Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 6caq_D.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): TYR 3.A OH PRO 6.A O no hydrogen 2.393 N/A CYS 8.A SG CYS 30.A O no hydrogen 3.095 N/A LEU 10.A N VAL 7.A O no hydrogen 2.505 N/A CYS 11.A N VAL 7.A O no hydrogen 3.255 N/A CYS 11.A SG LEU 18.A O no hydrogen 2.906 N/A ARG 12.A N ARG 9.A O no hydrogen 3.237 N/A ARG 12.A NH1 TYR 37.A O no hydrogen 2.570 N/A ARG 13.A N ARG 9.A O no hydrogen 3.280 N/A GLU 14.A N LEU 10.A O no hydrogen 3.284 N/A GLY 15.A N ARG 12.A O no hydrogen 2.950 N/A LYS 17.A NZ CYS 25.A O no hydrogen 2.345 N/A GLY 22.A N TYR 19.A O no hydrogen 3.090 N/A CYS 25.A SG LEU 18.A O no hydrogen 2.930 N/A SER 27.A OG ARG 24.A O no hydrogen 3.548 N/A LYS 29.A N SER 27.A O no hydrogen 2.543 N/A GLY 43.A N GLY 40.A O no hydrogen 3.338 N/A GLN 44.A NE2 TYR 37.A OH no hydrogen 2.953 N/A LYS 45.A N HIS 42.A O no hydrogen 3.388 N/A LYS 45.A NZ HIS 42.A ND1 no hydrogen 3.081 N/A ARG 49.A NH1 PRO 50.A O no hydrogen 2.941 N/A ALA 54.A N SER 51.A OG no hydrogen 2.803 N/A VAL 55.A N SER 51.A O no hydrogen 3.068 N/A ARG 56.A NH1 ASP 52.A O no hydrogen 3.515 N/A LEU 57.A N TYR 53.A O no hydrogen 2.864 N/A ARG 58.A N ALA 54.A O no hydrogen 3.040 N/A ARG 58.A NH2 GLU 14.A OE1 no hydrogen 2.302 N/A GLU 59.A N VAL 55.A O no hydrogen 3.108 N/A LYS 60.A N ARG 56.A O no hydrogen 3.364 N/A LYS 60.A NZ GLN 61.A OE1 no hydrogen 2.558 N/A LYS 60.A NZ GLU 71.A OE2 no hydrogen 2.648 N/A GLN 61.A N LEU 57.A O no hydrogen 3.195 N/A LYS 62.A N ARG 58.A O no hydrogen 2.978 N/A LYS 62.A NZ GLU 59.A OE1 no hydrogen 3.292 N/A LYS 62.A NZ GLU 59.A OE2 no hydrogen 2.978 N/A LYS 62.A NZ PRO 196.A O no hydrogen 2.293 N/A LEU 63.A N GLU 59.A O no hydrogen 3.112 N/A ARG 64.A N LYS 60.A O no hydrogen 2.621 N/A ARG 64.A NE ILE 69.A O no hydrogen 2.991 N/A ARG 65.A N GLN 61.A O no hydrogen 2.822 N/A ARG 65.A NH1 GLU 14.A OE1 no hydrogen 3.000 N/A ILE 66.A N LEU 63.A O no hydrogen 3.099 N/A TYR 67.A N LEU 63.A O no hydrogen 3.442 N/A TYR 67.A N ARG 64.A O no hydrogen 3.222 N/A TYR 67.A OH GLU 97.A OE1 no hydrogen 3.009 N/A GLY 68.A N ARG 65.A O no hydrogen 3.356 N/A PHE 74.A N SER 70.A O no hydrogen 2.942 N/A ARG 75.A N GLU 71.A O no hydrogen 2.670 N/A ARG 75.A NE GLU 79.A OE1 no hydrogen 3.465 N/A ARG 75.A NH2 GLU 79.A OE1 no hydrogen 3.365 N/A ASN 76.A N ARG 72.A O no hydrogen 3.031 N/A LEU 77.A N GLN 73.A O no hydrogen 2.980 N/A PHE 78.A N PHE 74.A O no hydrogen 3.174 N/A GLU 79.A N ARG 75.A O no hydrogen 2.989 N/A GLU 80.A N ASN 76.A