Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1ki7_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): LEU 4.A N THR 281.A O no hydrogen 2.544 N/A LEU 5.A N LEU 105.A O no hydrogen 2.746 N/A ARG 6.A NH1 TYR 8.A OH no hydrogen 2.758 N/A VAL 7.A N LEU 107.A O no hydrogen 2.914 N/A TYR 8.A N ASN 150.A O no hydrogen 2.807 N/A ILE 9.A N PHE 109.A O no hydrogen 2.945 N/A ASP 10.A N VAL 152.A O no hydrogen 2.755 N/A GLY 11.A N ASP 10.A OD1 no hydrogen 2.980 N/A LYS 17.A NZ ASP 110.A OD1 no hydrogen 3.305 N/A THR 18.A OG1 THR 19.A OG1 no hydrogen 3.264 N/A THR 19.A OG1 THR 18.A OG1 no hydrogen 3.264 N/A THR 20.A N LYS 17.A O no hydrogen 3.157 N/A THR 20.A OG1 GLY 16.A O no hydrogen 3.110 N/A THR 20.A OG1 LYS 17.A O no hydrogen 3.230 N/A THR 21.A N LYS 17.A O no hydrogen 2.810 N/A THR 21.A N THR 18.A O no hydrogen 3.146 N/A GLN 22.A N THR 18.A O no hydrogen 3.074 N/A VAL 25.A N THR 21.A O no hydrogen 3.527 N/A VAL 25.A N GLN 22.A O no hydrogen 3.192 N/A VAL 28.A N THR 106.A O no hydrogen 2.889 N/A VAL 30.A N ILE 108.A O no hydrogen 2.614 N/A MET 34.A N GLU 32.A O no hydrogen 2.574 N/A THR 35.A N MET 303.A O no hydrogen 2.672 N/A THR 35.A OG1 MET 303.A O no hydrogen 3.258 N/A THR 35.A OG1 GLY 304.A O no hydrogen 3.439 N/A THR 35.A OG1 GLU 305.A OE2 no hydrogen 3.303 N/A TYR 36.A N PRO 33.A O no hydrogen 2.798 N/A TRP 37.A N PRO 33.A O no hydrogen 3.043 N/A TRP 37.A NE1 MET 77.A O no hydrogen 2.714 N/A ARG 38.A N MET 34.A O no hydrogen 2.849 N/A VAL 39.A N THR 35.A O no hydrogen 2.814 N/A LEU 40.A N THR 35.A O no hydrogen 3.040 N/A GLY 41.A N TYR 36.A O no hydrogen 2.995 N/A GLU 44.A N ARG 38.A O no hydrogen 2.915 N/A THR 45.A N TRP 37.A O no hydrogen 2.901 N/A THR 45.A OG1 TRP 37.A O no hydrogen 2.580 N/A ASN 48.A N GLU 44.A O no hydrogen 3.036 N/A ILE 49.A N THR 45.A O no hydrogen 2.958 N/A TYR 50.A N ILE 46.A O no hydrogen 3.228 N/A THR 51.A N ALA 47.A O no hydrogen 2.942 N/A THR 51.A OG1 ALA 47.A O no hydrogen 2.813 N/A THR 52.A N ASN 48.A O no hydrogen 3.132 N/A THR 52.A OG1 ASN 48.A O no hydrogen 2.832 N/A GLN 53.A N ILE 49.A O no hydrogen 3.194 N/A GLN 53.A NE2 GLN 53.A O no hydrogen 3.558 N/A GLN 53.A NE2 ASP 57.A OD1 no hydrogen 3.232 N/A GLN 53.A NE2 MET 127.A O no hydrogen 3.541 N/A HIS 54.A N TYR 50.A O no hydrogen 3.142 N/A ARG 55.A N THR 51.A O no hydrogen 2.905 N/A LEU 56.A N THR 52.A O no hydrogen 2.774 N/A ASP 57.A N GLN 53.A O no hydrogen 2.862 N/A GLN 58.A N HIS 54.A O no hydrogen 2.826 N/A GLY 59.A N LEU 56.A O no hydrogen 2.830 N/A GLU 60.A N ARG 55.A O no hydrogen 2.826 