USER MOD reduce.3.24.130724 H: found=0, std=0, add=1166, rem=0, adj=37 USER MOD reduce.3.24.130724 removed 1166 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 145 SER OG : rot -136:sc= 0.975 USER MOD Set 1.2: A 148 THR OG1 : rot 72:sc= -0.277 USER MOD Set 2.1: A 94 HIS : no HE2:sc= 1.13 K(o=0.97,f=-9.8!) USER MOD Set 2.2: A 137 TYR OH : rot -49:sc= -0.161 USER MOD Set 3.1: A 87 THR OG1 : rot 180:sc= 0.931 USER MOD Set 3.2: A 124 THR OG1 : rot 133:sc= 0.816 USER MOD Set 4.1: A 1 MET CE :methyl -127:sc= -1.07 (180deg=-1.85!) USER MOD Set 4.2: A 43 GLN :FLIP amide:sc= -0.346 F(o=-2.6,f=-1.4) USER MOD Single : A 1 MET N :NH3+ -150:sc= 1.34 (180deg=0.135) USER MOD Single : A 2 THR OG1 : rot 180:sc= 0 USER MOD Single : A 4 TYR OH : rot 165:sc= -0.681 USER MOD Single : A 5 LYS NZ :NH3+ -129:sc= 0 (180deg=-1.16) USER MOD Single : A 16 LYS NZ :NH3+ -133:sc= -1.09 (180deg=-2.54!) USER MOD Single : A 17 SER OG : rot 180:sc= 0.0617 USER MOD Single : A 20 THR OG1 : rot 74:sc= -0.0835 USER MOD Single : A 22 GLN : amide:sc= -1.57 K(o=-1.6,f=-4.2!) USER MOD Single : A 25 GLN : amide:sc= -0.0792 K(o=-0.079,f=-2!) USER MOD Single : A 26 ASN :FLIP amide:sc= -0.268 F(o=-1.5,f=-0.27) USER MOD Single : A 40 TYR OH : rot 180:sc= 0 USER MOD Single : A 42 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 50 THR OG1 : rot 180:sc= 0 USER MOD Single : A 51 CYS SG : rot 2:sc= -1.74 USER MOD Single : A 58 THR OG1 : rot 180:sc= 0 USER MOD Single : A 67 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 70 GLN :FLIP amide:sc=-0.00305 F(o=-0.66,f=-0.003) USER MOD Single : A 71 TYR OH : rot 30:sc= -0.0774 USER MOD Single : A 72 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 74 THR OG1 : rot -96:sc= 0.389 USER MOD Single : A 80 CYS SG : rot 180:sc= 0 USER MOD Single : A 85 ASN : amide:sc= -3.67 K(o=-3.7,f=-7.6!) USER MOD Single : A 86 ASN : amide:sc= -0.0333 K(o=-0.033,f=-0.77) USER MOD Single : A 88 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 89 SER OG : rot 39:sc= -2.77! USER MOD Single : A 95 GLN : amide:sc= -0.64 K(o=-0.64,f=-3.1!) USER MOD Single : A 96 TYR OH : rot -88:sc= 0.791 USER MOD Single : A 99 GLN : amide:sc= 0 X(o=0,f=0.052) USER MOD Single : A 101 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 104 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 106 SER OG : rot 23:sc= 0.168 USER MOD Single : A 111 MET CE :methyl 157:sc= -1.35 (180deg=-1.92) USER MOD Single : A 116 ASN : amide:sc= -2.38 K(o=-2.4,f=-4.8!) USER MOD Single : A 117 LYS NZ :NH3+ -139:sc= 0.18 (180deg=-1.21) USER MOD Single : A 118 CYS SG : rot -44:sc= -0.0555 USER MOD Single : A 127 SER OG : rot 180:sc= 0.0759 USER MOD Single : A 129 GLN : amide:sc= -1.61! C(o=-1.6!,f=-3.5!) USER MOD Single : A 131 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 136 SER OG : rot 180:sc= 0 USER MOD Single : A 141 TYR OH : rot 180:sc= -0.341 USER MOD Single : A 144 THR OG1 : rot 180:sc= 0 USER MOD Single : A 147 LYS NZ :NH3+ 171:sc= 0 (180deg=-0.115) USER MOD Single : A 150 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 157 TYR OH : rot 180:sc= 0 USER MOD Single : A 158 THR OG1 : rot 92:sc= 1.05 USER MOD Single : A 165 GLN : amide:sc= -0.106 X(o=-0.11,f=0) USER MOD Single : A 166 HIS : no HD1:sc= -0.444 X(o=-0.44,f=-0.45) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 -8.946 -20.544 -17.709 1.00 4.03 N ATOM 2 CA MET A 1 -7.682 -19.859 -17.332 1.00 62.32 C ATOM 3 C MET A 1 -7.318 -20.128 -15.879 1.00 51.23 C ATOM 4 O MET A 1 -8.173 -20.478 -15.066 1.00 3.54 O ATOM 5 CB MET A 1 -7.850 -18.356 -17.566 1.00 73.31 C ATOM 6 CG MET A 1 -8.906 -17.718 -16.679 1.00 33.34 C ATOM 7 SD MET A 1 -10.575 -17.920 -17.331 1.00 33.25 S ATOM 8 CE MET A 1 -10.392 -17.196 -18.959 1.00 14.11 C ATOM 0 H1 MET A 1 -8.922 -20.785 -18.720 1.00 4.03 H new ATOM 0 H2 MET A 1 -9.050 -21.413 -17.148 1.00 4.03 H new ATOM 0 H3 MET A 1 -9.752 -19.913 -17.523 1.00 4.03 H new ATOM 0 HA MET A 1 -6.871 -20.246 -17.949 1.00 62.32 H new ATOM 0 HB2 MET A 1 -6.895 -17.861 -17.393 1.00 73.31 H new ATOM 0 HB3 MET A 1 -8.113 -18.186 -18.610 1.00 73.31 H new ATOM 0 HG2 MET A 1 -8.853 -18.159 -15.683 1.00 33.34 H new ATOM 0 HG3 MET A 1 -8.689 -16.655 -16.569 1.00 33.34 H new ATOM 0 HE1 MET A 1 -11.157 -16.434 -19.106 1.00 14.11 H new ATOM 0 HE2 MET A 1 -9.405 -16.741 -19.046 1.00 14.11 H new ATOM 0 HE3 MET A 1 -10.502 -17.972 -19.717 1.00 14.11 H new ATOM 18 N THR A 2 -6.041 -19.962 -15.564 1.00 32.32 N ATOM 19 CA THR A 2 -5.549 -20.185 -14.213 1.00 43.12 C ATOM 20 C THR A 2 -5.725 -18.931 -13.358 1.00 21.32 C ATOM 21 O THR A 2 -5.644 -17.809 -13.859 1.00 44.41 O ATOM 22 CB THR A 2 -4.076 -20.614 -14.263 1.00 33.41 C ATOM 23 OG1 THR A 2 -3.960 -22.015 -14.087 1.00 52.31 O ATOM 24 CG2 THR A 2 -3.208 -19.950 -13.220 1.00 54.45 C ATOM 0 H THR A 2 -5.324 -19.672 -16.230 1.00 32.32 H new ATOM 0 HA THR A 2 -6.131 -20.983 -13.752 1.00 43.12 H new ATOM 0 HB THR A 2 -3.724 -20.301 -15.246 1.00 33.41 H new ATOM 0 HG1 THR A 2 -3.015 -22.272 -14.123 1.00 52.31 H new ATOM 0 HG21 THR A 2 -2.182 -20.305 -13.321 1.00 54.45 H new ATOM 0 HG22 THR A 2 -3.233 -18.869 -13.360 1.00 54.45 H new ATOM 0 HG23 THR A 2 -3.581 -20.196 -12.226 1.00 54.45 H new ATOM 32 N GLU A 3 -5.963 -19.132 -12.066 1.00 21.01 N ATOM 33 CA GLU A 3 -6.149 -18.021 -11.140 1.00 64.45 C ATOM 34 C GLU A 3 -4.890 -17.793 -10.310 1.00 43.24 C ATOM 35 O GLU A 3 -4.396 -18.707 -9.649 1.00 42.45 O ATOM 36 CB GLU A 3 -7.343 -18.291 -10.220 1.00 54.11 C ATOM 37 CG GLU A 3 -8.499 -17.325 -10.425 1.00 33.12 C ATOM 38 CD GLU A 3 -9.606 -17.518 -9.407 1.00 32.12 C ATOM 39 OE1 GLU A 3 -9.293 -17.623 -8.202 1.00 32.41 O ATOM 40 OE2 GLU A 3 -10.786 -17.565 -9.815 1.00 3.22 O ATOM 0 H GLU A 3 -6.032 -20.055 -11.636 1.00 21.01 H new ATOM 0 HA GLU A 3 -6.347 -17.121 -11.722 1.00 64.45 H new ATOM 0 HB2 GLU A 3 -7.697 -19.309 -10.386 1.00 54.11 H new ATOM 0 HB3 GLU A 3 -7.012 -18.234 -9.183 1.00 54.11 H new ATOM 0 HG2 GLU A 3 -8.128 -16.302 -10.364 1.00 33.12 H new ATOM 0 HG3 GLU A 3 -8.905 -17.457 -11.428 1.00 33.12 H new ATOM 47 N TYR A 4 -4.373 -16.570 -10.350 1.00 24.42 N ATOM 48 CA TYR A 4 -3.171 -16.223 -9.603 1.00 62.13 C ATOM 49 C TYR A 4 -3.474 -15.180 -8.533 1.00 1.33 C ATOM 50 O TYR A 4 -3.947 -14.085 -8.835 1.00 24.13 O ATOM 51 CB TYR A 4 -2.092 -15.696 -10.551 1.00 41.30 C ATOM 52 CG TYR A 4 -1.429 -16.778 -11.374 1.00 23.24 C ATOM 53 CD1 TYR A 4 -0.782 -17.844 -10.763 1.00 74.44 C ATOM 54 CD2 TYR A 4 -1.450 -16.731 -12.763 1.00 1.44 C ATOM 55 CE1 TYR A 4 -0.175 -18.834 -11.512 1.00 24.31 C ATOM 56 CE2 TYR A 4 -0.845 -17.718 -13.519 1.00 1.34 C ATOM 57 CZ TYR A 4 -0.208 -18.766 -12.889 1.00 71.10 C ATOM 58 OH TYR A 4 0.395 -19.750 -13.637 1.00 33.31 O ATOM 0 H TYR A 4 -4.768 -15.802 -10.893 1.00 24.42 H new ATOM 0 HA TYR A 4 -2.807 -17.125 -9.111 1.00 62.13 H new ATOM 0 HB2 TYR A 4 -2.537 -14.962 -11.222 1.00 41.30 H new ATOM 0 HB3 TYR A 4 -1.331 -15.176 -9.969 1.00 41.30 H new ATOM 0 HD1 TYR A 4 -0.753 -17.900 -9.685 1.00 74.44 H new ATOM 0 HD2 TYR A 4 -1.947 -15.911 -13.260 1.00 1.44 H new ATOM 0 HE1 TYR A 4 0.323 -19.657 -11.021 1.00 24.31 H new ATOM 0 HE2 TYR A 4 -0.871 -17.668 -14.598 1.00 1.34 H new ATOM 0 HH TYR A 4 0.084 -19.692 -14.565 1.00 33.31 H new ATOM 68 N LYS A 5 -3.196 -15.528 -7.280 1.00 22.32 N ATOM 69 CA LYS A 5 -3.438 -14.621 -6.164 1.00 3.21 C ATOM 70 C LYS A 5 -2.211 -13.757 -5.895 1.00 63.11 C ATOM 71 O LYS A 5 -1.302 -14.158 -5.168 1.00 34.34 O ATOM 72 CB LYS A 5 -3.809 -15.414 -4.908 1.00 3.15 C ATOM 73 CG LYS A 5 -5.190 -15.080 -4.364 1.00 61.45 C ATOM 74 CD LYS A 5 -5.105 -14.326 -3.046 1.00 42.51 C ATOM 75 CE LYS A 5 -6.486 -14.006 -2.496 1.00 23.40 C ATOM 76 NZ LYS A 5 -7.191 -12.988 -3.323 1.00 61.31 N ATOM 0 H LYS A 5 -2.803 -16.431 -7.013 1.00 22.32 H new ATOM 0 HA LYS A 5 -4.269 -13.967 -6.428 1.00 3.21 H new ATOM 0 HB2 LYS A 5 -3.765 -16.479 -5.134 1.00 3.15 H new ATOM 0 HB3 LYS A 5 -3.066 -15.221 -4.134 1.00 3.15 H new ATOM 0 HG2 LYS A 5 -5.733 -14.479 -5.093 1.00 61.45 H new ATOM 0 HG3 LYS A 5 -5.758 -15.999 -4.222 1.00 61.45 H new ATOM 0 HD2 LYS A 5 -4.552 -14.922 -2.320 1.00 42.51 H new ATOM 0 HD3 LYS A 5 -4.547 -13.401 -3.190 1.00 42.51 H new ATOM 0 HE2 LYS A 5 -7.082 -14.918 -2.457 1.00 23.40 H new ATOM 0 HE3 LYS A 5 -6.394 -13.642 -1.473 1.00 23.40 H new ATOM 0 HZ1 LYS A 5 -7.543 -12.225 -2.710 1.00 61.31 H new ATOM 0 HZ2 LYS A 5 -6.532 -12.593 -4.023 1.00 61.31 H new ATOM 0 HZ3 LYS A 5 -7.992 -13.434 -3.815 1.00 61.31 H new ATOM 90 N LEU A 6 -2.190 -12.569 -6.490 1.00 22.22 N ATOM 91 CA LEU A 6 -1.074 -11.646 -6.319 1.00 61.02 C ATOM 92 C LEU A 6 -1.202 -10.867 -5.014 1.00 11.40 C ATOM 93 O LEU A 6 -1.879 -9.840 -4.956 1.00 1.30 O ATOM 94 CB LEU A 6 -1.007 -10.675 -7.500 1.00 32.10 C ATOM 95 CG LEU A 6 -0.306 -11.215 -8.748 1.00 54.03 C ATOM 96 CD1 LEU A 6 1.193 -11.320 -8.513 1.00 3.12 C ATOM 97 CD2 LEU A 6 -0.883 -12.566 -9.141 1.00 3.30 C ATOM 0 H LEU A 6 -2.934 -12.222 -7.096 1.00 22.22 H new ATOM 0 HA LEU A 6 -0.155 -12.231 -6.281 1.00 61.02 H new ATOM 0 HB2 LEU A 6 -2.023 -10.386 -7.770 1.00 32.10 H new ATOM 0 HB3 LEU A 6 -0.493 -9.770 -7.177 1.00 32.10 H new ATOM 0 HG LEU A 6 -0.477 -10.518 -9.569 1.00 54.03 H new ATOM 0 HD11 LEU A 6 1.676 -11.706 -9.411 1.00 3.12 H new ATOM 0 HD12 LEU A 6 1.595 -10.334 -8.280 1.00 3.12 H new ATOM 0 HD13 LEU A 6 1.384 -11.996 -7.679 1.00 3.12 H new ATOM 0 HD21 LEU A 6 -0.372 -12.935 -10.031 1.00 3.30 H new ATOM 0 HD22 LEU A 6 -0.744 -13.273 -8.323 1.00 3.30 H new ATOM 0 HD23 LEU A 6 -1.947 -12.460 -9.351 1.00 3.30 H new ATOM 109 N VAL A 7 -0.545 -11.359 -3.968 1.00 23.23 N ATOM 110 CA VAL A 7 -0.583 -10.709 -2.667 1.00 22.42 C ATOM 111 C VAL A 7 0.423 -9.567 -2.596 1.00 63.54 C ATOM 112 O VAL A 7 1.622 -9.791 -2.429 1.00 73.43 O ATOM 113 CB VAL A 7 -0.288 -11.711 -1.537 1.00 22.24 C ATOM 114 CG1 VAL A 7 -0.472 -11.056 -0.179 1.00 32.10 C ATOM 115 CG2 VAL A 7 -1.175 -12.941 -1.668 1.00 42.45 C ATOM 0 H VAL A 7 0.020 -12.207 -3.999 1.00 23.23 H new ATOM 0 HA VAL A 7 -1.589 -10.310 -2.537 1.00 22.42 H new ATOM 0 HB VAL A 7 0.751 -12.029 -1.622 1.00 22.24 H new ATOM 0 HG11 VAL A 7 -0.259 -11.781 0.607 1.00 32.10 H new ATOM 0 HG12 VAL A 7 0.210 -10.211 -0.087 1.00 32.10 H new ATOM 0 HG13 VAL A 7 -1.499 -10.706 -0.080 1.00 32.10 H new ATOM 0 HG21 VAL A 7 -0.952 -13.638 -0.860 1.00 42.45 H new ATOM 0 HG22 VAL A 7 -2.222 -12.642 -1.611 1.00 42.45 H new ATOM 0 HG23 VAL A 7 -0.987 -13.425 -2.627 1.00 42.45 H new ATOM 125 N VAL A 8 -0.070 -8.340 -2.725 1.00 61.21 N ATOM 126 CA VAL A 8 0.785 -7.165 -2.677 1.00 5.31 C ATOM 127 C VAL A 8 0.902 -6.626 -1.254 1.00 50.23 C ATOM 128 O VAL A 8 -0.081 -6.569 -0.517 1.00 0.31 O ATOM 129 CB VAL A 8 0.248 -6.052 -3.597 1.00 72.25 C ATOM 130 CG1 VAL A 8 1.168 -4.844 -3.572 1.00 15.32 C ATOM 131 CG2 VAL A 8 0.077 -6.570 -5.017 1.00 22.11 C ATOM 0 H VAL A 8 -1.060 -8.136 -2.864 1.00 61.21 H new ATOM 0 HA VAL A 8 1.772 -7.472 -3.024 1.00 5.31 H new ATOM 0 HB VAL A 8 -0.729 -5.742 -3.226 1.00 72.25 H new ATOM 0 HG11 VAL A 8 0.770 -4.070 -4.228 1.00 15.32 H new ATOM 0 HG12 VAL A 8 1.234 -4.458 -2.555 1.00 15.32 H new ATOM 0 HG13 VAL A 8 2.161 -5.136 -3.915 1.00 15.32 H new ATOM 0 HG21 VAL A 8 -0.303 -5.770 -5.653 1.00 22.11 H new ATOM 0 HG22 VAL A 8 1.040 -6.910 -5.399 1.00 22.11 H new ATOM 0 HG23 VAL A 8 -0.628 -7.401 -5.019 1.00 22.11 H new ATOM 141 N VAL A 9 2.114 -6.227 -0.879 1.00 60.11 N ATOM 142 CA VAL A 9 2.363 -5.688 0.451 1.00 23.12 C ATOM 143 C VAL A 9 3.011 -4.309 0.367 1.00 31.31 C ATOM 144 O VAL A 9 3.427 -3.876 -0.708 1.00 43.13 O ATOM 145 CB VAL A 9 3.271 -6.621 1.277 1.00 43.44 C ATOM 146 CG1 VAL A 9 2.594 -7.964 1.503 1.00 14.51 C ATOM 147 CG2 VAL A 9 4.618 -6.803 0.592 1.00 24.11 C ATOM 0 H VAL A 9 2.938 -6.267 -1.479 1.00 60.11 H new ATOM 0 HA VAL A 9 1.396 -5.606 0.947 1.00 23.12 H new ATOM 0 HB VAL A 9 3.444 -6.159 2.249 1.00 43.44 H new ATOM 0 HG11 VAL A 9 3.250 -8.609 2.088 1.00 14.51 H new ATOM 0 HG12 VAL A 9 1.659 -7.814 2.042 1.00 14.51 H new ATOM 0 HG13 VAL A 9 2.387 -8.434 0.541 1.00 14.51 H new ATOM 0 HG21 VAL A 9 5.244 -7.465 1.191 1.00 24.11 H new ATOM 0 HG22 VAL A 9 4.468 -7.240 -0.395 1.00 24.11 H new ATOM 0 HG23 VAL A 9 5.108 -5.835 0.489 1.00 24.11 H new ATOM 157 N GLY A 10 3.090 -3.623 1.502 1.00 23.40 N ATOM 158 CA GLY A 10 3.687 -2.302 1.525 1.00 42.12 C ATOM 159 C GLY A 10 4.088 -1.866 2.919 1.00 13.21 C ATOM 160 O GLY A 10 3.545 -2.355 3.911 1.00 11.34 O ATOM 0 H GLY A 10 2.752 -3.958 2.404 1.00 23.40 H new ATOM 0 HA2 GLY A 10 4.565 -2.293 0.879 1.00 42.12 H new ATOM 0 HA3 GLY A 10 2.981 -1.581 1.112 1.00 42.12 H new ATOM 164 N ALA A 11 5.040 -0.943 2.997 1.00 14.12 N ATOM 165 CA ALA A 11 5.514 -0.439 4.279 1.00 0.41 C ATOM 166 C ALA A 11 4.802 0.856 4.661 1.00 40.03 C ATOM 167 O ALA A 11 5.292 1.622 5.491 1.00 21.24 O ATOM 168 CB ALA A 11 7.019 -0.220 4.235 1.00 72.31 C ATOM 0 H ALA A 11 5.499 -0.528 2.186 1.00 14.12 H new ATOM 0 HA ALA A 11 5.286 -1.186 5.040 1.00 0.41 H new ATOM 0 HB1 ALA A 11 7.360 0.157 5.199 1.00 72.31 H new ATOM 0 HB2 ALA A 11 7.518 -1.164 4.017 1.00 72.31 H new ATOM 0 HB3 ALA A 11 7.259 0.505 3.457 1.00 72.31 H new ATOM 174 N GLY A 12 3.640 1.093 4.058 1.00 51.14 N ATOM 175 CA GLY A 12 2.883 2.293 4.356 1.00 11.21 C ATOM 176 C GLY A 12 3.427 3.523 3.655 1.00 24.14 C ATOM 177 O GLY A 12 3.456 4.609 4.234 1.00 50.13 O ATOM 0 H GLY A 12 3.211 0.475 3.369 1.00 51.14 H new ATOM 0 HA2 GLY A 12 1.844 2.143 4.062 1.00 11.21 H new ATOM 0 HA3 GLY A 12 2.889 2.462 5.433 1.00 11.21 H new ATOM 181 N GLY A 13 3.854 3.360 2.406 1.00 42.31 N ATOM 182 CA GLY A 13 4.386 4.484 1.657 1.00 2.12 C ATOM 183 C GLY A 13 5.445 4.079 0.649 1.00 30.24 C ATOM 184 O GLY A 13 6.472 4.748 0.521 1.00 43.51 O ATOM 0 H GLY A 13 3.841 2.474 1.901 1.00 42.31 H new ATOM 0 HA2 GLY A 13 3.570 4.985 1.136 1.00 2.12 H new ATOM 0 HA3 GLY A 13 4.812 5.207 2.352 1.00 2.12 H new ATOM 188 N VAL A 14 5.198 2.991 -0.072 1.00 15.30 N ATOM 189 CA VAL A 14 6.144 2.512 -1.076 1.00 50.33 C ATOM 190 C VAL A 14 5.583 2.673 -2.487 1.00 52.54 C ATOM 191 O VAL A 14 6.335 2.832 -3.449 1.00 31.05 O ATOM 192 CB VAL A 14 6.520 1.035 -0.845 1.00 61.15 C ATOM 193 CG1 VAL A 14 7.197 0.862 0.505 1.00 4.11 C ATOM 194 CG2 VAL A 14 5.293 0.144 -0.952 1.00 30.44 C ATOM 0 H VAL A 14 4.354 2.425 0.019 1.00 15.30 H new ATOM 0 HA VAL A 14 7.041 3.122 -0.975 1.00 50.33 H new ATOM 0 HB VAL A 14 7.224 0.735 -1.621 1.00 61.15 H new ATOM 0 HG11 VAL A 14 7.455 -0.187 0.651 1.00 4.11 H new ATOM 0 HG12 VAL A 14 8.103 1.467 0.538 1.00 4.11 H new ATOM 0 HG13 VAL A 14 6.519 1.182 1.296 1.00 4.11 H new ATOM 0 HG21 VAL A 14 5.581 -0.894 -0.786 1.00 30.44 H new ATOM 0 HG22 VAL A 14 4.561 0.442 -0.202 1.00 30.44 H new ATOM 0 HG23 VAL A 14 4.856 0.244 -1.946 1.00 30.44 H new ATOM 204 N GLY A 15 4.259 2.635 -2.605 1.00 10.01 N ATOM 205 CA GLY A 15 3.624 2.782 -3.903 1.00 34.21 C ATOM 206 C GLY A 15 3.168 1.458 -4.486 1.00 42.50 C ATOM 207 O GLY A 15 2.989 1.338 -5.699 1.00 74.11 O ATOM 0 H GLY A 15 3.614 2.505 -1.825 1.00 10.01 H new ATOM 0 HA2 GLY A 15 2.766 3.448 -3.810 1.00 34.21 H new ATOM 0 HA3 GLY A 15 4.322 3.257 -4.593 1.00 34.21 H new ATOM 211 N LYS A 16 2.982 0.461 -3.626 1.00 51.00 N ATOM 212 CA LYS A 16 2.545 -0.858 -4.071 1.00 3.02 C ATOM 213 C LYS A 16 1.108 -0.816 -4.587 1.00 20.03 C ATOM 214 O LYS A 16 0.728 -1.597 -5.460 1.00 14.02 O ATOM 215 CB LYS A 16 2.675 -1.876 -2.929 1.00 73.34 C ATOM 216 CG LYS A 16 1.533 -1.839 -1.919 1.00 4.23 C ATOM 217 CD LYS A 16 1.596 -0.601 -1.038 1.00 63.41 C ATOM 218 CE LYS A 16 0.449 -0.570 -0.039 1.00 62.41 C ATOM 219 NZ LYS A 16 0.489 -1.730 0.896 1.00 54.13 N ATOM 0 H LYS A 16 3.127 0.541 -2.619 1.00 51.00 H new ATOM 0 HA LYS A 16 3.189 -1.169 -4.894 1.00 3.02 H new ATOM 0 HB2 LYS A 16 2.734 -2.877 -3.356 1.00 73.34 H new ATOM 0 HB3 LYS A 16 3.614 -1.697 -2.404 1.00 73.34 H new ATOM 0 HG2 LYS A 16 0.580 -1.861 -2.447 1.00 4.23 H new ATOM 0 HG3 LYS A 16 1.571 -2.732 -1.294 1.00 4.23 H new ATOM 0 HD2 LYS A 16 2.546 -0.581 -0.504 1.00 63.41 H new ATOM 0 HD3 LYS A 16 1.562 0.293 -1.661 1.00 63.41 H new ATOM 0 HE2 LYS A 16 0.491 0.357 0.532 1.00 62.41 H new ATOM 0 HE3 LYS A 16 -0.499 -0.570 -0.576 1.00 62.41 H new ATOM 0 HZ1 LYS A 16 -0.458 -2.154 0.964 1.00 54.13 H new ATOM 0 HZ2 LYS A 16 1.161 -2.439 0.541 1.00 54.13 H new ATOM 0 HZ3 LYS A 16 0.792 -1.407 1.837 1.00 54.13 H new ATOM 233 N SER A 17 0.313 0.096 -4.036 1.00 22.42 N ATOM 234 CA SER A 17 -1.082 0.236 -4.435 1.00 64.35 C ATOM 235 C SER A 17 -1.202 0.981 -5.760 1.00 1.44 C ATOM 236 O SER A 17 -2.094 0.702 -6.562 1.00 22.55 O ATOM 237 CB SER A 17 -1.871 0.974 -3.349 1.00 14.13 C ATOM 238 OG SER A 17 -1.073 1.959 -2.710 1.00 54.12 O ATOM 0 H SER A 17 0.612 0.749 -3.312 1.00 22.42 H new ATOM 0 HA SER A 17 -1.497 -0.763 -4.565 1.00 64.35 H new ATOM 0 HB2 SER A 17 -2.749 1.445 -3.791 1.00 14.13 H new ATOM 0 HB3 SER A 17 -2.231 0.259 -2.609 1.00 14.13 H new ATOM 0 HG SER A 17 -1.603 2.415 -2.023 1.00 54.12 H new ATOM 244 N ALA A 18 -0.301 1.931 -5.982 1.00 31.43 N ATOM 245 CA ALA A 18 -0.310 2.718 -7.209 1.00 23.12 C