Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 5fff_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): LYS 5.A N SER 2.A OG no hydrogen 2.987 N/A ARG 6.A N SER 2.A O no hydrogen 2.896 N/A ARG 6.A NE MET 1.A O no hydrogen 3.227 N/A TRP 7.A N LEU 3.A O no hydrogen 3.084 N/A SER 8.A N LYS 5.A O no hydrogen 3.356 N/A LEU 9.A N PHE 34.A O no hydrogen 2.882 N/A GLU 10.A N SER 8.A OG no hydrogen 3.037 N/A THR 12.A N LEU 9.A O no hydrogen 3.053 N/A THR 12.A OG1 LEU 9.A O no hydrogen 2.727 N/A THR 13.A N ASN 91.A OD1 no hydrogen 2.962 N/A THR 13.A OG1 LYS 89.A O no hydrogen 2.768 N/A THR 13.A OG1 ASN 91.A OD1 no hydrogen 3.483 N/A ALA 14.A N ARG 37.A O no hydrogen 2.849 N/A LEU 15.A N ILE 92.A O no hydrogen 2.902 N/A VAL 16.A N TYR 39.A O no hydrogen 2.909 N/A THR 17.A N ILE 94.A O no hydrogen 3.129 N/A THR 17.A OG1 ILE 94.A O no hydrogen 3.494 N/A GLY 19.A N CYS 41.A O no hydrogen 3.111 N/A HIS 25.A N LYS 21.A O no hydrogen 3.132 N/A ALA 26.A N GLY 22.A O no hydrogen 3.181 N/A ILE 27.A N ILE 23.A O no hydrogen 2.840 N/A VAL 28.A N GLY 24.A O no hydrogen 2.944 N/A GLU 29.A N HIS 25.A O no hydrogen 3.157 N/A GLU 30.A N ALA 26.A O no hydrogen 2.930 N/A LEU 31.A N ILE 27.A O no hydrogen 2.913 N/A VAL 32.A N VAL 28.A O no hydrogen 3.018 N/A GLY 33.A N GLU 29.A O no hydrogen 2.924 N/A PHE 34.A N LEU 31.A O no hydrogen 3.082 N/A GLY 35.A N VAL 32.A O no hydrogen 2.944 N/A ALA 36.A N LEU 31.A O no hydrogen 3.078 N/A ARG 37.A N THR 12.A O no hydrogen 2.891 N/A VAL 38.A N ASP 61.A O no hydrogen 3.055 N/A TYR 39.A N ALA 14.A O no hydrogen 2.731 N/A TYR 39.A OH SER 65.A OG no hydrogen 2.638 N/A THR 40.A N THR 63.A O.A no hydrogen 2.910 N/A THR 40.A N THR 63.A O.B no hydrogen 2.868 N/A THR 40.A OG1 VAL 16.A O no hydrogen 2.646 N/A ASN 44.A N SER 42.A OG no hydrogen 3.270 N/A GLU 47.A N ASN 44.A OD1 no hydrogen 2.898 N/A LEU 48.A N ASN 44.A O no hydrogen 2.950 N/A ARG 49.A N GLU 45.A O no hydrogen 2.872 N/A ARG 49.A NH2 GLU 45.A OE1 no hydrogen 2.437 N/A LYS 50.A N ALA 46.A O no hydrogen 3.067 N/A CYS 51.A N GLU 47.A O no hydrogen 2.981 N/A CYS 51.A SG THR 20.A O no hydrogen 3.651 N/A CYS 51.A SG GLU 47.A O no hydrogen 3.534 N/A LEU 52.A N LEU 48.A O no hydrogen 2.887 N/A GLN 53.A N ARG 49.A O no hydrogen 2.889 N/A GLU 54.A N LYS 50.A O no hydrogen 2.867 N/A TRP 55.A N CYS 51.A O no hydrogen 2.903 N/A TRP 55.A NE1 GLU 29.A OE2 no hydrogen 2.801 N/A GLU 56.A N LEU 52.A O no hydrogen 2.853 N/A ASN 57.A N GLN 53.A O no hydrogen 2.833 N/A LEU 58.A N GLU 54.A O no hydrogen 3.080 N/A LYS 59.A N GLU 56.A O no hydrogen 2.866 N/A TYR 60.A N TRP 55.A O no hydrogen 2.716 N/A VAL 62.A N TYR 60.A O no hydrogen 2.955 N/A THR 63.A N.A VAL 38.A O no hydrogen 2.950 N/A THR 63.A N.B VAL 38.A O no hydrogen 