Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 2q42_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): MET 1.A N GLU 20.A OE2 no hydrogen 3.118 N/A GLN 2.A N HIS 18.A O no hydrogen 2.959 N/A GLU 4.A N ILE 16.A O no hydrogen 2.754 N/A VAL 6.A N ALA 14.A O no hydrogen 2.855 N/A CYS 8.A SG VAL 6.A O no hydrogen 3.578 N/A LEU 9.A N GLU 32.A OE2 no hydrogen 3.293 N/A ASN 12.A N CYS 8.A O no hydrogen 3.053 N/A ASN 12.A ND2 ASP 58.A OD2 no hydrogen 3.503 N/A TYR 13.A N GLY 168.A O no hydrogen 3.173 N/A TYR 13.A OH GLU 170.A OE1 no hydrogen 2.312 N/A ALA 14.A N VAL 6.A O no hydrogen 3.149 N/A TYR 15.A N VAL 28.A O no hydrogen 3.063 N/A TYR 15.A OH TYR 166.A O no hydrogen 2.809 N/A TYR 15.A OH CYS 167.A O no hydrogen 2.653 N/A ILE 16.A N GLU 4.A O no hydrogen 2.737 N/A LEU 17.A N GLY 26.A O no hydrogen 3.002 N/A HIS 18.A N GLN 2.A O no hydrogen 2.904 N/A ASP 19.A N THR 24.A O no hydrogen 2.714 N/A THR 22.A N ASP 19.A OD2 no hydrogen 2.743 N/A THR 22.A OG1 ASP 19.A OD2 no hydrogen 2.847 N/A THR 24.A OG1 ASP 19.A OD2 no hydrogen 3.246 N/A THR 24.A OG1 THR 22.A OG1 no hydrogen 3.250 N/A GLY 26.A N LEU 17.A O no hydrogen 3.165 N/A VAL 28.A N TYR 15.A O no hydrogen 2.782 N/A ASP 29.A N LEU 51.A O no hydrogen 2.870 N/A SER 31.A OG ASP 58.A O no hydrogen 2.597 N/A ILE 37.A N ALA 33.A O no hydrogen 2.722 N/A ASP 38.A N GLU 34.A O no hydrogen 2.966 N/A SER 39.A N PRO 35.A O no hydrogen 3.377 N/A SER 39.A OG GLU 4.A OE1 no hydrogen 2.684 N/A SER 39.A OG GLU 4.A OE2 no hydrogen 2.973 N/A LEU 40.A N ILE 36.A O no hydrogen 3.133 N/A LYS 41.A N ILE 37.A O no hydrogen 3.027 N/A ARG 42.A N SER 39.A O no hydrogen 2.822 N/A SER 43.A N SER 39.A O no hydrogen 2.856 N/A SER 43.A OG LEU 40.A O no hydrogen 2.835 N/A GLY 44.A N LEU 40.A O no hydrogen 2.896 N/A ARG 45.A N SER 43.A OG no hydrogen 3.349 N/A THR 48.A N VAL 25.A O no hydrogen 2.999 N/A LEU 51.A N VAL 27.A O no hydrogen 2.968 N/A ASN 52.A N ILE 75.A O no hydrogen 3.048 N/A THR 53.A N ASP 29.A OD1 no hydrogen 2.657 N/A THR 53.A OG1 ASP 29.A OD1 no hydrogen 3.335 N/A THR 53.A OG1 ASP 29.A OD2 no hydrogen 2.611 N/A THR 53.A OG1 HIS 54.A ND1 no hydrogen 2.874 N/A HIS 54.A ND1 THR 53.A OG1 no hydrogen 2.874 N/A HIS 59.A N HIS 56.A O no hydrogen 2.813 N/A HIS 59.A ND1 ASP 29.A OD2 no hydrogen 2.690 N/A HIS 59.A NE2 ASP 131.A OD2 no hydrogen 3.129 N/A THR 60.A N HIS 56.A