Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4ij1_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLN 5.A N SER 2.A OG no hydrogen 3.145 N/A ILE 6.A N SER 2.A O no hydrogen 3.045 N/A LEU 7.A N TRP 3.A O no hydrogen 2.865 N/A GLY 8.A N PRO 4.A O no hydrogen 2.942 N/A ARG 9.A N GLN 5.A O no hydrogen 3.037 N/A ARG 9.A NE ASP 15.A O no hydrogen 2.845 N/A ARG 9.A NH2 ASP 15.A O no hydrogen 3.419 N/A LEU 10.A N ILE 6.A O no hydrogen 3.062 N/A THR 11.A N LEU 7.A O no hydrogen 2.868 N/A THR 11.A OG1 LEU 7.A O no hydrogen 3.006 N/A THR 11.A OG1 GLY 8.A O no hydrogen 3.206 N/A ASP 12.A N GLY 8.A O no hydrogen 2.947 N/A ASN 13.A N LEU 10.A O no hydrogen 2.896 N/A ARG 14.A N ARG 9.A O no hydrogen 3.089 N/A LEU 16.A N GLU 54.A OE2 no hydrogen 2.778 N/A ALA 17.A N GLN 20.A OE1 no hydrogen 2.890 N/A GLY 19.A N GLU 57.A OE2 no hydrogen 2.769 N/A GLN 20.A N ALA 17.A O no hydrogen 3.052 N/A GLN 20.A NE2 GLN 5.A OE1 no hydrogen 3.333 N/A ALA 22.A N GLU 57.A OE1 no hydrogen 2.935 N/A TRP 23.A N GLY 19.A O no hydrogen 2.871 N/A ALA 24.A N GLN 20.A O no hydrogen 2.933 N/A MET 25.A N ALA 21.A O no hydrogen 2.933 N/A ASP 26.A N ALA 22.A O no hydrogen 2.858 N/A GLN 27.A N TRP 23.A O no hydrogen 2.934 N/A ILE 28.A N ALA 24.A O no hydrogen 2.955 N/A MET 29.A N MET 25.A O no hydrogen 3.006 N/A MET 29.A N ASP 26.A O no hydrogen 3.179 N/A THR 30.A N ASP 26.A O no hydrogen 2.906 N/A THR 30.A N GLN 27.A O no hydrogen 3.318 N/A THR 30.A OG1 ASP 26.A O no hydrogen 2.839 N/A THR 30.A OG1 ASN 32.A OD1 no hydrogen 3.063 N/A ASN 32.A N GLN 27.A O no hydrogen 2.923 N/A ARG 34.A N GLN 37.A OE1 no hydrogen 2.853 N/A ILE 38.A N ARG 34.A O no hydrogen 2.951 N/A ALA 39.A N PRO 35.A O no hydrogen 2.919 N/A ALA 40.A N ALA 36.A O no hydrogen 2.896 N/A PHE 41.A N GLN 37.A O no hydrogen 2.909 N/A ALA 42.A N ILE 38.A O no hydrogen 2.970 N/A VAL 43.A N ALA 39.A O no hydrogen 2.996 N/A ALA 44.A N ALA 40.A O no hydrogen 2.871 N/A MET 45.A N PHE 41.A O no hydrogen 2.948 N/A THR 46.A N ALA 42.A O no hydrogen 3.194 N/A THR 46.A OG1 ALA 42.A O no hydrogen 2.612 N/A MET 47.A N VAL 43.A O no hydrogen 2.968 N/A LYS 48.A N ALA 44.A O no hydrogen 2.926 N/A LYS 48.A NZ ASP 15.A OD1 no hydrogen 2.709 N/A LYS 48.A NZ ALA 49.A O no hydrogen 2.781 N/A LYS 48.A NZ GLU 54.A OE1 no hydrogen 2.733 N/A LYS 48.A NZ GLU 54.A OE2 no hydrogen 3.137 N/A ALA 49.A N THR 46.A O no