Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1ncy_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ASP 5.A N SER 2.A OG no hydrogen 3.304 N/A GLN 6.A N SER 2.A O no hydrogen 2.798 N/A GLN 7.A N MET 3.A O no hydrogen 2.862 N/A ALA 8.A N THR 4.A O no hydrogen 3.042 N/A GLU 9.A N ASP 5.A O no hydrogen 3.005 N/A ALA 10.A N GLN 6.A O no hydrogen 2.756 N/A ARG 11.A N GLN 7.A O no hydrogen 3.131 N/A ARG 11.A NE GLU 76.A OE1 no hydrogen 3.174 N/A ARG 11.A NH2 GLU 76.A OE2 no hydrogen 2.929 N/A ALA 12.A N ALA 8.A O no hydrogen 3.201 N/A PHE 13.A N GLU 9.A O no hydrogen 3.180 N/A PHE 13.A N ALA 10.A O no hydrogen 3.225 N/A LEU 14.A N ARG 11.A O no hydrogen 3.379 N/A GLU 17.A N GLU 17.A OE1 no hydrogen 2.786 N/A ILE 19.A N SER 15.A O no hydrogen 3.022 N/A ALA 20.A N GLU 16.A O no hydrogen 3.002 N/A GLU 21.A N GLU 17.A O no hydrogen 3.042 N/A PHE 22.A N MET 18.A O no hydrogen 2.873 N/A LYS 23.A N ILE 19.A O no hydrogen 2.984 N/A LYS 23.A NZ ASP 27.A OD1 no hydrogen 2.845 N/A LYS 23.A NZ ASP 27.A OD2 no hydrogen 2.944 N/A ALA 24.A N ALA 20.A O no hydrogen 2.919 N/A ALA 25.A N GLU 21.A O no hydrogen 3.391 N/A PHE 26.A N PHE 22.A O no hydrogen 3.094 N/A ASP 27.A N LYS 23.A O no hydrogen 2.787 N/A MET 28.A N ALA 25.A O no hydrogen 3.043 N/A PHE 29.A N PHE 26.A O no hydrogen 2.912 N/A ASP 30.A N ASP 27.A O no hydrogen 3.095 N/A GLY 34.A N ASP 30.A OD1 no hydrogen 2.963 N/A GLY 35.A N ASP 30.A OD2 no hydrogen 2.770 N/A ILE 37.A N ILE 73.A O no hydrogen 3.112 N/A THR 39.A N GLY 71.A O no hydrogen 3.226 N/A LYS 40.A N SER 38.A OG no hydrogen 3.169 N/A GLU 41.A N SER 38.A O no hydrogen 2.971 N/A LEU 42.A N THR 39.A O no hydrogen 3.392 N/A THR 44.A OG1 GLU 41.A OE1 no hydrogen 3.564 N/A VAL 45.A N GLU 41.A O no hydrogen 3.290 N/A MET 46.A N LEU 42.A O no hydrogen 3.090 N/A ARG 47.A N GLY 43.A O no hydrogen 3.059 N/A MET 48.A N THR 44.A O no hydrogen 3.083 N/A LEU 49.A N VAL 45.A O no hydrogen 3.103 N/A LEU 49.A N MET 46.A O no hydrogen 3.151 N/A GLY 50.A N ARG 47.A O no hydrogen 3.028 N/A GLN 51.A N MET 46.A O no hydrogen 2.976 N/A ASN 52.A N ASP 89.A OD2 no hydrogen 3.272 N/A ASN 52.A ND2 ASN 52.A O no hydrogen 2.430 N/A THR 54.A N GLU 57.A OE1 no hydrogen 2.943 N/A GLU 57.A N THR 54.A OG1 no hydrogen 3.050 N/A LEU 58.A N THR 54.A O no hydrogen 3.120 N/A ASP 59.A N LYS 55.A O no hydrogen 2.825 N/A ALA 60.A N GLU 56.A O no hydrogen 2.979 N/A ILE 61.A N GLU 57.A O no hydrogen 3.058 N/A ILE 62.A N LEU 58.A O no hydrogen 3.037 N/A GLU 63.A N ASP 