806 3.358 -2.624 1.00 0.18 C ATOM 2141 O ARG A 146 -14.617 3.331 -3.837 1.00 0.22 O ATOM 2142 CB ARG A 146 -16.548 1.854 -1.709 1.00 0.19 C ATOM 2143 CG ARG A 146 -16.930 0.667 -0.845 1.00 0.24 C ATOM 2144 CD ARG A 146 -18.431 0.460 -0.847 1.00 0.29 C ATOM 2145 NE ARG A 146 -19.146 1.711 -0.587 1.00 1.00 N ATOM 2146 CZ ARG A 146 -20.397 1.954 -0.975 1.00 1.46 C ATOM 2147 NH1 ARG A 146 -21.089 1.026 -1.627 1.00 1.63 N ATOM 2148 NH2 ARG A 146 -20.952 3.132 -0.717 1.00 2.22 N ATOM 0 H ARG A 146 -15.039 1.928 0.239 1.00 0.17 H new ATOM 0 HA ARG A 146 -14.604 1.236 -2.395 1.00 0.17 H new ATOM 0 HB2 ARG A 146 -16.994 2.754 -1.287 1.00 0.19 H new ATOM 0 HB3 ARG A 146 -16.978 1.720 -2.701 1.00 0.19 H new ATOM 0 HG2 ARG A 146 -16.434 -0.231 -1.213 1.00 0.24 H new ATOM 0 HG3 ARG A 146 -16.582 0.827 0.175 1.00 0.24 H new ATOM 0 HD2 ARG A 146 -18.742 0.055 -1.810 1.00 0.29 H new ATOM 0 HD3 ARG A 146 -18.699 -0.277 -0.090 1.00 0.29 H new ATOM 0 HE ARG A 146 -18.654 2.444 -0.076 1.00 1.00 H new ATOM 0 HH11 ARG A 146 -20.663 0.122 -1.833 1.00 1.63 H new ATOM 0 HH12 ARG A 146 -22.047 1.217 -1.922 1.00 1.63 H new ATOM 0 HH21 ARG A 146 -20.421 3.849 -0.223 1.00 2.22 H new ATOM 0 HH22 ARG A 146 -21.910 3.320 -1.013 1.00 2.22 H new ATOM 2162 N ASP A 147 -14.790 4.483 -1.930 1.00 0.18 N ATOM 2163 CA ASP A 147 -14.642 5.759 -2.599 1.00 0.21 C ATOM 2164 C ASP A 147 -13.234 6.264 -2.401 1.00 0.18 C ATOM 2165 O ASP A 147 -12.954 7.455 -2.524 1.00 0.24 O ATOM 2166 CB ASP A 147 -15.649 6.781 -2.080 1.00 0.28 C ATOM 2167 CG ASP A 147 -17.079 6.397 -2.391 1.00 1.09 C ATOM 2168 OD1 ASP A 147 -17.463 6.432 -3.577 1.00 1.19 O ATOM 2169 OD2 ASP A 147 -17.830 6.082 -1.444 1.00 2.00 O ATOM 0 H ASP A 147 -14.877 4.537 -0.915 1.00 0.18 H new ATOM 0 HA ASP A 147 -14.837 5.618 -3.662 1.00 0.21 H new ATOM 0 HB2 ASP A 147 -15.531 6.887 -1.002 1.00 0.28 H new ATOM 0 HB3 ASP A 147 -15.434 7.754 -2.521 1.00 0.28 H new ATOM 2174 N GLY A 148 -12.352 5.329 -2.087 1.00 0.16 N ATOM 2175 CA GLY A 148 -10.956 5.632 -1.950 1.00 0.16 C ATOM 2176 C GLY A 148 -10.594 6.461 -0.735 1.00 0.15 C ATOM 2177 O GLY A 148 -9.706 7.291 -0.819 1.00 0.17 O ATOM 0 H GLY A 148 -12.591 4.351 -1.923 1.00 0.16 H new ATOM 0 HA2 GLY A 148 -10.399 4.696 -1.911 1.00 0.16 H new ATOM 0 HA3 GLY A 148 -10.626 6.162 -2.843 1.00 0.16 H new ATOM 2181 N VAL A 149 -11.240 6.269 0.399 1.00 0.17 N ATOM 2182 CA VAL A 149 -10.769 6.950 1.596 1.00 0.18 C ATOM 2183 C VAL A 149 -10.015 5.972 2.505 1.00 0.17 C ATOM 2184 O VAL A 149 -10.482 4.865 2.763 1.00 0.24 O ATOM 2185 CB VAL A 149 -11.903 7.688 2.364 1.00 0.28 C ATOM 2186 CG1 VAL A 149 -12.789 6.744 3.154 1.00 0.97 C ATOM 2187 CG2 VAL A 149 -11.322 8.756 3.278 1.00 1.12 C ATOM 0 H VAL A 149 -12.059 5.673 0.520 1.00 0.17 H new ATOM 0 HA VAL A 149 -10.078 7.728 1.271 1.00 0.18 H new ATOM 0 HB VAL A 149 -12.534 8.161 1.611 1.00 0.28 H new ATOM 0 HG11 VAL A 149 -13.562 7.315 3.669 1.00 0.97 H new ATOM 0 HG12 VAL A 149 -13.257 6.031 2.475 1.00 0.97 H new ATOM 0 HG13 VAL A 149 -12.186 6.207 3.886 1.00 0.97 H new ATOM 0 HG21 VAL A 149 -12.130 9.261 3.807 1.00 1.12 H new ATOM 0 HG22 VAL A 149 -10.651 8.291 4.000 1.00 1.12 H new ATOM 0 HG23 VAL A 149 -10.768 9.482 2.683 1.00 1.12 H new ATOM 2197 N PRO A 150 -8.800 6.353 2.950 1.00 0.21 N ATOM 2198 CA PRO A 150 -7.989 5.520 3.837 1.00 0.20 C ATOM 2199 C PRO A 150 -8.616 5.450 5.224 1.00 0.23 C ATOM 2200 O PRO A 150 -8.809 6.474 5.878 