Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 5cle_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): HIS 4.A N GLU 69.A OE1 no hydrogen 2.923 N/A HIS 4.A NE2 ASP 62.A OD1 no hydrogen 3.190 N/A PHE 6.A N HIS 4.A ND1 no hydrogen 3.027 N/A LYS 8.A N HIS 4.A O no hydrogen 2.923 N/A LYS 8.A NZ GLN 11.A OE1 no hydrogen 2.990 N/A ALA 9.A N PRO 5.A O no hydrogen 2.945 N/A LEU 10.A N PHE 6.A O no hydrogen 3.027 N/A GLN 11.A N VAL 7.A O no hydrogen 2.851 N/A GLU 12.A N LYS 8.A O no hydrogen 2.984 N/A HIS 13.A N ALA 9.A O no hydrogen 3.029 N/A HIS 13.A NE2 ASP 50.A OD1 no hydrogen 3.200 N/A PHE 14.A N LEU 10.A O no hydrogen 2.839 N/A THR 15.A N GLN 11.A O no hydrogen 2.993 N/A THR 15.A OG1 GLN 11.A O no hydrogen 2.701 N/A ALA 16.A N GLU 12.A O no hydrogen 3.105 N/A HIS 17.A N PHE 14.A O no hydrogen 2.997 N/A GLN 18.A N THR 15.A O no hydrogen 3.321 N/A ASN 19.A N LEU 37.A O no hydrogen 2.785 N/A GLU 21.A N GLU 21.A OE1 no hydrogen 2.715 N/A LYS 22.A N ASN 19.A OD1 no hydrogen 3.062 N/A LYS 22.A NZ GLN 40.A OE1 no hydrogen 2.984 N/A ALA 23.A N ASN 19.A O no hydrogen 2.898 N/A MET 26.A N LYS 22.A O no hydrogen 3.185 N/A ALA 27.A N ALA 23.A O no hydrogen 2.862 N/A ARG 28.A N GLU 24.A O no hydrogen 3.039 N/A TYR 29.A N PRO 25.A O no hydrogen 2.954 N/A MET 30.A N ALA 27.A O no hydrogen 3.180 N/A LYS 31.A N ARG 28.A O no hydrogen 2.964 N/A ASN 32.A N ALA 27.A O no hydrogen 2.865 N/A HIS 33.A N MET 30.A O no hydrogen 3.134 N/A LEU 37.A N GLU 77.A OE1 no hydrogen 2.796 N/A GLY 38.A N GLU 77.A OE2 no hydrogen 2.761 N/A ILE 39.A N GLU 77.A OE2 no hydrogen 2.957 N/A ARG 44.A N GLN 40.A O no hydrogen 2.860 N/A ARG 44.A NH1 THR 41.A OG1 no hydrogen 3.170 N/A ARG 44.A NH2 ASP 84.A OD2 no hydrogen 2.827 N/A ARG 45.A N THR 41.A O no hydrogen 2.894 N/A ARG 45.A NE ASP 84.A OD1 no hydrogen 3.130 N/A ARG 45.A NE ASP 84.A OD2 no hydrogen 3.395 N/A ARG 45.A NH1 ASP 84.A OD1 no hydrogen 3.333 N/A GLN 46.A N PRO 42.A O no hydrogen 3.252 N/A GLN 46.A NE2 ASP 50.A OD2 no hydrogen 2.928 N/A LEU 47.A N GLU 43.A O no hydrogen 2.912 N/A LEU 48.A N ARG 44.A O no hydrogen 3.043 N/A LYS 49.A N ARG 45.A O no hydrogen 2.935 N/A ASP 50.A N GLN 46.A O no hydrogen 2.828 N/A ILE 51.A N LEU 47.A O no hydrogen 3.240 N/A ILE 52.A N LEU 48.A O no hydrogen 2.998 N/A GLN 53.A N LYS 49.A O no hydrogen 2.940 N/A ILE 54.A N ASP 50.A O no hydrogen 3.196 N/A HIS 55.A N ILE 51.A O no hydrogen 2.826 N/A THR 56.A N ILE 52.A O no hydrogen 2.759 N/A THR 56.A OG1 HIS 55.A O no hydrogen 2.472 N/A LYS 61.A N ASP 59.A OD1 no hydrogen 3.077 N/A LYS 61.A NZ ASP 62.A OD1 no hydrogen 3.369 N/A LYS 61.A NZ ASP 62.A OD2 no hydrogen 3.461 N/A ASP 62.A N ASP 59.A O no hydrogen 2.991 N/A