USER MOD reduce.3.24.130724 H: found=0, std=0, add=797, rem=0, adj=31 USER MOD reduce.3.24.130724 removed 803 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 114 SER OG : rot 125:sc= 1.2 USER MOD Set 1.2: A 138 SER OG : rot -170:sc= 1.06 USER MOD Set 2.1: A 32 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Set 2.2: A 134 SER OG : rot 180:sc= 0 USER MOD Set 3.1: A 88 TYR OH : rot 17:sc= 0.45! USER MOD Set 3.2: A 122 GLN : amide:sc= -4.33! C(o=-3.9!,f=-5.5!) USER MOD Set 4.1: A 12 GLN :FLIP amide:sc= -5.77! F(o=-16,f=-14!) USER MOD Set 4.2: A 25 ASN :FLIP amide:sc= -8.51! C(o=-16!,f=-14!) USER MOD Set 5.1: A 13 SER OG : rot -73:sc= 0.0861 USER MOD Set 5.2: A 147 THR OG1 : rot 180:sc= 0.0844 USER MOD Single : A 4 SER OG : rot 59:sc= 1.26 USER MOD Single : A 5 SER OG : rot 180:sc= -0.787 USER MOD Single : A 7 SER OG : rot 180:sc= 0 USER MOD Single : A 10 TYR OH : rot 180:sc= 0 USER MOD Single : A 16 LYS NZ :NH3+ -161:sc= -0.0348 (180deg=-0.534) USER MOD Single : A 30 ASN : amide:sc= -4.02! C(o=-4!,f=-4.6!) USER MOD Single : A 33 TYR OH : rot 180:sc= 0 USER MOD Single : A 35 TYR OH : rot 180:sc= 0 USER MOD Single : A 46 SER OG : rot 160:sc= -0.823 USER MOD Single : A 49 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 50 THR OG1 : rot -82:sc= -0.43 USER MOD Single : A 69 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 70 TYR OH : rot 180:sc= -0.166 USER MOD Single : A 71 TYR OH : rot 150:sc= -1.11 USER MOD Single : A 72 SER OG : rot 33:sc= 0.483 USER MOD Single : A 74 THR OG1 : rot 22:sc= 0.809 USER MOD Single : A 82 ASN : amide:sc= -0.215 X(o=-0.21,f=-0.35) USER MOD Single : A 84 TYR OH : rot 180:sc= 0 USER MOD Single : A 86 SER OG : rot 21:sc= -0.427 USER MOD Single : A 95 HIS :FLIP no HD1:sc= -1.15 F(o=-2!,f=-1.2) USER MOD Single : A 97 LYS NZ :NH3+ 161:sc= -0.0326 (180deg=-0.463) USER MOD Single : A 113 THR OG1 : rot -35:sc= 0.0842 USER MOD Single : A 117 TYR OH : rot 180:sc= 0 USER MOD Single : A 124 ASN : amide:sc= -6.19! C(o=-6.2!,f=-10!) USER MOD Single : A 126 HIS : no HD1:sc=-0.00946 X(o=-0.0095,f=-0.0095) USER MOD Single : A 128 ASN : amide:sc= -0.0424 K(o=-0.042,f=-1.8!) USER MOD Single : A 135 TYR OH : rot 180:sc= 0 USER MOD Single : A 137 TYR OH : rot 180:sc= 0 USER MOD Single : A 144 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 149 MET CE :methyl -158:sc= -0.0354 (180deg=-0.566) USER MOD Single : A 154 TYR OH : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 40 N SER A 4 20.945 0.105 6.140 1.00 0.00 N ATOM 41 CA SER A 4 19.842 0.437 5.246 1.00 0.00 C ATOM 42 C SER A 4 19.586 -0.702 4.264 1.00 0.00 C ATOM 43 O SER A 4 20.500 -1.451 3.917 1.00 0.00 O ATOM 44 CB SER A 4 20.163 1.716 4.474 1.00 0.00 C ATOM 45 OG SER A 4 19.082 2.024 3.605 1.00 0.00 O ATOM 0 HA SER A 4 18.946 0.591 5.847 1.00 0.00 H new ATOM 0 HB2 SER A 4 20.333 2.540 5.167 1.00 0.00 H new ATOM 0 HB3 SER A 4 21.081 1.587 3.900 1.00 0.00 H new ATOM 0 HG SER A 4 18.262 2.134 4.130 1.00 0.00 H new ATOM 51 N SER A 5 18.339 -0.830 3.820 1.00 0.00 N ATOM 52 CA SER A 5 17.990 -1.889 2.877 1.00 0.00 C ATOM 53 C SER A 5 16.946 -1.403 1.875 1.00 0.00 C ATOM 54 O SER A 5 16.245 -0.422 2.120 1.00 0.00 O ATOM 55 CB SER A 5 17.450 -3.110 3.627 1.00 0.00 C ATOM 56 OG SER A 5 16.207 -2.783 4.232 1.00 0.00 O ATOM 0 H SER A 5 17.564 -0.225 4.092 1.00 0.00 H new ATOM 0 HA SER A 5 18.893 -2.168 2.334 1.00 0.00 H new ATOM 0 HB2 SER A 5 17.323 -3.946 2.939 1.00 0.00 H new ATOM 0 HB3 SER A 5 18.164 -3.428 4.387 1.00 0.00 H new ATOM 0 HG SER A 5 15.860 -3.565 4.711 1.00 0.00 H new ATOM 62 N ILE A 6 16.860 -2.101 0.745 1.00 0.00 N ATOM 63 CA ILE A 6 15.912 -1.744 -0.307 1.00 0.00 C ATOM 64 C ILE A 6 14.917 -2.876 -0.542 1.00 0.00 C ATOM 65 O ILE A 6 15.307 -4.037 -0.690 1.00 0.00 O ATOM 66 CB ILE A 6 16.661 -1.446 -1.606 1.00 0.00 C ATOM 67 CG1 ILE A 6 17.618 -0.271 -1.386 1.00 0.00 C ATOM 68 CG2 ILE A 6 15.659 -1.086 -2.703 1.00 0.00 C ATOM 69 CD1 ILE A 6 18.540 -0.128 -2.597 1.00 0.00 C ATOM 0 H ILE A 6 17.435 -2.917 0.535 1.00 0.00 H new ATOM 0 HA ILE A 6 15.366 -0.856 0.011 1.00 0.00 H new ATOM 0 HB ILE A 6 17.228 -2.327 -1.907 1.00 0.00 H new ATOM 0 HG12 ILE A 6 17.053 0.649 -1.236 1.00 0.00 H new ATOM 0 HG13 ILE A 6 18.208 -0.433 -0.484 1.00 0.00 H new ATOM 0 HG21 ILE A 6 16.194 -0.874 -3.629 1.00 0.00 H new ATOM 0 HG22 ILE A 6 14.977 -1.921 -2.861 1.00 0.00 H new ATOM 0 HG23 ILE A 6 15.091 -0.206 -2.402 1.00 0.00 H new ATOM 0 HD11 ILE A 6 19.221 0.709 -2.439 1.00 0.00 H new ATOM 0 HD12 ILE A 6 19.115 -1.045 -2.726 1.00 0.00 H new ATOM 0 HD13 ILE A 6 17.942 0.054 -3.490 1.00 0.00 H new ATOM 81 N SER A 7 13.632 -2.532 -0.571 1.00 0.00 N ATOM 82 CA SER A 7 12.586 -3.525 -0.786 1.00 0.00 C ATOM 83 C SER A 7 11.568 -3.024 -1.806 1.00 0.00 C ATOM 84 O SER A 7 11.210 -1.847 -1.816 1.00 0.00 O ATOM 85 CB SER A 7 11.880 -3.835 0.534 1.00 0.00 C ATOM 86 OG SER A 7 10.836 -4.770 0.300 1.00 0.00 O ATOM 0 H SER A 7 13.292 -1.578 -0.449 1.00 0.00 H new ATOM 0 HA SER A 7 13.050 -4.433 -1.171 1.00 0.00 H new ATOM 0 HB2 SER A 7 12.591 -4.240 1.254 1.00 0.00 H new ATOM 0 HB3 SER A 7 11.474 -2.920 0.966 1.00 0.00 H new ATOM 0 HG SER A 7 10.382 -4.972 1.145 1.00 0.00 H new ATOM 92 N ILE A 8 11.111 -3.930 -2.665 1.00 0.00 N ATOM 93 CA ILE A 8 10.137 -3.581 -3.694 1.00 0.00 C ATOM 94 C ILE A 8 9.027 -4.626 -3.751 1.00 0.00 C ATOM 95 O ILE A 8 9.258 -5.803 -3.473 1.00 0.00 O ATOM 96 CB ILE A 8 10.826 -3.492 -5.056 1.00 0.00 C ATOM 97 CG1 ILE A 8 9.828 -2.986 -6.100 1.00 0.00 C ATOM 98 CG2 ILE A 8 11.332 -4.876 -5.464 1.00 0.00 C ATOM 99 CD1 ILE A 8 10.575 -2.605 -7.378 1.00 0.00 C ATOM 0 H ILE A 8 11.398 -4.909 -2.669 1.00 0.00 H new ATOM 0 HA ILE A 8 9.701 -2.614 -3.445 1.00 0.00 H new ATOM 0 HB ILE A 8 11.668 -2.802 -4.993 1.00 0.00 H new ATOM 0 HG12 ILE A 8 9.088 -3.757 -6.315 1.00 0.00 H new ATOM 0 HG13 ILE A 8 9.286 -2.123 -5.712 1.00 0.00 H new ATOM 0 HG21 ILE A 8 11.823 -4.812 -6.435 1.00 0.00 H new ATOM 0 HG22 ILE A 8 12.043 -5.237 -4.721 1.00 0.00 H new ATOM 0 HG23 ILE A 8 10.491 -5.567 -5.527 1.00 0.00 H new ATOM 0 HD11 ILE A 8 9.864 -2.245 -8.121 1.00 0.00 H new ATOM 0 HD12 ILE A 8 11.298 -1.820 -7.157 1.00 0.00 H new ATOM 0 HD13 ILE A 8 11.097 -3.479 -7.769 1.00 0.00 H new ATOM 111 N GLY A 9 7.823 -4.191 -4.109 1.00 0.00 N ATOM 112 CA GLY A 9 6.691 -5.105 -4.190 1.00 0.00 C ATOM 113 C GLY A 9 5.528 -4.473 -4.947 1.00 0.00 C ATOM 114 O GLY A 9 5.650 -3.374 -5.489 1.00 0.00 O ATOM 0 H GLY A 9 7.608 -3.222 -4.345 1.00 0.00 H new ATOM 0 HA2 GLY A 9 6.997 -6.024 -4.689 1.00 0.00 H new ATOM 0 HA3 GLY A 9 6.369 -5.380 -3.186 1.00 0.00 H new ATOM 118 N TYR A 10 4.404 -5.180 -4.983 1.00 0.00 N ATOM 119 CA TYR A 10 3.221 -4.686 -5.678 1.00 0.00 C ATOM 120 C TYR A 10 2.187 -4.181 -4.679 1.00 0.00 C ATOM 121 O TYR A 10 2.014 -4.759 -3.603 1.00 0.00 O ATOM 122 CB TYR A 10 2.611 -5.805 -6.526 1.00 0.00 C ATOM 123 CG TYR A 10 3.570 -6.182 -7.631 1.00 0.00 C ATOM 124 CD1 TYR A 10 3.519 -5.515 -8.859 1.00 0.00 C ATOM 125 CD2 TYR A 10 4.508 -7.200 -7.425 1.00 0.00 C ATOM 126 CE1 TYR A 10 4.408 -5.867 -9.884 1.00 0.00 C ATOM 127 CE2 TYR A 10 5.397 -7.551 -8.448 1.00 0.00 C ATOM 128 CZ TYR A 10 5.346 -6.885 -9.678 1.00 0.00 C ATOM 129 OH TYR A 10 6.221 -7.230 -10.687 1.00 0.00 O ATOM 0 H TYR A 10 4.287 -6.092 -4.542 1.00 0.00 H new ATOM 0 HA TYR A 10 3.518 -3.860 -6.325 1.00 0.00 H new ATOM 0 HB2 TYR A 10 2.399 -6.674 -5.902 1.00 0.00 H new ATOM 0 HB3 TYR A 10 1.662 -5.478 -6.950 1.00 0.00 H new ATOM 0 HD1 TYR A 10 2.795 -4.729 -9.018 1.00 0.00 H new ATOM 0 HD2 TYR A 10 4.546 -7.715 -6.476 1.00 0.00 H new ATOM 0 HE1 TYR A 10 4.369 -5.353 -10.833 1.00 0.00 H new ATOM 0 HE2 TYR A 10 6.122 -8.335 -8.288 1.00 0.00 H new ATOM 0 HH TYR A 10 6.806 -7.953 -10.379 1.00 0.00 H new ATOM 139 N ALA A 11 1.503 -3.096 -5.044 1.00 0.00 N ATOM 140 CA ALA A 11 0.484 -2.512 -4.178 1.00 0.00 C ATOM 141 C ALA A 11 -0.897 -2.677 -4.803 1.00 0.00 C ATOM 142 O ALA A 11 -1.091 -2.376 -5.982 1.00 0.00 O ATOM 143 CB ALA A 11 0.774 -1.027 -3.957 1.00 0.00 C ATOM 0 H ALA A 11 1.637 -2.607 -5.929 1.00 0.00 H new ATOM 0 HA ALA A 11 0.504 -3.029 -3.219 1.00 0.00 H new ATOM 0 HB1 ALA A 11 0.009 -0.599 -3.310 1.00 0.00 H new ATOM 0 HB2 ALA A 11 1.751 -0.913 -3.488 1.00 0.00 H new ATOM 0 HB3 ALA A 11 0.769 -0.509 -4.916 1.00 0.00 H new ATOM 149 N GLN A 12 -1.849 -3.159 -4.009 1.00 0.00 N ATOM 150 CA GLN A 12 -3.207 -3.365 -4.497 1.00 0.00 C ATOM 151 C GLN A 12 -4.214 -2.664 -3.587 1.00 0.00 C ATOM 152 O GLN A 12 -4.240 -2.910 -2.380 1.00 0.00 O ATOM 153 CB GLN A 12 -3.512 -4.864 -4.533 1.00 0.00 C ATOM 154 CG GLN A 12 -2.647 -5.537 -5.602 1.00 0.00 C ATOM 155 CD GLN A 12 -2.791 -7.053 -5.513 1.00 0.00 C ATOM 156 OE1 GLN A 12 -2.663 -7.776 -6.591 1.00 0.00 O flip ATOM 157 NE2 GLN A 12 -3.027 -7.592 -4.431 1.00 0.00 N flip ATOM 0 H GLN A 12 -1.706 -3.412 -3.031 1.00 0.00 H new ATOM 0 HA GLN A 12 -3.288 -2.945 -5.500 1.00 0.00 H new ATOM 0 HB2 GLN A 12 -3.315 -5.309 -3.558 1.00 0.00 H new ATOM 0 HB3 GLN A 12 -4.568 -5.026 -4.750 1.00 0.00 H new ATOM 0 HG2 GLN A 12 -2.945 -5.193 -6.592 1.00 0.00 H new ATOM 0 HG3 GLN A 12 -1.603 -5.254 -5.467 1.00 0.00 H new ATOM 0 HE21 GLN A 12 -3.127 -7.024 -3.589 1.00 0.00 H new ATOM 0 HE22 GLN A 12 -3.123 -8.606 -4.377 1.00 0.00 H new ATOM 166 N SER A 13 -5.043 -1.796 -4.170 1.00 0.00 N ATOM 167 CA SER A 13 -6.052 -1.075 -3.390 1.00 0.00 C ATOM 168 C SER A 13 -7.457 -1.431 -3.862 1.00 0.00 C ATOM 169 O SER A 13 -7.888 -0.996 -4.923 1.00 0.00 O ATOM 170 CB SER A 13 -5.833 0.432 -3.529 1.00 0.00 C ATOM 171 OG SER A 13 -4.575 0.778 -2.962 1.00 0.00 O ATOM 0 H SER A 13 -5.037 -1.577 -5.166 1.00 0.00 H new ATOM 0 HA SER A 13 -5.951 -1.366 -2.344 1.00 0.00 H new ATOM 0 HB2 SER A 13 -5.863 0.720 -4.580 1.00 0.00 H new ATOM 0 HB3 SER A 13 -6.633 0.975 -3.027 1.00 0.00 H new ATOM 0 HG SER A 13 -4.630 0.723 -1.985 1.00 0.00 H new ATOM 177 N ARG A 14 -8.181 -2.205 -3.060 1.00 0.00 N ATOM 178 CA ARG A 14 -9.538 -2.598 -3.427 1.00 0.00 C ATOM 179 C ARG A 14 -10.454 -1.382 -3.435 1.00 0.00 C ATOM 180 O ARG A 14 -10.426 -0.572 -2.507 1.00 0.00 O ATOM 181 CB ARG A 14 -10.066 -3.636 -2.432 1.00 0.00 C ATOM 182 CG ARG A 14 -11.458 -4.106 -2.864 1.00 0.00 C ATOM 183 CD ARG A 14 -11.945 -5.196 -1.908 1.00 0.00 C ATOM 184 NE ARG A 14 -13.266 -5.664 -2.308 1.00 0.00 N ATOM 185 CZ ARG A 14 -14.366 -5.014 -1.942 1.00 0.00 C ATOM 186 NH1 ARG A 14 -14.272 -3.931 -1.220 1.00 0.00 N ATOM 187 NH2 ARG A 14 -15.538 -5.456 -2.305 1.00 0.00 N ATOM 0 H ARG A 14 -7.857 -2.569 -2.164 1.00 0.00 H new ATOM 0 HA ARG A 14 -9.519 -3.033 -4.426 1.00 0.00 H new ATOM 0 HB2 ARG A 14 -9.384 -4.485 -2.382 1.00 0.00 H new ATOM 0 HB3 ARG A 14 -10.112 -3.205 -1.432 1.00 0.00 H new ATOM 0 HG2 ARG A 14 -12.154 -3.267 -2.862 1.00 0.00 H new ATOM 0 HG3 ARG A 14 -11.424 -4.490 -3.884 1.00 0.00 H new ATOM 0 HD2 ARG A 14 -11.242 -6.029 -1.906 1.00 0.00 H new ATOM 0 HD3 ARG A 14 -11.982 -4.807 -0.890 1.00 0.00 H new ATOM 0 HE ARG A 14 -13.348 -6.505 -2.879 1.00 0.00 H new ATOM 0 HH11 ARG A 14 -13.355 -3.584 -0.937 1.00 0.00 H new ATOM 0 HH12 ARG A 14 -15.115 -3.431 -0.938 1.00 0.00 H new ATOM 0 HH21 ARG A 14 -15.611 -6.302 -2.871 1.00 0.00 H new ATOM 0 HH22 ARG A 14 -16.381 -4.956 -2.023 1.00 0.00 H new ATOM 201 N VAL A 15 -11.255 -1.251 -4.497 1.00 0.00 N ATOM 202 CA VAL A 15 -12.160 -0.108 -4.616 1.00 0.00 C ATOM 203 C VAL A 15 -13.617 -0.539 -4.486 1.00 0.00 C ATOM 204 O VAL A 15 -14.085 -1.413 -5.214 1.00 0.00 O ATOM 205 CB VAL A 15 -11.951 0.574 -5.969 1.00 0.00 C ATOM 206 CG1 VAL A 15 -12.920 1.750 -6.106 