N/A SER 62.A N ASP 65.A OD2 no hydrogen 3.140 N/A ASP 65.A N SER 62.A OG no hydrogen 3.112 N/A ALA 66.A N SER 62.A O no hydrogen 2.850 N/A ALA 67.A N ALA 63.A O no hydrogen 2.986 N/A VAL 69.A N ASP 65.A O no hydrogen 3.243 N/A MET 70.A N ALA 66.A O no hydrogen 2.726 N/A THR 71.A N ALA 67.A O no hydrogen 2.912 N/A THR 71.A OG1 ALA 67.A O no hydrogen 2.656 N/A SER 72.A N VAL 68.A O no hydrogen 3.333 N/A ALA 73.A N VAL 69.A O no hydrogen 3.217 N/A GLN 74.A N MET 70.A O no hydrogen 3.116 N/A GLN 74.A N THR 71.A O no hydrogen 2.997 N/A ILE 75.A N THR 71.A O no hydrogen 3.262 N/A ILE 75.A N SER 72.A O no hydrogen 3.190 N/A THR 76.A N SER 72.A O no hydrogen 3.456 N/A THR 76.A OG1 SER 72.A O no hydrogen 3.519 N/A MET 77.A N ALA 73.A O no hydrogen 3.007 N/A GLY 78.A N GLN 74.A O no hydrogen 3.448 N/A TYR 81.A OH ASP 110.A O no hydrogen 2.961 N/A ALA 82.A N GLY 78.A O no hydrogen 2.845 N/A VAL 83.A N MET 79.A O no hydrogen 2.980 N/A THR 84.A N PRO 80.A O no hydrogen 3.152 N/A THR 84.A OG1 PRO 80.A O no hydrogen 2.887 N/A ASP 85.A N TYR 81.A O no hydrogen 3.119 N/A ALA 86.A N ALA 82.A O no hydrogen 3.116 N/A VAL 87.A N VAL 83.A O no hydrogen 2.851 N/A LEU 88.A N THR 84.A O no hydrogen 3.002 N/A ALA 89.A N ASP 85.A O no hydrogen 2.635 N/A HIS 91.A N LEU 88.A O no hydrogen 2.962 N/A GLY 93.A N HIS 282.A O no hydrogen 2.603 N/A ALA 96.A N GLN 280.A O no hydrogen 2.881 N/A SER 99.A N GLY 97.A O no hydrogen 2.691 N/A ALA 104.A N THR 3.A O no hydrogen 2.585 N/A LEU 105.A N THR 3.A O no hydrogen 3.441 N/A THR 106.A N ASP 26.A O no hydrogen 2.770 N/A LEU 107.A N LEU 5.A O no hydrogen 2.826 N/A ILE 108.A N VAL 28.A O no hydrogen 2.724 N/A PHE 109.A N VAL 7.A O no hydrogen 2.807 N/A ASP 110.A N VAL 30.A O no hydrogen 2.820 N/A ARG 111.A NE ASP 10.A OD1 no hydrogen 3.264 N/A ARG 111.A NH1 GLU 32.A OE2 no hydrogen 3.425 N/A ARG 111.A NH2 GLY 11.A O no hydrogen 2.579 N/A HIS 112.A N ASP 10.A OD2 no hydrogen 2.827 N/A ILE 114.A N HIS 112.A ND1 no hydrogen 3.096 N/A ALA 115.A N HIS 112.A O no hydrogen 2.968 N/A LEU 117.A N PRO 113.A O no hydrogen 3.165 N/A LEU 118.A N ILE 114.A O no hydrogen 2.715 N/A CYS 119.A N ILE 114.A O no hydrogen 3.074 N/A CYS 119.A SG ILE 114.A O no hydrogen 3.686 N/A TYR 120.A N ALA 115.A O no hydrogen 2.872 N/A ALA 122.A N LEU 118.A O no hydrogen 2.838 N/A ALA 123.A N CYS 119.A O no hydrogen 2.845 N/A ARG 124.A N TYR 120.A O no hydrogen 3.016 N/A ARG 124.A N PRO 121.A O no hydrogen 3.251 N/A ARG 124.A NH1 GLN 53.A OE1 no hydrogen 2.659 N/A TYR 125.A N PRO 121.A O no hydrogen 3.126 N/A