Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1q40_B.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ALA 5.A N SER 1.A O no hydrogen 3.096 N/A THR 6.A N ARG 2.A O no hydrogen 3.332 N/A THR 6.A OG1 ARG 2.A O no hydrogen 2.876 N/A ASN 7.A N ASN 3.A O no hydrogen 3.154 N/A PHE 8.A N LEU 4.A O no hydrogen 3.331 N/A ILE 9.A N ALA 5.A O no hydrogen 3.009 N/A ALA 10.A N THR 6.A O no hydrogen 3.094 N/A ASN 11.A N ASN 7.A O no hydrogen 3.032 N/A TYR 12.A N PHE 8.A O no hydrogen 2.862 N/A TYR 12.A OH TYR 26.A OH no hydrogen 2.611 N/A LEU 13.A N ILE 9.A O no hydrogen 3.004 N/A LYS 14.A N ALA 10.A O no hydrogen 3.236 N/A LEU 15.A N ASN 11.A O no hydrogen 3.243 N/A TRP 16.A N TYR 12.A O no hydrogen 2.805 N/A ASP 17.A N LEU 13.A O no hydrogen 3.013 N/A ALA 18.A N LEU 15.A O no hydrogen 3.145 N/A ARG 20.A NE TRP 16.A O no hydrogen 2.894 N/A ARG 20.A NH1 PHE 83.A O no hydrogen 2.945 N/A ARG 20.A NH1 LEU 86.A O no hydrogen 2.952 N/A ARG 20.A NH2 TRP 16.A O no hydrogen 3.422 N/A ARG 20.A NH2 PRO 87.A O no hydrogen 3.039 N/A ARG 20.A NH2 THR 89.A OG1 no hydrogen 3.325 N/A SER 21.A N ASN 19.A OD1 no hydrogen 3.389 N/A SER 21.A OG ASN 19.A OD1 no hydrogen 2.602 N/A GLU 22.A N ASN 19.A O no hydrogen 3.163 N/A LEU 23.A N ARG 20.A O no hydrogen 3.170 N/A LEU 25.A N LEU 23.A O no hydrogen 3.002 N/A TYR 26.A OH TYR 12.A OH no hydrogen 2.611 N/A TYR 26.A OH ASP 165.A OD2 no hydrogen 2.506 N/A GLN 27.A N SER 30.A OG no hydrogen 2.991 N/A SER 30.A N GLN 27.A O no hydrogen 3.191 N/A SER 30.A OG GLN 27.A O no hydrogen 3.539 N/A SER 30.A OG VAL 162.A O no hydrogen 2.627 N/A GLN 31.A N ALA 163.A O no hydrogen 3.064 N/A PHE 32.A N SER 73.A O no hydrogen 2.956 N/A SER 33.A N ASP 165.A O no hydrogen 3.189 N/A VAL 35.A N SER 57.A OG no hydrogen 2.887 N/A ASP 36.A N ILE 169.A O no hydrogen 2.872 N/A SER 38.A N ASP 36.A OD1 no hydrogen 3.216 N/A HIS 39.A N ASP 36.A O no hydrogen 3.371 N/A HIS 39.A ND1 ASP 36.A OD2 no hydrogen 2.941 N/A HIS 41.A ND1 HIS 39.A O no hydrogen 3.042 N/A LEU 42.A N THR 173.A OG1 no hydrogen 3.127 N/A GLY 51.A N ASP 49.A OD2 no hydrogen 2.873 N/A TYR 53.A N PHE 50.A O no hydrogen 2.905 N/A TYR 53.A OH GLU 121.A OE2 no hydrogen 2.598 N/A LEU 54.A N PHE 50.A O no hydrogen 3.160 N/A ASN 55.A ND2 GLY 129.A O no hydrogen 3.636 N/A ASN 56.A ND2 GLN 85.A OE1 no hydrogen 