Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3e28_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): LYS 5.A N ASP 2.A OD2 no hydrogen 2.586 N/A GLN 6.A NE2 ASN 10.A OD1 no hydrogen 3.522 N/A LEU 7.A N LYS 3.A O no hydrogen 3.236 N/A PHE 8.A N ILE 4.A O no hydrogen 2.977 N/A ALA 9.A N LYS 5.A O no hydrogen 2.864 N/A ASN 10.A N GLN 6.A O no hydrogen 2.787 N/A ASN 11.A N LEU 7.A O no hydrogen 2.827 N/A TYR 12.A N PHE 8.A O no hydrogen 2.997 N/A SER 13.A N ALA 9.A O no hydrogen 3.149 N/A SER 13.A OG ALA 9.A O no hydrogen 3.555 N/A SER 13.A OG ASN 10.A O no hydrogen 3.504 N/A TRP 14.A N ASN 10.A O no hydrogen 3.032 N/A ALA 15.A N ASN 11.A O no hydrogen 3.056 N/A GLN 16.A N TYR 12.A O no hydrogen 2.961 N/A ARG 17.A N SER 13.A O no hydrogen 2.743 N/A MET 18.A N TRP 14.A O no hydrogen 2.856 N/A LYS 19.A N ALA 15.A O no hydrogen 3.040 N/A LYS 19.A NZ GLN 16.A OE1 no hydrogen 3.149 N/A GLU 20.A N GLN 16.A O no hydrogen 3.118 N/A GLU 21.A N ARG 17.A O no hydrogen 3.267 N/A ASN 22.A N MET 18.A O no hydrogen 2.999 N/A THR 24.A OG1 MET 18.A O no hydrogen 3.408 N/A GLN 27.A NE2 THR 28.A O no hydrogen 3.222 N/A HIS 30.A N GLU 53.A O no hydrogen 2.977 N/A TYR 31.A N GLU 53.A O no hydrogen 3.292 N/A LEU 32.A N HIS 86.A O no hydrogen 2.861 N/A TRP 33.A N PHE 55.A O no hydrogen 2.603 N/A ILE 34.A N ILE 88.A O no hydrogen 2.779 N/A GLY 35.A N HIS 57.A O no hydrogen 2.872 N/A CYS 36.A SG ASP 38.A OD1 no hydrogen 2.938 N/A CYS 36.A SG ASN 59.A O no hydrogen 4.046 N/A CYS 36.A SG HIS 92.A NE2 no hydrogen 3.452 N/A SER 37.A N ASN 59.A O no hydrogen 2.893 N/A SER 39.A N CYS 36.A O no hydrogen 3.242 N/A SER 39.A OG CYS 36.A O no hydrogen 2.758 N/A GLU 44.A N GLU 44.A OE1 no hydrogen 2.987 N/A LEU 46.A N PRO 42.A O no hydrogen 3.043 N/A THR 47.A N ALA 43.A O no hydrogen 2.876 N/A THR 47.A OG1 ALA 43.A O no hydrogen 2.643 N/A ASN 48.A N LYS 45.A O no hydrogen 2.790 N/A LEU 49.A N GLU 44.A O no hydrogen 3.306 N/A GLU 50.A N GLU 53.A OE2 no hydrogen 2.988 N/A GLU 53.A N GLU 50.A O no hydrogen 3.234 N/A PHE 55.A N TYR 31.A O no hydrogen 2.847 N/A HIS 57.A N TRP 33.A O no hydrogen 2.705 N/A ARG 58.A NE CYS 36.A O no hydrogen 3.131 N/A ARG 58.A NH2 CYS 36.A O no hydrogen 2.964 N/A ARG 58.A NH2 SER 39.A O no hydrogen 2.872 N/A ASN 59.A N GLY 35.A O no hydrogen 3.121 N/A ASN 59.A ND2 HIS 57.A NE2 no hydrogen 2.810 N/A ASN 59.A ND2 GLN 63.A O no hydrogen 2.916 N/A ASN 62.A N ASN 59.A O no hydrogen 3.351 N/A ASN 62.A ND2 ASN 62.A O no hydrogen 2.753 N/A GLN 63.A N ASN 59.A OD1 no hydrogen 2.820 N/A GLN 63.A NE2 TRP 113.A O no hydrogen 3.353 N/A VAL 64.A N GLN 148.A OE1 no hydrogen 