Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 5ff9_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLU 3.A N GLU 3.A OE2 no hydrogen 2.549 N/A LYS 4.A N SER 1.A OG no hydrogen 3.025 N/A ARG 5.A N SER 1.A O no hydrogen 2.954 N/A TRP 6.A N LEU 2.A O no hydrogen 2.981 N/A LEU 8.A N PHE 33.A O no hydrogen 3.279 N/A GLU 9.A N SER 7.A OG no hydrogen 3.264 N/A THR 11.A N LEU 8.A O no hydrogen 3.301 N/A THR 11.A OG1 THR 12.A O no hydrogen 3.289 N/A THR 12.A N ASN 90.A OD1 no hydrogen 2.991 N/A THR 12.A OG1 LYS 88.A O no hydrogen 2.753 N/A ALA 13.A N ARG 36.A O no hydrogen 2.927 N/A LEU 14.A N ILE 91.A O no hydrogen 2.910 N/A VAL 15.A N TYR 38.A O no hydrogen 2.848 N/A THR 16.A N ILE 93.A O no hydrogen 3.141 N/A THR 16.A OG1 ILE 93.A O no hydrogen 3.466 N/A GLY 18.A N CYS 40.A O no hydrogen 3.295 N/A HIS 24.A N LYS 20.A O no hydrogen 3.406 N/A ALA 25.A N GLY 21.A O no hydrogen 3.112 N/A ILE 26.A N ILE 22.A O no hydrogen 2.798 N/A VAL 27.A N GLY 23.A O no hydrogen 2.938 N/A GLU 28.A N HIS 24.A O no hydrogen 3.240 N/A GLU 29.A N ALA 25.A O no hydrogen 2.842 N/A LEU 30.A N ILE 26.A O no hydrogen 2.882 N/A VAL 31.A N VAL 27.A O no hydrogen 3.037 N/A GLY 32.A N GLU 28.A O no hydrogen 2.880 N/A PHE 33.A N LEU 30.A O no hydrogen 3.084 N/A GLY 34.A N VAL 31.A O no hydrogen 2.874 N/A ALA 35.A N LEU 30.A O no hydrogen 3.082 N/A ARG 36.A N THR 11.A O no hydrogen 2.991 N/A VAL 37.A N ASP 60.A O no hydrogen 3.083 N/A TYR 38.A N ALA 13.A O no hydrogen 2.748 N/A TYR 38.A OH SER 64.A OG no hydrogen 2.878 N/A TYR 38.A OH GLU 80.A OE1 no hydrogen 2.443 N/A THR 39.A N THR 62.A O no hydrogen 2.874 N/A THR 39.A OG1 VAL 15.A O no hydrogen 2.478 N/A CYS 40.A N THR 39.A OG1 no hydrogen 2.771 N/A ASN 43.A N SER 41.A OG no hydrogen 2.976 N/A GLU 46.A N ASN 43.A OD1 no hydrogen 3.089 N/A LEU 47.A N ASN 43.A O no hydrogen 3.103 N/A ARG 48.A N GLU 44.A O no hydrogen 2.900 N/A ARG 48.A NE GLU 44.A OE2 no hydrogen 3.043 N/A ARG 48.A NH2 GLU 44.A OE2 no hydrogen 2.744 N/A LYS 49.A N ALA 45.A O no hydrogen 3.073 N/A CYS 50.A N GLU 46.A O no hydrogen 2.908 N/A CYS 50.A SG THR 19.A O no hydrogen 3.626 N/A CYS 50.A SG GLU 46.A O no hydrogen 3.366 N/A LEU 51.A N LEU 47.A O no hydrogen 2.841 N/A GLN 52.A N ARG 48.A O no hydrogen 2.765 N/A GLU 53.A N LYS 49.A O no hydrogen 2.697 N/A TRP 54.A N CYS 50.A O no hydrogen 2.783 N/A TRP 54.A NE1 GLU 28.A OE1 no hydrogen 2.918 N/A GLU 55.A N LEU 51.A O