USER MOD reduce.3.24.130724 H: found=0, std=0, add=1109, rem=0, adj=52 USER MOD reduce.3.24.130724 removed 1109 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 105 THR OG1 : rot 180:sc= 0 USER MOD Set 1.2: A 108 GLN : amide:sc= 0.126 K(o=0.13,f=-4.9!) USER MOD Set 2.1: A 38 ASN : amide:sc= -0.0276 K(o=-0.056,f=-0.86) USER MOD Set 2.2: A 62 ASN : amide:sc= -0.0285 K(o=-0.056,f=-0.96) USER MOD Set 3.1: A 25 SER OG : rot -55:sc= 1.59 USER MOD Set 3.2: A 143 LYS NZ :NH3+ -134:sc= 2.49 (180deg=-0.448) USER MOD Set 4.1: A 7 ASN :FLIP amide:sc= 0.486 F(o=2,f=3.8) USER MOD Set 4.2: A 36 TYR OH : rot -29:sc= 0.732 USER MOD Set 4.3: A 57 SER OG : rot 176:sc= 0.876 USER MOD Set 4.4: A 59 THR OG1 : rot -92:sc= 1.73 USER MOD Set 5.1: A 6 THR OG1 : rot -54:sc= 1.15 USER MOD Set 5.2: A 9 GLN : amide:sc= 1.63 K(o=2.8,f=-6.9!) USER MOD Single : A 5 MET CE :methyl -126:sc= -0.62 (180deg=-6.34!) USER MOD Single : A 12 LYS NZ :NH3+ -131:sc= 0.794 (180deg=-0.741!) USER MOD Single : A 13 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 15 LYS NZ :NH3+ 178:sc= 1.99 (180deg=1.99) USER MOD Single : A 17 SER OG : rot 180:sc= 0 USER MOD Single : A 21 SER OG : rot -150:sc= -0.348 USER MOD Single : A 22 ASN : amide:sc= -0.182 K(o=-0.18,f=-1.2) USER MOD Single : A 27 ASN : amide:sc= 0 X(o=0,f=-0.25) USER MOD Single : A 29 ASN : amide:sc= -0.271 K(o=-0.27,f=-2.5!) USER MOD Single : A 33 THR OG1 : rot -77:sc= 1.23 USER MOD Single : A 35 THR OG1 : rot 79:sc= 1.19 USER MOD Single : A 39 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 40 THR OG1 : rot 180:sc= 0.101 USER MOD Single : A 42 TYR OH : rot 180:sc= 0 USER MOD Single : A 43 SER OG : rot 170:sc= -1.44! USER MOD Single : A 44 SER OG : rot 7:sc= 0.0304 USER MOD Single : A 45 SER OG : rot 180:sc= 0 USER MOD Single : A 47 SER OG : rot 36:sc= 0.113 USER MOD Single : A 49 TYR OH : rot 180:sc= 0 USER MOD Single : A 51 ASN : amide:sc= 0 X(o=0,f=-0.0092) USER MOD Single : A 52 ASN : amide:sc= -0.149 K(o=-0.15,f=-1.1) USER MOD Single : A 53 ASN : amide:sc= -0.365 X(o=-0.36,f=-0.066) USER MOD Single : A 58 SER OG : rot 180:sc= 0 USER MOD Single : A 61 SER OG : rot 54:sc= 0.00805 USER MOD Single : A 64 SER OG : rot 180:sc= 0 USER MOD Single : A 65 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 67 LYS NZ :NH3+ -165:sc=-0.00943 (180deg=-0.192) USER MOD Single : A 72 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 73 LYS NZ :NH3+ -137:sc= 1.19 (180deg=0.0415) USER MOD Single : A 75 ASN : amide:sc= -0.184 X(o=-0.18,f=0) USER MOD Single : A 78 SER OG : rot 180:sc= 0.0412 USER MOD Single : A 82 ASN : amide:sc= 0 X(o=0,f=-0.032) USER MOD Single : A 83 THR OG1 : rot 174:sc= 1.09 USER MOD Single : A 84 THR OG1 : rot 180:sc= 0 USER MOD Single : A 86 SER OG : rot 180:sc= -0.0513 USER MOD Single : A 90 SER OG : rot 67:sc= 1.24 USER MOD Single : A 92 LYS NZ :NH3+ 165:sc= 2.25 (180deg=1.85) USER MOD Single : A 93 THR OG1 : rot -160:sc= 0.0998 USER MOD Single : A 95 THR OG1 : rot -76:sc= 1.22 USER MOD Single : A 96 SER OG : rot 180:sc= 0 USER MOD Single : A 97 LYS NZ :NH3+ 170:sc= 1.11 (180deg=1.02) USER MOD Single : A 99 LYS NZ :NH3+ 165:sc= -0.25 (180deg=-0.269) USER MOD Single : A 101 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 109 THR OG1 : rot 180:sc= 0 USER MOD Single : A 111 THR OG1 : rot 180:sc= 0 USER MOD Single : A 113 HIS : no HD1:sc= -0.145 X(o=-0.14,f=-0.14) USER MOD Single : A 114 CYS SG : rot 3:sc= 0.163 USER MOD Single : A 115 ASN : amide:sc= 0.869 K(o=0.87,f=-4.1!) USER MOD Single : A 117 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 118 SER OG : rot 180:sc= 0 USER MOD Single : A 120 ASN : amide:sc= -0.0315 K(o=-0.031,f=-0.9) USER MOD Single : A 121 THR OG1 : rot 180:sc= -0.0757 USER MOD Single : A 122 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 123 SER OG : rot 180:sc=-0.00234 USER MOD Single : A 124 SER OG : rot 180:sc= 0 USER MOD Single : A 126 SER OG : rot 180:sc= 0 USER MOD Single : A 128 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 134 THR OG1 : rot -27:sc= 0.144 USER MOD Single : A 135 SER OG : rot 180:sc= 0 USER MOD Single : A 137 ASN : amide:sc= -0.997 K(o=-1,f=-3.2!) USER MOD Single : A 139 THR OG1 : rot 180:sc= 0 USER MOD Single : A 140 THR OG1 : rot 180:sc= 0 USER MOD Single : A 142 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 148 LYS NZ :NH3+ 175:sc= 0.687 (180deg=0.589) USER MOD Single : A 150 THR OG1 : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 60 N MET A 5 18.984 -3.089 3.798 1.00 25.13 N ATOM 61 CA MET A 5 17.813 -3.928 3.606 1.00 72.12 C ATOM 62 C MET A 5 17.649 -4.234 2.111 1.00 31.14 C ATOM 63 O MET A 5 18.300 -3.613 1.274 1.00 73.42 O ATOM 64 CB MET A 5 16.610 -3.220 4.264 1.00 70.23 C ATOM 65 CG MET A 5 15.757 -2.320 3.364 1.00 30.33 C ATOM 66 SD MET A 5 16.621 -0.871 2.706 1.00 22.52 S ATOM 67 CE MET A 5 15.322 -0.230 1.624 1.00 50.32 C ATOM 0 HA MET A 5 17.907 -4.901 4.089 1.00 72.12 H new ATOM 0 HB2 MET A 5 15.961 -3.983 4.693 1.00 70.23 H new ATOM 0 HB3 MET A 5 16.983 -2.616 5.091 1.00 70.23 H new ATOM 0 HG2 MET A 5 15.383 -2.913 2.529 1.00 30.33 H new ATOM 0 HG3 MET A 5 14.888 -1.982 3.929 1.00 30.33 H new ATOM 0 HE1 MET A 5 15.717 -0.106 0.616 1.00 50.32 H new ATOM 0 HE2 MET A 5 14.487 -0.930 1.603 1.00 50.32 H new ATOM 0 HE3 MET A 5 14.978 0.734 2.000 1.00 50.32 H new ATOM 77 N THR A 6 16.773 -5.161 1.755 1.00 51.15 N ATOM 78 CA THR A 6 16.534 -5.633 0.393 1.00 22.30 C ATOM 79 C THR A 6 15.028 -5.585 0.147 1.00 61.12 C ATOM 80 O THR A 6 14.286 -5.141 1.026 1.00 32.20 O ATOM 81 CB THR A 6 17.131 -7.044 0.214 1.00 24.30 C ATOM 82 OG1 THR A 6 16.380 -8.034 0.901 1.00 21.20 O ATOM 83 CG2 THR A 6 18.566 -7.105 0.736 1.00 22.10 C ATOM 0 H THR A 6 16.179 -5.630 2.439 1.00 51.15 H new ATOM 0 HA THR A 6 17.026 -5.001 -0.346 1.00 22.30 H new ATOM 0 HB THR A 6 17.105 -7.246 -0.857 1.00 24.30 H new ATOM 0 HG1 THR A 6 16.284 -7.778 1.842 1.00 21.20 H new ATOM 0 HG21 THR A 6 18.961 -8.111 0.597 1.00 22.10 H new ATOM 0 HG22 THR A 6 19.183 -6.394 0.187 1.00 22.10 H new ATOM 0 HG23 THR A 6 18.578 -6.854 1.797 1.00 22.10 H new ATOM 91 N ASN A 7 14.551 -6.082 -0.994 1.00 31.51 N ATOM 92 CA ASN A 7 13.126 -6.280 -1.259 1.00 51.24 C ATOM 93 C ASN A 7 12.435 -7.023 -0.114 1.00 44.31 C ATOM 94 O ASN A 7 11.462 -6.489 0.419 1.00 53.33 O ATOM 95 CB ASN A 7 12.945 -7.031 -2.585 1.00 1.01 C ATOM 96 CG ASN A 7 13.005 -6.167 -3.835 1.00 23.40 C ATOM 97 OD1 ASN A 7 13.274 -4.880 -3.732 1.00 63.33 O flip ATOM 98 ND2 ASN A 7 12.816 -6.663 -4.935 1.00 42.45 N flip ATOM 0 H ASN A 7 15.151 -6.362 -1.770 1.00 31.51 H new ATOM 0 HA ASN A 7 12.654 -5.300 -1.335 1.00 51.24 H new ATOM 0 HB2 ASN A 7 13.715 -7.799 -2.657 1.00 1.01 H new ATOM 0 HB3 ASN A 7 11.984 -7.545 -2.564 1.00 1.01 H new ATOM 0 HD21 ASN A 7 12.608 -7.658 -5.017 1.00 42.45 H new ATOM 0 HD22 ASN A 7 12.866 -6.082 -5.772 1.00 42.45 H new ATOM 105 N GLY A 8 12.980 -8.170 0.318 1.00 12.22 N ATOM 106 CA GLY A 8 12.428 -9.012 1.382 1.00 61.15 C ATOM 107 C GLY A 8 12.268 -8.291 2.718 1.00 23.52 C ATOM 108 O GLY A 8 11.536 -8.743 3.599 1.00 4.01 O ATOM 0 H GLY A 8 13.842 -8.546 -0.077 1.00 12.22 H new ATOM 0 HA2 GLY A 8 11.456 -9.391 1.065 1.00 61.15 H new ATOM 0 HA3 GLY A 8 13.077 -9.877 1.522 1.00 61.15 H new ATOM 112 N GLN A 9 12.952 -7.161 2.898 1.00 63.14 N ATOM 113 CA GLN A 9 12.654 -6.226 3.960 1.00 50.15 C ATOM 114 C GLN A 9 11.678 -5.161 3.444 1.00 1.10 C ATOM 115 O GLN A 9 10.574 -5.068 3.962 1.00 53.32 O ATOM 116 CB GLN A 9 13.964 -5.643 4.499 1.00 11.42 C ATOM 117 CG GLN A 9 14.766 -6.648 5.351 1.00 72.21 C ATOM 118 CD GLN A 9 15.771 -7.511 4.581 1.00 70.15 C ATOM 119 OE1 GLN A 9 16.194 -7.193 3.474 1.00 34.10 O ATOM 120 NE2 GLN A 9 16.236 -8.596 5.165 1.00 65.14 N ATOM 0 H GLN A 9 13.730 -6.876 2.303 1.00 63.14 H new ATOM 0 HA GLN A 9 12.160 -6.723 4.795 1.00 50.15 H new ATOM 0 HB2 GLN A 9 14.579 -5.312 3.662 1.00 11.42 H new ATOM 0 HB3 GLN A 9 13.743 -4.761 5.100 1.00 11.42 H new ATOM 0 HG2 GLN A 9 15.303 -6.096 6.122 1.00 72.21 H new ATOM 0 HG3 GLN A 9 14.064 -7.307 5.861 1.00 72.21 H new ATOM 0 HE21 GLN A 9 15.890 -8.868 6.085 1.00 65.14 H new ATOM 0 HE22 GLN A 9 16.942 -9.164 4.697 1.00 65.14 H new ATOM 129 N LEU A 10 12.070 -4.350 2.456 1.00 22.21 N ATOM 130 CA LEU A 10 11.391 -3.151 1.968 1.00 41.32 C ATOM 131 C LEU A 10 9.921 -3.377 1.655 1.00 52.23 C ATOM 132 O LEU A 10 9.069 -2.722 2.252 1.00 63.51 O ATOM 133 CB LEU A 10 12.108 -2.614 0.717 1.00 53.02 C ATOM 134 CG LEU A 10 11.548 -1.270 0.194 1.00 61.34 C ATOM 135 CD1 LEU A 10 11.457 -0.188 1.277 1.00 51.01 C ATOM 136 CD2 LEU A 10 12.432 -0.747 -0.945 1.00 10.34 C ATOM 0 H LEU A 10 12.932 -4.529 1.941 1.00 22.21 H new ATOM 0 HA LEU A 10 11.434 -2.420 2.776 1.00 41.32 H new ATOM 0 HB2 LEU A 10 13.167 -2.490 0.944 1.00 53.02 H new ATOM 0 HB3 LEU A 10 12.037 -3.358 -0.076 1.00 53.02 H new ATOM 0 HG LEU A 10 10.535 -1.475 -0.153 1.00 61.34 H new ATOM 0 HD11 LEU A 10 11.057 0.728 0.843 1.00 51.01 H new ATOM 0 HD12 LEU A 10 10.799 -0.528 2.077 1.00 51.01 H new ATOM 0 HD13 LEU A 10 12.450 0.006 1.682 1.00 51.01 H new ATOM 0 HD21 LEU A 10 12.033 0.200 -1.310 1.00 10.34 H new ATOM 0 HD22 LEU A 10 13.447 -0.596 -0.578 1.00 10.34 H new ATOM 0 HD23 LEU A 10 12.445 -1.473 -1.758 1.00 10.34 H new ATOM 148 N TRP A 11 9.630 -4.281 0.715 1.00 3.12 N ATOM 149 CA TRP A 11 8.255 -4.621 0.354 1.00 14.10 C ATOM 150 C TRP A 11 7.498 -5.017 1.614 1.00 43.21 C ATOM 151 O TRP A 11 6.401 -4.532 1.853 1.00 3.12 O ATOM 152 CB TRP A 11 8.193 -5.741 -0.696 1.00 42.11 C ATOM 153 CG TRP A 11 6.825 -6.327 -0.894 1.00 33.23 C ATOM 154 CD1 TRP A 11 5.935 -5.998 -1.857 1.00 23.43 C ATOM 155 CD2 TRP A 11 6.186 -7.389 -0.125 1.00 64.40 C ATOM 156 NE1 TRP A 11 4.765 -6.712 -1.680 1.00 24.11 N ATOM 157 CE2 TRP A 11 4.868 -7.591 -0.627 1.00 21.15 C ATOM 158 CE3 TRP A 11 6.624 -8.241 0.909 1.00 43.22 C ATOM 159 CZ2 TRP A 11 4.010 -8.565 -0.103 1.00 45.33 C ATOM 160 CZ3 TRP A 11 5.775 -9.233 1.439 1.00 50.03 C ATOM 161 CH2 TRP A 11 4.469 -9.390 0.935 1.00 65.40 C ATOM 0 H TRP A 11 10.337 -4.793 0.187 1.00 3.12 H new ATOM 0 HA TRP A 11 7.789 -3.746 -0.099 1.00 14.10 H new ATOM 0 HB2 TRP A 11 8.549 -5.350 -1.649 1.00 42.11 H new ATOM 0 HB3 TRP A 11 8.877 -6.537 -0.402 1.00 42.11 H new ATOM 0 HD1 TRP A 11 6.112 -5.283 -2.647 1.00 23.43 H new ATOM 0 HE1 TRP A 11 3.931 -6.601 -2.257 1.00 24.11 H new ATOM 0 HE3 TRP A 11 7.625 -8.132 1.301 1.00 43.22 H new ATOM 0 HZ2 TRP A 11 3.009 -8.680 -0.492 1.00 45.33 H new ATOM 0 HZ3 TRP A 11 6.126 -9.874 2.234 1.00 50.03 H new ATOM 0 HH2 TRP A 11 3.819 -10.147 1.349 1.00 65.40 H new ATOM 172 N LYS A 12 8.108 -5.831 2.473 1.00 4.22 N ATOM 173 CA LYS A 12 7.500 -6.290 3.711 1.00 23.41 C ATOM 174 C LYS A 12 7.113 -5.105 4.600 1.00 25.14 C ATOM 175 O LYS A 12 5.974 -5.045 5.053 1.00 42.44 O ATOM 176 CB LYS A 12 8.467 -7.282 4.380 1.00 31.50 C ATOM 177 CG LYS A 12 7.779 -8.536 4.917 1.00 53.32 C ATOM 178 CD LYS A 12 6.851 -8.292 6.109 1.00 11.14 C ATOM 179 CE LYS A 12 7.562 -8.458 7.453 1.00 25.51 C ATOM 180 NZ LYS A 12 6.576 -8.493 8.549 1.00 25.41 N ATOM 0 H LYS A 12 9.050 -6.192 2.323 1.00 4.22 H new ATOM 0 HA LYS A 12 6.564 -6.814 3.518 1.00 23.41 H new ATOM 0 HB2 LYS A 12 9.229 -7.576 3.659 1.00 31.50 H new ATOM 0 HB3 LYS A 12 8.981 -6.780 5.200 1.00 31.50 H new ATOM 0 HG2 LYS A 12 7.203 -8.991 4.112 1.00 53.32 H new ATOM 0 HG3 LYS A 12 8.543 -9.257 5.209 1.00 53.32 H new ATOM 0 HD2 LYS A 12 6.438 -7.285 6.043 1.00 11.14 H new ATOM 0 HD3 LYS A 12 6.011 -8.985 6.059 1.00 11.14 H new ATOM 0 HE2 LYS A 12 8.148 -9.377 7.452 1.00 25.51 H new ATOM 0 HE3 LYS A 12 8.260 -7.635 7.608 1.00 25.51 H new ATOM 0 HZ1 LYS A 12 6.867 -7.835 9.299 1.00 25.41 H new ATOM 0 HZ2 LYS A 12 5.643 -8.213 8.186 1.00 25.41 H new ATOM 0 HZ3 LYS A 12 6.521 -9.457 8.936 1.00 25.41 H new ATOM 194 N LYS A 13 8.004 -4.129 4.807 1.00 3.31 N ATOM 195 CA LYS A 13 7.694 -2.902 5.567 1.00 52.31 C ATOM 196 C LYS A 13 6.483 -2.153 4.988 1.00 25.54 C ATOM 197 O LYS A 13 5.787 -1.443 5.717 1.00 41.31 O ATOM 198 CB LYS A 13 8.897 -1.934 5.667 1.00 34.34 C ATOM 199 CG LYS A 13 10.247 -2.590 5.999 1.00 62.34 C ATOM 200 CD LYS A 13 11.301 -1.617 6.539 1.00 25.23 C ATOM 201 CE LYS A 13 12.657 -2.333 6.630 1.00 51.21 C ATOM 202 NZ LYS A 13 13.744 -1.456 7.120 1.00 42.25 N ATOM 0 H LYS A 13 8.961 -4.163 4.455 1.00 3.31 H new ATOM 0 HA LYS A 13 7.451 -3.245 6.573 1.00 52.31 H new ATOM 0 HB2 LYS A 13 8.994 -1.403 4.720 1.00 34.34 H new ATOM 0 HB3 LYS A 13 8.678 -1.187 6.430 1.00 34.34 H new ATOM 0 HG2 LYS A 13 10.085 -3.378 6.735 1.00 62.34 H new ATOM 0 HG3 LYS A 13 10.637 -3.069 5.101 1.00 62.34 H new ATOM 0 HD2 LYS A 13 11.379 -0.748 5.885 1.00 25.23 H new ATOM 0 HD3 LYS A 13 11.004 -1.251 7.522 1.00 25.23 H new ATOM 0 HE2 LYS A 13 12.564 -3.192 7.294 1.00 51.21 H new ATOM 0 HE3 LYS A 13 12.925 -2.718 5.646 1.00 51.21 H new ATOM 0 HZ1 LYS A 13 14.633 -1.994 7.160 1.00 42.25 H new ATOM 0 HZ2 LYS A 13 13.857 -0.649 6.474 1.00 42.25 H new ATOM 0 HZ3 LYS A 13 13.507 -1.108 8.071 1.00 42.25 H new ATOM 216 N VAL A 14 6.234 -2.290 3.687 1.00 72.15 N ATOM 217 CA VAL A 14 5.148 -1.643 2.956 1.00 70.33 C ATOM 218 C VAL A 14 3.897 -2.544 2.876 1.00 73.50 C ATOM 219 O VAL A 14 2.793 -2.030 2.704 1.00 62.32 O ATOM 220 CB VAL A 14 5.707 -1.218 1.578 1.00 42.15 C ATOM 221 CG1 VAL A 14 4.632 -0.613 0.679 1.00 21.24 C ATOM 222 CG2 VAL A 14 6.817 -0.161 1.743 1.00 71.55 C ATOM 0 H VAL A 14 6.810 -2.881 3.088 1.00 72.15 H new ATOM 0 HA VAL A 14 4.799 -0.753 3.479 1.00 70.33 H new ATOM 0 HB VAL A 14 6.096 -2.126 1.118 1.00 42.15 H new ATOM 0 HG11 VAL A 14 5.074 -0.330 -0.277 1.00 21.24 H new ATOM 0 HG12 VAL A 14 3.843 -1.346 0.512 1.00 21.24 H new ATOM 0 HG13 VAL A 14 4.211 0.270 1.159 1.00 21.24 H new ATOM 0 HG21 VAL A 14 7.197 0.124 0.762 1.00 71.55 H new ATOM 0 HG22 VAL A 14 6.411 0.718 2.245 1.00 71.55 H new ATOM 0 HG23 VAL A 14 7.629 -0.576 2.340 1.00 71.55 H new ATOM 232 N LYS A 15 4.027 -3.865 3.047 1.00 4.03 N ATOM 233 CA LYS A 15 2.922 -4.804 3.240 1.00 54.43 C ATOM 234 C LYS A 15 2.332 -4.611 4.632 1.00 10.01 C ATOM 235 O LYS A 15 1.120 -4.514 4.800 1.00 51.31 O ATOM 236 CB LYS A 15 3.428 -6.250 3.035 1.00 54.44 C ATOM 237 CG LYS A 15 2.342 -7.317 3.275 1.00 71.52 C ATOM 238 CD LYS A 15 2.502 -8.154 4.559 1.00 2.25 C ATOM 239 CE LYS A 15 3.570 -9.242 4.383 1.00 30.53 C ATOM 240 NZ LYS A 15 3.290 -10.474 5.162 1.00 2.33 N ATOM 0 H LYS A 15 4.938 -4.323 3.055 1.00 4.03 H new ATOM 0 HA LYS A 15 2.137 -4.615 2.508 1.00 54.43 H new ATOM 0 HB2 LYS A 15 3.810 -6.353 2.019 1.00 54.44 H new ATOM 0 HB3 LYS A 15 4.264 -6.434 3.710 1.00 54.44 H new ATOM 0 HG2 LYS A 15 1.372 -6.821 3.305 1.00 71.52 H new ATOM 0 HG3 LYS A 15 2.328 -7.994 2.421 1.00 71.52 H new ATOM 0 HD2 LYS A 15 2.776 -7.503 5.389 1.00 2.25 H new ATOM 0 HD3 LYS A 15 1.549 -8.615 4.817 1.00 2.25 H new ATOM 0 HE2 LYS A 15 3.646 -9.499 3.326 1.00 30.53 H new ATOM 0 HE3 LYS A 15 4.538 -8.842 4.685 1.00 30.53 H new ATOM 0 HZ1 LYS A 15 4.030 -11.180 4.973 1.00 2.33 H new ATOM 0 HZ2 LYS A 15 3.279 -10.248 6.177 1.00 2.33 H new ATOM 0 HZ3 LYS A 15 2.365 -10.859 4.883 1.00 2.33 H new ATOM 254 N ASP A 16 3.204 -4.562 5.637 1.00 11.13 N ATOM 255 CA ASP A 16 2.845 -4.591 7.051 1.00 65.30 C ATOM 256 C ASP A 16 1.970 -3.400 7.442 1.00 72.00 C ATOM 257 O ASP A 16 1.169 -3.518 8.363 1.00 5.24 O ATOM 258 CB ASP A 16 4.112 -4.546 7.926 1.00 42.32 C ATOM 259 CG ASP A 16 4.701 -5.904 8.295 1.00 65.41 C ATOM 260 OD1 ASP A 16 4.436 -6.922 7.622 1.00 54.24 O ATOM 261 OD2 ASP A 16 5.517 -5.953 9.250 1.00 43.50 O ATOM 0 H ASP A 16 4.210 -4.499 5.484 1.00 11.13 H new ATOM 0 HA ASP A 16 2.291 -5.516 7.213 1.00 65.30 H new ATOM 0 HB2 ASP A 16 4.874 -3.969 7.403 1.00 42.32 H new ATOM 0 HB3 ASP A 16 3.879 -4.008 8.845 1.00 42.32 H new ATOM 266 N SER A 17 2.084 -2.253 6.767 1.00 71.03 N ATOM 267 CA SER A 17 1.327 -1.052 7.111 1.00 10.14 C ATOM 268 C SER A 17 -0.181 -1.291 7.062 1.00 22.15 C ATOM 269 O SER A 17 -0.934 -0.814 7.911 1.00 14.11 O ATOM 270 CB SER A 17 1.742 0.059 6.148 1.00 2.14 C ATOM 271 OG SER A 17 1.632 -0.317 4.795 1.00 25.53 O ATOM 0 H SER A 17 2.705 -2.133 5.967 1.00 71.03 H new ATOM 0 HA SER A 17 1.553 -0.764 8.138 1.00 10.14 H new ATOM 0 HB2 SER A 17 1.122 0.938 6.327 1.00 2.14 H new ATOM 0 HB3 SER A 17 2.772 0.347 6.357 1.00 2.14 H new ATOM 0 HG SER A 17 1.908 0.430 4.224 1.00 25.53 H new ATOM 277 N LEU A 18 -0.596 -2.050 6.053 1.00 61.00 N ATOM 278 