Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 6l1y_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): TRP 1.A NE1 GLU 47.A OE1 no hydrogen 2.867 N/A LYS 2.A N GLU 340.A O no hydrogen 3.002 N/A ALA 4.A N VAL 338.A O no hydrogen 3.379 N/A THR 7.A N THR 6.A OG1 no hydrogen 2.625 N/A LEU 8.A N GLN 59.A OE1 no hydrogen 2.988 N/A PHE 9.A N CYS 101.A O no hydrogen 2.960 N/A CYS 10.A SG ALA 29.A O no hydrogen 3.138 N/A ALA 11.A N HIS 99.A O no hydrogen 3.009 N/A SER 12.A N VAL 31.A O no hydrogen 3.050 N/A ALA 14.A N SER 12.A OG no hydrogen 3.045 N/A LYS 15.A N ASN 23.A OD1 no hydrogen 2.871 N/A GLU 20.A N GLU 18.A OE2 no hydrogen 3.132 N/A VAL 21.A N THR 92.A O no hydrogen 2.925 N/A HIS 22.A N GLU 20.A OE1 no hydrogen 3.050 N/A HIS 22.A ND1 GLU 20.A OE1 no hydrogen 2.764 N/A ASN 23.A N GLU 20.A OE2 no hydrogen 2.794 N/A ASN 23.A ND2 GLU 20.A OE2 no hydrogen 3.119 N/A VAL 24.A N GLU 20.A O no hydrogen 2.916 N/A TRP 25.A N VAL 21.A O no hydrogen 2.988 N/A ALA 26.A N HIS 22.A O no hydrogen 2.930 N/A THR 27.A N ASN 23.A O no hydrogen 3.111 N/A THR 27.A OG1 ASN 23.A O no hydrogen 2.555 N/A THR 27.A OG1 VAL 24.A O no hydrogen 2.731 N/A ALA 29.A N TRP 25.A O no hydrogen 2.923 N/A CYS 30.A N ALA 26.A O no hydrogen 2.546 N/A VAL 31.A N CYS 10.A O no hydrogen 2.855 N/A ALA 33.A N SER 12.A O no hydrogen 2.985 N/A ASN 36.A N ASP 34.A OD1 no hydrogen 2.291 N/A MET 40.A N THR 127.A O no hydrogen 2.905 N/A LEU 42.A N VAL 125.A O no hydrogen 2.989 N/A ASN 44.A ND2 ASN 44.A O no hydrogen 2.435 N/A GLU 47.A N CYS 122.A O no hydrogen 3.171 N/A PHE 49.A N GLY 120.A O no hydrogen 3.332 N/A MET 51.A N GLY 118.A O no hydrogen 2.889 N/A TRP 52.A N ASN 50.A OD1 no hydrogen 3.069 N/A LYS 53.A N ASN 50.A O no hydrogen 2.900 N/A MET 56.A N ASN 54.A OD1 no hydrogen 3.161 N/A VAL 57.A N ASN 54.A O no hydrogen 2.922 N/A ASN 58.A ND2 ASP 55.A OD1 no hydrogen 2.463 N/A GLN 59.A N ASP 55.A O no hydrogen 3.116 N/A GLN 59.A NE2 THR 6.A O no hydrogen 3.225 N/A MET 60.A N MET 56.A O no hydrogen 3.065 N/A GLN 61.A N VAL 57.A O no hydrogen 2.958 N/A GLU 62.A N ASN 58.A O no hydrogen 2.915 N/A ASP 63.A N GLN 59.A O no hydrogen 2.944 N/A VAL 64.A N MET 60.A O no hydrogen 2.911 N/A ILE 65.A N GLN 61.A O no hydrogen 2.959 N/A SER 66.A N GLU 62.A O no hydrogen 3.119 N/A SER 66.A OG GLU 62.A O no hydrogen 2.861 N/A LEU 67.A N ASP 63.A O no hydrogen 2.732 N/A TRP 68.A N VAL 64.A O no hydrogen 2.892 N/A ASP 69.A N ILE 65.A O no hydrogen 2.818 N/A GLN 70.A N SER 66.A O no hydrogen 2.901 N/A GLN 70.A N LEU 67.A O no hydrogen 3.103 N/A SER 71.A N LEU 67.A O no hydrogen 2.866 N/A SER 71.A N TRP 68.A O no hydrogen 3.110 N/A SER 71.A OG LEU 67.A O no hydrogen 3.046 N/A LEU 72.A N TRP 68.A O no hydrogen 2.930 N/A LYS 