Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 6y3o_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLY 4.A N GLY 1.A O no hydrogen 3.006 N/A MET 6.A N MET 3.A O no hydrogen 3.052 N/A ARG 8.A NH1 GLU 44.A OE1 no hydrogen 3.514 N/A ARG 8.A NH1 GLU 44.A OE2 no hydrogen 2.912 N/A ARG 8.A NH2 GLU 44.A OE1 no hydrogen 2.786 N/A LEU 11.A N GLU 7.A O no hydrogen 2.902 N/A ILE 12.A N ARG 8.A O no hydrogen 3.036 N/A GLN 13.A N ALA 9.A O no hydrogen 2.920 N/A LYS 14.A N SER 10.A O no hydrogen 2.893 N/A ALA 15.A N LEU 11.A O no hydrogen 2.816 N/A LYS 16.A N ILE 12.A O no hydrogen 3.117 N/A LYS 16.A NZ GLU 43.A OE2 no hydrogen 3.166 N/A LEU 17.A N GLN 13.A O no hydrogen 3.078 N/A ALA 18.A N LYS 14.A O no hydrogen 2.757 N/A GLU 19.A N ALA 15.A O no hydrogen 2.939 N/A GLN 20.A N LYS 16.A O no hydrogen 3.136 N/A GLN 20.A NE2 LYS 16.A O no hydrogen 3.502 N/A ALA 21.A N LEU 17.A O no hydrogen 2.983 N/A GLU 22.A N GLU 19.A O no hydrogen 3.020 N/A ARG 23.A N ALA 18.A O no hydrogen 2.799 N/A ARG 23.A NE ASP 26.A OD2 no hydrogen 2.907 N/A ARG 23.A NH2 ASP 26.A OD2 no hydrogen 2.898 N/A MET 27.A N ARG 23.A O no hydrogen 2.892 N/A ALA 28.A N TYR 24.A O no hydrogen 2.854 N/A ALA 29.A N GLU 25.A O no hydrogen 3.022 N/A PHE 30.A N ASP 26.A O no hydrogen 2.893 N/A MET 31.A N MET 27.A O no hydrogen 2.961 N/A LYS 32.A N ALA 28.A O no hydrogen 2.792 N/A LYS 32.A NZ GLU 36.A OE2 no hydrogen 2.698 N/A GLY 33.A N ALA 29.A O no hydrogen 2.975 N/A ALA 34.A N PHE 30.A O no hydrogen 2.892 N/A VAL 35.A N MET 31.A O no hydrogen 2.849 N/A GLU 36.A N LYS 32.A O no hydrogen 2.957 N/A LYS 37.A N ALA 34.A O no hydrogen 3.102 N/A LYS 37.A NZ MET 3.A O no hydrogen 3.292 N/A LYS 37.A NZ MET 6.A O no hydrogen 2.673 N/A GLY 38.A N VAL 35.A O no hydrogen 2.985 N/A SER 42.A N GLU 44.A OE1 no hydrogen 2.811 N/A GLU 44.A N SER 42.A OG no hydrogen 3.163 N/A ARG 45.A N SER 42.A O no hydrogen 2.855 N/A LEU 47.A N GLU 43.A O no hydrogen 3.011 N/A LEU 48.A N GLU 44.A O no hydrogen 2.979 N/A SER 49.A N ARG 45.A O no hydrogen 3.002 N/A VAL 50.A N ASN 46.A O no hydrogen 2.809 N/A ALA 51.A N LEU 47.A O no hydrogen 3.029 N/A TYR 52.A N LEU 48.A O no hydrogen 3.192 N/A LYS 53.A N SER 49.A O no hydrogen 2.870 N/A ASN 54.A N VAL 50.A O no hydrogen 3.132 N/A ASN 54.A ND2 VAL 50.A O no hydrogen 2.852 N/A VAL 55.A N ALA 51.A O no hydrogen 