Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 6qui_B.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLY 1.A N PRO 190.A O no hydrogen 3.333 N/A GLY 5.A N GLY 1.A O no hydrogen 2.801 N/A GLU 6.A N HIS 2.A O no hydrogen 2.802 N/A GLN 7.A N LYS 3.A O no hydrogen 3.311 N/A LEU 8.A N ARG 4.A O no hydrogen 3.116 N/A LEU 8.A N GLY 5.A O no hydrogen 3.149 N/A PHE 9.A N GLU 6.A O no hydrogen 3.152 N/A THR 10.A N GLN 7.A O no hydrogen 3.506 N/A THR 10.A OG1 GLN 7.A O no hydrogen 3.201 N/A VAL 13.A N GLY 36.A O no hydrogen 2.802 N/A ILE 15.A N GLY 34.A O no hydrogen 2.804 N/A LEU 16.A N LEU 117.A O no hydrogen 3.038 N/A VAL 17.A N GLY 32.A O no hydrogen 2.802 N/A GLU 18.A N ASN 119.A O no hydrogen 2.824 N/A LEU 19.A N VAL 30.A O no hydrogen 2.807 N/A ASP 20.A N ILE 121.A O no hydrogen 3.016 N/A GLY 21.A N PHE 28.A O no hydrogen 2.800 N/A ASP 22.A N LEU 123.A O no hydrogen 3.003 N/A VAL 23.A N HIS 26.A O no hydrogen 2.807 N/A ASN 24.A N GLY 125.A O no hydrogen 2.812 N/A ASN 24.A ND2 PHE 128.A O no hydrogen 2.839 N/A ASN 24.A ND2 GLU 130.A OE1 no hydrogen 3.496 N/A GLY 25.A N ASP 22.A OD1 no hydrogen 2.936 N/A HIS 26.A N VAL 23.A O no hydrogen 2.802 N/A HIS 26.A ND1 VAL 23.A O no hydrogen 2.748 N/A PHE 28.A N GLY 21.A O no hydrogen 2.806 N/A SER 29.A N THR 51.A OG1 no hydrogen 3.132 N/A SER 29.A OG ASP 20.A OD1 no hydrogen 2.574 N/A VAL 30.A N LEU 19.A O no hydrogen 2.804 N/A ARG 31.A N ILE 48.A O no hydrogen 2.811 N/A ARG 31.A NE GLU 33.A OE2 no hydrogen 3.445 N/A ARG 31.A NH2 GLU 33.A OE2 no hydrogen 2.950 N/A GLY 32.A N VAL 17.A O no hydrogen 2.799 N/A GLU 33.A N ARG 46.A O no hydrogen 2.814 N/A GLY 34.A N ILE 15.A O no hydrogen 3.115 N/A GLU 35.A N THR 44.A O no hydrogen 2.808 N/A GLY 36.A N VAL 13.A O no hydrogen 2.803 N/A ASP 37.A N ARG 42.A O no hydrogen 2.799 N/A THR 39.A OG1 THR 10.A O no hydrogen 3.285 N/A ASN 40.A N ASP 37.A O no hydrogen 3.017 N/A ASN 40.A ND2 ASP 37.A OD2 no hydrogen 2.799 N/A GLY 41.A N ALA 38.A O no hydrogen 2.813 N/A ARG 42.A N ASP 37.A O no hydrogen 2.934 N/A LEU 43.A N GLU 220.A O no hydrogen 2.802 N/A THR 44.A N GLU 35.A O no hydrogen 2.950 N/A THR 44.A OG1 GLU 35.A O no hydrogen 3.520 N/A LEU 45.A N LEU 218.A O no hydrogen 2.951 N/A ARG 46.A N GLU 33.A O no hydrogen 2.809 N/A ARG 46.A NE ASP 208.A OD2 no hydrogen 3.236 N/A ARG 46.A NH2 ASP 208.A OD2 no hydrogen 3.091 N/A ARG 46.A NH2 GLU 211.A OE1 no hydrogen 2.469 N/A PHE 47.A N MET 216.A O no hydrogen 2.805 N/A ILE 48.A N ARG 31.A O no hydrogen 2.798 N/A CYS 49.A N ASP 214.A O no hydrogen 2.818 N/A CYS 49.A SG SER 29.A O no hydrogen 3.536 N/A CYS 49.A SG THR 51.A OG1 no hydrogen 3.377 N/A CYS 49.A SG GLY 52.A O no hydrogen 3.092 N/A