USER MOD reduce.3.24.130724 H: found=0, std=0, add=1100, rem=0, adj=35 USER MOD reduce.3.24.130724 removed 1102 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: B 83 GLN : amide:sc= -1.61! C(o=-4.2!,f=-24!) USER MOD Set 1.2: B 98 ASN : amide:sc= -2.62! C(o=-4.2!,f=-19!) USER MOD Set 2.1: B 93 SER OG : rot -42:sc= 1.51 USER MOD Set 2.2: B 96 THR OG1 : rot -170:sc= 0.941 USER MOD Set 3.1: B 79 LYS NZ :NH3+ -141:sc= 0.568 (180deg=0.138) USER MOD Set 3.2: B 121 THR OG1 : rot 19:sc= 0.747 USER MOD Set 4.1: B 73 LYS NZ :NH3+ -127:sc= 0.353! (180deg=-0.75!) USER MOD Set 4.2: B 103 ASN : amide:sc= -0.718! C(o=-0.36!,f=-17!) USER MOD Set 5.1: B 71 ASN :FLIP amide:sc= -0.591 F(o=-3,f=-2.3) USER MOD Set 5.2: B 128 GLN :FLIP amide:sc= -1.69 F(o=-7.4!,f=-2.3) USER MOD Set 6.1: A 5 ASN : amide:sc= -3.16! C(o=-5.8!,f=-6.2!) USER MOD Set 6.2: A 62 GLN : amide:sc= -2.67! C(o=-5.8!,f=-8.6!) USER MOD Set 7.1: A 13 LYS NZ :NH3+ -158:sc= 0.217! (180deg=-0.038) USER MOD Set 7.2: A 55 THR OG1 : rot 22:sc= 1.3 USER MOD Set 8.1: A 48 LYS NZ :NH3+ -164:sc= -0.448! (180deg=-1.53!) USER MOD Set 8.2: A 52 TYR OH : rot -127:sc= 0.441 USER MOD Set 9.1: A 17 GLN : amide:sc= -0.915! C(o=-1!,f=-18!) USER MOD Set 9.2: A 32 ASN : amide:sc= -0.0918 K(o=-1,f=-18!) USER MOD Set10.1: A 4 ASN : amide:sc= -1.52 K(o=-9.3,f=-28!) USER MOD Set10.2: A 7 LYS NZ :NH3+ -133:sc= -3.62! (180deg=-2.15!) USER MOD Set10.3: A 37 ASN : amide:sc= -4.16! C(o=-9.3!,f=-26!) USER MOD Single : A 12 LYS NZ :NH3+ -148:sc= 0.864 (180deg=-0.0646) USER MOD Single : A 14 LYS NZ :NH3+ -157:sc= -0.0495 (180deg=-0.503) USER MOD Single : A 16 SER OG : rot 99:sc= 1.08 USER MOD Single : A 18 SER OG : rot 160:sc= -0.303 USER MOD Single : A 27 SER OG : rot 180:sc= 0.0237 USER MOD Single : A 29 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 30 THR OG1 : rot -160:sc= -0.244 USER MOD Single : A 36 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 38 LYS NZ :NH3+ -165:sc= -0.0106 (180deg=-0.327) USER MOD Single : A 39 TYR OH : rot -99:sc= -0.717! USER MOD Single : A 40 ASN :FLIP amide:sc= -0.448 F(o=-1.3,f=-0.45) USER MOD Single : A 42 SER OG : rot 180:sc= 0 USER MOD Single : A 44 GLN : amide:sc= 0 K(o=0,f=-0.69) USER MOD Single : A 51 TYR OH : rot 180:sc= 0 USER MOD Single : A 54 ASN : amide:sc= -0.538 K(o=-0.54,f=-1.4) USER MOD Single : A 64 GLN : amide:sc= -3.24 X(o=-3.2,f=-3) USER MOD Single : B 70 ASN : amide:sc= -2.77! C(o=-2.8!,f=-18!) USER MOD Single : B 78 LYS NZ :NH3+ -165:sc= -0.049 (180deg=-0.465) USER MOD Single : B 80 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 82 SER OG : rot 180:sc= 0 USER MOD Single : B 84 SER OG : rot 180:sc= -0.597 USER MOD Single : B 95 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 102 LYS NZ :NH3+ -163:sc= -0.0183 (180deg=-0.346) USER MOD Single : B 104 LYS NZ :NH3+ -159:sc= -0.111 (180deg=-0.673) USER MOD Single : B 105 TYR OH : rot 98:sc= -1.59! USER MOD Single : B 106 ASN :FLIP amide:sc= -8.71! C(o=-12!,f=-8.7!) USER MOD Single : B 108 SER OG : rot 180:sc= 0.0432 USER MOD Single : B 110 GLN : amide:sc= 0 X(o=0,f=-0.39) USER MOD Single : B 114 LYS NZ :NH3+ -143:sc= 0.429 (180deg=-7.46!) USER MOD Single : B 117 TYR OH : rot 180:sc= 0 USER MOD Single : B 118 TYR OH : rot 180:sc= 0 USER MOD Single : B 120 ASN : amide:sc= -0.887! C(o=-0.89!,f=-0.95!) USER MOD Single : B 130 GLN :FLIP amide:sc= -1.23 F(o=-1.9,f=-1.2) USER MOD ----------------------------------------------------------------- ATOM 18 N ILE A 2 0.165 10.764 1.662 1.00 0.00 N ATOM 19 CA ILE A 2 0.820 9.593 2.192 1.00 0.00 C ATOM 20 C ILE A 2 2.236 9.958 2.558 1.00 0.00 C ATOM 21 O ILE A 2 2.974 10.507 1.733 1.00 0.00 O ATOM 22 CB ILE A 2 0.828 8.486 1.130 1.00 0.00 C ATOM 23 CG1 ILE A 2 -0.605 8.143 0.713 1.00 0.00 C ATOM 24 CG2 ILE A 2 1.506 7.232 1.676 1.00 0.00 C ATOM 25 CD1 ILE A 2 -0.569 7.203 -0.495 1.00 0.00 C ATOM 0 HA ILE A 2 0.290 9.234 3.074 1.00 0.00 H new ATOM 0 HB ILE A 2 1.382 8.847 0.263 1.00 0.00 H new ATOM 0 HG12 ILE A 2 -1.134 7.670 1.541 1.00 0.00 H new ATOM 0 HG13 ILE A 2 -1.151 9.053 0.464 1.00 0.00 H new ATOM 0 HG21 ILE A 2 1.504 6.455 0.911 1.00 0.00 H new ATOM 0 HG22 ILE A 2 2.534 7.466 1.953 1.00 0.00 H new ATOM 0 HG23 ILE A 2 0.965 6.879 2.554 1.00 0.00 H new ATOM 0 HD11 ILE A 2 -1.588 6.957 -0.795 1.00 0.00 H new ATOM 0 HD12 ILE A 2 -0.056 7.693 -1.322 1.00 0.00 H new ATOM 0 HD13 ILE A 2 -0.038 6.289 -0.229 1.00 0.00 H new ATOM 37 N ILE A 3 2.612 9.676 3.777 1.00 0.00 N ATOM 38 CA ILE A 3 3.930 10.014 4.245 1.00 0.00 C ATOM 39 C ILE A 3 4.897 8.879 3.934 1.00 0.00 C ATOM 40 O ILE A 3 4.626 7.716 4.247 1.00 0.00 O ATOM 41 CB ILE A 3 3.852 10.325 5.739 1.00 0.00 C ATOM 42 CG1 ILE A 3 2.972 11.564 5.920 1.00 0.00 C ATOM 43 CG2 ILE A 3 5.244 10.620 6.298 1.00 0.00 C ATOM 44 CD1 ILE A 3 2.630 11.720 7.388 1.00 0.00 C ATOM 0 H ILE A 3 2.022 9.211 4.467 1.00 0.00 H new ATOM 0 HA ILE A 3 4.309 10.899 3.734 1.00 0.00 H new ATOM 0 HB ILE A 3 3.437 9.468 6.269 1.00 0.00 H new ATOM 0 HG12 ILE A 3 3.493 12.451 5.559 1.00 0.00 H new ATOM 0 HG13 ILE A 3 2.061 11.467 5.330 1.00 0.00 H new ATOM 0 HG21 ILE A 3 5.169 10.839 7.363 1.00 0.00 H new ATOM 0 HG22 ILE A 3 5.887 9.752 6.150 1.00 0.00 H new ATOM 0 HG23 ILE A 3 5.670 11.479 5.780 1.00 0.00 H new ATOM 0 HD11 ILE A 3 2.003 12.601 7.524 1.00 0.00 H new ATOM 0 HD12 ILE A 3 2.093 10.836 7.732 1.00 0.00 H new ATOM 0 HD13 ILE A 3 3.548 11.835 7.965 1.00 0.00 H new ATOM 56 N ASN A 4 5.938 9.219 3.174 1.00 0.00 N ATOM 57 CA ASN A 4 6.898 8.247 2.638 1.00 0.00 C ATOM 58 C ASN A 4 8.161 8.157 3.486 1.00 0.00 C ATOM 59 O ASN A 4 8.937 9.113 3.557 1.00 0.00 O ATOM 60 CB ASN A 4 7.268 8.624 1.194 1.00 0.00 C ATOM 61 CG ASN A 4 8.521 7.876 0.752 1.00 0.00 C ATOM 62 OD1 ASN A 4 8.811 6.799 1.260 1.00 0.00 O ATOM 63 ND2 ASN A 4 9.291 8.390 -0.149 1.00 0.00 N ATOM 0 H ASN A 4 6.142 10.183 2.910 1.00 0.00 H new ATOM 0 HA ASN A 4 6.419 7.268 2.658 1.00 0.00 H new ATOM 0 HB2 ASN A 4 6.440 8.386 0.526 1.00 0.00 H new ATOM 0 HB3 ASN A 4 7.435 9.699 1.124 1.00 0.00 H new ATOM 0 HD21 ASN A 4 10.138 7.900 -0.436 1.00 0.00 H new ATOM 0 HD22 ASN A 4 9.052 9.286 -0.573 1.00 0.00 H new ATOM 70 N ASN A 5 8.388 6.991 4.082 1.00 0.00 N ATOM 71 CA ASN A 5 9.596 6.737 4.880 1.00 0.00 C ATOM 72 C ASN A 5 10.569 5.854 4.119 1.00 0.00 C ATOM 73 O ASN A 5 11.406 5.181 4.728 1.00 0.00 O ATOM 74 CB ASN A 5 9.244 6.037 6.184 1.00 0.00 C ATOM 75 CG ASN A 5 8.295 6.874 7.002 1.00 0.00 C ATOM 76 OD1 ASN A 5 8.583 8.031 7.320 1.00 0.00 O ATOM 77 ND2 ASN A 5 7.174 6.368 7.349 1.00 0.00 N ATOM 0 H ASN A 5 7.749 6.197 4.030 1.00 0.00 H new ATOM 0 HA ASN A 5 10.055 7.704 5.088 1.00 0.00 H new ATOM 0 HB2 ASN A 5 8.791 5.069 5.971 1.00 0.00 H new ATOM 0 HB3 ASN A 5 10.152 5.845 6.756 1.00 0.00 H new ATOM 0 HD21 ASN A 5 6.511 6.921 7.892 1.00 0.00 H new ATOM 0 HD22 ASN A 5 6.942 5.411 7.083 1.00 0.00 H new ATOM 84 N LEU A 6 10.405 5.765 2.808 1.00 0.00 N ATOM 85 CA LEU A 6 11.176 4.806 2.022 1.00 0.00 C ATOM 86 C LEU A 6 12.656 5.052 2.185 1.00 0.00 C ATOM 87 O LEU A 6 13.417 4.127 2.470 1.00 0.00 O ATOM 88 CB LEU A 6 10.794 4.898 0.533 1.00 0.00 C ATOM 89 CG LEU A 6 11.640 3.909 -0.294 1.00 0.00 C ATOM 90 CD1 LEU A 6 11.440 2.493 0.235 1.00 0.00 C ATOM 91 CD2 LEU A 6 11.208 3.964 -1.762 1.00 0.00 C ATOM 0 H LEU A 6 9.754 6.336 2.269 1.00 0.00 H new ATOM 0 HA LEU A 6 10.943 3.806 2.387 1.00 0.00 H new ATOM 0 HB2 LEU A 6 9.734 4.676 0.407 1.00 0.00 H new ATOM 0 HB3 LEU A 6 10.952 5.914 0.171 1.00 0.00 H new ATOM 0 HG LEU A 6 12.692 4.184 -0.212 1.00 0.00 H new ATOM 0 HD11 LEU A 6 12.039 1.797 -0.352 1.00 0.00 H new ATOM 0 HD12 LEU A 6 11.750 2.447 1.279 1.00 0.00 H new ATOM 0 HD13 LEU A 6 10.387 2.221 0.157 1.00 0.00 H new ATOM 0 HD21 LEU A 6 11.807 3.264 -2.344 1.00 0.00 H new ATOM 0 HD22 LEU A 6 10.155 3.694 -1.842 1.00 0.00 H new ATOM 0 HD23 LEU A 6 11.353 4.973 -2.147 1.00 0.00 H new ATOM 103 N LYS A 7 13.052 6.299 2.097 1.00 0.00 N ATOM 104 CA LYS A 7 14.442 6.634 2.304 1.00 0.00 C ATOM 105 C LYS A 7 14.868 6.275 3.715 1.00 0.00 C ATOM 106 O LYS A 7 15.883 5.617 3.913 1.00 0.00 O ATOM 107 CB LYS A 7 14.702 8.117 2.014 1.00 0.00 C ATOM 108 CG LYS A 7 13.616 8.991 2.669 1.00 0.00 C ATOM 109 CD LYS A 7 12.984 9.889 1.605 1.00 0.00 C ATOM 110 CE LYS A 7 11.776 10.625 2.193 1.00 0.00 C ATOM 111 NZ LYS A 7 11.151 11.471 1.149 1.00 0.00 N ATOM 0 H LYS A 7 12.442 7.089 1.887 1.00 0.00 H new ATOM 0 HA LYS A 7 15.041 6.051 1.605 1.00 0.00 H new ATOM 0 HB2 LYS A 7 15.684 8.401 2.393 1.00 0.00 H new ATOM 0 HB3 LYS A 7 14.714 8.287 0.937 1.00 0.00 H new ATOM 0 HG2 LYS A 7 12.855 8.362 3.130 1.00 0.00 H new ATOM 0 HG3 LYS A 7 14.051 9.598 3.463 1.00 0.00 H new ATOM 0 HD2 LYS A 7 13.718 10.609 1.242 1.00 0.00 H new ATOM 0 HD3 LYS A 7 12.674 9.290 0.749 1.00 0.00 H new ATOM 0 HE2 LYS A 7 11.051 9.907 2.575 1.00 0.00 H new ATOM 0 HE3 LYS A 7 12.088 11.242 3.036 1.00 0.00 H new ATOM 0 HZ1 LYS A 7 10.970 12.420 1.534 1.00 0.00 H new ATOM 0 HZ2 LYS A 7 11.791 11.545 0.333 1.00 0.00 H new ATOM 0 HZ3 LYS A 7 10.253 11.043 0.847 1.00 0.00 H new ATOM 125 N LEU A 8 14.052 6.651 4.694 1.00 0.00 N ATOM 126 CA LEU A 8 14.378 6.360 6.078 1.00 0.00 C ATOM 127 C LEU A 8 14.436 4.858 6.273 1.00 0.00 C ATOM 128 O LEU A 8 15.376 4.328 6.861 1.00 0.00 O ATOM 129 CB LEU A 8 13.294 6.920 7.008 1.00 0.00 C ATOM 130 CG LEU A 8 13.204 8.442 6.884 1.00 0.00 C ATOM 131 CD1 LEU A 8 12.116 8.972 7.818 1.00 0.00 C ATOM 132 CD2 LEU A 8 14.542 9.088 7.216 1.00 0.00 C ATOM 0 H LEU A 8 13.174 7.150 4.555 1.00 0.00 H new ATOM 0 HA LEU A 8 15.339 6.818 6.313 1.00 0.00 H new ATOM 0 HB2 LEU A 8 12.331 6.473 6.761 1.00 0.00 H new ATOM 0 HB3 LEU A 8 13.517 6.647 8.039 1.00 0.00 H new ATOM 0 HG LEU A 8 12.949 8.695 5.855 1.00 0.00 H new ATOM 0 HD11 LEU A 8 12.055 10.056 7.727 1.00 0.00 H new ATOM 0 HD12 LEU A 8 11.157 8.530 7.547 1.00 0.00 H new ATOM 0 HD13 LEU A 8 12.359 8.707 8.847 1.00 0.00 H new ATOM 0 HD21 LEU A 8 14.457 10.171 7.122 1.00 0.00 H new ATOM 0 HD22 LEU A 8 14.825 8.834 8.237 1.00 0.00 H new ATOM 0 HD23 LEU A 8 15.303 8.723 6.527 1.00 0.00 H new ATOM 144 N ILE A 9 13.453 4.173 5.728 1.00 0.00 N ATOM 145 CA ILE A 9 13.410 2.732 5.797 1.00 0.00 C ATOM 146 C ILE A 9 14.545 2.103 5.039 1.00 0.00 C ATOM 147 O ILE A 9 15.214 1.209 5.545 1.00 0.00 O ATOM 148 CB ILE A 9 12.043 2.191 5.404 1.00 0.00 C ATOM 149 CG1 ILE A 9 11.058 2.602 6.491 1.00 0.00 C ATOM 150 CG2 ILE A 9 12.075 0.659 5.299 1.00 0.00 C ATOM 151 CD1 ILE A 9 9.666 2.282 6.047 1.00 0.00 C ATOM 0 H ILE A 9 12.670 4.596 5.230 1.00 0.00 H new ATOM 0 HA ILE A 9 13.555 2.444 6.838 1.00 0.00 H new ATOM 0 HB ILE A 9 11.750 2.591 4.433 1.00 0.00 H new ATOM 0 HG12 ILE A 9 11.285 2.078 7.420 1.00 0.00 H new ATOM 0 HG13 ILE A 9 11.150 3.669 6.696 1.00 0.00 H new ATOM 0 HG21 ILE A 9 11.088 0.293 5.017 1.00 0.00 H new ATOM 0 HG22 ILE A 9 12.802 0.361 4.543 1.00 0.00 H new ATOM 0 HG23 ILE A 9 12.358 0.234 6.262 1.00 0.00 H new ATOM 0 HD11 ILE A 9 8.960 2.575 6.824 1.00 0.00 H new ATOM 0 HD12 ILE A 9 9.443 2.826 5.129 1.00 0.00 H new ATOM 0 HD13 ILE A 9 9.580 1.211 5.864 1.00 0.00 H new ATOM 163 N ARG A 10 14.827 2.615 3.866 1.00 0.00 N ATOM 164 CA ARG A 10 15.957 2.104 3.126 1.00 0.00 C ATOM 165 C ARG A 10 17.200 2.226 3.983 1.00 0.00 C ATOM 166 O ARG A 10 17.976 1.278 4.093 1.00 0.00 O ATOM 167 CB ARG A 10 16.141 2.831 1.786 1.00 0.00 C ATOM 168 CG ARG A 10 17.322 2.198 1.036 1.00 0.00 C ATOM 169 CD ARG A 10 17.497 2.847 -0.350 1.00 0.00 C ATOM 170 NE ARG A 10 17.431 4.312 -0.297 1.00 0.00 N ATOM 171 CZ ARG A 10 18.215 5.075 0.469 1.00 0.00 C ATOM 172 NH1 ARG A 10 19.110 4.536 1.253 1.00 0.00 N ATOM 173 NH2 ARG A 10 18.084 6.365 0.419 1.00 0.00 N ATOM 0 H ARG A 10 14.306 3.365 3.412 1.00 0.00 H new ATOM 0 HA ARG A 10 15.775 1.056 2.889 1.00 0.00 H new ATOM 0 HB2 ARG A 10 15.232 2.757 1.189 1.00 0.00 H new ATOM 0 HB3 ARG A 10 16.326 3.892 1.955 1.00 0.00 H new ATOM 0 HG2 ARG A 10 18.236 2.319 1.618 1.00 0.00 H new ATOM 0 HG3 ARG A 10 17.156 1.127 0.923 1.00 0.00 H new ATOM 0 HD2 ARG A 10 18.456 2.545 -0.771 1.00 0.00 H new ATOM 0 HD3 ARG A 10 16.723 2.476 -1.022 1.00 0.00 H new ATOM 0 HE ARG A 10 16.740 4.779 -0.885 1.00 0.00 H new ATOM 0 HH11 ARG A 10 19.216 3.522 1.285 1.00 0.00 H new ATOM 0 HH12 ARG A 10 19.703 5.129 1.833 1.00 0.00 H new ATOM 0 HH21 ARG A 10 17.389 6.783 -0.200 1.00 0.00 H new ATOM 0 HH22 ARG A 10 18.676 6.961 0.998 1.00 0.00 H new ATOM 187 N GLU A 11 17.325 3.343 4.675 1.00 0.00 N ATOM 188 CA GLU A 11 18.415 3.511 5.607 1.00 0.00 C ATOM 189 C GLU A 11 18.339 2.430 6.696 1.00 0.00 C ATOM 190 O GLU A 11 19.365 1.913 7.130 1.00 0.00 O ATOM 191 CB GLU A 11 18.400 4.917 6.223 1.00 0.00 C ATOM 192 CG GLU A 11 18.666 5.963 5.125 1.00 0.00 C ATOM 193 CD GLU A 11 20.042 5.779 4.522 1.00 0.00 C ATOM 194 OE1 GLU A 11 20.991 5.769 5.264 1.00 0.00 O ATOM 195 OE2 GLU A 11 20.129 5.657 3.316 1.00 0.00 O ATOM 0 H GLU A 11 16.690 4.138 4.608 1.00 0.00 H new ATOM 0 HA GLU A 11 19.357 3.400 5.070 1.00 0.00 H new ATOM 0 HB2 GLU A 11 17.437 5.108 6.696 1.00 0.00 H new ATOM 0 HB3 GLU A 11 19.158 4.992 7.003 1.00 0.00 H new ATOM 0 HG2 GLU A 11 17.909 5.877 4.345 1.00 0.00 H new ATOM 0 HG3 GLU A 11 18.580 6.965 5.544 1.00 0.00 H new ATOM 202 N LYS A 12 17.121 2.044 7.099 1.00 0.00 N ATOM 203 CA LYS A 12 16.979 0.978 8.086 1.00 0.00 C ATOM 204 C LYS A 12 17.597 -0.305 7.529 1.00 0.00 C ATOM 205 O LYS A 12 18.204 -1.081 8.265 1.00 0.00 O ATOM 206 CB LYS A 12 15.490 0.696 8.355 1.00 0.00 C ATOM 207 CG LYS A 12 14.823 1.918 8.977 1.00 0.00 C ATOM 208 CD LYS A 12 13.333 1.628 9.231 1.00 0.00 C ATOM 209 CE LYS A 12 12.678 2.906 9.757 1.00 0.00 C ATOM 210 NZ LYS A 12 11.234 2.681 10.091 1.00 0.00 N ATOM 0 H LYS A 12 16.244 2.444 6.765 1.00 0.00 H new ATOM 0 HA LYS A 12 17.474 1.288 9.006 1.00 0.00 H new ATOM 0 HB2 LYS A 12 14.988 0.435 7.423 1.00 0.00 H new ATOM 0 HB3 LYS A 12 15.390 -0.160 9.022 1.00 0.00 H new ATOM 0 HG2 LYS A 12 15.317 2.176 9.914 1.00 0.00 H new ATOM 0 HG3 LYS A 12 14.928 2.777 8.314 1.00 0.00 H new ATOM 0 HD2 LYS A 12 12.847 1.303 8.311 1.00 0.00 H new ATOM 0 HD3 LYS A 12 13.221 0.819 9.953 1.00 0.00 H new ATOM 0 HE2 LYS A 12 13.209 3.251 10.644 1.00 0.00 H new ATOM 0 HE3 LYS A 12 12.762 3.694 9.009 1.00 0.00 H new ATOM 0 HZ1 LYS A 12 10.697 3.555 9.918 1.00 0.00 H new ATOM 0 HZ2 LYS A 12 10.855 1.918 9.495 1.00 0.00 H new ATOM 0 HZ3 LYS A 12 11.147 2.414 11.092 1.00 0.00 H new ATOM 224 N LYS A 13 17.345 -0.568 6.245 1.00 0.00 N ATOM 225 CA LYS A 13 17.786 -1.824 5.616 1.00 0.00 C ATOM 226 C LYS A 13 19.130 -1.660 4.905 1.00 0.00 C ATOM 227 O LYS A 13 19.668 -2.638 4.368 1.00 0.00 O ATOM 228 CB LYS A 13 16.761 -2.310 4.572 1.00 0.00 C ATOM 229 CG LYS A 13 15.331 -1.850 4.908 1.00 0.00 C ATOM 230 CD LYS A 13 14.930 -2.248 6.329 1.00 0.00 C ATOM 231 CE LYS A 13 14.618 -3.752 6.388 1.00 0.00 C ATOM 232 NZ LYS A 13 13.546 -4.015 7.381 1.00 0.00 N ATOM 0 H LYS A 13 16.842 0.063 5.621 1.00 0.00 H new ATOM 0 HA LYS A 13 17.882 -2.551 6.422 1.00 0.00 H new ATOM 0 HB2 LYS A 13 17.041 -1.934 3.588 1.00 0.00 H new ATOM 0 HB3 LYS A 13 16.788 -3.398 4.517 1.00 0.00 H new ATOM 0 HG2 LYS A 13 15.262 -0.768 4.800 1.00 0.00 H new ATOM 0 HG3 LYS A 13 14.631 -2.287 4.196 1.00 0.00 H new ATOM 0 HD2 LYS A 13 15.735 -2.008 7.023 1.00 0.00 H new ATOM 0 HD3 LYS A 13 14.058 -1.675 6.643 1.00 0.00 H new