Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 6s50_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLN 2.A NE2 ALA 21.A O no hydrogen 3.150 N/A GLY 4.A N ASP 1.A OD2 no hydrogen 3.077 N/A ILE 5.A N ASP 1.A O no hydrogen 2.900 N/A THR 6.A N GLN 2.A O no hydrogen 3.279 N/A THR 6.A OG1 GLN 2.A O no hydrogen 3.107 N/A GLY 7.A N VAL 19.A O no hydrogen 2.831 N/A TRP 9.A N PHE 17.A O no hydrogen 2.850 N/A TRP 9.A NE1 ILE 5.A O no hydrogen 2.771 N/A TYR 10.A N THR 119.A O no hydrogen 2.793 N/A ASN 11.A N SER 15.A O no hydrogen 3.037 N/A ASN 11.A ND2 ASP 116.A OD2 no hydrogen 3.243 N/A GLN 12.A N GLN 12.A OE1 no hydrogen 2.862 N/A GLN 12.A NE2 HIS 115.A O no hydrogen 3.639 N/A GLN 12.A NE2 ASP 116.A OD1 no hydrogen 2.901 N/A LEU 13.A N ASN 11.A OD1 no hydrogen 2.976 N/A GLY 14.A N ASN 11.A O no hydrogen 2.964 N/A SER 15.A N ASN 11.A OD1 no hydrogen 3.159 N/A THR 16.A N GLU 32.A O no hydrogen 2.806 N/A PHE 17.A N TRP 9.A O no hydrogen 2.970 N/A ILE 18.A N THR 30.A O no hydrogen 3.022 N/A VAL 19.A N GLY 7.A O no hydrogen 2.880 N/A THR 20.A N THR 28.A O no hydrogen 2.860 N/A ALA 21.A N THR 6.A OG1 no hydrogen 2.901 N/A GLY 22.A N ALA 26.A O no hydrogen 2.768 N/A ASP 24.A N ASP 24.A OD1 no hydrogen 2.591 N/A GLY 25.A N GLY 22.A O no hydrogen 3.384 N/A ALA 26.A N ASP 24.A OD1 no hydrogen 3.193 N/A LEU 27.A N GLY 46.A O no hydrogen 2.898 N/A THR 28.A N THR 20.A O no hydrogen 3.146 N/A GLY 29.A N LEU 44.A O no hydrogen 3.160 N/A THR 30.A N ILE 18.A O no hydrogen 3.087 N/A TYR 31.A N TYR 42.A O no hydrogen 2.823 N/A GLU 32.A N THR 16.A O no hydrogen 2.659 N/A SER 33.A OG VAL 35.A O no hydrogen 2.762 N/A ALA 34.A N SER 15.A OG no hydrogen 2.914 N/A VAL 35.A N SER 33.A OG no hydrogen 3.361 N/A GLU 39.A N TYR 42.A OH no hydrogen 2.736 N/A TYR 42.A N TYR 31.A O no hydrogen 2.928 N/A LEU 44.A N GLY 29.A O no hydrogen 3.032 N/A THR 45.A N THR 64.A O no hydrogen 3.199 N/A THR 45.A OG1 LEU 27.A O no hydrogen 3.555 N/A THR 45.A OG1 THR 169.A OG1 no hydrogen 2.670 N/A GLY 46.A N LEU 27.A O no hydrogen 2.929 N/A ARG 47.A N GLY 62.A O no hydrogen 2.976 N/A ARG 47.A NH2 ASP 24.A O no hydrogen 3.034 N/A TYR 48.A N GLY 25.A O no hydrogen 2.925 N/A TYR 48.A OH GLY 22.A O no hydrogen 2.468 N/A ASP 49.A N ALA 60.A O no hydrogen 2.975 N/A ALA 51.A N ASP 49.A OD1 no hydrogen 2.958 N/A SER 57.A N ASP 55.A OD1 no hydrogen 3.173 N/A SER 57.A OG ASP 55.A OD1 no hydrogen 2.679 N/A SER 57.A OG ASP 55.A OD2 no hydrogen 3.309 N/A GLY 58.A N THR 226.A O no hydrogen 2.916 N/A THR 59.A N TYR 84.A O no hydrogen 2.836 N/A LEU 61.A N GLY 82.A O no hydrogen 2.950 N/A GLY 62.A N ARG 47.A O no hydrogen 2.952 N/A TRP 63.A N TRP 80.A O no hydrogen 3.028 N/A THR 64.A N THR 45.A O no hydrogen 2.914 N/A VAL 65.A N THR 78.A O no hydrogen 2.932 N/A TRP 67.A N SER 76.A O no