Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3npk_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): LYS 4.A NZ GLU 5.A OE2 no hydrogen 3.532 N/A GLU 5.A N ASN 2.A OD1 no hydrogen 2.902 N/A LEU 6.A N ASN 2.A O no hydrogen 2.948 N/A PHE 7.A N LEU 3.A O no hydrogen 2.956 N/A ILE 8.A N LYS 4.A O no hydrogen 3.051 N/A HIS 9.A N GLU 5.A O no hydrogen 2.931 N/A HIS 10.A N LEU 6.A O no hydrogen 3.038 N/A HIS 10.A NE2 ASP 61.A OD1 no hydrogen 2.826 N/A LEU 11.A N PHE 7.A O no hydrogen 2.828 N/A GLU 12.A N ILE 8.A O no hydrogen 2.939 N/A LYS 13.A N HIS 9.A O no hydrogen 3.243 N/A LYS 13.A N HIS 10.A O no hydrogen 3.257 N/A ASN 14.A N LEU 11.A O no hydrogen 3.016 N/A ASN 14.A ND2 HIS 10.A O no hydrogen 2.817 N/A VAL 18.A N ASN 26.A OD1 no hydrogen 2.902 N/A HIS 22.A N SER 20.A OG no hydrogen 2.999 N/A PHE 24.A N HIS 22.A ND1 no hydrogen 3.122 N/A PHE 25.A N HIS 22.A ND1 no hydrogen 3.036 N/A ASN 26.A ND2 VAL 18.A O no hydrogen 2.941 N/A GLU 27.A N GLU 27.A OE1 no hydrogen 2.790 N/A ALA 28.A N PHE 24.A O no hydrogen 2.838 N/A LEU 29.A N PHE 25.A O no hydrogen 2.869 N/A ALA 30.A N ASN 26.A O no hydrogen 3.073 N/A LEU 31.A N GLU 27.A O no hydrogen 2.929 N/A LYS 33.A N ALA 30.A O no hydrogen 2.932 N/A ALA 34.A N LEU 31.A O no hydrogen 3.009 N/A ALA 41.A N GLU 67.A OE2 no hydrogen 3.000 N/A GLN 42.A N HIS 38.A O no hydrogen 2.842 N/A GLN 42.A NE2 LEU 3.A O no hydrogen 3.111 N/A LEU 43.A N PHE 39.A O no hydrogen 2.893 N/A LEU 44.A N ARG 40.A O no hydrogen 3.157 N/A LEU 45.A N ALA 41.A O no hydrogen 2.921 N/A SER 46.A N GLN 42.A O no hydrogen 2.891 N/A SER 46.A OG GLN 42.A O no hydrogen 2.709 N/A VAL 47.A N LEU 43.A O no hydrogen 3.180 N/A VAL 48.A N LEU 44.A O no hydrogen 3.134 N/A GLN 49.A N LEU 45.A O no hydrogen 2.808 N/A SER 50.A N SER 46.A O no hydrogen 2.980 N/A SER 50.A OG SER 46.A O no hydrogen 3.376 N/A SER 50.A OG VAL 47.A O no hydrogen 2.830 N/A ASN 51.A N VAL 48.A O no hydrogen 3.114 N/A LYS 52.A N VAL 48.A O no hydrogen 2.803 N/A GLU 54.A N GLU 54.A OE1 no hydrogen 2.773 N/A LEU 55.A N LYS 52.A O no hydrogen 2.884 N/A LEU 56.A N PRO 53.A O no hydrogen 3.116 N/A GLN 58.A N GLN 58.A OE1 no hydrogen 2.731 N/A ALA 59.A N LEU 55.A O no hydrogen 2.951 N/A LEU 60.A N ASN 57.A O no hydrogen 3.090 N/A VAL 62.A N ALA 59.A O no hydrogen 2.919 N/A ALA 63.A N ALA 59.A O no hydrogen 3.015 