Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4kp5_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): LYS 1.A NZ.A HIS 64.A NE2 no hydrogen 2.938 N/A THR 3.A N ASP 8.A O no hydrogen 2.961 N/A THR 3.A OG1 PHE 5.A O no hydrogen 2.842 N/A PHE 5.A N THR 3.A OG1 no hydrogen 3.189 N/A GLY 9.A N GLY 6.A O no hydrogen 2.986 N/A SER 12.A N.A GLY 9.A O no hydrogen 2.865 N/A SER 12.A N.B GLY 9.A O no hydrogen 2.947 N/A SER 12.A OG.A PRO 7.A O no hydrogen 3.269 N/A SER 12.A OG.B PRO 7.A O no hydrogen 3.449 N/A SER 12.A OG.B GLY 9.A O no hydrogen 2.628 N/A TRP 13.A N GLU 10.A O no hydrogen 3.355 N/A TRP 13.A NE1 THR 3.A O no hydrogen 2.949 N/A LYS 15.A N.A SER 12.A O.A no hydrogen 3.216 N/A LYS 15.A N.A SER 12.A O.B no hydrogen 2.838 N/A LYS 15.A N.B SER 12.A O.A no hydrogen 3.240 N/A LYS 15.A N.B SER 12.A O.B no hydrogen 2.863 N/A LYS 15.A N.C SER 12.A O.A no hydrogen 3.336 N/A LYS 15.A N.C SER 12.A O.B no hydrogen 2.957 N/A LYS 16.A N.A TRP 13.A O no hydrogen 3.257 N/A TYR 17.A N TRP 13.A O no hydrogen 2.869 N/A CYS 20.A N TYR 17.A O no hydrogen 2.852 N/A GLY 21.A N PRO 18.A O no hydrogen 3.067 N/A GLY 22.A N SER 19.A O no hydrogen 2.992 N/A GLN 25.A NE2 LEU 23.A O no hydrogen 3.170 N/A GLN 25.A NE2 CYS 200.A O no hydrogen 3.079 N/A SER 26.A N SER 194.A OG no hydrogen 2.862 N/A SER 26.A OG TYR 191.A OH no hydrogen 2.824 N/A SER 26.A OG SER 194.A O no hydrogen 3.516 N/A LEU 30.A N THR 104.A O no hydrogen 2.774 N/A ILE 34.A N HIS 31.A O no hydrogen 3.064 N/A LEU 35.A N SER 32.A O no hydrogen 3.195 N/A GLN 36.A N VAL 255.A O no hydrogen 2.843 N/A ASP 38.A N THR 257.A O no hydrogen 2.967 N/A SER 40.A N ASP 38.A OD1 no hydrogen 2.767 N/A LEU 41.A N ASP 38.A O no hydrogen 3.041 N/A GLU 45.A N GLN 77.A O no hydrogen 2.940 N/A GLN 47.A N HIS 75.A O no hydrogen 2.840 N/A TYR 49.A OH HIS 118.A NE2 no hydrogen 2.640 N/A LEU 51.A N PHE 175.A O no hydrogen 3.231 N/A ASN 54.A N SER 52.A OG no hydrogen 3.170 N/A LYS 55.A N SER 52.A O no hydrogen 3.138 N/A PHE 57.A N VAL 172.A O no hydrogen 2.846 N/A LEU 59.A N ALA 170.A O no hydrogen 2.800 N/A THR 60.A N.A LYS 67.A O no hydrogen 2.831 N/A THR 60.A N.B LYS 67.A O no hydrogen 2.846 N/A ASN 61.A N GLN 168.A O no hydrogen 3.115 N/A ASN 61.A ND2 VAL 163.A O no hydrogen 3.018 N/A ASN 61.A ND2 TYR 228.A O no hydrogen 2.865 N/A ASN 62.A N SER 65.A O no hydrogen 3.395 N/A GLY 63.A N ASN 61.A OD1 no hydrogen 2.784 N/A HIS 