Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3lib_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLU 1.A N GLU 1.A OE2 no hydrogen 2.169 N/A GLN 7.A N ALA 4.A O no hydrogen 2.966 N/A SER 8.A N ALA 4.A O no hydrogen 3.323 N/A SER 8.A N TYR 5.A O no hydrogen 2.923 N/A VAL 9.A N TYR 5.A O no hydrogen 3.186 N/A GLU 10.A N GLN 6.A O no hydrogen 3.334 N/A ALA 12.A N SER 8.A O no hydrogen 2.865 N/A SER 13.A N VAL 9.A O no hydrogen 2.827 N/A ASN 14.A N GLU 10.A O no hydrogen 3.188 N/A TYR 15.A N MET 11.A O no hydrogen 2.983 N/A ALA 16.A N ALA 12.A O no hydrogen 3.053 N/A ASN 17.A N SER 13.A O no hydrogen 2.931 N/A GLN 18.A N ASN 14.A O no hydrogen 2.885 N/A GLN 18.A NE2 ASN 14.A OD1 no hydrogen 2.963 N/A PHE 19.A N TYR 15.A O no hydrogen 2.901 N/A ASP 20.A N ASN 17.A O no hydrogen 2.953 N/A ALA 21.A N ASN 17.A O no hydrogen 3.263 N/A ALA 21.A N GLN 18.A O no hydrogen 2.939 N/A MET 23.A N PHE 19.A O no hydrogen 3.246 N/A LYS 24.A N ASP 20.A O no hydrogen 2.720 N/A LYS 24.A NZ GLU 247.A OE1 no hydrogen 2.764 N/A ALA 25.A N ALA 21.A O no hydrogen 3.020 N/A ASN 26.A N ASP 22.A O no hydrogen 3.229 N/A LEU 27.A N MET 23.A O no hydrogen 3.323 N/A ALA 28.A N LYS 24.A O no hydrogen 3.052 N/A ILE 29.A N ALA 25.A O no hydrogen 3.023 N/A ALA 30.A N ASN 26.A O no hydrogen 3.069 N/A ARG 31.A N LEU 27.A O no hydrogen 2.700 N/A ARG 31.A NE ASP 127.A OD2 no hydrogen 3.072 N/A THR 32.A N ALA 28.A O no hydrogen 2.811 N/A THR 32.A OG1 ALA 28.A O no hydrogen 3.119 N/A ILE 33.A N ILE 29.A O no hydrogen 2.796 N/A SER 34.A N ALA 30.A O no hydrogen 2.908 N/A SER 34.A OG ARG 31.A O no hydrogen 3.304 N/A SER 34.A OG SER 145.A OG no hydrogen 3.327 N/A SER 34.A OG PRO 146.A O no hydrogen 3.550 N/A THR 35.A N ARG 31.A O no hydrogen 2.891 N/A THR 35.A OG1 ARG 31.A O no hydrogen 3.300 N/A THR 36.A N THR 32.A O no hydrogen 3.142 N/A THR 36.A OG1 THR 32.A O no hydrogen 2.937 N/A MET 37.A N ILE 33.A O no hydrogen 3.033 N/A GLU 38.A N SER 34.A O no hydrogen 2.792 N/A SER 39.A N THR 35.A O no hydrogen 3.177 N/A SER 39.A N THR 36.A O no hydrogen 2.585 N/A SER 39.A OG THR 35.A O no hydrogen 3.256 N/A TYR 40.A N MET 37.A O no hydrogen 3.155 N/A TYR 40.A OH GLU 47.A OE2 no hydrogen 2.409 N/A ASP 44.A N TYR 40.A OH no hydrogen 3.383 N/A ARG 45.A NE ASP 75.A OD1 no hydrogen 2.997 N/A ARG 45.A NH1 HIS 87.A NE2 no hydrogen 3.179 N/A ARG 45.A NH1 GLY 91.A