Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 6ks1_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ILE 9.A N HIS 28.A O no hydrogen 2.922 N/A HIS 11.A N LEU 25.A O no hydrogen 2.590 N/A VAL 13.A N PRO 10.A O no hydrogen 3.455 N/A LEU 14.A N HIS 11.A O no hydrogen 3.182 N/A LEU 18.A N PRO 15.A O no hydrogen 3.213 N/A LYS 19.A N ASP 16.A O no hydrogen 3.090 N/A PHE 23.A N ASN 21.A OD1 no hydrogen 3.057 N/A LEU 24.A N ASN 21.A O no hydrogen 3.321 N/A LEU 25.A N ASP 245.A OD1 no hydrogen 3.016 N/A HIS 28.A N ILE 9.A O no hydrogen 3.243 N/A HIS 28.A NE2 LEU 24.A O no hydrogen 2.720 N/A ARG 29.A NH1 SER 41.A OG no hydrogen 2.727 N/A ARG 29.A NH1 THR 106.A O no hydrogen 3.149 N/A ARG 29.A NH2 HIS 105.A O no hydrogen 2.775 N/A ARG 29.A NH2 THR 106.A O no hydrogen 3.561 N/A MET 32.A N CYS 109.A O no hydrogen 2.860 N/A ALA 37.A N SER 34.A OG no hydrogen 3.224 N/A CYS 38.A N SER 34.A O no hydrogen 3.101 N/A CYS 38.A SG MET 32.A O no hydrogen 3.715 N/A CYS 38.A SG SER 34.A O no hydrogen 3.390 N/A PHE 39.A N PHE 35.A O no hydrogen 2.944 N/A LYS 40.A N ARG 36.A O no hydrogen 3.241 N/A SER 41.A N ALA 37.A O no hydrogen 3.144 N/A SER 41.A N CYS 38.A O no hydrogen 3.200 N/A SER 41.A OG CYS 38.A O no hydrogen 2.462 N/A PHE 43.A N LYS 40.A O no hydrogen 3.209 N/A ARG 44.A N SER 41.A O no hydrogen 3.017 N/A ARG 44.A NH2 TRP 6.A O no hydrogen 3.072 N/A HIS 46.A N THR 49.A OG1 no hydrogen 3.051 N/A HIS 46.A NE2 SER 41.A O no hydrogen 2.733 N/A GLU 48.A N HIS 46.A ND1 no hydrogen 3.199 N/A THR 49.A N HIS 46.A O no hydrogen 3.518 N/A THR 49.A OG1 ARG 44.A O no hydrogen 2.622 N/A THR 49.A OG1 HIS 46.A O no hydrogen 3.399 N/A ASN 51.A ND2 GLU 48.A OE1 no hydrogen 2.866 N/A ASN 51.A ND2 HIS 249.A NE2 no hydrogen 3.439 N/A ILE 52.A N GLU 48.A O no hydrogen 3.119 N/A TRP 53.A N THR 49.A O no hydrogen 3.170 N/A TRP 53.A NE1 ILE 42.A O no hydrogen 2.919 N/A THR 54.A N GLY 50.A O no hydrogen 3.080 N/A THR 54.A OG1 GLY 50.A O no hydrogen 2.684 N/A THR 54.A OG1 ASN 51.A O no hydrogen 3.121 N/A THR 54.A OG1 HIS 255.A ND1 no hydrogen 3.256 N/A HIS 55.A ND1 SER 101.A OG no hydrogen 2.698 N/A HIS 55.A NE2 HIS 255.A O no hydrogen 3.116 N/A LEU 56.A N ILE 52.A O no hydrogen 2.805 N/A LEU 57.A N TRP 53.A O no hydrogen 2.977 N/A GLY 58.A N THR 54.A O no hydrogen 3.130 N/A CYS 59.A SG SER 99.A OG no hydrogen 2.779 N/A VAL 60.A N LEU 56.A O no hydrogen 3.363 N/A PHE 61.A N LEU 57.A O no hydrogen 3.166 N/A PHE 62.A N GLY 58.A O no hydrogen 3.188 N/A LEU 63.A N CYS 59.A O no hydrogen 3.003 N/A CYS 64.A