Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3k6b_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): SER 1.A OG GLN 2.A O no hydrogen 3.393 N/A ASP 3.A N GLN 2.A OE1 no hydrogen 2.737 N/A TYR 5.A N ASP 3.A OD2 no hydrogen 3.082 N/A TYR 5.A OH GLU 14.A OE2 no hydrogen 2.522 N/A LYS 7.A N PRO 4.A O no hydrogen 3.347 N/A THR 12.A OG1 ASN 10.A OD1 no hydrogen 2.592 N/A GLU 14.A N TRP 11.A O no hydrogen 3.105 N/A ASP 17.A N ASN 13.A O no hydrogen 3.144 N/A PHE 18.A N GLU 14.A O no hydrogen 2.790 N/A LYS 19.A N HIS 15.A O no hydrogen 2.802 N/A LYS 20.A N ASP 16.A O no hydrogen 2.902 N/A ALA 21.A N ASP 17.A O no hydrogen 2.773 N/A GLU 22.A N PHE 18.A O no hydrogen 2.735 N/A MET 23.A N LYS 20.A O no hydrogen 2.904 N/A ARG 24.A N LYS 20.A O no hydrogen 3.077 N/A ARG 24.A NH1 ASP 3.A OD2 no hydrogen 2.422 N/A MET 25.A N ALA 21.A O no hydrogen 2.852 N/A ASP 26.A N GLU 22.A O no hydrogen 2.846 N/A GLU 27.A N MET 23.A O no hydrogen 2.685 N/A LYS 28.A N ARG 24.A O no hydrogen 3.127 N/A HIS 29.A N MET 25.A O no hydrogen 2.877 N/A ARG 30.A N ASP 26.A O no hydrogen 3.061 N/A LYS 31.A N GLU 27.A O no hydrogen 2.993 N/A LYS 31.A N LYS 28.A O no hydrogen 3.267 N/A LYS 32.A N LYS 28.A O no hydrogen 3.448 N/A VAL 33.A N HIS 29.A O no hydrogen 3.045 N/A ASP 34.A N ARG 30.A O no hydrogen 3.105 N/A LYS 35.A N LYS 31.A O no hydrogen 3.326 N/A VAL 36.A N LYS 32.A O no hydrogen 2.999 N/A MET 37.A N VAL 33.A O no hydrogen 2.938 N/A LYS 38.A N ASP 34.A O no hydrogen 2.904 N/A LYS 38.A NZ ASP 42.A OD2 no hydrogen 2.876 N/A GLU 39.A N LYS 35.A O no hydrogen 3.152 N/A TRP 40.A N VAL 36.A O no hydrogen 2.792 N/A GLY 41.A N MET 37.A O no hydrogen 3.112 N/A ASP 42.A N LYS 38.A O no hydrogen 3.032 N/A LEU 43.A N GLU 39.A O no hydrogen 2.934 N/A GLU 44.A N TRP 40.A O no hydrogen 2.613 N/A THR 45.A N GLY 41.A O no hydrogen 2.868 N/A THR 45.A OG1 GLY 41.A O no hydrogen 3.068 N/A ARG 46.A N ASP 42.A O no hydrogen 3.247 N/A TYR 47.A N LEU 43.A O no hydrogen 3.291 N/A TYR 47.A OH GLU 59.A OE1 no hydrogen 2.846 N/A ASN 48.A N GLU 44.A O no hydrogen 3.218 N/A GLU 49.A N THR 45.A O no hydrogen 3.029 N/A GLN 50.A N ARG 46.A O no hydrogen 3.001 N/A LYS 53.A NZ GLN 50.A OE1 no hydrogen 3.485 N/A ASP 54.A N GLN 50.A O no hydrogen 2.919 N/A GLY 57.A N ASP 54.A OD1 no hydrogen 2.750 N/A ALA 58.A N ASP 54.A O no hydrogen 2.460 N/A GLU 59.A N PRO 55.A O no hydrogen 3.311 N/A LYS 60.A N LYS 56.A O no