PHE 63.A N GLN 60.A O no hydrogen 2.983 N/A GLN 64.A N GLN 64.A OE1 no hydrogen 2.768 N/A ILE 66.A N ASP 62.A O no hydrogen 2.867 N/A ILE 67.A N PHE 63.A O no hydrogen 3.131 N/A ARG 68.A N GLN 64.A O no hydrogen 3.045 N/A GLU 69.A N ILE 65.A O no hydrogen 3.026 N/A LEU 70.A N ILE 66.A O no hydrogen 3.060 N/A TRP 71.A N ILE 67.A O no hydrogen 2.832 N/A TRP 71.A NE1 THR 107.A O no hydrogen 2.961 N/A ASP 72.A N ARG 68.A O no hydrogen 2.988 N/A LEU 73.A N LEU 70.A O no hydrogen 3.162 N/A GLU 75.A N GLU 75.A OE1 no hydrogen 2.832 N/A ARG 76.A N LEU 35.A O no hydrogen 2.861 N/A ARG 76.A NE ASP 112.A OD2 no hydrogen 2.916 N/A ARG 76.A NH1 GLN 79.A OE1 no hydrogen 3.103 N/A ARG 76.A NH1 LYS 108.A O no hydrogen 2.902 N/A ARG 76.A NH2 LYS 108.A O no hydrogen 3.213 N/A ARG 76.A NH2 ASP 112.A OD1 no hydrogen 2.721 N/A ARG 76.A NH2 ASP 112.A OD2 no hydrogen 3.495 N/A GLU 77.A N GLU 77.A OE1 no hydrogen 2.759 N/A PHE 78.A N GLU 75.A O no hydrogen 3.021 N/A GLN 79.A N ARG 76.A O no hydrogen 3.001 N/A GLN 79.A NE2 LEU 70.A O no hydrogen 3.199 N/A GLN 79.A NE2 LEU 73.A O no hydrogen 2.930 N/A GLN 79.A NE2 GLU 75.A O no hydrogen 3.544 N/A ALA 80.A N ARG 76.A O no hydrogen 3.101 N/A ALA 81.A N GLU 77.A O no hydrogen 2.884 N/A ALA 82.A N PHE 78.A O no hydrogen 2.967 N/A LEU 83.A N GLN 79.A O no hydrogen 3.089 N/A ASP 84.A N ALA 80.A O no hydrogen 3.102 N/A ILE 85.A N ALA 81.A O no hydrogen 2.840 N/A MET 86.A N ALA 82.A O no hydrogen 2.801 N/A GLN 87.A N LEU 83.A O no hydrogen 3.170 N/A TYR 89.A N MET 86.A O no hydrogen 3.018 N/A TYR 89.A OH PRO 58.A O no hydrogen 2.651 N/A LYS 90.A N GLN 87.A O no hydrogen 3.111 N/A LYS 90.A NZ ASP 124.A OD1 no hydrogen 2.603 N/A HIS 92.A N TYR 89.A O no hydrogen 2.860 N/A ILE 93.A N LYS 90.A O no hydrogen 3.120 N/A ASN 94.A N HIS 97.A ND1 no hydrogen 2.979 N/A GLU 95.A N GLU 95.A OE1 no hydrogen 2.697 N/A THR 96.A N ASN 94.A OD1 no hydrogen 2.909 N/A THR 96.A OG1 ASN 94.A OD1 no hydrogen 2.611 N/A HIS 97.A N ASN 94.A O no hydrogen 2.973 N/A ILE 98.A N GLU 95.A O no hydrogen 3.307 N/A LEU 101.A N HIS 97.A O no hydrogen 2.962 N/A GLU 102.A N ILE 98.A O no hydrogen 2.831 N/A GLU 103.A N PRO 99.A O no hydrogen 3.013 N/A LEU 104.A N PHE 100.A O no hydrogen 3.207 N/A ILE 105.A N LEU 101.A O no hydrogen 2.997 N/A VAL 106.A N GLU 102.A O no hydrogen 3.212 N/A THR 107.A N LEU 104.A O no hydrogen 3.442 N/A THR 107.A OG1 GLU 103.A O no hydrogen 2.863 N/A LYS 108.A NZ TRP 71.A O no hydrogen 2.868 N/A SER 109.A OG ILE 105.A O no hydrogen 2.594 N/A TRP 110.A N SER 113.A OG no hydrogen 3.400 N/A SER 113.A OG LYS 108.A O no hydrogen 3.561 N/A SER 113.A OG TRP 110.A O no hydrogen 3.173 N/A VAL 114.A N TRP 110.A O no hydrogen 