O no hydrogen 2.987 N/A ARG 45.A NH2 ASP 75.A OD1 no hydrogen 3.443 N/A ARG 45.A NH2 ASP 75.A OD2 no hydrogen 2.748 N/A ARG 45.A NH2 ASP 78.A OD1 no hydrogen 3.294 N/A ASP 46.A N ASP 44.A OD1 no hydrogen 2.330 N/A GLU 47.A N ASP 44.A OD1 no hydrogen 3.134 N/A ALA 48.A N ASP 44.A O no hydrogen 3.174 N/A LEU 49.A N ARG 45.A O no hydrogen 2.886 N/A LEU 50.A N ASP 46.A O no hydrogen 2.803 N/A ILE 51.A N GLU 47.A O no hydrogen 2.861 N/A LEU 52.A N ALA 48.A O no hydrogen 2.843 N/A GLU 53.A N LEU 49.A O no hydrogen 2.819 N/A ASN 54.A N LEU 50.A O no hydrogen 2.761 N/A LEU 55.A N ILE 51.A O no hydrogen 2.938 N/A LEU 55.A N LEU 52.A O no hydrogen 2.685 N/A LEU 56.A N LEU 52.A O no hydrogen 3.075 N/A ARG 57.A N GLU 53.A O no hydrogen 3.007 N/A ASP 58.A N ASN 54.A O no hydrogen 3.190 N/A ASN 59.A N LEU 56.A O no hydrogen 3.190 N/A ASN 59.A ND2 LEU 55.A O no hydrogen 2.525 N/A LEU 62.A N ASN 59.A O no hydrogen 2.967 N/A THR 65.A N TRP 97.A O no hydrogen 2.901 N/A TYR 66.A N GLY 158.A O no hydrogen 3.261 N/A TYR 66.A OH VAL 159.A O no hydrogen 3.244 N/A TYR 66.A OH ASP 160.A OD2 no hydrogen 2.689 N/A VAL 67.A N PRO 95.A O no hydrogen 3.464 N/A ALA 68.A N ILE 156.A O no hydrogen 2.923 N/A PHE 69.A N PHE 93.A O no hydrogen 3.003 N/A GLU 70.A N ALA 154.A O no hydrogen 3.031 N/A ASP 72.A N ASP 78.A OD2 no hydrogen 2.788 N/A ALA 73.A N GLU 70.A O no hydrogen 2.681 N/A GLY 76.A N ASP 72.A O no hydrogen 2.936 N/A LYS 77.A N ASP 75.A OD2 no hydrogen 2.769 N/A ASP 78.A N ASP 72.A OD1 no hydrogen 3.014 N/A GLU 80.A N LYS 77.A O no hydrogen 3.025 N/A TYR 81.A N ASP 78.A O no hydrogen 3.165 N/A THR 82.A N ASP 78.A O no hydrogen 3.348 N/A THR 82.A OG1 GLY 89.A O no hydrogen 2.891 N/A ASN 83.A N ASP 88.A O no hydrogen 2.961 N/A SER 84.A N TYR 81.A O no hydrogen 2.758 N/A SER 84.A OG TYR 81.A O no hydrogen 3.191 N/A SER 84.A OG HIS 87.A ND1 no hydrogen 3.396 N/A HIS 87.A N SER 84.A O no hydrogen 2.943 N/A HIS 87.A ND1 PRO 85.A O no hydrogen 2.708 N/A THR 90.A OG1 ASP 88.A OD1 no hydrogen 2.903 N/A THR 90.A OG1 ASP 88.A OD2 no hydrogen 2.997 N/A THR 90.A OG1 TYR 112.A OH no hydrogen 3.383 N/A GLY 91.A N ASP 88.A O no hydrogen 3.209 N/A ARG 92.A N THR 90.A OG1 no hydrogen 3.153 N/A ARG 92.A NH1 PHE 69.A O no hydrogen 2.249 N/A TYR 96.A N ALA 107.A O no hydrogen 2.659 N/A TYR 96.A OH ASP 160.A OD1 no hydrogen 2.865 N/A TRP 97.A N THR 65.A O no