Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 8spk_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLY 1.A N ASP 237.A OD1 no hydrogen 3.152 N/A HIS 3.A N ASN 235.A O no hydrogen 3.070 N/A MET 4.A N GLY 1.A O no hydrogen 2.485 N/A ILE 7.A N MET 4.A O no hydrogen 2.896 N/A LYS 11.A N ALA 8.A O no hydrogen 2.961 N/A ILE 12.A N ASP 9.A O no hydrogen 2.974 N/A THR 13.A N LYS 11.A O no hydrogen 3.112 N/A ALA 16.A N THR 13.A OG1 no hydrogen 2.989 N/A LEU 17.A N THR 13.A O no hydrogen 2.991 N/A SER 18.A N ALA 14.A O no hydrogen 2.919 N/A SER 18.A OG ALA 14.A O no hydrogen 2.962 N/A THR 20.A N ASP 19.A OD1 no hydrogen 2.721 N/A ARG 21.A N GLU 219.A OE2 no hydrogen 3.023 N/A ASN 23.A N THR 20.A O no hydrogen 3.053 N/A ASN 23.A ND2 THR 20.A O no hydrogen 2.680 N/A PHE 26.A N SER 83.A O no hydrogen 2.910 N/A SER 27.A N ASN 51.A OD1 no hydrogen 3.094 N/A SER 27.A OG.B THR 50.A OG1 no hydrogen 2.572 N/A ARG 29.A N TYR 48.A O no hydrogen 2.926 N/A LYS 31.A N ILE 46.A O no hydrogen 2.799 N/A LYS 31.A NZ ASP 117.A OD1 no hydrogen 2.903 N/A LYS 31.A NZ ASP 117.A OD2 no hydrogen 3.229 N/A LYS 31.A NZ THR 119.A OG1 no hydrogen 2.759 N/A ILE 33.A N GLY 44.A O no hydrogen 2.793 N/A SER 34.A OG SER 37.A OG no hydrogen 3.041 N/A ARG 35.A NH1 ASN 94.A O no hydrogen 2.972 N/A ARG 35.A NH2 ASN 94.A O no hydrogen 2.797 N/A SER 37.A N SER 34.A OG no hydrogen 2.982 N/A SER 37.A OG SER 34.A OG no hydrogen 3.041 N/A ALA 38.A N SER 34.A O no hydrogen 3.092 N/A GLY 42.A N ASN 92.A O no hydrogen 2.801 N/A GLY 44.A N ILE 33.A O no hydrogen 2.867 N/A THR 45.A N THR 90.A O no hydrogen 2.844 N/A THR 45.A OG1 GLU 71.A OE2 no hydrogen 2.648 N/A ILE 46.A N LYS 31.A O no hydrogen 2.848 N/A HIS 47.A N VAL 88.A O no hydrogen 2.697 N/A HIS 47.A NE2 THR 90.A OG1 no hydrogen 3.183 N/A TYR 48.A N ARG 29.A O no hydrogen 2.918 N/A THR 50.A N SER 27.A O no hydrogen 2.837 N/A THR 50.A OG1 SER 27.A O no hydrogen 3.391 N/A CYS 55.A N ALA 52.A O no hydrogen 2.830 N/A CYS 55.A SG ALA 52.A O no hydrogen 3.249 N/A GLY 56.A N SER 53.A O no hydrogen 3.288 N/A LEU 58.A N MET 123.A O no hydrogen 2.772 N/A ALA 60.A N ARG 128.A O no hydrogen 3.067 N/A ILE 61.A N VAL 87.A O no hydrogen 2.814 N/A ALA 62.A N GLY 130.A O no hydrogen 3.040 N/A VAL 63.A N ILE 89.A O no hydrogen 2.857 N/A VAL 64.A N ILE 132.A O no hydrogen 2.938 N/A GLY 66.A N SER 69.A OG no hydrogen 2.952 N/A VAL 68.A N ILE 96.A O no hydrogen 2.868 N/A SER 69.A N