Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4rl1_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): VAL 3.A N THR 271.A O no hydrogen 2.773 N/A PHE 4.A N ALA 89.A O no hydrogen 3.041 N/A VAL 5.A N VAL 273.A O no hydrogen 2.924 N/A PHE 6.A N LEU 91.A O no hydrogen 2.850 N/A GLN 9.A NE2 PRO 195.A O no hydrogen 3.164 N/A GLY 10.A N GLN 12.A OE1 no hydrogen 2.881 N/A GLN 12.A N GLN 12.A OE1 no hydrogen 2.848 N/A GLN 12.A NE2 PRO 195.A O no hydrogen 3.322 N/A TRP 13.A NE1 PRO 277.A O no hydrogen 2.793 N/A MET 16.A N TRP 13.A O no hydrogen 3.153 N/A ARG 18.A N GLY 15.A O no hydrogen 2.944 N/A ARG 18.A NH1 GLU 19.A OE2 no hydrogen 2.842 N/A LEU 21.A N GLY 17.A O no hydrogen 2.813 N/A ASP 22.A N ARG 18.A O no hydrogen 3.146 N/A ASP 22.A N GLU 19.A O no hydrogen 3.075 N/A ALA 23.A N GLU 19.A O no hydrogen 3.103 N/A ALA 23.A N LEU 20.A O no hydrogen 3.160 N/A SER 24.A N LEU 20.A O no hydrogen 2.933 N/A PHE 27.A N SER 24.A OG no hydrogen 3.226 N/A ARG 28.A N SER 24.A O no hydrogen 3.091 N/A ARG 28.A NE LEU 21.A O no hydrogen 2.799 N/A ARG 28.A NH1 LEU 21.A O no hydrogen 3.486 N/A GLU 29.A N ASP 25.A O no hydrogen 2.850 N/A SER 30.A N VAL 26.A O no hydrogen 3.045 N/A SER 30.A OG VAL 26.A O no hydrogen 3.210 N/A VAL 31.A N PHE 27.A O no hydrogen 2.893 N/A ARG 32.A N ARG 28.A O no hydrogen 2.900 N/A ARG 32.A NE GLU 47.A OE1 no hydrogen 2.967 N/A ARG 32.A NH1 GLU 47.A OE1 no hydrogen 3.531 N/A ARG 32.A NH1 GLU 47.A OE2 no hydrogen 2.992 N/A ALA 33.A N GLU 29.A O no hydrogen 3.055 N/A CYS 34.A N SER 30.A O no hydrogen 3.056 N/A CYS 34.A SG SER 30.A O no hydrogen 3.479 N/A GLU 35.A N VAL 31.A O no hydrogen 3.030 N/A ALA 36.A N ARG 32.A O no hydrogen 3.128 N/A ALA 37.A N ALA 33.A O no hydrogen 2.927 N/A PHE 38.A N CYS 34.A O no hydrogen 2.739 N/A ALA 39.A N ALA 36.A O no hydrogen 3.371 N/A TYR 41.A N PHE 38.A O no hydrogen 2.733 N/A VAL 42.A N PHE 38.A O no hydrogen 3.199 N/A SER 45.A OG GLU 35.A OE1 no hydrogen 2.786 N/A SER 45.A OG GLU 35.A OE2 no hydrogen 2.860 N/A GLU 47.A N GLU 35.A OE1 no hydrogen 2.910 N/A GLN 48.A N SER 45.A O no hydrogen 3.027 N/A GLN 48.A N SER 45.A OG no hydrogen 3.300 N/A VAL 49.A N SER 45.A O no hydrogen 3.107 N/A LEU 50.A N VAL 46.A O no hydrogen 2.912 N/A ARG 51.A N GLU 47.A O no hydrogen 3.110 N/A ARG 51.A NH1 ASP 22.A OD1 no hydrogen 3.354 N/A ARG 51.A NH1 GLU 47.A OE2 no hydrogen 3.431 N/A ARG 51.A NH2 ASP 22.A OD1 no hydrogen 