N/A LEU 64.A N LEU 60.A O no hydrogen 2.857 N/A ALA 65.A N ASP 61.A O no hydrogen 3.037 N/A LEU 66.A N VAL 62.A O no hydrogen 3.155 N/A GLU 67.A N ALA 63.A O no hydrogen 3.065 N/A PHE 68.A N LEU 64.A O no hydrogen 2.833 N/A ILE 69.A N ALA 65.A O no hydrogen 3.015 N/A HIS 70.A N LEU 66.A O no hydrogen 2.917 N/A THR 71.A N GLU 67.A O no hydrogen 2.818 N/A THR 71.A OG1 GLU 67.A O no hydrogen 3.080 N/A TYR 72.A N PHE 68.A O no hydrogen 2.908 N/A SER 73.A N ILE 69.A O no hydrogen 3.042 N/A SER 73.A OG HIS 70.A O no hydrogen 2.727 N/A LEU 74.A N HIS 70.A O no hydrogen 3.109 N/A ILE 75.A N THR 71.A O no hydrogen 3.053 N/A HIS 76.A N TYR 72.A O no hydrogen 2.977 N/A HIS 76.A NE2 ILE 103.A O no hydrogen 2.824 N/A ASP 77.A N SER 73.A O no hydrogen 2.850 N/A ASP 78.A N LEU 74.A O no hydrogen 2.946 N/A LEU 79.A N HIS 76.A O no hydrogen 3.081 N/A ASP 82.A N ASP 77.A O no hydrogen 2.806 N/A ASN 83.A N LEU 79.A O no hydrogen 2.817 N/A ALA 84.A N ASP 78.A O no hydrogen 2.915 N/A ARG 87.A N ILE 90.A O no hydrogen 2.872 N/A ARG 87.A NE ASP 78.A OD2 no hydrogen 2.847 N/A ARG 87.A NH1 ASP 78.A OD1 no hydrogen 2.847 N/A ARG 87.A NH1 ASP 78.A OD2 no hydrogen 3.541 N/A ARG 88.A NH1 THR 71.A OG1 no hydrogen 3.031 N/A ILE 90.A N ARG 87.A O no hydrogen 3.142 N/A THR 92.A N ASP 85.A O no hydrogen 3.081 N/A THR 92.A OG1 ALA 84.A O no hydrogen 2.786 N/A LYS 95.A N THR 92.A O no hydrogen 2.994 N/A SER 96.A N THR 92.A O no hydrogen 2.984 N/A TYR 97.A N LEU 93.A O no hydrogen 2.852 N/A THR 101.A N ASP 98.A OD1 no hydrogen 2.781 N/A THR 101.A OG1 ASP 98.A OD1 no hydrogen 2.772 N/A ALA 102.A N ASP 98.A O no hydrogen 3.126 N/A ILE 103.A N GLU 99.A O no hydrogen 2.867 N/A LEU 104.A N THR 100.A O no hydrogen 2.917 N/A VAL 105.A N THR 101.A O no hydrogen 2.777 N/A GLY 106.A N ALA 102.A O no hydrogen 3.082 N/A ASP 107.A N ILE 103.A O no hydrogen 2.944 N/A ALA 108.A N LEU 104.A O no hydrogen 2.803 N/A LEU 109.A N VAL 105.A O no hydrogen 2.935 N/A ASN 110.A N GLY 106.A O no hydrogen 2.987 N/A THR 111.A N ASP 107.A O no hydrogen 3.138 N/A THR 111.A OG1 ASP 107.A O no hydrogen 3.357 N/A GLU 112.A N ALA 108.A O no hydrogen 2.773 N/A ALA 113.A N LEU 109.A O no hydrogen 3.043 N/A PHE 114.A N THR 111.A O no hydrogen 3.033 N/A LEU 115.A N THR 111.A O no hydrogen 3.239 N/A VAL 116.A N GLU 112.A O no hydrogen 2.855 N/A LEU 117.A N ALA 