Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1xe4_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): PRO 1.A N TYR 45.A O no hydrogen 2.781 N/A PRO 1.A N GLU 93.A OE2 no hydrogen 2.693 N/A LEU 3.A N ASP 43.A O no hydrogen 2.816 N/A ASN 6.A N ASN 4.A OD1 no hydrogen 3.127 N/A ASP 7.A N ASN 4.A O no hydrogen 2.947 N/A ALA 10.A N ASP 7.A OD1 no hydrogen 2.959 N/A VAL 11.A N ASP 7.A O no hydrogen 2.900 N/A GLU 12.A N PRO 8.A O no hydrogen 2.806 N/A ARG 13.A N GLN 9.A O no hydrogen 3.195 N/A ARG 13.A NH2 GLU 47.A OE1 no hydrogen 2.675 N/A TYR 14.A N ALA 10.A O no hydrogen 3.038 N/A TYR 14.A OH SER 58.A OG no hydrogen 2.637 N/A GLU 15.A N VAL 11.A O no hydrogen 2.976 N/A GLU 16.A N GLU 12.A O no hydrogen 2.925 N/A PHE 17.A N ARG 13.A O no hydrogen 3.080 N/A MET 18.A N TYR 14.A O no hydrogen 3.034 N/A ARG 19.A N GLU 15.A O no hydrogen 2.756 N/A ARG 19.A NH2 GLU 12.A OE1 no hydrogen 3.534 N/A GLN 20.A N GLU 16.A O no hydrogen 3.262 N/A GLN 20.A NE2 GLU 16.A O no hydrogen 3.063 N/A SER 21.A N MET 18.A O no hydrogen 3.412 N/A TYR 23.A N SER 21.A OG no hydrogen 3.052 N/A GLY 24.A N SER 21.A O no hydrogen 2.840 N/A GLN 25.A NE2 GLU 110.A OE1 no hydrogen 3.026 N/A THR 27.A OG1 SER 74.A O no hydrogen 2.858 N/A GLN 28.A N GLN 25.A O no hydrogen 2.926 N/A GLN 28.A NE2 THR 27.A O no hydrogen 3.452 N/A GLN 28.A NE2 SER 58.A O no hydrogen 3.127 N/A GLN 28.A NE2 SER 74.A O no hydrogen 2.964 N/A ASP 29.A N VAL 26.A O no hydrogen 3.125 N/A LEU 30.A N GLU 15.A OE2 no hydrogen 2.697 N/A GLY 31.A N ASP 29.A OD1 no hydrogen 2.617 N/A TRP 32.A N ASP 29.A O no hydrogen 3.080 N/A ALA 33.A N LEU 30.A O no hydrogen 3.270 N/A LYS 34.A N GLY 31.A O no hydrogen 3.012 N/A VAL 35.A N GLY 31.A O no hydrogen 3.276 N/A MET 36.A N TRP 32.A O no hydrogen 2.901 N/A TRP 39.A N MET 36.A O no hydrogen 2.951 N/A GLU 40.A N LEU 61.A O no hydrogen 3.046 N/A VAL 42.A N MET 59.A O no hydrogen 3.006 N/A VAL 44.A N MET 57.A O no hydrogen 3.030 N/A TYR 45.A N PRO 1.A O no hydrogen 3.063 N/A LEU 46.A N ALA 55.A O no hydrogen 2.789 N/A ASP 48.A N ALA 52.A O no hydrogen 2.873 N/A GLY 51.A N ASP 48.A O no hydrogen 3.129 N/A ALA 52.A N ASP 48.A OD2 no hydrogen 2.952 N/A ILE 54.A N LEU 46.A O no hydrogen 2.930 N/A ALA 56.A N VAL 78.A O no hydrogen 3.293 N/A MET 57.A N VAL 44.A O no hydrogen 2.950 N/A SER 58.A N GLN 28.A OE1 no hydrogen 2.829 N/A SER 58.A OG TYR 14.A OH no hydrogen 2.637 N/A SER 58.A OG GLN 28.A O no hydrogen 2.665 N/A MET 59.A N VAL 42.A O no hydrogen 2.872 N/A LEU 60.A N TYR 72.A O no