N VAL 60.A O no hydrogen 3.024 N/A CYS 64.A SG VAL 60.A O no hydrogen 3.065 N/A LEU 65.A N PHE 61.A O no hydrogen 2.893 N/A GLY 66.A N PHE 62.A O no hydrogen 2.861 N/A ILE 67.A N LEU 63.A O no hydrogen 3.089 N/A PHE 68.A N CYS 64.A O no hydrogen 3.045 N/A TYR 69.A N LEU 65.A O no hydrogen 3.223 N/A MET 70.A N ILE 67.A O no hydrogen 3.141 N/A PHE 71.A N ILE 67.A O no hydrogen 3.284 N/A PHE 71.A N PHE 68.A O no hydrogen 3.188 N/A SER 76.A N PRO 73.A O no hydrogen 3.382 N/A PHE 77.A N ASN 74.A O no hydrogen 3.489 N/A VAL 78.A N GLU 83.A OE2 no hydrogen 3.273 N/A GLU 83.A N ALA 79.A O no hydrogen 2.742 N/A LYS 84.A N PRO 80.A O no hydrogen 3.034 N/A LYS 84.A NZ MET 70.A O no hydrogen 2.944 N/A LYS 84.A NZ ARG 72.A O no hydrogen 3.140 N/A LYS 84.A NZ ASN 74.A OD1 no hydrogen 2.843 N/A VAL 86.A N GLN 82.A O no hydrogen 3.285 N/A PHE 87.A N GLU 83.A O no hydrogen 3.322 N/A GLY 88.A N LYS 84.A O no hydrogen 3.087 N/A LEU 89.A N VAL 85.A O no hydrogen 2.887 N/A PHE 90.A N VAL 86.A O no hydrogen 3.381 N/A PHE 91.A N PHE 87.A O no hydrogen 2.857 N/A LEU 92.A N GLY 88.A O no hydrogen 2.581 N/A GLY 93.A N LEU 89.A O no hydrogen 3.220 N/A ALA 94.A N PHE 90.A O no hydrogen 2.941 N/A ILE 95.A N PHE 91.A O no hydrogen 2.891 N/A LEU 96.A N LEU 92.A O no hydrogen 3.077 N/A CYS 97.A N GLY 93.A O no hydrogen 3.117 N/A LEU 98.A N ALA 94.A O no hydrogen 3.245 N/A SER 99.A N ILE 95.A O no hydrogen 2.851 N/A SER 99.A OG ILE 95.A O no hydrogen 2.725 N/A PHE 100.A N LEU 96.A O no hydrogen 2.798 N/A SER 101.A N CYS 97.A O no hydrogen 3.132 N/A SER 101.A OG HIS 55.A ND1 no hydrogen 2.698 N/A TRP 102.A N LEU 98.A O no hydrogen 3.189 N/A LEU 103.A N SER 99.A O no hydrogen 3.168 N/A PHE 104.A N PHE 100.A O no hydrogen 3.041 N/A HIS 105.A N SER 101.A O no hydrogen 2.925 N/A HIS 105.A ND1 GLU 48.A OE1 no hydrogen 2.626 N/A THR 106.A N TRP 102.A O no hydrogen 3.063 N/A THR 106.A N LEU 103.A O no hydrogen 3.261 N/A THR 106.A OG1 TRP 102.A O no hydrogen 2.643 N/A VAL 107.A N LEU 103.A O no hydrogen 3.088 N/A HIS 110.A N VAL 107.A O no hydrogen 3.226 N/A HIS 110.A ND1 SER 111.A OG no hydrogen 3.200 N/A SER 111.A OG HIS 110.A ND1 no hydrogen 3.200 N/A SER 115.A N SER 111.A O no hydrogen 2.890 N/A SER 115.A OG TYR 108.A O no hydrogen 3.206 N/A ARG 116.A N GLU 112.A O no hydrogen 3.077 N/A LEU 117.A N GLY 113.A O no hydrogen 3.143 N/A PHE 118.A N VAL 114.A O no hydrogen 3.071 N/A SER 119.A N SER 115.A O no hydrogen 2.986 N/A SER 119.A OG SER 115.A O no hydrogen 3.402 N/A SER 119.A OG ARG 116.A O no hydrogen 