Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 2wpn_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ARG 1.A NH1 ILE 35.A O no hydrogen 2.936 N/A VAL 4.A N SER 36.A O no hydrogen 2.862 N/A PHE 5.A N PHE 67.A O no hydrogen 3.004 N/A TRP 6.A N PHE 39.A O no hydrogen 2.769 N/A TRP 6.A NE1 GLU 71.A OE1 no hydrogen 2.980 N/A LEU 7.A N VAL 69.A O no hydrogen 2.701 N/A GLN 8.A NE2 THR 42.A OG1 no hydrogen 3.001 N/A GLN 8.A NE2 GLU 71.A OE1 no hydrogen 3.315 N/A GLY 9.A N GLU 71.A O no hydrogen 2.759 N/A GLN 10.A N SER 73.A O no hydrogen 2.871 N/A GLN 10.A NE2 THR 129.A OG1 no hydrogen 2.913 N/A GLY 11.A N GLY 9.A O no hydrogen 2.981 N/A CYS 15.A SG VAL 112.A O no hydrogen 3.857 N/A SER 16.A N GLU 71.A OE2 no hydrogen 3.338 N/A SER 16.A OG HIS 40.A NE2 no hydrogen 2.721 N/A SER 16.A OG GLU 71.A OE1 no hydrogen 3.184 N/A VAL 17.A N THR 13.A O no hydrogen 3.037 N/A THR 18.A N GLY 14.A O no hydrogen 2.890 N/A THR 18.A OG1 PRO 155.A O no hydrogen 2.870 N/A LEU 19.A N CYS 15.A O no hydrogen 3.401 N/A LEU 20.A N SER 16.A O no hydrogen 3.154 N/A ASN 21.A N THR 18.A O no hydrogen 2.961 N/A SER 22.A N LEU 19.A O no hydrogen 2.948 N/A HIS 24.A N SER 22.A OG no hydrogen 2.998 N/A SER 26.A N HIS 24.A ND1 no hydrogen 2.854 N/A ILE 27.A N HIS 24.A O no hydrogen 3.162 N/A VAL 30.A N SER 26.A O no hydrogen 2.867 N/A LEU 31.A N ILE 27.A O no hydrogen 3.131 N/A LEU 32.A N ALA 28.A O no hydrogen 2.761 N/A LYS 33.A N ASP 29.A O no hydrogen 2.785 N/A LYS 33.A NZ ASP 29.A OD1 no hydrogen 2.771 N/A VAL 34.A N ASP 29.A O no hydrogen 3.078 N/A VAL 34.A N VAL 30.A O no hydrogen 3.052 N/A ILE 35.A N VAL 30.A O no hydrogen 2.915 N/A SER 36.A N PRO 2.A O no hydrogen 2.931 N/A SER 36.A OG GLU 38.A OE2 no hydrogen 2.989 N/A GLU 38.A N VAL 4.A O no hydrogen 2.903 N/A PHE 39.A N VAL 4.A O no hydrogen 3.507 N/A HIS 40.A NE2 SER 16.A OG no hydrogen 2.721 N/A THR 42.A N HIS 40.A ND1 no hydrogen 3.169 N/A VAL 43.A N HIS 40.A O no hydrogen 3.176 N/A MET 44.A N HIS 40.A O no hydrogen 2.979 N/A ALA 51.A N GLU 47.A O no hydrogen 3.120 N/A ILE 52.A N GLY 48.A O no hydrogen 2.993 N/A GLU 53.A N GLU 49.A O no hydrogen 2.768 N/A HIS 54.A N HIS 50.A O no hydrogen 3.043 N/A HIS 54.A NE2 GLU 38.A OE1 no hydrogen 2.847 N/A MET 55.A N ALA 51.A O no hydrogen 2.995 N/A ARG 56.A N ILE 52.A O no hydrogen 2.905 N/A ARG 56.A NE GLU 101.A OE1 no hydrogen 3.394 N/A ARG 56.A NE GLU 101.A OE2 no hydrogen 2.832 N/A ARG 56.A NH2 GLU 101.A OE1 no hydrogen 2.776 N/A LYS 57.A N GLU 53.A O no hydrogen 2.936 N/A VAL 58.A N HIS 54.A O no hydrogen 2.965 N/A ALA 59.A N MET 55.A O no hydrogen 2.868 N/A GLU 60.A N ARG 56.A O no hydrogen 3.087 N/A