Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3rsr_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): THR 2.A OG1 THR 3.A O no hydrogen 3.563 N/A THR 2.A OG1 ALA 76.A O no hydrogen 3.091 N/A GLN 5.A NE2 ASN 44.A OD1 no hydrogen 3.222 N/A SER 7.A OG ASN 44.A OD1 no hydrogen 2.733 N/A LYS 8.A N GLN 5.A O no hydrogen 3.019 N/A LYS 8.A NZ ASP 12.A OD1 no hydrogen 2.957 N/A LYS 8.A NZ ASP 12.A OD2 no hydrogen 2.881 N/A VAL 9.A N GLN 5.A O no hydrogen 3.045 N/A VAL 10.A N PHE 6.A O no hydrogen 2.836 N/A GLU 11.A N SER 7.A O no hydrogen 2.946 N/A ASP 12.A N LYS 8.A O no hydrogen 2.871 N/A LEU 13.A N VAL 9.A O no hydrogen 2.991 N/A TYR 14.A N VAL 10.A O no hydrogen 2.822 N/A TYR 14.A OH ASP 30.A OD1 no hydrogen 2.835 N/A ARG 15.A N GLU 11.A O no hydrogen 2.895 N/A ARG 15.A NE GLU 11.A OE2 no hydrogen 2.959 N/A ARG 15.A NH2 TYR 33.A OH no hydrogen 3.065 N/A ASN 18.A N LYS 23.A O no hydrogen 2.639 N/A ASN 18.A ND2 THR 21.A OG1 no hydrogen 2.524 N/A THR 21.A OG1 ASN 18.A O no hydrogen 3.509 N/A GLY 22.A N ALA 19.A O no hydrogen 3.253 N/A LYS 23.A N THR 21.A OG1 no hydrogen 3.290 N/A ALA 25.A N TYR 16.A O no hydrogen 2.882 N/A MET 27.A N LEU 13.A O no hydrogen 2.882 N/A SER 29.A N GLY 121.A O no hydrogen 3.053 N/A SER 29.A OG GLY 121.A O no hydrogen 3.337 N/A VAL 32.A N SER 29.A OG no hydrogen 3.192 N/A TYR 33.A N SER 29.A O no hydrogen 2.852 N/A TYR 33.A OH GLU 11.A OE1 no hydrogen 2.524 N/A ASN 34.A N ASP 30.A O no hydrogen 2.849 N/A ILE 35.A N ASP 31.A O no hydrogen 3.315 N/A VAL 36.A N VAL 32.A O no hydrogen 2.991 N/A MET 37.A N TYR 33.A O no hydrogen 3.145 N/A GLU 38.A N ASN 34.A O no hydrogen 3.064 N/A ASN 39.A N ILE 35.A O no hydrogen 3.151 N/A ASN 39.A N VAL 36.A O no hydrogen 3.252 N/A ASN 39.A ND2 ILE 35.A O no hydrogen 2.679 N/A LEU 43.A N ASN 39.A O no hydrogen 2.876 N/A ASN 44.A N LYS 40.A O no hydrogen 2.864 N/A SER 45.A N ASP 41.A O no hydrogen 3.236 N/A SER 45.A OG ASP 41.A O no hydrogen 2.579 N/A SER 45.A OG LYS 42.A O no hydrogen 3.468 N/A ALA 46.A N LYS 42.A O no hydrogen 3.272 N/A VAL 48.A N TYR 102.A OH no hydrogen 2.979 N/A TYR 49.A OH HIS 81.A NE2 no hydrogen 2.973 N/A ARG 51.A N VAL 48.A O no hydrogen 3.211 N/A ARG 51.A NH1 SER 106.A OG no hydrogen 2.921 N/A ASP 52.A N TYR 49.A O no hydrogen 3.207 N/A PHE 53.A N ASP 50.A O no hydrogen 3.041 N/A GLN 54.A N ARG 51.A O no hydrogen 3.181 N/A GLY 59.A N SER 56.A OG no hydrogen 2.851 N/A PHE 60.A N SER 56.A O no hydrogen 2.748 N/A LYS 61.A N TYR 57.A O no hydrogen 3.048 N/A THR 62.A N PHE 58.A O no hydrogen 3.138 N/A THR 62.A OG1 PHE 58.A O no hydrogen 2.887 N/A LEU 63.A N GLY 59.A O no hydrogen 3.233 N/A GLU 64.A N PHE 60.A O no hydrogen 2.755 N/A ARG 65.A N LYS 61.A O no hydrogen 2.900 N/A SER 66.A N THR 62.A O no hydrogen 3.328 N/A SER 66.A N LEU 63.A O no hydrogen 3.331 N/A TYR 67.A N LEU 63.A O no hydrogen 2.757 N/A TYR 67.A OH SER 114.A OG no hydrogen 2.609 N/A LEU 68.A N LEU 63.A O no hydrogen 3.063 N/A LEU 69.A N GLU 77.A OE1 no hydrogen 2.873 N/A ARG 70.A NH1 GLY 73.A O no hydrogen 3.124 N/A ARG 70.A NH2 GLU 64.A O no hydrogen 2.863 N/A ILE 71.A N GLN 74.A O no hydrogen 2.560 N/A GLN 74.A N ILE 71.A O no hydrogen 2.902 N/A ALA 76.A N LEU 69.A O no hydrogen 2.921 N/A GLU 77.A N LEU 69.A O no hydrogen 3.344 N/A ARG 78.A N HIS 81.A ND1 no hydrogen 2.907 N/A ARG 78.A NH2 THR 2.A O no hydrogen 3.040 N/A GLN 80.A NE2 ASP 52.A OD1 no hydrogen 2.806 N/A HIS 81.A NE2 LYS 4.A O no hydrogen 2.897 N/A HIS 81.A NE2 TYR 49.A OH no hydrogen 2.973 N/A LEU 82.A N ARG 78.A O no hydrogen 3.100 N/A ILE 83.A N PRO 79.A O no hydrogen 2.995 N/A MET 84.A N GLN 80.A O no hydrogen 3.070 N/A ARG 85.A N HIS 81.A O no hydrogen 2.819 N/A ARG 85.A NE GLU 77.A OE2 no hydrogen 2.569 N/A ARG 85.A NH1 LEU 117.A O no hydrogen 