3.006 N/A ASP 68.A N ILE 65.A O no hydrogen 3.058 N/A ASN 70.A N ASP 68.A OD1 no hydrogen 3.096 N/A CYS 71.A N ASP 68.A OD2 no hydrogen 3.155 N/A CYS 71.A SG GLN 63.A O no hydrogen 3.864 N/A LEU 72.A N ASP 68.A O no hydrogen 2.995 N/A SER 73.A N PHE 69.A O no hydrogen 3.025 N/A SER 73.A OG PHE 69.A O no hydrogen 2.787 N/A SER 73.A OG ASN 70.A O no hydrogen 3.177 N/A VAL 74.A N ASN 70.A O no hydrogen 3.204 N/A VAL 75.A N CYS 71.A O no hydrogen 2.957 N/A GLN 76.A N LEU 72.A O no hydrogen 2.781 N/A GLN 76.A NE2 ASP 80.A OD2 no hydrogen 2.962 N/A TYR 77.A N SER 73.A O no hydrogen 2.880 N/A ALA 78.A N VAL 74.A O no hydrogen 2.917 N/A VAL 79.A N VAL 75.A O no hydrogen 2.988 N/A ASP 80.A N GLN 76.A O no hydrogen 2.859 N/A VAL 81.A N TYR 77.A O no hydrogen 2.967 N/A LEU 82.A N TYR 77.A O no hydrogen 2.921 N/A LYS 83.A NZ ASP 80.A O no hydrogen 2.983 N/A ILE 84.A N ALA 78.A O no hydrogen 2.982 N/A HIS 86.A ND1 SER 169.A OG no hydrogen 2.702 N/A ILE 87.A N SER 169.A O no hydrogen 3.023 N/A ILE 88.A N LEU 32.A O no hydrogen 2.785 N/A ILE 89.A N HIS 171.A O no hydrogen 2.874 N/A CYS 90.A N ILE 34.A O no hydrogen 2.816 N/A CYS 90.A SG GLY 91.A O no hydrogen 3.326 N/A GLY 91.A N TRP 173.A O no hydrogen 2.936 N/A HIS 92.A NE2 ASP 38.A OD1 no hydrogen 2.926 N/A THR 93.A N PHE 175.A O no hydrogen 3.091 N/A THR 93.A OG1 ASP 176.A OD1 no hydrogen 3.142 N/A CYS 95.A SG HIS 92.A NE2 no hydrogen 3.744 N/A GLY 97.A N ASP 38.A OD2 no hydrogen 2.904 N/A HIS 99.A N CYS 95.A O no hydrogen 3.147 N/A ALA 100.A N GLY 96.A O no hydrogen 2.650 N/A ALA 101.A N GLY 97.A O no hydrogen 2.670 N/A MET 102.A N ILE 98.A O no hydrogen 3.006 N/A MET 102.A N HIS 99.A O no hydrogen 2.948 N/A ALA 103.A N HIS 99.A O no hydrogen 3.029 N/A LEU 107.A N ASN 111.A OD1 no hydrogen 3.480 N/A ASN 111.A N GLY 108.A O no hydrogen 2.812 N/A ASN 111.A ND2 LYS 105.A O no hydrogen 3.548 N/A ASN 112.A N LEU 109.A O no hydrogen 3.104 N/A ASN 112.A ND2 LEU 109.A O no hydrogen 3.101 N/A TRP 113.A NE1 VAL 60.A O no hydrogen 3.005 N/A LEU 114.A N ILE 110.A O no hydrogen 2.884 N/A LEU 115.A N ASN 112.A O no hydrogen 3.201 N/A ILE 117.A N LEU 114.A O no hydrogen 2.882 N/A ARG 118.A N LEU 114.A O no hydrogen 3.231 N/A ARG 118.A NH1 ALA 101.A O no hydrogen 2.968 N/A ARG 118.A NH1 MET 102.A O no hydrogen 3.369 N/A ASP 119.A N LEU 115.A O no hydrogen 2.988 N/A ILE 120.A N HIS 116.A O no hydrogen 3.302 N/A TRP 121.A N ILE 117.A O no hydrogen 2.910 N/A PHE 122.A N.A ARG 118.A O no hydrogen 2.889 N/A PHE 122.A N.B ARG 118.A O no hydrogen 2.870 N/A LYS 123.A N ASP 119.A O no hydrogen 2.735 N/A LYS 123.A NZ GLU 147.A OE1 no hydrogen 2.726 