Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3kot_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLN 1.A NE2 PRO 29.A O no hydrogen 3.452 N/A GLU 2.A N HIS 30.A O no hydrogen 3.025 N/A LEU 4.A N ASP 32.A O no hydrogen 2.875 N/A LYS 5.A N ASP 50.A OD2 no hydrogen 2.861 N/A LYS 5.A NZ GLU 47.A O no hydrogen 2.982 N/A ILE 6.A N HIS 34.A O no hydrogen 3.071 N/A GLY 7.A N TYR 51.A O no hydrogen 3.062 N/A VAL 8.A N SER 36.A O no hydrogen 2.705 N/A VAL 9.A N ILE 53.A O no hydrogen 2.922 N/A GLY 10.A N HIS 38.A O no hydrogen 2.972 N/A ALA 13.A N VAL 9.A O no hydrogen 2.969 N/A ILE 14.A N GLY 10.A O no hydrogen 3.012 N/A GLY 15.A N VAL 11.A O no hydrogen 3.022 N/A CYS 16.A N PHE 12.A O no hydrogen 2.877 N/A LEU 17.A N PHE 12.A O no hydrogen 2.935 N/A PHE 18.A N ALA 13.A O no hydrogen 2.815 N/A LEU 20.A N LEU 17.A O no hydrogen 2.960 N/A LEU 21.A N PHE 18.A O no hydrogen 3.210 N/A ASP 23.A N LEU 20.A O no hydrogen 2.987 N/A PHE 24.A N LEU 20.A O no hydrogen 3.278 N/A LYS 25.A N LEU 21.A O no hydrogen 3.027 N/A ARG 26.A N SER 22.A O no hydrogen 2.920 N/A SER 27.A N ASP 23.A O no hydrogen 3.114 N/A SER 27.A OG ASP 23.A O no hydrogen 3.473 N/A TYR 28.A N PHE 24.A O no hydrogen 2.825 N/A HIS 30.A NE2 GLU 188.A OE1 no hydrogen 2.833 N/A ILE 31.A N TYR 28.A O no hydrogen 3.226 N/A ASP 32.A N GLU 2.A O no hydrogen 2.796 N/A HIS 34.A N LEU 4.A O no hydrogen 2.663 N/A HIS 34.A NE2 ASP 32.A OD2 no hydrogen 2.839 N/A SER 36.A N ILE 6.A O no hydrogen 3.000 N/A SER 36.A OG ILE 6.A O no hydrogen 3.547 N/A HIS 38.A N VAL 8.A O no hydrogen 3.020 N/A HIS 38.A NE2 GLY 7.A O no hydrogen 3.106 N/A ASN 39.A ND2 ASP 127.A OD2 no hydrogen 2.852 N/A ASN 40.A N HIS 38.A ND1 no hydrogen 2.968 N/A ASN 40.A ND2 TYR 55.A O no hydrogen 2.985 N/A ARG 41.A N ASN 39.A OD1 no hydrogen 3.272 N/A ARG 41.A NH1 ASP 127.A O no hydrogen 3.107 N/A ALA 46.A N ASP 43.A OD1 no hydrogen 3.320 N/A GLU 47.A N ASP 43.A O no hydrogen 3.096 N/A GLY 48.A N ALA 45.A O no hydrogen 3.089 N/A LEU 49.A N PRO 44.A O no hydrogen 2.851 N/A ASP 50.A N LYS 5.A O no hydrogen 2.941 N/A TYR 51.A N LYS 5.A O no hydrogen 3.401 N/A TYR 51.A OH MET 186.A O no hydrogen 3.374 N/A TYR 51.A OH SER 190.A OG no hydrogen 2.548 N/A THR 52.A N THR 175.A O no hydrogen 2.979 N/A ILE 53.A N GLY 7.A O no hydrogen 2.853 N/A ARG 54.A N TRP 173.A O no hydrogen 2.912 N/A ARG 54.A NH1 THR 175.A OG1 no hydrogen 3.141 N/A TYR 55.A N ASN 40.A OD1 no hydrogen 2.720 N/A GLY 56.A N SER 171.A O no hydrogen 2.958 N/A THR 63.A OG1 HIS 61.A O no hydrogen 3.317 N/A ASP 64.A N ARG 176.A O no hydrogen 2.859 N/A GLN 66.A N ILE 174.A O no hydrogen 2.802 N/A LEU 68.A N PHE 172.A O no hydrogen 2.817 N/A CYS 69.A N PHE 