hydrogen 2.852 N/A TRP 67.A NE1 THR 78.A OG1 no hydrogen 2.813 N/A LYS 68.A N ALA 66.A O no hydrogen 2.727 N/A ASN 69.A N ARG 72.A O no hydrogen 2.914 N/A ASN 69.A ND2 GLU 39.A O no hydrogen 2.844 N/A ASN 69.A ND2 ARG 41.A O no hydrogen 2.806 N/A TYR 71.A N ASN 69.A OD1 no hydrogen 2.932 N/A ARG 72.A N ASN 69.A OD1 no hydrogen 3.008 N/A ARG 72.A NH1 GLU 39.A OE1 no hydrogen 2.834 N/A ARG 72.A NH2 ASN 37.A OD1 no hydrogen 3.437 N/A ASN 73.A ND2 ASP 173.A OD1 no hydrogen 3.018 N/A ALA 74.A N TRP 67.A O no hydrogen 2.791 N/A HIS 75.A N ASN 73.A OD1 no hydrogen 2.812 N/A HIS 75.A ND1 ASP 173.A OD2 no hydrogen 2.778 N/A SER 76.A OG ALA 74.A O no hydrogen 3.199 N/A ALA 77.A N THR 99.A O no hydrogen 3.034 N/A THR 78.A N VAL 65.A O no hydrogen 2.871 N/A THR 79.A N LEU 97.A O no hydrogen 2.926 N/A THR 79.A OG1 THR 203.A OG1 no hydrogen 2.918 N/A TRP 80.A N TRP 63.A O no hydrogen 2.884 N/A TRP 80.A NE1 ASP 116.A OD2 no hydrogen 2.829 N/A SER 81.A N GLN 95.A O no hydrogen 2.813 N/A SER 81.A OG LEU 221.A O no hydrogen 3.453 N/A SER 81.A OG THR 223.A OG1 no hydrogen 2.643 N/A GLY 82.A N LEU 61.A O no hydrogen 2.966 N/A GLN 83.A N ASN 93.A O no hydrogen 3.025 N/A GLN 83.A NE2 THR 226.A OG1 no hydrogen 3.165 N/A TYR 84.A N THR 59.A O no hydrogen 2.817 N/A VAL 85.A N ARG 91.A O no hydrogen 2.720 N/A ARG 91.A N VAL 85.A O no hydrogen 2.761 N/A ILE 92.A N PHE 118.A O no hydrogen 2.960 N/A ASN 93.A N GLN 83.A O no hydrogen 3.008 N/A THR 94.A N ASP 116.A O no hydrogen 2.861 N/A THR 94.A OG1 ASP 116.A O no hydrogen 2.758 N/A GLN 95.A N SER 81.A O no hydrogen 2.962 N/A GLN 95.A NE2 GLY 114.A O no hydrogen 3.609 N/A TRP 96.A N GLY 114.A O no hydrogen 2.821 N/A LEU 97.A N THR 79.A O no hydrogen 2.882 N/A LEU 98.A N LEU 112.A O no hydrogen 2.893 N/A THR 99.A N ALA 77.A O no hydrogen 2.955 N/A THR 99.A OG1 THR 111.A OG1 no hydrogen 3.212 N/A THR 99.A OG1 SER 205.A OG no hydrogen 2.647 N/A SER 100.A N SER 110.A O no hydrogen 2.833 N/A GLY 101.A N HIS 75.A O no hydrogen 2.996 N/A THR 102.A N GLN 207.A OE1 no hydrogen 2.750 N/A THR 102.A OG1 THR 103.A O no hydrogen 2.793 N/A ASN 106.A N THR 103.A O no hydrogen 3.044 N/A ALA 107.A N GLU 104.A O no hydrogen 3.466 N/A ALA 109.A N ASN 106.A O no hydrogen 2.874 N/A SER 110.A N ALA 107.A O no hydrogen 2.964 N/A SER 110.A OG ALA 107.A O no hydrogen 2.738 N/A SER 110.A OG THR 111.A OG1 no hydrogen 3.300 N/A THR 111.A OG1 THR 99.A OG1 no hydrogen 3.212 N/A THR 111.A OG1 SER 110.A OG no hydrogen 3.300 N/A LEU 112.A N LEU 98.A O no hydrogen 2.747 N/A GLY 114.A N TRP 96.A O no hydrogen 3.227 N/A ASP 116.A N THR 94.A O no hydrogen 3.079 N/A THR 117.A N GLN 12.A OE1 no hydrogen 2.959 N/A THR 117.A OG1.A ASN 93.A OD1 no hydrogen 3.304 N/A THR 117.A OG1.B ASN 93.A OD1 no hydrogen 3.304 N/A PHE 118.A N ILE 92.A O no