Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 2gzr_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ALA 4.A N PRO 1.A O no hydrogen 3.266 N/A LYS 6.A N ASN 2.A O no hydrogen 2.539 N/A GLY 7.A N ILE 3.A O no hydrogen 2.743 N/A SER 8.A OG ASP 58.A OD1 no hydrogen 2.721 N/A PHE 10.A N SER 8.A OG no hydrogen 2.968 N/A TYR 11.A OH PRO 70.A O no hydrogen 2.585 N/A HIS 12.A N VAL 33.A O no hydrogen 3.046 N/A HIS 12.A ND1 ASN 35.A OD1 no hydrogen 2.903 N/A SER 14.A N THR 31.A O no hydrogen 3.250 N/A THR 16.A N VAL 29.A O no hydrogen 2.961 N/A THR 16.A OG1 VAL 29.A O no hydrogen 3.465 N/A PHE 18.A N TYR 27.A O no hydrogen 3.219 N/A SER 20.A N ARG 25.A O no hydrogen 2.984 N/A SER 20.A OG ASP 22.A OD1 no hydrogen 2.861 N/A SER 20.A OG ARG 25.A O no hydrogen 3.480 N/A GLY 23.A N SER 20.A O no hydrogen 2.958 N/A THR 24.A N ASP 22.A OD1 no hydrogen 2.593 N/A THR 24.A OG1 ASP 22.A OD1 no hydrogen 2.709 N/A ARG 25.A N SER 20.A OG no hydrogen 3.197 N/A ARG 25.A NE TYR 27.A OH no hydrogen 3.485 N/A ARG 25.A NE ASP 91.A OD1 no hydrogen 2.881 N/A ARG 25.A NH1 ASP 22.A OD2 no hydrogen 2.875 N/A ARG 25.A NH2 ASP 22.A OD2 no hydrogen 2.928 N/A HIS 26.A ND1 ASP 19.A OD1 no hydrogen 2.767 N/A TYR 27.A N PHE 18.A O no hydrogen 2.756 N/A TYR 27.A OH ASP 91.A OD1 no hydrogen 3.408 N/A TYR 27.A OH ASP 91.A OD2 no hydrogen 3.084 N/A ARG 28.A N GLY 76.A O no hydrogen 3.107 N/A ARG 28.A NH1 THR 79.A O no hydrogen 3.085 N/A VAL 29.A N THR 16.A O no hydrogen 2.949 N/A TRP 30.A N ALA 74.A O no hydrogen 3.146 N/A THR 31.A N SER 14.A O no hydrogen 2.885 N/A ALA 32.A N ILE 72.A O no hydrogen 2.752 N/A VAL 33.A N HIS 12.A O no hydrogen 3.063 N/A ASN 35.A N PHE 10.A O no hydrogen 2.467 N/A ASN 35.A ND2 SER 8.A O no hydrogen 3.355 N/A ASN 35.A ND2 VAL 9.A O no hydrogen 2.626 N/A GLY 42.A N PRO 39.A O no hydrogen 2.685 N/A TYR 43.A N ASN 123.A O no hydrogen 2.981 N/A TYR 43.A OH THR 36.A O no hydrogen 2.470 N/A ILE 45.A N ARG 128.A O no hydrogen 3.288 N/A LEU 46.A N VAL 71.A O no hydrogen 2.951 N/A TYR 47.A N GLY 130.A O no hydrogen 2.895 N/A TYR 47.A OH GLU 119.A OE2 no hydrogen 2.557 N/A ASP 49.A N TYR 92.A OH no hydrogen 3.099 N/A GLY 50.A N VAL 75.A O no hydrogen 3.040 N/A ASN 51.A ND2 TYR 77.A O no hydrogen 2.803 N/A VAL 53.A N ASP 49.A O no hydrogen 3.108 N/A ARG 55.A N ALA 52.A O no hydrogen 3.195 N/A ARG 55.A N VAL 53.A O no hydrogen 3.058 N/A ARG 55.A NH1 ASN 225.A OD1 no hydrogen 3.028 N/A LEU 60.A N ASP 57.A OD2 no hydrogen 3.317 N/A LEU 61.A N ASP 57.A O no hydrogen 3.332 N/A LYS 62.A N ASP 58.A O no hydrogen 2.729 N/A GLN 63.A N GLU 59.A O no hydrogen 2.951 