USER MOD reduce.3.24.130724 H: found=0, std=0, add=1183, rem=0, adj=53 USER MOD reduce.3.24.130724 removed 1183 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 164 THR OG1 : rot 118:sc= 0.469 USER MOD Set 1.2: A 167 GLN :FLIP amide:sc= 0.426 F(o=0,f=0.89) USER MOD Set 2.1: A 87 GLN : amide:sc= -0.754 K(o=-1,f=-1.8!) USER MOD Set 2.2: A 118 ASN : amide:sc= -0.249 K(o=-1,f=-2.5) USER MOD Set 3.1: A 92 SER OG : rot 22:sc= 1.21 USER MOD Set 3.2: A 113 SER OG : rot 166:sc= 0.742 USER MOD Set 4.1: A 98 SER OG : rot 30:sc= -0.177 USER MOD Set 4.2: A 108 GLN : amide:sc= -1.38 K(o=-1.6,f=-8!) USER MOD Set 5.1: A 78 ASN : amide:sc= 0.0413 K(o=1.6,f=-1.3) USER MOD Set 5.2: A 85 TYR OH : rot -101:sc= 1.2 USER MOD Set 5.3: A 123 GLN : amide:sc= 0.351 K(o=1.6,f=-1.7!) USER MOD Set 6.1: A 75 THR OG1 : rot 128:sc= 1.2 USER MOD Set 6.2: A 83 THR OG1 : rot -100:sc= -1.91! USER MOD Set 7.1: A 74 TYR OH : rot 35:sc= 0.118 USER MOD Set 7.2: A 82 HIS : no HD1:sc= 0.118 X(o=0.24,f=-0.035) USER MOD Set 8.1: A 61 ASN : amide:sc= -1.82 K(o=-1.1,f=-15!) USER MOD Set 8.2: A 64 THR OG1 : rot -43:sc= 0.678 USER MOD Set 9.1: A 33 ASN : amide:sc= 1.74 K(o=2.5,f=-7.4!) USER MOD Set 9.2: A 35 ASN : amide:sc= 0.712 K(o=2.5,f=1.1) USER MOD Set10.1: A 13 TYR OH : rot 30:sc= 0.526 USER MOD Set10.2: A 21 GLN : amide:sc= 0.575 X(o=1.1,f=1.5) USER MOD Single : A 1 ALA N :NH3+ 168:sc= -0.0139 (180deg=-0.153) USER MOD Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 5 ASN : amide:sc= -0.0609 X(o=-0.061,f=0) USER MOD Single : A 6 TYR OH : rot 180:sc=-0.00342 USER MOD Single : A 8 SER OG : rot 180:sc= 0 USER MOD Single : A 9 SER OG : rot 180:sc= 0 USER MOD Single : A 14 SER OG : rot 180:sc= 0 USER MOD Single : A 16 HIS : no HD1:sc= -0.306 K(o=-0.31,f=-1.2) USER MOD Single : A 18 TYR OH : rot 180:sc= -0.606 USER MOD Single : A 24 SER OG : rot 180:sc= 0 USER MOD Single : A 25 THR OG1 : rot 39:sc= 1.09 USER MOD Single : A 30 ASN : amide:sc= -0.418 X(o=-0.42,f=-0.13) USER MOD Single : A 31 HIS : no HD1:sc= 0.961 K(o=0.96,f=-4.6!) USER MOD Single : A 32 THR OG1 : rot 180:sc= 0.0098 USER MOD Single : A 37 THR OG1 : rot 180:sc= 0 USER MOD Single : A 40 ASN :FLIP amide:sc= -0.42 F(o=-1.4!,f=-0.42) USER MOD Single : A 41 SER OG : rot 180:sc= 0 USER MOD Single : A 45 TYR OH : rot 180:sc= 0 USER MOD Single : A 48 SER OG : rot 180:sc= 0 USER MOD Single : A 50 SER OG : rot 180:sc= 0 USER MOD Single : A 52 SER OG : rot 180:sc= 0.0316 USER MOD Single : A 53 GLN : amide:sc= -1.71 K(o=-1.7,f=-2.8!) USER MOD Single : A 54 TYR OH : rot 110:sc= -1.59! USER MOD Single : A 57 SER OG : rot 180:sc= 0 USER MOD Single : A 58 SER OG : rot 145:sc= 0.806 USER MOD Single : A 59 THR OG1 : rot 180:sc= 0.168 USER MOD Single : A 62 GLN : amide:sc= 0 X(o=0,f=-0.13) USER MOD Single : A 71 ASN :FLIP amide:sc= -0.167 F(o=-1.8!,f=-0.17) USER MOD Single : A 73 THR OG1 : rot 180:sc= -0.239 USER MOD Single : A 90 SER OG : rot 180:sc= 0 USER MOD Single : A 102 THR OG1 : rot 180:sc= 0 USER MOD Single : A 103 SER OG : rot 180:sc= 0 USER MOD Single : A 105 TYR OH : rot -136:sc= 0.942 USER MOD Single : A 106 SER OG : rot 180:sc= 0 USER MOD Single : A 120 SER OG : rot 35:sc= 0.207 USER MOD Single : A 121 SER OG : rot 158:sc= -0.904 USER MOD Single : A 125 GLN : amide:sc= -0.461 K(o=-0.46,f=-3.5!) USER MOD Single : A 127 HIS : no HE2:sc= 0.21 K(o=0.21,f=-0.87) USER MOD Single : A 132 HIS : no HE2:sc= -5.84! C(o=-5.8!,f=-10!) USER MOD Single : A 133 GLN :FLIP amide:sc= -1.01 F(o=-2.4!,f=-1) USER MOD Single : A 136 TYR OH : rot 180:sc= 0 USER MOD Single : A 139 MET CE :methyl 163:sc= -0.181 (180deg=-0.95) USER MOD Single : A 140 SER OG : rot 83:sc= 0.679 USER MOD Single : A 143 THR OG1 : rot 180:sc= 0 USER MOD Single : A 148 THR OG1 : rot 180:sc= 0 USER MOD Single : A 151 ASN : amide:sc= 1.16 K(o=1.2,f=-0.73) USER MOD Single : A 157 TYR OH : rot 180:sc= 0 USER MOD Single : A 160 SER OG : rot 180:sc= 0 USER MOD Single : A 162 ASN : amide:sc= -0.0259 K(o=-0.026,f=-1.4!) USER MOD Single : A 163 SER OG : rot -160:sc= 0 USER MOD Single : A 172 THR OG1 : rot -80:sc= 0.692 USER MOD Single : A 177 GLN : amide:sc= -0.967 K(o=-0.97,f=-6.4!) USER MOD Single : A 178 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD ----------------------------------------------------------------- ATOM 1 N ALA A 1 -9.367 9.828 -9.833 1.00 0.00 N ATOM 2 CA ALA A 1 -9.376 8.477 -10.442 1.00 0.00 C ATOM 3 C ALA A 1 -8.999 7.407 -9.418 1.00 0.00 C ATOM 4 O ALA A 1 -8.355 6.410 -9.752 1.00 0.00 O ATOM 5 CB ALA A 1 -8.437 8.428 -11.634 1.00 0.00 C ATOM 0 H1 ALA A 1 -9.424 10.547 -10.582 1.00 0.00 H new ATOM 0 H2 ALA A 1 -10.183 9.927 -9.195 1.00 0.00 H new ATOM 0 H3 ALA A 1 -8.488 9.960 -9.294 1.00 0.00 H new ATOM 0 HA ALA A 1 -10.389 8.269 -10.786 1.00 0.00 H new ATOM 0 HB1 ALA A 1 -8.455 7.429 -12.070 1.00 0.00 H new ATOM 0 HB2 ALA A 1 -8.757 9.156 -12.380 1.00 0.00 H new ATOM 0 HB3 ALA A 1 -7.424 8.664 -11.309 1.00 0.00 H new ATOM 13 N PHE A 2 -9.405 7.616 -8.172 1.00 0.00 N ATOM 14 CA PHE A 2 -9.110 6.682 -7.097 1.00 0.00 C ATOM 15 C PHE A 2 -10.088 5.509 -7.135 1.00 0.00 C ATOM 16 O PHE A 2 -11.142 5.600 -7.758 1.00 0.00 O ATOM 17 CB PHE A 2 -9.162 7.425 -5.748 1.00 0.00 C ATOM 18 CG PHE A 2 -9.195 6.546 -4.523 1.00 0.00 C ATOM 19 CD1 PHE A 2 -8.149 5.690 -4.217 1.00 0.00 C ATOM 20 CD2 PHE A 2 -10.288 6.581 -3.681 1.00 0.00 C ATOM 21 CE1 PHE A 2 -8.201 4.889 -3.090 1.00 0.00 C ATOM 22 CE2 PHE A 2 -10.351 5.788 -2.559 1.00 0.00 C ATOM 23 CZ PHE A 2 -9.305 4.937 -2.259 1.00 0.00 C ATOM 0 H PHE A 2 -9.944 8.432 -7.881 1.00 0.00 H new ATOM 0 HA PHE A 2 -8.107 6.274 -7.224 1.00 0.00 H new ATOM 0 HB2 PHE A 2 -8.293 8.080 -5.680 1.00 0.00 H new ATOM 0 HB3 PHE A 2 -10.045 8.064 -5.739 1.00 0.00 H new ATOM 0 HD1 PHE A 2 -7.285 5.648 -4.864 1.00 0.00 H new ATOM 0 HD2 PHE A 2 -11.110 7.244 -3.908 1.00 0.00 H new ATOM 0 HE1 PHE A 2 -7.380 4.227 -2.860 1.00 0.00 H new ATOM 0 HE2 PHE A 2 -11.216 5.831 -1.914 1.00 0.00 H new ATOM 0 HZ PHE A 2 -9.349 4.312 -1.379 1.00 0.00 H new ATOM 33 N SER A 3 -9.695 4.400 -6.525 1.00 0.00 N ATOM 34 CA SER A 3 -10.557 3.238 -6.371 1.00 0.00 C ATOM 35 C SER A 3 -9.893 2.180 -5.506 1.00 0.00 C ATOM 36 O SER A 3 -8.685 2.226 -5.249 1.00 0.00 O ATOM 37 CB SER A 3 -10.899 2.635 -7.732 1.00 0.00 C ATOM 38 OG SER A 3 -9.770 2.636 -8.588 1.00 0.00 O ATOM 0 H SER A 3 -8.766 4.281 -6.122 1.00 0.00 H new ATOM 0 HA SER A 3 -11.474 3.571 -5.884 1.00 0.00 H new ATOM 0 HB2 SER A 3 -11.259 1.615 -7.601 1.00 0.00 H new ATOM 0 HB3 SER A 3 -11.708 3.202 -8.192 1.00 0.00 H new ATOM 0 HG SER A 3 -10.014 2.244 -9.452 1.00 0.00 H new ATOM 44 N VAL A 4 -10.696 1.231 -5.058 1.00 0.00 N ATOM 45 CA VAL A 4 -10.183 0.051 -4.380 1.00 0.00 C ATOM 46 C VAL A 4 -9.911 -1.018 -5.406 1.00 0.00 C ATOM 47 O VAL A 4 -10.784 -1.387 -6.193 1.00 0.00 O ATOM 48 CB VAL A 4 -11.151 -0.501 -3.303 1.00 0.00 C ATOM 49 CG1 VAL A 4 -12.600 -0.317 -3.751 1.00 0.00 C ATOM 50 CG2 VAL A 4 -10.861 -1.966 -3.005 1.00 0.00 C ATOM 0 H VAL A 4 -11.711 1.254 -5.152 1.00 0.00 H new ATOM 0 HA VAL A 4 -9.270 0.343 -3.862 1.00 0.00 H new ATOM 0 HB VAL A 4 -10.996 0.063 -2.383 1.00 0.00 H new ATOM 0 HG11 VAL A 4 -13.270 -0.709 -2.986 1.00 0.00 H new ATOM 0 HG12 VAL A 4 -12.802 0.743 -3.902 1.00 0.00 H new ATOM 0 HG13 VAL A 4 -12.763 -0.854 -4.685 1.00 0.00 H new ATOM 0 HG21 VAL A 4 -11.555 -2.327 -2.246 1.00 0.00 H new ATOM 0 HG22 VAL A 4 -10.981 -2.553 -3.915 1.00 0.00 H new ATOM 0 HG23 VAL A 4 -9.839 -2.068 -2.640 1.00 0.00 H new ATOM 60 N ASN A 5 -8.703 -1.512 -5.396 1.00 0.00 N ATOM 61 CA ASN A 5 -8.296 -2.491 -6.375 1.00 0.00 C ATOM 62 C ASN A 5 -8.308 -3.870 -5.774 1.00 0.00 C ATOM 63 O ASN A 5 -7.334 -4.617 -5.849 1.00 0.00 O ATOM 64 CB ASN A 5 -6.917 -2.193 -6.902 1.00 0.00 C ATOM 65 CG ASN A 5 -6.890 -1.129 -7.984 1.00 0.00 C ATOM 66 OD1 ASN A 5 -7.027 -1.428 -9.167 1.00 0.00 O ATOM 67 ND2 ASN A 5 -6.686 0.119 -7.590 1.00 0.00 N ATOM 0 H ASN A 5 -7.981 -1.255 -4.722 1.00 0.00 H new ATOM 0 HA ASN A 5 -9.006 -2.445 -7.201 1.00 0.00 H new ATOM 0 HB2 ASN A 5 -6.284 -1.872 -6.075 1.00 0.00 H new ATOM 0 HB3 ASN A 5 -6.483 -3.111 -7.298 1.00 0.00 H new ATOM 0 HD21 ASN A 5 -6.638 0.870 -8.279 1.00 0.00 H new ATOM 0 HD22 ASN A 5 -6.577 0.329 -6.598 1.00 0.00 H new ATOM 74 N TYR A 6 -9.399 -4.175 -5.140 1.00 0.00 N ATOM 75 CA TYR A 6 -9.606 -5.490 -4.587 1.00 0.00 C ATOM 76 C TYR A 6 -9.906 -6.450 -5.722 1.00 0.00 C ATOM 77 O TYR A 6 -10.477 -6.047 -6.735 1.00 0.00 O ATOM 78 CB TYR A 6 -10.776 -5.480 -3.593 1.00 0.00 C ATOM 79 CG TYR A 6 -12.147 -5.430 -4.237 1.00 0.00 C ATOM 80 CD1 TYR A 6 -12.722 -4.227 -4.607 1.00 0.00 C ATOM 81 CD2 TYR A 6 -12.874 -6.592 -4.451 1.00 0.00 C ATOM 82 CE1 TYR A 6 -13.980 -4.188 -5.175 1.00 0.00 C ATOM 83 CE2 TYR A 6 -14.127 -6.556 -5.024 1.00 0.00 C ATOM 84 CZ TYR A 6 -14.675 -5.350 -5.385 1.00 0.00 C ATOM 85 OH TYR A 6 -15.925 -5.302 -5.960 1.00 0.00 O ATOM 0 H TYR A 6 -10.172 -3.526 -4.989 1.00 0.00 H new ATOM 0 HA TYR A 6 -8.708 -5.804 -4.054 1.00 0.00 H new ATOM 0 HB2 TYR A 6 -10.714 -6.372 -2.969 1.00 0.00 H new ATOM 0 HB3 TYR A 6 -10.667 -4.620 -2.932 1.00 0.00 H new ATOM 0 HD1 TYR A 6 -12.180 -3.306 -4.449 1.00 0.00 H new ATOM 0 HD2 TYR A 6 -12.450 -7.543 -4.163 1.00 0.00 H new ATOM 0 HE1 TYR A 6 -14.417 -3.240 -5.454 1.00 0.00 H new ATOM 0 HE2 TYR A 6 -14.675 -7.472 -5.188 1.00 0.00 H new ATOM 0 HH TYR A 6 -16.283 -6.211 -6.041 1.00 0.00 H new ATOM 95 N ASP A 7 -9.511 -7.700 -5.574 1.00 0.00 N ATOM 96 CA ASP A 7 -9.932 -8.720 -6.519 1.00 0.00 C ATOM 97 C ASP A 7 -11.439 -8.848 -6.434 1.00 0.00 C ATOM 98 O ASP A 7 -11.935 -9.306 -5.409 1.00 0.00 O ATOM 99 CB ASP A 7 -9.296 -10.067 -6.200 1.00 0.00 C ATOM 100 CG ASP A 7 -9.555 -11.095 -7.284 1.00 0.00 C ATOM 101 OD1 ASP A 7 -8.802 -11.121 -8.277 1.00 0.00 O ATOM 102 OD2 ASP A 7 -10.511 -11.885 -7.146 1.00 0.00 O ATOM 0 H ASP A 7 -8.908 -8.032 -4.821 1.00 0.00 H new ATOM 0 HA ASP A 7 -9.617 -8.428 -7.521 1.00 0.00 H new ATOM 0 HB2 ASP A 7 -8.221 -9.938 -6.073 1.00 0.00 H new ATOM 0 HB3 ASP A 7 -9.687 -10.436 -5.252 1.00 0.00 H new ATOM 107 N SER A 8 -12.135 -8.338 -7.460 1.00 0.00 N ATOM 108 CA SER A 8 -13.595 -8.391 -7.586 1.00 0.00 C ATOM 109 C SER A 8 -14.174 -9.723 -7.116 1.00 0.00 C ATOM 110 O SER A 8 -14.473 -10.624 -7.902 1.00 0.00 O ATOM 111 CB SER A 8 -14.018 -8.106 -9.026 1.00 0.00 C ATOM 112 OG SER A 8 -15.415 -7.881 -9.104 1.00 0.00 O ATOM 0 H SER A 8 -11.685 -7.866 -8.244 1.00 0.00 H new ATOM 0 HA SER A 8 -13.999 -7.618 -6.933 1.00 0.00 H new ATOM 0 HB2 SER A 8 -13.483 -7.234 -9.401 1.00 0.00 H new ATOM 0 HB3 SER A 8 -13.744 -8.947 -9.664 1.00 0.00 H new ATOM 0 HG SER A 8 -15.666 -7.699 -10.034 1.00 0.00 H new ATOM 118 N SER A 9 -14.299 -9.806 -5.813 1.00 0.00 N ATOM 119 CA SER A 9 -14.866 -10.945 -5.119 1.00 0.00 C ATOM 120 C SER A 9 -14.977 -10.587 -3.638 1.00 0.00 C ATOM 121 O SER A 9 -15.863 -11.058 -2.928 1.00 0.00 O ATOM 122 CB SER A 9 -13.967 -12.174 -5.309 1.00 0.00 C ATOM 123 OG SER A 9 -14.589 -13.364 -4.856 1.00 0.00 O ATOM 0 H SER A 9 -14.000 -9.061 -5.184 1.00 0.00 H new ATOM 0 HA SER A 9 -15.852 -11.184 -5.519 1.00 0.00 H new ATOM 0 HB2 SER A 9 -13.713 -12.277 -6.364 1.00 0.00 H new ATOM 0 HB3 SER A 9 -13.032 -12.026 -4.769 1.00 0.00 H new ATOM 0 HG SER A 9 -13.985 -14.123 -4.996 1.00 0.00 H new ATOM 129 N PHE A 10 -14.071 -9.716 -3.189 1.00 0.00 N ATOM 130 CA PHE A 10 -14.051 -9.262 -1.803 1.00 0.00 C ATOM 131 C PHE A 10 -14.825 -7.956 -1.642 1.00 0.00 C ATOM 132 O PHE A 10 -14.681 -7.275 -0.629 1.00 0.00 O ATOM 133 CB PHE A 10 -12.607 -9.051 -1.332 1.00 0.00 C ATOM 134 CG PHE A 10 -11.733 -10.267 -1.462 1.00 0.00 C ATOM 135 CD1 PHE A 10 -11.765 -11.266 -0.503 1.00 0.00 C ATOM 136 CD2 PHE A 10 -10.875 -10.409 -2.542 1.00 0.00 C ATOM 137 CE1 PHE A 10 -10.961 -12.383 -0.619 1.00 0.00 C ATOM 138 CE2 PHE A 10 -10.069 -11.524 -2.663 1.00 0.00 C ATOM 139 CZ PHE A 10 -10.112 -12.512 -1.700 1.00 0.00 C ATOM 0 H PHE A 10 -13.339 -9.311 -3.772 1.00 0.00 H new ATOM 0 HA PHE A 10 -14.527 -10.032 -1.196 1.00 0.00 H new ATOM 0 HB2 PHE A 10 -12.165 -8.236 -1.906 1.00 0.00 H new ATOM 0 HB3 PHE A 10 -12.619 -8.736 -0.289 1.00 0.00 H new ATOM 0 HD1 PHE A 10 -12.426 -11.170 0.345 1.00 0.00 H new ATOM 0 HD2 PHE A 10 -10.837 -9.638 -3.298 1.00 0.00 H new ATOM 0 HE1 PHE A 10 -10.996 -13.155 0.135 1.00 0.00 H new ATOM 0 HE2 PHE A 10 -9.406 -11.623 -3.510 1.00 0.00 H new ATOM 0 HZ PHE A 10 -9.482 -13.385 -1.792 1.00 0.00 H new ATOM 149 N GLY A 11 -15.633 -7.603 -2.643 1.00 0.00 N ATOM 150 CA GLY A 11 -16.279 -6.292 -2.661 1.00 0.00 C ATOM 151 C GLY A 11 -17.405 -6.181 -1.651 1.00 0.00 C ATOM 152 O GLY A 11 -18.576 -6.093 -2.015 1.00 0.00 O ATOM 0 H GLY A 11 -15.853 -8.198 -3.441 1.00 0.00 H new ATOM 0 HA2 GLY A 11 -15.535 -5.522 -2.456 1.00 0.00 H new ATOM 0 HA3 GLY A 11 -16.671 -6.098 -3.659 1.00 0.00 H new ATOM 156 N GLY A 12 -17.039 -6.183 -0.379 1.00 0.00 N ATOM 157 CA GLY A 12 -18.007 -6.096 0.692 1.00 0.00 C ATOM 158 C GLY A 12 -17.341 -5.830 2.029 1.00 0.00 C ATOM 159 O GLY A 12 -17.991 -5.861 3.073 1.00 0.00 O ATOM 0 H GLY A 12 -16.070 -6.245 -0.066 1.00 0.00 H new ATOM 0 HA2 GLY A 12 -18.719 -5.300 0.475 1.00 0.00 H new ATOM 0 HA3 GLY A 12 -18.574 -7.025 0.746 1.00 0.00 H new ATOM 163 N TYR A 13 -16.042 -5.546 1.984 1.00 0.00 N ATOM 164 CA TYR A 13 -15.286 -5.182 3.175 1.00 0.00 C ATOM 165 C TYR A 13 -15.258 -3.693 3.359 1.00 0.00 C ATOM 166 O TYR A 13 -15.233 -2.949 2.387 1.00 0.00 O ATOM 167 CB TYR A 13 -13.832 -5.639 3.067 1.00 0.00 C ATOM 168 CG TYR A 13 -13.610 -7.070 3.496 1.00 0.00 C ATOM 169 CD1 TYR A 13 -13.950 -8.132 2.667 1.00 0.00 C ATOM 170 CD2 TYR A 13 -13.069 -7.356 4.747 1.00 0.00 C ATOM 171 CE1 TYR A 13 -13.754 -9.438 3.070 1.00 0.00 C ATOM 172 CE2 TYR A 13 -12.874 -8.659 5.155 1.00 0.00 C ATOM 173 CZ TYR A 13 -13.218 -9.696 4.314 1.00 0.00 C ATOM 174 OH TYR A 13 -13.026 -10.996 4.721 1.00 0.00 O ATOM 0 H TYR A 13 -15.489 -5.562 1.127 1.00 0.00 H new ATOM 0 HA TYR A 13 -15.781 -5.669 4.015 1.00 0.00 H new ATOM 0 HB2 TYR A 13 -13.500 -5.523 2.035 1.00 0.00 H new ATOM 0 HB3 TYR A 13 -13.209 -4.985 3.678 1.00 0.00 H new ATOM 0 HD1 TYR A 13 -14.374 -7.933 1.694 1.00 0.00 H new ATOM 0 HD2 TYR A 13 -12.798 -6.546 5.407 1.00 0.00 H new ATOM 0 HE1 TYR A 13 -14.019 -10.254 2.414 1.00 0.00 H new ATOM 0 HE2 TYR A 13 -12.454 -8.866 6.128 1.00 0.00 H new ATOM 0 HH TYR A 13 -12.851 -11.561 3.940 1.00 0.00 H new ATOM 184 N SER A 14 -15.244 -3.261 4.596 1.00 0.00 N ATOM 185 CA SER A 14 -14.814 -1.920 4.892 1.00 0.00 C ATOM 186 C SER A 14 -13.311 -1.899 4.660 1.00 0.00 C ATOM 187 O SER A 14 -12.635 -2.834 5.088 1.00 0.00 O ATOM 188 CB SER A 14 -15.134 -1.567 6.344 1.00 0.00 C ATOM 189 OG SER A 14 -16.448 -1.972 6.688 1.00 0.00 O ATOM 0 H SER A 14 -15.523 -3.814 5.406 1.00 0.00 H new ATOM 0 HA SER A 14 -15.324 -1.190 4.263 1.00 0.00 H new ATOM 0 HB2 SER A 14 -14.416 -2.050 7.006 1.00 0.00 H new ATOM 0 HB3 SER A 14 -15.031 -0.492 6.492 1.00 0.00 H new ATOM 0 HG SER A 14 -16.629 -1.737 7.622 1.00 0.00 H new ATOM 195 N ILE A 15 -12.792 -0.905 3.948 1.00 0.00 N ATOM 196 CA ILE A 15 -11.386 -0.885 3.592 1.00 0.00 C ATOM 197 C ILE A 15 -10.502 -1.224 4.793 1.00 0.00 C ATOM 198 O ILE A 15 -9.701 -2.157 4.742 1.00 0.00 O ATOM 199 CB ILE A 15 -10.957 0.482 3.025 1.00 0.00 C ATOM 200 CG1 ILE A 15 -11.969 1.008 1.992 1.00 0.00 C ATOM 201 CG2 ILE A 15 -9.612 0.306 2.378 1.00 0.00 C ATOM 202 CD1 ILE A 15 -11.867 0.356 0.629 1.00 0.00 C ATOM 0 H ILE A 15 -13.326 -0.105 3.608 1.00 0.00 H new ATOM 0 HA ILE A 15 -11.255 -1.644 2.820 1.00 0.00 H new ATOM 0 HB ILE A 15 -10.912 1.212 3.833 1.00 0.00 H new ATOM 0 HG12 ILE A 15 -12.977 0.857 2.379 1.00 0.00 H new ATOM 0 HG13 ILE A 15 -11.829 2.083 1.879 1.00 0.00 H new ATOM 0 HG21 ILE A 15 -9.279 1.258 1.965 1.00 0.00 H new ATOM 0 HG22 ILE A 15 -8.893 -0.039 3.121 1.00 0.00 H new ATOM 0 HG23 ILE A 15 -9.687 -0.430 1.577 1.00 0.00 H new ATOM 0 HD11 ILE A 15 -12.616 0.785 -0.037 1.00 0.00 H new ATOM 0 HD12 ILE A 15 -10.873 0.529 0.217 1.00 0.00 H new ATOM 0 HD13 ILE A 15 -12.039 -0.716 0.725 1.00 0.00 H new ATOM 214 N HIS A 16 -10.704 -0.495 5.886 1.00 0.00 N ATOM 215 CA HIS A 16 -9.921 -0.674 7.110 1.00 0.00 C ATOM 216 C HIS A 16 -10.087 -2.085 7.684 1.00 0.00 C ATOM 217 O HIS A 16 -9.210 -2.585 8.387 1.00 0.00 O ATOM 218 CB HIS A 16 -10.355 0.367 8.146 1.00 0.00 C ATOM 219 CG HIS A 16 -9.449 0.482 9.336 1.00 0.00 C ATOM 220 ND1 HIS A 16 -9.849 0.179 10.616 1.00 0.00 N ATOM 221 CD2 HIS A 16 -8.171 0.916 9.436 1.00 0.00 C ATOM 222 CE1 HIS A 16 -8.858 0.425 11.453 1.00 0.00 C ATOM 223 NE2 HIS A 16 -7.823 0.877 10.764 1.00 0.00 N ATOM 0 H HIS A 16 -11.413 0.236 5.951 1.00 0.00 H new ATOM 0 HA HIS A 16 -8.867 -0.539 6.865 1.00 0.00 H new ATOM 0 HB2 HIS A 16 -10.418 1.340 7.659 1.00 0.00 H new ATOM 0 HB3 HIS A 16 -11.358 0.118 8.493 1.00 0.00 H new ATOM 0 HD2 HIS A 16 -7.540 1.235 8.620 1.00 0.00 H new ATOM 0 HE1 HIS A 16 -8.887 0.281 12.523 1.00 0.00 H new ATOM 0 HE2 HIS A 16 -6.920 1.150 11.153 1.00 0.00 H new ATOM 232 N ASP A 17 -11.204 -2.723 7.361 1.00 0.00 N ATOM 233 CA ASP A 17 -11.531 -4.035 7.911 1.00 0.00 C ATOM 234 C ASP A 17 -10.734 -5.134 7.226 1.00 0.00 C ATOM 235 O ASP A 17 -10.185 -6.017 7.889 1.00 0.00 O ATOM 236 CB ASP A 17 -13.027 -4.309 7.787 1.00 0.00 C ATOM 237 CG ASP A 17 -13.446 -5.553 8.539 1.00 0.00 C ATOM 238 OD1 ASP A 17 -13.563 -5.484 9.782 1.00 0.00 O ATOM 239 OD2 ASP A 17 -13.654 -6.600 7.899 1.00 0.00 O ATOM 0 H ASP A 17 -11.903 -2.352 6.718 1.00 0.00 H new ATOM 0 HA ASP A 17 -11.261 -4.031 8.967 1.00 0.00 H new ATOM 0 HB2 ASP A 17 -13.584 -3.452 8.167 1.00 0.00 H new ATOM 0 HB3 ASP A 17 -13.288 -4.418 6.734 1.00 0.00 H new ATOM 244 N TYR A 18 -10.653 -5.080 5.902 1.00 0.00 N ATOM 245 CA TYR A 18 -9.885 -6.072 5.168 1.00 0.00 C ATOM 