Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3bi6_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): SER 1.A OG THR 4.A OG1 no hydrogen 2.957 N/A ARG 2.A N GLU 76.A OE2 no hydrogen 2.773 N/A ARG 2.A NH2 SER 72.A OG no hydrogen 2.781 N/A TYR 3.A N GLU 76.A OE1 no hydrogen 3.086 N/A TYR 3.A OH GLU 9.A OE2 no hydrogen 2.686 N/A THR 4.A N SER 1.A OG no hydrogen 2.890 N/A THR 4.A OG1 SER 1.A OG no hydrogen 2.957 N/A THR 5.A N SER 1.A O no hydrogen 2.932 N/A GLU 6.A N ARG 2.A O no hydrogen 2.671 N/A PHE 7.A N TYR 3.A O no hydrogen 3.093 N/A HIS 8.A N VAL 25.A O no hydrogen 2.629 N/A LEU 10.A N LYS 23.A O no hydrogen 2.841 N/A GLU 11.A N LYS 23.A O no hydrogen 3.360 N/A ILE 13.A N VAL 21.A O no hydrogen 2.892 N/A GLY 14.A N VAL 21.A O no hydrogen 3.330 N/A GLY 16.A N GLY 19.A O no hydrogen 2.902 N/A SER 20.A N ARG 37.A O no hydrogen 3.179 N/A VAL 21.A N GLY 14.A O no hydrogen 2.854 N/A PHE 22.A N ILE 35.A O no hydrogen 2.885 N/A LYS 23.A N GLU 11.A O no hydrogen 2.856 N/A CYS 24.A N TYR 33.A O no hydrogen 2.874 N/A CYS 24.A SG TYR 3.A OH no hydrogen 3.361 N/A CYS 24.A SG PHE 22.A O no hydrogen 3.926 N/A VAL 25.A N HIS 8.A O no hydrogen 2.846 N/A LYS 26.A N CYS 31.A O no hydrogen 2.917 N/A ARG 27.A N GLU 6.A O no hydrogen 2.810 N/A ARG 27.A NE THR 5.A O no hydrogen 3.293 N/A ARG 27.A NH2 THR 4.A O no hydrogen 3.318 N/A GLY 30.A N LYS 26.A O no hydrogen 2.911 N/A CYS 31.A N ASP 29.A OD1 no hydrogen 2.827 N/A TYR 33.A N CYS 24.A O no hydrogen 2.895 N/A TYR 33.A OH ASP 29.A OD2 no hydrogen 2.601 N/A ALA 34.A N ASN 84.A O no hydrogen 2.941 N/A ILE 35.A N PHE 22.A O no hydrogen 2.788 N/A LYS 36.A N ILE 82.A O no hydrogen 2.919 N/A ARG 37.A N SER 20.A O no hydrogen 2.899 N/A ARG 37.A NH2 ASP 77.A OD2 no hydrogen 3.127 N/A SER 38.A N MET 80.A O no hydrogen 2.915 N/A LYS 40.A N ASP 78.A O no hydrogen 2.604 N/A LYS 40.A NZ ASP 77.A O no hydrogen 2.415 N/A GLY 44.A N GLU 48.A OE1 no hydrogen 2.827 N/A SER 45.A N LEU 42.A O no hydrogen 2.946 N/A SER 45.A OG LEU 42.A O no hydrogen 2.290 N/A GLU 48.A N SER 45.A OG no hydrogen 3.186 N/A GLN 49.A N SER 45.A O no hydrogen 3.199 N/A ASN 50.A N VAL 46.A O no hydrogen 3.160 N/A ALA 51.A N ASP 47.A O no hydrogen 2.993 N/A LEU 52.A N GLU 48.A O no hydrogen 2.801 N/A ARG 53.A N GLN 49.A O no hydrogen 2.978 N/A ARG 53.A NH2 ASN 50.A OD1 no hydrogen 2.906 N/A GLU 54.A N ASN 50.A O no hydrogen 3.340 N/A TYR 56.A N LEU 52.A O no hydrogen 2.804 N/A ALA 57.A N ARG 53.A O no hydrogen 2.724 N/A HIS 58.A N GLU 54.A O no hydrogen 2.931 N/A ALA 59.A N VAL 55.A O no hydrogen 2.922 N/A VAL 60.A N ALA 57.A O no hydrogen 3.060 N/A LEU 61.A N HIS 58.A O no hydrogen 3.295 N/A GLN 63.A N TYR 124.A OH no hydrogen 3.011 N/A HIS 66.A N HIS 64.A ND1 no hydrogen 3.058 N/A HIS 66.A ND1 PHE 147.A O no hydrogen 2.794 N/A VAL 