Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 6ate_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): LYS 1.A NZ ASP 2.A O no hydrogen 3.457 N/A GLU 5.A N ASP 2.A O no hydrogen 3.396 N/A ILE 6.A N VAL 64.A O no hydrogen 3.211 N/A ARG 8.A NH2 GLU 67.A O no hydrogen 2.580 N/A ARG 8.A NH2 PRO 69.A O no hydrogen 2.604 N/A SER 10.A N PRO 7.A O no hydrogen 3.354 N/A SER 10.A OG PRO 7.A O no hydrogen 2.510 N/A LEU 11.A N ARG 8.A O no hydrogen 3.384 N/A ARG 12.A N THR 29.A O no hydrogen 2.734 N/A GLU 14.A N MET 27.A O no hydrogen 2.922 N/A VAL 15.A N MET 27.A O no hydrogen 2.969 N/A LEU 17.A N VAL 25.A O no hydrogen 3.106 N/A GLY 23.A N GLY 20.A O no hydrogen 3.181 N/A VAL 25.A N GLY 18.A O no hydrogen 2.877 N/A TRP 26.A N ILE 38.A O no hydrogen 2.733 N/A MET 27.A N VAL 15.A O no hydrogen 2.822 N/A GLY 28.A N VAL 36.A O no hydrogen 3.018 N/A THR 29.A N ARG 12.A O no hydrogen 2.817 N/A TRP 30.A N THR 34.A O no hydrogen 2.985 N/A THR 34.A OG1 THR 33.A O no hydrogen 2.480 N/A VAL 36.A N GLY 28.A O no hydrogen 3.280 N/A ALA 37.A N THR 74.A O no hydrogen 2.874 N/A ILE 38.A N TRP 26.A O no hydrogen 2.775 N/A LYS 39.A N ILE 72.A O no hydrogen 2.906 N/A LYS 39.A NZ CYS 21.A O no hydrogen 3.211 N/A THR 40.A N GLU 24.A O no hydrogen 3.104 N/A GLU 43.A N GLU 43.A OE1 no hydrogen 2.877 N/A PHE 45.A N PRO 42.A O no hydrogen 3.191 N/A LYS 51.A NZ ASP 2.A OD2 no hydrogen 3.413 N/A LYS 51.A NZ GLN 48.A OE1 no hydrogen 2.959 N/A LYS 52.A N VAL 49.A O no hydrogen 3.313 N/A ARG 54.A N TYR 112.A OH no hydrogen 2.983 N/A LYS 57.A N HIS 55.A ND1 no hydrogen 2.976 N/A LYS 57.A NZ GLN 105.A OE1 no hydrogen 2.905 N/A LEU 58.A N HIS 55.A O no hydrogen 3.191 N/A VAL 59.A N VAL 138.A O no hydrogen 2.874 N/A GLN 60.A N GLU 75.A OE2 no hydrogen 3.123 N/A GLN 60.A NE2 LEU 61.A O no hydrogen 2.714 N/A TYR 62.A N VAL 73.A O no hydrogen 2.698 N/A ALA 63.A N VAL 73.A O no hydrogen 3.312 N/A VAL 64.A N TRP 4.A O no hydrogen 2.991 N/A VAL 65.A N TYR 71.A O no hydrogen 3.230 N/A SER 66.A N GLU 5.A OE2 no hydrogen 2.854 N/A SER 66.A OG GLU 5.A OE1 no hydrogen 2.456 N/A SER 66.A OG GLU 5.A OE2 no hydrogen 3.550 N/A TYR 71.A N VAL 65.A O no hydrogen 3.341 N/A ILE 72.A N LYS 39.A O no hydrogen 2.993 N/A VAL 73.A N ALA 63.A O no hydrogen 3.048 N/A THR 74.A N ALA 37.A O no hydrogen 2.917 N/A THR 74.A OG1 GLU 75.A O no hydrogen 3.507 N/A GLU 75.A N GLN 60.A O no hydrogen 3.140 N/A SER 78.A OG GLU 132.A OE2 no hydrogen 2.771 N/A SER 81.A OG ALA 125.A O no hydrogen 3.570 N/A SER 81.A OG ALA 126.A O no hydrogen 3.514 N/A LEU 82.A N ILE 128.A O no hydrogen 2.610 N/A LEU 83.A N SER 81.A OG no hydrogen 3.224 N/A LEU 83.A N ALA 125.A