hydrogen 3.213 N/A THR 51.A N GLU 54.A OE1 no hydrogen 3.076 N/A GLU 54.A N THR 51.A OG1 no hydrogen 2.977 N/A VAL 55.A N THR 51.A O no hydrogen 3.017 N/A GLY 56.A N ALA 52.A O no hydrogen 2.872 N/A GLU 57.A N ASP 53.A O no hydrogen 3.034 N/A LEU 58.A N GLU 54.A O no hydrogen 3.098 N/A ALA 59.A N VAL 55.A O no hydrogen 2.903 N/A GLY 60.A N GLY 56.A O no hydrogen 2.771 N/A VAL 61.A N GLU 57.A O no hydrogen 3.031 N/A MET 62.A N LEU 58.A O no hydrogen 3.175 N/A LEU 63.A N ALA 59.A O no hydrogen 2.921 N/A SER 64.A N GLY 60.A O no hydrogen 2.904 N/A SER 64.A OG VAL 61.A O no hydrogen 2.641 N/A HIS 65.A N VAL 61.A O no hydrogen 3.123 N/A HIS 65.A N MET 62.A O no hydrogen 3.156 N/A HIS 65.A NE2 ASP 26.A OD1 no hydrogen 2.687 N/A ALA 66.A N LEU 63.A O no hydrogen 3.330 N/A HIS 67.A N PHE 148.A O no hydrogen 3.008 N/A THR 73.A OG1 PRO 70.A O no hydrogen 2.680 N/A ALA 78.A N PRO 75.A O no hydrogen 3.139 N/A VAL 79.A N PRO 104.A O no hydrogen 2.836 N/A ASP 80.A N ALA 182.A O no hydrogen 3.015 N/A VAL 82.A N LEU 184.A O no hydrogen 3.088 N/A THR 84.A N GLY 186.A O no hydrogen 2.786 N/A THR 84.A OG1 GLY 85.A O no hydrogen 2.694 N/A GLY 85.A N ASP 217.A OD2 no hydrogen 2.784 N/A THR 87.A OG1 ASP 217.A OD1 no hydrogen 2.917 N/A ASN 89.A ND2 LEU 255.A O no hydrogen 3.677 N/A SER 91.A N THR 87.A O no hydrogen 2.899 N/A SER 91.A OG THR 87.A O no hydrogen 3.093 N/A SER 91.A OG VAL 88.A O no hydrogen 3.431 N/A THR 92.A N VAL 88.A O no hydrogen 2.886 N/A THR 92.A OG1 VAL 88.A O no hydrogen 2.478 N/A MET 93.A N ASN 89.A O no hydrogen 3.244 N/A ALA 94.A N LEU 90.A O no hydrogen 2.872 N/A ALA 95.A N SER 91.A O no hydrogen 2.998 N/A ILE 96.A N THR 92.A O no hydrogen 3.201 N/A VAL 97.A N MET 93.A O no hydrogen 3.005 N/A VAL 98.A N ALA 94.A O no hydrogen 2.848 N/A ALA 99.A N ALA 95.A O no hydrogen 3.024 N/A ALA 100.A N ILE 96.A O no hydrogen 2.938 N/A ALA 101.A N VAL 97.A O no hydrogen 2.971 N/A ALA 101.A N VAL 98.A O no hydrogen 3.144 N/A GLY 102.A N ALA 99.A O no hydrogen 2.881 N/A VAL 103.A N VAL 98.A O no hydrogen 3.228 N/A VAL 105.A N GLY 139.A O no hydrogen 3.236 N/A VAL 106.A N VAL 79.A O no hydrogen 2.882 N/A LYS 107.A N GLY 141.A O no hydrogen 2.866 N/A LYS 107.A NZ VAL 81.A O no hydrogen 2.749 N/A HIS 108.A ND1 GLY 172.A O no hydrogen 2.974 N/A GLY 109.A N CYS 143.A O no hydrogen 3.139 N/A ARG 111.A N ASN 110.A OD1 no hydrogen 2.561 