hydrogen 3.213 N/A PHE 61.A N GLY 57.A O no hydrogen 3.132 N/A LYS 62.A N ALA 58.A O no hydrogen 3.112 N/A SER 63.A N GLU 59.A O no hydrogen 3.057 N/A GLN 64.A N LYS 60.A O no hydrogen 2.847 N/A MET 65.A N PHE 61.A O no hydrogen 2.794 N/A ASN 66.A N LYS 62.A O no hydrogen 2.963 N/A ASN 66.A N SER 63.A O no hydrogen 3.037 N/A ALA 67.A N SER 63.A O no hydrogen 3.222 N/A ARG 68.A N GLN 64.A O no hydrogen 3.266 N/A PHE 69.A N MET 65.A O no hydrogen 2.981 N/A GLN 70.A N ASN 66.A O no hydrogen 2.632 N/A LYS 71.A N ALA 67.A O no hydrogen 2.905 N/A THR 72.A N ARG 68.A O no hydrogen 2.711 N/A THR 72.A OG1 ARG 68.A O no hydrogen 3.297 N/A VAL 73.A N PHE 69.A O no hydrogen 2.864 N/A SER 74.A N GLN 70.A O no hydrogen 3.150 N/A SER 75.A N LYS 71.A O no hydrogen 2.903 N/A LEU 76.A N THR 72.A O no hydrogen 3.094 N/A GLU 77.A N VAL 73.A O no hydrogen 2.873 N/A GLU 78.A N SER 74.A O no hydrogen 3.114 N/A GLU 79.A N SER 75.A O no hydrogen 3.164 N/A HIS 80.A N LEU 76.A O no hydrogen 2.961 N/A LYS 81.A N GLU 77.A O no hydrogen 3.191 N/A ARG 82.A N GLU 78.A O no hydrogen 2.688 N/A MET 83.A N GLU 79.A O no hydrogen 2.844 N/A ARG 84.A N HIS 80.A O no hydrogen 2.730 N/A LYS 85.A N LYS 81.A O no hydrogen 3.126 N/A GLU 86.A N ARG 82.A O no hydrogen 3.052 N/A ILE 87.A N MET 83.A O no hydrogen 3.072 N/A GLU 88.A N ARG 84.A O no hydrogen 3.130 N/A ALA 89.A N LYS 85.A O no hydrogen 3.181 N/A VAL 90.A N GLU 86.A O no hydrogen 3.392 N/A HIS 91.A N ILE 87.A O no hydrogen 2.926 N/A HIS 91.A ND1 GLU 14.A OE2 no hydrogen 3.078 N/A GLU 92.A N GLU 88.A O no hydrogen 2.597 N/A GLU 93.A N ALA 89.A O no hydrogen 3.032 N/A GLU 93.A N VAL 90.A O no hydrogen 2.971 N/A ARG 94.A N VAL 90.A O no hydrogen 3.043 N/A ARG 94.A NH1 TYR 5.A O no hydrogen 3.377 N/A ARG 94.A NH1 GLU 14.A OE1 no hydrogen 3.124 N/A ARG 94.A NH2 TYR 5.A O no hydrogen 3.226 N/A VAL 95.A N HIS 91.A O no hydrogen 2.897 N/A GLN 96.A N GLU 92.A O no hydrogen 3.100 N/A ALA 97.A N GLU 93.A O no hydrogen 2.973 N/A MET 98.A N ARG 94.A O no hydrogen 2.643 N/A LEU 99.A N VAL 95.A O no hydrogen 2.769 N/A ASN 100.A N GLN 96.A O no hydrogen 2.758 N/A GLU 101.A N ALA 97.A O no hydrogen 3.152 N/A LYS 102.A N MET 98.A O no hydrogen 3.261 N/A LYS 103.A N LEU 99.A O no hydrogen 3.076 N/A LYS 103.A NZ GLU 137.A OE1 no hydrogen 3.226 N/A LYS 103.A NZ ASP 140.A OD2 no hydrogen 2.482 N/A ARG 104.A N ASN 100.A O no hydrogen 2.730 N/A ASP 105.A N GLU 101.A