hydrogen 3.036 N/A LEU 61.A N GLU 40.A O no hydrogen 2.688 N/A GLY 62.A N PHE 70.A O no hydrogen 2.876 N/A THR 64.A OG1 THR 66.A O no hydrogen 3.480 N/A THR 64.A OG1 THR 66.A OG1 no hydrogen 2.869 N/A THR 64.A OG1 LYS 68.A O no hydrogen 2.759 N/A THR 66.A N THR 64.A OG1 no hydrogen 3.061 N/A THR 66.A OG1 THR 64.A OG1 no hydrogen 2.869 N/A LYS 68.A N THR 66.A OG1 no hydrogen 3.379 N/A LYS 68.A NZ ASP 325.A OD2 no hydrogen 2.541 N/A LYS 69.A N ARG 101.A O no hydrogen 2.801 N/A LYS 69.A NZ ASP 63.A OD1 no hydrogen 2.506 N/A PHE 70.A N GLY 62.A O no hydrogen 2.868 N/A ALA 71.A N VAL 104.A O no hydrogen 3.154 N/A TYR 72.A N LEU 60.A O no hydrogen 2.942 N/A TYR 72.A OH ASP 108.A OD1 no hydrogen 2.515 N/A ALA 73.A N ARG 106.A O no hydrogen 2.812 N/A LYS 75.A N ASP 108.A OD2 no hydrogen 2.652 N/A LYS 75.A NZ GLU 110.A OE2 no hydrogen 3.028 N/A GLY 76.A N ALA 73.A O no hydrogen 3.059 N/A VAL 78.A N ALA 56.A O no hydrogen 2.827 N/A THR 82.A N ASP 80.A OD2 no hydrogen 3.169 N/A THR 82.A OG1 ASP 80.A OD1 no hydrogen 3.409 N/A THR 82.A OG1 ASP 80.A OD2 no hydrogen 2.793 N/A ASP 83.A N ASP 80.A O no hydrogen 2.946 N/A LEU 86.A N ASP 83.A OD2 no hydrogen 3.430 N/A LEU 87.A N ASP 83.A O no hydrogen 3.037 N/A ASP 88.A N VAL 84.A O no hydrogen 2.899 N/A ARG 89.A N ASP 85.A O no hydrogen 3.288 N/A LEU 90.A N LEU 86.A O no hydrogen 2.957 N/A VAL 91.A N LEU 87.A O no hydrogen 2.750 N/A ASP 92.A N ASP 88.A O no hydrogen 2.808 N/A GLU 93.A N ARG 89.A O no hydrogen 3.230 N/A ALA 94.A N LEU 90.A O no hydrogen 2.966 N/A VAL 95.A N VAL 91.A O no hydrogen 2.691 N/A LYS 96.A N ASP 92.A O no hydrogen 2.998 N/A ALA 97.A N GLU 93.A O no hydrogen 3.017 N/A LEU 98.A N ALA 94.A O no hydrogen 2.929 N/A ASP 99.A N LYS 96.A O no hydrogen 3.174 N/A ARG 101.A N LEU 98.A O no hydrogen 3.029 N/A ARG 101.A NH1 GLU 40.A OE1 no hydrogen 2.942 N/A ARG 101.A NH1 GLU 40.A OE2 no hydrogen 3.112 N/A ARG 101.A NH2 GLU 40.A OE2 no hydrogen 2.485 N/A TYR 103.A N LYS 69.A O no hydrogen 2.934 N/A LEU 105.A N LYS 322.A O no hydrogen 3.133 N/A ARG 106.A N ALA 71.A O no hydrogen 2.868 N/A ARG 106.A NE ASP 321.A OD1 no hydrogen 2.644 N/A ARG 106.A NE ASP 321.A OD2 no hydrogen 3.271 N/A ARG 106.A NH2 ASP 321.A OD2 no hydrogen 2.838 N/A PHE 107.A N ILE 320.A O no hydrogen 3.100 N/A TYR 113.A N GLU 315.A O no hydrogen 2.755 N/A TYR 113.A OH ASP 115.A OD1 no hydrogen 2.691 N/A SER 114.A OG GLU 116.A OE2 no hydrogen 3.557 N/A PHE 117.A N SER 114.A OG no hydrogen 3.006 N/A ASN 118.A N SER 114.A O no hydrogen 2.961 N/A THR 119.A