Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4ki2_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): LEU 8.A N VAL 4.A O no hydrogen 2.992 N/A HIS 9.A N ARG 5.A O no hydrogen 2.980 N/A GLU 10.A N GLN 6.A O no hydrogen 2.812 N/A ILE 11.A N TYR 7.A O no hydrogen 2.944 N/A GLY 12.A N LEU 8.A O no hydrogen 2.899 N/A THR 18.A N GLU 21.A OE1 no hydrogen 3.200 N/A THR 18.A OG1 GLU 20.A OE1 no hydrogen 2.988 N/A GLU 20.A N GLU 20.A OE1 no hydrogen 2.484 N/A GLU 21.A N THR 18.A OG1 no hydrogen 3.201 N/A GLU 22.A N THR 18.A O no hydrogen 3.043 N/A ILE 23.A N LEU 19.A O no hydrogen 2.884 N/A ASP 24.A N GLU 20.A O no hydrogen 2.950 N/A LEU 25.A N GLU 21.A O no hydrogen 2.987 N/A ALA 26.A N GLU 22.A O no hydrogen 2.908 N/A ARG 27.A N ILE 23.A O no hydrogen 2.742 N/A LYS 28.A N ASP 24.A O no hydrogen 2.972 N/A LYS 28.A NZ ASP 24.A OD1.A no hydrogen 2.327 N/A LYS 28.A NZ ASP 24.A OD2.A no hydrogen 3.142 N/A VAL 29.A N LEU 25.A O no hydrogen 2.778 N/A GLU 30.A N ALA 26.A O no hydrogen 3.077 N/A GLU 31.A N ARG 27.A O no hydrogen 2.765 N/A GLY 32.A N LYS 28.A O no hydrogen 2.772 N/A MET 33.A N VAL 29.A O no hydrogen 3.123 N/A GLU 34.A N GLU 30.A O no hydrogen 3.173 N/A ALA 35.A N GLU 31.A O no hydrogen 2.954 N/A ILE 36.A N GLY 32.A O no hydrogen 2.852 N/A LYS 37.A N MET 33.A O no hydrogen 2.919 N/A LYS 37.A N GLU 34.A O no hydrogen 3.102 N/A LYS 37.A NZ GLU 41.A OE1 no hydrogen 2.504 N/A LYS 38.A N GLU 34.A O no hydrogen 3.192 N/A LEU 39.A N ALA 35.A O no hydrogen 2.895 N/A SER 40.A N ILE 36.A O no hydrogen 2.925 N/A SER 40.A OG LEU 45.A O no hydrogen 2.013 N/A GLU 41.A N LYS 37.A O no hydrogen 2.810 N/A ALA 42.A N LYS 38.A O no hydrogen 3.005 N/A THR 43.A N LEU 39.A O no hydrogen 2.879 N/A ILE 50.A N ASP 46.A O no hydrogen 2.937 N/A ARG 51.A N GLN 47.A O no hydrogen 3.230 N/A ARG 51.A NH1.B GLU 104.A OE2 no hydrogen 3.545 N/A GLU 52.A N GLU 48.A O no hydrogen 3.223 N/A VAL 53.A N LEU 49.A O no hydrogen 2.923 N/A VAL 54.A N ILE 50.A O no hydrogen 2.934 N/A ARG 55.A N ARG 51.A O no hydrogen 2.694 N/A ALA 56.A N GLU 52.A O no hydrogen 3.182 N/A LYS 57.A N VAL 53.A O no hydrogen 3.114 N/A ILE 58.A N VAL 54.A O no hydrogen 3.151 N/A LEU 59.A N ARG 55.A O no hydrogen 2.778 N/A GLY 60.A N LYS 57.A O no hydrogen 3.437 N/A THR 61.A N ILE 58.A O no hydrogen 3.010 N/A ALA 62.A N LEU 59.A O no hydrogen 3.251 N/A ARG 63.A N GLU 112.A OE2 no hydrogen 2.936 N/A ARG 63.A NE GLU 112.A