Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 2jk2_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ARG 1.A NE ASP 224.A OD1 no hydrogen 2.719 N/A ARG 1.A NH1 GLN 199.A O no hydrogen 2.762 N/A LYS 2.A NZ ALA 32.A O no hydrogen 3.529 N/A PHE 4.A N ASP 224.A O no hydrogen 2.996 N/A VAL 5.A N GLU 35.A O no hydrogen 2.847 N/A GLY 6.A N PHE 226.A O no hydrogen 2.843 N/A GLY 7.A N VAL 37.A O no hydrogen 2.733 N/A ASN 8.A N VAL 228.A O no hydrogen 2.734 N/A TRP 9.A N ALA 39.A O no hydrogen 3.031 N/A LYS 10.A N ASN 8.A OD1 no hydrogen 3.006 N/A LYS 10.A NZ GLU 94.A OE2 no hydrogen 2.728 N/A ASN 12.A ND2 TRP 9.A O no hydrogen 2.956 N/A ARG 14.A N SER 17.A OG no hydrogen 3.131 N/A ARG 14.A NH1 GLY 13.A O no hydrogen 2.971 N/A SER 17.A OG ARG 14.A O no hydrogen 3.456 N/A LEU 18.A N ARG 14.A O no hydrogen 2.845 N/A GLY 19.A N LYS 15.A O no hydrogen 2.843 N/A GLU 20.A N GLN 16.A O no hydrogen 3.164 N/A LEU 21.A N SER 17.A O no hydrogen 3.008 N/A ILE 22.A N LEU 18.A O no hydrogen 2.939 N/A GLY 23.A N GLY 19.A O no hydrogen 2.964 N/A THR 24.A N GLU 20.A O no hydrogen 3.093 N/A THR 24.A OG1 GLU 20.A O no hydrogen 3.249 N/A LEU 25.A N LEU 21.A O no hydrogen 2.941 N/A ASN 26.A N ILE 22.A O no hydrogen 2.757 N/A ASN 26.A ND2 LYS 51.A O no hydrogen 3.005 N/A ALA 27.A N GLY 23.A O no hydrogen 3.094 N/A ALA 28.A N LEU 25.A O no hydrogen 3.162 N/A THR 34.A N PRO 31.A O no hydrogen 3.147 N/A THR 34.A OG1 ASP 33.A OD1 no hydrogen 3.107 N/A GLU 35.A N PHE 3.A O no hydrogen 2.791 N/A VAL 37.A N VAL 5.A O no hydrogen 2.972 N/A CYS 38.A N ALA 57.A O no hydrogen 2.921 N/A ALA 39.A N GLY 7.A O no hydrogen 2.788 N/A TYR 44.A N PRO 41.A O no hydrogen 2.831 N/A ILE 45.A N THR 42.A O no hydrogen 3.424 N/A ALA 48.A N TYR 44.A O no hydrogen 2.767 N/A ARG 49.A N ILE 45.A O no hydrogen 2.936 N/A ARG 49.A NE ARG 49.A O no hydrogen 2.848 N/A ARG 49.A NH1 ILE 56.A O no hydrogen 2.724 N/A ARG 49.A NH2 LEU 52.A O no hydrogen 2.969 N/A ARG 49.A NH2 ASP 53.A O no hydrogen 2.972 N/A ARG 49.A NH2 ILE 56.A O no hydrogen 3.009 N/A GLN 50.A N ASP 46.A O no hydrogen 3.018 N/A LYS 51.A N PHE 47.A O no hydrogen 3.096 N/A LYS 51.A N ALA 48.A O no hydrogen 3.180 N/A LEU 52.A N ALA 48.A O no hydrogen 2.759 N/A ASP 53.A N ASN 26.A OD1 no hydrogen 2.773 N/A LYS 55.A N ASP 53.A OD2 no hydrogen 2.964 N/A LYS 55.A NZ ASN 26.A O no hydrogen 2.791 N/A LYS 55.A NZ ALA 28.A O no hydrogen 2.746 N/A ILE 56.A N ASP 53.A O no hydrogen 3.009 N/A ALA 57.A N VAL 36.A O no hydrogen 2.989 N/A ALA 59.A N CYS 38.A O no hydrogen 2.816 N/A ALA 60.A N TRP 87.A O no hydrogen 2.902 N/A GLN 61.A NE2 LYS 10.A O no hydrogen 2.899 N/A GLN 61.A NE2 ALA 39.A O no hydrogen 2.891 N/A ASN 62.A ND2 GLU 101.A OE2 no hydrogen 3.468 N/A CYS 63.A SG TYR 64.A O no hydrogen 3.489 N/A TYR 64.A