hydrogen 2.849 N/A THR 119.A N TYR 10.A O no hydrogen 2.797 N/A THR 119.A OG1 VAL 121.A O no hydrogen 3.110 N/A LYS 120.A NZ GLY 4.A O no hydrogen 2.972 N/A LYS 120.A NZ THR 6.A O no hydrogen 2.978 N/A ILE 129.A N ASP 125.A O no hydrogen 2.789 N/A THR 130.A N GLN 126.A O no hydrogen 3.096 N/A THR 130.A OG1 GLN 126.A O no hydrogen 3.030 N/A GLY 131.A N VAL 143.A O no hydrogen 2.910 N/A TRP 133.A N PHE 141.A O no hydrogen 2.726 N/A TRP 133.A NE1 ILE 129.A O no hydrogen 2.882 N/A TYR 134.A N THR 243.A O no hydrogen 2.710 N/A ALA 135.A N ASP 139.A O no hydrogen 2.904 N/A GLN 136.A N GLN 136.A OE1 no hydrogen 2.811 N/A GLY 138.A N ALA 135.A O no hydrogen 3.083 N/A THR 140.A N VAL 156.A O no hydrogen 2.747 N/A PHE 141.A N TRP 133.A O no hydrogen 3.038 N/A ILE 142.A N THR 154.A O no hydrogen 2.900 N/A VAL 143.A N GLY 131.A O no hydrogen 2.992 N/A THR 144.A N THR 152.A O no hydrogen 2.782 N/A ALA 145.A N THR 130.A OG1 no hydrogen 2.880 N/A GLY 146.A N ALA 150.A O no hydrogen 2.757 N/A ASP 148.A N ASP 148.A OD1 no hydrogen 2.452 N/A GLY 149.A N GLY 146.A O no hydrogen 3.416 N/A ALA 150.A N ASP 148.A OD1 no hydrogen 3.251 N/A LEU 151.A N GLY 170.A O no hydrogen 2.863 N/A THR 152.A N THR 144.A O no hydrogen 3.111 N/A GLY 153.A N LEU 168.A O no hydrogen 3.204 N/A THR 154.A N ILE 142.A O no hydrogen 2.880 N/A TYR 155.A N TYR 166.A O no hydrogen 2.876 N/A VAL 156.A N THR 140.A O no hydrogen 2.607 N/A THR 157.A OG1 ASP 139.A OD2 no hydrogen 3.198 N/A THR 157.A OG1 ARG 159.A O no hydrogen 2.862 N/A ALA 158.A N ASP 139.A OD2 no hydrogen 3.146 N/A ARG 159.A N THR 157.A OG1 no hydrogen 3.388 N/A GLU 163.A N TYR 166.A OH no hydrogen 2.786 N/A TYR 166.A N TYR 155.A O no hydrogen 2.922 N/A LEU 168.A N GLY 153.A O no hydrogen 3.047 N/A THR 169.A N THR 188.A O no hydrogen 3.219 N/A THR 169.A OG1 THR 45.A OG1 no hydrogen 2.670 N/A GLY 170.A N LEU 151.A O no hydrogen 2.918 N/A ARG 171.A N GLY 186.A O no hydrogen 3.036 N/A ARG 171.A NH2 ASP 148.A O no hydrogen 3.049 N/A TYR 172.A N GLY 149.A O no hydrogen 2.900 N/A TYR 172.A OH GLY 146.A O no hydrogen 2.401 N/A ASP 173.A N ALA 184.A O no hydrogen 2.986 N/A ALA 175.A N ASP 173.A OD1 no hydrogen 2.948 N/A SER 181.A N ASP 179.A OD1 no hydrogen 3.212 N/A SER 181.A OG ASP 179.A OD1 no hydrogen 2.923 N/A GLY 182.A N THR 102.A O no hydrogen 2.928 N/A THR 183.A N TYR 208.A O no hydrogen 2.851 N/A THR 183.A OG1 ASP 125.A OD2 no hydrogen 2.422 N/A LEU 185.A N GLY 206.A O no hydrogen 2.934 N/A GLY 186.A N ARG 171.A O no hydrogen 2.994 N/A TRP 187.A N TRP 204.A O no hydrogen 2.967 N/A THR 188.A N THR 169.A O no hydrogen 2.921 N/A VAL 189.A N THR 202.A O no hydrogen 2.881 N/A TRP 191.A N SER 200.A O no hydrogen 2.888 N/A TRP 191.A NE1 THR 202.A OG1 no hydrogen 2.809 N/A LYS 192.A N ALA 190.A O no hydrogen 2.741 N/A