1.00 0.34 O ATOM 2201 CB PRO A 150 -6.637 6.235 3.927 1.00 0.26 C ATOM 2202 CG PRO A 150 -6.723 7.453 3.068 1.00 0.29 C ATOM 2203 CD PRO A 150 -8.156 7.632 2.642 1.00 0.41 C ATOM 0 HA PRO A 150 -7.903 4.500 3.464 1.00 0.20 H new ATOM 0 HB2 PRO A 150 -6.414 6.507 4.959 1.00 0.26 H new ATOM 0 HB3 PRO A 150 -5.833 5.582 3.588 1.00 0.26 H new ATOM 0 HG2 PRO A 150 -6.378 8.329 3.617 1.00 0.29 H new ATOM 0 HG3 PRO A 150 -6.078 7.349 2.196 1.00 0.29 H new ATOM 0 HD2 PRO A 150 -8.629 8.453 3.181 1.00 0.41 H new ATOM 0 HD3 PRO A 150 -8.227 7.865 1.580 1.00 0.41 H new ATOM 2211 N VAL A 151 -8.929 4.255 5.671 1.00 0.22 N ATOM 2212 CA VAL A 151 -9.606 4.074 6.940 1.00 0.29 C ATOM 2213 C VAL A 151 -8.689 3.344 7.900 1.00 0.32 C ATOM 2214 O VAL A 151 -8.784 3.494 9.116 1.00 0.61 O ATOM 2215 CB VAL A 151 -10.914 3.268 6.767 1.00 0.42 C ATOM 2216 CG1 VAL A 151 -11.715 3.235 8.058 1.00 1.45 C ATOM 2217 CG2 VAL A 151 -11.753 3.837 5.631 1.00 1.13 C ATOM 0 H VAL A 151 -8.725 3.388 5.173 1.00 0.22 H new ATOM 0 HA VAL A 151 -9.859 5.057 7.336 1.00 0.29 H new ATOM 0 HB VAL A 151 -10.642 2.243 6.514 1.00 0.42 H new ATOM 0 HG11 VAL A 151 -12.629 2.661 7.905 1.00 1.45 H new ATOM 0 HG12 VAL A 151 -11.121 2.768 8.843 1.00 1.45 H new ATOM 0 HG13 VAL A 151 -11.971 4.252 8.354 1.00 1.45 H new ATOM 0 HG21 VAL A 151 -12.668 3.254 5.528 1.00 1.13 H new ATOM 0 HG22 VAL A 151 -12.006 4.874 5.850 1.00 1.13 H new ATOM 0 HG23 VAL A 151 -11.186 3.790 4.701 1.00 1.13 H new ATOM 2227 N GLU A 152 -7.790 2.557 7.336 1.00 0.19 N ATOM 2228 CA GLU A 152 -6.856 1.776 8.141 1.00 0.20 C ATOM 2229 C GLU A 152 -5.462 1.802 7.552 1.00 0.20 C ATOM 2230 O GLU A 152 -5.262 2.227 6.423 1.00 0.19 O ATOM 2231 CB GLU A 152 -7.297 0.319 8.242 1.00 0.21 C ATOM 2232 CG GLU A 152 -8.689 0.141 8.794 1.00 0.57 C ATOM 2233 CD GLU A 152 -8.779 0.426 10.281 1.00 0.63 C ATOM 2234 OE1 GLU A 152 -7.726 0.645 10.917 1.00 1.17 O ATOM 2235 OE2 GLU A 152 -9.906 0.460 10.821 1.00 1.17 O ATOM 0 H GLU A 152 -7.684 2.439 6.328 1.00 0.19 H new ATOM 0 HA GLU A 152 -6.847 2.232 9.131 1.00 0.20 H new ATOM 0 HB2 GLU A 152 -7.248 -0.135 7.252 1.00 0.21 H new ATOM 0 HB3 GLU A 152 -6.593 -0.221 8.876 1.00 0.21 H new ATOM 0 HG2 GLU A 152 -9.372 0.802 8.261 1.00 0.57 H new ATOM 0 HG3 GLU A 152 -9.021 -0.880 8.605 1.00 0.57 H new ATOM 2242 N ARG A 153 -4.517 1.384 8.359 1.00 0.23 N ATOM 2243 CA ARG A 153 -3.182 1.046 7.904 1.00 0.24 C ATOM 2244 C ARG A 153 -2.650 -0.105 8.735 1.00 0.25 C ATOM 2245 O ARG A 153 -2.616 -0.043 9.963 1.00 0.39 O ATOM 2246 CB ARG A 153 -2.263 2.267 7.940 1.00 0.36 C ATOM 2247 CG ARG A 153 -0.762 1.976 7.951 1.00 0.40 C ATOM 2248 CD ARG A 153 -0.068 2.774 9.044 1.00 0.47 C ATOM 2249 NE ARG A 153 -0.132 4.230 8.818 1.00 0.65 N ATOM 2250 CZ ARG A 153 0.564 5.115 9.526 1.00 1.51 C ATOM 2251 NH1 ARG A 153 1.302 4.712 10.554 1.00 2.16 N ATOM 2252 NH2 ARG A 153 0.494 6.408 9.226 1.00 1.85 N ATOM 0 H ARG A 153 -4.651 1.266 9.363 1.00 0.23 H new ATOM 0 HA ARG A 153 -3.219 0.725 6.863 1.00 0.24 H new ATOM 0 HB2 ARG A 153 -2.486 2.890 7.074 1.00 0.36 H new ATOM 0 HB3 ARG A 153 -2.506 2.854 8.826 1.00 0.36 H new ATOM 0 HG2 ARG A 153 -0.594 0.911 8.109 1.00 0.40 H new ATOM 0 HG3 ARG A 153 -0.331 2.226 6.982 1.00 0.40 H new ATOM 0 HD2 ARG A 153 -0.526 2.540 10.005 1.00 0.47 H new ATOM 0 HD3 ARG A 153 0.976 2.466 9.105 1.00 0.47 H new ATOM 0 HE ARG A 153 -0.743 4.577 8.079 1.00 0.65 H new ATOM 0 HH11 ARG A 153 