USER MOD reduce.3.24.130724 H: found=0, std=0, add=1424, rem=0, adj=51 USER MOD reduce.3.24.130724 removed 1420 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: B 25 LYS NZ :NH3+ -153:sc= 0.204! (180deg=-0.204) USER MOD Set 1.2: B 26 TYR OH : rot -122:sc= 0.394! USER MOD Set 2.1: A 25 LYS NZ :NH3+ 155:sc= 0.907 (180deg=0.115!) USER MOD Set 2.2: A 26 TYR OH : rot -136:sc= 0.301 USER MOD Single : A 1 GLY N :NH3+ -168:sc= -1.19 (180deg=-2.09) USER MOD Single : A 2 SER OG : rot 174:sc= -0.0567 USER MOD Single : A 6 THR OG1 : rot 180:sc= 0 USER MOD Single : A 8 MET CE :methyl 151:sc= -1.96 (180deg=-3.89!) USER MOD Single : A 10 THR OG1 : rot 69:sc= 0.13 USER MOD Single : A 13 ASN : amide:sc= -0.678 X(o=-0.68,f=-0.45) USER MOD Single : A 16 HIS : no HE2:sc= -6.06! C(o=-6.1!,f=-8.1!) USER MOD Single : A 18 HIS : no HE2:sc= -0.976 K(o=-0.98,f=-9.2!) USER MOD Single : A 19 SER OG : rot 79:sc= 0.694 USER MOD Single : A 21 LYS NZ :NH3+ 127:sc= -0.0401 (180deg=-0.54) USER MOD Single : A 27 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 29 SER OG : rot -89:sc= -0.231 USER MOD Single : A 30 LYS NZ :NH3+ -159:sc= -3.95! (180deg=-6.63!) USER MOD Single : A 31 LYS NZ :NH3+ -173:sc= 0 (180deg=-0.077) USER MOD Single : A 34 LYS NZ :NH3+ -160:sc= -1.97! (180deg=-2.96!) USER MOD Single : A 38 GLN : amide:sc= 0 X(o=0,f=-0.097) USER MOD Single : A 39 THR OG1 : rot 99:sc= 0.916 USER MOD Single : A 42 SER OG : rot -112:sc= 1.31 USER MOD Single : A 48 GLN : amide:sc= -1.7 K(o=-1.7,f=-3.4!) USER MOD Single : A 49 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 56 LYS NZ :NH3+ 163:sc= 0.32! (180deg=-0.922!) USER MOD Single : A 58 MET CE :methyl -114:sc= -0.143 (180deg=-1.85) USER MOD Single : A 59 LYS NZ :NH3+ -179:sc= -0.874 (180deg=-0.911) USER MOD Single : A 64 ASN : amide:sc= -2.25! C(o=-2.3!,f=-2.9!) USER MOD Single : A 72 GLN : amide:sc= -0.142 K(o=-0.14,f=-1.5) USER MOD Single : A 74 TYR OH : rot 180:sc= -0.349 USER MOD Single : A 82 THR OG1 : rot 100:sc= 0.665 USER MOD Single : A 85 MET CE :methyl 180:sc= -0.0136 (180deg=-0.0136) USER MOD Single : A 86 ASN : amide:sc= -6.36! C(o=-6.4!,f=-9.7!) USER MOD Single : A 87 ASN :FLIP amide:sc= -1.54 F(o=-2.2!,f=-1.5) USER MOD Single : A 92 ASN : amide:sc= -0.0424 K(o=-0.042,f=-1.2) USER MOD Single : A 93 SER OG : rot 54:sc= 1.66 USER MOD Single : B 1 GLY N :NH3+ -117:sc= 0.559 (180deg=-0.816!) USER MOD Single : B 2 SER OG : rot -139:sc= 0.662 USER MOD Single : B 6 THR OG1 : rot 180:sc= 0.0102 USER MOD Single : B 8 MET CE :methyl 150:sc= -3.63 (180deg=-6.75!) USER MOD Single : B 10 THR OG1 : rot 85:sc= 0.748 USER MOD Single : B 13 ASN : amide:sc= -0.198 X(o=-0.2,f=-0.64) USER MOD Single : B 16 HIS : no HE2:sc= -2.38 K(o=-2.4,f=-3.1) USER MOD Single : B 18 HIS : no HE2:sc= -0.673 K(o=-0.67,f=-7.7!) USER MOD Single : B 19 SER OG : rot 75:sc= 1.09 USER MOD Single : B 21 LYS NZ :NH3+ 159:sc= -0.174 (180deg=-0.908) USER MOD Single : B 27 LYS NZ :NH3+ 145:sc= -1.6! (180deg=-5.51!) USER MOD Single : B 29 SER OG : rot 55:sc= -2.08 USER MOD Single : B 30 LYS NZ :NH3+ -133:sc= -3.14! (180deg=-13.1!) USER MOD Single : B 31 LYS NZ :NH3+ -175:sc= 0.806 (180deg=0.414) USER MOD Single : B 34 LYS NZ :NH3+ -160:sc= 0.912 (180deg=0.688) USER MOD Single : B 38 GLN : amide:sc= 0.105 X(o=0.11,f=-0.19) USER MOD Single : B 39 THR OG1 : rot 73:sc= 0.82 USER MOD Single : B 42 SER OG : rot -109:sc= 0.189 USER MOD Single : B 48 GLN : amide:sc= -6.3! C(o=-6.3!,f=-8.4!) USER MOD Single : B 49 LYS NZ :NH3+ -110:sc= -0.311 (180deg=-0.715) USER MOD Single : B 56 LYS NZ :NH3+ 164:sc= 0.674! (180deg=-0.0963) USER MOD Single : B 58 MET CE :methyl 134:sc= -0.0863 (180deg=-0.705) USER MOD Single : B 59 LYS NZ :NH3+ 179:sc= -2.35! (180deg=-2.4!) USER MOD Single : B 64 ASN : amide:sc= -0.0129 K(o=-0.013,f=-1.1) USER MOD Single : B 72 GLN :FLIP amide:sc= -0.341 F(o=-1.7,f=-0.34) USER MOD Single : B 74 TYR OH : rot 0:sc= -1.29 USER MOD Single : B 82 THR OG1 : rot 105:sc=-0.000404! USER MOD Single : B 85 MET CE :methyl 129:sc= -1.43 (180deg=-2.18!) USER MOD Single : B 86 ASN : amide:sc= -0.958! C(o=-0.96!,f=-7!) USER MOD Single : B 87 ASN : amide:sc= -0.382 X(o=-0.38,f=-0.77) USER MOD Single : B 92 ASN : amide:sc= 0 X(o=0,f=-0.026) USER MOD Single : B 93 SER OG : rot 74:sc= 1.07 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 -12.860 4.926 8.418 1.00 0.00 N ATOM 2 CA GLY A 1 -12.423 3.539 8.470 1.00 0.00 C ATOM 3 C GLY A 1 -11.679 3.233 9.761 1.00 0.00 C ATOM 4 O GLY A 1 -11.748 3.998 10.730 1.00 0.00 O ATOM 0 H1 GLY A 1 -13.530 5.050 7.633 1.00 0.00 H new ATOM 0 H2 GLY A 1 -13.326 5.177 9.313 1.00 0.00 H new ATOM 0 H3 GLY A 1 -12.037 5.544 8.271 1.00 0.00 H new ATOM 0 HA2 GLY A 1 -13.288 2.881 8.383 1.00 0.00 H new ATOM 0 HA3 GLY A 1 -11.776 3.329 7.618 1.00 0.00 H new ATOM 8 N SER A 2 -10.959 2.128 9.760 1.00 0.00 N ATOM 9 CA SER A 2 -10.175 1.705 10.913 1.00 0.00 C ATOM 10 C SER A 2 -8.783 2.329 10.860 1.00 0.00 C ATOM 11 O SER A 2 -8.497 3.160 9.987 1.00 0.00 O ATOM 12 CB SER A 2 -10.062 0.184 10.925 1.00 0.00 C ATOM 13 OG SER A 2 -11.349 -0.409 10.668 1.00 0.00 O ATOM 0 H SER A 2 -10.898 1.496 8.962 1.00 0.00 H new ATOM 0 HA SER A 2 -10.674 2.037 11.824 1.00 0.00 H new ATOM 0 HB2 SER A 2 -9.346 -0.141 10.171 1.00 0.00 H new ATOM 0 HB3 SER A 2 -9.684 -0.153 11.890 1.00 0.00 H new ATOM 0 HG SER A 2 -11.250 -1.380 10.582 1.00 0.00 H new ATOM 19 N GLU A 3 -7.905 1.912 11.777 1.00 0.00 N ATOM 20 CA GLU A 3 -6.536 2.432 11.823 1.00 0.00 C ATOM 21 C GLU A 3 -5.931 2.437 10.431 1.00 0.00 C ATOM 22 O GLU A 3 -4.965 3.153 10.163 1.00 0.00 O ATOM 23 CB GLU A 3 -5.645 1.555 12.712 1.00 0.00 C ATOM 24 CG GLU A 3 -6.266 1.392 14.086 1.00 0.00 C ATOM 25 CD GLU A 3 -7.211 0.216 14.076 1.00 0.00 C ATOM 26 OE1 GLU A 3 -6.746 -0.893 14.193 1.00 0.00 O ATOM 27 OE2 GLU A 3 -8.387 0.438 13.942 1.00 0.00 O ATOM 0 H GLU A 3 -8.117 1.219 12.495 1.00 0.00 H new ATOM 0 HA GLU A 3 -6.585 3.443 12.227 1.00 0.00 H new ATOM 0 HB2 GLU A 3 -5.509 0.578 12.249 1.00 0.00 H new ATOM 0 HB3 GLU A 3 -4.657 2.005 12.804 1.00 0.00 H new ATOM 0 HG2 GLU A 3 -5.487 1.239 14.833 1.00 0.00 H new ATOM 0 HG3 GLU A 3 -6.801 2.300 14.365 1.00 0.00 H new ATOM 34 N LEU A 4 -6.471 1.601 9.557 1.00 0.00 N ATOM 35 CA LEU A 4 -5.923 1.461 8.228 1.00 0.00 C ATOM 36 C LEU A 4 -5.991 2.780 7.507 1.00 0.00 C ATOM 37 O LEU A 4 -5.029 3.178 6.864 1.00 0.00 O ATOM 38 CB LEU A 4 -6.678 0.403 7.413 1.00 0.00 C ATOM 39 CG LEU A 4 -6.510 -1.013 8.005 1.00 0.00 C ATOM 40 CD1 LEU A 4 -6.309 -2.043 6.899 1.00 0.00 C ATOM 41 CD2 LEU A 4 -5.376 -1.100 9.024 1.00 0.00 C ATOM 0 H LEU A 4 -7.284 1.015 9.748 1.00 0.00 H new ATOM 0 HA LEU A 4 -4.886 1.140 8.330 1.00 0.00 H new ATOM 0 HB2 LEU A 4 -7.737 0.659 7.380 1.00 0.00 H new ATOM 0 HB3 LEU A 4 -6.316 0.411 6.385 1.00 0.00 H new ATOM 0 HG LEU A 4 -7.434 -1.236 8.538 1.00 0.00 H new ATOM 0 HD11 LEU A 4 -6.193 -3.033 7.340 1.00 0.00 H new ATOM 0 HD12 LEU A 4 -7.175 -2.040 6.237 1.00 0.00 H new ATOM 0 HD13 LEU A 4 -5.415 -1.793 6.328 1.00 0.00 H new ATOM 0 HD21 LEU A 4 -5.307 -2.119 9.405 1.00 0.00 H new ATOM 0 HD22 LEU A 4 -4.435 -0.826 8.546 1.00 0.00 H new ATOM 0 HD23 LEU A 4 -5.575 -0.417 9.850 1.00 0.00 H new ATOM 53 N GLU A 5 -7.096 3.497 7.661 1.00 0.00 N ATOM 54 CA GLU A 5 -7.191 4.792 7.014 1.00 0.00 C ATOM 55 C GLU A 5 -6.161 5.745 7.599 1.00 0.00 C ATOM 56 O GLU A 5 -5.405 6.381 6.863 1.00 0.00 O ATOM 57 CB GLU A 5 -8.606 5.385 7.110 1.00 0.00 C ATOM 58 CG GLU A 5 -9.568 4.549 6.248 1.00 0.00 C ATOM 59 CD GLU A 5 -10.969 5.156 6.230 1.00 0.00 C ATOM 60 OE1 GLU A 5 -11.186 6.150 6.904 1.00 0.00 O ATOM 61 OE2 GLU A 5 -11.809 4.631 5.531 1.00 0.00 O ATOM 0 H GLU A 5 -7.910 3.216 8.208 1.00 0.00 H new ATOM 0 HA GLU A 5 -6.980 4.650 5.954 1.00 0.00 H new ATOM 0 HB2 GLU A 5 -8.941 5.391 8.147 1.00 0.00 H new ATOM 0 HB3 GLU A 5 -8.602 6.421 6.771 1.00 0.00 H new ATOM 0 HG2 GLU A 5 -9.184 4.485 5.230 1.00 0.00 H new ATOM 0 HG3 GLU A 5 -9.616 3.531 6.636 1.00 0.00 H new ATOM 68 N THR A 6 -6.016 5.721 8.915 1.00 0.00 N ATOM 69 CA THR A 6 -4.974 6.497 9.557 1.00 0.00 C ATOM 70 C THR A 6 -3.612 6.014 9.081 1.00 0.00 C ATOM 71 O THR A 6 -2.775 6.808 8.643 1.00 0.00 O ATOM 72 CB THR A 6 -5.094 6.384 11.079 1.00 0.00 C ATOM 73 OG1 THR A 6 -6.447 6.626 11.452 1.00 0.00 O ATOM 74 CG2 THR A 6 -4.192 7.423 11.755 1.00 0.00 C ATOM 0 H THR A 6 -6.601 5.178 9.551 1.00 0.00 H new ATOM 0 HA THR A 6 -5.085 7.547 9.287 1.00 0.00 H new ATOM 0 HB THR A 6 -4.787 5.387 11.394 1.00 0.00 H new ATOM 0 HG1 THR A 6 -6.536 6.554 12.425 1.00 0.00 H new ATOM 0 HG21 THR A 6 -4.284 7.335 12.838 1.00 0.00 H new ATOM 0 HG22 THR A 6 -3.156 7.250 11.464 1.00 0.00 H new ATOM 0 HG23 THR A 6 -4.494 8.423 11.445 1.00 0.00 H new ATOM 82 N ALA A 7 -3.424 4.700 9.076 1.00 0.00 N ATOM 83 CA ALA A 7 -2.182 4.121 8.590 1.00 0.00 C ATOM 84 C ALA A 7 -1.972 4.503 7.132 1.00 0.00 C ATOM 85 O ALA A 7 -0.877 4.903 6.733 1.00 0.00 O ATOM 86 CB ALA A 7 -2.217 2.591 8.728 1.00 0.00 C ATOM 0 H ALA A 7 -4.112 4.021 9.401 1.00 0.00 H new ATOM 0 HA ALA A 7 -1.356 4.508 9.187 1.00 0.00 H new ATOM 0 HB1 ALA A 7 -1.281 2.171 8.360 1.00 0.00 H new ATOM 0 HB2 ALA A 7 -2.348 2.323 9.776 1.00 0.00 H new ATOM 0 HB3 ALA A 7 -3.047 2.192 8.145 1.00 0.00 H new ATOM 92 N MET A 8 -3.045 4.437 6.354 1.00 0.00 N ATOM 93 CA MET A 8 -2.990 4.816 4.954 1.00 0.00 C ATOM 94 C MET A 8 -2.657 6.293 4.854 1.00 0.00 C ATOM 95 O MET A 8 -1.752 6.692 4.113 1.00 0.00 O ATOM 96 CB MET A 8 -4.343 4.550 4.285 1.00 0.00 C ATOM 97 CG MET A 8 -4.531 3.041 4.061 1.00 0.00 C ATOM 98 SD MET A 8 -4.513 2.688 2.290 1.00 0.00 S ATOM 99 CE MET A 8 -2.726 2.744 2.053 1.00 0.00 C ATOM 0 H MET A 8 -3.962 4.124 6.672 1.00 0.00 H new ATOM 0 HA MET A 8 -2.224 4.227 4.449 1.00 0.00 H new ATOM 0 HB2 MET A 8 -5.149 4.937 4.909 1.00 0.00 H new ATOM 0 HB3 MET A 8 -4.397 5.077 3.332 1.00 0.00 H new ATOM 0 HG2 MET A 8 -3.737 2.487 4.561 1.00 0.00 H new ATOM 0 HG3 MET A 8 -5.474 2.712 4.499 1.00 0.00 H new ATOM 0 HE1 MET A 8 -2.447 2.087 1.229 1.00 0.00 H new ATOM 0 HE2 MET A 8 -2.421 3.765 1.822 1.00 0.00 H new ATOM 0 HE3 MET A 8 -2.228 2.415 2.965 1.00 0.00 H new ATOM 109 N GLU A 9 -3.300 7.096 5.695 1.00 0.00 N ATOM 110 CA GLU A 9 -3.006 8.513 5.740 1.00 0.00 C ATOM 111 C GLU A 9 -1.590 8.747 6.223 1.00 0.00 C ATOM 112 O GLU A 9 -0.891 9.625 5.725 1.00 0.00 O ATOM 113 CB GLU A 9 -3.999 9.284 6.610 1.00 0.00 C ATOM 114 CG GLU A 9 -5.379 9.329 5.927 1.00 0.00 C ATOM 115 CD GLU A 9 -6.366 10.092 6.788 1.00 0.00 C ATOM 116 OE1 GLU A 9 -5.974 10.561 7.837 1.00 0.00 O ATOM 117 OE2 GLU A 9 -7.499 10.215 6.388 1.00 0.00 O ATOM 0 H GLU A 9 -4.021 6.788 6.347 1.00 0.00 H new ATOM 0 HA GLU A 9 -3.104 8.893 4.723 1.00 0.00 H new ATOM 0 HB2 GLU A 9 -4.084 8.808 7.587 1.00 0.00 H new ATOM 0 HB3 GLU A 9 -3.635 10.298 6.779 1.00 0.00 H new ATOM 0 HG2 GLU A 9 -5.294 9.805 4.950 1.00 0.00 H new ATOM 0 HG3 GLU A 9 -5.742 8.315 5.757 1.00 0.00 H new ATOM 124 N THR A 10 -1.153 7.939 7.161 1.00 0.00 N ATOM 125 CA THR A 10 0.198 8.045 7.667 1.00 0.00 C ATOM 126 C THR A 10 1.166 7.875 6.507 1.00 0.00 C ATOM 127 O THR A 10 2.036 8.721 6.278 1.00 0.00 O ATOM 128 CB THR A 10 0.429 6.971 8.740 1.00 0.00 C ATOM 129 OG1 THR A 10 -0.645 7.008 9.674 1.00 0.00 O ATOM 130 CG2 THR A 10 1.757 7.219 9.476 1.00 0.00 C ATOM 0 H THR A 10 -1.712 7.201 7.590 1.00 0.00 H new ATOM 0 HA THR A 10 0.360 9.021 8.124 1.00 0.00 H new ATOM 0 HB THR A 10 0.475 5.994 8.260 1.00 0.00 H new ATOM 0 HG1 THR A 10 -1.465 6.689 9.242 1.00 0.00 H new ATOM 0 HG21 THR A 10 1.903 6.448 10.232 1.00 0.00 H new ATOM 0 HG22 THR A 10 2.580 7.188 8.762 1.00 0.00 H new ATOM 0 HG23 THR A 10 1.730 8.197 9.956 1.00 0.00 H new ATOM 138 N LEU A 11 0.898 6.878 5.679 1.00 0.00 N ATOM 139 CA LEU A 11 1.652 6.701 4.450 1.00 0.00 C ATOM 140 C LEU A 11 1.442 7.904 3.529 1.00 0.00 C ATOM 141 O LEU A 11 2.397 8.405 2.921 1.00 0.00 O ATOM 142 CB LEU A 11 1.249 5.393 3.751 1.00 0.00 C ATOM 143 CG LEU A 11 1.737 4.184 4.578 1.00 0.00 C ATOM 144 CD1 LEU A 11 1.091 2.905 4.048 1.00 0.00 C ATOM 145 CD2 LEU A 11 3.262 4.049 4.456 1.00 0.00 C ATOM 0 H LEU A 11 0.168 6.183 5.835 1.00 0.00 H new ATOM 0 HA LEU A 11 2.712 6.635 4.694 1.00 0.00 H new ATOM 0 HB2 LEU A 11 0.166 5.352 3.634 1.00 0.00 H new ATOM 0 HB3 LEU A 11 1.679 5.358 2.750 1.00 0.00 H new ATOM 0 HG LEU A 11 1.461 4.338 5.621 1.00 0.00 H new ATOM 0 HD11 LEU A 11 1.437 2.053 4.633 1.00 0.00 H new ATOM 0 HD12 LEU A 11 0.007 2.984 4.129 1.00 0.00 H new ATOM 0 HD13 LEU A 11 1.368 2.764 3.003 1.00 0.00 H new ATOM 0 HD21 LEU A 11 3.600 3.194 5.042 1.00 0.00 H new ATOM 0 HD22 LEU A 11 3.532 3.901 3.410 1.00 0.00 H new ATOM 0 HD23 LEU A 11 3.739 4.956 4.829 1.00 0.00 H new ATOM 157 N ILE A 12 0.199 8.394 3.454 1.00 0.00 N ATOM 158 CA ILE A 12 -0.099 9.562 2.621 1.00 0.00 C ATOM 159 C ILE A 12 0.664 10.773 3.124 1.00 0.00 C ATOM 160 O ILE A 12 1.182 11.543 2.334 1.00 0.00 O ATOM 161 CB ILE A 12 -1.612 9.903 2.648 1.00 0.00 C ATOM 162 CG1 ILE A 12 -2.455 8.825 1.944 1.00 0.00 C ATOM 163 CG2 ILE A 12 -1.859 11.267 1.982 1.00 0.00 C ATOM 164 CD1 ILE A 12 -2.231 8.871 0.427 1.00 0.00 C ATOM 0 H ILE A 12 -0.603 8.007 3.951 1.00 0.00 H new ATOM 0 HA ILE A 12 0.200 9.317 1.602 1.00 0.00 H new ATOM 0 HB ILE A 12 -1.919 9.941 3.693 1.00 0.00 H new ATOM 0 HG12 ILE A 12 -2.189 7.840 2.327 1.00 0.00 H new ATOM 0 HG13 ILE A 12 -3.511 8.979 2.166 1.00 0.00 H new ATOM 0 HG21 ILE A 12 -2.924 11.496 2.007 1.00 0.00 H new ATOM 0 HG22 ILE A 12 -1.309 12.039 2.520 1.00 0.00 H new ATOM 0 HG23 ILE A 12 -1.519 11.233 0.947 1.00 0.00 H new ATOM 0 HD11 ILE A 12 -2.835 8.102 -0.054 1.00 0.00 H new ATOM 0 HD12 ILE A 12 -2.520 9.850 0.046 1.00 0.00 H new ATOM 0 HD13 ILE A 12 -1.178 8.694 0.209 1.00 0.00 H new ATOM 176 N ASN A 13 0.676 10.975 4.427 1.00 0.00 N ATOM 177 CA ASN A 13 1.277 12.182 4.989 1.00 0.00 C ATOM 178 C ASN A 13 2.745 12.260 4.630 1.00 0.00 C ATOM 179 O ASN A 13 3.219 13.286 4.134 1.00 0.00 O ATOM 180 CB ASN A 13 1.114 12.203 6.509 1.00 0.00 C ATOM 181 CG ASN A 13 -0.301 12.630 6.876 1.00 0.00 C ATOM 182 OD1 ASN A 13 -0.622 13.819 6.850 1.00 0.00 O ATOM 183 ND2 ASN A 13 -1.176 11.735 7.197 1.00 0.00 N ATOM 0 H ASN A 13 0.283 10.332 5.114 1.00 0.00 H new ATOM 0 HA ASN A 13 0.764 13.046 4.566 1.00 0.00 H new ATOM 0 HB2 ASN A 13 1.322 11.215 6.919 1.00 0.00 H new ATOM 0 HB3 ASN A 13 1.836 12.890 6.951 1.00 0.00 H new ATOM 0 HD21 ASN A 13 -2.130 12.014 7.428 1.00 0.00 H new ATOM 0 HD22 ASN A 13 -0.913 10.750 7.219 1.00 0.00 H new ATOM 190 N VAL A 14 3.424 11.136 4.731 1.00 0.00 N ATOM 191 CA VAL A 14 4.808 11.063 4.313 1.00 0.00 C ATOM 192 C VAL A 14 4.900 11.358 2.820 1.00 0.00 C ATOM 193 O VAL A 14 5.669 12.221 2.384 1.00 0.00 O ATOM 194 CB VAL A 14 5.376 9.675 4.650 1.00 0.00 C ATOM 195 CG1 VAL A 14 6.790 9.528 4.074 1.00 0.00 C ATOM 196 CG2 VAL A 14 5.427 9.514 6.175 1.00 0.00 C ATOM 0 H VAL A 14 3.042 10.264 5.097 1.00 0.00 H new ATOM 0 HA VAL A 14 5.402 11.807 4.845 1.00 0.00 H new ATOM 0 HB VAL A 14 4.736 8.908 4.214 1.00 0.00 H new ATOM 0 HG11 VAL A 14 7.182 8.541 4.319 1.00 0.00 H new ATOM 0 HG12 VAL A 14 6.756 9.646 2.991 1.00 0.00 H new ATOM 0 HG13 VAL A 14 7.439 10.292 4.502 1.00 0.00 H new ATOM 0 HG21 VAL A 14 5.829 8.532 6.424 1.00 0.00 H new ATOM 0 HG22 VAL A 14 6.067 10.287 6.601 1.00 0.00 H new ATOM 0 HG23 VAL A 14 4.421 9.609 6.585 1.00 0.00 H new ATOM 206 N PHE A 15 4.028 10.726 2.060 1.00 0.00 N ATOM 207 CA PHE A 15 3.943 10.972 0.629 1.00 0.00 C ATOM 208 C PHE A 15 3.605 12.449 0.381 1.00 0.00 C ATOM 209 O PHE A 15 4.216 13.113 -0.461 1.00 0.00 O ATOM 210 CB PHE A 15 2.860 10.067 0.021 1.00 0.00 C ATOM 211 CG PHE A 15 2.855 10.188 -1.483 1.00 0.00 C ATOM 212 CD1 PHE A 15 3.779 9.464 -2.247 1.00 0.00 C ATOM 213 CD2 PHE A 15 1.924 11.020 -2.114 1.00 0.00 C ATOM 214 CE1 PHE A 15 3.770 9.574 -3.640 1.00 0.00 C ATOM 215 CE2 PHE A 15 1.918 11.130 -3.508 1.00 0.00 C ATOM 216 CZ PHE A 15 2.839 10.410 -4.269 1.00 0.00 C ATOM 0 H PHE A 15 3.364 10.035 2.409 1.00 0.00 H new ATOM 0 HA PHE A 15 4.900 10.747 0.158 1.00 0.00 H new ATOM 0 HB2 PHE A 15 3.040 9.031 0.308 1.00 0.00 H new ATOM 0 HB3 PHE A 15 1.883 10.342 0.417 1.00 0.00 H new ATOM 0 HD1 PHE A 15 4.498 8.821 -1.760 1.00 0.00 H new ATOM 0 HD2 PHE A 15 1.210 11.577 -1.525 1.00 0.00 H new ATOM 0 HE1 PHE A 15 4.480 9.015 -4.231 1.00 0.00 H new ATOM 0 HE2 PHE A 15 1.200 11.773 -3.996 1.00 0.00 H new ATOM 0 HZ PHE A 15 2.834 10.497 -5.345 1.00 0.00 H new ATOM 226 N HIS A 16 2.637 12.948 1.139 1.00 0.00 N ATOM 227 CA HIS A 16 2.167 14.329 1.039 1.00 0.00 C ATOM 228 C HIS A 16 3.321 15.292 1.257 1.00 0.00 C ATOM 229 O HIS A 16 3.539 16.217 0.458 1.00 0.00 O ATOM 230 CB HIS A 16 1.106 14.583 2.132 1.00 0.00 C ATOM 231 CG HIS A 16 -0.099 15.317 1.606 1.00 0.00 C ATOM 232 ND1 HIS A 16 -0.136 15.942 0.366 1.00 0.00 N ATOM 233 CD2 HIS A 16 -1.326 15.546 2.173 1.00 0.00 C ATOM 234 CE1 HIS A 16 -1.356 16.510 0.243 1.00 0.00 C ATOM 235 NE2 HIS A 16 -2.115 16.296 1.317 1.00 0.00 N ATOM 0 H HIS A 16 2.149 12.402 1.849 1.00 0.00 H new ATOM 0 HA HIS A 16 1.742 14.486 0.048 1.00 0.00 H new ATOM 0 HB2 HIS A 16 0.790 13.630 2.556 1.00 0.00 H new ATOM 0 HB3 HIS A 16 1.554 15.159 2.942 1.00 0.00 H new ATOM 0 HD1 HIS A 16 0.616 15.967 -0.322 1.00 0.00 H new ATOM 0 HD2 HIS A 16 -1.633 15.193 3.146 1.00 0.00 H new ATOM 0 HE1 HIS A 16 -1.677 17.070 -0.622 1.00 0.00 H new ATOM 244 N ALA A 17 4.065 15.072 2.331 1.00 0.00 N ATOM 245 CA ALA A 17 5.188 15.938 2.661 1.00 0.00 C ATOM 246 C ALA A 17 6.230 15.926 1.558 1.00 0.00 C ATOM 247 O ALA A 17 6.656 16.978 1.084 1.00 0.00 O ATOM 248 CB ALA A 17 5.829 15.505 3.985 1.00 0.00 C ATOM 0 H ALA A 17 3.913 14.305 2.986 1.00 0.00 H new ATOM 0 HA ALA A 17 4.805 16.953 2.764 1.00 0.00 H new ATOM 0 HB1 ALA A 17 6.667 16.163 4.216 1.00 0.00 H new ATOM 0 HB2 ALA A 17 5.090 15.564 4.784 1.00 0.00 H new ATOM 0 HB3 ALA A 17 6.187 14.479 3.898 1.00 0.00 H new ATOM 254 N HIS A 18 6.627 14.734 1.142 1.00 0.00 N ATOM 255 CA HIS A 18 7.633 14.598 0.099 1.00 0.00 C ATOM 256 C HIS A 18 7.110 15.088 -1.247 1.00 0.00 C ATOM 257 O HIS A 18 7.851 15.694 -2.024 1.00 0.00 O ATOM 258 CB HIS A 18 8.153 13.156 -0.001 1.00 0.00 C ATOM 259 CG HIS A 18 8.989 12.831 1.211 1.00 0.00 C ATOM 260 ND1 HIS A 18 10.324 13.207 1.317 1.00 0.00 N ATOM 261 CD2 HIS A 18 8.694 12.183 2.386 1.00 0.00 C ATOM 262 CE1 HIS A 18 10.766 12.785 2.518 1.00 0.00 C ATOM 263 NE2 HIS A 18 9.813 12.156 3.207 1.00 0.00 N ATOM 0 H HIS A 18 6.271 13.851 1.508 1.00 0.00 H new ATOM 0 HA HIS A 18 8.475 15.232 0.379 1.00 0.00 H new ATOM 0 HB2 HIS A 18 7.316 12.462 -0.074 1.00 0.00 H new ATOM 0 HB3 HIS A 18 8.747 13.036 -0.907 1.00 0.00 H new ATOM 0 HD1 HIS A 18 10.868 13.709 0.615 1.00 0.00 H new ATOM 0 HD2 HIS A 18 7.733 11.757 2.634 1.00 0.00 H new ATOM 0 HE1 HIS A 18 11.772 12.938 2.880 1.00 0.00 H new ATOM 272 N SER A 19 5.831 14.848 -1.520 1.00 0.00 N ATOM 273 CA SER A 19 5.251 15.288 -2.793 1.00 0.00 C ATOM 274 C SER A 19 5.437 16.781 -2.966 1.00 0.00 C ATOM 275 O SER A 19 5.791 17.256 -4.047 1.00 0.00 O ATOM 276 CB SER A 19 3.759 14.946 -2.873 1.00 0.00 C ATOM 277 OG SER A 19 3.590 13.547 -2.750 1.00 0.00 O ATOM 0 H SER A 19 5.186 14.363 -0.896 1.00 0.00 H new ATOM 0 HA SER A 19 5.770 14.760 -3.593 1.00 0.00 H new ATOM 0 HB2 SER A 19 3.214 15.460 -2.081 1.00 0.00 H new ATOM 0 HB3 SER A 19 3.346 15.291 -3.821 1.00 0.00 H new ATOM 0 HG SER A 19 3.652 13.292 -1.806 1.00 0.00 H new ATOM 283 N GLY A 20 5.236 17.514 -1.890 1.00 0.00 N ATOM 284 CA GLY A 20 5.390 18.960 -1.922 1.00 0.00 C ATOM 285 C GLY A 20 6.820 19.350 -2.268 1.00 0.00 C ATOM 286 O GLY A 20 7.060 20.401 -2.875 1.00 0.00 O ATOM 0 H GLY A 20 4.966 17.136 -0.982 1.00 0.00 H new ATOM 0 HA2 GLY A 20 4.706 19.386 -2.656 1.00 0.00 H new ATOM 0 HA3 GLY A 20 5.119 19.379 -0.953 1.00 0.00 H new ATOM 290 N LYS A 21 7.775 18.542 -1.825 1.00 0.00 N ATOM 291 CA LYS A 21 9.184 18.863 -2.018 1.00 0.00 C ATOM 292 C LYS A 21 9.570 18.897 -3.494 1.00 0.00 C ATOM 293 O LYS A 21 9.875 19.962 -4.037 1.00 0.00 O ATOM 294 CB LYS A 21 10.078 17.842 -1.298 1.00 0.00 C ATOM 295 CG LYS A 21 9.732 17.771 0.195 1.00 0.00 C ATOM 296 CD LYS A 21 10.032 19.108 0.878 1.00 0.00 C ATOM 297 CE LYS A 21 9.739 18.979 2.372 1.00 0.00 C ATOM 298 NZ LYS A 21 10.729 18.049 2.987 1.00 0.00 N ATOM 0 H LYS A 21 7.602 17.665 -1.333 1.00 0.00 H new ATOM 0 HA LYS A 21 9.336 19.857 -1.596 1.00 0.00 H new ATOM 0 HB2 LYS A 21 9.953 16.859 -1.752 1.00 0.00 H new ATOM 0 HB3 LYS A 21 11.125 18.119 -1.420 1.00 0.00 H new ATOM 0 HG2 LYS A 21 8.678 17.521 0.319 1.00 0.00 H new ATOM 0 