Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 2jkq_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ILE 4.A N VAL 76.A O no hydrogen 2.836 N/A ARG 6.A NH1 GLU 79.A O no hydrogen 2.798 N/A ARG 6.A NH1 PRO 81.A O no hydrogen 2.859 N/A ARG 6.A NH2 PRO 81.A O no hydrogen 2.881 N/A GLU 7.A N GLU 7.A OE1 no hydrogen 2.664 N/A ARG 8.A N GLN 5.A O no hydrogen 3.107 N/A ARG 8.A NH2 TYR 28.A OH no hydrogen 3.491 N/A ILE 9.A N ARG 6.A O no hydrogen 2.969 N/A GLU 10.A N ILE 27.A O no hydrogen 2.948 N/A GLY 12.A N GLN 25.A O no hydrogen 2.698 N/A CYS 14.A SG GLY 16.A O no hydrogen 3.398 N/A CYS 14.A SG VAL 23.A O no hydrogen 3.124 N/A ILE 15.A N VAL 23.A O no hydrogen 2.799 N/A GLY 18.A N GLY 21.A O no hydrogen 2.695 N/A VAL 23.A N GLY 16.A O no hydrogen 2.901 N/A HIS 24.A N ILE 40.A O no hydrogen 2.830 N/A GLN 25.A N ARG 13.A O no hydrogen 3.020 N/A GLY 26.A N VAL 38.A O no hydrogen 3.006 N/A ILE 27.A N GLU 10.A O no hydrogen 2.944 N/A TYR 28.A N LEU 36.A O no hydrogen 2.691 N/A MET 29.A N ARG 8.A O no hydrogen 2.696 N/A SER 30.A OG PRO 31.A O no hydrogen 3.473 N/A LEU 36.A N TYR 28.A O no hydrogen 2.893 N/A VAL 38.A N GLY 26.A O no hydrogen 2.999 N/A ALA 39.A N MET 86.A O no hydrogen 2.732 N/A ILE 40.A N HIS 24.A O no hydrogen 2.601 N/A LYS 41.A N ILE 84.A O no hydrogen 2.713 N/A LYS 41.A NZ GLU 58.A OE2 no hydrogen 2.623 N/A LYS 41.A NZ ASP 151.A OD2 no hydrogen 2.560 N/A THR 42.A N ASP 22.A O no hydrogen 2.964 N/A THR 42.A OG1 ASP 22.A O no hydrogen 2.635 N/A LYS 44.A N PHE 20.A O no hydrogen 2.737 N/A LYS 44.A NZ ASP 22.A OD1 no hydrogen 3.276 N/A LYS 44.A NZ ASP 22.A OD2 no hydrogen 3.378 N/A SER 48.A N ASN 45.A O no hydrogen 3.290 N/A GLU 53.A N ASP 49.A O no hydrogen 3.293 N/A LYS 54.A N SER 50.A O no hydrogen 3.227 N/A PHE 55.A N VAL 51.A O no hydrogen 2.886 N/A LEU 56.A N ARG 52.A O no hydrogen 2.959 N/A GLN 57.A N GLU 53.A O no hydrogen 3.259 N/A GLU 58.A N PHE 55.A O no hydrogen 3.311 N/A LEU 60.A N LEU 56.A O no hydrogen 3.038 N/A THR 61.A N GLN 57.A O no hydrogen 3.006 N/A THR 61.A OG1 GLN 57.A O no hydrogen 2.873 N/A THR 61.A OG1 GLN 57.A OE1 no hydrogen 3.299 N/A MET 62.A N GLU 58.A O no hydrogen 3.344 N/A ARG 63.A N ALA 59.A O no hydrogen 3.051 N/A GLN 64.A N THR 61.A O no hydrogen 3.198 N/A PHE 65.A N MET 62.A O no hydrogen 2.997 N/A ASP 66.A N TYR 123.A OH no hydrogen 2.975 N/A HIS 69.A N HIS 67.A ND1 no hydrogen 3.059 N/A HIS 69.A ND1 VAL 147.A O no hydrogen 3.104 N/A ILE 70.A N HIS 67.A O no hydrogen 3.267 N/A VAL 71.A N LEU 149.A O no hydrogen 3.106 N/A LYS 72.A NZ ASP 66.A OD1 no hydrogen 2.612 N/A ILE 74.A N ILE 85.A O no hydrogen 2.858 N/A GLY 75.A N ILE 85.A O no hydrogen 3.135 N/A VAL 76.A N TYR 2.A