O no hydrogen 3.317 N/A PHE 85.A N SER 81.A O no hydrogen 2.979 N/A LEU 86.A N LEU 82.A O no hydrogen 2.881 N/A LYS 87.A N LEU 83.A O no hydrogen 3.078 N/A GLY 88.A N ASP 84.A O no hydrogen 2.618 N/A GLY 91.A N GLY 88.A O no hydrogen 3.303 N/A LYS 92.A NZ GLU 89.A O no hydrogen 2.954 N/A TYR 93.A N THR 90.A O no hydrogen 3.207 N/A LEU 94.A N GLY 91.A O no hydrogen 3.047 N/A ARG 95.A N GLN 98.A OE1 no hydrogen 2.820 N/A LEU 96.A N LEU 255.A OXT no hydrogen 3.125 N/A LEU 99.A N ARG 95.A O no hydrogen 3.013 N/A VAL 100.A N LEU 96.A O no hydrogen 2.824 N/A ASP 101.A N PRO 97.A O no hydrogen 3.070 N/A MET 102.A N GLN 98.A O no hydrogen 2.851 N/A ALA 103.A N LEU 99.A O no hydrogen 2.916 N/A ALA 104.A N VAL 100.A O no hydrogen 2.803 N/A GLN 105.A N ASP 101.A O no hydrogen 3.091 N/A GLN 105.A NE2 ASP 101.A O no hydrogen 3.561 N/A GLN 105.A NE2 ASP 101.A OD2 no hydrogen 2.915 N/A GLN 105.A NE2 LEU 134.A O no hydrogen 3.156 N/A ILE 106.A N MET 102.A O no hydrogen 3.067 N/A ALA 107.A N ALA 103.A O no hydrogen 2.865 N/A SER 108.A N ALA 104.A O no hydrogen 2.930 N/A GLY 109.A N GLN 105.A O no hydrogen 3.048 N/A MET 110.A N ILE 106.A O no hydrogen 2.961 N/A ALA 111.A N ALA 107.A O no hydrogen 2.700 N/A TYR 112.A N SER 108.A O no hydrogen 3.213 N/A VAL 113.A N GLY 109.A O no hydrogen 3.186 N/A GLU 114.A N MET 110.A O no hydrogen 2.780 N/A ARG 115.A N ALA 111.A O no hydrogen 3.077 N/A MET 116.A N TYR 112.A O no hydrogen 2.985 N/A ASN 117.A N GLU 114.A O no hydrogen 3.142 N/A TYR 118.A N VAL 113.A O no hydrogen 3.114 N/A VAL 119.A N ARG 145.A O no hydrogen 2.938 N/A HIS 120.A N ASP 166.A OD2 no hydrogen 2.659 N/A HIS 120.A NE2 ALA 139.A O no hydrogen 2.482 N/A ARG 121.A N ASP 166.A OD1 no hydrogen 2.988 N/A ASP 122.A N HIS 120.A ND1 no hydrogen 3.129 N/A ARG 124.A NE ASP 122.A OD1 no hydrogen 2.766 N/A ALA 125.A N GLU 176.A OE1 no hydrogen 3.131 N/A ASN 127.A N ARG 124.A O no hydrogen 2.997 N/A ASN 127.A ND2 ASP 122.A O no hydrogen 2.688 N/A ILE 128.A N ALA 125.A O no hydrogen 3.212 N/A LEU 129.A N LYS 137.A O no hydrogen 3.044 N/A VAL 130.A N GLY 80.A O no hydrogen 2.568 N/A GLY 131.A N VAL 135.A O no hydrogen 2.761 N/A VAL 135.A N GLU 132.A O no hydrogen 3.152 N/A CYS 136.A N GLN 105.A OE1 no hydrogen 3.003 N/A CYS 136.A SG LEU 134.A O no hydrogen 3.681 N/A LYS 137.A N LEU 129.A O no hydrogen 2.943 N/A LYS 137.A NZ GLU 75.A OE1 no hydrogen 2.922 N/A LYS 137.A NZ GLU 75.A OE2 no hydrogen 2.784 N/A VAL 138.A N LYS 57.A O no hydrogen 2.727 N/A ALA 139.A N ASN 127.A O no hydrogen 3.157 N/A PHE 141.A N GLU 46.A OE2 no hydrogen 3.270 N/A ALA 144.A N PHE 141.A O no hydrogen 3.277 N/A ARG 145.A N VAL 119.A O