Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4xs7_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): TYR 4.A N SER 166.A O no hydrogen 2.808 N/A VAL 5.A N ALA 172.A O no hydrogen 2.928 N/A ALA 6.A N VAL 164.A O no hydrogen 2.852 N/A GLY 7.A N VAL 164.A O no hydrogen 3.478 N/A CYS 8.A SG ASP 299.A OD1 no hydrogen 3.211 N/A GLY 9.A N ALA 162.A O no hydrogen 2.995 N/A TRP 11.A N GLY 160.A O no hydrogen 2.879 N/A VAL 16.A N VAL 40.A O no hydrogen 2.800 N/A THR 17.A N GLN 20.A OE1 no hydrogen 2.957 N/A THR 18.A N LEU 38.A O no hydrogen 2.962 N/A THR 18.A OG1 MET 37.A O no hydrogen 2.307 N/A GLU 19.A N GLU 19.A OE1 no hydrogen 2.741 N/A GLN 20.A N THR 17.A OG1 no hydrogen 3.193 N/A ALA 21.A N THR 17.A O no hydrogen 3.064 N/A LEU 22.A N THR 18.A O no hydrogen 2.763 N/A ALA 23.A N GLU 19.A O no hydrogen 2.843 N/A ALA 24.A N GLN 20.A O no hydrogen 2.928 N/A GLY 25.A N LEU 22.A O no hydrogen 2.977 N/A HIS 26.A N ALA 21.A O no hydrogen 2.873 N/A CYS 27.A SG ASP 28.A O no hydrogen 3.427 N/A LEU 31.A N ASP 28.A OD1 no hydrogen 2.780 N/A ALA 32.A N ASP 28.A O no hydrogen 2.978 N/A SER 33.A N ARG 29.A O no hydrogen 3.050 N/A SER 34.A N ARG 30.A O no hydrogen 2.959 N/A SER 34.A OG ARG 30.A O no hydrogen 3.059 N/A SER 34.A OG LEU 31.A O no hydrogen 3.297 N/A THR 35.A N LEU 31.A O no hydrogen 3.136 N/A THR 35.A OG1 LEU 31.A O no hydrogen 2.881 N/A ARG 36.A N ALA 32.A O no hydrogen 3.006 N/A MET 37.A N THR 35.A OG1 no hydrogen 3.423 N/A LEU 38.A N ARG 284.A O no hydrogen 2.761 N/A SER 39.A N ARG 284.A O no hydrogen 3.082 N/A SER 39.A OG ARG 285.A O no hydrogen 2.766 N/A VAL 40.A N VAL 16.A O no hydrogen 2.916 N/A ALA 41.A N THR 286.A O no hydrogen 2.825 N/A VAL 42.A N PRO 14.A O no hydrogen 3.102 N/A ALA 43.A N ASP 158.A OD2 no hydrogen 2.948 N/A LYS 45.A N GLU 46.A OE1 no hydrogen 3.285 N/A LYS 45.A NZ ASP 44.A OD1 no hydrogen 2.393 N/A GLU 46.A N GLU 46.A OE1 no hydrogen 2.692 N/A THR 47.A N GLU 50.A OE1 no hydrogen 3.141 N/A THR 47.A OG1 GLU 50.A OE1 no hydrogen 3.497 N/A MET 51.A N THR 47.A O no hydrogen 3.039 N/A ALA 52.A N PRO 48.A O no hydrogen 2.939 N/A ALA 53.A N ALA 49.A O no hydrogen 2.727 N/A LEU 54.A N GLU 50.A O no hydrogen 3.025 N/A ALA 55.A N MET 51.A O no hydrogen 2.976 N/A ALA 56.A N ALA 52.A O no hydrogen 2.904 N/A GLN 57.A N ALA 53.A O no hydrogen 2.993 N/A GLN 57.A NE2 VAL 95.A O no hydrogen 3.203 N/A THR 58.A N LEU 54.A O no hydrogen 3.374 N/A THR 58.A OG1 LEU 54.A O no hydrogen 3.373 N/A ALA 59.A N ALA 55.A O no hydrogen 2.854 N/A LEU 60.A