2.826 N/A ASP 52.A N VAL 49.A O no hydrogen 2.825 N/A SER 53.A N GLN 48.A O no hydrogen 3.163 N/A ASP 55.A N SER 53.A OG no hydrogen 3.294 N/A ALA 56.A N SER 53.A O no hydrogen 2.879 N/A ARG 61.A NE ASP 63.A OD1 no hydrogen 2.821 N/A ARG 61.A NE ASP 63.A OD2 no hydrogen 3.295 N/A ARG 61.A NH1 ASP 63.A OD2 no hydrogen 2.532 N/A VAL 64.A N ARG 61.A O no hydrogen 3.095 N/A VAL 65.A N ARG 61.A O no hydrogen 2.994 N/A GLN 66.A N VAL 62.A O no hydrogen 3.208 N/A GLN 66.A NE2 GLN 9.A OE1 no hydrogen 2.465 N/A GLN 66.A NE2 GLN 123.A OE1 no hydrogen 3.118 N/A THR 68.A N VAL 64.A O no hydrogen 3.076 N/A THR 68.A OG1 VAL 64.A O no hydrogen 2.768 N/A LEU 69.A N VAL 65.A O no hydrogen 2.800 N/A PHE 70.A N GLN 66.A O no hydrogen 2.986 N/A ALA 71.A N PRO 67.A O no hydrogen 3.012 N/A VAL 72.A N THR 68.A O no hydrogen 3.012 N/A MET 73.A N LEU 69.A O no hydrogen 2.853 N/A ILE 74.A N PHE 70.A O no hydrogen 3.120 N/A SER 75.A N ALA 71.A O no hydrogen 3.131 N/A SER 75.A OG ALA 71.A O no hydrogen 2.650 N/A LEU 76.A N VAL 72.A O no hydrogen 2.847 N/A ALA 77.A N MET 73.A O no hydrogen 2.951 N/A ALA 78.A N ILE 74.A O no hydrogen 2.860 N/A LEU 79.A N SER 75.A O no hydrogen 3.095 N/A TRP 80.A N LEU 76.A O no hydrogen 2.971 N/A TRP 80.A NE1 THR 298.A OG1 no hydrogen 2.858 N/A ARG 81.A N ALA 77.A O no hydrogen 2.932 N/A ARG 81.A NE GLU 86.A OE1 no hydrogen 3.443 N/A ARG 81.A NE GLU 86.A OE2 no hydrogen 2.879 N/A ARG 81.A NH1 GLU 86.A OE1 no hydrogen 3.010 N/A ARG 81.A NH2 VAL 103.A O no hydrogen 3.206 N/A SER 82.A N ALA 78.A O no hydrogen 2.830 N/A SER 82.A OG LEU 79.A O no hydrogen 2.614 N/A GLN 83.A N TRP 80.A O no hydrogen 3.071 N/A GLY 84.A N ARG 81.A O no hydrogen 3.021 N/A VAL 85.A N TRP 80.A O no hydrogen 3.277 N/A CYS 88.A N VAL 2.A O no hydrogen 2.808 N/A CYS 88.A SG VAL 2.A O no hydrogen 3.485 N/A VAL 90.A N PRO 227.A O no hydrogen 2.971 N/A LEU 91.A N PHE 4.A O no hydrogen 2.884 N/A GLY 92.A N HIS 229.A O no hydrogen 3.252 N/A HIS 93.A N PHE 6.A O no hydrogen 2.866 N/A HIS 93.A NE2 ASN 163.A OD1 no hydrogen 2.711 N/A SER 94.A OG HIS 201.A NE2 no hydrogen 2.740 N/A GLY 96.A N HIS 93.A O no hydrogen 2.777 N/A GLU 97.A N SER 94.A O no hydrogen 2.881 N/A ILE 98.A N LEU 95.A O no hydrogen 2.918 N/A ALA 100.A N GLY 96.A O no hydrogen 2.792 N/A ALA 101.A N GLU 97.A O no hydrogen 2.763 N/A HIS 102.A N ILE 98.A O no hydrogen 3.100 N/A HIS 102.A ND1 LEU 107.A O no hydrogen 2.892 N/A