HG3 LYS A 21 10.306 16.976 0.670 1.00 0.00 H new ATOM 0 HD2 LYS A 21 11.074 19.386 0.721 1.00 0.00 H new ATOM 0 HD3 LYS A 21 9.422 19.899 0.442 1.00 0.00 H new ATOM 0 HE2 LYS A 21 9.794 19.956 2.851 1.00 0.00 H new ATOM 0 HE3 LYS A 21 8.727 18.605 2.525 1.00 0.00 H new ATOM 0 HZ1 LYS A 21 11.180 18.512 3.802 1.00 0.00 H new ATOM 0 HZ2 LYS A 21 10.244 17.185 3.304 1.00 0.00 H new ATOM 0 HZ3 LYS A 21 11.455 17.800 2.285 1.00 0.00 H new ATOM 312 N GLU A 22 9.709 17.716 -4.086 1.00 0.00 N ATOM 313 CA GLU A 22 10.246 17.587 -5.442 1.00 0.00 C ATOM 314 C GLU A 22 9.293 16.842 -6.375 1.00 0.00 C ATOM 315 O GLU A 22 9.586 16.669 -7.560 1.00 0.00 O ATOM 316 CB GLU A 22 11.593 16.868 -5.384 1.00 0.00 C ATOM 317 CG GLU A 22 12.623 17.769 -4.685 1.00 0.00 C ATOM 318 CD GLU A 22 13.945 17.040 -4.510 1.00 0.00 C ATOM 319 OE1 GLU A 22 14.011 15.877 -4.819 1.00 0.00 O ATOM 320 OE2 GLU A 22 14.886 17.666 -4.082 1.00 0.00 O ATOM 0 H GLU A 22 9.457 16.829 -3.649 1.00 0.00 H new ATOM 0 HA GLU A 22 10.372 18.590 -5.849 1.00 0.00 H new ATOM 0 HB2 GLU A 22 11.492 15.926 -4.845 1.00 0.00 H new ATOM 0 HB3 GLU A 22 11.931 16.624 -6.391 1.00 0.00 H new ATOM 0 HG2 GLU A 22 12.777 18.676 -5.270 1.00 0.00 H new ATOM 0 HG3 GLU A 22 12.241 18.079 -3.712 1.00 0.00 H new ATOM 327 N GLY A 23 8.205 16.335 -5.832 1.00 0.00 N ATOM 328 CA GLY A 23 7.259 15.546 -6.622 1.00 0.00 C ATOM 329 C GLY A 23 6.413 16.428 -7.540 1.00 0.00 C ATOM 330 O GLY A 23 6.922 17.012 -8.504 1.00 0.00 O ATOM 0 H GLY A 23 7.947 16.450 -4.852 1.00 0.00 H new ATOM 0 HA2 GLY A 23 7.805 14.816 -7.220 1.00 0.00 H new ATOM 0 HA3 GLY A 23 6.606 14.985 -5.953 1.00 0.00 H new ATOM 334 N ASP A 24 5.130 16.522 -7.229 1.00 0.00 N ATOM 335 CA ASP A 24 4.177 17.352 -7.977 1.00 0.00 C ATOM 336 C ASP A 24 3.082 17.799 -7.024 1.00 0.00 C ATOM 337 O ASP A 24 3.296 17.802 -5.808 1.00 0.00 O ATOM 338 CB ASP A 24 3.561 16.556 -9.134 1.00 0.00 C ATOM 339 CG ASP A 24 3.002 17.502 -10.168 1.00 0.00 C ATOM 340 OD1 ASP A 24 3.739 17.882 -11.052 1.00 0.00 O ATOM 341 OD2 ASP A 24 1.845 17.846 -10.057 1.00 0.00 O ATOM 0 H ASP A 24 4.709 16.023 -6.445 1.00 0.00 H new ATOM 0 HA ASP A 24 4.695 18.215 -8.395 1.00 0.00 H new ATOM 0 HB2 ASP A 24 4.316 15.913 -9.587 1.00 0.00 H new ATOM 0 HB3 ASP A 24 2.771 15.905 -8.759 1.00 0.00 H new ATOM 346 N LYS A 25 1.871 18.035 -7.531 1.00 0.00 N ATOM 347 CA LYS A 25 0.765 18.316 -6.621 1.00 0.00 C ATOM 348 C LYS A 25 0.597 17.116 -5.780 1.00 0.00 C ATOM 349 O LYS A 25 0.639 17.194 -4.556 1.00 0.00 O ATOM 350 CB LYS A 25 -0.547 18.519 -7.361 1.00 0.00 C ATOM 351 CG LYS A 25 -0.437 19.740 -8.238 1.00 0.00 C ATOM 352 CD LYS A 25 -1.833 20.297 -8.549 1.00 0.00 C ATOM 353 CE LYS A 25 -2.622 19.325 -9.433 1.00 0.00 C ATOM 354 NZ LYS A 25 -3.991 19.876 -9.669 1.00 0.00 N ATOM 0 H LYS A 25 1.638 18.038 -8.524 1.00 0.00 H new ATOM 0 HA LYS A 25 0.993 19.222 -6.060 1.00 0.00 H new ATOM 0 HB2 LYS A 25 -0.777 17.642 -7.966 1.00 0.00 H new ATOM 0 HB3 LYS A 25 -1.365 18.639 -6.650 1.00 0.00 H new ATOM 0 HG2 LYS A 25 0.164 20.501 -7.740 1.00 0.00 H new ATOM 0 HG3 LYS A 25 0.076 19.485 -9.166 1.00 0.00 H new ATOM 0 HD2 LYS A 25 -2.375 20.472 -7.620 1.00 0.00 H new ATOM 0 HD3 LYS A 25 -1.742 21.260 -9.051 1.00 0.00 H new ATOM 0 HE2 LYS A 25 -2.107 19.179 -10.383 1.00 0.00 H new ATOM 0 HE3 LYS A 25 -2.688 18.349 -8.952 1.00 0.00 H new ATOM 0 HZ1 LYS A 25 -4.373 19.489 -10.556 1.00 0.00 H new ATOM 0 HZ2 LYS A 25 -4.613 19.610 -8.879 1.00 0.00 H new ATOM 0 HZ3 LYS A 25 -3.941 20.913 -9.736 1.00 0.00 H new ATOM 368 N TYR A 26 0.624 15.978 -6.461 1.00 0.00 N ATOM 369 CA TYR A 26 0.671 14.704 -5.817 1.00 0.00 C ATOM 370 C TYR A 26 1.478 13.739 -6.656 1.00 0.00 C ATOM 371 O TYR A 26 0.937 13.006 -7.483 1.00 0.00 O ATOM 372 CB TYR A 26 -0.742 14.145 -5.562 1.00 0.00 C ATOM 373 CG TYR A 26 -1.748 14.859 -6.444 1.00 0.00 C ATOM 374 CD1 TYR A 26 -1.666 14.743 -7.833 1.00 0.00 C ATOM 375 CD2 TYR A 26 -2.753 15.638 -5.870 1.00 0.00 C ATOM 376 CE1 TYR A 26 -2.585 15.402 -8.643 1.00 0.00 C ATOM 377 CE2 TYR A 26 -3.676 16.296 -6.680 1.00 0.00 C ATOM 378 CZ TYR A 26 -3.591 16.178 -8.072 1.00 0.00 C ATOM 379 OH TYR A 26 -4.503 16.822 -8.885 1.00 0.00 O ATOM 0 H TYR A 26 0.613 15.929 -7.480 1.00 0.00 H new ATOM 0 HA TYR A 26 1.152 14.830 -4.847 1.00 0.00 H new ATOM 0 HB2 TYR A 26 -0.761 13.075 -5.767 1.00 0.00 H new ATOM 0 HB3 TYR A 26 -1.009 14.274 -4.513 1.00 0.00 H new ATOM 0 HD1 TYR A 26 -0.888 14.141 -8.279 1.00 0.00 H new ATOM 0 HD2 TYR A 26 -2.816 15.731 -4.796 1.00 0.00 H new ATOM 0 HE1 TYR A 26 -2.518 15.312 -9.717 1.00 0.00 H new ATOM 0 HE2 TYR A 26 -4.456 16.896 -6.235 1.00 0.00 H new ATOM 0 HH TYR A 26 -4.639 17.737 -8.563 1.00 0.00 H new ATOM 389 N LYS A 27 2.740 13.667 -6.341 1.00 0.00 N ATOM 390 CA LYS A 27 3.681 12.732 -6.923 1.00 0.00 C ATOM 391 C LYS A 27 4.889 12.695 -6.037 1.00 0.00 C ATOM 392 O LYS A 27 5.157 13.665 -5.341 1.00 0.00 O ATOM 393 CB LYS A 27 4.122 13.143 -8.338 1.00 0.00 C ATOM 394 CG LYS A 27 3.060 12.794 -9.403 1.00 0.00 C ATOM 395 CD LYS A 27 2.715 11.292 -9.322 1.00 0.00 C ATOM 396 CE LYS A 27 2.412 10.733 -10.733 1.00 0.00 C ATOM 397 NZ LYS A 27 0.961 10.458 -10.892 1.00 0.00 N ATOM 0 H LYS A 27 3.166 14.279 -5.645 1.00 0.00 H new ATOM 0 HA LYS A 27 3.196 11.759 -7.003 1.00 0.00 H new ATOM 0 HB2 LYS A 27 4.317 14.215 -8.359 1.00 0.00 H new ATOM 0 HB3 LYS A 27 5.059 12.644 -8.584 1.00 0.00 H new ATOM 0 HG2 LYS A 27 2.163 13.392 -9.245 1.00 0.00 H new ATOM 0 HG3 LYS A 27 3.434 13.038 -10.397 1.00 0.00 H new ATOM 0 HD2 LYS A 27 3.546 10.745 -8.877 1.00 0.00 H new ATOM 0 HD3 LYS A 27 1.852 11.145 -8.672 1.00 0.00 H new ATOM 0 HE2 LYS A 27 2.736 11.448 -11.489 1.00 0.00 H new ATOM 0 HE3 LYS A 27 2.980 9.817 -10.896 1.00 0.00 H new ATOM 0 HZ1 LYS A 27 0.781 10.084 -11.846 1.00 0.00 H new ATOM 0 HZ2 LYS A 27 0.661 9.759 -10.183 1.00 0.00 H new ATOM 0 HZ3 LYS A 27 0.424 11.339 -10.759 1.00 0.00 H new ATOM 411 N LEU A 28 5.662 11.645 -6.125 1.00 0.00 N ATOM 412 CA LEU A 28 6.884 11.557 -5.366 1.00 0.00 C ATOM 413 C LEU A 28 8.050 11.330 -6.310 1.00 0.00 C ATOM 414 O LEU A 28 7.988 10.471 -7.200 1.00 0.00 O ATOM 415 CB LEU A 28 6.766 10.413 -4.350 1.00 0.00 C ATOM 416 CG LEU A 28 8.081 10.204 -3.602 1.00 0.00 C ATOM 417 CD1 LEU A 28 8.347 11.395 -2.680 1.00 0.00 C ATOM 418 CD2 LEU A 28 7.980 8.935 -2.765 1.00 0.00 C ATOM 0 H LEU A 28 5.468 10.836 -6.716 1.00 0.00 H new ATOM 0 HA LEU A 28 7.058 12.486 -4.824 1.00 0.00 H new ATOM 0 HB2 LEU A 28 5.971 10.635 -3.638 1.00 0.00 H new ATOM 0 HB3 LEU A 28 6.486 9.493 -4.864 1.00 0.00 H new ATOM 0 HG LEU A 28 8.897 10.115 -4.319 1.00 0.00 H new ATOM 0 HD11 LEU A 28 9.286 11.241 -2.149 1.00 0.00 H new ATOM 0 HD12 LEU A 28 8.411 12.307 -3.273 1.00 0.00 H new ATOM 0 HD13 LEU A 28 7.534 11.487 -1.960 1.00 0.00 H new ATOM 0 HD21 LEU A 28 8.915 8.778 -2.227 1.00 0.00 H new ATOM 0 HD22 LEU A 28 7.163 9.035 -2.050 1.00 0.00 H new ATOM 0 HD23 LEU A 28 7.789 8.083 -3.418 1.00 0.00 H new ATOM 430 N SER A 29 9.104 12.114 -6.148 1.00 0.00 N ATOM 431 CA SER A 29 10.275 11.959 -6.982 1.00 0.00 C ATOM 432 C SER A 29 11.050 10.751 -6.508 1.00 0.00 C ATOM 433 O SER A 29 10.970 10.380 -5.324 1.00 0.00 O ATOM 434 CB SER A 29 11.152 13.221 -6.889 1.00 0.00 C ATOM 435 OG SER A 29 11.338 13.559 -5.512 1.00 0.00 O ATOM 0 H SER A 29 9.169 12.857 -5.452 1.00 0.00 H new ATOM 0 HA SER A 29 9.977 11.819 -8.021 1.00 0.00 H new ATOM 0 HB2 SER A 29 12.116 13.046 -7.367 1.00 0.00 H new ATOM 0 HB3 SER A 29 10.679 14.048 -7.419 1.00 0.00 H new ATOM 0 HG SER A 29 10.615 14.153 -5.221 1.00 0.00 H new ATOM 441 N LYS A 30 11.860 10.172 -7.371 1.00 0.00 N ATOM 442 CA LYS A 30 12.673 9.064 -6.927 1.00 0.00 C ATOM 443 C LYS A 30 13.846 9.598 -6.146 1.00 0.00 C ATOM 444 O LYS A 30 14.548 8.855 -5.463 1.00 0.00 O ATOM 445 CB LYS A 30 13.160 8.228 -8.113 1.00 0.00 C ATOM 446 CG LYS A 30 11.973 7.817 -9.006 1.00 0.00 C ATOM 447 CD LYS A 30 10.933 7.009 -8.203 1.00 0.00 C ATOM 448 CE LYS A 30 11.304 5.525 -8.180 1.00 0.00 C ATOM 449 NZ LYS A 30 11.593 5.072 -9.553 1.00 0.00 N ATOM 0 H LYS A 30 11.970 10.439 -8.349 1.00 0.00 H new ATOM 0 HA LYS A 30 12.071 8.415 -6.291 1.00 0.00 H new ATOM 0 HB2 LYS A 30 13.881 8.800 -8.697 1.00 0.00 H new ATOM 0 HB3 LYS A 30 13.676 7.339 -7.751 1.00 0.00 H new ATOM 0 HG2 LYS A 30 11.503 8.707 -9.425 1.00 0.00 H new ATOM 0 HG3 LYS A 30 12.333 7.221 -9.845 1.00 0.00 H new ATOM 0 HD2 LYS A 30 10.876 7.391 -7.184 1.00 0.00 H new ATOM 0 HD3 LYS A 30 9.945 7.136 -8.646 1.00 0.00 H new ATOM 0 HE2 LYS A 30 12.173 5.366 -7.542 1.00 0.00 H new ATOM 0 HE3 LYS A 30 10.487 4.941 -7.757 1.00 0.00 H new ATOM 0 HZ1 LYS A 30 11.495 4.038 -9.605 1.00 0.00 H new ATOM 0 HZ2 LYS A 30 10.924 5.517 -10.213 1.00 0.00 H new ATOM 0 HZ3 LYS A 30 12.564 5.341 -9.810 1.00 0.00 H new ATOM 463 N LYS A 31 13.978 10.914 -6.171 1.00 0.00 N ATOM 464 CA LYS A 31 15.002 11.606 -5.422 1.00 0.00 C ATOM 465 C LYS A 31 14.706 11.427 -3.947 1.00 0.00 C ATOM 466 O LYS A 31 15.547 10.984 -3.161 1.00 0.00 O ATOM 467 CB LYS A 31 14.889 13.096 -5.747 1.00 0.00 C ATOM 468 CG LYS A 31 14.918 13.292 -7.260 1.00 0.00 C ATOM 469 CD LYS A 31 14.752 14.776 -7.596 1.00 0.00 C ATOM 470 CE LYS A 31 14.349 14.920 -9.061 1.00 0.00 C ATOM 471 NZ LYS A 31 15.457 14.465 -9.938 1.00 0.00 N ATOM 0 H LYS A 31 13.374 11.530 -6.715 1.00 0.00 H new ATOM 0 HA LYS A 31 15.993 11.224 -5.668 1.00 0.00 H new ATOM 0 HB2 LYS A 31 13.964 13.499 -5.335 1.00 0.00 H new ATOM 0 HB3 LYS A 31 15.710 13.643 -5.283 1.00 0.00 H new ATOM 0 HG2 LYS A 31 15.859 12.921 -7.666 1.00 0.00 H new ATOM 0 HG3 LYS A 31 14.120 12.713 -7.726 1.00 0.00 H new ATOM 0 HD2 LYS A 31 13.994 15.224 -6.953 1.00 0.00 H new ATOM 0 HD3 LYS A 31 15.684 15.309 -7.409 1.00 0.00 H new ATOM 0 HE2 LYS A 31 13.452 14.333 -9.260 1.00 0.00 H new ATOM 0 HE3 LYS A 31 14.105 15.960 -9.279 1.00 0.00 H new ATOM 0 HZ1 LYS A 31 15.224 14.675 -10.929 1.00 0.00 H new ATOM 0 HZ2 LYS A 31 16.333 14.960 -9.676 1.00 0.00 H new ATOM 0 HZ3 LYS A 31 15.591 13.440 -9.824 1.00 0.00 H new ATOM 485 N GLU A 32 13.460 11.718 -3.620 1.00 0.00 N ATOM 486 CA GLU A 32 12.921 11.601 -2.284 1.00 0.00 C ATOM 487 C GLU A 32 12.660 10.150 -1.927 1.00 0.00 C ATOM 488 O GLU A 32 12.836 9.736 -0.784 1.00 0.00 O ATOM 489 CB GLU A 32 11.614 12.392 -2.233 1.00 0.00 C ATOM 490 CG GLU A 32 11.917 13.892 -2.381 1.00 0.00 C ATOM 491 CD GLU A 32 12.568 14.424 -1.119 1.00 0.00 C ATOM 492 OE1 GLU A 32 11.954 14.330 -0.080 1.00 0.00 O ATOM 493 OE2 GLU A 32 13.669 14.892 -1.195 1.00 0.00 O ATOM 0 H GLU A 32 12.777 12.052 -4.300 1.00 0.00 H new ATOM 0 HA GLU A 32 13.639 11.994 -1.564 1.00 0.00 H new ATOM 0 HB2 GLU A 32 10.947 12.064 -3.030 1.00 0.00 H new ATOM 0 HB3 GLU A 32 11.100 12.205 -1.290 1.00 0.00 H new ATOM 0 HG2 GLU A 32 12.575 14.055 -3.234 1.00 0.00 H new ATOM 0 HG3 GLU A 32 10.995 14.438 -2.581 1.00 0.00 H new ATOM 500 N LEU A 33 12.167 9.398 -2.899 1.00 0.00 N ATOM 501 CA LEU A 33 11.748 8.025 -2.653 1.00 0.00 C ATOM 502 C LEU A 33 12.916 7.209 -2.138 1.00 0.00 C ATOM 503 O LEU A 33 12.788 6.486 -1.145 1.00 0.00 O ATOM 504 CB LEU A 33 11.213 7.404 -3.958 1.00 0.00 C ATOM 505 CG LEU A 33 10.664 5.972 -3.734 1.00 0.00 C ATOM 506 CD1 LEU A 33 11.818 4.959 -3.711 1.00 0.00 C ATOM 507 CD2 LEU A 33 9.877 5.890 -2.420 1.00 0.00 C ATOM 0 H LEU A 33 12.047 9.713 -3.862 1.00 0.00 H new ATOM 0 HA LEU A 33 10.958 8.024 -1.902 1.00 0.00 H new ATOM 0 HB2 LEU A 33 10.423 8.036 -4.364 1.00 0.00 H new ATOM 0 HB3 LEU A 33 12.011 7.375 -4.700 1.00 0.00 H new ATOM 0 HG LEU A 33 9.992 5.733 -4.558 1.00 0.00 H new ATOM 0 HD11 LEU A 33 11.419 3.957 -3.553 1.00 0.00 H new ATOM 0 HD12 LEU A 33 12.350 4.992 -4.662 1.00 0.00 H new ATOM 0 HD13 LEU A 33 12.505 5.208 -2.902 1.00 0.00 H new ATOM 0 HD21 LEU A 33 9.501 4.876 -2.284 1.00 0.00 H new ATOM 0 HD22 LEU A 33 10.531 6.150 -1.587 1.00 0.00 H new ATOM 0 HD23 LEU A 33 9.039 6.586 -2.454 1.00 0.00 H new ATOM 519 N LYS A 34 14.067 7.367 -2.767 1.00 0.00 N ATOM 520 CA LYS A 34 15.244 6.638 -2.338 1.00 0.00 C ATOM 521 C LYS A 34 15.633 7.022 -0.927 1.00 0.00 C ATOM 522 O LYS A 34 16.002 6.166 -0.127 1.00 0.00 O ATOM 523 CB LYS A 34 16.422 6.908 -3.276 1.00 0.00 C ATOM 524 CG LYS A 34 16.172 6.255 -4.640 1.00 0.00 C ATOM 525 CD LYS A 34 17.308 6.609 -5.617 1.00 0.00 C ATOM 526 CE LYS A 34 18.476 5.615 -5.482 1.00 0.00 C ATOM 527 NZ LYS A 34 18.967 5.582 -4.073 1.00 0.00 N ATOM 0 H LYS A 34 14.210 7.985 -3.566 1.00 0.00 H new ATOM 0 HA LYS A 34 14.999 5.576 -2.365 1.00 0.00 H new ATOM 0 HB2 LYS A 34 16.560 7.982 -3.399 1.00 0.00 H new ATOM 0 HB3 LYS A 34 17.341 6.516 -2.840 1.00 0.00 H new ATOM 0 HG2 LYS A 34 16.105 5.173 -4.526 1.00 0.00 H new ATOM 0 HG3 LYS A 34 15.217 6.593 -5.043 1.00 0.00 H new ATOM 0 HD2 LYS A 34 16.931 6.597 -6.640 1.00 0.00 H new ATOM 0 HD3 LYS A 34 17.661 7.621 -5.419 1.00 0.00 H new ATOM 0 HE2 LYS A 34 18.152 4.619 -5.785 1.00 0.00 H new ATOM 0 HE3 LYS A 34 19.287 5.903 -6.150 1.00 0.00 H new ATOM 0 HZ1 LYS A 34 19.931 5.194 -4.050 1.00 0.00 H new ATOM 0 HZ2 LYS A 34 18.973 6.547 -3.685 1.00 0.00 H new ATOM 0 HZ3 LYS A 34 18.339 4.983 -3.500 1.00 0.00 H new ATOM 541 N GLU A 35 15.595 8.311 -0.639 1.00 0.00 N ATOM 542 CA GLU A 35 15.994 8.796 0.667 1.00 0.00 C ATOM 543 C GLU A 35 14.936 8.453 1.697 1.00 0.00 C ATOM 544 O GLU A 35 15.233 7.898 2.760 1.00 0.00 O ATOM 545 CB GLU A 35 16.194 10.313 0.631 1.00 0.00 C ATOM 546 CG GLU A 35 17.241 10.672 -0.430 1.00 0.00 C ATOM 547 CD GLU A 35 18.595 10.052 -0.122 1.00 0.00 C ATOM 548 OE1 GLU A 35 18.842 9.698 1.011 1.00 0.00 O ATOM 549 OE2 GLU A 35 19.367 9.931 -1.040 1.00 0.00 O ATOM 0 H GLU A 35 15.293 9.036 -1.289 1.00 0.00 H new ATOM 0 HA GLU A 35 16.934 8.316 0.941 1.00 0.00 H new ATOM 0 HB2 GLU A 35 15.250 10.809 0.406 1.00 0.00 H new ATOM 0 HB3 GLU A 35 16.516 10.670 1.609 1.00 0.00 H new ATOM 0 HG2 GLU A 35 16.899 10.331 -1.407 1.00 0.00 H new ATOM 0 HG3 GLU A 35 17.343 11.756 -0.488 1.00 0.00 H new ATOM 556 N LEU A 36 13.703 8.819 1.401 1.00 0.00 N ATOM 557 CA LEU A 36 12.613 8.612 2.323 1.00 0.00 C ATOM 558 C LEU A 36 12.359 7.138 2.601 1.00 0.00 C ATOM 559 O LEU A 36 12.176 6.747 3.755 1.00 0.00 O ATOM 560 CB LEU A 36 11.343 9.367 1.845 1.00 0.00 C ATOM 561 CG LEU A 36 10.217 8.399 1.434 1.00 0.00 C ATOM 562 CD1 LEU A 36 9.419 7.962 2.660 1.00 0.00 C ATOM 563 CD2 LEU A 36 9.280 9.104 0.455 1.00 0.00 C ATOM 0 H LEU A 36 13.435 9.263 0.523 1.00 0.00 H new ATOM 0 HA LEU A 36 12.901 9.038 3.284 1.00 0.00 H new ATOM 0 HB2 LEU A 36 10.987 10.019 2.643 1.00 0.00 H new ATOM 0 HB3 LEU A 36 11.598 10.007 1.000 1.00 0.00 H new ATOM 0 HG LEU A 36 10.660 7.520 0.965 1.00 0.00 H new ATOM 0 HD11 LEU A 36 8.627 7.278 2.354 1.00 0.00 H new ATOM 0 HD12 LEU A 36 10.081 7.458 3.364 1.00 0.00 H new ATOM 0 HD13 LEU A 36 8.978 8.837 3.138 1.00 0.00 H new ATOM 0 HD21 LEU A 36 8.481 8.423 0.161 1.00 0.00 H new ATOM 0 HD22 LEU A 36 8.849 9.984 0.933 1.00 0.00 H new ATOM 0 HD23 LEU A 36 9.840 9.409 -0.429 1.00 0.00 H new ATOM 575 N LEU A 37 12.370 6.314 1.561 1.00 0.00 N ATOM 576 CA LEU A 37 12.078 4.897 1.749 1.00 0.00 C ATOM 577 C LEU A 37 13.097 4.264 2.667 1.00 0.00 C ATOM 578 O LEU A 37 12.738 3.605 3.650 1.00 0.00 O ATOM 579 CB LEU A 37 12.042 4.165 0.388 1.00 0.00 C ATOM 580 CG LEU A 37 11.780 2.646 0.563 1.00 0.00 C ATOM 581 CD1 LEU A 37 13.056 1.918 1.001 1.00 0.00 C ATOM 582 CD2 LEU A 37 10.674 2.410 1.593 1.00 0.00 C ATOM 0 H LEU A 37 12.573 6.592 0.601 1.00 0.00 H new ATOM 0 HA LEU A 37 11.096 4.806 2.212 1.00 0.00 H new ATOM 0 HB2 LEU A 37 11.263 4.599 -0.239 1.00 0.00 H new ATOM 0 HB3 LEU A 37 12.989 4.314 -0.131 1.00 0.00 H new ATOM 0 HG LEU A 37 11.463 2.247 -0.401 1.00 0.00 H new ATOM 0 HD11 LEU A 37 12.847 0.855 1.117 1.00 0.00 H new ATOM 0 HD12 LEU A 37 13.830 2.055 0.246 1.00 0.00 H new ATOM 0 HD13 LEU A 37 13.400 2.326 1.952 1.00 0.00 H new ATOM 0 HD21 LEU A 37 10.503 1.339 1.704 1.00 0.00 H new ATOM 0 HD22 LEU A 37 10.975 2.831 2.553 1.00 0.00 H new ATOM 0 HD23 LEU A 37 9.756 2.892 1.258 1.00 0.00 H new ATOM 594 N GLN A 38 14.361 4.530 2.411 1.00 0.00 N ATOM 595 CA GLN A 38 15.394 3.996 3.268 1.00 0.00 C ATOM 596 C GLN A 38 15.300 4.611 4.648 1.00 0.00 C ATOM 597 O GLN A 38 15.493 3.933 5.660 1.00 0.00 O ATOM 598 CB GLN A 38 16.791 4.197 2.654 1.00 0.00 C ATOM 599 CG GLN A 38 17.132 5.687 2.576 1.00 0.00 C ATOM 600 CD GLN A 38 18.462 5.886 1.867 1.00 0.00 C ATOM 601 OE1 GLN A 38 18.640 5.426 0.735 1.00 0.00 O ATOM 602 NE2 GLN A 38 19.409 6.537 2.457 1.00 0.00 N ATOM 0 H GLN A 38 14.692 5.101 1.633 1.00 0.00 H new ATOM 0 HA GLN A 38 15.239 2.921 3.363 1.00 0.00 H new ATOM 0 HB2 GLN A 38 17.537 3.678 3.255 1.00 0.00 H new ATOM 0 HB3 GLN A 38 16.823 3.758 1.657 1.00 0.00 H new ATOM 0 HG2 GLN A 38 16.345 6.220 2.043 1.00 0.00 H new ATOM 0 HG3 GLN A 38 17.180 6.109 3.580 1.00 0.00 H new ATOM 0 HE21 GLN A 38 19.261 6.917 3.392 1.00 0.00 H new ATOM 0 HE22 GLN A 38 20.305 6.671 1.988 1.00 0.00 H new ATOM 611 N THR A 39 15.043 5.899 4.682 1.00 0.00 N ATOM 612 CA THR A 39 14.947 6.615 5.929 1.00 0.00 C ATOM 613 C THR A 39 13.777 6.115 6.779 1.00 0.00 C ATOM 614 O THR A 39 13.933 5.850 7.982 1.00 0.00 O ATOM 615 CB THR A 39 14.774 8.106 5.619 1.00 0.00 C ATOM 616 OG1 THR A 39 15.908 8.576 4.898 1.00 0.00 O ATOM 617 CG2 THR A 39 14.606 8.908 6.903 1.00 0.00 C ATOM 0 H THR A 39 14.896 6.474 3.852 1.00 0.00 H new ATOM 0 HA THR A 39 15.858 6.447 6.504 1.00 0.00 H new ATOM 0 HB THR A 39 13.877 8.236 5.014 1.00 0.00 H new ATOM 0 HG1 THR A 39 15.698 8.607 3.941 1.00 0.00 H new ATOM 0 HG21 THR A 39 14.485 9.964 6.659 1.00 0.00 H new ATOM 0 HG22 THR A 39 13.725 8.556 7.439 1.00 0.00 H new ATOM 0 HG23 THR A 39 15.488 8.779 7.530 1.00 0.00 H new ATOM 625 N GLU A 40 12.592 6.073 6.183 1.00 0.00 N ATOM 626 CA GLU A 40 11.389 5.751 6.933 1.00 0.00 C ATOM 627 C GLU A 40 11.315 4.282 7.315 1.00 0.00 C ATOM 628 O GLU A 40 10.965 3.944 8.454 1.00 0.00 O ATOM 629 CB GLU A 40 10.148 6.170 6.154 1.00 0.00 C ATOM 630 CG GLU A 40 10.182 7.693 5.931 1.00 0.00 C ATOM 631 CD GLU A 40 10.222 8.426 7.250 1.00 0.00 C ATOM 632 OE1 GLU A 40 9.353 8.204 8.056 1.00 0.00 O ATOM 633 OE2 GLU A 40 11.120 9.204 7.439 1.00 0.00 O ATOM 0 H GLU A 40 12.440 6.256 5.191 1.00 0.00 H new ATOM 0 HA GLU A 40 11.432 6.316 7.864 1.00 0.00 H new ATOM 0 HB2 GLU A 40 10.112 5.651 5.196 1.00 0.00 H new ATOM 0 HB3 GLU A 40 9.248 5.890 6.702 1.00 0.00 H new ATOM 0 HG2 GLU A 40 11.055 7.959 5.335 1.00 0.00 H new ATOM 0 HG3 GLU A 40 9.304 8.002 5.364 1.00 0.00 H new ATOM 640 N LEU A 41 11.658 3.415 6.377 1.00 0.00 N ATOM 641 CA LEU A 41 11.626 1.977 6.618 1.00 0.00 C ATOM 642 C LEU A 41 12.994 1.473 6.992 1.00 0.00 C ATOM 643 O LEU A 41 13.391 0.369 6.619 1.00 0.00 O ATOM 644 CB LEU A 41 11.098 1.219 5.404 1.00 0.00 C ATOM 645 CG LEU A 41 9.566 1.144 5.474 1.00 0.00 C ATOM 646 CD1 LEU A 41 8.960 2.546 5.370 1.00 0.00 C ATOM 647 CD2 LEU A 41 9.043 0.271 4.344 1.00 0.00 C ATOM 0 H LEU A 41 11.962 3.679 5.440 1.00 0.00 H new ATOM 0 HA LEU A 41 10.944 1.797 7.449 1.00 0.00 H new ATOM 0 HB2 LEU A 41 11.407 1.720 4.487 1.00 0.00 H new ATOM 0 HB3 LEU A 41 11.521 0.215 5.377 1.00 0.00 H new ATOM 0 HG LEU A 41 9.278 0.708 6.431 1.00 0.00 H new ATOM 0 HD11 LEU A 41 7.873 2.477 5.421 1.00 0.00 H new ATOM 0 HD12 LEU A 41 9.324 3.162 6.193 1.00 0.00 H new ATOM 0 HD13 LEU A 41 9.251 2.999 4.422 1.00 0.00 H new ATOM 0 HD21 LEU A 41 7.955 0.220 4.397 1.00 0.00 H new ATOM 0 HD22 LEU A 41 9.340 0.699 3.386 1.00 0.00 H new ATOM 0 HD23 LEU A 41 9.458 -0.733 4.438 1.00 0.00 H new ATOM 659 N SER A 42 13.723 2.286 7.711 1.00 0.00 N ATOM 660 CA SER A 42 15.064 1.947 8.110 1.00 0.00 C ATOM 661 C SER A 42 15.068 0.643 8.906 1.00 0.00 C ATOM 662 O SER A 42 15.979 -0.179 8.767 1.00 0.00 O ATOM 663 CB SER A 42 15.650 3.097 8.933 1.00 0.00 C ATOM 664 OG SER A 42 14.581 3.931 9.410 1.00 0.00 O ATOM 0 H SER A 42 13.405 3.199 8.036 1.00 0.00 H new ATOM 0 HA SER A 42 15.682 1.796 7.225 1.00 0.00 H new ATOM 0 HB2 SER A 42 16.223 2.704 9.773 1.00 0.00 H new ATOM 0 HB3 SER A 42 16.339 3.682 8.323 1.00 0.00 H new ATOM 0 HG SER A 42 14.621 4.802 8.962 1.00 0.00 H new ATOM 670 N GLY A 43 14.009 0.426 9.672 1.00 0.00 N ATOM 671 CA GLY A 43 13.851 -0.800 10.444 1.00 0.00 C ATOM 672 C GLY A 43 13.659 -2.011 9.539 1.00 0.00 C ATOM 673 O GLY A 43 14.399 -2.998 9.645 1.00 0.00 O ATOM 0 H GLY A 43 13.240 1.088 9.776 1.00 0.00 H new ATOM 0 HA2 GLY A 43 14.728 -0.950 11.073 1.00 0.00 H new ATOM 0 HA3 GLY A 43 12.994 -0.703 11.110 1.00 0.00 H new ATOM 677 N PHE A 44 12.720 -1.915 8.596 1.00 0.00 N ATOM 678 CA PHE A 44 12.512 -3.001 7.638 1.00 0.00 