1.00 0.00 C ATOM 207 CG2 VAL A 15 -10.512 1.089 -6.064 1.00 0.00 C ATOM 0 H VAL A 15 -11.295 -1.911 -5.274 1.00 0.00 H new ATOM 0 HA VAL A 15 -11.935 0.588 -3.808 1.00 0.00 H new ATOM 0 HB VAL A 15 -12.136 -0.144 -6.768 1.00 0.00 H new ATOM 0 HG11 VAL A 15 -12.770 2.235 -7.071 1.00 0.00 H new ATOM 0 HG12 VAL A 15 -13.945 1.386 -6.038 1.00 0.00 H new ATOM 0 HG13 VAL A 15 -12.736 2.468 -5.307 1.00 0.00 H new ATOM 0 HG21 VAL A 15 -10.362 1.575 -7.028 1.00 0.00 H new ATOM 0 HG22 VAL A 15 -10.329 1.806 -5.264 1.00 0.00 H new ATOM 0 HG23 VAL A 15 -9.819 0.253 -5.968 1.00 0.00 H new ATOM 217 N LYS A 16 -14.329 0.094 -3.556 1.00 0.00 N ATOM 218 CA LYS A 16 -15.737 -0.215 -3.338 1.00 0.00 C ATOM 219 C LYS A 16 -16.606 0.787 -4.088 1.00 0.00 C ATOM 220 O LYS A 16 -16.465 1.997 -3.912 1.00 0.00 O ATOM 221 CB LYS A 16 -16.060 -0.166 -1.842 1.00 0.00 C ATOM 222 CG LYS A 16 -17.527 -0.544 -1.614 1.00 0.00 C ATOM 223 CD LYS A 16 -17.829 -0.532 -0.115 1.00 0.00 C ATOM 224 CE LYS A 16 -19.284 -0.941 0.117 1.00 0.00 C ATOM 225 NZ LYS A 16 -20.190 0.062 -0.513 1.00 0.00 N ATOM 0 H LYS A 16 -13.955 0.820 -2.945 1.00 0.00 H new ATOM 0 HA LYS A 16 -15.942 -1.218 -3.711 1.00 0.00 H new ATOM 0 HB2 LYS A 16 -15.410 -0.851 -1.298 1.00 0.00 H new ATOM 0 HB3 LYS A 16 -15.868 0.833 -1.452 1.00 0.00 H new ATOM 0 HG2 LYS A 16 -18.180 0.158 -2.133 1.00 0.00 H new ATOM 0 HG3 LYS A 16 -17.728 -1.532 -2.028 1.00 0.00 H new ATOM 0 HD2 LYS A 16 -17.160 -1.217 0.407 1.00 0.00 H new ATOM 0 HD3 LYS A 16 -17.650 0.462 0.295 1.00 0.00 H new ATOM 0 HE2 LYS A 16 -19.467 -1.929 -0.307 1.00 0.00 H new ATOM 0 HE3 LYS A 16 -19.487 -1.010 1.186 1.00 0.00 H new ATOM 0 HZ1 LYS A 16 -21.141 -0.021 -0.100 1.00 0.00 H new ATOM 0 HZ2 LYS A 16 -19.821 1.019 -0.342 1.00 0.00 H new ATOM 0 HZ3 LYS A 16 -20.241 -0.111 -1.537 1.00 0.00 H new ATOM 369 N ASN A 25 -9.467 -5.109 -8.143 1.00 0.00 N ATOM 370 CA ASN A 25 -8.096 -4.850 -7.723 1.00 0.00 C ATOM 371 C ASN A 25 -7.343 -3.977 -8.747 1.00 0.00 C ATOM 372 O ASN A 25 -7.041 -4.445 -9.844 1.00 0.00 O ATOM 373 CB ASN A 25 -7.356 -6.180 -7.570 1.00 0.00 C ATOM 374 CG ASN A 25 -5.925 -5.933 -7.107 1.00 0.00 C ATOM 375 OD1 ASN A 25 -5.503 -4.708 -6.948 1.00 0.00 O flip ATOM 376 ND2 ASN A 25 -5.172 -6.880 -6.881 1.00 0.00 N flip ATOM 0 HA ASN A 25 -8.131 -4.314 -6.774 1.00 0.00 H new ATOM 0 HB2 ASN A 25 -7.875 -6.813 -6.850 1.00 0.00 H new ATOM 0 HB3 ASN A 25 -7.352 -6.714 -8.520 1.00 0.00 H new ATOM 0 HD21 ASN A 25 -5.504 -7.836 -7.006 1.00 0.00 H new ATOM 0 HD22 ASN A 25 -4.216 -6.708 -6.569 1.00 0.00 H new ATOM 383 N PRO A 26 -6.995 -2.750 -8.415 1.00 0.00 N ATOM 384 CA PRO A 26 -6.225 -1.861 -9.327 1.00 0.00 C ATOM 385 C PRO A 26 -4.726 -2.144 -9.243 1.00 0.00 C ATOM 386 O PRO A 26 -4.251 -2.710 -8.258 1.00 0.00 O ATOM 387 CB PRO A 26 -6.559 -0.465 -8.815 1.00 0.00 C ATOM 388 CG PRO A 26 -6.744 -0.643 -7.349 1.00 0.00 C ATOM 389 CD PRO A 26 -7.294 -2.058 -7.148 1.00 0.00 C ATOM 0 HA PRO A 26 -6.481 -2.001 -10.377 1.00 0.00 H new ATOM 0 HB2 PRO A 26 -5.757 0.240 -9.032 1.00 0.00 H new ATOM 0 HB3 PRO A 26 -7.462 -0.075 -9.285 1.00 0.00 H new ATOM 0 HG2 PRO A 26 -5.799 -0.516 -6.821 1.00 0.00 H new ATOM 0 HG3 PRO A 26 -7.434 0.101 -6.952 1.00 0.00 H new ATOM 0 HD2 PRO A 26 -6.817 -2.553 -6.302 1.00 0.00 H new ATOM 0 HD3 PRO A 26 -8.365 -2.043 -6.946 1.00 0.00 H new ATOM 397 N ARG A 27 -3.988 -1.751 -10.270 1.00 0.00 N ATOM 398 CA ARG A 27 -2.545 -1.974 -10.284 1.00 0.00 C ATOM 399 C ARG A 27 -1.807 -0.760 -9.733 1.00 0.00 C ATOM 400 O ARG A 27 -2.202 0.380 -9.976 1.00 0.00 O ATOM 401 CB ARG A 27 -2.079 -2.265 -11.713 1.00 0.00 C ATOM 402 CG ARG A 27 -2.308 -1.033 -12.592 1.00 0.00 C ATOM 403 CD ARG A 27 -2.027 -1.391 -14.051 1.00 0.00 C ATOM 404 NE ARG A 27 -2.269 -0.238 -14.911 1.00 0.00 N ATOM 405 CZ ARG A 27 -1.336 0.689 -15.098 1.00 0.00 C ATOM 406 NH1 ARG A 27 -0.179 0.579 -14.504 1.00 0.00 N ATOM 407 NH2 ARG A 27 -1.577 1.709 -15.876 1.00 0.00 N ATOM 0 H ARG A 27 -4.356 -1.281 -11.097 1.00 0.00 H new ATOM 0 HA ARG A 27 -2.320 -2.831 -9.649 1.00 0.00 H new ATOM 0 HB2 ARG A 27 -1.022 -2.533 -11.714 1.00 0.00 H new ATOM 0 HB3 ARG A 27 -2.624 -3.118 -12.117 1.00 0.00 H new ATOM 0 HG2 ARG A 27 -3.334 -0.681 -12.484 1.00 0.00 H new ATOM 0 HG3 ARG A 27 -1.656 -0.219 -12.274 1.00 0.00 H new ATOM 0 HD2 ARG A 27 -0.994 -1.723 -14.159 1.00 0.00 H new ATOM 0 HD3 ARG A 27 -2.663 -2.222 -14.358 1.00 0.00 H new ATOM 0 HE ARG A 27 -3.171 -0.142 -15.377 1.00 0.00 H new ATOM 0 HH11 ARG A 27 0.009 -0.219 -13.896 1.00 0.00 H new ATOM 0 HH12 ARG A 27 0.538 1.291 -14.647 1.00 0.00 H new ATOM 0 HH21 ARG A 27 -2.481 1.794 -16.340 1.00 0.00 H new ATOM 0 HH22 ARG A 27 -0.861 2.421 -16.020 1.00 0.00 H new ATOM 421 N GLY A 28 -0.729 -1.008 -8.991 1.00 0.00 N ATOM 422 CA GLY A 28 0.052 0.080 -8.417 1.00 0.00 C ATOM 423 C GLY A 28 1.460 -0.382 -8.060 1.00 0.00 C ATOM 424 O GLY A 28 1.756 -1.577 -8.084 1.00 0.00 O ATOM 0 H GLY A 28 -0.381 -1.943 -8.776 1.00 0.00 H new ATOM 0 HA2 GLY A 28 0.106 0.906 -9.126 1.00 0.00 H new ATOM 0 HA3 GLY A 28 -0.447 0.458 -7.525 1.00 0.00 H new ATOM 428 N PHE A 29 2.321 0.577 -7.727 1.00 0.00 N ATOM 429 CA PHE A 29 3.700 0.267 -7.367 1.00 0.00 C ATOM 430 C PHE A 29 3.929 0.495 -5.877 1.00 0.00 C ATOM 431 O PHE A 29 3.392 1.442 -5.294 1.00 0.00 O ATOM 432 CB PHE A 29 4.660 1.145 -8.172 1.00 0.00 C ATOM 433 CG PHE A 29 4.533 0.817 -9.641 1.00 0.00 C ATOM 434 CD1 PHE A 29 5.289 -0.222 -10.195 1.00 0.00 C ATOM 435 CD2 PHE A 29 3.657 1.554 -10.447 1.00 0.00 C ATOM 436 CE1 PHE A 29 5.172 -0.525 -11.556 1.00 0.00 C ATOM 437 CE2 PHE A 29 3.539 1.252 -11.810 1.00 0.00 C ATOM 438 CZ PHE A 29 4.296 0.212 -12.364 1.00 0.00 C ATOM 0 H PHE A 29 2.089 1.570 -7.699 1.00 0.00 H new ATOM 0 HA PHE A 29 3.888 -0.782 -7.596 1.00 0.00 H new ATOM 0 HB2 PHE A 29 4.435 2.198 -8.003 1.00 0.00 H new ATOM 0 HB3 PHE A 29 5.685 0.981 -7.839 1.00 0.00 H new ATOM 0 HD1 PHE A 29 5.963 -0.790 -9.572 1.00 0.00 H new ATOM 0 HD2 PHE A 29 3.073 2.355 -10.018 1.00 0.00 H new ATOM 0 HE1 PHE A 29 5.756 -1.326 -11.983 1.00 0.00 H new ATOM 0 HE2 PHE A 29 2.865 1.821 -12.433 1.00 0.00 H new ATOM 0 HZ PHE A 29 4.205 -0.022 -13.414 1.00 0.00 H new ATOM 448 N ASN A 30 4.725 -0.381 -5.270 1.00 0.00 N ATOM 449 CA ASN A 30 5.026 -0.281 -3.846 1.00 0.00 C ATOM 450 C ASN A 30 6.535 -0.261 -3.612 1.00 0.00 C ATOM 451 O ASN A 30 7.237 -1.214 -3.951 1.00 0.00 O ATOM 452 CB ASN A 30 4.412 -1.475 -3.112 1.00 0.00 C ATOM 453 CG ASN A 30 4.731 -1.400 -1.625 1.00 0.00 C ATOM 454 OD1 ASN A 30 4.356 -0.440 -0.953 1.00 0.00 O ATOM 455 ND2 ASN A 30 5.408 -2.369 -1.070 1.00 0.00 N ATOM 0 H ASN A 30 5.172 -1.167 -5.742 1.00 0.00 H new ATOM 0 HA ASN A 30 4.603 0.648 -3.464 1.00 0.00 H new ATOM 0 HB2 ASN A 30 3.332 -1.485 -3.259 1.00 0.00 H new ATOM 0 HB3 ASN A 30 4.799 -2.405 -3.528 1.00 0.00 H new ATOM 0 HD21 ASN A 30 5.628 -2.332 -0.075 1.00 0.00 H new ATOM 0 HD22 ASN A 30 5.716 -3.163 -1.632 1.00 0.00 H new ATOM 462 N LEU A 31 7.021 0.830 -3.023 1.00 0.00 N ATOM 463 CA LEU A 31 8.447 0.968 -2.734 1.00 0.00 C ATOM 464 C LEU A 31 8.665 1.292 -1.259 1.00 0.00 C ATOM 465 O LEU A 31 7.949 2.115 -0.688 1.00 0.00 O ATOM 466 CB LEU A 31 9.051 2.078 -3.597 1.00 0.00 C ATOM 467 CG LEU A 31 8.649 1.870 -5.059 1.00 0.00 C ATOM 468 CD1 LEU A 31 7.399 2.696 -5.373 1.00 0.00 C ATOM 469 CD2 LEU A 31 9.795 2.315 -5.969 1.00 0.00 C ATOM 0 H LEU A 31 6.452 1.627 -2.738 1.00 0.00 H new ATOM 0 HA LEU A 31 8.938 0.022 -2.964 1.00 0.00 H new ATOM 0 HB2 LEU A 31 8.705 3.051 -3.249 1.00 0.00 H new ATOM 0 HB3 LEU A 31 10.137 2.074 -3.504 1.00 0.00 H new ATOM 0 HG LEU A 31 8.436 0.815 -5.228 1.00 0.00 H new ATOM 0 HD11 LEU A 31 7.116 2.546 -6.415 1.00 0.00 H new ATOM 0 HD12 LEU A 31 6.582 2.379 -4.725 1.00 0.00 H new ATOM 0 HD13 LEU A 31 7.609 3.752 -5.203 1.00 0.00 H new ATOM 0 HD21 LEU A 31 9.511 2.168 -7.011 1.00 0.00 H new ATOM 0 HD22 LEU A 31 10.008 3.370 -5.797 1.00 0.00 H new ATOM 0 HD23 LEU A 31 10.685 1.725 -5.749 1.00 0.00 H new ATOM 481 N LYS A 32 9.657 0.647 -0.651 1.00 0.00 N ATOM 482 CA LYS A 32 9.958 0.885 0.757 1.00 0.00 C ATOM 483 C LYS A 32 11.460 1.046 0.980 1.00 0.00 C ATOM 484 O LYS A 32 12.270 0.404 0.309 1.00 0.00 O ATOM 485 CB LYS A 32 9.438 -0.275 1.610 1.00 0.00 C ATOM 486 CG LYS A 32 7.909 -0.279 1.598 1.00 0.00 C ATOM 487 CD LYS A 32 7.397 -1.441 2.453 1.00 0.00 C ATOM 488 CE LYS A 32 5.866 -1.436 2.463 1.00 0.00 C ATOM 489 NZ LYS A 32 5.372 -2.576 3.286 1.00 0.00 N ATOM 0 H LYS A 32 10.261 -0.038 -1.106 1.00 0.00 H new ATOM 0 HA LYS A 32 9.462 1.809 1.053 1.00 0.00 H new ATOM 0 HB2 LYS A 32 9.817 -1.221 1.224 1.00 0.00 H new ATOM 0 HB3 LYS A 32 9.803 -0.179 2.633 1.00 0.00 H new ATOM 0 HG2 LYS A 32 7.529 0.667 1.985 1.00 0.00 H new ATOM 0 HG3 LYS A 32 7.543 -0.376 0.576 1.00 0.00 H new ATOM 0 HD2 LYS A 32 7.765 -2.387 2.056 1.00 0.00 H new ATOM 0 HD3 LYS A 32 7.778 -1.352 3.471 1.00 0.00 H new ATOM 0 HE2 LYS A 32 5.497 -0.494 2.869 1.00 0.00 H new ATOM 0 HE3 LYS A 32 5.485 -1.516 1.445 1.00 0.00 H new ATOM 0 HZ1 LYS A 32 4.332 -2.574 3.294 1.00 0.00 H new ATOM 0 HZ2 LYS A 32 5.713 -3.471 2.880 1.00 0.00 H new ATOM 0 HZ3 LYS A 32 5.725 -2.480 4.259 1.00 0.00 H new ATOM 503 N TYR A 33 11.817 1.898 1.938 1.00 0.00 N ATOM 504 CA TYR A 33 13.221 2.133 2.264 1.00 0.00 C ATOM 505 C TYR A 33 13.439 1.943 3.762 1.00 0.00 C ATOM 506 O TYR A 33 12.626 2.382 4.572 1.00 0.00 O ATOM 507 CB TYR A 33 13.623 3.553 1.863 1.00 0.00 C ATOM 508 CG TYR A 33 13.451 3.723 0.372 1.00 0.00 C ATOM 509 CD1 TYR A 33 14.495 3.382 -0.497 1.00 0.00 C ATOM 510 CD2 TYR A 33 12.249 4.224 -0.142 1.00 0.00 C ATOM 511 CE1 TYR A 33 14.337 3.541 -1.879 1.00 0.00 C ATOM 512 CE2 TYR A 33 12.091 4.384 -1.524 1.00 0.00 C ATOM 513 CZ TYR A 33 13.134 4.042 -2.392 1.00 0.00 C ATOM 514 OH TYR A 33 12.978 4.198 -3.754 1.00 0.00 O ATOM 0 H TYR A 33 11.157 2.435 2.500 1.00 0.00 H new ATOM 0 HA TYR A 33 13.836 1.421 1.714 1.00 0.00 H new ATOM 0 HB2 TYR A 33 13.010 4.280 2.396 1.00 0.00 H new ATOM 0 HB3 TYR A 33 14.659 3.742 2.144 1.00 0.00 H new ATOM 0 HD1 TYR A 33 15.423 2.996 -0.101 1.00 0.00 H new ATOM 0 HD2 TYR A 33 11.443 4.487 0.528 1.00 0.00 H new ATOM 0 HE1 TYR A 33 15.142 3.278 -2.549 1.00 0.00 H new ATOM 0 HE2 TYR A 33 11.164 4.771 -1.920 1.00 0.00 H new ATOM 0 HH TYR A 33 12.085 4.555 -3.942 1.00 0.00 H new ATOM 524 N ARG A 34 14.537 1.283 4.122 1.00 0.00 N ATOM 525 CA ARG A 34 14.840 1.033 5.530 1.00 0.00 C ATOM 526 C ARG A 34 15.996 1.907 5.996 1.00 0.00 C ATOM 527 O ARG A 34 17.065 1.915 5.383 1.00 0.00 O ATOM 528 CB ARG A 34 15.211 -0.439 5.717 1.00 0.00 C ATOM 529 CG ARG A 34 15.450 -0.734 7.201 1.00 0.00 C ATOM 530 CD ARG A 34 15.748 -2.225 7.377 1.00 0.00 C ATOM 531 NE ARG A 34 16.006 -2.528 8.779 1.00 0.00 N ATOM 532 CZ ARG A 34 15.008 -2.731 9.633 1.00 0.00 C ATOM 533 NH1 ARG A 34 13.772 -2.652 9.220 1.00 0.00 N ATOM 534 NH2 ARG A 34 15.263 -3.009 10.882 1.00 0.00 N ATOM 0 H ARG A 34 15.226 0.915 3.466 1.00 0.00 H new ATOM 0 HA ARG A 34 13.958 1.274 6.124 1.00 0.00 H new ATOM 0 HB2 ARG A 34 14.413 -1.075 5.335 1.00 0.00 H new ATOM 0 HB3 ARG A 34 16.107 -0.673 5.142 1.00 0.00 H new ATOM 0 HG2 ARG A 34 16.284 -0.138 7.573 1.00 0.00 H new ATOM 0 HG3 ARG A 34 14.573 -0.455 7.785 1.00 0.00 H new ATOM 0 HD2 ARG A 34 14.905 -2.816 7.020 1.00 0.00 H new ATOM 0 HD3 ARG A 34 16.611 -2.504 6.773 1.00 0.00 H new ATOM 0 HE ARG A 34 16.969 -2.585 9.111 1.00 0.00 H new ATOM 0 HH11 ARG A 34 13.574 -2.435 8.243 1.00 0.00 H new ATOM 0 HH12 ARG A 34 13.005 -2.808 9.874 1.00 0.00 H new ATOM 0 HH21 ARG A 34 16.229 -3.071 11.204 