N ALA 56.A O no hydrogen 2.692 N/A ASP 61.A N GLN 57.A O no hydrogen 2.878 N/A ARG 62.A N THR 58.A O no hydrogen 3.077 N/A ARG 62.A NH1 CYS 8.A O no hydrogen 2.841 N/A SER 63.A N ALA 59.A O no hydrogen 3.080 N/A SER 63.A OG LEU 60.A O no hydrogen 2.668 N/A GLY 64.A N LEU 60.A O no hydrogen 2.940 N/A GLY 64.A N ASP 61.A O no hydrogen 3.221 N/A VAL 65.A N SER 63.A OG no hydrogen 3.255 N/A HIS 69.A N ALA 66.A O no hydrogen 2.866 N/A VAL 70.A N PRO 67.A O no hydrogen 3.079 N/A ASP 71.A N ALA 131.A O no hydrogen 2.746 N/A VAL 73.A N PRO 102.A O no hydrogen 2.913 N/A LEU 74.A N LEU 133.A O no hydrogen 2.784 N/A HIS 75.A N MET 104.A O no hydrogen 2.921 N/A HIS 75.A ND1 THR 135.A OG1 no hydrogen 2.903 N/A HIS 75.A NE2 GLN 81.A OE1 no hydrogen 2.643 N/A ALA 76.A N THR 135.A O no hydrogen 2.699 N/A LEU 78.A N ASP 138.A OD2 no hydrogen 2.865 N/A TYR 79.A N ASP 138.A OD1 no hydrogen 2.980 N/A GLN 81.A NE2 TYR 79.A O no hydrogen 3.115 N/A GLN 81.A NE2 GLY 137.A O no hydrogen 3.103 N/A SER 90.A N ALA 87.A O no hydrogen 2.834 N/A TYR 91.A N ALA 87.A O no hydrogen 3.099 N/A VAL 92.A N PRO 88.A O no hydrogen 3.047 N/A GLN 93.A N SER 89.A O no hydrogen 2.989 N/A GLN 93.A NE2 ASN 99.A OD1 no hydrogen 2.951 N/A GLN 93.A NE2 CYS 101.A O no hydrogen 2.827 N/A ARG 94.A N SER 90.A O no hydrogen 2.846 N/A VAL 95.A N TYR 91.A O no hydrogen 2.935 N/A ALA 96.A N VAL 92.A O no hydrogen 2.953 N/A VAL 97.A N GLN 93.A O no hydrogen 2.943 N/A GLY 98.A N GLN 93.A O no hydrogen 2.743 N/A ASN 99.A ND2 PRO 67.A O no hydrogen 3.113 N/A CYS 101.A SG VAL 70.A O no hydrogen 3.170 N/A CYS 101.A SG PRO 102.A O no hydrogen 3.647 N/A MET 104.A N VAL 73.A O no hydrogen 2.905 N/A VAL 106.A N HIS 75.A O no hydrogen 2.992 N/A ARG 107.A NE SER 77.A OG no hydrogen 3.377 N/A ARG 107.A NH2 SER 77.A OG no hydrogen 3.158 N/A ASN 110.A ND2 GLN 108.A OE1 no hydrogen 2.716 N/A ASN 110.A ND2 SER 325.A OG no hydrogen 2.833 N/A GLY 111.A N VAL 109.A O no hydrogen 2.982 N/A GLY 112.A N GLY 291.A O no hydrogen 3.202 N/A ALA 114.A N ASN 110.A O no hydrogen 2.909 N/A ALA 115.A N GLY 111.A O no hydrogen 2.822 N/A LEU 116.A N GLY 112.A O no hydrogen 2.902 N/A GLU 117.A N MET 113.A O no hydrogen 2.901 N/A LEU 118.A N ALA 114.A O no hydrogen 3.291 N/A ALA 119.A N ALA 115.A O no hydrogen 2.797 N/A ARG 120.A N LEU 116.A O no hydrogen 2.917 N/A ARG 120.A NH2 GLU 117.A OE2 no hydrogen 2.912 N/A ARG 120.A NH2 LEU 177.A O no hydrogen 2.798 N/A ALA 121.A N GLU 117.A O no hydrogen 3.016 N/A TYR 122.A N LEU 118.A O no hydrogen 2.841 