N/A ARG 111.A NE GLU 118.A OE1 no hydrogen 2.642 N/A ARG 111.A NH2 GLU 118.A OE2 no hydrogen 3.187 N/A ALA 112.A N ASP 115.A OD2 no hydrogen 2.874 N/A ALA 114.A N ASN 110.A O no hydrogen 3.401 N/A ALA 114.A N GLY 113.A O no hydrogen 2.236 N/A LEU 117.A N GLY 113.A O no hydrogen 3.414 N/A GLU 118.A N ALA 114.A O no hydrogen 3.030 N/A ALA 119.A N ASP 115.A O no hydrogen 2.960 N/A LEU 120.A N THR 116.A O no hydrogen 3.064 N/A LEU 120.A N LEU 117.A O no hydrogen 2.973 N/A GLY 121.A N GLU 118.A O no hydrogen 2.929 N/A VAL 122.A N LEU 117.A O no hydrogen 2.885 N/A LEU 130.A N GLY 127.A O no hydrogen 3.118 N/A VAL 131.A N GLY 127.A O no hydrogen 3.073 N/A ALA 132.A N PRO 128.A O no hydrogen 3.068 N/A ARG 133.A N ASP 129.A O no hydrogen 3.045 N/A ARG 133.A NE GLU 137.A OE2 no hydrogen 2.953 N/A ARG 133.A NH2 GLU 137.A OE2 no hydrogen 2.635 N/A SER 134.A N LEU 130.A O no hydrogen 2.824 N/A SER 134.A OG ILE 140.A O no hydrogen 2.731 N/A LEU 135.A N VAL 131.A O no hydrogen 2.897 N/A ALA 136.A N ALA 132.A O no hydrogen 3.126 N/A GLU 137.A N ARG 133.A O no hydrogen 2.858 N/A VAL 138.A N SER 134.A O no hydrogen 2.747 N/A GLY 139.A N SER 134.A O no hydrogen 3.328 N/A GLY 141.A N VAL 105.A O no hydrogen 3.011 N/A CYS 143.A N LYS 107.A O no hydrogen 2.753 N/A ALA 145.A N GLY 109.A O no hydrogen 2.877 N/A ARG 147.A N PHE 144.A O no hydrogen 2.817 N/A ARG 147.A NH1 ASP 125.A OD1 no hydrogen 3.524 N/A PHE 148.A N PHE 144.A O no hydrogen 3.253 N/A PHE 148.A N ALA 145.A O no hydrogen 3.114 N/A HIS 149.A N ALA 145.A O no hydrogen 2.842 N/A HIS 149.A NE2 THR 175.A O no hydrogen 2.774 N/A TYR 152.A N HIS 149.A O no hydrogen 2.950 N/A ARG 153.A N PRO 150.A O no hydrogen 3.184 N/A ARG 153.A NE HIS 154.A NE2 no hydrogen 3.455 N/A ALA 156.A N TYR 152.A O no hydrogen 2.962 N/A ALA 157.A N ARG 153.A O no hydrogen 3.065 N/A VAL 158.A N HIS 154.A O no hydrogen 3.048 N/A ARG 159.A N ALA 155.A O no hydrogen 2.997 N/A ARG 160.A N.A ALA 156.A O no hydrogen 3.330 N/A ARG 160.A N.A ALA 157.A O no hydrogen 3.106 N/A ARG 160.A N.B ALA 156.A O no hydrogen 3.352 N/A GLU 161.A N ALA 157.A O no hydrogen 3.068 N/A ILE 162.A N VAL 158.A O no hydrogen 3.159 N/A GLY 163.A N ARG 159.A O no hydrogen 3.269 N/A VAL 164.A N ILE 162.A O no hydrogen 2.870 N/A THR 166.A N ASN 169.A OD1 no hydrogen 2.875 N/A VAL 167.A N THR 46.A OG1 no hydrogen 2.899 N/A PHE 168.A N THR 