USER MOD reduce.3.24.130724 H: found=0, std=0, add=572, rem=0, adj=20 USER MOD reduce.3.24.130724 removed 573 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 132 THR OG1 : rot 170:sc= 0.156 USER MOD Set 1.2: A 158 ASN : amide:sc= 0.169 X(o=0.33,f=0.61) USER MOD Set 2.1: A 95 ASN : amide:sc= 0.756 K(o=1.5,f=-2.6!) USER MOD Set 2.2: A 101 SER OG : rot 120:sc= 0.936 USER MOD Set 2.3: A 157 MET CE :methyl -162:sc= -0.169 (180deg=-1.35) USER MOD Single : A 90 SER OG : rot 180:sc= 0 USER MOD Single : A 100 SER OG : rot 160:sc= 0.54 USER MOD Single : A 102 THR OG1 : rot 180:sc= 0 USER MOD Single : A 103 TYR OH : rot 180:sc= -0.304 USER MOD Single : A 108 THR OG1 : rot 180:sc= 0 USER MOD Single : A 109 GLN : amide:sc= -0.149 K(o=-0.15,f=-4.1!) USER MOD Single : A 110 THR OG1 : rot -82:sc= 0.0525 USER MOD Single : A 113 HIS : no HD1:sc= 0 X(o=0,f=-0.0058) USER MOD Single : A 115 LYS NZ :NH3+ -122:sc= 1.24 (180deg=-0.739) USER MOD Single : A 116 GLN :FLIP amide:sc= -1.43 F(o=-6.6!,f=-1.4) USER MOD Single : A 117 GLN :FLIP amide:sc= 0 F(o=-0.9,f=0) USER MOD Single : A 119 SER OG : rot -128:sc= 1.26 USER MOD Single : A 125 GLN :FLIP amide:sc= -0.0706 F(o=-1.6!,f=-0.071) USER MOD Single : A 136 LYS NZ :NH3+ 176:sc= -0.284 (180deg=-0.339) USER MOD Single : A 141 GLN :FLIP amide:sc= -0.0244 F(o=-1.3!,f=-0.024) USER MOD Single : A 147 TYR OH : rot 70:sc= -0.62 USER MOD Single : A 150 LYS NZ :NH3+ -168:sc=-0.00825 (180deg=-0.134) USER MOD Single : A 153 SER OG : rot 42:sc= 0.229 USER MOD Single : A 154 THR OG1 : rot 28:sc= 0.425 USER MOD ----------------------------------------------------------------- ATOM 28 N PRO A 88 11.672 -9.074 -2.727 1.00 0.00 N ATOM 29 CA PRO A 88 10.865 -7.877 -2.632 1.00 0.00 C ATOM 30 C PRO A 88 10.150 -7.541 -3.938 1.00 0.00 C ATOM 31 O PRO A 88 10.724 -7.631 -5.026 1.00 0.00 O ATOM 32 CB PRO A 88 11.902 -6.810 -2.285 1.00 0.00 C ATOM 33 CG PRO A 88 13.208 -7.311 -2.832 1.00 0.00 C ATOM 34 CD PRO A 88 13.021 -8.762 -3.213 1.00 0.00 C ATOM 0 HA PRO A 88 10.059 -7.973 -1.904 1.00 0.00 H new ATOM 0 HB2 PRO A 88 11.637 -5.849 -2.726 1.00 0.00 H new ATOM 0 HB3 PRO A 88 11.962 -6.660 -1.207 1.00 0.00 H new ATOM 0 HG2 PRO A 88 13.510 -6.724 -3.699 1.00 0.00 H new ATOM 0 HG3 PRO A 88 13.998 -7.210 -2.088 1.00 0.00 H new ATOM 0 HD2 PRO A 88 13.103 -8.908 -4.290 1.00 0.00 H new ATOM 0 HD3 PRO A 88 13.773 -9.399 -2.747 1.00 0.00 H new ATOM 42 N LEU A 89 8.896 -7.163 -3.818 1.00 0.00 N ATOM 43 CA LEU A 89 8.101 -6.763 -4.960 1.00 0.00 C ATOM 44 C LEU A 89 8.096 -5.238 -5.054 1.00 0.00 C ATOM 45 O LEU A 89 7.766 -4.548 -4.086 1.00 0.00 O ATOM 46 CB LEU A 89 6.667 -7.291 -4.803 1.00 0.00 C ATOM 47 CG LEU A 89 5.903 -7.608 -6.097 1.00 0.00 C ATOM 48 CD1 LEU A 89 5.931 -6.438 -7.065 1.00 0.00 C ATOM 49 CD2 LEU A 89 6.448 -8.862 -6.757 1.00 0.00 C ATOM 0 H LEU A 89 8.399 -7.124 -2.928 1.00 0.00 H new ATOM 0 HA LEU A 89 8.528 -7.179 -5.873 1.00 0.00 H new ATOM 0 HB2 LEU A 89 6.702 -8.197 -4.198 1.00 0.00 H new ATOM 0 HB3 LEU A 89 6.093 -6.555 -4.241 1.00 0.00 H new ATOM 0 HG LEU A 89 4.863 -7.787 -5.824 1.00 0.00 H new ATOM 0 HD11 LEU A 89 5.380 -6.700 -7.968 1.00 0.00 H new ATOM 0 HD12 LEU A 89 5.469 -5.568 -6.598 1.00 0.00 H new ATOM 0 HD13 LEU A 89 6.964 -6.205 -7.324 1.00 0.00 H new ATOM 0 HD21 LEU A 89 5.890 -9.064 -7.671 1.00 0.00 H new ATOM 0 HD22 LEU A 89 7.501 -8.717 -6.999 1.00 0.00 H new ATOM 0 HD23 LEU A 89 6.345 -9.706 -6.075 1.00 0.00 H new ATOM 61 N SER A 90 8.475 -4.717 -6.206 1.00 0.00 N ATOM 62 CA SER A 90 8.471 -3.285 -6.427 1.00 0.00 C ATOM 63 C SER A 90 7.115 -2.839 -6.965 1.00 0.00 C ATOM 64 O SER A 90 6.822 -2.990 -8.154 1.00 0.00 O ATOM 65 CB SER A 90 9.593 -2.908 -7.401 1.00 0.00 C ATOM 66 OG SER A 90 9.728 -1.504 -7.528 1.00 0.00 O ATOM 0 H SER A 90 8.790 -5.267 -7.005 1.00 0.00 H new ATOM 0 HA SER A 90 8.646 -2.775 -5.480 1.00 0.00 H new ATOM 0 HB2 SER A 90 10.534 -3.334 -7.054 1.00 0.00 H new ATOM 0 HB3 SER A 90 9.387 -3.344 -8.379 1.00 0.00 H new ATOM 0 HG SER A 90 10.453 -1.300 -8.155 1.00 0.00 H new ATOM 72 N ILE A 91 6.278 -2.320 -6.075 1.00 0.00 N ATOM 73 CA ILE A 91 4.949 -1.856 -6.452 1.00 0.00 C ATOM 74 C ILE A 91 4.936 -0.339 -6.572 1.00 0.00 C ATOM 75 O ILE A 91 5.836 0.340 -6.073 1.00 0.00 O ATOM 76 CB ILE A 91 3.870 -2.287 -5.436 1.00 0.00 C ATOM 77 CG1 ILE A 91 4.194 -1.740 -4.042 1.00 0.00 C ATOM 78 CG2 ILE A 91 3.745 -3.805 -5.405 1.00 0.00 C ATOM 79 CD1 ILE A 91 3.099 -1.982 -3.025 1.00 0.00 C ATOM 0 H ILE A 91 6.497 -2.210 -5.085 1.00 0.00 H new ATOM 0 HA ILE A 91 4.715 -2.314 -7.413 1.00 0.00 H new ATOM 0 HB ILE A 91 2.913 -1.871 -5.750 1.00 0.00 H new ATOM 0 HG12 ILE A 91 5.116 -2.199 -3.686 1.00 0.00 H new ATOM 0 HG13 ILE A 91 4.379 -0.668 -4.116 1.00 0.00 H new ATOM 0 HG21 ILE A 91 2.980 -4.092 -4.684 1.00 0.00 H new ATOM 0 HG22 ILE A 91 3.465 -4.167 -6.394 1.00 0.00 H new ATOM 0 HG23 ILE A 91 4.700 -4.243 -5.115 1.00 0.00 H new ATOM 0 HD11 ILE A 91 3.399 -1.568 -2.062 1.00 0.00 H new ATOM 0 HD12 ILE A 91 2.180 -1.499 -3.358 1.00 0.00 H new ATOM 0 HD13 ILE A 91 2.929 -3.054 -2.922 1.00 0.00 H new ATOM 91 N LEU A 92 3.913 0.193 -7.219 1.00 0.00 N ATOM 92 CA LEU A 92 3.818 1.626 -7.422 1.00 0.00 C ATOM 93 C LEU A 92 2.561 2.178 -6.763 1.00 0.00 C ATOM 94 O LEU A 92 1.444 1.888 -7.194 1.00 0.00 O ATOM 95 CB LEU A 92 3.812 1.952 -8.916 1.00 0.00 C ATOM 96 CG LEU A 92 4.007 3.430 -9.255 1.00 0.00 C ATOM 97 CD1 LEU A 92 5.385 3.899 -8.807 1.00 0.00 C ATOM 98 CD2 LEU A 92 3.813 3.662 -10.747 1.00 0.00 C ATOM 0 H LEU A 92 3.140 -0.345 -7.611 1.00 0.00 H new ATOM 0 HA LEU A 92 4.687 2.095 -6.962 1.00 0.00 H new ATOM 0 HB2 LEU A 92 4.600 1.376 -9.401 1.00 0.00 H new ATOM 0 HB3 LEU A 92 2.865 1.619 -9.342 1.00 0.00 H new ATOM 0 HG LEU A 92 3.258 4.014 -8.720 1.00 0.00 H new ATOM 0 HD11 LEU A 92 5.509 4.953 -9.055 1.00 0.00 H new ATOM 0 HD12 LEU A 92 5.482 3.766 -7.730 1.00 0.00 H new ATOM 0 HD13 LEU A 92 6.151 3.314 -9.315 1.00 0.00 H new ATOM 0 HD21 LEU A 92 3.955 4.719 -10.972 1.00 0.00 H new ATOM 0 HD22 LEU A 92 4.540 3.071 -11.305 1.00 0.00 H new ATOM 0 HD23 LEU A 92 2.805 3.362 -11.034 1.00 0.00 H new ATOM 110 N VAL A 93 2.738 2.956 -5.709 1.00 0.00 N ATOM 111 CA VAL A 93 1.617 3.599 -5.041 1.00 0.00 C ATOM 112 C VAL A 93 1.667 5.099 -5.288 1.00 0.00 C ATOM 113 O VAL A 93 2.579 5.781 -4.831 1.00 0.00 O ATOM 114 CB VAL A 93 1.616 3.322 -3.520 1.00 0.00 C ATOM 115 CG1 VAL A 93 0.414 3.977 -2.851 1.00 0.00 C ATOM 116 CG2 VAL A 93 1.630 1.826 -3.248 1.00 0.00 C ATOM 0 H VAL A 93 3.648 3.159 -5.296 1.00 0.00 H new ATOM 0 HA VAL A 93 0.699 3.182 -5.455 1.00 0.00 H new ATOM 0 HB VAL A 93 2.521 3.757 -3.095 1.00 0.00 H new ATOM 0 HG11 VAL A 93 0.435 3.768 -1.781 1.00 0.00 H new ATOM 0 HG12 VAL A 93 0.451 5.055 -3.011 1.00 0.00 H new ATOM 0 HG13 VAL A 93 -0.504 3.577 -3.281 1.00 0.00 H new ATOM 0 HG21 VAL A 93 1.629 1.652 -2.172 1.00 0.00 H new ATOM 0 HG22 VAL A 93 0.746 1.367 -3.691 1.00 0.00 H new ATOM 0 HG23 VAL A 93 2.525 1.385 -3.686 1.00 0.00 H new ATOM 126 N ARG A 94 0.704 5.607 -6.033 1.00 0.00 N ATOM 127 CA ARG A 94 0.690 7.018 -6.368 1.00 0.00 C ATOM 128 C ARG A 94 -0.080 7.812 -5.330 1.00 0.00 C ATOM 129 O ARG A 94 -1.238 7.506 -5.027 1.00 0.00 O ATOM 130 CB ARG A 94 0.104 7.252 -7.761 1.00 0.00 C ATOM 131 CG ARG A 94 1.067 6.896 -8.876 1.00 0.00 C ATOM 132 CD ARG A 94 0.530 7.299 -10.235 1.00 0.00 C ATOM 133 NE ARG A 94 1.569 7.237 -11.261 1.00 0.00 N ATOM 134 CZ ARG A 94 1.334 7.225 -12.571 1.00 0.00 C ATOM 135 NH1 ARG A 94 0.089 7.268 -13.029 1.00 0.00 N ATOM 136 NH2 ARG A 94 2.350 7.178 -13.427 1.00 0.00 N ATOM 0 H ARG A 94 -0.073 5.069 -6.415 1.00 0.00 H new ATOM 0 HA ARG A 94 1.723 7.366 -6.373 1.00 0.00 H new ATOM 0 HB2 ARG A 94 -0.805 6.661 -7.871 1.00 0.00 H new ATOM 0 HB3 ARG A 94 -0.183 8.299 -7.857 1.00 0.00 H new ATOM 0 HG2 ARG A 94 2.023 7.390 -8.702 1.00 0.00 H new ATOM 0 HG3 ARG A 94 1.256 5.823 -8.864 1.00 0.00 H new ATOM 0 HD2 ARG A 94 -0.295 6.642 -10.511 1.00 0.00 H new ATOM 0 HD3 ARG A 94 0.128 8.311 -10.183 1.00 0.00 H new ATOM 0 HE ARG A 94 2.540 7.200 -10.952 1.00 0.00 H new ATOM 0 HH11 ARG A 94 -0.693 7.311 -12.376 1.00 0.00 H new ATOM 0 HH12 ARG A 94 -0.085 7.259 -14.034 1.00 0.00 H new ATOM 0 HH21 ARG A 94 3.309 7.151 -13.080 1.00 0.00 H new ATOM 0 HH22 ARG A 94 2.171 7.169 -14.431 1.00 0.00 H new ATOM 150 N ASN A 95 0.582 8.820 -4.780 1.00 0.00 N ATOM 151 CA ASN A 95 -0.043 9.716 -3.819 1.00 0.00 C ATOM 152 C ASN A 95 -1.119 10.521 -4.531 1.00 0.00 C ATOM 153 O ASN A 95 -1.000 10.776 -5.733 1.00 0.00 O ATOM 154 CB ASN A 95 0.995 10.668 -3.203 1.00 0.00 C ATOM 155 CG ASN A 95 2.271 9.964 -2.769 1.00 0.00 C ATOM 156 OD1 ASN A 95 2.270 8.782 -2.423 1.00 0.00 O ATOM 157 ND2 ASN A 95 3.377 10.694 -2.772 1.00 0.00 N ATOM 0 H ASN A 95 1.557 9.038 -4.985 1.00 0.00 H new ATOM 0 HA ASN A 95 -0.482 9.127 -3.014 1.00 0.00 H new ATOM 0 HB2 ASN A 95 1.244 11.442 -3.929 1.00 0.00 H new ATOM 0 HB3 ASN A 95 0.553 11.169 -2.342 1.00 0.00 H new ATOM 0 HD21 ASN A 95 4.263 10.279 -2.482 1.00 0.00 H new ATOM 0 HD22 ASN A 95 3.343 11.671 -3.065 1.00 0.00 H new ATOM 207 N ARG A 99 3.323 12.463 -6.074 1.00 0.00 N ATOM 208 CA ARG A 99 4.325 11.690 -6.797 1.00 0.00 C ATOM 209 C ARG A 99 4.015 10.200 -6.745 1.00 0.00 C ATOM 210 O ARG A 99 3.247 9.737 -5.897 1.00 0.00 O ATOM 211 CB ARG A 99 5.734 11.938 -6.240 1.00 0.00 C ATOM 212 CG ARG A 99 5.956 11.436 -4.820 1.00 0.00 C ATOM 213 CD ARG A 99 7.435 11.442 -4.458 1.00 0.00 C ATOM 214 NE ARG A 99 7.679 10.930 -3.107 1.00 0.00 N ATOM 215 CZ ARG A 99 8.556 9.963 -2.819 1.00 0.00 C ATOM 216 NH1 ARG A 99 9.258 9.380 -3.786 1.00 0.00 N ATOM 217 NH2 ARG A 99 8.735 9.582 -1.561 1.00 0.00 N ATOM 0 HA ARG A 99 4.294 12.023 -7.834 1.00 0.00 H new ATOM 0 HB2 ARG A 99 6.459 11.458 -6.898 1.00 0.00 H new ATOM 0 HB3 ARG A 99 5.937 13.008 -6.268 1.00 0.00 H new ATOM 0 HG2 ARG A 99 5.405 12.064 -4.119 1.00 0.00 H new ATOM 0 HG3 ARG A 99 5.559 10.425 -4.723 1.00 0.00 H new ATOM 0 HD2 ARG A 99 7.986 10.837 -5.178 1.00 0.00 H new ATOM 0 HD3 ARG A 99 7.821 12.458 -4.534 1.00 0.00 H new ATOM 0 HE ARG A 99 7.146 11.337 -2.338 1.00 0.00 H new ATOM 0 HH11 ARG A 99 9.129 9.670 -4.755 1.00 0.00 H new ATOM 0 HH12 ARG A 99 9.925 8.643 -3.558 1.00 0.00 H new ATOM 0 HH21 ARG A 99 8.203 10.027 -0.813 1.00 0.00 H new ATOM 0 HH22 ARG A 99 9.404 8.844 -1.342 1.00 0.00 H new ATOM 231 N SER A 100 4.602 9.455 -7.670 1.00 0.00 N ATOM 232 CA SER A 100 4.479 8.009 -7.674 1.00 0.00 C ATOM 233 C SER A 100 5.479 7.401 -6.694 1.00 0.00 C ATOM 234 O SER A 100 6.686 7.396 -6.944 1.00 0.00 O ATOM 235 CB SER A 100 4.717 7.464 -9.083 1.00 0.00 C ATOM 236 OG SER A 100 3.941 8.171 -10.035 1.00 0.00 O ATOM 0 H SER A 100 5.170 9.832 -8.429 1.00 0.00 H new ATOM 0 HA SER A 100 3.471 7.737 -7.363 1.00 0.00 H new ATOM 0 HB2 SER A 100 5.774 7.547 -9.336 1.00 0.00 H new ATOM 0 HB3 SER A 100 4.463 6.404 -9.115 1.00 0.00 H new ATOM 0 HG SER A 100 4.325 8.046 -10.928 1.00 0.00 H new ATOM 242 N SER A 101 4.980 6.916 -5.571 1.00 0.00 N ATOM 243 CA SER A 101 5.831 6.336 -4.551 1.00 0.00 C ATOM 244 C SER A 101 6.095 4.861 -4.850 1.00 0.00 C ATOM 245 O SER A 101 5.222 4.007 -4.671 1.00 0.00 O ATOM 246 CB SER A 101 5.179 6.502 -3.176 1.00 0.00 C ATOM 247 OG SER A 101 4.879 7.867 -2.919 1.00 0.00 O ATOM 0 H SER A 101 3.986 6.913 -5.343 1.00 0.00 H new ATOM 0 HA SER A 101 6.789 6.857 -4.550 1.00 0.00 H new ATOM 0 HB2 SER A 101 4.265 5.909 -3.128 1.00 0.00 H new ATOM 0 HB3 SER A 101 5.847 6.121 -2.404 1.00 0.00 H new ATOM 0 HG SER A 101 3.915 7.969 -2.775 1.00 0.00 H new ATOM 253 N THR A 102 7.289 4.579 -5.344 1.00 0.00 N ATOM 254 CA THR A 102 7.698 3.217 -5.625 1.00 0.00 C ATOM 255 C THR A 102 8.078 2.507 -4.326 1.00 0.00 C ATOM 256 O THR A 102 9.032 2.896 -3.653 1.00 0.00 O ATOM 257 CB THR A 102 8.893 3.206 -6.596 1.00 0.00 C ATOM 258 OG1 THR A 102 8.685 4.201 -7.613 1.00 0.00 O ATOM 259 CG2 THR A 102 9.059 1.835 -7.238 1.00 0.00 C ATOM 0 H THR A 102 7.995 5.283 -5.559 1.00 0.00 H new ATOM 0 HA THR A 102 6.864 2.691 -6.089 1.00 0.00 H new ATOM 0 HB THR A 102 9.802 3.431 -6.038 1.00 0.00 H new ATOM 0 HG1 THR A 102 9.444 4.199 -8.233 1.00 0.00 H new ATOM 0 HG21 THR A 102 9.909 1.853 -7.920 1.00 0.00 H new ATOM 0 HG22 THR A 102 9.231 1.089 -6.463 1.00 0.00 H new ATOM 0 HG23 THR A 102 8.155 1.581 -7.792 1.00 0.00 H new ATOM 267 N TYR A 103 7.321 1.480 -3.969 1.00 0.00 N ATOM 268 CA TYR A 103 7.523 0.793 -2.704 1.00 0.00 C ATOM 269 C TYR A 103 8.154 -0.577 -2.900 1.00 0.00 C ATOM 270 O TYR A 103 7.716 -1.364 -3.740 1.00 0.00 O ATOM 271 CB TYR A 103 6.201 0.644 -1.947 1.00 0.00 C ATOM 272 CG TYR A 103 5.772 1.893 -1.214 1.00 0.00 C ATOM 273 CD1 TYR A 103 6.381 2.259 -0.021 1.00 0.00 C ATOM 274 CD2 TYR A 103 4.753 2.696 -1.703 1.00 0.00 C ATOM 275 CE1 TYR A 103 5.988 3.393 0.664 1.00 0.00 C ATOM 276 CE2 TYR A 103 4.353 3.832 -1.024 1.00 0.00 C ATOM 277 CZ TYR A 103 4.972 4.176 0.157 1.00 0.00 C ATOM 278 OH TYR A 103 4.573 5.304 0.836 1.00 0.00 O ATOM 0 H TYR A 103 6.562 1.105 -4.538 1.00 0.00 H new ATOM 0 HA TYR A 103 8.207 1.405 -2.116 1.00 0.00 H new ATOM 0 HB2 TYR A 103 5.419 0.362 -2.652 1.00 0.00 H new ATOM 0 HB3 TYR A 103 6.294 -0.172 -1.231 1.00 0.00 H new ATOM 0 HD1 TYR A 103 7.176 1.647 0.379 1.00 0.00 H new ATOM 0 HD2 TYR A 103 4.264 2.430 -2.629 1.00 0.00 H new ATOM 0 HE1 TYR A 103 6.473 3.664 1.590 1.00 0.00 H new ATOM 0 HE2 TYR A 103 3.558 4.447 -1.418 1.00 0.00 H new ATOM 0 HH TYR A 103 3.848 5.743 0.344 1.00 0.00 H new ATOM 288 N GLU A 104 9.189 -0.845 -2.118 1.00 0.00 N ATOM 289 CA GLU A 104 9.818 -2.152 -2.089 1.00 0.00 C ATOM 290 C GLU A 104 9.222 -2.962 -0.943 1.00 0.00 C ATOM 291 O GLU A 104 9.527 -2.715 0.227 1.00 0.00 O ATOM 292 CB GLU A 104 11.330 -2.002 -1.909 1.00 0.00 C ATOM 293 CG GLU A 104 12.088 -3.316 -1.931 1.00 0.00 C ATOM 294 CD GLU A 104 13.576 -3.125 -1.734 1.00 0.00 C ATOM 295 OE1 GLU A 104 14.264 -2.738 -2.707 1.00 0.00 O ATOM 296 OE2 GLU A 104 14.067 -3.342 -0.608 1.00 0.00 O ATOM 0 H GLU A 104 9.613 -0.164 -1.489 1.00 0.00 H new ATOM 0 HA GLU A 104 9.636 -2.670 -3.030 1.00 0.00 H new ATOM 0 HB2 GLU A 104 11.717 -1.358 -2.698 1.00 0.00 H new ATOM 0 HB3 GLU A 104 11.525 -1.498 -0.962 1.00 0.00 H new ATOM 0 HG2 GLU A 104 11.701 -3.969 -1.149 1.00 0.00 H new ATOM 0 HG3 GLU A 104 11.911 -3.819 -2.882 1.00 0.00 H new ATOM 303 N VAL A 105 8.337 -3.890 -1.274 1.00 0.00 N ATOM 304 CA VAL A 105 7.622 -4.652 -0.260 1.00 0.00 C ATOM 305 C VAL A 105 7.714 -6.147 -0.530 1.00 0.00 C ATOM 306 O VAL A 105 7.593 -6.589 -1.664 1.00 0.00 O ATOM 307 CB VAL A 105 6.135 -4.236 -0.193 1.00 0.00 C ATOM 308 CG1 VAL A 105 6.010 -2.763 0.151 1.00 0.00 C ATOM 309 CG2 VAL A 105 5.423 -4.530 -1.507 1.00 0.00 C ATOM 0 H VAL A 105 8.097 -4.134 -2.235 1.00 0.00 H new ATOM 0 HA VAL A 105 8.095 -4.433 0.697 1.00 0.00 H new ATOM 0 HB VAL A 105 5.659 -4.823 0.592 1.00 0.00 H new ATOM 0 HG11 VAL A 105 4.956 -2.488 0.194 1.00 0.00 H new ATOM 0 HG12 VAL A 105 6.474 -2.575 1.119 1.00 0.00 H new ATOM 0 HG13 VAL A 105 6.510 -2.167 -0.613 1.00 0.00 H new ATOM 0 HG21 VAL A 105 4.379 -4.227 -1.431 1.00 0.00 H new ATOM 0 HG22 VAL A 105 5.904 -3.976 -2.313 1.00 0.00 H new ATOM 0 HG23 VAL A 105 5.476 -5.598 -1.719 1.00 0.00 H new ATOM 319 N ARG A 106 7.933 -6.928 0.510 1.00 0.00 N ATOM 320 CA ARG A 106 8.007 -8.370 0.357 1.00 0.00 C ATOM 321 C ARG A 106 6.610 -8.977 0.354 1.00 0.00 C ATOM 322 O ARG A 106 5.693 -8.452 0.982 1.00 0.00 O ATOM 323 CB ARG A 106 8.853 -8.979 1.474 1.00 0.00 C ATOM 324 CG ARG A 106 10.316 -8.588 1.390 1.00 0.00 C ATOM 325 CD ARG A 106 11.106 -9.109 2.577 1.00 0.00 C ATOM 326 NE ARG A 106 10.700 -8.471 3.826 1.00 0.00 N ATOM 327 CZ ARG A 106 11.549 -7.888 4.671 1.00 0.00 C ATOM 328 NH1 ARG A 106 12.844 -7.835 4.382 1.00 0.00 N ATOM 329 NH2 ARG A 106 11.100 -7.344 5.793 1.00 0.00 N ATOM 0 H ARG A 106 8.062 -6.592 1.464 1.00 0.00 H new ATOM 0 HA ARG A 106 8.481 -8.594 -0.598 1.00 0.00 H new ATOM 0 HB2 ARG A 106 8.453 -8.664 2.438 1.00 0.00 H new ATOM 0 HB3 ARG A 106 8.770 -10.065 1.434 1.00 0.00 H new ATOM 0 HG2 ARG A 106 10.745 -8.979 0.468 1.00 0.00 H new ATOM 0 HG3 ARG A 106 10.400 -7.502 1.345 1.00 0.00 H new ATOM 0 HD2 ARG A 106 10.968 -10.187 2.659 1.00 0.00 H new ATOM 0 HD3 ARG A 106 12.169 -8.935 2.410 1.00 