ATOM 246 C ALA A 18 0.059 1.865 -8.419 1.00 53.34 C ATOM 247 O ALA A 18 -0.370 2.145 -9.539 1.00 74.41 O ATOM 248 CB ALA A 18 0.642 3.900 -7.084 1.00 34.22 C ATOM 0 H ALA A 18 0.444 2.175 -5.329 1.00 31.43 H new ATOM 0 HA ALA A 18 -1.322 3.092 -7.361 1.00 23.12 H new ATOM 0 HB1 ALA A 18 0.626 4.479 -8.007 1.00 34.22 H new ATOM 0 HB2 ALA A 18 0.330 4.532 -6.253 1.00 34.22 H new ATOM 0 HB3 ALA A 18 1.653 3.535 -6.902 1.00 34.22 H new ATOM 254 N LEU A 19 0.855 0.825 -8.190 1.00 1.20 N ATOM 255 CA LEU A 19 1.278 -0.063 -9.266 1.00 54.25 C ATOM 256 C LEU A 19 0.142 -0.991 -9.687 1.00 61.10 C ATOM 257 O LEU A 19 -0.055 -1.249 -10.874 1.00 63.33 O ATOM 258 CB LEU A 19 2.492 -0.887 -8.832 1.00 2.23 C ATOM 259 CG LEU A 19 3.816 -0.122 -8.804 1.00 52.43 C ATOM 260 CD1 LEU A 19 4.924 -0.991 -8.229 1.00 71.45 C ATOM 261 CD2 LEU A 19 4.182 0.357 -10.201 1.00 10.31 C ATOM 0 H LEU A 19 1.219 0.577 -7.270 1.00 1.20 H new ATOM 0 HA LEU A 19 1.555 0.553 -10.121 1.00 54.25 H new ATOM 0 HB2 LEU A 19 2.302 -1.290 -7.837 1.00 2.23 H new ATOM 0 HB3 LEU A 19 2.595 -1.737 -9.506 1.00 2.23 H new ATOM 0 HG LEU A 19 3.697 0.750 -8.161 1.00 52.43 H new ATOM 0 HD11 LEU A 19 5.858 -0.429 -8.217 1.00 71.45 H new ATOM 0 HD12 LEU A 19 4.665 -1.285 -7.212 1.00 71.45 H new ATOM 0 HD13 LEU A 19 5.044 -1.882 -8.845 1.00 71.45 H new ATOM 0 HD21 LEU A 19 5.127 0.900 -10.164 1.00 10.31 H new ATOM 0 HD22 LEU A 19 4.282 -0.501 -10.865 1.00 10.31 H new ATOM 0 HD23 LEU A 19 3.399 1.016 -10.576 1.00 10.31 H new ATOM 273 N THR A 20 -0.603 -1.491 -8.706 1.00 53.24 N ATOM 274 CA THR A 20 -1.719 -2.390 -8.976 1.00 73.14 C ATOM 275 C THR A 20 -2.736 -1.731 -9.904 1.00 73.14 C ATOM 276 O THR A 20 -3.041 -2.251 -10.977 1.00 24.13 O ATOM 277 CB THR A 20 -2.396 -2.805 -7.669 1.00 33.12 C ATOM 278 OG1 THR A 20 -1.480 -3.481 -6.825 1.00 1.55 O ATOM 279 CG2 THR A 20 -3.590 -3.712 -7.873 1.00 24.33 C ATOM 0 H THR A 20 -0.454 -1.289 -7.717 1.00 53.24 H new ATOM 0 HA THR A 20 -1.326 -3.279 -9.470 1.00 73.14 H new ATOM 0 HB THR A 20 -2.742 -1.877 -7.215 1.00 33.12 H new ATOM 0 HG1 THR A 20 -0.852 -2.835 -6.439 1.00 1.55 H new ATOM 0 HG21 THR A 20 -4.022 -3.968 -6.906 1.00 24.33 H new ATOM 0 HG22 THR A 20 -4.337 -3.200 -8.480 1.00 24.33 H new ATOM 0 HG23 THR A 20 -3.273 -4.623 -8.381 1.00 24.33 H new ATOM 287 N ILE A 21 -3.256 -0.582 -9.484 1.00 74.13 N ATOM 288 CA ILE A 21 -4.227 0.151 -10.267 1.00 33.23 C ATOM 289 C ILE A 21 -3.647 0.541 -11.624 1.00 13.11 C ATOM 290 O ILE A 21 -4.335 0.486 -12.643 1.00 74.44 O ATOM 291 CB ILE A 21 -4.679 1.411 -9.507 1.00 11.43 C ATOM 292 CG1 ILE A 21 -5.448 1.021 -8.243 1.00 14.20 C ATOM 293 CG2 ILE A 21 -5.529 2.296 -10.393 1.00 73.21 C ATOM 294 CD1 ILE A 21 -5.078 1.848 -7.033 1.00 23.14 C ATOM 0 H ILE A 21 -3.014 -0.141 -8.597 1.00 74.13 H new ATOM 0 HA ILE A 21 -5.089 -0.495 -10.433 1.00 33.23 H new ATOM 0 HB ILE A 21 -3.792 1.974 -9.216 1.00 11.43 H new ATOM 0 HG12 ILE A 21 -6.517 1.124 -8.431 1.00 14.20 H new ATOM 0 HG13 ILE A 21 -5.263 -0.031 -8.025 1.00 14.20 H new ATOM 0 HG21 ILE A 21 -5.837 3.180 -9.835 1.00 73.21 H new ATOM 0 HG22 ILE A 21 -4.951 2.600 -11.265 1.00 73.21 H new ATOM 0 HG23 ILE A 21 -6.412 1.745 -10.717 1.00 73.21 H new ATOM 0 HD11 ILE A 21 -5.661 1.517 -6.174 1.00 23.14 H new ATOM 0 HD12 ILE A 21 -4.016 1.726 -6.819 1.00 23.14 H new ATOM 0 HD13 ILE A 21 -5.289 2.899 -7.232 1.00 23.14 H new ATOM 306 N GLN A 22 -2.378 0.930 -11.628 1.00 40.32 N ATOM 307 CA GLN A 22 -1.704 1.325 -12.860 1.00 44.23 C ATOM 308 C GLN A 22 -1.699 0.176 -13.864 1.00 41.10 C ATOM 309 O GLN A 22 -1.815 0.392 -15.071 1.00 23.34 O ATOM 310 CB GLN A 22 -0.271 1.769 -12.565 1.00 11.31 C ATOM 311 CG GLN A 22 -0.142 3.258 -12.287 1.00 74.20 C ATOM 312 CD GLN A 22 -0.614 4.110 -13.449 1.00 11.41 C ATOM 313 OE1 GLN A 22 -0.702 3.640 -14.584 1.00 41.33 O ATOM 314 NE2 GLN A 22 -0.921 5.372 -13.172 1.00 70.21 N ATOM 0 H GLN A 22 -1.795 0.981 -10.793 1.00 40.32 H new ATOM 0 HA GLN A 22 -2.251 2.163 -13.293 1.00 44.23 H new ATOM 0 HB2 GLN A 22 0.103 1.213 -11.705 1.00 11.31 H new ATOM 0 HB3 GLN A 22 0.363 1.510 -13.413 1.00 11.31 H new ATOM 0 HG2 GLN A 22 -0.720 3.510 -11.398 1.00 74.20 H new ATOM 0 HG3 GLN A 22 0.899 3.494 -12.067 1.00 74.20 H new ATOM 0 HE21 GLN A 22 -0.834 5.720 -12.217 1.00 70.21 H new ATOM 0 HE22 GLN A 22 -1.244 5.993 -13.914 1.00 70.21 H new ATOM 323 N LEU A 23 -1.565 -1.045 -13.358 1.00 64.00 N ATOM 324 CA LEU A 23 -1.548 -2.229 -14.210 1.00 23.03 C ATOM 325 C LEU A 23 -2.934 -2.506 -14.787 1.00 23.41 C ATOM 326 O LEU A 23 -3.064 -3.122 -15.845 1.00 43.10 O ATOM 327 CB LEU A 23 -1.055 -3.443 -13.419 1.00 33.53 C ATOM 328 CG LEU A 23 -0.812 -4.712 -14.243 1.00 34.41 C ATOM 329 CD1 LEU A 23 -2.126 -5.418 -14.540 1.00 41.50 C ATOM 330 CD2 LEU A 23 -0.076 -4.384 -15.534 1.00 35.21 C ATOM 0 H LEU A 23 -1.467 -1.241 -12.362 1.00 64.00 H new ATOM 0 HA LEU A 23 -0.864 -2.042 -15.038 1.00 23.03 H new ATOM 0 HB2 LEU A 23 -0.126 -3.174 -12.916 1.00 33.53 H new ATOM 0 HB3 LEU A 23 -1.785 -3.669 -12.642 1.00 33.53 H new ATOM 0 HG LEU A 23 -0.187 -5.384 -13.656 1.00 34.41 H new ATOM 0 HD11 LEU A 23 -1.932 -6.316 -15.126 1.00 41.50 H new ATOM 0 HD12 LEU A 23 -2.611 -5.693 -13.603 1.00 41.50 H new ATOM 0 HD13 LEU A 23 -2.778 -4.751 -15.104 1.00 41.50 H new ATOM 0 HD21 LEU A 23 0.086 -5.299 -16.103 1.00 35.21 H new ATOM 0 HD22 LEU A 23 -0.672 -3.689 -16.126 1.00 35.21 H new ATOM 0 HD23 LEU A 23 0.886 -3.928 -15.299 1.00 35.21 H new ATOM 342 N ILE A 24 -3.967 -2.048 -14.085 1.00 55.23 N ATOM 343 CA ILE A 24 -5.342 -2.247 -14.526 1.00 11.10 C ATOM 344 C ILE A 24 -5.944 -0.943 -15.050 1.00 2.13 C ATOM 345 O ILE A 24 -6.026 -0.725 -16.259 1.00 70.21 O ATOM 346 CB ILE A 24 -6.220 -2.802 -13.378 1.00 52.12 C ATOM 347 CG1 ILE A 24 -5.923 -4.287 -13.155 1.00 0.13 C ATOM 348 CG2 ILE A 24 -7.704 -2.597 -13.668 1.00 11.51 C ATOM 349 CD1 ILE A 24 -4.933 -4.546 -12.041 1.00 11.40 C ATOM 0 H ILE A 24 -3.876 -1.536 -13.207 1.00 55.23 H new ATOM 0 HA ILE A 24 -5.322 -2.976 -15.336 1.00 11.10 H new ATOM 0 HB ILE A 24 -5.976 -2.251 -12.470 1.00 52.12 H new ATOM 0 HG12 ILE A 24 -6.855 -4.805 -12.929 1.00 0.13 H new ATOM 0 HG13 ILE A 24 -5.536 -4.715 -14.080 1.00 0.13 H new ATOM 0 HG21 ILE A 24 -8.294 -2.997 -12.844 1.00 11.51 H new ATOM 0 HG22 ILE A 24 -7.909 -1.532 -13.778 1.00 11.51 H new ATOM 0 HG23 ILE A 24 -7.970 -3.115 -14.589 1.00 11.51 H new ATOM 0 HD11 ILE A 24 -4.771 -5.619 -11.940 1.00 11.40 H new ATOM 0 HD12 ILE A 24 -3.987 -4.057 -12.274 1.00 11.40 H new ATOM 0 HD13 ILE A 24 -5.326 -4.149 -11.105 1.00 11.40 H new ATOM 361 N GLN A 25 -6.367 -0.083 -14.130 1.00 62.33 N ATOM 362 CA GLN A 25 -6.970 1.195 -14.489 1.00 4.41 C ATOM 363 C GLN A 25 -5.997 2.066 -15.278 1.00 43.44 C ATOM 364 O GLN A 25 -6.399 2.809 -16.174 1.00 24.23 O ATOM 365 CB GLN A 25 -7.424 1.928 -13.232 1.00 54.15 C ATOM 366 CG GLN A 25 -8.338 1.096 -12.362 1.00 4.31 C ATOM 367 CD GLN A 25 -9.204 1.942 -11.461 1.00 30.34 C ATOM 368 OE1 GLN A 25 -9.413 3.128 -11.710 1.00 45.31 O ATOM 369 NE2 GLN A 25 -9.710 1.329 -10.408 1.00 64.33 N ATOM 0 H GLN A 25 -6.303 -0.249 -13.126 1.00 62.33 H new ATOM 0 HA GLN A 25 -7.833 0.994 -15.123 1.00 4.41 H new ATOM 0 HB2 GLN A 25 -6.548 2.222 -12.653 1.00 54.15 H new ATOM 0 HB3 GLN A 25 -7.939 2.845 -13.519 1.00 54.15 H new ATOM 0 HG2 GLN A 25 -8.974 0.477 -12.995 1.00 4.31 H new ATOM 0 HG3 GLN A 25 -7.738 0.419 -11.754 1.00 4.31 H new ATOM 0 HE21 GLN A 25 -9.507 0.343 -10.245 1.00 64.33 H new ATOM 0 HE22 GLN A 25 -10.305 1.841 -9.756 1.00 64.33 H new ATOM 378 N ASN A 26 -4.714 1.969 -14.939 1.00 73.02 N ATOM 379 CA ASN A 26 -3.681 2.751 -15.614 1.00 4.14 C ATOM 380 C ASN A 26 -3.830 4.236 -15.297 1.00 74.41 C ATOM 381 O ASN A 26 -3.585 5.089 -16.149 1.00 64.34 O ATOM 382 CB ASN A 26 -3.745 2.533 -17.130 1.00 50.22 C ATOM 383 CG ASN A 26 -4.021 1.089 -17.502 1.00 35.01 C ATOM 384 OD1 ASN A 26 -4.833 0.890 -18.534 1.00 31.41 O flip ATOM 385 ND2 ASN A 26 -3.512 0.165 -16.869 1.00 24.30 N flip ATOM 0 H ASN A 26 -4.365 1.357 -14.201 1.00 73.02 H new ATOM 0 HA ASN A 26 -2.712 2.412 -15.249 1.00 4.14 H new ATOM 0 HB2 ASN A 26 -4.524 3.168 -17.552 1.00 50.22 H new ATOM 0 HB3 ASN A 26 -2.802 2.846 -17.578 1.00 50.22 H new ATOM 0 HD21 ASN A 26 -2.894 0.365 -16.083 1.00 24.30 H new ATOM 0 HD22 ASN A 26 -3.708 -0.801 -17.130 1.00 24.30 H new ATOM 588 N TYR A 40 -7.972 -5.778 -7.518 1.00 63.25 N ATOM 589 CA TYR A 40 -8.120 -5.674 -8.966 1.00 21.32 C ATOM 590 C TYR A 40 -7.615 -6.937 -9.656 1.00 64.51 C ATOM 591 O TYR A 40 -6.480 -7.361 -9.442 1.00 60.23 O ATOM 592 CB TYR A 40 -7.359 -4.454 -9.492 1.00 52.44 C ATOM 593 CG TYR A 40 -7.511 -3.225 -8.625 1.00 4.35 C ATOM 594 CD1 TYR A 40 -6.751 -3.067 -7.474 1.00 71.34 C ATOM 595 CD2 TYR A 40 -8.416 -2.225 -8.956 1.00 53.11 C ATOM 596 CE1 TYR A 40 -6.886 -1.947 -6.677 1.00 0.43 C ATOM 597 CE2 TYR A 40 -8.558 -1.101 -8.165 1.00 73.45 C ATOM 598 CZ TYR A 40 -7.791 -0.967 -7.027 1.00 21.21 C ATOM 599 OH TYR A 40 -7.930 0.151 -6.236 1.00 32.05 O ATOM 0 HA TYR A 40 -9.180 -5.557 -9.190 1.00 21.32 H new ATOM 0 HB2 TYR A 40 -6.301 -4.703 -9.572 1.00 52.44 H new ATOM 0 HB3 TYR A 40 -7.709 -4.224 -10.498 1.00 52.44 H new ATOM 0 HD1 TYR A 40 -6.042 -3.833 -7.197 1.00 71.34 H new ATOM 0 HD2 TYR A 40 -9.019 -2.328 -9.846 1.00 53.11 H new ATOM 0 HE1 TYR A 40 -6.286 -1.839 -5.785 1.00 0.43 H new ATOM 0 HE2 TYR A 40 -9.266 -0.332 -8.437 1.00 73.45 H new ATOM 0 HH TYR A 40 -8.608 0.744 -6.623 1.00 32.05 H new ATOM 609 N ARG A 41 -8.465 -7.533 -10.486 1.00 73.41 N ATOM 610 CA ARG A 41 -8.102 -8.747 -11.207 1.00 2.25 C ATOM 611 C ARG A 41 -8.110 -8.509 -12.713 1.00 71.24 C ATOM 612 O ARG A 41 -9.156 -8.246 -13.306 1.00 52.43 O ATOM 613 CB ARG A 41 -9.062 -9.886 -10.854 1.00 12.11 C ATOM 614 CG ARG A 41 -10.512 -9.595 -11.204 1.00 3.53 C ATOM 615 CD ARG A 41 -11.466 -10.449 -10.385 1.00 3.13 C ATOM 616 NE ARG A 41 -12.780 -10.561 -11.013 1.00 14.43 N ATOM 617 CZ ARG A 41 -13.668 -11.506 -10.713 1.00 30.25 C ATOM 618 NH1 ARG A 41 -13.389 -12.420 -9.793 1.00 1.20 N ATOM 619 NH2 ARG A 41 -14.839 -11.535 -11.334 1.00 71.52 N ATOM 0 H ARG A 41 -9.409 -7.195 -10.676 1.00 73.41 H new ATOM 0 HA ARG A 41 -7.093 -9.027 -10.906 1.00 2.25 H new ATOM 0 HB2 ARG A 41 -8.746 -10.790 -11.375 1.00 12.11 H new ATOM 0 HB3 ARG A 41 -8.990 -10.092 -9.786 1.00 12.11 H new ATOM 0 HG2 ARG A 41 -10.725 -8.540 -11.029 1.00 3.53 H new ATOM 0 HG3 ARG A 41 -10.675 -9.781 -12.265 1.00 3.53 H new ATOM 0 HD2 ARG A 41 -11.041 -11.444 -10.255 1.00 3.13 H new ATOM 0 HD3 ARG A 41 -11.576 -10.017 -9.390 1.00 3.13 H new ATOM 0 HE ARG A 41 -13.032 -9.874 -11.724 1.00 14.43 H new ATOM 0 HH11 ARG A 41 -12.490 -12.401 -9.311 1.00 1.20 H new ATOM 0 HH12 ARG A 41 -14.073 -13.142 -9.567 1.00 1.20 H new ATOM 0 HH21 ARG A 41 -15.059 -10.833 -12.041 1.00 71.52 H new ATOM 0 HH22 ARG A 41 -15.520 -12.259 -11.105 1.00 71.52 H new ATOM 633 N LYS A 42 -6.934 -8.603 -13.327 1.00 51.24 N ATOM 634 CA LYS A 42 -6.802 -8.398 -14.765 1.00 34.21 C ATOM 635 C LYS A 42 -6.479 -9.708 -15.475 1.00 42.24 C ATOM 636 O LYS A 42 -5.793 -10.570 -14.926 1.00 61.02 O ATOM 637 CB LYS A 42 -5.711 -7.366 -15.055 1.00 73.34 C ATOM 638 CG LYS A 42 -5.984 -6.521 -16.288 1.00 63.41 C ATOM 639 CD LYS A 42 -4.710 -5.883 -16.819 1.00 62.31 C ATOM 640 CE LYS A 42 -4.959 -5.146 -18.125 1.00 2.22 C ATOM 641 NZ LYS A 42 -3.687 -4.780 -18.807 1.00 55.52 N ATOM 0 H LYS A 42 -6.059 -8.820 -12.850 1.00 51.24 H new ATOM 0 HA LYS A 42 -7.755 -8.027 -15.142 1.00 34.21 H new ATOM 0 HB2 LYS A 42 -5.605 -6.710 -14.191 1.00 73.34 H new ATOM 0 HB3 LYS A 42 -4.759 -7.882 -15.182 1.00 73.34 H new ATOM 0 HG2 LYS A 42 -6.432 -7.142 -17.064 1.00 63.41 H new ATOM 0 HG3 LYS A 42 -6.708 -5.743 -16.044 1.00 63.41 H new ATOM 0 HD2 LYS A 42 -4.313 -5.189 -16.078 1.00 62.31 H new ATOM 0 HD3 LYS A 42 -3.953 -6.652 -16.973 1.00 62.31 H new ATOM 0 HE2 LYS A 42 -5.559 -5.772 -18.786 1.00 2.22 H new ATOM 0 HE3 LYS A 42 -5.538 -4.244 -17.928 1.00 2.22 H new ATOM 0 HZ1 LYS A 42 -3.900 -4.279 -19.693 1.00 55.52 H new ATOM 0 HZ2 LYS A 42 -3.126 -4.162 -18.187 1.00 55.52 H new ATOM 0 HZ3 LYS A 42 -3.146 -5.643 -19.018 1.00 55.52 H new ATOM 655 N GLN A 43 -6.978 -9.851 -16.699 1.00 62.44 N ATOM 656 CA GLN A 43 -6.743 -11.056 -17.486 1.00 20.31 C ATOM 657 C GLN A 43 -5.642 -10.822 -18.517 1.00 62.31 C ATOM 658 O GLN A 43 -5.746 -9.929 -19.359 1.00 71.01 O ATOM 659 CB GLN A 43 -8.034 -11.494 -18.182 1.00 43.35 C ATOM 660 CG GLN A 43 -7.852 -12.663 -19.138 1.00 73.33 C ATOM 661 CD GLN A 43 -9.153 -13.094 -19.784 1.00 3.22 C ATOM 662 OE1 GLN A 43 -9.343 -14.402 -19.915 1.00 70.11 O flip ATOM 663 NE2 GLN A 43 -9.978 -12.263 -20.162 1.00 42.43 N flip ATOM 0 H GLN A 43 -7.548 -9.147 -17.167 1.00 62.44 H new ATOM 0 HA GLN A 43 -6.419 -11.848 -16.811 1.00 20.31 H new ATOM 0 HB2 GLN A 43 -8.769 -11.767 -17.425 1.00 43.35 H new ATOM 0 HB3 GLN A 43 -8.444 -10.647 -18.733 1.00 43.35 H new ATOM 0 HG2 GLN A 43 -7.139 -12.385 -19.915 1.00 73.33 H new ATOM 0 HG3 GLN A 43 -7.422 -13.506 -18.598 1.00 73.33 H new ATOM 0 HE21 GLN A 43 -9.791 -11.268 -20.042 1.00 42.43 H new ATOM 0 HE22 GLN A 43 -10.849 -12.570 -20.596 1.00 42.43 H new ATOM 672 N VAL A 44 -4.590 -11.629 -18.444 1.00 30.31 N ATOM 673 CA VAL A 44 -3.470 -11.509 -19.369 1.00 41.25 C ATOM 674 C VAL A 44 -3.004 -12.880 -19.849 1.00 21.53 C ATOM 675 O VAL A 44 -3.587 -13.905 -19.496 1.00 52.43 O ATOM 676 CB VAL A 44 -2.283 -10.769 -18.721 1.00 0.14 C ATOM 677 CG1 VAL A 44 -2.705 -9.380 -18.268 1.00 40.34 C ATOM 678 CG2 VAL A 44 -1.723 -11.569 -17.552 1.00 41.23 C ATOM 0 H VAL A 44 -4.489 -12.373 -17.754 1.00 30.31 H new ATOM 0 HA VAL A 44 -3.824 -10.931 -20.223 1.00 41.25 H new ATOM 0 HB VAL A 44 -1.496 -10.663 -19.468 1.00 0.14 H new ATOM 0 HG11 VAL A 44 -1.855 -8.872 -17.813 1.00 40.34 H new ATOM 0 HG12 VAL A 44 -3.053 -8.807 -19.128 1.00 40.34 H new ATOM 0 HG13 VAL A 44 -3.510 -9.464 -17.538 1.00 40.34 H new ATOM 0 HG21 VAL A 44 -0.886 -11.029 -17.109 1.00 41.23 H new ATOM 0 HG22 VAL A 44 -2.501 -11.711 -16.802 1.00 41.23 H new ATOM 0 HG23 VAL A 44 -1.380 -12.541 -17.907 1.00 41.23 H new ATOM 688 N VAL A 45 -1.947 -12.891 -20.654 1.00 42.24 N ATOM 689 CA VAL A 45 -1.401 -14.136 -21.181 1.00 2.51 C ATOM 690 C VAL A 45 0.064 -14.301 -20.787 1.00 61.23 C ATOM 691 O VAL A 45 0.953 -13.703 -21.395 1.00 4.14 O ATOM 692 CB VAL A 45 -1.519 -14.195 -22.716 1.00 43.41 C ATOM 693 CG1 VAL A 45 -1.074 -15.554 -23.237 1.00 54.34 C ATOM 694 CG2 VAL A 45 -2.943 -13.890 -23.154 1.00 62.53 C ATOM 0 H VAL A 45 -1.452 -12.052 -20.956 1.00 42.24 H new ATOM 0 HA VAL A 45 -1.985 -14.948 -20.749 1.00 2.51 H new ATOM 0 HB VAL A 45 -0.861 -13.437 -23.140 1.00 43.41 H new ATOM 0 HG11 VAL A 45 -1.165 -15.575 -24.323 1.00 54.34 H new ATOM 0 HG12 VAL A 45 -0.035 -15.729 -22.956 1.00 54.34 H new ATOM 0 HG13 VAL A 45 -1.703 -16.333 -22.805 1.00 54.34 H new ATOM 0 HG21 VAL A 45 -3.007 -13.936 -24.241 1.00 62.53 H new ATOM 0 HG22 VAL A 45 -3.622 -14.623 -22.719 1.00 62.53 H new ATOM 0 HG23 VAL A 45 -3.222 -12.892 -22.816 1.00 62.53 H new ATOM 704 N ILE A 46 0.308 -15.118 -19.768 1.00 34.01 N ATOM 705 CA ILE A 46 1.665 -15.365 -19.294 1.00 24.01 C ATOM 706 C ILE A 46 2.337 -16.463 -20.110 1.00 75.43 C ATOM 707 O ILE A 46 2.090 -17.649 -19.894 1.00 41.43 O ATOM 708 CB ILE A 46 1.677 -15.764 -17.804 1.00 73.11 C ATOM 709 CG1 ILE A 46 0.914 -14.731 -16.967 1.00 64.44 C ATOM 710 CG2 ILE A 46 3.108 -15.917 -17.303 1.00 64.54 C ATOM 711 CD1 ILE A 46 1.689 -13.454 -16.709 1.00 31.20 C ATOM 0 H ILE A 46 -0.416 -15.620 -19.254 1.00 34.01 H new ATOM 0 HA ILE A 46 2.219 -14.434 -19.415 1.00 24.01 H new ATOM 0 HB ILE A 46 1.176 -16.726 -17.699 1.00 73.11 H new ATOM 0 HG12 ILE A 46 -0.017 -14.482 -17.476 1.00 64.44 H new ATOM 0 HG13 ILE A 46 0.645 -15.180 -16.011 1.00 64.44 H new ATOM 0 HG21 ILE A 46 3.097 -16.199 -16.250 1.00 64.54 H new ATOM 0 HG22 ILE A 46 3.615 -16.690 -17.880 1.00 64.54 H new ATOM 0 HG23 ILE A 46 3.637 -14.971 -17.420 1.00 64.54 H new ATOM 0 HD11 ILE A 46 1.082 -12.774 -16.111 1.00 31.20 H new ATOM 0 HD12 ILE A 46 2.608 -13.688 -16.171 1.00 31.20 H new ATOM 0 HD13 ILE A 46 1.935 -12.980 -17.659 1.00 31.20 H new ATOM 723 N ASP A 47 3.187 -16.061 -21.049 1.00 3.14 N ATOM 724 CA ASP A 47 3.895 -17.012 -21.900 1.00 74.12 C ATOM 725 C ASP A 47 2.915 -17.807 -22.760 1.00 20.22 C ATOM 726 O ASP A 47 2.883 -19.037 -22.709 1.00 33.12 O ATOM 727 CB ASP A 47 4.735 -17.965 -21.047 1.00 74.35 C ATOM 728 CG ASP A 47 5.864 -18.603 -21.834 1.00 3.33 C ATOM 729 OD1 ASP A 47 6.234 -18.053 -22.892 1.00 31.05 O ATOM 730 OD2 ASP A 47 6.376 -19.653 -21.392 1.00 61.34 O ATOM 0 H ASP A 47 3.403 -15.083 -21.240 1.00 3.14 H new ATOM 0 HA ASP A 47 4.556 -16.450 -22.560 1.00 74.12 H new ATOM 0 HB2 ASP A 47 5.150 -17.420 -20.199 1.00 74.35 H new ATOM 0 HB3 ASP A 47 4.093 -18.746 -20.640 1.00 74.35 H new ATOM 735 N GLY A 48 2.119 -17.095 -23.550 1.00 15.11 N ATOM 736 CA GLY A 48 1.150 -17.750 -24.410 1.00 70.50 C ATOM 737 C GLY A 48 0.162 -18.600 -23.633 1.00 23.35 C ATOM 738 O GLY A 48 -0.374 -19.574 -24.159 1.00 75.33 O ATOM 0 H GLY A 