C ATOM 679 C PHE A 44 13.661 -3.075 6.686 1.00 0.00 C ATOM 680 O PHE A 44 14.123 -4.158 6.323 1.00 0.00 O ATOM 681 CB PHE A 44 11.186 -2.872 6.859 1.00 0.00 C ATOM 682 CG PHE A 44 10.028 -3.337 7.716 1.00 0.00 C ATOM 683 CD1 PHE A 44 10.049 -4.612 8.285 1.00 0.00 C ATOM 684 CD2 PHE A 44 8.943 -2.493 7.949 1.00 0.00 C ATOM 685 CE1 PHE A 44 8.985 -5.043 9.084 1.00 0.00 C ATOM 686 CE2 PHE A 44 7.881 -2.921 8.747 1.00 0.00 C ATOM 687 CZ PHE A 44 7.902 -4.193 9.315 1.00 0.00 C ATOM 0 H PHE A 44 12.102 -1.112 8.476 1.00 0.00 H new ATOM 0 HA PHE A 44 12.450 -3.923 8.216 1.00 0.00 H new ATOM 0 HB2 PHE A 44 11.032 -1.836 6.558 1.00 0.00 H new ATOM 0 HB3 PHE A 44 11.233 -3.465 5.946 1.00 0.00 H new ATOM 0 HD1 PHE A 44 10.889 -5.267 8.108 1.00 0.00 H new ATOM 0 HD2 PHE A 44 8.924 -1.506 7.511 1.00 0.00 H new ATOM 0 HE1 PHE A 44 9.001 -6.031 9.521 1.00 0.00 H new ATOM 0 HE2 PHE A 44 7.042 -2.265 8.925 1.00 0.00 H new ATOM 0 HZ PHE A 44 7.080 -4.521 9.934 1.00 0.00 H new ATOM 697 N LEU A 45 14.134 -1.923 6.294 1.00 0.00 N ATOM 698 CA LEU A 45 15.213 -1.847 5.364 1.00 0.00 C ATOM 699 C LEU A 45 16.456 -2.510 5.905 1.00 0.00 C ATOM 700 O LEU A 45 17.116 -3.252 5.185 1.00 0.00 O ATOM 701 CB LEU A 45 15.498 -0.387 4.984 1.00 0.00 C ATOM 702 CG LEU A 45 16.772 -0.327 4.145 1.00 0.00 C ATOM 703 CD1 LEU A 45 16.625 -1.185 2.882 1.00 0.00 C ATOM 704 CD2 LEU A 45 17.095 1.115 3.760 1.00 0.00 C ATOM 0 H LEU A 45 13.781 -1.020 6.611 1.00 0.00 H new ATOM 0 HA LEU A 45 14.915 -2.387 4.465 1.00 0.00 H new ATOM 0 HB2 LEU A 45 14.659 0.026 4.424 1.00 0.00 H new ATOM 0 HB3 LEU A 45 15.611 0.220 5.882 1.00 0.00 H new ATOM 0 HG LEU A 45 17.592 -0.721 4.745 1.00 0.00 H new ATOM 0 HD11 LEU A 45 17.543 -1.130 2.296 1.00 0.00 H new ATOM 0 HD12 LEU A 45 16.437 -2.221 3.165 1.00 0.00 H new ATOM 0 HD13 LEU A 45 15.791 -0.815 2.286 1.00 0.00 H new ATOM 0 HD21 LEU A 45 18.006 1.137 3.162 1.00 0.00 H new ATOM 0 HD22 LEU A 45 16.271 1.530 3.180 1.00 0.00 H new ATOM 0 HD23 LEU A 45 17.239 1.709 4.663 1.00 0.00 H new ATOM 716 N ASP A 46 16.785 -2.247 7.161 1.00 0.00 N ATOM 717 CA ASP A 46 18.020 -2.778 7.713 1.00 0.00 C ATOM 718 C ASP A 46 18.066 -4.281 7.560 1.00 0.00 C ATOM 719 O ASP A 46 19.063 -4.836 7.103 1.00 0.00 O ATOM 720 CB ASP A 46 18.167 -2.430 9.187 1.00 0.00 C ATOM 721 CG ASP A 46 19.595 -2.676 9.616 1.00 0.00 C ATOM 722 OD1 ASP A 46 20.466 -1.986 9.134 1.00 0.00 O ATOM 723 OD2 ASP A 46 19.809 -3.555 10.414 1.00 0.00 O ATOM 0 H ASP A 46 16.229 -1.683 7.803 1.00 0.00 H new ATOM 0 HA ASP A 46 18.841 -2.323 7.159 1.00 0.00 H new ATOM 0 HB2 ASP A 46 17.899 -1.387 9.355 1.00 0.00 H new ATOM 0 HB3 ASP A 46 17.486 -3.035 9.785 1.00 0.00 H new ATOM 728 N ALA A 47 16.969 -4.932 7.899 1.00 0.00 N ATOM 729 CA ALA A 47 16.872 -6.380 7.750 1.00 0.00 C ATOM 730 C ALA A 47 16.895 -6.762 6.284 1.00 0.00 C ATOM 731 O ALA A 47 17.490 -7.771 5.898 1.00 0.00 O ATOM 732 CB ALA A 47 15.593 -6.902 8.398 1.00 0.00 C ATOM 0 H ALA A 47 16.133 -4.487 8.278 1.00 0.00 H new ATOM 0 HA ALA A 47 17.729 -6.831 8.249 1.00 0.00 H new ATOM 0 HB1 ALA A 47 15.539 -7.984 8.276 1.00 0.00 H new ATOM 0 HB2 ALA A 47 15.597 -6.656 9.460 1.00 0.00 H new ATOM 0 HB3 ALA A 47 14.729 -6.440 7.921 1.00 0.00 H new ATOM 738 N GLN A 48 16.219 -5.965 5.474 1.00 0.00 N ATOM 739 CA GLN A 48 16.112 -6.234 4.050 1.00 0.00 C ATOM 740 C GLN A 48 17.386 -5.879 3.297 1.00 0.00 C ATOM 741 O GLN A 48 17.560 -6.278 2.152 1.00 0.00 O ATOM 742 CB GLN A 48 14.886 -5.544 3.446 1.00 0.00 C ATOM 743 CG GLN A 48 13.614 -6.105 4.108 1.00 0.00 C ATOM 744 CD GLN A 48 13.535 -7.603 3.878 1.00 0.00 C ATOM 745 OE1 GLN A 48 13.327 -8.049 2.755 1.00 0.00 O ATOM 746 NE2 GLN A 48 13.727 -8.408 4.877 1.00 0.00 N ATOM 0 H GLN A 48 15.734 -5.122 5.780 1.00 0.00 H new ATOM 0 HA GLN A 48 15.976 -7.310 3.938 1.00 0.00 H new ATOM 0 HB2 GLN A 48 14.947 -4.467 3.601 1.00 0.00 H new ATOM 0 HB3 GLN A 48 14.854 -5.710 2.369 1.00 0.00 H new ATOM 0 HG2 GLN A 48 13.624 -5.892 5.177 1.00 0.00 H new ATOM 0 HG3 GLN A 48 12.732 -5.617 3.694 1.00 0.00 H new ATOM 0 HE21 GLN A 48 13.900 -8.032 5.809 1.00 0.00 H new ATOM 0 HE22 GLN A 48 13.705 -9.417 4.730 1.00 0.00 H new ATOM 755 N LYS A 49 18.318 -5.234 3.975 1.00 0.00 N ATOM 756 CA LYS A 49 19.606 -4.899 3.358 1.00 0.00 C ATOM 757 C LYS A 49 20.273 -6.160 2.856 1.00 0.00 C ATOM 758 O LYS A 49 20.959 -6.146 1.835 1.00 0.00 O ATOM 759 CB LYS A 49 20.553 -4.247 4.378 1.00 0.00 C ATOM 760 CG LYS A 49 20.151 -2.801 4.695 1.00 0.00 C ATOM 761 CD LYS A 49 21.041 -2.271 5.834 1.00 0.00 C ATOM 762 CE LYS A 49 22.506 -2.142 5.366 1.00 0.00 C ATOM 763 NZ LYS A 49 23.422 -2.557 6.462 1.00 0.00 N ATOM 0 H LYS A 49 18.217 -4.931 4.944 1.00 0.00 H new ATOM 0 HA LYS A 49 19.411 -4.205 2.540 1.00 0.00 H new ATOM 0 HB2 LYS A 49 20.554 -4.833 5.297 1.00 0.00 H new ATOM 0 HB3 LYS A 49 21.571 -4.263 3.989 1.00 0.00 H new ATOM 0 HG2 LYS A 49 20.262 -2.176 3.809 1.00 0.00 H new ATOM 0 HG3 LYS A 49 19.101 -2.757 4.986 1.00 0.00 H new ATOM 0 HD2 LYS A 49 20.674 -1.301 6.168 1.00 0.00 H new ATOM 0 HD3 LYS A 49 20.985 -2.944 6.689 1.00 0.00 H new ATOM 0 HE2 LYS A 49 22.672 -2.763 4.486 1.00 0.00 H new ATOM 0 HE3 LYS A 49 22.715 -1.113 5.075 1.00 0.00 H new ATOM 0 HZ1 LYS A 49 24.408 -2.469 6.143 1.00 0.00 H new ATOM 0 HZ2 LYS A 49 23.270 -1.947 7.291 1.00 0.00 H new ATOM 0 HZ3 LYS A 49 23.229 -3.546 6.720 1.00 0.00 H new ATOM 777 N ASP A 50 20.145 -7.218 3.626 1.00 0.00 N ATOM 778 CA ASP A 50 20.787 -8.479 3.305 1.00 0.00 C ATOM 779 C ASP A 50 19.815 -9.428 2.619 1.00 0.00 C ATOM 780 O ASP A 50 20.020 -10.649 2.612 1.00 0.00 O ATOM 781 CB ASP A 50 21.346 -9.122 4.575 1.00 0.00 C ATOM 782 CG ASP A 50 22.415 -10.147 4.240 1.00 0.00 C ATOM 783 OD1 ASP A 50 23.085 -9.988 3.239 1.00 0.00 O ATOM 784 OD2 ASP A 50 22.566 -11.072 5.001 1.00 0.00 O ATOM 0 H ASP A 50 19.598 -7.232 4.487 1.00 0.00 H new ATOM 0 HA ASP A 50 21.608 -8.278 2.616 1.00 0.00 H new ATOM 0 HB2 ASP A 50 21.765 -8.352 5.223 1.00 0.00 H new ATOM 0 HB3 ASP A 50 20.539 -9.601 5.130 1.00 0.00 H new ATOM 789 N VAL A 51 18.738 -8.880 2.078 1.00 0.00 N ATOM 790 CA VAL A 51 17.719 -9.689 1.431 1.00 0.00 C ATOM 791 C VAL A 51 17.596 -9.294 -0.041 1.00 0.00 C ATOM 792 O VAL A 51 17.553 -8.113 -0.374 1.00 0.00 O ATOM 793 CB VAL A 51 16.377 -9.498 2.164 1.00 0.00 C ATOM 794 CG1 VAL A 51 15.236 -10.202 1.423 1.00 0.00 C ATOM 795 CG2 VAL A 51 16.487 -10.032 3.598 1.00 0.00 C ATOM 0 H VAL A 51 18.548 -7.878 2.075 1.00 0.00 H new ATOM 0 HA VAL A 51 17.999 -10.741 1.478 1.00 0.00 H new ATOM 0 HB VAL A 51 16.151 -8.432 2.192 1.00 0.00 H new ATOM 0 HG11 VAL A 51 14.302 -10.049 1.964 1.00 0.00 H new ATOM 0 HG12 VAL A 51 15.145 -9.789 0.418 1.00 0.00 H new ATOM 0 HG13 VAL A 51 15.448 -11.269 1.359 1.00 0.00 H new ATOM 0 HG21 VAL A 51 15.535 -9.894 4.111 1.00 0.00 H new ATOM 0 HG22 VAL A 51 16.736 -11.093 3.573 1.00 0.00 H new ATOM 0 HG23 VAL A 51 17.268 -9.489 4.130 1.00 0.00 H new ATOM 805 N ASP A 52 17.567 -10.295 -0.909 1.00 0.00 N ATOM 806 CA ASP A 52 17.525 -10.082 -2.358 1.00 0.00 C ATOM 807 C ASP A 52 16.320 -9.247 -2.745 1.00 0.00 C ATOM 808 O ASP A 52 16.363 -8.474 -3.704 1.00 0.00 O ATOM 809 CB ASP A 52 17.473 -11.432 -3.086 1.00 0.00 C ATOM 810 CG ASP A 52 17.442 -11.223 -4.591 1.00 0.00 C ATOM 811 OD1 ASP A 52 18.328 -10.577 -5.099 1.00 0.00 O ATOM 812 OD2 ASP A 52 16.540 -11.716 -5.223 1.00 0.00 O ATOM 0 H ASP A 52 17.572 -11.277 -0.635 1.00 0.00 H new ATOM 0 HA ASP A 52 18.428 -9.546 -2.651 1.00 0.00 H new ATOM 0 HB2 ASP A 52 18.341 -12.032 -2.814 1.00 0.00 H new ATOM 0 HB3 ASP A 52 16.590 -11.988 -2.772 1.00 0.00 H new ATOM 817 N ALA A 53 15.237 -9.430 -2.022 1.00 0.00 N ATOM 818 CA ALA A 53 14.002 -8.725 -2.319 1.00 0.00 C ATOM 819 C ALA A 53 14.214 -7.216 -2.317 1.00 0.00 C ATOM 820 O ALA A 53 13.552 -6.500 -3.058 1.00 0.00 O ATOM 821 CB ALA A 53 12.906 -9.095 -1.311 1.00 0.00 C ATOM 0 H ALA A 53 15.183 -10.061 -1.223 1.00 0.00 H new ATOM 0 HA ALA A 53 13.684 -9.030 -3.316 1.00 0.00 H new ATOM 0 HB1 ALA A 53 11.991 -8.555 -1.554 1.00 0.00 H new ATOM 0 HB2 ALA A 53 12.717 -10.168 -1.356 1.00 0.00 H new ATOM 0 HB3 ALA A 53 13.230 -8.826 -0.306 1.00 0.00 H new ATOM 827 N VAL A 54 15.149 -6.731 -1.511 1.00 0.00 N ATOM 828 CA VAL A 54 15.380 -5.296 -1.438 1.00 0.00 C ATOM 829 C VAL A 54 15.750 -4.745 -2.809 1.00 0.00 C ATOM 830 O VAL A 54 15.163 -3.761 -3.264 1.00 0.00 O ATOM 831 CB VAL A 54 16.448 -4.949 -0.369 1.00 0.00 C ATOM 832 CG1 VAL A 54 17.867 -5.038 -0.947 1.00 0.00 C ATOM 833 CG2 VAL A 54 16.204 -3.532 0.169 1.00 0.00 C ATOM 0 H VAL A 54 15.748 -7.297 -0.910 1.00 0.00 H new ATOM 0 HA VAL A 54 14.453 -4.816 -1.125 1.00 0.00 H new ATOM 0 HB VAL A 54 16.361 -5.674 0.440 1.00 0.00 H new ATOM 0 HG11 VAL A 54 18.592 -4.789 -0.172 1.00 0.00 H new ATOM 0 HG12 VAL A 54 18.051 -6.051 -1.304 1.00 0.00 H new ATOM 0 HG13 VAL A 54 17.967 -4.337 -1.776 1.00 0.00 H new ATOM 0 HG21 VAL A 54 16.957 -3.293 0.920 1.00 0.00 H new ATOM 0 HG22 VAL A 54 16.268 -2.816 -0.650 1.00 0.00 H new ATOM 0 HG23 VAL A 54 15.213 -3.480 0.620 1.00 0.00 H new ATOM 843 N ASP A 55 16.618 -5.460 -3.516 1.00 0.00 N ATOM 844 CA ASP A 55 16.972 -5.095 -4.881 1.00 0.00 C ATOM 845 C ASP A 55 15.752 -5.105 -5.761 1.00 0.00 C ATOM 846 O ASP A 55 15.472 -4.155 -6.477 1.00 0.00 O ATOM 847 CB ASP A 55 17.980 -6.129 -5.433 1.00 0.00 C ATOM 848 CG ASP A 55 17.996 -6.121 -6.957 1.00 0.00 C ATOM 849 OD1 ASP A 55 18.195 -5.070 -7.532 1.00 0.00 O ATOM 850 OD2 ASP A 55 17.805 -7.178 -7.541 1.00 0.00 O ATOM 0 H ASP A 55 17.089 -6.295 -3.166 1.00 0.00 H new ATOM 0 HA ASP A 55 17.406 -4.095 -4.876 1.00 0.00 H new ATOM 0 HB2 ASP A 55 18.978 -5.906 -5.055 1.00 0.00 H new ATOM 0 HB3 ASP A 55 17.718 -7.124 -5.074 1.00 0.00 H new ATOM 855 N LYS A 56 15.100 -6.224 -5.764 1.00 0.00 N ATOM 856 CA LYS A 56 13.987 -6.479 -6.643 1.00 0.00 C ATOM 857 C LYS A 56 12.771 -5.626 -6.327 1.00 0.00 C ATOM 858 O LYS A 56 12.162 -5.047 -7.231 1.00 0.00 O ATOM 859 CB LYS A 56 13.713 -7.964 -6.638 1.00 0.00 C ATOM 860 CG LYS A 56 14.974 -8.590 -7.244 1.00 0.00 C ATOM 861 CD LYS A 56 14.913 -10.094 -7.262 1.00 0.00 C ATOM 862 CE LYS A 56 16.206 -10.610 -7.915 1.00 0.00 C ATOM 863 NZ LYS A 56 17.399 -9.862 -7.367 1.00 0.00 N ATOM 0 H LYS A 56 15.325 -7.005 -5.147 1.00 0.00 H new ATOM 0 HA LYS A 56 14.246 -6.177 -7.658 1.00 0.00 H new ATOM 0 HB2 LYS A 56 13.534 -8.331 -5.627 1.00 0.00 H new ATOM 0 HB3 LYS A 56 12.828 -8.206 -7.226 1.00 0.00 H new ATOM 0 HG2 LYS A 56 15.107 -8.222 -8.261 1.00 0.00 H new ATOM 0 HG3 LYS A 56 15.846 -8.271 -6.673 1.00 0.00 H new ATOM 0 HD2 LYS A 56 14.815 -10.484 -6.249 1.00 0.00 H new ATOM 0 HD3 LYS A 56 14.041 -10.434 -7.821 1.00 0.00 H new ATOM 0 HE2 LYS A 56 16.318 -11.677 -7.725 1.00 0.00 H new ATOM 0 HE3 LYS A 56 16.152 -10.483 -8.996 1.00 0.00 H new ATOM 0 HZ1 LYS A 56 18.269 -10.390 -7.582 1.00 0.00 H new ATOM 0 HZ2 LYS A 56 17.449 -8.920 -7.805 1.00 0.00 H new ATOM 0 HZ3 LYS A 56 17.301 -9.760 -6.337 1.00 0.00 H new ATOM 877 N VAL A 57 12.503 -5.442 -5.045 1.00 0.00 N ATOM 878 CA VAL A 57 11.437 -4.558 -4.612 1.00 0.00 C ATOM 879 C VAL A 57 11.786 -3.153 -5.048 1.00 0.00 C ATOM 880 O VAL A 57 10.998 -2.461 -5.695 1.00 0.00 O ATOM 881 CB VAL A 57 11.304 -4.620 -3.082 1.00 0.00 C ATOM 882 CG1 VAL A 57 10.387 -3.509 -2.595 1.00 0.00 C ATOM 883 CG2 VAL A 57 10.730 -5.981 -2.662 1.00 0.00 C ATOM 0 H VAL A 57 13.011 -5.895 -4.285 1.00 0.00 H new ATOM 0 HA VAL A 57 10.487 -4.860 -5.053 1.00 0.00 H new ATOM 0 HB VAL A 57 12.291 -4.492 -2.637 1.00 0.00 H new ATOM 0 HG11 VAL A 57 10.298 -3.560 -1.510 1.00 0.00 H new ATOM 0 HG12 VAL A 57 10.803 -2.543 -2.880 1.00 0.00 H new ATOM 0 HG13 VAL A 57 9.402 -3.627 -3.046 1.00 0.00 H new ATOM 0 HG21 VAL A 57 10.638 -6.018 -1.576 1.00 0.00 H new ATOM 0 HG22 VAL A 57 9.747 -6.117 -3.114 1.00 0.00 H new ATOM 0 HG23 VAL A 57 11.396 -6.776 -2.997 1.00 0.00 H new ATOM 893 N MET A 58 13.024 -2.800 -4.804 1.00 0.00 N ATOM 894 CA MET A 58 13.562 -1.547 -5.247 1.00 0.00 C ATOM 895 C MET A 58 13.538 -1.484 -6.763 1.00 0.00 C ATOM 896 O MET A 58 13.342 -0.419 -7.349 1.00 0.00 O ATOM 897 CB MET A 58 14.993 -1.395 -4.726 1.00 0.00 C ATOM 898 CG MET A 58 15.612 -0.124 -5.279 1.00 0.00 C ATOM 899 SD MET A 58 17.281 0.083 -4.600 1.00 0.00 S ATOM 900 CE MET A 58 18.091 -1.242 -5.545 1.00 0.00 C ATOM 0 H MET A 58 13.687 -3.380 -4.289 1.00 0.00 H new ATOM 0 HA MET A 58 12.955 -0.730 -4.857 1.00 0.00 H new ATOM 0 HB2 MET A 58 14.991 -1.365 -3.636 1.00 0.00 H new ATOM 0 HB3 MET A 58 15.590 -2.258 -5.020 1.00 0.00 H new ATOM 0 HG2 MET A 58 15.654 -0.171 -6.367 1.00 0.00 H new ATOM 0 HG3 MET A 58 14.994 0.736 -5.021 1.00 0.00 H new ATOM 0 HE1 MET A 58 18.414 -2.029 -4.864 1.00 0.00 H new ATOM 0 HE2 MET A 58 17.388 -1.654 -6.269 1.00 0.00 H new ATOM 0 HE3 MET A 58 18.957 -0.838 -6.069 1.00 0.00 H new ATOM 910 N LYS A 59 13.827 -2.606 -7.385 1.00 0.00 N ATOM 911 CA LYS A 59 13.954 -2.686 -8.827 1.00 0.00 C ATOM 912 C LYS A 59 12.656 -2.302 -9.499 1.00 0.00 C ATOM 913 O LYS A 59 12.649 -1.529 -10.454 1.00 0.00 O ATOM 914 CB LYS A 59 14.388 -4.097 -9.260 1.00 0.00 C ATOM 915 CG LYS A 59 14.999 -4.049 -10.659 1.00 0.00 C ATOM 916 CD LYS A 59 16.315 -3.243 -10.617 1.00 0.00 C ATOM 917 CE LYS A 59 17.517 -4.185 -10.754 1.00 0.00 C ATOM 918 NZ LYS A 59 17.368 -5.327 -9.809 1.00 0.00 N ATOM 0 H LYS A 59 13.981 -3.493 -6.905 1.00 0.00 H new ATOM 0 HA LYS A 59 14.725 -1.981 -9.138 1.00 0.00 H new ATOM 0 HB2 LYS A 59 15.113 -4.497 -8.551 1.00 0.00 H new ATOM 0 HB3 LYS A 59 13.530 -4.769 -9.252 1.00 0.00 H new ATOM 0 HG2 LYS A 59 15.190 -5.060 -11.019 1.00 0.00 H new ATOM 0 HG3 LYS A 59 14.300 -3.589 -11.357 1.00 0.00 H new ATOM 0 HD2 LYS A 59 16.326 -2.508 -11.422 1.00 0.00 H new ATOM 0 HD3 LYS A 59 16.382 -2.690 -9.680 1.00 0.00 H new ATOM 0 HE2 LYS A 59 17.588 -4.554 -11.777 1.00 0.00 H new ATOM 0 HE3 LYS A 59 18.441 -3.645 -10.545 1.00 0.00 H new ATOM 0 HZ1 LYS A 59 18.192 -5.956 -9.891 1.00 0.00 H new ATOM 0 HZ2 LYS A 59 17.304 -4.966 -8.836 1.00 0.00 H new ATOM 0 HZ3 LYS A 59 16.504 -5.858 -10.039 1.00 0.00 H new ATOM 932 N GLU A 60 11.550 -2.771 -8.955 1.00 0.00 N ATOM 933 CA GLU A 60 10.261 -2.418 -9.508 1.00 0.00 C ATOM 934 C GLU A 60 10.124 -0.905 -9.486 1.00 0.00 C ATOM 935 O GLU A 60 9.828 -0.274 -10.511 1.00 0.00 O ATOM 936 CB GLU A 60 9.159 -3.027 -8.651 1.00 0.00 C ATOM 937 CG GLU A 60 9.145 -4.554 -8.780 1.00 0.00 C ATOM 938 CD GLU A 60 8.083 -5.153 -7.869 1.00 0.00 C ATOM 939 OE1 GLU A 60 7.739 -4.530 -6.889 1.00 0.00 O ATOM 940 OE2 GLU A 60 7.615 -6.226 -8.169 1.00 0.00 O ATOM 0 H GLU A 60 11.518 -3.388 -8.143 1.00 0.00 H new ATOM 0 HA GLU A 60 10.179 -2.792 -10.528 1.00 0.00 H new ATOM 0 HB2 GLU A 60 9.308 -2.748 -7.608 1.00 0.00 H new ATOM 0 HB3 GLU A 60 8.193 -2.624 -8.954 1.00 0.00 H new ATOM 0 HG2 GLU A 60 8.948 -4.836 -9.814 1.00 0.00 H new ATOM 0 HG3 GLU A 60 10.124 -4.956 -8.521 1.00 0.00 H new ATOM 947 N LEU A 61 10.486 -0.323 -8.358 1.00 0.00 N ATOM 948 CA LEU A 61 10.541 1.118 -8.233 1.00 0.00 C ATOM 949 C LEU A 61 11.599 1.685 -9.157 1.00 0.00 C ATOM 950 O LEU A 61 11.407 2.741 -9.753 1.00 0.00 O ATOM 951 CB LEU A 61 10.824 1.522 -6.786 1.00 0.00 C ATOM 952 CG LEU A 61 9.523 1.521 -5.960 1.00 0.00 C ATOM 953 CD1 LEU A 61 8.710 2.784 -6.251 1.00 0.00 C ATOM 954 CD2 LEU A 61 8.676 0.280 -6.277 1.00 0.00 C ATOM 0 H LEU A 61 10.747 -0.830 -7.513 1.00 0.00 H new ATOM 0 HA LEU A 61 9.572 1.527 -8.520 1.00 0.00 H new ATOM 0 HB2 LEU A 61 11.543 0.832 -6.344 1.00 0.00 H new ATOM 0 HB3 LEU A 61 11.277 2.513 -6.761 1.00 0.00 H new ATOM 0 HG LEU A 61 9.793 1.501 -4.904 1.00 0.00 H new ATOM 0 HD11 LEU A 61 7.794 2.771 -5.661 1.00 0.00 H new ATOM 0 HD12 LEU A 61 9.298 3.664 -5.988 1.00 0.00 H new ATOM 0 HD13 LEU A 61 8.459 2.819 -7.311 1.00 0.00 H new ATOM 0 HD21 LEU A 61 7.763 0.301 -5.682 1.00 0.00 H new ATOM 0 HD22 LEU A 61 8.419 0.276 -7.336 1.00 0.00 H new ATOM 0 HD23 LEU A 61 9.244 -0.619 -6.038 1.00 0.00 H new ATOM 966 N ASP A 62 12.732 1.002 -9.239 1.00 0.00 N ATOM 967 CA ASP A 62 13.845 1.460 -10.060 1.00 0.00 C ATOM 968 C ASP A 62 13.409 1.536 -11.510 1.00 0.00 C ATOM 969 O ASP A 62 13.703 2.509 -12.206 1.00 0.00 O ATOM 970 CB ASP A 62 15.054 0.522 -9.911 1.00 0.00 C ATOM 971 CG ASP A 62 16.331 1.204 -10.373 1.00 0.00 C ATOM 972 OD1 ASP A 62 16.493 2.382 -10.095 1.00 0.00 O ATOM 973 OD2 ASP A 62 17.145 0.538 -10.973 1.00 0.00 O ATOM 0 H ASP A 62 12.905 0.126 -8.746 1.00 0.00 H new ATOM 0 HA ASP A 62 14.146 2.452 -9.724 1.00 0.00 H new ATOM 0 HB2 ASP A 62 15.156 0.217 -8.870 1.00 0.00 H new ATOM 0 HB3 ASP A 62 14.890 -0.384 -10.494 1.00 0.00 H new ATOM 978 N GLU A 63 12.609 0.560 -11.926 1.00 0.00 N ATOM 979 CA GLU A 63 12.001 0.585 -13.254 1.00 0.00 C ATOM 980 C GLU A 63 11.081 1.771 -13.316 1.00 0.00 C ATOM 981 O GLU A 63 11.088 2.541 -14.277 1.00 0.00 O ATOM 982 CB GLU A 63 11.153 -0.669 -13.458 1.00 0.00 C ATOM 983 CG GLU A 63 12.034 -1.918 -13.527 1.00 0.00 C ATOM 984 CD GLU A 63 11.175 -3.170 -13.602 1.00 0.00 C ATOM 985 OE1 GLU A 63 9.963 -3.043 -13.622 1.00 0.00 O ATOM 986 OE2 GLU A 63 11.734 -4.241 -13.645 1.00 0.00 O ATOM 0 H GLU A 63 12.366 -0.257 -11.365 1.00 0.00 H new ATOM 0 HA GLU A 63 12.780 0.635 -14.015 1.00 0.00 H new ATOM 0 HB2 GLU A 63 10.439 -0.767 -12.640 1.00 0.00 H new ATOM 0 HB3 GLU A 63 10.574 -0.576 -14.377 1.00 0.00 H new ATOM 0 HG2 GLU A 63 12.685 -1.863 -14.399 1.00 0.00 H new ATOM 0 HG3 GLU A 63 12.679 -1.964 -12.650 1.00 0.00 H new ATOM 993 N ASN A 64 10.330 1.960 -12.249 1.00 0.00 N ATOM 994 CA ASN A 64 9.410 3.080 -12.162 1.00 0.00 C ATOM 995 C ASN A 64 10.177 4.377 -11.918 1.00 0.00 C ATOM 996 O ASN A 64 9.761 5.240 -11.133 1.00 0.00 O ATOM 997 CB ASN A 64 8.349 2.842 -11.070 1.00 0.00 C ATOM 998 CG ASN A 64 7.026 3.469 -11.498 1.00 0.00 C ATOM 999 OD1 ASN A 64 7.008 4.342 -12.364 1.00 0.00 O ATOM 1000 ND2 ASN A 64 5.923 3.082 -10.955 1.00 0.00 N ATOM 0 H ASN A 64 10.338 1.353 -11.429 1.00 0.00 H new ATOM 0 HA ASN A 64 8.884 3.169 -13.112 1.00 0.00 H new ATOM 0 HB2 ASN A 64 8.219 1.773 -10.902 1.00 0.00 H new ATOM 0 HB3 ASN A 64 8.680 3.275 -10.126 1.00 0.00 H new ATOM 0 HD21 ASN A 64 5.038 3.500 -11.244 1.00 0.00 H new ATOM 0 HD22 ASN A 64 5.935 2.358 -10.236 1.00 0.00 H new ATOM 1007 N GLY A 65 11.345 4.480 -12.532 1.00 0.00 N ATOM 1008 CA GLY A 65 12.193 5.656 -12.408 1.00 0.00 C ATOM 1009 C GLY A 65 12.036 6.526 -13.630 1.00 0.00 C ATOM 1010 O GLY A 65 12.624 7.606 -13.726 1.00 0.00 O ATOM 0 H GLY A 65 11.732 3.751 -13.131 1.00 0.00 H new ATOM 0 HA2 GLY A 65 11.925 6.217 -11.513 1.00 0.00 H new ATOM 0 HA3 GLY A 65 13.235 5.355 -12.295 1.00 0.00 H new ATOM 1014 N ASP A 66 11.253 6.033 -14.571 1.00 0.00 N ATOM 1015 CA ASP A 66 11.028 6.703 -15.837 1.00 0.00 C ATOM 1016 C ASP A 66 10.383 8.053 -15.612 1.00 0.00 C ATOM 1017 O ASP A 66 10.757 9.053 -16.239 1.00 0.00 O ATOM 1018 CB ASP A 66 10.130 5.825 -16.711 1.00 0.00 C ATOM 1019 CG ASP A 66 10.888 4.606 -17.208 1.00 0.00 C ATOM 1020 OD1 ASP A 66 12.083 4.545 -17.010 1.00 0.00 O ATOM 1021 OD2 ASP A 66 10.266 3.740 -17.776 1.00 0.00 O ATOM 0 H ASP A 66 10.752 5.150 -14.477 1.00 0.00 H new ATOM 0 HA ASP A 66 11.983 6.863 -16.338 1.00 0.00 H new ATOM 0 HB2 ASP A 66 9.257 5.508 -16.141 1.00 0.00 H new ATOM 0 HB3 ASP A 66 9.764 6.402 -17.560 1.00 0.00 H new ATOM 1026 N GLY A 67 9.456 8.087 -14.686 1.00 0.00 N ATOM 1027 CA GLY A 67 8.794 9.314 -14.292 1.00 0.00 C ATOM 1028 C GLY A 67 8.860 9.455 -12.783 1.00 0.00 C ATOM 1029 O GLY A 67 9.857 9.072 -12.158 1.00 0.00 O ATOM 0 H GLY A 67 9.135 7.262 -14.180 1.00 0.00 H new ATOM 0 HA2 GLY A 67 9.272 10.169 -14.770 1.00 0.00 H new ATOM 0 HA3 GLY A 67 7.756 9.303 -14.623 1.00 0.00 H new ATOM 1033 N GLU A 68 7.789 9.931 -12.199 1.00 0.00 N ATOM 1034 CA GLU A 68 7.698 10.054 -10.748 1.00 0.00 C ATOM 1035 C GLU A 68 7.108 8.782 -10.178 1.00 0.00 C ATOM 1036 O GLU A 68 6.614 7.933 -10.930 1.00 0.00 O ATOM 1037 CB GLU A 68 6.795 11.240 -10.365 1.00 0.00 C ATOM 1038 CG GLU A 68 7.373 12.536 -10.937 1.00 0.00 C ATOM 1039 CD GLU A 68 7.188 12.566 -12.444 1.00 0.00 C ATOM 1040 OE1 GLU A 68 6.109 12.239 -12.899 1.00 0.00 O ATOM 1041 OE2 GLU A 68 8.127 12.897 -13.121 1.00 0.00 O ATOM 0 H GLU A 68 6.958 10.244 -12.701 1.00 0.00 H new ATOM 0 HA GLU A 68 8.697 10.222 -10.345 1.00 0.00 H new ATOM 0 HB2 GLU A 68 5.787 11.080 -10.748 1.00 0.00 H new ATOM 0 HB3 GLU A 68 6.716 11.314 -9.280 1.00 0.00 H new ATOM 0 HG2 GLU A 68 6.878 13.395 -10.484 1.00 0.00 H new ATOM 0 HG3 GLU A 68 8.432 12.611 -10.691 1.00 0.00 H new ATOM 1048 N VAL A 69 7.043 8.701 -8.865 1.00 0.00 N ATOM 1049 CA VAL A 69 6.396 7.580 -8.200 