THR 50.A N SER 29.A O no hydrogen 3.012 N/A THR 50.A OG1 SER 29.A O no hydrogen 3.477 N/A LEU 54.A N ASP 214.A OD2 no hydrogen 2.799 N/A TRP 58.A NE1 ASP 214.A OD1 no hydrogen 2.965 N/A THR 60.A N PRO 57.A O no hydrogen 2.809 N/A THR 60.A OG1 PRO 57.A O no hydrogen 2.638 N/A THR 60.A OG1 TYR 104.A OH no hydrogen 2.813 N/A LEU 61.A N TRP 58.A O no hydrogen 2.814 N/A VAL 62.A N PRO 59.A O no hydrogen 3.324 N/A THR 63.A OG1 HIS 179.A NE2 no hydrogen 2.687 N/A LEU 65.A N LEU 61.A O no hydrogen 2.816 N/A PHE 69.A N VAL 66.A O no hydrogen 2.996 N/A SER 70.A N GLN 67.A O no hydrogen 3.126 N/A SER 70.A OG GLN 67.A O no hydrogen 2.648 N/A ARG 71.A N VAL 222.A O no hydrogen 2.805 N/A TYR 72.A OH HIS 197.A NE2 no hydrogen 2.675 N/A HIS 75.A NE2 ILE 227.A O no hydrogen 2.795 N/A MET 76.A N PRO 73.A O no hydrogen 2.801 N/A ARG 77.A N ASP 74.A O no hydrogen 3.062 N/A ARG 77.A NE GLU 6.A OE1 no hydrogen 3.517 N/A ARG 77.A NH1 ASP 74.A OD1 no hydrogen 2.654 N/A ARG 77.A NH2 GLU 6.A OE2 no hydrogen 3.220 N/A HIS 79.A N MET 76.A O no hydrogen 2.805 N/A LYS 83.A N ASP 80.A OD1 no hydrogen 3.290 N/A LYS 83.A NZ CYS 68.A O no hydrogen 2.887 N/A LYS 83.A NZ SER 70.A O no hydrogen 2.876 N/A LYS 83.A NZ ASP 80.A OD2 no hydrogen 2.720 N/A SER 84.A OG PHE 81.A O no hydrogen 2.673 N/A ALA 85.A N PHE 81.A O no hydrogen 3.202 N/A MET 86.A N LYS 83.A O no hydrogen 2.998 N/A GLU 88.A N GLU 88.A OE1 no hydrogen 2.720 N/A GLY 89.A N ALA 85.A O no hydrogen 2.796 N/A TYR 90.A N VAL 110.A O no hydrogen 2.806 N/A VAL 91.A N THR 184.A O no hydrogen 2.876 N/A GLN 92.A N ALA 108.A O no hydrogen 2.802 N/A GLU 93.A N GLN 182.A O no hydrogen 2.927 N/A ARG 94.A N THR 106.A O no hydrogen 3.014 N/A ARG 94.A NE GLN 181.A OE1 no hydrogen 2.887 N/A ARG 94.A NH1 THR 63.A O no hydrogen 2.813 N/A ARG 94.A NH2 GLN 181.A OE1 no hydrogen 2.846 N/A THR 95.A N TYR 180.A O no hydrogen 2.945 N/A ILE 96.A N TYR 104.A O no hydrogen 2.800 N/A SER 97.A N ASN 178.A O no hydrogen 2.806 N/A PHE 98.A N GLY 102.A O no hydrogen 3.043 N/A ARG 99.A N LEU 176.A O no hydrogen 2.948 N/A ARG 99.A NH1 ASN 178.A OD1 no hydrogen 3.078 N/A ASP 101.A N PHE 98.A O no hydrogen 2.808 N/A GLY 102.A N ASP 101.A OD1 no hydrogen 2.817 N/A THR 103.A N THR 126.A O no hydrogen 2.905 N/A TYR 104.A N ILE 96.A O no hydrogen 2.806 N/A TYR 104.A OH THR 60.A OG1 no hydrogen 2.813 N/A ARG 105.A N ARG 124.A O no hydrogen 2.801 N/A THR 106.A N ARG 94.A O no hydrogen 2.816 N/A ARG 107.A N GLU 122.A O no hydrogen 2.979 N/A ALA 108.A N GLN 92.A O no hydrogen 2.806 N/A VAL 109.A N ARG 120.A O no hydrogen 2.807 N/A VAL 110.A N TYR 90.A O no hydrogen 2.810 N/A ARG 111.A N VAL 118.A O no hydrogen 3.102 N/A ARG 111.A NE GLU 