246 C TYR A 18 -8.400 -5.864 5.396 1.00 0.00 C ATOM 247 O TYR A 18 -7.648 -6.822 5.553 1.00 0.00 O ATOM 248 CB TYR A 18 -10.162 -6.025 3.668 1.00 0.00 C ATOM 249 CG TYR A 18 -9.371 -7.057 2.915 1.00 0.00 C ATOM 250 CD1 TYR A 18 -8.102 -6.750 2.463 1.00 0.00 C ATOM 251 CD2 TYR A 18 -9.866 -8.333 2.684 1.00 0.00 C ATOM 252 CE1 TYR A 18 -7.341 -7.673 1.803 1.00 0.00 C ATOM 253 CE2 TYR A 18 -9.108 -9.272 2.013 1.00 0.00 C ATOM 254 CZ TYR A 18 -7.843 -8.938 1.575 1.00 0.00 C ATOM 255 OH TYR A 18 -7.084 -9.868 0.909 1.00 0.00 O ATOM 0 H TYR A 18 -11.103 -4.370 5.324 1.00 0.00 H new ATOM 0 HA TYR A 18 -10.194 -7.047 5.544 1.00 0.00 H new ATOM 0 HB2 TYR A 18 -11.226 -6.184 3.491 1.00 0.00 H new ATOM 0 HB3 TYR A 18 -9.920 -5.033 3.286 1.00 0.00 H new ATOM 0 HD1 TYR A 18 -7.704 -5.761 2.635 1.00 0.00 H new ATOM 0 HD2 TYR A 18 -10.854 -8.594 3.033 1.00 0.00 H new ATOM 0 HE1 TYR A 18 -6.350 -7.413 1.461 1.00 0.00 H new ATOM 0 HE2 TYR A 18 -9.503 -10.261 1.832 1.00 0.00 H new ATOM 0 HH TYR A 18 -7.586 -10.706 0.834 1.00 0.00 H new ATOM 265 N LEU A 19 -7.977 -4.609 5.381 1.00 0.00 N ATOM 266 CA LEU A 19 -6.573 -4.283 5.568 1.00 0.00 C ATOM 267 C LEU A 19 -6.065 -4.864 6.886 1.00 0.00 C ATOM 268 O LEU A 19 -4.945 -5.368 6.968 1.00 0.00 O ATOM 269 CB LEU A 19 -6.366 -2.782 5.538 1.00 0.00 C ATOM 270 CG LEU A 19 -6.866 -2.070 4.283 1.00 0.00 C ATOM 271 CD1 LEU A 19 -6.239 -0.708 4.225 1.00 0.00 C ATOM 272 CD2 LEU A 19 -6.565 -2.864 3.012 1.00 0.00 C ATOM 0 H LEU A 19 -8.585 -3.802 5.242 1.00 0.00 H new ATOM 0 HA LEU A 19 -6.004 -4.725 4.750 1.00 0.00 H new ATOM 0 HB2 LEU A 19 -6.866 -2.347 6.404 1.00 0.00 H new ATOM 0 HB3 LEU A 19 -5.301 -2.578 5.649 1.00 0.00 H new ATOM 0 HG LEU A 19 -7.951 -1.980 4.339 1.00 0.00 H new ATOM 0 HD11 LEU A 19 -6.586 -0.185 3.334 1.00 0.00 H new ATOM 0 HD12 LEU A 19 -6.521 -0.140 5.111 1.00 0.00 H new ATOM 0 HD13 LEU A 19 -5.154 -0.808 4.188 1.00 0.00 H new ATOM 0 HD21 LEU A 19 -6.939 -2.319 2.145 1.00 0.00 H new ATOM 0 HD22 LEU A 19 -5.488 -3.003 2.916 1.00 0.00 H new ATOM 0 HD23 LEU A 19 -7.053 -3.837 3.067 1.00 0.00 H new ATOM 284 N GLY A 20 -6.910 -4.786 7.915 1.00 0.00 N ATOM 285 CA GLY A 20 -6.616 -5.424 9.186 1.00 0.00 C ATOM 286 C GLY A 20 -6.424 -6.924 9.042 1.00 0.00 C ATOM 287 O GLY A 20 -5.519 -7.505 9.639 1.00 0.00 O ATOM 0 H GLY A 20 -7.799 -4.287 7.887 1.00 0.00 H new ATOM 0 HA2 GLY A 20 -5.715 -4.983 9.613 1.00 0.00 H new ATOM 0 HA3 GLY A 20 -7.429 -5.229 9.886 1.00 0.00 H new ATOM 291 N GLN A 21 -7.281 -7.550 8.242 1.00 0.00 N ATOM 292 CA GLN A 21 -7.187 -8.965 7.958 1.00 0.00 C ATOM 293 C GLN A 21 -5.875 -9.304 7.261 1.00 0.00 C ATOM 294 O GLN A 21 -5.273 -10.346 7.517 1.00 0.00 O ATOM 295 CB GLN A 21 -8.349 -9.368 7.072 1.00 0.00 C ATOM 296 CG GLN A 21 -8.844 -10.748 7.381 1.00 0.00 C ATOM 297 CD GLN A 21 -10.002 -11.167 6.511 1.00 0.00 C ATOM 298 OE1 GLN A 21 -9.814 -11.738 5.438 1.00 0.00 O ATOM 299 NE2 GLN A 21 -11.208 -10.901 6.966 1.00 0.00 N ATOM 0 H GLN A 21 -8.059 -7.084 7.775 1.00 0.00 H new ATOM 0 HA GLN A 21 -7.220 -9.511 8.901 1.00 0.00 H new ATOM 0 HB2 GLN A 21 -9.164 -8.655 7.198 1.00 0.00 H new ATOM 0 HB3 GLN A 21 -8.041 -9.320 6.027 1.00 0.00 H new ATOM 0 HG2 GLN A 21 -8.027 -11.458 7.255 1.00 0.00 H new ATOM 0 HG3 GLN A 21 -9.147 -10.794 8.427 1.00 0.00 H new ATOM 0 HE21 GLN A 21 -11.322 -10.426 7.861 1.00 0.00 H new ATOM 0 HE22 GLN A 21 -12.029 -11.170 6.423 1.00 0.00 H new ATOM 308 N TRP A 22 -5.448 -8.423 6.374 1.00 0.00 N ATOM 309 CA TRP A 22 -4.164 -8.564 5.706 1.00 0.00 C ATOM 310 C TRP A 22 -3.038 -8.560 6.739 1.00 0.00 C ATOM 311 O TRP A 22 -2.145 -9.409 6.707 1.00 0.00 O ATOM 312 CB TRP A 22 -3.979 -7.430 4.686 1.00 0.00 C ATOM 313 CG TRP A 22 -2.582 -7.302 4.163 1.00 0.00 C ATOM 314 CD1 TRP A 22 -2.045 -7.926 3.077 1.00 0.00 C ATOM 315 CD2 TRP A 22 -1.543 -6.486 4.712 1.00 0.00 C ATOM 316 NE1 TRP A 22 -0.730 -7.549 2.921 1.00 0.00 N ATOM 317 CE2 TRP A 22 -0.402 -6.668 3.917 1.00 0.00 C ATOM 318 CE3 TRP A 22 -1.476 -5.624 5.809 1.00 0.00 C ATOM 319 CZ2 TRP A 22 0.799 -6.015 4.180 1.00 0.00 C ATOM 320 CZ3 TRP A 22 -0.285 -4.976 6.072 1.00 0.00 C ATOM 321 CH2 TRP A 22 0.838 -5.176 5.263 1.00 0.00 C ATOM 0 H TRP A 22 -5.976 -7.595 6.097 1.00 0.00 H new ATOM 0 HA TRP A 22 -4.135 -9.514 5.172 1.00 0.00 H new ATOM 0 HB2 TRP A 22 -4.656 -7.595 3.848 1.00 0.00 H new ATOM 0 HB3 TRP A 22 -4.270 -6.487 5.150 1.00 0.00 H new ATOM 0 HD1 TRP A 22 -2.573 -8.614 2.434 1.00 0.00 H new ATOM 0 HE1 TRP A 22 -0.103 -7.873 2.184 1.00 0.00 H new ATOM 0 HE3 TRP A 22 -2.339 -5.467 6.439 1.00 0.00 H new ATOM 0 HZ2 TRP A 22 1.667 -6.164 3.555 1.00 0.00 H new ATOM 0 HZ3 TRP A 22 -0.220 -4.305 6.915 1.00 0.00 H new ATOM 0 HH2 TRP A 22 1.756 -4.658 5.497 1.00 0.00 H new ATOM 332 N ALA A 23 -3.104 -7.613 7.669 1.00 0.00 N ATOM 333 CA ALA A 23 -2.115 -7.507 8.730 1.00 0.00 C ATOM 334 C ALA A 23 -2.174 -8.713 9.666 1.00 0.00 C ATOM 335 O ALA A 23 -1.174 -9.071 10.287 1.00 0.00 O ATOM 336 CB ALA A 23 -2.328 -6.218 9.505 1.00 0.00 C ATOM 0 H ALA A 23 -3.837 -6.905 7.707 1.00 0.00 H new ATOM 0 HA ALA A 23 -1.124 -7.491 8.276 1.00 0.00 H new ATOM 0 HB1 ALA A 23 -1.585 -6.144 10.299 1.00 0.00 H new ATOM 0 HB2 ALA A 23 -2.226 -5.367 8.831 1.00 0.00 H new ATOM 0 HB3 ALA A 23 -3.327 -6.217 9.942 1.00 0.00 H new ATOM 342 N SER A 24 -3.347 -9.338 9.755 1.00 0.00 N ATOM 343 CA SER A 24 -3.516 -10.549 10.545 1.00 0.00 C ATOM 344 C SER A 24 -2.554 -11.628 10.058 1.00 0.00 C ATOM 345 O SER A 24 -1.753 -12.163 10.831 1.00 0.00 O ATOM 346 CB SER A 24 -4.966 -11.035 10.437 1.00 0.00 C ATOM 347 OG SER A 24 -5.158 -12.265 11.112 1.00 0.00 O ATOM 0 H SER A 24 -4.196 -9.021 9.286 1.00 0.00 H new ATOM 0 HA SER A 24 -3.293 -10.333 11.590 1.00 0.00 H new ATOM 0 HB2 SER A 24 -5.634 -10.282 10.855 1.00 0.00 H new ATOM 0 HB3 SER A 24 -5.234 -11.151 9.387 1.00 0.00 H new ATOM 0 HG SER A 24 -6.093 -12.544 11.024 1.00 0.00 H new ATOM 353 N THR A 25 -2.630 -11.933 8.769 1.00 0.00 N ATOM 354 CA THR A 25 -1.734 -12.882 8.151 1.00 0.00 C ATOM 355 C THR A 25 -0.294 -12.374 8.145 1.00 0.00 C ATOM 356 O THR A 25 0.645 -13.157 8.250 1.00 0.00 O ATOM 357 CB THR A 25 -2.192 -13.187 6.718 1.00 0.00 C ATOM 358 OG1 THR A 25 -2.822 -12.029 6.149 1.00 0.00 O ATOM 359 CG2 THR A 25 -3.162 -14.355 6.704 1.00 0.00 C ATOM 0 H THR A 25 -3.314 -11.527 8.131 1.00 0.00 H new ATOM 0 HA THR A 25 -1.762 -13.798 8.741 1.00 0.00 H new ATOM 0 HB THR A 25 -1.317 -13.452 6.125 1.00 0.00 H new ATOM 0 HG1 THR A 25 -2.342 -11.223 6.433 1.00 0.00 H new ATOM 0 HG21 THR A 25 -3.475 -14.556 5.679 1.00 0.00 H new ATOM 0 HG22 THR A 25 -2.673 -15.239 7.114 1.00 0.00 H new ATOM 0 HG23 THR A 25 -4.035 -14.110 7.309 1.00 0.00 H new ATOM 367 N PHE A 26 -0.136 -11.058 8.037 1.00 0.00 N ATOM 368 CA PHE A 26 1.182 -10.433 7.995 1.00 0.00 C ATOM 369 C PHE A 26 1.953 -10.704 9.286 1.00 0.00 C ATOM 370 O PHE A 26 3.124 -11.080 9.249 1.00 0.00 O ATOM 371 CB PHE A 26 1.033 -8.918 7.758 1.00 0.00 C ATOM 372 CG PHE A 26 2.332 -8.164 7.623 1.00 0.00 C ATOM 373 CD1 PHE A 26 3.095 -7.854 8.737 1.00 0.00 C ATOM 374 CD2 PHE A 26 2.785 -7.764 6.376 1.00 0.00 C ATOM 375 CE1 PHE A 26 4.281 -7.161 8.611 1.00 0.00 C ATOM 376 CE2 PHE A 26 3.978 -7.064 6.242 1.00 0.00 C ATOM 377 CZ PHE A 26 4.722 -6.767 7.364 1.00 0.00 C ATOM 0 H PHE A 26 -0.912 -10.399 7.977 1.00 0.00 H new ATOM 0 HA PHE A 26 1.749 -10.865 7.171 1.00 0.00 H new ATOM 0 HB2 PHE A 26 0.444 -8.763 6.854 1.00 0.00 H new ATOM 0 HB3 PHE A 26 0.466 -8.490 8.585 1.00 0.00 H new ATOM 0 HD1 PHE A 26 2.757 -8.159 9.716 1.00 0.00 H new ATOM 0 HD2 PHE A 26 2.203 -7.999 5.497 1.00 0.00 H new ATOM 0 HE1 PHE A 26 4.865 -6.927 9.489 1.00 0.00 H new ATOM 0 HE2 PHE A 26 4.320 -6.755 5.265 1.00 0.00 H new ATOM 0 HZ PHE A 26 5.651 -6.225 7.267 1.00 0.00 H new ATOM 387 N GLY A 27 1.288 -10.507 10.417 1.00 0.00 N ATOM 388 CA GLY A 27 1.930 -10.677 11.709 1.00 0.00 C ATOM 389 C GLY A 27 2.319 -12.113 12.015 1.00 0.00 C ATOM 390 O GLY A 27 3.299 -12.359 12.725 1.00 0.00 O ATOM 0 H GLY A 27 0.307 -10.230 10.464 1.00 0.00 H new ATOM 0 HA2 GLY A 27 2.823 -10.053 11.746 1.00 0.00 H new ATOM 0 HA3 GLY A 27 1.258 -10.318 12.488 1.00 0.00 H new ATOM 394 N ASP A 28 1.553 -13.061 11.490 1.00 0.00 N ATOM 395 CA ASP A 28 1.765 -14.473 11.799 1.00 0.00 C ATOM 396 C ASP A 28 2.982 -15.026 11.065 1.00 0.00 C ATOM 397 O ASP A 28 2.957 -15.217 9.851 1.00 0.00 O ATOM 398 CB ASP A 28 0.528 -15.292 11.446 1.00 0.00 C ATOM 399 CG ASP A 28 0.640 -16.721 11.932 1.00 0.00 C ATOM 400 OD1 ASP A 28 0.580 -16.936 13.161 1.00 0.00 O ATOM 401 OD2 ASP A 28 0.778 -17.629 11.095 1.00 0.00 O ATOM 0 H ASP A 28 0.780 -12.880 10.849 1.00 0.00 H new ATOM 0 HA ASP A 28 1.948 -14.551 12.871 1.00 0.00 H new ATOM 0 HB2 ASP A 28 -0.354 -14.827 11.887 1.00 0.00 H new ATOM 0 HB3 ASP A 28 0.385 -15.286 10.365 1.00 0.00 H new ATOM 406 N VAL A 29 4.041 -15.295 11.820 1.00 0.00 N ATOM 407 CA VAL A 29 5.321 -15.711 11.263 1.00 0.00 C ATOM 408 C VAL A 29 5.263 -17.064 10.546 1.00 0.00 C ATOM 409 O VAL A 29 6.022 -17.306 9.608 1.00 0.00 O ATOM 410 CB VAL A 29 6.396 -15.774 12.359 1.00 0.00 C ATOM 411 CG1 VAL A 29 6.720 -14.378 12.845 1.00 0.00 C ATOM 412 CG2 VAL A 29 5.954 -16.662 13.517 1.00 0.00 C ATOM 0 H VAL A 29 4.035 -15.230 12.838 1.00 0.00 H new ATOM 0 HA VAL A 29 5.578 -14.956 10.520 1.00 0.00 H new ATOM 0 HB VAL A 29 7.296 -16.216 11.933 1.00 0.00 H new ATOM 0 HG11 VAL A 29 7.483 -14.431 13.622 1.00 0.00 H new ATOM 0 HG12 VAL A 29 7.091 -13.780 12.013 1.00 0.00 H new ATOM 0 HG13 VAL A 29 5.820 -13.916 13.251 1.00 0.00 H new ATOM 0 HG21 VAL A 29 6.736 -16.686 14.276 1.00 0.00 H new ATOM 0 HG22 VAL A 29 5.038 -16.263 13.952 1.00 0.00 H new ATOM 0 HG23 VAL A 29 5.772 -17.673 13.152 1.00 0.00 H new ATOM 422 N ASN A 30 4.368 -17.943 10.979 1.00 0.00 N ATOM 423 CA ASN A 30 4.326 -19.300 10.463 1.00 0.00 C ATOM 424 C ASN A 30 3.324 -19.438 9.326 1.00 0.00 C ATOM 425 O ASN A 30 3.125 -20.530 8.787 1.00 0.00 O ATOM 426 CB ASN A 30 3.984 -20.270 11.588 1.00 0.00 C ATOM 427 CG ASN A 30 2.700 -19.923 12.309 1.00 0.00 C ATOM 428 OD1 ASN A 30 1.623 -20.387 11.942 1.00 0.00 O ATOM 429 ND2 ASN A 30 2.811 -19.125 13.363 1.00 0.00 N ATOM 0 H ASN A 30 3.662 -17.738 11.686 1.00 0.00 H new ATOM 0 HA ASN A 30 5.312 -19.539 10.063 1.00 0.00 H new ATOM 0 HB2 ASN A 30 3.901 -21.276 11.178 1.00 0.00 H new ATOM 0 HB3 ASN A 30 4.803 -20.285 12.307 1.00 0.00 H new ATOM 0 HD21 ASN A 30 1.982 -18.875 13.903 1.00 0.00 H new ATOM 0 HD22 ASN A 30 3.725 -18.762 13.633 1.00 0.00 H new ATOM 436 N HIS A 31 2.691 -18.332 8.974 1.00 0.00 N ATOM 437 CA HIS A 31 1.750 -18.308 7.861 1.00 0.00 C ATOM 438 C HIS A 31 2.468 -18.536 6.536 1.00 0.00 C ATOM 439 O HIS A 31 3.217 -17.681 6.069 1.00 0.00 O ATOM 440 CB HIS A 31 0.977 -16.981 7.826 1.00 0.00 C ATOM 441 CG HIS A 31 0.197 -16.763 6.560 1.00 0.00 C ATOM 442 ND1 HIS A 31 -0.897 -17.520 6.197 1.00 0.00 N ATOM 443 CD2 HIS A 31 0.381 -15.875 5.556 1.00 0.00 C ATOM 444 CE1 HIS A 31 -1.346 -17.106 5.026 1.00 0.00 C ATOM 445 NE2 HIS A 31 -0.588 -16.108 4.614 1.00 0.00 N ATOM 0 H HIS A 31 2.811 -17.434 9.443 1.00 0.00 H new ATOM 0 HA HIS A 31 1.037 -19.119 8.010 1.00 0.00 H new ATOM 0 HB2 HIS A 31 0.292 -16.949 8.673 1.00 0.00 H new ATOM 0 HB3 HIS A 31 1.681 -16.159 7.954 1.00 0.00 H new ATOM 0 HD2 HIS A 31 1.151 -15.120 5.506 1.00 0.00 H new ATOM 0 HE1 HIS A 31 -2.192 -17.516 4.495 1.00 0.00 H new ATOM 0 HE2 HIS A 31 -0.703 -15.595 3.740 1.00 0.00 H new ATOM 454 N THR A 32 2.249 -19.699 5.951 1.00 0.00 N ATOM 455 CA THR A 32 2.755 -19.994 4.623 1.00 0.00 C ATOM 456 C THR A 32 1.638 -19.890 3.592 1.00 0.00 C ATOM 457 O THR A 32 0.497 -19.568 3.934 1.00 0.00 O ATOM 458 CB THR A 32 3.378 -21.396 4.570 1.00 0.00 C ATOM 459 OG1 THR A 32 2.556 -22.327 5.287 1.00 0.00 O ATOM 460 CG2 THR A 32 4.778 -21.374 5.155 1.00 0.00 C ATOM 0 H THR A 32 1.720 -20.460 6.378 1.00 0.00 H new ATOM 0 HA THR A 32 3.527 -19.261 4.390 1.00 0.00 H new ATOM 0 HB THR A 32 3.442 -21.711 3.529 1.00 0.00 H new ATOM 0 HG1 THR A 32 2.960 -23.219 5.246 1.00 0.00 H new ATOM 0 HG21 THR A 32 5.207 -22.375 5.110 1.00 0.00 H new ATOM 0 HG22 THR A 32 5.401 -20.687 4.582 1.00 0.00 H new ATOM 0 HG23 THR A 32 4.733 -21.044 6.193 1.00 0.00 H new ATOM 468 N ASN A 33 1.958 -20.184 2.341 1.00 0.00 N ATOM 469 CA ASN A 33 0.968 -20.148 1.275 1.00 0.00 C ATOM 470 C ASN A 33 1.396 -21.065 0.140 1.00 0.00 C ATOM 471 O ASN A 33 2.466 -20.892 -0.445 1.00 0.00 O ATOM 472 CB ASN A 33 0.793 -18.716 0.763 1.00 0.00 C ATOM 473 CG ASN A 33 -0.446 -18.531 -0.094 1.00 0.00 C ATOM 474 OD1 ASN A 33 -0.848 -19.422 -0.847 1.00 0.00 O ATOM 475 ND2 ASN A 33 -1.069 -17.374 0.031 1.00 0.00 N ATOM 0 H ASN A 33 2.895 -20.450 2.039 1.00 0.00 H new ATOM 0 HA ASN A 33 0.012 -20.495 1.668 1.00 0.00 H new ATOM 0 HB2 ASN A 33 0.742 -18.037 1.614 1.00 0.00 H new ATOM 0 HB3 ASN A 33 1.672 -18.435 0.183 1.00 0.00 H new ATOM 0 HD21 ASN A 33 -1.916 -17.190 -0.506 1.00 0.00 H new ATOM 0 HD22 ASN A 33 -0.703 -16.664 0.665 1.00 0.00 H new ATOM 482 N GLY A 34 0.549 -22.038 -0.164 1.00 0.00 N ATOM 483 CA GLY A 34 0.861 -23.017 -1.189 1.00 0.00 C ATOM 484 C GLY A 34 0.888 -22.427 -2.587 1.00 0.00 C ATOM 485 O GLY A 34 1.290 -23.091 -3.537 1.00 0.00 O ATOM 0 H GLY A 34 -0.357 -22.168 0.285 1.00 0.00 H new ATOM 0 HA2 GLY A 34 1.830 -23.466 -0.972 1.00 0.00 H new ATOM 0 HA3 GLY A 34 0.124 -23.819 -1.154 1.00 0.00 H new ATOM 489 N ASN A 35 0.470 -21.174 -2.714 1.00 0.00 N ATOM 490 CA ASN A 35 0.419 -20.516 -4.006 1.00 0.00 C ATOM 491 C ASN A 35 1.653 -19.655 -4.186 1.00 0.00 C ATOM 492 O ASN A 35 1.884 -19.080 -5.250 1.00 0.00 O ATOM 493 CB ASN A 35 -0.833 -19.649 -4.107 1.00 0.00 C ATOM 494 CG ASN A 35 -2.116 -20.451 -4.028 1.00 0.00 C ATOM 495 OD1 ASN A 35 -2.637 -20.914 -5.043 1.00 0.00 O ATOM 496 ND2 ASN A 35 -2.641 -20.610 -2.823 1.00 0.00 N ATOM 0 H ASN A 35 0.161 -20.595 -1.933 1.00 0.00 H new ATOM 0 HA ASN A 35 0.387 -21.274 -4.789 1.00 0.00 H new ATOM 0 HB2 ASN A 35 -0.823 -18.911 -3.305 1.00 0.00 H new ATOM 0 HB3 ASN A 35 -0.812 -19.099 -5.048 1.00 0.00 H new ATOM 0 HD21 ASN A 35 -3.510 -21.133 -2.710 1.00 0.00 H new ATOM 0 HD22 ASN A 35 -2.177 -20.210 -2.008 1.00 0.00 H new ATOM 503 N VAL A 36 2.437 -19.576 -3.127 1.00 0.00 N ATOM 504 CA VAL A 36 3.608 -18.727 -3.092 1.00 0.00 C ATOM 505 C VAL A 36 4.882 -19.538 -3.292 1.00 0.00 C ATOM 506 O VAL A 36 5.235 -20.385 -2.470 1.00 0.00 O ATOM 507 CB VAL A 36 3.658 -17.953 -1.766 1.00 0.00 C ATOM 508 CG1 VAL A 36 5.016 -17.303 -1.546 1.00 0.00 C ATOM 509 CG2 VAL A 36 2.560 -16.907 -1.758 1.00 0.00 C ATOM 0 H VAL A 36 2.278 -20.100 -2.267 1.00 0.00 H new ATOM 0 HA VAL A 36 3.539 -18.013 -3.913 1.00 0.00 H new ATOM 0 HB VAL A 36 3.502 -18.656 -0.948 1.00 0.00 H new ATOM 0 HG11 VAL A 36 5.013 -16.765 -0.598 1.00 0.00 H new ATOM 0 HG12 VAL A 36 5.788 -18.072 -1.524 1.00 0.00 H new ATOM 0 HG13 VAL A 36 5.222 -16.606 -2.358 1.00 0.00 H new ATOM 0 HG21 VAL A 36 2.591 -16.354 -0.819 1.00 0.00 H new ATOM 0 HG22 VAL A 36 2.708 -16.218 -2.590 1.00 0.00 H new ATOM 0 HG23 VAL A 36 1.591 -17.396 -1.860 1.00 0.00 H new ATOM 519 N THR A 37 5.547 -19.278 -4.403 1.00 0.00 N ATOM 520 CA THR A 37 6.774 -19.964 -4.759 1.00 0.00 C ATOM 521 C THR A 37 7.998 -19.121 -4.437 1.00 0.00 C ATOM 522 O THR A 37 8.726 -19.387 -3.477 1.00 0.00 O ATOM 523 CB THR A 37 6.795 -20.267 -6.248 1.00 0.00 C ATOM 524 OG1 THR A 37 5.503 -20.733 -6.666 1.00 0.00 O ATOM 525 CG2 THR A 37 7.852 -21.311 -6.574 1.00 0.00 C ATOM 0 H THR A 37 5.249 -18.582 -5.086 1.00 0.00 H new ATOM 0 HA THR A 37 6.805 -20.885 -4.177 1.00 0.00 H new ATOM 0 HB THR A 37 7.042 -19.350 -6.784 1.00 0.00 H new ATOM 0 HG1 THR A 37 5.520 -20.926 -7.627 1.00 0.00 H new ATOM 0 HG21 THR A 37 7.848 -21.511 -7.645 1.00 0.00 H new ATOM 0 HG22 THR A 37 8.833 -20.940 -6.278 1.00 0.00 H new ATOM 0 HG23 THR A 37 7.634 -22.231 -6.032 1.00 0.00 H new ATOM 533 N ASP A 38 8.201 -18.096 -5.255 1.00 0.00 N ATOM 534 CA ASP A 38 9.387 -17.262 -5.187 1.00 0.00 C ATOM 535 C ASP A 38 9.434 -16.483 -3.880 1.00 0.00 C ATOM 536 O ASP A 38 10.398 -16.591 -3.120 1.00 0.00 O ATOM 537 CB ASP A 38 9.376 -16.301 -6.362 1.00 0.00 C ATOM 538 CG ASP A 38 10.658 -16.324 -7.172 1.00 0.00 C ATOM 539 OD1 ASP A 38 10.868 -17.299 -7.924 1.00 0.00 O ATOM 540 OD2 ASP A 38 11.440 -15.350 -7.097 1.00 0.00 O ATOM 0 H ASP A 38 7.544 -17.822 -5.985 1.00 0.00 H new ATOM 0 HA ASP A 38 10.271 -17.898 -5.229 1.00 0.00 H new ATOM 0 HB2 ASP A 38 8.538 -16.547 -7.015 1.00 0.00 H new ATOM 0 HB3 ASP A 38 9.206 -15.290 -5.993 1.00 0.00 H new ATOM 545 N ALA A 39 8.383 -15.704 -3.634 1.00 0.00 N ATOM 546 CA ALA A 39 8.253 -14.912 -2.411 1.00 0.00 C ATOM 547 C ALA A 39 9.364 -13.882 -2.308 1.00 0.00 C ATOM 548 O ALA A 39 10.303 -14.008 -1.517 1.00 0.00 O ATOM 549 CB ALA A 39 8.203 -15.797 -1.182 1.00 0.00 C ATOM 0 H ALA A 39 7.597 -15.603 -4.276 1.00 0.00 H new ATOM 0 HA ALA A 39 7.306 -14.374 -2.463 1.00 0.00 H new ATOM 0 HB1 ALA A 39 8.106 -15.177 -0.291 1.00 0.00 H new ATOM 0 HB2 ALA A 39 7.347 -16.468 -1.252 1.00 0.00 H new ATOM 0 HB3 ALA A 39 9.120 -16.383 -1.118 1.00 0.00 H new ATOM 555 N ASN A 40 9.231 -12.867 -3.129 1.00 0.00 N ATOM 556 CA ASN A 40 10.178 -11.775 -3.190 1.00 0.00 C ATOM 557 C ASN A 40 9.855 -10.729 -2.127 1.00 0.00 C ATOM 558 O ASN A 40 8.696 -10.361 -1.934 1.00 0.00 O ATOM 559 CB ASN A 40 10.125 -11.172 -4.589 1.00 0.00 C ATOM 560 CG ASN A 40 10.922 -11.979 -5.596 1.00 0.00 C ATOM 561 OD1 ASN A 40 10.330 -13.049 -6.102 1.00 0.00 O flip ATOM 562 ND2 ASN A 40 12.067 -11.657 -5.902 1.00 0.00 N flip ATOM 0 H ASN A 40 8.453 -12.774 -3.782 1.00 0.00 H new ATOM 0 HA ASN A 40 11.185 -12.140 -2.990 1.00 0.00 H new ATOM 0 HB2 ASN A 40 9.087 -11.111 -4.916 1.00 0.00 H new ATOM 0 HB3 ASN A 40 10.510 -10.153 -4.557 1.00 0.00 H new ATOM 0 HD21 ASN A 40 12.490 -10.825 -5.491 1.00 0.00 H new ATOM 0 HD22 ASN A 40 12.595 -12.222 -6.567 1.00 0.00 H new ATOM 569 N SER A 41 10.894 -10.273 -1.435 1.00 0.00 N ATOM 570 CA SER A 41 10.747 -9.344 -0.319 1.00 0.00 C ATOM 571 C SER A 41 10.435 -7.927 -0.791 1.00 0.00 C ATOM 572 O SER A 41 9.634 -7.227 -0.178 1.00 0.00 O ATOM 573 CB SER A 41 12.023 -9.334 0.523 1.00 0.00 C ATOM 574 OG SER A 41 12.256 -10.599 1.124 1.00 0.00 O ATOM 0 H SER A 41 11.860 -10.536 -1.631 1.00 0.00 H new ATOM 0 HA SER A 41 9.906 -9.688 0.283 1.00 0.00 H new ATOM 0 HB2 SER A 41 12.873 -9.065 -0.104 1.00 0.00 H new ATOM 0 HB3 SER A 41 11.944 -8.571 1.297 1.00 0.00 H new ATOM 0 HG SER A 41 13.079 -10.563 1.654 1.00 0.00 H new ATOM 580 N GLY A 42 11.083 -7.499 -1.860 1.00 0.00 N ATOM 581 CA GLY A 42 10.830 -6.176 -2.385 1.00 0.00 C ATOM 582 C GLY A 42 12.094 -5.348 -2.501 1.00 0.00 C ATOM 583 O GLY A 42 13.065 -5.769 -3.133 1.00 0.00 O ATOM 0 H GLY A 42 11.778 -8.042 -2.373 1.00 0.00 H new ATOM 0 HA2 GLY A 42 10.363 -6.261 -3.366 1.00 0.00 H new ATOM 0 HA3 GLY A 42 10.120 -5.661 -1.738 1.00 0.00 H new ATOM 587 N GLY A 43 12.086 -4.174 -1.888 1.00 0.00 N ATOM 588 CA GLY A 43 13.233 -3.288 -1.966 1.00 0.00 C ATOM 589 C GLY A 43 13.311 -2.553 -3.290 1.00 0.00 C ATOM 590 O GLY A 43 14.296 -2.680 -4.022 1.00 0.00 O ATOM 0 H GLY A 43 11.306 -3.817 -1.337 1.00 0.00 H new ATOM 0 HA2 GLY A 43 13.183 -2.563 -1.154 1.00 0.00 H new ATOM 0 HA3 GLY A 43 14.145 -3.867 -1.821 1.00 0.00 H new ATOM 594 N PHE A 44 12.267 -1.777 -3.586 1.00 0.00 N ATOM 595 CA PHE A 44 12.203 -0.957 -4.795 1.00 0.00 C ATOM 596 C PHE A 44 12.281 -1.784 -6.084 1.00 0.00 C ATOM 597 O PHE A 44 12.324 -3.015 -6.062 1.00 0.00 O ATOM 598 CB PHE A 44 13.323 0.086 -4.771 1.00 0.00 C ATOM 599 CG PHE A 44 13.297 0.945 -3.542 1.00 0.00 C ATOM 600 CD1 PHE A 44 12.270 1.846 -3.342 1.00 0.00 C ATOM 601 CD2 PHE A 44 14.298 0.850 -2.588 1.00 0.00 C ATOM 602 CE1 PHE A 44 12.233 2.639 -2.213 1.00 0.00 C ATOM 603 CE2 PHE A 44 14.269 1.639 -1.455 1.00 0.00 C ATOM 604 CZ PHE A 44 13.234 2.534 -1.267 1.00 0.00 C ATOM 0 H PHE A 44 11.441 -1.700 -2.993 1.00 0.00 H new ATOM 0 HA PHE A 44 11.231 -0.464 -4.797 1.00 0.00 H new ATOM 0 HB2 PHE A 44 14.286 -0.421 -4.833 1.00 0.00 H new ATOM 0 HB3 PHE A 44 13.240 0.721 -5.653 1.00 0.00 H new ATOM 0 HD1 PHE A 44 11.485 1.931 -4.079 1.00 0.00 H new ATOM 0 HD2 PHE A 44 15.109 0.152 -2.732 1.00 0.00 H new ATOM 0 HE1 PHE A 44 11.424 3.340 -2.070 1.00 0.00 H new ATOM 0 HE2 PHE A 44 15.054 1.556 -0.718 1.00 0.00 H new ATOM 0 HZ PHE A 44 13.207 3.151 -0.381 1.00 0.00 H new ATOM 614 N TYR A 45 12.259 -1.076 -7.206 1.00 0.00 N ATOM 615 CA TYR A 45 12.375 -1.678 -8.526 1.00 0.00 C ATOM 616 C TYR A 45 13.214 -0.776 -9.425 1.00 0.00 C ATOM 617 O TYR A 45 14.337 -1.117 -9.788 1.00 0.00 O ATOM 618 CB TYR A 45 10.984 -1.906 -9.139 1.00 0.00 C ATOM 619 CG TYR A 45 10.993 -2.161 -10.637 1.00 0.00 C ATOM 620 CD1 TYR A 45 11.328 -3.405 -11.157 1.00 0.00 C ATOM 621 CD2 TYR A 45 10.665 -1.147 -11.531 1.00 0.00 C ATOM 622 CE1 TYR A 45 11.341 -3.628 -12.527 1.00 0.00 C ATOM 623 CE2 TYR A 45 10.674 -1.361 -12.893 1.00 0.00 C ATOM 624 CZ TYR A 45 11.014 -2.599 -13.388 1.00 0.00 C ATOM 625 OH TYR A 45 11.028 -2.809 -14.749 1.00 0.00 O ATOM 0 H TYR A 45 12.159 -0.061 -7.225 1.00 0.00 H new ATOM 0 HA TYR A 45 12.866 -2.647 -8.434 1.00 0.00 H new ATOM 0 HB2 TYR A 45 10.515 -2.755 -8.641 1.00 0.00 H new ATOM 0 HB3 TYR A 45 10.363 -1.034 -8.935 1.00 0.00 H new ATOM 0 HD1 TYR A 45 11.582 -4.211 -10.485 1.00 0.00 H new ATOM 0 HD2 TYR A 45 10.398 -0.172 -11.150 1.00 0.00 H new ATOM 0 HE1 TYR A 45 11.605 -4.600 -12.917 1.00 0.00 H new ATOM 0 HE2 TYR A 45 10.415 -0.560 -13.569 1.00 0.00 H new ATOM 0 HH TYR A 45 10.772 -1.983 -15.210 1.00 0.00 H new ATOM 635 N GLY A 46 12.661 0.378 -9.776 1.00 0.00 N ATOM 636 CA GLY A 46 13.374 1.325 -10.603 1.00 0.00 C ATOM 637 C GLY A 46 14.163 2.319 -9.781 1.00 0.00 C ATOM 638 O GLY A 46 13.967 3.526 -9.908 1.00 0.00 O ATOM 0 H GLY A 46 11.725 0.674 -9.499 1.00 0.00 H new ATOM 0 HA2 GLY A 46 14.050 0.788 -11.268 1.00 0.00 H new ATOM 0 HA3 GLY A 46 12.665 1.860 -11.234 1.00 0.00 H new ATOM 642 N GLY A 47 15.034 1.818 -8.919 1.00 0.00 N ATOM 643 CA GLY A 47 15.848 2.693 -8.105 1.00 0.00 C ATOM 644 C GLY A 47 16.566 1.948 -7.001 1.00 0.00 C ATOM 645 O GLY A 47 16.147 0.860 -6.606 1.00 0.00 O ATOM 0 H GLY A 47 15.191 0.821 -8.769 1.00 0.00 H new ATOM 0 HA2 GLY A 47 16.580 3.196 -8.737 1.00 0.00 H new ATOM 0 HA3 GLY A 47 15.219 3.468 -7.667 1.00 0.00 H new ATOM 649 N SER A 48 17.659 2.526 -6.517 1.00 0.00 N ATOM 650 CA SER A 48 18.407 1.951 -5.407 1.00 0.00 C ATOM 651 C SER A 48 17.751 2.331 -4.089 1.00 0.00 C ATOM 652 O SER A 48 17.805 1.587 -3.109 1.00 0.00 O ATOM 653 CB SER A 48 19.848 2.462 -5.420 1.00 0.00 C ATOM 654 OG SER A 48 20.384 2.446 -6.733 1.00 0.00 O ATOM 0 H SER A 48 18.048 3.397 -6.878 1.00 0.00 H new ATOM 0 HA SER A 48 18.410 0.866 -5.514 1.00 0.00 H new ATOM 0 HB2 SER A 48 19.881 3.477 -5.023 1.00 0.00 H new ATOM 0 HB3 SER A 48 20.462 1.844 -4.766 1.00 0.00 H new ATOM 0 HG SER A 48 21.306 2.779 -6.714 1.00 0.00 H new ATOM 660 N LEU A 49 17.081 3.477 -4.106 1.00 0.00 N ATOM 661 CA LEU A 49 16.517 4.081 -2.907 1.00 0.00 C ATOM 662 C LEU A 49 15.349 4.961 -3.316 1.00 0.00 C ATOM 663 O LEU A 49 14.317 5.007 -2.654 1.00 0.00 O ATOM 664 CB LEU A 49 17.543 4.982 -2.198 1.00 0.00 C ATOM 665 CG LEU A 49 18.988 4.493 -2.144 1.00 0.00 C ATOM 666 CD1 LEU A 49 19.914 5.645 -1.795 1.00 0.00 C ATOM 667 CD2 LEU A 49 19.134 3.393 -1.125 1.00 0.00 C ATOM 0 H LEU A 49 16.913 4.015 -4.956 1.00 0.00 H new ATOM 0 HA LEU A 49 16.213 3.280 -2.233 1.00 0.00 H new ATOM 0 HB2 LEU A 49 17.535 5.954 -2.690 1.00 0.00 H new ATOM 0 HB3 LEU A 49 17.202 5.140 -1.175 1.00 0.00 H new ATOM 0 HG LEU A 49 19.258 4.100 -3.124 1.00 0.00 H new ATOM 0 HD11 LEU A 49 20.943 5.287 -1.759 1.00 0.00 H new ATOM 0 HD12 LEU A 49 19.827 6.424 -2.553 1.00 0.00 H new ATOM 0 HD13 LEU A 49 19.637 6.053 -0.823 1.00 0.00 H new ATOM 0 HD21 LEU A 49 20.170 3.056 -1.099 1.00 0.00 H new ATOM 0 HD22 LEU A 49 18.850 3.768 -0.142 1.00 0.00 H new ATOM 0 HD23 LEU A 49 18.488 2.558 -1.396 1.00 0.00 H new ATOM 679 N SER A 50 15.535 5.676 -4.408 1.00 0.00 N ATOM 680 CA SER A 50 14.490 6.503 -4.968 1.00 0.00 C ATOM 681 C SER A 50 14.105 5.986 -6.345 1.00 0.00 C ATOM 682 O SER A 50 14.942 5.428 -7.055 1.00 0.00 O ATOM 683 CB SER A 50 14.980 7.948 -5.049 1.00 0.00 C ATOM 684 OG SER A 50 16.286 8.011 -5.597 1.00 0.00 O ATOM 0 H SER A 50 16.412 5.699 -4.929 1.00 0.00 H new ATOM 0 HA SER A 50 13.607 6.466 -4.330 1.00 0.00 H new ATOM 0 HB2 SER A 50 14.296 8.534 -5.662 1.00 0.00 H new ATOM 0 HB3 SER A 50 14.977 8.393 -4.054 1.00 0.00 H new ATOM 0 HG SER A 50 16.578 8.946 -5.641 1.00 0.00 H new ATOM 690 N GLY A 51 12.846 6.148 -6.715 1.00 0.00 N ATOM 691 CA GLY A 51 12.409 5.692 -8.012 1.00 0.00 C ATOM 692 C GLY A 51 10.905 5.595 -8.122 1.00 0.00 C ATOM 693 O GLY A 51 10.178 6.466 -7.646 1.00 0.00 O ATOM 0 H GLY A 51 12.123 6.585 -6.143 1.00 0.00 H new ATOM 0 HA2 GLY A 51 12.781 6.374 -8.776 1.00 0.00 H new ATOM 0 HA3 GLY A 51 12.847 4.715 -8.215 1.00 0.00 H new ATOM 697 N SER A 52 10.442 4.526 -8.738 1.00 0.00 N ATOM 698 CA SER A 52 9.030 4.356 -9.024 1.00 0.00 C ATOM 699 C SER A 52 8.309 3.545 -7.947 1.00 0.00 C ATOM 700 O SER A 52 7.352 4.017 -7.331 1.00 0.00 O ATOM 701 CB SER A 52 8.894 3.664 -10.376 1.00 0.00 C ATOM 702 OG SER A 52 9.817 2.585 -10.474 1.00 0.00 O ATOM 0 H SER A 52 11.029 3.754 -9.053 1.00 0.00 H new ATOM 0 HA SER A 52 8.562 5.340 -9.041 1.00 0.00 H new ATOM 0 HB2 SER A 52 7.877 3.294 -10.502 1.00 0.00 H new ATOM 0 HB3 SER A 52 9.074 4.380 -11.178 1.00 0.00 H new ATOM 0 HG SER A 52 9.718 2.148 -11.346 1.00 0.00 H new ATOM 708 N GLN A 53 8.781 2.328 -7.721 1.00 0.00 N ATOM 709 CA GLN A 53 8.045 1.357 -6.924 1.00 0.00 C ATOM 710 C GLN A 53 8.776 1.003 -5.630 1.00 0.00 C ATOM 711 O GLN A 53 10.003 1.062 -5.565 1.00 0.00 O ATOM 712 CB GLN A 53 7.816 0.101 -7.779 1.00 0.00 C ATOM 713 CG GLN A 53 6.973 -0.979 -7.119 1.00 0.00 C ATOM 714 CD GLN A 53 6.762 -2.186 -8.016 1.00 0.00 C ATOM 715 OE1 GLN A 53 6.759 -2.075 -9.237 1.00 0.00 O ATOM 716 NE2 GLN A 53 6.578 -3.351 -7.413 1.00 0.00 N ATOM 0 H GLN A 53 9.673 1.988 -8.080 1.00 0.00 H new ATOM 0 HA GLN A 53 7.091 1.794 -6.630 1.00 0.00 H new ATOM 0 HB2 GLN A 53 7.336 0.397 -8.712 1.00 0.00 H new ATOM 0 HB3 GLN A 53 8.785 -0.324 -8.040 1.00 0.00 H new ATOM 0 HG2 GLN A 53 7.456 -1.298 -6.195 1.00 0.00 H new ATOM 0 HG3 GLN A 53 6.004 -0.561 -6.845 1.00 0.00 H new ATOM 0 HE21 GLN A 53 6.587 -3.405 -6.394 1.00 0.00 H new ATOM 0 HE22 GLN A 53 6.427 -4.194 -7.967 1.00 0.00 H new ATOM 725 N TYR A 54 8.004 0.620 -4.612 1.00 0.00 N ATOM 726 CA TYR A 54 8.554 0.211 -3.326 1.00 0.00 C ATOM 727 C TYR A 54 7.724 -0.904 -2.692 1.00 0.00 C ATOM 728 O TYR A 54 6.724 -0.664 -2.028 1.00 0.00 O ATOM 729 CB TYR A 54 8.736 1.395 -2.346 1.00 0.00 C ATOM 730 CG TYR A 54 7.607 2.403 -2.173 1.00 0.00 C ATOM 731 CD1 TYR A 54 6.718 2.732 -3.191 1.00 0.00 C ATOM 732 CD2 TYR A 54 7.463 3.054 -0.954 1.00 0.00 C ATOM 733 CE1 TYR A 54 5.721 3.674 -2.993 1.00 0.00 C ATOM 734 CE2 TYR A 54 6.472 3.991 -0.750 1.00 0.00 C ATOM 735 CZ TYR A 54 5.604 4.297 -1.769 1.00 0.00 C ATOM 736 OH TYR A 54 4.618 5.231 -1.567 1.00 0.00 O ATOM 0 H TYR A 54 6.986 0.586 -4.658 1.00 0.00 H new ATOM 0 HA TYR A 54 9.550 -0.181 -3.532 1.00 0.00 H new ATOM 0 HB2 TYR A 54 8.954 0.976 -1.364 1.00 0.00 H new ATOM 0 HB3 TYR A 54 9.622 1.947 -2.661 1.00 0.00 H new ATOM 0 HD1 TYR A 54 6.806 2.245 -4.151 1.00 0.00 H new ATOM 0 HD2 TYR A 54 8.143 2.821 -0.148 1.00 0.00 H new ATOM 0 HE1 TYR A 54 5.039 3.919 -3.794 1.00 0.00 H new ATOM 0 HE2 TYR A 54 6.379 4.482 0.207 1.00 0.00 H new ATOM 0 HH TYR A 54 3.944 4.868 -0.955 1.00 0.00 H new ATOM 746 N ALA A 55 8.154 -2.136 -2.927 1.00 0.00 N ATOM 747 CA ALA A 55 7.459 -3.310 -2.417 1.00 0.00 C ATOM 748 C ALA A 55 8.062 -3.800 -1.097 1.00 0.00 C ATOM 749 O ALA A 55 9.257 -3.630 -0.850 1.00 0.00 O ATOM 750 CB ALA A 55 7.485 -4.407 -3.453 1.00 0.00 C ATOM 0 H ALA A 55 8.989 -2.349 -3.473 1.00 0.00 H new ATOM 0 HA ALA A 55 6.425 -3.030 -2.213 1.00 0.00 H new ATOM 0 HB1 ALA A 55 6.964 -5.284 -3.068 1.00 0.00 H new ATOM 0 HB2 ALA A 55 6.991 -4.061 -4.361 1.00 0.00 H new ATOM 0 HB3 ALA A 55 8.518 -4.669 -3.679 1.00 0.00 H new ATOM 756 N ILE A 56 7.227 -4.425 -0.273 1.00 0.00 N ATOM 757 CA ILE A 56 7.625 -4.929 1.035 1.00 0.00 C ATOM 758 C ILE A 56 6.868 -6.195 1.371 1.00 0.00 C ATOM 759 O ILE A 56 5.655 -6.246 1.265 1.00 0.00 O ATOM 760 CB ILE A 56 7.366 -3.886 2.142 1.00 0.00 C ATOM 761 CG1 ILE A 56 8.488 -2.866 2.179 1.00 0.00 C ATOM 762 CG2 ILE A 56 7.170 -4.540 3.509 1.00 0.00 C ATOM 763 CD1 ILE A 56 9.822 -3.475 2.491 1.00 0.00 C ATOM 0 H ILE A 56 6.247 -4.597 -0.497 1.00 0.00 H new ATOM 0 HA ILE A 56 8.694 -5.139 0.987 1.00 0.00 H new ATOM 0 HB ILE A 56 6.436 -3.371 1.902 1.00 0.00 H new ATOM 0 HG12 ILE A 56 8.543 -2.359 1.216 1.00 0.00 H new ATOM 0 HG13 ILE A 56 8.257 -2.107 2.926 1.00 0.00 H new ATOM 0 HG21 ILE A 56 6.991 -3.769 4.259 1.00 0.00 H new ATOM 0 HG22 ILE A 56 6.315 -5.215 3.470 1.00 0.00 H new ATOM 0 HG23 ILE A 56 8.065 -5.103 3.775 1.00 0.00 H new ATOM 0 HD11 ILE A 56 10.584 -2.696 2.503 1.00 0.00 H new ATOM 0 HD12 ILE A 56 9.782 -3.959 3.467 1.00 0.00 H new ATOM 0 HD13 ILE A 56 10.071 -4.214 1.730 1.00 0.00 H new ATOM 775 N SER A 57 7.594 -7.210 1.762 1.00 0.00 N ATOM 776 CA SER A 57 6.994 -8.442 2.216 1.00 0.00 C ATOM 777 C SER A 57 7.273 -8.626 3.702 1.00 0.00 C ATOM 778 O SER A 57 8.312 -8.189 4.205 1.00 0.00 O ATOM 779 CB SER A 57 7.539 -9.605 1.394 1.00 0.00 C ATOM 780 OG SER A 57 6.832 -10.806 1.657 1.00 0.00 O ATOM 0 H SER A 57 8.614 -7.208 1.776 1.00 0.00 H new ATOM 0 HA SER A 57 5.913 -8.408 2.078 1.00 0.00 H new ATOM 0 HB2 SER A 57 7.469 -9.366 0.333 1.00 0.00 H new ATOM 0 HB3 SER A 57 8.596 -9.747 1.620 1.00 0.00 H new ATOM 0 HG SER A 57 7.205 -11.531 1.113 1.00 0.00 H new ATOM 786 N SER A 58 6.319 -9.248 4.388 1.00 0.00 N ATOM 787 CA SER A 58 6.354 -9.423 5.838 1.00 0.00 C ATOM 788 C SER A 58 7.710 -9.890 6.335 1.00 0.00 C ATOM 789 O SER A 58 8.134 -10.974 6.016 1.00 0.00 O ATOM 790 CB SER A 58 5.314 -10.451 6.263 1.00 0.00 C ATOM 791 OG SER A 58 5.314 -10.621 7.671 1.00 0.00 O ATOM 0 H SER A 58 5.490 -9.649 3.949 1.00 0.00 H new ATOM 0 HA SER A 58 6.143 -8.447 6.275 1.00 0.00 H new ATOM 0 HB2 SER A 58 4.326 -10.132 5.931 1.00 0.00 H new ATOM 0 HB3 SER A 58 5.521 -11.405 5.778 1.00 0.00 H new ATOM 0 HG SER A 58 4.399 -10.786 7.981 1.00 0.00 H new ATOM 797 N THR A 59 8.371 -9.095 7.151 1.00 0.00 N ATOM 798 CA THR A 59 9.640 -9.505 7.739 1.00 0.00 C ATOM 799 C THR A 59 9.444 -10.694 8.683 1.00 0.00 C ATOM 800 O THR A 59 10.406 -11.344 9.091 1.00 0.00 O ATOM 801 CB THR A 59 10.284 -8.334 8.496 1.00 0.00 C ATOM 802 OG1 THR A 59 9.460 -7.161 8.373 1.00 0.00 O ATOM 803 CG2 THR A 59 11.662 -8.055 7.933 1.00 0.00 C ATOM 0 H THR A 59 8.056 -8.164 7.424 1.00 0.00 H new ATOM 0 HA THR A 59 10.304 -9.811 6.930 1.00 0.00 H new ATOM 0 HB THR A 59 10.375 -8.597 9.550 1.00 0.00 H new ATOM 0 HG1 THR A 59 9.874 -6.418 8.859 1.00 0.00 H new ATOM 0 HG21 THR A 59 12.114 -7.224 8.473 1.00 0.00 H new ATOM 0 HG22 THR A 59 12.286 -8.942 8.043 1.00 0.00 H new ATOM 0 HG23 THR A 59 11.578 -7.799 6.877 1.00 0.00 H new ATOM 811 N ALA A 60 8.185 -10.967 9.013 1.00 0.00 N ATOM 812 CA ALA A 60 7.825 -12.078 9.877 1.00 0.00 C ATOM 813 C ALA A 60 7.794 -13.403 9.116 1.00 0.00 C ATOM 814 O ALA A 60 8.545 -14.326 9.428 1.00 0.00 O ATOM 815 CB ALA A 60 6.479 -11.814 10.531 1.00 0.00 C ATOM 0 H ALA A 60 7.387 -10.421 8.687 1.00 0.00 H new ATOM 0 HA ALA A 60 8.591 -12.161 10.648 1.00 0.00 H new ATOM 0 HB1 ALA A 60 6.218 -12.652 11.177 1.00 0.00 H new ATOM 0 HB2 ALA A 60 6.536 -10.902 11.125 1.00 0.00 H new ATOM 0 HB3 ALA A 60 5.717 -11.698 9.761 1.00 0.00 H new ATOM 821 N ASN A 61 6.930 -13.488 8.109 1.00 0.00 N ATOM 822 CA ASN A 61 6.698 -14.749 7.398 1.00 0.00 C ATOM 823 C ASN A 61 7.134 -14.665 5.940 1.00 0.00 C ATOM 824 O ASN A 61 7.058 -15.644 5.200 1.00 0.00 O ATOM 825 CB ASN A 61 5.214 -15.135 7.472 1.00 0.00 C ATOM 826 CG ASN A 61 4.278 -14.088 6.883 1.00 0.00 C ATOM 827 OD1 ASN A 61 4.612 -13.380 5.933 1.00 0.00 O ATOM 828 ND2 ASN A 61 3.096 -13.975 7.455 1.00 0.00 N ATOM 0 H ASN A 61 6.378 -12.702 7.765 1.00 0.00 H new ATOM 0 HA ASN A 61 7.301 -15.515 7.887 1.00 0.00 H new ATOM 0 HB2 ASN A 61 5.067 -16.078 6.946 1.00 0.00 H new ATOM 0 HB3 ASN A 61 4.944 -15.306 8.514 1.00 0.00 H new ATOM 0 HD21 ASN A 61 2.427 -13.285 7.112 1.00 0.00 H new ATOM 0 HD22 ASN A 61 2.850 -14.577 8.241 1.00 0.00 H new ATOM 835 N GLN A 62 7.623 -13.483 5.579 1.00 0.00 N ATOM 836 CA GLN A 62 7.986 -13.101 4.218 1.00 0.00 C ATOM 837 C GLN A 62 7.123 -13.707 3.121 1.00 0.00 C ATOM 838 O GLN A 62 7.615 -14.108 2.067 1.00 0.00 O ATOM 839 CB GLN A 62 9.463 -13.334 4.008 1.00 0.00 C ATOM 840 CG GLN A 62 10.268 -12.309 4.761 1.00 0.00 C ATOM 841 CD GLN A 62 11.726 -12.638 4.934 1.00 0.00 C ATOM 842 OE1 GLN A 62 12.343 -13.309 4.108 1.00 0.00 O ATOM 843 NE2 GLN A 62 12.279 -12.150 6.031 1.00 0.00 N ATOM 0 H GLN A 62 7.784 -12.735 6.253 1.00 0.00 H new ATOM 0 HA GLN A 62 7.774 -12.036 4.123 1.00 0.00 H new ATOM 0 HB2 GLN A 62 9.731 -14.335 4.345 1.00 0.00 H new ATOM 0 HB3 GLN A 62 9.698 -13.281 2.945 1.00 0.00 H new ATOM 0 HG2 GLN A 62 10.187 -11.354 4.242 1.00 0.00 H new ATOM 0 HG3 GLN A 62 9.823 -12.174 5.747 1.00 0.00 H new ATOM 0 HE21 GLN A 62 11.720 -11.599 6.683 1.00 0.00 H new ATOM 0 HE22 GLN A 62 13.265 -12.324 6.226 1.00 0.00 H new ATOM 852 N VAL A 63 5.821 -13.724 3.367 1.00 0.00 N ATOM 853 CA VAL A 63 4.859 -13.988 2.325 1.00 0.00 C ATOM 854 C VAL A 63 3.886 -12.813 2.206 1.00 0.00 C ATOM 855 O VAL A 63 3.751 -12.234 1.136 1.00 0.00 O ATOM 856 CB VAL A 63 4.105 -15.327 2.542 1.00 0.00 C ATOM 857 CG1 VAL A 63 3.381 -15.372 3.873 1.00 0.00 C ATOM 858 CG2 VAL A 63 3.142 -15.597 1.399 1.00 0.00 C ATOM 0 H VAL A 63 5.412 -13.556 4.286 1.00 0.00 H new ATOM 0 HA VAL A 63 5.403 -14.093 1.386 1.00 0.00 H new ATOM 0 HB VAL A 63 4.858 -16.115 2.559 1.00 0.00 H new ATOM 0 HG11 VAL A 63 2.869 -16.329 3.977 1.00 0.00 H new ATOM 0 HG12 VAL A 63 4.101 -15.256 4.683 1.00 0.00 H new ATOM 0 HG13 VAL A 63 2.651 -14.564 3.918 1.00 0.00 H new ATOM 0 HG21 VAL A 63 2.625 -16.541 1.574 1.00 0.00 H new ATOM 0 HG22 VAL A 63 2.412 -14.789 1.340 1.00 0.00 H new ATOM 0 HG23 VAL A 63 3.696 -15.655 0.462 1.00 0.00 H new ATOM 868 N THR A 64 3.251 -12.428 3.311 1.00 0.00 N ATOM 869 CA THR A 64 2.264 -11.359 3.290 1.00 0.00 C ATOM 870 C THR A 64 2.924 -10.040 2.903 1.00 0.00 C ATOM 871 O THR A 64 3.628 -9.427 3.704 1.00 0.00 O ATOM 872 CB THR A 64 1.551 -11.255 4.646 1.00 0.00 C ATOM 873 OG1 THR A 64 1.026 -12.545 4.995 1.00 0.00 O ATOM 874 CG2 THR A 64 0.417 -10.246 4.589 1.00 0.00 C ATOM 0 H THR A 64 3.405 -12.842 4.230 1.00 0.00 H new ATOM 0 HA THR A 64 1.509 -11.590 2.539 1.00 0.00 H new ATOM 0 HB THR A 64 2.268 -10.921 5.396 1.00 0.00 H new ATOM 0 HG1 THR A 64 0.615 -12.955 4.206 1.00 0.00 H new ATOM 0 HG21 THR A 64 -0.071 -10.192 5.562 1.00 0.00 H new ATOM 0 HG22 THR A 64 0.815 -9.266 4.328 1.00 0.00 H new ATOM 0 HG23 THR A 64 -0.308 -10.556 3.836 1.00 0.00 H new ATOM 882 N ALA A 65 2.710 -9.623 1.664 1.00 0.00 N ATOM 883 CA ALA A 65 3.457 -8.520 1.096 1.00 0.00 C ATOM 884 C ALA A 65 2.584 -7.308 0.779 1.00 0.00 C ATOM 885 O ALA A 65 1.374 -7.303 1.024 1.00 0.00 O ATOM 886 CB ALA A 65 4.167 -8.998 -0.155 1.00 0.00 C ATOM 0 H ALA A 65 2.022 -10.036 1.034 1.00 0.00 H new ATOM 0 HA ALA A 65 4.179 -8.190 1.843 1.00 0.00 H new ATOM 0 HB1 ALA A 65 4.732 -8.174 -0.590 1.00 0.00 H new ATOM 0 HB2 ALA A 65 4.848 -9.810 0.101 1.00 0.00 H new ATOM 0 HB3 ALA A 65 3.432 -9.354 -0.877 1.00 0.00 H new