N ILE 75.A O no hydrogen 2.802 N/A LYS 65.A NZ GLN 108.A OE1 no hydrogen 2.764 N/A GLU 74.A N PHE 71.A O no hydrogen 2.984 N/A SER 76.A OG THR 67.A O no hydrogen 2.810 N/A ILE 80.A N SER 76.A O no hydrogen 3.032 N/A LYS 81.A N PRO 77.A O no hydrogen 2.879 N/A LYS 81.A NZ GLU 116.A O no hydrogen 3.226 N/A ASP 82.A N GLY 78.A O no hydrogen 3.038 N/A CYS 83.A N MET 79.A O no hydrogen 2.990 N/A CYS 83.A N ILE 80.A O no hydrogen 3.201 N/A CYS 83.A SG MET 79.A O no hydrogen 3.502 N/A GLY 84.A N LYS 81.A O no hydrogen 2.883 N/A ALA 85.A N ILE 80.A O no hydrogen 3.160 N/A THR 86.A N VAL 58.A O no hydrogen 2.907 N/A TRP 87.A N VAL 58.A O no hydrogen 3.374 N/A VAL 88.A N GLY 119.A O no hydrogen 2.940 N/A VAL 89.A N ALA 60.A O no hydrogen 2.846 N/A LEU 90.A N ILE 121.A O no hydrogen 2.922 N/A SER 93.A N GLU 162.A OE1 no hydrogen 2.774 N/A SER 93.A OG GLU 162.A OE1 no hydrogen 3.562 N/A SER 93.A OG GLU 162.A OE2 no hydrogen 2.749 N/A GLU 94.A N HIS 92.A ND1 no hydrogen 3.097 N/A ARG 95.A NE GLU 101.A OE2 no hydrogen 2.912 N/A ARG 95.A NH2 GLU 101.A OE2 no hydrogen 3.349 N/A ARG 96.A N HIS 92.A O no hydrogen 3.019 N/A ARG 96.A NE GLY 91.A O no hydrogen 2.763 N/A ARG 96.A NH1 ASP 103.A OD1 no hydrogen 2.861 N/A ARG 96.A NH2 CYS 123.A O no hydrogen 2.999 N/A HIS 97.A N SER 93.A O no hydrogen 2.860 N/A VAL 98.A N GLU 94.A O no hydrogen 2.876 N/A GLU 101.A N ARG 95.A O no hydrogen 3.103 N/A LEU 105.A N SER 102.A OG no hydrogen 2.991 N/A ILE 106.A N SER 102.A O no hydrogen 2.915 N/A GLY 107.A N ASP 103.A O no hydrogen 2.897 N/A GLN 108.A N GLU 104.A O no hydrogen 3.030 N/A LYS 109.A N LEU 105.A O no hydrogen 2.990 N/A LYS 109.A NZ ASN 62.A OD1 no hydrogen 2.950 N/A LYS 109.A NZ CYS 63.A O no hydrogen 3.149 N/A LYS 109.A NZ GLU 101.A OE1 no hydrogen 2.865 N/A LYS 109.A NZ GLU 101.A OE2 no hydrogen 3.038 N/A VAL 110.A N ILE 106.A O no hydrogen 2.947 N/A ALA 111.A N GLY 107.A O no hydrogen 2.969 N/A HIS 112.A N GLN 108.A O no hydrogen 3.023 N/A ALA 113.A N LYS 109.A O no hydrogen 2.862 N/A LEU 114.A N VAL 110.A O no hydrogen 3.023 N/A ALA 115.A N ALA 111.A O no hydrogen 2.963 N/A GLU 116.A N HIS 112.A O no hydrogen 2.910 N/A GLY 117.A N LEU 114.A O no hydrogen 3.130 N/A LEU 118.A N ALA 113.A O no hydrogen 3.004 N/A GLY 119.A N THR 86.A O no hydrogen 3.018 N/A VAL 120.A N LYS 156.A O no hydrogen 2.904 N/A ILE 121.A N VAL 88.A O no hydrogen 2.950 N/A ALA 122.A N VAL 158.A O no hydrogen 2.805 N/A CYS 123.A N LEU 90.A O no hydrogen 2.907 N/A ILE 124.A N ALA 160.A O no hydrogen 2.859 N/A GLY 125.A N GLN 143.A OE1 no hydrogen 2.794 N/A GLU 126.A N GLU 126.A OE1 no hydrogen 2.754 N/A LYS 127.A N GLU 130.A OE1 no hydrogen 2.939 N/A ARG 131.A N LYS 127.A O no hydrogen 3.018 N/A ARG 131.A NH1 GLU 126.A OE2 no hydrogen 2.996 N/A GLU 132.A