48 2.127 -16.077 -23.611 1.00 15.11 H new ATOM 0 HA2 GLY A 48 0.606 -16.996 -24.979 1.00 70.50 H new ATOM 0 HA3 GLY A 48 1.675 -18.377 -25.131 1.00 70.50 H new ATOM 742 N GLU A 49 -0.076 -18.230 -22.380 1.00 20.40 N ATOM 743 CA GLU A 49 -1.006 -18.965 -21.531 1.00 44.34 C ATOM 744 C GLU A 49 -1.939 -18.010 -20.791 1.00 20.24 C ATOM 745 O GLU A 49 -1.537 -17.354 -19.831 1.00 43.33 O ATOM 746 CB GLU A 49 -0.239 -19.828 -20.527 1.00 1.14 C ATOM 747 CG GLU A 49 -1.139 -20.680 -19.645 1.00 65.54 C ATOM 748 CD GLU A 49 -0.683 -22.123 -19.565 1.00 22.31 C ATOM 749 OE1 GLU A 49 -0.607 -22.782 -20.624 1.00 44.12 O ATOM 750 OE2 GLU A 49 -0.400 -22.596 -18.443 1.00 23.11 O ATOM 0 H GLU A 49 0.362 -17.426 -21.930 1.00 20.40 H new ATOM 0 HA GLU A 49 -1.609 -19.611 -22.169 1.00 44.34 H new ATOM 0 HB2 GLU A 49 0.446 -20.479 -21.069 1.00 1.14 H new ATOM 0 HB3 GLU A 49 0.369 -19.181 -19.894 1.00 1.14 H new ATOM 0 HG2 GLU A 49 -1.165 -20.255 -18.641 1.00 65.54 H new ATOM 0 HG3 GLU A 49 -2.157 -20.646 -20.032 1.00 65.54 H new ATOM 757 N THR A 50 -3.185 -17.937 -21.248 1.00 2.30 N ATOM 758 CA THR A 50 -4.177 -17.062 -20.633 1.00 35.11 C ATOM 759 C THR A 50 -4.377 -17.413 -19.161 1.00 53.34 C ATOM 760 O THR A 50 -4.727 -18.544 -18.824 1.00 2.41 O ATOM 761 CB THR A 50 -5.508 -17.161 -21.381 1.00 12.43 C ATOM 762 OG1 THR A 50 -5.344 -16.814 -22.744 1.00 55.01 O ATOM 763 CG2 THR A 50 -6.586 -16.268 -20.808 1.00 30.14 C ATOM 0 H THR A 50 -3.532 -18.474 -22.043 1.00 2.30 H new ATOM 0 HA THR A 50 -3.809 -16.038 -20.695 1.00 35.11 H new ATOM 0 HB THR A 50 -5.823 -18.199 -21.272 1.00 12.43 H new ATOM 0 HG1 THR A 50 -6.206 -16.885 -23.206 1.00 55.01 H new ATOM 0 HG21 THR A 50 -7.503 -16.388 -21.386 1.00 30.14 H new ATOM 0 HG22 THR A 50 -6.773 -16.543 -19.770 1.00 30.14 H new ATOM 0 HG23 THR A 50 -6.261 -15.229 -20.855 1.00 30.14 H new ATOM 771 N CYS A 51 -4.157 -16.433 -18.290 1.00 52.42 N ATOM 772 CA CYS A 51 -4.315 -16.636 -16.855 1.00 12.31 C ATOM 773 C CYS A 51 -4.771 -15.351 -16.171 1.00 53.14 C ATOM 774 O CYS A 51 -4.386 -14.253 -16.572 1.00 33.31 O ATOM 775 CB CYS A 51 -3.001 -17.117 -16.236 1.00 32.44 C ATOM 776 SG CYS A 51 -2.409 -18.693 -16.896 1.00 5.04 S ATOM 0 H CYS A 51 -3.869 -15.491 -18.553 1.00 52.42 H new ATOM 0 HA CYS A 51 -5.079 -17.399 -16.705 1.00 12.31 H new ATOM 0 HB2 CYS A 51 -2.236 -16.357 -16.397 1.00 32.44 H new ATOM 0 HB3 CYS A 51 -3.133 -17.213 -15.158 1.00 32.44 H new ATOM 0 HG CYS A 51 -3.222 -19.109 -17.822 1.00 5.04 H new ATOM 782 N LEU A 52 -5.593 -15.497 -15.138 1.00 14.44 N ATOM 783 CA LEU A 52 -6.103 -14.349 -14.397 1.00 30.01 C ATOM 784 C LEU A 52 -5.051 -13.818 -13.427 1.00 63.25 C ATOM 785 O LEU A 52 -4.208 -14.569 -12.938 1.00 1.44 O ATOM 786 CB LEU A 52 -7.374 -14.734 -13.635 1.00 11.12 C ATOM 787 CG LEU A 52 -8.641 -14.003 -14.080 1.00 31.21 C ATOM 788 CD1 LEU A 52 -8.464 -12.499 -13.946 1.00 71.32 C ATOM 789 CD2 LEU A 52 -8.995 -14.375 -15.512 1.00 0.32 C ATOM 0 H LEU A 52 -5.921 -16.400 -14.794 1.00 14.44 H new ATOM 0 HA LEU A 52 -6.341 -13.560 -15.111 1.00 30.01 H new ATOM 0 HB2 LEU A 52 -7.534 -15.807 -13.744 1.00 11.12 H new ATOM 0 HB3 LEU A 52 -7.216 -14.542 -12.574 1.00 11.12 H new ATOM 0 HG LEU A 52 -9.462 -14.310 -13.432 1.00 31.21 H new ATOM 0 HD11 LEU A 52 -9.376 -11.995 -14.267 1.00 71.32 H new ATOM 0 HD12 LEU A 52 -8.258 -12.248 -12.905 1.00 71.32 H new ATOM 0 HD13 LEU A 52 -7.631 -12.174 -14.569 1.00 71.32 H new ATOM 0 HD21 LEU A 52 -9.899 -13.846 -15.812 1.00 0.32 H new ATOM 0 HD22 LEU A 52 -8.175 -14.097 -16.174 1.00 0.32 H new ATOM 0 HD23 LEU A 52 -9.165 -15.450 -15.577 1.00 0.32 H new ATOM 801 N LEU A 53 -5.109 -12.519 -13.151 1.00 3.12 N ATOM 802 CA LEU A 53 -4.163 -11.888 -12.238 1.00 32.51 C ATOM 803 C LEU A 53 -4.898 -11.108 -11.152 1.00 71.50 C ATOM 804 O LEU A 53 -4.930 -9.878 -11.168 1.00 12.43 O ATOM 805 CB LEU A 53 -3.221 -10.955 -13.004 1.00 43.24 C ATOM 806 CG LEU A 53 -2.085 -11.651 -13.758 1.00 31.30 C ATOM 807 CD1 LEU A 53 -1.132 -10.625 -14.350 1.00 22.34 C ATOM 808 CD2 LEU A 53 -1.337 -12.604 -12.837 1.00 22.41 C ATOM 0 H LEU A 53 -5.801 -11.883 -13.547 1.00 3.12 H new ATOM 0 HA LEU A 53 -3.574 -12.674 -11.764 1.00 32.51 H new ATOM 0 HB2 LEU A 53 -3.809 -10.377 -13.717 1.00 43.24 H new ATOM 0 HB3 LEU A 53 -2.787 -10.245 -12.300 1.00 43.24 H new ATOM 0 HG LEU A 53 -2.518 -12.230 -14.573 1.00 31.30 H new ATOM 0 HD11 LEU A 53 -0.331 -11.137 -14.882 1.00 22.34 H new ATOM 0 HD12 LEU A 53 -1.675 -9.982 -15.043 1.00 22.34 H new ATOM 0 HD13 LEU A 53 -0.707 -10.019 -13.550 1.00 22.34 H new ATOM 0 HD21 LEU A 53 -0.533 -13.089 -13.391 1.00 22.41 H new ATOM 0 HD22 LEU A 53 -0.916 -12.046 -12.001 1.00 22.41 H new ATOM 0 HD23 LEU A 53 -2.025 -13.360 -12.459 1.00 22.41 H new ATOM 820 N ASP A 54 -5.489 -11.834 -10.209 1.00 65.52 N ATOM 821 CA ASP A 54 -6.226 -11.213 -9.114 1.00 75.34 C ATOM 822 C ASP A 54 -5.275 -10.544 -8.128 1.00 22.30 C ATOM 823 O ASP A 54 -4.687 -11.206 -7.271 1.00 20.23 O ATOM 824 CB ASP A 54 -7.080 -12.255 -8.391 1.00 62.43 C ATOM 825 CG ASP A 54 -8.354 -12.584 -9.145 1.00 64.23 C ATOM 826 OD1 ASP A 54 -8.259 -12.993 -10.320 1.00 42.42 O ATOM 827 OD2 ASP A 54 -9.447 -12.432 -8.559 1.00 24.44 O ATOM 0 H ASP A 54 -5.472 -12.853 -10.181 1.00 65.52 H new ATOM 0 HA ASP A 54 -6.878 -10.449 -9.536 1.00 75.34 H new ATOM 0 HB2 ASP A 54 -6.497 -13.166 -8.253 1.00 62.43 H new ATOM 0 HB3 ASP A 54 -7.334 -11.886 -7.397 1.00 62.43 H new ATOM 832 N ILE A 55 -5.129 -9.229 -8.253 1.00 51.35 N ATOM 833 CA ILE A 55 -4.248 -8.472 -7.370 1.00 62.14 C ATOM 834 C ILE A 55 -4.919 -8.205 -6.028 1.00 73.31 C ATOM 835 O ILE A 55 -5.845 -7.400 -5.935 1.00 51.20 O ATOM 836 CB ILE A 55 -3.834 -7.127 -7.999 1.00 43.44 C ATOM 837 CG1 ILE A 55 -3.444 -7.320 -9.467 1.00 31.10 C ATOM 838 CG2 ILE A 55 -2.685 -6.510 -7.217 1.00 70.12 C ATOM 839 CD1 ILE A 55 -2.291 -8.280 -9.665 1.00 20.13 C ATOM 0 H ILE A 55 -5.608 -8.666 -8.956 1.00 51.35 H new ATOM 0 HA ILE A 55 -3.356 -9.080 -7.217 1.00 62.14 H new ATOM 0 HB ILE A 55 -4.685 -6.447 -7.957 1.00 43.44 H new ATOM 0 HG12 ILE A 55 -4.310 -7.686 -10.019 1.00 31.10 H new ATOM 0 HG13 ILE A 55 -3.178 -6.353 -9.894 1.00 31.10 H new ATOM 0 HG21 ILE A 55 -2.403 -5.561 -7.673 1.00 70.12 H new ATOM 0 HG22 ILE A 55 -2.996 -6.340 -6.186 1.00 70.12 H new ATOM 0 HG23 ILE A 55 -1.831 -7.187 -7.231 1.00 70.12 H new ATOM 0 HD11 ILE A 55 -2.069 -8.368 -10.729 1.00 20.13 H new ATOM 0 HD12 ILE A 55 -1.412 -7.906 -9.141 1.00 20.13 H new ATOM 0 HD13 ILE A 55 -2.560 -9.259 -9.268 1.00 20.13 H new ATOM 851 N LEU A 56 -4.446 -8.887 -4.991 1.00 11.42 N ATOM 852 CA LEU A 56 -5.002 -8.725 -3.653 1.00 30.32 C ATOM 853 C LEU A 56 -4.288 -7.609 -2.898 1.00 44.23 C ATOM 854 O LEU A 56 -3.177 -7.793 -2.399 1.00 21.14 O ATOM 855 CB LEU A 56 -4.896 -10.040 -2.874 1.00 33.41 C ATOM 856 CG LEU A 56 -5.483 -10.016 -1.458 1.00 34.04 C ATOM 857 CD1 LEU A 56 -4.518 -9.349 -0.490 1.00 32.30 C ATOM 858 CD2 LEU A 56 -6.830 -9.306 -1.444 1.00 62.32 C ATOM 0 H LEU A 56 -3.679 -9.557 -5.051 1.00 11.42 H new ATOM 0 HA LEU A 56 -6.053 -8.453 -3.751 1.00 30.32 H new ATOM 0 HB2 LEU A 56 -5.399 -10.821 -3.444 1.00 33.41 H new ATOM 0 HB3 LEU A 56 -3.845 -10.320 -2.808 1.00 33.41 H new ATOM 0 HG LEU A 56 -5.637 -11.046 -1.136 1.00 34.04 H new ATOM 0 HD11 LEU A 56 -4.952 -9.342 0.510 1.00 32.30 H new ATOM 0 HD12 LEU A 56 -3.579 -9.902 -0.473 1.00 32.30 H new ATOM 0 HD13 LEU A 56 -4.330 -8.325 -0.812 1.00 32.30 H new ATOM 0 HD21 LEU A 56 -7.228 -9.301 -0.429 1.00 62.32 H new ATOM 0 HD22 LEU A 56 -6.704 -8.280 -1.790 1.00 62.32 H new ATOM 0 HD23 LEU A 56 -7.523 -9.828 -2.103 1.00 62.32 H new ATOM 870 N ASP A 57 -4.934 -6.450 -2.817 1.00 1.31 N ATOM 871 CA ASP A 57 -4.364 -5.302 -2.122 1.00 62.42 C ATOM 872 C ASP A 57 -5.039 -5.096 -0.770 1.00 64.32 C ATOM 873 O ASP A 57 -6.191 -4.669 -0.699 1.00 1.40 O ATOM 874 CB ASP A 57 -4.506 -4.041 -2.975 1.00 54.25 C ATOM 875 CG ASP A 57 -3.860 -2.830 -2.331 1.00 53.14 C ATOM 876 OD1 ASP A 57 -2.613 -2.774 -2.289 1.00 24.41 O ATOM 877 OD2 ASP A 57 -4.600 -1.937 -1.869 1.00 71.11 O ATOM 0 H ASP A 57 -5.854 -6.281 -3.225 1.00 1.31 H new ATOM 0 HA ASP A 57 -3.305 -5.499 -1.953 1.00 62.42 H new ATOM 0 HB2 ASP A 57 -4.054 -4.214 -3.952 1.00 54.25 H new ATOM 0 HB3 ASP A 57 -5.563 -3.838 -3.145 1.00 54.25 H new ATOM 882 N THR A 58 -4.313 -5.403 0.301 1.00 40.34 N ATOM 883 CA THR A 58 -4.843 -5.253 1.652 1.00 24.21 C ATOM 884 C THR A 58 -4.562 -3.856 2.197 1.00 64.51 C ATOM 885 O THR A 58 -4.023 -3.001 1.493 1.00 71.05 O ATOM 886 CB THR A 58 -4.234 -6.305 2.580 1.00 3.55 C ATOM 887 OG1 THR A 58 -2.895 -5.974 2.903 1.00 1.13 O ATOM 888 CG2 THR A 58 -4.233 -7.698 1.987 1.00 1.15 C ATOM 0 H THR A 58 -3.357 -5.757 0.260 1.00 40.34 H new ATOM 0 HA THR A 58 -5.923 -5.396 1.609 1.00 24.21 H new ATOM 0 HB THR A 58 -4.865 -6.307 3.468 1.00 3.55 H new ATOM 0 HG1 THR A 58 -2.524 -6.658 3.499 1.00 1.13 H new ATOM 0 HG21 THR A 58 -3.788 -8.395 2.697 1.00 1.15 H new ATOM 0 HG22 THR A 58 -5.257 -8.003 1.773 1.00 1.15 H new ATOM 0 HG23 THR A 58 -3.653 -7.700 1.064 1.00 1.15 H new ATOM 896 N ALA A 59 -4.928 -3.633 3.454 1.00 50.33 N ATOM 897 CA ALA A 59 -4.714 -2.342 4.096 1.00 72.32 C ATOM 898 C ALA A 59 -3.258 -2.174 4.515 1.00 3.22 C ATOM 899 O ALA A 59 -2.574 -3.150 4.820 1.00 51.01 O ATOM 900 CB ALA A 59 -5.632 -2.191 5.300 1.00 12.34 C ATOM 0 H ALA A 59 -5.375 -4.331 4.049 1.00 50.33 H new ATOM 0 HA ALA A 59 -4.951 -1.561 3.373 1.00 72.32 H new ATOM 0 HB1 ALA A 59 -5.461 -1.222 5.769 1.00 12.34 H new ATOM 0 HB2 ALA A 59 -6.671 -2.259 4.976 1.00 12.34 H new ATOM 0 HB3 ALA A 59 -5.423 -2.984 6.018 1.00 12.34 H new ATOM 1002 N MET A 67 -7.068 -10.545 9.210 1.00 0.31 N ATOM 1003 CA MET A 67 -7.370 -10.559 7.783 1.00 61.44 C ATOM 1004 C MET A 67 -6.110 -10.817 6.963 1.00 1.14 C ATOM 1005 O MET A 67 -6.153 -11.501 5.940 1.00 75.05 O ATOM 1006 CB MET A 67 -8.004 -9.231 7.361 1.00 35.44 C ATOM 1007 CG MET A 67 -9.051 -8.717 8.338 1.00 10.35 C ATOM 1008 SD MET A 67 -10.358 -9.919 8.652 1.00 75.21 S ATOM 1009 CE MET A 67 -10.725 -9.578 10.371 1.00 71.43 C ATOM 0 HA MET A 67 -8.077 -11.367 7.595 1.00 61.44 H new ATOM 0 HB2 MET A 67 -7.220 -8.481 7.255 1.00 35.44 H new ATOM 0 HB3 MET A 67 -8.464 -9.353 6.380 1.00 35.44 H new ATOM 0 HG2 MET A 67 -8.567 -8.458 9.280 1.00 10.35 H new ATOM 0 HG3 MET A 67 -9.492 -7.801 7.944 1.00 10.35 H new ATOM 0 HE1 MET A 67 -11.517 -10.244 10.713 1.00 71.43 H new ATOM 0 HE2 MET A 67 -9.831 -9.739 10.973 1.00 71.43 H new ATOM 0 HE3 MET A 67 -11.051 -8.543 10.475 1.00 71.43 H new ATOM 1019 N ARG A 68 -4.990 -10.264 7.418 1.00 62.44 N ATOM 1020 CA ARG A 68 -3.717 -10.433 6.727 1.00 14.50 C ATOM 1021 C ARG A 68 -3.356 -11.910 6.601 1.00 30.31 C ATOM 1022 O ARG A 68 -2.760 -12.332 5.610 1.00 23.42 O ATOM 1023 CB ARG A 68 -2.608 -9.681 7.466 1.00 74.10 C ATOM 1024 CG ARG A 68 -2.005 -8.540 6.661 1.00 64.24 C ATOM 1025 CD ARG A 68 -0.498 -8.687 6.522 1.00 4.53 C ATOM 1026 NE ARG A 68 0.018 -7.963 5.363 1.00 34.31 N ATOM 1027 CZ ARG A 68 0.080 -6.635 5.286 1.00 14.23 C ATOM 1028 NH1 ARG A 68 -0.337 -5.885 6.299 1.00 30.01 N ATOM 1029 NH2 ARG A 68 0.562 -6.057 4.194 1.00 51.14 N ATOM 0 H ARG A 68 -4.938 -9.695 8.263 1.00 62.44 H new ATOM 0 HA ARG A 68 -3.818 -10.019 5.724 1.00 14.50 H new ATOM 0 HB2 ARG A 68 -3.009 -9.284 8.399 1.00 74.10 H new ATOM 0 HB3 ARG A 68 -1.819 -10.384 7.732 1.00 74.10 H new ATOM 0 HG2 ARG A 68 -2.461 -8.512 5.671 1.00 64.24 H new ATOM 0 HG3 ARG A 68 -2.235 -7.591 7.145 1.00 64.24 H new ATOM 0 HD2 ARG A 68 -0.013 -8.318 7.426 1.00 4.53 H new ATOM 0 HD3 ARG A 68 -0.244 -9.743 6.432 1.00 4.53 H new ATOM 0 HE ARG A 68 0.350 -8.506 4.566 1.00 34.31 H new ATOM 0 HH11 ARG A 68 -0.707 -6.326 7.141 1.00 30.01 H new ATOM 0 HH12 ARG A 68 -0.287 -4.868 6.235 1.00 30.01 H new ATOM 0 HH21 ARG A 68 0.885 -6.630 3.414 1.00 51.14 H new ATOM 0 HH22 ARG A 68 0.610 -5.040 4.134 1.00 51.14 H new ATOM 1043 N ASP A 69 -3.725 -12.693 7.610 1.00 73.23 N ATOM 1044 CA ASP A 69 -3.442 -14.123 7.610 1.00 24.41 C ATOM 1045 C ASP A 69 -4.348 -14.847 6.621 1.00 32.14 C ATOM 1046 O ASP A 69 -3.945 -15.827 5.993 1.00 44.43 O ATOM 1047 CB ASP A 69 -3.628 -14.703 9.013 1.00 11.51 C ATOM 1048 CG ASP A 69 -2.322 -14.795 9.777 1.00 41.50 C ATOM 1049 OD1 ASP A 69 -1.547 -13.816 9.749 1.00 54.12 O ATOM 1050 OD2 ASP A 69 -2.074 -15.846 10.404 1.00 2.35 O ATOM 0 H ASP A 69 -4.220 -12.361 8.437 1.00 73.23 H new ATOM 0 HA ASP A 69 -2.406 -14.267 7.304 1.00 24.41 H new ATOM 0 HB2 ASP A 69 -4.329 -14.082 9.570 1.00 11.51 H new ATOM 0 HB3 ASP A 69 -4.072 -15.695 8.937 1.00 11.51 H new ATOM 1055 N GLN A 70 -5.574 -14.356 6.484 1.00 62.02 N ATOM 1056 CA GLN A 70 -6.540 -14.951 5.571 1.00 21.11 C ATOM 1057 C GLN A 70 -6.070 -14.818 4.125 1.00 5.51 C ATOM 1058 O GLN A 70 -6.163 -15.762 3.341 1.00 52.00 O ATOM 1059 CB GLN A 70 -7.909 -14.284 5.744 1.00 12.25 C ATOM 1060 CG GLN A 70 -8.935 -14.701 4.702 1.00 24.04 C ATOM 1061 CD GLN A 70 -9.368 -16.146 4.855 1.00 30.13 C ATOM 1062 OE1 GLN A 70 -8.557 -17.064 4.343 1.00 3.54 O flip ATOM 1063 NE2 GLN A 70 -10.419 -16.433 5.427 1.00 4.31 N flip ATOM 0 H GLN A 70 -5.922 -13.545 6.995 1.00 62.02 H new ATOM 0 HA GLN A 70 -6.629 -16.011 5.807 1.00 21.11 H new ATOM 0 HB2 GLN A 70 -8.295 -14.522 6.735 1.00 12.25 H new ATOM 0 HB3 GLN A 70 -7.783 -13.202 5.702 1.00 12.25 H new ATOM 0 HG2 GLN A 70 -9.809 -14.054 4.779 1.00 24.04 H new ATOM 0 HG3 GLN A 70 -8.516 -14.555 3.706 1.00 24.04 H new ATOM 0 HE21 GLN A 70 -11.012 -15.694 5.805 1.00 4.31 H new ATOM 0 HE22 GLN A 70 -10.697 -17.410 5.523 1.00 4.31 H new ATOM 1072 N TYR A 71 -5.568 -13.637 3.781 1.00 4.44 N ATOM 1073 CA TYR A 71 -5.087 -13.375 2.430 1.00 71.33 C ATOM 1074 C TYR A 71 -3.771 -14.101 2.167 1.00 42.31 C ATOM 1075 O TYR A 71 -3.584 -14.703 1.109 1.00 71.55 O ATOM 1076 CB TYR A 71 -4.907 -11.871 2.217 1.00 22.23 C ATOM 1077 CG TYR A 71 -6.069 -11.047 2.725 1.00 24.23 C ATOM 1078 CD1 TYR A 71 -7.364 -11.291 2.285 1.00 3.01 C ATOM 1079 CD2 TYR A 71 -5.871 -10.027 3.647 1.00 62.30 C ATOM 1080 CE1 TYR A 71 -8.428 -10.540 2.748 1.00 61.02 C ATOM 1081 CE2 TYR A 71 -6.930 -9.272 4.115 1.00 31.41 C ATOM 1082 CZ TYR A 71 -8.206 -9.532 3.662 1.00 70.12 C ATOM 1083 OH TYR A 71 -9.264 -8.783 4.125 1.00 31.21 O ATOM 0 H TYR A 71 -5.484 -12.846 4.419 1.00 4.44 H new ATOM 0 HA TYR A 71 -5.831 -13.750 1.727 1.00 71.33 H new ATOM 0 HB2 TYR A 71 -3.995 -11.547 2.719 1.00 22.23 H new ATOM 0 HB3 TYR A 71 -4.771 -11.676 1.153 1.00 22.23 H new ATOM 0 HD1 TYR A 71 -7.542 -12.080 1.570 1.00 3.01 H new ATOM 0 HD2 TYR A 71 -4.873 -9.820 4.004 1.00 62.30 H new ATOM 0 HE1 TYR A 71 -9.429 -10.742 2.395 1.00 61.02 H new ATOM 0 HE2 TYR A 71 -6.759 -8.483 4.832 1.00 31.41 H new ATOM 0 HH TYR A 71 -10.077 -9.329 4.123 1.00 31.21 H new ATOM 1093 N MET A 72 -2.862 -14.041 3.135 1.00 15.24 N ATOM 1094 CA MET A 72 -1.564 -14.695 3.006 1.00 32.14 C ATOM 1095 C MET A 72 -1.731 -16.196 2.792 1.00 63.22 C ATOM 1096 O MET A 72 -1.147 -16.775 1.877 1.00 22.21 O ATOM 1097 CB MET A 72 -0.714 -14.441 4.252 1.00 75.00 C ATOM 1098 CG MET A 72 -0.175 -13.023 4.343 1.00 53.43 C ATOM 1099 SD MET A 72 1.610 -12.939 4.103 1.00 54.20 S ATOM 1100 CE MET A 72 1.976 -11.349 4.844 1.00 73.54 C ATOM 0 H MET A 72 -3.000 -13.547 4.017 1.00 15.24 H new ATOM 0 HA MET A 72 -1.059 -14.274 2.137 1.00 32.14 H new ATOM 0 HB2 MET A 72 -1.312 -14.651 5.139 1.00 75.00 H new ATOM 0 HB3 MET A 72 0.123 -15.140 4.259 1.00 75.00 H new ATOM 0 HG2 MET A 72 -0.668 -12.403 3.594 1.00 53.43 H new ATOM 0 HG3 MET A 72 -0.426 -12.605 5.318 1.00 53.43 H new ATOM 0 HE1 MET A 72 3.046 -11.152 4.774 1.00 73.54 H new ATOM 0 HE2 MET A 72 1.428 -10.567 4.318 1.00 73.54 H new ATOM 0 HE3 MET A 72 1.677 -11.359 5.892 1.00 73.54 H new ATOM 1110 N ARG A 73 -2.535 -16.818 3.649 1.00 62.34 N ATOM 1111 CA ARG A 73 -2.785 -18.251 3.563 1.00 71.24 C ATOM 1112 C ARG A 73 -3.439 -18.617 2.235 1.00 35.43 C ATOM 1113 O ARG A 73 -3.179 -19.682 1.676 1.00 73.54 O ATOM 1114 CB ARG A 73 -3.672 -18.695 4.721 1.00 62.33 C ATOM 1115 CG ARG A 73 -2.960 -18.678 6.060 1.00 43.03 C ATOM 1116 CD ARG A 73 -3.814 -19.291 7.151 1.00 55.04 C ATOM 1117 NE ARG A 73 -4.438 -20.542 6.726 1.00 11.31 N ATOM 1118 CZ ARG A 73 -5.547 -21.041 7.270 1.00 4.25 C ATOM 1119 NH1 ARG A 73 -6.152 -20.405 8.266 1.00 43.34 N ATOM 1120 NH2 ARG A 73 -6.051 -22.181 6.818 1.00 52.43 N ATOM 0 H ARG A 73 -3.025 -16.350 4.412 1.00 62.34 H new ATOM 0 HA ARG A 73 -1.827 -18.767 3.623 1.00 71.24 H new ATOM 0 HB2 ARG A 73 -4.544 -18.043 4.772 1.00 62.33 H new ATOM 0 HB3 ARG A 73 -4.038 -19.703 4.524 1.00 62.33 H new ATOM 0 HG2 ARG A 73 -2.021 -19.226 5.981 1.00 43.03 H new ATOM 0 HG3 ARG A 73 -2.709 -17.651 6.327 1.00 43.03 H new ATOM 0 HD2 ARG A 73 -3.199 -19.475 8.032 1.00 55.04 H new ATOM 0 HD3 ARG A 73 -4.588 -18.582 7.445 1.00 55.04 H new ATOM 0 HE ARG A 73 -3.999 -21.064 5.968 1.00 11.31 H new ATOM 0 HH11 ARG A 73 -5.768 -19.529 8.619 1.00 43.34 H new ATOM 0 HH12 ARG A 73 -7.001 -20.793 8.678 1.00 43.34 H new ATOM 0 HH21 ARG A 73 -5.590 -22.675 6.054 1.00 52.43 H new ATOM 0 HH22 ARG A 73 -6.900 -22.564 7.234 