no hydrogen 3.047 N/A LYS 149.A NZ PRO 184.A O no hydrogen 3.234 N/A LYS 149.A NZ TYR 185.A O no hydrogen 3.368 N/A LYS 149.A NZ MET 188.A O no hydrogen 2.930 N/A TRP 150.A N PRO 147.A O no hydrogen 3.136 N/A TRP 150.A NE1 GLU 176.A OE1 no hydrogen 2.973 N/A THR 151.A N ILE 148.A O no hydrogen 3.154 N/A THR 151.A OG1 PRO 147.A O no hydrogen 2.657 N/A GLU 154.A N GLU 154.A OE1 no hydrogen 2.761 N/A ALA 155.A N ALA 152.A O no hydrogen 2.981 N/A ALA 156.A N ALA 152.A O no hydrogen 2.948 N/A LEU 157.A N PRO 153.A O no hydrogen 2.949 N/A TYR 158.A N GLU 154.A O no hydrogen 3.335 N/A GLY 159.A N ALA 155.A O no hydrogen 2.958 N/A ARG 160.A N GLU 154.A O no hydrogen 3.166 N/A PHE 161.A N GLY 159.A O no hydrogen 2.853 N/A THR 162.A N SER 165.A OG no hydrogen 2.944 N/A LYS 164.A N THR 162.A OG1 no hydrogen 3.138 N/A LYS 164.A NZ ARG 228.A O no hydrogen 2.756 N/A SER 165.A N THR 162.A O no hydrogen 3.130 N/A SER 165.A N THR 162.A OG1 no hydrogen 3.391 N/A SER 165.A OG THR 162.A O no hydrogen 2.499 N/A ASP 166.A N THR 162.A O no hydrogen 3.288 N/A VAL 167.A N ILE 163.A O no hydrogen 3.063 N/A TRP 168.A N LYS 164.A O no hydrogen 3.200 N/A SER 169.A N SER 165.A O no hydrogen 3.102 N/A SER 169.A OG TRP 150.A O no hydrogen 2.501 N/A SER 169.A OG SER 165.A O no hydrogen 3.368 N/A PHE 170.A N ASP 166.A O no hydrogen 2.867 N/A GLY 171.A N VAL 167.A O no hydrogen 3.113 N/A ILE 172.A N TRP 168.A O no hydrogen 3.221 N/A LEU 173.A N SER 169.A O no hydrogen 2.865 N/A LEU 174.A N PHE 170.A O no hydrogen 2.893 N/A THR 175.A OG1 ILE 172.A O no hydrogen 2.499 N/A GLU 176.A N ILE 172.A O no hydrogen 3.193 N/A LEU 177.A N LEU 173.A O no hydrogen 3.039 N/A THR 178.A N LEU 174.A O no hydrogen 2.972 N/A THR 178.A OG1 LEU 174.A O no hydrogen 3.060 N/A THR 178.A OG1 THR 175.A O no hydrogen 3.363 N/A THR 179.A OG1 THR 175.A O no hydrogen 2.753 N/A LYS 180.A N LEU 177.A O no hydrogen 3.381 N/A LYS 180.A NZ LEU 94.A O no hydrogen 3.151 N/A LYS 180.A NZ ASN 254.A O no hydrogen 3.079 N/A GLY 181.A N GLU 176.A O no hydrogen 2.619 N/A ARG 182.A N THR 179.A OG1 no hydrogen 3.203 N/A MET 188.A N TYR 185.A O no hydrogen 3.222 N/A VAL 189.A N GLU 192.A OE1 no hydrogen 3.508 N/A VAL 193.A N VAL 189.A O no hydrogen 2.885 N/A LEU 194.A N ASN 190.A O no hydrogen 2.965 N/A ASP 195.A N ARG 191.A O no hydrogen 3.125 N/A GLN 196.A N GLU 192.A O no hydrogen 3.057 N/A VAL 197.A N VAL 193.A O no hydrogen 2.999 N/A GLU 198.A N LEU 194.A O no hydrogen 3.362 N/A ARG 199.A N ASP 195.A O no hydrogen 3.295 N/A GLY 200.A N VAL 197.A O no hydrogen 2.985 N/A TYR 201.A N GLN 196.A O no hydrogen 2.827 N/A ARG 202.A NE TRP 221.A O no hydrogen 2.838 N/A