59.A O no hydrogen 2.980 N/A GLU 64.A N ALA 60.A O no hydrogen 2.935 N/A VAL 65.A N ILE 61.A O no hydrogen 2.779 N/A ASP 66.A N ILE 62.A O no hydrogen 2.858 N/A GLY 69.A N ASP 66.A O no hydrogen 3.085 N/A SER 70.A N ASP 68.A OD1 no hydrogen 3.042 N/A SER 70.A OG ASP 66.A OD1 no hydrogen 3.427 N/A SER 70.A OG ASP 68.A OD1 no hydrogen 2.787 N/A GLY 71.A N ASP 66.A OD1 no hydrogen 2.948 N/A ILE 73.A N ILE 37.A O no hydrogen 2.924 N/A ASP 74.A N GLU 77.A OE1 no hydrogen 3.058 N/A PHE 75.A N GLY 35.A O no hydrogen 3.279 N/A GLU 77.A N ASP 74.A OD1 no hydrogen 2.718 N/A PHE 78.A N ASP 74.A O no hydrogen 2.948 N/A LEU 79.A N PHE 75.A O no hydrogen 2.982 N/A VAL 80.A N GLU 76.A O no hydrogen 3.297 N/A MET 81.A N GLU 77.A O no hydrogen 3.043 N/A MET 82.A N PHE 78.A O no hydrogen 2.861 N/A VAL 83.A N LEU 79.A O no hydrogen 3.062 N/A ARG 84.A N VAL 80.A O no hydrogen 3.117 N/A ARG 84.A NH1 GLU 64.A OE1 no hydrogen 2.752 N/A ARG 84.A NH1 GLU 64.A OE2 no hydrogen 3.305 N/A ARG 84.A NH2 GLU 64.A OE2 no hydrogen 2.899 N/A GLN 85.A N MET 81.A O no hydrogen 3.040 N/A GLN 85.A NE2 GLU 57.A OE1 no hydrogen 3.276 N/A GLN 85.A NE2 ASP 89.A OD1 no hydrogen 3.014 N/A MET 86.A N MET 82.A O no hydrogen 2.905 N/A LYS 87.A N VAL 83.A O no hydrogen 3.040 N/A GLU 88.A N ARG 84.A O no hydrogen 3.193 N/A ASP 89.A N GLN 85.A O no hydrogen 2.855 N/A ALA 90.A N MET 86.A O no hydrogen 2.892 N/A LYS 91.A N LYS 87.A O no hydrogen 3.127 N/A GLY 92.A N GLU 88.A O no hydrogen 3.208 N/A GLY 92.A N ASP 89.A O no hydrogen 3.084 N/A LYS 93.A N ASP 89.A O no hydrogen 2.905 N/A SER 94.A N ALA 90.A O no hydrogen 2.955 N/A SER 94.A OG LYS 91.A O no hydrogen 3.154 N/A GLU 95.A N LYS 91.A O no hydrogen 3.278 N/A GLU 96.A N GLY 92.A O no hydrogen 3.004 N/A GLU 97.A N LYS 93.A O no hydrogen 2.986 N/A LEU 98.A N SER 94.A O no hydrogen 2.972 N/A ALA 99.A N GLU 95.A O no hydrogen 3.005 N/A ASN 100.A N GLU 96.A O no hydrogen 3.089 N/A CYS 101.A N GLU 97.A O no hydrogen 3.001 N/A PHE 102.A N LEU 98.A O no hydrogen 2.892 N/A ARG 103.A N ALA 99.A O no hydrogen 3.098 N/A ILE 104.A N ASN 100.A O no hydrogen 3.211 N/A PHE 105.A N CYS 101.A O no hydrogen 2.999 N/A ASP 106.A N PHE 102.A O no hydrogen 2.866 N/A LYS 107.A N PHE 105.A O no hydrogen 2.982 N/A LYS 107.A NZ PHE 105.A O no hydrogen 3.076 N/A LYS 107.A NZ GLU 117.A O no hydrogen 3.294 N/A ASN 108.A N GLU 117.A OE2 no hydrogen 3.044 N/A ASN 108.A ND2 ASP 110.A OD2 no hydrogen 3.450 N/A ALA 109.A N ASP 106.A O no hydrogen 3.118 N/A ASP 110.A