LEU 126.A N ALA 122.A O no hydrogen 3.162 N/A MET 127.A N ARG 124.A O no hydrogen 3.071 N/A GLY 128.A N TYR 125.A O no hydrogen 2.903 N/A SER 129.A N ARG 124.A O no hydrogen 2.903 N/A SER 129.A OG GLN 53.A OE1 no hydrogen 2.912 N/A SER 129.A OG ARG 124.A O no hydrogen 3.181 N/A GLN 133.A N GLN 133.A OE1 no hydrogen 2.792 N/A ALA 134.A N THR 131.A OG1 no hydrogen 2.957 N/A VAL 135.A N THR 131.A O no hydrogen 2.994 N/A LEU 136.A N PRO 132.A O no hydrogen 2.939 N/A ALA 137.A N GLN 133.A O no hydrogen 3.039 N/A ALA 137.A N ALA 134.A O no hydrogen 2.876 N/A PHE 138.A N ALA 134.A O no hydrogen 3.137 N/A VAL 139.A N VAL 135.A O no hydrogen 3.068 N/A ALA 140.A N LEU 136.A O no hydrogen 3.104 N/A LEU 141.A N PHE 138.A O no hydrogen 3.068 N/A ILE 142.A N VAL 139.A O no hydrogen 2.864 N/A THR 145.A OG1 ARG 249.A O no hydrogen 2.617 N/A THR 149.A OG1 LEU 146.A O no hydrogen 2.788 N/A ASN 150.A ND2 ARG 6.A O no hydrogen 2.881 N/A ASN 150.A ND2 VAL 279.A O no hydrogen 3.237 N/A ILE 151.A N HIS 254.A O no hydrogen 2.681 N/A VAL 152.A N TYR 8.A O no hydrogen 3.024 N/A LEU 153.A N PHE 256.A O no hydrogen 2.624 N/A ALA 155.A N LEU 258.A O no hydrogen 2.862 N/A ARG 160.A NE ASP 261.A OD1 no hydrogen 3.267 N/A ARG 160.A NH2 ASP 261.A OD1 no hydrogen 2.964 N/A HIS 161.A N PRO 157.A O no hydrogen 2.894 N/A HIS 161.A NE2 HIS 13.A O no hydrogen 2.453 N/A ILE 162.A N GLU 158.A O no hydrogen 2.879 N/A ASP 163.A N ASP 159.A O no hydrogen 3.249 N/A ARG 164.A N ARG 160.A O no hydrogen 3.013 N/A ARG 164.A NH1 MET 15.A O no hydrogen 2.876 N/A ARG 164.A NH1 TYR 260.A O no hydrogen 2.658 N/A ARG 164.A NH2 TYR 260.A O no hydrogen 3.214 N/A ARG 164.A NH2 GLN 262.A O no hydrogen 3.120 N/A LEU 165.A N HIS 161.A O no hydrogen 2.695 N/A ALA 166.A N ILE 162.A O no hydrogen 2.927 N/A LYS 167.A N ARG 164.A O no hydrogen 2.439 N/A ARG 168.A N ARG 164.A O no hydrogen 3.148 N/A GLN 169.A N LYS 167.A O no hydrogen 2.693 N/A ARG 170.A N GLU 173.A OE1 no hydrogen 2.910 N/A GLU 173.A N ARG 170.A O no hydrogen 3.003 N/A ARG 174.A NH2 THR 51.A OG1 no hydrogen 3.106 N/A MET 179.A N ASP 176.A OD1 no hydrogen 2.840 N/A LEU 180.A N ASP 176.A O no hydrogen 2.980 N/A ALA 181.A N LEU 177.A O no hydrogen 2.854 N/A ALA 182.A N ALA 178.A O no hydrogen 2.627 N/A ILE 183.A N MET 179.A O no hydrogen 2.764 N/A ARG 184.A N LEU 180.A O no hydrogen 3.086 N/A ARG 184.A NE HIS 161.A ND1 no hydrogen 3.220 N/A ARG 185.A N ALA 181.A O no hydrogen 2.977 N/A VAL 186.A N ALA 182.A O no hydrogen 2.981 N/A TYR 187.A N ILE 183.A O no hydrogen 3.109 N/A TYR 187.A OH ASP 