2.878 N/A SER 57.A N LEU 54.A O no hydrogen 3.317 N/A ARG 58.A NE ARG 69.A O no hydrogen 2.865 N/A ARG 58.A NH2 ARG 69.A O no hydrogen 3.370 N/A ASN 59.A ND2 VAL 35.A O no hydrogen 3.026 N/A THR 61.A N ASN 59.A OD1 no hydrogen 3.103 N/A THR 61.A OG1 ASN 59.A OD1 no hydrogen 2.653 N/A ARG 62.A N ASN 59.A O no hydrogen 2.975 N/A ALA 68.A N SER 65.A OG no hydrogen 3.242 N/A ARG 69.A N SER 65.A O no hydrogen 3.029 N/A ARG 69.A NH1 LEU 60.A O no hydrogen 3.089 N/A ARG 69.A NH1 VAL 63.A O no hydrogen 2.779 N/A LYS 71.A N ALA 68.A O no hydrogen 3.268 N/A SER 73.A N PHE 32.A O no hydrogen 2.910 N/A SER 73.A OG GLN 78.A O no hydrogen 3.349 N/A SER 73.A OG SER 82.A OG no hydrogen 2.542 N/A GLY 75.A N SER 30.A O no hydrogen 3.009 N/A ILE 79.A N GLY 75.A O no hydrogen 3.111 N/A TYR 80.A N GLN 76.A O no hydrogen 2.879 N/A LYS 81.A N GLU 77.A O no hydrogen 3.104 N/A LYS 81.A NZ GLU 77.A OE2 no hydrogen 3.110 N/A SER 82.A N GLN 78.A O no hydrogen 3.054 N/A SER 82.A OG SER 73.A OG no hydrogen 2.542 N/A SER 82.A OG GLN 78.A O no hydrogen 3.407 N/A PHE 83.A N ILE 79.A O no hydrogen 2.979 N/A GLN 84.A N TYR 80.A O no hydrogen 3.005 N/A GLN 84.A NE2 GLU 126.A OE1 no hydrogen 3.212 N/A GLN 85.A N SER 82.A O no hydrogen 3.126 N/A GLN 85.A NE2 LYS 81.A O no hydrogen 3.049 N/A LEU 86.A N PHE 83.A O no hydrogen 3.375 N/A LYS 88.A N ALA 123.A O no hydrogen 3.027 N/A THR 89.A OG1 ASP 17.A OD1 no hydrogen 2.776 N/A ARG 90.A N ASP 120.A O no hydrogen 3.026 N/A HIS 91.A N ASP 17.A OD2 no hydrogen 2.780 N/A HIS 91.A ND1 ASP 17.A OD1 no hydrogen 2.873 N/A THR 96.A N ASP 92.A O no hydrogen 2.924 N/A THR 96.A OG1 ASP 92.A OD2 no hydrogen 2.603 N/A GLU 98.A N GLU 98.A OE1 no hydrogen 3.012 N/A LEU 99.A N THR 96.A O no hydrogen 3.246 N/A PHE 100.A N PRO 97.A O no hydrogen 3.261 N/A SER 101.A N HIS 116.A O no hydrogen 3.008 N/A GLU 102.A N THR 114.A O no hydrogen 3.033 N/A PHE 106.A N GLY 111.A O no hydrogen 2.999 N/A GLY 111.A N THR 108.A O no hydrogen 3.382 N/A ILE 112.A N VAL 156.A O no hydrogen 2.986 N/A THR 114.A N GLU 102.A O no hydrogen 3.023 N/A THR 114.A OG1 THR 153.A OG1 no hydrogen 2.882 N/A LEU 115.A N ARG 152.A O no hydrogen 2.853 N/A HIS 116.A N SER 101.A O no hydrogen 2.822 N/A HIS 116.A ND1 ASP 151.A OD1 no hydrogen 2.464 N/A HIS 116.A NE2 GLU 102.A OE2 no hydrogen 2.934 N/A GLY 117.A