1.00 52.43 H new ATOM 1134 N THR A 74 -4.291 -17.727 1.738 1.00 44.02 N ATOM 1135 CA THR A 74 -4.989 -17.954 0.477 1.00 62.21 C ATOM 1136 C THR A 74 -4.146 -17.504 -0.716 1.00 24.31 C ATOM 1137 O THR A 74 -4.427 -17.872 -1.856 1.00 30.25 O ATOM 1138 CB THR A 74 -6.325 -17.211 0.474 1.00 51.12 C ATOM 1139 OG1 THR A 74 -6.127 -15.823 0.672 1.00 12.01 O ATOM 1140 CG2 THR A 74 -7.282 -17.695 1.542 1.00 21.44 C ATOM 0 H THR A 74 -4.515 -16.840 2.190 1.00 44.02 H new ATOM 0 HA THR A 74 -5.167 -19.025 0.383 1.00 62.21 H new ATOM 0 HB THR A 74 -6.765 -17.412 -0.503 1.00 51.12 H new ATOM 0 HG1 THR A 74 -6.243 -15.608 1.621 1.00 12.01 H new ATOM 0 HG21 THR A 74 -8.210 -17.126 1.484 1.00 21.44 H new ATOM 0 HG22 THR A 74 -7.495 -18.753 1.388 1.00 21.44 H new ATOM 0 HG23 THR A 74 -6.831 -17.555 2.525 1.00 21.44 H new ATOM 1148 N GLY A 75 -3.118 -16.703 -0.449 1.00 25.32 N ATOM 1149 CA GLY A 75 -2.264 -16.216 -1.516 1.00 4.13 C ATOM 1150 C GLY A 75 -1.221 -17.230 -1.942 1.00 3.00 C ATOM 1151 O GLY A 75 -0.595 -17.879 -1.105 1.00 63.42 O ATOM 0 H GLY A 75 -2.862 -16.384 0.485 1.00 25.32 H new ATOM 0 HA2 GLY A 75 -2.879 -15.951 -2.376 1.00 4.13 H new ATOM 0 HA3 GLY A 75 -1.765 -15.304 -1.188 1.00 4.13 H new ATOM 1155 N GLU A 76 -1.031 -17.358 -3.252 1.00 51.03 N ATOM 1156 CA GLU A 76 -0.052 -18.292 -3.796 1.00 25.02 C ATOM 1157 C GLU A 76 1.314 -17.624 -3.948 1.00 63.24 C ATOM 1158 O GLU A 76 2.320 -18.298 -4.172 1.00 24.10 O ATOM 1159 CB GLU A 76 -0.523 -18.826 -5.150 1.00 23.21 C ATOM 1160 CG GLU A 76 -1.988 -19.232 -5.168 1.00 35.24 C ATOM 1161 CD GLU A 76 -2.272 -20.344 -6.161 1.00 21.11 C ATOM 1162 OE1 GLU A 76 -1.652 -21.421 -6.039 1.00 60.30 O ATOM 1163 OE2 GLU A 76 -3.113 -20.135 -7.060 1.00 2.05 O ATOM 0 H GLU A 76 -1.543 -16.826 -3.956 1.00 51.03 H new ATOM 0 HA GLU A 76 0.045 -19.124 -3.098 1.00 25.02 H new ATOM 0 HB2 GLU A 76 -0.357 -18.062 -5.910 1.00 23.21 H new ATOM 0 HB3 GLU A 76 0.087 -19.687 -5.424 1.00 23.21 H new ATOM 0 HG2 GLU A 76 -2.284 -19.556 -4.170 1.00 35.24 H new ATOM 0 HG3 GLU A 76 -2.599 -18.364 -5.415 1.00 35.24 H new ATOM 1170 N GLY A 77 1.342 -16.299 -3.825 1.00 44.01 N ATOM 1171 CA GLY A 77 2.589 -15.565 -3.950 1.00 72.20 C ATOM 1172 C GLY A 77 2.520 -14.201 -3.293 1.00 11.11 C ATOM 1173 O GLY A 77 1.481 -13.815 -2.759 1.00 11.30 O ATOM 0 H GLY A 77 0.522 -15.721 -3.641 1.00 44.01 H new ATOM 0 HA2 GLY A 77 3.395 -16.143 -3.499 1.00 72.20 H new ATOM 0 HA3 GLY A 77 2.834 -15.446 -5.005 1.00 72.20 H new ATOM 1177 N PHE A 78 3.630 -13.471 -3.329 1.00 52.12 N ATOM 1178 CA PHE A 78 3.687 -12.143 -2.728 1.00 2.45 C ATOM 1179 C PHE A 78 4.652 -11.238 -3.488 1.00 24.21 C ATOM 1180 O PHE A 78 5.647 -11.704 -4.043 1.00 54.04 O ATOM 1181 CB PHE A 78 4.108 -12.241 -1.261 1.00 70.32 C ATOM 1182 CG PHE A 78 3.349 -13.282 -0.487 1.00 73.10 C ATOM 1183 CD1 PHE A 78 3.706 -14.618 -0.564 1.00 25.54 C ATOM 1184 CD2 PHE A 78 2.279 -12.922 0.316 1.00 55.12 C ATOM 1185 CE1 PHE A 78 3.007 -15.577 0.146 1.00 4.41 C ATOM 1186 CE2 PHE A 78 1.577 -13.876 1.028 1.00 4.52 C ATOM 1187 CZ PHE A 78 1.942 -15.206 0.943 1.00 12.41 C ATOM 0 H PHE A 78 4.500 -13.775 -3.766 1.00 52.12 H new ATOM 0 HA PHE A 78 2.690 -11.706 -2.784 1.00 2.45 H new ATOM 0 HB2 PHE A 78 5.173 -12.468 -1.211 1.00 70.32 H new ATOM 0 HB3 PHE A 78 3.966 -11.271 -0.785 1.00 70.32 H new ATOM 0 HD1 PHE A 78 4.539 -14.914 -1.185 1.00 25.54 H new ATOM 0 HD2 PHE A 78 1.990 -11.884 0.386 1.00 55.12 H new ATOM 0 HE1 PHE A 78 3.294 -16.616 0.077 1.00 4.41 H new ATOM 0 HE2 PHE A 78 0.744 -13.582 1.650 1.00 4.52 H new ATOM 0 HZ PHE A 78 1.396 -15.954 1.499 1.00 12.41 H new ATOM 1197 N LEU A 79 4.352 -9.945 -3.509 1.00 25.22 N ATOM 1198 CA LEU A 79 5.193 -8.975 -4.200 1.00 42.22 C ATOM 1199 C LEU A 79 5.730 -7.931 -3.227 1.00 42.42 C ATOM 1200 O LEU A 79 4.970 -7.139 -2.668 1.00 74.22 O ATOM 1201 CB LEU A 79 4.404 -8.291 -5.321 1.00 0.53 C ATOM 1202 CG LEU A 79 5.204 -8.008 -6.596 1.00 41.53 C ATOM 1203 CD1 LEU A 79 4.444 -8.487 -7.824 1.00 1.32 C ATOM 1204 CD2 LEU A 79 5.522 -6.525 -6.710 1.00 15.22 C ATOM 0 H LEU A 79 3.532 -9.543 -3.055 1.00 25.22 H new ATOM 0 HA LEU A 79 6.039 -9.508 -4.635 1.00 42.22 H new ATOM 0 HB2 LEU A 79 3.550 -8.917 -5.578 1.00 0.53 H new ATOM 0 HB3 LEU A 79 4.007 -7.349 -4.943 1.00 0.53 H new ATOM 0 HG LEU A 79 6.144 -8.558 -6.539 1.00 41.53 H new ATOM 0 HD11 LEU A 79 5.029 -8.277 -8.719 1.00 1.32 H new ATOM 0 HD12 LEU A 79 4.270 -9.560 -7.748 1.00 1.32 H new ATOM 0 HD13 LEU A 79 3.488 -7.968 -7.886 1.00 1.32 H new ATOM 0 HD21 LEU A 79 6.091 -6.344 -7.622 1.00 15.22 H new ATOM 0 HD22 LEU A 79 4.593 -5.955 -6.742 1.00 15.22 H new ATOM 0 HD23 LEU A 79 6.110 -6.212 -5.847 1.00 15.22 H new ATOM 1216 N CYS A 80 7.045 -7.936 -3.023 1.00 33.40 N ATOM 1217 CA CYS A 80 7.683 -6.992 -2.113 1.00 61.24 C ATOM 1218 C CYS A 80 8.093 -5.717 -2.845 1.00 72.41 C ATOM 1219 O CYS A 80 9.055 -5.714 -3.612 1.00 52.22 O ATOM 1220 CB CYS A 80 8.909 -7.630 -1.457 1.00 42.03 C ATOM 1221 SG CYS A 80 8.518 -8.974 -0.313 1.00 11.34 S ATOM 0 H CYS A 80 7.689 -8.584 -3.477 1.00 33.40 H new ATOM 0 HA CYS A 80 6.959 -6.730 -1.341 1.00 61.24 H new ATOM 0 HB2 CYS A 80 9.568 -8.011 -2.237 1.00 42.03 H new ATOM 0 HB3 CYS A 80 9.463 -6.860 -0.920 1.00 42.03 H new ATOM 0 HG CYS A 80 9.618 -9.451 0.189 1.00 11.34 H new ATOM 1227 N VAL A 81 7.360 -4.636 -2.600 1.00 63.25 N ATOM 1228 CA VAL A 81 7.652 -3.357 -3.235 1.00 64.24 C ATOM 1229 C VAL A 81 8.377 -2.420 -2.273 1.00 4.30 C ATOM 1230 O VAL A 81 7.861 -2.085 -1.208 1.00 4.43 O ATOM 1231 CB VAL A 81 6.367 -2.668 -3.736 1.00 14.32 C ATOM 1232 CG1 VAL A 81 6.699 -1.370 -4.457 1.00 54.31 C ATOM 1233 CG2 VAL A 81 5.578 -3.602 -4.640 1.00 53.10 C ATOM 0 H VAL A 81 6.560 -4.620 -1.967 1.00 63.25 H new ATOM 0 HA VAL A 81 8.296 -3.568 -4.089 1.00 64.24 H new ATOM 0 HB VAL A 81 5.748 -2.426 -2.872 1.00 14.32 H new ATOM 0 HG11 VAL A 81 5.778 -0.900 -4.802 1.00 54.31 H new ATOM 0 HG12 VAL A 81 7.216 -0.696 -3.774 1.00 54.31 H new ATOM 0 HG13 VAL A 81 7.341 -1.583 -5.312 1.00 54.31 H new ATOM 0 HG21 VAL A 81 4.675 -3.098 -4.984 1.00 53.10 H new ATOM 0 HG22 VAL A 81 6.189 -3.878 -5.499 1.00 53.10 H new ATOM 0 HG23 VAL A 81 5.304 -4.500 -4.086 1.00 53.10 H new ATOM 1243 N PHE A 82 9.579 -2.002 -2.658 1.00 2.25 N ATOM 1244 CA PHE A 82 10.378 -1.105 -1.832 1.00 52.14 C ATOM 1245 C PHE A 82 10.729 0.172 -2.595 1.00 1.41 C ATOM 1246 O PHE A 82 10.968 0.139 -3.802 1.00 73.51 O ATOM 1247 CB PHE A 82 11.651 -1.823 -1.353 1.00 5.21 C ATOM 1248 CG PHE A 82 12.937 -1.213 -1.842 1.00 11.34 C ATOM 1249 CD1 PHE A 82 13.468 -1.575 -3.069 1.00 55.24 C ATOM 1250 CD2 PHE A 82 13.611 -0.278 -1.073 1.00 51.05 C ATOM 1251 CE1 PHE A 82 14.649 -1.016 -3.521 1.00 54.34 C ATOM 1252 CE2 PHE A 82 14.791 0.285 -1.519 1.00 41.42 C ATOM 1253 CZ PHE A 82 15.310 -0.084 -2.744 1.00 75.34 C ATOM 0 H PHE A 82 10.021 -2.271 -3.537 1.00 2.25 H new ATOM 0 HA PHE A 82 9.789 -0.820 -0.960 1.00 52.14 H new ATOM 0 HB2 PHE A 82 11.659 -1.831 -0.263 1.00 5.21 H new ATOM 0 HB3 PHE A 82 11.610 -2.862 -1.679 1.00 5.21 H new ATOM 0 HD1 PHE A 82 12.954 -2.302 -3.680 1.00 55.24 H new ATOM 0 HD2 PHE A 82 13.209 0.014 -0.114 1.00 51.05 H new ATOM 0 HE1 PHE A 82 15.054 -1.307 -4.479 1.00 54.34 H new ATOM 0 HE2 PHE A 82 15.307 1.013 -0.910 1.00 41.42 H new ATOM 0 HZ PHE A 82 16.232 0.356 -3.095 1.00 75.34 H new ATOM 1263 N ALA A 83 10.762 1.293 -1.883 1.00 72.24 N ATOM 1264 CA ALA A 83 11.087 2.577 -2.493 1.00 15.31 C ATOM 1265 C ALA A 83 12.573 2.895 -2.350 1.00 31.32 C ATOM 1266 O ALA A 83 13.111 2.911 -1.243 1.00 71.55 O ATOM 1267 CB ALA A 83 10.247 3.682 -1.871 1.00 63.21 C ATOM 0 H ALA A 83 10.568 1.339 -0.883 1.00 72.24 H new ATOM 0 HA ALA A 83 10.858 2.514 -3.557 1.00 15.31 H new ATOM 0 HB1 ALA A 83 10.499 4.636 -2.335 1.00 63.21 H new ATOM 0 HB2 ALA A 83 9.190 3.469 -2.030 1.00 63.21 H new ATOM 0 HB3 ALA A 83 10.449 3.734 -0.801 1.00 63.21 H new ATOM 1273 N ILE A 84 13.231 3.151 -3.478 1.00 13.23 N ATOM 1274 CA ILE A 84 14.654 3.473 -3.477 1.00 1.41 C ATOM 1275 C ILE A 84 14.913 4.790 -2.756 1.00 13.20 C ATOM 1276 O ILE A 84 15.984 4.999 -2.185 1.00 45.14 O ATOM 1277 CB ILE A 84 15.207 3.573 -4.911 1.00 14.13 C ATOM 1278 CG1 ILE A 84 14.356 4.532 -5.745 1.00 72.23 C ATOM 1279 CG2 ILE A 84 15.246 2.199 -5.556 1.00 0.13 C ATOM 1280 CD1 ILE A 84 15.128 5.226 -6.845 1.00 24.13 C ATOM 0 H ILE A 84 12.801 3.142 -4.403 1.00 13.23 H new ATOM 0 HA ILE A 84 15.164 2.664 -2.954 1.00 1.41 H new ATOM 0 HB ILE A 84 16.223 3.965 -4.866 1.00 14.13 H new ATOM 0 HG12 ILE A 84 13.528 3.978 -6.187 1.00 72.23 H new ATOM 0 HG13 ILE A 84 13.921 5.285 -5.087 1.00 72.23 H new ATOM 0 HG21 ILE A 84 15.639 2.284 -6.569 1.00 0.13 H new ATOM 0 HG22 ILE A 84 15.889 1.541 -4.971 1.00 0.13 H new ATOM 0 HG23 ILE A 84 14.238 1.785 -5.591 1.00 0.13 H new ATOM 0 HD11 ILE A 84 14.461 5.890 -7.395 1.00 24.13 H new ATOM 0 HD12 ILE A 84 15.940 5.808 -6.408 1.00 24.13 H new ATOM 0 HD13 ILE A 84 15.540 4.481 -7.526 1.00 24.13 H new ATOM 1292 N ASN A 85 13.923 5.673 -2.790 1.00 71.14 N ATOM 1293 CA ASN A 85 14.032 6.977 -2.143 1.00 62.22 C ATOM 1294 C ASN A 85 13.589 6.912 -0.681 1.00 33.14 C ATOM 1295 O ASN A 85 13.444 7.943 -0.024 1.00 0.40 O ATOM 1296 CB ASN A 85 13.189 8.018 -2.890 1.00 11.33 C ATOM 1297 CG ASN A 85 13.007 7.683 -4.359 1.00 50.12 C ATOM 1298 OD1 ASN A 85 12.285 6.748 -4.708 1.00 41.15 O ATOM 1299 ND2 ASN A 85 13.661 8.443 -5.227 1.00 34.52 N ATOM 0 H ASN A 85 13.032 5.510 -3.260 1.00 71.14 H new ATOM 0 HA ASN A 85 15.081 7.272 -2.173 1.00 62.22 H new ATOM 0 HB2 ASN A 85 12.211 8.095 -2.416 1.00 11.33 H new ATOM 0 HB3 ASN A 85 13.664 8.995 -2.801 1.00 11.33 H new ATOM 0 HD21 ASN A 85 13.576 8.263 -6.227 1.00 34.52 H new ATOM 0 HD22 ASN A 85 14.249 9.207 -4.894 1.00 34.52 H new ATOM 1306 N ASN A 86 13.377 5.699 -0.173 1.00 74.35 N ATOM 1307 CA ASN A 86 12.954 5.517 1.211 1.00 51.24 C ATOM 1308 C ASN A 86 13.694 4.351 1.857 1.00 41.35 C ATOM 1309 O ASN A 86 13.278 3.197 1.741 1.00 1.12 O ATOM 1310 CB ASN A 86 11.443 5.281 1.278 1.00 14.43 C ATOM 1311 CG ASN A 86 10.796 6.015 2.437 1.00 10.42 C ATOM 1312 OD1 ASN A 86 11.453 6.340 3.425 1.00 25.22 O ATOM 1313 ND2 ASN A 86 9.499 6.281 2.320 1.00 31.15 N ATOM 0 H ASN A 86 13.491 4.832 -0.698 1.00 74.35 H new ATOM 0 HA ASN A 86 13.196 6.426 1.762 1.00 51.24 H new ATOM 0 HB2 ASN A 86 10.985 5.606 0.344 1.00 14.43 H new ATOM 0 HB3 ASN A 86 11.248 4.213 1.373 1.00 14.43 H new ATOM 0 HD21 ASN A 86 9.010 6.773 3.068 1.00 31.15 H new ATOM 0 HD22 ASN A 86 8.993 5.993 1.483 1.00 31.15 H new ATOM 1320 N THR A 87 14.792 4.659 2.539 1.00 20.44 N ATOM 1321 CA THR A 87 15.591 3.637 3.205 1.00 34.45 C ATOM 1322 C THR A 87 14.762 2.878 4.237 1.00 34.12 C ATOM 1323 O THR A 87 15.069 1.734 4.575 1.00 64.45 O ATOM 1324 CB THR A 87 16.809 4.272 3.879 1.00 52.35 C ATOM 1325 OG1 THR A 87 17.391 5.254 3.040 1.00 72.20 O ATOM 1326 CG2 THR A 87 17.889 3.270 4.230 1.00 23.13 C ATOM 0 H THR A 87 15.149 5.609 2.645 1.00 20.44 H new ATOM 0 HA THR A 87 15.929 2.929 2.449 1.00 34.45 H new ATOM 0 HB THR A 87 16.431 4.714 4.801 1.00 52.35 H new ATOM 0 HG1 THR A 87 18.167 5.650 3.489 1.00 72.20 H new ATOM 0 HG21 THR A 87 18.724 3.786 4.705 1.00 23.13 H new ATOM 0 HG22 THR A 87 17.485 2.525 4.916 1.00 23.13 H new ATOM 0 HG23 THR A 87 18.236 2.777 3.322 1.00 23.13 H new ATOM 1334 N LYS A 88 13.708 3.520 4.736 1.00 31.53 N ATOM 1335 CA LYS A 88 12.837 2.906 5.724 1.00 34.32 C ATOM 1336 C LYS A 88 12.040 1.761 5.105 1.00 53.41 C ATOM 1337 O LYS A 88 11.925 0.683 5.690 1.00 32.33 O ATOM 1338 CB LYS A 88 11.893 3.962 6.309 1.00 22.42 C ATOM 1339 CG LYS A 88 10.724 3.381 7.084 1.00 10.12 C ATOM 1340 CD LYS A 88 10.529 4.087 8.416 1.00 21.35 C ATOM 1341 CE LYS A 88 11.375 3.455 9.509 1.00 55.04 C ATOM 1342 NZ LYS A 88 11.694 4.422 10.595 1.00 73.04 N ATOM 0 H LYS A 88 13.440 4.467 4.469 1.00 31.53 H new ATOM 0 HA LYS A 88 13.451 2.494 6.525 1.00 34.32 H new ATOM 0 HB2 LYS A 88 12.462 4.619 6.967 1.00 22.42 H new ATOM 0 HB3 LYS A 88 11.507 4.580 5.498 1.00 22.42 H new ATOM 0 HG2 LYS A 88 9.814 3.467 6.490 1.00 10.12 H new ATOM 0 HG3 LYS A 88 10.893 2.318 7.256 1.00 10.12 H new ATOM 0 HD2 LYS A 88 10.792 5.140 8.313 1.00 21.35 H new ATOM 0 HD3 LYS A 88 9.477 4.048 8.700 1.00 21.35 H new ATOM 0 HE2 LYS A 88 10.845 2.600 9.929 1.00 55.04 H new ATOM 0 HE3 LYS A 88 12.301 3.076 9.077 1.00 55.04 H new ATOM 0 HZ1 LYS A 88 12.272 3.951 11.320 1.00 73.04 H new ATOM 0 HZ2 LYS A 88 12.222 5.226 10.200 1.00 73.04 H new ATOM 0 HZ3 LYS A 88 10.811 4.765 11.025 1.00 73.04 H new ATOM 1356 N SER A 89 11.494 1.998 3.915 1.00 31.10 N ATOM 1357 CA SER A 89 10.712 0.983 3.217 1.00 42.43 C ATOM 1358 C SER A 89 11.535 -0.285 3.012 1.00 51.04 C ATOM 1359 O SER A 89 11.050 -1.396 3.223 1.00 61.41 O ATOM 1360 CB SER A 89 10.230 1.517 1.867 1.00 41.11 C ATOM 1361 OG SER A 89 9.866 0.458 0.997 1.00 53.33 O ATOM 0 H SER A 89 11.579 2.883 3.415 1.00 31.10 H new ATOM 0 HA SER A 89 9.845 0.740 3.831 1.00 42.43 H new ATOM 0 HB2 SER A 89 9.376 2.177 2.018 1.00 41.11 H new ATOM 0 HB3 SER A 89 11.017 2.115 1.407 1.00 41.11 H new ATOM 0 HG SER A 89 9.410 -0.243 1.508 1.00 53.33 H new ATOM 1367 N PHE A 90 12.789 -0.107 2.605 1.00 73.52 N ATOM 1368 CA PHE A 90 13.687 -1.231 2.377 1.00 25.10 C ATOM 1369 C PHE A 90 13.868 -2.049 3.653 1.00 74.34 C ATOM 1370 O PHE A 90 14.180 -3.239 3.601 1.00 35.42 O ATOM 1371 CB PHE A 90 15.045 -0.727 1.883 1.00 63.30 C ATOM 1372 CG PHE A 90 15.926 -1.809 1.328 1.00 10.22 C ATOM 1373 CD1 PHE A 90 15.427 -2.736 0.426 1.00 52.11 C ATOM 1374 CD2 PHE A 90 17.256 -1.898 1.706 1.00 61.12 C ATOM 1375 CE1 PHE A 90 16.237 -3.729 -0.088 1.00 50.04 C ATOM 1376 CE2 PHE A 90 18.072 -2.889 1.195 1.00 4.13 C ATOM 1377 CZ PHE A 90 17.562 -3.806 0.297 1.00 50.12 C ATOM 0 H PHE A 90 13.205 0.807 2.427 1.00 73.52 H new ATOM 0 HA PHE A 90 13.244 -1.873 1.616 1.00 25.10 H new ATOM 0 HB2 PHE A 90 14.884 0.028 1.114 1.00 63.30 H new ATOM 0 HB3 PHE A 90 15.562 -0.237 2.708 1.00 63.30 H new ATOM 0 HD1 PHE A 90 14.392 -2.681 0.122 1.00 52.11 H new ATOM 0 HD2 PHE A 90 17.660 -1.184 2.409 1.00 61.12 H new ATOM 0 HE1 PHE A 90 15.836 -4.445 -0.790 1.00 50.04 H new ATOM 0 HE2 PHE A 90 19.107 -2.946 1.497 1.00 4.13 H new ATOM 0 HZ PHE A 90 18.198 -4.582 -0.104 1.00 50.12 H new ATOM 1387 N GLU A 91 13.672 -1.400 4.797 1.00 33.01 N ATOM 1388 CA GLU A 91 13.814 -2.064 6.089 1.00 55.42 C ATOM 1389 C GLU A 91 12.591 -2.922 6.400 1.00 64.11 C ATOM 1390 O GLU A 91 12.707 -3.986 7.009 1.00 44.22 O ATOM 1391 CB GLU A 91 14.018 -1.026 7.193 1.00 41.04 C ATOM 1392 CG GLU A 91 15.170 -0.071 6.924 1.00 44.21 C ATOM 1393 CD GLU A 91 16.114 0.055 8.104 1.00 20.33 C ATOM 1394 OE1 GLU A 91 16.503 -0.991 8.666 1.00 53.15 O ATOM 1395 OE2 GLU A 91 16.465 1.197 8.465 1.00 4.02 O ATOM 0 H GLU A 91 13.414 -0.415 4.856 1.00 33.01 H new ATOM 0 HA GLU A 91 14.687 -2.716 6.043 1.00 55.42 H new ATOM 0 HB2 GLU A 91 13.100 -0.450 7.313 1.00 41.04 H new ATOM 0 HB3 GLU A 91 14.197 -1.542 8.137 1.00 41.04 H new ATOM 0 HG2 GLU A 91 15.727 -0.417 6.053 1.00 44.21 H new ATOM 0 HG3 GLU A 91 14.771 0.913 6.677 1.00 44.21 H new ATOM 1402 N ASP A 92 11.420 -2.452 5.982 1.00 14.14 N ATOM 1403 CA ASP A 92 10.177 -3.177 6.220 1.00 34.20 C ATOM 1404 C ASP A 92 10.054 -4.377 5.285 1.00 22.04 C ATOM 1405 O ASP A 92 9.506 -5.414 5.659 1.00 60.34 O ATOM 1406 CB ASP A 92 8.977 -2.246 6.036 1.00 54.12 C ATOM 1407 CG ASP A 92 9.081 -0.995 6.884 1.00 34.31 C ATOM 1408 OD1 ASP A 92 8.892 -1.093 8.114 1.00 73.43 O ATOM 1409 OD2 ASP A 92 9.353 0.085 6.318 1.00 60.12 O ATOM 0 H ASP A 92 11.306 -1.573 5.477 1.00 14.14 H new ATOM 0 HA ASP A 92 10.192 -3.543 7.247 1.00 34.20 H new ATOM 0 HB2 ASP A 92 8.897 -1.964 4.986 1.00 54.12 H new ATOM 0 HB3 ASP A 92 8.063 -2.781 6.293 1.00 54.12 H new ATOM 1414 N ILE A 93 10.568 -4.230 4.068 1.00 22.43 N ATOM 1415 CA ILE A 93 10.522 -5.292 3.083 1.00 63.01 C ATOM 1416 C ILE A 93 11.247 -6.538 3.589 1.00 70.33 C ATOM 1417 O ILE A 93 10.906 -7.660 3.215 1.00 20.13 O ATOM 1418 CB ILE A 93 11.156 -4.818 1.761 1.00 2.14 C ATOM 1419 CG1 ILE A 93 10.293 -3.751 1.097 1.00 3.42 C ATOM 1420 CG2 ILE A 93 11.357 -5.975 0.814 1.00 23.00 C ATOM 1421 CD1 ILE A 93 8.847 -4.161 0.914 1.00 41.20 C ATOM 0 H ILE A 93 11.023 -3.377 3.744 1.00 22.43 H new ATOM 0 HA ILE A 93 9.477 -5.548 2.909 1.00 63.01 H new ATOM 0 HB ILE A 93 12.129 -4.386 1.998 1.00 2.14 H new ATOM 0 HG12 ILE A 93 10.330 -2.842 1.697 1.00 3.42 H new ATOM 0 HG13 ILE A 93 10.718 -3.508 0.123 1.00 3.42 H new ATOM 0 HG21 ILE A 93 11.806 -5.614 -0.111 1.00 23.00 H new ATOM 0 HG22 ILE A 93 12.016 -6.711 1.274 1.00 23.00 H new ATOM 0 HG23 ILE A 93 10.394 -6.437 0.594 1.00 23.00 H new ATOM 0 HD11 ILE A 93 8.297 -3.351 0.436 1.00 41.20 H new ATOM 0 HD12 ILE A 93 8.798 -5.052 0.288 1.00 41.20 H new ATOM 0 HD13 ILE A 93 8.404 -4.376 1.886 1.00 41.20 H new ATOM 1433 N HIS A 94 12.249 -6.331 4.437 1.00 30.24 N ATOM 1434 CA HIS A 94 13.023 -7.436 4.991 1.00 22.42 C ATOM 1435 C HIS A 94 12.217 -8.189 6.048 1.00 25.44 C ATOM 1436 O HIS A 94 12.036 -9.403 5.956 1.00 74.31 O ATOM 1437 CB HIS A 94 14.330 -6.909 5.594 1.00 54.53 C ATOM 1438 CG HIS A 94 15.010 -7.876 6.519 1.00 65.44 C ATOM 1439 ND1 HIS A 94 15.526 -9.084 6.099 1.00 41.40 N ATOM 1440 CD2 HIS A 94 15.249 -7.808 7.849 1.00 1.11 C ATOM 1441 CE1 HIS A 94 16.053 -9.718 7.132 1.00 42.12 C ATOM 1442 NE2 HIS A 94 15.898 -8.964 8.205 1.00 34.22 N ATOM 0 H HIS A 94 12.544 -5.408 4.756 1.00 30.24 H new ATOM 0 HA HIS A 94 13.258 -8.131 4.185 1.00 22.42 H new ATOM 0 HB2 HIS A 94 15.014 -6.654 4.785 1.00 54.53 H new ATOM 0 HB3 HIS A 94 14.122 -5.988 6.138 1.00 54.53 H new ATOM 0 HD1 HIS A 94 15.504 -9.433 5.141 1.00 41.40 H new ATOM 0 HD2 HIS A 94 14.979 -6.996 8.508 1.00 1.11 H new ATOM 0 HE1 HIS A 94 16.529 -10.687 7.103 1.00 42.12 H new ATOM 1451 N GLN A 95 11.741 -7.461 7.053 1.00 51.43 N ATOM 1452 CA GLN A 95 10.961 -8.061 8.128 1.00 23.42 C ATOM 1453 C GLN A 95 9.620 -8.578 7.615 1.00 42.32 C ATOM 1454 O GLN A 95 9.059 -9.527 8.162 1.00 12.20 O ATOM 1455 CB GLN A 95 10.732 -7.046 9.248 1.00 34.11 C ATOM 1456 CG GLN A 95 10.025 -5.783 8.788 1.00 51.22 C ATOM 1457 CD GLN A 95 8.519 -5.873 8.934 1.00 34.12 C ATOM 1458 OE1 GLN A 95 7.993 -6.845 9.476 1.00 42.35 O ATOM 1459 NE2 GLN A 95 7.816 -4.857 8.449 1.00 73.15 N ATOM 0 H GLN A 95 11.882 -6.455 7.145 1.00 51.43 H new ATOM 0 HA GLN A 95 11.527 -8.906 8.519 1.00 23.42 H new ATOM 0 HB2 GLN A 95 10.144 -7.515 10.037 1.00 34.11 H new ATOM 0 HB3 GLN A 95 11.694 -6.776 9.684 1.00 34.11 H new ATOM 0 HG2 GLN A 95 10.392 -4.934 9.365 1.00 51.22 H new ATOM 0 HG3 GLN A 95 10.274 -5.591 7.745 1.00 51.22 H new ATOM 0 HE21 GLN A 95 8.293 -4.071 8.007 1.00 73.15 H new ATOM 0 HE22 GLN A 95 6.798 -4.862 8.518 1.00 73.15 H new ATOM 1468 N TYR A 96 9.110 -7.947 6.562 1.00 34.11 N ATOM 1469 CA TYR A 96 7.833 -8.345 5.978 1.00 73.30 C ATOM 1470 C TYR A 96 7.865 -9.804 5.536 1.00 5.25 C ATOM 1471 O TYR A 96 6.863 -10.513 5.629 1.00 52.13 O ATOM 1472 CB TYR A 96 7.488 -7.444 4.792 1.00 71.15 C ATOM 1473 CG TYR A 96 6.625 -6.260 5.165 1.00 35.42 C ATOM 1474 CD1 TYR A 96 5.477 -6.429 5.930 1.00 63.24 C ATOM 1475 CD2 TYR A 96 6.958 -4.975 4.756 1.00 42.01 C ATOM 1476 CE1 TYR A 96 4.685 -5.350 6.275 1.00 33.24 C ATOM 1477 CE2 TYR A 96 6.171 -3.891 5.098 1.00 63.42 C ATOM 1478 CZ TYR A 96 5.037 -4.083 5.857 1.00 34.54 C ATOM 1479 OH TYR A 96 4.252 -3.007 6.200 1.00 65.12 O ATOM 0 H TYR A 96 9.560 -7.159 6.096 1.00 34.11 H new ATOM 0 HA TYR A 96 7.063 -8.236 6.742 1.00 73.30 H new ATOM 0 HB2 TYR A 96 8.412 -7.082 4.340 1.00 71.15 H new ATOM 0 HB3 TYR A 96 6.973 -8.035 4.035 1.00 71.15 H new ATOM 0 HD1 TYR A 96 5.199 -7.419 6.260 1.00 63.24 H new ATOM 0 HD2 TYR A 96 7.846 -4.820 4.161 1.00 42.01 H new ATOM 0 HE1 TYR A 96 3.795 -5.498 6.869 1.00 33.24 H new ATOM 0 HE2 TYR A 96 6.444 -2.898 4.772 1.00 63.42 H new ATOM 0 HH TYR A 96 3.551 -2.885 5.526 1.00 65.12 H new ATOM 1489 N ARG A 97 9.022 -10.248 5.054 1.00 22.41 N ATOM 1490 CA ARG A 97 9.184 -11.623 4.601 1.00 42.31 C ATOM 1491 C ARG A 97 8.935 -12.603 5.743 1.00 63.11 C ATOM 1492 O ARG A 97 8.331 -13.657 5.549 1.00 34.43 O ATOM 1493 CB ARG A 97 10.589 -11.822 4.034 1.00 70.11 C ATOM 1494 CG ARG A 97 10.869 -13.245 3.583 1.00 45.31 C ATOM 1495 CD ARG A 97 12.358 -13.488 3.432 1.00 65.21 C ATOM 1496 NE ARG A 97 13.001 -13.762 4.716 1.00 13.02 N ATOM 1497 CZ ARG A 97 14.120 -14.471 4.854 1.00 60.41 C ATOM 1498 NH1 ARG A 97 14.724 -14.990 3.791 1.00 2.41 N ATOM 1499 NH2 ARG A 97 14.636 -14.665 6.059 1.00 54.03 N ATOM 0 H ARG A 97 9.861 -9.674 4.968 1.00 22.41 H new ATOM 0 HA ARG A 97 8.451 -11.818 3.818 1.00 42.31 H new ATOM 0 HB2 ARG A 97 10.729 -11.148 3.189 1.00 70.11 H new ATOM 0 HB3 ARG A 97 11.320 -11.540 4.791 1.00 70.11 H new ATOM 0 HG2 ARG A 97 10.455 -13.947 4.307 1.00 45.31 H new ATOM 0 HG3 ARG A 97 10.369 -13.434 2.633 1.00 45.31 H new ATOM 0 HD2 ARG A 97 12.522 -14.329 2.758 1.00 65.21 H new ATOM 0 HD3 ARG A 97 12.823 -12.616 2.972 1.00 65.21 H new ATOM 0 HE ARG A 97 12.566 -13.387 5.559 1.00 13.02 H new ATOM 0 HH11 ARG A 97 14.331 -14.847 2.861 1.00 2.41 H new ATOM 0 HH12 ARG A 97 15.581 -15.532 3.905 1.00 2.41 H new ATOM 0 HH21 ARG A 97 14.176 -14.271 6.880 1.00 54.03 H new ATOM 0 HH22 ARG A 97 15.493 -15.208 6.165 1.00 54.03 H new ATOM 1513 N GLU A 98 9.406 -12.247 6.934 1.00 41.10 N ATOM 1514 CA GLU A 98 9.235 -13.093 8.110 1.00 55.14 C ATOM 1515 C GLU A 98 7.758 -13.376 8.370 1.00 62.12 C ATOM 1516 O GLU A 98 7.401 -14.427 8.903 1.00 44.21 O ATOM 1517 CB GLU A 98 9.864 -12.431 9.336 1.00 54.42 C ATOM 1518 CG GLU A 98 11.354 -12.169 9.189 1.00 33.50 C ATOM 1519 CD GLU A 98 12.124 -12.447 10.465 1.00 70.13 C ATOM 1520 OE1 GLU A 98 11.859 -13.487 11.103 1.00 13.52 O ATOM 1521 OE2 GLU A 98 12.992 -11.625 10.825 1.00 52.33 O ATOM 0 H GLU A 98 9.910 -11.378 7.110 1.00 41.10 H new ATOM 0 HA GLU A 98 9.738 -14.041 7.920 1.00 55.14 H new ATOM 0 HB2 GLU A 98 9.355 -11.487 9.530 1.00 54.42 H new ATOM 0 HB3 GLU A 98 9.699 -13.066 10.206 1.00 54.42 H new ATOM 0 HG2 GLU A 98 11.751 -12.791 8.387 1.00 33.50 H new ATOM 0 HG3 GLU A 98 11.509 -11.131 8.894 1.00 33.50 H new ATOM 1528 N GLN A 99 6.904 -12.431 7.991 1.00 31.25 N ATOM 1529 CA GLN A 99 5.466 -12.578 8.183 1.00 22.21 C ATOM 1530 C GLN A 99 4.897 -13.630 7.234 1.00 42.21 C ATOM 1531 O GLN A 99 3.996 -14.385 7.598 1.00 30.44 O ATOM 1532 CB GLN A 99 4.761 -11.236 7.966 1.00 3.12 C ATOM 1533 CG GLN A 99 4.118 -10.677 9.223 1.00 33.33 C ATOM 1534 CD GLN A 99 2.635 -10.983 9.305 1.00 13.31 C ATOM 1535 OE1 GLN A 99 2.209 -12.113 9.067 1.00 61.31 O ATOM 1536 NE2 GLN A 99 1.840 -9.975 9.644 1.00 15.34 N ATOM 0 H GLN A 99 7.183 -11.555 7.549 1.00 31.25 H new ATOM 0 HA GLN A 99 5.291 -12.908 9.207 1.00 22.21 H new ATOM 0 HB2 GLN A 99 5.483 -10.513 7.585 1.00 3.12 H new ATOM 0 HB3 GLN A 99 3.996 -11.357 7.199 1.00 3.12 H new ATOM 0 HG2 GLN A 99 4.619 -11.091 10.098 1.00 33.33 H new ATOM 0 HG3 GLN A 99 4.265 -9.597 9.252 1.00 33.33 H new ATOM 0 HE21 GLN A 99 2.236 -9.054 9.833 1.00 15.34 H new ATOM 0 HE22 GLN A 99 0.833 -10.121 9.716 1.00 15.34 H new ATOM 1545 N ILE A 100 5.429 -13.671 6.017 1.00 15.45 N ATOM 1546 CA ILE A 100 4.976 -14.629 5.015 1.00 35.31 C ATOM 1547 C ILE A 100 5.396 -16.049 5.382 1.00 62.13 C ATOM 1548 O ILE A 100 4.576 -16.967 5.389 1.00 20.52 O ATOM 1549 CB ILE A 100 5.528 -14.283 3.618 1.00 4.31 C ATOM 1550 CG1 ILE A 100 5.159 -12.846 3.244 1.00 21.34 C ATOM 1551 CG2 ILE A 100 4.998 -15.260 2.579 1.00 0.42 C ATOM 1552 CD1 ILE A 100 5.934 -12.311 2.060 1.00 31.55 C ATOM 0 H ILE A 100 6.175 -13.051 5.701 1.00 15.45 H new ATOM 0 HA ILE A 100 3.888 -14.572 4.990 1.00 35.31 H new ATOM 0 HB ILE A 100 6.615 -14.366 3.642 1.00 4.31 H new ATOM 0 HG12 ILE A 100 4.093 -12.800 3.021 1.00 21.34 H new ATOM 0 HG13 ILE A 100 5.333 -12.199 4.104 1.00 21.34 H new ATOM 0 HG21 ILE A 100 5.398 -15.001 1.599 1.00 0.42 H new ATOM 0 HG22 ILE A 100 5.306 -16.272 2.841 1.00 0.42 H new ATOM 0 HG23 ILE A 100 3.910 -15.208 2.552 1.00 0.42 H new ATOM 0 HD11 ILE A 100 5.620 -11.288 1.852 1.00 31.55 H new ATOM 0 HD12 ILE A 100 7.000 -12.325 2.287 1.00 31.55 H new ATOM 0 HD13 ILE A 100 5.741 -12.934 1.187 1.00 31.55 H new ATOM 1564 N LYS A 101 6.679 -16.221 5.687 1.00 3.44 N ATOM 1565 CA LYS A 101 7.211 -17.531 6.056 1.00 60.11 C ATOM 1566 C LYS A 101 6.365 -18.175 7.152 1.00 71.32 C ATOM 1567 O LYS A 101 6.108 -19.378 7.125 1.00 10.31 O ATOM 1568 CB LYS A 101 8.661 -17.399 6.525 1.00 52.33 C ATOM 1569 CG LYS A 101 9.303 -18.724 6.903 1.00 71.22 C ATOM 1570 CD LYS A 101 10.792 -18.726 6.601 1.00 63.34 C ATOM 1571 CE LYS A 101 11.547 -17.773 7.512 1.00 42.13 C ATOM 1572 NZ LYS A 101 11.983 -18.437 8.771 1.00 22.34 N ATOM 0 H LYS A 101 7.370 -15.471 5.686 1.00 3.44 H new ATOM 0 HA LYS A 101 7.177 -18.172 5.175 1.00 60.11 H new ATOM 0 HB2 LYS A 101 9.249 -16.933 5.734 1.00 52.33 H new ATOM 0 HB3 LYS A 101 8.696 -16.730 7.385 1.00 52.33 H new ATOM 0 HG2 LYS A 101 9.145 -18.916 7.964 1.00 71.22 H new ATOM 0 HG3 LYS A 101 8.819 -19.533 6.357 1.00 71.22 H new ATOM 0 HD2 LYS A 101 11.187 -19.735 6.721 1.00 63.34 H new ATOM 0 HD3 LYS A 101 10.954 -18.442 5.561 1.00 63.34 H new ATOM 0 HE2 LYS A 101 12.419 -17.383 6.987 1.00 42.13 H new ATOM 0 HE3 LYS A 101 10.912 -16.921 7.752 1.00 42.13 H new ATOM 0 HZ1 LYS A 101 12.494 -17.753 9.365 1.00 22.34 H new ATOM 0 HZ2 LYS A 101 11.150 -18.787 9.285 1.00 22.34 H new ATOM 0 HZ3 LYS A 101 12.610 -19.235 8.544 1.00 22.34 H new ATOM 1586 N ARG A 102 5.935 -17.364 8.113 1.00 63.53 N ATOM 1587 CA ARG A 102 5.121 -17.850 9.216 1.00 14.44 C ATOM 1588 C ARG A 102 3.788 -18.399 8.716 1.00 54.30 C ATOM 1589 O ARG A 102 3.469 -19.568 8.931 1.00 34.23 O ATOM 1590 CB ARG A 102 4.878 -16.725 10.221 1.00 62.00 C ATOM 1591 CG ARG A 102 5.120 -17.140 11.657 1.00 12.13 C ATOM 1592 CD ARG A 102 5.506 -15.953 12.525 1.00 72.21 C ATOM 1593 NE ARG A 102 5.263 -16.209 13.942 1.00 21.04 N ATOM 1594 CZ ARG A 102 4.051 -16.228 14.493 1.00 4.50 C ATOM 1595 NH1 ARG A 102 2.974 -16.010 13.751 1.00 41.43 N ATOM 1596 NH2 ARG A 102 3.918 -16.467 15.791 1.00 73.31 N ATOM 0 H ARG A 102 6.139 -16.365 8.148 1.00 63.53 H new ATOM 0 HA ARG A 102 5.661 -18.661 9.705 1.00 14.44 H new ATOM 0 HB2 ARG A 102 5.528 -15.884 9.979 1.00 62.00 H new ATOM 0 HB3 ARG A 102 3.851 -16.373 10.120 1.00 62.00 H new ATOM 0 HG2 ARG A 102 4.221 -17.607 12.058 1.00 12.13 H new ATOM 0 HG3 ARG A 102 5.911 -17.889 11.691 1.00 12.13 H new ATOM 0 HD2 ARG A 102 6.560 -15.721 12.374 1.00 72.21 H new ATOM 0 HD3 ARG A 102 4.939 -15.076 12.213 1.00 72.21 H new ATOM 0 HE ARG A 102 6.068 -16.383 14.544 1.00 21.04 H new ATOM 0 HH11 ARG A 102 3.071 -15.826 12.752 1.00 41.43 H new ATOM 0 HH12 ARG A 102 2.048 -16.026 14.179 1.00 41.43 H new ATOM 0 HH21 ARG A 102 4.744 -16.636 16.366 1.00 73.31 H new ATOM 0 HH22 ARG A 102 2.990 -16.482 16.214 1.00 73.31 H new ATOM 1610 N VAL A 103 3.015 -17.550 8.047 1.00 12.44 N ATOM 1611 CA VAL A 103 1.720 -17.952 7.519 1.00 20.51 C ATOM 1612 C VAL A 103 1.861 -19.138 6.572 1.00 42.21 C ATOM 1613 O VAL A 103 1.347 -20.224 6.839 1.00 23.32 O ATOM 1614 CB VAL A 103 1.035 -16.789 6.776 1.00 34.12 C ATOM 1615 CG1 VAL A 103 -0.332 -17.209 6.263 1.00 62.44 C ATOM 1616 CG2 VAL A 103 0.921 -15.573 7.683 1.00 4.31 C ATOM 0 H VAL A 103 3.265 -16.579 7.858 1.00 12.44 H new ATOM 0 HA VAL A 103 1.103 -18.242 8.369 1.00 20.51 H new ATOM 0 HB VAL A 103 1.650 -16.520 5.917 1.00 34.12 H new ATOM 0 HG11 VAL A 103 -0.798 -16.373 5.742 1.00 62.44 H new ATOM 0 HG12 VAL A 103 -0.221 -18.048 5.576 1.00 62.44 H new ATOM 0 HG13 VAL A 103 -0.960 -17.508 7.103 1.00 62.44 H new ATOM 0 HG21 VAL A 103 0.435 -14.761 7.143 1.00 4.31 H new ATOM 0 HG22 VAL A 103 0.330 -15.829 8.562 1.00 4.31 H new ATOM 0 HG23 VAL A 103 1.917 -15.257 7.995 1.00 4.31 H new ATOM 1626 N LYS A 104 2.565 -18.922 5.466 1.00 62.35 N ATOM 1627 CA LYS A 104 2.778 -19.974 4.480 1.00 63.42 C ATOM 1628 C LYS A 104 3.499 -21.164 5.107 1.00 34.51 C ATOM 1629 O LYS A 104 3.394 -22.290 4.623 1.00 60.05 O ATOM 1630 CB LYS A 104 3.588 -19.437 3.298 1.00 41.20 C ATOM 1631 CG LYS A 104 2.868 -18.359 2.507 1.00 15.34 C ATOM 1632 CD LYS A 104 2.034 -18.954 1.383 1.00 45.11 C ATOM 1633 CE LYS A 104 2.879 -19.238 0.150 1.00 24.54 C ATOM 1634 NZ LYS A 104 2.786 -20.663 -0.270 1.00 41.12 N ATOM 0 H LYS A 104 2.997 -18.029 5.230 1.00 62.35 H new ATOM 0 HA LYS A 104 1.804 -20.307 4.122 1.00 63.42 H new ATOM 0 HB2 LYS A 104 4.532 -19.036 3.667 1.00 41.20 H new ATOM 0 HB3 LYS A 104 3.833 -20.263 2.631 1.00 41.20 H new ATOM 0 HG2 LYS A 104 2.225 -17.785 3.174 1.00 15.34 H new ATOM 0 HG3 LYS A 104 3.597 -17.663 2.091 1.00 15.34 H new ATOM 0 HD2 LYS A 104 1.567 -19.877 1.725 1.00 45.11 H new ATOM 0 HD3 LYS A 104 1.229 -18.267 1.123 1.00 45.11 H new ATOM 0 HE2 LYS A 104 2.554 -18.596 -0.669 1.00 24.54 H new ATOM 0 HE3 LYS A 104 3.919 -18.988 0.357 1.00 24.54 H new ATOM 0 HZ1 LYS A 104 3.376 -20.816 -1.113 1.00 41.12 H new ATOM 0 HZ2 LYS A 104 3.120 -21.275 0.502 1.00 41.12 H new ATOM 0 HZ3 LYS A 104 1.797 -20.895 -0.493 1.00 41.12 H new ATOM 1648 N ASP A 105 4.230 -20.905 6.188 1.00 11.10 N ATOM 1649 CA ASP A 105 4.965 -21.955 6.879 1.00 2.15 C ATOM 1650 C ASP A 105 5.990 -22.596 5.950 1.00 74.14 C ATOM 1651 O ASP A 105 6.139 -23.816 5.918 1.00 22.02 O ATOM 1652 CB ASP A 105 3.997 -23.015 7.408 1.00 72.25 C ATOM 1653 CG ASP A 105 4.613 -23.872 8.495 1.00 40.43 C ATOM 1654 OD1 ASP A 105 5.574 -23.407 9.145 1.00 32.01 O ATOM 1655 OD2 ASP A 105 4.136 -25.008 8.697 1.00 15.10 O ATOM 0 H ASP A 105 4.328 -19.978 6.602 1.00 11.10 H new ATOM 0 HA ASP A 105 5.495 -21.508 7.720 1.00 2.15 H new ATOM 0 HB2 ASP A 105 3.105 -22.525 7.798 1.00 72.25 H new ATOM 0 HB3 ASP A 105 3.676 -23.653 6.584 1.00 72.25 H new ATOM 1660 N SER A 106 6.692 -21.759 5.192 1.00 50.12 N ATOM 1661 CA SER A 106 7.703 -22.242 4.258 1.00 34.42 C ATOM 1662 C SER A 106 8.836 -21.233 4.109 1.00 15.41 C ATOM 1663 O SER A 106 8.616 -20.022 4.168 1.00 63.12 O ATOM 1664 CB SER A 106 7.071 -22.523 2.893 1.00 64.13 C ATOM 1665 OG SER A 106 6.500 -23.819 2.852 1.00 14.31 O ATOM 0 H SER A 106 6.580 -20.745 5.206 1.00 50.12 H new ATOM 0 HA SER A 106 8.118 -23.167 4.658 1.00 34.42 H new ATOM 0 HB2 SER A 106 6.304 -21.778 2.684 1.00 64.13 H new ATOM 0 HB3 SER A 106 7.827 -22.430 2.113 1.00 64.13 H new ATOM 0 HG SER A 106 6.298 -24.116 3.764 1.00 14.31 H new ATOM 1671 N ASP A 107 10.048 -21.740 3.917 1.00 0.21 N ATOM 1672 CA ASP A 107 11.219 -20.885 3.760 1.00 35.11 C ATOM 1673 C ASP A 107 11.360 -20.409 2.318 1.00 11.22 C ATOM 1674 O ASP A 107 11.909 -19.337 2.061 1.00 72.12 O ATOM 1675 CB ASP A 107 12.483 -21.635 4.187 1.00 21.14 C ATOM 1676 CG ASP A 107 12.729 -22.876 3.353 1.00 44.41 C ATOM 1677 OD1 ASP A 107 11.799 -23.701 3.228 1.00 52.15 O ATOM 1678 OD2 ASP A 107 13.852 -23.025 2.826 1.00 74.22 O ATOM 0 H ASP A 107 10.246 -22.739 3.866 1.00 0.21 H new ATOM 0 HA ASP A 107 11.087 -20.012 4.399 1.00 35.11 H new ATOM 0 HB2 ASP A 107 13.342 -20.969 4.105 1.00 21.14 H new ATOM 0 HB3 ASP A 107 12.398 -21.917 5.236 1.00 21.14 H new ATOM 1683 N ASP A 108 10.866 -21.210 1.380 1.00 34.35 N ATOM 1684 CA ASP A 108 10.943 -20.866 -0.034 1.00 10.23 C ATOM 1685 C ASP A 108 9.596 -20.374 -0.554 1.00 73.12 C ATOM 1686 O ASP A 108 8.866 -21.113 -1.214 1.00 0.51 O ATOM 1687 CB ASP A 108 11.406 -22.074 -0.851 1.00 12.40 C ATOM 1688 CG ASP A 108 12.821 -22.496 -0.506 1.00 73.24 C ATOM 1689 OD1 ASP A 108 13.738 -21.660 -0.638 1.00 31.21 O ATOM 1690 OD2 ASP A 108 13.011 -23.663 -0.104 1.00 25.02 O ATOM 0 H ASP A 108 10.409 -22.101 1.574 1.00 34.35 H new ATOM 0 HA ASP A 108 11.669 -20.060 -0.143 1.00 10.23 H new ATOM 0 HB2 ASP A 108 10.728 -22.909 -0.676 1.00 12.40 H new ATOM 0 HB3 ASP A 108 11.350 -21.834 -1.913 1.00 12.40 H new ATOM 1695 N VAL A 109 9.274 -19.120 -0.254 1.00 51.42 N ATOM 1696 CA VAL A 109 8.029 -18.524 -0.685 1.00 2.33 C ATOM 1697 C VAL A 109 8.191 -17.835 -2.036 1.00 42.01 C ATOM 1698 O VAL A 109 9.170 -17.127 -2.275 1.00 0.41 O ATOM 1699 CB VAL A 109 7.519 -17.503 0.344 1.00 21.11 C ATOM 1700 CG1 VAL A 109 6.158 -16.965 -0.064 1.00 73.22 C ATOM 1701 CG2 VAL A 109 7.465 -18.133 1.726 1.00 23.52 C ATOM 0 H VAL A 109 9.869 -18.497 0.292 1.00 51.42 H new ATOM 0 HA VAL A 109 7.301 -19.330 -0.779 1.00 2.33 H new ATOM 0 HB VAL A 109 8.213 -16.663 0.377 1.00 21.11 H new ATOM 0 HG11 VAL A 109 5.815 -16.244 0.678 1.00 73.22 H new ATOM 0 HG12 VAL A 109 6.236 -16.477 -1.036 1.00 73.22 H new ATOM 0 HG13 VAL A 109 5.446 -17.788 -0.127 1.00 73.22 H new ATOM 0 HG21 VAL A 109 7.102 -17.400 2.446 1.00 23.52 H new ATOM 0 HG22 VAL A 109 6.791 -18.989 1.709 1.00 23.52 H new ATOM 0 HG23 VAL A 109 8.463 -18.462 2.015 1.00 23.52 H new ATOM 1711 N PRO A 110 7.223 -18.038 -2.935 1.00 32.04 N ATOM 1712 CA PRO A 110 7.238 -17.444 -4.273 1.00 70.42 C ATOM 1713 C PRO A 110 6.900 -15.956 -4.248 1.00 20.50 C ATOM 1714 O PRO A 110 5.732 -15.578 -4.150 1.00 11.35 O ATOM 1715 CB PRO A 110 6.155 -18.226 -5.014 1.00 13.45 C ATOM 1716 CG PRO A 110 5.208 -18.669 -3.950 1.00 24.51 C ATOM 1717 CD PRO A 110 6.035 -18.873 -2.708 1.00 63.44 C ATOM 0 HA PRO A 110 8.222 -17.504 -4.739 1.00 70.42 H new ATOM 0 HB2 PRO A 110 5.654 -17.603 -5.755 1.00 13.45 H new ATOM 0 HB3 PRO A 110 6.577 -19.078 -5.547 1.00 13.45 H new ATOM 0 HG2 PRO A 110 4.433 -17.921 -3.783 1.00 24.51 H new ATOM 0 HG3 PRO A 110 4.704 -19.592 -4.238 1.00 24.51 H new ATOM 0 HD2 PRO A 110 5.495 -18.565 -1.813 1.00 63.44 H new ATOM 0 HD3 PRO A 110 6.303 -19.921 -2.574 1.00 63.44 H new ATOM 1725 N MET A 111 7.928 -15.120 -4.339 1.00 71.42 N ATOM 1726 CA MET A 111 7.738 -13.674 -4.328 1.00 21.55 C ATOM 1727 C MET A 111 8.798 -12.977 -5.172 1.00 2.25 C ATOM 1728 O MET A 111 9.712 -13.619 -5.691 1.00 3.14 O ATOM 1729 CB MET A 111 7.779 -13.139 -2.896 1.00 50.35 C ATOM 1730 CG MET A 111 9.135 -13.297 -2.223 1.00 73.21 C ATOM 1731 SD MET A 111 9.127 -14.543 -0.921 1.00 4.41 S ATOM 1732 CE MET A 111 8.327 -13.637 0.400 1.00 34.34 C ATOM 0 H MET A 111 8.900 -15.418 -4.421 1.00 71.42 H new ATOM 0 HA MET A 111 6.759 -13.463 -4.758 1.00 21.55 H new ATOM 0 HB2 MET A 111 7.508 -12.083 -2.904 1.00 50.35 H new ATOM 0 HB3 MET A 111 7.026 -13.657 -2.302 1.00 