GLY 66.A O no hydrogen 3.215 N/A SER 69.A OG GLY 66.A O no hydrogen 2.891 N/A SER 69.A OG SER 73.A OG no hydrogen 3.424 N/A GLU 71.A N ASN 92.A OD1 no hydrogen 2.815 N/A SER 73.A N TYR 70.A O no hydrogen 2.912 N/A SER 73.A OG SER 69.A OG no hydrogen 3.424 N/A SER 73.A OG TYR 70.A O no hydrogen 2.818 N/A ILE 74.A N GLU 71.A O no hydrogen 2.897 N/A TRP 77.A N ILE 74.A O no hydrogen 3.211 N/A GLY 78.A N LYS 75.A O no hydrogen 2.888 N/A ARG 80.A N TRP 76.A O no hydrogen 3.457 N/A ARG 80.A NE SER 223.A OG no hydrogen 2.943 N/A ARG 80.A NH1 ARG 21.A O no hydrogen 3.133 N/A ARG 80.A NH1 ASN 23.A O no hydrogen 3.038 N/A ARG 80.A NH2 LEU 17.A O no hydrogen 2.853 N/A LEU 81.A N TRP 77.A O no hydrogen 2.938 N/A ALA 82.A N GLY 78.A O no hydrogen 2.896 N/A SER 83.A N PRO 79.A O no hydrogen 2.966 N/A SER 83.A OG PRO 79.A O no hydrogen 3.159 N/A SER 83.A OG ARG 80.A O no hydrogen 2.881 N/A TRP 84.A N LEU 81.A O no hydrogen 3.029 N/A GLY 85.A N ALA 82.A O no hydrogen 2.966 N/A PHE 86.A N LEU 81.A O no hydrogen 3.194 N/A VAL 87.A N GLY 59.A O no hydrogen 2.998 N/A VAL 88.A N HIS 47.A O no hydrogen 2.881 N/A ILE 89.A N ILE 61.A O no hydrogen 2.888 N/A THR 90.A N THR 45.A O no hydrogen 2.947 N/A THR 90.A OG1 THR 45.A O no hydrogen 3.484 N/A THR 90.A OG1 HIS 47.A NE2 no hydrogen 3.183 N/A THR 90.A OG1 GLU 71.A OE2 no hydrogen 2.663 N/A ILE 91.A N VAL 63.A O no hydrogen 2.989 N/A ASN 92.A N GLY 43.A O no hydrogen 2.945 N/A THR 93.A OG1 SER 95.A O no hydrogen 2.773 N/A ASN 94.A N GLN 106.A OE1 no hydrogen 2.872 N/A SER 95.A N ASP 98.A OD2 no hydrogen 3.027 N/A TYR 97.A N SER 95.A OG no hydrogen 3.088 N/A ASP 98.A N SER 95.A O no hydrogen 3.018 N/A SER 102.A N ASP 99.A OD1 no hydrogen 2.918 N/A ARG 103.A N ASP 99.A O no hydrogen 2.927 N/A ARG 103.A NE ASP 98.A O no hydrogen 2.839 N/A ARG 103.A NH1 PRO 65.A O no hydrogen 2.804 N/A ARG 103.A NH2 ASP 98.A O no hydrogen 2.872 N/A ALA 104.A N PRO 100.A O no hydrogen 3.025 N/A ALA 105.A N ASP 101.A O no hydrogen 3.236 N/A GLN 106.A N SER 102.A O no hydrogen 3.005 N/A GLN 106.A NE2 ASP 98.A OD2 no hydrogen 2.724 N/A GLN 106.A NE2 SER 102.A O no hydrogen 3.591 N/A GLN 106.A NE2 SER 102.A OG no hydrogen 2.994 N/A LEU 107.A N ARG 103.A O no hydrogen 2.891 N/A ASN 108.A N ALA 104.A O no hydrogen 3.022 N/A ALA 109.A N ALA 105.A O no hydrogen 3.039 N/A ALA 110.A N GLN 106.A O no hydrogen 2.883 N/A LEU 111.A N LEU 107.A O no hydrogen 2.951 N/A ASP 112.A N ASN 