Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 7mu2_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): LEU 3.A N GLY 17.A O no hydrogen 2.741 N/A PHE 4.A N GLY 17.A O no hydrogen 3.342 N/A ASN 6.A N ALA 15.A O no hydrogen 2.958 N/A ASN 8.A N SER 13.A O no hydrogen 3.037 N/A ASN 8.A ND2 THR 12.A OG1 no hydrogen 2.850 N/A ASN 8.A ND2 PHE 52.A O no hydrogen 2.945 N/A GLN 9.A N GLN 9.A OE1 no hydrogen 2.704 N/A GLN 9.A NE2 ARG 50.A O no hydrogen 2.983 N/A GLN 9.A NE2 LEU 93.A O no hydrogen 3.020 N/A ASN 11.A N ASN 8.A O no hydrogen 3.289 N/A THR 12.A N ASN 8.A OD1 no hydrogen 2.826 N/A THR 12.A OG1 ASP 10.A OD1 no hydrogen 2.718 N/A THR 12.A OG1 SER 53.A OG no hydrogen 3.006 N/A SER 13.A N ASN 8.A OD1 no hydrogen 3.042 N/A LEU 14.A N PHE 25.A O no hydrogen 2.865 N/A ALA 15.A N ASN 6.A O no hydrogen 2.807 N/A VAL 16.A N LYS 23.A O no hydrogen 2.959 N/A GLY 17.A N PHE 4.A O no hydrogen 2.819 N/A SER 18.A N GLY 21.A O no hydrogen 2.810 N/A SER 18.A OG SER 20.A OG no hydrogen 3.331 N/A SER 18.A OG GLY 21.A O no hydrogen 3.425 N/A LYS 19.A N GLN 1.A O no hydrogen 3.002 N/A SER 20.A N SER 18.A OG no hydrogen 3.355 N/A SER 20.A OG SER 18.A OG no hydrogen 3.331 N/A GLY 21.A N SER 18.A O no hydrogen 3.440 N/A TYR 22.A N CYS 39.A O no hydrogen 3.166 N/A LYS 23.A N VAL 16.A O no hydrogen 2.944 N/A LYS 23.A NZ GLN 35.A OE1 no hydrogen 3.528 N/A LYS 23.A NZ ASP 308.A O no hydrogen 2.670 N/A PHE 24.A N TYR 37.A O no hydrogen 3.015 N/A PHE 25.A N LEU 14.A O no hydrogen 2.788 N/A SER 26.A N GLU 34.A O no hydrogen 2.914 N/A SER 26.A OG GLU 34.A O no hydrogen 3.450 N/A GLN 35.A NE2 GLU 38.A OE2 no hydrogen 3.527 N/A ILE 36.A N PHE 24.A O no hydrogen 2.860 N/A TYR 37.A N PHE 24.A O no hydrogen 3.419 N/A TYR 37.A OH PHE 73.A O no hydrogen 3.074 N/A CYS 39.A N TYR 22.A O no hydrogen 2.899 N/A CYS 39.A SG ASP 41.A OD2 no hydrogen 3.279 N/A CYS 39.A SG THR 42.A OG1 no hydrogen 3.676 N/A ASP 44.A N LYS 19.A O no hydrogen 2.998 N/A VAL 45.A N SER 18.A O no hydrogen 3.293 N/A CYS 46.A N VAL 60.A O no hydrogen 2.947 N/A CYS 46.A SG VAL 60.A O no hydrogen 3.468 N/A ILE 47.A N VAL 60.A O no hydrogen 3.256 N/A GLU 49.A N ALA 58.A O no hydrogen 2.900 N/A ARG 50.A NE SER 54.A O no hydrogen 3.073 N/A ARG 50.A NH1 SER 13.A OG no hydrogen 3.024 N/A ARG 50.A NH2 SER 53.A O no hydrogen 3.171 N/A ARG 50.A NH2 SER 54.A O no hydrogen 3.333 N/A LEU 51.A N LEU 56.A O no hydrogen 3.086 N/A PHE 52.A N GLN 9.A OE1 no hydrogen 2.763 N/A SER 54.A N LEU 51.A O no hydrogen 2.901 N/A SER 54.A OG LEU 51.A O no hydrogen 2.724 N/A LEU 56.A N SER 54.A