O no hydrogen 2.801 N/A ILE 77.A N TRP 83.A O no hydrogen 2.765 N/A THR 78.A N GLU 3.A OE1 no hydrogen 2.887 N/A THR 78.A OG1 GLU 3.A OE1 no hydrogen 2.784 N/A THR 78.A OG1 GLU 3.A OE2 no hydrogen 2.827 N/A ASN 80.A ND2 CYS 46.A O no hydrogen 3.200 N/A TRP 83.A N ILE 77.A O no hydrogen 2.968 N/A ILE 84.A N LYS 41.A O no hydrogen 3.132 N/A ILE 85.A N GLY 75.A O no hydrogen 2.760 N/A MET 86.A N ALA 39.A O no hydrogen 2.738 N/A GLU 87.A N LYS 72.A O no hydrogen 3.078 N/A LEU 88.A N ALA 37.A O no hydrogen 3.366 N/A CYS 89.A SG SER 142.A OG no hydrogen 3.503 N/A LEU 91.A N VAL 141.A O no hydrogen 3.095 N/A GLY 92.A N CYS 89.A O no hydrogen 3.211 N/A LEU 94.A N VAL 139.A O no hydrogen 2.921 N/A ARG 95.A NE GLY 191.A O no hydrogen 3.231 N/A ARG 95.A NH2 GLY 191.A O no hydrogen 3.533 N/A SER 96.A OG GLU 93.A OE2 no hydrogen 2.987 N/A PHE 97.A N GLU 93.A O no hydrogen 3.363 N/A LEU 98.A N LEU 94.A O no hydrogen 2.985 N/A GLN 99.A N ARG 95.A O no hydrogen 3.200 N/A VAL 100.A N SER 96.A O no hydrogen 3.043 N/A ARG 101.A N PHE 97.A O no hydrogen 2.864 N/A ARG 101.A NE SER 104.A OG no hydrogen 3.210 N/A ARG 101.A NH2 ASN 144.A OD1 no hydrogen 2.749 N/A SER 104.A N ARG 101.A O no hydrogen 3.327 N/A SER 109.A N ASP 106.A O no hydrogen 2.996 N/A SER 109.A OG ASP 106.A OD2 no hydrogen 2.915 N/A ILE 111.A N LEU 107.A O no hydrogen 3.232 N/A LEU 112.A N ALA 108.A O no hydrogen 3.204 N/A TYR 113.A N SER 109.A O no hydrogen 3.161 N/A TYR 113.A OH ASN 144.A O no hydrogen 2.862 N/A ALA 114.A N LEU 110.A O no hydrogen 3.214 N/A TYR 115.A N ILE 111.A O no hydrogen 2.868 N/A GLN 116.A N LEU 112.A O no hydrogen 2.788 N/A GLN 116.A NE2 ASP 145.A O no hydrogen 2.840 N/A LEU 117.A N TYR 113.A O no hydrogen 2.990 N/A SER 118.A N ALA 114.A O no hydrogen 3.114 N/A SER 118.A OG ALA 114.A O no hydrogen 3.355 N/A SER 118.A OG TYR 115.A O no hydrogen 2.446 N/A THR 119.A N TYR 115.A O no hydrogen 2.967 N/A THR 119.A OG1 GLN 116.A O no hydrogen 2.443 N/A ALA 120.A N GLN 116.A O no hydrogen 3.177 N/A LEU 121.A N LEU 117.A O no hydrogen 2.821 N/A ALA 122.A N SER 118.A O no hydrogen 2.855 N/A TYR 123.A N THR 119.A O no hydrogen 3.031 N/A LEU 124.A N ALA 120.A O no hydrogen 3.020 N/A GLU 125.A N LEU 121.A O no hydrogen 2.853 N/A SER 126.A N ALA 122.A O no hydrogen 2.939 N/A SER 126.A OG ALA 122.A O no hydrogen 3.555 N/A SER 126.A OG TYR 123.A O no hydrogen 2.690 N/A LYS 127.A N TYR 123.A O no hydrogen 3.162 N/A ARG 128.A N GLU 125.A O no hydrogen 2.699 N/A PHE 129.A N LEU 124.A O no hydrogen 2.748 N/A HIS 131.A N ASP 176.A OD1 no hydrogen 2.727 N/A ARG 132.A N ASP 176.A OD2 no hydrogen 2.780 N/A ALA 136.A N GLU 186.A OE2 no hydrogen 3.018 N/A ASN 138.A N ALA 135.A O no