Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1q39_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ARG 4.A NH1 VAL 44.A O no hydrogen 2.840 N/A ASN 9.A N ARG 5.A O no hydrogen 3.141 N/A LEU 10.A N ALA 6.A O no hydrogen 3.360 N/A GLU 11.A N ALA 7.A O no hydrogen 2.978 N/A ALA 12.A N ASP 8.A O no hydrogen 2.649 N/A ALA 13.A N LEU 10.A O no hydrogen 3.059 N/A ILE 14.A N LEU 10.A O no hydrogen 2.955 N/A LYS 15.A N GLU 11.A O no hydrogen 2.954 N/A LYS 15.A NZ GLU 11.A OE2 no hydrogen 3.249 N/A GLY 16.A N VAL 41.A O no hydrogen 2.942 N/A LYS 17.A N ILE 14.A O no hydrogen 3.276 N/A LYS 17.A NZ ALA 13.A O no hydrogen 2.807 N/A LYS 17.A NZ ASP 92.A OD2 no hydrogen 2.896 N/A LEU 19.A N GLN 39.A O no hydrogen 2.577 N/A THR 20.A N GLN 89.A O no hydrogen 2.798 N/A THR 20.A OG1 GLN 89.A O no hydrogen 2.911 N/A ASP 21.A N GLN 89.A O no hydrogen 3.259 N/A TRP 23.A N LYS 87.A O no hydrogen 2.812 N/A PHE 24.A N GLN 33.A OE1 no hydrogen 2.739 N/A ALA 25.A N ARG 85.A O no hydrogen 2.860 N/A GLN 28.A N GLN 28.A OE1 no hydrogen 2.487 N/A LEU 29.A N PHE 26.A O no hydrogen 2.927 N/A LYS 30.A N PRO 27.A O no hydrogen 3.151 N/A LYS 30.A NZ PHE 24.A O no hydrogen 2.815 N/A TYR 32.A N LEU 29.A O no hydrogen 2.807 N/A GLN 33.A N LYS 30.A O no hydrogen 3.205 N/A LEU 36.A N GLN 33.A O no hydrogen 3.090 N/A GLY 38.A N LEU 19.A O no hydrogen 3.022 N/A GLN 39.A N LEU 36.A O no hydrogen 2.746 N/A HIS 40.A N SER 56.A OG no hydrogen 2.831 N/A THR 42.A N HIS 54.A O no hydrogen 2.947 N/A THR 42.A OG1 HIS 43.A ND1 no hydrogen 2.855 N/A THR 42.A OG1 HIS 54.A O no hydrogen 3.547 N/A HIS 43.A ND1 THR 42.A OG1 no hydrogen 2.855 N/A VAL 44.A N GLU 11.A OE2 no hydrogen 2.727 N/A GLU 45.A N LEU 52.A O no hydrogen 2.809 N/A ARG 47.A N ALA 50.A O no hydrogen 3.136 N/A ARG 47.A NH1 VAL 120.A O no hydrogen 2.783 N/A ALA 50.A N ARG 47.A O no hydrogen 3.020 N/A LEU 51.A N SER 63.A O no hydrogen 2.986 N/A LEU 52.A N GLU 45.A O no hydrogen 2.811 N/A THR 53.A N LEU 61.A O no hydrogen 2.912 N/A HIS 54.A N HIS 43.A O no hydrogen 2.940 N/A HIS 54.A ND1 THR 60.A OG1 no hydrogen 2.962 N/A HIS 54.A NE2 GLU 45.A OE1 no hydrogen 3.257 N/A PHE 55.A N LEU 59.A O no hydrogen 2.930 N/A SER 56.A N HIS 40.A O no hydrogen 2.850 N/A SER 56.A OG GLN 39.A OE1 no hydrogen 2.773 N/A SER 56.A OG HIS 40.A ND1 no hydrogen 3.358 N/A SER 56.A