Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3mj5_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ILE 3.A N VAL 19.A O no hydrogen 2.922 N/A VAL 5.A N GLN 17.A O no hydrogen 3.006 N/A PHE 6.A N LYS 51.A O no hydrogen 3.171 N/A THR 7.A N HIS 15.A O no hydrogen 3.037 N/A THR 8.A N PHE 53.A O no hydrogen 2.791 N/A THR 8.A OG1 ASN 13.A O no hydrogen 2.629 N/A ASP 10.A N THR 8.A OG1 no hydrogen 3.182 N/A ASN 11.A N THR 8.A OG1 no hydrogen 2.688 N/A THR 12.A N ASP 10.A OD1 no hydrogen 2.643 N/A ASN 13.A N ASP 10.A OD1 no hydrogen 2.602 N/A HIS 15.A N THR 7.A O no hydrogen 2.941 N/A HIS 15.A NE2 GLU 65.A OE1 no hydrogen 2.834 N/A GLN 17.A N VAL 5.A O no hydrogen 2.778 N/A VAL 19.A N ILE 3.A O no hydrogen 2.463 N/A ASP 20.A N GLN 28.A OE1 no hydrogen 2.443 N/A SER 22.A N ASP 20.A OD1 no hydrogen 2.475 N/A THR 24.A N GLN 27.A OE1 no hydrogen 2.750 N/A THR 24.A OG1 GLN 27.A OE1 no hydrogen 2.805 N/A TYR 25.A N ILE 42.A O no hydrogen 3.009 N/A TYR 25.A OH HIS 48.A ND1 no hydrogen 3.125 N/A GLY 26.A N THR 40.A O no hydrogen 2.295 N/A GLN 27.A N THR 24.A O no hydrogen 2.673 N/A GLN 28.A N THR 24.A O no hydrogen 3.246 N/A GLN 28.A N TYR 25.A O no hydrogen 2.670 N/A GLN 28.A NE2 ASP 20.A O no hydrogen 3.217 N/A PHE 29.A N TYR 25.A O no hydrogen 2.533 N/A THR 32.A OG1 GLY 30.A O no hydrogen 2.519 N/A TYR 33.A N PHE 54.A O no hydrogen 3.268 N/A LEU 34.A N ALA 37.A O no hydrogen 2.759 N/A ALA 37.A N LEU 34.A O no hydrogen 2.815 N/A VAL 39.A N THR 32.A O no hydrogen 3.048 N/A THR 40.A N ASP 38.A OD1 no hydrogen 2.851 N/A THR 40.A OG1 ASP 38.A OD1 no hydrogen 2.827 N/A HIS 45.A N HIS 48.A ND1 no hydrogen 2.187 N/A HIS 48.A N HIS 45.A O no hydrogen 2.226 N/A GLY 50.A N LYS 4.A O no hydrogen 3.229 N/A PHE 53.A N PHE 6.A O no hydrogen 2.800 N/A PHE 54.A N TYR 33.A O no hydrogen 3.150 N/A VAL 55.A N THR 8.A O no hydrogen 3.299 N/A LEU 62.A N ASP 59.A OD1 no hydrogen 3.004 N/A ARG 63.A N ASP 59.A O no hydrogen 2.856 N/A SER 64.A N ASP 60.A O no hydrogen 2.699 N/A GLU 65.A N THR 61.A O no hydrogen 2.862 N/A ALA 66.A N LEU 62.A O no hydrogen 2.948 N/A PHE 67.A N ARG 63.A O no hydrogen 3.158 N/A GLU 68.A N SER 64.A O no hydrogen 3.333 N/A TYR 69.A N GLU 65.A O no hydrogen 3.074 N/A TYR 69.A OH GLU 132.A OE1 no hydrogen 2.949 N/A TYR 70.A N ALA 66.A O no hydrogen 2.627 N/A TYR 70.A OH VAL 9.A O no hydrogen 2.412 N/A HIS 71.A N PHE 67.A O no hydrogen 2.568 N/A ASP 74.A N THR 72.A OG1 no hydrogen 3.021 N/A SER 76.A N ASP 74.A OD1 no hydrogen 3.037 N/A SER 76.A OG ASP 74.A OD1 no