2.961 N/A ARG 85.A NH1 ALA 120.A O no hydrogen 2.933 N/A ARG 85.A NH2 GLU 77.A OE1 no hydrogen 2.960 N/A ARG 85.A NH2 GLU 77.A OE2 no hydrogen 3.415 N/A ARG 85.A NH2 LEU 117.A O no hydrogen 3.181 N/A VAL 86.A N LEU 82.A O no hydrogen 2.770 N/A ALA 87.A N ILE 83.A O no hydrogen 2.826 N/A LEU 88.A N MET 84.A O no hydrogen 2.938 N/A GLY 89.A N ARG 85.A O no hydrogen 2.855 N/A ILE 90.A N VAL 86.A O no hydrogen 2.995 N/A HIS 91.A N ALA 87.A O no hydrogen 2.934 N/A HIS 91.A NE2 THR 101.A OG1 no hydrogen 2.788 N/A GLY 92.A N LEU 88.A O no hydrogen 2.707 N/A ASP 94.A N HIS 91.A O no hydrogen 3.248 N/A ALA 97.A N ASP 94.A OD1 no hydrogen 2.812 N/A ALA 98.A N ASP 94.A O no hydrogen 2.904 N/A LEU 99.A N ILE 95.A O no hydrogen 2.804 N/A GLU 100.A N GLU 96.A O no hydrogen 3.077 N/A THR 101.A N ALA 97.A O no hydrogen 2.923 N/A THR 101.A OG1 HIS 91.A NE2 no hydrogen 2.788 N/A THR 101.A OG1 ALA 97.A O no hydrogen 3.562 N/A THR 101.A OG1 ASN 369.A OD1 no hydrogen 3.237 N/A TYR 102.A N ALA 98.A O no hydrogen 2.732 N/A TYR 102.A OH GLN 80.A OE1 no hydrogen 2.600 N/A ASN 103.A N LEU 99.A O no hydrogen 2.787 N/A LEU 104.A N GLU 100.A O no hydrogen 2.940 N/A MET 105.A N THR 101.A O no hydrogen 2.933 N/A SER 106.A N TYR 102.A O no hydrogen 2.948 N/A SER 106.A OG TYR 102.A O no hydrogen 2.706 N/A SER 106.A OG ASN 103.A O no hydrogen 2.916 N/A LEU 107.A N ASN 103.A O no hydrogen 2.901 N/A LYS 108.A N MET 105.A O no hydrogen 2.784 N/A LYS 108.A NZ GLN 54.A O no hydrogen 3.249 N/A LYS 108.A NZ LEU 502.A O no hydrogen 3.358 N/A TYR 109.A N LEU 104.A O no hydrogen 2.897 N/A THR 111.A N SER 339.A O no hydrogen 2.986 N/A THR 111.A OG1 HIS 112.A O no hydrogen 3.325 N/A ALA 113.A N LEU 337.A O no hydrogen 3.308 N/A SER 114.A OG TYR 67.A OH no hydrogen 2.609 N/A THR 116.A N ALA 113.A O no hydrogen 2.950 N/A THR 116.A OG1 MET 127.A O no hydrogen 2.767 N/A LEU 117.A N ALA 113.A O no hydrogen 3.202 N/A PHE 118.A N SER 114.A O no hydrogen 2.858 N/A ASN 119.A N PRO 115.A O no hydrogen 2.851 N/A ALA 120.A N THR 116.A O no hydrogen 2.821 N/A THR 122.A N ASN 119.A O no hydrogen 2.992 N/A THR 122.A OG1 ASN 119.A O no hydrogen 2.791 N/A GLN 126.A N LYS 124.A O no hydrogen 2.715 N/A MET 127.A N ASN 377.A OD1 no hydrogen 2.805 N/A SER 128.A N GLN 126.A OE1 no hydrogen 2.887 N/A SER 128.A OG ASN 336.A OD1 no hydrogen 2.807 N/A SER 129.A N CYS 335.A O no hydrogen 2.791 N/A PHE 131.A N GLY 159.A O no hydrogen 2.923 N/A LEU 132.A N ALA 333.A O no hydrogen 2.713 N/A VAL 133.A N GLY 161.A O no hydrogen 2.745 N/A MET 135.A N HIS 163.A O no hydrogen 3.380 N/A LYS 136.A N THR 146.A OG1 no hydrogen 3.044 N/A LYS 136.A NZ GLU 149.A OE1 no hydrogen 3.375 N/A LYS 136.A NZ PRO 329.A O no hydrogen 2.932 N/A LYS 136.A NZ GLU 383.A OE2 no hydrogen 2.746 N/A SER 139.A OG GLU 137.A OE1 no hydrogen 3.148 N/A GLY 142.A N SER 139.A OG no hydrogen 2.949 N/A ILE 143.A N SER 139.A O no hydrogen 2.888 N/A TYR 144.A N ILE 140.A O no hydrogen 2.893 N/A ASP 145.A N GLU 141.A O no hydrogen 2.885 N/A THR 146.A N GLY 142.A O no hydrogen 2.964 N/A THR 146.A OG1 GLY 142.A O no hydrogen 2.588 N/A LEU 147.A N ILE 143.A O no hydrogen 2.860 N/A LYS 148.A N TYR 144.A O no hydrogen 3.079 N/A GLU 149.A N ASP 145.A O no hydrogen 3.063 N/A CYS 150.A N THR 146.A O no hydrogen 2.926 N/A CYS 150.A SG THR 146.A O no hydrogen 3.349 N/A ALA 151.A N LEU 147.A O no hydrogen 2.924 N/A LEU 152.A N LYS 148.A O no hydrogen 2.973 N/A ILE 153.A N GLU 149.A O no hydrogen 2.959 N/A SER 154.A N CYS 150.A O no hydrogen 2.924 N/A SER 154.A OG CYS 150.A O no hydrogen 2.718 N/A LYS 155.A N LEU 152.A O no hydrogen 3.186 N/A THR 156.A N ILE 153.A O no hydrogen 2.954 N/A THR 156.A OG1 ILE 153.A O no hydrogen 2.849 N/A THR 156.A OG1 ALA 157.A O no hydrogen 2.767 N/A GLY 