USER MOD reduce.3.24.130724 H: found=0, std=0, add=818, rem=0, adj=41 USER MOD reduce.3.24.130724 removed 819 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 187 THR OG1 : rot 127:sc= 2.2 USER MOD Set 1.2: A 191 THR OG1 : rot 159:sc= -3.76! USER MOD Set 1.3: A 205 MET CE :methyl 155:sc= -1.1 (180deg=-3.3!) USER MOD Set 2.1: A 159 GLN :FLIP amide:sc= -0.876 F(o=-4.4!,f=-2.8) USER MOD Set 2.2: A 186 HIS :FLIP no HD1:sc= -1.93 X(o=-2.9,f=-2.8) USER MOD Set 3.1: A 133 MET CE :methyl -140:sc= -4.31! (180deg=-3.94!) USER MOD Set 3.2: A 156 TYR OH : rot 8:sc= -2.39 USER MOD Set 3.3: A 212 MET CE :methyl -125:sc= -5.42! (180deg=-4.74!) USER MOD Single : A 127 TYR OH : rot 180:sc= 0 USER MOD Single : A 128 MET CE :methyl 154:sc= -2.92! (180deg=-5.17!) USER MOD Single : A 131 SER OG : rot -170:sc= 0 USER MOD Single : A 134 SER OG : rot -49:sc= 0.269 USER MOD Single : A 139 HIS :FLIP no HD1:sc= -1.36 F(o=-2.4,f=-1.4) USER MOD Single : A 142 ASN : amide:sc= -1.59! C(o=-1.6!,f=-8.3!) USER MOD Single : A 144 TYR OH : rot 180:sc= 0 USER MOD Single : A 148 TYR OH : rot 180:sc= 0 USER MOD Single : A 149 TYR OH : rot -140:sc= -1.61 USER MOD Single : A 152 ASN : amide:sc= -6.22! C(o=-6.2!,f=-12!) USER MOD Single : A 153 MET CE :methyl 160:sc= -10.6! (180deg=-13.6!) USER MOD Single : A 154 TYR OH : rot 180:sc= 0 USER MOD Single : A 158 ASN : amide:sc= 0 X(o=0,f=0.17) USER MOD Single : A 161 TYR OH : rot 180:sc= 0 USER MOD Single : A 162 TYR OH : rot 9:sc= -3.9! USER MOD Single : A 167 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 168 TYR OH : rot 0:sc= 0.71 USER MOD Single : A 169 SER OG : rot 180:sc= 0 USER MOD Single : A 170 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 171 GLN :FLIP amide:sc= -0.392 F(o=-6.1!,f=-0.39) USER MOD Single : A 172 ASN : amide:sc= 0 X(o=0,f=-0.15) USER MOD Single : A 173 SER OG : rot 180:sc= 0 USER MOD Single : A 176 HIS : no HE2:sc= 1.02 K(o=1,f=-5.7!) USER MOD Single : A 180 ASN :FLIP amide:sc= -0.0367 F(o=-0.9,f=-0.037) USER MOD Single : A 182 THR OG1 : rot -91:sc= -5.35! USER MOD Single : A 184 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 185 GLN :FLIP amide:sc= -0.368 F(o=-1.5!,f=-0.37) USER MOD Single : A 189 THR OG1 : rot 6:sc= 0.218 USER MOD Single : A 190 THR OG1 : rot 180:sc= 0 USER MOD Single : A 192 THR OG1 : rot 177:sc= -0.843 USER MOD Single : A 193 LYS NZ :NH3+ 139:sc= 0.665 (180deg=0.0555) USER MOD Single : A 196 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 198 THR OG1 : rot 180:sc=0.000561 USER MOD Single : A 200 THR OG1 : rot 180:sc= 0 USER MOD Single : A 203 LYS NZ :NH3+ -170:sc= 1.72 (180deg=1.6) USER MOD Single : A 211 GLN : amide:sc= -0.515 X(o=-0.52,f=-0.33) USER MOD Single : A 215 THR OG1 : rot 62:sc= 1.23 USER MOD Single : A 216 GLN : amide:sc= -0.596 K(o=-0.6,f=-4.4!) USER MOD Single : A 217 TYR OH : rot 71:sc= 0.0908 USER MOD Single : A 218 GLN : amide:sc= -0.965 X(o=-0.97,f=-1.2) USER MOD Single : A 219 GLN :FLIP amide:sc= -0.174 F(o=-1.9!,f=-0.17) USER MOD Single : A 221 SER OG : rot 78:sc= 0.803 USER MOD Single : A 222 GLN :FLIP amide:sc= 0 F(o=-0.62,f=0) USER MOD Single : A 225 TYR OH : rot 180:sc= 0 USER MOD Single : A 226 GLN : amide:sc= -0.0568 X(o=-0.057,f=-0.18) USER MOD ----------------------------------------------------------------- ATOM 1 N LEU A 124 -6.708 15.022 1.662 1.00 0.00 N ATOM 2 CA LEU A 124 -7.579 13.986 2.268 1.00 0.00 C ATOM 3 C LEU A 124 -8.941 14.557 2.624 1.00 0.00 C ATOM 4 O LEU A 124 -9.082 15.290 3.599 1.00 0.00 O ATOM 5 CB LEU A 124 -6.945 13.383 3.529 1.00 0.00 C ATOM 6 CG LEU A 124 -6.020 12.184 3.305 1.00 0.00 C ATOM 7 CD1 LEU A 124 -4.771 12.593 2.544 1.00 0.00 C ATOM 8 CD2 LEU A 124 -5.654 11.547 4.636 1.00 0.00 C ATOM 0 HA LEU A 124 -7.699 13.200 1.522 1.00 0.00 H new ATOM 0 HB2 LEU A 124 -6.379 14.164 4.036 1.00 0.00 H new ATOM 0 HB3 LEU A 124 -7.745 13.079 4.204 1.00 0.00 H new ATOM 0 HG LEU A 124 -6.552 11.449 2.701 1.00 0.00 H new ATOM 0 HD11 LEU A 124 -4.132 11.722 2.399 1.00 0.00 H new ATOM 0 HD12 LEU A 124 -5.054 13.002 1.574 1.00 0.00 H new ATOM 0 HD13 LEU A 124 -4.230 13.349 3.112 1.00 0.00 H new ATOM 0 HD21 LEU A 124 -4.996 10.695 4.463 1.00 0.00 H new ATOM 0 HD22 LEU A 124 -5.143 12.279 5.262 1.00 0.00 H new ATOM 0 HD23 LEU A 124 -6.560 11.209 5.139 1.00 0.00 H new ATOM 20 N GLY A 125 -9.932 14.235 1.812 1.00 0.00 N ATOM 21 CA GLY A 125 -11.302 14.561 2.143 1.00 0.00 C ATOM 22 C GLY A 125 -12.087 13.307 2.453 1.00 0.00 C ATOM 23 O GLY A 125 -12.810 13.237 3.446 1.00 0.00 O ATOM 0 H GLY A 125 -9.812 13.750 0.923 1.00 0.00 H new ATOM 0 HA2 GLY A 125 -11.325 15.232 3.001 1.00 0.00 H new ATOM 0 HA3 GLY A 125 -11.766 15.091 1.312 1.00 0.00 H new ATOM 27 N GLY A 126 -11.908 12.310 1.600 1.00 0.00 N ATOM 28 CA GLY A 126 -12.525 11.017 1.798 1.00 0.00 C ATOM 29 C GLY A 126 -11.504 9.907 1.784 1.00 0.00 C ATOM 30 O GLY A 126 -11.686 8.895 1.111 1.00 0.00 O ATOM 0 H GLY A 126 -11.335 12.378 0.759 1.00 0.00 H new ATOM 0 HA2 GLY A 126 -13.059 11.009 2.748 1.00 0.00 H new ATOM 0 HA3 GLY A 126 -13.264 10.842 1.016 1.00 0.00 H new ATOM 34 N TYR A 127 -10.405 10.110 2.493 1.00 0.00 N ATOM 35 CA TYR A 127 -9.446 9.043 2.700 1.00 0.00 C ATOM 36 C TYR A 127 -9.437 8.648 4.151 1.00 0.00 C ATOM 37 O TYR A 127 -8.880 9.352 4.994 1.00 0.00 O ATOM 38 CB TYR A 127 -8.031 9.429 2.289 1.00 0.00 C ATOM 39 CG TYR A 127 -7.917 9.687 0.813 1.00 0.00 C ATOM 40 CD1 TYR A 127 -8.333 8.736 -0.100 1.00 0.00 C ATOM 41 CD2 TYR A 127 -7.432 10.894 0.335 1.00 0.00 C ATOM 42 CE1 TYR A 127 -8.262 8.971 -1.451 1.00 0.00 C ATOM 43 CE2 TYR A 127 -7.365 11.141 -1.018 1.00 0.00 C ATOM 44 CZ TYR A 127 -7.783 10.174 -1.904 1.00 0.00 C ATOM 45 OH TYR A 127 -7.736 10.411 -3.249 1.00 0.00 O ATOM 0 H TYR A 127 -10.158 10.998 2.931 1.00 0.00 H new ATOM 0 HA TYR A 127 -9.759 8.212 2.068 1.00 0.00 H new ATOM 0 HB2 TYR A 127 -7.727 10.321 2.836 1.00 0.00 H new ATOM 0 HB3 TYR A 127 -7.343 8.632 2.571 1.00 0.00 H new ATOM 0 HD1 TYR A 127 -8.720 7.792 0.255 1.00 0.00 H new ATOM 0 HD2 TYR A 127 -7.103 11.650 1.032 1.00 0.00 H new ATOM 0 HE1 TYR A 127 -8.581 8.214 -2.152 1.00 0.00 H new ATOM 0 HE2 TYR A 127 -6.988 12.086 -1.381 1.00 0.00 H new ATOM 0 HH TYR A 127 -7.374 11.307 -3.411 1.00 0.00 H new ATOM 55 N MET A 128 -10.090 7.556 4.444 1.00 0.00 N ATOM 56 CA MET A 128 -9.972 6.956 5.740 1.00 0.00 C ATOM 57 C MET A 128 -8.738 6.084 5.676 1.00 0.00 C ATOM 58 O MET A 128 -8.248 5.804 4.585 1.00 0.00 O ATOM 59 CB MET A 128 -11.254 6.185 6.092 1.00 0.00 C ATOM 60 CG MET A 128 -11.415 4.838 5.438 1.00 0.00 C ATOM 61 SD MET A 128 -11.195 3.474 6.597 1.00 0.00 S ATOM 62 CE MET A 128 -10.953 2.115 5.461 1.00 0.00 C ATOM 0 H MET A 128 -10.710 7.065 3.800 1.00 0.00 H new ATOM 0 HA MET A 128 -9.860 7.690 6.538 1.00 0.00 H new ATOM 0 HB2 MET A 128 -11.287 6.048 7.173 1.00 0.00 H new ATOM 0 HB3 MET A 128 -12.111 6.802 5.823 1.00 0.00 H new ATOM 0 HG2 MET A 128 -12.406 4.772 4.989 1.00 0.00 H new ATOM 0 HG3 MET A 128 -10.691 4.742 4.628 1.00 0.00 H new ATOM 0 HE1 MET A 128 -10.368 1.334 5.947 1.00 0.00 H new ATOM 0 HE2 MET A 128 -11.921 1.712 5.164 1.00 0.00 H new ATOM 0 HE3 MET A 128 -10.422 2.469 4.578 1.00 0.00 H new ATOM 72 N LEU A 129 -8.155 5.716 6.783 1.00 0.00 N ATOM 73 CA LEU A 129 -6.996 4.885 6.673 1.00 0.00 C ATOM 74 C LEU A 129 -7.423 3.469 6.365 1.00 0.00 C ATOM 75 O LEU A 129 -7.933 2.755 7.229 1.00 0.00 O ATOM 76 CB LEU A 129 -6.098 4.950 7.893 1.00 0.00 C ATOM 77 CG LEU A 129 -4.656 4.607 7.555 1.00 0.00 C ATOM 78 CD1 LEU A 129 -3.713 5.717 7.980 1.00 0.00 C ATOM 79 CD2 LEU A 129 -4.264 3.290 8.200 1.00 0.00 C ATOM 0 H LEU A 129 -8.447 5.965 7.728 1.00 0.00 H new ATOM 0 HA LEU A 129 -6.389 5.265 5.851 1.00 0.00 H new ATOM 0 HB2 LEU A 129 -6.142 5.951 8.323 1.00 0.00 H new ATOM 0 HB3 LEU A 129 -6.467 4.260 8.652 1.00 0.00 H new ATOM 0 HG LEU A 129 -4.576 4.502 6.473 1.00 0.00 H new ATOM 0 HD11 LEU A 129 -2.689 5.442 7.725 1.00 0.00 H new ATOM 0 HD12 LEU A 129 -3.981 6.639 7.464 1.00 0.00 H new ATOM 0 HD13 LEU A 129 -3.791 5.868 9.057 1.00 0.00 H new ATOM 0 HD21 LEU A 129 -3.229 3.056 7.950 1.00 0.00 H new ATOM 0 HD22 LEU A 129 -4.367 3.370 9.282 1.00 0.00 H new ATOM 0 HD23 LEU A 129 -4.914 2.497 7.832 1.00 0.00 H new ATOM 91 N GLY A 130 -7.235 3.101 5.106 1.00 0.00 N ATOM 92 CA GLY A 130 -7.683 1.829 4.600 1.00 0.00 C ATOM 93 C GLY A 130 -6.876 0.676 5.139 1.00 0.00 C ATOM 94 O GLY A 130 -6.044 0.104 4.434 1.00 0.00 O ATOM 0 H GLY A 130 -6.766 3.683 4.412 1.00 0.00 H new ATOM 0 HA2 GLY A 130 -8.732 1.687 4.861 1.00 0.00 H new ATOM 0 HA3 GLY A 130 -7.623 1.833 3.512 1.00 0.00 H new ATOM 98 N SER A 131 -7.108 0.385 6.411 1.00 0.00 N ATOM 99 CA SER A 131 -6.539 -0.773 7.088 1.00 0.00 C ATOM 100 C SER A 131 -5.029 -0.683 7.264 1.00 0.00 C ATOM 101 O SER A 131 -4.266 -0.620 6.299 1.00 0.00 O ATOM 102 CB SER A 131 -6.885 -2.060 6.347 1.00 0.00 C ATOM 103 OG SER A 131 -8.286 -2.267 6.305 1.00 0.00 O ATOM 0 H SER A 131 -7.705 0.954 7.011 1.00 0.00 H new ATOM 0 HA SER A 131 -6.985 -0.785 8.083 1.00 0.00 H new ATOM 0 HB2 SER A 131 -6.491 -2.015 5.332 1.00 0.00 H new ATOM 0 HB3 SER A 131 -6.404 -2.906 6.838 1.00 0.00 H new ATOM 0 HG SER A 131 -8.474 -3.168 5.968 1.00 0.00 H new ATOM 109 N ALA A 132 -4.599 -0.690 8.509 1.00 0.00 N ATOM 110 CA ALA A 132 -3.196 -0.859 8.806 1.00 0.00 C ATOM 111 C ALA A 132 -2.888 -2.340 8.866 1.00 0.00 C ATOM 112 O ALA A 132 -3.040 -2.985 9.906 1.00 0.00 O ATOM 113 CB ALA A 132 -2.799 -0.175 10.103 1.00 0.00 C ATOM 0 H ALA A 132 -5.199 -0.581 9.326 1.00 0.00 H new ATOM 0 HA ALA A 132 -2.613 -0.386 8.015 1.00 0.00 H new ATOM 0 HB1 ALA A 132 -1.735 -0.329 10.285 1.00 0.00 H new ATOM 0 HB2 ALA A 132 -3.003 0.893 10.028 1.00 0.00 H new ATOM 0 HB3 ALA A 132 -3.373 -0.597 10.928 1.00 0.00 H new ATOM 119 N MET A 133 -2.525 -2.879 7.720 1.00 0.00 N ATOM 120 CA MET A 133 -2.167 -4.278 7.606 1.00 0.00 C ATOM 121 C MET A 133 -0.842 -4.541 8.302 1.00 0.00 C ATOM 122 O MET A 133 -0.270 -3.656 8.934 1.00 0.00 O ATOM 123 CB MET A 133 -2.058 -4.677 6.133 1.00 0.00 C ATOM 124 CG MET A 133 -1.187 -3.731 5.331 1.00 0.00 C ATOM 125 SD MET A 133 -0.318 -4.533 3.976 1.00 0.00 S ATOM 126 CE MET A 133 -0.014 -3.138 2.887 1.00 0.00 C ATOM 0 H MET A 133 -2.470 -2.361 6.843 1.00 0.00 H new ATOM 0 HA MET A 133 -2.946 -4.873 8.083 1.00 0.00 H new ATOM 0 HB2 MET A 133 -1.650 -5.686 6.064 1.00 0.00 H new ATOM 0 HB3 MET A 133 -3.055 -4.705 5.694 1.00 0.00 H new ATOM 0 HG2 MET A 133 -1.808 -2.929 4.931 1.00 0.00 H new ATOM 0 HG3 MET A 133 -0.458 -3.268 5.996 1.00 0.00 H new ATOM 0 HE1 MET A 133 -0.167 -3.444 1.852 1.00 0.00 H new ATOM 0 HE2 MET A 133 -0.702 -2.329 3.132 1.00 0.00 H new ATOM 0 HE3 MET A 133 1.012 -2.793 3.015 1.00 0.00 H new ATOM 136 N SER A 134 -0.351 -5.754 8.178 1.00 0.00 N ATOM 137 CA SER A 134 0.945 -6.094 8.717 1.00 0.00 C ATOM 138 C SER A 134 1.842 -6.556 7.578 1.00 0.00 C ATOM 139 O SER A 134 2.693 -7.433 7.755 1.00 0.00 O ATOM 140 CB SER A 134 0.797 -7.184 9.785 1.00 0.00 C ATOM 141 OG SER A 134 2.007 -7.383 10.500 1.00 0.00 O ATOM 0 H SER A 134 -0.831 -6.522 7.708 1.00 0.00 H new ATOM 0 HA SER A 134 1.397 -5.223 9.192 1.00 0.00 H new ATOM 0 HB2 SER A 134 0.004 -6.908 10.480 1.00 0.00 H new ATOM 0 HB3 SER A 134 0.495 -8.119 9.312 1.00 0.00 H new ATOM 0 HG SER A 134 2.748 -7.485 9.867 1.00 0.00 H new ATOM 147 N ARG A 135 1.653 -5.917 6.416 1.00 0.00 N ATOM 148 CA ARG A 135 2.341 -6.266 5.189 1.00 0.00 C ATOM 149 C ARG A 135 1.948 -7.681 4.726 1.00 0.00 C ATOM 150 O ARG A 135 2.171 -8.659 5.435 1.00 0.00 O ATOM 151 CB ARG A 135 3.839 -6.117 5.394 1.00 0.00 C ATOM 152 CG ARG A 135 4.618 -6.129 4.108 1.00 0.00 C ATOM 153 CD ARG A 135 4.831 -7.548 3.609 1.00 0.00 C ATOM 154 NE ARG A 135 5.984 -8.206 4.229 1.00 0.00 N ATOM 155 CZ ARG A 135 5.951 -8.959 5.337 1.00 0.00 C ATOM 156 NH1 ARG A 135 4.826 -9.138 6.016 1.00 0.00 N ATOM 157 NH2 ARG A 135 7.062 -9.541 5.767 1.00 0.00 N ATOM 0 H ARG A 135 1.007 -5.134 6.312 1.00 0.00 H new ATOM 0 HA ARG A 135 2.041 -5.586 4.391 1.00 0.00 H new ATOM 0 HB2 ARG A 135 4.036 -5.184 5.921 1.00 0.00 H new ATOM 0 HB3 ARG A 135 4.194 -6.925 6.033 1.00 0.00 H new ATOM 0 HG2 ARG A 135 4.087 -5.551 3.352 1.00 0.00 H new ATOM 0 HG3 ARG A 135 5.583 -5.645 4.259 1.00 0.00 H new ATOM 0 HD2 ARG A 135 3.934 -8.135 3.807 