ATOM 0 HE2 LYS A 13 14.307 -4.105 5.405 1.00 0.00 H new ATOM 0 HE3 LYS A 13 15.517 -4.307 6.657 1.00 0.00 H new ATOM 0 HZ1 LYS A 13 13.594 -5.007 7.689 1.00 0.00 H new ATOM 0 HZ2 LYS A 13 13.673 -3.391 8.203 1.00 0.00 H new ATOM 0 HZ3 LYS A 13 12.619 -3.831 6.948 1.00 0.00 H new ATOM 246 N LYS A 14 19.580 -0.420 4.758 1.00 0.00 N ATOM 247 CA LYS A 14 20.754 -0.109 3.941 1.00 0.00 C ATOM 248 C LYS A 14 20.750 -0.875 2.626 1.00 0.00 C ATOM 249 O LYS A 14 21.807 -1.153 2.040 1.00 0.00 O ATOM 250 CB LYS A 14 22.044 -0.324 4.711 1.00 0.00 C ATOM 251 CG LYS A 14 22.169 0.800 5.729 1.00 0.00 C ATOM 252 CD LYS A 14 23.438 0.637 6.543 1.00 0.00 C ATOM 253 CE LYS A 14 23.515 1.800 7.523 1.00 0.00 C ATOM 254 NZ LYS A 14 23.818 3.044 6.772 1.00 0.00 N ATOM 0 H LYS A 14 19.149 0.394 5.196 1.00 0.00 H new ATOM 0 HA LYS A 14 20.698 0.951 3.692 1.00 0.00 H new ATOM 0 HB2 LYS A 14 22.034 -1.293 5.210 1.00 0.00 H new ATOM 0 HB3 LYS A 14 22.898 -0.323 4.034 1.00 0.00 H new ATOM 0 HG2 LYS A 14 22.178 1.763 5.218 1.00 0.00 H new ATOM 0 HG3 LYS A 14 21.302 0.798 6.390 1.00 0.00 H new ATOM 0 HD2 LYS A 14 23.430 -0.313 7.077 1.00 0.00 H new ATOM 0 HD3 LYS A 14 24.312 0.628 5.891 1.00 0.00 H new ATOM 0 HE2 LYS A 14 22.572 1.904 8.059 1.00 0.00 H new ATOM 0 HE3 LYS A 14 24.287 1.613 8.269 1.00 0.00 H new ATOM 0 HZ1 LYS A 14 24.249 3.740 7.413 1.00 0.00 H new ATOM 0 HZ2 LYS A 14 24.479 2.830 5.998 1.00 0.00 H new ATOM 0 HZ3 LYS A 14 22.938 3.434 6.378 1.00 0.00 H new ATOM 268 N ILE A 15 19.553 -1.104 2.110 1.00 0.00 N ATOM 269 CA ILE A 15 19.382 -1.703 0.806 1.00 0.00 C ATOM 270 C ILE A 15 19.603 -0.643 -0.257 1.00 0.00 C ATOM 271 O ILE A 15 19.227 0.514 -0.071 1.00 0.00 O ATOM 272 CB ILE A 15 17.989 -2.374 0.689 1.00 0.00 C ATOM 273 CG1 ILE A 15 18.155 -3.873 0.428 1.00 0.00 C ATOM 274 CG2 ILE A 15 17.168 -1.764 -0.448 1.00 0.00 C ATOM 275 CD1 ILE A 15 18.943 -4.521 1.566 1.00 0.00 C ATOM 0 H ILE A 15 18.679 -0.879 2.585 1.00 0.00 H new ATOM 0 HA ILE A 15 20.119 -2.493 0.659 1.00 0.00 H new ATOM 0 HB ILE A 15 17.462 -2.208 1.629 1.00 0.00 H new ATOM 0 HG12 ILE A 15 17.177 -4.345 0.338 1.00 0.00 H new ATOM 0 HG13 ILE A 15 18.673 -4.030 -0.518 1.00 0.00 H new ATOM 0 HG21 ILE A 15 16.198 -2.258 -0.502 1.00 0.00 H new ATOM 0 HG22 ILE A 15 17.024 -0.700 -0.262 1.00 0.00 H new ATOM 0 HG23 ILE A 15 17.697 -1.899 -1.392 1.00 0.00 H new ATOM 0 HD11 ILE A 15 19.055 -5.587 1.370 1.00 0.00 H new ATOM 0 HD12 ILE A 15 19.928 -4.059 1.636 1.00 0.00 H new ATOM 0 HD13 ILE A 15 18.409 -4.379 2.505 1.00 0.00 H new ATOM 287 N SER A 16 20.300 -0.996 -1.298 1.00 0.00 N ATOM 288 CA SER A 16 20.640 -0.043 -2.329 1.00 0.00 C ATOM 289 C SER A 16 19.378 0.358 -3.091 1.00 0.00 C ATOM 290 O SER A 16 18.454 -0.447 -3.238 1.00 0.00 O ATOM 291 CB SER A 16 21.668 -0.671 -3.269 1.00 0.00 C ATOM 292 OG SER A 16 22.605 -1.414 -2.479 1.00 0.00 O ATOM 0 H SER A 16 20.648 -1.941 -1.461 1.00 0.00 H new ATOM 0 HA SER A 16 21.071 0.854 -1.885 1.00 0.00 H new ATOM 0 HB2 SER A 16 21.175 -1.325 -3.988 1.00 0.00 H new ATOM 0 HB3 SER A 16 22.182 0.102 -3.841 1.00 0.00 H new ATOM 0 HG SER A 16 22.362 -2.363 -2.490 1.00 0.00 H new ATOM 298 N GLN A 17 19.319 1.592 -3.561 1.00 0.00 N ATOM 299 CA GLN A 17 18.136 2.037 -4.274 1.00 0.00 C ATOM 300 C GLN A 17 17.977 1.154 -5.481 1.00 0.00 C ATOM 301 O GLN A 17 16.890 0.687 -5.791 1.00 0.00 O ATOM 302 CB GLN A 17 18.318 3.468 -4.783 1.00 0.00 C ATOM 303 CG GLN A 17 18.529 4.427 -3.639 1.00 0.00 C ATOM 304 CD GLN A 17 18.704 5.822 -4.206 1.00 0.00 C ATOM 305 OE1 GLN A 17 19.595 6.043 -5.043 1.00 0.00 O ATOM 306 NE2 GLN A 17 17.909 6.771 -3.828 1.00 0.00 N ATOM 0 H GLN A 17 20.058 2.289 -3.465 1.00 0.00 H new ATOM 0 HA GLN A 17 17.276 1.994 -3.606 1.00 0.00 H new ATOM 0 HB2 GLN A 17 19.171 3.511 -5.460 1.00 0.00 H new ATOM 0 HB3 GLN A 17 17.441 3.768 -5.356 1.00 0.00 H new ATOM 0 HG2 GLN A 17 17.677 4.399 -2.959 1.00 0.00 H new ATOM 0 HG3 GLN A 17 19.408 4.140 -3.061 1.00 0.00 H new ATOM 0 HE21 GLN A 17 17.180 6.582 -3.140 1.00 0.00 H new ATOM 0 HE22 GLN A 17 18.012 7.708 -4.218 1.00 0.00 H new ATOM 315 N SER A 18 19.093 0.934 -6.157 1.00 0.00 N ATOM 316 CA SER A 18 19.130 0.141 -7.359 1.00 0.00 C ATOM 317 C SER A 18 18.708 -1.296 -7.108 1.00 0.00 C ATOM 318 O SER A 18 17.893 -1.839 -7.855 1.00 0.00 O ATOM 319 CB SER A 18 20.535 0.199 -7.952 1.00 0.00 C ATOM 320 OG SER A 18 21.444 0.697 -6.958 1.00 0.00 O ATOM 0 H SER A 18 20.001 1.306 -5.879 1.00 0.00 H new ATOM 0 HA SER A 18 18.414 0.556 -8.068 1.00 0.00 H new ATOM 0 HB2 SER A 18 20.845 -0.792 -8.282 1.00 0.00 H new ATOM 0 HB3 SER A 18 20.546 0.845 -8.830 1.00 0.00 H new ATOM 0 HG SER A 18 22.360 0.444 -7.197 1.00 0.00 H new ATOM 326 N GLU A 19 19.199 -1.900 -6.024 1.00 0.00 N ATOM 327 CA GLU A 19 18.796 -3.254 -5.732 1.00 0.00 C ATOM 328 C GLU A 19 17.326 -3.289 -5.393 1.00 0.00 C ATOM 329 O GLU A 19 16.572 -4.022 -6.017 1.00 0.00 O ATOM 330 CB GLU A 19 19.678 -3.921 -4.646 1.00 0.00 C ATOM 331 CG GLU A 19 19.382 -3.376 -3.243 1.00 0.00 C ATOM 332 CD GLU A 19 20.332 -4.001 -2.245 1.00 0.00 C ATOM 333 OE1 GLU A 19 20.202 -5.174 -1.988 1.00 0.00 O ATOM 334 OE2 GLU A 19 21.192 -3.302 -1.756 1.00 0.00 O ATOM 0 H GLU A 19 19.853 -1.482 -5.362 1.00 0.00 H new ATOM 0 HA GLU A 19 18.952 -3.855 -6.628 1.00 0.00 H new ATOM 0 HB2 GLU A 19 19.513 -4.998 -4.658 1.00 0.00 H new ATOM 0 HB3 GLU A 19 20.729 -3.757 -4.883 1.00 0.00 H new ATOM 0 HG2 GLU A 19 19.490 -2.291 -3.233 1.00 0.00 H new ATOM 0 HG3 GLU A 19 18.351 -3.596 -2.966 1.00 0.00 H new ATOM 341 N LEU A 20 16.889 -2.341 -4.558 1.00 0.00 N ATOM 342 CA LEU A 20 15.472 -2.205 -4.221 1.00 0.00 C ATOM 343 C LEU A 20 14.684 -1.939 -5.486 1.00 0.00 C ATOM 344 O LEU A 20 13.672 -2.595 -5.752 1.00 0.00 O ATOM 345 CB LEU A 20 15.255 -1.030 -3.254 1.00 0.00 C ATOM 346 CG LEU A 20 13.765 -0.936 -2.872 1.00 0.00 C ATOM 347 CD1 LEU A 20 13.360 -2.143 -2.022 1.00 0.00 C ATOM 348 CD2 LEU A 20 13.495 0.358 -2.098 1.00 0.00 C ATOM 0 H LEU A 20 17.496 -1.658 -4.105 1.00 0.00 H new ATOM 0 HA LEU A 20 15.138 -3.127 -3.745 1.00 0.00 H new ATOM 0 HB2 LEU A 20 15.861 -1.167 -2.359 1.00 0.00 H new ATOM 0 HB3 LEU A 20 15.580 -0.099 -3.719 1.00 0.00 H new ATOM 0 HG LEU A 20 13.173 -0.931 -3.787 1.00 0.00 H new ATOM 0 HD11 LEU A 20 12.305 -2.065 -1.759 1.00 0.00 H new ATOM 0 HD12 LEU A 20 13.526 -3.059 -2.589 1.00 0.00 H new ATOM 0 HD13 LEU A 20 13.960 -2.165 -1.113 1.00 0.00 H new ATOM 0 HD21 LEU A 20 12.439 0.411 -1.835 1.00 0.00 H new ATOM 0 HD22 LEU A 20 14.096 0.371 -1.189 1.00 0.00 H new ATOM 0 HD23 LEU A 20 13.758 1.215 -2.719 1.00 0.00 H new ATOM 360 N ALA A 21 15.203 -1.043 -6.315 1.00 0.00 N ATOM 361 CA ALA A 21 14.579 -0.771 -7.592 1.00 0.00 C ATOM 362 C ALA A 21 14.512 -2.056 -8.382 1.00 0.00 C ATOM 363 O ALA A 21 13.481 -2.386 -8.963 1.00 0.00 O ATOM 364 CB ALA A 21 15.375 0.281 -8.369 1.00 0.00 C ATOM 0 H ALA A 21 16.045 -0.500 -6.125 1.00 0.00 H new ATOM 0 HA ALA A 21 13.574 -0.381 -7.428 1.00 0.00 H new ATOM 0 HB1 ALA A 21 14.889 0.471 -9.326 1.00 0.00 H new ATOM 0 HB2 ALA A 21 15.416 1.205 -7.793 1.00 0.00 H new ATOM 0 HB3 ALA A 21 16.388 -0.084 -8.542 1.00 0.00 H new ATOM 370 N ALA A 22 15.583 -2.834 -8.311 1.00 0.00 N ATOM 371 CA ALA A 22 15.615 -4.145 -8.934 1.00 0.00 C ATOM 372 C ALA A 22 14.604 -5.076 -8.272 1.00 0.00 C ATOM 373 O ALA A 22 13.929 -5.850 -8.955 1.00 0.00 O ATOM 374 CB ALA A 22 17.019 -4.752 -8.871 1.00 0.00 C ATOM 0 H ALA A 22 16.443 -2.577 -7.826 1.00 0.00 H new ATOM 0 HA ALA A 22 15.345 -4.025 -9.983 1.00 0.00 H new ATOM 0 HB1 ALA A 22 17.013 -5.733 -9.345 1.00 0.00 H new ATOM 0 HB2 ALA A 22 17.720 -4.101 -9.393 1.00 0.00 H new ATOM 0 HB3 ALA A 22 17.325 -4.854 -7.830 1.00 0.00 H new ATOM 380 N LEU A 23 14.478 -4.990 -6.941 1.00 0.00 N ATOM 381 CA LEU A 23 13.510 -5.840 -6.240 1.00 0.00 C ATOM 382 C LEU A 23 12.127 -5.475 -6.754 1.00 0.00 C ATOM 383 O LEU A 23 11.329 -6.331 -7.175 1.00 0.00 O ATOM 384 CB LEU A 23 13.518 -5.554 -4.722 1.00 0.00 C ATOM 385 CG LEU A 23 14.928 -5.614 -4.124 1.00 0.00 C ATOM 386 CD1 LEU A 23 14.876 -5.292 -2.629 1.00 0.00 C ATOM 387 CD2 LEU A 23 15.566 -6.974 -4.341 1.00 0.00 C ATOM 0 H LEU A 23 15.016 -4.361 -6.345 1.00 0.00 H new ATOM 0 HA LEU A 23 13.765 -6.886 -6.413 1.00 0.00 H new ATOM 0 HB2 LEU A 23 13.090 -4.569 -4.538 1.00 0.00 H new ATOM 0 HB3 LEU A 23 12.880 -6.278 -4.215 1.00 0.00 H new ATOM 0 HG LEU A 23 15.541 -4.871 -4.634 1.00 0.00 H new ATOM 0 HD11 LEU A 23 15.882 -5.337 -2.212 1.00 0.00 H new ATOM 0 HD12 LEU A 23 14.468 -4.291 -2.486 1.00 0.00 H new ATOM 0 HD13 LEU A 23 14.240 -6.018 -2.122 1.00 0.00 H new ATOM 0 HD21 LEU A 23 16.565 -6.981 -3.905 1.00 0.00 H new ATOM 0 HD22 LEU A 23 14.956 -7.742 -3.865 1.00 0.00 H new ATOM 0 HD23 LEU A 23 15.636 -7.177 -5.410 1.00 0.00 H new ATOM 399 N LEU A 24 11.906 -4.183 -6.846 1.00 0.00 N ATOM 400 CA LEU A 24 10.690 -3.649 -7.418 1.00 0.00 C ATOM 401 C LEU A 24 10.603 -3.965 -8.885 1.00 0.00 C ATOM 402 O LEU A 24 9.506 -4.160 -9.411 1.00 0.00 O ATOM 403 CB LEU A 24 10.564 -2.152 -7.159 1.00 0.00 C ATOM 404 CG LEU A 24 9.858 -1.921 -5.811 1.00 0.00 C ATOM 405 CD1 LEU A 24 10.595 -2.660 -4.690 1.00 0.00 C ATOM 406 CD2 LEU A 24 9.834 -0.424 -5.503 1.00 0.00 C ATOM 0 H LEU A 24 12.564 -3.472 -6.526 1.00 0.00 H new ATOM 0 HA LEU A 24 9.847 -4.133 -6.924 1.00 0.00 H new ATOM 0 HB2 LEU A 24 11.551 -1.690 -7.148 1.00 0.00 H new ATOM 0 HB3 LEU A 24 9.999 -1.679 -7.963 1.00 0.00 H new ATOM 0 HG LEU A 24 8.839 -2.303 -5.874 1.00 0.00 H new ATOM 0 HD11 LEU A 24 10.084 -2.487 -3.743 1.00 0.00 H new ATOM 0 HD12 LEU A 24 10.608 -3.728 -4.906 1.00 0.00 H new ATOM 0 HD13 LEU A 24 11.618 -2.291 -4.623 1.00 0.00 H new ATOM 0 HD21 LEU A 24 9.335 -0.257 -4.549 1.00 0.00 H new ATOM 0 HD22 LEU A 24 10.855 -0.047 -5.449 1.00 0.00 H new ATOM 0 HD23 LEU A 24 9.295 0.101 -6.292 1.00 0.00 H new ATOM 418 N GLU A 25 11.768 -3.988 -9.533 1.00 0.00 N ATOM 419 CA GLU A 25 11.901 -4.186 -10.976 1.00 0.00 C ATOM 420 C GLU A 25 11.667 -2.858 -11.671 1.00 0.00 C ATOM 421 O GLU A 25 11.140 -2.796 -12.785 1.00 0.00 O ATOM 422 CB GLU A 25 10.882 -5.214 -11.467 1.00 0.00 C ATOM 423 CG GLU A 25 11.041 -6.515 -10.672 1.00 0.00 C ATOM 424 CD GLU A 25 9.880 -7.432 -10.947 1.00 0.00 C ATOM 425 OE1 GLU A 25 9.315 -7.344 -12.018 1.00 0.00 O ATOM 426 OE2 GLU A 25 9.565 -8.216 -10.078 1.00 0.00 O ATOM 0 H GLU A 25 12.663 -3.867 -9.060 1.00 0.00 H new ATOM 0 HA GLU A 25 12.901 -4.557 -11.203 1.00 0.00 H new ATOM 0 HB2 GLU A 25 9.871 -4.824 -11.348 1.00 0.00 H new ATOM 0 HB3 GLU A 25 11.027 -5.406 -12.530 1.00 0.00 H new ATOM 0 HG2 GLU A 25 11.975 -7.006 -10.945 1.00 0.00 H new ATOM 0 HG3 GLU A 25 11.096 -6.295 -9.606 1.00 0.00 H new ATOM 433 N VAL A 26 12.107 -1.803 -11.010 1.00 0.00 N ATOM 434 CA VAL A 26 12.000 -0.450 -11.512 1.00 0.00 C ATOM 435 C VAL A 26 13.357 0.228 -11.470 1.00 0.00 C ATOM 436 O VAL A 26 14.320 -0.320 -10.917 1.00 0.00 O ATOM 437 CB VAL A 26 10.977 0.355 -10.693 1.00 0.00 C ATOM 438 CG1 VAL A 26 9.597 -0.281 -10.838 1.00 0.00 C ATOM 439 CG2 VAL A 26 11.378 0.372 -9.212 1.00 0.00 C ATOM 0 H VAL A 26 12.555 -1.866 -10.096 1.00 0.00 H new ATOM 0 HA VAL A 26 11.655 -0.490 -12.545 1.00 0.00 H new ATOM 0 HB VAL A 26 10.952 1.379 -11.065 1.00 0.00 H new ATOM 0 HG11 VAL A 26 8.871 0.289 -10.258 1.00 0.00 H new ATOM 0 HG12 VAL A 26 9.304 -0.279 -11.888 1.00 0.00 H new ATOM 0 HG13 VAL A 26 9.629 -1.307 -10.472 1.00 0.00 H new ATOM 0 HG21 VAL A 26 10.646 0.945 -8.643 1.00 0.00 H new ATOM 0 HG22 VAL A 26 11.413 -0.649 -8.833 1.00 0.00 H new ATOM 0 HG23 VAL A 26 12.360 0.832 -9.106 1.00 0.00 H new ATOM 449 N SER A 27 13.449 1.376 -12.092 1.00 0.00 N ATOM 450 CA SER A 27 14.689 2.115 -12.159 1.00 0.00 C ATOM 451 C SER A 27 15.077 2.629 -10.770 1.00 0.00 C ATOM 452 O SER A 27 14.209 3.034 -9.988 1.00 0.00 O ATOM 453 CB SER A 27 14.507 3.294 -13.111 1.00 0.00 C ATOM 454 OG SER A 27 13.748 2.864 -14.239 1.00 0.00 O ATOM 0 H SER A 27 12.667 1.827 -12.567 1.00 0.00 H new ATOM 0 HA SER A 27 15.482 1.461 -12.521 1.00 0.00 H new ATOM 0 HB2 SER A 27 13.997 4.113 -12.604 1.00 0.00 H new ATOM 0 HB3 SER A 27 15.477 3.673 -13.432 1.00 0.00 H new ATOM 0 HG SER A 27 13.624 3.615 -14.856 1.00 0.00 H new ATOM 460 N ARG A 28 16.373 2.736 -10.507 1.00 0.00 N ATOM 461 CA ARG A 28 16.838 3.317 -9.262 1.00 0.00 C ATOM 462 C ARG A 28 16.302 4.736 -9.190 1.00 0.00 C ATOM 463 O ARG A 28 15.829 5.197 -8.144 1.00 0.00 O ATOM 464 CB ARG A 28 18.364 3.311 -9.219 1.00 0.00 C ATOM 465 CG ARG A 28 18.834 3.825 -7.865 1.00 0.00 C ATOM 466 CD ARG A 28 20.352 3.780 -7.809 1.00 0.00 C ATOM 467 NE ARG A 28 20.840 4.405 -6.578 1.00 0.00 N ATOM 468 CZ ARG A 28 21.957 4.002 -5.966 1.00 0.00 C ATOM 469 NH1 ARG A 28 22.566 2.907 -6.353 1.00 0.00 N ATOM 470 NH2 ARG A 28 22.407 4.674 -4.945 1.00 0.00 N ATOM 0 H ARG A 28 17.114 2.429 -11.137 1.00 0.00 H new ATOM 0 HA ARG A 28 16.483 2.739 -8.409 1.00 0.00 H new ATOM 0 HB2 ARG A 28 18.740 2.302 -9.387 1.00 0.00 H new ATOM 0 HB3 ARG A 28 18.764 3.937 -10.017 1.00 0.00 H new ATOM 0 HG2 ARG A 28 18.483 4.845 -7.709 1.00 0.00 H new ATOM 0 HG3 ARG A 28 18.411 3.217 -7.066 1.00 0.00 H new ATOM 0 HD2 ARG A 28 20.693 2.746 -7.858 1.00 0.00 H new ATOM 0 HD3 ARG A 28 20.769 4.295 -8.675 1.00 0.00 H new ATOM 0 HE ARG A 28 20.308 5.176 -6.173 1.00 0.00 H new ATOM 0 HH11 ARG A 28 22.187 2.358 -7.125 1.00 0.00 H new ATOM 0 HH12 ARG A 28 23.419 2.604 -5.882 1.00 0.00 H new ATOM 0 HH21 ARG A 28 21.907 5.501 -4.618 1.00 0.00 H new ATOM 0 HH22 ARG A 28 23.259 4.373 -4.472 1.00 0.00 H new ATOM 484 N GLN A 29 16.268 5.370 -10.348 1.00 0.00 N ATOM 485 CA GLN A 29 15.692 6.689 -10.495 1.00 0.00 C ATOM 486 C GLN A 29 14.270 6.681 -9.947 1.00 0.00 C ATOM 487 O GLN A 29 13.850 7.616 -9.267 1.00 0.00 O ATOM 488 CB GLN A 29 15.642 7.044 -11.982 1.00 0.00 C ATOM 489 CG GLN A 29 17.060 7.207 -12.535 1.00 0.00 C ATOM 490 CD GLN A 29 17.001 7.338 -14.048 1.00 0.00 C ATOM 491 OE1 GLN A 29 16.779 8.431 -14.574 1.00 0.00 O ATOM 492 NE2 GLN A 29 17.181 6.290 -14.786 1.00 0.00 N ATOM 0 H GLN A 29 16.641 4.981 -11.214 1.00 0.00 H new ATOM 0 HA GLN A 29 16.295 7.417 -9.952 1.00 0.00 H new ATOM 0 HB2 GLN A 29 15.117 6.263 -12.532 1.00 0.00 H new ATOM 0 HB3 GLN A 29 15.080 7.967 -12.124 1.00 0.00 H new ATOM 0 HG2 GLN A 29 17.532 8.088 -12.101 1.00 0.00 H new ATOM 0 HG3 GLN A 29 17.671 6.348 -12.257 1.00 0.00 H new ATOM 0 HE21 GLN A 29 17.365 5.386 -14.351 1.00 0.00 H new ATOM 0 HE22 GLN A 29 17.139 6.368 -15.802 1.00 0.00 H new ATOM 501 N THR A 30 13.550 5.589 -10.204 1.00 0.00 N ATOM 502 CA THR A 30 12.192 5.453 -9.718 1.00 0.00 C ATOM 503 C THR A 30 12.182 5.500 -8.193 1.00 0.00 C ATOM 504 O THR A 30 11.394 6.251 -7.591 1.00 0.00 O ATOM 505 CB THR A 30 11.573 4.137 -10.222 1.00 0.00 C ATOM 506 OG1 THR A 30 11.800 4.017 -11.626 1.00 0.00 O ATOM 507 CG2 THR A 30 10.063 4.129 -9.951 1.00 0.00 C ATOM 0 H THR A 30 13.889 4.793 -10.744 1.00 0.00 H new ATOM 0 HA THR A 30 11.593 6.280 -10.099 1.00 0.00 H new ATOM 0 HB THR A 30 12.035 3.300 -9.698 1.00 0.00 H new ATOM 0 HG1 THR A 30 11.163 3.377 -12.007 1.00 0.00 H new ATOM 0 HG21 THR A 30 9.634 3.194 -10.311 1.00 0.00 H new ATOM 0 HG22 THR A 30 9.885 4.221 -8.880 1.00 0.00 H new ATOM 0 HG23 THR A 30 9.596 4.966 -10.470 1.00 0.00 H new ATOM 515 N ILE A 31 13.107 4.772 -7.580 1.00 0.00 N ATOM 516 CA ILE A 31 13.249 4.788 -6.135 1.00 