172.A O no hydrogen 3.340 N/A CYS 69.A SG SER 70.A O no hydrogen 3.821 N/A MET 73.A N ILE 167.A O no hydrogen 2.850 N/A SER 74.A N ALA 145.A O no hydrogen 3.430 N/A SER 74.A OG PHE 163.A O no hydrogen 3.190 N/A SER 74.A OG THR 165.A O no hydrogen 2.731 N/A LEU 76.A N ALA 143.A O no hydrogen 2.903 N/A CYS 77.A N VAL 160.A O no hydrogen 3.004 N/A CYS 77.A SG SER 78.A O no hydrogen 3.601 N/A LEU 81.A N SER 78.A OG no hydrogen 3.298 N/A ALA 82.A N SER 78.A O no hydrogen 2.865 N/A SER 83.A N PRO 79.A O no hydrogen 2.975 N/A SER 83.A OG THR 80.A O no hydrogen 2.655 N/A GLN 84.A N LEU 81.A O no hydrogen 2.909 N/A ILE 85.A N ALA 82.A O no hydrogen 2.961 N/A GLN 86.A N ASP 90.A OD2 no hydrogen 2.919 N/A GLN 86.A NE2 SER 83.A O no hydrogen 3.188 N/A THR 87.A N ASP 90.A OD2 no hydrogen 3.233 N/A ASP 90.A N THR 87.A O no hydrogen 2.893 N/A ILE 91.A N PRO 88.A O no hydrogen 3.090 N/A LEU 92.A N ALA 89.A O no hydrogen 3.118 N/A LYS 93.A N ASP 90.A O no hydrogen 2.997 N/A LYS 93.A NZ GLN 84.A O no hydrogen 2.717 N/A PHE 94.A N ILE 91.A O no hydrogen 3.057 N/A LEU 96.A N ASN 122.A O no hydrogen 3.007 N/A LEU 97.A N VAL 142.A O no hydrogen 2.857 N/A ARG 98.A N MET 124.A O no hydrogen 2.969 N/A ARG 98.A NH1 SER 99.A O no hydrogen 2.742 N/A ARG 98.A NH1 ARG 101.A O no hydrogen 3.378 N/A SER 99.A N GLU 104.A OE1 no hydrogen 3.028 N/A SER 99.A OG GLU 104.A OE1 no hydrogen 3.349 N/A SER 99.A OG GLU 104.A OE2 no hydrogen 3.062 N/A ARG 101.A N SER 99.A OG no hydrogen 3.175 N/A TRP 105.A NE1 LEU 97.A O no hydrogen 2.974 N/A LEU 107.A N ASP 103.A O no hydrogen 2.955 N/A TRP 108.A N GLU 104.A O no hydrogen 3.029 N/A TRP 108.A NE1 THR 165.A O no hydrogen 2.984 N/A MET 109.A N TRP 105.A O no hydrogen 3.047 N/A GLN 110.A N ALA 106.A O no hydrogen 2.924 N/A THR 111.A N LEU 107.A O no hydrogen 2.954 N/A THR 111.A OG1 LEU 107.A O no hydrogen 2.943 N/A VAL 112.A N TRP 108.A O no hydrogen 3.035 N/A GLY 113.A N GLN 110.A O no hydrogen 3.199 N/A GLU 114.A N MET 109.A O no hydrogen 2.770 N/A THR 120.A N SER 118.A OG no hydrogen 3.214 N/A THR 120.A OG1 SER 118.A OG no hydrogen 3.304 N/A HIS 121.A N SER 118.A O no hydrogen 2.873 N/A HIS 121.A NE2 PHE 94.A O no hydrogen 2.945 N/A MET 124.A N LEU 96.A O no hydrogen 2.951 N/A PHE 126.A N ARG 98.A O no hydrogen 2.816 N/A VAL 130.A N SER 128.A OG no hydrogen 3.098 N/A MET 132.A N SER 128.A O no hydrogen 2.977 N/A LEU 133.A N ALA 129.A O no hydrogen 2.981 N/A GLU 134.A N VAL 130.A O no hydrogen 3.111 N/A ALA 135.A N THR 131.A O no hydrogen 3.030 N/A ALA 136.A N MET 132.A O no hydrogen 2.841 N/A GLN 137.A N LEU 133.A O no hydrogen 3.002 N/A GLN 137.A NE2 LEU 133.A O no hydrogen 3.128 N/A GLN 137.A NE2 GLU 134.A OE2 no