Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4ke6_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLN 4.A N ASP 64.A OD1 no hydrogen 2.833 N/A GLN 4.A N ASP 64.A OD2 no hydrogen 3.078 N/A TYR 5.A N ASP 64.A OD2 no hydrogen 2.958 N/A TYR 5.A OH GLU 63.A OE1 no hydrogen 2.899 N/A LEU 8.A N GLY 59.A O no hydrogen 2.897 N/A GLY 10.A N GLU 12.A OE1 no hydrogen 3.111 N/A GLY 10.A N GLU 12.A OE2 no hydrogen 3.310 N/A ALA 11.A N LEU 8.A O no hydrogen 3.011 N/A GLU 12.A N GLU 12.A OE1 no hydrogen 2.830 N/A PHE 14.A N LEU 52.A O no hydrogen 2.859 N/A ALA 16.A N VAL 50.A O no hydrogen 2.855 N/A ASN 18.A N THR 49.A OG1 no hydrogen 2.934 N/A ASN 18.A ND2 TYR 48.A O no hydrogen 3.156 N/A GLY 19.A N GLY 47.A O no hydrogen 3.013 N/A GLY 22.A N THR 90.A O no hydrogen 2.789 N/A VAL 23.A N THR 49.A O no hydrogen 2.914 N/A LEU 24.A N PHE 92.A O no hydrogen 2.869 N/A LEU 25.A N CYS 51.A O no hydrogen 2.884 N/A VAL 26.A N THR 94.A O no hydrogen 2.902 N/A HIS 27.A ND1 GLY 28.A O no hydrogen 2.920 N/A THR 30.A N HIS 58.A NE2 no hydrogen 3.088 N/A THR 30.A OG1 PHE 29.A O no hydrogen 2.516 N/A GLY 31.A N GLY 28.A O no hydrogen 2.971 N/A THR 32.A OG1 LEU 155.A O no hydrogen 3.189 N/A HIS 34.A N THR 32.A OG1 no hydrogen 3.236 N/A SER 35.A N THR 32.A O no hydrogen 3.416 N/A SER 35.A OG THR 32.A O no hydrogen 3.243 N/A MET 36.A N PRO 33.A O no hydrogen 2.994 N/A ARG 37.A NH2 GLY 10.A O no hydrogen 3.245 N/A ARG 37.A NH2 GLU 12.A O no hydrogen 2.733 N/A ALA 40.A N MET 36.A O no hydrogen 3.077 N/A GLU 41.A N ARG 37.A O no hydrogen 2.882 N/A ALA 42.A N PRO 38.A O no hydrogen 3.140 N/A TYR 43.A N LEU 39.A O no hydrogen 2.955 N/A ALA 44.A N ALA 40.A O no hydrogen 2.804 N/A LYS 45.A N GLU 41.A O no hydrogen 2.701 N/A ALA 46.A N ALA 42.A O no hydrogen 3.066 N/A ALA 46.A N TYR 43.A O no hydrogen 3.218 N/A GLY 47.A N ALA 44.A O no hydrogen 2.940 N/A TYR 48.A N TYR 43.A O no hydrogen 3.095 N/A THR 49.A N VAL 21.A O no hydrogen 3.109 N/A THR 49.A OG1 GLY 19.A O no hydrogen 2.493 N/A VAL 50.A N ALA 16.A O no hydrogen 2.779 N/A CYS 51.A N VAL 23.A O no hydrogen 2.918 N/A CYS 51.A SG GLY 80.A O no hydrogen 3.758 N/A LEU 52.A N PHE 14.A O no hydrogen 2.734 N/A ARG 54.A NH1 GLU 3.A OE1 no hydrogen 3.246 N/A ARG 54.A NH1 GLU 3.A OE2 no hydrogen 2.528 N/A ARG 54.A NH1 HIS 58.A O no hydrogen 2.763 N/A ARG 54.A NH2 GLU 3.A OE1 no hydrogen 2.724 N/A LEU 55.A N HIS 27.A NE2 no hydrogen 3.098 N/A LYS 56.A N SER 76.A OG no hydrogen 2.904 N/A LYS 56.A NZ MET 1.A O no hydrogen 2.280 N/A GLY 57.A N GLU 3.A OE2 no hydrogen 2.758 N/A HIS 58.A N LEU 55.A O no hydrogen 3.028 N/A HIS 58.A ND1 LYS 56.A O no hydrogen 2.994 N/A THR 60.A N TYR 157.A OH no hydrogen 2.928 N/A THR 60.A OG1 