N/A LEU 123.A N ALA 119.A O no hydrogen 2.995 N/A LEU 124.A N ARG 120.A O no hydrogen 2.983 N/A ALA 125.A N TYR 122.A O no hydrogen 3.115 N/A ASP 128.A N ASP 128.A OD1 no hydrogen 2.433 N/A ARG 129.A N ALA 126.A O no hydrogen 3.360 N/A ARG 129.A NH1 TYR 122.A O no hydrogen 2.901 N/A VAL 130.A N ASP 71.A OD2 no hydrogen 2.806 N/A ALA 131.A N HIS 69.A O no hydrogen 2.964 N/A ALA 132.A N LEU 165.A O no hydrogen 2.770 N/A LEU 133.A N LEU 72.A O no hydrogen 2.834 N/A ILE 134.A N LEU 163.A O no hydrogen 2.875 N/A THR 135.A N LEU 74.A O no hydrogen 2.855 N/A THR 135.A OG1 HIS 75.A ND1 no hydrogen 2.903 N/A THR 136.A N THR 161.A O no hydrogen 2.972 N/A THR 136.A OG1 THR 161.A OG1 no hydrogen 2.481 N/A GLY 137.A N ALA 76.A O no hydrogen 3.327 N/A ASP 138.A N GLY 159.A O no hydrogen 3.156 N/A ARG 139.A NH1 ASP 44.A O no hydrogen 2.740 N/A ARG 139.A NH1 GLU 46.A O no hydrogen 3.506 N/A ARG 139.A NH2 ASP 44.A O no hydrogen 3.263 N/A MET 140.A N ASP 158.A OD1 no hydrogen 2.605 N/A HIS 141.A NE2 ALA 43.A O no hydrogen 2.860 N/A PHE 145.A N HIS 141.A O no hydrogen 3.353 N/A ASP 146.A N SER 150.A OG no hydrogen 2.758 N/A ARG 147.A NH1 TYR 156.A O no hydrogen 2.676 N/A ARG 147.A NH1 ASP 158.A OD1 no hydrogen 3.119 N/A ARG 147.A NH2 ASP 158.A OD1 no hydrogen 3.302 N/A ARG 147.A NH2 ASP 158.A OD2 no hydrogen 3.077 N/A TRP 148.A N ASP 146.A OD1 no hydrogen 3.092 N/A SER 149.A N ASP 146.A OD1 no hydrogen 2.912 N/A SER 149.A OG ASP 146.A OD1 no hydrogen 3.414 N/A SER 149.A OG ASP 146.A OD2 no hydrogen 3.340 N/A SER 150.A N ASP 146.A O no hydrogen 2.824 N/A SER 150.A OG ASP 146.A O no hydrogen 3.076 N/A SER 150.A OG VAL 206.A O no hydrogen 3.003 N/A THR 154.A N ASP 151.A O no hydrogen 3.041 N/A TYR 156.A N ARG 147.A O no hydrogen 3.083 N/A TYR 156.A OH ASP 151.A OD2 no hydrogen 2.935 N/A ALA 157.A N HIS 288.A O no hydrogen 2.851 N/A ASP 158.A N ALA 41.A O no hydrogen 3.000 N/A GLY 159.A N ASP 138.A O no hydrogen 3.129 N/A GLY 160.A N TRP 11.A O no hydrogen 3.029 N/A THR 161.A N THR 136.A O no hydrogen 3.016 N/A THR 161.A OG1 THR 136.A OG1 no hydrogen 2.481 N/A ALA 162.A N GLY 9.A O no hydrogen 2.896 N/A LEU 163.A N ILE 134.A O no hydrogen 2.705 N/A VAL 164.A N GLY 7.A O no hydrogen 2.958 N/A LEU 165.A N ALA 132.A O no hydrogen 2.934 N/A SER 166.A N TYR 4.A O no hydrogen 2.922 N/A SER 166.A OG GLY 169.A O no hydrogen 3.474 N/A ARG 167.A N VAL 130.A O no hydrogen 2.715 N/A GLN 168.A N SER 166.A OG no hydrogen 2.681 N/A GLY 169.A N SER 166.A OG no hydrogen 3.268 N/A ALA 172.A N VAL 