166.A OG1 no hydrogen 3.073 N/A ASN 169.A N THR 166.A O no hydrogen 2.766 N/A LEU 170.A N VAL 167.A O no hydrogen 3.015 N/A LEU 171.A N PHE 168.A O no hydrogen 3.062 N/A THR 175.A N GLY 172.A O no hydrogen 3.060 N/A THR 175.A OG1 LEU 171.A O no hydrogen 2.669 N/A THR 175.A OG1 GLY 172.A O no hydrogen 3.402 N/A ASN 176.A ND2 ASP 80.A OD2 no hydrogen 2.806 N/A ASN 176.A ND2 VAL 106.A O no hydrogen 2.797 N/A ALA 178.A N ASN 176.A OD1 no hydrogen 3.025 N/A ARG 179.A N ASN 176.A O no hydrogen 2.840 N/A ARG 181.A NH1 ASP 76.A O no hydrogen 2.943 N/A GLY 183.A N SER 206.A O no hydrogen 3.146 N/A LEU 184.A N ASP 80.A O no hydrogen 3.091 N/A ILE 185.A N LEU 208.A O no hydrogen 2.803 N/A GLY 186.A N VAL 82.A O no hydrogen 2.603 N/A CYS 187.A N VAL 210.A O no hydrogen 2.869 N/A CYS 187.A SG PHE 189.A O no hydrogen 3.459 N/A ALA 188.A N THR 84.A OG1 no hydrogen 2.827 N/A LEU 192.A N PHE 189.A O no hydrogen 2.992 N/A ALA 193.A N PHE 189.A O no hydrogen 3.098 N/A MET 196.A N LEU 192.A O no hydrogen 2.867 N/A ALA 197.A N ALA 193.A O no hydrogen 2.924 N/A GLY 198.A N GLU 194.A O no hydrogen 3.040 N/A VAL 199.A N VAL 195.A O no hydrogen 3.142 N/A PHE 200.A N MET 196.A O no hydrogen 3.265 N/A ALA 201.A N ALA 197.A O no hydrogen 2.882 N/A ALA 202.A N GLY 198.A O no hydrogen 2.974 N/A ARG 203.A N VAL 199.A O no hydrogen 3.310 N/A ARG 203.A NH1 LEU 174.A O no hydrogen 3.208 N/A ARG 203.A NH2 LEU 174.A O no hydrogen 3.201 N/A ARG 204.A N ALA 201.A O no hydrogen 2.982 N/A SER 205.A N PHE 200.A O no hydrogen 3.062 N/A SER 206.A N ARG 181.A O no hydrogen 2.834 N/A SER 206.A OG ALA 292.A O no hydrogen 2.702 N/A VAL 207.A N VAL 230.A O no hydrogen 2.949 N/A LEU 208.A N GLY 183.A O no hydrogen 2.953 N/A VAL 209.A N TRP 228.A O no hydrogen 2.983 N/A VAL 210.A N ILE 185.A O no hydrogen 2.723 N/A HIS 211.A N THR 226.A O no hydrogen 2.876 N/A HIS 211.A ND1 CYS 187.A O no hydrogen 2.831 N/A GLY 212.A N LEU 216.A O no hydrogen 2.809 N/A ASP 213.A N THR 224.A O no hydrogen 2.945 N/A GLY 215.A N GLY 212.A O no hydrogen 2.836 N/A LEU 216.A N ASP 214.A OD1 no hydrogen 3.245 N/A LEU 219.A N ASN 285.A OD1 no hydrogen 2.802 N/A THR 220.A N SER 225.A OG no hydrogen 3.162 N/A THR 220.A OG1 ASP 214.A OD2 no hydrogen 2.924 N/A THR 222.A N THR 220.A OG1 no hydrogen 3.042 N/A THR 222.A OG1 ASP 214.A OD2 no hydrogen 2.786 N/A THR 224.A N THR 223.A OG1 no hydrogen 