Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1kr5_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ALA 1.A N GLU 5.A OE1 no hydrogen 2.932 N/A HIS 3.A NE2 MET 25.A O no hydrogen 2.794 N/A GLU 5.A N SER 2.A OG no hydrogen 3.109 N/A LEU 6.A N SER 2.A O no hydrogen 3.267 N/A ILE 7.A N HIS 3.A O no hydrogen 2.880 N/A HIS 8.A N SER 4.A O no hydrogen 2.714 N/A HIS 8.A ND1 SER 4.A O no hydrogen 2.908 N/A ASN 9.A N GLU 5.A O no hydrogen 2.825 N/A LEU 10.A N LEU 6.A O no hydrogen 3.080 N/A ARG 11.A N ILE 7.A O no hydrogen 3.129 N/A LYS 12.A N HIS 8.A O no hydrogen 2.916 N/A ASN 13.A N ASN 9.A O no hydrogen 2.946 N/A GLY 14.A N ARG 11.A O no hydrogen 2.936 N/A ILE 15.A N LEU 10.A O no hydrogen 2.831 N/A ILE 16.A N LEU 10.A O no hydrogen 3.170 N/A LYS 17.A N GLU 63.A OE2 no hydrogen 2.717 N/A THR 18.A OG1 GLU 63.A OE1 no hydrogen 2.941 N/A THR 18.A OG1 GLU 63.A OE2 no hydrogen 3.042 N/A LYS 20.A NZ LEU 69.A O no hydrogen 2.847 N/A LYS 20.A NZ MET 92.A O no hydrogen 3.044 N/A VAL 21.A N THR 18.A OG1 no hydrogen 3.211 N/A PHE 22.A N THR 18.A O no hydrogen 2.958 N/A GLU 23.A N ASP 19.A O no hydrogen 2.909 N/A VAL 24.A N LYS 20.A O no hydrogen 2.971 N/A MET 25.A N VAL 21.A O no hydrogen 2.927 N/A LEU 26.A N PHE 22.A O no hydrogen 2.951 N/A ALA 27.A N GLU 23.A O no hydrogen 2.674 N/A THR 28.A N MET 25.A O no hydrogen 3.200 N/A THR 28.A OG1 VAL 24.A O no hydrogen 2.819 N/A ARG 30.A NE PRO 38.A O no hydrogen 2.763 N/A ARG 30.A NH1 SER 53.A O no hydrogen 2.876 N/A ARG 30.A NH2 SER 53.A O no hydrogen 3.088 N/A SER 31.A N ASP 29.A OD1 no hydrogen 2.637 N/A SER 31.A OG ASP 29.A OD1 no hydrogen 2.878 N/A HIS 32.A N ASP 29.A O no hydrogen 3.226 N/A TYR 33.A N ARG 30.A O no hydrogen 2.937 N/A TYR 33.A OH ASP 119.A OD2 no hydrogen 2.637 N/A ALA 34.A N ARG 30.A O no hydrogen 2.739 N/A TYR 39.A OH ASP 29.A OD1 no hydrogen 2.614 N/A MET 40.A N ASN 37.A O no hydrogen 3.486 N/A SER 42.A N MET 40.A O no hydrogen 2.786 N/A GLN 44.A N ILE 52.A O no hydrogen 3.089 N/A GLN 44.A NE2 SER 42.A O no hydrogen 2.882 N/A ILE 46.A N ALA 50.A O no hydrogen 2.938 N/A GLY 47.A N SER 45.A OG no hydrogen 3.041 N/A GLN 49.A NE2 GLN 215.A O no hydrogen 3.484 N/A ALA 50.A N GLY 47.A O no hydrogen 2.919 N/A ILE 52.A N GLN 44.A O no hydrogen 2.658 N/A HIS 56.A N ASP 41.A OD1 no hydrogen 3.052 N/A HIS 56.A ND1 ASP 41.A OD1 no hydrogen 