Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4ke9_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLN 2.A N ASP 62.A OD1 no hydrogen 3.208 N/A TYR 3.A N ASP 62.A OD2 no hydrogen 3.153 N/A TYR 3.A OH GLU 61.A OE2 no hydrogen 3.388 N/A LEU 6.A N GLY 57.A O no hydrogen 2.680 N/A GLY 8.A N GLU 10.A OE1 no hydrogen 3.029 N/A ALA 9.A N LEU 6.A O no hydrogen 3.021 N/A GLU 10.A N GLU 10.A OE1 no hydrogen 2.832 N/A PHE 12.A N LEU 50.A O no hydrogen 2.742 N/A ALA 14.A N VAL 48.A O no hydrogen 3.033 N/A ASN 16.A N THR 47.A OG1 no hydrogen 2.816 N/A ASN 16.A ND2 TYR 46.A O no hydrogen 3.101 N/A GLY 17.A N GLY 45.A O no hydrogen 2.844 N/A GLY 20.A N THR 88.A O no hydrogen 2.783 N/A VAL 21.A N THR 47.A O no hydrogen 2.728 N/A LEU 22.A N PHE 90.A O no hydrogen 2.756 N/A LEU 23.A N CYS 49.A O no hydrogen 2.972 N/A VAL 24.A N THR 92.A O no hydrogen 2.857 N/A HIS 25.A ND1 GLY 26.A O no hydrogen 2.988 N/A THR 28.A N HIS 56.A NE2 no hydrogen 3.081 N/A THR 28.A OG1 PHE 27.A O no hydrogen 2.413 N/A GLY 29.A N GLY 26.A O no hydrogen 3.032 N/A THR 30.A OG1 LEU 155.A O no hydrogen 3.219 N/A HIS 32.A N THR 30.A OG1 no hydrogen 3.355 N/A SER 33.A N THR 30.A O no hydrogen 3.277 N/A SER 33.A OG THR 30.A O no hydrogen 3.212 N/A MET 34.A N PRO 31.A O no hydrogen 2.994 N/A ALA 38.A N MET 34.A O no hydrogen 2.997 N/A GLU 39.A N ARG 35.A O no hydrogen 3.005 N/A ALA 40.A N PRO 36.A O no hydrogen 3.161 N/A TYR 41.A N LEU 37.A O no hydrogen 2.898 N/A ALA 42.A N ALA 38.A O no hydrogen 2.875 N/A LYS 43.A N GLU 39.A O no hydrogen 2.885 N/A ALA 44.A N ALA 40.A O no hydrogen 3.284 N/A GLY 45.A N ALA 42.A O no hydrogen 3.157 N/A TYR 46.A N TYR 41.A O no hydrogen 3.041 N/A THR 47.A N VAL 19.A O no hydrogen 2.921 N/A THR 47.A OG1 GLY 17.A O no hydrogen 2.641 N/A VAL 48.A N ALA 14.A O no hydrogen 3.014 N/A CYS 49.A N VAL 21.A O no hydrogen 2.989 N/A CYS 49.A SG GLY 78.A O no hydrogen 3.742 N/A LEU 50.A N PHE 12.A O no hydrogen 2.712 N/A ARG 52.A NH1 GLU 1.A OE1 no hydrogen 3.391 N/A ARG 52.A NH1 GLU 1.A OE2 no hydrogen 2.698 N/A ARG 52.A NH1 HIS 56.A O no hydrogen 2.806 N/A LEU 53.A N HIS 25.A NE2 no hydrogen 3.018 N/A LYS 54.A N SER 74.A OG no hydrogen 3.015 N/A LYS 54.A NZ ASP 70.A OD1 no hydrogen 3.085 N/A HIS 56.A N LEU 53.A O no hydrogen 2.990 N/A HIS 56.A ND1 LYS 54.A O no hydrogen 3.121 N/A THR 58.A N TYR 157.A OH no hydrogen 2.803 N/A THR 58.A OG1 GLU 1.A OE2 no hydrogen 3.170 N/A THR 58.A OG1 ASP 62.A OD2 no hydrogen 3.005 N/A THR 58.A OG1 TYR 157.A OH no hydrogen 3.243 N/A HIS 59.A N THR 58.A OG1 no hydrogen 2.574 N/A GLU 61.A N HIS 59.A ND1 no hydrogen 3.137 N/A ASP 62.A N HIS 59.A O no hydrogen 2.901 N/A MET 63.A N HIS 59.A