CA LEU A 18 -1.990 -2.413 5.823 1.00 44.43 C ATOM 279 C LEU A 18 -2.518 -3.427 6.846 1.00 70.03 C ATOM 280 O LEU A 18 -3.727 -3.628 6.889 1.00 2.55 O ATOM 281 CB LEU A 18 -2.207 -2.955 4.402 1.00 21.44 C ATOM 282 CG LEU A 18 -1.890 -2.038 3.208 1.00 5.12 C ATOM 283 CD1 LEU A 18 -2.073 -0.540 3.496 1.00 23.34 C ATOM 284 CD2 LEU A 18 -0.494 -2.327 2.660 1.00 23.42 C ATOM 0 H LEU A 18 0.041 -2.438 5.357 1.00 61.00 H new ATOM 0 HA LEU A 18 -2.557 -1.490 5.944 1.00 44.43 H new ATOM 0 HB2 LEU A 18 -1.604 -3.857 4.296 1.00 21.44 H new ATOM 0 HB3 LEU A 18 -3.251 -3.258 4.319 1.00 21.44 H new ATOM 0 HG LEU A 18 -2.632 -2.277 2.446 1.00 5.12 H new ATOM 0 HD11 LEU A 18 -1.829 0.035 2.603 1.00 23.34 H new ATOM 0 HD12 LEU A 18 -3.108 -0.348 3.780 1.00 23.34 H new ATOM 0 HD13 LEU A 18 -1.412 -0.243 4.310 1.00 23.34 H new ATOM 0 HD21 LEU A 18 -0.291 -1.667 1.816 1.00 23.42 H new ATOM 0 HD22 LEU A 18 0.246 -2.156 3.441 1.00 23.42 H new ATOM 0 HD23 LEU A 18 -0.440 -3.365 2.331 1.00 23.42 H new ATOM 296 N ILE A 19 -1.651 -4.074 7.637 1.00 73.04 N ATOM 297 CA ILE A 19 -2.026 -4.974 8.733 1.00 33.23 C ATOM 298 C ILE A 19 -2.504 -4.139 9.922 1.00 42.54 C ATOM 299 O ILE A 19 -3.451 -4.497 10.618 1.00 33.04 O ATOM 300 CB ILE A 19 -0.812 -5.824 9.183 1.00 44.40 C ATOM 301 CG1 ILE A 19 -0.127 -6.619 8.057 1.00 11.53 C ATOM 302 CG2 ILE A 19 -1.152 -6.719 10.378 1.00 5.53 C ATOM 303 CD1 ILE A 19 -0.892 -7.854 7.606 1.00 11.24 C ATOM 0 H ILE A 19 -0.641 -3.982 7.528 1.00 73.04 H new ATOM 0 HA ILE A 19 -2.817 -5.638 8.384 1.00 33.23 H new ATOM 0 HB ILE A 19 -0.070 -5.093 9.503 1.00 44.40 H new ATOM 0 HG12 ILE A 19 0.016 -5.962 7.199 1.00 11.53 H new ATOM 0 HG13 ILE A 19 0.864 -6.923 8.394 1.00 11.53 H new ATOM 0 HG21 ILE A 19 -0.273 -7.298 10.661 1.00 5.53 H new ATOM 0 HG22 ILE A 19 -1.465 -6.100 11.219 1.00 5.53 H new ATOM 0 HG23 ILE A 19 -1.961 -7.397 10.106 1.00 5.53 H new ATOM 0 HD11 ILE A 19 -0.339 -8.354 6.811 1.00 11.24 H new ATOM 0 HD12 ILE A 19 -1.012 -8.535 8.448 1.00 11.24 H new ATOM 0 HD13 ILE A 19 -1.873 -7.559 7.235 1.00 11.24 H new ATOM 315 N ASP A 20 -1.797 -3.045 10.212 1.00 65.34 N ATOM 316 CA ASP A 20 -2.148 -2.115 11.288 1.00 72.43 C ATOM 317 C ASP A 20 -3.525 -1.493 11.047 1.00 54.41 C ATOM 318 O ASP A 20 -4.139 -1.002 11.994 1.00 24.35 O ATOM 319 CB ASP A 20 -1.115 -0.983 11.426 1.00 23.03 C ATOM 320 CG ASP A 20 0.228 -1.434 11.987 1.00 65.10 C ATOM 321 OD1 ASP A 20 0.898 -2.283 11.359 1.00 31.24 O ATOM 322 OD2 ASP A 20 0.680 -0.894 13.024 1.00 74.11 O ATOM 0 H ASP A 20 -0.956 -2.777 9.701 1.00 65.34 H new ATOM 0 HA ASP A 20 -2.161 -2.698 12.209 1.00 72.43 H new ATOM 0 HB2 ASP A 20 -0.955 -0.530 10.448 1.00 23.03 H new ATOM 0 HB3 ASP A 20 -1.525 -0.208 12.073 1.00 23.03 H new ATOM 327 N SER A 21 -4.006 -1.512 9.801 1.00 1.24 N ATOM 328 CA SER A 21 -5.272 -0.961 9.349 1.00 44.53 C ATOM 329 C SER A 21 -6.201 -2.093 8.882 1.00 11.44 C ATOM 330 O SER A 21 -5.831 -3.264 8.907 1.00 43.23 O ATOM 331 CB SER A 21 -4.993 0.093 8.265 1.00 44.54 C ATOM 332 OG SER A 21 -3.785 -0.108 7.544 1.00 65.21 O ATOM 0 H SER A 21 -3.483 -1.942 9.038 1.00 1.24 H new ATOM 0 HA SER A 21 -5.795 -0.459 10.163 1.00 44.53 H new ATOM 0 HB2 SER A 21 -5.825 0.100 7.561 1.00 44.54 H new ATOM 0 HB3 SER A 21 -4.963 1.077 8.732 1.00 44.54 H new ATOM 0 HG SER A 21 -3.431 0.758 7.251 1.00 65.21 H new ATOM 338 N ASN A 22 -7.422 -1.761 8.455 1.00 3.31 N ATOM 339 CA ASN A 22 -8.427 -2.747 8.039 1.00 54.30 C ATOM 340 C ASN A 22 -8.410 -2.967 6.518 1.00 54.52 C ATOM 341 O ASN A 22 -9.455 -3.076 5.870 1.00 51.24 O ATOM 342 CB ASN A 22 -9.799 -2.284 8.539 1.00 43.30 C ATOM 343 CG ASN A 22 -10.841 -3.396 8.505 1.00 3.43 C ATOM 344 OD1 ASN A 22 -10.542 -4.571 8.314 1.00 11.14 O ATOM 345 ND2 ASN A 22 -12.097 -3.057 8.745 1.00 62.12 N ATOM 0 H ASN A 22 -7.745 -0.796 8.387 1.00 3.31 H new ATOM 0 HA ASN A 22 -8.194 -3.715 8.482 1.00 54.30 H new ATOM 0 HB2 ASN A 22 -9.703 -1.912 9.559 1.00 43.30 H new ATOM 0 HB3 ASN A 22 -10.142 -1.450 7.926 1.00 43.30 H new ATOM 0 HD21 ASN A 22 -12.822 -3.774 8.772 1.00 62.12 H new ATOM 0 HD22 ASN A 22 -12.340 -2.079 8.903 1.00 62.12 H new ATOM 352 N ILE A 23 -7.227 -2.892 5.898 1.00 63.11 N ATOM 353 CA ILE A 23 -7.114 -2.685 4.455 1.00 5.15 C ATOM 354 C ILE A 23 -6.937 -4.009 3.702 1.00 5.13 C ATOM 355 O ILE A 23 -7.398 -4.106 2.560 1.00 50.23 O ATOM 356 CB ILE A 23 -6.024 -1.617 4.199 1.00 73.34 C ATOM 357 CG1 ILE A 23 -6.593 -0.252 4.649 1.00 50.33 C ATOM 358 CG2 ILE A 23 -5.565 -1.563 2.732 1.00 3.33 C ATOM 359 CD1 ILE A 23 -5.541 0.854 4.723 1.00 70.23 C ATOM 0 H ILE A 23 -6.331 -2.972 6.379 1.00 63.11 H new ATOM 0 HA ILE A 23 -8.043 -2.291 4.042 1.00 5.15 H new ATOM 0 HB ILE A 23 -5.134 -1.879 4.771 1.00 73.34 H new ATOM 0 HG12 ILE A 23 -7.379 0.051 3.957 1.00 50.33 H new ATOM 0 HG13 ILE A 23 -7.058 -0.366 5.628 1.00 50.33 H new ATOM 0 HG21 ILE A 23 -4.800 -0.795 2.618 1.00 3.33 H new ATOM 0 HG22 ILE A 23 -5.153 -2.530 2.444 1.00 3.33 H new ATOM 0 HG23 ILE A 23 -6.416 -1.326 2.093 1.00 3.33 H new ATOM 0 HD11 ILE A 23 -6.012 1.783 5.045 1.00 70.23 H new ATOM 0 HD12 ILE A 23 -4.767 0.573 5.437 1.00 70.23 H new ATOM 0 HD13 ILE A 23 -5.093 0.996 3.740 1.00 70.23 H new ATOM 371 N ILE A 24 -6.330 -5.022 4.327 1.00 14.32 N ATOM 372 CA ILE A 24 -6.105 -6.360 3.789 1.00 23.15 C ATOM 373 C ILE A 24 -6.382 -7.383 4.906 1.00 65.02 C ATOM 374 O ILE A 24 -6.271 -7.052 6.088 1.00 45.31 O ATOM 375 CB ILE A 24 -4.666 -6.477 3.218 1.00 13.24 C ATOM 376 CG1 ILE A 24 -3.561 -6.098 4.222 1.00 42.23 C ATOM 377 CG2 ILE A 24 -4.441 -5.606 1.971 1.00 50.51 C ATOM 378 CD1 ILE A 24 -3.102 -7.236 5.108 1.00 33.41 C ATOM 0 H ILE A 24 -5.964 -4.921 5.274 1.00 14.32 H new ATOM 0 HA ILE A 24 -6.782 -6.562 2.959 1.00 23.15 H new ATOM 0 HB ILE A 24 -4.591 -7.536 2.969 1.00 13.24 H new ATOM 0 HG12 ILE A 24 -2.703 -5.714 3.671 1.00 42.23 H new ATOM 0 HG13 ILE A 24 -3.923 -5.286 4.853 1.00 42.23 H new ATOM 0 HG21 ILE A 24 -3.417 -5.731 1.620 1.00 50.51 H new ATOM 0 HG22 ILE A 24 -5.134 -5.909 1.186 1.00 50.51 H new ATOM 0 HG23 ILE A 24 -4.613 -4.559 2.222 1.00 50.51 H new ATOM 0 HD11 ILE A 24 -2.324 -6.880 5.783 1.00 33.41 H new ATOM 0 HD12 ILE A 24 -3.946 -7.607 5.690 1.00 33.41 H new ATOM 0 HD13 ILE A 24 -2.706 -8.041 4.490 1.00 33.41 H new ATOM 390 N SER A 25 -6.702 -8.622 4.535 1.00 70.23 N ATOM 391 CA SER A 25 -6.739 -9.797 5.406 1.00 22.35 C ATOM 392 C SER A 25 -5.363 -10.476 5.478 1.00 73.03 C ATOM 393 O SER A 25 -5.056 -11.139 6.466 1.00 51.11 O ATOM 394 CB SER A 25 -7.745 -10.819 4.859 1.00 52.43 C ATOM 395 OG SER A 25 -9.011 -10.225 4.642 1.00 11.25 O ATOM 0 H SER A 25 -6.955 -8.845 3.572 1.00 70.23 H new ATOM 0 HA SER A 25 -7.031 -9.462 6.401 1.00 22.35 H new ATOM 0 HB2 SER A 25 -7.371 -11.237 3.924 1.00 52.43 H new ATOM 0 HB3 SER A 25 -7.844 -11.647 5.561 1.00 52.43 H new ATOM 0 HG SER A 25 -9.318 -9.797 5.469 1.00 11.25 H new ATOM 401 N GLY A 26 -4.509 -10.303 4.467 1.00 74.03 N ATOM 402 CA GLY A 26 -3.156 -10.825 4.480 1.00 23.15 C ATOM 403 C GLY A 26 -3.068 -12.326 4.241 1.00 25.14 C ATOM 404 O GLY A 26 -2.164 -12.961 4.791 1.00 10.23 O ATOM 0 H GLY A 26 -4.745 -9.793 3.616 1.00 74.03 H new ATOM 0 HA2 GLY A 26 -2.572 -10.311 3.716 1.00 23.15 H new ATOM 0 HA3 GLY A 26 -2.698 -10.593 5.441 1.00 23.15 H new ATOM 408 N ASN A 27 -3.987 -12.888 3.456 1.00 2.43 N ATOM 409 CA ASN A 27 -4.070 -14.326 3.212 1.00 21.44 C ATOM 410 C ASN A 27 -3.349 -14.675 1.908 1.00 34.32 C ATOM 411 O ASN A 27 -2.689 -13.831 1.295 1.00 22.12 O ATOM 412 CB ASN A 27 -5.540 -14.796 3.217 1.00 21.25 C ATOM 413 CG ASN A 27 -6.335 -14.433 4.471 1.00 12.13 C ATOM 414 OD1 ASN A 27 -5.801 -14.094 5.528 1.00 3.34 O ATOM 415 ND2 ASN A 27 -7.651 -14.469 4.375 1.00 74.32 N ATOM 0 H ASN A 27 -4.702 -12.350 2.967 1.00 2.43 H new ATOM 0 HA ASN A 27 -3.568 -14.860 4.018 1.00 21.44 H new ATOM 0 HB2 ASN A 27 -6.044 -14.369 2.350 1.00 21.25 H new ATOM 0 HB3 ASN A 27 -5.559 -15.879 3.095 1.00 21.25 H new ATOM 0 HD21 ASN A 27 -8.228 -14.216 5.177 1.00 74.32 H new ATOM 0 HD22 ASN A 27 -8.091 -14.750 3.499 1.00 74.32 H new ATOM 422 N GLU A 28 -3.459 -15.933 1.479 1.00 72.32 N ATOM 423 CA GLU A 28 -2.855 -16.515 0.277 1.00 32.24 C ATOM 424 C GLU A 28 -3.424 -15.956 -1.042 1.00 3.22 C ATOM 425 O GLU A 28 -3.273 -16.569 -2.101 1.00 45.32 O ATOM 426 CB GLU A 28 -2.989 -18.051 0.355 1.00 31.51 C ATOM 427 CG GLU A 28 -4.446 -18.555 0.220 1.00 44.40 C ATOM 428 CD GLU A 28 -4.559 -20.083 0.211 1.00 12.22 C ATOM 429 OE1 GLU A 28 -4.487 -20.696 1.306 1.00 61.42 O ATOM 430 OE2 GLU A 28 -4.798 -20.642 -0.887 1.00 2.03 O ATOM 0 H GLU A 28 -4.009 -16.619 1.996 1.00 72.32 H new ATOM 0 HA GLU A 28 -1.803 -16.230 0.259 1.00 32.24 H new ATOM 0 HB2 GLU A 28 -2.384 -18.500 -0.432 1.00 31.51 H new ATOM 0 HB3 GLU A 28 -2.581 -18.395 1.306 1.00 31.51 H new ATOM 0 HG2 GLU A 28 -5.038 -18.158 1.045 1.00 44.40 H new ATOM 0 HG3 GLU A 28 -4.876 -18.160 -0.700 1.00 44.40 H new ATOM 437 N ASN A 29 -4.167 -14.850 -0.996 1.00 52.12 N ATOM 438 CA ASN A 29 -5.001 -14.384 -2.087 1.00 73.14 C ATOM 439 C ASN A 29 -5.095 -12.864 -2.215 1.00 25.13 C ATOM 440 O ASN A 29 -5.924 -12.358 -2.978 1.00 43.34 O ATOM 441 CB ASN A 29 -6.374 -15.021 -1.919 1.00 2.31 C ATOM 442 CG ASN A 29 -7.181 -14.509 -0.735 1.00 45.44 C ATOM 443 OD1 ASN A 29 -6.744 -13.681 0.054 1.00 11.43 O ATOM 444 ND2 ASN A 29 -8.360 -15.068 -0.561 1.00 5.04 N ATOM 0 H ASN A 29 -4.201 -14.244 -0.176 1.00 52.12 H new ATOM 0 HA ASN A 29 -4.535 -14.690 -3.023 1.00 73.14 H new ATOM 0 HB2 ASN A 29 -6.949 -14.855 -2.830 1.00 2.31 H new ATOM 0 HB3 ASN A 29 -6.247 -16.099 -1.814 1.00 2.31 H new ATOM 0 HD21 ASN A 29 -8.931 -14.814 0.245 1.00 5.04 H new ATOM 0 HD22 ASN A 29 -8.703 -15.755 -1.232 1.00 5.04 H new ATOM 451 N GLU A 30 -4.210 -12.130 -1.543 1.00 30.51 N ATOM 452 CA GLU A 30 -4.051 -10.697 -1.744 1.00 50.12 C ATOM 453 C GLU A 30 -2.592 -10.444 -2.082 1.00 70.31 C ATOM 454 O GLU A 30 -1.721 -10.952 -1.376 1.00 11.23 O ATOM 455 CB GLU A 30 -4.452 -9.936 -0.479 1.00 34.35 C ATOM 456 CG GLU A 30 -5.959 -10.039 -0.209 1.00 50.31 C ATOM 457 CD GLU A 30 -6.383 -9.237 1.015 1.00 41.21 C ATOM 458 OE1 GLU A 30 -5.907 -9.540 2.127 1.00 5.45 O ATOM 459 OE2 GLU A 30 -7.231 -8.318 0.886 1.00 24.13 O ATOM 0 H GLU A 30 -3.581 -12.518 -0.840 1.00 30.51 H new ATOM 0 HA GLU A 30 -4.693 -10.348 -2.553 1.00 50.12 H new ATOM 0 HB2 GLU A 30 -3.901 -10.332 0.374 1.00 34.35 H new ATOM 0 HB3 GLU A 30 -4.171 -8.888 -0.580 1.00 34.35 H new ATOM 0 HG2 GLU A 30 -6.507 -9.684 -1.081 1.00 50.31 H new ATOM 0 HG3 GLU A 30 -6.230 -11.085 -0.067 1.00 50.31 H new ATOM 466 N GLU A 31 -2.323 -9.674 -3.136 1.00 73.10 N ATOM 467 CA GLU A 31 -0.979 -9.331 -3.584 1.00 54.03 C ATOM 468 C GLU A 31 -0.804 -7.827 -3.395 1.00 2.31 C ATOM 469 O GLU A 31 -1.776 -7.065 -3.477 1.00 52.32 O ATOM 470 CB GLU A 31 -0.789 -9.719 -5.065 1.00 34.15 C ATOM 471 CG GLU A 31 0.682 -9.834 -5.505 1.00 53.30 C ATOM 472 CD GLU A 31 0.875 -9.514 -6.981 1.00 73.43 C ATOM 473 OE1 GLU A 31 0.625 -10.415 -7.814 1.00 70.23 O ATOM 474 OE2 GLU A 31 1.249 -8.357 -7.283 1.00 24.15 O ATOM 0 H GLU A 31 -3.055 -9.262 -3.715 1.00 73.10 H new ATOM 0 HA GLU A 31 -0.232 -9.876 -3.007 1.00 54.03 H new ATOM 0 HB2 GLU A 31 -1.286 -10.672 -5.246 1.00 34.15 H new ATOM 0 HB3 GLU A 31 -1.286 -8.977 -5.690 1.00 34.15 H new ATOM 0 HG2 GLU A 31 1.291 -9.156 -4.907 1.00 53.30 H new ATOM 0 HG3 GLU A 31 1.040 -10.844 -5.306 1.00 53.30 H new ATOM 481 N ILE A 32 0.435 -7.393 -3.171 1.00 45.02 N ATOM 482 CA ILE A 32 0.793 -5.985 -3.120 1.00 45.01 C ATOM 483 C ILE A 32 1.992 -5.808 -4.043 1.00 34.13 C ATOM 484 O ILE A 32 2.991 -6.517 -3.900 1.00 72.22 O ATOM 485 CB ILE A 32 1.077 -5.518 -1.675 1.00 43.10 C ATOM 486 CG1 ILE A 32 -0.023 -5.926 -0.672 1.00 11.13 C ATOM 487 CG2 ILE A 32 1.182 -3.981 -1.653 1.00 23.15 C ATOM 488 CD1 ILE A 32 0.258 -7.192 0.135 1.00 12.21 C ATOM 0 H ILE A 32 1.225 -8.020 -3.019 1.00 45.02 H new ATOM 0 HA ILE A 32 -0.033 -5.358 -3.456 1.00 45.01 H new ATOM 0 HB ILE A 32 2.006 -6.001 -1.371 1.00 43.10 H new ATOM 0 HG12 ILE A 32 -0.181 -5.101 0.023 1.00 11.13 H new ATOM 0 HG13 ILE A 32 -0.956 -6.065 -1.219 1.00 11.13 H new ATOM 0 HG21 ILE A 32 1.382 -3.645 -0.636 1.00 23.15 H new ATOM 0 HG22 ILE A 32 1.994 -3.662 -2.307 1.00 23.15 H new ATOM 0 HG23 ILE A 32 0.244 -3.547 -2.001 1.00 23.15 H new ATOM 0 HD11 ILE A 32 -0.577 -7.387 0.808 1.00 12.21 H new ATOM 0 HD12 ILE A 32 0.383 -8.036 -0.544 1.00 12.21 H new ATOM 0 HD13 ILE A 32 1.169 -7.057 0.718 1.00 12.21 H new ATOM 500 N THR A 33 1.892 -4.851 -4.956 1.00 25.52 N ATOM 501 CA THR A 33 2.795 -4.654 -6.079 1.00 41.11 C ATOM 502 C THR A 33 3.498 -3.306 -5.895 1.00 70.13 C ATOM 503 O THR A 33 3.000 -2.256 -6.304 1.00 61.21 O ATOM 504 CB THR A 33 2.001 -4.743 -7.392 1.00 43.32 C ATOM 505 OG1 THR A 33 0.959 -5.701 -7.342 1.00 72.12 O ATOM 506 CG2 THR A 33 2.950 -5.032 -8.550 1.00 4.33 C ATOM 0 H THR A 33 1.143 -4.159 -4.931 1.00 25.52 H new ATOM 0 HA THR A 33 3.560 -5.429 -6.122 1.00 41.11 H new ATOM 0 HB THR A 33 1.519 -3.778 -7.547 1.00 43.32 H new ATOM 0 HG1 THR A 33 1.336 -6.600 -7.443 1.00 72.12 H new ATOM 0 HG21 THR A 33 2.383 -5.094 -9.479 1.00 4.33 H new ATOM 0 HG22 THR A 33 3.685 -4.231 -8.627 1.00 4.33 H new ATOM 0 HG23 THR A 33 3.462 -5.978 -8.374 1.00 4.33 H new ATOM 514 N VAL A 34 4.634 -3.315 -5.206 1.00 31.15 N ATOM 515 CA VAL A 34 5.218 -2.136 -4.576 1.00 12.44 C ATOM 516 C VAL A 34 6.323 -1.591 -5.472 1.00 61.25 C ATOM 517 O VAL A 34 7.419 -2.155 -5.478 1.00 52.32 O ATOM 518 CB VAL A 34 5.731 -2.500 -3.165 1.00 52.14 C ATOM 519 CG1 VAL A 34 6.381 -1.302 -2.469 1.00 62.24 C ATOM 520 CG2 VAL A 34 4.595 -3.002 -2.260 1.00 24.10 C ATOM 0 H VAL A 34 5.187 -4.161 -5.067 1.00 31.15 H new ATOM 0 HA VAL A 34 4.469 -1.354 -4.454 1.00 12.44 H new ATOM 0 HB VAL A 34 6.468 -3.289 -3.314 1.00 52.14 H new ATOM 0 HG11 VAL A 34 6.728 -1.600 -1.480 1.00 62.24 H new ATOM 0 HG12 VAL A 34 7.227 -0.953 -3.061 1.00 62.24 H new ATOM 0 HG13 VAL A 34 5.651 -0.499 -2.370 1.00 62.24 H new ATOM 0 HG21 VAL A 34 4.995 -3.248 -1.276 1.00 24.10 H new ATOM 0 HG22 VAL A 34 3.839 -2.224 -2.160 1.00 24.10 H new ATOM 0 HG23 VAL A 34 4.144 -3.891 -2.701 1.00 24.10 H new ATOM 530 N THR A 35 6.062 -0.511 -6.215 1.00 34.42 N ATOM 531 CA THR A 35 7.091 0.140 -7.019 1.00 1.02 C ATOM 532 C THR A 35 7.820 1.182 -6.164 1.00 4.10 C ATOM 533 O THR A 35 7.201 2.035 -5.519 1.00 52.25 O ATOM 534 CB THR A 35 6.537 0.717 -8.344 1.00 25.32 C ATOM 535 OG1 THR A 35 5.209 0.300 -8.588 1.00 51.02 O ATOM 536 CG2 THR A 35 7.431 0.358 -9.539 1.00 22.23 C ATOM 0 H THR A 35 5.144 -0.071 -6.274 1.00 34.42 H new ATOM 0 HA THR A 35 7.817 -0.610 -7.332 1.00 1.02 H new ATOM 0 HB THR A 35 6.536 1.801 -8.230 1.00 25.32 H new ATOM 0 HG1 THR A 35 4.593 0.837 -8.048 1.00 51.02 H new ATOM 0 HG21 THR A 35 7.008 0.781 -10.450 1.00 22.23 H new ATOM 0 HG22 THR A 35 8.430 0.763 -9.381 1.00 22.23 H new ATOM 0 HG23 THR A 35 7.490 -0.726 -9.636 1.00 22.23 H new ATOM 544 N TYR A 36 9.151 1.135 -6.166 1.00 71.15 N ATOM 545 CA TYR A 36 10.013 2.171 -5.596 1.00 54.15 C ATOM 546 C TYR A 36 11.142 2.495 -6.579 1.00 41.22 C ATOM 547 O TYR A 36 11.234 1.877 -7.642 1.00 43.24 O ATOM 548 CB TYR A 36 10.541 1.726 -4.224 1.00 34.54 C ATOM 549 CG TYR A 36 11.578 0.622 -4.292 1.00 51.11 C ATOM 550 CD1 TYR A 36 11.173 -0.714 -4.478 1.00 50.33 C ATOM 551 CD2 TYR A 36 12.950 0.944 -4.240 1.00 71.41 C ATOM 552 CE1 TYR A 36 12.135 -1.726 -4.612 1.00 62.31 C ATOM 553 CE2 TYR A 36 13.918 -0.065 -4.382 1.00 33.21 C ATOM 554 CZ TYR A 36 13.509 -1.405 -4.568 1.00 50.04 C ATOM 555 OH TYR A 36 14.427 -2.396 -4.715 1.00 72.23 O ATOM 0 H TYR A 36 9.673 0.359 -6.573 1.00 71.15 H new ATOM 0 HA TYR A 36 9.441 3.085 -5.435 1.00 54.15 H new ATOM 0 HB2 TYR A 36 10.975 2.587 -3.716 1.00 34.54 H new ATOM 0 HB3 TYR A 36 9.703 1.386 -3.616 1.00 34.54 H new ATOM 0 HD1 TYR A 36 10.122 -0.959 -4.517 1.00 50.33 H new ATOM 0 HD2 TYR A 36 13.258 1.968 -4.091 1.00 71.41 H new ATOM 0 HE1 TYR A 36 11.824 -2.751 -4.749 1.00 62.31 H new ATOM 0 HE2 TYR A 36 14.969 0.182 -4.349 1.00 33.21 H new ATOM 0 HH TYR A 36 14.053 -3.240 -4.387 1.00 72.23 H new ATOM 565 N VAL A 37 11.982 3.485 -6.257 1.00 42.22 N ATOM 566 CA VAL A 37 13.153 3.829 -7.055 1.00 41.45 C ATOM 567 C VAL A 37 14.386 4.198 -6.202 1.00 22.32 C ATOM 568 O VAL A 37 14.307 4.528 -5.014 1.00 33.33 O ATOM 569 CB VAL A 37 12.714 4.838 -8.132 1.00 71.35 C ATOM 570 CG1 VAL A 37 12.041 6.085 -7.582 