1.00 0.00 H new ATOM 0 HD3 ARG A 135 4.968 -7.530 2.528 1.00 0.00 H new ATOM 0 HE ARG A 135 6.890 -8.080 3.778 1.00 0.00 H new ATOM 0 HH11 ARG A 135 3.963 -8.698 5.697 1.00 0.00 H new ATOM 0 HH12 ARG A 135 4.824 -9.715 6.857 1.00 0.00 H new ATOM 0 HH21 ARG A 135 7.935 -9.414 5.255 1.00 0.00 H new ATOM 0 HH22 ARG A 135 7.044 -10.115 6.610 1.00 0.00 H new ATOM 171 N PRO A 136 1.408 -7.813 3.501 1.00 0.00 N ATOM 172 CA PRO A 136 0.804 -9.053 3.017 1.00 0.00 C ATOM 173 C PRO A 136 1.814 -9.998 2.371 1.00 0.00 C ATOM 174 O PRO A 136 1.481 -10.699 1.415 1.00 0.00 O ATOM 175 CB PRO A 136 -0.209 -8.563 1.972 1.00 0.00 C ATOM 176 CG PRO A 136 0.161 -7.147 1.645 1.00 0.00 C ATOM 177 CD PRO A 136 1.370 -6.781 2.467 1.00 0.00 C ATOM 0 HA PRO A 136 0.366 -9.631 3.831 1.00 0.00 H new ATOM 0 HB2 PRO A 136 -0.177 -9.188 1.079 1.00 0.00 H new ATOM 0 HB3 PRO A 136 -1.225 -8.617 2.363 1.00 0.00 H new ATOM 0 HG2 PRO A 136 0.378 -7.045 0.582 1.00 0.00 H new ATOM 0 HG3 PRO A 136 -0.668 -6.475 1.867 1.00 0.00 H new ATOM 0 HD2 PRO A 136 2.279 -6.782 1.866 1.00 0.00 H new ATOM 0 HD3 PRO A 136 1.275 -5.785 2.898 1.00 0.00 H new ATOM 185 N LEU A 137 3.033 -10.015 2.926 1.00 0.00 N ATOM 186 CA LEU A 137 4.144 -10.851 2.447 1.00 0.00 C ATOM 187 C LEU A 137 4.161 -10.998 0.934 1.00 0.00 C ATOM 188 O LEU A 137 3.802 -12.038 0.376 1.00 0.00 O ATOM 189 CB LEU A 137 4.146 -12.210 3.102 1.00 0.00 C ATOM 190 CG LEU A 137 2.779 -12.789 3.323 1.00 0.00 C ATOM 191 CD1 LEU A 137 2.612 -14.046 2.502 1.00 0.00 C ATOM 192 CD2 LEU A 137 2.604 -13.011 4.799 1.00 0.00 C ATOM 0 H LEU A 137 3.280 -9.441 3.732 1.00 0.00 H new ATOM 0 HA LEU A 137 5.054 -10.325 2.735 1.00 0.00 H new ATOM 0 HB2 LEU A 137 4.724 -12.898 2.484 1.00 0.00 H new ATOM 0 HB3 LEU A 137 4.657 -12.137 4.062 1.00 0.00 H new ATOM 0 HG LEU A 137 1.996 -12.108 2.989 1.00 0.00 H new ATOM 0 HD11 LEU A 137 1.617 -14.460 2.668 1.00 0.00 H new ATOM 0 HD12 LEU A 137 2.735 -13.809 1.445 1.00 0.00 H new ATOM 0 HD13 LEU A 137 3.363 -14.777 2.799 1.00 0.00 H new ATOM 0 HD21 LEU A 137 1.617 -13.432 4.989 1.00 0.00 H new ATOM 0 HD22 LEU A 137 3.368 -13.701 5.156 1.00 0.00 H new ATOM 0 HD23 LEU A 137 2.700 -12.060 5.324 1.00 0.00 H new ATOM 204 N ILE A 138 4.572 -9.942 0.282 1.00 0.00 N ATOM 205 CA ILE A 138 4.589 -9.879 -1.158 1.00 0.00 C ATOM 206 C ILE A 138 5.732 -10.694 -1.735 1.00 0.00 C ATOM 207 O ILE A 138 5.523 -11.424 -2.692 1.00 0.00 O ATOM 208 CB ILE A 138 4.792 -8.447 -1.577 1.00 0.00 C ATOM 209 CG1 ILE A 138 3.771 -7.527 -0.889 1.00 0.00 C ATOM 210 CG2 ILE A 138 4.728 -8.310 -3.086 1.00 0.00 C ATOM 211 CD1 ILE A 138 2.401 -7.552 -1.521 1.00 0.00 C ATOM 0 H ILE A 138 4.907 -9.094 0.738 1.00 0.00 H new ATOM 0 HA ILE A 138 3.644 -10.279 -1.525 1.00 0.00 H new ATOM 0 HB ILE A 138 5.787 -8.137 -1.259 1.00 0.00 H new ATOM 0 HG12 ILE A 138 3.683 -7.818 0.158 1.00 0.00 H new ATOM 0 HG13 ILE A 138 4.149 -6.505 -0.905 1.00 0.00 H new ATOM 0 HG21 ILE A 138 4.877 -7.267 -3.363 1.00 0.00 H new ATOM 0 HG22 ILE A 138 5.508 -8.921 -3.540 1.00 0.00 H new ATOM 0 HG23 ILE A 138 3.753 -8.643 -3.441 1.00 0.00 H new ATOM 0 HD11 ILE A 138 1.738 -6.878 -0.979 1.00 0.00 H new ATOM 0 HD12 ILE A 138 2.474 -7.232 -2.560 1.00 0.00 H new ATOM 0 HD13 ILE A 138 2.000 -8.565 -1.481 1.00 0.00 H new ATOM 223 N HIS A 139 6.929 -10.536 -1.117 1.00 0.00 N ATOM 224 CA HIS A 139 8.230 -11.116 -1.566 1.00 0.00 C ATOM 225 C HIS A 139 8.490 -10.968 -3.071 1.00 0.00 C ATOM 226 O HIS A 139 7.591 -10.725 -3.872 1.00 0.00 O ATOM 227 CB HIS A 139 8.415 -12.590 -1.134 1.00 0.00 C ATOM 228 CG HIS A 139 7.264 -13.454 -1.503 1.00 0.00 C ATOM 229 ND1 HIS A 139 6.798 -13.793 -2.714 1.00 0.00 N flip ATOM 230 CD2 HIS A 139 6.343 -13.897 -0.592 1.00 0.00 C flip ATOM 231 CE1 HIS A 139 5.581 -14.399 -2.536 1.00 0.00 C flip ATOM 232 NE2 HIS A 139 5.342 -14.457 -1.234 1.00 0.00 N flip ATOM 0 H HIS A 139 7.024 -9.984 -0.264 1.00 0.00 H new ATOM 0 HA HIS A 139 8.978 -10.514 -1.050 1.00 0.00 H new ATOM 0 HB2 HIS A 139 9.321 -12.986 -1.593 1.00 0.00 H new ATOM 0 HB3 HIS A 139 8.561 -12.631 -0.055 1.00 0.00 H new ATOM 0 HD2 HIS A 139 6.426 -13.802 0.481 1.00 0.00 H new ATOM 0 HE1 HIS A 139 4.932 -14.764 -3.318 1.00 0.00 H new ATOM 0 HE2 HIS A 139 4.516 -14.869 -0.800 1.00 0.00 H new ATOM 241 N PHE A 140 9.748 -11.086 -3.446 1.00 0.00 N ATOM 242 CA PHE A 140 10.130 -11.022 -4.850 1.00 0.00 C ATOM 243 C PHE A 140 11.115 -12.125 -5.174 1.00 0.00 C ATOM 244 O PHE A 140 11.627 -12.215 -6.290 1.00 0.00 O ATOM 245 CB PHE A 140 10.725 -9.649 -5.172 1.00 0.00 C ATOM 246 CG PHE A 140 9.770 -8.548 -4.833 1.00 0.00 C ATOM 247 CD1 PHE A 140 8.662 -8.322 -5.626 1.00 0.00 C ATOM 248 CD2 PHE A 140 9.946 -7.783 -3.696 1.00 0.00 C ATOM 249 CE1 PHE A 140 7.750 -7.347 -5.297 1.00 0.00 C ATOM 250 CE2 PHE A 140 9.029 -6.812 -3.357 1.00 0.00 C ATOM 251 CZ PHE A 140 7.930 -6.592 -4.159 1.00 0.00 C ATOM 0 H PHE A 140 10.526 -11.227 -2.801 1.00 0.00 H new ATOM 0 HA PHE A 140 9.242 -11.164 -5.466 1.00 0.00 H new ATOM 0 HB2 PHE A 140 11.652 -9.513 -4.615 1.00 0.00 H new ATOM 0 HB3 PHE A 140 10.979 -9.600 -6.231 1.00 0.00 H new ATOM 0 HD1 PHE A 140 8.510 -8.918 -6.514 1.00 0.00 H new ATOM 0 HD2 PHE A 140 10.809 -7.947 -3.068 1.00 0.00 H new ATOM 0 HE1 PHE A 140 6.893 -7.173 -5.931 1.00 0.00 H new ATOM 0 HE2 PHE A 140 9.171 -6.223 -2.463 1.00 0.00 H new ATOM 0 HZ PHE A 140 7.212 -5.830 -3.896 1.00 0.00 H new ATOM 261 N GLY A 141 11.381 -12.961 -4.176 1.00 0.00 N ATOM 262 CA GLY A 141 12.344 -14.025 -4.335 1.00 0.00 C ATOM 263 C GLY A 141 13.742 -13.480 -4.471 1.00 0.00 C ATOM 264 O GLY A 141 14.686 -14.214 -4.752 1.00 0.00 O ATOM 0 H GLY A 141 10.942 -12.917 -3.256 1.00 0.00 H new ATOM 0 HA2 GLY A 141 12.294 -14.695 -3.477 1.00 0.00 H new ATOM 0 HA3 GLY A 141 12.094 -14.616 -5.216 1.00 0.00 H new ATOM 268 N ASN A 142 13.868 -12.178 -4.271 1.00 0.00 N ATOM 269 CA ASN A 142 15.136 -11.508 -4.434 1.00 0.00 C ATOM 270 C ASN A 142 15.823 -11.375 -3.087 1.00 0.00 C ATOM 271 O ASN A 142 15.336 -11.872 -2.074 1.00 0.00 O ATOM 272 CB ASN A 142 14.908 -10.130 -5.068 1.00 0.00 C ATOM 273 CG ASN A 142 16.175 -9.489 -5.610 1.00 0.00 C ATOM 274 OD1 ASN A 142 16.846 -8.719 -4.914 1.00 0.00 O ATOM 275 ND2 ASN A 142 16.511 -9.800 -6.851 1.00 0.00 N ATOM 0 H ASN A 142 13.100 -11.567 -3.994 1.00 0.00 H new ATOM 0 HA ASN A 142 15.780 -12.092 -5.092 1.00 0.00 H new ATOM 0 HB2 ASN A 142 14.186 -10.228 -5.878 1.00 0.00 H new ATOM 0 HB3 ASN A 142 14.465 -9.467 -4.325 1.00 0.00 H new ATOM 0 HD21 ASN A 142 17.352 -9.400 -7.267 1.00 0.00 H new ATOM 0 HD22 ASN A 142 15.929 -10.440 -7.392 1.00 0.00 H new ATOM 282 N ASP A 143 16.965 -10.738 -3.090 1.00 0.00 N ATOM 283 CA ASP A 143 17.710 -10.484 -1.875 1.00 0.00 C ATOM 284 C ASP A 143 17.475 -9.071 -1.391 1.00 0.00 C ATOM 285 O ASP A 143 16.866 -8.850 -0.355 1.00 0.00 O ATOM 286 CB ASP A 143 19.195 -10.704 -2.113 1.00 0.00 C ATOM 287 CG ASP A 143 19.548 -12.170 -2.206 1.00 0.00 C ATOM 288 OD1 ASP A 143 19.659 -12.827 -1.154 1.00 0.00 O ATOM 289 OD2 ASP A 143 19.716 -12.676 -3.332 1.00 0.00 O ATOM 0 H ASP A 143 17.409 -10.378 -3.935 1.00 0.00 H new ATOM 0 HA ASP A 143 17.363 -11.179 -1.111 1.00 0.00 H new ATOM 0 HB2 ASP A 143 19.492 -10.202 -3.034 1.00 0.00 H new ATOM 0 HB3 ASP A 143 19.763 -10.246 -1.303 1.00 0.00 H new ATOM 294 N TYR A 144 17.935 -8.119 -2.189 1.00 0.00 N ATOM 295 CA TYR A 144 17.956 -6.724 -1.803 1.00 0.00 C ATOM 296 C TYR A 144 16.700 -5.972 -2.225 1.00 0.00 C ATOM 297 O TYR A 144 16.361 -4.984 -1.599 1.00 0.00 O ATOM 298 CB TYR A 144 19.208 -6.048 -2.357 1.00 0.00 C ATOM 299 CG TYR A 144 19.735 -6.691 -3.619 1.00 0.00 C ATOM 300 CD1 TYR A 144 20.635 -7.746 -3.546 1.00 0.00 C ATOM 301 CD2 TYR A 144 19.329 -6.258 -4.872 1.00 0.00 C ATOM 302 CE1 TYR A 144 21.116 -8.354 -4.685 1.00 0.00 C ATOM 303 CE2 TYR A 144 19.806 -6.861 -6.020 1.00 0.00 C ATOM 304 CZ TYR A 144 20.698 -7.909 -5.920 1.00 0.00 C ATOM 305 OH TYR A 144 21.175 -8.514 -7.059 1.00 0.00 O ATOM 0 H TYR A 144 18.304 -8.297 -3.123 1.00 0.00 H new ATOM 0 HA TYR A 144 17.979 -6.691 -0.714 1.00 0.00 H new ATOM 0 HB2 TYR A 144 18.986 -5.000 -2.559 1.00 0.00 H new ATOM 0 HB3 TYR A 144 19.988 -6.068 -1.596 1.00 0.00 H new ATOM 0 HD1 TYR A 144 20.964 -8.096 -2.579 1.00 0.00 H new ATOM 0 HD2 TYR A 144 18.630 -5.438 -4.952 1.00 0.00 H new ATOM 0 HE1 TYR A 144 21.816 -9.173 -4.610 1.00 0.00 H new ATOM 0 HE2 TYR A 144 19.482 -6.514 -6.990 1.00 0.00 H new ATOM 0 HH TYR A 144 20.782 -8.084 -7.847 1.00 0.00 H new ATOM 315 N GLU A 145 16.001 -6.417 -3.266 1.00 0.00 N ATOM 316 CA GLU A 145 14.723 -5.790 -3.613 1.00 0.00 C ATOM 317 C GLU A 145 13.637 -6.400 -2.749 1.00 0.00 C ATOM 318 O GLU A 145 12.660 -5.743 -2.379 1.00 0.00 O ATOM 319 CB GLU A 145 14.404 -5.961 -5.090 1.00 0.00 C ATOM 320 CG GLU A 145 13.582 -7.183 -5.419 1.00 0.00 C ATOM 321 CD GLU A 145 12.967 -7.108 -6.803 1.00 0.00 C ATOM 322 OE1 GLU A 145 13.623 -7.530 -7.776 1.00 0.00 O ATOM 323 OE2 GLU A 145 11.823 -6.611 -6.927 1.00 0.00 O ATOM 0 H GLU A 145 16.285 -7.188 -3.871 1.00 0.00 H new ATOM 0 HA GLU A 145 14.784 -4.718 -3.426 1.00 0.00 H new ATOM 0 HB2 GLU A 145 13.870 -5.076 -5.438 1.00 0.00 H new ATOM 0 HB3 GLU A 145 15.340 -6.008 -5.647 1.00 0.00 H new ATOM 0 HG2 GLU A 145 14.211 -8.070 -5.351 1.00 0.00 H new ATOM 0 HG3 GLU A 145 12.791 -7.296 -4.678 1.00 0.00 H new ATOM 330 N ASP A 146 13.839 -7.670 -2.422 1.00 0.00 N ATOM 331 CA ASP A 146 13.010 -8.354 -1.455 1.00 0.00 C ATOM 332 C ASP A 146 13.258 -7.715 -0.106 1.00 0.00 C ATOM 333 O ASP A 146 12.354 -7.537 0.710 1.00 0.00 O ATOM 334 CB ASP A 146 13.372 -9.835 -1.410 1.00 0.00 C ATOM 335 CG ASP A 146 12.353 -10.690 -0.683 1.00 0.00 C ATOM 336 OD1 ASP A 146 12.484 -10.864 0.547 1.00 0.00 O ATOM 337 OD2 ASP A 146 11.441 -11.225 -1.351 1.00 0.00 O ATOM 0 H ASP A 146 14.580 -8.247 -2.821 1.00 0.00 H new ATOM 0 HA ASP A 146 11.958 -8.272 -1.727 1.00 0.00 H new ATOM 0 HB2 ASP A 146 13.482 -10.204 -2.430 1.00 0.00 H new ATOM 0 HB3 ASP A 146 14.341 -9.948 -0.924 1.00 0.00 H new ATOM 342 N ARG A 147 14.518 -7.341 0.095 1.00 0.00 N ATOM 343 CA ARG A 147 14.932 -6.638 1.286 1.00 0.00 C ATOM 344 C ARG A 147 14.320 -5.301 1.339 1.00 0.00 C ATOM 345 O ARG A 147 13.690 -4.941 2.318 1.00 0.00 O ATOM 346 CB ARG A 147 16.423 -6.421 1.326 1.00 0.00 C ATOM 347 CG ARG A 147 16.896 -6.418 2.724 1.00 0.00 C ATOM 348 CD ARG A 147 16.361 -7.674 3.311 1.00 0.00 C ATOM 349 NE ARG A 147 17.323 -8.770 3.179 1.00 0.00 N ATOM 350 CZ ARG A 147 17.101 -10.039 3.527 1.00 0.00 C ATOM 351 NH1 ARG A 147 15.931 -10.410 4.028 1.00 0.00 N ATOM 352 NH2 ARG A 147 18.047 -10.950 3.340 1.00 0.00 N ATOM 0 H ARG A 147 15.273 -7.520 -0.567 1.00 0.00 H new ATOM 0 HA ARG A 147 14.617 -7.260 2.124 1.00 0.00 H new ATOM 0 HB2 ARG A 147 16.928 -7.207 0.764 1.00 0.00 H new ATOM 0 HB3 ARG A 147 16.674 -5.475 0.847 1.00 0.00 H new ATOM 0 HG2 ARG A 147 17.985 -6.391 2.773 1.00 0.00 H new ATOM 0 HG3 ARG A 147 16.531 -5.543 3.263 1.00 0.00 H new ATOM 0 HD2 ARG A 147 16.127 -7.516 4.364 1.00 0.00 H new ATOM 0 HD3 ARG A 147 15.429 -7.943 2.814 1.00 0.00 H new ATOM 0 HE ARG A 147 18.238 -8.545 2.789 1.00 0.00 H new ATOM 0 HH11 ARG A 147 15.188 -9.722 4.151 1.00 0.00 H new ATOM 0 HH12 ARG A 147 15.774 -11.383 4.290 1.00 0.00 H new ATOM 0 HH21 ARG A 147 18.942 -10.680 2.931 1.00 0.00 H new ATOM 0 HH22 ARG A 147 17.880 -11.921 3.605 1.00 0.00 H new ATOM 366 N TYR A 148 14.585 -4.560 0.294 1.00 0.00 N ATOM 367 CA TYR A 148 14.027 -3.264 0.110 1.00 0.00 C ATOM 368 C TYR A 148 12.617 -3.254 0.587 1.00 0.00 C ATOM 369 O TYR A 148 12.328 -2.604 1.548 1.00 0.00 O ATOM 370 CB TYR A 148 14.071 -2.905 -1.354 1.00 0.00 C ATOM 371 CG TYR A 148 15.342 -2.232 -1.822 1.00 0.00 C ATOM 372 CD1 TYR A 148 16.296 -1.764 -0.923 1.00 0.00 C ATOM 373 CD2 TYR A 148 15.576 -2.054 -3.178 1.00 0.00 C ATOM 374 CE1 TYR A 148 17.443 -1.137 -1.368 1.00 0.00 C ATOM 375 CE2 TYR A 148 16.720 -1.430 -3.630 1.00 0.00 C ATOM 376 CZ TYR A 148 17.649 -0.974 -2.722 1.00 0.00 C ATOM 377 OH TYR A 148 18.793 -0.350 -3.171 1.00 0.00 O ATOM 0 H TYR A 148 15.206 -4.854 -0.460 1.00 0.00 H new ATOM 0 HA TYR A 148 14.603 -2.535 0.680 1.00 0.00 H new ATOM 0 HB2 TYR A 148 13.926 -3.814 -1.938 1.00 0.00 H new ATOM 0 HB3 TYR A 148 13.230 -2.247 -1.574 1.00 0.00 H new ATOM 0 HD1 TYR A 148 16.137 -1.893 