OG HIS 40.A O no hydrogen 3.220 N/A ASP 58.A N PHE 55.A O no hydrogen 3.113 N/A LEU 59.A N ASN 57.A OD1 no hydrogen 3.000 N/A THR 60.A N LEU 106.A O no hydrogen 3.081 N/A THR 60.A OG1 HIS 54.A ND1 no hydrogen 2.962 N/A LEU 61.A N THR 53.A O no hydrogen 2.831 N/A TYR 62.A N GLU 104.A O no hydrogen 2.721 N/A SER 63.A N LEU 51.A O no hydrogen 3.073 N/A HIS 64.A N ASP 102.A O no hydrogen 2.814 N/A GLN 66.A NE2 ASP 102.A OD2 no hydrogen 3.545 N/A GLY 69.A N ASN 65.A O no hydrogen 2.809 N/A VAL 70.A N TYR 98.A O no hydrogen 3.060 N/A ARG 72.A N LEU 96.A O no hydrogen 2.838 N/A VAL 74.A N THR 94.A O no hydrogen 2.862 N/A THR 76.A N ASP 92.A O no hydrogen 2.776 N/A THR 76.A OG1 THR 90.A O no hydrogen 2.394 N/A THR 76.A OG1 ALA 91.A O no hydrogen 2.929 N/A THR 76.A OG1 LYS 93.A O no hydrogen 3.263 N/A THR 81.A OG1 THR 80.A O no hydrogen 2.406 N/A ARG 82.A N THR 80.A O no hydrogen 2.668 N/A ARG 85.A N LEU 97.A O no hydrogen 2.816 N/A VAL 86.A N LEU 97.A O no hydrogen 3.299 N/A LYS 87.A N TRP 23.A O no hydrogen 2.935 N/A LYS 87.A NZ ASP 21.A OD2 no hydrogen 3.146 N/A LEU 88.A N ILE 95.A O no hydrogen 3.302 N/A GLN 89.A N ASP 21.A O no hydrogen 2.744 N/A THR 90.A N LYS 93.A O no hydrogen 2.618 N/A THR 90.A OG1 LYS 93.A O no hydrogen 2.503 N/A ASP 92.A N ASP 92.A OD1 no hydrogen 2.417 N/A LYS 93.A N THR 90.A OG1 no hydrogen 3.129 N/A THR 94.A N VAL 74.A O no hydrogen 3.298 N/A ILE 95.A N LEU 88.A O no hydrogen 3.027 N/A LEU 96.A N ARG 72.A O no hydrogen 2.784 N/A LEU 97.A N VAL 86.A O no hydrogen 3.006 N/A TYR 98.A N VAL 70.A O no hydrogen 3.104 N/A SER 99.A N VAL 83.A O no hydrogen 2.985 N/A GLU 104.A N TYR 62.A O no hydrogen 2.966 N/A LEU 106.A N THR 60.A O no hydrogen 2.781 N/A ARG 107.A N GLN 110.A OE1 no hydrogen 3.096 N/A ARG 107.A NE GLU 109.A OE2 no hydrogen 2.639 N/A ARG 107.A NH2 GLU 109.A OE2 no hydrogen 3.219 N/A GLU 109.A N GLU 109.A OE1 no hydrogen 2.528 N/A GLN 110.A N ARG 107.A O no hydrogen 2.739 N/A LEU 111.A N PRO 108.A O no hydrogen 3.271 N/A HIS 114.A NE2 GLU 104.A OE2 no hydrogen 2.695 N/A LEU 117.A N HIS 114.A ND1 no hydrogen 3.498 N/A GLN 118.A N HIS 114.A O no hydrogen 2.953 N/A GLN 118.A NE2 THR 112.A O no hydrogen 2.909 N/A ARG 119.A N PHE 116.A O no hydrogen 2.694 N/A GLY 121.A N GLN 155.A O no hydrogen 3.003 N/A VAL 124.A N ALA 159.A O no hydrogen 2.932 N/A