1.335 3.723 10.801 1.00 2.16 H new ATOM 0 HH12 ARG A 153 1.835 5.392 11.096 1.00 2.16 H new ATOM 0 HH21 ARG A 153 -0.093 6.721 8.453 1.00 1.85 H new ATOM 0 HH22 ARG A 153 1.028 7.087 9.769 1.00 1.85 H new ATOM 2266 N PHE A 154 -2.245 -1.152 8.048 1.00 0.24 N ATOM 2267 CA PHE A 154 -1.923 -2.416 8.683 1.00 0.22 C ATOM 2268 C PHE A 154 -0.429 -2.599 8.666 1.00 0.24 C ATOM 2269 O PHE A 154 0.230 -2.112 7.765 1.00 0.32 O ATOM 2270 CB PHE A 154 -2.576 -3.579 7.926 1.00 0.22 C ATOM 2271 CG PHE A 154 -4.082 -3.575 7.930 1.00 0.20 C ATOM 2272 CD1 PHE A 154 -4.792 -2.831 6.998 1.00 0.22 C ATOM 2273 CD2 PHE A 154 -4.787 -4.293 8.883 1.00 0.21 C ATOM 2274 CE1 PHE A 154 -6.175 -2.805 7.016 1.00 0.24 C ATOM 2275 CE2 PHE A 154 -6.168 -4.268 8.907 1.00 0.22 C ATOM 2276 CZ PHE A 154 -6.863 -3.612 7.899 1.00 0.22 C ATOM 0 H PHE A 154 -2.129 -1.153 7.035 1.00 0.24 H new ATOM 0 HA PHE A 154 -2.297 -2.407 9.707 1.00 0.22 H new ATOM 0 HB2 PHE A 154 -2.230 -3.560 6.892 1.00 0.22 H new ATOM 0 HB3 PHE A 154 -2.229 -4.516 8.361 1.00 0.22 H new ATOM 0 HD1 PHE A 154 -4.258 -2.265 6.249 1.00 0.22 H new ATOM 0 HD2 PHE A 154 -4.251 -4.879 9.615 1.00 0.21 H new ATOM 0 HE1 PHE A 154 -6.714 -2.156 6.342 1.00 0.24 H new ATOM 0 HE2 PHE A 154 -6.705 -4.757 9.706 1.00 0.22 H new ATOM 0 HZ PHE A 154 -7.932 -3.732 7.807 1.00 0.22 H new ATOM 2286 N SER A 155 0.106 -3.290 9.646 1.00 0.22 N ATOM 2287 CA SER A 155 1.526 -3.588 9.649 1.00 0.25 C ATOM 2288 C SER A 155 1.792 -4.720 8.665 1.00 0.22 C ATOM 2289 O SER A 155 0.866 -5.446 8.324 1.00 0.26 O ATOM 2290 CB SER A 155 1.977 -3.971 11.060 1.00 0.35 C ATOM 2291 OG SER A 155 1.604 -2.969 11.993 1.00 1.11 O ATOM 0 H SER A 155 -0.412 -3.655 10.446 1.00 0.22 H new ATOM 0 HA SER A 155 2.094 -2.709 9.343 1.00 0.25 H new ATOM 0 HB2 SER A 155 1.531 -4.924 11.344 1.00 0.35 H new ATOM 0 HB3 SER A 155 3.058 -4.107 11.078 1.00 0.35 H new ATOM 0 HG SER A 155 1.899 -3.231 12.890 1.00 1.11 H new ATOM 2297 N PRO A 156 3.024 -4.887 8.167 1.00 0.25 N ATOM 2298 CA PRO A 156 3.344 -5.979 7.245 1.00 0.29 C ATOM 2299 C PRO A 156 2.950 -7.321 7.844 1.00 0.39 C ATOM 2300 O PRO A 156 2.296 -8.136 7.201 1.00 0.78 O ATOM 2301 CB PRO A 156 4.867 -5.889 7.075 1.00 0.34 C ATOM 2302 CG PRO A 156 5.334 -4.985 8.167 1.00 0.36 C ATOM 2303 CD PRO A 156 4.192 -4.054 8.455 1.00 0.33 C ATOM 0 HA PRO A 156 2.810 -5.898 6.298 1.00 0.29 H new ATOM 0 HB2 PRO A 156 5.330 -6.873 7.154 1.00 0.34 H new ATOM 0 HB3 PRO A 156 5.130 -5.490 6.095 1.00 0.34 H new ATOM 0 HG2 PRO A 156 5.605 -5.555 9.055 1.00 0.36 H new ATOM 0 HG3 PRO A 156 6.221 -4.430 7.861 1.00 0.36 H new ATOM 0 HD2 PRO A 156 4.200 -3.710 9.489 1.00 0.33 H new ATOM 0 HD3 PRO A 156 4.223 -3.166 7.823 1.00 0.33 H new ATOM 2311 N GLY A 157 3.367 -7.518 9.086 1.00 0.36 N ATOM 2312 CA GLY A 157 2.986 -8.685 9.861 1.00 0.46 C ATOM 2313 C GLY A 157 1.481 -8.852 10.076 1.00 0.41 C ATOM 2314 O GLY A 157 1.055 -9.823 10.707 1.00 0.50 O ATOM 0 H GLY A 157 3.979 -6.872 9.583 1.00 0.36 H new ATOM 0 HA2 GLY A 157 3.368 -9.575 9.361 1.00 0.46 H new ATOM 0 HA3 GLY A 157 3.474 -8.632 10.834 1.00 0.46 H new ATOM 2318 N ALA A 158 0.666 -7.918 9.585 1.00 0.34 N ATOM 2319 CA ALA A 158 -0.776 -8.116 9.593 1.00 0.31 C ATOM 2320 C ALA A 158 -1.146 -8.913 8.357 1.00 0.34 C ATOM 2321 O ALA A 158 -0.676 -8.616 7.260 1.00 0.50 O ATOM 2322 CB ALA A 158 -1.522 -6.788 9.635 1.00 0.37 C ATOM 0 H ALA A 158 0.976 -7.033 9.184 1.00 0.34 H new