Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 7skj_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): CYS 3.A SG VAL 245.A O no hydrogen 3.944 N/A PHE 4.A N ASP 224.A O no hydrogen 3.021 N/A VAL 5.A N ASP 35.A O no hydrogen 2.807 N/A GLY 6.A N PHE 226.A O no hydrogen 2.836 N/A GLY 7.A N VAL 37.A O no hydrogen 2.767 N/A ASN 8.A N VAL 228.A O no hydrogen 2.816 N/A TRP 9.A N ALA 39.A O no hydrogen 3.324 N/A LYS 10.A N ASN 8.A OD1 no hydrogen 2.953 N/A LYS 10.A NZ GLU 94.A OE2 no hydrogen 2.747 N/A ASN 12.A ND2 TRP 9.A O no hydrogen 2.953 N/A THR 14.A N SER 17.A OG no hydrogen 2.926 N/A SER 17.A N THR 14.A OG1 no hydrogen 3.241 N/A SER 17.A OG THR 14.A O no hydrogen 3.411 N/A ILE 18.A N THR 14.A O no hydrogen 2.805 N/A VAL 19.A N LYS 15.A O no hydrogen 2.925 N/A ARG 20.A N GLU 16.A O no hydrogen 3.309 N/A ARG 20.A NE ASP 24.A OD1 no hydrogen 3.358 N/A ARG 20.A NE ASP 24.A OD2 no hydrogen 2.684 N/A ARG 20.A NH2 ASP 24.A OD2 no hydrogen 3.503 N/A LEU 21.A N SER 17.A O no hydrogen 2.991 N/A ILE 22.A N ILE 18.A O no hydrogen 2.762 N/A SER 23.A N VAL 19.A O no hydrogen 2.841 N/A ASP 24.A N ARG 20.A O no hydrogen 3.028 N/A LEU 25.A N LEU 21.A O no hydrogen 2.984 N/A ASN 26.A N ILE 22.A O no hydrogen 2.863 N/A ASN 26.A ND2 THR 51.A O no hydrogen 3.072 N/A SER 27.A N SER 23.A O no hydrogen 3.076 N/A SER 27.A N ASP 24.A O no hydrogen 3.279 N/A SER 27.A OG SER 23.A O no hydrogen 3.058 N/A SER 28.A N LEU 25.A O no hydrogen 3.363 N/A SER 28.A OG LEU 25.A O no hydrogen 2.870 N/A GLU 31.A N ASN 243.A OD1 no hydrogen 2.678 N/A ASP 35.A N CYS 3.A O no hydrogen 2.931 N/A VAL 37.A N VAL 5.A O no hydrogen 3.017 N/A VAL 38.A N GLU 57.A O no hydrogen 2.994 N/A ALA 39.A N GLY 7.A O no hydrogen 2.804 N/A TYR 44.A N PRO 41.A O no hydrogen 3.069 N/A ILE 45.A N PHE 42.A O no hydrogen 3.317 N/A GLN 47.A NE2 LYS 15.A O no hydrogen 3.285 N/A VAL 48.A N TYR 44.A O no hydrogen 3.006 N/A LYS 49.A N ILE 45.A O no hydrogen 2.862 N/A SER 50.A N GLU 46.A O no hydrogen 2.932 N/A THR 51.A N GLN 47.A O no hydrogen 3.180 N/A THR 51.A N VAL 48.A O no hydrogen 3.185 N/A THR 51.A OG1 GLN 47.A O no hydrogen 2.826 N/A LEU 52.A N VAL 48.A O no hydrogen 2.842 N/A THR 53.A N ASN 26.A OD1 no hydrogen 2.817 N/A ARG 55.A N THR 53.A OG1 no hydrogen 3.304 N/A ARG 55.A NH1 LEU 30.A O no hydrogen 3.223 N/A ARG 55.A NH1 GLU 31.A O no hydrogen 3.359 N/A ARG 55.A NH2 GLU 31.A O no hydrogen 2.753 N/A ARG 55.A NH2 VAL 34.A O no hydrogen 2.829 N/A ILE 56.A N THR 53.A O no hydrogen 3.069 N/A GLU 57.A N VAL 36.A O no hydrogen 2.956 N/A ALA 59.A N VAL 38.A O no hydrogen 2.744 N/A ALA 60.A N TRP 87.A O no hydrogen 2.915 N/A GLN 61.A NE2 LYS 10.A O no hydrogen 2.955 N/A GLN 61.A NE2 ALA 39.A O no hydrogen 2.856 N/A CYS 63.A SG TRP 64.A O no hydrogen 3.618 N/A TRP 64.A N ILE 75.A O no hydrogen 2.901 N/A GLY 68.A N GLU 