2.936 N/A SER 65.A N THR 40.A O no hydrogen 3.272 N/A SER 65.A OG TYR 39.A OH no hydrogen 2.638 N/A CYS 67.A N SER 42.A O no hydrogen 2.909 N/A CYS 67.A SG GLU 74.A O no hydrogen 3.488 N/A ASP 68.A N GLU 74.A OE1 no hydrogen 2.921 N/A SER 70.A N ASP 68.A OD2 no hydrogen 2.919 N/A SER 70.A OG ASP 68.A OD2 no hydrogen 2.630 N/A SER 71.A N ASP 68.A O no hydrogen 3.021 N/A THR 73.A OG1 SER 71.A OG no hydrogen 3.237 N/A GLU 74.A N SER 71.A OG no hydrogen 3.176 N/A ARG 75.A N SER 71.A O no hydrogen 2.945 N/A ARG 75.A NE HIS 126.A ND1 no hydrogen 2.853 N/A ARG 75.A NH1 VAL 69.A O no hydrogen 2.810 N/A ARG 75.A NH2 HIS 126.A ND1 no hydrogen 3.358 N/A GLU 76.A N ARG 72.A O no hydrogen 3.043 N/A LYS 77.A N THR 73.A O no hydrogen 3.001 N/A LYS 77.A NZ VAL 66.A O no hydrogen 2.821 N/A LEU 78.A N GLU 74.A O no hydrogen 2.870 N/A ALA 79.A N ARG 75.A O no hydrogen 2.934 N/A GLU 80.A N GLU 76.A O no hydrogen 3.098 N/A GLU 81.A N LYS 77.A O no hydrogen 2.991 N/A VAL 82.A N LEU 78.A O no hydrogen 2.809 N/A SER 83.A N ALA 79.A O no hydrogen 2.964 N/A SER 84.A N GLU 80.A O no hydrogen 3.005 N/A SER 84.A OG.A GLU 80.A O no hydrogen 3.167 N/A VAL 85.A N GLU 81.A O no hydrogen 2.880 N/A PHE 86.A N VAL 82.A O no hydrogen 2.937 N/A ASN 87.A N SER 84.A O no hydrogen 3.363 N/A GLY 88.A N SER 83.A O no hydrogen 2.734 N/A LYS 89.A N PHE 86.A O no hydrogen 3.294 N/A LEU 90.A N MET 134.A O no hydrogen 2.999 N/A ASN 91.A N THR 13.A O no hydrogen 3.018 N/A ASN 91.A N THR 13.A OG1 no hydrogen 3.168 N/A ASN 91.A ND2 THR 140.A O no hydrogen 3.069 N/A ILE 92.A N THR 13.A O no hydrogen 3.005 N/A LEU 93.A N SER 142.A O no hydrogen 2.936 N/A ILE 94.A N LEU 15.A O no hydrogen 2.796 N/A ASN 95.A N VAL 144.A O no hydrogen 2.891 N/A ASN 95.A ND2 HIS 145.A ND1 no hydrogen 3.114 N/A ASN 96.A N THR 17.A OG1 no hydrogen 3.089 N/A ASN 96.A ND2 THR 17.A O no hydrogen 3.141 N/A ALA 97.A N THR 17.A OG1 no hydrogen 3.042 N/A GLY 99.A N ASN 120.A OD1 no hydrogen 2.845 N/A TYR 100.A OH HIS 158.A NE2 no hydrogen 2.928 N/A ASN 102.A ND2 TYR 100.A OH no hydrogen 2.879 N/A ASN 102.A ND2 PRO 156.A O no hydrogen 3.634 N/A LYS 103.A N GLY 157.A O no hydrogen 3.132 N/A LYS 103.A NZ ASP 112.A OD2 no hydrogen 2.718 N/A GLY 107.A N PRO 104.A O no hydrogen 2.789 N/A PHE 108.A N ILE 105.A O no hydrogen 3.420 N/A THR 109.A N ASP 112.A OD2 no hydrogen 3.002 N/A THR 109.A OG1 GLU 111.A OE1 no hydrogen 3.542 N/A ASP 112.A N THR 109.A OG1 no hydrogen 2.955 N/A PHE 113.A N THR 109.A O no hydrogen 3.102 N/A SER 114.A N ALA 110.A O no hydrogen 2.938 N/A SER 114.A OG.B ALA 110.A O no hydrogen 3.392 N/A SER 114.A OG.B GLU 111.A O no hydrogen 3.112 N/A PHE 115.A N GLU 111.A O no hydrogen 2.875 N/A LEU 116.A N ASP 112.A O no hydrogen 3.071 N/A VAL 117.A N PHE 