OG no hydrogen 3.183 N/A VAL 57.A N CYS 71.A O no hydrogen 3.046 N/A ALA 58.A N GLU 49.A O no hydrogen 2.873 N/A ILE 59.A N LYS 69.A O no hydrogen 2.777 N/A VAL 60.A N ILE 47.A O no hydrogen 3.056 N/A SER 61.A OG GLU 43.A O no hydrogen 2.744 N/A LEU 62.A N ASP 44.A O no hydrogen 2.702 N/A LYS 63.A N SER 61.A OG no hydrogen 2.879 N/A ALA 64.A N SER 61.A O no hydrogen 3.034 N/A ARG 66.A NE SER 85.A O no hydrogen 3.091 N/A LYS 67.A N ALA 64.A O no hydrogen 3.136 N/A LEU 68.A N TYR 82.A O no hydrogen 2.806 N/A LYS 69.A N ILE 59.A O no hydrogen 2.904 N/A VAL 70.A N CYS 80.A O no hydrogen 2.916 N/A CYS 71.A N VAL 57.A O no hydrogen 2.865 N/A HIS 72.A N THR 77.A O no hydrogen 2.875 N/A PHE 73.A N SER 55.A O no hydrogen 3.024 N/A LYS 75.A N HIS 72.A ND1 no hydrogen 3.154 N/A GLY 76.A N HIS 72.A O no hydrogen 2.818 N/A GLY 76.A N PHE 73.A O no hydrogen 3.168 N/A THR 77.A N HIS 72.A O no hydrogen 3.177 N/A ILE 79.A N VAL 70.A O no hydrogen 2.745 N/A CYS 80.A N VAL 70.A O no hydrogen 3.322 N/A ASN 81.A ND2 GLU 78.A OE1 no hydrogen 2.991 N/A TYR 82.A N LEU 68.A O no hydrogen 3.028 N/A TYR 84.A N ARG 66.A O no hydrogen 2.904 N/A TYR 84.A OH HIS 109.A NE2 no hydrogen 2.798 N/A THR 87.A N ASN 86.A OD1 no hydrogen 2.828 N/A ILE 88.A N PRO 65.A O no hydrogen 2.975 N/A LEU 89.A N CYS 101.A O no hydrogen 2.840 N/A ALA 90.A N CYS 101.A O no hydrogen 3.355 N/A LYS 92.A N ILE 99.A O no hydrogen 2.995 N/A LYS 92.A NZ CYS 131.A O no hydrogen 3.381 N/A ASN 94.A N ARG 97.A O no hydrogen 2.961 N/A ASN 94.A ND2 SER 134.A O no hydrogen 2.936 N/A GLN 96.A N ASN 94.A OD1 no hydrogen 2.820 N/A GLN 96.A NE2 ASN 137.A OD1 no hydrogen 3.458 N/A ARG 97.A N ASN 94.A OD1 no hydrogen 2.869 N/A ARG 97.A NE THR 158.A O no hydrogen 2.813 N/A ARG 97.A NH1 GLN 96.A O no hydrogen 2.799 N/A LEU 98.A N HIS 109.A O no hydrogen 2.952 N/A ILE 99.A N LYS 92.A O no hydrogen 2.754 N/A VAL 100.A N TYR 107.A O no hydrogen 2.960 N/A CYS 101.A N ALA 90.A O no hydrogen 2.903 N/A CYS 101.A SG LEU 102.A O no hydrogen 3.496 N/A LEU 102.A N SER 105.A O no hydrogen 2.838 N/A GLU 104.A N GLU 104.A OE1 no hydrogen 2.597 N/A SER 105.A OG GLU 104.A OE2 no hydrogen 2.751 N/A LEU 106.A N ILE 120.A O no hydrogen 2.951 N/A TYR 107.A N VAL 100.A O no hydrogen 2.911 N/A ILE 108.A N HIS 118.A O no hydrogen 2.901 N/A HIS 109.A N LEU 98.A O no hydrogen 2.776 N/A HIS 109.A ND1 MET 114.A O no hydrogen 2.932 N/A ASN 110.A N LYS 115.A O no hydrogen 2.863 N/A ILE 111.A N GLN 96.A O no hydrogen 3.172 N/A ARG 112.A N ASN 110.A OD1 no hydrogen 3.043 N/A ASP 113.A N ASN 110.A O no hydrogen 