Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4mhb_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): LEU 5.A N ILE 9.A O no hydrogen 2.875 N/A ASN 6.A ND2 ILE 147.A O no hydrogen 3.503 N/A ASN 6.A ND2 PRO 148.A O no hydrogen 3.376 N/A ASN 7.A ND2 ARG 126.A O no hydrogen 2.949 N/A GLY 8.A N LEU 5.A O no hydrogen 2.887 N/A ILE 9.A N ASN 7.A OD1 no hydrogen 3.271 N/A LEU 12.A N GLN 1.A O no hydrogen 2.985 N/A GLY 14.A N SER 219.A O no hydrogen 2.941 N/A PHE 15.A N LEU 39.A O no hydrogen 2.995 N/A GLY 16.A N ALA 221.A O no hydrogen 3.366 N/A VAL 17.A N ASP 41.A O no hydrogen 3.071 N/A ALA 23.A N ASN 21.A OD1 no hydrogen 2.714 N/A CYS 25.A N ASN 21.A O no hydrogen 3.422 N/A GLU 26.A N THR 22.A O no hydrogen 2.982 N/A ARG 27.A N ALA 23.A O no hydrogen 2.916 N/A ARG 27.A NE ASP 31.A OD1 no hydrogen 2.716 N/A ALA 28.A N GLU 24.A O no hydrogen 2.892 N/A VAL 29.A N CYS 25.A O no hydrogen 3.160 N/A ILE 30.A N GLU 26.A O no hydrogen 3.126 N/A ASP 31.A N ARG 27.A O no hydrogen 2.847 N/A ALA 32.A N ALA 28.A O no hydrogen 2.813 N/A ILE 33.A N VAL 29.A O no hydrogen 2.964 N/A GLU 34.A N ILE 30.A O no hydrogen 2.948 N/A THR 35.A N ASP 31.A O no hydrogen 2.829 N/A THR 35.A OG1 ASP 31.A O no hydrogen 2.738 N/A GLY 36.A N ALA 32.A O no hydrogen 3.195 N/A GLY 36.A N ILE 33.A O no hydrogen 3.085 N/A TYR 37.A N ALA 32.A O no hydrogen 3.024 N/A ARG 38.A NH1 ILE 33.A O no hydrogen 2.835 N/A ARG 38.A NH1 TYR 37.A O no hydrogen 2.890 N/A ILE 40.A N PHE 67.A O no hydrogen 2.996 N/A ASP 41.A N PHE 15.A O no hydrogen 3.015 N/A THR 42.A N THR 69.A O no hydrogen 2.948 N/A THR 42.A OG1 ASN 48.A OD1 no hydrogen 2.713 N/A ALA 43.A N THR 42.A OG1 no hydrogen 2.769 N/A ALA 44.A N LYS 71.A O no hydrogen 3.089 N/A TYR 46.A N ALA 43.A O no hydrogen 3.099 N/A GLN 47.A N ALA 44.A O no hydrogen 3.028 N/A VAL 52.A N ASN 48.A O no hydrogen 3.035 N/A GLY 53.A N GLU 49.A O no hydrogen 2.913 N/A ASN 54.A N THR 50.A O no hydrogen 2.927 N/A ASN 54.A ND2 GLU 26.A OE1 no hydrogen 3.452 N/A ALA 55.A N GLN 51.A O no hydrogen 2.991 N/A LEU 56.A N VAL 52.A O no hydrogen 3.007 N/A LYS 57.A N GLY 53.A O no hydrogen 3.230 N/A LEU 58.A N ASN 54.A O no hydrogen 3.067 N/A SER 59.A N LEU 56.A O no hydrogen 3.205 N/A SER 59.A OG LEU 56.A O no hydrogen 2.818 N/A ILE 61.A N SER 59.A OG no hydrogen 3.079 N/A ARG 63.A NH1 ARG 63.A O no hydrogen 2.928 N/A ARG 63.A NH1 LEU 66.A O no hydrogen 3.037 N/A ARG 63.A NH1 ASP 99.A OD1 no hydrogen 3.094 N/A ARG 63.A NH2 TYR 97.A O no hydrogen 2.940 N/A ARG 63.A NH2 ASP 99.A OD1 no