LEU 125.A N ASP 123.A OD1 no hydrogen 2.758 N/A ASP 126.A N ASP 123.A O no hydrogen 2.678 N/A ASN 128.A ND2 GLU 11.A OE1 no hydrogen 3.358 N/A ASN 128.A ND2 GLU 11.A OE2 no hydrogen 2.764 N/A LEU 129.A N ASP 126.A O no hydrogen 2.843 N/A VAL 133.A N THR 130.A O no hydrogen 2.739 N/A VAL 134.A N THR 130.A O no hydrogen 3.017 N/A LYS 135.A N PRO 131.A O no hydrogen 2.897 N/A GLU 136.A N GLU 132.A O no hydrogen 3.377 N/A ARG 137.A N VAL 133.A O no hydrogen 3.143 N/A ARG 137.A NE PHE 157.A O no hydrogen 2.450 N/A ARG 137.A NH2 ALA 156.A O no hydrogen 3.207 N/A LEU 138.A N VAL 134.A O no hydrogen 2.729 N/A LEU 139.A N LYS 135.A O no hydrogen 2.776 N/A SER 140.A N ARG 137.A O no hydrogen 3.137 N/A SER 140.A OG ARG 137.A O no hydrogen 2.665 N/A PHE 143.A N SER 140.A O no hydrogen 3.032 N/A ARG 144.A N SER 140.A O no hydrogen 2.932 N/A ARG 144.A NH1 LEU 139.A O no hydrogen 3.091 N/A ARG 146.A N PHE 143.A O no hydrogen 2.715 N/A ARG 146.A NH1 ASP 154.A OD2 no hydrogen 2.682 N/A PHE 148.A N HIS 179.A O no hydrogen 3.006 N/A ALA 149.A N GLY 177.A O no hydrogen 3.004 N/A LEU 151.A N GLN 147.A O no hydrogen 3.076 N/A LEU 152.A N PHE 148.A O no hydrogen 2.931 N/A LEU 153.A N GLY 150.A O no hydrogen 2.750 N/A ASP 154.A N LEU 151.A O no hydrogen 2.952 N/A ALA 156.A N ASP 154.A OD1 no hydrogen 2.798 N/A PHE 157.A N ASP 154.A O no hydrogen 2.978 N/A LEU 158.A N ASP 154.A O no hydrogen 3.496 N/A ALA 159.A N PRO 122.A O no hydrogen 2.795 N/A ASN 163.A ND2 PRO 248.A O no hydrogen 2.985 N/A LEU 165.A N GLY 162.A O no hydrogen 3.171 N/A ARG 166.A N GLY 162.A O no hydrogen 3.107 N/A ARG 166.A NE ASN 163.A OD1 no hydrogen 2.958 N/A ARG 166.A NH1 ALA 149.A O no hydrogen 2.634 N/A ARG 166.A NH2 ASN 163.A OD1 no hydrogen 2.503 N/A ARG 166.A NH2 ARG 247.A O no hydrogen 2.892 N/A VAL 167.A N ASN 163.A O no hydrogen 3.289 N/A ILE 169.A N LEU 165.A O no hydrogen 2.982 N/A LEU 170.A N ARG 166.A O no hydrogen 3.096 N/A TRP 171.A N VAL 167.A O no hydrogen 3.080 N/A GLN 172.A N GLU 168.A O no hydrogen 3.133 N/A LEU 175.A N LEU 170.A O no hydrogen 2.887 N/A THR 176.A OG1 ASN 178.A OD1 no hydrogen 2.946 N/A LYS 180.A NZ ASN 145.A O no hydrogen 3.353 N/A LYS 180.A NZ ASN 145.A OD1 no hydrogen 2.707 N/A LYS 182.A NZ ASN 145.A OD1 no hydrogen 2.843 N/A ASP 183.A N LYS 180.A O no hydrogen 2.926 N/A GLN 188.A N ASN 