Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4ce3_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): SER 3.A OG.A THR 159.A OG1 no hydrogen 2.928 N/A GLU 4.A N VAL 158.A O no hydrogen 2.927 N/A PHE 6.A N PHE 156.A O no hydrogen 2.872 N/A PHE 8.A N GLY 154.A O no hydrogen 2.780 N/A GLN 9.A N GLY 94.A O no hydrogen 2.861 N/A ILE 12.A N GLN 9.A O no hydrogen 2.956 N/A THR 13.A N GLN 9.A O no hydrogen 3.441 N/A THR 13.A OG1 GLN 9.A O no hydrogen 3.485 N/A GLN 14.A N ALA 10.A O no hydrogen 3.348 N/A LEU 15.A N GLU 11.A O no hydrogen 3.153 N/A MET 16.A N ILE 12.A O no hydrogen 2.872 N/A SER 17.A N THR 13.A O no hydrogen 2.942 N/A LEU 18.A N GLN 14.A O no hydrogen 2.907 N/A ILE 19.A N LEU 15.A O no hydrogen 3.094 N/A ILE 20.A N MET 16.A O no hydrogen 3.004 N/A ASN 21.A N LEU 18.A O no hydrogen 3.301 N/A ASN 21.A ND2 SER 17.A O no hydrogen 2.917 N/A THR 22.A N LEU 18.A O no hydrogen 3.114 N/A TYR 24.A OH ASP 113.A OD1 no hydrogen 2.721 N/A LYS 27.A N SER 25.A O no hydrogen 2.759 N/A LYS 27.A NZ THR 22.A O no hydrogen 3.362 N/A LYS 27.A NZ TYR 24.A O no hydrogen 2.809 N/A PHE 30.A N LYS 27.A O no hydrogen 3.361 N/A LEU 31.A N GLU 28.A O no hydrogen 3.395 N/A ARG 32.A NE GLU 33.A OE2 no hydrogen 3.139 N/A ARG 32.A NH2 GLU 33.A OE2 no hydrogen 2.609 N/A ARG 32.A NH2 SER 115.A O no hydrogen 2.793 N/A GLU 33.A N ILE 29.A O no hydrogen 3.184 N/A LEU 34.A N PHE 30.A O no hydrogen 3.041 N/A ILE 35.A N LEU 31.A O no hydrogen 2.871 N/A SER 36.A N ARG 32.A O no hydrogen 2.980 N/A SER 36.A OG ARG 32.A O no hydrogen 2.683 N/A ASN 37.A N GLU 33.A O no hydrogen 3.106 N/A ALA 38.A N LEU 34.A O no hydrogen 3.007 N/A SER 39.A N ILE 35.A O no hydrogen 2.768 N/A ASP 40.A N SER 36.A O no hydrogen 2.764 N/A ALA 41.A N ASN 37.A O no hydrogen 2.986 N/A LEU 42.A N ALA 38.A O no hydrogen 3.043 N/A ASP 43.A N SER 39.A O no hydrogen 2.933 N/A LYS 44.A N ASP 40.A O no hydrogen 2.941 N/A ILE 45.A N ALA 41.A O no hydrogen 3.153 N/A ARG 46.A N LEU 42.A O no hydrogen 3.044 N/A ARG 46.A NE TYR 203.A OH no hydrogen 2.800 N/A ARG 46.A NH2 ASP 43.A OD1 no hydrogen 3.544 N/A ARG 46.A NH2 TYR 203.A OH no hydrogen 3.216 N/A TYR 47.A N ASP 43.A O no hydrogen 2.705 N/A LYS 48.A N LYS 44.A O no hydrogen 2.982 N/A SER 49.A N ILE 45.A O no hydrogen 2.993 N/A SER 49.A OG ILE 45.A O no hydrogen 3.371 N/A SER 49.A OG ARG 46.A O no hydrogen 2.567 N/A LEU 50.A N TYR 47.A O no hydrogen 3.268 N/A GLN 55.A N ASP 52.A O no hydrogen 3.170 N/A LEU 56.A N PRO 53.A O no hydrogen 