0.00 C ATOM 517 C ILE A 31 13.646 6.175 -5.683 1.00 0.00 C ATOM 518 O ILE A 31 13.038 6.729 -4.767 1.00 0.00 O ATOM 519 CB ILE A 31 14.306 3.753 -5.687 1.00 0.00 C ATOM 520 CG1 ILE A 31 13.802 2.329 -5.992 1.00 0.00 C ATOM 521 CG2 ILE A 31 14.574 3.881 -4.181 1.00 0.00 C ATOM 522 CD1 ILE A 31 12.505 2.052 -5.218 1.00 0.00 C ATOM 0 H ILE A 31 13.768 4.164 -8.063 1.00 0.00 H new ATOM 0 HA ILE A 31 12.296 4.522 -5.679 1.00 0.00 H new ATOM 0 HB ILE A 31 15.231 3.942 -6.232 1.00 0.00 H new ATOM 0 HG12 ILE A 31 13.627 2.218 -7.062 1.00 0.00 H new ATOM 0 HG13 ILE A 31 14.563 1.599 -5.716 1.00 0.00 H new ATOM 0 HG21 ILE A 31 15.320 3.146 -3.880 1.00 0.00 H new ATOM 0 HG22 ILE A 31 14.943 4.883 -3.961 1.00 0.00 H new ATOM 0 HG23 ILE A 31 13.650 3.705 -3.631 1.00 0.00 H new ATOM 0 HD11 ILE A 31 12.157 1.043 -5.440 1.00 0.00 H new ATOM 0 HD12 ILE A 31 12.693 2.143 -4.148 1.00 0.00 H new ATOM 0 HD13 ILE A 31 11.743 2.772 -5.515 1.00 0.00 H new ATOM 534 N ASN A 32 14.589 6.783 -6.387 1.00 0.00 N ATOM 535 CA ASN A 32 15.009 8.124 -6.024 1.00 0.00 C ATOM 536 C ASN A 32 13.846 9.091 -6.096 1.00 0.00 C ATOM 537 O ASN A 32 13.598 9.832 -5.147 1.00 0.00 O ATOM 538 CB ASN A 32 16.144 8.620 -6.926 1.00 0.00 C ATOM 539 CG ASN A 32 17.479 8.141 -6.390 1.00 0.00 C ATOM 540 OD1 ASN A 32 17.977 8.690 -5.404 1.00 0.00 O ATOM 541 ND2 ASN A 32 18.098 7.163 -6.967 1.00 0.00 N ATOM 0 H ASN A 32 15.067 6.380 -7.193 1.00 0.00 H new ATOM 0 HA ASN A 32 15.375 8.080 -4.998 1.00 0.00 H new ATOM 0 HB2 ASN A 32 15.998 8.254 -7.942 1.00 0.00 H new ATOM 0 HB3 ASN A 32 16.132 9.709 -6.975 1.00 0.00 H new ATOM 0 HD21 ASN A 32 18.998 6.846 -6.607 1.00 0.00 H new ATOM 0 HD22 ASN A 32 17.686 6.709 -7.782 1.00 0.00 H new ATOM 548 N GLY A 33 13.060 9.002 -7.157 1.00 0.00 N ATOM 549 CA GLY A 33 11.881 9.847 -7.269 1.00 0.00 C ATOM 550 C GLY A 33 10.965 9.613 -6.079 1.00 0.00 C ATOM 551 O GLY A 33 10.491 10.564 -5.443 1.00 0.00 O ATOM 0 H GLY A 33 13.212 8.366 -7.940 1.00 0.00 H new ATOM 0 HA2 GLY A 33 12.176 10.895 -7.312 1.00 0.00 H new ATOM 0 HA3 GLY A 33 11.351 9.627 -8.196 1.00 0.00 H new ATOM 555 N ILE A 34 10.793 8.353 -5.718 1.00 0.00 N ATOM 556 CA ILE A 34 10.003 8.020 -4.552 1.00 0.00 C ATOM 557 C ILE A 34 10.665 8.589 -3.298 1.00 0.00 C ATOM 558 O ILE A 34 9.996 9.187 -2.453 1.00 0.00 O ATOM 559 CB ILE A 34 9.838 6.492 -4.431 1.00 0.00 C ATOM 560 CG1 ILE A 34 8.985 5.976 -5.593 1.00 0.00 C ATOM 561 CG2 ILE A 34 9.133 6.151 -3.112 1.00 0.00 C ATOM 562 CD1 ILE A 34 9.045 4.445 -5.623 1.00 0.00 C ATOM 0 H ILE A 34 11.187 7.552 -6.212 1.00 0.00 H new ATOM 0 HA ILE A 34 9.012 8.462 -4.658 1.00 0.00 H new ATOM 0 HB ILE A 34 10.822 6.025 -4.455 1.00 0.00 H new ATOM 0 HG12 ILE A 34 7.953 6.309 -5.478 1.00 0.00 H new ATOM 0 HG13 ILE A 34 9.349 6.384 -6.536 1.00 0.00 H new ATOM 0 HG21 ILE A 34 9.018 5.070 -3.030 1.00 0.00 H new ATOM 0 HG22 ILE A 34 9.729 6.517 -2.276 1.00 0.00 H new ATOM 0 HG23 ILE A 34 8.151 6.623 -3.092 1.00 0.00 H new ATOM 0 HD11 ILE A 34 8.439 4.073 -6.449 1.00 0.00 H new ATOM 0 HD12 ILE A 34 10.078 4.124 -5.758 1.00 0.00 H new ATOM 0 HD13 ILE A 34 8.661 4.047 -4.684 1.00 0.00 H new ATOM 574 N GLU A 35 11.982 8.434 -3.181 1.00 0.00 N ATOM 575 CA GLU A 35 12.663 8.934 -1.996 1.00 0.00 C ATOM 576 C GLU A 35 12.532 10.436 -1.904 1.00 0.00 C ATOM 577 O GLU A 35 12.286 10.978 -0.832 1.00 0.00 O ATOM 578 CB GLU A 35 14.139 8.571 -1.980 1.00 0.00 C ATOM 579 CG GLU A 35 14.319 7.057 -1.998 1.00 0.00 C ATOM 580 CD GLU A 35 15.741 6.686 -1.627 1.00 0.00 C ATOM 581 OE1 GLU A 35 16.444 7.517 -1.077 1.00 0.00 O ATOM 582 OE2 GLU A 35 16.119 5.584 -1.896 1.00 0.00 O ATOM 0 H GLU A 35 12.581 7.980 -3.871 1.00 0.00 H new ATOM 0 HA GLU A 35 12.183 8.459 -1.140 1.00 0.00 H new ATOM 0 HB2 GLU A 35 14.637 9.012 -2.843 1.00 0.00 H new ATOM 0 HB3 GLU A 35 14.612 8.988 -1.091 1.00 0.00 H new ATOM 0 HG2 GLU A 35 13.622 6.594 -1.299 1.00 0.00 H new ATOM 0 HG3 GLU A 35 14.082 6.669 -2.989 1.00 0.00 H new ATOM 589 N LYS A 36 12.680 11.114 -3.023 1.00 0.00 N ATOM 590 CA LYS A 36 12.567 12.560 -3.018 1.00 0.00 C ATOM 591 C LYS A 36 11.097 12.951 -2.900 1.00 0.00 C ATOM 592 O LYS A 36 10.741 14.124 -3.021 1.00 0.00 O ATOM 593 CB LYS A 36 13.197 13.203 -4.277 1.00 0.00 C ATOM 594 CG LYS A 36 14.542 12.531 -4.677 1.00 0.00 C ATOM 595 CD LYS A 36 15.336 12.018 -3.452 1.00 0.00 C ATOM 596 CE LYS A 36 16.658 11.384 -3.928 1.00 0.00 C ATOM 597 NZ LYS A 36 17.742 12.400 -3.935 1.00 0.00 N ATOM 0 H LYS A 36 12.875 10.698 -3.933 1.00 0.00 H new ATOM 0 HA LYS A 36 13.122 12.938 -2.160 1.00 0.00 H new ATOM 0 HB2 LYS A 36 12.496 13.130 -5.108 1.00 0.00 H new ATOM 0 HB3 LYS A 36 13.365 14.264 -4.094 1.00 0.00 H new ATOM 0 HG2 LYS A 36 14.342 11.698 -5.351 1.00 0.00 H new ATOM 0 HG3 LYS A 36 15.152 13.247 -5.228 1.00 0.00 H new ATOM 0 HD2 LYS A 36 15.540 12.841 -2.767 1.00 0.00 H new ATOM 0 HD3 LYS A 36 14.745 11.285 -2.903 1.00 0.00 H new ATOM 0 HE2 LYS A 36 16.930 10.557 -3.272 1.00 0.00 H new ATOM 0 HE3 LYS A 36 16.532 10.970 -4.928 1.00 0.00 H new ATOM 0 HZ1 LYS A 36 18.628 11.960 -4.258 1.00 0.00 H new ATOM 0 HZ2 LYS A 36 17.486 13.176 -4.578 1.00 0.00 H new ATOM 0 HZ3 LYS A 36 17.872 12.776 -2.974 1.00 0.00 H new ATOM 611 N ASN A 37 10.240 11.941 -2.724 1.00 0.00 N ATOM 612 CA ASN A 37 8.799 12.130 -2.646 1.00 0.00 C ATOM 613 C ASN A 37 8.309 12.841 -3.881 1.00 0.00 C ATOM 614 O ASN A 37 7.399 13.680 -3.826 1.00 0.00 O ATOM 615 CB ASN A 37 8.414 12.914 -1.402 1.00 0.00 C ATOM 616 CG ASN A 37 8.687 12.098 -0.152 1.00 0.00 C ATOM 617 OD1 ASN A 37 8.797 10.874 -0.203 1.00 0.00 O ATOM 618 ND2 ASN A 37 8.832 12.702 0.965 1.00 0.00 N ATOM 0 H ASN A 37 10.533 10.968 -2.632 1.00 0.00 H new ATOM 0 HA ASN A 37 8.328 11.149 -2.583 1.00 0.00 H new ATOM 0 HB2 ASN A 37 8.977 13.847 -1.364 1.00 0.00 H new ATOM 0 HB3 ASN A 37 7.358 13.181 -1.446 1.00 0.00 H new ATOM 0 HD21 ASN A 37 9.038 12.169 1.810 1.00 0.00 H new ATOM 0 HD22 ASN A 37 8.742 13.717 1.011 1.00 0.00 H new ATOM 625 N LYS A 38 8.949 12.533 -4.986 1.00 0.00 N ATOM 626 CA LYS A 38 8.644 13.133 -6.266 1.00 0.00 C ATOM 627 C LYS A 38 7.208 12.782 -6.638 1.00 0.00 C ATOM 628 O LYS A 38 6.415 13.634 -7.041 1.00 0.00 O ATOM 629 CB LYS A 38 9.613 12.551 -7.297 1.00 0.00 C ATOM 630 CG LYS A 38 9.858 13.521 -8.448 1.00 0.00 C ATOM 631 CD LYS A 38 10.950 12.921 -9.345 1.00 0.00 C ATOM 632 CE LYS A 38 11.435 13.952 -10.357 1.00 0.00 C ATOM 633 NZ LYS A 38 10.288 14.514 -11.107 1.00 0.00 N ATOM 0 H LYS A 38 9.706 11.850 -5.022 1.00 0.00 H new ATOM 0 HA LYS A 38 8.747 14.218 -6.231 1.00 0.00 H new ATOM 0 HB2 LYS A 38 10.560 12.313 -6.813 1.00 0.00 H new ATOM 0 HB3 LYS A 38 9.211 11.616 -7.688 1.00 0.00 H new ATOM 0 HG2 LYS A 38 8.941 13.679 -9.016 1.00 0.00 H new ATOM 0 HG3 LYS A 38 10.168 14.494 -8.068 1.00 0.00 H new ATOM 0 HD2 LYS A 38 11.786 12.582 -8.733 1.00 0.00 H new ATOM 0 HD3 LYS A 38 10.561 12.046 -9.866 1.00 0.00 H new ATOM 0 HE2 LYS A 38 11.970 14.751 -9.844 1.00 0.00 H new ATOM 0 HE3 LYS A 38 12.139 13.490 -11.049 1.00 0.00 H new ATOM 0 HZ1 LYS A 38 10.636 15.013 -11.950 1.00 0.00 H new ATOM 0 HZ2 LYS A 38 9.653 13.744 -11.398 1.00 0.00 H new ATOM 0 HZ3 LYS A 38 9.769 15.180 -10.500 1.00 0.00 H new ATOM 647 N TYR A 39 6.877 11.524 -6.427 1.00 0.00 N ATOM 648 CA TYR A 39 5.540 10.992 -6.656 1.00 0.00 C ATOM 649 C TYR A 39 5.284 9.842 -5.697 1.00 0.00 C ATOM 650 O TYR A 39 6.232 9.215 -5.209 1.00 0.00 O ATOM 651 CB TYR A 39 5.404 10.509 -8.108 1.00 0.00 C ATOM 652 CG TYR A 39 6.551 9.582 -8.432 1.00 0.00 C ATOM 653 CD1 TYR A 39 6.445 8.208 -8.189 1.00 0.00 C ATOM 654 CD2 TYR A 39 7.727 10.107 -8.973 1.00 0.00 C ATOM 655 CE1 TYR A 39 7.519 7.365 -8.485 1.00 0.00 C ATOM 656 CE2 TYR A 39 8.796 9.271 -9.267 1.00 0.00 C ATOM 657 CZ TYR A 39 8.697 7.899 -9.025 1.00 0.00 C ATOM 658 OH TYR A 39 9.758 7.076 -9.321 1.00 0.00 O ATOM 0 H TYR A 39 7.538 10.827 -6.085 1.00 0.00 H new ATOM 0 HA TYR A 39 4.805 11.778 -6.482 1.00 0.00 H new ATOM 0 HB2 TYR A 39 4.454 9.993 -8.245 1.00 0.00 H new ATOM 0 HB3 TYR A 39 5.405 11.360 -8.789 1.00 0.00 H new ATOM 0 HD1 TYR A 39 5.535 7.800 -7.774 1.00 0.00 H new ATOM 0 HD2 TYR A 39 7.805 11.167 -9.163 1.00 0.00 H new ATOM 0 HE1 TYR A 39 7.442 6.304 -8.298 1.00 0.00 H new ATOM 0 HE2 TYR A 39 9.704 9.682 -9.683 1.00 0.00 H new ATOM 0 HH TYR A 39 10.420 7.123 -8.600 1.00 0.00 H new ATOM 668 N ASN A 40 4.022 9.535 -5.458 1.00 0.00 N ATOM 669 CA ASN A 40 3.668 8.414 -4.586 1.00 0.00 C ATOM 670 C ASN A 40 3.621 7.119 -5.386 1.00 0.00 C ATOM 671 O ASN A 40 2.925 7.037 -6.398 1.00 0.00 O ATOM 672 CB ASN A 40 2.320 8.650 -3.884 1.00 0.00 C ATOM 673 CG ASN A 40 2.516 9.538 -2.659 1.00 0.00 C ATOM 674 OD1 ASN A 40 2.885 9.010 -1.531 1.00 0.00 O flip ATOM 675 ND2 ASN A 40 2.328 10.749 -2.734 1.00 0.00 N flip ATOM 0 H ASN A 40 3.225 10.038 -5.849 1.00 0.00 H new ATOM 0 HA ASN A 40 4.437 8.334 -3.818 1.00 0.00 H new ATOM 0 HB2 ASN A 40 1.619 9.119 -4.574 1.00 0.00 H new ATOM 0 HB3 ASN A 40 1.884 7.696 -3.586 1.00 0.00 H new ATOM 0 HD21 ASN A 40 2.038 11.166 -3.618 1.00 0.00 H new ATOM 0 HD22 ASN A 40 2.462 11.338 -1.912 1.00 0.00 H new ATOM 682 N PRO A 41 4.372 6.129 -4.978 1.00 0.00 N ATOM 683 CA PRO A 41 4.448 4.833 -5.715 1.00 0.00 C ATOM 684 C PRO A 41 3.146 4.049 -5.661 1.00 0.00 C ATOM 685 O PRO A 41 2.317 4.254 -4.770 1.00 0.00 O ATOM 686 CB PRO A 41 5.561 4.076 -4.995 1.00 0.00 C ATOM 687 CG PRO A 41 5.492 4.569 -3.593 1.00 0.00 C ATOM 688 CD PRO A 41 5.085 6.047 -3.685 1.00 0.00 C ATOM 0 HA PRO A 41 4.637 4.985 -6.778 1.00 0.00 H new ATOM 0 HB2 PRO A 41 5.407 2.998 -5.046 1.00 0.00 H new ATOM 0 HB3 PRO A 41 6.534 4.280 -5.441 1.00 0.00 H new ATOM 0 HG2 PRO A 41 4.765 3.999 -3.014 1.00 0.00 H new ATOM 0 HG3 PRO A 41 6.454 4.459 -3.093 1.00 0.00 H new ATOM 0 HD2 PRO A 41 4.443 6.339 -2.854 1.00 0.00 H new ATOM 0 HD3 PRO A 41 5.954 6.705 -3.663 1.00 0.00 H new ATOM 696 N SER A 42 2.974 3.163 -6.616 1.00 0.00 N ATOM 697 CA SER A 42 1.795 2.326 -6.679 1.00 0.00 C ATOM 698 C SER A 42 1.806 1.320 -5.525 1.00 0.00 C ATOM 699 O SER A 42 2.852 1.081 -4.906 1.00 0.00 O ATOM 700 CB SER A 42 1.741 1.600 -8.020 1.00 0.00 C ATOM 701 OG SER A 42 2.044 2.528 -9.068 1.00 0.00 O ATOM 0 H SER A 42 3.644 3.002 -7.368 1.00 0.00 H new ATOM 0 HA SER A 42 0.907 2.952 -6.587 1.00 0.00 H new ATOM 0 HB2 SER A 42 2.454 0.775 -8.030 1.00 0.00 H new ATOM 0 HB3 SER A 42 0.752 1.168 -8.174 1.00 0.00 H new ATOM 0 HG SER A 42 2.013 2.067 -9.932 1.00 0.00 H new ATOM 707 N LEU A 43 0.652 0.730 -5.243 1.00 0.00 N ATOM 708 CA LEU A 43 0.525 -0.200 -4.126 1.00 0.00 C ATOM 709 C LEU A 43 1.444 -1.394 -4.317 1.00 0.00 C ATOM 710 O LEU A 43 2.106 -1.837 -3.378 1.00 0.00 O ATOM 711 CB LEU A 43 -0.934 -0.663 -3.970 1.00 0.00 C ATOM 712 CG LEU A 43 -1.056 -1.649 -2.797 1.00 0.00 C ATOM 713 CD1 LEU A 43 -0.544 -0.995 -1.519 1.00 0.00 C ATOM 714 CD2 LEU A 43 -2.526 -2.030 -2.599 1.00 0.00 C ATOM 0 H LEU A 43 -0.209 0.878 -5.770 1.00 0.00 H new ATOM 0 HA LEU A 43 0.821 0.319 -3.214 1.00 0.00 H new ATOM 0 HB2 LEU A 43 -1.580 0.198 -3.799 1.00 0.00 H new ATOM 0 HB3 LEU A 43 -1.273 -1.138 -4.891 1.00 0.00 H new ATOM 0 HG LEU A 43 -0.466 -2.539 -3.019 1.00 0.00 H new ATOM 0 HD11 LEU A 43 -0.632 -1.697 -0.690 1.00 0.00 H new ATOM 0 HD12 LEU A 43 0.502 -0.715 -1.647 1.00 0.00 H new ATOM 0 HD13 LEU A 43 -1.135 -0.104 -1.304 1.00 0.00 H new ATOM 0 HD21 LEU A 43 -2.612 -2.729 -1.767 1.00 0.00 H new ATOM 0 HD22 LEU A 43 -3.108 -1.134 -2.382 1.00 0.00 H new ATOM 0 HD23 LEU A 43 -2.906 -2.498 -3.507 1.00 0.00 H new ATOM 726 N GLN A 44 1.500 -1.901 -5.535 1.00 0.00 N ATOM 727 CA GLN A 44 2.348 -3.051 -5.837 1.00 0.00 C ATOM 728 C GLN A 44 3.792 -2.745 -5.476 1.00 0.00 C ATOM 729 O GLN A 44 4.449 -3.516 -4.779 1.00 0.00 O ATOM 730 CB GLN A 44 2.274 -3.333 -7.335 1.00 0.00 C ATOM 731 CG GLN A 44 3.110 -4.561 -7.695 1.00 0.00 C ATOM 732 CD GLN A 44 3.071 -4.756 -9.198 1.00 0.00 C ATOM 733 OE1 GLN A 44 3.209 -3.792 -9.947 1.00 0.00 O ATOM 734 NE2 GLN A 44 2.897 -5.928 -9.683 1.00 0.00 N ATOM 0 H GLN A 44 0.973 -1.541 -6.331 1.00 0.00 H new ATOM 0 HA GLN A 44 2.004 -3.911 -5.262 1.00 0.00 H new ATOM 0 HB2 GLN A 44 1.237 -3.494 -7.629 1.00 0.00 H new ATOM 0 HB3 GLN A 44 2.632 -2.467 -7.891 1.00 0.00 H new ATOM 0 HG2 GLN A 44 4.138 -4.429 -7.358 1.00 0.00 H new ATOM 0 HG3 GLN A 44 2.720 -5.444 -7.190 1.00 0.00 H new ATOM 0 HE21 GLN A 44 2.783 -6.726 -9.059 1.00 0.00 H new ATOM 0 HE22 GLN A 44 2.873 -6.063 -10.694 1.00 0.00 H new ATOM 743 N LEU A 45 4.261 -1.605 -5.928 1.00 0.00 N ATOM 744 CA LEU A 45 5.620 -1.178 -5.644 1.00 0.00 C ATOM 745 C LEU A 45 5.794 -0.978 -4.152 1.00 0.00 C ATOM 746 O LEU A 45 6.782 -1.416 -3.564 1.00 0.00 O ATOM 747 CB LEU A 45 5.923 0.136 -6.375 1.00 0.00 C ATOM 748 CG LEU A 45 5.946 -0.100 -7.892 1.00 0.00 C ATOM 749 CD1 LEU A 45 6.047 1.250 -8.618 1.00 0.00 C ATOM 750 CD2 LEU A 45 7.153 -0.972 -8.267 1.00 0.00 C ATOM 0 H LEU A 45 3.722 -0.951 -6.496 1.00 0.00 H new ATOM 0 HA LEU A 45 6.310 -1.947 -5.990 1.00 0.00 H new ATOM 0 HB2 LEU A 45 5.169 0.882 -6.126 1.00 0.00 H new ATOM 0 HB3 LEU A 45 6.884 0.532 -6.046 1.00 0.00 H new ATOM 0 HG LEU A 45 5.029 -0.609 -8.189 1.00 0.00 H new ATOM 0 HD11 LEU A 45 6.063 1.084 -9.695 1.00 0.00 H new ATOM 0 HD12 LEU A 45 5.187 1.867 -8.359 1.00 0.00 H new ATOM 0 HD13 LEU A 45 6.963 1.758 -8.315 1.00 0.00 H new ATOM 0 HD21 LEU A 45 7.163 -1.135 -9.345 1.00 0.00 H new ATOM 0 HD22 LEU A 45 8.072 -0.469 -7.968 1.00 0.00 H new ATOM 0 HD23 LEU A 45 7.082 -1.932 -7.755 1.00 0.00 H new ATOM 762 N ALA A 46 4.799 -0.353 -3.539 1.00 0.00 N ATOM 763 CA ALA A 46 4.825 -0.114 -2.108 1.00 0.00 C ATOM 764 C ALA A 46 4.907 -1.428 -1.355 1.00 0.00 C ATOM 765 O ALA A 46 5.779 -1.616 -0.501 1.00 0.00 O ATOM 766 CB ALA A 46 3.580 0.664 -1.676 1.00 0.00 C ATOM 0 H ALA A 46 3.966 -0.004 -4.012 1.00 0.00 H new ATOM 0 HA ALA A 46 5.708 0.480 -1.872 1.00 0.00 H new ATOM 0 HB1 ALA A 46 3.613 0.836 -0.600 1.00 0.00 H new ATOM 0 HB2 ALA A 46 3.551 1.622 -2.196 1.00 0.00 H new ATOM 0 HB3 ALA A 46 2.688 0.089 -1.924 1.00 0.00 H new ATOM 772 N LEU A 47 4.043 -2.363 -1.721 1.00 0.00 N ATOM 773 CA LEU A 47 4.068 -3.679 -1.106 1.00 0.00 C ATOM 774 C LEU A 47 5.366 -4.399 -1.390 1.00 0.00 C ATOM 775 O LEU A 47 5.942 -5.021 -0.490 1.00 0.00 O ATOM 776 CB LEU A 47 2.878 -4.531 -1.534 1.00 0.00 C ATOM 777 CG LEU A 47 1.596 -3.999 -0.883 1.00 0.00 C ATOM 778 CD1 LEU A 47 0.387 -4.681 -1.513 1.00 0.00 C ATOM 779 CD2 LEU A 47 1.621 -4.323 0.618 1.00 0.00 C ATOM 0 H LEU A 47 3.324 -2.236 -2.433 1.00 0.00 H new ATOM 0 HA LEU A 47 3.994 -3.523 -0.030 1.00 0.00 H new ATOM 0 HB2 LEU A 47 2.779 -4.515 -2.619 1.00 0.00 H new ATOM 0 HB3 LEU A 47 3.040 -5.569 -1.244 1.00 0.00 H new ATOM 0 HG LEU A 47 1.532 -2.921 -1.032 1.00 0.00 H new ATOM 0 HD11 LEU A 47 -0.525 -4.304 -1.051 1.00 0.00 H new ATOM 0 HD12 LEU A 47 0.366 -4.470 -2.582 1.00 0.00 H new ATOM 0 HD13 LEU A 47 0.454 -5.758 -1.357 1.00 0.00 H new ATOM 0 HD21 LEU A 47 0.712 -3.947 1.087 1.00 0.00 H new ATOM 0 HD22 LEU A 47 1.681 -5.403 0.756 1.00 0.00 H new ATOM 0 HD23 LEU A 47 2.488 -3.850 1.078 1.00 0.00 H new ATOM 791 N LYS A 48 5.861 -4.292 -2.620 1.00 0.00 N ATOM 792 CA LYS A 48 7.112 -4.940 -2.938 1.00 0.00 C ATOM 793 C LYS A 48 8.209 -4.423 -2.034 1.00 0.00 C ATOM 794 O LYS A 48 8.980 -5.203 -1.483 1.00 0.00 O ATOM 795 CB LYS A 48 7.522 -4.696 -4.390 1.00 