Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4kdd_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): MET 1.A N GLU 138.A OE2 no hydrogen 3.102 N/A ALA 5.A N MET 1.A O no hydrogen 2.579 N/A LEU 6.A N ILE 2.A O no hydrogen 3.087 N/A PHE 7.A N ASP 3.A O no hydrogen 2.776 N/A ASP 8.A N GLU 4.A O no hydrogen 3.057 N/A ALA 9.A N ALA 5.A O no hydrogen 3.064 N/A GLU 10.A N LEU 6.A O no hydrogen 3.034 N/A GLU 11.A N PHE 7.A O no hydrogen 3.146 N/A LYS 12.A N ASP 8.A O no hydrogen 2.988 N/A LYS 12.A NZ ASP 8.A OD1 no hydrogen 2.891 N/A MET 13.A N ALA 9.A O no hydrogen 2.877 N/A GLU 14.A N GLU 10.A O no hydrogen 2.942 N/A LYS 15.A N GLU 11.A O no hydrogen 3.198 N/A ALA 16.A N LYS 12.A O no hydrogen 2.882 N/A VAL 17.A N MET 13.A O no hydrogen 2.890 N/A ALA 18.A N GLU 14.A O no hydrogen 2.977 N/A VAL 19.A N LYS 15.A O no hydrogen 2.810 N/A ALA 20.A N ALA 16.A O no hydrogen 3.016 N/A ARG 21.A N VAL 17.A O no hydrogen 2.939 N/A ASP 22.A N ALA 18.A O no hydrogen 3.099 N/A ASP 23.A N VAL 19.A O no hydrogen 2.936 N/A LEU 24.A N ALA 20.A O no hydrogen 2.946 N/A SER 25.A N ARG 21.A O no hydrogen 3.034 N/A SER 25.A OG ARG 21.A O no hydrogen 3.344 N/A SER 25.A OG ASP 22.A O no hydrogen 2.655 N/A THR 26.A N ASP 23.A O no hydrogen 3.247 N/A THR 26.A OG1 ASP 23.A O no hydrogen 2.614 N/A ILE 27.A N LEU 24.A O no hydrogen 3.061 N/A ARG 28.A NE LEU 87.A O no hydrogen 3.080 N/A ARG 28.A NH2 PRO 103.A O no hydrogen 2.715 N/A THR 29.A OG1 GLY 30.A O no hydrogen 2.877 N/A THR 29.A OG1 GLU 181.A OE1 no hydrogen 3.145 N/A ALA 32.A N ALA 62.A O no hydrogen 3.231 N/A ASN 33.A ND2 ARG 31.A O no hydrogen 3.633 N/A MET 36.A N ASN 33.A O no hydrogen 3.139 N/A PHE 37.A N PRO 34.A O no hydrogen 2.917 N/A SER 38.A N GLY 35.A O no hydrogen 2.952 N/A SER 38.A OG GLY 35.A O no hydrogen 2.739 N/A ARG 39.A NH2 ASP 23.A OD2 no hydrogen 2.998 N/A ILE 40.A N PHE 37.A O no hydrogen 3.257 N/A ILE 42.A N THR 49.A O no hydrogen 3.065 N/A TYR 44.A N ALA 47.A O no hydrogen 2.892 N/A TYR 44.A OH GLU 71.A OE2 no hydrogen 2.615 N/A TYR 45.A OH GLU 71.A OE1 no hydrogen 3.250 N/A GLY 46.A N ASP 43.A OD1 no hydrogen 2.879 N/A THR 49.A N ILE 42.A O no hydrogen 2.850 N/A THR 49.A OG1 ALA 47.A O no hydrogen 2.767 N/A ILE 51.A N ILE 40.A O no hydrogen 2.808 N/A GLN 53.A N PRO 50.A O no hydrogen 2.911 N/A LEU 54.A N ILE 51.A O no hydrogen 3.046 N/A SER 56.A N LYS 68.A O no hydrogen 3.000 N/A ASN 58.A N VAL 66.A O no hydrogen 2.871 N/A ASN 58.A ND2 ILE 57.A O no hydrogen 2.860 N/A LEU 64.A N GLU 61.A O no hydrogen 3.158 N/A VAL 65.A N VAL 100.A O no hydrogen 2.818 N/A VAL 66.A N ASN 58.A O no hydrogen 2.866 N/A ILE 67.A N ILE 98.A O no hydrogen 2.867 N/A LYS 68.A N SER 56.A O no hydrogen 3.056 