Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1jce_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ILE 3.A N ARG 90.A O no hydrogen 3.206 N/A GLY 4.A N PHE 15.A O no hydrogen 2.734 N/A ILE 5.A N VAL 92.A O no hydrogen 2.841 N/A ASP 6.A N LEU 13.A O no hydrogen 2.836 N/A THR 12.A N GLU 25.A O no hydrogen 2.796 N/A THR 12.A OG1 SER 27.A OG no hydrogen 2.705 N/A LEU 13.A N ASP 6.A O no hydrogen 2.961 N/A VAL 14.A N VAL 23.A O no hydrogen 2.880 N/A PHE 15.A N GLY 4.A O no hydrogen 2.793 N/A LEU 16.A N GLY 20.A O no hydrogen 2.752 N/A ARG 17.A N ASP 2.A O no hydrogen 3.033 N/A LYS 19.A N LEU 16.A O no hydrogen 3.084 N/A GLY 20.A N LEU 16.A O no hydrogen 3.047 N/A VAL 22.A N VAL 14.A O no hydrogen 2.937 N/A GLU 25.A N THR 12.A O no hydrogen 3.010 N/A SER 27.A N ALA 10.A O no hydrogen 2.794 N/A SER 27.A OG GLY 8.A O no hydrogen 2.650 N/A SER 27.A OG THR 12.A OG1 no hydrogen 2.705 N/A ILE 29.A N ILE 58.A O no hydrogen 2.917 N/A ALA 30.A N LYS 40.A O no hydrogen 2.834 N/A ILE 31.A N LYS 56.A O no hydrogen 2.988 N/A ASP 32.A N GLU 37.A O no hydrogen 2.865 N/A SER 33.A N THR 54.A O no hydrogen 3.044 N/A SER 33.A OG ALA 53.A O no hydrogen 2.695 N/A THR 34.A N ASP 32.A OD2 no hydrogen 2.792 N/A THR 35.A N ASP 32.A OD2 no hydrogen 3.046 N/A GLY 36.A N ASP 32.A O no hydrogen 2.862 N/A GLU 37.A N THR 35.A OG1 no hydrogen 3.270 N/A LEU 39.A N ALA 30.A O no hydrogen 2.731 N/A LYS 40.A N ALA 30.A O no hydrogen 3.384 N/A LYS 40.A NZ GLU 44.A OE1 no hydrogen 3.312 N/A LYS 40.A NZ GLU 44.A OE2 no hydrogen 3.504 N/A GLY 42.A N VAL 28.A O no hydrogen 2.945 N/A LEU 43.A N GLU 25.A OE2 no hydrogen 2.945 N/A ALA 45.A N GLY 42.A O no hydrogen 3.008 N/A LYS 46.A N GLY 42.A O no hydrogen 2.946 N/A LYS 46.A NZ GLU 194.A OE1 no hydrogen 3.539 N/A LYS 46.A NZ GLU 194.A OE2 no hydrogen 2.928 N/A ASN 47.A N LEU 43.A O no hydrogen 2.849 N/A THR 51.A OG1 ILE 55.A O no hydrogen 3.466 N/A ILE 55.A N PRO 52.A O no hydrogen 3.166 N/A LYS 56.A N ILE 31.A O no hydrogen 3.026 N/A ILE 58.A N ILE 29.A O no hydrogen 2.713 N/A ARG 59.A NE THR 9.A O no hydrogen 3.450 N/A ARG 59.A NH1 THR 9.A O no hydrogen 2.931 N/A ARG 59.A NH1 ASP 171.A OD1 no hydrogen 2.914 N/A ARG 59.A NH2 GLU 190.A OE2 no hydrogen 2.945 N/A VAL 64.A N ARG 61.A O no hydrogen 2.972 N/A ALA 66.A N PRO 60.A O no hydrogen 2.889 N/A ASP 67.A N PRO 60.A O no hydrogen 3.336 N/A TYR 68.A OH GLU 113.A OE2 no hydrogen 2.690 N/A ALA 71.A N ASP 67.A O no hydrogen 2.943 N/A LEU 72.A N TYR 68.A O no hydrogen 2.789 N/A VAL 73.A N THR 69.A O no hydrogen 3.031 N/A ARG 75.A N LEU 72.A O no hydrogen 3.027 N/A ARG 75.A NH1 GLU 113.A O no hydrogen 2.630 N/A TYR 76.A N VAL 73.A O no