0.00 C ATOM 796 CG LYS A 48 6.951 -5.796 -5.289 1.00 0.00 C ATOM 797 CD LYS A 48 7.323 -5.504 -6.759 1.00 0.00 C ATOM 798 CE LYS A 48 7.912 -6.776 -7.420 1.00 0.00 C ATOM 799 NZ LYS A 48 9.066 -6.434 -8.308 1.00 0.00 N ATOM 0 H LYS A 48 5.425 -3.778 -3.386 1.00 0.00 H new ATOM 0 HA LYS A 48 6.969 -6.010 -2.789 1.00 0.00 H new ATOM 0 HB2 LYS A 48 7.160 -3.722 -4.719 1.00 0.00 H new ATOM 0 HB3 LYS A 48 8.609 -4.677 -4.471 1.00 0.00 H new ATOM 0 HG2 LYS A 48 7.345 -6.767 -4.989 1.00 0.00 H new ATOM 0 HG3 LYS A 48 5.868 -5.844 -5.179 1.00 0.00 H new ATOM 0 HD2 LYS A 48 6.440 -5.175 -7.307 1.00 0.00 H new ATOM 0 HD3 LYS A 48 8.048 -4.692 -6.805 1.00 0.00 H new ATOM 0 HE2 LYS A 48 8.237 -7.474 -6.648 1.00 0.00 H new ATOM 0 HE3 LYS A 48 7.139 -7.280 -8.000 1.00 0.00 H new ATOM 0 HZ1 LYS A 48 9.269 -7.236 -8.938 1.00 0.00 H new ATOM 0 HZ2 LYS A 48 8.829 -5.597 -8.878 1.00 0.00 H new ATOM 0 HZ3 LYS A 48 9.904 -6.231 -7.726 1.00 0.00 H new ATOM 813 N ILE A 49 8.254 -3.116 -1.839 1.00 0.00 N ATOM 814 CA ILE A 49 9.281 -2.553 -0.986 1.00 0.00 C ATOM 815 C ILE A 49 9.104 -3.092 0.420 1.00 0.00 C ATOM 816 O ILE A 49 10.061 -3.558 1.048 1.00 0.00 O ATOM 817 CB ILE A 49 9.186 -1.015 -0.965 1.00 0.00 C ATOM 818 CG1 ILE A 49 9.540 -0.448 -2.338 1.00 0.00 C ATOM 819 CG2 ILE A 49 10.165 -0.441 0.068 1.00 0.00 C ATOM 820 CD1 ILE A 49 9.222 1.051 -2.368 1.00 0.00 C ATOM 0 H ILE A 49 7.608 -2.441 -2.249 1.00 0.00 H new ATOM 0 HA ILE A 49 10.260 -2.833 -1.375 1.00 0.00 H new ATOM 0 HB ILE A 49 8.165 -0.738 -0.702 1.00 0.00 H new ATOM 0 HG12 ILE A 49 10.597 -0.611 -2.549 1.00 0.00 H new ATOM 0 HG13 ILE A 49 8.976 -0.966 -3.114 1.00 0.00 H new ATOM 0 HG21 ILE A 49 10.090 0.646 0.075 1.00 0.00 H new ATOM 0 HG22 ILE A 49 9.919 -0.828 1.057 1.00 0.00 H new ATOM 0 HG23 ILE A 49 11.182 -0.733 -0.193 1.00 0.00 H new ATOM 0 HD11 ILE A 49 9.474 1.457 -3.348 1.00 0.00 H new ATOM 0 HD12 ILE A 49 8.160 1.202 -2.175 1.00 0.00 H new ATOM 0 HD13 ILE A 49 9.806 1.562 -1.602 1.00 0.00 H new ATOM 832 N ALA A 50 7.865 -3.092 0.882 1.00 0.00 N ATOM 833 CA ALA A 50 7.567 -3.609 2.199 1.00 0.00 C ATOM 834 C ALA A 50 7.954 -5.069 2.283 1.00 0.00 C ATOM 835 O ALA A 50 8.690 -5.482 3.189 1.00 0.00 O ATOM 836 CB ALA A 50 6.070 -3.450 2.510 1.00 0.00 C ATOM 0 H ALA A 50 7.058 -2.742 0.366 1.00 0.00 H new ATOM 0 HA ALA A 50 8.142 -3.043 2.932 1.00 0.00 H new ATOM 0 HB1 ALA A 50 5.861 -3.844 3.505 1.00 0.00 H new ATOM 0 HB2 ALA A 50 5.801 -2.394 2.474 1.00 0.00 H new ATOM 0 HB3 ALA A 50 5.485 -3.999 1.772 1.00 0.00 H new ATOM 842 N TYR A 51 7.471 -5.846 1.325 1.00 0.00 N ATOM 843 CA TYR A 51 7.750 -7.269 1.294 1.00 0.00 C ATOM 844 C TYR A 51 9.240 -7.525 1.138 1.00 0.00 C ATOM 845 O TYR A 51 9.821 -8.296 1.893 1.00 0.00 O ATOM 846 CB TYR A 51 6.997 -7.943 0.142 1.00 0.00 C ATOM 847 CG TYR A 51 7.243 -9.435 0.192 1.00 0.00 C ATOM 848 CD1 TYR A 51 8.385 -9.982 -0.406 1.00 0.00 C ATOM 849 CD2 TYR A 51 6.321 -10.271 0.832 1.00 0.00 C ATOM 850 CE1 TYR A 51 8.603 -11.361 -0.360 1.00 0.00 C ATOM 851 CE2 TYR A 51 6.539 -11.647 0.878 1.00 0.00 C ATOM 852 CZ TYR A 51 7.679 -12.194 0.283 1.00 0.00 C ATOM 853 OH TYR A 51 7.889 -13.553 0.329 1.00 0.00 O ATOM 0 H TYR A 51 6.884 -5.513 0.560 1.00 0.00 H new ATOM 0 HA TYR A 51 7.413 -7.692 2.240 1.00 0.00 H new ATOM 0 HB2 TYR A 51 5.930 -7.736 0.219 1.00 0.00 H new ATOM 0 HB3 TYR A 51 7.332 -7.539 -0.813 1.00 0.00 H new ATOM 0 HD1 TYR A 51 9.096 -9.338 -0.902 1.00 0.00 H new ATOM 0 HD2 TYR A 51 5.439 -9.849 1.291 1.00 0.00 H new ATOM 0 HE1 TYR A 51 9.484 -11.784 -0.820 1.00 0.00 H new ATOM 0 HE2 TYR A 51 5.827 -12.290 1.373 1.00 0.00 H new ATOM 0 HH TYR A 51 7.153 -13.982 0.813 1.00 0.00 H new ATOM 863 N TYR A 52 9.863 -6.863 0.165 1.00 0.00 N ATOM 864 CA TYR A 52 11.286 -7.077 -0.091 1.00 0.00 C ATOM 865 C TYR A 52 12.105 -6.710 1.116 1.00 0.00 C ATOM 866 O TYR A 52 13.045 -7.413 1.480 1.00 0.00 O ATOM 867 CB TYR A 52 11.771 -6.264 -1.291 1.00 0.00 C ATOM 868 CG TYR A 52 11.371 -6.935 -2.586 1.00 0.00 C ATOM 869 CD1 TYR A 52 11.808 -8.235 -2.875 1.00 0.00 C ATOM 870 CD2 TYR A 52 10.571 -6.252 -3.505 1.00 0.00 C ATOM 871 CE1 TYR A 52 11.444 -8.840 -4.078 1.00 0.00 C ATOM 872 CE2 TYR A 52 10.213 -6.858 -4.705 1.00 0.00 C ATOM 873 CZ TYR A 52 10.646 -8.150 -4.993 1.00 0.00 C ATOM 874 OH TYR A 52 10.300 -8.743 -6.188 1.00 0.00 O ATOM 0 H TYR A 52 9.414 -6.185 -0.450 1.00 0.00 H new ATOM 0 HA TYR A 52 11.414 -8.137 -0.312 1.00 0.00 H new ATOM 0 HB2 TYR A 52 11.350 -5.259 -1.251 1.00 0.00 H new ATOM 0 HB3 TYR A 52 12.855 -6.157 -1.250 1.00 0.00 H new ATOM 0 HD1 TYR A 52 12.426 -8.768 -2.167 1.00 0.00 H new ATOM 0 HD2 TYR A 52 10.230 -5.252 -3.284 1.00 0.00 H new ATOM 0 HE1 TYR A 52 11.779 -9.842 -4.302 1.00 0.00 H new ATOM 0 HE2 TYR A 52 9.598 -6.325 -5.415 1.00 0.00 H new ATOM 0 HH TYR A 52 10.538 -8.148 -6.929 1.00 0.00 H new ATOM 884 N LEU A 53 11.750 -5.613 1.742 1.00 0.00 N ATOM 885 CA LEU A 53 12.469 -5.171 2.912 1.00 0.00 C ATOM 886 C LEU A 53 11.946 -5.884 4.142 1.00 0.00 C ATOM 887 O LEU A 53 12.363 -5.584 5.260 1.00 0.00 O ATOM 888 CB LEU A 53 12.360 -3.648 3.082 1.00 0.00 C ATOM 889 CG LEU A 53 12.978 -2.941 1.859 1.00 0.00 C ATOM 890 CD1 LEU A 53 12.831 -1.426 2.003 1.00 0.00 C ATOM 891 CD2 LEU A 53 14.462 -3.310 1.726 1.00 0.00 C ATOM 0 H LEU A 53 10.973 -5.014 1.463 1.00 0.00 H new ATOM 0 HA LEU A 53 13.523 -5.418 2.783 1.00 0.00 H new ATOM 0 HB2 LEU A 53 11.315 -3.359 3.191 1.00 0.00 H new ATOM 0 HB3 LEU A 53 12.873 -3.337 3.992 1.00 0.00 H new ATOM 0 HG LEU A 53 12.452 -3.268 0.962 1.00 0.00 H new ATOM 0 HD11 LEU A 53 13.270 -0.934 1.135 1.00 0.00 H new ATOM 0 HD12 LEU A 53 11.774 -1.168 2.071 1.00 0.00 H new ATOM 0 HD13 LEU A 53 13.344 -1.095 2.906 1.00 0.00 H new ATOM 0 HD21 LEU A 53 14.886 -2.804 0.859 1.00 0.00 H new ATOM 0 HD22 LEU A 53 14.996 -3.000 2.624 1.00 0.00 H new ATOM 0 HD23 LEU A 53 14.559 -4.388 1.601 1.00 0.00 H new ATOM 903 N ASN A 54 10.939 -6.744 3.946 1.00 0.00 N ATOM 904 CA ASN A 54 10.306 -7.449 5.062 1.00 0.00 C ATOM 905 C ASN A 54 9.921 -6.449 6.129 1.00 0.00 C ATOM 906 O ASN A 54 9.994 -6.726 7.325 1.00 0.00 O ATOM 907 CB ASN A 54 11.240 -8.527 5.646 1.00 0.00 C ATOM 908 CG ASN A 54 11.234 -9.793 4.782 1.00 0.00 C ATOM 909 OD1 ASN A 54 11.629 -10.866 5.249 1.00 0.00 O ATOM 910 ND2 ASN A 54 10.817 -9.747 3.556 1.00 0.00 N ATOM 0 H ASN A 54 10.549 -6.966 3.030 1.00 0.00 H new ATOM 0 HA ASN A 54 9.413 -7.954 4.695 1.00 0.00 H new ATOM 0 HB2 ASN A 54 12.255 -8.135 5.714 1.00 0.00 H new ATOM 0 HB3 ASN A 54 10.925 -8.774 6.660 1.00 0.00 H new ATOM 0 HD21 ASN A 54 10.817 -10.592 2.985 1.00 0.00 H new ATOM 0 HD22 ASN A 54 10.489 -8.865 3.162 1.00 0.00 H new ATOM 917 N THR A 55 9.563 -5.271 5.683 1.00 0.00 N ATOM 918 CA THR A 55 9.205 -4.179 6.559 1.00 0.00 C ATOM 919 C THR A 55 7.784 -3.757 6.241 1.00 0.00 C ATOM 920 O THR A 55 7.366 -3.847 5.089 1.00 0.00 O ATOM 921 CB THR A 55 10.182 -3.015 6.327 1.00 0.00 C ATOM 922 OG1 THR A 55 11.522 -3.524 6.280 1.00 0.00 O ATOM 923 CG2 THR A 55 10.065 -1.989 7.454 1.00 0.00 C ATOM 0 H THR A 55 9.511 -5.039 4.691 1.00 0.00 H new ATOM 0 HA THR A 55 9.263 -4.482 7.605 1.00 0.00 H new ATOM 0 HB THR A 55 9.937 -2.528 5.383 1.00 0.00 H new ATOM 0 HG1 THR A 55 11.502 -4.477 6.051 1.00 0.00 H new ATOM 0 HG21 THR A 55 10.763 -1.171 7.275 1.00 0.00 H new ATOM 0 HG22 THR A 55 9.048 -1.598 7.486 1.00 0.00 H new ATOM 0 HG23 THR A 55 10.300 -2.465 8.406 1.00 0.00 H new ATOM 931 N PRO A 56 7.006 -3.385 7.224 1.00 0.00 N ATOM 932 CA PRO A 56 5.581 -3.041 6.952 1.00 0.00 C ATOM 933 C PRO A 56 5.467 -1.907 5.945 1.00 0.00 C ATOM 934 O PRO A 56 6.194 -0.911 6.030 1.00 0.00 O ATOM 935 CB PRO A 56 5.038 -2.606 8.318 1.00 0.00 C ATOM 936 CG PRO A 56 5.930 -3.272 9.303 1.00 0.00 C ATOM 937 CD PRO A 56 7.313 -3.278 8.666 1.00 0.00 C ATOM 0 HA PRO A 56 5.030 -3.877 6.521 1.00 0.00 H new ATOM 0 HB2 PRO A 56 5.064 -1.522 8.428 1.00 0.00 H new ATOM 0 HB3 PRO A 56 4.001 -2.915 8.449 1.00 0.00 H new ATOM 0 HG2 PRO A 56 5.938 -2.734 10.251 1.00 0.00 H new ATOM 0 HG3 PRO A 56 5.592 -4.286 9.515 1.00 0.00 H new ATOM 0 HD2 PRO A 56 7.868 -2.369 8.895 1.00 0.00 H new ATOM 0 HD3 PRO A 56 7.916 -4.116 9.015 1.00 0.00 H new ATOM 945 N LEU A 57 4.501 -2.019 5.055 1.00 0.00 N ATOM 946 CA LEU A 57 4.245 -0.980 4.068 1.00 0.00 C ATOM 947 C LEU A 57 3.861 0.292 4.783 1.00 0.00 C ATOM 948 O LEU A 57 4.278 1.392 4.405 1.00 0.00 O ATOM 949 CB LEU A 57 3.114 -1.414 3.119 1.00 0.00 C ATOM 950 CG LEU A 57 2.844 -0.311 2.076 1.00 0.00 C ATOM 951 CD1 LEU A 57 2.176 -0.919 0.849 1.00 0.00 C ATOM 952 CD2 LEU A 57 1.915 0.754 2.670 1.00 0.00 C ATOM 0 H LEU A 57 3.876 -2.822 4.992 1.00 0.00 H new ATOM 0 HA LEU A 57 5.145 -0.811 3.476 1.00 0.00 H new ATOM 0 HB2 LEU A 57 3.387 -2.342 2.616 1.00 0.00 H new ATOM 0 HB3 LEU A 57 2.207 -1.615 3.690 1.00 0.00 H new ATOM 0 HG LEU A 57 3.792 0.147 1.794 1.00 0.00 H new ATOM 0 HD11 LEU A 57 1.986 -0.137 0.113 1.00 0.00 H new ATOM 0 HD12 LEU A 57 2.831 -1.675 0.415 1.00 0.00 H new ATOM 0 HD13 LEU A 57 1.232 -1.381 1.140 1.00 0.00 H new ATOM 0 HD21 LEU A 57 1.729 1.530 1.927 1.00 0.00 H new ATOM 0 HD22 LEU A 57 0.970 0.293 2.958 1.00 0.00 H new ATOM 0 HD23 LEU A 57 2.384 1.198 3.548 1.00 0.00 H new ATOM 964 N GLU A 58 3.067 0.123 5.817 1.00 0.00 N ATOM 965 CA GLU A 58 2.569 1.217 6.608 1.00 0.00 C ATOM 966 C GLU A 58 3.740 2.016 7.154 1.00 0.00 C ATOM 967 O GLU A 58 3.698 3.245 7.196 1.00 0.00 O ATOM 968 CB GLU A 58 1.739 0.659 7.775 1.00 0.00 C ATOM 969 CG GLU A 58 0.575 -0.212 7.236 1.00 0.00 C ATOM 970 CD GLU A 58 1.051 -1.635 6.922 1.00 0.00 C ATOM 971 OE1 GLU A 58 2.235 -1.883 7.007 1.00 0.00 O ATOM 972 OE2 GLU A 58 0.225 -2.458 6.607 1.00 0.00 O ATOM 0 H GLU A 58 2.747 -0.792 6.133 1.00 0.00 H new ATOM 0 HA GLU A 58 1.944 1.864 5.992 1.00 0.00 H new ATOM 0 HB2 GLU A 58 2.374 0.064 8.431 1.00 0.00 H new ATOM 0 HB3 GLU A 58 1.342 1.479 8.373 1.00 0.00 H new ATOM 0 HG2 GLU A 58 -0.228 -0.248 7.972 1.00 0.00 H new ATOM 0 HG3 GLU A 58 0.162 0.244 6.336 1.00 0.00 H new ATOM 979 N ASP A 59 4.810 1.310 7.526 1.00 0.00 N ATOM 980 CA ASP A 59 6.012 1.977 8.011 1.00 0.00 C ATOM 981 C ASP A 59 6.609 2.816 6.914 1.00 0.00 C ATOM 982 O ASP A 59 7.157 3.890 7.169 1.00 0.00 O ATOM 983 CB ASP A 59 7.065 0.959 8.515 1.00 0.00 C ATOM 984 CG ASP A 59 8.189 1.680 9.260 1.00 0.00 C ATOM 985 OD1 ASP A 59 7.880 2.533 10.061 1.00 0.00 O ATOM 986 OD2 ASP A 59 9.349 1.360 9.032 1.00 0.00 O ATOM 0 H ASP A 59 4.866 0.292 7.500 1.00 0.00 H new ATOM 0 HA ASP A 59 5.725 2.611 8.850 1.00 0.00 H new ATOM 0 HB2 ASP A 59 6.591 0.232 9.174 1.00 0.00 H new ATOM 0 HB3 ASP A 59 7.476 0.404 7.672 1.00 0.00 H new ATOM 991 N ILE A 60 6.495 2.333 5.685 1.00 0.00 N ATOM 992 CA ILE A 60 7.071 3.028 4.550 1.00 0.00 C ATOM 993 C ILE A 60 6.143 4.128 4.102 1.00 0.00 C ATOM 994 O ILE A 60 6.560 5.284 3.935 1.00 0.00 O ATOM 995 CB ILE A 60 7.284 2.058 3.372 1.00 0.00 C ATOM 996 CG1 ILE A 60 8.042 0.799 3.823 1.00 0.00 C ATOM 997 CG2 ILE A 60 8.112 2.761 2.297 1.00 0.00 C ATOM 998 CD1 ILE A 60 8.002 -0.244 2.704 1.00 0.00 C ATOM 0 H ILE A 60 6.011 1.466 5.452 1.00 0.00 H new ATOM 0 HA ILE A 60 8.031 3.444 4.856 1.00 0.00 H new ATOM 0 HB ILE A 60 6.308 1.764 2.986 1.00 0.00 H new ATOM 0 HG12 ILE A 60 9.075 1.050 4.065 1.00 0.00 H new ATOM 0 HG13 ILE A 60 7.591 0.394 4.729 1.00 0.00 H new ATOM 0 HG21 ILE A 60 8.269 2.083 1.458 1.00 0.00 H new ATOM 0 HG22 ILE A 60 7.582 3.649 1.952 1.00 0.00 H new ATOM 0 HG23 ILE A 60 9.076 3.053 2.713 1.00 0.00 H new ATOM 0 HD11 ILE A 60 8.539 -1.138 3.021 1.00 0.00 H new ATOM 0 HD12 ILE A 60 6.966 -0.502 2.484 1.00 0.00 H new ATOM 0 HD13 ILE A 60 8.473 0.164 1.809 1.00 0.00 H new ATOM 1010 N PHE A 61 4.899 3.765 3.877 1.00 0.00 N ATOM 1011 CA PHE A 61 3.914 4.708 3.415 1.00 0.00 C ATOM 1012 C PHE A 61 2.765 4.779 4.384 1.00 0.00 C ATOM 1013 O PHE A 61 1.894 3.911 4.389 1.00 0.00 O ATOM 1014 CB PHE A 61 3.416 4.316 2.022 1.00 0.00 C ATOM 1015 CG PHE A 61 4.595 4.226 1.083 1.00 0.00 C ATOM 1016 CD1 PHE A 61 5.215 5.392 0.616 1.00 0.00 C ATOM 1017 CD2 PHE A 61 5.074 2.971 0.691 1.00 0.00 C ATOM 1018 CE1 PHE A 61 6.314 5.295 -0.245 1.00 0.00 C ATOM 1019 CE2 PHE A 61 6.171 2.876 -0.165 1.00 0.00 C ATOM 1020 CZ PHE A 61 6.791 4.035 -0.635 1.00 0.00 C ATOM 0 H PHE A 61 4.548 2.816 4.009 1.00 0.00 H new ATOM 0 HA PHE A 61 4.376 5.693 3.353 1.00 0.00 H new ATOM 0 HB2 PHE A 61 2.895 3.359 2.064 1.00 0.00 H new ATOM 0 HB3 PHE A 61 2.700 5.053 1.657 1.00 0.00 H new ATOM 0 HD1 PHE A 61 4.847 6.361 0.919 1.00 0.00 H new ATOM 0 HD2 PHE A 61 4.593 2.074 1.052 1.00 0.00 H new ATOM 0 HE1 PHE A 61 6.795 6.191 -0.609 1.00 0.00 H new ATOM 0 HE2 PHE A 61 6.541 1.906 -0.464 1.00 0.00 H new ATOM 0 HZ PHE A 61 7.639 3.961 -1.300 1.00 0.00 H new ATOM 1030 N GLN A 62 2.725 5.839 5.163 1.00 0.00 N ATOM 1031 CA GLN A 62 1.625 6.032 6.090 1.00 0.00 C ATOM 1032 C GLN A 62 0.705 7.129 5.600 1.00 0.00 C ATOM 1033 O GLN A 62 1.153 8.233 5.268 1.00 0.00 O ATOM 1034 CB GLN A 62 2.114 6.310 7.532 1.00 0.00 C ATOM 1035 CG GLN A 62 3.333 7.245 7.530 1.00 0.00 C ATOM 1036 CD GLN A 62 4.535 6.566 8.173 1.00 0.00 C ATOM 1037 OE1 GLN A 62 5.327 7.226 8.857 1.00 0.00 O ATOM 1038 NE2 GLN A 62 4.742 5.299 7.993 1.00 0.00 N ATOM 0 H GLN A 62 3.432 6.574 5.175 1.00 0.00 H new ATOM 0 HA GLN A 62 1.062 5.099 6.127 1.00 0.00 H new ATOM 0 HB2 GLN A 62 1.308 6.759 8.113 1.00 0.00 H new ATOM 0 HB3 GLN A 62 2.373 5.370 8.019 1.00 0.00 H new ATOM 0 HG2 GLN A 62 3.576 7.532 6.507 1.00 0.00 H new ATOM 0 HG3 GLN A 62 3.095 8.162 8.070 1.00 0.00 H new ATOM 0 HE21 GLN A 62 4.092 4.751 7.430 1.00 0.00 H new ATOM 0 HE22 GLN A 62 5.555 4.850 8.415 1.00 0.00 H new ATOM 1047 N TRP A 63 -0.570 6.816 5.536 1.00 0.00 N ATOM 1048 CA TRP A 63 -1.580 7.757 5.095 1.00 0.00 C ATOM 1049 C TRP A 63 -2.189 8.414 6.306 1.00 0.00 C ATOM 1050 O TRP A 63 -2.414 7.756 7.324 1.00 0.00 O ATOM 1051 CB TRP A 63 -2.655 7.011 4.312 1.00 0.00 C ATOM 1052 CG TRP A 63 -3.744 7.933 3.876 1.00 0.00 C ATOM 1053 CD1 TRP A 63 -3.773 8.611 2.710 1.00 0.00 C ATOM 1054 CD2 TRP A 63 -4.964 8.281 4.578 1.00 0.00 C ATOM 1055 NE1 TRP A 63 -4.946 9.336 2.656 1.00 0.00 N ATOM 1056 CE2 TRP A 63 -5.704 9.172 3.780 1.00 0.00 C ATOM 1057 CE3 TRP A 63 -5.500 7.908 5.813 1.00 0.00 C ATOM 1058 CZ2 TRP A 63 -6.929 9.679 4.190 1.00 0.00 C ATOM 1059 CZ3 TRP A 63 -6.740 8.422 6.232 1.00 0.00 C ATOM 1060 CH2 TRP A 63 -7.451 9.304 5.419 1.00 0.00 C ATOM 0 H TRP A 63 -0.939 5.899 5.789 1.00 0.00 H new ATOM 0 HA TRP A 63 -1.134 8.516 4.452 1.00 0.00 H new ATOM 0 HB2 TRP A 63 -2.208 6.534 3.440 1.00 0.00 H new ATOM 0 HB3 TRP A 63 -3.073 6.217 4.930 1.00 0.00 H new ATOM 0 HD1 TRP A 63 -3.008 8.590 1.948 1.00 0.00 H new ATOM 0 HE1 TRP A 63 -5.215 9.926 1.868 1.00 0.00 H new ATOM 0 HE3 TRP A 63 -4.960 7.222 6.449 1.00 0.00 H new ATOM 0 HZ2 TRP A 63 -7.473 10.362 3.555 1.00 0.00 H new ATOM 0 HZ3 TRP A 63 -7.145 8.132 7.190 1.00 0.00 H new ATOM 0 HH2 TRP A 63 -8.404 9.693 5.745 1.00 0.00 H new ATOM 1071 N GLN A 64 -2.421 9.702 6.215 1.00 0.00 N ATOM 1072 CA GLN A 64 -2.971 10.443 7.325 1.00 0.00 C ATOM 1073 C GLN A 64 -4.258 11.145 6.917 1.00 0.00 C ATOM 1074 O GLN A 64 -4.354 11.697 5.815 1.00 0.00 O ATOM 1075 CB GLN A 64 -1.942 11.459 7.841 1.00 0.00 C ATOM 1076 CG GLN A 64 -0.605 10.746 8.133 1.00 0.00 C ATOM 1077 CD GLN A 64 0.175 11.518 9.192 1.00 0.00 C ATOM 1078 