1.00 0.00 C ATOM 1050 C VAL A 69 5.219 8.106 -7.393 1.00 0.00 C ATOM 1051 O VAL A 69 5.321 9.151 -6.743 1.00 0.00 O ATOM 1052 CB VAL A 69 7.413 6.810 -7.310 1.00 0.00 C ATOM 1053 CG1 VAL A 69 8.257 7.782 -6.493 1.00 0.00 C ATOM 1054 CG2 VAL A 69 6.695 5.840 -6.359 1.00 0.00 C ATOM 0 H VAL A 69 7.431 9.400 -8.231 1.00 0.00 H new ATOM 0 HA VAL A 69 6.025 6.870 -8.939 1.00 0.00 H new ATOM 0 HB VAL A 69 8.061 6.238 -7.975 1.00 0.00 H new ATOM 0 HG11 VAL A 69 8.962 7.223 -5.877 1.00 0.00 H new ATOM 0 HG12 VAL A 69 8.806 8.441 -7.165 1.00 0.00 H new ATOM 0 HG13 VAL A 69 7.607 8.377 -5.851 1.00 0.00 H new ATOM 0 HG21 VAL A 69 7.431 5.316 -5.750 1.00 0.00 H new ATOM 0 HG22 VAL A 69 6.019 6.399 -5.711 1.00 0.00 H new ATOM 0 HG23 VAL A 69 6.124 5.116 -6.941 1.00 0.00 H new ATOM 1064 N ASP A 70 4.071 7.470 -7.552 1.00 0.00 N ATOM 1065 CA ASP A 70 2.858 7.930 -6.901 1.00 0.00 C ATOM 1066 C ASP A 70 2.654 7.213 -5.587 1.00 0.00 C ATOM 1067 O ASP A 70 3.470 6.374 -5.181 1.00 0.00 O ATOM 1068 CB ASP A 70 1.631 7.734 -7.798 1.00 0.00 C ATOM 1069 CG ASP A 70 0.930 6.436 -7.465 1.00 0.00 C ATOM 1070 OD1 ASP A 70 1.491 5.403 -7.731 1.00 0.00 O ATOM 1071 OD2 ASP A 70 -0.168 6.498 -6.940 1.00 0.00 O ATOM 0 H ASP A 70 3.954 6.635 -8.126 1.00 0.00 H new ATOM 0 HA ASP A 70 2.974 8.997 -6.711 1.00 0.00 H new ATOM 0 HB2 ASP A 70 0.942 8.569 -7.669 1.00 0.00 H new ATOM 0 HB3 ASP A 70 1.936 7.731 -8.845 1.00 0.00 H new ATOM 1076 N PHE A 71 1.547 7.505 -4.950 1.00 0.00 N ATOM 1077 CA PHE A 71 1.212 6.877 -3.694 1.00 0.00 C ATOM 1078 C PHE A 71 1.082 5.369 -3.876 1.00 0.00 C ATOM 1079 O PHE A 71 1.598 4.589 -3.068 1.00 0.00 O ATOM 1080 CB PHE A 71 -0.091 7.454 -3.122 1.00 0.00 C ATOM 1081 CG PHE A 71 -0.289 6.932 -1.717 1.00 0.00 C ATOM 1082 CD1 PHE A 71 0.612 7.304 -0.720 1.00 0.00 C ATOM 1083 CD2 PHE A 71 -1.364 6.089 -1.408 1.00 0.00 C ATOM 1084 CE1 PHE A 71 0.445 6.840 0.583 1.00 0.00 C ATOM 1085 CE2 PHE A 71 -1.528 5.623 -0.101 1.00 0.00 C ATOM 1086 CZ PHE A 71 -0.627 5.999 0.894 1.00 0.00 C ATOM 0 H PHE A 71 0.857 8.179 -5.283 1.00 0.00 H new ATOM 0 HA PHE A 71 2.016 7.081 -2.987 1.00 0.00 H new ATOM 0 HB2 PHE A 71 -0.049 8.543 -3.116 1.00 0.00 H new ATOM 0 HB3 PHE A 71 -0.935 7.171 -3.751 1.00 0.00 H new ATOM 0 HD1 PHE A 71 1.441 7.953 -0.958 1.00 0.00 H new ATOM 0 HD2 PHE A 71 -2.064 5.800 -2.178 1.00 0.00 H new ATOM 0 HE1 PHE A 71 1.144 7.130 1.353 1.00 0.00 H new ATOM 0 HE2 PHE A 71 -2.354 4.970 0.139 1.00 0.00 H new ATOM 0 HZ PHE A 71 -0.757 5.641 1.904 1.00 0.00 H new ATOM 1096 N GLN A 72 0.400 4.966 -4.943 1.00 0.00 N ATOM 1097 CA GLN A 72 0.185 3.552 -5.228 1.00 0.00 C ATOM 1098 C GLN A 72 1.515 2.839 -5.435 1.00 0.00 C ATOM 1099 O GLN A 72 1.736 1.754 -4.899 1.00 0.00 O ATOM 1100 CB GLN A 72 -0.716 3.390 -6.462 1.00 0.00 C ATOM 1101 CG GLN A 72 -2.116 3.902 -6.131 1.00 0.00 C ATOM 1102 CD GLN A 72 -3.012 3.806 -7.356 1.00 0.00 C ATOM 1103 OE1 GLN A 72 -3.677 2.793 -7.556 1.00 0.00 O ATOM 1104 NE2 GLN A 72 -3.066 4.795 -8.194 1.00 0.00 N ATOM 0 H GLN A 72 -0.014 5.600 -5.626 1.00 0.00 H new ATOM 0 HA GLN A 72 -0.314 3.097 -4.373 1.00 0.00 H new ATOM 0 HB2 GLN A 72 -0.303 3.944 -7.304 1.00 0.00 H new ATOM 0 HB3 GLN A 72 -0.760 2.343 -6.760 1.00 0.00 H new ATOM 0 HG2 GLN A 72 -2.541 3.319 -5.314 1.00 0.00 H new ATOM 0 HG3 GLN A 72 -2.062 4.936 -5.791 1.00 0.00 H new ATOM 0 HE21 GLN A 72 -2.513 5.636 -8.027 1.00 0.00 H new ATOM 0 HE22 GLN A 72 -3.661 4.732 -9.020 1.00 0.00 H new ATOM 1113 N GLU A 73 2.420 3.471 -6.151 1.00 0.00 N ATOM 1114 CA GLU A 73 3.760 2.926 -6.303 1.00 0.00 C ATOM 1115 C GLU A 73 4.520 3.024 -4.980 1.00 0.00 C ATOM 1116 O GLU A 73 5.288 2.133 -4.608 1.00 0.00 O ATOM 1117 CB GLU A 73 4.506 3.660 -7.413 1.00 0.00 C ATOM 1118 CG GLU A 73 3.851 3.328 -8.756 1.00 0.00 C ATOM 1119 CD GLU A 73 4.027 1.851 -9.078 1.00 0.00 C ATOM 1120 OE1 GLU A 73 5.149 1.410 -9.139 1.00 0.00 O ATOM 1121 OE2 GLU A 73 3.041 1.177 -9.248 1.00 0.00 O ATOM 0 H GLU A 73 2.259 4.355 -6.634 1.00 0.00 H new ATOM 0 HA GLU A 73 3.686 1.874 -6.580 1.00 0.00 H new ATOM 0 HB2 GLU A 73 4.480 4.735 -7.237 1.00 0.00 H new ATOM 0 HB3 GLU A 73 5.555 3.364 -7.422 1.00 0.00 H new ATOM 0 HG2 GLU A 73 2.790 3.576 -8.722 1.00 0.00 H new ATOM 0 HG3 GLU A 73 4.295 3.935 -9.545 1.00 0.00 H new ATOM 1128 N TYR A 74 4.305 4.120 -4.277 1.00 0.00 N ATOM 1129 CA TYR A 74 4.951 4.349 -2.990 1.00 0.00 C ATOM 1130 C TYR A 74 4.563 3.287 -1.961 1.00 0.00 C ATOM 1131 O TYR A 74 5.432 2.731 -1.283 1.00 0.00 O ATOM 1132 CB TYR A 74 4.619 5.762 -2.479 1.00 0.00 C ATOM 1133 CG TYR A 74 5.102 5.950 -1.054 1.00 0.00 C ATOM 1134 CD1 TYR A 74 6.465 5.879 -0.749 1.00 0.00 C ATOM 1135 CD2 TYR A 74 4.175 6.211 -0.040 1.00 0.00 C ATOM 1136 CE1 TYR A 74 6.897 6.063 0.569 1.00 0.00 C ATOM 1137 CE2 TYR A 74 4.606 6.399 1.274 1.00 0.00 C ATOM 1138 CZ TYR A 74 5.966 6.324 1.578 1.00 0.00 C ATOM 1139 OH TYR A 74 6.389 6.504 2.874 1.00 0.00 O ATOM 0 H TYR A 74 3.684 4.873 -4.575 1.00 0.00 H new ATOM 0 HA TYR A 74 6.028 4.270 -3.135 1.00 0.00 H new ATOM 0 HB2 TYR A 74 5.084 6.506 -3.126 1.00 0.00 H new ATOM 0 HB3 TYR A 74 3.543 5.927 -2.527 1.00 0.00 H new ATOM 0 HD1 TYR A 74 7.184 5.682 -1.531 1.00 0.00 H new ATOM 0 HD2 TYR A 74 3.122 6.267 -0.274 1.00 0.00 H new ATOM 0 HE1 TYR A 74 7.949 6.003 0.806 1.00 0.00 H new ATOM 0 HE2 TYR A 74 3.888 6.602 2.055 1.00 0.00 H new ATOM 0 HH TYR A 74 5.615 6.677 3.450 1.00 0.00 H new ATOM 1149 N VAL A 75 3.264 3.012 -1.828 1.00 0.00 N ATOM 1150 CA VAL A 75 2.811 2.056 -0.822 1.00 0.00 C ATOM 1151 C VAL A 75 3.345 0.645 -1.075 1.00 0.00 C ATOM 1152 O VAL A 75 3.729 -0.056 -0.134 1.00 0.00 O ATOM 1153 CB VAL A 75 1.281 2.048 -0.677 1.00 0.00 C ATOM 1154 CG1 VAL A 75 0.814 3.375 -0.075 1.00 0.00 C ATOM 1155 CG2 VAL A 75 0.619 1.849 -2.037 1.00 0.00 C ATOM 0 H VAL A 75 2.523 3.428 -2.392 1.00 0.00 H new ATOM 0 HA VAL A 75 3.230 2.396 0.125 1.00 0.00 H new ATOM 0 HB VAL A 75 0.997 1.226 -0.020 1.00 0.00 H new ATOM 0 HG11 VAL A 75 -0.271 3.367 0.027 1.00 0.00 H new ATOM 0 HG12 VAL A 75 1.269 3.510 0.906 1.00 0.00 H new ATOM 0 HG13 VAL A 75 1.111 4.195 -0.728 1.00 0.00 H new ATOM 0 HG21 VAL A 75 -0.464 1.846 -1.917 1.00 0.00 H new ATOM 0 HG22 VAL A 75 0.908 2.661 -2.705 1.00 0.00 H new ATOM 0 HG23 VAL A 75 0.940 0.898 -2.462 1.00 0.00 H new ATOM 1165 N VAL A 76 3.366 0.223 -2.331 1.00 0.00 N ATOM 1166 CA VAL A 76 3.844 -1.103 -2.648 1.00 0.00 C ATOM 1167 C VAL A 76 5.315 -1.239 -2.294 1.00 0.00 C ATOM 1168 O VAL A 76 5.735 -2.264 -1.766 1.00 0.00 O ATOM 1169 CB VAL A 76 3.566 -1.473 -4.122 1.00 0.00 C ATOM 1170 CG1 VAL A 76 4.266 -0.499 -5.071 1.00 0.00 C ATOM 1171 CG2 VAL A 76 4.053 -2.899 -4.404 1.00 0.00 C ATOM 0 H VAL A 76 3.061 0.775 -3.133 1.00 0.00 H new ATOM 0 HA VAL A 76 3.289 -1.817 -2.040 1.00 0.00 H new ATOM 0 HB VAL A 76 2.491 -1.412 -4.290 1.00 0.00 H new ATOM 0 HG11 VAL A 76 4.055 -0.781 -6.103 1.00 0.00 H new ATOM 0 HG12 VAL A 76 3.901 0.512 -4.889 1.00 0.00 H new ATOM 0 HG13 VAL A 76 5.342 -0.533 -4.899 1.00 0.00 H new ATOM 0 HG21 VAL A 76 3.853 -3.152 -5.445 1.00 0.00 H new ATOM 0 HG22 VAL A 76 5.125 -2.962 -4.214 1.00 0.00 H new ATOM 0 HG23 VAL A 76 3.528 -3.598 -3.753 1.00 0.00 H new ATOM 1181 N LEU A 77 6.088 -0.183 -2.540 1.00 0.00 N ATOM 1182 CA LEU A 77 7.514 -0.219 -2.229 1.00 0.00 C ATOM 1183 C LEU A 77 7.724 -0.431 -0.734 1.00 0.00 C ATOM 1184 O LEU A 77 8.461 -1.335 -0.322 1.00 0.00 O ATOM 1185 CB LEU A 77 8.173 1.102 -2.656 1.00 0.00 C ATOM 1186 CG LEU A 77 9.674 1.099 -2.292 1.00 0.00 C ATOM 1187 CD1 LEU A 77 10.395 -0.063 -2.972 1.00 0.00 C ATOM 1188 CD2 LEU A 77 10.317 2.426 -2.711 1.00 0.00 C ATOM 0 H LEU A 77 5.758 0.693 -2.946 1.00 0.00 H new ATOM 0 HA LEU A 77 7.969 -1.047 -2.773 1.00 0.00 H new ATOM 0 HB2 LEU A 77 8.053 1.245 -3.730 1.00 0.00 H new ATOM 0 HB3 LEU A 77 7.675 1.939 -2.166 1.00 0.00 H new ATOM 0 HG LEU A 77 9.765 0.978 -1.213 1.00 0.00 H new ATOM 0 HD11 LEU A 77 11.451 -0.045 -2.701 1.00 0.00 H new ATOM 0 HD12 LEU A 77 9.953 -1.005 -2.648 1.00 0.00 H new ATOM 0 HD13 LEU A 77 10.296 0.030 -4.053 1.00 0.00 H new ATOM 0 HD21 LEU A 77 11.375 2.416 -2.451 1.00 0.00 H new ATOM 0 HD22 LEU A 77 10.209 2.559 -3.788 1.00 0.00 H new ATOM 0 HD23 LEU A 77 9.824 3.249 -2.193 1.00 0.00 H new ATOM 1200 N VAL A 78 7.013 0.335 0.077 1.00 0.00 N ATOM 1201 CA VAL A 78 7.099 0.154 1.515 1.00 0.00 C ATOM 1202 C VAL A 78 6.454 -1.157 1.941 1.00 0.00 C ATOM 1203 O VAL A 78 7.004 -1.908 2.756 1.00 0.00 O ATOM 1204 CB VAL A 78 6.523 1.363 2.286 1.00 0.00 C ATOM 1205 CG1 VAL A 78 7.372 2.602 2.008 1.00 0.00 C ATOM 1206 CG2 VAL A 78 5.086 1.654 1.850 1.00 0.00 C ATOM 0 H VAL A 78 6.381 1.075 -0.229 1.00 0.00 H new ATOM 0 HA VAL A 78 8.156 0.098 1.776 1.00 0.00 H new ATOM 0 HB VAL A 78 6.535 1.122 3.349 1.00 0.00 H new ATOM 0 HG11 VAL A 78 6.963 3.453 2.553 1.00 0.00 H new ATOM 0 HG12 VAL A 78 8.397 2.421 2.333 1.00 0.00 H new ATOM 0 HG13 VAL A 78 7.363 2.817 0.939 1.00 0.00 H new ATOM 0 HG21 VAL A 78 4.703 2.509 2.407 1.00 0.00 H new ATOM 0 HG22 VAL A 78 5.068 1.878 0.783 1.00 0.00 H new ATOM 0 HG23 VAL A 78 4.462 0.783 2.049 1.00 0.00 H new ATOM 1216 N ALA A 79 5.304 -1.458 1.359 1.00 0.00 N ATOM 1217 CA ALA A 79 4.600 -2.682 1.689 1.00 0.00 C ATOM 1218 C ALA A 79 5.421 -3.887 1.303 1.00 0.00 C ATOM 1219 O ALA A 79 5.486 -4.870 2.043 1.00 0.00 O ATOM 1220 CB ALA A 79 3.262 -2.737 0.972 1.00 0.00 C ATOM 0 H ALA A 79 4.843 -0.875 0.661 1.00 0.00 H new ATOM 0 HA ALA A 79 4.432 -2.692 2.766 1.00 0.00 H new ATOM 0 HB1 ALA A 79 2.748 -3.662 1.232 1.00 0.00 H new ATOM 0 HB2 ALA A 79 2.652 -1.886 1.274 1.00 0.00 H new ATOM 0 HB3 ALA A 79 3.425 -2.702 -0.105 1.00 0.00 H new ATOM 1226 N ALA A 80 6.042 -3.805 0.139 1.00 0.00 N ATOM 1227 CA ALA A 80 6.849 -4.882 -0.374 1.00 0.00 C ATOM 1228 C ALA A 80 7.956 -5.211 0.605 1.00 0.00 C ATOM 1229 O ALA A 80 8.122 -6.364 1.008 1.00 0.00 O ATOM 1230 CB ALA A 80 7.437 -4.486 -1.719 1.00 0.00 C ATOM 0 H ALA A 80 5.997 -2.989 -0.471 1.00 0.00 H new ATOM 0 HA ALA A 80 6.226 -5.766 -0.506 1.00 0.00 H new ATOM 0 HB1 ALA A 80 8.047 -5.303 -2.104 1.00 0.00 H new ATOM 0 HB2 ALA A 80 6.630 -4.274 -2.420 1.00 0.00 H new ATOM 0 HB3 ALA A 80 8.056 -3.597 -1.598 1.00 0.00 H new ATOM 1236 N LEU A 81 8.649 -4.184 1.061 1.00 0.00 N ATOM 1237 CA LEU A 81 9.667 -4.366 2.074 1.00 0.00 C ATOM 1238 C LEU A 81 9.032 -4.879 3.357 1.00 0.00 C ATOM 1239 O LEU A 81 9.577 -5.769 4.024 1.00 0.00 O ATOM 1240 CB LEU A 81 10.419 -3.054 2.335 1.00 0.00 C ATOM 1241 CG LEU A 81 11.280 -2.693 1.110 1.00 0.00 C ATOM 1242 CD1 LEU A 81 11.833 -1.274 1.266 1.00 0.00 C ATOM 1243 CD2 LEU A 81 12.457 -3.673 0.989 1.00 0.00 C ATOM 0 H LEU A 81 8.525 -3.221 0.747 1.00 0.00 H new ATOM 0 HA LEU A 81 10.388 -5.101 1.715 1.00 0.00 H new ATOM 0 HB2 LEU A 81 9.710 -2.253 2.541 1.00 0.00 H new ATOM 0 HB3 LEU A 81 11.051 -3.156 3.218 1.00 0.00 H new ATOM 0 HG LEU A 81 10.659 -2.753 0.216 1.00 0.00 H new ATOM 0 HD11 LEU A 81 12.441 -1.023 0.397 1.00 0.00 H new ATOM 0 HD12 LEU A 81 11.006 -0.568 1.346 1.00 0.00 H new ATOM 0 HD13 LEU A 81 12.446 -1.219 2.166 1.00 0.00 H new ATOM 0 HD21 LEU A 81 13.061 -3.411 0.120 1.00 0.00 H new ATOM 0 HD22 LEU A 81 13.071 -3.617 1.888 1.00 0.00 H new ATOM 0 HD23 LEU A 81 12.075 -4.687 0.873 1.00 0.00 H new ATOM 1255 N THR A 82 7.880 -4.313 3.706 1.00 0.00 N ATOM 1256 CA THR A 82 7.185 -4.711 4.911 1.00 0.00 C ATOM 1257 C THR A 82 6.774 -6.182 4.856 1.00 0.00 C ATOM 1258 O THR A 82 7.092 -6.949 5.761 1.00 0.00 O ATOM 1259 CB THR A 82 5.955 -3.822 5.125 1.00 0.00 C ATOM 1260 OG1 THR A 82 6.330 -2.457 5.014 1.00 0.00 O ATOM 1261 CG2 THR A 82 5.345 -4.075 6.509 1.00 0.00 C ATOM 0 H THR A 82 7.415 -3.581 3.169 1.00 0.00 H new ATOM 0 HA THR A 82 7.867 -4.587 5.752 1.00 0.00 H new ATOM 0 HB THR A 82 5.212 -4.062 4.364 1.00 0.00 H new ATOM 0 HG1 THR A 82 6.094 -2.124 4.123 1.00 0.00 H new ATOM 0 HG21 THR A 82 4.473 -3.436 6.645 1.00 0.00 H new ATOM 0 HG22 THR A 82 5.045 -5.120 6.589 1.00 0.00 H new ATOM 0 HG23 THR A 82 6.083 -3.850 7.279 1.00 0.00 H new ATOM 1269 N VAL A 83 6.106 -6.586 3.775 1.00 0.00 N ATOM 1270 CA VAL A 83 5.670 -7.981 3.659 1.00 0.00 C ATOM 1271 C VAL A 83 6.862 -8.907 3.619 1.00 0.00 C ATOM 1272 O VAL A 83 6.893 -9.924 4.317 1.00 0.00 O ATOM 1273 CB VAL A 83 4.752 -8.200 2.428 1.00 0.00 C ATOM 1274 CG1 VAL A 83 5.481 -7.860 1.131 1.00 0.00 C ATOM 1275 CG2 VAL A 83 4.271 -9.657 2.366 1.00 0.00 C ATOM 0 H VAL A 83 5.859 -5.988 2.987 1.00 0.00 H new ATOM 0 HA VAL A 83 5.079 -8.216 4.544 1.00 0.00 H new ATOM 0 HB VAL A 83 3.894 -7.537 2.538 1.00 0.00 H new ATOM 0 HG11 VAL A 83 4.813 -8.023 0.285 1.00 0.00 H new ATOM 0 HG12 VAL A 83 5.792 -6.816 1.152 1.00 0.00 H new ATOM 0 HG13 VAL A 83 6.359 -8.498 1.029 1.00 0.00 H new ATOM 0 HG21 VAL A 83 3.628 -9.791 1.496 1.00 0.00 H new ATOM 0 HG22 VAL A 83 5.132 -10.321 2.287 1.00 0.00 H new ATOM 0 HG23 VAL A 83 3.711 -9.894 3.271 1.00 0.00 H new ATOM 1285 N ALA A 84 7.874 -8.525 2.854 1.00 0.00 N ATOM 1286 CA ALA A 84 9.057 -9.340 2.748 1.00 0.00 C ATOM 1287 C ALA A 84 9.618 -9.642 4.123 1.00 0.00 C ATOM 1288 O ALA A 84 9.804 -10.804 4.474 1.00 0.00 O ATOM 1289 CB ALA A 84 10.116 -8.639 1.895 1.00 0.00 C ATOM 0 H ALA A 84 7.893 -7.665 2.306 1.00 0.00 H new ATOM 0 HA ALA A 84 8.783 -10.278 2.266 1.00 0.00 H new ATOM 0 HB1 ALA A 84 11.003 -9.269 1.826 1.00 0.00 H new ATOM 0 HB2 ALA A 84 9.719 -8.461 0.896 1.00 0.00 H new ATOM 0 HB3 ALA A 84 10.382 -7.687 2.355 1.00 0.00 H new ATOM 1295 N MET A 85 9.842 -8.610 4.924 1.00 0.00 N ATOM 1296 CA MET A 85 10.343 -8.839 6.266 1.00 0.00 C ATOM 1297 C MET A 85 9.244 -9.326 7.210 1.00 0.00 C ATOM 1298 O MET A 85 9.480 -10.195 8.047 1.00 0.00 O ATOM 1299 CB MET A 85 11.029 -7.607 6.852 1.00 0.00 C ATOM 1300 CG MET A 85 11.590 -7.986 8.233 1.00 0.00 C ATOM 1301 SD MET A 85 12.483 -6.602 8.960 1.00 0.00 S ATOM 1302 CE MET A 85 13.003 -7.465 10.466 1.00 0.00 C ATOM 0 H MET A 85 9.689 -7.633 4.675 1.00 0.00 H new ATOM 0 HA MET A 85 11.092 -9.626 6.173 1.00 0.00 H new ATOM 0 HB2 MET A 85 11.830 -7.269 6.195 1.00 0.00 H new ATOM 0 HB3 MET A 85 10.321 -6.783 6.942 1.00 0.00 H new ATOM 0 HG2 MET A 85 10.775 -8.286 8.892 1.00 0.00 H new ATOM 0 HG3 MET A 85 12.255 -8.844 8.138 1.00 0.00 H new ATOM 0 HE1 MET A 85 13.587 -6.788 11.090 1.00 0.00 H new ATOM 0 HE2 MET A 85 12.123 -7.798 11.017 1.00 0.00 H new ATOM 0 HE3 MET A 85 13.612 -8.329 10.199 1.00 0.00 H new ATOM 1312 N ASN A 86 8.072 -8.703 7.144 1.00 0.00 N ATOM 1313 CA ASN A 86 7.001 -9.030 8.086 1.00 0.00 C ATOM 1314 C ASN A 86 6.556 -10.469 7.948 1.00 0.00 C ATOM 1315 O ASN A 86 6.339 -11.153 8.943 1.00 0.00 O ATOM 1316 CB ASN A 86 5.802 -8.092 7.952 1.00 0.00 C ATOM 1317 CG ASN A 86 5.001 -8.126 9.246 1.00 0.00 C ATOM 1318 OD1 ASN A 86 4.304 -9.100 9.514 1.00 0.00 O ATOM 1319 ND2 ASN A 86 5.063 -7.130 10.068 1.00 0.00 N ATOM 0 H ASN A 86 7.839 -7.981 6.462 1.00 0.00 H new ATOM 0 HA ASN A 86 7.421 -8.892 9.082 1.00 0.00 H new ATOM 0 HB2 ASN A 86 6.139 -7.077 7.744 1.00 0.00 H new ATOM 0 HB3 ASN A 86 5.176 -8.398 7.113 1.00 0.00 H new ATOM 0 HD21 ASN A 86 4.533 -7.154 10.939 1.00 0.00 H new ATOM 0 HD22 ASN A 86 5.642 -6.320 9.846 1.00 0.00 H new ATOM 1326 N ASN A 87 6.473 -10.940 6.711 1.00 0.00 N ATOM 1327 CA ASN A 87 6.058 -12.311 6.442 1.00 0.00 C ATOM 1328 C ASN A 87 6.815 -13.279 7.350 1.00 0.00 C ATOM 1329 O ASN A 87 6.268 -14.296 7.781 1.00 0.00 O ATOM 1330 CB ASN A 87 6.297 -12.648 4.963 1.00 0.00 C ATOM 1331 CG ASN A 87 5.822 -14.065 4.593 1.00 0.00 C ATOM 1332 OD1 ASN A 87 5.622 -14.964 5.510 1.00 0.00 O flip ATOM 1333 ND2 ASN A 87 5.635 -14.359 3.402 1.00 0.00 N flip ATOM 0 H ASN A 87 6.688 -10.393 5.877 1.00 0.00 H new ATOM 0 HA ASN A 87 4.993 -12.411 6.652 1.00 0.00 H new ATOM 0 HB2 ASN A 87 5.777 -11.920 4.340 1.00 0.00 H new ATOM 0 HB3 ASN A 87 7.360 -12.556 4.741 1.00 0.00 H new ATOM 0 HD21 ASN A 87 5.789 -13.661 2.674 1.00 0.00 H new ATOM 0 HD22 ASN A 87 5.327 -15.299 3.151 1.00 0.00 H new ATOM 1340 N PHE A 88 8.052 -12.938 7.677 1.00 0.00 N ATOM 1341 CA PHE A 88 8.857 -13.775 8.560 1.00 0.00 C ATOM 1342 C PHE A 88 8.234 -13.857 9.946 1.00 0.00 C ATOM 1343 O PHE A 88 8.236 -14.911 10.562 1.00 0.00 O ATOM 1344 CB PHE A 88 10.302 -13.281 8.647 1.00 0.00 C ATOM 1345 CG PHE A 88 10.962 -13.476 7.307 1.00 0.00 C ATOM 1346 CD1 PHE A 88 11.242 -14.758 6.839 1.00 0.00 C ATOM 1347 CD2 PHE A 88 11.284 -12.370 6.532 1.00 0.00 C ATOM 1348 CE1 PHE A 88 11.844 -14.932 5.594 1.00 0.00 C ATOM 1349 CE2 PHE A 88 11.888 -12.538 5.288 1.00 0.00 C ATOM 1350 CZ PHE A 88 12.169 -13.818 4.816 1.00 0.00 C ATOM 0 H PHE A 88 8.520 -12.094 7.348 1.00 0.00 H new ATOM 0 HA PHE A 88 8.877 -14.776 8.130 1.00 0.00 H new ATOM 0 HB2 PHE A 88 10.325 -12.229 8.930 1.00 0.00 H new ATOM 0 HB3 PHE A 88 10.843 -13.830 9.418 1.00 0.00 H new ATOM 0 HD1 PHE A 88 10.992 -15.618 7.442 1.00 0.00 H new ATOM 0 HD2 PHE A 88 11.066 -11.376 6.895 1.00 0.00 H new ATOM 0 HE1 PHE A 88 12.059 -15.926 5.231 1.00 0.00 H new ATOM 0 HE2 PHE A 88 12.139 -11.675 4.689 1.00 0.00 H new ATOM 0 HZ PHE A 88 12.637 -13.949 3.851 1.00 0.00 H new ATOM 1360 N PHE A 89 7.616 -12.768 10.391 1.00 0.00 N ATOM 1361 CA PHE A 89 6.911 -12.775 11.673 1.00 0.00 C ATOM 1362 C PHE A 89 5.797 -13.799 11.624 1.00 0.00 C ATOM 1363 O PHE A 89 5.533 -14.496 12.595 1.00 0.00 O ATOM 1364 CB PHE A 89 6.317 -11.393 11.994 1.00 0.00 C ATOM 1365 CG PHE A 89 7.385 -10.435 12.460 1.00 0.00 C ATOM 1366 CD1 PHE A 89 8.185 -9.769 11.530 1.00 0.00 C ATOM 1367 CD2 PHE A 89 7.570 -10.208 13.832 1.00 0.00 C ATOM 1368 CE1 PHE A 89 9.168 -8.875 11.963 1.00 0.00 C ATOM 1369 CE2 PHE A 89 8.554 -9.310 14.266 1.00 0.00 C ATOM 1370 CZ PHE A 89 9.354 -8.643 13.331 1.00 0.00 C ATOM 0 H PHE A 89 7.587 -11.879 9.892 1.00 0.00 H new ATOM 0 HA PHE A 89 7.626 -13.029 12.455 1.00 0.00 H new ATOM 0 HB2 PHE A 89 5.825 -10.991 11.108 1.00 0.00 H new ATOM 0 HB3 PHE A 89 5.553 -11.493 12.765 1.00 0.00 H new ATOM 0 HD1 PHE A 89 8.044 -9.945 10.474 1.00 0.00 H new ATOM 0 HD2 PHE A 89 6.954 -10.725 14.553 1.00 0.00 H new ATOM 0 HE1 PHE A 89 9.786 -8.362 11.241 1.00 0.00 H new ATOM 0 HE2 PHE A 89 8.695 -9.132 15.322 1.00 0.00 H new ATOM 0 HZ PHE A 89 10.113 -7.951 13.664 1.00 0.00 H new ATOM 1380 N TRP A 90 5.147 -13.901 10.483 1.00 0.00 N ATOM 1381 CA TRP A 90 4.075 -14.866 10.331 1.00 0.00 C ATOM 1382 C TRP A 90 4.663 -16.251 10.466 1.00 0.00 C ATOM 1383 O TRP A 90 4.117 -17.119 11.150 1.00 0.00 O ATOM 1384 CB TRP A 90 3.381 -14.714 8.967 1.00 0.00 C ATOM 1385 CG TRP A 90 3.157 -13.259 8.622 1.00 0.00 C ATOM 1386 CD1 TRP A 90 3.504 -12.189 9.385 1.00 0.00 C ATOM 1387 CD2 TRP A 90 2.536 -12.709 7.432 1.00 0.00 C ATOM 1388 NE1 TRP A 90 3.166 -11.043 8.724 1.00 0.00 N ATOM 1389 CE2 TRP A 90 2.560 -11.302 7.517 1.00 0.00 C ATOM 1390 CE3 TRP A 90 1.970 -13.293 6.294 1.00 0.00 C ATOM 1391 CZ2 TRP A 90 2.037 -10.504 6.507 1.00 0.00 C ATOM 1392 CZ3 TRP A 90 1.442 -12.494 5.274 1.00 0.00 C ATOM 1393 CH2 TRP A 90 1.477 -11.101 5.379 1.00 0.00 C ATOM 0 H TRP A 90 5.338 -13.336 9.656 1.00 0.00 H new ATOM 0 HA TRP A 90 3.322 -14.696 11.101 1.00 0.00 H new ATOM 0 HB2 TRP A 90 3.989 -15.184 8.193 1.00 0.00 H new ATOM 0 HB3 TRP A 90 2.425 -15.237 8.983 1.00 0.00 H new ATOM 0 HD1 TRP A 90 3.972 -12.237 10.357 1.00 0.00 H new ATOM 0 HE1 TRP A 90 3.342 -10.105 9.083 1.00 0.00 H new ATOM 0 HE3 TRP A 90 1.940 -14.369 6.202 1.00 0.00 H new ATOM 0 HZ2 TRP A 90 2.064 -9.428 6.595 1.00 0.00 H new ATOM 0 HZ3 TRP A 90 1.005 -12.956 4.401 1.00 0.00 H new ATOM 0 HH2 TRP A 90 1.071 -10.488 4.588 1.00 0.00 H new ATOM 1404 N GLU A 91 5.818 -16.425 9.855 1.00 0.00 N ATOM 1405 CA GLU A 91 6.556 -17.676 9.945 1.00 0.00 C ATOM 1406 C GLU A 91 7.149 -17.868 11.339 1.00 0.00 C ATOM 1407 O GLU A 91 7.087 -18.959 11.909 1.00 0.00 O ATOM 1408 CB GLU A 91 7.664 -17.700 8.911 1.00 0.00 C ATOM 1409 CG GLU A 91 7.032 -17.741 7.522 1.00 0.00 C ATOM 1410 CD GLU A 91 8.097 -17.792 6.451 1.00 0.00 C ATOM 1411 OE1 GLU A 91 8.994 -16.981 6.476 1.00 0.00 O ATOM 1412 OE2 GLU A 91 8.007 -18.664 5.623 1.00 0.00 O ATOM 0 H GLU A 91 6.272 -15.711 9.285 1.00 0.00 H new ATOM 0 HA GLU A 91 5.860 -18.492 9.753 1.00 0.00 H new ATOM 0 HB2 GLU A 91 8.296 -16.818 9.013 1.00 0.00 H new ATOM 0 HB3 GLU A 91 8.303 -18.570 9.062 1.00 0.00 H new ATOM 0 HG2 GLU A 91 6.383 -18.613 7.438 1.00 0.00 H new ATOM 0 HG3 GLU A 91 6.405 -16.861 7.376 1.00 0.00 H new ATOM 1419 N ASN A 92 7.714 -16.805 11.878 1.00 0.00 N ATOM 1420 CA ASN A 92 8.302 -16.830 13.206 1.00 0.00 C ATOM 1421 C ASN A 92 7.293 -16.345 14.205 1.00 0.00 C ATOM 1422 O ASN A 92 7.058 -15.148 14.333 1.00 0.00 O ATOM 1423 CB ASN A 92 