N LEU 128.A O no hydrogen 2.830 N/A ALA 133.A N ASP 129.A O no hydrogen 2.925 N/A GLY 134.A N ARG 131.A O no hydrogen 3.027 N/A ILE 135.A N GLU 130.A O no hydrogen 2.792 N/A THR 136.A OG1 GLU 126.A OE2 no hydrogen 2.726 N/A VAL 139.A N ILE 135.A O no hydrogen 2.966 N/A VAL 140.A N THR 136.A O no hydrogen 2.948 N/A PHE 141.A N GLU 137.A O no hydrogen 2.901 N/A GLU 142.A N LYS 138.A O no hydrogen 3.077 N/A GLN 143.A N VAL 139.A O no hydrogen 3.085 N/A GLN 143.A NE2 GLY 125.A O no hydrogen 3.327 N/A THR 144.A N VAL 140.A O no hydrogen 2.964 N/A THR 144.A OG1 VAL 140.A O no hydrogen 2.758 N/A LYS 145.A N PHE 141.A O no hydrogen 2.816 N/A VAL 146.A N GLU 142.A O no hydrogen 3.201 N/A ILE 147.A N GLN 143.A O no hydrogen 3.346 N/A ALA 148.A N THR 144.A O no hydrogen 2.905 N/A ASP 149.A N LYS 145.A O no hydrogen 3.241 N/A ASN 150.A N ILE 147.A O no hydrogen 2.878 N/A ASN 150.A ND2 VAL 146.A O no hydrogen 2.836 N/A VAL 151.A N ALA 148.A O no hydrogen 2.894 N/A SER 155.A OG ASP 153.A OD1 no hydrogen 2.575 N/A SER 155.A OG ASP 153.A OD2 no hydrogen 3.295 N/A LYS 156.A NZ GLY 117.A O no hydrogen 3.147 N/A VAL 157.A N TRP 154.A O no hydrogen 3.199 N/A VAL 158.A N VAL 120.A O no hydrogen 2.883 N/A LEU 159.A N ARG 202.A O no hydrogen 2.902 N/A ALA 160.A N ALA 122.A O no hydrogen 2.828 N/A TYR 161.A N ILE 204.A O no hydrogen 2.846 N/A TYR 161.A OH GLU 126.A OE1 no hydrogen 2.619 N/A TYR 161.A OH GLU 126.A OE2 no hydrogen 3.307 N/A GLU 162.A N ILE 124.A O no hydrogen 2.743 N/A VAL 164.A N GLU 162.A O no hydrogen 2.824 N/A TRP 165.A N GLU 126.A O no hydrogen 3.081 N/A TRP 165.A NE1 TYR 161.A OH no hydrogen 2.950 N/A ALA 166.A N PRO 163.A O no hydrogen 2.866 N/A ILE 167.A N VAL 164.A O no hydrogen 3.075 N/A THR 169.A OG1 TRP 165.A O no hydrogen 2.547 N/A LYS 171.A N THR 169.A OG1 no hydrogen 3.156 N/A THR 174.A N GLN 177.A OE1 no hydrogen 2.978 N/A THR 174.A OG1 GLN 177.A OE1 no hydrogen 3.439 N/A GLN 177.A N THR 174.A OG1 no hydrogen 3.136 N/A ALA 178.A N THR 174.A O no hydrogen 2.967 N/A GLN 179.A N PRO 175.A O no hydrogen 2.836 N/A GLN 179.A NE2 ASP 222.A OD1 no hydrogen 2.681 N/A GLU 180.A N GLN 176.A O no hydrogen 2.872 N/A VAL 181.A N GLN 177.A O no hydrogen 3.271 N/A HIS 182.A N ALA 178.A O no hydrogen 3.007 N/A HIS 182.A ND1 ASP 222.A O no hydrogen 3.014 N/A GLU 183.A N GLN 179.A O no hydrogen 2.899 N/A LYS 184.A N GLU 180.A O no hydrogen 3.188 N/A LEU 185.A N VAL 181.A O no hydrogen 2.805 N/A ARG 186.A N HIS 182.A O no hydrogen 3.011 N/A ARG 186.A NE ASP 222.A OD2 no hydrogen 2.854 N/A ARG 186.A NH1 ALA 198.A O no hydrogen 2.776 N/A ARG 186.A NH1 THR 201.A O no hydrogen 2.775 N/A ARG 186.A NH2 ASP 222.A O no hydrogen 3.145 N/A ARG 186.A NH2 ASP 224.A OD2 no hydrogen 2.739 N/A GLY 187.A N GLU 183.A O no hydrogen 2.970 