Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4png_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ILE 3.A N GLU 57.A O no hydrogen 2.915 N/A LEU 4.A N GLU 28.A O no hydrogen 2.864 N/A TYR 5.A N THR 55.A O no hydrogen 2.808 N/A TYR 5.A OH GLU 57.A OE2 no hydrogen 2.738 N/A GLY 6.A N VAL 30.A O no hydrogen 3.044 N/A SER 10.A N LEU 7.A O no hydrogen 2.988 N/A SER 10.A OG.A LEU 7.A O no hydrogen 3.527 N/A VAL 13.A N SER 10.A OG.B no hydrogen 3.353 N/A ARG 14.A N SER 10.A O no hydrogen 3.163 N/A ARG 14.A NE GLU 8.A O no hydrogen 2.893 N/A ARG 14.A NH1 SER 164.A O no hydrogen 3.093 N/A ARG 14.A NH1 SER 167.A OG no hydrogen 3.364 N/A ARG 14.A NH1 ASN 200.A OD1 no hydrogen 2.937 N/A ARG 14.A NH2 ALA 9.A O no hydrogen 2.849 N/A ARG 14.A NH2 SER 168.A OG no hydrogen 2.892 N/A ALA 15.A N PRO 11.A O no hydrogen 3.057 N/A VAL 16.A N PRO 12.A O no hydrogen 3.394 N/A LYS 17.A N VAL 13.A O no hydrogen 2.928 N/A LYS 17.A NZ TYR 27.A OH no hydrogen 3.021 N/A LYS 17.A NZ GLU 198.A OE1.A no hydrogen 3.102 N/A LEU 18.A N ARG 14.A O no hydrogen 2.822 N/A THR 19.A N ALA 15.A O no hydrogen 3.171 N/A THR 19.A OG1 ALA 15.A O no hydrogen 2.920 N/A LEU 20.A N VAL 16.A O no hydrogen 2.842 N/A ALA 21.A N LYS 17.A O no hydrogen 2.984 N/A ALA 22.A N LEU 18.A O no hydrogen 2.905 N/A LEU 23.A N THR 19.A O no hydrogen 2.948 N/A GLU 24.A N ALA 21.A O no hydrogen 3.137 N/A VAL 25.A N LEU 20.A O no hydrogen 3.180 N/A GLU 28.A N LEU 2.A O no hydrogen 2.937 N/A VAL 30.A N LEU 4.A O no hydrogen 2.784 N/A VAL 32.A N GLY 6.A O no hydrogen 2.818 N/A ASN 33.A N GLU 38.A OE2 no hydrogen 2.887 N/A ARG 35.A NH1 GLU 213.A OE2 no hydrogen 3.083 N/A ARG 35.A NH1 TYR 214.A OH no hydrogen 2.916 N/A ARG 35.A NH2 GLU 213.A OE1 no hydrogen 3.163 N/A ALA 36.A N ASN 33.A O no hydrogen 3.104 N/A ALA 36.A N ASN 33.A OD1 no hydrogen 3.245 N/A LYS 37.A N THR 34.A O no hydrogen 2.926 N/A GLU 38.A N ASN 33.A O no hydrogen 3.047 N/A ASN 39.A ND2 HIS 51.A O no hydrogen 2.842 N/A PHE 40.A N LYS 37.A O no hydrogen 3.199 N/A SER 41.A N GLU 38.A O no hydrogen 3.508 N/A GLU 43.A N GLU 43.A OE1 no hydrogen 3.097 N/A PHE 44.A N SER 41.A OG no hydrogen 2.991 N/A LEU 45.A N SER 41.A O no hydrogen 2.971 N/A LYS 46.A N GLU 42.A O no hydrogen 3.078 N/A LYS 47.A N GLU 43.A O no hydrogen 3.396 N/A LYS 47.A NZ TYR 5.A OH no hydrogen 3.113 N/A ASN 48.A N PHE 44.A O no hydrogen 2.823 N/A ASN 48.A ND2 THR 52.A O no hydrogen 3.000 N/A ASN 48.A ND2 THR 52.A OG1 no hydrogen 3.161 N/A ASN 48.A ND2 THR 55.A OG1 no hydrogen 3.153 N/A GLN 50.A N ASN 48.A OD1 no hydrogen 2.783 N/A HIS 51.A N ASN 48.A O no hydrogen 2.816 N/A THR 55.A N TYR 5.A