USER MOD reduce.3.24.130724 H: found=0, std=0, add=1076, rem=0, adj=36 USER MOD reduce.3.24.130724 removed 1079 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 109 ASN : amide:sc= -0.664 X(o=-1.4,f=-1.3) USER MOD Set 1.2: A 114 ASN : amide:sc= -0.746 X(o=-1.4,f=-1.1) USER MOD Set 2.1: A 62 ASN : amide:sc= 1.14 K(o=1.1,f=-3.7!) USER MOD Set 2.2: A 65 LYS NZ :NH3+ -127:sc= -0.0415 (180deg=-1.13) USER MOD Set 3.1: A 42 ASN : amide:sc= -5.72! C(o=-7.6!,f=-9.4!) USER MOD Set 3.2: A 119 TYR OH : rot -150:sc= -1.84! USER MOD Set 4.1: A 28 TYR OH : rot -117:sc= 0.783 USER MOD Set 4.2: A 33 HIS : no HE2:sc= -0.404 K(o=0.35,f=-13!) USER MOD Set 4.3: A 70 THR OG1 : rot 11:sc= -0.0298! USER MOD Set 5.1: A 29 ASN : amide:sc= -2.61 K(o=-2.6,f=-2.1!) USER MOD Set 5.2: A 32 GLN : amide:sc= 0 X(o=-2.6,f=-2.6) USER MOD Single : A 13 SER OG : rot 180:sc= 0 USER MOD Single : A 14 SER OG : rot 180:sc= 0 USER MOD Single : A 25 HIS : no HD1:sc= -0.872 K(o=-0.87,f=-0.29) USER MOD Single : A 26 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 34 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 36 SER OG : rot -129:sc= 0.997 USER MOD Single : A 41 TYR OH : rot -150:sc= -0.0697 USER MOD Single : A 45 SER OG : rot -157:sc= -2.5! USER MOD Single : A 46 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 49 TYR OH : rot 180:sc= 0 USER MOD Single : A 50 THR OG1 : rot 180:sc= 0.0414 USER MOD Single : A 51 LYS NZ :NH3+ 165:sc= -0.0229 (180deg=-0.23) USER MOD Single : A 54 TYR OH : rot 106:sc= 0.0247 USER MOD Single : A 56 THR OG1 : rot 87:sc= 1.07 USER MOD Single : A 58 THR OG1 : rot 82:sc= 0.603 USER MOD Single : A 59 THR OG1 : rot 92:sc= 1.28 USER MOD Single : A 61 TYR OH : rot 180:sc= 0 USER MOD Single : A 63 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 64 TYR OH : rot 167:sc= 1.22 USER MOD Single : A 66 SER OG : rot 180:sc= 0.00337 USER MOD Single : A 67 GLN : amide:sc= -19.8! C(o=-20!,f=-17!) USER MOD Single : A 76 SER OG : rot 180:sc= 0 USER MOD Single : A 96 THR OG1 : rot 180:sc= -0.34 USER MOD Single : A 97 LYS NZ :NH3+ 177:sc= 0.125 (180deg=0.122) USER MOD Single : A 99 LYS NZ :NH3+ 175:sc= 0.749 (180deg=0.731) USER MOD Single : A 105 MET CE :methyl 165:sc= -7.44! (180deg=-7.72!) USER MOD Single : A 107 LYS NZ :NH3+ 179:sc= 0 (180deg=-0.000155) USER MOD Single : A 111 ASN : amide:sc= -2.54! C(o=-2.5!,f=-13!) USER MOD Single : A 116 HIS : no HD1:sc= -4.74! C(o=-4.7!,f=-6.9!) USER MOD Single : A 121 TYR OH : rot 23:sc= 0.176 USER MOD Single : A 122 MET CE :methyl 154:sc= -3.67 (180deg=-8.23!) USER MOD Single : A 123 LYS NZ :NH3+ 177:sc= -0.394 (180deg=-0.412) USER MOD Single : A 124 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 125 THR OG1 : rot 77:sc= 1.26 USER MOD Single : A 126 LYS NZ :NH3+ -173:sc= 1.22 (180deg=1.1) USER MOD Single : A 136 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 138 ASN : amide:sc= -1.19 K(o=-1.2,f=-2.6) USER MOD Single : A 140 THR OG1 : rot -161:sc= -1.62! USER MOD Single : A 141 SER OG : rot -108:sc=-0.00681 USER MOD Single : A 155 SER OG : rot 180:sc= 0 USER MOD Single : A 159 SER OG : rot 90:sc= 1.24 USER MOD Single : A 161 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 166 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 173 SER OG : rot 32:sc= 0.329 USER MOD ----------------------------------------------------------------- ATOM 34 N SER A 13 8.933 -15.321 -0.137 1.00 0.71 N ATOM 35 CA SER A 13 10.045 -14.839 0.658 1.00 0.72 C ATOM 36 C SER A 13 10.051 -13.314 0.606 1.00 0.55 C ATOM 37 O SER A 13 10.468 -12.639 1.546 1.00 0.73 O ATOM 38 CB SER A 13 11.362 -15.406 0.114 1.00 0.93 C ATOM 39 OG SER A 13 12.422 -15.262 1.045 1.00 1.68 O ATOM 0 HA SER A 13 9.940 -15.167 1.692 1.00 0.72 H new ATOM 0 HB2 SER A 13 11.231 -16.461 -0.128 1.00 0.93 H new ATOM 0 HB3 SER A 13 11.621 -14.896 -0.814 1.00 0.93 H new ATOM 0 HG SER A 13 13.244 -15.636 0.665 1.00 1.68 H new ATOM 45 N SER A 14 9.550 -12.792 -0.507 1.00 0.38 N ATOM 46 CA SER A 14 9.426 -11.362 -0.727 1.00 0.28 C ATOM 47 C SER A 14 8.168 -11.098 -1.553 1.00 0.26 C ATOM 48 O SER A 14 7.673 -11.988 -2.250 1.00 0.36 O ATOM 49 CB SER A 14 10.680 -10.835 -1.433 1.00 0.35 C ATOM 50 OG SER A 14 11.042 -11.664 -2.528 1.00 0.65 O ATOM 0 H SER A 14 9.216 -13.357 -1.288 1.00 0.38 H new ATOM 0 HA SER A 14 9.336 -10.838 0.224 1.00 0.28 H new ATOM 0 HB2 SER A 14 10.501 -9.819 -1.786 1.00 0.35 H new ATOM 0 HB3 SER A 14 11.506 -10.785 -0.723 1.00 0.35 H new ATOM 0 HG SER A 14 11.844 -11.303 -2.961 1.00 0.65 H new ATOM 56 N ILE A 15 7.650 -9.875 -1.439 1.00 0.22 N ATOM 57 CA ILE A 15 6.341 -9.504 -1.985 1.00 0.22 C ATOM 58 C ILE A 15 6.212 -9.765 -3.481 1.00 0.20 C ATOM 59 O ILE A 15 5.102 -9.896 -3.992 1.00 0.22 O ATOM 60 CB ILE A 15 6.017 -8.011 -1.747 1.00 0.22 C ATOM 61 CG1 ILE A 15 7.062 -7.106 -2.418 1.00 0.21 C ATOM 62 CG2 ILE A 15 5.922 -7.712 -0.258 1.00 0.25 C ATOM 63 CD1 ILE A 15 6.558 -5.704 -2.680 1.00 0.30 C ATOM 0 H ILE A 15 8.127 -9.109 -0.964 1.00 0.22 H new ATOM 0 HA ILE A 15 5.637 -10.141 -1.450 1.00 0.22 H new ATOM 0 HB ILE A 15 5.049 -7.800 -2.201 1.00 0.22 H new ATOM 0 HG12 ILE A 15 7.948 -7.054 -1.785 1.00 0.21 H new ATOM 0 HG13 ILE A 15 7.370 -7.556 -3.362 1.00 0.21 H new ATOM 0 HG21 ILE A 15 5.693 -6.656 -0.113 1.00 0.25 H new ATOM 0 HG22 ILE A 15 5.132 -8.319 0.185 1.00 0.25 H new ATOM 0 HG23 ILE A 15 6.872 -7.947 0.222 1.00 0.25 H new ATOM 0 HD11 ILE A 15 7.344 -5.117 -3.155 1.00 0.30 H new ATOM 0 HD12 ILE A 15 5.690 -5.746 -3.338 1.00 0.30 H new ATOM 0 HD13 ILE A 15 6.276 -5.236 -1.737 1.00 0.30 H new ATOM 75 N PHE A 16 7.335 -9.842 -4.179 1.00 0.20 N ATOM 76 CA PHE A 16 7.314 -9.921 -5.630 1.00 0.20 C ATOM 77 C PHE A 16 7.090 -11.344 -6.121 1.00 0.21 C ATOM 78 O PHE A 16 7.082 -11.595 -7.327 1.00 0.27 O ATOM 79 CB PHE A 16 8.600 -9.374 -6.211 1.00 0.20 C ATOM 80 CG PHE A 16 8.911 -7.989 -5.749 1.00 0.20 C ATOM 81 CD1 PHE A 16 8.267 -6.897 -6.295 1.00 0.22 C ATOM 82 CD2 PHE A 16 9.839 -7.786 -4.753 1.00 0.23 C ATOM 83 CE1 PHE A 16 8.549 -5.626 -5.849 1.00 0.24 C ATOM 84 CE2 PHE A 16 10.122 -6.521 -4.297 1.00 0.25 C ATOM 85 CZ PHE A 16 9.498 -5.412 -4.948 1.00 0.24 C ATOM 0 H PHE A 16 8.268 -9.851 -3.766 1.00 0.20 H new ATOM 0 HA PHE A 16 6.476 -9.314 -5.971 1.00 0.20 H new ATOM 0 HB2 PHE A 16 9.424 -10.034 -5.940 1.00 0.20 H new ATOM 0 HB3 PHE A 16 8.531 -9.381 -7.299 1.00 0.20 H new ATOM 0 HD1 PHE A 16 7.537 -7.041 -7.078 1.00 0.22 H new ATOM 0 HD2 PHE A 16 10.352 -8.634 -4.323 1.00 0.23 H new ATOM 0 HE1 PHE A 16 7.988 -4.789 -6.239 1.00 0.24 H new ATOM 0 HE2 PHE A 16 10.798 -6.369 -3.469 1.00 0.25 H new ATOM 0 HZ PHE A 16 9.798 -4.403 -4.707 1.00 0.24 H new ATOM 95 N ASP A 17 6.929 -12.276 -5.192 1.00 0.23 N ATOM 96 CA ASP A 17 6.534 -13.632 -5.553 1.00 0.27 C ATOM 97 C ASP A 17 5.076 -13.619 -5.982 1.00 0.24 C ATOM 98 O ASP A 17 4.605 -14.507 -6.696 1.00 0.33 O ATOM 99 CB ASP A 17 6.729 -14.595 -4.378 1.00 0.34 C ATOM 100 CG ASP A 17 6.295 -16.013 -4.711 1.00 0.99 C ATOM 101 OD1 ASP A 17 6.932 -16.649 -5.575 1.00 1.24 O ATOM 102 OD2 ASP A 17 5.322 -16.507 -4.098 1.00 1.96 O ATOM 0 H ASP A 17 7.064 -12.122 -4.193 1.00 0.23 H new ATOM 0 HA ASP A 17 7.162 -13.979 -6.373 1.00 0.27 H new ATOM 0 HB2 ASP A 17 7.779 -14.599 -4.086 1.00 0.34 H new ATOM 0 HB3 ASP A 17 6.161 -14.236 -3.520 1.00 0.34 H new ATOM 107 N PHE A 18 4.377 -12.581 -5.553 1.00 0.18 N ATOM 108 CA PHE A 18 2.970 -12.423 -5.863 1.00 0.19 C ATOM 109 C PHE A 18 2.788 -11.534 -7.087 1.00 0.24 C ATOM 110 O PHE A 18 3.668 -10.743 -7.429 1.00 0.40 O ATOM 111 CB PHE A 18 2.246 -11.835 -4.658 1.00 0.20 C ATOM 112 CG PHE A 18 2.394 -12.665 -3.413 1.00 0.18 C ATOM 113 CD1 PHE A 18 3.476 -12.486 -2.568 1.00 0.20 C ATOM 114 CD2 PHE A 18 1.452 -13.630 -3.093 1.00 0.19 C ATOM 115 CE1 PHE A 18 3.621 -13.256 -1.430 1.00 0.22 C ATOM 116 CE2 PHE A 18 1.587 -14.398 -1.955 1.00 0.20 C ATOM 117 CZ PHE A 18 2.660 -14.185 -1.099 1.00 0.20 C ATOM 0 H PHE A 18 4.768 -11.830 -4.984 1.00 0.18 H new ATOM 0 HA PHE A 18 2.543 -13.400 -6.092 1.00 0.19 H new ATOM 0 HB2 PHE A 18 2.629 -10.833 -4.466 1.00 0.20 H new ATOM 0 HB3 PHE A 18 1.187 -11.732 -4.894 1.00 0.20 H new ATOM 0 HD1 PHE A 18 4.216 -11.735 -2.801 1.00 0.20 H new ATOM 0 HD2 PHE A 18 0.602 -13.782 -3.742 1.00 0.19 H new ATOM 0 HE1 PHE A 18 4.489 -13.129 -0.800 1.00 0.22 H new ATOM 0 HE2 PHE A 18 0.859 -15.164 -1.730 1.00 0.20 H new ATOM 0 HZ PHE A 18 2.740 -14.745 -0.179 1.00 0.20 H new ATOM 127 N GLU A 19 1.652 -11.685 -7.747 1.00 0.28 N ATOM 128 CA GLU A 19 1.348 -10.911 -8.944 1.00 0.34 C ATOM 129 C GLU A 19 0.398 -9.767 -8.604 1.00 0.29 C ATOM 130 O GLU A 19 -0.508 -9.935 -7.794 1.00 0.48 O ATOM 131 CB GLU A 19 0.721 -11.818 -10.006 1.00 0.59 C ATOM 132 CG GLU A 19 0.416 -11.114 -11.318 1.00 1.16 C ATOM 133 CD GLU A 19 -0.337 -12.001 -12.283 1.00 1.99 C ATOM 134 OE1 GLU A 19 -1.582 -12.023 -12.225 1.00 2.77 O ATOM 135 OE2 GLU A 19 0.311 -12.692 -13.096 1.00 2.28 O ATOM 0 H GLU A 19 0.920 -12.340 -7.474 1.00 0.28 H new ATOM 0 HA GLU A 19 2.274 -10.491 -9.338 1.00 0.34 H new ATOM 0 HB2 GLU A 19 1.395 -12.652 -10.201 1.00 0.59 H new ATOM 0 HB3 GLU A 19 -0.202 -12.241 -9.609 1.00 0.59 H new ATOM 0 HG2 GLU A 19 -0.171 -10.217 -11.119 1.00 1.16 H new ATOM 0 HG3 GLU A 19 1.349 -10.789 -11.779 1.00 1.16 H new ATOM 142 N VAL A 20 0.597 -8.610 -9.222 1.00 0.24 N ATOM 143 CA VAL A 20 -0.233 -7.446 -8.937 1.00 0.27 C ATOM 144 C VAL A 20 -1.055 -7.052 -10.158 1.00 0.25 C ATOM 145 O VAL A 20 -0.663 -7.312 -11.287 1.00 0.27 O ATOM 146 CB VAL A 20 0.629 -6.250 -8.451 1.00 0.35 C ATOM 147 CG1 VAL A 20 -0.184 -4.969 -8.351 1.00 0.74 C ATOM 148 CG2 VAL A 20 1.226 -6.585 -7.105 1.00 0.49 C ATOM 0 H VAL A 20 1.323 -8.452 -9.921 1.00 0.24 H new ATOM 0 HA VAL A 20 -0.920 -7.716 -8.135 1.00 0.27 H new ATOM 0 HB VAL A 20 1.419 -6.080 -9.183 1.00 0.35 H new ATOM 0 HG11 VAL A 20 0.457 -4.157 -8.008 1.00 0.74 H new ATOM 0 HG12 VAL A 20 -0.592 -4.720 -9.331 1.00 0.74 H new ATOM 0 HG13 VAL A 20 -1.001 -5.111 -7.643 1.00 0.74 H new ATOM 0 HG21 VAL A 20 1.833 -5.749 -6.758 1.00 0.49 H new ATOM 0 HG22 VAL A 20 0.426 -6.775 -6.389 1.00 0.49 H new ATOM 0 HG23 VAL A 20 1.851 -7.474 -7.195 1.00 0.49 H new ATOM 158 N LEU A 21 -2.220 -6.468 -9.915 1.00 0.29 N ATOM 159 CA LEU A 21 -3.068 -5.962 -10.981 1.00 0.31 C ATOM 160 C LEU A 21 -3.055 -4.447 -10.984 1.00 0.27 C ATOM 161 O LEU A 21 -3.150 -3.813 -9.935 1.00 0.28 O ATOM 162 CB LEU A 21 -4.492 -6.495 -10.835 1.00 0.38 C ATOM 163 CG LEU A 21 -4.624 -8.019 -10.877 1.00 0.47 C ATOM 164 CD1 LEU A 21 -6.077 -8.426 -10.727 1.00 0.72 C ATOM 165 CD2 LEU A 21 -4.047 -8.573 -12.170 1.00 0.64 C ATOM 0 H LEU A 21 -2.601 -6.333 -8.978 1.00 0.29 H new ATOM 0 HA LEU A 21 -2.675 -6.312 -11.936 1.00 0.31 H new ATOM 0 HB2 LEU A 21 -4.902 -6.137 -9.891 1.00 0.38 H new ATOM 0 HB3 LEU A 21 -5.105 -6.071 -11.630 1.00 0.38 H new ATOM 0 HG LEU A 21 -4.058 -8.437 -10.044 1.00 0.47 H new ATOM 0 HD11 LEU A 21 -6.156 -9.513 -10.759 1.00 0.72 H new ATOM 0 HD12 LEU A 21 -6.460 -8.062 -9.774 1.00 0.72 H new ATOM 0 HD13 LEU A 21 -6.661 -7.996 -11.541 1.00 0.72 H new ATOM 0 HD21 LEU A 21 -4.151 -9.658 -12.179 1.00 0.64 H new ATOM 0 HD22 LEU A 21 -4.584 -8.150 -13.019 1.00 0.64 H new ATOM 0 HD23 LEU A 21 -2.992 -8.309 -12.240 1.00 0.64 H new ATOM 177 N ASP A 22 -2.895 -3.889 -12.174 1.00 0.28 N ATOM 178 CA ASP A 22 -2.899 -2.448 -12.381 1.00 0.29 C ATOM 179 C ASP A 22 -4.295 -1.893 -12.119 1.00 0.27 C ATOM 180 O ASP A 22 -5.217 -2.662 -11.846 1.00 0.27 O ATOM 181 CB ASP A 22 -2.457 -2.147 -13.826 1.00 0.41 C ATOM 182 CG ASP A 22 -2.395 -0.670 -14.155 1.00 0.95 C ATOM 183 OD1 ASP A 22 -1.360 -0.039 -13.852 1.00 1.32 O ATOM 184 OD2 ASP A 22 -3.375 -0.135 -14.716 1.00 1.59 O ATOM 0 H ASP A 22 -2.758 -4.427 -13.030 1.00 0.28 H new ATOM 0 HA ASP A 22 -2.205 -1.971 -11.689 1.00 0.29 H new ATOM 0 HB2 ASP A 22 -1.474 -2.588 -13.994 1.00 0.41 H new ATOM 0 HB3 ASP A 22 -3.147 -2.634 -14.515 1.00 0.41 H new ATOM 189 N ALA A 23 -4.461 -0.583 -12.201 1.00 0.32 N ATOM 190 CA ALA A 23 -5.772 0.036 -12.050 1.00 0.38 C ATOM 191 C ALA A 23 -6.796 -0.626 -12.973 1.00 0.44 C ATOM 192 O ALA A 23 -7.987 -0.691 -12.661 1.00 0.52 O ATOM 193 CB ALA A 23 -5.680 1.525 -12.350 1.00 0.48 C ATOM 0 H ALA A 23 -3.702 0.077 -12.372 1.00 0.32 H new ATOM 0 HA ALA A 23 -6.102 -0.102 -11.020 1.00 0.38 H new ATOM 0 HB1 ALA A 23 -6.663 1.981 -12.235 1.00 0.48 H new ATOM 0 HB2 ALA A 23 -4.980 1.993 -11.658 1.00 0.48 H new ATOM 0 HB3 ALA A 23 -5.330 1.669 -13.372 1.00 0.48 H new ATOM 199 N ASP A 24 -6.322 -1.128 -14.107 1.00 0.46 N ATOM 200 CA ASP A 24 -7.194 -1.780 -15.076 1.00 0.57 C ATOM 201 C ASP A 24 -7.183 -3.305 -14.911 1.00 0.49 C ATOM 202 O ASP A 24 -7.830 -4.019 -15.674 1.00 0.55 O ATOM 203 CB ASP A 24 -6.772 -1.407 -16.495 1.00 0.76 C ATOM 204 CG ASP A 24 -7.858 -1.702 -17.512 1.00 1.49 C ATOM 205 OD1 ASP A 24 -8.964 -1.138 -17.385 1.00 1.88 O ATOM 206 OD2 ASP A 24 -7.607 -2.503 -18.437 1.00 2.22 O ATOM 0 H ASP A 24 -5.339 -1.096 -14.378 1.00 0.46 H new ATOM 0 HA ASP A 24 -8.211 -1.431 -14.895 1.00 0.57 H new ATOM 0 HB2 ASP A 24 -6.521 -0.347 -16.531 1.00 0.76 H new ATOM 0 HB3 ASP A 24 -5.869 -1.957 -16.760 1.00 0.76 H new ATOM 211 N HIS A 25 -6.427 -3.797 -13.922 1.00 0.43 N ATOM 212 CA HIS A 25 -6.358 -5.228 -13.603 1.00 0.42 C ATOM 213 C HIS A 25 -5.523 -5.970 -14.630 1.00 0.46 C ATOM 214 O HIS A 25 -5.536 -7.197 -14.695 1.00 0.53 O ATOM 215 CB HIS A 25 -7.738 -5.866 -13.461 1.00 0.45 C ATOM 216 CG HIS A 25 -8.510 -5.394 -12.266 1.00 0.51 C ATOM 217 ND1 HIS A 25 -8.827 -6.204 -11.199 1.00 0.57 N ATOM 218 CD2 HIS A 25 -9.031 -4.180 -11.976 1.00 0.66 C ATOM 219 CE1 HIS A 25 -9.502 -5.508 -10.305 1.00 0.67 C ATOM 220 NE2 HIS A 25 -9.648 -4.273 -10.751 1.00 0.73 N ATOM 0 H HIS A 25 -5.846 -3.214 -13.320 1.00 0.43 H new ATOM 0 HA HIS A 25 -5.872 -5.311 -12.631 1.00 0.42 H new ATOM 0 HB2 HIS A 25 -8.317 -5.657 -14.360 1.00 0.45 H new ATOM 0 HB3 HIS A 25 -7.622 -6.948 -13.401 1.00 0.45 H new ATOM 0 HD2 HIS A 25 -8.973 -3.297 -12.595 1.00 0.66 H new ATOM 0 HE1 HIS A 25 -9.874 -5.885 -9.364 1.00 0.67 H new ATOM 0 HE2 HIS A 25 -10.135 -3.518 -10.269 1.00 0.73 H new ATOM 229 N LYS A 26 -4.811 -5.206 -15.446 1.00 0.49 N ATOM 230 CA LYS A 26 -3.739 -5.754 -16.255 1.00 0.53 C ATOM 231 C LYS A 26 -2.629 -6.117 -15.290 1.00 0.45 C ATOM 232 O LYS A 26 -2.480 -5.440 -14.274 1.00 0.42 O ATOM 233 CB LYS A 26 -3.221 -4.712 -17.254 1.00 0.63 C ATOM 234 CG LYS A 26 -4.300 -3.939 -17.998 1.00 0.85 C ATOM 235 CD LYS A 26 -5.078 -4.805 -18.979 1.00 1.58 C ATOM 236 CE LYS A 26 -6.312 -5.423 -18.343 1.00 2.38 C ATOM 237 NZ LYS A 26 -7.191 -6.058 -19.359 1.00 3.25 N ATOM 0 H LYS A 26 -4.959 -4.204 -15.563 1.00 0.49 H new ATOM 0 HA LYS A 26 -4.088 -6.614 -16.827 1.00 0.53 H new ATOM 0 HB2 LYS A 26 -2.590 -4.002 -16.720 1.00 0.63 H new ATOM 0 HB3 LYS A 26 -2.587 -5.215 -17.984 1.00 0.63 H new ATOM 0 HG2 LYS A 26 -4.992 -3.505 -17.276 1.00 0.85 H new ATOM 0 HG3 LYS A 26 -3.840 -3.111 -18.537 1.00 0.85 H new ATOM 0 HD2 LYS A 26 -5.376 -4.202 -19.837 1.00 1.58 H new ATOM 0 HD3 LYS A 26 -4.430 -5.596 -19.356 1.00 1.58 H new ATOM 0 HE2 LYS A 26 -6.009 -6.168 -17.607 1.00 2.38 H new ATOM 0 HE3 LYS A 26 -6.870 -4.655 -17.808 1.00 2.38 H new ATOM 0 HZ1 LYS A 26 -8.023 -6.469 -18.890 1.00 3.25 H new ATOM 0 HZ2 LYS A 26 -7.500 -5.342 -20.047 1.00 3.25 H new ATOM 0 HZ3 LYS A 26 -6.666 -6.808 -19.852 1.00 3.25 H new ATOM 251 N PRO