Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4ivp_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): LEU 4.A N THR 285.A O no hydrogen 2.650 N/A LEU 5.A N LEU 107.A O no hydrogen 2.873 N/A ARG 6.A NE TYR 8.A OH no hydrogen 3.096 N/A ARG 6.A NH1 PRO 149.A O no hydrogen 3.168 N/A ARG 6.A NH2 TYR 8.A OH no hydrogen 3.565 N/A VAL 7.A N LEU 109.A O no hydrogen 2.887 N/A TYR 8.A N ASN 152.A O no hydrogen 2.804 N/A ILE 9.A N PHE 111.A O no hydrogen 2.867 N/A ASP 10.A N VAL 154.A O no hydrogen 2.837 N/A GLY 11.A N ASP 10.A OD1 no hydrogen 2.673 N/A HIS 13.A N TYR 122.A OH no hydrogen 3.206 N/A HIS 13.A ND1 TYR 122.A OH no hydrogen 2.666 N/A HIS 13.A NE2 GLU 175.A OE2 no hydrogen 3.137 N/A LYS 17.A NZ ILE 9.A O no hydrogen 3.087 N/A LYS 17.A NZ ASP 112.A OD1 no hydrogen 3.244 N/A THR 18.A OG1 ASP 112.A OD2 no hydrogen 3.272 N/A THR 20.A N GLY 16.A O no hydrogen 3.109 N/A THR 20.A OG1 GLY 16.A O no hydrogen 3.021 N/A THR 21.A N LYS 17.A O no hydrogen 3.203 N/A THR 21.A OG1 LYS 17.A O no hydrogen 2.874 N/A GLN 22.A N THR 18.A O no hydrogen 3.221 N/A LEU 23.A N THR 19.A O no hydrogen 3.236 N/A LEU 24.A N THR 20.A O no hydrogen 3.280 N/A VAL 25.A N THR 21.A O no hydrogen 2.904 N/A ALA 26.A N GLN 22.A O no hydrogen 3.234 N/A ALA 26.A N LEU 23.A O no hydrogen 3.061 N/A LEU 27.A N LEU 24.A O no hydrogen 3.156 N/A SER 29.A OG ASP 31.A OD1 no hydrogen 3.208 N/A VAL 34.A N THR 108.A O no hydrogen 2.911 N/A TYR 35.A OH ASP 112.A OD2 no hydrogen 3.185 N/A VAL 36.A N ILE 110.A O no hydrogen 2.754 N/A MET 40.A N GLU 38.A O no hydrogen 2.765 N/A THR 41.A N MET 307.A O no hydrogen 2.987 N/A THR 41.A OG1 GLY 308.A O no hydrogen 3.484 N/A TRP 43.A N PRO 39.A O no hydrogen 3.194 N/A TRP 43.A NE1 MET 83.A O no hydrogen 2.877 N/A ARG 44.A N MET 40.A O no hydrogen 2.865 N/A ARG 44.A NE GLU 50.A OE1 no hydrogen 2.904 N/A ARG 44.A NE GLU 50.A OE2 no hydrogen 3.388 N/A ARG 44.A NH2 GLU 50.A OE2 no hydrogen 2.911 N/A VAL 45.A N THR 41.A O no hydrogen 2.872 N/A LEU 46.A N THR 41.A O no hydrogen 3.062 N/A GLY 47.A N TYR 42.A O no hydrogen 2.839 N/A GLU 50.A N ARG 44.A O no hydrogen 2.885 N/A THR 51.A N TRP 43.A O no hydrogen 2.972 N/A THR 51.A OG1 TRP 43.A O no hydrogen 2.633 N/A ASN 54.A N GLU 50.A O no hydrogen 3.060 N/A ILE 55.A N THR 51.A O no hydrogen 2.918 N/A TYR 56.A N ILE 52.A O no hydrogen 3.025 N/A THR 57.A N ALA 53.A O no