10.A OD1 no hydrogen 2.753 N/A GLY 188.A N ARG 184.A O no hydrogen 2.815 N/A LEU 189.A N ARG 185.A O no hydrogen 2.814 N/A LEU 190.A N VAL 186.A O no hydrogen 2.847 N/A ALA 191.A N TYR 187.A O no hydrogen 3.193 N/A ASN 192.A N GLY 188.A O no hydrogen 3.189 N/A ASN 192.A ND2 ASP 217.A O no hydrogen 2.897 N/A THR 193.A N LEU 189.A O no hydrogen 2.734 N/A THR 193.A OG1 LEU 189.A O no hydrogen 2.740 N/A VAL 194.A N LEU 190.A O no hydrogen 3.284 N/A ARG 195.A NH2 ASN 192.A OD1 no hydrogen 3.146 N/A TYR 196.A N ASN 192.A O no hydrogen 2.972 N/A TYR 196.A OH ASP 206.A OD2 no hydrogen 2.581 N/A LEU 197.A N THR 193.A O no hydrogen 2.796 N/A GLN 198.A N VAL 194.A O no hydrogen 2.754 N/A GLN 198.A NE2 ARG 251.A O no hydrogen 2.767 N/A GLN 198.A NE2 MET 253.A O no hydrogen 2.862 N/A CYS 199.A N ARG 195.A O no hydrogen 2.732 N/A CYS 199.A SG PRO 211.A O no hydrogen 3.940 N/A GLY 200.A N LEU 197.A O no hydrogen 3.161 N/A GLY 201.A N TYR 196.A O no hydrogen 2.809 N/A TRP 203.A NE1 ASP 244.A OD1 no hydrogen 3.063 N/A ARG 204.A NE ASP 244.A OD1 no hydrogen 2.939 N/A ARG 204.A NH2 ASP 244.A OD1 no hydrogen 3.163 N/A ARG 204.A NH2 ASP 244.A OD2 no hydrogen 2.708 N/A ASP 206.A N SER 202.A O no hydrogen 2.870 N/A GLN 209.A NE2 ASP 206.A O no hydrogen 3.629 N/A LEU 210.A N TRP 207.A O no hydrogen 3.360 N/A HIS 214.A N ASP 217.A OD2 no hydrogen 3.217 N/A GLY 216.A N HIS 214.A ND1 no hydrogen 3.109 N/A ASP 217.A N HIS 214.A O no hydrogen 2.647 N/A THR 218.A N ILE 215.A O no hydrogen 3.024 N/A THR 218.A OG1 ILE 215.A O no hydrogen 2.776 N/A LEU 219.A N THR 193.A OG1 no hydrogen 2.867 N/A THR 221.A N THR 218.A O no hydrogen 3.299 N/A THR 221.A OG1 ILE 215.A O no hydrogen 3.045 N/A THR 221.A OG1 THR 218.A O no hydrogen 2.657 N/A LEU 222.A N LEU 219.A O no hydrogen 3.030 N/A PHE 223.A N PHE 220.A O no hydrogen 3.158 N/A GLU 227.A N GLU 227.A OE1 no hydrogen 2.860 N/A LEU 228.A N ALA 225.A O no hydrogen 2.877 N/A ALA 230.A N ASP 234.A O no hydrogen 2.357 N/A GLY 233.A N ALA 230.A O no hydrogen 2.577 N/A TYR 236.A N LEU 228.A O no hydrogen 3.043 N/A ALA 240.A N TYR 236.A O no hydrogen 2.955 N/A TRP 241.A N ASN 237.A O no hydrogen 2.755 N/A ALA 242.A N VAL 238.A O no hydrogen 3.114 N/A ALA 242.A N PHE 239.A O no hydrogen 3.074 N/A LEU 243.A N PHE 239.A O no hydrogen 3.077 N/A ASP 244.A N ALA 240.A O no hydrogen 3.086 N/A VAL 245.A N TRP 241.A O no hydrogen 3.286 N/A LEU 246.A N ALA 242.A O no hydrogen 3.244 N/A ALA 247.A N LEU 243.A O no hydrogen 2.968 N/A LYS 248.A N ASP 244.A O no hydrogen 2.972 N/A ARG 249.A N VAL 