VAL 103.A N ALA 99.A O no hydrogen 2.986 N/A SER 104.A N ALA 100.A O no hydrogen 2.867 N/A SER 104.A OG ALA 100.A O no hydrogen 3.317 N/A SER 104.A OG ALA 101.A O no hydrogen 2.676 N/A GLY 105.A N HIS 102.A O no hydrogen 3.089 N/A GLY 106.A N SER 104.A OG no hydrogen 3.115 N/A LEU 107.A N ALA 101.A O no hydrogen 3.323 N/A ASP 111.A N SER 108.A OG no hydrogen 3.261 N/A ALA 112.A N SER 108.A O no hydrogen 2.974 N/A ALA 113.A N LEU 109.A O no hydrogen 2.818 N/A ARG 114.A N ALA 110.A O no hydrogen 3.127 N/A ARG 114.A NE GLY 215.A O no hydrogen 2.928 N/A ARG 114.A NH1 GLY 215.A O no hydrogen 3.000 N/A ARG 114.A NH2 TYR 41.A OH no hydrogen 3.154 N/A VAL 115.A N ASP 111.A O no hydrogen 2.945 N/A VAL 116.A N ALA 112.A O no hydrogen 2.953 N/A THR 117.A N ALA 113.A O no hydrogen 3.083 N/A THR 117.A OG1 ALA 113.A O no hydrogen 2.764 N/A THR 117.A OG1 ARG 114.A O no hydrogen 3.262 N/A LEU 118.A N ARG 114.A O no hydrogen 3.010 N/A TRP 119.A N VAL 115.A O no hydrogen 2.866 N/A SER 120.A N VAL 116.A O no hydrogen 3.007 N/A SER 120.A OG VAL 116.A O no hydrogen 2.889 N/A SER 120.A OG THR 117.A O no hydrogen 2.913 N/A GLN 121.A N THR 117.A O no hydrogen 2.841 N/A GLN 121.A NE2 TYR 41.A O no hydrogen 2.824 N/A ALA 122.A N LEU 118.A O no hydrogen 3.019 N/A GLN 123.A N TRP 119.A O no hydrogen 3.296 N/A THR 124.A N SER 120.A O no hydrogen 3.156 N/A THR 124.A N GLN 121.A O no hydrogen 3.244 N/A THR 124.A OG1 GLN 121.A O no hydrogen 2.629 N/A THR 125.A OG1 ALA 122.A O no hydrogen 2.839 N/A LEU 126.A N GLN 123.A O no hydrogen 2.702 N/A ALA 127.A N THR 124.A O no hydrogen 2.969 N/A GLY 128.A N ASP 197.A O no hydrogen 2.665 N/A THR 129.A N LEU 126.A O no hydrogen 2.941 N/A THR 129.A OG1 LEU 126.A O no hydrogen 2.676 N/A GLY 130.A N ASP 197.A O no hydrogen 3.374 N/A ALA 131.A N GLY 172.A O no hydrogen 3.145 N/A VAL 133.A N VAL 170.A O no hydrogen 2.980 N/A SER 134.A N ARG 192.A O no hydrogen 2.786 N/A VAL 135.A N THR 168.A O no hydrogen 2.767 N/A ALA 136.A N ARG 190.A O no hydrogen 2.960 N/A ALA 137.A N VAL 135.A O no hydrogen 2.832 N/A THR 138.A N GLU 141.A OE2 no hydrogen 2.973 N/A GLU 141.A N THR 138.A OG1 no hydrogen 2.988 N/A LEU 142.A N THR 138.A O no hydrogen 3.131 N/A LEU 143.A N PRO 139.A O no hydrogen 2.927 N/A ARG 145.A NH1 ASP 183.A OD2 no hydrogen 2.968 N/A ILE 146.A N LEU 142.A O no hydrogen 2.988 N/A ALA 147.A N PRO 144.A O no hydrogen 3.307 N/A THR 150.A N ILE 146.A O