2.796 N/A LYS 120.A N ARG 116.A O no hydrogen 3.279 N/A LEU 121.A N LEU 117.A O no hydrogen 3.270 N/A ASP 122.A N PHE 118.A O no hydrogen 2.943 N/A TYR 123.A N SER 119.A O no hydrogen 2.893 N/A SER 124.A N LYS 120.A O no hydrogen 2.936 N/A SER 124.A OG LYS 120.A O no hydrogen 2.878 N/A GLY 125.A N LEU 121.A O no hydrogen 3.004 N/A LEU 128.A N SER 124.A O no hydrogen 3.112 N/A LEU 129.A N GLY 125.A O no hydrogen 2.953 N/A ILE 130.A N ILE 126.A O no hydrogen 3.087 N/A MET 131.A N ALA 127.A O no hydrogen 2.897 N/A GLY 132.A N LEU 128.A O no hydrogen 2.830 N/A SER 133.A N LEU 129.A O no hydrogen 2.918 N/A SER 133.A OG LEU 129.A O no hydrogen 3.104 N/A SER 133.A OG ILE 130.A O no hydrogen 2.355 N/A PHE 134.A N ILE 130.A O no hydrogen 3.300 N/A PHE 134.A N MET 131.A O no hydrogen 3.122 N/A LEU 138.A N PHE 134.A O no hydrogen 2.949 N/A TYR 139.A N VAL 135.A O no hydrogen 3.174 N/A SER 141.A N TRP 137.A O.A no hydrogen 3.447 N/A SER 141.A N TRP 137.A O.B no hydrogen 3.378 N/A SER 141.A OG TRP 137.A O.A no hydrogen 3.540 N/A PHE 142.A N LEU 138.A O no hydrogen 3.028 N/A ASN 145.A N PHE 142.A O no hydrogen 3.385 N/A CYS 149.A N ASN 145.A O no hydrogen 3.421 N/A PHE 150.A N PRO 146.A O no hydrogen 3.023 N/A PHE 150.A N GLN 147.A O no hydrogen 3.241 N/A ILE 151.A N GLN 147.A O no hydrogen 3.152 N/A TYR 152.A N PRO 148.A O no hydrogen 3.194 N/A TYR 152.A OH HIS 198.A ND1 no hydrogen 2.909 N/A LEU 153.A N CYS 149.A O no hydrogen 3.314 N/A ILE 154.A N PHE 150.A O no hydrogen 3.279 N/A ILE 154.A N ILE 151.A O no hydrogen 2.900 N/A VAL 155.A N ILE 151.A O no hydrogen 2.970 N/A ILE 156.A N TYR 152.A O no hydrogen 3.387 N/A CYS 157.A SG LEU 153.A O no hydrogen 3.121 N/A VAL 158.A N ILE 154.A O no hydrogen 2.905 N/A LEU 159.A N VAL 155.A O no hydrogen 2.846 N/A GLY 160.A N ILE 156.A O no hydrogen 2.771 N/A ILE 161.A N CYS 157.A O no hydrogen 2.922 N/A ALA 162.A N VAL 158.A O no hydrogen 3.249 N/A ALA 163.A N LEU 159.A O no hydrogen 2.834 N/A ILE 164.A N GLY 160.A O no hydrogen 2.885 N/A ILE 165.A N ILE 161.A O no hydrogen 2.875 N/A VAL 166.A N ALA 162.A O no hydrogen 2.894 N/A SER 167.A N ALA 163.A O no hydrogen 3.315 N/A SER 167.A OG ALA 163.A O no hydrogen 3.030 N/A GLN 168.A N ILE 165.A O no hydrogen 3.094 N/A GLN 168.A NE2 ILE 164.A O no hydrogen 2.847 N/A TRP 169.A N VAL 166.A O no hydrogen 3.253 N/A MET 171.A N ASP 170.A OD2 no hydrogen 2.724 N/A ALA 173.A N ASP 170.A O no hydrogen 3.082 N/A THR 174.A N MET 171.A O no hydrogen 3.387 N/A THR 174.A OG1 MET 171.A O no hydrogen 2.743 