0.137 1.00 0.00 H new ATOM 0 HD2 TYR A 148 14.849 -2.411 -3.893 1.00 0.00 H new ATOM 0 HE1 TYR A 148 18.174 -0.776 -0.660 1.00 0.00 H new ATOM 0 HE2 TYR A 148 16.886 -1.300 -4.689 1.00 0.00 H new ATOM 0 HH TYR A 148 18.785 -0.317 -4.150 1.00 0.00 H new ATOM 387 N TYR A 149 11.765 -4.016 -0.062 1.00 0.00 N ATOM 388 CA TYR A 149 10.392 -4.168 0.364 1.00 0.00 C ATOM 389 C TYR A 149 10.240 -4.594 1.846 1.00 0.00 C ATOM 390 O TYR A 149 9.346 -4.100 2.530 1.00 0.00 O ATOM 391 CB TYR A 149 9.696 -5.128 -0.592 1.00 0.00 C ATOM 392 CG TYR A 149 8.913 -6.223 0.063 1.00 0.00 C ATOM 393 CD1 TYR A 149 7.737 -5.953 0.735 1.00 0.00 C ATOM 394 CD2 TYR A 149 9.354 -7.534 -0.007 1.00 0.00 C ATOM 395 CE1 TYR A 149 7.018 -6.965 1.324 1.00 0.00 C ATOM 396 CE2 TYR A 149 8.640 -8.551 0.574 1.00 0.00 C ATOM 397 CZ TYR A 149 7.474 -8.264 1.235 1.00 0.00 C ATOM 398 OH TYR A 149 6.756 -9.280 1.808 1.00 0.00 O ATOM 0 H TYR A 149 12.004 -4.547 -0.899 1.00 0.00 H new ATOM 0 HA TYR A 149 9.910 -3.191 0.322 1.00 0.00 H new ATOM 0 HB2 TYR A 149 9.024 -4.555 -1.232 1.00 0.00 H new ATOM 0 HB3 TYR A 149 10.447 -5.578 -1.241 1.00 0.00 H new ATOM 0 HD1 TYR A 149 7.379 -4.936 0.798 1.00 0.00 H new ATOM 0 HD2 TYR A 149 10.274 -7.759 -0.527 1.00 0.00 H new ATOM 0 HE1 TYR A 149 6.102 -6.745 1.853 1.00 0.00 H new ATOM 0 HE2 TYR A 149 8.994 -9.570 0.511 1.00 0.00 H new ATOM 0 HH TYR A 149 7.370 -9.919 2.227 1.00 0.00 H new ATOM 408 N ARG A 150 11.102 -5.475 2.349 1.00 0.00 N ATOM 409 CA ARG A 150 10.995 -5.950 3.742 1.00 0.00 C ATOM 410 C ARG A 150 11.227 -4.809 4.746 1.00 0.00 C ATOM 411 O ARG A 150 10.679 -4.788 5.845 1.00 0.00 O ATOM 412 CB ARG A 150 11.983 -7.084 4.026 1.00 0.00 C ATOM 413 CG ARG A 150 13.245 -6.628 4.738 1.00 0.00 C ATOM 414 CD ARG A 150 13.787 -7.722 5.641 1.00 0.00 C ATOM 415 NE ARG A 150 12.758 -8.213 6.565 1.00 0.00 N ATOM 416 CZ ARG A 150 13.014 -8.892 7.687 1.00 0.00 C ATOM 417 NH1 ARG A 150 14.268 -9.133 8.047 1.00 0.00 N ATOM 418 NH2 ARG A 150 12.014 -9.330 8.445 1.00 0.00 N ATOM 0 H ARG A 150 11.879 -5.876 1.824 1.00 0.00 H new ATOM 0 HA ARG A 150 9.980 -6.328 3.865 1.00 0.00 H new ATOM 0 HB2 ARG A 150 11.488 -7.842 4.632 1.00 0.00 H new ATOM 0 HB3 ARG A 150 12.259 -7.559 3.084 1.00 0.00 H new ATOM 0 HG2 ARG A 150 14.001 -6.350 4.003 1.00 0.00 H new ATOM 0 HG3 ARG A 150 13.032 -5.737 5.328 1.00 0.00 H new ATOM 0 HD2 ARG A 150 14.156 -8.548 5.033 1.00 0.00 H new ATOM 0 HD3 ARG A 150 14.635 -7.340 6.209 1.00 0.00 H new ATOM 0 HE ARG A 150 11.782 -8.023 6.335 1.00 0.00 H new ATOM 0 HH11 ARG A 150 15.038 -8.800 7.467 1.00 0.00 H new ATOM 0 HH12 ARG A 150 14.462 -9.651 8.904 1.00 0.00 H new ATOM 0 HH21 ARG A 150 11.049 -9.148 8.171 1.00 0.00 H new ATOM 0 HH22 ARG A 150 12.212 -9.848 9.301 1.00 0.00 H new ATOM 432 N GLU A 151 12.052 -3.876 4.338 1.00 0.00 N ATOM 433 CA GLU A 151 12.446 -2.737 5.143 1.00 0.00 C ATOM 434 C GLU A 151 11.614 -1.581 4.691 1.00 0.00 C ATOM 435 O GLU A 151 11.394 -0.614 5.412 1.00 0.00 O ATOM 436 CB GLU A 151 13.956 -2.466 5.011 1.00 0.00 C ATOM 437 CG GLU A 151 14.482 -2.476 3.587 1.00 0.00 C ATOM 438 CD GLU A 151 15.616 -1.490 3.377 1.00 0.00 C ATOM 439 OE1 GLU A 151 15.367 -0.266 3.410 1.00 0.00 O ATOM 440 OE2 GLU A 151 16.767 -1.940 3.187 1.00 0.00 O ATOM 0 H GLU A 151 12.481 -3.885 3.413 1.00 0.00 H new ATOM 0 HA GLU A 151 12.275 -2.921 6.204 1.00 0.00 H new ATOM 0 HB2 GLU A 151 14.178 -1.497 5.459 1.00 0.00 H new ATOM 0 HB3 GLU A 151 14.497 -3.215 5.589 1.00 0.00 H new ATOM 0 HG2 GLU A 151 14.827 -3.479 3.338 1.00 0.00 H new ATOM 0 HG3 GLU A 151 13.668 -2.240 2.901 1.00 0.00 H new ATOM 447 N ASN A 152 11.088 -1.766 3.492 1.00 0.00 N ATOM 448 CA ASN A 152 10.238 -0.814 2.840 1.00 0.00 C ATOM 449 C ASN A 152 8.948 -0.744 3.554 1.00 0.00 C ATOM 450 O ASN A 152 8.244 0.185 3.420 1.00 0.00 O ATOM 451 CB ASN A 152 10.083 -1.141 1.344 1.00 0.00 C ATOM 452 CG ASN A 152 8.671 -1.125 0.815 1.00 0.00 C ATOM 453 OD1 ASN A 152 8.205 -0.118 0.312 1.00 0.00 O ATOM 454 ND2 ASN A 152 8.007 -2.261 0.894 1.00 0.00 N ATOM 0 H ASN A 152 11.251 -2.608 2.940 1.00 0.00 H new ATOM 0 HA ASN A 152 10.693 0.176 2.880 1.00 0.00 H new ATOM 0 HB2 ASN A 152 10.674 -0.426 0.771 1.00 0.00 H new ATOM 0 HB3 ASN A 152 10.509 -2.127 1.160 1.00 0.00 H new ATOM 0 HD21 ASN A 152 7.059 -2.324 0.524 1.00 0.00 H new ATOM 0 HD22 ASN A 152 8.442 -3.077 1.325 1.00 0.00 H new ATOM 461 N MET A 153 8.695 -1.709 4.374 1.00 0.00 N ATOM 462 CA MET A 153 7.484 -1.746 5.129 1.00 0.00 C ATOM 463 C MET A 153 7.603 -0.986 6.450 1.00 0.00 C ATOM 464 O MET A 153 6.642 -0.869 7.214 1.00 0.00 O ATOM 465 CB MET A 153 7.174 -3.186 5.291 1.00 0.00 C ATOM 466 CG MET A 153 7.236 -3.752 6.694 1.00 0.00 C ATOM 467 SD MET A 153 7.129 -5.538 6.621 1.00 0.00 S ATOM 468 CE MET A 153 7.946 -5.765 5.042 1.00 0.00 C ATOM 0 H MET A 153 9.322 -2.496 4.541 1.00 0.00 H new ATOM 0 HA MET A 153 6.666 -1.234 4.622 1.00 0.00 H new ATOM 0 HB2 MET A 153 6.172 -3.362 4.899 1.00 0.00 H new ATOM 0 HB3 MET A 153 7.865 -3.753 4.667 1.00 0.00 H new ATOM 0 HG2 MET A 153 8.165 -3.452 7.178 1.00 0.00 H new ATOM 0 HG3 MET A 153 6.420 -3.352 7.296 1.00 0.00 H new ATOM 0 HE1 MET A 153 8.303 -6.792 4.962 1.00 0.00 H new ATOM 0 HE2 MET A 153 7.242 -5.562 4.235 1.00 0.00 H new ATOM 0 HE3 MET A 153 8.790 -5.080 4.967 1.00 0.00 H new ATOM 478 N TYR A 154 8.796 -0.476 6.707 1.00 0.00 N ATOM 479 CA TYR A 154 9.027 0.412 7.832 1.00 0.00 C ATOM 480 C TYR A 154 9.128 1.855 7.354 1.00 0.00 C ATOM 481 O TYR A 154 8.964 2.802 8.121 1.00 0.00 O ATOM 482 CB TYR A 154 10.319 0.030 8.539 1.00 0.00 C ATOM 483 CG TYR A 154 10.238 -1.285 9.272 1.00 0.00 C ATOM 484 CD1 TYR A 154 9.715 -1.352 10.554 1.00 0.00 C ATOM 485 CD2 TYR A 154 10.675 -2.462 8.675 1.00 0.00 C ATOM 486 CE1 TYR A 154 9.630 -2.554 11.223 1.00 0.00 C ATOM 487 CE2 TYR A 154 10.590 -3.669 9.338 1.00 0.00 C ATOM 488 CZ TYR A 154 10.067 -3.709 10.613 1.00 0.00 C ATOM 489 OH TYR A 154 9.966 -4.909 11.278 1.00 0.00 O ATOM 0 H TYR A 154 9.626 -0.665 6.145 1.00 0.00 H new ATOM 0 HA TYR A 154 8.189 0.318 8.523 1.00 0.00 H new ATOM 0 HB2 TYR A 154 11.124 -0.021 7.806 1.00 0.00 H new ATOM 0 HB3 TYR A 154 10.582 0.816 9.247 1.00 0.00 H new ATOM 0 HD1 TYR A 154 9.369 -0.449 11.036 1.00 0.00 H new ATOM 0 HD2 TYR A 154 11.087 -2.431 7.677 1.00 0.00 H new ATOM 0 HE1 TYR A 154 9.222 -2.590 12.222 1.00 0.00 H new ATOM 0 HE2 TYR A 154 10.931 -4.576 8.861 1.00 0.00 H new ATOM 0 HH TYR A 154 10.317 -5.628 10.711 1.00 0.00 H new ATOM 499 N ARG A 155 9.375 1.996 6.066 1.00 0.00 N ATOM 500 CA ARG A 155 9.690 3.296 5.458 1.00 0.00 C ATOM 501 C ARG A 155 8.600 3.661 4.469 1.00 0.00 C ATOM 502 O ARG A 155 8.280 4.815 4.229 1.00 0.00 O ATOM 503 CB ARG A 155 11.018 3.152 4.768 1.00 0.00 C ATOM 504 CG ARG A 155 11.069 1.864 4.005 1.00 0.00 C ATOM 505 CD ARG A 155 12.461 1.613 3.435 1.00 0.00 C ATOM 506 NE ARG A 155 12.446 0.845 2.200 1.00 0.00 N ATOM 507 CZ ARG A 155 13.291 1.032 1.193 1.00 0.00 C ATOM 508 NH1 ARG A 155 14.225 1.971 1.269 1.00 0.00 N ATOM 509 NH2 ARG A 155 13.206 0.270 0.119 1.00 0.00 N ATOM 0 H ARG A 155 9.366 1.220 5.404 1.00 0.00 H new ATOM 0 HA ARG A 155 9.743 4.088 6.205 1.00 0.00 H new ATOM 0 HB2 ARG A 155 11.176 3.991 4.090 1.00 0.00 H new ATOM 0 HB3 ARG A 155 11.823 3.180 5.503 1.00 0.00 H new ATOM 0 HG2 ARG A 155 10.788 1.039 4.660 1.00 0.00 H new ATOM 0 HG3 ARG A 155 10.341 1.890 3.194 1.00 0.00 H new ATOM 0 HD2 ARG A 155 12.950 2.570 3.254 1.00 0.00 H new ATOM 0 HD3 ARG A 155 13.060 1.084 4.176 1.00 0.00 H new ATOM 0 HE ARG A 155 11.740 0.115 2.101 1.00 0.00 H new ATOM 0 HH11 ARG A 155 14.296 2.553 2.104 1.00 0.00 H new ATOM 0 HH12 ARG A 155 14.872 2.111 0.493 1.00 0.00 H new ATOM 0 HH21 ARG A 155 12.494 -0.458 0.065 1.00 0.00 H new ATOM 0 HH22 ARG A 155 13.852 0.409 -0.658 1.00 0.00 H new ATOM 523 N TYR A 156 8.072 2.631 3.881 1.00 0.00 N ATOM 524 CA TYR A 156 6.759 2.651 3.306 1.00 0.00 C ATOM 525 C TYR A 156 5.968 1.950 4.365 1.00 0.00 C ATOM 526 O TYR A 156 6.509 1.088 5.032 1.00 0.00 O ATOM 527 CB TYR A 156 6.714 1.877 1.977 1.00 0.00 C ATOM 528 CG TYR A 156 5.582 0.884 1.887 1.00 0.00 C ATOM 529 CD1 TYR A 156 4.301 1.292 1.603 1.00 0.00 C ATOM 530 CD2 TYR A 156 5.807 -0.462 2.109 1.00 0.00 C ATOM 531 CE1 TYR A 156 3.278 0.390 1.540 1.00 0.00 C ATOM 532 CE2 TYR A 156 4.790 -1.374 2.048 1.00 0.00 C ATOM 533 CZ TYR A 156 3.517 -0.939 1.762 1.00 0.00 C ATOM 534 OH TYR A 156 2.475 -1.824 1.703 1.00 0.00 O ATOM 0 H TYR A 156 8.550 1.735 3.785 1.00 0.00 H new ATOM 0 HA TYR A 156 6.397 3.649 3.058 1.00 0.00 H new ATOM 0 HB2 TYR A 156 6.626 2.589 1.156 1.00 0.00 H new ATOM 0 HB3 TYR A 156 7.659 1.350 1.842 1.00 0.00 H new ATOM 0 HD1 TYR A 156 4.101 2.339 1.428 1.00 0.00 H new ATOM 0 HD2 TYR A 156 6.807 -0.800 2.335 1.00 0.00 H new ATOM 0 HE1 TYR A 156 2.277 0.726 1.314 1.00 0.00 H new ATOM 0 HE2 TYR A 156 4.984 -2.422 2.222 1.00 0.00 H new ATOM 0 HH TYR A 156 1.675 -1.365 1.372 1.00 0.00 H new ATOM 544 N PRO A 157 4.752 2.296 4.644 1.00 0.00 N ATOM 545 CA PRO A 157 4.105 1.640 5.751 1.00 0.00 C ATOM 546 C PRO A 157 3.481 0.303 5.381 1.00 0.00 C ATOM 547 O PRO A 157 4.018 -0.462 4.600 1.00 0.00 O ATOM 548 CB PRO A 157 3.011 2.647 6.093 1.00 0.00 C ATOM 549 CG PRO A 157 2.618 3.148 4.743 1.00 0.00 C ATOM 550 CD PRO A 157 3.927 3.347 4.029 1.00 0.00 C ATOM 0 HA PRO A 157 4.798 1.398 6.557 1.00 0.00 H new ATOM 0 HB2 PRO A 157 2.175 2.180 6.614 1.00 0.00 H new ATOM 0 HB3 PRO A 157 3.379 3.448 6.734 1.00 0.00 H new ATOM 0 HG2 PRO A 157 1.984 2.431 4.221 1.00 0.00 H new ATOM 0 HG3 PRO A 157 2.056 4.079 4.812 1.00 0.00 H new ATOM 0 HD2 PRO A 157 3.831 3.217 2.951 1.00 0.00 H new ATOM 0 HD3 PRO A 157 4.339 4.343 4.195 1.00 0.00 H new ATOM 558 N ASN A 158 2.366 0.013 6.015 1.00 0.00 N ATOM 559 CA ASN A 158 1.510 -1.080 5.610 1.00 0.00 C ATOM 560 C ASN A 158 0.073 -0.661 5.794 1.00 0.00 C ATOM 561 O ASN A 158 -0.642 -1.164 6.652 1.00 0.00 O ATOM 562 CB ASN A 158 1.816 -2.371 6.370 1.00 0.00 C ATOM 563 CG ASN A 158 2.568 -2.147 7.672 1.00 0.00 C ATOM 564 OD1 ASN A 158 1.971 -1.948 8.726 1.00 0.00 O ATOM 565 ND2 ASN A 158 3.890 -2.183 7.602 1.00 0.00 N ATOM 0 H ASN A 158 2.027 0.529 6.827 1.00 0.00 H new ATOM 0 HA ASN A 158 1.698 -1.301 4.559 1.00 0.00 H new ATOM 0 HB2 ASN A 158 0.880 -2.887 6.585 1.00 0.00 H new ATOM 0 HB3 ASN A 158 2.403 -3.029 5.730 1.00 0.00 H new ATOM 0 HD21 ASN A 158 4.449 -2.043 8.443 1.00 0.00 H new ATOM 0 HD22 ASN A 158 4.349 -2.351 6.707 1.00 0.00 H new ATOM 572 N GLN A 159 -0.308 0.331 5.018 1.00 0.00 N ATOM 573 CA GLN A 159 -1.640 0.886 5.061 1.00 0.00 C ATOM 574 C GLN A 159 -1.833 1.782 3.858 1.00 0.00 C ATOM 575 O GLN A 159 -0.855 2.276 3.299 1.00 0.00 O ATOM 576 CB GLN A 159 -1.834 1.678 6.350 1.00 0.00 C ATOM 577 CG GLN A 159 -0.808 2.787 6.537 1.00 0.00 C ATOM 578 CD GLN A 159 -0.620 3.181 7.989 1.00 0.00 C ATOM 579 OE1 GLN A 159 -0.749 2.218 8.885 1.00 0.00 O flip ATOM 580 NE2 GLN A 159 -0.335 4.335 8.295 1.00 0.00 N flip ATOM 0 H GLN A 159 0.304 0.777 4.335 1.00 0.00 H new ATOM 0 HA GLN A 159 -2.377 0.083 5.039 1.00 0.00 H new ATOM 0 HB2 GLN A 159 -2.833 2.113 6.354 1.00 0.00 H new ATOM 0 HB3 GLN A 159 -1.780 0.996 7.199 1.00 0.00 H new ATOM 0 HG2 GLN A 159 0.149 2.462 6.128 1.00 0.00 H new ATOM 0 HG3 GLN A 159 -1.119 3.662 5.966 1.00 0.00 H new ATOM 0 HE21 GLN A 159 -0.245 5.047 7.571 1.00 0.00 H new ATOM 0 HE22 GLN A 159 -0.188 4.582 9.274 1.00 0.00 H new ATOM 589 N VAL A 160 -3.067 2.023 3.474 1.00 0.00 N ATOM 590 CA VAL A 160 -3.339 2.873 2.349 1.00 0.00 C ATOM 591 C VAL A 160 -4.397 3.868 2.733 1.00 0.00 C ATOM 592 O VAL A 160 -5.103 3.684 3.715 1.00 0.00 O ATOM 593 CB VAL A 160 -3.764 2.110 1.076 1.00 0.00 C ATOM 594 CG1 VAL A 160 -2.582 1.962 0.128 1.00 0.00 C ATOM 595 CG2 VAL A 160 -4.357 0.739 1.410 1.00 0.00 C ATOM 0 H VAL A 160 -3.895 1.639 3.929 1.00 0.00 H new ATOM 0 HA VAL A 160 -2.405 3.374 2.095 1.00 0.00 H new ATOM 0 HB VAL A 160 -4.542 2.694 0.584 1.00 0.00 H new ATOM 0 HG11 VAL A 160 -2.897 1.422 -0.765 1.00 0.00 H new ATOM 0 HG12 VAL A 160 -2.217 2.949 -0.155 1.00 0.00 H new ATOM 0 HG13 VAL A 160 -1.785 1.409 0.624 1.00 0.00 H new ATOM 0 HG21 VAL A 160 -4.644 0.232 0.489 1.00 0.00 H new ATOM 0 HG22 VAL A 160 -3.614 0.140 1.937 1.00 0.00 H new ATOM 0 HG23 VAL A 160 -5.235 0.867 2.043 1.00 0.00 H new ATOM 605 N TYR