no hydrogen 2.735 N/A ASN 56.A N GLN 52.A O no hydrogen 2.929 N/A LEU 57.A N GLU 53.A O no hydrogen 3.179 N/A LEU 57.A N TRP 54.A O no hydrogen 3.192 N/A LYS 58.A N GLU 55.A O no hydrogen 2.966 N/A TYR 59.A N TRP 54.A O no hydrogen 2.900 N/A THR 62.A N VAL 37.A O no hydrogen 2.868 N/A SER 64.A N THR 39.A O no hydrogen 3.276 N/A SER 64.A OG TYR 38.A OH no hydrogen 2.878 N/A CYS 66.A N SER 41.A O no hydrogen 2.954 N/A CYS 66.A SG GLU 73.A O no hydrogen 3.611 N/A ASP 67.A N GLU 73.A OE1 no hydrogen 2.938 N/A SER 69.A N ASP 67.A OD1 no hydrogen 2.768 N/A SER 69.A OG ASP 67.A OD1 no hydrogen 2.216 N/A SER 70.A N ASP 67.A O no hydrogen 3.066 N/A ARG 74.A N SER 70.A O no hydrogen 3.083 N/A ARG 74.A NE HIS 125.A ND1 no hydrogen 2.832 N/A ARG 74.A NH1 VAL 68.A O no hydrogen 2.882 N/A ARG 74.A NH1 GLU 121.A OE1 no hydrogen 3.041 N/A ARG 74.A NH2 GLU 121.A OE1 no hydrogen 2.709 N/A GLU 75.A N ARG 71.A O no hydrogen 3.164 N/A LYS 76.A N THR 72.A O no hydrogen 3.006 N/A LEU 77.A N GLU 73.A O no hydrogen 2.795 N/A ALA 78.A N ARG 74.A O no hydrogen 2.926 N/A GLU 79.A N GLU 75.A O no hydrogen 3.106 N/A GLU 80.A N LYS 76.A O no hydrogen 3.069 N/A VAL 81.A N LEU 77.A O no hydrogen 3.071 N/A SER 82.A N ALA 78.A O no hydrogen 3.014 N/A SER 82.A OG ALA 78.A O no hydrogen 2.523 N/A SER 83.A N GLU 79.A O no hydrogen 3.028 N/A VAL 84.A N GLU 80.A O no hydrogen 2.862 N/A PHE 85.A N VAL 81.A O no hydrogen 2.908 N/A ASN 86.A N SER 83.A O no hydrogen 3.309 N/A GLY 87.A N SER 82.A O no hydrogen 2.482 N/A LYS 88.A N PHE 85.A O no hydrogen 3.194 N/A LEU 89.A N MET 133.A O no hydrogen 3.124 N/A ASN 90.A N THR 12.A O no hydrogen 2.943 N/A ASN 90.A N THR 12.A OG1 no hydrogen 3.128 N/A ASN 90.A ND2 THR 139.A O no hydrogen 3.180 N/A LEU 92.A N SER 141.A O no hydrogen 2.960 N/A ILE 93.A N LEU 14.A O no hydrogen 2.865 N/A ASN 94.A N VAL 143.A O no hydrogen 2.879 N/A ASN 95.A N THR 16.A OG1 no hydrogen 3.040 N/A ALA 96.A N THR 16.A OG1 no hydrogen 3.054 N/A GLY 98.A N ASN 119.A OD1 no hydrogen 2.907 N/A TYR 99.A OH HIS 157.A NE2 no hydrogen 2.717 N/A ASN 101.A ND2 TYR 99.A OH no hydrogen 2.674 N/A ASN 101.A ND2 PRO 155.A O no hydrogen 3.658 N/A LYS 102.A NZ ASP 111.A OD2 no hydrogen 2.698 N/A GLY 106.A N PRO 103.A O no hydrogen 2.905 N/A THR 108.A N ASP 111.A OD2 no hydrogen 3.031 N/A ASP 111.A N THR 108.A OG1 no hydrogen 3.221 N/A PHE 112.A N THR 108.A O no hydrogen 3.060 N/A SER 113.A N ALA 109.A