3.102 N/A VAL 56.A N TYR 52.A O no hydrogen 2.833 N/A GLY 57.A N LYS 53.A O no hydrogen 2.797 N/A GLY 58.A N ASN 54.A O no hydrogen 3.164 N/A GLN 59.A N VAL 55.A O no hydrogen 3.244 N/A ARG 60.A N VAL 56.A O no hydrogen 2.813 N/A ARG 60.A NE GLU 135.A OE1 no hydrogen 3.040 N/A ARG 60.A NH2 GLU 135.A OE1 no hydrogen 3.508 N/A ARG 60.A NH2 GLU 135.A OE2 no hydrogen 3.006 N/A ALA 61.A N GLY 57.A O no hydrogen 3.025 N/A ALA 62.A N GLY 58.A O no hydrogen 3.033 N/A TRP 63.A N GLN 59.A O no hydrogen 2.827 N/A TRP 63.A NE1 GLU 92.A OE2 no hydrogen 2.794 N/A ARG 64.A N ARG 60.A O no hydrogen 2.931 N/A VAL 65.A N ALA 61.A O no hydrogen 3.145 N/A LEU 66.A N ALA 62.A O no hydrogen 2.974 N/A SER 67.A N TRP 63.A O no hydrogen 2.768 N/A SER 68.A N ARG 64.A O no hydrogen 2.989 N/A ILE 69.A N VAL 65.A O no hydrogen 3.072 N/A GLU 70.A N LEU 66.A O no hydrogen 2.855 N/A GLN 71.A N SER 67.A O no hydrogen 2.860 N/A LYS 72.A N SER 68.A O no hydrogen 3.069 N/A SER 73.A N ILE 69.A O no hydrogen 2.966 N/A SER 73.A OG GLU 70.A O no hydrogen 2.743 N/A SER 73.A OG ASN 74.A OD1 no hydrogen 3.292 N/A ASN 74.A N GLN 71.A O no hydrogen 3.115 N/A SER 77.A N GLU 75.A O no hydrogen 2.958 N/A SER 77.A OG LYS 72.A O no hydrogen 2.734 N/A SER 77.A OG GLU 75.A O no hydrogen 3.059 N/A GLY 81.A N GLU 79.A OE2 no hydrogen 2.793 N/A GLU 83.A N GLU 83.A OE1 no hydrogen 2.876 N/A ARG 85.A NH1 GLU 89.A OE2 no hydrogen 3.223 N/A GLU 86.A N PRO 82.A O no hydrogen 2.860 N/A TYR 87.A N GLU 83.A O no hydrogen 2.917 N/A ARG 88.A N VAL 84.A O no hydrogen 2.879 N/A ARG 88.A NE GLU 70.A OE1 no hydrogen 2.654 N/A ARG 88.A NH1 GLU 92.A OE2 no hydrogen 2.905 N/A ARG 88.A NH2 GLU 70.A OE1 no hydrogen 3.348 N/A ARG 88.A NH2 GLU 70.A OE2 no hydrogen 2.814 N/A GLU 89.A N ARG 85.A O no hydrogen 2.832 N/A LYS 90.A N GLU 86.A O no hydrogen 2.918 N/A LYS 90.A NZ GLU 94.A OE2 no hydrogen 3.240 N/A VAL 91.A N TYR 87.A O no hydrogen 3.011 N/A GLU 92.A N ARG 88.A O no hydrogen 2.834 N/A THR 93.A N GLU 89.A O no hydrogen 2.839 N/A THR 93.A OG1 GLU 89.A O no hydrogen 3.002 N/A GLU 94.A N LYS 90.A O no hydrogen 3.078 N/A LEU 95.A N VAL 91.A O no hydrogen 2.894 N/A GLN 96.A N GLU 92.A O no hydrogen 2.852 N/A GLY 97.A N THR 93.A O no hydrogen 2.905 N/A VAL 98.A N GLU 94.A O no hydrogen 3.022 N/A CYS 99.A N LEU 95.A O no hydrogen 2.967 N/A CYS 99.A