3.052 N/A ASP 115.A N TRP 111.A O no hydrogen 2.969 N/A SER 116.A N SER 113.A O no hydrogen 3.042 N/A SER 116.A OG ASP 112.A O no hydrogen 3.035 N/A ILE 117.A N VAL 114.A O no hydrogen 3.146 N/A VAL 118.A N VAL 114.A O no hydrogen 3.017 N/A THR 120.A OG1 SER 116.A O no hydrogen 2.933 N/A PHE 121.A N ILE 117.A O no hydrogen 3.167 N/A LEU 122.A N ILE 117.A O no hydrogen 3.312 N/A GLY 123.A N VAL 118.A O no hydrogen 2.830 N/A ASP 124.A N THR 120.A O no hydrogen 2.973 N/A ILE 125.A N PHE 121.A O no hydrogen 3.324 N/A PHE 126.A N LEU 122.A O no hydrogen 3.003 N/A LEU 127.A N GLY 123.A O no hydrogen 3.038 N/A LYS 128.A N ASP 124.A O no hydrogen 3.245 N/A HIS 129.A N ILE 125.A O no hydrogen 2.866 N/A GLU 131.A N GLU 131.A OE1 no hydrogen 2.806 N/A LEU 132.A N HIS 129.A O no hydrogen 2.985 N/A ILE 133.A N PRO 130.A O no hydrogen 3.168 N/A ALA 135.A N LEU 132.A O no hydrogen 2.944 N/A TYR 136.A N ILE 133.A O no hydrogen 3.050 N/A ILE 137.A N ILE 133.A O no hydrogen 2.886 N/A LYS 139.A NZ GLU 102.A OE2 no hydrogen 2.708 N/A TRP 140.A N TYR 136.A O no hydrogen 3.005 N/A TRP 140.A NE1 GLU 102.A OE2 no hydrogen 2.582 N/A ILE 141.A N ILE 137.A O no hydrogen 2.989 N/A ALA 142.A N PRO 138.A O no hydrogen 3.165 N/A SER 143.A N TRP 140.A O no hydrogen 3.305 N/A SER 143.A OG.A TRP 140.A O no hydrogen 2.737 N/A SER 143.A OG.A ASN 145.A O no hydrogen 3.412 N/A ASN 145.A N SER 143.A OG.A no hydrogen 3.298 N/A ASN 145.A N SER 143.A OG.B no hydrogen 2.792 N/A TRP 147.A N ASN 145.A OD1 no hydrogen 2.820 N/A LEU 148.A N ASN 145.A O no hydrogen 3.102 N/A LEU 148.A N ASN 145.A OD1 no hydrogen 3.262 N/A GLN 149.A N ASN 145.A O no hydrogen 3.232 N/A GLN 149.A NE2 ILE 141.A O no hydrogen 3.107 N/A ARG 150.A N ILE 146.A O no hydrogen 2.881 N/A ARG 150.A NE ASP 115.A OD1 no hydrogen 3.196 N/A ARG 150.A NH1 PHE 182.A O no hydrogen 2.842 N/A ARG 150.A NH2 ASP 115.A OD1 no hydrogen 3.142 N/A ARG 150.A NH2 ASP 115.A OD2 no hydrogen 3.053 N/A ALA 151.A N TRP 147.A O no hydrogen 2.986 N/A ALA 152.A N LEU 148.A O no hydrogen 3.013 N/A ILE 153.A N GLN 149.A O no hydrogen 3.195 N/A LEU 154.A N ARG 150.A O no hydrogen 2.896 N/A PHE 155.A N ALA 151.A O no hydrogen 3.057 N/A LEU 157.A N LEU 154.A O no hydrogen 2.962 N/A TYR 159.A N GLN 156.A O no hydrogen 3.019 N/A TYR 159.A OH GLY 123.A O no hydrogen 2.637 N/A LYS 162.A N TYR 159.A O no hydrogen 2.862 N/A MET 163.A N LYS 160.A O no hydrogen 3.050 N/A ASP 164.A N GLN 156.A OE1 no hydrogen 3.067 N/A LEU 167.A N ASP 164.A OD1 no hydrogen 3.178 N/A LEU 168.A N ASP 164.A O no hydrogen 2.898 N/A PHE 169.A N GLU 165.A O no hydrogen 2.985 N/A TRP 170.A N GLU 166.A O no hydrogen 3.031 N/A ILE 171.A N LEU 167.A O no hydrogen 