1.00 41.23 C ATOM 571 CG2 VAL A 37 13.830 5.274 -9.081 1.00 25.24 C ATOM 0 H VAL A 37 11.864 4.070 -5.430 1.00 42.22 H new ATOM 0 HA VAL A 37 13.536 2.957 -7.585 1.00 41.45 H new ATOM 0 HB VAL A 37 11.981 4.261 -8.696 1.00 71.35 H new ATOM 0 HG11 VAL A 37 11.764 6.742 -8.406 1.00 41.23 H new ATOM 0 HG12 VAL A 37 11.147 5.801 -7.027 1.00 41.23 H new ATOM 0 HG13 VAL A 37 12.730 6.607 -6.918 1.00 41.23 H new ATOM 0 HG21 VAL A 37 13.434 5.984 -9.807 1.00 25.24 H new ATOM 0 HG22 VAL A 37 14.629 5.747 -8.510 1.00 25.24 H new ATOM 0 HG23 VAL A 37 14.224 4.403 -9.604 1.00 25.24 H new ATOM 581 N ASN A 38 15.560 4.060 -6.820 1.00 74.53 N ATOM 582 CA ASN A 38 16.896 4.160 -6.231 1.00 12.41 C ATOM 583 C ASN A 38 17.405 5.600 -6.248 1.00 64.33 C ATOM 584 O ASN A 38 16.673 6.522 -6.605 1.00 62.25 O ATOM 585 CB ASN A 38 17.834 3.218 -6.995 1.00 34.42 C ATOM 586 CG ASN A 38 17.421 1.766 -6.814 1.00 73.35 C ATOM 587 OD1 ASN A 38 17.117 1.303 -5.718 1.00 42.35 O ATOM 588 ND2 ASN A 38 17.391 1.025 -7.900 1.00 44.13 N ATOM 0 H ASN A 38 15.605 3.861 -7.819 1.00 74.53 H new ATOM 0 HA ASN A 38 16.859 3.861 -5.183 1.00 12.41 H new ATOM 0 HB2 ASN A 38 17.825 3.472 -8.055 1.00 34.42 H new ATOM 0 HB3 ASN A 38 18.857 3.355 -6.643 1.00 34.42 H new ATOM 0 HD21 ASN A 38 17.111 0.046 -7.842 1.00 44.13 H new ATOM 0 HD22 ASN A 38 17.647 1.429 -8.801 1.00 44.13 H new ATOM 595 N LYS A 39 18.682 5.804 -5.894 1.00 14.40 N ATOM 596 CA LYS A 39 19.410 7.026 -6.244 1.00 53.23 C ATOM 597 C LYS A 39 19.380 7.224 -7.753 1.00 22.40 C ATOM 598 O LYS A 39 19.339 8.354 -8.230 1.00 50.23 O ATOM 599 CB LYS A 39 20.884 6.952 -5.807 1.00 54.22 C ATOM 600 CG LYS A 39 21.114 7.363 -4.346 1.00 63.51 C ATOM 601 CD LYS A 39 22.350 8.271 -4.198 1.00 74.42 C ATOM 602 CE LYS A 39 21.994 9.738 -4.463 1.00 5.00 C ATOM 603 NZ LYS A 39 23.138 10.641 -4.223 1.00 4.10 N ATOM 0 H LYS A 39 19.233 5.131 -5.361 1.00 14.40 H new ATOM 0 HA LYS A 39 18.924 7.854 -5.728 1.00 53.23 H new ATOM 0 HB2 LYS A 39 21.246 5.934 -5.950 1.00 54.22 H new ATOM 0 HB3 LYS A 39 21.479 7.596 -6.455 1.00 54.22 H new ATOM 0 HG2 LYS A 39 20.233 7.884 -3.971 1.00 63.51 H new ATOM 0 HG3 LYS A 39 21.242 6.471 -3.733 1.00 63.51 H new ATOM 0 HD2 LYS A 39 22.761 8.169 -3.194 1.00 74.42 H new ATOM 0 HD3 LYS A 39 23.125 7.951 -4.894 1.00 74.42 H new ATOM 0 HE2 LYS A 39 21.656 9.848 -5.494 1.00 5.00 H new ATOM 0 HE3 LYS A 39 21.162 10.030 -3.822 1.00 5.00 H new ATOM 0 HZ1 LYS A 39 22.852 11.622 -4.414 1.00 4.10 H new ATOM 0 HZ2 LYS A 39 23.445 10.557 -3.233 1.00 4.10 H new ATOM 0 HZ3 LYS A 39 23.924 10.381 -4.852 1.00 4.10 H new ATOM 617 N THR A 40 19.515 6.134 -8.496 1.00 45.13 N ATOM 618 CA THR A 40 19.504 6.116 -9.940 1.00 72.44 C ATOM 619 C THR A 40 18.047 6.132 -10.408 1.00 62.13 C ATOM 620 O THR A 40 17.144 5.779 -9.647 1.00 30.40 O ATOM 621 CB THR A 40 20.297 4.868 -10.373 1.00 22.20 C ATOM 622 OG1 THR A 40 19.975 3.722 -9.598 1.00 61.54 O ATOM 623 CG2 THR A 40 21.783 5.135 -10.128 1.00 63.35 C ATOM 0 H THR A 40 19.639 5.207 -8.088 1.00 45.13 H new ATOM 0 HA THR A 40 19.978 6.985 -10.396 1.00 72.44 H new ATOM 0 HB THR A 40 20.053 4.680 -11.419 1.00 22.20 H new ATOM 0 HG1 THR A 40 20.501 2.957 -9.911 1.00 61.54 H new ATOM 0 HG21 THR A 40 22.364 4.263 -10.428 1.00 63.35 H new ATOM 0 HG22 THR A 40 22.098 6.000 -10.712 1.00 63.35 H new ATOM 0 HG23 THR A 40 21.947 5.333 -9.069 1.00 63.35 H new ATOM 631 N GLY A 41 17.804 6.479 -11.675 1.00 52.41 N ATOM 632 CA GLY A 41 16.470 6.518 -12.274 1.00 54.45 C ATOM 633 C GLY A 41 15.887 5.130 -12.530 1.00 74.13 C ATOM 634 O GLY A 41 15.119 4.965 -13.478 1.00 30.20 O ATOM 0 H GLY A 41 18.544 6.746 -12.324 1.00 52.41 H new ATOM 0 HA2 GLY A 41 15.799 7.072 -11.617 1.00 54.45 H new ATOM 0 HA3 GLY A 41 16.517 7.065 -13.216 1.00 54.45 H new ATOM 638 N TYR A 42 16.294 4.129 -11.750 1.00 65.45 N ATOM 639 CA TYR A 42 16.043 2.718 -11.966 1.00 50.44 C ATOM 640 C TYR A 42 15.075 2.254 -10.895 1.00 43.35 C ATOM 641 O TYR A 42 15.394 2.252 -9.701 1.00 54.24 O ATOM 642 CB TYR A 42 17.349 1.934 -12.004 1.00 73.51 C ATOM 643 CG TYR A 42 18.368 2.398 -13.039 1.00 22.53 C ATOM 644 CD1 TYR A 42 17.980 3.112 -14.194 1.00 21.32 C ATOM 645 CD2 TYR A 42 19.727 2.087 -12.849 1.00 42.14 C ATOM 646 CE1 TYR A 42 18.938 3.531 -15.126 1.00 44.33 C ATOM 647 CE2 TYR A 42 20.692 2.472 -13.799 1.00 13.23 C ATOM 648 CZ TYR A 42 20.292 3.190 -14.949 1.00 31.20 C ATOM 649 OH TYR A 42 21.173 3.558 -15.917 1.00 35.40 O ATOM 0 H TYR A 42 16.838 4.299 -10.904 1.00 65.45 H new ATOM 0 HA TYR A 42 15.584 2.539 -12.938 1.00 50.44 H new ATOM 0 HB2 TYR A 42 17.811 1.985 -11.018 1.00 73.51 H new ATOM 0 HB3 TYR A 42 17.117 0.886 -12.194 1.00 73.51 H new ATOM 0 HD1 TYR A 42 16.937 3.337 -14.360 1.00 21.32 H new ATOM 0 HD2 TYR A 42 20.033 1.547 -11.965 1.00 42.14 H new ATOM 0 HE1 TYR A 42 18.637 4.117 -15.982 1.00 44.33 H new ATOM 0 HE2 TYR A 42 21.732 2.220 -13.650 1.00 13.23 H new ATOM 0 HH TYR A 42 22.074 3.262 -15.669 1.00 35.40 H new ATOM 659 N SER A 43 13.857 2.006 -11.344 1.00 41.11 N ATOM 660 CA SER A 43 12.693 1.621 -10.575 1.00 23.41 C ATOM 661 C SER A 43 12.655 0.088 -10.479 1.00 11.44 C ATOM 662 O SER A 43 13.190 -0.590 -11.362 1.00 33.50 O ATOM 663 CB SER A 43 11.473 2.130 -11.352 1.00 61.42 C ATOM 664 OG SER A 43 11.644 3.499 -11.706 1.00 5.12 O ATOM 0 H SER A 43 13.642 2.075 -12.339 1.00 41.11 H new ATOM 0 HA SER A 43 12.710 2.034 -9.567 1.00 23.41 H new ATOM 0 HB2 SER A 43 11.331 1.531 -12.251 1.00 61.42 H new ATOM 0 HB3 SER A 43 10.574 2.014 -10.746 1.00 61.42 H new ATOM 0 HG SER A 43 10.940 3.765 -12.334 1.00 5.12 H new ATOM 670 N SER A 44 11.971 -0.460 -9.479 1.00 32.14 N ATOM 671 CA SER A 44 11.616 -1.872 -9.398 1.00 24.33 C ATOM 672 C SER A 44 10.235 -1.950 -8.764 1.00 3.03 C ATOM 673 O SER A 44 10.002 -1.248 -7.776 1.00 10.31 O ATOM 674 CB SER A 44 12.611 -2.639 -8.513 1.00 24.13 C ATOM 675 OG SER A 44 13.903 -2.746 -9.088 1.00 3.00 O ATOM 0 H SER A 44 11.639 0.082 -8.681 1.00 32.14 H new ATOM 0 HA SER A 44 11.634 -2.316 -10.393 1.00 24.33 H new ATOM 0 HB2 SER A 44 12.690 -2.138 -7.548 1.00 24.13 H new ATOM 0 HB3 SER A 44 12.221 -3.639 -8.322 1.00 24.13 H new ATOM 0 HG SER A 44 13.941 -2.211 -9.908 1.00 3.00 H new ATOM 681 N SER A 45 9.352 -2.818 -9.265 1.00 5.23 N ATOM 682 CA SER A 45 8.278 -3.342 -8.430 1.00 31.40 C ATOM 683 C SER A 45 8.811 -4.545 -7.650 1.00 44.25 C ATOM 684 O SER A 45 9.743 -5.225 -8.099 1.00 4.02 O ATOM 685 CB SER A 45 7.011 -3.733 -9.218 1.00 72.12 C ATOM 686 OG SER A 45 6.955 -3.209 -10.536 1.00 51.34 O ATOM 0 H SER A 45 9.361 -3.164 -10.224 1.00 5.23 H new ATOM 0 HA SER A 45 7.968 -2.543 -7.756 1.00 31.40 H new ATOM 0 HB2 SER A 45 6.951 -4.820 -9.269 1.00 72.12 H new ATOM 0 HB3 SER A 45 6.135 -3.391 -8.667 1.00 72.12 H new ATOM 0 HG SER A 45 6.126 -3.502 -10.969 1.00 51.34 H new ATOM 692 N VAL A 46 8.156 -4.860 -6.539 1.00 43.12 N ATOM 693 CA VAL A 46 8.218 -6.192 -5.948 1.00 70.11 C ATOM 694 C VAL A 46 6.757 -6.667 -5.873 1.00 10.24 C ATOM 695 O VAL A 46 5.871 -5.828 -5.678 1.00 10.14 O ATOM 696 CB VAL A 46 8.855 -6.151 -4.543 1.00 21.21 C ATOM 697 CG1 VAL A 46 9.519 -7.494 -4.244 1.00 70.54 C ATOM 698 CG2 VAL A 46 9.807 -4.995 -4.224 1.00 24.23 C ATOM 0 H VAL A 46 7.570 -4.203 -6.024 1.00 43.12 H new ATOM 0 HA VAL A 46 8.837 -6.866 -6.540 1.00 70.11 H new ATOM 0 HB VAL A 46 8.012 -5.954 -3.880 1.00 21.21 H new ATOM 0 HG11 VAL A 46 9.969 -7.465 -3.252 1.00 70.54 H new ATOM 0 HG12 VAL A 46 8.771 -8.286 -4.280 1.00 70.54 H new ATOM 0 HG13 VAL A 46 10.292 -7.691 -4.987 1.00 70.54 H new ATOM 0 HG21 VAL A 46 10.176 -5.098 -3.204 1.00 24.23 H new ATOM 0 HG22 VAL A 46 10.648 -5.014 -4.917 1.00 24.23 H new ATOM 0 HG23 VAL A 46 9.276 -4.048 -4.324 1.00 24.23 H new ATOM 708 N SER A 47 6.489 -7.965 -6.018 1.00 34.33 N ATOM 709 CA SER A 47 5.146 -8.537 -5.975 1.00 63.34 C ATOM 710 C SER A 47 5.162 -9.832 -5.162 1.00 51.13 C ATOM 711 O SER A 47 5.931 -10.748 -5.479 1.00 24.11 O ATOM 712 CB SER A 47 4.643 -8.745 -7.409 1.00 70.22 C ATOM 713 OG SER A 47 5.529 -9.545 -8.182 1.00 53.00 O ATOM 0 H SER A 47 7.217 -8.662 -6.172 1.00 34.33 H new ATOM 0 HA SER A 47 4.454 -7.858 -5.478 1.00 63.34 H new ATOM 0 HB2 SER A 47 3.661 -9.217 -7.382 1.00 70.22 H new ATOM 0 HB3 SER A 47 4.518 -7.776 -7.892 1.00 70.22 H new ATOM 0 HG SER A 47 5.931 -10.233 -7.611 1.00 53.00 H new ATOM 719 N ALA A 48 4.321 -9.936 -4.131 1.00 64.41 N ATOM 720 CA ALA A 48 4.176 -11.142 -3.320 1.00 5.25 C ATOM 721 C ALA A 48 2.842 -11.090 -2.593 1.00 14.03 C ATOM 722 O ALA A 48 2.153 -10.063 -2.631 1.00 3.33 O ATOM 723 CB ALA A 48 5.321 -11.277 -2.312 1.00 5.02 C ATOM 0 H ALA A 48 3.714 -9.172 -3.833 1.00 64.41 H new ATOM 0 HA ALA A 48 4.211 -12.012 -3.975 1.00 5.25 H new ATOM 0 HB1 ALA A 48 5.183 -12.185 -1.724 1.00 5.02 H new ATOM 0 HB2 ALA A 48 6.270 -11.330 -2.845 1.00 5.02 H new ATOM 0 HB3 ALA A 48 5.325 -10.412 -1.648 1.00 5.02 H new ATOM 729 N TYR A 49 2.466 -12.202 -1.962 1.00 21.21 N ATOM 730 CA TYR A 49 1.169 -12.333 -1.325 1.00 31.31 C ATOM 731 C TYR A 49 1.271 -11.913 0.132 1.00 62.32 C ATOM 732 O TYR A 49 2.329 -11.986 0.751 1.00 5.42 O ATOM 733 CB TYR A 49 0.623 -13.766 -1.501 1.00 3.34 C ATOM 734 CG TYR A 49 0.109 -14.128 -2.893 1.00 50.00 C ATOM 735 CD1 TYR A 49 0.180 -13.219 -3.966 1.00 45.33 C ATOM 736 CD2 TYR A 49 -0.519 -15.370 -3.103 1.00 73.12 C ATOM 737 CE1 TYR A 49 -0.378 -13.515 -5.216 1.00 70.13 C ATOM 738 CE2 TYR A 49 -1.091 -15.685 -4.351 1.00 61.12 C ATOM 739 CZ TYR A 49 -1.036 -14.750 -5.410 1.00 13.11 C ATOM 740 OH TYR A 49 -1.670 -15.007 -6.588 1.00 24.54 O ATOM 0 H TYR A 49 3.054 -13.031 -1.882 1.00 21.21 H new ATOM 0 HA TYR A 49 0.451 -11.668 -1.805 1.00 31.31 H new ATOM 0 HB2 TYR A 49 1.413 -14.468 -1.235 1.00 3.34 H new ATOM 0 HB3 TYR A 49 -0.188 -13.913 -0.788 1.00 3.34 H new ATOM 0 HD1 TYR A 49 0.677 -12.271 -3.822 1.00 45.33 H new ATOM 0 HD2 TYR A 49 -0.563 -16.089 -2.299 1.00 73.12 H new ATOM 0 HE1 TYR A 49 -0.306 -12.804 -6.026 1.00 70.13 H new ATOM 0 HE2 TYR A 49 -1.572 -16.641 -4.499 1.00 61.12 H new ATOM 0 HH TYR A 49 -2.070 -15.901 -6.556 1.00 24.54 H new ATOM 750 N GLY A 50 0.150 -11.475 0.695 1.00 64.22 N ATOM 751 CA GLY A 50 0.097 -11.051 2.077 1.00 54.31 C ATOM 752 C GLY A 50 0.442 -12.187 3.024 1.00 22.32 C ATOM 753 O GLY A 50 1.070 -11.929 4.059 1.00 70.22 O ATOM 0 H GLY A 50 -0.741 -11.407 0.203 1.00 64.22 H new ATOM 0 HA2 GLY A 50 0.791 -10.224 2.231 1.00 54.31 H new ATOM 0 HA3 GLY A 50 -0.901 -10.677 2.305 1.00 54.31 H new ATOM 757 N ASN A 51 0.043 -13.412 2.684 1.00 41.04 N ATOM 758 CA ASN A 51 0.406 -14.616 3.409 1.00 25.23 C ATOM 759 C ASN A 51 1.926 -14.711 3.559 1.00 45.02 C ATOM 760 O ASN A 51 2.649 -14.757 2.564 1.00 61.53 O ATOM 761 CB ASN A 51 -0.155 -15.851 2.689 1.00 34.35 C ATOM 762 CG ASN A 51 0.592 -17.120 3.075 1.00 4.32 C ATOM 763 OD1 ASN A 51 0.615 -17.514 4.239 1.00 30.55 O ATOM 764 ND2 ASN A 51 1.225 -17.775 2.119 1.00 23.35 N ATOM 0 H ASN A 51 -0.555 -13.593 1.878 1.00 41.04 H new ATOM 0 HA ASN A 51 -0.028 -14.574 4.408 1.00 25.23 H new ATOM 0 HB2 ASN A 51 -1.212 -15.964 2.931 1.00 34.35 H new ATOM 0 HB3 ASN A 51 -0.089 -15.704 1.611 1.00 34.35 H new ATOM 0 HD21 ASN A 51 1.745 -18.624 2.341 1.00 23.35 H new ATOM 0 HD22 ASN A 51 1.194 -17.432 1.159 1.00 23.35 H new ATOM 771 N ASN A 52 2.353 -14.834 4.817 1.00 10.25 N ATOM 772 CA ASN A 52 3.688 -15.215 5.282 1.00 54.21 C ATOM 773 C ASN A 52 4.696 -14.069 5.130 1.00 53.30 C ATOM 774 O ASN A 52 4.342 -12.961 4.715 1.00 4.22 O ATOM 775 CB ASN A 52 4.147 -16.501 4.565 1.00 42.31 C ATOM 776 CG ASN A 52 5.136 -17.328 5.369 1.00 43.04 C ATOM 777 OD1 ASN A 52 6.343 -17.153 5.284 1.00 5.32 O ATOM 778 ND2 ASN A 52 4.661 -18.297 6.127 1.00 25.13 N ATOM 0 H ASN A 52 1.724 -14.655 5.600 1.00 10.25 H new ATOM 0 HA ASN A 52 3.636 -15.425 6.350 1.00 54.21 H new ATOM 0 HB2 ASN A 52 3.273 -17.113 4.340 1.00 42.31 H new ATOM 0 HB3 ASN A 52 4.602 -16.232 3.612 1.00 42.31 H new ATOM 0 HD21 ASN A 52 5.301 -18.901 6.643 1.00 25.13 H new ATOM 0 HD22 ASN A 52 3.654 -18.442 6.197 1.00 25.13 H new ATOM 785 N ASN A 53 5.952 -14.301 5.513 1.00 64.53 N ATOM 786 CA ASN A 53 7.063 -13.475 5.060 1.00 71.12 C ATOM 787 C ASN A 53 7.459 -13.905 3.661 1.00 5.42 C ATOM 788 O ASN A 53 7.061 -14.948 3.150 1.00 13.22 O ATOM 789 CB ASN A 53 8.290 -13.561 5.985 1.00 12.15 C ATOM 790 CG ASN A 53 8.766 -14.981 6.245 1.00 65.41 C ATOM 791 OD1 ASN A 53 8.527 -15.521 7.321 1.00 32.44 O ATOM 792 ND2 ASN A 53 9.443 -15.597 5.294 1.00 51.01 N ATOM 0 H ASN A 53 6.222 -15.059 6.139 1.00 64.53 H new ATOM 0 HA ASN A 53 6.725 -12.439 5.072 1.00 71.12 H new ATOM 0 HB2 ASN A 53 9.106 -12.990 5.544 1.00 12.15 H new ATOM 0 HB3 ASN A 53 8.049 -13.089 6.937 1.00 12.15 H new ATOM 0 HD21 ASN A 53 9.783 -16.547 5.443 1.00 51.01 H new ATOM 0 HD22 ASN A 53 9.626 -15.123 4.410 1.00 51.01 H new ATOM 799 N ASP A 54 8.340 -13.110 3.082 1.00 30.55 N ATOM 800 CA ASP A 54 9.101 -13.455 1.893 1.00 43.22 C ATOM 801 C ASP A 54 10.414 -12.691 1.970 1.00 72.13 C ATOM 802 O ASP A 54 10.470 -11.608 2.553 1.00 10.42 O ATOM 803 CB ASP A 54 8.328 -13.095 0.618 1.00 61.31 C ATOM 804 CG ASP A 54 9.188 -13.313 -0.629 1.00 53.40 C ATOM 805 OD1 ASP A 54 9.906 -14.332 -0.685 1.00 4.03 O ATOM 806 OD2 ASP A 54 9.187 -12.442 -1.537 1.00 22.44 O ATOM 0 H ASP A 54 8.553 -12.178 3.436 1.00 30.55 H new ATOM 0 HA ASP A 54 9.282 -14.529 1.852 1.00 43.22 H new ATOM 0 HB2 ASP A 54 7.426 -13.703 0.552 1.00 61.31 H new ATOM 0 HB3 ASP A 54 8.008 -12.054 0.665 1.00 61.31 H new ATOM 811 N ASP A 55 11.470 -13.276 1.425 1.00 51.02 N ATOM 812 CA ASP A 55 12.845 -12.804 1.430 1.00 72.52 C ATOM 813 C ASP A 55 13.686 -13.862 0.725 1.00 11.41 C ATOM 814 O ASP A 55 13.805 -14.982 1.225 1.00 32.15 O ATOM 815 CB ASP A 55 13.378 -12.575 2.857 1.00 44.32 C ATOM 816 CG ASP A 55 14.898 -12.450 2.869 1.00 30.53 C ATOM 817 OD1 ASP A 55 15.426 -11.637 2.080 1.00 65.51 O ATOM 818 OD2 ASP A 55 15.545 -13.180 3.652 1.00 23.11 O ATOM 0 H ASP A 55 11.380 -14.163 0.929 1.00 51.02 H new ATOM 0 HA ASP A 55 12.898 -11.842 0.921 1.00 72.52 H new ATOM 0 HB2 ASP A 55 12.934 -11.671 3.272 1.00 44.32 H new ATOM 0 HB3 ASP A 55 13.074 -13.403 3.498 1.00 44.32 H new ATOM 823 N PHE A 56 14.208 -13.511 -0.448 1.00 13.44 N ATOM 824 CA PHE A 56 15.105 -14.326 -1.277 1.00 51.12 C ATOM 825 C PHE A 56 15.874 -13.465 -2.295 1.00 53.05 C ATOM 826 O PHE A 56 16.560 -13.983 -3.183 1.00 63.32 O ATOM 827 CB PHE A 56 14.283 -15.375 -2.041 1.00 62.10 C ATOM 828 CG PHE A 56 13.443 -14.816 -3.177 1.00 1.41 C ATOM 829 CD1 PHE A 56 12.244 -14.137 -2.903 1.00 54.14 C ATOM 830 CD2 PHE A 56 13.875 -14.948 -4.510 1.00 63.11 C ATOM 831 CE1 PHE A 56 11.439 -13.671 -3.957 1.00 21.25 C ATOM 832 CE2 PHE A 56 13.093 -14.443 -5.562 1.00 32.14 C ATOM 833 CZ PHE A 56 11.866 -13.818 -5.285 1.00 51.13 C ATOM 0 H PHE A 56 14.009 -12.605 -0.871 1.00 13.44 H new ATOM 0 HA PHE A 56 15.825 -14.807 -0.615 1.00 51.12 H new ATOM 0 HB2 PHE A 56 14.962 -16.126 -2.444 1.00 62.10 H new ATOM 0 HB3 PHE A 56 13.625 -15.885 -1.337 1.00 62.10 H new ATOM 0 HD1 PHE A 56 11.940 -13.973 -1.880 1.00 54.14 H new ATOM 0 HD2 PHE A 56 14.812 -15.440 -4.725 1.00 63.11 H new ATOM 0 HE1 PHE A 56 10.491 -13.199 -3.744 1.00 21.25 H new ATOM 0 HE2 PHE A 56 13.435 -14.535 -6.582 1.00 32.14 H new ATOM 0 HZ PHE A 56 11.252 -13.451 -6.094 1.00 51.13 H new ATOM 843 N SER A 57 15.668 -12.149 -2.258 1.00 22.34 N ATOM 844 CA SER A 57 15.982 -11.250 -3.337 1.00 14.22 C ATOM 845 C SER A 57 17.262 -10.524 -2.949 1.00 11.10 C ATOM 846 O SER A 57 17.352 -9.862 -1.909 1.00 71.41 O ATOM 847 CB SER A 57 14.751 -10.373 -3.605 1.00 51.11 C ATOM 848 OG SER A 57 15.008 -9.317 -4.517 1.00 13.20 O ATOM 0 H SER A 57 15.266 -11.678 -1.447 1.00 22.34 H new ATOM 0 HA SER A 57 16.188 -11.737 -4.290 1.00 14.22 H new ATOM 0 HB2 SER A 57 13.947 -10.996 -3.997 1.00 51.11 H new ATOM 0 HB3 SER A 57 14.399 -9.954 -2.663 1.00 51.11 H new ATOM 0 HG SER A 57 14.176 -8.833 -4.700 1.00 13.20 H new ATOM 854 N SER A 58 18.290 -10.680 -3.779 1.00 34.21 N ATOM 855 CA SER A 58 19.596 -10.073 -3.571 1.00 64.35 C ATOM 856 C SER A 58 19.617 -8.596 -4.004 1.00 42.15 C ATOM 857 O SER A 58 20.597 -8.132 -4.597 1.00 21.44 O ATOM 858 CB SER A 58 20.647 -10.907 -4.303 1.00 23.23 C ATOM 859 OG SER A 58 20.789 -12.188 -3.715 1.00 31.33 O ATOM 0 H SER A 58 18.235 -11.242 -4.629 1.00 34.21 H new ATOM 0 HA SER A 58 19.827 -10.069 -2.506 1.00 64.35 H new ATOM 0 HB2 SER A 58 20.364 -11.015 -5.350 