Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1xx4_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): LYS 4.A N GLU 33.A OE2 no hydrogen 3.165 N/A LYS 4.A NZ GLU 29.A OE2 no hydrogen 3.057 N/A ARG 5.A N GLU 33.A OE1 no hydrogen 2.805 N/A ARG 5.A NE GLU 29.A OE1 no hydrogen 2.804 N/A ARG 5.A NH2 GLU 29.A OE1 no hydrogen 3.234 N/A VAL 6.A N GLU 33.A OE2 no hydrogen 3.252 N/A LEU 7.A N LYS 17.A O no hydrogen 2.979 N/A VAL 8.A N ASN 3.A OD1 no hydrogen 2.805 N/A GLU 9.A N VAL 15.A O no hydrogen 2.836 N/A ALA 14.A N GLY 49.A O no hydrogen 3.106 N/A VAL 15.A N GLU 9.A O no hydrogen 3.027 N/A MET 16.A N ILE 51.A O no hydrogen 2.953 N/A LYS 17.A N LEU 7.A O no hydrogen 2.826 N/A LYS 17.A NZ GLU 9.A OE1 no hydrogen 3.173 N/A PHE 18.A N THR 53.A O no hydrogen 2.783 N/A LYS 19.A N ARG 5.A O no hydrogen 2.597 N/A ASN 20.A N ASN 24.A OD1 no hydrogen 2.997 N/A ASN 20.A ND2 SER 25.A O no hydrogen 2.876 N/A ASN 24.A ND2 SER 54.A OG no hydrogen 2.913 N/A ASN 24.A ND2 ILE 59.A O no hydrogen 2.908 N/A ASN 24.A ND2 PHE 60.A O no hydrogen 3.181 N/A LEU 26.A N GLY 63.A O no hydrogen 2.667 N/A SER 27.A N SER 25.A O no hydrogen 3.069 N/A LEU 28.A N GLU 68.A OE1 no hydrogen 3.047 N/A PHE 30.A N SER 27.A OG no hydrogen 3.209 N/A LEU 31.A N SER 27.A O no hydrogen 2.807 N/A THR 32.A N LEU 28.A O no hydrogen 2.967 N/A THR 32.A OG1 LEU 28.A O no hydrogen 2.934 N/A GLU 33.A N GLU 29.A O no hydrogen 2.821 N/A PHE 34.A N PHE 30.A O no hydrogen 2.847 N/A VAL 35.A N LEU 31.A O no hydrogen 3.386 N/A ILE 36.A N THR 32.A O no hydrogen 3.180 N/A SER 37.A N GLU 33.A O no hydrogen 2.926 N/A SER 37.A OG GLU 33.A O no hydrogen 3.096 N/A LEU 38.A N PHE 34.A O no hydrogen 2.799 N/A GLU 39.A N VAL 35.A O no hydrogen 2.935 N/A LYS 40.A N ILE 36.A O no hydrogen 3.277 N/A LEU 41.A N SER 37.A O no hydrogen 3.152 N/A GLU 42.A N LEU 38.A O no hydrogen 2.991 N/A ASN 43.A N GLU 39.A O no hydrogen 3.104 N/A ASP 44.A N LEU 41.A O no hydrogen 3.294 N/A SER 46.A N ASP 44.A OD1 no hydrogen 2.889 N/A SER 46.A OG ASP 44.A OD1 no hydrogen 2.678 N/A ILE 47.A N ASP 44.A O no hydrogen 2.751 N/A ARG 48.A N GLY 12.A O no hydrogen 2.732 N/A ARG 48.A NE ASP 204.A OD1 no hydrogen 2.837 N/A ARG 48.A NE ASP 204.A OD2 no hydrogen 3.449 N/A ARG 48.A NH1 PHE 200.A O no hydrogen 3.383 N/A ARG 48.A NH2 PHE 200.A O no hydrogen 2.706 N/A ARG 48.A NH2 ASP 204.A OD1 no hydrogen 2.783 N/A GLY 49.A N GLY 12.A O no hydrogen 2.952 N/A VAL 50.A N THR 97.A O no hydrogen 2.787 N/A ILE 51.A N ALA 14.A O no hydrogen 