1.00 0.00 H new ATOM 0 HH22 ARG A 34 14.496 -3.165 11.537 1.00 0.00 H new ATOM 548 N TYR A 35 15.779 2.630 7.093 1.00 0.00 N ATOM 549 CA TYR A 35 16.813 3.496 7.646 1.00 0.00 C ATOM 550 C TYR A 35 16.844 3.370 9.165 1.00 0.00 C ATOM 551 O TYR A 35 15.816 3.522 9.826 1.00 0.00 O ATOM 552 CB TYR A 35 16.543 4.950 7.255 1.00 0.00 C ATOM 553 CG TYR A 35 17.590 5.844 7.876 1.00 0.00 C ATOM 554 CD1 TYR A 35 18.863 5.934 7.302 1.00 0.00 C ATOM 555 CD2 TYR A 35 17.288 6.582 9.025 1.00 0.00 C ATOM 556 CE1 TYR A 35 19.835 6.762 7.877 1.00 0.00 C ATOM 557 CE2 TYR A 35 18.259 7.410 9.602 1.00 0.00 C ATOM 558 CZ TYR A 35 19.532 7.500 9.028 1.00 0.00 C ATOM 559 OH TYR A 35 20.489 8.316 9.594 1.00 0.00 O ATOM 0 H TYR A 35 14.901 2.632 7.612 1.00 0.00 H new ATOM 0 HA TYR A 35 17.779 3.191 7.243 1.00 0.00 H new ATOM 0 HB2 TYR A 35 16.558 5.054 6.170 1.00 0.00 H new ATOM 0 HB3 TYR A 35 15.550 5.249 7.590 1.00 0.00 H new ATOM 0 HD1 TYR A 35 19.096 5.364 6.415 1.00 0.00 H new ATOM 0 HD2 TYR A 35 16.305 6.513 9.468 1.00 0.00 H new ATOM 0 HE1 TYR A 35 20.817 6.831 7.433 1.00 0.00 H new ATOM 0 HE2 TYR A 35 18.025 7.979 10.490 1.00 0.00 H new ATOM 0 HH TYR A 35 20.116 8.757 10.385 1.00 0.00 H new ATOM 569 N GLU A 36 18.024 3.083 9.712 1.00 0.00 N ATOM 570 CA GLU A 36 18.171 2.931 11.157 1.00 0.00 C ATOM 571 C GLU A 36 19.149 3.958 11.717 1.00 0.00 C ATOM 572 O GLU A 36 20.331 3.956 11.371 1.00 0.00 O ATOM 573 CB GLU A 36 18.681 1.524 11.479 1.00 0.00 C ATOM 574 CG GLU A 36 17.593 0.497 11.163 1.00 0.00 C ATOM 575 CD GLU A 36 18.145 -0.914 11.324 1.00 0.00 C ATOM 576 OE1 GLU A 36 19.351 -1.045 11.456 1.00 0.00 O ATOM 577 OE2 GLU A 36 17.355 -1.843 11.315 1.00 0.00 O ATOM 0 H GLU A 36 18.885 2.952 9.181 1.00 0.00 H new ATOM 0 HA GLU A 36 17.195 3.089 11.617 1.00 0.00 H new ATOM 0 HB2 GLU A 36 19.577 1.309 10.897 1.00 0.00 H new ATOM 0 HB3 GLU A 36 18.961 1.460 12.531 1.00 0.00 H new ATOM 0 HG2 GLU A 36 16.741 0.641 11.828 1.00 0.00 H new ATOM 0 HG3 GLU A 36 17.231 0.641 10.145 1.00 0.00 H new ATOM 668 N GLY A 42 14.148 1.598 14.500 1.00 0.00 N ATOM 669 CA GLY A 42 14.357 2.404 13.299 1.00 0.00 C ATOM 670 C GLY A 42 13.030 2.876 12.713 1.00 0.00 C ATOM 671 O GLY A 42 11.984 2.788 13.358 1.00 0.00 O ATOM 0 HA2 GLY A 42 14.978 3.267 13.540 1.00 0.00 H new ATOM 0 HA3 GLY A 42 14.898 1.819 12.555 1.00 0.00 H new ATOM 675 N VAL A 43 13.083 3.378 11.482 1.00 0.00 N ATOM 676 CA VAL A 43 11.882 3.857 10.808 1.00 0.00 C ATOM 677 C VAL A 43 11.841 3.341 9.375 1.00 0.00 C ATOM 678 O VAL A 43 12.878 2.993 8.805 1.00 0.00 O ATOM 679 CB VAL A 43 11.858 5.387 10.804 1.00 0.00 C ATOM 680 CG1 VAL A 43 11.844 5.903 12.244 1.00 0.00 C ATOM 681 CG2 VAL A 43 13.103 5.912 10.085 1.00 0.00 C ATOM 0 H VAL A 43 13.940 3.463 10.935 1.00 0.00 H new ATOM 0 HA VAL A 43 11.009 3.485 11.345 1.00 0.00 H new ATOM 0 HB VAL A 43 10.964 5.735 10.287 1.00 0.00 H new ATOM 0 HG11 VAL A 43 11.827 6.993 12.240 1.00 0.00 H new ATOM 0 HG12 VAL A 43 10.958 5.528 12.756 1.00 0.00 H new ATOM 0 HG13 VAL A 43 12.737 5.556 12.763 1.00 0.00 H new ATOM 0 HG21 VAL A 43 13.088 7.002 10.081 1.00 0.00 H new ATOM 0 HG22 VAL A 43 13.996 5.563 10.603 1.00 0.00 H new ATOM 0 HG23 VAL A 43 13.112 5.545 9.059 1.00 0.00 H new ATOM 691 N ILE A 44 10.647 3.294 8.793 1.00 0.00 N ATOM 692 CA ILE A 44 10.503 2.819 7.421 1.00 0.00 C ATOM 693 C ILE A 44 9.524 3.702 6.651 1.00 0.00 C ATOM 694 O ILE A 44 8.446 4.030 7.145 1.00 0.00 O ATOM 695 CB ILE A 44 9.998 1.371 7.417 1.00 0.00 C ATOM 696 CG1 ILE A 44 10.149 0.770 6.017 1.00 0.00 C ATOM 697 CG2 ILE A 44 8.523 1.340 7.813 1.00 0.00 C ATOM 698 CD1 ILE A 44 9.876 -0.733 6.077 1.00 0.00 C ATOM 0 H ILE A 44 9.776 3.575 9.242 1.00 0.00 H new ATOM 0 HA ILE A 44 11.478 2.864 6.936 1.00 0.00 H new ATOM 0 HB ILE A 44 10.585 0.791 8.129 1.00 0.00 H new ATOM 0 HG12 ILE A 44 9.455 1.249 5.327 1.00 0.00 H new ATOM 0 HG13 ILE A 44 11.154 0.953 5.637 1.00 0.00 H new ATOM 0 HG21 ILE A 44 8.167 0.310 7.809 1.00 0.00 H new ATOM 0 HG22 ILE A 44 8.405 1.761 8.812 1.00 0.00 H new ATOM 0 HG23 ILE A 44 7.943 1.927 7.101 1.00 0.00 H new ATOM 0 HD11 ILE A 44 9.983 -1.162 5.081 1.00 0.00 H new ATOM 0 HD12 ILE A 44 10.588 -1.205 6.754 1.00 0.00 H new ATOM 0 HD13 ILE A 44 8.862 -0.904 6.439 1.00 0.00 H new ATOM 710 N GLY A 45 9.906 4.075 5.434 1.00 0.00 N ATOM 711 CA GLY A 45 9.051 4.910 4.599 1.00 0.00 C ATOM 712 C GLY A 45 8.410 4.071 3.505 1.00 0.00 C ATOM 713 O GLY A 45 9.089 3.283 2.846 1.00 0.00 O ATOM 0 H GLY A 45 10.795 3.815 5.007 1.00 0.00 H new ATOM 0 HA2 GLY A 45 8.278 5.378 5.209 1.00 0.00 H new ATOM 0 HA3 GLY A 45 9.637 5.715 4.155 1.00 0.00 H new ATOM 717 N SER A 46 7.102 4.233 3.319 1.00 0.00 N ATOM 718 CA SER A 46 6.387 3.469 2.301 1.00 0.00 C ATOM 719 C SER A 46 5.566 4.384 1.403 1.00 0.00 C ATOM 720 O SER A 46 4.936 5.333 1.871 1.00 0.00 O ATOM 721 CB SER A 46 5.464 2.455 2.973 1.00 0.00 C ATOM 722 OG SER A 46 6.242 1.556 3.752 1.00 0.00 O ATOM 0 H SER A 46 6.521 4.879 3.854 1.00 0.00 H new ATOM 0 HA SER A 46 7.122 2.951 1.685 1.00 0.00 H new ATOM 0 HB2 SER A 46 4.739 2.968 3.605 1.00 0.00 H new ATOM 0 HB3 SER A 46 4.898 1.906 2.220 1.00 0.00 H new ATOM 0 HG SER A 46 5.671 1.123 4.420 1.00 0.00 H new ATOM 728 N PHE A 47 5.567 4.075 0.112 1.00 0.00 N ATOM 729 CA PHE A 47 4.811 4.855 -0.858 1.00 0.00 C ATOM 730 C PHE A 47 4.006 3.921 -1.755 1.00 0.00 C ATOM 731 O PHE A 47 4.479 2.846 -2.122 1.00 0.00 O ATOM 732 CB PHE A 47 5.764 5.693 -1.711 1.00 0.00 C ATOM 733 CG PHE A 47 6.528 6.644 -0.822 1.00 0.00 C ATOM 734 CD1 PHE A 47 5.982 7.890 -0.499 1.00 0.00 C ATOM 735 CD2 PHE A 47 7.783 6.279 -0.320 1.00 0.00 C ATOM 736 CE1 PHE A 47 6.689 8.773 0.326 1.00 0.00 C ATOM 737 CE2 PHE A 47 8.490 7.160 0.506 1.00 0.00 C ATOM 738 CZ PHE A 47 7.944 8.409 0.829 1.00 0.00 C ATOM 0 H PHE A 47 6.083 3.290 -0.287 1.00 0.00 H new ATOM 0 HA PHE A 47 4.130 5.520 -0.326 1.00 0.00 H new ATOM 0 HB2 PHE A 47 6.456 5.044 -2.247 1.00 0.00 H new ATOM 0 HB3 PHE A 47 5.203 6.250 -2.461 1.00 0.00 H new ATOM 0 HD1 PHE A 47 5.014 8.172 -0.886 1.00 0.00 H new ATOM 0 HD2 PHE A 47 8.206 5.317 -0.570 1.00 0.00 H new ATOM 0 HE1 PHE A 47 6.266 9.735 0.575 1.00 0.00 H new ATOM 0 HE2 PHE A 47 9.457 6.877 0.895 1.00 0.00 H new ATOM 0 HZ PHE A 47 8.490 9.090 1.465 1.00 0.00 H new ATOM 748 N ALA A 48 2.793 4.331 -2.105 1.00 0.00 N ATOM 749 CA ALA A 48 1.953 3.500 -2.960 1.00 0.00 C ATOM 750 C ALA A 48 1.154 4.356 -3.935 1.00 0.00 C ATOM 751 O ALA A 48 0.639 5.415 -3.571 1.00 0.00 O ATOM 752 CB ALA A 48 0.993 2.675 -2.104 1.00 0.00 C ATOM 0 H ALA A 48 2.375 5.216 -1.817 1.00 0.00 H new ATOM 0 HA ALA A 48 2.602 2.835 -3.530 1.00 0.00 H new ATOM 0 HB1 ALA A 48 0.369 2.057 -2.750 1.00 0.00 H new ATOM 0 HB2 ALA A 48 1.564 2.035 -1.431 1.00 0.00 H new ATOM 0 HB3 ALA A 48 0.360 3.343 -1.520 1.00 0.00 H new ATOM 758 N GLN A 49 1.048 3.888 -5.174 1.00 0.00 N ATOM 759 CA GLN A 49 0.299 4.614 -6.192 1.00 0.00 C ATOM 760 C GLN A 49 -0.451 3.638 -7.093 1.00 0.00 C ATOM 761 O GLN A 49 0.144 2.717 -7.651 1.00 0.00 O ATOM 762 CB GLN A 49 1.257 5.470 -7.030 1.00 0.00 C ATOM 763 CG GLN A 49 0.463 6.293 -8.048 1.00 0.00 C ATOM 764 CD GLN A 49 1.412 7.154 -8.875 1.00 0.00 C ATOM 765 OE1 GLN A 49 2.317 6.631 -9.527 1.00 0.00 O ATOM 766 NE2 GLN A 49 1.261 8.451 -8.887 1.00 0.00 N ATOM 0 H GLN A 49 1.468 3.016 -5.496 1.00 0.00 H new ATOM 0 HA GLN A 49 -0.425 5.264 -5.701 1.00 0.00 H new ATOM 0 HB2 GLN A 49 1.830 6.132 -6.381 1.00 0.00 H new ATOM 0 HB3 GLN A 49 1.974 4.831 -7.545 1.00 0.00 H new ATOM 0 HG2 GLN A 49 -0.103 5.630 -8.702 1.00 0.00 H new ATOM 0 HG3 GLN A 49 -0.260 6.926 -7.533 1.00 0.00 H new ATOM 0 HE21 GLN A 49 0.511 8.882 -8.347 1.00 0.00 H new ATOM 0 HE22 GLN A 49 1.893 9.033 -9.437 1.00 0.00 H new ATOM 775 N THR A 50 -1.760 3.850 -7.232 1.00 0.00 N ATOM 776 CA THR A 50 -2.586 2.981 -8.073 1.00 0.00 C ATOM 777 C THR A 50 -3.408 3.813 -9.052 1.00 0.00 C ATOM 778 O THR A 50 -3.635 5.003 -8.834 1.00 0.00 O ATOM 779 CB THR A 50 -3.538 2.140 -7.210 1.00 0.00 C ATOM 780 OG1 THR A 50 -4.389 3.001 -6.468 1.00 0.00 O ATOM 781 CG2 THR A 50 -2.745 1.251 -6.247 1.00 0.00 C ATOM 0 H THR A 50 -2.268 4.609 -6.778 1.00 0.00 H new ATOM 0 HA THR A 50 -1.920 2.319 -8.626 1.00 0.00 H new ATOM 0 HB THR A 50 -4.135 1.504 -7.863 1.00 0.00 H new ATOM 0 HG1 THR A 50 -3.923 3.307 -5.662 1.00 0.00 H new ATOM 0 HG21 THR A 50 -3.436 0.662 -5.643 1.00 0.00 H new ATOM 0 HG22 THR A 50 -2.100 0.582 -6.817 1.00 0.00 H new ATOM 0 HG23 THR A 50 -2.134 1.875 -5.595 1.00 0.00 H new ATOM 789 N ARG A 51 -3.858 3.174 -10.129 1.00 0.00 N ATOM 790 CA ARG A 51 -4.661 3.863 -11.135 1.00 0.00 C ATOM 791 C ARG A 51 -5.490 2.860 -11.930 1.00 0.00 C ATOM 792 O ARG A 51 -5.192 1.666 -11.934 1.00 0.00 O ATOM 793 CB ARG A 51 -3.752 4.663 -12.074 1.00 0.00 C ATOM 794 CG ARG A 51 -2.827 3.714 -12.841 1.00 0.00 C ATOM 795 CD ARG A 51 -1.872 4.533 -13.711 1.00 0.00 C ATOM 796 NE ARG A 51 -0.975 3.649 -14.447 1.00 0.00 N ATOM 797 CZ ARG A 51 -0.031 4.139 -15.245 1.00 0.00 C ATOM 798 NH1 ARG A 51 0.106 5.429 -15.383 1.00 0.00 N ATOM 799 NH2 ARG A 51 0.762 3.327 -15.891 1.00 0.00 N ATOM 0 H ARG A 51 -3.682 2.189 -10.327 1.00 0.00 H new ATOM 0 HA ARG A 51 -5.340 4.551 -10.631 1.00 0.00 H new ATOM 0 HB2 ARG A 51 -4.356 5.240 -12.774 1.00 0.00 H new ATOM 0 HB3 ARG A 51 -3.160 5.376 -11.500 1.00 0.00 H new ATOM 0 HG2 ARG A 51 -2.262 3.096 -12.143 1.00 0.00 H new ATOM 0 HG3 ARG A 51 -3.415 3.038 -13.462 1.00 0.00 H new ATOM 0 HD2 ARG A 51 -2.441 5.148 -14.408 1.00 0.00 H new ATOM 0 HD3 ARG A 51 -1.292 5.213 -13.086 1.00 0.00 H new ATOM 0 HE ARG A 51 -1.074 2.639 -14.348 1.00 0.00 H new ATOM 0 HH11 ARG A 51 -0.512 6.064 -14.878 1.00 0.00 H new ATOM 0 HH12 ARG A 51 0.831 5.802 -15.996 1.00 0.00 H new ATOM 0 HH21 ARG A 51 0.657 2.318 -15.783 1.00 0.00 H new ATOM 0 HH22 ARG A 51 1.487 3.702 -16.503 1.00 0.00 H new ATOM 813 N ARG A 52 -6.533 3.345 -12.597 1.00 0.00 N ATOM 814 CA ARG A 52 -7.388 2.463 -13.381 1.00 0.00 C ATOM 815 C ARG A 52 -6.664 1.997 -14.640 1.00 0.00 C ATOM 816 O ARG A 52 -6.123 2.807 -15.392 1.00 0.00 O ATOM 817 CB ARG A 52 -8.676 3.191 -13.773 1.00 0.00 C ATOM 818 CG ARG A 52 -9.665 3.156 -12.603 1.00 0.00 C ATOM 819 CD ARG A 52 -9.075 3.904 -11.404 1.00 0.00 C ATOM 820 NE ARG A 52 -8.344 2.984 -10.540 1.00 0.00 N ATOM 821 CZ ARG A 52 -7.678 3.425 -9.477 1.00 0.00 C ATOM 822 NH1 ARG A 52 -7.674 4.699 -9.194 1.00 0.00 N ATOM 823 NH2 ARG A 52 -7.027 2.586 -8.720 1.00 0.00 N ATOM 0 H ARG A 52 -6.803 4.329 -12.611 1.00 0.00 H new ATOM 0 HA ARG A 52 -7.635 1.594 -12.772 1.00 0.00 H new ATOM 0 HB2 ARG A 52 -8.454 4.223 -14.043 1.00 0.00 H new ATOM 0 HB3 ARG A 52 -9.119 2.720 -14.651 1.00 0.00 H new ATOM 0 HG2 ARG A 52 -10.610 3.612 -12.899 1.00 0.00 H new ATOM 0 HG3 ARG A 52 -9.882 2.124 -12.329 1.00 0.00 H new ATOM 0 HD2 ARG A 52 -8.409 4.693 -11.752 1.00 0.00 H new ATOM 0 HD3 ARG A 52 -9.873 4.386 -10.840 1.00 0.00 H new ATOM 0 HE ARG A 52 -8.344 1.987 -10.755 1.00 0.00 H new ATOM 0 HH11 ARG A 52 -8.181 5.355 -9.788 1.00 0.00 H new ATOM 0 HH12 ARG A 52 -7.164 5.039 -8.379 1.00 0.00 H new ATOM 0 HH21 ARG A 52 -7.028 1.591 -8.943 1.00 0.00 H new ATOM 0 HH22 ARG A 52 -6.516 2.925 -7.905 1.00 0.00 H new ATOM 1051 N PHE A 68 -8.372 7.950 -13.019 1.00 0.00 N ATOM 1052 CA PHE A 68 -8.278 8.384 -11.631 1.00 0.00 C ATOM 1053 C PHE A 68 -6.908 8.031 -11.065 1.00 0.00 C ATOM 1054 O PHE A 68 -6.343 6.987 -11.398 1.00 0.00 O ATOM 1055 CB PHE A 68 -9.369 7.718 -10.790 1.00 0.00 C ATOM 1056 CG PHE A 68 -10.718 8.281 -11.174 1.00 0.00 C ATOM 1057 CD1 PHE A 68 -11.194 9.439 -10.551 