1.00 23.23 H new ATOM 0 HB3 SER A 58 21.605 -10.387 -4.283 1.00 23.23 H new ATOM 0 HG SER A 58 21.466 -12.700 -4.205 1.00 31.33 H new ATOM 865 N THR A 59 18.521 -7.872 -3.798 1.00 5.23 N ATOM 866 CA THR A 59 18.359 -6.477 -4.176 1.00 72.33 C ATOM 867 C THR A 59 19.166 -5.566 -3.229 1.00 13.13 C ATOM 868 O THR A 59 19.397 -5.925 -2.074 1.00 33.24 O ATOM 869 CB THR A 59 16.847 -6.152 -4.195 1.00 63.13 C ATOM 870 OG1 THR A 59 16.094 -7.005 -3.344 1.00 54.32 O ATOM 871 CG2 THR A 59 16.311 -6.296 -5.624 1.00 32.14 C ATOM 0 H THR A 59 17.692 -8.258 -3.346 1.00 5.23 H new ATOM 0 HA THR A 59 18.756 -6.294 -5.174 1.00 72.33 H new ATOM 0 HB THR A 59 16.736 -5.130 -3.832 1.00 63.13 H new ATOM 0 HG1 THR A 59 15.779 -7.781 -3.854 1.00 54.32 H new ATOM 0 HG21 THR A 59 15.245 -6.067 -5.638 1.00 32.14 H new ATOM 0 HG22 THR A 59 16.839 -5.606 -6.282 1.00 32.14 H new ATOM 0 HG23 THR A 59 16.467 -7.318 -5.970 1.00 32.14 H new ATOM 879 N PRO A 60 19.633 -4.394 -3.695 1.00 41.25 N ATOM 880 CA PRO A 60 20.415 -3.460 -2.887 1.00 44.22 C ATOM 881 C PRO A 60 19.527 -2.680 -1.906 1.00 14.42 C ATOM 882 O PRO A 60 18.298 -2.724 -2.008 1.00 4.22 O ATOM 883 CB PRO A 60 21.064 -2.521 -3.915 1.00 22.23 C ATOM 884 CG PRO A 60 20.067 -2.497 -5.072 1.00 64.24 C ATOM 885 CD PRO A 60 19.483 -3.901 -5.057 1.00 33.43 C ATOM 0 HA PRO A 60 21.150 -3.971 -2.266 1.00 44.22 H new ATOM 0 HB2 PRO A 60 21.221 -1.524 -3.502 1.00 22.23 H new ATOM 0 HB3 PRO A 60 22.038 -2.891 -4.235 1.00 22.23 H new ATOM 0 HG2 PRO A 60 19.297 -1.739 -4.925 1.00 64.24 H new ATOM 0 HG3 PRO A 60 20.556 -2.274 -6.020 1.00 64.24 H new ATOM 0 HD2 PRO A 60 18.434 -3.888 -5.352 1.00 33.43 H new ATOM 0 HD3 PRO A 60 20.005 -4.546 -5.763 1.00 33.43 H new ATOM 893 N SER A 61 20.151 -1.871 -1.039 1.00 13.14 N ATOM 894 CA SER A 61 19.535 -0.694 -0.426 1.00 30.11 C ATOM 895 C SER A 61 20.162 0.555 -1.039 1.00 53.32 C ATOM 896 O SER A 61 20.827 1.330 -0.348 1.00 63.52 O ATOM 897 CB SER A 61 19.652 -0.696 1.107 1.00 30.53 C ATOM 898 OG SER A 61 20.964 -0.950 1.568 1.00 31.32 O ATOM 0 H SER A 61 21.115 -2.022 -0.741 1.00 13.14 H new ATOM 0 HA SER A 61 18.465 -0.709 -0.634 1.00 30.11 H new ATOM 0 HB2 SER A 61 19.320 0.269 1.491 1.00 30.53 H new ATOM 0 HB3 SER A 61 18.979 -1.450 1.515 1.00 30.53 H new ATOM 0 HG SER A 61 21.587 -0.323 1.144 1.00 31.32 H new ATOM 904 N ASN A 62 19.962 0.777 -2.340 1.00 22.10 N ATOM 905 CA ASN A 62 20.173 2.098 -2.927 1.00 2.30 C ATOM 906 C ASN A 62 18.873 2.796 -3.280 1.00 30.12 C ATOM 907 O ASN A 62 18.911 3.781 -4.015 1.00 4.00 O ATOM 908 CB ASN A 62 21.241 2.180 -4.020 1.00 63.31 C ATOM 909 CG ASN A 62 21.121 1.268 -5.219 1.00 62.41 C ATOM 910 OD1 ASN A 62 20.064 0.817 -5.627 1.00 73.31 O ATOM 911 ND2 ASN A 62 22.247 1.007 -5.853 1.00 70.22 N ATOM 0 H ASN A 62 19.656 0.063 -3.001 1.00 22.10 H new ATOM 0 HA ASN A 62 20.622 2.676 -2.120 1.00 2.30 H new ATOM 0 HB2 ASN A 62 21.262 3.207 -4.386 1.00 63.31 H new ATOM 0 HB3 ASN A 62 22.207 1.988 -3.554 1.00 63.31 H new ATOM 0 HD21 ASN A 62 22.238 0.425 -6.690 1.00 70.22 H new ATOM 0 HD22 ASN A 62 23.128 1.388 -5.506 1.00 70.22 H new ATOM 918 N PHE A 63 17.765 2.361 -2.677 1.00 32.21 N ATOM 919 CA PHE A 63 16.503 3.078 -2.591 1.00 73.43 C ATOM 920 C PHE A 63 16.767 4.546 -2.219 1.00 44.22 C ATOM 921 O PHE A 63 17.750 4.868 -1.536 1.00 62.43 O ATOM 922 CB PHE A 63 15.579 2.361 -1.587 1.00 41.22 C ATOM 923 CG PHE A 63 15.767 2.725 -0.125 1.00 25.23 C ATOM 924 CD1 PHE A 63 16.984 2.453 0.533 1.00 31.11 C ATOM 925 CD2 PHE A 63 14.703 3.303 0.595 1.00 31.51 C ATOM 926 CE1 PHE A 63 17.122 2.730 1.903 1.00 61.44 C ATOM 927 CE2 PHE A 63 14.857 3.611 1.958 1.00 64.52 C ATOM 928 CZ PHE A 63 16.062 3.313 2.614 1.00 25.54 C ATOM 0 H PHE A 63 17.728 1.453 -2.214 1.00 32.21 H new ATOM 0 HA PHE A 63 15.994 3.082 -3.555 1.00 73.43 H new ATOM 0 HB2 PHE A 63 14.545 2.571 -1.862 1.00 41.22 H new ATOM 0 HB3 PHE A 63 15.725 1.286 -1.694 1.00 41.22 H new ATOM 0 HD1 PHE A 63 17.812 2.031 -0.018 1.00 31.11 H new ATOM 0 HD2 PHE A 63 13.766 3.510 0.099 1.00 31.51 H new ATOM 0 HE1 PHE A 63 18.046 2.494 2.410 1.00 61.44 H new ATOM 0 HE2 PHE A 63 14.048 4.077 2.501 1.00 64.52 H new ATOM 0 HZ PHE A 63 16.173 3.532 3.666 1.00 25.54 H new ATOM 938 N SER A 64 15.921 5.448 -2.712 1.00 42.32 N ATOM 939 CA SER A 64 16.007 6.862 -2.368 1.00 5.11 C ATOM 940 C SER A 64 14.661 7.574 -2.553 1.00 14.30 C ATOM 941 O SER A 64 14.450 8.624 -1.944 1.00 71.34 O ATOM 942 CB SER A 64 17.123 7.517 -3.203 1.00 3.33 C ATOM 943 OG SER A 64 17.726 8.614 -2.536 1.00 62.23 O ATOM 0 H SER A 64 15.163 5.220 -3.356 1.00 42.32 H new ATOM 0 HA SER A 64 16.256 6.957 -1.311 1.00 5.11 H new ATOM 0 HB2 SER A 64 17.885 6.772 -3.433 1.00 3.33 H new ATOM 0 HB3 SER A 64 16.710 7.856 -4.153 1.00 3.33 H new ATOM 0 HG SER A 64 18.428 8.996 -3.103 1.00 62.23 H new ATOM 949 N LYS A 65 13.719 7.022 -3.329 1.00 21.13 N ATOM 950 CA LYS A 65 12.391 7.571 -3.540 1.00 71.31 C ATOM 951 C LYS A 65 11.373 6.441 -3.524 1.00 44.33 C ATOM 952 O LYS A 65 11.705 5.294 -3.842 1.00 52.14 O ATOM 953 CB LYS A 65 12.329 8.243 -4.918 1.00 25.31 C ATOM 954 CG LYS A 65 12.041 9.739 -4.899 1.00 21.41 C ATOM 955 CD LYS A 65 11.277 10.114 -6.185 1.00 21.20 C ATOM 956 CE LYS A 65 11.759 11.435 -6.777 1.00 42.04 C ATOM 957 NZ LYS A 65 10.997 12.614 -6.315 1.00 31.22 N ATOM 0 H LYS A 65 13.874 6.153 -3.840 1.00 21.13 H new ATOM 0 HA LYS A 65 12.174 8.294 -2.754 1.00 71.31 H new ATOM 0 HB2 LYS A 65 13.279 8.079 -5.427 1.00 25.31 H new ATOM 0 HB3 LYS A 65 11.559 7.749 -5.511 1.00 25.31 H new ATOM 0 HG2 LYS A 65 11.451 9.999 -4.020 1.00 21.41 H new ATOM 0 HG3 LYS A 65 12.972 10.302 -4.835 1.00 21.41 H new ATOM 0 HD2 LYS A 65 11.400 9.321 -6.923 1.00 21.20 H new ATOM 0 HD3 LYS A 65 10.212 10.183 -5.966 1.00 21.20 H new ATOM 0 HE2 LYS A 65 12.810 11.573 -6.524 1.00 42.04 H new ATOM 0 HE3 LYS A 65 11.697 11.378 -7.864 1.00 42.04 H new ATOM 0 HZ1 LYS A 65 11.382 13.472 -6.759 1.00 31.22 H new ATOM 0 HZ2 LYS A 65 9.997 12.506 -6.579 1.00 31.22 H new ATOM 0 HZ3 LYS A 65 11.075 12.695 -5.281 1.00 31.22 H new ATOM 971 N LEU A 66 10.114 6.787 -3.281 1.00 24.32 N ATOM 972 CA LEU A 66 8.995 5.882 -3.481 1.00 14.43 C ATOM 973 C LEU A 66 8.383 6.130 -4.858 1.00 25.54 C ATOM 974 O LEU A 66 8.676 7.126 -5.524 1.00 14.40 O ATOM 975 CB LEU A 66 7.980 6.037 -2.327 1.00 44.25 C ATOM 976 CG LEU A 66 8.399 5.322 -1.020 1.00 32.41 C ATOM 977 CD1 LEU A 66 8.741 3.840 -1.236 1.00 70.35 C ATOM 978 CD2 LEU A 66 9.599 5.970 -0.313 1.00 51.31 C ATOM 0 H LEU A 66 9.842 7.708 -2.938 1.00 24.32 H new ATOM 0 HA LEU A 66 9.332 4.846 -3.461 1.00 14.43 H new ATOM 0 HB2 LEU A 66 7.840 7.098 -2.120 1.00 44.25 H new ATOM 0 HB3 LEU A 66 7.015 5.645 -2.650 1.00 44.25 H new ATOM 0 HG LEU A 66 7.516 5.419 -0.388 1.00 32.41 H new ATOM 0 HD11 LEU A 66 9.028 3.390 -0.285 1.00 70.35 H new ATOM 0 HD12 LEU A 66 7.870 3.320 -1.635 1.00 70.35 H new ATOM 0 HD13 LEU A 66 9.568 3.756 -1.941 1.00 70.35 H new ATOM 0 HD21 LEU A 66 9.832 5.412 0.594 1.00 51.31 H new ATOM 0 HD22 LEU A 66 10.463 5.958 -0.978 1.00 51.31 H new ATOM 0 HD23 LEU A 66 9.355 7.000 -0.053 1.00 51.31 H new ATOM 990 N LYS A 67 7.547 5.187 -5.285 1.00 61.21 N ATOM 991 CA LYS A 67 6.687 5.306 -6.454 1.00 14.24 C ATOM 992 C LYS A 67 5.301 4.755 -6.123 1.00 50.04 C ATOM 993 O LYS A 67 4.942 4.661 -4.954 1.00 51.03 O ATOM 994 CB LYS A 67 7.309 4.567 -7.631 1.00 61.34 C ATOM 995 CG LYS A 67 7.210 5.351 -8.933 1.00 2.04 C ATOM 996 CD LYS A 67 8.005 4.572 -9.978 1.00 10.30 C ATOM 997 CE LYS A 67 9.486 4.889 -9.853 1.00 21.21 C ATOM 998 NZ LYS A 67 9.811 6.240 -10.354 1.00 44.22 N ATOM 0 H LYS A 67 7.448 4.290 -4.809 1.00 61.21 H new ATOM 0 HA LYS A 67 6.583 6.355 -6.733 1.00 14.24 H new ATOM 0 HB2 LYS A 67 8.357 4.362 -7.414 1.00 61.34 H new ATOM 0 HB3 LYS A 67 6.814 3.603 -7.753 1.00 61.34 H new ATOM 0 HG2 LYS A 67 6.170 5.460 -9.241 1.00 2.04 H new ATOM 0 HG3 LYS A 67 7.613 6.356 -8.811 1.00 2.04 H new ATOM 0 HD2 LYS A 67 7.842 3.502 -9.847 1.00 10.30 H new ATOM 0 HD3 LYS A 67 7.654 4.828 -10.978 1.00 10.30 H new ATOM 0 HE2 LYS A 67 9.786 4.809 -8.808 1.00 21.21 H new ATOM 0 HE3 LYS A 67 10.062 4.149 -10.408 1.00 21.21 H new ATOM 0 HZ1 LYS A 67 10.839 6.322 -10.489 1.00 44.22 H new ATOM 0 HZ2 LYS A 67 9.329 6.399 -11.262 1.00 44.22 H new ATOM 0 HZ3 LYS A 67 9.494 6.951 -9.665 1.00 44.22 H new ATOM 1012 N GLU A 68 4.502 4.437 -7.134 1.00 31.22 N ATOM 1013 CA GLU A 68 3.117 4.009 -6.966 1.00 53.35 C ATOM 1014 C GLU A 68 2.997 2.513 -6.611 1.00 3.02 C ATOM 1015 O GLU A 68 3.990 1.777 -6.650 1.00 4.34 O ATOM 1016 CB GLU A 68 2.323 4.388 -8.221 1.00 62.21 C ATOM 1017 CG GLU A 68 2.659 3.616 -9.499 1.00 10.34 C ATOM 1018 CD GLU A 68 3.986 4.031 -10.136 1.00 32.31 C ATOM 1019 OE1 GLU A 68 4.017 5.052 -10.865 1.00 65.35 O ATOM 1020 OE2 GLU A 68 5.015 3.357 -9.919 1.00 73.51 O ATOM 0 H GLU A 68 4.802 4.469 -8.108 1.00 31.22 H new ATOM 0 HA GLU A 68 2.688 4.531 -6.111 1.00 53.35 H new ATOM 0 HB2 GLU A 68 1.263 4.251 -8.008 1.00 62.21 H new ATOM 0 HB3 GLU A 68 2.475 5.450 -8.414 1.00 62.21 H new ATOM 0 HG2 GLU A 68 2.693 2.551 -9.271 1.00 10.34 H new ATOM 0 HG3 GLU A 68 1.857 3.762 -10.223 1.00 10.34 H new ATOM 1027 N ILE A 69 1.788 2.053 -6.254 1.00 2.43 N ATOM 1028 CA ILE A 69 1.520 0.689 -5.791 1.00 23.14 C ATOM 1029 C ILE A 69 0.200 0.216 -6.415 1.00 24.15 C ATOM 1030 O ILE A 69 -0.768 0.977 -6.482 1.00 3.45 O ATOM 1031 CB ILE A 69 1.438 0.627 -4.238 1.00 34.41 C ATOM 1032 CG1 ILE A 69 2.650 1.266 -3.514 1.00 13.24 C ATOM 1033 CG2 ILE A 69 1.264 -0.816 -3.723 1.00 34.44 C ATOM 1034 CD1 ILE A 69 2.323 1.637 -2.063 1.00 70.53 C ATOM 0 H ILE A 69 0.951 2.636 -6.281 1.00 2.43 H new ATOM 0 HA ILE A 69 2.337 0.036 -6.099 1.00 23.14 H new ATOM 0 HB ILE A 69 0.555 1.219 -3.997 1.00 34.41 H new ATOM 0 HG12 ILE A 69 3.489 0.571 -3.530 1.00 13.24 H new ATOM 0 HG13 ILE A 69 2.965 2.159 -4.054 1.00 13.24 H new ATOM 0 HG21 ILE A 69 1.212 -0.810 -2.634 1.00 34.44 H new ATOM 0 HG22 ILE A 69 0.345 -1.239 -4.128 1.00 34.44 H new ATOM 0 HG23 ILE A 69 2.113 -1.421 -4.042 1.00 34.44 H new ATOM 0 HD11 ILE A 69 3.201 2.081 -1.594 1.00 70.53 H new ATOM 0 HD12 ILE A 69 1.501 2.353 -2.047 1.00 70.53 H new ATOM 0 HD13 ILE A 69 2.034 0.741 -1.515 1.00 70.53 H new ATOM 1046 N ASP A 70 0.122 -1.065 -6.771 1.00 11.42 N ATOM 1047 CA ASP A 70 -1.144 -1.764 -6.994 1.00 42.00 C ATOM 1048 C ASP A 70 -1.404 -2.695 -5.817 1.00 42.22 C ATOM 1049 O ASP A 70 -0.479 -3.291 -5.260 1.00 33.34 O ATOM 1050 CB ASP A 70 -1.141 -2.560 -8.308 1.00 43.41 C ATOM 1051 CG ASP A 70 -1.601 -1.685 -9.460 1.00 4.01 C ATOM 1052 OD1 ASP A 70 -2.804 -1.345 -9.533 1.00 22.34 O ATOM 1053 OD2 ASP A 70 -0.744 -1.225 -10.244 1.00 24.44 O ATOM 0 H ASP A 70 0.943 -1.653 -6.914 1.00 11.42 H new ATOM 0 HA ASP A 70 -1.938 -1.021 -7.074 1.00 42.00 H new ATOM 0 HB2 ASP A 70 -0.139 -2.938 -8.509 1.00 43.41 H new ATOM 0 HB3 ASP A 70 -1.796 -3.426 -8.217 1.00 43.41 H new ATOM 1058 N LEU A 71 -2.675 -2.825 -5.445 1.00 33.35 N ATOM 1059 CA LEU A 71 -3.193 -3.941 -4.673 1.00 43.04 C ATOM 1060 C LEU A 71 -3.942 -4.872 -5.601 1.00 64.10 C ATOM 1061 O LEU A 71 -4.568 -4.427 -6.568 1.00 21.55 O ATOM 1062 CB LEU A 71 -4.181 -3.444 -3.600 1.00 25.14 C ATOM 1063 CG LEU A 71 -3.449 -2.886 -2.382 1.00 4.31 C ATOM 1064 CD1 LEU A 71 -4.387 -2.051 -1.501 1.00 23.24 C ATOM 1065 CD2 LEU A 71 -2.836 -4.008 -1.559 1.00 3.22 C ATOM 0 H LEU A 71 -3.389 -2.136 -5.681 1.00 33.35 H new ATOM 0 HA LEU A 71 -2.358 -4.450 -4.192 1.00 43.04 H new ATOM 0 HB2 LEU A 71 -4.824 -2.673 -4.025 1.00 25.14 H new ATOM 0 HB3 LEU A 71 -4.829 -4.265 -3.292 1.00 25.14 H new ATOM 0 HG LEU A 71 -2.653 -2.239 -2.750 1.00 4.31 H new ATOM 0 HD11 LEU A 71 -3.835 -1.668 -0.643 1.00 23.24 H new ATOM 0 HD12 LEU A 71 -4.782 -1.216 -2.080 1.00 23.24 H new ATOM 0 HD13 LEU A 71 -5.211 -2.674 -1.154 1.00 23.24 H new ATOM 0 HD21 LEU A 71 -2.320 -3.586 -0.697 1.00 3.22 H new ATOM 0 HD22 LEU A 71 -3.623 -4.681 -1.218 1.00 3.22 H new ATOM 0 HD23 LEU A 71 -2.125 -4.562 -2.172 1.00 3.22 H new ATOM 1077 N LYS A 72 -3.985 -6.138 -5.200 1.00 12.14 N ATOM 1078 CA LYS A 72 -4.960 -7.114 -5.688 1.00 42.11 C ATOM 1079 C LYS A 72 -5.510 -7.925 -4.538 1.00 25.51 C ATOM 1080 O LYS A 72 -4.983 -7.907 -3.423 1.00 44.00 O ATOM 1081 CB LYS A 72 -4.387 -8.027 -6.788 1.00 45.24 C ATOM 1082 CG LYS A 72 -4.327 -7.227 -8.084 1.00 63.42 C ATOM 1083 CD LYS A 72 -3.913 -8.016 -9.324 1.00 14.11 C ATOM 1084 CE LYS A 72 -5.090 -8.789 -9.931 1.00 32.53 C ATOM 1085 NZ LYS A 72 -4.789 -9.249 -11.301 1.00 41.04 N ATOM 0 H LYS A 72 -3.334 -6.524 -4.516 1.00 12.14 H new ATOM 0 HA LYS A 72 -5.775 -6.555 -6.148 1.00 42.11 H new ATOM 0 HB2 LYS A 72 -3.393 -8.378 -6.511 1.00 45.24 H new ATOM 0 HB3 LYS A 72 -5.014 -8.910 -6.914 1.00 45.24 H new ATOM 0 HG2 LYS A 72 -5.308 -6.787 -8.265 1.00 63.42 H new ATOM 0 HG3 LYS A 72 -3.628 -6.402 -7.949 1.00 63.42 H new ATOM 0 HD2 LYS A 72 -3.505 -7.333 -10.069 1.00 14.11 H new ATOM 0 HD3 LYS A 72 -3.118 -8.714 -9.061 1.00 14.11 H new ATOM 0 HE2 LYS A 72 -5.326 -9.647 -9.302 1.00 32.53 H new ATOM 0 HE3 LYS A 72 -5.975 -8.153 -9.946 1.00 32.53 H new ATOM 0 HZ1 LYS A 72 -5.607 -9.768 -11.680 1.00 41.04 H new ATOM 0 HZ2 LYS A 72 -4.589 -8.428 -11.907 1.00 41.04 H new ATOM 0 HZ3 LYS A 72 -3.960 -9.876 -11.282 1.00 41.04 H new ATOM 1099 N LYS A 73 -6.637 -8.571 -4.808 1.00 12.33 N ATOM 1100 CA LYS A 73 -7.416 -9.321 -3.832 1.00 23.32 C ATOM 1101 C LYS A 73 -8.367 -10.270 -4.536 1.00 12.24 C ATOM 1102 O LYS A 73 -8.633 -10.105 -5.729 1.00 54.10 O ATOM 1103 CB LYS A 73 -8.184 -8.344 -2.932 1.00 41.13 C ATOM 1104 CG LYS A 73 -9.234 -7.534 -3.711 1.00 30.51 C ATOM 1105 CD LYS A 73 -9.623 -6.252 -2.981 1.00 33.52 C ATOM 1106 CE LYS A 73 -8.551 -5.164 -3.118 1.00 13.35 C ATOM 1107 NZ LYS A 73 -8.491 -4.295 -1.924 1.00 72.22 N ATOM 0 H LYS A 73 -7.047 -8.588 -5.742 1.00 12.33 H new ATOM 0 HA LYS A 73 -6.745 -9.916 -3.212 1.00 23.32 H new ATOM 0 HB2 LYS A 73 -8.676 -8.899 -2.134 1.00 41.13 H new ATOM 0 HB3 LYS A 73 -7.480 -7.660 -2.458 1.00 41.13 H new ATOM 0 HG2 LYS A 73 -8.842 -7.285 -4.697 1.00 30.51 H new ATOM 0 HG3 LYS A 73 -10.122 -8.146 -3.867 1.00 30.51 H new ATOM 0 HD2 LYS A 73 -10.568 -5.882 -3.378 1.00 33.52 H new ATOM 0 HD3 LYS A 73 -9.784 -6.471 -1.925 1.00 33.52 H new ATOM 0 HE2 LYS A 73 -7.579 -5.630 -3.277 1.00 13.35 H new ATOM 0 HE3 LYS A 73 -8.761 -4.557 -3.999 1.00 13.35 H new ATOM 0 HZ1 LYS A 73 -8.399 -3.303 -2.221 1.00 72.22 H new ATOM 0 HZ2 LYS A 73 -9.361 -4.411 -1.366 1.00 72.22 H new ATOM 0 HZ3 LYS A 73 -7.670 -4.560 -1.343 1.00 72.22 H new ATOM 1121 N ASP A 74 -8.949 -11.182 -3.767 1.00 1.11 N ATOM 1122 CA ASP A 74 -9.756 -12.300 -4.237 1.00 4.13 C ATOM 1123 C ASP A 74 -10.999 -12.455 -3.363 1.00 71.24 C ATOM 1124 O ASP A 74 -11.289 -11.604 -2.515 1.00 2.34 O ATOM 1125 CB ASP A 74 -8.890 -13.557 -4.163 1.00 65.14 C ATOM 1126 CG ASP A 74 -9.345 -14.634 -5.131 1.00 32.11 C ATOM 1127 OD1 ASP A 74 -9.019 -14.551 -6.333 1.00 14.25 O ATOM 1128 OD2 ASP A 74 -9.980 -15.604 -4.661 1.00 13.24 O ATOM 0 H ASP A 74 -8.867 -11.161 -2.751 1.00 1.11 H new ATOM 0 HA ASP A 74 -10.089 -12.130 -5.261 1.00 4.13 H new ATOM 0 HB2 ASP A 74 -7.854 -13.294 -4.378 1.00 65.14 H new ATOM 0 HB3 ASP A 74 -8.914 -13.952 -3.147 1.00 65.14 H new ATOM 1133 N ASN A 75 -11.750 -13.542 -3.543 1.00 42.23 N ATOM 1134 CA ASN A 75 -12.911 -13.859 -2.733 1.00 70.30 C ATOM 1135 C ASN A 75 -12.455 -14.590 -1.485 1.00 52.12 C ATOM 1136 O ASN A 75 -12.406 -15.824 -1.427 1.00 54.10 O ATOM 1137 CB ASN A 75 -13.947 -14.663 -3.507 1.00 63.50 C ATOM 1138 CG ASN A 75 -14.586 -13.866 -4.626 1.00 21.11 C ATOM 1139 OD1 ASN A 75 -14.636 -14.310 -5.770 1.00 74.11 O ATOM 1140 ND2 ASN A 75 -15.126 -12.692 -4.345 1.00 73.30 N ATOM 0 H ASN A 75 -11.560 -14.233 -4.269 1.00 42.23 H new ATOM 0 HA ASN A 75 -13.405 -12.930 -2.447 1.00 70.30 H new ATOM 0 HB2 ASN A 75 -13.474 -15.552 -3.924 1.00 63.50 H new ATOM 0 HB3 ASN A 75 -14.722 -15.005 -2.821 1.00 63.50 H new ATOM 0 HD21 ASN A 75 -15.585 -12.153 -5.079 1.00 73.30 H new ATOM 0 HD22 ASN A 75 -15.083 -12.325 -3.394 1.00 73.30 H new ATOM 1147 N VAL A 76 -12.142 -13.778 -0.488 1.00 5.11 N ATOM 1148 CA VAL A 76 -11.940 -14.170 0.891 1.00 42.13 C ATOM 1149 C VAL A 76 -13.150 -14.972 1.409 1.00 33.44 C ATOM 1150 O VAL A 76 -14.233 -14.903 0.818 1.00 65.43 O ATOM 1151 CB VAL A 76 -11.668 -12.889 1.709 1.00 72.23 C ATOM 1152 CG1 VAL A 76 -10.444 -12.137 1.154 1.00 62.11 C ATOM 1153 CG2 VAL A 