ARG 202.A NH1 VAL 197.A O no hydrogen 3.017 N/A ARG 202.A NH1 TYR 201.A O no hydrogen 2.669 N/A ARG 202.A NH2 TRP 221.A O no hydrogen 2.828 N/A CYS 205.A SG PRO 206.A O no hydrogen 3.592 N/A CYS 205.A SG CYS 209.A O no hydrogen 3.141 N/A CYS 205.A SG GLU 211.A OE1 no hydrogen 3.511 N/A CYS 209.A N PRO 206.A O no hydrogen 3.077 N/A CYS 209.A SG PRO 210.A O no hydrogen 3.520 N/A SER 212.A OG TYR 241.A OH no hydrogen 2.671 N/A SER 212.A OG GLU 246.A OE2 no hydrogen 2.624 N/A LEU 213.A N PRO 210.A O no hydrogen 3.129 N/A HIS 214.A N PRO 210.A O no hydrogen 3.233 N/A HIS 214.A NE2 MET 203.A O no hydrogen 2.962 N/A ASP 215.A N GLU 211.A O no hydrogen 2.816 N/A LEU 216.A N SER 212.A O no hydrogen 3.376 N/A MET 217.A N LEU 213.A O no hydrogen 3.319 N/A CYS 218.A N HIS 214.A O no hydrogen 3.021 N/A CYS 218.A SG HIS 214.A O no hydrogen 3.420 N/A GLN 219.A N ASP 215.A O no hydrogen 2.978 N/A CYS 220.A N LEU 216.A O no hydrogen 3.123 N/A CYS 220.A SG LEU 216.A O no hydrogen 3.283 N/A TRP 221.A N CYS 218.A O no hydrogen 2.883 N/A ARG 222.A N GLN 219.A O no hydrogen 3.443 N/A ARG 222.A NH1 GLU 227.A O no hydrogen 2.867 N/A LYS 223.A NZ VAL 197.A O no hydrogen 2.487 N/A GLU 226.A N GLU 226.A OE2 no hydrogen 2.631 N/A GLU 227.A N GLU 224.A O no hydrogen 3.081 N/A ARG 228.A N PRO 225.A O no hydrogen 2.997 N/A ARG 228.A NE LYS 164.A O no hydrogen 3.056 N/A ARG 228.A NH1 ARG 222.A O no hydrogen 2.952 N/A ARG 228.A NH2 GLU 154.A OE2 no hydrogen 2.623 N/A ARG 228.A NH2 LYS 164.A O no hydrogen 2.810 N/A PHE 231.A N GLU 114.A OE2 no hydrogen 3.013 N/A GLU 232.A N GLU 114.A OE1 no hydrogen 3.337 N/A TYR 233.A N THR 230.A OG1 no hydrogen 3.077 N/A LEU 234.A N THR 230.A O no hydrogen 2.908 N/A GLN 235.A N PHE 231.A O no hydrogen 2.801 N/A GLN 235.A NE2 GLU 239.A OE2 no hydrogen 2.891 N/A ALA 236.A N GLU 232.A O no hydrogen 3.336 N/A PHE 237.A N TYR 233.A O no hydrogen 2.912 N/A LEU 238.A N LEU 234.A O no hydrogen 3.045 N/A GLU 239.A N GLN 235.A O no hydrogen 2.967 N/A ASP 240.A N ALA 236.A O no hydrogen 3.274 N/A TYR 241.A N LEU 238.A O no hydrogen 3.376 N/A TYR 241.A OH SER 212.A OG no hydrogen 2.671 N/A THR 243.A N ASP 240.A O no hydrogen 3.285 N/A SER 244.A N ASP 240.A O no hydrogen 2.921 N/A THR 245.A N TYR 241.A O no hydrogen 2.976 N/A GLU 246.A N TYR 241.A O no hydrogen 2.934 N/A TYR 249.A N GLU 246.A O no hydrogen 3.333 N/A TYR 249.A OH LEU 255.A OXT no hydrogen 2.495 N/A GLY 252.A N LEU 255.A O no hydrogen 2.595 N/A ASN 254.A N GLU 208.A OE1 no hydrogen 3.169 N/A ASN 254.A N GLU 208.A OE2 no hydrogen 3.131 N/A ASN 254.A ND2 GLU 208.A OE2 no hydrogen 3.115 N/A LEU 255.A N GLU 208.A OE1 no hydrogen 3.270 N/A