O no hydrogen 3.178 N/A THR 55.A OG1 THR 52.A O no hydrogen 2.857 N/A LEU 56.A N ILE 63.A O no hydrogen 2.752 N/A GLU 57.A N ILE 3.A O no hydrogen 2.805 N/A ASP 58.A N HIS 61.A O no hydrogen 2.929 N/A HIS 61.A N ASP 58.A O no hydrogen 2.981 N/A ILE 63.A N LEU 56.A O no hydrogen 2.861 N/A TRP 64.A NE1 GLN 50.A OE1 no hydrogen 2.843 N/A HIS 67.A N ASP 65.A OD1 no hydrogen 2.917 N/A HIS 67.A ND1 ASP 65.A OD1 no hydrogen 2.702 N/A HIS 67.A NE2 GLU 101.A OE1 no hydrogen 2.630 N/A ILE 69.A N ASP 65.A O no hydrogen 2.872 N/A ILE 70.A N SER 66.A O no hydrogen 2.902 N/A ALA 71.A N HIS 67.A O no hydrogen 3.225 N/A TYR 72.A N ALA 68.A O no hydrogen 3.047 N/A TYR 72.A OH ASP 58.A OD1 no hydrogen 2.919 N/A LEU 73.A N ILE 69.A O no hydrogen 2.817 N/A VAL 74.A N ILE 70.A O no hydrogen 3.119 N/A SER 75.A N ALA 71.A O no hydrogen 2.965 N/A SER 75.A OG ALA 71.A O no hydrogen 2.958 N/A LYS 76.A N TYR 72.A O no hydrogen 2.836 N/A LYS 76.A NZ ASP 58.A OD1 no hydrogen 3.033 N/A LYS 76.A NZ ASP 58.A OD2 no hydrogen 3.508 N/A LYS 76.A NZ TYR 72.A OH no hydrogen 3.391 N/A LYS 76.A NZ TYR 77.A OH no hydrogen 3.247 N/A TYR 77.A N LEU 73.A O no hydrogen 2.861 N/A TYR 77.A OH ASP 58.A OD1 no hydrogen 2.770 N/A GLY 78.A N VAL 74.A O no hydrogen 2.843 N/A SER 82.A N THR 80.A OG1 no hydrogen 3.201 N/A TYR 84.A N ASP 81.A O no hydrogen 2.938 N/A TYR 84.A OH ASP 95.A OD1 no hydrogen 2.611 N/A LYS 86.A N ASP 81.A OD2 no hydrogen 2.841 N/A GLN 90.A N ASP 87.A OD2 no hydrogen 2.914 N/A ARG 91.A N ASP 87.A O no hydrogen 2.794 N/A ARG 91.A NE PRO 85.A O no hydrogen 2.866 N/A ARG 91.A NH1 TYR 84.A O no hydrogen 3.013 N/A ARG 91.A NH1 PRO 85.A O no hydrogen 3.326 N/A ALA 92.A N LEU 88.A O no hydrogen 2.932 N/A VAL 93.A N LEU 89.A O no hydrogen 3.347 N/A VAL 94.A N GLN 90.A O no hydrogen 3.167 N/A ASP 95.A N ARG 91.A O no hydrogen 2.767 N/A GLN 96.A N ALA 92.A O no hydrogen 2.996 N/A ARG 97.A N VAL 93.A O no hydrogen 2.923 N/A ARG 97.A NE VAL 150.A O no hydrogen 2.692 N/A ARG 97.A NH1 GLN 96.A OE1 no hydrogen 2.755 N/A ARG 97.A NH2 VAL 150.A O no hydrogen 2.915 N/A LEU 98.A N VAL 94.A O no hydrogen 2.869 N/A HIS 99.A N ASP 95.A O no hydrogen 2.901 N/A PHE 100.A N GLN 96.A O no hydrogen 2.817 N/A GLU 101.A N ARG 97.A O no hydrogen 3.002 N/A SER 102.A N LEU 98.A O no hydrogen 3.000 N/A SER 102.A OG LEU 98.A O no hydrogen 3.447 N/A GLY 103.A N HIS 99.A O no hydrogen 3.095 N/A ILE 105.A N PHE 100.A O no hydrogen 3.148 N/A PHE 106.A N GLU 101.A O no hydrogen 2.725 N/A ALA 107.A N SER 102.A O no hydrogen 3.198 N/A ASN 108.A N GLY 103.A O no hydrogen 2.840 N/A ALA 109.A N ILE 105.A O no hydrogen 2.909 N/A LEU 110.A