Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4wwj_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ARG 6.A NE GLU 206.A OE2 no hydrogen 2.807 N/A ARG 6.A NH1 GLY 8.A O no hydrogen 2.819 N/A ARG 6.A NH2 GLU 206.A OE2 no hydrogen 3.485 N/A GLU 12.A N PRO 9.A O no hydrogen 3.346 N/A SER 15.A N GLU 12.A O no hydrogen 2.965 N/A SER 15.A OG PRO 9.A O no hydrogen 2.563 N/A SER 15.A OG GLU 12.A O no hydrogen 3.475 N/A TYR 16.A N ALA 13.A O no hydrogen 3.090 N/A TYR 16.A OH LEU 10.A O no hydrogen 2.620 N/A TRP 19.A NE1 GLY 213.A O no hydrogen 2.861 N/A THR 20.A N PRO 17.A O no hydrogen 2.997 N/A GLN 21.A N PRO 17.A O no hydrogen 3.089 N/A GLN 22.A N ALA 18.A O no hydrogen 2.830 N/A GLN 22.A NE2 ASP 26.A OD1 no hydrogen 2.943 N/A LEU 23.A N TRP 19.A O no hydrogen 2.899 N/A ILE 24.A N THR 20.A O no hydrogen 2.897 N/A GLN 25.A N GLN 21.A O no hydrogen 2.907 N/A ASP 26.A N GLN 22.A O no hydrogen 2.755 N/A CYS 27.A N LEU 23.A O no hydrogen 2.974 N/A CYS 27.A N ILE 24.A O no hydrogen 3.204 N/A CYS 27.A SG LEU 23.A O no hydrogen 3.337 N/A SER 28.A N GLN 25.A O no hydrogen 3.103 N/A SER 28.A OG GLN 25.A O no hydrogen 2.628 N/A LYS 31.A N CYS 27.A O no hydrogen 2.990 N/A LYS 31.A NZ GLU 163.A OE2 no hydrogen 2.719 N/A ARG 32.A N SER 28.A O no hydrogen 2.825 N/A ARG 32.A NE GLU 29.A OE1 no hydrogen 2.936 N/A ARG 32.A NH1 GLU 36.A OE1 no hydrogen 2.919 N/A ARG 32.A NH2 GLU 29.A OE2 no hydrogen 2.750 N/A ARG 33.A N GLU 29.A O no hydrogen 3.166 N/A ARG 33.A NH2 ASP 233.A OD1 no hydrogen 3.092 N/A VAL 34.A N LYS 31.A O no hydrogen 3.005 N/A VAL 35.A N LYS 31.A O no hydrogen 2.945 N/A GLU 36.A N ARG 32.A O no hydrogen 3.084 N/A HIS 37.A N VAL 34.A O no hydrogen 3.048 N/A HIS 37.A NE2 GLU 240.A OE2 no hydrogen 2.784 N/A LEU 39.A N HIS 37.A ND1 no hydrogen 2.968 N/A TYR 40.A N HIS 37.A O no hydrogen 2.952 N/A TYR 40.A OH TYR 56.A OH no hydrogen 2.694 N/A GLN 41.A N HIS 37.A O no hydrogen 3.266 N/A ARG 42.A N GLU 38.A O no hydrogen 2.967 N/A ARG 42.A NH2 GLU 246.A OE2 no hydrogen 2.655 N/A MET 43.A N LEU 39.A O no hydrogen 2.942 N/A ARG 44.A N TYR 40.A O no hydrogen 2.989 N/A ARG 44.A NE ASP 45.A OD1 no hydrogen 2.940 N/A ARG 44.A NH1 ASP 45.A OD1 no hydrogen 3.448 N/A ARG 44.A NH1 ASP 45.A OD2 no hydrogen 3.064 N/A ASP 45.A N ARG 42.A O no hydrogen 3.172 N/A ASN 46.A N MET 43.A O no hydrogen 2.963 N/A LYS 47.A N ARG 42.A O no hydrogen 2.890 N/A SER 49.A N GLU 246.A OE1 no hydrogen 3.081 N/A SER 49.A N GLU 246.A OE2 no hydrogen 3.178 N/A SER 49.A OG GLU 246.A OE1 no hydrogen 2.605 N/A