Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 5grh_B.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ARG 2.A NE ASP 33.A OD1 no hydrogen 3.531 N/A ARG 2.A NE ASP 33.A OD2 no hydrogen 3.170 N/A ARG 2.A NH2 ASP 33.A OD1 no hydrogen 3.386 N/A HIS 3.A N PRO 31.A O no hydrogen 3.094 N/A VAL 5.A N ASP 33.A O no hydrogen 2.927 N/A THR 6.A N VAL 60.A O no hydrogen 3.105 N/A THR 6.A OG1 ALA 54.A O no hydrogen 3.397 N/A MET 7.A N GLU 35.A O no hydrogen 3.228 N/A ILE 8.A N LEU 62.A O no hydrogen 2.854 N/A ASP 11.A N ASN 65.A O no hydrogen 2.938 N/A ILE 13.A N THR 261.A O no hydrogen 2.790 N/A GLY 14.A N ASP 11.A O no hydrogen 3.060 N/A LEU 17.A N ILE 13.A O no hydrogen 3.183 N/A MET 18.A N GLY 14.A O no hydrogen 2.987 N/A LEU 19.A N PRO 15.A O no hydrogen 3.119 N/A VAL 21.A N LEU 17.A O no hydrogen 3.085 N/A LYS 22.A N MET 18.A O no hydrogen 3.066 N/A LYS 22.A NZ GLU 36.A OE1 no hydrogen 2.453 N/A SER 23.A N LEU 19.A O no hydrogen 3.049 N/A SER 23.A OG HIS 20.A O no hydrogen 3.102 N/A VAL 24.A N HIS 20.A O no hydrogen 3.005 N/A PHE 25.A N VAL 21.A O no hydrogen 2.909 N/A ARG 26.A N LYS 22.A O no hydrogen 2.882 N/A HIS 27.A N SER 23.A O no hydrogen 3.098 N/A HIS 27.A ND1 SER 23.A O no hydrogen 2.738 N/A ALA 28.A N VAL 24.A O no hydrogen 2.917 N/A ALA 28.A N PHE 25.A O no hydrogen 3.211 N/A CYS 29.A N ARG 26.A O no hydrogen 3.219 N/A VAL 30.A N PHE 25.A O no hydrogen 3.153 N/A VAL 32.A N VAL 30.A O no hydrogen 3.086 N/A ASP 33.A N HIS 3.A O no hydrogen 2.744 N/A GLU 35.A N VAL 5.A O no hydrogen 2.992 N/A VAL 37.A N MET 7.A O no hydrogen 2.983 N/A SER 40.A N ASP 47.A OD2 no hydrogen 2.696 N/A SER 40.A OG ASN 42.A OD1 no hydrogen 2.828 N/A SER 40.A OG ASP 47.A OD2 no hydrogen 2.600 N/A ILE 48.A N GLU 45.A O no hydrogen 2.400 N/A ARG 49.A N GLU 45.A O no hydrogen 3.010 N/A ARG 49.A NH2 GLU 45.A OE1 no hydrogen 3.124 N/A ASN 50.A N GLU 46.A O no hydrogen 3.066 N/A ILE 52.A N ILE 48.A O no hydrogen 3.407 N/A MET 53.A N ARG 49.A O no hydrogen 3.203 N/A ALA 54.A N ASN 50.A O no hydrogen 3.007 N/A ILE 55.A N ALA 51.A O no hydrogen 2.843 N/A ARG 56.A N ILE 52.A O no hydrogen 2.852 N/A ARG 57.A N MET 53.A O no hydrogen 3.148 N/A ARG 57.A NH2 GLU 35.A OE2 no hydrogen 2.549 N/A ASN 58.A N ALA 54.A O no hydrogen 3.109 N/A ASN 58.A ND2 THR 6.A OG1 no hydrogen 3.142 N/A ASN 58.A ND2 GLU 35.A OE1 no hydrogen 3.400 N/A ARG 59.A N ILE 55.A O no hydrogen 2.592 N/A ALA 61.A