hydrogen 2.911 N/A THR 57.A OG1 ALA 53.A O no hydrogen 2.970 N/A THR 58.A N ASN 54.A O no hydrogen 3.014 N/A THR 58.A OG1 ASN 54.A O no hydrogen 2.828 N/A THR 58.A OG1 ASN 54.A OD1 no hydrogen 3.529 N/A GLN 59.A N ILE 55.A O no hydrogen 3.153 N/A GLN 59.A NE2 ASP 63.A OD1 no hydrogen 2.963 N/A GLN 59.A NE2 MET 129.A O no hydrogen 3.203 N/A HIS 60.A N TYR 56.A O no hydrogen 2.980 N/A ARG 61.A N THR 57.A O no hydrogen 2.884 N/A LEU 62.A N THR 58.A O no hydrogen 2.934 N/A ASP 63.A N GLN 59.A O no hydrogen 2.862 N/A GLN 64.A N HIS 60.A O no hydrogen 3.000 N/A GLY 65.A N LEU 62.A O no hydrogen 2.976 N/A GLU 66.A N ARG 61.A O no hydrogen 2.813 N/A ASP 71.A N SER 68.A OG no hydrogen 3.123 N/A ALA 72.A N SER 68.A O no hydrogen 2.987 N/A ALA 73.A N ALA 69.A O no hydrogen 2.938 N/A VAL 74.A N GLY 70.A O no hydrogen 3.261 N/A VAL 75.A N ASP 71.A O no hydrogen 3.426 N/A MET 76.A N ALA 72.A O no hydrogen 2.862 N/A THR 77.A N ALA 73.A O no hydrogen 2.924 N/A THR 77.A OG1 ALA 73.A O no hydrogen 2.750 N/A SER 78.A N VAL 74.A O no hydrogen 3.101 N/A SER 78.A OG VAL 74.A O no hydrogen 2.960 N/A ALA 79.A N VAL 75.A O no hydrogen 2.867 N/A GLN 80.A N MET 76.A O no hydrogen 2.988 N/A GLN 80.A NE2 ALA 118.A O no hydrogen 3.175 N/A ILE 81.A N THR 77.A O no hydrogen 3.300 N/A THR 82.A N SER 78.A O no hydrogen 3.321 N/A THR 82.A OG1 SER 78.A O no hydrogen 3.536 N/A MET 83.A N ALA 79.A O no hydrogen 2.843 N/A GLY 84.A N GLN 80.A O no hydrogen 3.047 N/A MET 85.A N ILE 81.A O no hydrogen 3.231 N/A ALA 88.A N GLY 84.A O no hydrogen 2.947 N/A VAL 89.A N MET 85.A O no hydrogen 2.917 N/A THR 90.A N PRO 86.A O no hydrogen 3.204 N/A THR 90.A OG1 PRO 86.A O no hydrogen 2.800 N/A ASP 91.A N TYR 87.A O no hydrogen 2.980 N/A ALA 92.A N ALA 88.A O no hydrogen 3.039 N/A VAL 93.A N VAL 89.A O no hydrogen 2.957 N/A LEU 94.A N THR 90.A O no hydrogen 2.995 N/A ALA 95.A N ASP 91.A O no hydrogen 2.910 N/A HIS 97.A N LEU 94.A O no hydrogen 2.825 N/A HIS 97.A ND1 SER 292.A OG no hydrogen 2.861 N/A ILE 98.A N ALA 95.A O no hydrogen 3.217 N/A GLY 99.A N HIS 286.A O no hydrogen 2.727 N/A ALA 102.A N GLN 284.A O no hydrogen 2.945 N/A ALA 106.A N THR 3.A O no hydrogen 2.996 N/A LEU 107.A N THR 3.A O no hydrogen 3.388 N/A THR 108.A N ASP 32.A O no hydrogen 2.991 N/A LEU 109.A N LEU 5.A O no hydrogen 2.752 N/A ILE 110.A N VAL 34.A O no hydrogen 2.865 N/A PHE 111.A N VAL 