VAL 52.A N SER 49.A OG no hydrogen 3.182 N/A MET 53.A N SER 49.A O no hydrogen 2.956 N/A ARG 54.A N ALA 50.A O no hydrogen 3.031 N/A ARG 54.A NH1 GLY 115.A O no hydrogen 2.969 N/A ARG 54.A NH2 ASP 120.A OD2 no hydrogen 2.959 N/A GLN 55.A N LYS 51.A O no hydrogen 3.064 N/A TYR 56.A N VAL 52.A O no hydrogen 2.809 N/A TYR 56.A OH TYR 40.A OH no hydrogen 2.694 N/A LEU 57.A N MET 53.A O no hydrogen 3.029 N/A ILE 58.A N ARG 54.A O no hydrogen 2.989 N/A GLY 59.A N GLN 55.A O no hydrogen 2.806 N/A GLY 60.A N TYR 56.A O no hydrogen 2.898 N/A TRP 61.A N ILE 58.A O no hydrogen 3.349 N/A VAL 64.A N GLY 60.A O no hydrogen 3.405 N/A GLU 65.A N TRP 61.A O no hydrogen 2.809 N/A GLN 66.A N PRO 62.A O no hydrogen 2.855 N/A PHE 67.A N VAL 64.A O no hydrogen 3.368 N/A TYR 70.A N GLN 66.A O no hydrogen 3.048 N/A TYR 70.A OH GLN 66.A OE1 no hydrogen 2.756 N/A MET 71.A N PHE 67.A O no hydrogen 3.353 N/A ALA 72.A N ALA 68.A O no hydrogen 2.818 N/A GLN 73.A N LEU 69.A O no hydrogen 3.029 N/A ASN 74.A N TYR 70.A O no hydrogen 3.080 N/A LEU 75.A N MET 71.A O no hydrogen 2.798 N/A THR 76.A N ALA 72.A O no hydrogen 3.076 N/A THR 76.A OG1 ALA 72.A O no hydrogen 2.962 N/A LYS 77.A N ASN 74.A O no hydrogen 3.046 N/A LYS 77.A NZ ASN 74.A OD1 no hydrogen 2.847 N/A LYS 77.A NZ THR 140.A O no hydrogen 3.546 N/A LYS 77.A NZ SER 141.A O no hydrogen 2.689 N/A LYS 77.A NZ ASP 144.A O no hydrogen 2.714 N/A THR 78.A N LEU 75.A O no hydrogen 3.065 N/A THR 78.A OG1 LEU 75.A O no hydrogen 2.714 N/A ARG 79.A N GLU 86.A OE2 no hydrogen 2.737 N/A ARG 79.A NH2 THR 76.A O no hydrogen 2.851 N/A ARG 79.A NH2 THR 78.A O no hydrogen 2.863 N/A ALA 81.A N ASP 87.A OD1 no hydrogen 2.846 N/A ARG 82.A NE GLU 86.A OE1 no hydrogen 3.337 N/A ARG 82.A NH2 GLU 86.A OE2 no hydrogen 2.952 N/A GLU 86.A N HIS 83.A O no hydrogen 2.994 N/A ALA 89.A N GLY 85.A O no hydrogen 2.992 N/A ARG 90.A N GLU 86.A O no hydrogen 2.959 N/A ARG 90.A NE THR 78.A OG1 no hydrogen 3.417 N/A ARG 90.A NH2 THR 78.A O no hydrogen 3.031 N/A ARG 90.A NH2 THR 78.A OG1 no hydrogen 3.085 N/A ARG 91.A N ASP 87.A O no hydrogen 2.947 N/A TRP 92.A N MET 88.A O no hydrogen 2.963 N/A TRP 92.A NE1 GLU 203.A OE1 no hydrogen 2.921 N/A LEU 93.A N ALA 89.A O no hydrogen 2.848 N/A MET 94.A N ARG 90.A O no hydrogen 3.028 N/A ARG 95.A N ARG 91.A O no hydrogen 3.023 N/A ASN 96.A N TRP 92.A O no hydrogen 2.831 N/A ASN 96.A ND2 TRP 92.A O no hydrogen 2.858 N/A ILE 97.A N LEU 93.A O no hydrogen 2.911 N/A ARG 98.A NH1 ARG 98.A O no hydrogen 2.939 N/A GLU 100.A N ASN 96.A O no hydrogen 