159.A N SER 129.A O no hydrogen 3.040 N/A GLY 161.A N PHE 131.A O no hydrogen 2.893 N/A LEU 162.A N ALA 200.A O no hydrogen 2.902 N/A HIS 163.A N VAL 133.A O no hydrogen 3.292 N/A HIS 163.A NE2 SER 327.A OG no hydrogen 2.769 N/A ILE 164.A N TYR 202.A O no hydrogen 3.174 N/A HIS 165.A NE2 LYS 315.A O no hydrogen 2.847 N/A ASN 166.A ND2 MET 135.A O no hydrogen 3.208 N/A ILE 167.A N ILE 164.A O no hydrogen 3.160 N/A ARG 168.A N ASP 138.A OD1 no hydrogen 3.096 N/A ARG 168.A NE ASP 138.A OD2 no hydrogen 2.741 N/A ARG 168.A NH1 TYR 173.A O no hydrogen 2.802 N/A ARG 168.A NH2 ASP 138.A O no hydrogen 3.499 N/A ARG 168.A NH2 ASP 138.A OD2 no hydrogen 3.194 N/A SER 169.A N SER 244.A OG no hydrogen 3.371 N/A THR 170.A N ASP 209.A OD1 no hydrogen 3.178 N/A THR 170.A N ASP 209.A OD2 no hydrogen 3.297 N/A THR 170.A OG1 ASN 182.A O no hydrogen 3.513 N/A THR 170.A OG1 ASP 209.A OD1 no hydrogen 2.735 N/A GLY 171.A N SER 181.A O no hydrogen 2.693 N/A SER 172.A N SER 169.A O no hydrogen 3.059 N/A SER 172.A OG SER 169.A O no hydrogen 2.851 N/A SER 172.A OG SER 244.A OG no hydrogen 2.822 N/A TYR 173.A OH ASN 178.A OD1 no hydrogen 2.686 N/A ILE 174.A N GLY 179.A O no hydrogen 3.107 N/A ASN 178.A N ALA 175.A O no hydrogen 3.446 N/A GLY 179.A N THR 177.A OG1 no hydrogen 3.078 N/A SER 181.A N SER 172.A O no hydrogen 2.735 N/A GLY 183.A N SER 181.A OG no hydrogen 2.957 N/A LEU 184.A N ASP 209.A OD2 no hydrogen 3.123 N/A ILE 188.A N LEU 184.A O no hydrogen 2.818 N/A ARG 189.A N ILE 185.A O no hydrogen 3.064 N/A VAL 190.A N PRO 186.A O no hydrogen 3.367 N/A PHE 191.A N MET 187.A O no hydrogen 3.338 N/A ASN 192.A N ILE 188.A O no hydrogen 2.889 N/A ASN 193.A N ARG 189.A O no hydrogen 3.020 N/A THR 194.A N VAL 190.A O no hydrogen 3.059 N/A ALA 195.A N PHE 191.A O no hydrogen 2.885 N/A ARG 196.A N ASN 192.A O no hydrogen 2.994 N/A TYR 197.A N ASN 193.A O no hydrogen 2.975 N/A VAL 198.A N THR 194.A O no hydrogen 3.221 N/A ALA 200.A N ILE 160.A O no hydrogen 2.789 N/A LEU 201.A N PHE 221.A O no hydrogen 2.600 N/A TYR 202.A N LEU 162.A O no hydrogen 2.822 N/A TYR 202.A OH ASN 318.A O no hydrogen 2.787 N/A LEU 203.A N ALA 223.A O no hydrogen 3.102 N/A GLU 204.A N HIS 165.A ND1 no hydrogen 3.015 N/A TRP 206.A NE1 GLU 204.A OE1 no hydrogen 2.600 N/A HIS 207.A N GLU 204.A O no hydrogen 3.118 N/A HIS 207.A NE2 ILE 167.A O no hydrogen 2.673 N/A ALA 208.A N PHE 243.A O no hydrogen 2.950 N/A ASP 209.A N HIS 207.A ND1 no hydrogen 3.125 N/A ILE 210.A N HIS 207.A O no hydrogen 2.887 N/A PHE 213.A N ASP 209.A O no hydrogen 3.049 N/A ILE 214.A N ILE 210.A O no hydrogen 3.120 N/A ASP 215.A N ASP 212.A O no hydrogen 3.066 N/A ILE 216.A N PHE 213.A O no hydrogen 3.264 N/A ARG 217.A NH1 LEU 220.A O no hydrogen 3.267 N/A LYS 218.A N ASP 215.A O no hydrogen 3.021 N/A PHE 221.A N PHE 199.A O no hydrogen 2.710 N/A ALA 223.A N LEU 201.A O no hydrogen 2.718 N/A LEU 224.A N PHE 295.A O no hydrogen 2.784 N/A TRP 225.A N LEU 203.A O no hydrogen 2.980 N/A ILE 226.A N VAL 297.A O no hydrogen 2.887 N/A ASP 228.A N ASP 300.A OD2 no hydrogen 2.654 N/A PHE 230.A N PRO 227.A O no hydrogen 3.188 N/A LYS 232.A N ASP 228.A O no hydrogen 3.002 N/A LYS 232.A NZ GLU 260.A OE2 no hydrogen 3.235 N/A ARG 233.A N LEU 229.A O no hydrogen 2.988 N/A ARG 233.A NH1 THR 239.A O no hydrogen 2.933 N/A ARG 233.A NH1 GLU 267.A OE1 no hydrogen 3.448 N/A ARG 233.A NH1 GLU 267.A OE2 no hydrogen 3.145 N/A ARG 233.A NH2 GLU 267.A OE1 no hydrogen 2.765 N/A VAL 234.A N PHE 230.A O no hydrogen 2.987 N/A GLU 235.A N MET 231.A O no hydrogen 2.916 N/A GLU 236.A N LYS 232.A O no hydrogen 2.903 N/A ASN 237.A N VAL 234.A O no hydrogen 2.974 N/A GLY 238.A N ARG 233.A O no hydrogen 2.806 N/A TRP 240.A N ILE 275.A O no hydrogen 2.812 N/A TRP 240.A NE1 PRO 205.A O no