113.A O no hydrogen 3.007 N/A ALA 118.A N SER 114.A O no hydrogen 3.014 N/A VAL 119.A N PHE 115.A O no hydrogen 3.089 N/A ASN 120.A N LEU 116.A O no hydrogen 2.978 N/A ASN 120.A ND2 GLY 99.A O no hydrogen 3.043 N/A ASN 120.A ND2 THR 164.A OG1 no hydrogen 3.040 N/A LEU 121.A N VAL 117.A O no hydrogen 3.003 N/A GLU 122.A N VAL 117.A O no hydrogen 2.886 N/A SER 123.A N ALA 118.A O no hydrogen 2.920 N/A SER 123.A OG VAL 119.A O no hydrogen 2.533 N/A PHE 125.A N LEU 121.A O no hydrogen 2.998 N/A HIS 126.A N GLU 122.A O no hydrogen 2.847 N/A LEU 127.A N SER 123.A O no hydrogen 2.925 N/A CYS 128.A N ALA 124.A O no hydrogen 2.900 N/A CYS 128.A SG ALA 124.A O no hydrogen 3.209 N/A GLN 129.A N PHE 125.A O no hydrogen 3.058 N/A LEU 130.A N HIS 126.A O no hydrogen 2.831 N/A ALA 131.A N LEU 127.A O no hydrogen 2.823 N/A HIS 132.A N GLN 129.A O no hydrogen 3.289 N/A HIS 132.A NE2 ASP 182.A OD2 no hydrogen 2.707 N/A LEU 135.A N ALA 131.A O no hydrogen 2.833 N/A LYS 136.A N HIS 132.A O no hydrogen 2.853 N/A ALA 137.A N PRO 133.A O no hydrogen 2.857 N/A SER 138.A N MET 134.A O no hydrogen 3.059 N/A SER 138.A OG LEU 90.A O no hydrogen 3.227 N/A SER 138.A OG LEU 135.A O no hydrogen 2.812 N/A SER 138.A OG THR 140.A O no hydrogen 2.956 N/A GLY 139.A N LYS 136.A O no hydrogen 3.067 N/A THR 140.A N SER 138.A OG no hydrogen 3.199 N/A GLY 141.A N ASN 183.A O no hydrogen 3.046 N/A SER 142.A N ASN 91.A O no hydrogen 2.772 N/A SER 142.A OG LEU 234.A O no hydrogen 3.338 N/A ILE 143.A N ARG 185.A O no hydrogen 2.785 N/A VAL 144.A N LEU 93.A O no hydrogen 2.878 N/A HIS 145.A N ASN 187.A O no hydrogen 2.954 N/A ILE 146.A N ASN 95.A O no hydrogen 3.079 N/A SER 147.A N.A ILE 189.A O no hydrogen 2.718 N/A SER 147.A N.B ILE 189.A O no hydrogen 2.736 N/A SER 147.A OG.A LYS 165.A O no hydrogen 3.289 N/A SER 147.A OG.A ASN 169.A OD1 no hydrogen 2.806 N/A SER 147.A OG.B ASN 169.A OD1 no hydrogen 3.204 N/A SER 147.A OG.B SER 188.A OG.A no hydrogen 2.555 N/A SER 147.A OG.B ILE 189.A O no hydrogen 3.108 N/A CYS 149.A N PRO 191.A O no hydrogen 2.867 N/A CYS 149.A SG PRO 191.A O no hydrogen 3.700 N/A CYS 150.A N SER 148.A OG no hydrogen 3.356 N/A CYS 150.A SG SER 148.A OG no hydrogen 2.992 N/A CYS 150.A SG HIS 158.A ND1 no hydrogen 3.243 N/A CYS 150.A SG SER 162.A OG no hydrogen 2.983 N/A ALA 151.A N SER 148.A O no hydrogen 3.152 N/A GLN 152.A N CYS 149.A O no hydrogen 3.256 N/A HIS 158.A N ILE 155.A O no hydrogen 3.015 N/A SER 162.A N HIS 158.A O no hydrogen 2.686 N/A SER 162.A OG CYS 150.A O no hydrogen 3.192 N/A SER 162.A OG HIS 158.A O no hydrogen 2.979 N/A SER 163.A N SER 159.A O no hydrogen 2.970 N/A SER 163.A OG SER 159.A O no hydrogen 2.734 N/A THR 164.A N ILE 160.A O no hydrogen 2.933 N/A THR 164.A OG1 ILE 160.A O