3.365 N/A GLU 100.A N ILE 97.A O no hydrogen 3.298 N/A LEU 101.A N ARG 98.A O no hydrogen 2.936 N/A HIS 103.A N GLU 100.A O no hydrogen 2.983 N/A TYR 106.A N ASN 102.A O no hydrogen 2.928 N/A TRP 107.A N HIS 103.A O no hydrogen 3.067 N/A TRP 107.A NE1 LEU 57.A O no hydrogen 2.878 N/A VAL 108.A N ALA 104.A O no hydrogen 3.020 N/A HIS 109.A N ASP 105.A O no hydrogen 2.931 N/A TRP 110.A N TYR 106.A O no hydrogen 3.005 N/A TRP 110.A NE1 TYR 174.A OH no hydrogen 2.808 N/A SER 111.A N TRP 107.A O no hydrogen 2.903 N/A SER 111.A OG TRP 107.A O no hydrogen 2.776 N/A ARG 112.A N VAL 108.A O no hydrogen 2.936 N/A ARG 112.A NH1 ARG 112.A O no hydrogen 3.242 N/A ALA 113.A N HIS 109.A O no hydrogen 3.177 N/A HIS 114.A N SER 111.A O no hydrogen 2.871 N/A HIS 114.A NE2 TYR 174.A OH no hydrogen 2.565 N/A GLY 115.A N ARG 112.A O no hydrogen 2.872 N/A VAL 116.A N SER 111.A O no hydrogen 3.059 N/A THR 117.A N ASP 120.A OD2 no hydrogen 2.940 N/A ASP 120.A N THR 117.A OG1 no hydrogen 3.102 N/A LEU 121.A N THR 117.A O no hydrogen 3.041 N/A GLN 122.A N LEU 118.A O no hydrogen 2.863 N/A ALA 123.A N GLU 119.A O no hydrogen 2.980 N/A VAL 126.A N GLN 124.A O no hydrogen 3.084 N/A GLU 129.A N GLU 129.A OE1 no hydrogen 2.682 N/A LEU 130.A N PRO 127.A O no hydrogen 2.975 N/A HIS 131.A N PRO 128.A O no hydrogen 3.124 N/A SER 134.A N HIS 131.A O no hydrogen 3.087 N/A SER 134.A OG HIS 131.A O no hydrogen 2.898 N/A HIS 135.A N HIS 131.A O no hydrogen 3.396 N/A TRP 136.A N ALA 132.A O no hydrogen 3.002 N/A TRP 136.A NE1 SER 231.A OG no hydrogen 2.896 N/A CYS 137.A N LEU 133.A O no hydrogen 2.949 N/A CYS 137.A SG LEU 133.A O no hydrogen 3.292 N/A TRP 138.A N SER 134.A O no hydrogen 2.940 N/A HIS 139.A N HIS 135.A O no hydrogen 2.899 N/A THR 140.A N TRP 136.A O no hydrogen 2.917 N/A THR 140.A OG1 ASP 144.A OD2 no hydrogen 2.635 N/A SER 141.A N CYS 137.A O no hydrogen 3.085 N/A SER 141.A OG CYS 137.A O no hydrogen 2.721 N/A SER 142.A N TRP 138.A O no hydrogen 2.799 N/A ALA 143.A N HIS 139.A O no hydrogen 2.900 N/A ASP 144.A N THR 140.A O no hydrogen 2.901 N/A VAL 148.A N SER 145.A OG no hydrogen 3.422 N/A ALA 149.A N SER 145.A O no hydrogen 3.043 N/A ILE 150.A N LEU 146.A O no hydrogen 2.808 N/A ALA 151.A N ILE 147.A O no hydrogen 3.176 N/A ALA 152.A N VAL 148.A O no hydrogen 2.999 N/A THR 153.A N ALA 149.A O no hydrogen 3.141 N/A THR 153.A N ILE 150.A O no hydrogen 3.330 N/A THR 153.A OG1 ALA 149.A O no hydrogen 2.782 N/A ASN 154.A N ILE 150.A O no hydrogen 2.836 N/A TYR 155.A N ILE 150.A O no hydrogen 3.063 