76 -12.887 -11.972 1.779 1.00 2.44 C ATOM 0 H VAL A 76 -12.016 -12.776 -0.630 1.00 5.11 H new ATOM 0 HA VAL A 76 -11.082 -14.835 0.990 1.00 42.13 H new ATOM 0 HB VAL A 76 -11.451 -13.202 2.730 1.00 72.23 H new ATOM 0 HG11 VAL A 76 -10.271 -11.238 1.745 1.00 62.11 H new ATOM 0 HG12 VAL A 76 -9.566 -12.781 1.207 1.00 62.11 H new ATOM 0 HG13 VAL A 76 -10.628 -11.859 0.116 1.00 62.11 H new ATOM 0 HG21 VAL A 76 -12.643 -11.086 2.365 1.00 2.44 H new ATOM 0 HG22 VAL A 76 -13.175 -11.672 0.771 1.00 2.44 H new ATOM 0 HG23 VAL A 76 -13.715 -12.502 2.250 1.00 2.44 H new ATOM 1163 N PRO A 77 -13.005 -15.697 2.526 1.00 12.35 N ATOM 1164 CA PRO A 77 -14.108 -16.336 3.227 1.00 23.05 C ATOM 1165 C PRO A 77 -15.011 -15.291 3.887 1.00 45.34 C ATOM 1166 O PRO A 77 -14.758 -14.082 3.847 1.00 22.02 O ATOM 1167 CB PRO A 77 -13.441 -17.225 4.284 1.00 5.53 C ATOM 1168 CG PRO A 77 -12.198 -16.412 4.616 1.00 11.34 C ATOM 1169 CD PRO A 77 -11.769 -15.940 3.243 1.00 54.20 C ATOM 0 HA PRO A 77 -14.745 -16.909 2.553 1.00 23.05 H new ATOM 0 HB2 PRO A 77 -14.078 -17.376 5.155 1.00 5.53 H new ATOM 0 HB3 PRO A 77 -13.194 -18.213 3.894 1.00 5.53 H new ATOM 0 HG2 PRO A 77 -12.419 -15.580 5.285 1.00 11.34 H new ATOM 0 HG3 PRO A 77 -11.431 -17.016 5.100 1.00 11.34 H new ATOM 0 HD2 PRO A 77 -11.166 -15.034 3.308 1.00 54.20 H new ATOM 0 HD3 PRO A 77 -11.162 -16.692 2.739 1.00 54.20 H new ATOM 1177 N SER A 78 -16.053 -15.775 4.557 1.00 42.42 N ATOM 1178 CA SER A 78 -17.034 -14.972 5.273 1.00 61.13 C ATOM 1179 C SER A 78 -16.400 -13.978 6.251 1.00 32.01 C ATOM 1180 O SER A 78 -16.975 -12.917 6.497 1.00 21.01 O ATOM 1181 CB SER A 78 -17.952 -15.922 6.021 1.00 4.35 C ATOM 1182 OG SER A 78 -18.377 -16.968 5.165 1.00 54.51 O ATOM 0 H SER A 78 -16.243 -16.775 4.617 1.00 42.42 H new ATOM 0 HA SER A 78 -17.582 -14.372 4.547 1.00 61.13 H new ATOM 0 HB2 SER A 78 -17.432 -16.337 6.884 1.00 4.35 H new ATOM 0 HB3 SER A 78 -18.817 -15.379 6.401 1.00 4.35 H new ATOM 0 HG SER A 78 -18.967 -17.575 5.659 1.00 54.51 H new ATOM 1188 N ASP A 79 -15.208 -14.300 6.755 1.00 30.13 N ATOM 1189 CA ASP A 79 -14.382 -13.552 7.693 1.00 32.25 C ATOM 1190 C ASP A 79 -14.329 -12.079 7.298 1.00 72.12 C ATOM 1191 O ASP A 79 -14.638 -11.204 8.106 1.00 24.44 O ATOM 1192 CB ASP A 79 -12.946 -14.120 7.719 1.00 62.21 C ATOM 1193 CG ASP A 79 -12.804 -15.618 8.022 1.00 14.34 C ATOM 1194 OD1 ASP A 79 -13.773 -16.392 7.830 1.00 10.41 O ATOM 1195 OD2 ASP A 79 -11.687 -16.065 8.359 1.00 42.54 O ATOM 0 H ASP A 79 -14.757 -15.175 6.489 1.00 30.13 H new ATOM 0 HA ASP A 79 -14.826 -13.646 8.684 1.00 32.25 H new ATOM 0 HB2 ASP A 79 -12.484 -13.923 6.751 1.00 62.21 H new ATOM 0 HB3 ASP A 79 -12.374 -13.566 8.464 1.00 62.21 H new ATOM 1200 N ASP A 80 -14.036 -11.803 6.024 1.00 50.50 N ATOM 1201 CA ASP A 80 -13.742 -10.450 5.515 1.00 45.20 C ATOM 1202 C ASP A 80 -14.613 -10.094 4.311 1.00 64.42 C ATOM 1203 O ASP A 80 -14.424 -9.060 3.660 1.00 43.30 O ATOM 1204 CB ASP A 80 -12.244 -10.270 5.198 1.00 72.04 C ATOM 1205 CG ASP A 80 -11.511 -9.445 6.253 1.00 74.40 C ATOM 1206 OD1 ASP A 80 -11.939 -8.297 6.501 1.00 73.03 O ATOM 1207 OD2 ASP A 80 -10.473 -9.933 6.756 1.00 52.54 O ATOM 0 H ASP A 80 -13.994 -12.522 5.301 1.00 50.50 H new ATOM 0 HA ASP A 80 -13.991 -9.751 6.314 1.00 45.20 H new ATOM 0 HB2 ASP A 80 -11.774 -11.250 5.119 1.00 72.04 H new ATOM 0 HB3 ASP A 80 -12.138 -9.786 4.227 1.00 72.04 H new ATOM 1212 N PHE A 81 -15.593 -10.946 3.997 1.00 73.01 N ATOM 1213 CA PHE A 81 -16.447 -10.796 2.828 1.00 41.40 C ATOM 1214 C PHE A 81 -17.207 -9.460 2.866 1.00 73.11 C ATOM 1215 O PHE A 81 -17.587 -8.915 1.827 1.00 52.22 O ATOM 1216 CB PHE A 81 -17.454 -11.952 2.778 1.00 13.42 C ATOM 1217 CG PHE A 81 -17.649 -12.499 1.384 1.00 13.31 C ATOM 1218 CD1 PHE A 81 -18.319 -11.749 0.398 1.00 32.44 C ATOM 1219 CD2 PHE A 81 -17.089 -13.743 1.054 1.00 14.11 C ATOM 1220 CE1 PHE A 81 -18.404 -12.238 -0.916 1.00 51.22 C ATOM 1221 CE2 PHE A 81 -17.173 -14.227 -0.257 1.00 52.14 C ATOM 1222 CZ PHE A 81 -17.836 -13.481 -1.245 1.00 74.42 C ATOM 0 H PHE A 81 -15.814 -11.768 4.559 1.00 73.01 H new ATOM 0 HA PHE A 81 -15.816 -10.810 1.939 1.00 41.40 H new ATOM 0 HB2 PHE A 81 -17.113 -12.753 3.433 1.00 13.42 H new ATOM 0 HB3 PHE A 81 -18.413 -11.609 3.166 1.00 13.42 H new ATOM 0 HD1 PHE A 81 -18.767 -10.799 0.652 1.00 32.44 H new ATOM 0 HD2 PHE A 81 -16.592 -14.328 1.813 1.00 14.11 H new ATOM 0 HE1 PHE A 81 -18.907 -11.658 -1.675 1.00 51.22 H new ATOM 0 HE2 PHE A 81 -16.726 -15.177 -0.509 1.00 52.14 H new ATOM 0 HZ PHE A 81 -17.909 -13.861 -2.253 1.00 74.42 H new ATOM 1232 N ASN A 82 -17.480 -8.951 4.071 1.00 62.23 N ATOM 1233 CA ASN A 82 -18.360 -7.820 4.347 1.00 14.34 C ATOM 1234 C ASN A 82 -17.569 -6.590 4.787 1.00 54.22 C ATOM 1235 O ASN A 82 -18.165 -5.595 5.208 1.00 24.12 O ATOM 1236 CB ASN A 82 -19.403 -8.239 5.399 1.00 30.25 C ATOM 1237 CG ASN A 82 -20.346 -9.297 4.847 1.00 53.43 C ATOM 1238 OD1 ASN A 82 -20.986 -9.072 3.823 1.00 53.42 O ATOM 1239 ND2 ASN A 82 -20.432 -10.470 5.445 1.00 4.14 N ATOM 0 H ASN A 82 -17.071 -9.339 4.921 1.00 62.23 H new ATOM 0 HA ASN A 82 -18.879 -7.537 3.431 1.00 14.34 H new ATOM 0 HB2 ASN A 82 -18.896 -8.625 6.283 1.00 30.25 H new ATOM 0 HB3 ASN A 82 -19.975 -7.367 5.715 1.00 30.25 H new ATOM 0 HD21 ASN A 82 -21.033 -11.197 5.057 1.00 4.14 H new ATOM 0 HD22 ASN A 82 -19.898 -10.650 6.295 1.00 4.14 H new ATOM 1246 N THR A 83 -16.239 -6.637 4.729 1.00 45.23 N ATOM 1247 CA THR A 83 -15.414 -5.579 5.274 1.00 70.30 C ATOM 1248 C THR A 83 -15.447 -4.336 4.377 1.00 63.41 C ATOM 1249 O THR A 83 -15.381 -4.389 3.140 1.00 4.24 O ATOM 1250 CB THR A 83 -14.020 -6.152 5.552 1.00 70.31 C ATOM 1251 OG1 THR A 83 -14.195 -7.182 6.498 1.00 24.35 O ATOM 1252 CG2 THR A 83 -13.073 -5.107 6.140 1.00 13.35 C ATOM 0 H THR A 83 -15.715 -7.403 4.306 1.00 45.23 H new ATOM 0 HA THR A 83 -15.803 -5.220 6.227 1.00 70.30 H new ATOM 0 HB THR A 83 -13.578 -6.501 4.619 1.00 70.31 H new ATOM 0 HG1 THR A 83 -13.342 -7.643 6.641 1.00 24.35 H new ATOM 0 HG21 THR A 83 -12.098 -5.560 6.320 1.00 13.35 H new ATOM 0 HG22 THR A 83 -12.965 -4.279 5.440 1.00 13.35 H new ATOM 0 HG23 THR A 83 -13.480 -4.736 7.081 1.00 13.35 H new ATOM 1260 N THR A 84 -15.540 -3.186 5.028 1.00 10.22 N ATOM 1261 CA THR A 84 -15.568 -1.857 4.451 1.00 1.22 C ATOM 1262 C THR A 84 -14.636 -0.959 5.266 1.00 25.14 C ATOM 1263 O THR A 84 -14.243 -1.331 6.375 1.00 33.35 O ATOM 1264 CB THR A 84 -17.018 -1.340 4.443 1.00 51.41 C ATOM 1265 OG1 THR A 84 -17.710 -1.648 5.640 1.00 70.11 O ATOM 1266 CG2 THR A 84 -17.768 -1.983 3.287 1.00 63.13 C ATOM 0 H THR A 84 -15.602 -3.159 6.046 1.00 10.22 H new ATOM 0 HA THR A 84 -15.219 -1.864 3.419 1.00 1.22 H new ATOM 0 HB THR A 84 -16.974 -0.255 4.343 1.00 51.41 H new ATOM 0 HG1 THR A 84 -18.624 -1.299 5.589 1.00 70.11 H new ATOM 0 HG21 THR A 84 -18.796 -1.622 3.275 1.00 63.13 H new ATOM 0 HG22 THR A 84 -17.281 -1.723 2.347 1.00 63.13 H new ATOM 0 HG23 THR A 84 -17.765 -3.066 3.409 1.00 63.13 H new ATOM 1274 N VAL A 85 -14.269 0.200 4.722 1.00 41.14 N ATOM 1275 CA VAL A 85 -13.356 1.126 5.379 1.00 41.13 C ATOM 1276 C VAL A 85 -13.792 2.568 5.135 1.00 13.53 C ATOM 1277 O VAL A 85 -14.208 2.933 4.032 1.00 44.30 O ATOM 1278 CB VAL A 85 -11.906 0.910 4.894 1.00 23.41 C ATOM 1279 CG1 VAL A 85 -11.201 -0.211 5.657 1.00 25.03 C ATOM 1280 CG2 VAL A 85 -11.765 0.652 3.381 1.00 31.21 C ATOM 0 H VAL A 85 -14.598 0.521 3.812 1.00 41.14 H new ATOM 0 HA VAL A 85 -13.387 0.930 6.451 1.00 41.13 H new ATOM 0 HB VAL A 85 -11.422 1.864 5.105 1.00 23.41 H new ATOM 0 HG11 VAL A 85 -10.185 -0.325 5.280 1.00 25.03 H new ATOM 0 HG12 VAL A 85 -11.169 0.036 6.718 1.00 25.03 H new ATOM 0 HG13 VAL A 85 -11.746 -1.145 5.518 1.00 25.03 H new ATOM 0 HG21 VAL A 85 -10.713 0.512 3.132 1.00 31.21 H new ATOM 0 HG22 VAL A 85 -12.324 -0.244 3.111 1.00 31.21 H new ATOM 0 HG23 VAL A 85 -12.158 1.505 2.828 1.00 31.21 H new ATOM 1290 N SER A 86 -13.643 3.432 6.138 1.00 63.10 N ATOM 1291 CA SER A 86 -13.625 4.859 5.905 1.00 53.13 C ATOM 1292 C SER A 86 -12.418 5.185 5.026 1.00 44.20 C ATOM 1293 O SER A 86 -11.295 4.759 5.310 1.00 31.13 O ATOM 1294 CB SER A 86 -13.615 5.595 7.243 1.00 42.12 C ATOM 1295 OG SER A 86 -14.943 5.746 7.699 1.00 54.22 O ATOM 0 H SER A 86 -13.534 3.161 7.115 1.00 63.10 H new ATOM 0 HA SER A 86 -14.519 5.192 5.378 1.00 53.13 H new ATOM 0 HB2 SER A 86 -13.028 5.038 7.974 1.00 42.12 H new ATOM 0 HB3 SER A 86 -13.143 6.571 7.131 1.00 42.12 H new ATOM 0 HG SER A 86 -14.942 6.216 8.559 1.00 54.22 H new ATOM 1301 N GLY A 87 -12.651 5.914 3.932 1.00 65.43 N ATOM 1302 CA GLY A 87 -11.616 6.237 2.967 1.00 51.13 C ATOM 1303 C GLY A 87 -10.528 7.078 3.623 1.00 70.10 C ATOM 1304 O GLY A 87 -9.351 6.862 3.344 1.00 50.22 O ATOM 0 H GLY A 87 -13.568 6.294 3.697 1.00 65.43 H new ATOM 0 HA2 GLY A 87 -11.184 5.320 2.565 1.00 51.13 H new ATOM 0 HA3 GLY A 87 -12.049 6.780 2.127 1.00 51.13 H new ATOM 1308 N GLU A 88 -10.921 7.999 4.503 1.00 4.21 N ATOM 1309 CA GLU A 88 -10.021 8.809 5.309 1.00 52.11 C ATOM 1310 C GLU A 88 -9.199 7.901 6.222 1.00 41.14 C ATOM 1311 O GLU A 88 -7.976 7.917 6.164 1.00 2.14 O ATOM 1312 CB GLU A 88 -10.874 9.815 6.096 1.00 4.32 C ATOM 1313 CG GLU A 88 -10.060 10.833 6.893 1.00 1.41 C ATOM 1314 CD GLU A 88 -10.765 11.487 8.076 1.00 1.24 C ATOM 1315 OE1 GLU A 88 -11.995 11.353 8.229 1.00 12.45 O ATOM 1316 OE2 GLU A 88 -10.052 12.238 8.784 1.00 10.23 O ATOM 0 H GLU A 88 -11.905 8.205 4.676 1.00 4.21 H new ATOM 0 HA GLU A 88 -9.313 9.361 4.691 1.00 52.11 H new ATOM 0 HB2 GLU A 88 -11.522 10.348 5.400 1.00 4.32 H new ATOM 0 HB3 GLU A 88 -11.523 9.268 6.780 1.00 4.32 H new ATOM 0 HG2 GLU A 88 -9.161 10.339 7.262 1.00 1.41 H new ATOM 0 HG3 GLU A 88 -9.735 11.619 6.212 1.00 1.41 H new ATOM 1323 N ASP A 89 -9.860 7.074 7.026 1.00 34.11 N ATOM 1324 CA ASP A 89 -9.226 6.221 8.036 1.00 43.41 C ATOM 1325 C ASP A 89 -8.263 5.211 7.412 1.00 43.50 C ATOM 1326 O ASP A 89 -7.276 4.813 8.021 1.00 25.44 O ATOM 1327 CB ASP A 89 -10.339 5.477 8.775 1.00 34.43 C ATOM 1328 CG ASP A 89 -9.938 5.022 10.173 1.00 14.32 C ATOM 1329 OD1 ASP A 89 -9.733 5.912 11.032 1.00 5.41 O ATOM 1330 OD2 ASP A 89 -10.037 3.807 10.457 1.00 23.25 O ATOM 0 H ASP A 89 -10.875 6.973 6.996 1.00 34.11 H new ATOM 0 HA ASP A 89 -8.641 6.844 8.713 1.00 43.41 H new ATOM 0 HB2 ASP A 89 -11.212 6.125 8.848 1.00 34.43 H new ATOM 0 HB3 ASP A 89 -10.636 4.607 8.189 1.00 34.43 H new ATOM 1335 N SER A 90 -8.524 4.830 6.158 1.00 10.52 N ATOM 1336 CA SER A 90 -7.621 4.007 5.359 1.00 14.34 C ATOM 1337 C SER A 90 -6.266 4.700 5.147 1.00 34.15 C ATOM 1338 O SER A 90 -5.234 4.042 5.068 1.00 44.33 O ATOM 1339 CB SER A 90 -8.224 3.725 3.980 1.00 34.11 C ATOM 1340 OG SER A 90 -9.504 3.136 4.060 1.00 2.15 O ATOM 0 H SER A 90 -9.379 5.089 5.666 1.00 10.52 H new ATOM 0 HA SER A 90 -7.475 3.077 5.909 1.00 14.34 H new ATOM 0 HB2 SER A 90 -8.291 4.657 3.419 1.00 34.11 H new ATOM 0 HB3 SER A 90 -7.558 3.065 3.424 1.00 34.11 H new ATOM 0 HG SER A 90 -10.136 3.779 4.444 1.00 2.15 H new ATOM 1346 N TRP A 91 -6.268 6.021 4.972 1.00 61.32 N ATOM 1347 CA TRP A 91 -5.085 6.807 4.656 1.00 72.30 C ATOM 1348 C TRP A 91 -4.248 7.050 5.905 1.00 64.02 C ATOM 1349 O TRP A 91 -3.019 7.018 5.828 1.00 10.23 O ATOM 1350 CB TRP A 91 -5.557 8.125 4.035 1.00 52.44 C ATOM 1351 CG TRP A 91 -4.510 9.099 3.617 1.00 65.05 C ATOM 1352 CD1 TRP A 91 -3.985 9.234 2.378 1.00 4.30 C ATOM 1353 CD2 TRP A 91 -3.896 10.133 4.437 1.00 14.41 C ATOM 1354 NE1 TRP A 91 -3.094 10.286 2.368 1.00 4.44 N ATOM 1355 CE2 TRP A 91 -3.010 10.881 3.613 1.00 25.12 C ATOM 1356 CE3 TRP A 91 -4.007 10.514 5.794 1.00 4.24 C ATOM 1357 CZ2 TRP A 91 -2.265 11.947 4.126 1.00 23.23 C ATOM 1358 CZ3 TRP A 91 -3.262 11.592 6.310 1.00 23.42 C ATOM 1359 CH2 TRP A 91 -2.396 12.310 5.473 1.00 11.44 C ATOM 0 H TRP A 91 -7.115 6.584 5.049 1.00 61.32 H new ATOM 0 HA TRP A 91 -4.448 6.272 3.952 1.00 72.30 H new ATOM 0 HB2 TRP A 91 -6.164 7.887 3.162 1.00 52.44 H new ATOM 0 HB3 TRP A 91 -6.211 8.620 4.753 1.00 52.44 H new ATOM 0 HD1 TRP A 91 -4.226 8.613 1.528 1.00 4.30 H new ATOM 0 HE1 TRP A 91 -2.566 10.586 1.549 1.00 4.44 H new ATOM 0 HE3 TRP A 91 -4.674 9.969 6.446 1.00 4.24 H new ATOM 0 HZ2 TRP A 91 -1.588 12.491 3.484 1.00 23.23 H new ATOM 0 HZ3 TRP A 91 -3.358 11.866 7.350 1.00 23.42 H new ATOM 0 HH2 TRP A 91 -1.831 13.142 5.866 1.00 11.44 H new ATOM 1370 N LYS A 92 -4.897 7.296 7.047 1.00 31.43 N ATOM 1371 CA LYS A 92 -4.276 7.587 8.324 1.00 23.04 C ATOM 1372 C LYS A 92 -3.160 6.594 8.649 1.00 30.42 C ATOM 1373 O LYS A 92 -1.983 6.948 8.587 1.00 44.44 O ATOM 1374 CB LYS A 92 -5.368 7.567 9.408 1.00 11.14 C ATOM 1375 CG LYS A 92 -5.902 8.970 9.655 1.00 73.30 C ATOM 1376 CD LYS A 92 -6.884 9.540 8.644 1.00 41.12 C ATOM 1377 CE LYS A 92 -6.752 11.062 8.667 1.00 3.43 C ATOM 1378 NZ LYS A 92 -7.494 11.715 9.768 1.00 12.42 N ATOM 0 H LYS A 92 -5.916 7.296 7.099 1.00 31.43 H new ATOM 0 HA LYS A 92 -3.811 8.572 8.283 1.00 23.04 H new ATOM 0 HB2 LYS A 92 -6.182 6.911 9.100 1.00 11.14 H new ATOM 0 HB3 LYS A 92 -4.962 7.158 10.333 1.00 11.14 H new ATOM 0 HG2 LYS A 92 -6.384 8.978 10.632 1.00 73.30 H new ATOM 0 HG3 LYS A 92 -5.050 9.648 9.714 1.00 73.30 H new ATOM 0 HD2 LYS A 92 -6.672 9.154 7.647 1.00 41.12 H new ATOM 0 HD3 LYS A 92 -7.903 9.242 8.892 1.00 41.12 H new ATOM 0 HE2 LYS A 92 -5.697 11.323 8.749 1.00 3.43 H new ATOM 0 HE3 LYS A 92 -7.107 11.461 7.717 1.00 3.43 H new ATOM 0 HZ1 LYS A 92 -7.162 12.695 9.877 1.00 12.42 H new ATOM 0 HZ2 LYS A 92 -8.511 11.716 9.549 1.00 12.42 H new ATOM 0 HZ3 LYS A 92 -7.331 11.194 10.653 1.00 12.42 H new ATOM 1392 N THR A 93 -3.527 5.357 8.973 1.00 30.45 N ATOM 1393 CA THR A 93 -2.605 4.326 9.421 1.00 70.00 C ATOM 1394 C THR A 93 -1.550 4.095 8.332 1.00 43.53 C ATOM 1395 O THR A 93 -0.349 4.220 8.575 1.00 62.31 O ATOM 1396 CB THR A 93 -3.398 3.044 9.746 1.00 34.45 C ATOM 1397 OG1 THR A 93 -4.787 3.289 9.947 1.00 31.04 O ATOM 1398 CG2 THR A 93 -2.825 2.314 10.955 1.00 21.13 C ATOM 0 H THR A 93 -4.496 5.040 8.929 1.00 30.45 H new ATOM 0 HA THR A 93 -2.087 4.633 10.329 1.00 70.00 H new ATOM 0 HB THR A 93 -3.295 2.407 8.867 1.00 34.45 H new ATOM 0 HG1 THR A 93 -5.182 2.544 10.447 1.00 31.04 H new ATOM 0 HG21 THR A 93 -3.412 1.417 11.150 1.00 21.13 H new ATOM 0 HG22 THR A 93 -1.791 2.034 10.755 1.00 21.13 H new ATOM 0 HG23 THR A 93 -2.862 2.968 11.826 1.00 21.13 H new ATOM 1406 N LEU A 94 -2.002 3.835 7.099 1.00 21.42 N ATOM 1407 CA LEU A 94 -1.191 3.601 5.913 1.00 65.35 C ATOM 1408 C LEU A 94 -0.065 4.619 5.756 1.00 73.22 C ATOM 1409 O LEU A 94 1.033 4.204 5.384 1.00 2.44 O ATOM 1410 CB LEU A 94 -2.171 3.602 4.722 1.00 45.53 C ATOM 1411 CG LEU A 94 -1.641 3.454 3.281 1.00 65.43 C ATOM 1412 CD1 LEU A 94 -2.816 3.052 2.379 1.00 70.10 C ATOM 1413 CD2 LEU A 94 -1.041 4.744 2.699 1.00 2.11 C ATOM 0 H LEU A 94 -3.001 3.781 6.898 1.00 21.42 H new ATOM 0 HA LEU A 94 -0.668 2.647 5.982 1.00 65.35 H new ATOM 0 HB2 LEU A 94 -2.883 2.794 4.889 1.00 45.53 H new ATOM 0 HB3 LEU A 94 -2.732 4.536 4.766 1.00 45.53 H new ATOM 0 HG LEU A 94 -0.846 2.709 3.316 1.00 65.43 H new ATOM 0 HD11 LEU A 94 -2.466 2.941 1.353 1.00 70.10 H new ATOM 0 HD12 LEU A 94 -3.233 2.106 2.724 1.00 70.10 H new ATOM 0 HD13 LEU A 94 -3.585 3.823 2.418 1.00 70.10 H new ATOM 0 HD21 LEU A 94 -0.691 4.557 1.684 1.00 2.11 H new ATOM 0 HD22 LEU A 94 -1.802 5.524 2.683 1.00 2.11 H new ATOM 0 HD23 LEU A 94 -0.204 5.067 3.317 1.00 2.11 H new ATOM 1425 N THR A 95 -0.303 5.908 6.010 1.00 33.01 N ATOM 1426 CA THR A 95 0.739 6.922 5.893 1.00 13.40 C ATOM 1427 C THR A 95 1.660 6.930 7.114 1.00 21.44 C ATOM 1428 O THR A 95 2.886 6.918 6.949 1.00 23.11 O ATOM 1429 CB THR A 95 0.135 8.310 5.627 1.00 24.44 C ATOM 1430 OG1 THR A 95 -0.924 8.632 6.508 1.00 11.22 O ATOM 1431 CG2 THR A 95 -0.374 8.402 4.188 1.00 64.04 C ATOM 0 H THR A 95 -1.211 6.271 6.298 1.00 33.01 H new ATOM 0 HA THR A 95 1.355 6.662 5.032 1.00 13.40 H new ATOM 0 HB THR A 95 0.938 9.028 5.796 1.00 24.44 H new ATOM 0 HG1 THR A 95 -1.732 8.146 6.240 1.00 11.22 H new ATOM 0 HG21 THR A 95 -0.799 9.391 4.015 1.00 64.04 H new ATOM 0 HG22 THR A 95 0.454 8.237 3.498 1.00 64.04 H new ATOM 0 HG23 THR A 95 -1.140 7.644 4.024 1.00 64.04 H new ATOM 1439 N SER A 96 1.105 6.907 8.333 1.00 2.50 N ATOM 1440 CA SER A 96 1.880 6.955 9.558 1.00 2.40 C ATOM 1441 C SER A 96 2.885 5.797 9.612 1.00 72.24 C ATOM 1442 O SER A 96 4.051 5.981 9.976 1.00 11.51 O ATOM 1443 CB SER A 96 0.900 6.966 10.742 1.00 23.42 