Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1orh_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): HIS 6.A N SER 3.A O no hydrogen 3.049 N/A PHE 7.A N TYR 4.A O no hydrogen 3.485 N/A GLU 11.A N PHE 7.A O no hydrogen 3.196 N/A GLU 12.A N GLY 8.A O no hydrogen 3.060 N/A MET 13.A N ILE 9.A O no hydrogen 3.001 N/A LEU 14.A N HIS 10.A O no hydrogen 2.720 N/A LYS 15.A N GLU 11.A O no hydrogen 2.816 N/A LYS 15.A NZ GLU 11.A OE2 no hydrogen 2.629 N/A ASP 16.A N MET 13.A O no hydrogen 3.121 N/A ARG 19.A N ASP 16.A OD2 no hydrogen 3.063 N/A ARG 19.A NE MET 13.A O no hydrogen 3.033 N/A ARG 19.A NH1 GLU 109.A OE1 no hydrogen 3.135 N/A ARG 19.A NH2 MET 13.A O no hydrogen 3.470 N/A THR 20.A N ASP 16.A O no hydrogen 2.974 N/A THR 20.A OG1 ASP 16.A O no hydrogen 2.962 N/A LEU 21.A N GLU 17.A O no hydrogen 2.811 N/A THR 22.A N ARG 19.A O no hydrogen 3.086 N/A THR 22.A OG1 VAL 18.A O no hydrogen 2.501 N/A TYR 23.A N ARG 19.A O no hydrogen 3.145 N/A TYR 23.A OH SER 108.A O no hydrogen 2.604 N/A ARG 24.A N THR 20.A O no hydrogen 3.033 N/A ASN 25.A N LEU 21.A O no hydrogen 2.969 N/A SER 26.A N THR 22.A O no hydrogen 3.184 N/A SER 26.A OG TYR 23.A O no hydrogen 2.724 N/A MET 27.A N ARG 24.A O no hydrogen 3.195 N/A PHE 28.A N ARG 24.A O no hydrogen 2.868 N/A HIS 29.A N ASN 25.A O no hydrogen 2.950 N/A ASN 30.A N MET 27.A O no hydrogen 2.872 N/A ASN 30.A ND2 SER 26.A O no hydrogen 3.282 N/A LEU 33.A N ASN 30.A O no hydrogen 2.911 N/A PHE 34.A N ARG 31.A O no hydrogen 2.911 N/A LYS 35.A N ARG 31.A O no hydrogen 3.118 N/A ASP 36.A N GLY 57.A O no hydrogen 2.837 N/A LYS 37.A N PHE 34.A O no hydrogen 3.391 N/A VAL 38.A N ASP 104.A OD2 no hydrogen 3.197 N/A VAL 39.A N LYS 60.A O no hydrogen 3.079 N/A LEU 40.A N ILE 105.A O no hydrogen 2.780 N/A ASP 41.A N ILE 62.A O no hydrogen 2.866 N/A VAL 42.A N ILE 107.A O no hydrogen 3.185 N/A GLY 43.A N ILE 64.A O no hydrogen 2.815 N/A SER 44.A N ILE 64.A O no hydrogen 2.950 N/A GLY 45.A N GLU 65.A OE1 no hydrogen 2.727 N/A GLY 47.A N SER 44.A O no hydrogen 2.745 N/A CYS 50.A SG ASP 41.A OD1 no hydrogen 3.483 N/A MET 51.A N GLY 47.A O no hydrogen 3.010 N/A PHE 52.A N ILE 48.A O no hydrogen 3.208 N/A ALA 53.A N LEU 49.A O no hydrogen 3.030 N/A ALA 54.A N CYS 50.A O no hydrogen 2.922 N/A LYS 55.A N MET 51.A O no hydrogen 2.969 N/A ALA 56.A N ALA 53.A O no hydrogen 2.934 N/A GLY 57.A N ALA 54.A O no hydrogen 2.969 N/A ALA 58.A N ALA 53.A O no hydrogen 3.328 N/A ARG 59.A N LYS 37.A O no hydrogen 2.838 N/A ARG 59.A NH1 ASP 36.A O no hydrogen 3.452 N/A LYS 60.A N LYS 37.A O no hydrogen 3.262 