N/A LEU 64.A N LEU 60.A O no hydrogen 2.820 N/A SER 65.A N LEU 61.A O no hydrogen 2.952 N/A SER 65.A OG LEU 61.A O no hydrogen 2.758 N/A GLU 66.A N GLN 63.A O no hydrogen 2.952 N/A LYS 67.A N LEU 64.A O no hydrogen 3.275 N/A THR 68.A N SER 236.A O no hydrogen 3.058 N/A VAL 71.A N PRO 44.A O no hydrogen 2.801 N/A ILE 72.A N ALA 32.A O no hydrogen 2.919 N/A VAL 73.A N LEU 46.A O no hydrogen 2.966 N/A ALA 74.A N TRP 30.A O no hydrogen 2.935 N/A GLY 76.A N ARG 28.A O no hydrogen 2.768 N/A TYR 77.A N ASN 51.A OD1 no hydrogen 2.595 N/A TYR 77.A OH ASP 91.A OD2 no hydrogen 2.722 N/A GLN 78.A N HIS 26.A O no hydrogen 3.013 N/A GLN 78.A NE2 TYR 27.A O no hydrogen 3.114 N/A LEU 81.A N THR 79.A OG1 no hydrogen 3.265 N/A SER 87.A N ASP 84.A OD1 no hydrogen 2.955 N/A ARG 88.A N ASP 84.A O no hydrogen 2.987 N/A ARG 88.A NE ASP 49.A OD1 no hydrogen 2.662 N/A ARG 88.A NE ASP 49.A OD2 no hydrogen 3.422 N/A ARG 88.A NH2 ASP 49.A OD2 no hydrogen 2.872 N/A ARG 88.A NH2 HIS 134.A O no hydrogen 3.229 N/A ALA 89.A N LEU 85.A O no hydrogen 3.122 N/A TYR 90.A N ASN 86.A O no hydrogen 3.303 N/A TYR 90.A N SER 87.A O no hydrogen 3.077 N/A ASP 91.A N SER 87.A O no hydrogen 2.940 N/A TYR 92.A N ARG 88.A O no hydrogen 2.990 N/A THR 93.A OG1 ALA 89.A O no hydrogen 3.117 N/A THR 93.A OG1 TYR 90.A O no hydrogen 3.555 N/A GLY 101.A N THR 93.A OG1 no hydrogen 2.568 N/A GLY 102.A N TYR 90.A O no hydrogen 2.707 N/A SER 103.A N THR 93.A O no hydrogen 3.186 N/A SER 103.A OG THR 93.A O no hydrogen 3.447 N/A SER 103.A OG ASP 143.A OD2 no hydrogen 2.800 N/A PHE 106.A N GLY 102.A O no hydrogen 3.018 N/A ARG 107.A N SER 103.A O no hydrogen 2.788 N/A ARG 107.A NE SER 144.A OG no hydrogen 3.064 N/A ARG 107.A NH1 ASN 104.A OD1 no hydrogen 2.819 N/A ARG 107.A NH2 ASP 143.A OD2 no hydrogen 2.259 N/A ARG 107.A NH2 SER 144.A OG no hydrogen 3.313 N/A GLN 108.A N ASN 104.A O no hydrogen 2.886 N/A LEU 109.A N ASN 105.A O no hydrogen 2.948 N/A LEU 110.A N PHE 106.A O no hydrogen 2.864 N/A GLU 111.A N ARG 107.A O no hydrogen 2.784 N/A THR 112.A N GLN 108.A O no hydrogen 2.999 N/A THR 112.A OG1 GLN 108.A O no hydrogen 2.841 N/A ARG 113.A N LEU 109.A O no hydrogen 2.979 N/A ILE 114.A N LEU 109.A O no hydrogen 3.113 N/A ALA 115.A N LEU 110.A O no hydrogen 2.900 N/A LYS 117.A N ARG 113.A O no hydrogen 3.312 N/A LYS 117.A NZ GLN 120.A OE1 no hydrogen 2.874 N/A VAL 118.A N ILE 114.A O no hydrogen 2.890 N/A GLU 119.A N ALA 115.A O no hydrogen 3.143 N/A GLN 120.A N LYS 117.A O no hydrogen 3.364 N/A LEU 122.A N GLU 119.A O no hydrogen 3.161 N/A ASN 123.A ND2 ALA 40.A O no hydrogen 3.269 N/A ASP 125.A N