2.774 N/A HIS 56.A ND1 ASP 41.A OD2 no hydrogen 2.639 N/A MET 57.A N ALA 54.A O no hydrogen 2.928 N/A HIS 58.A N ALA 54.A O no hydrogen 3.414 N/A HIS 58.A N PRO 55.A O no hydrogen 3.060 N/A ALA 59.A N PRO 55.A O no hydrogen 3.135 N/A TYR 60.A N HIS 56.A O no hydrogen 2.847 N/A ALA 61.A N MET 57.A O no hydrogen 3.133 N/A LEU 62.A N HIS 58.A O no hydrogen 2.946 N/A GLU 63.A N ALA 59.A O no hydrogen 2.892 N/A LEU 64.A N TYR 60.A O no hydrogen 2.930 N/A LEU 65.A N ALA 61.A O no hydrogen 3.011 N/A PHE 66.A N GLU 63.A O no hydrogen 3.459 N/A LEU 69.A N PHE 66.A O no hydrogen 3.064 N/A HIS 70.A ND1 ASP 67.A O no hydrogen 2.845 N/A GLY 72.A N VAL 93.A O no hydrogen 2.795 N/A ALA 73.A N HIS 70.A O no hydrogen 2.838 N/A LYS 74.A N ASP 147.A OD1 no hydrogen 2.850 N/A LYS 74.A NZ GLU 143.A O no hydrogen 3.025 N/A LYS 74.A NZ GLU 143.A OE1 no hydrogen 2.714 N/A ALA 75.A N LYS 98.A O no hydrogen 2.950 N/A LEU 76.A N ALA 148.A O no hydrogen 2.918 N/A ASP 77.A N ILE 100.A O no hydrogen 2.728 N/A VAL 78.A N HIS 150.A O no hydrogen 2.574 N/A GLY 79.A N ILE 102.A O no hydrogen 2.721 N/A SER 80.A N ILE 102.A O no hydrogen 2.972 N/A GLY 81.A N ASP 103.A OD2 no hydrogen 2.680 N/A GLY 83.A N SER 80.A O no hydrogen 2.613 N/A ILE 84.A N SER 82.A OG no hydrogen 3.371 N/A THR 86.A OG1 ASP 77.A OD2 no hydrogen 2.867 N/A THR 86.A OG1 GLY 83.A O no hydrogen 3.397 N/A ALA 87.A N GLY 83.A O no hydrogen 3.080 N/A CYS 88.A N ILE 84.A O no hydrogen 3.064 N/A CYS 88.A SG ILE 84.A O no hydrogen 3.281 N/A PHE 89.A N LEU 85.A O no hydrogen 2.839 N/A ALA 90.A N THR 86.A O no hydrogen 2.951 N/A ARG 91.A N ALA 87.A O no hydrogen 2.835 N/A ARG 91.A NH1 ASP 119.A OD2 no hydrogen 2.971 N/A ARG 91.A NH2 ASP 119.A OD1 no hydrogen 2.634 N/A ARG 91.A NH2 ASP 119.A OD2 no hydrogen 3.421 N/A MET 92.A N CYS 88.A O no hydrogen 2.807 N/A VAL 93.A N PHE 89.A O no hydrogen 2.915 N/A THR 96.A N GLU 71.A OE2 no hydrogen 2.844 N/A THR 96.A OG1 GLU 71.A OE2 no hydrogen 2.643 N/A GLY 97.A N GLY 94.A O no hydrogen 3.094 N/A LYS 98.A N ALA 73.A O no hydrogen 3.061 N/A VAL 99.A N ARG 128.A O no hydrogen 2.920 N/A ILE 100.A N ALA 75.A O no hydrogen 2.887 N/A GLY 101.A N GLN 130.A O no hydrogen 2.711 N/A ILE 102.A N ASP 77.A O no hydrogen 3.019 N/A ASP 103.A N VAL 132.A O no hydrogen 3.075 N/A HIS 104.A NE2 GLN 215.A OE1 no hydrogen 2.800 N/A ILE 105.A