OE1 GLN A 64 1.045 10.953 9.860 1.00 0.00 O ATOM 1079 NE2 GLN A 64 -0.078 12.774 9.391 1.00 0.00 N ATOM 0 H GLN A 64 -2.237 10.260 5.381 1.00 0.00 H new ATOM 0 HA GLN A 64 -3.206 9.745 8.128 1.00 0.00 H new ATOM 0 HB2 GLN A 64 -1.791 12.245 7.101 1.00 0.00 H new ATOM 0 HB3 GLN A 64 -2.314 11.939 8.746 1.00 0.00 H new ATOM 0 HG2 GLN A 64 -0.793 9.729 8.477 1.00 0.00 H new ATOM 0 HG3 GLN A 64 -0.016 10.670 7.219 1.00 0.00 H new ATOM 0 HE21 GLN A 64 -0.797 13.243 8.840 1.00 0.00 H new ATOM 0 HE22 GLN A 64 0.442 13.293 10.099 1.00 0.00 H new ATOM 1136 N ILE B 68 -1.346 -9.698 -5.459 1.00 0.00 N ATOM 1137 CA ILE B 68 -1.667 -9.199 -4.144 1.00 0.00 C ATOM 1138 C ILE B 68 -2.987 -9.772 -3.677 1.00 0.00 C ATOM 1139 O ILE B 68 -3.999 -9.684 -4.379 1.00 0.00 O ATOM 1140 CB ILE B 68 -1.713 -7.661 -4.170 1.00 0.00 C ATOM 1141 CG1 ILE B 68 -0.342 -7.129 -4.597 1.00 0.00 C ATOM 1142 CG2 ILE B 68 -2.054 -7.117 -2.775 1.00 0.00 C ATOM 1143 CD1 ILE B 68 -0.436 -5.637 -4.858 1.00 0.00 C ATOM 0 HA ILE B 68 -0.895 -9.511 -3.440 1.00 0.00 H new ATOM 0 HB ILE B 68 -2.479 -7.337 -4.874 1.00 0.00 H new ATOM 0 HG12 ILE B 68 0.395 -7.327 -3.819 1.00 0.00 H new ATOM 0 HG13 ILE B 68 -0.004 -7.645 -5.495 1.00 0.00 H new ATOM 0 HG21 ILE B 68 -2.084 -6.028 -2.806 1.00 0.00 H new ATOM 0 HG22 ILE B 68 -3.027 -7.498 -2.464 1.00 0.00 H new ATOM 0 HG23 ILE B 68 -1.294 -7.439 -2.063 1.00 0.00 H new ATOM 0 HD11 ILE B 68 0.540 -5.259 -5.162 1.00 0.00 H new ATOM 0 HD12 ILE B 68 -1.160 -5.451 -5.651 1.00 0.00 H new ATOM 0 HD13 ILE B 68 -0.755 -5.128 -3.949 1.00 0.00 H new ATOM 1155 N ILE B 69 -2.970 -10.356 -2.506 1.00 0.00 N ATOM 1156 CA ILE B 69 -4.148 -10.955 -1.923 1.00 0.00 C ATOM 1157 C ILE B 69 -4.882 -9.917 -1.090 1.00 0.00 C ATOM 1158 O ILE B 69 -4.282 -9.265 -0.228 1.00 0.00 O ATOM 1159 CB ILE B 69 -3.718 -12.152 -1.071 1.00 0.00 C ATOM 1160 CG1 ILE B 69 -3.083 -13.198 -1.986 1.00 0.00 C ATOM 1161 CG2 ILE B 69 -4.923 -12.773 -0.347 1.00 0.00 C ATOM 1162 CD1 ILE B 69 -2.363 -14.229 -1.133 1.00 0.00 C ATOM 0 H ILE B 69 -2.135 -10.431 -1.925 1.00 0.00 H new ATOM 0 HA ILE B 69 -4.828 -11.305 -2.700 1.00 0.00 H new ATOM 0 HB ILE B 69 -3.004 -11.815 -0.319 1.00 0.00 H new ATOM 0 HG12 ILE B 69 -3.848 -13.681 -2.594 1.00 0.00 H new ATOM 0 HG13 ILE B 69 -2.383 -12.722 -2.673 1.00 0.00 H new ATOM 0 HG21 ILE B 69 -4.590 -13.621 0.251 1.00 0.00 H new ATOM 0 HG22 ILE B 69 -5.381 -12.027 0.303 1.00 0.00 H new ATOM 0 HG23 ILE B 69 -5.654 -13.111 -1.081 1.00 0.00 H new ATOM 0 HD11 ILE B 69 -1.907 -14.980 -1.778 1.00 0.00 H new ATOM 0 HD12 ILE B 69 -1.589 -13.737 -0.544 1.00 0.00 H new ATOM 0 HD13 ILE B 69 -3.077 -14.710 -0.464 1.00 0.00 H new ATOM 1174 N ASN B 70 -6.151 -9.723 -1.403 1.00 0.00 N ATOM 1175 CA ASN B 70 -6.985 -8.718 -0.752 1.00 0.00 C ATOM 1176 C ASN B 70 -7.892 -9.333 0.291 1.00 0.00 C ATOM 1177 O ASN B 70 -8.844 -10.037 -0.051 1.00 0.00 O ATOM 1178 CB ASN B 70 -7.845 -7.992 -1.786 1.00 0.00 C ATOM 1179 CG ASN B 70 -8.754 -6.985 -1.088 1.00 0.00 C ATOM 1180 OD1 ASN B 70 -8.529 -6.643 0.075 1.00 0.00 O ATOM 1181 ND2 ASN B 70 -9.789 -6.515 -1.711 1.00 0.00 N ATOM 0 H ASN B 70 -6.639 -10.260 -2.120 1.00 0.00 H new ATOM 0 HA ASN B 70 -6.314 -8.014 -0.260 1.00 0.00 H new ATOM 0 HB2 ASN B 70 -7.208 -7.481 -2.508 1.00 0.00 H new ATOM 0 HB3 ASN B 70 -8.445 -8.712 -2.343 1.00 0.00 H new ATOM 0 HD21 ASN B 70 -10.416 -5.863 -1.239 1.00 0.00 H new ATOM 0 HD22 ASN B 70 -9.977 -6.797 -2.673 1.00 0.00 H new ATOM 1188 N ASN B 71 -7.659 -9.003 1.548 1.00 0.00 N ATOM 1189 CA ASN B 71 -8.527 -9.467 2.631 1.00 0.00 C ATOM 1190 C ASN B 71 -9.528 -8.393 3.008 1.00 0.00 C ATOM 1191 O ASN B 71 -10.149 -8.467 4.068 1.00 0.00 O ATOM 1192 CB ASN B 71 -7.713 -9.816 3.877 1.00 0.00 C ATOM 1193 CG ASN B 71 -6.778 -10.973 3.608 1.00 0.00 C ATOM 1194 OD1 ASN B 71 -5.522 -10.842 3.870 1.00 0.00 O flip ATOM 1195 ND2 ASN B 71 -7.207 -12.024 3.138 1.00 0.00 N flip ATOM 0 H ASN B 71 -6.880 -8.418 1.850 1.00 0.00 H new ATOM 0 HA ASN B 71 -9.045 -10.355 2.270 1.00 0.00 H new ATOM 0 HB2 ASN B 71 -7.138 -8.946 4.196 1.00 0.00 H new ATOM 0 HB3 ASN B 71 -8.386 -10.071 4.696 1.00 0.00 H new ATOM 0 HD21 ASN B 71 -8.201 -12.123 2.933 1.00 0.00 H new ATOM 0 HD22 ASN B 71 -6.569 -12.798 2.953 1.00 0.00 H new ATOM 1202 N LEU B 72 -9.633 -7.354 2.197 1.00 0.00 N ATOM 1203 CA LEU B 72 -10.460 -6.216 2.573 1.00 0.00 C ATOM 1204 C LEU B 72 -11.895 -6.625 2.787 1.00 0.00 C ATOM 1205 O LEU B 72 -12.492 -6.255 3.785 1.00 0.00 O ATOM 1206 CB LEU B 72 -10.392 -5.111 1.514 1.00 0.00 C ATOM 1207 CG LEU B 72 -11.312 -3.946 1.912 1.00 0.00 C ATOM 1208 CD1 LEU B 72 -10.910 -3.408 3.287 1.00 0.00 C ATOM 1209 CD2 LEU B 72 -11.206 -2.830 0.872 1.00 0.00 C ATOM 0 H LEU B 72 -9.168 -7.272 1.293 1.00 0.00 H new ATOM 0 HA LEU B 72 -10.065 -5.830 3.513 1.00 0.00 H new ATOM 0 HB2 LEU B 72 -9.366 -4.757 1.411 1.00 0.00 H new ATOM 0 HB3 LEU B 72 -10.691 -5.507 0.543 1.00 0.00 H new ATOM 0 HG LEU B 72 -12.341 -4.303 1.957 1.00 0.00 H new ATOM 0 HD11 LEU B 72 -11.567 -2.583 3.561 1.00 0.00 H new ATOM 0 HD12 LEU B 72 -10.997 -4.203 4.028 1.00 0.00 H new ATOM 0 HD13 LEU B 72 -9.879 -3.055 3.252 1.00 0.00 H new ATOM 0 HD21 LEU B 72 -11.859 -2.005 1.156 1.00 0.00 H new ATOM 0 HD22 LEU B 72 -10.176 -2.477 0.821 1.00 0.00 H new ATOM 0 HD23 LEU B 72 -11.507 -3.212 -0.103 1.00 0.00 H new ATOM 1221 N LYS B 73 -12.443 -7.411 1.882 1.00 0.00 N ATOM 1222 CA LYS B 73 -13.816 -7.841 2.046 1.00 0.00 C ATOM 1223 C LYS B 73 -13.977 -8.665 3.306 1.00 0.00 C ATOM 1224 O LYS B 73 -14.867 -8.416 4.113 1.00 0.00 O ATOM 1225 CB LYS B 73 -14.313 -8.598 0.809 1.00 0.00 C ATOM 1226 CG LYS B 73 -13.415 -9.812 0.493 1.00 0.00 C ATOM 1227 CD LYS B 73 -13.442 -10.028 -1.023 1.00 0.00 C ATOM 1228 CE LYS B 73 -12.567 -11.219 -1.437 1.00 0.00 C ATOM 1229 NZ LYS B 73 -12.636 -11.368 -2.916 1.00 0.00 N ATOM 0 H LYS B 73 -11.973 -7.758 1.046 1.00 0.00 H new ATOM 0 HA LYS B 73 -14.437 -6.952 2.152 1.00 0.00 H new ATOM 0 HB2 LYS B 73 -15.337 -8.934 0.973 1.00 0.00 H new ATOM 0 HB3 LYS B 73 -14.332 -7.925 -0.048 1.00 0.00 H new ATOM 0 HG2 LYS B 73 -12.396 -9.634 0.836 1.00 0.00 H new ATOM 0 HG3 LYS B 73 -13.775 -10.700 1.012 1.00 0.00 H new ATOM 0 HD2 LYS B 73 -14.468 -10.198 -1.349 1.00 0.00 H new ATOM 0 HD3 LYS B 73 -13.093 -9.126 -1.526 1.00 0.00 H new ATOM 0 HE2 LYS B 73 -11.536 -11.059 -1.121 1.00 0.00 H new ATOM 0 HE3 LYS B 73 -12.913 -12.130 -0.949 1.00 0.00 H new ATOM 0 HZ1 LYS B 73 -12.903 -12.344 -3.154 1.00 0.00 H new ATOM 0 HZ2 LYS B 73 -13.346 -10.712 -3.298 1.00 0.00 H new ATOM 0 HZ3 LYS B 73 -11.707 -11.152 -3.330 1.00 0.00 H new ATOM 1243 N LEU B 74 -13.072 -9.605 3.504 1.00 0.00 N ATOM 1244 CA LEU B 74 -13.123 -10.452 4.683 1.00 0.00 C ATOM 1245 C LEU B 74 -12.948 -9.595 5.927 1.00 0.00 C ATOM 1246 O LEU B 74 -13.710 -9.705 6.893 1.00 0.00 O ATOM 1247 CB LEU B 74 -11.985 -11.471 4.626 1.00 0.00 C ATOM 1248 CG LEU B 74 -12.153 -12.366 3.394 1.00 0.00 C ATOM 1249 CD1 LEU B 74 -10.996 -13.352 3.318 1.00 0.00 C ATOM 1250 CD2 LEU B 74 -13.484 -13.114 3.445 1.00 0.00 C ATOM 0 H LEU B 74 -12.298 -9.801 2.870 1.00 0.00 H new ATOM 0 HA LEU B 74 -14.083 -10.967 4.716 1.00 0.00 H new ATOM 0 HB2 LEU B 74 -11.025 -10.956 4.585 1.00 0.00 H new ATOM 0 HB3 LEU B 74 -11.983 -12.079 5.531 1.00 0.00 H new ATOM 0 HG LEU B 74 -12.151 -11.739 2.502 1.00 0.00 H new ATOM 0 HD11 LEU B 74 -11.117 -13.988 2.441 1.00 0.00 H new ATOM 0 HD12 LEU B 74 -10.056 -12.805 3.243 1.00 0.00 H new ATOM 0 HD13 LEU B 74 -10.985 -13.970 4.216 1.00 0.00 H new ATOM 0 HD21 LEU B 74 -13.582 -13.743 2.560 1.00 0.00 H new ATOM 0 HD22 LEU B 74 -13.517 -13.737 4.339 1.00 0.00 H new ATOM 0 HD23 LEU B 74 -14.304 -12.396 3.472 1.00 0.00 H new ATOM 1262 N ILE B 75 -11.996 -8.684 5.862 1.00 0.00 N ATOM 1263 CA ILE B 75 -11.767 -7.735 6.931 1.00 0.00 C ATOM 1264 C ILE B 75 -12.965 -6.818 7.074 1.00 0.00 C ATOM 1265 O ILE B 75 -13.442 -6.564 8.176 1.00 0.00 O ATOM 1266 CB ILE B 75 -10.463 -6.967 6.706 1.00 0.00 C ATOM 1267 CG1 ILE B 75 -9.294 -7.943 6.859 1.00 0.00 C ATOM 1268 CG2 ILE B 75 -10.316 -5.842 7.738 1.00 0.00 C ATOM 1269 CD1 ILE B 75 -8.008 -7.259 6.422 1.00 0.00 C ATOM 0 H ILE B 75 -11.362 -8.582 5.069 1.00 0.00 H new ATOM 0 HA ILE B 75 -11.652 -8.272 7.872 1.00 0.00 H new ATOM 0 HB ILE B 75 -10.471 -6.527 5.709 1.00 0.00 H new ATOM 0 HG12 ILE B 75 -9.211 -8.270 7.896 1.00 0.00 H new ATOM 0 HG13 ILE B 75 -9.468 -8.834 6.256 1.00 0.00 H new ATOM 0 HG21 ILE B 75 -9.383 -5.307 7.562 1.00 0.00 H new ATOM 0 HG22 ILE B 75 -11.154 -5.151 7.645 1.00 0.00 H new ATOM 0 HG23 ILE B 75 -10.307 -6.268 8.741 1.00 0.00 H new ATOM 0 HD11 ILE B 75 -7.173 -7.951 6.530 1.00 0.00 H new ATOM 0 HD12 ILE B 75 -8.094 -6.954 5.379 1.00 0.00 H new ATOM 0 HD13 ILE B 75 -7.834 -6.381 7.044 1.00 0.00 H new ATOM 1281 N ARG B 76 -13.492 -6.376 5.948 1.00 0.00 N ATOM 1282 CA ARG B 76 -14.661 -5.534 5.949 1.00 0.00 C ATOM 1283 C ARG B 76 -15.762 -6.219 6.722 1.00 0.00 C ATOM 1284 O ARG B 76 -16.402 -5.603 7.581 1.00 0.00 O ATOM 1285 CB ARG B 76 -15.124 -5.261 4.508 1.00 0.00 C ATOM 1286 CG ARG B 76 -16.336 -4.337 4.536 1.00 0.00 C ATOM 1287 CD ARG B 76 -16.832 -4.049 3.104 1.00 0.00 C ATOM 1288 NE ARG B 76 -16.951 -5.277 2.300 1.00 0.00 N ATOM 1289 CZ ARG B 76 -17.694 -6.337 2.638 1.00 0.00 C ATOM 1290 NH1 ARG B 76 -18.389 -6.352 3.745 1.00 0.00 N ATOM 1291 NH2 ARG B 76 -17.726 -7.355 1.839 1.00 0.00 N ATOM 0 H ARG B 76 -13.124 -6.590 5.021 1.00 0.00 H new ATOM 0 HA ARG B 76 -14.419 -4.581 6.420 1.00 0.00 H new ATOM 0 HB2 ARG B 76 -14.317 -4.804 3.935 1.00 0.00 H new ATOM 0 HB3 ARG B 76 -15.377 -6.198 4.011 1.00 0.00 H new ATOM 0 HG2 ARG B 76 -17.136 -4.795 5.119 1.00 0.00 H new ATOM 0 HG3 ARG B 76 -16.076 -3.402 5.032 1.00 0.00 H new ATOM 0 HD2 ARG B 76 -17.801 -3.551 3.150 1.00 0.00 H new ATOM 0 HD3 ARG B 76 -16.143 -3.361 2.614 1.00 0.00 H new ATOM 0 HE ARG B 76 -16.430 -5.323 1.424 1.00 0.00 H new ATOM 0 HH11 ARG B 76 -18.371 -5.546 4.369 1.00 0.00 H new ATOM 0 HH12 ARG B 76 -18.949 -7.170 3.984 1.00 0.00 H new ATOM 0 HH21 ARG B 76 -17.191 -7.339 0.971 1.00 0.00 H new ATOM 0 HH22 ARG B 76 -18.286 -8.173 2.078 1.00 0.00 H new ATOM 1305 N GLU B 77 -15.917 -7.509 6.504 1.00 0.00 N ATOM 1306 CA GLU B 77 -16.883 -8.261 7.269 1.00 0.00 C ATOM 1307 C GLU B 77 -16.512 -8.212 8.752 1.00 0.00 C ATOM 1308 O GLU B 77 -17.390 -8.059 9.606 1.00 0.00 O ATOM 1309 CB GLU B 77 -16.968 -9.713 6.779 1.00 0.00 C ATOM 1310 CG GLU B 77 -17.478 -9.738 5.323 1.00 0.00 C ATOM 1311 CD GLU B 77 -18.885 -9.178 5.209 1.00 0.00 C ATOM 1312 OE1 GLU B 77 -19.594 -9.165 6.195 1.00 0.00 O ATOM 1313 OE2 GLU B 77 -19.247 -8.772 4.124 1.00 0.00 O ATOM 0 H GLU B 77 -15.395 -8.049 5.814 1.00 0.00 H new ATOM 0 HA GLU B 77 -17.866 -7.810 7.131 1.00 0.00 H new ATOM 0 HB2 GLU B 77 -15.988 -10.186 6.840 1.00 0.00 H new ATOM 0 HB3 GLU B 77 -17.639 -10.285 7.420 1.00 0.00 H new ATOM 0 HG2 GLU B 77 -16.804 -9.159 4.692 1.00 0.00 H new ATOM 0 HG3 GLU B 77 -17.463 -10.762 4.950 1.00 0.00 H new ATOM 1320 N LYS B 78 -15.204 -8.265 9.060 1.00 0.00 N ATOM 1321 CA LYS B 78 -14.759 -8.137 10.449 1.00 0.00 C ATOM 1322 C LYS B 78 -15.133 -6.760 10.958 1.00 0.00 C ATOM 1323 O LYS B 78 -15.622 -6.600 12.081 1.00 0.00 O ATOM 1324 CB LYS B 78 -13.229 -8.277 10.560 1.00 0.00 C ATOM 1325 CG LYS B 78 -12.776 -9.677 10.175 1.00 0.00 C ATOM 1326 CD LYS B 78 -11.253 -9.754 10.313 1.00 0.00 C ATOM 1327 CE LYS B 78 -10.753 -11.088 9.771 1.00 0.00 C ATOM 1328 NZ LYS B 78 -11.417 -12.206 10.482 1.00 0.00 N ATOM 0 H LYS B 78 -14.455 -8.393 8.379 1.00 0.00 H new ATOM 0 HA LYS B 78 -15.236 -8.925 11.032 1.00 0.00 H new ATOM 0 HB2 LYS B 78 -12.746 -7.545 9.913 1.00 0.00 H new ATOM 0 HB3 LYS B 78 -12.914 -8.058 11.580 1.00 0.00 H new ATOM 0 HG2 LYS B 78 -13.252 -10.418 10.817 1.00 0.00 H new ATOM 0 HG3 LYS B 78 -13.075 -9.903 9.151 1.00 0.00 H new ATOM 0 HD2 LYS B 78 -10.787 -8.932 9.769 1.00 0.00 H new ATOM 0 HD3 LYS B 78 -10.967 -9.646 11.359 1.00 0.00 H new ATOM 0 HE2 LYS B 78 -10.956 -11.154 8.702 1.00 0.00 H new ATOM 0 HE3 LYS B 78 -9.672 -11.158 9.895 1.00 0.00 H new ATOM 0 HZ1 LYS B 78 -10.901 -13.090 10.297 1.00 0.00 H new ATOM 0 HZ2 LYS B 78 -11.420 -12.014 11.504 1.00 0.00 H new ATOM 0 HZ3 LYS B 78 -12.396 -12.299 10.144 1.00 0.00 H new ATOM 1342 N LYS B 79 -14.884 -5.761 10.128 1.00 0.00 N ATOM 1343 CA LYS B 79 -15.183 -4.383 10.475 1.00 0.00 C ATOM 1344 C LYS B 79 -16.687 -4.190 10.577 1.00 0.00 C ATOM 1345 O LYS B 79 -17.163 -3.321 11.300 1.00 0.00 O ATOM 1346 CB LYS B 79 -14.608 -3.402 9.437 1.00 0.00 C ATOM 1347 CG LYS B 79 -13.135 -3.730 9.066 1.00 0.00 C ATOM 1348 CD LYS B 79 -12.328 -4.268 10.269 1.00 0.00 C ATOM 1349 CE LYS B 79 -11.699 -3.109 11.057 1.00 0.00 C ATOM 1350 NZ LYS B 79 -10.334 -3.487 11.513 1.00 0.00 N ATOM 0 H LYS B 79 -14.472 -5.881 9.202 1.00 0.00 H new ATOM 0 HA LYS B 79 -14.716 -4.173 11.437 1.00 0.00 H new ATOM 0 HB2 LYS B 79 -15.221 -3.429 8.536 1.00 0.00 H new ATOM 0 HB3 LYS B 79 -14.664 -2.387 9.830 1.00 0.00 H new ATOM 0 HG2 LYS B 79 -13.121 -4.468 8.264 1.00 0.00 H new ATOM 0 HG3 LYS B 79 -12.652 -2.832 8.681 1.00 0.00 H new ATOM 0 HD2 LYS B 79 -12.980 -4.848 10.922 1.00 0.00 H new ATOM 0 HD3 LYS B 79 -11.547 -4.943 9.918 1.00 0.00 H new ATOM 0 HE2 LYS B 79 -11.649 -2.218 10.431 1.00 0.00 H new ATOM 0 HE3 LYS B 79 -12.323 -2.861 11.916 1.00 0.00 H new ATOM 0 HZ1 LYS B 79 -10.175 -3.120 12.473 1.00 0.00 H new ATOM 0 HZ2 LYS B 79 -10.245 -4.523 11.519 1.00 0.00 H new ATOM 0 HZ3 LYS B 79 -9.627 -3.082 10.866 1.00 0.00 H new ATOM 1364 N LYS B 80 -17.407 -4.888 9.711 1.00 0.00 N ATOM 1365 CA LYS B 80 -18.848 -4.707 9.550 1.00 0.00 C ATOM 1366 C LYS B 80 -19.144 -3.325 8.979 1.00 0.00 C ATOM 1367 O LYS B 80 -20.188 -2.718 9.256 1.00 0.00 O ATOM 1368 CB LYS B 80 -19.608 -4.949 10.864 1.00 0.00 C ATOM 1369 CG LYS B 80 -19.523 -6.440 11.235 1.00 0.00 C ATOM 1370 CD LYS B 80 -20.288 -6.692 12.536 1.00 0.00 C ATOM 1371 CE LYS B 80 -20.217 -8.177 12.910 1.00 0.00 C ATOM 1372 NZ LYS B 80 -20.945 -8.399 14.184 1.00 0.00 N ATOM 0 H LYS B 80 -17.010 -5.599 9.097 1.00 0.00 H new ATOM 0 HA LYS B 80 -19.204 -5.456 8.843 1.00 0.00 H new ATOM 0 HB2 LYS B 80 -19.182 -4.340 11.661 1.00 0.00 H new ATOM 0 HB3 LYS B 80 -20.650 -4.649 10.755 1.00 0.00 H new ATOM 0 HG2 LYS B 80 -19.940 -7.049 10.433 1.00 0.00 H new ATOM 0 HG3 LYS B 80 -18.481 -6.737 11.351 1.00 0.00 H new ATOM 0 HD2 LYS B 80 -19.866 -6.086 13.338 1.00 0.00 H new ATOM 0 HD3 LYS B 80 -21.328 -6.388 12.420 1.00 0.00 H new ATOM 0 HE2 LYS B 80 -20.654 -8.784 12.118 1.00 0.00 H new ATOM 0 HE3 LYS B 80 -19.177 -8.488 13.013 1.00 0.00 H new ATOM 0 HZ1 LYS B 80 -20.898 -9.406 14.440 1.00 0.00 H new ATOM 0 HZ2 LYS B 80 -20.508 -7.830 14.937 1.00 0.00 H new ATOM 0 HZ3 LYS B 80 -21.939 -8.117 14.069 1.00 0.00 H new ATOM 1386 N ILE B 81 -18.262 -2.891 8.100 1.00 0.00 N ATOM 1387 CA ILE B 81 -18.419 -1.660 7.350 1.00 0.00 C ATOM 1388 C ILE B 81 -18.867 -1.944 5.945 1.00 0.00 C ATOM 1389 O ILE B 81 -18.376 -2.860 5.301 1.00 0.00 O ATOM 1390 CB ILE B 81 -17.122 -0.833 7.378 1.00 0.00 C ATOM 1391 CG1 ILE B 81 -17.206 0.204 8.488 1.00 0.00 C ATOM 1392 CG2 ILE B 81 -16.848 -0.146 6.041 1.00 0.00 C ATOM 1393 CD1 ILE B 81 -15.829 0.461 9.038 1.00 0.00 C ATOM 0 H ILE B 81 -17.401 -3.393 7.883 1.00 0.00 H new ATOM 0 HA ILE B 81 -19.197 -1.064 7.827 1.00 0.00 H new ATOM 0 HB ILE B 