1.00 0.00 C ATOM 1058 CD2 PHE A 68 -11.489 7.643 -12.151 1.00 0.00 C ATOM 1059 CE1 PHE A 68 -12.445 9.961 -10.905 1.00 0.00 C ATOM 1060 CE2 PHE A 68 -12.740 8.164 -12.506 1.00 0.00 C ATOM 1061 CZ PHE A 68 -13.217 9.323 -11.882 1.00 0.00 C ATOM 0 HA PHE A 68 -8.414 9.465 -11.596 1.00 0.00 H new ATOM 0 HB2 PHE A 68 -9.356 6.639 -10.947 1.00 0.00 H new ATOM 0 HB3 PHE A 68 -9.181 7.889 -9.730 1.00 0.00 H new ATOM 0 HD1 PHE A 68 -10.597 9.931 -9.797 1.00 0.00 H new ATOM 0 HD2 PHE A 68 -11.120 6.749 -12.632 1.00 0.00 H new ATOM 0 HE1 PHE A 68 -12.813 10.855 -10.424 1.00 0.00 H new ATOM 0 HE2 PHE A 68 -13.336 7.672 -13.260 1.00 0.00 H new ATOM 0 HZ PHE A 68 -14.182 9.725 -12.155 1.00 0.00 H new ATOM 1071 N LYS A 69 -6.375 8.908 -10.216 1.00 0.00 N ATOM 1072 CA LYS A 69 -5.065 8.681 -9.617 1.00 0.00 C ATOM 1073 C LYS A 69 -5.175 8.575 -8.102 1.00 0.00 C ATOM 1074 O LYS A 69 -5.958 9.291 -7.475 1.00 0.00 O ATOM 1075 CB LYS A 69 -4.122 9.828 -9.982 1.00 0.00 C ATOM 1076 CG LYS A 69 -3.894 9.840 -11.495 1.00 0.00 C ATOM 1077 CD LYS A 69 -2.949 10.987 -11.861 1.00 0.00 C ATOM 1078 CE LYS A 69 -2.724 10.998 -13.375 1.00 0.00 C ATOM 1079 NZ LYS A 69 -1.811 12.120 -13.731 1.00 0.00 N ATOM 0 H LYS A 69 -6.828 9.776 -9.930 1.00 0.00 H new ATOM 0 HA LYS A 69 -4.668 7.743 -10.005 1.00 0.00 H new ATOM 0 HB2 LYS A 69 -4.547 10.779 -9.660 1.00 0.00 H new ATOM 0 HB3 LYS A 69 -3.172 9.711 -9.461 1.00 0.00 H new ATOM 0 HG2 LYS A 69 -3.470 8.889 -11.817 1.00 0.00 H new ATOM 0 HG3 LYS A 69 -4.844 9.958 -12.016 1.00 0.00 H new ATOM 0 HD2 LYS A 69 -3.372 11.938 -11.538 1.00 0.00 H new ATOM 0 HD3 LYS A 69 -1.998 10.869 -11.342 1.00 0.00 H new ATOM 0 HE2 LYS A 69 -2.295 10.049 -13.697 1.00 0.00 H new ATOM 0 HE3 LYS A 69 -3.676 11.110 -13.894 1.00 0.00 H new ATOM 0 HZ1 LYS A 69 -1.657 12.129 -14.759 1.00 0.00 H new ATOM 0 HZ2 LYS A 69 -2.238 13.022 -13.437 1.00 0.00 H new ATOM 0 HZ3 LYS A 69 -0.900 11.994 -13.246 1.00 0.00 H new ATOM 1093 N TYR A 70 -4.385 7.677 -7.525 1.00 0.00 N ATOM 1094 CA TYR A 70 -4.390 7.474 -6.080 1.00 0.00 C ATOM 1095 C TYR A 70 -2.978 7.598 -5.523 1.00 0.00 C ATOM 1096 O TYR A 70 -2.060 6.916 -5.977 1.00 0.00 O ATOM 1097 CB TYR A 70 -4.951 6.090 -5.754 1.00 0.00 C ATOM 1098 CG TYR A 70 -4.876 5.851 -4.264 1.00 0.00 C ATOM 1099 CD1 TYR A 70 -5.807 6.454 -3.412 1.00 0.00 C ATOM 1100 CD2 TYR A 70 -3.876 5.023 -3.740 1.00 0.00 C ATOM 1101 CE1 TYR A 70 -5.737 6.230 -2.031 1.00 0.00 C ATOM 1102 CE2 TYR A 70 -3.806 4.800 -2.360 1.00 0.00 C ATOM 1103 CZ TYR A 70 -4.738 5.403 -1.505 1.00 0.00 C ATOM 1104 OH TYR A 70 -4.670 5.182 -0.145 1.00 0.00 O ATOM 0 H TYR A 70 -3.734 7.079 -8.034 1.00 0.00 H new ATOM 0 HA TYR A 70 -5.018 8.238 -5.621 1.00 0.00 H new ATOM 0 HB2 TYR A 70 -5.984 6.016 -6.093 1.00 0.00 H new ATOM 0 HB3 TYR A 70 -4.386 5.323 -6.284 1.00 0.00 H new ATOM 0 HD1 TYR A 70 -6.579 7.091 -3.818 1.00 0.00 H new ATOM 0 HD2 TYR A 70 -3.159 4.557 -4.400 1.00 0.00 H new ATOM 0 HE1 TYR A 70 -6.454 6.696 -1.372 1.00 0.00 H new ATOM 0 HE2 TYR A 70 -3.034 4.163 -1.954 1.00 0.00 H new ATOM 0 HH TYR A 70 -3.919 4.584 0.052 1.00 0.00 H new ATOM 1114 N TYR A 71 -2.815 8.475 -4.537 1.00 0.00 N ATOM 1115 CA TYR A 71 -1.514 8.691 -3.915 1.00 0.00 C ATOM 1116 C TYR A 71 -1.637 8.614 -2.398 1.00 0.00 C ATOM 1117 O TYR A 71 -2.491 9.273 -1.805 1.00 0.00 O ATOM 1118 CB TYR A 71 -0.968 10.061 -4.325 1.00 0.00 C ATOM 1119 CG TYR A 71 0.339 10.321 -3.616 1.00 0.00 C ATOM 1120 CD1 TYR A 71 1.504 9.662 -4.027 1.00 0.00 C ATOM 1121 CD2 TYR A 71 0.388 11.228 -2.551 1.00 0.00 C ATOM 1122 CE1 TYR A 71 2.716 9.909 -3.373 1.00 0.00 C ATOM 1123 CE2 TYR A 71 1.600 11.475 -1.897 1.00 0.00 C ATOM 1124 CZ TYR A 71 2.765 10.816 -2.307 1.00 0.00 C ATOM 1125 OH TYR A 71 3.960 11.059 -1.663 1.00 0.00 O ATOM 0 H TYR A 71 -3.567 9.047 -4.152 1.00 0.00 H new ATOM 0 HA TYR A 71 -0.827 7.914 -4.251 1.00 0.00 H new ATOM 0 HB2 TYR A 71 -0.820 10.096 -5.404 1.00 0.00 H new ATOM 0 HB3 TYR A 71 -1.689 10.840 -4.076 1.00 0.00 H new ATOM 0 HD1 TYR A 71 1.467 8.963 -4.849 1.00 0.00 H new ATOM 0 HD2 TYR A 71 -0.510 11.737 -2.234 1.00 0.00 H new ATOM 0 HE1 TYR A 71 3.614 9.400 -3.690 1.00 0.00 H new ATOM 0 HE2 TYR A 71 1.637 12.175 -1.075 1.00 0.00 H new ATOM 0 HH TYR A 71 3.966 11.977 -1.320 1.00 0.00 H new ATOM 1135 N SER A 72 -0.788 7.803 -1.775 1.00 0.00 N ATOM 1136 CA SER A 72 -0.828 7.650 -0.325 1.00 0.00 C ATOM 1137 C SER A 72 0.579 7.575 0.257 1.00 0.00 C ATOM 1138 O SER A 72 1.467 6.936 -0.312 1.00 0.00 O ATOM 1139 CB SER A 72 -1.600 6.383 0.042 1.00 0.00 C ATOM 1140 OG SER A 72 -1.618 6.238 1.455 1.00 0.00 O ATOM 0 H SER A 72 -0.072 7.248 -2.244 1.00 0.00 H new ATOM 0 HA SER A 72 -1.330 8.522 0.095 1.00 0.00 H new ATOM 0 HB2 SER A 72 -2.618 6.439 -0.342 1.00 0.00 H new ATOM 0 HB3 SER A 72 -1.133 5.512 -0.419 1.00 0.00 H new ATOM 0 HG SER A 72 -1.639 7.123 1.874 1.00 0.00 H new ATOM 1146 N VAL A 73 0.764 8.227 1.403 1.00 0.00 N ATOM 1147 CA VAL A 73 2.056 8.235 2.079 1.00 0.00 C ATOM 1148 C VAL A 73 1.902 7.724 3.505 1.00 0.00 C ATOM 1149 O VAL A 73 1.043 8.193 4.251 1.00 0.00 O ATOM 1150 CB VAL A 73 2.626 9.654 2.109 1.00 0.00 C ATOM 1151 CG1 VAL A 73 3.962 9.655 2.852 1.00 0.00 C ATOM 1152 CG2 VAL A 73 2.842 10.146 0.678 1.00 0.00 C ATOM 0 H VAL A 73 0.035 8.756 1.881 1.00 0.00 H new ATOM 0 HA VAL A 73 2.738 7.584 1.532 1.00 0.00 H new ATOM 0 HB VAL A 73 1.926 10.314 2.621 1.00 0.00 H new ATOM 0 HG11 VAL A 73 4.366 10.667 2.872 1.00 0.00 H new ATOM 0 HG12 VAL A 73 3.811 9.304 3.873 1.00 0.00 H new ATOM 0 HG13 VAL A 73 4.663 8.994 2.341 1.00 0.00 H new ATOM 0 HG21 VAL A 73 3.248 11.157 0.698 1.00 0.00 H new ATOM 0 HG22 VAL A 73 3.542 9.484 0.167 1.00 0.00 H new ATOM 0 HG23 VAL A 73 1.890 10.148 0.146 1.00 0.00 H new ATOM 1162 N THR A 74 2.731 6.757 3.883 1.00 0.00 N ATOM 1163 CA THR A 74 2.655 6.201 5.225 1.00 0.00 C ATOM 1164 C THR A 74 4.029 5.752 5.714 1.00 0.00 C ATOM 1165 O THR A 74 4.919 5.443 4.921 1.00 0.00 O ATOM 1166 CB THR A 74 1.691 5.012 5.245 1.00 0.00 C ATOM 1167 OG1 THR A 74 1.530 4.559 6.582 1.00 0.00 O ATOM 1168 CG2 THR A 74 2.254 3.879 4.385 1.00 0.00 C ATOM 0 H THR A 74 3.452 6.348 3.288 1.00 0.00 H new ATOM 0 HA THR A 74 2.289 6.981 5.892 1.00 0.00 H new ATOM 0 HB THR A 74 0.725 5.321 4.845 1.00 0.00 H new ATOM 0 HG1 THR A 74 1.769 5.279 7.202 1.00 0.00 H new ATOM 0 HG21 THR A 74 1.566 3.034 4.401 1.00 0.00 H new ATOM 0 HG22 THR A 74 2.377 4.227 3.360 1.00 0.00 H new ATOM 0 HG23 THR A 74 3.221 3.567 4.781 1.00 0.00 H new ATOM 1176 N ALA A 75 4.180 5.716 7.031 1.00 0.00 N ATOM 1177 CA ALA A 75 5.429 5.301 7.654 1.00 0.00 C ATOM 1178 C ALA A 75 5.120 4.524 8.923 1.00 0.00 C ATOM 1179 O ALA A 75 4.025 4.646 9.478 1.00 0.00 O ATOM 1180 CB ALA A 75 6.282 6.526 7.991 1.00 0.00 C ATOM 0 H ALA A 75 3.447 5.971 7.693 1.00 0.00 H new ATOM 0 HA ALA A 75 5.984 4.668 6.962 1.00 0.00 H new ATOM 0 HB1 ALA A 75 7.214 6.204 8.456 1.00 0.00 H new ATOM 0 HB2 ALA A 75 6.504 7.077 7.077 1.00 0.00 H new ATOM 0 HB3 ALA A 75 5.736 7.171 8.680 1.00 0.00 H new ATOM 1186 N GLY A 76 6.062 3.706 9.380 1.00 0.00 N ATOM 1187 CA GLY A 76 5.815 2.923 10.579 1.00 0.00 C ATOM 1188 C GLY A 76 7.096 2.633 11.367 1.00 0.00 C ATOM 1189 O GLY A 76 8.184 2.568 10.795 1.00 0.00 O ATOM 0 H GLY A 76 6.978 3.571 8.951 1.00 0.00 H new ATOM 0 HA2 GLY A 76 5.112 3.457 11.219 1.00 0.00 H new ATOM 0 HA3 GLY A 76 5.342 1.981 10.302 1.00 0.00 H new ATOM 1193 N PRO A 77 6.984 2.427 12.662 1.00 0.00 N ATOM 1194 CA PRO A 77 8.152 2.098 13.531 1.00 0.00 C ATOM 1195 C PRO A 77 8.565 0.637 13.382 1.00 0.00 C ATOM 1196 O PRO A 77 7.764 -0.198 12.960 1.00 0.00 O ATOM 1197 CB PRO A 77 7.627 2.364 14.939 1.00 0.00 C ATOM 1198 CG PRO A 77 6.172 2.058 14.854 1.00 0.00 C ATOM 1199 CD PRO A 77 5.735 2.485 13.455 1.00 0.00 C ATOM 0 HA PRO A 77 9.038 2.681 13.280 1.00 0.00 H new ATOM 0 HB2 PRO A 77 8.124 1.732 15.675 1.00 0.00 H new ATOM 0 HB3 PRO A 77 7.799 3.398 15.239 1.00 0.00 H new ATOM 0 HG2 PRO A 77 5.986 0.996 15.014 1.00 0.00 H new ATOM 0 HG3 PRO A 77 5.614 2.598 15.619 1.00 0.00 H new ATOM 0 HD2 PRO A 77 4.974 1.817 13.052 1.00 0.00 H new ATOM 0 HD3 PRO A 77 5.309 3.488 13.458 1.00 0.00 H new ATOM 1207 N VAL A 78 9.804 0.329 13.745 1.00 0.00 N ATOM 1208 CA VAL A 78 10.293 -1.044 13.662 1.00 0.00 C ATOM 1209 C VAL A 78 10.977 -1.446 14.965 1.00 0.00 C ATOM 1210 O VAL A 78 11.979 -0.848 15.363 1.00 0.00 O ATOM 1211 CB VAL A 78 11.278 -1.185 12.495 1.00 0.00 C ATOM 1212 CG1 VAL A 78 12.454 -0.236 12.704 1.00 0.00 C ATOM 1213 CG2 VAL A 78 11.802 -2.625 12.425 1.00 0.00 C ATOM 0 H VAL A 78 10.484 1.003 14.097 1.00 0.00 H new ATOM 0 HA VAL A 78 9.442 -1.703 13.493 1.00 0.00 H new ATOM 0 HB VAL A 78 10.765 -0.940 11.565 1.00 0.00 H new ATOM 0 HG11 VAL A 78 13.154 -0.336 11.875 1.00 0.00 H new ATOM 0 HG12 VAL A 78 12.090 0.790 12.749 1.00 0.00 H new ATOM 0 HG13 VAL A 78 12.960 -0.483 13.637 1.00 0.00 H new ATOM 0 HG21 VAL A 78 12.501 -2.718 11.594 1.00 0.00 H new ATOM 0 HG22 VAL A 78 12.311 -2.873 13.357 1.00 0.00 H new ATOM 0 HG23 VAL A 78 10.967 -3.309 12.275 1.00 0.00 H new ATOM 1223 N PHE A 79 10.434 -2.477 15.609 1.00 0.00 N ATOM 1224 CA PHE A 79 11.001 -2.980 16.857 1.00 0.00 C ATOM 1225 C PHE A 79 11.418 -4.436 16.688 1.00 0.00 C ATOM 1226 O PHE A 79 10.585 -5.293 16.391 1.00 0.00 O ATOM 1227 CB PHE A 79 9.972 -2.887 17.989 1.00 0.00 C ATOM 1228 CG PHE A 79 9.581 -1.447 18.224 1.00 0.00 C ATOM 1229 CD1 PHE A 79 10.415 -0.610 18.974 1.00 0.00 C ATOM 1230 CD2 PHE A 79 8.382 -0.954 17.699 1.00 0.00 C ATOM 1231 CE1 PHE A 79 10.048 0.723 19.200 1.00 0.00 C ATOM 1232 CE2 PHE A 79 8.014 0.377 17.925 1.00 0.00 C ATOM 1233 CZ PHE A 79 8.846 1.216 18.675 1.00 0.00 C ATOM 0 H PHE A 79 9.606 -2.978 15.288 1.00 0.00 H new ATOM 0 HA PHE A 79 11.870 -2.372 17.108 1.00 0.00 H new ATOM 0 HB2 PHE A 79 9.089 -3.474 17.736 1.00 0.00 H new ATOM 0 HB3 PHE A 79 10.387 -3.312 18.903 1.00 0.00 H new ATOM 0 HD1 PHE A 79 11.341 -0.991 19.378 1.00 0.00 H new ATOM 0 HD2 PHE A 79 7.740 -1.601 17.119 1.00 0.00 H new ATOM 0 HE1 PHE A 79 10.691 1.370 19.778 1.00 0.00 H new ATOM 0 HE2 PHE A 79 7.088 0.757 17.520 1.00 0.00 H new ATOM 0 HZ PHE A 79 8.562 2.243 18.849 1.00 0.00 H new ATOM 1243 N ARG A 80 12.702 -4.722 16.884 1.00 0.00 N ATOM 1244 CA ARG A 80 13.178 -6.095 16.750 1.00 0.00 C ATOM 1245 C ARG A 80 12.872 -6.884 18.020 1.00 0.00 C ATOM 1246 O ARG A 80 13.193 -6.448 19.126 1.00 0.00 O ATOM 1247 CB ARG A 80 14.684 -6.108 16.452 1.00 0.00 C ATOM 1248 CG ARG A 80 15.471 -5.619 17.671 1.00 0.00 C ATOM 1249 CD ARG A 80 16.941 -5.441 17.287 1.00 0.00 C ATOM 1250 NE ARG A 80 17.717 -5.007 18.443 1.00 0.00 N ATOM 1251 CZ ARG A 80 19.007 -4.708 18.331 1.00 0.00 C ATOM 1252 NH1 ARG A 80 19.602 -4.805 17.174 1.00 0.00 N ATOM 1253 NH2 ARG A 80 19.680 -4.319 19.380 1.00 0.00 N ATOM 0 H ARG A 80 13.418 -4.038 17.131 1.00 0.00 H new ATOM 0 HA ARG A 80 12.659 -6.569 15.917 1.00 0.00 H new ATOM 0 HB2 ARG A 80 15.001 -7.117 16.187 1.00 0.00 H new ATOM 0 HB3 ARG A 80 14.897 -5.471 15.593 1.00 0.00 H new ATOM 0 HG2 ARG A 80 15.060 -4.675 18.029 1.00 0.00 H new ATOM 0 HG3 ARG A 80 15.381 -6.335 18.487 1.00 0.00 H new ATOM 0 HD2 ARG A 80 17.340 -6.380 16.904 1.00 0.00 H new ATOM 0 HD3 ARG A 80 17.028 -4.707 16.486 1.00 0.00 H new ATOM 0 HE ARG A 80 17.262 -4.932 19.353 1.00 0.00 H new ATOM 0 HH11 ARG A 80 19.077 -5.110 16.355 1.00 0.00 H new ATOM 0 HH12 ARG A 80 20.592 -4.575 17.089 1.00 0.00 H new ATOM 0 HH21 ARG A 80 19.216 -4.245 20.285 1.00 0.00 H new ATOM 0 HH22 ARG A 80 20.670 -4.089 19.294 1.00 0.00 H new ATOM 1267 N ILE A 81 12.239 -8.045 