N/A TYR 70.A N LEU 54.A O no hydrogen 2.900 N/A GLN 74.A N GLU 71.A O no hydrogen 2.746 N/A LEU 75.A N ALA 72.A O no hydrogen 3.268 N/A ILE 78.A N GLN 74.A O no hydrogen 3.038 N/A GLU 79.A N LEU 75.A O no hydrogen 2.799 N/A THR 80.A N ARG 76.A O no hydrogen 2.891 N/A THR 80.A OG1 ARG 76.A O no hydrogen 3.114 N/A ALA 81.A N ALA 77.A O no hydrogen 3.059 N/A ILE 82.A N ILE 78.A O no hydrogen 2.959 N/A ARG 83.A N GLU 79.A O no hydrogen 2.827 N/A ARG 83.A NH1 PRO 91.A O no hydrogen 2.776 N/A ARG 83.A NH2 GLU 79.A OE2 no hydrogen 2.546 N/A ASN 84.A N THR 80.A O no hydrogen 2.697 N/A SER 85.A N ILE 82.A O no hydrogen 3.295 N/A SER 85.A OG ILE 82.A O no hydrogen 2.737 N/A LEU 87.A N SER 85.A OG no hydrogen 3.282 N/A THR 92.A N ARG 99.A O no hydrogen 2.999 N/A ASN 93.A ND2 GLU 79.A OE1 no hydrogen 2.421 N/A ASP 94.A N LEU 97.A O no hydrogen 2.981 N/A GLY 95.A N ASN 93.A OD1 no hydrogen 2.968 N/A ALA 96.A N ASP 94.A OD2 no hydrogen 3.401 N/A LEU 97.A N ASP 94.A OD2 no hydrogen 2.796 N/A ILE 98.A N ILE 67.A O no hydrogen 2.996 N/A ARG 99.A N THR 92.A O no hydrogen 2.763 N/A VAL 100.A N VAL 65.A O no hydrogen 2.689 N/A VAL 102.A N ARG 63.A O no hydrogen 2.871 N/A GLU 108.A N GLU 108.A OE1 no hydrogen 2.818 N/A ARG 109.A N THR 106.A OG1 no hydrogen 2.979 N/A ARG 109.A NH1 GLU 112.A OE1 no hydrogen 3.355 N/A ARG 110.A N THR 106.A O no hydrogen 2.970 N/A ARG 111.A N GLU 107.A O no hydrogen 3.232 N/A GLU 112.A N GLU 108.A O no hydrogen 3.203 N/A LEU 113.A N ARG 109.A O no hydrogen 2.901 N/A VAL 114.A N ARG 110.A O no hydrogen 2.769 N/A LYS 115.A N ARG 111.A O no hydrogen 3.014 N/A GLN 116.A N GLU 112.A O no hydrogen 2.993 N/A ALA 117.A N LEU 113.A O no hydrogen 2.940 N/A LYS 118.A N VAL 114.A O no hydrogen 2.964 N/A HIS 119.A N LYS 115.A O no hydrogen 2.929 N/A LYS 120.A N GLN 116.A O no hydrogen 2.938 N/A LYS 120.A NZ ASP 23.A OD2 no hydrogen 3.406 N/A GLY 121.A N ALA 117.A O no hydrogen 2.984 N/A GLU 122.A N LYS 118.A O no hydrogen 2.922 N/A GLU 123.A N HIS 119.A O no hydrogen 2.994 N/A ALA 124.A N LYS 120.A O no hydrogen 3.127 N/A LYS 125.A N GLY 121.A O no hydrogen 3.023 N/A LYS 125.A NZ ASP 172.A OD2 no hydrogen 2.814 N/A VAL 126.A N GLU 122.A O no hydrogen 3.072 N/A SER 127.A N GLU 123.A O no hydrogen 3.179 N/A VAL 128.A N ALA 124.A O no hydrogen 3.008 N/A ARG 129.A N LYS 125.A O no hydrogen 2.971 N/A ASN 130.A N VAL 126.A O no hydrogen 2.979 N/A ILE 131.A N SER 127.A O no hydrogen 2.981 N/A ARG 132.A N VAL 128.A O no hydrogen 2.862 N/A ARG 132.A NE ASP 161.A OD1 no hydrogen 2.846 N/A ARG 132.A NH2 ASP 161.A OD1 no hydrogen 3.025 N/A ARG 133.A N ARG 129.A O no hydrogen 2.880 N/A LYS 134.A N ASN 130.A O no hydrogen 3.057 N/A ALA 135.A N ILE 131.A