A 161 -4.486 4.934 1.988 1.00 0.00 N ATOM 606 CA TYR A 161 -5.404 5.992 2.319 1.00 0.00 C ATOM 607 C TYR A 161 -6.605 5.962 1.408 1.00 0.00 C ATOM 608 O TYR A 161 -6.523 6.363 0.251 1.00 0.00 O ATOM 609 CB TYR A 161 -4.708 7.327 2.185 1.00 0.00 C ATOM 610 CG TYR A 161 -3.732 7.649 3.293 1.00 0.00 C ATOM 611 CD1 TYR A 161 -2.468 7.077 3.301 1.00 0.00 C ATOM 612 CD2 TYR A 161 -4.056 8.532 4.312 1.00 0.00 C ATOM 613 CE1 TYR A 161 -1.555 7.370 4.290 1.00 0.00 C ATOM 614 CE2 TYR A 161 -3.142 8.839 5.306 1.00 0.00 C ATOM 615 CZ TYR A 161 -1.894 8.253 5.288 1.00 0.00 C ATOM 616 OH TYR A 161 -0.975 8.560 6.264 1.00 0.00 O ATOM 0 H TYR A 161 -3.934 5.095 1.146 1.00 0.00 H new ATOM 0 HA TYR A 161 -5.740 5.849 3.346 1.00 0.00 H new ATOM 0 HB2 TYR A 161 -4.176 7.349 1.234 1.00 0.00 H new ATOM 0 HB3 TYR A 161 -5.463 8.112 2.146 1.00 0.00 H new ATOM 0 HD1 TYR A 161 -2.194 6.388 2.516 1.00 0.00 H new ATOM 0 HD2 TYR A 161 -5.035 8.987 4.331 1.00 0.00 H new ATOM 0 HE1 TYR A 161 -0.578 6.909 4.282 1.00 0.00 H new ATOM 0 HE2 TYR A 161 -3.405 9.533 6.090 1.00 0.00 H new ATOM 0 HH TYR A 161 -1.368 9.199 6.894 1.00 0.00 H new ATOM 626 N TYR A 162 -7.716 5.491 1.931 1.00 0.00 N ATOM 627 CA TYR A 162 -8.939 5.434 1.168 1.00 0.00 C ATOM 628 C TYR A 162 -10.132 5.221 2.075 1.00 0.00 C ATOM 629 O TYR A 162 -10.001 4.683 3.149 1.00 0.00 O ATOM 630 CB TYR A 162 -8.905 4.312 0.136 1.00 0.00 C ATOM 631 CG TYR A 162 -8.906 2.917 0.732 1.00 0.00 C ATOM 632 CD1 TYR A 162 -10.099 2.292 1.061 1.00 0.00 C ATOM 633 CD2 TYR A 162 -7.726 2.235 0.977 1.00 0.00 C ATOM 634 CE1 TYR A 162 -10.124 1.037 1.618 1.00 0.00 C ATOM 635 CE2 TYR A 162 -7.741 0.973 1.539 1.00 0.00 C ATOM 636 CZ TYR A 162 -8.944 0.382 1.856 1.00 0.00 C ATOM 637 OH TYR A 162 -8.968 -0.855 2.438 1.00 0.00 O ATOM 0 H TYR A 162 -7.795 5.141 2.886 1.00 0.00 H new ATOM 0 HA TYR A 162 -9.033 6.390 0.653 1.00 0.00 H new ATOM 0 HB2 TYR A 162 -9.767 4.414 -0.523 1.00 0.00 H new ATOM 0 HB3 TYR A 162 -8.015 4.430 -0.483 1.00 0.00 H new ATOM 0 HD1 TYR A 162 -11.031 2.805 0.875 1.00 0.00 H new ATOM 0 HD2 TYR A 162 -6.782 2.695 0.726 1.00 0.00 H new ATOM 0 HE1 TYR A 162 -11.066 0.570 1.866 1.00 0.00 H new ATOM 0 HE2 TYR A 162 -6.814 0.452 1.729 1.00 0.00 H new ATOM 0 HH TYR A 162 -9.893 -1.177 2.485 1.00 0.00 H new ATOM 647 N ARG A 163 -11.292 5.541 1.558 1.00 0.00 N ATOM 648 CA ARG A 163 -12.566 5.386 2.252 1.00 0.00 C ATOM 649 C ARG A 163 -13.177 4.047 1.849 1.00 0.00 C ATOM 650 O ARG A 163 -12.670 3.403 0.939 1.00 0.00 O ATOM 651 CB ARG A 163 -13.512 6.516 1.854 1.00 0.00 C ATOM 652 CG ARG A 163 -13.850 6.504 0.374 1.00 0.00 C ATOM 653 CD ARG A 163 -14.924 7.522 0.039 1.00 0.00 C ATOM 654 NE ARG A 163 -15.016 7.755 -1.399 1.00 0.00 N ATOM 655 CZ ARG A 163 -14.875 8.950 -1.973 1.00 0.00 C ATOM 656 NH1 ARG A 163 -14.772 10.042 -1.225 1.00 0.00 N ATOM 657 NH2 ARG A 163 -14.881 9.061 -3.297 1.00 0.00 N ATOM 0 H ARG A 163 -11.389 5.927 0.619 1.00 0.00 H new ATOM 0 HA ARG A 163 -12.408 5.419 3.330 1.00 0.00 H new ATOM 0 HB2 ARG A 163 -14.432 6.435 2.433 1.00 0.00 H new ATOM 0 HB3 ARG A 163 -13.057 7.473 2.111 1.00 0.00 H new ATOM 0 HG2 ARG A 163 -12.952 6.717 -0.207 1.00 0.00 H new ATOM 0 HG3 ARG A 163 -14.188 5.509 0.085 1.00 0.00 H new ATOM 0 HD2 ARG A 163 -15.886 7.173 0.414 1.00 0.00 H new ATOM 0 HD3 ARG A 163 -14.706 8.462 0.547 1.00 0.00 H new ATOM 0 HE ARG A 163 -15.200 6.953 -2.002 1.00 0.00 H new ATOM 0 HH11 ARG A 163 -14.801 9.968 -0.208 1.00 0.00 H new ATOM 0 HH12 ARG A 163 -14.664 10.955 -1.667 1.00 0.00 H new ATOM 0 HH21 ARG A 163 -14.994 8.230 -3.878 1.00 0.00 H new ATOM 0 HH22 ARG A 163 -14.773 9.977 -3.732 1.00 0.00 H new ATOM 671 N PRO A 164 -14.287 3.600 2.455 1.00 0.00 N ATOM 672 CA PRO A 164 -14.702 2.211 2.319 1.00 0.00 C ATOM 673 C PRO A 164 -15.494 1.988 1.050 1.00 0.00 C ATOM 674 O PRO A 164 -16.538 2.595 0.795 1.00 0.00 O ATOM 675 CB PRO A 164 -15.619 1.987 3.529 1.00 0.00 C ATOM 676 CG PRO A 164 -15.494 3.221 4.362 1.00 0.00 C ATOM 677 CD PRO A 164 -15.139 4.316 3.402 1.00 0.00 C ATOM 0 HA PRO A 164 -13.847 1.536 2.275 1.00 0.00 H new ATOM 0 HB2 PRO A 164 -16.651 1.829 3.215 1.00 0.00 H new ATOM 0 HB3 PRO A 164 -15.318 1.103 4.091 1.00 0.00 H new ATOM 0 HG2 PRO A 164 -16.427 3.441 4.881 1.00 0.00 H new ATOM 0 HG3 PRO A 164 -14.725 3.103 5.125 1.00 0.00 H new ATOM 0 HD2 PRO A 164 -16.019 4.743 2.922 1.00 0.00 H new ATOM 0 HD3 PRO A 164 -14.613 5.136 3.890 1.00 0.00 H new ATOM 685 N VAL A 165 -14.928 1.095 0.266 1.00 0.00 N ATOM 686 CA VAL A 165 -15.267 0.902 -1.121 1.00 0.00 C ATOM 687 C VAL A 165 -15.937 -0.444 -1.341 1.00 0.00 C ATOM 688 O VAL A 165 -15.458 -1.482 -0.880 1.00 0.00 O ATOM 689 CB VAL A 165 -13.978 0.997 -1.959 1.00 0.00 C ATOM 690 CG1 VAL A 165 -12.845 0.265 -1.254 1.00 0.00 C ATOM 691 CG2 VAL A 165 -14.181 0.459 -3.363 1.00 0.00 C ATOM 0 H VAL A 165 -14.195 0.464 0.591 1.00 0.00 H new ATOM 0 HA VAL A 165 -15.973 1.674 -1.427 1.00 0.00 H new ATOM 0 HB VAL A 165 -13.713 2.050 -2.055 1.00 0.00 H new ATOM 0 HG11 VAL A 165 -11.937 0.337 -1.853 1.00 0.00 H new ATOM 0 HG12 VAL A 165 -12.672 0.717 -0.277 1.00 0.00 H new ATOM 0 HG13 VAL A 165 -13.113 -0.784 -1.126 1.00 0.00 H new ATOM 0 HG21 VAL A 165 -13.250 0.543 -3.923 1.00 0.00 H new ATOM 0 HG22 VAL A 165 -14.480 -0.588 -3.312 1.00 0.00 H new ATOM 0 HG23 VAL A 165 -14.959 1.035 -3.864 1.00 0.00 H new ATOM 701 N ASP A 166 -17.038 -0.403 -2.062 1.00 0.00 N ATOM 702 CA ASP A 166 -17.834 -1.586 -2.336 1.00 0.00 C ATOM 703 C ASP A 166 -18.929 -1.229 -3.327 1.00 0.00 C ATOM 704 O ASP A 166 -19.290 -2.012 -4.202 1.00 0.00 O ATOM 705 CB ASP A 166 -18.405 -2.141 -1.030 1.00 0.00 C ATOM 706 CG ASP A 166 -19.617 -3.031 -1.236 1.00 0.00 C ATOM 707 OD1 ASP A 166 -19.475 -4.117 -1.832 1.00 0.00 O ATOM 708 OD2 ASP A 166 -20.721 -2.637 -0.802 1.00 0.00 O ATOM 0 H ASP A 166 -17.409 0.452 -2.476 1.00 0.00 H new ATOM 0 HA ASP A 166 -17.214 -2.366 -2.779 1.00 0.00 H new ATOM 0 HB2 ASP A 166 -17.630 -2.708 -0.514 1.00 0.00 H new ATOM 0 HB3 ASP A 166 -18.679 -1.311 -0.379 1.00 0.00 H new ATOM 713 N GLN A 167 -19.402 -0.003 -3.205 1.00 0.00 N ATOM 714 CA GLN A 167 -20.356 0.575 -4.143 1.00 0.00 C ATOM 715 C GLN A 167 -19.654 1.047 -5.420 1.00 0.00 C ATOM 716 O GLN A 167 -20.244 1.741 -6.248 1.00 0.00 O ATOM 717 CB GLN A 167 -21.046 1.750 -3.460 1.00 0.00 C ATOM 718 CG GLN A 167 -20.052 2.698 -2.811 1.00 0.00 C ATOM 719 CD GLN A 167 -20.687 3.624 -1.798 1.00 0.00 C ATOM 720 OE1 GLN A 167 -21.084 4.744 -2.116 1.00 0.00 O ATOM 721 NE2 GLN A 167 -20.785 3.153 -0.567 1.00 0.00 N ATOM 0 H GLN A 167 -19.136 0.627 -2.448 1.00 0.00 H new ATOM 0 HA GLN A 167 -21.087 -0.181 -4.429 1.00 0.00 H new ATOM 0 HB2 GLN A 167 -21.642 2.295 -4.192 1.00 0.00 H new ATOM 0 HB3 GLN A 167 -21.736 1.375 -2.704 1.00 0.00 H new ATOM 0 HG2 GLN A 167 -19.271 2.116 -2.322 1.00 0.00 H new ATOM 0 HG3 GLN A 167 -19.569 3.294 -3.585 1.00 0.00 H new ATOM 0 HE21 GLN A 167 -20.442 2.217 -0.350 1.00 0.00 H new ATOM 0 HE22 GLN A 167 -21.204 3.725 0.166 1.00 0.00 H new ATOM 730 N TYR A 168 -18.394 0.653 -5.576 1.00 0.00 N ATOM 731 CA TYR A 168 -17.580 1.102 -6.698 1.00 0.00 C ATOM 732 C TYR A 168 -17.399 -0.021 -7.715 1.00 0.00 C ATOM 733 O TYR A 168 -17.694 -1.179 -7.420 1.00 0.00 O ATOM 734 CB TYR A 168 -16.223 1.606 -6.207 1.00 0.00 C ATOM 735 CG TYR A 168 -16.323 2.843 -5.342 1.00 0.00 C ATOM 736 CD1 TYR A 168 -16.567 2.744 -3.977 1.00 0.00 C ATOM 737 CD2 TYR A 168 -16.181 4.111 -5.890 1.00 0.00 C ATOM 738 CE1 TYR A 168 -16.662 3.868 -3.185 1.00 0.00 C ATOM 739 CE2 TYR A 168 -16.275 5.243 -5.102 1.00 0.00 C ATOM 740 CZ TYR A 168 -16.517 5.114 -3.751 1.00 0.00 C ATOM 741 OH TYR A 168 -16.614 6.233 -2.962 1.00 0.00 O ATOM 0 H TYR A 168 -17.914 0.021 -4.936 1.00 0.00 H new ATOM 0 HA TYR A 168 -18.097 1.927 -7.188 1.00 0.00 H new ATOM 0 HB2 TYR A 168 -15.732 0.814 -5.642 1.00 0.00 H new ATOM 0 HB3 TYR A 168 -15.590 1.823 -7.068 1.00 0.00 H new ATOM 0 HD1 TYR A 168 -16.684 1.768 -3.529 1.00 0.00 H new ATOM 0 HD2 TYR A 168 -15.994 4.214 -6.949 1.00 0.00 H new ATOM 0 HE1 TYR A 168 -16.849 3.771 -2.126 1.00 0.00 H new ATOM 0 HE2 TYR A 168 -16.160 6.222 -5.542 1.00 0.00 H new ATOM 0 HH TYR A 168 -16.787 5.966 -2.035 1.00 0.00 H new ATOM 751 N SER A 169 -16.910 0.318 -8.902 1.00 0.00 N ATOM 752 CA SER A 169 -16.792 -0.663 -9.977 1.00 0.00 C ATOM 753 C SER A 169 -15.342 -0.867 -10.430 1.00 0.00 C ATOM 754 O SER A 169 -14.909 -1.999 -10.642 1.00 0.00 O ATOM 755 CB SER A 169 -17.661 -0.235 -11.159 1.00 0.00 C ATOM 756 OG SER A 169 -19.009 -0.060 -10.753 1.00 0.00 O ATOM 0 H SER A 169 -16.591 1.256 -9.145 1.00 0.00 H new ATOM 0 HA SER A 169 -17.139 -1.620 -9.588 1.00 0.00 H new ATOM 0 HB2 SER A 169 -17.279 0.695 -11.580 1.00 0.00 H new ATOM 0 HB3 SER A 169 -17.608 -0.986 -11.947 1.00 0.00 H new ATOM 0 HG SER A 169 -19.549 0.216 -11.523 1.00 0.00 H new ATOM 762 N ASN A 170 -14.597 0.220 -10.585 1.00 0.00 N ATOM 763 CA ASN A 170 -13.218 0.128 -11.060 1.00 0.00 C ATOM 764 C ASN A 170 -12.258 0.070 -9.884 1.00 0.00 C ATOM 765 O ASN A 170 -12.390 0.830 -8.925 1.00 0.00 O ATOM 766 CB ASN A 170 -12.868 1.317 -11.965 1.00 0.00 C ATOM 767 CG ASN A 170 -13.851 1.504 -13.109 1.00 0.00 C ATOM 768 OD1 ASN A 170 -14.821 2.256 -12.995 1.00 0.00 O ATOM 769 ND2 ASN A 170 -13.614 0.817 -14.215 1.00 0.00 N ATOM 0 H ASN A 170 -14.918 1.168 -10.391 1.00 0.00 H new ATOM 0 HA ASN A 170 -13.122 -0.788 -11.643 1.00 0.00 H new ATOM 0 HB2 ASN A 170 -12.840 2.227 -11.365 1.00 0.00 H new ATOM 0 HB3 ASN A 170 -11.868 1.173 -12.373 1.00 0.00 H new ATOM 0 HD21 ASN A 170 -14.245 0.900 -15.012 1.00 0.00 H new ATOM 0 HD22 ASN A 170 -12.800 0.205 -14.271 1.00 0.00 H new ATOM 776 N GLN A 171 -11.279 -0.823 -9.965 1.00 0.00 N ATOM 777 CA GLN A 171 -10.407 -1.086 -8.833 1.00 0.00 C ATOM 778 C GLN A 171 -9.267 -0.095 -8.755 1.00 0.00 C ATOM 779 O GLN A 171 -9.258 0.740 -7.870 1.00 0.00 O ATOM 780 CB GLN A 171 -9.847 -2.505 -8.902 1.00 0.00 C ATOM 781 CG GLN A 171 -10.572 -3.497 -8.009 1.00 0.00 C ATOM 782 CD GLN A 171 -11.890 -4.002 -8.575 1.00 0.00 C ATOM 783 OE1 GLN A 171 -12.586 -3.173 -9.334 1.00 0.00 O flip ATOM 784 NE2 GLN A 171 -12.286 -5.135 -8.320 1.00 0.00 N flip ATOM 0 H GLN A 171 -11.072 -1.373 -10.799 1.00 0.00 H new ATOM 0 HA GLN A 171 -11.013 -0.978 -7.933 1.00 0.00 H new ATOM 0 HB2 GLN A 171 -9.897 -2.855 -9.933 1.00 0.00 H new ATOM 0 HB3 GLN A 171 -8.793 -2.483 -8.624 1.00 0.00 H new ATOM 0 HG2 GLN A 171 -9.918 -4.350 -7.827 1.00 0.00 H new ATOM 0 HG3 GLN A 171 -10.761 -3.028 -7.043 1.00 0.00 H new ATOM 0 HE21 GLN A 171 -11.725 -5.751 -7.731 1.00 0.00 H new ATOM 0 HE22 GLN A 171 -13.176 -5.461 -8.697 1.00 0.00 H new ATOM 793 N ASN A 172 -8.330 -0.160 -9.696 1.00 0.00 N ATOM 794 CA ASN A 172 -7.151 0.716 -9.683 1.00 0.00 C ATOM 795 C ASN A 172 -7.548 2.187 -9.701 1.00 0.00 C ATOM 796 O ASN A 172 -6.803 3.040 -9.222 1.00 0.00 O ATOM 797 CB ASN A 172 -6.226 0.404 -10.866 1.00 0.00 C ATOM 798 CG ASN A 172 -6.874 0.676 -12.211 1.00 0.00 C ATOM 799 OD1 ASN A 172 -7.605 -0.161 -12.736 1.00 0.00 O ATOM 800 ND2 ASN A 172 -6.597 1.836 -12.779 1.00 0.00 N ATOM 0 H ASN A 172 -8.360 -0.810 -10.481 1.00 0.00 H new ATOM 0 HA ASN A 172 -6.612 0.522 -8.756 1.00 0.00 H new ATOM 0 HB2 ASN A 172 -5.319 1.001 -10.778 1.00 0.00 H new ATOM 0 HB3 ASN A 172 -5.925 -0.642 -10.819 1.00 0.00 H new ATOM 0 HD21 ASN A 172 -6.995 2.066 -13.689 1.00 0.00 H new ATOM 0 HD22 ASN A 172 -5.985 2.502 -12.307 1.00 0.00 H new ATOM 807 N SER A 173 -8.730 2.471 -10.239 1.00 0.00 N ATOM 808 CA SER A 173 -9.271 3.819 -10.229 1.00 0.00 C ATOM 809 C SER A 173 -9.414 4.306 -8.788 1.00 0.00 C ATOM 810 O SER A 173 -9.216 5.481 -8.492 1.00 0.00 O ATOM 811 CB SER A 173 -10.637 3.833 -10.922 1.00 0.00 C ATOM 812 OG SER A 173 -10.963 5.129 -11.400 1.00 0.00 O ATOM 0 H SER A 173 -9.331 1.780 -10.688 1.00 0.00 H new ATOM 0 HA SER A 173 -8.593 4.483 -10.765 1.00 0.00 H new ATOM 0 HB2 SER A 173 -10.632 3.128 -11.753 1.00 0.00 H new ATOM 0 HB3 SER A 173 -11.404 3.498 -10.224 1.00 0.00 H new ATOM 0 HG SER A 173 -11.839 5.105 -11.839 1.00 0.00 H new ATOM 818 N PHE A 174 -9.777 3.384 -7.908 1.00 0.00 N ATOM 819 CA PHE A 174 -9.924 3.674 -6.494 1.00 0.00 C ATOM 820 C PHE A 174 -8.675 3.262 -5.701 1.00 0.00 C ATOM 821 O PHE A 174 -8.124 4.056 -4.940 1.00 0.00 O ATOM 822 CB PHE