A 27 -1.859 -7.180 -15.535 1.00 0.51 N ATOM 252 CA PRO A 27 -0.786 -7.541 -14.618 1.00 0.46 C ATOM 253 C PRO A 27 0.197 -6.386 -14.445 1.00 0.36 C ATOM 254 O PRO A 27 0.913 -6.008 -15.377 1.00 0.41 O ATOM 255 CB PRO A 27 -0.110 -8.743 -15.294 1.00 0.58 C ATOM 256 CG PRO A 27 -0.607 -8.741 -16.705 1.00 0.86 C ATOM 257 CD PRO A 27 -1.965 -8.102 -16.670 1.00 0.68 C ATOM 0 HA PRO A 27 -1.150 -7.773 -13.617 1.00 0.46 H new ATOM 0 HB2 PRO A 27 0.976 -8.652 -15.260 1.00 0.58 H new ATOM 0 HB3 PRO A 27 -0.368 -9.674 -14.789 1.00 0.58 H new ATOM 0 HG2 PRO A 27 0.068 -8.184 -17.355 1.00 0.86 H new ATOM 0 HG3 PRO A 27 -0.664 -9.756 -17.099 1.00 0.86 H new ATOM 0 HD2 PRO A 27 -2.189 -7.577 -17.598 1.00 0.68 H new ATOM 0 HD3 PRO A 27 -2.755 -8.838 -16.521 1.00 0.68 H new ATOM 265 N TYR A 28 0.220 -5.838 -13.238 1.00 0.28 N ATOM 266 CA TYR A 28 1.133 -4.766 -12.884 1.00 0.22 C ATOM 267 C TYR A 28 2.512 -5.320 -12.590 1.00 0.22 C ATOM 268 O TYR A 28 2.668 -6.252 -11.797 1.00 0.28 O ATOM 269 CB TYR A 28 0.602 -3.999 -11.670 1.00 0.20 C ATOM 270 CG TYR A 28 1.401 -2.771 -11.289 1.00 0.19 C ATOM 271 CD1 TYR A 28 1.405 -1.651 -12.109 1.00 0.21 C ATOM 272 CD2 TYR A 28 2.168 -2.735 -10.126 1.00 0.19 C ATOM 273 CE1 TYR A 28 2.140 -0.531 -11.782 1.00 0.23 C ATOM 274 CE2 TYR A 28 2.902 -1.619 -9.795 1.00 0.21 C ATOM 275 CZ TYR A 28 2.845 -0.515 -10.563 1.00 0.22 C ATOM 276 OH TYR A 28 3.616 0.583 -10.277 1.00 0.28 O ATOM 0 H TYR A 28 -0.396 -6.126 -12.477 1.00 0.28 H new ATOM 0 HA TYR A 28 1.207 -4.081 -13.728 1.00 0.22 H new ATOM 0 HB2 TYR A 28 -0.426 -3.697 -11.871 1.00 0.20 H new ATOM 0 HB3 TYR A 28 0.574 -4.675 -10.816 1.00 0.20 H new ATOM 0 HD1 TYR A 28 0.823 -1.657 -13.018 1.00 0.21 H new ATOM 0 HD2 TYR A 28 2.187 -3.596 -9.474 1.00 0.19 H new ATOM 0 HE1 TYR A 28 2.174 0.318 -12.448 1.00 0.23 H new ATOM 0 HE2 TYR A 28 3.527 -1.629 -8.914 1.00 0.21 H new ATOM 0 HH TYR A 28 4.557 0.316 -10.219 1.00 0.28 H new ATOM 286 N ASN A 29 3.507 -4.748 -13.241 1.00 0.27 N ATOM 287 CA ASN A 29 4.883 -5.152 -13.039 1.00 0.33 C ATOM 288 C ASN A 29 5.391 -4.567 -11.727 1.00 0.27 C ATOM 289 O ASN A 29 6.045 -3.527 -11.703 1.00 0.34 O ATOM 290 CB ASN A 29 5.738 -4.681 -14.224 1.00 0.49 C ATOM 291 CG ASN A 29 7.166 -5.203 -14.209 1.00 0.64 C ATOM 292 OD1 ASN A 29 8.073 -4.556 -14.727 1.00 1.65 O ATOM 293 ND2 ASN A 29 7.386 -6.372 -13.630 1.00 0.65 N ATOM 0 H ASN A 29 3.385 -3.996 -13.919 1.00 0.27 H new ATOM 0 HA ASN A 29 4.950 -6.238 -12.983 1.00 0.33 H new ATOM 0 HB2 ASN A 29 5.258 -4.995 -15.151 1.00 0.49 H new ATOM 0 HB3 ASN A 29 5.761 -3.591 -14.230 1.00 0.49 H new ATOM 0 HD21 ASN A 29 8.329 -6.759 -13.605 1.00 0.65 H new ATOM 0 HD22 ASN A 29 6.612 -6.886 -13.208 1.00 0.65 H new ATOM 300 N LEU A 30 5.068 -5.236 -10.627 1.00 0.20 N ATOM 301 CA LEU A 30 5.408 -4.735 -9.304 1.00 0.17 C ATOM 302 C LEU A 30 6.906 -4.840 -9.069 1.00 0.16 C ATOM 303 O LEU A 30 7.515 -3.988 -8.425 1.00 0.16 O ATOM 304 CB LEU A 30 4.650 -5.507 -8.201 1.00 0.19 C ATOM 305 CG LEU A 30 5.279 -6.820 -7.706 1.00 0.20 C ATOM 306 CD1 LEU A 30 4.619 -7.268 -6.412 1.00 0.25 C ATOM 307 CD2 LEU A 30 5.147 -7.914 -8.757 1.00 0.22 C ATOM 0 H LEU A 30 4.571 -6.127 -10.626 1.00 0.20 H new ATOM 0 HA LEU A 30 5.108 -3.688 -9.257 1.00 0.17 H new ATOM 0 HB2 LEU A 30 4.533 -4.844 -7.344 1.00 0.19 H new ATOM 0 HB3 LEU A 30 3.649 -5.730 -8.571 1.00 0.19 H new ATOM 0 HG LEU A 30 6.338 -6.639 -7.523 1.00 0.20 H new ATOM 0 HD11 LEU A 30 5.075 -8.199 -6.074 1.00 0.25 H new ATOM 0 HD12 LEU A 30 4.754 -6.500 -5.650 1.00 0.25 H new ATOM 0 HD13 LEU A 30 3.554 -7.427 -6.583 1.00 0.25 H new ATOM 0 HD21 LEU A 30 5.599 -8.833 -8.384 1.00 0.22 H new ATOM 0 HD22 LEU A 30 4.092 -8.089 -8.970 1.00 0.22 H new ATOM 0 HD23 LEU A 30 5.655 -7.604 -9.670 1.00 0.22 H new ATOM 319 N VAL A 31 7.492 -5.878 -9.636 1.00 0.16 N ATOM 320 CA VAL A 31 8.854 -6.264 -9.322 1.00 0.18 C ATOM 321 C VAL A 31 9.891 -5.375 -10.011 1.00 0.18 C ATOM 322 O VAL A 31 11.092 -5.543 -9.811 1.00 0.21 O ATOM 323 CB VAL A 31 9.063 -7.752 -9.653 1.00 0.22 C ATOM 324 CG1 VAL A 31 9.165 -7.988 -11.151 1.00 0.38 C ATOM 325 CG2 VAL A 31 10.253 -8.329 -8.914 1.00 0.41 C ATOM 0 H VAL A 31 7.038 -6.476 -10.326 1.00 0.16 H new ATOM 0 HA VAL A 31 9.006 -6.119 -8.253 1.00 0.18 H new ATOM 0 HB VAL A 31 8.178 -8.284 -9.304 1.00 0.22 H new ATOM 0 HG11 VAL A 31 9.312 -9.051 -11.343 1.00 0.38 H new ATOM 0 HG12 VAL A 31 8.247 -7.656 -11.635 1.00 0.38 H new ATOM 0 HG13 VAL A 31 10.009 -7.427 -11.551 1.00 0.38 H new ATOM 0 HG21 VAL A 31 10.367 -9.381 -9.174 1.00 0.41 H new ATOM 0 HG22 VAL A 31 11.155 -7.785 -9.196 1.00 0.41 H new ATOM 0 HG23 VAL A 31 10.094 -8.236 -7.840 1.00 0.41 H new ATOM 335 N GLN A 32 9.432 -4.408 -10.796 1.00 0.18 N ATOM 336 CA GLN A 32 10.339 -3.435 -11.383 1.00 0.22 C ATOM 337 C GLN A 32 10.620 -2.339 -10.364 1.00 0.21 C ATOM 338 O GLN A 32 11.460 -1.467 -10.573 1.00 0.25 O ATOM 339 CB GLN A 32 9.752 -2.828 -12.660 1.00 0.28 C ATOM 340 CG GLN A 32 8.506 -1.990 -12.415 1.00 0.29 C ATOM 341 CD GLN A 32 8.100 -1.163 -13.621 1.00 0.43 C ATOM 342 OE1 GLN A 32 8.322 -1.553 -14.766 1.00 1.24 O ATOM 343 NE2 GLN A 32 7.514 -0.005 -13.372 1.00 1.18 N ATOM 0 H GLN A 32 8.449 -4.279 -11.038 1.00 0.18 H new ATOM 0 HA GLN A 32 11.267 -3.939 -11.652 1.00 0.22 H new ATOM 0 HB2 GLN A 32 10.509 -2.208 -13.140 1.00 0.28 H new ATOM 0 HB3 GLN A 32 9.510 -3.631 -13.356 1.00 0.28 H new ATOM 0 HG2 GLN A 32 7.682 -2.647 -12.138 1.00 0.29 H new ATOM 0 HG3 GLN A 32 8.682 -1.326 -11.569 1.00 0.29 H new ATOM 0 HE21 GLN A 32 7.346 0.285 -12.409 1.00 1.18 H new ATOM 0 HE22 GLN A 32 7.229 0.599 -14.143 1.00 1.18 H new ATOM 352 N HIS A 33 9.908 -2.411 -9.247 1.00 0.19 N ATOM 353 CA HIS A 33 10.059 -1.455 -8.167 1.00 0.21 C ATOM 354 C HIS A 33 11.054 -2.011 -7.173 1.00 0.23 C ATOM 355 O HIS A 33 11.415 -1.362 -6.197 1.00 0.38 O ATOM 356 CB HIS A 33 8.713 -1.195 -7.492 1.00 0.22 C ATOM 357 CG HIS A 33 7.708 -0.572 -8.409 1.00 0.22 C ATOM 358 ND1 HIS A 33 7.914 0.647 -9.012 1.00 0.25 N ATOM 359 CD2 HIS A 33 6.498 -1.008 -8.848 1.00 0.21 C ATOM 360 CE1 HIS A 33 6.888 0.937 -9.783 1.00 0.26 C ATOM 361 NE2 HIS A 33 6.014 -0.047 -9.703 1.00 0.24 N ATOM 0 H HIS A 33 9.211 -3.134 -9.068 1.00 0.19 H new ATOM 0 HA HIS A 33 10.422 -0.505 -8.560 1.00 0.21 H new ATOM 0 HB2 HIS A 33 8.316 -2.136 -7.113 1.00 0.22 H new ATOM 0 HB3 HIS A 33 8.864 -0.543 -6.632 1.00 0.22 H new ATOM 0 HD1 HIS A 33 8.736 1.236 -8.881 1.00 0.25 H new ATOM 0 HD2 HIS A 33 6.010 -1.933 -8.577 1.00 0.21 H new ATOM 0 HE1 HIS A 33 6.780 1.830 -10.380 1.00 0.26 H new ATOM 370 N LYS A 34 11.514 -3.217 -7.464 1.00 0.20 N ATOM 371 CA LYS A 34 12.443 -3.908 -6.605 1.00 0.21 C ATOM 372 C LYS A 34 13.850 -3.356 -6.800 1.00 0.21 C ATOM 373 O LYS A 34 14.246 -3.018 -7.913 1.00 0.28 O ATOM 374 CB LYS A 34 12.414 -5.407 -6.889 1.00 0.26 C ATOM 375 CG LYS A 34 13.174 -6.198 -5.849 1.00 0.35 C ATOM 376 CD LYS A 34 13.141 -7.689 -6.112 1.00 0.79 C ATOM 377 CE LYS A 34 13.904 -8.058 -7.367 1.00 1.03 C ATOM 378 NZ LYS A 34 14.054 -9.530 -7.501 1.00 1.73 N ATOM 0 H LYS A 34 11.251 -3.737 -8.301 1.00 0.20 H new ATOM 0 HA LYS A 34 12.147 -3.748 -5.568 1.00 0.21 H new ATOM 0 HB2 LYS A 34 11.380 -5.750 -6.920 1.00 0.26 H new ATOM 0 HB3 LYS A 34 12.842 -5.597 -7.873 1.00 0.26 H new ATOM 0 HG2 LYS A 34 14.210 -5.860 -5.826 1.00 0.35 H new ATOM 0 HG3 LYS A 34 12.751 -5.997 -4.865 1.00 0.35 H new ATOM 0 HD2 LYS A 34 13.567 -8.218 -5.259 1.00 0.79 H new ATOM 0 HD3 LYS A 34 12.106 -8.018 -6.206 1.00 0.79 H new ATOM 0 HE2 LYS A 34 13.383 -7.664 -8.240 1.00 1.03 H new ATOM 0 HE3 LYS A 34 14.889 -7.591 -7.346 1.00 1.03 H new ATOM 0 HZ1 LYS A 34 14.581 -9.747 -8.371 1.00 1.73 H new ATOM 0 HZ2 LYS A 34 14.572 -9.902 -6.680 1.00 1.73 H new ATOM 0 HZ3 LYS A 34 13.114 -9.972 -7.546 1.00 1.73 H new ATOM 392 N GLY A 35 14.593 -3.263 -5.710 1.00 0.21 N ATOM 393 CA GLY A 35 15.915 -2.674 -5.747 1.00 0.25 C ATOM 394 C GLY A 35 15.928 -1.358 -5.010 1.00 0.26 C ATOM 395 O GLY A 35 16.976 -0.858 -4.607 1.00 0.36 O ATOM 0 H GLY A 35 14.300 -3.589 -4.789 1.00 0.21 H new ATOM 0 HA2 GLY A 35 16.636 -3.356 -5.297 1.00 0.25 H new ATOM 0 HA3 GLY A 35 16.223 -2.521 -6.781 1.00 0.25 H new ATOM 399 N SER A 36 14.743 -0.810 -4.833 1.00 0.25 N ATOM 400 CA SER A 36 14.552 0.422 -4.100 1.00 0.29 C ATOM 401 C SER A 36 13.269 0.310 -3.289 1.00 0.24 C ATOM 402 O SER A 36 12.282 -0.242 -3.768 1.00 0.31 O ATOM 403 CB SER A 36 14.481 1.609 -5.061 1.00 0.43 C ATOM 404 OG SER A 36 15.698 1.769 -5.778 1.00 1.14 O ATOM 0 H SER A 36 13.879 -1.212 -5.197 1.00 0.25 H new ATOM 0 HA SER A 36 15.395 0.588 -3.429 1.00 0.29 H new ATOM 0 HB2 SER A 36 13.660 1.462 -5.763 1.00 0.43 H new ATOM 0 HB3 SER A 36 14.264 2.519 -4.502 1.00 0.43 H new ATOM 0 HG SER A 36 15.998 2.699 -5.710 1.00 1.14 H new ATOM 410 N PRO A 37 13.276 0.799 -2.046 1.00 0.22 N ATOM 411 CA PRO A 37 12.123 0.697 -1.148 1.00 0.20 C ATOM 412 C PRO A 37 10.931 1.492 -1.649 1.00 0.19 C ATOM 413 O PRO A 37 11.080 2.491 -2.359 1.00 0.24 O ATOM 414 CB PRO A 37 12.637 1.268 0.175 1.00 0.26 C ATOM 415 CG PRO A 37 14.115 1.240 0.044 1.00 0.52 C ATOM 416 CD PRO A 37 14.394 1.490 -1.406 1.00 0.32 C ATOM 0 HA PRO A 37 11.765 -0.329 -1.065 1.00 0.20 H new ATOM 0 HB2 PRO A 37 12.272 2.282 0.338 1.00 0.26 H new ATOM 0 HB3 PRO A 37 12.302 0.669 1.022 1.00 0.26 H new ATOM 0 HG2 PRO A 37 14.579 2.002 0.670 1.00 0.52 H new ATOM 0 HG3 PRO A 37 14.519 0.278 0.361 1.00 0.52 H new ATOM 0 HD2 PRO A 37 14.407 2.554 -1.643 1.00 0.32 H new ATOM 0 HD3 PRO A 37 15.357 1.083 -1.714 1.00 0.32 H new ATOM 424 N LEU A 38 9.757 1.053 -1.254 1.00 0.18 N ATOM 425 CA LEU A 38 8.520 1.593 -1.764 1.00 0.19 C ATOM 426 C LEU A 38 7.408 1.384 -0.745 1.00 0.18 C ATOM 427 O LEU A 38 7.520 0.545 0.142 1.00 0.24 O ATOM 428 CB LEU A 38 8.152 0.924 -3.103 1.00 0.24 C ATOM 429 CG LEU A 38 7.823 -0.580 -3.052 1.00 0.40 C ATOM 430 CD1 LEU A 38 7.173 -1.037 -4.344 1.00 0.79 C ATOM 431 CD2 LEU A 38 9.062 -1.425 -2.788 1.00 1.03 C ATOM 0 H LEU A 38 9.635 0.309 -0.567 1.00 0.18 H new ATOM 0 HA LEU A 38 8.646 2.662 -1.938 1.00 0.19 H new ATOM 0 HB2 LEU A 38 7.292 1.447 -3.521 1.00 0.24 H new ATOM 0 HB3 LEU A 38 8.981 1.069 -3.796 1.00 0.24 H new ATOM 0 HG LEU A 38 7.127 -0.720 -2.225 1.00 0.40 H new ATOM 0 HD11 LEU A 38 6.951 -2.102 -4.282 1.00 0.79 H new ATOM 0 HD12 LEU A 38 6.248 -0.482 -4.502 1.00 0.79 H new ATOM 0 HD13 LEU A 38 7.852 -0.856 -5.177 1.00 0.79 H new ATOM 0 HD21 LEU A 38 8.785 -2.479 -2.760 1.00 1.03 H new ATOM 0 HD22 LEU A 38 9.790 -1.262 -3.583 1.00 1.03 H new ATOM 0 HD23 LEU A 38 9.500 -1.140 -1.832 1.00 1.03 H new ATOM 443 N LEU A 39 6.352 2.164 -0.855 1.00 0.17 N ATOM 444 CA LEU A 39 5.200 1.995 0.010 1.00 0.16 C ATOM 445 C LEU A 39 4.012 1.544 -0.798 1.00 0.19 C ATOM 446 O LEU A 39 3.965 1.742 -2.006 1.00 0.42 O ATOM 447 CB LEU A 39 4.848 3.274 0.756 1.00 0.21 C ATOM 448 CG LEU A 39 5.346 3.344 2.203 1.00 0.25 C ATOM 449 CD1 LEU A 39 6.858 3.241 2.275 1.00 0.97 C ATOM 450 CD2 LEU A 39 4.876 4.627 2.851 1.00 1.10 C ATOM 0 H LEU A 39 6.267 2.921 -1.534 1.00 0.17 H new ATOM 0 HA LEU A 39 5.460 1.238 0.750 1.00 0.16 H new ATOM 0 HB2 LEU A 39 5.259 4.121 0.206 1.00 0.21 H new ATOM 0 HB3 LEU A 39 3.764 3.389 0.756 1.00 0.21 H new ATOM 0 HG LEU A 39 4.929 2.495 2.745 1.00 0.25 H new ATOM 0 HD11 LEU A 39 7.177 3.294 3.316 1.00 0.97 H new ATOM 0 HD12 LEU A 39 7.179 2.292 1.845 1.00 0.97 H new ATOM 0 HD13 LEU A 39 7.306 4.063 1.716 1.00 0.97 H new ATOM 0 HD21 LEU A 39 5.235 4.668 3.879 1.00 1.10 H new ATOM 0 HD22 LEU A 39 5.267 5.480 2.296 1.00 1.10 H new ATOM 0 HD23 LEU A 39 3.787 4.660 2.845 1.00 1.10 H new ATOM 462 N ILE A 40 3.066 0.930 -0.126 1.00 0.18 N ATOM 463 CA ILE A 40 1.891 0.381 -0.776 1.00 0.15 C ATOM 464 C ILE A 40 0.670 0.601 0.105 1.00 0.14 C ATOM 465 O ILE A 40 0.612 0.087 1.223 1.00 0.15 O ATOM 466 CB ILE A 40 2.091 -1.125 -1.081 1.00 0.16 C ATOM 467 CG1 ILE A 40 3.274 -1.309 -2.043 1.00 0.18 C ATOM 468 CG2 ILE A 40 0.829 -1.731 -1.673 1.00 0.20 C ATOM 469 CD1 ILE A 40 3.666 -2.746 -2.289 1.00 0.18 C ATOM 0 H ILE A 40 3.086 0.795 0.885 1.00 0.18 H new ATOM 0 HA ILE A 40 1.735 0.894 -1.725 1.00 0.15 H new ATOM 0 HB ILE A 40 2.307 -1.642 -0.146 1.00 0.16 H new ATOM 0 HG12 ILE A 40 3.025 -0.846 -2.998 1.00 0.18 H new ATOM 0 HG13 ILE A 40 4.136 -0.774 -1.645 1.00 0.18 H new ATOM 0 HG21 ILE A 40 0.995 -2.789 -1.878 1.00 0.20 H new ATOM 0 HG22 ILE A 40 0.007 -1.623 -0.965 1.00 0.20 H new ATOM 0 HG23 ILE A 40 0.579 -1.216 -2.601 1.00 0.20 H new ATOM 0 HD11 ILE A 40 4.509 -2.780 -2.979 1.00 0.18 H new ATOM 0 HD12 ILE A 40 3.951 -3.212 -1.346 1.00 0.18 H new ATOM 0 HD13 ILE A 40 2.822 -3.285 -2.720 1.00 0.18 H new ATOM 481 N TYR A 41 -0.289 1.383 -0.384 1.00 0.13 N ATOM 482 CA TYR A 41 -1.434 1.761 0.424 1.00 0.13 C ATOM 483 C TYR A 41 -2.672 0.954 0.033 1.00 0.14 C ATOM 484 O TYR A 41 -3.073 0.960 -1.123 1.00 0.19 O ATOM 485 CB TYR A 41 -1.727 3.263 0.258 1.00 0.15 C ATOM 486 CG TYR A 41 -0.679 4.197 0.834 1.00 0.14 C ATOM 487 CD1 TYR A 41 0.593 4.285 0.290 1.00 0.17 C ATOM 488 CD2 TYR A 41 -0.982 5.019 1.912 1.00 0.18 C ATOM 489 CE1 TYR A 41 1.532 5.159 0.805 1.00 0.19 C ATOM 490 CE2 TYR A 41 -0.049 5.893 2.435 1.00 0.20 C ATOM 491 CZ TYR A 41 1.206 5.960 1.875 1.00 0.18 C ATOM 492 OH TYR A 41 2.138 6.829 2.388 1.00 0.23 O ATOM 0 H TYR A 41 -0.292 1.763 -1.331 1.00 0.13 H new ATOM 0 HA TYR A 41 -1.195 1.549 1.466 1.00 0.13 H new ATOM 0 HB2 TYR A 41 -1.838 3.479 -0.805 1.00 0.15 H new ATOM 0 HB3 TYR A 41 -2.685 3.484 0.730 1.00 0.15 H new ATOM 0 HD1 TYR A 41 0.855 3.660 -0.551 1.00 0.17 H new ATOM 0 HD2 TYR A 41 -1.968 4.974 2.350 1.00 0.18 H new ATOM 0 HE1 TYR A 41 2.519 5.213 0.369 1.00 0.19 H new ATOM 0 HE2 TYR A 41 -0.303 6.519 3.277 1.00 0.20 H new ATOM 0 HH TYR A 41 1.976 6.954 3.347 1.00 0.23 H new ATOM 502 N ASN A 42 -3.260 0.267 1.003 1.00 0.16 N ATOM 503 CA ASN A 42 -4.583 -0.339 0.842 1.00 0.18 C ATOM 504 C ASN A 42 -5.634 0.750 1.017 1.00 0.18 C ATOM 505 O ASN A 42 -6.084 1.036 2.123 1.00 0.21 O ATOM 506 CB ASN A 42 -4.795 -1.451 1.873 1.00 0.26 C ATOM 507 CG ASN A 42 -4.196 -1.134 3.230 1.00 0.46 C ATOM 508 OD1 ASN A 42 -4.839 -0.552 4.099 1.00 1.25 O ATOM 509 ND2 ASN A 42 -2.951 -1.537 3.424 1.00 1.28 N ATOM 0 H ASN A 42 -2.840 0.112 1.920 1.00 0.16 H new ATOM 0 HA ASN A 42 -4.666 -0.783 -0.150 1.00 0.18 H new ATOM 0 HB2 ASN A 42 -5.864 -1.631 1.989 1.00 0.26 H new ATOM 0 HB3 ASN A 42 -4.355 -2.375 1.496 1.00 0.26 H new ATOM 0 HD21 ASN A 42 -2.494 -1.367 4.320 1.00 1.28 H new ATOM 0 HD22 ASN A 42 -2.448 -2.018 2.678 1.00 1.28 H new ATOM 516 N VAL A 43 -6.040 1.349 -0.081 1.00 0.18 N ATOM 517 CA VAL A 43 -6.750 2.616 -0.021 1.00 0.21 C ATOM 518 C VAL A 43 -8.198 2.506 -0.471 1.00 0.25 C ATOM 519 O VAL A 43 -8.488 1.951 -1.531 1.00 0.35 O ATOM 520 CB VAL A 43 -6.031 3.683 -0.879 1.00 0.27 C ATOM 521 CG1 VAL A 43 -5.724 3.154 -2.271 1.00 0.68 C ATOM 522 CG2 VAL A 43 -6.865 4.950 -0.971 1.00 0.88 C ATOM 0 H VAL A 43 -5.894 0.985 -1.023 1.00 0.18 H new ATOM 0 HA VAL A 43 -6.751 2.915 1.027 1.00 0.21 H new ATOM 0 HB VAL A 43 -5.087 3.920 -0.389 1.00 0.27 H new ATOM 0 HG11 VAL A 43 -5.219 3.927 -2.851 1.00 0.68 H new ATOM 0 HG12 VAL A 43 -5.079 2.278 -2.194 1.00 0.68 H new ATOM 0 HG13 VAL A 43 -6.654 2.877 -2.768 1.00 0.68 H new ATOM 0 HG21 VAL A 43 -6.341 5.687 -1.579 1.00 0.88 H new ATOM 0 HG22 VAL A 43 -7.827 4.720 -1.429 1.00 0.88 H new ATOM 0 HG23 VAL A 43 -7.026 5.353 0.029 1.00 