hydrogen 3.005 N/A ILE 78.A N LEU 74.A O no hydrogen 2.922 N/A ASN 79.A N ARG 75.A O no hydrogen 2.836 N/A LYS 80.A N TYR 76.A O no hydrogen 2.901 N/A LYS 80.A NZ GLU 25.A OE1 no hydrogen 3.419 N/A ALA 81.A N PHE 77.A O no hydrogen 2.812 N/A LYS 82.A N ILE 78.A O no hydrogen 2.910 N/A LYS 82.A NZ ASN 85.A O no hydrogen 3.507 N/A LYS 82.A NZ ASN 85.A OD1 no hydrogen 2.885 N/A LYS 82.A NZ PHE 87.A O no hydrogen 3.071 N/A GLY 83.A N LYS 80.A O no hydrogen 2.987 N/A GLY 84.A N ASN 79.A O no hydrogen 2.950 N/A PHE 87.A N ASN 85.A OD1 no hydrogen 2.794 N/A ARG 90.A N LYS 1.A O no hydrogen 3.376 N/A ARG 90.A NH2 ASP 2.A OD1 no hydrogen 2.615 N/A VAL 91.A N LYS 118.A O no hydrogen 2.826 N/A VAL 92.A N ILE 3.A O no hydrogen 3.266 N/A ILE 93.A N PHE 120.A O no hydrogen 2.729 N/A GLY 94.A N ILE 5.A O no hydrogen 3.113 N/A VAL 95.A N ILE 122.A O no hydrogen 2.942 N/A ILE 97.A N GLU 151.A OE1 no hydrogen 2.629 N/A GLY 98.A N SER 165.A OG no hydrogen 3.318 N/A THR 100.A N GLU 103.A OE2 no hydrogen 2.942 N/A GLU 103.A N THR 100.A OG1 no hydrogen 3.069 N/A ARG 104.A N THR 100.A O no hydrogen 2.846 N/A ARG 105.A N ASP 101.A O no hydrogen 2.851 N/A ALA 106.A N VAL 102.A O no hydrogen 2.949 N/A ILE 107.A N GLU 103.A O no hydrogen 3.250 N/A LEU 108.A N ARG 104.A O no hydrogen 3.321 N/A ASP 109.A N ARG 105.A O no hydrogen 2.943 N/A ALA 110.A N ALA 106.A O no hydrogen 2.825 N/A GLY 111.A N ILE 107.A O no hydrogen 2.957 N/A LEU 112.A N LEU 108.A O no hydrogen 3.156 N/A GLU 113.A N ASP 109.A O no hydrogen 2.760 N/A ALA 114.A N ALA 110.A O no hydrogen 2.715 N/A GLY 115.A N LEU 112.A O no hydrogen 3.094 N/A ALA 116.A N GLY 111.A O no hydrogen 3.057 N/A SER 117.A N PRO 89.A O no hydrogen 3.120 N/A SER 117.A OG LYS 88.A O no hydrogen 2.837 N/A SER 117.A OG PRO 89.A O no hydrogen 3.387 N/A LYS 118.A NZ ALA 324.A O no hydrogen 3.532 N/A VAL 119.A N ALA 324.A O no hydrogen 3.144 N/A PHE 120.A N VAL 91.A O no hydrogen 2.780 N/A LEU 121.A N GLN 322.A O no hydrogen 3.027 N/A ILE 122.A N ILE 93.A O no hydrogen 3.026 N/A GLU 123.A N GLU 123.A OE2 no hydrogen 2.734 N/A GLU 124.A N VAL 95.A O no hydrogen 2.794 N/A ALA 127.A N GLU 124.A O no hydrogen 2.948 N/A ALA 128.A N PRO 125.A O no hydrogen 2.912 N/A GLY 130.A N ALA 126.A O no hydrogen 2.824 N/A SER 131.A N ALA 128.A O no hydrogen 3.166 N/A SER 131.A OG ALA 127.A O no hydrogen 2.946 N/A ASN 132.A N ILE 129.A O no hydrogen 3.005 N/A LEU 133.A N ALA 128.A O no hydrogen 3.034 N/A GLU 137.A N ASN 134.A O no hydrogen 3.275 N/A GLY 140.A N ASP 265.A OD1 no hydrogen 2.777 N/A ASN 141.A N ILE 155.A O no hydrogen 3.059 N/A VAL 143.A N PHE 272.A O no hydrogen 2.785 N/A ASP 144.A N GLU 151.A O