SG LEU 95.A O no hydrogen 3.498 N/A CYS 99.A SG TYR 129.A O no hydrogen 3.833 N/A ASP 100.A N GLN 96.A O no hydrogen 2.838 N/A THR 101.A N GLY 97.A O no hydrogen 2.906 N/A THR 101.A OG1 GLY 97.A O no hydrogen 2.997 N/A VAL 102.A N VAL 98.A O no hydrogen 3.016 N/A LEU 104.A N THR 101.A O no hydrogen 2.951 N/A LEU 105.A N VAL 102.A O no hydrogen 2.966 N/A SER 107.A N GLY 103.A O no hydrogen 2.827 N/A LEU 109.A N LEU 104.A O no hydrogen 3.304 N/A ILE 110.A N LEU 105.A O no hydrogen 2.968 N/A LYS 111.A NZ HIS 108.A ND1 no hydrogen 2.960 N/A ALA 113.A N ILE 110.A O no hydrogen 2.997 N/A SER 118.A OG ASP 115.A O no hydrogen 2.962 N/A ARG 119.A N ASP 115.A O no hydrogen 2.889 N/A ARG 119.A NE GLU 155.A OE2 no hydrogen 3.509 N/A ARG 119.A NH1 ILE 110.A O no hydrogen 2.886 N/A ARG 119.A NH1 ALA 113.A O no hydrogen 3.005 N/A ARG 119.A NH2 GLU 155.A OE2 no hydrogen 3.241 N/A VAL 120.A N ALA 116.A O no hydrogen 2.839 N/A PHE 121.A N GLU 117.A O no hydrogen 3.348 N/A TYR 122.A N SER 118.A O no hydrogen 2.962 N/A LEU 123.A N ARG 119.A O no hydrogen 2.948 N/A LYS 124.A N VAL 120.A O no hydrogen 2.857 N/A LYS 124.A NZ ASP 128.A OD2 no hydrogen 2.860 N/A MET 125.A N PHE 121.A O no hydrogen 3.037 N/A LYS 126.A N TYR 122.A O no hydrogen 2.850 N/A GLY 127.A N LEU 123.A O no hydrogen 2.920 N/A ASP 128.A N LYS 124.A O no hydrogen 2.822 N/A TYR 129.A N MET 125.A O no hydrogen 2.912 N/A TYR 130.A N LYS 126.A O no hydrogen 3.060 N/A ARG 131.A N GLY 127.A O no hydrogen 2.850 N/A ARG 131.A NE TYR 153.A OH no hydrogen 2.841 N/A ARG 131.A NH2 ASP 128.A OD1 no hydrogen 3.139 N/A ARG 131.A NH2 TYR 153.A OH no hydrogen 3.438 N/A TYR 132.A N ASP 128.A O no hydrogen 2.899 N/A LEU 133.A N TYR 129.A O no hydrogen 3.061 N/A ALA 134.A N TYR 130.A O no hydrogen 2.795 N/A GLU 135.A N ARG 131.A O no hydrogen 2.946 N/A GLU 135.A N TYR 132.A O no hydrogen 3.209 N/A VAL 136.A N LEU 133.A O no hydrogen 3.304 N/A ALA 137.A N ALA 134.A O no hydrogen 3.209 N/A LYS 142.A N GLY 139.A O no hydrogen 3.300 N/A ILE 145.A N ASP 141.A O no hydrogen 2.814 N/A ILE 146.A N LYS 142.A O no hydrogen 2.970 N/A ASP 147.A N LYS 143.A O no hydrogen 2.944 N/A SER 148.A N ARG 144.A O no hydrogen 2.905 N/A SER 148.A OG ARG 144.A O no hydrogen 3.042 N/A ALA 149.A N ILE 145.A O no hydrogen 3.026 N/A ARG 150.A N.A ILE 146.A O no hydrogen 2.922 N/A