9.537 -15.926 13.244 1.00 0.00 C ATOM 1424 CG ASN A 92 10.124 -15.901 14.646 1.00 0.00 C ATOM 1425 OD1 ASN A 92 9.945 -16.847 15.416 1.00 0.00 O ATOM 1426 ND2 ASN A 92 10.824 -14.884 15.027 1.00 0.00 N ATOM 0 H ASN A 92 7.779 -15.901 11.410 1.00 0.00 H new ATOM 0 HA ASN A 92 8.598 -17.850 13.451 1.00 0.00 H new ATOM 0 HB2 ASN A 92 10.283 -16.286 12.536 1.00 0.00 H new ATOM 0 HB3 ASN A 92 9.267 -14.916 12.936 1.00 0.00 H new ATOM 0 HD21 ASN A 92 11.228 -14.865 15.964 1.00 0.00 H new ATOM 0 HD22 ASN A 92 10.973 -14.100 14.391 1.00 0.00 H new ATOM 1433 N SER A 93 6.665 -17.271 14.876 1.00 0.00 N ATOM 1434 CA SER A 93 5.594 -16.948 15.778 1.00 0.00 C ATOM 1435 C SER A 93 5.358 -18.111 16.744 1.00 0.00 C ATOM 1436 O SER A 93 4.311 -18.171 17.333 1.00 0.00 O ATOM 1437 CB SER A 93 4.338 -16.651 14.940 1.00 0.00 C ATOM 1438 OG SER A 93 4.331 -15.273 14.562 1.00 0.00 O ATOM 1439 OXT SER A 93 6.242 -18.928 16.881 1.00 0.00 O ATOM 0 H SER A 93 6.880 -18.266 14.814 1.00 0.00 H new ATOM 0 HA SER A 93 5.843 -16.072 16.377 1.00 0.00 H new ATOM 0 HB2 SER A 93 4.323 -17.283 14.052 1.00 0.00 H new ATOM 0 HB3 SER A 93 3.441 -16.886 15.514 1.00 0.00 H new ATOM 0 HG SER A 93 5.177 -15.050 14.121 1.00 0.00 H new TER 1445 SER A 93 ATOM 1446 N GLY B 1 11.363 1.110 12.593 1.00 0.00 N ATOM 1447 CA GLY B 1 11.687 2.333 11.872 1.00 0.00 C ATOM 1448 C GLY B 1 10.648 3.410 12.128 1.00 0.00 C ATOM 1449 O GLY B 1 10.235 3.634 13.272 1.00 0.00 O ATOM 0 H1 GLY B 1 12.112 0.906 13.285 1.00 0.00 H new ATOM 0 H2 GLY B 1 10.456 1.229 13.088 1.00 0.00 H new ATOM 0 H3 GLY B 1 11.289 0.320 11.921 1.00 0.00 H new ATOM 0 HA2 GLY B 1 12.670 2.691 12.180 1.00 0.00 H new ATOM 0 HA3 GLY B 1 11.744 2.125 10.804 1.00 0.00 H new ATOM 1453 N SER B 2 10.223 4.072 11.067 1.00 0.00 N ATOM 1454 CA SER B 2 9.225 5.117 11.175 1.00 0.00 C ATOM 1455 C SER B 2 7.856 4.528 11.439 1.00 0.00 C ATOM 1456 O SER B 2 7.584 3.376 11.082 1.00 0.00 O ATOM 1457 CB SER B 2 9.190 5.956 9.904 1.00 0.00 C ATOM 1458 OG SER B 2 10.310 6.832 9.881 1.00 0.00 O ATOM 0 H SER B 2 10.556 3.902 10.118 1.00 0.00 H new ATOM 0 HA SER B 2 9.498 5.757 12.014 1.00 0.00 H new ATOM 0 HB2 SER B 2 9.204 5.308 9.028 1.00 0.00 H new ATOM 0 HB3 SER B 2 8.265 6.531 9.861 1.00 0.00 H new ATOM 0 HG SER B 2 10.031 7.711 9.551 1.00 0.00 H new ATOM 1464 N GLU B 3 6.974 5.348 11.982 1.00 0.00 N ATOM 1465 CA GLU B 3 5.599 4.949 12.248 1.00 0.00 C ATOM 1466 C GLU B 3 5.000 4.311 11.010 1.00 0.00 C ATOM 1467 O GLU B 3 4.034 3.555 11.091 1.00 0.00 O ATOM 1468 CB GLU B 3 4.771 6.180 12.630 1.00 0.00 C ATOM 1469 CG GLU B 3 5.386 6.863 13.860 1.00 0.00 C ATOM 1470 CD GLU B 3 6.537 7.751 13.443 1.00 0.00 C ATOM 1471 OE1 GLU B 3 6.282 8.841 12.995 1.00 0.00 O ATOM 1472 OE2 GLU B 3 7.662 7.323 13.556 1.00 0.00 O ATOM 0 H GLU B 3 7.188 6.308 12.251 1.00 0.00 H new ATOM 0 HA GLU B 3 5.590 4.231 13.068 1.00 0.00 H new ATOM 0 HB2 GLU B 3 4.736 6.879 11.794 1.00 0.00 H new ATOM 0 HB3 GLU B 3 3.743 5.886 12.843 1.00 0.00 H new ATOM 0 HG2 GLU B 3 4.628 7.455 14.373 1.00 0.00 H new ATOM 0 HG3 GLU B 3 5.735 6.110 14.567 1.00 0.00 H new ATOM 1479 N LEU B 4 5.625 4.567 9.871 1.00 0.00 N ATOM 1480 CA LEU B 4 5.182 3.989 8.633 1.00 0.00 C ATOM 1481 C LEU B 4 5.271 2.489 8.738 1.00 0.00 C ATOM 1482 O LEU B 4 4.351 1.781 8.343 1.00 0.00 O ATOM 1483 CB LEU B 4 6.072 4.440 7.483 1.00 0.00 C ATOM 1484 CG LEU B 4 5.952 5.951 7.278 1.00 0.00 C ATOM 1485 CD1 LEU B 4 6.868 6.378 6.137 1.00 0.00 C ATOM 1486 CD2 LEU B 4 4.508 6.342 6.952 1.00 0.00 C ATOM 0 H LEU B 4 6.441 5.174 9.789 1.00 0.00 H new ATOM 0 HA LEU B 4 4.157 4.309 8.443 1.00 0.00 H new ATOM 0 HB2 LEU B 4 7.109 4.176 7.692 1.00 0.00 H new ATOM 0 HB3 LEU B 4 5.788 3.919 6.569 1.00 0.00 H new ATOM 0 HG LEU B 4 6.246 6.455 8.199 1.00 0.00 H new ATOM 0 HD11 LEU B 4 6.785 7.455 5.988 1.00 0.00 H new ATOM 0 HD12 LEU B 4 7.899 6.124 6.383 1.00 0.00 H new ATOM 0 HD13 LEU B 4 6.576 5.861 5.223 1.00 0.00 H new ATOM 0 HD21 LEU B 4 4.446 7.421 6.810 1.00 0.00 H new ATOM 0 HD22 LEU B 4 4.192 5.837 6.039 1.00 0.00 H new ATOM 0 HD23 LEU B 4 3.856 6.046 7.774 1.00 0.00 H new ATOM 1498 N GLU B 5 6.350 2.004 9.344 1.00 0.00 N ATOM 1499 CA GLU B 5 6.505 0.577 9.529 1.00 0.00 C ATOM 1500 C GLU B 5 5.384 0.071 10.421 1.00 0.00 C ATOM 1501 O GLU B 5 4.695 -0.891 10.082 1.00 0.00 O ATOM 1502 CB GLU B 5 7.856 0.252 10.174 1.00 0.00 C ATOM 1503 CG GLU B 5 9.004 0.601 9.213 1.00 0.00 C ATOM 1504 CD GLU B 5 10.345 0.165 9.807 1.00 0.00 C ATOM 1505 OE1 GLU B 5 10.342 -0.418 10.877 1.00 0.00 O ATOM 1506 OE2 GLU B 5 11.356 0.401 9.179 1.00 0.00 O ATOM 0 H GLU B 5 7.115 2.572 9.708 1.00 0.00 H new ATOM 0 HA GLU B 5 6.464 0.089 8.555 1.00 0.00 H new ATOM 0 HB2 GLU B 5 7.967 0.812 11.103 1.00 0.00 H new ATOM 0 HB3 GLU B 5 7.898 -0.806 10.433 1.00 0.00 H new ATOM 0 HG2 GLU B 5 8.846 0.109 8.253 1.00 0.00 H new ATOM 0 HG3 GLU B 5 9.015 1.674 9.023 1.00 0.00 H new ATOM 1513 N THR B 6 5.101 0.823 11.474 1.00 0.00 N ATOM 1514 CA THR B 6 3.984 0.519 12.344 1.00 0.00 C ATOM 1515 C THR B 6 2.689 0.579 11.542 1.00 0.00 C ATOM 1516 O THR B 6 1.862 -0.343 11.589 1.00 0.00 O ATOM 1517 CB THR B 6 3.942 1.528 13.493 1.00 0.00 C ATOM 1518 OG1 THR B 6 5.254 1.669 14.031 1.00 0.00 O ATOM 1519 CG2 THR B 6 3.001 1.021 14.587 1.00 0.00 C ATOM 0 H THR B 6 5.634 1.650 11.744 1.00 0.00 H new ATOM 0 HA THR B 6 4.100 -0.483 12.758 1.00 0.00 H new ATOM 0 HB THR B 6 3.583 2.489 13.125 1.00 0.00 H new ATOM 0 HG1 THR B 6 5.238 2.315 14.767 1.00 0.00 H new ATOM 0 HG21 THR B 6 2.972 1.741 15.405 1.00 0.00 H new ATOM 0 HG22 THR B 6 1.999 0.898 14.177 1.00 0.00 H new ATOM 0 HG23 THR B 6 3.360 0.062 14.960 1.00 0.00 H new ATOM 1527 N ALA B 7 2.556 1.628 10.745 1.00 0.00 N ATOM 1528 CA ALA B 7 1.405 1.772 9.870 1.00 0.00 C ATOM 1529 C ALA B 7 1.328 0.576 8.934 1.00 0.00 C ATOM 1530 O ALA B 7 0.276 -0.060 8.803 1.00 0.00 O ATOM 1531 CB ALA B 7 1.507 3.070 9.057 1.00 0.00 C ATOM 0 H ALA B 7 3.231 2.391 10.687 1.00 0.00 H new ATOM 0 HA ALA B 7 0.501 1.817 10.477 1.00 0.00 H new ATOM 0 HB1 ALA B 7 0.637 3.162 8.407 1.00 0.00 H new ATOM 0 HB2 ALA B 7 1.545 3.922 9.735 1.00 0.00 H new ATOM 0 HB3 ALA B 7 2.412 3.049 8.450 1.00 0.00 H new ATOM 1537 N MET B 8 2.461 0.234 8.336 1.00 0.00 N ATOM 1538 CA MET B 8 2.527 -0.913 7.449 1.00 0.00 C ATOM 1539 C MET B 8 2.225 -2.190 8.220 1.00 0.00 C ATOM 1540 O MET B 8 1.414 -3.012 7.783 1.00 0.00 O ATOM 1541 CB MET B 8 3.901 -1.010 6.771 1.00 0.00 C ATOM 1542 CG MET B 8 4.147 0.239 5.919 1.00 0.00 C ATOM 1543 SD MET B 8 4.677 -0.258 4.268 1.00 0.00 S ATOM 1544 CE MET B 8 3.036 -0.630 3.614 1.00 0.00 C ATOM 0 H MET B 8 3.343 0.734 8.450 1.00 0.00 H new ATOM 0 HA MET B 8 1.776 -0.784 6.669 1.00 0.00 H new ATOM 0 HB2 MET B 8 4.683 -1.108 7.524 1.00 0.00 H new ATOM 0 HB3 MET B 8 3.947 -1.902 6.147 1.00 0.00 H new ATOM 0 HG2 MET B 8 3.237 0.835 5.857 1.00 0.00 H new ATOM 0 HG3 MET B 8 4.908 0.866 6.384 1.00 0.00 H new ATOM 0 HE1 MET B 8 3.022 -0.444 2.540 1.00 0.00 H new ATOM 0 HE2 MET B 8 2.797 -1.676 3.804 1.00 0.00 H new ATOM 0 HE3 MET B 8 2.297 0.005 4.102 1.00 0.00 H new ATOM 1554 N GLU B 9 2.791 -2.303 9.414 1.00 0.00 N ATOM 1555 CA GLU B 9 2.518 -3.448 10.268 1.00 0.00 C ATOM 1556 C GLU B 9 1.050 -3.466 10.692 1.00 0.00 C ATOM 1557 O GLU B 9 0.408 -4.522 10.694 1.00 0.00 O ATOM 1558 CB GLU B 9 3.464 -3.497 11.483 1.00 0.00 C ATOM 1559 CG GLU B 9 4.894 -3.850 11.008 1.00 0.00 C ATOM 1560 CD GLU B 9 5.840 -3.927 12.193 1.00 0.00 C ATOM 1561 OE1 GLU B 9 5.659 -4.813 13.002 1.00 0.00 O ATOM 1562 OE2 GLU B 9 6.735 -3.113 12.276 1.00 0.00 O ATOM 0 H GLU B 9 3.437 -1.620 9.810 1.00 0.00 H new ATOM 0 HA GLU B 9 2.711 -4.350 9.687 1.00 0.00 H new ATOM 0 HB2 GLU B 9 3.466 -2.535 11.995 1.00 0.00 H new ATOM 0 HB3 GLU B 9 3.114 -4.239 12.201 1.00 0.00 H new ATOM 0 HG2 GLU B 9 4.884 -4.803 10.480 1.00 0.00 H new ATOM 0 HG3 GLU B 9 5.246 -3.098 10.302 1.00 0.00 H new ATOM 1569 N THR B 10 0.486 -2.286 10.912 1.00 0.00 N ATOM 1570 CA THR B 10 -0.939 -2.189 11.203 1.00 0.00 C ATOM 1571 C THR B 10 -1.716 -2.792 10.029 1.00 0.00 C ATOM 1572 O THR B 10 -2.594 -3.639 10.216 1.00 0.00 O ATOM 1573 CB THR B 10 -1.349 -0.715 11.422 1.00 0.00 C ATOM 1574 OG1 THR B 10 -0.428 -0.080 12.316 1.00 0.00 O ATOM 1575 CG2 THR B 10 -2.754 -0.650 12.033 1.00 0.00 C ATOM 0 H THR B 10 0.983 -1.396 10.895 1.00 0.00 H new ATOM 0 HA THR B 10 -1.166 -2.736 12.118 1.00 0.00 H new ATOM 0 HB THR B 10 -1.340 -0.204 10.459 1.00 0.00 H new ATOM 0 HG1 THR B 10 0.346 0.246 11.811 1.00 0.00 H new ATOM 0 HG21 THR B 10 -3.037 0.392 12.185 1.00 0.00 H new ATOM 0 HG22 THR B 10 -3.466 -1.125 11.358 1.00 0.00 H new ATOM 0 HG23 THR B 10 -2.759 -1.171 12.991 1.00 0.00 H new ATOM 1583 N LEU B 11 -1.299 -2.444 8.813 1.00 0.00 N ATOM 1584 CA LEU B 11 -1.884 -3.029 7.610 1.00 0.00 C ATOM 1585 C LEU B 11 -1.621 -4.536 7.575 1.00 0.00 C ATOM 1586 O LEU B 11 -2.487 -5.323 7.166 1.00 0.00 O ATOM 1587 CB LEU B 11 -1.323 -2.363 6.339 1.00 0.00 C ATOM 1588 CG LEU B 11 -1.801 -0.902 6.231 1.00 0.00 C ATOM 1589 CD1 LEU B 11 -1.056 -0.204 5.090 1.00 0.00 C ATOM 1590 CD2 LEU B 11 -3.304 -0.862 5.940 1.00 0.00 C ATOM 0 H LEU B 11 -0.561 -1.762 8.636 1.00 0.00 H new ATOM 0 HA LEU B 11 -2.960 -2.855 7.637 1.00 0.00 H new ATOM 0 HB2 LEU B 11 -0.234 -2.394 6.357 1.00 0.00 H new ATOM 0 HB3 LEU B 11 -1.643 -2.921 5.459 1.00 0.00 H new ATOM 0 HG LEU B 11 -1.600 -0.394 7.174 1.00 0.00 H new ATOM 0 HD11 LEU B 11 -1.394 0.829 5.013 1.00 0.00 H new ATOM 0 HD12 LEU B 11 0.015 -0.222 5.290 1.00 0.00 H new ATOM 0 HD13 LEU B 11 -1.258 -0.722 4.153 1.00 0.00 H new ATOM 0 HD21 LEU B 11 -3.633 0.175 5.865 1.00 0.00 H new ATOM 0 HD22 LEU B 11 -3.506 -1.375 5.000 1.00 0.00 H new ATOM 0 HD23 LEU B 11 -3.844 -1.357 6.747 1.00 0.00 H new ATOM 1602 N ILE B 12 -0.422 -4.932 7.992 1.00 0.00 N ATOM 1603 CA ILE B 12 -0.043 -6.344 7.988 1.00 0.00 C ATOM 1604 C ILE B 12 -0.963 -7.131 8.906 1.00 0.00 C ATOM 1605 O ILE B 12 -1.379 -8.236 8.571 1.00 0.00 O ATOM 1606 CB ILE B 12 1.424 -6.523 8.466 1.00 0.00 C ATOM 1607 CG1 ILE B 12 2.418 -5.955 7.438 1.00 0.00 C ATOM 1608 CG2 ILE B 12 1.724 -8.011 8.707 1.00 0.00 C ATOM 1609 CD1 ILE B 12 2.499 -6.865 6.204 1.00 0.00 C ATOM 0 H ILE B 12 0.301 -4.300 8.335 1.00 0.00 H new ATOM 0 HA ILE B 12 -0.132 -6.715 6.967 1.00 0.00 H new ATOM 0 HB ILE B 12 1.542 -5.972 9.399 1.00 0.00 H new ATOM 0 HG12 ILE B 12 2.107 -4.954 7.139 1.00 0.00 H new ATOM 0 HG13 ILE B 12 3.404 -5.860 7.892 1.00 0.00 H new ATOM 0 HG21 ILE B 12 2.755 -8.125 9.042 1.00 0.00 H new ATOM 0 HG22 ILE B 12 1.050 -8.399 9.470 1.00 0.00 H new ATOM 0 HG23 ILE B 12 1.580 -8.566 7.780 1.00 0.00 H new ATOM 0 HD11 ILE B 12 3.207 -6.446 5.489 1.00 0.00 H new ATOM 0 HD12 ILE B 12 2.832 -7.858 6.505 1.00 0.00 H new ATOM 0 HD13 ILE B 12 1.515 -6.938 5.740 1.00 0.00 H new ATOM 1621 N ASN B 13 -1.244 -6.585 10.072 1.00 0.00 N ATOM 1622 CA ASN B 13 -2.025 -7.307 11.069 1.00 0.00 C ATOM 1623 C ASN B 13 -3.373 -7.702 10.502 1.00 0.00 C ATOM 1624 O ASN B 13 -3.787 -8.854 10.622 1.00 0.00 O ATOM 1625 CB ASN B 13 -2.247 -6.408 12.287 1.00 0.00 C ATOM 1626 CG ASN B 13 -0.975 -6.310 13.108 1.00 0.00 C ATOM 1627 OD1 ASN B 13 -0.298 -7.315 13.329 1.00 0.00 O ATOM 1628 ND2 ASN B 13 -0.589 -5.153 13.550 1.00 0.00 N ATOM 0 H ASN B 13 -0.948 -5.651 10.356 1.00 0.00 H new ATOM 0 HA ASN B 13 -1.479 -8.206 11.356 1.00 0.00 H new ATOM 0 HB2 ASN B 13 -2.556 -5.414 11.963 1.00 0.00 H new ATOM 0 HB3 ASN B 13 -3.054 -6.808 12.901 1.00 0.00 H new ATOM 0 HD21 ASN B 13 0.277 -5.074 14.082 1.00 0.00 H new ATOM 0 HD22 ASN B 13 -1.152 -4.323 13.365 1.00 0.00 H new ATOM 1635 N VAL B 14 -4.017 -6.777 9.804 1.00 0.00 N ATOM 1636 CA VAL B 14 -5.289 -7.082 9.177 1.00 0.00 C ATOM 1637 C VAL B 14 -5.093 -8.167 8.118 1.00 0.00 C ATOM 1638 O VAL B 14 -5.799 -9.183 8.098 1.00 0.00 O ATOM 1639 CB VAL B 14 -5.874 -5.812 8.529 1.00 0.00 C ATOM 1640 CG1 VAL B 14 -7.180 -6.147 7.794 1.00 0.00 C ATOM 1641 CG2 VAL B 14 -6.150 -4.762 9.610 1.00 0.00 C ATOM 0 H VAL B 14 -3.684 -5.824 9.660 1.00 0.00 H new ATOM 0 HA VAL B 14 -5.985 -7.443 9.934 1.00 0.00 H new ATOM 0 HB VAL B 14 -5.154 -5.417 7.813 1.00 0.00 H new ATOM 0 HG11 VAL B 14 -7.584 -5.242 7.340 1.00 0.00 H new ATOM 0 HG12 VAL B 14 -6.981 -6.885 7.017 1.00 0.00 H new ATOM 0 HG13 VAL B 14 -7.903 -6.552 8.503 1.00 0.00 H new ATOM 0 HG21 VAL B 14 -6.564 -3.865 9.149 1.00 0.00 H new ATOM 0 HG22 VAL B 14 -6.863 -5.161 10.331 1.00 0.00 H new ATOM 0 HG23 VAL B 14 -5.220 -4.512 10.120 1.00 0.00 H new ATOM 1651 N PHE B 15 -4.101 -7.967 7.274 1.00 0.00 N ATOM 1652 CA PHE B 15 -3.781 -8.924 6.230 1.00 0.00 C ATOM 1653 C PHE B 15 -3.398 -10.267 6.847 1.00 0.00 C ATOM 1654 O PHE B 15 -3.864 -11.336 6.422 1.00 0.00 O ATOM 1655 CB PHE B 15 -2.605 -8.389 5.409 1.00 0.00 C ATOM 1656 CG PHE B 15 -2.331 -9.313 4.252 1.00 0.00 C ATOM 1657 CD1 PHE B 15 -1.520 -10.430 4.434 1.00 0.00 C ATOM 1658 CD2 PHE B 15 -2.897 -9.057 3.003 1.00 0.00 C ATOM 1659 CE1 PHE B 15 -1.272 -11.292 3.368 1.00 0.00 C ATOM 1660 CE2 PHE B 15 -2.648 -9.924 1.937 1.00 0.00 C ATOM 1661 CZ PHE B 15 -1.836 -11.040 2.124 1.00 0.00 C ATOM 0 H PHE B 15 -3.498 -7.145 7.290 1.00 0.00 H new ATOM 0 HA PHE B 15 -4.652 -9.065 5.590 1.00 0.00 H new ATOM 0 HB2 PHE B 15 -2.831 -7.388 5.042 1.00 0.00 H new ATOM 0 HB3 PHE B 15 -1.719 -8.305 6.038 1.00 0.00 H new ATOM 0 HD1 PHE B 15 -1.083 -10.628 5.402 1.00 0.00 H new ATOM 0 HD2 PHE B 15 -3.526 -8.191 2.861 1.00 0.00 H new ATOM 0 HE1 PHE B 15 -0.641 -12.157 3.509 1.00 0.00 H new ATOM 0 HE2 PHE B 15 -3.085 -9.729 0.969 1.00 0.00 H new ATOM 0 HZ PHE B 15 -1.644 -11.711 1.300 1.00 0.00 H new ATOM 1671 N HIS B 16 -2.523 -10.196 7.828 1.00 0.00 N ATOM 1672 CA HIS B 16 -1.982 -11.370 8.482 1.00 0.00 C ATOM 1673 C HIS B 16 -3.081 -12.166 9.168 1.00 0.00 C ATOM 1674 O HIS B 16 -3.173 -13.383 8.994 1.00 0.00 O ATOM 1675 CB HIS B 16 -0.918 -10.928 9.495 1.00 0.00 C ATOM 1676 CG HIS B 16 -0.193 -12.107 10.080 1.00 0.00 C ATOM 1677 ND1 HIS B 16 -0.323 -13.396 9.584 1.00 0.00 N ATOM 1678 CD2 HIS B 16 0.705 -12.188 11.111 1.00 0.00 C ATOM 1679 CE1 HIS B 16 0.486 -14.188 10.315 1.00 0.00 C ATOM 1680 NE2 HIS B 16 1.137 -13.499 11.261 1.00 0.00 N ATOM 0 H HIS B 16 -2.164 -9.315 8.197 1.00 0.00 H new ATOM 0 HA HIS B 16 -1.526 -12.020 7.735 1.00 0.00 H new ATOM 0 HB2 HIS B 16 -0.203 -10.265 9.008 1.00 0.00 H new ATOM 0 HB3 HIS B 16 -1.390 -10.356 10.294 1.00 0.00 H new ATOM 0 HD1 HIS B 16 -0.920 -13.690 8.810 1.00 0.00 H new ATOM 0 HD2 HIS B 16 1.029 -11.355 11.718 1.00 0.00 H new ATOM 0 HE1 HIS B 16 0.596 -15.251 10.157 1.00 0.00 H new ATOM 1689 N ALA B 17 -3.934 -11.474 9.917 1.00 0.00 N ATOM 1690 CA ALA B 17 -5.022 -12.138 10.617 1.00 0.00 C ATOM 1691 C ALA B 17 -5.935 -12.849 9.635 1.00 0.00 C ATOM 1692 O ALA B 17 -6.307 -14.009 9.842 1.00 0.00 O ATOM 1693 CB ALA B 17 -5.830 -11.135 11.442 1.00 0.00 C ATOM 0 H ALA B 17 -3.892 -10.464 10.053 1.00 0.00 H new ATOM 0 HA ALA B 17 -4.585 -12.875 11.291 1.00 0.00 H new ATOM 0 HB1 ALA B 17 -6.638 -11.655 11.957 1.00 0.00 H new ATOM 0 HB2 ALA B 17 -5.179 -10.659 12.176 1.00 0.00 H new ATOM 0 HB3 ALA B 17 -6.249 -10.375 10.782 1.00 0.00 H new ATOM 1699 N HIS B 18 -6.292 -12.158 8.565 1.00 0.00 N ATOM 1700 CA HIS B 18 -7.176 -12.733 7.559 1.00 0.00 C ATOM 1701 C HIS B 18 -6.489 -13.819 6.741 1.00 0.00 C ATOM 1702 O HIS B 18 -7.148 -14.750 6.264 1.00 0.00 O ATOM 1703 CB HIS B 18 -7.796 -11.660 6.668 1.00 0.00 C ATOM 1704 CG HIS B 18 -8.844 -10.920 7.450 1.00 0.00 C ATOM 1705 ND1 HIS B 18 -10.114 -11.441 7.664 1.00 0.00 N ATOM 1706 CD2 HIS B 18 -8.829 -9.703 8.089 1.00 0.00 C ATOM 1707 CE1 HIS B 18 -10.795 -10.551 8.407 1.00 0.00 C ATOM 1708 NE2 HIS B 18 -10.061 -9.475 8.693 1.00 0.00 N ATOM 0 H HIS B 18 -5.987 -11.205 8.369 1.00 0.00 H new ATOM 0 HA HIS B 18 -7.992 -13.215 8.098 1.00 0.00 H new ATOM 0 HB2 HIS B 18 -7.028 -10.969 6.321 1.00 0.00 H new ATOM 0 HB3 HIS B 18 -8.239 -12.116 5.782 1.00 0.00 H new ATOM 0 HD1 HIS B 18 -10.465 -12.335 7.320 1.00 0.00 H new ATOM 0 HD2 HIS B 18 -7.988 -9.026 8.118 1.00 0.00 H new ATOM 0 HE1 HIS B 18 -11.815 -10.691 8.733 1.00 0.00 H new ATOM 1717 N SER B 19 -5.164 -13.740 6.617 1.00 0.00 N ATOM 1718 CA SER B 19 -4.430 -14.772 5.890 1.00 0.00 C ATOM 1719 C SER B 19 -4.786 -16.132 6.468 1.00 0.00 C ATOM 1720 O SER B 19 -5.052 -17.083 5.736 1.00 0.00 O ATOM 1721 CB SER B 19 -2.907 -14.557 6.010 1.00 0.00 C ATOM 1722 OG SER B 19 -2.567 -13.253 5.538 1.00 0.00 O ATOM 0 H SER B 19 -4.589 -12.990 7.001 1.00 0.00 H new ATOM 0 HA SER B 19 -4.706 -14.718 4.837 1.00 0.00 H new ATOM 0 HB2 SER B 19 -2.594 -14.672 7.048 1.00 0.00 H new ATOM 0 HB3 SER B 19 -2.376 -15.313 5.432 1.00 0.00 H new ATOM 0 HG SER B 19 -2.833 -12.585 6.203 1.00 0.00 H new ATOM 1728 N GLY B 20 -4.849 -16.201 7.785 1.00 0.00 N ATOM 1729 CA GLY B 20 -5.190 -17.437 8.471 1.00 0.00 C ATOM 1730 C GLY B 20 -6.593 -17.915 8.125 1.00 0.00 C ATOM 1731 O GLY B 20 -6.840 -19.118 8.023 1.00 0.00 O ATOM 0 H GLY B 20 -4.668 -15.412 8.405 1.00 0.00 H new ATOM 0 HA2 GLY B 20 -4.468 -18.210 8.205 1.00 0.00 H new ATOM 0 HA3 GLY B 20 -5.114 -17.286 9.548 1.00 0.00 H new ATOM 1735 N LYS B 21 -7.529 -16.983 8.070 1.00 0.00 N ATOM 1736 CA LYS B 21 -8.934 -17.333 7.902 1.00 0.00 C ATOM 1737 C LYS B 21 -9.231 -17.970 6.545 1.00 0.00 C ATOM 1738 O LYS B 21 -9.975 -18.953 6.472 1.00 0.00 O ATOM 1739 CB LYS B 21 -9.813 -16.096 8.103 1.00 0.00 C ATOM 1740 CG LYS B 21 -9.623 -15.544 9.531 1.00 0.00 C ATOM 1741 CD LYS B 21 -10.095 -16.573 10.573 1.00 0.00 C ATOM 1742 CE LYS B 21 -9.885 -16.011 11.981 1.00 0.00 C ATOM 1743 NZ LYS B 21 -10.482 -14.654 12.073 1.00 0.00 N ATOM 0 H LYS B 21 -7.346 -15.982 8.139 1.00 0.00 H new ATOM 0 HA LYS B 21 -9.165 -18.080 8.661 1.00 0.00 H new ATOM 0 HB2 LYS B 21 -9.553 -15.332 7.371 1.00 0.00 H new ATOM 0 HB3 LYS B 21 -10.860 -16.352 7.939 1.00 0.00 H new ATOM 0 HG2 LYS B 21 -8.573 -15.304 9.698 1.00 0.00 H new ATOM 0 HG3 LYS B 21 -10.184 -14.617 9.647 1.00 0.00 H new ATOM 0 HD2 LYS B 21 -11.148 -16.807 10.417 1.00 0.00 H new ATOM 0 HD3 LYS B 21 -9.541 -17.504 10.456 1.00 0.00 H new ATOM 0 HE2 LYS B 21 -10.343 -16.671 12.718 1.00 0.00 H new ATOM 0 HE3 LYS B 21 -8.820 -15.967 12.210 1.00 0.00 H new ATOM 0 HZ1 LYS B 21 -10.661 -14.421 13.070 1.00 0.00 H new ATOM 0 HZ2 LYS B 21 -9.825 -13.957 11.667 1.00 0.00 H new ATOM 0 HZ3 LYS B 21 -11.378 -14.633 11.546 1.00 0.00 H new ATOM 1757 N GLU B 22 -8.713 -17.379 5.481 1.00 0.00 N ATOM 1758 CA GLU B 22 -9.007 -17.869 4.128 1.00 0.00 C ATOM 1759 C GLU B 22 -7.803 -17.777 3.217 1.00 0.00 C ATOM 1760 O GLU B 22 -7.899 -18.111 2.033 1.00 0.00 O ATOM 1761 CB GLU B 22 -10.155 -17.067 3.508 1.00 0.00 C ATOM 1762 CG GLU B 22 -11.463 -17.323 4.260 1.00 0.00 C ATOM 1763 CD GLU B 22 -11.954 -18.750 4.035 1.00 0.00 C ATOM 1764 OE1 GLU B 22 -11.577 -19.355 3.040 1.00 0.00 O ATOM 1765 OE2 GLU B 22 -12.718 -19.219 4.849 1.00 0.00 O ATOM 0 H GLU B 22 -8.094 -16.569 5.517 1.00 0.00 H new ATOM 0 HA GLU B 22 -9.289 -18.917 4.226 1.00 0.00 H new ATOM 0 HB2 GLU B 22 -9.917 -16.004 3.534 1.00 0.00 H new ATOM 0 HB3 GLU B 22 -10.273 -17.342 2.460 1.00 0.00 H new ATOM 0 HG2 GLU B 22 -11.314 -17.150 5.326 1.00 0.00 H new ATOM 0 HG3 GLU B 22 -12.223 -16.616 3.926 1.00 0.00 H new ATOM 1772 N GLY B 23 -6.732 -17.203 3.701 1.00 0.00 N ATOM 1773 CA GLY B 23 -5.563 -16.987 2.867 1.00 0.00 C ATOM 1774 C GLY B 23 -4.641 -18.178 2.932 1.00 0.00 C ATOM 1775 O GLY B 23 -4.872 -19.110 3.716 1.00 0.00 O ATOM 0 H GLY B 23 -6.638 -16.876 4.663 1.00 0.00 H new ATOM 0 HA2 GLY B 23 -5.871 -16.814 1.836 1.00 0.00 H new ATOM 0 HA3 GLY B 23 -5.035 -16.092 3.196 1.00 0.00 H new ATOM 1779 N ASP B 24 -3.570 -18.142 2.149 1.00 0.00 N ATOM 1780 CA ASP B 24 -2.583 -19.207 2.196 1.00 0.00 C ATOM 1781 C ASP B 24 -1.750 -19.027 3.445 1.00 0.00 C ATOM 1782 O ASP B 24 -2.177 -18.328 4.364 1.00 0.00 O ATOM 1783 CB ASP B 24 -1.693 -19.202 0.950 1.00 0.00 C ATOM 1784 CG ASP B 24 -0.989 -20.533 0.848 1.00 0.00 C ATOM 1785 OD1 ASP B 24 -1.609 -21.477 0.431 1.00 0.00 O ATOM 1786 OD2 ASP B 24 0.157 -20.603 1.222 1.00 0.00 O ATOM 0 H ASP B 24 -3.366 -17.397 1.483 1.00 0.00 H new ATOM 0 HA ASP B 24 -3.093 -20.170 2.219 1.00 0.00 H new ATOM 0 HB2 ASP B 24 -2.294 -19.024 0.058 1.00 0.00 H new ATOM 0 HB3 ASP B 24 -0.964 -18.394 1.010 1.00 0.00 H new ATOM 1791 N LYS B 25 -0.547 -19.576 3.483 1.00 0.00 N ATOM 1792 CA LYS B 25 0.288 -19.370 4.655 1.00 0.00 C ATOM 1793 C LYS B 25 0.555 -17.911 4.772 1.00 0.00 C ATOM 1794 O LYS B 25 0.292 -17.296 5.810 1.00 0.00 O ATOM 1795 CB LYS B 25 1.607 -20.071 4.500 1.00 0.00 C ATOM 1796 CG LYS B 25 1.343 -21.527 4.158 1.00 0.00 