Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3nnt_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): TYR 1.A N ASN 141.A OD1.B no hydrogen 2.679 N/A TYR 1.A OH ASP 173.A OD1 no hydrogen 3.230 N/A PHE 2.A N THR 11.A O no hydrogen 2.955 N/A SER 4.A N THR 9.A O no hydrogen 2.945 N/A ALA 6.A N SER 4.A OG no hydrogen 3.120 N/A THR 9.A N SER 4.A O no hydrogen 2.972 N/A VAL 10.A N VAL 17.A O no hydrogen 2.943 N/A THR 11.A N PHE 2.A O no hydrogen 2.843 N/A VAL 12.A N.A LEU 15.A O no hydrogen 2.992 N/A VAL 12.A N.B LEU 15.A O no hydrogen 2.945 N/A ARG 13.A NE ASP 117.A OD1 no hydrogen 3.104 N/A ARG 13.A NH1 ASP 117.A OD2 no hydrogen 2.923 N/A ARG 13.A NH2 THR 79.A O no hydrogen 2.974 N/A LEU 15.A N VAL 12.A O.A no hydrogen 3.041 N/A LEU 15.A N VAL 12.A O.B no hydrogen 2.813 N/A VAL 17.A N VAL 10.A O no hydrogen 2.803 N/A LYS 23.A N ALA 228.A O no hydrogen 3.033 N/A LYS 23.A NZ VAL 16.A O no hydrogen 3.087 N/A LYS 23.A NZ ALA 21.A O no hydrogen 2.889 N/A ILE 24.A N ASP 49.A OD2 no hydrogen 2.814 N/A ILE 25.A N THR 230.A O no hydrogen 2.853 N/A VAL 26.A N ILE 50.A O no hydrogen 3.120 N/A SER 27.A OG GLU 52.A OE1 no hydrogen 2.492 N/A SER 27.A OG SER 238.A OG no hydrogen 2.854 N/A LEU 28.A N.A GLU 52.A O no hydrogen 2.693 N/A LEU 28.A N.B GLU 52.A O no hydrogen 2.679 N/A THR 32.A N ASP 35.A OD2 no hydrogen 3.159 N/A ASP 35.A N THR 32.A OG1 no hydrogen 3.166 N/A VAL 36.A N.A THR 32.A O no hydrogen 3.008 N/A VAL 36.A N.B THR 32.A O no hydrogen 2.953 N/A LYS 37.A N ILE 33.A O.A no hydrogen 3.081 N/A LYS 37.A N ILE 33.A O.B no hydrogen 3.061 N/A SER 38.A N THR 34.A O no hydrogen 2.933 N/A SER 38.A OG THR 34.A O no hydrogen 2.750 N/A GLU 39.A N ASP 35.A O no hydrogen 2.905 N/A ALA 40.A N VAL 36.A O.A no hydrogen 2.810 N/A ALA 40.A N VAL 36.A O.B no hydrogen 3.035 N/A LEU 41.A N LYS 37.A O no hydrogen 3.053 N/A ALA 42.A N SER 38.A O no hydrogen 3.120 N/A TYR 43.A N GLU 39.A O no hydrogen 2.975 N/A TYR 43.A N ALA 40.A O no hydrogen 3.247 N/A TYR 43.A OH SER 27.A O no hydrogen 2.500 N/A ARG 44.A N ALA 40.A O no hydrogen 3.106 N/A ARG 44.A N LEU 41.A O no hydrogen 3.367 N/A ALA 46.A N TYR 43.A O no hydrogen 2.884 N/A ASP 49.A N ILE 24.A O no hydrogen 2.778 N/A ILE 50.A N ILE 24.A O no hydrogen 2.963 N/A LEU 51.A N PRO 82.A O no hydrogen 2.896 N/A GLU 52.A N VAL 26.A O no hydrogen 2.814 N/A TRP 53.A N LEU 84.A O no hydrogen 2.766 N/A ARG 54.A N LEU 28.A O.A no hydrogen 2.920 N/A ARG 54.A N LEU 28.A O.B no hydrogen 2.917 N/A ARG 54.A NE ASP 56.A OD1 no hydrogen 2.816 N/A ARG 54.A NH2 ASP 56.A OD1 no hydrogen 