A 174 -11.156 2.951 -5.943 1.00 0.00 C ATOM 823 CG PHE A 174 -11.484 3.331 -4.535 1.00 0.00 C ATOM 824 CD1 PHE A 174 -10.866 2.693 -3.476 1.00 0.00 C ATOM 825 CD2 PHE A 174 -12.399 4.334 -4.271 1.00 0.00 C ATOM 826 CE1 PHE A 174 -11.155 3.047 -2.179 1.00 0.00 C ATOM 827 CE2 PHE A 174 -12.695 4.692 -2.974 1.00 0.00 C ATOM 828 CZ PHE A 174 -12.072 4.047 -1.925 1.00 0.00 C ATOM 0 H PHE A 174 -9.977 2.415 -8.157 1.00 0.00 H new ATOM 0 HA PHE A 174 -10.050 4.751 -6.381 1.00 0.00 H new ATOM 0 HB2 PHE A 174 -12.013 3.170 -6.580 1.00 0.00 H new ATOM 0 HB3 PHE A 174 -10.989 1.875 -5.992 1.00 0.00 H new ATOM 0 HD1 PHE A 174 -10.149 1.909 -3.669 1.00 0.00 H new ATOM 0 HD2 PHE A 174 -12.886 4.842 -5.090 1.00 0.00 H new ATOM 0 HE1 PHE A 174 -10.665 2.543 -1.359 1.00 0.00 H new ATOM 0 HE2 PHE A 174 -13.413 5.475 -2.779 1.00 0.00 H new ATOM 0 HZ PHE A 174 -12.302 4.324 -0.907 1.00 0.00 H new ATOM 838 N VAL A 175 -8.235 2.020 -5.899 1.00 0.00 N ATOM 839 CA VAL A 175 -7.216 1.406 -5.054 1.00 0.00 C ATOM 840 C VAL A 175 -5.823 2.003 -5.284 1.00 0.00 C ATOM 841 O VAL A 175 -5.269 2.618 -4.396 1.00 0.00 O ATOM 842 CB VAL A 175 -7.217 -0.140 -5.198 1.00 0.00 C ATOM 843 CG1 VAL A 175 -8.568 -0.690 -4.786 1.00 0.00 C ATOM 844 CG2 VAL A 175 -6.867 -0.604 -6.590 1.00 0.00 C ATOM 0 H VAL A 175 -8.574 1.415 -6.647 1.00 0.00 H new ATOM 0 HA VAL A 175 -7.479 1.639 -4.022 1.00 0.00 H new ATOM 0 HB VAL A 175 -6.439 -0.524 -4.538 1.00 0.00 H new ATOM 0 HG11 VAL A 175 -8.566 -1.775 -4.888 1.00 0.00 H new ATOM 0 HG12 VAL A 175 -8.768 -0.424 -3.748 1.00 0.00 H new ATOM 0 HG13 VAL A 175 -9.343 -0.267 -5.425 1.00 0.00 H new ATOM 0 HG21 VAL A 175 -6.885 -1.693 -6.626 1.00 0.00 H new ATOM 0 HG22 VAL A 175 -7.592 -0.206 -7.299 1.00 0.00 H new ATOM 0 HG23 VAL A 175 -5.870 -0.249 -6.852 1.00 0.00 H new ATOM 854 N HIS A 176 -5.243 1.824 -6.457 1.00 0.00 N ATOM 855 CA HIS A 176 -4.014 2.532 -6.807 1.00 0.00 C ATOM 856 C HIS A 176 -4.122 4.054 -6.526 1.00 0.00 C ATOM 857 O HIS A 176 -3.115 4.718 -6.289 1.00 0.00 O ATOM 858 CB HIS A 176 -3.665 2.254 -8.274 1.00 0.00 C ATOM 859 CG HIS A 176 -2.308 2.738 -8.673 1.00 0.00 C ATOM 860 ND1 HIS A 176 -1.210 1.914 -8.802 1.00 0.00 N ATOM 861 CD2 HIS A 176 -1.881 3.978 -8.965 1.00 0.00 C ATOM 862 CE1 HIS A 176 -0.164 2.636 -9.158 1.00 0.00 C ATOM 863 NE2 HIS A 176 -0.543 3.895 -9.264 1.00 0.00 N ATOM 0 H HIS A 176 -5.596 1.200 -7.182 1.00 0.00 H new ATOM 0 HA HIS A 176 -3.208 2.160 -6.175 1.00 0.00 H new ATOM 0 HB2 HIS A 176 -3.726 1.181 -8.455 1.00 0.00 H new ATOM 0 HB3 HIS A 176 -4.412 2.728 -8.912 1.00 0.00 H new ATOM 0 HD1 HIS A 176 -1.207 0.906 -8.647 1.00 0.00 H new ATOM 0 HD2 HIS A 176 -2.481 4.876 -8.965 1.00 0.00 H new ATOM 0 HE1 HIS A 176 0.833 2.260 -9.333 1.00 0.00 H new ATOM 872 N ASP A 177 -5.346 4.586 -6.515 1.00 0.00 N ATOM 873 CA ASP A 177 -5.602 6.007 -6.200 1.00 0.00 C ATOM 874 C ASP A 177 -5.657 6.253 -4.693 1.00 0.00 C ATOM 875 O ASP A 177 -5.815 7.378 -4.254 1.00 0.00 O ATOM 876 CB ASP A 177 -6.909 6.459 -6.858 1.00 0.00 C ATOM 877 CG ASP A 177 -7.244 7.924 -6.620 1.00 0.00 C ATOM 878 OD1 ASP A 177 -6.445 8.799 -7.015 1.00 0.00 O ATOM 879 OD2 ASP A 177 -8.330 8.206 -6.065 1.00 0.00 O ATOM 0 H ASP A 177 -6.190 4.052 -6.722 1.00 0.00 H new ATOM 0 HA ASP A 177 -4.773 6.592 -6.598 1.00 0.00 H new ATOM 0 HB2 ASP A 177 -6.845 6.281 -7.931 1.00 0.00 H new ATOM 0 HB3 ASP A 177 -7.726 5.844 -6.481 1.00 0.00 H new ATOM 884 N CYS A 178 -5.548 5.199 -3.907 1.00 0.00 N ATOM 885 CA CYS A 178 -5.411 5.328 -2.470 1.00 0.00 C ATOM 886 C CYS A 178 -3.928 5.305 -2.125 1.00 0.00 C ATOM 887 O CYS A 178 -3.501 5.777 -1.072 1.00 0.00 O ATOM 888 CB CYS A 178 -6.110 4.181 -1.745 1.00 0.00 C ATOM 889 SG CYS A 178 -5.124 2.661 -1.649 1.00 0.00 S ATOM 0 H CYS A 178 -5.552 4.236 -4.244 1.00 0.00 H new ATOM 0 HA CYS A 178 -5.872 6.264 -2.153 1.00 0.00 H new ATOM 0 HB2 CYS A 178 -6.362 4.503 -0.735 1.00 0.00 H new ATOM 0 HB3 CYS A 178 -7.049 3.962 -2.253 1.00 0.00 H new ATOM 894 N VAL A 179 -3.137 4.743 -3.035 1.00 0.00 N ATOM 895 CA VAL A 179 -1.703 4.632 -2.832 1.00 0.00 C ATOM 896 C VAL A 179 -0.994 5.791 -3.494 1.00 0.00 C ATOM 897 O VAL A 179 0.072 6.211 -3.055 1.00 0.00 O ATOM 898 CB VAL A 179 -1.138 3.312 -3.365 1.00 0.00 C ATOM 899 CG1 VAL A 179 -2.193 2.234 -3.344 1.00 0.00 C ATOM 900 CG2 VAL A 179 -0.536 3.465 -4.745 1.00 0.00 C ATOM 0 H VAL A 179 -3.469 4.358 -3.919 1.00 0.00 H new ATOM 0 HA VAL A 179 -1.530 4.654 -1.756 1.00 0.00 H new ATOM 0 HB VAL A 179 -0.328 3.012 -2.700 1.00 0.00 H new ATOM 0 HG11 VAL A 179 -1.771 1.305 -3.727 1.00 0.00 H new ATOM 0 HG12 VAL A 179 -2.538 2.082 -2.321 1.00 0.00 H new ATOM 0 HG13 VAL A 179 -3.034 2.535 -3.969 1.00 0.00 H new ATOM 0 HG21 VAL A 179 -0.148 2.503 -5.082 1.00 0.00 H new ATOM 0 HG22 VAL A 179 -1.302 3.811 -5.440 1.00 0.00 H new ATOM 0 HG23 VAL A 179 0.276 4.191 -4.709 1.00 0.00 H new ATOM 910 N ASN A 180 -1.615 6.335 -4.535 1.00 0.00 N ATOM 911 CA ASN A 180 -1.169 7.593 -5.115 1.00 0.00 C ATOM 912 C ASN A 180 -1.242 8.662 -4.030 1.00 0.00 C ATOM 913 O ASN A 180 -0.821 9.799 -4.206 1.00 0.00 O ATOM 914 CB ASN A 180 -2.060 7.964 -6.302 1.00 0.00 C ATOM 915 CG ASN A 180 -1.538 9.148 -7.102 1.00 0.00 C ATOM 916 OD1 ASN A 180 -0.228 9.215 -7.301 1.00 0.00 O flip ATOM 917 ND2 ASN A 180 -2.314 9.979 -7.572 1.00 0.00 N flip ATOM 0 H ASN A 180 -2.428 5.923 -4.993 1.00 0.00 H new ATOM 0 HA ASN A 180 -0.146 7.507 -5.480 1.00 0.00 H new ATOM 0 HB2 ASN A 180 -2.152 7.101 -6.962 1.00 0.00 H new ATOM 0 HB3 ASN A 180 -3.061 8.194 -5.937 1.00 0.00 H new ATOM 0 HD21 ASN A 180 -3.316 9.897 -7.399 1.00 0.00 H new ATOM 0 HD22 ASN A 180 -1.956 10.750 -8.135 1.00 0.00 H new ATOM 924 N ILE A 181 -1.861 8.258 -2.929 1.00 0.00 N ATOM 925 CA ILE A 181 -1.907 9.001 -1.691 1.00 0.00 C ATOM 926 C ILE A 181 -0.841 8.484 -0.712 1.00 0.00 C ATOM 927 O ILE A 181 -0.032 9.244 -0.217 1.00 0.00 O ATOM 928 CB ILE A 181 -3.297 8.832 -1.056 1.00 0.00 C ATOM 929 CG1 ILE A 181 -4.331 8.621 -2.142 1.00 0.00 C ATOM 930 CG2 ILE A 181 -3.679 10.037 -0.244 1.00 0.00 C ATOM 931 CD1 ILE A 181 -4.536 9.832 -3.033 1.00 0.00 C ATOM 0 H ILE A 181 -2.361 7.370 -2.879 1.00 0.00 H new ATOM 0 HA ILE A 181 -1.712 10.052 -1.902 1.00 0.00 H new ATOM 0 HB ILE A 181 -3.260 7.966 -0.395 1.00 0.00 H new ATOM 0 HG12 ILE A 181 -4.030 7.774 -2.759 1.00 0.00 H new ATOM 0 HG13 ILE A 181 -5.282 8.356 -1.680 1.00 0.00 H new ATOM 0 HG21 ILE A 181 -4.667 9.885 0.191 1.00 0.00 H new ATOM 0 HG22 ILE A 181 -2.950 10.184 0.553 1.00 0.00 H new ATOM 0 HG23 ILE A 181 -3.697 10.918 -0.886 1.00 0.00 H new ATOM 0 HD11 ILE A 181 -5.290 9.606 -3.786 1.00 0.00 H new ATOM 0 HD12 ILE A 181 -4.868 10.676 -2.429 1.00 0.00 H new ATOM 0 HD13 ILE A 181 -3.597 10.085 -3.525 1.00 0.00 H new ATOM 943 N THR A 182 -0.812 7.169 -0.501 1.00 0.00 N ATOM 944 CA THR A 182 -0.036 6.552 0.582 1.00 0.00 C ATOM 945 C THR A 182 1.437 6.662 0.351 1.00 0.00 C ATOM 946 O THR A 182 2.206 7.071 1.231 1.00 0.00 O ATOM 947 CB THR A 182 -0.354 5.051 0.759 1.00 0.00 C ATOM 948 OG1 THR A 182 -1.616 4.893 1.372 1.00 0.00 O ATOM 949 CG2 THR A 182 0.699 4.367 1.624 1.00 0.00 C ATOM 0 H THR A 182 -1.324 6.499 -1.074 1.00 0.00 H new ATOM 0 HA THR A 182 -0.325 7.102 1.477 1.00 0.00 H new ATOM 0 HB THR A 182 -0.357 4.592 -0.230 1.00 0.00 H new ATOM 0 HG1 THR A 182 -1.504 4.852 2.345 1.00 0.00 H new ATOM 0 HG21 THR A 182 0.451 3.311 1.733 1.00 0.00 H new ATOM 0 HG22 THR A 182 1.677 4.463 1.152 1.00 0.00 H new ATOM 0 HG23 THR A 182 0.723 4.837 2.607 1.00 0.00 H new ATOM 957 N VAL A 183 1.818 6.283 -0.841 1.00 0.00 N ATOM 958 CA VAL A 183 3.196 6.258 -1.229 1.00 0.00 C ATOM 959 C VAL A 183 3.695 7.698 -1.310 1.00 0.00 C ATOM 960 O VAL A 183 4.865 7.970 -1.567 1.00 0.00 O ATOM 961 CB VAL A 183 3.346 5.485 -2.564 1.00 0.00 C ATOM 962 CG1 VAL A 183 2.295 4.399 -2.658 1.00 0.00 C ATOM 963 CG2 VAL A 183 3.288 6.406 -3.776 1.00 0.00 C ATOM 0 H VAL A 183 1.173 5.982 -1.572 1.00 0.00 H new ATOM 0 HA VAL A 183 3.809 5.732 -0.497 1.00 0.00 H new ATOM 0 HB VAL A 183 4.334 5.025 -2.568 1.00 0.00 H new ATOM 0 HG11 VAL A 183 2.410 3.862 -3.600 1.00 0.00 H new ATOM 0 HG12 VAL A 183 2.415 3.704 -1.827 1.00 0.00 H new ATOM 0 HG13 VAL A 183 1.303 4.848 -2.615 1.00 0.00 H new ATOM 0 HG21 VAL A 183 3.398 5.817 -4.686 1.00 0.00 H new ATOM 0 HG22 VAL A 183 2.330 6.925 -3.793 1.00 0.00 H new ATOM 0 HG23 VAL A 183 4.095 7.136 -3.717 1.00 0.00 H new ATOM 973 N LYS A 184 2.755 8.614 -1.082 1.00 0.00 N ATOM 974 CA LYS A 184 3.052 10.011 -0.895 1.00 0.00 C ATOM 975 C LYS A 184 3.171 10.325 0.588 1.00 0.00 C ATOM 976 O LYS A 184 4.250 10.621 1.091 1.00 0.00 O ATOM 977 CB LYS A 184 1.941 10.867 -1.484 1.00 0.00 C ATOM 978 CG LYS A 184 1.609 10.503 -2.906 1.00 0.00 C ATOM 979 CD LYS A 184 2.841 10.522 -3.767 1.00 0.00 C ATOM 980 CE LYS A 184 2.552 9.964 -5.145 1.00 0.00 C ATOM 981 NZ LYS A 184 3.709 10.116 -6.063 1.00 0.00 N ATOM 0 H LYS A 184 1.761 8.393 -1.024 1.00 0.00 H new ATOM 0 HA LYS A 184 3.994 10.231 -1.398 1.00 0.00 H new ATOM 0 HB2 LYS A 184 1.046 10.764 -0.870 1.00 0.00 H new ATOM 0 HB3 LYS A 184 2.237 11.915 -1.443 1.00 0.00 H new ATOM 0 HG2 LYS A 184 1.155 9.512 -2.935 1.00 0.00 H new ATOM 0 HG3 LYS A 184 0.873 11.203 -3.302 1.00 0.00 H new ATOM 0 HD2 LYS A 184 3.211 11.543 -3.855 1.00 0.00 H new ATOM 0 HD3 LYS A 184 3.629 9.937 -3.292 1.00 0.00 H new ATOM 0 HE2 LYS A 184 2.292 8.909 -5.061 1.00 0.00 H new ATOM 0 HE3 LYS A 184 1.685 10.473 -5.567 1.00 0.00 H new ATOM 0 HZ1 LYS A 184 3.468 9.721 -6.994 1.00 0.00 H new ATOM 0 HZ2 LYS A 184 3.941 11.125 -6.164 1.00 0.00 H new ATOM 0 HZ3 LYS A 184 4.530 9.609 -5.674 1.00 0.00 H new ATOM 995 N GLN A 185 2.037 10.187 1.269 1.00 0.00 N ATOM 996 CA GLN A 185 1.870 10.542 2.680 1.00 0.00 C ATOM 997 C GLN A 185 3.053 10.118 3.531 1.00 0.00 C ATOM 998 O GLN A 185 3.443 10.817 4.466 1.00 0.00 O ATOM 999 CB GLN A 185 0.602 9.876 3.203 1.00 0.00 C ATOM 1000 CG GLN A 185 -0.607 10.166 2.334 1.00 0.00 C ATOM 1001 CD GLN A 185 -1.204 11.529 2.594 1.00 0.00 C ATOM 1002 OE1 GLN A 185 -1.235 11.916 3.855 1.00 0.00 O flip ATOM 1003 NE2 GLN A 185 -1.680 12.202 1.680 1.00 0.00 N flip ATOM 0 H GLN A 185 1.186 9.816 0.847 1.00 0.00 H new ATOM 0 HA GLN A 185 1.800 11.628 2.748 1.00 0.00 H new ATOM 0 HB2 GLN A 185 0.757 8.798 3.256 1.00 0.00 H new ATOM 0 HB3 GLN A 185 0.407 10.221 4.218 1.00 0.00 H new ATOM 0 HG2 GLN A 185 -0.320 10.095 1.285 1.00 0.00 H new ATOM 0 HG3 GLN A 185 -1.366 9.403 2.509 1.00 0.00 H new ATOM 0 HE21 GLN A 185 -1.633 11.863 0.719 1.00 0.00 H new ATOM 0 HE22 GLN A 185 -2.121 13.099 1.883 1.00 0.00 H new ATOM 1012 N HIS A 186 3.621 8.971 3.211 1.00 0.00 N ATOM 1013 CA HIS A 186 4.754 8.486 3.957 1.00 0.00 C ATOM 1014 C HIS A 186 6.072 8.864 3.285 1.00 0.00 C ATOM 1015 O HIS A 186 6.742 9.769 3.738 1.00 0.00 O ATOM 1016 CB HIS A 186 4.621 6.977 4.134 1.00 0.00 C ATOM 1017 CG HIS A 186 3.766 6.626 5.316 1.00 0.00 C ATOM 1018 ND1 HIS A 186 2.446 6.837 5.538 1.00 0.00 N flip ATOM 1019 CD2 HIS A 186 4.247 6.010 6.452 1.00 0.00 C flip ATOM 1020 CE1 HIS A 186 2.158 6.357 6.789 1.00 0.00 C flip ATOM 1021 NE2 HIS A 186 3.260 5.863 7.319 1.00 0.00 N flip ATOM 0 H HIS A 186 3.317 8.367 2.447 1.00 0.00 H new ATOM 0 HA HIS A 186 4.766 8.959 4.939 1.00 0.00 H new ATOM 0 HB2 HIS A 186 4.190 6.542 3.232 1.00 0.00 H new ATOM 0 HB3 HIS A 186 5.611 6.537 4.258 1.00 0.00 H new ATOM 0 HD2 HIS A 186 5.269 5.697 6.609 1.00 0.00 H new ATOM 0 HE1 HIS A 186 1.188 6.380 7.263 1.00 0.00 H new ATOM 0 HE2 HIS A 186 3.338 5.439 8.243 1.00 0.00 H new ATOM 1030 N THR A 187 6.367 8.230 2.171 1.00 0.00 N ATOM 1031 CA THR A 187 7.600 8.428 1.383 1.00 0.00 C ATOM 1032 C THR A 187 8.140 9.877 1.305 1.00 0.00 C ATOM 1033 O THR A 187 9.345 10.086 1.170 1.00 0.00 O ATOM 1034 CB THR A 187 7.389 7.842 -0.038 1.00 0.00 C ATOM 1035 OG1 THR A 187 7.868 6.492 -0.071 1.00 0.00 O ATOM 1036 CG2 THR A 187 8.069 8.659 -1.131 1.00 0.00 C ATOM 0 H THR A 187 5.744 7.535 1.761 1.00 0.00 H new ATOM 0 HA THR A 187 8.381 7.896 1.926 1.00 0.00 H new ATOM 0 HB THR A 187 6.319 7.875 -0.243 1.00 0.00 H new ATOM 0 HG1 THR A 187 7.161 5.902 -0.407 1.00 0.00 H new ATOM 0 HG21 THR A 187 7.883 8.196 -2.100 1.00 0.00 H new ATOM 0 HG22 THR A 187 7.668 9.673 -1.130 1.00 0.00 H new ATOM 0 HG23 THR A 187 9.142 8.693 -0.945 1.00 0.00 H