185.A OD1 no hydrogen 2.483 N/A LEU 189.A N ASN 185.A O no hydrogen 2.972 N/A ASP 190.A N ALA 186.A O no hydrogen 2.989 N/A ALA 191.A N ALA 187.A O no hydrogen 2.905 N/A LEU 192.A N GLN 188.A O no hydrogen 3.308 N/A ALA 193.A N LEU 189.A O no hydrogen 3.096 N/A HIS 194.A N ASP 190.A O no hydrogen 3.130 N/A HIS 194.A N ALA 191.A O no hydrogen 3.310 N/A HIS 194.A ND1 ASP 190.A O no hydrogen 2.889 N/A ALA 195.A N ALA 191.A O no hydrogen 3.030 N/A LEU 196.A N LEU 192.A O no hydrogen 2.941 N/A LEU 197.A N HIS 194.A O no hydrogen 3.305 N/A GLU 198.A N HIS 194.A O no hydrogen 2.972 N/A ILE 199.A N ALA 195.A O no hydrogen 3.182 N/A ARG 201.A N LEU 197.A O no hydrogen 2.902 N/A ARG 201.A NE VAL 124.A O no hydrogen 2.753 N/A ARG 201.A NH2 VAL 124.A O no hydrogen 3.266 N/A ARG 201.A NH2 LEU 129.A O no hydrogen 2.938 N/A PHE 202.A N GLU 198.A O no hydrogen 2.775 N/A SER 203.A N ILE 199.A O no hydrogen 2.781 N/A TYR 204.A N PRO 200.A O no hydrogen 3.151 N/A ALA 205.A N ARG 201.A O no hydrogen 2.831 N/A THR 206.A N PHE 202.A O no hydrogen 3.345 N/A THR 206.A OG1 PHE 202.A O no hydrogen 2.893 N/A ARG 207.A N TYR 204.A O no hydrogen 2.995 N/A LYS 214.A N ASP 211.A O no hydrogen 3.242 N/A HIS 215.A N GLU 212.A O no hydrogen 2.995 N/A ARG 221.A NE ALA 218.A O no hydrogen 2.505 N/A LYS 223.A N GLU 168.A OE1 no hydrogen 2.700 N/A LYS 223.A N GLU 168.A OE2 no hydrogen 2.962 N/A VAL 224.A N GLU 168.A OE2 no hydrogen 3.024 N/A PHE 225.A N GLU 168.A OE2 no hydrogen 3.010 N/A ARG 227.A N VAL 224.A O no hydrogen 3.410 N/A ARG 227.A NH1 LYS 223.A O no hydrogen 2.615 N/A ARG 227.A NH2 PRO 231.A O no hydrogen 2.886 N/A GLY 229.A N ILE 239.A O no hydrogen 2.941 N/A GLU 230.A N ARG 227.A O no hydrogen 3.438 N/A CYS 235.A SG SER 237.A OG no hydrogen 2.921 N/A GLY 236.A N CYS 232.A O no hydrogen 2.788 N/A ILE 239.A N GLU 230.A O no hydrogen 3.111 N/A GLU 240.A N TRP 251.A O no hydrogen 3.053 N/A THR 242.A N PHE 249.A O no hydrogen 3.216 N/A LEU 244.A N THR 243.A OG1 no hydrogen 1.897 N/A SER 245.A OG THR 243.A O no hydrogen 2.146 N/A PHE 249.A N THR 242.A OG1 no hydrogen 3.077 N/A TRP 251.A N GLU 240.A O no hydrogen 3.338 N/A CYS 252.A N GLN 256.A OE1 no hydrogen 3.011 N/A GLN 256.A N CYS 252.A O no hydrogen 3.092 N/A GLN 256.A NE2 LEU 175.A O no hydrogen 2.755 N/A HIS 257.A N GLY 174.A O no hydrogen 3.465 N/A