7.A O no hydrogen 2.780 N/A ASP 112.A N VAL 36.A O no hydrogen 2.727 N/A ARG 113.A N ILE 9.A O no hydrogen 2.767 N/A ARG 113.A NH1 GLY 11.A O no hydrogen 2.739 N/A ARG 113.A NH2 GLY 11.A O no hydrogen 3.098 N/A HIS 114.A N ASP 10.A OD2 no hydrogen 2.802 N/A ILE 116.A N HIS 114.A ND1 no hydrogen 3.004 N/A ALA 117.A N HIS 114.A O no hydrogen 2.940 N/A ALA 118.A N PRO 115.A O no hydrogen 3.138 N/A LEU 119.A N PRO 115.A O no hydrogen 3.020 N/A LEU 120.A N ILE 116.A O no hydrogen 2.936 N/A CYS 121.A N ILE 116.A O no hydrogen 2.964 N/A CYS 121.A SG ILE 116.A O no hydrogen 3.734 N/A TYR 122.A N ALA 117.A O no hydrogen 2.901 N/A TYR 122.A OH HIS 13.A ND1 no hydrogen 2.666 N/A ALA 124.A N LEU 120.A O no hydrogen 2.869 N/A ALA 125.A N CYS 121.A O no hydrogen 2.994 N/A ARG 126.A N TYR 122.A O no hydrogen 2.982 N/A ARG 126.A NH1 GLN 59.A OE1 no hydrogen 3.039 N/A TYR 127.A N PRO 123.A O no hydrogen 2.929 N/A LEU 128.A N ALA 124.A O no hydrogen 3.009 N/A MET 129.A N ARG 126.A O no hydrogen 2.979 N/A GLY 130.A N TYR 127.A O no hydrogen 2.853 N/A SER 131.A N ARG 126.A O no hydrogen 2.838 N/A SER 131.A OG GLN 59.A OE1 no hydrogen 2.731 N/A SER 131.A OG ARG 126.A O no hydrogen 3.176 N/A GLN 135.A N GLN 135.A OE1 no hydrogen 2.748 N/A ALA 136.A N THR 133.A OG1 no hydrogen 3.161 N/A VAL 137.A N THR 133.A O no hydrogen 3.251 N/A LEU 138.A N PRO 134.A O no hydrogen 3.059 N/A ALA 139.A N GLN 135.A O no hydrogen 3.031 N/A PHE 140.A N ALA 136.A O no hydrogen 3.006 N/A VAL 141.A N VAL 137.A O no hydrogen 2.926 N/A ALA 142.A N LEU 138.A O no hydrogen 2.936 N/A LEU 143.A N PHE 140.A O no hydrogen 2.989 N/A ILE 144.A N VAL 141.A O no hydrogen 3.041 N/A THR 147.A OG1 ARG 253.A O no hydrogen 2.580 N/A THR 151.A OG1 LEU 148.A O no hydrogen 2.634 N/A ASN 152.A ND2 ARG 6.A O no hydrogen 3.035 N/A ASN 152.A ND2 VAL 283.A O no hydrogen 2.849 N/A ILE 153.A N HIS 258.A O no hydrogen 2.833 N/A VAL 154.A N TYR 8.A O no hydrogen 2.779 N/A LEU 155.A N PHE 260.A O no hydrogen 2.806 N/A ALA 157.A N LEU 262.A O no hydrogen 2.876 N/A HIS 163.A N PRO 159.A O no hydrogen 3.001 N/A HIS 163.A NE2 HIS 13.A O no hydrogen 2.905 N/A ILE 164.A N GLU 160.A O no hydrogen 2.847 N/A ASP 165.A N ASP 161.A O no hydrogen 3.039 N/A ARG 166.A N ARG 162.A O no hydrogen 2.991 N/A ARG 166.A NH1 MET 15.A O no hydrogen 2.875 N/A ARG 166.A NH1 TYR 264.A O no hydrogen 2.566 N/A ARG 