USER MOD reduce.3.24.130724 H: found=0, std=0, add=1233, rem=0, adj=40 USER MOD reduce.3.24.130724 removed 1231 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 155 TYR OH : rot 180:sc= -1.22 USER MOD Set 1.2: A 157 GLN :FLIP amide:sc= -0.828 F(o=-2.7,f=-2) USER MOD Set 2.1: A 78 ASN : amide:sc= 0.119 X(o=0.23,f=0.37) USER MOD Set 2.2: A 80 THR OG1 : rot 180:sc= 0.107 USER MOD Set 3.1: A 59 ASN : amide:sc= -0.291 K(o=-11,f=-13) USER MOD Set 3.2: A 71 HIS : no HD1:sc= -1.81 X(o=-11,f=-11!) USER MOD Set 3.3: A 73 ASN :FLIP amide:sc= -7.05! C(o=-12!,f=-11!) USER MOD Set 3.4: A 84 ASN : amide:sc= -1.43 K(o=-11,f=-12) USER MOD Set 3.5: A 148 GLN :FLIP amide:sc= -0.336 F(o=-12,f=-11) USER MOD Set 4.1: A 17 MET CE :methyl 168:sc= -0.0355 (180deg=-0.923) USER MOD Set 4.2: A 22 THR OG1 : rot -150:sc= 0 USER MOD Set 4.3: A 29 TYR OH : rot 112:sc= 0.485 USER MOD Single : A 1 GLY N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 2 SER OG : rot -47:sc= 0.868 USER MOD Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 5 SER OG : rot 180:sc= 0 USER MOD Single : A 6 SER OG : rot 180:sc= 0 USER MOD Single : A 8 HIS : no HD1:sc= -0.0101 X(o=-0.01,f=-0.01) USER MOD Single : A 9 GLN :FLIP amide:sc= -0.129 F(o=-0.69,f=-0.13) USER MOD Single : A 10 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 12 ASN : amide:sc= -0.182 K(o=-0.18,f=-0.79) USER MOD Single : A 13 SER OG : rot 180:sc= 0 USER MOD Single : A 16 THR OG1 : rot 180:sc= 0 USER MOD Single : A 24 ASN : amide:sc= -0.157 X(o=-0.16,f=-0.018) USER MOD Single : A 34 GLN : amide:sc= -2.66! C(o=-2.7!,f=-3.3!) USER MOD Single : A 38 THR OG1 : rot 180:sc= -1.42 USER MOD Single : A 42 THR OG1 : rot 180:sc= 0 USER MOD Single : A 46 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 48 TYR OH : rot -130:sc= -0.328 USER MOD Single : A 52 THR OG1 : rot 180:sc= 0 USER MOD Single : A 54 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 55 SER OG : rot 180:sc= 0 USER MOD Single : A 61 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 64 SER OG : rot 180:sc= 0 USER MOD Single : A 65 SER OG : rot -131:sc= 0.203 USER MOD Single : A 76 MET CE :methyl 175:sc= -3.72 (180deg=-3.8!) USER MOD Single : A 85 SER OG : rot 24:sc= -0.401 USER MOD Single : A 88 ASN : amide:sc= 0.447 K(o=0.45,f=-0.34) USER MOD Single : A 90 SER OG : rot 180:sc= 0 USER MOD Single : A 93 SER OG : rot 11:sc= 0.825 USER MOD Single : A 96 LYS NZ :NH3+ 151:sc= -0.499 (180deg=-1.65!) USER MOD Single : A 97 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 99 THR OG1 : rot 180:sc= 0 USER MOD Single : A 100 HIS : no HD1:sc= -1.5 K(o=-1.5,f=-2.8!) USER MOD Single : A 101 ASN : amide:sc= -2.49! C(o=-2.5!,f=-3.2!) USER MOD Single : A 107 GLN : amide:sc= 0 X(o=0,f=-0.052) USER MOD Single : A 112 SER OG : rot 180:sc= -0.0318 USER MOD Single : A 115 CYS SG : rot 73:sc= -4.38 USER MOD Single : A 121 LYS NZ :NH3+ 169:sc= 0 (180deg=-0.0476) USER MOD Single : A 123 TYR OH : rot 180:sc= -0.219 USER MOD Single : A 125 ASN : amide:sc= -0.329 K(o=-0.33,f=-2.7!) USER MOD Single : A 127 GLN : amide:sc= -0.0473 K(o=-0.047,f=-1.9!) USER MOD Single : A 128 HIS : no HD1:sc= 0 X(o=0,f=-0.015) USER MOD Single : A 134 HIS :FLIP no HD1:sc= -1.65 F(o=-2.2,f=-1.7) USER MOD Single : A 137 SER OG : rot 180:sc= 0 USER MOD Single : A 140 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 144 THR OG1 : rot -160:sc= -0.0146 USER MOD Single : A 152 THR OG1 : rot 180:sc= 0 USER MOD Single : A 154 SER OG : rot 180:sc= 0 USER MOD Single : A 159 SER OG : rot -7:sc= 0.565! USER MOD Single : A 162 SER OG : rot 180:sc= 0 USER MOD Single : A 163 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 -28.912 -19.719 4.913 1.00 0.00 N ATOM 2 CA GLY A 1 -28.468 -18.912 3.791 1.00 0.00 C ATOM 3 C GLY A 1 -29.524 -18.791 2.711 1.00 0.00 C ATOM 4 O GLY A 1 -30.607 -18.255 2.949 1.00 0.00 O ATOM 0 H1 GLY A 1 -28.155 -19.771 5.624 1.00 0.00 H new ATOM 0 H2 GLY A 1 -29.757 -19.287 5.338 1.00 0.00 H new ATOM 0 H3 GLY A 1 -29.142 -20.677 4.582 1.00 0.00 H new ATOM 0 HA2 GLY A 1 -28.200 -17.917 4.146 1.00 0.00 H new ATOM 0 HA3 GLY A 1 -27.566 -19.352 3.365 1.00 0.00 H new ATOM 8 N SER A 2 -29.210 -19.289 1.519 1.00 0.00 N ATOM 9 CA SER A 2 -30.138 -19.229 0.396 1.00 0.00 C ATOM 10 C SER A 2 -30.728 -17.829 0.253 1.00 0.00 C ATOM 11 O SER A 2 -31.924 -17.670 0.007 1.00 0.00 O ATOM 12 CB SER A 2 -31.261 -20.252 0.580 1.00 0.00 C ATOM 13 OG SER A 2 -32.155 -20.231 -0.519 1.00 0.00 O ATOM 0 H SER A 2 -28.320 -19.739 1.306 1.00 0.00 H new ATOM 0 HA SER A 2 -29.586 -19.466 -0.513 1.00 0.00 H new ATOM 0 HB2 SER A 2 -30.835 -21.249 0.687 1.00 0.00 H new ATOM 0 HB3 SER A 2 -31.805 -20.038 1.500 1.00 0.00 H new ATOM 0 HG SER A 2 -32.396 -19.304 -0.727 1.00 0.00 H new ATOM 19 N SER A 3 -29.880 -16.818 0.410 1.00 0.00 N ATOM 20 CA SER A 3 -30.317 -15.431 0.303 1.00 0.00 C ATOM 21 C SER A 3 -30.113 -14.905 -1.115 1.00 0.00 C ATOM 22 O SER A 3 -29.262 -15.396 -1.855 1.00 0.00 O ATOM 23 CB SER A 3 -29.554 -14.555 1.298 1.00 0.00 C ATOM 24 OG SER A 3 -30.058 -13.230 1.303 1.00 0.00 O ATOM 0 H SER A 3 -28.887 -16.933 0.612 1.00 0.00 H new ATOM 0 HA SER A 3 -31.381 -15.392 0.537 1.00 0.00 H new ATOM 0 HB2 SER A 3 -29.634 -14.981 2.298 1.00 0.00 H new ATOM 0 HB3 SER A 3 -28.495 -14.544 1.040 1.00 0.00 H new ATOM 0 HG SER A 3 -29.555 -12.691 1.948 1.00 0.00 H new ATOM 30 N GLY A 4 -30.902 -13.901 -1.487 1.00 0.00 N ATOM 31 CA GLY A 4 -30.794 -13.325 -2.814 1.00 0.00 C ATOM 32 C GLY A 4 -30.373 -11.869 -2.781 1.00 0.00 C ATOM 33 O GLY A 4 -29.182 -11.561 -2.728 1.00 0.00 O ATOM 0 H GLY A 4 -31.614 -13.477 -0.892 1.00 0.00 H new ATOM 0 HA2 GLY A 4 -30.071 -13.896 -3.397 1.00 0.00 H new ATOM 0 HA3 GLY A 4 -31.754 -13.411 -3.323 1.00 0.00 H new ATOM 37 N SER A 5 -31.352 -10.971 -2.815 1.00 0.00 N ATOM 38 CA SER A 5 -31.077 -9.539 -2.795 1.00 0.00 C ATOM 39 C SER A 5 -31.507 -8.922 -1.467 1.00 0.00 C ATOM 40 O SER A 5 -32.134 -9.581 -0.638 1.00 0.00 O ATOM 41 CB SER A 5 -31.798 -8.843 -3.951 1.00 0.00 C ATOM 42 OG SER A 5 -31.173 -9.132 -5.189 1.00 0.00 O ATOM 0 H SER A 5 -32.343 -11.210 -2.857 1.00 0.00 H new ATOM 0 HA SER A 5 -30.002 -9.399 -2.910 1.00 0.00 H new ATOM 0 HB2 SER A 5 -32.839 -9.165 -3.981 1.00 0.00 H new ATOM 0 HB3 SER A 5 -31.803 -7.766 -3.785 1.00 0.00 H new ATOM 0 HG SER A 5 -31.653 -8.677 -5.912 1.00 0.00 H new ATOM 48 N SER A 6 -31.165 -7.652 -1.274 1.00 0.00 N ATOM 49 CA SER A 6 -31.512 -6.946 -0.046 1.00 0.00 C ATOM 50 C SER A 6 -32.367 -5.719 -0.348 1.00 0.00 C ATOM 51 O SER A 6 -32.384 -5.222 -1.473 1.00 0.00 O ATOM 52 CB SER A 6 -30.244 -6.527 0.702 1.00 0.00 C ATOM 53 OG SER A 6 -29.374 -5.793 -0.142 1.00 0.00 O ATOM 0 H SER A 6 -30.648 -7.091 -1.952 1.00 0.00 H new ATOM 0 HA SER A 6 -32.089 -7.624 0.583 1.00 0.00 H new ATOM 0 HB2 SER A 6 -30.512 -5.922 1.568 1.00 0.00 H new ATOM 0 HB3 SER A 6 -29.730 -7.412 1.078 1.00 0.00 H new ATOM 0 HG SER A 6 -28.572 -5.535 0.359 1.00 0.00 H new ATOM 59 N GLY A 7 -33.077 -5.236 0.667 1.00 0.00 N ATOM 60 CA GLY A 7 -33.925 -4.072 0.491 1.00 0.00 C ATOM 61 C GLY A 7 -33.130 -2.813 0.206 1.00 0.00 C ATOM 62 O GLY A 7 -32.454 -2.716 -0.819 1.00 0.00 O ATOM 0 H GLY A 7 -33.080 -5.630 1.608 1.00 0.00 H new ATOM 0 HA2 GLY A 7 -34.619 -4.253 -0.329 1.00 0.00 H new ATOM 0 HA3 GLY A 7 -34.524 -3.924 1.389 1.00 0.00 H new ATOM 66 N HIS A 8 -33.212 -1.845 1.113 1.00 0.00 N ATOM 67 CA HIS A 8 -32.495 -0.585 0.954 1.00 0.00 C ATOM 68 C HIS A 8 -31.058 -0.710 1.453 1.00 0.00 C ATOM 69 O HIS A 8 -30.785 -1.439 2.406 1.00 0.00 O ATOM 70 CB HIS A 8 -33.213 0.534 1.708 1.00 0.00 C ATOM 71 CG HIS A 8 -32.664 1.898 1.421 1.00 0.00 C ATOM 72 ND1 HIS A 8 -32.870 2.556 0.226 1.00 0.00 N ATOM 73 CD2 HIS A 8 -31.915 2.729 2.182 1.00 0.00 C ATOM 74 CE1 HIS A 8 -32.269 3.732 0.265 1.00 0.00 C ATOM 75 NE2 HIS A 8 -31.683 3.862 1.442 1.00 0.00 N ATOM 0 H HIS A 8 -33.768 -1.909 1.966 1.00 0.00 H new ATOM 0 HA HIS A 8 -32.472 -0.341 -0.108 1.00 0.00 H new ATOM 0 HB2 HIS A 8 -34.271 0.515 1.448 1.00 0.00 H new ATOM 0 HB3 HIS A 8 -33.144 0.342 2.779 1.00 0.00 H new ATOM 0 HD2 HIS A 8 -31.565 2.537 3.185 1.00 0.00 H new ATOM 0 HE1 HIS A 8 -32.259 4.463 -0.530 1.00 0.00 H new ATOM 0 HE2 HIS A 8 -31.146 4.672 1.751 1.00 0.00 H new ATOM 84 N GLN A 9 -30.146 0.005 0.802 1.00 0.00 N ATOM 85 CA GLN A 9 -28.738 -0.028 1.179 1.00 0.00 C ATOM 86 C GLN A 9 -28.031 1.255 0.756 1.00 0.00 C ATOM 87 O GLN A 9 -28.076 1.642 -0.411 1.00 0.00 O ATOM 88 CB GLN A 9 -28.047 -1.238 0.548 1.00 0.00 C ATOM 89 CG GLN A 9 -26.619 -1.442 1.027 1.00 0.00 C ATOM 90 CD GLN A 9 -25.930 -2.599 0.331 1.00 0.00 C ATOM 91 OE1 GLN A 9 -25.851 -2.532 -0.993 1.00 0.00 O flip ATOM 92 NE2 GLN A 9 -25.472 -3.542 0.976 1.00 0.00 N flip ATOM 0 H GLN A 9 -30.357 0.614 0.011 1.00 0.00 H new ATOM 0 HA GLN A 9 -28.680 -0.112 2.264 1.00 0.00 H new ATOM 0 HB2 GLN A 9 -28.627 -2.134 0.770 1.00 0.00 H new ATOM 0 HB3 GLN A 9 -28.044 -1.120 -0.536 1.00 0.00 H new ATOM 0 HG2 GLN A 9 -26.049 -0.529 0.857 1.00 0.00 H new ATOM 0 HG3 GLN A 9 -26.622 -1.620 2.102 1.00 0.00 H new ATOM 0 HE21 GLN A 9 -25.555 -3.553 1.993 1.00 0.00 H new ATOM 0 HE22 GLN A 9 -25.010 -4.313 0.494 1.00 0.00 H new ATOM 101 N GLN A 10 -27.379 1.909 1.712 1.00 0.00 N ATOM 102 CA GLN A 10 -26.663 3.149 1.437 1.00 0.00 C ATOM 103 C GLN A 10 -25.156 2.914 1.416 1.00 0.00 C ATOM 104 O GLN A 10 -24.592 2.349 2.354 1.00 0.00 O ATOM 105 CB GLN A 10 -27.012 4.207 2.486 1.00 0.00 C ATOM 106 CG GLN A 10 -26.693 3.780 3.910 1.00 0.00 C ATOM 107 CD GLN A 10 -27.055 4.841 4.931 1.00 0.00 C ATOM 108 OE1 GLN A 10 -26.248 5.715 5.247 1.00 0.00 O ATOM 109 NE2 GLN A 10 -28.273 4.768 5.454 1.00 0.00 N ATOM 0 H GLN A 10 -27.332 1.601 2.683 1.00 0.00 H new ATOM 0 HA GLN A 10 -26.970 3.507 0.454 1.00 0.00 H new ATOM 0 HB2 GLN A 10 -26.468 5.124 2.260 1.00 0.00 H new ATOM 0 HB3 GLN A 10 -28.074 4.441 2.415 1.00 0.00 H new ATOM 0 HG2 GLN A 10 -27.232 2.861 4.139 1.00 0.00 H new ATOM 0 HG3 GLN A 10 -25.630 3.553 3.988 1.00 0.00 H new ATOM 0 HE21 GLN A 10 -28.910 4.026 5.163 1.00 0.00 H new ATOM 0 HE22 GLN A 10 -28.572 5.454 6.147 1.00 0.00 H new ATOM 118 N LEU A 11 -24.510 3.351 0.341 1.00 0.00 N ATOM 119 CA LEU A 11 -23.067 3.189 0.197 1.00 0.00 C ATOM 120 C LEU A 11 -22.413 4.495 -0.241 1.00 0.00 C ATOM 121 O LEU A 11 -22.420 4.839 -1.422 1.00 0.00 O ATOM 122 CB LEU A 11 -22.757 2.085 -0.816 1.00 0.00 C ATOM 123 CG LEU A 11 -23.440 0.739 -0.572 1.00 0.00 C ATOM 124 CD1 LEU A 11 -23.595 -0.025 -1.878 1.00 0.00 C ATOM 125 CD2 LEU A 11 -22.654 -0.082 0.439 1.00 0.00 C ATOM 0 H LEU A 11 -24.962 3.820 -0.444 1.00 0.00 H new ATOM 0 HA LEU A 11 -22.659 2.908 1.168 1.00 0.00 H new ATOM 0 HB2 LEU A 11 -23.040 2.439 -1.807 1.00 0.00 H new ATOM 0 HB3 LEU A 11 -21.679 1.925 -0.831 1.00 0.00 H new ATOM 0 HG LEU A 11 -24.433 0.925 -0.164 1.00 0.00 H new ATOM 0 HD11 LEU A 11 -24.083 -0.980 -1.685 1.00 0.00 H new ATOM 0 HD12 LEU A 11 -24.201 0.558 -2.571 1.00 0.00 H new ATOM 0 HD13 LEU A 11 -22.612 -0.201 -2.315 1.00 0.00 H new ATOM 0 HD21 LEU A 11 -23.155 -1.037 0.600 1.00 0.00 H new ATOM 0 HD22 LEU A 11 -21.648 -0.260 0.060 1.00 0.00 H new ATOM 0 HD23 LEU A 11 -22.596 0.461 1.382 1.00 0.00 H new ATOM 137 N ASN A 12 -21.847 5.218 0.720 1.00 0.00 N ATOM 138 CA ASN A 12 -21.187 6.487 0.433 1.00 0.00 C ATOM 139 C ASN A 12 -19.900 6.264 -0.357 1.00 0.00 C ATOM 140 O ASN A 12 -19.591 7.013 -1.283 1.00 0.00 O ATOM 141 CB ASN A 12 -20.878 7.230 1.734 1.00 0.00 C ATOM 142 CG ASN A 12 -22.039 7.197 2.709 1.00 0.00 C ATOM 143 OD1 ASN A 12 -23.199 7.114 2.306 1.00 0.00 O ATOM 144 ND2 ASN A 12 -21.730 7.262 3.999 1.00 0.00 N ATOM 0 H ASN A 12 -21.832 4.947 1.703 1.00 0.00 H new ATOM 0 HA ASN A 12 -21.863 7.092 -0.171 1.00 0.00 H new ATOM 0 HB2 ASN A 12 -20.000 6.785 2.203 1.00 0.00 H new ATOM 0 HB3 ASN A 12 -20.627 8.266 1.507 1.00 0.00 H new ATOM 0 HD21 ASN A 12 -22.469 7.244 4.702 1.00 0.00 H new ATOM 0 HD22 ASN A 12 -20.754 7.330 4.287 1.00 0.00 H new ATOM 151 N SER A 13 -19.155 5.229 0.017 1.00 0.00 N ATOM 152 CA SER A 13 -17.900 4.909 -0.653 1.00 0.00 C ATOM 153 C SER A 13 -18.122 4.698 -2.148 1.00 0.00 C ATOM 154 O SER A 13 -19.240 4.831 -2.647 1.00 0.00 O ATOM 155 CB SER A 13 -17.273 3.657 -0.037 1.00 0.00 C ATOM 156 OG SER A 13 -16.960 3.863 1.329 1.00 0.00 O ATOM 0 H SER A 13 -19.399 4.598 0.780 1.00 0.00 H new ATOM 0 HA SER A 13 -17.220 5.750 -0.519 1.00 0.00 H new ATOM 0 HB2 SER A 13 -17.961 2.817 -0.133 1.00 0.00 H new ATOM 0 HB3 SER A 13 -16.369 3.392 -0.585 1.00 0.00 H new ATOM 0 HG SER A 13 -16.562 3.048 1.700 1.00 0.00 H new ATOM 162 N LEU A 14 -17.048 4.367 -2.858 1.00 0.00 N ATOM 163 CA LEU A 14 -17.123 4.137 -4.296 1.00 0.00 C ATOM 164 C LEU A 14 -16.961 2.655 -4.620 1.00 0.00 C ATOM 165 O LEU A 14 -16.399 1.883 -3.843 1.00 0.00 O ATOM 166 CB LEU A 14 -16.048 4.949 -5.019 1.00 0.00 C ATOM 167 CG LEU A 14 -14.660 4.310 -5.094 1.00 0.00 C ATOM 168 CD1 LEU A 14 -13.972 4.679 -6.398 1.00 0.00 C ATOM 169 CD2 LEU A 14 -13.813 4.735 -3.903 1.00 0.00 C ATOM 0 H LEU A 14 -16.116 4.252 -2.461 1.00 0.00 H new ATOM 0 HA LEU A 14 -18.106 4.460 -4.640 1.00 0.00 H new ATOM 0 HB2 LEU A 14 -16.391 5.145 -6.035 1.00 0.00 H new ATOM 0 HB3 LEU A 14 -15.955 5.915 -4.522 1.00 0.00 H new ATOM 0 HG LEU A 14 -14.777 3.227 -5.064 1.00 0.00 H new ATOM 0 HD11 LEU A 14 -12.986 4.215 -6.433 1.00 0.00 H new ATOM 0 HD12 LEU A 14 -14.570 4.325 -7.238 1.00 0.00 H new ATOM 0 HD13 LEU A 14 -13.866 5.762 -6.460 1.00 0.00 H new ATOM 0 HD21 LEU A 14 -12.829 4.271 -3.972 1.00 0.00 H new ATOM 0 HD22 LEU A 14 -13.704 5.820 -3.903 1.00 0.00 H new ATOM 0 HD23 LEU A 14 -14.299 4.419 -2.980 1.00 0.00 H new ATOM 181 N PRO A 15 -17.463 2.247 -5.795 1.00 0.00 N ATOM 182 CA PRO A 15 -17.383 0.856 -6.249 1.00 0.00 C ATOM 183 C PRO A 15 -15.959 0.442 -6.603 1.00 0.00 C ATOM 184 O PRO A 15 -15.003 1.166 -6.322 1.00 0.00 O ATOM 185 CB PRO A 15 -18.270 0.839 -7.497 1.00 0.00 C ATOM 186 CG PRO A 15 -18.253 2.244 -7.993 1.00 0.00 C ATOM 187 CD PRO A 15 -18.146 3.113 -6.770 1.00 0.00 C ATOM 0 HA PRO A 15 -17.698 0.156 -5.475 1.00 0.00 H new ATOM 0 HB2 PRO A 15 -17.884 0.149 -8.248 1.00 0.00 H new ATOM 0 HB3 PRO A 15 -19.283 0.516 -7.258 1.00 0.00 H new ATOM 0 HG2 PRO A 15 -17.411 2.411 -8.665 1.00 0.00 H new ATOM 0 HG3 PRO A 15 -19.159 2.471 -8.555 1.00 0.00 H new ATOM 0 HD2 PRO A 15 -17.576 4.020 -6.970 1.00 0.00 H new ATOM 0 HD3 PRO A 15 -19.127 3.425 -6.412 1.00 0.00 H new ATOM 195 N THR A 16 -15.823 -0.727 -7.220 1.00 0.00 N ATOM 196 CA THR A 16 -14.515 -1.238 -7.611 1.00 0.00 C ATOM 197 C THR A 16 -14.034 -0.587 -8.903 1.00 0.00 C ATOM 198 O THR A 16 -14.839 -0.151 -9.726 1.00 0.00 O ATOM 199 CB THR A 16 -14.542 -2.767 -7.800 1.00 0.00 C ATOM 200 OG1 THR A 16 -14.359 -3.419 -6.538 1.00 0.00 O ATOM 201 CG2 THR A 16 -13.457 -3.212 -8.769 1.00 0.00 C ATOM 0 H THR A 16 -16.603 -1.338 -7.460 1.00 0.00 H new ATOM 0 HA THR A 16 -13.826 -0.991 -6.804 1.00 0.00 H new ATOM 0 HB THR A 16 -15.512 -3.043 -8.214 1.00 0.00 H new ATOM 0 HG1 THR A 16 -14.379 -4.390 -6.666 1.00 0.00 H new ATOM 0 HG21 THR A 16 -13.496 -4.295 -8.886 1.00 0.00 H new ATOM 0 HG22 THR A 16 -13.616 -2.736 -9.737 1.00 0.00 H new ATOM 0 HG23 THR A 16 -12.481 -2.924 -8.379 1.00 0.00 H new ATOM 209 N MET A 17 -12.718 -0.523 -9.074 1.00 0.00 N ATOM 210 CA MET A 17 -12.130 0.074 -10.267 1.00 0.00 C ATOM 211 C MET A 17 -12.070 -0.938 -11.408 1.00 0.00 C ATOM 212 O MET A 17 -10.990 -1.371 -11.808 1.00 0.00 O ATOM 213 CB MET A 17 -10.727 0.600 -9.962 1.00 0.00 C ATOM 214 CG MET A 17 -9.766 -0.475 -9.482 1.00 0.00 C ATOM 215 SD MET A 17 -8.372 0.201 -8.558 1.00 0.00 S ATOM 216 CE MET A 17 -8.442 -0.788 -7.067 1.00 0.00 C ATOM 0 H MET A 17 -12.038 -0.877 -8.401 1.00 0.00 H new ATOM 0 HA MET A 17 -12.762 0.906 -10.576 1.00 0.00 H new ATOM 0 HB2 MET A 17 -10.319 1.066 -10.859 1.00 0.00 H new ATOM 0 HB3 MET A 17 -10.797 1.379 -9.202 1.00 0.00 H new ATOM 0 HG2 MET A 17 -10.305 -1.184 -8.853 1.00 0.00 H new ATOM 0 HG3 MET A 17 -9.392 -1.032 -10.341 1.00 0.00 H new ATOM 0 HE1 MET A 17 -7.528 -0.643 -6.491 1.00 0.00 H new ATOM 0 HE2 MET A 17 -9.301 -0.484 -6.469 1.00 0.00 H new ATOM 0 HE3 MET A 17 -8.540 -1.841 -7.333 1.00 0.00 H new ATOM 226 N GLU A 18 -13.237 -1.309 -11.926 1.00 0.00 N ATOM 227 CA GLU A 18 -13.315 -2.270 -13.020 1.00 0.00 C ATOM 228 C GLU A 18 -12.870 -1.636 -14.334 1.00 0.00 C ATOM 229 O GLU A 18 -12.899 -0.415 -14.489 1.00 0.00 O ATOM 230 CB GLU A 18 -14.741 -2.806 -13.156 1.00 0.00 C ATOM 231 CG GLU A 18 -15.032 -3.998 -12.260 1.00 0.00 C ATOM 232 CD GLU A 18 -15.570 -3.590 -10.902 1.00 0.00 C ATOM 233 OE1 GLU A 18 -15.991 -2.423 -10.758 1.00 0.00 O ATOM 234 OE2 GLU A 18 -15.569 -4.436 -9.984 1.00 0.00 O ATOM 0 H GLU A 18 -14.140 -0.959 -11.606 1.00 0.00 H new ATOM 0 HA GLU A 18 -12.644 -3.098 -12.791 1.00 0.00 H new ATOM 0 HB2 GLU A 18 -15.444 -2.007 -12.923 1.00 0.00 H new ATOM 0 HB3 GLU A 18 -14.915 -3.091 -14.194 1.00 0.00 H new ATOM 0 HG2 GLU A 18 -15.754 -4.650 -12.752 1.00 0.00 H new ATOM 0 HG3 GLU A 18 -14.119 -4.578 -12.126 1.00 0.00 H new ATOM 241 N GLY A 19 -12.459 -2.475 -15.280 1.00 0.00 N ATOM 242 CA GLY A 19 -12.013 -1.979 -16.569 1.00 0.00 C ATOM 243 C GLY A 19 -10.511 -1.788 -16.629 1.00 0.00 C ATOM 244 O GLY A 19 -9.737 -2.641 -16.194 1.00 0.00 O ATOM 0 H GLY A 19 -12.427 -3.489 -15.177 1.00 0.00 H new ATOM 0 HA2 GLY A 19 -12.319 -2.677 -17.349 1.00 0.00 H new ATOM 0 HA3 GLY A 19 -12.505 -1.030 -16.780 1.00 0.00 H new ATOM 248 N PRO A 20 -10.077 -0.645 -17.181 1.00 0.00 N ATOM 249 CA PRO A 20 -8.654 -0.318 -17.311 1.00 0.00 C ATOM 250 C PRO A 20 -8.000 -0.031 -15.963 1.00 0.00 C ATOM 251 O PRO A 20 -8.668 0.097 -14.937 1.00 0.00 O ATOM 252 CB PRO A 20 -8.656 0.939 -18.183 1.00 0.00 C ATOM 253 CG PRO A 20 -9.991 1.559 -17.951 1.00 0.00 C ATOM 254 CD PRO A 20 -10.942 