2.999 N/A LEU 52.A N ILE 99.A O no hydrogen 2.783 N/A THR 53.A N MET 16.A O no hydrogen 3.042 N/A THR 53.A OG1 SER 54.A O no hydrogen 3.564 N/A THR 53.A OG1 ALA 101.A O no hydrogen 3.002 N/A THR 53.A OG1 HIS 189.A NE2 no hydrogen 3.408 N/A SER 54.A N ASN 103.A OD1 no hydrogen 3.284 N/A SER 54.A OG ARG 56.A O no hydrogen 2.582 N/A SER 54.A OG ILE 59.A O no hydrogen 3.176 N/A GLU 55.A N PHE 18.A O no hydrogen 3.010 N/A ARG 56.A N SER 54.A OG no hydrogen 3.079 N/A GLY 58.A N ASN 103.A O no hydrogen 3.099 N/A PHE 60.A N ALA 105.A O no hydrogen 2.828 N/A SER 61.A N ALA 105.A O no hydrogen 3.347 N/A SER 61.A OG ASN 24.A O no hydrogen 3.000 N/A ALA 62.A N VAL 23.A O no hydrogen 3.100 N/A GLY 63.A N SER 61.A OG no hydrogen 3.056 N/A MET 67.A N ASP 65.A OD1 no hydrogen 2.875 N/A GLU 68.A N ASP 65.A O no hydrogen 2.733 N/A MET 69.A N LEU 66.A O no hydrogen 2.947 N/A TYR 70.A N MET 67.A O no hydrogen 3.225 N/A GLY 71.A N GLN 243.A OE1 no hydrogen 2.488 N/A ARG 72.A N TYR 77.A OH no hydrogen 2.943 N/A HIS 76.A N ASN 73.A O no hydrogen 2.749 N/A HIS 76.A N ASN 73.A OD1 no hydrogen 2.907 N/A HIS 76.A NE2 GLU 68.A O no hydrogen 2.877 N/A TYR 77.A N ASN 73.A O no hydrogen 3.184 N/A ALA 78.A N PRO 74.A O no hydrogen 2.854 N/A GLU 79.A N ALA 75.A O no hydrogen 3.027 N/A TYR 80.A N HIS 76.A O no hydrogen 2.637 N/A TRP 81.A N TYR 77.A O no hydrogen 2.779 N/A TRP 81.A NE1 ASP 229.A OD2 no hydrogen 2.803 N/A LYS 82.A N ALA 78.A O no hydrogen 3.060 N/A ALA 83.A N GLU 79.A O no hydrogen 3.179 N/A VAL 84.A N TYR 80.A O no hydrogen 3.092 N/A GLN 85.A N TRP 81.A O no hydrogen 2.966 N/A GLN 85.A NE2 ARG 226.A O no hydrogen 3.430 N/A GLN 85.A NE2 ASP 229.A OD2 no hydrogen 2.680 N/A GLU 86.A N LYS 82.A O no hydrogen 2.929 N/A LEU 87.A N ALA 83.A O no hydrogen 3.034 N/A TRP 88.A N VAL 84.A O no hydrogen 3.100 N/A TRP 88.A NE1 ASN 148.A OD1 no hydrogen 3.090 N/A LEU 89.A N GLN 85.A O no hydrogen 2.756 N/A ARG 90.A N GLU 86.A O no hydrogen 2.837 N/A ARG 90.A NH2 GLU 42.A OE1 no hydrogen 2.739 N/A LEU 91.A N LEU 87.A O no hydrogen 3.256 N/A TYR 92.A N TRP 88.A O no hydrogen 2.822 N/A LEU 93.A N LEU 89.A O no hydrogen 3.026 N/A SER 94.A N LEU 91.A O no hydrogen 3.286 N/A SER 94.A OG GLU 42.A OE2 no hydrogen 2.663 N/A ASN 95.A N GLU 42.A OE2 no hydrogen 3.301 N/A LEU 96.A N SER 94.A OG no hydrogen 3.131 N/A THR 97.A N ARG 48.A O no hydrogen 3.188 N/A LEU 98.A N ASP 118.A OD2 no hydrogen 2.960 N/A ILE 99.A N VAL 50.A O no hydrogen 2.935 N/A SER 100.A N TYR 119.A O no hydrogen 3.042 