C ATOM 1797 CD LYS B 25 2.457 -22.451 4.697 1.00 0.00 C ATOM 1798 CE LYS B 25 3.836 -21.789 4.562 1.00 0.00 C ATOM 1799 NZ LYS B 25 4.377 -21.521 5.921 1.00 0.00 N ATOM 0 H LYS B 25 -0.137 -20.148 2.745 1.00 0.00 H new ATOM 0 HA LYS B 25 -0.223 -19.764 5.534 1.00 0.00 H new ATOM 0 HB2 LYS B 25 2.197 -19.599 3.714 1.00 0.00 H new ATOM 0 HB3 LYS B 25 2.185 -19.997 5.421 1.00 0.00 H new ATOM 0 HG2 LYS B 25 0.384 -21.831 4.577 1.00 0.00 H new ATOM 0 HG3 LYS B 25 1.269 -21.639 3.076 1.00 0.00 H new ATOM 0 HD2 LYS B 25 2.264 -22.687 5.744 1.00 0.00 H new ATOM 0 HD3 LYS B 25 2.448 -23.394 4.151 1.00 0.00 H new ATOM 0 HE2 LYS B 25 4.513 -22.439 4.008 1.00 0.00 H new ATOM 0 HE3 LYS B 25 3.754 -20.859 3.999 1.00 0.00 H new ATOM 0 HZ1 LYS B 25 5.031 -20.713 5.881 1.00 0.00 H new ATOM 0 HZ2 LYS B 25 3.594 -21.301 6.569 1.00 0.00 H new ATOM 0 HZ3 LYS B 25 4.885 -22.361 6.264 1.00 0.00 H new ATOM 1813 N TYR B 26 0.899 -17.315 3.643 1.00 0.00 N ATOM 1814 CA TYR B 26 0.973 -15.892 3.590 1.00 0.00 C ATOM 1815 C TYR B 26 0.360 -15.417 2.291 1.00 0.00 C ATOM 1816 O TYR B 26 1.062 -15.142 1.325 1.00 0.00 O ATOM 1817 CB TYR B 26 2.442 -15.419 3.702 1.00 0.00 C ATOM 1818 CG TYR B 26 3.317 -16.550 4.216 1.00 0.00 C ATOM 1819 CD1 TYR B 26 3.361 -16.850 5.585 1.00 0.00 C ATOM 1820 CD2 TYR B 26 4.082 -17.297 3.314 1.00 0.00 C ATOM 1821 CE1 TYR B 26 4.171 -17.893 6.041 1.00 0.00 C ATOM 1822 CE2 TYR B 26 4.887 -18.335 3.773 1.00 0.00 C ATOM 1823 CZ TYR B 26 4.934 -18.634 5.132 1.00 0.00 C ATOM 1824 OH TYR B 26 5.734 -19.660 5.580 1.00 0.00 O ATOM 0 H TYR B 26 1.125 -17.797 2.773 1.00 0.00 H new ATOM 0 HA TYR B 26 0.421 -15.468 4.429 1.00 0.00 H new ATOM 0 HB2 TYR B 26 2.800 -15.086 2.728 1.00 0.00 H new ATOM 0 HB3 TYR B 26 2.507 -14.564 4.375 1.00 0.00 H new ATOM 0 HD1 TYR B 26 2.771 -16.277 6.285 1.00 0.00 H new ATOM 0 HD2 TYR B 26 4.048 -17.068 2.259 1.00 0.00 H new ATOM 0 HE1 TYR B 26 4.208 -18.127 7.095 1.00 0.00 H new ATOM 0 HE2 TYR B 26 5.476 -18.910 3.074 1.00 0.00 H new ATOM 0 HH TYR B 26 6.663 -19.488 5.320 1.00 0.00 H new ATOM 1834 N LYS B 27 -0.927 -15.173 2.345 1.00 0.00 N ATOM 1835 CA LYS B 27 -1.688 -14.570 1.273 1.00 0.00 C ATOM 1836 C LYS B 27 -3.035 -14.171 1.822 1.00 0.00 C ATOM 1837 O LYS B 27 -3.463 -14.707 2.843 1.00 0.00 O ATOM 1838 CB LYS B 27 -1.856 -15.517 0.066 1.00 0.00 C ATOM 1839 CG LYS B 27 -0.795 -15.211 -1.022 1.00 0.00 C ATOM 1840 CD LYS B 27 -0.985 -13.778 -1.572 1.00 0.00 C ATOM 1841 CE LYS B 27 -1.511 -13.817 -3.028 1.00 0.00 C ATOM 1842 NZ LYS B 27 -0.634 -13.031 -3.936 1.00 0.00 N ATOM 0 H LYS B 27 -1.494 -15.396 3.163 1.00 0.00 H new ATOM 0 HA LYS B 27 -1.147 -13.698 0.905 1.00 0.00 H new ATOM 0 HB2 LYS B 27 -1.760 -16.552 0.394 1.00 0.00 H new ATOM 0 HB3 LYS B 27 -2.856 -15.406 -0.353 1.00 0.00 H new ATOM 0 HG2 LYS B 27 0.206 -15.317 -0.603 1.00 0.00 H new ATOM 0 HG3 LYS B 27 -0.879 -15.933 -1.834 1.00 0.00 H new ATOM 0 HD2 LYS B 27 -1.686 -13.231 -0.941 1.00 0.00 H new ATOM 0 HD3 LYS B 27 -0.037 -13.241 -1.536 1.00 0.00 H new ATOM 0 HE2 LYS B 27 -1.562 -14.850 -3.372 1.00 0.00 H new ATOM 0 HE3 LYS B 27 -2.525 -13.419 -3.062 1.00 0.00 H new ATOM 0 HZ1 LYS B 27 -0.596 -13.493 -4.867 1.00 0.00 H new ATOM 0 HZ2 LYS B 27 -1.016 -12.070 -4.041 1.00 0.00 H new ATOM 0 HZ3 LYS B 27 0.324 -12.980 -3.535 1.00 0.00 H new ATOM 1856 N LEU B 28 -3.749 -13.347 1.106 1.00 0.00 N ATOM 1857 CA LEU B 28 -5.101 -12.995 1.493 1.00 0.00 C ATOM 1858 C LEU B 28 -6.036 -13.327 0.353 1.00 0.00 C ATOM 1859 O LEU B 28 -5.711 -13.092 -0.806 1.00 0.00 O ATOM 1860 CB LEU B 28 -5.180 -11.501 1.843 1.00 0.00 C ATOM 1861 CG LEU B 28 -6.612 -11.105 2.220 1.00 0.00 C ATOM 1862 CD1 LEU B 28 -6.997 -11.772 3.542 1.00 0.00 C ATOM 1863 CD2 LEU B 28 -6.678 -9.584 2.391 1.00 0.00 C ATOM 0 H LEU B 28 -3.423 -12.902 0.248 1.00 0.00 H new ATOM 0 HA LEU B 28 -5.393 -13.563 2.376 1.00 0.00 H new ATOM 0 HB2 LEU B 28 -4.507 -11.281 2.672 1.00 0.00 H new ATOM 0 HB3 LEU B 28 -4.845 -10.906 0.994 1.00 0.00 H new ATOM 0 HG LEU B 28 -7.299 -11.426 1.436 1.00 0.00 H new ATOM 0 HD11 LEU B 28 -8.015 -11.490 3.809 1.00 0.00 H new ATOM 0 HD12 LEU B 28 -6.937 -12.855 3.434 1.00 0.00 H new ATOM 0 HD13 LEU B 28 -6.313 -11.447 4.326 1.00 0.00 H new ATOM 0 HD21 LEU B 28 -7.693 -9.292 2.659 1.00 0.00 H new ATOM 0 HD22 LEU B 28 -5.991 -9.276 3.180 1.00 0.00 H new ATOM 0 HD23 LEU B 28 -6.396 -9.100 1.456 1.00 0.00 H new ATOM 1875 N SER B 29 -7.127 -13.983 0.654 1.00 0.00 N ATOM 1876 CA SER B 29 -8.050 -14.381 -0.378 1.00 0.00 C ATOM 1877 C SER B 29 -9.037 -13.259 -0.686 1.00 0.00 C ATOM 1878 O SER B 29 -9.120 -12.266 0.050 1.00 0.00 O ATOM 1879 CB SER B 29 -8.753 -15.669 0.009 1.00 0.00 C ATOM 1880 OG SER B 29 -8.796 -15.766 1.423 1.00 0.00 O ATOM 0 H SER B 29 -7.397 -14.252 1.600 1.00 0.00 H new ATOM 0 HA SER B 29 -7.491 -14.575 -1.294 1.00 0.00 H new ATOM 0 HB2 SER B 29 -9.763 -15.684 -0.400 1.00 0.00 H new ATOM 0 HB3 SER B 29 -8.226 -16.526 -0.411 1.00 0.00 H new ATOM 0 HG SER B 29 -9.214 -14.961 1.794 1.00 0.00 H new ATOM 1886 N LYS B 30 -9.751 -13.389 -1.787 1.00 0.00 N ATOM 1887 CA LYS B 30 -10.664 -12.344 -2.224 1.00 0.00 C ATOM 1888 C LYS B 30 -11.953 -12.343 -1.408 1.00 0.00 C ATOM 1889 O LYS B 30 -12.842 -11.522 -1.648 1.00 0.00 O ATOM 1890 CB LYS B 30 -10.964 -12.468 -3.726 1.00 0.00 C ATOM 1891 CG LYS B 30 -9.645 -12.684 -4.520 1.00 0.00 C ATOM 1892 CD LYS B 30 -8.624 -11.563 -4.210 1.00 0.00 C ATOM 1893 CE LYS B 30 -8.903 -10.324 -5.075 1.00 0.00 C ATOM 1894 NZ LYS B 30 -9.146 -10.725 -6.486 1.00 0.00 N ATOM 0 H LYS B 30 -9.719 -14.206 -2.397 1.00 0.00 H new ATOM 0 HA LYS B 30 -10.170 -11.388 -2.054 1.00 0.00 H new ATOM 0 HB2 LYS B 30 -11.643 -13.302 -3.901 1.00 0.00 H new ATOM 0 HB3 LYS B 30 -11.467 -11.568 -4.080 1.00 0.00 H new ATOM 0 HG2 LYS B 30 -9.216 -13.653 -4.264 1.00 0.00 H new ATOM 0 HG3 LYS B 30 -9.858 -12.702 -5.589 1.00 0.00 H new ATOM 0 HD2 LYS B 30 -8.678 -11.296 -3.155 1.00 0.00 H new ATOM 0 HD3 LYS B 30 -7.612 -11.923 -4.396 1.00 0.00 H new ATOM 0 HE2 LYS B 30 -9.770 -9.789 -4.687 1.00 0.00 H new ATOM 0 HE3 LYS B 30 -8.057 -9.639 -5.025 1.00 0.00 H new ATOM 0 HZ1 LYS B 30 -8.591 -10.116 -7.120 1.00 0.00 H new ATOM 0 HZ2 LYS B 30 -8.860 -11.716 -6.619 1.00 0.00 H new ATOM 0 HZ3 LYS B 30 -10.157 -10.624 -6.706 1.00 0.00 H new ATOM 1908 N LYS B 31 -12.078 -13.298 -0.499 1.00 0.00 N ATOM 1909 CA LYS B 31 -13.277 -13.420 0.343 1.00 0.00 C ATOM 1910 C LYS B 31 -13.172 -12.434 1.493 1.00 0.00 C ATOM 1911 O LYS B 31 -13.995 -11.528 1.653 1.00 0.00 O ATOM 1912 CB LYS B 31 -13.351 -14.826 0.967 1.00 0.00 C ATOM 1913 CG LYS B 31 -12.689 -15.847 0.048 1.00 0.00 C ATOM 1914 CD LYS B 31 -12.622 -17.196 0.759 1.00 0.00 C ATOM 1915 CE LYS B 31 -11.769 -18.155 -0.067 1.00 0.00 C ATOM 1916 NZ LYS B 31 -11.735 -19.486 0.591 1.00 0.00 N ATOM 0 H LYS B 31 -11.366 -14.006 -0.319 1.00 0.00 H new ATOM 0 HA LYS B 31 -14.154 -13.231 -0.275 1.00 0.00 H new ATOM 0 HB2 LYS B 31 -12.857 -14.827 1.939 1.00 0.00 H new ATOM 0 HB3 LYS B 31 -14.392 -15.101 1.138 1.00 0.00 H new ATOM 0 HG2 LYS B 31 -13.254 -15.939 -0.879 1.00 0.00 H new ATOM 0 HG3 LYS B 31 -11.686 -15.515 -0.222 1.00 0.00 H new ATOM 0 HD2 LYS B 31 -12.195 -17.075 1.755 1.00 0.00 H new ATOM 0 HD3 LYS B 31 -13.625 -17.602 0.890 1.00 0.00 H new ATOM 0 HE2 LYS B 31 -12.178 -18.246 -1.073 1.00 0.00 H new ATOM 0 HE3 LYS B 31 -10.757 -17.762 -0.168 1.00 0.00 H new ATOM 0 HZ1 LYS B 31 -11.086 -20.113 0.073 1.00 0.00 H new ATOM 0 HZ2 LYS B 31 -11.405 -19.380 1.572 1.00 0.00 H new ATOM 0 HZ3 LYS B 31 -12.690 -19.899 0.589 1.00 0.00 H new ATOM 1930 N GLU B 32 -12.120 -12.624 2.272 1.00 0.00 N ATOM 1931 CA GLU B 32 -11.829 -11.823 3.444 1.00 0.00 C ATOM 1932 C GLU B 32 -11.540 -10.393 3.024 1.00 0.00 C ATOM 1933 O GLU B 32 -11.844 -9.434 3.743 1.00 0.00 O ATOM 1934 CB GLU B 32 -10.585 -12.408 4.131 1.00 0.00 C ATOM 1935 CG GLU B 32 -10.859 -13.851 4.611 1.00 0.00 C ATOM 1936 CD GLU B 32 -11.846 -13.855 5.765 1.00 0.00 C ATOM 1937 OE1 GLU B 32 -11.562 -13.221 6.755 1.00 0.00 O ATOM 1938 OE2 GLU B 32 -12.870 -14.485 5.649 1.00 0.00 O ATOM 0 H GLU B 32 -11.431 -13.356 2.101 1.00 0.00 H new ATOM 0 HA GLU B 32 -12.681 -11.832 4.124 1.00 0.00 H new ATOM 0 HB2 GLU B 32 -9.744 -12.403 3.438 1.00 0.00 H new ATOM 0 HB3 GLU B 32 -10.303 -11.784 4.979 1.00 0.00 H new ATOM 0 HG2 GLU B 32 -11.254 -14.445 3.787 1.00 0.00 H new ATOM 0 HG3 GLU B 32 -9.925 -14.319 4.923 1.00 0.00 H new ATOM 1945 N LEU B 33 -10.893 -10.268 1.880 1.00 0.00 N ATOM 1946 CA LEU B 33 -10.436 -8.986 1.372 1.00 0.00 C ATOM 1947 C LEU B 33 -11.603 -8.032 1.183 1.00 0.00 C ATOM 1948 O LEU B 33 -11.537 -6.866 1.590 1.00 0.00 O ATOM 1949 CB LEU B 33 -9.701 -9.208 0.029 1.00 0.00 C ATOM 1950 CG LEU B 33 -9.217 -7.880 -0.593 1.00 0.00 C ATOM 1951 CD1 LEU B 33 -10.380 -7.153 -1.276 1.00 0.00 C ATOM 1952 CD2 LEU B 33 -8.581 -6.981 0.473 1.00 0.00 C ATOM 0 H LEU B 33 -10.668 -11.057 1.273 1.00 0.00 H new ATOM 0 HA LEU B 33 -9.753 -8.539 2.094 1.00 0.00 H new ATOM 0 HB2 LEU B 33 -8.847 -9.866 0.188 1.00 0.00 H new ATOM 0 HB3 LEU B 33 -10.368 -9.714 -0.670 1.00 0.00 H new ATOM 0 HG LEU B 33 -8.461 -8.111 -1.343 1.00 0.00 H new ATOM 0 HD11 LEU B 33 -10.021 -6.219 -1.709 1.00 0.00 H new ATOM 0 HD12 LEU B 33 -10.791 -7.784 -2.064 1.00 0.00 H new ATOM 0 HD13 LEU B 33 -11.156 -6.938 -0.542 1.00 0.00 H new ATOM 0 HD21 LEU B 33 -8.247 -6.051 0.013 1.00 0.00 H new ATOM 0 HD22 LEU B 33 -9.315 -6.759 1.247 1.00 0.00 H new ATOM 0 HD23 LEU B 33 -7.727 -7.492 0.918 1.00 0.00 H new ATOM 1964 N LYS B 34 -12.690 -8.531 0.630 1.00 0.00 N ATOM 1965 CA LYS B 34 -13.858 -7.693 0.413 1.00 0.00 C ATOM 1966 C LYS B 34 -14.363 -7.178 1.747 1.00 0.00 C ATOM 1967 O LYS B 34 -14.777 -6.024 1.864 1.00 0.00 O ATOM 1968 CB LYS B 34 -14.974 -8.514 -0.236 1.00 0.00 C ATOM 1969 CG LYS B 34 -14.561 -8.936 -1.645 1.00 0.00 C ATOM 1970 CD LYS B 34 -15.679 -9.787 -2.256 1.00 0.00 C ATOM 1971 CE LYS B 34 -15.274 -10.262 -3.656 1.00 0.00 C ATOM 1972 NZ LYS B 34 -14.439 -11.487 -3.545 1.00 0.00 N ATOM 0 H LYS B 34 -12.792 -9.499 0.325 1.00 0.00 H new ATOM 0 HA LYS B 34 -13.580 -6.863 -0.236 1.00 0.00 H new ATOM 0 HB2 LYS B 34 -15.187 -9.396 0.369 1.00 0.00 H new ATOM 0 HB3 LYS B 34 -15.891 -7.927 -0.278 1.00 0.00 H new ATOM 0 HG2 LYS B 34 -14.376 -8.057 -2.263 1.00 0.00 H new ATOM 0 HG3 LYS B 34 -13.631 -9.503 -1.611 1.00 0.00 H new ATOM 0 HD2 LYS B 34 -15.883 -10.646 -1.617 1.00 0.00 H new ATOM 0 HD3 LYS B 34 -16.599 -9.206 -2.313 1.00 0.00 H new ATOM 0 HE2 LYS B 34 -16.163 -10.468 -4.252 1.00 0.00 H new ATOM 0 HE3 LYS B 34 -14.720 -9.477 -4.171 1.00 0.00 H new ATOM 0 HZ1 LYS B 34 -13.894 -11.616 -4.421 1.00 0.00 H new ATOM 0 HZ2 LYS B 34 -13.786 -11.390 -2.742 1.00 0.00 H new ATOM 0 HZ3 LYS B 34 -15.053 -12.313 -3.394 1.00 0.00 H new ATOM 1986 N GLU B 35 -14.385 -8.060 2.730 1.00 0.00 N ATOM 1987 CA GLU B 35 -14.899 -7.728 4.043 1.00 0.00 C ATOM 1988 C GLU B 35 -13.976 -6.774 4.804 1.00 0.00 C ATOM 1989 O GLU B 35 -14.429 -5.747 5.322 1.00 0.00 O ATOM 1990 CB GLU B 35 -15.136 -9.014 4.838 1.00 0.00 C ATOM 1991 CG GLU B 35 -16.308 -9.778 4.204 1.00 0.00 C ATOM 1992 CD GLU B 35 -16.500 -11.139 4.850 1.00 0.00 C ATOM 1993 OE1 GLU B 35 -15.714 -11.501 5.701 1.00 0.00 O ATOM 1994 OE2 GLU B 35 -17.435 -11.813 4.475 1.00 0.00 O ATOM 0 H GLU B 35 -14.049 -9.019 2.640 1.00 0.00 H new ATOM 0 HA GLU B 35 -15.845 -7.203 3.913 1.00 0.00 H new ATOM 0 HB2 GLU B 35 -14.237 -9.631 4.835 1.00 0.00 H new ATOM 0 HB3 GLU B 35 -15.358 -8.779 5.879 1.00 0.00 H new ATOM 0 HG2 GLU B 35 -17.222 -9.193 4.306 1.00 0.00 H new ATOM 0 HG3 GLU B 35 -16.127 -9.903 3.136 1.00 0.00 H new ATOM 2001 N LEU B 36 -12.687 -7.098 4.879 1.00 0.00 N ATOM 2002 CA LEU B 36 -11.765 -6.240 5.622 1.00 0.00 C ATOM 2003 C LEU B 36 -11.571 -4.908 4.940 1.00 0.00 C ATOM 2004 O LEU B 36 -11.517 -3.869 5.595 1.00 0.00 O ATOM 2005 CB LEU B 36 -10.401 -6.913 5.909 1.00 0.00 C ATOM 2006 CG LEU B 36 -9.774 -7.479 4.626 1.00 0.00 C ATOM 2007 CD1 LEU B 36 -8.606 -6.595 4.193 1.00 0.00 C ATOM 2008 CD2 LEU B 36 -9.249 -8.892 4.900 1.00 0.00 C ATOM 0 H LEU B 36 -12.266 -7.922 4.449 1.00 0.00 H new ATOM 0 HA LEU B 36 -12.238 -6.067 6.589 1.00 0.00 H new ATOM 0 HB2 LEU B 36 -9.723 -6.187 6.358 1.00 0.00 H new ATOM 0 HB3 LEU B 36 -10.535 -7.715 6.635 1.00 0.00 H new ATOM 0 HG LEU B 36 -10.527 -7.506 3.839 1.00 0.00 H new ATOM 0 HD11 LEU B 36 -8.162 -6.998 3.283 1.00 0.00 H new ATOM 0 HD12 LEU B 36 -8.966 -5.584 4.004 1.00 0.00 H new ATOM 0 HD13 LEU B 36 -7.855 -6.572 4.983 1.00 0.00 H new ATOM 0 HD21 LEU B 36 -8.803 -9.297 3.992 1.00 0.00 H new ATOM 0 HD22 LEU B 36 -8.497 -8.854 5.688 1.00 0.00 H new ATOM 0 HD23 LEU B 36 -10.073 -9.531 5.216 1.00 0.00 H new ATOM 2020 N LEU B 37 -11.463 -4.931 3.622 1.00 0.00 N ATOM 2021 CA LEU B 37 -11.202 -3.701 2.884 1.00 0.00 C ATOM 2022 C LEU B 37 -12.327 -2.695 3.092 1.00 0.00 C ATOM 2023 O LEU B 37 -12.080 -1.546 3.476 1.00 0.00 O ATOM 2024 CB LEU B 37 -10.997 -4.004 1.373 1.00 0.00 C ATOM 2025 CG LEU B 37 -10.711 -2.717 0.561 1.00 0.00 C ATOM 2026 CD1 LEU B 37 -12.018 -1.997 0.221 1.00 0.00 C ATOM 2027 CD2 LEU B 37 -9.795 -1.783 1.342 1.00 0.00 C ATOM 0 H LEU B 37 -11.550 -5.769 3.048 1.00 0.00 H new ATOM 0 HA LEU B 37 -10.283 -3.259 3.269 1.00 0.00 H new ATOM 0 HB2 LEU B 37 -10.168 -4.702 1.252 1.00 0.00 H new ATOM 0 HB3 LEU B 37 -11.887 -4.493 0.977 1.00 0.00 H new ATOM 0 HG LEU B 37 -10.214 -3.004 -0.365 1.00 0.00 H new ATOM 0 HD11 LEU B 37 -11.799 -1.095 -0.350 1.00 0.00 H new ATOM 0 HD12 LEU B 37 -12.653 -2.656 -0.372 1.00 0.00 H new ATOM 0 HD13 LEU B 37 -12.535 -1.727 1.142 1.00 0.00 H new ATOM 0 HD21 LEU B 37 -9.606 -0.884 0.755 1.00 0.00 H new ATOM 0 HD22 LEU B 37 -10.272 -1.508 2.283 1.00 0.00 H new ATOM 0 HD23 LEU B 37 -8.851 -2.287 1.548 1.00 0.00 H new ATOM 2039 N GLN B 38 -13.563 -3.149 2.965 1.00 0.00 N ATOM 2040 CA GLN B 38 -14.684 -2.268 3.221 1.00 0.00 C ATOM 2041 C GLN B 38 -14.706 -1.871 4.678 1.00 0.00 C ATOM 2042 O GLN B 38 -15.003 -0.735 5.018 1.00 0.00 O ATOM 2043 CB GLN B 38 -16.017 -2.917 2.813 1.00 0.00 C ATOM 2044 CG GLN B 38 -16.283 -4.177 3.638 1.00 0.00 C ATOM 2045 CD GLN B 38 -17.524 -4.883 3.114 1.00 0.00 C ATOM 2046 OE1 GLN B 38 -18.638 -4.486 3.431 1.00 0.00 O ATOM 2047 NE2 GLN B 38 -17.396 -5.901 2.321 1.00 0.00 N ATOM 0 H GLN B 38 -13.810 -4.100 2.693 1.00 0.00 H new ATOM 0 HA GLN B 38 -14.559 -1.373 2.611 1.00 0.00 H new ATOM 0 HB2 GLN B 38 -16.831 -2.206 2.954 1.00 0.00 H new ATOM 0 HB3 GLN B 38 -15.994 -3.169 1.753 1.00 0.00 H new ATOM 0 HG2 GLN B 38 -15.424 -4.845 3.585 1.00 0.00 H new ATOM 0 HG3 GLN B 38 -16.419 -3.914 4.687 1.00 0.00 H new ATOM 0 HE21 GLN B 38 -16.467 -6.229 2.059 1.00 0.00 H new ATOM 0 HE22 GLN B 38 -18.225 -6.373 1.960 1.00 0.00 H new ATOM 2056 N THR B 39 -14.451 -2.834 5.532 1.00 0.00 N ATOM 2057 CA THR B 39 -14.486 -2.607 6.956 1.00 0.00 C ATOM 2058 C THR B 39 -13.388 -1.624 7.394 1.00 0.00 C ATOM 2059 O THR B 39 -13.665 -0.633 8.076 1.00 0.00 O ATOM 2060 CB THR B 39 -14.316 -3.956 7.655 1.00 0.00 C ATOM 2061 OG1 THR B 39 -15.380 -4.821 7.265 1.00 0.00 O ATOM 2062 CG2 THR B 39 -14.340 -3.775 9.164 1.00 0.00 C ATOM 0 H THR B 39 -14.215 -3.789 5.262 1.00 0.00 H new ATOM 0 HA THR B 39 -15.440 -2.157 7.231 1.00 0.00 H new ATOM 0 HB THR B 39 -13.358 -4.389 7.368 1.00 0.00 H new ATOM 0 HG1 THR B 39 -15.245 -5.108 6.338 1.00 0.00 H new ATOM 0 HG21 THR B 39 -14.218 -4.744 9.649 1.00 0.00 H new ATOM 0 HG22 THR B 39 -13.527 -3.114 9.464 1.00 0.00 H new ATOM 0 HG23 THR B 39 -15.292 -3.337 9.463 1.00 0.00 H new ATOM 2070 N GLU B 40 -12.149 -1.912 7.007 1.00 0.00 N ATOM 2071 CA GLU B 40 -11.005 -1.103 7.409 1.00 0.00 C ATOM 2072 C GLU B 40 -10.993 0.270 6.752 1.00 0.00 C ATOM 2073 O GLU B 40 -10.680 1.263 7.405 1.00 0.00 O ATOM 2074 CB GLU B 40 -9.713 -1.867 7.139 1.00 0.00 C ATOM 2075 CG GLU B 40 -9.682 -3.111 8.054 1.00 0.00 C ATOM 2076 CD GLU B 40 -9.667 -2.699 9.524 1.00 0.00 C ATOM 2077 OE1 GLU B 40 -8.667 -2.207 9.975 1.00 0.00 O ATOM 2078 OE2 GLU B 40 -10.683 -2.838 10.166 1.00 0.00 O ATOM 0 H GLU B 40 -11.912 -2.705 6.411 1.00 0.00 H new ATOM 0 HA GLU B 40 -11.090 -0.917 8.480 1.00 0.00 H new ATOM 0 HB2 GLU B 40 -9.660 -2.165 6.092 1.00 0.00 H new ATOM 0 HB3 GLU B 40 -8.849 -1.232 7.333 1.00 0.00 H new ATOM 0 HG2 GLU B 40 -10.552 -3.737 7.855 1.00 0.00 H new ATOM 0 HG3 GLU B 40 -8.800 -3.711 7.830 1.00 0.00 H new ATOM 2085 N LEU B 41 -11.359 0.330 5.476 1.00 0.00 N ATOM 2086 CA LEU B 41 -11.401 1.606 4.743 1.00 0.00 C ATOM 2087 C LEU B 41 -12.837 2.031 4.503 1.00 0.00 C ATOM 2088 O LEU B 41 -13.182 2.541 3.428 1.00 0.00 O ATOM 2089 CB LEU B 41 -10.661 1.502 3.403 1.00 0.00 C ATOM 2090 CG LEU B 41 -9.162 1.743 3.615 1.00 0.00 C ATOM 2091 CD1 LEU B 41 -8.554 0.584 4.407 1.00 0.00 C ATOM 2092 CD2 LEU B 41 -8.467 1.863 2.256 1.00 0.00 C ATOM 0 H LEU B 41 -11.631 -0.483 4.923 1.00 0.00 H new ATOM 0 HA LEU B 41 -10.901 2.357 5.355 1.00 0.00 H new ATOM 0 HB2 LEU B 41 -10.821 0.517 2.964 1.00 0.00 H new ATOM 0 HB3 LEU B 41 -11.060 2.233 2.700 1.00 0.00 H new ATOM 0 HG LEU B 41 -9.022 2.667 4.176 1.00 0.00 H new ATOM 0 HD11 LEU B 41 -7.489 0.763 4.553 1.00 0.00 H new ATOM 0 HD12 LEU B 41 -9.046 0.508 5.377 1.00 0.00 H new ATOM 0 HD13 LEU B 41 -8.693 -0.346 3.856 1.00 0.00 H new ATOM 0 HD21 LEU B 41 -7.401 2.034 2.406 1.00 0.00 H new ATOM 0 HD22 LEU B 41 -8.610 0.942 1.691 1.00 0.00 H new ATOM 0 HD23 LEU B 41 -8.894 2.699 1.701 1.00 0.00 H new ATOM 2104 N SER B 42 -13.681 1.776 5.471 1.00 0.00 N ATOM 2105 CA SER B 42 -15.092 2.056 5.333 1.00 0.00 C ATOM 2106 C SER B 42 -15.340 3.535 5.035 1.00 0.00 C ATOM 2107 O SER B 42 -16.205 3.873 4.209 1.00 0.00 O ATOM 2108 CB SER B 42 -15.820 1.616 6.612 1.00 0.00 C ATOM 2109 OG SER B 42 -14.862 1.480 7.673 1.00 0.00 O ATOM 0 H SER B 42 -13.415 1.372 6.369 1.00 0.00 H new ATOM 0 HA SER B 42 -15.485 1.493 4.486 1.00 0.00 H new ATOM 0 HB2 SER B 42 -16.580 2.348 6.883 1.00 0.00 H new ATOM 0 HB3 SER B 42 -16.334 0.669 6.446 1.00 0.00 H new ATOM 0 HG SER B 42 -14.737 0.531 7.881 1.00 0.00 H new ATOM 2115 N GLY B 43 -14.541 4.404 5.634 1.00 0.00 N ATOM 2116 CA GLY B 43 -14.654 5.831 5.384 1.00 0.00 C ATOM 2117 C GLY B 43 -14.297 6.162 3.943 1.00 0.00 C ATOM 2118 O GLY B 43 -15.094 6.785 3.216 1.00 0.00 O ATOM 0 H GLY B 43 -13.809 4.146 6.295 1.00 0.00 H new ATOM 0 HA2 GLY B 43 -15.671 6.161 5.596 1.00 0.00 H new ATOM 0 HA3 GLY B 43 -13.995 6.376 6.060 1.00 0.00 H new ATOM 2122 N PHE B 44 -13.137 5.680 3.496 1.00 0.00 N ATOM 2123 CA PHE B 44 -12.723 5.878 2.107 1.00 0.00 C ATOM 2124 C PHE B 44 -13.645 5.135 1.183 1.00 0.00 C ATOM 2125 O PHE B 44 -14.056 5.656 0.152 1.00 0.00 O ATOM 2126 CB PHE B 44 -11.269 5.435 1.854 1.00 0.00 C ATOM 2127 CG PHE B 44 -10.293 6.456 2.405 1.00 0.00 C ATOM 2128 CD1 PHE B 44 -10.422 7.813 2.075 1.00 0.00 C ATOM 2129 CD2 PHE B 44 -9.260 6.042 3.244 1.00 0.00 C ATOM 2130 CE1 PHE B 44 -9.517 8.746 2.585 1.00 0.00 C ATOM 2131 CE2 PHE B 44 -8.353 6.975 3.755 1.00 0.00 C ATOM 2132 CZ PHE B 44 -8.479 8.328 3.427 1.00 0.00 C ATOM 0 H PHE B 44 -12.474 5.156 4.068 1.00 0.00 H new ATOM 0 HA PHE B 44 -12.778 6.948 1.909 1.00 0.00 H new ATOM 0 HB2 PHE B 44 -11.092 4.467 2.322 1.00 0.00 H new ATOM 0 HB3 PHE B 44 -11.104 5.307 0.784 1.00 0.00 H new ATOM 0 HD1 PHE B 44 -11.222 8.137 1.426 1.00 0.00 H new ATOM 0 HD2 PHE B 44 -9.160 4.998 3.500 1.00 0.00 H new ATOM 0 HE1 PHE B 44 -9.618 9.791 2.330 1.00 0.00 H new ATOM 0 HE2 PHE B 44 -7.554 6.650 4.404 1.00 0.00 H new ATOM 0 HZ PHE B 44 -7.778 9.049 3.822 1.00 0.00 H new ATOM 2142 N LEU B 45 -14.011 3.934 1.573 1.00 0.00 N ATOM 2143 CA LEU B 45 -14.902 3.135 0.769 1.00 0.00 C ATOM 2144 C LEU B 45 -16.201 3.864 0.567 1.00 0.00 C ATOM 2145 O LEU B 45 -16.663 4.025 -0.558 1.00 0.00 O ATOM 2146 CB LEU B 45 -15.156 1.789 1.473 1.00 0.00 C ATOM 2147 CG LEU B 45 -16.544 1.239 1.105 1.00 0.00 C ATOM 2148 CD1 LEU B 45 -16.668 1.044 -0.404 1.00 0.00 C ATOM 2149 CD2 LEU B 45 -16.777 -0.090 1.810 1.00 0.00 C ATOM 0 H LEU B 45 -13.705 3.492 2.440 1.00 0.00 H new ATOM 0 HA LEU B 45 -14.447 2.952 -0.205 1.00 0.00 H new ATOM 0 HB2 LEU B 45 -14.387 1.072 1.186 1.00 0.00 H new ATOM 0 HB3 LEU B 45 -15.085 1.918 2.553 1.00 0.00 H new ATOM 0 HG LEU B 45 -17.295 1.961 1.426 1.00 0.00 H new ATOM 0 HD11 LEU B 45 -17.658 0.654 -0.640 1.00 0.00 H new ATOM 0 HD12 LEU B 45 -16.525 2.000 -0.907 1.00 0.00 H new ATOM 0 HD13 LEU B 45 -15.910 0.338 -0.743 1.00 0.00 H new ATOM 0 HD21 LEU B 45 -17.762 -0.475 1.545 1.00 0.00 H new ATOM 0 HD22 LEU B 45 -16.014 -0.804 1.501 1.00 0.00 H new ATOM 0 HD23 LEU B 45 -16.722 0.056 2.889 1.00 0.00 H new ATOM 2161 N