113.A O no hydrogen 2.950 N/A SER 118.A N PHE 114.A O no hydrogen 2.934 N/A SER 118.A OG PHE 114.A O no hydrogen 3.200 N/A SER 118.A OG LEU 115.A O no hydrogen 2.899 N/A HIS 119.A N LEU 115.A O no hydrogen 3.141 N/A HIS 119.A N VAL 116.A O no hydrogen 3.203 N/A HIS 119.A ND1 LEU 115.A O no hydrogen 3.167 N/A ALA 120.A N LEU 117.A O no hydrogen 3.129 N/A LYS 123.A NZ GLU 185.A OE1 no hydrogen 3.223 N/A LYS 123.A NZ GLU 185.A OE2 no hydrogen 3.093 N/A LYS 127.A N LYS 123.A O no hydrogen 2.964 N/A LYS 127.A NZ SER 118.A O no hydrogen 2.778 N/A LYS 127.A NZ ALA 120.A O no hydrogen 2.970 N/A ILE 128.A N ASP 124.A O no hydrogen 2.942 N/A LYS 129.A N GLU 125.A O no hydrogen 3.269 N/A LYS 129.A NZ GLU 125.A OE1 no hydrogen 3.411 N/A LEU 130.A N ILE 126.A O no hydrogen 2.915 N/A ILE 131.A N LYS 127.A O no hydrogen 2.883 N/A LYS 132.A N ILE 128.A O no hydrogen 2.949 N/A THR 133.A N LYS 129.A O no hydrogen 2.977 N/A THR 133.A OG1 LYS 129.A O no hydrogen 3.136 N/A THR 133.A OG1 GLU 182.A OE1 no hydrogen 2.722 N/A THR 133.A OG1 GLU 182.A OE2 no hydrogen 3.087 N/A LEU 134.A N LEU 130.A O no hydrogen 2.894 N/A ALA 135.A N ILE 131.A O no hydrogen 2.870 N/A PHE 136.A N LYS 132.A O no hydrogen 3.041 N/A ASN 137.A N THR 133.A O no hydrogen 3.076 N/A ASN 137.A ND2 THR 133.A O no hydrogen 2.887 N/A ALA 138.A N LEU 134.A O no hydrogen 2.819 N/A GLY 142.A N GLY 139.A O no hydrogen 2.966 N/A GLY 145.A N GLY 142.A O no hydrogen 3.017 N/A ALA 147.A N VAL 143.A O no hydrogen 2.907 N/A ILE 148.A N ILE 144.A O no hydrogen 2.924 N/A ASP 149.A N GLY 145.A O no hydrogen 2.880 N/A CYS 150.A N GLN 146.A O no hydrogen 2.876 N/A CYS 150.A SG GLN 146.A O no hydrogen 3.368 N/A PHE 151.A N ALA 147.A O no hydrogen 2.919 N/A PHE 152.A N ILE 148.A O no hydrogen 2.900 N/A GLU 153.A N CYS 150.A O no hydrogen 3.492 N/A LYS 155.A N PHE 152.A O no hydrogen 3.016 N/A LYS 155.A NZ PHE 151.A O no hydrogen 2.761 N/A LYS 155.A NZ ASP 154.A OD1 no hydrogen 2.870 N/A LEU 157.A N ASN 216.A OD1 no hydrogen 2.931 N/A SER 158.A N GLU 161.A OE1 no hydrogen 2.976 N/A GLU 161.A N SER 158.A OG no hydrogen 3.051 N/A LEU 162.A N SER 158.A O no hydrogen 2.879 N/A GLU 163.A N LEU 159.A O no hydrogen 2.873 N/A PHE 164.A N ASN 160.A O no hydrogen 2.932 N/A LEU 165.A N GLU 161.A O no hydrogen 2.881 N/A HIS 166.A N LEU 162.A O no hydrogen 3.097 N/A THR 