ASP 64.A OD2 no hydrogen 2.982 N/A HIS 61.A N THR 60.A OG1 no hydrogen 2.692 N/A GLU 63.A N HIS 61.A ND1 no hydrogen 2.948 N/A ASP 64.A N HIS 61.A O no hydrogen 2.940 N/A MET 65.A N HIS 61.A O no hydrogen 3.204 N/A GLU 66.A N TYR 62.A O no hydrogen 2.734 N/A ARG 67.A N GLU 63.A O no hydrogen 3.311 N/A ARG 67.A N ASP 64.A O no hydrogen 3.147 N/A ARG 67.A NH2 ASP 64.A OD1 no hydrogen 2.645 N/A THR 68.A N MET 65.A O no hydrogen 3.008 N/A THR 68.A OG1 MET 65.A O no hydrogen 2.591 N/A THR 69.A N ASP 72.A OD2 no hydrogen 2.882 N/A PHE 70.A N GLN 167.A OE1 no hydrogen 3.209 N/A ASP 72.A N THR 69.A O no hydrogen 2.967 N/A TRP 73.A NE1 THR 68.A OG1 no hydrogen 3.077 N/A VAL 74.A N PHE 70.A O no hydrogen 2.943 N/A ALA 75.A N HIS 71.A O no hydrogen 2.937 N/A SER 76.A N ASP 72.A O no hydrogen 2.968 N/A SER 76.A OG ASP 72.A O no hydrogen 3.360 N/A VAL 77.A N TRP 73.A O no hydrogen 3.178 N/A GLU 78.A N VAL 74.A O no hydrogen 2.970 N/A GLU 79.A N ALA 75.A O no hydrogen 2.999 N/A GLY 80.A N SER 76.A O no hydrogen 3.398 N/A TYR 81.A N VAL 77.A O no hydrogen 2.774 N/A TYR 81.A OH ASP 112.A OD1 no hydrogen 2.755 N/A TYR 81.A OH ASP 112.A OD2 no hydrogen 3.144 N/A GLY 82.A N GLU 78.A O no hydrogen 2.682 N/A TRP 83.A N GLU 79.A O no hydrogen 2.799 N/A LEU 84.A N GLY 80.A O no hydrogen 3.053 N/A LYS 85.A N TYR 81.A O no hydrogen 2.968 N/A LYS 85.A NZ ASP 112.A OD2 no hydrogen 3.181 N/A GLN 86.A N GLY 82.A O no hydrogen 3.324 N/A ARG 87.A N LEU 84.A O no hydrogen 2.840 N/A ARG 87.A NE GLU 17.A OE2 no hydrogen 2.779 N/A ARG 87.A NH1 TRP 83.A O no hydrogen 2.799 N/A ARG 87.A NH1 GLN 86.A OE1 no hydrogen 3.540 N/A CYS 88.A N LEU 84.A O no hydrogen 2.705 N/A GLN 89.A N PRO 20.A O no hydrogen 2.855 N/A THR 90.A N PRO 20.A O no hydrogen 3.449 N/A PHE 92.A N GLY 22.A O no hydrogen 2.853 N/A VAL 93.A N GLY 115.A O no hydrogen 3.052 N/A THR 94.A N LEU 24.A O no hydrogen 2.841 N/A THR 94.A OG1 VAL 117.A O no hydrogen 2.676 N/A GLY 95.A N VAL 117.A O no hydrogen 3.410 N/A LEU 96.A N VAL 26.A O no hydrogen 3.054 N/A SER 97.A N ILE 119.A O no hydrogen 2.832 N/A SER 97.A OG HIS 224.A NE2 no hydrogen 2.846 N/A GLY 99.A N LEU 96.A O no hydrogen 2.668 N/A THR 101.A N SER 97.A O no hydrogen 2.838 N/A THR 101.A OG1 SER 97.A O no hydrogen 3.202 N/A THR 101.A OG1 ALA 122.A O no hydrogen 2.661 N/A LEU 102.A N MET 98.A O no hydrogen 2.648 N/A THR 103.A N GLY 99.A O no hydrogen 2.708 N/A THR 103.A OG1 GLY 99.A O no hydrogen 2.838 N/A LEU 104.A N GLY 100.A O no hydrogen 2.884 N/A TYR 105.A N THR 101.A O no hydrogen 2.994 N/A LEU 106.A N LEU 102.A O no hydrogen 2.985 N/A ALA 107.A N THR 103.A O no hydrogen 3.205 N/A GLU 108.A N LEU 104.A O no hydrogen 2.977 N/A GLU 108.A N TYR 