73.A NZ ASP 69.A O no hydrogen 3.321 N/A CYS 75.A N MET 284.A O no hydrogen 2.729 N/A VAL 76.A N MET 284.A O no hydrogen 3.249 N/A LYS 77.A N ILE 84.A O no hydrogen 3.049 N/A LEU 78.A N ARG 282.A O no hydrogen 2.693 N/A THR 79.A OG1 GLU 279.A OE1 no hydrogen 3.512 N/A ILE 84.A N LYS 77.A O no hydrogen 3.202 N/A GLN 86.A N CYS 75.A O no hydrogen 3.270 N/A GLN 86.A NE2 PRO 74.A O no hydrogen 3.124 N/A LYS 90.A NZ GLU 242.A OE1 no hydrogen 3.036 N/A LYS 90.A NZ GLU 242.A OE2 no hydrogen 2.931 N/A LYS 90.A NZ ALA 286.A O no hydrogen 3.063 N/A LYS 90.A NZ PRO 287.A O no hydrogen 2.780 N/A ASP 94.A N GLU 20.A OE1 no hydrogen 2.679 N/A ILE 98.A N ILE 134.A O no hydrogen 3.023 N/A HIS 99.A N ALA 11.A O no hydrogen 2.681 N/A HIS 99.A ND1 THR 131.A O no hydrogen 2.938 N/A TYR 100.A N THR 131.A OG1 no hydrogen 2.755 N/A TYR 100.A OH ASP 63.A OD2 no hydrogen 2.743 N/A CYS 101.A N PHE 9.A O no hydrogen 2.689 N/A THR 102.A N GLN 129.A O no hydrogen 3.123 N/A THR 102.A OG1 PRO 103.A O no hydrogen 3.233 N/A TYR 106.A N PRO 103.A O no hydrogen 3.011 N/A ALA 107.A N VAL 339.A O no hydrogen 2.803 N/A ILE 108.A N VAL 128.A O no hydrogen 3.466 N/A LEU 109.A N LYS 337.A O no hydrogen 2.850 N/A LYS 110.A N SER 126.A O no hydrogen 2.905 N/A CYS 111.A N LYS 335.A O no hydrogen 2.963 N/A ASN 112.A N ASN 124.A O no hydrogen 2.732 N/A ASN 112.A ND2 ASN 124.A O no hydrogen 3.212 N/A ASN 112.A ND2 ASN 124.A OD1 no hydrogen 3.240 N/A ASN 112.A ND2 SER 126.A OG no hydrogen 2.903 N/A LYS 114.A NZ GLU 150.A OE1 no hydrogen 3.204 N/A PHE 116.A N ASP 113.A O no hydrogen 3.477 N/A THR 119.A N ASN 117.A OD1 no hydrogen 2.993 N/A THR 119.A OG1 ASN 117.A OD1 no hydrogen 3.404 N/A CYS 122.A N GLU 47.A O no hydrogen 2.521 N/A CYS 122.A SG ASP 113.A OD1 no hydrogen 3.440 N/A CYS 122.A SG ASN 124.A O no hydrogen 3.641 N/A HIS 123.A N ASP 113.A OD1 no hydrogen 2.740 N/A ASN 124.A N ASP 113.A OD2 no hydrogen 2.808 N/A SER 126.A N LYS 110.A O no hydrogen 2.972 N/A SER 126.A OG GLU 39.A OE2 no hydrogen 3.114 N/A SER 126.A OG LYS 110.A O no hydrogen 3.514 N/A THR 127.A N MET 40.A O no hydrogen 2.826 N/A VAL 128.A N ILE 108.A O no hydrogen 3.048 N/A GLN 129.A NE2 THR 102.A O no hydrogen 3.571 N/A THR 131.A N TYR 100.A O no hydrogen 2.974 N/A THR 131.A OG1 HIS 132.A O no hydrogen 2.968 N/A HIS 132.A N TYR 336.A OH no hydrogen 3.032 N/A HIS 132.A ND1 TYR 336.A OH no hydrogen 2.678 N/A HIS 132.A NE2 GLU 332.A OE1 no hydrogen 3.024 N/A ILE 134.A N ILE 98.A O no hydrogen 2.925 N/A VAL 137.A N LYS 135.A O no hydrogen 2.905 N/A SER 139.A OG LEU 142.A O no hydrogen 2.741 N/A THR 140.A N SER 236.A O no hydrogen 3.224 N/A THR 140.A OG1 GLU 231.A O no hydrogen 2.649 N/A THR 140.A OG1 THR 234.A O no hydrogen 3.129 N/A THR 140.A OG1 