ATOM 892 N PHE A 66 3.226 -6.304 0.199 1.00 0.00 N ATOM 893 CA PHE A 66 2.603 -5.035 -0.125 1.00 0.00 C ATOM 894 C PHE A 66 3.434 -4.323 -1.199 1.00 0.00 C ATOM 895 O PHE A 66 4.623 -4.069 -1.023 1.00 0.00 O ATOM 896 CB PHE A 66 2.452 -4.181 1.164 1.00 0.00 C ATOM 897 CG PHE A 66 3.124 -2.827 1.155 1.00 0.00 C ATOM 898 CD1 PHE A 66 2.551 -1.772 0.462 1.00 0.00 C ATOM 899 CD2 PHE A 66 4.314 -2.597 1.854 1.00 0.00 C ATOM 900 CE1 PHE A 66 3.143 -0.529 0.458 1.00 0.00 C ATOM 901 CE2 PHE A 66 4.899 -1.356 1.847 1.00 0.00 C ATOM 902 CZ PHE A 66 4.318 -0.321 1.151 1.00 0.00 C ATOM 0 H PHE A 66 4.211 -6.352 -0.063 1.00 0.00 H new ATOM 0 HA PHE A 66 1.603 -5.194 -0.528 1.00 0.00 H new ATOM 0 HB2 PHE A 66 1.389 -4.034 1.354 1.00 0.00 H new ATOM 0 HB3 PHE A 66 2.849 -4.754 2.002 1.00 0.00 H new ATOM 0 HD1 PHE A 66 1.630 -1.927 -0.081 1.00 0.00 H new ATOM 0 HD2 PHE A 66 4.776 -3.403 2.404 1.00 0.00 H new ATOM 0 HE1 PHE A 66 2.687 0.284 -0.088 1.00 0.00 H new ATOM 0 HE2 PHE A 66 5.818 -1.191 2.389 1.00 0.00 H new ATOM 0 HZ PHE A 66 4.782 0.654 1.147 1.00 0.00 H new ATOM 912 N VAL A 67 2.811 -4.056 -2.334 1.00 0.00 N ATOM 913 CA VAL A 67 3.472 -3.381 -3.440 1.00 0.00 C ATOM 914 C VAL A 67 3.054 -1.921 -3.501 1.00 0.00 C ATOM 915 O VAL A 67 1.908 -1.602 -3.817 1.00 0.00 O ATOM 916 CB VAL A 67 3.158 -4.058 -4.794 1.00 0.00 C ATOM 917 CG1 VAL A 67 3.723 -3.252 -5.946 1.00 0.00 C ATOM 918 CG2 VAL A 67 3.751 -5.444 -4.838 1.00 0.00 C ATOM 0 H VAL A 67 1.837 -4.299 -2.515 1.00 0.00 H new ATOM 0 HA VAL A 67 4.545 -3.448 -3.261 1.00 0.00 H new ATOM 0 HB VAL A 67 2.074 -4.115 -4.891 1.00 0.00 H new ATOM 0 HG11 VAL A 67 3.489 -3.749 -6.887 1.00 0.00 H new ATOM 0 HG12 VAL A 67 3.283 -2.255 -5.943 1.00 0.00 H new ATOM 0 HG13 VAL A 67 4.805 -3.171 -5.838 1.00 0.00 H new ATOM 0 HG21 VAL A 67 3.521 -5.908 -5.797 1.00 0.00 H new ATOM 0 HG22 VAL A 67 4.832 -5.381 -4.715 1.00 0.00 H new ATOM 0 HG23 VAL A 67 3.329 -6.046 -4.034 1.00 0.00 H new ATOM 928 N ALA A 68 3.974 -1.044 -3.161 1.00 0.00 N ATOM 929 CA ALA A 68 3.728 0.380 -3.241 1.00 0.00 C ATOM 930 C ALA A 68 4.286 0.948 -4.543 1.00 0.00 C ATOM 931 O ALA A 68 5.260 0.421 -5.078 1.00 0.00 O ATOM 932 CB ALA A 68 4.354 1.074 -2.043 1.00 0.00 C ATOM 0 H ALA A 68 4.904 -1.294 -2.825 1.00 0.00 H new ATOM 0 HA ALA A 68 2.652 0.556 -3.230 1.00 0.00 H new ATOM 0 HB1 ALA A 68 4.168 2.146 -2.105 1.00 0.00 H new ATOM 0 HB2 ALA A 68 3.915 0.682 -1.125 1.00 0.00 H new ATOM 0 HB3 ALA A 68 5.429 0.892 -2.038 1.00 0.00 H new ATOM 938 N GLY A 69 3.686 2.024 -5.046 1.00 0.00 N ATOM 939 CA GLY A 69 4.189 2.649 -6.259 1.00 0.00 C ATOM 940 C GLY A 69 3.778 4.106 -6.391 1.00 0.00 C ATOM 941 O GLY A 69 2.636 4.468 -6.089 1.00 0.00 O ATOM 0 H GLY A 69 2.865 2.473 -4.639 1.00 0.00 H new ATOM 0 HA2 GLY A 69 5.277 2.582 -6.272 1.00 0.00 H new ATOM 0 HA3 GLY A 69 3.825 2.095 -7.124 1.00 0.00 H new ATOM 945 N GLY A 70 4.705 4.940 -6.855 1.00 0.00 N ATOM 946 CA GLY A 70 4.421 6.353 -7.033 1.00 0.00 C ATOM 947 C GLY A 70 5.564 7.092 -7.707 1.00 0.00 C ATOM 948 O GLY A 70 5.930 6.783 -8.840 1.00 0.00 O ATOM 0 H GLY A 70 5.652 4.660 -7.112 1.00 0.00 H new ATOM 0 HA2 GLY A 70 3.516 6.467 -7.630 1.00 0.00 H new ATOM 0 HA3 GLY A 70 4.221 6.806 -6.062 1.00 0.00 H new ATOM 952 N ASN A 71 6.141 8.055 -7.002 1.00 0.00 N ATOM 953 CA ASN A 71 7.243 8.854 -7.538 1.00 0.00 C ATOM 954 C ASN A 71 8.193 9.203 -6.401 1.00 0.00 C ATOM 955 O ASN A 71 8.255 10.339 -5.942 1.00 0.00 O ATOM 956 CB ASN A 71 6.717 10.133 -8.197 1.00 0.00 C ATOM 957 CG ASN A 71 7.741 10.795 -9.088 1.00 0.00 C ATOM 958 OD1 ASN A 71 8.563 9.991 -9.729 1.00 0.00 O flip ATOM 959 ND2 ASN A 71 7.779 12.021 -9.211 1.00 0.00 N flip ATOM 0 H ASN A 71 5.865 8.306 -6.053 1.00 0.00 H new ATOM 0 HA ASN A 71 7.769 8.277 -8.299 1.00 0.00 H new ATOM 0 HB2 ASN A 71 5.830 9.895 -8.784 1.00 0.00 H new ATOM 0 HB3 ASN A 71 6.408 10.835 -7.422 1.00 0.00 H new ATOM 0 HD21 ASN A 71 7.122 12.606 -8.695 1.00 0.00 H new ATOM 0 HD22 ASN A 71 8.467 12.450 -9.829 1.00 0.00 H new ATOM 966 N LEU A 72 8.930 8.202 -5.969 1.00 0.00 N ATOM 967 CA LEU A 72 9.652 8.232 -4.708 1.00 0.00 C ATOM 968 C LEU A 72 10.989 8.922 -4.793 1.00 0.00 C ATOM 969 O LEU A 72 11.573 9.074 -5.867 1.00 0.00 O ATOM 970 CB LEU A 72 9.882 6.797 -4.283 1.00 0.00 C ATOM 971 CG LEU A 72 8.676 5.908 -4.441 1.00 0.00 C ATOM 972 CD1 LEU A 72 9.087 4.483 -4.189 1.00 0.00 C ATOM 973 CD2 LEU A 72 7.577 6.359 -3.499 1.00 0.00 C ATOM 0 H LEU A 72 9.048 7.332 -6.488 1.00 0.00 H new ATOM 0 HA LEU A 72 9.051 8.797 -3.995 1.00 0.00 H new ATOM 0 HB2 LEU A 72 10.704 6.384 -4.867 1.00 0.00 H new ATOM 0 HB3 LEU A 72 10.195 6.784 -3.239 1.00 0.00 H new ATOM 0 HG LEU A 72 8.280 5.976 -5.454 1.00 0.00 H new ATOM 0 HD11 LEU A 72 8.222 3.830 -4.301 1.00 0.00 H new ATOM 0 HD12 LEU A 72 9.855 4.194 -4.906 1.00 0.00 H new ATOM 0 HD13 LEU A 72 9.482 4.392 -3.177 1.00 0.00 H new ATOM 0 HD21 LEU A 72 6.708 5.712 -3.618 1.00 0.00 H new ATOM 0 HD22 LEU A 72 7.933 6.302 -2.470 1.00 0.00 H new ATOM 0 HD23 LEU A 72 7.299 7.387 -3.730 1.00 0.00 H new ATOM 985 N THR A 73 11.474 9.307 -3.625 1.00 0.00 N ATOM 986 CA THR A 73 12.788 9.888 -3.480 1.00 0.00 C ATOM 987 C THR A 73 13.288 9.669 -2.050 1.00 0.00 C ATOM 988 O THR A 73 12.631 10.065 -1.086 1.00 0.00 O ATOM 989 CB THR A 73 12.775 11.389 -3.814 1.00 0.00 C ATOM 990 OG1 THR A 73 12.239 11.599 -5.130 1.00 0.00 O ATOM 991 CG2 THR A 73 14.183 11.958 -3.748 1.00 0.00 C ATOM 0 H THR A 73 10.960 9.223 -2.748 1.00 0.00 H new ATOM 0 HA THR A 73 13.462 9.397 -4.182 1.00 0.00 H new ATOM 0 HB THR A 73 12.148 11.898 -3.082 1.00 0.00 H new ATOM 0 HG1 THR A 73 12.234 12.558 -5.332 1.00 0.00 H new ATOM 0 HG21 THR A 73 14.157 13.021 -3.987 1.00 0.00 H new ATOM 0 HG22 THR A 73 14.584 11.821 -2.744 1.00 0.00 H new ATOM 0 HG23 THR A 73 14.819 11.440 -4.466 1.00 0.00 H new ATOM 999 N TYR A 74 14.428 9.004 -1.923 1.00 0.00 N ATOM 1000 CA TYR A 74 14.998 8.696 -0.620 1.00 0.00 C ATOM 1001 C TYR A 74 16.021 9.768 -0.229 1.00 0.00 C ATOM 1002 O TYR A 74 17.032 9.964 -0.900 1.00 0.00 O ATOM 1003 CB TYR A 74 15.629 7.305 -0.654 1.00 0.00 C ATOM 1004 CG TYR A 74 16.339 6.910 0.615 1.00 0.00 C ATOM 1005 CD1 TYR A 74 17.650 7.281 0.812 1.00 0.00 C ATOM 1006 CD2 TYR A 74 15.711 6.159 1.598 1.00 0.00 C ATOM 1007 CE1 TYR A 74 18.332 6.927 1.947 1.00 0.00 C ATOM 1008 CE2 TYR A 74 16.384 5.797 2.752 1.00 0.00 C ATOM 1009 CZ TYR A 74 17.699 6.185 2.921 1.00 0.00 C ATOM 1010 OH TYR A 74 18.379 5.831 4.062 1.00 0.00 O ATOM 0 H TYR A 74 14.979 8.666 -2.712 1.00 0.00 H new ATOM 0 HA TYR A 74 14.212 8.695 0.136 1.00 0.00 H new ATOM 0 HB2 TYR A 74 14.850 6.572 -0.863 1.00 0.00 H new ATOM 0 HB3 TYR A 74 16.338 7.262 -1.481 1.00 0.00 H new ATOM 0 HD1 TYR A 74 18.153 7.864 0.055 1.00 0.00 H new ATOM 0 HD2 TYR A 74 14.684 5.853 1.461 1.00 0.00 H new ATOM 0 HE1 TYR A 74 19.361 7.228 2.078 1.00 0.00 H new ATOM 0 HE2 TYR A 74 15.885 5.216 3.514 1.00 0.00 H new ATOM 0 HH TYR A 74 18.995 6.551 4.312 1.00 0.00 H new ATOM 1020 N THR A 75 15.726 10.468 0.845 1.00 0.00 N ATOM 1021 CA THR A 75 16.478 11.648 1.262 1.00 0.00 C ATOM 1022 C THR A 75 17.768 11.354 2.042 1.00 0.00 C ATOM 1023 O THR A 75 17.987 11.983 3.074 1.00 0.00 O ATOM 1024 CB THR A 75 15.594 12.517 2.159 1.00 0.00 C ATOM 1025 OG1 THR A 75 14.946 11.683 3.102 1.00 0.00 O ATOM 1026 CG2 THR A 75 14.557 13.268 1.373 1.00 0.00 C ATOM 0 H THR A 75 14.950 10.237 1.465 1.00 0.00 H new ATOM 0 HA THR A 75 16.768 12.143 0.335 1.00 0.00 H new ATOM 0 HB THR A 75 16.230 13.251 2.654 1.00 0.00 H new ATOM 0 HG1 THR A 75 15.093 12.034 4.005 1.00 0.00 H new ATOM 0 HG21 THR A 75 13.953 13.871 2.051 1.00 0.00 H new ATOM 0 HG22 THR A 75 15.049 13.918 0.649 1.00 0.00 H new ATOM 0 HG23 THR A 75 13.916 12.560 0.848 1.00 0.00 H new ATOM 1034 N LEU A 76 18.629 10.446 1.594 1.00 0.00 N ATOM 1035 CA LEU A 76 19.857 10.179 2.359 1.00 0.00 C ATOM 1036 C LEU A 76 20.716 11.413 2.498 1.00 0.00 C ATOM 1037 O LEU A 76 21.014 11.842 3.609 1.00 0.00 O ATOM 1038 CB LEU A 76 20.724 9.047 1.817 1.00 0.00 C ATOM 1039 CG LEU A 76 21.194 9.117 0.378 1.00 0.00 C ATOM 1040 CD1 LEU A 76 22.147 7.968 0.089 1.00 0.00 C ATOM 1041 CD2 LEU A 76 20.035 9.078 -0.597 1.00 0.00 C ATOM 0 H LEU A 76 18.515 9.898 0.741 1.00 0.00 H new ATOM 0 HA LEU A 76 19.481 9.860 3.331 1.00 0.00 H new ATOM 0 HB2 LEU A 76 21.608 8.975 2.451 1.00 0.00 H new ATOM 0 HB3 LEU A 76 20.168 8.117 1.939 1.00 0.00 H new ATOM 0 HG LEU A 76 21.709 10.068 0.245 1.00 0.00 H new ATOM 0 HD11 LEU A 76 22.481 8.024 -0.947 1.00 0.00 H new ATOM 0 HD12 LEU A 76 23.009 8.035 0.752 1.00 0.00 H new ATOM 0 HD13 LEU A 76 21.635 7.020 0.254 1.00 0.00 H new ATOM 0 HD21 LEU A 76 20.416 9.130 -1.617 1.00 0.00 H new ATOM 0 HD22 LEU A 76 19.479 8.150 -0.464 1.00 0.00 H new ATOM 0 HD23 LEU A 76 19.375 9.926 -0.412 1.00 0.00 H new ATOM 1053 N PHE A 77 21.105 11.991 1.380 1.00 0.00 N ATOM 1054 CA PHE A 77 21.959 13.164 1.419 1.00 0.00 C ATOM 1055 C PHE A 77 21.099 14.417 1.467 1.00 0.00 C ATOM 1056 O PHE A 77 21.600 15.541 1.475 1.00 0.00 O ATOM 1057 CB PHE A 77 22.877 13.225 0.192 1.00 0.00 C ATOM 1058 CG PHE A 77 23.671 11.973 -0.047 1.00 0.00 C ATOM 1059 CD1 PHE A 77 24.051 11.164 1.007 1.00 0.00 C ATOM 1060 CD2 PHE A 77 24.034 11.608 -1.332 1.00 0.00 C ATOM 1061 CE1 PHE A 77 24.777 10.015 0.787 1.00 0.00 C ATOM 1062 CE2 PHE A 77 24.763 10.457 -1.559 1.00 0.00 C ATOM 1063 CZ PHE A 77 25.135 9.660 -0.497 1.00 0.00 C ATOM 0 H PHE A 77 20.849 11.675 0.445 1.00 0.00 H new ATOM 0 HA PHE A 77 22.582 13.102 2.311 1.00 0.00 H new ATOM 0 HB2 PHE A 77 22.272 13.432 -0.691 1.00 0.00 H new ATOM 0 HB3 PHE A 77 23.566 14.062 0.309 1.00 0.00 H new ATOM 0 HD1 PHE A 77 23.775 11.436 2.015 1.00 0.00 H new ATOM 0 HD2 PHE A 77 23.744 12.230 -2.166 1.00 0.00 H new ATOM 0 HE1 PHE A 77 25.066 9.391 1.620 1.00 0.00 H new ATOM 0 HE2 PHE A 77 25.041 10.182 -2.566 1.00 0.00 H new ATOM 0 HZ PHE A 77 25.706 8.760 -0.670 1.00 0.00 H new ATOM 1073 N ASN A 78 19.794 14.202 1.500 1.00 0.00 N ATOM 1074 CA ASN A 78 18.830 15.298 1.418 1.00 0.00 C ATOM 1075 C ASN A 78 18.481 15.869 2.792 1.00 0.00 C ATOM 1076 O ASN A 78 18.967 15.393 3.816 1.00 0.00 O ATOM 1077 CB ASN A 78 17.565 14.849 0.687 1.00 0.00 C ATOM 1078 CG ASN A 78 17.737 14.819 -0.822 1.00 0.00 C ATOM 1079 OD1 ASN A 78 17.462 15.805 -1.503 1.00 0.00 O ATOM 1080 ND2 ASN A 78 18.181 13.691 -1.357 1.00 0.00 N ATOM 0 H ASN A 78 19.372 13.277 1.583 1.00 0.00 H new ATOM 0 HA ASN A 78 19.304 16.098 0.849 1.00 0.00 H new ATOM 0 HB2 ASN A 78 17.282 13.856 1.036 1.00 0.00 H new ATOM 0 HB3 ASN A 78 16.746 15.521 0.942 1.00 0.00 H new ATOM 0 HD21 ASN A 78 18.305 13.620 -2.367 1.00 0.00 H new ATOM 0 HD22 ASN A 78 18.399 12.894 -0.759 1.00 0.00 H new ATOM 1087 N GLU A 79 17.618 16.888 2.783 1.00 0.00 N ATOM 1088 CA GLU A 79 17.278 17.669 3.979 1.00 0.00 C ATOM 1089 C GLU A 79 16.811 16.815 5.175 1.00 0.00 C ATOM 1090 O GLU A 79 17.511 16.766 6.186 1.00 0.00 O ATOM 1091 CB GLU A 79 16.240 18.736 3.632 1.00 0.00 C ATOM 1092 CG GLU A 79 16.736 19.736 2.608 1.00 0.00 C ATOM 1093 CD GLU A 79 17.896 20.556 3.125 1.00 0.00 C ATOM 1094 OE1 GLU A 79 17.661 21.454 3.955 1.00 0.00 O ATOM 1095 OE2 GLU A 79 19.047 20.292 2.716 1.00 0.00 O ATOM 0 H GLU A 79 17.132 17.198 1.942 1.00 0.00 H new ATOM 0 HA GLU A 79 18.202 18.146 4.306 1.00 0.00 H new ATOM 0 HB2 GLU A 79 15.342 18.250 3.251 1.00 0.00 H new ATOM 0 HB3 GLU A 79 15.955 19.266 4.541 1.00 0.00 H new ATOM 0 HG2 GLU A 79 17.041 19.207 1.705 1.00 0.00 H new ATOM 0 HG3 GLU A 79 15.920 20.401 2.328 1.00 0.00 H new ATOM 1102 N PRO A 80 15.626 16.147 5.118 1.00 0.00 N ATOM 1103 CA PRO A 80 15.133 15.343 6.256 1.00 0.00 C ATOM 1104 C PRO A 80 16.117 14.258 6.696 1.00 0.00 C ATOM 1105 O PRO A 80 16.124 13.856 7.858 1.00 0.00 O ATOM 1106 CB PRO A 80 13.852 14.712 5.721 1.00 0.00 C ATOM 1107 CG PRO A 80 13.400 15.627 4.645 1.00 0.00 C ATOM 1108 CD PRO A 80 14.655 16.139 3.999 1.00 0.00 C ATOM 0 HA PRO A 80 14.987 15.960 7.143 1.00 0.00 H new ATOM 0 HB2 PRO A 80 14.036 13.709 5.336 1.00 0.00 H new ATOM 0 HB3 PRO A 80 13.099 14.620 6.504 1.00 0.00 H new ATOM 0 HG2 PRO A 80 12.773 15.104 3.923 1.00 0.00 H new ATOM 0 HG3 PRO A 80 12.805 16.446 5.050 1.00 0.00 H new ATOM 0 HD2 PRO A 80 14.983 15.492 3.185 1.00 0.00 H new ATOM 0 HD3 PRO A 80 14.515 17.135 3.579 1.00 0.00 H new ATOM 1116 N ALA A 81 16.921 13.790 5.749 1.00 0.00 N ATOM 1117 CA ALA A 81 18.008 12.837 6.010 1.00 0.00 C ATOM 1118 C ALA A 81 17.498 11.436 6.316 1.00 0.00 C ATOM 1119 O ALA A 81 16.809 11.201 7.312 1.00 0.00 O ATOM 1120 CB ALA A 81 18.925 13.333 7.120 1.00 0.00 C ATOM 0 H ALA A 81 16.841 14.060 4.768 1.00 0.00 H new ATOM 0 HA ALA A 81 18.587 12.771 5.089 1.00 0.00 H new ATOM 0 HB1 ALA A 81 19.719 12.605 7.289 1.00 0.00 H new ATOM 0 HB2 ALA A 81 19.364 14.288 6.830 1.00 0.00 H new ATOM 0 HB3 ALA A 81 18.350 13.462 8.037 1.00 0.00 H new ATOM 1126 N HIS A 82 17.843 10.518 5.418 1.00 0.00 N ATOM 1127 CA HIS A 82 17.480 9.108 5.532 1.00 0.00 C ATOM 1128 C HIS A 82 15.978 8.937 5.711 1.00 0.00 C ATOM 1129 O HIS A 82 15.517 8.250 6.621 1.00 0.00 O ATOM 1130 CB HIS A 82 18.232 8.430 6.685 1.00 0.00 C ATOM 1131 CG HIS A 82 19.657 8.106 6.365 1.00 0.00 C ATOM 1132 ND1 HIS A 82 20.151 6.822 6.346 1.00 0.00 N ATOM 1133 CD2 HIS A 82 20.696 8.909 6.037 1.00 0.00 C ATOM 1134 CE1 HIS A 82 21.427 6.848 6.019 1.00 0.00 C ATOM 1135 NE2 HIS A 82 21.784 8.103 5.823 1.00 0.00 N ATOM 0 H HIS A 82 18.387 10.733 4.583 1.00 0.00 H new ATOM 0 HA HIS A 82 17.772 8.624 4.600 1.00 0.00 H new ATOM 0 HB2 HIS A 82 18.204 9.082 7.558 1.00 0.00 H new ATOM 0 HB3 HIS A 82 17.712 7.511 6.956 1.00 0.00 H new ATOM 0 HD2 HIS A 82 20.672 9.986 5.958 1.00 0.00 H new ATOM 0 HE1 HIS A 82 22.072 5.987 5.927 1.00 0.00 H new ATOM 0 HE2 HIS A 82 22.716 8.421 5.556 1.00 0.00 H new ATOM 1144 N THR A 83 15.224 9.560 4.831 1.00 0.00 N ATOM 1145 CA THR A 83 13.784 9.586 4.936 1.00 0.00 C ATOM 1146 C THR A 83 13.161 9.300 3.566 1.00 0.00 C ATOM 1147 O THR A 83 13.883 9.102 2.584 1.00 0.00 O ATOM 1148 CB THR A 83 13.342 10.971 5.461 1.00 0.00 C ATOM 1149 OG1 THR A 83 14.488 11.818 5.602 1.00 0.00 O ATOM 1150 CG2 THR A 83 12.658 10.865 6.809 1.00 0.00 C ATOM 0 H THR A 83 15.593 10.062 4.024 1.00 0.00 H new ATOM 0 HA THR A 83 13.446 8.819 5.632 1.00 0.00 H new ATOM 0 HB THR A 83 12.637 11.387 4.741 1.00 0.00 H new ATOM 0 HG1 THR A 83 14.763 11.842 6.542 1.00 0.00 H new ATOM 0 HG21 THR A 83 12.362 11.858 7.146 1.00 0.00 H new ATOM 0 HG22 THR A 83 11.774 10.233 6.720 1.00 0.00 H new ATOM 0 HG23 THR A 83 13.346 10.427 7.532 1.00 0.00 H new ATOM 1158 N LEU A 84 11.838 9.268 3.499 1.00 0.00 N ATOM 1159 CA LEU A 84 11.151 8.999 2.245 1.00 0.00 C ATOM 1160 C LEU A 84 10.154 10.103 1.944 1.00 0.00 C ATOM 1161 O LEU A 84 9.498 10.609 2.854 1.00 0.00 O ATOM 1162 CB LEU A 84 10.393 7.675 2.292 1.00 0.00 C ATOM 1163 CG LEU A 84 10.046 7.104 0.917 1.00 0.00 C ATOM 1164 CD1 LEU A 84 11.297 6.667 0.179 1.00 0.00 C ATOM 1165 CD2 LEU A 84 9.108 5.940 1.089 1.00 0.00 C ATOM 0 H LEU A 84 11.221 9.424 4.296 1.00 0.00 H new ATOM 0 HA LEU A 84 11.914 8.949 1.468 1.00 0.00 H new ATOM 0 HB2 LEU A 84 10.992 6.945 2.836 1.00 0.00 H new ATOM 0 HB3 LEU A 84 9.472 7.816 2.858 1.00 0.00 H new ATOM 0 HG LEU A 84 9.563 7.880 0.323 1.00 0.00 H new ATOM 0 HD11 LEU A 84 11.022 6.265 -0.796 1.00 0.00 H new ATOM 0 HD12 LEU A 84 11.958 7.523 0.045 1.00 0.00 H new ATOM 0 HD13 LEU A 84 11.811 5.899 0.757 1.00 0.00 H new ATOM 0 HD21 LEU A 84 8.856 5.528 0.112 1.00 0.00 H new ATOM 0 HD22 LEU A 84 9.589 5.171 1.694 1.00 0.00 H new ATOM 0 HD23 LEU A 84 8.198 6.276 1.586 1.00 0.00 H new ATOM 1177 N TYR A 85 10.039 10.458 0.675 1.00 0.00 N ATOM 1178 CA TYR A 85 8.990 11.356 0.216 1.00 0.00 C ATOM 1179 C TYR A 85 8.711 11.069 -1.257 1.00 0.00 C ATOM 1180 O TYR A 85 9.065 9.995 -1.759 1.00 0.00 O ATOM 1181 CB TYR A 85 9.363 12.840 0.456 1.00 0.00 C ATOM 1182 CG TYR A 85 10.364 13.440 -0.514 1.00 0.00 C ATOM 1183 CD1 TYR A 85 11.714 13.162 -0.413 1.00 0.00 C ATOM 1184 CD2 TYR A 85 9.950 14.302 -1.524 1.00 0.00 C ATOM 1185 CE1 TYR A 85 12.625 13.713 -1.290 1.00 0.00 C ATOM 1186 CE2 TYR A 85 10.854 14.858 -2.407 1.00 0.00 C ATOM 1187 CZ TYR A 85 12.191 14.559 -2.284 1.00 0.00 C ATOM 1188 OH TYR A 85 13.103 15.106 -3.156 1.00 0.00 O ATOM 0 H TYR A 85 10.665 10.135 -0.062 1.00 0.00 H new ATOM 0 HA TYR A 85 8.082 11.178 0.792 1.00 0.00 H new ATOM 0 HB2 TYR A 85 8.450 13.434 0.419 1.00 0.00 H new ATOM 0 HB3 TYR A 85 9.764 12.935 1.465 1.00 0.00 H new ATOM 0 HD1 TYR A 85 12.062 12.501 0.367 1.00 0.00 H new ATOM 0 HD2 TYR A 85 8.901 14.541 -1.619 1.00 0.00 H new ATOM 0 HE1 TYR A 85 13.676 13.481 -1.197 1.00 0.00 H new ATOM 0 HE2 TYR A 85 10.514 15.522 -3.188 1.00 0.00 H new ATOM 0 HH TYR A 85 13.291 16.032 -2.895 1.00 0.00 H new ATOM 1198 N GLY A 86 8.117 12.015 -1.954 1.00 0.00 N ATOM 1199 CA GLY A 86 7.730 11.783 -3.322 1.00 0.00 C ATOM 1200 C GLY A 86 6.260 11.457 -3.455 1.00 0.00 C ATOM 1201 O GLY A 86 5.470 11.717 -2.546 1.00 0.00 O ATOM 0 H GLY A 86 7.895 12.944 -1.596 1.00 0.00 H new ATOM 0 HA2 GLY A 86 7.959 12.667 -3.917 1.00 0.00 H new ATOM 0 HA3 GLY A 86 8.320 10.962 -3.730 1.00 0.00 H new ATOM 1205 N GLN A 87 5.890 10.904 -4.594 1.00 0.00 N ATOM 1206 CA GLN A 87 4.502 10.666 -4.908 1.00 0.00 C ATOM 1207 C GLN A 87 4.060 9.274 -4.517 1.00 0.00 C ATOM 1208 O GLN A 87 4.871 8.379 -4.279 1.00 0.00 O ATOM 1209 CB GLN A 87 4.275 10.852 -6.397 1.00 0.00 C ATOM 1210 CG GLN A 87 2.981 11.524 -6.735 1.00 0.00 C ATOM 1211 CD GLN A 87 2.019 10.631 -7.475 1.00 0.00 C ATOM 1212 OE1 GLN A 87 2.417 9.690 -8.159 1.00 0.00 O ATOM 1213 NE2 GLN A 87 0.746 10.945 -7.360 1.00 0.00 N ATOM 0 H GLN A 87 6.542 10.610 -5.321 1.00 0.00 H new ATOM 0 HA GLN A 87 3.913 11.383 -4.336 1.00 0.00 H new ATOM 0 HB2 GLN A 87 5.096 11.439 -6.809 