O no hydrogen 3.272 N/A MET 136.A N ARG 132.A O no hydrogen 2.775 N/A GLU 137.A N ARG 133.A O no hydrogen 2.836 N/A GLU 138.A N LYS 134.A O no hydrogen 3.224 N/A LEU 139.A N ALA 135.A O no hydrogen 2.910 N/A HIS 140.A N MET 136.A O no hydrogen 2.895 N/A ARG 141.A N GLU 137.A O no hydrogen 2.878 N/A ARG 141.A NE GLU 138.A OE1 no hydrogen 3.045 N/A ARG 141.A NH1 GLU 147.A OE1 no hydrogen 2.800 N/A ARG 141.A NH2 GLU 138.A OE2 no hydrogen 2.720 N/A ARG 141.A NH2 GLU 147.A OE2 no hydrogen 3.027 N/A ILE 142.A N GLU 138.A O no hydrogen 2.871 N/A ARG 143.A N LEU 139.A O no hydrogen 2.985 N/A ARG 143.A NH1 GLU 157.A OE1 no hydrogen 3.053 N/A ARG 143.A NH2 GLU 157.A OE1 no hydrogen 3.381 N/A ARG 143.A NH2 GLU 157.A OE2 no hydrogen 2.701 N/A LYS 144.A N HIS 140.A O no hydrogen 3.060 N/A GLU 145.A N ARG 141.A O no hydrogen 3.026 N/A GLY 146.A N ARG 143.A O no hydrogen 3.061 N/A GLU 147.A N ILE 142.A O no hydrogen 2.929 N/A GLY 149.A N GLU 152.A OE1 no hydrogen 3.029 N/A VAL 153.A N GLY 149.A O no hydrogen 3.074 N/A GLY 154.A N GLU 150.A O no hydrogen 3.054 N/A ARG 155.A N ASP 151.A O no hydrogen 2.999 N/A ALA 156.A N GLU 152.A O no hydrogen 3.044 N/A GLU 157.A N VAL 153.A O no hydrogen 2.885 N/A LYS 158.A N GLY 154.A O no hydrogen 3.206 N/A ASP 159.A N ARG 155.A O no hydrogen 3.112 N/A LEU 160.A N ALA 156.A O no hydrogen 2.879 N/A ASP 161.A N GLU 157.A O no hydrogen 2.903 N/A LYS 162.A N LYS 158.A O no hydrogen 2.922 N/A THR 163.A N ASP 159.A O no hydrogen 2.963 N/A THR 163.A OG1 ASP 159.A O no hydrogen 3.015 N/A THR 164.A N LEU 160.A O no hydrogen 2.986 N/A THR 164.A OG1 LEU 160.A O no hydrogen 2.667 N/A HIS 165.A N ASP 161.A O no hydrogen 3.069 N/A GLN 166.A N LYS 162.A O no hydrogen 2.955 N/A TYR 167.A N THR 163.A O no hydrogen 3.111 N/A TYR 167.A OH GLU 14.A OE1 no hydrogen 2.748 N/A VAL 168.A N THR 164.A O no hydrogen 2.935 N/A THR 169.A N HIS 165.A O no hydrogen 2.921 N/A THR 169.A OG1 HIS 165.A O no hydrogen 2.935 N/A GLN 170.A N GLN 166.A O no hydrogen 3.087 N/A ILE 171.A N TYR 167.A O no hydrogen 3.110 N/A ASP 172.A N VAL 168.A O no hydrogen 2.971 N/A GLU 173.A N THR 169.A O no hydrogen 2.873 N/A LEU 174.A N GLN 170.A O no hydrogen 3.002 N/A VAL 175.A N ILE 171.A O no hydrogen 2.935 N/A LYS 176.A N ASP 172.A O no hydrogen 2.859 N/A HIS 177.A N GLU 173.A O no hydrogen 2.842 N/A LYS 178.A N LEU 174.A O no hydrogen 3.048 N/A LYS 178.A NZ LEU 24.A O no hydrogen 3.393 N/A GLU 179.A N VAL 175.A O no hydrogen 2.873 N/A GLY 180.A N LYS 176.A O no hydrogen 3.111 N/A GLU 181.A N HIS 177.A O no hydrogen 3.090 N/A LEU 182.A N LYS 178.A O no hydrogen 2.858 N/A LEU 183.A N GLU 179.A O no hydrogen 2.824 N/A GLU 184.A N GLU 181.A O no hydrogen 3.345 N/A