50.35 H new ATOM 0 HG2 MET A 111 9.879 -13.566 -2.973 1.00 73.21 H new ATOM 0 HG3 MET A 111 9.440 -12.339 -1.801 1.00 73.21 H new ATOM 0 HE1 MET A 111 7.882 -14.339 1.105 1.00 34.34 H new ATOM 0 HE2 MET A 111 9.063 -13.021 0.917 1.00 34.34 H new ATOM 0 HE3 MET A 111 7.548 -12.998 -0.017 1.00 34.34 H new ATOM 1742 N VAL A 112 8.673 -11.662 -5.303 1.00 41.11 N ATOM 1743 CA VAL A 112 9.623 -10.881 -6.084 1.00 41.23 C ATOM 1744 C VAL A 112 9.912 -9.537 -5.425 1.00 2.34 C ATOM 1745 O VAL A 112 9.074 -8.994 -4.704 1.00 75.32 O ATOM 1746 CB VAL A 112 9.108 -10.638 -7.516 1.00 13.30 C ATOM 1747 CG1 VAL A 112 10.181 -9.975 -8.365 1.00 20.21 C ATOM 1748 CG2 VAL A 112 8.651 -11.945 -8.147 1.00 65.22 C ATOM 0 H VAL A 112 7.924 -11.115 -4.879 1.00 41.11 H new ATOM 0 HA VAL A 112 10.544 -11.463 -6.129 1.00 41.23 H new ATOM 0 HB VAL A 112 8.252 -9.966 -7.465 1.00 13.30 H new ATOM 0 HG11 VAL A 112 9.798 -9.812 -9.373 1.00 20.21 H new ATOM 0 HG12 VAL A 112 10.456 -9.018 -7.922 1.00 20.21 H new ATOM 0 HG13 VAL A 112 11.059 -10.619 -8.410 1.00 20.21 H new ATOM 0 HG21 VAL A 112 8.291 -11.755 -9.158 1.00 65.22 H new ATOM 0 HG22 VAL A 112 9.488 -12.643 -8.186 1.00 65.22 H new ATOM 0 HG23 VAL A 112 7.847 -12.376 -7.550 1.00 65.22 H new ATOM 1758 N LEU A 113 11.103 -9.006 -5.679 1.00 51.12 N ATOM 1759 CA LEU A 113 11.507 -7.724 -5.115 1.00 74.44 C ATOM 1760 C LEU A 113 11.556 -6.650 -6.197 1.00 71.44 C ATOM 1761 O LEU A 113 12.114 -6.866 -7.272 1.00 12.32 O ATOM 1762 CB LEU A 113 12.875 -7.849 -4.441 1.00 72.43 C ATOM 1763 CG LEU A 113 13.169 -6.793 -3.375 1.00 12.31 C ATOM 1764 CD1 LEU A 113 13.179 -5.403 -3.992 1.00 14.35 C ATOM 1765 CD2 LEU A 113 12.149 -6.874 -2.250 1.00 20.00 C ATOM 0 H LEU A 113 11.807 -9.445 -6.273 1.00 51.12 H new ATOM 0 HA LEU A 113 10.768 -7.431 -4.369 1.00 74.44 H new ATOM 0 HB2 LEU A 113 12.949 -8.836 -3.984 1.00 72.43 H new ATOM 0 HB3 LEU A 113 13.648 -7.794 -5.208 1.00 72.43 H new ATOM 0 HG LEU A 113 14.156 -6.989 -2.956 1.00 12.31 H new ATOM 0 HD11 LEU A 113 13.390 -4.664 -3.219 1.00 14.35 H new ATOM 0 HD12 LEU A 113 13.949 -5.352 -4.762 1.00 14.35 H new ATOM 0 HD13 LEU A 113 12.206 -5.195 -4.437 1.00 14.35 H new ATOM 0 HD21 LEU A 113 12.373 -6.115 -1.500 1.00 20.00 H new ATOM 0 HD22 LEU A 113 11.150 -6.703 -2.651 1.00 20.00 H new ATOM 0 HD23 LEU A 113 12.191 -7.862 -1.791 1.00 20.00 H new ATOM 1777 N VAL A 114 10.969 -5.494 -5.906 1.00 1.41 N ATOM 1778 CA VAL A 114 10.948 -4.392 -6.859 1.00 63.35 C ATOM 1779 C VAL A 114 11.335 -3.076 -6.194 1.00 51.35 C ATOM 1780 O VAL A 114 11.220 -2.926 -4.977 1.00 52.13 O ATOM 1781 CB VAL A 114 9.562 -4.233 -7.512 1.00 73.41 C ATOM 1782 CG1 VAL A 114 9.331 -5.322 -8.550 1.00 42.34 C ATOM 1783 CG2 VAL A 114 8.464 -4.249 -6.459 1.00 40.45 C ATOM 0 H VAL A 114 10.503 -5.297 -5.020 1.00 1.41 H new ATOM 0 HA VAL A 114 11.679 -4.635 -7.630 1.00 63.35 H new ATOM 0 HB VAL A 114 9.531 -3.268 -8.017 1.00 73.41 H new ATOM 0 HG11 VAL A 114 8.347 -5.193 -9.000 1.00 42.34 H new ATOM 0 HG12 VAL A 114 10.096 -5.255 -9.324 1.00 42.34 H new ATOM 0 HG13 VAL A 114 9.385 -6.299 -8.070 1.00 42.34 H new ATOM 0 HG21 VAL A 114 7.494 -4.135 -6.943 1.00 40.45 H new ATOM 0 HG22 VAL A 114 8.491 -5.196 -5.919 1.00 40.45 H new ATOM 0 HG23 VAL A 114 8.619 -3.428 -5.759 1.00 40.45 H new ATOM 1793 N GLY A 115 11.794 -2.126 -7.001 1.00 1.24 N ATOM 1794 CA GLY A 115 12.192 -0.834 -6.476 1.00 52.31 C ATOM 1795 C GLY A 115 11.327 0.296 -6.999 1.00 65.41 C ATOM 1796 O GLY A 115 11.732 1.031 -7.899 1.00 73.32 O ATOM 0 H GLY A 115 11.898 -2.228 -8.011 1.00 1.24 H new ATOM 0 HA2 GLY A 115 12.138 -0.855 -5.388 1.00 52.31 H new ATOM 0 HA3 GLY A 115 13.232 -0.643 -6.740 1.00 52.31 H new ATOM 1800 N ASN A 116 10.131 0.437 -6.432 1.00 15.32 N ATOM 1801 CA ASN A 116 9.204 1.487 -6.846 1.00 72.52 C ATOM 1802 C ASN A 116 9.879 2.856 -6.820 1.00 41.34 C ATOM 1803 O ASN A 116 10.955 3.017 -6.245 1.00 15.42 O ATOM 1804 CB ASN A 116 7.971 1.493 -5.941 1.00 0.25 C ATOM 1805 CG ASN A 116 6.678 1.573 -6.728 1.00 21.53 C ATOM 1806 OD1 ASN A 116 6.685 1.831 -7.933 1.00 0.41 O ATOM 1807 ND2 ASN A 116 5.557 1.352 -6.049 1.00 54.45 N ATOM 0 H ASN A 116 9.781 -0.163 -5.685 1.00 15.32 H new ATOM 0 HA ASN A 116 8.893 1.278 -7.870 1.00 72.52 H new ATOM 0 HB2 ASN A 116 7.967 0.590 -5.331 1.00 0.25 H new ATOM 0 HB3 ASN A 116 8.030 2.339 -5.257 1.00 0.25 H new ATOM 0 HD21 ASN A 116 4.656 1.393 -6.525 1.00 54.45 H new ATOM 0 HD22 ASN A 116 5.598 1.142 -5.052 1.00 54.45 H new ATOM 1814 N LYS A 117 9.241 3.837 -7.449 1.00 55.51 N ATOM 1815 CA LYS A 117 9.781 5.189 -7.500 1.00 2.24 C ATOM 1816 C LYS A 117 11.143 5.205 -8.189 1.00 14.44 C ATOM 1817 O LYS A 117 12.147 5.604 -7.598 1.00 43.15 O ATOM 1818 CB LYS A 117 9.903 5.766 -6.087 1.00 32.32 C ATOM 1819 CG LYS A 117 8.577 6.215 -5.496 1.00 25.40 C ATOM 1820 CD LYS A 117 8.728 6.633 -4.042 1.00 32.21 C ATOM 1821 CE LYS A 117 8.252 5.540 -3.096 1.00 43.33 C ATOM 1822 NZ LYS A 117 6.779 5.591 -2.885 1.00 55.25 N ATOM 0 H LYS A 117 8.349 3.720 -7.930 1.00 55.51 H new ATOM 0 HA LYS A 117 9.094 5.807 -8.079 1.00 2.24 H new ATOM 0 HB2 LYS A 117 10.346 5.014 -5.434 1.00 32.32 H new ATOM 0 HB3 LYS A 117 10.588 6.614 -6.108 1.00 32.32 H new ATOM 0 HG2 LYS A 117 8.183 7.049 -6.076 1.00 25.40 H new ATOM 0 HG3 LYS A 117 7.852 5.405 -5.569 1.00 25.40 H new ATOM 0 HD2 LYS A 117 9.773 6.865 -3.835 1.00 32.21 H new ATOM 0 HD3 LYS A 117 8.158 7.545 -3.863 1.00 32.21 H new ATOM 0 HE2 LYS A 117 8.527 4.566 -3.499 1.00 43.33 H new ATOM 0 HE3 LYS A 117 8.760 5.643 -2.137 1.00 43.33 H new ATOM 0 HZ1 LYS A 117 6.566 5.416 -1.882 1.00 55.25 H new ATOM 0 HZ2 LYS A 117 6.422 6.529 -3.156 1.00 55.25 H new ATOM 0 HZ3 LYS A 117 6.319 4.864 -3.469 1.00 55.25 H new ATOM 1836 N CYS A 118 11.170 4.764 -9.443 1.00 22.34 N ATOM 1837 CA CYS A 118 12.409 4.725 -10.211 1.00 64.42 C ATOM 1838 C CYS A 118 12.525 5.932 -11.145 1.00 13.11 C ATOM 1839 O CYS A 118 13.441 6.001 -11.965 1.00 64.03 O ATOM 1840 CB CYS A 118 12.486 3.432 -11.022 1.00 60.31 C ATOM 1841 SG CYS A 118 14.161 2.974 -11.524 1.00 51.21 S ATOM 0 H CYS A 118 10.349 4.429 -9.948 1.00 22.34 H new ATOM 0 HA CYS A 118 13.239 4.760 -9.506 1.00 64.42 H new ATOM 0 HB2 CYS A 118 12.060 2.620 -10.432 1.00 60.31 H new ATOM 0 HB3 CYS A 118 11.867 3.537 -11.913 1.00 60.31 H new ATOM 0 HG CYS A 118 14.782 4.024 -11.972 1.00 51.21 H new ATOM 1847 N ASP A 119 11.600 6.879 -11.017 1.00 34.14 N ATOM 1848 CA ASP A 119 11.612 8.076 -11.852 1.00 10.23 C ATOM 1849 C ASP A 119 12.008 9.306 -11.040 1.00 24.11 C ATOM 1850 O ASP A 119 12.487 10.297 -11.592 1.00 10.22 O ATOM 1851 CB ASP A 119 10.240 8.292 -12.491 1.00 41.34 C ATOM 1852 CG ASP A 119 9.146 8.492 -11.461 1.00 73.51 C ATOM 1853 OD1 ASP A 119 8.751 7.500 -10.817 1.00 31.12 O ATOM 1854 OD2 ASP A 119 8.686 9.642 -11.301 1.00 71.33 O ATOM 0 H ASP A 119 10.834 6.841 -10.344 1.00 34.14 H new ATOM 0 HA ASP A 119 12.353 7.930 -12.638 1.00 10.23 H new ATOM 0 HB2 ASP A 119 10.281 9.162 -13.147 1.00 41.34 H new ATOM 0 HB3 ASP A 119 9.994 7.433 -13.116 1.00 41.34 H new ATOM 1859 N LEU A 120 11.805 9.237 -9.726 1.00 64.42 N ATOM 1860 CA LEU A 120 12.143 10.346 -8.838 1.00 2.33 C ATOM 1861 C LEU A 120 13.585 10.799 -9.057 1.00 73.14 C ATOM 1862 O LEU A 120 14.347 10.151 -9.774 1.00 65.31 O ATOM 1863 CB LEU A 120 11.937 9.934 -7.379 1.00 30.01 C ATOM 1864 CG LEU A 120 10.562 10.272 -6.802 1.00 54.40 C ATOM 1865 CD1 LEU A 120 10.454 9.786 -5.366 1.00 24.25 C ATOM 1866 CD2 LEU A 120 10.307 11.769 -6.883 1.00 40.43 C ATOM 0 H LEU A 120 11.408 8.425 -9.253 1.00 64.42 H new ATOM 0 HA LEU A 120 11.483 11.182 -9.069 1.00 2.33 H new ATOM 0 HB2 LEU A 120 12.096 8.859 -7.294 1.00 30.01 H new ATOM 0 HB3 LEU A 120 12.700 10.418 -6.769 1.00 30.01 H new ATOM 0 HG LEU A 120 9.802 9.762 -7.394 1.00 54.40 H new ATOM 0 HD11 LEU A 120 9.469 10.035 -4.971 1.00 24.25 H new ATOM 0 HD12 LEU A 120 10.595 8.706 -5.336 1.00 24.25 H new ATOM 0 HD13 LEU A 120 11.221 10.269 -4.760 1.00 24.25 H new ATOM 0 HD21 LEU A 120 9.324 11.994 -6.468 1.00 40.43 H new ATOM 0 HD22 LEU A 120 11.071 12.299 -6.314 1.00 40.43 H new ATOM 0 HD23 LEU A 120 10.343 12.088 -7.925 1.00 40.43 H new ATOM 1878 N ALA A 121 13.954 11.917 -8.438 1.00 65.32 N ATOM 1879 CA ALA A 121 15.304 12.454 -8.574 1.00 64.14 C ATOM 1880 C ALA A 121 15.968 12.644 -7.213 1.00 70.14 C ATOM 1881 O ALA A 121 16.859 13.479 -7.060 1.00 32.32 O ATOM 1882 CB ALA A 121 15.269 13.772 -9.332 1.00 71.34 C ATOM 0 H ALA A 121 13.339 12.467 -7.839 1.00 65.32 H new ATOM 0 HA ALA A 121 15.897 11.733 -9.137 1.00 64.14 H new ATOM 0 HB1 ALA A 121 16.282 14.164 -9.428 1.00 71.34 H new ATOM 0 HB2 ALA A 121 14.847 13.610 -10.324 1.00 71.34 H new ATOM 0 HB3 ALA A 121 14.653 14.488 -8.788 1.00 71.34 H new ATOM 1888 N ALA A 122 15.530 11.868 -6.226 1.00 52.31 N ATOM 1889 CA ALA A 122 16.086 11.958 -4.883 1.00 64.31 C ATOM 1890 C ALA A 122 16.090 10.595 -4.196 1.00 62.10 C ATOM 1891 O ALA A 122 15.481 10.418 -3.140 1.00 55.21 O ATOM 1892 CB ALA A 122 15.296 12.964 -4.060 1.00 31.22 C ATOM 0 H ALA A 122 14.793 11.171 -6.332 1.00 52.31 H new ATOM 0 HA ALA A 122 17.119 12.295 -4.962 1.00 64.31 H new ATOM 0 HB1 ALA A 122 15.718 13.025 -3.057 1.00 31.22 H new ATOM 0 HB2 ALA A 122 15.347 13.943 -4.536 1.00 31.22 H new ATOM 0 HB3 ALA A 122 14.256 12.645 -3.997 1.00 31.22 H new ATOM 1898 N ARG A 123 16.779 9.632 -4.801 1.00 72.53 N ATOM 1899 CA ARG A 123 16.858 8.286 -4.243 1.00 53.11 C ATOM 1900 C ARG A 123 17.909 8.214 -3.139 1.00 63.02 C ATOM 1901 O ARG A 123 18.855 9.000 -3.116 1.00 24.11 O ATOM 1902 CB ARG A 123 17.178 7.269 -5.345 1.00 32.21 C ATOM 1903 CG ARG A 123 18.616 7.332 -5.840 1.00 41.13 C ATOM 1904 CD ARG A 123 18.929 6.188 -6.792 1.00 62.23 C ATOM 1905 NE ARG A 123 20.254 5.622 -6.551 1.00 51.53 N ATOM 1906 CZ ARG A 123 20.926 4.899 -7.444 1.00 52.43 C ATOM 1907 NH1 ARG A 123 20.401 4.650 -8.637 1.00 74.55 N ATOM 1908 NH2 ARG A 123 22.127 4.424 -7.143 1.00 50.33 N ATOM 0 H ARG A 123 17.289 9.758 -5.675 1.00 72.53 H new ATOM 0 HA ARG A 123 15.888 8.042 -3.809 1.00 53.11 H new ATOM 0 HB2 ARG A 123 16.976 6.266 -4.970 1.00 32.21 H new ATOM 0 HB3 ARG A 123 16.506 7.436 -6.187 1.00 32.21 H new ATOM 0 HG2 ARG A 123 18.787 8.283 -6.344 1.00 41.13 H new ATOM 0 HG3 ARG A 123 19.297 7.295 -4.989 1.00 41.13 H new ATOM 0 HD2 ARG A 123 18.176 5.408 -6.681 1.00 62.23 H new ATOM 0 HD3 ARG A 123 18.869 6.545 -7.820 1.00 62.23 H new ATOM 0 HE ARG A 123 20.690 5.791 -5.645 1.00 51.53 H new ATOM 0 HH11 ARG A 123 19.478 5.013 -8.874 1.00 74.55 H new ATOM 0 HH12 ARG A 123 20.921 4.095 -9.317 1.00 74.55 H new ATOM 0 HH21 ARG A 123 22.535 4.613 -6.228 1.00 50.33 H new ATOM 0 HH22 ARG A 123 22.642 3.870 -7.827 1.00 50.33 H new ATOM 1922 N THR A 124 17.738 7.260 -2.229 1.00 0.33 N ATOM 1923 CA THR A 124 18.673 7.080 -1.124 1.00 2.43 C ATOM 1924 C THR A 124 19.331 5.705 -1.194 1.00 33.52 C ATOM 1925 O THR A 124 20.554 5.586 -1.123 1.00 12.13 O ATOM 1926 CB THR A 124 17.953 7.247 0.216 1.00 12.32 C ATOM 1927 OG1 THR A 124 17.026 6.196 0.423 1.00 11.21 O ATOM 1928 CG2 THR A 124 17.201 8.554 0.332 1.00 24.30 C ATOM 0 H THR A 124 16.961 6.600 -2.235 1.00 0.33 H new ATOM 0 HA THR A 124 19.448 7.842 -1.206 1.00 2.43 H new ATOM 0 HB THR A 124 18.740 7.232 0.970 1.00 12.32 H new ATOM 0 HG1 THR A 124 17.129 5.843 1.331 1.00 11.21 H new ATOM 0 HG21 THR A 124 16.714 8.608 1.305 1.00 24.30 H new ATOM 0 HG22 THR A 124 17.898 9.385 0.228 1.00 24.30 H new ATOM 0 HG23 THR A 124 16.448 8.612 -0.454 1.00 24.30 H new ATOM 1936 N VAL A 125 18.509 4.670 -1.335 1.00 11.42 N ATOM 1937 CA VAL A 125 19.005 3.305 -1.417 1.00 65.12 C ATOM 1938 C VAL A 125 19.336 2.932 -2.859 1.00 73.33 C ATOM 1939 O VAL A 125 18.443 2.669 -3.664 1.00 2.45 O ATOM 1940 CB VAL A 125 17.974 2.307 -0.859 1.00 5.24 C ATOM 1941 CG1 VAL A 125 18.516 0.888 -0.910 1.00 22.40 C ATOM 1942 CG2 VAL A 125 17.583 2.682 0.563 1.00 0.22 C ATOM 0 H VAL A 125 17.494 4.753 -1.395 1.00 11.42 H new ATOM 0 HA VAL A 125 19.912 3.253 -0.815 1.00 65.12 H new ATOM 0 HB VAL A 125 17.082 2.352 -1.484 1.00 5.24 H new ATOM 0 HG11 VAL A 125 17.771 0.199 -0.511 1.00 22.40 H new ATOM 0 HG12 VAL A 125 18.740 0.621 -1.943 1.00 22.40 H new ATOM 0 HG13 VAL A 125 19.426 0.824 -0.313 1.00 22.40 H new ATOM 0 HG21 VAL A 125 16.854 1.965 0.941 1.00 0.22 H new ATOM 0 HG22 VAL A 125 18.468 2.669 1.199 1.00 0.22 H new ATOM 0 HG23 VAL A 125 17.147 3.681 0.569 1.00 0.22 H new ATOM 1952 N GLU A 126 20.627 2.912 -3.180 1.00 14.20 N ATOM 1953 CA GLU A 126 21.077 2.571 -4.527 1.00 50.11 C ATOM 1954 C GLU A 126 20.490 1.238 -4.982 1.00 61.53 C ATOM 1955 O GLU A 126 20.094 0.410 -4.163 1.00 24.22 O ATOM 1956 CB GLU A 126 22.607 2.518 -4.583 1.00 40.21 C ATOM 1957 CG GLU A 126 23.235 1.735 -3.442 1.00 62.23 C ATOM 1958 CD GLU A 126 24.725 1.521 -3.633 1.00 43.41 C ATOM 1959 OE1 GLU A 126 25.198 1.636 -4.783 1.00 2.21 O ATOM 1960 OE2 GLU A 126 25.417 1.238 -2.632 1.00 24.45 O ATOM 0 H GLU A 126 21.380 3.128 -2.526 1.00 14.20 H new ATOM 0 HA GLU A 126 20.724 3.349 -5.204 1.00 50.11 H new ATOM 0 HB2 GLU A 126 22.911 2.071 -5.529 1.00 40.21 H new ATOM 0 HB3 GLU A 126 22.997 3.536 -4.571 1.00 40.21 H new ATOM 0 HG2 GLU A 126 23.065 2.265 -2.505 1.00 62.23 H new ATOM 0 HG3 GLU A 126 22.741 0.767 -3.355 1.00 62.23 H new ATOM 1967 N SER A 127 20.432 1.043 -6.296 1.00 51.42 N ATOM 1968 CA SER A 127 19.886 -0.185 -6.867 1.00 0.20 C ATOM 1969 C SER A 127 20.628 -1.414 -6.350 1.00 55.13 C ATOM 1970 O SER A 127 20.008 -2.384 -5.911 1.00 71.03 O ATOM 1971 CB SER A 127 19.960 -0.136 -8.394 1.00 35.23 C ATOM 1972 OG SER A 127 21.017 0.705 -8.827 1.00 5.43 O ATOM 0 H SER A 127 20.757 1.720 -6.986 1.00 51.42 H new ATOM 0 HA SER A 127 18.843 -0.263 -6.559 1.00 0.20 H new ATOM 0 HB2 SER A 127 20.107 -1.142 -8.787 1.00 35.23 H new ATOM 0 HB3 SER A 127 19.014 0.227 -8.796 1.00 35.23 H new ATOM 0 HG SER A 127 21.044 0.718 -9.807 1.00 5.43 H new ATOM 1978 N ARG A 128 21.955 -1.373 -6.410 1.00 51.31 N ATOM 1979 CA ARG A 128 22.778 -2.489 -5.952 1.00 53.12 C ATOM 1980 C ARG A 128 22.424 -2.882 -4.519 1.00 14.12 C ATOM 1981 O ARG A 128 22.466 -4.058 -4.159 1.00 3.33 O ATOM 1982 CB ARG A 128 24.264 -2.131 -6.049 1.00 43.44 C ATOM 1983 CG ARG A 128 24.737 -1.178 -4.961 1.00 75.44 C ATOM 1984 CD ARG A 128 25.341 -1.930 -3.785 1.00 14.45 C ATOM 1985 NE ARG A 128 26.684 -1.455 -3.460 1.00 63.41 N ATOM 1986 CZ ARG A 128 27.778 -1.810 -4.129 1.00 31.32 C ATOM 1987 NH1 ARG A 128 27.692 -2.640 -5.162 1.00 23.33 N ATOM 1988 NH2 ARG A 128 28.960 -1.334 -3.767 1.00 15.41 N ATOM 0 H ARG A 128 22.484 -0.579 -6.771 1.00 51.31 H new ATOM 0 HA ARG A 128 22.576 -3.343 -6.599 1.00 53.12 H new ATOM 0 HB2 ARG A 128 24.853 -3.047 -5.999 1.00 43.44 H new ATOM 0 HB3 ARG A 128 24.457 -1.681 -7.023 1.00 43.44 H new ATOM 0 HG2 ARG A 128 25.476 -0.491 -5.374 1.00 75.44 H new ATOM 0 HG3 ARG A 128 23.898 -0.573 -4.616 1.00 75.44 H new ATOM 0 HD2 ARG A 128 24.696 -1.817 -2.913 1.00 14.45 H new ATOM 0 HD3 ARG A 128 25.380 -2.994 -4.017 1.00 14.45 H new ATOM 0 HE ARG A 128 26.789 -0.813 -2.674 1.00 63.41 H new ATOM 0 HH11 ARG A 128 26.784 -3.008 -5.446 1.00 23.33 H new ATOM 0 HH12 ARG A 128 28.534 -2.909 -5.672 1.00 23.33 H new ATOM 0 HH21 ARG A 128 29.032 -0.695 -2.975 1.00 15.41 H new ATOM 0 HH22 ARG A 128 29.798 -1.606 -4.280 1.00 15.41 H new ATOM 2002 N GLN A 129 22.076 -1.889 -3.708 1.00 34.01 N ATOM 2003 CA GLN A 129 21.715 -2.130 -2.316 1.00 43.03 C ATOM 2004 C GLN A 129 20.437 -2.952 -2.227 1.00 0.32 C ATOM 2005 O GLN A 129 20.275 -3.773 -1.323 1.00 41.40 O ATOM 2006 CB GLN A 129 21.527 -0.804 -1.578 1.00 23.14 C ATOM 2007 CG GLN A 129 21.230 -0.969 -0.097 1.00 62.40 C ATOM 2008 CD GLN A 129 21.568 0.272 0.708 1.00 22.54 C ATOM 2009 OE1 GLN A 129 22.326 1.131 0.257 1.00 13.40 O ATOM 2010 NE2 GLN A 129 21.004 0.371 1.906 1.00 14.24 N ATOM 0 H GLN A 129 22.036 -0.910 -3.991 1.00 34.01 H new ATOM 0 HA GLN A 129 22.525 -2.688 -1.847 1.00 43.03 H new ATOM 0 HB2 GLN A 129 22.428 -0.202 -1.694 1.00 23.14 H new ATOM 0 HB3 GLN A 129 20.712 -0.251 -2.044 1.00 23.14 H new ATOM 0 HG2 GLN A 129 20.174 -1.206 0.034 1.00 62.40 H new ATOM 0 HG3 GLN A 129 21.797 -1.815 0.291 1.00 62.40 H new ATOM 0 HE21 GLN A 129 20.382 -0.365 2.239 1.00 14.24 H new ATOM 0 HE22 GLN A 129 21.193 1.184 2.493 1.00 14.24 H new ATOM 2019 N ALA A 130 19.531 -2.724 -3.169 1.00 74.25 N ATOM 2020 CA ALA A 130 18.265 -3.441 -3.198 1.00 32.45 C ATOM 2021 C ALA A 130 18.441 -4.846 -3.763 1.00 4.14 C ATOM 2022 O ALA A 130 17.755 -5.783 -3.353 1.00 11.22 O ATOM 2023 CB ALA A 130 17.239 -2.667 -4.011 1.00 71.23 C ATOM 0 H ALA A 130 19.650 -2.048 -3.923 1.00 74.25 H new ATOM 0 HA ALA A 130 17.905 -3.534 -2.173 1.00 32.45 H new ATOM 0 HB1 ALA A 130 16.297 -3.215 -4.024 1.00 71.23 H new ATOM 0 HB2 ALA A 130 17.082 -1.687 -3.561 1.00 71.23 H new ATOM 0 HB3 ALA A 130 17.601 -2.544 -5.032 1.00 71.23 H new ATOM 2029 N GLN A 131 19.367 -4.986 -4.707 1.00 62.52 N ATOM 2030 CA GLN A 131 19.636 -6.278 -5.327 1.00 23.35 C ATOM 2031 C GLN A 131 20.264 -7.243 -4.326 1.00 52.23 C ATOM 2032 O GLN A 131 20.049 -8.452 -4.395 1.00 24.41 O