0.88 H new ATOM 532 N ALA A 44 -9.106 3.063 0.336 1.00 0.32 N ATOM 533 CA ALA A 44 -10.483 3.228 -0.092 1.00 0.39 C ATOM 534 C ALA A 44 -10.483 3.989 -1.397 1.00 0.36 C ATOM 535 O ALA A 44 -10.084 5.152 -1.469 1.00 0.42 O ATOM 536 CB ALA A 44 -11.324 3.944 0.946 1.00 0.52 C ATOM 0 H ALA A 44 -8.908 3.401 1.278 1.00 0.32 H new ATOM 0 HA ALA A 44 -10.932 2.244 -0.224 1.00 0.39 H new ATOM 0 HB1 ALA A 44 -12.346 4.044 0.580 1.00 0.52 H new ATOM 0 HB2 ALA A 44 -11.325 3.370 1.873 1.00 0.52 H new ATOM 0 HB3 ALA A 44 -10.907 4.934 1.132 1.00 0.52 H new ATOM 542 N SER A 45 -10.911 3.305 -2.417 1.00 0.39 N ATOM 543 CA SER A 45 -10.665 3.699 -3.775 1.00 0.45 C ATOM 544 C SER A 45 -11.544 4.870 -4.233 1.00 0.47 C ATOM 545 O SER A 45 -12.560 4.677 -4.900 1.00 0.60 O ATOM 546 CB SER A 45 -10.860 2.445 -4.608 1.00 0.62 C ATOM 547 OG SER A 45 -11.651 1.511 -3.901 1.00 1.84 O ATOM 0 H SER A 45 -11.450 2.443 -2.328 1.00 0.39 H new ATOM 0 HA SER A 45 -9.654 4.090 -3.890 1.00 0.45 H new ATOM 0 HB2 SER A 45 -11.340 2.698 -5.553 1.00 0.62 H new ATOM 0 HB3 SER A 45 -9.892 2.005 -4.849 1.00 0.62 H new ATOM 0 HG SER A 45 -11.483 0.610 -4.249 1.00 1.84 H new ATOM 553 N LYS A 46 -11.112 6.082 -3.860 1.00 0.56 N ATOM 554 CA LYS A 46 -11.779 7.334 -4.235 1.00 0.65 C ATOM 555 C LYS A 46 -13.081 7.482 -3.454 1.00 0.63 C ATOM 556 O LYS A 46 -14.144 7.738 -4.018 1.00 0.83 O ATOM 557 CB LYS A 46 -12.034 7.401 -5.752 1.00 0.77 C ATOM 558 CG LYS A 46 -12.473 8.775 -6.252 1.00 1.12 C ATOM 559 CD LYS A 46 -11.332 9.782 -6.225 1.00 1.59 C ATOM 560 CE LYS A 46 -11.821 11.176 -6.587 1.00 2.01 C ATOM 561 NZ LYS A 46 -10.700 12.118 -6.853 1.00 2.43 N ATOM 0 H LYS A 46 -10.282 6.221 -3.284 1.00 0.56 H new ATOM 0 HA LYS A 46 -11.121 8.165 -3.981 1.00 0.65 H new ATOM 0 HB2 LYS A 46 -11.123 7.110 -6.275 1.00 0.77 H new ATOM 0 HB3 LYS A 46 -12.799 6.670 -6.013 1.00 0.77 H new ATOM 0 HG2 LYS A 46 -12.854 8.686 -7.269 1.00 1.12 H new ATOM 0 HG3 LYS A 46 -13.294 9.140 -5.635 1.00 1.12 H new ATOM 0 HD2 LYS A 46 -10.881 9.798 -5.233 1.00 1.59 H new ATOM 0 HD3 LYS A 46 -10.554 9.474 -6.924 1.00 1.59 H new ATOM 0 HE2 LYS A 46 -12.459 11.117 -7.468 1.00 2.01 H new ATOM 0 HE3 LYS A 46 -12.435 11.565 -5.775 1.00 2.01 H new ATOM 0 HZ1 LYS A 46 -11.083 13.054 -7.095 1.00 2.43 H new ATOM 0 HZ2 LYS A 46 -10.104 12.197 -6.004 1.00 2.43 H new ATOM 0 HZ3 LYS A 46 -10.128 11.762 -7.646 1.00 2.43 H new ATOM 575 N CYS A 47 -12.986 7.319 -2.142 1.00 0.61 N ATOM 576 CA CYS A 47 -14.158 7.347 -1.288 1.00 0.63 C ATOM 577 C CYS A 47 -13.772 7.552 0.173 1.00 0.75 C ATOM 578 O CYS A 47 -12.728 7.074 0.624 1.00 0.96 O ATOM 579 CB CYS A 47 -14.932 6.040 -1.450 1.00 0.70 C ATOM 580 SG CYS A 47 -13.856 4.581 -1.652 1.00 0.99 S ATOM 0 H CYS A 47 -12.107 7.166 -1.648 1.00 0.61 H new ATOM 0 HA CYS A 47 -14.786 8.186 -1.586 1.00 0.63 H new ATOM 0 HB2 CYS A 47 -15.570 5.894 -0.578 1.00 0.70 H new ATOM 0 HB3 CYS A 47 -15.589 6.120 -2.316 1.00 0.70 H new ATOM 585 N GLY A 48 -14.602 8.299 0.891 1.00 0.82 N ATOM 586 CA GLY A 48 -14.440 8.428 2.326 1.00 1.09 C ATOM 587 C GLY A 48 -13.398 9.452 2.720 1.00 0.83 C ATOM 588 O GLY A 48 -13.114 10.387 1.967 1.00 0.95 O ATOM 0 H GLY A 48 -15.388 8.820 0.502 1.00 0.82 H new ATOM 0 HA2 GLY A 48 -15.397 8.704 2.769 1.00 1.09 H new ATOM 0 HA3 GLY A 48 -14.163 7.459 2.742 1.00 1.09 H new ATOM 592 N TYR A 49 -12.842 9.287 3.908 1.00 0.84 N ATOM 593 CA TYR A 49 -11.825 10.196 4.410 1.00 0.81 C ATOM 594 C TYR A 49 -10.433 9.654 4.122 1.00 0.74 C ATOM 595 O TYR A 49 -10.216 8.448 4.094 1.00 1.08 O ATOM 596 CB TYR A 49 -12.009 10.431 5.906 1.00 1.17 C ATOM 597 CG TYR A 49 -13.105 11.421 6.204 1.00 1.46 C ATOM 598 CD1 TYR A 49 -14.423 11.004 6.322 1.00 1.79 C ATOM 599 CD2 TYR A 49 -12.821 12.766 6.390 1.00 2.18 C ATOM 600 CE1 TYR A 49 -15.429 11.899 6.618 1.00 2.24 C ATOM 601 CE2 TYR A 49 -13.821 13.669 6.682 1.00 2.70 C ATOM 602 CZ TYR A 49 -15.121 13.259 6.706 1.00 2.55 C ATOM 603 OH TYR A 49 -16.120 14.120 7.100 1.00 3.16 O ATOM 0 H TYR A 49 -13.079 8.528 4.546 1.00 0.84 H new ATOM 0 HA TYR A 49 -11.934 11.151 3.896 1.00 0.81 H new ATOM 0 HB2 TYR A 49 -12.237 9.483 6.394 1.00 1.17 H new ATOM 0 HB3 TYR A 49 -11.073 10.791 6.332 1.00 1.17 H new ATOM 0 HD1 TYR A 49 -14.665 9.961 6.180 1.00 1.79 H new ATOM 0 HD2 TYR A 49 -11.801 13.111 6.305 1.00 2.18 H new ATOM 0 HE1 TYR A 49 -16.440 11.554 6.779 1.00 2.24 H new ATOM 0 HE2 TYR A 49 -13.575 14.700 6.891 1.00 2.70 H new ATOM 0 HH TYR A 49 -15.773 15.036 7.121 1.00 3.16 H new ATOM 613 N THR A 50 -9.498 10.557 3.894 1.00 0.66 N ATOM 614 CA THR A 50 -8.157 10.181 3.494 1.00 0.68 C ATOM 615 C THR A 50 -7.244 9.941 4.692 1.00 0.89 C ATOM 616 O THR A 50 -6.274 9.185 4.596 1.00 1.94 O ATOM 617 CB THR A 50 -7.561 11.276 2.591 1.00 0.71 C ATOM 618 OG1 THR A 50 -7.893 12.567 3.130 1.00 1.00 O ATOM 619 CG2 THR A 50 -8.097 11.165 1.172 1.00 0.83 C ATOM 0 H THR A 50 -9.645 11.563 3.980 1.00 0.66 H new ATOM 0 HA THR A 50 -8.227 9.242 2.946 1.00 0.68 H new ATOM 0 HB THR A 50 -6.479 11.149 2.559 1.00 0.71 H new ATOM 0 HG1 THR A 50 -7.514 13.267 2.559 1.00 1.00 H new ATOM 0 HG21 THR A 50 -7.660 11.950 0.555 1.00 0.83 H new ATOM 0 HG22 THR A 50 -7.834 10.191 0.759 1.00 0.83 H new ATOM 0 HG23 THR A 50 -9.181 11.274 1.183 1.00 0.83 H new ATOM 627 N LYS A 51 -7.553 10.606 5.810 1.00 0.51 N ATOM 628 CA LYS A 51 -6.794 10.479 7.062 1.00 0.44 C ATOM 629 C LYS A 51 -5.370 11.024 6.929 1.00 0.45 C ATOM 630 O LYS A 51 -4.638 11.095 7.914 1.00 0.59 O ATOM 631 CB LYS A 51 -6.774 9.026 7.554 1.00 0.55 C ATOM 632 CG LYS A 51 -8.161 8.462 7.839 1.00 1.23 C ATOM 633 CD LYS A 51 -8.101 7.038 8.374 1.00 1.45 C ATOM 634 CE LYS A 51 -7.541 6.981 9.789 1.00 1.44 C ATOM 635 NZ LYS A 51 -8.434 7.654 10.771 1.00 2.03 N ATOM 0 H LYS A 51 -8.340 11.251 5.874 1.00 0.51 H new ATOM 0 HA LYS A 51 -7.308 11.087 7.807 1.00 0.44 H new ATOM 0 HB2 LYS A 51 -6.284 8.404 6.805 1.00 0.55 H new ATOM 0 HB3 LYS A 51 -6.173 8.966 8.461 1.00 0.55 H new ATOM 0 HG2 LYS A 51 -8.670 9.099 8.562 1.00 1.23 H new ATOM 0 HG3 LYS A 51 -8.754 8.481 6.925 1.00 1.23 H new ATOM 0 HD2 LYS A 51 -9.101 6.604 8.363 1.00 1.45 H new ATOM 0 HD3 LYS A 51 -7.482 6.429 7.715 1.00 1.45 H new ATOM 0 HE2 LYS A 51 -7.400 5.940 10.081 1.00 1.44 H new ATOM 0 HE3 LYS A 51 -6.559 7.453 9.809 1.00 1.44 H new ATOM 0 HZ1 LYS A 51 -8.158 7.380 11.736 1.00 2.03 H new ATOM 0 HZ2 LYS A 51 -8.350 8.685 10.667 1.00 2.03 H new ATOM 0 HZ3 LYS A 51 -9.419 7.367 10.598 1.00 2.03 H new ATOM 649 N GLY A 52 -5.002 11.442 5.720 1.00 0.43 N ATOM 650 CA GLY A 52 -3.660 11.938 5.474 1.00 0.47 C ATOM 651 C GLY A 52 -2.847 11.000 4.601 1.00 0.39 C ATOM 652 O GLY A 52 -1.702 11.291 4.263 1.00 0.45 O ATOM 0 H GLY A 52 -5.613 11.445 4.904 1.00 0.43 H new ATOM 0 HA2 GLY A 52 -3.719 12.916 4.995 1.00 0.47 H new ATOM 0 HA3 GLY A 52 -3.148 12.079 6.426 1.00 0.47 H new ATOM 656 N GLY A 53 -3.458 9.890 4.196 1.00 0.34 N ATOM 657 CA GLY A 53 -2.748 8.864 3.459 1.00 0.30 C ATOM 658 C GLY A 53 -2.368 9.316 2.070 1.00 0.27 C ATOM 659 O GLY A 53 -1.314 8.957 1.560 1.00 0.26 O ATOM 0 H GLY A 53 -4.442 9.684 4.368 1.00 0.34 H new ATOM 0 HA2 GLY A 53 -1.848 8.583 4.006 1.00 0.30 H new ATOM 0 HA3 GLY A 53 -3.371 7.972 3.391 1.00 0.30 H new ATOM 663 N TYR A 54 -3.227 10.118 1.467 1.00 0.30 N ATOM 664 CA TYR A 54 -3.025 10.564 0.108 1.00 0.29 C ATOM 665 C TYR A 54 -1.904 11.595 0.053 1.00 0.26 C ATOM 666 O TYR A 54 -0.997 11.493 -0.770 1.00 0.25 O ATOM 667 CB TYR A 54 -4.333 11.151 -0.423 1.00 0.32 C ATOM 668 CG TYR A 54 -4.367 11.348 -1.916 1.00 0.32 C ATOM 669 CD1 TYR A 54 -3.262 11.037 -2.687 1.00 0.32 C ATOM 670 CD2 TYR A 54 -5.498 11.836 -2.549 1.00 0.49 C ATOM 671 CE1 TYR A 54 -3.282 11.202 -4.056 1.00 0.33 C ATOM 672 CE2 TYR A 54 -5.539 11.992 -3.919 1.00 0.57 C ATOM 673 CZ TYR A 54 -4.437 11.750 -4.658 1.00 0.43 C ATOM 674 OH TYR A 54 -4.458 11.791 -6.035 1.00 0.52 O ATOM 0 H TYR A 54 -4.077 10.474 1.905 1.00 0.30 H new ATOM 0 HA TYR A 54 -2.733 9.720 -0.518 1.00 0.29 H new ATOM 0 HB2 TYR A 54 -5.154 10.494 -0.137 1.00 0.32 H new ATOM 0 HB3 TYR A 54 -4.509 12.111 0.062 1.00 0.32 H new ATOM 0 HD1 TYR A 54 -2.370 10.659 -2.210 1.00 0.32 H new ATOM 0 HD2 TYR A 54 -6.364 12.099 -1.959 1.00 0.49 H new ATOM 0 HE1 TYR A 54 -2.431 10.918 -4.657 1.00 0.33 H new ATOM 0 HE2 TYR A 54 -6.453 12.308 -4.400 1.00 0.57 H new ATOM 0 HH TYR A 54 -5.060 11.096 -6.374 1.00 0.52 H new ATOM 684 N GLU A 55 -1.958 12.570 0.948 1.00 0.26 N ATOM 685 CA GLU A 55 -0.958 13.629 0.978 1.00 0.26 C ATOM 686 C GLU A 55 0.405 13.036 1.276 1.00 0.22 C ATOM 687 O GLU A 55 1.406 13.410 0.665 1.00 0.24 O ATOM 688 CB GLU A 55 -1.299 14.678 2.036 1.00 0.33 C ATOM 689 CG GLU A 55 -2.745 15.124 1.998 1.00 1.15 C ATOM 690 CD GLU A 55 -3.172 15.651 0.644 1.00 1.78 C ATOM 691 OE1 GLU A 55 -2.605 16.670 0.194 1.00 2.46 O ATOM 692 OE2 GLU A 55 -4.067 15.043 0.022 1.00 2.23 O ATOM 0 H GLU A 55 -2.682 12.651 1.662 1.00 0.26 H new ATOM 0 HA GLU A 55 -0.946 14.114 0.002 1.00 0.26 H new ATOM 0 HB2 GLU A 55 -1.078 14.272 3.023 1.00 0.33 H new ATOM 0 HB3 GLU A 55 -0.655 15.546 1.896 1.00 0.33 H new ATOM 0 HG2 GLU A 55 -3.384 14.285 2.272 1.00 1.15 H new ATOM 0 HG3 GLU A 55 -2.899 15.900 2.748 1.00 1.15 H new ATOM 699 N THR A 56 0.425 12.100 2.210 1.00 0.21 N ATOM 700 CA THR A 56 1.639 11.416 2.578 1.00 0.21 C ATOM 701 C THR A 56 2.177 10.601 1.400 1.00 0.19 C ATOM 702 O THR A 56 3.350 10.710 1.048 1.00 0.21 O ATOM 703 CB THR A 56 1.397 10.505 3.799 1.00 0.26 C ATOM 704 OG1 THR A 56 0.980 11.295 4.922 1.00 0.33 O ATOM 705 CG2 THR A 56 2.645 9.731 4.168 1.00 0.27 C ATOM 0 H THR A 56 -0.400 11.799 2.729 1.00 0.21 H new ATOM 0 HA THR A 56 2.385 12.163 2.847 1.00 0.21 H new ATOM 0 HB THR A 56 0.616 9.792 3.534 1.00 0.26 H new ATOM 0 HG1 THR A 56 0.008 11.413 4.896 1.00 0.33 H new ATOM 0 HG21 THR A 56 2.439 9.099 5.032 1.00 0.27 H new ATOM 0 HG22 THR A 56 2.949 9.108 3.327 1.00 0.27 H new ATOM 0 HG23 THR A 56 3.447 10.428 4.411 1.00 0.27 H new ATOM 713 N ALA A 57 1.299 9.827 0.767 1.00 0.18 N ATOM 714 CA ALA A 57 1.687 8.973 -0.349 1.00 0.17 C ATOM 715 C ALA A 57 2.208 9.789 -1.525 1.00 0.17 C ATOM 716 O ALA A 57 3.283 9.508 -2.058 1.00 0.18 O ATOM 717 CB ALA A 57 0.504 8.128 -0.784 1.00 0.19 C ATOM 0 H ALA A 57 0.310 9.775 1.011 1.00 0.18 H new ATOM 0 HA ALA A 57 2.496 8.324 -0.012 1.00 0.17 H new ATOM 0 HB1 ALA A 57 0.799 7.491 -1.618 1.00 0.19 H new ATOM 0 HB2 ALA A 57 0.175 7.506 0.049 1.00 0.19 H new ATOM 0 HB3 ALA A 57 -0.313 8.779 -1.095 1.00 0.19 H new ATOM 723 N THR A 58 1.438 10.798 -1.924 1.00 0.18 N ATOM 724 CA THR A 58 1.841 11.699 -2.986 1.00 0.20 C ATOM 725 C THR A 58 3.208 12.323 -2.690 1.00 0.19 C ATOM 726 O THR A 58 4.105 12.309 -3.535 1.00 0.21 O ATOM 727 CB THR A 58 0.795 12.817 -3.178 1.00 0.23 C ATOM 728 OG1 THR A 58 -0.461 12.244 -3.543 1.00 0.27 O ATOM 729 CG2 THR A 58 1.231 13.810 -4.246 1.00 0.30 C ATOM 0 H THR A 58 0.525 11.008 -1.520 1.00 0.18 H new ATOM 0 HA THR A 58 1.913 11.115 -3.903 1.00 0.20 H new ATOM 0 HB THR A 58 0.699 13.354 -2.234 1.00 0.23 H new ATOM 0 HG1 THR A 58 -0.921 11.925 -2.739 1.00 0.27 H new ATOM 0 HG21 THR A 58 0.471 14.584 -4.355 1.00 0.30 H new ATOM 0 HG22 THR A 58 2.176 14.268 -3.953 1.00 0.30 H new ATOM 0 HG23 THR A 58 1.359 13.290 -5.196 1.00 0.30 H new ATOM 737 N THR A 59 3.365 12.845 -1.477 1.00 0.18 N ATOM 738 CA THR A 59 4.605 13.496 -1.085 1.00 0.19 C ATOM 739 C THR A 59 5.773 12.512 -1.084 1.00 0.18 C ATOM 740 O THR A 59 6.831 12.816 -1.610 1.00 0.22 O ATOM 741 CB THR A 59 4.482 14.158 0.303 1.00 0.23 C ATOM 742 OG1 THR A 59 3.393 15.092 0.300 1.00 0.97 O ATOM 743 CG2 THR A 59 5.767 14.881 0.681 1.00 1.08 C ATOM 0 H THR A 59 2.648 12.829 -0.751 1.00 0.18 H new ATOM 0 HA THR A 59 4.801 14.273 -1.824 1.00 0.19 H new ATOM 0 HB THR A 59 4.297 13.374 1.038 1.00 0.23 H new ATOM 0 HG1 THR A 59 2.576 14.642 0.600 1.00 0.97 H new ATOM 0 HG21 THR A 59 5.652 15.338 1.664 1.00 1.08 H new ATOM 0 HG22 THR A 59 6.591 14.168 0.707 1.00 1.08 H new ATOM 0 HG23 THR A 59 5.979 15.655 -0.056 1.00 1.08 H new ATOM 751 N LEU A 60 5.569 11.331 -0.512 1.00 0.16 N ATOM 752 CA LEU A 60 6.616 10.312 -0.445 1.00 0.15 C ATOM 753 C LEU A 60 7.083 9.892 -1.824 1.00 0.14 C ATOM 754 O LEU A 60 8.284 9.889 -2.104 1.00 0.16 O ATOM 755 CB LEU A 60 6.113 9.087 0.293 1.00 0.15 C ATOM 756 CG LEU A 60 5.999 9.246 1.791 1.00 0.18 C ATOM 757 CD1 LEU A 60 5.296 8.039 2.355 1.00 0.81 C ATOM 758 CD2 LEU A 60 7.385 9.402 2.394 1.00 0.70 C ATOM 0 H LEU A 60 4.685 11.052 -0.086 1.00 0.16 H new ATOM 0 HA LEU A 60 7.457 10.754 0.089 1.00 0.15 H new ATOM 0 HB2 LEU A 60 5.134 8.819 -0.104 1.00 0.15 H new ATOM 0 HB3 LEU A 60 6.783 8.253 0.081 1.00 0.15 H new ATOM 0 HG LEU A 60 5.421 10.137 2.035 1.00 0.18 H new ATOM 0 HD11 LEU A 60 5.207 8.142 3.437 1.00 0.81 H new ATOM 0 HD12 LEU A 60 4.302 7.959 1.916 1.00 0.81 H new ATOM 0 HD13 LEU A 60 5.869 7.142 2.122 1.00 0.81 H new ATOM 0 HD21 LEU A 60 7.301 9.517 3.475 1.00 0.70 H new ATOM 0 HD22 LEU A 60 7.982 8.518 2.168 1.00 0.70 H new ATOM 0 HD23 LEU A 60 7.868 10.283 1.972 1.00 0.70 H new ATOM 770 N TYR A 61 6.127 9.525 -2.671 1.00 0.14 N ATOM 771 CA TYR A 61 6.423 9.123 -4.034 1.00 0.16 C ATOM 772 C TYR A 61 7.273 10.190 -4.702 1.00 0.18 C ATOM 773 O TYR A 61 8.318 9.903 -5.262 1.00 0.22 O ATOM 774 CB TYR A 61 5.117 8.899 -4.796 1.00 0.21 C ATOM 775 CG TYR A 61 5.292 8.355 -6.195 1.00 0.20 C ATOM 776 CD1 TYR A 61 5.804 7.083 -6.407 1.00 0.23 C ATOM 777 CD2 TYR A 61 4.970 9.125 -7.305 1.00 0.26 C ATOM 778 CE1 TYR A 61 5.992 6.594 -7.685 1.00 0.24 C ATOM 779 CE2 TYR A 61 5.150 8.643 -8.587 1.00 0.30 C ATOM 780 CZ TYR A 61 5.562 7.331 -8.767 1.00 0.27 C ATOM 781 OH TYR A 61 5.851 6.888 -10.045 1.00 0.33 O ATOM 0 H TYR A 61 5.136 9.499 -2.432 1.00 0.14 H new ATOM 0 HA TYR A 61 6.983 8.188 -4.035 1.00 0.16 H new ATOM 0 HB2 TYR A 61 4.493 8.209 -4.227 1.00 0.21 H new ATOM 0 HB3 TYR A 61 4.577 9.844 -4.852 1.00 0.21 H new ATOM 0 HD1 TYR A 61 6.060 6.465 -5.559 1.00 0.23 H new ATOM 0 HD2 TYR A 61 4.572 10.119 -7.163 1.00 0.26 H new ATOM 0 HE1 TYR A 61 6.473 5.639 -7.835 1.00 0.24 H new ATOM 0 HE2 TYR A 61 4.972 9.281 -9.440 1.00 0.30 H new ATOM 0 HH TYR A 61 5.480 7.515 -10.700 1.00 0.33 H new ATOM 791 N ASN A 62 6.871 11.433 -4.548 1.00 0.22 N ATOM 792 CA ASN A 62 7.551 12.531 -5.231 1.00 0.29 C ATOM 793 C ASN A 62 8.905 12.817 -4.595 1.00 0.28 C ATOM 794 O ASN A 62 9.885 13.109 -5.282 1.00 0.36 O ATOM 795 CB ASN A 62 6.695 13.799 -5.217 1.00 0.38 C ATOM 796 CG ASN A 62 5.577 13.765 -6.240 1.00 1.04 C ATOM 797 OD1 ASN A 62 5.710 13.156 -7.302 1.00 1.76 O ATOM 798 ND2 ASN A 62 4.473 14.428 -5.932 1.00 1.29 N ATOM 0 H ASN A 62 6.085 11.715 -3.963 1.00 0.22 H new ATOM 0 HA ASN A 62 7.708 12.225 -6.265 1.00 0.29 H new ATOM 0 HB2 ASN A 62 6.268 13.932 -4.223 1.00 0.38 H new ATOM 0 HB3 ASN A 62 7.331 14.663 -5.409 1.00 0.38 H new ATOM 0 HD21 ASN A 62 3.691 14.447 -6.586 1.00 1.29 H new ATOM 0 HD22 ASN A 62 4.405 14.919 -5.041 1.00 1.29 H new ATOM 805 N LYS A 63 8.949 12.696 -3.283 1.00 0.24 N ATOM 806 CA LYS A 63 10.115 13.066 -2.497 1.00 0.28 C ATOM 807 C LYS A 63 11.251 12.058 -2.661 1.00 0.27 C ATOM 808 O LYS A 63 12.422 12.433 -2.619 1.00 0.42 O ATOM 809 CB LYS A 63 9.707 13.176 -1.022 1.00 0.33 C ATOM 810 CG LYS A 63 10.784 13.712 -0.090 1.00 0.43 C ATOM 811 CD LYS A 63 10.283 13.729 1.348 1.00 0.98 C ATOM 812 CE LYS A 63 11.385 14.071 2.338 1.00 1.16 C ATOM 813 NZ LYS A 63 11.716 15.516 2.355 