N ILE 105.A O no hydrogen 3.091 N/A LEU 110.A N PHE 106.A O no hydrogen 3.294 N/A ARG 111.A N PHE 106.A O no hydrogen 2.815 N/A ARG 111.A NH2 THR 114.A OG1 no hydrogen 3.357 N/A SER 112.A OG ASN 108.A O no hydrogen 2.694 N/A ILE 113.A N LEU 110.A O no hydrogen 2.943 N/A THR 114.A N LEU 110.A O no hydrogen 2.969 N/A LYS 115.A N ARG 111.A O no hydrogen 3.005 N/A LEU 117.A N ILE 113.A O no hydrogen 3.038 N/A PHE 118.A N THR 114.A O no hydrogen 2.812 N/A ALA 119.A N LYS 115.A O no hydrogen 3.155 N/A GLY 120.A N LEU 117.A O no hydrogen 3.039 N/A LYS 121.A N PRO 116.A O no hydrogen 2.963 N/A ILE 125.A N THR 217.A O no hydrogen 2.738 N/A GLU 128.A N GLU 128.A OE2 no hydrogen 2.876 N/A ARG 129.A N PRO 126.A O no hydrogen 2.905 N/A ARG 129.A NH1 ASN 108.A O no hydrogen 2.902 N/A ASP 131.A N LYS 127.A O no hydrogen 2.962 N/A ALA 132.A N GLU 128.A O no hydrogen 2.956 N/A ILE 133.A N TYR 130.A O no hydrogen 3.024 N/A ILE 134.A N TYR 130.A O no hydrogen 3.122 N/A GLU 135.A N ASP 131.A O no hydrogen 2.878 N/A VAL 136.A N ALA 132.A O no hydrogen 3.247 N/A TYR 137.A N ILE 133.A O no hydrogen 3.085 N/A TYR 137.A OH VAL 173.A O no hydrogen 2.728 N/A ASP 138.A N ILE 134.A O no hydrogen 2.877 N/A PHE 139.A N GLU 135.A O no hydrogen 3.008 N/A LEU 140.A N VAL 136.A O no hydrogen 2.807 N/A GLU 141.A N TYR 137.A O no hydrogen 2.897 N/A LYS 142.A N ASP 138.A O no hydrogen 3.209 N/A PHE 143.A N PHE 139.A O no hydrogen 2.846 N/A LEU 144.A N LEU 140.A O no hydrogen 2.906 N/A ALA 145.A N GLU 141.A O no hydrogen 3.235 N/A ASN 147.A N LEU 144.A O no hydrogen 2.822 N/A ASP 148.A N ASN 153.A OD1 no hydrogen 2.906 N/A TYR 149.A N GLY 152.A O no hydrogen 3.101 N/A VAL 150.A N ASP 159.A OD1 no hydrogen 2.872 N/A GLY 152.A N TYR 149.A O no hydrogen 3.500 N/A GLN 154.A NE2.A ASN 153.A O no hydrogen 2.823 N/A GLN 154.A NE2.B SER 82.A O no hydrogen 2.620 N/A THR 156.A N ASP 159.A OD2 no hydrogen 2.905 N/A ILE 157.A N LEU 83.A O no hydrogen 2.920 N/A ALA 158.A N THR 156.A OG1 no hydrogen 3.192 N/A ASP 159.A N THR 156.A O no hydrogen 2.905 N/A SER 161.A N ILE 157.A O no hydrogen 2.975 N/A SER 161.A OG HIS 67.A NE2 no hydrogen 3.084 N/A ILE 162.A N ALA 158.A O no hydrogen 2.980 N/A ILE 163.A N ASP 159.A O no hydrogen 2.854 N/A SER 164.A N PHE 160.A O no hydrogen 3.223 N/A SER 164.A OG PRO 11.A O no hydrogen 3.201 N/A SER 164.A OG SER 161.A O no hydrogen 2.664 N/A THR 165.A OG1 GLU 101.A OE2 no hydrogen 2.637 N/A THR 165.A OG1 SER 161.A O no hydrogen 3.516 N/A THR 165.A OG1 ILE 162.A O no hydrogen 3.406 N/A VAL 166.A N ILE 162.A O no hydrogen 2.885 N/A SER 167.A N ILE 163.A O no hydrogen 2.893 N/A SER 167.A