new ATOM 1044 N VAL A 188 7.284 10.857 1.468 1.00 0.00 N ATOM 1045 CA VAL A 188 7.665 12.248 1.210 1.00 0.00 C ATOM 1046 C VAL A 188 8.045 12.976 2.498 1.00 0.00 C ATOM 1047 O VAL A 188 8.351 14.167 2.496 1.00 0.00 O ATOM 1048 CB VAL A 188 6.550 13.008 0.473 1.00 0.00 C ATOM 1049 CG1 VAL A 188 6.065 12.172 -0.696 1.00 0.00 C ATOM 1050 CG2 VAL A 188 5.403 13.371 1.410 1.00 0.00 C ATOM 0 H VAL A 188 6.320 10.731 1.776 1.00 0.00 H new ATOM 0 HA VAL A 188 8.544 12.222 0.566 1.00 0.00 H new ATOM 0 HB VAL A 188 6.954 13.948 0.097 1.00 0.00 H new ATOM 0 HG11 VAL A 188 5.274 12.706 -1.222 1.00 0.00 H new ATOM 0 HG12 VAL A 188 6.894 11.986 -1.379 1.00 0.00 H new ATOM 0 HG13 VAL A 188 5.678 11.222 -0.328 1.00 0.00 H new ATOM 0 HG21 VAL A 188 4.634 13.907 0.853 1.00 0.00 H new ATOM 0 HG22 VAL A 188 4.977 12.461 1.833 1.00 0.00 H new ATOM 0 HG23 VAL A 188 5.777 14.005 2.214 1.00 0.00 H new ATOM 1060 N THR A 189 8.003 12.242 3.592 1.00 0.00 N ATOM 1061 CA THR A 189 8.487 12.716 4.880 1.00 0.00 C ATOM 1062 C THR A 189 9.096 11.552 5.634 1.00 0.00 C ATOM 1063 O THR A 189 10.073 11.670 6.372 1.00 0.00 O ATOM 1064 CB THR A 189 7.344 13.333 5.712 1.00 0.00 C ATOM 1065 OG1 THR A 189 6.892 14.555 5.110 1.00 0.00 O ATOM 1066 CG2 THR A 189 7.783 13.580 7.146 1.00 0.00 C ATOM 0 H THR A 189 7.630 11.293 3.616 1.00 0.00 H new ATOM 0 HA THR A 189 9.236 13.490 4.710 1.00 0.00 H new ATOM 0 HB THR A 189 6.517 12.623 5.730 1.00 0.00 H new ATOM 0 HG1 THR A 189 7.343 14.682 4.249 1.00 0.00 H new ATOM 0 HG21 THR A 189 6.958 14.015 7.709 1.00 0.00 H new ATOM 0 HG22 THR A 189 8.077 12.636 7.604 1.00 0.00 H new ATOM 0 HG23 THR A 189 8.630 14.266 7.154 1.00 0.00 H new ATOM 1074 N THR A 190 8.525 10.425 5.341 1.00 0.00 N ATOM 1075 CA THR A 190 8.825 9.179 5.979 1.00 0.00 C ATOM 1076 C THR A 190 9.968 8.478 5.271 1.00 0.00 C ATOM 1077 O THR A 190 10.757 7.764 5.887 1.00 0.00 O ATOM 1078 CB THR A 190 7.568 8.299 6.003 1.00 0.00 C ATOM 1079 OG1 THR A 190 6.695 8.696 7.067 1.00 0.00 O ATOM 1080 CG2 THR A 190 7.919 6.844 6.125 1.00 0.00 C ATOM 0 H THR A 190 7.807 10.344 4.621 1.00 0.00 H new ATOM 0 HA THR A 190 9.139 9.368 7.005 1.00 0.00 H new ATOM 0 HB THR A 190 7.048 8.438 5.055 1.00 0.00 H new ATOM 0 HG1 THR A 190 5.898 8.126 7.066 1.00 0.00 H new ATOM 0 HG21 THR A 190 7.006 6.249 6.139 1.00 0.00 H new ATOM 0 HG22 THR A 190 8.533 6.545 5.276 1.00 0.00 H new ATOM 0 HG23 THR A 190 8.473 6.680 7.049 1.00 0.00 H new ATOM 1088 N THR A 191 10.078 8.700 3.977 1.00 0.00 N ATOM 1089 CA THR A 191 11.184 8.135 3.248 1.00 0.00 C ATOM 1090 C THR A 191 12.285 9.170 3.097 1.00 0.00 C ATOM 1091 O THR A 191 13.468 8.850 3.032 1.00 0.00 O ATOM 1092 CB THR A 191 10.797 7.590 1.870 1.00 0.00 C ATOM 1093 OG1 THR A 191 9.681 6.703 2.001 1.00 0.00 O ATOM 1094 CG2 THR A 191 11.955 6.833 1.240 1.00 0.00 C ATOM 0 H THR A 191 9.428 9.256 3.422 1.00 0.00 H new ATOM 0 HA THR A 191 11.534 7.284 3.832 1.00 0.00 H new ATOM 0 HB THR A 191 10.537 8.434 1.231 1.00 0.00 H new ATOM 0 HG1 THR A 191 9.226 6.620 1.137 1.00 0.00 H new ATOM 0 HG21 THR A 191 11.654 6.456 0.262 1.00 0.00 H new ATOM 0 HG22 THR A 191 12.807 7.502 1.125 1.00 0.00 H new ATOM 0 HG23 THR A 191 12.235 5.997 1.881 1.00 0.00 H new ATOM 1102 N THR A 192 11.882 10.427 3.097 1.00 0.00 N ATOM 1103 CA THR A 192 12.809 11.523 2.886 1.00 0.00 C ATOM 1104 C THR A 192 13.605 11.838 4.142 1.00 0.00 C ATOM 1105 O THR A 192 14.235 12.890 4.243 1.00 0.00 O ATOM 1106 CB THR A 192 12.059 12.781 2.448 1.00 0.00 C ATOM 1107 OG1 THR A 192 11.077 13.119 3.438 1.00 0.00 O ATOM 1108 CG2 THR A 192 11.379 12.558 1.108 1.00 0.00 C ATOM 0 H THR A 192 10.914 10.715 3.241 1.00 0.00 H new ATOM 0 HA THR A 192 13.500 11.209 2.104 1.00 0.00 H new ATOM 0 HB THR A 192 12.773 13.598 2.343 1.00 0.00 H new ATOM 0 HG1 THR A 192 10.629 13.953 3.183 1.00 0.00 H new ATOM 0 HG21 THR A 192 10.850 13.464 0.813 1.00 0.00 H new ATOM 0 HG22 THR A 192 12.129 12.314 0.356 1.00 0.00 H new ATOM 0 HG23 THR A 192 10.669 11.735 1.193 1.00 0.00 H new ATOM 1116 N LYS A 193 13.603 10.919 5.095 1.00 0.00 N ATOM 1117 CA LYS A 193 14.339 11.133 6.328 1.00 0.00 C ATOM 1118 C LYS A 193 15.752 10.613 6.188 1.00 0.00 C ATOM 1119 O LYS A 193 16.438 10.342 7.172 1.00 0.00 O ATOM 1120 CB LYS A 193 13.620 10.517 7.534 1.00 0.00 C ATOM 1121 CG LYS A 193 12.986 9.157 7.289 1.00 0.00 C ATOM 1122 CD LYS A 193 13.997 8.020 7.270 1.00 0.00 C ATOM 1123 CE LYS A 193 13.289 6.678 7.375 1.00 0.00 C ATOM 1124 NZ LYS A 193 14.243 5.539 7.460 1.00 0.00 N ATOM 0 H LYS A 193 13.107 10.030 5.039 1.00 0.00 H new ATOM 0 HA LYS A 193 14.389 12.206 6.515 1.00 0.00 H new ATOM 0 HB2 LYS A 193 14.334 10.424 8.353 1.00 0.00 H new ATOM 0 HB3 LYS A 193 12.844 11.207 7.864 1.00 0.00 H new ATOM 0 HG2 LYS A 193 12.245 8.963 8.065 1.00 0.00 H new ATOM 0 HG3 LYS A 193 12.454 9.177 6.338 1.00 0.00 H new ATOM 0 HD2 LYS A 193 14.581 8.059 6.350 1.00 0.00 H new ATOM 0 HD3 LYS A 193 14.698 8.134 8.097 1.00 0.00 H new ATOM 0 HE2 LYS A 193 12.647 6.677 8.256 1.00 0.00 H new ATOM 0 HE3 LYS A 193 12.642 6.543 6.508 1.00 0.00 H new ATOM 0 HZ1 LYS A 193 13.899 4.850 8.159 1.00 0.00 H new ATOM 0 HZ2 LYS A 193 14.319 5.080 6.530 1.00 0.00 H new ATOM 0 HZ3 LYS A 193 15.178 5.890 7.751 1.00 0.00 H new ATOM 1138 N GLY A 194 16.179 10.488 4.946 1.00 0.00 N ATOM 1139 CA GLY A 194 17.527 10.050 4.670 1.00 0.00 C ATOM 1140 C GLY A 194 17.543 8.578 4.379 1.00 0.00 C ATOM 1141 O GLY A 194 18.485 7.857 4.716 1.00 0.00 O ATOM 0 H GLY A 194 15.614 10.683 4.120 1.00 0.00 H new ATOM 0 HA2 GLY A 194 17.929 10.601 3.820 1.00 0.00 H new ATOM 0 HA3 GLY A 194 18.170 10.267 5.523 1.00 0.00 H new ATOM 1145 N GLU A 195 16.473 8.142 3.755 1.00 0.00 N ATOM 1146 CA GLU A 195 16.283 6.759 3.413 1.00 0.00 C ATOM 1147 C GLU A 195 16.563 6.598 1.926 1.00 0.00 C ATOM 1148 O GLU A 195 16.540 7.583 1.190 1.00 0.00 O ATOM 1149 CB GLU A 195 14.845 6.358 3.771 1.00 0.00 C ATOM 1150 CG GLU A 195 14.538 4.895 3.559 1.00 0.00 C ATOM 1151 CD GLU A 195 15.480 4.009 4.337 1.00 0.00 C ATOM 1152 OE1 GLU A 195 16.560 3.684 3.807 1.00 0.00 O ATOM 1153 OE2 GLU A 195 15.151 3.657 5.485 1.00 0.00 O ATOM 0 H GLU A 195 15.704 8.748 3.469 1.00 0.00 H new ATOM 0 HA GLU A 195 16.961 6.109 3.966 1.00 0.00 H new ATOM 0 HB2 GLU A 195 14.659 6.609 4.815 1.00 0.00 H new ATOM 0 HB3 GLU A 195 14.155 6.953 3.173 1.00 0.00 H new ATOM 0 HG2 GLU A 195 13.511 4.691 3.863 1.00 0.00 H new ATOM 0 HG3 GLU A 195 14.609 4.658 2.497 1.00 0.00 H new ATOM 1160 N ASN A 196 16.833 5.387 1.478 1.00 0.00 N ATOM 1161 CA ASN A 196 17.197 5.187 0.085 1.00 0.00 C ATOM 1162 C ASN A 196 16.008 4.674 -0.681 1.00 0.00 C ATOM 1163 O ASN A 196 15.592 3.532 -0.499 1.00 0.00 O ATOM 1164 CB ASN A 196 18.338 4.179 -0.084 1.00 0.00 C ATOM 1165 CG ASN A 196 19.494 4.399 0.868 1.00 0.00 C ATOM 1166 OD1 ASN A 196 20.343 5.264 0.654 1.00 0.00 O ATOM 1167 ND2 ASN A 196 19.551 3.587 1.912 1.00 0.00 N ATOM 0 H ASN A 196 16.809 4.539 2.045 1.00 0.00 H new ATOM 0 HA ASN A 196 17.529 6.153 -0.295 1.00 0.00 H new ATOM 0 HB2 ASN A 196 17.946 3.173 0.062 1.00 0.00 H new ATOM 0 HB3 ASN A 196 18.708 4.231 -1.108 1.00 0.00 H new ATOM 0 HD21 ASN A 196 20.320 3.665 2.577 1.00 0.00 H new ATOM 0 HD22 ASN A 196 18.825 2.884 2.051 1.00 0.00 H new ATOM 1174 N PHE A 197 15.440 5.523 -1.511 1.00 0.00 N ATOM 1175 CA PHE A 197 14.373 5.096 -2.370 1.00 0.00 C ATOM 1176 C PHE A 197 14.730 5.355 -3.823 1.00 0.00 C ATOM 1177 O PHE A 197 14.766 6.491 -4.295 1.00 0.00 O ATOM 1178 CB PHE A 197 13.021 5.713 -1.966 1.00 0.00 C ATOM 1179 CG PHE A 197 12.864 7.190 -2.196 1.00 0.00 C ATOM 1180 CD1 PHE A 197 13.697 8.106 -1.578 1.00 0.00 C ATOM 1181 CD2 PHE A 197 11.861 7.652 -3.028 1.00 0.00 C ATOM 1182 CE1 PHE A 197 13.534 9.462 -1.790 1.00 0.00 C ATOM 1183 CE2 PHE A 197 11.691 9.005 -3.245 1.00 0.00 C ATOM 1184 CZ PHE A 197 12.530 9.913 -2.626 1.00 0.00 C ATOM 0 H PHE A 197 15.702 6.504 -1.604 1.00 0.00 H new ATOM 0 HA PHE A 197 14.248 4.020 -2.251 1.00 0.00 H new ATOM 0 HB2 PHE A 197 12.233 5.196 -2.514 1.00 0.00 H new ATOM 0 HB3 PHE A 197 12.857 5.513 -0.907 1.00 0.00 H new ATOM 0 HD1 PHE A 197 14.482 7.758 -0.923 1.00 0.00 H new ATOM 0 HD2 PHE A 197 11.203 6.947 -3.514 1.00 0.00 H new ATOM 0 HE1 PHE A 197 14.190 10.168 -1.303 1.00 0.00 H new ATOM 0 HE2 PHE A 197 10.904 9.353 -3.897 1.00 0.00 H new ATOM 0 HZ PHE A 197 12.401 10.972 -2.795 1.00 0.00 H new ATOM 1194 N THR A 198 15.051 4.273 -4.506 1.00 0.00 N ATOM 1195 CA THR A 198 15.325 4.308 -5.913 1.00 0.00 C ATOM 1196 C THR A 198 14.111 3.789 -6.659 1.00 0.00 C ATOM 1197 O THR A 198 13.146 3.414 -6.029 1.00 0.00 O ATOM 1198 CB THR A 198 16.600 3.517 -6.306 1.00 0.00 C ATOM 1199 OG1 THR A 198 17.069 3.958 -7.588 1.00 0.00 O ATOM 1200 CG2 THR A 198 16.345 2.016 -6.362 1.00 0.00 C ATOM 0 H THR A 198 15.127 3.345 -4.090 1.00 0.00 H new ATOM 0 HA THR A 198 15.525 5.343 -6.191 1.00 0.00 H new ATOM 0 HB THR A 198 17.351 3.707 -5.539 1.00 0.00 H new ATOM 0 HG1 THR A 198 17.875 3.457 -7.831 1.00 0.00 H new ATOM 0 HG21 THR A 198 17.264 1.501 -6.641 1.00 0.00 H new ATOM 0 HG22 THR A 198 16.016 1.666 -5.384 1.00 0.00 H new ATOM 0 HG23 THR A 198 15.572 1.806 -7.102 1.00 0.00 H new ATOM 1208 N GLU A 199 14.117 3.881 -7.978 1.00 0.00 N ATOM 1209 CA GLU A 199 12.993 3.414 -8.801 1.00 0.00 C ATOM 1210 C GLU A 199 12.439 2.062 -8.314 1.00 0.00 C ATOM 1211 O GLU A 199 11.224 1.865 -8.252 1.00 0.00 O ATOM 1212 CB GLU A 199 13.414 3.313 -10.269 1.00 0.00 C ATOM 1213 CG GLU A 199 12.316 2.784 -11.178 1.00 0.00 C ATOM 1214 CD GLU A 199 12.697 2.829 -12.639 1.00 0.00 C ATOM 1215 OE1 GLU A 199 13.544 2.014 -13.064 1.00 0.00 O ATOM 1216 OE2 GLU A 199 12.148 3.680 -13.370 1.00 0.00 O ATOM 0 H GLU A 199 14.890 4.277 -8.513 1.00 0.00 H new ATOM 0 HA GLU A 199 12.194 4.149 -8.704 1.00 0.00 H new ATOM 0 HB2 GLU A 199 13.722 4.298 -10.619 1.00 0.00 H new ATOM 0 HB3 GLU A 199 14.284 2.661 -10.346 1.00 0.00 H new ATOM 0 HG2 GLU A 199 12.083 1.756 -10.899 1.00 0.00 H new ATOM 0 HG3 GLU A 199 11.410 3.370 -11.025 1.00 0.00 H new ATOM 1223 N THR A 200 13.324 1.142 -7.949 1.00 0.00 N ATOM 1224 CA THR A 200 12.894 -0.138 -7.399 1.00 0.00 C ATOM 1225 C THR A 200 12.334 0.029 -5.982 1.00 0.00 C ATOM 1226 O THR A 200 11.497 -0.753 -5.536 1.00 0.00 O ATOM 1227 CB THR A 200 14.045 -1.154 -7.377 1.00 0.00 C ATOM 1228 OG1 THR A 200 14.606 -1.276 -8.691 1.00 0.00 O ATOM 1229 CG2 THR A 200 13.550 -2.511 -6.905 1.00 0.00 C ATOM 0 H THR A 200 14.335 1.256 -8.023 1.00 0.00 H new ATOM 0 HA THR A 200 12.106 -0.515 -8.051 1.00 0.00 H new ATOM 0 HB THR A 200 14.809 -0.801 -6.685 1.00 0.00 H new ATOM 0 HG1 THR A 200 15.341 -1.924 -8.674 1.00 0.00 H new ATOM 0 HG21 THR A 200 14.380 -3.218 -6.896 1.00 0.00 H new ATOM 0 HG22 THR A 200 13.141 -2.419 -5.899 1.00 0.00 H new ATOM 0 HG23 THR A 200 12.774 -2.871 -7.581 1.00 0.00 H new ATOM 1237 N ASP A 201 12.774 1.071 -5.292 1.00 0.00 N ATOM 1238 CA ASP A 201 12.299 1.356 -3.946 1.00 0.00 C ATOM 1239 C ASP A 201 10.928 1.994 -3.971 1.00 0.00 C ATOM 1240 O ASP A 201 10.308 2.225 -2.933 1.00 0.00 O ATOM 1241 CB ASP A 201 13.265 2.229 -3.158 1.00 0.00 C ATOM 1242 CG ASP A 201 14.575 1.536 -2.857 1.00 0.00 C ATOM 1243 OD1 ASP A 201 14.606 0.699 -1.940 1.00 0.00 O ATOM 1244 OD2 ASP A 201 15.576 1.842 -3.526 1.00 0.00 O ATOM 0 H ASP A 201 13.463 1.736 -5.644 1.00 0.00 H new ATOM 0 HA ASP A 201 12.233 0.394 -3.437 1.00 0.00 H new ATOM 0 HB2 ASP A 201 13.464 3.141 -3.721 1.00 0.00 H new ATOM 0 HB3 ASP A 201 12.795 2.528 -2.221 1.00 0.00 H new ATOM 1249 N ILE A 202 10.461 2.266 -5.164 1.00 0.00 N ATOM 1250 CA ILE A 202 9.159 2.860 -5.364 1.00 0.00 C ATOM 1251 C ILE A 202 8.138 1.780 -5.565 1.00 0.00 C ATOM 1252 O ILE A 202 7.139 1.709 -4.850 1.00 0.00 O ATOM 1253 CB ILE A 202 9.171 3.745 -6.609 1.00 0.00 C ATOM 1254 CG1 ILE A 202 10.508 4.452 -6.682 1.00 0.00 C ATOM 1255 CG2 ILE A 202 8.021 4.732 -6.588 1.00 0.00 C ATOM 1256 CD1 ILE A 202 10.737 5.442 -5.567 1.00 0.00 C ATOM 0 H ILE A 202 10.973 2.082 -6.027 1.00 0.00 H new ATOM 0 HA ILE A 202 8.912 3.457 -4.486 1.00 0.00 H new ATOM 0 HB ILE A 202 9.038 3.130 -7.499 1.00 0.00 H new ATOM 0 HG12 ILE A 202 11.304 3.707 -6.662 1.00 0.00 H new ATOM 0 HG13 ILE A 202 10.581 4.972 -7.637 1.00 0.00 H new ATOM 0 HG21 ILE A 202 8.054 5.349 -7.486 1.00 0.00 H new ATOM 0 HG22 ILE A 202 7.076 