0.00 H new ATOM 0 HE ARG A 106 9.709 -8.472 4.066 1.00 0.00 H new ATOM 0 HH11 ARG A 106 13.189 -8.241 3.512 1.00 0.00 H new ATOM 0 HH12 ARG A 106 13.493 -7.388 5.030 1.00 0.00 H new ATOM 0 HH21 ARG A 106 10.104 -7.372 6.010 1.00 0.00 H new ATOM 0 HH22 ARG A 106 11.751 -6.898 6.439 1.00 0.00 H new ATOM 343 N LEU A 107 6.453 -10.088 -0.357 1.00 0.00 N ATOM 344 CA LEU A 107 5.155 -10.748 -0.473 1.00 0.00 C ATOM 345 C LEU A 107 4.736 -11.366 0.858 1.00 0.00 C ATOM 346 O LEU A 107 3.560 -11.660 1.077 1.00 0.00 O ATOM 347 CB LEU A 107 5.182 -11.827 -1.562 1.00 0.00 C ATOM 348 CG LEU A 107 5.324 -11.321 -3.006 1.00 0.00 C ATOM 349 CD1 LEU A 107 6.726 -10.800 -3.280 1.00 0.00 C ATOM 350 CD2 LEU A 107 4.969 -12.422 -3.989 1.00 0.00 C ATOM 0 H LEU A 107 7.208 -10.552 -0.862 1.00 0.00 H new ATOM 0 HA LEU A 107 4.425 -9.988 -0.752 1.00 0.00 H new ATOM 0 HB2 LEU A 107 6.009 -12.506 -1.353 1.00 0.00 H new ATOM 0 HB3 LEU A 107 4.264 -12.411 -1.491 1.00 0.00 H new ATOM 0 HG LEU A 107 4.629 -10.491 -3.137 1.00 0.00 H new ATOM 0 HD11 LEU A 107 6.789 -10.451 -4.311 1.00 0.00 H new ATOM 0 HD12 LEU A 107 6.946 -9.975 -2.603 1.00 0.00 H new ATOM 0 HD13 LEU A 107 7.449 -11.601 -3.123 1.00 0.00 H new ATOM 0 HD21 LEU A 107 5.074 -12.048 -5.008 1.00 0.00 H new ATOM 0 HD22 LEU A 107 5.638 -13.270 -3.843 1.00 0.00 H new ATOM 0 HD23 LEU A 107 3.939 -12.739 -3.824 1.00 0.00 H new ATOM 362 N THR A 108 5.704 -11.552 1.743 1.00 0.00 N ATOM 363 CA THR A 108 5.453 -12.125 3.057 1.00 0.00 C ATOM 364 C THR A 108 4.902 -11.060 4.020 1.00 0.00 C ATOM 365 O THR A 108 4.638 -11.331 5.194 1.00 0.00 O ATOM 366 CB THR A 108 6.755 -12.737 3.622 1.00 0.00 C ATOM 367 OG1 THR A 108 7.399 -13.505 2.595 1.00 0.00 O ATOM 368 CG2 THR A 108 6.480 -13.637 4.819 1.00 0.00 C ATOM 0 H THR A 108 6.680 -11.312 1.572 1.00 0.00 H new ATOM 0 HA THR A 108 4.705 -12.911 2.956 1.00 0.00 H new ATOM 0 HB THR A 108 7.397 -11.920 3.952 1.00 0.00 H new ATOM 0 HG1 THR A 108 8.226 -13.894 2.948 1.00 0.00 H new ATOM 0 HG21 THR A 108 7.419 -14.049 5.188 1.00 0.00 H new ATOM 0 HG22 THR A 108 6.003 -13.057 5.609 1.00 0.00 H new ATOM 0 HG23 THR A 108 5.821 -14.451 4.518 1.00 0.00 H new ATOM 376 N GLN A 109 4.729 -9.843 3.515 1.00 0.00 N ATOM 377 CA GLN A 109 4.169 -8.758 4.311 1.00 0.00 C ATOM 378 C GLN A 109 2.663 -8.679 4.118 1.00 0.00 C ATOM 379 O GLN A 109 2.140 -9.066 3.074 1.00 0.00 O ATOM 380 CB GLN A 109 4.781 -7.411 3.919 1.00 0.00 C ATOM 381 CG GLN A 109 6.291 -7.348 4.045 1.00 0.00 C ATOM 382 CD GLN A 109 6.853 -6.009 3.601 1.00 0.00 C ATOM 383 OE1 GLN A 109 7.978 -5.927 3.109 1.00 0.00 O ATOM 384 NE2 GLN A 109 6.072 -4.949 3.760 1.00 0.00 N ATOM 0 H GLN A 109 4.969 -9.584 2.558 1.00 0.00 H new ATOM 0 HA GLN A 109 4.401 -8.969 5.355 1.00 0.00 H new ATOM 0 HB2 GLN A 109 4.505 -7.186 2.889 1.00 0.00 H new ATOM 0 HB3 GLN A 109 4.344 -6.632 4.543 1.00 0.00 H new ATOM 0 HG2 GLN A 109 6.575 -7.532 5.081 1.00 0.00 H new ATOM 0 HG3 GLN A 109 6.736 -8.143 3.446 1.00 0.00 H new ATOM 0 HE21 GLN A 109 5.145 -5.056 4.172 1.00 0.00 H new ATOM 0 HE22 GLN A 109 6.398 -4.027 3.470 1.00 0.00 H new ATOM 393 N THR A 110 1.975 -8.177 5.126 1.00 0.00 N ATOM 394 CA THR A 110 0.555 -7.894 5.019 1.00 0.00 C ATOM 395 C THR A 110 0.346 -6.462 4.532 1.00 0.00 C ATOM 396 O THR A 110 1.238 -5.619 4.670 1.00 0.00 O ATOM 397 CB THR A 110 -0.150 -8.107 6.374 1.00 0.00 C ATOM 398 OG1 THR A 110 0.719 -7.714 7.446 1.00 0.00 O ATOM 399 CG2 THR A 110 -0.552 -9.564 6.549 1.00 0.00 C ATOM 0 H THR A 110 2.380 -7.955 6.035 1.00 0.00 H new ATOM 0 HA THR A 110 0.117 -8.583 4.297 1.00 0.00 H new ATOM 0 HB THR A 110 -1.050 -7.492 6.393 1.00 0.00 H new ATOM 0 HG1 THR A 110 1.342 -8.444 7.647 1.00 0.00 H new ATOM 0 HG21 THR A 110 -1.048 -9.692 7.511 1.00 0.00 H new ATOM 0 HG22 THR A 110 -1.234 -9.852 5.749 1.00 0.00 H new ATOM 0 HG23 THR A 110 0.337 -10.194 6.512 1.00 0.00 H new ATOM 407 N VAL A 111 -0.819 -6.189 3.950 1.00 0.00 N ATOM 408 CA VAL A 111 -1.124 -4.850 3.446 1.00 0.00 C ATOM 409 C VAL A 111 -1.048 -3.815 4.569 1.00 0.00 C ATOM 410 O VAL A 111 -0.684 -2.658 4.344 1.00 0.00 O ATOM 411 CB VAL A 111 -2.519 -4.796 2.790 1.00 0.00 C ATOM 412 CG1 VAL A 111 -2.802 -3.407 2.234 1.00 0.00 C ATOM 413 CG2 VAL A 111 -2.640 -5.848 1.695 1.00 0.00 C ATOM 0 H VAL A 111 -1.565 -6.872 3.815 1.00 0.00 H new ATOM 0 HA VAL A 111 -0.376 -4.614 2.689 1.00 0.00 H new ATOM 0 HB VAL A 111 -3.263 -5.013 3.557 1.00 0.00 H new ATOM 0 HG11 VAL A 111 -3.791 -3.393 1.776 1.00 0.00 H new ATOM 0 HG12 VAL A 111 -2.766 -2.677 3.043 1.00 0.00 H new ATOM 0 HG13 VAL A 111 -2.052 -3.155 1.484 1.00 0.00 H new ATOM 0 HG21 VAL A 111 -3.631 -5.793 1.245 1.00 0.00 H new ATOM 0 HG22 VAL A 111 -1.884 -5.666 0.931 1.00 0.00 H new ATOM 0 HG23 VAL A 111 -2.491 -6.839 2.124 1.00 0.00 H new ATOM 423 N ALA A 112 -1.366 -4.255 5.782 1.00 0.00 N ATOM 424 CA ALA A 112 -1.290 -3.404 6.961 1.00 0.00 C ATOM 425 C ALA A 112 0.102 -2.795 7.120 1.00 0.00 C ATOM 426 O ALA A 112 0.241 -1.625 7.473 1.00 0.00 O ATOM 427 CB ALA A 112 -1.653 -4.203 8.203 1.00 0.00 C ATOM 0 H ALA A 112 -1.682 -5.206 5.974 1.00 0.00 H new ATOM 0 HA ALA A 112 -2.002 -2.588 6.834 1.00 0.00 H new ATOM 0 HB1 ALA A 112 -1.594 -3.559 9.080 1.00 0.00 H new ATOM 0 HB2 ALA A 112 -2.668 -4.588 8.104 1.00 0.00 H new ATOM 0 HB3 ALA A 112 -0.958 -5.035 8.316 1.00 0.00 H new ATOM 433 N HIS A 113 1.129 -3.593 6.835 1.00 0.00 N ATOM 434 CA HIS A 113 2.511 -3.149 6.981 1.00 0.00 C ATOM 435 C HIS A 113 2.811 -2.033 5.988 1.00 0.00 C ATOM 436 O HIS A 113 3.528 -1.089 6.301 1.00 0.00 O ATOM 437 CB HIS A 113 3.479 -4.323 6.767 1.00 0.00 C ATOM 438 CG HIS A 113 4.866 -4.080 7.303 1.00 0.00 C ATOM 439 ND1 HIS A 113 5.370 -4.734 8.408 1.00 0.00 N ATOM 440 CD2 HIS A 113 5.858 -3.264 6.872 1.00 0.00 C ATOM 441 CE1 HIS A 113 6.606 -4.329 8.633 1.00 0.00 C ATOM 442 NE2 HIS A 113 6.927 -3.435 7.715 1.00 0.00 N ATOM 0 H HIS A 113 1.028 -4.552 6.501 1.00 0.00 H new ATOM 0 HA HIS A 113 2.648 -2.768 7.993 1.00 0.00 H new ATOM 0 HB2 HIS A 113 3.067 -5.212 7.245 1.00 0.00 H new ATOM 0 HB3 HIS A 113 3.545 -4.536 5.700 1.00 0.00 H new ATOM 0 HD2 HIS A 113 5.815 -2.601 6.021 1.00 0.00 H new ATOM 0 HE1 HIS A 113 7.247 -4.671 9.433 1.00 0.00 H new ATOM 0 HE2 HIS A 113 7.822 -2.951 7.644 1.00 0.00 H new ATOM 451 N LEU A 114 2.244 -2.149 4.794 1.00 0.00 N ATOM 452 CA LEU A 114 2.419 -1.140 3.756 1.00 0.00 C ATOM 453 C LEU A 114 1.734 0.158 4.149 1.00 0.00 C ATOM 454 O LEU A 114 2.339 1.231 4.101 1.00 0.00 O ATOM 455 CB LEU A 114 1.848 -1.640 2.429 1.00 0.00 C ATOM 456 CG LEU A 114 1.846 -0.614 1.291 1.00 0.00 C ATOM 457 CD1 LEU A 114 3.263 -0.275 0.861 1.00 0.00 C ATOM 458 CD2 LEU A 114 1.034 -1.128 0.113 1.00 0.00 C ATOM 0 H LEU A 114 1.656 -2.936 4.519 1.00 0.00 H new ATOM 0 HA LEU A 114 3.487 -0.954 3.640 1.00 0.00 H new ATOM 0 HB2 LEU A 114 2.421 -2.511 2.110 1.00 0.00 H new ATOM 0 HB3 LEU A 114 0.824 -1.976 2.596 1.00 0.00 H new ATOM 0 HG LEU A 114 1.380 0.300 1.658 1.00 0.00 H new ATOM 0 HD11 LEU A 114 3.233 0.455 0.052 1.00 0.00 H new ATOM 0 HD12 LEU A 114 3.810 0.142 1.707 1.00 0.00 H new ATOM 0 HD13 LEU A 114 3.764 -1.179 0.515 1.00 0.00 H new ATOM 0 HD21 LEU A 114 1.043 -0.387 -0.686 1.00 0.00 H new ATOM 0 HD22 LEU A 114 1.469 -2.059 -0.250 1.00 0.00 H new ATOM 0 HD23 LEU A 114 0.007 -1.307 0.430 1.00 0.00 H new ATOM 470 N LYS A 115 0.473 0.048 4.542 1.00 0.00 N ATOM 471 CA LYS A 115 -0.315 1.215 4.907 1.00 0.00 C ATOM 472 C LYS A 115 0.276 1.917 6.120 1.00 0.00 C ATOM 473 O LYS A 115 0.309 3.139 6.163 1.00 0.00 O ATOM 474 CB LYS A 115 -1.773 0.821 5.160 1.00 0.00 C ATOM 475 CG LYS A 115 -2.654 1.982 5.599 1.00 0.00 C ATOM 476 CD LYS A 115 -4.123 1.662 5.416 1.00 0.00 C ATOM 477 CE LYS A 115 -5.018 2.731 6.022 1.00 0.00 C ATOM 478 NZ LYS A 115 -4.909 2.780 7.505 1.00 0.00 N ATOM 0 H LYS A 115 -0.026 -0.838 4.616 1.00 0.00 H new ATOM 0 HA LYS A 115 -0.289 1.916 4.073 1.00 0.00 H new ATOM 0 HB2 LYS A 115 -2.186 0.387 4.249 1.00 0.00 H new ATOM 0 HB3 LYS A 115 -1.803 0.045 5.925 1.00 0.00 H new ATOM 0 HG2 LYS A 115 -2.458 2.213 6.646 1.00 0.00 H new ATOM 0 HG3 LYS A 115 -2.400 2.872 5.023 1.00 