OG ILE 163.A O no hydrogen 2.801 N/A SER 167.A OG SER 164.A O no hydrogen 3.134 N/A SER 168.A N THR 165.A O no hydrogen 2.918 N/A LEU 169.A N THR 165.A O no hydrogen 2.794 N/A GLU 170.A N VAL 166.A O no hydrogen 3.310 N/A VAL 171.A N SER 168.A O no hydrogen 3.156 N/A PHE 172.A N LEU 169.A O no hydrogen 2.921 N/A VAL 173.A N LEU 169.A O no hydrogen 3.059 N/A VAL 175.A N GLU 170.A OE1 no hydrogen 2.853 N/A THR 178.A N ASP 176.A OD1 no hydrogen 2.904 N/A LYS 179.A N ASP 176.A OD1 no hydrogen 3.176 N/A TYR 180.A N ASP 176.A O no hydrogen 2.799 N/A TYR 180.A OH ASP 138.A OD1 no hydrogen 2.668 N/A ARG 182.A N GLU 141.A OE2 no hydrogen 2.963 N/A ARG 182.A NE ALA 145.A O no hydrogen 3.179 N/A ARG 182.A NH1 GLU 141.A OE2 no hydrogen 2.812 N/A ILE 183.A N GLU 141.A OE1 no hydrogen 2.880 N/A ALA 184.A N TYR 180.A O no hydrogen 3.024 N/A ALA 185.A N PRO 181.A O no hydrogen 2.969 N/A TRP 186.A N ARG 182.A O no hydrogen 2.922 N/A TRP 186.A NE1 ASP 159.A OD1 no hydrogen 2.858 N/A PHE 187.A N ILE 183.A O no hydrogen 2.861 N/A LYS 188.A N ALA 184.A O no hydrogen 3.097 N/A ARG 189.A N ALA 185.A O no hydrogen 3.029 N/A ARG 189.A NH1 ASP 148.A O no hydrogen 2.816 N/A LEU 190.A N TRP 186.A O no hydrogen 3.026 N/A GLN 191.A N PHE 187.A O no hydrogen 2.931 N/A LYS 192.A N LYS 188.A O no hydrogen 3.192 N/A LYS 192.A N ARG 189.A O no hydrogen 3.311 N/A LEU 193.A N LEU 190.A O no hydrogen 3.011 N/A TYR 196.A N LEU 193.A O no hydrogen 3.012 N/A ALA 199.A N TYR 195.A O no hydrogen 2.953 N/A ASN 200.A N TYR 196.A O no hydrogen 2.784 N/A ASN 200.A ND2 SER 167.A OG no hydrogen 3.086 N/A ASN 200.A ND2 TYR 196.A OH no hydrogen 3.039 N/A GLY 201.A N TYR 196.A O no hydrogen 3.029 N/A ASN 202.A N GLU 197.A O no hydrogen 2.872 N/A ALA 204.A N ASN 200.A O no hydrogen 2.951 N/A ARG 205.A N GLY 201.A O no hydrogen 3.015 N/A ARG 205.A NH1 GLU 197.A OE2 no hydrogen 2.807 N/A ARG 205.A NH1 ASN 202.A OD1 no hydrogen 2.803 N/A ARG 205.A NH2 GLU 197.A OE2 no hydrogen 2.871 N/A THR 206.A N ASN 202.A O no hydrogen 3.024 N/A THR 206.A OG1 ASN 202.A O no hydrogen 3.262 N/A PHE 207.A N GLY 203.A O no hydrogen 2.877 N/A GLU 208.A N ALA 204.A O no hydrogen 2.955 N/A SER 209.A N ARG 205.A O no hydrogen 2.999 N/A SER 209.A OG THR 206.A O no hydrogen 2.576 N/A PHE 210.A N THR 206.A O no hydrogen 3.022 N/A ILE 211.A N PHE 207.A O no hydrogen 3.054 N/A ARG 212.A N GLU 208.A O no hydrogen 2.922 N/A GLU 213.A N PHE 210.A O no hydrogen 3.181 N/A TYR 214.A N ILE 211.A O no hydrogen 2.977 N/A THR 217.A N THR 123.A O no hydrogen 3.027 N/A ALA 219.A N ILE 125.A O no hydrogen 2.813 N/A SER 220.A OG ASN 221.A O no hydrogen 2.787 N/A