67.A N HIS 64.A O no hydrogen 3.369 N/A VAL 68.A N ILE 149.A O no hydrogen 2.856 N/A ARG 69.A N GLU 85.A OE1 no hydrogen 2.851 N/A ARG 69.A NH1.A TYR 70.A O no hydrogen 3.056 N/A ARG 69.A NH2.B GLY 62.A O no hydrogen 3.121 N/A PHE 71.A N GLN 83.A O no hydrogen 2.833 N/A SER 72.A N GLN 83.A O no hydrogen 3.315 N/A TRP 74.A N LEU 81.A O no hydrogen 2.926 N/A TRP 74.A NE1 GLU 76.A OE1 no hydrogen 3.084 N/A GLU 76.A N HIS 79.A O no hydrogen 2.885 N/A HIS 79.A N GLU 76.A O no hydrogen 3.113 N/A MET 80.A N SER 38.A O no hydrogen 2.965 N/A LEU 81.A N TRP 74.A O no hydrogen 2.780 N/A ILE 82.A N LYS 36.A O no hydrogen 3.104 N/A GLN 83.A N SER 72.A O no hydrogen 2.771 N/A ASN 84.A N ALA 34.A O no hydrogen 2.812 N/A ASN 84.A ND2 HIS 58.A NE2 no hydrogen 3.121 N/A GLU 85.A N ARG 69.A O no hydrogen 2.802 N/A GLY 89.A N ILE 142.A O no hydrogen 2.788 N/A GLY 90.A N CYS 87.A O no hydrogen 3.481 N/A LEU 92.A N ILE 140.A O no hydrogen 2.779 N/A ALA 93.A N PRO 137.A O no hydrogen 3.045 N/A ASP 94.A N SER 91.A OG no hydrogen 3.288 N/A ALA 95.A N SER 91.A O no hydrogen 3.240 N/A ILE 96.A N LEU 92.A O no hydrogen 2.842 N/A SER 97.A N ALA 93.A O no hydrogen 2.998 N/A SER 97.A OG ALA 93.A O no hydrogen 3.184 N/A GLU 98.A N ASP 94.A O no hydrogen 3.004 N/A ASN 99.A N ALA 95.A O no hydrogen 3.013 N/A TYR 100.A N ILE 96.A O no hydrogen 2.904 N/A TYR 100.A OH GLU 202.A OE1 no hydrogen 3.131 N/A TYR 100.A OH GLU 202.A OE2 no hydrogen 2.402 N/A ARG 101.A N SER 97.A O no hydrogen 3.277 N/A ARG 101.A N GLU 98.A O no hydrogen 3.095 N/A ILE 102.A N GLU 98.A O no hydrogen 3.270 N/A SER 104.A N ASN 99.A O no hydrogen 3.169 N/A PHE 106.A N ALA 198.A O no hydrogen 3.313 N/A LYS 107.A N GLU 110.A OE1 no hydrogen 2.763 N/A LYS 107.A NZ TYR 105.A O no hydrogen 3.480 N/A LEU 111.A N LYS 107.A O no hydrogen 2.902 N/A LYS 112.A N GLU 108.A O no hydrogen 2.937 N/A LYS 112.A NZ VAL 256.A O no hydrogen 3.389 N/A ASP 113.A N ALA 109.A O no hydrogen 3.124 N/A LEU 114.A N GLU 110.A O no hydrogen 2.949 N/A LEU 115.A N LEU 111.A O no hydrogen 2.895 N/A LEU 116.A N LYS 112.A O no hydrogen 2.794 N/A GLN 117.A N ASP 113.A O no hydrogen 2.873 N/A GLN 117.A NE2 ASP 113.A OD1 no hydrogen 2.796 N/A GLN 117.A NE2 VAL 145.A O no hydrogen 3.194 N/A VAL 118.A N LEU 114.A O no hydrogen 3.096 N/A GLY 119.A N LEU 115.A O no hydrogen 2.772 N/A ARG 120.A N LEU 116.A O no hydrogen 2.786 N/A GLY 121.A N GLN 117.A O no hydrogen 3.123 N/A LEU 122.A N VAL 118.A O no hydrogen 2.804 N/A ARG 123.A N GLY 119.A O no hydrogen 2.973 N/A TYR 124.A N ARG 120.A O no hydrogen 3.172 N/A ILE 125.A N GLY 121.A O no hydrogen 2.976 N/A HIS 126.A N LEU 122.A O no hydrogen 2.761 N/A HIS 126.A NE2 ASP 187.A OD2 no hydrogen 2.770 N/A SER 127.A N ARG 123.A O no hydrogen 2.915 N/A SER 127.A N TYR 124.A O no hydrogen 3.139 N/A SER 