O no hydrogen 2.934 N/A ALA 81.A N LEU 77.A O no hydrogen 3.149 N/A SER 82.A N PHE 78.A O no hydrogen 3.155 N/A SER 82.A OG PHE 78.A O no hydrogen 3.002 N/A SER 82.A OG GLU 79.A O no hydrogen 3.127 N/A LYS 83.A N GLU 80.A O no hydrogen 3.134 N/A LYS 84.A N GLU 80.A O no hydrogen 3.338 N/A VAL 91.A N VAL 87.A O no hydrogen 3.075 N/A PHE 92.A N THR 88.A O no hydrogen 3.329 N/A GLY 94.A N SER 90.A O no hydrogen 3.018 N/A LEU 95.A N VAL 91.A O no hydrogen 3.081 N/A LEU 95.A N PHE 92.A O no hydrogen 3.077 N/A LEU 96.A N PHE 92.A O no hydrogen 3.186 N/A GLU 97.A N LEU 93.A O no hydrogen 2.799 N/A SER 98.A N LEU 95.A O no hydrogen 3.190 N/A SER 98.A OG GLY 94.A O no hydrogen 2.892 N/A ARG 99.A N LEU 96.A O no hydrogen 3.115 N/A ARG 99.A NE ASP 101.A OD1 no hydrogen 3.357 N/A ARG 99.A NE ASP 101.A OD2 no hydrogen 3.285 N/A ARG 99.A NH1 GLN 73.A OE1 no hydrogen 2.864 N/A ARG 99.A NH2 GLN 73.A OE1 no hydrogen 3.499 N/A ARG 99.A NH2 ASP 101.A OD2 no hydrogen 3.185 N/A LEU 100.A N TYR 137.A O no hydrogen 2.881 N/A ASP 101.A N PRO 135.A O no hydrogen 3.262 N/A ASN 102.A ND2 GLU 97.A O no hydrogen 3.084 N/A ASN 102.A ND2 GLU 97.A OE2 no hydrogen 2.883 N/A VAL 103.A N ARG 99.A O no hydrogen 2.813 N/A VAL 104.A N LEU 100.A O no hydrogen 2.847 N/A TYR 105.A N ASP 101.A O no hydrogen 3.280 N/A ARG 106.A N ASN 102.A O no hydrogen 2.779 N/A LEU 107.A N VAL 103.A O no hydrogen 2.835 N/A GLY 108.A N TYR 105.A O no hydrogen 2.649 N/A PHE 109.A N VAL 104.A O no hydrogen 3.235 N/A VAL 111.A N GLN 115.A OE1 no hydrogen 2.732 N/A ARG 113.A NE ASN 102.A OD1 no hydrogen 2.877 N/A ARG 113.A NH1 ILE 66.A O no hydrogen 2.910 N/A ARG 114.A NH2 TYR 3.A O no hydrogen 3.324 N/A GLN 115.A N SER 112.A OG no hydrogen 2.783 N/A ALA 116.A N SER 112.A O no hydrogen 3.221 N/A ARG 117.A N ARG 113.A O no hydrogen 2.837 N/A GLN 118.A N ARG 114.A O no hydrogen 3.158 N/A LEU 119.A N GLN 115.A O no hydrogen 3.003 N/A VAL 120.A N ALA 116.A O no hydrogen 3.131 N/A ARG 121.A N ARG 117.A O no hydrogen 2.951 N/A ARG 121.A NE ASP 133.A O no hydrogen 3.231 N/A HIS 122.A N GLN 118.A O no hydrogen 3.086 N/A GLY 123.A N VAL 120.A O no hydrogen 2.739 N/A HIS 124.A N LEU 119.A O no hydrogen 3.053 N/A HIS 124.A ND1 SER 151.A OG no hydrogen 2.461 N/A THR 126.A N ALA 146.A O no hydrogen 2.928 N/A VAL 127.A N ARG 130.A O no hydrogen 2.633 N/A ASN 128.A N GLU 144.A O no hydrogen 2.798 N/A ARG 130.A N VAL 127.A O no hydrogen 3.120 N/A VAL 132.A N ILE 125.A O no hydrogen 3.277 N/A TYR 137.A N LEU 134.A O no hydrogen 3.443 N/A ARG 138.A