Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 6pel_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): THR 3.A OG1 GLY 2.A O no hydrogen 2.903 N/A THR 3.A OG1 PHE 12.A O no hydrogen 2.547 N/A VAL 10.A N THR 3.A O no hydrogen 2.997 N/A PHE 12.A N VAL 10.A O no hydrogen 2.565 N/A GLY 17.A N ASN 14.A O no hydrogen 2.982 N/A VAL 19.A N ASN 14.A OD1 no hydrogen 3.410 N/A ARG 20.A N TYR 29.A OH no hydrogen 2.908 N/A ARG 20.A NH1 GLY 17.A O no hydrogen 2.890 N/A ARG 20.A NH1 VAL 19.A O no hydrogen 2.853 N/A ARG 20.A NH2 GLY 17.A O no hydrogen 3.213 N/A GLU 24.A N SER 21.A O no hydrogen 2.888 N/A ALA 25.A N SER 21.A O no hydrogen 3.081 N/A GLN 27.A N GLY 100.A O no hydrogen 3.180 N/A GLN 27.A NE2 ARG 20.A O no hydrogen 3.036 N/A GLN 27.A NE2 ALA 25.A O no hydrogen 2.736 N/A LEU 30.A N GLN 27.A O no hydrogen 3.164 N/A GLU 32.A N GLN 35.A OE1 no hydrogen 2.908 N/A GLN 35.A N GLU 32.A O no hydrogen 3.209 N/A SER 37.A N PRO 33.A O no hydrogen 2.937 N/A MET 38.A N TRP 34.A O no hydrogen 2.899 N/A LEU 39.A N GLN 35.A O no hydrogen 2.924 N/A ALA 40.A N PHE 36.A O no hydrogen 2.982 N/A ALA 41.A N SER 37.A O no hydrogen 2.854 N/A TYR 42.A N MET 38.A O no hydrogen 2.926 N/A TYR 42.A OH THR 296.A OG1 no hydrogen 2.513 N/A MET 43.A N LEU 39.A O no hydrogen 3.031 N/A PHE 44.A N ALA 40.A O no hydrogen 2.896 N/A LEU 45.A N ALA 41.A O no hydrogen 2.910 N/A LEU 46.A N TYR 42.A O no hydrogen 2.941 N/A ILE 47.A N MET 43.A O no hydrogen 2.968 N/A ILE 47.A N PHE 44.A O no hydrogen 3.209 N/A MET 48.A N PHE 44.A O no hydrogen 2.877 N/A LEU 49.A N LEU 45.A O no hydrogen 2.920 N/A GLY 50.A N LEU 46.A O no hydrogen 2.888 N/A PHE 51.A N ILE 47.A O no hydrogen 2.952 N/A ASN 54.A ND2 GLY 50.A O no hydrogen 2.707 N/A ASN 54.A ND2 ALA 298.A O no hydrogen 2.939 N/A PHE 55.A N PHE 51.A O no hydrogen 2.901 N/A LEU 56.A N PRO 52.A O no hydrogen 2.872 N/A THR 57.A OG1 ILE 53.A O no hydrogen 3.022 N/A TYR 59.A N PHE 55.A O no hydrogen 2.944 N/A VAL 60.A N LEU 56.A O no hydrogen 2.863 N/A THR 61.A N THR 57.A O no hydrogen 2.999 N/A THR 61.A OG1 THR 57.A O no hydrogen 2.837 N/A VAL 62.A N LEU 58.A O no hydrogen 2.974 N/A GLN 63.A N TYR 59.A O no hydrogen 2.962 N/A GLN 63.A N VAL 60.A O no hydrogen 3.059 N/A HIS 64.A N VAL 60.A O no hydrogen 2.863 N/A HIS 64.A ND1 VAL 60.A O no hydrogen 3.015 N/A LEU 67.A N HIS 64.A O no hydrogen 3.236 N/A ARG 68.A N LYS 65.A O no hydrogen 2.929 N/A ARG 68.A NH1 THR 61.A O no hydrogen 3.314 N/A ASN 72.A N THR 69.A O no hydrogen 3.039 N/A ASN 72.A ND2 LEU 67.A O no hydrogen 2.892 N/A TYR 73.A N PRO 70.A O no hydrogen 2.934 N/A LEU 76.A N ASN 72.A O no hydrogen 3.105 N/A ASN 77.A N TYR 73.A O no hydrogen 2.760 N/A ASN 77.A ND2 SER 126.A OG no hydrogen 2.378 N/A LEU 78.A N ILE 74.A O no hydrogen 2.760 N/A ALA 79.A N LEU 75.A O no hydrogen 3.030 N/A VAL 80.A