1.00 0.00 H new ATOM 0 HB3 GLN A 87 4.304 9.877 -6.883 1.00 0.00 H new ATOM 0 HG2 GLN A 87 2.509 11.871 -5.816 1.00 0.00 H new ATOM 0 HG3 GLN A 87 3.186 12.406 -7.341 1.00 0.00 H new ATOM 0 HE21 GLN A 87 0.466 11.736 -6.780 1.00 0.00 H new ATOM 0 HE22 GLN A 87 0.039 10.398 -7.851 1.00 0.00 H new ATOM 1222 N LEU A 88 2.760 9.119 -4.514 1.00 0.00 N ATOM 1223 CA LEU A 88 2.103 7.873 -4.195 1.00 0.00 C ATOM 1224 C LEU A 88 0.727 7.862 -4.836 1.00 0.00 C ATOM 1225 O LEU A 88 -0.018 8.839 -4.739 1.00 0.00 O ATOM 1226 CB LEU A 88 1.966 7.692 -2.683 1.00 0.00 C ATOM 1227 CG LEU A 88 1.177 6.457 -2.260 1.00 0.00 C ATOM 1228 CD1 LEU A 88 1.742 5.228 -2.944 1.00 0.00 C ATOM 1229 CD2 LEU A 88 1.226 6.304 -0.754 1.00 0.00 C ATOM 0 H LEU A 88 2.112 9.874 -4.739 1.00 0.00 H new ATOM 0 HA LEU A 88 2.706 7.051 -4.581 1.00 0.00 H new ATOM 0 HB2 LEU A 88 2.963 7.638 -2.245 1.00 0.00 H new ATOM 0 HB3 LEU A 88 1.483 8.576 -2.267 1.00 0.00 H new ATOM 0 HG LEU A 88 0.136 6.572 -2.560 1.00 0.00 H new ATOM 0 HD11 LEU A 88 1.175 4.349 -2.639 1.00 0.00 H new ATOM 0 HD12 LEU A 88 1.671 5.348 -4.025 1.00 0.00 H new ATOM 0 HD13 LEU A 88 2.787 5.102 -2.661 1.00 0.00 H new ATOM 0 HD21 LEU A 88 0.660 5.420 -0.459 1.00 0.00 H new ATOM 0 HD22 LEU A 88 2.262 6.196 -0.433 1.00 0.00 H new ATOM 0 HD23 LEU A 88 0.791 7.186 -0.284 1.00 0.00 H new ATOM 1241 N ASP A 89 0.391 6.771 -5.493 1.00 0.00 N ATOM 1242 CA ASP A 89 -0.907 6.656 -6.137 1.00 0.00 C ATOM 1243 C ASP A 89 -1.559 5.340 -5.796 1.00 0.00 C ATOM 1244 O ASP A 89 -2.745 5.280 -5.469 1.00 0.00 O ATOM 1245 CB ASP A 89 -0.768 6.741 -7.647 1.00 0.00 C ATOM 1246 CG ASP A 89 -2.111 6.882 -8.332 1.00 0.00 C ATOM 1247 OD1 ASP A 89 -2.598 8.022 -8.473 1.00 0.00 O ATOM 1248 OD2 ASP A 89 -2.693 5.849 -8.720 1.00 0.00 O ATOM 0 H ASP A 89 0.993 5.954 -5.597 1.00 0.00 H new ATOM 0 HA ASP A 89 -1.523 7.479 -5.774 1.00 0.00 H new ATOM 0 HB2 ASP A 89 -0.138 7.592 -7.906 1.00 0.00 H new ATOM 0 HB3 ASP A 89 -0.265 5.847 -8.016 1.00 0.00 H new ATOM 1253 N SER A 90 -0.774 4.287 -5.868 1.00 0.00 N ATOM 1254 CA SER A 90 -1.311 2.951 -5.746 1.00 0.00 C ATOM 1255 C SER A 90 -0.545 2.069 -4.765 1.00 0.00 C ATOM 1256 O SER A 90 0.688 2.045 -4.738 1.00 0.00 O ATOM 1257 CB SER A 90 -1.359 2.304 -7.129 1.00 0.00 C ATOM 1258 OG SER A 90 -0.428 2.907 -8.018 1.00 0.00 O ATOM 0 H SER A 90 0.235 4.330 -6.010 1.00 0.00 H new ATOM 0 HA SER A 90 -2.315 3.043 -5.333 1.00 0.00 H new ATOM 0 HB2 SER A 90 -1.143 1.239 -7.042 1.00 0.00 H new ATOM 0 HB3 SER A 90 -2.365 2.393 -7.539 1.00 0.00 H new ATOM 0 HG SER A 90 -0.482 2.470 -8.894 1.00 0.00 H new ATOM 1264 N LEU A 91 -1.316 1.378 -3.932 1.00 0.00 N ATOM 1265 CA LEU A 91 -0.805 0.325 -3.068 1.00 0.00 C ATOM 1266 C LEU A 91 -1.292 -1.005 -3.615 1.00 0.00 C ATOM 1267 O LEU A 91 -2.084 -1.026 -4.554 1.00 0.00 O ATOM 1268 CB LEU A 91 -1.273 0.481 -1.612 1.00 0.00 C ATOM 1269 CG LEU A 91 -0.707 1.677 -0.844 1.00 0.00 C ATOM 1270 CD1 LEU A 91 0.803 1.744 -0.984 1.00 0.00 C ATOM 1271 CD2 LEU A 91 -1.351 2.978 -1.293 1.00 0.00 C ATOM 0 H LEU A 91 -2.319 1.535 -3.838 1.00 0.00 H new ATOM 0 HA LEU A 91 0.284 0.381 -3.060 1.00 0.00 H new ATOM 0 HB2 LEU A 91 -2.360 0.555 -1.608 1.00 0.00 H new ATOM 0 HB3 LEU A 91 -1.013 -0.428 -1.070 1.00 0.00 H new ATOM 0 HG LEU A 91 -0.945 1.536 0.210 1.00 0.00 H new ATOM 0 HD11 LEU A 91 1.182 2.602 -0.429 1.00 0.00 H new ATOM 0 HD12 LEU A 91 1.246 0.831 -0.587 1.00 0.00 H new ATOM 0 HD13 LEU A 91 1.067 1.847 -2.037 1.00 0.00 H new ATOM 0 HD21 LEU A 91 -0.927 3.808 -0.728 1.00 0.00 H new ATOM 0 HD22 LEU A 91 -1.163 3.129 -2.356 1.00 0.00 H new ATOM 0 HD23 LEU A 91 -2.426 2.931 -1.118 1.00 0.00 H new ATOM 1283 N SER A 92 -0.866 -2.103 -3.028 1.00 0.00 N ATOM 1284 CA SER A 92 -1.280 -3.404 -3.516 1.00 0.00 C ATOM 1285 C SER A 92 -0.926 -4.490 -2.507 1.00 0.00 C ATOM 1286 O SER A 92 0.229 -4.878 -2.378 1.00 0.00 O ATOM 1287 CB SER A 92 -0.609 -3.670 -4.865 1.00 0.00 C ATOM 1288 OG SER A 92 -1.160 -4.805 -5.507 1.00 0.00 O ATOM 0 H SER A 92 -0.241 -2.124 -2.222 1.00 0.00 H new ATOM 0 HA SER A 92 -2.362 -3.416 -3.648 1.00 0.00 H new ATOM 0 HB2 SER A 92 -0.723 -2.797 -5.507 1.00 0.00 H new ATOM 0 HB3 SER A 92 0.461 -3.819 -4.717 1.00 0.00 H new ATOM 0 HG SER A 92 -2.055 -4.982 -5.148 1.00 0.00 H new ATOM 1294 N PHE A 93 -1.920 -4.969 -1.783 1.00 0.00 N ATOM 1295 CA PHE A 93 -1.688 -5.962 -0.748 1.00 0.00 C ATOM 1296 C PHE A 93 -1.943 -7.355 -1.305 1.00 0.00 C ATOM 1297 O PHE A 93 -2.814 -7.542 -2.155 1.00 0.00 O ATOM 1298 CB PHE A 93 -2.610 -5.730 0.455 1.00 0.00 C ATOM 1299 CG PHE A 93 -2.547 -4.356 1.079 1.00 0.00 C ATOM 1300 CD1 PHE A 93 -1.645 -3.389 0.650 1.00 0.00 C ATOM 1301 CD2 PHE A 93 -3.416 -4.033 2.106 1.00 0.00 C ATOM 1302 CE1 PHE A 93 -1.626 -2.137 1.234 1.00 0.00 C ATOM 1303 CE2 PHE A 93 -3.391 -2.784 2.691 1.00 0.00 C ATOM 1304 CZ PHE A 93 -2.497 -1.837 2.251 1.00 0.00 C ATOM 0 H PHE A 93 -2.895 -4.688 -1.891 1.00 0.00 H new ATOM 0 HA PHE A 93 -0.652 -5.872 -0.420 1.00 0.00 H new ATOM 0 HB2 PHE A 93 -3.637 -5.919 0.143 1.00 0.00 H new ATOM 0 HB3 PHE A 93 -2.368 -6.467 1.221 1.00 0.00 H new ATOM 0 HD1 PHE A 93 -0.953 -3.618 -0.147 1.00 0.00 H new ATOM 0 HD2 PHE A 93 -4.124 -4.770 2.455 1.00 0.00 H new ATOM 0 HE1 PHE A 93 -0.924 -1.392 0.889 1.00 0.00 H new ATOM 0 HE2 PHE A 93 -4.074 -2.550 3.495 1.00 0.00 H new ATOM 0 HZ PHE A 93 -2.480 -0.857 2.705 1.00 0.00 H new ATOM 1314 N GLY A 94 -1.173 -8.326 -0.847 1.00 0.00 N ATOM 1315 CA GLY A 94 -1.398 -9.693 -1.257 1.00 0.00 C ATOM 1316 C GLY A 94 -0.365 -10.634 -0.676 1.00 0.00 C ATOM 1317 O GLY A 94 0.625 -10.188 -0.094 1.00 0.00 O ATOM 0 H GLY A 94 -0.397 -8.193 -0.199 1.00 0.00 H new ATOM 0 HA2 GLY A 94 -2.393 -10.007 -0.942 1.00 0.00 H new ATOM 0 HA3 GLY A 94 -1.374 -9.754 -2.345 1.00 0.00 H new ATOM 1321 N ASP A 95 -0.583 -11.929 -0.835 1.00 0.00 N ATOM 1322 CA ASP A 95 0.349 -12.927 -0.319 1.00 0.00 C ATOM 1323 C ASP A 95 1.366 -13.350 -1.381 1.00 0.00 C ATOM 1324 O ASP A 95 1.008 -13.923 -2.416 1.00 0.00 O ATOM 1325 CB ASP A 95 -0.404 -14.156 0.190 1.00 0.00 C ATOM 1326 CG ASP A 95 -0.224 -14.402 1.680 1.00 0.00 C ATOM 1327 OD1 ASP A 95 -0.084 -13.429 2.452 1.00 0.00 O ATOM 1328 OD2 ASP A 95 -0.226 -15.584 2.084 1.00 0.00 O ATOM 0 H ASP A 95 -1.395 -12.317 -1.316 1.00 0.00 H new ATOM 0 HA ASP A 95 0.889 -12.467 0.509 1.00 0.00 H new ATOM 0 HB2 ASP A 95 -1.466 -14.037 -0.025 1.00 0.00 H new ATOM 0 HB3 ASP A 95 -0.064 -15.034 -0.359 1.00 0.00 H new ATOM 1333 N GLY A 96 2.626 -13.027 -1.126 1.00 0.00 N ATOM 1334 CA GLY A 96 3.730 -13.537 -1.915 1.00 0.00 C ATOM 1335 C GLY A 96 4.011 -12.731 -3.163 1.00 0.00 C ATOM 1336 O GLY A 96 3.261 -12.795 -4.127 1.00 0.00 O ATOM 0 H GLY A 96 2.908 -12.406 -0.368 1.00 0.00 H new ATOM 0 HA2 GLY A 96 4.628 -13.557 -1.297 1.00 0.00 H new ATOM 0 HA3 GLY A 96 3.516 -14.567 -2.199 1.00 0.00 H new ATOM 1340 N LEU A 97 5.102 -11.982 -3.159 1.00 0.00 N ATOM 1341 CA LEU A 97 5.524 -11.273 -4.355 1.00 0.00 C ATOM 1342 C LEU A 97 6.378 -12.166 -5.218 1.00 0.00 C ATOM 1343 O LEU A 97 7.006 -13.108 -4.736 1.00 0.00 O ATOM 1344 CB LEU A 97 6.327 -10.014 -4.040 1.00 0.00 C ATOM 1345 CG LEU A 97 5.595 -8.935 -3.259 1.00 0.00 C ATOM 1346 CD1 LEU A 97 6.450 -7.683 -3.183 1.00 0.00 C ATOM 1347 CD2 LEU A 97 4.250 -8.634 -3.895 1.00 0.00 C ATOM 0 H LEU A 97 5.707 -11.850 -2.348 1.00 0.00 H new ATOM 0 HA LEU A 97 4.611 -10.982 -4.875 1.00 0.00 H new ATOM 0 HB2 LEU A 97 7.214 -10.304 -3.477 1.00 0.00 H new ATOM 0 HB3 LEU A 97 6.673 -9.583 -4.980 1.00 0.00 H new ATOM 0 HG LEU A 97 5.413 -9.294 -2.246 1.00 0.00 H new ATOM 0 HD11 LEU A 97 5.920 -6.914 -2.622 1.00 0.00 H new ATOM 0 HD12 LEU A 97 7.390 -7.914 -2.682 1.00 0.00 H new ATOM 0 HD13 LEU A 97 6.655 -7.321 -4.190 1.00 0.00 H new ATOM 0 HD21 LEU A 97 3.741 -7.859 -3.321 1.00 0.00 H new ATOM 0 HD22 LEU A 97 4.400 -8.288 -4.918 1.00 0.00 H new ATOM 0 HD23 LEU A 97 3.641 -9.538 -3.903 1.00 0.00 H new ATOM 1359 N SER A 98 6.401 -11.850 -6.484 1.00 0.00 N ATOM 1360 CA SER A 98 7.230 -12.530 -7.433 1.00 0.00 C ATOM 1361 C SER A 98 7.719 -11.558 -8.490 1.00 0.00 C ATOM 1362 O SER A 98 7.312 -10.392 -8.513 1.00 0.00 O ATOM 1363 CB SER A 98 6.459 -13.682 -8.046 1.00 0.00 C ATOM 1364 OG SER A 98 6.650 -14.860 -7.286 1.00 0.00 O ATOM 0 H SER A 98 5.836 -11.103 -6.888 1.00 0.00 H new ATOM 0 HA SER A 98 8.107 -12.938 -6.930 1.00 0.00 H new ATOM 0 HB2 SER A 98 5.398 -13.437 -8.089 1.00 0.00 H new ATOM 0 HB3 SER A 98 6.790 -13.845 -9.072 1.00 0.00 H new ATOM 0 HG SER A 98 6.803 -14.623 -6.348 1.00 0.00 H new ATOM 1370 N GLY A 99 8.596 -12.039 -9.346 1.00 0.00 N ATOM 1371 CA GLY A 99 9.252 -11.185 -10.300 1.00 0.00 C ATOM 1372 C GLY A 99 10.580 -10.713 -9.756 1.00 0.00 C ATOM 1373 O GLY A 99 11.409 -11.524 -9.345 1.00 0.00 O ATOM 0 H GLY A 99 8.868 -13.021 -9.397 1.00 0.00 H new ATOM 0 HA2 GLY A 99 9.405 -11.724 -11.235 1.00 0.00 H new ATOM 0 HA3 GLY A 99 8.619 -10.327 -10.526 1.00 0.00 H new ATOM 1377 N GLY A 100 10.769 -9.405 -9.731 1.00 0.00 N ATOM 1378 CA GLY A 100 11.972 -8.829 -9.155 1.00 0.00 C ATOM 1379 C GLY A 100 13.237 -9.328 -9.814 1.00 0.00 C ATOM 1380 O GLY A 100 14.177 -9.749 -9.140 1.00 0.00 O ATOM 0 H GLY A 100 10.107 -8.723 -10.102 1.00 0.00 H new ATOM 0 HA2 GLY A 100 11.927 -7.743 -9.242 1.00 0.00 H new ATOM 0 HA3 GLY A 100 12.007 -9.062 -8.091 1.00 0.00 H new ATOM 1384 N ASP A 101 13.249 -9.286 -11.133 1.00 0.00 N ATOM 1385 CA ASP A 101 14.399 -9.724 -11.912 1.00 0.00 C ATOM 1386 C ASP A 101 14.521 -8.839 -13.131 1.00 0.00 C ATOM 1387 O ASP A 101 15.430 -8.016 -13.243 1.00 0.00 O ATOM 1388 CB ASP A 101 14.230 -11.179 -12.355 1.00 0.00 C ATOM 1389 CG ASP A 101 15.474 -11.745 -13.006 1.00 0.00 C ATOM 1390 OD1 ASP A 101 16.343 -12.265 -12.279 1.00 0.00 O ATOM 1391 OD2 ASP A 101 15.577 -11.692 -14.245 1.00 0.00 O ATOM 0 H ASP A 101 12.467 -8.950 -11.695 1.00 0.00 H new ATOM 0 HA ASP A 101 15.296 -9.653 -11.297 1.00 0.00 H new ATOM 0 HB2 ASP A 101 13.969 -11.789 -11.490 1.00 0.00 H new ATOM 0 HB3 ASP A 101 13.397 -11.246 -13.055 1.00 0.00 H new ATOM 1396 N THR A 102 13.577 -9.014 -14.033 1.00 0.00 N ATOM 1397 CA THR A 102 13.464 -8.178 -15.206 1.00 0.00 C ATOM 1398 C THR A 102 12.087 -7.535 -15.242 1.00 0.00 C ATOM 1399 O THR A 102 11.803 -6.661 -16.062 1.00 0.00 O ATOM 1400 CB THR A 102 13.704 -9.008 -16.475 1.00 0.00 C ATOM 1401 OG1 THR A 102 12.802 -10.123 -16.505 1.00 0.00 O ATOM 1402 CG2 THR A 102 15.133 -9.514 -16.493 1.00 0.00 C ATOM 0 H THR A 102 12.866 -9.742 -13.971 1.00 0.00 H new ATOM 0 HA THR A 102 14.220 -7.394 -15.163 1.00 0.00 H new ATOM 0 HB THR A 102 13.531 -8.380 -17.349 1.00 0.00 H new ATOM 0 HG1 THR A 102 12.958 -10.648 -17.317 1.00 0.00 H new ATOM 0 HG21 THR A 102 15.299 -10.103 -17.395 1.00 0.00 H new ATOM 0 HG22 THR A 102 15.819 -8.667 -16.481 1.00 0.00 H new ATOM 0 HG23 THR A 102 15.310 -10.137 -15.616 1.00 0.00 H new ATOM 1410 N SER A 103 11.237 -7.985 -14.332 1.00 0.00 N ATOM 1411 CA SER A 103 9.918 -7.417 -14.159 1.00 0.00 C ATOM 1412 C SER A 103 9.741 -6.912 -12.737 1.00 0.00 C ATOM 1413 O SER A 103 10.409 -7.376 -11.808 1.00 0.00 O ATOM 1414 CB SER A 103 8.848 -8.455 -14.484 1.00 0.00 C ATOM 1415 OG SER A 103 9.264 -9.757 -14.101 1.00 0.00 O ATOM 0 H SER A 103 11.446 -8.754 -13.695 1.00 0.00 H new ATOM 0 HA SER A 103 9.811 -6.576 -14.844 1.00 0.00 H new ATOM 0 HB2 SER A 103 7.922 -8.200 -13.969 1.00 0.00 H new ATOM 0 HB3 SER A 103 8.634 -8.438 -15.553 1.00 0.00 H new ATOM 0 HG SER A 103 8.560 -10.403 -14.319 1.00 0.00 H new ATOM 1421 N PRO A 104 8.854 -5.932 -12.565 1.00 0.00 N ATOM 1422 CA PRO A 104 8.526 -5.360 -11.258 1.00 0.00 C ATOM 1423 C PRO A 104 7.809 -6.368 -10.374 1.00 0.00 C ATOM 1424 O PRO A 104 7.264 -7.359 -10.862 1.00 0.00 O ATOM 1425 CB PRO A 104 7.600 -4.184 -11.609 1.00 0.00 C ATOM 1426 CG PRO A 104 7.847 -3.937 -13.058 1.00 0.00 C ATOM 1427 CD PRO A 104 8.099 -5.288 -13.640 1.00 0.00 C ATOM 0 HA PRO A 104 9.410 -5.059 -10.696 1.00 0.00 H new ATOM 0 HB2 PRO A 104 6.555 -4.431 -11.421 1.00 0.00 H new ATOM 0 HB3 PRO A 104 7.832 -3.303 -11.011 1.00 0.00 H new ATOM 0 HG2 PRO A 104 6.989 -3.458 -13.529 1.00 0.00 H new ATOM 0 HG3 PRO A 104 8.702 -3.277 -13.206 1.00 0.00 H new ATOM 0 HD2 PRO A 104 7.173 -5.817 -13.865 1.00 0.00 H new ATOM 0 HD3 PRO A 104 8.669 -5.235 -14.567 1.00 0.00 H new ATOM 1435 N TYR A 105 7.818 -6.118 -9.073 1.00 0.00 N ATOM 1436 CA TYR A 105 7.192 -7.029 -8.133 1.00 0.00 C ATOM 1437 C TYR A 105 5.692 -7.027 -8.302 1.00 0.00 C ATOM 1438 O TYR A 105 5.076 -5.984 -8.517 1.00 0.00 O ATOM 1439 CB TYR A 105 7.534 -6.672 -6.695 1.00 0.00 C ATOM 1440 CG TYR A 105 8.995 -6.830 -6.368 1.00 0.00 C ATOM 1441 CD1 TYR A 105 9.629 -8.055 -6.504 1.00 0.00 C ATOM 1442 CD2 TYR A 105 9.742 -5.748 -5.943 1.00 0.00 C ATOM 1443 CE1 TYR A 105 10.972 -8.198 -6.217 1.00 0.00 C ATOM 1444 CE2 TYR A 105 11.087 -5.879 -5.660 1.00 0.00 C ATOM 1445 CZ TYR A 105 11.697 -7.108 -5.797 1.00 0.00 C ATOM 1446 OH TYR A 105 13.039 -7.244 -5.522 1.00 0.00 O ATOM 0 H TYR A 105 8.249 -5.297 -8.649 1.00 0.00 H new ATOM 0 HA TYR A 105 7.581 -8.025 -8.347 1.00 0.00 H new ATOM 0 HB2 TYR A 105 7.237 -5.641 -6.505 1.00 0.00 H new ATOM 0 HB3 TYR A 105 6.950 -7.301 -6.024 1.00 0.00 H new ATOM 0 HD1 TYR A 105 9.063 -8.912 -6.840 1.00 0.00 H new ATOM 0 HD2 TYR A 105 9.266 -4.785 -5.830 1.00 0.00 H new ATOM 0 HE1 TYR A 105 11.450 -9.161 -6.322 1.00 0.00 H new ATOM 0 HE2 TYR A 105 11.659 -5.023 -5.333 1.00 0.00 H new ATOM 0 HH TYR A 105 13.251 -6.775 -4.688 1.00 0.00 H new ATOM 1456 N SER A 106 5.125 -8.201 -8.168 1.00 0.00 N ATOM 1457 CA SER A 106 3.702 -8.404 -8.324 1.00 0.00 C ATOM 1458 C SER A 106 3.289 -9.570 -7.452 1.00 0.00 C ATOM 1459 O SER A 106 4.078 -10.489 -7.219 1.00 0.00 O ATOM 1460 CB SER A 106 3.354 -8.668 -9.795 1.00 0.00 C ATOM 1461 OG SER A 106 4.151 -9.709 -10.339 1.00 0.00 O ATOM 0 H SER A 106 5.642 -9.052 -7.945 1.00 0.00 H new ATOM 0 HA SER A 106 3.161 -7.509 -8.018 1.00 0.00 H new ATOM 0 HB2 SER A 106 2.300 -8.933 -9.879 1.00 0.00 H new ATOM 0 HB3 SER A 106 3.500 -7.756 -10.374 1.00 0.00 H new ATOM 0 HG SER A 106 3.904 -9.854 -11.276 1.00 0.00 H new ATOM 1467 N ILE A 107 2.082 -9.513 -6.930 1.00 0.00 N ATOM 1468 CA ILE A 107 1.628 -10.512 -5.994 1.00 0.00 C ATOM 1469 C ILE A 107 1.194 -11.775 -6.720 1.00 0.00 C ATOM 1470 O ILE A 107 0.429 -11.724 -7.683 1.00 0.00 O ATOM 1471 CB ILE A 107 0.455 -10.009 -5.132 1.00 0.00 C ATOM 1472 CG1 ILE A 107 0.718 -8.604 -4.574 1.00 0.00 C ATOM 1473 CG2 ILE A 107 0.227 -10.977 -3.994 1.00 0.00 C ATOM 1474 CD1 ILE A 107 0.409 -7.486 -5.540 1.00 0.00 C ATOM 0 H ILE A 107 1.400 -8.784 -7.140 1.00 0.00 H new ATOM 0 HA ILE A 107 2.473 -10.729 -5.340 1.00 0.00 H new ATOM 0 HB ILE A 107 -0.432 -9.951 -5.763 1.00 0.00 H new ATOM 0 HG12 ILE A 107 0.121 -8.466 -3.673 1.00 0.00 H new ATOM 0 HG13 ILE A 107 1.764 -8.533 -4.277 1.00 0.00 H new ATOM 0 HG21 ILE A 107 -0.602 -10.627 -3.379 1.00 0.00 H new ATOM 0 HG22 ILE A 107 -0.010 -11.962 -4.396 1.00 0.00 H new ATOM 0 HG23 ILE A 107 1.128 -11.041 -3.385 1.00 0.00 H new ATOM 0 HD11 ILE A 107 0.622 -6.527 -5.067 1.00 0.00 H new ATOM 0 HD12 ILE A 107 1.025 -7.596 -6.432 1.00 0.00 H new ATOM 0 HD13 ILE A 107 -0.644 -7.527 -5.819 1.00 0.00 H new ATOM 1486 N GLN A 108 1.709 -12.903 -6.250 1.00 0.00 N ATOM 1487 CA GLN A 108 1.338 -14.203 -6.768 1.00 0.00 C ATOM 1488 C GLN A 108 -0.138 -14.472 -6.503 1.00 0.00 C ATOM 1489 O GLN A 108 -0.850 -14.968 -7.371 1.00 0.00 O ATOM 1490 CB GLN A 108 2.194 -15.283 -6.126 1.00 0.00 C ATOM 1491 CG GLN A 108 3.651 -15.233 -6.550 1.00 0.00 C ATOM 1492 CD GLN A 108 4.523 -16.114 -5.688 1.00 0.00 C ATOM 1493 OE1 GLN A 108 4.699 -17.297 -5.963 1.00 0.00 O ATOM 1494 NE2 GLN A 108 5.088 -15.537 -4.645 1.00 0.00 N ATOM 0 H GLN A 108 2.397 -12.937 -5.497 1.00 0.00 H new ATOM 0 HA GLN A 108 1.507 -14.215 -7.845 1.00 0.00 H new ATOM 0 HB2 GLN A 108 2.136 -15.185 -5.042 1.00 0.00 H new ATOM 0 HB3 GLN A 108 1.783 -16.260 -6.380 1.00 0.00 H new ATOM 0 HG2 GLN A 108 3.736 -15.546 -7.591 1.00 0.00 H new ATOM 0 HG3 GLN A 108 4.009 -14.205 -6.496 1.00 0.00 H new ATOM 0 HE21 GLN A 108 4.915 -14.550 -4.452 1.00 0.00 H new ATOM 0 HE22 GLN A 108 5.698 -16.077 -4.031 1.00 0.00 H new ATOM 1503 N VAL A 109 -0.584 -14.165 -5.286 1.00 0.00 N ATOM 1504 CA VAL A 109 -2.007 -14.181 -4.967 1.00 0.00 C ATOM 1505 C VAL A 109 -2.498 -12.754 -4.759 1.00 0.00 C ATOM 1506 O VAL A 109 -2.581 -12.269 -3.631 1.00 0.00 O ATOM 1507 CB VAL A 109 -2.311 -15.010 -3.707 1.00 0.00 C ATOM 1508 CG1 VAL A 109 -3.735 -15.534 -3.749 1.00 0.00 C ATOM 1509 CG2 VAL A 109 -1.311 -16.141 -3.551 1.00 0.00 C ATOM 0 H VAL A 109 0.020 -13.903 -4.507 1.00 0.00 H new ATOM 0 HA VAL A 109 -2.526 -14.646 -5.805 1.00 0.00 H new ATOM 0 HB VAL A 109 -2.215 -14.363 -2.835 1.00 0.00 H new ATOM 0 HG11 VAL A 109 -3.934 -16.118 -2.851 1.00 0.00 H new ATOM 0 HG12 VAL A 109 -4.430 -14.696 -3.798 1.00 0.00 H new ATOM 0 HG13 VAL A 109 -3.865 -16.165 -4.628 1.00 0.00 H new ATOM 0 HG21 VAL A 109 -1.546 -16.713 -2.654 1.00 0.00 H new ATOM 0 HG22 VAL A 109 -1.362 -16.795 -4.422 1.00 0.00 H new ATOM 0 HG23 VAL A 109 -0.306 -15.729 -3.465 1.00 0.00 H new ATOM 1519 N PRO A 110 -2.811 -12.069 -5.862 1.00 0.00 N ATOM 1520 CA PRO A 110 -3.193 -10.653 -5.855 1.00 0.00 C ATOM 1521 C PRO A 110 -4.515 -10.398 -5.137 1.00 0.00 C ATOM 1522 O PRO A 110 -5.584 -10.789 -5.612 1.00 0.00 O ATOM 1523 CB PRO A 110 -3.320 -10.318 -7.342 1.00 0.00 C ATOM 1524 CG PRO A 110 -3.591 -11.624 -8.001 1.00 0.00 C ATOM 1525 CD PRO A 110 -2.829 -12.638 -7.216 1.00 0.00 C ATOM 0 HA PRO A 110 -2.466 -10.042 -5.321 1.00 0.00 H new ATOM 0 HB2 PRO A 110 -4.128 -9.609 -7.521 1.00 0.00 H new ATOM 0 HB3 PRO A 110 -2.406 -9.863 -7.725 1.00 0.00 H new ATOM 0 HG2 PRO A 110 -4.658 -11.849 -8.000 1.00 0.00 H new ATOM 0 HG3 PRO A 110 -3.268 -11.612 -9.042 1.00 0.00 H new ATOM 0 HD2 PRO A 110 -3.316 -13.613 -7.237 1.00 0.00 H new ATOM 0 HD3 PRO A 110 -1.821 -12.777 -7.608 1.00 0.00 H new ATOM 1533 N ASP A 111 -4.432 -9.738 -3.994 1.00 0.00 N ATOM 1534 CA ASP A 111 -5.613 -9.400 -3.216 1.00 0.00 C ATOM 1535 C ASP A 111 -5.945 -7.921 -3.371 1.00 0.00 C ATOM 1536 O ASP A 111 -5.678 -7.322 -4.419 1.00 0.00 O ATOM 1537 CB ASP A 111 -5.399 -9.748 -1.740 1.00 0.00 C ATOM 1538 CG ASP A 111 -5.361 -11.243 -1.493 1.00 0.00 C ATOM 1539 OD1 ASP A 111 -6.355 -11.928 -1.816 1.00 0.00 O ATOM 1540 OD2 ASP A 111 -4.346 -11.738 -0.961 1.00 0.00 O ATOM 0 H ASP A 111 -3.553 -9.424 -3.582 1.00 0.00 H new ATOM 0 HA ASP A 111 -6.453 -9.985 -3.590 1.00 0.00 H new ATOM 0 HB2 ASP A 111 -4.465 -9.303 -1.397 1.00 0.00 H new ATOM 0 HB3 ASP A 111 -6.199 -9.306 -1.147 1.00 0.00 H new ATOM 1545 N VAL A 112 -6.544 -7.339 -2.338 1.00 0.00 N ATOM 1546 CA VAL A 112 -6.953 -5.941 -2.375 1.00 0.00 C ATOM 1547 C VAL A 112 -5.768 -5.018 -2.608 1.00 0.00 C ATOM 1548 O VAL A 112 -4.673 -5.236 -2.103 1.00 0.00 O ATOM 1549 CB VAL A 112 -7.686 -5.518 -1.102 1.00 0.00 C ATOM 1550 CG1 VAL A 112 -8.166 -4.074 -1.183 1.00 0.00 C ATOM 1551 CG2 VAL A 112 -8.853 -6.426 -0.865 1.00 0.00 C ATOM 0 H VAL A 112 -6.757 -7.816 -1.462 1.00 0.00 H new ATOM 0 HA VAL A 112 -7.644 -5.851 -3.213 1.00 0.00 H new ATOM 0 HB VAL A 112 -6.984 -5.592 -0.271 1.00 0.00 H new ATOM 0 HG11 VAL A 112 -8.682 -3.810 -0.260 1.00 0.00 H new ATOM 0 HG12 VAL A 112 -7.310 -3.413 -1.322 1.00 0.00 H new ATOM 0 HG13 VAL A 112 -8.849 -3.964 -2.025 1.00 0.00 H new ATOM 0 HG21 VAL A 112 -9.373 -6.121 0.043 1.00 0.00 H new ATOM 0 HG22 VAL A 112 -9.537 -6.368 -1.712 1.00 0.00 H new ATOM 0 HG23 VAL A 112 -8.500 -7.451 -0.754 1.00 0.00 H new ATOM 1561 N SER A 113 -6.012 -3.977 -3.361 1.00 0.00 N ATOM 1562 CA SER A 113 -4.994 -3.020 -3.717 1.00 0.00 C ATOM 1563 C SER A 113 -5.584 -1.625 -3.686 1.00 0.00 C ATOM 1564 O SER A 113 -6.774 -1.456 -3.418 1.00 0.00 O ATOM 1565 CB SER A 113 -4.481 -3.330 -5.113 1.00 0.00 C ATOM 1566 OG SER A 113 -3.792 -4.569 -5.141 1.00 0.00 O ATOM 0 H SER A 113 -6.932 -3.767 -3.749 1.00 0.00 H new ATOM 0 HA SER A 113 -4.169 -3.078 -3.007 1.00 0.00 H new ATOM 0 HB2 SER A 113 -5.316 -3.359 -5.812 1.00 0.00 H new ATOM 0 HB3 SER A 113 -3.816 -2.533 -5.444 1.00 0.00 H new ATOM 0 HG SER A 113 -3.669 -4.854 -6.071 1.00 0.00 H new ATOM 1572 N PHE A 114 -4.766 -0.636 -3.967 1.00 0.00 N ATOM 1573 CA PHE A 114 -5.216 0.744 -3.953 1.00 0.00 C ATOM 1574 C PHE A 114 -4.696 1.469 -5.177 1.00 0.00 C ATOM 1575 O PHE A 114 -3.637 1.129 -5.679 1.00 0.00 O ATOM 1576 CB PHE A 114 -4.755 1.452 -2.682 1.00 0.00 C ATOM 1577 CG PHE A 114 -5.341 0.851 -1.447 1.00 0.00 C ATOM 1578 CD1 PHE A 114 -4.712 -0.206 -0.823 1.00 0.00 C ATOM 1579 CD2 PHE A 114 -6.522 1.333 -0.922 1.00 0.00 C ATOM 1580 CE1 PHE A 114 -5.251 -0.779 0.313 1.00 0.00 C ATOM 1581 CE2 PHE A 114 -7.067 0.770 0.211 1.00 0.00 C ATOM 1582 CZ PHE A 114 -6.431 -0.287 0.829 1.00 0.00 C ATOM 0 H PHE A 114 -3.783 -0.759 -4.209 1.00 0.00 H new ATOM 0 HA PHE A 114 -6.306 0.753 -3.970 1.00 0.00 H new ATOM 0 HB2 PHE A 114 -3.667 1.411 -2.621 1.00 0.00 H new ATOM 0 HB3 PHE A 114 -5.032 2.505 -2.736 1.00 0.00 H new ATOM 0 HD1 PHE A 114 -3.787 -0.590 -1.227 1.00 0.00 H new ATOM 0 HD2 PHE A 114 -7.024 2.159 -1.404 1.00 0.00 H new ATOM 0 HE1 PHE A 114 -4.751 -1.607 0.794 1.00 0.00 H new ATOM 0 HE2 PHE A 114 -7.991 1.156 0.615 1.00 0.00 H new ATOM 0 HZ PHE A 114 -6.858 -0.729 1.717 1.00 0.00 H new ATOM 1592 N GLY A 115 -5.451 2.432 -5.673 1.00 0.00 N ATOM 1593 CA GLY A 115 -5.004 3.198 -6.819 1.00 0.00 C ATOM 1594 C GLY A 115 -5.774 4.487 -6.967 1.00 0.00 C ATOM 1595 O GLY A 115 -6.980 4.515 -6.739 1.00 0.00 O ATOM 0 H GLY A 115 -6.364 2.699 -5.306 1.00 0.00 H new ATOM 0 HA2 GLY A 115 -3.942 3.419 -6.716 1.00 0.00 H new ATOM 0 HA3 GLY A 115 -5.119 2.600 -7.723 1.00 0.00 H new ATOM 1599 N GLY A 116 -5.082 5.554 -7.335 1.00 0.00 N ATOM 1600 CA GLY A 116 -5.742 6.823 -7.551 1.00 0.00 C ATOM 1601 C GLY A 116 -5.622 7.767 -6.371 1.00 0.00 C ATOM 1602 O GLY A 116 -6.317 8.782 -6.320 1.00 0.00 O ATOM 0 H GLY A 116 -4.074 5.563 -7.488 1.00 0.00 H new ATOM 0 HA2 GLY A 116 -5.318 7.300 -8.434 1.00 0.00 H new ATOM 0 HA3 GLY A 116 -6.797 6.646 -7.760 1.00 0.00 H new ATOM 1606 N LEU A 117 -4.752 7.437 -5.417 1.00 0.00 N ATOM 1607 CA LEU A 117 -4.540 8.292 -4.249 1.00 0.00 C ATOM 1608 C LEU A 117 -4.102 9.680 -4.697 1.00 0.00 C ATOM 1609 O LEU A 117 -4.681 10.686 -4.281 1.00 0.00 O ATOM 1610 CB LEU A 117 -3.455 7.714 -3.331 1.00 0.00 C ATOM 1611 CG LEU A 117 -3.757 6.371 -2.682 1.00 0.00 C ATOM 1612 CD1 LEU A 117 -2.797 6.128 -1.535 1.00 0.00 C ATOM 1613 CD2 LEU A 117 -5.190 6.326 -2.207 1.00 0.00 C ATOM 0 H LEU A 117 -4.185 6.589 -5.429 1.00 0.00 H new ATOM 0 HA LEU A 117 -5.481 8.347 -3.702 1.00 0.00 H new ATOM 0 HB2 LEU A 117 -2.537 7.614 -3.910 1.00 0.00 H new ATOM 0 HB3 LEU A 117 -3.256 8.438 -2.540 1.00 0.00 H new ATOM 0 HG LEU A 117 -3.623 5.579 -3.419 1.00 0.00 H new ATOM 0 HD11 LEU A 117 -3.017 5.165 -1.074 1.00 0.00 H new ATOM 0 HD12 LEU A 117 -1.774 6.124 -1.911 1.00 0.00 H new ATOM 0 HD13 LEU A 117 -2.908 6.919 -0.794 1.00 0.00 H new ATOM 0 HD21 LEU A 117 -5.390 5.359 -1.745 1.00 0.00 H new ATOM 0 HD22 LEU A 117 -5.356 7.118 -1.477 1.00 0.00 H new ATOM 0 HD23 LEU A 117 -5.859 6.468 -3.056 1.00 0.00 H new ATOM 1625 N ASN A 118 -3.087 9.714 -5.561 1.00 0.00 N ATOM 1626 CA ASN A 118 -2.506 10.965 -6.040 1.00 0.00 C ATOM 1627 C ASN A 118 -2.039 11.825 -4.863 1.00 0.00 C ATOM 1628 O ASN A 118 -2.410 12.994 -4.725 1.00 0.00 O ATOM 1629 CB ASN A 118 -3.511 11.725 -6.912 1.00 0.00 C ATOM 1630 CG ASN A 118 -2.915 12.963 -7.559 1.00 0.00 C ATOM 1631 OD1 ASN A 118 -1.713 13.028 -7.817 1.00 0.00 O ATOM 1632 ND2 ASN A 118 -3.753 13.953 -7.832 1.00 0.00 N ATOM 0 H ASN A 118 -2.647 8.878 -5.946 1.00 0.00 H new ATOM 0 HA ASN A 118 -1.636 10.731 -6.654 1.00 0.00 H new ATOM 0 HB2 ASN A 118 -3.886 11.059 -7.690 1.00 0.00 H new ATOM 0 HB3 ASN A 118 -4.366 12.016 -6.302 1.00 0.00 H new ATOM 0 HD21 ASN A 118 -3.408 14.807 -8.271 1.00 0.00 H new ATOM 0 HD22 ASN A 118 -4.743 13.861 -7.603 1.00 0.00 H new ATOM 1639 N LEU A 119 -1.242 11.219 -3.995 1.00 0.00 N ATOM 1640 CA LEU A 119 -0.696 11.910 -2.836 1.00 0.00 C ATOM 1641 C LEU A 119 0.817 12.042 -2.958 1.00 0.00 C ATOM 1642 O LEU A 119 1.539 11.054 -2.883 1.00 0.00 O ATOM 1643 CB LEU A 119 -1.040 11.154 -1.546 1.00 0.00 C ATOM 1644 CG LEU A 119 -2.527 10.904 -1.303 1.00 0.00 C ATOM 1645 CD1 LEU A 119 -2.764 10.417 0.113 1.00 0.00 C ATOM 1646 CD2 LEU A 119 -3.319 12.159 -1.587 1.00 0.00 C ATOM 0 H LEU A 119 -0.957 10.243 -4.073 1.00 0.00 H new ATOM 0 HA LEU A 119 -1.141 12.904 -2.796 1.00 0.00 H new ATOM 0 HB2 LEU A 119 -0.526 10.193 -1.562 1.00 0.00 H new ATOM 0 HB3 LEU A 119 -0.641 11.715 -0.700 1.00 0.00 H new ATOM 0 HG LEU A 119 -2.867 10.123 -1.984 1.00 0.00 H new ATOM 0 HD11 LEU A 119 -3.830 10.245 0.265 1.00 0.00 H new ATOM 0 HD12 LEU A 119 -2.220 9.486 0.274 1.00 0.00 H new ATOM 0 HD13 LEU A 119 -2.413 11.169 0.820 1.00 0.00 H new ATOM 0 HD21 LEU A 119 -4.378 11.969 -1.410 1.00 0.00 H new ATOM 0 HD22 LEU A 119 -2.980 12.960 -0.930 1.00 0.00 H new ATOM 0 HD23 LEU A 119 -3.172 12.455 -2.626 1.00 0.00 H new ATOM 1658 N SER A 120 1.294 13.255 -3.167 1.00 0.00 N ATOM 1659 CA SER A 120 2.718 13.499 -3.249 1.00 0.00 C ATOM 1660 C SER A 120 3.176 14.381 -2.094 1.00 0.00 C ATOM 1661 O SER A 120 2.573 15.418 -1.827 1.00 0.00 O ATOM 1662 CB SER A 120 3.044 14.167 -4.576 1.00 0.00 C ATOM 1663 OG SER A 120 2.326 15.381 -4.723 1.00 0.00 O ATOM 0 H SER A 120 0.714 14.086 -3.283 1.00 0.00 H new ATOM 0 HA SER A 120 3.244 12.547 -3.184 1.00 0.00 H new ATOM 0 HB2 SER A 120 4.114 14.364 -4.635 1.00 0.00 H new ATOM 0 HB3 SER A 120 2.798 13.493 -5.397 1.00 0.00 H new ATOM 0 HG SER A 120 2.230 15.812 -3.848 1.00 0.00 H new ATOM 1669 N SER A 121 4.231 13.968 -1.412 1.00 0.00 N ATOM 1670 CA SER A 121 4.750 14.724 -0.280 1.00 0.00 C ATOM 1671 C SER A 121 5.932 15.590 -0.712 1.00 0.00 C ATOM 1672 O SER A 121 6.689 15.219 -1.611 1.00 0.00 O ATOM 1673 CB SER A 121 5.169 13.774 0.840 1.00 0.00 C ATOM 1674 OG SER A 121 6.182 12.893 0.406 1.00 0.00 O ATOM 0 H SER A 121 4.747 13.113 -1.621 1.00 0.00 H new ATOM 0 HA SER A 121 3.962 15.378 0.092 1.00 0.00 H new ATOM 0 HB2 SER A 121 5.525 14.349 1.695 1.00 0.00 H new ATOM 0 HB3 SER A 121 4.305 13.202 1.178 1.00 0.00 H new ATOM 0 HG SER A 121 6.673 12.552 1.182 1.00 0.00 H new ATOM 1680 N LEU A 122 6.072 16.748 -0.079 1.00 0.00 N ATOM 1681 CA LEU A 122 7.163 17.666 -0.381 1.00 0.00 C ATOM 1682 C LEU A 122 8.492 17.175 0.186 1.00 0.00 C ATOM 1683 O LEU A 122 8.525 16.220 0.958 1.00 0.00 O ATOM 1684 CB LEU A 122 6.846 19.055 0.165 1.00 0.00 C ATOM 1685 CG LEU A 122 5.614 19.708 -0.447 1.00 0.00 C ATOM 1686 CD1 LEU A 122 5.448 21.123 0.075 1.00 0.00 C ATOM 1687 CD2 LEU A 122 5.707 19.701 -1.962 1.00 0.00 C ATOM 0 H LEU A 122 5.439 17.075 0.651 1.00 0.00 H new ATOM 0 HA LEU A 122 7.262 17.714 -1.465 1.00 0.00 H new ATOM 0 HB2 LEU A 122 6.706 18.984 1.244 1.00 0.00 H new ATOM 0 HB3 LEU A 122 7.706 19.703 -0.003 1.00 0.00 H new ATOM 0 HG LEU A 122 4.736 19.132 -0.156 1.00 0.00 H new ATOM 0 HD11 LEU A 122 4.563 21.575 -0.373 1.00 0.00 H new ATOM 0 HD12 LEU A 122 5.335 21.100 1.159 1.00 0.00 H new ATOM 0 HD13 LEU A 122 6.327 21.712 -0.186 1.00 0.00 H new ATOM 0 HD21 LEU A 122 4.819 20.171 -2.383 1.00 0.00 H new ATOM 0 HD22 LEU A 122 6.593 20.254 -2.275 1.00 0.00 H new ATOM 0 HD23 LEU A 122 5.776 18.673 -2.318 1.00 0.00 H new ATOM 1699 N GLN A 123 9.572 17.853 -0.191 1.00 0.00 N ATOM 1700 CA GLN A 123 10.932 17.471 0.198 1.00 0.00 C ATOM 1701 C GLN A 123 11.068 17.220 1.699 1.00 0.00 C ATOM 1702 O GLN A 123 11.516 16.155 2.120 1.00 0.00 O ATOM 1703 CB GLN A 123 11.916 18.574 -0.201 1.00 0.00 C ATOM 1704 CG GLN A 123 13.347 18.268 0.188 1.00 0.00 C ATOM 1705 CD GLN A 123 14.024 17.374 -0.821 1.00 0.00 C ATOM 1706 OE1 GLN A 123 13.764 17.467 -2.017 1.00 0.00 O ATOM 1707 NE2 GLN A 123 14.861 16.475 -0.350 1.00 0.00 N ATOM 0 H GLN A 123 9.532 18.687 -0.777 1.00 0.00 H new ATOM 0 HA GLN A 123 11.156 16.540 -0.322 1.00 0.00 H new ATOM 0 HB2 GLN A 123 11.864 18.725 -1.279 1.00 0.00 H new ATOM 0 HB3 GLN A 123 11.612 19.510 0.267 1.00 0.00 H new ATOM 0 HG2 GLN A 123 13.905 19.200 0.280 1.00 0.00 H new ATOM 0 HG3 GLN A 123 13.363 17.788 1.167 1.00 0.00 H new ATOM 0 HE21 GLN A 123 15.051 16.430 0.651 1.00 0.00 H new ATOM 0 HE22 GLN A 123 15.320 15.823 -0.986 1.00 0.00 H new ATOM 1716 N ALA A 124 10.691 18.211 2.497 1.00 0.00 N ATOM 1717 CA ALA A 124 10.922 18.159 3.936 1.00 0.00 C ATOM 1718 C ALA A 124 9.840 17.364 4.664 1.00 0.00 C ATOM 1719 O ALA A 124 9.762 17.383 5.894 1.00 0.00 O ATOM 1720 CB ALA A 124 11.027 19.564 4.504 1.00 0.00 C ATOM 0 H ALA A 124 10.225 19.059 2.174 1.00 0.00 H new ATOM 0 HA ALA A 124 11.866 17.638 4.097 1.00 0.00 H new ATOM 0 HB1 ALA A 124 11.199 19.510 5.579 1.00 0.00 H new ATOM 0 HB2 ALA A 124 11.857 20.087 4.029 1.00 0.00 H new ATOM 0 HB3 ALA A 124 10.100 20.104 4.312 1.00 0.00 H new ATOM 1726 N GLN A 125 8.997 16.677 3.904 1.00 0.00 N ATOM 1727 CA GLN A 125 8.017 15.775 4.473 1.00 0.00 C ATOM 1728 C GLN A 125 8.678 14.460 4.830 1.00 0.00 C ATOM 1729 O GLN A 125 8.419 13.435 4.205 1.00 0.00 O ATOM 1730 CB GLN A 125 6.886 15.557 3.501 1.00 0.00 C ATOM 1731 CG GLN A 125 5.982 16.756 3.424 1.00 0.00 C ATOM 1732 CD GLN A 125 5.011 16.835 4.586 1.00 0.00 C ATOM 1733 OE1 GLN A 125 5.291 16.355 5.682 1.00 0.00 O ATOM 1734 NE2 GLN A 125 3.870 17.461 4.358 1.00 0.00 N ATOM 0 H GLN A 125 8.976 16.731 2.886 1.00 0.00 H new ATOM 0 HA GLN A 125 7.606 16.217 5.381 1.00 0.00 H new ATOM 0 HB2 GLN A 125 7.292 15.343 2.512 1.00 0.00 H new ATOM 0 HB3 GLN A 125 6.308 14.684 3.804 1.00 0.00 H new ATOM 0 HG2 GLN A 125 6.588 17.662 3.401 1.00 0.00 H new ATOM 0 HG3 GLN A 125 5.422 16.723 2.490 1.00 0.00 H new ATOM 0 HE21 GLN A 125 3.675 17.846 3.434 1.00 0.00 H new ATOM 0 HE22 GLN A 125 3.184 17.560 5.106 1.00 0.00 H new ATOM 1743 N GLY A 126 9.550 14.522 5.826 1.00 0.00 N ATOM 1744 CA GLY A 126 10.332 13.373 6.233 1.00 0.00 C ATOM 1745 C GLY A 126 9.486 12.193 6.675 1.00 0.00 C ATOM 1746 O GLY A 126 8.939 11.469 5.854 1.00 0.00 O ATOM 0 H GLY A 126 9.732 15.366 6.369 1.00 0.00 H new ATOM 0 HA2 GLY A 126 10.968 13.064 5.404 1.00 0.00 H new ATOM 0 HA3 GLY A 126 10.992 13.663 7.050 1.00 0.00 H new ATOM 1750 N HIS A 127 9.398 11.973 7.973 1.00 0.00 N ATOM 1751 CA HIS A 127 8.605 10.863 8.503 1.00 0.00 C ATOM 1752 C HIS A 127 7.140 11.265 8.607 1.00 0.00 C ATOM 1753 O HIS A 127 6.265 10.416 8.752 1.00 0.00 O ATOM 1754 CB HIS A 127 9.117 10.441 9.874 1.00 0.00 C ATOM 1755 CG HIS A 127 9.010 8.972 10.059 1.00 0.00 C ATOM 1756 ND1 HIS A 127 7.811 8.309 10.027 1.00 0.00 N ATOM 1757 CD2 HIS A 127 9.962 8.025 10.168 1.00 0.00 C ATOM 1758 CE1 HIS A 127 8.027 7.019 10.093 1.00 0.00 C ATOM 1759 NE2 HIS A 127 9.327 6.812 10.184 1.00 0.00 N ATOM 0 H HIS A 127 9.861 12.541 8.683 1.00 0.00 H new ATOM 0 HA HIS A 127 8.700 10.021 7.818 1.00 0.00 H new ATOM 0 HB2 HIS A 127 10.156 10.750 9.988 1.00 0.00 H new ATOM 0 HB3 HIS A 127 8.546 10.950 10.651 1.00 0.00 H new ATOM 0 HD1 HIS A 127 6.894 8.751 9.962 1.00 0.00 H new ATOM 0 HD2 HIS A 127 11.027 8.192 10.231 1.00 0.00 H new ATOM 0 HE1 HIS A 127 7.267 6.252 10.076 1.00 0.00 H new ATOM 1768 N ASP A 128 6.882 12.560 8.515 1.00 0.00 N ATOM 1769 CA ASP A 128 5.528 13.077 8.666 1.00 0.00 C ATOM 1770 C ASP A 128 4.795 13.068 7.333 1.00 0.00 C ATOM 1771 O ASP A 128 3.565 13.124 7.287 1.00 0.00 O ATOM 1772 CB ASP A 128 5.554 14.487 9.246 1.00 0.00 C ATOM 1773 CG ASP A 128 4.191 14.949 9.717 1.00 0.00 C ATOM 1774 OD1 ASP A 128 3.743 14.492 10.792 1.00 0.00 O ATOM 1775 OD2 ASP A 128 3.568 15.783 9.036 1.00 0.00 O ATOM 0 H ASP A 128 7.590 13.272 8.337 1.00 0.00 H new ATOM 0 HA ASP A 128 4.992 12.427 9.357 1.00 0.00 H new ATOM 0 HB2 ASP A 128 6.253 14.519 10.082 1.00 0.00 H new ATOM 0 HB3 ASP A 128 5.927 15.179 8.491 1.00 0.00 H new ATOM 1780 N GLY A 129 5.557 12.989 6.249 1.00 0.00 N ATOM 1781 CA GLY A 129 4.960 12.869 4.936 1.00 0.00 C ATOM 1782 C GLY A 129 4.221 11.558 4.802 1.00 0.00 C ATOM 1783 O GLY A 129 4.815 10.494 4.971 1.00 0.00 O ATOM 0 H GLY A 129 6.577 13.006 6.257 1.00 0.00 H new ATOM 0 HA2 GLY A 129 4.273 13.698 4.766 1.00 0.00 H new ATOM 0 HA3 GLY A 129 5.734 12.935 4.172 1.00 0.00 H new ATOM 1787 N VAL A 130 2.925 11.638 4.513 1.00 0.00 N ATOM 1788 CA VAL A 130 2.047 10.465 4.494 1.00 0.00 C ATOM 1789 C VAL A 130 2.602 9.296 3.681 1.00 0.00 C ATOM 1790 O VAL A 130 2.363 8.148 4.036 1.00 0.00 O ATOM 1791 CB VAL A 130 0.634 10.811 3.983 1.00 0.00 C ATOM 1792 CG1 VAL A 130 -0.090 11.668 5.003 1.00 0.00 C ATOM 1793 CG2 VAL A 130 0.697 11.522 2.637 1.00 0.00 C ATOM 0 H VAL A 130 2.452 12.513 4.286 1.00 0.00 H new ATOM 0 HA VAL A 130 1.991 10.147 5.535 1.00 0.00 H new ATOM 0 HB VAL A 130 0.081 9.882 3.844 1.00 0.00 H new ATOM 0 HG11 VAL A 130 -1.087 11.908 4.634 1.00 0.00 H new ATOM 0 HG12 VAL A 130 -0.172 11.123 5.943 1.00 0.00 H new ATOM 0 HG13 VAL A 130 0.468 12.590 5.166 1.00 0.00 H new ATOM 0 HG21 VAL A 130 -0.313 11.754 2.300 1.00 0.00 H new ATOM 0 HG22 VAL A 130 1.266 12.446 2.740 1.00 0.00 H new ATOM 0 HG23 VAL A 130 1.183 10.876 1.906 1.00 0.00 H new ATOM 1803 N VAL A 131 3.345 9.569 2.610 1.00 0.00 N ATOM 1804 CA VAL A 131 3.913 8.492 1.808 1.00 0.00 C ATOM 1805 C VAL A 131 4.919 7.681 2.626 1.00 0.00 C ATOM 1806 O VAL A 131 4.946 6.453 2.560 1.00 0.00 O ATOM 1807 CB VAL A 131 4.577 9.020 0.519 1.00 0.00 C ATOM 1808 CG1 VAL A 131 3.553 9.740 -0.335 1.00 0.00 C ATOM 1809 CG2 VAL A 131 5.754 9.929 0.825 1.00 0.00 C ATOM 0 H VAL A 131 3.564 10.510 2.283 1.00 0.00 H new ATOM 0 HA VAL A 131 3.089 7.842 1.513 1.00 0.00 H new ATOM 0 HB VAL A 131 4.964 8.164 -0.034 1.00 0.00 H new ATOM 0 HG11 VAL A 131 4.031 10.109 -1.242 1.00 0.00 H new ATOM 0 HG12 VAL A 131 2.752 9.050 -0.601 1.00 0.00 H new ATOM 0 HG13 VAL A 131 3.139 10.579 0.224 1.00 0.00 H new ATOM 0 HG21 VAL A 131 6.195 10.280 -0.108 1.00 0.00 H new ATOM 0 HG22 VAL A 131 5.412 10.783 1.409 1.00 0.00 H new ATOM 0 HG23 VAL A 131 6.502 9.377 1.394 1.00 0.00 H new ATOM 1819 N HIS A 132 5.734 8.381 3.406 1.00 0.00 N ATOM 1820 CA HIS A 132 6.685 7.748 4.309 1.00 0.00 C ATOM 1821 C HIS A 132 5.937 6.978 5.392 1.00 0.00 C ATOM 1822 O HIS A 132 6.355 5.900 5.815 1.00 0.00 O ATOM 1823 CB HIS A 132 7.581 8.815 4.950 1.00 0.00 C ATOM 1824 CG HIS A 132 8.784 8.280 5.670 1.00 0.00 C ATOM 1825 ND1 HIS A 132 9.921 9.020 5.871 1.00 0.00 N ATOM 1826 CD2 HIS A 132 9.024 7.080 6.235 1.00 0.00 C ATOM 1827 CE1 HIS A 132 10.810 8.293 6.524 1.00 0.00 C ATOM 1828 NE2 HIS A 132 10.289 7.115 6.759 1.00 0.00 N ATOM 0 H HIS A 132 5.754 9.401 3.430 1.00 0.00 H new ATOM 0 HA HIS A 132 7.307 7.053 3.744 1.00 0.00 H new ATOM 0 HB2 HIS A 132 7.916 9.502 4.173 1.00 0.00 H new ATOM 0 HB3 HIS A 132 6.984 9.396 5.653 1.00 0.00 H new ATOM 0 HD1 HIS A 132 10.059 9.983 5.564 1.00 0.00 H new ATOM 0 HD2 HIS A 132 8.343 6.243 6.268 1.00 0.00 H new ATOM 0 HE1 HIS A 132 11.799 8.616 6.815 1.00 0.00 H new ATOM 1837 N GLN A 133 4.833 7.554 5.838 1.00 0.00 N ATOM 1838 CA GLN A 133 4.037 6.975 6.903 1.00 0.00 C ATOM 1839 C GLN A 133 3.430 5.661 6.464 1.00 0.00 C ATOM 1840 O GLN A 133 3.658 4.617 7.072 1.00 0.00 O ATOM 1841 CB GLN A 133 2.916 7.936 7.288 1.00 0.00 C ATOM 1842 CG GLN A 133 3.411 9.325 7.583 1.00 0.00 C ATOM 1843 CD GLN A 133 2.696 9.968 8.748 1.00 0.00 C ATOM 1844 OE1 GLN A 133 3.423 10.763 9.508 1.00 0.00 O flip ATOM 1845 NE2 GLN A 133 1.511 9.734 8.975 1.00 0.00 N flip ATOM 0 H GLN A 133 4.466 8.433 5.473 1.00 0.00 H new ATOM 0 HA GLN A 133 4.688 6.797 7.759 1.00 0.00 H new ATOM 0 HB2 GLN A 133 2.188 7.980 6.478 1.00 0.00 H new ATOM 0 