1.00 1.79 N ATOM 0 H LYS A 63 8.173 12.336 -2.727 1.00 0.24 H new ATOM 0 HA LYS A 63 10.485 14.027 -2.854 1.00 0.28 H new ATOM 0 HB2 LYS A 63 8.833 13.823 -0.951 1.00 0.33 H new ATOM 0 HB3 LYS A 63 9.403 12.190 -0.671 1.00 0.33 H new ATOM 0 HG2 LYS A 63 11.678 13.092 -0.163 1.00 0.43 H new ATOM 0 HG3 LYS A 63 11.069 14.719 -0.394 1.00 0.43 H new ATOM 0 HD2 LYS A 63 9.476 14.456 1.441 1.00 0.98 H new ATOM 0 HD3 LYS A 63 9.864 12.754 1.596 1.00 0.98 H new ATOM 0 HE2 LYS A 63 11.078 13.762 3.337 1.00 1.16 H new ATOM 0 HE3 LYS A 63 12.280 13.501 2.089 1.00 1.16 H new ATOM 0 HZ1 LYS A 63 12.472 15.691 3.047 1.00 1.79 H new ATOM 0 HZ2 LYS A 63 12.036 15.810 1.410 1.00 1.79 H new ATOM 0 HZ3 LYS A 63 10.872 16.062 2.620 1.00 1.79 H new ATOM 827 N TYR A 64 10.924 10.780 -2.842 1.00 0.18 N ATOM 828 CA TYR A 64 11.971 9.769 -2.909 1.00 0.19 C ATOM 829 C TYR A 64 11.985 8.958 -4.202 1.00 0.22 C ATOM 830 O TYR A 64 12.666 7.934 -4.267 1.00 0.28 O ATOM 831 CB TYR A 64 11.927 8.840 -1.695 1.00 0.21 C ATOM 832 CG TYR A 64 12.437 9.500 -0.442 1.00 0.24 C ATOM 833 CD1 TYR A 64 13.782 9.447 -0.110 1.00 0.30 C ATOM 834 CD2 TYR A 64 11.570 10.157 0.424 1.00 0.27 C ATOM 835 CE1 TYR A 64 14.251 10.036 1.046 1.00 0.35 C ATOM 836 CE2 TYR A 64 12.031 10.740 1.582 1.00 0.33 C ATOM 837 CZ TYR A 64 13.384 10.753 1.846 1.00 0.34 C ATOM 838 OH TYR A 64 13.834 11.251 3.053 1.00 0.43 O ATOM 0 H TYR A 64 9.971 10.429 -2.942 1.00 0.18 H new ATOM 0 HA TYR A 64 12.905 10.332 -2.900 1.00 0.19 H new ATOM 0 HB2 TYR A 64 10.902 8.507 -1.534 1.00 0.21 H new ATOM 0 HB3 TYR A 64 12.523 7.951 -1.901 1.00 0.21 H new ATOM 0 HD1 TYR A 64 14.472 8.937 -0.766 1.00 0.30 H new ATOM 0 HD2 TYR A 64 10.518 10.211 0.184 1.00 0.27 H new ATOM 0 HE1 TYR A 64 15.290 9.937 1.323 1.00 0.35 H new ATOM 0 HE2 TYR A 64 11.337 11.185 2.280 1.00 0.33 H new ATOM 0 HH TYR A 64 13.187 11.899 3.401 1.00 0.43 H new ATOM 848 N LYS A 65 11.277 9.399 -5.243 1.00 0.22 N ATOM 849 CA LYS A 65 11.409 8.741 -6.550 1.00 0.29 C ATOM 850 C LYS A 65 12.860 8.767 -7.013 1.00 0.32 C ATOM 851 O LYS A 65 13.297 7.899 -7.767 1.00 0.39 O ATOM 852 CB LYS A 65 10.543 9.393 -7.629 1.00 0.36 C ATOM 853 CG LYS A 65 9.117 8.892 -7.688 1.00 0.38 C ATOM 854 CD LYS A 65 8.520 9.071 -9.079 1.00 0.92 C ATOM 855 CE LYS A 65 8.660 10.500 -9.586 1.00 1.37 C ATOM 856 NZ LYS A 65 7.845 11.463 -8.800 1.00 2.11 N ATOM 0 H LYS A 65 10.625 10.183 -5.215 1.00 0.22 H new ATOM 0 HA LYS A 65 11.068 7.715 -6.412 1.00 0.29 H new ATOM 0 HB2 LYS A 65 10.528 10.470 -7.461 1.00 0.36 H new ATOM 0 HB3 LYS A 65 11.011 9.228 -8.599 1.00 0.36 H new ATOM 0 HG2 LYS A 65 9.089 7.838 -7.411 1.00 0.38 H new ATOM 0 HG3 LYS A 65 8.511 9.429 -6.959 1.00 0.38 H new ATOM 0 HD2 LYS A 65 9.012 8.391 -9.774 1.00 0.92 H new ATOM 0 HD3 LYS A 65 7.465 8.797 -9.058 1.00 0.92 H new ATOM 0 HE2 LYS A 65 9.708 10.796 -9.544 1.00 1.37 H new ATOM 0 HE3 LYS A 65 8.358 10.542 -10.633 1.00 1.37 H new ATOM 0 HZ1 LYS A 65 7.244 12.016 -9.444 1.00 2.11 H new ATOM 0 HZ2 LYS A 65 7.246 10.943 -8.128 1.00 2.11 H new ATOM 0 HZ3 LYS A 65 8.474 12.105 -8.278 1.00 2.11 H new ATOM 870 N SER A 66 13.601 9.762 -6.538 1.00 0.33 N ATOM 871 CA SER A 66 15.002 9.925 -6.889 1.00 0.43 C ATOM 872 C SER A 66 15.821 8.683 -6.538 1.00 0.50 C ATOM 873 O SER A 66 16.677 8.265 -7.315 1.00 0.61 O ATOM 874 CB SER A 66 15.569 11.147 -6.174 1.00 0.52 C ATOM 875 OG SER A 66 14.722 12.271 -6.351 1.00 1.20 O ATOM 0 H SER A 66 13.246 10.475 -5.901 1.00 0.33 H new ATOM 0 HA SER A 66 15.067 10.067 -7.968 1.00 0.43 H new ATOM 0 HB2 SER A 66 15.680 10.933 -5.111 1.00 0.52 H new ATOM 0 HB3 SER A 66 16.564 11.371 -6.560 1.00 0.52 H new ATOM 0 HG SER A 66 15.102 13.044 -5.884 1.00 1.20 H new ATOM 881 N GLN A 67 15.558 8.084 -5.375 1.00 0.49 N ATOM 882 CA GLN A 67 16.277 6.873 -4.983 1.00 0.61 C ATOM 883 C GLN A 67 15.524 5.616 -5.433 1.00 0.63 C ATOM 884 O GLN A 67 16.015 4.499 -5.279 1.00 0.80 O ATOM 885 CB GLN A 67 16.572 6.853 -3.474 1.00 0.75 C ATOM 886 CG GLN A 67 15.373 7.061 -2.589 1.00 0.97 C ATOM 887 CD GLN A 67 14.564 5.809 -2.421 1.00 1.23 C ATOM 888 OE1 GLN A 67 15.089 4.696 -2.444 1.00 1.90 O ATOM 889 NE2 GLN A 67 13.282 5.986 -2.261 1.00 1.36 N ATOM 0 H GLN A 67 14.866 8.410 -4.700 1.00 0.49 H new ATOM 0 HA GLN A 67 17.240 6.879 -5.494 1.00 0.61 H new ATOM 0 HB2 GLN A 67 17.030 5.897 -3.221 1.00 0.75 H new ATOM 0 HB3 GLN A 67 17.307 7.627 -3.252 1.00 0.75 H new ATOM 0 HG2 GLN A 67 15.703 7.412 -1.611 1.00 0.97 H new ATOM 0 HG3 GLN A 67 14.743 7.844 -3.012 1.00 0.97 H new ATOM 0 HE21 GLN A 67 12.895 6.930 -2.249 1.00 1.36 H new ATOM 0 HE22 GLN A 67 12.666 5.181 -2.148 1.00 1.36 H new ATOM 898 N GLY A 68 14.336 5.811 -6.005 1.00 0.54 N ATOM 899 CA GLY A 68 13.594 4.699 -6.581 1.00 0.63 C ATOM 900 C GLY A 68 12.327 4.338 -5.820 1.00 0.72 C ATOM 901 O GLY A 68 11.806 3.230 -5.975 1.00 1.32 O ATOM 0 H GLY A 68 13.875 6.718 -6.080 1.00 0.54 H new ATOM 0 HA2 GLY A 68 13.330 4.946 -7.609 1.00 0.63 H new ATOM 0 HA3 GLY A 68 14.243 3.824 -6.620 1.00 0.63 H new ATOM 905 N PHE A 69 11.821 5.265 -5.017 1.00 0.26 N ATOM 906 CA PHE A 69 10.634 5.021 -4.208 1.00 0.24 C ATOM 907 C PHE A 69 9.370 5.097 -5.046 1.00 0.23 C ATOM 908 O PHE A 69 9.221 5.988 -5.882 1.00 0.26 O ATOM 909 CB PHE A 69 10.552 6.060 -3.098 1.00 0.22 C ATOM 910 CG PHE A 69 9.443 5.849 -2.120 1.00 0.19 C ATOM 911 CD1 PHE A 69 9.565 4.919 -1.104 1.00 0.18 C ATOM 912 CD2 PHE A 69 8.283 6.591 -2.209 1.00 0.24 C ATOM 913 CE1 PHE A 69 8.546 4.736 -0.197 1.00 0.19 C ATOM 914 CE2 PHE A 69 7.264 6.412 -1.304 1.00 0.24 C ATOM 915 CZ PHE A 69 7.393 5.484 -0.297 1.00 0.19 C ATOM 0 H PHE A 69 12.217 6.199 -4.908 1.00 0.26 H new ATOM 0 HA PHE A 69 10.714 4.019 -3.787 1.00 0.24 H new ATOM 0 HB2 PHE A 69 11.498 6.067 -2.557 1.00 0.22 H new ATOM 0 HB3 PHE A 69 10.436 7.045 -3.550 1.00 0.22 H new ATOM 0 HD1 PHE A 69 10.467 4.331 -1.021 1.00 0.18 H new ATOM 0 HD2 PHE A 69 8.175 7.320 -2.998 1.00 0.24 H new ATOM 0 HE1 PHE A 69 8.650 4.007 0.593 1.00 0.19 H new ATOM 0 HE2 PHE A 69 6.362 7.000 -1.384 1.00 0.24 H new ATOM 0 HZ PHE A 69 6.592 5.342 0.414 1.00 0.19 H new ATOM 925 N THR A 70 8.464 4.167 -4.815 1.00 0.22 N ATOM 926 CA THR A 70 7.169 4.208 -5.431 1.00 0.22 C ATOM 927 C THR A 70 6.109 3.976 -4.363 1.00 0.21 C ATOM 928 O THR A 70 6.325 3.229 -3.416 1.00 0.25 O ATOM 929 CB THR A 70 7.045 3.151 -6.556 1.00 0.27 C ATOM 930 OG1 THR A 70 6.005 3.511 -7.476 1.00 0.51 O ATOM 931 CG2 THR A 70 6.744 1.778 -5.997 1.00 0.33 C ATOM 0 H THR A 70 8.612 3.369 -4.197 1.00 0.22 H new ATOM 0 HA THR A 70 7.026 5.187 -5.889 1.00 0.22 H new ATOM 0 HB THR A 70 8.004 3.122 -7.073 1.00 0.27 H new ATOM 0 HG1 THR A 70 5.714 4.430 -7.298 1.00 0.51 H new ATOM 0 HG21 THR A 70 6.664 1.062 -6.815 1.00 0.33 H new ATOM 0 HG22 THR A 70 7.547 1.474 -5.326 1.00 0.33 H new ATOM 0 HG23 THR A 70 5.803 1.807 -5.447 1.00 0.33 H new ATOM 939 N VAL A 71 5.004 4.666 -4.473 1.00 0.20 N ATOM 940 CA VAL A 71 3.852 4.370 -3.652 1.00 0.19 C ATOM 941 C VAL A 71 2.811 3.672 -4.500 1.00 0.18 C ATOM 942 O VAL A 71 2.184 4.282 -5.355 1.00 0.24 O ATOM 943 CB VAL A 71 3.249 5.641 -3.034 1.00 0.22 C ATOM 944 CG1 VAL A 71 1.862 5.370 -2.446 1.00 0.23 C ATOM 945 CG2 VAL A 71 4.163 6.204 -1.963 1.00 0.24 C ATOM 0 H VAL A 71 4.874 5.440 -5.124 1.00 0.20 H new ATOM 0 HA VAL A 71 4.172 3.726 -2.833 1.00 0.19 H new ATOM 0 HB VAL A 71 3.146 6.376 -3.833 1.00 0.22 H new ATOM 0 HG11 VAL A 71 1.463 6.289 -2.017 1.00 0.23 H new ATOM 0 HG12 VAL A 71 1.195 5.018 -3.233 1.00 0.23 H new ATOM 0 HG13 VAL A 71 1.939 4.610 -1.669 1.00 0.23 H new ATOM 0 HG21 VAL A 71 3.716 7.103 -1.539 1.00 0.24 H new ATOM 0 HG22 VAL A 71 4.302 5.462 -1.176 1.00 0.24 H new ATOM 0 HG23 VAL A 71 5.129 6.451 -2.403 1.00 0.24 H new ATOM 955 N LEU A 72 2.668 2.386 -4.299 1.00 0.16 N ATOM 956 CA LEU A 72 1.662 1.635 -5.005 1.00 0.17 C ATOM 957 C LEU A 72 0.391 1.668 -4.190 1.00 0.18 C ATOM 958 O LEU A 72 0.379 1.237 -3.046 1.00 0.32 O ATOM 959 CB LEU A 72 2.120 0.192 -5.207 1.00 0.20 C ATOM 960 CG LEU A 72 3.548 0.038 -5.729 1.00 0.20 C ATOM 961 CD1 LEU A 72 3.899 -1.434 -5.878 1.00 0.48 C ATOM 962 CD2 LEU A 72 3.701 0.756 -7.059 1.00 0.51 C ATOM 0 H LEU A 72 3.235 1.838 -3.652 1.00 0.16 H new ATOM 0 HA LEU A 72 1.490 2.075 -5.988 1.00 0.17 H new ATOM 0 HB2 LEU A 72 2.037 -0.337 -4.257 1.00 0.20 H new ATOM 0 HB3 LEU A 72 1.439 -0.296 -5.904 1.00 0.20 H new ATOM 0 HG LEU A 72 4.234 0.487 -5.010 1.00 0.20 H new ATOM 0 HD11 LEU A 72 4.919 -1.529 -6.251 1.00 0.48 H new ATOM 0 HD12 LEU A 72 3.819 -1.927 -4.909 1.00 0.48 H new ATOM 0 HD13 LEU A 72 3.211 -1.903 -6.581 1.00 0.48 H new ATOM 0 HD21 LEU A 72 4.723 0.639 -7.420 1.00 0.51 H new ATOM 0 HD22 LEU A 72 3.008 0.329 -7.785 1.00 0.51 H new ATOM 0 HD23 LEU A 72 3.482 1.816 -6.928 1.00 0.51 H new ATOM 974 N ALA A 73 -0.674 2.177 -4.754 1.00 0.15 N ATOM 975 CA ALA A 73 -1.910 2.272 -4.013 1.00 0.16 C ATOM 976 C ALA A 73 -2.909 1.274 -4.537 1.00 0.19 C ATOM 977 O ALA A 73 -3.395 1.390 -5.653 1.00 0.28 O ATOM 978 CB ALA A 73 -2.474 3.677 -4.069 1.00 0.17 C ATOM 0 H ALA A 73 -0.714 2.528 -5.711 1.00 0.15 H new ATOM 0 HA ALA A 73 -1.701 2.041 -2.969 1.00 0.16 H new ATOM 0 HB1 ALA A 73 -3.404 3.718 -3.503 1.00 0.17 H new ATOM 0 HB2 ALA A 73 -1.756 4.375 -3.639 1.00 0.17 H new ATOM 0 HB3 ALA A 73 -2.668 3.950 -5.106 1.00 0.17 H new ATOM 984 N PHE A 74 -3.211 0.298 -3.719 1.00 0.20 N ATOM 985 CA PHE A 74 -4.165 -0.725 -4.061 1.00 0.21 C ATOM 986 C PHE A 74 -5.511 -0.337 -3.496 1.00 0.25 C ATOM 987 O PHE A 74 -5.722 -0.347 -2.285 1.00 0.29 O ATOM 988 CB PHE A 74 -3.714 -2.084 -3.509 1.00 0.23 C ATOM 989 CG PHE A 74 -2.473 -2.685 -4.144 1.00 0.22 C ATOM 990 CD1 PHE A 74 -1.381 -1.876 -4.411 1.00 0.24 C ATOM 991 CD2 PHE A 74 -2.400 -4.030 -4.504 1.00 0.32 C ATOM 992 CE1 PHE A 74 -0.251 -2.382 -5.020 1.00 0.26 C ATOM 993 CE2 PHE A 74 -1.267 -4.538 -5.108 1.00 0.34 C ATOM 994 CZ PHE A 74 -0.202 -3.857 -5.247 1.00 0.26 C ATOM 0 H PHE A 74 -2.799 0.191 -2.792 1.00 0.20 H new ATOM 0 HA PHE A 74 -4.238 -0.816 -5.145 1.00 0.21 H new ATOM 0 HB2 PHE A 74 -3.534 -1.977 -2.439 1.00 0.23 H new ATOM 0 HB3 PHE A 74 -4.535 -2.791 -3.625 1.00 0.23 H new ATOM 0 HD1 PHE A 74 -1.415 -0.832 -4.138 1.00 0.24 H new ATOM 0 HD2 PHE A 74 -3.239 -4.682 -4.308 1.00 0.32 H new ATOM 0 HE1 PHE A 74 0.563 -1.739 -5.320 1.00 0.26 H new ATOM 0 HE2 PHE A 74 -1.286 -5.553 -5.477 1.00 0.34 H new ATOM 0 HZ PHE A 74 0.724 -4.338 -5.525 1.00 0.26 H new ATOM 1004 N PRO A 75 -6.418 0.053 -4.388 1.00 0.26 N ATOM 1005 CA PRO A 75 -7.760 0.490 -4.027 1.00 0.32 C ATOM 1006 C PRO A 75 -8.522 -0.604 -3.299 1.00 0.38 C ATOM 1007 O PRO A 75 -8.095 -1.759 -3.271 1.00 0.73 O ATOM 1008 CB PRO A 75 -8.410 0.793 -5.376 1.00 0.37 C ATOM 1009 CG PRO A 75 -7.284 0.981 -6.321 1.00 0.31 C ATOM 1010 CD PRO A 75 -6.199 0.080 -5.835 1.00 0.26 C ATOM 0 HA PRO A 75 -7.754 1.344 -3.350 1.00 0.32 H new ATOM 0 HB2 PRO A 75 -9.057 -0.025 -5.693 1.00 0.37 H new ATOM 0 HB3 PRO A 75 -9.031 1.687 -5.321 1.00 0.37 H new ATOM 0 HG2 PRO A 75 -7.579 0.726 -7.339 1.00 0.31 H new ATOM 0 HG3 PRO A 75 -6.954 2.020 -6.336 1.00 0.31 H new ATOM 0 HD2 PRO A 75 -6.274 -0.915 -6.273 1.00 0.26 H new ATOM 0 HD3 PRO A 75 -5.211 0.466 -6.087 1.00 0.26 H new ATOM 1018 N SER A 76 -9.658 -0.263 -2.724 1.00 0.29 N ATOM 1019 CA SER A 76 -10.366 -1.233 -1.933 1.00 0.30 C ATOM 1020 C SER A 76 -11.709 -1.635 -2.513 1.00 0.44 C ATOM 1021 O SER A 76 -12.511 -0.814 -2.964 1.00 0.57 O ATOM 1022 CB SER A 76 -10.486 -0.751 -0.490 1.00 0.53 C ATOM 1023 OG SER A 76 -9.211 -0.480 0.060 1.00 1.54 O ATOM 0 H SER A 76 -10.097 0.655 -2.790 1.00 0.29 H new ATOM 0 HA SER A 76 -9.772 -2.147 -1.950 1.00 0.30 H new ATOM 0 HB2 SER A 76 -11.101 0.148 -0.453 1.00 0.53 H new ATOM 0 HB3 SER A 76 -10.992 -1.508 0.110 1.00 0.53 H new ATOM 0 HG SER A 76 -9.312 -0.171 0.984 1.00 1.54 H new ATOM 1298 N CYS A 95 -16.411 2.687 -4.901 1.00 0.75 N ATOM 1299 CA CYS A 95 -14.973 2.858 -4.905 1.00 0.59 C ATOM 1300 C CYS A 95 -14.318 2.149 -6.075 1.00 0.59 C ATOM 1301 O CYS A 95 -14.459 0.936 -6.240 1.00 0.91 O ATOM 1302 CB CYS A 95 -14.401 2.325 -3.601 1.00 0.59 C ATOM 1303 SG CYS A 95 -15.133 3.082 -2.135 1.00 0.88 S ATOM 0 HA CYS A 95 -14.763 3.923 -5.006 1.00 0.59 H new ATOM 0 HB2 CYS A 95 -14.555 1.247 -3.559 1.00 0.59 H new ATOM 0 HB3 CYS A 95 -13.324 2.494 -3.589 1.00 0.59 H new ATOM 1308 N THR A 96 -13.592 2.907 -6.875 1.00 0.66 N ATOM 1309 CA THR A 96 -12.764 2.336 -7.908 1.00 0.69 C ATOM 1310 C THR A 96 -11.541 3.218 -8.154 1.00 0.65 C ATOM 1311 O THR A 96 -11.674 4.395 -8.491 1.00 1.18 O ATOM 1312 CB THR A 96 -13.539 2.105 -9.231 1.00 1.20 C ATOM 1313 OG1 THR A 96 -12.657 1.570 -10.226 1.00 1.81 O ATOM 1314 CG2 THR A 96 -14.174 3.391 -9.744 1.00 1.92 C ATOM 0 H THR A 96 -13.562 3.925 -6.825 1.00 0.66 H new ATOM 0 HA THR A 96 -12.439 1.357 -7.555 1.00 0.69 H new ATOM 0 HB THR A 96 -14.340 1.394 -9.027 1.00 1.20 H new ATOM 0 HG1 THR A 96 -13.153 1.425 -11.059 1.00 1.81 H new ATOM 0 HG21 THR A 96 -14.708 3.188 -10.672 1.00 1.92 H new ATOM 0 HG22 THR A 96 -14.873 3.774 -9.000 1.00 1.92 H new ATOM 0 HG23 THR A 96 -13.397 4.133 -9.927 1.00 1.92 H new ATOM 1322 N LYS A 97 -10.361 2.620 -7.938 1.00 0.67 N ATOM 1323 CA LYS A 97 -9.050 3.241 -8.178 1.00 1.00 C ATOM 1324 C LYS A 97 -9.040 4.766 -8.038 1.00 0.96 C ATOM 1325 O LYS A 97 -9.278 5.487 -9.000 1.00 1.76 O ATOM 1326 CB LYS A 97 -8.509 2.816 -9.544 1.00 1.50 C ATOM 1327 CG LYS A 97 -9.589 2.711 -10.592 1.00 1.65 C ATOM 1328 CD LYS A 97 -9.032 2.353 -11.959 1.00 2.34 C ATOM 1329 CE LYS A 97 -10.140 1.984 -12.932 1.00 2.79 C ATOM 1330 NZ LYS A 97 -9.603 1.501 -14.232 1.00 3.18 N ATOM 0 H LYS A 97 -10.290 1.667 -7.582 1.00 0.67 H new ATOM 0 HA LYS A 97 -8.393 2.876 -7.389 1.00 1.00 H new ATOM 0 HB2 LYS A 97 -7.759 3.535 -9.873 1.00 1.50 H new ATOM 0 HB3 LYS A 97 -8.007 1.853 -9.448 1.00 1.50 H new ATOM 0 HG2 LYS A 97 -10.315 1.956 -10.289 1.00 1.65 H new ATOM 0 HG3 LYS A 97 -10.123 3.659 -10.657 1.00 1.65 H new ATOM 0 HD2 LYS A 97 -8.465 3.196 -12.354 1.00 2.34 H new ATOM 0 HD3 LYS A 97 -8.338 1.518 -11.863 1.00 2.34 H new ATOM 0 HE2 LYS A 97 -10.768 1.211 -12.490 1.00 2.79 H new ATOM 0 HE3 LYS A 97 -10.776 2.852 -13.103 1.00 2.79 H new ATOM 0 HZ1 LYS A 97 -10.390 1.212 -14.847 1.00 3.18 H new ATOM 0 HZ2 LYS A 97 -9.067 2.265 -14.691 1.00 3.18 H new ATOM 0 HZ3 LYS A 97 -8.976 0.688 -14.068 1.00 3.18 H new ATOM 1344 N PHE A 98 -8.778 5.246 -6.829 1.00 0.70 N ATOM 1345 CA PHE A 98 -8.531 6.666 -6.609 1.00 0.66 C ATOM 1346 C PHE A 98 -7.298 7.061 -7.429 1.00 0.83 C ATOM 1347 O PHE A 98 -6.297 6.356 -7.413 1.00 1.74 O ATOM 1348 CB PHE A 98 -8.340 6.924 -5.098 1.00 0.82 C ATOM 1349 CG PHE A 98 -6.921 7.147 -4.686 1.00 0.52 C ATOM 1350 CD1 PHE A 98 -6.365 8.416 -4.714 1.00 0.62 C ATOM 1351 CD2 PHE A 98 -6.154 6.091 -4.244 1.00 0.44 C ATOM 1352 CE1 PHE A 98 -5.062 8.617 -4.307 1.00 0.55 C ATOM 1353 CE2 PHE A 98 -4.862 6.290 -3.831 1.00 0.36 C ATOM 1354 CZ PHE A 98 -4.281 7.573 -3.986 1.00 0.32 C ATOM 0 H PHE A 98 -8.731 4.674 -5.986 1.00 0.70 H new ATOM 0 HA PHE A 98 -9.374 7.276 -6.934 1.00 0.66 H new ATOM 0 HB2 PHE A 98 -8.930 7.795 -4.813 1.00 0.82 H new ATOM 0 HB3 PHE A 98 -8.738 6.074 -4.543 1.00 0.82 H new ATOM 0 HD1 PHE A 98 -6.955 9.253 -5.057 1.00 0.62 H new ATOM 0 HD2 PHE A 98 -6.575 5.097 -4.223 1.00 0.44 H new ATOM 0 HE1 PHE A 98 -4.668 9.621 -4.246 1.00 0.55 H new ATOM 0 HE2 PHE A 98 -4.296 5.481 -3.394 1.00 0.36 H new ATOM 0 