108.A O no hydrogen 3.087 N/A ASN 113.A N ALA 109.A O no hydrogen 2.865 N/A MET 114.A N ALA 110.A O no hydrogen 3.107 N/A ILE 115.A N LEU 111.A O no hydrogen 3.064 N/A ALA 116.A N ASP 112.A O no hydrogen 3.125 N/A ASP 117.A N MET 114.A O no hydrogen 3.138 N/A THR 119.A N ASP 117.A OD2 no hydrogen 2.794 N/A VAL 120.A N ASP 117.A OD2 no hydrogen 2.914 N/A GLY 121.A N ASP 117.A O no hydrogen 2.859 N/A MET 123.A N VAL 120.A O no hydrogen 2.878 N/A ILE 124.A N GLY 121.A O no hydrogen 3.178 N/A ASP 125.A N LEU 58.A O no hydrogen 2.917 N/A LYS 127.A N ASP 125.A OD1 no hydrogen 2.942 N/A ARG 128.A N ASP 125.A O no hydrogen 2.944 N/A ARG 128.A NE ASN 235.A OD1 no hydrogen 3.119 N/A ARG 128.A NH1 LEU 57.A O no hydrogen 3.296 N/A ARG 128.A NH1 ASP 125.A OD2 no hydrogen 3.202 N/A ARG 128.A NH2 LEU 57.A O no hydrogen 2.995 N/A ARG 128.A NH2 ASN 235.A OD1 no hydrogen 2.863 N/A LEU 129.A N THR 150.A O no hydrogen 3.092 N/A GLY 130.A N ALA 60.A O no hydrogen 2.843 N/A ALA 131.A N ALA 153.A O no hydrogen 3.193 N/A ILE 132.A N ALA 62.A O no hydrogen 2.919 N/A GLY 133.A N MET 155.A O no hydrogen 3.391 N/A TRP 134.A N VAL 64.A O no hydrogen 3.146 N/A TRP 134.A NE1 HIS 210.A O no hydrogen 2.875 N/A SER 135.A N LEU 157.A O no hydrogen 2.784 N/A SER 135.A OG HIS 210.A NE2 no hydrogen 2.727 N/A GLY 137.A N TRP 134.A O no hydrogen 2.825 N/A GLY 139.A N SER 135.A O no hydrogen 3.176 N/A GLY 140.A N MET 136.A O no hydrogen 2.928 N/A ALA 141.A N GLY 137.A O no hydrogen 2.933 N/A LEU 142.A N GLY 138.A O no hydrogen 3.133 N/A LYS 143.A N GLY 139.A O no hydrogen 2.991 N/A LEU 144.A N GLY 140.A O no hydrogen 2.869 N/A ALA 145.A N ALA 141.A O no hydrogen 3.024 N/A THR 146.A N LYS 143.A O no hydrogen 2.972 N/A THR 146.A OG1 LYS 143.A O no hydrogen 2.712 N/A GLU 147.A N LEU 144.A O no hydrogen 2.915 N/A ARG 148.A N LEU 144.A O no hydrogen 2.963 N/A ARG 148.A NE THR 150.A OG1 no hydrogen 3.089 N/A ARG 148.A NH1 ASN 108.A OD1 no hydrogen 2.849 N/A ARG 148.A NH1 ASP 112.A OD1 no hydrogen 2.954 N/A ARG 148.A NH2 ASP 112.A OD1 no hydrogen 3.041 N/A VAL 151.A N ARG 148.A O no hydrogen 3.163 N/A ARG 152.A N LEU 129.A O no hydrogen 2.685 N/A ARG 152.A NE TYR 233.A O no hydrogen 2.965 N/A ARG 152.A NH2 ASN 236.A OD1 no hydrogen 3.082 N/A ILE 154.A N PRO 171.A O no hydrogen 2.970 N/A MET 155.A N ALA 131.A O no hydrogen 2.943 N/A LEU 157.A N GLY 133.A O no hydrogen 2.813 N/A ALA 158.A N ILE 175.A O no hydrogen 2.703 