N/A VAL 61.A N VAL 85.A O no hydrogen 2.769 N/A ILE 62.A N VAL 39.A O no hydrogen 2.911 N/A GLY 63.A N THR 87.A O no hydrogen 2.994 N/A ILE 64.A N ASP 41.A O no hydrogen 3.007 N/A GLU 65.A N ILE 89.A O no hydrogen 3.054 N/A SER 67.A N GLU 65.A OE2 no hydrogen 3.042 N/A SER 67.A OG GLU 65.A OE2 no hydrogen 2.987 N/A ILE 69.A N SER 67.A OG no hydrogen 3.316 N/A SER 70.A N SER 67.A O no hydrogen 3.002 N/A SER 70.A OG SER 67.A O no hydrogen 3.168 N/A ASP 71.A N SER 68.A O no hydrogen 2.944 N/A TYR 72.A N ILE 69.A O no hydrogen 2.811 N/A ALA 73.A N ILE 69.A O no hydrogen 3.055 N/A ALA 73.A N SER 70.A O no hydrogen 3.144 N/A VAL 74.A N SER 70.A O no hydrogen 3.207 N/A ILE 76.A N TYR 72.A O no hydrogen 2.959 N/A VAL 77.A N ALA 73.A O no hydrogen 2.637 N/A LYS 78.A N VAL 74.A O no hydrogen 2.902 N/A ALA 79.A N LYS 75.A O no hydrogen 2.825 N/A ASN 80.A N ILE 76.A O no hydrogen 3.175 N/A ASN 80.A N VAL 77.A O no hydrogen 3.010 N/A ASN 80.A ND2 ILE 76.A O no hydrogen 2.627 N/A LYS 81.A N LYS 78.A O no hydrogen 2.847 N/A LEU 82.A N VAL 77.A O no hydrogen 3.364 N/A VAL 85.A N LEU 82.A O no hydrogen 3.116 N/A VAL 86.A N LEU 82.A O no hydrogen 2.950 N/A THR 87.A N VAL 61.A O no hydrogen 2.948 N/A ILE 89.A N GLY 63.A O no hydrogen 2.855 N/A LYS 90.A NZ ASP 71.A OD1 no hydrogen 3.395 N/A GLY 91.A N GLU 65.A O no hydrogen 2.981 N/A GLU 95.A N LYS 92.A O no hydrogen 2.849 N/A VAL 103.A N TRP 131.A O no hydrogen 2.713 N/A ASP 104.A N VAL 38.A O no hydrogen 2.948 N/A ILE 105.A N VAL 38.A O no hydrogen 3.183 N/A ILE 106.A N LEU 137.A O no hydrogen 3.056 N/A ILE 107.A N LEU 40.A O no hydrogen 2.803 N/A SER 108.A N PHE 139.A O no hydrogen 3.039 N/A SER 108.A OG VAL 42.A O no hydrogen 3.210 N/A GLY 112.A N LEU 115.A O no hydrogen 2.739 N/A LEU 115.A N GLY 112.A O no hydrogen 2.711 N/A TYR 117.A N TYR 113.A O no hydrogen 2.979 N/A SER 119.A N PHE 116.A O no hydrogen 3.245 N/A MET 120.A N TRP 110.A O no hydrogen 3.226 N/A LEU 121.A N SER 119.A OG no hydrogen 2.974 N/A THR 123.A OG1 GLU 94.A OE2 no hydrogen 3.187 N/A VAL 124.A N MET 120.A O no hydrogen 2.907 N/A LEU 125.A N LEU 121.A O no hydrogen 2.972 N/A HIS 126.A N ASN 122.A O no hydrogen 3.010 N/A HIS 126.A ND1 ASN 122.A O no hydrogen 2.582 N/A ALA 127.A N THR 123.A O no hydrogen 3.002 N/A ARG 128.A N VAL 124.A O no hydrogen 2.759 N/A ARG 128.A NE ASP 129.A OD1 no hydrogen 2.951 N/A ARG 128.A NH1 ILE 204.A O no hydrogen 2.640 N/A ARG 128.A NH1 VAL 207.A O no hydrogen 3.005 N/A ARG 128.A NH2 ASP 129.A OD1 no hydrogen 3.026 N/A ARG 128.A NH2 VAL 207.A O no hydrogen 2.947 N/A ASP 129.A