N/A LYS 123.A NZ GLU 147.A OE2 no hydrogen 3.234 N/A HIS 124.A N ILE 120.A O no hydrogen 3.010 N/A HIS 124.A NE2 GLU 147.A OE2 no hydrogen 2.470 N/A GLY 125.A N PHE 122.A O.A no hydrogen 3.390 N/A GLY 125.A N PHE 122.A O.B no hydrogen 3.004 N/A LEU 128.A N HIS 124.A O no hydrogen 2.905 N/A GLY 129.A N GLY 125.A O no hydrogen 2.669 N/A LYS 130.A N HIS 126.A O no hydrogen 3.380 N/A LYS 130.A N LEU 127.A O no hydrogen 3.161 N/A LYS 130.A NZ HIS 126.A ND1 no hydrogen 3.052 N/A LYS 130.A NZ HIS 126.A O no hydrogen 3.190 N/A LEU 131.A N LEU 128.A O no hydrogen 3.248 N/A SER 132.A N ASN 213.A O no hydrogen 2.629 N/A SER 132.A OG GLU 134.A OE1 no hydrogen 3.052 N/A SER 132.A OG GLU 134.A OE2 no hydrogen 3.432 N/A LYS 135.A N SER 132.A O no hydrogen 3.023 N/A ARG 136.A N PRO 133.A O no hydrogen 3.262 N/A ARG 136.A NE LEU 128.A O no hydrogen 2.842 N/A ARG 136.A NE LEU 131.A O no hydrogen 3.204 N/A ARG 136.A NH2 GLY 129.A O no hydrogen 3.486 N/A ARG 136.A NH2 LEU 131.A O no hydrogen 3.092 N/A ASP 138.A N LYS 135.A O no hydrogen 2.982 N/A MET 139.A N LYS 135.A O no hydrogen 3.437 N/A LEU 140.A N ARG 136.A O no hydrogen 2.879 N/A THR 141.A N ALA 137.A O no hydrogen 3.055 N/A THR 141.A OG1 ALA 137.A O no hydrogen 2.772 N/A LYS 142.A NZ GLN 185.A OE1 no hydrogen 2.607 N/A ILE 143.A N MET 139.A O no hydrogen 2.801 N/A ASN 144.A N LEU 140.A O no hydrogen 2.717 N/A ASN 144.A ND2 ALA 61.A O no hydrogen 2.927 N/A VAL 145.A N THR 141.A O no hydrogen 3.333 N/A ALA 146.A N LYS 142.A O no hydrogen 3.057 N/A GLU 147.A N ILE 143.A O no hydrogen 2.808 N/A GLN 148.A N ASN 144.A O no hydrogen 2.921 N/A GLN 148.A NE2 ASN 144.A O no hydrogen 3.572 N/A GLN 148.A NE2 ASN 144.A OD1 no hydrogen 2.684 N/A VAL 149.A N VAL 145.A O no hydrogen 3.205 N/A TYR 150.A N ALA 146.A O no hydrogen 3.164 N/A TYR 150.A OH GLU 196.A OE1 no hydrogen 2.286 N/A ASN 151.A N GLU 147.A O no hydrogen 2.778 N/A ASN 151.A ND2 VAL 64.A O no hydrogen 3.141 N/A ASN 151.A ND2 GLN 148.A OE1 no hydrogen 3.344 N/A LEU 152.A N GLN 148.A O no hydrogen 2.888 N/A GLY 153.A N VAL 149.A O no hydrogen 2.960 N/A ARG 154.A N TYR 150.A O no hydrogen 3.149 N/A ARG 154.A N ASN 151.A O no hydrogen 3.123 N/A THR 155.A N LEU 152.A O no hydrogen 3.139 N/A THR 155.A OG1 LEU 152.A O no hydrogen 2.668 N/A VAL 158.A N THR 155.A OG1 no hydrogen 3.282 N/A LYS 159.A N THR 155.A O no hydrogen 3.217 N/A SER 160.A N SER 156.A O no hydrogen 3.144 N/A SER 160.A OG SER 156.A O no hydrogen 3.018 N/A ALA 161.A N ILE 157.A O no hydrogen 3.092 N/A TRP 162.A N VAL 158.A O no hydrogen 2.985 N/A TRP 162.A NE1 LEU 168.A O no hydrogen 2.943 N/A GLU 163.A N LYS 