HZ PHE A 98 -3.219 7.710 -3.847 1.00 0.32 H new ATOM 1364 N LYS A 99 -7.379 8.143 -8.186 1.00 0.73 N ATOM 1365 CA LYS A 99 -6.270 8.518 -9.061 1.00 0.68 C ATOM 1366 C LYS A 99 -5.310 9.456 -8.358 1.00 0.58 C ATOM 1367 O LYS A 99 -5.724 10.263 -7.532 1.00 0.77 O ATOM 1368 CB LYS A 99 -6.761 9.173 -10.359 1.00 0.87 C ATOM 1369 CG LYS A 99 -7.413 8.213 -11.341 1.00 1.19 C ATOM 1370 CD LYS A 99 -8.804 7.810 -10.897 1.00 1.64 C ATOM 1371 CE LYS A 99 -9.349 6.678 -11.747 1.00 2.13 C ATOM 1372 NZ LYS A 99 -10.693 6.236 -11.285 1.00 3.08 N ATOM 0 H LYS A 99 -8.183 8.770 -8.216 1.00 0.73 H new ATOM 0 HA LYS A 99 -5.749 7.595 -9.315 1.00 0.68 H new ATOM 0 HB2 LYS A 99 -7.475 9.957 -10.108 1.00 0.87 H new ATOM 0 HB3 LYS A 99 -5.916 9.657 -10.849 1.00 0.87 H new ATOM 0 HG2 LYS A 99 -7.467 8.680 -12.324 1.00 1.19 H new ATOM 0 HG3 LYS A 99 -6.793 7.323 -11.445 1.00 1.19 H new ATOM 0 HD2 LYS A 99 -8.779 7.503 -9.851 1.00 1.64 H new ATOM 0 HD3 LYS A 99 -9.471 8.669 -10.961 1.00 1.64 H new ATOM 0 HE2 LYS A 99 -9.410 7.001 -12.786 1.00 2.13 H new ATOM 0 HE3 LYS A 99 -8.659 5.835 -11.715 1.00 2.13 H new ATOM 0 HZ1 LYS A 99 -11.068 5.521 -11.941 1.00 3.08 H new ATOM 0 HZ2 LYS A 99 -10.615 5.826 -10.333 1.00 3.08 H new ATOM 0 HZ3 LYS A 99 -11.337 7.052 -11.259 1.00 3.08 H new ATOM 1386 N ALA A 100 -4.033 9.346 -8.710 1.00 0.43 N ATOM 1387 CA ALA A 100 -2.990 10.174 -8.116 1.00 0.36 C ATOM 1388 C ALA A 100 -1.764 10.244 -9.010 1.00 0.34 C ATOM 1389 O ALA A 100 -1.818 9.847 -10.176 1.00 0.41 O ATOM 1390 CB ALA A 100 -2.589 9.638 -6.757 1.00 0.31 C ATOM 0 H ALA A 100 -3.694 8.686 -9.410 1.00 0.43 H new ATOM 0 HA ALA A 100 -3.399 11.178 -8.003 1.00 0.36 H new ATOM 0 HB1 ALA A 100 -1.810 10.271 -6.332 1.00 0.31 H new ATOM 0 HB2 ALA A 100 -3.456 9.636 -6.096 1.00 0.31 H new ATOM 0 HB3 ALA A 100 -2.212 8.621 -6.864 1.00 0.31 H new ATOM 1396 N GLU A 101 -0.653 10.737 -8.467 1.00 0.32 N ATOM 1397 CA GLU A 101 0.588 10.794 -9.229 1.00 0.34 C ATOM 1398 C GLU A 101 1.290 9.443 -9.207 1.00 0.35 C ATOM 1399 O GLU A 101 1.924 9.033 -10.182 1.00 0.64 O ATOM 1400 CB GLU A 101 1.526 11.869 -8.684 1.00 0.45 C ATOM 1401 CG GLU A 101 0.989 13.279 -8.832 1.00 0.73 C ATOM 1402 CD GLU A 101 2.042 14.324 -8.545 1.00 1.37 C ATOM 1403 OE1 GLU A 101 2.779 14.698 -9.481 1.00 1.63 O ATOM 1404 OE2 GLU A 101 2.144 14.776 -7.390 1.00 2.19 O ATOM 0 H GLU A 101 -0.588 11.098 -7.515 1.00 0.32 H new ATOM 0 HA GLU A 101 0.331 11.050 -10.257 1.00 0.34 H new ATOM 0 HB2 GLU A 101 1.717 11.671 -7.629 1.00 0.45 H new ATOM 0 HB3 GLU A 101 2.484 11.798 -9.200 1.00 0.45 H new ATOM 0 HG2 GLU A 101 0.609 13.417 -9.844 1.00 0.73 H new ATOM 0 HG3 GLU A 101 0.147 13.418 -8.154 1.00 0.73 H new ATOM 1411 N PHE A 102 1.153 8.755 -8.090 1.00 0.23 N ATOM 1412 CA PHE A 102 1.775 7.472 -7.889 1.00 0.19 C ATOM 1413 C PHE A 102 0.894 6.370 -8.485 1.00 0.18 C ATOM 1414 O PHE A 102 -0.245 6.623 -8.861 1.00 0.22 O ATOM 1415 CB PHE A 102 2.045 7.269 -6.391 1.00 0.20 C ATOM 1416 CG PHE A 102 0.874 7.470 -5.478 1.00 0.16 C ATOM 1417 CD1 PHE A 102 0.530 8.733 -5.043 1.00 0.20 C ATOM 1418 CD2 PHE A 102 0.087 6.395 -5.100 1.00 0.18 C ATOM 1419 CE1 PHE A 102 -0.573 8.925 -4.243 1.00 0.24 C ATOM 1420 CE2 PHE A 102 -1.021 6.582 -4.302 1.00 0.22 C ATOM 1421 CZ PHE A 102 -1.227 7.831 -3.712 1.00 0.22 C ATOM 0 H PHE A 102 0.602 9.078 -7.295 1.00 0.23 H new ATOM 0 HA PHE A 102 2.734 7.427 -8.405 1.00 0.19 H new ATOM 0 HB2 PHE A 102 2.425 6.258 -6.245 1.00 0.20 H new ATOM 0 HB3 PHE A 102 2.837 7.954 -6.089 1.00 0.20 H new ATOM 0 HD1 PHE A 102 1.133 9.581 -5.334 1.00 0.20 H new ATOM 0 HD2 PHE A 102 0.344 5.401 -5.434 1.00 0.18 H new ATOM 0 HE1 PHE A 102 -0.925 9.924 -4.032 1.00 0.24 H new ATOM 0 HE2 PHE A 102 -1.719 5.775 -4.135 1.00 0.22 H new ATOM 0 HZ PHE A 102 -1.882 7.939 -2.860 1.00 0.22 H new ATOM 1431 N PRO A 103 1.434 5.155 -8.632 1.00 0.18 N ATOM 1432 CA PRO A 103 0.739 4.012 -9.259 1.00 0.21 C ATOM 1433 C PRO A 103 -0.377 3.428 -8.396 1.00 0.19 C ATOM 1434 O PRO A 103 -0.120 2.696 -7.440 1.00 0.27 O ATOM 1435 CB PRO A 103 1.868 2.987 -9.431 1.00 0.27 C ATOM 1436 CG PRO A 103 3.117 3.782 -9.281 1.00 0.31 C ATOM 1437 CD PRO A 103 2.791 4.781 -8.236 1.00 0.21 C ATOM 0 HA PRO A 103 0.239 4.303 -10.183 1.00 0.21 H new ATOM 0 HB2 PRO A 103 1.806 2.199 -8.681 1.00 0.27 H new ATOM 0 HB3 PRO A 103 1.820 2.503 -10.407 1.00 0.27 H new ATOM 0 HG2 PRO A 103 3.956 3.153 -8.982 1.00 0.31 H new ATOM 0 HG3 PRO A 103 3.397 4.263 -10.218 1.00 0.31 H new ATOM 0 HD2 PRO A 103 2.827 4.357 -7.233 1.00 0.21 H new ATOM 0 HD3 PRO A 103 3.474 5.630 -8.248 1.00 0.21 H new ATOM 1445 N ILE A 104 -1.618 3.748 -8.742 1.00 0.24 N ATOM 1446 CA ILE A 104 -2.768 3.151 -8.079 1.00 0.24 C ATOM 1447 C ILE A 104 -3.235 1.946 -8.890 1.00 0.26 C ATOM 1448 O ILE A 104 -3.341 2.009 -10.115 1.00 0.36 O ATOM 1449 CB ILE A 104 -3.931 4.154 -7.875 1.00 0.27 C ATOM 1450 CG1 ILE A 104 -3.568 5.212 -6.822 1.00 0.25 C ATOM 1451 CG2 ILE A 104 -5.207 3.434 -7.468 1.00 0.37 C ATOM 1452 CD1 ILE A 104 -2.724 6.335 -7.355 1.00 0.31 C ATOM 0 H ILE A 104 -1.852 4.416 -9.476 1.00 0.24 H new ATOM 0 HA ILE A 104 -2.457 2.839 -7.082 1.00 0.24 H new ATOM 0 HB ILE A 104 -4.102 4.655 -8.828 1.00 0.27 H new ATOM 0 HG12 ILE A 104 -4.486 5.626 -6.406 1.00 0.25 H new ATOM 0 HG13 ILE A 104 -3.036 4.728 -6.003 1.00 0.25 H new ATOM 0 HG21 ILE A 104 -6.007 4.161 -7.331 1.00 0.37 H new ATOM 0 HG22 ILE A 104 -5.489 2.726 -8.247 1.00 0.37 H new ATOM 0 HG23 ILE A 104 -5.040 2.898 -6.534 1.00 0.37 H new ATOM 0 HD11 ILE A 104 -2.509 7.041 -6.553 1.00 0.31 H new ATOM 0 HD12 ILE A 104 -1.789 5.934 -7.745 1.00 0.31 H new ATOM 0 HD13 ILE A 104 -3.261 6.846 -8.154 1.00 0.31 H new ATOM 1464 N MET A 105 -3.496 0.854 -8.192 1.00 0.23 N ATOM 1465 CA MET A 105 -3.600 -0.459 -8.808 1.00 0.27 C ATOM 1466 C MET A 105 -5.031 -0.980 -8.833 1.00 0.26 C ATOM 1467 O MET A 105 -5.991 -0.213 -8.850 1.00 0.28 O ATOM 1468 CB MET A 105 -2.730 -1.432 -8.018 1.00 0.34 C ATOM 1469 CG MET A 105 -1.395 -0.848 -7.588 1.00 0.53 C ATOM 1470 SD MET A 105 -0.129 -0.922 -8.866 1.00 0.74 S ATOM 1471 CE MET A 105 -0.794 0.152 -10.134 1.00 1.47 C ATOM 0 H MET A 105 -3.642 0.852 -7.182 1.00 0.23 H new ATOM 0 HA MET A 105 -3.267 -0.373 -9.842 1.00 0.27 H new ATOM 0 HB2 MET A 105 -3.276 -1.757 -7.133 1.00 0.34 H new ATOM 0 HB3 MET A 105 -2.550 -2.319 -8.625 1.00 0.34 H new ATOM 0 HG2 MET A 105 -1.541 0.191 -7.293 1.00 0.53 H new ATOM 0 HG3 MET A 105 -1.041 -1.383 -6.707 1.00 0.53 H new ATOM 0 HE1 MET A 105 -0.008 0.404 -10.846 1.00 1.47 H new ATOM 0 HE2 MET A 105 -1.605 -0.358 -10.654 1.00 1.47 H new ATOM 0 HE3 MET A 105 -1.174 1.065 -9.675 1.00 1.47 H new ATOM 1481 N ALA A 106 -5.151 -2.299 -8.865 1.00 0.29 N ATOM 1482 CA ALA A 106 -6.439 -2.959 -8.793 1.00 0.32 C ATOM 1483 C ALA A 106 -6.977 -2.910 -7.369 1.00 0.32 C ATOM 1484 O ALA A 106 -6.226 -3.151 -6.423 1.00 0.39 O ATOM 1485 CB ALA A 106 -6.312 -4.405 -9.224 1.00 0.36 C ATOM 0 H ALA A 106 -4.359 -2.937 -8.941 1.00 0.29 H new ATOM 0 HA ALA A 106 -7.127 -2.440 -9.460 1.00 0.32 H new ATOM 0 HB1 ALA A 106 -7.287 -4.889 -9.165 1.00 0.36 H new ATOM 0 HB2 ALA A 106 -5.947 -4.448 -10.250 1.00 0.36 H new ATOM 0 HB3 ALA A 106 -5.611 -4.920 -8.567 1.00 0.36 H new ATOM 1491 N LYS A 107 -8.257 -2.594 -7.192 1.00 0.39 N ATOM 1492 CA LYS A 107 -8.852 -2.711 -5.876 1.00 0.42 C ATOM 1493 C LYS A 107 -9.053 -4.168 -5.557 1.00 0.35 C ATOM 1494 O LYS A 107 -9.682 -4.916 -6.310 1.00 0.43 O ATOM 1495 CB LYS A 107 -10.182 -1.962 -5.753 1.00 0.59 C ATOM 1496 CG LYS A 107 -11.075 -2.081 -6.960 1.00 0.59 C ATOM 1497 CD LYS A 107 -12.493 -1.620 -6.651 1.00 0.89 C ATOM 1498 CE LYS A 107 -13.421 -1.789 -7.843 1.00 1.15 C ATOM 1499 NZ LYS A 107 -13.779 -3.212 -8.086 1.00 1.66 N ATOM 0 H LYS A 107 -8.884 -2.264 -7.926 1.00 0.39 H new ATOM 0 HA LYS A 107 -8.168 -2.250 -5.163 1.00 0.42 H new ATOM 0 HB2 LYS A 107 -10.718 -2.337 -4.881 1.00 0.59 H new ATOM 0 HB3 LYS A 107 -9.976 -0.907 -5.571 1.00 0.59 H new ATOM 0 HG2 LYS A 107 -10.667 -1.485 -7.776 1.00 0.59 H new ATOM 0 HG3 LYS A 107 -11.094 -3.117 -7.300 1.00 0.59 H new ATOM 0 HD2 LYS A 107 -12.882 -2.187 -5.806 1.00 0.89 H new ATOM 0 HD3 LYS A 107 -12.476 -0.572 -6.351 1.00 0.89 H new ATOM 0 HE2 LYS A 107 -14.331 -1.212 -7.677 1.00 1.15 H new ATOM 0 HE3 LYS A 107 -12.943 -1.380 -8.733 1.00 1.15 H new ATOM 0 HZ1 LYS A 107 -14.426 -3.273 -8.898 1.00 1.66 H new ATOM 0 HZ2 LYS A 107 -12.917 -3.757 -8.288 1.00 1.66 H new ATOM 0 HZ3 LYS A 107 -14.245 -3.602 -7.242 1.00 1.66 H new ATOM 1513 N ILE A 108 -8.507 -4.556 -4.444 1.00 0.33 N ATOM 1514 CA ILE A 108 -8.554 -5.907 -3.990 1.00 0.32 C ATOM 1515 C ILE A 108 -9.206 -5.891 -2.639 1.00 0.35 C ATOM 1516 O ILE A 108 -9.496 -4.819 -2.104 1.00 0.43 O ATOM 1517 CB ILE A 108 -7.132 -6.488 -3.886 1.00 0.35 C ATOM 1518 CG1 ILE A 108 -6.252 -5.553 -3.047 1.00 0.46 C ATOM 1519 CG2 ILE A 108 -6.542 -6.696 -5.275 1.00 0.47 C ATOM 1520 CD1 ILE A 108 -4.810 -5.986 -2.954 1.00 0.45 C ATOM 0 H ILE A 108 -8.007 -3.927 -3.816 1.00 0.33 H new ATOM 0 HA ILE A 108 -9.114 -6.530 -4.687 1.00 0.32 H new ATOM 0 HB ILE A 108 -7.175 -7.459 -3.392 1.00 0.35 H new ATOM 0 HG12 ILE A 108 -6.293 -4.551 -3.475 1.00 0.46 H new ATOM 0 HG13 ILE A 108 -6.666 -5.487 -2.041 1.00 0.46 H new ATOM 0 HG21 ILE A 108 -5.537 -7.107 -5.185 1.00 0.47 H new ATOM 0 HG22 ILE A 108 -7.169 -7.389 -5.836 1.00 0.47 H new ATOM 0 HG23 ILE A 108 -6.498 -5.741 -5.798 1.00 0.47 H new ATOM 0 HD11 ILE A 108 -4.255 -5.273 -2.344 1.00 0.45 H new ATOM 0 HD12 ILE A 108 -4.756 -6.974 -2.497 1.00 0.45 H new ATOM 0 HD13 ILE A 108 -4.376 -6.024 -3.953 1.00 0.45 H new ATOM 1532 N ASN A 109 -9.451 -7.045 -2.090 1.00 0.39 N ATOM 1533 CA ASN A 109 -10.021 -7.108 -0.776 1.00 0.48 C ATOM 1534 C ASN A 109 -8.935 -6.987 0.259 1.00 0.48 C ATOM 1535 O ASN A 109 -8.471 -7.990 0.784 1.00 0.92 O ATOM 1536 CB ASN A 109 -10.791 -8.405 -0.578 1.00 0.68 C ATOM 1537 CG ASN A 109 -12.208 -8.306 -1.080 1.00 1.12 C ATOM 1538 OD1 ASN A 109 -12.500 -8.619 -2.234 1.00 2.16 O ATOM 1539 ND2 ASN A 109 -13.091 -7.838 -0.219 1.00 1.05 N ATOM 0 H ASN A 109 -9.267 -7.948 -2.527 1.00 0.39 H new ATOM 0 HA ASN A 109 -10.719 -6.279 -0.664 1.00 0.48 H new ATOM 0 HB2 ASN A 109 -10.278 -9.214 -1.099 1.00 0.68 H new ATOM 0 HB3 ASN A 109 -10.799 -8.663 0.481 1.00 0.68 H new ATOM 0 HD21 ASN A 109 -14.065 -7.722 -0.499 1.00 1.05 H new ATOM 0 HD22 ASN A 109 -12.800 -7.592 0.727 1.00 1.05 H new ATOM 1546 N VAL A 110 -8.492 -5.772 0.555 1.00 0.28 N ATOM 1547 CA VAL A 110 -7.488 -5.638 1.578 1.00 0.26 C ATOM 1548 C VAL A 110 -8.151 -5.725 2.937 1.00 0.30 C ATOM 1549 O VAL A 110 -8.437 -4.720 3.568 1.00 0.38 O ATOM 1550 CB VAL A 110 -6.777 -4.279 1.462 1.00 0.28 C ATOM 1551 CG1 VAL A 110 -5.668 -4.363 0.449 1.00 0.29 C ATOM 1552 CG2 VAL A 110 -7.760 -3.182 1.076 1.00 0.36 C ATOM 0 H VAL A 110 -8.802 -4.904 0.117 1.00 0.28 H new ATOM 0 HA VAL A 110 -6.755 -6.436 1.457 1.00 0.26 H new ATOM 0 HB VAL A 110 -6.354 -4.029 2.435 1.00 0.28 H new ATOM 0 HG11 VAL A 110 -5.170 -3.396 0.373 1.00 0.29 H new ATOM 0 HG12 VAL A 110 -4.947 -5.119 0.760 1.00 0.29 H new ATOM 0 HG13 VAL A 110 -6.082 -4.635 -0.522 1.00 0.29 H new ATOM 0 HG21 VAL A 110 -7.233 -2.231 1.000 1.00 0.36 H new ATOM 0 HG22 VAL A 110 -8.214 -3.422 0.115 1.00 0.36 H new ATOM 0 HG23 VAL A 110 -8.538 -3.106 1.836 1.00 0.36 H new ATOM 1562 N ASN A 111 -8.348 -6.951 3.385 1.00 0.33 N ATOM 1563 CA ASN A 111 -8.695 -7.271 4.754 1.00 0.44 C ATOM 1564 C ASN A 111 -9.065 -8.744 4.797 1.00 0.48 C ATOM 1565 O ASN A 111 -9.022 -9.413 3.765 1.00 0.54 O ATOM 1566 CB ASN A 111 -9.836 -6.423 5.317 1.00 0.54 C ATOM 1567 CG ASN A 111 -9.848 -6.478 6.835 1.00 1.15 C ATOM 1568 OD1 ASN A 111 -8.819 -6.747 7.458 1.00 1.98 O ATOM 1569 ND2 ASN A 111 -10.989 -6.218 7.440 1.00 1.31 N ATOM 0 H ASN A 111 -8.268 -7.774 2.788 1.00 0.33 H new ATOM 0 HA ASN A 111 -7.834 -7.048 5.384 1.00 0.44 H new ATOM 0 HB2 ASN A 111 -9.725 -5.390 4.987 1.00 0.54 H new ATOM 0 HB3 ASN A 111 -10.789 -6.782 4.928 1.00 0.54 H new ATOM 0 HD21 ASN A 111 -11.042 -6.235 8.458 1.00 1.31 H new ATOM 0 HD22 ASN A 111 -11.820 -5.999 6.890 1.00 1.31 H new ATOM 1576 N GLY A 112 -9.408 -9.248 5.970 1.00 0.61 N ATOM 1577 CA GLY A 112 -10.169 -10.481 6.060 1.00 0.67 C ATOM 1578 C GLY A 112 -9.550 -11.681 5.384 1.00 0.71 C ATOM 1579 O GLY A 112 -8.330 -11.785 5.238 1.00 0.78 O ATOM 0 H GLY A 112 -9.173 -8.825 6.868 1.00 0.61 H new ATOM 0 HA2 GLY A 112 -10.320 -10.718 7.113 1.00 0.67 H new ATOM 0 HA3 GLY A 112 -11.155 -10.311 5.627 1.00 0.67 H new ATOM 1583 N GLU A 113 -10.426 -12.577 4.965 1.00 0.73 N ATOM 1584 CA GLU A 113 -10.039 -13.836 4.347 1.00 0.81 C ATOM 1585 C GLU A 113 -9.922 -13.681 2.842 1.00 0.73 C ATOM 1586 O GLU A 113 -9.254 -14.464 2.172 1.00 0.81 O ATOM 1587 CB GLU A 113 -11.101 -14.892 4.651 1.00 0.98 C ATOM 1588 CG GLU A 113 -12.501 -14.441 4.249 1.00 1.18 C ATOM 1589 CD GLU A 113 -13.548 -15.519 4.401 1.00 1.49 C ATOM 1590 OE1 GLU A 113 -14.006 -15.746 5.539 1.00 1.67 O ATOM 1591 OE2 GLU A 113 -13.906 -16.153 3.388 1.00 1.98 O ATOM 0 H GLU A 113 -11.435 -12.451 5.044 1.00 0.73 H new ATOM 0 HA GLU A 113 -9.072 -14.138 4.750 1.00 0.81 H new ATOM 0 HB2 GLU A 113 -10.854 -15.814 4.124 1.00 0.98 H new ATOM 0 HB3 GLU A 113 -11.088 -15.120 5.717 1.00 0.98 H new ATOM 0 HG2 GLU A 113 -12.785 -13.581 4.856 1.00 1.18 H new ATOM 0 HG3 GLU A 113 -12.483 -14.107 3.212 1.00 1.18 H new ATOM 1598 N ASN A 114 -10.572 -12.655 2.323 1.00 0.63 N ATOM 1599 CA ASN A 114 -10.752 -12.504 0.898 1.00 0.60 C ATOM 1600 C ASN A 114 -9.631 -11.648 0.302 1.00 0.48 C ATOM 1601 O ASN A 114 -9.642 -11.301 -0.882 1.00 0.53 O ATOM 1602 CB ASN A 114 -12.132 -11.888 0.693 1.00 0.67 C ATOM 1603 CG ASN A 114 -12.583 -11.854 -0.753 1.00 1.15 C ATOM 1604 OD1 ASN A 114 -12.106 -12.618 -1.589 1.00 2.04 O ATOM 1605 ND2 ASN A 114 -13.553 -11.011 -1.039 1.00 1.62 N ATOM 0 H ASN A 114 -10.987 -11.907 2.879 1.00 0.63 H new ATOM 0 HA ASN A 114 -10.698 -13.462 0.381 1.00 0.60 H new ATOM 0 HB2 ASN A 114 -12.860 -12.451 1.277 1.00 0.67 H new ATOM 0 HB3 ASN A 114 -12.127 -10.871 1.085 1.00 0.67 H new ATOM 0 HD21 ASN A 114 -13.936 -10.976 -1.984 1.00 1.62 H new ATOM 0 HD22 ASN A 114 -13.921 -10.393 -0.316 1.00 1.62 H new ATOM 1612 N ALA A 115 -8.659 -11.332 1.149 1.00 0.43 N ATOM 1613 CA ALA A 115 -7.496 -10.536 0.768 1.00 0.37 C ATOM 1614 C ALA A 115 -6.722 -11.123 -0.411 1.00 0.33 C ATOM 1615 O ALA A 115 -6.599 -12.342 -0.549 1.00 0.37 O ATOM 1616 CB ALA A 115 -6.567 -10.385 1.967 1.00 0.48 C ATOM 0 H ALA A 115 -8.654 -11.622 2.127 1.00 0.43 H new ATOM 0 HA ALA A 115 -7.870 -9.564 0.445 1.00 0.37 H new ATOM 0 HB1 ALA A 115 -5.699 -9.791 1.682 1.00 0.48 H new ATOM 0 HB2 ALA A 115 -7.098 -9.886 2.778 1.00 0.48 H new ATOM 0 HB3 ALA A 115 -6.239 -11.370 2.300 1.00 0.48 H new ATOM 1622 N HIS A 116 -6.236 -10.233 -1.279 1.00 0.29 N ATOM 1623 CA HIS A 116 -5.255 -10.594 -2.303 1.00 0.26 C ATOM 1624 C HIS A 116 -4.057 -11.263 -1.633 1.00 0.23 C ATOM 1625 O HIS A 116 -3.563 -10.764 -0.629 1.00 0.23 O ATOM 1626 CB HIS A 116 -4.777 -9.322 -2.998 1.00 0.27 C ATOM 1627 CG HIS A 116 -4.035 -9.540 -4.283 1.00 0.30 C ATOM 1628 ND1 HIS A 116 -2.664 -9.484 -4.370 1.00 0.41 N ATOM 1629 CD2 HIS A 116 -4.474 -9.796 -5.539 1.00 0.28 C ATOM 1630 CE1 HIS A 116 -2.296 -9.698 -5.619 1.00 0.42 C ATOM 1631 NE2 HIS A 116 -3.373 -9.891 -6.347 1.00 0.34 N ATOM 0 H HIS A 116 -6.509 -9.250 -1.292 1.00 0.29 H new ATOM 0 HA HIS A 