O no hydrogen 3.197 N/A THR 60.A OG1 HIS 55.A O no hydrogen 3.146 N/A THR 60.A OG1 HIS 56.A O no hydrogen 3.345 N/A GLY 62.A N PRO 30.A O no hydrogen 2.883 N/A ASN 63.A N THR 60.A O no hydrogen 3.118 N/A ASN 63.A ND2 PRO 85.A O no hydrogen 3.115 N/A LEU 66.A N GLY 62.A O no hydrogen 2.924 N/A LYS 67.A N ASN 63.A O no hydrogen 2.917 N/A LYS 67.A NZ GLY 86.A O no hydrogen 2.858 N/A LYS 67.A NZ ASP 88.A OD1 no hydrogen 3.239 N/A LYS 67.A NZ ASP 88.A OD2 no hydrogen 3.298 N/A ASP 68.A N LEU 64.A O no hydrogen 3.181 N/A ARG 69.A N GLU 65.A O no hydrogen 2.872 N/A TYR 70.A N LYS 67.A O no hydrogen 3.282 N/A GLY 71.A N LYS 67.A O no hydrogen 2.715 N/A LYS 73.A N THR 48.A O no hydrogen 2.614 N/A VAL 74.A N ASP 88.A OD2 no hydrogen 2.778 N/A ILE 75.A N ILE 50.A O no hydrogen 2.522 N/A GLY 76.A N MET 89.A O no hydrogen 2.934 N/A SER 77.A OG GLY 115.A O no hydrogen 2.973 N/A MET 79.A N SER 77.A OG no hydrogen 3.113 N/A LYS 81.A N ALA 78.A O no hydrogen 3.006 N/A ARG 83.A N ASP 80.A O no hydrogen 2.656 N/A ARG 83.A NE ASP 80.A OD1 no hydrogen 2.804 N/A ARG 83.A NH1 GLU 143.A OE2 no hydrogen 2.990 N/A ARG 83.A NH2 ASP 80.A OD1 no hydrogen 2.837 N/A ARG 83.A NH2 GLU 143.A OE1 no hydrogen 3.038 N/A ILE 84.A N ASP 80.A O no hydrogen 2.856 N/A ILE 87.A N ILE 84.A O no hydrogen 3.176 N/A ASP 88.A N VAL 74.A O no hydrogen 2.799 N/A MET 89.A N VAL 74.A O no hydrogen 3.140 N/A LEU 91.A N GLY 76.A O no hydrogen 2.931 N/A LYS 92.A N ASP 95.A OD2 no hydrogen 3.188 N/A GLY 94.A N VAL 106.A O no hydrogen 2.678 N/A ASP 95.A N LYS 92.A O no hydrogen 3.006 N/A TRP 97.A N VAL 104.A O no hydrogen 3.065 N/A PHE 99.A N HIS 102.A O no hydrogen 2.786 N/A HIS 102.A N PHE 99.A O no hydrogen 2.994 N/A HIS 102.A NE2 ASP 21.A OD2 no hydrogen 2.888 N/A VAL 104.A N TRP 97.A O no hydrogen 2.958 N/A HIS 105.A N TYR 120.A O no hydrogen 2.802 N/A VAL 106.A N ASP 95.A O no hydrogen 2.940 N/A MET 107.A N SER 118.A O no hydrogen 3.155 N/A ASP 108.A N ASP 93.A OD1 no hydrogen 2.759 N/A THR 109.A N HIS 116.A O no hydrogen 2.678 N/A THR 109.A OG1 HIS 116.A ND1 no hydrogen 3.188 N/A THR 109.A OG1 SER 118.A OG no hydrogen 3.035 N/A THR 109.A OG1 THR 132.A OG1 no hydrogen 3.135 N/A GLY 111.A N THR 113.A O no hydrogen 3.053 N/A HIS 112.A ND1 LYS 140.A O no hydrogen 2.777 N/A HIS 112.A NE2 HIS 56.A ND1 no hydrogen 3.073 N/A LYS 114.A N GLU 143.A OE1 no hydrogen 