Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1nn5_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ARG 2.A NE LYS 197.A O no hydrogen 2.955 N/A ARG 2.A NH1 GLY 3.A O no hydrogen 2.929 N/A ARG 2.A NH1 ASP 125.A OD2 no hydrogen 2.869 N/A ARG 2.A NH2 ASP 125.A OD1 no hydrogen 2.827 N/A ARG 2.A NH2 LYS 197.A O no hydrogen 2.936 N/A GLY 3.A N LEU 84.A O no hydrogen 2.927 N/A ALA 4.A N THR 89.A OG1 no hydrogen 2.996 N/A LEU 5.A N ASP 125.A OD2 no hydrogen 2.832 N/A ILE 6.A N LEU 90.A O no hydrogen 2.792 N/A VAL 7.A N LEU 126.A O no hydrogen 2.941 N/A LEU 8.A N VAL 92.A O no hydrogen 2.830 N/A GLU 9.A N LEU 128.A O no hydrogen 2.828 N/A ASP 12.A N GLN 149.A OE1 no hydrogen 3.067 N/A ARG 13.A NH2 GLU 144.A OE1 no hydrogen 2.665 N/A ALA 14.A N VAL 11.A O no hydrogen 3.273 N/A LYS 16.A NZ GLY 10.A O no hydrogen 3.318 N/A LYS 16.A NZ VAL 11.A O no hydrogen 2.767 N/A SER 17.A OG ASP 93.A OD2 no hydrogen 2.574 N/A GLN 19.A N GLY 15.A O no hydrogen 2.827 N/A GLN 19.A NE2 ILE 176.A O no hydrogen 3.022 N/A SER 20.A N LYS 16.A O no hydrogen 2.843 N/A SER 20.A OG.A LYS 16.A O no hydrogen 2.682 N/A SER 20.A OG.B LYS 16.A O no hydrogen 3.020 N/A SER 20.A OG.B SER 17.A O no hydrogen 2.870 N/A ARG 21.A N SER 17.A O no hydrogen 3.008 N/A LYS 22.A N THR 18.A O no hydrogen 2.958 N/A LYS 22.A NZ GLU 177.A OE2 no hydrogen 2.936 N/A LEU 23.A N GLN 19.A O no hydrogen 2.868 N/A VAL 24.A N SER 20.A O no hydrogen 3.134 N/A GLU 25.A N ARG 21.A O no hydrogen 3.096 N/A ALA 26.A N LYS 22.A O no hydrogen 2.947 N/A LEU 27.A N LEU 23.A O no hydrogen 2.878 N/A CYS 28.A N VAL 24.A O no hydrogen 2.994 N/A CYS 28.A SG VAL 24.A O no hydrogen 3.419 N/A CYS 28.A SG HIS 32.A O no hydrogen 3.961 N/A CYS 28.A SG ALA 34.A O no hydrogen 3.268 N/A ALA 29.A N GLU 25.A O no hydrogen 2.988 N/A ALA 30.A N ALA 26.A O no hydrogen 3.100 N/A ALA 30.A N LEU 27.A O no hydrogen 3.034 N/A GLY 31.A N CYS 28.A O no hydrogen 3.049 N/A HIS 32.A N LEU 27.A O no hydrogen 3.001 N/A HIS 32.A NE2 GLU 188.A OE1 no hydrogen 2.936 N/A HIS 32.A NE2 GLU 188.A OE2 no hydrogen 3.096 N/A GLU 35.A N THR 89.A O no hydrogen 2.868 N/A LEU 37.A N VAL 91.A O no hydrogen 2.836 N/A ARG 38.A NH1 GLU 41.A OE1 no hydrogen 2.677 N/A PHE 39.A N ASP 93.A O no hydrogen 2.975 N/A GLU 41.A N ASN 72.A OD1 no hydrogen 2.763 N/A ARG 42.A NH1 SER 51.A OG no hydrogen 2.670 N/A ARG 42.A NH1 GLU 141.A OE2 no hydrogen 3.385 N/A ARG 42.A NH2 GLU 141.A OE1 no hydrogen 3.283 N/A ARG 42.A NH2 GLU 141.A OE2 no hydrogen 3.401 N/A SER 43.A N GLU 41.A OE2 no hydrogen 3.281 N/A SER 43.A OG GLU 41.A OE2 no hydrogen 2.656 N/A THR 44.A OG1 GLU 75.A OE1 no hydrogen 2.683 N/A GLY 