O no hydrogen 2.797 N/A ALA 106.A N LYS 102.A O no hydrogen 2.701 N/A THR 107.A N LYS 103.A O no hydrogen 2.862 N/A THR 107.A OG1 LYS 103.A O no hydrogen 2.892 N/A HIS 108.A N ARG 104.A O no hydrogen 3.337 N/A ASP 109.A N ASP 105.A O no hydrogen 3.098 N/A TYR 110.A N ALA 106.A O no hydrogen 3.134 N/A TYR 110.A OH THR 180.A O no hydrogen 3.047 N/A ARG 111.A N THR 107.A O no hydrogen 2.800 N/A GLN 112.A N HIS 108.A O no hydrogen 2.960 N/A ALA 113.A N ASP 109.A O no hydrogen 2.940 N/A LEU 114.A N TYR 110.A O no hydrogen 3.059 N/A ALA 115.A N ARG 111.A O no hydrogen 3.123 N/A THR 116.A N GLN 112.A O no hydrogen 2.770 N/A HIS 117.A NE2 ASP 189.A OD2 no hydrogen 3.027 N/A VAL 118.A N LEU 114.A O no hydrogen 3.139 N/A LYS 120.A N THR 116.A O no hydrogen 3.125 N/A ASN 122.A N HIS 117.A ND1 no hydrogen 2.808 N/A ASN 122.A ND2 ALA 113.A O no hydrogen 3.018 N/A VAL 126.A N ASN 122.A O no hydrogen 2.956 N/A GLN 128.A N HIS 124.A O no hydrogen 3.180 N/A SER 129.A N SER 125.A O no hydrogen 3.009 N/A SER 129.A N VAL 126.A O no hydrogen 3.130 N/A LEU 130.A N VAL 126.A O no hydrogen 2.890 N/A LYS 131.A N LEU 127.A O no hydrogen 2.751 N/A TYR 133.A N SER 129.A O no hydrogen 3.148 N/A ILE 134.A N LEU 130.A O no hydrogen 2.869 N/A ARG 135.A N LYS 131.A O no hydrogen 3.029 N/A ARG 135.A NE TYR 201.A OH no hydrogen 2.882 N/A ALA 136.A N ALA 132.A O no hydrogen 3.089 N/A GLU 137.A N TYR 133.A O no hydrogen 3.029 N/A GLU 138.A N ILE 134.A O no hydrogen 2.897 N/A LYS 139.A N ARG 135.A O no hydrogen 2.893 N/A ASP 140.A N ALA 136.A O no hydrogen 3.256 N/A ASP 140.A N GLU 137.A O no hydrogen 2.877 N/A ARG 141.A N GLU 137.A O no hydrogen 3.081 N/A MET 142.A N GLU 138.A O no hydrogen 2.960 N/A HIS 143.A N LYS 139.A O no hydrogen 3.087 N/A THR 144.A N ASP 140.A O no hydrogen 3.152 N/A THR 144.A OG1 ASP 140.A O no hydrogen 2.430 N/A LEU 145.A N ARG 141.A O no hydrogen 2.814 N/A ASN 146.A N MET 142.A O no hydrogen 3.120 N/A ARG 147.A N HIS 143.A O no hydrogen 2.942 N/A TYR 148.A N THR 144.A O no hydrogen 3.086 N/A ARG 149.A N LEU 145.A O no hydrogen 2.999 N/A HIS 150.A N ASN 146.A O no hydrogen 3.040 N/A LEU 151.A N ARG 147.A O no hydrogen 2.929 N/A LEU 152.A N TYR 148.A O no hydrogen 2.915 N/A LYS 153.A N ARG 149.A O no hydrogen 3.282 N/A LYS 153.A N HIS 150.A O no hydrogen 3.080 N/A ALA 154.A N HIS 150.A O no hydrogen 2.839 N/A ASP 155.A N LEU 151.A O no hydrogen 2.957 N/A ALA 159.A N ASP 