ASP B 46 -16.744 4.370 1.645 1.00 0.00 N ATOM 2162 CA ASP B 46 -17.988 5.098 1.583 1.00 0.00 C ATOM 2163 C ASP B 46 -17.843 6.323 0.717 1.00 0.00 C ATOM 2164 O ASP B 46 -18.663 6.567 -0.165 1.00 0.00 O ATOM 2165 CB ASP B 46 -18.440 5.465 2.981 1.00 0.00 C ATOM 2166 CG ASP B 46 -19.756 6.192 2.930 1.00 0.00 C ATOM 2167 OD1 ASP B 46 -20.718 5.595 2.505 1.00 0.00 O ATOM 2168 OD2 ASP B 46 -19.790 7.333 3.325 1.00 0.00 O ATOM 0 H ASP B 46 -16.343 4.291 2.580 1.00 0.00 H new ATOM 0 HA ASP B 46 -18.750 4.463 1.131 1.00 0.00 H new ATOM 0 HB2 ASP B 46 -18.538 4.564 3.587 1.00 0.00 H new ATOM 0 HB3 ASP B 46 -17.689 6.092 3.461 1.00 0.00 H new ATOM 2173 N ALA B 47 -16.730 7.009 0.874 1.00 0.00 N ATOM 2174 CA ALA B 47 -16.416 8.127 0.005 1.00 0.00 C ATOM 2175 C ALA B 47 -16.213 7.633 -1.422 1.00 0.00 C ATOM 2176 O ALA B 47 -16.489 8.342 -2.387 1.00 0.00 O ATOM 2177 CB ALA B 47 -15.165 8.857 0.492 1.00 0.00 C ATOM 0 H ALA B 47 -16.030 6.815 1.590 1.00 0.00 H new ATOM 0 HA ALA B 47 -17.251 8.828 0.026 1.00 0.00 H new ATOM 0 HB1 ALA B 47 -14.948 9.692 -0.175 1.00 0.00 H new ATOM 0 HB2 ALA B 47 -15.333 9.233 1.501 1.00 0.00 H new ATOM 0 HB3 ALA B 47 -14.320 8.168 0.497 1.00 0.00 H new ATOM 2183 N GLN B 48 -15.644 6.446 -1.543 1.00 0.00 N ATOM 2184 CA GLN B 48 -15.328 5.863 -2.843 1.00 0.00 C ATOM 2185 C GLN B 48 -16.551 5.261 -3.533 1.00 0.00 C ATOM 2186 O GLN B 48 -16.471 4.885 -4.697 1.00 0.00 O ATOM 2187 CB GLN B 48 -14.212 4.814 -2.722 1.00 0.00 C ATOM 2188 CG GLN B 48 -12.858 5.510 -2.524 1.00 0.00 C ATOM 2189 CD GLN B 48 -12.477 6.278 -3.784 1.00 0.00 C ATOM 2190 OE1 GLN B 48 -11.481 6.989 -3.801 1.00 0.00 O ATOM 2191 NE2 GLN B 48 -13.211 6.175 -4.845 1.00 0.00 N ATOM 0 H GLN B 48 -15.388 5.859 -0.749 1.00 0.00 H new ATOM 0 HA GLN B 48 -14.976 6.683 -3.470 1.00 0.00 H new ATOM 0 HB2 GLN B 48 -14.415 4.150 -1.882 1.00 0.00 H new ATOM 0 HB3 GLN B 48 -14.185 4.195 -3.619 1.00 0.00 H new ATOM 0 HG2 GLN B 48 -12.911 6.191 -1.675 1.00 0.00 H new ATOM 0 HG3 GLN B 48 -12.091 4.771 -2.292 1.00 0.00 H new ATOM 0 HE21 GLN B 48 -14.042 5.583 -4.835 1.00 0.00 H new ATOM 0 HE22 GLN B 48 -12.959 6.685 -5.691 1.00 0.00 H new ATOM 2200 N LYS B 49 -17.652 5.115 -2.808 1.00 0.00 N ATOM 2201 CA LYS B 49 -18.840 4.454 -3.368 1.00 0.00 C ATOM 2202 C LYS B 49 -19.355 5.169 -4.606 1.00 0.00 C ATOM 2203 O LYS B 49 -19.775 4.523 -5.568 1.00 0.00 O ATOM 2204 CB LYS B 49 -19.968 4.310 -2.333 1.00 0.00 C ATOM 2205 CG LYS B 49 -19.592 3.271 -1.281 1.00 0.00 C ATOM 2206 CD LYS B 49 -20.746 3.124 -0.291 1.00 0.00 C ATOM 2207 CE LYS B 49 -20.386 2.085 0.765 1.00 0.00 C ATOM 2208 NZ LYS B 49 -20.325 0.739 0.137 1.00 0.00 N ATOM 0 H LYS B 49 -17.755 5.437 -1.846 1.00 0.00 H new ATOM 0 HA LYS B 49 -18.520 3.453 -3.658 1.00 0.00 H new ATOM 0 HB2 LYS B 49 -20.156 5.271 -1.854 1.00 0.00 H new ATOM 0 HB3 LYS B 49 -20.892 4.016 -2.831 1.00 0.00 H new ATOM 0 HG2 LYS B 49 -19.380 2.313 -1.757 1.00 0.00 H new ATOM 0 HG3 LYS B 49 -18.685 3.575 -0.759 1.00 0.00 H new ATOM 0 HD2 LYS B 49 -20.955 4.083 0.184 1.00 0.00 H new ATOM 0 HD3 LYS B 49 -21.653 2.824 -0.816 1.00 0.00 H new ATOM 0 HE2 LYS B 49 -19.426 2.330 1.219 1.00 0.00 H new ATOM 0 HE3 LYS B 49 -21.127 2.092 1.564 1.00 0.00 H new ATOM 0 HZ1 LYS B 49 -21.126 0.165 0.469 1.00 0.00 H new ATOM 0 HZ2 LYS B 49 -20.373 0.836 -0.897 1.00 0.00 H new ATOM 0 HZ3 LYS B 49 -19.433 0.273 0.400 1.00 0.00 H new ATOM 2222 N ASP B 50 -19.336 6.492 -4.591 1.00 0.00 N ATOM 2223 CA ASP B 50 -19.827 7.252 -5.740 1.00 0.00 C ATOM 2224 C ASP B 50 -18.720 7.520 -6.748 1.00 0.00 C ATOM 2225 O ASP B 50 -18.890 8.327 -7.668 1.00 0.00 O ATOM 2226 CB ASP B 50 -20.502 8.565 -5.316 1.00 0.00 C ATOM 2227 CG ASP B 50 -21.501 8.992 -6.379 1.00 0.00 C ATOM 2228 OD1 ASP B 50 -22.279 8.161 -6.805 1.00 0.00 O ATOM 2229 OD2 ASP B 50 -21.484 10.139 -6.756 1.00 0.00 O ATOM 0 H ASP B 50 -18.994 7.058 -3.814 1.00 0.00 H new ATOM 0 HA ASP B 50 -20.583 6.633 -6.223 1.00 0.00 H new ATOM 0 HB2 ASP B 50 -21.008 8.433 -4.359 1.00 0.00 H new ATOM 0 HB3 ASP B 50 -19.751 9.343 -5.175 1.00 0.00 H new ATOM 2234 N VAL B 51 -17.610 6.817 -6.607 1.00 0.00 N ATOM 2235 CA VAL B 51 -16.516 6.925 -7.557 1.00 0.00 C ATOM 2236 C VAL B 51 -16.305 5.584 -8.235 1.00 0.00 C ATOM 2237 O VAL B 51 -16.125 4.572 -7.566 1.00 0.00 O ATOM 2238 CB VAL B 51 -15.228 7.361 -6.846 1.00 0.00 C ATOM 2239 CG1 VAL B 51 -14.230 7.937 -7.864 1.00 0.00 C ATOM 2240 CG2 VAL B 51 -15.551 8.431 -5.793 1.00 0.00 C ATOM 0 H VAL B 51 -17.442 6.164 -5.842 1.00 0.00 H new ATOM 0 HA VAL B 51 -16.768 7.677 -8.305 1.00 0.00 H new ATOM 0 HB VAL B 51 -14.785 6.491 -6.360 1.00 0.00 H new ATOM 0 HG11 VAL B 51 -13.320 8.243 -7.348 1.00 0.00 H new ATOM 0 HG12 VAL B 51 -13.988 7.177 -8.607 1.00 0.00 H new ATOM 0 HG13 VAL B 51 -14.674 8.800 -8.360 1.00 0.00 H new ATOM 0 HG21 VAL B 51 -14.633 8.737 -5.291 1.00 0.00 H new ATOM 0 HG22 VAL B 51 -16.004 9.295 -6.279 1.00 0.00 H new ATOM 0 HG23 VAL B 51 -16.246 8.022 -5.060 1.00 0.00 H new ATOM 2250 N ASP B 52 -16.307 5.576 -9.554 1.00 0.00 N ATOM 2251 CA ASP B 52 -16.160 4.330 -10.296 1.00 0.00 C ATOM 2252 C ASP B 52 -14.841 3.654 -9.984 1.00 0.00 C ATOM 2253 O ASP B 52 -14.754 2.424 -9.957 1.00 0.00 O ATOM 2254 CB ASP B 52 -16.265 4.560 -11.798 1.00 0.00 C ATOM 2255 CG ASP B 52 -16.271 3.215 -12.496 1.00 0.00 C ATOM 2256 OD1 ASP B 52 -17.241 2.493 -12.356 1.00 0.00 O ATOM 2257 OD2 ASP B 52 -15.305 2.909 -13.145 1.00 0.00 O ATOM 0 H ASP B 52 -16.408 6.409 -10.134 1.00 0.00 H new ATOM 0 HA ASP B 52 -16.976 3.679 -9.981 1.00 0.00 H new ATOM 0 HB2 ASP B 52 -17.175 5.112 -12.033 1.00 0.00 H new ATOM 0 HB3 ASP B 52 -15.427 5.163 -12.147 1.00 0.00 H new ATOM 2262 N ALA B 53 -13.809 4.458 -9.774 1.00 0.00 N ATOM 2263 CA ALA B 53 -12.473 3.934 -9.513 1.00 0.00 C ATOM 2264 C ALA B 53 -12.510 2.795 -8.503 1.00 0.00 C ATOM 2265 O ALA B 53 -11.692 1.878 -8.565 1.00 0.00 O ATOM 2266 CB ALA B 53 -11.541 5.041 -9.006 1.00 0.00 C ATOM 0 H ALA B 53 -13.869 5.476 -9.779 1.00 0.00 H new ATOM 0 HA ALA B 53 -12.088 3.548 -10.457 1.00 0.00 H new ATOM 0 HB1 ALA B 53 -10.551 4.626 -8.819 1.00 0.00 H new ATOM 0 HB2 ALA B 53 -11.468 5.828 -9.757 1.00 0.00 H new ATOM 0 HB3 ALA B 53 -11.940 5.458 -8.081 1.00 0.00 H new ATOM 2272 N VAL B 54 -13.482 2.827 -7.596 1.00 0.00 N ATOM 2273 CA VAL B 54 -13.594 1.771 -6.601 1.00 0.00 C ATOM 2274 C VAL B 54 -13.800 0.427 -7.291 1.00 0.00 C ATOM 2275 O VAL B 54 -13.127 -0.558 -6.971 1.00 0.00 O ATOM 2276 CB VAL B 54 -14.731 2.065 -5.596 1.00 0.00 C ATOM 2277 CG1 VAL B 54 -16.105 1.987 -6.277 1.00 0.00 C ATOM 2278 CG2 VAL B 54 -14.680 1.074 -4.423 1.00 0.00 C ATOM 0 H VAL B 54 -14.190 3.558 -7.531 1.00 0.00 H new ATOM 0 HA VAL B 54 -12.665 1.731 -6.032 1.00 0.00 H new ATOM 0 HB VAL B 54 -14.587 3.077 -5.219 1.00 0.00 H new ATOM 0 HG11 VAL B 54 -16.886 2.198 -5.546 1.00 0.00 H new ATOM 0 HG12 VAL B 54 -16.154 2.720 -7.082 1.00 0.00 H new ATOM 0 HG13 VAL B 54 -16.252 0.988 -6.686 1.00 0.00 H new ATOM 0 HG21 VAL B 54 -15.487 1.295 -3.725 1.00 0.00 H new ATOM 0 HG22 VAL B 54 -14.794 0.058 -4.800 1.00 0.00 H new ATOM 0 HG23 VAL B 54 -13.722 1.165 -3.911 1.00 0.00 H new ATOM 2288 N ASP B 55 -14.650 0.419 -8.314 1.00 0.00 N ATOM 2289 CA ASP B 55 -14.870 -0.781 -9.101 1.00 0.00 C ATOM 2290 C ASP B 55 -13.594 -1.218 -9.750 1.00 0.00 C ATOM 2291 O ASP B 55 -13.202 -2.378 -9.674 1.00 0.00 O ATOM 2292 CB ASP B 55 -15.877 -0.507 -10.217 1.00 0.00 C ATOM 2293 CG ASP B 55 -15.949 -1.714 -11.130 1.00 0.00 C ATOM 2294 OD1 ASP B 55 -16.278 -2.779 -10.657 1.00 0.00 O ATOM 2295 OD2 ASP B 55 -15.663 -1.564 -12.295 1.00 0.00 O ATOM 0 H ASP B 55 -15.194 1.229 -8.613 1.00 0.00 H new ATOM 0 HA ASP B 55 -15.243 -1.553 -8.428 1.00 0.00 H new ATOM 0 HB2 ASP B 55 -16.859 -0.297 -9.793 1.00 0.00 H new ATOM 0 HB3 ASP B 55 -15.579 0.375 -10.783 1.00 0.00 H new ATOM 2300 N LYS B 56 -12.981 -0.294 -10.436 1.00 0.00 N ATOM 2301 CA LYS B 56 -11.792 -0.578 -11.195 1.00 0.00 C ATOM 2302 C LYS B 56 -10.639 -1.008 -10.311 1.00 0.00 C ATOM 2303 O LYS B 56 -9.981 -2.013 -10.590 1.00 0.00 O ATOM 2304 CB LYS B 56 -11.413 0.634 -12.041 1.00 0.00 C ATOM 2305 CG LYS B 56 -12.437 0.816 -13.185 1.00 0.00 C ATOM 2306 CD LYS B 56 -12.076 2.066 -13.983 1.00 0.00 C ATOM 2307 CE LYS B 56 -12.868 2.122 -15.301 1.00 0.00 C ATOM 2308 NZ LYS B 56 -14.310 1.914 -15.050 1.00 0.00 N ATOM 0 H LYS B 56 -13.290 0.677 -10.486 1.00 0.00 H new ATOM 0 HA LYS B 56 -12.009 -1.418 -11.855 1.00 0.00 H new ATOM 0 HB2 LYS B 56 -11.386 1.529 -11.419 1.00 0.00 H new ATOM 0 HB3 LYS B 56 -10.413 0.502 -12.454 1.00 0.00 H new ATOM 0 HG2 LYS B 56 -12.434 -0.059 -13.835 1.00 0.00 H new ATOM 0 HG3 LYS B 56 -13.444 0.907 -12.778 1.00 0.00 H new ATOM 0 HD2 LYS B 56 -12.287 2.955 -13.389 1.00 0.00 H new ATOM 0 HD3 LYS B 56 -11.007 2.071 -14.196 1.00 0.00 H new ATOM 0 HE2 LYS B 56 -12.713 3.087 -15.784 1.00 0.00 H new ATOM 0 HE3 LYS B 56 -12.499 1.359 -15.986 1.00 0.00 H new ATOM 0 HZ1 LYS B 56 -14.855 2.218 -15.882 1.00 0.00 H new ATOM 0 HZ2 LYS B 56 -14.489 0.906 -14.869 1.00 0.00 H new ATOM 0 HZ3 LYS B 56 -14.602 2.472 -14.222 1.00 0.00 H new ATOM 2322 N VAL B 57 -10.469 -0.333 -9.189 1.00 0.00 N ATOM 2323 CA VAL B 57 -9.418 -0.702 -8.261 1.00 0.00 C ATOM 2324 C VAL B 57 -9.691 -2.090 -7.738 1.00 0.00 C ATOM 2325 O VAL B 57 -8.838 -2.983 -7.793 1.00 0.00 O ATOM 2326 CB VAL B 57 -9.348 0.311 -7.100 1.00 0.00 C ATOM 2327 CG1 VAL B 57 -8.374 -0.186 -6.038 1.00 0.00 C ATOM 2328 CG2 VAL B 57 -8.862 1.667 -7.622 1.00 0.00 C ATOM 0 H VAL B 57 -11.037 0.464 -8.901 1.00 0.00 H new ATOM 0 HA VAL B 57 -8.456 -0.692 -8.774 1.00 0.00 H new ATOM 0 HB VAL B 57 -10.343 0.418 -6.667 1.00 0.00 H new ATOM 0 HG11 VAL B 57 -8.329 0.534 -5.221 1.00 0.00 H new ATOM 0 HG12 VAL B 57 -8.713 -1.149 -5.656 1.00 0.00 H new ATOM 0 HG13 VAL B 57 -7.383 -0.299 -6.477 1.00 0.00 H new ATOM 0 HG21 VAL B 57 -8.815 2.378 -6.798 1.00 0.00 H new ATOM 0 HG22 VAL B 57 -7.871 1.554 -8.061 1.00 0.00 H new ATOM 0 HG23 VAL B 57 -9.554 2.035 -8.379 1.00 0.00 H new ATOM 2338 N MET B 58 -10.918 -2.295 -7.340 1.00 0.00 N ATOM 2339 CA MET B 58 -11.353 -3.581 -6.884 1.00 0.00 C ATOM 2340 C MET B 58 -11.253 -4.608 -8.002 1.00 0.00 C ATOM 2341 O MET B 58 -10.814 -5.745 -7.780 1.00 0.00 O ATOM 2342 CB MET B 58 -12.788 -3.478 -6.363 1.00 0.00 C ATOM 2343 CG MET B 58 -13.274 -4.850 -5.940 1.00 0.00 C ATOM 2344 SD MET B 58 -14.935 -4.718 -5.217 1.00 0.00 S ATOM 2345 CE MET B 58 -15.835 -4.365 -6.752 1.00 0.00 C ATOM 0 H MET B 58 -11.640 -1.575 -7.324 1.00 0.00 H new ATOM 0 HA MET B 58 -10.705 -3.912 -6.072 1.00 0.00 H new ATOM 0 HB2 MET B 58 -12.831 -2.790 -5.519 1.00 0.00 H new ATOM 0 HB3 MET B 58 -13.439 -3.073 -7.138 1.00 0.00 H new ATOM 0 HG2 MET B 58 -13.294 -5.520 -6.800 1.00 0.00 H new ATOM 0 HG3 MET B 58 -12.585 -5.282 -5.215 1.00 0.00 H new ATOM 0 HE1 MET B 58 -16.731 -4.984 -6.799 1.00 0.00 H new ATOM 0 HE2 MET B 58 -16.120 -3.313 -6.773 1.00 0.00 H new ATOM 0 HE3 MET B 58 -15.196 -4.585 -7.607 1.00 0.00 H new ATOM 2355 N LYS B 59 -11.660 -4.207 -9.198 1.00 0.00 N ATOM 2356 CA LYS B 59 -11.638 -5.089 -10.354 1.00 0.00 C ATOM 2357 C LYS B 59 -10.218 -5.482 -10.700 1.00 0.00 C ATOM 2358 O LYS B 59 -9.936 -6.644 -10.964 1.00 0.00 O ATOM 2359 CB LYS B 59 -12.332 -4.446 -11.555 1.00 0.00 C ATOM 2360 CG LYS B 59 -12.660 -5.517 -12.608 1.00 0.00 C ATOM 2361 CD LYS B 59 -13.738 -6.503 -12.092 1.00 0.00 C ATOM 2362 CE LYS B 59 -14.856 -5.775 -11.313 1.00 0.00 C ATOM 2363 NZ LYS B 59 -15.296 -4.564 -12.055 1.00 0.00 N ATOM 0 H LYS B 59 -12.012 -3.270 -9.393 1.00 0.00 H new ATOM 0 HA LYS B 59 -12.190 -5.993 -10.096 1.00 0.00 H new ATOM 0 HB2 LYS B 59 -13.247 -3.948 -11.233 1.00 0.00 H new ATOM 0 HB3 LYS B 59 -11.689 -3.681 -11.990 1.00 0.00 H new ATOM 0 HG2 LYS B 59 -13.011 -5.037 -13.521 1.00 0.00 H new ATOM 0 HG3 LYS B 59 -11.755 -6.067 -12.865 1.00 0.00 H new ATOM 0 HD2 LYS B 59 -14.173 -7.040 -12.935 1.00 0.00 H new ATOM 0 HD3 LYS B 59 -13.271 -7.247 -11.447 1.00 0.00 H new ATOM 0 HE2 LYS B 59 -15.702 -6.446 -11.164 1.00 0.00 H new ATOM 0 HE3 LYS B 59 -14.495 -5.493 -10.324 1.00 0.00 H new ATOM 0 HZ1 LYS B 59 -16.060 -4.093 -11.529 1.00 0.00 H new ATOM 0 HZ2 LYS B 59 -14.494 -3.911 -12.160 1.00 0.00 H new ATOM 0 HZ3 LYS B 59 -15.643 -4.840 -12.996 1.00 0.00 H new ATOM 2377 N GLU B 60 -9.304 -4.533 -10.642 1.00 0.00 N ATOM 2378 CA GLU B 60 -7.915 -4.860 -10.904 1.00 0.00 C ATOM 2379 C GLU B 60 -7.442 -5.877 -9.875 1.00 0.00 C ATOM 2380 O GLU B 60 -6.848 -6.899 -10.226 1.00 0.00 O ATOM 2381 CB GLU B 60 -7.038 -3.617 -10.844 1.00 0.00 C ATOM 2382 CG GLU B 60 -7.340 -2.684 -12.031 1.00 0.00 C ATOM 2383 CD GLU B 60 -6.486 -1.430 -11.948 1.00 0.00 C ATOM 2384 OE1 GLU B 60 -5.557 -1.410 -11.174 1.00 0.00 O ATOM 2385 OE2 GLU B 60 -6.776 -0.501 -12.650 1.00 0.00 O ATOM 0 H GLU B 60 -9.489 -3.554 -10.422 1.00 0.00 H new ATOM 0 HA GLU B 60 -7.836 -5.278 -11.907 1.00 0.00 H new ATOM 0 HB2 GLU B 60 -7.210 -3.089 -9.906 1.00 0.00 H new ATOM 0 HB3 GLU B 60 -5.987 -3.906 -10.859 1.00 0.00 H new ATOM 0 HG2 GLU B 60 -7.145 -3.203 -12.969 1.00 0.00 H new ATOM 0 HG3 GLU B 60 -8.396 -2.414 -12.030 1.00 0.00 H new ATOM 2392 N LEU B 61 -7.854 -5.678 -8.630 1.00 0.00 N ATOM 2393 CA LEU B 61 -7.613 -6.672 -7.595 1.00 0.00 C ATOM 2394 C LEU B 61 -8.349 -7.950 -7.946 1.00 0.00 C ATOM 2395 O LEU B 61 -7.847 -9.058 -7.723 1.00 0.00 O ATOM 2396 CB LEU B 61 -8.035 -6.164 -6.208 1.00 0.00 C ATOM 2397 CG LEU B 61 -6.881 -5.391 -5.534 1.00 0.00 C ATOM 2398 CD1 LEU B 61 -5.861 -6.372 -4.947 1.00 0.00 C ATOM 2399 CD2 LEU B 61 -6.178 -4.464 -6.536 1.00 0.00 C ATOM 0 H LEU B 61 -8.352 -4.845 -8.315 1.00 0.00 H new ATOM 0 HA LEU B 61 -6.542 -6.870 -7.549 1.00 0.00 H new ATOM 0 HB2 LEU B 61 -8.907 -5.516 -6.302 1.00 0.00 H new ATOM 0 HB3 LEU B 61 -8.330 -7.006 -5.581 1.00 0.00 H new ATOM 0 HG LEU B 61 -7.306 -4.783 -4.735 1.00 0.00 H new ATOM 0 HD11 LEU B 61 -5.052 -5.816 -4.474 1.00 0.00 H new ATOM 0 HD12 LEU B 61 -6.349 -7.004 -4.205 1.00 0.00 H new ATOM 0 HD13 LEU B 61 -5.456 -6.996 -5.744 1.00 0.00 H new ATOM 0 HD21 LEU B 61 -5.370 -3.932 -6.034 1.00 0.00 H new ATOM 0 HD22 LEU B 61 -5.769 -5.056 -7.355 1.00 0.00 H new ATOM 0 HD23 LEU B 61 -6.895 -3.745 -6.931 1.00 0.00 H new ATOM 2411 N ASP B 62 -9.549 -7.804 -8.485 1.00 0.00 N ATOM 2412 CA ASP B 62 -10.322 -8.962 -8.905 1.00 0.00 C ATOM 2413 C ASP B 62 -9.550 -9.714 -9.976 1.00 0.00 C ATOM 2414 O ASP B 62 -9.405 -10.940 -9.909 1.00 0.00 O ATOM 2415 CB ASP B 62 -11.688 -8.533 -9.463 1.00 0.00 C ATOM 2416 CG ASP B 62 -12.593 -9.740 -9.606 1.00 0.00 C ATOM 2417 OD1 ASP B 62 -12.958 -10.300 -8.597 1.00 0.00 O ATOM 2418 OD2 ASP B 62 -12.925 -10.083 -10.717 1.00 0.00 O ATOM 0 H ASP B 62 -10.005 -6.905 -8.641 1.00 0.00 H new ATOM 0 HA ASP B 62 -10.489 -9.606 -8.041 1.00 0.00 H new ATOM 0 HB2 ASP B 62 -12.147 -7.801 -8.799 1.00 0.00 H new ATOM 0 HB3 ASP B 62 -11.559 -8.049 -10.431 1.00 0.00 H new ATOM 2423 N GLU B 63 -9.013 -8.962 -10.934 1.00 0.00 N ATOM 2424 CA GLU B 63 -8.219 -9.535 -12.010 1.00 0.00 C ATOM 2425 C GLU B 63 -6.904 -10.079 -11.482 1.00 0.00 C ATOM 2426 O GLU B 63 -6.520 -11.202 -11.788 1.00 0.00 O ATOM 2427 CB GLU B 63 -7.918 -8.459 -13.058 1.00 0.00 C ATOM 2428 CG GLU B 63 -9.214 -8.040 -13.749 1.00 0.00 C ATOM 2429 CD GLU B 63 -8.978 -6.880 -14.699 1.00 0.00 C ATOM 2430 OE1 GLU B 63 -7.841 -6.498 -14.886 1.00 0.00 O ATOM 2431 OE2 GLU B 63 -9.937 -6.385 -15.229 1.00 0.00 O ATOM 0 H GLU B 63 -9.116 -7.948 -10.984 1.00 0.00 H new ATOM 0 HA GLU B 63 -8.790 -10.350 -12.455 1.00 0.00 H new ATOM 0 HB2 GLU B 63 -7.451 -7.596 -12.584 1.00 0.00 H new ATOM 0 HB3 GLU B 63 -7.209 -8.841 -13.793 1.00 0.00 H new ATOM 0 HG2 GLU B 63 -9.626 -8.886 -14.299 1.00 0.00 H new ATOM 0 HG3 GLU B 63 -9.953 -7.756 -13.000 1.00 0.00 H new ATOM 2438 N ASN B 64 -6.181 -9.250 -10.745 1.00 0.00 N ATOM 2439 CA ASN B 64 -4.867 -9.645 -10.235 1.00 0.00 C ATOM 2440 C ASN B 64 -5.013 -10.707 -9.181 1.00 0.00 C ATOM 2441 O ASN B 64 -4.401 -11.775 -9.254 1.00 0.00 O ATOM 2442 CB ASN B 64 -4.156 -8.456 -9.618 1.00 0.00 C ATOM 2443 CG ASN B 64 -2.643 -8.641 -9.715 1.00 0.00 C ATOM 2444 OD1 ASN B 64 -2.155 -9.774 -9.701 1.00 0.00 O ATOM 2445 ND2 ASN B 64 -1.868 -7.605 -9.811 1.00 0.00 N ATOM 0 H ASN B 64 -6.473 -8.308 -10.486 1.00 0.00 H new ATOM 0 HA ASN B 64 -4.286 -10.029 -11.074 1.00 0.00 H new ATOM 0 HB2 ASN B 64 -4.452 -7.540 -10.130 1.00 0.00 H new ATOM 0 HB3 ASN B 64 -4.451 -8.348 -8.574 1.00 0.00 H new ATOM 0 HD21 ASN B 64 -0.857 -7.728 -9.875 1.00 0.00 H new ATOM 0 HD22 ASN B 64 -2.269 -6.667 -9.823 1.00 0.00 H new ATOM 2452 N GLY B 65 -5.908 -10.450 -8.248 1.00 0.00 N ATOM 2453 CA GLY B 65 -6.214 -11.394 -7.204 1.00 0.00 C ATOM 2454 C GLY B 65 -7.094 -12.462 -7.764 1.00 0.00 C ATOM 2455 O GLY B 65 -8.130 -12.800 -7.181 1.00 0.00 O ATOM 0 H GLY B 65 -6.440 -9.581 -8.196 1.00 0.00 H new ATOM 0 HA2 GLY B 65 -5.297 -11.830 -6.808 1.00 0.00 H new ATOM 0 HA3 GLY B 65 -6.712 -10.891 -6.375 1.00 0.00 H new ATOM 2459 N ASP B 66 -6.715 -12.954 -8.929 1.00 0.00 N ATOM 2460 CA ASP B 66 -7.480 -13.966 -9.611 1.00 0.00 C ATOM 2461 C ASP B 66 -7.548 -15.185 -8.745 1.00 0.00 C ATOM 2462 O ASP B 66 -8.557 -15.892 -8.709 1.00 0.00 O ATOM 2463 CB ASP B 66 -6.838 -14.314 -10.951 1.00 0.00 C ATOM 2464 CG ASP B 66 -7.780 -15.163 -11.760 1.00 0.00 C ATOM 2465 OD1 ASP B 66 -8.819 -14.667 -12.137 1.00 0.00 O ATOM 2466 OD2 ASP B 66 -7.456 -16.296 -12.002 1.00 0.00 O ATOM 0 H ASP B 66 -5.872 -12.661 -9.422 1.00 0.00 H new ATOM 0 HA ASP B 66 -8.485 -13.589 -9.804 1.00 0.00 H new ATOM 0 HB2 ASP B 66 -6.596 -13.402 -11.497 1.00 0.00 H new ATOM 0 HB3 ASP B 66 -5.901 -14.847 -10.789 1.00 0.00 H new ATOM 2471 N GLY B 67 -6.478 -15.406 -8.019 1.00 0.00 N ATOM 2472 CA GLY B 67 -6.407 -16.510 -7.083 1.00 0.00 C ATOM 2473 C GLY B 67 -6.451 -15.990 -5.663 1.00 0.00 C ATOM 2474 O GLY B 67 -7.381 -16.284 -4.906 1.00 0.00 O ATOM 0 H GLY B 67 -5.636 -14.832 -8.057 1.00 0.00 H new ATOM 0 HA2 GLY B 67 -7.237 -17.196 -7.254 1.00 0.00 H new ATOM 0 HA3 GLY B 67 -5.489 -17.075 -7.244 1.00 0.00 H new ATOM 2478 N GLU B 68 -5.449 -15.205 -5.315 1.00 0.00 N ATOM 2479 CA GLU B 68 -5.310 -14.647 -3.980 1.00 0.00 C ATOM 2480 C GLU B 68 -4.829 -13.207 -4.076 1.00 0.00 C ATOM 2481 O GLU B 68 -4.335 -12.790 -5.119 1.00 0.00 O ATOM 2482 CB GLU B 68 -4.274 -15.470 -3.211 1.00 0.00 C ATOM 2483 CG GLU B 68 -4.814 -16.886 -2.937 1.00 0.00 C ATOM 2484 CD GLU B 68 -3.703 -17.789 -2.406 1.00 0.00 C ATOM 2485 OE1 GLU B 68 -2.568 -17.358 -2.385 1.00 0.00 O ATOM 2486 OE2 GLU B 68 -4.001 -18.899 -2.031 1.00 0.00 O ATOM 0 H GLU B 68 -4.702 -14.934 -5.954 1.00 0.00 H new ATOM 0 HA GLU B 68 -6.271 -14.674 -3.467 1.00 0.00 H new ATOM 0 HB2 GLU B 68 -3.349 -15.531 -3.785 1.00 0.00 H new ATOM 0 HB3 GLU B 68 -4.033 -14.976 -2.269 1.00 0.00 H new ATOM 0 HG2 GLU B 68 -5.628 -16.837 -2.214 1.00 0.00 H new ATOM 0 HG3 GLU B 68 -5.227 -17.308 -3.853 1.00 0.00 H new ATOM 2493 N VAL B 69 -4.862 -12.496 -2.962 1.00 0.00 N ATOM 2494 CA VAL B 69 -4.317 -11.143 -2.888 1.00 0.00 C ATOM 2495 C VAL B 69 -3.241 -11.086 -1.800 1.00 0.00 C ATOM 2496 O VAL B 69 -3.454 -11.565 -0.683 1.00 0.00 O ATOM 2497 CB VAL B 69 -5.462 -10.110 -2.639 1.00 0.00 C ATOM 2498 CG1 VAL B 69 -6.444 -10.633 -1.592 1.00 0.00 C ATOM 2499 CG2 VAL B 69 -4.899 -8.759 -2.163 1.00 0.00 C ATOM 0 H VAL B 69 -5.263 -12.833 -2.087 1.00 0.00 H new ATOM 0 HA VAL B 69 -3.850 -10.879 -3.837 1.00 0.00 H new ATOM 0 HB VAL B 69 -5.980 -9.967 -3.587 1.00 0.00 H new ATOM 0 HG11 VAL B 69 -7.233 -9.898 -1.434 1.00 0.00 H new ATOM 0 HG12 VAL B 69 -6.883 -11.568 -1.940 1.00 0.00 H new ATOM 0 HG13 VAL B 69 -5.917 -10.807 -0.654 1.00 0.00 H new ATOM 0 HG21 VAL B 69 -5.720 -8.061 -1.998 1.00 0.00 H new ATOM 0 HG22 VAL B 69 -4.351 -8.901 -1.232 1.00 0.00 H new ATOM 0 HG23 VAL B 69 -4.227 -8.357 -2.922 1.00 0.00 H new ATOM 2509 N ASP B 70 -2.058 -10.582 -2.144 1.00 0.00 N ATOM 2510 CA ASP B 70 -0.968 -10.508 -1.174 1.00 0.00 C ATOM 2511 C ASP B 70 -0.942 -9.158 -0.486 1.00 0.00 C ATOM 2512 O ASP B 70 -1.759 -8.285 -0.778 1.00 0.00 O ATOM 2513 CB ASP B 70 0.399 -10.839 -1.799 1.00 0.00 C ATOM 2514 CG ASP B 70 1.194 -9.583 -2.074 1.00 0.00 C ATOM 2515 OD1 ASP B 70 0.930 -8.950 -3.060 1.00 0.00 O ATOM 2516 OD2 ASP B 70 2.070 -9.284 -1.287 1.00 0.00 O ATOM 0 H ASP B 70 -1.831 -10.224 -3.072 1.00 0.00 H new ATOM 0 HA ASP B 70 -1.163 -11.272 -0.421 1.00 0.00 H new ATOM 0 HB2 ASP B 70 0.961 -11.488 -1.128 1.00 0.00 H new ATOM 0 HB3 ASP B 70 0.253 -11.391 -2.728 1.00 0.00 H new ATOM 2521 N PHE B 71 0.005 -8.976 0.413 1.00 0.00 N ATOM 2522 CA PHE B 71 0.132 -7.720 1.119 1.00 0.00 