N LEU 76.A O no hydrogen 2.985 N/A ALA 81.A N ASN 77.A O no hydrogen 2.785 N/A ASP 82.A N LEU 78.A O no hydrogen 2.862 N/A LEU 83.A N ALA 79.A O no hydrogen 2.958 N/A PHE 84.A N VAL 80.A O no hydrogen 2.929 N/A MET 85.A N ALA 81.A O no hydrogen 2.907 N/A VAL 86.A N LEU 83.A O no hydrogen 2.949 N/A PHE 87.A N LEU 83.A O no hydrogen 2.920 N/A GLY 88.A N PHE 84.A O no hydrogen 3.092 N/A PHE 90.A N MET 85.A O no hydrogen 3.178 N/A THR 91.A N VAL 86.A O no hydrogen 3.002 N/A THR 91.A OG1 PHE 87.A O no hydrogen 3.243 N/A THR 93.A N GLY 89.A O no hydrogen 2.951 N/A THR 93.A OG1 GLY 89.A O no hydrogen 3.139 N/A LEU 94.A N PHE 90.A O no hydrogen 2.941 N/A TYR 95.A N THR 91.A O no hydrogen 2.994 N/A THR 96.A N THR 92.A O no hydrogen 2.873 N/A THR 96.A OG1 THR 92.A O no hydrogen 3.325 N/A THR 96.A OG1 THR 93.A O no hydrogen 3.446 N/A THR 96.A OG1 CYS 184.A O no hydrogen 2.627 N/A SER 97.A N THR 93.A O no hydrogen 2.869 N/A SER 97.A OG THR 93.A O no hydrogen 2.866 N/A SER 97.A OG LEU 94.A O no hydrogen 2.729 N/A LEU 98.A N LEU 94.A O no hydrogen 3.029 N/A HIS 99.A N THR 96.A O no hydrogen 2.970 N/A GLY 100.A N SER 97.A O no hydrogen 3.204 N/A PHE 102.A N PRO 22.A O no hydrogen 2.841 N/A GLY 108.A N PHE 104.A O no hydrogen 3.267 N/A CYS 109.A N GLY 105.A O no hydrogen 2.903 N/A CYS 109.A SG TYR 177.A O no hydrogen 3.809 N/A ASN 110.A N PRO 106.A O no hydrogen 2.964 N/A ASN 110.A ND2 PRO 106.A O no hydrogen 2.723 N/A LEU 111.A N THR 107.A O no hydrogen 2.928 N/A GLU 112.A N GLY 108.A O no hydrogen 2.907 N/A GLY 113.A N CYS 109.A O no hydrogen 2.934 N/A PHE 114.A N ASN 110.A O no hydrogen 2.904 N/A PHE 115.A N LEU 111.A O no hydrogen 2.911 N/A ALA 116.A N GLU 112.A O no hydrogen 2.967 N/A THR 117.A N GLY 113.A O no hydrogen 2.951 N/A THR 117.A OG1 GLY 113.A O no hydrogen 2.792 N/A LEU 118.A N PHE 114.A O no hydrogen 2.897 N/A GLY 119.A N PHE 115.A O no hydrogen 2.942 N/A GLY 120.A N ALA 116.A O no hydrogen 3.014 N/A GLU 121.A N THR 117.A O no hydrogen 2.946 N/A ILE 122.A N LEU 118.A O no hydrogen 2.868 N/A ALA 123.A N GLY 119.A O no hydrogen 2.983 N/A LEU 124.A N GLY 120.A O no hydrogen 3.012 N/A TRP 125.A N GLU 121.A O no hydrogen 2.889 N/A TRP 125.A NE1 HIS 210.A ND1 no hydrogen 3.079 N/A SER 126.A N ILE 122.A O no hydrogen 2.850 N/A SER 126.A OG ILE 122.A O no hydrogen 2.708 N/A LEU 127.A N ALA 123.A O no hydrogen 2.986 N/A VAL 128.A N LEU 124.A O no hydrogen 3.043 N/A VAL 129.A N TRP 125.A O no hydrogen 2.881 N/A LEU 130.A N SER 126.A O no hydrogen 2.871 N/A ALA 131.A N LEU 127.A O no hydrogen 3.043 N/A ILE 132.A N VAL 128.A O no hydrogen 2.942 N/A GLU 133.A N VAL 129.A O no hydrogen 2.856 N/A ARG 134.A N LEU 130.A O no hydrogen 2.971 N/A ARG 134.A NH1 TYR 222.A OH no hydrogen 3.566 N/A TYR 135.A N ALA 131.A O no hydrogen 2.943 N/A VAL 136.A N ILE 132.A O no