Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1cqp_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ASN 2.A ND2 ASP 102.A OD1 no hydrogen 3.082 N/A ASP 4.A N THR 104.A O no hydrogen 2.877 N/A LEU 5.A N GLN 40.A O no hydrogen 2.882 N/A VAL 6.A N VAL 106.A O no hydrogen 3.057 N/A PHE 7.A N ALA 42.A O no hydrogen 2.923 N/A LEU 8.A N ILE 108.A O no hydrogen 2.822 N/A PHE 9.A N VAL 44.A O no hydrogen 2.931 N/A ASP 10.A N ILE 110.A O no hydrogen 2.770 N/A GLY 11.A N PHE 46.A O no hydrogen 2.820 N/A SER 12.A N ASP 10.A OD1 no hydrogen 2.802 N/A SER 12.A OG ASP 10.A OD1 no hydrogen 2.745 N/A SER 12.A OG SER 14.A OG no hydrogen 2.774 N/A SER 12.A OG ASP 112.A OD1 no hydrogen 3.129 N/A MET 13.A N LEU 77.A O no hydrogen 2.818 N/A SER 14.A OG SER 12.A OG no hydrogen 2.774 N/A SER 14.A OG ASP 112.A OD1 no hydrogen 2.712 N/A SER 14.A OG ASP 112.A OD2 no hydrogen 2.794 N/A LEU 15.A N SER 12.A O no hydrogen 3.397 N/A GLN 16.A N GLU 19.A OE1 no hydrogen 3.248 N/A GLU 19.A N GLN 16.A O no hydrogen 2.917 N/A PHE 20.A N GLN 16.A O no hydrogen 3.071 N/A GLN 21.A N PRO 17.A O no hydrogen 3.109 N/A GLN 21.A NE2 ASP 25.A OD1 no hydrogen 3.449 N/A LYS 22.A N ASP 18.A O no hydrogen 3.146 N/A LYS 22.A NZ ASP 18.A OD2 no hydrogen 3.526 N/A ILE 23.A N GLU 19.A O no hydrogen 3.256 N/A ILE 23.A N PHE 20.A O no hydrogen 3.047 N/A LEU 24.A N PHE 20.A O no hydrogen 3.010 N/A ASP 25.A N GLN 21.A O no hydrogen 2.814 N/A PHE 26.A N LYS 22.A O no hydrogen 3.162 N/A MET 27.A N ILE 23.A O no hydrogen 3.239 N/A LYS 28.A N LEU 24.A O no hydrogen 3.066 N/A ASP 29.A N ASP 25.A O no hydrogen 2.931 N/A VAL 30.A N PHE 26.A O no hydrogen 3.029 N/A MET 31.A N MET 27.A O no hydrogen 3.145 N/A LYS 32.A N LYS 28.A O no hydrogen 2.787 N/A LYS 33.A N ASP 29.A O no hydrogen 2.943 N/A LEU 34.A N VAL 30.A O no hydrogen 3.013 N/A SER 35.A OG LYS 32.A O no hydrogen 2.997 N/A THR 37.A OG1 LEU 34.A O no hydrogen 2.478 N/A TYR 39.A N THR 37.A OG1 no hydrogen 3.274 N/A GLN 40.A N VAL 3.A O no hydrogen 2.937 N/A GLN 40.A NE2 GLY 98.A O no hydrogen 3.320 N/A ALA 42.A N LEU 5.A O no hydrogen 3.220 N/A ALA 43.A N PHE 54.A O no hydrogen 2.926 N/A VAL 44.A N PHE 7.A O no hydrogen 2.885 N/A GLN 45.A N LYS 51.A O no hydrogen 2.741 N/A PHE 46.A N PHE 9.A O no hydrogen 3.054 N/A SER 47.A N SER 49.A O no hydrogen 3.072 N/A SER 47.A OG GLY 11.A O no hydrogen 3.069 N/A SER 47.A OG LEU 78.A O no hydrogen 3.063 N/A LYS 51.A N GLN 45.A O no hydrogen 2.806 N/A LYS 51.A NZ GLU 53.A OE2 no hydrogen 3.248 N/A THR 52.A OG1 TYR 87.A OH no hydrogen 3.028 N/A GLU 53.A N ALA 43.A O no hydrogen 2.618 N/A PHE 54.A N ALA 43.A O no hydrogen 3.346 N/A ASP 55.A N ASP 58.A OD1 no hydrogen 2.885 N/A SER 57.A N LEU 97.A O no hydrogen 3.120 N/A ASP 58.A N ASP 55.A O no hydrogen 