0.00 H new ATOM 0 HD2 LYS A 115 -4.343 1.565 4.353 1.00 0.00 H new ATOM 0 HD3 LYS A 115 -4.345 0.699 5.877 1.00 0.00 H new ATOM 0 HE2 LYS A 115 -4.752 3.703 5.607 1.00 0.00 H new ATOM 0 HE3 LYS A 115 -6.053 2.538 5.742 1.00 0.00 H new ATOM 0 HZ1 LYS A 115 -5.847 2.626 7.927 1.00 0.00 H new ATOM 0 HZ2 LYS A 115 -4.257 2.038 7.830 1.00 0.00 H new ATOM 0 HZ3 LYS A 115 -4.547 3.711 7.796 1.00 0.00 H new ATOM 492 N GLN A 116 0.770 1.154 7.086 1.00 0.00 N ATOM 493 CA GLN A 116 1.348 1.744 8.288 1.00 0.00 C ATOM 494 C GLN A 116 2.633 2.512 7.962 1.00 0.00 C ATOM 495 O GLN A 116 2.962 3.481 8.642 1.00 0.00 O ATOM 496 CB GLN A 116 1.607 0.668 9.348 1.00 0.00 C ATOM 497 CG GLN A 116 2.043 1.217 10.706 1.00 0.00 C ATOM 498 CD GLN A 116 0.936 1.945 11.468 1.00 0.00 C ATOM 499 OE1 GLN A 116 0.010 2.573 10.757 1.00 0.00 O flip ATOM 500 NE2 GLN A 116 0.916 1.945 12.701 1.00 0.00 N flip ATOM 0 H GLN A 116 0.783 0.134 7.063 1.00 0.00 H new ATOM 0 HA GLN A 116 0.629 2.456 8.694 1.00 0.00 H new ATOM 0 HB2 GLN A 116 0.699 0.080 9.481 1.00 0.00 H new ATOM 0 HB3 GLN A 116 2.376 -0.011 8.980 1.00 0.00 H new ATOM 0 HG2 GLN A 116 2.410 0.393 11.318 1.00 0.00 H new ATOM 0 HG3 GLN A 116 2.879 1.901 10.558 1.00 0.00 H new ATOM 0 HE21 GLN A 116 1.642 1.453 13.223 1.00 0.00 H new ATOM 0 HE22 GLN A 116 0.174 2.437 13.199 1.00 0.00 H new ATOM 509 N GLN A 117 3.349 2.089 6.920 1.00 0.00 N ATOM 510 CA GLN A 117 4.501 2.848 6.442 1.00 0.00 C ATOM 511 C GLN A 117 4.034 4.209 5.942 1.00 0.00 C ATOM 512 O GLN A 117 4.571 5.254 6.324 1.00 0.00 O ATOM 513 CB GLN A 117 5.234 2.111 5.313 1.00 0.00 C ATOM 514 CG GLN A 117 5.864 0.791 5.728 1.00 0.00 C ATOM 515 CD GLN A 117 6.648 0.137 4.601 1.00 0.00 C ATOM 516 OE1 GLN A 117 6.244 0.387 3.363 1.00 0.00 O flip ATOM 517 NE2 GLN A 117 7.616 -0.589 4.837 1.00 0.00 N flip ATOM 0 H GLN A 117 3.154 1.235 6.397 1.00 0.00 H new ATOM 0 HA GLN A 117 5.197 2.968 7.272 1.00 0.00 H new ATOM 0 HB2 GLN A 117 4.531 1.924 4.501 1.00 0.00 H new ATOM 0 HB3 GLN A 117 6.013 2.762 4.917 1.00 0.00 H new ATOM 0 HG2 GLN A 117 6.527 0.960 6.576 1.00 0.00 H new ATOM 0 HG3 GLN A 117 5.083 0.110 6.065 1.00 0.00 H new ATOM 0 HE21 GLN A 117 7.901 -0.761 5.801 1.00 0.00 H new ATOM 0 HE22 GLN A 117 8.132 -1.017 4.068 1.00 0.00 H new ATOM 526 N VAL A 118 3.010 4.184 5.099 1.00 0.00 N ATOM 527 CA VAL A 118 2.403 5.403 4.598 1.00 0.00 C ATOM 528 C VAL A 118 1.872 6.232 5.762 1.00 0.00 C ATOM 529 O VAL A 118 2.167 7.418 5.869 1.00 0.00 O ATOM 530 CB VAL A 118 1.248 5.103 3.621 1.00 0.00 C ATOM 531 CG1 VAL A 118 0.634 6.394 3.101 1.00 0.00 C ATOM 532 CG2 VAL A 118 1.732 4.233 2.468 1.00 0.00 C ATOM 0 H VAL A 118 2.583 3.327 4.748 1.00 0.00 H new ATOM 0 HA VAL A 118 3.171 5.958 4.060 1.00 0.00 H new ATOM 0 HB VAL A 118 0.477 4.554 4.162 1.00 0.00 H new ATOM 0 HG11 VAL A 118 -0.179 6.159 2.414 1.00 0.00 H new ATOM 0 HG12 VAL A 118 0.245 6.975 3.937 1.00 0.00 H new ATOM 0 HG13 VAL A 118 1.395 6.974 2.579 1.00 0.00 H new ATOM 0 HG21 VAL A 118 0.902 4.033 1.790 1.00 0.00 H new ATOM 0 HG22 VAL A 118 2.524 4.752 1.928 1.00 0.00 H new ATOM 0 HG23 VAL A 118 2.116 3.291 2.859 1.00 0.00 H new ATOM 542 N SER A 119 1.122 5.577 6.642 1.00 0.00 N ATOM 543 CA SER A 119 0.557 6.207 7.830 1.00 0.00 C ATOM 544 C SER A 119 1.646 6.782 8.740 1.00 0.00 C ATOM 545 O SER A 119 1.379 7.656 9.568 1.00 0.00 O ATOM 546 CB SER A 119 -0.302 5.192 8.590 1.00 0.00 C ATOM 547 OG SER A 119 -1.408 4.772 7.807 1.00 0.00 O ATOM 0 H SER A 119 0.888 4.588 6.551 1.00 0.00 H new ATOM 0 HA SER A 119 -0.067 7.041 7.510 1.00 0.00 H new ATOM 0 HB2 SER A 119 0.305 4.328 8.861 1.00 0.00 H new ATOM 0 HB3 SER A 119 -0.658 5.636 9.520 1.00 0.00 H new ATOM 0 HG SER A 119 -2.235 4.885 8.321 1.00 0.00 H new ATOM 553 N GLY A 120 2.867 6.297 8.581 1.00 0.00 N ATOM 554 CA GLY A 120 3.978 6.834 9.338 1.00 0.00 C ATOM 555 C GLY A 120 4.491 8.136 8.753 1.00 0.00 C ATOM 556 O GLY A 120 4.885 9.042 9.486 1.00 0.00 O ATOM 0 H GLY A 120 3.109 5.541 7.941 1.00 0.00 H new ATOM 0 HA2 GLY A 120 3.667 6.998 10.370 1.00 0.00 H new ATOM 0 HA3 GLY A 120 4.787 6.104 9.361 1.00 0.00 H new ATOM 560 N LEU A 121 4.481 8.230 7.431 1.00 0.00 N ATOM 561 CA LEU A 121 5.004 9.410 6.744 1.00 0.00 C ATOM 562 C LEU A 121 3.895 10.403 6.378 1.00 0.00 C ATOM 563 O LEU A 121 3.805 11.489 6.945 1.00 0.00 O ATOM 564 CB LEU A 121 5.760 8.985 5.481 1.00 0.00 C ATOM 565 CG LEU A 121 6.919 8.013 5.715 1.00 0.00 C ATOM 566 CD1 LEU A 121 7.584 7.647 4.396 1.00 0.00 C ATOM 567 CD2 LEU A 121 7.932 8.615 6.676 1.00 0.00 C ATOM 0 H LEU A 121 4.118 7.506 6.811 1.00 0.00 H new ATOM 0 HA LEU A 121 5.684 9.915 7.430 1.00 0.00 H new ATOM 0 HB2 LEU A 121 5.053 8.524 4.791 1.00 0.00 H new ATOM 0 HB3 LEU A 121 6.148 9.878 4.991 1.00 0.00 H new ATOM 0 HG LEU A 121 6.520 7.102 6.162 1.00 0.00 H new ATOM 0 HD11 LEU A 121 8.406 6.955 4.582 1.00 0.00 H new ATOM 0 HD12 LEU A 121 6.854 7.174 3.739 1.00 0.00 H new ATOM 0 HD13 LEU A 121 7.970 8.549 3.920 1.00 0.00 H new ATOM 0 HD21 LEU A 121 8.749 7.911 6.831 1.00 0.00 H new ATOM 0 HD22 LEU A 121 8.326 9.541 6.257 1.00 0.00 H new ATOM 0 HD23 LEU A 121 7.448 8.825 7.630 1.00 0.00 H new ATOM 579 N GLU A 122 3.053 10.009 5.433 1.00 0.00 N ATOM 580 CA GLU A 122 1.980 10.860 4.916 1.00 0.00 C ATOM 581 C GLU A 122 0.668 10.528 5.616 1.00 0.00 C ATOM 582 O GLU A 122 -0.397 11.015 5.243 1.00 0.00 O ATOM 583 CB GLU A 122 1.826 10.654 3.408 1.00 0.00 C ATOM 584 CG GLU A 122 3.094 10.924 2.614 1.00 0.00 C ATOM 585 CD GLU A 122 3.524 12.374 2.672 1.00 0.00 C ATOM 586 OE1 GLU A 122 2.807 13.230 2.112 1.00 0.00 O ATOM 587 OE2 GLU A 122 4.576 12.672 3.274 1.00 0.00 O ATOM 0 H GLU A 122 3.092 9.087 4.999 1.00 0.00 H new ATOM 0 HA GLU A 122 2.235 11.902 5.109 1.00 0.00 H new ATOM 0 HB2 GLU A 122 1.505 9.629 3.223 1.00 0.00 H new ATOM 0 HB3 GLU A 122 1.034 11.307 3.041 1.00 0.00 H new ATOM 0 HG2 GLU A 122 3.898 10.296 2.997 1.00 0.00 H new ATOM 0 HG3 GLU A 122 2.934 10.638 1.574 1.00 0.00 H new ATOM 594 N GLY A 123 0.783 9.675 6.623 1.00 0.00 N ATOM 595 CA GLY A 123 -0.353 9.067 7.296 1.00 0.00 C ATOM 596 C GLY A 123 -1.301 10.014 8.003 1.00 0.00 C ATOM 597 O GLY A 123 -2.163 9.542 8.736 1.00 0.00 O ATOM 0 H GLY A 123 1.684 9.382 7.001 1.00 0.00 H new ATOM 0 HA2 GLY A 123 -0.922 8.499 6.560 1.00 0.00 H new ATOM 0 HA3 GLY A 123 0.025 8.352 8.027 1.00 0.00 H new ATOM 601 N VAL A 124 -1.103 11.318 7.829 1.00 0.00 N ATOM 602 CA VAL A 124 -1.964 12.362 8.403 1.00 0.00 C ATOM 603 C VAL A 124 -3.421 11.913 8.544 1.00 0.00 C ATOM 604 O VAL A 124 -4.205 12.049 7.607 1.00 0.00 O ATOM 605 CB VAL A 124 -1.945 13.614 7.512 1.00 0.00 C ATOM 606 CG1 VAL A 124 -2.827 14.711 8.096 1.00 0.00 C ATOM 607 CG2 VAL A 124 -0.519 14.100 7.305 1.00 0.00 C ATOM 0 H VAL A 124 -0.330 11.690 7.278 1.00 0.00 H new ATOM 0 HA VAL A 124 -1.565 12.575 9.395 1.00 0.00 H new ATOM 0 HB VAL A 124 -2.354 13.349 6.537 1.00 0.00 H new ATOM 0 HG11 VAL A 124 -2.797 15.586 7.447 1.00 0.00 H new ATOM 0 HG12 VAL A 124 -3.853 14.351 8.172 1.00 0.00 H new ATOM 0 HG13 VAL A 124 -2.463 14.981 9.087 1.00 0.00 H new ATOM 0 HG21 VAL A 124 -0.525 14.987 6.672 1.00 0.00 H new ATOM 0 HG22 VAL A 124 -0.075 14.346 8.270 1.00 0.00 H new ATOM 0 HG23 VAL A 124 0.067 13.316 6.825 1.00 0.00 H new ATOM 617 N GLN A 125 -3.757 11.393 9.727 1.00 0.00 N ATOM 618 CA GLN A 125 -5.082 10.842 10.014 1.00 0.00 C ATOM 619 C GLN A 125 -5.512 9.785 8.993 1.00 0.00 C ATOM 620 O GLN A 125 -5.818 10.092 7.840 1.00 0.00 O ATOM 621 CB GLN A 125 -6.138 11.946 10.094 1.00 0.00 C ATOM 622 CG GLN A 125 -5.974 12.862 11.294 1.00 0.00 C ATOM 623 CD GLN A 125 -7.150 13.800 11.478 1.00 0.00 C ATOM 624 OE1 GLN A 125 -8.332 13.358 11.075 1.00 0.00 O flip ATOM 625 NE2 GLN A 125 -7.002 14.911 11.985 1.00 0.00 N flip ATOM 0 H GLN A 125 -3.113 11.342 10.517 1.00 0.00 H new ATOM 0 HA GLN A 125 -5.003 10.353 10.985 1.00 0.00 H new ATOM 0 HB2 GLN A 125 -6.096 12.544 9.183 1.00 0.00 H new ATOM 0 HB3 GLN A 125 -7.127 11.489 10.130 1.00 0.00 H new ATOM 0 HG2 GLN A 125 -5.852 12.258 12.193 1.00 0.00 H new ATOM 0 HG3 GLN A 125 -5.062 13.448 11.177 1.00 0.00 H new ATOM 0 HE21 GLN A 125 -6.076 