no hydrogen 2.803 N/A ILE 145.A N THR 274.A O no hydrogen 2.930 N/A GLY 146.A N THR 149.A O no hydrogen 2.978 N/A THR 149.A OG1 ASP 62.A O no hydrogen 3.478 N/A THR 150.A N ILE 166.A O no hydrogen 2.939 N/A THR 150.A OG1 ILE 168.A O no hydrogen 2.750 N/A GLU 151.A N ASP 144.A O no hydrogen 2.786 N/A VAL 152.A N GLU 164.A O no hydrogen 2.980 N/A ALA 153.A N VAL 142.A O no hydrogen 2.916 N/A VAL 154.A N THR 162.A O no hydrogen 2.970 N/A ILE 155.A N ASN 141.A O no hydrogen 2.785 N/A SER 156.A N SER 159.A O no hydrogen 2.975 N/A LEU 157.A N GLU 137.A O no hydrogen 3.021 N/A GLY 158.A N VAL 135.A O no hydrogen 2.634 N/A SER 159.A N SER 156.A O no hydrogen 3.169 N/A SER 159.A OG LEU 157.A O no hydrogen 3.487 N/A VAL 161.A N VAL 154.A O no hydrogen 2.818 N/A THR 162.A OG1 THR 258.A OG1 no hydrogen 3.041 N/A GLU 164.A N VAL 152.A O no hydrogen 2.973 N/A SER 165.A OG GLU 151.A OE2 no hydrogen 2.465 N/A ILE 166.A N THR 150.A O no hydrogen 3.089 N/A ARG 167.A NH1 GLU 103.A OE1 no hydrogen 2.799 N/A ALA 169.A N GLU 172.A OE2 no hydrogen 2.760 N/A GLY 170.A N GLY 146.A O no hydrogen 3.006 N/A ASP 171.A N GLY 147.A O no hydrogen 2.752 N/A GLU 174.A N ASP 171.A O no hydrogen 3.057 N/A ALA 175.A N GLU 172.A O no hydrogen 3.005 N/A ILE 176.A N ASP 173.A O no hydrogen 3.053 N/A VAL 177.A N ASP 173.A O no hydrogen 3.047 N/A GLN 178.A N GLU 174.A O no hydrogen 2.900 N/A GLN 178.A NE2 GLU 182.A OE1 no hydrogen 2.811 N/A TYR 179.A N ALA 175.A O no hydrogen 2.953 N/A TYR 179.A OH GLU 235.A OE2 no hydrogen 2.633 N/A VAL 180.A N ILE 176.A O no hydrogen 3.006 N/A ARG 181.A N VAL 177.A O no hydrogen 3.060 N/A GLU 182.A N GLN 178.A O no hydrogen 2.933 N/A THR 183.A N TYR 179.A O no hydrogen 2.875 N/A THR 183.A OG1 TYR 179.A O no hydrogen 2.885 N/A TYR 184.A N VAL 180.A O no hydrogen 2.936 N/A TYR 184.A OH GLU 235.A OE2 no hydrogen 2.527 N/A ARG 185.A N ARG 181.A O no hydrogen 2.889 N/A ARG 185.A NE SER 222.A OG no hydrogen 3.271 N/A ALA 187.A N ILE 219.A O no hydrogen 2.871 N/A ARG 191.A NE ILE 48.A O no hydrogen 3.314 N/A ARG 191.A NH1 ILE 48.A O no hydrogen 3.019 N/A ALA 193.A N GLY 189.A O no hydrogen 3.034 N/A GLU 194.A N GLU 190.A O no hydrogen 2.922 N/A ARG 195.A N ARG 191.A O no hydrogen 3.005 N/A ARG 195.A NH1 THR 215.A O no hydrogen 2.901 N/A ARG 195.A NH2 GLU 199.A OE1 no hydrogen 2.983 N/A ARG 195.A NH2 THR 215.A O no hydrogen 3.074 N/A VAL 196.A N THR 192.A O no hydrogen 3.050 N/A LYS 197.A N ALA 193.A O no hydrogen 2.961 N/A LYS 197.A NZ ASP 173.A OD2 no hydrogen 2.802 N/A ILE 198.A N GLU 194.A O no hydrogen 2.926 N/A GLU 199.A N ARG 195.A O no hydrogen 2.788 N/A ILE 200.A N VAL 196.A O no hydrogen 2.867 N/A GLY 