2.743 N/A ASP 58.A N ASP 55.A OD1 no hydrogen 3.122 N/A TYR 59.A N ASP 55.A O no hydrogen 3.074 N/A VAL 60.A N PHE 56.A O no hydrogen 3.105 N/A LYS 61.A N SER 57.A O no hydrogen 2.919 N/A TRP 62.A N ASP 58.A O no hydrogen 2.673 N/A LYS 63.A N TYR 59.A O no hydrogen 2.613 N/A LYS 63.A NZ VAL 60.A O no hydrogen 3.085 N/A ASP 64.A N TRP 62.A O no hydrogen 2.631 N/A ASP 66.A N ASP 64.A OD1 no hydrogen 3.195 N/A LEU 68.A N ASP 64.A O no hydrogen 2.810 N/A LEU 69.A N PRO 65.A O no hydrogen 3.110 N/A LYS 70.A N ALA 67.A O no hydrogen 3.406 N/A LYS 73.A NZ VAL 72.A O no hydrogen 3.003 N/A HIS 74.A NE2 SER 12.A O no hydrogen 2.737 N/A LEU 76.A N GLY 11.A O no hydrogen 2.849 N/A LEU 77.A N SER 47.A OG no hydrogen 2.930 N/A LEU 78.A N THR 48.A OG1 no hydrogen 3.205 N/A THR 79.A N THR 116.A OG1 no hydrogen 2.840 N/A ASN 80.A N SER 47.A O no hydrogen 2.738 N/A ASN 80.A ND2 THR 48.A O no hydrogen 2.734 N/A THR 81.A N THR 79.A O no hydrogen 2.963 N/A PHE 82.A N ASP 117.A OD1 no hydrogen 3.116 N/A GLY 83.A N ASP 117.A OD2 no hydrogen 3.035 N/A ALA 84.A N ASN 80.A O no hydrogen 3.023 N/A ILE 85.A N THR 81.A O no hydrogen 2.930 N/A ASN 86.A N PHE 82.A O no hydrogen 3.175 N/A ASN 86.A ND2 PHE 82.A O no hydrogen 2.618 N/A ASN 86.A ND2 ASN 120.A O no hydrogen 3.130 N/A TYR 87.A N GLY 83.A O no hydrogen 2.896 N/A TYR 87.A OH THR 52.A OG1 no hydrogen 3.028 N/A VAL 88.A N ALA 84.A O no hydrogen 3.042 N/A ALA 89.A N ILE 85.A O no hydrogen 2.893 N/A THR 90.A N ASN 86.A O no hydrogen 2.903 N/A THR 90.A OG1 ASN 86.A O no hydrogen 3.001 N/A GLU 91.A N TYR 87.A O no hydrogen 2.683 N/A GLU 91.A N VAL 88.A O no hydrogen 3.261 N/A VAL 92.A N VAL 88.A O no hydrogen 2.849 N/A PHE 93.A N VAL 88.A O no hydrogen 3.322 N/A ARG 94.A N VAL 92.A O no hydrogen 2.665 N/A ARG 94.A NE GLU 96.A OE1 no hydrogen 2.955 N/A ARG 94.A NH2 GLU 96.A OE1 no hydrogen 3.467 N/A LEU 97.A N ARG 94.A O no hydrogen 2.869 N/A GLY 98.A N GLU 95.A O no hydrogen 3.002 N/A ALA 99.A N ARG 94.A O no hydrogen 3.373 N/A ARG 100.A N ASP 4.A OD2 no hydrogen 3.018 N/A ARG 100.A NE ASP 4.A OD1 no hydrogen 3.138 N/A ARG 100.A NH1 SER 38.A O no hydrogen 3.215 N/A ARG 100.A NH2 ASP 4.A OD1 no hydrogen 3.045 N/A ARG 100.A NH2 SER 38.A O no hydrogen 2.855 N/A ALA 103.A N ARG 100.A O no hydrogen 3.030 N/A THR 104.A N ASN 2.A O no hydrogen 2.741 N/A THR 104.A OG1 ASN 2.A O no hydrogen 3.460 N/A VAL 106.A N ASP 4.A O no hydrogen 3.043 N/A LEU 107.A N ILE 128.A O no hydrogen 2.612 N/A ILE 108.A N VAL 6.A O no hydrogen 2.887 N/A ILE 109.A N TYR 130.A O no hydrogen 2.915 N/A ILE 110.A N LEU 8.A O no hydrogen 2.874 N/A THR 111.A N ILE 132.A O no hydrogen 2.975 N/A THR 111.A OG1 ASP 10.A OD2 no hydrogen 2.670 N/A THR 111.A OG1 GLY 113.A O no hydrogen 3.426 N/A ASP 112.A N ASP 