N ASP 115.A O no hydrogen 2.885 N/A THR 119.A OG1 ASP 115.A O no hydrogen 2.755 N/A THR 120.A N GLU 116.A O no hydrogen 3.104 N/A THR 120.A OG1 GLU 116.A O no hydrogen 3.179 N/A THR 120.A OG1 GLU 116.A OE1 no hydrogen 3.431 N/A LEU 121.A N PHE 117.A O no hydrogen 3.048 N/A GLN 122.A N ASN 118.A O no hydrogen 3.091 N/A ASP 123.A N THR 119.A O no hydrogen 2.784 N/A HIS 124.A N THR 120.A O no hydrogen 2.888 N/A HIS 124.A N LEU 121.A O no hydrogen 3.053 N/A HIS 124.A ND1 ASP 88.A OD2 no hydrogen 2.594 N/A GLY 125.A N GLN 122.A O no hydrogen 3.057 N/A TYR 126.A N LEU 121.A O no hydrogen 3.083 N/A TYR 126.A OH ASP 88.A OD1 no hydrogen 2.639 N/A VAL 127.A N ASP 321.A O no hydrogen 2.887 N/A THR 128.A OG1 ASN 118.A OD1 no hydrogen 2.612 N/A ARG 129.A N GLU 319.A O no hydrogen 2.786 N/A ARG 129.A NH1 HIS 139.A O no hydrogen 3.205 N/A ARG 129.A NH1 ALA 140.A O no hydrogen 3.112 N/A ARG 129.A NH1 GLU 319.A OE1 no hydrogen 2.890 N/A ARG 129.A NH2 HIS 139.A O no hydrogen 2.638 N/A ARG 129.A NH2 LYS 334.A O no hydrogen 2.961 N/A ASN 130.A N ASN 132.A OD1 no hydrogen 2.785 N/A ARG 131.A NE GLU 315.A OE2 no hydrogen 2.764 N/A ARG 131.A NH2 GLU 315.A OE1 no hydrogen 3.088 N/A ARG 131.A NH2 GLU 315.A OE2 no hydrogen 3.503 N/A ASN 132.A ND2 THR 128.A O no hydrogen 3.431 N/A VAL 133.A N ASN 130.A O no hydrogen 3.055 N/A ALA 140.A N GLY 137.A O no hydrogen 2.883 N/A THR 141.A OG1 GLN 143.A O no hydrogen 2.666 N/A ILE 142.A N GLU 319.A OE2 no hydrogen 2.740 N/A ARG 145.A NH1 GLU 315.A OE2 no hydrogen 3.062 N/A ARG 145.A NH1 TYR 316.A O no hydrogen 3.047 N/A ASN 147.A N ARG 314.A O no hydrogen 2.871 N/A MET 148.A N GLY 290.A O no hydrogen 3.010 N/A LEU 150.A N TYR 287.A O no hydrogen 2.744 N/A LEU 152.A N ASP 285.A O no hydrogen 2.958 N/A THR 153.A N ASP 151.A OD1 no hydrogen 3.081 N/A THR 153.A OG1 ASP 151.A OD1 no hydrogen 2.601 N/A LYS 154.A N ASP 151.A O no hydrogen 3.169 N/A LYS 154.A NZ ASP 311.A OD2 no hydrogen 2.514 N/A PHE 155.A N LEU 152.A O no hydrogen 2.918 N/A ALA 158.A N PHE 155.A O no hydrogen 2.925 N/A LYS 159.A N ASP 163.A OD2 no hydrogen 2.925 N/A THR 160.A N ASP 163.A OD2 no hydrogen 2.899 N/A THR 160.A OG1 ASP 163.A OD2 no hydrogen 3.406 N/A THR 161.A N GLN 277.A OE1 no hydrogen 3.152 N/A THR 161.A OG1 SER 273.A O no hydrogen 2.752 N/A THR 161.A OG1 GLN 277.A OE1 no hydrogen 3.541 N/A ASP 163.A N THR 160.A O no hydrogen 2.913 N/A LEU 164.A N THR 161.A O no hydrogen 2.973 N/A TYR 165.A N LEU 162.A O no hydrogen 3.121 N/A TYR 165.A OH PHE 308.A O no hydrogen 2.687 