159.A O no hydrogen 2.883 N/A ARG 164.A N SER 160.A O no hydrogen 3.132 N/A ARG 164.A NH2 ASP 80.A OD1 no hydrogen 2.867 N/A ARG 164.A NH2 GLN 166.A OE1 no hydrogen 2.992 N/A GLY 165.A N TRP 162.A O no hydrogen 3.225 N/A GLN 166.A N ALA 161.A O no hydrogen 2.907 N/A GLN 166.A NE2 VAL 79.A O no hydrogen 2.943 N/A LYS 167.A NZ GLU 85.A OE2 no hydrogen 2.971 N/A SER 169.A N GLU 85.A O no hydrogen 2.852 N/A SER 169.A OG GLU 85.A O no hydrogen 3.418 N/A SER 169.A OG HIS 171.A NE2 no hydrogen 2.971 N/A LEU 170.A N ALA 189.A O no hydrogen 2.796 N/A HIS 171.A N ILE 87.A O no hydrogen 2.879 N/A HIS 171.A NE2 SER 169.A OG no hydrogen 2.971 N/A TRP 173.A N ILE 89.A O no hydrogen 2.920 N/A VAL 174.A N VAL 183.A O no hydrogen 2.974 N/A PHE 175.A N GLY 91.A O no hydrogen 2.796 N/A ASP 176.A N PHE 181.A O no hydrogen 3.034 N/A ASN 178.A N ASP 176.A OD1 no hydrogen 3.153 N/A ASP 179.A N ASP 176.A O no hydrogen 3.279 N/A PHE 181.A N ASP 179.A OD2 no hydrogen 3.051 N/A VAL 183.A N VAL 174.A O no hydrogen 2.958 N/A GLN 185.A N GLY 172.A O no hydrogen 3.076 N/A GLN 185.A NE2 VAL 183.A O no hydrogen 3.032 N/A GLY 186.A N ASP 184.A OD2 no hydrogen 2.987 N/A MET 188.A N SER 198.A OG no hydrogen 2.754 N/A ALA 189.A N LEU 170.A O no hydrogen 3.227 N/A THR 190.A N THR 194.A OG1 no hydrogen 2.878 N/A SER 191.A OG THR 194.A OG1 no hydrogen 2.667 N/A ARG 192.A NH1 GLU 196.A OE1 no hydrogen 2.658 N/A THR 194.A N SER 191.A OG no hydrogen 3.096 N/A THR 194.A OG1 SER 191.A O no hydrogen 2.848 N/A THR 194.A OG1 SER 191.A OG no hydrogen 2.667 N/A LEU 195.A N SER 191.A O no hydrogen 2.859 N/A GLU 196.A N ARG 192.A O no hydrogen 3.148 N/A ILE 197.A N GLU 193.A O no hydrogen 3.261 N/A SER 198.A N THR 194.A O no hydrogen 3.023 N/A SER 198.A OG GLY 186.A O no hydrogen 2.683 N/A SER 198.A OG MET 188.A O no hydrogen 3.552 N/A TYR 199.A N LEU 195.A O no hydrogen 3.023 N/A TYR 199.A OH GLU 147.A OE1 no hydrogen 3.238 N/A TYR 199.A OH GLU 147.A OE2 no hydrogen 2.492 N/A ARG 200.A N GLU 196.A O no hydrogen 3.044 N/A ARG 200.A NH2 ASN 201.A OD1 no hydrogen 3.304 N/A ASN 201.A N ILE 197.A O no hydrogen 2.839 N/A ALA 202.A N SER 198.A O no hydrogen 2.850 N/A ILE 203.A N TYR 199.A O no hydrogen 2.869 N/A ALA 204.A N ARG 200.A O no hydrogen 3.041 N/A ARG 205.A N ASN 201.A O no hydrogen 3.093 N/A ARG 205.A N ALA 202.A O no hydrogen 3.139 N/A LEU 206.A N ALA 202.A O no hydrogen 3.005 N/A SER 207.A N ILE 203.A O no hydrogen 3.006 N/A SER 207.A OG ILE 203.A O no hydrogen 2.614 N/A ILE 208.A N ARG 205.A O no hydrogen 3.305 N/A GLU 212.A N GLU 212.A OE1 no hydrogen 3.208 N/A ASN 213.A N ASP 210.A O no hydrogen 3.027 N/A