N ALA 252.A O no hydrogen 3.001 N/A LEU 62.A N THR 6.A O no hydrogen 2.890 N/A LYS 63.A N PHE 254.A O no hydrogen 3.073 N/A LYS 63.A NZ GLY 64.A O no hydrogen 2.867 N/A LYS 63.A NZ ASN 80.A OD1 no hydrogen 3.206 N/A LYS 63.A NZ GLU 255.A OE1 no hydrogen 2.521 N/A GLY 64.A N ILE 8.A O no hydrogen 2.681 N/A ASN 65.A ND2 THR 258.A O no hydrogen 3.098 N/A ASN 65.A ND2 ASN 260.A O no hydrogen 2.750 N/A GLU 67.A N ASP 11.A OD2 no hydrogen 2.673 N/A ASN 71.A N ASN 69.A OD1 no hydrogen 3.153 N/A LEU 72.A N ASN 69.A O no hydrogen 3.412 N/A HIS 76.A N PRO 73.A O no hydrogen 2.844 N/A LYS 77.A NZ TYR 122.A O no hydrogen 3.088 N/A ARG 79.A NE LYS 77.A O no hydrogen 3.104 N/A ARG 79.A NH2 GLU 45.A OE2 no hydrogen 3.340 N/A ARG 79.A NH2 LYS 77.A O no hydrogen 2.668 N/A ILE 82.A N SER 78.A O no hydrogen 2.946 N/A LEU 83.A N ARG 79.A O no hydrogen 3.051 N/A ARG 84.A N ASN 80.A O no hydrogen 3.177 N/A ARG 84.A NH1 TYR 122.A OH no hydrogen 2.799 N/A ARG 84.A NH2 GLU 255.A OE2 no hydrogen 2.692 N/A THR 85.A N ASN 81.A O no hydrogen 3.209 N/A THR 85.A OG1 ASN 81.A O no hydrogen 3.245 N/A THR 85.A OG1 ILE 82.A O no hydrogen 3.093 N/A SER 86.A N ILE 82.A O no hydrogen 2.918 N/A SER 86.A OG ILE 82.A O no hydrogen 2.625 N/A LEU 87.A N LEU 83.A O no hydrogen 3.326 N/A ASP 88.A N THR 85.A O no hydrogen 3.169 N/A LEU 89.A N ARG 84.A O no hydrogen 2.980 N/A ALA 91.A N TYR 247.A O no hydrogen 3.074 N/A ASN 92.A N ARG 115.A O no hydrogen 2.984 N/A ASN 92.A ND2 ASN 246.A OD1 no hydrogen 2.946 N/A VAL 93.A N ALA 245.A O no hydrogen 2.852 N/A ILE 94.A N ILE 113.A O no hydrogen 3.073 N/A HIS 95.A NE2 ASP 110.A OD1 no hydrogen 2.611 N/A CYS 96.A N ILE 111.A O no hydrogen 2.921 N/A SER 98.A N ILE 109.A O no hydrogen 2.866 N/A VAL 102.A N LEU 99.A O no hydrogen 3.193 N/A THR 104.A OG1 HIS 106.A O no hydrogen 2.649 N/A HIS 106.A NE2 VAL 209.A O no hydrogen 2.647 N/A ILE 109.A N SER 98.A OG no hydrogen 3.149 N/A ILE 111.A N CYS 96.A O no hydrogen 3.211 N/A LEU 112.A N ASP 216.A O no hydrogen 2.976 N/A ILE 113.A N ILE 94.A O no hydrogen 2.918 N/A VAL 114.A N MET 218.A O no hydrogen 2.549 N/A ARG 115.A N ASN 92.A O no hydrogen 2.924 N/A ARG 115.A NH1 ASN 117.A OD1 no hydrogen 2.968 N/A ARG 115.A NH1 TYR 122.A OH no hydrogen 3.336 N/A ARG 115.A NH1 ASN 222.A OD1 no hydrogen 3.198 N/A ARG 115.A NH2 ASN 117.A OD1 no hydrogen 3.394 N/A GLU 116.A N MET 220.A O no hydrogen 3.087 N/A ASN 117.A ND2 