64.A N ASN 62.A OD1 no hydrogen 2.809 N/A SER 65.A N ASN 62.A OD1 no hydrogen 2.932 N/A SER 65.A OG VAL 66.A O no hydrogen 3.279 N/A SER 65.A OG LEU 90.A O no hydrogen 2.638 N/A LYS 67.A N THR 60.A O.A no hydrogen 2.949 N/A LYS 67.A N THR 60.A O.B no hydrogen 2.947 N/A LEU 68.A N LEU 88.A O no hydrogen 2.823 N/A ASN 69.A N.A LEU 58.A O no hydrogen 2.830 N/A ASN 69.A N.B LEU 58.A O no hydrogen 2.827 N/A LEU 70.A N THR 86.A O no hydrogen 3.011 N/A MET 74.A N PRO 71.A O no hydrogen 3.013 N/A HIS 75.A N GLN 47.A O no hydrogen 2.846 N/A HIS 75.A ND1 ASP 73.A O no hydrogen 3.065 N/A HIS 75.A NE2 GLN 47.A OE1 no hydrogen 2.849 N/A ILE 76.A N TYR 83.A O no hydrogen 2.832 N/A GLN 77.A N GLU 45.A O no hydrogen 2.897 N/A GLN 77.A NE2 GLU 45.A OE1 no hydrogen 2.646 N/A ARG 82.A N ASP 122.A OD2 no hydrogen 2.741 N/A TYR 83.A OH GLU 135.A O no hydrogen 2.877 N/A SER 84.A N TYR 119.A O no hydrogen 2.792 N/A SER 84.A OG SER 72.A O no hydrogen 3.312 N/A SER 84.A OG SER 121.A OG no hydrogen 2.671 N/A ALA 85.A N MET 74.A O no hydrogen 2.747 N/A THR 86.A N VAL 117.A O no hydrogen 2.923 N/A GLN 87.A N VAL 117.A O no hydrogen 3.478 N/A LEU 88.A N LEU 68.A O no hydrogen 2.958 N/A HIS 89.A N HIS 115.A O no hydrogen 2.959 N/A HIS 89.A ND1 GLN 87.A OE1 no hydrogen 2.668 N/A LEU 90.A N SER 65.A OG no hydrogen 3.237 N/A HIS 91.A N GLU 113.A O no hydrogen 2.853 N/A HIS 91.A ND1 ASN 243.A O no hydrogen 2.739 N/A HIS 91.A NE2 HIS 89.A NE2 no hydrogen 3.174 N/A HIS 91.A NE2 HIS 115.A ND1 no hydrogen 3.026 N/A TRP 92.A N ASN 243.A OD1 no hydrogen 2.821 N/A TRP 92.A NE1 MET 240.A O no hydrogen 2.845 N/A ASN 94.A N ASP 97.A O no hydrogen 3.415 N/A ASN 94.A ND2 ASN 242.A OD1 no hydrogen 2.903 N/A ASN 96.A N ASN 94.A OD1 no hydrogen 2.800 N/A ASP 97.A N ASN 94.A O no hydrogen 2.936 N/A HIS 99.A N ASP 97.A O no hydrogen 2.753 N/A GLY 100.A N ALA 111.A O no hydrogen 2.982 N/A SER 101.A N PHE 110.A O no hydrogen 2.960 N/A SER 101.A OG HIS 103.A O no hydrogen 2.705 N/A SER 101.A OG PHE 110.A O no hydrogen 3.492 N/A GLU 102.A N GLU 113.A OE1 no hydrogen 2.817 N/A HIS 103.A N GLU 113.A OE1 no hydrogen 2.855 N/A HIS 103.A ND1 GLU 113.A OE2 no hydrogen 2.821 N/A HIS 103.A NE2 TYR 191.A OH no hydrogen 2.682 N/A THR 104.A N ILE 28.A O no hydrogen 3.368 N/A THR 104.A OG1 ASP 29.A OD1 no hydrogen 2.683 N/A VAL 105.A N GLN 108.A O no hydrogen 2.967 N/A SER 106.A N LEU 30.A O no hydrogen 2.859 N/A GLY 