LYS 61.A N LYS 57.A O no hydrogen 3.038 N/A PHE 62.A N VAL 58.A O no hydrogen 2.793 N/A LYS 63.A N GLU 60.A O no hydrogen 3.257 N/A GLY 64.A N ASN 105.A O no hydrogen 2.651 N/A LYS 65.A N PHE 62.A O no hydrogen 2.932 N/A PHE 67.A N PRO 3.A O no hydrogen 3.000 N/A LEU 68.A N ALA 108.A O no hydrogen 3.234 N/A VAL 69.A N PHE 5.A O no hydrogen 2.830 N/A ILE 70.A N LEU 110.A O no hydrogen 2.996 N/A GLU 71.A N LEU 7.A O no hydrogen 2.965 N/A SER 73.A OG GLN 10.A OE1 no hydrogen 2.936 N/A VAL 74.A N THR 132.A O no hydrogen 2.935 N/A VAL 76.A N GLY 130.A O no hydrogen 3.151 N/A GLU 77.A N THR 129.A O no hydrogen 3.195 N/A GLY 80.A N GLU 77.A O no hydrogen 2.994 N/A LYS 81.A N ALA 78.A O no hydrogen 2.999 N/A CYS 83.A N GLY 80.A O no hydrogen 3.211 N/A ILE 85.A N ILE 93.A O no hydrogen 2.813 N/A ALA 88.A N HIS 91.A O no hydrogen 3.232 N/A HIS 91.A N ALA 88.A O no hydrogen 3.048 N/A ILE 93.A N GLY 86.A O no hydrogen 2.802 N/A SER 94.A N ASP 97.A OD2 no hydrogen 3.111 N/A MET 95.A N CYS 83.A O no hydrogen 2.805 N/A ASP 97.A N SER 94.A OG no hydrogen 3.006 N/A ALA 98.A N SER 94.A O no hydrogen 2.912 N/A LEU 99.A N MET 95.A O no hydrogen 2.993 N/A LYS 100.A N VAL 96.A O no hydrogen 3.206 N/A GLU 101.A N ASP 97.A O no hydrogen 2.908 N/A GLU 101.A N ALA 98.A O no hydrogen 3.245 N/A PHE 102.A N ALA 98.A O no hydrogen 2.966 N/A GLY 103.A N LEU 99.A O no hydrogen 2.817 N/A ASN 105.A N PHE 102.A O no hydrogen 3.065 N/A ALA 107.A N PHE 66.A O no hydrogen 2.753 N/A VAL 109.A N PRO 146.A O no hydrogen 3.002 N/A LEU 110.A N LEU 68.A O no hydrogen 2.900 N/A ALA 111.A N VAL 148.A O no hydrogen 2.965 N/A VAL 112.A N ILE 70.A O no hydrogen 2.918 N/A GLY 113.A N ILE 150.A O no hydrogen 2.745 N/A THR 114.A N GLY 152.A O no hydrogen 2.942 N/A THR 114.A OG1 CYS 262.A O no hydrogen 2.594 N/A CYS 115.A SG GLN 10.A O no hydrogen 4.025 N/A ALA 117.A N GLY 113.A O no hydrogen 2.921 N/A TYR 118.A N THR 114.A O no hydrogen 2.841 N/A TYR 118.A OH ASP 190.A O no hydrogen 2.868 N/A GLY 119.A N CYS 115.A O no hydrogen 2.952 N/A ALA 123.A N GLY 120.A O no hydrogen 3.080 N/A ALA 124.A N ILE 121.A O no hydrogen 2.952 N/A GLU 125.A N ASP 269.A OD2 no hydrogen 2.769 N/A SER 127.A N ALA 124.A O no hydrogen 3.030 N/A SER 127.A OG ALA 124.A O no hydrogen 2.659 N/A THR 132.A N VAL 74.A O no hydrogen 2.852 N/A THR 132.A OG1 VAL 74.A O no hydrogen 3.487 N/A THR 132.A OG1 GLY 130.A O no hydrogen 2.784 N/A VAL 134.A N ALA 116.A O no hydrogen 2.797 N/A PHE 137.A N ALA 133.A O no hydrogen 3.059 N/A LEU 138.A N VAL 134.A O no hydrogen 2.926 N/A GLY 139.A N SER 135.A O no hydrogen 2.964 N/A ASP 140.A N LYS 136.A O no hydrogen 2.789 N/A ASN 