LEU 89.A O no hydrogen 3.057 N/A ASN 117.A ND2 ASN 246.A OD1 no hydrogen 2.733 N/A THR 118.A N GLU 116.A OE1 no hydrogen 2.821 N/A THR 118.A OG1 GLU 116.A OE1 no hydrogen 3.180 N/A THR 118.A OG1 GLU 116.A OE2 no hydrogen 2.641 N/A GLU 119.A N GLU 116.A OE1 no hydrogen 2.845 N/A GLY 120.A N ILE 139.A O no hydrogen 2.991 N/A GLU 121.A N ASN 222.A O no hydrogen 3.053 N/A TYR 122.A N GLU 119.A O no hydrogen 3.499 N/A TYR 122.A OH ASN 117.A OD1 no hydrogen 3.017 N/A SER 123.A N GLY 120.A O no hydrogen 3.065 N/A SER 124.A N GLU 121.A O no hydrogen 3.439 N/A LEU 125.A N LEU 137.A O no hydrogen 3.206 N/A HIS 127.A N GLU 135.A O no hydrogen 3.100 N/A SER 129.A OG HIS 127.A ND1 no hydrogen 2.939 N/A GLY 132.A N GLU 128.A OE1 no hydrogen 2.946 N/A VAL 133.A N VAL 130.A O no hydrogen 3.090 N/A GLU 135.A N HIS 127.A O no hydrogen 3.096 N/A LEU 137.A N LEU 125.A O no hydrogen 2.898 N/A THR 141.A N GLU 119.A OE2 no hydrogen 3.056 N/A THR 141.A OG1 GLU 119.A OE1 no hydrogen 3.010 N/A LYS 144.A N THR 141.A OG1 no hydrogen 3.222 N/A SER 145.A N THR 141.A O no hydrogen 3.177 N/A SER 145.A OG THR 141.A O no hydrogen 2.823 N/A LEU 146.A N LYS 142.A O no hydrogen 3.085 N/A ARG 147.A NH2 ASP 88.A OD2 no hydrogen 2.804 N/A ILE 148.A N LYS 144.A O no hydrogen 3.419 N/A ALA 149.A N SER 145.A O no hydrogen 3.302 N/A GLU 150.A N LEU 146.A O no hydrogen 2.624 N/A TYR 151.A N ARG 147.A O no hydrogen 2.825 N/A ALA 152.A N ILE 148.A O no hydrogen 3.142 N/A PHE 153.A N ALA 149.A O no hydrogen 3.216 N/A LYS 154.A N GLU 150.A O no hydrogen 3.198 N/A LYS 154.A NZ GLU 158.A OE1 no hydrogen 2.510 N/A LYS 154.A NZ GLU 158.A OE2 no hydrogen 3.371 N/A LEU 155.A N TYR 151.A O no hydrogen 2.786 N/A ALA 156.A N ALA 152.A O no hydrogen 2.623 N/A GLN 157.A N PHE 153.A O no hydrogen 2.774 N/A GLN 157.A NE2 GLN 193.A OE1 no hydrogen 3.094 N/A GLU 158.A N LYS 154.A O no hydrogen 3.069 N/A SER 159.A N LEU 155.A O no hydrogen 2.995 N/A SER 159.A OG LEU 155.A O no hydrogen 2.754 N/A GLY 160.A N GLN 157.A O no hydrogen 3.230 N/A ARG 161.A N ALA 156.A O no hydrogen 3.009 N/A ARG 161.A NH1 ASP 110.A O no hydrogen 3.210 N/A ARG 161.A NH1 ASP 216.A OD1 no hydrogen 2.484 N/A ARG 161.A NH2 ASP 110.A OD1 no hydrogen 2.536 N/A LYS 162.A N ASP 216.A OD2 no hydrogen 2.938 N/A LYS 163.A N ASP 216.A OD2 no hydrogen 2.956 N/A LYS 163.A NZ GLN 214.A O no hydrogen 2.941 N/A VAL 164.A N THR 195.A O no hydrogen 2.848 N/A