hydrogen 2.695 N/A PHE 77.A N ASP 74.A O no hydrogen 3.142 N/A ARG 80.A N SER 76.A O no hydrogen 2.924 N/A ARG 80.A NE SER 76.A OG no hydrogen 2.862 N/A ARG 80.A NH1 ALA 151.A O no hydrogen 2.862 N/A ARG 80.A NH2 ASP 74.A OD2 no hydrogen 3.545 N/A TYR 81.A N PHE 77.A O no hydrogen 2.760 N/A MET 82.A N LEU 78.A O no hydrogen 3.152 N/A SER 83.A N GLY 79.A O no hydrogen 3.307 N/A SER 83.A OG GLY 79.A O no hydrogen 3.375 N/A ALA 84.A N ARG 80.A O no hydrogen 3.103 N/A LEU 85.A N TYR 81.A O no hydrogen 2.898 N/A ASN 86.A N MET 82.A O no hydrogen 2.975 N/A HIS 87.A N ALA 84.A O no hydrogen 2.748 N/A THR 88.A N ALA 84.A O no hydrogen 2.794 N/A THR 88.A OG1 ALA 84.A O no hydrogen 3.542 N/A THR 88.A OG1 LEU 85.A O no hydrogen 3.496 N/A THR 88.A OG1 ALA 143.A O no hydrogen 2.858 N/A LYS 89.A N LEU 85.A O no hydrogen 3.200 N/A LYS 89.A NZ ASP 35.A O no hydrogen 2.803 N/A LYS 89.A NZ ASN 86.A OD1 no hydrogen 3.319 N/A LYS 90.A N HIS 87.A O no hydrogen 2.959 N/A TRP 91.A N THR 88.A O no hydrogen 3.067 N/A TRP 91.A NE1 ASP 106.A OD2 no hydrogen 2.999 N/A VAL 96.A N LEU 99.A O no hydrogen 2.841 N/A LEU 99.A N VAL 96.A O no hydrogen 2.960 N/A THR 100.A N GLN 119.A OE1 no hydrogen 3.257 N/A THR 100.A OG1 GLN 119.A OE1 no hydrogen 3.409 N/A THR 100.A OG1 ALA 137.A O no hydrogen 2.836 N/A SER 101.A N PRO 94.A O no hydrogen 3.058 N/A SER 101.A OG GLY 285.A O no hydrogen 2.618 N/A LYS 103.A N LYS 92.A O no hydrogen 3.094 N/A ALA 105.A N ASN 108.A OD1 no hydrogen 3.200 N/A ASN 107.A ND2 GLY 158.A O no hydrogen 2.360 N/A ASN 108.A N ALA 105.A O no hydrogen 2.794 N/A ASN 108.A ND2 LYS 103.A O no hydrogen 3.428 N/A CYS 109.A SG HIS 270.A ND1 no hydrogen 3.749 N/A SER 112.A N ASN 108.A O no hydrogen 3.024 N/A SER 113.A N CYS 109.A O no hydrogen 3.185 N/A VAL 114.A N TYR 110.A O no hydrogen 3.026 N/A LEU 115.A N LEU 111.A O no hydrogen 2.811 N/A LEU 116.A N SER 112.A O no hydrogen 2.762 N/A ALA 117.A N SER 113.A O no hydrogen 2.838 N/A LEU 118.A N VAL 114.A O no hydrogen 2.847 N/A GLN 119.A NE2 THR 100.A O no hydrogen 2.681 N/A GLN 119.A NE2 LEU 115.A O no hydrogen 2.966 N/A GLN 120.A N ALA 117.A O no hydrogen 3.027 N/A GLN 120.A NE2 LEU 116.A O no hydrogen 2.847 N/A GLN 120.A NE2 HIS 273.A NE2 no hydrogen 2.794 N/A LEU 121.A N LEU 118.A O no hydrogen 2.931 N/A ASN 126.A N HIS 173.A O no hydrogen 3.071 N/A ASN 126.A ND2 ALA 174.A O no hydrogen 3.642 N/A ALA 129.A N TYR 69.A O no hydrogen 3.134 N/A GLN 131.A N ALA 127.A O no hydrogen 2.906 N/A GLN 131.A NE2 PHE 125.A O no hydrogen 2.632 