OE1 no hydrogen 3.200 N/A ARG 63.A NH2 GLU 112.A OE1 no hydrogen 3.565 N/A ILE 64.A N GLU 112.A OE2 no hydrogen 3.257 N/A LEU 70.A N PRO 68.A O no hydrogen 2.534 N/A THR 78.A N ASP 75.A OD2 no hydrogen 2.434 N/A THR 78.A OG1 ASP 75.A OD1 no hydrogen 2.777 N/A THR 78.A OG1 ASP 75.A OD2 no hydrogen 2.805 N/A VAL 79.A N ASP 75.A O no hydrogen 2.856 N/A GLU 80.A N PRO 76.A O no hydrogen 2.657 N/A GLU 81.A N LYS 77.A O no hydrogen 2.510 N/A VAL 82.A N THR 78.A O no hydrogen 2.743 N/A ASP 83.A N VAL 79.A O no hydrogen 2.791 N/A GLY 84.A N GLU 80.A O no hydrogen 2.865 N/A LYS 85.A N GLU 81.A O no hydrogen 2.899 N/A LEU 86.A N VAL 82.A O no hydrogen 2.873 N/A LYS 87.A N ASP 83.A O no hydrogen 2.745 N/A SER 88.A N GLY 84.A O no hydrogen 3.047 N/A SER 88.A OG GLY 84.A O no hydrogen 2.183 N/A LEU 89.A N LEU 86.A O no hydrogen 2.978 N/A TYR 96.A N LEU 93.A O no hydrogen 3.102 N/A LEU 97.A N LYS 94.A O no hydrogen 2.818 N/A HIS 98.A N LYS 94.A O no hydrogen 3.271 N/A HIS 98.A N ARG 95.A O no hydrogen 2.827 N/A ILE 99.A N ARG 95.A O no hydrogen 3.118 N/A ALA 100.A N TYR 96.A O no hydrogen 3.124 N/A ARG 101.A N LEU 97.A O no hydrogen 2.949 N/A GLU 102.A N HIS 98.A O no hydrogen 2.756 N/A GLY 103.A N ILE 99.A O no hydrogen 2.755 N/A GLU 104.A N ALA 100.A O no hydrogen 3.309 N/A ALA 105.A N ARG 101.A O no hydrogen 3.129 N/A ALA 106.A N GLU 102.A O no hydrogen 2.727 N/A ARG 107.A N GLY 103.A O no hydrogen 2.761 N/A ARG 107.A NE GLU 104.A OE2 no hydrogen 2.987 N/A ARG 107.A NH2 GLU 104.A OE2 no hydrogen 3.335 N/A GLN 108.A N GLU 104.A O no hydrogen 3.180 N/A GLN 108.A NE2 GLU 112.A OE2 no hydrogen 2.621 N/A HIS 109.A N ALA 105.A O no hydrogen 3.057 N/A LEU 110.A N ALA 106.A O no hydrogen 2.882 N/A ILE 111.A N ARG 107.A O no hydrogen 2.989 N/A GLU 112.A N GLN 108.A O no hydrogen 2.918 N/A ALA 113.A N HIS 109.A O no hydrogen 2.886 N/A ASN 114.A N LEU 110.A O no hydrogen 3.340 N/A ASN 114.A N ILE 111.A O no hydrogen 3.281 N/A ASN 114.A ND2 LEU 110.A O no hydrogen 3.253 N/A LEU 115.A N GLU 112.A O no hydrogen 3.483 N/A ARG 116.A NH1 VAL 14.A O no hydrogen 2.764 N/A LEU 117.A N ASN 114.A O no hydrogen 2.938 N/A VAL 118.A N ASN 114.A O no hydrogen 3.415 N/A VAL 119.A N LEU 115.A O no hydrogen 3.250 N/A SER 120.A N ARG 116.A O no hydrogen 3.116 N/A SER 120.A OG LEU 117.A O no hydrogen 3.190 N/A ILE 121.A N LEU 117.A O no hydrogen 2.905 N/A ALA 122.A N VAL 118.A O no hydrogen 2.754 N/A LYS 