hydrogen 2.955 N/A THR 241.A N TYR 263.A OH no hydrogen 2.829 N/A THR 241.A OG1 GLU 267.A OE2 no hydrogen 2.529 N/A THR 241.A OG1 THR 274.A OG1 no hydrogen 3.416 N/A LEU 242.A N LYS 273.A O no hydrogen 2.887 N/A PHE 243.A N TRP 206.A O no hydrogen 2.845 N/A SER 244.A OG SER 172.A OG no hydrogen 2.822 N/A SER 244.A OG THR 246.A OG1 no hydrogen 2.916 N/A THR 246.A N SER 244.A OG no hydrogen 3.397 N/A THR 246.A OG1 SER 244.A OG no hydrogen 2.916 N/A SER 247.A N SER 244.A O no hydrogen 2.974 N/A ALA 248.A N SER 244.A O no hydrogen 3.115 N/A ALA 248.A N PRO 245.A O no hydrogen 3.281 N/A ASP 253.A N GLY 250.A O no hydrogen 2.949 N/A CYS 254.A SG GLY 250.A O no hydrogen 3.645 N/A CYS 254.A SG LEU 251.A O no hydrogen 3.995 N/A GLY 256.A N ASP 300.A OD1 no hydrogen 2.835 N/A PHE 259.A N TYR 255.A O no hydrogen 3.276 N/A GLU 260.A N GLY 256.A O no hydrogen 3.082 N/A ALA 261.A N ASP 257.A O no hydrogen 3.089 N/A LEU 262.A N GLU 258.A O no hydrogen 3.154 N/A TYR 263.A N PHE 259.A O no hydrogen 2.697 N/A TYR 263.A OH THR 241.A O no hydrogen 2.657 N/A THR 264.A N GLU 260.A O no hydrogen 2.854 N/A THR 264.A OG1 GLU 260.A O no hydrogen 2.709 N/A ARG 265.A N ALA 261.A O no hydrogen 3.026 N/A ARG 265.A NE GLU 269.A OE2 no hydrogen 2.868 N/A TYR 266.A N LEU 262.A O no hydrogen 3.026 N/A TYR 266.A OH PRO 249.A O no hydrogen 2.625 N/A GLU 267.A N TYR 263.A O no hydrogen 2.912 N/A LYS 268.A N THR 264.A O no hydrogen 2.963 N/A GLU 269.A N ARG 265.A O no hydrogen 3.072 N/A GLY 270.A N GLU 267.A O no hydrogen 2.871 N/A ARG 271.A N TYR 266.A O no hydrogen 3.279 N/A ARG 271.A NE GLU 269.A OE1 no hydrogen 2.649 N/A ARG 271.A NH1 SER 247.A O no hydrogen 2.925 N/A ARG 271.A NH2 GLU 269.A OE1 no hydrogen 3.392 N/A LYS 273.A N LEU 242.A O no hydrogen 2.969 N/A THR 274.A OG1 THR 241.A OG1 no hydrogen 3.416 N/A ILE 275.A N TRP 240.A O no hydrogen 2.773 N/A LYS 276.A NZ ASN 237.A OD1 no hydrogen 3.073 N/A ALA 277.A N GLY 238.A O no hydrogen 2.944 N/A GLN 278.A NE2 VAL 234.A O no hydrogen 2.889 N/A LYS 279.A N LYS 276.A O no hydrogen 2.794 N/A TRP 281.A N ALA 277.A O no hydrogen 3.106 N/A TRP 281.A NE1 THR 589.A OG1 no hydrogen 3.136 N/A TYR 282.A N GLN 278.A O no hydrogen 2.793 N/A SER 283.A N LYS 279.A O no hydrogen 3.222 N/A SER 283.A OG LYS 279.A O no hydrogen 3.505 N/A ILE 284.A N LEU 280.A O no hydrogen 2.889 N/A LEU 285.A N TRP 281.A O no hydrogen 3.059 N/A GLU 286.A N TYR 282.A O no hydrogen 2.990 N/A ALA 287.A N SER 283.A O no hydrogen 2.974 N/A GLN 288.A N ILE 284.A O no hydrogen 2.908 N/A GLN 288.A NE2 PRO 294.A O no hydrogen 2.992 N/A THR 289.A N LEU 285.A O no hydrogen 2.877 N/A THR 289.A OG1 LEU 285.A O no hydrogen 2.768 N/A GLU 290.A N GLU 286.A O no hydrogen 3.225 N/A THR 291.A N ALA 287.A O no hydrogen 2.785 N/A THR 291.A OG1 ALA 287.A O no hydrogen 2.695 N/A THR 291.A OG1 THR 293.A OG1 no hydrogen 2.912 N/A GLY 292.A N GLN 288.A O no hydrogen 2.787 N/A THR 293.A N THR 291.A OG1 no hydrogen 3.184 N/A THR 293.A OG1 THR 291.A OG1 no hydrogen 2.912 N/A PHE 295.A N PRO 222.A O no hydrogen 3.161 N/A VAL 296.A N MET 604.A O no hydrogen 2.990 N/A VAL 297.A N LEU 224.A O no hydrogen 3.021 N/A TYR 298.A N LYS 601.A O no hydrogen 2.641 N/A TYR 298.A OH HIS 592.A O no hydrogen 3.348 N/A LYS 299.A N ILE 226.A O no hydrogen 2.908 N/A LYS 299.A NZ GLU 204.A OE2 no hydrogen 3.102 N/A LYS 299.A NZ LEU 251.A O no hydrogen 3.206 N/A LYS 299.A NZ CYS 254.A O no hydrogen 2.804 N/A CYS 302.A N TYR 298.A O no hydrogen 3.015 N/A CYS 302.A SG TYR 298.A O no hydrogen 3.367 N/A ASN 303.A N LYS 299.A O no hydrogen 3.104 N/A ASN 303.A ND2 LYS 299.A O no hydrogen 2.995 N/A ASN 303.A ND2 ILE 314.A O no hydrogen 3.070 N/A ARG 304.A N ASP 300.A O no hydrogen 2.906 N/A LYS 305.A N ALA 301.A O no hydrogen 3.217 N/A LYS 