2.610 N/A THR 224.A OG1 ASP 213.A OD2 no hydrogen 2.625 N/A SER 225.A N PHE 240.A O no hydrogen 2.914 N/A THR 226.A N HIS 211.A O no hydrogen 2.766 N/A THR 226.A OG1 ASP 213.A OD1 no hydrogen 2.992 N/A ILE 227.A N LEU 238.A O no hydrogen 2.735 N/A TRP 228.A N VAL 209.A O no hydrogen 2.798 N/A ARG 229.A N ASP 236.A O no hydrogen 2.762 N/A ARG 229.A NH2.A ALA 299.A O no hydrogen 2.809 N/A VAL 230.A N VAL 207.A O no hydrogen 2.833 N/A ALA 231.A N SER 234.A O no hydrogen 3.221 N/A SER 234.A N ALA 231.A O no hydrogen 3.072 N/A SER 234.A OG ALA 231.A O no hydrogen 3.137 N/A ASP 236.A N ARG 229.A O no hydrogen 2.897 N/A LEU 238.A N ILE 227.A O no hydrogen 2.748 N/A PHE 240.A N SER 225.A O no hydrogen 2.700 N/A ALA 243.A N ASP 241.A OD1 no hydrogen 2.876 N/A GLY 244.A N ASP 241.A O no hydrogen 2.941 N/A PHE 245.A N PRO 242.A O no hydrogen 2.761 N/A GLY 246.A N ALA 243.A O no hydrogen 3.063 N/A PHE 247.A N PRO 242.A O no hydrogen 3.206 N/A ARG 249.A NH1 ASP 241.A OD1 no hydrogen 2.949 N/A ARG 249.A NH2 ASP 241.A OD1 no hydrogen 3.081 N/A ARG 249.A NH2 ASP 241.A OD2 no hydrogen 3.131 N/A ALA 250.A N THR 221.A O no hydrogen 3.217 N/A GLN 251.A N GLN 254.A OE1 no hydrogen 2.886 N/A GLN 254.A N GLN 251.A O no hydrogen 3.074 N/A GLN 254.A N ASP 253.A OD1 no hydrogen 2.659 N/A LEU 255.A N LEU 252.A O no hydrogen 2.926 N/A ALA 256.A N ASP 253.A O no hydrogen 2.912 N/A ASN 263.A N ASP 259.A O no hydrogen 3.194 N/A ALA 264.A N ALA 260.A O no hydrogen 2.820 N/A ALA 265.A N GLN 261.A O no hydrogen 2.857 N/A ALA 266.A N ALA 262.A O no hydrogen 2.893 N/A VAL 267.A N ASN 263.A O no hydrogen 2.870 N/A ARG 268.A N ALA 264.A O no hydrogen 3.005 N/A ALA 269.A N ALA 265.A O no hydrogen 2.996 N/A VAL 270.A N ALA 266.A O no hydrogen 3.101 N/A LEU 271.A N VAL 267.A O no hydrogen 2.910 N/A GLY 272.A N ARG 268.A O no hydrogen 2.957 N/A GLY 272.A N ALA 269.A O no hydrogen 3.174 N/A GLY 273.A N VAL 270.A O no hydrogen 2.909 N/A ALA 274.A N ALA 269.A O no hydrogen 2.909 N/A ARG 279.A NH1 ASP 317.A OD1 no hydrogen 3.087 N/A ARG 279.A NH2 ASP 317.A OD1 no hydrogen 3.084 N/A ARG 279.A NH2 ASP 317.A OD2 no hydrogen 3.359 N/A ASP 280.A N GLY 276.A O no hydrogen 3.041 N/A ALA 281.A N PRO 277.A O no hydrogen 3.028 N/A VAL 282.A N VAL 278.A O no hydrogen 2.929 N/A VAL 283.A N ARG 279.A O no hydrogen 2.811 N/A LEU 284.A N ASP 280.A O no hydrogen 2.920 N/A ASN 