107.A N ASP 29.A OD1 no hydrogen 2.783 N/A GLN 108.A N VAL 105.A O no hydrogen 2.912 N/A GLN 108.A NE2 SER 106.A O no hydrogen 3.115 N/A PHE 110.A N SER 101.A OG no hydrogen 2.850 N/A ALA 112.A N ILE 144.A O no hydrogen 3.203 N/A GLU 113.A N HIS 91.A O no hydrogen 2.932 N/A LEU 114.A N VAL 142.A O no hydrogen 2.919 N/A HIS 115.A N HIS 89.A O no hydrogen 2.880 N/A HIS 115.A NE2 GLU 113.A OE2 no hydrogen 2.736 N/A ILE 116.A N LEU 140.A O no hydrogen 2.807 N/A VAL 117.A N GLN 87.A O no hydrogen 2.806 N/A HIS 118.A N ALA 138.A O no hydrogen 2.795 N/A HIS 118.A ND1 ILE 116.A O no hydrogen 3.051 N/A HIS 118.A NE2 TYR 49.A OH no hydrogen 2.640 N/A TYR 119.A N SER 84.A O no hydrogen 2.784 N/A ASN 120.A N GLY 136.A O no hydrogen 2.827 N/A ASN 120.A ND2 SER 81.A OG no hydrogen 3.156 N/A ASN 120.A ND2 GLU 135.A O no hydrogen 3.435 N/A SER 121.A N ARG 82.A O no hydrogen 3.247 N/A SER 121.A OG ARG 82.A O no hydrogen 3.519 N/A SER 121.A OG SER 84.A OG no hydrogen 2.671 N/A ASP 122.A N ASN 120.A OD1 no hydrogen 2.999 N/A LEU 123.A N ASN 120.A OD1 no hydrogen 2.974 N/A TYR 124.A N ASN 120.A O no hydrogen 2.970 N/A TYR 124.A OH SER 134.A O no hydrogen 2.944 N/A THR 129.A N ASP 126.A OD2 no hydrogen 2.915 N/A THR 129.A OG1 ASP 126.A OD2 no hydrogen 2.632 N/A ALA 130.A N ASP 126.A O no hydrogen 3.039 N/A SER 131.A N SER 128.A O no hydrogen 3.347 N/A SER 131.A OG SER 128.A O no hydrogen 2.903 N/A LYS 133.A N ALA 130.A O no hydrogen 3.007 N/A LYS 133.A NZ THR 129.A O no hydrogen 2.740 N/A LYS 133.A NZ ASN 132.A OD1 no hydrogen 2.862 N/A LEU 137.A N THR 203.A O no hydrogen 2.967 N/A ALA 138.A N HIS 118.A O no hydrogen 2.944 N/A VAL 139.A N LEU 205.A O no hydrogen 3.075 N/A LEU 140.A N ILE 116.A O no hydrogen 2.913 N/A ALA 141.A N THR 207.A O no hydrogen 2.783 N/A VAL 142.A N LEU 114.A O no hydrogen 2.889 N/A ILE 144.A N ALA 112.A O no hydrogen 2.946 N/A GLU 145.A N VAL 213.A O no hydrogen 2.915 N/A GLY 147.A N ILE 215.A O no hydrogen 2.685 N/A SER 148.A N.A GLN 214.A OE1 no hydrogen 3.016 N/A SER 148.A N.B GLN 214.A OE1 no hydrogen 3.065 N/A SER 148.A OG.B GLN 214.A OE1 no hydrogen 3.360 N/A ASN 150.A N GLN 219.A OE1 no hydrogen 2.951 N/A ASN 150.A ND2 GLN 214.A O no hydrogen 2.970 N/A SER 152.A OG GLU 179.A OE1 no hydrogen 2.798 N/A TYR 153.A N ASN 150.A OD1 no hydrogen 3.080 N/A TYR 153.A OH LEU 180.A O no hydrogen 2.737 N/A ASP 154.A N ASN 150.A O no hydrogen 3.098 N/A