201.A N LYS 197.A O no hydrogen 2.994 N/A ASN 202.A ND2 PHE 204.A O no hydrogen 3.545 N/A VAL 203.A N ARG 281.A O no hydrogen 2.931 N/A ASN 209.A N SER 206.A OG no hydrogen 3.001 N/A ASN 209.A ND2 PHE 204.A O no hydrogen 2.870 N/A ASP 210.A N SER 206.A O no hydrogen 2.937 N/A GLU 211.A N LYS 207.A O no hydrogen 3.106 N/A LEU 212.A N ASN 209.A O no hydrogen 3.205 N/A THR 214.A N LEU 231.A O no hydrogen 3.201 N/A THR 214.A OG1 GLU 199.A OE1 no hydrogen 2.620 N/A VAL 216.A N LEU 229.A O no hydrogen 2.884 N/A GLY 218.A N ARG 227.A O no hydrogen 2.950 N/A ILE 219.A N ALA 187.A O no hydrogen 3.204 N/A ASP 220.A N LEU 225.A O no hydrogen 2.753 N/A LEU 221.A N ARG 185.A O no hydrogen 2.779 N/A SER 222.A N ASP 220.A OD1 no hydrogen 2.839 N/A SER 222.A OG ASP 220.A OD1 no hydrogen 2.637 N/A THR 223.A N ASP 220.A O no hydrogen 3.315 N/A THR 223.A N ASP 220.A OD1 no hydrogen 3.199 N/A GLY 224.A N ASP 220.A O no hydrogen 2.680 N/A LEU 225.A N THR 223.A OG1 no hydrogen 3.274 N/A ARG 227.A N GLY 218.A O no hydrogen 2.885 N/A ARG 227.A NH2 ASP 220.A OD2 no hydrogen 2.908 N/A LEU 229.A N VAL 216.A O no hydrogen 3.035 N/A LEU 231.A N THR 214.A O no hydrogen 2.871 N/A LYS 232.A N GLU 235.A OE1 no hydrogen 2.924 N/A GLY 233.A N LEU 212.A O no hydrogen 2.859 N/A VAL 236.A N LYS 232.A O no hydrogen 3.311 N/A ARG 237.A N GLY 233.A O no hydrogen 2.952 N/A ARG 237.A NH1 ASP 210.A OD1 no hydrogen 2.921 N/A ARG 237.A NH2 ASP 210.A OD1 no hydrogen 2.981 N/A GLU 238.A N GLY 234.A O no hydrogen 3.098 N/A ALA 239.A N GLU 235.A O no hydrogen 2.937 N/A LEU 240.A N VAL 236.A O no hydrogen 3.027 N/A ARG 241.A N GLU 238.A O no hydrogen 3.164 N/A VAL 244.A N LEU 240.A O no hydrogen 3.015 N/A VAL 245.A N ARG 241.A O no hydrogen 2.830 N/A ALA 246.A N SER 242.A O no hydrogen 3.097 N/A ILE 247.A N VAL 243.A O no hydrogen 3.058 N/A VAL 248.A N VAL 244.A O no hydrogen 2.930 N/A GLU 249.A N VAL 245.A O no hydrogen 2.960 N/A SER 250.A N ALA 246.A O no hydrogen 3.041 N/A SER 250.A OG ALA 246.A O no hydrogen 3.383 N/A VAL 251.A N ILE 247.A O no hydrogen 3.198 N/A ARG 252.A N VAL 248.A O no hydrogen 3.013 N/A ARG 252.A NH1 GLU 290.A O no hydrogen 2.502 N/A ARG 252.A NH1 GLU 290.A OE2 no hydrogen 2.949 N/A THR 253.A N GLU 249.A O no hydrogen 2.917 N/A THR 253.A OG1 GLU 249.A O no hydrogen 3.067 N/A THR 254.A N SER 250.A O no hydrogen 3.106 N/A THR 254.A OG1 SER 250.A O no hydrogen 2.826 N/A LEU 255.A N VAL 251.A O no hydrogen 3.053 N/A GLU 256.A N ARG 252.A O no hydrogen 3.032 N/A LYS 257.A N THR 253.A O no hydrogen 3.452 N/A LYS 257.A NZ TRP 163.A O no hydrogen 2.960 N/A LYS 257.A NZ GLU 164.A OE1 no hydrogen 2.753 N/A THR 258.A N LEU 255.A O