2.642 N/A LYS 114.A NZ GLU 143.A O no hydrogen 3.112 N/A ILE 117.A N THR 53.A O no hydrogen 2.947 N/A SER 118.A N MET 107.A O no hydrogen 2.863 N/A SER 118.A OG THR 109.A OG1 no hydrogen 3.035 N/A LEU 119.A N PHE 128.A O no hydrogen 2.881 N/A TYR 120.A N HIS 105.A O no hydrogen 3.276 N/A PHE 121.A N ALA 126.A O no hydrogen 2.645 N/A SER 124.A N PHE 121.A O no hydrogen 2.961 N/A ARG 125.A N PRO 122.A O no hydrogen 3.082 N/A ALA 126.A N PHE 121.A O no hydrogen 3.286 N/A ILE 127.A N SER 164.A O no hydrogen 3.070 N/A PHE 128.A N LEU 119.A O no hydrogen 2.695 N/A THR 129.A OG1 MET 133.A O no hydrogen 2.750 N/A ASP 131.A N HIS 116.A NE2 no hydrogen 2.892 N/A THR 132.A N THR 129.A O no hydrogen 2.958 N/A THR 132.A OG1 THR 109.A O no hydrogen 3.250 N/A THR 132.A OG1 THR 109.A OG1 no hydrogen 3.135 N/A PHE 134.A N SER 137.A O no hydrogen 3.036 N/A SER 135.A OG TYR 192.A OH no hydrogen 2.831 N/A SER 135.A OG GLU 214.A OE2 no hydrogen 2.780 N/A LEU 136.A N GLU 214.A OE1 no hydrogen 2.830 N/A SER 137.A OG CYS 138.A O no hydrogen 3.140 N/A CYS 138.A SG GLY 139.A O no hydrogen 3.263 N/A GLY 139.A N THR 132.A O no hydrogen 3.001 N/A GLU 143.A N HIS 112.A O no hydrogen 3.179 N/A GLY 144.A N GLY 111.A O no hydrogen 2.843 N/A THR 145.A N GLN 148.A OE1 no hydrogen 2.779 N/A GLN 148.A N THR 145.A OG1 no hydrogen 3.051 N/A MET 149.A N THR 145.A O no hydrogen 2.843 N/A LEU 150.A N PRO 146.A O no hydrogen 3.080 N/A ALA 151.A N LYS 147.A O no hydrogen 3.085 N/A SER 152.A N GLN 148.A O no hydrogen 2.994 N/A SER 152.A OG PRO 110.A O no hydrogen 2.693 N/A SER 152.A OG GLN 148.A O no hydrogen 3.038 N/A LEU 153.A N MET 149.A O no hydrogen 2.895 N/A GLN 154.A N LEU 150.A O no hydrogen 2.946 N/A LYS 155.A N ALA 151.A O no hydrogen 3.073 N/A LYS 155.A NZ ASP 93.A OD1 no hydrogen 3.348 N/A LYS 155.A NZ ASP 93.A OD2 no hydrogen 3.534 N/A LYS 155.A NZ ASP 108.A O no hydrogen 2.926 N/A ILE 156.A N SER 152.A O no hydrogen 3.266 N/A THR 157.A N LEU 153.A O no hydrogen 2.817 N/A THR 157.A OG1 LEU 153.A O no hydrogen 3.189 N/A THR 157.A OG1 GLN 154.A O no hydrogen 3.206 N/A SER 158.A N LYS 155.A O no hydrogen 3.127 N/A SER 158.A OG LYS 155.A O no hydrogen 2.531 N/A LEU 159.A N ILE 156.A O no hydrogen 3.278 N/A THR 163.A N PRO 160.A O no hydrogen 3.068 N/A THR 163.A OG1 PRO 160.A O no hydrogen 2.733 N/A SER 164.A N ARG 125.A O no hydrogen 2.980 