113.A OE2 no hydrogen 3.309 N/A ARG 111.A NH2 GLU 113.A OE2 no hydrogen 3.499 N/A PHE 112.A N PRO 87.A O no hydrogen 3.196 N/A GLU 113.A N THR 116.A O no hydrogen 2.807 N/A THR 116.A N GLU 113.A O no hydrogen 3.104 N/A LEU 117.A N PRO 14.A O no hydrogen 2.811 N/A VAL 118.A N ARG 111.A O no hydrogen 2.803 N/A ASN 119.A N LEU 16.A O no hydrogen 2.805 N/A ASN 119.A ND2 THR 64.A O no hydrogen 3.352 N/A ASN 119.A ND2 LEU 65.A O no hydrogen 3.019 N/A ARG 120.A N VAL 109.A O no hydrogen 2.816 N/A ARG 120.A NE GLU 113.A OE2 no hydrogen 2.987 N/A ARG 120.A NH2 GLU 113.A OE1 no hydrogen 2.692 N/A ARG 120.A NH2 GLU 113.A OE2 no hydrogen 3.502 N/A ILE 121.A N GLU 18.A O no hydrogen 2.796 N/A GLU 122.A N ARG 107.A O no hydrogen 2.805 N/A LEU 123.A N ASP 20.A O no hydrogen 2.813 N/A ARG 124.A N ARG 105.A O no hydrogen 2.813 N/A GLY 125.A N ASP 22.A O no hydrogen 2.801 N/A THR 126.A N THR 103.A O no hydrogen 2.967 N/A PHE 128.A N ASN 24.A OD1 no hydrogen 3.142 N/A ARG 129.A N ASP 101.A OD1 no hydrogen 2.804 N/A GLY 132.A N ARG 129.A O no hydrogen 2.996 N/A ASN 133.A ND2 GLN 175.A OE1 no hydrogen 2.989 N/A GLY 136.A N GLY 132.A O no hydrogen 2.804 N/A HIS 137.A N ILE 134.A O no hydrogen 2.989 N/A ARG 138.A N ASN 133.A O no hydrogen 2.808 N/A ARG 138.A NH1 ASP 131.A O no hydrogen 3.220 N/A ARG 138.A NH1 ASP 131.A OD1 no hydrogen 2.787 N/A ARG 138.A NH2 ASP 131.A O no hydrogen 2.877 N/A GLU 140.A N ASN 168.A O no hydrogen 2.806 N/A TYR 141.A OH SER 206.A O no hydrogen 2.632 N/A ASN 142.A ND2 GLU 140.A OE1 no hydrogen 2.909 N/A ASN 144.A ND2 ARG 166.A O no hydrogen 2.800 N/A ASN 144.A ND2 ASN 168.A OD1 no hydrogen 3.125 N/A HIS 146.A N THR 201.A O no hydrogen 2.827 N/A ASN 147.A ND2 TYR 149.A OH no hydrogen 3.397 N/A VAL 148.A N LEU 199.A O no hydrogen 2.803 N/A TYR 149.A N ASN 162.A O no hydrogen 3.355 N/A ILE 150.A N HIS 197.A O no hydrogen 2.803 N/A THR 151.A N ARG 160.A O no hydrogen 2.986 N/A ASP 153.A N GLY 158.A O no hydrogen 2.801 N/A ARG 156.A N ASP 153.A O no hydrogen 3.045 N/A ARG 156.A NE ASP 153.A OD2 no hydrogen 2.968 N/A ARG 156.A NH1 THR 184.A OG1 no hydrogen 3.041 N/A ASN 157.A N ARG 154.A O no hydrogen 2.804 N/A GLY 158.A N ASP 153.A O no hydrogen 3.007 N/A ILE 159.A N ASN 183.A O no hydrogen 2.923 N/A ARG 160.A N THR 151.A O no hydrogen 2.815 N/A ARG 160.A NH1 GLN 182.A OE1 no hydrogen 3.117 N/A ALA 161.A N GLN 181.A O no hydrogen 2.808 N/A ASN 162.A N TYR 149.A O no hydrogen 3.211 N/A PHE 163.A N HIS 179.A O no hydrogen 3.351 N/A ILE 165.A N ALA 177.A O no hydrogen 2.806 N/A ARG 166.A N HIS 146.A NE2 no hydrogen 2.986 N/A ARG 166.A NH2 SER 145.A O no hydrogen 2.909 N/A HIS 167.A N GLN 175.A O no hydrogen 2.801 N/A ASN 