N/A TYR 177.A N THR 174.A O no hydrogen 3.064 N/A ARG 178.A N PRO 175.A O no hydrogen 3.420 N/A ARG 181.A N TYR 177.A O no hydrogen 2.803 N/A ARG 181.A NE TYR 231.A OH no hydrogen 3.393 N/A ARG 181.A NH1 PHE 172.A O no hydrogen 2.983 N/A ARG 181.A NH1 THR 174.A O no hydrogen 2.829 N/A ARG 181.A NH2 TYR 231.A OH no hydrogen 2.648 N/A ALA 182.A N ARG 178.A O no hydrogen 3.155 N/A GLY 183.A N GLY 179.A O no hydrogen 3.183 N/A VAL 184.A N VAL 180.A O no hydrogen 3.019 N/A PHE 185.A N ARG 181.A O no hydrogen 3.306 N/A LEU 186.A N ALA 182.A O no hydrogen 2.947 N/A GLY 187.A N GLY 183.A O no hydrogen 2.740 N/A LEU 188.A N VAL 184.A O no hydrogen 3.039 N/A GLY 189.A N PHE 185.A O no hydrogen 3.168 N/A LEU 190.A N LEU 186.A O no hydrogen 2.838 N/A GLY 192.A N GLY 189.A O no hydrogen 3.272 N/A ILE 193.A N LEU 190.A O no hydrogen 3.245 N/A ILE 194.A N SER 191.A O no hydrogen 3.276 N/A THR 196.A N GLY 192.A O no hydrogen 3.071 N/A THR 196.A OG1 GLY 192.A O no hydrogen 2.443 N/A LEU 197.A N ILE 193.A O no hydrogen 2.943 N/A HIS 198.A N ILE 194.A O no hydrogen 3.069 N/A TYR 199.A N PRO 195.A O no hydrogen 2.958 N/A TYR 199.A OH GLU 203.A OE2 no hydrogen 2.753 N/A VAL 200.A N THR 196.A O no hydrogen 2.947 N/A ILE 201.A N LEU 197.A O no hydrogen 3.013 N/A SER 202.A N HIS 198.A O no hydrogen 3.300 N/A GLU 203.A N TYR 199.A O no hydrogen 2.970 N/A GLY 204.A N VAL 200.A O no hydrogen 2.772 N/A ALA 208.A N GLY 204.A O no hydrogen 3.050 N/A ALA 209.A N PHE 205.A O no hydrogen 2.895 N/A THR 210.A N LEU 206.A O no hydrogen 2.621 N/A THR 210.A OG1 LEU 206.A O no hydrogen 2.442 N/A THR 210.A OG1 LYS 207.A O no hydrogen 2.786 N/A ILE 211.A N LYS 207.A O no hydrogen 3.089 N/A GLY 212.A N ALA 209.A O no hydrogen 2.954 N/A GLN 213.A N ALA 208.A O no hydrogen 2.916 N/A GLN 213.A NE2 SER 141.A OG no hydrogen 2.523 N/A ILE 214.A N ALA 208.A O no hydrogen 3.448 N/A TRP 216.A N.B GLN 213.A O no hydrogen 3.021 N/A TRP 216.A NE1.B VAL 264.A O no hydrogen 2.318 N/A LEU 217.A N GLN 213.A O no hydrogen 2.972 N/A LEU 219.A N GLY 215.A O no hydrogen 3.349 N/A MET 220.A N TRP 216.A O.A no hydrogen 2.879 N/A MET 220.A N TRP 216.A O.B no hydrogen 2.988 N/A ALA 221.A N LEU 217.A O no hydrogen 2.458 N/A SER 222.A N MET 218.A O no hydrogen 3.011 N/A SER 222.A OG MET 218.A O no hydrogen 2.636 N/A SER 222.A OG LEU 219.A O no hydrogen 2.603 N/A LEU 223.A N LEU 219.A O no hydrogen 2.982 N/A TYR 224.A N MET 220.A O no hydrogen 2.776 N/A ILE 225.A N ALA 221.A O no hydrogen 2.907 N/A THR 226.A N SER 222.A O no hydrogen 2.722 