N LEU 125.A O no hydrogen 3.038 N/A LYS 130.A N HIS 126.A O no hydrogen 2.990 N/A TRP 131.A N ALA 127.A O no hydrogen 2.929 N/A LEU 132.A N ARG 128.A O no hydrogen 3.087 N/A ALA 133.A N VAL 103.A O no hydrogen 2.954 N/A GLY 136.A N ALA 133.A O no hydrogen 3.188 N/A LEU 137.A N ASP 104.A O no hydrogen 3.139 N/A ILE 138.A N TYR 205.A OH no hydrogen 3.405 N/A PHE 139.A N ILE 106.A O no hydrogen 2.757 N/A ASP 141.A N GLU 238.A O no hydrogen 3.194 N/A ARG 142.A N GLU 238.A O no hydrogen 3.191 N/A ARG 142.A NE GLU 201.A OE1 no hydrogen 3.225 N/A ARG 142.A NH2 GLU 201.A OE1 no hydrogen 2.951 N/A ALA 143.A N VAL 202.A O no hydrogen 2.812 N/A THR 144.A N ASN 236.A O no hydrogen 3.082 N/A LEU 145.A N LYS 200.A O no hydrogen 2.768 N/A TYR 146.A N TYR 234.A O no hydrogen 2.936 N/A VAL 147.A N CYS 197.A O no hydrogen 2.943 N/A THR 148.A N VAL 232.A O no hydrogen 2.986 N/A THR 148.A OG1 ASN 195.A O no hydrogen 2.642 N/A ALA 149.A N THR 194.A OG1 no hydrogen 3.299 N/A ILE 150.A N ALA 230.A O no hydrogen 3.175 N/A GLU 151.A N GLN 191.A O no hydrogen 2.802 N/A ASP 152.A N HIS 229.A ND1 no hydrogen 2.992 N/A ARG 153.A N GLU 151.A OE1 no hydrogen 3.327 N/A LYS 156.A NZ GLU 267.A O no hydrogen 3.568 N/A ASP 157.A N ARG 153.A O no hydrogen 3.153 N/A TYR 158.A N GLN 154.A O no hydrogen 3.187 N/A LYS 159.A N LYS 156.A O no hydrogen 2.905 N/A ILE 160.A N LYS 156.A O no hydrogen 2.518 N/A TRP 162.A N ASP 157.A O no hydrogen 2.753 N/A TRP 163.A N ILE 160.A O no hydrogen 3.038 N/A GLU 164.A N HIS 161.A O no hydrogen 3.342 N/A VAL 166.A N PHE 169.A O no hydrogen 2.882 N/A GLY 168.A N ASN 165.A OD1 no hydrogen 2.910 N/A PHE 169.A N VAL 166.A O no hydrogen 3.178 N/A MET 171.A N TRP 163.A O no hydrogen 3.068 N/A SER 172.A N ASP 170.A OD1 no hydrogen 3.166 N/A SER 172.A OG ASP 170.A OD1 no hydrogen 2.731 N/A ILE 174.A N MET 171.A O no hydrogen 3.254 N/A LYS 175.A N SER 172.A O no hydrogen 2.872 N/A ALA 178.A N ILE 174.A O no hydrogen 2.968 N/A ILE 179.A N LYS 175.A O no hydrogen 3.316 N/A LYS 180.A NZ ASP 314.A O no hydrogen 3.202 N/A GLU 181.A N ALA 178.A O no hydrogen 3.004 N/A LEU 183.A N VAL 263.A O no hydrogen 2.839 N/A ASP 185.A N GLN 261.A O no hydrogen 3.049 N/A VAL 187.A N GLN 261.A OE1 no hydrogen 2.703 N/A LYS 190.A N ASP 188.A OD2 no hydrogen 2.759 N/A GLN 191.A N ASP 188.A O no hydrogen 2.911 N/A LEU 192.A N PRO 189.A O no hydrogen 3.160 N/A VAL 193.A N ALA 149.A O no hydrogen 3.027 N/A THR 194.A OG1 ASN 195.A O no hydrogen 2.869 N/A CYS 197.A N VAL 147.A O no hydrogen 2.845 N/A CYS 197.A SG LEU 198.A O no hydrogen 3.956 N/A