Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 5i01_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLN 3.A N GLN 3.A OE1 no hydrogen 2.957 N/A ARG 5.A N THR 1.A O no hydrogen 2.918 N/A VAL 6.A N LEU 2.A O no hydrogen 2.949 N/A ALA 7.A N GLN 3.A O no hydrogen 2.989 N/A ALA 8.A N GLU 4.A O no hydrogen 2.871 N/A HIS 9.A N ARG 5.A O no hydrogen 3.155 N/A PHE 10.A N VAL 6.A O no hydrogen 3.227 N/A ALA 11.A N ALA 7.A O no hydrogen 3.003 N/A GLU 12.A N ALA 8.A O no hydrogen 2.817 N/A SER 13.A N HIS 9.A O no hydrogen 2.868 N/A SER 13.A OG GLU 168.A OE1 no hydrogen 2.936 N/A ILE 14.A N PHE 10.A O no hydrogen 2.803 N/A ARG 15.A N ALA 11.A O no hydrogen 2.869 N/A ALA 16.A N GLU 12.A O no hydrogen 2.912 N/A LYS 17.A N SER 13.A O no hydrogen 3.199 N/A LYS 17.A NZ GLU 168.A O no hydrogen 3.355 N/A GLN 18.A N ILE 14.A O no hydrogen 2.990 N/A GLU 19.A N ARG 15.A O no hydrogen 3.253 N/A ALA 20.A N ALA 16.A O no hydrogen 3.237 N/A GLU 21.A N LYS 17.A O no hydrogen 3.010 N/A LYS 22.A N GLU 19.A O no hydrogen 3.045 N/A ILE 23.A N ALA 20.A O no hydrogen 3.235 N/A LEU 24.A N ALA 20.A O no hydrogen 2.904 N/A THR 28.A N LEU 24.A O no hydrogen 3.275 N/A THR 28.A OG1 LEU 24.A O no hydrogen 2.585 N/A VAL 29.A N VAL 25.A O no hydrogen 3.191 N/A GLN 30.A N GLU 26.A O no hydrogen 3.034 N/A ALA 31.A N PRO 27.A O no hydrogen 2.836 N/A ALA 32.A N THR 28.A O no hydrogen 3.038 N/A GLU 33.A N VAL 29.A O no hydrogen 2.864 N/A LEU 34.A N GLN 30.A O no hydrogen 3.026 N/A MET 35.A N ALA 31.A O no hydrogen 3.131 N/A LEU 36.A N ALA 32.A O no hydrogen 2.924 N/A GLN 37.A N GLU 33.A O no hydrogen 2.997 N/A CYS 38.A N LEU 34.A O no hydrogen 3.127 N/A CYS 38.A SG LYS 44.A O no hydrogen 3.514 N/A CYS 38.A SG GLY 105.A O no hydrogen 3.567 N/A LEU 39.A N MET 35.A O no hydrogen 2.977 N/A MET 40.A N LEU 36.A O no hydrogen 3.023 N/A ASN 41.A N GLN 37.A O no hydrogen 3.147 N/A GLY 43.A N CYS 38.A O no hydrogen 2.806 N/A LYS 44.A N ASP 106.A OD1 no hydrogen 2.798 N/A LYS 44.A NZ LEU 101.A O no hydrogen 2.856 N/A LYS 44.A NZ ASP 106.A OD2 no hydrogen 2.904 N/A ILE 45.A N ALA 70.A O no hydrogen 3.017 N/A LEU 46.A N VAL 107.A O no hydrogen 2.679 N/A ALA 47.A N VAL 72.A O no hydrogen 3.051 N/A CYS 48.A N VAL 109.A O no hydrogen 2.998 N/A ASN 50.A ND2 ASN 119.A OD1 no hydrogen 2.762 N/A SER 53.A N ASN 50.A O no hydrogen 2.925 N/A ALA 54.A N GLY 51.A O no hydrogen 3.052 N/A ALA 55.A N GLY 51.A O no hydrogen 3.413 N/A ASP 56.A N GLY 52.A O no hydrogen 3.046 N/A ALA 57.A N SER 53.A O no hydrogen 2.976 N/A GLN 58.A N ALA 54.A O no hydrogen 3.203 N/A HIS 59.A N ALA 55.A O no hydrogen 2.986 N/A PHE 60.A N ASP 56.A O no hydrogen 2.930 N/A ALA 61.A N ALA 57.A O no hydrogen 3.090 N/A ALA 62.A N GLN 58.A O no hydrogen 2.979 N/A GLU 63.A N HIS 59.A O no hydrogen 3.165 N/A MET 64.A N PHE 60.A O no hydrogen 3.261 N/A MET 64.A