HB3 GLN A 133 2.396 7.547 8.164 1.00 0.00 H new ATOM 0 HG2 GLN A 133 4.480 9.287 7.795 1.00 0.00 H new ATOM 0 HG3 GLN A 133 3.284 9.947 6.697 1.00 0.00 H new ATOM 0 HE21 GLN A 133 0.987 9.112 8.359 1.00 0.00 H new ATOM 0 HE22 GLN A 133 1.052 10.162 9.779 1.00 0.00 H new ATOM 1854 N VAL A 134 2.664 5.738 5.394 1.00 0.00 N ATOM 1855 CA VAL A 134 1.924 4.587 4.887 1.00 0.00 C ATOM 1856 C VAL A 134 2.837 3.416 4.543 1.00 0.00 C ATOM 1857 O VAL A 134 2.493 2.267 4.811 1.00 0.00 O ATOM 1858 CB VAL A 134 1.065 4.932 3.657 1.00 0.00 C ATOM 1859 CG1 VAL A 134 -0.045 5.885 4.047 1.00 0.00 C ATOM 1860 CG2 VAL A 134 1.904 5.513 2.533 1.00 0.00 C ATOM 0 H VAL A 134 2.534 6.591 4.851 1.00 0.00 H new ATOM 0 HA VAL A 134 1.264 4.292 5.703 1.00 0.00 H new ATOM 0 HB VAL A 134 0.622 4.008 3.286 1.00 0.00 H new ATOM 0 HG11 VAL A 134 -0.646 6.122 3.169 1.00 0.00 H new ATOM 0 HG12 VAL A 134 -0.676 5.419 4.804 1.00 0.00 H new ATOM 0 HG13 VAL A 134 0.387 6.801 4.449 1.00 0.00 H new ATOM 0 HG21 VAL A 134 1.263 5.744 1.682 1.00 0.00 H new ATOM 0 HG22 VAL A 134 2.392 6.425 2.877 1.00 0.00 H new ATOM 0 HG23 VAL A 134 2.660 4.788 2.231 1.00 0.00 H new ATOM 1870 N VAL A 135 3.999 3.702 3.966 1.00 0.00 N ATOM 1871 CA VAL A 135 4.910 2.645 3.555 1.00 0.00 C ATOM 1872 C VAL A 135 5.479 1.918 4.771 1.00 0.00 C ATOM 1873 O VAL A 135 5.413 0.694 4.848 1.00 0.00 O ATOM 1874 CB VAL A 135 6.058 3.161 2.649 1.00 0.00 C ATOM 1875 CG1 VAL A 135 6.949 4.165 3.362 1.00 0.00 C ATOM 1876 CG2 VAL A 135 6.882 1.997 2.122 1.00 0.00 C ATOM 0 H VAL A 135 4.328 4.648 3.774 1.00 0.00 H new ATOM 0 HA VAL A 135 4.325 1.944 2.960 1.00 0.00 H new ATOM 0 HB VAL A 135 5.597 3.681 1.809 1.00 0.00 H new ATOM 0 HG11 VAL A 135 7.737 4.496 2.686 1.00 0.00 H new ATOM 0 HG12 VAL A 135 6.353 5.023 3.673 1.00 0.00 H new ATOM 0 HG13 VAL A 135 7.396 3.696 4.239 1.00 0.00 H new ATOM 0 HG21 VAL A 135 7.683 2.376 1.488 1.00 0.00 H new ATOM 0 HG22 VAL A 135 7.311 1.447 2.959 1.00 0.00 H new ATOM 0 HG23 VAL A 135 6.243 1.333 1.540 1.00 0.00 H new ATOM 1886 N TYR A 136 5.995 2.670 5.739 1.00 0.00 N ATOM 1887 CA TYR A 136 6.568 2.067 6.932 1.00 0.00 C ATOM 1888 C TYR A 136 5.481 1.472 7.812 1.00 0.00 C ATOM 1889 O TYR A 136 5.727 0.529 8.563 1.00 0.00 O ATOM 1890 CB TYR A 136 7.416 3.075 7.706 1.00 0.00 C ATOM 1891 CG TYR A 136 8.847 3.102 7.253 1.00 0.00 C ATOM 1892 CD1 TYR A 136 9.192 3.769 6.098 1.00 0.00 C ATOM 1893 CD2 TYR A 136 9.849 2.467 7.975 1.00 0.00 C ATOM 1894 CE1 TYR A 136 10.492 3.813 5.661 1.00 0.00 C ATOM 1895 CE2 TYR A 136 11.161 2.503 7.546 1.00 0.00 C ATOM 1896 CZ TYR A 136 11.478 3.178 6.386 1.00 0.00 C ATOM 1897 OH TYR A 136 12.782 3.218 5.951 1.00 0.00 O ATOM 0 H TYR A 136 6.027 3.689 5.719 1.00 0.00 H new ATOM 0 HA TYR A 136 7.226 1.257 6.617 1.00 0.00 H new ATOM 0 HB2 TYR A 136 6.985 4.069 7.591 1.00 0.00 H new ATOM 0 HB3 TYR A 136 7.381 2.833 8.768 1.00 0.00 H new ATOM 0 HD1 TYR A 136 8.424 4.267 5.525 1.00 0.00 H new ATOM 0 HD2 TYR A 136 9.599 1.939 8.883 1.00 0.00 H new ATOM 0 HE1 TYR A 136 10.742 4.343 4.753 1.00 0.00 H new ATOM 0 HE2 TYR A 136 11.933 2.006 8.115 1.00 0.00 H new ATOM 0 HH TYR A 136 13.351 2.722 6.576 1.00 0.00 H new ATOM 1907 N GLY A 137 4.281 2.027 7.719 1.00 0.00 N ATOM 1908 CA GLY A 137 3.142 1.416 8.360 1.00 0.00 C ATOM 1909 C GLY A 137 2.873 0.051 7.771 1.00 0.00 C ATOM 1910 O GLY A 137 2.882 -0.951 8.480 1.00 0.00 O ATOM 0 H GLY A 137 4.079 2.888 7.211 1.00 0.00 H new ATOM 0 HA2 GLY A 137 3.324 1.327 9.431 1.00 0.00 H new ATOM 0 HA3 GLY A 137 2.264 2.051 8.238 1.00 0.00 H new ATOM 1914 N LEU A 138 2.674 0.025 6.457 1.00 0.00 N ATOM 1915 CA LEU A 138 2.475 -1.210 5.704 1.00 0.00 C ATOM 1916 C LEU A 138 3.552 -2.239 6.041 1.00 0.00 C ATOM 1917 O LEU A 138 3.253 -3.388 6.360 1.00 0.00 O ATOM 1918 CB LEU A 138 2.528 -0.898 4.208 1.00 0.00 C ATOM 1919 CG LEU A 138 1.216 -1.002 3.437 1.00 0.00 C ATOM 1920 CD1 LEU A 138 0.566 -2.346 3.664 1.00 0.00 C ATOM 1921 CD2 LEU A 138 0.275 0.102 3.840 1.00 0.00 C ATOM 0 H LEU A 138 2.646 0.866 5.880 1.00 0.00 H new ATOM 0 HA LEU A 138 1.504 -1.627 5.972 1.00 0.00 H new ATOM 0 HB2 LEU A 138 2.915 0.114 4.085 1.00 0.00 H new ATOM 0 HB3 LEU A 138 3.248 -1.573 3.746 1.00 0.00 H new ATOM 0 HG LEU A 138 1.441 -0.900 2.375 1.00 0.00 H new ATOM 0 HD11 LEU A 138 -0.368 -2.398 3.105 1.00 0.00 H new ATOM 0 HD12 LEU A 138 1.236 -3.136 3.325 1.00 0.00 H new ATOM 0 HD13 LEU A 138 0.360 -2.476 4.726 1.00 0.00 H new ATOM 0 HD21 LEU A 138 -0.655 0.010 3.279 1.00 0.00 H new ATOM 0 HD22 LEU A 138 0.064 0.029 4.907 1.00 0.00 H new ATOM 0 HD23 LEU A 138 0.734 1.067 3.626 1.00 0.00 H new ATOM 1933 N MET A 139 4.804 -1.799 5.973 1.00 0.00 N ATOM 1934 CA MET A 139 5.963 -2.642 6.260 1.00 0.00 C ATOM 1935 C MET A 139 5.882 -3.293 7.638 1.00 0.00 C ATOM 1936 O MET A 139 6.380 -4.397 7.848 1.00 0.00 O ATOM 1937 CB MET A 139 7.237 -1.805 6.191 1.00 0.00 C ATOM 1938 CG MET A 139 7.543 -1.290 4.806 1.00 0.00 C ATOM 1939 SD MET A 139 8.897 -0.100 4.795 1.00 0.00 S ATOM 1940 CE MET A 139 10.071 -0.945 5.847 1.00 0.00 C ATOM 0 H MET A 139 5.046 -0.842 5.716 1.00 0.00 H new ATOM 0 HA MET A 139 5.976 -3.434 5.511 1.00 0.00 H new ATOM 0 HB2 MET A 139 7.144 -0.959 6.872 1.00 0.00 H new ATOM 0 HB3 MET A 139 8.077 -2.406 6.541 1.00 0.00 H new ATOM 0 HG2 MET A 139 7.796 -2.129 4.158 1.00 0.00 H new ATOM 0 HG3 MET A 139 6.650 -0.823 4.390 1.00 0.00 H new ATOM 0 HE1 MET A 139 11.061 -0.510 5.710 1.00 0.00 H new ATOM 0 HE2 MET A 139 9.769 -0.838 6.889 1.00 0.00 H new ATOM 0 HE3 MET A 139 10.100 -2.002 5.584 1.00 0.00 H new ATOM 1950 N SER A 140 5.285 -2.587 8.579 1.00 0.00 N ATOM 1951 CA SER A 140 5.165 -3.080 9.946 1.00 0.00 C ATOM 1952 C SER A 140 3.833 -3.795 10.176 1.00 0.00 C ATOM 1953 O SER A 140 3.617 -4.388 11.234 1.00 0.00 O ATOM 1954 CB SER A 140 5.317 -1.924 10.932 1.00 0.00 C ATOM 1955 OG SER A 140 6.539 -1.237 10.719 1.00 0.00 O ATOM 0 H SER A 140 4.873 -1.667 8.425 1.00 0.00 H new ATOM 0 HA SER A 140 5.962 -3.806 10.109 1.00 0.00 H new ATOM 0 HB2 SER A 140 4.482 -1.233 10.820 1.00 0.00 H new ATOM 0 HB3 SER A 140 5.282 -2.304 11.953 1.00 0.00 H new ATOM 0 HG SER A 140 6.426 -0.585 9.996 1.00 0.00 H new ATOM 1961 N GLY A 141 2.953 -3.750 9.183 1.00 0.00 N ATOM 1962 CA GLY A 141 1.648 -4.372 9.317 1.00 0.00 C ATOM 1963 C GLY A 141 0.602 -3.416 9.857 1.00 0.00 C ATOM 1964 O GLY A 141 -0.402 -3.838 10.426 1.00 0.00 O ATOM 0 H GLY A 141 3.119 -3.294 8.286 1.00 0.00 H new ATOM 0 HA2 GLY A 141 1.326 -4.747 8.345 1.00 0.00 H new ATOM 0 HA3 GLY A 141 1.726 -5.233 9.981 1.00 0.00 H new ATOM 1968 N ASP A 142 0.838 -2.125 9.677 1.00 0.00 N ATOM 1969 CA ASP A 142 -0.085 -1.100 10.139 1.00 0.00 C ATOM 1970 C ASP A 142 -0.813 -0.458 8.967 1.00 0.00 C ATOM 1971 O ASP A 142 -0.206 -0.134 7.947 1.00 0.00 O ATOM 1972 CB ASP A 142 0.653 -0.017 10.936 1.00 0.00 C ATOM 1973 CG ASP A 142 -0.257 1.139 11.319 1.00 0.00 C ATOM 1974 OD1 ASP A 142 -0.979 1.019 12.332 1.00 0.00 O ATOM 1975 OD2 ASP A 142 -0.262 2.166 10.610 1.00 0.00 O ATOM 0 H ASP A 142 1.668 -1.761 9.210 1.00 0.00 H new ATOM 0 HA ASP A 142 -0.814 -1.584 10.789 1.00 0.00 H new ATOM 0 HB2 ASP A 142 1.076 -0.458 11.839 1.00 0.00 H new ATOM 0 HB3 ASP A 142 1.487 0.361 10.345 1.00 0.00 H new ATOM 1980 N THR A 143 -2.113 -0.280 9.114 1.00 0.00 N ATOM 1981 CA THR A 143 -2.903 0.395 8.101 1.00 0.00 C ATOM 1982 C THR A 143 -3.532 1.668 8.663 1.00 0.00 C ATOM 1983 O THR A 143 -4.359 2.308 8.010 1.00 0.00 O ATOM 1984 CB THR A 143 -3.993 -0.535 7.544 1.00 0.00 C ATOM 1985 OG1 THR A 143 -4.778 -1.091 8.607 1.00 0.00 O ATOM 1986 CG2 THR A 143 -3.355 -1.644 6.744 1.00 0.00 C ATOM 0 H THR A 143 -2.645 -0.594 9.926 1.00 0.00 H new ATOM 0 HA THR A 143 -2.234 0.669 7.285 1.00 0.00 H new ATOM 0 HB THR A 143 -4.650 0.048 6.899 1.00 0.00 H new ATOM 0 HG1 THR A 143 -5.467 -1.678 8.232 1.00 0.00 H new ATOM 0 HG21 THR A 143 -4.130 -2.301 6.351 1.00 0.00 H new ATOM 0 HG22 THR A 143 -2.788 -1.216 5.917 1.00 0.00 H new ATOM 0 HG23 THR A 143 -2.685 -2.216 7.386 1.00 0.00 H new ATOM 1994 N GLY A 144 -3.095 2.045 9.864 1.00 0.00 N ATOM 1995 CA GLY A 144 -3.651 3.199 10.549 1.00 0.00 C ATOM 1996 C GLY A 144 -3.233 4.510 9.918 1.00 0.00 C ATOM 1997 O GLY A 144 -3.854 5.550 10.143 1.00 0.00 O ATOM 0 H GLY A 144 -2.357 1.564 10.379 1.00 0.00 H new ATOM 0 HA2 GLY A 144 -4.739 3.129 10.545 1.00 0.00 H new ATOM 0 HA3 GLY A 144 -3.334 3.185 11.592 1.00 0.00 H new ATOM 2001 N ALA A 145 -2.165 4.471 9.141 1.00 0.00 N ATOM 2002 CA ALA A 145 -1.731 5.646 8.407 1.00 0.00 C ATOM 2003 C ALA A 145 -2.361 5.677 7.024 1.00 0.00 C ATOM 2004 O ALA A 145 -2.718 6.741 6.516 1.00 0.00 O ATOM 2005 CB ALA A 145 -0.215 5.682 8.303 1.00 0.00 C ATOM 0 H ALA A 145 -1.585 3.643 9.002 1.00 0.00 H new ATOM 0 HA ALA A 145 -2.059 6.530 8.953 1.00 0.00 H new ATOM 0 HB1 ALA A 145 0.091 6.570 7.750 1.00 0.00 H new ATOM 0 HB2 ALA A 145 0.218 5.711 9.303 1.00 0.00 H new ATOM 0 HB3 ALA A 145 0.135 4.791 7.782 1.00 0.00 H new ATOM 2011 N LEU A 146 -2.519 4.504 6.425 1.00 0.00 N ATOM 2012 CA LEU A 146 -3.097 4.411 5.095 1.00 0.00 C ATOM 2013 C LEU A 146 -4.563 4.817 5.137 1.00 0.00 C ATOM 2014 O LEU A 146 -5.041 5.502 4.246 1.00 0.00 O ATOM 2015 CB LEU A 146 -2.963 2.993 4.530 1.00 0.00 C ATOM 2016 CG LEU A 146 -2.493 2.908 3.075 1.00 0.00 C ATOM 2017 CD1 LEU A 146 -2.630 1.492 2.556 1.00 0.00 C ATOM 2018 CD2 LEU A 146 -3.268 3.870 2.199 1.00 0.00 C ATOM 0 H LEU A 146 -2.256 3.609 6.838 1.00 0.00 H new ATOM 0 HA LEU A 146 -2.551 5.090 4.440 1.00 0.00 H new ATOM 0 HB2 LEU A 146 -2.263 2.436 5.153 1.00 0.00 H new ATOM 0 HB3 LEU A 146 -3.929 2.495 4.612 1.00 0.00 H new ATOM 0 HG LEU A 146 -1.441 3.191 3.041 1.00 0.00 H new ATOM 0 HD11 LEU A 146 -2.292 1.450 1.521 1.00 0.00 H new ATOM 0 HD12 LEU A 146 -2.023 0.821 3.164 1.00 0.00 H new ATOM 0 HD13 LEU A 146 -3.674 1.184 2.609 1.00 0.00 H new ATOM 0 HD21 LEU A 146 -2.915 3.790 1.171 1.00 0.00 H new ATOM 0 HD22 LEU A 146 -4.329 3.624 2.239 1.00 0.00 H new ATOM 0 HD23 LEU A 146 -3.118 4.889 2.556 1.00 0.00 H new ATOM 2030 N GLU A 147 -5.262 4.406 6.191 1.00 0.00 N ATOM 2031 CA GLU A 147 -6.672 4.742 6.364 1.00 0.00 C ATOM 2032 C GLU A 147 -6.876 6.255 6.342 1.00 0.00 C ATOM 2033 O GLU A 147 -7.869 6.745 5.807 1.00 0.00 O ATOM 2034 CB GLU A 147 -7.200 4.148 7.668 1.00 0.00 C ATOM 2035 CG GLU A 147 -6.612 4.780 8.901 1.00 0.00 C ATOM 2036 CD GLU A 147 -7.297 4.326 10.171 1.00 0.00 C ATOM 2037 OE1 GLU A 147 -8.382 4.852 10.479 1.00 0.00 O ATOM 2038 OE2 GLU A 147 -6.756 3.434 10.861 1.00 0.00 O ATOM 0 H GLU A 147 -4.872 3.837 6.942 1.00 0.00 H new ATOM 0 HA GLU A 147 -7.233 4.314 5.533 1.00 0.00 H new ATOM 0 HB2 GLU A 147 -8.284 4.259 7.695 1.00 0.00 H new ATOM 0 HB3 GLU A 147 -6.989 3.079 7.682 1.00 0.00 H new ATOM 0 HG2 GLU A 147 -5.551 4.537 8.958 1.00 0.00 H new ATOM 0 HG3 GLU A 147 -6.687 5.864 8.820 1.00 0.00 H new ATOM 2045 N THR A 148 -5.915 6.992 6.884 1.00 0.00 N ATOM 2046 CA THR A 148 -6.025 8.429 6.974 1.00 0.00 C ATOM 2047 C THR A 148 -5.731 9.061 5.614 1.00 0.00 C ATOM 2048 O THR A 148 -6.348 10.055 5.230 1.00 0.00 O ATOM 2049 CB THR A 148 -5.071 8.941 8.073 1.00 0.00 C ATOM 2050 OG1 THR A 148 -5.799 9.659 9.076 1.00 0.00 O ATOM 2051 CG2 THR A 148 -3.959 9.801 7.515 1.00 0.00 C ATOM 0 H THR A 148 -5.050 6.610 7.267 1.00 0.00 H new ATOM 0 HA THR A 148 -7.040 8.715 7.249 1.00 0.00 H new ATOM 0 HB THR A 148 -4.606 8.065 8.525 1.00 0.00 H new ATOM 0 HG1 THR A 148 -5.180 9.975 9.766 1.00 0.00 H new ATOM 0 HG21 THR A 148 -3.315 10.136 8.328 1.00 0.00 H new ATOM 0 HG22 THR A 148 -3.372 9.220 6.803 1.00 0.00 H new ATOM 0 HG23 THR A 148 -4.387 10.667 7.011 1.00 0.00 H new ATOM 2059 N ALA A 149 -4.797 8.459 4.887 1.00 0.00 N ATOM 2060 CA ALA A 149 -4.490 8.882 3.525 1.00 0.00 C ATOM 2061 C ALA A 149 -5.675 8.611 2.597 1.00 0.00 C ATOM 2062 O ALA A 149 -6.049 9.452 1.780 1.00 0.00 O ATOM 2063 CB ALA A 149 -3.241 8.175 3.021 1.00 0.00 C ATOM 0 H ALA A 149 -4.237 7.674 5.219 1.00 0.00 H new ATOM 0 HA ALA A 149 -4.301 9.955 3.530 1.00 0.00 H new ATOM 0 HB1 ALA A 149 -3.024 8.500 2.004 1.00 0.00 H new ATOM 0 HB2 ALA A 149 -2.398 8.420 3.668 1.00 0.00 H new ATOM 0 HB3 ALA A 149 -3.404 7.097 3.030 1.00 0.00 H new ATOM 2069 N LEU A 150 -6.255 7.422 2.740 1.00 0.00 N ATOM 2070 CA LEU A 150 -7.434 7.019 1.986 1.00 0.00 C ATOM 2071 C LEU A 150 -8.567 8.011 2.182 1.00 0.00 C ATOM 2072 O LEU A 150 -9.256 8.380 1.229 1.00 0.00 O ATOM 2073 CB LEU A 150 -7.879 5.627 2.424 1.00 0.00 C ATOM 2074 CG LEU A 150 -6.894 4.507 2.106 1.00 0.00 C ATOM 2075 CD1 LEU A 150 -7.365 3.196 2.710 1.00 0.00 C ATOM 2076 CD2 LEU A 150 -6.722 4.373 0.603 1.00 0.00 C ATOM 0 H LEU A 150 -5.917 6.709 3.386 1.00 0.00 H new ATOM 0 HA LEU A 150 -7.175 6.999 0.927 1.00 0.00 H new ATOM 0 HB2 LEU A 150 -8.057 5.640 3.499 1.00 0.00 H new ATOM 0 HB3 LEU A 150 -8.832 5.399 1.946 1.00 0.00 H new ATOM 0 HG LEU A 150 -5.928 4.756 2.545 1.00 0.00 H new ATOM 0 HD11 LEU A 150 -6.650 2.408 2.473 1.00 0.00 H new ATOM 0 HD12 LEU A 150 -7.443 3.301 3.792 1.00 0.00 H new ATOM 0 HD13 LEU A 150 -8.341 2.936 2.299 1.00 0.00 H new ATOM 0 HD21 LEU A 150 -6.017 3.570 0.388 1.00 0.00 H new ATOM 0 HD22 LEU A 150 -7.684 4.143 0.146 1.00 0.00 H new ATOM 0 HD23 LEU A 150 -6.341 5.310 0.195 1.00 0.00 H new ATOM 2088 N ASN A 151 -8.739 8.451 3.426 1.00 0.00 N ATOM 2089 CA ASN A 151 -9.744 9.456 3.774 1.00 0.00 C ATOM 2090 C ASN A 151 -9.602 10.727 2.938 1.00 0.00 C ATOM 2091 O ASN A 151 -10.489 11.570 2.944 1.00 0.00 O ATOM 2092 CB ASN A 151 -9.662 9.815 5.262 1.00 0.00 C ATOM 2093 CG ASN A 151 -10.595 8.988 6.128 1.00 0.00 C ATOM 2094 OD1 ASN A 151 -11.766 9.321 6.294 1.00 0.00 O ATOM 2095 ND2 ASN A 151 -10.083 7.908 6.694 1.00 0.00 N ATOM 0 H ASN A 151 -8.189 8.123 4.220 1.00 0.00 H new ATOM 0 HA ASN A 151 -10.716 9.013 3.557 1.00 0.00 H new ATOM 0 HB2 ASN A 151 -8.637 9.676 5.607 1.00 0.00 H new ATOM 0 HB3 ASN A 151 -9.900 10.871 5.388 1.00 0.00 H new ATOM 0 HD21 ASN A 151 -10.665 7.321 7.291 1.00 0.00 H new ATOM 0 HD22 ASN A 151 -9.106 7.662 6.533 1.00 0.00 H new ATOM 2102 N GLY A 152 -8.512 10.849 2.194 1.00 0.00 N ATOM 2103 CA GLY A 152 -8.272 12.053 1.434 1.00 0.00 C ATOM 2104 C GLY A 152 -9.188 12.141 0.237 1.00 0.00 C ATOM 2105 O GLY A 152 -9.698 13.212 -0.088 1.00 0.00 O ATOM 0 H GLY A 152 -7.790 10.134 2.105 1.00 0.00 H new ATOM 0 HA2 GLY A 152 -8.421 12.924 2.073 1.00 0.00 H new ATOM 0 HA3 GLY A 152 -7.234 12.075 1.102 1.00 0.00 H new ATOM 2109 N ILE A 153 -9.409 11.009 -0.419 1.00 0.00 N ATOM 2110 CA ILE A 153 -10.334 10.961 -1.533 1.00 0.00 C ATOM 2111 C ILE A 153 -11.754 10.741 -1.035 1.00 0.00 C ATOM 2112 O ILE A 153 -12.682 11.424 -1.462 1.00 0.00 O ATOM 2113 CB ILE A 153 -9.993 9.841 -2.517 1.00 0.00 C ATOM 2114 CG1 ILE A 153 -8.525 9.880 -2.908 1.00 0.00 C ATOM 2115 CG2 ILE A 153 -10.865 9.944 -3.754 1.00 0.00 C ATOM 2116 CD1 ILE A 153 -7.699 8.871 -2.156 1.00 0.00 C ATOM 0 H ILE A 153 -8.961 10.120 -0.197 1.00 0.00 H new ATOM 0 HA ILE A 153 -10.252 11.919 -2.047 1.00 0.00 H new ATOM 0 HB ILE A 153 -10.187 8.889 -2.022 1.00 0.00 H new ATOM 0 HG12 ILE A 153 -8.433 9.695 -3.978 1.00 0.00 H new ATOM 0 HG13 ILE A 153 -8.130 10.879 -2.722 1.00 0.00 H new ATOM 0 HG21 ILE A 153 -10.612 9.141 -4.446 1.00 0.00 H new ATOM 0 HG22 ILE A 153 -11.913 9.859 -3.468 1.00 0.00 H new ATOM 0 HG23 ILE A 153 -10.697 10.906 -4.238 1.00 0.00 H new ATOM 0 HD11 ILE A 153 -6.659 8.942 -2.474 1.00 0.00 H new ATOM 0 HD12 ILE A 153 -7.766 9.071 -1.087 1.00 0.00 H new ATOM 0 HD13 ILE A 153 -8.073 7.868 -2.362 1.00 0.00 H new ATOM 2128 N LEU A 154 -11.918 9.782 -0.122 1.00 0.00 N ATOM 2129 CA LEU A 154 -13.234 9.440 0.394 1.00 0.00 C ATOM 2130 C LEU A 154 -13.939 10.645 0.992 1.00 0.00 C ATOM 2131 O LEU A 154 -15.110 10.866 0.717 1.00 0.00 O ATOM 2132 CB LEU A 154 -13.145 8.326 1.439 1.00 0.00 C ATOM 2133 CG LEU A 154 -12.974 6.909 0.899 1.00 0.00 C ATOM 2134 CD1 LEU A 154 -13.456 6.811 -0.538 1.00 0.00 C ATOM 2135 CD2 LEU A 154 -11.540 6.457 1.048 1.00 0.00 C ATOM 0 H LEU A 154 -11.154 9.232 0.271 1.00 0.00 H new ATOM 0 HA LEU A 154 -13.820 9.087 -0.454 1.00 0.00 H new ATOM 0 HB2 LEU A 154 -12.307 8.544 2.102 1.00 0.00 H new ATOM 0 HB3 LEU A 154 -14.049 8.354 2.048 1.00 0.00 H new ATOM 0 HG LEU A 154 -13.595 6.234 1.489 1.00 0.00 H new ATOM 0 HD11 LEU A 154 -13.323 5.791 -0.898 1.00 0.00 H new ATOM 0 HD12 LEU A 154 -14.512 7.078 -0.587 1.00 0.00 H new ATOM 0 HD13 LEU A 154 -12.880 7.494 -1.162 1.00 0.00 H new ATOM 0 HD21 LEU A 154 -11.435 5.445 0.658 1.00 0.00 H new ATOM 0 HD22 LEU A 154 -10.887 7.129 0.492 1.00 0.00 H new ATOM 0 HD23 LEU A 154 -11.262 6.471 2.102 1.00 0.00 H new ATOM 2147 N ASP A 155 -13.224 11.434 1.781 1.00 0.00 N ATOM 2148 CA ASP A 155 -13.828 12.562 2.493 1.00 0.00 C ATOM 2149 C ASP A 155 -14.367 13.612 1.524 1.00 0.00 C ATOM 2150 O ASP A 155 -15.264 14.381 1.867 1.00 0.00 O ATOM 2151 CB ASP A 155 -12.808 13.187 3.441 1.00 0.00 C ATOM 2152 CG ASP A 155 -13.393 14.278 4.311 1.00 0.00 C ATOM 2153 OD1 ASP A 155 -14.231 13.963 5.180 1.00 0.00 O ATOM 2154 OD2 ASP A 155 -12.988 15.448 4.152 1.00 0.00 O ATOM 0 H ASP A 155 -12.224 11.318 1.947 1.00 0.00 H new ATOM 0 HA ASP A 155 -14.671 12.184 3.072 1.00 0.00 H new ATOM 0 HB2 ASP A 155 -12.389 12.408 4.078 1.00 0.00 H new ATOM 0 HB3 ASP A 155 -11.984 13.599 2.858 1.00 0.00 H new ATOM 2159 N ASP A 156 -13.830 13.619 0.309 1.00 0.00 N ATOM 2160 CA ASP A 156 -14.309 14.514 -0.741 1.00 0.00 C ATOM 2161 C ASP A 156 -15.734 14.140 -1.136 1.00 0.00 C ATOM 2162 O ASP A 156 -16.556 15.002 -1.444 1.00 0.00 O ATOM 2163 CB ASP A 156 -13.385 14.442 -1.962 1.00 0.00 C ATOM 2164 CG ASP A 156 -13.793 15.388 -3.075 1.00 0.00 C ATOM 2165 OD1 ASP A 156 -13.339 16.554 -3.064 1.00 0.00 O ATOM 2166 OD2 ASP A 156 -14.533 14.966 -3.986 1.00 0.00 O ATOM 0 H ASP A 156 -13.060 13.013 0.025 1.00 