O no hydrogen 3.404 N/A GLU 64.A N TYR 60.A O no hydrogen 3.187 N/A ARG 65.A NH2 ASP 62.A OD1 no hydrogen 2.927 N/A THR 66.A N MET 63.A O no hydrogen 2.953 N/A THR 66.A OG1 MET 63.A O no hydrogen 2.610 N/A THR 67.A N ASP 70.A OD2 no hydrogen 2.834 N/A THR 67.A OG1 ASP 70.A OD2 no hydrogen 3.485 N/A PHE 68.A N GLN 167.A OE1 no hydrogen 2.825 N/A ASP 70.A N THR 67.A O no hydrogen 3.205 N/A TRP 71.A NE1 THR 66.A OG1 no hydrogen 3.009 N/A VAL 72.A N PHE 68.A O no hydrogen 2.795 N/A ALA 73.A N HIS 69.A O no hydrogen 2.949 N/A SER 74.A N ASP 70.A O no hydrogen 2.915 N/A SER 74.A OG ASP 70.A O no hydrogen 3.126 N/A VAL 75.A N TRP 71.A O no hydrogen 3.192 N/A GLU 76.A N VAL 72.A O no hydrogen 2.643 N/A GLU 77.A N ALA 73.A O no hydrogen 2.981 N/A GLY 78.A N SER 74.A O no hydrogen 3.376 N/A TYR 79.A N VAL 75.A O no hydrogen 2.833 N/A GLY 80.A N GLU 76.A O no hydrogen 2.935 N/A TRP 81.A N GLU 77.A O no hydrogen 2.949 N/A LEU 82.A N GLY 78.A O no hydrogen 3.097 N/A LYS 83.A N TYR 79.A O no hydrogen 2.864 N/A ARG 85.A N LEU 82.A O no hydrogen 3.297 N/A ARG 85.A NE TRP 81.A O no hydrogen 2.992 N/A ARG 85.A NH1 GLU 15.A OE2 no hydrogen 2.974 N/A GLN 87.A N PRO 18.A O no hydrogen 3.189 N/A PHE 90.A N GLY 20.A O no hydrogen 2.748 N/A VAL 91.A N GLY 113.A O no hydrogen 3.132 N/A THR 92.A N LEU 22.A O no hydrogen 2.733 N/A THR 92.A OG1 VAL 115.A O no hydrogen 2.568 N/A GLY 93.A N VAL 115.A O no hydrogen 3.339 N/A LEU 94.A N VAL 24.A O no hydrogen 3.151 N/A SER 95.A N ILE 117.A O no hydrogen 2.937 N/A SER 95.A OG HIS 224.A NE2 no hydrogen 3.010 N/A GLY 97.A N LEU 94.A O no hydrogen 2.703 N/A THR 99.A N SER 95.A O no hydrogen 3.014 N/A THR 99.A OG1 SER 95.A O no hydrogen 3.299 N/A THR 99.A OG1 ALA 120.A O no hydrogen 2.420 N/A LEU 100.A N MET 96.A O no hydrogen 2.735 N/A THR 101.A N GLY 97.A O no hydrogen 2.891 N/A THR 101.A OG1 GLY 97.A O no hydrogen 2.693 N/A LEU 102.A N GLY 98.A O no hydrogen 3.074 N/A TYR 103.A N THR 99.A O no hydrogen 2.889 N/A LEU 104.A N LEU 100.A O no hydrogen 3.044 N/A ALA 105.A N THR 101.A O no hydrogen 3.228 N/A GLU 106.A N LEU 102.A O no hydrogen 3.106 N/A GLU 106.A N TYR 103.A O no hydrogen 3.231 N/A HIS 107.A N LEU 104.A O no hydrogen 2.922 N/A HIS 107.A ND1 TYR 103.A O no hydrogen 2.865 N/A HIS 108.A N LEU 104.A O no hydrogen 2.849 N/A HIS 108.A NE2 GLU 76.A OE1 no hydrogen 3.098 N/A ILE 111.A N HIS 108.A O no hydrogen 3.350 N/A CYS 112.A N ILE 89.A O no hydrogen 2.954 N/A CYS 112.A SG HIS 246.A O no hydrogen 3.142 N/A ILE 114.A N PRO 185.A O no hydrogen 2.932 N/A VAL 115.A N VAL 91.A O no hydrogen 2.815 N/A ILE 117.A N GLY 93.A O no hydrogen 2.725 N/A ASN 118.A N PHE 189.A O no hydrogen 