N/A ALA 156.A N ALA 151.A O no hydrogen 2.922 N/A GLU 158.A N THR 153.A O no hydrogen 3.212 N/A GLY 159.A N TYR 155.A O no hydrogen 3.015 N/A ALA 160.A N ALA 156.A O no hydrogen 3.030 N/A THR 161.A N ILE 157.A O no hydrogen 2.814 N/A THR 161.A OG1 ILE 157.A O no hydrogen 2.861 N/A GLY 162.A N GLU 158.A O no hydrogen 3.002 N/A GLU 163.A N GLY 159.A O no hydrogen 3.334 N/A GLU 163.A N ALA 160.A O no hydrogen 3.091 N/A TRP 164.A N ALA 160.A O no hydrogen 2.948 N/A SER 165.A N THR 161.A O no hydrogen 2.968 N/A SER 165.A OG THR 161.A O no hydrogen 2.759 N/A SER 165.A OG GLY 162.A O no hydrogen 3.109 N/A ALA 166.A N GLY 162.A O no hydrogen 3.123 N/A LEU 167.A N GLU 163.A O no hydrogen 3.034 N/A VAL 168.A N TRP 164.A O no hydrogen 2.904 N/A CYS 169.A N SER 165.A O no hydrogen 3.055 N/A CYS 169.A N ALA 166.A O no hydrogen 3.211 N/A CYS 169.A SG SER 165.A O no hydrogen 3.430 N/A SER 170.A N LEU 167.A O no hydrogen 3.206 N/A SER 170.A OG LEU 167.A O no hydrogen 2.639 N/A ASN 171.A ND2 ASP 45.A OD1 no hydrogen 3.035 N/A ILE 173.A N ASN 171.A OD1 no hydrogen 3.026 N/A TYR 174.A N ARG 44.A O no hydrogen 3.105 N/A TYR 174.A OH HIS 114.A NE2 no hydrogen 2.565 N/A ALA 176.A N GLY 172.A O no hydrogen 2.841 N/A ALA 177.A N ILE 173.A O no hydrogen 3.076 N/A PHE 178.A N ALA 175.A O no hydrogen 3.254 N/A GLU 181.A N GLU 181.A OE1 no hydrogen 2.862 N/A ASP 182.A N PRO 179.A O no hydrogen 2.991 N/A ARG 183.A N GLU 180.A O no hydrogen 3.442 N/A ARG 183.A NE ALA 175.A O no hydrogen 2.869 N/A ARG 183.A NH2 PHE 178.A O no hydrogen 2.880 N/A ALA 186.A N ASP 182.A O no hydrogen 3.094 N/A MET 187.A N ARG 183.A O no hydrogen 2.824 N/A LYS 191.A N.A MET 187.A O no hydrogen 2.840 N/A LYS 191.A N.B MET 187.A O no hydrogen 2.785 N/A LYS 191.A NZ.B GLN 195.A OE1 no hydrogen 3.225 N/A LYS 191.A NZ.B TYR 196.A OH no hydrogen 3.371 N/A MET 192.A N LYS 188.A O no hydrogen 2.938 N/A HIS 193.A N TRP 189.A O no hydrogen 3.231 N/A HIS 193.A N LEU 190.A O no hydrogen 3.163 N/A HIS 193.A ND1 TRP 189.A O no hydrogen 2.725 N/A ALA 194.A N LEU 190.A O no hydrogen 2.844 N/A ALA 194.A N LYS 191.A O.B no hydrogen 3.320 N/A GLN 195.A N LYS 191.A O.A no hydrogen 3.333 N/A GLN 195.A N LYS 191.A O.B no hydrogen 3.248 N/A HIS 200.A N ASP 197.A O no hydrogen 3.278 N/A HIS 200.A ND1 GLU 203.A OE1 no hydrogen 3.352 N/A GLU 203.A N ALA 199.A O no hydrogen 2.808 N/A ALA 204.A N HIS 200.A O no hydrogen 2.947 N/A LEU 205.A N PRO 201.A O no hydrogen 2.892 N/A GLU 206.A N TRP 202.A O no hydrogen 2.919 N/A ILE 207.A N GLU 203.A O no