105.A O no hydrogen 3.069 N/A HIS 109.A N LEU 106.A O no hydrogen 3.026 N/A HIS 109.A ND1 TYR 105.A O no hydrogen 2.760 N/A HIS 110.A NE2 GLU 78.A OE1 no hydrogen 3.197 N/A CYS 114.A N ILE 91.A O no hydrogen 2.808 N/A CYS 114.A SG HIS 246.A O no hydrogen 3.126 N/A ILE 116.A N PRO 185.A O no hydrogen 3.156 N/A VAL 117.A N VAL 93.A O no hydrogen 2.826 N/A ILE 119.A N GLY 95.A O no hydrogen 2.907 N/A ASN 120.A N PHE 189.A O no hydrogen 2.976 N/A ASN 120.A ND2 SER 191.A OG no hydrogen 3.069 N/A ASN 120.A ND2 HIS 224.A O no hydrogen 2.972 N/A ALA 122.A N THR 101.A OG1 no hydrogen 3.078 N/A VAL 123.A N ASN 201.A OD1 no hydrogen 2.935 N/A ASP 124.A N ASN 201.A OD1 no hydrogen 2.930 N/A ILE 128.A N ILE 125.A O no hydrogen 2.889 N/A ALA 129.A N ILE 125.A O no hydrogen 3.432 N/A ARG 138.A NE GLU 66.A OE1 no hydrogen 3.499 N/A ARG 138.A NE GLU 66.A OE2 no hydrogen 2.873 N/A ARG 138.A NH2 GLU 66.A OE1 no hydrogen 2.990 N/A TYR 139.A OH GLU 66.A OE1 no hydrogen 2.650 N/A LEU 140.A N THR 160.A O no hydrogen 2.714 N/A SER 142.A N GLU 158.A O no hydrogen 2.883 N/A SER 142.A OG TYR 157.A O no hydrogen 3.161 N/A SER 145.A OG GLU 154.A OE2 no hydrogen 2.968 N/A LYS 148.A N ASP 229.A OD2 no hydrogen 2.739 N/A LYS 148.A NZ GLU 193.A OE2 no hydrogen 3.380 N/A ASN 149.A N ASP 229.A OD1 no hydrogen 2.891 N/A ASP 151.A N ASN 149.A OD1 no hydrogen 2.955 N/A LEU 155.A N HIS 34.A ND1 no hydrogen 3.492 N/A TYR 157.A N THR 30.A O no hydrogen 3.082 N/A TYR 157.A OH GLY 57.A O no hydrogen 2.578 N/A THR 160.A N LEU 140.A O no hydrogen 2.847 N/A THR 162.A N ARG 138.A O no hydrogen 2.958 N/A THR 162.A OG1 PRO 137.A O no hydrogen 3.127 N/A THR 162.A OG1 ARG 138.A O no hydrogen 3.490 N/A SER 164.A N PRO 161.A O no hydrogen 3.008 N/A SER 164.A OG MET 65.A O no hydrogen 3.465 N/A LEU 165.A N THR 162.A O no hydrogen 3.153 N/A LEU 168.A N SER 164.A O no hydrogen 2.818 N/A ALA 169.A N LEU 165.A O no hydrogen 2.910 N/A ARG 170.A N LEU 166.A O no hydrogen 3.187 N/A LEU 171.A N GLN 167.A O no hydrogen 3.170 N/A MET 172.A N LEU 168.A O no hydrogen 2.953 N/A ALA 173.A N ALA 169.A O no hydrogen 2.786 N/A GLN 174.A N ARG 170.A O no hydrogen 3.000 N/A THR 175.A N LEU 171.A O no hydrogen 2.970 N/A THR 175.A OG1 LEU 171.A O no hydrogen 2.733 N/A LYS 176.A N MET 172.A O no hydrogen 2.882 N/A ALA 177.A N ALA 173.A O no hydrogen 3.011 N/A LYS 178.A N THR 175.A O no hydrogen 3.360 N/A LEU 179.A N LYS 176.A O no hydrogen 3.389 N/A ARG 181.A N LYS 178.A O no hydrogen 3.079 N/A ILE 182.A N LEU 179.A O no hydrogen 3.075 N/A CYS 184.A SG PRO 185.A O no hydrogen 3.708 N/A ALA 186.A N GLU 213.A O no hydrogen 2.853 N/A LEU 187.A N ILE 116.A O no hydrogen 3.006 N/A ILE 188.A N GLU 215.A O no hydrogen 