2.866 N/A ASN 118.A ND2 SER 191.A OG no hydrogen 3.179 N/A ASN 118.A ND2 HIS 224.A O no hydrogen 2.797 N/A ALA 120.A N SER 95.A O no hydrogen 3.366 N/A VAL 121.A N ASN 201.A OD1 no hydrogen 3.047 N/A ASP 122.A N ASN 201.A OD1 no hydrogen 2.819 N/A ILE 126.A N ILE 123.A O no hydrogen 3.140 N/A ALA 128.A N PRO 124.A O no hydrogen 3.050 N/A GLY 129.A N ALA 125.A O no hydrogen 3.116 N/A GLY 129.A N ILE 126.A O no hydrogen 3.171 N/A THR 131.A OG1 ALA 127.A O no hydrogen 3.092 N/A THR 131.A OG1 ALA 128.A O no hydrogen 3.367 N/A ARG 138.A NE GLU 64.A OE2 no hydrogen 2.773 N/A TYR 139.A OH GLU 64.A OE1 no hydrogen 2.435 N/A LEU 140.A N THR 160.A O no hydrogen 2.828 N/A SER 142.A N GLU 158.A O no hydrogen 3.069 N/A SER 142.A OG TYR 157.A O no hydrogen 2.988 N/A SER 142.A OG THR 160.A OG1 no hydrogen 2.778 N/A LYS 148.A N ASP 229.A OD1 no hydrogen 3.073 N/A LYS 148.A N ASP 229.A OD2 no hydrogen 3.130 N/A LYS 148.A NZ ASN 221.A OD1 no hydrogen 3.300 N/A ASN 149.A N ASP 229.A OD1 no hydrogen 2.980 N/A ASP 151.A N ASN 149.A OD1 no hydrogen 2.893 N/A TYR 157.A N THR 28.A O no hydrogen 3.324 N/A TYR 157.A OH GLY 55.A O no hydrogen 2.713 N/A TYR 157.A OH THR 58.A OG1 no hydrogen 3.243 N/A THR 160.A N LEU 140.A O no hydrogen 2.643 N/A THR 160.A OG1 SER 142.A OG no hydrogen 2.778 N/A THR 162.A N ARG 138.A O no hydrogen 2.911 N/A THR 162.A OG1 PRO 137.A O no hydrogen 2.508 N/A THR 162.A OG1 ARG 138.A O no hydrogen 3.393 N/A SER 164.A N PRO 161.A O no hydrogen 3.093 N/A SER 164.A OG MET 63.A O no hydrogen 3.392 N/A LEU 165.A N PRO 161.A O no hydrogen 3.215 N/A LEU 166.A N THR 162.A O no hydrogen 3.123 N/A GLN 167.A N ALA 163.A O no hydrogen 3.129 N/A LEU 168.A N SER 164.A O no hydrogen 2.892 N/A ALA 169.A N LEU 165.A O no hydrogen 3.020 N/A ARG 170.A N LEU 166.A O no hydrogen 3.159 N/A LEU 171.A N GLN 167.A O no hydrogen 3.102 N/A MET 172.A N LEU 168.A O no hydrogen 2.952 N/A ALA 173.A N ALA 169.A O no hydrogen 2.965 N/A GLN 174.A N ARG 170.A O no hydrogen 3.107 N/A THR 175.A N LEU 171.A O no hydrogen 2.912 N/A THR 175.A OG1 LEU 171.A O no hydrogen 2.680 N/A LYS 176.A N MET 172.A O no hydrogen 2.884 N/A ALA 177.A N ALA 173.A O no hydrogen 3.202 N/A LYS 178.A N THR 175.A O no hydrogen 3.257 N/A ARG 181.A N LYS 178.A O no hydrogen 3.224 N/A ILE 182.A N LEU 179.A O no hydrogen 3.181 N/A CYS 184.A SG PRO 185.A O no hydrogen 3.722 N/A ALA 186.A N GLU 213.A O no hydrogen 2.981 N/A LEU 187.A N ILE 114.A O no hydrogen 2.844 N/A ILE 188.A N GLU 215.A O no hydrogen 2.836 N/A PHE 189.A N PRO 116.A O no hydrogen 2.967 N/A VAL 190.A N VAL 217.A O no hydrogen 3.141 N/A SER 191.A N ASN 118.A OD1 no hydrogen 2.767 N/A SER 191.A OG SER 222.A