N/A ALA 101.A N LEU 52.A O no hydrogen 2.841 N/A ILE 102.A N ILE 121.A O no hydrogen 2.745 N/A ASN 103.A ND2 SER 54.A O no hydrogen 2.867 N/A ALA 105.A N GLY 58.A O no hydrogen 3.010 N/A SER 106.A N THR 129.A O no hydrogen 2.830 N/A ALA 108.A N ASN 133.A OD1 no hydrogen 3.278 N/A GLY 110.A N PRO 107.A O no hydrogen 2.781 N/A CYS 111.A N PRO 107.A O no hydrogen 3.395 N/A LEU 112.A N ALA 108.A O no hydrogen 3.100 N/A LEU 112.A N GLY 109.A O no hydrogen 3.113 N/A ALA 114.A N GLY 110.A O no hydrogen 3.405 N/A LEU 115.A N CYS 111.A O no hydrogen 2.887 N/A THR 116.A N LEU 112.A O no hydrogen 3.091 N/A THR 116.A N MET 113.A O no hydrogen 3.184 N/A THR 116.A OG1 MET 113.A O no hydrogen 2.569 N/A CYS 117.A N ALA 114.A O no hydrogen 3.119 N/A CYS 117.A SG SER 100.A OG no hydrogen 2.972 N/A CYS 117.A SG MET 113.A O no hydrogen 3.361 N/A ASP 118.A N LEU 98.A O no hydrogen 2.795 N/A TYR 119.A OH GLU 181.A OE1 no hydrogen 2.734 N/A ARG 120.A N ASP 180.A OD2 no hydrogen 2.852 N/A ARG 120.A NE LEU 178.A O no hydrogen 2.849 N/A ARG 120.A NH2 ALA 114.A O no hydrogen 3.070 N/A ARG 120.A NH2 CYS 117.A O no hydrogen 3.016 N/A ILE 121.A N SER 100.A O no hydrogen 2.905 N/A MET 122.A N GLU 181.A O no hydrogen 2.960 N/A ALA 123.A N ILE 102.A O no hydrogen 3.051 N/A ASP 124.A N VAL 183.A O no hydrogen 2.747 N/A ASN 125.A N ALA 123.A O no hydrogen 2.663 N/A ASN 125.A ND2 GLU 185.A OE1 no hydrogen 2.923 N/A LYS 127.A N ASN 125.A OD1 no hydrogen 2.865 N/A TYR 128.A N ASN 125.A O no hydrogen 2.736 N/A TYR 128.A OH GLU 185.A OE2 no hydrogen 2.904 N/A ILE 130.A N PHE 168.A O no hydrogen 2.851 N/A GLY 131.A N SER 106.A O no hydrogen 3.362 N/A SER 135.A OG LEU 162.A O no hydrogen 3.219 N/A SER 135.A OG GLN 163.A O no hydrogen 3.179 N/A LEU 136.A N ASN 133.A O no hydrogen 3.225 N/A LEU 137.A N GLU 134.A O no hydrogen 2.691 N/A GLY 138.A N SER 135.A O no hydrogen 3.118 N/A ILE 139.A N GLU 134.A O no hydrogen 3.192 N/A TRP 144.A NE1 ASP 229.A OD2 no hydrogen 2.888 N/A LYS 146.A N PRO 142.A O no hydrogen 2.942 N/A LYS 146.A NZ ASP 147.A OD1 no hydrogen 2.475 N/A ASP 147.A N PHE 143.A O no hydrogen 2.855 N/A ASN 148.A N TRP 144.A O no hydrogen 3.053 N/A ASN 148.A ND2 LEU 115.A O no hydrogen 3.218 N/A TYR 149.A N LEU 145.A O no hydrogen 2.934 N/A VAL 150.A N LYS 146.A O no hydrogen 2.853 N/A ASN 151.A N ASP 147.A O no hydrogen 2.856 N/A ASN 151.A ND2 THR 218.A OG1 no hydrogen 3.143 N/A THR 152.A N TYR 149.A O no hydrogen 2.839 N/A THR 152.A OG1 ASN 148.A O no hydrogen 2.681 N/A