TYR 43.A O no hydrogen 2.867 N/A ARG 126.A NE GLU 119.A OE1 no hydrogen 3.203 N/A GLN 127.A N ASP 125.A OD1 no hydrogen 3.120 N/A ARG 128.A N ASP 125.A O no hydrogen 2.593 N/A ARG 128.A NH1 ASP 125.A OD2 no hydrogen 3.372 N/A ARG 128.A NH2 ILE 235.A O no hydrogen 3.429 N/A ARG 129.A NE GLU 119.A OE1 no hydrogen 3.495 N/A ARG 129.A NE GLU 119.A OE2 no hydrogen 3.066 N/A ARG 129.A NH1 TYR 150.A O no hydrogen 2.907 N/A ARG 129.A NH2 GLU 119.A OE1 no hydrogen 3.562 N/A GLY 130.A N ILE 45.A O no hydrogen 2.716 N/A LEU 131.A N SER 153.A O no hydrogen 2.968 N/A TRP 132.A N TYR 47.A O no hydrogen 3.045 N/A GLY 133.A N TYR 155.A O no hydrogen 3.146 N/A HIS 134.A NE2 HIS 221.A O no hydrogen 3.073 N/A SER 135.A N ALA 157.A O no hydrogen 2.835 N/A SER 135.A OG HIS 221.A NE2 no hydrogen 2.754 N/A GLY 137.A N HIS 134.A O no hydrogen 2.775 N/A LEU 139.A N SER 135.A O no hydrogen 3.201 N/A PHE 140.A N TYR 136.A O no hydrogen 3.166 N/A VAL 141.A N GLY 137.A O no hydrogen 3.217 N/A VAL 141.A N GLY 138.A O no hydrogen 3.223 N/A LEU 142.A N GLY 138.A O no hydrogen 3.301 N/A ASP 143.A N LEU 139.A O no hydrogen 2.982 N/A SER 144.A N PHE 140.A O no hydrogen 2.869 N/A SER 144.A OG PHE 140.A O no hydrogen 2.714 N/A TRP 145.A N VAL 141.A O no hydrogen 2.684 N/A LEU 146.A N LEU 142.A O no hydrogen 3.033 N/A SER 147.A N SER 144.A O no hydrogen 3.049 N/A SER 147.A OG ASP 143.A O no hydrogen 3.182 N/A SER 148.A N SER 144.A O no hydrogen 2.699 N/A SER 148.A OG GLU 111.A OE1 no hydrogen 3.371 N/A SER 148.A OG GLU 111.A OE2 no hydrogen 2.948 N/A TYR 150.A N SER 148.A OG no hydrogen 2.850 N/A ARG 152.A N ARG 129.A O no hydrogen 2.995 N/A SER 153.A N ARG 129.A O no hydrogen 3.023 N/A TYR 154.A N HIS 184.A ND1 no hydrogen 2.886 N/A TYR 154.A OH PHE 151.A O no hydrogen 2.954 N/A TYR 155.A N LEU 131.A O no hydrogen 2.805 N/A TYR 155.A OH ASP 234.A OD2 no hydrogen 2.492 N/A SER 156.A N ALA 186.A O no hydrogen 2.938 N/A SER 156.A OG GLY 138.A O no hydrogen 2.873 N/A ALA 157.A N GLY 133.A O no hydrogen 2.894 N/A SER 160.A N SER 135.A O no hydrogen 3.314 N/A TYR 165.A N LEU 161.A O no hydrogen 3.202 N/A LEU 168.A N TYR 165.A O no hydrogen 2.914 N/A ARG 171.A N ALA 167.A O no hydrogen 2.759 N/A ARG 171.A NH1 GLU 97.A OE2 no hydrogen 2.481 N/A ARG 171.A NH1 ASP 143.A OD1 no hydrogen 3.497 N/A VAL 172.A N LEU 168.A O no hydrogen 2.832 N/A THR 173.A N LEU 169.A O no hydrogen 2.862 N/A THR 173.A OG1 SER 170.A O no hydrogen 3.233 N/A ALA 174.A N ARG 171.A O no hydrogen 3.269 N/A VAL 175.A N VAL 172.A O no hydrogen 3.405 N/A GLN 179.A N GLU 176.A OE1 no hydrogen 2.599 N/A GLN 179.A NE2 GLU 