3.480 N/A ARG 54.A NH2 ASP 56.A OD2 no hydrogen 2.832 N/A VAL 55.A N THR 86.A O no hydrogen 2.839 N/A HIS 57.A N ARG 54.A O no hydrogen 3.086 N/A PHE 58.A N VAL 55.A O no hydrogen 2.937 N/A ALA 59.A N LYS 31.A O no hydrogen 2.868 N/A THR 63.A N ASN 60.A O no hydrogen 3.112 N/A VAL 67.A N THR 63.A O no hydrogen 3.152 N/A LEU 68.A N ALA 64.A O no hydrogen 3.026 N/A GLU 69.A N GLU 65.A O no hydrogen 2.989 N/A ALA 70.A N SER 66.A O no hydrogen 3.004 N/A ALA 71.A N VAL 67.A O no hydrogen 2.973 N/A GLY 72.A N LEU 68.A O no hydrogen 2.958 N/A ALA 73.A N GLU 69.A O no hydrogen 2.845 N/A ILE 74.A N ALA 70.A O no hydrogen 2.947 N/A ARG 75.A N ALA 71.A O no hydrogen 3.059 N/A ARG 75.A NH2 LEU 115.A O no hydrogen 2.912 N/A GLU 76.A N GLY 72.A O no hydrogen 2.955 N/A ILE 77.A N ILE 74.A O no hydrogen 3.019 N/A ILE 78.A N ILE 74.A O no hydrogen 2.919 N/A LYS 81.A NZ.A PHE 48.A O no hydrogen 2.855 N/A LYS 81.A NZ.B PHE 48.A O no hydrogen 2.827 N/A LEU 83.A N ASP 117.A OD2 no hydrogen 2.862 N/A LEU 84.A N LEU 51.A O no hydrogen 2.820 N/A PHE 85.A N MET 118.A O.A no hydrogen 2.902 N/A PHE 85.A N MET 118.A O.B no hydrogen 2.848 N/A THR 86.A N TRP 53.A O no hydrogen 2.982 N/A THR 86.A OG1 GLU 52.A OE2 no hydrogen 2.999 N/A ARG 88.A N ASP 56.A OD1 no hydrogen 3.042 N/A ARG 88.A NH1 ASP 120.A OD1 no hydrogen 3.109 N/A ARG 88.A NH1 GLU 122.A OE2 no hydrogen 2.963 N/A ARG 88.A NH2 ASP 120.A OD2 no hydrogen 2.996 N/A SER 89.A N GLU 122.A OE2 no hydrogen 2.829 N/A SER 89.A OG GLU 122.A OE1 no hydrogen 2.548 N/A SER 89.A OG GLU 122.A OE2 no hydrogen 3.395 N/A LYS 91.A NZ PHE 124.A O no hydrogen 2.782 N/A GLU 92.A N SER 89.A O no hydrogen 2.980 N/A GLU 92.A N SER 89.A OG no hydrogen 3.254 N/A GLY 93.A N ALA 90.A O no hydrogen 3.036 N/A GLY 94.A N SER 89.A O no hydrogen 2.687 N/A GLU 95.A N ASP 56.A OD2 no hydrogen 2.936 N/A GLN 96.A NE2 ASP 56.A O no hydrogen 2.928 N/A GLN 96.A NE2 PHE 58.A O no hydrogen 2.754 N/A THR 99.A N GLN 102.A OE1 no hydrogen 2.808 N/A GLN 102.A N THR 99.A OG1 no hydrogen 2.970 N/A TYR 103.A N THR 99.A O no hydrogen 2.862 N/A ILE 104.A N THR 100.A O no hydrogen 2.889 N/A ASP 105.A N GLY 101.A O no hydrogen 3.002 N/A LEU 106.A N GLN 102.A O no hydrogen 2.840 N/A ASN 107.A N TYR 103.A O no hydrogen 3.071 N/A ASN 107.A ND2 TYR 103.A O no hydrogen 2.995 N/A ARG 108.A N ILE 104.A O no hydrogen 2.976 N/A ALA 109.A N ASP 105.A O no hydrogen 2.911 N/A ALA 110.A N LEU 106.A O no hydrogen 3.045 N/A VAL 111.A N ASN 107.A O no hydrogen 2.961 N/A ASP 112.A N ARG 108.A O no hydrogen 2.920 N/A SER 113.A N ALA 