4.189 -6.556 1.00 0.00 H new ATOM 0 HG23 ILE A 202 8.104 5.369 -5.707 1.00 0.00 H new ATOM 0 HD11 ILE A 202 11.715 5.907 -5.688 1.00 0.00 H new ATOM 0 HD12 ILE A 202 9.964 6.210 -5.598 1.00 0.00 H new ATOM 0 HD13 ILE A 202 10.697 4.925 -4.608 1.00 0.00 H new ATOM 1268 N LYS A 203 8.432 0.911 -6.523 1.00 0.00 N ATOM 1269 CA LYS A 203 7.503 -0.111 -6.926 1.00 0.00 C ATOM 1270 C LYS A 203 7.108 -0.936 -5.741 1.00 0.00 C ATOM 1271 O LYS A 203 5.944 -1.042 -5.468 1.00 0.00 O ATOM 1272 CB LYS A 203 8.093 -1.028 -7.982 1.00 0.00 C ATOM 1273 CG LYS A 203 9.498 -1.466 -7.640 1.00 0.00 C ATOM 1274 CD LYS A 203 9.764 -2.906 -8.032 1.00 0.00 C ATOM 1275 CE LYS A 203 9.112 -3.874 -7.048 1.00 0.00 C ATOM 1276 NZ LYS A 203 9.409 -5.294 -7.390 1.00 0.00 N ATOM 0 H LYS A 203 9.316 0.902 -7.033 1.00 0.00 H new ATOM 0 HA LYS A 203 6.634 0.391 -7.350 1.00 0.00 H new ATOM 0 HB2 LYS A 203 7.458 -1.907 -8.093 1.00 0.00 H new ATOM 0 HB3 LYS A 203 8.099 -0.515 -8.944 1.00 0.00 H new ATOM 0 HG2 LYS A 203 10.212 -0.816 -8.146 1.00 0.00 H new ATOM 0 HG3 LYS A 203 9.663 -1.347 -6.569 1.00 0.00 H new ATOM 0 HD2 LYS A 203 9.380 -3.090 -9.036 1.00 0.00 H new ATOM 0 HD3 LYS A 203 10.839 -3.085 -8.064 1.00 0.00 H new ATOM 0 HE2 LYS A 203 9.467 -3.661 -6.040 1.00 0.00 H new ATOM 0 HE3 LYS A 203 8.033 -3.719 -7.046 1.00 0.00 H new ATOM 0 HZ1 LYS A 203 8.818 -5.922 -6.809 1.00 0.00 H new ATOM 0 HZ2 LYS A 203 9.204 -5.459 -8.396 1.00 0.00 H new ATOM 0 HZ3 LYS A 203 10.413 -5.493 -7.204 1.00 0.00 H new ATOM 1290 N ILE A 204 8.090 -1.486 -5.029 1.00 0.00 N ATOM 1291 CA ILE A 204 7.832 -2.306 -3.864 1.00 0.00 C ATOM 1292 C ILE A 204 6.753 -1.701 -3.003 1.00 0.00 C ATOM 1293 O ILE A 204 5.786 -2.349 -2.669 1.00 0.00 O ATOM 1294 CB ILE A 204 9.091 -2.444 -3.025 1.00 0.00 C ATOM 1295 CG1 ILE A 204 9.737 -1.083 -2.965 1.00 0.00 C ATOM 1296 CG2 ILE A 204 10.023 -3.492 -3.605 1.00 0.00 C ATOM 1297 CD1 ILE A 204 10.906 -0.982 -2.039 1.00 0.00 C ATOM 0 H ILE A 204 9.080 -1.372 -5.248 1.00 0.00 H new ATOM 0 HA ILE A 204 7.507 -3.284 -4.220 1.00 0.00 H new ATOM 0 HB ILE A 204 8.850 -2.785 -2.018 1.00 0.00 H new ATOM 0 HG12 ILE A 204 10.062 -0.806 -3.968 1.00 0.00 H new ATOM 0 HG13 ILE A 204 8.986 -0.354 -2.660 1.00 0.00 H new ATOM 0 HG21 ILE A 204 10.915 -3.569 -2.984 1.00 0.00 H new ATOM 0 HG22 ILE A 204 9.515 -4.456 -3.631 1.00 0.00 H new ATOM 0 HG23 ILE A 204 10.309 -3.205 -4.617 1.00 0.00 H new ATOM 0 HD11 ILE A 204 11.303 0.033 -2.064 1.00 0.00 H new ATOM 0 HD12 ILE A 204 10.588 -1.223 -1.024 1.00 0.00 H new ATOM 0 HD13 ILE A 204 11.680 -1.682 -2.353 1.00 0.00 H new ATOM 1309 N MET A 205 6.892 -0.441 -2.693 1.00 0.00 N ATOM 1310 CA MET A 205 5.944 0.195 -1.832 1.00 0.00 C ATOM 1311 C MET A 205 4.599 0.311 -2.497 1.00 0.00 C ATOM 1312 O MET A 205 3.593 -0.159 -1.959 1.00 0.00 O ATOM 1313 CB MET A 205 6.423 1.563 -1.438 1.00 0.00 C ATOM 1314 CG MET A 205 5.298 2.527 -1.149 1.00 0.00 C ATOM 1315 SD MET A 205 5.895 4.220 -1.107 1.00 0.00 S ATOM 1316 CE MET A 205 6.825 4.225 -2.640 1.00 0.00 C ATOM 0 H MET A 205 7.648 0.159 -3.023 1.00 0.00 H new ATOM 0 HA MET A 205 5.843 -0.424 -0.941 1.00 0.00 H new ATOM 0 HB2 MET A 205 7.056 1.479 -0.555 1.00 0.00 H new ATOM 0 HB3 MET A 205 7.043 1.968 -2.238 1.00 0.00 H new ATOM 0 HG2 MET A 205 4.526 2.429 -1.912 1.00 0.00 H new ATOM 0 HG3 MET A 205 4.836 2.277 -0.194 1.00 0.00 H new ATOM 0 HE1 MET A 205 6.897 5.245 -3.019 1.00 0.00 H new ATOM 0 HE2 MET A 205 7.826 3.833 -2.460 1.00 0.00 H new ATOM 0 HE3 MET A 205 6.318 3.600 -3.375 1.00 0.00 H new ATOM 1326 N GLU A 206 4.592 0.950 -3.661 1.00 0.00 N ATOM 1327 CA GLU A 206 3.375 1.125 -4.415 1.00 0.00 C ATOM 1328 C GLU A 206 2.723 -0.222 -4.571 1.00 0.00 C ATOM 1329 O GLU A 206 1.585 -0.400 -4.234 1.00 0.00 O ATOM 1330 CB GLU A 206 3.654 1.704 -5.800 1.00 0.00 C ATOM 1331 CG GLU A 206 4.572 2.913 -5.811 1.00 0.00 C ATOM 1332 CD GLU A 206 4.664 3.523 -7.196 1.00 0.00 C ATOM 1333 OE1 GLU A 206 5.266 2.885 -8.086 1.00 0.00 O ATOM 1334 OE2 GLU A 206 4.106 4.622 -7.414 1.00 0.00 O ATOM 0 H GLU A 206 5.422 1.353 -4.097 1.00 0.00 H new ATOM 0 HA GLU A 206 2.727 1.821 -3.882 1.00 0.00 H new ATOM 0 HB2 GLU A 206 4.095 0.925 -6.422 1.00 0.00 H new ATOM 0 HB3 GLU A 206 2.706 1.981 -6.260 1.00 0.00 H new ATOM 0 HG2 GLU A 206 4.203 3.659 -5.107 1.00 0.00 H new ATOM 0 HG3 GLU A 206 5.566 2.620 -5.474 1.00 0.00 H new ATOM 1341 N ARG A 207 3.526 -1.180 -4.959 1.00 0.00 N ATOM 1342 CA ARG A 207 3.061 -2.489 -5.373 1.00 0.00 C ATOM 1343 C ARG A 207 2.462 -3.258 -4.199 1.00 0.00 C ATOM 1344 O ARG A 207 1.515 -4.026 -4.369 1.00 0.00 O ATOM 1345 CB ARG A 207 4.227 -3.265 -6.031 1.00 0.00 C ATOM 1346 CG ARG A 207 5.239 -3.848 -5.063 1.00 0.00 C ATOM 1347 CD ARG A 207 4.826 -5.193 -4.534 1.00 0.00 C ATOM 1348 NE ARG A 207 4.855 -6.220 -5.565 1.00 0.00 N ATOM 1349 CZ ARG A 207 3.779 -6.716 -6.178 1.00 0.00 C ATOM 1350 NH1 ARG A 207 2.565 -6.271 -5.878 1.00 0.00 N ATOM 1351 NH2 ARG A 207 3.926 -7.653 -7.100 1.00 0.00 N ATOM 0 H ARG A 207 4.540 -1.075 -4.998 1.00 0.00 H new ATOM 0 HA ARG A 207 2.265 -2.370 -6.108 1.00 0.00 H new ATOM 0 HB2 ARG A 207 3.811 -4.075 -6.630 1.00 0.00 H new ATOM 0 HB3 ARG A 207 4.747 -2.596 -6.717 1.00 0.00 H new ATOM 0 HG2 ARG A 207 6.203 -3.939 -5.563 1.00 0.00 H new ATOM 0 HG3 ARG A 207 5.376 -3.160 -4.229 1.00 0.00 H new ATOM 0 HD2 ARG A 207 5.489 -5.480 -3.718 1.00 0.00 H new ATOM 0 HD3 ARG A 207 3.821 -5.125 -4.119 1.00 0.00 H new ATOM 0 HE ARG A 207 5.766 -6.588 -5.839 1.00 0.00 H new ATOM 0 HH11 ARG A 207 2.448 -5.543 -5.173 1.00 0.00 H new ATOM 0 HH12 ARG A 207 1.749 -6.657 -6.353 1.00 0.00 H new ATOM 0 HH21 ARG A 207 4.858 -7.992 -7.338 1.00 0.00 H new ATOM 0 HH22 ARG A 207 3.107 -8.036 -7.572 1.00 0.00 H new ATOM 1365 N VAL A 208 3.022 -3.069 -3.009 1.00 0.00 N ATOM 1366 CA VAL A 208 2.493 -3.714 -1.828 1.00 0.00 C ATOM 1367 C VAL A 208 1.230 -3.022 -1.387 1.00 0.00 C ATOM 1368 O VAL A 208 0.195 -3.650 -1.172 1.00 0.00 O ATOM 1369 CB VAL A 208 3.504 -3.705 -0.648 1.00 0.00 C ATOM 1370 CG1 VAL A 208 2.949 -4.438 0.543 1.00 0.00 C ATOM 1371 CG2 VAL A 208 4.819 -4.315 -1.055 1.00 0.00 C ATOM 0 H VAL A 208 3.836 -2.477 -2.844 1.00 0.00 H new ATOM 0 HA VAL A 208 2.291 -4.751 -2.096 1.00 0.00 H new ATOM 0 HB VAL A 208 3.673 -2.664 -0.372 1.00 0.00 H new ATOM 0 HG11 VAL A 208 3.676 -4.417 1.355 1.00 0.00 H new ATOM 0 HG12 VAL A 208 2.027 -3.957 0.869 1.00 0.00 H new ATOM 0 HG13 VAL A 208 2.741 -5.472 0.269 1.00 0.00 H new ATOM 0 HG21 VAL A 208 5.507 -4.295 -0.209 1.00 0.00 H new ATOM 0 HG22 VAL A 208 4.660 -5.347 -1.369 1.00 0.00 H new ATOM 0 HG23 VAL A 208 5.244 -3.746 -1.882 1.00 0.00 H new ATOM 1381 N VAL A 209 1.334 -1.722 -1.290 1.00 0.00 N ATOM 1382 CA VAL A 209 0.277 -0.896 -0.776 1.00 0.00 C ATOM 1383 C VAL A 209 -0.920 -0.889 -1.749 1.00 0.00 C ATOM 1384 O VAL A 209 -2.079 -0.926 -1.342 1.00 0.00 O ATOM 1385 CB VAL A 209 0.852 0.513 -0.521 1.00 0.00 C ATOM 1386 CG1 VAL A 209 0.554 1.474 -1.639 1.00 0.00 C ATOM 1387 CG2 VAL A 209 0.403 1.053 0.814 1.00 0.00 C ATOM 0 H VAL A 209 2.166 -1.203 -1.570 1.00 0.00 H new ATOM 0 HA VAL A 209 -0.104 -1.288 0.167 1.00 0.00 H new ATOM 0 HB VAL A 209 1.937 0.408 -0.492 1.00 0.00 H new ATOM 0 HG11 VAL A 209 0.982 2.449 -1.405 1.00 0.00 H new ATOM 0 HG12 VAL A 209 0.988 1.100 -2.566 1.00 0.00 H new ATOM 0 HG13 VAL A 209 -0.525 1.571 -1.757 1.00 0.00 H new ATOM 0 HG21 VAL A 209 0.824 2.047 0.965 1.00 0.00 H new ATOM 0 HG22 VAL A 209 -0.685 1.113 0.835 1.00 0.00 H new ATOM 0 HG23 VAL A 209 0.745 0.390 1.608 1.00 0.00 H new ATOM 1397 N GLU A 210 -0.595 -0.881 -3.032 1.00 0.00 N ATOM 1398 CA GLU A 210 -1.558 -0.901 -4.135 1.00 0.00 C ATOM 1399 C GLU A 210 -2.398 -2.163 -4.169 1.00 0.00 C ATOM 1400 O GLU A 210 -3.625 -2.088 -4.249 1.00 0.00 O ATOM 1401 CB GLU A 210 -0.795 -0.722 -5.456 1.00 0.00 C ATOM 1402 CG GLU A 210 -0.891 -1.865 -6.451 1.00 0.00 C ATOM 1403 CD GLU A 210 -0.310 -1.494 -7.798 1.00 0.00 C ATOM 1404 OE1 GLU A 210 -0.928 -0.672 -8.512 1.00 0.00 O ATOM 1405 OE2 GLU A 210 0.772 -2.009 -8.143 1.00 0.00 O ATOM 0 H GLU A 210 0.374 -0.860 -3.350 1.00 0.00 H new ATOM 0 HA GLU A 210 -2.260 -0.081 -3.984 1.00 0.00 H new ATOM 0 HB2 GLU A 210 -1.159 0.184 -5.940 1.00 0.00 H new ATOM 0 HB3 GLU A 210 0.257 -0.559 -5.223 1.00 0.00 H new ATOM 0 HG2 GLU A 210 -0.365 -2.734 -6.056 1.00 0.00 H new ATOM 0 HG3 GLU A 210 -1.935 -2.153 -6.573 1.00 0.00 H new ATOM 1412 N GLN A 211 -1.764 -3.322 -4.089 1.00 0.00 N ATOM 1413 CA GLN A 211 -2.503 -4.547 -4.284 1.00 0.00 C ATOM 1414 C GLN A 211 -3.235 -4.855 -3.005 1.00 0.00 C ATOM 1415 O GLN A 211 -4.210 -5.597 -2.977 1.00 0.00 O ATOM 1416 CB GLN A 211 -1.592 -5.723 -4.648 1.00 0.00 C ATOM 1417 CG GLN A 211 -0.899 -6.347 -3.440 1.00 0.00 C ATOM 1418 CD GLN A 211 -0.313 -7.719 -3.738 1.00 0.00 C ATOM 1419 OE1 GLN A 211 -0.217 -8.568 -2.851 1.00 0.00 O ATOM 1420 NE2 GLN A 211 0.062 -7.958 -4.985 1.00 0.00 N ATOM 0 H GLN A 211 -0.769 -3.435 -3.896 1.00 0.00 H new ATOM 0 HA GLN A 211 -3.194 -4.409 -5.116 1.00 0.00 H new ATOM 0 HB2 GLN A 211 -2.182 -6.487 -5.154 1.00 0.00 H new ATOM 0 HB3 GLN A 211 -0.836 -5.382 -5.356 1.00 0.00 H new ATOM 0 HG2 GLN A 211 -0.104 -5.683 -3.101 1.00 0.00 H new ATOM 0 HG3 GLN A 211 -1.614 -6.433 -2.621 1.00 0.00 H new ATOM 0 HE21 GLN A 211 -0.032 -7.231 -5.694 1.00 0.00 H new ATOM 0 HE22 GLN A 211 0.445 -8.869 -5.237 1.00 0.00 H new ATOM 1429 N MET A 212 -2.726 -4.290 -1.937 1.00 0.00 N ATOM 1430 CA MET A 212 -3.355 -4.380 -0.666 1.00 0.00 C ATOM 1431 C MET A 212 -4.601 -3.537 -0.639 1.00 0.00 C ATOM 1432 O MET A 212 -5.589 -3.894 -0.023 1.00 0.00 O ATOM 1433 CB MET A 212 -2.388 -3.926 0.390 1.00 0.00 C ATOM 1434 CG MET A 212 -2.428 -4.834 1.556 1.00 0.00 C ATOM 1435 SD MET A 212 -3.733 -4.431 2.715 1.00 0.00 S ATOM 1436 CE MET A 212 -3.431 -2.682 2.854 1.00 0.00 C ATOM 0 H MET A 212 -1.858 -3.754 -1.938 1.00 0.00 H new ATOM 0 HA MET A 212 -3.643 -5.413 -0.472 1.00 0.00 H new ATOM 0 HB2 MET A 212 -1.379 -3.897 -0.021 1.00 0.00 H new ATOM 0 HB3 MET A 212 -2.633 -2.911 0.704 1.00 0.00 H new ATOM 0 HG2 MET A 212 -2.563 -5.858 1.207 1.00 0.00 H new ATOM 0 HG3 MET A 212 -1.468 -4.797 2.071 1.00 0.00 H new ATOM 0 HE1 MET A 212 -3.292 -2.419 3.903 1.00 0.00 H new ATOM 0 HE2 MET A 212 -2.533 -2.422 2.293 1.00 0.00 H new ATOM 0 HE3 MET A 212 -4.282 -2.133 2.452 1.00 0.00 H new ATOM 1446 N CYS A 213 -4.535 -2.418 -1.320 1.00 0.00 N ATOM 1447 CA CYS A 213 -5.683 -1.546 -1.459 1.00 0.00 C ATOM 1448 C CYS A 213 -6.805 -2.271 -2.195 1.00 0.00 C ATOM 1449 O CYS A 213 -7.977 -2.089 -1.878 1.00 0.00 O ATOM 1450 CB CYS A 213 -5.294 -0.274 -2.205 1.00 0.00 C ATOM 1451 SG CYS A 213 -6.420 1.131 -1.936 1.00 0.00 S ATOM 0 H CYS A 213 -3.693 -2.086 -1.791 1.00 0.00 H new ATOM 0 HA CYS A 213 -6.037 -1.270 -0.466 1.00 0.00 H new ATOM 0 HB2 CYS A 213 -4.289 0.018 -1.900 1.00 0.00 H new ATOM 0 HB3 CYS A 213 -5.253 -0.492 -3.272 1.00 0.00 H new ATOM 1456 N VAL A 214 -6.450 -3.104 -3.181 1.00 0.00 N ATOM 1457 CA VAL A 214 -7.457 -3.896 -3.879 1.00 0.00 C ATOM 1458 C VAL A 214 -7.797 -5.171 -3.101 1.00 0.00 C ATOM 1459 O VAL A 214 -8.936 -5.640 -3.130 1.00 0.00 O ATOM 1460 CB VAL A 214 -7.072 -4.251 -5.335 1.00 0.00 C ATOM 1461 CG1 VAL A 214 -5.725 -4.943 -5.420 1.00 0.00 C ATOM 1462 CG2 VAL A 214 -8.154 -5.120 -5.947 1.00 0.00 C ATOM 0 H VAL A 214 -5.493 -3.242 -3.505 1.00 0.00 H new ATOM 0 HA VAL A 214 -8.339 -3.258 -3.935 1.00 0.00 H new ATOM 0 HB VAL A 214 -6.986 -3.320 -5.895 1.00 0.00 H new ATOM 0 HG11 VAL A 214 -5.499 -5.172 -6.461 1.00 0.00 H new ATOM 0 HG12 VAL A 214 -4.953 -4.288 -5.017 1.00 0.00 H new ATOM 0 HG13 VAL A 214 -5.754 -5.867 -4.843 1.00 0.00 H new ATOM 0 HG21 VAL A 214 -7.883 -5.370 -6.973 1.00 0.00 H new ATOM 0 HG22 VAL A 214 -8.257 -6.036 -5.365 1.00 0.00 H new ATOM 0 HG23 VAL A 214 -9.100 -4.579 -5.943 1.00 0.00 H new ATOM 1472 N THR A 215 -6.823 -5.727 -2.394 1.00 0.00 N ATOM 1473 CA THR A 215 -7.103 -6.822 -1.480 1.00 0.00 C ATOM 1474 C THR A 215 -8.107 -6.347 -0.444 1.00 0.00 C ATOM 1475 O THR A 215 -9.077 -7.035 -0.127 1.00 0.00 O ATOM 1476 CB THR A 215 -5.824 -7.329 -0.780 1.00 0.00 C ATOM 1477 OG1 THR A 215 -4.920 -7.871 -1.753 1.00 0.00 O ATOM 1478 CG2 THR A 215 -6.155 -8.390 0.260 1.00 0.00 C ATOM 0 H THR A 215 -5.845 -5.442 -2.435 1.00 0.00 H new ATOM 0 HA THR A 