78.A OE2 no hydrogen 2.934 N/A PHE 71.A N GLY 69.A O no hydrogen 2.842 N/A GLU 74.A N PHE 71.A O no hydrogen 2.989 N/A SER 76.A N GLN 79.A OE1 no hydrogen 3.043 N/A GLU 78.A N GLU 78.A OE1 no hydrogen 2.773 N/A GLN 79.A N SER 76.A OG no hydrogen 3.174 N/A LEU 80.A N SER 76.A O no hydrogen 3.024 N/A LYS 81.A N ALA 77.A O no hydrogen 2.951 N/A LYS 81.A NZ GLN 116.A O no hydrogen 2.946 N/A ASP 82.A N GLU 78.A O no hydrogen 2.946 N/A ILE 83.A N GLN 79.A O no hydrogen 2.944 N/A GLY 84.A N LEU 80.A O no hydrogen 3.293 N/A GLY 84.A N LYS 81.A O no hydrogen 3.302 N/A CYS 85.A N LEU 80.A O no hydrogen 2.985 N/A LYS 86.A N ILE 58.A O no hydrogen 2.804 N/A TRP 87.A N ILE 58.A O no hydrogen 3.412 N/A TRP 87.A NE1 GLU 57.A OE2 no hydrogen 3.060 N/A VAL 88.A N GLY 119.A O no hydrogen 2.849 N/A ILE 89.A N ALA 60.A O no hydrogen 2.860 N/A LEU 90.A N ILE 121.A O no hydrogen 2.979 N/A GLU 94.A N HIS 92.A ND1 no hydrogen 3.022 N/A ARG 95.A NE GLU 101.A OE2 no hydrogen 2.749 N/A ARG 95.A NH2 GLU 101.A OE2 no hydrogen 3.549 N/A ARG 96.A N HIS 92.A O no hydrogen 2.991 N/A ARG 96.A NE GLY 91.A O no hydrogen 2.809 N/A ARG 96.A NH1 ASN 103.A OD1 no hydrogen 2.853 N/A ARG 96.A NH2 CYS 123.A O no hydrogen 2.887 N/A HIS 97.A N SER 93.A O no hydrogen 2.785 N/A VAL 98.A N GLU 94.A O no hydrogen 2.906 N/A MET 99.A N GLU 94.A O no hydrogen 3.233 N/A GLU 101.A N ARG 95.A O no hydrogen 2.924 N/A PHE 105.A N ASN 102.A OD1 no hydrogen 3.009 N/A ILE 106.A N ASN 102.A O no hydrogen 2.952 N/A GLY 107.A N ASN 103.A O no hydrogen 2.863 N/A LYS 108.A N GLU 104.A O no hydrogen 3.016 N/A LYS 109.A N PHE 105.A O no hydrogen 3.280 N/A LYS 109.A NZ ASN 62.A OD1 no hydrogen 2.772 N/A LYS 109.A NZ CYS 63.A O no hydrogen 3.103 N/A LYS 109.A NZ GLU 101.A OE1 no hydrogen 3.559 N/A LYS 109.A NZ GLU 101.A OE2 no hydrogen 2.759 N/A ALA 110.A N ILE 106.A O no hydrogen 3.006 N/A ALA 111.A N GLY 107.A O no hydrogen 2.930 N/A TYR 112.A N LYS 108.A O no hydrogen 3.004 N/A TYR 112.A OH GLU 78.A OE1 no hydrogen 2.682 N/A ALA 113.A N LYS 109.A O no hydrogen 2.840 N/A SER 114.A N ALA 110.A O no hydrogen 3.053 N/A SER 115.A N ALA 111.A O no hydrogen 3.027 N/A SER 115.A OG TYR 112.A O no hydrogen 2.602 N/A GLN 116.A N TYR 112.A O no hydrogen 3.148 N/A GLN 116.A N ALA 113.A O no hydrogen 3.003 N/A GLN 116.A NE2 SER 115.A OG no hydrogen 3.051 N/A GLY 117.A N SER 114.A O no hydrogen 2.896 N/A VAL 118.A N ALA 113.A O no hydrogen 3.100 N/A GLY 119.A N LYS 86.A O no hydrogen 2.851 N/A ILE 120.A N ASN 156.A O no hydrogen 2.944 N/A ILE 121.A N VAL 88.A O no hydrogen 2.917 N/A ALA 122.A N VAL 158.A O no hydrogen 2.777 N/A CYS 123.A N LEU 90.A O no hydrogen 3.009 N/A CYS 123.A SG LEU 90.A O no hydrogen 3.724 N/A CYS 123.A SG ILE 121.A O no hydrogen 3.927 N/A ILE 124.A N ALA 160.A O no hydrogen 2.977 N/A GLY 125.A N GLN 143.A OE1 no