285.A N ALA 281.A O no hydrogen 3.032 N/A ASN 285.A ND2 LEU 219.A O no hydrogen 3.059 N/A ASN 285.A ND2 ALA 281.A O no hydrogen 2.754 N/A ALA 286.A N VAL 282.A O no hydrogen 2.867 N/A ALA 287.A N VAL 283.A O no hydrogen 2.942 N/A GLY 288.A N LEU 284.A O no hydrogen 3.081 N/A ALA 289.A N ASN 285.A O no hydrogen 3.070 N/A ILE 290.A N ALA 286.A O no hydrogen 2.942 N/A VAL 291.A N ALA 287.A O no hydrogen 2.704 N/A ALA 292.A N GLY 288.A O no hydrogen 2.933 N/A HIS 293.A N ALA 289.A O no hydrogen 2.895 N/A HIS 293.A NE2 ASP 77.A OD2 no hydrogen 2.637 N/A ALA 294.A N ILE 290.A O no hydrogen 2.897 N/A GLY 295.A N VAL 291.A O no hydrogen 3.129 N/A GLY 295.A N ALA 292.A O no hydrogen 3.074 N/A LEU 296.A N HIS 293.A O no hydrogen 3.127 N/A SER 297.A N ALA 294.A O no hydrogen 3.261 N/A ALA 304.A N GLU 300.A O no hydrogen 2.877 N/A TRP 305.A N TRP 301.A O no hydrogen 2.968 N/A GLU 306.A N LEU 302.A O no hydrogen 2.923 N/A GLU 307.A N PRO 303.A O no hydrogen 2.799 N/A GLY 308.A N ALA 304.A O no hydrogen 2.852 N/A LEU 309.A N TRP 305.A O no hydrogen 2.756 N/A ARG 310.A N GLU 306.A O no hydrogen 3.117 N/A ARG 311.A N GLU 307.A O no hydrogen 2.926 N/A ARG 311.A NH2 ALA 101.A O no hydrogen 3.040 N/A ALA 312.A N GLY 308.A O no hydrogen 2.934 N/A SER 313.A N LEU 309.A O no hydrogen 3.017 N/A SER 313.A OG LEU 309.A O no hydrogen 3.044 N/A ALA 314.A N ARG 310.A O no hydrogen 2.931 N/A ALA 315.A N ARG 311.A O no hydrogen 2.956 N/A ILE 316.A N ALA 312.A O no hydrogen 3.295 N/A ASP 317.A N SER 313.A O no hydrogen 2.804 N/A THR 318.A N ALA 314.A O no hydrogen 2.862 N/A THR 318.A OG1 ALA 314.A O no hydrogen 2.770 N/A GLY 319.A N ILE 316.A O no hydrogen 2.960 N/A ALA 320.A N THR 318.A OG1 no hydrogen 3.275 N/A ALA 321.A N ALA 315.A O no hydrogen 2.889 N/A GLN 323.A N GLY 319.A O no hydrogen 2.894 N/A LEU 324.A N ALA 320.A O no hydrogen 2.861 N/A LEU 325.A N ALA 321.A O no hydrogen 3.162 N/A ALA 326.A N GLU 322.A O no hydrogen 3.223 N/A ARG 327.A N GLN 323.A O no hydrogen 2.896 N/A TRP 328.A N LEU 324.A O no hydrogen 2.835 N/A VAL 329.A N LEU 325.A O no hydrogen 2.954 N/A ARG 330.A N ALA 326.A O no hydrogen 2.957 N/A PHE 331.A N ARG 327.A O no hydrogen 2.917 N/A GLY 332.A N TRP 328.A O no hydrogen 3.280 N/A ARG 333.A N VAL 329.A O no hydrogen 3.156 N/A GLN 334.A N ARG 330.A O no hydrogen 3.182 N/A GLN 334.A N PHE 331.A O no hydrogen 3.300 N/A