N/A THR 226.A OG1 SER 222.A O no hydrogen 2.939 N/A GLY 227.A N LEU 223.A O no hydrogen 3.009 N/A ALA 228.A N TYR 224.A O no hydrogen 3.110 N/A ALA 229.A N ILE 225.A O no hydrogen 2.803 N/A LEU 230.A N THR 226.A O no hydrogen 3.025 N/A TYR 231.A N GLY 227.A O no hydrogen 3.223 N/A ALA 232.A N ALA 228.A O no hydrogen 2.983 N/A ALA 233.A N ALA 229.A O no hydrogen 3.214 N/A ARG 234.A N LEU 230.A O no hydrogen 2.802 N/A ARG 234.A NH1 ASN 21.A OD1 no hydrogen 2.810 N/A ILE 235.A N LEU 230.A O no hydrogen 3.416 N/A GLU 237.A N GLU 237.A OE1 no hydrogen 2.887 N/A ARG 238.A N ARG 234.A O no hydrogen 2.781 N/A ARG 238.A NE ALA 233.A O no hydrogen 2.795 N/A PHE 239.A N PRO 236.A O no hydrogen 3.047 N/A PHE 240.A N PRO 236.A O no hydrogen 3.255 N/A LYS 243.A N PHE 240.A O no hydrogen 3.491 N/A CYS 244.A SG PHE 248.A O no hydrogen 4.040 N/A PHE 248.A N GLN 252.A OE1 no hydrogen 2.855 N/A SER 250.A N GLU 237.A OE1 no hydrogen 2.600 N/A SER 250.A OG GLU 237.A OE2 no hydrogen 2.665 N/A GLN 252.A NE2 ILE 246.A O no hydrogen 2.861 N/A LEU 253.A N HIS 249.A O no hydrogen 3.109 N/A PHE 254.A N SER 250.A O no hydrogen 2.874 N/A HIS 255.A N HIS 251.A O no hydrogen 3.101 N/A HIS 255.A ND1 THR 54.A OG1 no hydrogen 3.256 N/A ILE 256.A N GLN 252.A O no hydrogen 3.231 N/A PHE 257.A N LEU 253.A O no hydrogen 2.887 N/A VAL 258.A N PHE 254.A O no hydrogen 3.122 N/A VAL 258.A N HIS 255.A O no hydrogen 3.236 N/A VAL 259.A N HIS 255.A O no hydrogen 3.241 N/A ALA 260.A N ILE 256.A O no hydrogen 2.973 N/A GLY 261.A N PHE 257.A O no hydrogen 2.912 N/A ALA 262.A N VAL 258.A O no hydrogen 2.855 N/A PHE 263.A N VAL 259.A O no hydrogen 3.106 N/A VAL 264.A N ALA 260.A O no hydrogen 2.816 N/A HIS 265.A N GLY 261.A O no hydrogen 2.917 N/A PHE 266.A N ALA 262.A O no hydrogen 2.923 N/A HIS 267.A N PHE 263.A O no hydrogen 2.937 N/A GLY 268.A N VAL 264.A O no hydrogen 3.147 N/A GLY 268.A N HIS 265.A O no hydrogen 3.147 N/A VAL 269.A N HIS 265.A O no hydrogen 3.228 N/A SER 270.A N PHE 266.A O no hydrogen 2.957 N/A ASN 271.A N HIS 267.A O no hydrogen 3.248 N/A LEU 272.A N GLY 268.A O no hydrogen 3.120 N/A GLN 273.A N VAL 269.A O no hydrogen 3.245 N/A GLU 274.A N SER 270.A O no hydrogen 3.222 N/A PHE 275.A N ASN 271.A O no hydrogen 2.898 N/A ARG 276.A N LEU 272.A O no hydrogen 3.241 N/A ARG 276.A NH2 GLY 280.A O no hydrogen 3.322 N/A PHE 277.A N GLN 273.A O no hydrogen 3.029 N/A ILE 279.A N ARG 276.A O no hydrogen 3.242 N/A GLY 280.A N ARG 276.A O no hydrogen 2.762 N/A CYS 283.A SG GLY 281.A O no hydrogen 2.998 N/A