305.A NZ GLY 599.A O no hydrogen 2.644 N/A SER 306.A N ASN 303.A O no hydrogen 3.435 N/A ASN 307.A ND2 SER 489.A O no hydrogen 2.907 N/A GLN 308.A N SER 306.A OG no hydrogen 3.072 N/A GLN 308.A NE2 SER 489.A OG no hydrogen 2.975 N/A LYS 309.A N SER 306.A O no hydrogen 3.250 N/A LYS 309.A NZ ARG 304.A O no hydrogen 2.719 N/A LEU 311.A N GLN 308.A O no hydrogen 2.846 N/A ILE 314.A N ASN 303.A OD1 no hydrogen 2.776 N/A LYS 315.A NZ ASP 253.A OD1 no hydrogen 3.298 N/A LYS 315.A NZ VAL 313.A O no hydrogen 3.018 N/A SER 316.A OG SER 317.A O no hydrogen 3.128 N/A SER 317.A OG ASN 318.A OD1 no hydrogen 3.342 N/A SER 317.A OG ILE 323.A O no hydrogen 2.660 N/A ASN 318.A ND2 GLU 322.A OE1 no hydrogen 2.895 N/A CYS 320.A SG TYR 605.A OH no hydrogen 3.732 N/A CYS 321.A N ASN 318.A O no hydrogen 3.159 N/A CYS 321.A SG TYR 202.A OH no hydrogen 3.565 N/A CYS 321.A SG LEU 319.A O no hydrogen 4.016 N/A GLU 322.A N GLU 322.A OE1 no hydrogen 2.820 N/A ILE 323.A N ASN 318.A OD1 no hydrogen 2.957 N/A VAL 324.A N GLN 572.A OE1 no hydrogen 2.773 N/A TYR 326.A N GLN 308.A OE1 no hydrogen 2.791 N/A SER 327.A OG HIS 163.A NE2 no hydrogen 2.769 N/A ALA 328.A N GLU 331.A O no hydrogen 2.898 N/A GLU 331.A N ALA 328.A O no hydrogen 2.930 N/A THR 332.A N GLU 383.A O no hydrogen 2.975 N/A THR 332.A OG1 GLU 149.A OE2 no hydrogen 2.567 N/A ALA 333.A N LEU 132.A O no hydrogen 3.047 N/A CYS 335.A N CYS 130.A O no hydrogen 2.892 N/A ASN 336.A ND2 ASN 388.A OD1 no hydrogen 3.517 N/A ASN 336.A ND2 PRO 393.A O no hydrogen 2.772 N/A SER 339.A N THR 111.A O no hydrogen 2.983 N/A SER 339.A OG GLN 399.A OE1 no hydrogen 3.448 N/A VAL 340.A N GLY 397.A O no hydrogen 2.951 N/A ALA 341.A N TYR 109.A O no hydrogen 2.877 N/A LEU 342.A N GLN 399.A O no hydrogen 3.002 N/A ALA 344.A N ALA 341.A O no hydrogen 3.093 N/A PHE 345.A N LEU 342.A O no hydrogen 3.447 N/A ILE 346.A N PRO 343.A O no hydrogen 3.078 N/A GLU 347.A N THR 353.A O no hydrogen 2.684 N/A SER 349.A N THR 351.A O no hydrogen 2.734 N/A THR 351.A OG1 SER 349.A O no hydrogen 2.937 N/A THR 353.A N GLU 347.A O no hydrogen 2.577 N/A THR 353.A OG1 GLU 347.A O no hydrogen 3.322 N/A TYR 354.A OH LEU 342.A O no hydrogen 2.597 N/A ASN 355.A N PHE 345.A O no hydrogen 2.809 N/A ASN 355.A ND2 GLU 347.A OE2 no hydrogen 2.997 N/A LYS 358.A N ASN 355.A OD1 no hydrogen 2.996 N/A LYS 358.A NZ GLU 347.A OE2 no hydrogen 3.352 N/A LEU 359.A N ASN 355.A O no hydrogen 3.251 N/A HIS 360.A N PHE 356.A O no hydrogen 2.911 N/A HIS 360.A NE2 HIS 430.A ND1 no hydrogen 2.995 N/A GLU 361.A N LYS 357.A O no hydrogen 3.226 N/A ILE 362.A N LYS 358.A O no hydrogen 2.889 N/A ALA 363.A N LEU 359.A O no hydrogen 2.838 N/A LYS 364.A N HIS 360.A O no hydrogen 3.127 N/A LYS 364.A NZ GLU 434.A OE1 no hydrogen 3.056 N/A LYS 364.A NZ GLU 438.A OE1 no hydrogen 3.232 N/A LYS 364.A NZ GLU 438.A OE2 no hydrogen 2.701 N/A VAL 365.A N GLU 361.A O no hydrogen 3.141 N/A VAL 366.A N ILE 362.A O no hydrogen 3.078 N/A THR 367.A N ALA 363.A O no hydrogen 3.120 N/A THR 367.A OG1 ALA 363.A O no hydrogen 2.754 N/A ARG 368.A N LYS 364.A O no hydrogen 3.246 N/A ARG 368.A NH2 GLU 438.A OE1 no hydrogen 3.107 N/A ASN 369.A N VAL 365.A O no hydrogen 2.935 N/A ASN 369.A ND2 THR 101.A OG1 no hydrogen 3.094 N/A LEU 370.A N VAL 366.A O no hydrogen 2.867 N/A ASN 371.A N THR 367.A O no hydrogen 3.197 N/A ASN 371.A ND2 THR 367.A O no hydrogen 3.199 N/A ASN 371.A ND2 ASN 488.A OD1 no hydrogen 2.827 N/A ARG 372.A N ARG 368.A O no hydrogen 3.090 N/A ARG 372.A NH2 HIS 91.A O no hydrogen 2.783 N/A VAL 373.A N ASN 369.A O no hydrogen 2.890 N/A ILE 374.A N LEU 370.A O no hydrogen 3.139 N/A ASP 375.A N ASN 371.A O no hydrogen 3.433 N/A ARG 376.A N ARG 372.A O no hydrogen 2.861 N/A ARG 376.A NE GLY 89.A O no hydrogen 2.650 N/A ARG 