5.A O no hydrogen 3.417 N/A ARG 173.A N GLU 330.A O no hydrogen 2.663 N/A ARG 173.A NE GLY 1.A O no hydrogen 3.178 N/A LEU 174.A N LEU 3.A O no hydrogen 2.940 N/A ARG 175.A N VAL 328.A O no hydrogen 2.775 N/A ARG 175.A NH1 GLU 330.A OE1 no hydrogen 2.638 N/A ARG 175.A NH2 ALA 243.A O no hydrogen 2.621 N/A SER 176.A N VAL 328.A O no hydrogen 3.183 N/A SER 176.A OG ALA 239.A O no hydrogen 2.762 N/A VAL 178.A N CYS 326.A O no hydrogen 3.036 N/A THR 179.A OG1 GLU 117.A OE1 no hydrogen 2.527 N/A THR 179.A OG1 SER 325.A OG no hydrogen 2.868 N/A VAL 180.A N TRP 324.A O no hydrogen 2.821 N/A GLU 182.A N PHE 322.A O no hydrogen 2.938 N/A LEU 185.A N GLU 182.A O no hydrogen 3.170 N/A GLU 186.A N PRO 183.A O no hydrogen 3.174 N/A MET 188.A N LEU 185.A O no hydrogen 2.822 N/A HIS 189.A N GLU 186.A O no hydrogen 3.339 N/A ARG 190.A N GLY 187.A O no hydrogen 3.402 N/A ARG 190.A NE GLU 186.A OE1 no hydrogen 2.777 N/A ARG 190.A NH1 GLY 191.A O no hydrogen 2.862 N/A ARG 190.A NH1 HIS 193.A O no hydrogen 3.239 N/A ARG 190.A NH2 GLU 186.A OE2 no hydrogen 2.811 N/A ARG 190.A NH2 HIS 193.A O no hydrogen 3.119 N/A PHE 195.A N HIS 193.A ND1 no hydrogen 2.985 N/A GLY 196.A N HIS 193.A O no hydrogen 2.814 N/A SER 199.A N GLY 191.A O no hydrogen 3.175 N/A VAL 206.A N GLY 144.A O no hydrogen 3.218 N/A LEU 208.A N SER 150.A O no hydrogen 2.994 N/A ALA 210.A N ASP 207.A OD1 no hydrogen 3.464 N/A LYS 212.A N LEU 208.A O no hydrogen 3.036 N/A ARG 213.A N ASP 209.A O no hydrogen 3.076 N/A ARG 213.A NH1 ASP 209.A OD2 no hydrogen 2.806 N/A ALA 214.A N ALA 210.A O no hydrogen 3.250 N/A TYR 215.A N HIS 211.A O no hydrogen 2.832 N/A TYR 215.A OH VAL 184.A O no hydrogen 2.685 N/A VAL 216.A N LYS 212.A O no hydrogen 2.838 N/A ALA 217.A N ARG 213.A O no hydrogen 2.824 N/A GLU 218.A N ALA 214.A O no hydrogen 3.258 N/A ALA 219.A N TYR 215.A O no hydrogen 2.687 N/A GLY 220.A N VAL 216.A O no hydrogen 2.664 N/A SER 224.A N GLY 220.A O no hydrogen 3.098 N/A SER 224.A OG GLY 220.A O no hydrogen 2.941 N/A VAL 225.A N SER 221.A O no hydrogen 3.016 N/A ALA 226.A N SER 222.A O no hydrogen 3.179 N/A ARG 227.A N PHE 223.A O no hydrogen 2.993 N/A ARG 227.A NH1 GLU 182.A OE1 no hydrogen 3.156 N/A VAL 228.A N SER 224.A O no hydrogen 3.023 N/A SER 229.A N VAL 225.A O no hydrogen 2.973 N/A SER 229.A OG VAL 225.A O no hydrogen 3.271 N/A ALA 230.A N ALA 226.A O no hydrogen 2.799 N/A GLY 231.A N ARG 227.A O no hydrogen 2.842 N/A GLN 232.A N VAL 228.A O no hydrogen 3.077 N/A GLN 232.A NE2 GLN 232.A O no hydrogen 3.253 