hydrogen 2.745 N/A ALA 138.A N GLU 134.A O no hydrogen 3.250 N/A GLY 139.A N ALA 136.A O no hydrogen 2.839 N/A MET 140.A N ALA 135.A O no hydrogen 3.001 N/A VAL 142.A N PRO 95.A O no hydrogen 3.020 N/A ALA 143.A N LEU 76.A O no hydrogen 2.855 N/A VAL 147.A N LEU 72.A O no hydrogen 3.169 N/A MET 149.A N PRO 146.A O no hydrogen 3.194 N/A PHE 150.A N VAL 147.A O no hydrogen 3.026 N/A THR 151.A OG1 ARG 148.A O no hydrogen 3.399 N/A LEU 153.A N PHE 150.A O no hydrogen 2.974 N/A LEU 154.A N PHE 150.A O no hydrogen 3.041 N/A SER 155.A N THR 151.A O no hydrogen 2.844 N/A SER 155.A OG THR 151.A O no hydrogen 3.156 N/A SER 156.A N HIS 152.A O no hydrogen 3.224 N/A SER 156.A OG HIS 152.A O no hydrogen 2.739 N/A SER 156.A OG LEU 153.A O no hydrogen 3.467 N/A GLU 157.A N LEU 154.A O no hydrogen 3.080 N/A ARG 158.A N LEU 153.A O no hydrogen 2.849 N/A ILE 159.A N LEU 153.A O no hydrogen 3.105 N/A VAL 160.A N CYS 77.A O no hydrogen 2.609 N/A GLN 161.A NE2 SER 74.A OG no hydrogen 3.339 N/A GLN 161.A NE2 PHE 163.A O no hydrogen 3.005 N/A ILE 167.A N MET 73.A O no hydrogen 2.867 N/A GLY 170.A N ASP 168.A OD1 no hydrogen 2.883 N/A SER 171.A N GLY 56.A O no hydrogen 2.885 N/A PHE 172.A N CYS 69.A O no hydrogen 2.831 N/A TRP 173.A N ARG 54.A O no hydrogen 2.915 N/A ILE 174.A N GLN 66.A O no hydrogen 2.811 N/A THR 175.A N THR 52.A O no hydrogen 2.793 N/A THR 175.A OG1 THR 52.A O no hydrogen 3.497 N/A ARG 176.A N ASP 64.A O no hydrogen 2.940 N/A ARG 176.A NH1 ARG 180.A O no hydrogen 2.767 N/A ARG 176.A NH2 ASP 64.A OD2 no hydrogen 3.097 N/A GLN 178.A N ASP 62.A O no hydrogen 3.027 N/A ARG 180.A N LEU 177.A O no hydrogen 2.808 N/A ARG 180.A NE ASP 50.A OD1 no hydrogen 3.165 N/A ARG 180.A NH2 ASP 50.A OD1 no hydrogen 2.894 N/A MET 186.A N THR 183.A OG1 no hydrogen 3.094 N/A ARG 187.A N THR 183.A O no hydrogen 3.104 N/A ARG 187.A NH1 GLU 182.A O no hydrogen 3.079 N/A ARG 187.A NH1 GLU 182.A OE1 no hydrogen 2.804 N/A GLU 188.A N PRO 184.A O no hydrogen 3.092 N/A PHE 189.A N ALA 185.A O no hydrogen 2.921 N/A SER 190.A N MET 186.A O no hydrogen 2.876 N/A SER 190.A OG TYR 51.A OH no hydrogen 2.548 N/A SER 190.A OG MET 186.A O no hydrogen 3.107 N/A ARG 191.A N ARG 187.A O no hydrogen 2.965 N/A TRP 192.A N GLU 188.A O no hydrogen 2.904 N/A TRP 192.A NE1 ASP 23.A OD2 no hydrogen 2.871 N/A LEU 193.A N PHE 189.A O no hydrogen 2.958 N/A THR 194.A N SER 190.A O no hydrogen 3.145 N/A THR 194.A OG1 SER 190.A O no hydrogen 2.921 N/A THR 194.A OG1 ARG 191.A O no hydrogen 3.537 N/A GLY 195.A N ARG 191.A O no hydrogen 3.093 N/A VAL 196.A N TRP 192.A O no hydrogen 2.716 N/A LEU 197.A N LEU 193.A O no hydrogen 3.045 N/A HIS 198.A N GLY 195.A O no hydrogen 3.177 N/A