3.263 N/A GLU 57.A N LYS 54.A O no hydrogen 3.316 N/A THR 58.A OG1 GLN 55.A O no hydrogen 3.341 N/A THR 58.A OG1 ASN 141.A OD1 no hydrogen 2.606 N/A GLU 59.A N LEU 56.A O no hydrogen 3.191 N/A PHE 63.A N SER 80.A OG no hydrogen 3.118 N/A ILE 64.A N PRO 204.A O no hydrogen 3.014 N/A ARG 65.A N ARG 78.A O no hydrogen 2.712 N/A ARG 65.A NE GLN 206.A OE1 no hydrogen 2.696 N/A ARG 65.A NH2 GLN 206.A OE1 no hydrogen 2.972 N/A ILE 66.A N GLN 206.A O no hydrogen 2.687 N/A THR 67.A N GLU 76.A O no hydrogen 2.883 N/A LYS 69.A N VAL 74.A O no hydrogen 2.587 N/A LYS 69.A NZ GLU 76.A OE1 no hydrogen 3.537 N/A LYS 69.A NZ GLU 76.A OE2 no hydrogen 2.903 N/A GLN 72.A N LYS 69.A O no hydrogen 3.121 N/A LYS 73.A N PRO 70.A O no hydrogen 3.113 N/A LYS 73.A NZ ASP 179.A OD1 no hydrogen 2.792 N/A VAL 74.A N LYS 69.A O no hydrogen 3.105 N/A LEU 75.A N LEU 175.A O no hydrogen 2.964 N/A GLU 76.A N THR 67.A O no hydrogen 3.054 N/A ILE 77.A N LEU 173.A O no hydrogen 2.893 N/A ARG 78.A N ARG 65.A O no hydrogen 2.884 N/A ASP 79.A N THR 171.A O no hydrogen 3.062 N/A SER 80.A N PHE 63.A O no hydrogen 3.188 N/A SER 80.A OG ASP 61.A O no hydrogen 2.565 N/A GLY 81.A N ASP 79.A OD1 no hydrogen 2.895 N/A ILE 82.A N ALA 41.A O no hydrogen 3.004 N/A MET 84.A N SER 138.A OG no hydrogen 2.752 N/A THR 85.A N GLU 88.A OE1 no hydrogen 2.781 N/A THR 85.A OG1 GLU 88.A OE1 no hydrogen 3.192 N/A LYS 86.A N ASP 143.A OD2 no hydrogen 3.021 N/A LYS 86.A NZ GLU 4.A OE2 no hydrogen 2.638 N/A GLU 88.A N THR 85.A OG1 no hydrogen 3.066 N/A LEU 89.A N THR 85.A O no hydrogen 2.939 N/A ILE 90.A N LYS 86.A O no hydrogen 3.096 N/A ASN 91.A N ALA 87.A O no hydrogen 2.982 N/A ASN 91.A ND2 ALA 87.A O no hydrogen 3.314 N/A ASN 92.A N GLU 88.A O no hydrogen 2.910 N/A LEU 93.A N LEU 89.A O no hydrogen 3.159 N/A THR 95.A N ILE 90.A O no hydrogen 3.125 N/A THR 95.A OG1 ILE 90.A O no hydrogen 2.922 N/A ILE 96.A N ASN 91.A O no hydrogen 3.249 N/A THR 101.A N LYS 98.A O no hydrogen 3.488 N/A THR 101.A OG1 LYS 98.A O no hydrogen 3.109 N/A PHE 104.A N GLY 100.A O no hydrogen 2.725 N/A MET 105.A N THR 101.A O no hydrogen 3.215 N/A GLU 106.A N LYS 102.A O no hydrogen 3.001 N/A ALA 107.A N ALA 103.A O no hydrogen 2.880 N/A LEU 108.A N PHE 104.A O no hydrogen 2.852 N/A SER 109.A N MET 105.A O no hydrogen 3.022 N/A SER 109.A OG MET 105.A O no hydrogen 2.791 N/A ALA 110.A N GLU 106.A O no hydrogen 3.146 N/A GLY 111.A N LEU 108.A O no hydrogen 3.171 N/A ALA 112.A N ALA 107.A O no hydrogen 2.882 