hydrogen 2.847 N/A GLU 65.A N ALA 62.A O no hydrogen 2.977 N/A LEU 66.A N ARG 63.A O no hydrogen 3.074 N/A PHE 67.A N ARG 38.A O no hydrogen 2.810 N/A ILE 68.A N ASP 99.A OD1 no hydrogen 2.823 N/A THR 69.A N ILE 40.A O no hydrogen 2.977 N/A THR 70.A N LEU 100.A O no hydrogen 3.199 N/A THR 70.A OG1 GLU 49.A OE2 no hydrogen 2.655 N/A LYS 71.A N THR 70.A OG1 no hydrogen 2.824 N/A LYS 71.A NZ ASP 41.A OD1 no hydrogen 2.702 N/A LYS 71.A NZ ASP 41.A OD2 no hydrogen 3.405 N/A LYS 71.A NZ THR 42.A O no hydrogen 2.887 N/A LYS 71.A NZ TYR 46.A OH no hydrogen 2.993 N/A LEU 72.A N LEU 102.A O no hydrogen 2.835 N/A TRP 73.A N GLN 85.A OE1 no hydrogen 2.850 N/A TRP 73.A NE1 GLN 75.A OE1 no hydrogen 2.826 N/A ASP 76.A N TRP 73.A O no hydrogen 3.073 N/A THR 77.A N LEU 74.A O no hydrogen 3.213 N/A TYR 78.A N ASP 76.A O no hydrogen 2.889 N/A TYR 79.A OH GLU 118.A OE1 no hydrogen 2.444 N/A TYR 79.A OH GLU 118.A OE2 no hydrogen 3.386 N/A GLU 80.A N GLU 80.A OE1 no hydrogen 2.836 N/A ALA 82.A N TYR 78.A O no hydrogen 2.976 N/A LYS 83.A NZ GLU 118.A OE1 no hydrogen 2.677 N/A ALA 84.A N GLU 80.A O no hydrogen 3.152 N/A GLN 85.A N GLY 81.A O no hydrogen 2.848 N/A GLN 85.A NE2 TRP 73.A O no hydrogen 3.154 N/A GLN 85.A NE2 ASP 76.A OD2 no hydrogen 2.877 N/A PHE 86.A N ALA 82.A O no hydrogen 2.921 N/A GLU 87.A N LYS 83.A O no hydrogen 3.105 N/A ARG 88.A N ALA 84.A O no hydrogen 3.114 N/A ARG 88.A NE VAL 274.A OXT no hydrogen 2.759 N/A ARG 88.A NH2 ASP 76.A OD2 no hydrogen 2.889 N/A ARG 88.A NH2 VAL 274.A O no hydrogen 2.884 N/A ARG 88.A NH2 VAL 274.A OXT no hydrogen 3.355 N/A SER 89.A N GLN 85.A O no hydrogen 2.886 N/A SER 89.A OG GLU 49.A OE1 no hydrogen 3.170 N/A SER 89.A OG GLU 49.A OE2 no hydrogen 2.713 N/A SER 89.A OG GLN 85.A O no hydrogen 3.541 N/A LEU 90.A N PHE 86.A O no hydrogen 2.946 N/A ASN 91.A N GLU 87.A O no hydrogen 3.055 N/A ARG 92.A N ARG 88.A O no hydrogen 2.935 N/A ARG 92.A NE GLU 49.A OE1 no hydrogen 2.769 N/A ARG 92.A NH1 VAL 274.A OXT no hydrogen 2.994 N/A ARG 92.A NH2 GLU 49.A OE1 no hydrogen 2.955 N/A ARG 92.A NH2 SER 89.A OG no hydrogen 3.408 N/A ARG 92.A NH2 VAL 274.A OXT no hydrogen 3.039 N/A LEU 93.A N SER 89.A O no hydrogen 2.869 N/A GLN 94.A N ASN 91.A O no hydrogen 3.182 N/A LEU 95.A N LEU 90.A O no hydrogen 3.093 N/A VAL 98.A N LYS 124.A O no hydrogen 3.104 N/A ASP 99.A N ILE 68.A O no hydrogen 3.059 N/A LEU 100.A N ILE 68.A O no hydrogen 3.248 N/A TYR 101.A N ALA 127.A O no hydrogen 3.138 N/A LEU 102.A N THR 70.A O no hydrogen 3.065 N/A ILE 103.A N GLY 129.A O