hydrogen 2.761 N/A ASN 98.A N SER 105.A O no hydrogen 2.860 N/A LYS 99.A N LEU 63.A O no hydrogen 3.036 N/A LYS 99.A NZ LEU 56.A O no hydrogen 3.458 N/A LYS 99.A NZ PRO 60.A O no hydrogen 2.896 N/A LYS 99.A NZ LEU 62.A O no hydrogen 3.126 N/A THR 103.A N ASN 101.A O no hydrogen 2.301 N/A ALA 107.A N TYR 96.A O no hydrogen 2.988 N/A LEU 109.A N VAL 94.A O no hydrogen 2.946 N/A LEU 110.A N TYR 135.A OH no hydrogen 3.110 N/A TYR 112.A OH ASP 88.A OD1 no hydrogen 2.923 N/A SER 114.A N HIS 111.A O no hydrogen 3.247 N/A SER 114.A OG HIS 111.A O no hydrogen 3.097 N/A SER 115.A N HIS 111.A O no hydrogen 2.926 N/A TYR 117.A OH LEU 110.A O no hydrogen 2.966 N/A TYR 118.A N SER 115.A O no hydrogen 3.135 N/A TYR 118.A OH GLU 70.A OE2 no hydrogen 3.105 N/A GLN 119.A N SER 115.A O no hydrogen 2.954 N/A GLN 119.A NE2 TYR 112.A O no hydrogen 3.277 N/A LEU 120.A N ASP 116.A O no hydrogen 2.987 N/A LYS 122.A N TYR 118.A O no hydrogen 2.996 N/A LYS 122.A NZ GLU 70.A OE1 no hydrogen 3.380 N/A LYS 122.A NZ GLU 70.A OE2 no hydrogen 3.180 N/A ALA 123.A N GLN 119.A O no hydrogen 2.698 N/A THR 124.A N LEU 120.A O no hydrogen 2.777 N/A THR 124.A OG1 LEU 120.A O no hydrogen 3.109 N/A GLU 125.A N PRO 121.A O no hydrogen 2.671 N/A LYS 126.A N THR 124.A OG1 no hydrogen 3.203 N/A VAL 128.A N VAL 144.A O no hydrogen 2.900 N/A THR 130.A N SER 142.A O no hydrogen 3.003 N/A THR 130.A OG1 GLU 131.A O no hydrogen 2.891 N/A THR 130.A OG1 SER 142.A O no hydrogen 3.561 N/A TYR 133.A N MET 140.A O no hydrogen 2.948 N/A TYR 133.A OH SER 142.A OG no hydrogen 2.581 N/A TYR 135.A N VAL 138.A O no hydrogen 2.905 N/A VAL 138.A N TYR 135.A O no hydrogen 3.193 N/A MET 140.A N TYR 133.A O no hydrogen 2.867 N/A VAL 141.A N VAL 161.A O no hydrogen 2.741 N/A SER 142.A N THR 130.A OG1 no hydrogen 3.101 N/A SER 142.A OG TYR 133.A OH no hydrogen 2.581 N/A SER 142.A OG ASP 160.A OD2 no hydrogen 3.077 N/A TYR 143.A N VAL 159.A O no hydrogen 2.907 N/A VAL 144.A N VAL 128.A O no hydrogen 2.875 N/A SER 145.A N GLY 157.A O no hydrogen 2.879 N/A SER 145.A OG SER 34.A OG no hydrogen 3.327 N/A SER 145.A OG ASP 127.A OD1 no hydrogen 2.570 N/A ILE 147.A N GLY 155.A O no hydrogen 2.611 N/A MET 148.A N GLU 38.A OE2 no hydrogen 2.547 N/A LYS 149.A N GLU 152.A O no hydrogen 2.622 N/A GLU 152.A N LYS 149.A O no hydrogen 3.161 N/A ALA 154.A N ILE 147.A O no hydrogen 2.829 N/A ILE 156.A