N/A SER 115.A N ASP 113.A OD1 no hydrogen 3.202 N/A MET 116.A N ASP 113.A O no hydrogen 2.851 N/A ILE 117.A N VAL 114.A O no hydrogen 2.884 N/A GLN 119.A N MET 116.A O no hydrogen 2.724 N/A PHE 120.A N ILE 117.A O no hydrogen 3.170 N/A VAL 122.A N ILE 117.A O no hydrogen 3.472 N/A TYR 125.A N VAL 122.A O no hydrogen 3.233 N/A TYR 125.A OH LEU 93.A O no hydrogen 2.639 N/A SER 126.A N GLY 123.A O no hydrogen 2.999 N/A SER 126.A OG GLY 123.A O no hydrogen 2.628 N/A LEU 127.A N PHE 124.A O no hydrogen 3.279 N/A PHE 128.A N TYR 125.A O no hydrogen 3.248 N/A LEU 129.A N SER 126.A O no hydrogen 3.066 N/A VAL 130.A N LEU 127.A O no hydrogen 3.166 N/A ALA 131.A N LEU 127.A O no hydrogen 3.009 N/A ASP 132.A N PHE 176.A O no hydrogen 3.209 N/A ARG 133.A NE GLU 149.A OE2 no hydrogen 2.772 N/A ARG 133.A NH2 GLU 149.A OE2 no hydrogen 3.305 N/A VAL 134.A N SER 150.A O no hydrogen 2.907 N/A GLN 135.A N ARG 174.A O no hydrogen 3.040 N/A GLN 135.A NE2 GLU 149.A OE1 no hydrogen 2.965 N/A VAL 136.A N TRP 148.A O no hydrogen 2.703 N/A ILE 137.A N ILE 172.A O no hydrogen 2.853 N/A SER 138.A N TYR 146.A O no hydrogen 3.036 N/A SER 138.A OG MET 84.A O no hydrogen 3.563 N/A SER 138.A OG GLY 170.A O no hydrogen 3.201 N/A SER 138.A OG THR 171.A OG1 no hydrogen 2.960 N/A LYS 139.A N GLY 170.A O no hydrogen 2.759 N/A LYS 139.A NZ SER 140.A O no hydrogen 2.731 N/A LYS 139.A NZ ASP 143.A O no hydrogen 2.683 N/A ASN 141.A ND2 GLN 55.A O no hydrogen 2.824 N/A ASN 141.A ND2 GLN 55.A OE1 no hydrogen 3.106 N/A ASP 142.A N SER 140.A OG no hydrogen 3.183 N/A ASP 143.A N SER 140.A O no hydrogen 3.139 N/A GLU 144.A N ASP 143.A OD1 no hydrogen 2.810 N/A GLN 145.A NE2 ASP 161.A OD2 no hydrogen 2.758 N/A GLN 145.A NE2 GLU 165.A O no hydrogen 2.984 N/A TYR 146.A N SER 138.A O no hydrogen 3.116 N/A ILE 147.A N THR 159.A O no hydrogen 2.835 N/A TRP 148.A N VAL 136.A O no hydrogen 2.807 N/A GLU 149.A N THR 157.A O no hydrogen 2.851 N/A SER 150.A N VAL 134.A O no hydrogen 3.060 N/A ALA 152.A N SER 150.A OG no hydrogen 3.159 N/A PHE 156.A N PHE 6.A O no hydrogen 2.936 N/A THR 157.A N GLU 149.A O no hydrogen 2.990 N/A VAL 158.A N GLU 4.A O no hydrogen 2.942 N/A THR 159.A N ILE 147.A O no hydrogen 2.846 N/A THR 159.A OG1 SER 3.A OG.A no hydrogen 2.928 N/A ASP 161.A N GLN 145.A O no hydrogen 2.972 N/A VAL 163.A N ASP 161.A OD1 no hydrogen 3.031 N/A ASN 164.A N ASP 161.A OD1 no hydrogen 2.824 N/A ASN 164.A ND2 ASP 161.A OD1 no hydrogen 3.310 N/A ASN 164.A ND2 ASP 161.A OD2 no