123.A N VAL 119.A O no hydrogen 3.160 N/A LYS 124.A N ILE 121.A O no hydrogen 3.059 N/A TYR 125.A N ALA 122.A O no hydrogen 2.769 N/A THR 126.A N LYS 123.A O no hydrogen 3.468 N/A THR 126.A OG1 LYS 123.A O no hydrogen 3.476 N/A SER 131.A N ASP 134.A OD2 no hydrogen 2.931 N/A SER 131.A OG ASP 134.A OD2 no hydrogen 3.012 N/A ASP 134.A N SER 131.A O no hydrogen 3.004 N/A LEU 135.A N SER 131.A O no hydrogen 3.337 N/A ILE 136.A N PHE 132.A O no hydrogen 3.046 N/A GLN 137.A N LEU 133.A O no hydrogen 2.953 N/A GLU 138.A N ASP 134.A O no hydrogen 2.872 N/A GLY 139.A N LEU 135.A O no hydrogen 2.515 N/A ASN 140.A N ILE 136.A O no hydrogen 2.805 N/A GLN 141.A N GLN 137.A O no hydrogen 2.871 N/A GLY 142.A N GLU 138.A O no hydrogen 2.895 N/A LEU 143.A N GLY 139.A O no hydrogen 2.919 N/A ILE 144.A N ASN 140.A O no hydrogen 2.878 N/A ARG 145.A N GLN 141.A O no hydrogen 3.179 N/A ALA 146.A N GLY 142.A O no hydrogen 2.697 N/A VAL 147.A N LEU 143.A O no hydrogen 3.044 N/A GLU 148.A N ILE 144.A O no hydrogen 3.132 N/A LYS 149.A N ARG 145.A O no hydrogen 3.210 N/A LYS 149.A N ALA 146.A O no hydrogen 3.104 N/A PHE 150.A N ALA 146.A O no hydrogen 2.898 N/A ARG 154.A NE GLU 151.A OE1 no hydrogen 2.764 N/A ARG 154.A NH2 GLU 151.A OE1 no hydrogen 3.193 N/A ARG 155.A N TYR 152.A O no hydrogen 2.870 N/A LYS 157.A NZ GLU 22.A OE2 no hydrogen 3.055 N/A PHE 158.A N GLU 22.A OE1 no hydrogen 3.131 N/A THR 160.A OG1 LYS 157.A O no hydrogen 3.289 N/A ALA 162.A N PHE 158.A O no hydrogen 2.965 N/A THR 163.A N SER 159.A O no hydrogen 2.861 N/A THR 163.A OG1 SER 159.A O no hydrogen 2.909 N/A TRP 164.A N THR 160.A O no hydrogen 3.265 N/A TRP 165.A N TYR 161.A O no hydrogen 3.268 N/A ILE 166.A N ALA 162.A O no hydrogen 2.768 N/A ARG 167.A N THR 163.A O no hydrogen 3.002 N/A ARG 167.A N TRP 164.A O no hydrogen 2.890 N/A GLN 168.A N TRP 164.A O no hydrogen 2.795 N/A ALA 169.A N TRP 165.A O no hydrogen 2.930 N/A ILE 170.A N ILE 166.A O no hydrogen 3.372 N/A ASN 171.A N ARG 167.A O no hydrogen 2.888 N/A ARG 172.A N GLN 168.A O no hydrogen 2.858 N/A ALA 173.A N ALA 169.A O no hydrogen 2.822 N/A ILE 174.A N ILE 170.A O no hydrogen 3.033 N/A ALA 175.A N ASN 171.A O no hydrogen 3.044 N/A ALA 175.A N ARG 172.A O no hydrogen 2.948 N/A ASP 176.A N ARG 172.A O no hydrogen 2.939 N/A ASP 176.A N ALA 173.A O no hydrogen 2.931 N/A GLN 177.A N ILE 174.A O no hydrogen 3.326 N/A ALA 178.A N ALA 175.A O no hydrogen 3.329 N/A