116 -5.707 -11.273 -3.026 1.00 0.26 H new ATOM 0 HB2 HIS A 116 -5.642 -8.689 -3.198 1.00 0.27 H new ATOM 0 HB3 HIS A 116 -4.132 -8.772 -2.313 1.00 0.27 H new ATOM 0 HD2 HIS A 116 -5.504 -9.905 -5.846 1.00 0.28 H new ATOM 0 HE1 HIS A 116 -1.279 -9.712 -5.982 1.00 0.42 H new ATOM 0 HE2 HIS A 116 -3.386 -10.080 -7.349 1.00 0.34 H new ATOM 1640 N PRO A 117 -3.561 -12.381 -2.202 1.00 0.26 N ATOM 1641 CA PRO A 117 -2.450 -13.160 -1.627 1.00 0.26 C ATOM 1642 C PRO A 117 -1.208 -12.311 -1.355 1.00 0.21 C ATOM 1643 O PRO A 117 -0.467 -12.564 -0.410 1.00 0.23 O ATOM 1644 CB PRO A 117 -2.148 -14.221 -2.695 1.00 0.35 C ATOM 1645 CG PRO A 117 -2.855 -13.759 -3.924 1.00 0.36 C ATOM 1646 CD PRO A 117 -4.051 -12.995 -3.445 1.00 0.32 C ATOM 0 HA PRO A 117 -2.722 -13.579 -0.658 1.00 0.26 H new ATOM 0 HB2 PRO A 117 -1.076 -14.309 -2.869 1.00 0.35 H new ATOM 0 HB3 PRO A 117 -2.503 -15.204 -2.384 1.00 0.35 H new ATOM 0 HG2 PRO A 117 -2.207 -13.129 -4.534 1.00 0.36 H new ATOM 0 HG3 PRO A 117 -3.154 -14.604 -4.544 1.00 0.36 H new ATOM 0 HD2 PRO A 117 -4.370 -12.245 -4.169 1.00 0.32 H new ATOM 0 HD3 PRO A 117 -4.905 -13.649 -3.265 1.00 0.32 H new ATOM 1654 N LEU A 118 -0.987 -11.312 -2.200 1.00 0.21 N ATOM 1655 CA LEU A 118 0.112 -10.367 -2.011 1.00 0.19 C ATOM 1656 C LEU A 118 -0.078 -9.600 -0.697 1.00 0.18 C ATOM 1657 O LEU A 118 0.863 -9.429 0.075 1.00 0.18 O ATOM 1658 CB LEU A 118 0.192 -9.440 -3.246 1.00 0.23 C ATOM 1659 CG LEU A 118 1.157 -8.243 -3.202 1.00 0.28 C ATOM 1660 CD1 LEU A 118 0.553 -7.077 -2.435 1.00 1.10 C ATOM 1661 CD2 LEU A 118 2.500 -8.643 -2.611 1.00 1.05 C ATOM 0 H LEU A 118 -1.556 -11.133 -3.027 1.00 0.21 H new ATOM 0 HA LEU A 118 1.064 -10.891 -1.929 1.00 0.19 H new ATOM 0 HB2 LEU A 118 0.464 -10.054 -4.105 1.00 0.23 H new ATOM 0 HB3 LEU A 118 -0.809 -9.052 -3.435 1.00 0.23 H new ATOM 0 HG LEU A 118 1.325 -7.917 -4.228 1.00 0.28 H new ATOM 0 HD11 LEU A 118 1.258 -6.246 -2.421 1.00 1.10 H new ATOM 0 HD12 LEU A 118 -0.370 -6.761 -2.921 1.00 1.10 H new ATOM 0 HD13 LEU A 118 0.337 -7.387 -1.412 1.00 1.10 H new ATOM 0 HD21 LEU A 118 3.162 -7.777 -2.592 1.00 1.05 H new ATOM 0 HD22 LEU A 118 2.355 -9.011 -1.595 1.00 1.05 H new ATOM 0 HD23 LEU A 118 2.947 -9.428 -3.221 1.00 1.05 H new ATOM 1673 N TYR A 119 -1.307 -9.171 -0.435 1.00 0.19 N ATOM 1674 CA TYR A 119 -1.630 -8.518 0.825 1.00 0.20 C ATOM 1675 C TYR A 119 -1.722 -9.524 1.942 1.00 0.20 C ATOM 1676 O TYR A 119 -1.397 -9.201 3.064 1.00 0.21 O ATOM 1677 CB TYR A 119 -2.897 -7.682 0.711 1.00 0.24 C ATOM 1678 CG TYR A 119 -2.576 -6.213 0.575 1.00 0.35 C ATOM 1679 CD1 TYR A 119 -2.426 -5.417 1.699 1.00 0.69 C ATOM 1680 CD2 TYR A 119 -2.396 -5.628 -0.671 1.00 0.44 C ATOM 1681 CE1 TYR A 119 -2.111 -4.079 1.589 1.00 1.06 C ATOM 1682 CE2 TYR A 119 -2.077 -4.289 -0.790 1.00 0.79 C ATOM 1683 CZ TYR A 119 -1.939 -3.519 0.344 1.00 1.10 C ATOM 1684 OH TYR A 119 -1.623 -2.186 0.234 1.00 1.49 O ATOM 0 H TYR A 119 -2.094 -9.264 -1.078 1.00 0.19 H new ATOM 0 HA TYR A 119 -0.818 -7.832 1.066 1.00 0.20 H new ATOM 0 HB2 TYR A 119 -3.476 -8.011 -0.152 1.00 0.24 H new ATOM 0 HB3 TYR A 119 -3.520 -7.840 1.591 1.00 0.24 H new ATOM 0 HD1 TYR A 119 -2.558 -5.852 2.679 1.00 0.69 H new ATOM 0 HD2 TYR A 119 -2.507 -6.229 -1.561 1.00 0.44 H new ATOM 0 HE1 TYR A 119 -2.000 -3.473 2.476 1.00 1.06 H new ATOM 0 HE2 TYR A 119 -1.937 -3.849 -1.766 1.00 0.79 H new ATOM 0 HH TYR A 119 -1.986 -1.832 -0.604 1.00 1.49 H new ATOM 1694 N GLU A 120 -2.121 -10.747 1.645 1.00 0.21 N ATOM 1695 CA GLU A 120 -2.045 -11.796 2.646 1.00 0.22 C ATOM 1696 C GLU A 120 -0.622 -11.911 3.138 1.00 0.21 C ATOM 1697 O GLU A 120 -0.393 -12.027 4.336 1.00 0.26 O ATOM 1698 CB GLU A 120 -2.511 -13.143 2.101 1.00 0.28 C ATOM 1699 CG GLU A 120 -3.970 -13.174 1.698 1.00 0.40 C ATOM 1700 CD GLU A 120 -4.443 -14.577 1.405 1.00 1.38 C ATOM 1701 OE1 GLU A 120 -4.048 -15.133 0.363 1.00 2.37 O ATOM 1702 OE2 GLU A 120 -5.232 -15.121 2.207 1.00 1.57 O ATOM 0 H GLU A 120 -2.493 -11.035 0.740 1.00 0.21 H new ATOM 0 HA GLU A 120 -2.710 -11.527 3.466 1.00 0.22 H new ATOM 0 HB2 GLU A 120 -1.901 -13.404 1.237 1.00 0.28 H new ATOM 0 HB3 GLU A 120 -2.337 -13.909 2.857 1.00 0.28 H new ATOM 0 HG2 GLU A 120 -4.576 -12.746 2.496 1.00 0.40 H new ATOM 0 HG3 GLU A 120 -4.117 -12.550 0.816 1.00 0.40 H new ATOM 1709 N TYR A 121 0.333 -11.819 2.218 1.00 0.19 N ATOM 1710 CA TYR A 121 1.741 -11.887 2.589 1.00 0.18 C ATOM 1711 C TYR A 121 2.126 -10.683 3.438 1.00 0.17 C ATOM 1712 O TYR A 121 2.778 -10.820 4.467 1.00 0.21 O ATOM 1713 CB TYR A 121 2.658 -11.976 1.360 1.00 0.20 C ATOM 1714 CG TYR A 121 4.129 -11.813 1.694 1.00 0.26 C ATOM 1715 CD1 TYR A 121 4.862 -12.874 2.210 1.00 0.40 C ATOM 1716 CD2 TYR A 121 4.786 -10.606 1.483 1.00 0.32 C ATOM 1717 CE1 TYR A 121 6.203 -12.736 2.508 1.00 0.48 C ATOM 1718 CE2 TYR A 121 6.130 -10.463 1.778 1.00 0.41 C ATOM 1719 CZ TYR A 121 6.823 -11.498 2.322 1.00 0.47 C ATOM 1720 OH TYR A 121 8.174 -11.404 2.581 1.00 0.58 O ATOM 0 H TYR A 121 0.160 -11.698 1.220 1.00 0.19 H new ATOM 0 HA TYR A 121 1.877 -12.799 3.171 1.00 0.18 H new ATOM 0 HB2 TYR A 121 2.508 -12.939 0.873 1.00 0.20 H new ATOM 0 HB3 TYR A 121 2.368 -11.208 0.643 1.00 0.20 H new ATOM 0 HD1 TYR A 121 4.375 -13.823 2.381 1.00 0.40 H new ATOM 0 HD2 TYR A 121 4.238 -9.766 1.082 1.00 0.32 H new ATOM 0 HE1 TYR A 121 6.768 -13.578 2.882 1.00 0.48 H new ATOM 0 HE2 TYR A 121 6.630 -9.527 1.576 1.00 0.41 H new ATOM 0 HH TYR A 121 8.582 -12.292 2.514 1.00 0.58 H new ATOM 1730 N MET A 122 1.704 -9.510 3.008 1.00 0.16 N ATOM 1731 CA MET A 122 2.045 -8.279 3.704 1.00 0.18 C ATOM 1732 C MET A 122 1.424 -8.225 5.099 1.00 0.18 C ATOM 1733 O MET A 122 2.130 -8.024 6.093 1.00 0.21 O ATOM 1734 CB MET A 122 1.611 -7.072 2.874 1.00 0.20 C ATOM 1735 CG MET A 122 2.446 -6.877 1.624 1.00 0.22 C ATOM 1736 SD MET A 122 1.927 -5.458 0.647 1.00 0.34 S ATOM 1737 CE MET A 122 3.100 -5.558 -0.702 1.00 0.28 C ATOM 0 H MET A 122 1.124 -9.381 2.179 1.00 0.16 H new ATOM 0 HA MET A 122 3.127 -8.255 3.831 1.00 0.18 H new ATOM 0 HB2 MET A 122 0.565 -7.191 2.590 1.00 0.20 H new ATOM 0 HB3 MET A 122 1.674 -6.174 3.489 1.00 0.20 H new ATOM 0 HG2 MET A 122 3.491 -6.753 1.907 1.00 0.22 H new ATOM 0 HG3 MET A 122 2.386 -7.776 1.010 1.00 0.22 H new ATOM 0 HE1 MET A 122 2.674 -5.091 -1.590 1.00 0.28 H new ATOM 0 HE2 MET A 122 4.018 -5.040 -0.425 1.00 0.28 H new ATOM 0 HE3 MET A 122 3.323 -6.604 -0.913 1.00 0.28 H new ATOM 1747 N LYS A 123 0.112 -8.423 5.168 1.00 0.18 N ATOM 1748 CA LYS A 123 -0.622 -8.340 6.425 1.00 0.22 C ATOM 1749 C LYS A 123 -0.079 -9.354 7.435 1.00 0.23 C ATOM 1750 O LYS A 123 0.029 -9.062 8.626 1.00 0.31 O ATOM 1751 CB LYS A 123 -2.120 -8.606 6.212 1.00 0.32 C ATOM 1752 CG LYS A 123 -2.782 -7.834 5.087 1.00 0.60 C ATOM 1753 CD LYS A 123 -4.045 -8.556 4.621 1.00 0.78 C ATOM 1754 CE LYS A 123 -4.972 -8.892 5.783 1.00 0.74 C ATOM 1755 NZ LYS A 123 -5.990 -9.914 5.411 1.00 0.94 N ATOM 0 H LYS A 123 -0.469 -8.644 4.360 1.00 0.18 H new ATOM 0 HA LYS A 123 -0.490 -7.329 6.811 1.00 0.22 H new ATOM 0 HB2 LYS A 123 -2.256 -9.671 6.023 1.00 0.32 H new ATOM 0 HB3 LYS A 123 -2.644 -8.377 7.140 1.00 0.32 H new ATOM 0 HG2 LYS A 123 -3.033 -6.829 5.425 1.00 0.60 H new ATOM 0 HG3 LYS A 123 -2.088 -7.726 4.253 1.00 0.60 H new ATOM 0 HD2 LYS A 123 -4.576 -7.931 3.903 1.00 0.78 H new ATOM 0 HD3 LYS A 123 -3.768 -9.473 4.102 1.00 0.78 H new ATOM 0 HE2 LYS A 123 -4.382 -9.258 6.623 1.00 0.74 H new ATOM 0 HE3 LYS A 123 -5.475 -7.985 6.118 1.00 0.74 H new ATOM 0 HZ1 LYS A 123 -6.566 -10.149 6.244 1.00 0.94 H new ATOM 0 HZ2 LYS A 123 -6.604 -9.536 4.661 1.00 0.94 H new ATOM 0 HZ3 LYS A 123 -5.512 -10.771 5.067 1.00 0.94 H new ATOM 1769 N LYS A 124 0.261 -10.546 6.952 1.00 0.21 N ATOM 1770 CA LYS A 124 0.740 -11.610 7.825 1.00 0.24 C ATOM 1771 C LYS A 124 2.169 -11.344 8.277 1.00 0.25 C ATOM 1772 O LYS A 124 2.527 -11.628 9.421 1.00 0.30 O ATOM 1773 CB LYS A 124 0.652 -12.973 7.121 1.00 0.27 C ATOM 1774 CG LYS A 124 1.684 -13.173 6.012 1.00 0.26 C ATOM 1775 CD LYS A 124 1.369 -14.393 5.158 1.00 1.05 C ATOM 1776 CE LYS A 124 1.268 -15.664 5.985 1.00 1.37 C ATOM 1777 NZ LYS A 124 0.868 -16.828 5.150 1.00 2.13 N ATOM 0 H LYS A 124 0.214 -10.797 5.965 1.00 0.21 H new ATOM 0 HA LYS A 124 0.099 -11.631 8.706 1.00 0.24 H new ATOM 0 HB2 LYS A 124 0.776 -13.761 7.863 1.00 0.27 H new ATOM 0 HB3 LYS A 124 -0.346 -13.087 6.698 1.00 0.27 H new ATOM 0 HG2 LYS A 124 1.715 -12.285 5.380 1.00 0.26 H new ATOM 0 HG3 LYS A 124 2.674 -13.284 6.453 1.00 0.26 H new ATOM 0 HD2 LYS A 124 0.430 -14.231 4.629 1.00 1.05 H new ATOM 0 HD3 LYS A 124 2.144 -14.515 4.402 1.00 1.05 H new ATOM 0 HE2 LYS A 124 2.228 -15.868 6.459 1.00 1.37 H new ATOM 0 HE3 LYS A 124 0.541 -15.522 6.785 1.00 1.37 H new ATOM 0 HZ1 LYS A 124 0.809 -17.678 5.746 1.00 2.13 H new ATOM 0 HZ2 LYS A 124 -0.060 -16.643 4.718 1.00 2.13 H new ATOM 0 HZ3 LYS A 124 1.575 -16.978 4.402 1.00 2.13 H new ATOM 1791 N THR A 125 2.975 -10.789 7.385 1.00 0.23 N ATOM 1792 CA THR A 125 4.383 -10.564 7.680 1.00 0.28 C ATOM 1793 C THR A 125 4.579 -9.455 8.709 1.00 0.34 C ATOM 1794 O THR A 125 5.376 -9.597 9.638 1.00 0.47 O ATOM 1795 CB THR A 125 5.189 -10.246 6.403 1.00 0.31 C ATOM 1796 OG1 THR A 125 5.094 -11.350 5.496 1.00 0.35 O ATOM 1797 CG2 THR A 125 6.654 -9.983 6.723 1.00 0.37 C ATOM 0 H THR A 125 2.681 -10.487 6.456 1.00 0.23 H new ATOM 0 HA THR A 125 4.761 -11.494 8.105 1.00 0.28 H new ATOM 0 HB THR A 125 4.771 -9.347 5.951 1.00 0.31 H new ATOM 0 HG1 THR A 125 4.219 -11.337 5.056 1.00 0.35 H new ATOM 0 HG21 THR A 125 7.194 -9.762 5.802 1.00 0.37 H new ATOM 0 HG22 THR A 125 6.731 -9.133 7.401 1.00 0.37 H new ATOM 0 HG23 THR A 125 7.087 -10.865 7.195 1.00 0.37 H new ATOM 1805 N LYS A 126 3.843 -8.364 8.566 1.00 0.34 N ATOM 1806 CA LYS A 126 4.024 -7.233 9.458 1.00 0.50 C ATOM 1807 C LYS A 126 2.685 -6.646 9.895 1.00 0.54 C ATOM 1808 O LYS A 126 2.032 -5.926 9.135 1.00 0.88 O ATOM 1809 CB LYS A 126 4.879 -6.168 8.775 1.00 0.70 C ATOM 1810 CG LYS A 126 5.998 -5.641 9.656 1.00 1.17 C ATOM 1811 CD LYS A 126 5.487 -4.664 10.700 1.00 0.75 C ATOM 1812 CE LYS A 126 6.547 -4.371 11.747 1.00 0.91 C ATOM 1813 NZ LYS A 126 6.068 -3.416 12.778 1.00 1.75 N ATOM 0 H LYS A 126 3.126 -8.239 7.852 1.00 0.34 H new ATOM 0 HA LYS A 126 4.535 -7.583 10.355 1.00 0.50 H new ATOM 0 HB2 LYS A 126 5.309 -6.586 7.865 1.00 0.70 H new ATOM 0 HB3 LYS A 126 4.241 -5.337 8.474 1.00 0.70 H new ATOM 0 HG2 LYS A 126 6.493 -6.476 10.152 1.00 1.17 H new ATOM 0 HG3 LYS A 126 6.747 -5.150 9.035 1.00 1.17 H new ATOM 0 HD2 LYS A 126 5.185 -3.736 10.215 1.00 0.75 H new ATOM 0 HD3 LYS A 126 4.600 -5.075 11.182 1.00 0.75 H new ATOM 0 HE2 LYS A 126 6.847 -5.302 12.228 1.00 0.91 H new ATOM 0 HE3 LYS A 126 7.433 -3.963 11.260 1.00 0.91 H new ATOM 0 HZ1 LYS A 126 6.858 -3.154 13.402 1.00 1.75 H new ATOM 0 HZ2 LYS A 126 5.695 -2.563 12.315 1.00 1.75 H new ATOM 0 HZ3 LYS A 126 5.315 -3.861 13.341 1.00 1.75 H new ATOM 1932 N ALA A 134 -5.248 -6.428 11.224 1.00 0.68 N ATOM 1933 CA ALA A 134 -5.991 -6.472 9.975 1.00 0.59 C ATOM 1934 C ALA A 134 -6.058 -5.110 9.299 1.00 0.46 C ATOM 1935 O ALA A 134 -5.507 -4.128 9.797 1.00 0.72 O ATOM 1936 CB ALA A 134 -7.389 -7.022 10.221 1.00 0.93 C ATOM 0 HA ALA A 134 -5.459 -7.137 9.295 1.00 0.59 H new ATOM 0 HB1 ALA A 134 -7.939 -7.052 9.280 1.00 0.93 H new ATOM 0 HB2 ALA A 134 -7.317 -8.029 10.631 1.00 0.93 H new ATOM 0 HB3 ALA A 134 -7.914 -6.379 10.928 1.00 0.93 H new ATOM 1942 N ILE A 135 -6.726 -5.070 8.153 1.00 0.49 N ATOM 1943 CA ILE A 135 -6.815 -3.863 7.354 1.00 0.38 C ATOM 1944 C ILE A 135 -8.195 -3.218 7.519 1.00 0.51 C ATOM 1945 O ILE A 135 -9.122 -3.507 6.766 1.00 1.05 O ATOM 1946 CB ILE A 135 -6.540 -4.148 5.864 1.00 0.40 C ATOM 1947 CG1 ILE A 135 -5.184 -4.835 5.702 1.00 0.39 C ATOM 1948 CG2 ILE A 135 -6.569 -2.851 5.066 1.00 0.58 C ATOM 1949 CD1 ILE A 135 -4.792 -5.080 4.262 1.00 0.87 C ATOM 0 H ILE A 135 -7.218 -5.871 7.756 1.00 0.49 H new ATOM 0 HA ILE A 135 -6.050 -3.173 7.710 1.00 0.38 H new ATOM 0 HB ILE A 135 -7.318 -4.810 5.484 1.00 0.40 H new ATOM 0 HG12 ILE A 135 -4.418 -4.223 6.178 1.00 0.39 H new ATOM 0 HG13 ILE A 135 -5.205 -5.788 6.230 1.00 0.39 H new ATOM 0 HG21 ILE A 135 -6.373 -3.066 4.015 1.00 0.58 H new ATOM 0 HG22 ILE A 135 -7.549 -2.385 5.165 1.00 0.58 H new ATOM 0 HG23 ILE A 135 -5.805 -2.173 5.446 1.00 0.58 H new ATOM 0 HD11 ILE A 135 -3.819 -5.570 4.228 1.00 0.87 H new ATOM 0 HD12 ILE A 135 -5.537 -5.718 3.786 1.00 0.87 H new ATOM 0 HD13 ILE A 135 -4.738 -4.129 3.733 1.00 0.87 H new ATOM 1961 N LYS A 136 -8.331 -2.349 8.514 1.00 0.47 N ATOM 1962 CA LYS A 136 -9.634 -1.782 8.865 1.00 0.51 C ATOM 1963 C LYS A 136 -9.686 -0.263 8.677 1.00 0.52 C ATOM 1964 O LYS A 136 -10.452 0.426 9.351 1.00 0.84 O ATOM 1965 CB LYS A 136 -9.991 -2.149 10.307 1.00 0.60 C ATOM 1966 CG LYS A 136 -8.838 -1.984 11.282 1.00 0.67 C ATOM 1967 CD LYS A 136 -9.265 -2.292 12.705 1.00 0.90 C ATOM 1968 CE LYS A 136 -8.067 -2.360 13.633 1.00 1.05 C ATOM 1969 NZ LYS A 136 -8.469 -2.527 15.056 1.00 1.50 N ATOM 0 H LYS A 136 -7.558 -2.020 9.093 1.00 0.47 H new ATOM 0 HA LYS A 136 -10.367 -2.211 8.182 1.00 0.51 H new ATOM 0 HB2 LYS A 136 -10.824 -1.528 10.635 1.00 0.60 H new ATOM 0 HB3 LYS A 136 -10.334 -3.183 10.335 1.00 0.60 H new ATOM 0 HG2 LYS A 136 -8.020 -2.645 10.995 1.00 0.67 H new ATOM 0 HG3 LYS A 136 -8.457 -0.964 11.228 1.00 0.67 H new ATOM 0 HD2 LYS A 136 -9.956 -1.525 13.054 1.00 0.90 H new ATOM 0 HD3 LYS A 136 -9.802 -3.240 12.730 1.00 0.90 H new ATOM 0 HE2 LYS A 136 -7.427 -3.192 13.338 1.00 1.05 H new ATOM 0 HE3 LYS A 136 -7.476 -1.450 13.528 1.00 1.05 H new ATOM 0 HZ1 LYS A 136 -7.619 -2.569 15.654 1.00 1.50 H new ATOM 0 HZ2 LYS A 136 -9.058 -1.721 15.347 1.00 1.50 H new ATOM 0 HZ3 LYS A 136 -9.011 -3.408 15.163 1.00 1.50 H new ATOM 1983 N TRP A 137 -8.888 0.251 7.754 1.00 0.38 N ATOM 1984 CA TRP A 137 -8.860 1.682 7.454 1.00 0.37 C ATOM 1985 C TRP A 137 -8.398 1.959 6.031 1.00 0.32 C ATOM 1986 O TRP A 137 -7.933 1.068 5.334 1.00 0.33 O ATOM 1987 CB TRP A 137 -7.988 2.515 8.427 1.00 0.42 C ATOM 1988 CG TRP A 137 -6.878 1.812 9.144 1.00 0.30 C ATOM 1989 CD1 TRP A 137 -6.353 2.206 10.345 1.00 0.37 C ATOM 1990 CD2 TRP A 137 -6.139 0.649 8.752 1.00 0.35 C ATOM 1991 NE1 TRP A 137 -5.379 1.345 10.735 1.00 0.32 N ATOM 1992 CE2 TRP A 137 -5.219 0.399 9.777 1.00 0.41 C ATOM 1993 CE3 TRP A 137 -6.158 -0.213 7.648 1.00 0.54 C ATOM 1994 CZ2 TRP A 137 -4.344 -0.651 9.749 1.00 0.66 C ATOM 1995 CZ3 TRP A 137 -5.268 -1.260 7.625 1.00 0.81 C ATOM 1996 CH2 TRP A 137 -4.368 -1.471 8.667 1.00 0.87 C ATOM 0 H TRP A 137 -8.243 -0.305 7.192 1.00 0.38 H new ATOM 0 HA TRP A 137 -9.896 1.998 7.579 1.00 0.37 H new ATOM 0 HB2 TRP A 137 -7.553 3.341 7.864 1.00 0.42 H new ATOM 0 HB3 TRP A 137 -8.647 2.953 9.177 1.00 0.42 H new ATOM 0 HD1 TRP A 137 -6.668 3.076 10.902 1.00 0.37 H new ATOM 0 HE1 TRP A 137 -4.853 1.401 11.607 1.00 0.32 H new ATOM 0 HE3 TRP A 137 -6.854 -0.059 6.836 1.00 0.54 H new ATOM 0 HZ2 TRP A 137 -3.655 -0.823 10.563 1.00 0.66 H new ATOM 0 HZ3 TRP A 137 -5.266 -1.934 6.781 1.00 0.81 H new ATOM 0 HH2 TRP A 137 -3.678 -2.300 8.613 1.00 0.87 H new ATOM 2007 N ASN A 138 -8.565 3.216 5.643 1.00 0.33 N ATOM 2008 CA ASN A 138 -8.123 3.789 4.361 1.00 0.33 C ATOM 2009 C ASN A 138 -6.650 3.513 4.045 1.00 0.27 C ATOM 2010 O ASN A 138 -6.059 2.594 4.587 1.00 0.26 O ATOM 2011 CB ASN A 138 -8.388 5.289 4.350 1.00 0.40 C ATOM 2012 CG ASN A 138 -9.798 5.604 4.811 1.00 1.09 C ATOM 2013 OD1 ASN A 138 -10.024 5.895 5.985 1.00 1.80 O ATOM 2014 ND2 ASN A 138 -10.756 5.496 3.902 1.00 1.17 N ATOM 0 H ASN A 138 -9.033 3.903 6.235 1.00 0.33 H new ATOM 0 HA ASN A 138 -8.702 3.296 3.580 1.00 0.33 H new ATOM 0 HB2 ASN A 138 -7.670 5.792 4.998 1.00 0.40 H new ATOM 0 HB3 ASN A 138 -8.237 5.680 3.344 1.00 0.40 H new ATOM 0 HD21 ASN A 138 -11.728 5.657 4.164 1.00 1.17 H new ATOM 0 HD22 ASN A 138 -10.521 5.252 2.940 1.00 1.17 H new ATOM 2021 N PHE A 139 -6.069 4.383 3.205 1.00 0.27 N ATOM 2022 CA PHE A 139 -4.776 4.181 2.523 1.00 0.26 C ATOM 2023 C PHE A 139 -3.835 3.218 3.239 1.00 0.22 C ATOM 2024 O PHE A 139 -3.451 2.245 2.639 1.00 0.30 O ATOM 2025 CB PHE A 139 -4.098 5.541 2.467 1.00 0.29 C ATOM 2026 CG PHE A 139 -4.757 6.509 1.530 1.00 0.59 C ATOM 2027 CD1 PHE A 139 -5.935 7.145 1.884 1.00 0.75 C ATOM 2028 CD2 PHE A 139 -4.201 6.777 0.291 1.00 0.89 C ATOM 2029 CE1 PHE A 139 -6.546 8.031 1.023 1.00 1.12 C ATOM 2030 CE2 PHE A 139 -4.809 7.663 -0.577 1.00 1.28 C ATOM 2031 CZ PHE A 139 -5.984 8.291 -0.210 1.00 1.37 C ATOM 0 H PHE A 139 -6.499 5.278 2.972 1.00 0.27 H new ATOM 0 HA PHE A 139 -4.980 3.744 1.545 1.00 0.26 H new ATOM 0 HB2 PHE A 139 -4.085 5.971 3.468 1.00 0.29 H new ATOM 0 HB3 PHE A 139 -3.060 5.406 2.164 1.00 0.29 H new ATOM 0 HD1 PHE A 139 -6.381 6.944 2.847 1.00 0.75 H new ATOM 0 HD2 PHE A 139 -3.283 6.289 0.000 1.00 0.89 H new ATOM 0 HE1 PHE A 139 -7.464 8.521 1.313 1.00 1.12 H new ATOM 0 HE2 PHE A 139 -4.367 7.865 -1.541 1.00 1.28 H new ATOM 0 HZ PHE A 139 -6.461 8.984 -0.887 1.00 1.37 H new ATOM 2041 N THR A 140 -3.482 3.481 4.489 1.00 0.22 N ATOM 2042 CA THR A 140 -2.630 2.580 5.277 1.00 0.21 C ATOM 2043 C THR A 140 -1.515 1.931 4.456 1.00 0.19 C ATOM 2044 O THR A 140 -1.692 0.876 3.845 1.00 0.22 O ATOM 2045 CB THR A 140 -3.440 1.453 5.921 1.00 0.23 C ATOM 2046 OG1 THR A 140 -4.558 2.003 6.608 1.00 0.30 O ATOM 2047 CG2 THR A 140 -2.572 0.658 6.886 1.00 0.28 C ATOM 0 H THR A 140 -3.773 4.320 4.991 1.00 0.22 H new ATOM 0 HA THR A 140 -2.186 3.220 6.039 1.00 0.21 H new ATOM 0 HB THR A 140 -3.792 0.779 5.140 1.00 0.23 H new ATOM 0 HG1 THR A 140 -4.896 1.351 7.257 1.00 0.30 H new ATOM 0 HG21 THR A 140 -3.164 -0.140 7.335 1.00 0.28 H new ATOM 0 HG22 THR A 140 -1.730 0.225 6.346 1.00 0.28 H new ATOM 0 HG23 THR A 140 -2.200 1.318 7.669 1.00 0.28 H new ATOM 2055 N SER A 141 -0.359 2.525 4.472 1.00 0.18 N ATOM 2056 CA SER A 141 0.733 2.009 3.675 1.00 0.17 C ATOM 2057 C SER A 141 1.475 0.894 4.399 1.00 0.17 C ATOM 2058 O SER A 141 1.514 0.854 5.625 1.00 0.22 O ATOM 2059 CB SER A 141 1.711 3.131 3.368 1.00 0.21 C ATOM 2060 OG SER A 141 2.016 3.872 4.539 1.00 0.80 O ATOM 0 H SER A 141 -0.141 3.358 5.019 1.00 0.18 H new ATOM 0 HA SER A 141 0.313 1.604 2.754 1.00 0.17 H new ATOM 0 HB2 SER A 141 2.627 2.716 2.947 1.00 0.21 H new ATOM 0 HB3 SER A 141 1.286 3.793 2.614 1.00 0.21 H new ATOM 0 HG SER A 141 1.591 4.754 4.488 1.00 0.80 H new ATOM 2066 N PHE A 142 2.068 -0.006 3.637 1.00 0.17 N ATOM 2067 CA PHE A 142 3.053 -0.917 4.187 1.00 0.17 C ATOM 2068 C PHE A 142 4.420 -0.435 3.768 1.00 0.23 C ATOM 2069 O PHE A 142 4.637 -0.088 2.617 1.00 0.53 O ATOM 2070 CB PHE A 142 2.905 -2.348 3.682 1.00 0.17 C ATOM 2071 CG PHE A 142 1.768 -3.141 4.244 1.00 0.16 C ATOM 2072 CD1 PHE A 142 0.472 -2.683 4.076 1.00 0.23 C ATOM 2073 CD2 PHE A 142 1.982 -4.297 4.973 1.00 0.20 C ATOM 2074 CE1 PHE A 142 -0.592 -3.365 4.618 1.00 0.29 C ATOM 2075 CE2 PHE A 142 0.919 -4.981 5.524 1.00 0.26 C ATOM 2076 CZ PHE A 142 -0.296 -4.706 5.220 1.00 0.28 C ATOM 0 H PHE A 142 1.886 -0.125 2.641 1.00 0.17 H new ATOM 0 HA PHE A 142 2.911 -0.927 5.268 1.00 0.17 H new ATOM 0 HB2 PHE A 142 2.796 -2.317 2.598 1.00 0.17 H new ATOM 0 HB3 PHE A 142 3.831 -2.882 3.895 1.00 0.17 H new ATOM 0 HD1 PHE A 142 0.295 -1.779 3.512 1.00 0.23 H new ATOM 0 HD2 PHE A 142 2.988 -4.666 5.111 1.00 0.20 H new ATOM 0 HE1 PHE A 142 -1.591 -2.955 4.610 1.00 0.29 H new ATOM 0 HE2 PHE A 142 1.116 -5.772 6.233 1.00 0.26 H new ATOM 0 HZ PHE A 142 -1.086 -5.422 5.393 1.00 0.28 H new ATOM 2086 N LEU A 143 5.340 -0.413 4.683 1.00 0.14 N ATOM 2087 CA LEU A 143 6.677 0.001 4.361 1.00 0.14 C ATOM 2088 C LEU A 143 7.423 -1.167 3.751 1.00 0.13 C ATOM 2089 O LEU A 143 7.809 -2.103 4.447 1.00 0.13 O ATOM 2090 CB LEU A 143 7.347 0.501 5.622 1.00 0.16 C ATOM 2091 CG LEU A 143 8.837 0.809 5.519 1.00 0.19 C ATOM 2092 CD1 LEU A 143 9.067 2.101 4.759 1.00 0.37 C ATOM 2093 CD2 LEU A 143 9.456 0.879 6.904 1.00 0.51 C ATOM 0 H LEU A 143 5.193 -0.676 5.658 1.00 0.14 H new ATOM 0 HA LEU A 143 6.672 0.812 3.633 1.00 0.14 H new ATOM 0 HB2 LEU A 143 6.832 1.405 5.947 1.00 0.16 H new ATOM 0 HB3 LEU A 143 7.205 -0.245 6.404 1.00 0.16 H new ATOM 0 HG LEU A 143 9.320 0.004 4.966 1.00 0.19 H new ATOM 0 HD11 LEU A 143 10.137 2.301 4.697 1.00 0.37 H new ATOM 0 HD12 LEU A 143 8.656 2.010 3.753 1.00 0.37 H new ATOM 0 HD13 LEU A 143 8.573 2.922 5.279 1.00 0.37 H new ATOM 0 HD21 LEU A 143 10.520 1.099 6.816 1.00 0.51 H new ATOM 0 HD22 LEU A 143 8.969 1.665 7.481 1.00 0.51 H new ATOM 0 HD23 LEU A 143 9.324 -0.077 7.410 1.00 0.51 H new ATOM 2105 N ILE A 144 7.598 -1.112 2.444 1.00 0.14 N ATOM 2106 CA ILE A 144 8.202 -2.201 1.708 1.00 0.14 C ATOM 2107 C ILE A 144 9.646 -1.843 1.375 1.00 0.15 C ATOM 2108 O ILE A 144 9.912 -0.796 0.791 1.00 0.19 O ATOM 2109 CB ILE A 144 7.411 -2.508 0.406 1.00 0.16 C ATOM 2110 CG1 ILE A 144 5.893 -2.532 0.673 1.00 0.16 C ATOM 2111 CG2 ILE A 144 7.867 -3.835 -0.177 1.00 0.20 C ATOM 2112 CD1 ILE A 144 5.443 -3.537 1.716 1.00 0.16 C ATOM 0 H ILE A 144 7.327 -0.315 1.868 1.00 0.14 H new ATOM 0 HA ILE A 144 8.179 -3.097 2.329 1.00 0.14 H new ATOM 0 HB ILE A 144 7.613 -1.715 -0.314 1.00 0.16 H new ATOM 0 HG12 ILE A 144 5.579 -1.537 0.989 1.00 0.16 H new ATOM 0 HG13 ILE A 144 5.378 -2.747 -0.263 1.00 0.16 H new ATOM 0 HG21 ILE A 144 7.308 -4.043 -1.089 1.00 0.20 H new ATOM 0 HG22 ILE A 144 8.931 -3.785 -0.407 1.00 0.20 H new ATOM 0 HG23 ILE A 144 7.689 -4.631 0.547 1.00 0.20 H new ATOM 0 HD11 ILE A 144 4.361 -3.479 1.834 1.00 0.16 H new ATOM 0 HD12 ILE A 144 5.720 -4.542 1.397 1.00 0.16 H new ATOM 0 HD13 ILE A 144 5.924 -3.313 2.668 1.00 0.16 H new ATOM 2124 N ASP A 145 10.580 -2.690 1.778 1.00 0.15 N ATOM 2125 CA ASP A 145 11.994 -2.389 1.590 1.00 0.17 C ATOM 2126 C ASP A 145 12.435 -2.660 0.151 1.00 0.18 C ATOM 2127 O ASP A 145 11.615 -3.027 -0.692 1.00 0.21 O ATOM 2128 CB ASP A 145 12.858 -3.195 2.559 1.00 0.22 C ATOM 2129 CG ASP A 145 13.126 -4.602 2.070 1.00 0.68 C ATOM 2130 OD1 ASP A 145 12.243 -5.469 2.229 1.00 1.02 O ATOM 2131 OD2 ASP A 145 14.215 -4.849 1.535 1.00 1.30 O ATOM 0 H ASP A 145 10.390 -3.583 2.233 1.00 0.15 H new ATOM 0 HA ASP A 145 12.129 -1.327 1.797 1.00 0.17 H new ATOM 0 HB2 ASP A 145 13.807 -2.680 2.708 1.00 0.22 H new ATOM 0 HB3 ASP A 145 12.363 -3.240 3.529 1.00 0.22 H new ATOM 2136 N ARG A 146 13.733 -2.516 -0.113 1.00 0.21 N ATOM 2137 CA ARG A 146 14.282 -2.651 -1.466 1.00 0.25 C ATOM 2138 C ARG A 146 13.956 -4.013 -2.081 1.00 0.27 C ATOM 2139 O ARG A 146 13.884 -4.153 -3.302 1.00 0.43 O ATOM 2140 CB ARG A 146 15.809 -2.481 -1.449 1.00 0.29 C ATOM 2141 CG ARG A 146 16.300 -1.288 -0.650 1.00 0.46 C ATOM 2142 CD ARG A 146 17.794 -1.064 -0.825 1.00 0.90 C ATOM 2143 NE ARG A 146 18.115 -0.486 -2.130 1.00 1.87 N ATOM 2144 CZ ARG A 146 19.324 -0.041 -2.478 1.00 2.72 C ATOM 2145 NH1 ARG A 146 20.376 -0.256 -1.696 1.00 2.90 N ATOM 2146 NH2 ARG A 146 19.483 0.577 -3.641 1.00 3.78 N ATOM 0 H ARG A 146 14.432 -2.304 0.599 1.00 0.21 H new ATOM 0 HA ARG A 146 13.820 -1.870 -2.070 1.00 0.25 H new ATOM 0 HB2 ARG A 146 16.258 -3.386 -1.040 1.00 0.29 H new ATOM 0 HB3 ARG A 146 16.163 -2.385 -2.476 1.00 0.29 H new ATOM 0 HG2 ARG A 146 15.760 -0.394 -0.963 1.00 0.46 H new ATOM 0 HG3 ARG A 146 16.077 -1.442 0.406 1.00 0.46 H new ATOM 0 HD2 ARG A 146 18.156 -0.403 -0.037 1.00 0.90 H new ATOM 0 HD3 ARG A 146 18.318 -2.013 -0.710 1.00 0.90 H new ATOM 0 HE ARG A 146 17.366 -0.419 -2.819 1.00 1.87 H new ATOM 0 HH11 ARG A 146 20.264 -0.766 -0.820 1.00 2.90 H new ATOM 0 HH12 ARG A 146 21.295 0.089 -1.972 1.00 2.90 H new ATOM 0 HH21 ARG A 146 18.684 0.709 -4.262 1.00 3.78 H new ATOM 0 HH22 ARG A 146 20.404 0.920 -3.914 1.00 3.78 H new ATOM 2160 N ASP A 147 13.748 -5.010 -1.243 1.00 0.19 N ATOM 2161 CA ASP A 147 13.687 -6.380 -1.711 1.00 0.26 C ATOM 2162 C ASP A 147 12.266 -6.909 -1.648 1.00 0.20 C ATOM 2163 O ASP A 147 11.950 -7.954 -2.218 1.00 0.27 O ATOM 2164 CB ASP A 147 14.626 -7.254 -0.887 1.00 0.39 C ATOM 2165 CG ASP A 147 14.924 -8.572 -1.572 1.00 0.66 C ATOM 2166 OD1 ASP A 147 15.355 -8.553 -2.747 1.00 1.18 O ATOM 2167 OD2 ASP A 147 14.748 -9.632 -0.940 1.00 0.85 O ATOM 0 H ASP A 147 13.619 -4.897 -0.238 1.00 0.19 H new ATOM 0 HA ASP A 147 14.007 -6.407 -2.752 1.00 0.26 H new ATOM 0 HB2 ASP A 147 15.559 -6.718 -0.711 1.00 0.39 H new ATOM 0 HB3 ASP A 147 14.180 -7.446 0.089 1.00 0.39 H new ATOM 2172 N GLY A 148 11.408 -6.171 -0.964 1.00 0.18 N ATOM 2173 CA GLY A 148 10.014 -6.526 -0.922 1.00 0.16 C ATOM 2174 C GLY A 148 9.617 -7.264 0.337 1.00 0.16 C ATOM 2175 O GLY A 148 8.913 -8.266 0.275 1.00 0.23 O ATOM 0 H GLY A 148 11.656 -5.333 -0.438 1.00 0.18 H new ATOM 0 HA2 GLY A 148 9.414 -5.620 -1.007 1.00 0.16 H new ATOM 0 HA3 GLY A 148 9.779 -7.147 -1.787 1.00 0.16 H new ATOM 2179 N VAL A 149 10.078 -6.785 1.474 1.00 0.19 N ATOM 2180 CA VAL A 149 9.629 -7.302 2.756 1.00 0.20 C ATOM 2181 C VAL A 149 8.968 -6.179 3.549 1.00 0.18 C ATOM 2182 O VAL A 149 9.535 -5.094 3.688 1.00 0.22 O ATOM 2183 CB VAL A 149 10.793 -7.908 3.573 1.00 0.27 C ATOM 2184 CG1 VAL A 149 10.302 -8.443 4.912 1.00 0.61 C ATOM 2185 CG2 VAL A 149 11.488 -9.008 2.785 1.00 0.62 C ATOM 0 H VAL A 149 10.766 -6.035 1.539 1.00 0.19 H new ATOM 0 HA VAL A 149 8.912 -8.101 2.566 1.00 0.20 H new ATOM 0 HB VAL A 149 11.513 -7.113 3.768 1.00 0.27 H new ATOM 0 HG11 VAL A 149 11.141 -8.863 5.466 1.00 0.61 H new ATOM 0 HG12 VAL A 149 9.858 -7.631 5.488 1.00 0.61 H new ATOM 0 HG13 VAL A 149 9.555 -9.218 4.742 1.00 0.61 H new ATOM 0 HG21 VAL A 149 12.304 -9.421 3.378 1.00 0.62 H new ATOM 0 HG22 VAL A 149 10.773 -9.797 2.553 1.00 0.62 H new ATOM 0 HG23 VAL A 149 11.886 -8.595 1.858 1.00 0.62 H new ATOM 2195 N PRO A 150 7.741 -6.407 4.041 1.00 0.18 N ATOM 2196 CA PRO A 150 7.017 -5.417 4.833 1.00 0.19 C ATOM 2197 C PRO A 150 7.681 -5.195 6.187 1.00 0.19 C ATOM 2198 O PRO A 150 7.690 -6.085 7.037 1.00 0.30 O ATOM 2199 CB PRO A 150 5.618 -6.023 5.017 1.00 0.24 C ATOM 2200 CG PRO A 150 5.554 -7.197 4.094 1.00 0.26 C ATOM 2201 CD PRO A 150 6.969 -7.645 3.871 1.00 0.23 C ATOM 0 HA PRO A 150 6.995 -4.443 4.344 1.00 0.19 H new ATOM 0 HB2 PRO A 150 5.458 -6.330 6.051 1.00 0.24 H new ATOM 0 HB3 PRO A 150 4.843 -5.295 4.777 1.00 0.24 H new ATOM 0 HG2 PRO A 150 4.958 -7.999 4.528 1.00 0.26 H new ATOM 0 HG3 PRO A 150 5.081 -6.923 3.151 1.00 0.26 H new ATOM 0 HD2 PRO A 150 7.268 -8.408 4.589 1.00 0.23 H new ATOM 0 HD3 PRO A 150 7.105 -8.072 2.877 1.00 0.23 H new ATOM 2209 N VAL A 151 8.248 -4.014 6.376 1.00 0.15 N ATOM 2210 CA VAL A 151 8.935 -3.681 7.614 1.00 0.17 C ATOM 2211 C VAL A 151 8.006 -2.951 8.568 1.00 0.18 C ATOM 2212 O VAL A 151 8.191 -3.006 9.778 1.00 0.27 O ATOM 2213 CB VAL A 151 10.186 -2.812 7.346 1.00 0.21 C ATOM 2214 CG1 VAL A 151 11.005 -2.625 8.614 1.00 0.27 C ATOM 2215 CG2 VAL A 151 11.039 -3.424 6.244 1.00 0.23 C ATOM 0 H VAL A 151 8.246 -3.266 5.683 1.00 0.15 H new ATOM 0 HA VAL A 151 9.252 -4.619 8.071 1.00 0.17 H new ATOM 0 HB VAL A 151 9.847 -1.830 7.016 1.00 0.21 H new ATOM 0 HG11 VAL A 151 11.878 -2.010 8.396 1.00 0.27 H new ATOM 0 HG12 VAL A 151 10.395 -2.133 9.372 1.00 0.27 H new ATOM 0 HG13 VAL A 151 11.329 -3.597 8.984 1.00 0.27 H new ATOM 0 HG21 VAL A 151 11.914 -2.797 6.071 1.00 0.23 H new ATOM 0 HG22 VAL A 151 11.360 -4.421 6.544 1.00 0.23 H new ATOM 0 HG23 VAL A 151 10.454 -3.492 5.327 1.00 0.23 H new ATOM 2225 N GLU A 152 7.004 -2.278 8.021 1.00 0.17 N ATOM 2226 CA GLU A 152 6.022 -1.567 8.836 1.00 0.18 C ATOM 2227 C GLU A 152 4.675 -1.497 8.131 1.00 0.16 C ATOM 2228 O GLU A 152 4.576 -1.755 6.936 1.00 0.17 O ATOM 2229 CB GLU A 152 6.484 -0.140 9.160 1.00 0.26 C ATOM 2230 CG GLU A 152 7.586 -0.050 10.206 1.00 0.48 C ATOM 2231 CD GLU A 152 7.190 -0.654 11.543 1.00 0.66 C ATOM 2232 OE1 GLU A 152 5.984 -0.914 11.765 1.00 1.05 O ATOM 2233 OE2 GLU A 152 8.086 -0.884 12.381 1.00 1.22 O ATOM 0 H GLU A 152 6.847 -2.208 7.016 1.00 0.17 H new ATOM 0 HA GLU A 152 5.921 -2.128 9.765 1.00 0.18 H new ATOM 0 HB2 GLU A 152 6.834 0.331 8.242 1.00 0.26 H new ATOM 0 HB3 GLU A 152 5.625 0.435 9.506 1.00 0.26 H new ATOM 0 HG2 GLU A 152 8.475 -0.559 9.833 1.00 0.48 H new ATOM 0 HG3 GLU A 152 7.855 0.996 10.352 1.00 0.48 H new ATOM 2240 N ARG A 153 3.645 -1.174 8.893 1.00 0.20 N ATOM 2241 CA ARG A 153 2.339 -0.854 8.342 1.00 0.22 C ATOM 2242 C ARG A 153 1.859 0.462 8.952 1.00 0.22 C ATOM 2243 O ARG A 153 1.325 0.484 10.061 1.00 0.29 O ATOM 2244 CB ARG A 153 1.322 -1.971 8.638 1.00 0.28 C ATOM 2245 CG ARG A 153 0.005 -1.811 7.887 1.00 0.32 C ATOM 2246 CD ARG A 153 -1.060 -2.802 8.354 1.00 0.47 C ATOM 2247 NE ARG A 153 -0.562 -4.172 8.423 1.00 0.73 N ATOM 2248 CZ ARG A 153 -1.310 -5.218 8.775 1.00 1.34 C ATOM 2249 NH1 ARG A 153 -2.611 -5.075 8.994 1.00 1.72 N ATOM 2250 NH2 ARG A 153 -0.752 -6.411 8.910 1.00 1.75 N ATOM 0 H ARG A 153 3.690 -1.126 9.911 1.00 0.20 H new ATOM 0 HA ARG A 153 2.424 -0.760 7.259 1.00 0.22 H new ATOM 0 HB2 ARG A 153 1.765 -2.932 8.378 1.00 0.28 H new ATOM 0 HB3 ARG A 153 1.120 -1.993 9.709 1.00 0.28 H new ATOM 0 HG2 ARG A 153 -0.365 -0.795 8.022 1.00 0.32 H new ATOM 0 HG3 ARG A 153 0.180 -1.947 6.820 1.00 0.32 H new ATOM 0 HD2 ARG A 153 -1.424 -2.502 9.337 1.00 0.47 H new ATOM 0 HD3 ARG A 153 -1.911 -2.763 7.674 1.00 0.47 H new ATOM 0 HE ARG A 153 0.416 -4.339 8.188 1.00 0.73 H new ATOM 0 HH11 ARG A 153 -3.047 -4.159 8.893 1.00 1.72 H new ATOM 0 HH12 ARG A 153 -3.175 -5.882 9.263 1.00 1.72 H new ATOM 0 HH21 ARG A 153 0.248 -6.528 8.745 1.00 1.75 H new ATOM 0 HH22 ARG A 153 -1.322 -7.213 9.179 1.00 1.75 H new ATOM 2264 N PHE A 154 2.069 1.552 8.230 1.00 0.21 N ATOM 2265 CA PHE A 154 1.642 2.870 8.681 1.00 0.22 C ATOM 2266 C PHE A 154 0.219 3.130 8.211 1.00 0.26 C ATOM 2267 O PHE A 154 -0.001 3.344 7.022 1.00 0.38 O ATOM 2268 CB PHE A 154 2.532 3.983 8.100 1.00 0.24 C ATOM 2269 CG PHE A 154 4.019 3.841 8.308 1.00 0.20 C ATOM 2270 CD1 PHE A 154 4.786 3.108 7.417 1.00 0.24 C ATOM 2271 CD2 PHE A 154 4.659 4.487 9.359 1.00 0.20 C ATOM 2272 CE1 PHE A 154 6.156 3.018 7.569 1.00 0.25 C ATOM 2273 CE2 PHE A 154 6.034 4.392 9.517 1.00 0.22 C ATOM 2274 CZ PHE A 154 6.779 3.658 8.618 1.00 0.23 C ATOM 0 H PHE A 154 2.536 1.550 7.323 1.00 0.21 H new ATOM 0 HA PHE A 154 1.712 2.881 9.769 1.00 0.22 H new ATOM 0 HB2 PHE A 154 2.343 4.045 7.028 1.00 0.24 H new ATOM 0 HB3 PHE A 154 2.217 4.932 8.534 1.00 0.24 H new ATOM 0 HD1 PHE A 154 4.307 2.600 6.593 1.00 0.24 H new ATOM 0 HD2 PHE A 154 4.080 5.069 10.060 1.00 0.20 H new ATOM 0 HE1 PHE A 154 6.740 2.445 6.864 1.00 0.25 H new ATOM 0 HE2 PHE A 154 6.520 4.892 10.342 1.00 0.22 H new ATOM 0 HZ PHE A 154 7.850 3.585 8.736 1.00 0.23 H new ATOM 2284 N SER A 155 -0.744 3.125 9.123 1.00 0.26 N ATOM 2285 CA SER A 155 -2.113 3.445 8.769 1.00 0.28 C ATOM 2286 C SER A 155 -2.185 4.902 8.273 1.00 0.29 C ATOM 2287 O SER A 155 -1.235 5.665 8.453 1.00 0.34 O ATOM 2288 CB SER A 155 -2.999 3.193 