ASN 193.A N ARG 196.A O no hydrogen 2.944 N/A ASN 193.A ND2 GLU 163.A O no hydrogen 2.983 N/A ASN 193.A ND2 ARG 165.A O no hydrogen 2.887 N/A TYR 195.A N ASN 193.A OD1 no hydrogen 2.839 N/A ARG 196.A N ASN 193.A OD1 no hydrogen 2.951 N/A ARG 196.A NE GLU 163.A OE1 no hydrogen 2.817 N/A ASN 197.A ND2 ASP 49.A OD1 no hydrogen 2.929 N/A ALA 198.A N TRP 191.A O no hydrogen 2.877 N/A HIS 199.A N ASN 197.A OD1 no hydrogen 2.840 N/A HIS 199.A ND1 ASP 49.A OD2 no hydrogen 2.889 N/A SER 200.A OG ALA 198.A O no hydrogen 3.350 N/A ALA 201.A N THR 223.A O no hydrogen 3.023 N/A THR 202.A N VAL 189.A O no hydrogen 2.879 N/A THR 203.A N LEU 221.A O no hydrogen 2.948 N/A THR 203.A OG1 THR 79.A OG1 no hydrogen 2.918 N/A TRP 204.A N TRP 187.A O no hydrogen 2.901 N/A SER 205.A N GLN 219.A O no hydrogen 2.863 N/A SER 205.A OG LEU 97.A O no hydrogen 3.281 N/A SER 205.A OG THR 99.A OG1 no hydrogen 2.647 N/A GLY 206.A N LEU 185.A O no hydrogen 2.867 N/A GLN 207.A N ASN 217.A O no hydrogen 3.075 N/A GLN 207.A NE2 THR 102.A OG1 no hydrogen 3.184 N/A TYR 208.A N THR 183.A O no hydrogen 2.798 N/A VAL 209.A N ARG 215.A O no hydrogen 2.796 N/A ARG 215.A N VAL 209.A O no hydrogen 2.819 N/A ILE 216.A N PHE 242.A O no hydrogen 2.946 N/A ASN 217.A N GLN 207.A O no hydrogen 3.136 N/A ASN 217.A ND2 THR 241.A OG1 no hydrogen 3.251 N/A THR 218.A N ALA 240.A O no hydrogen 2.788 N/A THR 218.A OG1 ALA 240.A O no hydrogen 2.741 N/A GLN 219.A N SER 205.A O no hydrogen 2.955 N/A GLN 219.A NE2 GLY 238.A O no hydrogen 3.629 N/A TRP 220.A N GLY 238.A O no hydrogen 2.826 N/A LEU 221.A N THR 203.A O no hydrogen 2.925 N/A LEU 222.A N LEU 236.A O no hydrogen 2.837 N/A THR 223.A N ALA 201.A O no hydrogen 2.878 N/A THR 223.A OG1 SER 81.A OG no hydrogen 2.643 N/A THR 223.A OG1 THR 235.A OG1 no hydrogen 3.249 N/A ARG 224.A N SER 234.A O no hydrogen 2.722 N/A GLY 225.A N HIS 199.A O no hydrogen 3.013 N/A THR 226.A N GLN 83.A OE1 no hydrogen 2.820 N/A THR 226.A OG1 THR 227.A O no hydrogen 2.789 N/A ASN 230.A N THR 227.A O no hydrogen 3.110 N/A ALA 231.A N GLU 228.A O no hydrogen 3.423 N/A LYS 233.A N ASN 230.A O no hydrogen 2.979 N/A SER 234.A N ALA 231.A O no hydrogen 2.980 N/A SER 234.A OG ALA 231.A O no hydrogen 2.808 N/A SER 234.A OG THR 235.A OG1 no hydrogen 3.339 N/A THR 235.A OG1 THR 223.A OG1 no hydrogen 3.249 N/A THR 235.A OG1 SER 234.A OG no hydrogen 3.339 N/A LEU 236.A N LEU 222.A O no hydrogen 2.842 N/A GLY 238.A N TRP 220.A O no hydrogen 3.115 N/A ALA 240.A N THR 218.A O no hydrogen 2.907 N/A THR 241.A N GLN 136.A OE1 no hydrogen 3.243 N/A PHE 242.A N ILE 216.A O no hydrogen 2.813 N/A THR 243.A N TYR 134.A O no hydrogen 2.865 N/A THR 243.A OG1 VAL 245.A O no hydrogen 3.056 N/A LYS 244.A NZ GLY 128.A O no hydrogen 2.630 N/A LYS 244.A NZ THR 130.A O no hydrogen 3.263 N/A