3.400 N/A MET 114.A N ASN 110.A O no hydrogen 2.594 N/A LYS 115.A N ASP 113.A OD1 no hydrogen 2.864 N/A LEU 117.A N ILE 108.A O no hydrogen 2.703 N/A HIS 118.A N ILE 108.A O no hydrogen 3.440 N/A ILE 120.A N LEU 106.A O no hydrogen 2.822 N/A THR 123.A N GLU 104.A O no hydrogen 2.991 N/A THR 123.A OG1 PRO 124.A O no hydrogen 3.271 N/A ASN 126.A N GLU 103.A O no hydrogen 2.945 N/A ASN 126.A ND2 LEU 130.A O no hydrogen 2.788 N/A GLY 129.A N ASN 126.A O no hydrogen 3.033 N/A LEU 130.A N ASN 126.A OD1 no hydrogen 2.915 N/A CYS 131.A SG GLY 129.A O no hydrogen 3.844 N/A ALA 132.A N ALA 143.A O no hydrogen 2.927 N/A SER 134.A N TYR 141.A O no hydrogen 2.901 N/A SER 134.A OG ASN 136.A O no hydrogen 3.513 N/A SER 134.A OG ASN 139.A O no hydrogen 2.635 N/A ASN 136.A N SER 134.A OG no hydrogen 3.033 N/A ASP 138.A N ASN 136.A OD1 no hydrogen 2.937 N/A ASN 139.A N ASN 136.A OD1 no hydrogen 3.214 N/A ASN 139.A ND2 SER 182.A O no hydrogen 3.202 N/A CYS 140.A SG THR 158.A OG1 no hydrogen 3.289 N/A LEU 142.A N PHE 156.A O no hydrogen 2.785 N/A ALA 143.A N ALA 132.A O no hydrogen 2.826 N/A TYR 144.A N GLN 154.A O no hydrogen 3.088 N/A GLY 146.A N GLU 152.A O no hydrogen 2.770 N/A THR 149.A N SER 147.A OG no hydrogen 3.085 N/A ILE 150.A N SER 147.A OG no hydrogen 3.024 N/A GLU 152.A N ILE 150.A O no hydrogen 3.000 N/A VAL 153.A N ILE 167.A O no hydrogen 2.766 N/A GLN 154.A N TYR 144.A O no hydrogen 2.799 N/A VAL 155.A N ASN 165.A O no hydrogen 2.866 N/A PHE 156.A N LEU 142.A O no hydrogen 2.834 N/A ASP 157.A N ARG 162.A O no hydrogen 2.743 N/A THR 158.A N CYS 140.A O no hydrogen 2.989 N/A THR 158.A OG1 CYS 140.A O no hydrogen 2.939 N/A ILE 159.A N ASP 157.A OD1 no hydrogen 2.926 N/A ASN 160.A N ASP 157.A OD1 no hydrogen 3.095 N/A ASN 160.A ND2 ASP 157.A OD2 no hydrogen 2.592 N/A ARG 162.A N ASP 157.A O no hydrogen 3.292 N/A ALA 164.A N VAL 155.A O no hydrogen 2.789 N/A ASN 165.A N VAL 155.A O no hydrogen 3.301 N/A ASN 165.A ND2 PRO 202.A O no hydrogen 2.902 N/A MET 166.A N ASN 165.A OD1 no hydrogen 2.794 N/A ILE 167.A N VAL 153.A O no hydrogen 2.786 N/A ALA 169.A N GLY 151.A O no hydrogen 2.740 N/A HIS 170.A N GLY 151.A O no hydrogen 3.035 N/A HIS 170.A NE2 THR 188.A OG1 no hydrogen 2.875 N/A SER 172.A OG SER 190.A OG no hydrogen 2.894 N/A ALA 175.A N ALA 189.A O no hydrogen 2.655 N/A ALA 176.A N ALA 189.A O no hydrogen 3.301 N/A ALA 178.A N ALA 187.A O no hydrogen 2.981 N/A ASP 180.A N LYS 185.A O no hydrogen 3.032 N/A SER 182.A N ASP 180.A OD2 no hydrogen 3.341 N/A SER 182.A OG ASP 180.A OD1 no hydrogen 3.004 N/A SER 182.A