N ASP 103.A OD1 no hydrogen 3.379 N/A GLU 107.A N GLU 107.A OE1.B no hydrogen 2.324 N/A LEU 108.A N ILE 105.A O no hydrogen 2.939 N/A VAL 109.A N ILE 105.A O no hydrogen 3.074 N/A ASP 110.A N LYS 106.A O no hydrogen 3.021 N/A ASP 111.A N GLU 107.A O no hydrogen 3.197 N/A SER 112.A N LEU 108.A O no hydrogen 2.717 N/A SER 112.A OG VAL 109.A O no hydrogen 2.447 N/A VAL 113.A N VAL 109.A O no hydrogen 2.880 N/A ASN 114.A N ASP 110.A O no hydrogen 3.012 N/A ASN 115.A N ASP 111.A O no hydrogen 2.678 N/A ASN 115.A ND2 SER 82.A O no hydrogen 2.876 N/A VAL 116.A N SER 112.A O no hydrogen 3.001 N/A ARG 117.A N VAL 113.A O no hydrogen 3.031 N/A LYS 118.A N ASN 114.A O no hydrogen 3.136 N/A ASP 119.A N ASN 115.A O no hydrogen 2.997 N/A ASP 120.A N VAL 116.A O no hydrogen 2.757 N/A THR 122.A N ASP 120.A OD1 no hydrogen 2.813 N/A LEU 123.A N ASP 120.A O no hydrogen 3.105 N/A LEU 124.A N PRO 121.A O no hydrogen 3.112 N/A SER 125.A N PRO 121.A O no hydrogen 3.322 N/A SER 126.A N THR 122.A O no hydrogen 2.908 N/A SER 126.A OG THR 122.A O no hydrogen 2.581 N/A SER 126.A OG LEU 123.A O no hydrogen 3.213 N/A GLY 127.A N LEU 124.A O no hydrogen 3.125 N/A ARG 128.A N SER 126.A OG no hydrogen 3.080 N/A VAL 129.A N LEU 123.A O no hydrogen 2.867 N/A GLN 130.A N VAL 99.A O no hydrogen 2.991 N/A VAL 132.A N GLY 101.A O no hydrogen 2.791 N/A GLY 134.A N ASP 103.A O no hydrogen 3.067 N/A ARG 137.A N ASP 135.A OD1 no hydrogen 2.741 N/A ARG 137.A NE ASP 135.A OD1 no hydrogen 2.902 N/A ARG 137.A NH1 ASP 211.A OD1 no hydrogen 3.153 N/A ARG 137.A NH2 ASP 135.A OD2 no hydrogen 2.792 N/A MET 138.A N ASP 135.A O no hydrogen 2.843 N/A GLY 139.A N GLY 136.A O no hydrogen 2.701 N/A TYR 140.A N GLN 165.A OE1 no hydrogen 2.703 N/A GLU 143.A N TYR 140.A O no hydrogen 2.966 N/A ALA 144.A N ALA 141.A O no hydrogen 2.777 N/A TYR 146.A N GLN 165.A O no hydrogen 2.711 N/A TYR 146.A OH TYR 140.A O no hydrogen 2.634 N/A ASP 147.A N LYS 74.A O no hydrogen 2.769 N/A ALA 148.A N LYS 74.A O no hydrogen 3.351 N/A ILE 149.A N ARG 171.A O no hydrogen 2.973 N/A HIS 150.A N LEU 76.A O no hydrogen 2.905 N/A HIS 150.A ND1 ASP 77.A OD1 no hydrogen 3.025 N/A VAL 151.A N ILE 173.A O no hydrogen 2.948 N/A GLY 152.A N VAL 78.A O no hydrogen 2.940 N/A ALA 154.A N VAL 207.A O no hydrogen 2.943 N/A ALA 155.A N PRO 175.A O no hydrogen 2.706 N/A GLN 160.A NE2 