N/A LYS 170.A N PRO 166.A O no hydrogen 2.949 N/A LYS 170.A NZ LEU 162.A O no hydrogen 2.725 N/A LYS 170.A NZ TYR 165.A O no hydrogen 2.637 N/A SER 171.A N SER 167.A O no hydrogen 3.038 N/A SER 171.A OG SER 167.A O no hydrogen 3.254 N/A LYS 172.A N LYS 168.A O no hydrogen 3.386 N/A ILE 173.A N THR 169.A O no hydrogen 3.047 N/A LYS 174.A N LYS 170.A O no hydrogen 2.932 N/A ARG 175.A N SER 171.A O no hydrogen 3.112 N/A ARG 178.A N LYS 174.A O no hydrogen 2.941 N/A ASP 179.A N ARG 175.A O no hydrogen 2.954 N/A ASP 179.A N PRO 176.A O no hydrogen 3.009 N/A GLY 180.A N PHE 177.A O no hydrogen 3.014 N/A VAL 181.A N PRO 176.A O no hydrogen 2.973 N/A GLU 182.A N GLU 234.A O no hydrogen 2.697 N/A HIS 184.A N VAL 232.A O no hydrogen 2.995 N/A HIS 184.A NE2 GLU 194.A OE1 no hydrogen 2.959 N/A GLY 186.A N ILE 230.A O no hydrogen 3.047 N/A SER 188.A N GLU 191.A OE1 no hydrogen 3.116 N/A SER 188.A OG GLU 191.A OE1 no hydrogen 3.257 N/A GLU 191.A N SER 188.A OG no hydrogen 3.334 N/A LEU 192.A N SER 188.A O no hydrogen 3.024 N/A ASP 193.A N ALA 189.A O no hydrogen 2.992 N/A GLU 194.A N THR 190.A O no hydrogen 3.145 N/A PHE 195.A N GLU 191.A O no hydrogen 2.955 N/A PHE 196.A N LEU 192.A O no hydrogen 2.715 N/A LYS 197.A N ASP 193.A O no hydrogen 2.851 N/A THR 198.A N GLU 194.A O no hydrogen 3.358 N/A THR 198.A OG1 PHE 195.A O no hydrogen 2.748 N/A THR 198.A OG1 THR 242.A OG1 no hydrogen 2.826 N/A TYR 199.A N PHE 195.A O no hydrogen 2.805 N/A THR 200.A N PHE 196.A O no hydrogen 2.965 N/A THR 200.A OG1 PHE 196.A O no hydrogen 3.022 N/A THR 200.A OG1 LYS 197.A O no hydrogen 3.213 N/A THR 201.A N LYS 197.A O no hydrogen 3.243 N/A THR 201.A OG1 LYS 197.A O no hydrogen 2.665 N/A MET 202.A N THR 198.A O no hydrogen 2.976 N/A ALA 203.A N TYR 199.A O no hydrogen 3.034 N/A GLU 204.A N THR 200.A O no hydrogen 2.889 N/A ARG 205.A N THR 201.A O no hydrogen 2.920 N/A ARG 205.A NH1 SER 259.A O no hydrogen 2.945 N/A ARG 205.A NH1 ASP 261.A OD2 no hydrogen 2.511 N/A ARG 205.A NH2 SER 259.A O no hydrogen 3.498 N/A ARG 205.A NH2 SER 259.A OG no hydrogen 2.944 N/A HIS 206.A N MET 202.A O no hydrogen 2.977 N/A GLY 207.A N GLU 204.A O no hydrogen 3.124 N/A ILE 208.A N ALA 203.A O no hydrogen 2.980 N/A ARG 211.A N TYR 199.A OH no hydrogen 2.916 N/A TYR 215.A N PRO 212.A O no hydrogen 3.003 N/A TYR 215.A OH TYR 256.A OH no hydrogen 2.401 N/A GLN 217.A N ILE 213.A O no hydrogen 2.949 N/A ARG 218.A N GLU 214.A O no hydrogen 2.961 N/A ARG 218.A NE VAL 35.A O no hydrogen 2.880 N/A ARG 218.A NH2 VAL 35.A O no