245.A O no hydrogen 2.962 N/A ARG 249.A NH1 ILE 142.A O no hydrogen 2.914 N/A LEU 250.A N LEU 246.A O no hydrogen 3.233 N/A ARG 251.A N ALA 247.A O no hydrogen 3.221 N/A MET 253.A N LEU 250.A O no hydrogen 3.386 N/A HIS 254.A N THR 149.A O no hydrogen 2.950 N/A PHE 256.A N ILE 151.A O no hydrogen 2.666 N/A LEU 258.A N LEU 153.A O no hydrogen 3.049 N/A TYR 260.A N ALA 155.A O no hydrogen 2.500 N/A ASP 261.A N ASP 259.A OD1 no hydrogen 3.445 N/A GLN 262.A N TYR 260.A O no hydrogen 2.623 N/A GLN 262.A NE2 ASP 259.A O no hydrogen 2.810 N/A GLY 266.A N SER 263.A OG no hydrogen 3.242 N/A CYS 267.A N SER 263.A O no hydrogen 2.613 N/A CYS 267.A SG TYR 260.A O no hydrogen 3.661 N/A CYS 267.A SG GLN 262.A O no hydrogen 3.745 N/A CYS 267.A SG SER 263.A O no hydrogen 3.606 N/A ARG 268.A N PRO 264.A O no hydrogen 2.854 N/A ASP 269.A N ALA 265.A O no hydrogen 2.523 N/A ALA 270.A N GLY 266.A O no hydrogen 2.627 N/A LEU 271.A N CYS 267.A O no hydrogen 3.002 N/A LEU 272.A N ARG 268.A O no hydrogen 3.406 N/A GLN 273.A N ASP 269.A O no hydrogen 3.356 N/A LEU 274.A N ALA 270.A O no hydrogen 3.013 N/A THR 275.A N LEU 271.A O no hydrogen 3.402 N/A THR 275.A OG1 LEU 271.A O no hydrogen 3.270 N/A SER 276.A N GLN 273.A O no hydrogen 3.148 N/A SER 276.A OG GLN 273.A O no hydrogen 3.182 N/A GLY 277.A N LEU 274.A O no hydrogen 3.166 N/A MET 278.A N THR 275.A O no hydrogen 3.296 N/A VAL 279.A N ASN 150.A OD1 no hydrogen 2.931 N/A GLN 280.A NE2 PRO 101.A O no hydrogen 3.436 N/A THR 281.A N LEU 4.A O no hydrogen 2.835 N/A HIS 282.A N GLY 94.A O no hydrogen 3.116 N/A VAL 283.A N PRO 2.A O no hydrogen 2.872 N/A THR 285.A N SER 288.A OG no hydrogen 3.077 N/A THR 285.A OG1 SER 288.A OG no hydrogen 2.542 N/A SER 288.A N THR 285.A O no hydrogen 3.244 N/A SER 288.A OG THR 285.A O no hydrogen 3.459 N/A SER 288.A OG THR 285.A OG1 no hydrogen 2.542 N/A THR 291.A N GLY 287.A O no hydrogen 3.046 N/A THR 291.A OG1 GLY 287.A O no hydrogen 3.002 N/A ILE 292.A N SER 288.A O no hydrogen 2.889 N/A CYS 293.A N ILE 289.A O no hydrogen 3.002 N/A ASP 294.A N PRO 290.A O no hydrogen 3.101 N/A LEU 295.A N THR 291.A O no hydrogen 2.915 N/A ALA 296.A N ILE 292.A O no hydrogen 2.694 N/A ARG 297.A N CYS 293.A O no hydrogen 2.756 N/A THR 298.A N ASP 294.A O no hydrogen 2.734 N/A THR 298.A OG1 ASP 294.A O no hydrogen 2.742 N/A PHE 299.A N LEU 295.A O no hydrogen 2.950 N/A ALA 300.A N ALA 296.A O no hydrogen 3.383 N/A ARG 301.A N ARG 297.A O no hydrogen 3.086 N/A GLU 302.A N THR 298.A O no hydrogen 3.225 N/A MET 303.A N PHE 299.A O no hydrogen 2.927 N/A