hydrogen 2.745 N/A GLU 126.A N GLU 126.A OE1 no hydrogen 2.835 N/A LEU 127.A N GLU 130.A OE1 no hydrogen 2.714 N/A ARG 131.A N LEU 127.A O no hydrogen 3.046 N/A ARG 131.A NE GLU 126.A OE2 no hydrogen 2.788 N/A ARG 131.A NH2 GLU 126.A OE2 no hydrogen 3.202 N/A ARG 131.A NH2 TYR 161.A OH no hydrogen 3.290 N/A GLU 132.A N LEU 128.A O no hydrogen 2.944 N/A ALA 133.A N GLU 129.A O no hydrogen 2.868 N/A ARG 134.A N ARG 131.A O no hydrogen 2.916 N/A LYS 135.A N GLU 130.A O no hydrogen 2.830 N/A VAL 139.A N LYS 135.A O no hydrogen 2.899 N/A CYS 140.A N THR 136.A O no hydrogen 3.011 N/A CYS 140.A SG THR 136.A O no hydrogen 3.299 N/A PHE 141.A N PHE 137.A O no hydrogen 2.717 N/A GLN 142.A N ASP 138.A O no hydrogen 2.958 N/A GLN 142.A NE2 GLN 142.A O no hydrogen 2.595 N/A GLN 143.A N VAL 139.A O no hydrogen 2.915 N/A GLN 143.A NE2 GLY 125.A O no hydrogen 3.331 N/A LEU 144.A N CYS 140.A O no hydrogen 2.919 N/A LYS 145.A N PHE 141.A O no hydrogen 2.879 N/A LYS 145.A NZ ASP 149.A OD2 no hydrogen 3.008 N/A ALA 146.A N GLN 142.A O no hydrogen 3.162 N/A PHE 147.A N GLN 143.A O no hydrogen 3.252 N/A ALA 148.A N LEU 144.A O no hydrogen 2.753 N/A ASP 149.A N LYS 145.A O no hydrogen 2.764 N/A ALA 150.A N ALA 146.A O no hydrogen 3.321 N/A ALA 150.A N PHE 147.A O no hydrogen 3.169 N/A LEU 151.A N PHE 147.A O no hydrogen 2.895 N/A GLU 155.A N SER 153.A OG no hydrogen 3.061 N/A VAL 158.A N ILE 120.A O no hydrogen 2.827 N/A ILE 159.A N ARG 202.A O no hydrogen 2.956 N/A ALA 160.A N ALA 122.A O no hydrogen 2.864 N/A TYR 161.A N ILE 204.A O no hydrogen 2.831 N/A TYR 161.A OH GLU 126.A OE1 no hydrogen 2.610 N/A TYR 161.A OH GLU 126.A OE2 no hydrogen 3.038 N/A GLU 162.A N ILE 124.A O no hydrogen 2.845 N/A VAL 164.A N GLU 126.A O no hydrogen 3.104 N/A TRP 165.A NE1 GLU 126.A OE2 no hydrogen 3.027 N/A ALA 166.A N PRO 163.A O no hydrogen 2.490 N/A ILE 167.A N VAL 164.A O no hydrogen 3.256 N/A THR 169.A OG1 TRP 165.A O no hydrogen 2.673 N/A GLY 170.A N SER 208.A OG no hydrogen 3.063 N/A LYS 171.A N THR 169.A OG1 no hydrogen 3.249 N/A ALA 173.A N TYR 205.A OH no hydrogen 2.932 N/A THR 174.A N GLN 177.A OE1 no hydrogen 3.047 N/A GLN 177.A N THR 174.A OG1 no hydrogen 3.062 N/A ALA 178.A N THR 174.A O no hydrogen 3.042 N/A GLN 179.A N PRO 175.A O no hydrogen 2.916 N/A GLN 179.A NE2 ASP 222.A OD2 no hydrogen 2.880 N/A GLU 180.A N GLU 176.A O no hydrogen 2.982 N/A VAL 181.A N GLN 177.A O no hydrogen 3.281 N/A HIS 182.A N ALA 178.A O no hydrogen 2.882 N/A HIS 182.A ND1 ASP 222.A O no hydrogen 2.985 N/A ALA 183.A N GLN 179.A O no hydrogen 2.863 N/A ALA 184.A N GLU 180.A O no hydrogen 3.164 N/A ILE 185.A N VAL 181.A O no hydrogen 2.831 N/A ARG 186.A N HIS 182.A O no hydrogen 2.999 N/A ARG 186.A NE ASP 222.A OD1 no hydrogen 2.691 N/A ARG 186.A NH1 ALA 198.A O no hydrogen 2.837 N/A ARG 186.A NH1 THR 201.A O no