155.A O no hydrogen 2.688 N/A ALA 161.A N LYS 157.A O no hydrogen 3.278 N/A ALA 161.A N GLU 158.A O no hydrogen 3.104 N/A TYR 162.A N ALA 159.A O no hydrogen 2.775 N/A LYS 163.A N ALA 159.A O no hydrogen 3.361 N/A VAL 166.A N TYR 162.A O no hydrogen 2.832 N/A ILE 167.A N LYS 163.A O no hydrogen 2.858 N/A HIS 168.A N PRO 164.A O no hydrogen 3.085 N/A ARG 169.A N THR 165.A O no hydrogen 2.864 N/A LEU 170.A N VAL 166.A O no hydrogen 3.038 N/A TYR 172.A N HIS 168.A O no hydrogen 3.407 N/A ILE 173.A N ARG 169.A O no hydrogen 3.054 N/A LEU 175.A N ARG 171.A O no hydrogen 2.935 N/A ARG 176.A N TYR 172.A O no hydrogen 2.650 N/A ARG 176.A NE GLU 137.A OE1 no hydrogen 3.371 N/A ARG 176.A NE GLU 137.A OE2 no hydrogen 2.966 N/A ILE 177.A N ILE 173.A O no hydrogen 2.848 N/A ASN 178.A N ASP 174.A O no hydrogen 2.793 N/A GLY 179.A N LEU 175.A O no hydrogen 2.724 N/A THR 180.A N ARG 176.A O no hydrogen 2.833 N/A THR 180.A OG1 TYR 133.A OH no hydrogen 3.375 N/A THR 180.A OG1 ARG 176.A O no hydrogen 2.614 N/A LEU 181.A N ILE 177.A O no hydrogen 3.027 N/A LEU 181.A N ASN 178.A O no hydrogen 3.220 N/A ALA 182.A N ASN 178.A O no hydrogen 3.034 N/A MET 183.A N GLY 179.A O no hydrogen 3.362 N/A LEU 184.A N LEU 181.A O no hydrogen 3.029 N/A ARG 185.A N ALA 182.A O no hydrogen 2.811 N/A PHE 187.A N LEU 184.A O no hydrogen 2.693 N/A GLU 191.A N PHE 187.A O no hydrogen 2.561 N/A LYS 192.A N PRO 188.A O no hydrogen 3.365 N/A TYR 193.A N LEU 190.A O no hydrogen 3.311 N/A VAL 194.A N LEU 190.A O no hydrogen 2.955 N/A ILE 197.A N VAL 194.A O no hydrogen 3.050 N/A ALA 198.A N VAL 194.A O no hydrogen 3.029 N/A VAL 199.A N ARG 195.A O no hydrogen 2.980 N/A THR 200.A N PRO 196.A O no hydrogen 3.385 N/A THR 200.A OG1 PRO 196.A O no hydrogen 2.613 N/A TYR 201.A N ILE 197.A O no hydrogen 2.975 N/A TRP 202.A N ALA 198.A O no hydrogen 3.043 N/A LYS 203.A N VAL 199.A O no hydrogen 3.060 N/A LYS 203.A NZ ASP 207.A OD2 no hydrogen 2.462 N/A ASP 204.A N THR 200.A O no hydrogen 2.751 N/A TYR 205.A N TYR 201.A O no hydrogen 2.753 N/A ARG 206.A N TRP 202.A O no hydrogen 2.880 N/A ARG 206.A NE GLU 138.A OE2 no hydrogen 2.790 N/A ARG 206.A NH2 GLU 138.A OE2 no hydrogen 2.742 N/A ARG 206.A NH2 ASP 174.A OD1 no hydrogen 3.062 N/A ASP 207.A N LYS 203.A O no hydrogen 3.004 N/A GLU 208.A N ASP 204.A O no hydrogen 3.225 N/A VAL 209.A N TYR 205.A O no hydrogen 3.208 N/A SER 210.A N ARG 206.A O no hydrogen 3.016 N/A