ATOM 0 HA ALA A 158 -1.067 -8.662 10.491 1.00 0.31 H new ATOM 0 HB1 ALA A 158 -2.596 -6.974 9.640 1.00 0.37 H new ATOM 0 HB2 ALA A 158 -1.244 -6.243 10.537 1.00 0.37 H new ATOM 0 HB3 ALA A 158 -1.260 -6.196 8.758 1.00 0.37 H new ATOM 2328 N SER A 159 -1.976 -9.923 8.515 1.00 0.26 N ATOM 2329 CA SER A 159 -2.157 -10.875 7.456 1.00 0.30 C ATOM 2330 C SER A 159 -3.541 -10.748 6.850 1.00 0.23 C ATOM 2331 O SER A 159 -4.307 -9.849 7.203 1.00 0.22 O ATOM 2332 CB SER A 159 -1.913 -12.296 7.974 1.00 0.41 C ATOM 2333 OG SER A 159 -1.698 -13.202 6.902 1.00 1.42 O ATOM 0 H SER A 159 -2.526 -10.099 9.356 1.00 0.26 H new ATOM 0 HA SER A 159 -1.429 -10.666 6.672 1.00 0.30 H new ATOM 0 HB2 SER A 159 -1.048 -12.301 8.637 1.00 0.41 H new ATOM 0 HB3 SER A 159 -2.769 -12.623 8.564 1.00 0.41 H new ATOM 0 HG SER A 159 -1.340 -12.716 6.130 1.00 1.42 H new ATOM 2339 N VAL A 160 -3.833 -11.665 5.940 1.00 0.22 N ATOM 2340 CA VAL A 160 -5.073 -11.683 5.184 1.00 0.20 C ATOM 2341 C VAL A 160 -6.273 -11.443 6.089 1.00 0.21 C ATOM 2342 O VAL A 160 -7.080 -10.561 5.834 1.00 0.20 O ATOM 2343 CB VAL A 160 -5.241 -13.052 4.507 1.00 0.24 C ATOM 2344 CG1 VAL A 160 -6.529 -13.122 3.704 1.00 0.28 C ATOM 2345 CG2 VAL A 160 -4.046 -13.375 3.627 1.00 0.26 C ATOM 0 H VAL A 160 -3.202 -12.431 5.703 1.00 0.22 H new ATOM 0 HA VAL A 160 -5.024 -10.888 4.440 1.00 0.20 H new ATOM 0 HB VAL A 160 -5.298 -13.801 5.297 1.00 0.24 H new ATOM 0 HG11 VAL A 160 -6.615 -14.104 3.239 1.00 0.28 H new ATOM 0 HG12 VAL A 160 -7.380 -12.958 4.366 1.00 0.28 H new ATOM 0 HG13 VAL A 160 -6.518 -12.354 2.930 1.00 0.28 H new ATOM 0 HG21 VAL A 160 -4.191 -14.349 3.160 1.00 0.26 H new ATOM 0 HG22 VAL A 160 -3.947 -12.613 2.854 1.00 0.26 H new ATOM 0 HG23 VAL A 160 -3.141 -13.395 4.235 1.00 0.26 H new ATOM 2355 N LYS A 161 -6.350 -12.206 7.173 1.00 0.26 N ATOM 2356 CA LYS A 161 -7.504 -12.170 8.064 1.00 0.31 C ATOM 2357 C LYS A 161 -7.580 -10.843 8.817 1.00 0.26 C ATOM 2358 O LYS A 161 -8.670 -10.316 9.057 1.00 0.27 O ATOM 2359 CB LYS A 161 -7.437 -13.342 9.051 1.00 0.45 C ATOM 2360 CG LYS A 161 -8.514 -13.315 10.125 1.00 1.12 C ATOM 2361 CD LYS A 161 -9.911 -13.397 9.532 1.00 1.80 C ATOM 2362 CE LYS A 161 -10.974 -13.269 10.611 1.00 2.67 C ATOM 2363 NZ LYS A 161 -10.889 -11.967 11.324 1.00 3.46 N ATOM 0 H LYS A 161 -5.622 -12.861 7.458 1.00 0.26 H new ATOM 0 HA LYS A 161 -8.407 -12.262 7.460 1.00 0.31 H new ATOM 0 HB2 LYS A 161 -7.518 -14.276 8.495 1.00 0.45 H new ATOM 0 HB3 LYS A 161 -6.459 -13.341 9.533 1.00 0.45 H new ATOM 0 HG2 LYS A 161 -8.362 -14.148 10.812 1.00 1.12 H new ATOM 0 HG3 LYS A 161 -8.421 -12.399 10.709 1.00 1.12 H new ATOM 0 HD2 LYS A 161 -10.042 -12.607 8.793 1.00 1.80 H new ATOM 0 HD3 LYS A 161 -10.032 -14.346 9.009 1.00 1.80 H new ATOM 0 HE2 LYS A 161 -11.962 -13.372 10.161 1.00 2.67 H new ATOM 0 HE3 LYS A 161 -10.863 -14.083 11.328 1.00 2.67 H new ATOM 0 HZ1 LYS A 161 -10.473 -12.113 12.266 1.00 3.46 H new ATOM 0 HZ2 LYS A 161 -10.292 -11.312 10.780 1.00 3.46 H new ATOM 0 HZ3 LYS A 161 -11.842 -11.564 11.426 1.00 3.46 H new ATOM 2377 N ASP A 162 -6.419 -10.299 9.155 1.00 0.26 N ATOM 2378 CA ASP A 162 -6.340 -9.064 9.927 1.00 0.27 C ATOM 2379 C ASP A 162 -6.826 -7.909 9.084 1.00 0.22 C ATOM 2380 O ASP A 162 -7.446 -6.966 9.573 1.00 0.26 O ATOM 2381 CB ASP A 162 -4.901 -8.797 10.361 1.00 0.33 C ATOM 2382 CG ASP A 162 -4.356 -9.864 11.280 1.00 0.78 C ATOM 2383 OD1 ASP A 162 -4.731 -9.877 