9.990 1.00 0.37 C ATOM 2289 OG SER A 155 -2.629 4.025 11.078 1.00 0.99 O ATOM 0 H SER A 155 -0.600 2.903 10.108 1.00 0.26 H new ATOM 0 HA SER A 155 -2.472 2.813 7.956 1.00 0.28 H new ATOM 0 HB2 SER A 155 -4.041 3.375 9.729 1.00 0.37 H new ATOM 0 HB3 SER A 155 -2.923 2.147 10.287 1.00 0.37 H new ATOM 0 HG SER A 155 -3.214 3.843 11.843 1.00 0.99 H new ATOM 2295 N PRO A 156 -3.314 5.321 7.650 1.00 0.33 N ATOM 2296 CA PRO A 156 -3.373 6.557 6.853 1.00 0.42 C ATOM 2297 C PRO A 156 -3.218 7.794 7.706 1.00 0.47 C ATOM 2298 O PRO A 156 -3.075 8.898 7.198 1.00 0.66 O ATOM 2299 CB PRO A 156 -4.771 6.538 6.224 1.00 0.48 C ATOM 2300 CG PRO A 156 -5.326 5.186 6.505 1.00 0.48 C ATOM 2301 CD PRO A 156 -4.629 4.677 7.727 1.00 0.34 C ATOM 0 HA PRO A 156 -2.565 6.592 6.122 1.00 0.42 H new ATOM 0 HB2 PRO A 156 -5.403 7.316 6.652 1.00 0.48 H new ATOM 0 HB3 PRO A 156 -4.719 6.724 5.151 1.00 0.48 H new ATOM 0 HG2 PRO A 156 -6.403 5.236 6.667 1.00 0.48 H new ATOM 0 HG3 PRO A 156 -5.162 4.518 5.660 1.00 0.48 H new ATOM 0 HD2 PRO A 156 -5.160 4.952 8.638 1.00 0.34 H new ATOM 0 HD3 PRO A 156 -4.547 3.590 7.721 1.00 0.34 H new ATOM 2309 N GLY A 157 -3.246 7.575 9.003 1.00 0.40 N ATOM 2310 CA GLY A 157 -3.126 8.651 9.959 1.00 0.48 C ATOM 2311 C GLY A 157 -1.678 9.012 10.225 1.00 0.42 C ATOM 2312 O GLY A 157 -1.385 9.921 11.006 1.00 0.52 O ATOM 0 H GLY A 157 -3.352 6.651 9.421 1.00 0.40 H new ATOM 0 HA2 GLY A 157 -3.656 9.528 9.587 1.00 0.48 H new ATOM 0 HA3 GLY A 157 -3.606 8.361 10.894 1.00 0.48 H new ATOM 2316 N ALA A 158 -0.770 8.288 9.584 1.00 0.37 N ATOM 2317 CA ALA A 158 0.655 8.552 9.712 1.00 0.33 C ATOM 2318 C ALA A 158 1.097 9.590 8.690 1.00 0.30 C ATOM 2319 O ALA A 158 0.678 9.557 7.530 1.00 0.43 O ATOM 2320 CB ALA A 158 1.450 7.266 9.542 1.00 0.40 C ATOM 0 H ALA A 158 -0.998 7.509 8.967 1.00 0.37 H new ATOM 0 HA ALA A 158 0.846 8.947 10.710 1.00 0.33 H new ATOM 0 HB1 ALA A 158 2.514 7.480 9.640 1.00 0.40 H new ATOM 0 HB2 ALA A 158 1.152 6.550 10.308 1.00 0.40 H new ATOM 0 HB3 ALA A 158 1.254 6.845 8.556 1.00 0.40 H new ATOM 2326 N SER A 159 1.939 10.512 9.122 1.00 0.28 N ATOM 2327 CA SER A 159 2.395 11.585 8.264 1.00 0.36 C ATOM 2328 C SER A 159 3.673 11.180 7.533 1.00 0.28 C ATOM 2329 O SER A 159 4.252 10.130 7.825 1.00 0.25 O ATOM 2330 CB SER A 159 2.642 12.837 9.102 1.00 0.50 C ATOM 2331 OG SER A 159 1.898 12.787 10.310 1.00 1.25 O ATOM 0 H SER A 159 2.321 10.537 10.067 1.00 0.28 H new ATOM 0 HA SER A 159 1.627 11.794 7.519 1.00 0.36 H new ATOM 0 HB2 SER A 159 3.705 12.926 9.327 1.00 0.50 H new ATOM 0 HB3 SER A 159 2.361 13.723 8.533 1.00 0.50 H new ATOM 0 HG SER A 159 2.431 12.347 11.005 1.00 1.25 H new ATOM 2337 N VAL A 160 4.113 12.014 6.596 1.00 0.29 N ATOM 2338 CA VAL A 160 5.324 11.743 5.824 1.00 0.28 C ATOM 2339 C VAL A 160 6.503 11.434 6.743 1.00 0.26 C ATOM 2340 O VAL A 160 7.231 10.459 6.543 1.00 0.25 O ATOM 2341 CB VAL A 160 5.692 12.948 4.933 1.00 0.34 C ATOM 2342 CG1 VAL A 160 6.885 12.626 4.044 1.00 0.41 C ATOM 2343 CG2 VAL A 160 4.499 13.379 4.094 1.00 0.38 C ATOM 0 H VAL A 160 3.647 12.888 6.351 1.00 0.29 H new ATOM 0 HA VAL A 160 5.117 10.876 5.197 1.00 0.28 H new ATOM 0 HB VAL A 160 5.971 13.776 5.585 1.00 0.34 H new ATOM 0 HG11 VAL A 160 7.123 13.492 3.427 1.00 0.41 H new ATOM 0 HG12 VAL A 160 7.745 12.376 4.665 1.00 0.41 H new ATOM 0 HG13 VAL A 160 6.643 11.779 3.402 1.00 0.41 H new ATOM 0 HG21 VAL A 160 4.779 14.230 3.473 1.00 0.38 H new ATOM 0 HG22 VAL A 160 4.185 12.552 3.457 1.00 0.38 H new ATOM 0 HG23 VAL A 160 3.677 13.664 4.750 1.00 0.38 H new ATOM 2353 N LYS A 161 6.638 12.242 7.783 1.00 0.29 N ATOM 2354 CA LYS A 161 7.760 12.156 8.704 1.00 0.33 C ATOM 2355 C LYS A 161 7.720 10.849 9.487 1.00 0.29 C ATOM 2356 O LYS A 161 8.755 10.222 9.727 1.00 0.29 O ATOM 2357 CB LYS A 161 7.714 13.346 9.662 1.00 0.44 C ATOM 2358 CG LYS A 161 8.824 13.350 10.704 1.00 1.11 C ATOM 2359 CD LYS A 161 8.548 14.364 11.807 1.00 1.81 C ATOM 2360 CE LYS A 161 7.233 14.068 12.516 1.00 2.69 C ATOM 2361 NZ LYS A 161 6.981 14.991 13.655 1.00 3.44 N ATOM 0 H LYS A 161 5.970 12.978 8.013 1.00 0.29 H new ATOM 0 HA LYS A 161 8.689 12.178 8.135 1.00 0.33 H new ATOM 0 HB2 LYS A 161 7.771 14.267 9.082 1.00 0.44 H new ATOM 0 HB3 LYS A 161 6.751 13.350 10.173 1.00 0.44 H new ATOM 0 HG2 LYS A 161 8.921 12.355 11.138 1.00 1.11 H new ATOM 0 HG3 LYS A 161 9.775 13.582 10.224 1.00 1.11 H new ATOM 0 HD2 LYS A 161 9.364 14.350 12.529 1.00 1.81 H new ATOM 0 HD3 LYS A 161 8.516 15.367 11.382 1.00 1.81 H new ATOM 0 HE2 LYS A 161 6.413 14.145 11.802 1.00 2.69 H new ATOM 0 HE3 LYS A 161 7.243 13.041 12.880 1.00 2.69 H new ATOM 0 HZ1 LYS A 161 6.075 14.749 14.104 1.00 3.44 H new ATOM 0 HZ2 LYS A 161 7.748 14.900 14.352 1.00 3.44 H new ATOM 0 HZ3 LYS A 161 6.944 15.970 13.307 1.00 3.44 H new ATOM 2375 N ASP A 162 6.511 10.438 9.856 1.00 0.28 N ATOM 2376 CA ASP A 162 6.307 9.219 10.624 1.00 0.28 C ATOM 2377 C ASP A 162 6.777 8.019 9.825 1.00 0.22 C ATOM 2378 O ASP A 162 7.257 7.033 10.378 1.00 0.23 O ATOM 2379 CB ASP A 162 4.830 9.048 10.981 1.00 0.34 C ATOM 2380 CG ASP A 162 4.301 10.148 11.879 1.00 1.02 C ATOM 2381 OD1 ASP A 162 4.705 10.207 13.058 1.00 1.30 O ATOM 2382 OD2 ASP A 162 3.477 10.958 11.408 1.00 1.86 O ATOM 0 H ASP A 162 5.651 10.939 9.632 1.00 0.28 H new ATOM 0 HA ASP A 162 6.885 9.292 11.545 1.00 0.28 H new ATOM 0 HB2 ASP A 162 4.242 9.023 10.064 1.00 0.34 H new ATOM 0 HB3 ASP A 162 4.691 8.086 11.475 1.00 0.34 H new ATOM 2387 N ILE A 163 6.634 8.115 8.512 1.00 0.19 N ATOM 2388 CA ILE A 163 7.059 7.055 7.623 1.00 0.17 C ATOM 2389 C ILE A 163 8.552 7.148 7.329 1.00 0.17 C ATOM 2390 O ILE A 163 9.258 6.139 7.358 1.00 0.18 O ATOM 2391 CB ILE A 163 6.254 7.069 6.307 1.00 0.17 C ATOM 2392 CG1 ILE A 163 4.770 6.848 6.619 1.00 0.18 C ATOM 2393 CG2 ILE A 163 6.779 6.005 5.356 1.00 0.20 C ATOM 2394 CD1 ILE A 163 3.876 6.813 5.402 1.00 0.21 C ATOM 0 H ILE A 163 6.224 8.922 8.041 1.00 0.19 H new ATOM 0 HA ILE A 163 6.866 6.110 8.131 1.00 0.17 H new ATOM 0 HB ILE A 163 6.369 8.036 5.818 1.00 0.17 H new ATOM 0 HG12 ILE A 163 4.661 5.909 7.162 1.00 0.18 H new ATOM 0 HG13 ILE A 163 4.429 7.642 7.283 1.00 0.18 H new ATOM 0 HG21 ILE A 163 6.202 6.026 4.432 1.00 0.20 H new ATOM 0 HG22 ILE A 163 7.828 6.201 5.133 1.00 0.20 H new ATOM 0 HG23 ILE A 163 6.684 5.023 5.820 1.00 0.20 H new ATOM 0 HD11 ILE A 163 2.844 6.653 5.713 1.00 0.21 H new ATOM 0 HD12 ILE A 163 3.951 7.760 4.868 1.00 0.21 H new ATOM 0 HD13 ILE A 163 4.187 6.001 4.745 1.00 0.21 H new ATOM 2406 N GLU A 164 9.036 8.361 7.079 1.00 0.19 N ATOM 2407 CA GLU A 164 10.427 8.568 6.694 1.00 0.22 C ATOM 2408 C GLU A 164 11.415 7.984 7.696 1.00 0.23 C ATOM 2409 O GLU A 164 12.458 7.465 7.299 1.00 0.24 O ATOM 2410 CB GLU A 164 10.736 10.050 6.511 1.00 0.27 C ATOM 2411 CG GLU A 164 10.199 10.649 5.227 1.00 0.33 C ATOM 2412 CD GLU A 164 10.756 12.033 4.984 1.00 0.44 C ATOM 2413 OE1 GLU A 164 11.933 12.150 4.586 1.00 0.73 O ATOM 2414 OE2 GLU A 164 10.009 13.015 5.186 1.00 0.88 O ATOM 0 H GLU A 164 8.484 9.217 7.136 1.00 0.19 H new ATOM 0 HA GLU A 164 10.548 8.041 5.748 1.00 0.22 H new ATOM 0 HB2 GLU A 164 10.322 10.602 7.355 1.00 0.27 H new ATOM 0 HB3 GLU A 164 11.817 10.189 6.538 1.00 0.27 H new ATOM 0 HG2 GLU A 164 10.453 10.001 4.388 1.00 0.33 H new ATOM 0 HG3 GLU A 164 9.111 10.697 5.274 1.00 0.33 H new ATOM 2421 N GLU A 165 11.101 8.065 8.983 1.00 0.24 N ATOM 2422 CA GLU A 165 12.014 7.564 10.008 1.00 0.27 C ATOM 2423 C GLU A 165 12.296 6.076 9.831 1.00 0.27 C ATOM 2424 O GLU A 165 13.355 5.584 10.230 1.00 0.35 O ATOM 2425 CB GLU A 165 11.490 7.838 11.416 1.00 0.33 C ATOM 2426 CG GLU A 165 10.027 7.514 11.629 1.00 0.41 C ATOM 2427 CD GLU A 165 9.648 7.603 13.090 1.00 0.58 C ATOM 2428 OE1 GLU A 165 9.730 8.709 13.665 1.00 0.75 O ATOM 2429 OE2 GLU A 165 9.297 6.561 13.683 1.00 0.71 O ATOM 0 H GLU A 165 10.234 8.467 9.341 1.00 0.24 H new ATOM 0 HA GLU A 165 12.951 8.107 9.883 1.00 0.27 H new ATOM 0 HB2 GLU A 165 12.082 7.260 12.126 1.00 0.33 H new ATOM 0 HB3 GLU A 165 11.651 8.891 11.649 1.00 0.33 H new ATOM 0 HG2 GLU A 165 9.412 8.203 11.050 1.00 0.41 H new ATOM 0 HG3 GLU A 165 9.817 6.511 11.258 1.00 0.41 H new ATOM 2436 N LYS A 166 11.364 5.365 9.219 1.00 0.22 N ATOM 2437 CA LYS A 166 11.540 3.944 8.964 1.00 0.23 C ATOM 2438 C LYS A 166 11.922 3.715 7.504 1.00 0.20 C ATOM 2439 O LYS A 166 12.447 2.665 7.140 1.00 0.25 O ATOM 2440 CB LYS A 166 10.252 3.181 9.284 1.00 0.27 C ATOM 2441 CG LYS A 166 9.647 3.509 10.642 1.00 0.46 C ATOM 2442 CD LYS A 166 10.611 3.232 11.782 1.00 0.77 C ATOM 2443 CE LYS A 166 9.921 3.377 13.129 1.00 1.05 C ATOM 2444 NZ LYS A 166 10.868 3.205 14.261 1.00 1.58 N ATOM 0 H LYS A 166 10.478 5.748 8.889 1.00 0.22 H new ATOM 0 HA LYS A 166 12.340 3.575 9.606 1.00 0.23 H new ATOM 0 HB2 LYS A 166 9.515 3.396 8.510 1.00 0.27 H new ATOM 0 HB3 LYS A 166 10.457 2.111 9.240 1.00 0.27 H new ATOM 0 HG2 LYS A 166 9.354 4.559 10.663 1.00 0.46 H new ATOM 0 HG3 LYS A 166 8.740 2.922 10.785 1.00 0.46 H new ATOM 0 HD2 LYS A 166 11.016 2.225 11.684 1.00 0.77 H new ATOM 0 HD3 LYS A 166 11.454 3.921 11.725 1.00 0.77 H new ATOM 0 HE2 LYS A 166 9.454 4.360 13.193 1.00 1.05 H new ATOM 0 HE3 LYS A 166 9.123 2.639 13.209 1.00 1.05 H new ATOM 0 HZ1 LYS A 166 10.357 3.312 15.160 1.00 1.58 H new ATOM 0 HZ2 LYS A 166 11.295 2.258 14.216 1.00 1.58 H new ATOM 0 HZ3 LYS A 166 11.616 3.925 14.200 1.00 1.58 H new ATOM 2458 N LEU A 167 11.672 4.722 6.680 1.00 0.18 N ATOM 2459 CA LEU A 167 11.835 4.607 5.238 1.00 0.18 C ATOM 2460 C LEU A 167 13.258 4.936 4.797 1.00 0.18 C ATOM 2461 O LEU A 167 13.871 4.178 4.049 1.00 0.19 O ATOM 2462 CB LEU A 167 10.846 5.542 4.536 1.00 0.19 C ATOM 2463 CG LEU A 167 10.915 5.546 3.009 1.00 0.20 C ATOM 2464 CD1 LEU A 167 10.569 4.174 2.454 1.00 0.23 C ATOM 2465 CD2 LEU A 167 9.985 6.606 2.442 1.00 0.24 C ATOM 0 H LEU A 167 11.351 5.639 6.991 1.00 0.18 H new ATOM 0 HA LEU A 167 11.635 3.572 4.960 1.00 0.18 H new ATOM 0 HB2 LEU A 167 9.835 5.265 4.836 1.00 0.19 H new ATOM 0 HB3 LEU A 167 11.017 6.558 4.893 1.00 0.19 H new ATOM 0 HG LEU A 167 11.935 5.786 2.708 1.00 0.20 H new ATOM 0 HD11 LEU A 167 10.624 4.197 1.366 1.00 0.23 H new ATOM 0 HD12 LEU A 167 11.276 3.438 2.837 1.00 0.23 H new ATOM 0 HD13 LEU A 167 9.559 3.902 2.761 1.00 0.23 H new ATOM 0 HD21 LEU A 167 10.044 6.598 1.354 1.00 0.24 H new ATOM 0 HD22 LEU A 167 8.961 6.395 2.751 1.00 0.24 H new ATOM 0 HD23 LEU A 167 10.281 7.587 2.814 1.00 0.24 H new ATOM 2477 N ILE A 168 13.775 6.066 5.272 1.00 0.21 N ATOM 2478 CA ILE A 168 15.086 6.564 4.850 1.00 0.25 C ATOM 2479 C ILE A 168 16.197 5.511 5.007 1.00 0.26 C ATOM 2480 O ILE A 168 16.978 5.310 4.075 1.00 0.28 O ATOM 2481 CB ILE A 168 15.471 7.858 5.605 1.00 0.32 C ATOM 2482 CG1 ILE A 168 14.433 8.951 5.328 1.00 0.35 C ATOM 2483 CG2 ILE A 168 16.862 8.328 5.194 1.00 0.39 C ATOM 2484 CD1 ILE A 168 14.695 10.249 6.061 1.00 0.44 C ATOM 0 H ILE A 168 13.304 6.660 5.955 1.00 0.21 H new ATOM 0 HA ILE A 168 14.994 6.791 3.788 1.00 0.25 H new ATOM 0 HB ILE A 168 15.487 7.647 6.674 1.00 0.32 H new ATOM 0 HG12 ILE A 168 14.407 9.150 4.257 1.00 0.35 H new ATOM 0 HG13 ILE A 168 13.447 8.580 5.608 1.00 0.35 H new ATOM 0 HG21 ILE A 168 17.113 9.239 5.737 1.00 0.39 H new ATOM 0 HG22 ILE A 168 17.592 7.553 5.428 1.00 0.39 H new ATOM 0 HG23 ILE A 168 16.877 8.528 4.123 1.00 0.39 H new ATOM 0 HD11 ILE A 168 13.917 10.971 5.812 1.00 0.44 H new ATOM 0 HD12 ILE A 168 14.691 10.067 7.136 1.00 0.44 H new ATOM 0 HD13 ILE A 168 15.666 10.645 5.764 1.00 0.44 H new ATOM 2496 N PRO A 169 16.300 4.828 6.174 1.00 0.29 N ATOM 2497 CA PRO A 169 17.269 3.740 6.359 1.00 0.34 C ATOM 2498 C PRO A 169 17.154 2.666 5.275 1.00 0.35 C ATOM 2499 O PRO A 169 18.163 2.195 4.751 1.00 0.48 O ATOM 2500 CB PRO A 169 16.917 3.152 7.736 1.00 0.39 C ATOM 2501 CG PRO A 169 15.601 3.747 8.107 1.00 0.49 C ATOM 2502 CD PRO A 169 15.531 5.071 7.405 1.00 0.31 C ATOM 0 HA PRO A 169 18.294 4.105 6.294 1.00 0.34 H new ATOM 0 HB2 PRO A 169 16.856 2.065 7.693 1.00 0.39 H new ATOM 0 HB3 PRO A 169 17.680 3.400 8.474 1.00 0.39 H new ATOM 0 HG2 PRO A 169 14.780 3.099 7.800 1.00 0.49 H new ATOM 0 HG3 PRO A 169 15.521 3.873 9.187 1.00 0.49 H new ATOM 0 HD2 PRO A 169 14.503 5.360 7.189 1.00 0.31 H new ATOM 0 HD3 PRO A 169 15.968 5.870 8.004 1.00 0.31 H new ATOM 2510 N LEU A 170 15.920 2.297 4.931 1.00 0.27 N ATOM 2511 CA LEU A 170 15.679 1.288 3.902 1.00 0.29 C ATOM 2512 C LEU A 170 16.119 1.788 2.535 1.00 0.29 C ATOM 2513 O LEU A 170 16.739 1.047 1.770 1.00 0.37 O ATOM 2514 CB LEU A 170 14.201 0.901 3.841 1.00 0.29 C ATOM 2515 CG LEU A 170 13.626 0.273 5.107 1.00 0.38 C ATOM 2516 CD1 LEU A 170 12.178 -0.115 4.873 1.00 0.60 C ATOM 2517 CD2 LEU A 170 14.448 -0.934 5.536 1.00 0.71 C ATOM 0 H LEU A 170 15.073 2.682 5.350 1.00 0.27 H new ATOM 0 HA LEU A 170 16.266 0.410 4.171 1.00 0.29 H new ATOM 0 HB2 LEU A 170 13.621 1.793 3.605 1.00 0.29 H new ATOM 0 HB3 LEU A 170 14.062 0.202 3.016 1.00 0.29 H new ATOM 0 HG LEU A 170 13.669 1.005 5.914 1.00 0.38 H new ATOM 0 HD11 LEU A 170 11.770 -0.563 5.779 1.00 0.60 H new ATOM 0 HD12 LEU A 170 11.600 0.773 4.616 1.00 0.60 H new ATOM 0 HD13 LEU A 170 12.121 -0.834 4.056 1.00 0.60 H new ATOM 0 HD21 LEU A 170 14.018 -1.364 6.441 1.00 0.71 H new ATOM 0 HD22 LEU A 170 14.441 -1.680 4.741 1.00 0.71 H new ATOM 0 HD23 LEU A 170 15.474 -0.624 5.734 1.00 0.71 H new ATOM 2529 N LEU A 171 15.772 3.040 2.230 1.00 0.25 N ATOM 2530 CA LEU A 171 16.131 3.657 0.949 1.00 0.28 C ATOM 2531 C LEU A 171 17.627 3.588 0.753 1.00 0.34 C ATOM 2532 O LEU A 171 18.119 3.178 -0.299 1.00 0.46 O ATOM 2533 CB LEU A 171 15.677 5.112 0.918 1.00 0.29 C ATOM 2534 CG LEU A 171 14.220 5.323 1.300 1.00 0.30 C ATOM 2535 CD1 LEU A 171 13.890 6.792 1.325 1.00 0.45 C ATOM 2536 CD2 LEU A 171 13.316 4.599 0.332 1.00 0.40 C ATOM 0 H LEU A 171 15.242 3.649 2.853 1.00 0.25 H new ATOM 0 HA LEU A 171 15.633 3.115 0.145 1.00 0.28 H new ATOM 0 HB2 LEU A 171 16.305 5.691 1.595 1.00 0.29 H new ATOM 0 HB3 LEU A 171 15.839 5.509 -0.084 1.00 0.29 H new ATOM 0 HG LEU A 171 14.061 4.916 2.298 1.00 0.30 H new ATOM 0 HD11 LEU A 171 12.844 6.925 1.600 1.00 0.45 H new ATOM 0 HD12 LEU A 171 14.524 7.295 2.055 1.00 0.45 H new ATOM 0 HD13 LEU A 171 14.063 7.221 0.338 1.00 0.45 H new ATOM 0 HD21 LEU A 171 12.276 4.758 0.617 1.00 0.40 H new ATOM 0 HD22 LEU A 171 13.479 4.983 -0.675 1.00 0.40 H new ATOM 0 HD23 LEU A 171 13.539 3.532 0.354 1.00 0.40 H new ATOM 2548 N GLY A 172 18.325 4.048 1.769 1.00 0.32 N ATOM 2549 CA GLY A 172 19.752 3.830 1.870 1.00 0.44 C ATOM 2550 C GLY A 172 20.152 2.376 1.641 1.00 0.71 C ATOM 2551 O GLY A 172 20.861 2.073 0.682 1.00 1.52 O ATOM 0 H GLY A 172 17.924 4.579 2.542 1.00 0.32 H new ATOM 0 HA2 GLY A 172 20.262 4.460 1.142 1.00 0.44 H new ATOM 0 HA3 GLY A 172 20.093 4.143 2.857 1.00 0.44 H new ATOM 2555 N SER A 173 19.691 1.475 2.512 1.00 0.74 N ATOM 2556 CA SER A 173 20.016 0.052 2.393 1.00 0.92 C ATOM 2557 C SER A 173 19.168 -0.789 3.352 1.00 1.29 C ATOM 2558 O SER A 173 19.223 -0.595 4.565 1.00 1.88 O ATOM 2559 CB SER A 173 21.506 -0.167 2.684 1.00 1.67 C ATOM 2560 OG SER A 173 21.861 0.342 3.962 1.00 2.52 O ATOM 0 H SER A 173 19.093 1.705 3.306 1.00 0.74 H new ATOM 0 HA SER A 173 19.794 -0.266 1.374 1.00 0.92 H new ATOM 0 HB2 SER A 173 21.736 -1.232 2.637 1.00 1.67 H new ATOM 0 HB3 SER A 173 22.105 0.322 1.916 1.00 1.67 H new ATOM 0 HG SER A 173 21.100 0.251 4.573 1.00 2.52 H new