N ALA 61.A O no hydrogen 3.247 N/A THR 65.A N ALA 61.A O no hydrogen 3.058 N/A THR 65.A OG1 ALA 61.A O no hydrogen 3.222 N/A THR 65.A OG1 ALA 62.A O no hydrogen 3.495 N/A GLY 66.A N ALA 62.A O no hydrogen 3.128 N/A GLU 68.A N GLU 68.A OE1 no hydrogen 2.954 N/A LEU 69.A N MET 64.A O no hydrogen 3.068 N/A VAL 72.A N ILE 45.A O no hydrogen 2.986 N/A LEU 74.A N ALA 47.A O no hydrogen 2.783 N/A THR 75.A OG1 ALA 54.A O no hydrogen 3.383 N/A SER 79.A N ASP 77.A OD1 no hydrogen 3.277 N/A LEU 81.A N ASP 77.A O no hydrogen 2.925 N/A THR 82.A N THR 78.A O no hydrogen 2.993 N/A THR 82.A OG1 THR 78.A O no hydrogen 2.753 N/A ALA 83.A N SER 79.A O no hydrogen 2.979 N/A ILE 84.A N ALA 80.A O no hydrogen 3.091 N/A GLY 85.A N LEU 81.A O no hydrogen 2.969 N/A ASN 86.A N THR 82.A O no hydrogen 3.059 N/A ASN 86.A ND2 ASP 87.A OD1 no hydrogen 3.211 N/A ASP 87.A N ALA 83.A O no hydrogen 2.868 N/A TYR 88.A N ILE 84.A O no hydrogen 2.827 N/A GLY 89.A N ILE 84.A O no hydrogen 2.787 N/A HIS 92.A N GLY 89.A O no hydrogen 3.239 N/A VAL 93.A N PHE 90.A O no hydrogen 3.324 N/A SER 95.A OG HIS 92.A O no hydrogen 3.528 N/A LYS 96.A N HIS 92.A O no hydrogen 3.151 N/A GLN 97.A NE2 LEU 74.A O no hydrogen 2.895 N/A GLN 97.A NE2 VAL 93.A O no hydrogen 2.866 N/A VAL 98.A N PHE 94.A O no hydrogen 3.045 N/A ARG 99.A N SER 95.A O no hydrogen 3.215 N/A ALA 100.A N LYS 96.A O no hydrogen 3.004 N/A LEU 101.A N GLN 97.A O no hydrogen 2.870 N/A GLY 102.A N VAL 98.A O no hydrogen 2.769 N/A ARG 103.A N ASP 106.A OD2 no hydrogen 2.834 N/A ARG 103.A NH1 ALA 100.A O no hydrogen 3.221 N/A ARG 103.A NH1 GLY 102.A O no hydrogen 3.229 N/A GLY 105.A N ASP 131.A O no hydrogen 3.105 N/A ASP 106.A N ARG 103.A O no hydrogen 3.298 N/A VAL 107.A N LYS 44.A O no hydrogen 2.996 N/A LEU 108.A N HIS 133.A O no hydrogen 3.110 N/A VAL 109.A N LEU 46.A O no hydrogen 2.718 N/A GLY 110.A N ILE 135.A O no hydrogen 2.998 N/A ILE 111.A N CYS 48.A O no hydrogen 2.766 N/A SER 112.A N LEU 137.A O no hydrogen 2.855 N/A SER 112.A OG SER 117.A OG no hydrogen 3.151 N/A GLY 115.A N SER 112.A O no hydrogen 3.321 N/A GLY 115.A N SER 112.A OG no hydrogen 3.100 N/A ASN 116.A N SER 114.A OG no hydrogen 3.342 N/A SER 117.A OG SER 112.A OG no hydrogen 3.151 N/A ASN 119.A ND2 ASN 50.A OD1 no hydrogen 2.968 N/A ILE 121.A N SER 117.A O no hydrogen 2.910 N/A GLU 122.A N ALA 118.A O no hydrogen 3.066 N/A ALA 123.A N ASN 119.A O no hydrogen 3.165 N/A VAL 124.A N VAL 120.A O no hydrogen 3.065 N/A LYS 125.A N ILE 121.A O no hydrogen 3.157 N/A LYS 125.A NZ GLU 122.A OE2 no hydrogen 3.518 N/A ALA 126.A N GLU 122.A O no hydrogen 3.167 N/A ALA 127.A N ALA 123.A O no hydrogen 2.977 N/A HIS 128.A N VAL 124.A O no hydrogen 2.876 N/A HIS 128.A NE2 ASP 153.A OD2 no hydrogen 2.845 N/A GLU 129.A N LYS 125.A O no hydrogen 2.848 N/A ARG 130.A N ALA 126.A O no hydrogen 2.990 