12.474 1.00 0.86 O ATOM 2384 OD2 ASP A 162 -3.547 -10.694 10.816 1.00 1.40 O ATOM 0 H ASP A 162 -5.513 -10.696 8.905 1.00 0.26 H new ATOM 0 HA ASP A 162 -6.966 -9.167 10.814 1.00 0.27 H new ATOM 0 HB2 ASP A 162 -4.267 -8.728 9.477 1.00 0.33 H new ATOM 0 HB3 ASP A 162 -4.852 -7.831 10.864 1.00 0.33 H new ATOM 2389 N ILE A 163 -6.527 -8.003 7.804 1.00 0.18 N ATOM 2390 CA ILE A 163 -6.918 -7.001 6.841 1.00 0.15 C ATOM 2391 C ILE A 163 -8.368 -7.181 6.411 1.00 0.14 C ATOM 2392 O ILE A 163 -9.139 -6.220 6.403 1.00 0.15 O ATOM 2393 CB ILE A 163 -5.992 -7.057 5.612 1.00 0.14 C ATOM 2394 CG1 ILE A 163 -4.628 -6.425 5.941 1.00 0.15 C ATOM 2395 CG2 ILE A 163 -6.648 -6.373 4.420 1.00 0.15 C ATOM 2396 CD1 ILE A 163 -3.588 -6.627 4.861 1.00 0.21 C ATOM 0 H ILE A 163 -6.003 -8.781 7.404 1.00 0.18 H new ATOM 0 HA ILE A 163 -6.826 -6.025 7.317 1.00 0.15 H new ATOM 0 HB ILE A 163 -5.822 -8.100 5.345 1.00 0.14 H new ATOM 0 HG12 ILE A 163 -4.763 -5.356 6.107 1.00 0.15 H new ATOM 0 HG13 ILE A 163 -4.257 -6.848 6.874 1.00 0.15 H new ATOM 0 HG21 ILE A 163 -5.980 -6.422 3.560 1.00 0.15 H new ATOM 0 HG22 ILE A 163 -7.584 -6.877 4.181 1.00 0.15 H new ATOM 0 HG23 ILE A 163 -6.849 -5.330 4.665 1.00 0.15 H new ATOM 0 HD11 ILE A 163 -2.653 -6.155 5.163 1.00 0.21 H new ATOM 0 HD12 ILE A 163 -3.423 -7.694 4.710 1.00 0.21 H new ATOM 0 HD13 ILE A 163 -3.937 -6.178 3.931 1.00 0.21 H new ATOM 2408 N GLU A 164 -8.737 -8.413 6.066 1.00 0.13 N ATOM 2409 CA GLU A 164 -10.076 -8.705 5.571 1.00 0.13 C ATOM 2410 C GLU A 164 -11.142 -8.204 6.529 1.00 0.15 C ATOM 2411 O GLU A 164 -12.174 -7.711 6.113 1.00 0.15 O ATOM 2412 CB GLU A 164 -10.305 -10.205 5.397 1.00 0.14 C ATOM 2413 CG GLU A 164 -9.573 -10.853 4.242 1.00 0.20 C ATOM 2414 CD GLU A 164 -9.909 -12.326 4.131 1.00 0.30 C ATOM 2415 OE1 GLU A 164 -9.473 -13.110 4.998 1.00 0.67 O ATOM 2416 OE2 GLU A 164 -10.597 -12.714 3.165 1.00 0.60 O ATOM 0 H GLU A 164 -8.123 -9.226 6.121 1.00 0.13 H new ATOM 0 HA GLU A 164 -10.151 -8.198 4.609 1.00 0.13 H new ATOM 0 HB2 GLU A 164 -10.009 -10.708 6.318 1.00 0.14 H new ATOM 0 HB3 GLU A 164 -11.373 -10.378 5.268 1.00 0.14 H new ATOM 0 HG2 GLU A 164 -9.836 -10.347 3.313 1.00 0.20 H new ATOM 0 HG3 GLU A 164 -8.498 -10.733 4.377 1.00 0.20 H new ATOM 2423 N GLU A 165 -10.898 -8.350 7.815 1.00 0.18 N ATOM 2424 CA GLU A 165 -11.890 -7.982 8.814 1.00 0.21 C ATOM 2425 C GLU A 165 -12.239 -6.493 8.738 1.00 0.21 C ATOM 2426 O GLU A 165 -13.308 -6.075 9.186 1.00 0.27 O ATOM 2427 CB GLU A 165 -11.400 -8.355 10.217 1.00 0.27 C ATOM 2428 CG GLU A 165 -10.271 -7.485 10.738 1.00 0.47 C ATOM 2429 CD GLU A 165 -9.774 -7.946 12.093 1.00 0.66 C ATOM 2430 OE1 GLU A 165 -10.360 -7.541 13.116 1.00 0.87 O ATOM 2431 OE2 GLU A 165 -8.788 -8.710 12.142 1.00 0.83 O ATOM 0 H GLU A 165 -10.027 -8.719 8.196 1.00 0.18 H new ATOM 0 HA GLU A 165 -12.801 -8.542 8.603 1.00 0.21 H new ATOM 0 HB2 GLU A 165 -12.239 -8.294 10.910 1.00 0.27 H new ATOM 0 HB3 GLU A 165 -11.068 -9.393 10.209 1.00 0.27 H new ATOM 0 HG2 GLU A 165 -9.446 -7.498 10.026 1.00 0.47 H new ATOM 0 HG3 GLU A 165 -10.613 -6.453 10.810 1.00 0.47 H new ATOM 2438 N LYS A 166 -11.343 -5.701 8.163 1.00 0.19 N ATOM 2439 CA LYS A 166 -11.614 -4.294 7.928 1.00 0.20 C ATOM 2440 C LYS A 166 -12.020 -4.073 6.473 1.00 0.19 C ATOM 2441 O LYS A 166 -12.710 -3.109 6.139 1.00 0.25 O ATOM 2442 CB LYS A 166 -10.387 -3.447 8.272 1.00 0.25 C ATOM 2443 CG LYS A 166 -9.999 -3.483 9.743 