47.A N THR 44.A OG1 no hydrogen 2.893 N/A LYS 48.A N THR 44.A O no hydrogen 2.763 N/A LEU 49.A N GLU 45.A O no hydrogen 3.369 N/A LEU 50.A N ILE 46.A O no hydrogen 3.069 N/A SER 51.A N GLY 47.A O no hydrogen 2.863 N/A SER 52.A N LYS 48.A O no hydrogen 2.958 N/A SER 52.A OG SER 58.A OG no hydrogen 2.954 N/A TYR 53.A N LEU 49.A O no hydrogen 3.036 N/A TYR 53.A OH TYR 143.A OH no hydrogen 3.083 N/A LEU 54.A N LEU 50.A O no hydrogen 2.988 N/A GLN 55.A N SER 51.A O no hydrogen 3.057 N/A GLN 55.A NE2 SER 51.A O no hydrogen 3.132 N/A GLN 55.A NE2 SER 51.A OG no hydrogen 2.793 N/A LYS 56.A N TYR 53.A O no hydrogen 2.946 N/A LYS 57.A N SER 52.A O no hydrogen 2.952 N/A LYS 57.A NZ GLN 55.A OE1 no hydrogen 2.476 N/A SER 58.A OG SER 52.A OG no hydrogen 2.954 N/A HIS 63.A ND1 GLU 61.A OE1 no hydrogen 2.669 N/A SER 64.A N GLU 61.A OE2 no hydrogen 2.856 N/A SER 64.A OG.B GLU 61.A OE2 no hydrogen 3.470 N/A VAL 65.A N GLU 61.A O no hydrogen 2.907 N/A HIS 66.A N ASP 62.A O no hydrogen 3.138 N/A HIS 66.A ND1 THR 103.A OG1 no hydrogen 2.693 N/A HIS 66.A NE2 CYS 114.A O no hydrogen 2.821 N/A LEU 67.A N HIS 63.A O no hydrogen 3.048 N/A LEU 68.A N SER 64.A O no hydrogen 2.958 N/A PHE 69.A N VAL 65.A O no hydrogen 2.938 N/A SER 70.A N HIS 66.A O no hydrogen 3.141 N/A SER 70.A OG ASP 118.A OD1 no hydrogen 2.709 N/A ALA 71.A N LEU 67.A O no hydrogen 2.762 N/A ASN 72.A N LEU 68.A O no hydrogen 2.873 N/A ASN 72.A ND2 GLU 41.A O no hydrogen 2.940 N/A ASN 72.A ND2 GLU 75.A OE1 no hydrogen 2.912 N/A ARG 73.A N SER 70.A O no hydrogen 2.905 N/A ARG 73.A NE ASP 118.A OD1 no hydrogen 2.942 N/A ARG 73.A NE ASP 118.A OD2 no hydrogen 3.357 N/A ARG 73.A NH2 ASP 118.A OD1 no hydrogen 3.383 N/A ARG 73.A NH2 ASP 118.A OD2 no hydrogen 2.820 N/A TRP 74.A N SER 70.A O no hydrogen 3.032 N/A TRP 74.A NE1 PRO 117.A O no hydrogen 2.830 N/A GLU 75.A N ALA 71.A O no hydrogen 2.941 N/A GLN 76.A N ARG 73.A O no hydrogen 2.912 N/A VAL 77.A N TRP 74.A O no hydrogen 2.968 N/A ILE 80.A N GLN 76.A O no hydrogen 2.897 N/A LYS 81.A N VAL 77.A O no hydrogen 2.858 N/A GLU 82.A N PRO 78.A O no hydrogen 2.932 N/A LYS 83.A N LEU 79.A O no hydrogen 2.871 N/A LYS 83.A NZ GLU 35.A OE1 no hydrogen 3.009 N/A LYS 83.A NZ GLU 35.A OE2 no hydrogen 3.295 N/A LEU 84.A N ILE 80.A O no hydrogen 3.016 N/A SER 85.A N LYS 81.A O no hydrogen 2.933 N/A SER 85.A OG LYS 81.A O no hydrogen 3.482 N/A SER 85.A OG GLU 82.A O no hydrogen 2.680 N/A GLN 86.A N GLU 82.A O no hydrogen 3.039 N/A GLN 86.A N LYS 83.A O no hydrogen 3.064 N/A GLY 87.A N LEU 84.A O no hydrogen 3.000 N/A VAL 88.A N LYS 83.A O no hydrogen 2.963 N/A THR 89.A N ARG 33.A O no hydrogen 2.864 N/A