167.A N GLU 163.A O no hydrogen 2.901 N/A THR 167.A OG1 GLU 163.A O no hydrogen 2.862 N/A HIS 168.A N PHE 164.A O no hydrogen 3.056 N/A HIS 168.A ND1 PHE 164.A O no hydrogen 2.844 N/A LYS 169.A N LEU 165.A O no hydrogen 2.826 N/A LYS 169.A NZ ASP 149.A OD2 no hydrogen 2.487 N/A THR 170.A N HIS 166.A O no hydrogen 3.083 N/A THR 170.A OG1 HIS 166.A O no hydrogen 3.322 N/A ALA 171.A N HIS 166.A O no hydrogen 3.176 N/A ARG 172.A N THR 167.A O no hydrogen 2.894 N/A ARG 172.A NH1 ASN 141.A O no hydrogen 2.679 N/A ILE 174.A N THR 170.A O no hydrogen 3.435 N/A ALA 175.A N ALA 171.A O no hydrogen 2.891 N/A ALA 176.A N ARG 172.A O no hydrogen 2.820 N/A ALA 177.A N LEU 173.A O no hydrogen 3.004 N/A LEU 178.A N ILE 174.A O no hydrogen 3.331 N/A LYS 179.A N ALA 175.A O no hydrogen 2.882 N/A CYS 181.A N LEU 178.A O no hydrogen 3.189 N/A CYS 181.A SG LEU 178.A O no hydrogen 3.534 N/A GLU 182.A N LYS 179.A O no hydrogen 2.849 N/A CYS 184.A N GLY 180.A O no hydrogen 3.299 N/A CYS 184.A SG GLY 180.A O no hydrogen 3.430 N/A GLU 185.A N GLU 182.A O no hydrogen 3.018 N/A LEU 186.A N CYS 181.A O no hydrogen 2.975 N/A ASN 187.A ND2 GLU 189.A OE1 no hydrogen 3.531 N/A SER 191.A N ASN 187.A O no hydrogen 3.036 N/A SER 191.A OG LEU 186.A O no hydrogen 3.292 N/A SER 191.A OG ASN 187.A O no hydrogen 2.803 N/A ASN 192.A N ASN 188.A O no hydrogen 2.842 N/A GLN 193.A N GLU 189.A O no hydrogen 3.161 N/A ILE 194.A N GLU 190.A O no hydrogen 2.983 N/A TYR 195.A N SER 191.A O no hydrogen 2.989 N/A TYR 195.A OH ASN 137.A OD1 no hydrogen 2.606 N/A LYS 196.A N ASN 192.A O no hydrogen 3.056 N/A LEU 197.A N GLN 193.A O no hydrogen 3.006 N/A GLY 198.A N ILE 194.A O no hydrogen 2.999 N/A LEU 199.A N TYR 195.A O no hydrogen 3.035 N/A LYS 200.A N LYS 196.A O no hydrogen 3.123 N/A LYS 200.A NZ GLU 237.A OE1 no hydrogen 2.788 N/A LYS 200.A NZ ASP 241.A OD2 no hydrogen 3.446 N/A LEU 201.A N LEU 197.A O no hydrogen 2.928 N/A GLY 202.A N GLY 198.A O no hydrogen 2.961 N/A LEU 203.A N LEU 199.A O no hydrogen 3.123 N/A ILE 204.A N LYS 200.A O no hydrogen 2.873 N/A PHE 205.A N LEU 201.A O no hydrogen 2.907 N/A GLN 206.A N GLY 202.A O no hydrogen 3.260 N/A ILE 207.A N LEU 203.A O no hydrogen 2.982 N/A ASN 208.A N ILE 204.A O no hydrogen 2.897 N/A ASP 209.A N PHE 205.A O no hydrogen 2.999 N/A ASP 210.A N GLN 206.A O no hydrogen 3.071 N/A ILE 