166.A NH2 TYR 264.A O no hydrogen 3.053 N/A ARG 166.A NH2 GLN 266.A O no hydrogen 2.883 N/A LEU 167.A N HIS 163.A O no hydrogen 2.866 N/A ALA 168.A N ILE 164.A O no hydrogen 2.971 N/A LYS 169.A N ARG 166.A O no hydrogen 3.065 N/A ARG 170.A N ARG 166.A O no hydrogen 3.195 N/A ARG 170.A N LEU 167.A O no hydrogen 3.095 N/A ARG 170.A NH1 THR 19.A OG1 no hydrogen 2.760 N/A GLN 171.A NE2 LEU 167.A O no hydrogen 2.995 N/A ARG 172.A N GLU 175.A OE1 no hydrogen 2.748 N/A ARG 172.A NE GLU 38.A OE1 no hydrogen 3.016 N/A ARG 172.A NE GLU 38.A OE2 no hydrogen 3.151 N/A ARG 172.A NH2 GLU 38.A OE1 no hydrogen 3.532 N/A ARG 172.A NH2 GLU 38.A OE2 no hydrogen 2.956 N/A GLU 175.A N ARG 172.A O no hydrogen 3.023 N/A ARG 176.A NH2 THR 57.A OG1 no hydrogen 2.979 N/A MET 181.A N ASP 178.A OD1 no hydrogen 2.951 N/A LEU 182.A N ASP 178.A O no hydrogen 2.993 N/A ALA 183.A N LEU 179.A O no hydrogen 3.096 N/A ALA 184.A N ALA 180.A O no hydrogen 2.938 N/A ILE 185.A N MET 181.A O no hydrogen 2.910 N/A ARG 186.A N LEU 182.A O no hydrogen 2.992 N/A ARG 186.A NH1 LEU 158.A O no hydrogen 2.793 N/A ARG 186.A NH1 HIS 163.A ND1 no hydrogen 2.920 N/A ARG 186.A NH2 LEU 158.A O no hydrogen 2.996 N/A ARG 187.A N ALA 183.A O no hydrogen 2.867 N/A VAL 188.A N ALA 184.A O no hydrogen 2.900 N/A TYR 189.A N ILE 185.A O no hydrogen 3.039 N/A TYR 189.A OH ASP 10.A OD1 no hydrogen 2.475 N/A GLY 190.A N ARG 186.A O no hydrogen 2.955 N/A LEU 191.A N ARG 187.A O no hydrogen 2.852 N/A LEU 192.A N VAL 188.A O no hydrogen 2.806 N/A ALA 193.A N TYR 189.A O no hydrogen 3.094 N/A ASN 194.A N GLY 190.A O no hydrogen 3.158 N/A ASN 194.A ND2 ASP 221.A O no hydrogen 3.035 N/A THR 195.A N LEU 191.A O no hydrogen 2.738 N/A THR 195.A OG1 LEU 191.A O no hydrogen 2.480 N/A VAL 196.A N LEU 192.A O no hydrogen 3.025 N/A ARG 197.A N ALA 193.A O no hydrogen 3.292 N/A ARG 197.A NH2 ASN 194.A OD1 no hydrogen 3.020 N/A TYR 198.A N ASN 194.A O no hydrogen 2.803 N/A TYR 198.A OH ASP 208.A OD2 no hydrogen 2.686 N/A LEU 199.A N THR 195.A O no hydrogen 2.895 N/A GLN 200.A N VAL 196.A O no hydrogen 2.849 N/A GLN 200.A NE2 ARG 255.A O no hydrogen 2.901 N/A GLN 200.A NE2 MET 257.A O no hydrogen 2.841 N/A CYS 201.A N ARG 197.A O no hydrogen 2.971 N/A CYS 201.A SG ARG 197.A O no hydrogen 3.445 N/A CYS 201.A SG PRO 215.A O no hydrogen 3.735 N/A GLY 202.A N LEU 199.A O no hydrogen 3.047 N/A GLY 