N ALA 68.A O no hydrogen 2.919 N/A GLY 157.A N SER 145.A O no hydrogen 3.134 N/A GLY 158.A N TYR 66.A O no hydrogen 2.953 N/A VAL 159.A N TYR 143.A O no hydrogen 3.287 N/A ASP 160.A N GLY 64.A O no hydrogen 3.018 N/A VAL 161.A N VAL 141.A O no hydrogen 2.930 N/A LEU 163.A N PHE 139.A O no hydrogen 2.804 N/A TYR 165.A N SER 162.A O no hydrogen 3.232 N/A TYR 165.A N SER 162.A OG no hydrogen 3.150 N/A VAL 166.A N SER 162.A O no hydrogen 3.314 N/A ASP 167.A N LEU 163.A O no hydrogen 2.806 N/A GLU 168.A N GLU 164.A O no hydrogen 3.432 N/A VAL 169.A N TYR 165.A O no hydrogen 3.165 N/A VAL 170.A N VAL 166.A O no hydrogen 2.838 N/A SER 171.A N ASP 167.A O no hydrogen 2.949 N/A SER 171.A OG ASP 167.A O no hydrogen 2.702 N/A SER 171.A OG ASP 167.A OD2 no hydrogen 2.247 N/A THR 175.A N GLY 179.A O no hydrogen 2.721 N/A ASP 177.A N GLU 261.A OE1 no hydrogen 2.357 N/A THR 178.A N GLU 261.A OE1 no hydrogen 3.237 N/A THR 178.A N GLU 261.A OE2 no hydrogen 2.664 N/A THR 178.A OG1 GLU 261.A OE2 no hydrogen 2.281 N/A PHE 182.A N VAL 254.A O no hydrogen 2.889 N/A MET 183.A N SER 192.A OG no hydrogen 3.407 N/A SER 185.A N VAL 189.A O no hydrogen 2.811 N/A SER 185.A OG GLU 131.A OE1 no hydrogen 3.525 N/A SER 185.A OG GLU 131.A OE2 no hydrogen 2.379 N/A ASN 186.A N GLU 131.A OE1 no hydrogen 3.053 N/A ASN 186.A ND2 LYS 221.A O no hydrogen 3.085 N/A ASN 186.A ND2 ASP 250.A O no hydrogen 2.794 N/A SER 187.A N GLU 131.A OE1 no hydrogen 3.225 N/A GLY 188.A N SER 185.A O no hydrogen 2.920 N/A VAL 189.A N SER 185.A OG no hydrogen 3.021 N/A ILE 190.A N LYS 203.A O no hydrogen 2.872 N/A LEU 191.A N MET 183.A O no hydrogen 3.483 N/A HIS 193.A N ASP 167.A OD2 no hydrogen 2.940 N/A THR 195.A N HIS 193.A ND1 no hydrogen 2.854 N/A THR 195.A OG1 HIS 196.A ND1 no hydrogen 2.983 N/A HIS 196.A N HIS 193.A ND1 no hydrogen 3.140 N/A HIS 196.A ND1 THR 195.A OG1 no hydrogen 2.983 N/A LYS 197.A NZ ASP 167.A OD1 no hydrogen 2.923 N/A LYS 197.A NZ ASP 167.A OD2 no hydrogen 3.320 N/A LYS 197.A NZ HIS 193.A O no hydrogen 3.100 N/A TRP 199.A N HIS 196.A O no hydrogen 2.835 N/A ILE 200.A N LYS 197.A O no hydrogen 3.363 N/A GLY 201.A N ILE 190.A O no hydrogen 2.665 N/A LYS 202.A N TRP 199.A O no hydrogen 2.691 N/A LYS 203.A N TRP 199.A O no hydrogen 2.897 N/A ASP 204.A N ASP 207.A OD2 no hydrogen 3.100 N/A LEU 205.A N GLY 188.A O no hydrogen 3.013 N/A TYR 206.A N ASP 