N/A TYR 160.A N SER 135.A O no hydrogen 2.990 N/A HIS 161.A NE2 ASP 101.A OD1 no hydrogen 2.804 N/A LYS 163.A N HIS 161.A ND1 no hydrogen 3.133 N/A THR 172.A N PRO 199.A O no hydrogen 3.046 N/A THR 172.A OG1 THR 170.A O no hydrogen 2.793 N/A LEU 173.A N ILE 154.A O no hydrogen 3.016 N/A VAL 174.A N MET 201.A O no hydrogen 2.853 N/A ILE 175.A N PRO 156.A O no hydrogen 2.950 N/A ALA 176.A N VAL 203.A O no hydrogen 2.865 N/A GLU 178.A N VAL 205.A O no hydrogen 2.981 N/A ASP 179.A N GLY 208.A O no hydrogen 2.774 N/A ASP 180.A N CYS 177.A O no hydrogen 3.104 N/A ILE 182.A N ASP 180.A OD1 no hydrogen 2.875 N/A ALA 183.A N ASP 180.A OD1 no hydrogen 2.860 N/A LYS 187.A N GLU 184.A O no hydrogen 3.148 N/A LYS 187.A NZ ASP 162.A OD1 no hydrogen 3.527 N/A LYS 187.A NZ TYR 188.A OH no hydrogen 3.088 N/A TYR 188.A N GLU 184.A O no hydrogen 2.919 N/A TYR 188.A OH ASP 162.A OD1 no hydrogen 2.742 N/A ASN 190.A N THR 185.A O no hydrogen 2.821 N/A PHE 192.A N TYR 188.A O no hydrogen 2.912 N/A TYR 193.A N ALA 189.A O no hydrogen 2.941 N/A LYS 194.A N ASN 190.A O no hydrogen 2.937 N/A ASN 195.A N ALA 191.A O no hydrogen 2.887 N/A ALA 196.A N PHE 192.A O no hydrogen 3.175 N/A ALA 196.A N TYR 193.A O no hydrogen 3.308 N/A ILE 197.A N VAL 168.A O no hydrogen 2.836 N/A LYS 200.A N LYS 262.A O no hydrogen 3.011 N/A LYS 200.A NZ TYR 193.A O no hydrogen 2.858 N/A LYS 200.A NZ ALA 196.A O no hydrogen 2.837 N/A MET 201.A N THR 172.A O no hydrogen 2.994 N/A LYS 202.A N ASP 260.A O no hydrogen 2.800 N/A LYS 202.A NZ ASN 190.A OD1 no hydrogen 3.279 N/A VAL 203.A N VAL 174.A O no hydrogen 2.990 N/A GLU 204.A N ALA 258.A O no hydrogen 2.909 N/A VAL 205.A N ALA 176.A O no hydrogen 2.873 N/A ASN 206.A N ARG 255.A O no hydrogen 2.782 N/A ASN 206.A ND2 PRO 254.A O no hydrogen 2.949 N/A ASN 207.A N GLU 178.A OE1 no hydrogen 2.834 N/A GLY 208.A N VAL 205.A O no hydrogen 3.100 N/A HIS 210.A ND1 ASP 180.A OD2 no hydrogen 2.767 N/A HIS 210.A NE2 SER 135.A OG no hydrogen 2.727 N/A PHE 211.A N SER 209.A OG no hydrogen 3.046 N/A CYS 212.A N SER 209.A O no hydrogen 2.828 N/A CYS 212.A SG ALA 176.A O no hydrogen 3.872 N/A SER 214.A N PHE 211.A O no hydrogen 2.968 N/A SER 214.A OG PHE 211.A O no hydrogen 2.744 N/A TYR 215.A N SER 73.A O no hydrogen 2.860 N/A ARG 216.A NE GLU 219.A OE1 no hydrogen 3.036 N/A ARG 216.A NH2 GLU 219.A OE1 no hydrogen 2.773 N/A PHE 217.A N SER 214.A O no hydrogen 2.885 N/A ASN 218.A ND2 CYS 212.A