N ASP 106.A OD1 no hydrogen 3.302 N/A ASP 110.A N ASN 108.A OD1 no hydrogen 3.299 N/A GLY 111.A N ASP 106.A OD2 no hydrogen 2.663 N/A PHE 112.A N ASP 110.A OD1 no hydrogen 2.951 N/A ILE 113.A N ILE 149.A O no hydrogen 2.701 N/A ASP 114.A N GLU 117.A OE1 no hydrogen 3.126 N/A GLU 117.A N ASP 114.A OD1 no hydrogen 2.853 N/A LEU 118.A N ASP 114.A O no hydrogen 2.827 N/A GLY 119.A N ILE 115.A O no hydrogen 2.848 N/A GLU 120.A N GLU 116.A O no hydrogen 3.031 N/A ILE 121.A N GLU 117.A O no hydrogen 3.104 N/A LEU 122.A N LEU 118.A O no hydrogen 3.121 N/A ARG 123.A N GLY 119.A O no hydrogen 2.690 N/A ARG 123.A NH1 GLU 131.A OE1 no hydrogen 3.459 N/A ARG 123.A NH2 GLU 131.A OE1 no hydrogen 3.011 N/A ALA 124.A N GLU 120.A O no hydrogen 3.111 N/A THR 125.A N LEU 122.A O no hydrogen 3.154 N/A THR 125.A OG1 LEU 122.A O no hydrogen 2.622 N/A GLY 126.A N ARG 123.A O no hydrogen 3.212 N/A GLU 127.A N THR 125.A OG1 no hydrogen 3.184 N/A VAL 129.A N GLU 127.A O no hydrogen 2.907 N/A THR 130.A N ASP 133.A OD2 no hydrogen 3.258 N/A ASP 133.A N THR 130.A OG1 no hydrogen 3.323 N/A ILE 134.A N THR 130.A O no hydrogen 3.157 N/A GLU 135.A N GLU 131.A O no hydrogen 2.822 N/A ASP 136.A N GLU 132.A O no hydrogen 2.829 N/A LEU 137.A N ASP 133.A O no hydrogen 3.083 N/A MET 138.A N ILE 134.A O no hydrogen 2.972 N/A LYS 139.A N GLU 135.A O no hydrogen 2.973 N/A ASP 140.A N ASP 136.A O no hydrogen 3.070 N/A SER 141.A N LEU 137.A O no hydrogen 2.942 N/A SER 141.A OG LEU 137.A O no hydrogen 2.868 N/A ASP 142.A N MET 138.A O no hydrogen 2.865 N/A LYS 143.A N SER 141.A O no hydrogen 3.033 N/A LYS 143.A NZ ASP 140.A O no hydrogen 2.676 N/A ASN 144.A N GLU 153.A OE2 no hydrogen 3.098 N/A ASN 144.A ND2 ASP 146.A OD2 no hydrogen 3.439 N/A ASN 145.A N ASP 142.A O no hydrogen 3.296 N/A ASP 146.A N ASP 142.A OD1 no hydrogen 3.372 N/A GLY 147.A N ASP 142.A OD2 no hydrogen 2.758 N/A ARG 148.A N ASP 146.A OD1 no hydrogen 3.071 N/A ARG 148.A NH1 ASP 146.A OD2 no hydrogen 3.558 N/A ILE 149.A N ILE 113.A O no hydrogen 3.013 N/A ASP 150.A N GLU 153.A OE1 no hydrogen 3.222 N/A GLU 153.A N ASP 150.A OD1 no hydrogen 2.847 N/A PHE 154.A N ASP 150.A O no hydrogen 2.797 N/A LEU 155.A N PHE 151.A O no hydrogen 3.087 N/A LYS 156.A N ASP 152.A O no hydrogen 3.186 N/A MET 157.A N GLU 153.A O no hydrogen 2.877 N/A MET 158.A N PHE 154.A O no hydrogen 2.930 N/A GLU 159.A N LEU 155.A O no hydrogen 2.776 N/A GLY 160.A N LYS 156.A O no hydrogen 3.036 N/A VAL 161.A N GLU 159.A O no hydrogen 2.693 N/A