17.862 1.00 0.00 N ATOM 1268 CA ILE A 81 11.902 -8.867 19.016 1.00 0.00 C ATOM 1269 C ILE A 81 13.029 -9.835 19.337 1.00 0.00 C ATOM 1270 O ILE A 81 13.492 -9.910 20.475 1.00 0.00 O ATOM 1271 CB ILE A 81 10.626 -9.664 18.750 1.00 0.00 C ATOM 1272 CG1 ILE A 81 9.443 -8.707 18.580 1.00 0.00 C ATOM 1273 CG2 ILE A 81 10.361 -10.600 19.931 1.00 0.00 C ATOM 1274 CD1 ILE A 81 8.229 -9.479 18.055 1.00 0.00 C ATOM 0 H ILE A 81 11.954 -8.430 16.962 1.00 0.00 H new ATOM 0 HA ILE A 81 11.747 -8.200 19.864 1.00 0.00 H new ATOM 0 HB ILE A 81 10.747 -10.248 17.838 1.00 0.00 H new ATOM 0 HG12 ILE A 81 9.203 -8.237 19.533 1.00 0.00 H new ATOM 0 HG13 ILE A 81 9.706 -7.907 17.887 1.00 0.00 H new ATOM 0 HG21 ILE A 81 9.451 -11.171 19.746 1.00 0.00 H new ATOM 0 HG22 ILE A 81 11.201 -11.284 20.049 1.00 0.00 H new ATOM 0 HG23 ILE A 81 10.242 -10.012 20.841 1.00 0.00 H new ATOM 0 HD11 ILE A 81 7.388 -8.796 17.935 1.00 0.00 H new ATOM 0 HD12 ILE A 81 8.472 -9.928 17.092 1.00 0.00 H new ATOM 0 HD13 ILE A 81 7.962 -10.263 18.764 1.00 0.00 H new ATOM 1286 N ASN A 82 13.456 -10.580 18.321 1.00 0.00 N ATOM 1287 CA ASN A 82 14.527 -11.559 18.496 1.00 0.00 C ATOM 1288 C ASN A 82 15.687 -11.266 17.555 1.00 0.00 C ATOM 1289 O ASN A 82 16.528 -12.129 17.309 1.00 0.00 O ATOM 1290 CB ASN A 82 13.993 -12.966 18.224 1.00 0.00 C ATOM 1291 CG ASN A 82 12.834 -13.277 19.166 1.00 0.00 C ATOM 1292 OD1 ASN A 82 11.724 -13.559 18.713 1.00 0.00 O ATOM 1293 ND2 ASN A 82 13.024 -13.240 20.456 1.00 0.00 N ATOM 0 H ASN A 82 13.081 -10.526 17.374 1.00 0.00 H new ATOM 0 HA ASN A 82 14.886 -11.494 19.523 1.00 0.00 H new ATOM 0 HB2 ASN A 82 13.661 -13.044 17.189 1.00 0.00 H new ATOM 0 HB3 ASN A 82 14.789 -13.698 18.360 1.00 0.00 H new ATOM 0 HD21 ASN A 82 12.253 -13.445 21.091 1.00 0.00 H new ATOM 0 HD22 ASN A 82 13.944 -13.006 20.830 1.00 0.00 H new ATOM 1300 N GLU A 83 15.720 -10.054 17.020 1.00 0.00 N ATOM 1301 CA GLU A 83 16.776 -9.675 16.093 1.00 0.00 C ATOM 1302 C GLU A 83 16.513 -10.303 14.729 1.00 0.00 C ATOM 1303 O GLU A 83 17.019 -9.834 13.710 1.00 0.00 O ATOM 1304 CB GLU A 83 18.136 -10.142 16.620 1.00 0.00 C ATOM 1305 CG GLU A 83 19.223 -9.161 16.177 1.00 0.00 C ATOM 1306 CD GLU A 83 20.586 -9.637 16.669 1.00 0.00 C ATOM 1307 OE1 GLU A 83 20.624 -10.326 17.674 1.00 0.00 O ATOM 1308 OE2 GLU A 83 21.573 -9.301 16.034 1.00 0.00 O ATOM 0 H GLU A 83 15.035 -9.323 17.209 1.00 0.00 H new ATOM 0 HA GLU A 83 16.787 -8.589 15.997 1.00 0.00 H new ATOM 0 HB2 GLU A 83 18.113 -10.208 17.708 1.00 0.00 H new ATOM 0 HB3 GLU A 83 18.359 -11.141 16.245 1.00 0.00 H new ATOM 0 HG2 GLU A 83 19.228 -9.077 15.090 1.00 0.00 H new ATOM 0 HG3 GLU A 83 19.011 -8.168 16.572 1.00 0.00 H new ATOM 1315 N TYR A 84 15.708 -11.364 14.721 1.00 0.00 N ATOM 1316 CA TYR A 84 15.370 -12.048 13.480 1.00 0.00 C ATOM 1317 C TYR A 84 13.953 -11.691 13.046 1.00 0.00 C ATOM 1318 O TYR A 84 13.606 -11.823 11.872 1.00 0.00 O ATOM 1319 CB TYR A 84 15.483 -13.563 13.660 1.00 0.00 C ATOM 1320 CG TYR A 84 16.913 -13.933 13.971 1.00 0.00 C ATOM 1321 CD1 TYR A 84 17.856 -14.014 12.939 1.00 0.00 C ATOM 1322 CD2 TYR A 84 17.298 -14.196 15.292 1.00 0.00 C ATOM 1323 CE1 TYR A 84 19.183 -14.356 13.228 1.00 0.00 C ATOM 1324 CE2 TYR A 84 18.624 -14.539 15.580 1.00 0.00 C ATOM 1325 CZ TYR A 84 19.566 -14.619 14.548 1.00 0.00 C ATOM 1326 OH TYR A 84 20.874 -14.957 14.834 1.00 0.00 O ATOM 0 H TYR A 84 15.281 -11.765 15.556 1.00 0.00 H new ATOM 0 HA TYR A 84 16.071 -11.726 12.710 1.00 0.00 H new ATOM 0 HB2 TYR A 84 14.828 -13.893 14.467 1.00 0.00 H new ATOM 0 HB3 TYR A 84 15.154 -14.072 12.754 1.00 0.00 H new ATOM 0 HD1 TYR A 84 17.560 -13.813 11.920 1.00 0.00 H new ATOM 0 HD2 TYR A 84 16.571 -14.134 16.089 1.00 0.00 H new ATOM 0 HE1 TYR A 84 19.911 -14.417 12.432 1.00 0.00 H new ATOM 0 HE2 TYR A 84 18.920 -14.742 16.599 1.00 0.00 H new ATOM 0 HH TYR A 84 20.970 -15.106 15.798 1.00 0.00 H new ATOM 1336 N VAL A 85 13.141 -11.226 13.995 1.00 0.00 N ATOM 1337 CA VAL A 85 11.770 -10.840 13.686 1.00 0.00 C ATOM 1338 C VAL A 85 11.465 -9.482 14.305 1.00 0.00 C ATOM 1339 O VAL A 85 11.972 -9.154 15.382 1.00 0.00 O ATOM 1340 CB VAL A 85 10.791 -11.890 14.221 1.00 0.00 C ATOM 1341 CG1 VAL A 85 11.054 -13.239 13.545 1.00 0.00 C ATOM 1342 CG2 VAL A 85 10.976 -12.043 15.733 1.00 0.00 C ATOM 0 H VAL A 85 13.407 -11.109 14.973 1.00 0.00 H new ATOM 0 HA VAL A 85 11.657 -10.774 12.604 1.00 0.00 H new ATOM 0 HB VAL A 85 9.772 -11.567 14.006 1.00 0.00 H new ATOM 0 HG11 VAL A 85 10.355 -13.981 13.930 1.00 0.00 H new ATOM 0 HG12 VAL A 85 10.920 -13.138 12.468 1.00 0.00 H new ATOM 0 HG13 VAL A 85 12.075 -13.559 13.756 1.00 0.00 H new ATOM 0 HG21 VAL A 85 10.278 -12.790 16.111 1.00 0.00 H new ATOM 0 HG22 VAL A 85 11.997 -12.360 15.944 1.00 0.00 H new ATOM 0 HG23 VAL A 85 10.784 -11.088 16.222 1.00 0.00 H new ATOM 1352 N SER A 86 10.644 -8.694 13.611 1.00 0.00 N ATOM 1353 CA SER A 86 10.287 -7.363 14.094 1.00 0.00 C ATOM 1354 C SER A 86 8.818 -7.047 13.817 1.00 0.00 C ATOM 1355 O SER A 86 8.233 -7.559 12.861 1.00 0.00 O ATOM 1356 CB SER A 86 11.166 -6.313 13.418 1.00 0.00 C ATOM 1357 OG SER A 86 10.818 -5.025 13.909 1.00 0.00 O ATOM 0 H SER A 86 10.218 -8.952 12.721 1.00 0.00 H new ATOM 0 HA SER A 86 10.447 -7.344 15.172 1.00 0.00 H new ATOM 0 HB2 SER A 86 12.218 -6.519 13.617 1.00 0.00 H new ATOM 0 HB3 SER A 86 11.033 -6.351 12.337 1.00 0.00 H new ATOM 0 HG SER A 86 10.362 -5.116 14.772 1.00 0.00 H new ATOM 1363 N LEU A 87 8.232 -6.193 14.653 1.00 0.00 N ATOM 1364 CA LEU A 87 6.835 -5.804 14.481 1.00 0.00 C ATOM 1365 C LEU A 87 6.743 -4.415 13.857 1.00 0.00 C ATOM 1366 O LEU A 87 7.504 -3.513 14.214 1.00 0.00 O ATOM 1367 CB LEU A 87 6.119 -5.797 15.835 1.00 0.00 C ATOM 1368 CG LEU A 87 6.217 -7.179 16.484 1.00 0.00 C ATOM 1369 CD1 LEU A 87 5.542 -7.144 17.857 1.00 0.00 C ATOM 1370 CD2 LEU A 87 5.520 -8.220 15.604 1.00 0.00 C ATOM 0 H LEU A 87 8.699 -5.760 15.450 1.00 0.00 H new ATOM 0 HA LEU A 87 6.357 -6.527 13.820 1.00 0.00 H new ATOM 0 HB2 LEU A 87 6.565 -5.047 16.488 1.00 0.00 H new ATOM 0 HB3 LEU A 87 5.073 -5.522 15.701 1.00 0.00 H new ATOM 0 HG LEU A 87 7.267 -7.448 16.595 1.00 0.00 H new ATOM 0 HD11 LEU A 87 5.611 -8.128 18.321 1.00 0.00 H new ATOM 0 HD12 LEU A 87 6.040 -6.409 18.489 1.00 0.00 H new ATOM 0 HD13 LEU A 87 4.493 -6.870 17.740 1.00 0.00 H new ATOM 0 HD21 LEU A 87 5.594 -9.201 16.073 1.00 0.00 H new ATOM 0 HD22 LEU A 87 4.470 -7.953 15.486 1.00 0.00 H new ATOM 0 HD23 LEU A 87 5.999 -8.248 14.625 1.00 0.00 H new ATOM 1382 N TYR A 88 5.807 -4.254 12.922 1.00 0.00 N ATOM 1383 CA TYR A 88 5.615 -2.974 12.244 1.00 0.00 C ATOM 1384 C TYR A 88 4.197 -2.444 12.436 1.00 0.00 C ATOM 1385 O TYR A 88 3.225 -3.197 12.360 1.00 0.00 O ATOM 1386 CB TYR A 88 5.867 -3.131 10.744 1.00 0.00 C ATOM 1387 CG TYR A 88 7.347 -3.193 10.459 1.00 0.00 C ATOM 1388 CD1 TYR A 88 8.056 -4.382 10.650 1.00 0.00 C ATOM 1389 CD2 TYR A 88 8.005 -2.054 9.978 1.00 0.00 C ATOM 1390 CE1 TYR A 88 9.425 -4.434 10.357 1.00 0.00 C ATOM 1391 CE2 TYR A 88 9.372 -2.105 9.689 1.00 0.00 C ATOM 1392 CZ TYR A 88 10.082 -3.295 9.877 1.00 0.00 C ATOM 1393 OH TYR A 88 11.427 -3.349 9.579 1.00 0.00 O ATOM 0 H TYR A 88 5.172 -4.992 12.618 1.00 0.00 H new ATOM 0 HA TYR A 88 6.322 -2.269 12.681 1.00 0.00 H new ATOM 0 HB2 TYR A 88 5.383 -4.038 10.381 1.00 0.00 H new ATOM 0 HB3 TYR A 88 5.422 -2.294 10.205 1.00 0.00 H new ATOM 0 HD1 TYR A 88 7.549 -5.260 11.023 1.00 0.00 H new ATOM 0 HD2 TYR A 88 7.456 -1.136 9.830 1.00 0.00 H new ATOM 0 HE1 TYR A 88 9.974 -5.353 10.501 1.00 0.00 H new ATOM 0 HE2 TYR A 88 9.879 -1.226 9.321 1.00 0.00 H new ATOM 0 HH TYR A 88 11.706 -4.285 9.496 1.00 0.00 H new ATOM 1403 N GLY A 89 4.091 -1.135 12.641 1.00 0.00 N ATOM 1404 CA GLY A 89 2.790 -0.490 12.794 1.00 0.00 C ATOM 1405 C GLY A 89 2.543 0.426 11.600 1.00 0.00 C ATOM 1406 O GLY A 89 3.455 1.118 11.163 1.00 0.00 O ATOM 0 H GLY A 89 4.887 -0.501 12.705 1.00 0.00 H new ATOM 0 HA2 GLY A 89 2.003 -1.242 12.860 1.00 0.00 H new ATOM 0 HA3 GLY A 89 2.762 0.084 13.720 1.00 0.00 H new ATOM 1410 N LEU A 90 1.327 0.420 11.063 1.00 0.00 N ATOM 1411 CA LEU A 90 1.028 1.256 9.898 1.00 0.00 C ATOM 1412 C LEU A 90 0.251 2.510 10.283 1.00 0.00 C ATOM 1413 O LEU A 90 -0.869 2.434 10.790 1.00 0.00 O ATOM 1414 CB LEU A 90 0.220 0.451 8.873 1.00 0.00 C ATOM 1415 CG LEU A 90 1.131 -0.028 7.736 1.00 0.00 C ATOM 1416 CD1 LEU A 90 1.603 1.168 6.902 1.00 0.00 C ATOM 1417 CD2 LEU A 90 2.346 -0.753 8.322 1.00 0.00 C ATOM 0 H LEU A 90 0.546 -0.140 11.404 1.00 0.00 H new ATOM 0 HA LEU A 90 1.978 1.568 9.465 1.00 0.00 H new ATOM 0 HB2 LEU A 90 -0.247 -0.405 9.359 1.00 0.00 H new ATOM 0 HB3 LEU A 90 -0.584 1.066 8.469 1.00 0.00 H new ATOM 0 HG LEU A 90 0.572 -0.711 7.097 1.00 0.00 H new ATOM 0 HD11 LEU A 90 2.249 0.818 6.097 1.00 0.00 H new ATOM 0 HD12 LEU A 90 0.739 1.679 6.477 1.00 0.00 H new ATOM 0 HD13 LEU A 90 2.157 1.859 7.538 1.00 0.00 H new ATOM 0 HD21 LEU A 90 2.992 -1.093 7.513 1.00 0.00 H new ATOM 0 HD22 LEU A 90 2.900 -0.071 8.967 1.00 0.00 H new ATOM 0 HD23 LEU A 90 2.011 -1.612 8.904 1.00 0.00 H new ATOM 1429 N LEU A 91 0.853 3.667 10.014 1.00 0.00 N ATOM 1430 CA LEU A 91 0.218 4.946 10.308 1.00 0.00 C ATOM 1431 C LEU A 91 0.431 5.899 9.133 1.00 0.00 C ATOM 1432 O LEU A 91 1.567 6.165 8.742 1.00 0.00 O ATOM 1433 CB LEU A 91 0.812 5.544 11.590 1.00 0.00 C ATOM 1434 CG LEU A 91 0.162 6.898 11.900 1.00 0.00 C ATOM 1435 CD1 LEU A 91 -1.344 6.714 12.108 1.00 0.00 C ATOM 1436 CD2 LEU A 91 0.779 7.471 13.179 1.00 0.00 C ATOM 0 H LEU A 91 1.779 3.743 9.593 1.00 0.00 H new ATOM 0 HA LEU A 91 -0.851 4.795 10.458 1.00 0.00 H new ATOM 0 HB2 LEU A 91 0.657 4.860 12.424 1.00 0.00 H new ATOM 0 HB3 LEU A 91 1.889 5.668 11.476 1.00 0.00 H new ATOM 0 HG LEU A 91 0.332 7.580 11.067 1.00 0.00 H new ATOM 0 HD11 LEU A 91 -1.801 7.679 12.328 1.00 0.00 H new ATOM 0 HD12 LEU A 91 -1.788 6.300 11.203 1.00 0.00 H new ATOM 0 HD13 LEU A 91 -1.516 6.033 12.941 1.00 0.00 H new ATOM 0 HD21 LEU A 91 0.321 8.434 13.404 1.00 0.00 H new ATOM 0 HD22 LEU A 91 0.605 6.784 14.007 1.00 0.00 H new ATOM 0 HD23 LEU A 91 1.852 7.604 13.038 1.00 0.00 H new ATOM 1448 N GLY A 92 -0.661 6.408 8.568 1.00 0.00 N ATOM 1449 CA GLY A 92 -0.558 7.321 7.434 1.00 0.00 C ATOM 1450 C GLY A 92 -1.936 7.705 6.910 1.00 0.00 C ATOM 1451 O GLY A 92 -2.950 7.447 7.558 1.00 0.00 O ATOM 0 H GLY A 92 -1.614 6.207 8.871 1.00 0.00 H new ATOM 0 HA2 GLY A 92 -0.017 8.218 7.734 1.00 0.00 H new ATOM 0 HA3 GLY A 92 0.019 6.852 6.637 1.00 0.00 H new ATOM 1455 N ALA A 93 -1.966 8.325 5.734 1.00 0.00 N ATOM 1456 CA ALA A 93 -3.230 8.739 5.134 1.00 0.00 C ATOM 1457 C ALA A 93 -3.173 8.612 3.615 1.00 0.00 C ATOM 1458 O ALA A 93 -2.106 8.723 3.010 1.00 0.00 O ATOM 1459 CB ALA A 93 -3.536 10.189 5.515 1.00 0.00 C ATOM 0 H ALA A 93 -1.138 8.550 5.182 1.00 0.00 H new ATOM 0 HA ALA A 93 -4.019 8.088 5.510 1.00 0.00 H new ATOM 0 HB1 ALA A 93 -4.481 10.492 5.064 1.00 0.00 H new ATOM 0 HB2 ALA A 93 -3.608 10.273 6.599 1.00 0.00 H new ATOM 0 HB3 ALA A 93 -2.737 10.837 5.153 1.00 0.00 H new ATOM 1465 N GLY A 94 -4.332 8.381 3.006 1.00 0.00 N ATOM 1466 CA GLY A 94 -4.411 8.240 1.556 1.00 0.00 C ATOM 1467 C GLY A 94 -5.026 9.485 0.927 1.00 0.00 C ATOM 1468 O GLY A 94 -5.893 10.127 1.521 1.00 0.00 O ATOM 0 H GLY A 94 -5.225 8.288 3.491 1.00 0.00 H new ATOM 0 HA2 GLY A 94 -3.414 8.074 1.147 1.00 0.00 H new ATOM 0 HA3 GLY A 94 -5.009 7.365 1.303 1.00 0.00 H new ATOM 1472 N HIS A 95 -4.569 9.821 -0.276 1.00 0.00 N ATOM 1473 CA HIS A 95 -5.077 10.994 -0.980 1.00 0.00 C ATOM 1474 C HIS A 95 -5.454 10.641 -2.415 1.00 0.00 C ATOM 1475 O HIS A 95 -4.790 9.829 -3.060 1.00 0.00 O ATOM 1476 CB HIS A 95 -4.012 12.093 -0.990 1.00 0.00 C ATOM 1477 CG HIS A 95 -3.718 12.520 0.422 1.00 0.00 C ATOM 1478 ND1 HIS A 95 -4.163 13.581 1.170 1.00 0.00 N flip ATOM 1479 CD2 HIS A 95 -2.854 11.813 1.242 1.00 0.00 C flip ATOM 1480 CE1 HIS A 95 -3.585 13.534 2.437 1.00 0.00 C flip ATOM 1481 NE2 HIS A 95 -2.806 12.450 2.426 1.00 0.00 N flip ATOM 0 H HIS A 95 -3.852 9.301 -0.781 1.00 0.00 H new ATOM 0 HA HIS A 95 -5.967 11.348 -0.460 1.00 0.00 H new ATOM 0 HB2 HIS A 95 -3.103 11.728 -1.468 1.00 0.00 H new ATOM 0 HB3 HIS A 95 -4.359 12.945 -1.574 1.00 0.00 H new ATOM 0 HD2 HIS A 95 -2.317 10.914 0.979 1.00 0.00 H new ATOM 0 HE1 HIS A 95 -3.735 14.226 3.253 1.00 0.00 H new ATOM 0 HE2 HIS A 95 -2.243 12.142 3.219 1.00 0.00 H new ATOM 1490 N GLY A 96 -6.521 11.264 -2.907 1.00 0.00 N ATOM 1491 CA GLY A 96 -6.986 11.022 -4.270 1.00 0.00 C ATOM 1492 C GLY A 96 -6.877 12.291 -5.105 1.00 0.00 C ATOM 1493 O GLY A 96 -7.104 13.393 -4.603 1.00 0.00 O ATOM 0 H GLY A 96 -7.079 11.939 -2.384 1.00 0.00 H new ATOM 0 HA2 GLY A 96 -6.395 10.228 -4.726 1.00 0.00 H new ATOM 0 HA3 GLY A 96 -8.021 10.679 -4.252 1.00 0.00 H new ATOM 1497 N LYS A 97 -6.527 12.132 -6.380 1.00 0.00 N ATOM 1498 CA LYS A 97 -6.388 13.277 -7.272 1.00 0.00 C ATOM 1499 C LYS A 97 -7.153 13.041 -8.570 1.00 0.00 C ATOM 1500 O LYS A 97 -6.957 12.028 -9.244 1.00 0.00 O ATOM 1501 CB LYS A 97 -4.906 13.516 -7.580 1.00 0.00 C ATOM 1502 CG LYS A 97 -4.751 14.743 -8.486 1.00 0.00 C ATOM 1503 CD LYS A 97 -3.265 15.003 -8.740 1.00 0.00 C ATOM 1504 CE LYS A 97 -3.109 16.188 -9.696 1.00 0.00 C ATOM 1505 NZ LYS A 97 -3.675 17.413 -9.064 1.00 0.00 N ATOM 0 H LYS A 97 -6.336 11.229 -6.814 1.00 0.00 H new ATOM 0 HA LYS A 97 -6.803 14.156 -6.778 1.00 0.00 H new ATOM 0 HB2 LYS A 97 -4.353 13.666 -6.653 1.00 0.00 H new ATOM 0 HB3 LYS A 97 -4.481 12.638 -8.067 1.00 0.00 H new ATOM 0 HG2 LYS A 97 -5.269 14.579 -9.431 1.00 0.00 H new ATOM 0 HG3 LYS A 97 -5.209 15.614 -8.018 1.00 0.00 H new ATOM 0 HD2 LYS A 97 -2.756 15.212 -7.799 1.00 0.00 H new ATOM 0 HD3 LYS A 97 -2.797 14.115 -9.165 1.00 0.00 H new ATOM 0 HE2 LYS A 97 -2.056 16.341 -9.933 1.00 0.00 H new ATOM 0 HE3 LYS A 97 -3.621 15.981 -10.636 1.00 0.00 H new ATOM 0 HZ1 LYS A 97 -3.297 18.256 -9.542 1.00 0.00 H new ATOM 0 HZ2 LYS A 97 -4.711 17.401 -9.150 1.00 0.00 H new ATOM 0 HZ3 LYS A 97 -3.412 17.438 -8.058 1.00 0.00 H new ATOM 1750 N THR A 113 -9.280 13.550 0.917 1.00 0.00 N ATOM 1751 CA THR A 113 -8.342 13.048 1.922 1.00 0.00 C ATOM 1752 C THR A 113 -8.987 11.966 2.786 1.00 0.00 C ATOM 1753 O THR A 113 -10.199 11.964 3.000 1.00 0.00 O ATOM 1754 CB THR A 113 -7.877 14.200 2.817 1.00 0.00 C ATOM 1755 OG1 THR A 113 -9.000 14.758 3.487 1.00 0.00 O ATOM 1756 CG2 THR A 113 -7.205 15.276 1.962 1.00 0.00 C ATOM 0 HA THR A 113 -7.489 12.613 1.401 1.00 0.00 H new ATOM 0 HB THR A 113 -7.163 13.825 3.550 1.00 0.00 H new ATOM 0 HG1 THR A 113 -9.779 14.735 2.893 1.00 0.00 H new ATOM 0 HG21 THR A 113 -6.875 16.095 2.601 1.00 0.00 H new ATOM 0 HG22 THR A 113 -6.345 14.847 1.448 1.00 0.00 H new ATOM 0 HG23 THR A 113 -7.916 15.653 1.227 1.00 0.00 H new ATOM 1764 N SER A 114 -8.158 11.047 3.281 1.00 0.00 N ATOM 1765 CA SER A 114 -8.644 9.958 4.125 1.00 0.00 C ATOM 1766 C SER A 114 -7.542 9.485 5.073 1.00 0.00 C ATOM 1767 O SER A 114 -6.367 9.789 4.871 1.00 0.00 O ATOM 1768 CB SER A 114 -9.109 8.789 3.259 1.00 0.00 C ATOM 1769 OG SER A 114 -7.993 8.239 2.571 1.00 0.00 O ATOM 0 H SER A 114 -7.152 11.035 3.113 1.00 0.00 H new ATOM 0 HA SER A 114 -9.484 10.327 4.713 1.00 0.00 H new ATOM 0 HB2 SER A 114 -9.580 8.027 3.880 1.00 0.00 H new ATOM 0 HB3 SER A 114 -9.860 9.127 2.545 1.00 0.00 H new ATOM 0 HG SER A 114 -7.933 7.279 2.760 1.00 0.00 H new ATOM 1775 N LEU A 115 -7.931 8.745 6.109 1.00 0.00 N ATOM 1776 CA LEU A 115 -6.965 8.244 7.082 1.00 0.00 C ATOM 1777 C LEU A 115 -6.630 6.781 6.803 1.00 0.00 C ATOM 1778 O LEU A 115 -7.490 6.014 6.372 1.00 0.00 O ATOM 1779 CB LEU A 115 -7.533 8.375 8.498 1.00 0.00 C ATOM 1780 CG LEU A 115 -7.888 9.839 8.784 1.00 0.00 C ATOM 1781 CD1 LEU A 115 -8.499 9.952 10.181 1.00 0.00 C ATOM 1782 CD2 LEU A 115 -6.625 10.704 8.713 1.00 0.00 C ATOM 0 H LEU A 115 -8.899 8.481 6.295 1.00 0.00 H new ATOM 0 HA LEU A 115 -6.054 8.837 6.998 1.00 0.00 H new ATOM 0 HB2 LEU A 115 -8.419 7.749 8.603 1.00 0.00 H new ATOM 0 HB3 LEU A 115 -6.804 8.019 9.226 1.00 0.00 H new ATOM 0 HG LEU A 115 -8.605 10.185 8.040 1.00 0.00 H new ATOM 0 HD11 LEU A 115 -8.751 10.993 10.385 1.00 0.00 H new ATOM 0 HD12 LEU A 115 -9.401 9.343 10.234 1.00 0.00 H new ATOM 0 HD13 LEU A 115 -7.780 9.601 10.922 1.00 0.00 H new ATOM 0 HD21 LEU A 115 -6.884 11.743 8.917 1.00 0.00 H new ATOM 0 HD22 LEU A 115 -5.904 10.357 9.454 1.00 0.00 H new ATOM 0 HD23 LEU A 115 -6.187 10.628 7.718 1.00 0.00 H new ATOM 1794 N ALA A 116 -5.377 6.404 7.055 1.00 0.00 N ATOM 1795 CA ALA A 116 -4.941 5.027 6.830 1.00 0.00 C ATOM 1796 C ALA A 116 -4.288 4.456 8.084 1.00 0.00 C ATOM 1797 O ALA A 116 -3.484 5.120 8.738 1.00 0.00 O ATOM 1798 CB ALA A 116 -3.946 4.978 5.667 1.00 0.00 C ATOM 0 H ALA A 116 -4.652 7.026 7.412 1.00 0.00 H new ATOM 0 HA ALA A 116 -5.817 4.426 6.586 1.00 0.00 H new ATOM 0 HB1 ALA A 116 -3.626 3.949 5.505 1.00 0.00 H new ATOM 0 HB2 ALA A 116 -4.424 5.355 4.763 1.00 0.00 H new ATOM 0 HB3 ALA A 116 -3.079 5.595 5.904 1.00 0.00 H new ATOM 1804 N TYR A 117 -4.639 3.214 8.411 1.00 0.00 N ATOM 1805 CA TYR A 117 -4.080 2.554 9.588 1.00 0.00 C ATOM 1806 C TYR A 117 -4.041 1.043 9.379 1.00 0.00 C ATOM 1807 O TYR A 117 -4.741 0.513 8.517 1.00 0.00 O ATOM 1808 CB TYR A 117 -4.924 2.880 10.822 1.00 0.00 C ATOM 1809 CG TYR A 117 -6.302 2.282 10.665 1.00 0.00 C ATOM 1810 CD1 TYR A 117 -7.319 3.018 10.046 1.00 0.00 C ATOM 1811 CD2 TYR A 117 -6.561 0.991 11.140 1.00 0.00 C ATOM 1812 CE1 TYR A 117 -8.596 2.463 9.903 1.00 0.00 C ATOM 1813 CE2 TYR A 117 -7.839 0.436 10.996 1.00 0.00 C ATOM 1814 CZ TYR A 117 -8.855 1.172 10.378 1.00 0.00 C ATOM 1815 OH TYR A 117 -10.115 0.626 10.236 1.00 0.00 O ATOM 0 H TYR A 117 -5.303 2.648 7.882 1.00 0.00 H new ATOM 0 HA TYR A 117 -3.064 2.918 9.740 1.00 0.00 H new ATOM 0 HB2 TYR A 117 -4.445 2.485 11.718 1.00 0.00 H new ATOM 0 HB3 TYR A 117 -4.998 3.960 10.950 1.00 0.00 H new ATOM 0 HD1 TYR A 117 -7.118 4.014 9.679 1.00 0.00 H new ATOM 0 HD2 TYR A 117 -5.776 0.423 11.617 1.00 0.00 H new ATOM 0 HE1 TYR A 117 -9.381 3.031 9.426 1.00 0.00 H new ATOM 0 HE2 TYR A 117 -8.040 -0.560 11.362 1.00 0.00 H new ATOM 0 HH TYR A 117 -10.125 -0.277 10.618 1.00 0.00 H new ATOM 1825 N GLY A 118 -3.219 0.352 10.167 1.00 0.00 N ATOM 1826 CA GLY A 118 -3.114 -1.098 10.037 1.00 0.00 C ATOM 1827 C GLY A 118 -1.943 -1.657 10.838 1.00 0.00 C ATOM 1828 O GLY A 118 -1.432 -1.011 11.753 1.00 0.00 O ATOM 0 H GLY A 118 -2.627 0.764 10.888 1.00 0.00 H new ATOM 0 HA2 GLY A 118 -4.040 -1.561 10.377 1.00 0.00 H new ATOM 0 HA3 GLY A 118 -2.993 -1.361 8.986 1.00 0.00 H new ATOM 1832 N ALA A 119 -1.528 -2.868 10.478 1.00 0.00 N ATOM 1833 CA ALA A 119 -0.415 -3.527 11.152 1.00 0.00 C ATOM 1834 C ALA A 119 0.306 -4.467 10.190 1.00 0.00 C ATOM 1835 O ALA A 119 -0.263 -4.889 9.181 1.00 0.00 O ATOM 1836 CB ALA A 119 -0.930 -4.321 12.354 1.00 0.00 C ATOM 0 H ALA A 119 -1.946 -3.412 9.723 1.00 0.00 H new ATOM 0 HA ALA A 119 0.285 -2.765 11.494 1.00 0.00 H new ATOM 0 HB1 ALA A 119 -0.093 -4.810 12.852 1.00 0.00 H new ATOM 0 HB2 ALA A 119 -1.423 -3.645 13.052 1.00 0.00 H new ATOM 0 HB3 ALA A 119 -1.641 -5.074 12.015 1.00 0.00 H new ATOM 1842 N GLY A 120 1.558 -4.790 10.499 1.00 0.00 N ATOM 1843 CA GLY A 120 2.338 -5.679 9.641 1.00 0.00 C ATOM 1844 C GLY A 120 3.477 -6.335 10.414 1.00 0.00 C ATOM 1845 O GLY A 120 3.704 -6.028 11.585 1.00 0.00 O ATOM 0 H GLY A 120 2.051 -4.455 11.327 1.00 0.00 H new ATOM 0 HA2 GLY A 120 1.688 -6.448 9.224 1.00 0.00 H new ATOM 0 HA3 GLY A 120 2.743 -5.114 8.801 1.00 0.00 H new ATOM 1849 N LEU A 121 4.188 -7.245 9.752 1.00 0.00 N ATOM 1850 CA LEU A 121 5.300 -7.946 10.388 1.00 0.00 C ATOM 1851 C LEU A 121 6.415 -8.221 9.382 1.00 0.00 C ATOM 1852 O LEU A 121 6.218 -8.105 8.171 1.00 0.00 O ATOM 1853 CB LEU A 121 4.810 -9.268 10.983 1.00 0.00 C ATOM 1854 CG LEU A 121 4.283 -10.166 9.863 1.00 0.00 C ATOM 1855 CD1 LEU A 121 5.298 -11.273 9.574 1.00 0.00 C ATOM 1856 CD2 LEU A 121 2.956 -10.794 10.297 1.00 0.00 C ATOM 0 H LEU A 121 4.016 -7.513 8.783 1.00 0.00 H new ATOM 0 HA LEU A 121 5.695 -7.312 11.182 1.00 0.00 H new ATOM 0 HB2 LEU A 121 5.624 -9.766 11.510 1.00 0.00 H new ATOM 0 HB3 LEU A 121 4.024 -9.081 11.714 1.00 0.00 H new ATOM 0 HG LEU A 121 4.129 -9.571 8.963 1.00 0.00 H new ATOM 0 HD11 LEU A 121 4.921 -11.912 8.776 1.00 0.00 H new ATOM 0 HD12 LEU A 121 6.244 -10.828 9.267 1.00 0.00 H new ATOM 0 HD13 LEU A 121 5.453 -11.869 10.474 1.00 0.00 H new ATOM 0 HD21 LEU A 121 2.579 -11.435 9.500 1.00 0.00 H new ATOM 0 HD22 LEU A 121 3.112 -11.389 11.197 1.00 0.00 H new ATOM 0 HD23 LEU A 121 2.231 -10.007 10.503 1.00 0.00 H new ATOM 1868 N GLN A 122 7.588 -8.585 9.894 1.00 0.00 N ATOM 1869 CA GLN A 122 8.736 -8.873 9.040 1.00 0.00 C ATOM 1870 C GLN A 122 9.431 -10.150 9.504 1.00 0.00 C ATOM 1871 O GLN A 122 9.640 -10.348 10.704 1.00 0.00 O ATOM 1872 CB GLN A 122 9.718 -7.703 9.090 1.00 0.00 C ATOM 1873 CG GLN A 122 10.845 -7.927 8.081 1.00 0.00 C ATOM 1874 CD GLN A 122 11.755 -6.704 8.049 1.00 0.00 C ATOM 1875 OE1 GLN A 122 11.567 -5.769 8.826 1.00 0.00 O ATOM 1876 NE2 GLN A 122 12.729 -6.650 7.185 1.00 0.00 N ATOM 0 H GLN A 122 7.768 -8.687 10.893 1.00 0.00 H new ATOM 0 HA GLN A 122 8.390 -9.013 8.016 1.00 0.00 H new ATOM 0 HB2 GLN A 122 9.199 -6.771 8.867 1.00 0.00 H new ATOM 0 HB3 GLN A 122 10.131 -7.606 10.094 1.00 0.00 H new ATOM 0 HG2 GLN A 122 11.419 -8.813 8.353 1.00 0.00 H new ATOM 0 HG3 GLN A 122 10.429 -8.109 7.090 1.00 0.00 H new ATOM 0 HE21 GLN A 122 12.884 -7.426 6.541 1.00 0.00 H new ATOM 0 HE22 GLN A 122 13.337 -5.832 7.152 1.00 0.00 H new ATOM 1885 N PHE A 123 9.778 -11.014 8.549 1.00 0.00 N ATOM 1886 CA PHE A 123 10.438 -12.276 8.871 1.00 0.00 C ATOM 1887 C PHE A 123 11.714 -12.425 8.043 1.00 0.00 C ATOM 1888 O PHE A 123 11.689 -12.284 6.819 1.00 0.00 O ATOM 1889 CB PHE A 123 9.470 -13.433 8.594 1.00 0.00 C ATOM 1890 CG PHE A 123 10.093 -14.753 8.981 1.00 0.00 C ATOM 1891 CD1 PHE A 123 10.405 -15.012 10.322 1.00 0.00 C ATOM 1892 CD2 PHE A 123 10.340 -15.726 8.005 1.00 0.00 C ATOM 1893 CE1 PHE A 123 10.964 -16.244 10.685 1.00 0.00 C ATOM 1894 CE2 PHE A 123 10.903 -16.956 8.369 1.00 0.00 C ATOM 1895 CZ PHE A 123 11.215 -17.214 9.708 1.00 0.00 C ATOM 0 H PHE A 123 9.614 -10.863 7.554 1.00 0.00 H new ATOM 0 HA PHE A 123 10.716 -12.290 9.925 1.00 0.00 H new ATOM 0 HB2 PHE A 123 8.546 -13.283 9.153 1.00 0.00 H new ATOM 0 HB3 PHE A 123 9.204 -13.446 7.537 1.00 0.00 H new ATOM 0 HD1 PHE A 123 10.215 -14.262 11.076 1.00 0.00 H new ATOM 0 HD2 PHE A 123 10.096 -15.528 6.972 1.00 0.00 H new ATOM 0 HE1 PHE A 123 11.201 -16.445 11.719 1.00 0.00 H new ATOM 0 HE2 PHE A 123 11.096 -17.705 7.616 1.00 0.00 H new ATOM 0 HZ PHE A 123 11.650 -18.162 9.988 1.00 0.00 H new ATOM 1905 N ASN A 124 12.831 -12.682 8.725 1.00 0.00 N ATOM 1906 CA ASN A 124 14.123 -12.817 8.052 1.00 0.00 C ATOM 1907 C ASN A 124 14.791 -14.151 8.395 1.00 0.00 C ATOM 1908 O ASN A 124 15.600 -14.214 9.320 1.00 0.00 O ATOM 1909 CB ASN A 124 15.044 -11.681 8.499 1.00 0.00 C ATOM 1910 CG ASN A 124 14.390 -10.336 8.215 1.00 0.00 C ATOM 1911 OD1 ASN A 124 13.450 -10.259 7.427 1.00 0.00 O ATOM 1912 ND2 ASN A 124 14.832 -9.264 