CYS 197.A SG CYS 219.A O no hydrogen 3.758 N/A ILE 199.A N LEU 145.A O no hydrogen 2.895 N/A LYS 200.A NZ ASP 211.A O no hydrogen 2.819 N/A VAL 202.A N ALA 143.A O no hydrogen 2.606 N/A ILE 204.A N ASP 141.A O no hydrogen 3.092 N/A TYR 205.A OH ASP 141.A OD1 no hydrogen 3.129 N/A THR 206.A N ASP 203.A O no hydrogen 3.105 N/A THR 206.A N ASP 203.A OD2 no hydrogen 2.848 N/A VAL 207.A N ASP 203.A O no hydrogen 3.088 N/A LYS 208.A N ASP 211.A OD2 no hydrogen 3.015 N/A GLU 210.A N GLU 210.A OE1 no hydrogen 2.715 N/A ASP 211.A N LYS 208.A O no hydrogen 2.771 N/A LEU 212.A N VAL 209.A O no hydrogen 2.985 N/A THR 213.A N GLU 210.A O no hydrogen 3.274 N/A PHE 214.A N MET 284.A O no hydrogen 3.109 N/A SER 216.A N ILE 282.A O no hydrogen 2.898 N/A SER 216.A OG ILE 199.A O no hydrogen 2.903 N/A PHE 218.A N GLY 280.A O no hydrogen 2.882 N/A LEU 220.A N ILE 278.A O no hydrogen 2.757 N/A GLN 221.A N ASN 195.A OD1 no hydrogen 3.154 N/A VAL 222.A N GLU 276.A O no hydrogen 2.747 N/A LYS 223.A N VAL 193.A O no hydrogen 2.774 N/A LYS 223.A NZ GLN 221.A OE1 no hydrogen 2.962 N/A ARG 224.A NE ASP 226.A OD2 no hydrogen 2.909 N/A ARG 224.A NH1 LYS 190.A O no hydrogen 3.290 N/A ARG 224.A NH2 LYS 190.A O no hydrogen 3.455 N/A ARG 224.A NH2 ASP 226.A OD2 no hydrogen 2.736 N/A ASP 226.A N VAL 272.A O no hydrogen 3.090 N/A TYR 227.A N ASP 226.A OD1 no hydrogen 2.800 N/A VAL 228.A N LEU 270.A O no hydrogen 2.804 N/A HIS 229.A N ILE 150.A O no hydrogen 3.277 N/A LEU 231.A N PHE 264.A O no hydrogen 2.956 N/A VAL 232.A N THR 148.A O no hydrogen 2.821 N/A ALA 233.A N THR 262.A O no hydrogen 2.904 N/A TYR 234.A N TYR 146.A O no hydrogen 3.287 N/A PHE 235.A N THR 250.A OG1 no hydrogen 2.985 N/A ASN 236.A N THR 144.A O no hydrogen 2.827 N/A ASN 236.A ND2 PHE 235.A O no hydrogen 2.764 N/A ILE 237.A N PHE 248.A O no hydrogen 3.058 N/A GLU 238.A N ARG 142.A O no hydrogen 2.952 N/A PHE 239.A N THR 246.A O no hydrogen 3.013 N/A THR 240.A N ASP 141.A OD2 no hydrogen 3.044 N/A THR 240.A OG1 ASP 141.A OD1 no hydrogen 2.728 N/A THR 240.A OG1 ASP 141.A OD2 no hydrogen 2.711 N/A CYS 242.A N PHE 239.A O no hydrogen 3.205 N/A CYS 242.A SG SER 26.A O no hydrogen 3.872 N/A CYS 242.A SG PHE 239.A O no hydrogen 3.234 N/A HIS 243.A N ASN 30.A OD1 no hydrogen 2.968 N/A THR 246.A OG1 LYS 244.A O no hydrogen 2.775 N/A PHE 248.A N ILE 237.A O no hydrogen 3.310 N/A SER 249.A OG SER 254.A OG no hydrogen 3.404 N/A THR 250.A N PHE 235.A O no hydrogen 3.066 N/A THR 250.A OG1 PHE 235.A O no hydrogen 2.708 N/A SER 251.A N SER 249.A OG no hydrogen 3.333 N/A SER 251.A OG GLU 