10.A OD2 no hydrogen 3.137 N/A THR 116.A N THR 79.A O no hydrogen 2.795 N/A THR 116.A OG1 ASN 80.A OD1 no hydrogen 3.213 N/A ASP 122.A N ASN 120.A OD1 no hydrogen 3.258 N/A ALA 124.A N ILE 121.A O no hydrogen 3.111 N/A LYS 125.A N ASP 122.A O no hydrogen 3.108 N/A ILE 127.A N ALA 124.A O no hydrogen 3.383 N/A ILE 128.A N LYS 105.A O no hydrogen 2.805 N/A ARG 129.A N SER 152.A OG no hydrogen 2.982 N/A ARG 129.A NE ALA 124.A O no hydrogen 3.075 N/A ARG 129.A NH1 PHE 150.A O no hydrogen 2.598 N/A TYR 130.A N LEU 107.A O no hydrogen 2.939 N/A ILE 131.A N PHE 158.A O no hydrogen 2.825 N/A ILE 132.A N ILE 109.A O no hydrogen 2.799 N/A GLY 133.A N LYS 160.A O no hydrogen 2.701 N/A ILE 134.A N THR 111.A O no hydrogen 2.985 N/A GLY 135.A N LEU 162.A O no hydrogen 2.918 N/A PHE 138.A N GLY 135.A O no hydrogen 3.088 N/A GLN 139.A N LYS 136.A O no hydrogen 3.269 N/A THR 140.A OG1 SER 143.A OG no hydrogen 3.175 N/A LYS 141.A NZ GLN 144.A OE1 no hydrogen 3.002 N/A SER 143.A N THR 140.A O no hydrogen 2.985 N/A SER 143.A N THR 140.A OG1 no hydrogen 2.998 N/A SER 143.A OG HIS 137.A O no hydrogen 3.078 N/A SER 143.A OG THR 140.A O no hydrogen 2.809 N/A SER 143.A OG THR 140.A OG1 no hydrogen 3.175 N/A GLN 144.A N THR 140.A O no hydrogen 3.133 N/A GLN 144.A NE2 PHE 138.A O no hydrogen 2.807 N/A GLU 145.A N LYS 141.A O no hydrogen 3.165 N/A THR 146.A N SER 143.A O no hydrogen 3.250 N/A THR 146.A OG1 SER 143.A O no hydrogen 2.898 N/A LYS 149.A NZ THR 146.A O no hydrogen 2.755 N/A PHE 150.A N LEU 147.A O no hydrogen 3.028 N/A ALA 151.A N HIS 148.A O no hydrogen 3.364 N/A SER 152.A N ARG 129.A O no hydrogen 3.105 N/A GLU 157.A N PRO 154.A O no hydrogen 2.825 N/A PHE 158.A N PRO 154.A O no hydrogen 3.140 N/A VAL 159.A N ALA 155.A O no hydrogen 2.624 N/A LYS 160.A N ILE 131.A O no hydrogen 2.732 N/A LYS 160.A NZ GLU 157.A O no hydrogen 3.367 N/A LEU 162.A N GLY 133.A O no hydrogen 2.839 N/A THR 164.A OG1 ASP 163.A OD2 no hydrogen 3.498 N/A THR 164.A OG1 GLU 166.A OE2 no hydrogen 3.233 N/A GLU 166.A N THR 164.A OG1 no hydrogen 3.263 N/A LYS 167.A N THR 164.A O no hydrogen 3.145 N/A LYS 167.A NZ ASP 163.A OD2 no hydrogen 3.490 N/A LEU 168.A N PHE 165.A O no hydrogen 3.373 N/A LYS 169.A N GLU 166.A O no hydrogen 3.329 N/A LEU 171.A N LYS 167.A O no hydrogen 2.947 N/A PHE 172.A N LEU 168.A O no hydrogen 3.205 N/A PHE 172.A N LYS 169.A O no hydrogen 3.197 N/A THR 173.A N LYS 169.A O no hydrogen 3.224 N/A THR 173.A OG1 LYS 169.A O no hydrogen 3.243 N/A GLU 174.A N ASP 170.A O no hydrogen 3.246 N/A LEU 175.A N LEU 171.A O no hydrogen 3.009 N/A GLN 176.A N PHE 172.A O no hydrogen 3.010 N/A LYS 178.A N LEU 175.A O no hydrogen 3.034 N/A LYS 178.A NZ GLU 174.A O no hydrogen 3.168 N/A ILE 179.A N GLN 176.A O no hydrogen 3.307 N/A