SER 236.A OG no hydrogen 3.240 N/A GLN 141.A N GLY 321.A O no hydrogen 2.760 N/A GLN 141.A NE2 VAL 232.A O no hydrogen 2.928 N/A GLN 141.A NE2 THR 233.A O no hydrogen 2.638 N/A LEU 142.A N THR 140.A O no hydrogen 2.683 N/A LEU 143.A N GLY 301.A O no hydrogen 2.982 N/A ASN 145.A N ASN 298.A O no hydrogen 2.712 N/A GLY 146.A N THR 300.A OG1 no hydrogen 2.951 N/A SER 147.A N GLU 332.A OE2 no hydrogen 2.911 N/A SER 147.A OG GLU 332.A OE1 no hydrogen 2.961 N/A SER 147.A OG GLU 332.A OE2 no hydrogen 3.566 N/A ALA 149.A N LEU 171.A O no hydrogen 2.600 N/A ILE 154.A N HIS 170.A O no hydrogen 3.096 N/A ARG 156.A N ILE 168.A O no hydrogen 2.701 N/A ARG 156.A NH1 PHE 116.A O no hydrogen 2.972 N/A ARG 156.A NH2 HIS 170.A ND1 no hydrogen 2.812 N/A ASN 159.A N SER 157.A OG no hydrogen 2.750 N/A THR 161.A N ASN 159.A OD1 no hydrogen 3.133 N/A THR 161.A OG1 ASN 159.A OD1 no hydrogen 2.583 N/A ASN 162.A N ASN 159.A O no hydrogen 3.086 N/A ASN 163.A ND2 ASP 307.A O no hydrogen 2.471 N/A VAL 164.A N ASN 162.A OD1 no hydrogen 3.103 N/A LYS 165.A N ASN 162.A O no hydrogen 3.048 N/A LYS 165.A NZ GLU 158.A OE2 no hydrogen 2.773 N/A ILE 167.A N LEU 304.A O no hydrogen 2.644 N/A ILE 168.A N ARG 156.A O no hydrogen 2.700 N/A VAL 169.A N LEU 302.A O no hydrogen 2.976 N/A HIS 170.A N ILE 154.A O no hydrogen 2.796 N/A HIS 170.A NE2 SER 147.A O no hydrogen 3.010 N/A LEU 171.A N THR 300.A O no hydrogen 3.072 N/A ASN 172.A ND2 GLY 151.A O no hydrogen 2.636 N/A VAL 175.A N ILE 299.A O no hydrogen 3.123 N/A ILE 177.A N SER 297.A O no hydrogen 2.902 N/A VAL 178.A N ASN 194.A O no hydrogen 3.260 N/A CYS 179.A N CYS 295.A O no hydrogen 2.932 N/A THR 180.A N HIS 192.A O no hydrogen 2.797 N/A ARG 181.A N ILE 293.A O no hydrogen 2.745 N/A ARG 181.A NH1 ILE 188.A O no hydrogen 2.613 N/A ARG 181.A NH2 ILE 289.A O no hydrogen 3.130 N/A ARG 181.A NH2 GLY 291.A O no hydrogen 2.842 N/A GLY 183.A N ASN 292.A OD1 no hydrogen 2.580 N/A ARG 189.A N ASP 187.A OD1 no hydrogen 3.081 N/A GLN 190.A N ASP 187.A O no hydrogen 2.984 N/A ALA 191.A N CYS 268.A O no hydrogen 2.842 N/A HIS 192.A N THR 180.A O no hydrogen 3.125 N/A CYS 193.A N ILE 266.A O no hydrogen 2.859 N/A ASN 194.A N VAL 178.A O no hydrogen 2.731 N/A ILE 195.A N ILE 264.A O no hydrogen 2.794 N/A GLU 197.A N SER 262.A O no hydrogen 2.696 N/A LYS 199.A N SER 196.A OG no hydrogen 3.002 N/A TRP 200.A N SER 196.A O no hydrogen 2.825 N/A TRP 200.A NE1 LEU 251.A O no hydrogen 2.768 N/A ASN 201.A N GLU 197.A O no hydrogen 2.921 N/A ASN 201.A ND2 GLU 197.A O no hydrogen 2.503 N/A GLU 202.A N ASP 198.A O no hydrogen 2.784 N/A THR 203.A N LYS 199.A O no hydrogen 3.026 N/A THR 203.A OG1 LYS 199.A O no hydrogen 3.217 N/A LEU 204.A N TRP 200.A O no hydrogen 2.833 N/A GLN 