C ATOM 1444 OG SER A 96 1.059 8.162 11.481 1.00 13.34 O ATOM 0 H SER A 96 0.098 6.854 8.487 1.00 2.50 H new ATOM 0 HA SER A 96 2.481 7.863 9.603 1.00 2.40 H new ATOM 0 HB2 SER A 96 -0.125 6.885 10.379 1.00 23.42 H new ATOM 0 HB3 SER A 96 1.080 6.104 11.384 1.00 23.42 H new ATOM 0 HG SER A 96 0.432 8.167 12.234 1.00 13.34 H new ATOM 1450 N LYS A 97 2.482 4.617 9.135 1.00 1.11 N ATOM 1451 CA LYS A 97 3.318 3.425 9.077 1.00 50.32 C ATOM 1452 C LYS A 97 4.533 3.543 8.154 1.00 53.13 C ATOM 1453 O LYS A 97 5.409 2.677 8.228 1.00 72.43 O ATOM 1454 CB LYS A 97 2.427 2.231 8.686 1.00 21.12 C ATOM 1455 CG LYS A 97 1.460 1.794 9.801 1.00 32.12 C ATOM 1456 CD LYS A 97 2.121 1.410 11.129 1.00 32.23 C ATOM 1457 CE LYS A 97 3.025 0.188 10.988 1.00 42.12 C ATOM 1458 NZ LYS A 97 3.717 -0.132 12.251 1.00 62.35 N ATOM 0 H LYS A 97 1.542 4.465 8.771 1.00 1.11 H new ATOM 0 HA LYS A 97 3.752 3.280 10.066 1.00 50.32 H new ATOM 0 HB2 LYS A 97 1.851 2.493 7.799 1.00 21.12 H new ATOM 0 HB3 LYS A 97 3.062 1.387 8.416 1.00 21.12 H new ATOM 0 HG2 LYS A 97 0.755 2.605 9.986 1.00 32.12 H new ATOM 0 HG3 LYS A 97 0.880 0.943 9.443 1.00 32.12 H new ATOM 0 HD2 LYS A 97 2.706 2.252 11.499 1.00 32.23 H new ATOM 0 HD3 LYS A 97 1.350 1.206 11.872 1.00 32.23 H new ATOM 0 HE2 LYS A 97 2.430 -0.669 10.672 1.00 42.12 H new ATOM 0 HE3 LYS A 97 3.762 0.370 10.206 1.00 42.12 H new ATOM 0 HZ1 LYS A 97 4.185 -1.057 12.166 1.00 62.35 H new ATOM 0 HZ2 LYS A 97 4.429 0.599 12.452 1.00 62.35 H new ATOM 0 HZ3 LYS A 97 3.026 -0.164 13.027 1.00 62.35 H new ATOM 1472 N LEU A 98 4.635 4.564 7.301 1.00 53.12 N ATOM 1473 CA LEU A 98 5.755 4.723 6.371 1.00 61.25 C ATOM 1474 C LEU A 98 6.802 5.682 6.910 1.00 50.41 C ATOM 1475 O LEU A 98 8.000 5.421 6.774 1.00 10.14 O ATOM 1476 CB LEU A 98 5.261 5.247 5.018 1.00 32.12 C ATOM 1477 CG LEU A 98 4.297 4.289 4.306 1.00 53.02 C ATOM 1478 CD1 LEU A 98 3.714 5.007 3.088 1.00 45.03 C ATOM 1479 CD2 LEU A 98 4.986 2.973 3.921 1.00 3.02 C ATOM 0 H LEU A 98 3.940 5.307 7.235 1.00 53.12 H new ATOM 0 HA LEU A 98 6.208 3.739 6.249 1.00 61.25 H new ATOM 0 HB2 LEU A 98 4.764 6.205 5.168 1.00 32.12 H new ATOM 0 HB3 LEU A 98 6.120 5.431 4.373 1.00 32.12 H new ATOM 0 HG LEU A 98 3.488 4.015 4.983 1.00 53.02 H new ATOM 0 HD11 LEU A 98 3.025 4.341 2.568 1.00 45.03 H new ATOM 0 HD12 LEU A 98 3.180 5.900 3.413 1.00 45.03 H new ATOM 0 HD13 LEU A 98 4.521 5.293 2.413 1.00 45.03 H new ATOM 0 HD21 LEU A 98 4.271 2.321 3.419 1.00 3.02 H new ATOM 0 HD22 LEU A 98 5.820 3.181 3.251 1.00 3.02 H new ATOM 0 HD23 LEU A 98 5.357 2.480 4.820 1.00 3.02 H new ATOM 1491 N LYS A 99 6.372 6.792 7.521 1.00 41.42 N ATOM 1492 CA LYS A 99 7.293 7.808 8.032 1.00 32.30 C ATOM 1493 C LYS A 99 8.213 7.186 9.084 1.00 21.02 C ATOM 1494 O LYS A 99 9.380 7.557 9.161 1.00 24.33 O ATOM 1495 CB LYS A 99 6.486 9.000 8.571 1.00 44.52 C ATOM 1496 CG LYS A 99 7.336 10.197 9.029 1.00 22.00 C ATOM 1497 CD LYS A 99 7.776 11.108 7.874 1.00 54.33 C ATOM 1498 CE LYS A 99 8.739 12.166 8.426 1.00 34.31 C ATOM 1499 NZ LYS A 99 8.760 13.428 7.657 1.00 44.12 N ATOM 0 H LYS A 99 5.387 7.008 7.673 1.00 41.42 H new ATOM 0 HA LYS A 99 7.933 8.185 7.234 1.00 32.30 H new ATOM 0 HB2 LYS A 99 5.798 9.336 7.795 1.00 44.52 H new ATOM 0 HB3 LYS A 99 5.879 8.661 9.410 1.00 44.52 H new ATOM 0 HG2 LYS A 99 6.766 10.784 9.749 1.00 22.00 H new ATOM 0 HG3 LYS A 99 8.220 9.828 9.548 1.00 22.00 H new ATOM 0 HD2 LYS A 99 8.264 10.522 7.095 1.00 54.33 H new ATOM 0 HD3 LYS A 99 6.909 11.586 7.418 1.00 54.33 H new ATOM 0 HE2 LYS A 99 8.465 12.387 9.458 1.00 34.31 H new ATOM 0 HE3 LYS A 99 9.746 11.749 8.446 1.00 34.31 H new ATOM 0 HZ1 LYS A 99 9.226 14.169 8.219 1.00 44.12 H new ATOM 0 HZ2 LYS A 99 9.284 13.285 6.770 1.00 44.12 H new ATOM 0 HZ3 LYS A 99 7.785 13.719 7.440 1.00 44.12 H new ATOM 1513 N GLU A 100 7.734 6.163 9.798 1.00 64.05 N ATOM 1514 CA GLU A 100 8.505 5.319 10.709 1.00 51.54 C ATOM 1515 C GLU A 100 9.848 4.909 10.092 1.00 3.14 C ATOM 1516 O GLU A 100 10.925 5.360 10.493 1.00 74.41 O ATOM 1517 CB GLU A 100 7.725 4.052 11.049 1.00 32.03 C ATOM 1518 CG GLU A 100 6.481 4.234 11.918 1.00 41.32 C ATOM 1519 CD GLU A 100 6.249 2.972 12.755 1.00 4.24 C ATOM 1520 OE1 GLU A 100 6.933 2.864 13.804 1.00 11.42 O ATOM 1521 OE2 GLU A 100 5.475 2.083 12.321 1.00 2.12 O ATOM 0 H GLU A 100 6.752 5.890 9.753 1.00 64.05 H new ATOM 0 HA GLU A 100 8.688 5.903 11.611 1.00 51.54 H new ATOM 0 HB2 GLU A 100 7.424 3.575 10.116 1.00 32.03 H new ATOM 0 HB3 GLU A 100 8.399 3.362 11.557 1.00 32.03 H new ATOM 0 HG2 GLU A 100 6.605 5.098 12.571 1.00 41.32 H new ATOM 0 HG3 GLU A 100 5.612 4.431 11.290 1.00 41.32 H new ATOM 1528 N LYS A 101 9.769 4.045 9.081 1.00 34.00 N ATOM 1529 CA LYS A 101 10.898 3.376 8.462 1.00 52.25 C ATOM 1530 C LYS A 101 11.634 4.290 7.483 1.00 51.25 C ATOM 1531 O LYS A 101 12.481 3.801 6.733 1.00 72.52 O ATOM 1532 CB LYS A 101 10.390 2.073 7.817 1.00 25.21 C ATOM 1533 CG LYS A 101 9.933 1.032 8.858 1.00 72.51 C ATOM 1534 CD LYS A 101 11.101 0.563 9.741 1.00 63.41 C ATOM 1535 CE LYS A 101 10.770 -0.750 10.453 1.00 33.24 C ATOM 1536 NZ LYS A 101 11.889 -1.227 11.294 1.00 41.21 N ATOM 0 H LYS A 101 8.878 3.786 8.658 1.00 34.00 H new ATOM 0 HA LYS A 101 11.644 3.122 9.215 1.00 52.25 H new ATOM 0 HB2 LYS A 101 9.559 2.303 7.150 1.00 25.21 H new ATOM 0 HB3 LYS A 101 11.182 1.644 7.203 1.00 25.21 H new ATOM 0 HG2 LYS A 101 9.152 1.462 9.485 1.00 72.51 H new ATOM 0 HG3 LYS A 101 9.495 0.174 8.347 1.00 72.51 H new ATOM 0 HD2 LYS A 101 11.993 0.432 9.128 1.00 63.41 H new ATOM 0 HD3 LYS A 101 11.332 1.331 10.479 1.00 63.41 H new ATOM 0 HE2 LYS A 101 9.885 -0.612 11.074 1.00 33.24 H new ATOM 0 HE3 LYS A 101 10.524 -1.511 9.712 1.00 33.24 H new ATOM 0 HZ1 LYS A 101 11.620 -2.119 11.757 1.00 41.21 H new ATOM 0 HZ2 LYS A 101 12.727 -1.385 10.699 1.00 41.21 H new ATOM 0 HZ3 LYS A 101 12.108 -0.513 12.018 1.00 41.21 H new ATOM 1550 N GLY A 102 11.333 5.592 7.468 1.00 12.12 N ATOM 1551 CA GLY A 102 11.967 6.554 6.588 1.00 51.12 C ATOM 1552 C GLY A 102 11.551 6.315 5.141 1.00 2.02 C ATOM 1553 O GLY A 102 12.417 6.286 4.266 1.00 31.13 O ATOM 0 H GLY A 102 10.629 6.005 8.080 1.00 12.12 H new ATOM 0 HA2 GLY A 102 11.693 7.565 6.888 1.00 51.12 H new ATOM 0 HA3 GLY A 102 13.051 6.478 6.678 1.00 51.12 H new ATOM 1557 N LEU A 103 10.253 6.083 4.897 1.00 24.20 N ATOM 1558 CA LEU A 103 9.703 5.684 3.598 1.00 5.10 C ATOM 1559 C LEU A 103 8.685 6.694 3.053 1.00 34.44 C ATOM 1560 O LEU A 103 7.899 6.344 2.179 1.00 53.32 O ATOM 1561 CB LEU A 103 9.094 4.268 3.672 1.00 21.13 C ATOM 1562 CG LEU A 103 10.077 3.136 4.020 1.00 14.24 C ATOM 1563 CD1 LEU A 103 9.318 1.807 4.077 1.00 44.02 C ATOM 1564 CD2 LEU A 103 11.217 3.008 3.003 1.00 51.35 C ATOM 0 H LEU A 103 9.539 6.171 5.620 1.00 24.20 H new ATOM 0 HA LEU A 103 10.535 5.668 2.893 1.00 5.10 H new ATOM 0 HB2 LEU A 103 8.297 4.274 4.416 1.00 21.13 H new ATOM 0 HB3 LEU A 103 8.632 4.041 2.711 1.00 21.13 H new ATOM 0 HG LEU A 103 10.520 3.380 4.986 1.00 14.24 H new ATOM 0 HD11 LEU A 103 10.011 1.003 4.323 1.00 44.02 H new ATOM 0 HD12 LEU A 103 8.542 1.864 4.840 1.00 44.02 H new ATOM 0 HD13 LEU A 103 8.860 1.608 3.108 1.00 44.02 H new ATOM 0 HD21 LEU A 103 11.879 2.194 3.299 1.00 51.35 H new ATOM 0 HD22 LEU A 103 10.803 2.798 2.017 1.00 51.35 H new ATOM 0 HD23 LEU A 103 11.781 3.940 2.969 1.00 51.35 H new ATOM 1576 N VAL A 104 8.677 7.932 3.543 1.00 73.12 N ATOM 1577 CA VAL A 104 8.020 9.059 2.883 1.00 10.12 C ATOM 1578 C VAL A 104 8.795 10.328 3.233 1.00 45.21 C ATOM 1579 O VAL A 104 9.537 10.354 4.224 1.00 10.24 O ATOM 1580 CB VAL A 104 6.533 9.219 3.284 1.00 41.02 C ATOM 1581 CG1 VAL A 104 5.574 8.260 2.573 1.00 14.21 C ATOM 1582 CG2 VAL A 104 6.302 9.104 4.796 1.00 33.33 C ATOM 0 H VAL A 104 9.132 8.184 4.420 1.00 73.12 H new ATOM 0 HA VAL A 104 8.024 8.872 1.809 1.00 10.12 H new ATOM 0 HB VAL A 104 6.302 10.232 2.954 1.00 41.02 H new ATOM 0 HG11 VAL A 104 4.556 8.444 2.915 1.00 14.21 H new ATOM 0 HG12 VAL A 104 5.630 8.421 1.496 1.00 14.21 H new ATOM 0 HG13 VAL A 104 5.853 7.231 2.800 1.00 14.21 H new ATOM 0 HG21 VAL A 104 5.241 9.225 5.012 1.00 33.33 H new ATOM 0 HG22 VAL A 104 6.633 8.125 5.141 1.00 33.33 H new ATOM 0 HG23 VAL A 104 6.868 9.881 5.311 1.00 33.33 H new ATOM 1592 N THR A 105 8.569 11.402 2.484 1.00 3.33 N ATOM 1593 CA THR A 105 9.079 12.724 2.801 1.00 61.42 C ATOM 1594 C THR A 105 7.961 13.551 3.419 1.00 43.01 C ATOM 1595 O THR A 105 6.789 13.344 3.106 1.00 4.22 O ATOM 1596 CB THR A 105 9.614 13.392 1.524 1.00 14.24 C ATOM 1597 OG1 THR A 105 8.605 13.580 0.549 1.00 45.05 O ATOM 1598 CG2 THR A 105 10.711 12.548 0.881 1.00 24.31 C ATOM 0 H THR A 105 8.017 11.374 1.627 1.00 3.33 H new ATOM 0 HA THR A 105 9.899 12.649 3.515 1.00 61.42 H new ATOM 0 HB THR A 105 10.001 14.360 1.840 1.00 14.24 H new ATOM 0 HG1 THR A 105 8.991 14.008 -0.243 1.00 45.05 H new ATOM 0 HG21 THR A 105 11.071 13.044 -0.020 1.00 24.31 H new ATOM 0 HG22 THR A 105 11.536 12.428 1.583 1.00 24.31 H new ATOM 0 HG23 THR A 105 10.311 11.568 0.620 1.00 24.31 H new ATOM 1606 N ASP A 106 8.322 14.571 4.193 1.00 13.04 N ATOM 1607 CA ASP A 106 7.450 15.697 4.505 1.00 24.43 C ATOM 1608 C ASP A 106 6.811 16.189 3.207 1.00 34.41 C ATOM 1609 O ASP A 106 7.499 16.306 2.188 1.00 43.33 O ATOM 1610 CB ASP A 106 8.278 16.854 5.087 1.00 4.32 C ATOM 1611 CG ASP A 106 8.451 16.848 6.596 1.00 30.21 C ATOM 1612 OD1 ASP A 106 9.291 16.069 7.101 1.00 63.55 O ATOM 1613 OD2 ASP A 106 7.819 17.700 7.260 1.00 73.41 O ATOM 0 H ASP A 106 9.243 14.638 4.627 1.00 13.04 H new ATOM 0 HA ASP A 106 6.695 15.379 5.224 1.00 24.43 H new ATOM 0 HB2 ASP A 106 9.266 16.837 4.627 1.00 4.32 H new ATOM 0 HB3 ASP A 106 7.808 17.794 4.798 1.00 4.32 H new ATOM 1618 N GLY A 107 5.511 16.483 3.245 1.00 33.40 N ATOM 1619 CA GLY A 107 4.801 17.113 2.143 1.00 63.42 C ATOM 1620 C GLY A 107 4.438 16.188 0.976 1.00 44.15 C ATOM 1621 O GLY A 107 3.725 16.652 0.082 1.00 10.03 O ATOM 0 H GLY A 107 4.919 16.286 4.052 1.00 33.40 H new ATOM 0 HA2 GLY A 107 3.884 17.556 2.531 1.00 63.42 H new ATOM 0 HA3 GLY A 107 5.413 17.930 1.760 1.00 63.42 H new ATOM 1625 N GLN A 108 4.850 14.910 0.956 1.00 2.31 N ATOM 1626 CA GLN A 108 4.435 13.991 -0.109 1.00 74.13 C ATOM 1627 C GLN A 108 2.912 13.894 -0.124 1.00 34.50 C ATOM 1628 O GLN A 108 2.284 13.872 0.935 1.00 62.24 O ATOM 1629 CB GLN A 108 5.052 12.590 0.074 1.00 54.33 C ATOM 1630 CG GLN A 108 5.963 12.236 -1.102 1.00 50.12 C ATOM 1631 CD GLN A 108 6.665 10.889 -0.956 1.00 54.23 C ATOM 1632 OE1 GLN A 108 7.175 10.535 0.098 1.00 50.04 O ATOM 1633 NE2 GLN A 108 6.759 10.122 -2.030 1.00 62.21 N ATOM 0 H GLN A 108 5.463 14.496 1.658 1.00 2.31 H new ATOM 0 HA GLN A 108 4.794 14.385 -1.060 1.00 74.13 H new ATOM 0 HB2 GLN A 108 5.622 12.558 1.003 1.00 54.33 H new ATOM 0 HB3 GLN A 108 4.259 11.848 0.161 1.00 54.33 H new ATOM 0 HG2 GLN A 108 5.372 12.229 -2.018 1.00 50.12 H new ATOM 0 HG3 GLN A 108 6.715 13.017 -1.214 1.00 50.12 H new ATOM 0 HE21 GLN A 108 6.333 10.419 -2.908 1.00 62.21 H new ATOM 0 HE22 GLN A 108 7.257 9.234 -1.980 1.00 62.21 H new ATOM 1642 N THR A 109 2.308 13.792 -1.304 1.00 21.34 N ATOM 1643 CA THR A 109 0.858 13.690 -1.434 1.00 31.54 C ATOM 1644 C THR A 109 0.535 12.249 -1.831 1.00 1.34 C ATOM 1645 O THR A 109 0.699 11.876 -2.991 1.00 63.23 O ATOM 1646 CB THR A 109 0.330 14.768 -2.392 1.00 32.41 C ATOM 1647 OG1 THR A 109 0.886 16.033 -2.055 1.00 70.53 O ATOM 1648 CG2 THR A 109 -1.193 14.894 -2.337 1.00 12.23 C ATOM 0 H THR A 109 2.807 13.778 -2.193 1.00 21.34 H new ATOM 0 HA THR A 109 0.340 13.891 -0.496 1.00 31.54 H new ATOM 0 HB THR A 109 0.623 14.465 -3.397 1.00 32.41 H new ATOM 0 HG1 THR A 109 0.546 16.715 -2.672 1.00 70.53 H new ATOM 0 HG21 THR A 109 -1.519 15.668 -3.031 1.00 12.23 H new ATOM 0 HG22 THR A 109 -1.647 13.943 -2.615 1.00 12.23 H new ATOM 0 HG23 THR A 109 -1.500 15.161 -1.326 1.00 12.23 H new ATOM 1656 N VAL A 110 0.192 11.417 -0.845 1.00 50.34 N ATOM 1657 CA VAL A 110 -0.161 10.015 -1.049 1.00 62.44 C ATOM 1658 C VAL A 110 -1.648 9.994 -1.396 1.00 65.13 C ATOM 1659 O VAL A 110 -2.454 10.526 -0.624 1.00 4.43 O ATOM 1660 CB VAL A 110 0.156 9.202 0.229 1.00 45.42 C ATOM 1661 CG1 VAL A 110 -0.154 7.708 0.049 1.00 73.35 C ATOM 1662 CG2 VAL A 110 1.631 9.349 0.650 1.00 50.05 C ATOM 0 H VAL A 110 0.152 11.706 0.132 1.00 50.34 H new ATOM 0 HA VAL A 110 0.413 9.556 -1.854 1.00 62.44 H new ATOM 0 HB VAL A 110 -0.485 9.612 1.009 1.00 45.42 H new ATOM 0 HG11 VAL A 110 0.083 7.174 0.969 1.00 73.35 H new ATOM 0 HG12 VAL A 110 -1.212 7.581 -0.182 1.00 73.35 H new ATOM 0 HG13 VAL A 110 0.447 7.308 -0.768 1.00 73.35 H new ATOM 0 HG21 VAL A 110 1.812 8.763 1.551 1.00 50.05 H new ATOM 0 HG22 VAL A 110 2.276 8.990 -0.152 1.00 50.05 H new ATOM 0 HG23 VAL A 110 1.850 10.398 0.849 1.00 50.05 H new ATOM 1672 N THR A 111 -1.990 9.388 -2.533 1.00 70.13 N ATOM 1673 CA THR A 111 -3.315 9.400 -3.128 1.00 24.43 C ATOM 1674 C THR A 111 -3.779 7.941 -3.311 1.00 3.30 C ATOM 1675 O THR A 111 -3.153 7.150 -4.020 1.00 33.24 O ATOM 1676 CB THR A 111 -3.247 10.189 -4.450 1.00 71.52 C ATOM 1677 OG1 THR A 111 -2.721 11.484 -4.210 1.00 50.04 O ATOM 1678 CG2 THR A 111 -4.615 10.344 -5.127 1.00 43.41 C ATOM 0 H THR A 111 -1.318 8.854 -3.084 1.00 70.13 H new ATOM 0 HA THR A 111 -4.049 9.896 -2.493 1.00 24.43 H new ATOM 0 HB THR A 111 -2.603 9.617 -5.118 1.00 71.52 H new ATOM 0 HG1 THR A 111 -2.678 11.981 -5.053 1.00 50.04 H new ATOM 0 HG21 THR A 111 -4.501 10.908 -6.053 1.00 43.41 H new ATOM 0 HG22 THR A 111 -5.024 9.359 -5.351 1.00 43.41 H new ATOM 0 HG23 THR A 111 -5.293 10.875 -4.459 1.00 43.41 H new ATOM 1686 N ILE A 112 -4.879 7.556 -2.671 1.00 52.40 N ATOM 1687 CA ILE A 112 -5.498 6.223 -2.755 1.00 43.03 C ATOM 1688 C ILE A 112 -6.674 6.352 -3.728 1.00 73.51 C ATOM 1689 O ILE A 112 -7.351 7.379 -3.667 1.00 22.12 O ATOM 1690 CB ILE A 112 -6.027 5.776 -1.366 1.00 50.21 C ATOM 1691 CG1 ILE A 112 -5.140 6.292 -0.216 1.00 21.15 C ATOM 1692 CG2 ILE A 112 -6.183 4.246 -1.323 1.00 4.21 C ATOM 1693 CD1 ILE A 112 -5.508 5.778 1.176 1.00 25.14 C ATOM 0 H ILE A 112 -5.390 8.185 -2.052 1.00 52.40 H new ATOM 0 HA ILE A 112 -4.772 5.482 -3.089 1.00 43.03 H new ATOM 0 HB ILE A 112 -7.010 6.224 -1.220 1.00 50.21 H new ATOM 0 HG12 ILE A 112 -4.106 6.017 -0.425 1.00 21.15 H new ATOM 0 HG13 ILE A 112 -5.184 7.381 -0.206 1.00 21.15 H new ATOM 0 HG21 ILE A 112 -6.555 3.946 -0.343 1.00 4.21 H new ATOM 0 HG22 ILE A 112 -6.889 3.931 -2.091 1.00 4.21 H new ATOM 0 HG23 ILE A 112 -5.216 3.776 -1.504 1.00 4.21 H new ATOM 0 HD11 ILE A 112 -4.824 6.200 1.912 1.00 25.14 H new ATOM 0 HD12 ILE A 112 -6.529 6.076 1.416 1.00 25.14 H new ATOM 0 HD13 ILE A 112 -5.434 4.691 1.194 1.00 25.14 H new ATOM 1705 N HIS A 113 -6.955 5.341 -4.559 1.00 30.52 N ATOM 1706 CA HIS A 113 -8.126 5.332 -5.450 1.00 74.32 C ATOM 1707 C HIS A 113 -9.055 4.157 -5.146 1.00 44.32 C ATOM 1708 O HIS A 113 -8.585 3.031 -4.984 1.00 54.01 O ATOM 1709 CB HIS A 113 -7.693 5.261 -6.922 1.00 10.03 C ATOM 1710 CG HIS A 113 -7.628 6.609 -7.582 1.00 71.54 C ATOM 1711 ND1 HIS A 113 -6.539 7.437 -7.630 1.00 22.24 N ATOM 1712 CD2 HIS A 113 -8.646 7.226 -8.252 1.00 44.00 C ATOM 1713 CE1 HIS A 113 -6.882 8.539 -8.309 1.00 31.41 C ATOM 1714 NE2 HIS A 113 -8.170 8.464 -8.702 1.00 45.20 N ATOM 0 H HIS A 113 -6.377 4.504 -4.634 1.00 30.52 H new ATOM 0 HA HIS A 113 -8.666 6.262 -5.273 1.00 74.32 H new ATOM 0 HB2 HIS A 113 -6.714 4.785 -6.984 1.00 10.03 H new ATOM 0 HB3 HIS A 113 -8.391 4.628 -7.470 1.00 10.03 H new ATOM 0 HD2 HIS A 113 -9.639 6.830 -8.407 1.00 44.00 H new ATOM 0 HE1 HIS A 113 -6.222 9.369 -8.513 1.00 31.41 H new ATOM 0 HE2 HIS A 113 -8.693 9.168 -9.223 1.00 45.20 H new ATOM 1722 N CYS A 114 -10.370 4.406 -5.137 1.00 62.13 N ATOM 1723 CA CYS A 114 -11.407 3.379 -5.167 1.00 44.41 C ATOM 1724 C CYS A 114 -11.891 3.224 -6.612 1.00 53.03 C ATOM 1725 O CYS A 114 -12.016 4.214 -7.337 1.00 73.13 O ATOM 1726 CB CYS A 114 -12.574 3.776 -4.246 1.00 63.32 C ATOM 1727 SG CYS A 114 -13.589 2.307 -3.903 1.00 3.33 S ATOM 0 H CYS A 114 -10.747 5.353 -5.108 1.00 62.13 H new ATOM 0 HA CYS A 114 -11.006 2.431 -4.810 1.00 44.41 H new ATOM 0 HB2 CYS A 114 -12.192 4.195 -3.315 1.00 63.32 H new ATOM 0 HB3 CYS A 114 -13.180 4.549 -4.719 1.00 63.32 H new ATOM 0 HG CYS A 114 -13.053 1.267 -4.469 1.00 3.33 H new ATOM 1733 N ASN A 115 -12.197 1.989 -7.013 1.00 22.25 N ATOM 1734 CA ASN A 115 -12.396 1.544 -8.386 1.00 21.22 C ATOM 1735 C ASN A 115 -13.694 0.725 -8.481 1.00 71.12 C ATOM 1736 O ASN A 115 -13.701 -0.385 -9.029 1.00 53.02 O ATOM 1737 CB ASN A 115 -11.174 0.697 -8.804 1.00 64.34 C ATOM 1738 CG ASN A 115 -9.846 1.294 -8.368 1.00 5.34 C ATOM 1739 OD1 ASN A 115 -9.193 0.793 -7.464 1.00 71.20 O ATOM 1740 ND2 ASN A 115 -9.458 2.418 -8.932 1.00 31.12 N ATOM 0 H ASN A 115 -12.319 1.229 -6.344 1.00 22.25 H new ATOM 0 HA ASN A 115 -12.488 2.398 -9.057 1.00 21.22 H new ATOM 0 HB2 ASN A 115 -11.272 -0.302 -8.379 1.00 64.34 H new ATOM 0 HB3 ASN A 115 -11.174 0.583 -9.888 1.00 64.34 H new ATOM 0 HD21 ASN A 115 -8.605 2.879 -8.616 1.00 31.12 H new ATOM 0 HD22 ASN A 115 -10.010 2.828 -9.686 1.00 31.12 H new ATOM 1747 N ASP A 116 -14.773 1.218 -7.873 1.00 42.03 N ATOM 1748 CA ASP A 116 -15.950 0.454 -7.472 1.00 65.23 C ATOM 1749 C ASP A 116 -16.724 -0.073 -8.680 1.00 65.51 C ATOM 1750 O ASP A 116 -16.937 0.645 -9.663 1.00 23.52 O ATOM 1751 CB ASP A 116 -16.852 1.356 -6.631 1.00 42.03 C ATOM 1752 CG ASP A 116 -17.830 0.570 -5.772 1.00 32.34 C ATOM 1753 OD1 ASP A 116 -18.751 -0.072 -6.321 1.00 22.11 O ATOM 1754 OD2 ASP A 116 -17.700 0.626 -4.525 1.00 72.31 O ATOM 0 H ASP A 116 -14.852 2.207 -7.637 1.00 42.03 H new ATOM 0 HA ASP A 116 -15.624 -0.410 -6.894 1.00 65.23 H new ATOM 0 HB2 ASP A 116 -16.234 1.984 -5.989 1.00 42.03 H new ATOM 0 HB3 ASP A 116 -17.408 2.023 -7.290 1.00 42.03 H new ATOM 1759 N LYS A 117 -17.149 -1.339 -8.629 1.00 71.12 N ATOM 1760 CA LYS A 117 -17.856 -1.982 -9.738 1.00 32.53 C ATOM 1761 C LYS A 117 -19.362 -2.039 -9.496 1.00 73.53 C ATOM 1762 O LYS A 117 -20.072 -2.503 -10.392 1.00 11.04 O ATOM 1763 CB LYS A 117 -17.286 -3.388 -10.012 1.00 70.44 C ATOM 1764 CG LYS A 117 -15.774 -3.450 -10.311 1.00 45.31 C ATOM 1765 CD LYS A 117 -15.365 -2.634 -11.549 1.00 1.35 C ATOM 1766 CE LYS A 117 -15.951 -3.171 -12.865 1.00 34.54 C ATOM 1767 NZ LYS A 117 -15.135 -4.249 -13.465 1.00 54.03 N ATOM 0 H LYS A 117 -17.013 -1.945 -7.820 1.00 71.12 H new ATOM 0 HA LYS A 117 -17.695 -1.369 -10.625 1.00 32.53 H new ATOM 0 HB2 LYS A 117 -17.493 -4.019 -9.147 1.00 70.44 H new ATOM 0 HB3 LYS A 117 -17.823 -3.819 -10.857 1.00 70.44 H new ATOM 0 HG2 LYS A 117 -15.224 -3.083 -9.444 1.00 45.31 H new ATOM 0 HG3 LYS A 117 -15.482 -4.490 -10.457 1.00 45.31 H new ATOM 0 HD2 LYS A 117 -15.685 -1.601 -11.414 1.00 1.35 H new ATOM 0 HD3 LYS A 117 -14.278 -2.624 -11.623 1.00 1.35 H new ATOM 0 HE2 LYS A 117 -16.958 -3.545 -12.682 1.00 34.54 H new ATOM 0 HE3 LYS A 117 -16.040 -2.351 -13.578 1.00 34.54 H new ATOM 0 HZ1 LYS A 117 -15.580 -4.570 -14.349 1.00 54.03 H new ATOM 0 HZ2 LYS A 117 -14.181 -3.890 -13.668 1.00 54.03 H new ATOM 0 HZ3 LYS A 117 -15.070 -5.046 -12.800 1.00 54.03 H new ATOM 1781 N SER A 118 -19.862 -1.610 -8.339 1.00 1.24 N ATOM 1782 CA SER A 118 -21.261 -1.779 -7.989 1.00 1.15 C ATOM 1783 C SER A 118 -22.106 -0.842 -8.852 1.00 62.53 C ATOM 1784 O SER A 118 -23.025 -1.323 -9.518 1.00 12.45 O ATOM 1785 CB SER A 118 -21.458 -1.610 -6.472 1.00 62.32 C ATOM 1786 OG SER A 118 -22.532 -2.408 -5.996 1.00 14.14 O ATOM 0 H SER A 118 -19.308 -1.138 -7.624 1.00 1.24 H new ATOM 0 HA SER A 118 -21.602 -2.791 -8.206 1.00 1.15 H new ATOM 0 HB2 SER A 118 -20.540 -1.885 -5.952 1.00 62.32 H new ATOM 0 HB3 SER A 118 -21.652 -0.562 -6.243 1.00 62.32 H new ATOM 0 HG SER A 118 -22.631 -2.280 -5.029 1.00 14.14 H new ATOM 1792 N ASP A 119 -21.782 0.459 -8.928 1.00 33.34 N ATOM 1793 CA ASP A 119 -22.529 1.396 -9.781 1.00 31.13 C ATOM 1794 C ASP A 119 -21.643 2.396 -10.519 1.00 44.21 C ATOM 1795 O ASP A 119 -21.951 3.583 -10.575 1.00 25.42 O ATOM 1796 CB ASP A 119 -23.672 2.093 -9.037 1.00 24.42 C ATOM 1797 CG ASP A 119 -24.732 2.512 -10.067 1.00 52.32 C ATOM 1798 OD1 ASP A 119 -25.365 1.604 -10.659 1.00 3.25 O ATOM 1799 OD2 ASP A 119 -24.895 3.716 -10.362 1.00 31.41 O ATOM 0 H ASP A 119 -21.012 0.884 -8.412 1.00 33.34 H new ATOM 0 HA ASP A 119 -22.981 0.770 -10.551 1.00 31.13 H new ATOM 0 HB2 ASP A 119 -24.107 1.423 -8.295 1.00 24.42 H new ATOM 0 HB3 ASP A 119 -23.299 2.965 -8.499 1.00 24.42 H new ATOM 1804 N ASN A 120 -20.531 1.923 -11.090 1.00 25.42 N ATOM 1805 CA ASN A 120 -19.627 2.733 -11.906 1.00 11.24 C ATOM 1806 C ASN A 120 -19.178 3.996 -11.151 1.00 1.44 C ATOM 1807 O ASN A 120 -19.408 5.113 -11.623 1.00 24.41 O ATOM 1808 CB ASN A 120 -20.291 3.027 -13.258 1.00 70.53 C ATOM 1809 CG ASN A 120 -19.326 3.635 -14.265 1.00 12.12 C ATOM 1810 OD1 ASN A 120 -18.120 3.753 -14.066 1.00 13.45 O ATOM 1811 ND2 ASN A 120 -19.835 3.927 -15.446 1.00 1.43 N ATOM 0 H ASN A 120 -20.231 0.953 -10.996 1.00 25.42 H new ATOM 0 HA ASN A 120 -18.710 2.179 -12.109 1.00 11.24 H new ATOM 0 HB2 ASN A 120 -20.701 2.103 -13.666 1.00 70.53 H new ATOM 0 HB3 ASN A 120 -21.129 3.708 -13.107 1.00 70.53 H new ATOM 0 HD21 ASN A 120 -19.227 4.252 -16.197 1.00 1.43 H new ATOM 0 HD22 ASN A 120 -20.837 3.828 -15.608 1.00 1.43 H new ATOM 1818 N THR A 121 -18.577 3.838 -9.962 1.00 62.24 N ATOM 1819 CA THR A 121 -18.200 4.957 -9.098 1.00 45.23 C ATOM 1820 C THR A 121 -16.688 4.905 -8.850 1.00 31.43 C ATOM 1821 O THR A 121 -16.134 3.843 -8.562 1.00 10.04 O ATOM 1822 CB THR A 121 -19.069 5.012 -7.815 1.00 12.11 C ATOM 1823 OG1 THR A 121 -18.717 4.077 -6.823 1.00 51.23 O ATOM 1824 CG2 THR A 121 -20.560 4.761 -8.068 1.00 65.53 C ATOM 0 H THR A 121 -18.340 2.925 -9.575 1.00 62.24 H new ATOM 0 HA THR A 121 -18.409 5.905 -9.593 1.00 45.23 H new ATOM 0 HB THR A 121 -18.878 6.030 -7.476 1.00 12.11 H new ATOM 0 HG1 THR A 121 -19.311 4.180 -6.050 1.00 51.23 H new ATOM 0 HG21 THR A 121 -21.103 4.815 -7.125 1.00 65.53 H new ATOM 0 HG22 THR A 121 -20.945 5.517 -8.753 1.00 65.53 H new ATOM 0 HG23 THR A 121 -20.693 3.772 -8.507 1.00 65.53 H new ATOM 1832 N LYS A 122 -15.991 6.032 -9.014 1.00 11.15 N ATOM 1833 CA LYS A 122 -14.547 6.135 -8.812 1.00 2.25 C ATOM 1834 C LYS A 122 -14.228 7.474 -8.187 1.00 5.03 C ATOM 1835 O LYS A 122 -14.667 8.520 -8.675 1.00 3.41 O ATOM 1836 CB LYS A 122 -13.793 5.984 -10.134 1.00 51.04 C ATOM 1837 CG LYS A 122 -13.412 4.517 -10.379 1.00 61.12 C ATOM 1838 CD LYS A 122 -13.630 4.099 -11.824 1.00 1.44 C ATOM 1839 CE LYS A 122 -12.668 4.870 -12.724 1.00 5.31 C ATOM 1840 NZ LYS A 122 -13.324 5.397 -13.932 1.00 64.30 N ATOM 0 H LYS A 122 -16.423 6.912 -9.296 1.00 11.15 H new ATOM 0 HA LYS A 122 -14.228 5.330 -8.150 1.00 2.25 H new ATOM 0 HB2 LYS A 122 -14.413 6.346 -10.955 1.00 51.04 H new ATOM 0 HB3 LYS A 122 -12.894 6.600 -10.118 1.00 51.04 H new ATOM 0 HG2 LYS A 122 -12.366 4.366 -10.113 1.00 61.12 H new ATOM 0 HG3 LYS A 122 -14.003 3.876 -9.724 1.00 61.12 H new ATOM 0 HD2 LYS A 122 -13.467 3.027 -11.933 1.00 1.44 H new ATOM 0 HD3 LYS A 122 -14.660 4.297 -12.120 1.00 1.44 H new ATOM 0 HE2 LYS A 122 -12.233 5.696 -12.161 1.00 5.31 H new ATOM 0 HE3 LYS A 122 -11.847 4.216 -13.017 1.00 5.31 H new ATOM 0 HZ1 LYS A 122 -12.628 5.912 -14.508 1.00 64.30 H new ATOM 0 HZ2 LYS A 122 -13.717 4.609 -14.485 1.00 64.30 H new ATOM 0 HZ3 LYS A 122 -14.091 6.043 -13.657 1.00 64.30 H new ATOM 1854 N SER A 123 -13.450 7.402 -7.118 1.00 22.22 N ATOM 1855 CA SER A 123 -13.104 8.500 -6.235 1.00 25.54 C ATOM 1856 C SER A 123 -11.739 8.187 -5.617 1.00 45.32 C ATOM 1857 O SER A 123 -11.203 7.090 -5.817 1.00 45.40 O ATOM 1858 CB SER A 123 -14.203 8.619 -5.173 1.00 21.34 C ATOM 1859 OG SER A 123 -15.444 8.956 -5.769 1.00 3.03 O ATOM 0 H SER A 123 -13.019 6.524 -6.829 1.00 22.22 H new ATOM 0 HA SER A 123 -13.035 9.452 -6.761 1.00 25.54 H new ATOM 0 HB2 SER A 123 -14.297 7.677 -4.634 1.00 21.34 H new ATOM 0 HB3 SER A 123 -13.927 9.379 -4.441 1.00 21.34 H new ATOM 0 HG SER A 123 -16.132 9.025 -5.075 1.00 3.03 H new ATOM 1865 N SER A 124 -11.165 9.127 -4.870 1.00 22.23 N ATOM 1866 CA SER A 124 -9.859 8.961 -4.246 1.00 32.13 C ATOM 1867 C SER A 124 -9.845 9.601 -2.857 1.00 73.34 C ATOM 1868 O SER A 124 -10.837 10.216 -2.447 1.00 72.42 O ATOM 1869 CB SER A 124 -8.775 9.518 -5.191 1.00 13.12 C ATOM 1870 OG SER A 124 -9.095 10.793 -5.724 1.00 52.31 O ATOM 0 H SER A 124 -11.598 10.031 -4.681 1.00 22.23 H new ATOM 0 HA SER A 124 -9.641 7.905 -4.089 1.00 32.13 H new ATOM 0 HB2 SER A 124 -7.831 9.585 -4.650 1.00 13.12 H new ATOM 0 HB3 SER A 124 -8.623 8.817 -6.012 1.00 13.12 H new ATOM 0 HG SER A 124 -8.371 11.093 -6.312 1.00 52.31 H new ATOM 1876 N VAL A 125 -8.742 9.479 -2.114 1.00 74.23 N ATOM 1877 CA VAL A 125 -8.423 10.439 -1.066 1.00 12.21 C ATOM 1878 C VAL A 125 -6.958 10.827 -1.197 1.00 52.14 C ATOM 1879 O VAL A 125 -6.157 9.996 -1.631 1.00 43.33 O ATOM 1880 CB VAL A 125 -8.753 9.907 0.347 1.00 63.40 C ATOM 1881 CG1 VAL A 125 -10.185 9.384 0.501 1.00 63.04 C ATOM 1882 CG2 VAL A 125 -7.790 8.802 0.808 1.00 71.44 C ATOM 0 H VAL A 125 -8.061 8.727 -2.221 1.00 74.23 H new ATOM 0 HA VAL A 125 -9.049 11.322 -1.194 1.00 12.21 H new ATOM 0 HB VAL A 125 -8.637 10.788 0.979 1.00 63.40 H new ATOM 0 HG11 VAL A 125 -10.335 9.029 1.521 1.00 63.04 H new ATOM 0 HG12 VAL A 125 -10.891 10.187 0.289 1.00 63.04 H new ATOM 0 HG13 VAL A 125 -10.349 8.563 -0.197 1.00 63.04 H new ATOM 0 HG21 VAL A 125 -8.071 8.468 1.807 1.00 71.44 H new ATOM 0 HG22 VAL A 125 -7.842 7.962 0.116 1.00 71.44 H new ATOM 0 HG23 VAL A 125 -6.772 9.192 0.829 1.00 71.44 H new ATOM 1892 N SER A 126 -6.609 12.041 -0.776 1.00 74.55 N ATOM 1893 CA SER A 126 -5.230 12.469 -0.635 1.00 42.41 C ATOM 1894 C SER A 126 -5.062 13.539 0.450 1.00 41.21 C ATOM 1895 O SER A 126 -5.971 14.308 0.796 1.00 44.23 O ATOM 1896 CB SER A 126 -4.663 12.929 -1.986 1.00 34.23 C ATOM 1897 OG SER A 126 -5.210 14.165 -2.391 1.00 54.23 O ATOM 0 H SER A 126 -7.288 12.759 -0.522 1.00 74.55 H new ATOM 0 HA SER A 126 -4.651 11.607 -0.305 1.00 42.41 H new ATOM 0 HB2 SER A 126 -3.579 13.018 -1.914 1.00 34.23 H new ATOM 0 HB3 SER A 126 -4.871 12.174 -2.744 1.00 34.23 H new ATOM 0 HG SER A 126 -4.825 14.426 -3.253 1.00 54.23 H new ATOM 1903 N GLY A 127 -3.850 13.577 0.989 1.00 22.51 N ATOM 1904 CA GLY A 127 -3.396 14.460 2.051 1.00 1.22 C ATOM 1905 C GLY A 127 -1.875 14.461 2.048 1.00 34.22 C ATOM 1906 O GLY A 127 -1.264 13.769 1.224 1.00 34.34 O ATOM 0 H GLY A 127 -3.111 12.949 0.673 1.00 22.51 H new ATOM 0 HA2 GLY A 127 -3.777 15.469 1.896 1.00 1.22 H new ATOM 0 HA3 GLY A 127 -3.774 14.121 3.015 1.00 1.22 H new ATOM 1910 N LYS A 128 -1.250 15.181 2.978 1.00 25.20 N ATOM 1911 CA LYS A 128 0.196 15.407 2.982 1.00 34.52 C ATOM 1912 C LYS A 128 0.835 14.904 4.267 1.00 61.41 C ATOM 1913 O LYS A 128 0.200 14.881 5.318 1.00 43.35 O ATOM 1914 CB LYS A 128 0.481 16.884 2.701 1.00 1.43 C ATOM 1915 CG LYS A 128 0.291 17.166 1.201 1.00 71.43 C ATOM 1916 CD LYS A 128 -0.125 18.613 0.953 1.00 41.33 C ATOM 1917 CE LYS A 128 -0.336 18.874 -0.539 1.00 61.41 C ATOM 1918 NZ LYS A 128 -0.481 20.315 -0.807 1.00 31.23 N ATOM 0 H LYS A 128 -1.736 15.628 3.756 1.00 25.20 H new ATOM 0 HA LYS A 128 0.658 14.826 2.184 1.00 34.52 H new ATOM 0 HB2 LYS A 128 -0.189 17.513 3.288 1.00 1.43 H new ATOM 0 HB3 LYS A 128 1.498 17.133 3.003 1.00 1.43 H new ATOM 0 HG2 LYS A 128 1.220 16.957 0.670 1.00 71.43 H new ATOM 0 HG3 LYS A 128 -0.466 16.494 0.796 1.00 71.43 H new ATOM 0 HD2 LYS A 128 -1.044 18.829 1.497 1.00 41.33 H new ATOM 0 HD3 LYS A 128 0.640 19.286 1.339 1.00 41.33 H new ATOM 0 HE2 LYS A 128 0.508 18.478 -1.104 1.00 61.41 H new ATOM 0 HE3 LYS A 128 -1.225 18.345 -0.882 1.00 61.41 H new ATOM 0 HZ1 LYS A 128 -0.623 20.466 -1.826 1.00 31.23 H new ATOM 0 HZ2 LYS A 128 -1.301 20.684 -0.285 1.00 31.23 H new ATOM 0 HZ3 LYS A 128 0.378 20.813 -0.500 1.00 31.23 H new ATOM 1932 N VAL A 129 2.089 14.470 4.162 1.00 32.50 N ATOM 1933 CA VAL A 129 2.791 13.758 5.228 1.00 64.25 C ATOM 1934 C VAL A 129 3.062 14.691 6.401 1.00 33.10 C ATOM 1935 O VAL A 129 4.008 15.480 6.369 1.00 31.24 O ATOM 1936 CB VAL A 129 4.069 13.088 4.694 1.00 32.33 C ATOM 1937 CG1 VAL A 129 4.755 12.208 5.744 1.00 32.54 C ATOM 1938 CG2 VAL A 129 3.776 12.168 3.504 1.00 71.23 C ATOM 0 H VAL A 129 2.654 14.605 3.323 1.00 32.50 H new ATOM 0 HA VAL A 129 2.153 12.956 5.598 1.00 64.25 H new ATOM 0 HB VAL A 129 4.714 13.918 4.407 1.00 32.33 H new ATOM 0 HG11 VAL A 129 5.651 11.760 5.314 1.00 32.54 H new ATOM 0 HG12 VAL A 129 5.031 12.817 6.605 1.00 32.54 H new ATOM 0 HG13 VAL A 129 4.072 11.420 6.061 1.00 32.54 H new ATOM 0 HG21 VAL A 129 4.705 11.715 3.157 1.00 71.23 H new ATOM 0 HG22 VAL A 129 3.083 11.385 3.811 1.00 71.23 H new ATOM 0 HG23 VAL A 129 3.332 12.749 2.696 1.00 71.23 H new ATOM 1948 N GLY A 130 2.259 14.557 7.454 1.00 53.41 N ATOM 1949 CA GLY A 130 2.335 15.343 8.679 1.00 1.22 C ATOM 1950 C GLY A 130 1.109 16.242 8.860 1.00 32.41 C ATOM 1951 O GLY A 130 0.924 16.808 9.937 1.00 53.13 O ATOM 0 H GLY A 130 1.507 13.868 7.476 1.00 53.41 H new ATOM 0 HA2 GLY A 130 2.423 14.673 9.535 1.00 1.22 H new ATOM 0 HA3 GLY A 130 3.235 15.957 8.661 1.00 1.22 H new ATOM 1955 N ALA A 131 0.264 16.353 7.830 1.00 11.14 N ATOM 1956 CA ALA A 131 -0.991 17.090 7.806 1.00 62.11 C ATOM 1957 C ALA A 131 -2.148 16.100 7.667 1.00 31.44 C ATOM 1958 O ALA A 131 -1.922 14.886 7.614 1.00 50.41 O ATOM 1959 CB ALA A 131 -0.951 18.087 6.639 1.00 11.21 C ATOM 0 H ALA A 131 0.456 15.899 6.937 1.00 11.14 H new ATOM 0 HA ALA A 131 -1.137 17.649 8.730 1.00 62.11 H new ATOM 0 HB1 ALA A 131 -1.885 18.648 6.607 1.00 11.21 H new ATOM 0 HB2 ALA A 131 -0.118 18.777 6.778 1.00 11.21 H new ATOM 0 HB3 ALA A 131 -0.821 17.545 5.702 1.00 11.21 H new ATOM 1965 N ASP A 132 -3.379 16.603 7.616 1.00 25.40 N ATOM 1966 CA ASP A 132 -4.562 15.807 7.295 1.00 25.43 C ATOM 1967 C ASP A 132 -4.834 15.783 5.784 1.00 71.33 C ATOM 1968 O ASP A 132 -4.117 16.376 4.967 1.00 10.31 O ATOM 1969 CB ASP A 132 -5.775 16.296 8.104 1.00 62.35 C ATOM 1970 CG ASP A 132 -6.828 15.190 8.247 1.00 62.11 C ATOM 1971 OD1 ASP A 132 -6.695 14.272 9.081 1.00 3.10 O ATOM 1972 OD2 ASP A 132 -7.809 15.203 7.470 1.00 42.22 O ATOM 0 H ASP A 132 -3.586 17.585 7.798 1.00 25.40 H new ATOM 0 HA ASP A 132 -4.371 14.774 7.586 1.00 25.43 H new ATOM 0 HB2 ASP A 132 -5.449 16.622 9.092 1.00 62.35 H new ATOM 0 HB3 ASP A 132 -6.218 17.162 7.613 1.00 62.35 H new ATOM 1977 N LEU A 133 -5.890 15.076 5.397 1.00 61.03 N ATOM 1978 CA LEU A 133 -6.483 15.049 4.074 1.00 63.32 C ATOM 1979 C LEU A 133 -7.279 16.331 3.865 1.00 24.10 C ATOM 1980 O LEU A 133 -7.956 16.813 4.773 1.00 45.21 O ATOM 1981 CB LEU A 133 -7.451 13.865 4.021 1.00 72.35 C ATOM 1982 CG LEU A 133 -6.757 12.485 4.050 1.00 52.15 C ATOM 1983 CD1 LEU A 133 -7.587 11.569 4.921 1.00 53.24 C ATOM 1984 CD2 LEU A 133 -6.660 11.800 2.686 1.00 65.45 C ATOM 0 H LEU A 133 -6.385 14.466 6.048 1.00 61.03 H new ATOM 0 HA LEU A 133 -5.712 14.960 3.309 1.00 63.32 H new ATOM 0 HB2 LEU A 133 -8.138 13.933 4.864 1.00 72.35 H new ATOM 0 HB3 LEU A 133 -8.051 13.940 3.114 1.00 72.35 H new ATOM 0 HG LEU A 133 -5.744 12.659 4.413 1.00 52.15 H new ATOM 0 HD11 LEU A 133 -7.121 10.584 4.961 1.00 53.24 H new ATOM 0 HD12 LEU A 133 -7.649 11.982 5.928 1.00 53.24 H new ATOM 0 HD13 LEU A 133 -8.590 11.479 4.503 1.00 53.24 H new ATOM 0 HD21 LEU A 133 -6.160 10.838 2.797 1.00 65.45 H new ATOM 0 HD22 LEU A 133 -7.662 11.644 2.285 1.00 65.45 H new ATOM 0 HD23 LEU A 133 -6.089 12.429 2.003 1.00 65.45 H new ATOM 1996 N THR A 134 -7.288 16.817 2.630 1.00 12.41 N ATOM 1997 CA THR A 134 -8.114 17.946 2.207 1.00 51.55 C ATOM 1998 C THR A 134 -8.743 17.698 0.835 1.00 64.22 C ATOM 1999 O THR A 134 -9.599 18.470 0.401 1.00 65.11 O ATOM 2000 CB THR A 134 -7.274 19.229 2.259 1.00 42.25 C ATOM 2001 OG1 THR A 134 -8.064 20.387 2.052 1.00 31.10 O ATOM 2002 CG2 THR A 134 -6.103 19.209 1.271 1.00 30.33 C ATOM 0 H THR A 134 -6.713 16.433 1.880 1.00 12.41 H new ATOM 0 HA THR A 134 -8.953 18.064 2.893 1.00 51.55 H new ATOM 0 HB THR A 134 -6.858 19.268 3.266 1.00 42.25 H new ATOM 0 HG1 THR A 134 -8.848 20.156 1.512 1.00 31.10 H new ATOM 0 HG21 THR A 134 -5.543 20.141 1.351 1.00 30.33 H new ATOM 0 HG22 THR A 134 -5.446 18.370 1.502 1.00 30.33 H new ATOM 0 HG23 THR A 134 -6.485 19.101 0.256 1.00 30.33 H new ATOM 2010 N SER A 135 -8.354 16.616 0.164 1.00 13.14 N ATOM 2011 CA SER A 135 -8.844 16.216 -1.136 1.00 64.15 C ATOM 2012 C SER A 135 -9.344 14.815 -0.853 1.00 65.52 C ATOM 2013 O SER A 135 -8.534 13.911 -0.734 1.00 10.31 O ATOM 2014 CB SER A 135 -7.701 16.262 -2.175 1.00 52.34 C ATOM 2015 OG SER A 135 -7.948 17.220 -3.189 1.00 44.24 O ATOM 0 H SER A 135 -7.657 15.971 0.536 1.00 13.14 H new ATOM 0 HA SER A 135 -9.617 16.855 -1.563 1.00 64.15 H new ATOM 0 HB2 SER A 135 -6.763 16.498 -1.673 1.00 52.34 H new ATOM 0 HB3 SER A 