15.216 12.283 1.00 0.00 H new ATOM 0 HE22 GLN A 125 -7.806 15.527 12.107 1.00 0.00 H new ATOM 634 N ASP A 126 -5.594 8.538 9.446 1.00 0.00 N ATOM 635 CA ASP A 126 -6.049 7.433 8.599 1.00 0.00 C ATOM 636 C ASP A 126 -7.500 7.646 8.165 1.00 0.00 C ATOM 637 O ASP A 126 -8.056 6.863 7.397 1.00 0.00 O ATOM 638 CB ASP A 126 -5.931 6.095 9.335 1.00 0.00 C ATOM 639 CG ASP A 126 -4.497 5.677 9.594 1.00 0.00 C ATOM 640 OD1 ASP A 126 -3.934 6.076 10.636 1.00 0.00 O ATOM 641 OD2 ASP A 126 -3.931 4.927 8.766 1.00 0.00 O ATOM 0 H ASP A 126 -5.351 8.263 10.398 1.00 0.00 H new ATOM 0 HA ASP A 126 -5.410 7.410 7.716 1.00 0.00 H new ATOM 0 HB2 ASP A 126 -6.459 6.164 10.286 1.00 0.00 H new ATOM 0 HB3 ASP A 126 -6.428 5.321 8.749 1.00 0.00 H new ATOM 646 N ASP A 127 -8.108 8.705 8.682 1.00 0.00 N ATOM 647 CA ASP A 127 -9.470 9.068 8.330 1.00 0.00 C ATOM 648 C ASP A 127 -9.496 9.969 7.100 1.00 0.00 C ATOM 649 O ASP A 127 -10.498 10.027 6.392 1.00 0.00 O ATOM 650 CB ASP A 127 -10.153 9.796 9.492 1.00 0.00 C ATOM 651 CG ASP A 127 -10.197 8.967 10.757 1.00 0.00 C ATOM 652 OD1 ASP A 127 -11.140 8.166 10.917 1.00 0.00 O ATOM 653 OD2 ASP A 127 -9.293 9.121 11.604 1.00 0.00 O ATOM 0 H ASP A 127 -7.671 9.334 9.355 1.00 0.00 H new ATOM 0 HA ASP A 127 -10.007 8.145 8.110 1.00 0.00 H new ATOM 0 HB2 ASP A 127 -9.625 10.728 9.692 1.00 0.00 H new ATOM 0 HB3 ASP A 127 -11.169 10.062 9.201 1.00 0.00 H new ATOM 658 N LEU A 128 -8.397 10.681 6.852 1.00 0.00 N ATOM 659 CA LEU A 128 -8.349 11.637 5.754 1.00 0.00 C ATOM 660 C LEU A 128 -7.970 10.958 4.445 1.00 0.00 C ATOM 661 O LEU A 128 -8.555 11.244 3.399 1.00 0.00 O ATOM 662 CB LEU A 128 -7.363 12.766 6.069 1.00 0.00 C ATOM 663 CG LEU A 128 -7.725 13.623 7.285 1.00 0.00 C ATOM 664 CD1 LEU A 128 -6.670 14.692 7.519 1.00 0.00 C ATOM 665 CD2 LEU A 128 -9.093 14.263 7.101 1.00 0.00 C ATOM 0 H LEU A 128 -7.536 10.613 7.394 1.00 0.00 H new ATOM 0 HA LEU A 128 -9.347 12.061 5.638 1.00 0.00 H new ATOM 0 HB2 LEU A 128 -6.377 12.331 6.231 1.00 0.00 H new ATOM 0 HB3 LEU A 128 -7.286 13.415 5.196 1.00 0.00 H new ATOM 0 HG LEU A 128 -7.761 12.974 8.160 1.00 0.00 H new ATOM 0 HD11 LEU A 128 -6.945 15.291 8.387 1.00 0.00 H new ATOM 0 HD12 LEU A 128 -5.705 14.218 7.696 1.00 0.00 H new ATOM 0 HD13 LEU A 128 -6.603 15.335 6.641 1.00 0.00 H new ATOM 0 HD21 LEU A 128 -9.332 14.868 7.976 1.00 0.00 H new ATOM 0 HD22 LEU A 128 -9.082 14.896 6.214 1.00 0.00 H new ATOM 0 HD23 LEU A 128 -9.846 13.484 6.982 1.00 0.00 H new ATOM 677 N PHE A 129 -6.997 10.060 4.499 1.00 0.00 N ATOM 678 CA PHE A 129 -6.546 9.374 3.298 1.00 0.00 C ATOM 679 C PHE A 129 -6.852 7.887 3.388 1.00 0.00 C ATOM 680 O PHE A 129 -6.945 7.322 4.481 1.00 0.00 O ATOM 681 CB PHE A 129 -5.036 9.572 3.084 1.00 0.00 C ATOM 682 CG PHE A 129 -4.178 8.641 3.901 1.00 0.00 C ATOM 683 CD1 PHE A 129 -3.910 8.908 5.232 1.00 0.00 C ATOM 684 CD2 PHE A 129 -3.651 7.488 3.333 1.00 0.00 C ATOM 685 CE1 PHE A 129 -3.135 8.045 5.982 1.00 0.00 C ATOM 686 CE2 PHE A 129 -2.880 6.621 4.079 1.00 0.00 C ATOM 687 CZ PHE A 129 -2.618 6.899 5.404 1.00 0.00 C ATOM 0 H PHE A 129 -6.509 9.791 5.353 1.00 0.00 H new ATOM 0 HA PHE A 129 -7.081 9.803 2.451 1.00 0.00 H new ATOM 0 HB2 PHE A 129 -4.807 9.429 2.028 1.00 0.00 H new ATOM 0 HB3 PHE A 129 -4.776 10.601 3.331 1.00 0.00 H new ATOM 0 HD1 PHE A 129 -4.311 9.801 5.689 1.00 0.00 H new ATOM 0 HD2 PHE A 129 -3.847 7.268 2.294 1.00 0.00 H new ATOM 0 HE1 PHE A 129 -2.932 8.265 7.020 1.00 0.00 H new ATOM 0 HE2 PHE A 129 -2.482 5.725 3.626 1.00 0.00 H new ATOM 0 HZ PHE A 129 -2.011 6.224 5.989 1.00 0.00 H new ATOM 697 N TRP A 130 -7.027 7.267 2.238 1.00 0.00 N ATOM 698 CA TRP A 130 -7.094 5.822 2.143 1.00 0.00 C ATOM 699 C TRP A 130 -6.852 5.429 0.691 1.00 0.00 C ATOM 700 O TRP A 130 -7.368 6.066 -0.222 1.00 0.00 O ATOM 701 CB TRP A 130 -8.437 5.284 2.673 1.00 0.00 C ATOM 702 CG TRP A 130 -9.515 5.133 1.643 1.00 0.00 C ATOM 703 CD1 TRP A 130 -9.882 3.977 1.024 1.00 0.00 C ATOM 704 CD2 TRP A 130 -10.370 6.158 1.120 1.00 0.00 C ATOM 705 NE1 TRP A 130 -10.904 4.214 0.144 1.00 0.00 N ATOM 706 CE2 TRP A 130 -11.225 5.545 0.183 1.00 0.00 C ATOM 707 CE3 TRP A 130 -10.496 7.532 1.347 1.00 0.00 C ATOM 708 CZ2 TRP A 130 -12.191 6.257 -0.522 1.00 0.00 C ATOM 709 CZ3 TRP A 130 -11.457 8.236 0.647 1.00 0.00 C ATOM 710 CH2 TRP A 130 -12.294 7.598 -0.279 1.00 0.00 C ATOM 0 H TRP A 130 -7.127 7.749 1.345 1.00 0.00 H new ATOM 0 HA TRP A 130 -6.325 5.372 2.770 1.00 0.00 H new ATOM 0 HB2 TRP A 130 -8.263 4.314 3.139 1.00 0.00 H new ATOM 0 HB3 TRP A 130 -8.795 5.953 3.455 1.00 0.00 H new ATOM 0 HD1 TRP A 130 -9.432 3.012 1.202 1.00 0.00 H new ATOM 0 HE1 TRP A 130 -11.353 3.513 -0.445 1.00 0.00 H new ATOM 0 HE3 TRP A 130 -9.854 8.034 2.056 1.00 0.00 H new ATOM 0 HZ2 TRP A 130 -12.836 5.767 -1.236 1.00 0.00 H new ATOM 0 HZ3 TRP A 130 -11.565 9.297 0.816 1.00 0.00 H new ATOM 0 HH2 TRP A 130 -13.034 8.177 -0.811 1.00 0.00 H new ATOM 721 N LEU A 131 -6.036 4.417 0.468 1.00 0.00 N ATOM 722 CA LEU A 131 -5.648 4.068 -0.888 1.00 0.00 C ATOM 723 C LEU A 131 -6.483 2.915 -1.434 1.00 0.00 C ATOM 724 O LEU A 131 -6.882 2.010 -0.700 1.00 0.00 O ATOM 725 CB LEU A 131 -4.139 3.772 -0.959 1.00 0.00 C ATOM 726 CG LEU A 131 -3.561 2.907 0.168 1.00 0.00 C ATOM 727 CD1 LEU A 131 -3.859 1.437 -0.060 1.00 0.00 C ATOM 728 CD2 LEU A 131 -2.062 3.133 0.292 1.00 0.00 C ATOM 0 H LEU A 131 -5.633 3.828 1.196 1.00 0.00 H new ATOM 0 HA LEU A 131 -5.849 4.926 -1.529 1.00 0.00 H new ATOM 0 HB2 LEU A 131 -3.932 3.279 -1.909 1.00 0.00 H new ATOM 0 HB3 LEU A 131 -3.604 4.722 -0.969 1.00 0.00 H new ATOM 0 HG LEU A 131 -4.040 3.205 1.101 1.00 0.00 H new ATOM 0 HD11 LEU A 131 -3.437 0.849 0.755 1.00 0.00 H new ATOM 0 HD12 LEU A 131 -4.938 1.286 -0.095 1.00 0.00 H new ATOM 0 HD13 LEU A 131 -3.417 1.118 -1.004 1.00 0.00 H new ATOM 0 HD21 LEU A 131 -1.666 2.513 1.096 1.00 0.00 H new ATOM 0 HD22 LEU A 131 -1.575 2.866 -0.646 1.00 0.00 H new ATOM 0 HD23 LEU A 131 -1.869 4.182 0.515 1.00 0.00 H new ATOM 740 N THR A 132 -6.757 2.981 -2.723 1.00 0.00 N ATOM 741 CA THR A 132 -7.592 2.001 -3.387 1.00 0.00 C ATOM 742 C THR A 132 -6.821 1.301 -4.500 1.00 0.00 C ATOM 743 O THR A 132 -5.902 1.881 -5.086 1.00 0.00 O ATOM 744 CB THR A 132 -8.839 2.680 -3.989 1.00 0.00 C ATOM 745 OG1 THR A 132 -8.439 3.814 -4.771 1.00 0.00 O ATOM 746 CG2 THR A 132 -9.803 3.128 -2.900 1.00 0.00 C ATOM 0 H THR A 132 -6.407 3.715 -3.338 1.00 0.00 H new ATOM 0 HA THR A 132 -7.899 1.264 -2.645 1.00 0.00 H new ATOM 0 HB THR A 132 -9.350 1.954 -4.621 1.00 0.00 H new ATOM 0 HG1 THR A 132 -9.207 4.147 -5.281 1.00 0.00 H new ATOM 0 HG21 THR A 132 -10.672 3.603 -3.356 1.00 0.00 H new ATOM 0 HG22 THR A 132 -10.125 2.263 -2.320 1.00 0.00 H new ATOM 0 HG23 THR A 132 -9.304 3.840 -2.242 1.00 0.00 H new ATOM 754 N PHE A 133 -7.199 0.063 -4.797 1.00 0.00 N ATOM 755 CA PHE A 133 -6.555 -0.683 -5.877 1.00 0.00 C ATOM 756 C PHE A 133 -7.586 -1.422 -6.711 1.00 0.00 C ATOM 757 O PHE A 133 -7.720 -1.183 -7.910 1.00 0.00 O ATOM 758 CB PHE A 133 -5.517 -1.675 -5.333 1.00 0.00 C ATOM 759 CG PHE A 133 -5.207 -2.778 -6.308 1.00 0.00 C ATOM 760 CD1 PHE A 133 -4.560 -2.505 -7.500 1.00 0.00 C ATOM 761 CD2 PHE A 133 -5.606 -4.081 -6.046 1.00 0.00 C ATOM 762 CE1 PHE A 133 -4.311 -3.509 -8.411 1.00 0.00 C ATOM 763 CE2 PHE A 133 -5.367 -5.088 -6.957 1.00 0.00 C ATOM 764 CZ PHE A 133 -4.718 -4.801 -8.139 1.00 0.00 C ATOM 0 H PHE A 133 -7.940 -0.443 -4.312 1.00 0.00 H new ATOM 0 HA PHE A 133 -6.040 0.040 -6.509 1.00 0.00 H new ATOM 0 HB2 PHE A 133 -4.599 -1.139 -5.092 1.00 0.00 H new ATOM 0 HB3 PHE A 133 -5.886 -2.109 -4.404 1.00 0.00 H new ATOM 0 HD1 PHE A 133 -4.247 -1.495 -7.719 1.00 0.00 H new ATOM 0 HD2 PHE A 133 -6.109 -4.309 -5.118 1.00 0.00 H new ATOM 0 HE1 PHE A 133 -3.799 -3.286 -9.335 1.00 0.00 H new ATOM 0 HE2 PHE A 133 -5.687 -6.098 -6.745 1.00 0.00 H new ATOM 0 HZ PHE A 133 -4.527 -5.588 -8.854 1.00 0.00 H new ATOM 774 N GLU A 134 -8.317 -2.312 -6.069 1.00 0.00 N ATOM 775 CA GLU A 134 -9.340 -3.100 -6.742 1.00 0.00 C ATOM 776 C GLU A 134 -10.612 -2.251 -6.849 1.00 0.00 C ATOM 777 O GLU A 134 -11.726 -2.743 -6.728 1.00 0.00 