hydrogen 2.895 N/A VAL 137.A N GLU 133.A O no hydrogen 2.854 N/A VAL 138.A N ARG 134.A O no hydrogen 2.959 N/A CYS 139.A N TYR 135.A O no hydrogen 2.876 N/A CYS 139.A SG THR 228.A OG1 no hydrogen 3.723 N/A LYS 140.A N VAL 136.A O no hydrogen 3.169 N/A GLY 148.A N HIS 151.A ND1 no hydrogen 3.168 N/A ALA 152.A N GLY 148.A O no hydrogen 3.321 N/A ILE 153.A N GLU 149.A O no hydrogen 2.954 N/A MET 154.A N ASN 150.A O no hydrogen 2.918 N/A GLY 155.A N HIS 151.A O no hydrogen 2.918 N/A VAL 156.A N ALA 152.A O no hydrogen 2.978 N/A ALA 157.A N ILE 153.A O no hydrogen 2.969 N/A PHE 158.A N MET 154.A O no hydrogen 2.866 N/A THR 159.A N GLY 155.A O no hydrogen 3.005 N/A THR 159.A OG1 VAL 156.A O no hydrogen 2.263 N/A TRP 160.A N VAL 156.A O no hydrogen 3.016 N/A TRP 160.A NE1.A ASN 77.A OD1 no hydrogen 2.886 N/A VAL 161.A N ALA 157.A O no hydrogen 2.889 N/A MET 162.A N PHE 158.A O no hydrogen 2.931 N/A ALA 163.A N THR 159.A O no hydrogen 2.933 N/A LEU 164.A N TRP 160.A O no hydrogen 2.915 N/A ALA 165.A N VAL 161.A O no hydrogen 2.882 N/A CYS 166.A N ALA 163.A O no hydrogen 2.958 N/A ALA 167.A N ALA 163.A O no hydrogen 2.921 N/A ALA 167.A N LEU 164.A O no hydrogen 3.360 N/A ALA 168.A N LEU 164.A O no hydrogen 3.085 N/A LEU 171.A N ALA 168.A O no hydrogen 2.887 N/A VAL 172.A N PRO 169.A O no hydrogen 3.014 N/A GLY 173.A N PRO 169.A O no hydrogen 2.996 N/A TRP 174.A N PRO 169.A O no hydrogen 2.983 N/A TRP 174.A NE1 SER 201.A OG no hydrogen 2.688 N/A SER 175.A N THR 197.A O no hydrogen 2.853 N/A SER 175.A OG ASP 189.A O no hydrogen 3.355 N/A ARG 176.A NE ASP 189.A OD2 no hydrogen 2.810 N/A ARG 176.A NH2 ASP 189.A OD2 no hydrogen 3.264 N/A ARG 176.A NH2 THR 192.A OG1 no hydrogen 3.170 N/A TYR 177.A OH ALA 167.A O no hydrogen 2.548 N/A ILE 178.A N GLY 187.A O no hydrogen 2.920 N/A GLU 180.A N SER 185.A O no hydrogen 2.839 N/A GLN 183.A N GLU 180.A O no hydrogen 2.644 N/A GLN 183.A NE2 TYR 9.A O no hydrogen 3.672 N/A GLN 183.A NE2 GLY 181.A O no hydrogen 2.703 N/A CYS 184.A SG THR 96.A O no hydrogen 3.875 N/A CYS 184.A SG MET 182.A O no hydrogen 3.617 N/A SER 185.A OG GLU 180.A OE2 no hydrogen 3.323 N/A CYS 186.A N GLU 112.A OE2 no hydrogen 2.608 N/A GLY 187.A N ILE 178.A O no hydrogen 2.969 N/A ASP 189.A N ARG 176.A O no hydrogen 2.883 N/A TYR 191.A N ASP 189.A OD1 no hydrogen 3.418 N/A THR 192.A N ASP 189.A OD1 no hydrogen 3.288 N/A THR 192.A OG1 ASP 189.A OD1 no hydrogen 2.870 N/A HIS 194.A ND1 THR 197.A OG1 no hydrogen 3.150 N/A GLU 195.A N GLU 195.A OE1 no hydrogen 2.945 N/A GLU 196.A N GLU 196.A OE1 no hydrogen 2.981 N/A THR 197.A N HIS 194.A O no hydrogen 3.307 N/A THR 197.A OG1 HIS 194.A ND1 no hydrogen 3.150 N/A THR 197.A OG1 HIS 194.A O no hydrogen 3.386 N/A THR 197.A OG1 ASN 199.A OD1 no hydrogen 2.650 N/A ASN 198.A N GLU 195.A O no hydrogen 3.242 N/A ASN 199.A