LYS 155.A N SER 152.A O no hydrogen 2.988 N/A LYS 155.A NZ GLU 179.A OE1 no hydrogen 2.810 N/A ILE 156.A N TYR 153.A O no hydrogen 2.910 N/A PHE 157.A N TYR 153.A O no hydrogen 2.842 N/A SER 158.A N ASP 154.A O no hydrogen 2.901 N/A SER 158.A OG ASP 154.A O no hydrogen 2.958 N/A HIS 159.A N ILE 156.A O no hydrogen 2.958 N/A LEU 160.A N PHE 157.A O no hydrogen 3.091 N/A HIS 162.A N HIS 159.A O no hydrogen 3.020 N/A VAL 163.A N LEU 160.A O no hydrogen 2.913 N/A TYR 165.A N GLN 168.A OE1 no hydrogen 2.930 N/A LYS 166.A N THR 230.A O no hydrogen 2.931 N/A GLY 167.A N ASN 61.A O no hydrogen 2.803 N/A GLN 168.A N TYR 165.A O no hydrogen 2.968 N/A ALA 170.A N LEU 59.A O no hydrogen 2.871 N/A VAL 172.A N PHE 57.A O no hydrogen 2.888 N/A GLY 174.A N LYS 55.A O no hydrogen 3.056 N/A ILE 177.A N TYR 49.A O no hydrogen 2.872 N/A GLU 178.A N ASN 176.A OD1 no hydrogen 2.978 N/A GLU 179.A N ASN 176.A O no hydrogen 2.803 N/A LEU 180.A N ILE 177.A O no hydrogen 2.883 N/A LEU 181.A N GLU 178.A O no hydrogen 3.040 N/A GLU 187.A N ARG 184.A O no hydrogen 2.815 N/A TYR 188.A N SER 258.A OG no hydrogen 2.843 N/A TYR 188.A OH THR 42.A O no hydrogen 2.586 N/A TYR 189.A N VAL 208.A O no hydrogen 2.769 N/A ARG 190.A N TYR 256.A O no hydrogen 2.756 N/A ARG 190.A NE TRP 206.A O no hydrogen 3.254 N/A ARG 190.A NE THR 207.A OG1 no hydrogen 2.972 N/A ARG 190.A NH2 THR 207.A OG1 no hydrogen 2.856 N/A TYR 191.A N TRP 206.A O no hydrogen 3.207 N/A TYR 191.A OH SER 26.A OG no hydrogen 2.824 N/A TYR 191.A OH HIS 103.A NE2 no hydrogen 2.682 N/A ARG 192.A NH1 GLU 135.A OE1 no hydrogen 2.884 N/A ARG 192.A NH2 GLU 135.A OE1 no hydrogen 3.339 N/A GLY 193.A N VAL 204.A O no hydrogen 2.829 N/A SER 194.A N SER 26.A OG no hydrogen 2.980 N/A SER 194.A OG LEU 195.A O no hydrogen 2.727 N/A LEU 195.A N ASN 201.A O no hydrogen 3.050 N/A THR 196.A OG1 GLU 102.A OE1 no hydrogen 2.577 N/A THR 196.A OG1 GLU 102.A OE2 no hydrogen 3.526 N/A THR 197.A OG1 PRO 198.A O no hydrogen 3.321 N/A CYS 200.A N THR 197.A O no hydrogen 2.818 N/A THR 203.A OG1 SER 131.A O no hydrogen 2.730 N/A VAL 204.A N GLY 193.A O no hydrogen 3.082 N/A LEU 205.A N LEU 137.A O no hydrogen 2.925 N/A TRP 206.A N TYR 191.A O no hydrogen 2.905 N/A TRP 206.A NE1 SER 194.A O no hydrogen 2.996 N/A THR 207.A N VAL 139.A O no hydrogen 3.047 N/A VAL 208.A N TYR 189.A O no hydrogen 2.871 N/A PHE 209.A N ALA 141.A O no hydrogen 2.970 N/A ARG 210.A