LEU 90.A N ALA 4.A O no hydrogen 2.910 N/A VAL 91.A N GLU 35.A O no hydrogen 2.908 N/A VAL 92.A N ILE 6.A O no hydrogen 2.803 N/A ASP 93.A N LEU 37.A O no hydrogen 2.937 N/A ARG 94.A N LEU 8.A O no hydrogen 2.945 N/A ARG 94.A NH1 SER 98.A OG no hydrogen 2.769 N/A ARG 94.A NH2 ASP 12.A OD1 no hydrogen 3.067 N/A TYR 95.A N GLU 9.A OE1 no hydrogen 2.853 N/A TYR 95.A OH PRO 122.A O no hydrogen 2.712 N/A SER 98.A N GLU 9.A OE1 no hydrogen 2.969 N/A SER 98.A OG GLU 9.A OE2 no hydrogen 2.577 N/A GLY 99.A N TYR 95.A O no hydrogen 3.375 N/A VAL 100.A N ALA 96.A O no hydrogen 2.916 N/A ALA 101.A N PHE 97.A O no hydrogen 2.809 N/A PHE 102.A N SER 98.A O no hydrogen 2.951 N/A THR 103.A N GLY 99.A O no hydrogen 3.343 N/A THR 103.A OG1 HIS 66.A ND1 no hydrogen 2.693 N/A GLY 104.A N VAL 100.A O no hydrogen 2.798 N/A ALA 105.A N PHE 102.A O no hydrogen 3.287 N/A LYS 106.A N THR 103.A O no hydrogen 2.911 N/A LYS 106.A NZ TYR 53.A OH no hydrogen 3.041 N/A LYS 106.A NZ ASP 62.A OD2 no hydrogen 2.940 N/A LYS 106.A NZ TYR 143.A OH no hydrogen 2.741 N/A TRP 113.A N SER 110.A OG no hydrogen 3.047 N/A CYS 114.A N SER 110.A O no hydrogen 3.092 N/A CYS 114.A SG SER 110.A O no hydrogen 3.300 N/A LYS 115.A N LEU 111.A O no hydrogen 2.906 N/A GLN 116.A N ASP 112.A O no hydrogen 3.323 N/A GLN 116.A NE2 ASP 112.A O no hydrogen 3.040 N/A ASP 118.A N LYS 115.A O no hydrogen 3.049 N/A VAL 119.A N GLN 116.A O no hydrogen 2.976 N/A GLY 120.A N LEU 202.A O no hydrogen 2.823 N/A LEU 121.A N ASP 118.A O no hydrogen 3.086 N/A LYS 123.A N GLY 200.A O no hydrogen 2.944 N/A LYS 123.A NZ THR 164.A O no hydrogen 2.619 N/A ASP 125.A N LEU 5.A O no hydrogen 2.762 N/A VAL 127.A N ASN 166.A O no hydrogen 2.906 N/A LEU 128.A N VAL 7.A O no hydrogen 2.805 N/A PHE 129.A N LYS 168.A O no hydrogen 2.917 N/A LEU 130.A N GLU 9.A O no hydrogen 2.875 N/A GLN 131.A N VAL 170.A O no hydrogen 2.821 N/A ALA 137.A N GLN 133.A O no hydrogen 3.080 N/A ALA 138.A N LEU 134.A O no hydrogen 3.201 N/A ALA 138.A N ALA 135.A O no hydrogen 3.283 N/A LYS 139.A N ASP 136.A O no hydrogen 2.603 N/A ARG 140.A N ALA 137.A O no hydrogen 3.380 N/A ARG 140.A NH1 ARG 13.A O no hydrogen 3.064 N/A ARG 140.A NH1 ALA 14.A O no hydrogen 3.241 N/A ARG 140.A NH2 ALA 172.A O no hydrogen 2.938 N/A ARG 142.A N LEU 54.A O no hydrogen 2.797 N/A ARG 142.A NE TYR 53.A O no hydrogen 2.830 N/A ARG 142.A NH2 TYR 53.A O no hydrogen 2.937 N/A ARG 142.A NH2 ASP 59.A OD1 no hydrogen 3.363 N/A TYR 143.A OH TYR 53.A OH no hydrogen 3.083 N/A GLU 144.A N GLU 141.A O no hydrogen 3.362 N/A PHE 148.A N ASN 145.A OD1 no hydrogen 2.884 N/A GLN 149.A N ASN 145.A O no hydrogen 3.036 N/A GLN 