N/A TRP 188.A N LYS 184.A O no hydrogen 2.860 N/A LEU 189.A N LEU 185.A O no hydrogen 2.980 N/A LYS 190.A N ARG 186.A O no hydrogen 2.720 N/A ASN 192.A N LEU 189.A O no hydrogen 2.358 N/A VAL 193.A N LEU 189.A O no hydrogen 2.896 N/A VAL 197.A N SER 194.A O no hydrogen 3.201 N/A VAL 197.A N SER 194.A OG no hydrogen 2.726 N/A ALA 198.A N SER 194.A O no hydrogen 3.037 N/A GLN 199.A N ASP 195.A O no hydrogen 2.990 N/A SER 200.A N VAL 197.A O no hydrogen 2.811 N/A SER 200.A OG ALA 196.A O no hydrogen 2.526 N/A SER 200.A OG VAL 197.A O no hydrogen 3.087 N/A THR 201.A N VAL 197.A O no hydrogen 2.454 N/A THR 201.A OG1 VAL 197.A O no hydrogen 2.725 N/A ARG 202.A NH1 LYS 2.A O no hydrogen 3.041 N/A ARG 202.A NH1 GLU 35.A OE1 no hydrogen 2.680 N/A ARG 202.A NH2 GLU 35.A OE1 no hydrogen 3.147 N/A ILE 203.A N ASP 224.A OD2 no hydrogen 2.771 N/A ILE 204.A N LEU 159.A O no hydrogen 2.697 N/A TYR 205.A N GLY 225.A O no hydrogen 2.806 N/A GLY 206.A N TYR 161.A O no hydrogen 2.709 N/A THR 210.A N THR 213.A OG1 no hydrogen 3.059 N/A THR 210.A OG1 THR 213.A OG1 no hydrogen 3.183 N/A GLY 211.A N GLU 236.A OE2 no hydrogen 3.052 N/A THR 213.A N THR 210.A O no hydrogen 3.145 N/A THR 213.A OG1 THR 210.A O no hydrogen 3.481 N/A THR 213.A OG1 THR 210.A OG1 no hydrogen 3.183 N/A CYS 214.A N THR 210.A O no hydrogen 2.933 N/A CYS 214.A SG GLY 211.A O no hydrogen 3.707 N/A CYS 214.A SG ASP 239.A O no hydrogen 3.755 N/A LYS 215.A NZ ASN 242.A O no hydrogen 3.388 N/A LEU 217.A N THR 213.A O no hydrogen 3.176 N/A ALA 218.A N CYS 214.A O no hydrogen 2.885 N/A SER 219.A N LYS 215.A O no hydrogen 3.238 N/A SER 219.A N GLU 216.A O no hydrogen 3.345 N/A SER 219.A OG GLU 216.A O no hydrogen 2.672 N/A GLN 220.A N LEU 217.A O no hydrogen 3.129 N/A GLN 220.A NE2 GLU 216.A O no hydrogen 3.052 N/A ASP 222.A N GLN 179.A OE1 no hydrogen 2.831 N/A VAL 223.A N GLN 220.A O no hydrogen 3.110 N/A ASP 224.A N ILE 203.A O no hydrogen 3.030 N/A PHE 226.A N PHE 4.A O no hydrogen 2.880 N/A LEU 227.A N TYR 205.A O no hydrogen 2.954 N/A VAL 228.A N GLY 6.A O no hydrogen 2.729 N/A SER 232.A N GLY 229.A O no hydrogen 2.890 N/A SER 232.A OG ASN 8.A O no hydrogen 3.141 N/A SER 232.A OG GLY 229.A O no hydrogen 2.618 N/A LEU 233.A N GLY 230.A O no hydrogen 3.123 N/A LYS 234.A N ALA 231.A O no hydrogen 3.229 N/A PHE 237.A N LYS 234.A O no hydrogen 2.921 N/A VAL 238.A N PRO 235.A O no hydrogen 2.988 N/A ILE 240.A N GLU 236.A O no hydrogen 3.294 N/A ILE 241.A N PHE 237.A O no hydrogen 2.896 N/A ASN 242.A N VAL 238.A O no hydrogen 2.974 N/A ALA 243.A N ILE 240.A O no hydrogen 3.171 N/A LYS 244.A NZ ALA 218.A O no hydrogen 2.606 N/A GLN 245.A N ASN 242.A O no hydrogen 2.858 N/A GLN 245.A NE2 ASP 33.A OD1 no hydrogen 2.840 N/A GLN 245.A NE2 ASP 33.A OD2 no hydrogen 3.560 N/A