no hydrogen 3.020 N/A THR 150.A OG1 ILE 146.A O no hydrogen 3.196 N/A THR 150.A OG1 ALA 147.A O no hydrogen 2.500 N/A GLU 151.A N ALA 147.A O no hydrogen 2.728 N/A ARG 156.A N TRP 149.A O no hydrogen 3.185 N/A ARG 156.A NH1 GLU 175.A OE1 no hydrogen 2.225 N/A ALA 158.A N SER 171.A O no hydrogen 2.821 N/A ALA 160.A N VAL 169.A O no hydrogen 2.764 N/A ALA 161.A N VAL 169.A O no hydrogen 3.179 N/A VAL 162.A N VAL 255.A O no hydrogen 2.954 N/A ASN 163.A N SER 167.A O no hydrogen 2.917 N/A GLY 164.A N SER 167.A O no hydrogen 3.312 N/A ARG 166.A N GLU 287.A OE1 no hydrogen 3.134 N/A SER 167.A N GLY 164.A O no hydrogen 3.127 N/A SER 167.A OG GLU 287.A OE1 no hydrogen 2.700 N/A THR 168.A N VAL 135.A O no hydrogen 3.010 N/A THR 168.A OG1 ALA 137.A O no hydrogen 2.734 N/A VAL 169.A N ALA 161.A O no hydrogen 2.866 N/A VAL 170.A N VAL 133.A O no hydrogen 2.905 N/A SER 171.A N ALA 158.A O no hydrogen 2.958 N/A SER 171.A OG ALA 200.A O no hydrogen 2.777 N/A SER 171.A OG HIS 201.A O no hydrogen 3.257 N/A GLY 172.A N ALA 131.A O no hydrogen 3.275 N/A ALA 173.A N ARG 156.A O no hydrogen 3.003 N/A ARG 174.A N THR 129.A O no hydrogen 2.827 N/A GLU 175.A N GLU 175.A OE2 no hydrogen 2.784 N/A VAL 177.A N ALA 173.A O no hydrogen 2.999 N/A ALA 178.A N ARG 174.A O no hydrogen 2.969 N/A ASP 179.A N GLU 175.A O no hydrogen 2.844 N/A LEU 180.A N ALA 176.A O no hydrogen 2.947 N/A VAL 181.A N VAL 177.A O no hydrogen 2.870 N/A ALA 182.A N ALA 178.A O no hydrogen 2.970 N/A ASP 183.A N ASP 179.A O no hydrogen 2.898 N/A LEU 184.A N LEU 180.A O no hydrogen 2.871 N/A THR 185.A N VAL 181.A O no hydrogen 2.883 N/A THR 185.A OG1 VAL 181.A O no hydrogen 2.804 N/A ALA 186.A N ALA 182.A O no hydrogen 3.498 N/A GLN 188.A N THR 185.A O no hydrogen 2.874 N/A VAL 189.A N LEU 184.A O no hydrogen 3.227 N/A ARG 192.A N SER 134.A O no hydrogen 2.759 N/A ILE 194.A N LEU 132.A O no hydrogen 2.970 N/A VAL 196.A N ILE 194.A O no hydrogen 2.759 N/A ALA 200.A N VAL 198.A O no hydrogen 2.820 N/A HIS 201.A N MET 251.A O no hydrogen 2.897 N/A HIS 201.A ND1 SER 253.A O no hydrogen 2.826 N/A HIS 201.A NE2 SER 94.A OG no hydrogen 2.740 N/A SER 202.A OG PRO 199.A O no hydrogen 2.650 N/A MET 205.A N SER 202.A O no hydrogen 3.047 N/A TYR 206.A N PRO 203.A O no hydrogen 2.970 N/A ILE 208.A N MET 205.A O no hydrogen 3.120 N/A GLU 209.A N TYR 206.A O no hydrogen 3.181 N/A VAL 212.A N ILE 208.A O no hydrogen 3.157 N/A VAL 