hydrogen 3.066 N/A ILE 208.A N ALA 204.A O no hydrogen 2.906 N/A VAL 209.A N LEU 205.A O no hydrogen 2.735 N/A THR 210.A N GLU 206.A O no hydrogen 2.897 N/A THR 210.A OG1 GLU 206.A O no hydrogen 2.699 N/A LEU 211.A N ILE 207.A O no hydrogen 2.908 N/A ALA 212.A N ILE 208.A O no hydrogen 2.957 N/A GLY 213.A N VAL 209.A O no hydrogen 2.760 N/A LEU 214.A N ASP 2.A O no hydrogen 2.740 N/A LEU 220.A N THR 217.A OG1 no hydrogen 3.054 N/A GLN 221.A N THR 217.A O no hydrogen 3.018 N/A ALA 222.A N LYS 218.A O no hydrogen 3.005 N/A GLU 223.A N ALA 219.A O no hydrogen 3.056 N/A LEU 224.A N LEU 220.A O no hydrogen 2.971 N/A ARG 225.A N GLN 221.A O no hydrogen 2.913 N/A GLN 226.A N ALA 222.A O no hydrogen 2.838 N/A ALA 227.A N GLU 223.A O no hydrogen 3.026 N/A ILE 228.A N LEU 224.A O no hydrogen 2.931 N/A CYS 229.A N ARG 225.A O no hydrogen 2.989 N/A CYS 229.A SG SER 30.A OG no hydrogen 3.673 N/A CYS 229.A SG ARG 225.A O no hydrogen 3.430 N/A LYS 230.A N GLN 226.A O no hydrogen 2.889 N/A SER 231.A N ALA 227.A O no hydrogen 3.120 N/A SER 231.A OG ALA 152.A O no hydrogen 2.675 N/A SER 231.A OG ALA 227.A O no hydrogen 3.537 N/A TYR 232.A N ILE 228.A O no hydrogen 3.100 N/A ASP 233.A N CYS 229.A O no hydrogen 2.775 N/A TYR 234.A N LYS 230.A O no hydrogen 2.920 N/A MET 235.A N SER 231.A O no hydrogen 3.008 N/A TYR 236.A N TYR 232.A O no hydrogen 2.898 N/A LEU 237.A N ASP 233.A O no hydrogen 2.849 N/A PHE 238.A N TYR 234.A O no hydrogen 3.130 N/A LEU 239.A N MET 235.A O no hydrogen 2.950 N/A GLU 240.A N TYR 236.A O no hydrogen 2.861 N/A ARG 241.A N LEU 237.A O no hydrogen 3.114 N/A ARG 241.A NH1 ARG 241.A O no hydrogen 3.564 N/A CYS 242.A N PHE 238.A O no hydrogen 3.042 N/A CYS 242.A SG PHE 238.A O no hydrogen 3.556 N/A MET 243.A N LEU 239.A O no hydrogen 2.956 N/A GLN 244.A N GLU 240.A O no hydrogen 3.031 N/A GLN 245.A N ARG 241.A O no hydrogen 3.264 N/A GLU 246.A N CYS 242.A O no hydrogen 2.905 N/A LYS 247.A N MET 243.A O no hydrogen 2.975 N/A THR 248.A N GLN 244.A O no hydrogen 3.288 N/A THR 248.A OG1 GLN 244.A O no hydrogen 3.282 N/A ALA 249.A N GLN 245.A O no hydrogen 2.906 N/A VAL 250.A N GLU 246.A O no hydrogen 3.031 N/A THR 251.A N LYS 247.A O no hydrogen 2.988 N/A THR 251.A OG1 LYS 247.A O no hydrogen 2.902 N/A ARG 252.A N THR 248.A O no hydrogen 3.051 N/A GLU 253.A N ALA 249.A O no hydrogen 3.344 N/A ARG 254.A N VAL 250.A O no hydrogen 3.020 N/A ARG 254.A N THR 251.A O no hydrogen 3.145 N/A LEU 255.A N THR 251.A O no hydrogen 3.060 N/A ALA 256.A N ARG 252.A O no hydrogen 2.950 N/A