OG ASP 180.A OD2 no hydrogen 2.473 N/A SER 182.A OG THR 184.A OG1 no hydrogen 2.650 N/A GLY 183.A N ASP 180.A O no hydrogen 2.982 N/A THR 184.A N ASP 180.A OD1 no hydrogen 3.100 N/A THR 184.A N SER 182.A OG no hydrogen 3.200 N/A THR 184.A OG1 SER 182.A OG no hydrogen 2.650 N/A LYS 185.A N ASP 180.A OD1 no hydrogen 3.085 N/A LEU 186.A N PHE 199.A O no hydrogen 2.849 N/A ALA 187.A N ALA 178.A O no hydrogen 2.749 N/A THR 188.A N ARG 197.A O no hydrogen 2.785 N/A THR 188.A OG1 HIS 170.A NE2 no hydrogen 2.875 N/A THR 188.A OG1 ARG 197.A O no hydrogen 3.471 N/A ALA 189.A N ALA 176.A O no hydrogen 3.086 N/A SER 190.A OG SER 172.A OG no hydrogen 2.894 N/A GLU 191.A N PRO 173.A O no hydrogen 2.828 N/A LYS 192.A N SER 190.A OG no hydrogen 3.207 N/A ILE 196.A N PHE 210.A O no hydrogen 2.876 N/A ARG 197.A N THR 188.A O no hydrogen 3.075 N/A ARG 197.A NE GLU 209.A OE1 no hydrogen 2.890 N/A ARG 197.A NH1 ALA 169.A O no hydrogen 2.952 N/A ARG 197.A NH2 GLU 209.A OE1 no hydrogen 3.149 N/A VAL 198.A N PHE 208.A O no hydrogen 3.022 N/A PHE 199.A N LEU 186.A O no hydrogen 2.910 N/A SER 200.A N GLN 205.A O no hydrogen 2.885 N/A ILE 201.A N THR 184.A O no hydrogen 2.901 N/A GLU 203.A N GLU 203.A OE2 no hydrogen 2.854 N/A GLY 204.A N SER 200.A O no hydrogen 2.819 N/A GLN 205.A N SER 200.A OG no hydrogen 3.126 N/A LYS 206.A NZ GLU 209.A OE1 no hydrogen 2.789 N/A LEU 207.A N VAL 198.A O no hydrogen 2.670 N/A PHE 208.A N VAL 198.A O no hydrogen 3.266 N/A PHE 210.A N ILE 196.A O no hydrogen 2.797 N/A ARG 211.A N GLY 249.A O no hydrogen 2.528 N/A ARG 212.A NE GLY 193.A O no hydrogen 3.216 N/A ARG 212.A NH1 ARG 212.A O no hydrogen 2.598 N/A SER 219.A N ASN 237.A OD1 no hydrogen 2.840 N/A CYS 221.A N SER 235.A O no hydrogen 2.905 N/A CYS 221.A SG ASN 264.A O no hydrogen 3.389 N/A ALA 224.A N SER 233.A O no hydrogen 3.099 N/A SER 226.A N PHE 231.A O no hydrogen 2.905 N/A SER 226.A OG ASP 228.A OD1 no hydrogen 2.686 N/A SER 226.A OG PHE 231.A O no hydrogen 3.518 N/A GLY 229.A N SER 226.A O no hydrogen 2.916 N/A MET 230.A N ASP 228.A OD1 no hydrogen 3.142 N/A PHE 231.A N SER 226.A OG no hydrogen 3.099 N/A LEU 232.A N PHE 244.A O no hydrogen 2.923 N/A SER 233.A N ALA 224.A O no hydrogen 2.829 N/A SER 233.A OG ALA 224.A O no hydrogen 3.390 N/A ALA 234.A N HIS 242.A O no hydrogen 2.809 N/A SER 235.A N SER 222.A O no hydrogen 2.979 N/A SER 235.A OG ASN 264.A OD1 no hydrogen 2.717 N/A ASN 237.A N SER 219.A O no hydrogen 3.217 N/A THR 238.A N SER 236.A OG no hydrogen 3.265 N/A THR 238.A OG1 SER 236.A OG no hydrogen 2.895 N/A THR 240.A OG1 GLU 