253.A OE1 no hydrogen 3.422 N/A SER 251.A OG SER 254.A OG no hydrogen 2.639 N/A GLU 253.A N GLU 253.A OE1 no hydrogen 2.683 N/A SER 254.A N SER 251.A O no hydrogen 2.922 N/A SER 254.A OG SER 249.A OG no hydrogen 3.404 N/A SER 254.A OG SER 251.A OG no hydrogen 2.639 N/A HIS 258.A N ASP 16.A OD1 no hydrogen 3.091 N/A HIS 258.A ND1 ASP 16.A OD1 no hydrogen 2.709 N/A TRP 259.A N THR 257.A OG1 no hydrogen 3.312 N/A LYS 260.A N THR 257.A O no hydrogen 2.921 N/A GLN 261.A N ASP 185.A O no hydrogen 3.157 N/A GLN 261.A NE2 THR 250.A O no hydrogen 2.810 N/A THR 262.A N ALA 233.A O no hydrogen 3.014 N/A VAL 263.A N LEU 183.A O no hydrogen 2.568 N/A PHE 264.A N LEU 231.A O no hydrogen 2.820 N/A TYR 265.A OH ASP 152.A OD1 no hydrogen 2.900 N/A MET 266.A N HIS 229.A O no hydrogen 3.312 N/A LEU 270.A N VAL 228.A O no hydrogen 2.932 N/A VAL 272.A N ASP 226.A O no hydrogen 2.927 N/A LYS 273.A N GLU 276.A OE2 no hydrogen 2.706 N/A THR 274.A N ASN 225.A OD1 no hydrogen 3.022 N/A THR 274.A OG1 ASN 225.A OD1 no hydrogen 3.136 N/A GLY 275.A N VAL 222.A O no hydrogen 2.889 N/A GLU 276.A N LYS 273.A O no hydrogen 3.108 N/A ILE 278.A N LEU 220.A O no hydrogen 2.614 N/A PHE 279.A N ASP 301.A O no hydrogen 3.115 N/A GLY 280.A N PHE 218.A O no hydrogen 3.207 N/A THR 281.A N ASP 299.A O no hydrogen 2.886 N/A ILE 282.A N SER 216.A O no hydrogen 2.830 N/A GLY 283.A N THR 297.A O no hydrogen 2.887 N/A MET 284.A N PHE 214.A O no hydrogen 2.798 N/A ARG 285.A N ASP 295.A O no hydrogen 3.072 N/A ASN 287.A N ASP 293.A O no hydrogen 3.071 N/A ASP 293.A N ASN 290.A O no hydrogen 2.781 N/A ASP 295.A N ARG 285.A O no hydrogen 2.895 N/A PHE 296.A N TYR 315.A O no hydrogen 2.853 N/A THR 297.A N GLY 283.A O no hydrogen 3.079 N/A THR 297.A OG1 ASP 314.A OD1 no hydrogen 2.577 N/A ILE 298.A N THR 313.A O no hydrogen 2.967 N/A ASP 299.A N THR 281.A O no hydrogen 2.998 N/A LEU 300.A N CYS 311.A O no hydrogen 2.969 N/A ASP 301.A N PHE 279.A O no hydrogen 2.927 N/A PHE 302.A N LEU 309.A O no hydrogen 2.849 N/A LYS 303.A NZ GLU 308.A OE1 no hydrogen 3.181 N/A LYS 303.A NZ GLU 308.A OE2 no hydrogen 3.030 N/A GLY 304.A N CYS 307.A O no hydrogen 2.767 N/A GLN 305.A N GLU 276.A OE1 no hydrogen 2.864 N/A LEU 309.A N PHE 302.A O no hydrogen 2.943 N/A CYS 311.A N LEU 300.A O no hydrogen 3.092 N/A SER 312.A OG ASP 299.A OD1 no hydrogen 2.779 N/A THR 313.A N ILE 298.A O no hydrogen 3.066 N/A TYR 315.A N PHE 296.A O no hydrogen 2.976 N/A TYR 315.A OH TYR 265.A O no hydrogen 2.595 N/A ARG 316.A N LYS 180.A O no hydrogen 3.017 N/A MET 317.A N LEU 294.A O no hydrogen 2.710 N/A