376.A NH1 ASP 31.A OD2 no hydrogen 3.242 N/A ARG 376.A NH2 ASP 31.A OD2 no hydrogen 2.944 N/A ARG 376.A NH2 GLY 89.A O no hydrogen 3.185 N/A TYR 378.A N PRO 125.A O no hydrogen 2.936 N/A TYR 379.A OH ILE 374.A O no hydrogen 2.624 N/A GLU 383.A N GLU 383.A OE1 no hydrogen 2.682 N/A ALA 384.A N VAL 381.A O no hydrogen 3.155 N/A ARG 385.A N VAL 381.A O no hydrogen 3.384 N/A ARG 385.A NE GLU 382.A OE1 no hydrogen 3.142 N/A ARG 385.A NE GLU 382.A OE2 no hydrogen 3.264 N/A ARG 385.A NH2 GLU 382.A OE2 no hydrogen 2.810 N/A LYS 386.A N GLU 382.A O no hydrogen 2.928 N/A LYS 386.A NZ ASP 330.A OD2 no hydrogen 2.646 N/A SER 387.A N GLU 383.A O no hydrogen 3.103 N/A ASN 388.A N ALA 384.A O no hydrogen 2.998 N/A ASN 388.A ND2 ASN 336.A OD1 no hydrogen 3.137 N/A ASN 388.A ND2 TYR 379.A OH no hydrogen 2.886 N/A MET 389.A N ARG 385.A O no hydrogen 2.967 N/A ARG 390.A N LYS 386.A O no hydrogen 3.122 N/A ARG 390.A N SER 387.A O no hydrogen 3.246 N/A HIS 391.A N SER 387.A O no hydrogen 3.192 N/A HIS 391.A ND1 THR 448.A OG1 no hydrogen 2.888 N/A HIS 391.A NE2 GLU 331.A OE1 no hydrogen 2.776 N/A ARG 392.A N ASN 388.A O no hydrogen 2.869 N/A ARG 392.A NE ASN 371.A OD1 no hydrogen 3.467 N/A ARG 392.A NH1 ASP 375.A OD1 no hydrogen 2.937 N/A ARG 392.A NH2 ASN 371.A OD1 no hydrogen 2.938 N/A ARG 392.A NH2 ASP 375.A OD2 no hydrogen 3.177 N/A ILE 394.A N LEU 490.A O no hydrogen 2.996 N/A ALA 395.A N ASN 336.A O no hydrogen 3.032 N/A LEU 396.A N THR 491.A O no hydrogen 2.784 N/A GLY 397.A N ALA 338.A O no hydrogen 2.773 N/A GLN 399.A N VAL 340.A O no hydrogen 2.967 N/A GLY 400.A N ASN 505.A O no hydrogen 3.330 N/A THR 404.A N GLY 400.A O no hydrogen 2.897 N/A THR 404.A OG1 GLY 400.A O no hydrogen 2.718 N/A PHE 405.A N LEU 401.A O no hydrogen 3.026 N/A MET 406.A N ALA 402.A O no hydrogen 3.053 N/A LEU 407.A N ASP 403.A O no hydrogen 2.852 N/A LEU 408.A N THR 404.A O no hydrogen 3.107 N/A ARG 409.A N MET 406.A O no hydrogen 2.977 N/A ARG 409.A NH1 ASP 517.A OD2 no hydrogen 2.799 N/A ARG 409.A NH2 ASP 517.A OD1 no hydrogen 2.688 N/A ARG 409.A NH2 ASP 517.A OD2 no hydrogen 2.955 N/A LEU 410.A N PHE 405.A O no hydrogen 2.723 N/A SER 414.A N PRO 411.A O no hydrogen 3.075 N/A SER 414.A OG PRO 411.A O no hydrogen 2.732 N/A SER 414.A OG GLU 416.A OE1 no hydrogen 3.559 N/A ALA 417.A N SER 414.A OG no hydrogen 3.057 N/A ARG 418.A N SER 414.A O no hydrogen 3.008 N/A ARG 418.A NE GLU 415.A OE1 no hydrogen 2.961 N/A LEU 419.A N GLU 415.A O no hydrogen 3.168 N/A LEU 420.A N GLU 416.A O no hydrogen 3.030 N/A ASN 421.A N ALA 417.A O no hydrogen 2.827 N/A ASN 421.A ND2 MET 562.A O no hydrogen 3.012 N/A ILE 422.A N ARG 418.A O no hydrogen 3.354 N/A GLN 423.A N LEU 419.A O no hydrogen 2.946 N/A GLN 423.A NE2 TYR 469.A OH no hydrogen 3.227 N/A ILE 424.A N LEU 420.A O no hydrogen 2.885 N/A PHE 425.A N ASN 421.A O no hydrogen 3.270 N/A GLU 426.A N ILE 422.A O no hydrogen 3.072 N/A THR 427.A N GLN 423.A O no hydrogen 2.975 N/A THR 427.A OG1 GLN 423.A O no hydrogen 2.855 N/A ILE 428.A N ILE 424.A O no hydrogen 3.106 N/A TYR 429.A N PHE 425.A O no hydrogen 2.991 N/A HIS 430.A N GLU 426.A O no hydrogen 2.886 N/A HIS 430.A ND1 HIS 360.A NE2 no hydrogen 2.995 N/A HIS 430.A NE2 ASP 473.A O no hydrogen 3.191 N/A ALA 431.A N THR 427.A O no hydrogen 2.789 N/A SER 432.A N ILE 428.A O no hydrogen 2.883 N/A SER 432.A OG ILE 428.A O no hydrogen 3.078 N/A SER 432.A OG TYR 429.A O no hydrogen 3.140 N/A MET 433.A N TYR 429.A O no hydrogen 3.032 N/A GLU 434.A N HIS 430.A O no hydrogen 2.831 N/A ALA 435.A N ALA 431.A O no hydrogen 2.833 N/A SER 436.A N SER 432.A O no hydrogen 2.884 N/A SER 436.A OG ASN 488.A OD1 no hydrogen 2.867 N/A CYS 437.A N MET 433.A O no hydrogen 2.891 N/A CYS 437.A SG GLN 441.A OE1 no hydrogen 3.743 N/A CYS 437.A