N/A ARG 130.A NH1 ARG 99.A O no hydrogen 2.619 N/A ARG 130.A NH1 GLY 102.A O no hydrogen 3.279 N/A ARG 130.A NH2 ARG 99.A O no hydrogen 3.058 N/A ASP 131.A N HIS 128.A O no hydrogen 2.894 N/A MET 132.A N ALA 127.A O no hydrogen 2.891 N/A HIS 133.A N ASP 106.A O no hydrogen 3.200 N/A VAL 134.A N ASP 153.A OD1 no hydrogen 2.835 N/A ILE 135.A N LEU 108.A O no hydrogen 2.813 N/A ALA 136.A N VAL 154.A O no hydrogen 3.060 N/A LEU 137.A N GLY 110.A O no hydrogen 2.876 N/A THR 138.A N LEU 156.A O no hydrogen 3.057 N/A THR 138.A OG1 ASN 157.A OD1 no hydrogen 2.604 N/A ARG 140.A N HIS 160.A O no hydrogen 3.272 N/A ARG 140.A NE PRO 161.A O no hydrogen 2.916 N/A ARG 140.A NH2 PRO 161.A O no hydrogen 3.323 N/A GLY 142.A N GLY 139.A O no hydrogen 3.124 N/A GLY 143.A N ASP 141.A OD1 no hydrogen 2.813 N/A LYS 144.A N ASN 116.A OD1 no hydrogen 2.938 N/A ILE 145.A N GLY 115.A O no hydrogen 2.896 N/A ALA 146.A N GLY 142.A O no hydrogen 2.994 N/A MET 148.A N ILE 145.A O no hydrogen 3.060 N/A LYS 150.A N ASP 153.A OD2 no hydrogen 2.940 N/A ASP 153.A N LYS 150.A O no hydrogen 3.154 N/A VAL 154.A N VAL 134.A O no hydrogen 3.042 N/A LEU 156.A N ALA 136.A O no hydrogen 2.855 N/A ASN 157.A ND2 ARG 140.A O no hydrogen 2.938 N/A VAL 158.A N THR 138.A O no hydrogen 2.968 N/A HIS 160.A N VAL 158.A O no hydrogen 2.880 N/A ARG 162.A N HIS 160.A ND1 no hydrogen 3.289 N/A ARG 165.A NE GLU 168.A OE1 no hydrogen 2.871 N/A ARG 165.A NH1 HIS 9.A ND1 no hydrogen 3.421 N/A ARG 165.A NH1 GLU 168.A OE1 no hydrogen 3.372 N/A ARG 165.A NH1 GLU 168.A OE2 no hydrogen 2.750 N/A ARG 165.A NH2 HIS 9.A ND1 no hydrogen 3.447 N/A ARG 165.A NH2 GLU 12.A OE1 no hydrogen 2.705 N/A ILE 166.A N ARG 162.A O no hydrogen 3.056 N/A GLN 167.A N THR 163.A O no hydrogen 2.952 N/A GLU 168.A N ALA 164.A O no hydrogen 3.241 N/A ASN 169.A N ARG 165.A O no hydrogen 3.141 N/A ASN 169.A ND2 ARG 165.A O no hydrogen 2.743 N/A HIS 170.A N ILE 166.A O no hydrogen 2.881 N/A HIS 170.A NE2 THR 138.A O no hydrogen 3.124 N/A ILE 171.A N GLN 167.A O no hydrogen 3.118 N/A LEU 172.A N GLU 168.A O no hydrogen 3.477 N/A LEU 173.A N ASN 169.A O no hydrogen 2.911 N/A ILE 174.A N HIS 170.A O no hydrogen 2.925 N/A HIS 175.A N ILE 171.A O no hydrogen 3.025 N/A HIS 175.A NE2 HIS 59.A NE2 no hydrogen 3.250 N/A ALA 176.A N LEU 172.A O no hydrogen 2.935 N/A MET 177.A N LEU 173.A O no hydrogen 2.975 N/A CYS 178.A N ILE 174.A O no hydrogen 2.933 N/A CYS 178.A SG ILE 174.A O no hydrogen 3.270 N/A ASP 179.A N HIS 175.A O no hydrogen 3.058 N/A CYS 180.A N ALA 176.A O no hydrogen 3.131 N/A CYS 180.A SG ALA 176.A O no hydrogen 3.231 N/A ILE 181.A N MET 177.A O no hydrogen 3.049 N/A ASP 182.A N CYS 178.A O no hydrogen 2.988 N/A SER 183.A N ASP 179.A O no hydrogen 3.049 N/A SER 183.A OG CYS 180.A O no hydrogen 2.729 N/A VAL 184.A N ILE 181.A O no hydrogen 3.101 N/A