0.417 -17.720 1.00 0.00 C ATOM 0 HA PRO A 20 -8.083 -1.145 -17.734 1.00 0.00 H new ATOM 0 HB2 PRO A 20 -7.850 1.617 -17.902 1.00 0.00 H new ATOM 0 HB3 PRO A 20 -8.512 0.691 -19.235 1.00 0.00 H new ATOM 0 HG2 PRO A 20 -9.967 2.227 -17.090 1.00 0.00 H new ATOM 0 HG3 PRO A 20 -10.299 2.156 -18.809 1.00 0.00 H new ATOM 0 HD2 PRO A 20 -11.731 0.687 -17.018 1.00 0.00 H new ATOM 0 HD3 PRO A 20 -11.430 0.107 -18.644 1.00 0.00 H new ATOM 262 N PRO A 21 -6.663 0.074 -15.964 1.00 0.00 N ATOM 263 CA PRO A 21 -5.890 0.349 -14.749 1.00 0.00 C ATOM 264 C PRO A 21 -6.099 1.771 -14.238 1.00 0.00 C ATOM 265 O PRO A 21 -6.933 2.512 -14.758 1.00 0.00 O ATOM 266 CB PRO A 21 -4.440 0.151 -15.198 1.00 0.00 C ATOM 267 CG PRO A 21 -4.460 0.406 -16.666 1.00 0.00 C ATOM 268 CD PRO A 21 -5.802 -0.067 -17.151 1.00 0.00 C ATOM 0 HA PRO A 21 -6.187 -0.297 -13.923 1.00 0.00 H new ATOM 0 HB2 PRO A 21 -3.769 0.841 -14.685 1.00 0.00 H new ATOM 0 HB3 PRO A 21 -4.091 -0.857 -14.976 1.00 0.00 H new ATOM 0 HG2 PRO A 21 -4.319 1.466 -16.880 1.00 0.00 H new ATOM 0 HG3 PRO A 21 -3.653 -0.130 -17.166 1.00 0.00 H new ATOM 0 HD2 PRO A 21 -6.164 0.536 -17.984 1.00 0.00 H new ATOM 0 HD3 PRO A 21 -5.763 -1.099 -17.499 1.00 0.00 H new ATOM 276 N THR A 22 -5.336 2.146 -13.216 1.00 0.00 N ATOM 277 CA THR A 22 -5.438 3.478 -12.634 1.00 0.00 C ATOM 278 C THR A 22 -4.385 4.414 -13.216 1.00 0.00 C ATOM 279 O THR A 22 -3.227 4.033 -13.386 1.00 0.00 O ATOM 280 CB THR A 22 -5.281 3.436 -11.103 1.00 0.00 C ATOM 281 OG1 THR A 22 -6.529 3.090 -10.492 1.00 0.00 O ATOM 282 CG2 THR A 22 -4.805 4.779 -10.570 1.00 0.00 C ATOM 0 H THR A 22 -4.640 1.545 -12.774 1.00 0.00 H new ATOM 0 HA THR A 22 -6.431 3.855 -12.879 1.00 0.00 H new ATOM 0 HB THR A 22 -4.535 2.681 -10.857 1.00 0.00 H new ATOM 0 HG1 THR A 22 -6.585 3.504 -9.606 1.00 0.00 H new ATOM 0 HG21 THR A 22 -4.702 4.724 -9.486 1.00 0.00 H new ATOM 0 HG22 THR A 22 -3.841 5.026 -11.015 1.00 0.00 H new ATOM 0 HG23 THR A 22 -5.531 5.550 -10.827 1.00 0.00 H new ATOM 290 N PHE A 23 -4.794 5.642 -13.520 1.00 0.00 N ATOM 291 CA PHE A 23 -3.886 6.633 -14.083 1.00 0.00 C ATOM 292 C PHE A 23 -4.100 7.998 -13.435 1.00 0.00 C ATOM 293 O PHE A 23 -5.191 8.563 -13.498 1.00 0.00 O ATOM 294 CB PHE A 23 -4.086 6.738 -15.597 1.00 0.00 C ATOM 295 CG PHE A 23 -3.200 5.815 -16.384 1.00 0.00 C ATOM 296 CD1 PHE A 23 -3.317 4.440 -16.250 1.00 0.00 C ATOM 297 CD2 PHE A 23 -2.251 6.321 -17.257 1.00 0.00 C ATOM 298 CE1 PHE A 23 -2.504 3.588 -16.973 1.00 0.00 C ATOM 299 CE2 PHE A 23 -1.436 5.473 -17.983 1.00 0.00 C ATOM 300 CZ PHE A 23 -1.561 4.105 -17.840 1.00 0.00 C ATOM 0 H PHE A 23 -5.749 5.974 -13.385 1.00 0.00 H new ATOM 0 HA PHE A 23 -2.865 6.310 -13.880 1.00 0.00 H new ATOM 0 HB2 PHE A 23 -5.127 6.519 -15.834 1.00 0.00 H new ATOM 0 HB3 PHE A 23 -3.897 7.765 -15.910 1.00 0.00 H new ATOM 0 HD1 PHE A 23 -4.052 4.030 -15.573 1.00 0.00 H new ATOM 0 HD2 PHE A 23 -2.147 7.390 -17.372 1.00 0.00 H new ATOM 0 HE1 PHE A 23 -2.606 2.519 -16.860 1.00 0.00 H new ATOM 0 HE2 PHE A 23 -0.701 5.880 -18.662 1.00 0.00 H new ATOM 0 HZ PHE A 23 -0.923 3.441 -18.405 1.00 0.00 H new ATOM 310 N ASN A 24 -3.049 8.521 -12.811 1.00 0.00 N ATOM 311 CA ASN A 24 -3.122 9.819 -12.149 1.00 0.00 C ATOM 312 C ASN A 24 -4.174 9.808 -11.044 1.00 0.00 C ATOM 313 O ASN A 24 -5.022 10.695 -10.953 1.00 0.00 O ATOM 314 CB ASN A 24 -3.445 10.916 -13.166 1.00 0.00 C ATOM 315 CG ASN A 24 -2.212 11.403 -13.903 1.00 0.00 C ATOM 316 OD1 ASN A 24 -2.154 11.365 -15.132 1.00 0.00 O ATOM 317 ND2 ASN A 24 -1.218 11.864 -13.152 1.00 0.00 N ATOM 0 H ASN A 24 -2.138 8.067 -12.750 1.00 0.00 H new ATOM 0 HA ASN A 24 -2.151 10.025 -11.699 1.00 0.00 H new ATOM 0 HB2 ASN A 24 -4.170 10.537 -13.887 1.00 0.00 H new ATOM 0 HB3 ASN A 24 -3.914 11.756 -12.654 1.00 0.00 H new ATOM 0 HD21 ASN A 24 -0.363 12.205 -13.591 1.00 0.00 H new ATOM 0 HD22 ASN A 24 -1.310 11.877 -12.136 1.00 0.00 H new ATOM 324 N PRO A 25 -4.117 8.781 -10.184 1.00 0.00 N ATOM 325 CA PRO A 25 -5.057 8.630 -9.069 1.00 0.00 C ATOM 326 C PRO A 25 -4.840 9.679 -7.983 1.00 0.00 C ATOM 327 O PRO A 25 -3.712 10.050 -7.661 1.00 0.00 O ATOM 328 CB PRO A 25 -4.746 7.231 -8.530 1.00 0.00 C ATOM 329 CG PRO A 25 -3.331 6.980 -8.921 1.00 0.00 C ATOM 330 CD PRO A 25 -3.132 7.688 -10.233 1.00 0.00 C ATOM 0 HA PRO A 25 -6.091 8.759 -9.387 1.00 0.00 H new ATOM 0 HB2 PRO A 25 -4.872 7.187 -7.448 1.00 0.00 H new ATOM 0 HB3 PRO A 25 -5.414 6.484 -8.959 1.00 0.00 H new ATOM 0 HG2 PRO A 25 -2.644 7.359 -8.165 1.00 0.00 H new ATOM 0 HG3 PRO A 25 -3.137 5.912 -9.021 1.00 0.00 H new ATOM 0 HD2 PRO A 25 -2.115 8.068 -10.334 1.00 0.00 H new ATOM 0 HD3 PRO A 25 -3.310 7.024 -11.079 1.00 0.00 H new ATOM 338 N PRO A 26 -5.947 10.169 -7.404 1.00 0.00 N ATOM 339 CA PRO A 26 -5.903 11.181 -6.344 1.00 0.00 C ATOM 340 C PRO A 26 -5.345 10.629 -5.037 1.00 0.00 C ATOM 341 O PRO A 26 -4.956 9.463 -4.960 1.00 0.00 O ATOM 342 CB PRO A 26 -7.372 11.578 -6.173 1.00 0.00 C ATOM 343 CG PRO A 26 -8.142 10.391 -6.638 1.00 0.00 C ATOM 344 CD PRO A 26 -7.325 9.772 -7.738 1.00 0.00 C ATOM 0 HA PRO A 26 -5.249 12.014 -6.602 1.00 0.00 H new ATOM 0 HB2 PRO A 26 -7.600 11.815 -5.134 1.00 0.00 H new ATOM 0 HB3 PRO A 26 -7.614 12.463 -6.762 1.00 0.00 H new ATOM 0 HG2 PRO A 26 -8.299 9.684 -5.823 1.00 0.00 H new ATOM 0 HG3 PRO A 26 -9.128 10.683 -7.001 1.00 0.00 H new ATOM 0 HD2 PRO A 26 -7.437 8.688 -7.760 1.00 0.00 H new ATOM 0 HD3 PRO A 26 -7.624 10.143 -8.718 1.00 0.00 H new ATOM 352 N VAL A 27 -5.309 11.473 -4.011 1.00 0.00 N ATOM 353 CA VAL A 27 -4.799 11.068 -2.706 1.00 0.00 C ATOM 354 C VAL A 27 -5.612 11.697 -1.580 1.00 0.00 C ATOM 355 O VAL A 27 -5.975 12.873 -1.624 1.00 0.00 O ATOM 356 CB VAL A 27 -3.319 11.458 -2.536 1.00 0.00 C ATOM 357 CG1 VAL A 27 -2.829 11.101 -1.141 1.00 0.00 C ATOM 358 CG2 VAL A 27 -2.465 10.784 -3.598 1.00 0.00 C ATOM 0 H VAL A 27 -5.627 12.441 -4.058 1.00 0.00 H new ATOM 0 HA VAL A 27 -4.889 9.983 -2.653 1.00 0.00 H new ATOM 0 HB VAL A 27 -3.230 12.537 -2.661 1.00 0.00 H new ATOM 0 HG11 VAL A 27 -1.781 11.384 -1.040 1.00 0.00 H new ATOM 0 HG12 VAL A 27 -3.422 11.635 -0.399 1.00 0.00 H new ATOM 0 HG13 VAL A 27 -2.932 10.027 -0.983 1.00 0.00 H new ATOM 0 HG21 VAL A 27 -1.422 11.071 -3.462 1.00 0.00 H new ATOM 0 HG22 VAL A 27 -2.558 9.702 -3.507 1.00 0.00 H new ATOM 0 HG23 VAL A 27 -2.801 11.095 -4.587 1.00 0.00 H new ATOM 368 N PRO A 28 -5.906 10.897 -0.544 1.00 0.00 N ATOM 369 CA PRO A 28 -5.480 9.496 -0.481 1.00 0.00 C ATOM 370 C PRO A 28 -6.213 8.620 -1.491 1.00 0.00 C ATOM 371 O PRO A 28 -7.391 8.839 -1.777 1.00 0.00 O ATOM 372 CB PRO A 28 -5.840 9.080 0.948 1.00 0.00 C ATOM 373 CG PRO A 28 -6.949 9.993 1.340 1.00 0.00 C ATOM 374 CD PRO A 28 -6.676 11.298 0.645 1.00 0.00 C ATOM 0 HA PRO A 28 -4.423 9.381 -0.720 1.00 0.00 H new ATOM 0 HB2 PRO A 28 -6.153 8.037 0.990 1.00 0.00 H new ATOM 0 HB3 PRO A 28 -4.986 9.184 1.618 1.00 0.00 H new ATOM 0 HG2 PRO A 28 -7.914 9.586 1.040 1.00 0.00 H new ATOM 0 HG3 PRO A 28 -6.981 10.126 2.421 1.00 0.00 H new ATOM 0 HD2 PRO A 28 -7.599 11.809 0.372 1.00 0.00 H new ATOM 0 HD3 PRO A 28 -6.110 11.980 1.279 1.00 0.00 H new ATOM 382 N TYR A 29 -5.511 7.629 -2.028 1.00 0.00 N ATOM 383 CA TYR A 29 -6.095 6.722 -3.009 1.00 0.00 C ATOM 384 C TYR A 29 -6.567 5.432 -2.344 1.00 0.00 C ATOM 385 O TYR A 29 -5.787 4.732 -1.698 1.00 0.00 O ATOM 386 CB TYR A 29 -5.080 6.401 -4.107 1.00 0.00 C ATOM 387 CG TYR A 29 -5.454 5.200 -4.945 1.00 0.00 C ATOM 388 CD1 TYR A 29 -5.137 3.912 -4.530 1.00 0.00 C ATOM 389 CD2 TYR A 29 -6.123 5.352 -6.153 1.00 0.00 C ATOM 390 CE1 TYR A 29 -5.476 2.812 -5.293 1.00 0.00 C ATOM 391 CE2 TYR A 29 -6.468 4.257 -6.922 1.00 0.00 C ATOM 392 CZ TYR A 29 -6.141 2.989 -6.487 1.00 0.00 C ATOM 393 OH TYR A 29 -6.481 1.896 -7.251 1.00 0.00 O ATOM 0 H TYR A 29 -4.536 7.433 -1.801 1.00 0.00 H new ATOM 0 HA TYR A 29 -6.958 7.217 -3.455 1.00 0.00 H new ATOM 0 HB2 TYR A 29 -4.975 7.269 -4.758 1.00 0.00 H new ATOM 0 HB3 TYR A 29 -4.106 6.225 -3.650 1.00 0.00 H new ATOM 0 HD1 TYR A 29 -4.617 3.769 -3.595 1.00 0.00 H new ATOM 0 HD2 TYR A 29 -6.378 6.343 -6.497 1.00 0.00 H new ATOM 0 HE1 TYR A 29 -5.221 1.818 -4.956 1.00 0.00 H new ATOM 0 HE2 TYR A 29 -6.990 4.393 -7.858 1.00 0.00 H new ATOM 0 HH TYR A 29 -7.455 1.789 -7.254 1.00 0.00 H new ATOM 403 N PHE A 30 -7.849 5.124 -2.509 1.00 0.00 N ATOM 404 CA PHE A 30 -8.427 3.919 -1.925 1.00 0.00 C ATOM 405 C PHE A 30 -8.717 2.878 -3.003 1.00 0.00 C ATOM 406 O PHE A 30 -9.698 2.986 -3.737 1.00 0.00 O ATOM 407 CB PHE A 30 -9.712 4.259 -1.169 1.00 0.00 C ATOM 408 CG PHE A 30 -9.510 5.245 -0.054 1.00 0.00 C ATOM 409 CD1 PHE A 30 -9.190 4.811 1.222 1.00 0.00 C ATOM 410 CD2 PHE A 30 -9.638 6.605 -0.283 1.00 0.00 C ATOM 411 CE1 PHE A 30 -9.004 5.716 2.250 1.00 0.00 C ATOM 412 CE2 PHE A 30 -9.452 7.515 0.740 1.00 0.00 C ATOM 413 CZ PHE A 30 -9.133 7.070 2.008 1.00 0.00 C ATOM 0 H PHE A 30 -8.507 5.692 -3.042 1.00 0.00 H new ATOM 0 HA PHE A 30 -7.703 3.500 -1.226 1.00 0.00 H new ATOM 0 HB2 PHE A 30 -10.441 4.662 -1.872 1.00 0.00 H new ATOM 0 HB3 PHE A 30 -10.136 3.342 -0.760 1.00 0.00 H new ATOM 0 HD1 PHE A 30 -9.085 3.754 1.416 1.00 0.00 H new ATOM 0 HD2 PHE A 30 -9.886 6.958 -1.273 1.00 0.00 H new ATOM 0 HE1 PHE A 30 -8.758 5.365 3.241 1.00 0.00 H new ATOM 0 HE2 PHE A 30 -9.556 8.573 0.548 1.00 0.00 H new ATOM 0 HZ PHE A 30 -8.985 7.779 2.809 1.00 0.00 H new ATOM 423 N GLY A 31 -7.855 1.870 -3.092 1.00 0.00 N ATOM 424 CA GLY A 31 -8.035 0.825 -4.082 1.00 0.00 C ATOM 425 C GLY A 31 -8.464 -0.491 -3.465 1.00 0.00 C ATOM 426 O GLY A 31 -7.686 -1.140 -2.766 1.00 0.00 O ATOM 0 H GLY A 31 -7.035 1.759 -2.496 1.00 0.00 H new ATOM 0 HA2 GLY A 31 -8.782 1.143 -4.809 1.00 0.00 H new ATOM 0 HA3 GLY A 31 -7.102 0.680 -4.627 1.00 0.00 H new ATOM 430 N ARG A 32 -9.707 -0.886 -3.722 1.00 0.00 N ATOM 431 CA ARG A 32 -10.239 -2.132 -3.184 1.00 0.00 C ATOM 432 C ARG A 32 -9.636 -3.336 -3.902 1.00 0.00 C ATOM 433 O ARG A 32 -9.879 -3.550 -5.090 1.00 0.00 O ATOM 434 CB ARG A 32 -11.763 -2.158 -3.314 1.00 0.00 C ATOM 435 CG ARG A 32 -12.488 -1.600 -2.100 1.00 0.00 C ATOM 436 CD ARG A 32 -12.793 -2.690 -1.084 1.00 0.00 C ATOM 437 NE ARG A 32 -13.875 -2.308 -0.180 1.00 0.00 N ATOM 438 CZ ARG A 32 -14.643 -3.184 0.458 1.00 0.00 C ATOM 439 NH1 ARG A 32 -14.448 -4.485 0.293 1.00 0.00 N ATOM 440 NH2 ARG A 32 -15.608 -2.759 1.264 1.00 0.00 N ATOM 0 H ARG A 32 -10.364 -0.361 -4.299 1.00 0.00 H new ATOM 0 HA ARG A 32 -9.970 -2.188 -2.129 1.00 0.00 H new ATOM 0 HB2 ARG A 32 -12.054 -1.586 -4.195 1.00 0.00 H new ATOM 0 HB3 ARG A 32 -12.087 -3.185 -3.480 1.00 0.00 H new ATOM 0 HG2 ARG A 32 -11.877 -0.827 -1.634 1.00 0.00 H new ATOM 0 HG3 ARG A 32 -13.417 -1.125 -2.416 1.00 0.00 H new ATOM 0 HD2 ARG A 32 -13.064 -3.607 -1.607 1.00 0.00 H new ATOM 0 HD3 ARG A 32 -11.896 -2.907 -0.504 1.00 0.00 H new ATOM 0 HE ARG A 32 -14.050 -1.314 -0.031 1.00 0.00 H new ATOM 0 HH11 ARG A 32 -13.707 -4.815 -0.325 1.00 0.00 H new ATOM 0 HH12 ARG A 32 -15.039 -5.156 0.784 1.00 0.00 H new ATOM 0 HH21 ARG A 32 -15.760 -1.759 1.394 1.00 0.00 H new ATOM 0 HH22 ARG A 32 -16.197 -3.433 1.753 1.00 0.00 H new ATOM 454 N LEU A 33 -8.848 -4.119 -3.173 1.00 0.00 N ATOM 455 CA LEU A 33 -8.209 -5.302 -3.739 1.00 0.00 C ATOM 456 C LEU A 33 -9.225 -6.418 -3.956 1.00 0.00 C ATOM 457 O LEU A 33 -9.559 -7.155 -3.028 1.00 0.00 O ATOM 458 CB LEU A 33 -7.087 -5.788 -2.821 1.00 0.00 C ATOM 459 CG LEU A 33 -6.134 -4.713 -2.297 1.00 0.00 C ATOM 460 CD1 LEU A 33 -5.503 -5.153 -0.985 1.00 0.00 C ATOM 461 CD2 LEU A 33 -5.061 -4.402 -3.330 1.00 0.00 C ATOM 0 H LEU A 33 -8.636 -3.956 -2.189 1.00 0.00 H new ATOM 0 HA LEU A 33 -7.786 -5.029 -4.706 1.00 0.00 H new ATOM 0 HB2 LEU A 33 -7.537 -6.293 -1.967 1.00 0.00 H new ATOM 0 HB3 LEU A 33 -6.501 -6.533 -3.360 1.00 0.00 H new ATOM 0 HG LEU A 33 -6.707 -3.804 -2.114 1.00 0.00 H new ATOM 0 HD11 LEU A 33 -4.828 -4.376 -0.627 1.00 0.00 H new ATOM 0 HD12 LEU A 33 -6.285 -5.324 -0.245 1.00 0.00 H new ATOM 0 HD13 LEU A 33 -4.944 -6.075 -1.142 1.00 0.00 H new ATOM 0 HD21 LEU A 33 -4.392 -3.635 -2.940 1.00 0.00 H new ATOM 0 HD22 LEU A 33 -4.491 -5.306 -3.546 1.00 0.00 H new ATOM 0 HD23 LEU A 33 -5.531 -4.042 -4.246 1.00 0.00 H new ATOM 473 N GLN A 34 -9.711 -6.539 -5.187 1.00 0.00 N ATOM 474 CA GLN A 34 -10.688 -7.567 -5.525 1.00 0.00 C ATOM 475 C GLN A 34 -10.071 -8.958 -5.423 1.00 0.00 C ATOM 476 O GLN A 34 -9.448 -9.443 -6.367 1.00 0.00 O ATOM 477 CB GLN A 34 -11.232 -7.340 -6.937 1.00 0.00 C ATOM 478 CG GLN A 34 -12.334 -6.295 -7.003 1.00 0.00 C ATOM 479 CD GLN A 34 -13.296 -6.534 -8.150 1.00 0.00 C ATOM 480 OE1 GLN A 34 -12.937 -6.379 -9.318 1.00 0.00 O ATOM 481 NE2 GLN A 34 -14.526 -6.913 -7.824 1.00 0.00 N ATOM 0 H GLN A 34 -9.444 -5.938 -5.967 1.00 0.00 H new ATOM 0 HA GLN A 34 -11.510 -7.500 -4.812 1.00 0.00 H new ATOM 0 HB2 GLN A 34 -10.413 -7.034 -7.588 1.00 0.00 H new ATOM 0 HB3 GLN A 34 -11.614 -8.284 -7.327 1.00 0.00 H new ATOM 0 HG2 GLN A 34 -12.887 -6.296 -6.064 1.00 0.00 H new ATOM 0 HG3 GLN A 34 -11.887 -5.307 -7.109 1.00 0.00 H new ATOM 0 HE21 GLN A 34 -14.781 -7.029 -6.843 1.00 0.00 H new ATOM 0 HE22 GLN A 34 -15.216 -7.088 -8.554 1.00 0.00 H new ATOM 490 N GLY A 35 -10.249 -9.596 -4.270 1.00 0.00 N ATOM 491 CA GLY A 35 -9.703 -10.925 -4.066 1.00 0.00 C ATOM 492 C GLY A 35 -9.038 -11.077 -2.712 1.00 0.00 C ATOM 493 O GLY A 35 -9.212 -12.091 -2.037 1.00 0.00 O ATOM 0 H GLY A 35 -10.761 -9.216 -3.474 1.00 0.00 H new ATOM 0 HA2 GLY A 35 -10.502 -11.661 -4.160 1.00 0.00 H new ATOM 0 HA3 GLY A 35 -8.977 -11.141 -4.850 1.00 0.00 H new ATOM 497 N GLY A 36 -8.270 -10.067 -2.315 1.00 0.00 N ATOM 498 CA GLY A 36 -7.587 -10.113 -1.035 1.00 0.00 C ATOM 499 C GLY A 36 -6.154 -10.592 -1.161 1.00 0.00 C ATOM 500 O GLY A 36 -5.739 -11.061 -2.221 1.00 0.00 O ATOM 0 H GLY A 36 -8.109 -9.218 -2.857 1.00 0.00 H new ATOM 0 HA2 GLY A 36 -7.597 -9.120 -0.585 1.00 0.00 H new ATOM 0 HA3 GLY A 36 -8.130 -10.774 -0.360 1.00 0.00 H new ATOM 504 N LEU A 37 -5.395 -10.473 -0.077 1.00 0.00 N ATOM 505 CA LEU A 37 -3.999 -10.896 -0.071 1.00 0.00 C ATOM 506 C LEU A 37 -3.880 -12.385 -0.379 1.00 0.00 C ATOM 507 O LEU A 37 -4.170 -13.231 0.467 1.00 0.00 O ATOM 508 CB LEU A 37 -3.360 -10.592 1.286 1.00 0.00 C ATOM 509 CG LEU A 37 -3.257 -9.114 1.663 1.00 0.00 C ATOM 510 CD1 LEU A 37 -2.715 -8.960 3.076 1.00 0.00 C ATOM 511 CD2 LEU A 37 -2.378 -8.369 0.668 1.00 0.00 C ATOM 0 H LEU A 37 -5.723 -10.087 0.809 1.00 0.00 H new ATOM 0 HA LEU A 37 -3.473 -10.340 -0.847 1.00 0.00 H new ATOM 0 HB2 LEU A 37 -3.934 -11.104 2.058 1.00 0.00 H new ATOM 0 HB3 LEU A 37 -2.358 -11.020 1.297 1.00 0.00 H new ATOM 0 HG LEU A 37 -4.256 -8.680 1.630 1.00 0.00 H new ATOM 0 HD11 LEU A 37 -2.649 -7.901 3.327 1.00 0.00 H new ATOM 0 HD12 LEU A 37 -3.383 -9.458 3.778 1.00 0.00 H new ATOM 0 HD13 LEU A 37 -1.724 -9.410 3.137 1.00 0.00 H new ATOM 0 HD21 LEU A 37 -2.316 -7.319 0.952 1.00 0.00 H new ATOM 0 HD22 LEU A 37 -1.379 -8.804 0.668 1.00 0.00 H new ATOM 0 HD23 LEU A 37 -2.809 -8.450 -0.330 1.00 0.00 H new ATOM 523 N THR A 38 -3.448 -12.698 -1.597 1.00 0.00 N ATOM 524 CA THR A 38 -3.289 -14.085 -2.018 1.00 0.00 C ATOM 525 C THR A 38 -1.833 -14.397 -2.342 1.00 0.00 C ATOM 526 O THR A 38 -1.041 -13.496 -2.617 1.00 0.00 O ATOM 527 CB THR A 38 -4.157 -14.401 -3.251 1.00 0.00 C ATOM 528 OG1 THR A 38 -3.661 -13.694 -4.393 1.00 0.00 O ATOM 529 CG2 THR A 38 -5.608 -14.019 -3.003 1.00 0.00 C ATOM 0 H THR A 38 -3.202 -12.010 -2.309 1.00 0.00 H new ATOM 0 HA THR A 38 -3.615 -14.708 -1.185 1.00 0.00 H new ATOM 0 HB THR A 38 -4.107 -15.474 -3.438 1.00 0.00 H new ATOM 0 HG1 THR A 38 -4.217 -13.901 -5.173 1.00 0.00 H new ATOM 0 HG21 THR A 38 -6.202 -14.251 -3.887 1.00 0.00 H new ATOM 0 HG22 THR A 38 -5.991 -14.580 -2.151 1.00 0.00 H new ATOM 0 HG23 THR A 38 -5.672 -12.951 -2.793 1.00 0.00 H new ATOM 537 N ALA A 39 -1.486 -15.680 -2.309 1.00 0.00 N ATOM 538 CA ALA A 39 -0.125 -16.111 -2.602 1.00 0.00 C ATOM 539 C ALA A 39 0.250 -15.801 -4.047 1.00 0.00 C ATOM 540 O ALA A 39 1.426 -15.812 -4.410 1.00 0.00 O ATOM 541 CB ALA A 39 0.029 -17.599 -2.322 1.00 0.00 C ATOM 0 H ALA A 39 -2.129 -16.439 -2.082 1.00 0.00 H new ATOM 0 HA ALA A 39 0.553 -15.558 -1.952 1.00 0.00 H new ATOM 0 HB1 ALA A 39 1.050 -17.907 -2.545 1.00 0.00 H new ATOM 0 HB2 ALA A 39 -0.188 -17.796 -1.272 1.00 0.00 H new ATOM 0 HB3 ALA A 39 -0.665 -18.161 -2.948 1.00 0.00 H new ATOM 547 N ARG A 40 -0.758 -15.525 -4.869 1.00 0.00 N ATOM 548 CA ARG A 40 -0.533 -15.214 -6.276 1.00 0.00 C ATOM 549 C ARG A 40 -0.938 -13.776 -6.585 1.00 0.00 C ATOM 550 O ARG A 40 -1.245 -13.439 -7.729 1.00 0.00 O ATOM 551 CB ARG A 40 -1.319 -16.179 -7.165 1.00 0.00 C ATOM 552 CG ARG A 40 -2.819 -16.154 -6.915 1.00 0.00 C ATOM 553 CD ARG A 40 -3.225 -17.172 -5.862 1.00 0.00 C ATOM 554 NE ARG A 40 -3.284 -18.527 -6.405 1.00 0.00 N ATOM 555 CZ ARG A 40 -4.057 -19.485 -5.906 1.00 0.00 C ATOM 556 NH1 ARG A 40 -4.832 -19.239 -4.858 1.00 0.00 N ATOM 557 NH2 ARG A 40 -4.056 -20.693 -6.455 1.00 0.00 N ATOM 0 H ARG A 40 -1.738 -15.510 -4.585 1.00 0.00 H new ATOM 0 HA ARG A 40 0.531 -15.326 -6.482 1.00 0.00 H new ATOM 0 HB2 ARG A 40 -1.129 -15.933 -8.210 1.00 0.00 H new ATOM 0 HB3 ARG A 40 -0.949 -17.192 -7.003 1.00 0.00 H new ATOM 0 HG2 ARG A 40 -3.119 -15.157 -6.593 1.00 0.00 H new ATOM 0 HG3 ARG A 40 -3.348 -16.361 -7.846 1.00 0.00 H new ATOM 0 HD2 ARG A 40 -2.514 -17.143 -5.036 1.00 0.00 H new ATOM 0 HD3 ARG A 40 -4.199 -16.902 -5.454 1.00 0.00 H new ATOM 0 HE ARG A 40 -2.700 -18.749 -7.211 1.00 0.00 H new ATOM 0 HH11 ARG A 40 -4.836 -18.312 -4.433 1.00 0.00 H new ATOM 0 HH12 ARG A 40 -5.424 -19.977 -4.477 1.00 0.00 H new ATOM 0 HH21 ARG A 40 -3.461 -20.886 -7.261 1.00 0.00 H new ATOM 0 HH22 ARG A 40 -4.650 -21.428 -6.071 1.00 0.00 H new ATOM 571 N ARG A 41 -0.936 -12.932 -5.559 1.00 0.00 N