ILE 153.A N TYR 149.A O no hydrogen 2.995 N/A GLY 154.A N VAL 150.A O no hydrogen 3.001 N/A ARG 156.A NH1 ARG 156.A O no hydrogen 3.469 N/A ALA 158.A N GLY 154.A O no hydrogen 3.099 N/A GLU 159.A N HIS 155.A O no hydrogen 2.894 N/A ARG 160.A N ARG 156.A O no hydrogen 3.211 N/A ALA 161.A N ALA 157.A O no hydrogen 2.855 N/A LEU 162.A N ALA 158.A O no hydrogen 2.854 N/A GLN 163.A N GLU 159.A O no hydrogen 3.412 N/A LEU 164.A N ARG 160.A O no hydrogen 2.956 N/A GLY 165.A N LEU 162.A O no hydrogen 3.390 N/A THR 166.A N ALA 161.A O no hydrogen 2.848 N/A PHE 168.A N ILE 130.A O no hydrogen 2.813 N/A GLU 172.A N GLU 172.A OE2 no hydrogen 2.395 N/A ALA 173.A N PRO 169.A O no hydrogen 2.834 N/A LEU 174.A N PRO 170.A O no hydrogen 2.907 N/A LYS 175.A N ALA 171.A O no hydrogen 2.968 N/A VAL 176.A N GLU 172.A O no hydrogen 2.963 N/A GLY 177.A N LEU 174.A O no hydrogen 3.005 N/A LEU 178.A N ALA 173.A O no hydrogen 2.873 N/A VAL 179.A N ALA 173.A O no hydrogen 3.389 N/A ASP 180.A N ARG 120.A O no hydrogen 2.838 N/A GLU 181.A N ARG 120.A O no hydrogen 3.250 N/A VAL 183.A N MET 122.A O no hydrogen 3.138 N/A GLN 187.A N PRO 184.A O no hydrogen 2.703 N/A VAL 188.A N GLU 185.A O no hydrogen 3.190 N/A SER 190.A OG GLN 187.A O no hydrogen 2.788 N/A LYS 191.A N GLN 187.A O no hydrogen 2.826 N/A LYS 191.A NZ GLU 181.A OE2 no hydrogen 2.600 N/A ALA 192.A N VAL 188.A O no hydrogen 2.997 N/A ARG 193.A N HIS 189.A O no hydrogen 3.084 N/A SER 194.A N SER 190.A O no hydrogen 2.893 N/A SER 194.A OG SER 190.A O no hydrogen 2.994 N/A VAL 195.A N LYS 191.A O no hydrogen 2.891 N/A MET 196.A N ALA 192.A O no hydrogen 2.911 N/A ALA 197.A N ARG 193.A O no hydrogen 2.921 N/A LYS 198.A N SER 194.A O no hydrogen 3.241 N/A TRP 199.A N VAL 195.A O no hydrogen 3.087 N/A PHE 200.A N MET 196.A O no hydrogen 3.021 N/A PHE 200.A N ALA 197.A O no hydrogen 3.158 N/A THR 201.A N LYS 198.A O no hydrogen 2.838 N/A THR 201.A OG1 LYS 198.A O no hydrogen 2.583 N/A ILE 202.A N TRP 199.A O no hydrogen 3.113 N/A SER 206.A OG PRO 203.A O no hydrogen 3.058 N/A ARG 207.A N PRO 203.A O no hydrogen 3.105 N/A ARG 207.A NH1 ASN 95.A O no hydrogen 3.158 N/A ARG 207.A NH2 ASN 95.A O no hydrogen 3.001 N/A GLN 208.A N ASP 204.A O no hydrogen 2.900 N/A LEU 209.A N HIS 205.A O no hydrogen 3.021 N/A THR 210.A N SER 206.A O no hydrogen 3.038 N/A THR 210.A OG1 SER 206.A O no hydrogen 2.737 N/A LYS 211.A N ARG 207.A O no hydrogen 2.910 N/A LYS 211.A NZ SER 94.A O no hydrogen 2.811 N/A LYS 211.A NZ LEU 96.A O no hydrogen 