8.814 1.00 0.00 N ATOM 0 H ASN A 124 12.867 -12.800 9.737 1.00 0.00 H new ATOM 0 HA ASN A 124 13.952 -12.777 6.976 1.00 0.00 H new ATOM 0 HB2 ASN A 124 15.257 -11.773 9.564 1.00 0.00 H new ATOM 0 HB3 ASN A 124 15.998 -11.748 7.976 1.00 0.00 H new ATOM 0 HD21 ASN A 124 14.397 -8.360 8.629 1.00 0.00 H new ATOM 0 HD22 ASN A 124 15.612 -9.330 9.468 1.00 0.00 H new ATOM 1919 N PRO A 125 14.480 -15.216 7.689 1.00 0.00 N ATOM 1920 CA PRO A 125 15.088 -16.548 7.971 1.00 0.00 C ATOM 1921 C PRO A 125 16.539 -16.612 7.512 1.00 0.00 C ATOM 1922 O PRO A 125 17.356 -17.327 8.092 1.00 0.00 O ATOM 1923 CB PRO A 125 14.205 -17.522 7.193 1.00 0.00 C ATOM 1924 CG PRO A 125 13.636 -16.726 6.068 1.00 0.00 C ATOM 1925 CD PRO A 125 13.546 -15.275 6.547 1.00 0.00 C ATOM 0 HA PRO A 125 15.123 -16.776 9.036 1.00 0.00 H new ATOM 0 HB2 PRO A 125 14.784 -18.368 6.823 1.00 0.00 H new ATOM 0 HB3 PRO A 125 13.416 -17.929 7.826 1.00 0.00 H new ATOM 0 HG2 PRO A 125 14.269 -16.802 5.184 1.00 0.00 H new ATOM 0 HG3 PRO A 125 12.652 -17.102 5.789 1.00 0.00 H new ATOM 0 HD2 PRO A 125 13.833 -14.577 5.761 1.00 0.00 H new ATOM 0 HD3 PRO A 125 12.531 -15.017 6.848 1.00 0.00 H new ATOM 1933 N HIS A 126 16.848 -15.847 6.468 1.00 0.00 N ATOM 1934 CA HIS A 126 18.200 -15.799 5.928 1.00 0.00 C ATOM 1935 C HIS A 126 18.651 -14.335 5.784 1.00 0.00 C ATOM 1936 O HIS A 126 17.979 -13.560 5.105 1.00 0.00 O ATOM 1937 CB HIS A 126 18.231 -16.471 4.555 1.00 0.00 C ATOM 1938 CG HIS A 126 17.797 -17.906 4.685 1.00 0.00 C ATOM 1939 ND1 HIS A 126 18.624 -18.882 5.219 1.00 0.00 N ATOM 1940 CD2 HIS A 126 16.631 -18.545 4.347 1.00 0.00 C ATOM 1941 CE1 HIS A 126 17.947 -20.046 5.189 1.00 0.00 C ATOM 1942 NE2 HIS A 126 16.727 -19.895 4.667 1.00 0.00 N ATOM 0 H HIS A 126 16.178 -15.252 5.980 1.00 0.00 H new ATOM 0 HA HIS A 126 18.872 -16.323 6.607 1.00 0.00 H new ATOM 0 HB2 HIS A 126 17.573 -15.943 3.865 1.00 0.00 H new ATOM 0 HB3 HIS A 126 19.237 -16.421 4.137 1.00 0.00 H new ATOM 0 HD2 HIS A 126 15.769 -18.072 3.900 1.00 0.00 H new ATOM 0 HE1 HIS A 126 18.342 -20.986 5.544 1.00 0.00 H new ATOM 0 HE2 HIS A 126 16.018 -20.615 4.532 1.00 0.00 H new ATOM 1951 N PRO A 127 19.756 -13.924 6.379 1.00 0.00 N ATOM 1952 CA PRO A 127 20.236 -12.512 6.252 1.00 0.00 C ATOM 1953 C PRO A 127 20.288 -12.040 4.800 1.00 0.00 C ATOM 1954 O PRO A 127 20.149 -10.849 4.520 1.00 0.00 O ATOM 1955 CB PRO A 127 21.647 -12.561 6.840 1.00 0.00 C ATOM 1956 CG PRO A 127 21.611 -13.674 7.823 1.00 0.00 C ATOM 1957 CD PRO A 127 20.664 -14.719 7.240 1.00 0.00 C ATOM 0 HA PRO A 127 19.569 -11.813 6.757 1.00 0.00 H new ATOM 0 HB2 PRO A 127 22.392 -12.742 6.065 1.00 0.00 H new ATOM 0 HB3 PRO A 127 21.908 -11.618 7.320 1.00 0.00 H new ATOM 0 HG2 PRO A 127 22.606 -14.092 7.976 1.00 0.00 H new ATOM 0 HG3 PRO A 127 21.258 -13.326 8.794 1.00 0.00 H new ATOM 0 HD2 PRO A 127 21.203 -15.473 6.666 1.00 0.00 H new ATOM 0 HD3 PRO A 127 20.117 -15.245 8.022 1.00 0.00 H new ATOM 1965 N ASN A 128 20.511 -12.974 3.881 1.00 0.00 N ATOM 1966 CA ASN A 128 20.602 -12.633 2.463 1.00 0.00 C ATOM 1967 C ASN A 128 19.221 -12.509 1.821 1.00 0.00 C ATOM 1968 O ASN A 128 19.107 -12.076 0.673 1.00 0.00 O ATOM 1969 CB ASN A 128 21.408 -13.704 1.726 1.00 0.00 C ATOM 1970 CG ASN A 128 22.875 -13.626 2.132 1.00 0.00 C ATOM 1971 OD1 ASN A 128 23.331 -12.593 2.620 1.00 0.00 O ATOM 1972 ND2 ASN A 128 23.646 -14.664 1.956 1.00 0.00 N ATOM 0 H ASN A 128 20.631 -13.965 4.089 1.00 0.00 H new ATOM 0 HA ASN A 128 21.100 -11.667 2.385 1.00 0.00 H new ATOM 0 HB2 ASN A 128 21.011 -14.692 1.957 1.00 0.00 H new ATOM 0 HB3 ASN A 128 21.313 -13.565 0.649 1.00 0.00 H new ATOM 0 HD21 ASN A 128 24.629 -14.620 2.223 1.00 0.00 H new ATOM 0 HD22 ASN A 128 23.265 -15.519 1.551 1.00 0.00 H new ATOM 1979 N PHE A 129 18.178 -12.890 2.551 1.00 0.00 N ATOM 1980 CA PHE A 129 16.821 -12.809 2.014 1.00 0.00 C ATOM 1981 C PHE A 129 15.853 -12.310 3.085 1.00 0.00 C ATOM 1982 O PHE A 129 15.754 -12.894 4.165 1.00 0.00 O ATOM 1983 CB PHE A 129 16.385 -14.184 1.503 1.00 0.00 C ATOM 1984 CG PHE A 129 15.099 -14.060 0.720 1.00 0.00 C ATOM 1985 CD1 PHE A 129 15.082 -13.357 -0.490 1.00 0.00 C ATOM 1986 CD2 PHE A 129 13.925 -14.662 1.195 1.00 0.00 C ATOM 1987 CE1 PHE A 129 13.895 -13.253 -1.225 1.00 0.00 C ATOM 1988 CE2 PHE A 129 12.738 -14.556 0.461 1.00 0.00 C ATOM 1989 CZ PHE A 129 12.722 -13.852 -0.749 1.00 0.00 C ATOM 0 H PHE A 129 18.242 -13.253 3.502 1.00 0.00 H new ATOM 0 HA PHE A 129 16.810 -12.101 1.185 1.00 0.00 H new ATOM 0 HB2 PHE A 129 17.165 -14.611 0.872 1.00 0.00 H new ATOM 0 HB3 PHE A 129 16.245 -14.865 2.342 1.00 0.00 H new ATOM 0 HD1 PHE A 129 15.986 -12.894 -0.857 1.00 0.00 H new ATOM 0 HD2 PHE A 129 13.937 -15.207 2.127 1.00 0.00 H new ATOM 0 HE1 PHE A 129 13.884 -12.711 -2.159 1.00 0.00 H new ATOM 0 HE2 PHE A 129 11.833 -15.018 0.828 1.00 0.00 H new ATOM 0 HZ PHE A 129 11.806 -13.771 -1.315 1.00 0.00 H new ATOM 1999 N VAL A 130 15.157 -11.219 2.779 1.00 0.00 N ATOM 2000 CA VAL A 130 14.208 -10.625 3.720 1.00 0.00 C ATOM 2001 C VAL A 130 12.844 -10.422 3.061 1.00 0.00 C ATOM 2002 O VAL A 130 12.759 -9.919 1.940 1.00 0.00 O ATOM 2003 CB VAL A 130 14.755 -9.279 4.210 1.00 0.00 C ATOM 2004 CG1 VAL A 130 13.768 -8.632 5.185 1.00 0.00 C ATOM 2005 CG2 VAL A 130 16.093 -9.505 4.916 1.00 0.00 C ATOM 0 H VAL A 130 15.231 -10.727 1.888 1.00 0.00 H new ATOM 0 HA VAL A 130 14.081 -11.302 4.565 1.00 0.00 H new ATOM 0 HB VAL A 130 14.894 -8.617 3.355 1.00 0.00 H new ATOM 0 HG11 VAL A 130 14.167 -7.677 5.526 1.00 0.00 H new ATOM 0 HG12 VAL A 130 12.815 -8.468 4.683 1.00 0.00 H new ATOM 0 HG13 VAL A 130 13.619 -9.290 6.041 1.00 0.00 H new ATOM 0 HG21 VAL A 130 16.486 -8.550 5.266 1.00 0.00 H new ATOM 0 HG22 VAL A 130 15.948 -10.171 5.766 1.00 0.00 H new ATOM 0 HG23 VAL A 130 16.801 -9.955 4.219 1.00 0.00 H new ATOM 2015 N ILE A 131 11.781 -10.810 3.768 1.00 0.00 N ATOM 2016 CA ILE A 131 10.425 -10.658 3.245 1.00 0.00 C ATOM 2017 C ILE A 131 9.542 -9.936 4.254 1.00 0.00 C ATOM 2018 O ILE A 131 9.729 -10.070 5.463 1.00 0.00 O ATOM 2019 CB ILE A 131 9.833 -12.032 2.919 1.00 0.00 C ATOM 2020 CG1 ILE A 131 9.826 -12.913 4.175 1.00 0.00 C ATOM 2021 CG2 ILE A 131 10.673 -12.705 1.835 1.00 0.00 C ATOM 2022 CD1 ILE A 131 9.062 -14.208 3.883 1.00 0.00 C ATOM 0 H ILE A 131 11.833 -11.228 4.697 1.00 0.00 H new ATOM 0 HA ILE A 131 10.468 -10.063 2.333 1.00 0.00 H new ATOM 0 HB ILE A 131 8.810 -11.903 2.566 1.00 0.00 H new ATOM 0 HG12 ILE A 131 10.848 -13.141 4.479 1.00 0.00 H new ATOM 0 HG13 ILE A 131 9.359 -12.381 5.003 1.00 0.00 H new ATOM 0 HG21 ILE A 131 10.252 -13.683 1.603 1.00 0.00 H new ATOM 0 HG22 ILE A 131 10.671 -12.087 0.937 1.00 0.00 H new ATOM 0 HG23 ILE A 131 11.696 -12.826 2.190 1.00 0.00 H new ATOM 0 HD11 ILE A 131 9.056 -14.836 4.774 1.00 0.00 H new ATOM 0 HD12 ILE A 131 8.037 -13.970 3.600 1.00 0.00 H new ATOM 0 HD13 ILE A 131 9.549 -14.742 3.067 1.00 0.00 H new ATOM 2034 N ASP A 132 8.574 -9.171 3.756 1.00 0.00 N ATOM 2035 CA ASP A 132 7.676 -8.445 4.643 1.00 0.00 C ATOM 2036 C ASP A 132 6.278 -8.349 4.043 1.00 0.00 C ATOM 2037 O ASP A 132 6.095 -8.477 2.831 1.00 0.00 O ATOM 2038 CB ASP A 132 8.218 -7.037 4.896 1.00 0.00 C ATOM 2039 CG ASP A 132 8.241 -6.246 3.593 1.00 0.00 C ATOM 2040 OD1 ASP A 132 7.798 -6.780 2.590 1.00 0.00 O ATOM 2041 OD2 ASP A 132 8.703 -5.115 3.617 1.00 0.00 O ATOM 0 H ASP A 132 8.395 -9.040 2.760 1.00 0.00 H new ATOM 0 HA ASP A 132 7.615 -8.990 5.585 1.00 0.00 H new ATOM 0 HB2 ASP A 132 7.596 -6.526 5.631 1.00 0.00 H new ATOM 0 HB3 ASP A 132 9.223 -7.095 5.314 1.00 0.00 H new ATOM 2046 N ALA A 133 5.298 -8.112 4.907 1.00 0.00 N ATOM 2047 CA ALA A 133 3.916 -7.985 4.471 1.00 0.00 C ATOM 2048 C ALA A 133 3.129 -7.148 5.470 1.00 0.00 C ATOM 2049 O ALA A 133 3.378 -7.210 6.675 1.00 0.00 O ATOM 2050 CB ALA A 133 3.278 -9.369 4.341 1.00 0.00 C ATOM 0 H ALA A 133 5.436 -8.004 5.912 1.00 0.00 H new ATOM 0 HA ALA A 133 3.898 -7.491 3.499 1.00 0.00 H new ATOM 0 HB1 ALA A 133 2.244 -9.264 4.014 1.00 0.00 H new ATOM 0 HB2 ALA A 133 3.832 -9.958 3.609 1.00 0.00 H new ATOM 0 HB3 ALA A 133 3.304 -9.874 5.307 1.00 0.00 H new ATOM 2056 N SER A 134 2.182 -6.367 4.968 1.00 0.00 N ATOM 2057 CA SER A 134 1.370 -5.526 5.835 1.00 0.00 C ATOM 2058 C SER A 134 0.061 -5.160 5.150 1.00 0.00 C ATOM 2059 O SER A 134 -0.065 -5.273 3.931 1.00 0.00 O ATOM 2060 CB SER A 134 2.135 -4.249 6.187 1.00 0.00 C ATOM 2061 OG SER A 134 2.292 -3.457 5.016 1.00 0.00 O ATOM 0 H SER A 134 1.959 -6.299 3.975 1.00 0.00 H new ATOM 0 HA SER A 134 1.149 -6.082 6.746 1.00 0.00 H new ATOM 0 HB2 SER A 134 1.596 -3.687 6.950 1.00 0.00 H new ATOM 0 HB3 SER A 134 3.110 -4.499 6.604 1.00 0.00 H new ATOM 0 HG SER A 134 2.780 -2.637 5.239 1.00 0.00 H new ATOM 2067 N TYR A 135 -0.906 -4.711 5.938 1.00 0.00 N ATOM 2068 CA TYR A 135 -2.196 -4.318 5.387 1.00 0.00 C ATOM 2069 C TYR A 135 -2.757 -3.123 6.145 1.00 0.00 C ATOM 2070 O TYR A 135 -2.522 -2.969 7.346 1.00 0.00 O ATOM 2071 CB TYR A 135 -3.176 -5.490 5.474 1.00 0.00 C ATOM 2072 CG TYR A 135 -3.384 -5.870 6.921 1.00 0.00 C ATOM 2073 CD1 TYR A 135 -2.554 -6.825 7.518 1.00 0.00 C ATOM 2074 CD2 TYR A 135 -4.408 -5.268 7.665 1.00 0.00 C ATOM 2075 CE1 TYR A 135 -2.745 -7.179 8.860 1.00 0.00 C ATOM 2076 CE2 TYR A 135 -4.598 -5.622 9.006 1.00 0.00 C ATOM 2077 CZ TYR A 135 -3.768 -6.578 9.603 1.00 0.00 C ATOM 2078 OH TYR A 135 -3.956 -6.927 10.925 1.00 0.00 O ATOM 0 H TYR A 135 -0.824 -4.610 6.950 1.00 0.00 H new ATOM 0 HA TYR A 135 -2.058 -4.037 4.343 1.00 0.00 H new ATOM 0 HB2 TYR A 135 -4.128 -5.216 5.019 1.00 0.00 H new ATOM 0 HB3 TYR A 135 -2.790 -6.343 4.916 1.00 0.00 H new ATOM 0 HD1 TYR A 135 -1.766 -7.289 6.944 1.00 0.00 H new ATOM 0 HD2 TYR A 135 -5.050 -4.532 7.204 1.00 0.00 H new ATOM 0 HE1 TYR A 135 -2.103 -7.915 9.321 1.00 0.00 H new ATOM 0 HE2 TYR A 135 -5.386 -5.157 9.580 1.00 0.00 H new ATOM 0 HH TYR A 135 -4.706 -6.416 11.295 1.00 0.00 H new ATOM 2088 N GLU A 136 -3.502 -2.285 5.435 1.00 0.00 N ATOM 2089 CA GLU A 136 -4.101 -1.107 6.044 1.00 0.00 C ATOM 2090 C GLU A 136 -5.452 -0.807 5.412 1.00 0.00 C ATOM 2091 O GLU A 136 -5.742 -1.262 4.304 1.00 0.00 O ATOM 2092 CB GLU A 136 -3.170 0.100 5.894 1.00 0.00 C ATOM 2093 CG GLU A 136 -3.006 0.451 4.413 1.00 0.00 C ATOM 2094 CD GLU A 136 -1.967 1.555 4.253 1.00 0.00 C ATOM 2095 OE1 GLU A 136 -1.427 1.983 5.260 1.00 0.00 O ATOM 2096 OE2 GLU A 136 -1.726 1.955 3.125 1.00 0.00 O ATOM 0 H GLU A 136 -3.704 -2.399 4.442 1.00 0.00 H new ATOM 0 HA GLU A 136 -4.251 -1.307 7.105 1.00 0.00 H new ATOM 0 HB2 GLU A 136 -3.577 0.954 6.436 1.00 0.00 H new ATOM 0 HB3 GLU A 136 -2.198 -0.123 6.334 1.00 0.00 H new ATOM 0 HG2 GLU A 136 -2.700 -0.432 3.853 1.00 0.00 H new ATOM 0 HG3 GLU A 136 -3.961 0.776 3.999 1.00 0.00 H new ATOM 2103 N TYR A 137 -6.268 -0.035 6.121 1.00 0.00 N ATOM 2104 CA TYR A 137 -7.587 0.326 5.622 1.00 0.00 C ATOM 2105 C TYR A 137 -7.703 1.838 5.469 1.00 0.00 C ATOM 2106 O TYR A 137 -7.244 2.597 6.323 1.00 0.00 O ATOM 2107 CB TYR A 137 -8.666 -0.168 6.589 1.00 0.00 C ATOM 2108 CG TYR A 137 -8.626 -1.675 6.664 1.00 0.00 C ATOM 2109 CD1 TYR A 137 -9.372 -2.442 5.760 1.00 0.00 C ATOM 2110 CD2 TYR A 137 -7.847 -2.305 7.641 1.00 0.00 C ATOM 2111 CE1 TYR A 137 -9.336 -3.840 5.834 1.00 0.00 C ATOM 2112 CE2 TYR A 137 -7.813 -3.702 7.714 1.00 0.00 C ATOM 2113 CZ TYR A 137 -8.558 -4.470 6.811 1.00 0.00 C ATOM 2114 OH TYR A 137 -8.524 -5.848 6.884 1.00 0.00 O ATOM 0 H TYR A 137 -6.040 0.350 7.038 1.00 0.00 H new ATOM 0 HA TYR A 137 -7.726 -0.143 4.648 1.00 0.00 H new ATOM 0 HB2 TYR A 137 -8.506 0.260 