ATOM 572 CA ARG A 41 -1.304 -11.530 -5.721 1.00 0.00 C ATOM 573 C ARG A 41 -0.098 -10.622 -5.497 1.00 0.00 C ATOM 574 O ARG A 41 0.667 -10.808 -4.550 1.00 0.00 O ATOM 575 CB ARG A 41 -2.423 -11.159 -4.747 1.00 0.00 C ATOM 576 CG ARG A 41 -2.619 -9.660 -4.587 1.00 0.00 C ATOM 577 CD ARG A 41 -3.837 -9.346 -3.732 1.00 0.00 C ATOM 578 NE ARG A 41 -5.061 -9.913 -4.293 1.00 0.00 N ATOM 579 CZ ARG A 41 -5.792 -9.308 -5.222 1.00 0.00 C ATOM 580 NH1 ARG A 41 -5.426 -8.124 -5.693 1.00 0.00 N ATOM 581 NH2 ARG A 41 -6.893 -9.889 -5.683 1.00 0.00 N ATOM 0 H ARG A 41 -0.684 -13.194 -4.606 1.00 0.00 H new ATOM 0 HA ARG A 41 -1.659 -11.389 -6.742 1.00 0.00 H new ATOM 0 HB2 ARG A 41 -3.356 -11.604 -5.092 1.00 0.00 H new ATOM 0 HB3 ARG A 41 -2.204 -11.594 -3.772 1.00 0.00 H new ATOM 0 HG2 ARG A 41 -1.731 -9.222 -4.132 1.00 0.00 H new ATOM 0 HG3 ARG A 41 -2.734 -9.200 -5.569 1.00 0.00 H new ATOM 0 HD2 ARG A 41 -3.684 -9.737 -2.726 1.00 0.00 H new ATOM 0 HD3 ARG A 41 -3.947 -8.265 -3.641 1.00 0.00 H new ATOM 0 HE ARG A 41 -5.371 -10.823 -3.953 1.00 0.00 H new ATOM 0 HH11 ARG A 41 -4.580 -7.675 -5.342 1.00 0.00 H new ATOM 0 HH12 ARG A 41 -5.990 -7.662 -6.407 1.00 0.00 H new ATOM 0 HH21 ARG A 41 -7.178 -10.800 -5.324 1.00 0.00 H new ATOM 0 HH22 ARG A 41 -7.454 -9.424 -6.397 1.00 0.00 H new ATOM 595 N THR A 42 0.066 -9.638 -6.376 1.00 0.00 N ATOM 596 CA THR A 42 1.178 -8.702 -6.276 1.00 0.00 C ATOM 597 C THR A 42 0.703 -7.263 -6.443 1.00 0.00 C ATOM 598 O THR A 42 0.045 -6.927 -7.428 1.00 0.00 O ATOM 599 CB THR A 42 2.259 -8.999 -7.332 1.00 0.00 C ATOM 600 OG1 THR A 42 2.764 -10.327 -7.156 1.00 0.00 O ATOM 601 CG2 THR A 42 3.402 -8.000 -7.233 1.00 0.00 C ATOM 0 H THR A 42 -0.558 -9.469 -7.165 1.00 0.00 H new ATOM 0 HA THR A 42 1.607 -8.827 -5.282 1.00 0.00 H new ATOM 0 HB THR A 42 1.805 -8.911 -8.319 1.00 0.00 H new ATOM 0 HG1 THR A 42 3.450 -10.509 -7.832 1.00 0.00 H new ATOM 0 HG21 THR A 42 4.153 -8.230 -7.989 1.00 0.00 H new ATOM 0 HG22 THR A 42 3.020 -6.992 -7.396 1.00 0.00 H new ATOM 0 HG23 THR A 42 3.853 -8.061 -6.243 1.00 0.00 H new ATOM 609 N ILE A 43 1.040 -6.417 -5.475 1.00 0.00 N ATOM 610 CA ILE A 43 0.649 -5.014 -5.517 1.00 0.00 C ATOM 611 C ILE A 43 1.760 -4.150 -6.105 1.00 0.00 C ATOM 612 O ILE A 43 2.938 -4.347 -5.804 1.00 0.00 O ATOM 613 CB ILE A 43 0.292 -4.487 -4.114 1.00 0.00 C ATOM 614 CG1 ILE A 43 -0.862 -5.297 -3.520 1.00 0.00 C ATOM 615 CG2 ILE A 43 -0.069 -3.010 -4.179 1.00 0.00 C ATOM 616 CD1 ILE A 43 -0.422 -6.595 -2.879 1.00 0.00 C ATOM 0 H ILE A 43 1.583 -6.679 -4.652 1.00 0.00 H new ATOM 0 HA ILE A 43 -0.232 -4.951 -6.155 1.00 0.00 H new ATOM 0 HB ILE A 43 1.162 -4.600 -3.467 1.00 0.00 H new ATOM 0 HG12 ILE A 43 -1.376 -4.689 -2.775 1.00 0.00 H new ATOM 0 HG13 ILE A 43 -1.584 -5.516 -4.307 1.00 0.00 H new ATOM 0 HG21 ILE A 43 -0.319 -2.652 -3.180 1.00 0.00 H new ATOM 0 HG22 ILE A 43 0.779 -2.445 -4.565 1.00 0.00 H new ATOM 0 HG23 ILE A 43 -0.926 -2.874 -4.838 1.00 0.00 H new ATOM 0 HD11 ILE A 43 -1.292 -7.117 -2.479 1.00 0.00 H new ATOM 0 HD12 ILE A 43 0.066 -7.222 -3.625 1.00 0.00 H new ATOM 0 HD13 ILE A 43 0.277 -6.383 -2.070 1.00 0.00 H new ATOM 628 N ILE A 44 1.377 -3.193 -6.942 1.00 0.00 N ATOM 629 CA ILE A 44 2.341 -2.297 -7.570 1.00 0.00 C ATOM 630 C ILE A 44 1.939 -0.838 -7.382 1.00 0.00 C ATOM 631 O ILE A 44 0.818 -0.447 -7.707 1.00 0.00 O ATOM 632 CB ILE A 44 2.484 -2.589 -9.075 1.00 0.00 C ATOM 633 CG1 ILE A 44 3.045 -3.996 -9.293 1.00 0.00 C ATOM 634 CG2 ILE A 44 3.376 -1.549 -9.734 1.00 0.00 C ATOM 635 CD1 ILE A 44 2.908 -4.487 -10.718 1.00 0.00 C ATOM 0 H ILE A 44 0.406 -3.017 -7.202 1.00 0.00 H new ATOM 0 HA ILE A 44 3.300 -2.473 -7.082 1.00 0.00 H new ATOM 0 HB ILE A 44 1.497 -2.537 -9.535 1.00 0.00 H new ATOM 0 HG12 ILE A 44 4.099 -4.006 -9.014 1.00 0.00 H new ATOM 0 HG13 ILE A 44 2.532 -4.690 -8.627 1.00 0.00 H new ATOM 0 HG21 ILE A 44 3.467 -1.769 -10.798 1.00 0.00 H new ATOM 0 HG22 ILE A 44 2.938 -0.559 -9.605 1.00 0.00 H new ATOM 0 HG23 ILE A 44 4.363 -1.572 -9.273 1.00 0.00 H new ATOM 0 HD11 ILE A 44 3.326 -5.490 -10.799 1.00 0.00 H new ATOM 0 HD12 ILE A 44 1.854 -4.510 -10.995 1.00 0.00 H new ATOM 0 HD13 ILE A 44 3.445 -3.815 -11.388 1.00 0.00 H new ATOM 647 N ILE A 45 2.862 -0.039 -6.858 1.00 0.00 N ATOM 648 CA ILE A 45 2.604 1.378 -6.630 1.00 0.00 C ATOM 649 C ILE A 45 3.671 2.244 -7.291 1.00 0.00 C ATOM 650 O ILE A 45 4.811 2.305 -6.828 1.00 0.00 O ATOM 651 CB ILE A 45 2.552 1.705 -5.126 1.00 0.00 C ATOM 652 CG1 ILE A 45 1.394 0.960 -4.460 1.00 0.00 C ATOM 653 CG2 ILE A 45 2.414 3.206 -4.916 1.00 0.00 C ATOM 654 CD1 ILE A 45 1.554 0.810 -2.963 1.00 0.00 C ATOM 0 H ILE A 45 3.794 -0.348 -6.583 1.00 0.00 H new ATOM 0 HA ILE A 45 1.634 1.598 -7.075 1.00 0.00 H new ATOM 0 HB ILE A 45 3.483 1.377 -4.665 1.00 0.00 H new ATOM 0 HG12 ILE A 45 0.464 1.490 -4.667 1.00 0.00 H new ATOM 0 HG13 ILE A 45 1.303 -0.029 -4.909 1.00 0.00 H new ATOM 0 HG21 ILE A 45 2.378 3.422 -3.848 1.00 0.00 H new ATOM 0 HG22 ILE A 45 3.268 3.716 -5.361 1.00 0.00 H new ATOM 0 HG23 ILE A 45 1.496 3.557 -5.388 1.00 0.00 H new ATOM 0 HD11 ILE A 45 0.697 0.272 -2.558 1.00 0.00 H new ATOM 0 HD12 ILE A 45 2.466 0.253 -2.749 1.00 0.00 H new ATOM 0 HD13 ILE A 45 1.615 1.796 -2.503 1.00 0.00 H new ATOM 666 N LYS A 46 3.294 2.913 -8.375 1.00 0.00 N ATOM 667 CA LYS A 46 4.217 3.779 -9.099 1.00 0.00 C ATOM 668 C LYS A 46 3.810 5.243 -8.962 1.00 0.00 C ATOM 669 O LYS A 46 2.775 5.661 -9.480 1.00 0.00 O ATOM 670 CB LYS A 46 4.263 3.388 -10.578 1.00 0.00 C ATOM 671 CG LYS A 46 5.347 2.376 -10.906 1.00 0.00 C ATOM 672 CD LYS A 46 5.151 1.777 -12.289 1.00 0.00 C ATOM 673 CE LYS A 46 4.305 0.515 -12.235 1.00 0.00 C ATOM 674 NZ LYS A 46 4.333 -0.227 -13.526 1.00 0.00 N ATOM 0 H LYS A 46 2.355 2.872 -8.772 1.00 0.00 H new ATOM 0 HA LYS A 46 5.209 3.653 -8.665 1.00 0.00 H new ATOM 0 HB2 LYS A 46 3.295 2.978 -10.867 1.00 0.00 H new ATOM 0 HB3 LYS A 46 4.421 4.285 -11.177 1.00 0.00 H new ATOM 0 HG2 LYS A 46 6.324 2.857 -10.852 1.00 0.00 H new ATOM 0 HG3 LYS A 46 5.342 1.581 -10.160 1.00 0.00 H new ATOM 0 HD2 LYS A 46 4.673 2.509 -12.939 1.00 0.00 H new ATOM 0 HD3 LYS A 46 6.122 1.547 -12.728 1.00 0.00 H new ATOM 0 HE2 LYS A 46 4.668 -0.132 -11.436 1.00 0.00 H new ATOM 0 HE3 LYS A 46 3.276 0.778 -11.989 1.00 0.00 H new ATOM 0 HZ1 LYS A 46 3.744 -1.081 -13.448 1.00 0.00 H new ATOM 0 HZ2 LYS A 46 3.963 0.381 -14.284 1.00 0.00 H new ATOM 0 HZ3 LYS A 46 5.312 -0.500 -13.748 1.00 0.00 H new ATOM 688 N GLY A 47 4.633 6.019 -8.263 1.00 0.00 N ATOM 689 CA GLY A 47 4.341 7.428 -8.072 1.00 0.00 C ATOM 690 C GLY A 47 5.591 8.285 -8.087 1.00 0.00 C ATOM 691 O GLY A 47 6.515 8.036 -8.862 1.00 0.00 O ATOM 0 H GLY A 47 5.496 5.697 -7.826 1.00 0.00 H new ATOM 0 HA2 GLY A 47 3.663 7.765 -8.856 1.00 0.00 H new ATOM 0 HA3 GLY A 47 3.823 7.563 -7.123 1.00 0.00 H new ATOM 695 N TYR A 48 5.621 9.299 -7.229 1.00 0.00 N ATOM 696 CA TYR A 48 6.765 10.200 -7.149 1.00 0.00 C ATOM 697 C TYR A 48 6.664 11.101 -5.923 1.00 0.00 C ATOM 698 O TYR A 48 5.676 11.812 -5.740 1.00 0.00 O ATOM 699 CB TYR A 48 6.859 11.052 -8.416 1.00 0.00 C ATOM 700 CG TYR A 48 7.503 12.401 -8.191 1.00 0.00 C ATOM 701 CD1 TYR A 48 6.761 13.477 -7.721 1.00 0.00 C ATOM 702 CD2 TYR A 48 8.854 12.600 -8.451 1.00 0.00 C ATOM 703 CE1 TYR A 48 7.345 14.712 -7.514 1.00 0.00 C ATOM 704 CE2 TYR A 48 9.446 13.831 -8.246 1.00 0.00 C ATOM 705 CZ TYR A 48 8.688 14.884 -7.778 1.00 0.00 C ATOM 706 OH TYR A 48 9.275 16.112 -7.574 1.00 0.00 O ATOM 0 H TYR A 48 4.866 9.518 -6.579 1.00 0.00 H new ATOM 0 HA TYR A 48 7.667 9.594 -7.059 1.00 0.00 H new ATOM 0 HB2 TYR A 48 7.429 10.507 -9.169 1.00 0.00 H new ATOM 0 HB3 TYR A 48 5.857 11.200 -8.820 1.00 0.00 H new ATOM 0 HD1 TYR A 48 5.709 13.346 -7.514 1.00 0.00 H new ATOM 0 HD2 TYR A 48 9.451 11.779 -8.819 1.00 0.00 H new ATOM 0 HE1 TYR A 48 6.753 15.538 -7.148 1.00 0.00 H new ATOM 0 HE2 TYR A 48 10.497 13.968 -8.451 1.00 0.00 H new ATOM 0 HH TYR A 48 9.782 16.369 -8.372 1.00 0.00 H new ATOM 716 N VAL A 49 7.695 11.066 -5.084 1.00 0.00 N ATOM 717 CA VAL A 49 7.725 11.880 -3.875 1.00 0.00 C ATOM 718 C VAL A 49 8.018 13.340 -4.203 1.00 0.00 C ATOM 719 O VAL A 49 9.086 13.687 -4.707 1.00 0.00 O ATOM 720 CB VAL A 49 8.783 11.367 -2.880 1.00 0.00 C ATOM 721 CG1 VAL A 49 8.621 12.050 -1.530 1.00 0.00 C ATOM 722 CG2 VAL A 49 8.690 9.856 -2.736 1.00 0.00 C ATOM 0 H VAL A 49 8.520 10.482 -5.220 1.00 0.00 H new ATOM 0 HA VAL A 49 6.739 11.804 -3.417 1.00 0.00 H new ATOM 0 HB VAL A 49 9.771 11.612 -3.269 1.00 0.00 H new ATOM 0 HG11 VAL A 49 9.377 11.675 -0.840 1.00 0.00 H new ATOM 0 HG12 VAL A 49 8.741 13.127 -1.650 1.00 0.00 H new ATOM 0 HG13 VAL A 49 7.629 11.838 -1.132 1.00 0.00 H new ATOM 0 HG21 VAL A 49 9.445 9.511 -2.029 1.00 0.00 H new ATOM 0 HG22 VAL A 49 7.700 9.586 -2.370 1.00 0.00 H new ATOM 0 HG23 VAL A 49 8.859 9.387 -3.705 1.00 0.00 H new ATOM 732 N PRO A 50 7.046 14.218 -3.911 1.00 0.00 N ATOM 733 CA PRO A 50 7.176 15.656 -4.165 1.00 0.00 C ATOM 734 C PRO A 50 8.189 16.319 -3.239 1.00 0.00 C ATOM 735 O PRO A 50 8.518 15.806 -2.169 1.00 0.00 O ATOM 736 CB PRO A 50 5.769 16.193 -3.891 1.00 0.00 C ATOM 737 CG PRO A 50 5.168 15.213 -2.944 1.00 0.00 C ATOM 738 CD PRO A 50 5.747 13.874 -3.309 1.00 0.00 C ATOM 0 HA PRO A 50 7.537 15.861 -5.173 1.00 0.00 H new ATOM 0 HB2 PRO A 50 5.804 17.192 -3.457 1.00 0.00 H new ATOM 0 HB3 PRO A 50 5.187 16.264 -4.810 1.00 0.00 H new ATOM 0 HG2 PRO A 50 5.405 15.472 -1.912 1.00 0.00 H new ATOM 0 HG3 PRO A 50 4.081 15.204 -3.029 1.00 0.00 H new ATOM 0 HD2 PRO A 50 5.866 13.235 -2.434 1.00 0.00 H new ATOM 0 HD3 PRO A 50 5.108 13.337 -4.011 1.00 0.00 H new ATOM 746 N PRO A 51 8.698 17.488 -3.656 1.00 0.00 N ATOM 747 CA PRO A 51 9.680 18.247 -2.877 1.00 0.00 C ATOM 748 C PRO A 51 9.078 18.849 -1.612 1.00 0.00 C ATOM 749 O PRO A 51 9.792 19.161 -0.658 1.00 0.00 O ATOM 750 CB PRO A 51 10.117 19.354 -3.840 1.00 0.00 C ATOM 751 CG PRO A 51 8.967 19.523 -4.770 1.00 0.00 C ATOM 752 CD PRO A 51 8.351 18.159 -4.920 1.00 0.00 C ATOM 0 HA PRO A 51 10.499 17.617 -2.529 1.00 0.00 H new ATOM 0 HB2 PRO A 51 10.334 20.280 -3.307 1.00 0.00 H new ATOM 0 HB3 PRO A 51 11.023 19.076 -4.378 1.00 0.00 H new ATOM 0 HG2 PRO A 51 8.245 20.236 -4.372 1.00 0.00 H new ATOM 0 HG3 PRO A 51 9.298 19.910 -5.734 1.00 0.00 H new ATOM 0 HD2 PRO A 51 7.272 18.219 -5.060 1.00 0.00 H new ATOM 0 HD3 PRO A 51 8.756 17.628 -5.781 1.00 0.00 H new ATOM 760 N THR A 52 7.758 19.010 -1.609 1.00 0.00 N ATOM 761 CA THR A 52 7.059 19.575 -0.462 1.00 0.00 C ATOM 762 C THR A 52 6.305 18.497 0.308 1.00 0.00 C ATOM 763 O THR A 52 5.396 18.794 1.081 1.00 0.00 O ATOM 764 CB THR A 52 6.067 20.671 -0.892 1.00 0.00 C ATOM 765 OG1 THR A 52 5.237 20.191 -1.956 1.00 0.00 O ATOM 766 CG2 THR A 52 6.805 21.922 -1.344 1.00 0.00 C ATOM 0 H THR A 52 7.152 18.757 -2.389 1.00 0.00 H new ATOM 0 HA THR A 52 7.818 20.016 0.184 1.00 0.00 H new ATOM 0 HB THR A 52 5.446 20.925 -0.033 1.00 0.00 H new ATOM 0 HG1 THR A 52 4.608 20.893 -2.222 1.00 0.00 H new ATOM 0 HG21 THR A 52 6.083 22.682 -1.643 1.00 0.00 H new ATOM 0 HG22 THR A 52 7.413 22.302 -0.523 1.00 0.00 H new ATOM 0 HG23 THR A 52 7.448 21.679 -2.190 1.00 0.00 H new ATOM 774 N GLY A 53 6.691 17.242 0.092 1.00 0.00 N ATOM 775 CA GLY A 53 6.040 16.139 0.774 1.00 0.00 C ATOM 776 C GLY A 53 6.939 15.484 1.804 1.00 0.00 C ATOM 777 O GLY A 53 7.989 14.938 1.466 1.00 0.00 O ATOM 0 H GLY A 53 7.442 16.971 -0.542 1.00 0.00 H new ATOM 0 HA2 GLY A 53 5.136 16.501 1.263 1.00 0.00 H new ATOM 0 HA3 GLY A 53 5.730 15.395 0.041 1.00 0.00 H new ATOM 781 N LYS A 54 6.527 15.538 3.067 1.00 0.00 N ATOM 782 CA LYS A 54 7.302 14.946 4.151 1.00 0.00 C ATOM 783 C LYS A 54 7.448 13.441 3.956 1.00 0.00 C ATOM 784 O LYS A 54 8.560 12.925 3.843 1.00 0.00 O ATOM 785 CB LYS A 54 6.634 15.234 5.498 1.00 0.00 C ATOM 786 CG LYS A 54 6.385 16.711 5.749 1.00 0.00 C ATOM 787 CD LYS A 54 6.283 17.014 7.235 1.00 0.00 C ATOM 788 CE LYS A 54 7.618 16.816 7.936 1.00 0.00 C ATOM 789 NZ LYS A 54 7.607 17.374 9.317 1.00 0.00 N ATOM 0 H LYS A 54 5.660 15.986 3.365 1.00 0.00 H new ATOM 0 HA LYS A 54 8.296 15.394 4.141 1.00 0.00 H new ATOM 0 HB2 LYS A 54 5.684 14.701 5.545 1.00 0.00 H new ATOM 0 HB3 LYS A 54 7.261 14.839 6.297 1.00 0.00 H new ATOM 0 HG2 LYS A 54 7.194 17.297 5.312 1.00 0.00 H new ATOM 0 HG3 LYS A 54 5.465 17.016 5.250 1.00 0.00 H new ATOM 0 HD2 LYS A 54 5.945 18.041 7.376 1.00 0.00 H new ATOM 0 HD3 LYS A 54 5.533 16.367 7.689 1.00 0.00 H new ATOM 0 HE2 LYS A 54 7.853 15.752 7.976 1.00 0.00 H new ATOM 0 HE3 LYS A 54 8.407 17.295 7.357 1.00 0.00 H new ATOM 0 HZ1 LYS A 54 8.534 17.219 9.761 1.00 0.00 H new ATOM 0 HZ2 LYS A 54 7.408 18.394 9.278 1.00 0.00 H new ATOM 0 HZ3 LYS A 54 6.871 16.899 9.878 1.00 0.00 H new ATOM 803 N SER A 55 6.319 12.741 3.915 1.00 0.00 N ATOM 804 CA SER A 55 6.322 11.294 3.736 1.00 0.00 C ATOM 805 C SER A 55 4.900 10.761 3.592 1.00 0.00 C ATOM 806 O SER A 55 3.944 11.373 4.069 1.00 0.00 O ATOM 807 CB SER A 55 7.017 10.614 4.917 1.00 0.00 C ATOM 808 OG SER A 55 6.563 11.144 6.150 1.00 0.00 O ATOM 0 H SER A 55 5.390 13.153 4.003 1.00 0.00 H new ATOM 0 HA SER A 55 6.870 11.067 2.822 1.00 0.00 H new ATOM 0 HB2 SER A 55 6.826 9.541 4.887 1.00 0.00 H new ATOM 0 HB3 SER A 55 8.096 10.749 4.835 1.00 0.00 H new ATOM 0 HG SER A 55 7.021 10.692 6.889 1.00 0.00 H new ATOM 814 N PHE A 56 4.768 9.616 2.932 1.00 0.00 N ATOM 815 CA PHE A 56 3.462 8.999 2.724 1.00 0.00 C ATOM 816 C PHE A 56 3.320 7.731 3.561 1.00 0.00 C ATOM 817 O PHE A 56 4.184 7.414 4.378 1.00 0.00 O ATOM 818 CB PHE A 56 3.260 8.671 1.243 1.00 0.00 C ATOM 819 CG PHE A 56 4.382 7.870 0.647 1.00 0.00 C ATOM 820 CD1 PHE A 56 5.625 8.445 0.435 1.00 0.00 C ATOM 821 CD2 PHE A 56 4.194 6.543 0.298 1.00 0.00 C ATOM 822 CE1 PHE A 56 6.660 7.711 -0.112 1.00 0.00 C ATOM 823 CE2 PHE A 56 5.225 5.803 -0.250 1.00 0.00 C ATOM 824 CZ PHE A 56 6.459 6.388 -0.456 1.00 0.00 C ATOM 0 H PHE A 56 5.549 9.096 2.532 1.00 0.00 H new ATOM 0 HA PHE A 56 2.698 9.709 3.040 1.00 0.00 H new ATOM 0 HB2 PHE A 56 2.328 8.119 1.126 1.00 0.00 H new ATOM 0 HB3 PHE A 56 3.152 9.601 0.685 1.00 0.00 H new ATOM 0 HD1 PHE A 56 5.787 9.479 0.701 1.00 0.00 H new ATOM 0 HD2 PHE A 56 3.231 6.081 0.456 1.00 0.00 H new ATOM 0 HE1 PHE A 56 7.624 8.171 -0.270 1.00 0.00 H new ATOM 0 HE2 PHE A 56 5.066 4.769 -0.517 1.00 0.00 H new ATOM 0 HZ PHE A 56 7.266 5.812 -0.885 1.00 0.00 H new ATOM 834 N ALA A 57 2.223 7.011 3.351 1.00 0.00 N ATOM 835 CA ALA A 57 1.968 5.778 4.084 1.00 0.00 C ATOM 836 C ALA A 57 1.043 4.853 3.299 1.00 0.00 C ATOM 837 O ALA A 57 0.128 5.311 2.614 1.00 0.00 O ATOM 838 CB ALA A 57 1.371 6.089 5.449 1.00 0.00 C ATOM 0 H ALA A 57 1.497 7.261 2.679 1.00 0.00 H new ATOM 0 HA ALA A 57 2.919 5.265 4.224 1.00 0.00 H new ATOM 0 HB1 ALA A 57 1.186 5.159 5.986 1.00 0.00 H new ATOM 0 HB2 ALA A 57 2.067 6.704 6.019 1.00 0.00 H new ATOM 0 HB3 ALA A 57 0.432 6.627 5.321 1.00 0.00 H new ATOM 844 N ILE A 58 1.289 3.552 3.401 1.00 0.00 N ATOM 845 CA ILE A 58 0.479 2.564 2.700 1.00 0.00 C ATOM 846 C ILE A 58 -0.108 1.545 3.671 1.00 0.00 C ATOM 847 O ILE A 58 0.566 0.598 4.074 1.00 0.00 O ATOM 848 CB ILE A 58 1.298 1.822 1.627 1.00 0.00 C ATOM 849 CG1 ILE A 58 2.171 2.808 0.849 1.00 0.00 C ATOM 850 CG2 ILE A 58 0.374 1.065 0.685 1.00 0.00 C ATOM 851 CD1 ILE A 58 3.528 3.038 1.475 1.00 0.00 C ATOM 0 H ILE A 58 2.043 3.157 3.963 1.00 0.00 H new ATOM 0 HA ILE A 58 -0.331 3.108 2.214 1.00 0.00 H new ATOM 0 HB ILE A 58 1.949 1.101 2.121 1.00 0.00 H new ATOM 0 HG12 ILE A 58 2.307 2.437 -0.167 1.00 0.00 H new ATOM 0 HG13 ILE A 58 1.649 3.762 0.773 1.00 0.00 H new ATOM 0 HG21 ILE A 58 0.968 0.546 -0.068 1.00 0.00 H new ATOM 0 HG22 ILE A 58 -0.208 0.339 1.252 1.00 0.00 H new ATOM 0 HG23 ILE A 58 -0.300 1.767 0.194 1.00 0.00 H new ATOM 0 HD11 ILE A 58 4.092 3.748 0.870 1.00 0.00 H new ATOM 0 HD12 ILE A 58 3.402 3.439 2.481 1.00 0.00 H new ATOM 0 HD13 ILE A 58 4.070 2.094 1.526 1.00 0.00 H new ATOM 863 N ASN A 59 -1.368 1.746 4.042 1.00 0.00 N ATOM 864 CA ASN A 59 -2.047 0.844 4.965 1.00 0.00 C ATOM 865 C ASN A 59 -2.929 -0.146 4.210 1.00 0.00 C ATOM 866 O ASN A 59 -3.537 0.197 3.196 1.00 0.00 O ATOM 867 CB ASN A 59 -2.892 1.640 5.961 1.00 0.00 C ATOM 868 CG ASN A 59 -2.045 2.496 6.884 1.00 0.00 C ATOM 869 OD1 ASN A 59 -1.887 2.185 8.065 1.00 0.00 O ATOM 870 ND2 ASN A 59 -1.496 3.580 6.348 1.00 0.00 N ATOM 0 H ASN A 59 -1.940 2.526 3.718 1.00 0.00 H new ATOM 0 HA ASN A 59 -1.287 0.284 5.510 1.00 0.00 H new ATOM 0 HB2 ASN A 59 -3.587 2.278 5.415 1.00 0.00 H new ATOM 0 HB3 ASN A 59 -3.491 0.951 6.557 1.00 0.00 H new ATOM 0 HD21 ASN A 59 -0.916 4.194 6.920 1.00 0.00 H new ATOM 0 HD22 ASN A 59 -1.654 3.799 5.364 1.00 0.00 H new ATOM 877 N PHE A 60 -2.993 -1.375 4.711 1.00 0.00 N ATOM 878 CA PHE A 60 -3.801 -2.414 4.083 1.00 0.00 C ATOM 879 C PHE A 60 -4.894 -2.900 5.031 1.00 0.00 C ATOM 880 O PHE A 60 -4.654 -3.748 5.891 1.00 0.00 O ATOM 881 CB PHE A 60 -2.917 -3.590 3.660 1.00 0.00 C ATOM 882 CG PHE A 60 -1.963 -3.253 2.550 1.00 0.00 C ATOM 883 CD1 PHE A 60 -0.918 -2.368 2.762 1.00 0.00 C ATOM 884 CD2 PHE A 60 -2.110 -3.823 1.296 1.00 0.00 C ATOM 885 CE1 PHE A 60 -0.039 -2.056 1.742 1.00 0.00 C ATOM 886 CE2 PHE A 60 -1.233 -3.515 0.272 1.00 0.00 C ATOM 887 CZ PHE A 60 -0.196 -2.631 0.496 1.00 0.00 C ATOM 0 H PHE A 60 -2.496 -1.676 5.549 1.00 0.00 H new ATOM 0 HA PHE A 60 -4.275 -1.987 3.199 1.00 0.00 H new ATOM 0 HB2 PHE A 60 -2.349 -3.937 4.524 1.00 0.00 H new ATOM 0 HB3 PHE A 60 -3.553 -4.417 3.344 1.00 0.00 H new ATOM 0 HD1 PHE A 60 -0.789 -1.917 3.735 1.00 0.00 H new ATOM 0 HD2 PHE A 60 -2.919 -4.516 1.116 1.00 0.00 H new ATOM 0 HE1 PHE A 60 0.770 -1.363 1.919 1.00 0.00 H new ATOM 0 HE2 PHE A 60 -1.359 -3.965 -0.702 1.00 0.00 H new ATOM 0 HZ PHE A 60 0.491 -2.390 -0.302 1.00 0.00 H new ATOM 897 N LYS