NH1 GLU 80.A OE1 no hydrogen 3.073 N/A ARG 138.A NH2 GLU 80.A OE1 no hydrogen 3.044 N/A VAL 139.A N SER 98.A O no hydrogen 2.785 N/A ARG 140.A N ASP 143.A OD2 no hydrogen 3.057 N/A GLY 142.A N PHE 184.A O no hydrogen 2.688 N/A ASP 143.A N ARG 140.A O no hydrogen 3.513 N/A GLU 144.A N ASN 128.A OD1 no hydrogen 3.098 N/A ILE 145.A N GLY 182.A O no hydrogen 2.644 N/A ALA 146.A N THR 126.A O no hydrogen 2.965 N/A VAL 147.A N MET 180.A O no hydrogen 3.078 N/A ALA 148.A N HIS 124.A O no hydrogen 3.011 N/A SER 151.A N ALA 148.A O no hydrogen 2.686 N/A SER 151.A OG HIS 124.A ND1 no hydrogen 2.461 N/A ARG 152.A N GLU 149.A O no hydrogen 3.336 N/A LEU 154.A N SER 151.A O no hydrogen 2.765 N/A ILE 157.A N LEU 154.A O no hydrogen 3.208 N/A ARG 158.A N LEU 154.A O no hydrogen 3.155 N/A ARG 158.A NH2 ARG 152.A O no hydrogen 3.359 N/A GLN 159.A N GLU 155.A O no hydrogen 2.920 N/A ASN 160.A N LEU 156.A O no hydrogen 3.148 N/A ASN 160.A ND2 PHE 109.A O no hydrogen 2.957 N/A ASN 160.A ND2 GLN 115.A OE1 no hydrogen 3.068 N/A LEU 161.A N ILE 157.A O no hydrogen 2.904 N/A GLU 162.A N ARG 158.A O no hydrogen 2.924 N/A ALA 163.A N GLN 159.A O no hydrogen 3.421 N/A MET 164.A N LEU 161.A O no hydrogen 3.132 N/A LYS 165.A N GLU 162.A O no hydrogen 3.269 N/A LYS 165.A NZ GLU 162.A OE1 no hydrogen 2.972 N/A ARG 167.A N MET 164.A O no hydrogen 3.304 N/A LEU 173.A N GLY 170.A O no hydrogen 2.771 N/A SER 174.A N LYS 183.A O no hydrogen 3.154 N/A VAL 177.A N GLU 178.A OE2 no hydrogen 3.197 N/A LYS 181.A NZ GLU 144.A OE1 no hydrogen 3.476 N/A LYS 183.A N SER 174.A O no hydrogen 2.647 N/A PHE 184.A N ASP 143.A O no hydrogen 3.260 N/A LEU 185.A N TRP 172.A O no hydrogen 2.784 N/A ARG 190.A N ASP 189.A OD1 no hydrogen 2.457 N/A ARG 190.A NE ARG 190.A O no hydrogen 2.767 N/A ARG 190.A NH1 VAL 197.A O no hydrogen 3.245 N/A ARG 190.A NH2 LEU 193.A O no hydrogen 3.162 N/A ASP 192.A N ASP 189.A O no hydrogen 2.952 N/A LEU 193.A N ARG 190.A O no hydrogen 3.141 N/A VAL 197.A N LEU 195.A O no hydrogen 2.744 N/A ASN 198.A N GLU 59.A OE2 no hydrogen 2.709 N/A LEU 201.A N ASN 198.A O no hydrogen 3.125 N/A VAL 202.A N GLU 199.A O no hydrogen 2.513 N/A ILE 203.A N GLU 199.A O no hydrogen 2.853 N/A GLU 204.A N GLN 200.A O no hydrogen 3.103 N/A PHE 205.A N VAL 202.A O no hydrogen 2.934 N/A TYR 206.A N VAL 202.A O no hydrogen 3.356 N/A TYR 206.A N ILE 203.A O no hydrogen 3.203 N/A TYR 206.A OH GLU 71.A OE1 no hydrogen 2.752 N/A SER 207.A N ILE 203.A O no hydrogen 3.237 N/A SER 207.A OG ILE 203.A O no hydrogen 3.071 N/A