109.A O no hydrogen 2.969 N/A SER 113.A N ALA 110.A O no hydrogen 3.229 N/A SER 113.A OG ALA 110.A O no hydrogen 2.699 N/A LEU 115.A N SER 113.A OG no hydrogen 2.989 N/A ASP 117.A N LEU 83.A O no hydrogen 2.905 N/A MET 118.A N.A LEU 83.A O no hydrogen 3.186 N/A MET 118.A N.B LEU 83.A O no hydrogen 3.171 N/A ILE 119.A N ALA 143.A O no hydrogen 2.909 N/A ASP 120.A N PHE 85.A O no hydrogen 2.945 N/A LEU 121.A N ILE 145.A O no hydrogen 2.919 N/A GLU 122.A N TYR 103.A OH no hydrogen 2.892 N/A LEU 123.A N SER 147.A O no hydrogen 2.854 N/A THR 125.A N GLU 122.A O no hydrogen 3.069 N/A THR 125.A OG1 GLU 122.A O no hydrogen 2.668 N/A VAL 130.A N GLY 126.A O no hydrogen 2.942 N/A LYS 131.A N ASP 127.A O no hydrogen 2.922 N/A ALA 132.A N ASP 128.A O no hydrogen 3.111 N/A THR 133.A N GLU 129.A O no hydrogen 2.967 N/A THR 133.A OG1 GLU 129.A O no hydrogen 2.672 N/A VAL 134.A N VAL 130.A O no hydrogen 2.824 N/A GLY 135.A N LYS 131.A O no hydrogen 3.078 N/A TYR 136.A N ALA 132.A O no hydrogen 3.087 N/A TYR 136.A OH ASP 112.A OD1 no hydrogen 2.442 N/A TYR 136.A OH ASP 112.A OD2 no hydrogen 3.032 N/A ALA 137.A N THR 133.A O no hydrogen 2.858 N/A HIS 138.A N VAL 134.A O no hydrogen 2.916 N/A HIS 138.A NE2 ASP 173.A OD2 no hydrogen 2.716 N/A GLN 139.A N GLY 135.A O no hydrogen 2.951 N/A HIS 140.A N TYR 136.A O no hydrogen 3.247 N/A HIS 140.A N ALA 137.A O no hydrogen 2.991 N/A HIS 140.A ND1 TYR 136.A O no hydrogen 2.848 N/A ASN 141.A N.A HIS 138.A O no hydrogen 3.067 N/A ASN 141.A N.B HIS 138.A O no hydrogen 3.065 N/A VAL 142.A N ALA 137.A O no hydrogen 2.905 N/A ALA 143.A N ASP 117.A O no hydrogen 3.181 N/A VAL 144.A N ASP 173.A OD2 no hydrogen 2.744 N/A ILE 145.A N ILE 119.A O no hydrogen 2.874 N/A MET 146.A N ILE 174.A O no hydrogen 3.024 N/A SER 147.A N LEU 121.A O no hydrogen 2.899 N/A SER 147.A OG ASP 120.A OD1 no hydrogen 2.666 N/A SER 147.A OG ASP 120.A OD2 no hydrogen 3.379 N/A ASN 148.A N MET 176.A O no hydrogen 3.013 N/A HIS 149.A N.A GLU 92.A OE1 no hydrogen 3.041 N/A HIS 149.A N.B GLU 92.A OE1 no hydrogen 3.017 N/A HIS 149.A ND1.A GLU 92.A OE1 no hydrogen 2.907 N/A ASP 150.A N ALA 178.A O no hydrogen 2.962 N/A HIS 152.A N ASP 150.A OD1 no hydrogen 3.049 N/A LYS 153.A N ASP 150.A OD1 no hydrogen 3.086 N/A LYS 153.A NZ ASP 150.A OD2 no hydrogen 2.798 N/A THR 154.A OG1 MET 180.A O.A no hydrogen 2.779 N/A THR 154.A OG1 MET 180.A O.B no hydrogen 2.780 N/A GLU 159.A N ALA 156.A O no hydrogen 2.896 N/A ILE 160.A N ALA 156.A O no hydrogen 2.957 N/A VAL 161.A N ALA 157.A O no hydrogen 2.959 N/A GLN 162.A N GLU 