168.A ND2 GLU 140.A OE1 no hydrogen 3.463 N/A VAL 169.A N SER 173.A O no hydrogen 2.803 N/A GLU 170.A N ARG 138.A O no hydrogen 2.802 N/A GLY 172.A N VAL 169.A O no hydrogen 2.804 N/A SER 173.A N ASP 171.A OD1 no hydrogen 3.023 N/A SER 173.A OG ASP 171.A OD1 no hydrogen 2.672 N/A GLN 175.A N HIS 167.A O no hydrogen 2.796 N/A GLN 175.A NE2 ARG 99.A O no hydrogen 2.949 N/A GLN 175.A NE2 LEU 176.A O no hydrogen 2.981 N/A ALA 177.A N ILE 165.A O no hydrogen 2.807 N/A ASN 178.A N SER 97.A O no hydrogen 2.800 N/A ASN 178.A ND2 THR 164.A OG1 no hydrogen 2.773 N/A HIS 179.A N PHE 163.A O no hydrogen 2.797 N/A HIS 179.A ND1 ALA 177.A O no hydrogen 2.902 N/A HIS 179.A NE2 THR 63.A OG1 no hydrogen 2.687 N/A TYR 180.A N THR 95.A O no hydrogen 2.809 N/A GLN 181.A N ALA 161.A O no hydrogen 2.804 N/A GLN 181.A NE2 GLN 67.A OE1 no hydrogen 2.925 N/A GLN 181.A NE2 ASN 183.A OD1 no hydrogen 2.870 N/A GLN 182.A N GLU 93.A O no hydrogen 2.995 N/A GLN 182.A NE2 GLU 93.A OE1 no hydrogen 2.798 N/A ASN 183.A N ILE 159.A O no hydrogen 2.809 N/A ASN 183.A ND2 GLN 92.A OE1 no hydrogen 2.755 N/A THR 184.A N VAL 91.A O no hydrogen 2.986 N/A ILE 186.A N GLY 89.A O no hydrogen 2.807 N/A LEU 192.A N SER 84.A OG no hydrogen 2.881 N/A ASP 195.A N HIS 79.A ND1 no hydrogen 3.051 N/A HIS 197.A N ILE 150.A O no hydrogen 3.187 N/A HIS 197.A ND1 ASP 195.A O no hydrogen 2.855 N/A HIS 197.A NE2 TYR 72.A OH no hydrogen 2.675 N/A TYR 198.A N ALA 225.A O no hydrogen 2.936 N/A LEU 199.A N VAL 148.A O no hydrogen 2.803 N/A SER 200.A N THR 223.A O no hydrogen 2.799 N/A THR 201.A N HIS 146.A O no hydrogen 2.800 N/A THR 201.A OG1 LEU 199.A O no hydrogen 3.425 N/A GLN 202.A N PHE 221.A O no hydrogen 2.814 N/A THR 203.A OG1 GLU 220.A OE1 no hydrogen 2.967 N/A ALA 204.A N LEU 219.A O no hydrogen 2.796 N/A SER 206.A N VAL 217.A O no hydrogen 2.803 N/A ARG 207.A NH1 HIS 215.A O no hydrogen 3.024 N/A ASP 208.A N HIS 215.A NE2 no hydrogen 2.776 N/A ASN 210.A N ASP 208.A OD1 no hydrogen 2.962 N/A GLU 211.A N ASP 208.A O no hydrogen 3.109 N/A ARG 213.A N GLU 211.A OE2 no hydrogen 2.836 N/A ARG 213.A NE GLU 211.A OE2 no hydrogen 2.881 N/A ARG 213.A NH2 GLU 211.A OE1 no hydrogen 3.064 N/A HIS 215.A ND1 ARG 213.A O no hydrogen 2.855 N/A MET 216.A N PHE 47.A O no hydrogen 2.814 N/A VAL 217.A N SER 206.A O no hydrogen 2.814 N/A LEU 218.A N LEU 45.A O no hydrogen 2.806 N/A LEU 219.A N ALA 204.A O no hydrogen 2.815 N/A GLU 220.A N LEU 43.A O no hydrogen 2.814 N/A PHE 221.A N GLN 202.A O no hydrogen 2.807 N/A VAL 222.A N GLY 41.A O no hydrogen 2.805 N/A THR 223.A N SER 200.A O no hydrogen 2.995 N/A ALA 224.A N ARG 71.A O no hydrogen 2.801 N/A ALA 225.A N TYR 198.A O no hydrogen 2.810 N/A