hydrogen 2.769 N/A ASN 138.A ND2 ASP 133.A O no hydrogen 2.414 N/A VAL 139.A N ALA 136.A O no hydrogen 2.943 N/A LEU 140.A N LYS 148.A O no hydrogen 2.613 N/A VAL 141.A N GLY 92.A O no hydrogen 2.749 N/A SER 142.A N CYS 146.A O no hydrogen 2.765 N/A SER 143.A N CYS 146.A O no hydrogen 3.256 N/A SER 143.A OG ASP 145.A OD2 no hydrogen 2.632 N/A ASP 145.A N SER 143.A OG no hydrogen 3.426 N/A CYS 146.A N SER 143.A O no hydrogen 3.103 N/A CYS 146.A SG HIS 69.A ND1 no hydrogen 3.865 N/A VAL 147.A N GLN 116.A OE1 no hydrogen 3.165 N/A LYS 148.A N LEU 140.A O no hydrogen 2.684 N/A LYS 148.A NZ GLU 87.A OE1 no hydrogen 3.346 N/A LEU 149.A N HIS 69.A O no hydrogen 3.194 N/A GLY 150.A N ASN 138.A O no hydrogen 2.895 N/A LEU 154.A N ASP 151.A O no hydrogen 3.087 N/A LEU 154.A N ASP 151.A OD2 no hydrogen 2.857 N/A SER 155.A N PHE 152.A O no hydrogen 3.124 N/A SER 155.A OG ASP 151.A O no hydrogen 2.489 N/A ILE 158.A N LEU 156.A O no hydrogen 2.952 N/A LYS 159.A NZ PHE 195.A O no hydrogen 2.943 N/A LYS 159.A NZ VAL 198.A O no hydrogen 2.679 N/A TRP 160.A N PRO 157.A O no hydrogen 2.793 N/A TRP 160.A NE1 GLU 186.A OE2 no hydrogen 3.028 N/A MET 161.A N ILE 158.A O no hydrogen 3.205 N/A GLU 164.A N GLU 164.A OE1 no hydrogen 2.927 N/A SER 165.A N ALA 162.A O no hydrogen 3.106 N/A SER 165.A OG ARG 170.A O no hydrogen 2.806 N/A ILE 166.A N ALA 162.A O no hydrogen 3.132 N/A ASN 167.A N PRO 163.A O no hydrogen 2.744 N/A ASN 167.A ND2 PRO 163.A O no hydrogen 3.192 N/A ASN 167.A ND2 GLU 208.A OE1 no hydrogen 3.094 N/A PHE 168.A N GLU 164.A O no hydrogen 2.962 N/A ARG 170.A N GLU 164.A O no hydrogen 3.237 N/A THR 172.A N SER 175.A OG no hydrogen 2.839 N/A SER 175.A N THR 172.A O no hydrogen 3.056 N/A SER 175.A OG THR 172.A O no hydrogen 2.557 N/A ASP 176.A N THR 172.A O no hydrogen 2.983 N/A VAL 177.A N SER 173.A O no hydrogen 2.918 N/A TRP 178.A N ALA 174.A O no hydrogen 3.419 N/A MET 179.A N SER 175.A O no hydrogen 3.163 N/A PHE 180.A N ASP 176.A O no hydrogen 2.754 N/A GLY 181.A N VAL 177.A O no hydrogen 2.826 N/A VAL 182.A N TRP 178.A O no hydrogen 2.998 N/A CYS 183.A N MET 179.A O no hydrogen 2.968 N/A MET 184.A N PHE 180.A O no hydrogen 2.804 N/A TRP 185.A N GLY 181.A O no hydrogen 3.178 N/A TRP 185.A NE1 PRO 214.A O no hydrogen 2.675 N/A GLU 186.A N VAL 182.A O no hydrogen 2.976 N/A ILE 187.A N CYS 183.A O no hydrogen 2.995 N/A LEU 188.A N MET 184.A O no hydrogen 3.066 N/A MET 189.A N TRP 185.A O no hydrogen 2.823 N/A HIS 190.A N ILE 187.A O no hydrogen 2.946 N/A GLY 191.A N GLU 186.A O no hydrogen 2.846 N/A VAL 198.A N PHE 195.A O no hydrogen 3.448 N/A ASP 202.A N LYS 199.A O no hydrogen 2.874 N/A ARG 206.A N ASP 202.A O no hydrogen 3.342 N/A