N PHE 150.A O no hydrogen 2.981 N/A PHE 119.A N LYS 148.A O no hydrogen 3.018 N/A ASP 120.A N ARG 90.A O no hydrogen 3.143 N/A VAL 122.A N LYS 88.A O no hydrogen 2.902 N/A GLN 124.A NE2 TYR 134.A O no hydrogen 3.044 N/A VAL 127.A N GLN 84.A O no hydrogen 3.042 N/A ASP 128.A N SER 136.A OG no hydrogen 3.342 N/A SER 130.A N ASP 128.A OD1 no hydrogen 3.066 N/A SER 130.A OG ASP 128.A OD1 no hydrogen 2.549 N/A SER 132.A OG HIS 135.A ND1 no hydrogen 3.202 N/A TYR 134.A N SER 132.A OG no hydrogen 3.182 N/A HIS 135.A NE2 PRO 138.A O no hydrogen 3.074 N/A HIS 140.A ND1 LYS 141.A O no hydrogen 2.738 N/A HIS 140.A NE2 ASP 128.A OD2 no hydrogen 2.653 N/A SER 146.A N GLU 121.A OE1 no hydrogen 3.001 N/A SER 146.A OG LYS 147.A O no hydrogen 3.183 N/A LYS 148.A N PHE 119.A O no hydrogen 3.193 N/A LYS 148.A NZ GLU 121.A OE1 no hydrogen 3.324 N/A LYS 148.A NZ GLU 121.A OE2 no hydrogen 2.779 N/A LYS 148.A NZ SER 146.A O no hydrogen 3.437 N/A LYS 148.A NZ SER 146.A OG no hydrogen 3.013 N/A SER 149.A N ARG 170.A O no hydrogen 2.979 N/A PHE 150.A N GLY 117.A O no hydrogen 2.920 N/A ASP 151.A N LEU 168.A O no hydrogen 3.103 N/A ARG 152.A N LEU 115.A O no hydrogen 2.831 N/A ARG 152.A NE ASP 165.A OD1 no hydrogen 2.953 N/A ARG 152.A NH1 ASP 165.A OD1 no hydrogen 3.455 N/A ARG 152.A NH1 ASP 165.A OD2 no hydrogen 2.938 N/A THR 153.A N THR 166.A O no hydrogen 2.967 N/A THR 153.A OG1 THR 114.A OG1 no hydrogen 2.882 N/A PHE 154.A N ILE 113.A O no hydrogen 2.811 N/A VAL 155.A N SER 164.A O no hydrogen 2.953 N/A VAL 156.A N ILE 112.A O no hydrogen 2.968 N/A ILE 157.A N ILE 161.A O no hydrogen 2.882 N/A VAL 162.A N LEU 25.A O no hydrogen 2.847 N/A ALA 163.A N VAL 155.A O no hydrogen 2.872 N/A THR 166.A N THR 153.A O no hydrogen 3.004 N/A LEU 167.A N SER 33.A O no hydrogen 3.085 N/A LEU 168.A N ASP 151.A O no hydrogen 2.812 N/A ILE 169.A N GLN 34.A O no hydrogen 2.855 N/A ARG 170.A N SER 149.A O no hydrogen 3.038 N/A ARG 170.A NE ASP 151.A OD2 no hydrogen 2.753 N/A ARG 170.A NH1 ASP 151.A OD1 no hydrogen 3.254 N/A ARG 170.A NH1 ASP 151.A OD2 no hydrogen 3.558 N/A THR 173.A N SER 149.A OG no hydrogen 3.115 N/A THR 173.A OG1 ASP 175.A O no hydrogen 2.669 N/A TRP 178.A NE1 LEU 99.A O no hydrogen 3.007 N/A LYS 179.A N PHE 176.A O no hydrogen 3.138 N/A LYS 179.A NZ SER 174.A O no hydrogen 2.653 N/A