O no hydrogen 2.921 N/A SER 113.A OG.B ALA 109.A O no hydrogen 2.900 N/A PHE 114.A N GLU 110.A O no hydrogen 2.543 N/A LEU 115.A N ASP 111.A O no hydrogen 2.928 N/A VAL 116.A N PHE 112.A O no hydrogen 3.024 N/A ALA 117.A N SER 113.A O no hydrogen 3.093 N/A VAL 118.A N PHE 114.A O no hydrogen 3.178 N/A ASN 119.A N LEU 115.A O no hydrogen 2.843 N/A ASN 119.A ND2 GLY 98.A O no hydrogen 3.036 N/A ASN 119.A ND2 THR 163.A OG1 no hydrogen 3.243 N/A LEU 120.A N VAL 116.A O no hydrogen 2.911 N/A GLU 121.A N VAL 116.A O no hydrogen 2.829 N/A SER 122.A N ALA 117.A O no hydrogen 2.850 N/A PHE 124.A N LEU 120.A O no hydrogen 3.016 N/A HIS 125.A N GLU 121.A O no hydrogen 2.874 N/A LEU 126.A N SER 122.A O no hydrogen 3.025 N/A CYS 127.A N ALA 123.A O no hydrogen 2.868 N/A CYS 127.A SG ALA 123.A O no hydrogen 3.180 N/A CYS 127.A SG HIS 144.A NE2 no hydrogen 3.662 N/A GLN 128.A N PHE 124.A O no hydrogen 3.244 N/A LEU 129.A N HIS 125.A O no hydrogen 2.960 N/A ALA 130.A N LEU 126.A O no hydrogen 2.859 N/A HIS 131.A N GLN 128.A O no hydrogen 3.266 N/A HIS 131.A NE2 ASP 181.A OD2 no hydrogen 2.814 N/A LEU 134.A N ALA 130.A O no hydrogen 2.938 N/A LYS 135.A N HIS 131.A O no hydrogen 2.842 N/A LYS 135.A NZ ASP 181.A OD1 no hydrogen 3.566 N/A ALA 136.A N PRO 132.A O no hydrogen 2.729 N/A SER 137.A N MET 133.A O no hydrogen 2.798 N/A SER 137.A OG LEU 89.A O no hydrogen 3.187 N/A SER 137.A OG LEU 134.A O no hydrogen 2.868 N/A SER 137.A OG THR 139.A O no hydrogen 2.948 N/A GLY 138.A N LYS 135.A O no hydrogen 3.032 N/A THR 139.A N SER 137.A OG no hydrogen 3.078 N/A GLY 140.A N ASN 182.A O no hydrogen 3.036 N/A SER 141.A N ASN 90.A O no hydrogen 2.820 N/A SER 141.A OG LEU 223.A O no hydrogen 3.260 N/A ILE 142.A N ARG 184.A O no hydrogen 2.769 N/A VAL 143.A N LEU 92.A O no hydrogen 2.795 N/A HIS 144.A N ASN 186.A O no hydrogen 3.011 N/A HIS 144.A ND1 THR 171.A OG1 no hydrogen 3.137 N/A ILE 145.A N ASN 94.A O no hydrogen 3.040 N/A SER 146.A N ILE 188.A O no hydrogen 2.714 N/A SER 146.A OG LYS 164.A O no hydrogen 3.219 N/A SER 146.A OG ASN 168.A OD1 no hydrogen 2.862 N/A SER 147.A N SER 146.A OG no hydrogen 2.516 N/A CYS 148.A N PRO 190.A O no hydrogen 2.905 N/A CYS 148.A SG PRO 190.A O no hydrogen 3.646 N/A CYS 149.A N SER 147.A OG no hydrogen 3.086 N/A CYS 149.A SG SER 147.A OG no hydrogen 2.809 N/A CYS 149.A SG HIS 157.A ND1 no hydrogen 3.435 N/A CYS 149.A SG SER 161.A OG no hydrogen 3.206 