hydrogen 3.073 N/A MET 219.A N TYR 215.A O no hydrogen 3.232 N/A GLN 220.A N PHE 216.A O no hydrogen 2.791 N/A ALA 221.A N GLN 217.A O no hydrogen 2.847 N/A ALA 222.A N ARG 218.A O no hydrogen 2.902 N/A ALA 222.A N MET 219.A O no hydrogen 3.145 N/A PHE 223.A N MET 219.A O no hydrogen 3.045 N/A ASP 226.A N ASP 224.A OD1 no hydrogen 2.685 N/A THR 227.A N ASP 224.A O no hydrogen 2.830 N/A THR 227.A OG1 ASP 224.A OD1 no hydrogen 3.546 N/A MET 228.A N ASP 224.A O no hydrogen 2.959 N/A ARG 229.A N ALA 245.A O no hydrogen 3.019 N/A ARG 229.A NH2 ALA 225.A O no hydrogen 2.950 N/A ILE 230.A N GLY 186.A O no hydrogen 2.702 N/A PHE 231.A N GLY 243.A O no hydrogen 2.841 N/A VAL 232.A N HIS 184.A O no hydrogen 2.803 N/A ALA 233.A N SER 241.A O no hydrogen 2.722 N/A GLU 234.A N GLU 182.A O no hydrogen 2.758 N/A ARG 235.A N LYS 238.A O no hydrogen 3.073 N/A ARG 235.A NE ASP 179.A O no hydrogen 2.837 N/A LYS 238.A N ARG 235.A O no hydrogen 2.919 N/A LEU 240.A N ALA 233.A O no hydrogen 2.916 N/A SER 241.A N ALA 233.A O no hydrogen 3.379 N/A THR 242.A N GLY 258.A O no hydrogen 2.892 N/A THR 242.A OG1 THR 198.A OG1 no hydrogen 2.826 N/A GLY 243.A N PHE 231.A O no hydrogen 2.970 N/A ILE 244.A N TYR 256.A O no hydrogen 2.785 N/A ALA 245.A N ARG 229.A O no hydrogen 2.971 N/A LEU 246.A N TRP 253.A O no hydrogen 2.948 N/A LYS 247.A N THR 227.A O no hydrogen 2.749 N/A TYR 248.A N LYS 251.A O no hydrogen 2.951 N/A TYR 248.A OH ASP 29.A OD2 no hydrogen 2.546 N/A ARG 250.A NE ASP 285.A OD2 no hydrogen 2.860 N/A LYS 251.A N TYR 248.A O no hydrogen 3.214 N/A LYS 251.A NZ GLU 110.A OE1 no hydrogen 2.646 N/A LYS 251.A NZ ASP 288.A OD1 no hydrogen 2.835 N/A ILE 252.A N LEU 286.A O no hydrogen 2.921 N/A TRP 253.A N LEU 246.A O no hydrogen 2.713 N/A TYR 254.A N ASP 288.A O no hydrogen 2.943 N/A MET 255.A N ILE 244.A O no hydrogen 2.866 N/A TYR 256.A N ILE 244.A O no hydrogen 3.397 N/A GLY 258.A N THR 242.A O no hydrogen 3.213 N/A SER 259.A N THR 198.A O no hydrogen 3.269 N/A MET 260.A N LEU 240.A O no hydrogen 2.939 N/A ALA 267.A N THR 264.A O no hydrogen 2.718 N/A TYR 269.A N TYR 266.A O no hydrogen 3.020 N/A VAL 271.A N ALA 267.A O no hydrogen 3.044 N/A GLN 272.A N PRO 268.A O no hydrogen 3.149 N/A SER 273.A N TYR 269.A O no hydrogen 2.981 N/A GLU 274.A N ALA 270.A O no hydrogen 3.081 N/A MET 275.A N VAL 271.A O no hydrogen 2.968 N/A ILE 276.A N GLN 272.A O no hydrogen 2.897 N/A GLN 277.A N SER 273.A O no hydrogen 2.971 N/A GLN 277.A NE2 LYS 159.A O no hydrogen 3.070 N/A GLN 277.A NE2 ASP 281.A