205.A N ASN 201.A O no hydrogen 2.941 N/A ARG 206.A N GLU 202.A O no hydrogen 3.210 N/A VAL 207.A N THR 203.A O no hydrogen 3.035 N/A SER 208.A N LEU 204.A O no hydrogen 2.817 N/A SER 208.A OG LEU 204.A O no hydrogen 2.651 N/A LYS 209.A N GLN 205.A O no hydrogen 3.259 N/A LYS 210.A N ARG 206.A O no hydrogen 3.045 N/A LYS 210.A NZ GLU 152.A OE2 no hydrogen 2.698 N/A LEU 211.A N VAL 207.A O no hydrogen 2.792 N/A ALA 212.A N SER 208.A O no hydrogen 2.580 N/A GLU 213.A N LYS 209.A O no hydrogen 3.105 N/A GLU 213.A N LYS 210.A O no hydrogen 2.833 N/A HIS 214.A N LEU 211.A O no hydrogen 3.241 N/A PHE 215.A N LEU 211.A O no hydrogen 3.189 N/A PHE 215.A N ALA 212.A O no hydrogen 3.173 N/A LYS 221.A N GLU 316.A O no hydrogen 3.007 N/A PHE 222.A N GLY 254.A O no hydrogen 2.940 N/A ALA 223.A N PHE 318.A O no hydrogen 3.015 N/A SER 224.A OG SER 249.A OG no hydrogen 2.804 N/A GLY 227.A N SER 225.A OG no hydrogen 3.355 N/A GLU 231.A N GLU 231.A OE1 no hydrogen 2.823 N/A VAL 232.A N ASP 229.A O no hydrogen 3.018 N/A THR 233.A N ASP 229.A O no hydrogen 2.892 N/A THR 233.A OG1 GLY 228.A O no hydrogen 3.433 N/A THR 233.A OG1 ASP 229.A O no hydrogen 3.077 N/A THR 234.A N LEU 230.A O no hydrogen 3.063 N/A THR 234.A OG1 LEU 230.A O no hydrogen 2.778 N/A HIS 235.A N CYS 246.A O no hydrogen 2.800 N/A HIS 235.A ND1 THR 140.A O no hydrogen 3.058 N/A SER 236.A N THR 140.A OG1 no hydrogen 3.242 N/A SER 236.A OG THR 140.A OG1 no hydrogen 3.240 N/A PHE 237.A N PHE 244.A O no hydrogen 3.386 N/A CYS 239.A N GLU 242.A O no hydrogen 2.712 N/A GLY 241.A N ASN 238.A OD1 no hydrogen 2.805 N/A GLU 242.A N CYS 239.A O no hydrogen 3.009 N/A PHE 244.A N PHE 237.A O no hydrogen 2.931 N/A TYR 245.A N ARG 269.A O no hydrogen 2.638 N/A TYR 245.A OH GLU 231.A OE2 no hydrogen 2.594 N/A CYS 246.A N HIS 235.A O no hydrogen 2.879 N/A ASN 247.A N PRO 267.A O no hydrogen 2.882 N/A THR 248.A OG1 GLN 141.A OE1 no hydrogen 2.539 N/A SER 249.A N ASN 247.A OD1 no hydrogen 3.093 N/A SER 249.A OG SER 224.A OG no hydrogen 2.804 N/A LEU 251.A N THR 248.A O no hydrogen 2.755 N/A PHE 252.A N THR 248.A O no hydrogen 3.167 N/A PHE 252.A N SER 249.A O no hydrogen 3.365 N/A ASN 253.A N TYR 256.A OH no hydrogen 3.220 N/A GLY 254.A N PHE 222.A O no hydrogen 3.125 N/A ILE 264.A N ILE 195.A O no hydrogen 2.564 N/A THR 265.A OG1 ASN 194.A OD1 no hydrogen 2.698 N/A ILE 266.A N CYS 193.A O no hydrogen 2.845 N/A CYS 268.A N ALA 191.A O no hydrogen 2.544 N/A CYS 268.A SG ILE 266.A O no hydrogen 3.904 N/A ARG 269.A N TYR 245.A O no hydrogen 2.714 N/A ILE 270.A N ARG 189.A O no hydrogen 2.936 N/A LYS 271.A N PHE 243.A O no hydrogen 3.063 N/A GLN 272.A NE2 TYR 285.A O no hydrogen 3.531 N/A ILE 274.A N ALA 283.A O no hydrogen 2.859 N/A ASN 275.A N