no hydrogen 3.155 N/A THR 258.A OG1 THR 162.A OG1 no hydrogen 3.041 N/A THR 258.A OG1 THR 254.A O no hydrogen 2.663 N/A LEU 262.A N PRO 259.A O no hydrogen 2.837 N/A VAL 263.A N PRO 259.A O no hydrogen 2.989 N/A SER 264.A N PRO 260.A O no hydrogen 2.883 N/A ASP 265.A N GLU 261.A O no hydrogen 3.299 N/A ILE 266.A N LEU 262.A O no hydrogen 2.959 N/A ILE 267.A N VAL 263.A O no hydrogen 2.980 N/A GLU 268.A N SER 264.A O no hydrogen 3.464 N/A ARG 269.A N ASP 265.A O no hydrogen 2.760 N/A ARG 269.A NH1 LEU 133.A O no hydrogen 3.000 N/A ARG 269.A NH2 SER 139.A OG no hydrogen 3.210 N/A GLY 270.A N ILE 266.A O no hydrogen 2.685 N/A ILE 271.A N SER 294.A O no hydrogen 2.714 N/A LEU 273.A N ILE 296.A O no hydrogen 2.821 N/A THR 274.A N VAL 143.A O no hydrogen 2.873 N/A THR 274.A OG1 SER 298.A OG no hydrogen 3.023 N/A GLY 277.A N ILE 145.A O no hydrogen 2.779 N/A SER 278.A N GLY 275.A O no hydrogen 3.040 N/A SER 278.A OG GLY 275.A O no hydrogen 2.723 N/A ARG 281.A N GLY 201.A O no hydrogen 3.272 N/A ARG 281.A NH1 ILE 198.A O no hydrogen 3.382 N/A ARG 281.A NH2 ILE 198.A O no hydrogen 3.362 N/A ARG 281.A NH2 GLY 201.A O no hydrogen 3.052 N/A LEU 283.A N LEU 280.A O no hydrogen 3.192 N/A THR 285.A N ASP 284.A OD2 no hydrogen 2.573 N/A THR 285.A OG1 ASP 284.A OD2 no hydrogen 3.202 N/A LEU 286.A N GLY 282.A O no hydrogen 2.920 N/A LEU 287.A N LEU 283.A O no hydrogen 3.017 N/A GLN 288.A N ASP 284.A O no hydrogen 2.932 N/A LYS 289.A N THR 285.A O no hydrogen 3.060 N/A GLU 290.A N LEU 286.A O no hydrogen 2.910 N/A THR 291.A N LEU 287.A O no hydrogen 2.873 N/A THR 291.A OG1 LEU 287.A O no hydrogen 2.806 N/A GLY 292.A N GLN 288.A O no hydrogen 2.734 N/A ILE 293.A N THR 291.A OG1 no hydrogen 3.043 N/A ILE 296.A N ILE 271.A O no hydrogen 2.742 N/A ARG 297.A NH1 LEU 280.A O no hydrogen 2.880 N/A ARG 297.A NH2 SER 278.A O no hydrogen 2.777 N/A SER 298.A N LEU 273.A O no hydrogen 2.937 N/A SER 298.A OG THR 274.A OG1 no hydrogen 3.023 N/A THR 303.A OG1 GLU 300.A OE2 no hydrogen 3.507 N/A ALA 304.A N GLU 300.A O no hydrogen 3.180 N/A LYS 307.A N THR 303.A O no hydrogen 3.066 N/A LYS 307.A NZ GLU 300.A OE2 no hydrogen 3.102 N/A LYS 307.A NZ THR 303.A OG1 no hydrogen 2.834 N/A GLY 308.A N ALA 304.A O no hydrogen 2.898 N/A ALA 309.A N VAL 305.A O no hydrogen 2.959 N/A GLY 310.A N ALA 306.A O no hydrogen 3.213 N/A LEU 312.A N GLY 310.A O no hydrogen 3.315 N/A LYS 314.A N VAL 311.A O no hydrogen 3.106 N/A LEU 318.A N LYS 314.A O no hydrogen 2.764 N/A LYS 319.A N VAL 315.A O no hydrogen 2.835 N/A LYS 320.A N ILE 317.A O no hydrogen 3.052 N/A LEU 321.A N LEU 318.A O no hydrogen 2.838 N/A ALA 324.A N VAL 119.A O no hydrogen 3.010 N/A