A 61 -6.095 -2.357 4.867 1.00 0.00 N ATOM 898 CA LYS A 61 -7.227 -2.733 5.705 1.00 0.00 C ATOM 899 C LYS A 61 -8.084 -3.792 5.019 1.00 0.00 C ATOM 900 O LYS A 61 -7.902 -4.081 3.836 1.00 0.00 O ATOM 901 CB LYS A 61 -8.078 -1.504 6.031 1.00 0.00 C ATOM 902 CG LYS A 61 -9.211 -1.789 7.002 1.00 0.00 C ATOM 903 CD LYS A 61 -9.876 -0.507 7.473 1.00 0.00 C ATOM 904 CE LYS A 61 -9.073 0.166 8.576 1.00 0.00 C ATOM 905 NZ LYS A 61 -9.584 1.531 8.881 1.00 0.00 N ATOM 0 H LYS A 61 -6.310 -1.654 4.160 1.00 0.00 H new ATOM 0 HA LYS A 61 -6.837 -3.152 6.632 1.00 0.00 H new ATOM 0 HB2 LYS A 61 -7.437 -0.729 6.451 1.00 0.00 H new ATOM 0 HB3 LYS A 61 -8.495 -1.105 5.106 1.00 0.00 H new ATOM 0 HG2 LYS A 61 -9.951 -2.429 6.521 1.00 0.00 H new ATOM 0 HG3 LYS A 61 -8.826 -2.337 7.862 1.00 0.00 H new ATOM 0 HD2 LYS A 61 -9.985 0.178 6.632 1.00 0.00 H new ATOM 0 HD3 LYS A 61 -10.880 -0.729 7.836 1.00 0.00 H new ATOM 0 HE2 LYS A 61 -9.111 -0.446 9.477 1.00 0.00 H new ATOM 0 HE3 LYS A 61 -8.027 0.228 8.277 1.00 0.00 H new ATOM 0 HZ1 LYS A 61 -9.010 1.955 9.637 1.00 0.00 H new ATOM 0 HZ2 LYS A 61 -9.524 2.123 8.028 1.00 0.00 H new ATOM 0 HZ3 LYS A 61 -10.575 1.470 9.191 1.00 0.00 H new ATOM 919 N VAL A 62 -9.021 -4.365 5.768 1.00 0.00 N ATOM 920 CA VAL A 62 -9.908 -5.390 5.230 1.00 0.00 C ATOM 921 C VAL A 62 -11.278 -4.810 4.896 1.00 0.00 C ATOM 922 O VAL A 62 -11.935 -4.212 5.747 1.00 0.00 O ATOM 923 CB VAL A 62 -10.084 -6.556 6.221 1.00 0.00 C ATOM 924 CG1 VAL A 62 -10.883 -7.682 5.583 1.00 0.00 C ATOM 925 CG2 VAL A 62 -8.730 -7.056 6.700 1.00 0.00 C ATOM 0 H VAL A 62 -9.185 -4.137 6.748 1.00 0.00 H new ATOM 0 HA VAL A 62 -9.443 -5.765 4.318 1.00 0.00 H new ATOM 0 HB VAL A 62 -10.639 -6.195 7.087 1.00 0.00 H new ATOM 0 HG11 VAL A 62 -10.997 -8.497 6.298 1.00 0.00 H new ATOM 0 HG12 VAL A 62 -11.867 -7.312 5.294 1.00 0.00 H new ATOM 0 HG13 VAL A 62 -10.358 -8.045 4.699 1.00 0.00 H new ATOM 0 HG21 VAL A 62 -8.873 -7.880 7.399 1.00 0.00 H new ATOM 0 HG22 VAL A 62 -8.147 -7.402 5.846 1.00 0.00 H new ATOM 0 HG23 VAL A 62 -8.198 -6.245 7.198 1.00 0.00 H new ATOM 935 N GLY A 63 -11.703 -4.991 3.649 1.00 0.00 N ATOM 936 CA GLY A 63 -12.993 -4.480 3.224 1.00 0.00 C ATOM 937 C GLY A 63 -14.140 -5.057 4.030 1.00 0.00 C ATOM 938 O GLY A 63 -15.118 -4.366 4.313 1.00 0.00 O ATOM 0 H GLY A 63 -11.177 -5.482 2.926 1.00 0.00 H new ATOM 0 HA2 GLY A 63 -12.998 -3.394 3.316 1.00 0.00 H new ATOM 0 HA3 GLY A 63 -13.142 -4.711 2.169 1.00 0.00 H new ATOM 942 N SER A 64 -14.020 -6.328 4.399 1.00 0.00 N ATOM 943 CA SER A 64 -15.058 -7.000 5.173 1.00 0.00 C ATOM 944 C SER A 64 -15.159 -6.408 6.575 1.00 0.00 C ATOM 945 O SER A 64 -16.104 -5.683 6.888 1.00 0.00 O ATOM 946 CB SER A 64 -14.768 -8.500 5.260 1.00 0.00 C ATOM 947 OG SER A 64 -15.846 -9.194 5.865 1.00 0.00 O ATOM 0 H SER A 64 -13.215 -6.913 4.175 1.00 0.00 H new ATOM 0 HA SER A 64 -16.010 -6.850 4.665 1.00 0.00 H new ATOM 0 HB2 SER A 64 -14.590 -8.898 4.261 1.00 0.00 H new ATOM 0 HB3 SER A 64 -13.857 -8.665 5.835 1.00 0.00 H new ATOM 0 HG SER A 64 -15.637 -10.150 5.907 1.00 0.00 H new ATOM 953 N SER A 65 -14.179 -6.722 7.416 1.00 0.00 N ATOM 954 CA SER A 65 -14.159 -6.225 8.787 1.00 0.00 C ATOM 955 C SER A 65 -13.685 -4.776 8.832 1.00 0.00 C ATOM 956 O SER A 65 -14.472 -3.860 9.067 1.00 0.00 O ATOM 957 CB SER A 65 -13.250 -7.098 9.655 1.00 0.00 C ATOM 958 OG SER A 65 -13.425 -6.806 11.030 1.00 0.00 O ATOM 0 H SER A 65 -13.388 -7.318 7.172 1.00 0.00 H new ATOM 0 HA SER A 65 -15.175 -6.269 9.179 1.00 0.00 H new ATOM 0 HB2 SER A 65 -13.469 -8.150 9.473 1.00 0.00 H new ATOM 0 HB3 SER A 65 -12.209 -6.936 9.375 1.00 0.00 H new ATOM 0 HG SER A 65 -12.550 -6.674 11.450 1.00 0.00 H new ATOM 964 N GLY A 66 -12.390 -4.576 8.605 1.00 0.00 N ATOM 965 CA GLY A 66 -11.832 -3.236 8.624 1.00 0.00 C ATOM 966 C GLY A 66 -10.603 -3.133 9.505 1.00 0.00 C ATOM 967 O GLY A 66 -10.445 -2.166 10.251 1.00 0.00 O ATOM 0 H GLY A 66 -11.718 -5.318 8.408 1.00 0.00 H new ATOM 0 HA2 GLY A 66 -11.573 -2.939 7.608 1.00 0.00 H new ATOM 0 HA3 GLY A 66 -12.589 -2.536 8.978 1.00 0.00 H new ATOM 971 N ASP A 67 -9.731 -4.131 9.421 1.00 0.00 N ATOM 972 CA ASP A 67 -8.510 -4.149 10.218 1.00 0.00 C ATOM 973 C ASP A 67 -7.277 -4.061 9.324 1.00 0.00 C ATOM 974 O ASP A 67 -7.233 -4.660 8.250 1.00 0.00 O ATOM 975 CB ASP A 67 -8.449 -5.419 11.068 1.00 0.00 C ATOM 976 CG ASP A 67 -9.811 -5.833 11.589 1.00 0.00 C ATOM 977 OD1 ASP A 67 -10.229 -5.308 12.642 1.00 0.00 O ATOM 978 OD2 ASP A 67 -10.459 -6.683 10.942 1.00 0.00 O ATOM 0 H ASP A 67 -9.847 -4.939 8.809 1.00 0.00 H new ATOM 0 HA ASP A 67 -8.522 -3.281 10.877 1.00 0.00 H new ATOM 0 HB2 ASP A 67 -8.029 -6.230 10.474 1.00 0.00 H new ATOM 0 HB3 ASP A 67 -7.775 -5.258 11.909 1.00 0.00 H new ATOM 983 N ILE A 68 -6.278 -3.309 9.775 1.00 0.00 N ATOM 984 CA ILE A 68 -5.045 -3.142 9.016 1.00 0.00 C ATOM 985 C ILE A 68 -4.060 -4.267 9.314 1.00 0.00 C ATOM 986 O ILE A 68 -3.674 -4.479 10.463 1.00 0.00 O ATOM 987 CB ILE A 68 -4.373 -1.791 9.324 1.00 0.00 C ATOM 988 CG1 ILE A 68 -5.355 -0.642 9.086 1.00 0.00 C ATOM 989 CG2 ILE A 68 -3.125 -1.614 8.472 1.00 0.00 C ATOM 990 CD1 ILE A 68 -4.897 0.675 9.673 1.00 0.00 C ATOM 0 H ILE A 68 -6.299 -2.806 10.662 1.00 0.00 H new ATOM 0 HA ILE A 68 -5.317 -3.171 7.961 1.00 0.00 H new ATOM 0 HB ILE A 68 -4.078 -1.780 10.373 1.00 0.00 H new ATOM 0 HG12 ILE A 68 -5.506 -0.520 8.013 1.00 0.00 H new ATOM 0 HG13 ILE A 68 -6.321 -0.906 9.516 1.00 0.00 H new ATOM 0 HG21 ILE A 68 -2.661 -0.655 8.701 1.00 0.00 H new ATOM 0 HG22 ILE A 68 -2.421 -2.418 8.687 1.00 0.00 H new ATOM 0 HG23 ILE A 68 -3.398 -1.643 7.417 1.00 0.00 H new ATOM 0 HD11 ILE A 68 -5.641 1.444 9.466 1.00 0.00 H new ATOM 0 HD12 ILE A 68 -4.774 0.570 10.751 1.00 0.00 H new ATOM 0 HD13 ILE A 68 -3.945 0.962 9.225 1.00 0.00 H new ATOM 1002 N ALA A 69 -3.655 -4.984 8.271 1.00 0.00 N ATOM 1003 CA ALA A 69 -2.712 -6.085 8.420 1.00 0.00 C ATOM 1004 C ALA A 69 -1.278 -5.612 8.206 1.00 0.00 C ATOM 1005 O ALA A 69 -0.343 -6.141 8.809 1.00 0.00 O ATOM 1006 CB ALA A 69 -3.051 -7.206 7.448 1.00 0.00 C ATOM 0 H ALA A 69 -3.966 -4.822 7.313 1.00 0.00 H new ATOM 0 HA ALA A 69 -2.793 -6.465 9.438 1.00 0.00 H new ATOM 0 HB1 ALA A 69 -2.338 -8.022 7.570 1.00 0.00 H new ATOM 0 HB2 ALA A 69 -4.058 -7.571 7.650 1.00 0.00 H new ATOM 0 HB3 ALA A 69 -3.000 -6.830 6.426 1.00 0.00 H new ATOM 1012 N LEU A 70 -1.112 -4.615 7.345 1.00 0.00 N ATOM 1013 CA LEU A 70 0.210 -4.070 7.051 1.00 0.00 C ATOM 1014 C LEU A 70 0.155 -2.552 6.916 1.00 0.00 C ATOM 1015 O LEU A 70 -0.692 -2.011 6.204 1.00 0.00 O ATOM 1016 CB LEU A 70 0.763 -4.689 5.766 1.00 0.00 C ATOM 1017 CG LEU A 70 2.040 -4.055 5.212 1.00 0.00 C ATOM 1018 CD1 LEU A 70 3.164 -4.140 6.233 1.00 0.00 C ATOM 1019 CD2 LEU A 70 2.448 -4.729 3.910 1.00 0.00 C ATOM 0 H LEU A 70 -1.875 -4.167 6.838 1.00 0.00 H new ATOM 0 HA LEU A 70 0.872 -4.318 7.881 1.00 0.00 H new ATOM 0 HB2 LEU A 70 0.956 -5.746 5.949 1.00 0.00 H new ATOM 0 HB3 LEU A 70 -0.009 -4.634 4.998 1.00 0.00 H new ATOM 0 HG LEU A 70 1.842 -3.003 5.007 1.00 0.00 H new ATOM 0 HD11 LEU A 70 4.065 -3.684 5.822 1.00 0.00 H new ATOM 0 HD12 LEU A 70 2.872 -3.612 7.141 1.00 0.00 H new ATOM 0 HD13 LEU A 70 3.362 -5.185 6.470 1.00 0.00 H new ATOM 0 HD21 LEU A 70 3.358 -4.265 3.530 1.00 0.00 H new ATOM 0 HD22 LEU A 70 2.628 -5.789 4.090 1.00 0.00 H new ATOM 0 HD23 LEU A 70 1.650 -4.616 3.176 1.00 0.00 H new ATOM 1031 N HIS A 71 1.066 -1.869 7.602 1.00 0.00 N ATOM 1032 CA HIS A 71 1.124 -0.412 7.557 1.00 0.00 C ATOM 1033 C HIS A 71 2.559 0.069 7.362 1.00 0.00 C ATOM 1034 O HIS A 71 3.298 0.253 8.329 1.00 0.00 O ATOM 1035 CB HIS A 71 0.544 0.182 8.840 1.00 0.00 C ATOM 1036 CG HIS A 71 0.951 1.604 9.079 1.00 0.00 C ATOM 1037 ND1 HIS A 71 1.204 2.496 8.058 1.00 0.00 N ATOM 1038 CD2 HIS A 71 1.146 2.287 10.231 1.00 0.00 C ATOM 1039 CE1 HIS A 71 1.539 3.666 8.572 1.00 0.00 C ATOM 1040 NE2 HIS A 71 1.511 3.566 9.889 1.00 0.00 N ATOM 0 H HIS A 71 1.774 -2.301 8.196 1.00 0.00 H new ATOM 0 HA HIS A 71 0.529 -0.075 6.708 1.00 0.00 H new ATOM 0 HB2 HIS A 71 -0.544 0.126 8.797 1.00 0.00 H new ATOM 0 HB3 HIS A 71 0.861 -0.425 9.688 1.00 0.00 H new ATOM 0 HD2 HIS A 71 1.035 1.899 11.233 1.00 0.00 H new ATOM 0 HE1 HIS A 71 1.793 4.553 8.011 1.00 0.00 H new ATOM 0 HE2 HIS A 71 1.726 4.317 10.545 1.00 0.00 H new ATOM 1049 N ILE A 72 2.945 0.269 6.107 1.00 0.00 N ATOM 1050 CA ILE A 72 4.291 0.729 5.787 1.00 0.00 C ATOM 1051 C ILE A 72 4.326 2.242 5.604 1.00 0.00 C ATOM 1052 O ILE A 72 3.513 2.809 4.875 1.00 0.00 O ATOM 1053 CB ILE A 72 4.826 0.056 4.508 1.00 0.00 C ATOM 1054 CG1 ILE A 72 4.755 -1.467 4.639 1.00 0.00 C ATOM 1055 CG2 ILE A 72 6.254 0.504 4.232 1.00 0.00 C ATOM 1056 CD1 ILE A 72 4.944 -2.195 3.327 1.00 0.00 C ATOM 0 H ILE A 72 2.346 0.120 5.295 1.00 0.00 H new ATOM 0 HA ILE A 72 4.927 0.452 6.628 1.00 0.00 H new ATOM 0 HB ILE A 72 4.202 0.359 3.667 1.00 0.00 H new ATOM 0 HG12 ILE A 72 5.518 -1.799 5.343 1.00 0.00 H new ATOM 0 HG13 ILE A 72 3.789 -1.743 5.062 1.00 0.00 H new ATOM 0 HG21 ILE A 72 6.618 0.020 3.326 1.00 0.00 H new ATOM 0 HG22 ILE A 72 6.277 1.586 4.100 1.00 0.00 H new ATOM 0 HG23 ILE A 72 6.891 0.227 5.072 1.00 0.00 H new ATOM 0 HD11 ILE A 72 4.882 -3.270 3.495 1.00 0.00 H new ATOM 0 HD12 ILE A 72 4.166 -1.891 2.627 1.00 0.00 H new ATOM 0 HD13 ILE A 72 5.921 -1.949 2.912 1.00 0.00 H new ATOM 1068 N ASN A 73 5.275 2.891 6.271 1.00 0.00 N ATOM 1069 CA ASN A 73 5.418 4.340 6.181 1.00 0.00 C ATOM 1070 C ASN A 73 6.887 4.736 6.066 1.00 0.00 C ATOM 1071 O ASN A 73 7.648 4.681 7.032 1.00 0.00 O ATOM 1072 CB ASN A 73 4.792 5.011 7.405 1.00 0.00 C ATOM 1073 CG ASN A 73 4.379 6.444 7.131 1.00 0.00 C ATOM 1074 OD1 ASN A 73 5.285 7.219 6.545 1.00 0.00 O flip ATOM 1075 ND2 ASN A 73 3.259 6.850 7.442 1.00 0.00 N flip ATOM 0 H ASN A 73 5.956 2.437 6.879 1.00 0.00 H new ATOM 0 HA ASN A 73 4.898 4.677 5.284 1.00 0.00 H new ATOM 0 HB2 ASN A 73 3.920 4.439 7.723 1.00 0.00 H new ATOM 0 HB3 ASN A 73 5.504 4.992 8.230 1.00 0.00 H new ATOM 0 HD21 ASN A 73 2.594 6.220 7.891 1.00 0.00 H new ATOM 0 HD22 ASN A 73 2.996 7.817 7.251 1.00 0.00 H new ATOM 1082 N PRO A 74 7.296 5.145 4.856 1.00 0.00 N ATOM 1083 CA PRO A 74 8.675 5.560 4.585 1.00 0.00 C ATOM 1084 C PRO A 74 9.027 6.882 5.259 1.00 0.00 C ATOM 1085 O PRO A 74 8.148 7.694 5.549 1.00 0.00 O ATOM 1086 CB PRO A 74 8.708 5.711 3.062 1.00 0.00 C ATOM 1087 CG PRO A 74 7.296 5.993 2.679 1.00 0.00 C ATOM 1088 CD PRO A 74 6.442 5.236 3.659 1.00 0.00 C ATOM 0 HA PRO A 74 9.399 4.843 4.972 1.00 0.00 H new ATOM 0 HB2 PRO A 74 9.370 6.522 2.759 1.00 0.00 H new ATOM 0 HB3 PRO A 74 9.075 4.804 2.582 1.00 0.00 H new ATOM 0 HG2 PRO A 74 7.086 7.062 2.722 1.00 0.00 H new ATOM 0 HG3 PRO A 74 7.097 5.670 1.657 1.00 0.00 H new ATOM 0 HD2 PRO A 74 5.510 5.761 3.869 1.00 0.00 H new ATOM 0 HD3 PRO A 74 6.174 4.250 3.280 1.00 0.00 H new ATOM 1096 N ARG A 75 10.316 7.090 5.506 1.00 0.00 N ATOM 1097 CA ARG A 75 10.782 8.314 6.147 1.00 0.00 C ATOM 1098 C ARG A 75 11.942 8.928 5.368 1.00 0.00 C ATOM 1099 O ARG A 75 13.096 8.538 5.544 1.00 0.00 O ATOM 1100 CB ARG A 75 11.216 8.028 7.586 1.00 0.00 C ATOM 1101 CG ARG A 75 10.054 7.779 8.534 1.00 0.00 C ATOM 1102 CD ARG A 75 10.540 7.385 9.920 1.00 0.00 C ATOM 1103 NE ARG A 75 11.263 8.471 10.576 1.00 0.00 N ATOM 1104 CZ ARG A 75 11.381 8.585 11.894 1.00 0.00 C ATOM 1105 NH1 ARG A 75 10.827 7.683 12.693 1.00 0.00 N ATOM 1106 NH2 ARG A 75 12.056 9.601 12.416 1.00 0.00 N ATOM 0 H ARG A 75 11.056 6.428 5.272 1.00 0.00 H new ATOM 0 HA ARG A 75 9.956 9.026 6.158 1.00 0.00 H new ATOM 0 HB2 ARG A 75 11.872 7.158 7.593 1.00 0.00 H new ATOM 0 HB3 ARG A 75 11.801 8.871 7.955 1.00 0.00 H new ATOM 0 HG2 ARG A 75 9.441 8.678 8.604 1.00 0.00 H new ATOM 0 HG3 ARG A 75 9.418 6.990 8.132 1.00 0.00 H new ATOM 0 HD2 ARG A 75 9.688 7.094 10.534 1.00 0.00 H new ATOM 0 HD3 ARG A 75 11.189 6.513 9.842 1.00 0.00 H new ATOM 0 HE ARG A 75 11.702 9.181 9.990 1.00 0.00 H new ATOM 0 HH11 ARG A 75 10.309 6.899 12.296 1.00 0.00 H new ATOM 0 HH12 ARG A 75 10.919 7.773 13.705 1.00 0.00 H new ATOM 0 HH21 ARG A 75 12.485 10.296 11.805 1.00 0.00 H new ATOM 0 HH22 ARG A 75 12.146 9.687 13.428 1.00 0.00 H new ATOM 1120 N MET A 76 11.626 9.889 4.507 1.00 0.00 N ATOM 1121 CA MET A 76 12.642 10.557 3.701 1.00 0.00 C ATOM 1122 C MET A 76 13.733 11.151 4.586 1.00 0.00 C ATOM 1123 O MET A 76 13.510 11.423 5.765 1.00 0.00 O ATOM 1124 CB MET A 76 12.005 11.657 2.849 1.00 0.00 C ATOM 1125 CG MET A 76 11.109 11.125 1.742 1.00 0.00 C ATOM 1126 SD MET A 76 9.446 10.739 2.320 1.00 0.00 S ATOM 1127 CE MET A 76 9.050 9.326 1.292 1.00 0.00 C ATOM 0 H MET A 76 10.675 10.223 4.349 1.00 0.00 H new ATOM 0 HA MET A 76 13.095 9.815 3.044 1.00 0.00 H new ATOM 0 HB2 MET A 76 11.421 12.313 3.494 1.00 0.00 H new ATOM 0 HB3 MET A 76 12.794 12.265 2.406 1.00 0.00 H new ATOM 0 HG2 MET A 76 11.049 11.863 0.942 1.00 0.00 H new ATOM 0 HG3 MET A 76 11.558 10.228 1.315 1.00 0.00 H new ATOM 0 HE1 MET A 76 8.086 8.916 1.592 1.00 0.00 H new ATOM 0 HE2 MET A 76 9.003 9.637 0.248 1.00 0.00 H new ATOM 0 HE3 MET A 76 9.820 8.564 1.409 1.00 0.00 H new ATOM 1137 N GLY A 77 14.914 11.351 4.008 1.00 0.00 N ATOM 1138 CA GLY A 77 16.022 11.911 4.760 1.00 0.00 C ATOM 1139 C GLY A 77 16.766 10.863 5.564 1.00 0.00 C ATOM 1140 O GLY A 77 17.824 10.392 5.152 1.00 0.00 O ATOM 0 H GLY A 77 15.123 11.135 3.033 1.00 0.00 H new ATOM 0 HA2 GLY A 77 16.715 12.397 4.073 1.00 0.00 H new ATOM 0 HA3 GLY A 77 15.647 12.682 5.433 1.00 0.00 H new ATOM 1144 N ASN A 78 16.211 10.500 6.716 1.00 0.00 N ATOM 1145 CA ASN A 78 16.830 9.503 7.581 1.00 0.00 C ATOM 1146 C ASN A 78 17.084 8.205 6.821 1.00 0.00 C ATOM 1147 O ASN A 78 18.231 7.820 6.595 1.00 0.00 O ATOM 1148 CB ASN A 78 15.941 9.229 8.796 1.00 0.00 C ATOM 1149 CG ASN A 78 16.733 8.746 9.995 1.00 0.00 C ATOM 1150 OD1 ASN A 78 17.507 9.499 10.587 1.00 0.00 O ATOM 1151 ND2 ASN A 78 16.544 7.483 10.359 1.00 0.00 N ATOM 0 H ASN A 78 15.334 10.881 7.072 1.00 0.00 H new ATOM 0 HA ASN A 78 17.787 9.898 7.921 1.00 0.00 H new ATOM 0 HB2 ASN A 78 15.403 10.139 9.062 1.00 0.00 H new ATOM 0 HB3 ASN A 78 15.192 8.482 8.534 1.00 0.00 H new ATOM 0 HD21 ASN A 78 17.050 7.101 11.158 1.00 0.00 H new ATOM 0 HD22 ASN A 78 15.893 6.895 9.840 1.00 0.00 H new ATOM 1158 N GLY A 79 16.005 7.534 6.428 1.00 0.00 N ATOM 1159 CA GLY A 79 16.133 6.287 5.697 1.00 0.00 C ATOM 1160 C GLY A 79 15.634 5.096 6.490 1.00 0.00 C ATOM 1161 O GLY A 79 16.274 4.044 6.515 1.00 0.00 O ATOM 0 H GLY A 79 15.045 7.832 6.603 1.00 0.00 H new ATOM 0 HA2 GLY A 79 15.575 6.358 4.764 1.00 0.00 H new ATOM 0 HA3 GLY A 79 17.179 6.131 5.432 1.00 0.00 H new ATOM 1165 N THR A 80 14.488 5.260 7.144 1.00 0.00 N ATOM 1166 CA THR A 80 13.905 4.191 7.945 1.00 0.00 C ATOM 1167 C THR A 80 12.405 4.077 7.700 1.00 0.00 C ATOM 1168 O THR A 80 11.648 5.008 7.976 1.00 0.00 O ATOM 1169 CB THR A 80 14.153 4.416 9.448 1.00 0.00 C ATOM 1170 OG1 THR A 80 13.965 5.798 9.774 1.00 0.00 O ATOM 1171 CG2 THR A 80 15.560 3.985 9.835 1.00 0.00 C ATOM 0 H THR A 80 13.945 6.124 7.134 1.00 0.00 H new ATOM 0 HA THR A 80 14.392 3.265 7.639 1.00 0.00 H new ATOM 0 HB THR A 80 13.439 3.811 10.006 1.00 0.00 H new ATOM 0 HG1 THR A 80 14.123 5.933 10.732 1.00 0.00 H new ATOM 0 HG21 THR A 80 15.712 4.153 10.901 1.00 0.00 H new ATOM 0 HG22 THR A 80 15.690 2.926 9.613 1.00 0.00 H new ATOM 0 HG23 THR A 80 16.287 4.567 9.269 1.00 0.00 H new ATOM 1179 N VAL A 81 11.980 2.929 7.182 1.00 0.00 N ATOM 1180 CA VAL A 81 10.569 2.692 6.903 1.00 0.00 C ATOM 1181 C VAL A 81 9.921 1.864 8.007 1.00 0.00 C ATOM 1182 O VAL A 81 10.181 0.668 8.136 1.00 0.00 O ATOM 1183 CB VAL A 81 10.377 1.970 5.556 1.00 0.00 C ATOM 1184 CG1 VAL A 81 8.904 1.921 5.181 1.00 0.00 C ATOM 1185 CG2 VAL A 81 11.191 2.651 4.466 1.00 0.00 C ATOM 0 H VAL A 81 12.593 2.148 6.947 1.00 0.00 H new ATOM 0 HA VAL A 81 10.088 3.669 6.856 1.00 0.00 H new ATOM 0 HB VAL A 81 10.735 0.946 5.659 1.00 0.00 H new ATOM 0 HG11 VAL A 81 8.788 1.407 4.227 1.00 0.00 H new ATOM 0 HG12 VAL A 81 8.350 1.384 5.951 1.00 0.00 H new ATOM 0 HG13 VAL A 81 8.516 2.936 5.096 1.00 0.00 H new ATOM 0 HG21 VAL A 81 11.044 2.128 3.521 1.00 0.00 H new ATOM 0 HG22 VAL A 81 10.866 3.686 4.362 1.00 0.00 H new ATOM 0 HG23 VAL A 81 12.248 2.628 4.733 1.00 0.00 H new ATOM 1195 N VAL A 82 9.074 2.510 8.803 1.00 0.00 N ATOM 1196 CA VAL A 82 8.387 1.833 9.897 1.00 0.00 C ATOM 1197 C VAL A 82 7.231 0.985 9.379 1.00 0.00 C ATOM 1198 O VAL A 82 6.540 1.370 8.435 1.00 0.00 O ATOM 1199 CB VAL A 82 7.847 2.841 10.929 1.00 0.00 C ATOM 1200 CG1 VAL A 82 7.202 2.114 12.099 1.00 0.00 C ATOM 1201 CG2 VAL A 82 8.962 3.758 11.411 1.00 0.00 C ATOM 0 H VAL A 82 8.847 3.500 8.711 1.00 0.00 H new ATOM 0 HA VAL A 82 9.120 1.187 10.380 1.00 0.00 H new ATOM 0 HB VAL A 82 7.085 3.454 10.448 1.00 0.00 H new ATOM 0 HG11 VAL A 82 6.826 2.842 12.818 1.00 0.00 H new ATOM 0 HG12 VAL A 82 6.376 1.503 11.737 1.00 0.00 H new ATOM 0 HG13 VAL A 82 7.941 1.475 12.583 1.00 0.00 H new ATOM 0 HG21 VAL A 82 8.563 4.464 12.140 1.00 0.00 H new ATOM 0 HG22 VAL A 82 9.748 3.162 11.875 1.00 0.00 H new ATOM 0 HG23 VAL A 82 9.375 4.306 10.564 1.00 0.00 H new ATOM 1211 N ARG A 83 7.026 -0.170 10.003 1.00 0.00 N ATOM 1212 CA ARG A 83 5.953 -1.073 9.604 1.00 0.00 C ATOM 1213 C ARG A 83 5.078 -1.439 10.799 1.00 0.00 C ATOM 1214 O ARG A 83 5.579 -1.838 11.849 1.00 0.00 O ATOM 1215 CB ARG A 83 6.533 -2.342 8.976 1.00 0.00 C ATOM 1216 CG ARG A 83 6.976 -2.161 7.534 1.00 0.00 C ATOM 1217 CD ARG A 83 8.437 -1.746 7.448 1.00 0.00 C ATOM 1218 NE ARG A 83 9.338 -2.841 7.798 1.00 0.00 N ATOM 1219 CZ ARG A 83 10.599 -2.915 7.386 1.00 0.00 C ATOM 1220 NH1 ARG A 83 11.105 -1.963 6.614 1.00 0.00 N ATOM 1221 NH2 ARG A 83 11.357 -3.942 7.747 1.00 0.00 N ATOM 0 H ARG A 83 7.588 -0.503 10.786 1.00 0.00 H new ATOM 0 HA