2.899 N/A ILE 172.A N LEU 168.A O no hydrogen 2.961 N/A GLY 173.A N PHE 169.A O no hydrogen 2.882 N/A GLN 174.A N TRP 170.A O no hydrogen 3.076 N/A GLN 174.A N ILE 171.A O no hydrogen 3.072 N/A LEU 175.A N ILE 171.A O no hydrogen 3.241 N/A LEU 175.A N ILE 172.A O no hydrogen 3.003 N/A HIS 176.A ND1 GLY 173.A O no hydrogen 2.799 N/A SER 177.A OG HIS 176.A NE2 no hydrogen 3.249 N/A SER 178.A N LEU 175.A O no hydrogen 3.088 N/A GLU 180.A N SER 178.A OG no hydrogen 3.050 N/A ILE 183.A N GLU 180.A O no hydrogen 3.065 N/A GLN 184.A N GLU 180.A O no hydrogen 2.985 N/A GLN 184.A NE2 SER 178.A O no hydrogen 2.853 N/A LYS 185.A N PHE 181.A O no hydrogen 2.891 N/A ALA 186.A N PHE 182.A O no hydrogen 3.268 N/A ILE 187.A N ILE 183.A O no hydrogen 3.013 N/A GLY 188.A N GLN 184.A O no hydrogen 3.125 N/A TRP 189.A N LYS 185.A O no hydrogen 2.816 N/A VAL 190.A N ALA 186.A O no hydrogen 2.963 N/A LEU 191.A N ILE 187.A O no hydrogen 3.164 N/A ARG 192.A N GLY 188.A O no hydrogen 2.891 N/A ARG 192.A NE GLU 218.A O no hydrogen 2.947 N/A ARG 192.A NH2 GLU 218.A OE1 no hydrogen 2.754 N/A GLU 193.A N TRP 189.A O no hydrogen 2.863 N/A TYR 194.A N VAL 190.A O no hydrogen 2.904 N/A TYR 194.A OH GLU 165.A OE2 no hydrogen 2.306 N/A ALA 195.A N LEU 191.A O no hydrogen 2.881 N/A LYS 196.A N GLU 193.A O no hydrogen 3.081 N/A LYS 196.A NZ GLU 193.A OE1 no hydrogen 3.198 N/A THR 197.A N TYR 194.A O no hydrogen 2.849 N/A ASN 198.A N TYR 194.A O no hydrogen 2.897 N/A VAL 201.A N ASN 198.A OD1 no hydrogen 3.365 N/A VAL 202.A N ASN 198.A O no hydrogen 3.456 N/A TRP 203.A N PRO 199.A O no hydrogen 2.879 N/A GLU 204.A N ASP 200.A O no hydrogen 2.976 N/A TYR 205.A N VAL 201.A O no hydrogen 2.982 N/A VAL 206.A N VAL 202.A O no hydrogen 2.968 N/A GLN 207.A N TRP 203.A O no hydrogen 3.040 N/A ASN 208.A N TYR 205.A O no hydrogen 3.158 N/A ASN 208.A ND2 GLU 204.A O no hydrogen 2.844 N/A ASN 209.A ND2 TYR 205.A O no hydrogen 2.862 N/A SER 215.A OG GLN 184.A O no hydrogen 2.608 N/A LYS 216.A N ALA 212.A O no hydrogen 3.075 N/A LYS 216.A NZ GLN 207.A OE1 no hydrogen 2.983 N/A ARG 217.A N PRO 213.A O no hydrogen 2.940 N/A GLU 218.A N LEU 214.A O no hydrogen 2.968 N/A ALA 219.A N SER 215.A O no hydrogen 2.928 N/A ILE 220.A N LYS 216.A O no hydrogen 3.119 N/A LYS 221.A N GLU 218.A O no hydrogen 3.409 N/A LYS 224.A N ILE 220.A O no hydrogen 2.976 N/A LYS 224.A NZ GLN 225.A OE1 no hydrogen 3.460 N/A GLN 225.A N HIS 222.A O no hydrogen 3.148 N/A GLN 225.A NE2 LYS 221.A O no hydrogen 3.236 N/A GLN 225.A NE2 HIS 222.A O no hydrogen 3.335 N/A ASN 226.A N ILE 223.A O no hydrogen 2.892 N/A TYR 227.A OH ASP 200.A OD1 no hydrogen 2.519 N/A GLY 228.A N LYS 224.A O no hydrogen 2.837 N/A