N/A GLU 132.A N PRO 128.A O no hydrogen 2.967 N/A ALA 133.A N ALA 129.A O no hydrogen 3.039 N/A TYR 134.A N LEU 130.A O no hydrogen 2.779 N/A TYR 135.A N GLN 131.A O no hydrogen 2.835 N/A ARG 136.A N GLU 132.A O no hydrogen 2.967 N/A ARG 136.A NE ASP 141.A OD2 no hydrogen 3.086 N/A ARG 136.A NH2 ASP 141.A OD2 no hydrogen 2.598 N/A ALA 137.A N ALA 133.A O no hydrogen 2.922 N/A ARG 138.A N TYR 134.A O no hydrogen 2.906 N/A ALA 139.A N ARG 136.A O no hydrogen 3.244 N/A GLY 140.A N ALA 137.A O no hydrogen 2.849 N/A ASP 141.A N ARG 136.A O no hydrogen 2.815 N/A ASN 144.A ND2 TYR 81.A OH no hydrogen 2.583 N/A CYS 146.A N ALA 142.A O no hydrogen 3.076 N/A CYS 146.A SG ALA 142.A O no hydrogen 3.476 N/A ALA 147.A N ALA 143.A O no hydrogen 3.120 N/A LEU 148.A N ASN 144.A O no hydrogen 2.988 N/A LEU 148.A N PHE 145.A O no hydrogen 3.138 N/A ILE 149.A N PHE 145.A O no hydrogen 2.925 N/A LEU 150.A N CYS 146.A O no hydrogen 2.876 N/A ALA 151.A N ALA 147.A O no hydrogen 2.919 N/A TYR 152.A N LEU 148.A O no hydrogen 2.632 N/A TYR 152.A OH TYR 70.A O no hydrogen 2.637 N/A SER 153.A N ILE 149.A O no hydrogen 2.983 N/A SER 153.A N LEU 150.A O no hydrogen 3.134 N/A SER 153.A OG ILE 149.A O no hydrogen 2.745 N/A SER 153.A OG LEU 150.A O no hydrogen 3.377 N/A ASN 154.A N ALA 151.A O no hydrogen 3.401 N/A ASN 154.A ND2 TYR 152.A O no hydrogen 3.569 N/A LYS 155.A N LEU 150.A O no hydrogen 3.125 N/A LYS 155.A NZ LEU 160.A O no hydrogen 3.335 N/A THR 156.A N GLU 159.A OE1 no hydrogen 3.180 N/A GLU 159.A N THR 156.A O no hydrogen 3.260 N/A VAL 163.A N TYR 271.A OH no hydrogen 3.055 N/A GLU 165.A N ASP 162.A OD2 no hydrogen 2.650 N/A THR 166.A N ASP 162.A O no hydrogen 2.977 N/A THR 166.A OG1 ASP 162.A O no hydrogen 2.769 N/A MET 167.A N VAL 163.A O no hydrogen 2.820 N/A THR 168.A N ARG 164.A O no hydrogen 2.945 N/A THR 168.A OG1 ARG 164.A O no hydrogen 3.156 N/A HIS 169.A N GLU 165.A O no hydrogen 3.245 N/A LEU 170.A N THR 166.A O no hydrogen 3.132 N/A LEU 171.A N MET 167.A O no hydrogen 2.776 N/A GLN 172.A N HIS 169.A O no hydrogen 3.163 N/A HIS 173.A N LEU 170.A O no hydrogen 2.570 N/A ALA 174.A N LEU 171.A O no hydrogen 3.212 N/A ASN 175.A N LYS 124.A O no hydrogen 2.790 N/A ASN 175.A ND2 GLU 177.A OE2 no hydrogen 2.723 N/A ALA 179.A N LEU 176.A O no hydrogen 2.764 N/A LYS 180.A N GLU 236.A O no hydrogen 2.927 N/A ARG 181.A N LEU 197.A O no hydrogen 2.949 N/A ARG 181.A NE GLN 235.A OE1 no hydrogen 2.996 N/A ARG 181.A NH1 MET 204.A O no hydrogen 3.456 N/A VAL 182.A N GLN 234.A O no hydrogen 