N/A ALA 150.A N SER 147.A O no hydrogen 3.112 N/A GLN 151.A N CYS 148.A O no hydrogen 3.277 N/A HIS 157.A N ILE 154.A O no hydrogen 3.109 N/A SER 161.A N HIS 157.A O no hydrogen 2.625 N/A SER 161.A OG CYS 149.A O no hydrogen 3.377 N/A SER 161.A OG HIS 157.A O no hydrogen 2.894 N/A SER 162.A N SER 158.A O no hydrogen 3.224 N/A SER 162.A OG SER 158.A O no hydrogen 2.633 N/A THR 163.A N ILE 159.A O no hydrogen 3.073 N/A THR 163.A OG1 ILE 159.A O no hydrogen 3.560 N/A THR 163.A OG1 TYR 160.A O no hydrogen 2.680 N/A LYS 164.A N TYR 160.A O no hydrogen 3.228 N/A LYS 164.A NZ ILE 145.A O no hydrogen 2.943 N/A GLY 165.A N SER 161.A O no hydrogen 2.820 N/A ALA 166.A N SER 162.A O no hydrogen 2.970 N/A ILE 167.A N THR 163.A O no hydrogen 2.976 N/A ASN 168.A N LYS 164.A O no hydrogen 2.915 N/A GLN 169.A N GLY 165.A O no hydrogen 3.104 N/A LEU 170.A N ALA 166.A O no hydrogen 2.868 N/A THR 171.A N ILE 167.A O no hydrogen 2.893 N/A THR 171.A OG1 HIS 144.A ND1 no hydrogen 3.137 N/A THR 171.A OG1 ILE 167.A O no hydrogen 3.110 N/A THR 171.A OG1 SER 187.A OG.B no hydrogen 2.673 N/A ARG 172.A NE GLN 169.A OE1 no hydrogen 2.647 N/A ARG 172.A NH2 GLN 169.A OE1 no hydrogen 2.756 N/A ASN 173.A N GLN 169.A O no hydrogen 3.216 N/A ASN 173.A ND2 GLN 169.A O no hydrogen 3.109 N/A LEU 174.A N LEU 170.A O no hydrogen 2.898 N/A ALA 175.A N THR 171.A O no hydrogen 2.892 N/A CYS 176.A N ARG 172.A O no hydrogen 3.121 N/A CYS 176.A SG ARG 172.A O no hydrogen 3.651 N/A GLU 177.A N ASN 173.A O no hydrogen 2.876 N/A TRP 178.A N LEU 174.A O no hydrogen 3.083 N/A ASP 181.A N TRP 178.A O no hydrogen 2.979 N/A ASN 182.A N ALA 179.A O no hydrogen 2.961 N/A ASN 182.A ND2 GLY 138.A O no hydrogen 2.613 N/A ILE 183.A N TRP 178.A O no hydrogen 3.313 N/A ARG 184.A N GLY 140.A O no hydrogen 2.935 N/A ARG 184.A NH1 LEU 223.A O no hydrogen 2.967 N/A ARG 184.A NH1 ILE 231.A O no hydrogen 3.059 N/A ARG 184.A NH2 LEU 223.A O no hydrogen 2.709 N/A THR 185.A N THR 232.A OG1 no hydrogen 3.158 N/A ASN 186.A N ILE 142.A O no hydrogen 2.970 N/A ASN 186.A ND2 ILE 231.A O no hydrogen 3.127 N/A SER 187.A N GLN 234.A O no hydrogen 2.845 N/A SER 187.A OG.A ASN 168.A OD1 no hydrogen 3.162 N/A SER 187.A OG.B THR 171.A OG1 no hydrogen 2.673 N/A ILE 188.A N HIS 144.A O no hydrogen 2.878 N/A ALA 189.A N ILE 236.A O no hydrogen 2.786 N/A GLY 191.A N VAL 238.A O no hydrogen 3.010 N/A ARG 194.A N GLY 211.A O no hydrogen 2.764 N/A