hydrogen 3.025 N/A ARG 166.A NH1 ASP 161.A O no hydrogen 3.014 N/A ARG 166.A NH2 ASP 161.A O no hydrogen 3.086 N/A ARG 166.A NH2 ASP 161.A OD1 no hydrogen 3.282 N/A ARG 166.A NH2 ASN 164.A O no hydrogen 2.774 N/A ILE 167.A N GLN 145.A OE1 no hydrogen 2.794 N/A ARG 169.A NE SER 80.A O no hydrogen 3.128 N/A ARG 169.A NE GLY 81.A O no hydrogen 2.965 N/A ARG 169.A NH1 LEU 56.A O no hydrogen 3.445 N/A ARG 169.A NH1 THR 58.A OG1 no hydrogen 3.393 N/A ARG 169.A NH1 GLU 59.A O no hydrogen 2.925 N/A ARG 169.A NH2 GLU 59.A O no hydrogen 2.814 N/A ARG 169.A NH2 SER 80.A O no hydrogen 2.576 N/A GLY 170.A N LYS 139.A O no hydrogen 2.824 N/A THR 171.A N ASP 79.A O no hydrogen 3.247 N/A THR 171.A OG1 SER 138.A OG no hydrogen 2.960 N/A ILE 172.A N ILE 137.A O no hydrogen 2.660 N/A LEU 173.A N ILE 77.A O no hydrogen 2.766 N/A ARG 174.A N GLN 135.A O no hydrogen 2.826 N/A ARG 174.A NE GLU 76.A OE2 no hydrogen 2.704 N/A ARG 174.A NH1 GLN 135.A OE1 no hydrogen 2.897 N/A ARG 174.A NH1 ASN 164.A OD1 no hydrogen 2.797 N/A ARG 174.A NH2 GLU 76.A OE2 no hydrogen 3.300 N/A ARG 174.A NH2 ASN 164.A OD1 no hydrogen 2.810 N/A LEU 175.A N LEU 75.A O no hydrogen 2.860 N/A PHE 176.A N ARG 133.A O no hydrogen 3.096 N/A LEU 177.A N LYS 73.A O no hydrogen 2.988 N/A LYS 178.A N VAL 130.A O no hydrogen 2.808 N/A LYS 178.A NZ ILE 20.A O no hydrogen 3.200 N/A LYS 178.A NZ PHE 128.A O no hydrogen 3.064 N/A LYS 178.A NZ LEU 129.A O no hydrogen 3.369 N/A GLN 181.A N LYS 178.A O no hydrogen 2.967 N/A TYR 184.A N GLN 181.A O no hydrogen 3.377 N/A LEU 185.A N LEU 182.A O no hydrogen 3.355 N/A GLU 186.A N GLU 183.A O no hydrogen 3.073 N/A ARG 189.A NE GLU 183.A OE2 no hydrogen 3.176 N/A ARG 189.A NH1 GLU 28.A OE1 no hydrogen 3.341 N/A ARG 189.A NH1 GLU 192.A OE1 no hydrogen 3.070 N/A ARG 189.A NH2 GLU 28.A OE1 no hydrogen 2.757 N/A ILE 190.A N GLU 186.A O no hydrogen 2.874 N/A LYS 191.A N GLU 187.A O no hydrogen 2.838 N/A GLU 192.A N LYS 188.A O no hydrogen 2.951 N/A VAL 193.A N ARG 189.A O no hydrogen 2.967 N/A ILE 194.A N ILE 190.A O no hydrogen 2.979 N/A LYS 195.A N LYS 191.A O no hydrogen 3.008 N/A ARG 196.A N GLU 192.A O no hydrogen 3.102 N/A ARG 196.A NH2 GLU 192.A OE2 no hydrogen 2.734 N/A HIS 197.A N VAL 193.A O no hydrogen 3.223 N/A HIS 197.A NE2 GLU 28.A OE2 no hydrogen 2.666 N/A SER 198.A N ILE 194.A O no hydrogen 2.818 N/A TYR 203.A OH ASP 43.A OD1 no hydrogen 2.515 N/A GLN 206.A N ILE 64.A O no hydrogen 2.674 N/A VAL 208.A N ILE 66.A O no hydrogen 2.917 N/A