C ATOM 2523 C PHE B 71 0.403 -6.607 0.118 1.00 0.00 C ATOM 2524 O PHE B 71 -0.271 -5.572 0.127 1.00 0.00 O ATOM 2525 CB PHE B 71 1.246 -7.790 2.163 1.00 0.00 C ATOM 2526 CG PHE B 71 1.217 -6.537 3.017 1.00 0.00 C ATOM 2527 CD1 PHE B 71 0.153 -6.333 3.906 1.00 0.00 C ATOM 2528 CD2 PHE B 71 2.251 -5.591 2.938 1.00 0.00 C ATOM 2529 CE1 PHE B 71 0.122 -5.190 4.706 1.00 0.00 C ATOM 2530 CE2 PHE B 71 2.211 -4.449 3.743 1.00 0.00 C ATOM 2531 CZ PHE B 71 1.151 -4.249 4.626 1.00 0.00 C ATOM 0 H PHE B 71 0.696 -9.681 0.670 1.00 0.00 H new ATOM 0 HA PHE B 71 -0.800 -7.512 1.646 1.00 0.00 H new ATOM 0 HB2 PHE B 71 1.117 -8.673 2.789 1.00 0.00 H new ATOM 0 HB3 PHE B 71 2.214 -7.886 1.672 1.00 0.00 H new ATOM 0 HD1 PHE B 71 -0.643 -7.060 3.972 1.00 0.00 H new ATOM 0 HD2 PHE B 71 3.075 -5.745 2.257 1.00 0.00 H new ATOM 0 HE1 PHE B 71 -0.700 -5.033 5.389 1.00 0.00 H new ATOM 0 HE2 PHE B 71 3.004 -3.719 3.681 1.00 0.00 H new ATOM 0 HZ PHE B 71 1.125 -3.367 5.248 1.00 0.00 H new ATOM 2541 N GLN B 72 1.307 -6.878 -0.819 1.00 0.00 N ATOM 2542 CA GLN B 72 1.596 -5.950 -1.896 1.00 0.00 C ATOM 2543 C GLN B 72 0.344 -5.671 -2.724 1.00 0.00 C ATOM 2544 O GLN B 72 0.050 -4.516 -3.037 1.00 0.00 O ATOM 2545 CB GLN B 72 2.750 -6.470 -2.766 1.00 0.00 C ATOM 2546 CG GLN B 72 4.090 -6.218 -2.077 1.00 0.00 C ATOM 2547 CD GLN B 72 5.207 -6.892 -2.869 1.00 0.00 C ATOM 2548 OE1 GLN B 72 5.929 -6.194 -3.685 1.00 0.00 O flip ATOM 2549 NE2 GLN B 72 5.404 -8.101 -2.758 1.00 0.00 N flip ATOM 0 H GLN B 72 1.852 -7.739 -0.850 1.00 0.00 H new ATOM 0 HA GLN B 72 1.915 -5.003 -1.460 1.00 0.00 H new ATOM 0 HB2 GLN B 72 2.623 -7.537 -2.950 1.00 0.00 H new ATOM 0 HB3 GLN B 72 2.734 -5.975 -3.737 1.00 0.00 H new ATOM 0 HG2 GLN B 72 4.277 -5.147 -2.004 1.00 0.00 H new ATOM 0 HG3 GLN B 72 4.066 -6.607 -1.059 1.00 0.00 H new ATOM 0 HE21 GLN B 72 4.836 -8.653 -2.115 1.00 0.00 H new ATOM 0 HE22 GLN B 72 6.135 -8.551 -3.308 1.00 0.00 H new ATOM 2558 N GLU B 73 -0.440 -6.704 -2.992 1.00 0.00 N ATOM 2559 CA GLU B 73 -1.720 -6.508 -3.673 1.00 0.00 C ATOM 2560 C GLU B 73 -2.666 -5.728 -2.748 1.00 0.00 C ATOM 2561 O GLU B 73 -3.414 -4.847 -3.182 1.00 0.00 O ATOM 2562 CB GLU B 73 -2.369 -7.861 -3.990 1.00 0.00 C ATOM 2563 CG GLU B 73 -1.559 -8.630 -5.040 1.00 0.00 C ATOM 2564 CD GLU B 73 -2.191 -9.990 -5.263 1.00 0.00 C ATOM 2565 OE1 GLU B 73 -3.231 -10.038 -5.887 1.00 0.00 O ATOM 2566 OE2 GLU B 73 -1.623 -10.976 -4.812 1.00 0.00 O ATOM 0 H GLU B 73 -0.222 -7.672 -2.755 1.00 0.00 H new ATOM 0 HA GLU B 73 -1.543 -5.961 -4.599 1.00 0.00 H new ATOM 0 HB2 GLU B 73 -2.444 -8.454 -3.079 1.00 0.00 H new ATOM 0 HB3 GLU B 73 -3.385 -7.704 -4.353 1.00 0.00 H new ATOM 0 HG2 GLU B 73 -1.531 -8.071 -5.976 1.00 0.00 H new ATOM 0 HG3 GLU B 73 -0.528 -8.746 -4.707 1.00 0.00 H new ATOM 2573 N TYR B 74 -2.673 -6.120 -1.484 1.00 0.00 N ATOM 2574 CA TYR B 74 -3.560 -5.532 -0.488 1.00 0.00 C ATOM 2575 C TYR B 74 -3.275 -4.050 -0.268 1.00 0.00 C ATOM 2576 O TYR B 74 -4.200 -3.229 -0.263 1.00 0.00 O ATOM 2577 CB TYR B 74 -3.452 -6.308 0.831 1.00 0.00 C ATOM 2578 CG TYR B 74 -4.295 -5.652 1.902 1.00 0.00 C ATOM 2579 CD1 TYR B 74 -5.661 -5.436 1.679 1.00 0.00 C ATOM 2580 CD2 TYR B 74 -3.720 -5.285 3.124 1.00 0.00 C ATOM 2581 CE1 TYR B 74 -6.444 -4.849 2.669 1.00 0.00 C ATOM 2582 CE2 TYR B 74 -4.505 -4.696 4.118 1.00 0.00 C ATOM 2583 CZ TYR B 74 -5.869 -4.478 3.889 1.00 0.00 C ATOM 2584 OH TYR B 74 -6.648 -3.901 4.861 1.00 0.00 O ATOM 0 H TYR B 74 -2.066 -6.853 -1.118 1.00 0.00 H new ATOM 0 HA TYR B 74 -4.580 -5.606 -0.866 1.00 0.00 H new ATOM 0 HB2 TYR B 74 -3.779 -7.337 0.682 1.00 0.00 H new ATOM 0 HB3 TYR B 74 -2.411 -6.347 1.152 1.00 0.00 H new ATOM 0 HD1 TYR B 74 -6.107 -5.725 0.739 1.00 0.00 H new ATOM 0 HD2 TYR B 74 -2.668 -5.457 3.299 1.00 0.00 H new ATOM 0 HE1 TYR B 74 -7.496 -4.680 2.495 1.00 0.00 H new ATOM 0 HE2 TYR B 74 -4.061 -4.410 5.060 1.00 0.00 H new ATOM 0 HH TYR B 74 -7.570 -3.824 4.538 1.00 0.00 H new ATOM 2594 N VAL B 75 -2.010 -3.707 -0.069 1.00 0.00 N ATOM 2595 CA VAL B 75 -1.657 -2.320 0.210 1.00 0.00 C ATOM 2596 C VAL B 75 -2.015 -1.398 -0.947 1.00 0.00 C ATOM 2597 O VAL B 75 -2.539 -0.303 -0.738 1.00 0.00 O ATOM 2598 CB VAL B 75 -0.180 -2.172 0.586 1.00 0.00 C ATOM 2599 CG1 VAL B 75 0.057 -2.763 1.987 1.00 0.00 C ATOM 2600 CG2 VAL B 75 0.697 -2.907 -0.430 1.00 0.00 C ATOM 0 H VAL B 75 -1.223 -4.356 -0.094 1.00 0.00 H new ATOM 0 HA VAL B 75 -2.252 -2.016 1.072 1.00 0.00 H new ATOM 0 HB VAL B 75 0.081 -1.114 0.585 1.00 0.00 H new ATOM 0 HG11 VAL B 75 1.109 -2.657 2.253 1.00 0.00 H new ATOM 0 HG12 VAL B 75 -0.557 -2.232 2.715 1.00 0.00 H new ATOM 0 HG13 VAL B 75 -0.213 -3.819 1.987 1.00 0.00 H new ATOM 0 HG21 VAL B 75 1.745 -2.796 -0.154 1.00 0.00 H new ATOM 0 HG22 VAL B 75 0.435 -3.965 -0.439 1.00 0.00 H new ATOM 0 HG23 VAL B 75 0.537 -2.485 -1.422 1.00 0.00 H new ATOM 2610 N VAL B 76 -1.772 -1.848 -2.169 1.00 0.00 N ATOM 2611 CA VAL B 76 -2.116 -1.051 -3.322 1.00 0.00 C ATOM 2612 C VAL B 76 -3.626 -0.869 -3.395 1.00 0.00 C ATOM 2613 O VAL B 76 -4.111 0.211 -3.719 1.00 0.00 O ATOM 2614 CB VAL B 76 -1.539 -1.659 -4.626 1.00 0.00 C ATOM 2615 CG1 VAL B 76 -2.156 -3.029 -4.913 1.00 0.00 C ATOM 2616 CG2 VAL B 76 -1.805 -0.720 -5.810 1.00 0.00 C ATOM 0 H VAL B 76 -1.344 -2.749 -2.380 1.00 0.00 H new ATOM 0 HA VAL B 76 -1.661 -0.066 -3.214 1.00 0.00 H new ATOM 0 HB VAL B 76 -0.464 -1.782 -4.492 1.00 0.00 H new ATOM 0 HG11 VAL B 76 -1.734 -3.433 -5.833 1.00 0.00 H new ATOM 0 HG12 VAL B 76 -1.939 -3.706 -4.087 1.00 0.00 H new ATOM 0 HG13 VAL B 76 -3.235 -2.926 -5.024 1.00 0.00 H new ATOM 0 HG21 VAL B 76 -1.395 -1.157 -6.720 1.00 0.00 H new ATOM 0 HG22 VAL B 76 -2.879 -0.578 -5.927 1.00 0.00 H new ATOM 0 HG23 VAL B 76 -1.330 0.243 -5.624 1.00 0.00 H new ATOM 2626 N LEU B 77 -4.365 -1.917 -3.037 1.00 0.00 N ATOM 2627 CA LEU B 77 -5.820 -1.849 -3.048 1.00 0.00 C ATOM 2628 C LEU B 77 -6.312 -0.786 -2.084 1.00 0.00 C ATOM 2629 O LEU B 77 -7.085 0.099 -2.463 1.00 0.00 O ATOM 2630 CB LEU B 77 -6.414 -3.221 -2.657 1.00 0.00 C ATOM 2631 CG LEU B 77 -7.954 -3.142 -2.563 1.00 0.00 C ATOM 2632 CD1 LEU B 77 -8.553 -2.688 -3.891 1.00 0.00 C ATOM 2633 CD2 LEU B 77 -8.525 -4.514 -2.187 1.00 0.00 C ATOM 0 H LEU B 77 -3.983 -2.814 -2.739 1.00 0.00 H new ATOM 0 HA LEU B 77 -6.146 -1.586 -4.054 1.00 0.00 H new ATOM 0 HB2 LEU B 77 -6.128 -3.971 -3.395 1.00 0.00 H new ATOM 0 HB3 LEU B 77 -6.002 -3.542 -1.700 1.00 0.00 H new ATOM 0 HG LEU B 77 -8.214 -2.415 -1.794 1.00 0.00 H new ATOM 0 HD11 LEU B 77 -9.638 -2.639 -3.803 1.00 0.00 H new ATOM 0 HD12 LEU B 77 -8.165 -1.702 -4.147 1.00 0.00 H new ATOM 0 HD13 LEU B 77 -8.284 -3.398 -4.673 1.00 0.00 H new ATOM 0 HD21 LEU B 77 -9.611 -4.451 -2.122 1.00 0.00 H new ATOM 0 HD22 LEU B 77 -8.249 -5.244 -2.948 1.00 0.00 H new ATOM 0 HD23 LEU B 77 -8.122 -4.824 -1.223 1.00 0.00 H new ATOM 2645 N VAL B 78 -5.803 -0.815 -0.865 1.00 0.00 N ATOM 2646 CA VAL B 78 -6.169 0.207 0.097 1.00 0.00 C ATOM 2647 C VAL B 78 -5.607 1.559 -0.318 1.00 0.00 C ATOM 2648 O VAL B 78 -6.308 2.575 -0.288 1.00 0.00 O ATOM 2649 CB VAL B 78 -5.742 -0.166 1.539 1.00 0.00 C ATOM 2650 CG1 VAL B 78 -6.493 -1.420 1.995 1.00 0.00 C ATOM 2651 CG2 VAL B 78 -4.243 -0.442 1.604 1.00 0.00 C ATOM 0 H VAL B 78 -5.149 -1.519 -0.523 1.00 0.00 H new ATOM 0 HA VAL B 78 -7.257 0.276 0.103 1.00 0.00 H new ATOM 0 HB VAL B 78 -5.981 0.674 2.192 1.00 0.00 H new ATOM 0 HG11 VAL B 78 -6.189 -1.678 3.009 1.00 0.00 H new ATOM 0 HG12 VAL B 78 -7.566 -1.229 1.975 1.00 0.00 H new ATOM 0 HG13 VAL B 78 -6.260 -2.248 1.325 1.00 0.00 H new ATOM 0 HG21 VAL B 78 -3.965 -0.702 2.625 1.00 0.00 H new ATOM 0 HG22 VAL B 78 -3.996 -1.270 0.939 1.00 0.00 H new ATOM 0 HG23 VAL B 78 -3.695 0.448 1.294 1.00 0.00 H new ATOM 2661 N ALA B 79 -4.354 1.564 -0.762 1.00 0.00 N ATOM 2662 CA ALA B 79 -3.719 2.798 -1.199 1.00 0.00 C ATOM 2663 C ALA B 79 -4.431 3.371 -2.400 1.00 0.00 C ATOM 2664 O ALA B 79 -4.650 4.581 -2.485 1.00 0.00 O ATOM 2665 CB ALA B 79 -2.259 2.555 -1.549 1.00 0.00 C ATOM 0 H ALA B 79 -3.764 0.734 -0.828 1.00 0.00 H new ATOM 0 HA ALA B 79 -3.778 3.510 -0.376 1.00 0.00 H new ATOM 0 HB1 ALA B 79 -1.802 3.490 -1.873 1.00 0.00 H new ATOM 0 HB2 ALA B 79 -1.732 2.179 -0.672 1.00 0.00 H new ATOM 0 HB3 ALA B 79 -2.195 1.822 -2.353 1.00 0.00 H new ATOM 2671 N ALA B 80 -4.783 2.504 -3.333 1.00 0.00 N ATOM 2672 CA ALA B 80 -5.449 2.928 -4.541 1.00 0.00 C ATOM 2673 C ALA B 80 -6.755 3.609 -4.200 1.00 0.00 C ATOM 2674 O ALA B 80 -7.038 4.715 -4.661 1.00 0.00 O ATOM 2675 CB ALA B 80 -5.703 1.738 -5.456 1.00 0.00 C ATOM 0 H ALA B 80 -4.616 1.500 -3.272 1.00 0.00 H new ATOM 0 HA ALA B 80 -4.805 3.635 -5.063 1.00 0.00 H new ATOM 0 HB1 ALA B 80 -6.206 2.076 -6.362 1.00 0.00 H new ATOM 0 HB2 ALA B 80 -4.753 1.273 -5.720 1.00 0.00 H new ATOM 0 HB3 ALA B 80 -6.332 1.011 -4.942 1.00 0.00 H new ATOM 2681 N LEU B 81 -7.511 2.994 -3.316 1.00 0.00 N ATOM 2682 CA LEU B 81 -8.728 3.615 -2.837 1.00 0.00 C ATOM 2683 C LEU B 81 -8.387 4.894 -2.090 1.00 0.00 C ATOM 2684 O LEU B 81 -9.035 5.926 -2.272 1.00 0.00 O ATOM 2685 CB LEU B 81 -9.507 2.657 -1.928 1.00 0.00 C ATOM 2686 CG LEU B 81 -10.064 1.492 -2.761 1.00 0.00 C ATOM 2687 CD1 LEU B 81 -10.663 0.436 -1.834 1.00 0.00 C ATOM 2688 CD2 LEU B 81 -11.155 2.006 -3.710 1.00 0.00 C ATOM 0 H LEU B 81 -7.309 2.077 -2.918 1.00 0.00 H new ATOM 0 HA LEU B 81 -9.360 3.856 -3.692 1.00 0.00 H new ATOM 0 HB2 LEU B 81 -8.856 2.276 -1.142 1.00 0.00 H new ATOM 0 HB3 LEU B 81 -10.322 3.188 -1.437 1.00 0.00 H new ATOM 0 HG LEU B 81 -9.253 1.052 -3.342 1.00 0.00 H new ATOM 0 HD11 LEU B 81 -11.057 -0.388 -2.428 1.00 0.00 H new ATOM 0 HD12 LEU B 81 -9.891 0.062 -1.161 1.00 0.00 H new ATOM 0 HD13 LEU B 81 -11.469 0.880 -1.250 1.00 0.00 H new ATOM 0 HD21 LEU B 81 -11.546 1.176 -4.298 1.00 0.00 H new ATOM 0 HD22 LEU B 81 -11.962 2.451 -3.129 1.00 0.00 H new ATOM 0 HD23 LEU B 81 -10.732 2.756 -4.378 1.00 0.00 H new ATOM 2700 N THR B 82 -7.348 4.831 -1.273 1.00 0.00 N ATOM 2701 CA THR B 82 -6.926 5.991 -0.509 1.00 0.00 C ATOM 2702 C THR B 82 -6.469 7.131 -1.420 1.00 0.00 C ATOM 2703 O THR B 82 -6.895 8.264 -1.247 1.00 0.00 O ATOM 2704 CB THR B 82 -5.812 5.601 0.472 1.00 0.00 C ATOM 2705 OG1 THR B 82 -6.217 4.449 1.198 1.00 0.00 O ATOM 2706 CG2 THR B 82 -5.541 6.749 1.455 1.00 0.00 C ATOM 0 H THR B 82 -6.785 3.994 -1.123 1.00 0.00 H new ATOM 0 HA THR B 82 -7.785 6.351 0.056 1.00 0.00 H new ATOM 0 HB THR B 82 -4.900 5.392 -0.088 1.00 0.00 H new ATOM 0 HG1 THR B 82 -5.736 3.664 0.861 1.00 0.00 H new ATOM 0 HG21 THR B 82 -4.749 6.458 2.145 1.00 0.00 H new ATOM 0 HG22 THR B 82 -5.233 7.636 0.902 1.00 0.00 H new ATOM 0 HG23 THR B 82 -6.449 6.969 2.017 1.00 0.00 H new ATOM 2714 N VAL B 83 -5.599 6.837 -2.383 1.00 0.00 N ATOM 2715 CA VAL B 83 -5.068 7.887 -3.251 1.00 0.00 C ATOM 2716 C VAL B 83 -6.191 8.561 -4.032 1.00 0.00 C ATOM 2717 O VAL B 83 -6.286 9.797 -4.061 1.00 0.00 O ATOM 2718 CB VAL B 83 -3.979 7.324 -4.202 1.00 0.00 C ATOM 2719 CG1 VAL B 83 -4.581 6.346 -5.196 1.00 0.00 C ATOM 2720 CG2 VAL B 83 -3.290 8.452 -4.966 1.00 0.00 C ATOM 0 H VAL B 83 -5.251 5.899 -2.581 1.00 0.00 H new ATOM 0 HA VAL B 83 -4.597 8.643 -2.622 1.00 0.00 H new ATOM 0 HB VAL B 83 -3.245 6.804 -3.587 1.00 0.00 H new ATOM 0 HG11 VAL B 83 -3.798 5.965 -5.852 1.00 0.00 H new ATOM 0 HG12 VAL B 83 -5.039 5.516 -4.658 1.00 0.00 H new ATOM 0 HG13 VAL B 83 -5.339 6.854 -5.793 1.00 0.00 H new ATOM 0 HG21 VAL B 83 -2.531 8.033 -5.626 1.00 0.00 H new ATOM 0 HG22 VAL B 83 -4.027 8.994 -5.558 1.00 0.00 H new ATOM 0 HG23 VAL B 83 -2.819 9.136 -4.259 1.00 0.00 H new ATOM 2730 N ALA B 84 -7.077 7.752 -4.605 1.00 0.00 N ATOM 2731 CA ALA B 84 -8.198 8.287 -5.354 1.00 0.00 C ATOM 2732 C ALA B 84 -9.058 9.164 -4.462 1.00 0.00 C ATOM 2733 O ALA B 84 -9.401 10.292 -4.830 1.00 0.00 O ATOM 2734 CB ALA B 84 -9.042 7.146 -5.932 1.00 0.00 C ATOM 0 H ALA B 84 -7.038 6.734 -4.563 1.00 0.00 H new ATOM 0 HA ALA B 84 -7.809 8.891 -6.174 1.00 0.00 H new ATOM 0 HB1 ALA B 84 -9.880 7.561 -6.492 1.00 0.00 H new ATOM 0 HB2 ALA B 84 -8.427 6.539 -6.596 1.00 0.00 H new ATOM 0 HB3 ALA B 84 -9.420 6.525 -5.120 1.00 0.00 H new ATOM 2740 N MET B 85 -9.425 8.636 -3.302 1.00 0.00 N ATOM 2741 CA MET B 85 -10.235 9.377 -2.343 1.00 0.00 C ATOM 2742 C MET B 85 -9.447 10.547 -1.770 1.00 0.00 C ATOM 2743 O MET B 85 -9.954 11.663 -1.642 1.00 0.00 O ATOM 2744 CB MET B 85 -10.680 8.449 -1.206 1.00 0.00 C ATOM 2745 CG MET B 85 -12.163 8.662 -0.904 1.00 0.00 C ATOM 2746 SD MET B 85 -12.339 10.103 0.184 1.00 0.00 S ATOM 2747 CE MET B 85 -13.137 11.211 -1.004 1.00 0.00 C ATOM 0 H MET B 85 -9.174 7.694 -3.001 1.00 0.00 H new ATOM 0 HA MET B 85 -11.114 9.764 -2.859 1.00 0.00 H new ATOM 0 HB2 MET B 85 -10.503 7.410 -1.484 1.00 0.00 H new ATOM 0 HB3 MET B 85 -10.087 8.645 -0.313 1.00 0.00 H new ATOM 0 HG2 MET B 85 -12.718 8.818 -1.829 1.00 0.00 H new ATOM 0 HG3 MET B 85 -12.582 7.776 -0.427 1.00 0.00 H new ATOM 0 HE1 MET B 85 -14.038 11.634 -0.559 1.00 0.00 H new ATOM 0 HE2 MET B 85 -12.451 12.016 -1.269 1.00 0.00 H new ATOM 0 HE3 MET B 85 -13.403 10.652 -1.901 1.00 0.00 H new ATOM 2757 N ASN B 86 -8.207 10.272 -1.412 1.00 0.00 N ATOM 2758 CA ASN B 86 -7.348 11.262 -0.788 1.00 0.00 C ATOM 2759 C ASN B 86 -7.081 12.419 -1.713 1.00 0.00 C ATOM 2760 O ASN B 86 -7.047 13.562 -1.282 1.00 0.00 O ATOM 2761 CB ASN B 86 -6.030 10.640 -0.344 1.00 0.00 C ATOM 2762 CG ASN B 86 -5.142 11.696 0.291 1.00 0.00 C ATOM 2763 OD1 ASN B 86 -4.004 11.862 -0.120 1.00 0.00 O ATOM 2764 ND2 ASN B 86 -5.596 12.434 1.260 1.00 0.00 N ATOM 0 H ASN B 86 -7.768 9.361 -1.544 1.00 0.00 H new ATOM 0 HA ASN B 86 -7.874 11.637 0.090 1.00 0.00 H new ATOM 0 HB2 ASN B 86 -6.220 9.837 0.368 1.00 0.00 H new ATOM 0 HB3 ASN B 86 -5.523 10.194 -1.200 1.00 0.00 H new ATOM 0 HD21 ASN B 86 -5.002 13.151 1.676 1.00 0.00 H new ATOM 0 HD22 ASN B 86 -6.546 12.296 1.604 1.00 0.00 H new ATOM 2771 N ASN B 87 -6.880 12.115 -2.983 1.00 0.00 N ATOM 2772 CA ASN B 87 -6.541 13.126 -3.984 1.00 0.00 C ATOM 2773 C ASN B 87 -7.425 14.354 -3.842 1.00 0.00 C ATOM 2774 O ASN B 87 -6.963 15.483 -4.010 1.00 0.00 O ATOM 2775 CB ASN B 87 -6.686 12.544 -5.386 1.00 0.00 C ATOM 2776 CG ASN B 87 -6.473 13.631 -6.434 1.00 0.00 C ATOM 2777 OD1 ASN B 87 -7.416 14.350 -6.779 1.00 0.00 O ATOM 2778 ND2 ASN B 87 -5.302 13.796 -6.964 1.00 0.00 N ATOM 0 H ASN B 87 -6.945 11.167 -3.354 1.00 0.00 H new ATOM 0 HA ASN B 87 -5.506 13.428 -3.823 1.00 0.00 H new ATOM 0 HB2 ASN B 87 -5.962 11.742 -5.531 1.00 0.00 H new ATOM 0 HB3 ASN B 87 -7.676 12.104 -5.504 1.00 0.00 H new ATOM 0 HD21 ASN B 87 -5.158 14.521 -7.667 1.00 0.00 H new ATOM 0 HD22 ASN B 87 -4.524 13.201 -6.678 1.00 0.00 H new ATOM 2785 N PHE B 88 -8.658 14.139 -3.433 1.00 0.00 N ATOM 2786 CA PHE B 88 -9.576 15.245 -3.197 1.00 0.00 C ATOM 2787 C PHE B 88 -9.067 16.168 -2.090 1.00 0.00 C ATOM 2788 O PHE B 88 -9.159 17.384 -2.206 1.00 0.00 O ATOM 2789 CB PHE B 88 -10.983 14.723 -2.878 1.00 0.00 C ATOM 2790 CG PHE B 88 -11.622 14.239 -4.160 1.00 0.00 C ATOM 2791 CD1 PHE B 88 -12.185 15.166 -5.044 1.00 0.00 C ATOM 2792 CD2 PHE B 88 -11.643 12.873 -4.474 1.00 0.00 C ATOM 2793 CE1 PHE B 88 -12.769 14.735 -6.240 1.00 0.00 C ATOM 2794 CE2 PHE B 88 -12.228 12.442 -5.672 1.00 0.00 C ATOM 2795 CZ PHE B 88 -12.790 13.373 -6.555 1.00 0.00 C ATOM 0 H PHE B 88 -9.051 13.214 -3.256 1.00 0.00 H new ATOM 0 HA PHE B 88 -9.631 15.834 -4.112 1.00 0.00 H new ATOM 0 HB2 PHE B 88 -10.930 13.911 -2.152 1.00 0.00 H new ATOM 0 HB3 PHE B 88 -11.586 15.512 -2.429 1.00 0.00 H new ATOM 0 HD1 PHE B 88 -12.169 16.218 -4.802 1.00 0.00 H new ATOM 0 HD2 PHE B 88 -11.209 12.155 -3.794 1.00 0.00 H new ATOM 0 HE1 PHE B 88 -13.203 15.454 -6.919 1.00 0.00 H new ATOM 0 HE2 PHE B 88 -12.246 11.390 -5.915 1.00 0.00 H new ATOM 0 HZ PHE B 88 -13.239 13.039 -7.479 1.00 0.00 H new ATOM 2805 N PHE B 89 -8.453 15.591 -1.069 1.00 0.00 N ATOM 2806 CA PHE B 89 -7.880 16.371 0.036 1.00 0.00 C ATOM 2807 C PHE B 89 -6.801 17.310 -0.482 1.00 0.00 C ATOM 2808 O PHE B 89 -6.675 18.442 -0.023 1.00 0.00 O ATOM 2809 CB PHE B 89 -7.255 15.440 1.085 1.00 0.00 C ATOM 2810 CG PHE B 89 -8.331 14.740 1.877 1.00 0.00 C ATOM 2811 CD1 PHE B 89 -9.072 13.700 1.298 1.00 0.00 C ATOM 2812 CD2 PHE B 89 -8.592 15.131 3.193 1.00 0.00 C ATOM 2813 CE1 PHE B 89 -10.069 13.056 2.035 1.00 0.00 C ATOM 2814 CE2 PHE B 89 -9.588 14.480 3.933 1.00 0.00 C ATOM 2815 CZ PHE B 89 -10.326 13.444 3.351 1.00 0.00 C ATOM 0 H PHE B 89 -8.334 14.582 -0.975 1.00 0.00 H new ATOM 0 HA PHE B 89 -8.686 16.948 0.490 1.00 0.00 H new ATOM 0 HB2 PHE B 89 -6.619 14.703 0.594 1.00 0.00 H new ATOM 0 HB3 PHE B 89 -6.617 16.015 1.756 1.00 0.00 H new ATOM 0 HD1 PHE B 89 -8.872 13.396 0.281 1.00 0.00 H new ATOM 0 HD2 PHE B 89 -8.026 15.935 3.640 1.00 0.00 H new ATOM 0 HE1 PHE B 89 -10.641 12.257 1.586 1.00 0.00 H new ATOM 0 HE2 PHE B 89 -9.786 14.778 4.952 1.00 0.00 H new ATOM 0 HZ PHE B 89 -11.095 12.944 3.920 1.00 0.00 H new ATOM 2825 N TRP B 90 -5.986 16.815 -1.396 1.00 0.00 N ATOM 2826 CA TRP B 90 -4.882 17.600 -1.938 1.00 0.00 C ATOM 2827 C TRP B 90 -5.424 18.828 -2.592 1.00 0.00 C ATOM 2828 O TRP B 90 -4.891 19.930 -2.441 1.00 0.00 O ATOM 2829 CB TRP B 90 -4.143 16.795 -3.005 1.00 0.00 C ATOM 2830 CG TRP B 90 -3.512 15.597 -2.407 1.00 0.00 C ATOM 2831 CD1 TRP B 90 -4.177 14.579 -1.852 1.00 0.00 C ATOM 2832 CD2 TRP B 90 -2.109 15.255 -2.330 1.00 0.00 C ATOM 2833 NE1 TRP B 90 -3.276 13.647 -1.418 1.00 0.00 N ATOM 2834 CE2 TRP B 90 -1.986 14.009 -1.693 1.00 0.00 C ATOM 2835 CE3 TRP B 90 -0.944 15.902 -2.733 1.00 0.00 C ATOM 2836 CZ2 TRP B 90 -0.753 13.418 -1.465 1.00 0.00 C ATOM 2837 CZ3 TRP B 90 0.313 15.313 -2.517 1.00 0.00 C ATOM 2838 CH2 TRP B 90 0.406 14.073 -1.883 1.00 0.00 C ATOM 0 H TRP B 90 -6.064 15.874 -1.781 1.00 0.00 H new ATOM 0 HA TRP B 90 -4.205 17.858 -1.124 1.00 0.00 H new ATOM 0 HB2 TRP B 90 -4.839 16.494 -3.788 1.00 0.00 H new ATOM 0 HB3 TRP B 90 -3.382 17.417 -3.476 1.00 0.00 H new ATOM 0 HD1 TRP B 90 -5.251 14.505 -1.761 1.00 0.00 H new ATOM 0 HE1 TRP B 90 -3.536 12.782 -0.944 1.00 0.00 H new ATOM 0 HE3 TRP B 90 -1.007 16.866 -3.216 1.00 0.00 H new ATOM 0 HZ2 TRP B 90 -0.690 12.461 -0.969 1.00 0.00 H new ATOM 0 HZ3 TRP B 90 1.209 15.821 -2.842 1.00 0.00 H new ATOM 0 HH2 TRP B 90 1.373 13.622 -1.716 1.00 0.00 H new ATOM 2849 N GLU B 91 -6.431 18.609 -3.386 1.00 0.00 N ATOM 2850 CA GLU B 91 -7.021 19.664 -4.181 1.00 0.00 C ATOM 2851 C GLU B 91 -8.036 20.452 -3.370 1.00 0.00 C ATOM 2852 O GLU B 91 -7.966 21.683 -3.292 1.00 0.00 O ATOM 2853 CB GLU B 91 -7.670 19.043 -5.401 1.00 0.00 C ATOM 2854 CG GLU B 91 -6.647 18.120 -6.101 1.00 0.00 C ATOM 2855 CD GLU B 91 -5.621 18.930 -6.867 1.00 0.00 C ATOM 2856 OE1 GLU B 91 -4.816 19.570 -6.242 1.00 0.00 O ATOM 2857 OE2 GLU B 91 -5.645 18.888 -8.084 1.00 0.00 O ATOM 0 H GLU B 91 -6.872 17.697 -3.506 1.00 0.00 H new ATOM 0 HA GLU B 91 -6.245 20.363 -4.494 1.00 0.00 H new ATOM 0 HB2 GLU B 91 -8.552 18.474 -5.109 1.00 0.00 H new ATOM 0 HB3 GLU B 91 -8.005 19.821 -6.086 1.00 0.00 H new ATOM 0 HG2 GLU B 91 -6.145 17.499 -5.359 1.00 0.00 H new ATOM 0 HG3 GLU B 91 -7.166 17.446 -6.782 1.00 0.00 H new ATOM 2864 N ASN B 92 -8.922 19.740 -2.698 1.00 0.00 N ATOM 2865 CA ASN B 92 -9.894 20.368 -1.823 1.00 0.00 C ATOM 2866 C ASN B 92 -9.305 20.480 -0.440 1.00 0.00 C ATOM 2867 O ASN B 92 -9.207 19.486 0.281 1.00 0.00 O ATOM 2868 CB ASN B 92 -11.183 19.542 -1.775 1.00 0.00 C ATOM 2869 CG ASN B 92 -12.208 20.218 -0.870 1.00 0.00 C ATOM 2870 OD1 ASN B 92 -12.309 19.887 0.313 1.00 0.00 O ATOM 2871 ND2 ASN B 92 -12.976 21.141 -1.354 1.00 0.00 N ATOM 0 H ASN B 92 -8.988 18.723 -2.742 1.00 0.00 H new ATOM 0 HA ASN B 92 -10.136 21.360 -2.205 1.00 0.00 H new ATOM 0 HB2 ASN B 92 -11.591 19.432 -2.780 1.00 0.00 H new ATOM 0 HB3 ASN B 92 -10.967 18.539 -1.407 1.00 0.00 H new ATOM 0 HD21 ASN B 92 -13.666 21.596 -0.756 1.00 0.00 H new ATOM 0 HD22 ASN B 92 -12.891 21.414 -2.333 1.00 0.00 H new ATOM 2878 N SER B 93 -8.835 21.669 -0.109 1.00 0.00 N ATOM 2879 CA SER B 93 -8.153 21.910 1.149 1.00 0.00 C ATOM 2880 C SER B 93 -7.882 23.401 1.307 1.00 0.00 C ATOM 2881 O SER B 93 -8.011 23.896 2.397 1.00 0.00 O ATOM 2882 CB SER B 93 -6.824 21.138 1.175 1.00 0.00 C ATOM 2883 OG SER B 93 -6.998 19.883 1.828 1.00 0.00 O ATOM 2884 OXT SER B 93 -7.548 24.026 0.326 1.00 0.00 O ATOM 0 H SER B 93 -8.915 22.494 -0.704 1.00 0.00 H new ATOM 0 HA SER B 93 -8.783 21.569 1.970 1.00 0.00 H new ATOM 0 HB2 SER B 93 -6.466 20.981 0.157 1.00 0.00 H new ATOM 0 HB3 SER B 93 -6.065 21.724 1.693 1.00 0.00 H new ATOM 0 HG SER B 93 -7.496 19.275 1.242 1.00 0.00 H new TER 2890 SER B 93