ARG 150.A N.B ILE 146.A O no hydrogen 2.919 N/A ARG 150.A NE.B ASP 147.A OD1 no hydrogen 2.736 N/A ARG 150.A NH2.B ASP 147.A OD1 no hydrogen 3.226 N/A ARG 150.A NH2.B ASP 147.A OD2 no hydrogen 3.330 N/A SER 151.A N ASP 147.A O no hydrogen 2.811 N/A ALA 152.A N SER 148.A O no hydrogen 3.082 N/A TYR 153.A N ALA 149.A O no hydrogen 2.975 N/A TYR 153.A OH ASP 128.A OD1 no hydrogen 2.595 N/A GLN 154.A N ARG 150.A O.A no hydrogen 2.808 N/A GLN 154.A N ARG 150.A O.B no hydrogen 2.807 N/A GLN 154.A NE2 GLN 154.A O no hydrogen 3.393 N/A GLN 154.A NE2 ASP 158.A OD1 no hydrogen 2.961 N/A GLU 155.A N SER 151.A O no hydrogen 3.018 N/A ALA 156.A N ALA 152.A O no hydrogen 3.049 N/A MET 157.A N TYR 153.A O no hydrogen 2.793 N/A ASP 158.A N GLN 154.A O no hydrogen 2.919 N/A ILE 159.A N GLU 155.A O no hydrogen 3.084 N/A SER 160.A N ALA 156.A O no hydrogen 2.899 N/A SER 160.A OG ALA 156.A O no hydrogen 3.424 N/A SER 160.A OG MET 157.A O no hydrogen 2.956 N/A LYS 161.A N MET 157.A O no hydrogen 2.897 N/A LYS 162.A N ASP 158.A O no hydrogen 3.204 N/A GLU 163.A N ILE 159.A O no hydrogen 2.829 N/A MET 164.A N SER 160.A O no hydrogen 3.056 N/A THR 167.A OG1 ASP 206.A OD2 no hydrogen 2.619 N/A ASN 168.A N PRO 165.A O no hydrogen 3.019 N/A ARG 171.A N ASN 168.A OD1 no hydrogen 3.087 N/A ARG 171.A NH1 MET 164.A O no hydrogen 2.794 N/A LEU 172.A N ASN 168.A O no hydrogen 2.858 N/A GLY 173.A N PRO 169.A O no hydrogen 2.912 N/A LEU 174.A N ILE 170.A O no hydrogen 2.922 N/A ALA 175.A N ARG 171.A O no hydrogen 2.993 N/A LEU 176.A N LEU 172.A O no hydrogen 2.898 N/A ASN 177.A N GLY 173.A O no hydrogen 3.011 N/A ASN 177.A ND2 ASP 128.A OD1 no hydrogen 2.972 N/A ASN 177.A ND2 ASP 128.A OD2 no hydrogen 3.347 N/A PHE 178.A N LEU 174.A O no hydrogen 2.820 N/A SER 179.A N ALA 175.A O no hydrogen 2.878 N/A SER 179.A OG ALA 192.A O no hydrogen 2.724 N/A VAL 180.A N LEU 176.A O no hydrogen 3.005 N/A PHE 181.A N ASN 177.A O no hydrogen 2.824 N/A HIS 182.A N PHE 178.A O no hydrogen 2.938 N/A TYR 183.A N SER 179.A O no hydrogen 3.025 N/A GLU 184.A N VAL 180.A O no hydrogen 2.777 N/A ILE 185.A N PHE 181.A O no hydrogen 2.930 N/A ALA 186.A N PHE 181.A O no hydrogen 2.986 N/A SER 188.A N HIS 182.A O no hydrogen 2.774 N/A SER 188.A OG ALA 186.A O no hydrogen 3.038 N/A ALA 192.A N SER 188.A O no hydrogen 3.000 N/A ILE 193.A N