141.A N PHE 137.A O no hydrogen 3.081 N/A ASN 141.A N LEU 138.A O no hydrogen 3.182 N/A ASN 141.A ND2 PHE 137.A O no hydrogen 2.882 N/A GLY 142.A N GLY 139.A O no hydrogen 2.999 N/A ILE 143.A N LEU 138.A O no hydrogen 2.822 N/A THR 145.A OG1 GLY 103.A O no hydrogen 2.647 N/A VAL 148.A N VAL 109.A O no hydrogen 2.943 N/A ASN 149.A N GLY 191.A O no hydrogen 2.949 N/A ASN 149.A ND2 ASP 190.A O no hydrogen 3.142 N/A ILE 150.A N ALA 111.A O no hydrogen 2.919 N/A GLY 152.A N THR 114.A OG1 no hydrogen 2.871 N/A ASP 158.A N HIS 156.A ND1 no hydrogen 2.882 N/A TRP 159.A N HIS 156.A O no hydrogen 2.919 N/A TRP 159.A NE1 ASP 240.A OD1 no hydrogen 2.756 N/A VAL 161.A N PRO 157.A O no hydrogen 2.947 N/A GLY 162.A N ASP 158.A O no hydrogen 2.755 N/A THR 163.A N TRP 159.A O no hydrogen 3.138 N/A THR 163.A OG1 TRP 159.A O no hydrogen 2.764 N/A VAL 164.A N ILE 160.A O no hydrogen 3.207 N/A VAL 165.A N VAL 161.A O no hydrogen 2.926 N/A LEU 166.A N GLY 162.A O no hydrogen 2.965 N/A ALA 167.A N THR 163.A O no hydrogen 2.895 N/A LEU 168.A N VAL 164.A O no hydrogen 2.679 N/A ASP 169.A N VAL 165.A O no hydrogen 2.969 N/A ALA 170.A N LEU 166.A O no hydrogen 3.116 N/A ILE 171.A N ALA 167.A O no hydrogen 3.175 N/A LYS 172.A N LEU 168.A O no hydrogen 2.975 N/A LYS 173.A N ASP 169.A O no hydrogen 3.038 N/A ASN 174.A N ILE 171.A O no hydrogen 3.382 N/A GLY 175.A N ILE 171.A O no hydrogen 2.796 N/A GLY 179.A N GLY 175.A O no hydrogen 2.830 N/A LEU 180.A N LEU 176.A O no hydrogen 3.078 N/A ALA 181.A N GLU 177.A O no hydrogen 3.086 N/A GLU 182.A N GLY 178.A O no hydrogen 3.071 N/A GLU 182.A N GLY 179.A O no hydrogen 3.138 N/A VAL 183.A N GLY 179.A O no hydrogen 3.233 N/A VAL 184.A N LEU 180.A O no hydrogen 3.374 N/A VAL 186.A N VAL 183.A O no hydrogen 3.121 N/A LEU 187.A N VAL 184.A O no hydrogen 3.009 N/A ASP 188.A N ARG 192.A O no hydrogen 2.843 N/A ASP 190.A N ASP 188.A OD1 no hydrogen 2.779 N/A GLY 191.A N ASP 188.A O no hydrogen 2.879 N/A ARG 192.A N ASP 188.A OD1 no hydrogen 3.269 N/A ARG 192.A NE ASP 188.A OD2 no hydrogen 2.631 N/A ARG 192.A NH1 GLU 264.A OE2 no hydrogen 2.874 N/A ARG 192.A NH2 ASP 188.A OD2 no hydrogen 3.318 N/A ARG 192.A NH2 GLU 264.A OE2 no hydrogen 3.544 N/A THR 194.A N VAL 186.A O no hydrogen 2.683 N/A THR 194.A OG1 VAL 186.A O no hydrogen 3.064 N/A PHE 196.A N PRO 193.A O no hydrogen 3.033 N/A PHE 197.A N PRO 193.A O no hydrogen 3.090 N/A ARG 199.A NH1 GLU 243.A OE1 no hydrogen 2.934 N/A ARG 199.A NH2 GLU 243.A OE1 no hydrogen 3.389 N/A ARG 199.A NH2 GLU 243.A OE2 no hydrogen 2.942 N/A ASN 200.A ND2 GLY 234.A O no hydrogen 3.491 N/A ASN 200.A ND2 PRO 235.A O no hydrogen 3.158 N/A