ILE 207.A N VAL 203.A O no hydrogen 3.058 N/A GLU 208.A N ILE 204.A O no hydrogen 2.929 N/A ASN 209.A N GLY 205.A O no hydrogen 2.956 N/A GLY 210.A N ILE 207.A O no hydrogen 3.380 N/A GLU 211.A N ARG 206.A O no hydrogen 2.977 N/A ARG 212.A NE TRP 231.A O no hydrogen 2.896 N/A ARG 212.A NH1 ILE 207.A O no hydrogen 2.854 N/A ARG 212.A NH1 GLU 211.A O no hydrogen 3.295 N/A ARG 212.A NH2 TRP 231.A O no hydrogen 2.936 N/A CYS 219.A N PRO 216.A O no hydrogen 3.082 N/A CYS 219.A SG PRO 220.A O no hydrogen 3.666 N/A LEU 223.A N PRO 220.A O no hydrogen 2.822 N/A TYR 224.A N PRO 220.A O no hydrogen 3.382 N/A TYR 224.A OH LEU 213.A O no hydrogen 2.385 N/A SER 225.A N PRO 221.A O no hydrogen 2.987 N/A LEU 226.A N THR 222.A O no hydrogen 3.242 N/A MET 227.A N LEU 223.A O no hydrogen 3.066 N/A THR 228.A N TYR 224.A O no hydrogen 2.895 N/A THR 228.A OG1 TYR 224.A O no hydrogen 3.175 N/A THR 228.A OG1 SER 225.A O no hydrogen 2.664 N/A LYS 229.A N SER 225.A O no hydrogen 3.066 N/A CYS 230.A N LEU 226.A O no hydrogen 3.046 N/A CYS 230.A SG LEU 226.A O no hydrogen 3.328 N/A TRP 231.A N MET 227.A O no hydrogen 3.223 N/A TRP 231.A N THR 228.A O no hydrogen 3.240 N/A ALA 232.A N LYS 229.A O no hydrogen 3.395 N/A TYR 233.A OH GLU 208.A OE1 no hydrogen 2.988 N/A SER 236.A N ASP 234.A OD2 no hydrogen 3.488 N/A SER 236.A OG ASP 234.A OD2 no hydrogen 3.028 N/A ARG 237.A N ASP 234.A O no hydrogen 3.185 N/A ARG 238.A NE ALA 232.A O no hydrogen 2.672 N/A ARG 238.A NH1 GLU 164.A OE1 no hydrogen 2.973 N/A ARG 238.A NH1 ALA 232.A O no hydrogen 3.361 N/A ARG 238.A NH1 TYR 233.A O no hydrogen 3.112 N/A ARG 238.A NH2 GLU 164.A OE1 no hydrogen 3.533 N/A ARG 238.A NH2 GLU 164.A OE2 no hydrogen 3.161 N/A ARG 238.A NH2 ALA 174.A O no hydrogen 2.853 N/A ARG 240.A NH1 GLU 243.A OE2 no hydrogen 3.487 N/A PHE 241.A N GLU 125.A OE1 no hydrogen 3.481 N/A PHE 241.A N GLU 125.A OE2 no hydrogen 3.088 N/A GLU 243.A N ARG 240.A O no hydrogen 3.135 N/A LEU 244.A N ARG 240.A O no hydrogen 3.130 N/A LYS 245.A N PHE 241.A O no hydrogen 3.097 N/A ALA 246.A N THR 242.A O no hydrogen 3.396 N/A GLN 247.A N GLU 243.A O no hydrogen 3.103 N/A LEU 248.A N LEU 244.A O no hydrogen 2.801 N/A SER 249.A N LYS 245.A O no hydrogen 3.076 N/A THR 250.A OG1 ALA 246.A O no hydrogen 3.391 N/A THR 250.A OG1 GLN 247.A O no hydrogen 2.991 N/A ILE 251.A N GLN 247.A O no hydrogen 2.951 N/A LEU 252.A N LEU 248.A O no hydrogen 3.032 N/A GLU 253.A N SER 249.A O no hydrogen 3.162 N/A GLU 254.A N THR 250.A O no hydrogen 2.999 N/A GLU 255.A N ILE 251.A O no hydrogen 3.177 N/A GLU 255.A N LEU 252.A O no hydrogen 2.912 N/A LYS 256.A N LEU 252.A O no hydrogen 2.780 N/A LEU 257.A N GLU 253.A O no hydrogen 3.240 N/A