no hydrogen 3.013 N/A HIS 104.A N LEU 72.A O no hydrogen 3.161 N/A TYR 107.A OH HIS 259.A O no hydrogen 2.705 N/A ASP 109.A N THR 77.A O no hydrogen 2.921 N/A VAL 110.A N GLY 108.A O no hydrogen 2.814 N/A HIS 111.A NE2 ASP 140.A OD2 no hydrogen 2.820 N/A GLY 112.A N ASP 109.A OD1 no hydrogen 2.933 N/A ALA 113.A N ASP 109.A O no hydrogen 2.943 N/A TRP 114.A N VAL 110.A O no hydrogen 2.896 N/A TRP 114.A NE1 ILE 146.A O no hydrogen 3.063 N/A ARG 115.A N HIS 111.A O no hydrogen 3.012 N/A ALA 116.A N GLY 112.A O no hydrogen 3.186 N/A GLU 118.A N ARG 115.A O no hydrogen 3.115 N/A LEU 119.A N ALA 116.A O no hydrogen 2.879 N/A HIS 120.A ND1 ILE 125.A O no hydrogen 2.749 N/A GLN 121.A N GLU 117.A O no hydrogen 2.914 N/A ALA 122.A N GLU 118.A O no hydrogen 2.897 N/A ALA 122.A N LEU 119.A O no hydrogen 3.241 N/A GLY 123.A N HIS 120.A O no hydrogen 2.956 N/A LYS 124.A N LEU 119.A O no hydrogen 3.107 N/A LYS 124.A NZ GLU 87.A OE2 no hydrogen 2.819 N/A ARG 126.A N VAL 98.A O no hydrogen 2.959 N/A ARG 126.A NH1 ASP 99.A OD2 no hydrogen 2.873 N/A GLY 129.A N TYR 101.A O no hydrogen 2.976 N/A VAL 130.A N VAL 150.A O no hydrogen 2.958 N/A SER 131.A OG GLN 152.A O no hydrogen 2.781 N/A ASN 132.A N GLN 152.A O no hydrogen 2.905 N/A ASN 132.A ND2 HIS 104.A O no hydrogen 3.052 N/A ASN 132.A ND2 GLN 105.A OE1 no hydrogen 3.486 N/A PHE 133.A N ASN 151.A OD1 no hydrogen 3.405 N/A ARG 137.A NH1 PRO 106.A O no hydrogen 3.175 N/A ARG 137.A NH2 PRO 106.A O no hydrogen 3.535 N/A LEU 138.A N HIS 134.A O no hydrogen 3.033 N/A ALA 139.A N PRO 135.A O no hydrogen 2.842 N/A ASP 140.A N ASP 136.A O no hydrogen 3.009 N/A LEU 141.A N ARG 137.A O no hydrogen 2.970 N/A ASN 144.A ND2 HIS 111.A ND1 no hydrogen 3.095 N/A ASN 144.A ND2 LEU 141.A O no hydrogen 2.850 N/A LYS 145.A N GLU 117.A OE2 no hydrogen 3.034 N/A ILE 146.A N GLU 117.A OE2 no hydrogen 2.833 N/A ALA 149.A N ILE 128.A O no hydrogen 2.836 N/A ASN 151.A N GLN 173.A O no hydrogen 3.063 N/A ASN 151.A ND2 PHE 133.A O no hydrogen 2.846 N/A GLN 152.A N VAL 130.A O no hydrogen 2.949 N/A GLN 152.A NE2 ASP 41.A OD2 no hydrogen 2.939 N/A GLN 152.A NE2 GLU 175.A OE1 no hydrogen 2.976 N/A ILE 153.A N GLU 175.A O no hydrogen 2.908 N/A VAL 155.A N TRP 177.A O no hydrogen 3.144 N/A ASN 156.A N ASN 159.A O no hydrogen 3.167 N/A ASN 156.A ND2 GLU 154.A OE2 no hydrogen 2.897 N/A ASN 156.A ND2 ALA 178.A O no hydrogen 3.102 N/A PHE 158.A N ASN 156.A OD1 no hydrogen 3.181 N/A ASN 159.A N ASN 156.A O no hydrogen 3.015 N/A GLN 160.A N ASP 250.A OD1 no hydrogen 2.827 