O no hydrogen 2.748 N/A GLU 219.A N ARG 216.A O no hydrogen 3.278 N/A LEU 222.A N ASN 218.A O no hydrogen 2.918 N/A SER 223.A N GLU 219.A O no hydrogen 2.995 N/A SER 223.A OG GLU 219.A O no hydrogen 2.682 N/A LYS 224.A NZ GLU 248.A OE2 no hydrogen 2.740 N/A GLY 226.A N LEU 222.A O no hydrogen 3.015 N/A ILE 227.A N SER 223.A O no hydrogen 2.853 N/A ALA 228.A N LYS 224.A O no hydrogen 3.038 N/A TRP 229.A N PRO 225.A O no hydrogen 2.889 N/A MET 230.A N GLY 226.A O no hydrogen 3.141 N/A GLN 231.A N ILE 227.A O no hydrogen 2.933 N/A ARG 232.A N ALA 228.A O no hydrogen 2.850 N/A ARG 232.A NH1 ARG 232.A O no hydrogen 2.950 N/A TYR 233.A N TRP 229.A O no hydrogen 2.957 N/A ILE 234.A N MET 230.A O no hydrogen 2.751 N/A ASN 235.A N GLN 231.A O no hydrogen 3.162 N/A ASN 235.A ND2 GLN 231.A OE1 no hydrogen 2.898 N/A ASP 237.A N GLN 231.A O no hydrogen 3.122 N/A ARG 239.A N ASP 237.A OD1 no hydrogen 3.029 N/A ARG 239.A NE ASP 237.A OD1 no hydrogen 3.010 N/A ARG 239.A NE ASP 237.A OD2 no hydrogen 3.473 N/A ARG 239.A NH1 ILE 7.A O no hydrogen 2.660 N/A ARG 239.A NH1 ASP 9.A OD1 no hydrogen 2.933 N/A ARG 239.A NH2 MET 4.A O no hydrogen 2.885 N/A ARG 239.A NH2 ILE 7.A O no hydrogen 3.125 N/A ARG 239.A NH2 ASP 237.A OD2 no hydrogen 2.890 N/A PHE 240.A N ASP 237.A O no hydrogen 3.239 N/A ASP 241.A N THR 238.A O no hydrogen 3.005 N/A LYS 242.A NZ ILE 12.A O no hydrogen 3.441 N/A PHE 243.A N PHE 240.A O no hydrogen 3.140 N/A LEU 244.A N ASP 241.A O no hydrogen 3.098 N/A ASN 247.A N LEU 244.A O no hydrogen 3.000 N/A ASN 247.A ND2 ASP 241.A O no hydrogen 2.957 N/A GLU 248.A N CYS 245.A O no hydrogen 3.393 N/A TYR 250.A N GLU 248.A O no hydrogen 2.920 N/A TYR 250.A OH PHE 243.A O no hydrogen 2.710 N/A SER 251.A N ASN 249.A OD1 no hydrogen 3.147 N/A SER 251.A OG.A ASN 249.A OD1 no hydrogen 2.722 N/A LYS 252.A N ASN 249.A O no hydrogen 3.141 N/A SER 253.A N TYR 250.A O no hydrogen 3.040 N/A ARG 255.A N SER 253.A OG no hydrogen 3.024 N/A ARG 255.A NH2 ASN 218.A OD1 no hydrogen 2.834 N/A ILE 256.A N SER 253.A O no hydrogen 3.078 N/A SER 257.A N GLU 204.A O no hydrogen 2.865 N/A SER 257.A OG GLU 204.A O no hydrogen 3.391 N/A SER 257.A OG GLU 204.A OE1 no hydrogen 2.689 N/A TYR 259.A OH CYS 245.A O no hydrogen 2.703 N/A ASP 260.A N LYS 202.A O no hydrogen 3.041 N/A LYS 262.A N LYS 200.A O no hydrogen 2.877 N/A CYS 264.A SG LYS 200.A O no hydrogen 3.318 N/A CYS 264.A SG LYS 262.A O no hydrogen 3.531 N/A