213.A N GLU 209.A O no hydrogen 3.028 N/A SER 214.A N GLU 210.A O no hydrogen 3.159 N/A SER 214.A OG GLU 210.A O no hydrogen 3.028 N/A GLY 215.A N ARG 211.A O no hydrogen 3.062 N/A LEU 216.A N VAL 212.A O no hydrogen 3.147 N/A LEU 216.A N VAL 213.A O no hydrogen 3.365 N/A LEU 217.A N SER 214.A O no hydrogen 3.330 N/A ILE 219.A N LEU 216.A O no hydrogen 3.305 N/A THR 220.A N ASP 111.A OD2 no hydrogen 2.744 N/A ARG 222.A N GLY 106.A O no hydrogen 2.765 N/A ARG 222.A NE GLY 105.A O no hydrogen 2.743 N/A ARG 222.A NH2 GLY 105.A O no hydrogen 3.018 N/A SER 224.A OG ILE 226.A O no hydrogen 2.930 N/A SER 224.A OG THR 239.A OG1 no hydrogen 3.352 N/A ILE 226.A N SER 104.A O no hydrogen 3.490 N/A HIS 229.A N VAL 90.A O no hydrogen 2.874 N/A SER 230.A N GLY 235.A O no hydrogen 2.759 N/A SER 230.A OG THR 233.A OG1 no hydrogen 3.174 N/A SER 230.A OG TYR 246.A OH no hydrogen 2.703 N/A SER 231.A N GLU 97.A OE2 no hydrogen 2.835 N/A SER 231.A OG GLY 92.A O no hydrogen 2.722 N/A VAL 232.A N GLU 97.A OE2 no hydrogen 3.271 N/A VAL 232.A N SER 230.A OG no hydrogen 3.028 N/A THR 233.A N SER 230.A OG no hydrogen 3.073 N/A THR 233.A OG1 SER 230.A OG no hydrogen 3.174 N/A THR 233.A OG1 GLY 235.A O no hydrogen 3.550 N/A GLY 235.A N SER 230.A O no hydrogen 2.941 N/A LEU 237.A N PHE 228.A O no hydrogen 2.976 N/A THR 239.A OG1 ARG 222.A O no hydrogen 2.602 N/A ARG 240.A N ASP 238.A OD1 no hydrogen 3.118 N/A ARG 240.A NE ASP 238.A OD1 no hydrogen 3.354 N/A ARG 240.A NE ASP 238.A OD2 no hydrogen 3.405 N/A ARG 240.A NH1 ASP 238.A OD2 no hydrogen 3.296 N/A GLU 241.A N ASP 238.A O no hydrogen 2.935 N/A LEU 242.A N THR 239.A O no hydrogen 3.331 N/A ASP 243.A N GLU 241.A O no hydrogen 2.926 N/A TYR 246.A N ASP 243.A OD1 no hydrogen 3.057 N/A TYR 246.A OH GLU 97.A OE1 no hydrogen 2.341 N/A TYR 246.A OH SER 230.A OG no hydrogen 2.703 N/A TRP 247.A N ASP 243.A O no hydrogen 3.136 N/A TRP 247.A NE1 LEU 242.A O no hydrogen 3.011 N/A TYR 248.A N ALA 244.A O no hydrogen 3.168 N/A ARG 249.A N ALA 245.A O no hydrogen 3.007 N/A ASN 250.A N TYR 246.A O no hydrogen 2.807 N/A ASN 250.A ND2 SER 94.A O no hydrogen 3.212 N/A MET 251.A N TRP 247.A O no hydrogen 3.128 N/A SER 252.A N ARG 249.A O no hydrogen 3.251 N/A SER 252.A OG TYR 248.A O no hydrogen 2.829 N/A SER 253.A N ASN 250.A O no hydrogen 3.331 N/A SER 253.A OG ARG 249.A O no hydrogen 2.579 N/A THR 254.A OG1 VAL 159.A O no hydrogen 2.734 N/A VAL 255.A