149.A NE2 TYR 143.A O no hydrogen 2.956 N/A GLU 150.A N GLY 146.A O no hydrogen 3.023 N/A ARG 151.A N ALA 147.A O no hydrogen 3.296 N/A ARG 151.A NE ALA 105.A O no hydrogen 2.711 N/A ALA 152.A N PHE 148.A O no hydrogen 2.917 N/A LEU 153.A N GLN 149.A O no hydrogen 2.793 N/A ARG 154.A N GLU 150.A O no hydrogen 3.021 N/A ARG 154.A NE GLU 150.A OE2 no hydrogen 3.214 N/A CYS 155.A N ARG 151.A O no hydrogen 3.148 N/A CYS 155.A SG ALA 101.A O no hydrogen 3.821 N/A CYS 155.A SG ARG 151.A O no hydrogen 3.526 N/A PHE 156.A N ALA 152.A O no hydrogen 2.883 N/A HIS 157.A N LEU 153.A O no hydrogen 3.024 N/A HIS 157.A ND1 LEU 153.A O no hydrogen 3.210 N/A GLN 158.A N ARG 154.A O no hydrogen 3.074 N/A LEU 159.A N CYS 155.A O no hydrogen 3.036 N/A MET 160.A N PHE 156.A O no hydrogen 3.044 N/A LYS 161.A N GLN 158.A O no hydrogen 3.170 N/A LYS 161.A NZ GLN 158.A OE1 no hydrogen 2.557 N/A ASP 162.A N LEU 159.A O no hydrogen 3.185 N/A THR 164.A N ASP 162.A OD1 no hydrogen 2.942 N/A THR 164.A OG1 ASP 162.A OD1 no hydrogen 2.576 N/A LEU 165.A N ASP 162.A O no hydrogen 3.202 N/A ASN 166.A ND2 ASP 125.A O no hydrogen 2.919 N/A LYS 168.A N VAL 127.A O no hydrogen 2.900 N/A VAL 170.A N PHE 129.A O no hydrogen 2.851 N/A ALA 172.A N GLN 131.A O no hydrogen 2.875 N/A SER 173.A N ASP 171.A OD1 no hydrogen 3.042 N/A SER 173.A OG ASP 171.A OD1 no hydrogen 2.705 N/A LYS 174.A NZ ASP 182.A OD2 no hydrogen 2.656 N/A ALA 178.A N SER 175.A OG no hydrogen 2.993 N/A VAL 179.A N SER 175.A O no hydrogen 2.911 N/A HIS 180.A N ILE 176.A O no hydrogen 2.964 N/A GLU 181.A N GLU 177.A O no hydrogen 2.974 N/A ASP 182.A N ALA 178.A O no hydrogen 3.192 N/A ILE 183.A N VAL 179.A O no hydrogen 2.958 N/A ARG 184.A N HIS 180.A O no hydrogen 2.764 N/A ARG 184.A NE GLU 181.A OE1 no hydrogen 2.998 N/A ARG 184.A NH2 GLU 181.A OE1 no hydrogen 3.495 N/A ARG 184.A NH2 GLU 181.A OE2 no hydrogen 2.739 N/A VAL 185.A N GLU 181.A O no hydrogen 2.977 N/A LEU 186.A N ASP 182.A O no hydrogen 3.173 N/A SER 187.A N ILE 183.A O no hydrogen 2.926 N/A SER 187.A OG ILE 183.A O no hydrogen 2.869 N/A GLU 188.A N ARG 184.A O no hydrogen 2.910 N/A ASP 189.A N VAL 185.A O no hydrogen 3.183 N/A ALA 190.A N LEU 186.A O no hydrogen 3.037 N/A ILE 191.A N SER 187.A O no hydrogen 2.973 N/A ALA 192.A N GLU 188.A O no hydrogen 3.167 N/A THR 193.A N ASP 189.A O no hydrogen 2.945 N/A THR 193.A OG1 ASP 189.A O no hydrogen 3.011 N/A THR 195.A OG1 ILE 191.A O no hydrogen 2.469 N/A THR 195.A OG1 ALA 192.A O no hydrogen 2.859 N/A GLU 196.A N THR 193.A O no hydrogen 3.357 N/A LEU 202.A N LEU 121.A O no hydrogen 2.722 N/A LYS 204.A NZ GLU 201.A OE1 no hydrogen 3.553 N/A