127.A OG ARG 123.A O no hydrogen 3.544 N/A SER 127.A OG TYR 124.A O no hydrogen 2.761 N/A MET 128.A N TYR 124.A O no hydrogen 3.186 N/A MET 128.A N ILE 125.A O no hydrogen 3.104 N/A SER 129.A N HIS 126.A O no hydrogen 3.198 N/A LEU 130.A N ILE 125.A O no hydrogen 3.450 N/A VAL 131.A N THR 156.A O no hydrogen 2.800 N/A HIS 132.A N ASP 187.A OD2 no hydrogen 2.806 N/A HIS 132.A NE2 GLY 150.A O no hydrogen 2.884 N/A MET 133.A N ASP 187.A OD1 no hydrogen 2.842 N/A ASP 134.A N HIS 132.A ND1 no hydrogen 3.133 N/A LYS 136.A NZ ASP 167.A OD2 no hydrogen 3.047 N/A ASN 139.A N LYS 136.A O no hydrogen 3.002 N/A ASN 139.A ND2 ASP 134.A O no hydrogen 2.652 N/A ASN 139.A ND2 ASP 134.A OD2 no hydrogen 3.036 N/A ILE 140.A N PRO 137.A O no hydrogen 3.317 N/A PHE 141.A N LYS 148.A O no hydrogen 2.856 N/A ILE 142.A N GLY 90.A O no hydrogen 2.974 N/A SER 143.A N MET 146.A O no hydrogen 3.031 N/A MET 146.A N SER 143.A O no hydrogen 2.876 N/A PHE 147.A N GLN 117.A OE1 no hydrogen 2.804 N/A LYS 148.A N PHE 141.A O no hydrogen 2.760 N/A LYS 148.A NZ SER 65.A O no hydrogen 3.439 N/A LYS 148.A NZ GLU 85.A OE2 no hydrogen 2.735 N/A ILE 149.A N HIS 66.A O no hydrogen 2.893 N/A GLY 150.A N ASN 139.A O no hydrogen 2.837 N/A GLY 153.A N ASP 151.A OD1 no hydrogen 3.302 N/A VAL 155.A N LEU 152.A O no hydrogen 3.261 N/A THR 156.A N VAL 131.A O no hydrogen 3.081 N/A THR 156.A OG1 SER 160.A OG no hydrogen 2.603 N/A ARG 157.A NE SER 129.A O no hydrogen 3.209 N/A ILE 158.A N SER 129.A O no hydrogen 2.741 N/A SER 160.A N ARG 157.A O no hydrogen 3.141 N/A SER 160.A OG THR 156.A OG1 no hydrogen 2.603 N/A SER 160.A OG ARG 157.A O no hydrogen 2.765 N/A ASP 167.A N ASP 134.A OD1 no hydrogen 2.795 N/A SER 168.A OG ARG 206.A O no hydrogen 3.472 N/A ARG 169.A N ASP 167.A OD1 no hydrogen 2.944 N/A ARG 169.A NE ASP 167.A OD1 no hydrogen 3.112 N/A ARG 169.A NH2 ASP 167.A OD2 no hydrogen 2.557 N/A PHE 170.A N ASP 167.A O no hydrogen 3.125 N/A LEU 171.A N SER 168.A O no hydrogen 3.448 N/A GLU 174.A N GLU 174.A OE1 no hydrogen 2.950 N/A VAL 175.A N ALA 172.A O no hydrogen 3.247 N/A LEU 176.A N ALA 172.A O no hydrogen 3.295 N/A GLN 177.A N ASN 173.A O no hydrogen 2.800 N/A GLU 178.A N VAL 175.A O no hydrogen 3.000 N/A ASN 179.A N GLU 174.A O no hydrogen 2.894 N/A THR 181.A N ASN 179.A OD1 no hydrogen 3.248 N/A THR 181.A OG1 ASN 179.A OD1 no hydrogen 2.705 N/A LYS 185.A N HIS 182.A O no hydrogen 3.024 N/A LYS 185.A NZ PRO 242.A O no hydrogen 3.272 N/A LYS 185.A NZ ARG 245.A O no hydrogen 2.879 N/A ALA 186.A N LEU 183.A O no hydrogen 2.980 N/A ASP 187.A N PRO 184.A O no hydrogen 3.088 N/A ILE 188.A N PRO 184.A O no hydrogen 3.348 N/A PHE 189.A N LYS 185.A O no hydrogen 3.030 N/A ALA 190.A N ALA 186.A O no hydrogen 3.102 N/A LEU 191.A N ASP 187.A O no hydrogen 2.873 N/A ALA 192.A N ILE 188.A O