203.A N TYR 198.A O no hydrogen 2.849 N/A TRP 205.A NE1 ASP 248.A OD1 no hydrogen 2.949 N/A ARG 206.A NE ASP 248.A OD1 no hydrogen 3.066 N/A ARG 206.A NH2 ASP 248.A OD2 no hydrogen 2.676 N/A ASP 208.A N SER 204.A O no hydrogen 3.025 N/A GLN 211.A N ASP 208.A O no hydrogen 2.981 N/A LEU 212.A N TRP 209.A O no hydrogen 3.144 N/A SER 213.A N GLY 210.A O no hydrogen 3.067 N/A ARG 216.A NE CYS 201.A O no hydrogen 3.428 N/A ARG 216.A NH2 CYS 201.A O no hydrogen 3.042 N/A GLY 220.A N HIS 218.A ND1 no hydrogen 2.896 N/A ASP 221.A N HIS 218.A O no hydrogen 2.746 N/A THR 222.A N ILE 219.A O no hydrogen 2.993 N/A THR 222.A OG1 ILE 219.A O no hydrogen 2.868 N/A LEU 223.A N THR 195.A OG1 no hydrogen 2.783 N/A PHE 224.A N THR 222.A OG1 no hydrogen 3.255 N/A THR 225.A N THR 222.A O no hydrogen 3.203 N/A LEU 226.A N LEU 223.A O no hydrogen 3.048 N/A PHE 227.A N PHE 224.A O no hydrogen 3.038 N/A ARG 228.A N THR 225.A O no hydrogen 3.426 N/A ARG 228.A NE SER 213.A OG no hydrogen 3.218 N/A GLU 231.A N GLU 231.A OE1 no hydrogen 2.855 N/A LEU 232.A N ALA 229.A O no hydrogen 2.878 N/A LEU 233.A N PRO 230.A O no hydrogen 3.153 N/A ALA 234.A N ASP 238.A O no hydrogen 2.746 N/A GLY 237.A N ALA 234.A O no hydrogen 2.865 N/A ASP 238.A N ASN 236.A OD1 no hydrogen 3.010 N/A TYR 240.A N LEU 232.A O no hydrogen 3.177 N/A PHE 243.A N TYR 240.A O no hydrogen 3.047 N/A ALA 244.A N TYR 240.A O no hydrogen 3.019 N/A TRP 245.A N ASN 241.A O no hydrogen 2.829 N/A ALA 246.A N VAL 242.A O no hydrogen 3.381 N/A LEU 247.A N PHE 243.A O no hydrogen 3.042 N/A ASP 248.A N ALA 244.A O no hydrogen 2.959 N/A VAL 249.A N TRP 245.A O no hydrogen 2.933 N/A LEU 250.A N ALA 246.A O no hydrogen 2.885 N/A ALA 251.A N LEU 247.A O no hydrogen 2.870 N/A LYS 252.A N ASP 248.A O no hydrogen 3.058 N/A ARG 253.A N VAL 249.A O no hydrogen 2.900 N/A ARG 253.A NE ILE 144.A O no hydrogen 2.847 N/A LEU 254.A N LEU 250.A O no hydrogen 3.085 N/A ARG 255.A N ALA 251.A O no hydrogen 3.202 N/A MET 257.A N LEU 254.A O no hydrogen 3.213 N/A HIS 258.A N THR 151.A O no hydrogen 2.901 N/A PHE 260.A N ILE 153.A O no hydrogen 2.876 N/A LEU 262.A N LEU 155.A O no hydrogen 2.731 N/A TYR 264.A N ALA 157.A O no hydrogen 2.814 N/A ASP 265.A N ASP 263.A OD1 no hydrogen 3.022 N/A GLN 266.A N TYR 264.A O no hydrogen 2.726 N/A GLN 266.A NE2 ASP 263.A O no hydrogen 2.796 N/A GLY 270.A N SER 267.A OG