N ALA 160.A O no hydrogen 2.774 N/A ARG 256.A N SER 231.A O no hydrogen 2.603 N/A GLU 258.A N VAL 162.A O no hydrogen 2.973 N/A ALA 260.A N ARG 256.A O no hydrogen 3.422 N/A ALA 261.A N PHE 257.A O no hydrogen 2.904 N/A ARG 262.A N GLU 258.A O no hydrogen 2.843 N/A ARG 262.A NH1 GLU 258.A OE1 no hydrogen 2.759 N/A LEU 263.A N PRO 259.A O no hydrogen 3.170 N/A LEU 264.A N ALA 260.A O no hydrogen 3.325 N/A LEU 265.A N ALA 261.A O no hydrogen 3.022 N/A GLN 266.A N ARG 262.A O no hydrogen 2.943 N/A GLN 267.A N LEU 263.A O no hydrogen 3.331 N/A LYS 270.A NZ GLY 1.A O no hydrogen 3.410 N/A THR 271.A N GLY 1.A O no hydrogen 3.163 N/A PHE 272.A N VAL 294.A O no hydrogen 2.832 N/A VAL 273.A N VAL 3.A O no hydrogen 2.993 N/A GLU 274.A N MET 296.A O no hydrogen 2.951 N/A MET 275.A N VAL 5.A O no hydrogen 2.838 N/A SER 276.A OG GLU 274.A OE2 no hydrogen 2.555 N/A SER 276.A OG HIS 278.A O no hydrogen 2.832 N/A VAL 280.A N GLU 274.A OE2 no hydrogen 2.722 N/A LEU 281.A N GLU 274.A OE1 no hydrogen 2.767 N/A LEU 285.A N LEU 281.A O no hydrogen 3.151 N/A GLN 286.A N THR 282.A O no hydrogen 2.839 N/A GLU 287.A N MET 283.A O no hydrogen 2.914 N/A LEU 288.A N GLY 284.A O no hydrogen 2.934 N/A ALA 289.A N LEU 285.A O no hydrogen 2.859 N/A ASP 291.A N GLU 287.A O no hydrogen 3.067 N/A LEU 292.A N LEU 288.A O no hydrogen 2.947 N/A LEU 292.A N ALA 289.A O no hydrogen 3.215 N/A VAL 294.A N LYS 270.A O no hydrogen 3.082 N/A MET 296.A N PHE 272.A O no hydrogen 3.041 N/A THR 298.A OG1 GLU 274.A O no hydrogen 2.844 N/A LEU 299.A N SER 276.A O no hydrogen 3.306 N/A ARG 300.A N GLN 303.A O no hydrogen 3.411 N/A ARG 301.A N HIS 278.A ND1 no hydrogen 3.098 N/A GLN 303.A N ARG 300.A O no hydrogen 2.785 N/A HIS 308.A N THR 305.A OG1 no hydrogen 2.968 N/A PHE 309.A N THR 305.A O no hydrogen 3.001 N/A LEU 310.A N LEU 306.A O no hydrogen 2.822 N/A THR 311.A N ASP 307.A O no hydrogen 3.153 N/A THR 311.A OG1 HIS 308.A O no hydrogen 2.842 N/A SER 312.A N HIS 308.A O no hydrogen 3.124 N/A SER 312.A OG THR 298.A O no hydrogen 2.841 N/A SER 312.A OG HIS 308.A O no hydrogen 3.564 N/A LEU 313.A N PHE 309.A O no hydrogen 2.816 N/A ALA 314.A N LEU 310.A O no hydrogen 2.843 N/A GLN 315.A N THR 311.A O no hydrogen 2.860 N/A LEU 316.A N SER 312.A O no hydrogen 3.031 N/A ARG 317.A N LEU 313.A O no hydrogen 3.084 N/A ARG 317.A NH2 GLN 83.A O no hydrogen 2.933 N/A GLY 318.A N ALA 314.A O no hydrogen 2.921 N/A