176.A OE2 no hydrogen 3.376 N/A CYS 181.A SG GLY 208.A O no hydrogen 3.666 N/A LYS 183.A N PHE 180.A O no hydrogen 3.249 N/A LYS 183.A NZ TRP 145.A O no hydrogen 2.586 N/A LYS 183.A NZ SER 148.A O no hydrogen 2.648 N/A LEU 185.A N ASN 210.A O no hydrogen 3.194 N/A ALA 186.A N TYR 154.A O no hydrogen 2.830 N/A ILE 187.A N VAL 212.A O no hydrogen 3.023 N/A SER 190.A N LEU 219.A O no hydrogen 2.498 N/A ALA 191.A N GLY 189.A O no hydrogen 2.475 N/A LYS 196.A N GLY 192.A O no hydrogen 3.004 N/A ILE 197.A N VAL 193.A O no hydrogen 3.044 N/A HIS 198.A N LEU 194.A O no hydrogen 2.657 N/A THR 199.A N SER 195.A O no hydrogen 2.729 N/A THR 199.A OG1 SER 195.A O no hydrogen 2.853 N/A THR 200.A N LYS 196.A O no hydrogen 2.886 N/A THR 200.A OG1 LYS 196.A O no hydrogen 2.733 N/A LEU 201.A N ILE 197.A O no hydrogen 2.929 N/A THR 202.A N HIS 198.A O no hydrogen 2.866 N/A THR 202.A OG1 HIS 198.A O no hydrogen 2.630 N/A ILE 203.A N THR 199.A O no hydrogen 2.797 N/A LEU 204.A N THR 200.A O no hydrogen 2.846 N/A LYS 205.A N LEU 201.A O no hydrogen 2.860 N/A ASP 206.A N THR 202.A O no hydrogen 2.980 N/A LYS 207.A N ILE 203.A O no hydrogen 3.005 N/A LYS 207.A N LEU 204.A O no hydrogen 3.028 N/A LYS 207.A NZ THR 173.A O no hydrogen 3.076 N/A LYS 207.A NZ VAL 175.A O no hydrogen 2.653 N/A GLY 208.A N LYS 205.A O no hydrogen 2.720 N/A VAL 209.A N LEU 204.A O no hydrogen 2.721 N/A ASN 210.A N LYS 183.A O no hydrogen 3.344 N/A VAL 212.A N LEU 185.A O no hydrogen 2.828 N/A TRP 214.A N ILE 187.A O no hydrogen 3.009 N/A PHE 216.A N GLU 188.A O no hydrogen 2.858 N/A ASN 218.A ND2 SER 190.A O no hydrogen 3.540 N/A LEU 219.A N PHE 216.A O no hydrogen 3.170 N/A HIS 221.A NE2 SER 135.A OG no hydrogen 2.754 N/A ALA 226.A N PRO 223.A O no hydrogen 3.197 N/A SER 227.A OG PHE 224.A O no hydrogen 3.204 N/A PHE 228.A N PHE 224.A O no hydrogen 3.052 N/A ARG 229.A N ASN 225.A O no hydrogen 2.918 N/A ARG 229.A NH1 ARG 55.A O no hydrogen 3.261 N/A GLN 230.A N ALA 226.A O no hydrogen 2.902 N/A GLN 230.A NE2 GLN 230.A O no hydrogen 2.857 N/A GLN 230.A NE2 GLU 238.A OE2 no hydrogen 3.183 N/A ALA 231.A N SER 227.A O no hydrogen 2.879 N/A LEU 232.A N PHE 228.A O no hydrogen 3.406 N/A LEU 233.A N ARG 229.A O no hydrogen 2.903 N/A ASP 234.A N GLN 230.A O no hydrogen 2.673 N/A ILE 235.A N ALA 231.A O no hydrogen 2.736 N/A SER 236.A N LEU 232.A O no hydrogen 2.971 N/A SER 236.A N LEU 233.A O no hydrogen 3.174 N/A SER 236.A OG LEU 232.A O no hydrogen 3.553 N/A SER 236.A OG LEU 233.A O no hydrogen 2.626 N/A GLY 237.A N ASP 234.A O no hydrogen 2.860 N/A GLU 238.A N LEU 233.A O no hydrogen 3.176 N/A