O no hydrogen 3.294 N/A SER 191.A OG TYR 223.A O no hydrogen 2.567 N/A ASP 192.A N LEU 219.A O no hydrogen 3.038 N/A HIS 195.A N ASP 146.A OD2 no hydrogen 2.779 N/A HIS 195.A ND1 ASP 146.A OD1 no hydrogen 2.582 N/A VAL 196.A N ASP 194.A OD1 no hydrogen 2.858 N/A VAL 197.A N ASP 194.A OD1 no hydrogen 2.838 N/A ASN 201.A N PRO 198.A O no hydrogen 2.957 N/A ASN 201.A ND2 ASP 122.A O no hydrogen 3.225 N/A ASN 201.A ND2 PRO 198.A O no hydrogen 2.569 N/A ALA 202.A N PRO 199.A O no hydrogen 3.378 N/A ILE 204.A N GLY 200.A O no hydrogen 3.181 N/A ILE 205.A N ASN 201.A O no hydrogen 2.990 N/A PHE 206.A N ALA 202.A O no hydrogen 2.870 N/A GLN 207.A N ASP 203.A O no hydrogen 2.952 N/A GLN 207.A NE2 ASP 203.A O no hydrogen 3.682 N/A GLY 208.A N ILE 204.A O no hydrogen 2.934 N/A ILE 209.A N ILE 205.A O no hydrogen 3.168 N/A SER 210.A N ILE 182.A O no hydrogen 2.849 N/A SER 210.A OG ASP 180.A O no hydrogen 2.590 N/A SER 211.A OG ILE 182.A O no hydrogen 3.311 N/A SER 211.A OG CYS 184.A O no hydrogen 2.495 N/A LYS 214.A NZ PHE 206.A O no hydrogen 2.666 N/A LYS 214.A NZ ILE 209.A O no hydrogen 3.496 N/A GLU 215.A N ALA 186.A O no hydrogen 3.156 N/A VAL 217.A N ILE 188.A O no hydrogen 2.729 N/A LEU 219.A N VAL 190.A O no hydrogen 2.812 N/A ASN 221.A N ASP 231.A OD2 no hydrogen 3.213 N/A SER 222.A OG ASP 231.A OD2 no hydrogen 2.834 N/A TYR 223.A N ASP 229.A OD2 no hydrogen 2.563 N/A HIS 224.A N ASP 146.A OD2 no hydrogen 3.060 N/A HIS 224.A ND1 ASP 194.A OD2 no hydrogen 2.631 N/A HIS 224.A NE2 SER 95.A OG no hydrogen 3.010 N/A VAL 225.A N ASP 146.A O no hydrogen 3.191 N/A ALA 226.A N HIS 224.A O no hydrogen 2.773 N/A THR 227.A OG1 SER 33.A O no hydrogen 2.868 N/A LEU 228.A N VAL 225.A O no hydrogen 3.148 N/A ASP 229.A N ALA 226.A O no hydrogen 2.922 N/A ASP 231.A N SER 222.A OG no hydrogen 2.972 N/A GLN 232.A N ASP 229.A O no hydrogen 3.119 N/A GLN 232.A NE2 THR 227.A O no hydrogen 2.699 N/A ILE 235.A N ASP 231.A O no hydrogen 2.976 N/A ILE 236.A N GLN 232.A O no hydrogen 3.050 N/A GLU 237.A N PRO 233.A O no hydrogen 2.974 N/A ARG 238.A N MET 234.A O no hydrogen 2.880 N/A ARG 238.A NH2 GLU 215.A OE2 no hydrogen 2.764 N/A SER 239.A N ILE 235.A O no hydrogen 3.020 N/A SER 239.A OG TYR 41.A OH no hydrogen 3.196 N/A SER 239.A OG ILE 235.A O no hydrogen 2.745 N/A LEU 240.A N ILE 236.A O no hydrogen 3.119 N/A GLU 241.A N GLU 237.A O no hydrogen 3.194 N/A PHE 242.A N ARG 238.A O no hydrogen 2.853 N/A PHE 243.A N SER 239.A O no hydrogen 2.687 N/A ALA 244.A N LEU 240.A O no hydrogen 2.944 N/A LYS 245.A N GLU 241.A O no hydrogen 3.232 N/A HIS 246.A N PHE 243.A O no hydrogen 3.242 N/A ALA 247.A N PHE 243.A O no hydrogen 2.891 N/A