THR 165.A N VAL 217.A O no hydrogen 2.742 N/A ALA 166.A N GLU 197.A O no hydrogen 2.806 N/A VAL 167.A N VAL 219.A O no hydrogen 3.070 N/A HIS 168.A N MET 199.A O no hydrogen 3.083 N/A HIS 168.A NE2 ASN 198.A OD1 no hydrogen 2.699 N/A LYS 169.A N ASP 177.A OD2 no hydrogen 2.823 N/A ALA 170.A N HIS 168.A ND1 no hydrogen 3.189 N/A ILE 172.A N LYS 169.A O no hydrogen 2.926 N/A MET 173.A N LYS 169.A O no hydrogen 2.945 N/A LEU 179.A N LEU 175.A O no hydrogen 3.168 N/A LEU 179.A N GLY 176.A O no hydrogen 3.040 N/A PHE 180.A N GLY 176.A O no hydrogen 3.194 N/A LEU 181.A N ASP 177.A O no hydrogen 2.786 N/A GLN 182.A N GLY 178.A O no hydrogen 2.992 N/A CYS 183.A N LEU 179.A O no hydrogen 2.813 N/A CYS 183.A SG LYS 142.A O no hydrogen 3.663 N/A CYS 183.A SG LEU 179.A O no hydrogen 3.273 N/A CYS 184.A N PHE 180.A O no hydrogen 2.989 N/A CYS 184.A SG PHE 180.A O no hydrogen 3.392 N/A ARG 185.A N LEU 181.A O no hydrogen 3.180 N/A ARG 185.A NH1 GLN 182.A OE1 no hydrogen 2.797 N/A GLU 186.A N GLN 182.A O no hydrogen 3.055 N/A ALA 188.A N CYS 184.A O no hydrogen 2.900 N/A ALA 189.A N ARG 185.A O no hydrogen 3.325 N/A ARG 190.A N VAL 187.A O no hydrogen 2.962 N/A ARG 190.A NH2 GLU 150.A OE1 no hydrogen 3.452 N/A TYR 191.A N ALA 188.A O no hydrogen 3.350 N/A ILE 194.A N TYR 191.A O no hydrogen 3.149 N/A THR 195.A N LYS 162.A O no hydrogen 2.786 N/A GLU 197.A N VAL 164.A O no hydrogen 3.074 N/A MET 199.A N ALA 166.A O no hydrogen 2.771 N/A VAL 201.A N HIS 168.A O no hydrogen 2.820 N/A THR 204.A N ILE 200.A O no hydrogen 2.830 N/A THR 204.A OG1 ILE 200.A O no hydrogen 2.680 N/A THR 205.A N VAL 201.A O no hydrogen 3.080 N/A THR 205.A OG1 ASP 202.A O no hydrogen 2.661 N/A MET 206.A N ASP 202.A O no hydrogen 3.425 N/A GLN 207.A N ASN 203.A O no hydrogen 2.937 N/A GLN 207.A NE2 ASN 203.A OD1 no hydrogen 3.515 N/A LEU 208.A N THR 204.A O no hydrogen 3.121 N/A LEU 208.A N THR 205.A O no hydrogen 3.207 N/A VAL 209.A N THR 205.A O no hydrogen 3.423 N/A SER 210.A N MET 206.A O no hydrogen 3.304 N/A ARG 211.A N GLN 207.A O no hydrogen 2.589 N/A GLN 213.A NE2 LYS 107.A O no hydrogen 3.288 N/A GLN 214.A N ARG 211.A O no hydrogen 3.477 N/A GLN 214.A NE2 GLN 207.A OE1 no hydrogen 2.746 N/A GLN 214.A NE2 ARG 211.A O no hydrogen 3.322 N/A PHE 215.A N PRO 212.A O no hydrogen 3.455 N/A VAL 217.A N LYS 163.A O no hydrogen 2.919 N/A MET 218.A N LEU 112.A O no hydrogen 2.789 N/A VAL 219.A N THR 