81 -16.294 -1.517 7.566 1.00 0.00 H new ATOM 0 HG12 ILE B 81 -17.635 1.130 8.104 1.00 0.00 H new ATOM 0 HG13 ILE B 81 -17.866 -0.148 9.281 1.00 0.00 H new ATOM 0 HG21 ILE B 81 -15.923 0.426 6.109 1.00 0.00 H new ATOM 0 HG22 ILE B 81 -16.753 -0.898 5.258 1.00 0.00 H new ATOM 0 HG23 ILE B 81 -17.673 0.525 5.801 1.00 0.00 H new ATOM 0 HD11 ILE B 81 -15.888 1.204 9.833 1.00 0.00 H new ATOM 0 HD12 ILE B 81 -15.418 -0.466 9.437 1.00 0.00 H new ATOM 0 HD13 ILE B 81 -15.183 0.832 8.242 1.00 0.00 H new ATOM 1405 N SER B 82 -19.799 -1.159 5.475 1.00 0.00 N ATOM 1406 CA SER B 82 -20.285 -1.314 4.125 1.00 0.00 C ATOM 1407 C SER B 82 -19.257 -0.773 3.147 1.00 0.00 C ATOM 1408 O SER B 82 -18.583 0.220 3.427 1.00 0.00 O ATOM 1409 CB SER B 82 -21.612 -0.584 3.956 1.00 0.00 C ATOM 1410 OG SER B 82 -22.656 -1.322 4.605 1.00 0.00 O ATOM 0 H SER B 82 -20.238 -0.406 6.004 1.00 0.00 H new ATOM 0 HA SER B 82 -20.446 -2.373 3.922 1.00 0.00 H new ATOM 0 HB2 SER B 82 -21.544 0.418 4.380 1.00 0.00 H new ATOM 0 HB3 SER B 82 -21.841 -0.466 2.897 1.00 0.00 H new ATOM 0 HG SER B 82 -23.507 -0.849 4.496 1.00 0.00 H new ATOM 1416 N GLN B 83 -19.169 -1.379 1.984 1.00 0.00 N ATOM 1417 CA GLN B 83 -18.257 -0.887 0.978 1.00 0.00 C ATOM 1418 C GLN B 83 -18.530 0.586 0.741 1.00 0.00 C ATOM 1419 O GLN B 83 -17.618 1.366 0.533 1.00 0.00 O ATOM 1420 CB GLN B 83 -18.400 -1.664 -0.344 1.00 0.00 C ATOM 1421 CG GLN B 83 -19.887 -1.829 -0.708 1.00 0.00 C ATOM 1422 CD GLN B 83 -20.028 -2.599 -2.008 1.00 0.00 C ATOM 1423 OE1 GLN B 83 -20.879 -2.258 -2.836 1.00 0.00 O ATOM 1424 NE2 GLN B 83 -19.247 -3.607 -2.257 1.00 0.00 N ATOM 0 H GLN B 83 -19.709 -2.201 1.714 1.00 0.00 H new ATOM 0 HA GLN B 83 -17.238 -1.029 1.337 1.00 0.00 H new ATOM 0 HB2 GLN B 83 -17.879 -1.135 -1.143 1.00 0.00 H new ATOM 0 HB3 GLN B 83 -17.930 -2.643 -0.251 1.00 0.00 H new ATOM 0 HG2 GLN B 83 -20.408 -2.354 0.092 1.00 0.00 H new ATOM 0 HG3 GLN B 83 -20.356 -0.850 -0.805 1.00 0.00 H new ATOM 0 HE21 GLN B 83 -18.544 -3.889 -1.573 1.00 0.00 H new ATOM 0 HE22 GLN B 83 -19.337 -4.117 -3.136 1.00 0.00 H new ATOM 1433 N SER B 84 -19.804 0.942 0.751 1.00 0.00 N ATOM 1434 CA SER B 84 -20.233 2.295 0.463 1.00 0.00 C ATOM 1435 C SER B 84 -19.631 3.305 1.441 1.00 0.00 C ATOM 1436 O SER B 84 -19.135 4.363 1.017 1.00 0.00 O ATOM 1437 CB SER B 84 -21.750 2.360 0.548 1.00 0.00 C ATOM 1438 OG SER B 84 -22.288 1.102 0.135 1.00 0.00 O ATOM 0 H SER B 84 -20.568 0.299 0.959 1.00 0.00 H new ATOM 0 HA SER B 84 -19.888 2.554 -0.538 1.00 0.00 H new ATOM 0 HB2 SER B 84 -22.062 2.588 1.567 1.00 0.00 H new ATOM 0 HB3 SER B 84 -22.130 3.160 -0.087 1.00 0.00 H new ATOM 0 HG SER B 84 -23.266 1.131 0.187 1.00 0.00 H new ATOM 1444 N GLU B 85 -19.663 2.998 2.741 1.00 0.00 N ATOM 1445 CA GLU B 85 -19.112 3.925 3.714 1.00 0.00 C ATOM 1446 C GLU B 85 -17.603 3.975 3.601 1.00 0.00 C ATOM 1447 O GLU B 85 -17.028 5.044 3.434 1.00 0.00 O ATOM 1448 CB GLU B 85 -19.590 3.620 5.154 1.00 0.00 C ATOM 1449 CG GLU B 85 -18.999 2.310 5.680 1.00 0.00 C ATOM 1450 CD GLU B 85 -19.662 1.943 6.979 1.00 0.00 C ATOM 1451 OE1 GLU B 85 -19.534 2.695 7.917 1.00 0.00 O ATOM 1452 OE2 GLU B 85 -20.305 0.921 7.021 1.00 0.00 O ATOM 0 H GLU B 85 -20.054 2.139 3.129 1.00 0.00 H new ATOM 0 HA GLU B 85 -19.494 4.919 3.484 1.00 0.00 H new ATOM 0 HB2 GLU B 85 -19.304 4.439 5.814 1.00 0.00 H new ATOM 0 HB3 GLU B 85 -20.678 3.561 5.172 1.00 0.00 H new ATOM 0 HG2 GLU B 85 -19.144 1.515 4.949 1.00 0.00 H new ATOM 0 HG3 GLU B 85 -17.924 2.417 5.826 1.00 0.00 H new ATOM 1459 N LEU B 86 -16.994 2.799 3.503 1.00 0.00 N ATOM 1460 CA LEU B 86 -15.556 2.682 3.297 1.00 0.00 C ATOM 1461 C LEU B 86 -15.188 3.361 1.990 1.00 0.00 C ATOM 1462 O LEU B 86 -14.257 4.173 1.935 1.00 0.00 O ATOM 1463 CB LEU B 86 -15.152 1.199 3.229 1.00 0.00 C ATOM 1464 CG LEU B 86 -13.623 1.063 3.084 1.00 0.00 C ATOM 1465 CD1 LEU B 86 -12.916 1.641 4.315 1.00 0.00 C ATOM 1466 CD2 LEU B 86 -13.244 -0.407 2.914 1.00 0.00 C ATOM 0 H LEU B 86 -17.480 1.904 3.564 1.00 0.00 H new ATOM 0 HA LEU B 86 -15.032 3.156 4.127 1.00 0.00 H new ATOM 0 HB2 LEU B 86 -15.485 0.683 4.130 1.00 0.00 H new ATOM 0 HB3 LEU B 86 -15.648 0.719 2.385 1.00 0.00 H new ATOM 0 HG LEU B 86 -13.306 1.620 2.202 1.00 0.00 H new ATOM 0 HD11 LEU B 86 -11.837 1.537 4.197 1.00 0.00 H new ATOM 0 HD12 LEU B 86 -13.170 2.696 4.419 1.00 0.00 H new ATOM 0 HD13 LEU B 86 -13.237 1.101 5.206 1.00 0.00 H new ATOM 0 HD21 LEU B 86 -12.162 -0.494 2.812 1.00 0.00 H new ATOM 0 HD22 LEU B 86 -13.573 -0.971 3.787 1.00 0.00 H new ATOM 0 HD23 LEU B 86 -13.726 -0.806 2.021 1.00 0.00 H new ATOM 1478 N ALA B 87 -15.991 3.114 0.958 1.00 0.00 N ATOM 1479 CA ALA B 87 -15.789 3.774 -0.321 1.00 0.00 C ATOM 1480 C ALA B 87 -15.837 5.272 -0.108 1.00 0.00 C ATOM 1481 O ALA B 87 -15.026 6.009 -0.657 1.00 0.00 O ATOM 1482 CB ALA B 87 -16.862 3.357 -1.338 1.00 0.00 C ATOM 0 H ALA B 87 -16.779 2.467 0.985 1.00 0.00 H new ATOM 0 HA ALA B 87 -14.819 3.479 -0.721 1.00 0.00 H new ATOM 0 HB1 ALA B 87 -16.684 3.867 -2.285 1.00 0.00 H new ATOM 0 HB2 ALA B 87 -16.817 2.279 -1.493 1.00 0.00 H new ATOM 0 HB3 ALA B 87 -17.847 3.628 -0.959 1.00 0.00 H new ATOM 1488 N ALA B 88 -16.737 5.702 0.768 1.00 0.00 N ATOM 1489 CA ALA B 88 -16.822 7.104 1.145 1.00 0.00 C ATOM 1490 C ALA B 88 -15.561 7.534 1.873 1.00 0.00 C ATOM 1491 O ALA B 88 -15.048 8.628 1.640 1.00 0.00 O ATOM 1492 CB ALA B 88 -18.044 7.362 2.033 1.00 0.00 C ATOM 0 H ALA B 88 -17.417 5.098 1.230 1.00 0.00 H new ATOM 0 HA ALA B 88 -16.927 7.689 0.231 1.00 0.00 H new ATOM 0 HB1 ALA B 88 -18.083 8.418 2.300 1.00 0.00 H new ATOM 0 HB2 ALA B 88 -18.951 7.091 1.492 1.00 0.00 H new ATOM 0 HB3 ALA B 88 -17.969 6.761 2.939 1.00 0.00 H new ATOM 1498 N LEU B 89 -15.054 6.675 2.758 1.00 0.00 N ATOM 1499 CA LEU B 89 -13.845 7.014 3.511 1.00 0.00 C ATOM 1500 C LEU B 89 -12.713 7.186 2.507 1.00 0.00 C ATOM 1501 O LEU B 89 -11.966 8.179 2.517 1.00 0.00 O ATOM 1502 CB LEU B 89 -13.460 5.860 4.455 1.00 0.00 C ATOM 1503 CG LEU B 89 -14.657 5.393 5.304 1.00 0.00 C ATOM 1504 CD1 LEU B 89 -14.239 4.236 6.208 1.00 0.00 C ATOM 1505 CD2 LEU B 89 -15.225 6.522 6.148 1.00 0.00 C ATOM 0 H LEU B 89 -15.450 5.759 2.969 1.00 0.00 H new ATOM 0 HA LEU B 89 -14.020 7.918 4.095 1.00 0.00 H new ATOM 0 HB2 LEU B 89 -13.081 5.022 3.870 1.00 0.00 H new ATOM 0 HB3 LEU B 89 -12.652 6.182 5.112 1.00 0.00 H new ATOM 0 HG LEU B 89 -15.436 5.061 4.618 1.00 0.00 H new ATOM 0 HD11 LEU B 89 -15.093 3.913 6.804 1.00 0.00 H new ATOM 0 HD12 LEU B 89 -13.888 3.405 5.596 1.00 0.00 H new ATOM 0 HD13 LEU B 89 -13.437 4.563 6.870 1.00 0.00 H new ATOM 0 HD21 LEU B 89 -16.068 6.151 6.732 1.00 0.00 H new ATOM 0 HD22 LEU B 89 -14.454 6.897 6.821 1.00 0.00 H new ATOM 0 HD23 LEU B 89 -15.562 7.329 5.497 1.00 0.00 H new ATOM 1517 N LEU B 90 -12.661 6.254 1.579 1.00 0.00 N ATOM 1518 CA LEU B 90 -11.730 6.311 0.468 1.00 0.00 C ATOM 1519 C LEU B 90 -12.054 7.466 -0.440 1.00 0.00 C ATOM 1520 O LEU B 90 -11.155 8.072 -1.015 1.00 0.00 O ATOM 1521 CB LEU B 90 -11.716 4.999 -0.308 1.00 0.00 C ATOM 1522 CG LEU B 90 -10.755 4.007 0.365 1.00 0.00 C ATOM 1523 CD1 LEU B 90 -11.120 3.844 1.848 1.00 0.00 C ATOM 1524 CD2 LEU B 90 -10.856 2.653 -0.345 1.00 0.00 C ATOM 0 H LEU B 90 -13.265 5.432 1.572 1.00 0.00 H new ATOM 0 HA LEU B 90 -10.731 6.467 0.876 1.00 0.00 H new ATOM 0 HB2 LEU B 90 -12.721 4.578 -0.346 1.00 0.00 H new ATOM 0 HB3 LEU B 90 -11.406 5.178 -1.338 1.00 0.00 H new ATOM 0 HG LEU B 90 -9.735 4.385 0.295 1.00 0.00 H new ATOM 0 HD11 LEU B 90 -10.433 3.139 2.316 1.00 0.00 H new ATOM 0 HD12 LEU B 90 -11.047 4.809 2.349 1.00 0.00 H new ATOM 0 HD13 LEU B 90 -12.140 3.468 1.933 1.00 0.00 H new ATOM 0 HD21 LEU B 90 -10.177 1.943 0.127 1.00 0.00 H new ATOM 0 HD22 LEU B 90 -11.878 2.280 -0.274 1.00 0.00 H new ATOM 0 HD23 LEU B 90 -10.586 2.771 -1.394 1.00 0.00 H new ATOM 1536 N GLU B 91 -13.347 7.706 -0.617 1.00 0.00 N ATOM 1537 CA GLU B 91 -13.867 8.713 -1.534 1.00 0.00 C ATOM 1538 C GLU B 91 -13.871 8.159 -2.948 1.00 0.00 C ATOM 1539 O GLU B 91 -13.561 8.866 -3.918 1.00 0.00 O ATOM 1540 CB GLU B 91 -13.031 9.993 -1.470 1.00 0.00 C ATOM 1541 CG GLU B 91 -12.992 10.521 -0.028 1.00 0.00 C ATOM 1542 CD GLU B 91 -11.938 11.585 0.083 1.00 0.00 C ATOM 1543 OE1 GLU B 91 -12.025 12.550 -0.630 1.00 0.00 O ATOM 1544 OE2 GLU B 91 -11.037 11.414 0.871 1.00 0.00 O ATOM 0 H GLU B 91 -14.077 7.197 -0.118 1.00 0.00 H new ATOM 0 HA GLU B 91 -14.887 8.961 -1.239 1.00 0.00 H new ATOM 0 HB2 GLU B 91 -12.018 9.794 -1.821 1.00 0.00 H new ATOM 0 HB3 GLU B 91 -13.455 10.748 -2.132 1.00 0.00 H new ATOM 0 HG2 GLU B 91 -13.965 10.927 0.249 1.00 0.00 H new ATOM 0 HG3 GLU B 91 -12.777 9.707 0.664 1.00 0.00 H new ATOM 1551 N VAL B 92 -14.250 6.897 -3.059 1.00 0.00 N ATOM 1552 CA VAL B 92 -14.343 6.213 -4.340 1.00 0.00 C ATOM 1553 C VAL B 92 -15.702 5.547 -4.492 1.00 0.00 C ATOM 1554 O VAL B 92 -16.479 5.482 -3.534 1.00 0.00 O ATOM 1555 CB VAL B 92 -13.215 5.179 -4.489 1.00 0.00 C ATOM 1556 CG1 VAL B 92 -11.865 5.893 -4.493 1.00 0.00 C ATOM 1557 CG2 VAL B 92 -13.258 4.183 -3.322 1.00 0.00 C ATOM 0 H VAL B 92 -14.503 6.315 -2.261 1.00 0.00 H new ATOM 0 HA VAL B 92 -14.232 6.954 -5.131 1.00 0.00 H new ATOM 0 HB VAL B 92 -13.349 4.640 -5.427 1.00 0.00 H new ATOM 0 HG11 VAL B 92 -11.066 5.159 -4.599 1.00 0.00 H new ATOM 0 HG12 VAL B 92 -11.827 6.594 -5.327 1.00 0.00 H new ATOM 0 HG13 VAL B 92 -11.738 6.436 -3.556 1.00 0.00 H new ATOM 0 HG21 VAL B 92 -12.455 3.454 -3.436 1.00 0.00 H new ATOM 0 HG22 VAL B 92 -13.131 4.719 -2.381 1.00 0.00 H new ATOM 0 HG23 VAL B 92 -14.218 3.667 -3.319 1.00 0.00 H new ATOM 1567 N SER B 93 -16.017 5.119 -5.698 1.00 0.00 N ATOM 1568 CA SER B 93 -17.301 4.493 -5.970 1.00 0.00 C ATOM 1569 C SER B 93 -17.365 3.102 -5.345 1.00 0.00 C ATOM 1570 O SER B 93 -16.323 2.461 -5.125 1.00 0.00 O ATOM 1571 CB SER B 93 -17.519 4.396 -7.480 1.00 0.00 C ATOM 1572 OG SER B 93 -16.607 3.438 -8.044 1.00 0.00 O ATOM 0 H SER B 93 -15.402 5.192 -6.509 1.00 0.00 H new ATOM 0 HA SER B 93 -18.087 5.106 -5.530 1.00 0.00 H new ATOM 0 HB2 SER B 93 -18.547 4.100 -7.690 1.00 0.00 H new ATOM 0 HB3 SER B 93 -17.367 5.372 -7.942 1.00 0.00 H new ATOM 0 HG SER B 93 -15.722 3.551 -7.638 1.00 0.00 H new ATOM 1578 N ARG B 94 -18.568 2.576 -5.182 1.00 0.00 N ATOM 1579 CA ARG B 94 -18.720 1.206 -4.732 1.00 0.00 C ATOM 1580 C ARG B 94 -18.137 0.275 -5.756 1.00 0.00 C ATOM 1581 O ARG B 94 -17.515 -0.727 -5.416 1.00 0.00 O ATOM 1582 CB ARG B 94 -20.172 0.844 -4.462 1.00 0.00 C ATOM 1583 CG ARG B 94 -20.642 1.573 -3.218 1.00 0.00 C ATOM 1584 CD ARG B 94 -22.097 1.217 -2.944 1.00 0.00 C ATOM 1585 NE ARG B 94 -22.207 -0.224 -2.755 1.00 0.00 N ATOM 1586 CZ ARG B 94 -23.343 -0.808 -2.411 1.00 0.00 C ATOM 1587 NH1 ARG B 94 -24.389 -0.086 -2.130 1.00 0.00 N ATOM 1588 NH2 ARG B 94 -23.396 -2.105 -2.341 1.00 0.00 N ATOM 0 H ARG B 94 -19.443 3.072 -5.353 1.00 0.00 H new ATOM 0 HA ARG B 94 -18.185 1.105 -3.788 1.00 0.00 H new ATOM 0 HB2 ARG B 94 -20.793 1.118 -5.315 1.00 0.00 H new ATOM 0 HB3 ARG B 94 -20.272 -0.233 -4.327 1.00 0.00 H new ATOM 0 HG2 ARG B 94 -20.022 1.297 -2.365 1.00 0.00 H new ATOM 0 HG3 ARG B 94 -20.538 2.650 -3.353 1.00 0.00 H new ATOM 0 HD2 ARG B 94 -22.452 1.741 -2.056 1.00 0.00 H new ATOM 0 HD3 ARG B 94 -22.725 1.536 -3.775 1.00 0.00 H new ATOM 0 HE ARG B 94 -21.379 -0.803 -2.893 1.00 0.00 H new ATOM 0 HH11 ARG B 94 -24.333 0.931 -2.175 1.00 0.00 H new ATOM 0 HH12 ARG B 94 -25.264 -0.538 -1.865 1.00 0.00 H new ATOM 0 HH21 ARG B 94 -22.567 -2.661 -2.550 1.00 0.00 H new ATOM 0 HH22 ARG B 94 -24.266 -2.566 -2.077 1.00 0.00 H new ATOM 1602 N GLN B 95 -18.299 0.638 -7.014 1.00 0.00 N ATOM 1603 CA GLN B 95 -17.741 -0.147 -8.092 1.00 0.00 C ATOM 1604 C GLN B 95 -16.252 -0.280 -7.856 1.00 0.00 C ATOM 1605 O GLN B 95 -15.679 -1.364 -7.997 1.00 0.00 O ATOM 1606 CB GLN B 95 -17.991 0.547 -9.439 1.00 0.00 C ATOM 1607 CG GLN B 95 -19.494 0.573 -9.733 1.00 0.00 C ATOM 1608 CD GLN B 95 -19.762 1.327 -11.028 1.00 0.00 C ATOM 1609 OE1 GLN B 95 -19.802 0.724 -12.104 1.00 0.00 O ATOM 1610 NE2 GLN B 95 -19.938 2.611 -10.995 1.00 0.00 N ATOM 0 H GLN B 95 -18.811 1.469 -7.311 1.00 0.00 H new ATOM 0 HA GLN B 95 -18.212 -1.130 -8.119 1.00 0.00 H new ATOM 0 HB2 GLN B 95 -17.597 1.563 -9.414 1.00 0.00 H new ATOM 0 HB3 GLN B 95 -17.464 0.020 -10.234 1.00 0.00 H new ATOM 0 HG2 GLN B 95 -19.875 -0.445 -9.811 1.00 0.00 H new ATOM 0 HG3 GLN B 95 -20.025 1.050 -8.909 1.00 0.00 H new ATOM 0 HE21 GLN B 95 -19.905 3.108 -10.105 1.00 0.00 H new ATOM 0 HE22 GLN B 95 -20.110 3.125 -11.859 1.00 0.00 H new ATOM 1619 N THR B 96 -15.646 0.803 -7.403 1.00 0.00 N ATOM 1620 CA THR B 96 -14.241 0.785 -7.089 1.00 0.00 C ATOM 1621 C THR B 96 -13.953 -0.224 -5.967 1.00 0.00 C ATOM 1622 O THR B 96 -13.113 -1.115 -6.134 1.00 0.00 O ATOM 1623 CB THR B 96 -13.785 2.192 -6.684 1.00 0.00 C ATOM 1624 OG1 THR B 96 -14.263 3.141 -7.646 1.00 0.00 O ATOM 1625 CG2 THR B 96 -12.255 2.250 -6.625 1.00 0.00 C ATOM 0 H THR B 96 -16.108 1.699 -7.247 1.00 0.00 H new ATOM 0 HA THR B 96 -13.683 0.474 -7.972 1.00 0.00 H new ATOM 0 HB THR B 96 -14.188 2.431 -5.700 1.00 0.00 H new ATOM 0 HG1 THR B 96 -13.846 4.012 -7.481 1.00 0.00 H new ATOM 0 HG21 THR B 96 -11.940 3.253 -6.337 1.00 0.00 H new ATOM 0 HG22 THR B 96 -11.892 1.530 -5.891 1.00 0.00 H new ATOM 0 HG23 THR B 96 -11.844 2.008 -7.605 1.00 0.00 H new ATOM 1633 N ILE B 97 -14.703 -0.134 -4.868 1.00 0.00 N ATOM 1634 CA ILE B 97 -14.551 -1.086 -3.761 1.00 0.00 C ATOM 1635 C ILE B 97 -14.944 -2.483 -4.195 1.00 0.00 C ATOM 1636 O ILE B 97 -14.234 -3.449 -3.919 1.00 0.00 O ATOM 1637 CB ILE B 97 -15.389 -0.647 -2.548 1.00 0.00 C ATOM 1638 CG1 ILE B 97 -14.825 0.659 -1.976 1.00 0.00 C ATOM 1639 CG2 ILE B 97 -15.347 -1.731 -1.457 1.00 0.00 C ATOM 1640 CD1 ILE B 97 -13.382 0.441 -1.499 1.00 0.00 C ATOM 0 H ILE B 97 -15.416 0.580 -4.719 1.00 0.00 H new ATOM 0 HA ILE B 97 -13.501 -1.099 -3.469 1.00 0.00 H new ATOM 0 HB ILE B 97 -16.419 -0.496 -2.870 1.00 0.00 H new ATOM 0 HG12 ILE B 97 -14.852 1.440 -2.736 1.00 0.00 H new ATOM 0 HG13 ILE B 97 -15.444 1.000 -1.146 1.00 0.00 H new ATOM 0 HG21 ILE B 97 -15.943 -1.411 -0.603 1.00 0.00 H new ATOM 0 HG22 ILE B 97 -15.752 -2.662 -1.853 1.00 0.00 H new ATOM 0 HG23 ILE B 97 -14.316 -1.889 -1.141 1.00 0.00 H new ATOM 0 HD11 ILE B 97 -12.988 1.373 -1.094 1.00 0.00 H new ATOM 0 HD12 ILE B 97 -13.367 -0.326 -0.725 1.00 0.00 H new ATOM 0 HD13 ILE B 97 -12.765 0.121 -2.339 1.00 0.00 H new ATOM 1652 N ASN B 98 -16.047 -2.585 -4.908 1.00 0.00 N ATOM 1653 CA ASN B 98 -16.533 -3.877 -5.338 1.00 0.00 C ATOM 1654 C ASN B 98 -15.491 -4.569 -6.186 1.00 0.00 C ATOM 1655 O ASN B 98 -15.202 -5.744 -5.987 1.00 0.00 O ATOM 1656 CB ASN B 98 -17.843 -3.734 -6.127 1.00 0.00 C ATOM 1657 CG ASN B 98 -19.025 -3.625 -5.171 1.00 0.00 C ATOM 1658 OD1 ASN B 98 -19.457 -4.643 -4.610 1.00 0.00 O ATOM 1659 ND2 ASN B 98 -19.576 -2.469 -4.927 1.00 0.00 N ATOM 0 H ASN B 98 -16.620 -1.793 -5.200 1.00 0.00 H new ATOM 0 HA ASN B 98 -16.730 -4.480 -4.452 1.00 0.00 H new ATOM 0 HB2 ASN B 98 -17.798 -2.850 -6.763 1.00 0.00 H new ATOM 0 HB3 ASN B 98 -17.976 -4.593 -6.784 1.00 0.00 H new ATOM 0 HD21 ASN B 98 -20.359 -2.404 -4.277 1.00 0.00 H new ATOM 0 HD22 ASN B 98 -19.224 -1.629 -5.386 1.00 0.00 H new ATOM 1666 N GLY B 99 -14.847 -3.813 -7.054 1.00 0.00 N ATOM 1667 CA GLY B 99 -13.764 -4.366 -7.851 1.00 0.00 