1.00 0.38 C ATOM 2444 CD LYS A 166 -11.111 -2.942 10.627 1.00 0.58 C ATOM 2445 CE LYS A 166 -10.680 -2.861 12.084 1.00 1.09 C ATOM 2446 NZ LYS A 166 -9.573 -1.890 12.286 1.00 1.71 N ATOM 0 H LYS A 166 -10.423 -6.012 7.852 1.00 0.19 H new ATOM 0 HA LYS A 166 -12.437 -3.986 8.573 1.00 0.20 H new ATOM 0 HB2 LYS A 166 -9.542 -3.792 7.676 1.00 0.25 H new ATOM 0 HB3 LYS A 166 -10.580 -2.414 7.983 1.00 0.25 H new ATOM 0 HG2 LYS A 166 -9.768 -4.508 10.034 1.00 0.38 H new ATOM 0 HG3 LYS A 166 -9.093 -2.896 9.896 1.00 0.38 H new ATOM 0 HD2 LYS A 166 -11.404 -1.952 10.278 1.00 0.58 H new ATOM 0 HD3 LYS A 166 -11.989 -3.583 10.542 1.00 0.58 H new ATOM 0 HE2 LYS A 166 -11.533 -2.571 12.698 1.00 1.09 H new ATOM 0 HE3 LYS A 166 -10.363 -3.847 12.423 1.00 1.09 H new ATOM 0 HZ1 LYS A 166 -9.402 -1.765 13.304 1.00 1.71 H new ATOM 0 HZ2 LYS A 166 -8.709 -2.249 11.831 1.00 1.71 H new ATOM 0 HZ3 LYS A 166 -9.832 -0.975 11.864 1.00 1.71 H new ATOM 2460 N LEU A 167 -11.611 -5.006 5.630 1.00 0.15 N ATOM 2461 CA LEU A 167 -11.795 -4.920 4.191 1.00 0.15 C ATOM 2462 C LEU A 167 -13.158 -5.447 3.747 1.00 0.15 C ATOM 2463 O LEU A 167 -13.876 -4.792 2.993 1.00 0.16 O ATOM 2464 CB LEU A 167 -10.702 -5.741 3.513 1.00 0.13 C ATOM 2465 CG LEU A 167 -10.993 -6.111 2.068 1.00 0.14 C ATOM 2466 CD1 LEU A 167 -10.839 -4.896 1.173 1.00 0.16 C ATOM 2467 CD2 LEU A 167 -10.095 -7.249 1.614 1.00 0.16 C ATOM 0 H LEU A 167 -11.135 -5.857 5.930 1.00 0.15 H new ATOM 0 HA LEU A 167 -11.740 -3.869 3.906 1.00 0.15 H new ATOM 0 HB2 LEU A 167 -9.769 -5.179 3.550 1.00 0.13 H new ATOM 0 HB3 LEU A 167 -10.546 -6.656 4.084 1.00 0.13 H new ATOM 0 HG LEU A 167 -12.025 -6.456 1.996 1.00 0.14 H new ATOM 0 HD11 LEU A 167 -11.050 -5.175 0.141 1.00 0.16 H new ATOM 0 HD12 LEU A 167 -11.537 -4.120 1.489 1.00 0.16 H new ATOM 0 HD13 LEU A 167 -9.819 -4.518 1.245 1.00 0.16 H new ATOM 0 HD21 LEU A 167 -10.320 -7.498 0.577 1.00 0.16 H new ATOM 0 HD22 LEU A 167 -9.052 -6.944 1.696 1.00 0.16 H new ATOM 0 HD23 LEU A 167 -10.268 -8.122 2.243 1.00 0.16 H new ATOM 2479 N ILE A 168 -13.491 -6.642 4.215 1.00 0.16 N ATOM 2480 CA ILE A 168 -14.685 -7.362 3.788 1.00 0.19 C ATOM 2481 C ILE A 168 -15.964 -6.531 3.947 1.00 0.22 C ATOM 2482 O ILE A 168 -16.766 -6.472 3.019 1.00 0.25 O ATOM 2483 CB ILE A 168 -14.828 -8.710 4.526 1.00 0.20 C ATOM 2484 CG1 ILE A 168 -13.615 -9.605 4.234 1.00 0.19 C ATOM 2485 CG2 ILE A 168 -16.117 -9.414 4.126 1.00 0.26 C ATOM 2486 CD1 ILE A 168 -13.646 -10.928 4.974 1.00 0.24 C ATOM 0 H ILE A 168 -12.936 -7.144 4.908 1.00 0.16 H new ATOM 0 HA ILE A 168 -14.554 -7.559 2.724 1.00 0.19 H new ATOM 0 HB ILE A 168 -14.869 -8.512 5.597 1.00 0.20 H new ATOM 0 HG12 ILE A 168 -13.566 -9.798 3.162 1.00 0.19 H new ATOM 0 HG13 ILE A 168 -12.705 -9.069 4.503 1.00 0.19 H new ATOM 0 HG21 ILE A 168 -16.195 -10.361 4.659 1.00 0.26 H new ATOM 0 HG22 ILE A 168 -16.969 -8.784 4.379 1.00 0.26 H new ATOM 0 HG23 ILE A 168 -16.111 -9.602 3.052 1.00 0.26 H new ATOM 0 HD11 ILE A 168 -12.759 -11.508 4.720 1.00 0.24 H new ATOM 0 HD12 ILE A 168 -13.664 -10.744 6.048 1.00 0.24 H new ATOM 0 HD13 ILE A 168 -14.538 -11.485 4.687 1.00 0.24 H new ATOM 2498 N PRO A 169 -16.183 -5.867 5.104 1.00 0.24 N ATOM 2499 CA PRO A 169 -17.341 -4.979 5.291 1.00 0.29 C ATOM 2500 C PRO A 169 -17.390 -3.835 4.272 1.00 0.29 C ATOM 2501 O PRO A 169 -18.420 -3.188 4.105 1.00 0.41 O ATOM 2502 CB PRO A 169 -17.155 -4.415 6.703 1.00 0.34 C ATOM 