N/A ILE 165.A N THR 209.A O no hydrogen 2.863 N/A TYR 166.A N ILE 127.A O no hydrogen 3.350 N/A GLY 168.A N GLY 130.A O no hydrogen 2.947 N/A HIS 169.A ND1 ASP 11.A O no hydrogen 3.031 N/A HIS 169.A NE2 ASP 131.A OD2 no hydrogen 2.917 N/A GLU 170.A N ASP 11.A O no hydrogen 3.250 N/A THR 172.A OG1 THR 206.A OG1 no hydrogen 2.643 N/A ASN 175.A N TYR 171.A O no hydrogen 2.872 N/A ASN 175.A ND2 SER 135.A O no hydrogen 2.812 N/A SER 176.A N THR 172.A O no hydrogen 2.889 N/A SER 176.A OG LEU 173.A O no hydrogen 2.516 N/A LYS 177.A N LEU 173.A O no hydrogen 3.245 N/A PHE 178.A N SER 174.A O no hydrogen 3.366 N/A ALA 179.A N ASN 175.A O no hydrogen 2.862 N/A LEU 180.A N SER 176.A O no hydrogen 2.741 N/A SER 181.A N LYS 177.A O no hydrogen 3.012 N/A SER 181.A N PHE 178.A O no hydrogen 3.082 N/A SER 181.A OG PHE 178.A O no hydrogen 2.529 N/A LEU 182.A N ALA 179.A O no hydrogen 3.150 N/A GLU 183.A N ALA 179.A O no hydrogen 2.980 N/A ASN 186.A N GLU 183.A O no hydrogen 3.203 N/A ASN 186.A ND2 GLU 183.A OE2 no hydrogen 3.102 N/A ASN 186.A ND2 ALA 216.A O no hydrogen 3.457 N/A LEU 189.A N ASN 186.A OD1 no hydrogen 3.222 N/A GLN 190.A N ASN 186.A O no hydrogen 3.075 N/A SER 191.A N GLU 187.A O no hydrogen 2.641 N/A TYR 192.A N VAL 188.A O no hydrogen 2.827 N/A TYR 192.A OH SER 135.A OG no hydrogen 2.831 N/A ALA 193.A N LEU 189.A O no hydrogen 2.831 N/A ALA 194.A N GLN 190.A O no hydrogen 3.171 N/A HIS 195.A N SER 191.A O no hydrogen 3.386 N/A VAL 196.A N TYR 192.A O no hydrogen 2.960 N/A ALA 197.A N ALA 193.A O no hydrogen 2.957 N/A GLU 198.A N ALA 194.A O no hydrogen 3.116 N/A LEU 199.A N HIS 195.A O no hydrogen 3.053 N/A ARG 200.A N VAL 196.A O no hydrogen 2.971 N/A ARG 200.A NH1 LEU 204.A O no hydrogen 2.750 N/A SER 201.A N ALA 197.A O no hydrogen 2.749 N/A LYS 202.A N GLU 198.A O no hydrogen 3.292 N/A LYS 202.A N LEU 199.A O no hydrogen 3.023 N/A LYS 203.A N ARG 200.A O no hydrogen 3.296 N/A LEU 204.A N LEU 199.A O no hydrogen 2.848 N/A THR 206.A N GLU 170.A OE1 no hydrogen 3.209 N/A THR 206.A OG1 GLU 170.A OE2 no hydrogen 2.627 N/A THR 206.A OG1 THR 172.A OG1 no hydrogen 2.643 N/A THR 209.A N ILE 165.A O no hydrogen 2.693 N/A THR 209.A OG1 GLU 214.A OE2 no hydrogen 2.712 N/A THR 210.A N THR 209.A OG1 no hydrogen 2.643 N/A VAL 211.A N THR 163.A O no hydrogen 2.842 N/A LYS 212.A N ASP 161.A O no hydrogen 3.011 N/A MET 