2.987 N/A LEU 183.A N THR 195.A O no hydrogen 2.917 N/A ASN 184.A N TYR 231.A O no hydrogen 3.005 N/A ASN 184.A ND2 LYS 193.A O no hydrogen 2.671 N/A VAL 185.A N LYS 193.A O no hydrogen 2.848 N/A VAL 186.A N THR 229.A O no hydrogen 2.763 N/A CYS 187.A N GLY 191.A O no hydrogen 2.846 N/A GLY 191.A N CYS 187.A O no hydrogen 2.850 N/A LYS 193.A N VAL 185.A O no hydrogen 2.990 N/A THR 194.A OG1 LEU 183.A O no hydrogen 3.355 N/A THR 195.A N LEU 183.A O no hydrogen 2.842 N/A LEU 197.A N ARG 181.A O no hydrogen 2.676 N/A ALA 202.A N GLY 199.A O no hydrogen 2.660 N/A VAL 203.A N VAL 200.A O no hydrogen 2.941 N/A MET 204.A N VAL 200.A O no hydrogen 3.178 N/A TYR 205.A N MET 241.A O no hydrogen 3.146 N/A GLY 207.A N SER 243.A O no hydrogen 2.809 N/A SER 210.A N THR 208.A OG1 no hydrogen 3.391 N/A TYR 211.A N TYR 303.A OH no hydrogen 3.067 N/A TYR 211.A OH GLU 305.A OE1 no hydrogen 2.653 N/A ASN 213.A N SER 210.A OG no hydrogen 2.924 N/A ASN 213.A ND2 THR 208.A OG1 no hydrogen 3.403 N/A LEU 214.A N TYR 211.A O no hydrogen 3.202 N/A LYS 215.A N TYR 211.A O no hydrogen 3.306 N/A THR 216.A N ASP 212.A O no hydrogen 2.910 N/A THR 216.A OG1 ASP 212.A O no hydrogen 2.768 N/A GLY 217.A N ASN 213.A O no hydrogen 2.822 N/A VAL 218.A N GLN 230.A O no hydrogen 2.769 N/A SER 219.A OG ASP 227.A OD2 no hydrogen 2.884 N/A SER 219.A OG ALA 228.A O no hydrogen 3.555 N/A ILE 220.A N ALA 228.A O no hydrogen 2.969 N/A CYS 222.A N ARG 226.A O no hydrogen 2.807 N/A GLY 225.A N CYS 222.A O no hydrogen 2.697 N/A ALA 228.A N ILE 220.A O no hydrogen 2.498 N/A THR 229.A N VAL 186.A O no hydrogen 2.836 N/A GLN 230.A N VAL 218.A O no hydrogen 2.841 N/A TYR 231.A N ASN 184.A O no hydrogen 3.011 N/A LEU 232.A N LEU 214.A O no hydrogen 2.875 N/A VAL 233.A N VAL 182.A O no hydrogen 3.033 N/A GLN 234.A N VAL 182.A O no hydrogen 3.424 N/A GLN 235.A N TYR 308.A O no hydrogen 2.842 N/A GLN 235.A NE2 ALA 202.A O no hydrogen 2.918 N/A GLN 235.A NE2 SER 237.A OG no hydrogen 2.855 N/A GLU 236.A N LYS 180.A O no hydrogen 2.936 N/A SER 237.A OG PHE 239.A O no hydrogen 2.902 N/A SER 238.A OG GLU 122.A O no hydrogen 2.747 N/A VAL 240.A N TYR 303.A O no hydrogen 2.906 N/A MET 241.A N VAL 203.A O no hydrogen 2.901 N/A MET 242.A N VAL 301.A O no hydrogen 2.840 N/A SER 243.A N TYR 205.A O no hydrogen 2.826 N/A SER 243.A OG ASP 300.A OD1 no hydrogen 2.557 N/A ALA 244.A N THR 299.A O no hydrogen 3.036 N/A TYR 249.A N GLY 296.A O no hydrogen 2.785 N/A LEU 251.A N TYR 294.A O no hydrogen 2.682 N/A GLN 253.A NE2 SER 292.A