204.A OD2 no hydrogen 2.906 N/A ASP 207.A N ASP 204.A O no hydrogen 2.736 N/A GLY 209.A N TYR 206.A O no hydrogen 3.326 N/A GLY 210.A N PHE 208.A O no hydrogen 3.303 N/A GLU 212.A N GLU 212.A OE1 no hydrogen 2.304 N/A GLU 214.A N GLU 211.A O no hydrogen 2.985 N/A LYS 215.A N GLU 211.A O no hydrogen 3.370 N/A ALA 216.A N GLU 212.A O no hydrogen 3.132 N/A SER 217.A N LEU 213.A O no hydrogen 3.242 N/A SER 217.A OG LEU 213.A O no hydrogen 2.898 N/A ARG 218.A N LYS 215.A O no hydrogen 2.793 N/A ASP 219.A N LYS 215.A O no hydrogen 3.270 N/A ILE 220.A N ALA 216.A O no hydrogen 3.075 N/A LYS 221.A N SER 217.A O no hydrogen 3.048 N/A ASN 222.A N ARG 218.A O no hydrogen 3.108 N/A GLY 223.A N ILE 220.A O no hydrogen 3.045 N/A ILE 224.A N ASP 219.A O no hydrogen 2.488 N/A LEU 228.A N LEU 241.A O no hydrogen 3.170 N/A THR 230.A N VAL 239.A O no hydrogen 2.773 N/A THR 230.A OG1 GLU 212.A OE2 no hydrogen 3.126 N/A ASP 232.A N LYS 237.A O no hydrogen 3.115 N/A LYS 237.A N THR 235.A OG1 no hydrogen 3.172 N/A VAL 239.A N THR 230.A O no hydrogen 2.682 N/A ILE 240.A N VAL 257.A O no hydrogen 2.818 N/A LEU 241.A N LEU 228.A O no hydrogen 3.207 N/A PHE 242.A N LEU 255.A O no hydrogen 2.937 N/A TYR 243.A N GLY 226.A O no hydrogen 3.119 N/A TYR 243.A OH ASP 219.A OD2 no hydrogen 3.159 N/A GLU 244.A N PHE 253.A O no hydrogen 2.984 N/A VAL 246.A N PHE 251.A O no hydrogen 2.676 N/A THR 248.A N ASP 20.A OD2 no hydrogen 2.993 N/A THR 248.A OG1 ASP 20.A OD2 no hydrogen 3.430 N/A ASP 250.A N GLU 247.A O no hydrogen 3.285 N/A ALA 252.A N VAL 184.A O no hydrogen 3.172 N/A PHE 253.A N GLU 244.A O no hydrogen 2.865 N/A VAL 254.A N PHE 182.A O no hydrogen 2.937 N/A LEU 255.A N PHE 242.A O no hydrogen 2.703 N/A VAL 256.A N TYR 180.A O no hydrogen 2.948 N/A VAL 257.A N ILE 240.A O no hydrogen 2.963 N/A LYS 259.A N THR 238.A O no hydrogen 3.013 N/A LYS 259.A NZ GLU 229.A OE1 no hydrogen 2.439 N/A MET 262.A N PRO 258.A O no hydrogen 3.323 N/A MET 262.A N LYS 259.A O no hydrogen 3.288 N/A LEU 263.A N LYS 259.A O no hydrogen 3.444 N/A ALA 264.A N GLU 260.A O no hydrogen 3.209 N/A GLY 265.A N GLU 261.A O no hydrogen 2.833 N/A VAL 266.A N MET 262.A O no hydrogen 2.762 N/A ALA 267.A N LEU 263.A O no hydrogen 2.996 N/A ASP 268.A N ALA 264.A O no hydrogen 3.325 N/A ARG 270.A N GLU 271.A OE2 no hydrogen 3.115 N/A GLU 271.A N GLU 271.A OE2 no hydrogen 2.444 N/A