3.082 N/A LYS 211.A NZ ASP 118.A OD1 no hydrogen 3.237 N/A LYS 211.A NZ ASP 118.A OD2 no hydrogen 2.984 N/A SER 212.A N GLN 208.A O no hydrogen 2.904 N/A MET 213.A N LEU 209.A O no hydrogen 2.888 N/A MET 214.A N THR 210.A O no hydrogen 2.913 N/A ARG 215.A N LYS 211.A O no hydrogen 3.104 N/A ARG 215.A N SER 212.A O no hydrogen 3.316 N/A ARG 215.A NH1 THR 116.A O no hydrogen 3.354 N/A ARG 215.A NH1 CYS 117.A O no hydrogen 3.137 N/A ARG 215.A NH2 TYR 92.A O no hydrogen 2.849 N/A ARG 215.A NH2 THR 116.A O no hydrogen 2.818 N/A LYS 216.A N SER 212.A O no hydrogen 2.959 N/A LYS 216.A NZ SER 212.A OG no hydrogen 2.695 N/A ALA 219.A N ARG 215.A O no hydrogen 3.031 N/A ASP 220.A N LYS 216.A O no hydrogen 2.606 N/A ASN 221.A N ALA 217.A O no hydrogen 2.976 N/A LEU 222.A N ALA 219.A O no hydrogen 2.779 N/A ILE 223.A N ALA 219.A O no hydrogen 2.972 N/A LYS 224.A N ASP 220.A O no hydrogen 3.080 N/A GLN 225.A N LEU 222.A O no hydrogen 3.003 N/A GLN 225.A NE2 ASN 221.A O no hydrogen 2.801 N/A ARG 226.A NE GLN 85.A OE1 no hydrogen 2.867 N/A ARG 226.A NH1 LYS 82.A O no hydrogen 3.035 N/A ARG 226.A NH1 GLU 86.A OE2 no hydrogen 2.741 N/A ARG 226.A NH2 GLU 86.A OE2 no hydrogen 3.095 N/A ASP 229.A N GLN 225.A O no hydrogen 2.971 N/A ILE 230.A N ARG 226.A O no hydrogen 2.970 N/A GLN 231.A N GLU 227.A O no hydrogen 2.892 N/A ASN 232.A N ALA 228.A O no hydrogen 2.922 N/A PHE 233.A N ASP 229.A O no hydrogen 3.025 N/A THR 234.A N ILE 230.A O no hydrogen 2.998 N/A THR 234.A OG1 ILE 230.A O no hydrogen 3.006 N/A SER 235.A N GLN 231.A O no hydrogen 2.893 N/A SER 235.A OG GLN 231.A O no hydrogen 3.127 N/A PHE 236.A N ASN 232.A O no hydrogen 2.925 N/A ILE 237.A N PHE 233.A O no hydrogen 2.786 N/A SER 238.A N THR 234.A O no hydrogen 3.019 N/A SER 238.A N SER 235.A O no hydrogen 3.042 N/A SER 238.A OG THR 234.A O no hydrogen 2.712 N/A ARG 239.A N SER 235.A O no hydrogen 3.248 N/A GLN 243.A N ARG 239.A O no hydrogen 2.626 N/A LYS 244.A N ASP 240.A O no hydrogen 2.817 N/A SER 245.A N SER 241.A O no hydrogen 3.374 N/A SER 245.A OG ILE 242.A O no hydrogen 3.295 N/A LEU 246.A N GLN 243.A O no hydrogen 3.148 N/A HIS 247.A N LYS 244.A O no hydrogen 2.541 N/A VAL 248.A N LYS 244.A O no hydrogen 3.177 N/A TYR 249.A N SER 245.A O no hydrogen 3.246 N/A GLU 251.A N HIS 247.A O no hydrogen 2.737 N/A LYS 252.A N VAL 248.A O no hydrogen 3.249 N/A LEU 253.A N LEU 250.A O no hydrogen 2.778 N/A LYS 254.A NZ GLU 251.A OE1 no hydrogen 2.922 N/A LYS 254.A NZ GLU 251.A OE2 no hydrogen 3.071 N/A