2503 CG PRO A 169 -15.735 -4.689 7.056 1.00 0.40 C ATOM 2504 CD PRO A 169 -15.370 -5.948 6.330 1.00 0.24 C ATOM 0 HA PRO A 169 -18.275 -5.523 5.153 1.00 0.29 H new ATOM 0 HB2 PRO A 169 -17.367 -3.346 6.730 1.00 0.34 H new ATOM 0 HB3 PRO A 169 -17.834 -4.893 7.409 1.00 0.34 H new ATOM 0 HG2 PRO A 169 -15.091 -3.863 6.755 1.00 0.40 H new ATOM 0 HG3 PRO A 169 -15.616 -4.810 8.133 1.00 0.40 H new ATOM 0 HD2 PRO A 169 -14.304 -5.991 6.106 1.00 0.24 H new ATOM 0 HD3 PRO A 169 -15.609 -6.836 6.915 1.00 0.24 H new ATOM 2512 N LEU A 170 -16.281 -3.576 3.596 1.00 0.22 N ATOM 2513 CA LEU A 170 -16.258 -2.548 2.571 1.00 0.22 C ATOM 2514 C LEU A 170 -16.447 -3.160 1.186 1.00 0.20 C ATOM 2515 O LEU A 170 -17.162 -2.602 0.356 1.00 0.23 O ATOM 2516 CB LEU A 170 -14.967 -1.728 2.630 1.00 0.24 C ATOM 2517 CG LEU A 170 -14.771 -0.876 3.879 1.00 0.33 C ATOM 2518 CD1 LEU A 170 -13.400 -0.220 3.837 1.00 0.71 C ATOM 2519 CD2 LEU A 170 -15.866 0.177 3.983 1.00 0.69 C ATOM 0 H LEU A 170 -15.394 -4.059 3.738 1.00 0.22 H new ATOM 0 HA LEU A 170 -17.090 -1.870 2.764 1.00 0.22 H new ATOM 0 HB2 LEU A 170 -14.122 -2.411 2.545 1.00 0.24 H new ATOM 0 HB3 LEU A 170 -14.936 -1.073 1.759 1.00 0.24 H new ATOM 0 HG LEU A 170 -14.832 -1.515 4.760 1.00 0.33 H new ATOM 0 HD11 LEU A 170 -13.261 0.389 4.730 1.00 0.71 H new ATOM 0 HD12 LEU A 170 -12.629 -0.990 3.799 1.00 0.71 H new ATOM 0 HD13 LEU A 170 -13.326 0.412 2.952 1.00 0.71 H new ATOM 0 HD21 LEU A 170 -15.711 0.776 4.880 1.00 0.69 H new ATOM 0 HD22 LEU A 170 -15.834 0.823 3.105 1.00 0.69 H new ATOM 0 HD23 LEU A 170 -16.838 -0.313 4.038 1.00 0.69 H new ATOM 2531 N LEU A 171 -15.803 -4.300 0.933 1.00 0.18 N ATOM 2532 CA LEU A 171 -16.001 -5.025 -0.328 1.00 0.20 C ATOM 2533 C LEU A 171 -17.433 -5.483 -0.432 1.00 0.27 C ATOM 2534 O LEU A 171 -18.138 -5.219 -1.408 1.00 0.34 O ATOM 2535 CB LEU A 171 -15.123 -6.271 -0.402 1.00 0.26 C ATOM 2536 CG LEU A 171 -13.635 -6.021 -0.426 1.00 0.17 C ATOM 2537 CD1 LEU A 171 -12.890 -7.337 -0.416 1.00 0.26 C ATOM 2538 CD2 LEU A 171 -13.260 -5.206 -1.648 1.00 0.31 C ATOM 0 H LEU A 171 -15.145 -4.740 1.576 1.00 0.18 H new ATOM 0 HA LEU A 171 -15.739 -4.342 -1.136 1.00 0.20 H new ATOM 0 HB2 LEU A 171 -15.353 -6.906 0.453 1.00 0.26 H new ATOM 0 HB3 LEU A 171 -15.393 -6.831 -1.297 1.00 0.26 H new ATOM 0 HG LEU A 171 -13.356 -5.456 0.463 1.00 0.17 H new ATOM 0 HD11 LEU A 171 -11.817 -7.148 -0.433 1.00 0.26 H new ATOM 0 HD12 LEU A 171 -13.146 -7.893 0.486 1.00 0.26 H new ATOM 0 HD13 LEU A 171 -13.170 -7.920 -1.293 1.00 0.26 H new ATOM 0 HD21 LEU A 171 -12.184 -5.033 -1.653 1.00 0.31 H new ATOM 0 HD22 LEU A 171 -13.545 -5.749 -2.549 1.00 0.31 H new ATOM 0 HD23 LEU A 171 -13.782 -4.249 -1.621 1.00 0.31 H new ATOM 2550 N GLY A 172 -17.835 -6.177 0.611 1.00 0.29 N ATOM 2551 CA GLY A 172 -19.141 -6.763 0.672 1.00 0.39 C ATOM 2552 C GLY A 172 -20.216 -5.742 0.956 1.00 0.66 C ATOM 2553 O GLY A 172 -21.404 -6.037 0.830 1.00 1.12 O ATOM 0 H GLY A 172 -17.260 -6.346 1.436 1.00 0.29 H new ATOM 0 HA2 GLY A 172 -19.357 -7.261 -0.273 1.00 0.39 H new ATOM 0 HA3 GLY A 172 -19.157 -7.529 1.447 1.00 0.39 H new ATOM 2557 N SER A 173 -19.780 -4.543 1.335 1.00 0.85 N ATOM 2558 CA SER A 173 -20.673 -3.440 1.648 1.00 1.33 C ATOM 2559 C SER A 173 -21.550 -3.785 2.851 1.00 1.84 C ATOM 2560 O SER A 173 -22.615 -4.388 2.717 1.00 2.43 O ATOM 2561 CB SER A 173 -21.529 -3.079 0.431 1.00 2.03 C ATOM 2562 OG SER A 173 -22.171 -1.829 0.607 1.00 2.64 O ATOM 0 H SER A 173 -18.791 -4.312 1.433 1.00 0.85 H new ATOM 0 HA SER A 173 -20.070 -2.570 1.907 1.00 1.33 H new ATOM 0 HB2 SER A 173 -20.902 -3.046 -0.460 1.00 2.03 H new ATOM 0 HB3 SER A 173 -22.277 -3.855 0.267 1.00 2.03 H new ATOM 0 HG SER A 173 -22.709 -1.623 -0.186 1.00 2.64 H new ATOM 2568 N ALA A 174 -21.078 -3.411 4.033 1.00 2.40 N ATOM 2569 CA ALA A 174 -21.812 -3.655 5.265 1.00 3.35 C ATOM 2570 C ALA A 174 -23.185 -3.000 5.210 1.00 3.69 C ATOM 2571 O ALA A 174 -24.178 -3.596 5.627 1.00 4.35 O ATOM 2572 CB ALA A 174 -21.026 -3.144 6.463 1.00 4.30 C ATOM 0 H ALA A 174 -20.185 -2.935 4.163 1.00 2.40 H new ATOM 0 HA ALA A 174 -21.949 -4.731 5.375 1.00 3.35 H new ATOM 0 HB1 ALA A 174 -21.590 -3.335 7.376 1.00 4.30 H new ATOM 0 HB2 ALA A 174 -20.066 -3.658 6.515 1.00 4.30 H new ATOM 0 HB3 ALA A 174 -20.858 -2.072 6.358 1.00 4.30 H new ATOM 2578 N ARG A 175 -23.230 -1.770 4.688 1.00 3.66 N ATOM 2579 CA ARG A 175 -24.485 -1.036 4.534 1.00 4.44 C ATOM 2580 C ARG A 175 -25.200 -0.901 5.875 1.00 4.81 C ATOM 2581 O ARG A 175 -24.570 -0.956 6.936 1.00 5.15 O ATOM 2582 CB ARG A 175 -25.389 -1.750 3.520 1.00 5.16 C ATOM 2583 CG ARG A 175 -24.924 -1.629 2.080 1.00 5.82 C ATOM 2584 CD ARG A 175 -25.527 -2.724 1.213 1.00 6.62 C ATOM 2585 NE ARG A 175 -25.040 -4.042 1.612 1.00 7.03 N ATOM 2586 CZ ARG A 175 -25.532 -5.199 1.175 1.00 7.84 C ATOM 2587 NH1 ARG A 175 -26.516 -5.224 0.284 1.00 8.30 N ATOM 2588 NH2 ARG A 175 -25.015 -6.337 1.622 1.00 8.45 N ATOM 0 H ARG A 175 -22.407 -1.262 4.365 1.00 3.66 H new ATOM 0 HA ARG A 175 -24.258 -0.036 4.166 1.00 4.44 H new ATOM 0 HB2 ARG A 175 -25.449 -2.806 3.783 1.00 5.16 H new ATOM 0 HB3 ARG A 175 -26.397 -1.344 3.600 1.00 5.16 H new ATOM 0 HG2 ARG A 175 -25.205 -0.653 1.685 1.00 5.82 H new ATOM 0 HG3 ARG A 175 -23.836 -1.688 2.040 1.00 5.82 H new ATOM 0 HD2 ARG A 175 -26.614 -2.696 1.291 1.00 6.62 H new ATOM 0 HD3 ARG A 175 -25.278 -2.542 0.168 1.00 6.62 H new ATOM 0 HE ARG A 175 -24.265 -4.078 2.275 1.00 7.03 H new ATOM 0 HH11 ARG A 175 -26.903 -4.350 -0.073 1.00 8.30 H new ATOM 0 HH12 ARG A 175 -26.885 -6.117 -0.043 1.00 8.30 H new ATOM 0 HH21 ARG A 175 -24.248 -6.319 2.294 1.00 8.45 H new ATOM 0 HH22 ARG A 175 -25.385 -7.229 1.293 1.00 8.45 H new ATOM 2602 N LEU A 176 -26.506 -0.712 5.826 1.00 5.22 N ATOM 2603 CA LEU A 176 -27.312 -0.647 7.028 1.00 6.05 C ATOM 2604 C LEU A 176 -28.672 -1.268 6.754 1.00 6.72 C ATOM 2605 O LEU A 176 -28.802 -2.499 6.913 1.00 7.14 O ATOM 2606 CB LEU A 176 -27.463 0.803 7.501 1.00 6.60 C ATOM 2607 CG LEU A 176 -28.162 0.977 8.852 1.00 7.19 C ATOM 2608 CD1 LEU A 176 -27.397 0.254 9.950 1.00 7.69 C ATOM 2609 CD2 LEU A 176 -28.301 2.452 9.189 1.00 7.60 C ATOM 2610 OXT LEU A 176 -29.595 -0.538 6.338 1.00 7.13 O ATOM 0 H LEU A 176 -27.033 -0.600 4.960 1.00 5.22 H new ATOM 0 HA LEU A 176 -26.817 -1.205 7.823 1.00 6.05 H new ATOM 0 HB2 LEU A 176 -26.472 1.254 7.561 1.00 6.60 H new ATOM 0 HB3 LEU A 176 -28.021 1.358 6.747 1.00 6.60 H new ATOM 0 HG LEU A 176 -29.158 0.539 8.782 1.00 7.19 H new ATOM 0 HD11 LEU A 176 -27.911 0.390 10.902 1.00 7.69 H new ATOM 0 HD12 LEU A 176 -27.343 -0.809 9.716 1.00 7.69 H new ATOM 0 HD13 LEU A 176 -26.389 0.662 10.020 1.00 7.69 H new ATOM 0 HD21 LEU A 176 -28.800 2.560 10.152 1.00 7.60 H new ATOM 0 HD22 LEU A 176 -27.312 2.908 9.239 1.00 7.60 H new ATOM 0 HD23 LEU A 176 -28.891 2.947 8.418 1.00 7.60 H new TER 2622 LEU A 176