no hydrogen 3.116 N/A LEU 193.A N PHE 189.A O no hydrogen 3.283 N/A THR 194.A N ALA 190.A O no hydrogen 2.928 N/A THR 194.A OG1 ALA 190.A O no hydrogen 2.933 N/A VAL 195.A N LEU 191.A O no hydrogen 2.931 N/A VAL 196.A N ALA 192.A O no hydrogen 2.901 N/A CYS 197.A N LEU 193.A O no hydrogen 3.077 N/A CYS 197.A SG LEU 193.A O no hydrogen 3.248 N/A ALA 198.A N THR 194.A O no hydrogen 3.142 N/A ALA 199.A N VAL 195.A O no hydrogen 2.855 N/A GLY 200.A N CYS 197.A O no hydrogen 3.098 N/A ALA 201.A N VAL 196.A O no hydrogen 3.382 N/A TRP 211.A NE1 SER 168.A O no hydrogen 2.761 N/A HIS 212.A N GLY 208.A O no hydrogen 3.374 N/A GLU 213.A N ASP 209.A O no hydrogen 3.091 N/A ILE 214.A N GLN 210.A O no hydrogen 3.395 N/A ARG 215.A N TRP 211.A O no hydrogen 3.264 N/A ARG 215.A NE TRP 211.A O no hydrogen 3.270 N/A ARG 215.A NH1 ARG 169.A O no hydrogen 3.480 N/A ARG 215.A NH1 LEU 171.A O no hydrogen 2.854 N/A ARG 215.A NH2 TRP 211.A O no hydrogen 3.384 N/A GLN 216.A N HIS 212.A O no hydrogen 3.060 N/A GLN 216.A N GLU 213.A O no hydrogen 3.019 N/A GLN 216.A NE2 HIS 212.A O no hydrogen 3.392 N/A GLY 217.A N ILE 214.A O no hydrogen 2.689 N/A GLN 224.A N ILE 222.A O no hydrogen 2.932 N/A GLN 224.A NE2 PHE 106.A O no hydrogen 2.712 N/A GLN 224.A NE2 ALA 199.A O no hydrogen 2.964 N/A SER 227.A N GLU 108.A OE1 no hydrogen 2.823 N/A SER 227.A OG GLU 108.A OE2 no hydrogen 2.704 N/A PHE 230.A N SER 227.A OG no hydrogen 3.106 N/A THR 231.A N SER 227.A O no hydrogen 3.155 N/A THR 231.A OG1 SER 227.A O no hydrogen 3.361 N/A GLU 232.A N GLN 228.A O no hydrogen 3.056 N/A LEU 233.A N GLU 229.A O no hydrogen 3.248 N/A LEU 234.A N PHE 230.A O no hydrogen 3.106 N/A LYS 235.A N THR 231.A O no hydrogen 2.923 N/A VAL 236.A N GLU 232.A O no hydrogen 2.851 N/A MET 237.A N LEU 233.A O no hydrogen 3.157 N/A ILE 238.A N LEU 234.A O no hydrogen 3.310 N/A ILE 238.A N LYS 235.A O no hydrogen 3.197 N/A HIS 239.A N VAL 236.A O no hydrogen 2.999 N/A ASP 241.A N HIS 239.A ND1 no hydrogen 2.980 N/A GLU 243.A N ASP 241.A OD1 no hydrogen 3.103 N/A ARG 244.A N ASP 241.A O no hydrogen 2.928 N/A ARG 245.A N PRO 242.A O no hydrogen 3.064 N/A ARG 245.A NE HIS 239.A O no hydrogen 2.702 N/A ARG 245.A NH1 GLU 174.A OE1 no hydrogen 3.520 N/A ARG 245.A NH1 GLU 174.A OE2 no hydrogen 2.738 N/A ARG 245.A NH1 LYS 185.A O no hydrogen 3.024 N/A ARG 245.A NH2 GLU 174.A OE1 no hydrogen 2.952 N/A ARG 245.A NH2 HIS 239.A O no hydrogen 2.952 N/A ALA 250.A N SER 247.A OG no hydrogen 3.124 N/A LEU 251.A N SER 247.A O no hydrogen 2.915 N/A VAL 252.A N ALA 248.A O no hydrogen 2.955 N/A LYS 253.A N MET 249.A O no hydrogen 3.164 N/A HIS 254.A N LEU 251.A O no hydrogen 3.024 N/A VAL 256.A N HIS 254.A ND1 no hydrogen 3.009 N/A LEU 257.A N HIS 254.A O no hydrogen 2.971 N/A LEU 258.A N SER 255.A O no hydrogen 3.155 N/A