no hydrogen 3.468 N/A THR 164.A OG1 TYR 161.A O no hydrogen 2.769 N/A LYS 165.A N TYR 161.A O no hydrogen 3.066 N/A LYS 165.A NZ ILE 146.A O no hydrogen 2.852 N/A GLY 166.A N SER 162.A O no hydrogen 2.749 N/A ALA 167.A N SER 163.A O no hydrogen 2.951 N/A ILE 168.A N THR 164.A O no hydrogen 3.064 N/A ASN 169.A N LYS 165.A O no hydrogen 2.928 N/A GLN 170.A N GLY 166.A O no hydrogen 3.170 N/A GLN 170.A NE2 ASN 174.A OD1 no hydrogen 2.854 N/A LEU 171.A N ALA 167.A O no hydrogen 2.907 N/A THR 172.A N ILE 168.A O no hydrogen 2.923 N/A THR 172.A OG1 ILE 168.A O no hydrogen 2.898 N/A THR 172.A OG1 SER 188.A OG.B no hydrogen 2.537 N/A ARG 173.A NE GLN 170.A OE1 no hydrogen 2.824 N/A ARG 173.A NH2 GLN 170.A OE1 no hydrogen 2.925 N/A ASN 174.A N GLN 170.A O no hydrogen 3.163 N/A LEU 175.A N LEU 171.A O no hydrogen 2.830 N/A ALA 176.A N THR 172.A O no hydrogen 2.969 N/A CYS 177.A N ARG 173.A O no hydrogen 3.156 N/A CYS 177.A SG ARG 173.A O no hydrogen 3.573 N/A GLU 178.A N ASN 174.A O no hydrogen 2.863 N/A TRP 179.A N LEU 175.A O no hydrogen 3.041 N/A LYS 181.A NZ GLU 178.A O no hydrogen 3.411 N/A ASP 182.A N TRP 179.A O no hydrogen 3.006 N/A ASN 183.A N ALA 180.A O no hydrogen 2.834 N/A ASN 183.A ND2 GLY 139.A O no hydrogen 2.653 N/A ILE 184.A N TRP 179.A O no hydrogen 3.354 N/A ARG 185.A N GLY 141.A O no hydrogen 2.935 N/A ARG 185.A NH1 LEU 234.A O no hydrogen 2.922 N/A ARG 185.A NH1 ILE 242.A O no hydrogen 3.066 N/A ARG 185.A NH2 LEU 234.A O no hydrogen 2.759 N/A THR 186.A N THR 243.A OG1 no hydrogen 3.162 N/A ASN 187.A N ILE 143.A O no hydrogen 2.960 N/A ASN 187.A ND2 ILE 242.A O no hydrogen 3.028 N/A SER 188.A N GLN 245.A O no hydrogen 2.842 N/A SER 188.A OG.A ASN 169.A OD1 no hydrogen 3.185 N/A SER 188.A OG.B THR 172.A OG1 no hydrogen 2.537 N/A ILE 189.A N HIS 145.A O no hydrogen 2.907 N/A ALA 190.A N ILE 247.A O no hydrogen 2.799 N/A GLY 192.A N VAL 249.A O no hydrogen 2.939 N/A ARG 195.A N GLY 222.A O no hydrogen 2.870 N/A ARG 195.A NE.A GLU 223.A OE2 no hydrogen 2.980 N/A ARG 195.A NE.B GLU 223.A OE2 no hydrogen 3.244 N/A ARG 195.A NH1.B GLU 223.A OE1 no hydrogen 2.267 N/A THR 196.A N THR 199.A OG1 no hydrogen 3.117 N/A THR 199.A N THR 196.A O no hydrogen 2.917 N/A THR 199.A OG1 ILE 194.A O no hydrogen 2.733 N/A THR 199.A OG1 THR 196.A O no hydrogen 3.198 N/A GLU 200.A N PRO 197.A O no hydrogen 3.127 N/A VAL 203.A N THR 199.A O no hydrogen 2.931 N/A ILE 204.A N GLU 200.A O no hydrogen 3.084 N/A ASP 205.A N SER 201.A O no hydrogen 3.138 N/A ASP 205.A N PHE 202.A O no hydrogen 3.089 N/A LYS 206.A NZ VAL 203.A O no hydrogen 2.818 N/A ALA 208.A N ASP 205.A OD2 no hydrogen 3.285 N/A LEU 209.A N ASP 205.A O no hydrogen 2.850 N/A ASP 210.A N LYS 206.A O no hydrogen 2.805 N/A ARG 211.A N ASP 