135 -7.581 15.277 -2.627 1.00 52.34 H new ATOM 0 HG SER A 135 -7.203 17.221 -3.826 1.00 44.24 H new ATOM 2021 N GLY A 136 -10.628 14.618 -0.568 1.00 71.24 N ATOM 2022 CA GLY A 136 -11.141 13.267 -0.373 1.00 23.21 C ATOM 2023 C GLY A 136 -11.714 12.973 1.004 1.00 72.14 C ATOM 2024 O GLY A 136 -12.412 11.966 1.142 1.00 23.34 O ATOM 0 H GLY A 136 -11.320 15.361 -0.469 1.00 71.24 H new ATOM 0 HA2 GLY A 136 -11.916 13.082 -1.116 1.00 23.21 H new ATOM 0 HA3 GLY A 136 -10.335 12.560 -0.570 1.00 23.21 H new ATOM 2028 N ASN A 137 -11.382 13.777 2.020 1.00 34.23 N ATOM 2029 CA ASN A 137 -11.792 13.561 3.403 1.00 42.30 C ATOM 2030 C ASN A 137 -13.320 13.550 3.488 1.00 14.14 C ATOM 2031 O ASN A 137 -13.940 14.451 2.919 1.00 10.51 O ATOM 2032 CB ASN A 137 -11.223 14.692 4.275 1.00 42.11 C ATOM 2033 CG ASN A 137 -11.331 14.317 5.742 1.00 45.12 C ATOM 2034 OD1 ASN A 137 -12.390 13.943 6.219 1.00 65.11 O ATOM 2035 ND2 ASN A 137 -10.243 14.360 6.484 1.00 12.31 N ATOM 0 H ASN A 137 -10.809 14.612 1.896 1.00 34.23 H new ATOM 0 HA ASN A 137 -11.413 12.603 3.759 1.00 42.30 H new ATOM 0 HB2 ASN A 137 -10.181 14.876 4.013 1.00 42.11 H new ATOM 0 HB3 ASN A 137 -11.767 15.617 4.086 1.00 42.11 H new ATOM 0 HD21 ASN A 137 -10.283 14.080 7.464 1.00 12.31 H new ATOM 0 HD22 ASN A 137 -9.361 14.674 6.078 1.00 12.31 H new ATOM 2042 N GLY A 138 -13.922 12.563 4.161 1.00 45.30 N ATOM 2043 CA GLY A 138 -15.345 12.559 4.491 1.00 10.53 C ATOM 2044 C GLY A 138 -16.193 11.516 3.752 1.00 24.14 C ATOM 2045 O GLY A 138 -17.418 11.632 3.757 1.00 3.43 O ATOM 0 H GLY A 138 -13.426 11.736 4.494 1.00 45.30 H new ATOM 0 HA2 GLY A 138 -15.451 12.394 5.563 1.00 10.53 H new ATOM 0 HA3 GLY A 138 -15.752 13.548 4.279 1.00 10.53 H new ATOM 2049 N THR A 139 -15.583 10.519 3.105 1.00 52.43 N ATOM 2050 CA THR A 139 -16.246 9.513 2.264 1.00 42.42 C ATOM 2051 C THR A 139 -15.783 8.107 2.661 1.00 24.31 C ATOM 2052 O THR A 139 -14.637 7.939 3.094 1.00 10.22 O ATOM 2053 CB THR A 139 -15.865 9.832 0.809 1.00 34.45 C ATOM 2054 OG1 THR A 139 -16.514 11.017 0.402 1.00 44.34 O ATOM 2055 CG2 THR A 139 -16.244 8.783 -0.235 1.00 32.21 C ATOM 0 H THR A 139 -14.573 10.383 3.153 1.00 52.43 H new ATOM 0 HA THR A 139 -17.329 9.540 2.388 1.00 42.42 H new ATOM 0 HB THR A 139 -14.777 9.894 0.838 1.00 34.45 H new ATOM 0 HG1 THR A 139 -16.270 11.222 -0.525 1.00 44.34 H new ATOM 0 HG21 THR A 139 -15.924 9.119 -1.221 1.00 32.21 H new ATOM 0 HG22 THR A 139 -15.754 7.839 0.003 1.00 32.21 H new ATOM 0 HG23 THR A 139 -17.325 8.641 -0.233 1.00 32.21 H new ATOM 2063 N THR A 140 -16.616 7.083 2.470 1.00 34.34 N ATOM 2064 CA THR A 140 -16.298 5.699 2.830 1.00 30.15 C ATOM 2065 C THR A 140 -16.301 4.799 1.586 1.00 43.42 C ATOM 2066 O THR A 140 -16.923 5.140 0.578 1.00 33.05 O ATOM 2067 CB THR A 140 -17.213 5.242 3.985 1.00 65.10 C ATOM 2068 OG1 THR A 140 -18.578 5.186 3.607 1.00 70.11 O ATOM 2069 CG2 THR A 140 -17.099 6.206 5.170 1.00 30.45 C ATOM 0 H THR A 140 -17.542 7.192 2.056 1.00 34.34 H new ATOM 0 HA THR A 140 -15.281 5.621 3.215 1.00 30.15 H new ATOM 0 HB THR A 140 -16.879 4.241 4.258 1.00 65.10 H new ATOM 0 HG1 THR A 140 -19.117 4.890 4.370 1.00 70.11 H new ATOM 0 HG21 THR A 140 -17.751 5.870 5.977 1.00 30.45 H new ATOM 0 HG22 THR A 140 -16.068 6.229 5.522 1.00 30.45 H new ATOM 0 HG23 THR A 140 -17.397 7.206 4.856 1.00 30.45 H new ATOM 2077 N PHE A 141 -15.570 3.684 1.628 1.00 22.31 N ATOM 2078 CA PHE A 141 -15.287 2.780 0.514 1.00 62.13 C ATOM 2079 C PHE A 141 -15.268 1.340 1.050 1.00 12.32 C ATOM 2080 O PHE A 141 -15.524 1.109 2.236 1.00 72.24 O ATOM 2081 CB PHE A 141 -13.920 3.135 -0.103 1.00 21.12 C ATOM 2082 CG PHE A 141 -13.746 4.504 -0.740 1.00 30.04 C ATOM 2083 CD1 PHE A 141 -14.750 5.070 -1.551 1.00 25.24 C ATOM 2084 CD2 PHE A 141 -12.525 5.187 -0.580 1.00 24.15 C ATOM 2085 CE1 PHE A 141 -14.552 6.322 -2.158 1.00 14.43 C ATOM 2086 CE2 PHE A 141 -12.317 6.424 -1.214 1.00 33.43 C ATOM 2087 CZ PHE A 141 -13.335 7.003 -1.987 1.00 51.54 C ATOM 0 H PHE A 141 -15.133 3.369 2.494 1.00 22.31 H new ATOM 0 HA PHE A 141 -16.052 2.876 -0.256 1.00 62.13 H new ATOM 0 HB2 PHE A 141 -13.167 3.035 0.679 1.00 21.12 H new ATOM 0 HB3 PHE A 141 -13.694 2.385 -0.861 1.00 21.12 H new ATOM 0 HD1 PHE A 141 -15.677 4.538 -1.707 1.00 25.24 H new ATOM 0 HD2 PHE A 141 -11.745 4.759 0.032 1.00 24.15 H new ATOM 0 HE1 PHE A 141 -15.336 6.761 -2.757 1.00 14.43 H new ATOM 0 HE2 PHE A 141 -11.370 6.931 -1.106 1.00 33.43 H new ATOM 0 HZ PHE A 141 -13.184 7.968 -2.448 1.00 51.54 H new ATOM 2097 N LYS A 142 -14.935 0.336 0.223 1.00 1.41 N ATOM 2098 CA LYS A 142 -14.979 -1.061 0.671 1.00 74.01 C ATOM 2099 C LYS A 142 -13.655 -1.781 0.511 1.00 52.24 C ATOM 2100 O LYS A 142 -12.903 -1.513 -0.421 1.00 42.22 O ATOM 2101 CB LYS A 142 -16.104 -1.844 -0.007 1.00 21.23 C ATOM 2102 CG LYS A 142 -17.414 -1.048 -0.167 1.00 24.11 C ATOM 2103 CD LYS A 142 -18.641 -1.959 -0.212 1.00 51.10 C ATOM 2104 CE LYS A 142 -19.920 -1.122 -0.137 1.00 62.21 C ATOM 2105 NZ LYS A 142 -20.579 -0.963 -1.444 1.00 73.32 N ATOM 0 H LYS A 142 -14.637 0.464 -0.744 1.00 1.41 H new ATOM 0 HA LYS A 142 -15.189 -1.017 1.740 1.00 74.01 H new ATOM 0 HB2 LYS A 142 -15.765 -2.168 -0.991 1.00 21.23 H new ATOM 0 HB3 LYS A 142 -16.307 -2.744 0.573 1.00 21.23 H new ATOM 0 HG2 LYS A 142 -17.514 -0.347 0.661 1.00 24.11 H new ATOM 0 HG3 LYS A 142 -17.369 -0.457 -1.082 1.00 24.11 H new ATOM 0 HD2 LYS A 142 -18.634 -2.546 -1.131 1.00 51.10 H new ATOM 0 HD3 LYS A 142 -18.610 -2.665 0.618 1.00 51.10 H new ATOM 0 HE2 LYS A 142 -20.615 -1.591 0.560 1.00 62.21 H new ATOM 0 HE3 LYS A 142 -19.681 -0.138 0.266 1.00 62.21 H new ATOM 0 HZ1 LYS A 142 -21.438 -0.388 -1.332 1.00 73.32 H new ATOM 0 HZ2 LYS A 142 -19.930 -0.490 -2.105 1.00 73.32 H new ATOM 0 HZ3 LYS A 142 -20.835 -1.898 -1.820 1.00 73.32 H new ATOM 2119 N LYS A 143 -13.423 -2.795 1.344 1.00 13.55 N ATOM 2120 CA LYS A 143 -12.205 -3.613 1.353 1.00 54.13 C ATOM 2121 C LYS A 143 -12.097 -4.504 0.105 1.00 52.22 C ATOM 2122 O LYS A 143 -11.037 -5.052 -0.183 1.00 50.42 O ATOM 2123 CB LYS A 143 -12.186 -4.385 2.683 1.00 30.44 C ATOM 2124 CG LYS A 143 -10.898 -5.133 3.063 1.00 72.44 C ATOM 2125 CD LYS A 143 -10.934 -6.609 2.652 1.00 54.12 C ATOM 2126 CE LYS A 143 -9.683 -7.335 3.137 1.00 5.12 C ATOM 2127 NZ LYS A 143 -9.492 -8.606 2.413 1.00 21.33 N ATOM 0 H LYS A 143 -14.097 -3.081 2.054 1.00 13.55 H new ATOM 0 HA LYS A 143 -11.314 -2.988 1.297 1.00 54.13 H new ATOM 0 HB2 LYS A 143 -12.411 -3.679 3.482 1.00 30.44 H new ATOM 0 HB3 LYS A 143 -12.999 -5.110 2.660 1.00 30.44 H new ATOM 0 HG2 LYS A 143 -10.046 -4.647 2.587 1.00 72.44 H new ATOM 0 HG3 LYS A 143 -10.745 -5.063 4.140 1.00 72.44 H new ATOM 0 HD2 LYS A 143 -11.821 -7.086 3.068 1.00 54.12 H new ATOM 0 HD3 LYS A 143 -11.009 -6.688 1.567 1.00 54.12 H new ATOM 0 HE2 LYS A 143 -8.811 -6.697 2.995 1.00 5.12 H new ATOM 0 HE3 LYS A 143 -9.764 -7.531 4.206 1.00 5.12 H new ATOM 0 HZ1 LYS A 143 -9.266 -9.361 3.091 1.00 21.33 H new ATOM 0 HZ2 LYS A 143 -10.365 -8.849 1.902 1.00 21.33 H new ATOM 0 HZ3 LYS A 143 -8.710 -8.505 1.735 1.00 21.33 H new ATOM 2141 N ARG A 144 -13.162 -4.587 -0.700 1.00 52.11 N ATOM 2142 CA ARG A 144 -13.216 -5.354 -1.941 1.00 73.23 C ATOM 2143 C ARG A 144 -13.362 -4.478 -3.199 1.00 73.10 C ATOM 2144 O ARG A 144 -13.744 -5.011 -4.239 1.00 32.44 O ATOM 2145 CB ARG A 144 -14.250 -6.491 -1.798 1.00 23.05 C ATOM 2146 CG ARG A 144 -15.701 -6.056 -1.526 1.00 70.23 C ATOM 2147 CD ARG A 144 -16.588 -7.251 -1.120 1.00 1.32 C ATOM 2148 NE ARG A 144 -16.690 -8.312 -2.140 1.00 62.20 N ATOM 2149 CZ ARG A 144 -17.233 -8.227 -3.359 1.00 44.42 C ATOM 2150 NH1 ARG A 144 -17.747 -7.100 -3.830 1.00 44.33 N ATOM 2151 NH2 ARG A 144 -17.297 -9.300 -4.134 1.00 42.32 N ATOM 0 H ARG A 144 -14.037 -4.105 -0.495 1.00 52.11 H new ATOM 0 HA ARG A 144 -12.249 -5.829 -2.108 1.00 73.23 H new ATOM 0 HB2 ARG A 144 -14.235 -7.085 -2.712 1.00 23.05 H new ATOM 0 HB3 ARG A 144 -13.930 -7.146 -0.987 1.00 23.05 H new ATOM 0 HG2 ARG A 144 -15.714 -5.307 -0.734 1.00 70.23 H new ATOM 0 HG3 ARG A 144 -16.113 -5.584 -2.418 1.00 70.23 H new ATOM 0 HD2 ARG A 144 -16.193 -7.685 -0.201 1.00 1.32 H new ATOM 0 HD3 ARG A 144 -17.589 -6.884 -0.895 1.00 1.32 H new ATOM 0 HE ARG A 144 -16.300 -9.219 -1.885 1.00 62.20 H new ATOM 0 HH11 ARG A 144 -17.737 -6.256 -3.257 1.00 44.33 H new ATOM 0 HH12 ARG A 144 -18.152 -7.076 -4.766 1.00 44.33 H new ATOM 0 HH21 ARG A 144 -16.932 -10.192 -3.801 1.00 42.32 H new ATOM 0 HH22 ARG A 144 -17.711 -9.234 -5.064 1.00 42.32 H new ATOM 2165 N PHE A 145 -13.079 -3.165 -3.138 1.00 2.15 N ATOM 2166 CA PHE A 145 -13.207 -2.264 -4.302 1.00 53.04 C ATOM 2167 C PHE A 145 -12.057 -1.252 -4.502 1.00 31.32 C ATOM 2168 O PHE A 145 -12.121 -0.438 -5.425 1.00 61.50 O ATOM 2169 CB PHE A 145 -14.571 -1.539 -4.241 1.00 74.52 C ATOM 2170 CG PHE A 145 -15.783 -2.375 -4.629 1.00 54.40 C ATOM 2171 CD1 PHE A 145 -15.785 -3.133 -5.818 1.00 12.12 C ATOM 2172 CD2 PHE A 145 -16.943 -2.350 -3.831 1.00 74.23 C ATOM 2173 CE1 PHE A 145 -16.917 -3.885 -6.174 1.00 24.33 C ATOM 2174 CE2 PHE A 145 -18.080 -3.093 -4.198 1.00 24.12 C ATOM 2175 CZ PHE A 145 -18.066 -3.866 -5.369 1.00 32.34 C ATOM 0 H PHE A 145 -12.758 -2.699 -2.289 1.00 2.15 H new ATOM 0 HA PHE A 145 -13.143 -2.910 -5.178 1.00 53.04 H new ATOM 0 HB2 PHE A 145 -14.719 -1.168 -3.227 1.00 74.52 H new ATOM 0 HB3 PHE A 145 -14.528 -0.669 -4.896 1.00 74.52 H new ATOM 0 HD1 PHE A 145 -14.914 -3.135 -6.457 1.00 12.12 H new ATOM 0 HD2 PHE A 145 -16.960 -1.755 -2.930 1.00 74.23 H new ATOM 0 HE1 PHE A 145 -16.903 -4.482 -7.074 1.00 24.33 H new ATOM 0 HE2 PHE A 145 -18.964 -3.068 -3.578 1.00 24.12 H new ATOM 0 HZ PHE A 145 -18.935 -4.443 -5.649 1.00 32.34 H new ATOM 2185 N ILE A 146 -11.009 -1.263 -3.679 1.00 24.34 N ATOM 2186 CA ILE A 146 -9.917 -0.290 -3.694 1.00 70.42 C ATOM 2187 C ILE A 146 -8.671 -1.063 -4.143 1.00 54.30 C ATOM 2188 O ILE A 146 -8.149 -1.903 -3.404 1.00 10.34 O ATOM 2189 CB ILE A 146 -9.744 0.382 -2.303 1.00 2.04 C ATOM 2190 CG1 ILE A 146 -11.057 0.881 -1.656 1.00 41.20 C ATOM 2191 CG2 ILE A 146 -8.793 1.579 -2.382 1.00 54.04 C ATOM 2192 CD1 ILE A 146 -10.915 1.048 -0.139 1.00 74.23 C ATOM 0 H ILE A 146 -10.893 -1.975 -2.958 1.00 24.34 H new ATOM 0 HA ILE A 146 -10.115 0.534 -4.379 1.00 70.42 H new ATOM 0 HB ILE A 146 -9.342 -0.415 -1.677 1.00 2.04 H new ATOM 0 HG12 ILE A 146 -11.343 1.834 -2.102 1.00 41.20 H new ATOM 0 HG13 ILE A 146 -11.859 0.175 -1.871 1.00 41.20 H new ATOM 0 HG21 ILE A 146 -8.691 2.029 -1.394 1.00 54.04 H new ATOM 0 HG22 ILE A 146 -7.816 1.245 -2.731 1.00 54.04 H new ATOM 0 HG23 ILE A 146 -9.194 2.317 -3.077 1.00 54.04 H new ATOM 0 HD11 ILE A 146 -11.858 1.400 0.278 1.00 74.23 H new ATOM 0 HD12 ILE A 146 -10.655 0.089 0.310 1.00 74.23 H new ATOM 0 HD13 ILE A 146 -10.130 1.774 0.075 1.00 74.23 H new ATOM 2204 N ASP A 147 -8.236 -0.824 -5.377 1.00 72.32 N ATOM 2205 CA ASP A 147 -7.132 -1.500 -6.051 1.00 42.04 C ATOM 2206 C ASP A 147 -6.376 -0.500 -6.947 1.00 30.15 C ATOM 2207 O ASP A 147 -6.242 -0.679 -8.160 1.00 50.12 O ATOM 2208 CB ASP A 147 -7.554 -2.829 -6.737 1.00 4.44 C ATOM 2209 CG ASP A 147 -8.973 -2.916 -7.318 1.00 64.44 C ATOM 2210 OD1 ASP A 147 -9.229 -2.488 -8.469 1.00 23.32 O ATOM 2211 OD2 ASP A 147 -9.851 -3.523 -6.658 1.00 22.25 O ATOM 0 H ASP A 147 -8.669 -0.113 -5.967 1.00 72.32 H new ATOM 0 HA ASP A 147 -6.416 -1.842 -5.304 1.00 42.04 H new ATOM 0 HB2 ASP A 147 -6.849 -3.028 -7.544 1.00 4.44 H new ATOM 0 HB3 ASP A 147 -7.440 -3.632 -6.009 1.00 4.44 H new ATOM 2216 N LYS A 148 -5.846 0.566 -6.317 1.00 2.31 N ATOM 2217 CA LYS A 148 -4.785 1.458 -6.821 1.00 24.31 C ATOM 2218 C LYS A 148 -4.275 2.367 -5.695 1.00 71.41 C ATOM 2219 O LYS A 148 -5.083 2.772 -4.853 1.00 25.55 O ATOM 2220 CB LYS A 148 -5.327 2.342 -7.957 1.00 11.04 C ATOM 2221 CG LYS A 148 -4.688 1.969 -9.292 1.00 74.32 C ATOM 2222 CD LYS A 148 -3.417 2.787 -9.576 1.00 32.15 C ATOM 2223 CE LYS A 148 -2.147 1.956 -9.763 1.00 70.54 C ATOM 2224 NZ LYS A 148 -2.238 0.972 -10.863 1.00 74.51 N ATOM 0 H LYS A 148 -6.166 0.843 -5.389 1.00 2.31 H new ATOM 0 HA LYS A 148 -3.969 0.838 -7.193 1.00 24.31 H new ATOM 0 HB2 LYS A 148 -6.409 2.231 -8.024 1.00 11.04 H new ATOM 0 HB3 LYS A 148 -5.127 3.390 -7.734 1.00 11.04 H new ATOM 0 HG2 LYS A 148 -4.442 0.907 -9.291 1.00 74.32 H new ATOM 0 HG3 LYS A 148 -5.408 2.129 -10.095 1.00 74.32 H new ATOM 0 HD2 LYS A 148 -3.579 3.384 -10.474 1.00 32.15 H new ATOM 0 HD3 LYS A 148 -3.260 3.485 -8.753 1.00 32.15 H new ATOM 0 HE2 LYS A 148 -1.310 2.627 -9.955 1.00 70.54 H new ATOM 0 HE3 LYS A 148 -1.927 1.430 -8.834 1.00 70.54 H new ATOM 0 HZ1 LYS A 148 -1.317 0.505 -10.988 1.00 74.51 H new ATOM 0 HZ2 LYS A 148 -2.960 0.259 -10.632 1.00 74.51 H new ATOM 0 HZ3 LYS A 148 -2.501 1.459 -11.743 1.00 74.51 H new ATOM 2238 N ILE A 149 -2.991 2.741 -5.702 1.00 11.21 N ATOM 2239 CA ILE A 149 -2.425 3.900 -4.998 1.00 45.43 C ATOM 2240 C ILE A 149 -1.434 4.545 -5.968 1.00 43.25 C ATOM 2241 O ILE A 149 -0.801 3.846 -6.758 1.00 45.41 O ATOM 2242 CB ILE A 149 -1.715 3.506 -3.672 1.00 54.23 C ATOM 2243 CG1 ILE A 149 -2.694 2.887 -2.654 1.00 62.21 C ATOM 2244 CG2 ILE A 149 -0.992 4.672 -2.967 1.00 45.25 C ATOM 2245 CD1 ILE A 149 -2.608 1.360 -2.649 1.00 43.14 C ATOM 0 H ILE A 149 -2.284 2.221 -6.222 1.00 11.21 H new ATOM 0 HA ILE A 149 -3.221 4.586 -4.710 1.00 45.43 H new ATOM 0 HB ILE A 149 -0.969 2.778 -3.989 1.00 54.23 H new ATOM 0 HG12 ILE A 149 -2.473 3.268 -1.657 1.00 62.21 H new ATOM 0 HG13 ILE A 149 -3.712 3.194 -2.894 1.00 62.21 H new ATOM 0 HG21 ILE A 149 -0.524 4.310 -2.051 1.00 45.25 H new ATOM 0 HG22 ILE A 149 -0.227 5.079 -3.628 1.00 45.25 H new ATOM 0 HG23 ILE A 149 -1.713 5.452 -2.722 1.00 45.25 H new ATOM 0 HD11 ILE A 149 -3.312 0.958 -1.920 1.00 43.14 H new ATOM 0 HD12 ILE A 149 -2.855 0.978 -3.640 1.00 43.14 H new ATOM 0 HD13 ILE A 149 -1.596 1.053 -2.384 1.00 43.14 H new ATOM 2257 N THR A 150 -1.251 5.857 -5.868 1.00 33.31 N ATOM 2258 CA THR A 150 -0.242 6.635 -6.567 1.00 2.03 C ATOM 2259 C THR A 150 0.185 7.747 -5.599 1.00 54.03 C ATOM 2260 O THR A 150 -0.545 8.074 -4.661 1.00 73.32 O ATOM 2261 CB THR A 150 -0.804 7.163 -7.906 1.00 43.24 C ATOM 2262 OG1 THR A 150 -2.150 7.576 -7.765 1.00 71.35 O ATOM 2263 CG2 THR A 150 -0.784 6.123 -9.035 1.00 30.30 C ATOM 0 H THR A 150 -1.836 6.435 -5.264 1.00 33.31 H new ATOM 0 HA THR A 150 0.630 6.041 -6.841 1.00 2.03 H new ATOM 0 HB THR A 150 -0.148 7.993 -8.169 1.00 43.24 H new ATOM 0 HG1 THR A 150 -2.482 7.908 -8.625 1.00 71.35 H new ATOM 0 HG21 THR A 150 -1.193 6.565 -9.944 1.00 30.30 H new ATOM 0 HG22 THR A 150 0.242 5.803 -9.217 1.00 30.30 H new ATOM 0 HG23 THR A 150 -1.387 5.262 -8.747 1.00 30.30 H new ATOM 2271 N ILE A 151 1.375 8.317 -5.769 1.00 63.21 N ATOM 2272 CA ILE A 151 1.900 9.357 -4.892 1.00 45.35 C ATOM 2273 C ILE A 151 2.433 10.452 -5.805 1.00 13.41 C ATOM 2274 O ILE A 151 3.022 10.137 -6.841 1.00 30.11 O ATOM 2275 CB ILE A 151 2.991 8.773 -3.971 1.00 65.54 C ATOM 2276 CG1 ILE A 151 2.439 7.685 -3.023 1.00 52.32 C ATOM 2277 CG2 ILE A 151 3.646 9.866 -3.111 1.00 64.25 C ATOM 2278 CD1 ILE A 151 3.103 6.337 -3.274 1.00 74.15 C ATOM 0 H ILE A 151 2.008 8.066 -6.528 1.00 63.21 H new ATOM 0 HA ILE A 151 1.136 9.765 -4.230 1.00 45.35 H new ATOM 0 HB ILE A 151 3.730 8.327 -4.637 1.00 65.54 H new ATOM 0 HG12 ILE A 151 2.603 7.985 -1.988 1.00 52.32 H new ATOM 0 HG13 ILE A 151 1.362 7.593 -3.161 1.00 52.32 H new ATOM 0 HG21 ILE A 151 4.410 9.419 -2.474 1.00 64.25 H new ATOM 0 HG22 ILE A 151 4.105 10.613 -3.759 1.00 64.25 H new ATOM 0 HG23 ILE A 151 2.888 10.342 -2.489 1.00 64.25 H new ATOM 0 HD11 ILE A 151 2.691 5.595 -2.590 1.00 74.15 H new ATOM 0 HD12 ILE A 151 2.917 6.026 -4.302 1.00 74.15 H new ATOM 0 HD13 ILE A 151 4.177 6.424 -3.110 1.00 74.15 H new ATOM 2290 N ASP A 152 2.214 11.713 -5.439 1.00 1.44 N ATOM 2291 CA ASP A 152 2.653 12.884 -6.200 1.00 3.31 C ATOM 2292 C ASP A 152 4.154 13.108 -6.064 1.00 12.41 C ATOM 2293 O ASP A 152 4.608 13.544 -4.985 1.00 3.00 O ATOM 2294 CB ASP A 152 1.899 14.134 -5.744 1.00 4.13 C ATOM 2295 CG ASP A 152 2.081 15.251 -6.762 1.00 52.34 C ATOM 2296 OD1 ASP A 152 1.484 15.128 -7.856 1.00 3.44 O ATOM 2297 OD2 ASP A 152 2.699 16.292 -6.441 1.00 25.14 O ATOM 0 H ASP A 152 1.714 11.956 -4.584 1.00 1.44 H new ATOM 0 HA ASP A 152 2.431 12.694 -7.250 1.00 3.31 H new ATOM 0 HB2 ASP A 152 0.839 13.907 -5.626 1.00 4.13 H new ATOM 0 HB3 ASP A 152 2.266 14.455 -4.769 1.00 4.13 H new