165.A O no hydrogen 2.958 N/A MET 220.A N VAL 114.A O no hydrogen 3.004 N/A ASN 222.A ND2 GLU 119.A O no hydrogen 3.035 N/A LEU 223.A N PRO 221.A O no hydrogen 2.916 N/A TYR 224.A OH ASP 177.A OD2 no hydrogen 2.400 N/A ILE 227.A N TYR 224.A O no hydrogen 3.321 N/A ASN 229.A ND2 ASN 226.A OD1 no hydrogen 3.001 N/A ASN 230.A N ASN 226.A O no hydrogen 3.189 N/A VAL 231.A N ILE 227.A O no hydrogen 2.887 N/A CYS 232.A N VAL 228.A O no hydrogen 3.079 N/A CYS 232.A SG VAL 228.A O no hydrogen 3.248 N/A ALA 233.A N ASN 229.A O no hydrogen 3.003 N/A GLY 234.A N ASN 230.A O no hydrogen 2.916 N/A LEU 235.A N VAL 231.A O no hydrogen 3.016 N/A VAL 236.A N ALA 233.A O no hydrogen 3.256 N/A GLY 237.A N ALA 233.A O no hydrogen 3.312 N/A LEU 241.A N GLY 238.A O no hydrogen 3.154 N/A GLY 244.A N GLU 255.A O no hydrogen 2.662 N/A ALA 245.A N VAL 93.A O no hydrogen 2.900 N/A ASN 246.A N VAL 253.A O no hydrogen 2.865 N/A ASN 246.A ND2 VAL 253.A O no hydrogen 3.117 N/A ASN 246.A ND2 GLU 255.A OE2 no hydrogen 3.233 N/A TYR 247.A N ALA 91.A O no hydrogen 2.840 N/A GLY 248.A N TYR 251.A O no hydrogen 2.859 N/A VAL 253.A N ASN 246.A O no hydrogen 2.901 N/A PHE 254.A N ALA 61.A O no hydrogen 2.825 N/A GLU 255.A N GLY 244.A O no hydrogen 3.162 N/A THR 256.A OG1 THR 258.A O no hydrogen 2.833 N/A ALA 257.A N VAL 242.A O no hydrogen 3.005 N/A ASN 260.A N THR 258.A OG1 no hydrogen 3.151 N/A THR 261.A OG1 GLU 67.A OE1 no hydrogen 2.880 N/A GLY 262.A N ASN 260.A OD1 no hydrogen 3.188 N/A ILE 265.A N GLY 262.A O no hydrogen 3.106 N/A ALA 266.A N LYS 263.A O no hydrogen 3.327 N/A ASN 267.A N GLU 16.A OE1 no hydrogen 2.717 N/A LYS 268.A NZ SER 264.A O no hydrogen 2.966 N/A ASN 269.A ND2 SER 321.A OG no hydrogen 2.973 N/A ASN 272.A ND2 ASP 313.A OD2 no hydrogen 2.925 N/A ALA 275.A N GLY 240.A O no hydrogen 2.997 N/A LEU 277.A N PRO 273.A O no hydrogen 2.929 N/A LEU 278.A N THR 274.A O no hydrogen 2.849 N/A ALA 279.A N ALA 275.A O no hydrogen 3.069 N/A SER 280.A N THR 276.A O no hydrogen 2.899 N/A SER 280.A OG LEU 277.A O no hydrogen 2.384 N/A CYS 281.A N LEU 277.A O no hydrogen 2.887 N/A CYS 281.A SG LEU 277.A O no hydrogen 3.305 N/A CYS 281.A SG ALA 293.A O no hydrogen 3.728 N/A MET 282.A N LEU 278.A O no hydrogen 2.959 N/A MET 283.A N ALA 279.A O no hydrogen 2.926 N/A LEU 284.A N SER 280.A O no hydrogen 2.968 N/A ASP 285.A N CYS 281.A O no hydrogen 2.960 N/A HIS 286.A N MET 282.A O no hydrogen 