0.00 H new ATOM 0 HA ASP A 156 -14.305 15.536 -0.361 1.00 0.00 H new ATOM 0 HB2 ASP A 156 -12.366 14.673 -1.653 1.00 0.00 H new ATOM 0 HB3 ASP A 156 -13.378 13.422 -2.345 1.00 0.00 H new ATOM 2171 N TYR A 157 -16.024 12.844 -1.109 1.00 0.00 N ATOM 2172 CA TYR A 157 -17.363 12.352 -1.405 1.00 0.00 C ATOM 2173 C TYR A 157 -18.149 12.136 -0.106 1.00 0.00 C ATOM 2174 O TYR A 157 -19.371 11.997 -0.117 1.00 0.00 O ATOM 2175 CB TYR A 157 -17.298 11.038 -2.192 1.00 0.00 C ATOM 2176 CG TYR A 157 -16.357 11.052 -3.377 1.00 0.00 C ATOM 2177 CD1 TYR A 157 -16.662 11.757 -4.537 1.00 0.00 C ATOM 2178 CD2 TYR A 157 -15.166 10.341 -3.337 1.00 0.00 C ATOM 2179 CE1 TYR A 157 -15.802 11.751 -5.621 1.00 0.00 C ATOM 2180 CE2 TYR A 157 -14.305 10.327 -4.416 1.00 0.00 C ATOM 2181 CZ TYR A 157 -14.625 11.033 -5.555 1.00 0.00 C ATOM 2182 OH TYR A 157 -13.767 11.012 -6.636 1.00 0.00 O ATOM 0 H TYR A 157 -15.348 12.114 -0.885 1.00 0.00 H new ATOM 0 HA TYR A 157 -17.872 13.100 -2.013 1.00 0.00 H new ATOM 0 HB2 TYR A 157 -16.994 10.240 -1.514 1.00 0.00 H new ATOM 0 HB3 TYR A 157 -18.300 10.792 -2.545 1.00 0.00 H new ATOM 0 HD1 TYR A 157 -17.584 12.317 -4.592 1.00 0.00 H new ATOM 0 HD2 TYR A 157 -14.908 9.789 -2.446 1.00 0.00 H new ATOM 0 HE1 TYR A 157 -16.050 12.305 -6.514 1.00 0.00 H new ATOM 0 HE2 TYR A 157 -13.384 9.765 -4.367 1.00 0.00 H new ATOM 0 HH TYR A 157 -12.985 10.461 -6.422 1.00 0.00 H new ATOM 2192 N GLY A 158 -17.432 12.125 1.014 1.00 0.00 N ATOM 2193 CA GLY A 158 -18.058 11.952 2.314 1.00 0.00 C ATOM 2194 C GLY A 158 -17.973 10.528 2.852 1.00 0.00 C ATOM 2195 O GLY A 158 -18.795 10.127 3.676 1.00 0.00 O ATOM 0 H GLY A 158 -16.418 12.234 1.044 1.00 0.00 H new ATOM 0 HA2 GLY A 158 -17.587 12.629 3.027 1.00 0.00 H new ATOM 0 HA3 GLY A 158 -19.106 12.242 2.244 1.00 0.00 H new ATOM 2199 N LEU A 159 -16.986 9.764 2.395 1.00 0.00 N ATOM 2200 CA LEU A 159 -16.761 8.413 2.911 1.00 0.00 C ATOM 2201 C LEU A 159 -15.558 8.396 3.848 1.00 0.00 C ATOM 2202 O LEU A 159 -15.106 9.443 4.318 1.00 0.00 O ATOM 2203 CB LEU A 159 -16.525 7.400 1.781 1.00 0.00 C ATOM 2204 CG LEU A 159 -17.675 7.204 0.794 1.00 0.00 C ATOM 2205 CD1 LEU A 159 -19.012 7.178 1.517 1.00 0.00 C ATOM 2206 CD2 LEU A 159 -17.647 8.290 -0.257 1.00 0.00 C ATOM 0 H LEU A 159 -16.329 10.054 1.670 1.00 0.00 H new ATOM 0 HA LEU A 159 -17.662 8.125 3.452 1.00 0.00 H new ATOM 0 HB2 LEU A 159 -15.643 7.712 1.221 1.00 0.00 H new ATOM 0 HB3 LEU A 159 -16.292 6.435 2.230 1.00 0.00 H new ATOM 0 HG LEU A 159 -17.549 6.241 0.299 1.00 0.00 H new ATOM 0 HD11 LEU A 159 -19.815 7.037 0.793 1.00 0.00 H new ATOM 0 HD12 LEU A 159 -19.022 6.357 2.234 1.00 0.00 H new ATOM 0 HD13 LEU A 159 -19.159 8.121 2.043 1.00 0.00 H new ATOM 0 HD21 LEU A 159 -18.470 8.142 -0.956 1.00 0.00 H new ATOM 0 HD22 LEU A 159 -17.749 9.263 0.223 1.00 0.00 H new ATOM 0 HD23 LEU A 159 -16.701 8.249 -0.797 1.00 0.00 H new ATOM 2218 N SER A 160 -15.026 7.204 4.085 1.00 0.00 N ATOM 2219 CA SER A 160 -13.865 7.026 4.940 1.00 0.00 C ATOM 2220 C SER A 160 -13.238 5.659 4.683 1.00 0.00 C ATOM 2221 O SER A 160 -13.727 4.905 3.840 1.00 0.00 O ATOM 2222 CB SER A 160 -14.273 7.152 6.412 1.00 0.00 C ATOM 2223 OG SER A 160 -15.287 6.212 6.737 1.00 0.00 O ATOM 0 H SER A 160 -15.388 6.336 3.690 1.00 0.00 H new ATOM 0 HA SER A 160 -13.132 7.800 4.712 1.00 0.00 H new ATOM 0 HB2 SER A 160 -13.404 6.991 7.050 1.00 0.00 H new ATOM 0 HB3 SER A 160 -14.631 8.162 6.610 1.00 0.00 H new ATOM 0 HG SER A 160 -15.532 6.308 7.681 1.00 0.00 H new ATOM 2229 N VAL A 161 -12.160 5.337 5.390 1.00 0.00 N ATOM 2230 CA VAL A 161 -11.544 4.013 5.291 1.00 0.00 C ATOM 2231 C VAL A 161 -12.537 2.902 5.674 1.00 0.00 C ATOM 2232 O VAL A 161 -12.357 1.740 5.317 1.00 0.00 O ATOM 2233 CB VAL A 161 -10.296 3.898 6.179 1.00 0.00 C ATOM 2234 CG1 VAL A 161 -10.671 3.865 7.654 1.00 0.00 C ATOM 2235 CG2 VAL A 161 -9.482 2.674 5.786 1.00 0.00 C ATOM 0 H VAL A 161 -11.693 5.972 6.038 1.00 0.00 H new ATOM 0 HA VAL A 161 -11.249 3.888 4.249 1.00 0.00 H new ATOM 0 HB VAL A 161 -9.679 4.783 6.023 1.00 0.00 H new ATOM 0 HG11 VAL A 161 -9.767 3.783 8.258 1.00 0.00 H new ATOM 0 HG12 VAL A 161 -11.200 4.781 7.915 1.00 0.00 H new ATOM 0 HG13 VAL A 161 -11.315 3.007 7.847 1.00 0.00 H new ATOM 0 HG21 VAL A 161 -8.600 2.604 6.423 1.00 0.00 H new ATOM 0 HG22 VAL A 161 -10.090 1.778 5.908 1.00 0.00 H new ATOM 0 HG23 VAL A 161 -9.172 2.762 4.745 1.00 0.00 H new ATOM 2245 N ASN A 162 -13.586 3.260 6.405 1.00 0.00 N ATOM 2246 CA ASN A 162 -14.570 2.277 6.847 1.00 0.00 C ATOM 2247 C ASN A 162 -15.675 2.108 5.814 1.00 0.00 C ATOM 2248 O ASN A 162 -16.718 1.520 6.095 1.00 0.00 O ATOM 2249 CB ASN A 162 -15.164 2.664 8.204 1.00 0.00 C ATOM 2250 CG ASN A 162 -14.174 2.490 9.343 1.00 0.00 C ATOM 2251 OD1 ASN A 162 -13.298 1.625 9.291 1.00 0.00 O ATOM 2252 ND2 ASN A 162 -14.310 3.301 10.379 1.00 0.00 N ATOM 0 H ASN A 162 -13.777 4.217 6.703 1.00 0.00 H new ATOM 0 HA ASN A 162 -14.055 1.323 6.958 1.00 0.00 H new ATOM 0 HB2 ASN A 162 -15.495 3.702 8.170 1.00 0.00 H new ATOM 0 HB3 ASN A 162 -16.047 2.055 8.398 1.00 0.00 H new ATOM 0 HD21 ASN A 162 -13.676 3.223 11.174 1.00 0.00 H new ATOM 0 HD22 ASN A 162 -15.049 4.004 10.383 1.00 0.00 H new ATOM 2259 N SER A 163 -15.444 2.624 4.619 1.00 0.00 N ATOM 2260 CA SER A 163 -16.383 2.450 3.528 1.00 0.00 C ATOM 2261 C SER A 163 -16.127 1.109 2.849 1.00 0.00 C ATOM 2262 O SER A 163 -14.999 0.615 2.828 1.00 0.00 O ATOM 2263 CB SER A 163 -16.261 3.599 2.525 1.00 0.00 C ATOM 2264 OG SER A 163 -17.367 3.620 1.638 1.00 0.00 O ATOM 0 H SER A 163 -14.614 3.167 4.381 1.00 0.00 H new ATOM 0 HA SER A 163 -17.399 2.460 3.923 1.00 0.00 H new ATOM 0 HB2 SER A 163 -16.201 4.547 3.059 1.00 0.00 H new ATOM 0 HB3 SER A 163 -15.337 3.494 1.957 1.00 0.00 H new ATOM 0 HG SER A 163 -17.132 4.130 0.835 1.00 0.00 H new ATOM 2270 N THR A 164 -17.187 0.519 2.329 1.00 0.00 N ATOM 2271 CA THR A 164 -17.133 -0.807 1.737 1.00 0.00 C ATOM 2272 C THR A 164 -16.414 -0.802 0.380 1.00 0.00 C ATOM 2273 O THR A 164 -16.452 0.188 -0.346 1.00 0.00 O ATOM 2274 CB THR A 164 -18.566 -1.339 1.569 1.00 0.00 C ATOM 2275 OG1 THR A 164 -19.309 -1.073 2.764 1.00 0.00 O ATOM 2276 CG2 THR A 164 -18.575 -2.831 1.301 1.00 0.00 C ATOM 0 H THR A 164 -18.113 0.946 2.305 1.00 0.00 H new ATOM 0 HA THR A 164 -16.563 -1.455 2.403 1.00 0.00 H new ATOM 0 HB THR A 164 -19.019 -0.835 0.715 1.00 0.00 H new ATOM 0 HG1 THR A 164 -20.059 -0.477 2.557 1.00 0.00 H new ATOM 0 HG21 THR A 164 -19.603 -3.174 1.187 1.00 0.00 H new ATOM 0 HG22 THR A 164 -18.020 -3.040 0.387 1.00 0.00 H new ATOM 0 HG23 THR A 164 -18.108 -3.353 2.136 1.00 0.00 H new ATOM 2284 N PHE A 165 -15.759 -1.931 0.059 1.00 0.00 N ATOM 2285 CA PHE A 165 -15.077 -2.138 -1.227 1.00 0.00 C ATOM 2286 C PHE A 165 -16.010 -1.869 -2.403 1.00 0.00 C ATOM 2287 O PHE A 165 -15.561 -1.590 -3.510 1.00 0.00 O ATOM 2288 CB PHE A 165 -14.522 -3.574 -1.319 1.00 0.00 C ATOM 2289 CG PHE A 165 -13.274 -3.800 -0.512 1.00 0.00 C ATOM 2290 CD1 PHE A 165 -12.536 -2.733 -0.063 1.00 0.00 C ATOM 2291 CD2 PHE A 165 -12.827 -5.075 -0.227 1.00 0.00 C ATOM 2292 CE1 PHE A 165 -11.386 -2.912 0.654 1.00 0.00 C ATOM 2293 CE2 PHE A 165 -11.669 -5.268 0.500 1.00 0.00 C ATOM 2294 CZ PHE A 165 -10.946 -4.177 0.942 1.00 0.00 C ATOM 0 H PHE A 165 -15.688 -2.730 0.690 1.00 0.00 H new ATOM 0 HA PHE A 165 -14.251 -1.429 -1.278 1.00 0.00 H new ATOM 0 HB2 PHE A 165 -15.290 -4.271 -0.984 1.00 0.00 H new ATOM 0 HB3 PHE A 165 -14.314 -3.806 -2.364 1.00 0.00 H new ATOM 0 HD1 PHE A 165 -12.871 -1.730 -0.281 1.00 0.00 H new ATOM 0 HD2 PHE A 165 -13.388 -5.929 -0.576 1.00 0.00 H new ATOM 0 HE1 PHE A 165 -10.824 -2.055 0.994 1.00 0.00 H new ATOM 0 HE2 PHE A 165 -11.330 -6.269 0.722 1.00 0.00 H new ATOM 0 HZ PHE A 165 -10.039 -4.320 1.511 1.00 0.00 H new ATOM 2304 N ASP A 166 -17.306 -1.965 -2.149 1.00 0.00 N ATOM 2305 CA ASP A 166 -18.312 -1.669 -3.156 1.00 0.00 C ATOM 2306 C ASP A 166 -18.582 -0.169 -3.215 1.00 0.00 C ATOM 2307 O ASP A 166 -18.523 0.438 -4.280 1.00 0.00 O ATOM 2308 CB ASP A 166 -19.606 -2.424 -2.846 1.00 0.00 C ATOM 2309 CG ASP A 166 -20.695 -2.145 -3.861 1.00 0.00 C ATOM 2310 OD1 ASP A 166 -20.688 -2.784 -4.933 1.00 0.00 O ATOM 2311 OD2 ASP A 166 -21.561 -1.291 -3.589 1.00 0.00 O ATOM 0 H ASP A 166 -17.687 -2.248 -1.246 1.00 0.00 H new ATOM 0 HA ASP A 166 -17.937 -1.993 -4.127 1.00 0.00 H new ATOM 0 HB2 ASP A 166 -19.402 -3.494 -2.821 1.00 0.00 H new ATOM 0 HB3 ASP A 166 -19.958 -2.144 -1.853 1.00 0.00 H new ATOM 2316 N GLN A 167 -18.848 0.424 -2.054 1.00 0.00 N ATOM 2317 CA GLN A 167 -19.199 1.839 -1.966 1.00 0.00 C ATOM 2318 C GLN A 167 -18.041 2.759 -2.348 1.00 0.00 C ATOM 2319 O GLN A 167 -18.250 3.734 -3.063 1.00 0.00 O ATOM 2320 CB GLN A 167 -19.703 2.168 -0.564 1.00 0.00 C ATOM 2321 CG GLN A 167 -21.147 1.751 -0.343 1.00 0.00 C ATOM 2322 CD GLN A 167 -21.578 1.871 1.103 1.00 0.00 C ATOM 2323 OE1 GLN A 167 -21.472 0.779 1.836 1.00 0.00 O flip ATOM 2324 NE2 GLN A 167 -22.026 2.928 1.547 1.00 0.00 N flip ATOM 0 H GLN A 167 -18.827 -0.058 -1.155 1.00 0.00 H new ATOM 0 HA GLN A 167 -19.994 2.019 -2.690 1.00 0.00 H new ATOM 0 HB2 GLN A 167 -19.070 1.670 0.171 1.00 0.00 H new ATOM 0 HB3 GLN A 167 -19.609 3.240 -0.392 1.00 0.00 H new ATOM 0 HG2 GLN A 167 -21.797 2.368 -0.963 1.00 0.00 H new ATOM 0 HG3 GLN A 167 -21.277 0.720 -0.672 1.00 0.00 H new ATOM 0 HE21 GLN A 167 -22.090 3.748 0.944 1.00 0.00 H new ATOM 0 HE22 GLN A 167 -22.333 2.984 2.518 1.00 0.00 H new ATOM 2333 N VAL A 168 -16.832 2.463 -1.872 1.00 0.00 N ATOM 2334 CA VAL A 168 -15.650 3.236 -2.265 1.00 0.00 C ATOM 2335 C VAL A 168 -15.514 3.247 -3.777 1.00 0.00 C ATOM 2336 O VAL A 168 -15.532 4.305 -4.400 1.00 0.00 O ATOM 2337 CB VAL A 168 -14.351 2.678 -1.639 1.00 0.00 C ATOM 2338 CG1 VAL A 168 -13.121 3.058 -2.459 1.00 0.00 C ATOM 2339 CG2 VAL A 168 -14.190 3.197 -0.239 1.00 0.00 C ATOM 0 H VAL A 168 -16.644 1.702 -1.220 1.00 0.00 H new ATOM 0 HA VAL A 168 -15.792 4.251 -1.893 1.00 0.00 H new ATOM 0 HB VAL A 168 -14.434 1.591 -1.628 1.00 0.00 H new ATOM 0 HG11 VAL A 168 -12.228 2.648 -1.987 1.00 0.00 H new ATOM 0 HG12 VAL A 168 -13.217 2.654 -3.467 1.00 0.00 H new ATOM 0 HG13 VAL A 168 -13.038 4.144 -2.509 1.00 0.00 H new ATOM 0 HG21 VAL A 168 -13.272 2.798 0.194 1.00 0.00 H new ATOM 0 HG22 VAL A 168 -14.139 4.286 -0.258 1.00 0.00 H new ATOM 0 HG23 VAL A 168 -15.042 2.884 0.365 1.00 0.00 H new ATOM 2349 N ALA A 169 -15.410 2.053 -4.352 1.00 0.00 N ATOM 2350 CA ALA A 169 -15.255 1.896 -5.785 1.00 0.00 C ATOM 2351 C ALA A 169 -16.376 2.606 -6.542 1.00 0.00 C ATOM 2352 O ALA A 169 -16.135 3.283 -7.535 1.00 0.00 O ATOM 2353 CB ALA A 169 -15.200 0.414 -6.127 1.00 0.00 C ATOM 0 H ALA A 169 -15.431 1.173 -3.836 1.00 0.00 H new ATOM 0 HA ALA A 169 -14.320 2.362 -6.097 1.00 0.00 H new ATOM 0 HB1 ALA A 169 -15.083 0.293 -7.204 1.00 0.00 H new ATOM 0 HB2 ALA A 169 -14.354 -0.046 -5.617 1.00 0.00 H new ATOM 0 HB3 ALA A 169 -16.123 -0.068 -5.806 1.00 0.00 H new ATOM 2359 N ALA A 170 -17.598 2.458 -6.051 1.00 0.00 N ATOM 2360 CA ALA A 170 -18.762 3.096 -6.652 1.00 0.00 C ATOM 2361 C ALA A 170 -18.733 4.624 -6.528 1.00 0.00 C ATOM 2362 O ALA A 170 -19.173 5.342 -7.429 1.00 0.00 O ATOM 2363 CB ALA A 170 -20.012 2.529 -6.022 1.00 0.00 C ATOM 0 H ALA A 170 -17.811 1.895 -5.228 1.00 0.00 H new ATOM 0 HA ALA A 170 -18.750 2.881 -7.721 1.00 0.00 H new ATOM 0 HB1 ALA A 170 -20.889 3.001 -6.465 1.00 0.00 H new ATOM 0 HB2 ALA A 170 -20.051 1.454 -6.196 1.00 0.00 H new ATOM 0 HB3 ALA A 170 -19.999 2.723 -4.949 1.00 0.00 H new ATOM 2369 N ALA A 171 -18.218 5.124 -5.413 1.00 0.00 N ATOM 2370 CA ALA A 171 -18.175 6.554 -5.173 1.00 0.00 C ATOM 2371 C ALA A 171 -17.061 7.188 -5.981 1.00 0.00 C ATOM 2372 O ALA A 171 -17.159 8.335 -6.419 1.00 0.00 O ATOM 2373 CB ALA A 171 -17.969 6.826 -3.697 1.00 0.00 C ATOM 0 H ALA A 171 -17.825 4.557 -4.662 1.00 0.00 H new ATOM 0 HA ALA A 171 -19.124 6.991 -5.484 1.00 0.00 H new ATOM 0 HB1 ALA A 171 -17.938 7.902 -3.526 1.00 0.00 H new ATOM 0 HB2 ALA A 171 -18.792 6.392 -3.129 1.00 0.00 H new ATOM 0 HB3 ALA A 171 -17.029 6.380 -3.373 1.00 0.00 H new ATOM 2379 N THR A 172 -16.014 6.420 -6.200 1.00 0.00 N ATOM 2380 CA THR A 172 -14.877 6.895 -6.949 1.00 0.00 C ATOM 2381 C THR A 172 -15.140 6.692 -8.430 1.00 0.00 C ATOM 2382 O THR A 172 -14.464 7.253 -9.295 1.00 0.00 O ATOM 2383 CB THR A 172 -13.599 6.163 -6.519 1.00 0.00 C ATOM 2384 OG1 THR A 172 -13.784 4.744 -6.607 1.00 0.00 O ATOM 2385 CG2 THR A 172 -13.225 6.537 -5.098 1.00 0.00 C ATOM 0 H THR A 172 -15.930 5.460 -5.867 1.00 0.00 H new ATOM 0 HA THR A 172 -14.732 7.957 -6.750 1.00 0.00 H new ATOM 0 HB THR A 172 -12.794 6.462 -7.190 1.00 0.00 H new ATOM 0 HG1 THR A 172 -14.272 4.428 -5.818 1.00 0.00 H new ATOM 0 HG21 THR A 172 -12.316 6.008 -4.810 1.00 0.00 H new ATOM 0 HG22 THR A 172 -13.054 7.612 -5.038 1.00 0.00 H new ATOM 0 HG23 THR A 172 -14.035 6.260 -4.424 1.00 0.00 H new ATOM 2393 N ALA A 173 -16.145 5.870 -8.693 1.00 0.00 N ATOM 2394 CA ALA A 173 -16.652 5.641 -10.028 1.00 0.00 C ATOM 2395 C ALA A 173 -17.373 6.878 -10.506 1.00 0.00 C ATOM 2396 O ALA A 173 -17.173 7.349 -11.628 1.00 0.00 O ATOM 2397 CB ALA A 173 -17.606 4.458 -10.015 1.00 0.00 C ATOM 0 H ALA A 173 -16.634 5.339 -7.973 1.00 0.00 H new ATOM 0 HA ALA A 173 -15.824 5.422 -10.702 1.00 0.00 H new ATOM 0 HB1 ALA A 173 -17.987 4.287 -11.022 1.00 0.00 H new ATOM 0 HB2 ALA A 173 -17.078 3.569 -9.671 1.00 0.00 H new ATOM 0 HB3 ALA A 173 -18.438 4.669 -9.343 1.00 0.00 H new ATOM 2403 N VAL A 174 -18.196 7.412 -9.622 1.00 0.00 N ATOM 2404 CA VAL A 174 -19.035 8.540 -9.945 1.00 0.00 C ATOM 2405 C VAL A 174 -19.696 9.085 -8.686 1.00 0.00 C ATOM 2406 O VAL A 174 -19.948 10.284 -8.564 1.00 0.00 O ATOM 2407 CB VAL A 174 -20.114 8.122 -10.960 1.00 0.00 C ATOM 2408 CG1 VAL A 174 -21.117 7.186 -10.325 1.00 0.00 C ATOM 2409 CG2 VAL A 174 -20.801 9.327 -11.581 1.00 0.00 C ATOM 0 H VAL A 174 -18.298 7.074 -8.665 1.00 0.00 H new ATOM 0 HA VAL A 174 -18.414 9.321 -10.384 1.00 0.00 H new ATOM 0 HB VAL A 174 -19.615 7.586 -11.767 1.00 0.00 H new ATOM 0 HG11 VAL A 174 -21.869 6.905 -11.062 1.00 0.00 H new ATOM 0 HG12 VAL A 174 -20.605 6.292 -9.969 1.00 0.00 H new ATOM 0 HG13 VAL A 174 -21.600 7.686 -9.486 1.00 0.00 H new ATOM 0 HG21 VAL A 174 -21.556 8.990 -12.292 1.00 0.00 H new ATOM 0 HG22 VAL A 174 -21.278 9.917 -10.798 1.00 0.00 H new ATOM 0 HG23 VAL A 174 -20.063 9.940 -12.099 1.00 0.00 H new ATOM 2419 N GLY A 175 -19.953 8.188 -7.742 1.00 0.00 N ATOM 2420 CA GLY A 175 -20.667 8.557 -6.549 1.00 0.00 C ATOM 2421 C GLY A 175 -22.086 8.064 -6.594 1.00 0.00 C ATOM 2422 O GLY A 175 -22.874 8.505 -7.426 1.00 0.00 O ATOM 0 H GLY A 175 -19.675 7.208 -7.788 1.00 0.00 H new ATOM 0 HA2 GLY A 175 -20.162 8.143 -5.676 1.00 0.00 H new ATOM 0 HA3 GLY A 175 -20.659 9.641 -6.437 1.00 0.00 H new ATOM 2426 N VAL A 176 -22.418 7.150 -5.707 1.00 0.00 N ATOM 2427 CA VAL A 176 -23.702 6.477 -5.767 1.00 0.00 C ATOM 2428 C VAL A 176 -24.379 6.509 -4.400 1.00 0.00 C ATOM 2429 O VAL A 176 -25.176 5.640 -4.048 1.00 0.00 O ATOM 2430 CB VAL A 176 -23.503 5.026 -6.252 1.00 0.00 C ATOM 2431 CG1 VAL A 176 -22.683 5.018 -7.541 1.00 0.00 C ATOM 2432 CG2 VAL A 176 -22.824 4.180 -5.184 1.00 0.00 C ATOM 0 H VAL A 176 -21.819 6.855 -4.936 1.00 0.00 H new ATOM 0 HA VAL A 176 -24.350 6.995 -6.475 1.00 0.00 H new ATOM 0 HB VAL A 176 -24.483 4.591 -6.450 1.00 0.00 H new ATOM 0 HG11 VAL A 176 -22.546 3.991 -7.879 1.00 0.00 H new ATOM 0 HG12 VAL A 176 -23.208 5.585 -8.310 1.00 0.00 H new ATOM 0 HG13 VAL A 176 -21.710 5.472 -7.356 1.00 0.00 H new ATOM 0 HG21 VAL A 176 -22.696 3.162 -5.553 1.00 0.00 H new ATOM 0 HG22 VAL A 176 -21.849 4.606 -4.948 1.00 0.00 H new ATOM 0 HG23 VAL A 176 -23.440 4.166 -4.285 1.00 0.00 H new ATOM 2442 N GLN A 177 -24.076 7.558 -3.653 1.00 0.00 N ATOM 2443 CA GLN A 177 -24.476 7.664 -2.255 1.00 0.00 C ATOM 2444 C GLN A 177 -25.868 8.272 -2.114 1.00 0.00 C ATOM 2445 O GLN A 177 -26.364 8.457 -1.004 1.00 0.00 O ATOM 2446 CB GLN A 177 -23.453 8.524 -1.516 1.00 0.00 C ATOM 2447 CG GLN A 177 -22.022 8.080 -1.761 1.00 0.00 C ATOM 2448 CD GLN A 177 -21.004 9.162 -1.458 1.00 0.00 C ATOM 2449 OE1 GLN A 177 -19.967 9.237 -2.106 1.00 0.00 O ATOM 2450 NE2 GLN A 177 -21.285 9.995 -0.467 1.00 0.00 N ATOM 0 H GLN A 177 -23.547 8.360 -3.996 1.00 0.00 H new ATOM 0 HA GLN A 177 -24.512 6.663 -1.824 1.00 0.00 H new ATOM 0 HB2 GLN A 177 -23.565 9.562 -1.829 1.00 0.00 H new ATOM 0 HB3 GLN A 177 -23.661 8.489 -0.447 1.00 0.00 H new ATOM 0 HG2 GLN A 177 -21.809 7.206 -1.146 1.00 0.00 H new ATOM 0 HG3 GLN A 177 -21.917 7.771 -2.801 1.00 0.00 H new ATOM 0 HE21 GLN A 177 -22.160 9.898 0.048 1.00 0.00 H new ATOM 0 HE22 GLN A 177 -20.626 10.733 -0.219 1.00 0.00 H new ATOM 2459 N HIS A 178 -26.498 8.577 -3.237 1.00 0.00 N ATOM 2460 CA HIS A 178 -27.816 9.188 -3.226 1.00 0.00 C ATOM 2461 C HIS A 178 -28.619 8.713 -4.427 1.00 0.00 C ATOM 2462 O HIS A 178 -29.333 7.702 -4.295 1.00 0.00 O ATOM 2463 CB HIS A 178 -27.695 10.717 -3.224 1.00 0.00 C ATOM 2464 CG HIS A 178 -29.009 11.436 -3.167 1.00 0.00 C ATOM 2465 ND1 HIS A 178 -29.825 11.429 -2.059 1.00 0.00 N ATOM 2466 CD2 HIS A 178 -29.640 12.198 -4.089 1.00 0.00 C ATOM 2467 CE1 HIS A 178 -30.900 12.155 -2.302 1.00 0.00 C ATOM 2468 NE2 HIS A 178 -30.813 12.637 -3.526 1.00 0.00 N ATOM 2469 OXT HIS A 178 -28.512 9.336 -5.502 1.00 0.00 O ATOM 0 H HIS A 178 -26.117 8.411 -4.168 1.00 0.00 H new ATOM 0 HA HIS A 178 -28.339 8.887 -2.318 1.00 0.00 H new ATOM 0 HB2 HIS A 178 -27.089 11.021 -2.370 1.00 0.00 H new ATOM 0 HB3 HIS A 178 -27.161 11.029 -4.121 1.00 0.00 H new ATOM 0 HD2 HIS A 178 -29.286 12.420 -5.085 1.00 0.00 H new ATOM 0 HE1 HIS A 178 -31.714 12.326 -1.614 1.00 0.00 H new ATOM 0 HE2 HIS A 178 -31.502 13.236 -3.979 1.00 0.00 H new TER 2478 HIS A 178