O no hydrogen 3.369 N/A THR 255.A OG1 GLN 252.A O no hydrogen 2.486 N/A LEU 257.A N PHE 302.A O no hydrogen 2.811 N/A CYS 258.A N PHE 302.A O no hydrogen 3.313 N/A ALA 259.A N ILE 274.A O no hydrogen 2.828 N/A ASN 260.A N ASP 300.A O no hydrogen 2.955 N/A GLU 261.A N THR 272.A O no hydrogen 2.906 N/A TYR 262.A N PRO 297.A O no hydrogen 3.020 N/A TYR 262.A OH ASN 265.A O no hydrogen 2.552 N/A THR 263.A N HIS 270.A O no hydrogen 2.833 N/A THR 263.A OG1 GLU 261.A OE1 no hydrogen 2.695 N/A ASN 265.A N CYS 268.A O no hydrogen 3.039 N/A CYS 268.A N ASN 265.A O no hydrogen 3.182 N/A CYS 268.A N ASN 265.A OD1 no hydrogen 3.011 N/A HIS 270.A N THR 263.A O no hydrogen 2.922 N/A HIS 270.A NE2 ASP 284.A OD1 no hydrogen 2.779 N/A THR 272.A N GLU 261.A O no hydrogen 2.928 N/A THR 272.A OG1 GLU 261.A OE2 no hydrogen 2.431 N/A HIS 273.A N ILE 283.A O no hydrogen 3.053 N/A ILE 274.A N ALA 259.A O no hydrogen 2.614 N/A THR 275.A N TYR 281.A O no hydrogen 2.824 N/A THR 275.A OG1 GLN 120.A OE1 no hydrogen 2.652 N/A ALA 276.A N LEU 257.A O no hydrogen 3.314 N/A LYS 277.A N THR 279.A O no hydrogen 2.874 N/A LYS 277.A NZ GLY 97.A O no hydrogen 2.881 N/A GLU 278.A N GLU 278.A OE1 no hydrogen 3.205 N/A THR 279.A OG1 MET 291.A O no hydrogen 2.843 N/A LEU 280.A N MET 291.A O no hydrogen 2.940 N/A TYR 281.A N THR 275.A O no hydrogen 2.793 N/A TYR 281.A OH GLU 278.A OE1 no hydrogen 2.899 N/A TYR 281.A OH GLU 278.A OE2 no hydrogen 2.173 N/A ARG 282.A N THR 289.A O no hydrogen 2.693 N/A ILE 283.A N HIS 273.A O no hydrogen 2.686 N/A ASP 284.A N HIS 287.A O no hydrogen 2.908 N/A HIS 287.A N ASP 284.A O no hydrogen 2.907 N/A THR 289.A N ARG 282.A O no hydrogen 3.196 N/A MET 291.A N LEU 280.A O no hydrogen 3.134 N/A TYR 294.A N LEU 251.A O no hydrogen 3.319 N/A GLY 296.A N TYR 249.A O no hydrogen 3.322 N/A VAL 298.A N GLY 296.A O no hydrogen 3.011 N/A THR 299.A N ASN 260.A O no hydrogen 2.823 N/A THR 299.A OG1 ALA 244.A O no hydrogen 3.103 N/A ASP 300.A N ASN 260.A O no hydrogen 3.481 N/A VAL 301.A N MET 242.A O no hydrogen 2.892 N/A PHE 302.A N CYS 258.A O no hydrogen 2.635 N/A TYR 303.A N VAL 240.A O no hydrogen 2.903 N/A TYR 303.A OH LEU 209.A O no hydrogen 2.555 N/A GLU 305.A N SER 238.A O no hydrogen 3.159 N/A THR 306.A N GLU 305.A OE2 no hydrogen 2.444 N/A SER 307.A N THR 306.A OG1 no hydrogen 2.710 N/A SER 307.A OG GLU 236.A OE2 no hydrogen 3.090 N/A TYR 308.A N GLN 235.A O no hydrogen 2.708 N/A THR 310.A N VAL 233.A O no hydrogen 2.850 N/A THR 310.A OG1 THR 311.A O no hydrogen 2.353 N/A