N/A GLN 160.A NE2 PRO 157.A O no hydrogen 2.827 N/A GLN 160.A NE2 ILE 246.A O no hydrogen 2.881 N/A GLN 161.A NE2 GLU 154.A O no hydrogen 2.863 N/A VAL 165.A N GLN 161.A O no hydrogen 3.002 N/A TRP 167.A N HIS 163.A O no hydrogen 2.910 N/A GLN 168.A NE2 ARG 215.A O no hydrogen 3.128 N/A GLN 168.A NE2 GLY 216.A O no hydrogen 3.370 N/A SER 169.A N PRO 166.A O no hydrogen 2.848 N/A SER 169.A OG PRO 166.A O no hydrogen 3.400 N/A SER 169.A OG TRP 167.A O no hydrogen 2.690 N/A ARG 170.A N TRP 167.A O no hydrogen 3.271 N/A ARG 170.A NH1 SER 169.A OG no hydrogen 2.812 N/A GLY 171.A N GLN 168.A O no hydrogen 3.033 N/A GLN 173.A N ALA 149.A O no hydrogen 3.011 N/A GLN 173.A NE2 PRO 174.A O no hydrogen 2.885 N/A GLN 173.A NE2 GLY 216.A O no hydrogen 2.904 N/A GLU 175.A N ASN 151.A O no hydrogen 3.123 N/A ALA 176.A N VAL 218.A O no hydrogen 2.704 N/A TRP 177.A N ILE 153.A O no hydrogen 2.881 N/A TRP 177.A NE1 ASN 132.A OD1 no hydrogen 2.904 N/A ALA 181.A N ALA 178.A O no hydrogen 3.046 N/A GLY 183.A N PHE 180.A O no hydrogen 2.859 N/A ARG 184.A N ALA 181.A O no hydrogen 2.765 N/A ARG 184.A NH1 ALA 255.A O no hydrogen 2.698 N/A LEU 187.A N ARG 184.A O no hydrogen 3.263 N/A GLN 189.A N GLY 186.A O no hydrogen 3.307 N/A ASN 190.A N LEU 187.A O no hydrogen 3.057 N/A LEU 193.A N ASN 190.A OD1 no hydrogen 3.045 N/A THR 194.A N ASN 190.A O no hydrogen 2.915 N/A THR 194.A OG1 ASN 190.A O no hydrogen 2.845 N/A ALA 195.A N PRO 191.A O no hydrogen 3.023 N/A ILE 196.A N VAL 192.A O no hydrogen 3.075 N/A GLY 197.A N LEU 193.A O no hydrogen 2.946 N/A GLU 198.A N THR 194.A O no hydrogen 3.008 N/A LYS 199.A N ALA 195.A O no hydrogen 3.349 N/A LYS 199.A N ILE 196.A O no hydrogen 3.113 N/A LYS 199.A NZ ASP 243.A OD1 no hydrogen 2.665 N/A TYR 200.A N GLY 197.A O no hydrogen 2.954 N/A TYR 200.A OH ASP 243.A OD2 no hydrogen 2.480 N/A LYS 202.A N GLY 197.A O no hydrogen 2.975 N/A LYS 202.A NZ ASN 233.A O no hydrogen 2.865 N/A LYS 202.A NZ ASP 236.A OD1 no hydrogen 3.002 N/A LYS 202.A NZ ASP 236.A OD2 no hydrogen 2.918 N/A SER 203.A N GLN 206.A OE1 no hydrogen 2.894 N/A SER 203.A OG GLN 206.A OE1 no hydrogen 3.345 N/A SER 203.A OG GLU 230.A OE2 no hydrogen 2.616 N/A GLN 206.A N SER 203.A OG no hydrogen 3.042 N/A GLN 206.A NE2 GLU 230.A O no hydrogen 2.829 N/A VAL 207.A N SER 203.A O no hydrogen 2.982 N/A VAL 208.A N VAL 204.A O no hydrogen 2.918 N/A LEU 209.A N GLY 205.A O no hydrogen 2.933 N/A ARG 210.A N GLN 206.A O no hydrogen 2.917 N/A ARG 210.A NE GLN 214.A OE1 no hydrogen 2.863 N/A ARG 210.A NH1 