ARG 194.A NH2 GLU 212.A OE1 no hydrogen 2.843 N/A THR 195.A N THR 198.A OG1 no hydrogen 2.952 N/A THR 198.A N THR 195.A O no hydrogen 3.085 N/A THR 198.A OG1 ILE 193.A O no hydrogen 3.003 N/A THR 198.A OG1 THR 195.A O no hydrogen 2.820 N/A SER 203.A N ASP 199.A O no hydrogen 3.062 N/A SER 203.A OG ARG 200.A O no hydrogen 3.131 N/A ARG 204.A N GLU 201.A O no hydrogen 2.921 N/A ARG 204.A NH1 ARG 200.A O no hydrogen 3.076 N/A VAL 205.A N VAL 202.A O no hydrogen 2.921 N/A GLY 208.A N VAL 205.A O no hydrogen 2.745 N/A ARG 209.A NH1 ILE 210.A O no hydrogen 3.121 N/A ARG 209.A NH1 GLU 215.A OE1 no hydrogen 3.302 N/A ARG 209.A NH1 GLU 215.A OE2 no hydrogen 2.996 N/A ARG 209.A NH2 GLU 215.A OE1 no hydrogen 2.639 N/A GLY 211.A N ALA 192.A O no hydrogen 2.795 N/A GLU 212.A N GLU 215.A OE2 no hydrogen 2.801 N/A GLU 214.A N GLU 214.A OE1 no hydrogen 2.891 N/A GLU 215.A N GLU 212.A O no hydrogen 2.812 N/A VAL 216.A N PRO 213.A O no hydrogen 3.000 N/A ALA 217.A N PRO 213.A O no hydrogen 2.990 N/A SER 218.A N GLU 214.A O no hydrogen 3.090 N/A SER 218.A OG GLU 214.A O no hydrogen 3.312 N/A SER 218.A OG GLU 215.A O no hydrogen 3.328 N/A ALA 220.A N VAL 216.A O no hydrogen 3.219 N/A ALA 221.A N ALA 217.A O no hydrogen 3.044 N/A PHE 222.A N SER 218.A O no hydrogen 2.996 N/A LEU 223.A N LEU 219.A O no hydrogen 2.906 N/A CYS 224.A N ALA 221.A O no hydrogen 3.080 N/A CYS 224.A SG SER 141.A OG no hydrogen 3.389 N/A CYS 224.A SG ALA 220.A O no hydrogen 3.342 N/A MET 225.A N PHE 222.A O no hydrogen 2.993 N/A SER 227.A N ARG 5.A O no hydrogen 3.110 N/A SER 227.A OG.B ARG 5.A O no hydrogen 3.020 N/A ALA 228.A N MET 225.A O no hydrogen 2.990 N/A SER 229.A OG PRO 226.A O no hydrogen 3.164 N/A ILE 231.A N ALA 228.A O no hydrogen 3.001 N/A THR 232.A OG1 THR 185.A O no hydrogen 3.538 N/A GLY 233.A N THR 185.A O no hydrogen 2.721 N/A GLN 234.A N ASN 186.A OD1 no hydrogen 3.045 N/A ILE 236.A N SER 187.A O no hydrogen 2.918 N/A CYS 237.A SG GLN 151.A OE1 no hydrogen 3.457 N/A VAL 238.A N ALA 189.A O no hydrogen 3.011 N/A GLY 241.A N ASP 239.A OD1 no hydrogen 2.866 N/A ARG 242.A N ASP 239.A O no hydrogen 3.047 N/A ARG 242.A NE ARG 242.A O no hydrogen 3.369 N/A ARG 242.A NH1 GLU 201.A OE2 no hydrogen 2.516 N/A THR 243.A N ASP 239.A OD2 no hydrogen 2.875 N/A THR 243.A OG1 ASP 239.A OD2 no hydrogen 2.949 N/A ILE 244.A N GLY 241.A O no hydrogen 3.249 N/A ASN 245.A N ARG 242.A O no hydrogen 3.290 N/A