213.A N THR 210.A OG1 no hydrogen 3.178 N/A GLU 214.A N THR 210.A O no hydrogen 3.002 N/A LYS 215.A N VAL 211.A O no hydrogen 2.926 N/A LYS 215.A NZ ASP 161.A OD1 no hydrogen 2.994 N/A ALA 216.A N LYS 212.A O no hydrogen 3.100 N/A CYS 217.A N GLU 214.A O no hydrogen 3.146 N/A CYS 217.A SG MET 213.A O no hydrogen 3.627 N/A ASN 218.A N GLU 214.A O no hydrogen 2.797 N/A ASN 218.A ND2 SER 137.A O no hydrogen 3.053 N/A ASN 218.A ND2 GLU 214.A OE1 no hydrogen 3.189 N/A PHE 220.A N ASN 218.A OD1 no hydrogen 2.957 N/A LEU 221.A N ASN 218.A O no hydrogen 2.807 N/A ARG 222.A N PRO 219.A O no hydrogen 3.040 N/A ARG 222.A NE GLU 183.A OE1 no hydrogen 3.093 N/A ARG 222.A NE GLU 183.A OE2 no hydrogen 3.165 N/A ARG 222.A NH1 LYS 215.A O no hydrogen 2.923 N/A ARG 222.A NH2 GLU 183.A OE2 no hydrogen 2.855 N/A SER 223.A OG GLU 240.A O no hydrogen 3.485 N/A ASN 225.A N ARG 222.A O no hydrogen 2.910 N/A ILE 228.A N ASN 225.A OD1 no hydrogen 2.835 N/A ARG 229.A N ASN 225.A O no hydrogen 2.971 N/A ARG 229.A NE SER 223.A O no hydrogen 2.771 N/A ARG 229.A NH1 ALA 238.A O no hydrogen 2.645 N/A ARG 229.A NH2 ALA 238.A O no hydrogen 2.909 N/A ARG 230.A N THR 226.A O no hydrogen 2.984 N/A ALA 231.A N ASP 227.A O no hydrogen 3.056 N/A LEU 232.A N ARG 229.A O no hydrogen 3.146 N/A ARG 233.A N ARG 230.A O no hydrogen 3.228 N/A ILE 234.A N ARG 229.A O no hydrogen 2.718 N/A ALA 238.A N PRO 235.A O no hydrogen 3.038 N/A ASP 239.A N GLU 242.A OE2 no hydrogen 2.961 N/A GLU 242.A N ASP 239.A OD1 no hydrogen 2.752 N/A ALA 243.A N ASP 239.A O no hydrogen 2.850 N/A LEU 244.A N GLU 240.A O no hydrogen 3.038 N/A GLY 245.A N ALA 241.A O no hydrogen 2.996 N/A ILE 246.A N GLU 242.A O no hydrogen 3.280 N/A ILE 247.A N ALA 243.A O no hydrogen 3.249 N/A ARG 248.A N LEU 244.A O no hydrogen 2.858 N/A ARG 248.A NE ARG 248.A O no hydrogen 3.180 N/A ARG 248.A NE ASP 252.A OD1 no hydrogen 2.808 N/A ARG 248.A NH1 GLY 139.A O no hydrogen 3.283 N/A ARG 248.A NH2 ASP 252.A OD1 no hydrogen 2.987 N/A LYS 249.A N GLY 245.A O no hydrogen 3.066 N/A ALA 250.A N ILE 246.A O no hydrogen 3.151 N/A LYS 251.A N ILE 247.A O no hydrogen 2.867 N/A LYS 251.A NZ SER 137.A OG no hydrogen 3.425 N/A LYS 251.A NZ ASN 175.A OD1 no hydrogen 2.841 N/A ASP 252.A N ARG 248.A O no hydrogen 3.144 N/A ASP 253.A N LYS 249.A O no hydrogen 3.282 N/A PHE 254.A N LYS 251.A O no hydrogen 3.122 N/A