207.A O no hydrogen 3.114 N/A GLU 212.A N ALA 208.A O no hydrogen 3.086 N/A VAL 213.A N LEU 209.A O no hydrogen 2.879 N/A SER 214.A N ASP 210.A O no hydrogen 2.930 N/A SER 214.A OG.A ARG 211.A O no hydrogen 2.656 N/A SER 214.A OG.B ASP 210.A O no hydrogen 2.777 N/A ARG 215.A N GLU 212.A O no hydrogen 2.960 N/A ARG 215.A NH1 GLY 257.A OXT no hydrogen 2.960 N/A ARG 215.A NH2 ASN 256.A O no hydrogen 2.921 N/A ARG 215.A NH2 GLY 257.A OXT no hydrogen 3.252 N/A VAL 216.A N VAL 213.A O no hydrogen 3.011 N/A PHE 218.A N GLY 251.A O no hydrogen 3.374 N/A GLY 219.A N VAL 216.A O no hydrogen 2.794 N/A ARG 220.A NH1 ILE 221.A O no hydrogen 3.123 N/A ARG 220.A NH1 GLU 226.A OE1 no hydrogen 2.949 N/A ARG 220.A NH1 GLU 226.A OE2 no hydrogen 3.465 N/A ARG 220.A NH2 GLU 226.A OE2 no hydrogen 2.805 N/A GLY 222.A N ALA 193.A O no hydrogen 2.845 N/A GLU 223.A N GLU 226.A OE1 no hydrogen 2.813 N/A GLU 225.A N GLU 225.A OE1 no hydrogen 2.817 N/A GLU 226.A N GLU 223.A O no hydrogen 2.893 N/A VAL 227.A N PRO 224.A O no hydrogen 3.050 N/A ALA 228.A N PRO 224.A O no hydrogen 3.006 N/A SER 229.A N GLU 225.A O no hydrogen 3.091 N/A SER 229.A OG.A GLU 30.A OE1 no hydrogen 2.948 N/A SER 229.A OG.A GLU 225.A O no hydrogen 2.904 N/A SER 229.A OG.B GLU 225.A O no hydrogen 3.304 N/A ALA 231.A N VAL 227.A O no hydrogen 3.150 N/A ALA 232.A N ALA 228.A O no hydrogen 2.961 N/A PHE 233.A N SER 229.A O no hydrogen 2.904 N/A LEU 234.A N LEU 230.A O no hydrogen 2.885 N/A CYS 235.A N ALA 232.A O no hydrogen 3.005 N/A CYS 235.A SG SER 142.A OG no hydrogen 3.416 N/A CYS 235.A SG ALA 231.A O no hydrogen 3.374 N/A MET 236.A N PHE 233.A O no hydrogen 3.034 N/A SER 238.A N ARG 6.A O no hydrogen 2.950 N/A SER 238.A OG.A ARG 6.A O no hydrogen 3.383 N/A SER 238.A OG.B ARG 6.A O no hydrogen 3.126 N/A ALA 239.A N MET 236.A O no hydrogen 2.941 N/A SER 240.A N PRO 237.A O no hydrogen 2.992 N/A SER 240.A OG PRO 237.A O no hydrogen 2.983 N/A ILE 242.A N ALA 239.A O no hydrogen 2.966 N/A GLY 244.A N THR 186.A O no hydrogen 2.726 N/A GLN 245.A N ASN 187.A OD1 no hydrogen 3.009 N/A GLN 245.A NE2.B THR 243.A O no hydrogen 2.845 N/A ILE 247.A N SER 188.A O no hydrogen 2.916 N/A CYS 248.A SG GLN 152.A OE1 no hydrogen 3.146 N/A VAL 249.A N ALA 190.A O no hydrogen 3.011 N/A GLY 252.A N ASP 250.A OD1 no hydrogen 2.923 N/A ARG 253.A N ASP 250.A O no hydrogen 3.025 N/A ARG 253.A NE GLU 212.A OE2 no hydrogen 2.657 N/A ARG 253.A NH2 GLU 212.A OE1 no hydrogen 2.993 N/A ARG 253.A NH2 GLU 212.A OE2 no hydrogen 3.535 N/A THR 254.A N ASP 250.A OD2 no hydrogen 2.941 N/A THR 254.A OG1 ASP 250.A OD2 no hydrogen 2.889 N/A ILE 255.A N GLY 252.A O no hydrogen 3.282 N/A ASN 256.A N ARG 253.A O no hydrogen 3.395 N/A ASN 256.A ND2 ARG 215.A O no hydrogen 2.924 N/A