SG GLY 485.A O no hydrogen 3.549 N/A GLU 438.A N GLU 434.A O no hydrogen 2.970 N/A LEU 439.A N ALA 435.A O no hydrogen 2.979 N/A ALA 440.A N SER 436.A O no hydrogen 2.997 N/A GLN 441.A N CYS 437.A O no hydrogen 3.042 N/A LYS 442.A N GLU 438.A O no hydrogen 3.149 N/A ASP 443.A N LEU 439.A O no hydrogen 2.678 N/A GLY 444.A N ALA 440.A O no hydrogen 2.813 N/A TYR 446.A N VAL 486.A O no hydrogen 3.305 N/A GLU 447.A N ARG 390.A O no hydrogen 3.243 N/A THR 448.A OG1 HIS 391.A ND1 no hydrogen 2.888 N/A PHE 449.A N TYR 446.A O no hydrogen 3.122 N/A GLY 451.A N SER 455.A OG no hydrogen 3.119 N/A SER 452.A N PHE 449.A O no hydrogen 3.141 N/A SER 452.A OG PHE 449.A O no hydrogen 2.704 N/A ALA 454.A N ASN 307.A OD1 no hydrogen 2.774 N/A SER 455.A N SER 452.A O no hydrogen 2.909 N/A SER 455.A N SER 452.A OG no hydrogen 3.213 N/A SER 455.A OG SER 452.A O no hydrogen 2.684 N/A GLN 456.A N SER 452.A O no hydrogen 3.300 N/A GLN 456.A N PRO 453.A O no hydrogen 2.889 N/A GLN 456.A NE2 SER 455.A OG no hydrogen 3.108 N/A GLY 457.A N ALA 454.A O no hydrogen 3.183 N/A ILE 458.A N PRO 453.A O no hydrogen 2.929 N/A LEU 459.A N ASP 462.A OD2 no hydrogen 2.832 N/A GLN 460.A N TYR 429.A OH no hydrogen 3.020 N/A GLN 460.A NE2 LYS 305.A O no hydrogen 2.897 N/A MET 463.A N GLN 460.A O no hydrogen 2.868 N/A TRP 464.A N PHE 461.A O no hydrogen 3.179 N/A TRP 464.A NE1 GLN 460.A OE1 no hydrogen 2.806 N/A ASP 465.A N ASP 462.A O no hydrogen 2.915 N/A GLN 466.A N PHE 461.A O no hydrogen 2.996 N/A TYR 469.A N TYR 569.A OH no hydrogen 2.820 N/A GLY 470.A N GLU 426.A OE2 no hydrogen 2.779 N/A MET 471.A N GLU 426.A OE1 no hydrogen 3.126 N/A TRP 472.A NE1 THR 427.A OG1 no hydrogen 2.807 N/A TRP 474.A NE1 GLU 426.A OE2 no hydrogen 2.736 N/A THR 476.A N ASP 473.A OD1 no hydrogen 3.117 N/A THR 476.A OG1 ASP 473.A OD2 no hydrogen 2.571 N/A ARG 478.A N TRP 474.A O no hydrogen 2.691 N/A ARG 478.A NH2 ASP 475.A OD1 no hydrogen 2.931 N/A LYS 479.A N ASP 475.A O no hydrogen 2.868 N/A ASP 480.A N THR 476.A O no hydrogen 2.982 N/A ILE 481.A N LEU 477.A O no hydrogen 2.951 N/A MET 482.A N ARG 478.A O no hydrogen 3.115 N/A LYS 483.A N LYS 479.A O no hydrogen 3.058 N/A HIS 484.A N ASP 480.A O no hydrogen 2.591 N/A GLY 485.A N ILE 481.A O no hydrogen 2.641 N/A ARG 487.A N SER 436.A O no hydrogen 3.058 N/A ARG 487.A N SER 436.A OG no hydrogen 2.933 N/A ARG 487.A NH1 GLY 444.A O no hydrogen 2.872 N/A ASN 488.A N SER 436.A OG no hydrogen 3.050 N/A ASN 488.A ND2 ASN 371.A OD1 no hydrogen 2.888 N/A ASN 488.A ND2 ARG 392.A O no hydrogen 2.733 N/A SER 489.A N HIS 391.A O no hydrogen 2.986 N/A SER 489.A OG HIS 391.A O no hydrogen 2.630 N/A THR 491.A N ASP 571.A OD2 no hydrogen 2.716 N/A THR 491.A OG1 ASP 571.A OD2 no hydrogen 2.531 N/A ALA 493.A N LEU 396.A O no hydrogen 3.215 N/A THR 497.A OG1 PRO 496.A O no hydrogen 2.554 N/A SER 499.A N THR 497.A O no hydrogen 3.220 N/A SER 499.A OG THR 497.A O no hydrogen 3.053 N/A LEU 502.A N THR 498.A O no hydrogen 3.413 N/A TYR 504.A N SER 499.A O no hydrogen 2.934 N/A ASN 505.A N ASP 403.A OD1 no hydrogen 2.810 N/A ASN 505.A N ASP 403.A OD2 no hydrogen 3.362 N/A ASN 505.A ND2 GLU 506.A O no hydrogen 3.696 N/A ASN 505.A ND2 GLU 509.A O no hydrogen 3.504 N/A CYS 507.A N THR 497.A OG1 no hydrogen 3.359 N/A TYR 513.A OH ASP 403.A OD2 no hydrogen 2.507 N/A LEU 514.A N ASN 511.A OD1 no hydrogen 2.965 N/A LEU 515.A N ASN 511.A O no hydrogen 2.815 N/A ARG 516.A N PRO 512.A O no hydrogen 2.927 N/A ASP 517.A N TYR 513.A O no hydrogen 3.283 N/A LEU 518.A N LEU 514.A O no hydrogen 2.905 N/A VAL 519.A N LEU 515.A O no hydrogen 2.836 N/A ASP 520.A N ARG 516.A O no hydrogen 3.060 N/A LEU 521.A N ASP 517.A O no hydrogen 3.141 N/A LEU 521.A N LEU 518.A O no hydrogen 3.203 N/A GLY 522.A N VAL 519.A O