C ATOM 1668 C GLY B 99 -12.640 -4.838 -6.949 1.00 0.00 C ATOM 1669 O GLY B 99 -12.076 -5.921 -7.155 1.00 0.00 O ATOM 0 H GLY B 99 -15.049 -2.828 -7.226 1.00 0.00 H new ATOM 0 HA2 GLY B 99 -14.132 -5.198 -8.451 1.00 0.00 H new ATOM 0 HA3 GLY B 99 -13.392 -3.612 -8.545 1.00 0.00 H new ATOM 1673 N ILE B 100 -12.344 -4.041 -5.926 1.00 0.00 N ATOM 1674 CA ILE B 100 -11.319 -4.394 -4.960 1.00 0.00 C ATOM 1675 C ILE B 100 -11.739 -5.646 -4.191 1.00 0.00 C ATOM 1676 O ILE B 100 -10.939 -6.578 -4.019 1.00 0.00 O ATOM 1677 CB ILE B 100 -11.053 -3.214 -3.998 1.00 0.00 C ATOM 1678 CG1 ILE B 100 -10.451 -2.039 -4.784 1.00 0.00 C ATOM 1679 CG2 ILE B 100 -10.062 -3.636 -2.902 1.00 0.00 C ATOM 1680 CD1 ILE B 100 -9.153 -2.473 -5.460 1.00 0.00 C ATOM 0 H ILE B 100 -12.802 -3.147 -5.748 1.00 0.00 H new ATOM 0 HA ILE B 100 -10.390 -4.609 -5.489 1.00 0.00 H new ATOM 0 HB ILE B 100 -11.996 -2.916 -3.539 1.00 0.00 H new ATOM 0 HG12 ILE B 100 -11.162 -1.690 -5.533 1.00 0.00 H new ATOM 0 HG13 ILE B 100 -10.259 -1.202 -4.113 1.00 0.00 H new ATOM 0 HG21 ILE B 100 -9.883 -2.796 -2.231 1.00 0.00 H new ATOM 0 HG22 ILE B 100 -10.478 -4.470 -2.337 1.00 0.00 H new ATOM 0 HG23 ILE B 100 -9.121 -3.942 -3.360 1.00 0.00 H new ATOM 0 HD11 ILE B 100 -8.733 -1.634 -6.015 1.00 0.00 H new ATOM 0 HD12 ILE B 100 -8.440 -2.800 -4.703 1.00 0.00 H new ATOM 0 HD13 ILE B 100 -9.357 -3.295 -6.146 1.00 0.00 H new ATOM 1692 N GLU B 101 -13.010 -5.694 -3.774 1.00 0.00 N ATOM 1693 CA GLU B 101 -13.516 -6.866 -3.073 1.00 0.00 C ATOM 1694 C GLU B 101 -13.512 -8.062 -4.011 1.00 0.00 C ATOM 1695 O GLU B 101 -13.262 -9.191 -3.605 1.00 0.00 O ATOM 1696 CB GLU B 101 -14.944 -6.646 -2.554 1.00 0.00 C ATOM 1697 CG GLU B 101 -15.019 -5.401 -1.661 1.00 0.00 C ATOM 1698 CD GLU B 101 -16.264 -5.479 -0.797 1.00 0.00 C ATOM 1699 OE1 GLU B 101 -16.298 -6.327 0.074 1.00 0.00 O ATOM 1700 OE2 GLU B 101 -17.176 -4.716 -1.018 1.00 0.00 O ATOM 0 H GLU B 101 -13.691 -4.947 -3.909 1.00 0.00 H new ATOM 0 HA GLU B 101 -12.864 -7.047 -2.218 1.00 0.00 H new ATOM 0 HB2 GLU B 101 -15.628 -6.536 -3.396 1.00 0.00 H new ATOM 0 HB3 GLU B 101 -15.269 -7.521 -1.992 1.00 0.00 H new ATOM 0 HG2 GLU B 101 -14.130 -5.335 -1.033 1.00 0.00 H new ATOM 0 HG3 GLU B 101 -15.044 -4.500 -2.274 1.00 0.00 H new ATOM 1707 N LYS B 102 -13.864 -7.814 -5.245 1.00 0.00 N ATOM 1708 CA LYS B 102 -13.981 -8.860 -6.238 1.00 0.00 C ATOM 1709 C LYS B 102 -12.636 -9.131 -6.892 1.00 0.00 C ATOM 1710 O LYS B 102 -12.532 -9.906 -7.848 1.00 0.00 O ATOM 1711 CB LYS B 102 -15.030 -8.435 -7.242 1.00 0.00 C ATOM 1712 CG LYS B 102 -16.338 -8.331 -6.460 1.00 0.00 C ATOM 1713 CD LYS B 102 -17.426 -7.687 -7.292 1.00 0.00 C ATOM 1714 CE LYS B 102 -18.648 -7.499 -6.400 1.00 0.00 C ATOM 1715 NZ LYS B 102 -19.248 -8.824 -6.099 1.00 0.00 N ATOM 0 H LYS B 102 -14.079 -6.880 -5.595 1.00 0.00 H new ATOM 0 HA LYS B 102 -14.290 -9.797 -5.775 1.00 0.00 H new ATOM 0 HB2 LYS B 102 -14.770 -7.480 -7.698 1.00 0.00 H new ATOM 0 HB3 LYS B 102 -15.115 -9.161 -8.050 1.00 0.00 H new ATOM 0 HG2 LYS B 102 -16.657 -9.325 -6.147 1.00 0.00 H new ATOM 0 HG3 LYS B 102 -16.177 -7.748 -5.553 1.00 0.00 H new ATOM 0 HD2 LYS B 102 -17.089 -6.728 -7.685 1.00 0.00 H new ATOM 0 HD3 LYS B 102 -17.672 -8.313 -8.149 1.00 0.00 H new ATOM 0 HE2 LYS B 102 -18.363 -6.998 -5.475 1.00 0.00 H new ATOM 0 HE3 LYS B 102 -19.379 -6.861 -6.896 1.00 0.00 H new ATOM 0 HZ1 LYS B 102 -20.218 -8.694 -5.747 1.00 0.00 H new ATOM 0 HZ2 LYS B 102 -19.269 -9.400 -6.964 1.00 0.00 H new ATOM 0 HZ3 LYS B 102 -18.678 -9.307 -5.375 1.00 0.00 H new ATOM 1729 N ASN B 103 -11.611 -8.485 -6.356 1.00 0.00 N ATOM 1730 CA ASN B 103 -10.230 -8.657 -6.818 1.00 0.00 C ATOM 1731 C ASN B 103 -10.081 -8.386 -8.307 1.00 0.00 C ATOM 1732 O ASN B 103 -9.205 -8.961 -8.966 1.00 0.00 O ATOM 1733 CB ASN B 103 -9.709 -10.068 -6.494 1.00 0.00 C ATOM 1734 CG ASN B 103 -9.878 -10.386 -5.011 1.00 0.00 C ATOM 1735 OD1 ASN B 103 -10.983 -10.693 -4.557 1.00 0.00 O ATOM 1736 ND2 ASN B 103 -8.847 -10.339 -4.224 1.00 0.00 N ATOM 0 H ASN B 103 -11.708 -7.823 -5.586 1.00 0.00 H new ATOM 0 HA ASN B 103 -9.632 -7.921 -6.281 1.00 0.00 H new ATOM 0 HB2 ASN B 103 -10.247 -10.804 -7.091 1.00 0.00 H new ATOM 0 HB3 ASN B 103 -8.657 -10.143 -6.768 1.00 0.00 H new ATOM 0 HD21 ASN B 103 -8.952 -10.556 -3.233 1.00 0.00 H new ATOM 0 HD22 ASN B 103 -7.932 -10.085 -4.597 1.00 0.00 H new ATOM 1743 N LYS B 104 -10.865 -7.454 -8.831 1.00 0.00 N ATOM 1744 CA LYS B 104 -10.717 -7.070 -10.231 1.00 0.00 C ATOM 1745 C LYS B 104 -9.356 -6.440 -10.457 1.00 0.00 C ATOM 1746 O LYS B 104 -8.671 -6.741 -11.435 1.00 0.00 O ATOM 1747 CB LYS B 104 -11.821 -6.101 -10.662 1.00 0.00 C ATOM 1748 CG LYS B 104 -13.159 -6.847 -10.748 1.00 0.00 C ATOM 1749 CD LYS B 104 -14.263 -5.869 -11.175 1.00 0.00 C ATOM 1750 CE LYS B 104 -15.596 -6.611 -11.295 1.00 0.00 C ATOM 1751 NZ LYS B 104 -15.467 -7.704 -12.301 1.00 0.00 N ATOM 0 H LYS B 104 -11.596 -6.958 -8.322 1.00 0.00 H new ATOM 0 HA LYS B 104 -10.803 -7.971 -10.838 1.00 0.00 H new ATOM 0 HB2 LYS B 104 -11.896 -5.280 -9.949 1.00 0.00 H new ATOM 0 HB3 LYS B 104 -11.576 -5.662 -11.629 1.00 0.00 H new ATOM 0 HG2 LYS B 104 -13.086 -7.665 -11.464 1.00 0.00 H new ATOM 0 HG3 LYS B 104 -13.404 -7.290 -9.782 1.00 0.00 H new ATOM 0 HD2 LYS B 104 -14.349 -5.063 -10.446 1.00 0.00 H new ATOM 0 HD3 LYS B 104 -14.005 -5.409 -12.129 1.00 0.00 H new ATOM 0 HE2 LYS B 104 -15.883 -7.024 -10.328 1.00 0.00 H new ATOM 0 HE3 LYS B 104 -16.384 -5.919 -11.593 1.00 0.00 H new ATOM 0 HZ1 LYS B 104 -16.411 -7.971 -12.647 1.00 0.00 H new ATOM 0 HZ2 LYS B 104 -14.886 -7.375 -13.099 1.00 0.00 H new ATOM 0 HZ3 LYS B 104 -15.014 -8.530 -11.860 1.00 0.00 H new ATOM 1765 N TYR B 105 -8.961 -5.598 -9.525 1.00 0.00 N ATOM 1766 CA TYR B 105 -7.673 -4.933 -9.558 1.00 0.00 C ATOM 1767 C TYR B 105 -7.241 -4.627 -8.139 1.00 0.00 C ATOM 1768 O TYR B 105 -8.073 -4.591 -7.235 1.00 0.00 O ATOM 1769 CB TYR B 105 -7.759 -3.628 -10.373 1.00 0.00 C ATOM 1770 CG TYR B 105 -8.806 -2.716 -9.768 1.00 0.00 C ATOM 1771 CD1 TYR B 105 -10.155 -2.885 -10.105 1.00 0.00 C ATOM 1772 CD2 TYR B 105 -8.432 -1.709 -8.870 1.00 0.00 C ATOM 1773 CE1 TYR B 105 -11.125 -2.054 -9.545 1.00 0.00 C ATOM 1774 CE2 TYR B 105 -9.407 -0.878 -8.309 1.00 0.00 C ATOM 1775 CZ TYR B 105 -10.753 -1.054 -8.649 1.00 0.00 C ATOM 1776 OH TYR B 105 -11.711 -0.240 -8.097 1.00 0.00 O ATOM 0 H TYR B 105 -9.530 -5.353 -8.715 1.00 0.00 H new ATOM 0 HA TYR B 105 -6.943 -5.587 -10.035 1.00 0.00 H new ATOM 0 HB2 TYR B 105 -6.790 -3.129 -10.382 1.00 0.00 H new ATOM 0 HB3 TYR B 105 -8.012 -3.851 -11.409 1.00 0.00 H new ATOM 0 HD1 TYR B 105 -10.444 -3.660 -10.799 1.00 0.00 H new ATOM 0 HD2 TYR B 105 -7.392 -1.574 -8.611 1.00 0.00 H new ATOM 0 HE1 TYR B 105 -12.165 -2.186 -9.806 1.00 0.00 H new ATOM 0 HE2 TYR B 105 -9.122 -0.102 -7.615 1.00 0.00 H new ATOM 0 HH TYR B 105 -11.944 -0.568 -7.203 1.00 0.00 H new ATOM 1786 N ASN B 106 -5.964 -4.358 -7.945 1.00 0.00 N ATOM 1787 CA ASN B 106 -5.474 -3.976 -6.626 1.00 0.00 C ATOM 1788 C ASN B 106 -5.553 -2.465 -6.481 1.00 0.00 C ATOM 1789 O ASN B 106 -5.320 -1.748 -7.448 1.00 0.00 O ATOM 1790 CB ASN B 106 -4.039 -4.460 -6.420 1.00 0.00 C ATOM 1791 CG ASN B 106 -3.799 -4.740 -4.948 1.00 0.00 C ATOM 1792 OD1 ASN B 106 -2.808 -4.181 -4.342 1.00 0.00 O flip ATOM 1793 ND2 ASN B 106 -4.546 -5.493 -4.328 1.00 0.00 N flip ATOM 0 H ASN B 106 -5.250 -4.395 -8.673 1.00 0.00 H new ATOM 0 HA ASN B 106 -6.096 -4.445 -5.864 1.00 0.00 H new ATOM 0 HB2 ASN B 106 -3.862 -5.362 -7.005 1.00 0.00 H new ATOM 0 HB3 ASN B 106 -3.336 -3.706 -6.776 1.00 0.00 H new ATOM 0 HD21 ASN B 106 -5.331 -5.937 -4.803 1.00 0.00 H new ATOM 0 HD22 ASN B 106 -4.381 -5.674 -3.338 1.00 0.00 H new ATOM 1800 N PRO B 107 -5.979 -1.972 -5.343 1.00 0.00 N ATOM 1801 CA PRO B 107 -6.218 -0.509 -5.153 1.00 0.00 C ATOM 1802 C PRO B 107 -4.937 0.313 -5.142 1.00 0.00 C ATOM 1803 O PRO B 107 -3.832 -0.219 -4.970 1.00 0.00 O ATOM 1804 CB PRO B 107 -6.914 -0.437 -3.799 1.00 0.00 C ATOM 1805 CG PRO B 107 -6.361 -1.587 -3.027 1.00 0.00 C ATOM 1806 CD PRO B 107 -6.036 -2.690 -4.045 1.00 0.00 C ATOM 0 HA PRO B 107 -6.800 -0.091 -5.974 1.00 0.00 H new ATOM 0 HB2 PRO B 107 -6.710 0.510 -3.299 1.00 0.00 H new ATOM 0 HB3 PRO B 107 -7.996 -0.515 -3.905 1.00 0.00 H new ATOM 0 HG2 PRO B 107 -5.466 -1.291 -2.480 1.00 0.00 H new ATOM 0 HG3 PRO B 107 -7.083 -1.941 -2.291 1.00 0.00 H new ATOM 0 HD2 PRO B 107 -5.089 -3.178 -3.816 1.00 0.00 H new ATOM 0 HD3 PRO B 107 -6.801 -3.466 -4.051 1.00 0.00 H new ATOM 1814 N SER B 108 -5.094 1.610 -5.341 1.00 0.00 N ATOM 1815 CA SER B 108 -3.982 2.540 -5.314 1.00 0.00 C ATOM 1816 C SER B 108 -3.370 2.564 -3.913 1.00 0.00 C ATOM 1817 O SER B 108 -4.015 2.150 -2.937 1.00 0.00 O ATOM 1818 CB SER B 108 -4.469 3.940 -5.689 1.00 0.00 C ATOM 1819 OG SER B 108 -5.527 3.833 -6.641 1.00 0.00 O ATOM 0 H SER B 108 -5.997 2.047 -5.526 1.00 0.00 H new ATOM 0 HA SER B 108 -3.227 2.221 -6.033 1.00 0.00 H new ATOM 0 HB2 SER B 108 -4.816 4.467 -4.800 1.00 0.00 H new ATOM 0 HB3 SER B 108 -3.648 4.524 -6.105 1.00 0.00 H new ATOM 0 HG SER B 108 -5.842 4.729 -6.882 1.00 0.00 H new ATOM 1825 N LEU B 109 -2.157 3.075 -3.805 1.00 0.00 N ATOM 1826 CA LEU B 109 -1.467 3.135 -2.525 1.00 0.00 C ATOM 1827 C LEU B 109 -2.262 3.982 -1.535 1.00 0.00 C ATOM 1828 O LEU B 109 -2.457 3.596 -0.380 1.00 0.00 O ATOM 1829 CB LEU B 109 -0.054 3.715 -2.723 1.00 0.00 C ATOM 1830 CG LEU B 109 0.692 3.828 -1.384 1.00 0.00 C ATOM 1831 CD1 LEU B 109 0.770 2.463 -0.695 1.00 0.00 C ATOM 1832 CD2 LEU B 109 2.115 4.330 -1.643 1.00 0.00 C ATOM 0 H LEU B 109 -1.627 3.456 -4.589 1.00 0.00 H new ATOM 0 HA LEU B 109 -1.379 2.128 -2.118 1.00 0.00 H new ATOM 0 HB2 LEU B 109 0.511 3.079 -3.405 1.00 0.00 H new ATOM 0 HB3 LEU B 109 -0.123 4.698 -3.188 1.00 0.00 H new ATOM 0 HG LEU B 109 0.152 4.523 -0.740 1.00 0.00 H new ATOM 0 HD11 LEU B 109 1.302 2.563 0.251 1.00 0.00 H new ATOM 0 HD12 LEU B 109 -0.238 2.092 -0.508 1.00 0.00 H new ATOM 0 HD13 LEU B 109 1.302 1.761 -1.337 1.00 0.00 H new ATOM 0 HD21 LEU B 109 2.650 4.412 -0.697 1.00 0.00 H new ATOM 0 HD22 LEU B 109 2.636 3.628 -2.294 1.00 0.00 H new ATOM 0 HD23 LEU B 109 2.074 5.308 -2.123 1.00 0.00 H new ATOM 1844 N GLN B 110 -2.762 5.107 -2.005 1.00 0.00 N ATOM 1845 CA GLN B 110 -3.560 5.992 -1.171 1.00 0.00 C ATOM 1846 C GLN B 110 -4.830 5.298 -0.704 1.00 0.00 C ATOM 1847 O GLN B 110 -5.190 5.357 0.474 1.00 0.00 O ATOM 1848 CB GLN B 110 -3.939 7.228 -1.989 1.00 0.00 C ATOM 1849 CG GLN B 110 -4.828 8.162 -1.170 1.00 0.00 C ATOM 1850 CD GLN B 110 -5.164 9.390 -1.993 1.00 0.00 C ATOM 1851 OE1 GLN B 110 -5.514 9.274 -3.174 1.00 0.00 O ATOM 1852 NE2 GLN B 110 -5.082 10.552 -1.454 1.00 0.00 N ATOM 0 H GLN B 110 -2.631 5.433 -2.962 1.00 0.00 H new ATOM 0 HA GLN B 110 -2.976 6.273 -0.295 1.00 0.00 H new ATOM 0 HB2 GLN B 110 -3.037 7.755 -2.300 1.00 0.00 H new ATOM 0 HB3 GLN B 110 -4.460 6.924 -2.897 1.00 0.00 H new ATOM 0 HG2 GLN B 110 -5.742 7.646 -0.876 1.00 0.00 H new ATOM 0 HG3 GLN B 110 -4.318 8.455 -0.252 1.00 0.00 H new ATOM 0 HE21 GLN B 110 -4.793 10.643 -0.480 1.00 0.00 H new ATOM 0 HE22 GLN B 110 -5.306 11.384 -2.000 1.00 0.00 H new ATOM 1861 N LEU B 111 -5.530 4.689 -1.639 1.00 0.00 N ATOM 1862 CA LEU B 111 -6.810 4.066 -1.328 1.00 0.00 C ATOM 1863 C LEU B 111 -6.621 2.941 -0.332 1.00 0.00 C ATOM 1864 O LEU B 111 -7.356 2.837 0.648 1.00 0.00 O ATOM 1865 CB LEU B 111 -7.460 3.509 -2.601 1.00 0.00 C ATOM 1866 CG LEU B 111 -7.832 4.654 -3.555 1.00 0.00 C ATOM 1867 CD1 LEU B 111 -8.406 4.073 -4.854 1.00 0.00 C ATOM 1868 CD2 LEU B 111 -8.867 5.578 -2.902 1.00 0.00 C ATOM 0 H LEU B 111 -5.242 4.610 -2.614 1.00 0.00 H new ATOM 0 HA LEU B 111 -7.460 4.827 -0.896 1.00 0.00 H new ATOM 0 HB2 LEU B 111 -6.774 2.822 -3.097 1.00 0.00 H new ATOM 0 HB3 LEU B 111 -8.352 2.938 -2.342 1.00 0.00 H new ATOM 0 HG LEU B 111 -6.936 5.233 -3.778 1.00 0.00 H new ATOM 0 HD11 LEU B 111 -8.670 4.886 -5.531 1.00 0.00 H new ATOM 0 HD12 LEU B 111 -7.660 3.434 -5.327 1.00 0.00 H new ATOM 0 HD13 LEU B 111 -9.296 3.486 -4.628 1.00 0.00 H new ATOM 0 HD21 LEU B 111 -9.120 6.384 -3.590 1.00 0.00 H new ATOM 0 HD22 LEU B 111 -9.765 5.008 -2.664 1.00 0.00 H new ATOM 0 HD23 LEU B 111 -8.452 6.000 -1.986 1.00 0.00 H new ATOM 1880 N ALA B 112 -5.594 2.140 -0.553 1.00 0.00 N ATOM 1881 CA ALA B 112 -5.295 1.041 0.346 1.00 0.00 C ATOM 1882 C ALA B 112 -4.973 1.573 1.728 1.00 0.00 C ATOM 1883 O ALA B 112 -5.506 1.098 2.735 1.00 0.00 O ATOM 1884 CB ALA B 112 -4.124 0.221 -0.191 1.00 0.00 C ATOM 0 H ALA B 112 -4.956 2.229 -1.344 1.00 0.00 H new ATOM 0 HA ALA B 112 -6.170 0.394 0.413 1.00 0.00 H new ATOM 0 HB1 ALA B 112 -3.911 -0.600 0.493 1.00 0.00 H new ATOM 0 HB2 ALA B 112 -4.380 -0.181 -1.171 1.00 0.00 H new ATOM 0 HB3 ALA B 112 -3.244 0.858 -0.279 1.00 0.00 H new ATOM 1890 N LEU B 113 -4.138 2.593 1.770 1.00 0.00 N ATOM 1891 CA LEU B 113 -3.784 3.209 3.032 1.00 0.00 C ATOM 1892 C LEU B 113 -4.988 3.849 3.706 1.00 0.00 C ATOM 1893 O LEU B 113 -5.165 3.712 4.923 1.00 0.00 O ATOM 1894 CB LEU B 113 -2.647 4.206 2.876 1.00 0.00 C ATOM 1895 CG LEU B 113 -1.343 3.462 2.550 1.00 0.00 C ATOM 1896 CD1 LEU B 113 -0.256 4.473 2.198 1.00 0.00 C ATOM 1897 CD2 LEU B 113 -0.893 2.653 3.776 1.00 0.00 C ATOM 0 H LEU B 113 -3.695 3.010 0.951 1.00 0.00 H new ATOM 0 HA LEU B 113 -3.430 2.410 3.683 1.00 0.00 H new ATOM 0 HB2 LEU B 113 -2.880 4.916 2.082 1.00 0.00 H new ATOM 0 HB3 LEU B 113 -2.528 4.782 3.794 1.00 0.00 H new ATOM 0 HG LEU B 113 -1.512 2.792 1.707 1.00 0.00 H new ATOM 0 HD11 LEU B 113 0.670 3.946 1.967 1.00 0.00 H new ATOM 0 HD12 LEU B 113 -0.568 5.056 1.332 1.00 0.00 H new ATOM 0 HD13 LEU B 113 -0.092 5.140 3.044 1.00 0.00 H new ATOM 0 HD21 LEU B 113 0.032 2.125 3.544 1.00 0.00 H new ATOM 0 HD22 LEU B 113 -0.725 3.328 4.616 1.00 0.00 H new ATOM 0 HD23 LEU B 113 -1.666 1.931 4.039 1.00 0.00 H new ATOM 1909 N LYS B 114 -5.852 4.504 2.921 1.00 0.00 N ATOM 1910 CA LYS B 114 -7.048 5.086 3.506 1.00 0.00 C ATOM 1911 C LYS B 114 -7.879 3.994 4.158 1.00 0.00 C ATOM 1912 O LYS B 114 -8.341 4.148 5.290 1.00 0.00 O ATOM 1913 CB LYS B 114 -7.902 5.821 2.455 1.00 0.00 C ATOM 1914 CG LYS B 114 -7.208 7.121 2.058 1.00 0.00 C ATOM 1915 CD LYS B 114 -8.036 7.884 1.004 1.00 0.00 C ATOM 1916 CE LYS B 114 -8.901 8.976 1.679 1.00 0.00 C ATOM 1917 NZ LYS B 114 -10.214 9.115 0.990 1.00 0.00 N ATOM 0 H LYS B 114 -5.746 4.638 1.915 1.00 0.00 H new ATOM 0 HA LYS B 114 -6.732 5.816 4.251 1.00 0.00 H new ATOM 0 HB2 LYS B 114 -8.043 5.189 1.578 1.00 0.00 H new ATOM 0 HB3 LYS B 114 -8.892 6.033 2.858 1.00 0.00 H new ATOM 0 HG2 LYS B 114 -7.067 7.747 2.939 1.00 0.00 H new ATOM 0 HG3 LYS B 114 -6.217 6.903 1.660 1.00 0.00 H new ATOM 0 HD2 LYS B 114 -7.371 8.341 0.271 1.00 0.00 H new ATOM 0 HD3 LYS B 114 -8.676 7.188 0.463 1.00 0.00 H new ATOM 0 HE2 LYS B 114 -9.061 8.723 2.727 1.00 0.00 H new ATOM 0 HE3 LYS B 114 -8.372 9.929 1.658 1.00 0.00 H new ATOM 0 HZ1 LYS B 114 -10.493 10.117 0.973 1.00 0.00 H new ATOM 0 HZ2 LYS B 114 -10.134 8.762 0.015 1.00 0.00 H new ATOM 0 HZ3 LYS B 114 -10.934 8.564 1.500 1.00 0.00 H new ATOM 1931 N ILE B 115 -7.986 2.855 3.483 1.00 0.00 N ATOM 1932 CA ILE B 115 -8.715 1.724 4.038 1.00 0.00 C ATOM 1933 C ILE B 115 -8.038 1.271 5.319 1.00 0.00 C ATOM 1934 O ILE B 115 -8.693 1.036 6.340 1.00 0.00 O ATOM 1935 CB ILE B 115 -8.710 