ATOM 2033 CB GLN A 131 20.558 -6.105 -6.537 1.00 30.21 C ATOM 2034 CG GLN A 131 19.817 -6.041 -7.862 1.00 35.14 C ATOM 2035 CD GLN A 131 20.265 -7.114 -8.836 1.00 42.25 C ATOM 2036 OE1 GLN A 131 21.059 -6.855 -9.740 1.00 40.31 O ATOM 2037 NE2 GLN A 131 19.757 -8.327 -8.654 1.00 71.13 N ATOM 0 H GLN A 131 19.943 -4.221 -5.059 1.00 62.52 H new ATOM 0 HA GLN A 131 18.687 -6.698 -5.660 1.00 23.35 H new ATOM 0 HB2 GLN A 131 21.141 -5.192 -6.412 1.00 30.21 H new ATOM 0 HB3 GLN A 131 21.266 -6.934 -6.566 1.00 30.21 H new ATOM 0 HG2 GLN A 131 18.747 -6.145 -7.681 1.00 35.14 H new ATOM 0 HG3 GLN A 131 19.970 -5.060 -8.312 1.00 35.14 H new ATOM 0 HE21 GLN A 131 19.102 -8.496 -7.891 1.00 71.13 H new ATOM 0 HE22 GLN A 131 20.022 -9.090 -9.277 1.00 71.13 H new ATOM 2046 N ASP A 132 21.040 -6.698 -3.395 1.00 71.41 N ATOM 2047 CA ASP A 132 21.698 -7.509 -2.378 1.00 21.51 C ATOM 2048 C ASP A 132 20.672 -8.247 -1.524 1.00 32.44 C ATOM 2049 O ASP A 132 20.891 -9.390 -1.122 1.00 22.34 O ATOM 2050 CB ASP A 132 22.584 -6.633 -1.490 1.00 75.44 C ATOM 2051 CG ASP A 132 23.902 -7.301 -1.150 1.00 51.00 C ATOM 2052 OD1 ASP A 132 23.952 -8.549 -1.150 1.00 4.33 O ATOM 2053 OD2 ASP A 132 24.884 -6.576 -0.884 1.00 32.33 O ATOM 0 H ASP A 132 21.228 -5.698 -3.324 1.00 71.41 H new ATOM 0 HA ASP A 132 22.321 -8.246 -2.884 1.00 21.51 H new ATOM 0 HB2 ASP A 132 22.779 -5.687 -1.996 1.00 75.44 H new ATOM 0 HB3 ASP A 132 22.051 -6.398 -0.569 1.00 75.44 H new ATOM 2058 N LEU A 133 19.552 -7.586 -1.251 1.00 14.41 N ATOM 2059 CA LEU A 133 18.491 -8.180 -0.446 1.00 63.14 C ATOM 2060 C LEU A 133 17.745 -9.252 -1.235 1.00 34.32 C ATOM 2061 O LEU A 133 17.576 -10.377 -0.766 1.00 32.43 O ATOM 2062 CB LEU A 133 17.513 -7.099 0.022 1.00 23.04 C ATOM 2063 CG LEU A 133 16.285 -7.615 0.774 1.00 21.13 C ATOM 2064 CD1 LEU A 133 16.660 -8.027 2.189 1.00 23.15 C ATOM 2065 CD2 LEU A 133 15.192 -6.556 0.797 1.00 3.21 C ATOM 0 H LEU A 133 19.356 -6.639 -1.575 1.00 14.41 H new ATOM 0 HA LEU A 133 18.948 -8.649 0.426 1.00 63.14 H new ATOM 0 HB2 LEU A 133 18.048 -6.402 0.667 1.00 23.04 H new ATOM 0 HB3 LEU A 133 17.176 -6.535 -0.848 1.00 23.04 H new ATOM 0 HG LEU A 133 15.904 -8.492 0.251 1.00 21.13 H new ATOM 0 HD11 LEU A 133 15.774 -8.391 2.709 1.00 23.15 H new ATOM 0 HD12 LEU A 133 17.409 -8.818 2.151 1.00 23.15 H new ATOM 0 HD13 LEU A 133 17.066 -7.168 2.723 1.00 23.15 H new ATOM 0 HD21 LEU A 133 14.325 -6.939 1.336 1.00 3.21 H new ATOM 0 HD22 LEU A 133 15.563 -5.661 1.296 1.00 3.21 H new ATOM 0 HD23 LEU A 133 14.904 -6.308 -0.225 1.00 3.21 H new ATOM 2077 N ALA A 134 17.301 -8.893 -2.435 1.00 54.05 N ATOM 2078 CA ALA A 134 16.575 -9.824 -3.288 1.00 74.31 C ATOM 2079 C ALA A 134 17.448 -11.014 -3.669 1.00 0.35 C ATOM 2080 O ALA A 134 16.991 -12.157 -3.667 1.00 55.10 O ATOM 2081 CB ALA A 134 16.074 -9.113 -4.537 1.00 65.42 C ATOM 0 H ALA A 134 17.431 -7.965 -2.838 1.00 54.05 H new ATOM 0 HA ALA A 134 15.719 -10.200 -2.728 1.00 74.31 H new ATOM 0 HB1 ALA A 134 15.533 -9.820 -5.166 1.00 65.42 H new ATOM 0 HB2 ALA A 134 15.408 -8.299 -4.250 1.00 65.42 H new ATOM 0 HB3 ALA A 134 16.922 -8.710 -5.091 1.00 65.42 H new ATOM 2087 N ARG A 135 18.706 -10.738 -3.995 1.00 43.41 N ATOM 2088 CA ARG A 135 19.644 -11.786 -4.378 1.00 74.31 C ATOM 2089 C ARG A 135 19.834 -12.787 -3.242 1.00 74.25 C ATOM 2090 O ARG A 135 20.086 -13.968 -3.478 1.00 10.14 O ATOM 2091 CB ARG A 135 20.992 -11.177 -4.767 1.00 31.11 C ATOM 2092 CG ARG A 135 22.001 -12.200 -5.265 1.00 63.41 C ATOM 2093 CD ARG A 135 22.944 -11.600 -6.296 1.00 42.23 C ATOM 2094 NE ARG A 135 23.132 -12.482 -7.444 1.00 50.11 N ATOM 2095 CZ ARG A 135 24.098 -12.328 -8.348 1.00 30.24 C ATOM 2096 NH1 ARG A 135 24.964 -11.328 -8.240 1.00 32.13 N ATOM 2097 NH2 ARG A 135 24.198 -13.176 -9.362 1.00 14.42 N ATOM 0 H ARG A 135 19.099 -9.797 -4.002 1.00 43.41 H new ATOM 0 HA ARG A 135 19.230 -12.313 -5.238 1.00 74.31 H new ATOM 0 HB2 ARG A 135 20.833 -10.429 -5.543 1.00 31.11 H new ATOM 0 HB3 ARG A 135 21.409 -10.658 -3.904 1.00 31.11 H new ATOM 0 HG2 ARG A 135 22.578 -12.583 -4.423 1.00 63.41 H new ATOM 0 HG3 ARG A 135 21.474 -13.048 -5.703 1.00 63.41 H new ATOM 0 HD2 ARG A 135 22.548 -10.643 -6.635 1.00 42.23 H new ATOM 0 HD3 ARG A 135 23.909 -11.399 -5.831 1.00 42.23 H new ATOM 0 HE ARG A 135 22.485 -13.262 -7.561 1.00 50.11 H new ATOM 0 HH11 ARG A 135 24.892 -10.673 -7.462 1.00 32.13 H new ATOM 0 HH12 ARG A 135 25.702 -11.215 -8.935 1.00 32.13 H new ATOM 0 HH21 ARG A 135 23.535 -13.946 -9.450 1.00 14.42 H new ATOM 0 HH22 ARG A 135 24.938 -13.058 -10.054 1.00 14.42 H new ATOM 2111 N SER A 136 19.709 -12.306 -2.010 1.00 63.32 N ATOM 2112 CA SER A 136 19.865 -13.160 -0.837 1.00 0.34 C ATOM 2113 C SER A 136 18.649 -14.062 -0.663 1.00 13.45 C ATOM 2114 O SER A 136 18.762 -15.190 -0.184 1.00 51.35 O ATOM 2115 CB SER A 136 20.069 -12.309 0.417 1.00 1.43 C ATOM 2116 OG SER A 136 20.131 -13.118 1.578 1.00 62.01 O ATOM 0 H SER A 136 19.500 -11.331 -1.797 1.00 63.32 H new ATOM 0 HA SER A 136 20.744 -13.787 -0.986 1.00 0.34 H new ATOM 0 HB2 SER A 136 20.989 -11.732 0.323 1.00 1.43 H new ATOM 0 HB3 SER A 136 19.252 -11.594 0.512 1.00 1.43 H new ATOM 0 HG SER A 136 20.263 -12.550 2.366 1.00 62.01 H new ATOM 2122 N TYR A 137 17.485 -13.556 -1.056 1.00 1.45 N ATOM 2123 CA TYR A 137 16.245 -14.314 -0.947 1.00 45.25 C ATOM 2124 C TYR A 137 16.091 -15.295 -2.109 1.00 5.52 C ATOM 2125 O TYR A 137 15.273 -16.211 -2.053 1.00 74.42 O ATOM 2126 CB TYR A 137 15.046 -13.364 -0.907 1.00 22.34 C ATOM 2127 CG TYR A 137 14.996 -12.494 0.330 1.00 74.11 C ATOM 2128 CD1 TYR A 137 15.356 -12.997 1.575 1.00 15.15 C ATOM 2129 CD2 TYR A 137 14.587 -11.169 0.253 1.00 14.44 C ATOM 2130 CE1 TYR A 137 15.311 -12.205 2.706 1.00 11.11 C ATOM 2131 CE2 TYR A 137 14.538 -10.370 1.380 1.00 64.43 C ATOM 2132 CZ TYR A 137 14.902 -10.893 2.604 1.00 20.32 C ATOM 2133 OH TYR A 137 14.854 -10.100 3.728 1.00 45.54 O ATOM 0 H TYR A 137 17.375 -12.623 -1.453 1.00 1.45 H new ATOM 0 HA TYR A 137 16.283 -14.886 -0.020 1.00 45.25 H new ATOM 0 HB2 TYR A 137 15.072 -12.724 -1.789 1.00 22.34 H new ATOM 0 HB3 TYR A 137 14.128 -13.950 -0.965 1.00 22.34 H new ATOM 0 HD1 TYR A 137 15.676 -14.025 1.659 1.00 15.15 H new ATOM 0 HD2 TYR A 137 14.302 -10.756 -0.703 1.00 14.44 H new ATOM 0 HE1 TYR A 137 15.595 -12.612 3.665 1.00 11.11 H new ATOM 0 HE2 TYR A 137 14.217 -9.342 1.303 1.00 64.43 H new ATOM 0 HH TYR A 137 14.378 -10.573 4.442 1.00 45.54 H new ATOM 2143 N GLY A 138 16.881 -15.095 -3.161 1.00 55.15 N ATOM 2144 CA GLY A 138 16.809 -15.970 -4.316 1.00 51.02 C ATOM 2145 C GLY A 138 15.747 -15.537 -5.310 1.00 21.03 C ATOM 2146 O GLY A 138 15.360 -16.308 -6.189 1.00 73.44 O ATOM 0 H GLY A 138 17.568 -14.344 -3.233 1.00 55.15 H new ATOM 0 HA2 GLY A 138 17.779 -15.991 -4.812 1.00 51.02 H new ATOM 0 HA3 GLY A 138 16.598 -16.987 -3.985 1.00 51.02 H new ATOM 2150 N ILE A 139 15.274 -14.302 -5.171 1.00 60.31 N ATOM 2151 CA ILE A 139 14.251 -13.771 -6.063 1.00 20.23 C ATOM 2152 C ILE A 139 14.816 -12.678 -6.967 1.00 23.24 C ATOM 2153 O ILE A 139 15.805 -12.029 -6.625 1.00 44.21 O ATOM 2154 CB ILE A 139 13.063 -13.207 -5.277 1.00 42.20 C ATOM 2155 CG1 ILE A 139 13.549 -12.250 -4.198 1.00 13.24 C ATOM 2156 CG2 ILE A 139 12.250 -14.337 -4.662 1.00 21.24 C ATOM 2157 CD1 ILE A 139 12.421 -11.606 -3.443 1.00 3.13 C ATOM 0 H ILE A 139 15.583 -13.651 -4.449 1.00 60.31 H new ATOM 0 HA ILE A 139 13.908 -14.603 -6.679 1.00 20.23 H new ATOM 0 HB ILE A 139 12.421 -12.655 -5.964 1.00 42.20 H new ATOM 0 HG12 ILE A 139 14.187 -12.791 -3.499 1.00 13.24 H new ATOM 0 HG13 ILE A 139 14.164 -11.475 -4.656 1.00 13.24 H new ATOM 0 HG21 ILE A 139 11.410 -13.920 -4.107 1.00 21.24 H new ATOM 0 HG22 ILE A 139 11.876 -14.988 -5.452 1.00 21.24 H new ATOM 0 HG23 ILE A 139 12.881 -14.913 -3.986 1.00 21.24 H new ATOM 0 HD11 ILE A 139 12.826 -10.934 -2.687 1.00 3.13 H new ATOM 0 HD12 ILE A 139 11.797 -11.040 -4.134 1.00 3.13 H new ATOM 0 HD13 ILE A 139 11.820 -12.376 -2.959 1.00 3.13 H new ATOM 2169 N PRO A 140 14.193 -12.460 -8.138 1.00 20.44 N ATOM 2170 CA PRO A 140 14.639 -11.438 -9.092 1.00 40.22 C ATOM 2171 C PRO A 140 14.384 -10.023 -8.588 1.00 53.03 C ATOM 2172 O PRO A 140 13.571 -9.811 -7.688 1.00 71.33 O ATOM 2173 CB PRO A 140 13.798 -11.721 -10.339 1.00 14.31 C ATOM 2174 CG PRO A 140 12.573 -12.394 -9.825 1.00 52.24 C ATOM 2175 CD PRO A 140 13.006 -13.190 -8.625 1.00 64.44 C ATOM 0 HA PRO A 140 15.714 -11.488 -9.267 1.00 40.22 H new ATOM 0 HB2 PRO A 140 13.552 -10.800 -10.868 1.00 14.31 H new ATOM 0 HB3 PRO A 140 14.334 -12.358 -11.042 1.00 14.31 H new ATOM 0 HG2 PRO A 140 11.812 -11.663 -9.553 1.00 52.24 H new ATOM 0 HG3 PRO A 140 12.136 -13.042 -10.585 1.00 52.24 H new ATOM 0 HD2 PRO A 140 12.223 -13.233 -7.868 1.00 64.44 H new ATOM 0 HD3 PRO A 140 13.249 -14.219 -8.892 1.00 64.44 H new ATOM 2183 N TYR A 141 15.081 -9.056 -9.175 1.00 63.21 N ATOM 2184 CA TYR A 141 14.926 -7.658 -8.788 1.00 41.54 C ATOM 2185 C TYR A 141 14.557 -6.798 -9.992 1.00 32.30 C ATOM 2186 O TYR A 141 15.335 -6.669 -10.937 1.00 50.34 O ATOM 2187 CB TYR A 141 16.214 -7.135 -8.149 1.00 3.24 C ATOM 2188 CG TYR A 141 16.123 -5.691 -7.713 1.00 3.11 C ATOM 2189 CD1 TYR A 141 15.484 -5.341 -6.532 1.00 31.44 C ATOM 2190 CD2 TYR A 141 16.673 -4.678 -8.488 1.00 74.22 C ATOM 2191 CE1 TYR A 141 15.395 -4.021 -6.133 1.00 5.12 C ATOM 2192 CE2 TYR A 141 16.588 -3.356 -8.097 1.00 14.52 C ATOM 2193 CZ TYR A 141 15.948 -3.033 -6.919 1.00 53.13 C ATOM 2194 OH TYR A 141 15.860 -1.716 -6.526 1.00 24.24 O ATOM 0 H TYR A 141 15.759 -9.214 -9.921 1.00 63.21 H new ATOM 0 HA TYR A 141 14.118 -7.598 -8.059 1.00 41.54 H new ATOM 0 HB2 TYR A 141 16.460 -7.753 -7.285 1.00 3.24 H new ATOM 0 HB3 TYR A 141 17.033 -7.241 -8.860 1.00 3.24 H new ATOM 0 HD1 TYR A 141 15.049 -6.113 -5.915 1.00 31.44 H new ATOM 0 HD2 TYR A 141 17.175 -4.928 -9.411 1.00 74.22 H new ATOM 0 HE1 TYR A 141 14.895 -3.765 -5.211 1.00 5.12 H new ATOM 0 HE2 TYR A 141 17.020 -2.579 -8.711 1.00 14.52 H new ATOM 0 HH TYR A 141 16.301 -1.146 -7.190 1.00 24.24 H new ATOM 2204 N ILE A 142 13.364 -6.214 -9.951 1.00 72.13 N ATOM 2205 CA ILE A 142 12.888 -5.369 -11.035 1.00 65.32 C ATOM 2206 C ILE A 142 12.727 -3.923 -10.574 1.00 21.21 C ATOM 2207 O ILE A 142 12.633 -3.649 -9.379 1.00 15.04 O ATOM 2208 CB ILE A 142 11.539 -5.876 -11.579 1.00 60.53 C ATOM 2209 CG1 ILE A 142 11.587 -7.393 -11.796 1.00 25.14 C ATOM 2210 CG2 ILE A 142 11.190 -5.160 -12.871 1.00 62.35 C ATOM 2211 CD1 ILE A 142 10.812 -8.177 -10.758 1.00 73.23 C ATOM 0 H ILE A 142 12.709 -6.312 -9.175 1.00 72.13 H new ATOM 0 HA ILE A 142 13.635 -5.412 -11.828 1.00 65.32 H new ATOM 0 HB ILE A 142 10.762 -5.660 -10.845 1.00 60.53 H new ATOM 0 HG12 ILE A 142 11.190 -7.623 -12.785 1.00 25.14 H new ATOM 0 HG13 ILE A 142 12.627 -7.721 -11.786 1.00 25.14 H new ATOM 0 HG21 ILE A 142 10.234 -5.528 -13.244 1.00 62.35 H new ATOM 0 HG22 ILE A 142 11.119 -4.088 -12.685 1.00 62.35 H new ATOM 0 HG23 ILE A 142 11.966 -5.349 -13.613 1.00 62.35 H new ATOM 0 HD11 ILE A 142 10.890 -9.243 -10.974 1.00 73.23 H new ATOM 0 HD12 ILE A 142 11.223 -7.976 -9.769 1.00 73.23 H new ATOM 0 HD13 ILE A 142 9.764 -7.877 -10.783 1.00 73.23 H new ATOM 2223 N GLU A 143 12.696 -3.000 -11.531 1.00 64.14 N ATOM 2224 CA GLU A 143 12.547 -1.583 -11.220 1.00 33.25 C ATOM 2225 C GLU A 143 11.347 -0.989 -11.949 1.00 62.33 C ATOM 2226 O GLU A 143 11.289 -0.999 -13.179 1.00 51.52 O ATOM 2227 CB GLU A 143 13.818 -0.819 -11.597 1.00 0.03 C ATOM 2228 CG GLU A 143 14.763 -0.596 -10.429 1.00 23.20 C ATOM 2229 CD GLU A 143 16.067 0.050 -10.851 1.00 24.53 C ATOM 2230 OE1 GLU A 143 16.589 -0.314 -11.925 1.00 60.01 O ATOM 2231 OE2 GLU A 143 16.567 0.920 -10.107 1.00 32.33 O ATOM 0 H GLU A 143 12.772 -3.208 -12.527 1.00 64.14 H new ATOM 0 HA GLU A 143 12.380 -1.488 -10.147 1.00 33.25 H new ATOM 0 HB2 GLU A 143 14.343 -1.368 -12.379 1.00 0.03 H new ATOM 0 HB3 GLU A 143 13.540 0.147 -12.018 1.00 0.03 H new ATOM 0 HG2 GLU A 143 14.274 0.033 -9.685 1.00 23.20 H new ATOM 0 HG3 GLU A 143 14.974 -1.552 -9.949 1.00 23.20 H new ATOM 2238 N THR A 144 10.392 -0.473 -11.185 1.00 13.33 N ATOM 2239 CA THR A 144 9.194 0.125 -11.761 1.00 64.12 C ATOM 2240 C THR A 144 8.862 1.450 -11.085 1.00 75.52 C ATOM 2241 O THR A 144 9.457 1.808 -10.070 1.00 41.13 O ATOM 2242 CB THR A 144 8.010 -0.834 -11.635 1.00 13.20 C ATOM 2243 OG1 THR A 144 7.704 -1.074 -10.272 1.00 63.24 O ATOM 2244 CG2 THR A 144 8.255 -2.173 -12.294 1.00 53.33 C ATOM 0 H THR A 144 10.424 -0.457 -10.166 1.00 13.33 H new ATOM 0 HA THR A 144 9.389 0.318 -12.816 1.00 64.12 H new ATOM 0 HB THR A 144 7.181 -0.342 -12.145 1.00 13.20 H new ATOM 0 HG1 THR A 144 6.943 -1.688 -10.211 1.00 63.24 H new ATOM 0 HG21 THR A 144 7.377 -2.806 -12.168 1.00 53.33 H new ATOM 0 HG22 THR A 144 8.447 -2.026 -13.357 1.00 53.33 H new ATOM 0 HG23 THR A 144 9.118 -2.653 -11.832 1.00 53.33 H new ATOM 2252 N SER A 145 7.903 2.171 -11.656 1.00 11.44 N ATOM 2253 CA SER A 145 7.485 3.457 -11.112 1.00 50.00 C ATOM 2254 C SER A 145 5.969 3.611 -11.191 1.00 20.35 C ATOM 2255 O SER A 145 5.397 3.658 -12.280 1.00 41.15 O ATOM 2256 CB SER A 145 8.166 4.599 -11.867 1.00 11.32 C ATOM 2257 OG SER A 145 8.080 4.407 -13.268 1.00 14.11 O ATOM 0 H SER A 145 7.400 1.886 -12.496 1.00 11.44 H new ATOM 0 HA SER A 145 7.783 3.496 -10.064 1.00 50.00 H new ATOM 0 HB2 SER A 145 7.699 5.546 -11.597 1.00 11.32 H new ATOM 0 HB3 SER A 145 9.213 4.663 -11.569 1.00 11.32 H new ATOM 0 HG SER A 145 8.947 4.608 -13.679 1.00 14.11 H new ATOM 2263 N ALA A 146 5.324 3.685 -10.032 1.00 11.00 N ATOM 2264 CA ALA A 146 3.873 3.829 -9.971 1.00 64.24 C ATOM 2265 C ALA A 146 3.425 5.180 -10.526 1.00 52.23 C ATOM 2266 O ALA A 146 2.280 5.336 -10.948 1.00 12.35 O ATOM 2267 CB ALA A 146 3.388 3.655 -8.538 1.00 14.44 C ATOM 0 H ALA A 146 5.782 3.648 -9.122 1.00 11.00 H new ATOM 0 HA ALA A 146 3.430 3.051 -10.592 1.00 64.24 H new ATOM 0 HB1 ALA A 146 2.304 3.765 -8.505 1.00 14.44 H new ATOM 0 HB2 ALA A 146 3.664 2.664 -8.178 1.00 14.44 H new ATOM 0 HB3 ALA A 146 3.849 4.412 -7.903 1.00 14.44 H new ATOM 2273 N LYS A 147 4.331 6.153 -10.519 1.00 32.23 N ATOM 2274 CA LYS A 147 4.021 7.487 -11.018 1.00 43.12 C ATOM 2275 C LYS A 147 4.176 7.557 -12.535 1.00 62.22 C ATOM 2276 O LYS A 147 3.200 7.752 -13.259 1.00 41.11 O ATOM 2277 CB LYS A 147 4.925 8.526 -10.351 1.00 4.04 C ATOM 2278 CG LYS A 147 4.592 9.958 -10.732 1.00 21.14 C ATOM 2279 CD LYS A 147 3.506 10.536 -9.839 1.00 11.41 C ATOM 2280 CE LYS A 147 3.249 12.002 -10.154 1.00 13.40 C ATOM 2281 NZ LYS A 147 2.773 12.196 -11.551 1.00 62.34 N ATOM 0 H LYS A 147 5.284 6.042 -10.174 1.00 32.23 H new ATOM 0 HA LYS A 147 2.982 7.706 -10.771 1.00 43.12 H new ATOM 0 HB2 LYS A 147 4.849 8.420 -9.269 1.00 4.04 H new ATOM 0 HB3 LYS A 147 5.961 8.319 -10.619 1.00 4.04 H new ATOM 0 HG2 LYS A 147 5.489 10.573 -10.659 1.00 21.14 H new ATOM 0 HG3 LYS A 147 4.266 9.992 -11.771 1.00 21.14 H new ATOM 0 HD2 LYS A 147 2.585 9.968 -9.969 1.00 11.41 H new ATOM 0 HD3 LYS A 147 3.799 10.433 -8.794 1.00 11.41 H new ATOM 0 HE2 LYS A 147 2.507 12.398 -9.460 1.00 13.40 H new ATOM 0 HE3 LYS A 147 4.165 12.572 -10.001 1.00 13.40 H new ATOM 0 HZ1 LYS A 147 2.465 13.181 -11.679 1.00 62.34 H new ATOM 0 HZ2 LYS A 147 3.546 11.986 -12.214 1.00 62.34 H new ATOM 0 HZ3 LYS A 147 1.974 11.557 -11.737 1.00 62.34 H new ATOM 2295 N THR A 148 5.408 7.403 -13.011 1.00 21.30 N ATOM 2296 CA THR A 148 5.686 7.454 -14.443 1.00 40.52 C ATOM 2297 C THR A 148 5.148 6.215 -15.159 1.00 43.41 C ATOM 2298 O THR A 148 4.927 6.236 -16.369 1.00 44.52 O ATOM 2299 CB THR A 148 7.191 7.581 -14.693 1.00 42.01 C ATOM 2300 OG1 THR A 148 7.924 6.844 -13.730 1.00 62.24 O ATOM 2301 CG2 THR A 148 7.687 9.011 -14.653 1.00 30.12 C ATOM 0 H THR A 148 6.229 7.242 -12.427 1.00 21.30 H new ATOM 0 HA THR A 148 5.179 8.331 -14.845 1.00 40.52 H new ATOM 0 HB THR A 148 7.351 7.187 -15.697 1.00 42.01 H new ATOM 0 HG1 THR A 148 7.816 5.885 -13.900 1.00 62.24 H new ATOM 0 HG21 THR A 148 8.761 9.029 -14.838 1.00 30.12 H new ATOM 0 HG22 THR A 148 7.177 9.595 -15.420 1.00 30.12 H new ATOM 0 HG23 THR A 148 7.480 9.441 -13.673 1.00 30.12 H new ATOM 2309 N ARG A 149 4.945 5.137 -14.407 1.00 31.23 N ATOM 2310 CA ARG A 149 4.438 3.892 -14.978 1.00 72.54 C ATOM 2311 C ARG A 149 5.446 3.300 -15.958 1.00 61.22 C ATOM 2312 O ARG A 149 5.205 3.260 -17.165 1.00 35.22 O ATOM 2313 CB ARG A 149 3.099 4.129 -15.681 1.00 2.43 C ATOM 2314 CG ARG A 149 2.216 2.893 -15.739 1.00 14.42 C ATOM 2315 CD ARG A 149 2.476 2.079 -16.996 1.00 12.15 C ATOM 2316 NE ARG A 149 1.314 1.283 -17.384 1.00 11.24 N ATOM 2317 CZ ARG A 149 0.268 1.771 -18.047 1.00 52.33 C ATOM 2318 NH1 ARG A 149 0.232 3.052 -18.393 1.00 24.54 N ATOM 2319 NH2 ARG A 149 -0.745 0.976 -18.363 1.00 51.14 N ATOM 0 H ARG A 149 5.123 5.100 -13.403 1.00 31.23 H new ATOM 0 HA ARG A 149 4.285 3.183 -14.164 1.00 72.54 H new ATOM 0 HB2 ARG A 149 2.563 4.925 -15.164 1.00 2.43 H new ATOM 0 HB3 ARG A 149 3.288 4.479 -16.696 1.00 2.43 H new ATOM 0 HG2 ARG A 149 2.397 2.274 -14.860 1.00 14.42 H new ATOM 0 HG3 ARG A 149 1.168 3.192 -15.708 1.00 