211.A N ILE 207.A O no hydrogen 2.987 N/A ILE 212.A N ASN 208.A O no hydrogen 2.904 N/A ASP 213.A N ASP 209.A O no hydrogen 2.946 N/A VAL 214.A N ILE 211.A O no hydrogen 3.251 N/A THR 215.A N ILE 211.A O no hydrogen 3.212 N/A THR 215.A N ILE 212.A O no hydrogen 3.075 N/A THR 215.A OG1 ILE 211.A O no hydrogen 2.955 N/A ASN 216.A ND2 PHE 152.A O no hydrogen 3.151 N/A ASN 216.A ND2 LYS 155.A O no hydrogen 2.757 N/A PHE 218.A N ASP 210.A OD2 no hydrogen 2.739 N/A ASN 220.A N SER 217.A OG no hydrogen 3.072 N/A LEU 221.A N SER 217.A O no hydrogen 3.143 N/A LEU 222.A N PHE 218.A O no hydrogen 2.899 N/A GLY 223.A N VAL 219.A O no hydrogen 2.653 N/A GLN 226.A NE2 THR 230.A OG1 no hydrogen 3.244 N/A ALA 227.A N GLY 223.A O no hydrogen 2.826 N/A ILE 228.A N LEU 224.A O no hydrogen 2.908 N/A LYS 229.A N GLU 225.A O no hydrogen 3.022 N/A THR 230.A N GLN 226.A O no hydrogen 2.821 N/A THR 230.A OG1 GLN 226.A O no hydrogen 2.754 N/A LYS 231.A N ALA 227.A O no hydrogen 2.946 N/A LYS 231.A NZ ASN 208.A OD1 no hydrogen 3.412 N/A GLU 232.A N ILE 228.A O no hydrogen 2.846 N/A ASN 233.A N LYS 229.A O no hydrogen 2.858 N/A LEU 234.A N THR 230.A O no hydrogen 2.947 N/A LEU 235.A N LYS 231.A O no hydrogen 2.878 N/A ASN 236.A N GLU 232.A O no hydrogen 2.976 N/A GLU 237.A N ASN 233.A O no hydrogen 3.005 N/A CYS 238.A N LEU 234.A O no hydrogen 2.875 N/A CYS 238.A SG.A LEU 234.A O no hydrogen 3.567 N/A GLU 239.A N LEU 235.A O no hydrogen 2.868 N/A GLN 240.A N ASN 236.A O no hydrogen 3.187 N/A GLN 240.A NE2 ASN 236.A O no hydrogen 3.554 N/A GLN 240.A NE2 ASN 236.A OD1 no hydrogen 2.869 N/A ASP 241.A N GLU 237.A O no hydrogen 2.942 N/A LEU 242.A N CYS 238.A O no hydrogen 2.785 N/A GLU 243.A N GLU 239.A O no hydrogen 3.188 N/A LYS 244.A N ASP 241.A O no hydrogen 3.141 N/A LEU 245.A N LEU 242.A O no hydrogen 2.983 N/A ALA 250.A N ASN 246.A O no hydrogen 2.847 N/A GLN 251.A N GLU 247.A O no hydrogen 3.095 N/A GLN 251.A NE2 GLN 251.A O no hydrogen 3.407 N/A GLN 251.A NE2 ASN 254.A OD1 no hydrogen 2.919 N/A GLN 253.A N ALA 250.A O no hydrogen 2.914 N/A ASN 254.A N GLN 251.A O no hydrogen 2.949 N/A ILE 256.A N ILE 252.A O no hydrogen 2.829 N/A ILE 257.A N GLN 253.A O no hydrogen 2.864 N/A GLN 258.A N ASN 254.A O no hydrogen 3.002 N/A TYR 259.A N LEU 255.A O no hydrogen 3.024 N/A LEU 260.A N ILE 256.A O no hydrogen 2.787 N/A