239.A OE2 no hydrogen 3.285 N/A VAL 241.A N VAL 255.A O no hydrogen 2.958 N/A HIS 242.A N ALA 234.A O no hydrogen 3.134 N/A ILE 243.A N ALA 253.A O no hydrogen 2.915 N/A PHE 244.A N LEU 232.A O no hydrogen 2.748 N/A LYS 245.A NZ GLU 247.A OE2 no hydrogen 3.444 N/A LYS 245.A NZ PRO 293.A O no hydrogen 2.872 N/A LEU 246.A N MET 230.A O no hydrogen 2.813 N/A PHE 252.A N ILE 243.A O no hydrogen 2.724 N/A ALA 253.A N ILE 243.A O no hydrogen 3.051 N/A THR 254.A N GLY 297.A O no hydrogen 3.050 N/A THR 254.A OG1 GLU 298.A OE1 no hydrogen 2.846 N/A VAL 255.A N VAL 241.A O no hydrogen 2.973 N/A LEU 257.A N GLU 239.A O no hydrogen 2.736 N/A CYS 260.A SG GLU 239.A OE1 no hydrogen 2.977 N/A ASN 264.A ND2 SER 236.A O no hydrogen 3.006 N/A ASN 264.A ND2 HIS 262.A O no hydrogen 3.067 N/A ILE 265.A N GLY 280.A O no hydrogen 2.819 N/A CYS 266.A N SER 222.A OG no hydrogen 3.090 N/A SER 267.A N LEU 278.A O no hydrogen 2.889 N/A ALA 269.A N ARG 276.A O no hydrogen 2.908 N/A ILE 271.A N ILE 274.A O no hydrogen 3.010 N/A ILE 274.A N ILE 271.A O no hydrogen 3.078 N/A ARG 276.A N ALA 269.A O no hydrogen 2.669 N/A ARG 276.A NE ILE 271.A O no hydrogen 3.205 N/A ARG 276.A NH2 ILE 271.A O no hydrogen 2.892 N/A LEU 277.A N TYR 289.A O no hydrogen 2.896 N/A LEU 278.A N SER 267.A O no hydrogen 2.813 N/A VAL 279.A N TYR 287.A O no hydrogen 2.892 N/A GLY 280.A N ILE 265.A O no hydrogen 2.754 N/A ALA 281.A N TYR 285.A O no hydrogen 2.978 N/A ALA 282.A N LYS 263.A O no hydrogen 2.990 N/A GLY 284.A N ALA 281.A O no hydrogen 3.107 N/A TYR 285.A N ASP 283.A OD1 no hydrogen 3.185 N/A LEU 286.A N HIS 305.A O no hydrogen 2.756 N/A TYR 287.A N VAL 279.A O no hydrogen 2.856 N/A TYR 287.A OH ASP 283.A OD2 no hydrogen 2.593 N/A MET 288.A N LYS 303.A O no hydrogen 2.768 N/A TYR 289.A N LEU 277.A O no hydrogen 2.899 N/A ASN 290.A N ALA 300.A O no hydrogen 3.025 N/A LEU 291.A N PRO 275.A O no hydrogen 2.965 N/A GLN 294.A N ASP 292.A OD2 no hydrogen 3.109 N/A GLU 295.A N ASP 292.A OD2 no hydrogen 3.196 N/A GLY 296.A N ASP 292.A O no hydrogen 2.872 N/A GLY 297.A N PHE 252.A O no hydrogen 3.102 N/A CYS 299.A N THR 254.A O no hydrogen 2.858 N/A CYS 299.A SG THR 254.A O no hydrogen 3.596 N/A CYS 299.A SG GLY 297.A O no hydrogen 3.983 N/A MET 302.A N MET 288.A O no hydrogen 2.703 N/A LYS 303.A N MET 288.A O no hydrogen 3.281 N/A HIS 305.A N LEU 286.A O no hydrogen 2.809 N/A HIS 305.A NE2 VAL 30.A O no hydrogen 2.951 N/A ARG 306.A NH2 ASP 308.A OD2 no hydrogen 2.617 N/A LEU 307.A N GLY 284.A O no hydrogen 2.867 N/A GLY 309.A N ARG 306.A O no hydrogen 3.183 N/A