0.556 3.032 1.00 0.00 C ATOM 1936 CG1 ILE B 115 -9.522 0.919 1.795 1.00 0.00 C ATOM 1937 CG2 ILE B 115 -9.318 -0.692 3.668 1.00 0.00 C ATOM 1938 CD1 ILE B 115 -9.295 -0.137 0.707 1.00 0.00 C ATOM 0 H ILE B 115 -7.582 2.692 2.561 1.00 0.00 H new ATOM 0 HA ILE B 115 -9.742 2.026 4.243 1.00 0.00 H new ATOM 0 HB ILE B 115 -7.677 0.358 2.748 1.00 0.00 H new ATOM 0 HG12 ILE B 115 -10.581 0.976 2.046 1.00 0.00 H new ATOM 0 HG13 ILE B 115 -9.228 1.903 1.429 1.00 0.00 H new ATOM 0 HG21 ILE B 115 -9.308 -1.509 2.947 1.00 0.00 H new ATOM 0 HG22 ILE B 115 -8.735 -0.975 4.545 1.00 0.00 H new ATOM 0 HG23 ILE B 115 -10.345 -0.484 3.967 1.00 0.00 H new ATOM 0 HD11 ILE B 115 -9.876 0.122 -0.178 1.00 0.00 H new ATOM 0 HD12 ILE B 115 -8.237 -0.172 0.449 1.00 0.00 H new ATOM 0 HD13 ILE B 115 -9.611 -1.113 1.075 1.00 0.00 H new ATOM 1950 N ALA B 116 -6.721 1.168 5.269 1.00 0.00 N ATOM 1951 CA ALA B 116 -5.965 0.731 6.426 1.00 0.00 C ATOM 1952 C ALA B 116 -6.167 1.677 7.594 1.00 0.00 C ATOM 1953 O ALA B 116 -6.513 1.249 8.701 1.00 0.00 O ATOM 1954 CB ALA B 116 -4.471 0.623 6.088 1.00 0.00 C ATOM 0 H ALA B 116 -6.158 1.380 4.445 1.00 0.00 H new ATOM 0 HA ALA B 116 -6.332 -0.255 6.712 1.00 0.00 H new ATOM 0 HB1 ALA B 116 -3.921 0.294 6.970 1.00 0.00 H new ATOM 0 HB2 ALA B 116 -4.331 -0.098 5.283 1.00 0.00 H new ATOM 0 HB3 ALA B 116 -4.098 1.597 5.771 1.00 0.00 H new ATOM 1960 N TYR B 117 -5.956 2.967 7.351 1.00 0.00 N ATOM 1961 CA TYR B 117 -6.100 3.954 8.412 1.00 0.00 C ATOM 1962 C TYR B 117 -7.530 3.987 8.925 1.00 0.00 C ATOM 1963 O TYR B 117 -7.767 3.940 10.134 1.00 0.00 O ATOM 1964 CB TYR B 117 -5.700 5.350 7.932 1.00 0.00 C ATOM 1965 CG TYR B 117 -5.808 6.327 9.090 1.00 0.00 C ATOM 1966 CD1 TYR B 117 -4.715 6.518 9.943 1.00 0.00 C ATOM 1967 CD2 TYR B 117 -6.998 7.034 9.313 1.00 0.00 C ATOM 1968 CE1 TYR B 117 -4.809 7.411 11.013 1.00 0.00 C ATOM 1969 CE2 TYR B 117 -7.088 7.928 10.386 1.00 0.00 C ATOM 1970 CZ TYR B 117 -5.994 8.116 11.234 1.00 0.00 C ATOM 1971 OH TYR B 117 -6.088 8.996 12.296 1.00 0.00 O ATOM 0 H TYR B 117 -5.689 3.348 6.443 1.00 0.00 H new ATOM 0 HA TYR B 117 -5.433 3.659 9.222 1.00 0.00 H new ATOM 0 HB2 TYR B 117 -4.681 5.337 7.546 1.00 0.00 H new ATOM 0 HB3 TYR B 117 -6.347 5.665 7.113 1.00 0.00 H new ATOM 0 HD1 TYR B 117 -3.797 5.974 9.774 1.00 0.00 H new ATOM 0 HD2 TYR B 117 -7.844 6.889 8.658 1.00 0.00 H new ATOM 0 HE1 TYR B 117 -3.964 7.556 11.670 1.00 0.00 H new ATOM 0 HE2 TYR B 117 -8.004 8.473 10.559 1.00 0.00 H new ATOM 0 HH TYR B 117 -6.979 9.404 12.305 1.00 0.00 H new ATOM 1981 N TYR B 118 -8.488 4.067 8.010 1.00 0.00 N ATOM 1982 CA TYR B 118 -9.886 4.152 8.407 1.00 0.00 C ATOM 1983 C TYR B 118 -10.305 2.932 9.191 1.00 0.00 C ATOM 1984 O TYR B 118 -11.054 3.036 10.164 1.00 0.00 O ATOM 1985 CB TYR B 118 -10.812 4.356 7.203 1.00 0.00 C ATOM 1986 CG TYR B 118 -10.844 5.822 6.817 1.00 0.00 C ATOM 1987 CD1 TYR B 118 -11.375 6.765 7.708 1.00 0.00 C ATOM 1988 CD2 TYR B 118 -10.349 6.237 5.578 1.00 0.00 C ATOM 1989 CE1 TYR B 118 -11.410 8.117 7.359 1.00 0.00 C ATOM 1990 CE2 TYR B 118 -10.386 7.589 5.230 1.00 0.00 C ATOM 1991 CZ TYR B 118 -10.917 8.530 6.119 1.00 0.00 C ATOM 1992 OH TYR B 118 -10.950 9.864 5.775 1.00 0.00 O ATOM 0 H TYR B 118 -8.326 4.075 7.003 1.00 0.00 H new ATOM 0 HA TYR B 118 -9.980 5.027 9.050 1.00 0.00 H new ATOM 0 HB2 TYR B 118 -10.465 3.757 6.361 1.00 0.00 H new ATOM 0 HB3 TYR B 118 -11.818 4.013 7.445 1.00 0.00 H new ATOM 0 HD1 TYR B 118 -11.758 6.446 8.666 1.00 0.00 H new ATOM 0 HD2 TYR B 118 -9.938 5.513 4.890 1.00 0.00 H new ATOM 0 HE1 TYR B 118 -11.818 8.842 8.047 1.00 0.00 H new ATOM 0 HE2 TYR B 118 -10.004 7.909 4.272 1.00 0.00 H new ATOM 0 HH TYR B 118 -10.568 9.981 4.880 1.00 0.00 H new ATOM 2002 N LEU B 119 -9.825 1.779 8.781 1.00 0.00 N ATOM 2003 CA LEU B 119 -10.157 0.549 9.471 1.00 0.00 C ATOM 2004 C LEU B 119 -9.173 0.283 10.606 1.00 0.00 C ATOM 2005 O LEU B 119 -9.209 -0.785 11.224 1.00 0.00 O ATOM 2006 CB LEU B 119 -10.175 -0.637 8.494 1.00 0.00 C ATOM 2007 CG LEU B 119 -11.215 -0.390 7.384 1.00 0.00 C ATOM 2008 CD1 LEU B 119 -11.220 -1.566 6.405 1.00 0.00 C ATOM 2009 CD2 LEU B 119 -12.613 -0.214 7.990 1.00 0.00 C ATOM 0 H LEU B 119 -9.207 1.666 7.978 1.00 0.00 H new ATOM 0 HA LEU B 119 -11.154 0.661 9.897 1.00 0.00 H new ATOM 0 HB2 LEU B 119 -9.187 -0.772 8.054 1.00 0.00 H new ATOM 0 HB3 LEU B 119 -10.414 -1.556 9.029 1.00 0.00 H new ATOM 0 HG LEU B 119 -10.946 0.522 6.851 1.00 0.00 H new ATOM 0 HD11 LEU B 119 -11.957 -1.385 5.623 1.00 0.00 H new ATOM 0 HD12 LEU B 119 -10.232 -1.670 5.956 1.00 0.00 H new ATOM 0 HD13 LEU B 119 -11.474 -2.482 6.938 1.00 0.00 H new ATOM 0 HD21 LEU B 119 -13.336 -0.040 7.193 1.00 0.00 H new ATOM 0 HD22 LEU B 119 -12.888 -1.115 8.539 1.00 0.00 H new ATOM 0 HD23 LEU B 119 -12.610 0.638 8.669 1.00 0.00 H new ATOM 2021 N ASN B 120 -8.203 1.189 10.784 1.00 0.00 N ATOM 2022 CA ASN B 120 -7.133 0.990 11.773 1.00 0.00 C ATOM 2023 C ASN B 120 -6.573 -0.408 11.630 1.00 0.00 C ATOM 2024 O ASN B 120 -6.140 -1.028 12.599 1.00 0.00 O ATOM 2025 CB ASN B 120 -7.651 1.216 13.205 1.00 0.00 C ATOM 2026 CG ASN B 120 -6.513 1.052 14.218 1.00 0.00 C ATOM 2027 OD1 ASN B 120 -6.546 0.138 15.049 1.00 0.00 O ATOM 2028 ND2 ASN B 120 -5.503 1.866 14.196 1.00 0.00 N ATOM 0 H ASN B 120 -8.136 2.062 10.260 1.00 0.00 H new ATOM 0 HA ASN B 120 -6.345 1.719 11.588 1.00 0.00 H new ATOM 0 HB2 ASN B 120 -8.080 2.214 13.290 1.00 0.00 H new ATOM 0 HB3 ASN B 120 -8.448 0.506 13.426 1.00 0.00 H new ATOM 0 HD21 ASN B 120 -4.740 1.750 14.863 1.00 0.00 H new ATOM 0 HD22 ASN B 120 -5.472 2.622 13.512 1.00 0.00 H new ATOM 2035 N THR B 121 -6.577 -0.889 10.414 1.00 0.00 N ATOM 2036 CA THR B 121 -6.094 -2.211 10.111 1.00 0.00 C ATOM 2037 C THR B 121 -4.887 -2.098 9.194 1.00 0.00 C ATOM 2038 O THR B 121 -4.887 -1.284 8.279 1.00 0.00 O ATOM 2039 CB THR B 121 -7.222 -3.007 9.435 1.00 0.00 C ATOM 2040 OG1 THR B 121 -8.447 -2.836 10.180 1.00 0.00 O ATOM 2041 CG2 THR B 121 -6.856 -4.492 9.385 1.00 0.00 C ATOM 0 H THR B 121 -6.917 -0.373 9.603 1.00 0.00 H new ATOM 0 HA THR B 121 -5.793 -2.730 11.021 1.00 0.00 H new ATOM 0 HB THR B 121 -7.359 -2.639 8.418 1.00 0.00 H new ATOM 0 HG1 THR B 121 -8.374 -2.044 10.752 1.00 0.00 H new ATOM 0 HG21 THR B 121 -7.660 -5.049 8.905 1.00 0.00 H new ATOM 0 HG22 THR B 121 -5.935 -4.621 8.816 1.00 0.00 H new ATOM 0 HG23 THR B 121 -6.711 -4.865 10.399 1.00 0.00 H new ATOM 2049 N PRO B 122 -3.836 -2.835 9.450 1.00 0.00 N ATOM 2050 CA PRO B 122 -2.612 -2.698 8.609 1.00 0.00 C ATOM 2051 C PRO B 122 -2.921 -2.990 7.150 1.00 0.00 C ATOM 2052 O PRO B 122 -3.709 -3.885 6.834 1.00 0.00 O ATOM 2053 CB PRO B 122 -1.642 -3.734 9.182 1.00 0.00 C ATOM 2054 CG PRO B 122 -2.118 -3.955 10.575 1.00 0.00 C ATOM 2055 CD PRO B 122 -3.636 -3.843 10.510 1.00 0.00 C ATOM 0 HA PRO B 122 -2.202 -1.688 8.632 1.00 0.00 H new ATOM 0 HB2 PRO B 122 -1.661 -4.658 8.604 1.00 0.00 H new ATOM 0 HB3 PRO B 122 -0.615 -3.369 9.166 1.00 0.00 H new ATOM 0 HG2 PRO B 122 -1.812 -4.934 10.943 1.00 0.00 H new ATOM 0 HG3 PRO B 122 -1.699 -3.214 11.255 1.00 0.00 H new ATOM 0 HD2 PRO B 122 -4.103 -4.795 10.258 1.00 0.00 H new ATOM 0 HD3 PRO B 122 -4.060 -3.522 11.461 1.00 0.00 H new ATOM 2063 N LEU B 123 -2.278 -2.255 6.274 1.00 0.00 N ATOM 2064 CA LEU B 123 -2.470 -2.416 4.853 1.00 0.00 C ATOM 2065 C LEU B 123 -2.055 -3.814 4.432 1.00 0.00 C ATOM 2066 O LEU B 123 -2.770 -4.482 3.669 1.00 0.00 O ATOM 2067 CB LEU B 123 -1.650 -1.360 4.105 1.00 0.00 C ATOM 2068 CG LEU B 123 -1.845 -1.504 2.592 1.00 0.00 C ATOM 2069 CD1 LEU B 123 -1.604 -0.154 1.921 1.00 0.00 C ATOM 2070 CD2 LEU B 123 -0.850 -2.535 2.047 1.00 0.00 C ATOM 0 H LEU B 123 -1.607 -1.529 6.526 1.00 0.00 H new ATOM 0 HA LEU B 123 -3.524 -2.282 4.608 1.00 0.00 H new ATOM 0 HB2 LEU B 123 -1.953 -0.363 4.424 1.00 0.00 H new ATOM 0 HB3 LEU B 123 -0.594 -1.467 4.354 1.00 0.00 H new ATOM 0 HG LEU B 123 -2.862 -1.837 2.383 1.00 0.00 H new ATOM 0 HD11 LEU B 123 -1.742 -0.253 0.844 1.00 0.00 H new ATOM 0 HD12 LEU B 123 -2.311 0.578 2.312 1.00 0.00 H new ATOM 0 HD13 LEU B 123 -0.587 0.178 2.127 1.00 0.00 H new ATOM 0 HD21 LEU B 123 -0.987 -2.639 0.971 1.00 0.00 H new ATOM 0 HD22 LEU B 123 0.168 -2.203 2.253 1.00 0.00 H new ATOM 0 HD23 LEU B 123 -1.022 -3.497 2.529 1.00 0.00 H new ATOM 2082 N GLU B 124 -0.937 -4.278 4.974 1.00 0.00 N ATOM 2083 CA GLU B 124 -0.451 -5.617 4.668 1.00 0.00 C ATOM 2084 C GLU B 124 -1.450 -6.651 5.132 1.00 0.00 C ATOM 2085 O GLU B 124 -1.635 -7.683 4.491 1.00 0.00 O ATOM 2086 CB GLU B 124 0.881 -5.893 5.352 1.00 0.00 C ATOM 2087 CG GLU B 124 1.982 -5.021 4.757 1.00 0.00 C ATOM 2088 CD GLU B 124 3.293 -5.335 5.441 1.00 0.00 C ATOM 2089 OE1 GLU B 124 3.301 -5.477 6.651 1.00 0.00 O ATOM 2090 OE2 GLU B 124 4.271 -5.468 4.752 1.00 0.00 O ATOM 0 H GLU B 124 -0.353 -3.751 5.623 1.00 0.00 H new ATOM 0 HA GLU B 124 -0.317 -5.677 3.588 1.00 0.00 H new ATOM 0 HB2 GLU B 124 0.794 -5.699 6.421 1.00 0.00 H new ATOM 0 HB3 GLU B 124 1.142 -6.945 5.239 1.00 0.00 H new ATOM 0 HG2 GLU B 124 2.065 -5.202 3.685 1.00 0.00 H new ATOM 0 HG3 GLU B 124 1.736 -3.967 4.884 1.00 0.00 H new ATOM 2097 N ASP B 125 -2.067 -6.390 6.272 1.00 0.00 N ATOM 2098 CA ASP B 125 -3.034 -7.320 6.828 1.00 0.00 C ATOM 2099 C ASP B 125 -4.185 -7.458 5.859 1.00 0.00 C ATOM 2100 O ASP B 125 -4.764 -8.542 5.699 1.00 0.00 O ATOM 2101 CB ASP B 125 -3.561 -6.811 8.174 1.00 0.00 C ATOM 2102 CG ASP B 125 -4.256 -7.931 8.921 1.00 0.00 C ATOM 2103 OD1 ASP B 125 -3.589 -8.879 9.276 1.00 0.00 O ATOM 2104 OD2 ASP B 125 -5.441 -7.830 9.139 1.00 0.00 O ATOM 0 H ASP B 125 -1.917 -5.548 6.827 1.00 0.00 H new ATOM 0 HA ASP B 125 -2.552 -8.285 6.988 1.00 0.00 H new ATOM 0 HB2 ASP B 125 -2.737 -6.422 8.772 1.00 0.00 H new ATOM 0 HB3 ASP B 125 -4.255 -5.986 8.013 1.00 0.00 H new ATOM 2109 N ILE B 126 -4.487 -6.364 5.178 1.00 0.00 N ATOM 2110 CA ILE B 126 -5.544 -6.353 4.192 1.00 0.00 C ATOM 2111 C ILE B 126 -5.025 -6.872 2.858 1.00 0.00 C ATOM 2112 O ILE B 126 -5.625 -7.766 2.250 1.00 0.00 O ATOM 2113 CB ILE B 126 -6.071 -4.928 4.007 1.00 0.00 C ATOM 2114 CG1 ILE B 126 -6.668 -4.413 5.321 1.00 0.00 C ATOM 2115 CG2 ILE B 126 -7.169 -4.938 2.940 1.00 0.00 C ATOM 2116 CD1 ILE B 126 -6.952 -2.916 5.197 1.00 0.00 C ATOM 0 H ILE B 126 -4.009 -5.470 5.294 1.00 0.00 H new ATOM 0 HA ILE B 126 -6.350 -6.998 4.541 1.00 0.00 H new ATOM 0 HB ILE B 126 -5.249 -4.280 3.704 1.00 0.00 H new ATOM 0 HG12 ILE B 126 -7.588 -4.951 5.551 1.00 0.00 H new ATOM 0 HG13 ILE B 126 -5.977 -4.596 6.144 1.00 0.00 H new ATOM 0 HG21 ILE B 126 -7.551 -3.927 2.801 1.00 0.00 H new ATOM 0 HG22 ILE B 126 -6.758 -5.303 1.999 1.00 0.00 H new ATOM 0 HG23 ILE B 126 -7.981 -5.592 3.259 1.00 0.00 H new ATOM 0 HD11 ILE B 126 -7.377 -2.548 6.131 1.00 0.00 H new ATOM 0 HD12 ILE B 126 -6.023 -2.386 4.987 1.00 0.00 H new ATOM 0 HD13 ILE B 126 -7.659 -2.746 4.385 1.00 0.00 H new ATOM 2128 N PHE B 127 -3.925 -6.295 2.397 1.00 0.00 N ATOM 2129 CA PHE B 127 -3.359 -6.661 1.109 1.00 0.00 C ATOM 2130 C PHE B 127 -2.076 -7.447 1.284 1.00 0.00 C ATOM 2131 O PHE B 127 -1.097 -6.933 1.823 1.00 0.00 O ATOM 2132 CB PHE B 127 -3.094 -5.405 0.272 1.00 0.00 C ATOM 2133 CG PHE B 127 -4.397 -4.676 0.041 1.00 0.00 C ATOM 2134 CD1 PHE B 127 -5.217 -5.030 -1.034 1.00 0.00 C ATOM 2135 CD2 PHE B 127 -4.793 -3.661 0.919 1.00 0.00 C ATOM 2136 CE1 PHE B 127 -6.428 -4.360 -1.238 1.00 0.00 C ATOM 2137 CE2 PHE B 127 -6.004 -2.992 0.719 1.00 0.00 C ATOM 2138 CZ PHE B 127 -6.825 -3.345 -0.357 1.00 0.00 C ATOM 0 H PHE B 127 -3.407 -5.572 2.896 1.00 0.00 H new ATOM 0 HA PHE B 127 -4.079 -7.292 0.589 1.00 0.00 H new ATOM 0 HB2 PHE B 127 -2.386 -4.754 0.785 1.00 0.00 H new ATOM 0 HB3 PHE B 127 -2.642 -5.678 -0.682 1.00 0.00 H new ATOM 0 HD1 PHE B 127 -4.916 -5.820 -1.706 1.00 0.00 H new ATOM 0 HD2 PHE B 127 -4.161 -3.394 1.753 1.00 0.00 H new ATOM 0 HE1 PHE B 127 -7.057 -4.625 -2.075 1.00 0.00 H new ATOM 0 HE2 PHE B 127 -6.305 -2.204 1.394 1.00 0.00 H new ATOM 0 HZ PHE B 127 -7.765 -2.835 -0.509 1.00 0.00 H new ATOM 2148 N GLN B 128 -2.057 -8.670 0.774 1.00 0.00 N ATOM 2149 CA GLN B 128 -0.858 -9.495 0.845 1.00 0.00 C ATOM 2150 C GLN B 128 -0.201 -9.577 -0.530 1.00 0.00 C ATOM 2151 O GLN B 128 -0.712 -10.260 -1.422 1.00 0.00 O ATOM 2152 CB GLN B 128 -1.179 -10.929 1.349 1.00 0.00 C ATOM 2153 CG GLN B 128 -2.600 -11.011 1.947 1.00 0.00 C ATOM 2154 CD GLN B 128 -2.682 -10.247 3.253 1.00 0.00 C ATOM 2155 OE1 GLN B 128 -3.434 -9.200 3.334 1.00 0.00 O flip ATOM 2156 NE2 GLN B 128 -2.042 -10.626 4.235 1.00 0.00 N flip ATOM 0 H GLN B 128 -2.851 -9.111 0.310 1.00 0.00 H new ATOM 0 HA GLN B 128 -0.177 -9.028 1.556 1.00 0.00 H new ATOM 0 HB2 GLN B 128 -1.089 -11.635 0.524 1.00 0.00 H new ATOM 0 HB3 GLN B 128 -0.448 -11.224 2.102 1.00 0.00 H new ATOM 0 HG2 GLN B 128 -3.321 -10.605 1.238 1.00 0.00 H new ATOM 0 HG3 GLN B 128 -2.869 -12.054 2.114 1.00 0.00 H new ATOM 0 HE21 GLN B 128 -1.449 -11.453 4.169 1.00 0.00 H new ATOM 0 HE22 GLN B 128 -2.105 -10.113 5.114 1.00 0.00 H new ATOM 2165 N TRP B 129 0.955 -8.933 -0.679 1.00 0.00 N ATOM 2166 CA TRP B 129 1.719 -8.999 -1.927 1.00 0.00 C ATOM 2167 C TRP B 129 2.496 -10.297 -1.961 1.00 0.00 C ATOM 2168 O TRP B 129 3.318 -10.550 -1.074 1.00 0.00 O ATOM 2169 CB TRP B 129 2.686 -7.801 -2.029 1.00 0.00 C ATOM 2170 CG TRP B 129 3.484 -7.868 -3.307 1.00 0.00 C ATOM 2171 CD1 TRP B 129 3.111 -7.337 -4.492 1.00 0.00 C ATOM 2172 CD2 TRP B 129 4.781 -8.495 -3.544 1.00 0.00 C ATOM 2173 NE1 TRP B 129 4.099 -7.596 -5.427 1.00 0.00 N ATOM 2174 CE2 TRP B 129 5.135 -8.310 -4.893 1.00 0.00 C ATOM 2175 CE3 TRP B 129 5.674 -9.193 -2.730 1.00 0.00 C ATOM 2176 CZ2 TRP B 129 6.322 -8.809 -5.420 1.00 0.00 C ATOM 2177 CZ3 TRP B 129 6.874 -9.695 -3.258 1.00 0.00 C ATOM 2178 CH2 TRP B 129 7.199 -9.499 -4.598 1.00 0.00 C ATOM 0 H TRP B 129 1.384 -8.360 0.047 1.00 0.00 H new ATOM 0 HA TRP B 129 1.033 -8.959 -2.773 1.00 0.00 H new ATOM 0 HB2 TRP B 129 2.123 -6.868 -1.995 1.00 0.00 H new ATOM 0 HB3 TRP B 129 3.361 -7.798 -1.173 1.00 0.00 H new ATOM 0 HD1 TRP B 129 2.193 -6.799 -4.679 1.00 0.00 H new ATOM 0 HE1 TRP B 129 4.058 -7.290 -6.399 1.00 0.00 H new ATOM 0 HE3 TRP B 129 5.440 -9.348 -1.687 1.00 0.00 H new ATOM 0 HZ2 TRP B 129 6.559 -8.660 -6.463 1.00 0.00 H new ATOM 0 HZ3 TRP B 129 7.553 -10.239 -2.618 1.00 0.00 H new ATOM 0 HH2 TRP B 129 8.128 -9.882 -4.994 1.00 0.00 H new ATOM 2189 N GLN B 130 2.172 -11.149 -2.914 1.00 0.00 N ATOM 2190 CA GLN B 130 2.780 -12.462 -3.002 1.00 0.00 C ATOM 2191 C GLN B 130 3.768 -12.533 -4.159 1.00 0.00 C ATOM 2192 O GLN B 130 3.373 -12.430 -5.325 1.00 0.00 O ATOM 2193 CB GLN B 130 1.690 -13.515 -3.194 1.00 0.00 C ATOM 2194 CG GLN B 130 0.803 -13.570 -1.943 1.00 0.00 C ATOM 2195 CD GLN B 130 0.721 -15.000 -1.435 1.00 0.00 C ATOM 2196 OE1 GLN B 130 0.194 -15.917 -2.190 1.00 0.00 O flip ATOM 2197 NE2 GLN B 130 1.158 -15.291 -0.319 1.00 0.00 N flip ATOM 0 H GLN B 130 1.486 -10.953 -3.643 1.00 0.00 H new ATOM 0 HA GLN B 130 3.323 -12.653 -2.077 1.00 0.00 H new ATOM 0 HB2 GLN B 130 1.087 -13.274 -4.070 1.00 0.00 H new ATOM 0 HB3 GLN B 130 2.141 -14.491 -3.376 1.00 0.00 H new ATOM 0 HG2 GLN B 130 1.211 -12.921 -1.168 1.00 0.00 H new ATOM 0 HG3 GLN B 130 -0.195 -13.199 -2.177 1.00 0.00 H new ATOM 0 HE21 GLN B 130 1.571 -14.569 0.271 1.00 0.00 H new ATOM 0 HE22 GLN B 130 1.106 -16.254 0.014 1.00 0.00 H new