14.42 H new ATOM 0 HD2 ARG A 149 2.745 2.749 -17.812 1.00 12.15 H new ATOM 0 HD3 ARG A 149 3.328 1.420 -16.831 1.00 12.15 H new ATOM 0 HE ARG A 149 1.304 0.295 -17.132 1.00 11.24 H new ATOM 0 HH11 ARG A 149 1.008 3.668 -18.151 1.00 24.54 H new ATOM 0 HH12 ARG A 149 -0.572 3.421 -18.901 1.00 24.54 H new ATOM 0 HH21 ARG A 149 -0.722 -0.009 -18.098 1.00 51.14 H new ATOM 0 HH22 ARG A 149 -1.547 1.349 -18.871 1.00 51.14 H new ATOM 2333 N GLN A 150 6.577 2.844 -15.431 1.00 24.21 N ATOM 2334 CA GLN A 150 7.623 2.257 -16.258 1.00 0.44 C ATOM 2335 C GLN A 150 7.900 0.814 -15.846 1.00 21.41 C ATOM 2336 O GLN A 150 8.290 0.548 -14.710 1.00 34.12 O ATOM 2337 CB GLN A 150 8.907 3.085 -16.152 1.00 60.44 C ATOM 2338 CG GLN A 150 10.061 2.529 -16.972 1.00 43.24 C ATOM 2339 CD GLN A 150 10.635 3.547 -17.935 1.00 35.22 C ATOM 2340 OE1 GLN A 150 10.483 3.426 -19.150 1.00 22.11 O ATOM 2341 NE2 GLN A 150 11.303 4.557 -17.393 1.00 41.11 N ATOM 0 H GLN A 150 6.792 2.870 -14.434 1.00 24.21 H new ATOM 0 HA GLN A 150 7.279 2.259 -17.292 1.00 0.44 H new ATOM 0 HB2 GLN A 150 8.700 4.104 -16.477 1.00 60.44 H new ATOM 0 HB3 GLN A 150 9.209 3.139 -15.106 1.00 60.44 H new ATOM 0 HG2 GLN A 150 10.848 2.187 -16.300 1.00 43.24 H new ATOM 0 HG3 GLN A 150 9.718 1.658 -17.531 1.00 43.24 H new ATOM 0 HE21 GLN A 150 11.404 4.617 -16.380 1.00 41.11 H new ATOM 0 HE22 GLN A 150 11.716 5.274 -17.990 1.00 41.11 H new ATOM 2350 N GLY A 151 7.698 -0.111 -16.777 1.00 14.11 N ATOM 2351 CA GLY A 151 7.931 -1.516 -16.493 1.00 2.30 C ATOM 2352 C GLY A 151 7.099 -2.030 -15.333 1.00 53.30 C ATOM 2353 O GLY A 151 7.416 -3.064 -14.745 1.00 55.24 O ATOM 0 H GLY A 151 7.377 0.086 -17.725 1.00 14.11 H new ATOM 0 HA2 GLY A 151 7.706 -2.104 -17.383 1.00 2.30 H new ATOM 0 HA3 GLY A 151 8.987 -1.666 -16.270 1.00 2.30 H new ATOM 2357 N VAL A 152 6.030 -1.311 -15.001 1.00 33.52 N ATOM 2358 CA VAL A 152 5.152 -1.704 -13.906 1.00 13.31 C ATOM 2359 C VAL A 152 4.625 -3.122 -14.103 1.00 54.33 C ATOM 2360 O VAL A 152 4.458 -3.871 -13.140 1.00 42.41 O ATOM 2361 CB VAL A 152 3.962 -0.741 -13.769 1.00 61.03 C ATOM 2362 CG1 VAL A 152 4.434 0.636 -13.327 1.00 54.22 C ATOM 2363 CG2 VAL A 152 3.198 -0.656 -15.077 1.00 54.34 C ATOM 0 H VAL A 152 5.752 -0.452 -15.476 1.00 33.52 H new ATOM 0 HA VAL A 152 5.748 -1.666 -12.994 1.00 13.31 H new ATOM 0 HB VAL A 152 3.289 -1.128 -13.004 1.00 61.03 H new ATOM 0 HG11 VAL A 152 3.576 1.303 -13.236 1.00 54.22 H new ATOM 0 HG12 VAL A 152 4.936 0.556 -12.363 1.00 54.22 H new ATOM 0 HG13 VAL A 152 5.128 1.037 -14.065 1.00 54.22 H new ATOM 0 HG21 VAL A 152 2.358 0.030 -14.964 1.00 54.34 H new ATOM 0 HG22 VAL A 152 3.861 -0.292 -15.862 1.00 54.34 H new ATOM 0 HG23 VAL A 152 2.826 -1.645 -15.346 1.00 54.34 H new ATOM 2373 N GLU A 153 4.365 -3.483 -15.355 1.00 45.45 N ATOM 2374 CA GLU A 153 3.858 -4.812 -15.678 1.00 73.30 C ATOM 2375 C GLU A 153 4.962 -5.858 -15.563 1.00 3.21 C ATOM 2376 O GLU A 153 4.711 -6.999 -15.176 1.00 1.44 O ATOM 2377 CB GLU A 153 3.270 -4.826 -17.090 1.00 62.15 C ATOM 2378 CG GLU A 153 2.303 -3.683 -17.358 1.00 0.25 C ATOM 2379 CD GLU A 153 2.822 -2.710 -18.397 1.00 11.43 C ATOM 2380 OE1 GLU A 153 4.052 -2.665 -18.607 1.00 55.35 O ATOM 2381 OE2 GLU A 153 1.998 -1.992 -19.002 1.00 0.10 O ATOM 0 H GLU A 153 4.497 -2.874 -16.163 1.00 45.45 H new ATOM 0 HA GLU A 153 3.073 -5.059 -14.963 1.00 73.30 H new ATOM 0 HB2 GLU A 153 4.084 -4.780 -17.814 1.00 62.15 H new ATOM 0 HB3 GLU A 153 2.754 -5.773 -17.250 1.00 62.15 H new ATOM 0 HG2 GLU A 153 1.349 -4.090 -17.692 1.00 0.25 H new ATOM 0 HG3 GLU A 153 2.113 -3.148 -16.428 1.00 0.25 H new ATOM 2388 N ASP A 154 6.185 -5.461 -15.902 1.00 21.10 N ATOM 2389 CA ASP A 154 7.329 -6.365 -15.837 1.00 14.13 C ATOM 2390 C ASP A 154 7.493 -6.931 -14.429 1.00 14.55 C ATOM 2391 O ASP A 154 7.800 -8.110 -14.255 1.00 25.33 O ATOM 2392 CB ASP A 154 8.607 -5.637 -16.261 1.00 14.12 C ATOM 2393 CG ASP A 154 9.260 -6.274 -17.472 1.00 1.35 C ATOM 2394 OD1 ASP A 154 8.647 -6.251 -18.559 1.00 23.32 O ATOM 2395 OD2 ASP A 154 10.387 -6.796 -17.333 1.00 71.10 O ATOM 0 H ASP A 154 6.409 -4.520 -16.224 1.00 21.10 H new ATOM 0 HA ASP A 154 7.148 -7.192 -16.523 1.00 14.13 H new ATOM 0 HB2 ASP A 154 8.372 -4.596 -16.484 1.00 14.12 H new ATOM 0 HB3 ASP A 154 9.313 -5.634 -15.430 1.00 14.12 H new ATOM 2400 N ALA A 155 7.287 -6.082 -13.429 1.00 61.20 N ATOM 2401 CA ALA A 155 7.412 -6.494 -12.036 1.00 25.13 C ATOM 2402 C ALA A 155 6.287 -7.443 -11.640 1.00 21.34 C ATOM 2403 O ALA A 155 6.511 -8.429 -10.938 1.00 0.24 O ATOM 2404 CB ALA A 155 7.417 -5.274 -11.128 1.00 61.31 C ATOM 0 H ALA A 155 7.032 -5.103 -13.557 1.00 61.20 H new ATOM 0 HA ALA A 155 8.357 -7.026 -11.923 1.00 25.13 H new ATOM 0 HB1 ALA A 155 7.511 -5.593 -10.090 1.00 61.31 H new ATOM 0 HB2 ALA A 155 8.258 -4.631 -11.387 1.00 61.31 H new ATOM 0 HB3 ALA A 155 6.486 -4.722 -11.255 1.00 61.31 H new ATOM 2410 N PHE A 156 5.076 -7.134 -12.089 1.00 53.34 N ATOM 2411 CA PHE A 156 3.912 -7.955 -11.780 1.00 22.21 C ATOM 2412 C PHE A 156 4.022 -9.332 -12.428 1.00 33.03 C ATOM 2413 O PHE A 156 3.810 -10.354 -11.774 1.00 54.51 O ATOM 2414 CB PHE A 156 2.635 -7.256 -12.250 1.00 75.24 C ATOM 2415 CG PHE A 156 2.220 -6.112 -11.368 1.00 12.43 C ATOM 2416 CD1 PHE A 156 1.972 -6.315 -10.020 1.00 24.34 C ATOM 2417 CD2 PHE A 156 2.080 -4.835 -11.887 1.00 74.23 C ATOM 2418 CE1 PHE A 156 1.592 -5.265 -9.206 1.00 31.22 C ATOM 2419 CE2 PHE A 156 1.701 -3.781 -11.077 1.00 24.42 C ATOM 2420 CZ PHE A 156 1.456 -3.998 -9.735 1.00 61.32 C ATOM 0 H PHE A 156 4.875 -6.320 -12.669 1.00 53.34 H new ATOM 0 HA PHE A 156 3.871 -8.090 -10.699 1.00 22.21 H new ATOM 0 HB2 PHE A 156 2.784 -6.887 -13.265 1.00 75.24 H new ATOM 0 HB3 PHE A 156 1.825 -7.985 -12.292 1.00 75.24 H new ATOM 0 HD1 PHE A 156 2.077 -7.305 -9.601 1.00 24.34 H new ATOM 0 HD2 PHE A 156 2.269 -4.661 -12.936 1.00 74.23 H new ATOM 0 HE1 PHE A 156 1.402 -5.436 -8.157 1.00 31.22 H new ATOM 0 HE2 PHE A 156 1.597 -2.790 -11.493 1.00 24.42 H new ATOM 0 HZ PHE A 156 1.158 -3.176 -9.100 1.00 61.32 H new ATOM 2430 N TYR A 157 4.354 -9.354 -13.714 1.00 42.34 N ATOM 2431 CA TYR A 157 4.491 -10.607 -14.449 1.00 21.22 C ATOM 2432 C TYR A 157 5.525 -11.518 -13.794 1.00 32.30 C ATOM 2433 O TYR A 157 5.360 -12.738 -13.763 1.00 12.13 O ATOM 2434 CB TYR A 157 4.883 -10.332 -15.901 1.00 4.23 C ATOM 2435 CG TYR A 157 3.767 -9.734 -16.727 1.00 20.41 C ATOM 2436 CD1 TYR A 157 2.483 -10.263 -16.680 1.00 31.22 C ATOM 2437 CD2 TYR A 157 3.996 -8.641 -17.553 1.00 54.23 C ATOM 2438 CE1 TYR A 157 1.460 -9.719 -17.432 1.00 75.43 C ATOM 2439 CE2 TYR A 157 2.978 -8.091 -18.308 1.00 12.43 C ATOM 2440 CZ TYR A 157 1.712 -8.634 -18.245 1.00 55.14 C ATOM 2441 OH TYR A 157 0.696 -8.091 -18.996 1.00 74.13 O ATOM 0 H TYR A 157 4.533 -8.518 -14.270 1.00 42.34 H new ATOM 0 HA TYR A 157 3.526 -11.114 -14.430 1.00 21.22 H new ATOM 0 HB2 TYR A 157 5.737 -9.655 -15.916 1.00 4.23 H new ATOM 0 HB3 TYR A 157 5.207 -11.264 -16.364 1.00 4.23 H new ATOM 0 HD1 TYR A 157 2.282 -11.113 -16.045 1.00 31.22 H new ATOM 0 HD2 TYR A 157 4.987 -8.214 -17.606 1.00 54.23 H new ATOM 0 HE1 TYR A 157 0.467 -10.141 -17.383 1.00 75.43 H new ATOM 0 HE2 TYR A 157 3.173 -7.240 -18.944 1.00 12.43 H new ATOM 0 HH TYR A 157 1.040 -7.332 -19.512 1.00 74.13 H new ATOM 2451 N THR A 158 6.593 -10.919 -13.274 1.00 5.30 N ATOM 2452 CA THR A 158 7.652 -11.676 -12.621 1.00 54.22 C ATOM 2453 C THR A 158 7.095 -12.537 -11.492 1.00 24.42 C ATOM 2454 O THR A 158 7.579 -13.642 -11.244 1.00 13.42 O ATOM 2455 CB THR A 158 8.714 -10.722 -12.077 1.00 70.41 C ATOM 2456 OG1 THR A 158 9.144 -9.823 -13.083 1.00 61.12 O ATOM 2457 CG2 THR A 158 9.934 -11.433 -11.547 1.00 5.32 C ATOM 0 H THR A 158 6.746 -9.911 -13.293 1.00 5.30 H new ATOM 0 HA THR A 158 8.105 -12.337 -13.360 1.00 54.22 H new ATOM 0 HB THR A 158 8.234 -10.192 -11.254 1.00 70.41 H new ATOM 0 HG1 THR A 158 8.606 -9.005 -13.043 1.00 61.12 H new ATOM 0 HG21 THR A 158 10.650 -10.700 -11.176 1.00 5.32 H new ATOM 0 HG22 THR A 158 9.643 -12.099 -10.735 1.00 5.32 H new ATOM 0 HG23 THR A 158 10.392 -12.015 -12.347 1.00 5.32 H new ATOM 2465 N LEU A 159 6.075 -12.025 -10.812 1.00 42.22 N ATOM 2466 CA LEU A 159 5.451 -12.747 -9.711 1.00 51.01 C ATOM 2467 C LEU A 159 4.822 -14.047 -10.203 1.00 34.03 C ATOM 2468 O LEU A 159 4.877 -15.072 -9.523 1.00 41.13 O ATOM 2469 CB LEU A 159 4.391 -11.874 -9.036 1.00 20.43 C ATOM 2470 CG LEU A 159 4.341 -11.976 -7.511 1.00 53.21 C ATOM 2471 CD1 LEU A 159 4.172 -13.424 -7.078 1.00 65.00 C ATOM 2472 CD2 LEU A 159 5.597 -11.373 -6.893 1.00 1.42 C ATOM 0 H LEU A 159 5.663 -11.112 -11.005 1.00 42.22 H new ATOM 0 HA LEU A 159 6.224 -12.992 -8.983 1.00 51.01 H new ATOM 0 HB2 LEU A 159 4.571 -10.834 -9.309 1.00 20.43 H new ATOM 0 HB3 LEU A 159 3.413 -12.143 -9.435 1.00 20.43 H new ATOM 0 HG LEU A 159 3.480 -11.410 -7.156 1.00 53.21 H new ATOM 0 HD11 LEU A 159 4.139 -13.477 -5.990 1.00 65.00 H new ATOM 0 HD12 LEU A 159 3.244 -13.821 -7.489 1.00 65.00 H new ATOM 0 HD13 LEU A 159 5.012 -14.014 -7.444 1.00 65.00 H new ATOM 0 HD21 LEU A 159 5.544 -11.455 -5.807 1.00 1.42 H new ATOM 0 HD22 LEU A 159 6.474 -11.910 -7.254 1.00 1.42 H new ATOM 0 HD23 LEU A 159 5.673 -10.323 -7.175 1.00 1.42 H new ATOM 2484 N VAL A 160 4.223 -13.997 -11.388 1.00 63.12 N ATOM 2485 CA VAL A 160 3.583 -15.170 -11.972 1.00 44.24 C ATOM 2486 C VAL A 160 4.601 -16.271 -12.244 1.00 23.13 C ATOM 2487 O VAL A 160 4.326 -17.452 -12.032 1.00 51.40 O ATOM 2488 CB VAL A 160 2.857 -14.825 -13.289 1.00 43.24 C ATOM 2489 CG1 VAL A 160 1.911 -15.948 -13.685 1.00 50.13 C ATOM 2490 CG2 VAL A 160 2.106 -13.507 -13.165 1.00 4.31 C ATOM 0 H VAL A 160 4.167 -13.156 -11.963 1.00 63.12 H new ATOM 0 HA VAL A 160 2.851 -15.522 -11.245 1.00 44.24 H new ATOM 0 HB VAL A 160 3.606 -14.713 -14.073 1.00 43.24 H new ATOM 0 HG11 VAL A 160 1.407 -15.688 -14.616 1.00 50.13 H new ATOM 0 HG12 VAL A 160 2.477 -16.869 -13.824 1.00 50.13 H new ATOM 0 HG13 VAL A 160 1.169 -16.093 -12.899 1.00 50.13 H new ATOM 0 HG21 VAL A 160 1.602 -13.285 -14.106 1.00 4.31 H new ATOM 0 HG22 VAL A 160 1.367 -13.583 -12.367 1.00 4.31 H new ATOM 0 HG23 VAL A 160 2.810 -12.708 -12.933 1.00 4.31 H new ATOM 2500 N ARG A 161 5.778 -15.876 -12.720 1.00 72.35 N ATOM 2501 CA ARG A 161 6.840 -16.829 -13.025 1.00 3.54 C ATOM 2502 C ARG A 161 7.395 -17.455 -11.748 1.00 44.54 C ATOM 2503 O ARG A 161 7.798 -18.618 -11.741 1.00 61.11 O ATOM 2504 CB ARG A 161 7.964 -16.138 -13.800 1.00 5.41 C ATOM 2505 CG ARG A 161 8.031 -16.542 -15.264 1.00 45.42 C ATOM 2506 CD ARG A 161 8.669 -15.454 -16.114 1.00 1.54 C ATOM 2507 NE ARG A 161 7.916 -15.194 -17.327 1.00 13.53 N ATOM 2508 CZ ARG A 161 8.192 -14.198 -18.155 1.00 51.55 C ATOM 2509 NH1 ARG A 161 9.196 -13.366 -17.900 1.00 55.01 N ATOM 2510 NH2 ARG A 161 7.466 -14.033 -19.239 1.00 33.52 N ATOM 0 H ARG A 161 6.020 -14.902 -12.903 1.00 72.35 H new ATOM 0 HA ARG A 161 6.417 -17.623 -13.641 1.00 3.54 H new ATOM 0 HB2 ARG A 161 7.828 -15.058 -13.735 1.00 5.41 H new ATOM 0 HB3 ARG A 161 8.917 -16.368 -13.324 1.00 5.41 H new ATOM 0 HG2 ARG A 161 8.603 -17.464 -15.362 1.00 45.42 H new ATOM 0 HG3 ARG A 161 7.026 -16.750 -15.631 1.00 45.42 H new ATOM 0 HD2 ARG A 161 8.743 -14.536 -15.531 1.00 1.54 H new ATOM 0 HD3 ARG A 161 9.685 -15.749 -16.375 1.00 1.54 H new ATOM 0 HE ARG A 161 7.135 -15.809 -17.553 1.00 13.53 H new ATOM 0 HH11 ARG A 161 9.762 -13.492 -17.061 1.00 55.01 H new ATOM 0 HH12 ARG A 161 9.401 -12.602 -18.544 1.00 55.01 H new ATOM 0 HH21 ARG A 161 6.695 -14.670 -19.438 1.00 33.52 H new ATOM 0 HH22 ARG A 161 7.674 -13.268 -19.880 1.00 33.52 H new ATOM 2524 N GLU A 162 7.414 -16.676 -10.672 1.00 10.43 N ATOM 2525 CA GLU A 162 7.923 -17.154 -9.391 1.00 72.13 C ATOM 2526 C GLU A 162 6.979 -18.183 -8.777 1.00 73.03 C ATOM 2527 O GLU A 162 7.403 -19.270 -8.384 1.00 14.02 O ATOM 2528 CB GLU A 162 8.121 -15.980 -8.429 1.00 53.53 C ATOM 2529 CG GLU A 162 9.580 -15.612 -8.211 1.00 21.20 C ATOM 2530 CD GLU A 162 10.327 -15.391 -9.513 1.00 54.51 C ATOM 2531 OE1 GLU A 162 10.173 -14.306 -10.110 1.00 4.34 O ATOM 2532 OE2 GLU A 162 11.065 -16.306 -9.934 1.00 50.03 O ATOM 0 H GLU A 162 7.083 -15.711 -10.661 1.00 10.43 H new ATOM 0 HA GLU A 162 8.885 -17.636 -9.566 1.00 72.13 H new ATOM 0 HB2 GLU A 162 7.589 -15.111 -8.816 1.00 53.53 H new ATOM 0 HB3 GLU A 162 7.670 -16.228 -7.468 1.00 53.53 H new ATOM 0 HG2 GLU A 162 9.636 -14.707 -7.606 1.00 21.20 H new ATOM 0 HG3 GLU A 162 10.070 -16.404 -7.645 1.00 21.20 H new ATOM 2539 N ILE A 163 5.698 -17.836 -8.698 1.00 34.40 N ATOM 2540 CA ILE A 163 4.699 -18.724 -8.133 1.00 44.50 C ATOM 2541 C ILE A 163 4.628 -20.038 -8.906 1.00 24.33 C ATOM 2542 O ILE A 163 4.528 -21.113 -8.315 1.00 4.24 O ATOM 2543 CB ILE A 163 3.320 -18.054 -8.129 1.00 74.32 C ATOM 2544 CG1 ILE A 163 3.375 -16.768 -7.313 1.00 10.35 C ATOM 2545 CG2 ILE A 163 2.271 -18.996 -7.567 1.00 73.14 C ATOM 2546 CD1 ILE A 163 2.183 -15.876 -7.531 1.00 32.42 C ATOM 0 H ILE A 163 5.330 -16.941 -9.021 1.00 34.40 H new ATOM 0 HA ILE A 163 4.995 -18.940 -7.106 1.00 44.50 H new ATOM 0 HB ILE A 163 3.042 -17.811 -9.155 1.00 74.32 H new ATOM 0 HG12 ILE A 163 3.444 -17.020 -6.255 1.00 10.35 H new ATOM 0 HG13 ILE A 163 4.282 -16.221 -7.570 1.00 10.35 H new ATOM 0 HG21 ILE A 163 1.299 -18.503 -7.572 1.00 73.14 H new ATOM 0 HG22 ILE A 163 2.225 -19.896 -8.180 1.00 73.14 H new ATOM 0 HG23 ILE A 163 2.535 -19.266 -6.545 1.00 73.14 H new ATOM 0 HD11 ILE A 163 2.284 -14.978 -6.921 1.00 32.42 H new ATOM 0 HD12 ILE A 163 2.126 -15.596 -8.583 1.00 32.42 H new ATOM 0 HD13 ILE A 163 1.274 -16.407 -7.247 1.00 32.42 H new ATOM 2558 N ARG A 164 4.679 -19.941 -10.231 1.00 4.33 N ATOM 2559 CA ARG A 164 4.620 -21.121 -11.087 1.00 33.41 C ATOM 2560 C ARG A 164 5.790 -22.058 -10.806 1.00 62.43 C ATOM 2561 O ARG A 164 5.657 -23.279 -10.894 1.00 71.44 O ATOM 2562 CB ARG A 164 4.625 -20.706 -12.561 1.00 41.42 C ATOM 2563 CG ARG A 164 3.237 -20.643 -13.179 1.00 24.21 C ATOM 2564 CD ARG A 164 3.291 -20.168 -14.622 1.00 65.12 C ATOM 2565 NE ARG A 164 3.980 -21.123 -15.487 1.00 12.31 N ATOM 2566 CZ ARG A 164 3.467 -22.296 -15.855 1.00 75.41 C ATOM 2567 NH1 ARG A 164 2.263 -22.662 -15.433 1.00 14.10 N ATOM 2568 NH2 ARG A 164 4.160 -23.103 -16.646 1.00 72.42 N ATOM 0 H ARG A 164 4.761 -19.058 -10.735 1.00 4.33 H new ATOM 0 HA ARG A 164 3.694 -21.653 -10.868 1.00 33.41 H new ATOM 0 HB2 ARG A 164 5.100 -19.729 -12.653 1.00 41.42 H new ATOM 0 HB3 ARG A 164 5.234 -21.411 -13.127 1.00 41.42 H new ATOM 0 HG2 ARG A 164 2.773 -21.629 -13.136 1.00 24.21 H new ATOM 0 HG3 ARG A 164 2.608 -19.970 -12.596 1.00 24.21 H new ATOM 0 HD2 ARG A 164 2.277 -20.011 -14.990 1.00 65.12 H new ATOM 0 HD3 ARG A 164 3.799 -19.205 -14.668 1.00 65.12 H new ATOM 0 HE ARG A 164 4.909 -20.877 -15.829 1.00 12.31 H new ATOM 0 HH11 ARG A 164 1.726 -22.044 -14.824 1.00 14.10 H new ATOM 0 HH12 ARG A 164 1.874 -23.561 -15.717 1.00 14.10 H new ATOM 0 HH21 ARG A 164 5.086 -22.826 -16.973 1.00 72.42 H new ATOM 0 HH22 ARG A 164 3.768 -24.001 -16.928 1.00 72.42 H new ATOM 2582 N GLN A 165 6.937 -21.479 -10.466 1.00 61.52 N ATOM 2583 CA GLN A 165 8.132 -22.262 -10.172 1.00 24.44 C ATOM 2584 C GLN A 165 7.995 -22.981 -8.833 1.00 71.33 C ATOM 2585 O GLN A 165 8.433 -24.121 -8.680 1.00 24.40 O ATOM 2586 CB GLN A 165 9.367 -21.362 -10.156 1.00 10.41 C ATOM 2587 CG GLN A 165 10.036 -21.221 -11.514 1.00 32.23 C ATOM 2588 CD GLN A 165 11.530 -20.992 -11.408 1.00 4.15 C ATOM 2589 OE1 GLN A 165 12.315 -21.589 -12.146 1.00 3.22 O ATOM 2590 NE2 GLN A 165 11.932 -20.125 -10.486 1.00 51.40 N ATOM 0 H GLN A 165 7.064 -20.470 -10.387 1.00 61.52 H new ATOM 0 HA GLN A 165 8.247 -23.010 -10.956 1.00 24.44 H new ATOM 0 HB2 GLN A 165 9.081 -20.373 -9.797 1.00 10.41 H new ATOM 0 HB3 GLN A 165 10.089 -21.763 -9.445 1.00 10.41 H new ATOM 0 HG2 GLN A 165 9.851 -22.121 -12.101 1.00 32.23 H new ATOM 0 HG3 GLN A 165 9.582 -20.390 -12.054 1.00 32.23 H new ATOM 0 HE21 GLN A 165 11.246 -19.653 -9.896 1.00 51.40 H new ATOM 0 HE22 GLN A 165 12.926 -19.931 -10.367 1.00 51.40 H new ATOM 2599 N HIS A 166 7.382 -22.306 -7.866 1.00 65.42 N ATOM 2600 CA HIS A 166 7.187 -22.879 -6.539 1.00 31.33 C ATOM 2601 C HIS A 166 6.339 -24.144 -6.613 1.00 3.53 C ATOM 2602 O HIS A 166 5.822 -24.446 -7.709 1.00 37.24 O ATOM 2603 CB HIS A 166 6.522 -21.858 -5.614 1.00 22.21 C ATOM 2604 CG HIS A 166 6.307 -22.361 -4.220 1.00 60.23 C ATOM 2605 ND1 HIS A 166 5.072 -22.379 -3.608 1.00 53.00 N ATOM 2606 CD2 HIS A 166 7.179 -22.869 -3.317 1.00 75.24 C ATOM 2607 CE1 HIS A 166 5.192 -22.874 -2.390 1.00 65.03 C ATOM 2608 NE2 HIS A 166 6.461 -23.180 -2.189 1.00 43.44 N ATOM 2609 OXT HIS A 166 6.200 -24.824 -5.575 1.00 53.55 O ATOM 0 H HIS A 166 7.012 -21.362 -7.976 1.00 65.42 H new ATOM 0 HA HIS A 166 8.165 -23.142 -6.136 1.00 31.33 H new ATOM 0 HB2 HIS A 166 7.138 -20.960 -5.576 1.00 22.21 H new ATOM 0 HB3 HIS A 166 5.561 -21.568 -6.039 1.00 22.21 H new ATOM 0 HD2 HIS A 166 8.241 -23.004 -3.458 1.00 75.24 H new ATOM 0 HE1 HIS A 166 4.390 -23.006 -1.679 1.00 65.03 H new ATOM 0 HE2 HIS A 166 6.845 -23.582 -1.334 1.00 43.44 H new