no hydrogen 3.317 N/A CYS 271.A N SER 267.A O no hydrogen 2.693 N/A CYS 271.A SG TYR 264.A O no hydrogen 3.782 N/A CYS 271.A SG GLN 266.A O no hydrogen 3.878 N/A CYS 271.A SG SER 267.A O no hydrogen 3.542 N/A ARG 272.A N PRO 268.A O no hydrogen 3.028 N/A ARG 272.A NE ASP 273.A OD1 no hydrogen 3.153 N/A ARG 272.A NH2 ASP 273.A OD1 no hydrogen 3.223 N/A ASP 273.A N ALA 269.A O no hydrogen 2.998 N/A ALA 274.A N GLY 270.A O no hydrogen 2.829 N/A LEU 275.A N CYS 271.A O no hydrogen 3.014 N/A LEU 276.A N ARG 272.A O no hydrogen 3.131 N/A GLN 277.A N ASP 273.A O no hydrogen 2.909 N/A LEU 278.A N ALA 274.A O no hydrogen 3.036 N/A THR 279.A N LEU 276.A O no hydrogen 3.261 N/A THR 279.A OG1 LEU 276.A O no hydrogen 2.275 N/A SER 280.A N GLN 277.A O no hydrogen 3.434 N/A MET 282.A N THR 279.A O no hydrogen 2.976 N/A VAL 283.A N ASN 152.A OD1 no hydrogen 2.894 N/A GLN 284.A NE2 PRO 103.A O no hydrogen 3.387 N/A THR 285.A N LEU 4.A O no hydrogen 2.964 N/A THR 285.A OG1 HIS 286.A O no hydrogen 3.004 N/A HIS 286.A N GLY 100.A O no hydrogen 2.883 N/A HIS 286.A ND1 MET 1.A O no hydrogen 2.922 N/A VAL 287.A N PRO 2.A O no hydrogen 3.099 N/A THR 288.A N HIS 97.A O no hydrogen 3.041 N/A THR 288.A OG1 PRO 96.A O no hydrogen 2.875 N/A THR 289.A N SER 292.A OG no hydrogen 3.023 N/A THR 289.A OG1 SER 292.A OG no hydrogen 2.673 N/A SER 292.A N THR 289.A O no hydrogen 3.073 N/A SER 292.A OG HIS 97.A ND1 no hydrogen 2.861 N/A SER 292.A OG THR 289.A O no hydrogen 3.250 N/A SER 292.A OG THR 289.A OG1 no hydrogen 2.673 N/A THR 295.A N GLY 291.A O no hydrogen 3.144 N/A THR 295.A OG1 GLY 291.A O no hydrogen 2.805 N/A ILE 296.A N SER 292.A O no hydrogen 2.831 N/A CYS 297.A N ILE 293.A O no hydrogen 3.119 N/A CYS 297.A SG.A ILE 293.A O no hydrogen 3.527 N/A ASP 298.A N PRO 294.A O no hydrogen 2.986 N/A LEU 299.A N THR 295.A O no hydrogen 2.933 N/A ALA 300.A N ILE 296.A O no hydrogen 2.885 N/A ARG 301.A N CYS 297.A O no hydrogen 3.038 N/A THR 302.A N ASP 298.A O no hydrogen 3.021 N/A THR 302.A OG1 ASP 298.A O no hydrogen 2.770 N/A THR 302.A OG1 ASP 298.A OD1 no hydrogen 3.338 N/A PHE 303.A N LEU 299.A O no hydrogen 2.897 N/A ALA 304.A N ALA 300.A O no hydrogen 3.017 N/A ARG 305.A N ARG 301.A O no hydrogen 2.856 N/A GLU 306.A N THR 302.A O no hydrogen 2.914 N/A MET 307.A N PHE 303.A O no hydrogen 2.695 N/A GLY 308.A N ALA 304.A O no hydrogen 2.909 N/A