ARG A 83 5.336 -0.560 8.867 1.00 0.00 H new ATOM 0 HB2 ARG A 83 7.385 -2.674 9.570 1.00 0.00 H new ATOM 0 HB3 ARG A 83 5.785 -3.134 9.021 1.00 0.00 H new ATOM 0 HG2 ARG A 83 6.828 -3.092 6.987 1.00 0.00 H new ATOM 0 HG3 ARG A 83 6.353 -1.407 7.053 1.00 0.00 H new ATOM 0 HD2 ARG A 83 8.658 -1.404 6.437 1.00 0.00 H new ATOM 0 HD3 ARG A 83 8.614 -0.903 8.116 1.00 0.00 H new ATOM 0 HE ARG A 83 8.980 -3.590 8.391 1.00 0.00 H new ATOM 0 HH11 ARG A 83 10.526 -1.171 6.335 1.00 0.00 H new ATOM 0 HH12 ARG A 83 12.073 -2.023 6.299 1.00 0.00 H new ATOM 0 HH21 ARG A 83 10.972 -4.676 8.341 1.00 0.00 H new ATOM 0 HH22 ARG A 83 12.325 -3.998 7.430 1.00 0.00 H new ATOM 1235 N ASN A 84 3.767 -1.298 10.631 1.00 0.00 N ATOM 1236 CA ASN A 84 2.821 -1.612 11.696 1.00 0.00 C ATOM 1237 C ASN A 84 1.579 -2.298 11.136 1.00 0.00 C ATOM 1238 O ASN A 84 1.467 -2.513 9.929 1.00 0.00 O ATOM 1239 CB ASN A 84 2.421 -0.338 12.443 1.00 0.00 C ATOM 1240 CG ASN A 84 3.530 0.697 12.456 1.00 0.00 C ATOM 1241 OD1 ASN A 84 3.835 1.308 11.432 1.00 0.00 O ATOM 1242 ND2 ASN A 84 4.138 0.897 13.619 1.00 0.00 N ATOM 0 H ASN A 84 3.336 -0.968 9.768 1.00 0.00 H new ATOM 0 HA ASN A 84 3.309 -2.295 12.391 1.00 0.00 H new ATOM 0 HB2 ASN A 84 1.534 0.090 11.977 1.00 0.00 H new ATOM 0 HB3 ASN A 84 2.152 -0.591 13.468 1.00 0.00 H new ATOM 0 HD21 ASN A 84 4.892 1.581 13.690 1.00 0.00 H new ATOM 0 HD22 ASN A 84 3.851 0.367 14.442 1.00 0.00 H new ATOM 1249 N SER A 85 0.648 -2.638 12.021 1.00 0.00 N ATOM 1250 CA SER A 85 -0.586 -3.302 11.616 1.00 0.00 C ATOM 1251 C SER A 85 -1.664 -3.144 12.683 1.00 0.00 C ATOM 1252 O SER A 85 -1.620 -3.795 13.728 1.00 0.00 O ATOM 1253 CB SER A 85 -0.327 -4.787 11.352 1.00 0.00 C ATOM 1254 OG SER A 85 -1.536 -5.474 11.081 1.00 0.00 O ATOM 0 H SER A 85 0.724 -2.465 13.023 1.00 0.00 H new ATOM 0 HA SER A 85 -0.938 -2.832 10.697 1.00 0.00 H new ATOM 0 HB2 SER A 85 0.354 -4.896 10.508 1.00 0.00 H new ATOM 0 HB3 SER A 85 0.163 -5.234 12.217 1.00 0.00 H new ATOM 0 HG SER A 85 -2.206 -4.839 10.752 1.00 0.00 H new ATOM 1260 N LEU A 86 -2.632 -2.274 12.414 1.00 0.00 N ATOM 1261 CA LEU A 86 -3.723 -2.029 13.350 1.00 0.00 C ATOM 1262 C LEU A 86 -4.744 -3.161 13.305 1.00 0.00 C ATOM 1263 O LEU A 86 -5.366 -3.410 12.271 1.00 0.00 O ATOM 1264 CB LEU A 86 -4.405 -0.698 13.031 1.00 0.00 C ATOM 1265 CG LEU A 86 -5.763 -0.463 13.695 1.00 0.00 C ATOM 1266 CD1 LEU A 86 -5.616 -0.413 15.207 1.00 0.00 C ATOM 1267 CD2 LEU A 86 -6.396 0.819 13.175 1.00 0.00 C ATOM 0 H LEU A 86 -2.683 -1.727 11.555 1.00 0.00 H new ATOM 0 HA LEU A 86 -3.304 -1.983 14.355 1.00 0.00 H new ATOM 0 HB2 LEU A 86 -3.735 0.110 13.324 1.00 0.00 H new ATOM 0 HB3 LEU A 86 -4.534 -0.629 11.951 1.00 0.00 H new ATOM 0 HG LEU A 86 -6.419 -1.296 13.442 1.00 0.00 H new ATOM 0 HD11 LEU A 86 -6.592 -0.245 15.662 1.00 0.00 H new ATOM 0 HD12 LEU A 86 -5.207 -1.358 15.564 1.00 0.00 H new ATOM 0 HD13 LEU A 86 -4.944 0.400 15.480 1.00 0.00 H new ATOM 0 HD21 LEU A 86 -7.361 0.970 13.658 1.00 0.00 H new ATOM 0 HD22 LEU A 86 -5.743 1.663 13.397 1.00 0.00 H new ATOM 0 HD23 LEU A 86 -6.538 0.743 12.097 1.00 0.00 H new ATOM 1279 N LEU A 87 -4.915 -3.842 14.432 1.00 0.00 N ATOM 1280 CA LEU A 87 -5.863 -4.947 14.523 1.00 0.00 C ATOM 1281 C LEU A 87 -7.199 -4.473 15.088 1.00 0.00 C ATOM 1282 O LEU A 87 -7.281 -3.413 15.706 1.00 0.00 O ATOM 1283 CB LEU A 87 -5.293 -6.064 15.399 1.00 0.00 C ATOM 1284 CG LEU A 87 -3.960 -6.660 14.944 1.00 0.00 C ATOM 1285 CD1 LEU A 87 -3.473 -7.699 15.941 1.00 0.00 C ATOM 1286 CD2 LEU A 87 -4.094 -7.270 13.557 1.00 0.00 C ATOM 0 H LEU A 87 -4.409 -3.649 15.296 1.00 0.00 H new ATOM 0 HA LEU A 87 -6.031 -5.333 13.517 1.00 0.00 H new ATOM 0 HB2 LEU A 87 -5.169 -5.678 16.411 1.00 0.00 H new ATOM 0 HB3 LEU A 87 -6.028 -6.867 15.453 1.00 0.00 H new ATOM 0 HG LEU A 87 -3.223 -5.859 14.896 1.00 0.00 H new ATOM 0 HD11 LEU A 87 -2.523 -8.112 15.601 1.00 0.00 H new ATOM 0 HD12 LEU A 87 -3.337 -7.232 16.916 1.00 0.00 H new ATOM 0 HD13 LEU A 87 -4.209 -8.499 16.022 1.00 0.00 H new ATOM 0 HD21 LEU A 87 -3.136 -7.689 13.250 1.00 0.00 H new ATOM 0 HD22 LEU A 87 -4.845 -8.059 13.578 1.00 0.00 H new ATOM 0 HD23 LEU A 87 -4.397 -6.499 12.848 1.00 0.00 H new ATOM 1298 N ASN A 88 -8.242 -5.269 14.872 1.00 0.00 N ATOM 1299 CA ASN A 88 -9.573 -4.931 15.361 1.00 0.00 C ATOM 1300 C ASN A 88 -9.499 -4.294 16.746 1.00 0.00 C ATOM 1301 O ASN A 88 -9.332 -4.984 17.750 1.00 0.00 O ATOM 1302 CB ASN A 88 -10.453 -6.182 15.410 1.00 0.00 C ATOM 1303 CG ASN A 88 -9.652 -7.443 15.670 1.00 0.00 C ATOM 1304 OD1 ASN A 88 -9.855 -8.467 15.017 1.00 0.00 O ATOM 1305 ND2 ASN A 88 -8.735 -7.374 16.629 1.00 0.00 N ATOM 0 H ASN A 88 -8.191 -6.151 14.362 1.00 0.00 H new ATOM 0 HA ASN A 88 -10.014 -4.210 14.672 1.00 0.00 H new ATOM 0 HB2 ASN A 88 -11.204 -6.064 16.191 1.00 0.00 H new ATOM 0 HB3 ASN A 88 -10.989 -6.283 14.466 1.00 0.00 H new ATOM 0 HD21 ASN A 88 -8.165 -8.191 16.849 1.00 0.00 H new ATOM 0 HD22 ASN A 88 -8.601 -6.504 17.145 1.00 0.00 H new ATOM 1312 N GLY A 89 -9.626 -2.971 16.789 1.00 0.00 N ATOM 1313 CA GLY A 89 -9.571 -2.262 18.055 1.00 0.00 C ATOM 1314 C GLY A 89 -8.218 -2.381 18.728 1.00 0.00 C ATOM 1315 O GLY A 89 -7.970 -1.749 19.754 1.00 0.00 O ATOM 0 H GLY A 89 -9.766 -2.378 15.971 1.00 0.00 H new ATOM 0 HA2 GLY A 89 -9.799 -1.209 17.888 1.00 0.00 H new ATOM 0 HA3 GLY A 89 -10.340 -2.653 18.721 1.00 0.00 H new ATOM 1319 N SER A 90 -7.341 -3.196 18.150 1.00 0.00 N ATOM 1320 CA SER A 90 -6.008 -3.401 18.704 1.00 0.00 C ATOM 1321 C SER A 90 -4.935 -2.954 17.716 1.00 0.00 C ATOM 1322 O SER A 90 -5.224 -2.677 16.552 1.00 0.00 O ATOM 1323 CB SER A 90 -5.803 -4.873 19.065 1.00 0.00 C ATOM 1324 OG SER A 90 -5.042 -5.006 20.253 1.00 0.00 O ATOM 0 H SER A 90 -7.530 -3.725 17.298 1.00 0.00 H new ATOM 0 HA SER A 90 -5.920 -2.797 19.607 1.00 0.00 H new ATOM 0 HB2 SER A 90 -6.771 -5.357 19.193 1.00 0.00 H new ATOM 0 HB3 SER A 90 -5.297 -5.384 18.246 1.00 0.00 H new ATOM 0 HG SER A 90 -4.927 -5.956 20.463 1.00 0.00 H new ATOM 1330 N TRP A 91 -3.696 -2.885 18.190 1.00 0.00 N ATOM 1331 CA TRP A 91 -2.578 -2.472 17.349 1.00 0.00 C ATOM 1332 C TRP A 91 -1.437 -3.481 17.425 1.00 0.00 C ATOM 1333 O TRP A 91 -1.367 -4.283 18.355 1.00 0.00 O ATOM 1334 CB TRP A 91 -2.081 -1.088 17.770 1.00 0.00 C ATOM 1335 CG TRP A 91 -2.674 0.027 16.963 1.00 0.00 C ATOM 1336 CD1 TRP A 91 -3.713 0.837 17.323 1.00 0.00 C ATOM 1337 CD2 TRP A 91 -2.264 0.453 15.659 1.00 0.00 C ATOM 1338 NE1 TRP A 91 -3.973 1.741 16.322 1.00 0.00 N ATOM 1339 CE2 TRP A 91 -3.098 1.527 15.290 1.00 0.00 C ATOM 1340 CE3 TRP A 91 -1.273 0.033 14.768 1.00 0.00 C ATOM 1341 CZ2 TRP A 91 -2.970 2.183 14.069 1.00 0.00 C ATOM 1342 CZ3 TRP A 91 -1.148 0.686 13.556 1.00 0.00 C ATOM 1343 CH2 TRP A 91 -1.991 1.751 13.216 1.00 0.00 C ATOM 0 H TRP A 91 -3.440 -3.110 19.152 1.00 0.00 H new ATOM 0 HA TRP A 91 -2.929 -2.426 16.318 1.00 0.00 H new ATOM 0 HB2 TRP A 91 -2.316 -0.930 18.823 1.00 0.00 H new ATOM 0 HB3 TRP A 91 -0.995 -1.056 17.678 1.00 0.00 H new ATOM 0 HD1 TRP A 91 -4.251 0.776 18.257 1.00 0.00 H new ATOM 0 HE1 TRP A 91 -4.700 2.456 16.344 1.00 0.00 H new ATOM 0 HE3 TRP A 91 -0.617 -0.787 15.021 1.00 0.00 H new ATOM 0 HZ2 TRP A 91 -3.620 3.004 13.804 1.00 0.00 H new ATOM 0 HZ3 TRP A 91 -0.386 0.369 12.859 1.00 0.00 H new ATOM 0 HH2 TRP A 91 -1.866 2.241 12.262 1.00 0.00 H new ATOM 1354 N GLY A 92 -0.544 -3.434 16.441 1.00 0.00 N ATOM 1355 CA GLY A 92 0.582 -4.349 16.416 1.00 0.00 C ATOM 1356 C GLY A 92 1.822 -3.759 17.057 1.00 0.00 C ATOM 1357 O GLY A 92 1.863 -3.551 18.270 1.00 0.00 O ATOM 0 H GLY A 92 -0.580 -2.778 15.661 1.00 0.00 H new ATOM 0 HA2 GLY A 92 0.311 -5.268 16.935 1.00 0.00 H new ATOM 0 HA3 GLY A 92 0.804 -4.619 15.384 1.00 0.00 H new ATOM 1361 N SER A 93 2.837 -3.491 16.242 1.00 0.00 N ATOM 1362 CA SER A 93 4.087 -2.927 16.738 1.00 0.00 C ATOM 1363 C SER A 93 4.849 -2.226 15.617 1.00 0.00 C ATOM 1364 O SER A 93 4.483 -2.327 14.446 1.00 0.00 O ATOM 1365 CB SER A 93 4.958 -4.024 17.353 1.00 0.00 C ATOM 1366 OG SER A 93 4.421 -4.469 18.586 1.00 0.00 O ATOM 0 H SER A 93 2.818 -3.655 15.235 1.00 0.00 H new ATOM 0 HA SER A 93 3.846 -2.192 17.506 1.00 0.00 H new ATOM 0 HB2 SER A 93 5.034 -4.863 16.662 1.00 0.00 H new ATOM 0 HB3 SER A 93 5.969 -3.646 17.508 1.00 0.00 H new ATOM 0 HG SER A 93 3.518 -4.105 18.700 1.00 0.00 H new ATOM 1372 N GLU A 94 5.910 -1.515 15.985 1.00 0.00 N ATOM 1373 CA GLU A 94 6.723 -0.797 15.011 1.00 0.00 C ATOM 1374 C GLU A 94 7.922 -1.636 14.578 1.00 0.00 C ATOM 1375 O GLU A 94 8.724 -2.065 15.407 1.00 0.00 O ATOM 1376 CB GLU A 94 7.203 0.533 15.596 1.00 0.00 C ATOM 1377 CG GLU A 94 6.118 1.302 16.331 1.00 0.00 C ATOM 1378 CD GLU A 94 6.362 2.798 16.333 1.00 0.00 C ATOM 1379 OE1 GLU A 94 6.460 3.385 15.235 1.00 0.00 O ATOM 1380 OE2 GLU A 94 6.456 3.383 17.432 1.00 0.00 O ATOM 0 H GLU A 94 6.226 -1.421 16.950 1.00 0.00 H new ATOM 0 HA GLU A 94 6.104 -0.599 14.136 1.00 0.00 H new ATOM 0 HB2 GLU A 94 8.029 0.342 16.281 1.00 0.00 H new ATOM 0 HB3 GLU A 94 7.595 1.154 14.791 1.00 0.00 H new ATOM 0 HG2 GLU A 94 5.154 1.096 15.867 1.00 0.00 H new ATOM 0 HG3 GLU A 94 6.059 0.946 17.360 1.00 0.00 H new ATOM 1387 N GLU A 95 8.035 -1.866 13.273 1.00 0.00 N ATOM 1388 CA GLU A 95 9.134 -2.655 12.730 1.00 0.00 C ATOM 1389 C GLU A 95 9.947 -1.839 11.729 1.00 0.00 C ATOM 1390 O GLU A 95 9.421 -1.369 10.721 1.00 0.00 O ATOM 1391 CB GLU A 95 8.599 -3.921 12.058 1.00 0.00 C ATOM 1392 CG GLU A 95 7.934 -4.889 13.022 1.00 0.00 C ATOM 1393 CD GLU A 95 7.995 -6.326 12.542 1.00 0.00 C ATOM 1394 OE1 GLU A 95 7.742 -6.561 11.342 1.00 0.00 O ATOM 1395 OE2 GLU A 95 8.295 -7.215 13.366 1.00 0.00 O ATOM 0 H GLU A 95 7.380 -1.517 12.574 1.00 0.00 H new ATOM 0 HA GLU A 95 9.786 -2.939 13.556 1.00 0.00 H new ATOM 0 HB2 GLU A 95 7.881 -3.638 11.288 1.00 0.00 H new ATOM 0 HB3 GLU A 95 9.421 -4.430 11.555 1.00 0.00 H new ATOM 0 HG2 GLU A 95 8.417 -4.815 13.996 1.00 0.00 H new ATOM 0 HG3 GLU A 95 6.892 -4.600 13.160 1.00 0.00 H new ATOM 1402 N LYS A 96 11.234 -1.675 12.016 1.00 0.00 N ATOM 1403 CA LYS A 96 12.122 -0.917 11.143 1.00 0.00 C ATOM 1404 C LYS A 96 13.312 -1.766 10.707 1.00 0.00 C ATOM 1405 O LYS A 96 14.090 -2.236 11.538 1.00 0.00 O ATOM 1406 CB LYS A 96 12.616 0.345 11.854 1.00 0.00 C ATOM 1407 CG LYS A 96 11.514 1.350 12.144 1.00 0.00 C ATOM 1408 CD LYS A 96 12.082 2.722 12.467 1.00 0.00 C ATOM 1409 CE LYS A 96 12.357 2.875 13.955 1.00 0.00 C ATOM 1410 NZ LYS A 96 13.413 1.935 14.423 1.00 0.00 N ATOM 0 H LYS A 96 11.685 -2.057 12.847 1.00 0.00 H new ATOM 0 HA LYS A 96 11.558 -0.629 10.255 1.00 0.00 H new ATOM 0 HB2 LYS A 96 13.093 0.061 12.792 1.00 0.00 H new ATOM 0 HB3 LYS A 96 13.380 0.823 11.240 1.00 0.00 H new ATOM 0 HG2 LYS A 96 10.851 1.423 11.282 1.00 0.00 H new ATOM 0 HG3 LYS A 96 10.911 0.999 12.981 1.00 0.00 H new ATOM 0 HD2 LYS A 96 13.005 2.876 11.908 1.00 0.00 H new ATOM 0 HD3 LYS A 96 11.381 3.492 12.144 1.00 0.00 H new ATOM 0 HE2 LYS A 96 12.664 3.900 14.164 1.00 0.00 H new ATOM 0 HE3 LYS A 96 11.439 2.697 14.514 1.00 0.00 H new ATOM 0 HZ1 LYS A 96 13.915 2.352 15.233 1.00 0.00 H new ATOM 0 HZ2 LYS A 96 12.975 1.037 14.712 1.00 0.00 H new ATOM 0 HZ3 LYS A 96 14.088 1.759 13.651 1.00 0.00 H new ATOM 1424 N LYS A 97 13.449 -1.958 9.400 1.00 0.00 N ATOM 1425 CA LYS A 97 14.546 -2.748 8.853 1.00 0.00 C ATOM 1426 C LYS A 97 14.602 -2.623 7.334 1.00 0.00 C ATOM 1427 O LYS A 97 13.736 -3.138 6.627 1.00 0.00 O ATOM 1428 CB LYS A 97 14.390 -4.218 9.249 1.00 0.00 C ATOM 1429 CG LYS A 97 15.616 -5.063 8.948 1.00 0.00 C ATOM 1430 CD LYS A 97 15.549 -5.667 7.555 1.00 0.00 C ATOM 1431 CE LYS A 97 16.879 -6.283 7.150 1.00 0.00 C ATOM 1432 NZ LYS A 97 16.990 -7.701 7.591 1.00 0.00 N ATOM 0 H LYS A 97 12.814 -1.577 8.699 1.00 0.00 H new ATOM 0 HA LYS A 97 15.479 -2.364 9.266 1.00 0.00 H new ATOM 0 HB2 LYS A 97 14.171 -4.277 10.315 1.00 0.00 H new ATOM 0 HB3 LYS A 97 13.532 -4.638 8.724 1.00 0.00 H new ATOM 0 HG2 LYS A 97 16.513 -4.449 9.037 1.00 0.00 H new ATOM 0 HG3 LYS A 97 15.700 -5.860 9.687 1.00 0.00 H new ATOM 0 HD2 LYS A 97 14.770 -6.429 7.525 1.00 0.00 H new ATOM 0 HD3 LYS A 97 15.270 -4.897 6.836 1.00 0.00 H new ATOM 0 HE2 LYS A 97 16.989 -6.230 6.067 1.00 0.00 H new ATOM 0 HE3 LYS A 97 17.695 -5.703 7.582 1.00 0.00 H new ATOM 0 HZ1 LYS A 97 17.910 -8.085 7.296 1.00 0.00 H new ATOM 0 HZ2 LYS A 97 16.910 -7.750 8.627 1.00 0.00 H new ATOM 0 HZ3 LYS A 97 16.227 -8.260 7.158 1.00 0.00 H new ATOM 1446 N ILE A 98 15.627 -1.936 6.839 1.00 0.00 N ATOM 1447 CA ILE A 98 15.796 -1.747 5.404 1.00 0.00 C ATOM 1448 C ILE A 98 17.272 -1.653 5.032 1.00 0.00 C ATOM 1449 O ILE A 98 18.107 -1.267 5.850 1.00 0.00 O ATOM 1450 CB ILE A 98 15.074 -0.477 4.914 1.00 0.00 C ATOM 1451 CG1 ILE A 98 15.564 -0.091 3.517 1.00 0.00 C ATOM 1452 CG2 ILE A 98 15.292 0.667 5.893 1.00 0.00 C ATOM 1453 CD1 ILE A 98 14.827 1.088 2.923 1.00 0.00 C ATOM 0 H ILE A 98 16.352 -1.502 7.410 1.00 0.00 H new ATOM 0 HA ILE A 98 15.355 -2.617 4.918 1.00 0.00 H new ATOM 0 HB ILE A 98 14.005 -0.683 4.859 1.00 0.00 H new ATOM 0 HG12 ILE A 98 16.628 0.143 3.566 1.00 0.00 H new ATOM 0 HG13 ILE A 98 15.456 -0.949 2.853 1.00 0.00 H new ATOM 0 HG21 ILE A 98 14.776 1.557 5.533 1.00 0.00 H new ATOM 0 HG22 ILE A 98 14.898 0.389 6.871 1.00 0.00 H new ATOM 0 HG23 ILE A 98 16.359 0.875 5.978 1.00 0.00 H new ATOM 0 HD11 ILE A 98 15.227 1.305 1.933 1.00 0.00 H new ATOM 0 HD12 ILE A 98 13.766 0.851 2.842 1.00 0.00 H new ATOM 0 HD13 ILE A 98 14.956 1.959 3.566 1.00 0.00 H new ATOM 1465 N THR A 99 17.588 -2.008 3.790 1.00 0.00 N ATOM 1466 CA THR A 99 18.962 -1.963 3.309 1.00 0.00 C ATOM 1467 C THR A 99 19.257 -0.642 2.608 1.00 0.00 C ATOM 1468 O THR A 99 20.330 -0.062 2.780 1.00 0.00 O ATOM 1469 CB THR A 99 19.255 -3.123 2.337 1.00 0.00 C ATOM 1470 OG1 THR A 99 20.632 -3.097 1.944 1.00 0.00 O ATOM 1471 CG2 THR A 99 18.369 -3.033 1.104 1.00 0.00 C ATOM 0 H THR A 99 16.910 -2.330 3.099 1.00 0.00 H new ATOM 0 HA THR A 99 19.606 -2.059 4.183 1.00 0.00 H new ATOM 0 HB THR A 99 19.042 -4.061 2.850 1.00 0.00 H new ATOM 0 HG1 THR A 99 20.810 -3.838 1.328 1.00 0.00 H new ATOM 0 HG21 THR A 99 18.594 -3.862 0.433 1.00 0.00 H new ATOM 0 HG22 THR A 99 17.322 -3.083 1.404 1.00 0.00 H new ATOM 0 HG23 THR A 99 18.555 -2.090 0.590 1.00 0.00 H new ATOM 1479 N HIS A 100 18.299 -0.170 1.817 1.00 0.00 N ATOM 1480 CA HIS A 100 18.456 1.085 1.091 1.00 0.00 C ATOM 1481 C HIS A 100 17.117 1.801 0.948 1.00 0.00 C ATOM 1482 O HIS A 100 16.132 1.214 0.502 1.00 0.00 O ATOM 1483 CB HIS A 100 19.060 0.828 -0.290 1.00 0.00 C ATOM 1484 CG HIS A 100 18.037 0.553 -1.349 1.00 0.00 C ATOM 1485 ND1 HIS A 100 17.072 -0.424 -1.228 1.00 0.00 N ATOM 1486 CD2 HIS A 100 17.832 1.135 -2.554 1.00 0.00 C ATOM 1487 CE1 HIS A 100 16.318 -0.433 -2.312 1.00 0.00 C ATOM 1488 NE2 HIS A 100 16.758 0.504 -3.133 1.00 0.00 N ATOM 0 H HIS A 100 17.406 -0.638 1.662 1.00 0.00 H new ATOM 0 HA HIS A 100 19.131 1.724 1.661 1.00 0.00 H new ATOM 0 HB2 HIS A 100 19.653 1.694 -0.585 1.00 0.00 H new ATOM 0 HB3 HIS A 100 19.743 -0.019 -0.227 1.00 0.00 H new ATOM 0 HD2 HIS A 100 18.406 1.944 -2.981 1.00 0.00 H new ATOM 0 HE1 HIS A 100 15.484 -1.094 -2.496 1.00 0.00 H new ATOM 0 HE2 HIS A 100 16.364 0.723 -4.048 1.00 0.00 H new ATOM 1497 N ASN A 101 17.087 3.074 1.330 1.00 0.00 N ATOM 1498 CA ASN A 101 15.868 3.870 1.246 1.00 0.00 C ATOM 1499 C ASN A 101 15.920 4.819 0.053 1.00 0.00 C ATOM 1500 O ASN A 101 16.471 5.918 0.125 1.00 0.00 O ATOM 1501 CB ASN A 101 15.663 4.666 2.537 1.00 0.00 C ATOM 1502 CG ASN A 101 14.521 5.657 2.429 1.00 0.00 C ATOM 1503 OD1 ASN A 101 14.504 6.507 1.538 1.00 0.00 O ATOM 1504 ND2 ASN A 101 13.560 5.553 3.339 1.00 0.00 N ATOM 0 H ASN A 101 17.894 3.576 1.701 1.00 0.00 H new ATOM 0 HA ASN A 101 15.028 3.189 1.110 1.00 0.00 H new ATOM 0 HB2 ASN A 101 15.466 3.977 3.358 1.00 0.00 H new ATOM 0 HB3 ASN A 101 16.582 5.199 2.782 1.00 0.00 H new ATOM 0 HD21 ASN A 101 12.766 6.193 3.318 1.00 0.00 H new ATOM 0 HD22 ASN A 101 13.616 4.833 4.059 1.00 0.00 H new ATOM 1511 N PRO A 102 15.332 4.388 -1.073 1.00 0.00 N ATOM 1512 CA PRO A 102 15.297 5.184 -2.303 1.00 0.00 C ATOM 1513 C PRO A 102 14.388 6.402 -2.179 1.00 0.00 C ATOM 1514 O PRO A 102 14.716 7.486 -2.661 1.00 0.00 O ATOM 1515 CB PRO A 102 14.743 4.207 -3.343 1.00 0.00 C ATOM 1516 CG PRO A 102 13.951 3.222 -2.553 1.00 0.00 C ATOM 1517 CD PRO A 102 14.656 3.089 -1.231 1.00 0.00 C ATOM 0 HA PRO A 102 16.278 5.586 -2.556 1.00 0.00 H new ATOM 0 HB2 PRO A 102 14.120 4.720 -4.075 1.00 0.00 H new ATOM 0 HB3 PRO A 102 15.546 3.718 -3.894 1.00 0.00 H new ATOM 0 HG2 PRO A 102 12.926 3.566 -2.416 1.00 0.00 H new ATOM 0 HG3 PRO A 102 13.899 2.262 -3.066 1.00 0.00 H new ATOM 0 HD2 PRO A 102 13.954 2.900 -0.419 1.00 0.00 H new ATOM 0 HD3 PRO A 102 15.368 2.264 -1.236 1.00 0.00 H new ATOM 1525 N PHE A 103 13.244 6.217 -1.529 1.00 0.00 N ATOM 1526 CA PHE A 103 12.286 7.301 -1.342 1.00 0.00 C ATOM 1527 C PHE A 103 13.005 8.635 -1.162 1.00 0.00 C ATOM 1528 O PHE A 103 13.676 8.861 -0.155 1.00 0.00 O ATOM 1529 CB PHE A 103 11.396 7.020 -0.130 1.00 0.00 C ATOM 1530 CG PHE A 103 10.909 5.601 -0.060 1.00 0.00 C ATOM 1531 CD1 PHE A 103 10.313 5.004 -1.159 1.00 0.00 C ATOM 1532 CD2 PHE A 103 11.047 4.864 1.105 1.00 0.00 C ATOM 1533 CE1 PHE A 103 9.864 3.699 -1.097 1.00 0.00 C ATOM 1534 CE2 PHE A 103 10.600 3.558 1.173 1.00 0.00 C ATOM 1535 CZ PHE A 103 10.008 2.974 0.070 1.00 0.00 C ATOM 0 H PHE A 103 12.957 5.326 -1.123 1.00 0.00 H new ATOM 0 HA PHE A 103 11.663 7.361 -2.234 1.00 0.00 H new ATOM 0 HB2 PHE A 103 11.951 7.251 0.779 1.00 0.00 H new ATOM 0 HB3 PHE A 103 10.536 7.690 -0.157 1.00 0.00 H new ATOM 0 HD1 PHE A 103 10.198 5.565 -2.075 1.00 0.00 H new ATOM 0 HD2 PHE A 103 11.509 5.315 1.970 1.00 0.00 H new ATOM 0 HE1 PHE A 103 9.400 3.246 -1.961 1.00 0.00 H new ATOM 