7.579 1.00 0.00 H new ATOM 0 HB3 TYR A 137 -9.649 0.164 6.254 1.00 0.00 H new ATOM 0 HD1 TYR A 137 -9.974 -1.956 5.007 1.00 0.00 H new ATOM 0 HD2 TYR A 137 -7.272 -1.713 8.338 1.00 0.00 H new ATOM 0 HE1 TYR A 137 -9.909 -4.432 5.136 1.00 0.00 H new ATOM 0 HE2 TYR A 137 -7.211 -4.188 8.468 1.00 0.00 H new ATOM 0 HH TYR A 137 -7.935 -6.122 7.617 1.00 0.00 H new ATOM 2124 N SER A 138 -8.336 2.260 4.381 1.00 0.00 N ATOM 2125 CA SER A 138 -8.536 3.676 4.115 1.00 0.00 C ATOM 2126 C SER A 138 -9.990 3.893 3.727 1.00 0.00 C ATOM 2127 O SER A 138 -10.495 3.235 2.818 1.00 0.00 O ATOM 2128 CB SER A 138 -7.620 4.142 2.982 1.00 0.00 C ATOM 2129 OG SER A 138 -7.878 5.511 2.702 1.00 0.00 O ATOM 0 H SER A 138 -8.720 1.639 3.668 1.00 0.00 H new ATOM 0 HA SER A 138 -8.295 4.253 5.007 1.00 0.00 H new ATOM 0 HB2 SER A 138 -6.576 4.007 3.264 1.00 0.00 H new ATOM 0 HB3 SER A 138 -7.789 3.538 2.090 1.00 0.00 H new ATOM 0 HG SER A 138 -7.412 5.770 1.880 1.00 0.00 H new ATOM 2216 N LYS A 144 -15.164 3.131 0.258 1.00 0.00 N ATOM 2217 CA LYS A 144 -14.323 2.431 1.228 1.00 0.00 C ATOM 2218 C LYS A 144 -13.137 1.828 0.477 1.00 0.00 C ATOM 2219 O LYS A 144 -13.319 1.280 -0.611 1.00 0.00 O ATOM 2220 CB LYS A 144 -15.120 1.325 1.925 1.00 0.00 C ATOM 2221 CG LYS A 144 -16.268 1.948 2.724 1.00 0.00 C ATOM 2222 CD LYS A 144 -17.065 0.844 3.419 1.00 0.00 C ATOM 2223 CE LYS A 144 -18.214 1.466 4.215 1.00 0.00 C ATOM 2224 NZ LYS A 144 -18.996 0.389 4.886 1.00 0.00 N ATOM 0 HA LYS A 144 -13.975 3.127 1.991 1.00 0.00 H new ATOM 0 HB2 LYS A 144 -15.514 0.626 1.187 1.00 0.00 H new ATOM 0 HB3 LYS A 144 -14.469 0.755 2.588 1.00 0.00 H new ATOM 0 HG2 LYS A 144 -15.874 2.646 3.462 1.00 0.00 H new ATOM 0 HG3 LYS A 144 -16.919 2.518 2.061 1.00 0.00 H new ATOM 0 HD2 LYS A 144 -17.457 0.144 2.681 1.00 0.00 H new ATOM 0 HD3 LYS A 144 -16.415 0.275 4.083 1.00 0.00 H new ATOM 0 HE2 LYS A 144 -17.821 2.161 4.957 1.00 0.00 H new ATOM 0 HE3 LYS A 144 -18.861 2.040 3.552 1.00 0.00 H new ATOM 0 HZ1 LYS A 144 -19.777 0.812 5.427 1.00 0.00 H new ATOM 0 HZ2 LYS A 144 -19.382 -0.258 4.169 1.00 0.00 H new ATOM 0 HZ3 LYS A 144 -18.375 -0.140 5.531 1.00 0.00 H new ATOM 2238 N VAL A 145 -11.924 1.952 1.023 1.00 0.00 N ATOM 2239 CA VAL A 145 -10.742 1.427 0.333 1.00 0.00 C ATOM 2240 C VAL A 145 -9.872 0.558 1.235 1.00 0.00 C ATOM 2241 O VAL A 145 -9.505 0.957 2.339 1.00 0.00 O ATOM 2242 CB VAL A 145 -9.905 2.590 -0.200 1.00 0.00 C ATOM 2243 CG1 VAL A 145 -8.656 2.042 -0.895 1.00 0.00 C ATOM 2244 CG2 VAL A 145 -10.733 3.396 -1.203 1.00 0.00 C ATOM 0 H VAL A 145 -11.736 2.400 1.920 1.00 0.00 H new ATOM 0 HA VAL A 145 -11.099 0.799 -0.483 1.00 0.00 H new ATOM 0 HB VAL A 145 -9.608 3.234 0.628 1.00 0.00 H new ATOM 0 HG11 VAL A 145 -8.058 2.870 -1.276 1.00 0.00 H new ATOM 0 HG12 VAL A 145 -8.066 1.466 -0.182 1.00 0.00 H new ATOM 0 HG13 VAL A 145 -8.953 1.399 -1.723 1.00 0.00 H new ATOM 0 HG21 VAL A 145 -10.137 4.225 -1.584 1.00 0.00 H new ATOM 0 HG22 VAL A 145 -11.029 2.752 -2.031 1.00 0.00 H new ATOM 0 HG23 VAL A 145 -11.624 3.785 -0.710 1.00 0.00 H new ATOM 2254 N GLY A 146 -9.517 -0.619 0.727 1.00 0.00 N ATOM 2255 CA GLY A 146 -8.649 -1.540 1.454 1.00 0.00 C ATOM 2256 C GLY A 146 -7.337 -1.698 0.691 1.00 0.00 C ATOM 2257 O GLY A 146 -7.351 -1.843 -0.531 1.00 0.00 O ATOM 0 H GLY A 146 -9.818 -0.958 -0.187 1.00 0.00 H new ATOM 0 HA2 GLY A 146 -8.457 -1.162 2.458 1.00 0.00 H new ATOM 0 HA3 GLY A 146 -9.138 -2.508 1.566 1.00 0.00 H new ATOM 2261 N THR A 147 -6.210 -1.640 1.401 1.00 0.00 N ATOM 2262 CA THR A 147 -4.904 -1.751 0.746 1.00 0.00 C ATOM 2263 C THR A 147 -4.049 -2.864 1.342 1.00 0.00 C ATOM 2264 O THR A 147 -3.883 -2.961 2.558 1.00 0.00 O ATOM 2265 CB THR A 147 -4.155 -0.421 0.863 1.00 0.00 C ATOM 2266 OG1 THR A 147 -4.914 0.604 0.237 1.00 0.00 O ATOM 2267 CG2 THR A 147 -2.792 -0.540 0.181 1.00 0.00 C ATOM 0 H THR A 147 -6.172 -1.519 2.413 1.00 0.00 H new ATOM 0 HA THR A 147 -5.086 -1.997 -0.300 1.00 0.00 H new ATOM 0 HB THR A 147 -4.011 -0.175 1.915 1.00 0.00 H new ATOM 0 HG1 THR A 147 -4.437 1.457 0.312 1.00 0.00 H new ATOM 0 HG21 THR A 147 -2.259 0.407 0.265 1.00 0.00 H new ATOM 0 HG22 THR A 147 -2.211 -1.327 0.663 1.00 0.00 H new ATOM 0 HG23 THR A 147 -2.932 -0.786 -0.872 1.00 0.00 H new ATOM 2275 N TRP A 148 -3.490 -3.685 0.458 1.00 0.00 N ATOM 2276 CA TRP A 148 -2.622 -4.784 0.867 1.00 0.00 C ATOM 2277 C TRP A 148 -1.307 -4.710 0.094 1.00 0.00 C ATOM 2278 O TRP A 148 -1.311 -4.661 -1.136 1.00 0.00 O ATOM 2279 CB TRP A 148 -3.303 -6.127 0.595 1.00 0.00 C ATOM 2280 CG TRP A 148 -2.348 -7.239 0.892 1.00 0.00 C ATOM 2281 CD1 TRP A 148 -1.651 -7.379 2.044 1.00 0.00 C ATOM 2282 CD2 TRP A 148 -1.969 -8.364 0.045 1.00 0.00 C ATOM 2283 NE1 TRP A 148 -0.872 -8.518 1.960 1.00 0.00 N ATOM 2284 CE2 TRP A 148 -1.033 -9.160 0.748 1.00 0.00 C ATOM 2285 CE3 TRP A 148 -2.345 -8.767 -1.248 1.00 0.00 C ATOM 2286 CZ2 TRP A 148 -0.489 -10.314 0.184 1.00 0.00 C ATOM 2287 CZ3 TRP A 148 -1.798 -9.929 -1.816 1.00 0.00 C ATOM 2288 CH2 TRP A 148 -0.873 -10.700 -1.103 1.00 0.00 C ATOM 0 H TRP A 148 -3.624 -3.609 -0.550 1.00 0.00 H new ATOM 0 HA TRP A 148 -2.424 -4.700 1.936 1.00 0.00 H new ATOM 0 HB2 TRP A 148 -4.196 -6.226 1.212 1.00 0.00 H new ATOM 0 HB3 TRP A 148 -3.627 -6.179 -0.445 1.00 0.00 H new ATOM 0 HD1 TRP A 148 -1.696 -6.710 2.891 1.00 0.00 H new ATOM 0 HE1 TRP A 148 -0.254 -8.844 2.703 1.00 0.00 H new ATOM 0 HE3 TRP A 148 -3.058 -8.180 -1.808 1.00 0.00 H new ATOM 0 HZ2 TRP A 148 0.225 -10.905 0.739 1.00 0.00 H new ATOM 0 HZ3 TRP A 148 -2.093 -10.230 -2.810 1.00 0.00 H new ATOM 0 HH2 TRP A 148 -0.456 -11.592 -1.547 1.00 0.00 H new ATOM 2299 N MET A 149 -0.190 -4.686 0.818 1.00 0.00 N ATOM 2300 CA MET A 149 1.122 -4.598 0.180 1.00 0.00 C ATOM 2301 C MET A 149 1.970 -5.829 0.481 1.00 0.00 C ATOM 2302 O MET A 149 2.024 -6.298 1.618 1.00 0.00 O ATOM 2303 CB MET A 149 1.853 -3.348 0.675 1.00 0.00 C ATOM 2304 CG MET A 149 1.119 -2.098 0.187 1.00 0.00 C ATOM 2305 SD MET A 149 2.107 -0.629 0.565 1.00 0.00 S ATOM 2306 CE MET A 149 1.879 -0.639 2.362 1.00 0.00 C ATOM 0 H MET A 149 -0.166 -4.726 1.837 1.00 0.00 H new ATOM 0 HA MET A 149 0.969 -4.541 -0.898 1.00 0.00 H new ATOM 0 HB2 MET A 149 1.903 -3.351 1.764 1.00 0.00 H new ATOM 0 HB3 MET A 149 2.880 -3.346 0.309 1.00 0.00 H new ATOM 0 HG2 MET A 149 0.942 -2.164 -0.887 1.00 0.00 H new ATOM 0 HG3 MET A 149 0.143 -2.026 0.667 1.00 0.00 H new ATOM 0 HE1 MET A 149 2.061 0.360 2.757 1.00 0.00 H new ATOM 0 HE2 MET A 149 0.859 -0.942 2.598 1.00 0.00 H new ATOM 0 HE3 MET A 149 2.580 -1.341 2.814 1.00 0.00 H new ATOM 2316 N LEU A 150 2.640 -6.335 -0.549 1.00 0.00 N ATOM 2317 CA LEU A 150 3.500 -7.506 -0.397 1.00 0.00 C ATOM 2318 C LEU A 150 4.803 -7.281 -1.158 1.00 0.00 C ATOM 2319 O LEU A 150 4.782 -6.894 -2.326 1.00 0.00 O ATOM 2320 CB LEU A 150 2.783 -8.753 -0.930 1.00 0.00 C ATOM 2321 CG LEU A 150 3.762 -9.929 -1.027 1.00 0.00 C ATOM 2322 CD1 LEU A 150 3.062 -11.208 -0.563 1.00 0.00 C ATOM 2323 CD2 LEU A 150 4.218 -10.106 -2.478 1.00 0.00 C ATOM 0 H LEU A 150 2.605 -5.955 -1.495 1.00 0.00 H new ATOM 0 HA LEU A 150 3.724 -7.657 0.659 1.00 0.00 H new ATOM 0 HB2 LEU A 150 1.955 -9.014 -0.271 1.00 0.00 H new ATOM 0 HB3 LEU A 150 2.356 -8.544 -1.911 1.00 0.00 H new ATOM 0 HG LEU A 150 4.628 -9.729 -0.396 1.00 0.00 H new ATOM 0 HD11 LEU A 150 3.755 -12.047 -0.630 1.00 0.00 H new ATOM 0 HD12 LEU A 150 2.735 -11.090 0.470 1.00 0.00 H new ATOM 0 HD13 LEU A 150 2.197 -11.400 -1.198 1.00 0.00 H new ATOM 0 HD21 LEU A 150 4.913 -10.943 -2.541 1.00 0.00 H new ATOM 0 HD22 LEU A 150 3.352 -10.305 -3.110 1.00 0.00 H new ATOM 0 HD23 LEU A 150 4.713 -9.196 -2.817 1.00 0.00 H new ATOM 2335 N GLY A 151 5.938 -7.514 -0.500 1.00 0.00 N ATOM 2336 CA GLY A 151 7.221 -7.312 -1.165 1.00 0.00 C ATOM 2337 C GLY A 151 8.371 -7.933 -0.380 1.00 0.00 C ATOM 2338 O GLY A 151 8.177 -8.483 0.704 1.00 0.00 O ATOM 0 H GLY A 151 5.995 -7.834 0.467 1.00 0.00 H new ATOM 0 HA2 GLY A 151 7.185 -7.748 -2.163 1.00 0.00 H new ATOM 0 HA3 GLY A 151 7.401 -6.244 -1.290 1.00 0.00 H new ATOM 2342 N ALA A 152 9.569 -7.834 -0.945 1.00 0.00 N ATOM 2343 CA ALA A 152 10.761 -8.382 -0.310 1.00 0.00 C ATOM 2344 C ALA A 152 11.985 -7.550 -0.678 1.00 0.00 C ATOM 2345 O ALA A 152 11.978 -6.828 -1.674 1.00 0.00 O ATOM 2346 CB ALA A 152 10.971 -9.831 -0.753 1.00 0.00 C ATOM 0 H ALA A 152 9.740 -7.379 -1.842 1.00 0.00 H new ATOM 0 HA ALA A 152 10.624 -8.353 0.771 1.00 0.00 H new ATOM 0 HB1 ALA A 152 11.864 -10.232 -0.274 1.00 0.00 H new ATOM 0 HB2 ALA A 152 10.106 -10.428 -0.466 1.00 0.00 H new ATOM 0 HB3 ALA A 152 11.093 -9.866 -1.836 1.00 0.00 H new ATOM 2352 N GLY A 153 13.030 -7.649 0.137 1.00 0.00 N ATOM 2353 CA GLY A 153 14.250 -6.892 -0.114 1.00 0.00 C ATOM 2354 C GLY A 153 15.451 -7.556 0.546 1.00 0.00 C ATOM 2355 O GLY A 153 15.353 -8.670 1.060 1.00 0.00 O ATOM 0 H GLY A 153 13.057 -8.239 0.968 1.00 0.00 H new ATOM 0 HA2 GLY A 153 14.419 -6.813 -1.188 1.00 0.00 H new ATOM 0 HA3 GLY A 153 14.137 -5.877 0.266 1.00 0.00 H new ATOM 2359 N TYR A 154 16.587 -6.867 0.525 1.00 0.00 N ATOM 2360 CA TYR A 154 17.803 -7.402 1.125 1.00 0.00 C ATOM 2361 C TYR A 154 18.660 -6.277 1.696 1.00 0.00 C ATOM 2362 O TYR A 154 18.513 -5.117 1.311 1.00 0.00 O ATOM 2363 CB TYR A 154 18.602 -8.178 0.078 1.00 0.00 C ATOM 2364 CG TYR A 154 19.057 -7.235 -1.011 1.00 0.00 C ATOM 2365 CD1 TYR A 154 18.242 -7.009 -2.127 1.00 0.00 C ATOM 2366 CD2 TYR A 154 20.293 -6.586 -0.904 1.00 0.00 C ATOM 2367 CE1 TYR A 154 18.663 -6.134 -3.136 1.00 0.00 C ATOM 2368 CE2 TYR A 154 20.714 -5.711 -1.913 1.00 0.00 C ATOM 2369 CZ TYR A 154 19.899 -5.486 -3.029 1.00 0.00 C ATOM 2370 OH TYR A 154 20.314 -4.624 -4.023 1.00 0.00 O ATOM 0 H TYR A 154 16.691 -5.944 0.103 1.00 0.00 H new ATOM 0 HA TYR A 154 17.522 -8.073 1.937 1.00 0.00 H new ATOM 0 HB2 TYR A 154 19.464 -8.655 0.544 1.00 0.00 H new ATOM 0 HB3 TYR A 154 17.989 -8.972 -0.347 1.00 0.00 H new ATOM 0 HD1 TYR A 154 17.289 -7.510 -2.210 1.00 0.00 H new ATOM 0 HD2 TYR A 154 20.922 -6.760 -0.043 1.00 0.00 H new ATOM 0 HE1 TYR A 154 18.034 -5.959 -3.996 1.00 0.00 H new ATOM 0 HE2 TYR A 154 21.667 -5.210 -1.830 1.00 0.00 H new ATOM 0 HH TYR A 154 21.193 -4.258 -3.792 1.00 0.00 H new ATOM 2380 N ARG A 155 19.550 -6.627 2.619 1.00 0.00 N ATOM 2381 CA ARG A 155 20.423 -5.636 3.239 1.00 0.00 C ATOM 2382 C ARG A 155 21.571 -5.270 2.304 1.00 0.00 C ATOM 2383 O ARG A 155 22.266 -6.144 1.787 1.00 0.00 O ATOM 2384 CB ARG A 155 20.981 -6.184 4.555 1.00 0.00 C ATOM 2385 CG ARG A 155 21.827 -5.111 5.244 1.00 0.00 C ATOM 2386 CD ARG A 155 22.326 -5.640 6.591 1.00 0.00 C ATOM 2387 NE ARG A 155 23.209 -6.781 6.387 1.00 0.00 N ATOM 2388 CZ ARG A 155 24.488 -6.611 6.072 1.00 0.00 C ATOM 2389 NH1 ARG A 155 24.972 -5.406 5.937 1.00 0.00 N ATOM 2390 NH2 ARG A 155 25.262 -7.649 5.897 1.00 0.00 N ATOM 0 H ARG A 155 19.686 -7.581 2.952 1.00 0.00 H new ATOM 0 HA ARG A 155 19.839 -4.738 3.440 1.00 0.00 H new ATOM 0 HB2 ARG A 155 20.164 -6.491 5.208 1.00 0.00 H new ATOM 0 HB3 ARG A 155 21.586 -7.070 4.363 1.00 0.00 H new ATOM 0 HG2 ARG A 155 22.673 -4.839 4.613 1.00 0.00 H new ATOM 0 HG3 ARG A 155 21.236 -4.207 5.393 1.00 0.00 H new ATOM 0 HD2 ARG A 155 22.856 -4.852 7.126 1.00 0.00 H new ATOM 0 HD3 ARG A 155 21.479 -5.933 7.212 1.00 0.00 H new ATOM 0 HE ARG A 155 22.839 -7.726 6.488 1.00 0.00 H new ATOM 0 HH11 ARG A 155 24.368 -4.596 6.073 1.00 0.00 H new ATOM 0 HH12 ARG A 155 25.954 -5.275 5.695 1.00 0.00 H new ATOM 0 HH21 ARG A 155 24.884 -8.591 6.002 1.00 0.00 H new ATOM 0 HH22 ARG A 155 26.244 -7.518 5.655 1.00 0.00 H new