no hydrogen 2.873 N/A TRP 524.A N LEU 518.A O no hydrogen 3.441 N/A THR 529.A N GLN 525.A O no hydrogen 3.235 N/A GLN 530.A N TYR 526.A O no hydrogen 2.503 N/A ASN 531.A N ILE 528.A O no hydrogen 3.100 N/A GLY 532.A N LEU 527.A O no hydrogen 2.690 N/A SER 533.A OG GLU 553.A OE2 no hydrogen 2.419 N/A GLN 535.A N SER 533.A OG no hydrogen 3.387 N/A GLN 535.A NE2 LYS 545.A O no hydrogen 2.720 N/A GLN 542.A NE2 ASP 546.A OD1 no hydrogen 3.105 N/A LYS 545.A N PRO 541.A O no hydrogen 3.266 N/A LYS 545.A NZ LEU 537.A O no hydrogen 2.743 N/A ASP 546.A N GLN 542.A O no hydrogen 2.902 N/A LEU 547.A N GLU 543.A O no hydrogen 3.098 N/A TYR 548.A N LEU 544.A O no hydrogen 2.931 N/A TYR 548.A OH ASP 517.A OD2 no hydrogen 2.741 N/A THR 550.A N GLU 553.A OE1 no hydrogen 2.547 N/A GLU 553.A N THR 550.A O no hydrogen 2.457 N/A ILE 554.A N VAL 551.A O no hydrogen 3.418 N/A LYS 557.A N SER 555.A OG no hydrogen 3.221 N/A LYS 557.A NZ TYR 594.A OH no hydrogen 3.131 N/A THR 558.A N SER 555.A O no hydrogen 2.968 N/A ILE 559.A N SER 555.A O no hydrogen 3.138 N/A ILE 560.A N GLN 556.A O no hydrogen 2.855 N/A ASN 561.A N LYS 557.A O no hydrogen 2.894 N/A MET 562.A N THR 558.A O no hydrogen 2.800 N/A ALA 563.A N ILE 559.A O no hydrogen 2.989 N/A ALA 564.A N ILE 560.A O no hydrogen 2.923 N/A ASP 565.A N ASN 561.A O no hydrogen 2.836 N/A ARG 566.A N MET 562.A O no hydrogen 3.023 N/A ARG 566.A NE ASN 421.A OD1 no hydrogen 2.996 N/A ARG 566.A NH2 ASN 421.A OD1 no hydrogen 2.893 N/A SER 567.A N ALA 563.A O no hydrogen 2.946 N/A SER 567.A OG ALA 563.A O no hydrogen 2.597 N/A SER 567.A OG HIS 574.A NE2 no hydrogen 3.036 N/A TYR 569.A N ARG 566.A O no hydrogen 2.978 N/A ILE 570.A N SER 567.A O no hydrogen 3.197 N/A GLN 572.A N MET 492.A O no hydrogen 3.040 N/A GLN 572.A NE2 GLU 325.A OE2 no hydrogen 3.089 N/A GLN 572.A NE2 ILE 394.A O no hydrogen 3.136 N/A SER 573.A N GLU 322.A O no hydrogen 2.878 N/A SER 573.A OG THR 602.A OG1 no hydrogen 2.614 N/A HIS 574.A NE2 SER 567.A OG no hydrogen 3.036 N/A SER 575.A OG CYS 320.A O no hydrogen 2.830 N/A ASN 577.A ND2 TYR 606.A O no hydrogen 3.648 N/A LEU 578.A N TYR 606.A O no hydrogen 3.014 N/A LEU 580.A N ARG 608.A O no hydrogen 2.930 N/A GLY 586.A N THR 584.A OG1 no hydrogen 3.024 N/A LEU 588.A N THR 584.A O no hydrogen 3.009 N/A THR 589.A N MET 585.A O no hydrogen 3.069 N/A THR 589.A OG1 MET 585.A O no hydrogen 2.824 N/A SER 590.A N GLY 586.A O no hydrogen 3.193 N/A SER 590.A OG GLY 586.A O no hydrogen 3.534 N/A SER 590.A OG LYS 587.A O no hydrogen 3.108 N/A MET 591.A N LYS 587.A O no hydrogen 3.045 N/A HIS 592.A N LEU 588.A O no hydrogen 2.971 N/A HIS 592.A NE2 GLN 288.A OE1 no hydrogen 2.991 N/A PHE 593.A N THR 589.A O no hydrogen 3.042 N/A TYR 594.A N SER 590.A O no hydrogen 2.893 N/A TYR 594.A OH ASN 561.A OD1 no hydrogen 2.634 N/A GLY 595.A N MET 591.A O no hydrogen 3.161 N/A TRP 596.A N HIS 592.A O no hydrogen 2.783 N/A TRP 596.A NE1 ASP 228.A OD1 no hydrogen 2.762 N/A LYS 597.A N PHE 593.A O no hydrogen 2.766 N/A LYS 597.A NZ GLU 235.A OE1 no hydrogen 3.329 N/A LYS 597.A NZ GLU 235.A OE2 no hydrogen 2.888 N/A LYS 598.A N TYR 594.A O no hydrogen 2.935 N/A GLY 599.A N TRP 596.A O no hydrogen 2.964 N/A LEU 600.A N GLY 595.A O no hydrogen 3.285 N/A LYS 601.A NZ LYS 305.A O no hydrogen 3.277 N/A LYS 601.A NZ GLN 460.A OE1 no hydrogen 2.895 N/A LYS 601.A NZ ILE 570.A O no hydrogen 3.389 N/A LYS 601.A NZ GLN 572.A O no hydrogen 3.094 N/A THR 602.A OG1 CYS 321.A O no hydrogen 2.717 N/A THR 602.A OG1 SER 573.A OG no hydrogen 2.614 N/A GLY 603.A N VAL 296.A O no hydrogen 2.853 N/A MET 604.A N VAL 296.A O no hydrogen 3.174 N/A TYR 605.A N LEU 576.A O no hydrogen 2.608 N/A LEU 607.A N GLY 292.A O no hydrogen 3.309 N/A ARG 608.A N LEU 578.A O no hydrogen 2.852 N/A