0 HE2 PHE A 103 10.713 2.995 2.087 1.00 0.00 H new ATOM 0 HZ PHE A 103 9.659 1.953 0.120 1.00 0.00 H new ATOM 1545 N GLY A 104 12.858 9.518 -2.146 1.00 0.00 N ATOM 1546 CA GLY A 104 13.498 10.818 -2.077 1.00 0.00 C ATOM 1547 C GLY A 104 12.593 11.936 -2.555 1.00 0.00 C ATOM 1548 O GLY A 104 11.929 11.829 -3.586 1.00 0.00 O ATOM 0 H GLY A 104 12.307 9.356 -2.989 1.00 0.00 H new ATOM 0 HA2 GLY A 104 13.802 11.016 -1.049 1.00 0.00 H new ATOM 0 HA3 GLY A 104 14.405 10.805 -2.681 1.00 0.00 H new ATOM 1552 N PRO A 105 12.556 13.039 -1.793 1.00 0.00 N ATOM 1553 CA PRO A 105 11.727 14.203 -2.124 1.00 0.00 C ATOM 1554 C PRO A 105 12.239 14.949 -3.352 1.00 0.00 C ATOM 1555 O PRO A 105 13.159 15.760 -3.258 1.00 0.00 O ATOM 1556 CB PRO A 105 11.839 15.084 -0.878 1.00 0.00 C ATOM 1557 CG PRO A 105 13.138 14.700 -0.258 1.00 0.00 C ATOM 1558 CD PRO A 105 13.321 13.237 -0.550 1.00 0.00 C ATOM 0 HA PRO A 105 10.704 13.918 -2.371 1.00 0.00 H new ATOM 0 HB2 PRO A 105 11.822 16.142 -1.139 1.00 0.00 H new ATOM 0 HB3 PRO A 105 11.008 14.911 -0.195 1.00 0.00 H new ATOM 0 HG2 PRO A 105 13.957 15.286 -0.674 1.00 0.00 H new ATOM 0 HG3 PRO A 105 13.127 14.885 0.816 1.00 0.00 H new ATOM 0 HD2 PRO A 105 14.373 12.982 -0.680 1.00 0.00 H new ATOM 0 HD3 PRO A 105 12.940 12.615 0.260 1.00 0.00 H new ATOM 1566 N GLY A 106 11.636 14.668 -4.503 1.00 0.00 N ATOM 1567 CA GLY A 106 12.045 15.322 -5.733 1.00 0.00 C ATOM 1568 C GLY A 106 12.386 14.333 -6.830 1.00 0.00 C ATOM 1569 O GLY A 106 12.689 14.726 -7.955 1.00 0.00 O ATOM 0 H GLY A 106 10.872 14.000 -4.606 1.00 0.00 H new ATOM 0 HA2 GLY A 106 11.245 15.978 -6.075 1.00 0.00 H new ATOM 0 HA3 GLY A 106 12.911 15.953 -5.535 1.00 0.00 H new ATOM 1573 N GLN A 107 12.338 13.046 -6.500 1.00 0.00 N ATOM 1574 CA GLN A 107 12.647 11.998 -7.465 1.00 0.00 C ATOM 1575 C GLN A 107 11.585 10.903 -7.439 1.00 0.00 C ATOM 1576 O GLN A 107 10.979 10.637 -6.401 1.00 0.00 O ATOM 1577 CB GLN A 107 14.023 11.398 -7.176 1.00 0.00 C ATOM 1578 CG GLN A 107 14.206 10.965 -5.730 1.00 0.00 C ATOM 1579 CD GLN A 107 15.663 10.928 -5.311 1.00 0.00 C ATOM 1580 OE1 GLN A 107 16.365 11.937 -5.374 1.00 0.00 O ATOM 1581 NE2 GLN A 107 16.125 9.760 -4.882 1.00 0.00 N ATOM 0 H GLN A 107 12.088 12.705 -5.572 1.00 0.00 H new ATOM 0 HA GLN A 107 12.656 12.446 -8.459 1.00 0.00 H new ATOM 0 HB2 GLN A 107 14.179 10.538 -7.827 1.00 0.00 H new ATOM 0 HB3 GLN A 107 14.790 12.131 -7.427 1.00 0.00 H new ATOM 0 HG2 GLN A 107 13.662 11.649 -5.078 1.00 0.00 H new ATOM 0 HG3 GLN A 107 13.767 9.977 -5.592 1.00 0.00 H new ATOM 0 HE21 GLN A 107 15.507 8.949 -4.846 1.00 0.00 H new ATOM 0 HE22 GLN A 107 17.098 9.673 -4.588 1.00 0.00 H new ATOM 1590 N PHE A 108 11.366 10.271 -8.587 1.00 0.00 N ATOM 1591 CA PHE A 108 10.376 9.205 -8.695 1.00 0.00 C ATOM 1592 C PHE A 108 10.801 7.984 -7.885 1.00 0.00 C ATOM 1593 O PHE A 108 11.931 7.907 -7.403 1.00 0.00 O ATOM 1594 CB PHE A 108 10.176 8.814 -10.161 1.00 0.00 C ATOM 1595 CG PHE A 108 9.579 9.909 -10.998 1.00 0.00 C ATOM 1596 CD1 PHE A 108 10.373 10.928 -11.498 1.00 0.00 C ATOM 1597 CD2 PHE A 108 8.223 9.919 -11.283 1.00 0.00 C ATOM 1598 CE1 PHE A 108 9.826 11.937 -12.269 1.00 0.00 C ATOM 1599 CE2 PHE A 108 7.671 10.925 -12.053 1.00 0.00 C ATOM 1600 CZ PHE A 108 8.473 11.936 -12.546 1.00 0.00 C ATOM 0 H PHE A 108 11.860 10.478 -9.455 1.00 0.00 H new ATOM 0 HA PHE A 108 9.433 9.576 -8.292 1.00 0.00 H new ATOM 0 HB2 PHE A 108 11.137 8.526 -10.586 1.00 0.00 H new ATOM 0 HB3 PHE A 108 9.530 7.937 -10.210 1.00 0.00 H new ATOM 0 HD1 PHE A 108 11.431 10.934 -11.283 1.00 0.00 H new ATOM 0 HD2 PHE A 108 7.591 9.132 -10.899 1.00 0.00 H new ATOM 0 HE1 PHE A 108 10.456 12.725 -12.654 1.00 0.00 H new ATOM 0 HE2 PHE A 108 6.613 10.921 -12.269 1.00 0.00 H new ATOM 0 HZ PHE A 108 8.043 12.724 -13.147 1.00 0.00 H new ATOM 1610 N PHE A 109 9.886 7.031 -7.738 1.00 0.00 N ATOM 1611 CA PHE A 109 10.164 5.814 -6.984 1.00 0.00 C ATOM 1612 C PHE A 109 9.170 4.714 -7.343 1.00 0.00 C ATOM 1613 O PHE A 109 7.962 4.871 -7.164 1.00 0.00 O ATOM 1614 CB PHE A 109 10.110 6.096 -5.481 1.00 0.00 C ATOM 1615 CG PHE A 109 8.712 6.212 -4.943 1.00 0.00 C ATOM 1616 CD1 PHE A 109 8.017 5.085 -4.534 1.00 0.00 C ATOM 1617 CD2 PHE A 109 8.093 7.448 -4.846 1.00 0.00 C ATOM 1618 CE1 PHE A 109 6.731 5.189 -4.039 1.00 0.00 C ATOM 1619 CE2 PHE A 109 6.807 7.558 -4.351 1.00 0.00 C ATOM 1620 CZ PHE A 109 6.126 6.427 -3.946 1.00 0.00 C ATOM 0 H PHE A 109 8.946 7.078 -8.131 1.00 0.00 H new ATOM 0 HA PHE A 109 11.166 5.474 -7.246 1.00 0.00 H new ATOM 0 HB2 PHE A 109 10.630 5.298 -4.951 1.00 0.00 H new ATOM 0 HB3 PHE A 109 10.649 7.021 -5.273 1.00 0.00 H new ATOM 0 HD1 PHE A 109 8.486 4.114 -4.603 1.00 0.00 H new ATOM 0 HD2 PHE A 109 8.621 8.336 -5.161 1.00 0.00 H new ATOM 0 HE1 PHE A 109 6.199 4.303 -3.725 1.00 0.00 H new ATOM 0 HE2 PHE A 109 6.336 8.527 -4.281 1.00 0.00 H new ATOM 0 HZ PHE A 109 5.122 6.510 -3.557 1.00 0.00 H new ATOM 1630 N ASP A 110 9.687 3.600 -7.850 1.00 0.00 N ATOM 1631 CA ASP A 110 8.846 2.472 -8.234 1.00 0.00 C ATOM 1632 C ASP A 110 8.789 1.432 -7.120 1.00 0.00 C ATOM 1633 O ASP A 110 9.760 0.714 -6.877 1.00 0.00 O ATOM 1634 CB ASP A 110 9.370 1.832 -9.520 1.00 0.00 C ATOM 1635 CG ASP A 110 8.938 0.386 -9.665 1.00 0.00 C ATOM 1636 OD1 ASP A 110 7.741 0.100 -9.453 1.00 0.00 O ATOM 1637 OD2 ASP A 110 9.798 -0.460 -9.990 1.00 0.00 O ATOM 0 H ASP A 110 10.685 3.454 -8.005 1.00 0.00 H new ATOM 0 HA ASP A 110 7.837 2.846 -8.409 1.00 0.00 H new ATOM 0 HB2 ASP A 110 9.013 2.402 -10.378 1.00 0.00 H new ATOM 0 HB3 ASP A 110 10.459 1.886 -9.532 1.00 0.00 H new ATOM 1642 N LEU A 111 7.648 1.358 -6.444 1.00 0.00 N ATOM 1643 CA LEU A 111 7.465 0.407 -5.354 1.00 0.00 C ATOM 1644 C LEU A 111 6.506 -0.708 -5.759 1.00 0.00 C ATOM 1645 O LEU A 111 5.485 -0.460 -6.402 1.00 0.00 O ATOM 1646 CB LEU A 111 6.936 1.122 -4.109 1.00 0.00 C ATOM 1647 CG LEU A 111 7.248 0.456 -2.769 1.00 0.00 C ATOM 1648 CD1 LEU A 111 6.600 -0.918 -2.692 1.00 0.00 C ATOM 1649 CD2 LEU A 111 8.752 0.351 -2.563 1.00 0.00 C ATOM 0 H LEU A 111 6.836 1.945 -6.632 1.00 0.00 H new ATOM 0 HA LEU A 111 8.434 -0.037 -5.126 1.00 0.00 H new ATOM 0 HB2 LEU A 111 7.345 2.132 -4.094 1.00 0.00 H new ATOM 0 HB3 LEU A 111 5.854 1.217 -4.201 1.00 0.00 H new ATOM 0 HG LEU A 111 6.835 1.075 -1.972 1.00 0.00 H new ATOM 0 HD11 LEU A 111 6.833 -1.377 -1.731 1.00 0.00 H new ATOM 0 HD12 LEU A 111 5.519 -0.817 -2.793 1.00 0.00 H new ATOM 0 HD13 LEU A 111 6.983 -1.546 -3.496 1.00 0.00 H new ATOM 0 HD21 LEU A 111 8.956 -0.126 -1.604 1.00 0.00 H new ATOM 0 HD22 LEU A 111 9.188 -0.245 -3.364 1.00 0.00 H new ATOM 0 HD23 LEU A 111 9.191 1.349 -2.573 1.00 0.00 H new ATOM 1661 N SER A 112 6.839 -1.937 -5.378 1.00 0.00 N ATOM 1662 CA SER A 112 6.009 -3.090 -5.703 1.00 0.00 C ATOM 1663 C SER A 112 6.043 -4.119 -4.576 1.00 0.00 C ATOM 1664 O SER A 112 7.087 -4.703 -4.286 1.00 0.00 O ATOM 1665 CB SER A 112 6.479 -3.732 -7.009 1.00 0.00 C ATOM 1666 OG SER A 112 6.769 -2.747 -7.986 1.00 0.00 O ATOM 0 H SER A 112 7.679 -2.160 -4.843 1.00 0.00 H new ATOM 0 HA SER A 112 4.983 -2.744 -5.826 1.00 0.00 H new ATOM 0 HB2 SER A 112 7.367 -4.336 -6.822 1.00 0.00 H new ATOM 0 HB3 SER A 112 5.709 -4.406 -7.385 1.00 0.00 H new ATOM 0 HG SER A 112 7.069 -3.183 -8.811 1.00 0.00 H new ATOM 1672 N ILE A 113 4.893 -4.336 -3.947 1.00 0.00 N ATOM 1673 CA ILE A 113 4.790 -5.294 -2.853 1.00 0.00 C ATOM 1674 C ILE A 113 4.314 -6.653 -3.356 1.00 0.00 C ATOM 1675 O ILE A 113 3.420 -6.735 -4.199 1.00 0.00 O ATOM 1676 CB ILE A 113 3.827 -4.798 -1.758 1.00 0.00 C ATOM 1677 CG1 ILE A 113 4.174 -3.363 -1.356 1.00 0.00 C ATOM 1678 CG2 ILE A 113 3.879 -5.720 -0.550 1.00 0.00 C ATOM 1679 CD1 ILE A 113 3.429 -2.315 -2.152 1.00 0.00 C ATOM 0 H ILE A 113 4.020 -3.862 -4.176 1.00 0.00 H new ATOM 0 HA ILE A 113 5.788 -5.396 -2.428 1.00 0.00 H new ATOM 0 HB ILE A 113 2.812 -4.809 -2.155 1.00 0.00 H new ATOM 0 HG12 ILE A 113 3.954 -3.228 -0.297 1.00 0.00 H new ATOM 0 HG13 ILE A 113 5.246 -3.208 -1.481 1.00 0.00 H new ATOM 0 HG21 ILE A 113 3.193 -5.356 0.215 1.00 0.00 H new ATOM 0 HG22 ILE A 113 3.589 -6.727 -0.848 1.00 0.00 H new ATOM 0 HG23 ILE A 113 4.893 -5.738 -0.150 1.00 0.00 H new ATOM 0 HD11 ILE A 113 3.725 -1.322 -1.813 1.00 0.00 H new ATOM 0 HD12 ILE A 113 3.668 -2.423 -3.210 1.00 0.00 H new ATOM 0 HD13 ILE A 113 2.356 -2.443 -2.008 1.00 0.00 H new ATOM 1691 N ARG A 114 4.915 -7.715 -2.832 1.00 0.00 N ATOM 1692 CA ARG A 114 4.551 -9.071 -3.227 1.00 0.00 C ATOM 1693 C ARG A 114 3.902 -9.820 -2.066 1.00 0.00 C ATOM 1694 O ARG A 114 4.486 -9.942 -0.989 1.00 0.00 O ATOM 1695 CB ARG A 114 5.787 -9.832 -3.712 1.00 0.00 C ATOM 1696 CG ARG A 114 6.036 -9.700 -5.205 1.00 0.00 C ATOM 1697 CD ARG A 114 7.260 -10.492 -5.638 1.00 0.00 C ATOM 1698 NE ARG A 114 7.792 -10.024 -6.915 1.00 0.00 N ATOM 1699 CZ ARG A 114 7.283 -10.367 -8.093 1.00 0.00 C ATOM 1700 NH1 ARG A 114 6.235 -11.177 -8.156 1.00 0.00 N ATOM 1701 NH2 ARG A 114 7.823 -9.900 -9.211 1.00 0.00 N ATOM 0 H ARG A 114 5.656 -7.664 -2.133 1.00 0.00 H new ATOM 0 HA ARG A 114 3.830 -9.005 -4.042 1.00 0.00 H new ATOM 0 HB2 ARG A 114 6.662 -9.469 -3.173 1.00 0.00 H new ATOM 0 HB3 ARG A 114 5.675 -10.887 -3.463 1.00 0.00 H new ATOM 0 HG2 ARG A 114 5.162 -10.051 -5.753 1.00 0.00 H new ATOM 0 HG3 ARG A 114 6.172 -8.649 -5.461 1.00 0.00 H new ATOM 0 HD2 ARG A 114 8.032 -10.413 -4.873 1.00 0.00 H new ATOM 0 HD3 ARG A 114 6.999 -11.547 -5.719 1.00 0.00 H new ATOM 0 HE ARG A 114 8.598 -9.400 -6.902 1.00 0.00 H new ATOM 0 HH11 ARG A 114 5.818 -11.538 -7.298 1.00 0.00 H new ATOM 0 HH12 ARG A 114 5.846 -11.439 -9.062 1.00 0.00 H new ATOM 0 HH21 ARG A 114 8.630 -9.277 -9.166 1.00 0.00 H new ATOM 0 HH22 ARG A 114 7.432 -10.164 -10.115 1.00 0.00 H new ATOM 1715 N CYS A 115 2.692 -10.319 -2.294 1.00 0.00 N ATOM 1716 CA CYS A 115 1.963 -11.055 -1.267 1.00 0.00 C ATOM 1717 C CYS A 115 2.226 -12.553 -1.382 1.00 0.00 C ATOM 1718 O CYS A 115 1.898 -13.176 -2.391 1.00 0.00 O ATOM 1719 CB CYS A 115 0.463 -10.778 -1.381 1.00 0.00 C ATOM 1720 SG CYS A 115 -0.568 -11.881 -0.386 1.00 0.00 S ATOM 0 H CYS A 115 2.195 -10.227 -3.180 1.00 0.00 H new ATOM 0 HA CYS A 115 2.315 -10.717 -0.292 1.00 0.00 H new ATOM 0 HB2 CYS A 115 0.271 -9.748 -1.080 1.00 0.00 H new ATOM 0 HB3 CYS A 115 0.167 -10.865 -2.426 1.00 0.00 H new ATOM 0 HG CYS A 115 -0.450 -11.569 0.871 1.00 0.00 H new ATOM 1726 N GLY A 116 2.822 -13.125 -0.340 1.00 0.00 N ATOM 1727 CA GLY A 116 3.121 -14.545 -0.345 1.00 0.00 C ATOM 1728 C GLY A 116 2.340 -15.305 0.708 1.00 0.00 C ATOM 1729 O GLY A 116 1.173 -15.006 0.963 1.00 0.00 O ATOM 0 H GLY A 116 3.103 -12.631 0.507 1.00 0.00 H new ATOM 0 HA2 GLY A 116 2.895 -14.957 -1.328 1.00 0.00 H new ATOM 0 HA3 GLY A 116 4.188 -14.689 -0.176 1.00 0.00 H new ATOM 1733 N LEU A 117 2.983 -16.293 1.321 1.00 0.00 N ATOM 1734 CA LEU A 117 2.340 -17.101 2.352 1.00 0.00 C ATOM 1735 C LEU A 117 3.110 -17.019 3.666 1.00 0.00 C ATOM 1736 O LEU A 117 2.517 -17.019 4.745 1.00 0.00 O ATOM 1737 CB LEU A 117 2.239 -18.558 1.897 1.00 0.00 C ATOM 1738 CG LEU A 117 1.317 -18.827 0.707 1.00 0.00 C ATOM 1739 CD1 LEU A 117 1.740 -20.093 -0.021 1.00 0.00 C ATOM 1740 CD2 LEU A 117 -0.130 -18.933 1.167 1.00 0.00 C ATOM 0 H LEU A 117 3.949 -16.554 1.122 1.00 0.00 H new ATOM 0 HA LEU A 117 1.337 -16.707 2.515 1.00 0.00 H new ATOM 0 HB2 LEU A 117 3.239 -18.908 1.643 1.00 0.00 H new ATOM 0 HB3 LEU A 117 1.896 -19.158 2.740 1.00 0.00 H new ATOM 0 HG LEU A 117 1.397 -17.990 0.014 1.00 0.00 H new ATOM 0 HD11 LEU A 117 1.072 -20.268 -0.865 1.00 0.00 H new ATOM 0 HD12 LEU A 117 2.761 -19.980 -0.384 1.00 0.00 H new ATOM 0 HD13 LEU A 117 1.690 -20.940 0.663 1.00 0.00 H new ATOM 0 HD21 LEU A 117 -0.772 -19.125 0.307 1.00 0.00 H new ATOM 0 HD22 LEU A 117 -0.226 -19.751 1.881 1.00 0.00 H new ATOM 0 HD23 LEU A 117 -0.430 -17.999 1.643 1.00 0.00 H new ATOM 1752 N ASP A 118 4.433 -16.948 3.568 1.00 0.00 N ATOM 1753 CA ASP A 118 5.284 -16.862 4.749 1.00 0.00 C ATOM 1754 C ASP A 118 5.568 -15.407 5.109 1.00 0.00 C ATOM 1755 O ASP A 118 5.705 -15.063 6.283 1.00 0.00 O ATOM 1756 CB ASP A 118 6.598 -17.609 4.512 1.00 0.00 C ATOM 1757 CG ASP A 118 6.459 -19.104 4.717 1.00 0.00 C ATOM 1758 OD1 ASP A 118 5.453 -19.676 4.248 1.00 0.00 O ATOM 1759 OD2 ASP A 118 7.356 -19.703 5.348 1.00 0.00 O ATOM 0 H ASP A 118 4.939 -16.948 2.683 1.00 0.00 H new ATOM 0 HA ASP A 118 4.757 -17.327 5.582 1.00 0.00 H new ATOM 0 HB2 ASP A 118 6.945 -17.415 3.497 1.00 0.00 H new ATOM 0 HB3 ASP A 118 7.360 -17.222 5.189 1.00 0.00 H new ATOM 1764 N ARG A 119 5.658 -14.558 4.091 1.00 0.00 N ATOM 1765 CA ARG A 119 5.929 -13.141 4.300 1.00 0.00 C ATOM 1766 C ARG A 119 5.836 -12.370 2.986 1.00 0.00 C ATOM 1767 O ARG A 119 5.842 -12.960 1.906 1.00 0.00 O ATOM 1768 CB ARG A 119 7.316 -12.950 4.917 1.00 0.00 C ATOM 1769 CG ARG A 119 8.456 -13.279 3.967 1.00 0.00 C ATOM 1770 CD ARG A 119 9.766 -13.473 4.715 1.00 0.00 C ATOM 1771 NE ARG A 119 9.791 -14.729 5.458 1.00 0.00 N ATOM 1772 CZ ARG A 119 10.910 -15.344 5.825 1.00 0.00 C ATOM 1773 NH1 ARG A 119 12.089 -14.821 5.518 1.00 0.00 N ATOM 1774 NH2 ARG A 119 10.851 -16.485 6.500 1.00 0.00 N ATOM 0 H ARG A 119 5.547 -14.827 3.113 1.00 0.00 H new ATOM 0 HA ARG A 119 5.177 -12.751 4.985 1.00 0.00 H new ATOM 0 HB2 ARG A 119 7.418 -11.917 5.249 1.00 0.00 H new ATOM 0 HB3 ARG A 119 7.400 -13.579 5.803 1.00 0.00 H new ATOM 0 HG2 ARG A 119 8.217 -14.184 3.409 1.00 0.00 H new ATOM 0 HG3 ARG A 119 8.567 -12.476 3.238 1.00 0.00 H new ATOM 0 HD2 ARG A 119 10.594 -13.454 4.006 1.00 0.00 H new ATOM 0 HD3 ARG A 119 9.917 -12.642 5.403 1.00 0.00 H new ATOM 0 HE ARG A 119 8.900 -15.158 5.709 1.00 0.00 H new ATOM 0 HH11 ARG A 119 12.138 -13.944 4.999 1.00 0.00 H new ATOM 0 HH12 ARG A 119 12.947 -15.295 5.801 1.00 0.00 H new ATOM 0 HH21 ARG A 119 9.946 -16.891 6.738 1.00 0.00 H new ATOM 0 HH22 ARG A 119 11.711 -16.956 6.781 1.00 0.00 H new ATOM 1788 N PHE A 120 5.748 -11.047 3.087 1.00 0.00 N ATOM 1789 CA PHE A 120 5.652 -10.195 1.908 1.00 0.00 C ATOM 1790 C PHE A 120 7.037 -9.768 1.430 1.00 0.00 C ATOM 1791 O PHE A 120 7.997 -9.759 2.201 1.00 0.00 O ATOM 1792 CB PHE A 120 4.802 -8.960 2.213 1.00 0.00 C ATOM 1793 CG PHE A 120 3.338 -9.156 1.937 1.00 0.00 C ATOM 1794 CD1 PHE A 120 2.749 -10.399 2.105 1.00 0.00 C ATOM 1795 CD2 PHE A 120 2.552 -8.098 1.510 1.00 0.00 C ATOM 1796 CE1 PHE A 120 1.403 -10.582 1.851 1.00 0.00 C ATOM 1797 CE2 PHE A 120 1.206 -8.275 1.254 1.00 0.00 C ATOM 1798 CZ PHE A 120 0.630 -9.519 1.426 1.00 0.00 C ATOM 0 H PHE A 120 5.741 -10.542 3.973 1.00 0.00 H new ATOM 0 HA PHE A 120 5.175 -10.769 1.114 1.00 0.00 H new ATOM 0 HB2 PHE A 120 4.933 -8.689 3.261 1.00 0.00 H new ATOM 0 HB3 PHE A 120 5.167 -8.122 1.619 1.00 0.00 H new ATOM 0 HD1 PHE A 120 3.348 -11.234 2.438 1.00 0.00 H new ATOM 0 HD2 PHE A 120 2.997 -7.123 1.376 1.00 0.00 H new ATOM 0 HE1 PHE A 120 0.956 -11.556 1.985 1.00 0.00 H new ATOM 0 HE2 PHE A 120 0.605 -7.442 0.920 1.00 0.00 H new ATOM 0 HZ PHE A 120 -0.422 -9.660 1.229 1.00 0.00 H new ATOM 1808 N LYS A 121 7.133 -9.415 0.153 1.00 0.00 N ATOM 1809 CA LYS A 121 8.398 -8.986 -0.430 1.00 0.00 C ATOM 1810 C LYS A 121 8.237 -7.659 -1.165 1.00 0.00 C ATOM 1811 O LYS A 121 7.710 -7.614 -2.276 1.00 0.00 O ATOM 1812 CB LYS A 121 8.929 -10.052 -1.391 1.00 0.00 C ATOM 1813 CG LYS A 121 9.192 -11.393 -0.727 1.00 0.00 C ATOM 1814 CD LYS A 121 10.110 -12.262 -1.570 1.00 0.00 C ATOM 1815 CE LYS A 121 11.573 -11.923 -1.331 1.00 0.00 C ATOM 1816 NZ LYS A 121 12.061 -12.460 -0.031 1.00 0.00 N ATOM 0 H LYS A 121 6.348 -9.418 -0.499 1.00 0.00 H new ATOM 0 HA LYS A 121 9.113 -8.848 0.381 1.00 0.00 H new ATOM 0 HB2 LYS A 121 8.211 -10.191 -2.199 1.00 0.00 H new ATOM 0 HB3 LYS A 121 9.853 -9.693 -1.844 1.00 0.00 H new ATOM 0 HG2 LYS A 121 9.640 -11.233 0.254 1.00 0.00 H new ATOM 0 HG3 LYS A 121 8.247 -11.911 -0.565 1.00 0.00 H new ATOM 0 HD2 LYS A 121 9.936 -13.312 -1.335 1.00 0.00 H new ATOM 0 HD3 LYS A 121 9.872 -12.128 -2.625 1.00 0.00 H new ATOM 0 HE2 LYS A 121 12.177 -12.330 -2.142 1.00 0.00 H new ATOM 0 HE3 LYS A 121 11.703 -10.841 -1.349 1.00 0.00 H new ATOM 0 HZ1 LYS A 121 13.096 -12.374 0.013 1.00 0.00 H new ATOM 0 HZ2 LYS A 121 11.635 -11.921 0.749 1.00 0.00 H new ATOM 0 HZ3 LYS A 121 11.793 -13.461 0.054 1.00 0.00 H new ATOM 1830 N VAL A 122 8.696 -6.581 -0.537 1.00 0.00 N ATOM 1831 CA VAL A 122 8.604 -5.253 -1.133 1.00 0.00 C ATOM 1832 C VAL A 122 9.869 -4.912 -1.913 1.00 0.00 C ATOM 1833 O VAL A 122 10.980 -5.018 -1.391 1.00 0.00 O ATOM 1834 CB VAL A 122 8.368 -4.172 -0.061 1.00 0.00 C ATOM 1835 CG1 VAL A 122 8.191 -2.807 -0.709 1.00 0.00 C ATOM 1836 CG2 VAL A 122 7.161 -4.526 0.794 1.00 0.00 C ATOM 0 H VAL A 122 9.135 -6.601 0.384 1.00 0.00 H new ATOM 0 HA VAL A 122 7.754 -5.270 -1.815 1.00 0.00 H new ATOM 0 HB VAL A 122 9.244 -4.129 0.587 1.00 0.00 H new ATOM 0 HG11 VAL A 122 8.025 -2.056 0.064 1.00 0.00 H new ATOM 0 HG12 VAL A 122 9.088 -2.554 -1.275 1.00 0.00 H new ATOM 0 HG13 VAL A 122 7.333 -2.832 -1.381 1.00 0.00 H new ATOM 0 HG21 VAL A 122 7.008 -3.752 1.546 1.00 0.00 H new ATOM 0 HG22 VAL A 122 6.276 -4.597 0.162 1.00 0.00 H new ATOM 0 HG23 VAL A 122 7.333 -5.483 1.287 1.00 0.00 H new ATOM 1846 N TYR A 123 9.694 -4.503 -3.164 1.00 0.00 N ATOM 1847 CA TYR A 123 10.822 -4.149 -4.017 1.00 0.00 C ATOM 1848 C TYR A 123 10.750 -2.683 -4.433 1.00 0.00 C ATOM 1849 O TYR A 123 9.670 -2.097 -4.502 1.00 0.00 O ATOM 1850 CB TYR A 123 10.850 -5.042 -5.259 1.00 0.00 C ATOM 1851 CG TYR A 123 10.901 -6.519 -4.941 1.00 0.00 C ATOM 1852 CD1 TYR A 123 9.798 -7.175 -4.409 1.00 0.00 C ATOM 1853 CD2 TYR A 123 12.054 -7.260 -5.174 1.00 0.00 C ATOM 1854 CE1 TYR A 123 9.841 -8.524 -4.116 1.00 0.00 C ATOM 1855 CE2 TYR A 123 12.105 -8.610 -4.886 1.00 0.00 C ATOM 1856 CZ TYR A 123 10.997 -9.237 -4.357 1.00 0.00 C ATOM 