158.A O.A no hydrogen 2.907 N/A GLN 162.A N GLU 158.A O.B no hydrogen 3.046 N/A ARG 163.A N GLU 159.A O no hydrogen 3.044 N/A ARG 163.A NE GLU 159.A OE1 no hydrogen 2.823 N/A ARG 163.A NH1 ASN 148.A OD1 no hydrogen 2.825 N/A ARG 163.A NH2 GLU 159.A OE1 no hydrogen 3.403 N/A LEU 164.A N ILE 160.A O no hydrogen 3.020 N/A ARG 165.A N VAL 161.A O no hydrogen 2.859 N/A LYS 166.A N GLN 162.A O no hydrogen 2.942 N/A LYS 166.A NZ ASP 127.A OD1 no hydrogen 3.331 N/A LYS 166.A NZ ASP 127.A OD2 no hydrogen 2.560 N/A MET 167.A N ARG 163.A O no hydrogen 2.994 N/A GLN 168.A N LEU 164.A O no hydrogen 3.133 N/A GLU 169.A N ARG 165.A O no hydrogen 2.961 N/A LEU 170.A N LYS 166.A O no hydrogen 2.890 N/A GLY 171.A N GLN 168.A O no hydrogen 3.006 N/A ALA 172.A N MET 167.A O no hydrogen 3.031 N/A ASP 173.A N VAL 144.A O no hydrogen 2.976 N/A ILE 174.A N VAL 144.A O no hydrogen 3.162 N/A MET 176.A N MET 146.A O no hydrogen 2.752 N/A ILE 177.A N ILE 207.A O no hydrogen 2.938 N/A ALA 178.A N ASN 148.A O no hydrogen 2.996 N/A VAL 179.A N MET 209.A O.A no hydrogen 3.068 N/A VAL 179.A N MET 209.A O.B no hydrogen 3.074 N/A MET 180.A N.A LYS 153.A O no hydrogen 3.278 N/A MET 180.A N.B LYS 153.A O no hydrogen 3.300 N/A GLN 182.A N ASP 186.A OD2 no hydrogen 2.782 N/A ASP 186.A N THR 183.A O no hydrogen 3.199 N/A ASP 186.A N THR 183.A OG1 no hydrogen 3.173 N/A VAL 187.A N LYS 184.A O no hydrogen 3.008 N/A THR 189.A N ALA 185.A O no hydrogen 2.871 N/A THR 189.A OG1 ALA 185.A O no hydrogen 3.217 N/A LEU 190.A N ASP 186.A O no hydrogen 3.147 N/A LEU 191.A N VAL 187.A O no hydrogen 3.077 N/A THR 192.A N LEU 188.A O no hydrogen 2.813 N/A THR 192.A OG1 LEU 188.A O no hydrogen 3.040 N/A ALA 193.A N THR 189.A O no hydrogen 3.028 N/A THR 194.A N LEU 190.A O no hydrogen 2.972 N/A THR 194.A OG1 LEU 190.A O no hydrogen 2.845 N/A THR 194.A OG1 THR 208.A OG1 no hydrogen 2.636 N/A VAL 195.A N LEU 191.A O no hydrogen 3.085 N/A GLU 196.A N THR 192.A O no hydrogen 2.924 N/A MET 197.A N ALA 193.A O no hydrogen 2.970 N/A GLN 198.A N THR 194.A O no hydrogen 2.826 N/A GLU 199.A N VAL 195.A O no hydrogen 2.914 N/A ALA 202.A N MET 197.A O no hydrogen 3.040 N/A ASP 203.A N GLN 168.A OE1 no hydrogen 3.156 N/A ARG 204.A NE ASP 203.A OD1 no hydrogen 2.698 N/A ARG 204.A NH1 ALA 172.A O no hydrogen 2.696 N/A ARG 204.A NH2 ASP 203.A OD1 no hydrogen 2.908 N/A ARG 204.A NH2 ASP 203.A OD2 no hydrogen 3.405 N/A ILE 207.A N PRO 175.A O no hydrogen 2.906 N/A THR 208.A N SER 227.A OG no hydrogen 3.012 N/A THR 208.A OG1 THR 194.A OG1 no hydrogen 2.636 N/A MET 209.A