215 -7.510 -7.655 -2.053 1.00 0.00 H new ATOM 0 HB THR A 215 -5.354 -6.486 -0.273 1.00 0.00 H new ATOM 0 HG1 THR A 215 -4.658 -7.168 -2.384 1.00 0.00 H new ATOM 0 HG21 THR A 215 -5.236 -8.730 0.738 1.00 0.00 H new ATOM 0 HG22 THR A 215 -6.820 -7.967 1.012 1.00 0.00 H new ATOM 0 HG23 THR A 215 -6.646 -9.234 -0.225 1.00 0.00 H new ATOM 1486 N GLN A 216 -7.880 -5.148 0.064 1.00 0.00 N ATOM 1487 CA GLN A 216 -8.829 -4.524 0.954 1.00 0.00 C ATOM 1488 C GLN A 216 -10.004 -3.883 0.211 1.00 0.00 C ATOM 1489 O GLN A 216 -10.911 -3.372 0.838 1.00 0.00 O ATOM 1490 CB GLN A 216 -8.130 -3.513 1.849 1.00 0.00 C ATOM 1491 CG GLN A 216 -8.099 -3.915 3.316 1.00 0.00 C ATOM 1492 CD GLN A 216 -7.174 -5.086 3.607 1.00 0.00 C ATOM 1493 OE1 GLN A 216 -6.945 -5.954 2.764 1.00 0.00 O ATOM 1494 NE2 GLN A 216 -6.641 -5.124 4.819 1.00 0.00 N ATOM 0 H GLN A 216 -7.047 -4.592 -0.127 1.00 0.00 H new ATOM 0 HA GLN A 216 -9.253 -5.313 1.576 1.00 0.00 H new ATOM 0 HB2 GLN A 216 -7.108 -3.375 1.497 1.00 0.00 H new ATOM 0 HB3 GLN A 216 -8.632 -2.550 1.756 1.00 0.00 H new ATOM 0 HG2 GLN A 216 -7.785 -3.058 3.912 1.00 0.00 H new ATOM 0 HG3 GLN A 216 -9.109 -4.173 3.635 1.00 0.00 H new ATOM 0 HE21 GLN A 216 -6.853 -4.388 5.492 1.00 0.00 H new ATOM 0 HE22 GLN A 216 -6.019 -5.889 5.079 1.00 0.00 H new ATOM 1503 N TYR A 217 -9.991 -3.907 -1.114 1.00 0.00 N ATOM 1504 CA TYR A 217 -11.154 -3.489 -1.900 1.00 0.00 C ATOM 1505 C TYR A 217 -12.231 -4.544 -1.749 1.00 0.00 C ATOM 1506 O TYR A 217 -13.341 -4.254 -1.307 1.00 0.00 O ATOM 1507 CB TYR A 217 -10.758 -3.317 -3.379 1.00 0.00 C ATOM 1508 CG TYR A 217 -11.878 -2.927 -4.331 1.00 0.00 C ATOM 1509 CD1 TYR A 217 -12.889 -3.823 -4.671 1.00 0.00 C ATOM 1510 CD2 TYR A 217 -11.903 -1.666 -4.915 1.00 0.00 C ATOM 1511 CE1 TYR A 217 -13.891 -3.471 -5.556 1.00 0.00 C ATOM 1512 CE2 TYR A 217 -12.898 -1.311 -5.806 1.00 0.00 C ATOM 1513 CZ TYR A 217 -13.890 -2.216 -6.121 1.00 0.00 C ATOM 1514 OH TYR A 217 -14.878 -1.866 -7.013 1.00 0.00 O ATOM 0 H TYR A 217 -9.192 -4.210 -1.671 1.00 0.00 H new ATOM 0 HA TYR A 217 -11.529 -2.530 -1.543 1.00 0.00 H new ATOM 0 HB2 TYR A 217 -9.977 -2.559 -3.439 1.00 0.00 H new ATOM 0 HB3 TYR A 217 -10.321 -4.253 -3.728 1.00 0.00 H new ATOM 0 HD1 TYR A 217 -12.890 -4.811 -4.235 1.00 0.00 H new ATOM 0 HD2 TYR A 217 -11.132 -0.951 -4.668 1.00 0.00 H new ATOM 0 HE1 TYR A 217 -14.670 -4.177 -5.803 1.00 0.00 H new ATOM 0 HE2 TYR A 217 -12.899 -0.328 -6.254 1.00 0.00 H new ATOM 0 HH TYR A 217 -15.728 -1.763 -6.536 1.00 0.00 H new ATOM 1524 N GLN A 218 -11.877 -5.777 -2.081 1.00 0.00 N ATOM 1525 CA GLN A 218 -12.786 -6.901 -1.932 1.00 0.00 C ATOM 1526 C GLN A 218 -13.084 -7.153 -0.457 1.00 0.00 C ATOM 1527 O GLN A 218 -14.189 -7.559 -0.094 1.00 0.00 O ATOM 1528 CB GLN A 218 -12.197 -8.150 -2.595 1.00 0.00 C ATOM 1529 CG GLN A 218 -10.779 -8.477 -2.161 1.00 0.00 C ATOM 1530 CD GLN A 218 -10.201 -9.662 -2.907 1.00 0.00 C ATOM 1531 OE1 GLN A 218 -8.988 -9.756 -3.107 1.00 0.00 O ATOM 1532 NE2 GLN A 218 -11.066 -10.566 -3.335 1.00 0.00 N ATOM 0 H GLN A 218 -10.962 -6.024 -2.457 1.00 0.00 H new ATOM 0 HA GLN A 218 -13.726 -6.662 -2.430 1.00 0.00 H new ATOM 0 HB2 GLN A 218 -12.839 -9.002 -2.372 1.00 0.00 H new ATOM 0 HB3 GLN A 218 -12.212 -8.014 -3.676 1.00 0.00 H new ATOM 0 HG2 GLN A 218 -10.144 -7.606 -2.322 1.00 0.00 H new ATOM 0 HG3 GLN A 218 -10.769 -8.686 -1.091 1.00 0.00 H new ATOM 0 HE21 GLN A 218 -12.062 -10.448 -3.147 1.00 0.00 H new ATOM 0 HE22 GLN A 218 -10.738 -11.381 -3.853 1.00 0.00 H new ATOM 1541 N GLN A 219 -12.098 -6.887 0.395 1.00 0.00 N ATOM 1542 CA GLN A 219 -12.274 -7.026 1.830 1.00 0.00 C ATOM 1543 C GLN A 219 -13.231 -5.968 2.367 1.00 0.00 C ATOM 1544 O GLN A 219 -14.145 -6.285 3.111 1.00 0.00 O ATOM 1545 CB GLN A 219 -10.931 -6.930 2.553 1.00 0.00 C ATOM 1546 CG GLN A 219 -11.056 -6.992 4.065 1.00 0.00 C ATOM 1547 CD GLN A 219 -9.743 -7.306 4.751 1.00 0.00 C ATOM 1548 OE1 GLN A 219 -8.886 -8.054 4.074 1.00 0.00 O flip ATOM 1549 NE2 GLN A 219 -9.502 -6.888 5.884 1.00 0.00 N flip ATOM 0 H GLN A 219 -11.169 -6.574 0.112 1.00 0.00 H new ATOM 0 HA GLN A 219 -12.704 -8.010 2.018 1.00 0.00 H new ATOM 0 HB2 GLN A 219 -10.286 -7.741 2.215 1.00 0.00 H new ATOM 0 HB3 GLN A 219 -10.442 -5.997 2.274 1.00 0.00 H new ATOM 0 HG2 GLN A 219 -11.434 -6.038 4.433 1.00 0.00 H new ATOM 0 HG3 GLN A 219 -11.791 -7.751 4.333 1.00 0.00 H new ATOM 0 HE21 GLN A 219 -10.189 -6.314 6.373 1.00 0.00 H new ATOM 0 HE22 GLN A 219 -8.615 -7.116 6.334 1.00 0.00 H new ATOM 1558 N GLU A 220 -13.022 -4.717 1.971 1.00 0.00 N ATOM 1559 CA GLU A 220 -13.861 -3.607 2.421 1.00 0.00 C ATOM 1560 C GLU A 220 -15.274 -3.780 1.882 1.00 0.00 C ATOM 1561 O GLU A 220 -16.258 -3.429 2.534 1.00 0.00 O ATOM 1562 CB GLU A 220 -13.268 -2.287 1.930 1.00 0.00 C ATOM 1563 CG GLU A 220 -13.428 -1.127 2.889 1.00 0.00 C ATOM 1564 CD GLU A 220 -13.211 -1.509 4.338 1.00 0.00 C ATOM 1565 OE1 GLU A 220 -12.053 -1.729 4.733 1.00 0.00 O ATOM 1566 OE2 GLU A 220 -14.208 -1.566 5.088 1.00 0.00 O ATOM 0 H GLU A 220 -12.274 -4.443 1.335 1.00 0.00 H new ATOM 0 HA GLU A 220 -13.898 -3.597 3.510 1.00 0.00 H new ATOM 0 HB2 GLU A 220 -12.206 -2.433 1.731 1.00 0.00 H new ATOM 0 HB3 GLU A 220 -13.737 -2.024 0.982 1.00 0.00 H new ATOM 0 HG2 GLU A 220 -12.722 -0.342 2.619 1.00 0.00 H new ATOM 0 HG3 GLU A 220 -14.428 -0.709 2.777 1.00 0.00 H new ATOM 1573 N SER A 221 -15.356 -4.344 0.686 1.00 0.00 N ATOM 1574 CA SER A 221 -16.628 -4.679 0.074 1.00 0.00 C ATOM 1575 C SER A 221 -17.403 -5.670 0.937 1.00 0.00 C ATOM 1576 O SER A 221 -18.615 -5.547 1.117 1.00 0.00 O ATOM 1577 CB SER A 221 -16.389 -5.259 -1.317 1.00 0.00 C ATOM 1578 OG SER A 221 -15.921 -4.265 -2.217 1.00 0.00 O ATOM 0 H SER A 221 -14.544 -4.581 0.116 1.00 0.00 H new ATOM 0 HA SER A 221 -17.225 -3.771 -0.012 1.00 0.00 H new ATOM 0 HB2 SER A 221 -15.662 -6.069 -1.256 1.00 0.00 H new ATOM 0 HB3 SER A 221 -17.315 -5.690 -1.698 1.00 0.00 H new ATOM 0 HG SER A 221 -14.969 -4.098 -2.054 1.00 0.00 H new ATOM 1584 N GLN A 222 -16.697 -6.645 1.489 1.00 0.00 N ATOM 1585 CA GLN A 222 -17.328 -7.635 2.340 1.00 0.00 C ATOM 1586 C GLN A 222 -17.260 -7.193 3.798 1.00 0.00 C ATOM 1587 O GLN A 222 -17.827 -7.831 4.680 1.00 0.00 O ATOM 1588 CB GLN A 222 -16.664 -8.998 2.158 1.00 0.00 C ATOM 1589 CG GLN A 222 -15.553 -9.248 3.150 1.00 0.00 C ATOM 1590 CD GLN A 222 -14.828 -10.566 2.932 1.00 0.00 C ATOM 1591 OE1 GLN A 222 -15.539 -11.574 2.454 1.00 0.00 O flip ATOM 1592 NE2 GLN A 222 -13.633 -10.676 3.202 1.00 0.00 N flip ATOM 0 H GLN A 222 -15.693 -6.770 1.362 1.00 0.00 H new ATOM 0 HA GLN A 222 -18.376 -7.727 2.054 1.00 0.00 H new ATOM 0 HB2 GLN A 222 -17.417 -9.780 2.259 1.00 0.00 H new ATOM 0 HB3 GLN A 222 -16.264 -9.069 1.147 1.00 0.00 H new ATOM 0 HG2 GLN A 222 -14.833 -8.432 3.089 1.00 0.00 H new ATOM 0 HG3 GLN A 222 -15.967 -9.233 4.158 1.00 0.00 H new ATOM 0 HE21 GLN A 222 -13.117 -9.876 3.569 1.00 0.00 H new ATOM 0 HE22 GLN A 222 -13.158 -11.567 3.059 1.00 0.00 H new ATOM 1601 N ALA A 223 -16.558 -6.103 4.052 1.00 0.00 N ATOM 1602 CA ALA A 223 -16.614 -5.458 5.348 1.00 0.00 C ATOM 1603 C ALA A 223 -17.967 -4.794 5.472 1.00 0.00 C ATOM 1604 O ALA A 223 -18.510 -4.641 6.562 1.00 0.00 O ATOM 1605 CB ALA A 223 -15.483 -4.460 5.514 1.00 0.00 C ATOM 0 H ALA A 223 -15.943 -5.648 3.377 1.00 0.00 H new ATOM 0 HA ALA A 223 -16.489 -6.194 6.142 1.00 0.00 H new ATOM 0 HB1 ALA A 223 -15.552 -3.992 6.496 1.00 0.00 H new ATOM 0 HB2 ALA A 223 -14.527 -4.975 5.424 1.00 0.00 H new ATOM 0 HB3 ALA A 223 -15.557 -3.694 4.742 1.00 0.00 H new ATOM 1611 N ALA A 224 -18.521 -4.435 4.320 1.00 0.00 N ATOM 1612 CA ALA A 224 -19.906 -4.014 4.231 1.00 0.00 C ATOM 1613 C ALA A 224 -20.818 -5.227 4.391 1.00 0.00 C ATOM 1614 O ALA A 224 -22.028 -5.100 4.523 1.00 0.00 O ATOM 1615 CB ALA A 224 -20.165 -3.317 2.906 1.00 0.00 C ATOM 0 H ALA A 224 -18.024 -4.429 3.430 1.00 0.00 H new ATOM 0 HA ALA A 224 -20.118 -3.304 5.031 1.00 0.00 H new ATOM 0 HB1 ALA A 224 -21.209 -3.008 2.856 1.00 0.00 H new ATOM 0 HB2 ALA A 224 -19.522 -2.440 2.824 1.00 0.00 H new ATOM 0 HB3 ALA A 224 -19.950 -4.002 2.086 1.00 0.00 H new ATOM 1621 N TYR A 225 -20.219 -6.409 4.366 1.00 0.00 N ATOM 1622 CA TYR A 225 -20.935 -7.631 4.675 1.00 0.00 C ATOM 1623 C TYR A 225 -20.742 -7.985 6.148 1.00 0.00 C ATOM 1624 O TYR A 225 -21.419 -8.856 6.690 1.00 0.00 O ATOM 1625 CB TYR A 225 -20.483 -8.784 3.772 1.00 0.00 C ATOM 1626 CG TYR A 225 -20.991 -8.679 2.345 1.00 0.00 C ATOM 1627 CD1 TYR A 225 -22.270 -8.202 2.073 1.00 0.00 C ATOM 1628 CD2 TYR A 225 -20.192 -9.049 1.270 1.00 0.00 C ATOM 1629 CE1 TYR A 225 -22.736 -8.099 0.775 1.00 0.00 C ATOM 1630 CE2 TYR A 225 -20.651 -8.948 -0.032 1.00 0.00 C ATOM 1631 CZ TYR A 225 -21.922 -8.472 -0.273 1.00 0.00 C ATOM 1632 OH TYR A 225 -22.382 -8.372 -1.569 1.00 0.00 O ATOM 0 H TYR A 225 -19.235 -6.544 4.134 1.00 0.00 H new ATOM 0 HA TYR A 225 -21.996 -7.467 4.487 1.00 0.00 H new ATOM 0 HB2 TYR A 225 -19.394 -8.817 3.759 1.00 0.00 H new ATOM 0 HB3 TYR A 225 -20.825 -9.725 4.202 1.00 0.00 H new ATOM 0 HD1 TYR A 225 -22.910 -7.907 2.891 1.00 0.00 H new ATOM 0 HD2 TYR A 225 -19.195 -9.422 1.454 1.00 0.00 H new ATOM 0 HE1 TYR A 225 -23.732 -7.728 0.584 1.00 0.00 H new ATOM 0 HE2 TYR A 225 -20.016 -9.241 -0.855 1.00 0.00 H new ATOM 0 HH TYR A 225 -21.685 -8.674 -2.188 1.00 0.00 H new ATOM 1642 N GLN A 226 -19.798 -7.299 6.783 1.00 0.00 N ATOM 1643 CA GLN A 226 -19.531 -7.480 8.204 1.00 0.00 C ATOM 1644 C GLN A 226 -20.273 -6.436 9.034 1.00 0.00 C ATOM 1645 O GLN A 226 -21.141 -6.771 9.839 1.00 0.00 O ATOM 1646 CB GLN A 226 -18.027 -7.386 8.486 1.00 0.00 C ATOM 1647 CG GLN A 226 -17.215 -8.527 7.895 1.00 0.00 C ATOM 1648 CD GLN A 226 -17.526 -9.861 8.544 1.00 0.00 C ATOM 1649 OE1 GLN A 226 -18.414 -10.588 8.105 1.00 0.00 O ATOM 1650 NE2 GLN A 226 -16.792 -10.187 9.593 1.00 0.00 N ATOM 0 H GLN A 226 -19.201 -6.607 6.331 1.00 0.00 H new ATOM 0 HA GLN A 226 -19.886 -8.471 8.486 1.00 0.00 H new ATOM 0 HB2 GLN A 226 -17.652 -6.443 8.089 1.00 0.00 H new ATOM 0 HB3 GLN A 226 -17.871 -7.363 9.564 1.00 0.00 H new ATOM 0 HG2 GLN A 226 -17.413 -8.593 6.825 1.00 0.00 H new ATOM 0 HG3 GLN A 226 -16.153 -8.310 8.010 1.00 0.00 H new ATOM 0 HE21 GLN A 226 -16.065 -9.553 9.924 1.00 0.00 H new ATOM 0 HE22 GLN A 226 -16.952 -11.073 10.072 1.00 0.00 H new ATOM 1659 N ARG A 227 -19.943 -5.166 8.809 1.00 0.00 N ATOM 1660 CA ARG A 227 -20.484 -4.073 9.614 1.00 0.00 C ATOM 1661 C ARG A 227 -21.913 -3.738 9.200 1.00 0.00 C ATOM 1662 O ARG A 227 -22.648 -3.090 9.943 1.00 0.00 O ATOM 1663 CB ARG A 227 -19.597 -2.825 9.495 1.00 0.00 C ATOM 1664 CG ARG A 227 -19.540 -2.244 8.090 1.00 0.00 C ATOM 1665 CD ARG A 227 -18.685 -0.987 8.025 1.00 0.00 C ATOM 1666 NE ARG A 227 -17.275 -1.256 8.320 1.00 0.00 N ATOM 1667 CZ ARG A 227 -16.319 -1.337 7.391 1.00 0.00 C ATOM 1668 NH1 ARG A 227 -16.608 -1.165 6.107 1.00 0.00 N ATOM 1669 NH2 ARG A 227 -15.062 -1.575 7.737 1.00 0.00 N ATOM 0 H ARG A 227 -19.302 -4.868 8.074 1.00 0.00 H new ATOM 0 HA ARG A 227 -20.496 -4.401 10.653 1.00 0.00 H new ATOM 0 HB2 ARG A 227 -19.967 -2.061 10.179 1.00 0.00 H new ATOM 0 HB3 ARG A 227 -18.586 -3.077 9.815 1.00 0.00 H new ATOM 0 HG2 ARG A 227 -19.138 -2.991 7.405 1.00 0.00 H new ATOM 0 HG3 ARG A 227 -20.550 -2.013 7.753 1.00 0.00 H new ATOM 0 HD2 ARG A 227 -18.768 -0.545 7.032 1.00 0.00 H new ATOM 0 HD3 ARG A 227 -19.068 -0.253 8.734 1.00 0.00 H new ATOM 0 HE ARG A 227 -17.007 -1.390 9.295 1.00 0.00 H new ATOM 0 HH11 ARG A 227 -17.568 -0.969 5.822 1.00 0.00 H new ATOM 0 HH12 ARG A 227 -15.871 -1.229 5.405 1.00 0.00 H new ATOM 0 HH21 ARG A 227 -14.818 -1.698 8.720 1.00 0.00 H new ATOM 0 HH22 ARG A 227 -14.338 -1.635 7.021 1.00 0.00 H new ATOM 1683 N ALA A 228 -22.302 -4.179 8.015 1.00 0.00 N ATOM 1684 CA ALA A 228 -23.642 -3.924 7.517 1.00 0.00 C ATOM 1685 C ALA A 228 -24.424 -5.226 7.432 1.00 0.00 C ATOM 1686 O ALA A 228 -24.492 -5.816 6.337 1.00 0.00 O ATOM 1687 CB ALA A 228 -23.578 -3.236 6.164 1.00 0.00 C ATOM 0 H ALA A 228 -21.709 -4.715 7.381 1.00 0.00 H new ATOM 0 HA ALA A 228 -24.159 -3.260 8.210 1.00 0.00 H new ATOM 0 HB1 ALA A 228 -24.589 -3.051 5.802 1.00 0.00 H new ATOM 0 HB2 ALA A 228 -23.048 -2.288 6.262 1.00 0.00 H new ATOM 0 HB3 ALA A 228 -23.050 -3.875 5.456 1.00 0.00 H new TER 1693 ALA A 228