1857 OH TYR A 123 11.043 -10.582 -4.068 1.00 0.00 O ATOM 0 H TYR A 123 8.782 -4.408 -3.610 1.00 0.00 H new ATOM 0 HA TYR A 123 11.738 -4.302 -3.447 1.00 0.00 H new ATOM 0 HB2 TYR A 123 9.965 -4.839 -5.862 1.00 0.00 H new ATOM 0 HB3 TYR A 123 11.717 -4.779 -5.866 1.00 0.00 H new ATOM 0 HD1 TYR A 123 8.891 -6.620 -4.221 1.00 0.00 H new ATOM 0 HD2 TYR A 123 12.924 -6.772 -5.587 1.00 0.00 H new ATOM 0 HE1 TYR A 123 8.975 -9.018 -3.701 1.00 0.00 H new ATOM 0 HE2 TYR A 123 13.008 -9.171 -5.074 1.00 0.00 H new ATOM 0 HH TYR A 123 11.928 -10.936 -4.297 1.00 0.00 H new ATOM 1867 N ALA A 124 11.910 -2.096 -4.711 1.00 0.00 N ATOM 1868 CA ALA A 124 11.980 -0.700 -5.123 1.00 0.00 C ATOM 1869 C ALA A 124 12.935 -0.521 -6.299 1.00 0.00 C ATOM 1870 O ALA A 124 14.148 -0.662 -6.152 1.00 0.00 O ATOM 1871 CB ALA A 124 12.410 0.175 -3.954 1.00 0.00 C ATOM 0 H ALA A 124 12.814 -2.566 -4.658 1.00 0.00 H new ATOM 0 HA ALA A 124 10.985 -0.393 -5.446 1.00 0.00 H new ATOM 0 HB1 ALA A 124 12.458 1.215 -4.276 1.00 0.00 H new ATOM 0 HB2 ALA A 124 11.688 0.079 -3.143 1.00 0.00 H new ATOM 0 HB3 ALA A 124 13.392 -0.142 -3.604 1.00 0.00 H new ATOM 1877 N ASN A 125 12.379 -0.212 -7.465 1.00 0.00 N ATOM 1878 CA ASN A 125 13.182 -0.016 -8.667 1.00 0.00 C ATOM 1879 C ASN A 125 14.015 -1.257 -8.972 1.00 0.00 C ATOM 1880 O ASN A 125 15.129 -1.158 -9.485 1.00 0.00 O ATOM 1881 CB ASN A 125 14.097 1.199 -8.502 1.00 0.00 C ATOM 1882 CG ASN A 125 13.448 2.305 -7.692 1.00 0.00 C ATOM 1883 OD1 ASN A 125 12.664 3.095 -8.217 1.00 0.00 O ATOM 1884 ND2 ASN A 125 13.774 2.366 -6.406 1.00 0.00 N ATOM 0 H ASN A 125 11.376 -0.092 -7.604 1.00 0.00 H new ATOM 0 HA ASN A 125 12.504 0.159 -9.502 1.00 0.00 H new ATOM 0 HB2 ASN A 125 15.022 0.890 -8.015 1.00 0.00 H new ATOM 0 HB3 ASN A 125 14.367 1.583 -9.486 1.00 0.00 H new ATOM 0 HD21 ASN A 125 13.370 3.089 -5.811 1.00 0.00 H new ATOM 0 HD22 ASN A 125 14.429 1.690 -6.013 1.00 0.00 H new ATOM 1891 N GLY A 126 13.466 -2.425 -8.654 1.00 0.00 N ATOM 1892 CA GLY A 126 14.173 -3.669 -8.902 1.00 0.00 C ATOM 1893 C GLY A 126 15.172 -3.996 -7.810 1.00 0.00 C ATOM 1894 O GLY A 126 16.189 -4.640 -8.064 1.00 0.00 O ATOM 0 H GLY A 126 12.545 -2.533 -8.229 1.00 0.00 H new ATOM 0 HA2 GLY A 126 13.452 -4.482 -8.986 1.00 0.00 H new ATOM 0 HA3 GLY A 126 14.693 -3.604 -9.858 1.00 0.00 H new ATOM 1898 N GLN A 127 14.882 -3.549 -6.592 1.00 0.00 N ATOM 1899 CA GLN A 127 15.765 -3.797 -5.458 1.00 0.00 C ATOM 1900 C GLN A 127 14.963 -4.165 -4.214 1.00 0.00 C ATOM 1901 O GLN A 127 14.114 -3.397 -3.760 1.00 0.00 O ATOM 1902 CB GLN A 127 16.627 -2.565 -5.178 1.00 0.00 C ATOM 1903 CG GLN A 127 17.429 -2.096 -6.382 1.00 0.00 C ATOM 1904 CD GLN A 127 18.728 -2.858 -6.550 1.00 0.00 C ATOM 1905 OE1 GLN A 127 19.097 -3.674 -5.704 1.00 0.00 O ATOM 1906 NE2 GLN A 127 19.430 -2.597 -7.646 1.00 0.00 N ATOM 0 H GLN A 127 14.044 -3.014 -6.365 1.00 0.00 H new ATOM 0 HA GLN A 127 16.414 -4.636 -5.711 1.00 0.00 H new ATOM 0 HB2 GLN A 127 15.985 -1.752 -4.841 1.00 0.00 H new ATOM 0 HB3 GLN A 127 17.312 -2.790 -4.361 1.00 0.00 H new ATOM 0 HG2 GLN A 127 16.826 -2.211 -7.283 1.00 0.00 H new ATOM 0 HG3 GLN A 127 17.647 -1.033 -6.277 1.00 0.00 H new ATOM 0 HE21 GLN A 127 19.087 -1.913 -8.321 1.00 0.00 H new ATOM 0 HE22 GLN A 127 20.313 -3.080 -7.813 1.00 0.00 H new ATOM 1915 N HIS A 128 15.237 -5.345 -3.667 1.00 0.00 N ATOM 1916 CA HIS A 128 14.542 -5.815 -2.474 1.00 0.00 C ATOM 1917 C HIS A 128 14.647 -4.793 -1.346 1.00 0.00 C ATOM 1918 O HIS A 128 15.723 -4.578 -0.787 1.00 0.00 O ATOM 1919 CB HIS A 128 15.116 -7.156 -2.018 1.00 0.00 C ATOM 1920 CG HIS A 128 14.532 -7.651 -0.731 1.00 0.00 C ATOM 1921 ND1 HIS A 128 15.278 -7.828 0.415 1.00 0.00 N ATOM 1922 CD2 HIS A 128 13.265 -8.006 -0.412 1.00 0.00 C ATOM 1923 CE1 HIS A 128 14.496 -8.272 1.383 1.00 0.00 C ATOM 1924 NE2 HIS A 128 13.269 -8.388 0.907 1.00 0.00 N ATOM 0 H HIS A 128 15.935 -5.993 -4.031 1.00 0.00 H new ATOM 0 HA HIS A 128 13.489 -5.946 -2.725 1.00 0.00 H new ATOM 0 HB2 HIS A 128 14.942 -7.900 -2.796 1.00 0.00 H new ATOM 0 HB3 HIS A 128 16.196 -7.060 -1.904 1.00 0.00 H new ATOM 0 HD2 HIS A 128 12.410 -7.991 -1.072 1.00 0.00 H new ATOM 0 HE1 HIS A 128 14.807 -8.501 2.392 1.00 0.00 H new ATOM 0 HE2 HIS A 128 12.457 -8.709 1.434 1.00 0.00 H new ATOM 1933 N LEU A 129 13.523 -4.165 -1.016 1.00 0.00 N ATOM 1934 CA LEU A 129 13.489 -3.165 0.045 1.00 0.00 C ATOM 1935 C LEU A 129 13.512 -3.828 1.419 1.00 0.00 C ATOM 1936 O LEU A 129 14.478 -3.690 2.170 1.00 0.00 O ATOM 1937 CB LEU A 129 12.240 -2.291 -0.091 1.00 0.00 C ATOM 1938 CG LEU A 129 12.379 -0.844 0.383 1.00 0.00 C ATOM 1939 CD1 LEU A 129 13.378 -0.092 -0.483 1.00 0.00 C ATOM 1940 CD2 LEU A 129 11.027 -0.147 0.370 1.00 0.00 C ATOM 0 H LEU A 129 12.624 -4.331 -1.468 1.00 0.00 H new ATOM 0 HA LEU A 129 14.376 -2.539 -0.051 1.00 0.00 H new ATOM 0 HB2 LEU A 129 11.940 -2.282 -1.139 1.00 0.00 H new ATOM 0 HB3 LEU A 129 11.430 -2.759 0.469 1.00 0.00 H new ATOM 0 HG LEU A 129 12.752 -0.851 1.407 1.00 0.00 H new ATOM 0 HD11 LEU A 129 13.464 0.936 -0.131 1.00 0.00 H new ATOM 0 HD12 LEU A 129 14.351 -0.579 -0.422 1.00 0.00 H new ATOM 0 HD13 LEU A 129 13.036 -0.093 -1.518 1.00 0.00 H new ATOM 0 HD21 LEU A 129 11.145 0.882 0.710 1.00 0.00 H new ATOM 0 HD22 LEU A 129 10.626 -0.150 -0.643 1.00 0.00 H new ATOM 0 HD23 LEU A 129 10.340 -0.672 1.034 1.00 0.00 H new ATOM 1952 N PHE A 130 12.443 -4.549 1.740 1.00 0.00 N ATOM 1953 CA PHE A 130 12.342 -5.235 3.023 1.00 0.00 C ATOM 1954 C PHE A 130 11.200 -6.248 3.010 1.00 0.00 C ATOM 1955 O PHE A 130 10.407 -6.292 2.069 1.00 0.00 O ATOM 1956 CB PHE A 130 12.128 -4.223 4.151 1.00 0.00 C ATOM 1957 CG PHE A 130 10.848 -3.447 4.025 1.00 0.00 C ATOM 1958 CD1 PHE A 130 9.623 -4.079 4.162 1.00 0.00 C ATOM 1959 CD2 PHE A 130 10.871 -2.086 3.768 1.00 0.00 C ATOM 1960 CE1 PHE A 130 8.443 -3.368 4.047 1.00 0.00 C ATOM 1961 CE2 PHE A 130 9.694 -1.369 3.653 1.00 0.00 C ATOM 1962 CZ PHE A 130 8.479 -2.011 3.791 1.00 0.00 C ATOM 0 H PHE A 130 11.635 -4.673 1.130 1.00 0.00 H new ATOM 0 HA PHE A 130 13.276 -5.769 3.196 1.00 0.00 H new ATOM 0 HB2 PHE A 130 12.132 -4.749 5.106 1.00 0.00 H new ATOM 0 HB3 PHE A 130 12.966 -3.526 4.167 1.00 0.00 H new ATOM 0 HD1 PHE A 130 9.589 -5.140 4.361 1.00 0.00 H new ATOM 0 HD2 PHE A 130 11.818 -1.579 3.656 1.00 0.00 H new ATOM 0 HE1 PHE A 130 7.495 -3.873 4.157 1.00 0.00 H new ATOM 0 HE2 PHE A 130 9.725 -0.308 3.455 1.00 0.00 H new ATOM 0 HZ PHE A 130 7.559 -1.453 3.699 1.00 0.00 H new ATOM 1972 N ASP A 131 11.125 -7.059 4.059 1.00 0.00 N ATOM 1973 CA ASP A 131 10.081 -8.071 4.169 1.00 0.00 C ATOM 1974 C ASP A 131 9.104 -7.725 5.288 1.00 0.00 C ATOM 1975 O ASP A 131 9.486 -7.137 6.300 1.00 0.00 O ATOM 1976 CB ASP A 131 10.700 -9.447 4.423 1.00 0.00 C ATOM 1977 CG ASP A 131 11.494 -9.495 5.714 1.00 0.00 C ATOM 1978 OD1 ASP A 131 10.869 -9.518 6.795 1.00 0.00 O ATOM 1979 OD2 ASP A 131 12.740 -9.511 5.643 1.00 0.00 O ATOM 0 H ASP A 131 11.774 -7.036 4.845 1.00 0.00 H new ATOM 0 HA ASP A 131 9.533 -8.096 3.227 1.00 0.00 H new ATOM 0 HB2 ASP A 131 9.910 -10.197 4.458 1.00 0.00 H new ATOM 0 HB3 ASP A 131 11.351 -9.709 3.589 1.00 0.00 H new ATOM 1984 N PHE A 132 7.841 -8.091 5.098 1.00 0.00 N ATOM 1985 CA PHE A 132 6.808 -7.817 6.090 1.00 0.00 C ATOM 1986 C PHE A 132 6.291 -9.113 6.709 1.00 0.00 C ATOM 1987 O PHE A 132 5.571 -9.876 6.066 1.00 0.00 O ATOM 1988 CB PHE A 132 5.651 -7.045 5.453 1.00 0.00 C ATOM 1989 CG PHE A 132 4.305 -7.417 6.008 1.00 0.00 C ATOM 1990 CD1 PHE A 132 4.103 -7.496 7.376 1.00 0.00 C ATOM 1991 CD2 PHE A 132 3.242 -7.686 5.161 1.00 0.00 C ATOM 1992 CE1 PHE A 132 2.866 -7.839 7.889 1.00 0.00 C ATOM 1993 CE2 PHE A 132 2.003 -8.028 5.668 1.00 0.00 C ATOM 1994 CZ PHE A 132 1.814 -8.104 7.034 1.00 0.00 C ATOM 0 H PHE A 132 7.508 -8.578 4.266 1.00 0.00 H new ATOM 0 HA PHE A 132 7.250 -7.209 6.880 1.00 0.00 H new ATOM 0 HB2 PHE A 132 5.813 -5.977 5.599 1.00 0.00 H new ATOM 0 HB3 PHE A 132 5.654 -7.224 4.378 1.00 0.00 H new ATOM 0 HD1 PHE A 132 4.921 -7.287 8.049 1.00 0.00 H new ATOM 0 HD2 PHE A 132 3.384 -7.628 4.092 1.00 0.00 H new ATOM 0 HE1 PHE A 132 2.722 -7.900 8.958 1.00 0.00 H new ATOM 0 HE2 PHE A 132 1.183 -8.236 4.997 1.00 0.00 H new ATOM 0 HZ PHE A 132 0.846 -8.370 7.433 1.00 0.00 H new ATOM 2004 N ALA A 133 6.664 -9.353 7.962 1.00 0.00 N ATOM 2005 CA ALA A 133 6.237 -10.554 8.669 1.00 0.00 C ATOM 2006 C ALA A 133 4.724 -10.572 8.858 1.00 0.00 C ATOM 2007 O ALA A 133 4.133 -9.589 9.306 1.00 0.00 O ATOM 2008 CB ALA A 133 6.940 -10.653 10.014 1.00 0.00 C ATOM 0 H ALA A 133 7.261 -8.732 8.508 1.00 0.00 H new ATOM 0 HA ALA A 133 6.511 -11.418 8.064 1.00 0.00 H new ATOM 0 HB1 ALA A 133 6.611 -11.555 10.531 1.00 0.00 H new ATOM 0 HB2 ALA A 133 8.018 -10.696 9.859 1.00 0.00 H new ATOM 0 HB3 ALA A 133 6.695 -9.779 10.618 1.00 0.00 H new ATOM 2014 N HIS A 134 4.102 -11.695 8.514 1.00 0.00 N ATOM 2015 CA HIS A 134 2.656 -11.840 8.646 1.00 0.00 C ATOM 2016 C HIS A 134 2.219 -11.627 10.092 1.00 0.00 C ATOM 2017 O HIS A 134 2.525 -12.436 10.969 1.00 0.00 O ATOM 2018 CB HIS A 134 2.215 -13.223 8.166 1.00 0.00 C ATOM 2019 CG HIS A 134 2.266 -13.384 6.678 1.00 0.00 C ATOM 2020 ND1 HIS A 134 2.710 -14.409 5.913 1.00 0.00 N flip ATOM 2021 CD2 HIS A 134 1.828 -12.416 5.800 1.00 0.00 C flip ATOM 2022 CE1 HIS A 134 2.532 -14.046 4.601 1.00 0.00 C flip ATOM 2023 NE2 HIS A 134 1.997 -12.839 4.560 1.00 0.00 N flip ATOM 0 H HIS A 134 4.576 -12.518 8.142 1.00 0.00 H new ATOM 0 HA HIS A 134 2.181 -11.080 8.026 1.00 0.00 H new ATOM 0 HB2 HIS A 134 2.851 -13.979 8.627 1.00 0.00 H new ATOM 0 HB3 HIS A 134 1.197 -13.410 8.509 1.00 0.00 H new ATOM 0 HD2 HIS A 134 1.411 -11.460 6.082 1.00 0.00 H new ATOM 0 HE1 HIS A 134 2.788 -14.649 3.742 1.00 0.00 H new ATOM 0 HE2 HIS A 134 1.755 -12.322 3.715 1.00 0.00 H new ATOM 2032 N ARG A 135 1.503 -10.534 10.334 1.00 0.00 N ATOM 2033 CA ARG A 135 1.025 -10.215 11.674 1.00 0.00 C ATOM 2034 C ARG A 135 -0.410 -10.695 11.869 1.00 0.00 C ATOM 2035 O ARG A 135 -0.747 -11.275 12.903 1.00 0.00 O ATOM 2036 CB ARG A 135 1.108 -8.707 11.922 1.00 0.00 C ATOM 2037 CG ARG A 135 2.506 -8.223 12.268 1.00 0.00 C ATOM 2038 CD ARG A 135 2.488 -6.794 12.788 1.00 0.00 C ATOM 2039 NE ARG A 135 3.730 -6.444 13.471 1.00 0.00 N ATOM 2040 CZ ARG A 135 4.104 -6.969 14.632 1.00 0.00 C ATOM 2041 NH1 ARG A 135 3.335 -7.864 15.237 1.00 0.00 N ATOM 2042 NH2 ARG A 135 5.249 -6.600 15.191 1.00 0.00 N ATOM 0 H ARG A 135 1.241 -9.854 9.620 1.00 0.00 H new ATOM 0 HA ARG A 135 1.662 -10.731 12.392 1.00 0.00 H new ATOM 0 HB2 ARG A 135 0.760 -8.181 11.033 1.00 0.00 H new ATOM 0 HB3 ARG A 135 0.430 -8.443 12.734 1.00 0.00 H new ATOM 0 HG2 ARG A 135 2.944 -8.879 13.020 1.00 0.00 H new ATOM 0 HG3 ARG A 135 3.142 -8.282 11.385 1.00 0.00 H new ATOM 0 HD2 ARG A 135 2.326 -6.108 11.957 1.00 0.00 H new ATOM 0 HD3 ARG A 135 1.650 -6.668 13.473 1.00 0.00 H new ATOM 0 HE ARG A 135 4.344 -5.758 13.032 1.00 0.00 H new ATOM 0 HH11 ARG A 135 2.454 -8.151 14.811 1.00 0.00 H new ATOM 0 HH12 ARG A 135 3.625 -8.266 16.129 1.00 0.00 H new ATOM 0 HH21 ARG A 135 5.844 -5.912 14.729 1.00 0.00 H new ATOM 0 HH22 ARG A 135 5.535 -7.004 16.083 1.00 0.00 H new ATOM 2056 N LEU A 136 -1.251 -10.451 10.870 1.00 0.00 N ATOM 2057 CA LEU A 136 -2.650 -10.858 10.932 1.00 0.00 C ATOM 2058 C LEU A 136 -2.881 -12.134 10.129 1.00 0.00 C ATOM 2059 O LEU A 136 -2.835 -12.123 8.899 1.00 0.00 O ATOM 2060 CB LEU A 136 -3.551 -9.740 10.404 1.00 0.00 C ATOM 2061 CG LEU A 136 -4.981 -10.143 10.046 1.00 0.00 C ATOM 2062 CD1 LEU A 136 -5.882 -10.057 11.268 1.00 0.00 C ATOM 2063 CD2 LEU A 136 -5.517 -9.266 8.923 1.00 0.00 C ATOM 0 H LEU A 136 -0.988 -9.974 10.008 1.00 0.00 H new ATOM 0 HA LEU A 136 -2.900 -11.056 11.974 1.00 0.00 H new ATOM 0 HB2 LEU A 136 -3.594 -8.951 11.155 1.00 0.00 H new ATOM 0 HB3 LEU A 136 -3.083 -9.312 9.518 1.00 0.00 H new ATOM 0 HG LEU A 136 -4.971 -11.177 9.700 1.00 0.00 H new ATOM 0 HD11 LEU A 136 -6.896 -10.348 10.994 1.00 0.00 H new ATOM 0 HD12 LEU A 136 -5.510 -10.727 12.043 1.00 0.00 H new ATOM 0 HD13 LEU A 136 -5.887 -9.034 11.645 1.00 0.00 H new ATOM 0 HD21 LEU A 136 -6.536 -9.567 8.681 1.00 0.00 H new ATOM 0 HD22 LEU A 136 -5.512 -8.224 9.242 1.00 0.00 H new ATOM 0 HD23 LEU A 136 -4.886 -9.378 8.041 1.00 0.00 H new ATOM 2075 N SER A 137 -3.133 -13.233 10.833 1.00 0.00 N ATOM 2076 CA SER A 137 -3.370 -14.518 10.186 1.00 0.00 C ATOM 2077 C SER A 137 -4.404 -14.383 9.072 1.00 0.00 C ATOM 2078 O SER A 137 -4.322 -15.061 8.049 1.00 0.00 O ATOM 2079 CB SER A 137 -3.842 -15.550 11.212 1.00 0.00 C ATOM 2080 OG SER A 137 -5.101 -15.191 11.755 1.00 0.00 O ATOM 0 H SER A 137 -3.178 -13.259 11.852 1.00 0.00 H new ATOM 0 HA SER A 137 -2.431 -14.855 9.748 1.00 0.00 H new ATOM 0 HB2 SER A 137 -3.912 -16.530 10.741 1.00 0.00 H new ATOM 0 HB3 SER A 137 -3.107 -15.633 12.013 1.00 0.00 H new ATOM 0 HG SER A 137 -5.381 -15.867 12.407 1.00 0.00 H new ATOM 2086 N ALA A 138 -5.376 -13.501 9.279 1.00 0.00 N ATOM 2087 CA ALA A 138 -6.425 -13.274 8.293 1.00 0.00 C ATOM 2088 C ALA A 138 -5.965 -12.295 7.218 1.00 0.00 C ATOM 2089 O ALA A 138 -6.767 -11.540 6.667 1.00 0.00 O ATOM 2090 CB ALA A 138 -7.686 -12.761 8.972 1.00 0.00 C ATOM 0 H ALA A 138 -5.459 -12.932 10.121 1.00 0.00 H new ATOM 0 HA ALA A 138 -6.647 -14.226 7.810 1.00 0.00 H new ATOM 0 HB1 ALA A 138 -8.461 -12.596 8.223 1.00 0.00 H new ATOM 0 HB2 ALA A 138 -8.033 -13.496 9.698 1.00 0.00 H new ATOM 0 HB3 ALA A 138 -7.469 -11.823 9.482 1.00 0.00 H new ATOM 2096 N PHE A 139 -4.669 -12.311 6.924 1.00 0.00 N ATOM 2097 CA PHE A 139 -4.102 -11.423 5.916 1.00 0.00 C ATOM 2098 C PHE A 139 -4.898 -11.498 4.617 1.00 0.00 C ATOM 2099 O PHE A 139 -5.131 -10.482 3.961 1.00 0.00 O ATOM 2100 CB PHE A 139 -2.639 -11.785 5.653 1.00 0.00 C ATOM 2101 CG PHE A 139 -2.468 -12.953 4.724 1.00 0.00 C ATOM 2102 CD1 PHE A 139 -2.893 -14.218 5.095 1.00 0.00 C ATOM 2103 CD2 PHE A 139 -1.881 -12.785 3.480 1.00 0.00 C ATOM 2104 CE1 PHE A 139 -2.737 -15.295 4.242 1.00 0.00 C ATOM 2105 CE2 PHE A 139 -1.723 -13.858 2.623 1.00 0.00 C ATOM 2106 CZ PHE A 139 -2.151 -15.115 3.005 1.00 0.00 C ATOM 0 H PHE A 139 -3.991 -12.930 7.370 1.00 0.00 H new ATOM 0 HA PHE A 139 -4.154 -10.402 6.295 1.00 0.00 H new ATOM 0 HB2 PHE A 139 -2.129 -10.919 5.232 1.00 0.00 H new ATOM 0 HB3 PHE A 139 -2.153 -12.012 6.602 1.00 0.00 H new ATOM 0 HD1 PHE A 139 -3.352 -14.365 6.062 1.00 0.00 H new ATOM 0 HD2 PHE A 139 -1.543 -11.805 3.177 1.00 0.00 H new ATOM 0 HE1 PHE A 139 -3.073 -16.276 4.543 1.00 0.00 H new ATOM 0 HE2 PHE A 139 -1.265 -13.714 1.655 1.00 0.00 H new ATOM 0 HZ PHE A 139 -2.027 -15.955 2.337 1.00 0.00 H new ATOM 2116 N GLN A 140 -5.311 -12.707 4.251 1.00 0.00 N ATOM 2117 CA GLN A 140 -6.079 -12.914 3.029 1.00 0.00 C ATOM 2118 C GLN A 140 -7.295 -11.994 2.988 1.00 0.00 C ATOM 2119 O GLN A 140 -7.603 -11.402 1.954 1.00 0.00 O ATOM 2120 CB GLN A 140 -6.526 -14.373 2.924 1.00 0.00 C ATOM 2121 CG GLN A 140 -7.299 -14.862 4.138 1.00 0.00 C ATOM 2122 CD GLN A 140 -7.243 -16.369 4.297 1.00 0.00 C ATOM 2123 OE1 GLN A 140 -7.569 -17.115 3.372 1.00 0.00 O ATOM 2124 NE2 GLN A 140 -6.829 -16.825 5.473 1.00 0.00 N ATOM 0 H GLN A 140 -5.127 -13.558 4.783 1.00 0.00 H new ATOM 0 HA GLN A 140 -5.437 -12.676 2.181 1.00 0.00 H new ATOM 0 HB2 GLN A 140 -7.148 -14.491 2.036 1.00 0.00 H new ATOM 0 HB3 GLN A 140 -5.648 -15.004 2.784 1.00 0.00 H new ATOM 0 HG2 GLN A 140 -6.896 -14.391 5.035 1.00 0.00 H new ATOM 0 HG3 GLN A 140 -8.339 -14.548 4.052 1.00 0.00 H new ATOM 0 HE21 GLN A 140 -6.569 -16.171 6.211 1.00 0.00 H new ATOM 0 HE22 GLN A 140 -6.771 -17.830 5.639 1.00 0.00 H new ATOM 2133 N ARG A 141 -7.983 -11.879 4.120 1.00 0.00 N ATOM 2134 CA ARG A 141 -9.166 -11.032 4.212 1.00 0.00 C ATOM 2135 C ARG A 141 -8.874 -9.631 3.683 1.00 0.00 C ATOM 2136 O ARG A 141 -9.684 -9.048 2.961 1.00 0.00 O ATOM 2137 CB ARG A 141 -9.649 -10.951 5.661 1.00 0.00 C ATOM 2138 CG ARG A 141 -9.997 -12.302 6.264 1.00 0.00 C ATOM 2139 CD ARG A 141 -10.690 -12.150 7.609 1.00 0.00 C ATOM 2140 NE ARG A 141 -12.097 -11.788 7.462 1.00 0.00 N ATOM 2141 CZ ARG A 141 -13.059 -12.667 7.205 1.00 0.00 C ATOM 2142 NH1 ARG A 141 -12.768 -13.953 7.067 1.00 0.00 N ATOM 2143 NH2 ARG A 141 -14.317 -12.260 7.085 1.00 0.00 N ATOM 0 H ARG A 141 -7.741 -12.362 4.985 1.00 0.00 H new ATOM 0 HA ARG A 141 -9.950 -11.477 3.599 1.00 0.00 H new ATOM 0 HB2 ARG A 141 -8.875 -10.481 6.267 1.00 0.00 H new ATOM 0 HB3 ARG A 141 -10.526 -10.305 5.707 1.00 0.00 H new ATOM 0 HG2 ARG A 141 -10.644 -12.851 5.580 1.00 0.00 H new ATOM 0 HG3 ARG A 141 -9.089 -12.892 6.386 1.00 0.00 H new ATOM 0 HD2 ARG A 141 -10.612 -13.085 8.164 1.00 0.00 H new ATOM 0 HD3 ARG A 141 -10.179 -11.387 8.196 1.00 0.00 H new ATOM 0 HE ARG A 141 -12.355 -10.806 7.562 1.00 0.00 H new ATOM 0 HH11 ARG A 141 -11.803 -14.270 7.158 1.00 0.00 H new ATOM 0 HH12 ARG A 141 -13.509 -14.625 6.870 1.00 0.00 H new ATOM 0 HH21 ARG A 141 -14.545 -11.271 7.190 1.00 0.00 H new ATOM 0 HH22 ARG A 141 -15.055 -12.936 6.888 1.00 0.00 H new ATOM 2157 N VAL A 142 -7.713 -9.096 4.046 1.00 0.00 N ATOM 2158 CA VAL A 142 -7.314 -7.764 3.607 1.00 0.00 C ATOM 2159 C VAL A 142 -7.603 -7.565 2.123 1.00 0.00 C ATOM 2160 O VAL A 142 -6.904 -8.106 1.266 1.00 0.00 O ATOM 2161 CB VAL A 142 -5.816 -7.513 3.865 1.00 0.00 C ATOM 2162 CG1 VAL A 142 -5.399 -6.158 3.316 1.00 0.00 C ATOM 2163 CG2 VAL A 142 -5.508 -7.613 5.352 1.00 0.00 C ATOM 0 H VAL A 142 -7.032 -9.565 4.643 1.00 0.00 H new ATOM 0 HA VAL A 142 -7.900 -7.051 4.187 1.00 0.00 H new ATOM 0 HB VAL A 142 -5.242 -8.280 3.346 1.00 0.00 H new ATOM 0 HG11 VAL A 142 -4.338 -5.999 3.508 1.00 0.00 H new ATOM 0 HG12 VAL A 142 -5.582 -6.129 2.242 1.00 0.00 H new ATOM 0 HG13 VAL A 142 -5.978 -5.374 3.804 1.00 0.00 H new ATOM 0 HG21 VAL A 142 -4.446 -7.433 5.516 1.00 0.00 H