O ATOM 778 CB GLU A 134 -9.592 -4.382 -5.929 1.00 0.00 C ATOM 779 CG GLU A 134 -10.026 -5.594 -6.749 1.00 0.00 C ATOM 780 CD GLU A 134 -11.468 -5.529 -7.212 1.00 0.00 C ATOM 781 OE1 GLU A 134 -12.378 -5.674 -6.367 1.00 0.00 O ATOM 782 OE2 GLU A 134 -11.701 -5.353 -8.421 1.00 0.00 O ATOM 0 H GLU A 134 -8.223 -2.511 -5.073 1.00 0.00 H new ATOM 0 HA GLU A 134 -9.023 -3.385 -7.745 1.00 0.00 H new ATOM 0 HB2 GLU A 134 -8.680 -4.636 -5.389 1.00 0.00 H new ATOM 0 HB3 GLU A 134 -10.358 -4.175 -5.182 1.00 0.00 H new ATOM 0 HG2 GLU A 134 -9.377 -5.684 -7.620 1.00 0.00 H new ATOM 0 HG3 GLU A 134 -9.885 -6.495 -6.152 1.00 0.00 H new ATOM 789 N GLY A 135 -10.428 -0.949 -7.054 1.00 0.00 N ATOM 790 CA GLY A 135 -11.535 -0.019 -6.977 1.00 0.00 C ATOM 791 C GLY A 135 -11.826 0.352 -5.537 1.00 0.00 C ATOM 792 O GLY A 135 -12.295 1.451 -5.240 1.00 0.00 O ATOM 0 H GLY A 135 -9.527 -0.523 -7.273 1.00 0.00 H new ATOM 0 HA2 GLY A 135 -11.302 0.879 -7.549 1.00 0.00 H new ATOM 0 HA3 GLY A 135 -12.422 -0.464 -7.429 1.00 0.00 H new ATOM 796 N LYS A 136 -11.535 -0.584 -4.648 1.00 0.00 N ATOM 797 CA LYS A 136 -11.711 -0.391 -3.226 1.00 0.00 C ATOM 798 C LYS A 136 -10.365 -0.498 -2.519 1.00 0.00 C ATOM 799 O LYS A 136 -9.355 -0.824 -3.157 1.00 0.00 O ATOM 800 CB LYS A 136 -12.675 -1.445 -2.679 1.00 0.00 C ATOM 801 CG LYS A 136 -12.160 -2.875 -2.764 1.00 0.00 C ATOM 802 CD LYS A 136 -13.164 -3.855 -2.174 1.00 0.00 C ATOM 803 CE LYS A 136 -12.635 -5.281 -2.183 1.00 0.00 C ATOM 804 NZ LYS A 136 -11.492 -5.462 -1.248 1.00 0.00 N ATOM 0 H LYS A 136 -11.168 -1.502 -4.899 1.00 0.00 H new ATOM 0 HA LYS A 136 -12.127 0.600 -3.046 1.00 0.00 H new ATOM 0 HB2 LYS A 136 -12.895 -1.213 -1.637 1.00 0.00 H new ATOM 0 HB3 LYS A 136 -13.616 -1.378 -3.226 1.00 0.00 H new ATOM 0 HG2 LYS A 136 -11.964 -3.133 -3.805 1.00 0.00 H new ATOM 0 HG3 LYS A 136 -11.212 -2.956 -2.232 1.00 0.00 H new ATOM 0 HD2 LYS A 136 -13.400 -3.562 -1.151 1.00 0.00 H new ATOM 0 HD3 LYS A 136 -14.093 -3.809 -2.742 1.00 0.00 H new ATOM 0 HE2 LYS A 136 -13.438 -5.966 -1.910 1.00 0.00 H new ATOM 0 HE3 LYS A 136 -12.321 -5.544 -3.193 1.00 0.00 H new ATOM 0 HZ1 LYS A 136 -11.208 -6.462 -1.237 1.00 0.00 H new ATOM 0 HZ2 LYS A 136 -10.691 -4.878 -1.562 1.00 0.00 H new ATOM 0 HZ3 LYS A 136 -11.777 -5.172 -0.291 1.00 0.00 H new ATOM 818 N PRO A 137 -10.325 -0.215 -1.205 1.00 0.00 N ATOM 819 CA PRO A 137 -9.110 -0.382 -0.403 1.00 0.00 C ATOM 820 C PRO A 137 -8.652 -1.839 -0.359 1.00 0.00 C ATOM 821 O PRO A 137 -9.357 -2.745 -0.816 1.00 0.00 O ATOM 822 CB PRO A 137 -9.519 0.092 0.997 1.00 0.00 C ATOM 823 CG PRO A 137 -10.763 0.883 0.804 1.00 0.00 C ATOM 824 CD PRO A 137 -11.442 0.311 -0.401 1.00 0.00 C ATOM 0 HA PRO A 137 -8.271 0.177 -0.818 1.00 0.00 H new ATOM 0 HB2 PRO A 137 -9.692 -0.754 1.662 1.00 0.00 H new ATOM 0 HB3 PRO A 137 -8.735 0.699 1.450 1.00 0.00 H new ATOM 0 HG2 PRO A 137 -11.406 0.816 1.681 1.00 0.00 H new ATOM 0 HG3 PRO A 137 -10.534 1.938 0.657 1.00 0.00 H new ATOM 0 HD2 PRO A 137 -12.147 -0.475 -0.130 1.00 0.00 H new ATOM 0 HD3 PRO A 137 -12.005 1.071 -0.944 1.00 0.00 H new ATOM 832 N LEU A 138 -7.473 -2.065 0.198 1.00 0.00 N ATOM 833 CA LEU A 138 -6.912 -3.402 0.279 1.00 0.00 C ATOM 834 C LEU A 138 -7.088 -3.968 1.680 1.00 0.00 C ATOM 835 O LEU A 138 -7.061 -3.225 2.661 1.00 0.00 O ATOM 836 CB LEU A 138 -5.435 -3.367 -0.110 1.00 0.00 C ATOM 837 CG LEU A 138 -5.170 -2.937 -1.552 1.00 0.00 C ATOM 838 CD1 LEU A 138 -3.684 -2.750 -1.790 1.00 0.00 C ATOM 839 CD2 LEU A 138 -5.745 -3.962 -2.515 1.00 0.00 C ATOM 0 H LEU A 138 -6.885 -1.336 0.602 1.00 0.00 H new ATOM 0 HA LEU A 138 -7.441 -4.053 -0.417 1.00 0.00 H new ATOM 0 HB2 LEU A 138 -4.912 -2.686 0.561 1.00 0.00 H new ATOM 0 HB3 LEU A 138 -5.008 -4.358 0.045 1.00 0.00 H new ATOM 0 HG LEU A 138 -5.662 -1.980 -1.728 1.00 0.00 H new ATOM 0 HD11 LEU A 138 -3.517 -2.444 -2.823 1.00 0.00 H new ATOM 0 HD12 LEU A 138 -3.302 -1.982 -1.117 1.00 0.00 H new ATOM 0 HD13 LEU A 138 -3.164 -3.689 -1.601 1.00 0.00 H new ATOM 0 HD21 LEU A 138 -5.551 -3.647 -3.540 1.00 0.00 H new ATOM 0 HD22 LEU A 138 -5.276 -4.930 -2.338 1.00 0.00 H new ATOM 0 HD23 LEU A 138 -6.820 -4.045 -2.358 1.00 0.00 H new ATOM 851 N GLU A 139 -7.293 -5.275 1.769 1.00 0.00 N ATOM 852 CA GLU A 139 -7.516 -5.919 3.053 1.00 0.00 C ATOM 853 C GLU A 139 -6.203 -6.009 3.821 1.00 0.00 C ATOM 854 O GLU A 139 -5.297 -6.744 3.429 1.00 0.00 O ATOM 855 CB GLU A 139 -8.107 -7.320 2.864 1.00 0.00 C ATOM 856 CG GLU A 139 -9.157 -7.416 1.764 1.00 0.00 C ATOM 857 CD GLU A 139 -10.280 -6.407 1.905 1.00 0.00 C ATOM 858 OE1 GLU A 139 -11.171 -6.608 2.752 1.00 0.00 O ATOM 859 OE2 GLU A 139 -10.287 -5.413 1.149 1.00 0.00 O ATOM 0 H GLU A 139 -7.309 -5.907 0.969 1.00 0.00 H new ATOM 0 HA GLU A 139 -8.227 -5.320 3.621 1.00 0.00 H new ATOM 0 HB2 GLU A 139 -7.298 -8.015 2.639 1.00 0.00 H new ATOM 0 HB3 GLU A 139 -8.553 -7.643 3.805 1.00 0.00 H new ATOM 0 HG2 GLU A 139 -8.672 -7.275 0.798 1.00 0.00 H new ATOM 0 HG3 GLU A 139 -9.580 -8.420 1.764 1.00 0.00 H new ATOM 866 N ASP A 140 -6.113 -5.264 4.917 1.00 0.00 N ATOM 867 CA ASP A 140 -4.874 -5.155 5.690 1.00 0.00 C ATOM 868 C ASP A 140 -4.425 -6.508 6.236 1.00 0.00 C ATOM 869 O ASP A 140 -3.235 -6.736 6.446 1.00 0.00 O ATOM 870 CB ASP A 140 -5.046 -4.168 6.846 1.00 0.00 C ATOM 871 CG ASP A 140 -5.912 -4.720 7.967 1.00 0.00 C ATOM 872 OD1 ASP A 140 -7.148 -4.749 7.803 1.00 0.00 O ATOM 873 OD2 ASP A 140 -5.358 -5.143 9.006 1.00 0.00 O ATOM 0 H ASP A 140 -6.889 -4.721 5.296 1.00 0.00 H new ATOM 0 HA ASP A 140 -4.104 -4.789 5.011 1.00 0.00 H new ATOM 0 HB2 ASP A 140 -4.065 -3.908 7.245 1.00 0.00 H new ATOM 0 HB3 ASP A 140 -5.491 -3.247 6.469 1.00 0.00 H new ATOM 878 N GLN A 141 -5.384 -7.398 6.437 1.00 0.00 N ATOM 879 CA GLN A 141 -5.124 -8.693 7.051 1.00 0.00 C ATOM 880 C GLN A 141 -4.488 -9.663 6.057 1.00 0.00 C ATOM 881 O GLN A 141 -3.870 -10.648 6.454 1.00 0.00 O ATOM 882 CB GLN A 141 -6.435 -9.281 7.570 1.00 0.00 C ATOM 883 CG GLN A 141 -7.231 -8.304 8.420 1.00 0.00 C ATOM 884 CD GLN A 141 -8.622 -8.796 8.775 1.00 0.00 C ATOM 885 OE1 GLN A 141 -9.215 -9.606 7.911 1.00 0.00 O flip ATOM 886 NE2 GLN A 141 -9.164 -8.434 9.818 1.00 0.00 N flip ATOM 0 H GLN A 141 -6.360 -7.246 6.181 1.00 0.00 H new ATOM 0 HA GLN A 141 -4.426 -8.546 7.875 1.00 0.00 H new ATOM 0 HB2 GLN A 141 -7.045 -9.598 6.724 1.00 0.00 H new ATOM 0 HB3 GLN A 141 -6.219 -10.173 8.158 1.00 0.00 H new ATOM 0 HG2 GLN A 141 -6.681 -8.104 9.339 1.00 0.00 H new ATOM 0 HG3 GLN A 141 -7.315 -7.357 7.887 1.00 0.00 H new ATOM 0 HE21 GLN A 141 -8.673 -7.809 10.458 1.00 0.00 H new ATOM 0 HE22 GLN A 141 -10.104 -8.759 10.043 1.00 0.00 H new ATOM 895 N LEU A 142 -4.636 -9.376 4.771 1.00 0.00 N ATOM 896 CA LEU A 142 -4.171 -10.287 3.736 1.00 0.00 C ATOM 897 C LEU A 142 -2.757 -9.931 3.291 1.00 0.00 C ATOM 898 O LEU A 142 -2.312 -8.789 3.454 1.00 0.00 O ATOM 899 CB LEU A 142 -5.128 -10.271 2.537 1.00 0.00 C ATOM 900 CG LEU A 142 -6.559 -10.724 2.836 1.00 0.00 C ATOM 901 CD1 LEU A 142 -7.370 -10.792 1.552 1.00 0.00 C ATOM 902 CD2 LEU A 142 -6.563 -12.072 3.540 1.00 0.00 C ATOM 0 H LEU A 142 -5.073 -8.523 4.421 1.00 0.00 H new ATOM 0 HA LEU A 142 -4.153 -11.293 4.155 1.00 0.00 H new ATOM 0 HB2 LEU A 142 -5.162 -9.259 2.134 1.00 0.00 H new ATOM 0 HB3 LEU A 142 -4.717 -10.912 1.757 1.00 0.00 H new ATOM 0 HG LEU A 142 -7.018 -9.992 3.501 1.00 0.00 H new ATOM 0 HD11 LEU A 142 -8.386 -11.116 1.780 1.00 0.00 H new ATOM 0 HD12 LEU A 142 -7.399 -9.806 1.087 1.00 0.00 H new ATOM 0 HD13 LEU A 142 -6.908 -11.503 0.867 1.00 0.00 H new ATOM 0 HD21 LEU A 142 -7.591 -12.374 3.742 1.00 0.00 H new ATOM 0 HD22 LEU A 142 -6.085 -12.816 2.903 1.00 0.00 H new ATOM 0 HD23 LEU A 142 -6.016 -11.993 4.480 1.00 0.00 H new ATOM 914 N PRO A 143 -2.026 -10.915 2.739 1.00 0.00 N ATOM 915 CA PRO A 143 -0.671 -10.707 2.227 1.00 0.00 C ATOM 916 C PRO A 143 -0.639 -9.724 1.062 1.00 0.00 C ATOM 917 O PRO A 143 -1.466 -9.788 0.149 1.00 0.00 O ATOM 918 CB PRO A 143 -0.233 -12.102 1.762 1.00 0.00 C ATOM 919 CG PRO A 143 -1.500 -12.852 1.555 1.00 0.00 C ATOM 920 CD PRO A 143 -2.466 -12.314 2.571 1.00 0.00 C