OD1 no hydrogen 3.109 N/A TRP 278.A N GLU 274.A O no hydrogen 3.020 N/A ALA 279.A N MET 275.A O no hydrogen 3.135 N/A LEU 280.A N ILE 276.A O no hydrogen 2.978 N/A ASP 281.A N GLN 277.A O no hydrogen 2.772 N/A THR 282.A N TRP 278.A O no hydrogen 3.084 N/A THR 282.A OG1 TRP 278.A O no hydrogen 2.748 N/A THR 282.A OG1 ALA 279.A O no hydrogen 3.099 N/A THR 282.A OG1 THR 284.A OG1 no hydrogen 2.593 N/A ASN 283.A N LEU 280.A O no hydrogen 2.966 N/A THR 284.A N ALA 279.A O no hydrogen 2.892 N/A THR 284.A OG1 ALA 279.A O no hydrogen 3.555 N/A THR 284.A OG1 THR 282.A OG1 no hydrogen 2.593 N/A LEU 286.A N ARG 250.A O no hydrogen 2.867 N/A TYR 287.A N LEU 150.A O no hydrogen 2.962 N/A TYR 287.A OH GLN 272.A OE1 no hydrogen 2.680 N/A ASP 288.A N ILE 252.A O no hydrogen 2.869 N/A LEU 289.A N MET 148.A O no hydrogen 2.832 N/A GLY 290.A N ASP 288.A OD2 no hydrogen 3.034 N/A ILE 292.A N LEU 146.A O no hydrogen 3.148 N/A GLU 293.A N ASP 299.A OD2 no hydrogen 2.645 N/A SER 294.A N ASP 299.A OD2 no hydrogen 2.814 N/A ASP 298.A N SER 296.A OG no hydrogen 3.356 N/A ASP 299.A N SER 296.A O no hydrogen 2.781 N/A LEU 301.A N ASP 299.A OD1 no hydrogen 2.742 N/A TYR 302.A N ASP 299.A OD1 no hydrogen 3.095 N/A VAL 303.A N ASP 299.A O no hydrogen 2.797 N/A PHE 304.A N SER 300.A O no hydrogen 3.051 N/A LYS 305.A N LEU 301.A O no hydrogen 2.943 N/A LYS 305.A NZ LEU 289.A O no hydrogen 2.875 N/A LYS 305.A NZ GLY 291.A O no hydrogen 2.637 N/A HIS 306.A N TYR 302.A O no hydrogen 2.700 N/A VAL 307.A N PHE 304.A O no hydrogen 3.126 N/A PHE 308.A N LYS 305.A O no hydrogen 3.166 N/A VAL 309.A N LYS 305.A O no hydrogen 3.023 N/A LYS 310.A NZ THR 169.A OG1 no hydrogen 2.641 N/A LYS 310.A NZ VAL 307.A O no hydrogen 3.278 N/A ARG 314.A N ASN 147.A O no hydrogen 2.820 N/A TYR 316.A N ARG 145.A O no hydrogen 2.981 N/A ILE 317.A N VAL 111.A O no hydrogen 2.734 N/A GLU 319.A N ARG 129.A O no hydrogen 3.062 N/A ILE 320.A N PHE 107.A O no hydrogen 2.914 N/A ASP 321.A N VAL 127.A O no hydrogen 2.656 N/A LYS 322.A N LEU 105.A O no hydrogen 2.835 N/A LEU 324.A N TYR 103.A O no hydrogen 3.022 N/A ASP 325.A N TYR 103.A O no hydrogen 3.004 N/A VAL 328.A N ASP 325.A OD1 no hydrogen 3.176 N/A TYR 329.A N ASP 325.A O no hydrogen 2.953 N/A TYR 329.A OH ASP 321.A OD2 no hydrogen 2.849 N/A ALA 330.A N PRO 326.A O no hydrogen 3.077 N/A GLU 331.A N GLU 327.A O no hydrogen 3.131 N/A LEU 332.A N VAL 328.A O no hydrogen 2.911 N/A VAL 333.A N TYR 329.A O no hydrogen 2.657 N/A LYS 334.A NZ ALA 330.A O no hydrogen 2.672 N/A