PRO 189.A O no hydrogen 2.912 N/A SER 194.A N GLU 190.A O no hydrogen 2.922 N/A SER 194.A OG.A GLU 190.A O no hydrogen 3.194 N/A LEU 195.A N GLU 191.A O no hydrogen 2.882 N/A ALA 196.A N ALA 192.A O no hydrogen 3.010 N/A LYS 197.A N ILE 193.A O no hydrogen 2.875 N/A THR 198.A N SER 194.A O no hydrogen 2.943 N/A THR 198.A OG1 SER 194.A O no hydrogen 3.341 N/A THR 199.A N LEU 195.A O no hydrogen 2.956 N/A THR 199.A OG1 LEU 195.A O no hydrogen 2.660 N/A PHE 200.A N ALA 196.A O no hydrogen 2.960 N/A ASP 201.A N LYS 197.A O no hydrogen 2.919 N/A GLU 202.A N THR 198.A O no hydrogen 2.971 N/A ALA 203.A N THR 199.A O no hydrogen 3.055 N/A MET 204.A N PHE 200.A O no hydrogen 2.869 N/A ALA 205.A N ASP 201.A O no hydrogen 3.158 N/A ASP 206.A N ALA 203.A O no hydrogen 2.905 N/A LEU 207.A N MET 204.A O no hydrogen 3.308 N/A HIS 208.A ND1 ALA 205.A O no hydrogen 3.196 N/A THR 209.A N ASP 206.A O no hydrogen 3.150 N/A THR 209.A OG1 ASP 206.A O no hydrogen 2.772 N/A THR 209.A OG1 ASP 206.A OD1 no hydrogen 3.568 N/A LEU 210.A N LEU 207.A O no hydrogen 3.091 N/A SER 211.A OG SER 214.A OG no hydrogen 3.270 N/A SER 214.A N SER 211.A OG no hydrogen 3.182 N/A SER 214.A OG SER 211.A OG no hydrogen 3.270 N/A TYR 215.A N SER 211.A O no hydrogen 2.830 N/A LYS 216.A N GLU 212.A O no hydrogen 3.092 N/A ASP 217.A N ASP 213.A O no hydrogen 3.081 N/A SER 218.A N SER 214.A O no hydrogen 2.910 N/A SER 218.A OG THR 167.A O no hydrogen 2.639 N/A SER 218.A OG SER 214.A O no hydrogen 3.254 N/A THR 219.A N TYR 215.A O no hydrogen 2.903 N/A THR 219.A OG1 TYR 215.A O no hydrogen 2.752 N/A THR 219.A OG1 LYS 216.A O no hydrogen 3.339 N/A LEU 220.A N LYS 216.A O no hydrogen 3.120 N/A MET 222.A N SER 218.A O no hydrogen 2.977 N/A GLN 223.A N THR 219.A O no hydrogen 2.931 N/A GLN 223.A NE2 ASP 227.A OD1 no hydrogen 2.884 N/A LEU 224.A N LEU 220.A O no hydrogen 3.443 N/A LEU 225.A N ILE 221.A O no hydrogen 3.098 N/A ARG 226.A N MET 222.A O no hydrogen 2.939 N/A ASP 227.A N GLN 223.A O no hydrogen 2.754 N/A ASN 228.A N LEU 224.A O no hydrogen 3.096 N/A LEU 229.A N LEU 225.A O no hydrogen 2.953 N/A THR 230.A N ARG 226.A O no hydrogen 2.801 N/A THR 230.A OG1 ARG 226.A O no hydrogen 2.979 N/A LEU 231.A N ASP 227.A O no hydrogen 3.087 N/A TRP 232.A N ASN 228.A O no hydrogen 2.853 N/A THR 233.A OG1 LEU 229.A O no hydrogen 2.593 N/A