ND2 THR 192.A O no hydrogen 3.077 N/A SER 201.A OG ASN 198.A O no hydrogen 3.266 N/A PHE 202.A N ASN 198.A O no hydrogen 3.465 N/A VAL 203.A N ASN 199.A O no hydrogen 2.875 N/A ILE 204.A N GLU 200.A O no hydrogen 2.974 N/A TYR 205.A N SER 201.A O no hydrogen 2.921 N/A TYR 205.A OH ALA 165.A O no hydrogen 2.189 N/A MET 206.A N PHE 202.A O no hydrogen 2.816 N/A PHE 207.A N VAL 203.A O no hydrogen 2.976 N/A VAL 208.A N ILE 204.A O no hydrogen 2.890 N/A VAL 209.A N TYR 205.A O no hydrogen 2.929 N/A HIS 210.A N MET 206.A O no hydrogen 2.815 N/A HIS 210.A NE2 TYR 205.A OH no hydrogen 2.799 N/A ILE 212.A N PHE 207.A O no hydrogen 2.886 N/A ILE 213.A N VAL 208.A O no hydrogen 3.080 N/A LEU 215.A N PHE 211.A O no hydrogen 3.021 N/A ILE 216.A N ILE 212.A O no hydrogen 2.900 N/A VAL 217.A N ILE 213.A O no hydrogen 2.951 N/A ILE 218.A N PRO 214.A O no hydrogen 2.907 N/A PHE 219.A N LEU 215.A O no hydrogen 2.989 N/A PHE 220.A N ILE 216.A O no hydrogen 2.865 N/A CYS 221.A N VAL 217.A O no hydrogen 2.915 N/A CYS 221.A SG VAL 217.A O no hydrogen 3.332 N/A TYR 222.A N ILE 218.A O no hydrogen 2.952 N/A GLY 223.A N PHE 219.A O no hydrogen 2.916 N/A GLN 224.A N PHE 220.A O no hydrogen 2.867 N/A LEU 225.A N CYS 221.A O no hydrogen 2.943 N/A VAL 226.A N TYR 222.A O no hydrogen 2.903 N/A PHE 227.A N GLY 223.A O no hydrogen 2.908 N/A THR 228.A N GLN 224.A O no hydrogen 2.904 N/A THR 228.A OG1 GLN 224.A O no hydrogen 3.498 N/A VAL 229.A N LEU 225.A O no hydrogen 2.935 N/A LYS 230.A N VAL 226.A O no hydrogen 2.901 N/A GLU 231.A N PHE 227.A O no hydrogen 2.883 N/A ALA 232.A N THR 228.A O no hydrogen 2.967 N/A ALA 233.A N VAL 229.A O no hydrogen 2.936 N/A ALA 234.A N LYS 230.A O no hydrogen 2.901 N/A GLN 235.A N GLU 231.A O no hydrogen 2.975 N/A GLN 236.A N ALA 233.A O no hydrogen 3.184 N/A GLN 237.A NE2 ALA 234.A O no hydrogen 3.639 N/A GLU 238.A N GLU 238.A OE1 no hydrogen 2.617 N/A SER 239.A N GLN 236.A O no hydrogen 2.986 N/A SER 239.A OG THR 242.A OG1 no hydrogen 2.839 N/A THR 242.A N SER 239.A OG no hydrogen 3.287 N/A THR 242.A OG1 SER 239.A OG no hydrogen 2.839 N/A GLN 243.A N SER 239.A O no hydrogen 3.292 N/A LYS 244.A N ALA 240.A O no hydrogen 2.925 N/A ALA 245.A N THR 241.A O no hydrogen 2.887 N/A GLU 246.A N THR 242.A O no hydrogen 2.935 N/A LYS 247.A N GLN 243.A O no hydrogen 3.020 N/A GLU 248.A N LYS 244.A O no hydrogen 2.898 N/A VAL 249.A N ALA 245.A O no hydrogen 2.885 N/A THR 250.A N GLU 246.A O no hydrogen 3.011 N/A THR 250.A OG1 GLU 246.A O no hydrogen 2.940 N/A ARG 251.A N LYS 247.A O no hydrogen 2.939 N/A ARG 251.A NH2 GLU 248.A OE1 no hydrogen 3.524 N/A MET 252.A N GLU 248.A O no hydrogen 2.908 N/A VAL 253.A N VAL 249.A O no hydrogen 2.947 N/A ILE 254.A N THR 250.A O no hydrogen 2.962 N/A ILE 255.A N ARG 251.A O no hydrogen 2.962 N/A MET 256.A N MET 252.A