N GLU 187.A O no hydrogen 2.950 N/A ARG 210.A NH1 GLN 261.A O no hydrogen 3.501 N/A ARG 210.A NH1 GLN 261.A OXT no hydrogen 2.985 N/A ARG 210.A NH2 GLN 261.A O no hydrogen 3.252 N/A VAL 213.A N LEU 143.A O no hydrogen 2.914 N/A GLN 214.A NE2 GLU 145.A OE2 no hydrogen 3.003 N/A ILE 215.A N GLU 145.A O no hydrogen 3.047 N/A SER 216.A N GLN 219.A OE1 no hydrogen 2.888 N/A SER 216.A OG GLU 218.A OE1 no hydrogen 3.417 N/A SER 216.A OG GLN 219.A OE1 no hydrogen 3.534 N/A GLN 219.A N SER 216.A OG no hydrogen 3.036 N/A GLN 219.A NE2 ASN 150.A O no hydrogen 2.940 N/A GLN 219.A NE2 ASP 154.A OD1 no hydrogen 2.923 N/A LEU 220.A N SER 216.A O no hydrogen 2.875 N/A LEU 221.A N GLN 217.A O no hydrogen 2.954 N/A ALA 222.A N GLU 218.A O no hydrogen 2.895 N/A LEU 223.A N GLN 219.A O no hydrogen 2.996 N/A GLU 224.A N LEU 220.A O no hydrogen 3.027 N/A THR 225.A N ALA 222.A O no hydrogen 3.209 N/A THR 225.A OG1 LEU 221.A O no hydrogen 2.752 N/A ALA 226.A N ALA 222.A O no hydrogen 2.923 N/A TYR 228.A N LYS 164.A O.A no hydrogen 2.775 N/A TYR 228.A N LYS 164.A O.B no hydrogen 2.783 N/A CYS 229.A N ARG 238.A O no hydrogen 2.796 N/A CYS 229.A SG GLY 63.A O no hydrogen 3.376 N/A CYS 229.A SG GLU 239.A O no hydrogen 3.874 N/A ASP 234.A N HIS 231.A O no hydrogen 3.050 N/A SER 236.A N ASP 234.A OD1 no hydrogen 2.805 N/A SER 236.A OG ASP 234.A OD1 no hydrogen 3.295 N/A ARG 238.A N THR 230.A OG1 no hydrogen 3.082 N/A MET 240.A N LEU 227.A O no hydrogen 2.863 N/A ASN 242.A N GLY 93.A O no hydrogen 2.926 N/A ASN 243.A N TRP 92.A O no hydrogen 3.106 N/A ASN 243.A ND2 HIS 64.A O no hydrogen 3.083 N/A ASN 243.A ND2 LEU 90.A O no hydrogen 3.602 N/A ARG 245.A N GLU 102.A OE2 no hydrogen 2.777 N/A ARG 245.A NH1 GLN 25.A OE1 no hydrogen 2.857 N/A ARG 245.A NH1 SER 26.A O no hydrogen 2.925 N/A ARG 245.A NH2 CYS 20.A O no hydrogen 3.029 N/A ARG 245.A NH2 GLN 25.A OE1 no hydrogen 3.166 N/A GLN 246.A N GLU 10.A OE1 no hydrogen 2.779 N/A GLN 248.A N PRO 27.A O no hydrogen 2.803 N/A GLN 248.A NE2 GLN 246.A O no hydrogen 2.906 N/A ARG 253.A NH2 ARG 192.A O no hydrogen 2.633 N/A VAL 255.A N ILE 34.A O no hydrogen 2.830 N/A TYR 256.A N ARG 190.A O no hydrogen 3.007 N/A THR 257.A N GLN 36.A O no hydrogen 2.914 N/A THR 257.A OG1 PHE 259.A O no hydrogen 2.904 N/A SER 258.A N TYR 188.A O no hydrogen 2.913 N/A SER 258.A OG ALA 186.A O no hydrogen 2.565 N/A SER 258.A OG TYR 188.A O no hydrogen 3.473 N/A