2.792 N/A PHE 189.A N PRO 118.A O no hydrogen 3.101 N/A VAL 190.A N VAL 217.A O no hydrogen 3.222 N/A SER 191.A N ASN 120.A OD1 no hydrogen 2.979 N/A SER 191.A OG SER 222.A O no hydrogen 3.556 N/A SER 191.A OG TYR 223.A O no hydrogen 2.730 N/A ASP 192.A N LEU 219.A O no hydrogen 2.949 N/A ASN 194.A ND2 VAL 197.A O no hydrogen 2.179 N/A HIS 195.A N ASP 146.A OD2 no hydrogen 3.014 N/A HIS 195.A ND1 ASP 146.A OD1 no hydrogen 2.718 N/A ASN 201.A N PRO 198.A O no hydrogen 3.070 N/A ASN 201.A ND2 ASP 124.A O no hydrogen 3.022 N/A ILE 204.A N GLY 200.A O no hydrogen 3.358 N/A ILE 205.A N ASN 201.A O no hydrogen 3.057 N/A PHE 206.A N ALA 202.A O no hydrogen 2.773 N/A GLN 207.A N ASP 203.A O no hydrogen 2.871 N/A GLY 208.A N ILE 204.A O no hydrogen 2.742 N/A ILE 209.A N ILE 205.A O no hydrogen 3.192 N/A SER 210.A N ILE 182.A O no hydrogen 2.982 N/A SER 210.A OG ASP 180.A O no hydrogen 2.733 N/A SER 211.A OG ILE 182.A O no hydrogen 3.558 N/A SER 211.A OG CYS 184.A O no hydrogen 2.508 N/A LYS 214.A NZ PHE 206.A O no hydrogen 3.009 N/A GLU 215.A N ALA 186.A O no hydrogen 2.978 N/A VAL 217.A N ILE 188.A O no hydrogen 2.980 N/A ARG 218.A NH1 ASP 192.A OD1 no hydrogen 2.739 N/A LEU 219.A N VAL 190.A O no hydrogen 2.851 N/A ASN 221.A N ASP 231.A OD2 no hydrogen 2.796 N/A SER 222.A OG ASP 231.A OD2 no hydrogen 2.963 N/A TYR 223.A N ASP 229.A OD2 no hydrogen 3.037 N/A HIS 224.A N ASP 146.A OD2 no hydrogen 3.056 N/A HIS 224.A NE2 SER 97.A OG no hydrogen 2.846 N/A VAL 225.A N ASP 146.A O no hydrogen 3.070 N/A ALA 226.A N HIS 224.A O no hydrogen 2.747 N/A THR 227.A OG1 SER 35.A O no hydrogen 2.757 N/A LEU 228.A N VAL 225.A O no hydrogen 3.271 N/A ASP 229.A N ALA 226.A O no hydrogen 3.133 N/A TYR 230.A N ASP 229.A OD1 no hydrogen 2.972 N/A ASP 231.A N SER 222.A OG no hydrogen 3.142 N/A GLN 232.A N ASP 229.A O no hydrogen 3.084 N/A GLN 232.A NE2 THR 227.A O no hydrogen 2.735 N/A ILE 235.A N ASP 231.A O no hydrogen 3.056 N/A ILE 236.A N GLN 232.A O no hydrogen 2.919 N/A GLU 237.A N PRO 233.A O no hydrogen 2.947 N/A ARG 238.A N MET 234.A O no hydrogen 2.825 N/A SER 239.A N ILE 235.A O no hydrogen 3.170 N/A SER 239.A OG TYR 43.A OH no hydrogen 3.291 N/A SER 239.A OG ILE 235.A O no hydrogen 2.612 N/A LEU 240.A N ILE 236.A O no hydrogen 3.258 N/A GLU 241.A N GLU 237.A O no hydrogen 3.295 N/A PHE 242.A N ARG 238.A O no hydrogen 3.206 N/A PHE 243.A N SER 239.A O no hydrogen 2.967 N/A ALA 244.A N LEU 240.A O no hydrogen 3.086 N/A LYS 245.A N GLU 241.A O no hydrogen 2.973 N/A HIS 246.A N PHE 242.A O no hydrogen 3.163 N/A HIS 246.A ND1 PHE 242.A O no hydrogen 3.039 N/A HIS 246.A NE2 GLU 213.A OE1 no hydrogen 3.289 N/A ALA 247.A N PHE 243.A O no hydrogen 2.942 N/A