ASP 164.A OD1 no hydrogen 2.777 N/A LEU 162.A N PRO 159.A O no hydrogen 3.216 N/A ASP 164.A N GLN 160.A O no hydrogen 2.860 N/A GLN 165.A N ALA 161.A O no hydrogen 2.916 N/A GLN 165.A N LEU 162.A O no hydrogen 3.257 N/A GLN 165.A NE2 MET 138.A O no hydrogen 2.866 N/A LEU 166.A N ILE 163.A O no hydrogen 3.138 N/A LYS 167.A N TYR 146.A O no hydrogen 2.827 N/A LYS 167.A NZ ASP 147.A OD1 no hydrogen 2.659 N/A LYS 167.A NZ ASP 147.A OD2 no hydrogen 3.291 N/A GLY 169.A N LYS 190.A O no hydrogen 2.657 N/A GLY 170.A N LYS 167.A O no hydrogen 2.738 N/A ARG 171.A N ASP 147.A O no hydrogen 3.008 N/A ARG 171.A NE ASP 189.A OD1 no hydrogen 2.697 N/A ARG 171.A NH1 LEU 64.A O no hydrogen 2.747 N/A ARG 171.A NH2 ASP 189.A OD1 no hydrogen 3.423 N/A LEU 172.A N TYR 188.A O no hydrogen 2.757 N/A ILE 173.A N ILE 149.A O no hydrogen 2.923 N/A LEU 174.A N GLU 186.A O no hydrogen 3.244 N/A VAL 176.A N MET 184.A O no hydrogen 2.849 N/A GLY 177.A N ALA 155.A O no hydrogen 2.803 N/A GLY 181.A N PRO 178.A O no hydrogen 3.080 N/A ASN 182.A N ASN 182.A OD1 no hydrogen 2.498 N/A GLN 183.A N VAL 204.A O no hydrogen 3.329 N/A GLN 183.A NE2 PRO 178.A O no hydrogen 3.167 N/A GLN 183.A NE2 TYR 206.A O no hydrogen 3.154 N/A MET 184.A N VAL 176.A O no hydrogen 2.852 N/A LEU 185.A N MET 202.A O no hydrogen 2.768 N/A GLU 186.A N LEU 174.A O no hydrogen 2.982 N/A GLN 187.A N LYS 199.A O no hydrogen 2.831 N/A GLN 187.A NE2 ASP 189.A OD2 no hydrogen 2.780 N/A TYR 188.A N LEU 172.A O no hydrogen 2.825 N/A TYR 188.A OH GLU 186.A OE1 no hydrogen 2.870 N/A ASP 189.A N LYS 197.A O no hydrogen 2.897 N/A LYS 190.A N GLY 170.A O no hydrogen 3.031 N/A LYS 190.A NZ ILE 163.A O no hydrogen 3.184 N/A LEU 191.A N SER 195.A O no hydrogen 2.843 N/A GLY 194.A N LEU 191.A O no hydrogen 2.598 N/A LYS 197.A N ASP 189.A O no hydrogen 2.982 N/A LYS 199.A N GLN 187.A O no hydrogen 2.656 N/A LEU 201.A N LEU 185.A O no hydrogen 2.712 N/A VAL 204.A N GLN 183.A O no hydrogen 2.640 N/A LEU 209.A N ALA 154.A O no hydrogen 2.561 N/A THR 210.A OG1 ASP 211.A OD1 no hydrogen 3.224 N/A ASP 211.A N THR 210.A OG1 no hydrogen 2.417 N/A LYS 214.A N ASP 211.A O no hydrogen 3.174 N/A GLN 215.A N LYS 212.A O no hydrogen 2.753 N/A GLN 215.A NE2 PHE 48.A O no hydrogen 2.879 N/A TRP 216.A N LYS 212.A O no hydrogen 2.695 N/A SER 217.A OG GLU 213.A OE1 no hydrogen 3.564 N/A