ILE 234.A O no hydrogen 3.019 N/A TRP 211.A N VAL 207.A O no hydrogen 2.882 N/A ILE 212.A N VAL 208.A O no hydrogen 3.061 N/A PHE 213.A N LEU 209.A O no hydrogen 2.901 N/A GLN 214.A N ARG 210.A O no hydrogen 2.900 N/A GLN 214.A NE2 LEU 239.A O no hydrogen 3.040 N/A ARG 215.A N TRP 211.A O no hydrogen 3.169 N/A ARG 215.A N ILE 212.A O no hydrogen 3.106 N/A ARG 215.A NH1 GLN 160.A O no hydrogen 2.758 N/A ARG 215.A NH2 GLN 160.A O no hydrogen 2.998 N/A ARG 215.A NH2 GLN 161.A O no hydrogen 3.386 N/A GLY 216.A N PHE 213.A O no hydrogen 2.800 N/A ILE 217.A N ILE 212.A O no hydrogen 3.235 N/A VAL 218.A N PRO 174.A O no hydrogen 3.174 N/A SER 219.A N LEU 12.A O no hydrogen 2.977 N/A LEU 220.A N ALA 176.A O no hydrogen 3.036 N/A ALA 221.A N GLY 14.A O no hydrogen 3.068 N/A SER 223.A OG ARG 225.A O no hydrogen 3.357 N/A ARG 225.A N SER 223.A OG no hydrogen 3.033 N/A GLU 230.A N GLY 227.A O no hydrogen 3.132 N/A ASN 231.A N ARG 228.A O no hydrogen 2.842 N/A ASN 233.A N GLU 230.A O no hydrogen 3.117 N/A ILE 234.A N ILE 232.A O no hydrogen 2.993 N/A LEU 239.A N GLN 214.A OE1 no hydrogen 2.810 N/A SER 240.A N ASP 243.A OD2 no hydrogen 2.798 N/A ASP 243.A N SER 240.A OG no hydrogen 3.062 N/A GLN 245.A N GLU 242.A O no hydrogen 3.030 N/A GLN 245.A NE2 GLU 242.A OE2 no hydrogen 2.978 N/A ILE 246.A N ASP 243.A O no hydrogen 3.037 N/A ALA 248.A N LEU 244.A O no hydrogen 3.154 N/A LEU 249.A N ILE 246.A O no hydrogen 2.870 N/A ASP 250.A N ALA 247.A O no hydrogen 3.126 N/A THR 251.A N PHE 158.A O no hydrogen 3.102 N/A THR 251.A OG1 PHE 158.A O no hydrogen 2.953 N/A ALA 252.A N ASP 250.A OD1 no hydrogen 2.995 N/A THR 253.A N PHE 158.A O no hydrogen 3.279 N/A THR 253.A OG1 THR 251.A O no hydrogen 3.014 N/A SER 254.A OG GLU 154.A OE1 no hydrogen 2.599 N/A SER 254.A OG PHE 257.A O no hydrogen 3.266 N/A ALA 255.A N GLU 154.A OE2 no hydrogen 2.837 N/A PHE 256.A N SER 254.A OG no hydrogen 2.802 N/A PHE 257.A N SER 254.A OG no hydrogen 3.175 N/A ARG 260.A N SER 258.A OG no hydrogen 2.913 N/A ARG 260.A NH2 ASP 136.A OD1 no hydrogen 2.997 N/A ASP 261.A N SER 258.A O no hydrogen 3.131 N/A ALA 263.A N ASP 261.A OD1 no hydrogen 2.906 N/A GLU 265.A N PRO 262.A O no hydrogen 2.879 N/A TRP 266.A N ALA 263.A O no hydrogen 2.871 N/A THR 268.A N VAL 264.A O no hydrogen 2.983 N/A THR 268.A OG1 VAL 264.A O no hydrogen 2.737 N/A THR 268.A OG1 GLU 265.A O no hydrogen 3.515 N/A GLY 269.A N TRP 266.A O no hydrogen 3.188 N/A ARG 270.A N LEU 267.A O no hydrogen 3.191 N/A LEU 272.A N GLN 75.A OE1 no hydrogen 2.808 N/A