GLU 231.A OE2 no hydrogen 2.888 N/A ASN 275.A ND2 GLU 231.A OE1 no hydrogen 3.283 N/A MET 276.A N GLY 281.A O no hydrogen 2.780 N/A GLN 278.A N GLN 278.A OE1 no hydrogen 2.676 N/A GLN 278.A NE2 ASP 69.A OD1 no hydrogen 3.444 N/A ARG 282.A N LEU 78.A O no hydrogen 3.098 N/A ALA 283.A N ILE 274.A O no hydrogen 2.803 N/A MET 284.A N VAL 76.A O no hydrogen 2.810 N/A TYR 285.A N GLN 272.A O no hydrogen 2.740 N/A TYR 285.A OH LEU 72.A O no hydrogen 3.419 N/A ILE 289.A N GLU 242.A OE2 no hydrogen 3.003 N/A ILE 293.A N ARG 181.A O no hydrogen 2.942 N/A CYS 295.A N CYS 179.A O no hydrogen 2.881 N/A CYS 295.A SG THR 294.A O no hydrogen 3.561 N/A SER 297.A N ILE 177.A O no hydrogen 2.749 N/A ASN 298.A N ASN 145.A OD1 no hydrogen 3.213 N/A ILE 299.A N VAL 175.A O no hydrogen 3.007 N/A THR 300.A N LEU 143.A O no hydrogen 3.092 N/A GLY 301.A N LEU 143.A O no hydrogen 3.300 N/A LEU 302.A N VAL 169.A O no hydrogen 2.976 N/A LEU 303.A N GLN 141.A O no hydrogen 2.913 N/A LEU 304.A N ILE 167.A O no hydrogen 2.916 N/A VAL 305.A N ARG 319.A O no hydrogen 2.818 N/A ARG 306.A NH1 GLU 316.A OE1 no hydrogen 3.229 N/A ARG 306.A NH2 LEU 160.A O no hydrogen 3.107 N/A ASP 307.A N THR 317.A O no hydrogen 2.982 N/A GLU 311.A N GLY 309.A O no hydrogen 2.660 N/A ASN 313.A ND2 THR 315.A OG1 no hydrogen 3.396 N/A THR 317.A OG1 ASP 307.A OD2 no hydrogen 2.581 N/A PHE 318.A N LYS 221.A O no hydrogen 2.837 N/A ARG 319.A N VAL 305.A O no hydrogen 2.917 N/A ARG 319.A NE ASP 307.A OD1 no hydrogen 2.544 N/A ARG 319.A NH1 SER 224.A O no hydrogen 3.070 N/A ARG 319.A NH2 ASP 307.A OD1 no hydrogen 3.380 N/A ARG 319.A NH2 ASP 307.A OD2 no hydrogen 2.758 N/A GLY 321.A N LEU 303.A O no hydrogen 2.645 N/A ARG 326.A N ASP 324.A OD1 no hydrogen 2.871 N/A ARG 326.A NH1 ASP 324.A OD1 no hydrogen 2.988 N/A ASN 327.A N ASP 324.A O no hydrogen 3.082 N/A ASN 328.A ND2 VAL 137.A O no hydrogen 3.525 N/A ASN 328.A ND2 SER 139.A O no hydrogen 3.097 N/A TRP 329.A N MET 325.A O no hydrogen 3.153 N/A TRP 329.A NE1 GLN 61.A OE1 no hydrogen 2.905 N/A ARG 330.A N ARG 326.A O no hydrogen 2.797 N/A ARG 330.A NH1 ASN 327.A OD1 no hydrogen 2.809 N/A SER 331.A N ASN 327.A O no hydrogen 2.994 N/A SER 331.A N ASN 328.A O no hydrogen 3.273 N/A SER 331.A OG ASN 328.A O no hydrogen 2.713 N/A GLU 332.A N TRP 329.A O no hydrogen 2.923 N/A LEU 333.A N TRP 329.A O no hydrogen 2.749 N/A TYR 336.A N LEU 333.A O no hydrogen 2.929 N/A TYR 336.A OH HIS 132.A ND1 no hydrogen 2.678 N/A LYS 337.A N LEU 109.A O no hydrogen 3.051 N/A LYS 337.A NZ GLU 47.A OE2 no hydrogen 2.390 N/A LYS 337.A NZ ASN 48.A O no hydrogen 2.839 N/A VAL 339.A N ALA 107.A O no hydrogen 2.779 N/A GLU 340.A N LYS 2.A O no hydrogen 2.817 N/A ILE 341.A N GLY 105.A O no hydrogen 2.949 N/A