O no hydrogen 2.854 N/A VAL 257.A N VAL 253.A O no hydrogen 2.942 N/A ILE 258.A N ILE 254.A O no hydrogen 2.947 N/A ALA 259.A N ILE 255.A O no hydrogen 2.904 N/A PHE 260.A N MET 256.A O no hydrogen 2.948 N/A LEU 261.A N VAL 257.A O no hydrogen 2.982 N/A ILE 262.A N ILE 258.A O no hydrogen 2.858 N/A CYS 263.A N ALA 259.A O no hydrogen 2.952 N/A CYS 263.A N PHE 260.A O no hydrogen 3.148 N/A TRP 264.A N PHE 260.A O no hydrogen 2.956 N/A LEU 265.A N LEU 261.A O no hydrogen 2.872 N/A ALA 268.A N TRP 264.A O no hydrogen 3.203 N/A GLY 269.A N LEU 265.A O no hydrogen 2.852 N/A VAL 270.A N PRO 266.A O no hydrogen 2.896 N/A ALA 271.A N TYR 267.A O no hydrogen 2.967 N/A PHE 272.A N ALA 268.A O no hydrogen 2.886 N/A TYR 273.A N GLY 269.A O no hydrogen 2.901 N/A ILE 274.A N VAL 270.A O no hydrogen 2.890 N/A PHE 275.A N PHE 272.A O no hydrogen 3.164 N/A THR 276.A N TYR 273.A O no hydrogen 3.147 N/A THR 276.A OG1 PHE 272.A O no hydrogen 2.453 N/A HIS 277.A N TYR 273.A O no hydrogen 2.746 N/A MET 287.A N GLY 283.A O no hydrogen 2.828 N/A THR 288.A N ILE 285.A O no hydrogen 3.200 N/A THR 288.A OG1 PRO 284.A O no hydrogen 3.133 N/A ALA 294.A N PRO 290.A O no hydrogen 2.963 N/A LYS 295.A N ALA 291.A O no hydrogen 2.898 N/A THR 296.A N PHE 292.A O no hydrogen 2.994 N/A THR 296.A OG1 TYR 42.A OH no hydrogen 2.513 N/A THR 296.A OG1 PHE 292.A O no hydrogen 2.680 N/A SER 297.A N ALA 294.A O no hydrogen 3.204 N/A SER 297.A OG ALA 294.A O no hydrogen 2.741 N/A ALA 298.A N LYS 295.A O no hydrogen 3.291 N/A VAL 299.A N THR 296.A O no hydrogen 2.898 N/A TYR 300.A N THR 296.A O no hydrogen 3.399 N/A TYR 300.A OH PHE 293.A O no hydrogen 3.229 N/A VAL 303.A N VAL 299.A O no hydrogen 3.369 N/A ILE 304.A N TYR 300.A O no hydrogen 2.921 N/A TYR 305.A N ASN 301.A O no hydrogen 2.890 N/A ILE 306.A N PRO 302.A O no hydrogen 2.921 N/A MET 307.A N PRO 302.A O no hydrogen 2.848 N/A MET 308.A N VAL 303.A O no hydrogen 3.043 N/A ASN 309.A N ILE 306.A O no hydrogen 3.121 N/A GLN 311.A NE2 LYS 66.A O no hydrogen 3.335 N/A ARG 313.A N ASN 309.A O no hydrogen 2.831 N/A ARG 313.A NH1 MET 307.A O no hydrogen 3.568 N/A ASN 314.A N LYS 310.A O no hydrogen 2.939 N/A CYS 315.A N GLN 311.A O no hydrogen 3.004 N/A CYS 315.A SG GLN 311.A O no hydrogen 3.380 N/A MET 316.A N PHE 312.A O no hydrogen 2.881 N/A MET 316.A N ARG 313.A O no hydrogen 2.563 N/A VAL 317.A N ARG 313.A O no hydrogen 2.896 N/A THR 318.A N ASN 314.A O no hydrogen 2.926 N/A THR 318.A OG1 ASN 314.A O no hydrogen 3.264 N/A THR 319.A N CYS 315.A O no hydrogen 2.933 N/A THR 319.A OG1 CYS 315.A O no hydrogen 3.243 N/A LEU 320.A N MET 316.A O no hydrogen 2.845 N/A CYS 321.A N VAL 317.A O no hydrogen 3.268 N/A CYS 322.A N THR 319.A O no hydrogen 2.915 N/A CYS 322.A SG LEU 320.A O no hydrogen 3.985 N/A GLY 323.A N THR 318.A O no hydrogen 3.192 N/A