ATOM 0 HA PRO A 143 -0.016 -10.277 2.985 1.00 0.00 H new ATOM 0 HB2 PRO A 143 0.348 -12.047 0.842 1.00 0.00 H new ATOM 0 HB3 PRO A 143 0.396 -12.588 2.508 1.00 0.00 H new ATOM 0 HG2 PRO A 143 -1.878 -12.709 0.543 1.00 0.00 H new ATOM 0 HG3 PRO A 143 -1.347 -13.923 1.690 1.00 0.00 H new ATOM 0 HD2 PRO A 143 -3.496 -12.374 2.220 1.00 0.00 H new ATOM 0 HD3 PRO A 143 -2.416 -12.868 3.508 1.00 0.00 H new ATOM 928 N LEU A 144 0.332 -8.824 1.100 1.00 0.00 N ATOM 929 CA LEU A 144 0.482 -7.802 0.078 1.00 0.00 C ATOM 930 C LEU A 144 0.784 -8.455 -1.266 1.00 0.00 C ATOM 931 O LEU A 144 0.309 -8.005 -2.309 1.00 0.00 O ATOM 932 CB LEU A 144 1.608 -6.842 0.480 1.00 0.00 C ATOM 933 CG LEU A 144 1.500 -5.407 -0.050 1.00 0.00 C ATOM 934 CD1 LEU A 144 2.512 -4.520 0.650 1.00 0.00 C ATOM 935 CD2 LEU A 144 1.716 -5.351 -1.555 1.00 0.00 C ATOM 0 H LEU A 144 1.035 -8.782 1.838 1.00 0.00 H new ATOM 0 HA LEU A 144 -0.445 -7.237 -0.016 1.00 0.00 H new ATOM 0 HB2 LEU A 144 1.651 -6.802 1.568 1.00 0.00 H new ATOM 0 HB3 LEU A 144 2.554 -7.262 0.139 1.00 0.00 H new ATOM 0 HG LEU A 144 0.492 -5.047 0.159 1.00 0.00 H new ATOM 0 HD11 LEU A 144 2.429 -3.502 0.268 1.00 0.00 H new ATOM 0 HD12 LEU A 144 2.317 -4.522 1.723 1.00 0.00 H new ATOM 0 HD13 LEU A 144 3.517 -4.897 0.463 1.00 0.00 H new ATOM 0 HD21 LEU A 144 1.632 -4.319 -1.896 1.00 0.00 H new ATOM 0 HD22 LEU A 144 2.708 -5.733 -1.795 1.00 0.00 H new ATOM 0 HD23 LEU A 144 0.962 -5.960 -2.054 1.00 0.00 H new ATOM 947 N GLY A 145 1.549 -9.546 -1.223 1.00 0.00 N ATOM 948 CA GLY A 145 1.951 -10.236 -2.434 1.00 0.00 C ATOM 949 C GLY A 145 0.777 -10.724 -3.260 1.00 0.00 C ATOM 950 O GLY A 145 0.900 -10.900 -4.467 1.00 0.00 O ATOM 0 H GLY A 145 1.899 -9.965 -0.361 1.00 0.00 H new ATOM 0 HA2 GLY A 145 2.561 -9.567 -3.041 1.00 0.00 H new ATOM 0 HA3 GLY A 145 2.579 -11.086 -2.169 1.00 0.00 H new ATOM 954 N GLU A 146 -0.369 -10.923 -2.620 1.00 0.00 N ATOM 955 CA GLU A 146 -1.547 -11.418 -3.321 1.00 0.00 C ATOM 956 C GLU A 146 -2.084 -10.359 -4.285 1.00 0.00 C ATOM 957 O GLU A 146 -2.643 -10.684 -5.332 1.00 0.00 O ATOM 958 CB GLU A 146 -2.628 -11.823 -2.320 1.00 0.00 C ATOM 959 CG GLU A 146 -3.783 -12.578 -2.951 1.00 0.00 C ATOM 960 CD GLU A 146 -4.798 -13.052 -1.938 1.00 0.00 C ATOM 961 OE1 GLU A 146 -4.487 -13.989 -1.169 1.00 0.00 O ATOM 962 OE2 GLU A 146 -5.920 -12.506 -1.916 1.00 0.00 O ATOM 0 H GLU A 146 -0.507 -10.751 -1.624 1.00 0.00 H new ATOM 0 HA GLU A 146 -1.260 -12.296 -3.900 1.00 0.00 H new ATOM 0 HB2 GLU A 146 -2.180 -12.443 -1.544 1.00 0.00 H new ATOM 0 HB3 GLU A 146 -3.013 -10.928 -1.831 1.00 0.00 H new ATOM 0 HG2 GLU A 146 -4.277 -11.934 -3.679 1.00 0.00 H new ATOM 0 HG3 GLU A 146 -3.394 -13.437 -3.497 1.00 0.00 H new ATOM 969 N TYR A 147 -1.897 -9.095 -3.930 1.00 0.00 N ATOM 970 CA TYR A 147 -2.350 -7.990 -4.770 1.00 0.00 C ATOM 971 C TYR A 147 -1.193 -7.410 -5.578 1.00 0.00 C ATOM 972 O TYR A 147 -1.383 -6.884 -6.676 1.00 0.00 O ATOM 973 CB TYR A 147 -2.971 -6.885 -3.913 1.00 0.00 C ATOM 974 CG TYR A 147 -4.176 -7.320 -3.109 1.00 0.00 C ATOM 975 CD1 TYR A 147 -5.395 -7.573 -3.725 1.00 0.00 C ATOM 976 CD2 TYR A 147 -4.097 -7.464 -1.728 1.00 0.00 C ATOM 977 CE1 TYR A 147 -6.497 -7.961 -2.991 1.00 0.00 C ATOM 978 CE2 TYR A 147 -5.196 -7.849 -0.988 1.00 0.00 C ATOM 979 CZ TYR A 147 -6.392 -8.094 -1.623 1.00 0.00 C ATOM 980 OH TYR A 147 -7.489 -8.475 -0.891 1.00 0.00 O ATOM 0 H TYR A 147 -1.435 -8.807 -3.067 1.00 0.00 H new ATOM 0 HA TYR A 147 -3.101 -8.381 -5.456 1.00 0.00 H new ATOM 0 HB2 TYR A 147 -2.213 -6.502 -3.230 1.00 0.00 H new ATOM 0 HB3 TYR A 147 -3.261 -6.059 -4.562 1.00 0.00 H new ATOM 0 HD1 TYR A 147 -5.482 -7.464 -4.796 1.00 0.00 H new ATOM 0 HD2 TYR A 147 -3.160 -7.271 -1.227 1.00 0.00 H new ATOM 0 HE1 TYR A 147 -7.436 -8.159 -3.485 1.00 0.00 H new ATOM 0 HE2 TYR A 147 -5.118 -7.957 0.084 1.00 0.00 H new ATOM 0 HH TYR A 147 -7.699 -9.413 -1.080 1.00 0.00 H new ATOM 990 N GLY A 148 0.008 -7.507 -5.023 1.00 0.00 N ATOM 991 CA GLY A 148 1.164 -6.887 -5.638 1.00 0.00 C ATOM 992 C GLY A 148 2.027 -7.856 -6.422 1.00 0.00 C ATOM 993 O GLY A 148 3.081 -7.473 -6.900 1.00 0.00 O ATOM 0 H GLY A 148 0.202 -8.006 -4.155 1.00 0.00 H new ATOM 0 HA2 GLY A 148 0.828 -6.092 -6.304 1.00 0.00 H new ATOM 0 HA3 GLY A 148 1.770 -6.419 -4.863 1.00 0.00 H new ATOM 997 N LEU A 149 1.575 -9.104 -6.550 1.00 0.00 N ATOM 998 CA LEU A 149 2.337 -10.167 -7.231 1.00 0.00 C ATOM 999 C LEU A 149 2.931 -9.714 -8.570 1.00 0.00 C ATOM 1000 O LEU A 149 3.999 -10.175 -8.970 1.00 0.00 O ATOM 1001 CB LEU A 149 1.457 -11.412 -7.455 1.00 0.00 C ATOM 1002 CG LEU A 149 0.360 -11.291 -8.527 1.00 0.00 C ATOM 1003 CD1 LEU A 149 -0.307 -12.639 -8.745 1.00 0.00 C ATOM 1004 CD2 LEU A 149 -0.679 -10.246 -8.134 1.00 0.00 C ATOM 0 H LEU A 149 0.673 -9.412 -6.187 1.00 0.00 H new ATOM 0 HA LEU A 149 3.168 -10.414 -6.570 1.00 0.00 H new ATOM 0 HB2 LEU A 149 2.106 -12.245 -7.723 1.00 0.00 H new ATOM 0 HB3 LEU A 149 0.982 -11.670 -6.508 1.00 0.00 H new ATOM 0 HG LEU A 149 0.827 -10.969 -9.458 1.00 0.00 H new ATOM 0 HD11 LEU A 149 -1.082 -12.543 -9.505 1.00 0.00 H new ATOM 0 HD12 LEU A 149 0.437 -13.364 -9.075 1.00 0.00 H new ATOM 0 HD13 LEU A 149 -0.755 -12.978 -7.811 1.00 0.00 H new ATOM 0 HD21 LEU A 149 -1.442 -10.182 -8.910 1.00 0.00 H new ATOM 0 HD22 LEU A 149 -1.144 -10.532 -7.191 1.00 0.00 H new ATOM 0 HD23 LEU A 149 -0.195 -9.276 -8.020 1.00 0.00 H new ATOM 1016 N LYS A 150 2.240 -8.822 -9.262 1.00 0.00 N ATOM 1017 CA LYS A 150 2.730 -8.313 -10.531 1.00 0.00 C ATOM 1018 C LYS A 150 3.429 -6.976 -10.329 1.00 0.00 C ATOM 1019 O LYS A 150 2.799 -6.000 -9.909 1.00 0.00 O ATOM 1020 CB LYS A 150 1.574 -8.159 -11.521 1.00 0.00 C ATOM 1021 CG LYS A 150 2.017 -7.799 -12.932 1.00 0.00 C ATOM 1022 CD LYS A 150 2.949 -8.851 -13.507 1.00 0.00 C ATOM 1023 CE LYS A 150 3.396 -8.497 -14.917 1.00 0.00 C ATOM 1024 NZ LYS A 150 2.258 -8.483 -15.875 1.00 0.00 N ATOM 0 H LYS A 150 1.342 -8.438 -8.967 1.00 0.00 H new ATOM 0 HA LYS A 150 3.448 -9.025 -10.938 1.00 0.00 H new ATOM 0 HB2 LYS A 150 1.010 -9.091 -11.554 1.00 0.00 H new ATOM 0 HB3 LYS A 150 0.895 -7.388 -11.156 1.00 0.00 H new ATOM 0 HG2 LYS A 150 1.142 -7.696 -13.574 1.00 0.00 H new ATOM 0 HG3 LYS A 150 2.520 -6.832 -12.921 1.00 0.00 H new ATOM 0 HD2 LYS A 150 3.823 -8.954 -12.863 1.00 0.00 H new ATOM 0 HD3 LYS A 150 2.445 -9.817 -13.517 1.00 0.00 H new ATOM 0 HE2 LYS A 150 3.876 -7.519 -14.910 1.00 0.00 H new ATOM 0 HE3 LYS A 150 4.143 -9.217 -15.252 1.00 0.00 H new ATOM 0 HZ1 LYS A 150 2.624 -8.440 -16.848 1.00 0.00 H new ATOM 0 HZ2 LYS A 150 1.693 -9.348 -15.755 1.00 0.00 H new ATOM 0 HZ3 LYS A 150 1.661 -7.651 -15.693 1.00 0.00 H new ATOM 1038 N PRO A 151 4.743 -6.913 -10.619 1.00 0.00 N ATOM 1039 CA PRO A 151 5.531 -5.683 -10.505 1.00 0.00 C ATOM 1040 C PRO A 151 5.083 -4.629 -11.509 1.00 0.00 C ATOM 1041 O PRO A 151 5.706 -4.440 -12.556 1.00 0.00 O ATOM 1042 CB PRO A 151 6.973 -6.129 -10.791 1.00 0.00 C ATOM 1043 CG PRO A 151 6.955 -7.617 -10.692 1.00 0.00 C ATOM 1044 CD PRO A 151 5.568 -8.042 -11.074 1.00 0.00 C ATOM 0 HA PRO A 151 5.418 -5.219 -9.525 1.00 0.00 H new ATOM 0 HB2 PRO A 151 7.295 -5.805 -11.781 1.00 0.00 H new ATOM 0 HB3 PRO A 151 7.668 -5.696 -10.072 1.00 0.00 H new ATOM 0 HG2 PRO A 151 7.696 -8.061 -11.357 1.00 0.00 H new ATOM 0 HG3 PRO A 151 7.198 -7.943 -9.681 1.00 0.00 H new ATOM 0 HD2 PRO A 151 5.476 -8.203 -12.148 1.00 0.00 H new ATOM 0 HD3 PRO A 151 5.282 -8.974 -10.586 1.00 0.00 H new ATOM 1052 N LEU A 152 3.996 -3.955 -11.164 1.00 0.00 N ATOM 1053 CA LEU A 152 3.331 -2.995 -12.038 1.00 0.00 C ATOM 1054 C LEU A 152 2.026 -2.549 -11.388 1.00 0.00 C ATOM 1055 O LEU A 152 1.514 -1.466 -11.674 1.00 0.00 O ATOM 1056 CB LEU A 152 3.036 -3.607 -13.416 1.00 0.00 C ATOM 1057 CG LEU A 152 2.440 -2.645 -14.447 1.00 0.00 C ATOM 1058 CD1 LEU A 152 3.413 -1.512 -14.742 1.00 0.00 C ATOM 1059 CD2 LEU A 152 2.089 -3.388 -15.725 1.00 0.00 C ATOM 0 H LEU A 152 3.543 -4.060 -10.256 1.00 0.00 H new ATOM 0 HA LEU A 152 3.993 -2.141 -12.182 1.00 0.00 H new ATOM 0 HB2 LEU A 152 3.962 -4.016 -13.819 1.00 0.00 H new ATOM 0 HB3 LEU A 152 2.349 -4.443 -13.284 1.00 0.00 H new ATOM 0 HG LEU A 152 1.527 -2.218 -14.033 1.00 0.00 H new ATOM 0 HD11 LEU A 152 2.974 -0.837 -15.477 1.00 0.00 H new ATOM 0 HD12 LEU A 152 3.621 -0.963 -13.824 1.00 0.00 H new ATOM 0 HD13 LEU A 152 4.342 -1.924 -15.137 1.00 0.00 H new ATOM 0 HD21 LEU A 152 1.666 -2.690 -16.447 1.00 0.00 H new ATOM 0 HD22 LEU A 152 2.989 -3.841 -16.141 1.00 0.00 H new ATOM 0 HD23 LEU A 152 1.360 -4.167 -15.504 1.00 0.00 H new ATOM 1071 N SER A 153 1.487 -3.411 -10.520 1.00 0.00 N ATOM 1072 CA SER A 153 0.288 -3.101 -9.748 1.00 0.00 C ATOM 1073 C SER A 153 0.383 -1.702 -9.140 1.00 0.00 C ATOM 1074 O SER A 153 1.284 -1.411 -8.343 1.00 0.00 O ATOM 1075 CB SER A 153 0.105 -4.154 -8.649 1.00 0.00 C ATOM 1076 OG SER A 153 -1.154 -4.025 -8.014 1.00 0.00 O ATOM 0 H SER A 153 1.870 -4.338 -10.336 1.00 0.00 H new ATOM 0 HA SER A 153 -0.577 -3.119 -10.411 1.00 0.00 H new ATOM 0 HB2 SER A 153 0.196 -5.151 -9.080 1.00 0.00 H new ATOM 0 HB3 SER A 153 0.899 -4.052 -7.910 1.00 0.00 H new ATOM 0 HG SER A 153 -1.844 -3.853 -8.688 1.00 0.00 H new ATOM 1082 N THR A 154 -0.531 -0.831 -9.549 1.00 0.00 N ATOM 1083 CA THR A 154 -0.504 0.556 -9.129 1.00 0.00 C ATOM 1084 C THR A 154 -1.662 0.867 -8.183 1.00 0.00 C ATOM 1085 O THR A 154 -2.834 0.707 -8.535 1.00 0.00 O ATOM 1086 CB THR A 154 -0.566 1.498 -10.346 1.00 0.00 C ATOM 1087 OG1 THR A 154 0.429 1.116 -11.307 1.00 0.00 O ATOM 1088 CG2 THR A 154 -0.331 2.945 -9.930 1.00 0.00 C ATOM 0 H THR A 154 -1.302 -1.067 -10.174 1.00 0.00 H new ATOM 0 HA THR A 154 0.435 0.719 -8.600 1.00 0.00 H new ATOM 0 HB THR A 154 -1.560 1.418 -10.786 1.00 0.00 H new ATOM 0 HG1 THR A 154 0.611 0.157 -11.225 1.00 0.00 H new ATOM 0 HG21 THR A 154 -0.380 3.589 -10.808 1.00 0.00 H new ATOM 0 HG22 THR A 154 -1.097 3.247 -9.215 1.00 0.00 H new ATOM 0 HG23 THR A 154 0.652 3.036 -9.468 1.00 0.00 H new ATOM 1096 N VAL A 155 -1.324 1.300 -6.982 1.00 0.00 N ATOM 1097 CA VAL A 155 -2.318 1.680 -5.996 1.00 0.00 C ATOM 1098 C VAL A 155 -2.494 3.195 -6.004 1.00 0.00 C ATOM 1099 O VAL A 155 -1.512 3.937 -6.073 1.00 0.00 O ATOM 1100 CB VAL A 155 -1.911 1.212 -4.580 1.00 0.00 C ATOM 1101 CG1 VAL A 155 -3.002 1.520 -3.568 1.00 0.00 C ATOM 1102 CG2 VAL A 155 -1.581 -0.277 -4.577 1.00 0.00 C ATOM 0 H VAL A 155 -0.360 1.398 -6.665 1.00 0.00 H new ATOM 0 HA VAL A 155 -3.259 1.196 -6.257 1.00 0.00 H new ATOM 0 HB VAL A 155 -1.016 1.763 -4.290 1.00 0.00 H new ATOM 0 HG11 VAL A 155 -2.689 1.180 -2.581 1.00 0.00 H new ATOM 0 HG12 VAL A 155 -3.181 2.595 -3.542 1.00 0.00 H new ATOM 0 HG13 VAL A 155 -3.920 1.006 -3.855 1.00 0.00 H new ATOM 0 HG21 VAL A 155 -1.297 -0.585 -3.571 1.00 0.00 H new ATOM 0 HG22 VAL A 155 -2.455 -0.844 -4.897 1.00 0.00 H new ATOM 0 HG23 VAL A 155 -0.754 -0.468 -5.261 1.00 0.00 H new ATOM 1112 N PHE A 156 -3.737 3.650 -5.961 1.00 0.00 N ATOM 1113 CA PHE A 156 -4.023 5.077 -5.974 1.00 0.00 C ATOM 1114 C PHE A 156 -4.596 5.525 -4.640 1.00 0.00 C ATOM 1115 O PHE A 156 -5.592 4.977 -4.165 1.00 0.00 O ATOM 1116 CB PHE A 156 -4.996 5.423 -7.102 1.00 0.00 C ATOM 1117 CG PHE A 156 -4.409 5.276 -8.476 1.00 0.00 C ATOM 1118 CD1 PHE A 156 -3.754 6.340 -9.077 1.00 0.00 C ATOM 1119 CD2 PHE A 156 -4.507 4.077 -9.168 1.00 0.00 C ATOM 1120 CE1 PHE A 156 -3.209 6.211 -10.341 1.00 0.00 C ATOM 1121 CE2 PHE A 156 -3.964 3.945 -10.431 1.00 0.00 C ATOM 1122 CZ PHE A 156 -3.314 5.013 -11.018 1.00 0.00 C ATOM 0 H PHE A 156 -4.563 3.053 -5.917 1.00 0.00 H new ATOM 0 HA PHE A 156 -3.085 5.605 -6.146 1.00 0.00 H new ATOM 0 HB2 PHE A 156 -5.874 4.781 -7.022 1.00 0.00 H new ATOM 0 HB3 PHE A 156 -5.339 6.450 -6.971 1.00 0.00 H new ATOM 0 HD1 PHE A 156 -3.669 7.280 -8.552 1.00 0.00 H new ATOM 0 HD2 PHE A 156 -5.013 3.238 -8.714 1.00 0.00 H new ATOM 0 HE1 PHE A 156 -2.701 7.047 -10.798 1.00 0.00 H new ATOM 0 HE2 PHE A 156 -4.048 3.007 -10.960 1.00 0.00 H new ATOM 0 HZ PHE A 156 -2.889 4.911 -12.005 1.00 0.00 H new ATOM 1132 N MET A 157 -3.959 6.517 -4.036 1.00 0.00 N ATOM 1133 CA MET A 157 -4.433 7.075 -2.777 1.00 0.00 C ATOM 1134 C MET A 157 -5.648 7.964 -3.005 1.00 0.00 C ATOM 1135 O MET A 157 -5.615 8.884 -3.822 1.00 0.00 O ATOM 1136 CB MET A 157 -3.335 7.883 -2.087 1.00 0.00 C ATOM 1137 CG MET A 157 -2.229 7.037 -1.481 1.00 0.00 C ATOM 1138 SD MET A 157 -0.895 8.054 -0.826 1.00 0.00 S ATOM 1139 CE MET A 157 0.274 6.800 -0.314 1.00 0.00 C ATOM 0 H MET A 157 -3.111 6.953 -4.398 1.00 0.00 H new ATOM 0 HA MET A 157 -4.714 6.241 -2.134 1.00 0.00 H new ATOM 0 HB2 MET A 157 -2.897 8.571 -2.810 1.00 0.00 H new ATOM 0 HB3 MET A 157 -3.785 8.490 -1.301 1.00 0.00 H new ATOM 0 HG2 MET A 157 -2.640 6.418 -0.683 1.00 0.00 H new ATOM 0 HG3 MET A 157 -1.833 6.360 -2.238 1.00 0.00 H new ATOM 0 HE1 MET A 157 0.989 7.233 0.385 1.00 0.00 H new ATOM 0 HE2 MET A 157 -0.259 5.983 0.172 1.00 0.00 H new ATOM 0 HE3 MET A 157 0.804 6.419 -1.187 1.00 0.00 H new ATOM 1149 N ASN A 158 -6.713 7.682 -2.280 1.00 0.00 N ATOM 1150 CA ASN A 158 -7.919 8.487 -2.346 1.00 0.00 C ATOM 1151 C ASN A 158 -8.039 9.354 -1.101 1.00 0.00 C ATOM 1152 O ASN A 158 -7.526 9.002 -0.036 1.00 0.00 O ATOM 1153 CB ASN A 158 -9.153 7.591 -2.485 1.00 0.00 C ATOM 1154 CG ASN A 158 -9.733 7.617 -3.887 1.00 0.00 C ATOM 1155 OD1 ASN A 158 -10.534 8.487 -4.225 1.00 0.00 O ATOM 1156 ND2 ASN A 158 -9.351 6.648 -4.705 1.00 0.00 N ATOM 0 H ASN A 158 -6.768 6.895 -1.633 1.00 0.00 H new ATOM 0 HA ASN A 158 -7.858 9.133 -3.222 1.00 0.00 H new ATOM 0 HB2 ASN A 158 -8.886 6.567 -2.224 1.00 0.00 H new ATOM 0 HB3 ASN A 158 -9.914 7.913 -1.774 1.00 0.00 H new ATOM 0 HD21 ASN A 158 -9.724 6.605 -5.654 1.00 0.00 H new ATOM 0 HD22 ASN A 158 -8.684 5.945 -4.386 1.00 0.00 H new ATOM 1163 N LEU A 159 -8.700 10.491 -1.240 1.00 0.00 N ATOM 1164 CA LEU A 159 -8.893 11.399 -0.121 1.00 0.00 C ATOM 1165 C LEU A 159 -10.372 11.518 0.217 1.00 0.00 C ATOM 1166 O LEU A 159 -11.228 11.474 -0.669 1.00 0.00 O ATOM 1167 CB LEU A 159 -8.317 12.784 -0.434 1.00 0.00 C ATOM 1168 CG LEU A 159 -6.795 12.845 -0.601 1.00 0.00 C ATOM 1169 CD1 LEU A 159 -6.349 14.270 -0.892 1.00 0.00 C ATOM 1170 CD2 LEU A 159 -6.101 12.314 0.644 1.00 0.00 C ATOM 0 H LEU A 159 -9.113 10.808 -2.117 1.00 0.00 H new ATOM 0 HA LEU A 159 -8.363 10.990 0.739 1.00 0.00 H new ATOM 0 HB2 LEU A 159 -8.780 13.152 -1.349 1.00 0.00 H new ATOM 0 HB3 LEU A 159 -8.605 13.467 0.366 1.00 0.00 H new ATOM 0 HG LEU A 159 -6.515 12.216 -1.446 1.00 0.00 H new ATOM 0 HD11 LEU A 159 -5.265 14.296 -1.008 1.00 0.00 H new ATOM 0 HD12 LEU A 159 -6.821 14.618 -1.811 1.00 0.00 H new ATOM 0 HD13 LEU A 159 -6.641 14.918 -0.066 1.00 0.00 H new ATOM 0 HD21 LEU A 159 -5.021 12.365 0.508 1.00 0.00 H new ATOM 0 HD22 LEU A 159 -6.387 12.918 1.505 1.00 0.00 H new ATOM 0 HD23 LEU A 159 -6.397 11.279 0.812 1.00 0.00 H new ATOM 1182 N ARG A 160 -10.658 11.659 1.499 1.00 0.00 N ATOM 1183 CA ARG A 160 -12.025 11.784 1.980 1.00 0.00 C ATOM 1184 C ARG A 160 -12.550 13.197 1.728 1.00 0.00 C ATOM 1185 O ARG A 160 -11.767 14.138 1.584 1.00 0.00 O ATOM 1186 CB ARG A 160 -12.065 11.454 3.475 1.00 0.00 C ATOM 1187 CG ARG A 160 -13.456 11.464 4.083 1.00 0.00 C ATOM 1188 CD ARG A 160 -13.413 11.128 5.559 1.00 0.00 C ATOM 1189 NE ARG A 160 -14.739 11.175 6.169 1.00 0.00 N ATOM 1190 CZ ARG A 160 -15.199 10.257 7.014 1.00 0.00 C ATOM 1191 NH1 ARG A 160 -14.454 9.201 7.319 1.00 0.00 N ATOM 1192 NH2 ARG A 160 -16.413 10.383 7.540 1.00 0.00 N ATOM 0 H ARG A 160 -9.953 11.690 2.235 1.00 0.00 H new ATOM 0 HA ARG A 160 -12.665 11.085 1.441 1.00 0.00 H new ATOM 0 HB2 ARG A 160 -11.621 10.470 3.629 1.00 0.00 H new ATOM 0 HB3 ARG A 160 -11.443 12.172 4.010 1.00 0.00 H new ATOM 0 HG2 ARG A 160 -13.909 12.446 3.944 1.00 0.00 H new ATOM 0 HG3 ARG A 160 -14.088 10.745 3.562 1.00 0.00 H new ATOM 0 HD2 ARG A 160 -12.988 10.133 5.692 1.00 0.00 H new ATOM 0 HD3 ARG A 160 -12.753 11.828 6.071 1.00 0.00 H new ATOM 0 HE ARG A 160 -15.348 11.958 5.933 1.00 0.00 H new ATOM 0 HH11 ARG A 160 -13.528 9.093 6.905 1.00 0.00 H new ATOM 0 HH12 ARG A 160 -14.808 8.497 7.967 1.00 0.00 H new ATOM 0 HH21 ARG A 160 -16.994 11.185 7.296 1.00 0.00 H new ATOM 0 HH22 ARG A 160 -16.764 9.678 8.188 1.00 0.00 H new