N/A GLU 233.A N SER 229.A O no hydrogen 3.039 N/A GLU 234.A N ALA 230.A O no hydrogen 2.921 N/A ALA 235.A N GLY 231.A O no hydrogen 3.119 N/A LEU 236.A N GLN 232.A O no hydrogen 3.051 N/A THR 237.A N GLU 233.A O no hydrogen 2.964 N/A THR 237.A OG1 GLU 233.A O no hydrogen 3.075 N/A THR 237.A OG1 GLU 233.A OE2 no hydrogen 2.889 N/A GLY 238.A N GLU 234.A O no hydrogen 2.799 N/A ALA 239.A N ALA 235.A O no hydrogen 2.904 N/A LEU 240.A N LEU 236.A O no hydrogen 2.984 N/A GLU 241.A N THR 237.A O no hydrogen 2.971 N/A ALA 242.A N GLY 238.A O no hydrogen 2.960 N/A ALA 243.A N ALA 239.A O no hydrogen 3.210 N/A ALA 243.A N LEU 240.A O no hydrogen 3.150 N/A GLY 244.A N GLU 241.A O no hydrogen 2.972 N/A ALA 245.A N LEU 240.A O no hydrogen 2.774 N/A GLY 246.A N ASP 249.A OD2 no hydrogen 2.608 N/A ASP 249.A N GLY 246.A O no hydrogen 2.914 N/A ILE 250.A N LEU 247.A O no hydrogen 3.278 N/A SER 251.A N LEU 312.A O no hydrogen 3.017 N/A VAL 253.A N ARG 277.A O no hydrogen 2.966 N/A VAL 254.A N LEU 314.A O no hydrogen 2.637 N/A LEU 255.A N THR 279.A OG1 no hydrogen 3.279 N/A HIS 257.A N ASP 293.A OD2 no hydrogen 2.734 N/A HIS 257.A ND1 GLY 287.A O no hydrogen 2.741 N/A MET 258.A N PRO 256.A O no hydrogen 2.884 N/A GLY 259.A N GLY 153.A O no hydrogen 2.853 N/A TRP 260.A N THR 35.A O no hydrogen 2.759 N/A ARG 261.A N SER 34.A O no hydrogen 3.043 N/A ARG 262.A NH1 ASP 151.A OD1 no hydrogen 3.122 N/A ARG 262.A NH1 ASP 151.A OD2 no hydrogen 3.406 N/A ARG 262.A NH1 THR 154.A OG1 no hydrogen 2.863 N/A ARG 262.A NH2 ASP 151.A OD1 no hydrogen 2.830 N/A LEU 263.A N GLY 259.A O no hydrogen 2.973 N/A SER 264.A N TRP 260.A O no hydrogen 2.870 N/A SER 264.A OG TRP 260.A O no hydrogen 2.844 N/A ALA 265.A N ARG 261.A O no hydrogen 3.013 N/A ALA 266.A N ARG 262.A O no hydrogen 2.772 N/A TYR 267.A N LEU 263.A O no hydrogen 2.813 N/A TYR 267.A OH GLN 232.A OE1 no hydrogen 2.835 N/A PHE 268.A N LEU 263.A O no hydrogen 3.070 N/A ASN 269.A N SER 264.A O no hydrogen 2.905 N/A LYS 270.A N TYR 267.A O no hydrogen 3.146 N/A LYS 270.A NZ SER 229.A OG no hydrogen 3.362 N/A TRP 271.A N TYR 267.A O no hydrogen 2.658 N/A ARG 277.A N GLN 274.A O no hydrogen 2.744 N/A ARG 277.A NH2 ILE 250.A O no hydrogen 3.238 N/A THR 278.A N PRO 275.A O no hydrogen 2.775 N/A THR 278.A OG1 PRO 275.A O no hydrogen 2.800 N/A THR 279.A N VAL 253.A O no hydrogen 3.267 N/A TRP 280.A N THR 278.A OG1 no hydrogen 3.050 N/A GLY 283.A N THR 279.A O no hydrogen 2.871 N/A ARG 284.A N TRP 280.A O no hydrogen 3.012 N/A ARG 284.A NE ARG 