N.A ILE 177.A O no hydrogen 3.096 N/A MET 209.A N.B ILE 177.A O no hydrogen 3.133 N/A SER 210.A N SER 218.A OG no hydrogen 2.793 N/A MET 211.A N VAL 179.A O no hydrogen 2.809 N/A SER 212.A N PRO 240.A O no hydrogen 2.885 N/A SER 212.A OG MET 211.A O no hydrogen 2.585 N/A GLY 215.A N SER 212.A O no hydrogen 3.027 N/A VAL 216.A N.A LYS 213.A O.A no hydrogen 3.247 N/A VAL 216.A N.A LYS 213.A O.B no hydrogen 3.273 N/A VAL 216.A N.B LYS 213.A O.A no hydrogen 3.236 N/A VAL 216.A N.B LYS 213.A O.B no hydrogen 3.261 N/A SER 218.A N GLY 215.A O no hydrogen 2.871 N/A SER 218.A OG SER 210.A O no hydrogen 3.087 N/A SER 218.A OG GLY 215.A O no hydrogen 2.690 N/A ARG 219.A N VAL 216.A O.A no hydrogen 2.810 N/A ARG 219.A N VAL 216.A O.B no hydrogen 2.846 N/A ARG 219.A NH2 PRO 240.A O no hydrogen 2.948 N/A LEU 220.A N ILE 217.A O no hydrogen 3.054 N/A ALA 221.A N ILE 217.A O no hydrogen 3.060 N/A PHE 225.A N ALA 221.A O no hydrogen 3.141 N/A GLY 226.A N GLY 222.A O no hydrogen 2.846 N/A SER 227.A N GLY 222.A O no hydrogen 3.049 N/A SER 227.A OG THR 208.A O no hydrogen 3.306 N/A SER 227.A OG ALA 229.A O no hydrogen 3.115 N/A ALA 228.A N ILE 206.A O no hydrogen 2.792 N/A THR 230.A N LYS 23.A O no hydrogen 2.833 N/A THR 230.A OG1 ARG 219.A O no hydrogen 2.767 N/A GLY 232.A N ILE 25.A O no hydrogen 3.027 N/A ALA 233.A N ILE 243.A O no hydrogen 2.849 N/A SER 238.A N GLN 242.A OE1 no hydrogen 2.883 N/A SER 238.A OG SER 27.A OG no hydrogen 2.854 N/A GLN 242.A NE2 SER 238.A OG no hydrogen 2.876 N/A VAL 245.A N ALA 233.A O no hydrogen 2.917 N/A ASP 247.A N SER 244.A OG no hydrogen 3.129 N/A LEU 248.A N SER 244.A O no hydrogen 2.879 N/A ARG 249.A N VAL 245.A O no hydrogen 2.982 N/A ARG 249.A NE ASP 47.A OD2 no hydrogen 2.884 N/A ARG 249.A NH1 ASP 49.A OD2 no hydrogen 2.826 N/A ARG 249.A NH2 ASP 47.A OD1 no hydrogen 2.898 N/A ARG 249.A NH2 ASP 49.A OD1 no hydrogen 3.041 N/A ARG 249.A NH2 ASP 49.A OD2 no hydrogen 3.377 N/A THR 250.A N ALA 246.A O no hydrogen 3.060 N/A THR 250.A OG1 ALA 246.A O no hydrogen 2.997 N/A VAL 251.A N ASP 247.A O no hydrogen 3.072 N/A LEU 252.A N LEU 248.A O no hydrogen 2.931 N/A THR 253.A N ARG 249.A O no hydrogen 2.899 N/A THR 253.A OG1 ARG 249.A O no hydrogen 3.069 N/A ILE 254.A N THR 250.A O no hydrogen 3.064 N/A LEU 255.A N VAL 251.A O no hydrogen 2.972 N/A HIS 256.A N LEU 252.A O no hydrogen 2.971 N/A HIS 256.A N THR 253.A O no hydrogen 3.265 N/A HIS 256.A ND1 GLU 223.A OE1 no hydrogen 2.691 N/A HIS 256.A ND1 GLU 223.A OE2 no hydrogen 3.224 N/A GLN 257.A N THR 253.A O no hydrogen 3.055 N/A