3.090 N/A LEU 287.A N MET 283.A O no hydrogen 3.170 N/A LYS 288.A N ASP 285.A O no hydrogen 3.172 N/A LEU 289.A N LEU 284.A O no hydrogen 2.920 N/A HIS 290.A ND1 ASP 285.A OD1 no hydrogen 3.176 N/A ALA 293.A N LEU 289.A O no hydrogen 3.217 N/A THR 294.A N HIS 290.A O no hydrogen 3.203 N/A THR 294.A OG1 HIS 290.A O no hydrogen 2.685 N/A SER 295.A N SER 291.A O no hydrogen 3.176 N/A SER 295.A OG SER 291.A O no hydrogen 3.346 N/A ILE 296.A N TYR 292.A O no hydrogen 3.187 N/A ARG 297.A N ALA 293.A O no hydrogen 3.008 N/A LYS 298.A N THR 294.A O no hydrogen 3.060 N/A ALA 299.A N SER 295.A O no hydrogen 3.133 N/A VAL 300.A N ILE 296.A O no hydrogen 2.913 N/A LEU 301.A N ARG 297.A O no hydrogen 2.992 N/A ALA 302.A N LYS 298.A O no hydrogen 3.026 N/A SER 303.A N ALA 299.A O no hydrogen 3.178 N/A SER 303.A OG ALA 299.A O no hydrogen 3.478 N/A SER 303.A OG VAL 300.A O no hydrogen 3.030 N/A MET 304.A N VAL 300.A O no hydrogen 3.098 N/A ASP 305.A N LEU 301.A O no hydrogen 3.310 N/A ASP 305.A N ALA 302.A O no hydrogen 3.047 N/A ASN 308.A N ASN 306.A OD1 no hydrogen 3.201 N/A MET 309.A N ASN 306.A O no hydrogen 3.313 N/A HIS 310.A N GLU 307.A O no hydrogen 3.281 N/A HIS 310.A NE2 MET 304.A O no hydrogen 2.620 N/A THR 311.A OG1 ASP 313.A OD1 no hydrogen 2.612 N/A ILE 314.A N THR 311.A O no hydrogen 3.079 N/A GLY 315.A N PRO 312.A O no hydrogen 3.033 N/A GLY 316.A N THR 311.A O no hydrogen 3.242 N/A GLY 318.A N HIS 310.A O no hydrogen 2.910 N/A THR 319.A N GLU 322.A OE1 no hydrogen 3.151 N/A THR 319.A OG1 SER 321.A OG no hydrogen 3.165 N/A THR 319.A OG1 GLU 322.A OE1 no hydrogen 3.352 N/A THR 320.A N ASN 269.A O no hydrogen 3.215 N/A THR 320.A OG1 ALA 271.A O no hydrogen 2.730 N/A SER 321.A N ASN 269.A OD1 no hydrogen 2.956 N/A SER 321.A OG THR 319.A OG1 no hydrogen 3.165 N/A GLU 322.A N THR 319.A OG1 no hydrogen 3.151 N/A ALA 323.A N THR 319.A O no hydrogen 3.113 N/A ILE 324.A N THR 320.A O no hydrogen 2.927 N/A GLN 325.A N SER 321.A O no hydrogen 2.846 N/A ASP 326.A N GLU 322.A O no hydrogen 3.257 N/A VAL 327.A N ALA 323.A O no hydrogen 2.970 N/A ILE 328.A N ILE 324.A O no hydrogen 2.890 N/A ARG 329.A N GLN 325.A O no hydrogen 2.987 N/A HIS 330.A N ASP 326.A O no hydrogen 3.075 N/A HIS 330.A ND1 ASP 326.A O no hydrogen 2.745 N/A ILE 331.A N VAL 327.A O no hydrogen 3.258 N/A ARG 332.A N ILE 328.A O no hydrogen 3.151 N/A ASN 335.A N ILE 331.A O no hydrogen 3.208 N/A