hydrogen 2.893 N/A ARG 186.A NH2 ASP 222.A O no hydrogen 3.341 N/A ARG 186.A NH2 ASP 224.A OD1 no hydrogen 2.640 N/A ASP 187.A N ALA 183.A O no hydrogen 2.940 N/A TRP 188.A N ALA 184.A O no hydrogen 2.810 N/A LEU 189.A N ILE 185.A O no hydrogen 2.913 N/A ASN 190.A N ARG 186.A O no hydrogen 2.887 N/A LYS 191.A N ASP 187.A O no hydrogen 2.993 N/A ASN 192.A N TRP 188.A O no hydrogen 2.855 N/A VAL 193.A N LEU 189.A O no hydrogen 2.949 N/A SER 194.A N LEU 189.A O no hydrogen 3.015 N/A VAL 197.A N SER 194.A OG no hydrogen 2.966 N/A ALA 198.A N SER 194.A O no hydrogen 2.984 N/A SER 199.A N SER 195.A O no hydrogen 2.959 N/A SER 199.A OG SER 195.A O no hydrogen 2.924 N/A SER 199.A OG GLU 196.A O no hydrogen 3.303 N/A GLU 200.A N GLU 196.A O no hydrogen 2.951 N/A THR 201.A N VAL 197.A O no hydrogen 2.930 N/A THR 201.A OG1 VAL 197.A O no hydrogen 2.680 N/A ARG 202.A NH1 LYS 2.A O no hydrogen 2.851 N/A ARG 202.A NH1 ASP 35.A OD2 no hydrogen 2.783 N/A ARG 202.A NH2 ASP 35.A OD2 no hydrogen 3.272 N/A ILE 203.A N ASP 224.A OD1 no hydrogen 2.870 N/A ILE 204.A N ILE 159.A O no hydrogen 2.757 N/A TYR 205.A N GLY 225.A O no hydrogen 3.003 N/A TYR 205.A OH GLY 207.A O no hydrogen 3.047 N/A GLY 206.A N TYR 161.A O no hydrogen 2.794 N/A SER 208.A OG ALA 166.A O no hydrogen 2.631 N/A ASN 210.A N ASN 213.A OD1 no hydrogen 2.922 N/A SER 212.A N ASN 210.A OD1 no hydrogen 2.708 N/A ASN 213.A N ASN 210.A OD1 no hydrogen 3.005 N/A ASN 213.A ND2 SER 208.A O no hydrogen 3.071 N/A CYS 214.A N ASN 210.A O no hydrogen 3.215 N/A CYS 214.A SG ASN 210.A O no hydrogen 3.530 N/A CYS 214.A SG GLY 211.A O no hydrogen 3.522 N/A CYS 214.A SG SER 240.A O no hydrogen 4.014 N/A LEU 217.A N ASN 213.A O no hydrogen 3.500 N/A ALA 218.A N CYS 214.A O no hydrogen 2.877 N/A LYS 220.A N LEU 217.A O no hydrogen 3.119 N/A ASP 222.A N GLN 179.A OE1 no hydrogen 2.991 N/A ILE 223.A N LYS 220.A O no hydrogen 3.248 N/A ASP 224.A N ILE 203.A O no hydrogen 2.908 N/A PHE 226.A N PHE 4.A O no hydrogen 3.023 N/A LEU 227.A N TYR 205.A O no hydrogen 3.002 N/A VAL 228.A N GLY 6.A O no hydrogen 2.773 N/A SER 232.A N GLY 229.A O no hydrogen 2.895 N/A SER 232.A OG VAL 228.A O no hydrogen 3.520 N/A SER 232.A OG GLY 229.A O no hydrogen 2.865 N/A LEU 233.A N GLY 230.A O no hydrogen 3.116 N/A LYS 234.A N ALA 231.A O no hydrogen 3.207 N/A PHE 238.A N LYS 234.A O no hydrogen 2.943 N/A ALA 239.A N GLY 235.A O no hydrogen 2.924 N/A SER 240.A N PRO 236.A O no hydrogen 3.033 N/A SER 240.A OG ASP 237.A O no hydrogen 2.944 N/A ILE 241.A N ASP 237.A O no hydrogen 3.132 N/A VAL 242.A N PHE 238.A O no hydrogen 2.964 N/A ASN 243.A N ALA 239.A O no hydrogen 2.936 N/A ASN 243.A ND2 LYS 29.A O no hydrogen 2.965 N/A SER 244.A N ILE 241.A O no hydrogen 3.106 N/A SER 244.A OG ILE 241.A O no hydrogen 2.672 N/A VAL 245.A N VAL 242.A O no hydrogen 3.438 N/A