new ATOM 0 HG22 VAL A 142 -6.090 -6.869 5.895 1.00 0.00 H new ATOM 0 HG23 VAL A 142 -5.767 -8.609 5.711 1.00 0.00 H new ATOM 2173 N ASP A 143 -8.636 -6.784 1.827 1.00 0.00 N ATOM 2174 CA ASP A 143 -9.017 -6.512 0.447 1.00 0.00 C ATOM 2175 C ASP A 143 -9.198 -5.014 0.219 1.00 0.00 C ATOM 2176 O ASP A 143 -9.990 -4.594 -0.626 1.00 0.00 O ATOM 2177 CB ASP A 143 -10.308 -7.253 0.096 1.00 0.00 C ATOM 2178 CG ASP A 143 -11.507 -6.717 0.854 1.00 0.00 C ATOM 2179 OD1 ASP A 143 -12.094 -5.712 0.402 1.00 0.00 O ATOM 2180 OD2 ASP A 143 -11.859 -7.304 1.899 1.00 0.00 O ATOM 0 H ASP A 143 -9.224 -6.328 2.525 1.00 0.00 H new ATOM 0 HA ASP A 143 -8.216 -6.867 -0.202 1.00 0.00 H new ATOM 0 HB2 ASP A 143 -10.492 -7.169 -0.975 1.00 0.00 H new ATOM 0 HB3 ASP A 143 -10.186 -8.313 0.317 1.00 0.00 H new ATOM 2185 N THR A 144 -8.458 -4.211 0.978 1.00 0.00 N ATOM 2186 CA THR A 144 -8.538 -2.761 0.861 1.00 0.00 C ATOM 2187 C THR A 144 -7.157 -2.124 0.969 1.00 0.00 C ATOM 2188 O THR A 144 -6.528 -2.157 2.027 1.00 0.00 O ATOM 2189 CB THR A 144 -9.454 -2.159 1.943 1.00 0.00 C ATOM 2190 OG1 THR A 144 -10.716 -2.836 1.947 1.00 0.00 O ATOM 2191 CG2 THR A 144 -9.670 -0.673 1.703 1.00 0.00 C ATOM 0 H THR A 144 -7.796 -4.541 1.680 1.00 0.00 H new ATOM 0 HA THR A 144 -8.959 -2.546 -0.121 1.00 0.00 H new ATOM 0 HB THR A 144 -8.970 -2.287 2.911 1.00 0.00 H new ATOM 0 HG1 THR A 144 -11.387 -2.274 2.387 1.00 0.00 H new ATOM 0 HG21 THR A 144 -10.320 -0.270 2.480 1.00 0.00 H new ATOM 0 HG22 THR A 144 -8.710 -0.157 1.729 1.00 0.00 H new ATOM 0 HG23 THR A 144 -10.135 -0.526 0.728 1.00 0.00 H new ATOM 2199 N LEU A 145 -6.690 -1.544 -0.132 1.00 0.00 N ATOM 2200 CA LEU A 145 -5.383 -0.898 -0.161 1.00 0.00 C ATOM 2201 C LEU A 145 -5.526 0.616 -0.283 1.00 0.00 C ATOM 2202 O LEU A 145 -5.893 1.130 -1.339 1.00 0.00 O ATOM 2203 CB LEU A 145 -4.550 -1.439 -1.324 1.00 0.00 C ATOM 2204 CG LEU A 145 -3.462 -0.508 -1.861 1.00 0.00 C ATOM 2205 CD1 LEU A 145 -2.263 -0.494 -0.926 1.00 0.00 C ATOM 2206 CD2 LEU A 145 -3.043 -0.930 -3.262 1.00 0.00 C ATOM 0 H LEU A 145 -7.198 -1.508 -1.016 1.00 0.00 H new ATOM 0 HA LEU A 145 -4.874 -1.122 0.777 1.00 0.00 H new ATOM 0 HB2 LEU A 145 -4.079 -2.369 -1.006 1.00 0.00 H new ATOM 0 HB3 LEU A 145 -5.225 -1.687 -2.143 1.00 0.00 H new ATOM 0 HG LEU A 145 -3.868 0.502 -1.913 1.00 0.00 H new ATOM 0 HD11 LEU A 145 -1.499 0.174 -1.324 1.00 0.00 H new ATOM 0 HD12 LEU A 145 -2.573 -0.144 0.059 1.00 0.00 H new ATOM 0 HD13 LEU A 145 -1.856 -1.502 -0.841 1.00 0.00 H new ATOM 0 HD21 LEU A 145 -2.268 -0.257 -3.628 1.00 0.00 H new ATOM 0 HD22 LEU A 145 -2.655 -1.948 -3.235 1.00 0.00 H new ATOM 0 HD23 LEU A 145 -3.905 -0.888 -3.928 1.00 0.00 H new ATOM 2218 N GLU A 146 -5.233 1.323 0.803 1.00 0.00 N ATOM 2219 CA GLU A 146 -5.328 2.778 0.816 1.00 0.00 C ATOM 2220 C GLU A 146 -3.944 3.412 0.927 1.00 0.00 C ATOM 2221 O GLU A 146 -3.013 2.807 1.458 1.00 0.00 O ATOM 2222 CB GLU A 146 -6.209 3.243 1.977 1.00 0.00 C ATOM 2223 CG GLU A 146 -5.860 2.594 3.305 1.00 0.00 C ATOM 2224 CD GLU A 146 -6.625 1.307 3.544 1.00 0.00 C ATOM 2225 OE1 GLU A 146 -7.872 1.341 3.495 1.00 0.00 O ATOM 2226 OE2 GLU A 146 -5.977 0.266 3.781 1.00 0.00 O ATOM 0 H GLU A 146 -4.928 0.912 1.685 1.00 0.00 H new ATOM 0 HA GLU A 146 -5.780 3.096 -0.123 1.00 0.00 H new ATOM 0 HB2 GLU A 146 -6.122 4.325 2.077 1.00 0.00 H new ATOM 0 HB3 GLU A 146 -7.251 3.028 1.740 1.00 0.00 H new ATOM 0 HG2 GLU A 146 -4.790 2.387 3.334 1.00 0.00 H new ATOM 0 HG3 GLU A 146 -6.071 3.294 4.114 1.00 0.00 H new ATOM 2233 N ILE A 147 -3.818 4.634 0.421 1.00 0.00 N ATOM 2234 CA ILE A 147 -2.550 5.351 0.463 1.00 0.00 C ATOM 2235 C ILE A 147 -2.762 6.824 0.796 1.00 0.00 C ATOM 2236 O ILE A 147 -3.323 7.576 0.000 1.00 0.00 O ATOM 2237 CB ILE A 147 -1.797 5.243 -0.876 1.00 0.00 C ATOM 2238 CG1 ILE A 147 -1.617 3.775 -1.268 1.00 0.00 C ATOM 2239 CG2 ILE A 147 -0.448 5.941 -0.784 1.00 0.00 C ATOM 2240 CD1 ILE A 147 -1.519 3.555 -2.761 1.00 0.00 C ATOM 0 H ILE A 147 -4.579 5.148 -0.023 1.00 0.00 H new ATOM 0 HA ILE A 147 -1.951 4.886 1.246 1.00 0.00 H new ATOM 0 HB ILE A 147 -2.387 5.736 -1.648 1.00 0.00 H new ATOM 0 HG12 ILE A 147 -0.716 3.388 -0.792 1.00 0.00 H new ATOM 0 HG13 ILE A 147 -2.456 3.198 -0.878 1.00 0.00 H new ATOM 0 HG21 ILE A 147 0.072 5.856 -1.738 1.00 0.00 H new ATOM 0 HG22 ILE A 147 -0.599 6.994 -0.546 1.00 0.00 H new ATOM 0 HG23 ILE A 147 0.151 5.474 -0.002 1.00 0.00 H new ATOM 0 HD11 ILE A 147 -1.393 2.492 -2.965 1.00 0.00 H new ATOM 0 HD12 ILE A 147 -2.430 3.911 -3.242 1.00 0.00 H new ATOM 0 HD13 ILE A 147 -0.663 4.104 -3.154 1.00 0.00 H new ATOM 2252 N GLN A 148 -2.307 7.229 1.978 1.00 0.00 N ATOM 2253 CA GLN A 148 -2.446 8.613 2.416 1.00 0.00 C ATOM 2254 C GLN A 148 -1.083 9.232 2.706 1.00 0.00 C ATOM 2255 O GLN A 148 -0.063 8.543 2.699 1.00 0.00 O ATOM 2256 CB GLN A 148 -3.330 8.689 3.663 1.00 0.00 C ATOM 2257 CG GLN A 148 -2.998 7.637 4.708 1.00 0.00 C ATOM 2258 CD GLN A 148 -3.756 6.342 4.494 1.00 0.00 C ATOM 2259 OE1 GLN A 148 -3.041 5.294 4.102 1.00 0.00 O flip ATOM 2260 NE2 GLN A 148 -4.972 6.283 4.679 1.00 0.00 N flip ATOM 0 H GLN A 148 -1.840 6.619 2.649 1.00 0.00 H new ATOM 0 HA GLN A 148 -2.916 9.177 1.611 1.00 0.00 H new ATOM 0 HB2 GLN A 148 -3.229 9.678 4.110 1.00 0.00 H new ATOM 0 HB3 GLN A 148 -4.373 8.578 3.366 1.00 0.00 H new ATOM 0 HG2 GLN A 148 -1.927 7.434 4.687 1.00 0.00 H new ATOM 0 HG3 GLN A 148 -3.229 8.029 5.699 1.00 0.00 H new ATOM 0 HE21 GLN A 148 -5.483 7.113 4.980 1.00 0.00 H new ATOM 0 HE22 GLN A 148 -5.468 5.404 4.531 1.00 0.00 H new ATOM 2269 N GLY A 149 -1.073 10.537 2.961 1.00 0.00 N ATOM 2270 CA GLY A 149 0.171 11.226 3.250 1.00 0.00 C ATOM 2271 C GLY A 149 0.580 12.173 2.139 1.00 0.00 C ATOM 2272 O GLY A 149 -0.266 12.827 1.529 1.00 0.00 O ATOM 0 H GLY A 149 -1.904 11.129 2.973 1.00 0.00 H new ATOM 0 HA2 GLY A 149 0.066 11.785 4.180 1.00 0.00 H new ATOM 0 HA3 GLY A 149 0.961 10.492 3.407 1.00 0.00 H new ATOM 2276 N ASP A 150 1.880 12.248 1.876 1.00 0.00 N ATOM 2277 CA ASP A 150 2.400 13.123 0.832 1.00 0.00 C ATOM 2278 C ASP A 150 3.089 12.313 -0.262 1.00 0.00 C ATOM 2279 O ASP A 150 4.275 11.998 -0.163 1.00 0.00 O ATOM 2280 CB ASP A 150 3.379 14.137 1.426 1.00 0.00 C ATOM 2281 CG ASP A 150 2.804 14.861 2.627 1.00 0.00 C ATOM 2282 OD1 ASP A 150 2.695 14.235 3.702 1.00 0.00 O ATOM 2283 OD2 ASP A 150 2.463 16.055 2.492 1.00 0.00 O ATOM 0 H ASP A 150 2.593 11.713 2.372 1.00 0.00 H new ATOM 0 HA ASP A 150 1.560 13.658 0.389 1.00 0.00 H new ATOM 0 HB2 ASP A 150 4.295 13.625 1.719 1.00 0.00 H new ATOM 0 HB3 ASP A 150 3.651 14.865 0.662 1.00 0.00 H new ATOM 2288 N VAL A 151 2.337 11.978 -1.306 1.00 0.00 N ATOM 2289 CA VAL A 151 2.874 11.205 -2.419 1.00 0.00 C ATOM 2290 C VAL A 151 2.146 11.531 -3.718 1.00 0.00 C ATOM 2291 O VAL A 151 0.977 11.918 -3.707 1.00 0.00 O ATOM 2292 CB VAL A 151 2.772 9.691 -2.152 1.00 0.00 C ATOM 2293 CG1 VAL A 151 1.328 9.291 -1.893 1.00 0.00 C ATOM 2294 CG2 VAL A 151 3.350 8.905 -3.319 1.00 0.00 C ATOM 0 H VAL A 151 1.354 12.230 -1.404 1.00 0.00 H new ATOM 0 HA VAL A 151 3.924 11.480 -2.517 1.00 0.00 H new ATOM 0 HB VAL A 151 3.354 9.456 -1.261 1.00 0.00 H new ATOM 0 HG11 VAL A 151 1.275 8.218 -1.706 1.00 0.00 H new ATOM 0 HG12 VAL A 151 0.952 9.829 -1.023 1.00 0.00 H new ATOM 0 HG13 VAL A 151 0.720 9.538 -2.763 1.00 0.00 H new ATOM 0 HG21 VAL A 151 3.270 7.837 -3.114 1.00 0.00 H new ATOM 0 HG22 VAL A 151 2.796 9.142 -4.227 1.00 0.00 H new ATOM 0 HG23 VAL A 151 4.398 9.171 -3.453 1.00 0.00 H new ATOM 2304 N THR A 152 2.845 11.373 -4.838 1.00 0.00 N ATOM 2305 CA THR A 152 2.265 11.651 -6.146 1.00 0.00 C ATOM 2306 C THR A 152 2.127 10.376 -6.968 1.00 0.00 C ATOM 2307 O THR A 152 3.061 9.964 -7.657 1.00 0.00 O ATOM 2308 CB THR A 152 3.116 12.666 -6.933 1.00 0.00 C ATOM 2309 OG1 THR A 152 3.355 13.830 -6.133 1.00 0.00 O ATOM 2310 CG2 THR A 152 2.422 13.066 -8.226 1.00 0.00 C ATOM 0 H THR A 152 3.813 11.054 -4.865 1.00 0.00 H new ATOM 0 HA THR A 152 1.276 12.075 -5.970 1.00 0.00 H new ATOM 0 HB THR A 152 4.067 12.195 -7.181 1.00 0.00 H new ATOM 0 HG1 THR A 152 3.898 14.469 -6.640 1.00 0.00 H new ATOM 0 HG21 THR A 152 3.041 13.783 -8.765 1.00 0.00 H new ATOM 0 HG22 THR A 152 2.268 12.182 -8.845 1.00 0.00 H new ATOM 0 HG23 THR A 152 1.458 13.520 -7.996 1.00 0.00 H new ATOM 2318 N LEU A 153 0.955 9.754 -6.894 1.00 0.00 N ATOM 2319 CA LEU A 153 0.693 8.524 -7.633 1.00 0.00 C ATOM 2320 C LEU A 153 0.525 8.808 -9.122 1.00 0.00 C ATOM 2321 O LEU A 153 -0.070 9.814 -9.508 1.00 0.00 O ATOM 2322 CB LEU A 153 -0.560 7.835 -7.089 1.00 0.00 C ATOM 2323 CG LEU A 153 -0.486 7.356 -5.639 1.00 0.00 C ATOM 2324 CD1 LEU A 153 -1.862 6.941 -5.143 1.00 0.00 C ATOM 2325 CD2 LEU A 153 0.500 6.205 -5.507 1.00 0.00 C ATOM 0 H LEU A 153 0.171 10.082 -6.330 1.00 0.00 H new ATOM 0 HA LEU A 153 1.549 7.862 -7.503 1.00 0.00 H new ATOM 0 HB2 LEU A 153 -1.399 8.525 -7.180 1.00 0.00 H new ATOM 0 HB3 LEU A 153 -0.783 6.977 -7.723 1.00 0.00 H new ATOM 0 HG LEU A 153 -0.134 8.182 -5.021 1.00 0.00 H new ATOM 0 HD11 LEU A 153 -1.789 6.603 -4.109 1.00 0.00 H new ATOM 0 HD12 LEU A 153 -2.541 7.792 -5.200 1.00 0.00 H new ATOM 0 HD13 LEU A 153 -2.243 6.130 -5.764 1.00 0.00 H new ATOM 0 HD21 LEU A 153 0.540 5.877 -4.468 1.00 0.00 H new ATOM 0 HD22 LEU A 153 0.178 5.376 -6.137 1.00 0.00 H new ATOM 0 HD23 LEU A 153 1.490 6.536 -5.821 1.00 0.00 H new ATOM 2337 N SER A 154 1.051 7.915 -9.953 1.00 0.00 N ATOM 2338 CA SER A 154 0.960 8.071 -11.400 1.00 0.00 C ATOM 2339 C SER A 154 0.350 6.829 -12.043 1.00 0.00 C ATOM 2340 O SER A 154 -0.285 6.910 -13.096 1.00 0.00 O ATOM 2341 CB SER A 154 2.345 8.337 -11.994 1.00 0.00 C ATOM 2342 OG SER A 154 2.915 9.515 -11.450 1.00 0.00 O ATOM 0 H SER A 154 1.545 7.076 -9.649 1.00 0.00 H new ATOM 0 HA SER A 154 0.313 8.923 -11.608 1.00 0.00 H new ATOM 0 HB2 SER A 154 2.999 7.488 -11.795 1.00 0.00 H new ATOM 0 HB3 SER A 154 2.267 8.433 -13.077 1.00 0.00 H new ATOM 0 HG SER A 154 3.800 9.662 -11.844 1.00 0.00 H new ATOM 2348 N TYR A 155 0.546 5.682 -11.403 1.00 0.00 N ATOM 2349 CA TYR A 155 0.017 4.422 -11.913 1.00 0.00 C ATOM 2350 C TYR A 155 -0.117 3.395 -10.793 1.00 0.00 C ATOM 2351 O TYR A 155 0.822 3.164 -10.030 1.00 0.00 O ATOM 2352 CB TYR A 155 0.923 3.875 -13.017 1.00 0.00 C ATOM 2353 CG TYR A 155 0.485 2.528 -13.547 1.00 0.00 C ATOM 2354 CD1 TYR A 155 0.811 1.356 -12.877 1.00 0.00 C ATOM 2355 CD2 TYR A 155 -0.257 2.429 -14.718 1.00 0.00 C ATOM 2356 CE1 TYR A 155 0.413 0.123 -13.358 1.00 0.00 C ATOM 2357 CE2 TYR A 155 -0.660 1.201 -15.206 1.00 0.00 C ATOM 2358 CZ TYR A 155 -0.322 0.051 -14.523 1.00 0.00 C ATOM 2359 OH TYR A 155 -0.722 -1.174 -15.005 1.00 0.00 O ATOM 0 H TYR A 155 1.067 5.598 -10.530 1.00 0.00 H new ATOM 0 HA TYR A 155 -0.973 4.613 -12.326 1.00 0.00 H new ATOM 0 HB2 TYR A 155 0.950 4.589 -13.840 1.00 0.00 H new ATOM 0 HB3 TYR A 155 1.940 3.792 -12.633 1.00 0.00 H new ATOM 0 HD1 TYR A 155 1.386 1.409 -11.964 1.00 0.00 H new ATOM 0 HD2 TYR A 155 -0.523 3.327 -15.256 1.00 0.00 H new ATOM 0 HE1 TYR A 155 0.676 -0.779 -12.825 1.00 0.00 H new ATOM 0 HE2 TYR A 155 -1.237 1.142 -16.117 1.00 0.00 H new ATOM 0 HH TYR A 155 -1.232 -1.049 -15.833 1.00 0.00 H new ATOM 2369 N VAL A 156 -1.291 2.780 -10.700 1.00 0.00 N ATOM 2370 CA VAL A 156 -1.550 1.776 -9.675 1.00 0.00 C ATOM 2371 C VAL A 156 -2.373 0.620 -10.234 1.00 0.00 C ATOM 2372 O VAL A 156 -3.575 0.754 -10.458 1.00 0.00 O ATOM 2373 CB VAL A 156 -2.290 2.382 -8.469 1.00 0.00 C ATOM 2374 CG1 VAL A 156 -2.652 1.299 -7.464 1.00 0.00 C ATOM 2375 CG2 VAL A 156 -1.445 3.466 -7.815 1.00 0.00 C ATOM 0 H VAL A 156 -2.079 2.959 -11.323 1.00 0.00 H new ATOM 0 HA VAL A 156 -0.580 1.403 -9.346 1.00 0.00 H new ATOM 0 HB VAL A 156 -3.214 2.838 -8.824 1.00 0.00 H new ATOM 0 HG11 VAL A 156 -3.174 1.747 -6.619 1.00 0.00 H new ATOM 0 HG12 VAL A 156 -3.298 0.562 -7.941 1.00 0.00 H new ATOM 0 HG13 VAL A 156 -1.743 0.811 -7.112 1.00 0.00 H new ATOM 0 HG21 VAL A 156 -1.984 3.883 -6.964 1.00 0.00 H new ATOM 0 HG22 VAL A 156 -0.503 3.037 -7.473 1.00 0.00 H new ATOM 0 HG23 VAL A 156 -1.242 4.255 -8.539 1.00 0.00 H new ATOM 2385 N GLN A 157 -1.716 -0.514 -10.455 1.00 0.00 N ATOM 2386 CA GLN A 157 -2.388 -1.694 -10.988 1.00 0.00 C ATOM 2387 C GLN A 157 -2.256 -2.873 -10.030 1.00 0.00 C ATOM 2388 O GLN A 157 -1.203 -3.081 -9.426 1.00 0.00 O ATOM 2389 CB GLN A 157 -1.808 -2.063 -12.354 1.00 0.00 C ATOM 2390 CG GLN A 157 -2.275 -3.416 -12.868 1.00 0.00 C ATOM 2391 CD GLN A 157 -2.076 -3.573 -14.362 1.00 0.00 C ATOM 2392 OE1 GLN A 157 -3.070 -3.156 -15.139 1.00 0.00 O flip ATOM 2393 NE2 GLN A 157 -1.041 -4.063 -14.814 1.00 0.00 N flip ATOM 0 H GLN A 157 -0.720 -0.641 -10.274 1.00 0.00 H new ATOM 0 HA GLN A 157 -3.446 -1.459 -11.103 1.00 0.00 H new ATOM 0 HB2 GLN A 157 -2.084 -1.294 -13.076 1.00 0.00 H new ATOM 0 HB3 GLN A 157 -0.720 -2.064 -12.289 1.00 0.00 H new ATOM 0 HG2 GLN A 157 -1.732 -4.205 -12.348 1.00 0.00 H new ATOM 0 HG3 GLN A 157 -3.331 -3.546 -12.630 1.00 0.00 H new ATOM 0 HE21 GLN A 157 -0.303 -4.370 -14.180 1.00 0.00 H new ATOM 0 HE22 GLN A 157 -0.921 -4.162 -15.822 1.00 0.00 H new ATOM 2402 N ILE A 158 -3.331 -3.643 -9.897 1.00 0.00 N ATOM 2403 CA ILE A 158 -3.335 -4.802 -9.013 1.00 0.00 C ATOM 2404 C ILE A 158 -3.396 -6.101 -9.811 1.00 0.00 C ATOM 2405 O ILE A 158 -4.475 -6.566 -10.177 1.00 0.00 O ATOM 2406 CB ILE A 158 -4.522 -4.759 -8.033 1.00 0.00 C ATOM 2407 CG1 ILE A 158 -4.487 -3.468 -7.213 1.00 0.00 C ATOM 2408 CG2 ILE A 158 -4.498 -5.974 -7.118 1.00 0.00 C ATOM 2409 CD1 ILE A 158 -5.858 -2.969 -6.811 1.00 0.00 C ATOM 0 H ILE A 158 -4.210 -3.485 -10.390 1.00 0.00 H new ATOM 0 HA ILE A 158 -2.405 -4.769 -8.446 1.00 0.00 H new ATOM 0 HB ILE A 158 -5.449 -4.779 -8.607 1.00 0.00 H new ATOM 0 HG12 ILE A 158 -3.892 -3.634 -6.315 1.00 0.00 H new ATOM 0 HG13 ILE A 158 -3.983 -2.694 -7.791 1.00 0.00 H new ATOM 0 HG21 ILE A 158 -5.343 -5.929 -6.431 1.00 0.00 H new ATOM 0 HG22 ILE A 158 -4.565 -6.882 -7.717 1.00 0.00 H new ATOM 0 HG23 ILE A 158 -3.568 -5.983 -6.549 1.00 0.00 H new ATOM 0 HD11 ILE A 158 -5.756 -2.051 -6.233 1.00 0.00 H new ATOM 0 HD12 ILE A 158 -6.450 -2.771 -7.705 1.00 0.00 H new ATOM 0 HD13 ILE A 158 -6.357 -3.725 -6.206 1.00 0.00 H new ATOM 2421 N SER A 159 -2.230 -6.683 -10.074 1.00 0.00 N ATOM 2422 CA SER A 159 -2.151 -7.927 -10.830 1.00 0.00 C ATOM 2423 C SER A 159 -2.928 -9.038 -10.130 1.00 0.00 C ATOM 2424 O SER A 159 -2.699 -9.327 -8.956 1.00 0.00 O ATOM 2425 CB SER A 159 -0.690 -8.347 -11.010 1.00 0.00 C ATOM 2426 OG SER A 159 -0.241 -9.115 -9.907 1.00 0.00 O ATOM 0 H SER A 159 -1.328 -6.313 -9.775 1.00 0.00 H new ATOM 0 HA SER A 159 -2.597 -7.757 -11.810 1.00 0.00 H new ATOM 0 HB2 SER A 159 -0.585 -8.926 -11.927 1.00 0.00 H new ATOM 0 HB3 SER A 159 -0.064 -7.461 -11.119 1.00 0.00 H new ATOM 0 HG SER A 159 -0.931 -9.122 -9.211 1.00 0.00 H new ATOM 2432 N GLY A 160 -3.850 -9.658 -10.861 1.00 0.00 N ATOM 2433 CA GLY A 160 -4.648 -10.730 -10.296 1.00 0.00 C ATOM 2434 C GLY A 160 -6.019 -10.830 -10.934 1.00 0.00 C ATOM 2435 O GLY A 160 -6.291 -10.224 -11.970 1.00 0.00 O ATOM 0 H GLY A 160 -4.058 -9.437 -11.835 1.00 0.00 H new ATOM 0 HA2 GLY A 160 -4.122 -11.676 -10.423 1.00 0.00 H new ATOM 0 HA3 GLY A 160 -4.760 -10.569 -9.224 1.00 0.00 H new ATOM 2439 N PRO A 161 -6.911 -11.614 -10.309 1.00 0.00 N ATOM 2440 CA PRO A 161 -8.276 -11.812 -10.805 1.00 0.00 C ATOM 2441 C PRO A 161 -9.132 -10.557 -10.663 1.00 0.00 C ATOM 2442 O PRO A 161 -8.871 -9.710 -9.809 1.00 0.00 O ATOM 2443 CB PRO A 161 -8.818 -12.933 -9.915 1.00 0.00 C ATOM 2444 CG PRO A 161 -8.023 -12.837 -8.659 1.00 0.00 C ATOM 2445 CD PRO A 161 -6.655 -12.367 -9.070 1.00 0.00 C ATOM 0 HA PRO A 161 -8.293 -12.049 -11.869 1.00 0.00 H new ATOM 0 HB2 PRO A 161 -9.883 -12.804 -9.720 1.00 0.00 H new ATOM 0 HB3 PRO A 161 -8.696 -13.908 -10.387 1.00 0.00 H new ATOM 0 HG2 PRO A 161 -8.482 -12.138 -7.959 1.00 0.00 H new ATOM 0 HG3 PRO A 161 -7.969 -13.803 -8.156 1.00 0.00 H new ATOM 0 HD2 PRO A 161 -6.199 -11.739 -8.305 1.00 0.00 H new ATOM 0 HD3 PRO A 161 -5.977 -13.203 -9.241 1.00 0.00 H new ATOM 2453 N SER A 162 -10.154 -10.446 -11.505 1.00 0.00 N ATOM 2454 CA SER A 162 -11.046 -9.293 -11.475 1.00 0.00 C ATOM 2455 C SER A 162 -12.479 -9.722 -11.175 1.00 0.00 C ATOM 2456 O SER A 162 -13.090 -9.256 -10.213 1.00 0.00 O ATOM 2457 CB SER A 162 -10.995 -8.546 -12.810 1.00 0.00 C ATOM 2458 OG SER A 162 -9.661 -8.221 -13.161 1.00 0.00 O ATOM 0 H SER A 162 -10.385 -11.140 -12.216 1.00 0.00 H new ATOM 0 HA SER A 162 -10.710 -8.627 -10.681 1.00 0.00 H new ATOM 0 HB2 SER A 162 -11.441 -9.161 -13.592 1.00 0.00 H new ATOM 0 HB3 SER A 162 -11.589 -7.635 -12.744 1.00 0.00 H new ATOM 0 HG SER A 162 -9.655 -7.746 -14.018 1.00 0.00 H new ATOM 2464 N SER A 163 -13.009 -10.615 -12.005 1.00 0.00 N ATOM 2465 CA SER A 163 -14.371 -11.105 -11.832 1.00 0.00 C ATOM 2466 C SER A 163 -14.397 -12.324 -10.914 1.00 0.00 C ATOM 2467 O SER A 163 -14.174 -13.451 -11.354 1.00 0.00 O ATOM 2468 CB SER A 163 -14.984 -11.461 -13.188 1.00 0.00 C ATOM 2469 OG SER A 163 -16.400 -11.464 -13.122 1.00 0.00 O ATOM 0 H SER A 163 -12.516 -11.014 -12.804 1.00 0.00 H new ATOM 0 HA SER A 163 -14.960 -10.312 -11.372 1.00 0.00 H new ATOM 0 HB2 SER A 163 -14.653 -10.744 -13.940 1.00 0.00 H new ATOM 0 HB3 SER A 163 -14.629 -12.442 -13.505 1.00 0.00 H new ATOM 0 HG SER A 163 -16.768 -11.693 -14.001 1.00 0.00 H new ATOM 2475 N GLY A 164 -14.671 -12.088 -9.635 1.00 0.00 N ATOM 2476 CA GLY A 164 -14.721 -13.175 -8.674 1.00 0.00 C ATOM 2477 C GLY A 164 -13.544 -13.159 -7.719 1.00 0.00 C ATOM 2478 O GLY A 164 -12.434 -12.786 -8.098 1.00 0.00 O ATOM 0 H GLY A 164 -14.859 -11.164 -9.247 1.00 0.00 H new ATOM 0 HA2 GLY A 164 -15.648 -13.110 -8.104 1.00 0.00 H new ATOM 0 HA3 GLY A 164 -14.740 -14.126 -9.206 1.00 0.00 H new TER 2482 GLY A 164