36.A O no hydrogen 3.018 N/A ARG 284.A NH1 GLU 281.A OE1 no hydrogen 3.197 N/A ARG 284.A NH2 ARG 36.A O no hydrogen 2.870 N/A ARG 285.A N PHE 282.A O no hydrogen 3.118 N/A ARG 285.A NH1 GLU 281.A O no hydrogen 2.994 N/A ARG 285.A NH1 GLU 281.A OE1 no hydrogen 2.919 N/A THR 286.A N GLY 283.A O no hydrogen 2.947 N/A THR 286.A OG1 PHE 282.A O no hydrogen 2.934 N/A GLY 287.A N GLY 283.A O no hydrogen 2.823 N/A HIS 288.A N VAL 155.A O no hydrogen 2.781 N/A HIS 288.A ND1 ASP 293.A OD2 no hydrogen 2.513 N/A LEU 289.A N ASP 293.A OD1 no hydrogen 2.646 N/A GLY 292.A N LEU 289.A O no hydrogen 2.695 N/A ALA 296.A N GLY 292.A O no hydrogen 2.921 N/A GLY 297.A N ASP 293.A O no hydrogen 2.748 N/A PHE 298.A N PRO 294.A O no hydrogen 3.099 N/A ASP 299.A N ILE 295.A O no hydrogen 2.893 N/A HIS 300.A N ALA 296.A O no hydrogen 2.901 N/A LEU 301.A N GLY 297.A O no hydrogen 2.957 N/A VAL 302.A N PHE 298.A O no hydrogen 2.937 N/A GLY 303.A N ASP 299.A O no hydrogen 2.806 N/A SER 304.A N HIS 300.A O no hydrogen 3.116 N/A SER 304.A OG HIS 300.A O no hydrogen 2.974 N/A GLY 305.A N VAL 302.A O no hydrogen 3.126 N/A ARG 306.A NH1 SER 304.A OG no hydrogen 2.754 N/A ALA 308.A N GLU 311.A OE1 no hydrogen 3.043 N/A GLY 310.A N LEU 331.A O no hydrogen 2.851 N/A GLU 311.A N ALA 308.A O no hydrogen 2.925 N/A CYS 313.A N VAL 329.A O no hydrogen 2.769 N/A CYS 313.A SG ARG 252.A O no hydrogen 3.715 N/A LEU 314.A N ARG 252.A O no hydrogen 2.870 N/A LEU 315.A N ALA 327.A O no hydrogen 2.733 N/A VAL 316.A N VAL 254.A O no hydrogen 2.811 N/A SER 317.A N SER 325.A O no hydrogen 2.912 N/A SER 317.A OG ASN 110.A OD1 no hydrogen 2.608 N/A GLY 319.A N SER 323.A O no hydrogen 2.910 N/A PHE 322.A N GLU 182.A O no hydrogen 2.983 N/A SER 323.A N GLY 319.A O no hydrogen 3.063 N/A TRP 324.A N VAL 180.A O no hydrogen 2.901 N/A SER 325.A N SER 317.A O no hydrogen 2.887 N/A SER 325.A OG THR 179.A OG1 no hydrogen 2.868 N/A CYS 326.A N VAL 178.A O no hydrogen 3.128 N/A CYS 326.A SG LEU 315.A O no hydrogen 3.817 N/A ALA 327.A N LEU 315.A O no hydrogen 3.081 N/A VAL 328.A N SER 176.A O no hydrogen 3.028 N/A VAL 328.A N SER 176.A OG no hydrogen 3.165 N/A VAL 329.A N CYS 313.A O no hydrogen 2.875 N/A GLU 330.A N ARG 173.A O no hydrogen 2.796 N/A LEU 331.A N GLU 311.A O no hydrogen 3.112 N/A LEU 332.A N PHE 171.A O no hydrogen 2.754 N/A GLU 333.A N PHE 171.A O no hydrogen 3.042 N/A ARG 334.A NH2 GLY 305.A O no hydrogen 3.533 N/A ALA 338.A N PRO 335.A O no hydrogen 3.130 N/A ALA 339.A N GLY 303.A O no hydrogen 2.793 N/A