ILE 201.A N THR 237.A O no hydrogen 2.955 N/A HIS 202.A N GLY 234.A O no hydrogen 3.388 N/A GLU 203.A N ASN 200.A OD1 no hydrogen 2.829 N/A ASN 204.A N ILE 201.A O no hydrogen 3.053 N/A ASN 204.A ND2 ASN 200.A O no hydrogen 2.762 N/A CYS 205.A N HIS 202.A O no hydrogen 3.122 N/A LEU 208.A N CYS 205.A O no hydrogen 3.112 N/A TYR 211.A N TYR 207.A O no hydrogen 3.014 N/A ASP 212.A N LEU 208.A O no hydrogen 2.838 N/A GLU 213.A N ASP 209.A O no hydrogen 2.861 N/A GLY 214.A N TYR 211.A O no hydrogen 3.130 N/A VAL 215.A N LYS 210.A O no hydrogen 2.968 N/A SER 217.A N CYS 226.A O no hydrogen 2.930 N/A SER 217.A OG ASP 222.A O no hydrogen 2.694 N/A ASP 222.A N THR 219.A O no hydrogen 3.078 N/A LYS 223.A NZ PHE 220.A O no hydrogen 2.912 N/A LYS 223.A NZ GLN 255.A O no hydrogen 2.969 N/A LYS 223.A NZ ASN 256.A O no hydrogen 2.620 N/A VAL 224.A N ASP 222.A OD1 no hydrogen 3.020 N/A CYS 226.A N VAL 215.A O no hydrogen 2.927 N/A ARG 227.A NE VAL 254.A O no hydrogen 2.835 N/A ARG 227.A NH1 LYS 223.A O no hydrogen 2.854 N/A ARG 227.A NH1 GLY 225.A O no hydrogen 2.749 N/A ARG 227.A NH2 VAL 254.A O no hydrogen 3.465 N/A ARG 227.A NH2 GLN 255.A O no hydrogen 3.126 N/A GLY 231.A N TYR 228.A O no hydrogen 2.937 N/A CYS 232.A N ARG 227.A O no hydrogen 3.172 N/A LYS 233.A N CYS 259.A O no hydrogen 2.891 N/A LYS 233.A NZ GLY 231.A O no hydrogen 2.582 N/A LYS 233.A NZ LYS 271.A O no hydrogen 3.278 N/A LYS 233.A NZ PRO 273.A O no hydrogen 3.033 N/A MET 236.A N LYS 233.A O no hydrogen 2.932 N/A THR 237.A N GLY 234.A O no hydrogen 3.230 N/A THR 237.A OG1 LYS 233.A O no hydrogen 2.746 N/A MET 238.A N GLU 264.A OE2 no hydrogen 3.029 N/A GLU 243.A N ASP 240.A O no hydrogen 2.910 N/A ARG 244.A N ASP 240.A O no hydrogen 3.162 N/A ARG 244.A NE ASP 240.A OD1 no hydrogen 3.134 N/A ARG 244.A NE ASP 240.A OD2 no hydrogen 2.959 N/A ARG 244.A NH1 ASP 158.A OD2 no hydrogen 2.837 N/A ARG 244.A NH2 ASP 240.A OD2 no hydrogen 2.966 N/A LYS 245.A N CYS 241.A O no hydrogen 2.941 N/A TRP 246.A N ASN 251.A O no hydrogen 2.768 N/A VAL 250.A N TRP 246.A O no hydrogen 3.090 N/A TRP 252.A N ASN 251.A OD1 no hydrogen 2.802 N/A GLN 255.A NE2 ASN 251.A OD1 no hydrogen 3.081 N/A ASN 256.A N TRP 252.A O no hydrogen 2.959 N/A ALA 257.A N CYS 253.A O no hydrogen 2.774 N/A GLU 264.A N GLY 261.A O no hydrogen 3.005 N/A PHE 267.A N GLU 264.A O no hydrogen 2.921 N/A GLY 270.A N ASP 266.A O no hydrogen 2.743 N/A LYS 271.A N PRO 268.A O no hydrogen 2.949 N/A LYS 271.A NZ ASP 266.A OD1 no hydrogen 2.713 N/A LYS 271.A NZ ASP 266.A OD2 no hydrogen 3.232 N/A SER 272.A N ASP 269.A O no hydrogen 3.328 N/A SER 272.A OG PRO 268.A O no hydrogen 2.735 N/A