Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3m1r_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): LEU 8.A N TYR 5.A O no hydrogen 2.999 N/A ARG 9.A NE SER 13.A OG no hydrogen 3.307 N/A SER 13.A N GLU 10.A O no hydrogen 2.947 N/A SER 13.A OG GLU 10.A O no hydrogen 2.754 N/A LYS 16.A NZ ASP 24.A OD1 no hydrogen 3.156 N/A ASP 19.A N ASP 17.A OD1 no hydrogen 2.873 N/A VAL 20.A N ASP 17.A O no hydrogen 3.257 N/A LYS 22.A N ASP 24.A OD2 no hydrogen 2.929 N/A SER 23.A OG LYS 66.A O no hydrogen 3.453 N/A ASP 24.A N LYS 22.A O no hydrogen 2.908 N/A ALA 27.A N LEU 84.A O no hydrogen 3.194 N/A TRP 29.A N ASP 86.A O no hydrogen 3.179 N/A TRP 29.A NE1 GLN 32.A O no hydrogen 2.935 N/A ASP 30.A N GLN 32.A OE1 no hydrogen 2.807 N/A GLN 32.A N GLN 32.A OE1 no hydrogen 2.569 N/A GLY 36.A N ASP 116.A O no hydrogen 2.604 N/A ALA 38.A N VAL 118.A O no hydrogen 3.241 N/A LEU 39.A N TYR 85.A O no hydrogen 2.838 N/A ILE 40.A N LEU 120.A O no hydrogen 2.952 N/A GLY 41.A N GLY 88.A O no hydrogen 2.762 N/A VAL 42.A N LEU 122.A O no hydrogen 2.802 N/A LEU 44.A N VAL 42.A O no hydrogen 2.817 N/A SER 45.A OG SER 52.A O no hydrogen 2.929 N/A SER 47.A OG ASP 125.A OD1 no hydrogen 2.630 N/A SER 47.A OG ASP 125.A OD2 no hydrogen 3.250 N/A SER 47.A OG SER 127.A OG no hydrogen 2.936 N/A SER 48.A N SER 45.A O no hydrogen 2.933 N/A SER 48.A OG ASP 125.A OD1 no hydrogen 3.148 N/A SER 50.A OG HIS 51.A O no hydrogen 3.445 N/A GLY 53.A N ASP 283.A OD2 no hydrogen 2.763 N/A ALA 54.A N SER 52.A OG no hydrogen 2.958 N/A SER 55.A N SER 45.A OG no hydrogen 2.861 N/A PHE 56.A N GLY 53.A O no hydrogen 2.807 N/A ALA 57.A N ALA 54.A O no hydrogen 2.857 N/A THR 60.A N PHE 56.A O no hydrogen 3.267 N/A THR 60.A OG1 ALA 57.A O no hydrogen 3.266 N/A THR 60.A OG1 SER 292.A OG no hydrogen 2.568 N/A ILE 61.A N ALA 57.A O no hydrogen 2.702 N/A ARG 62.A N PRO 58.A O no hydrogen 3.008 N/A ARG 62.A NE ASP 86.A OD2 no hydrogen 2.641 N/A ARG 62.A NH1 ASP 89.A OD1 no hydrogen 2.953 N/A ARG 62.A NH2 ASP 86.A OD1 no hydrogen 3.115 N/A ARG 62.A NH2 GLY 88.A O no hydrogen 3.168 N/A ARG 62.A NH2 ASP 89.A OD1 no hydrogen 3.001 N/A GLN 63.A N GLY 59.A O no hydrogen 3.161 N/A GLN 63.A NE2 HIS 67.A NE2 no hydrogen 3.511 N/A ALA 64.A N THR 60.A O no hydrogen 2.995 N/A LEU 65.A N ILE 61.A O no hydrogen 2.792 N/A LYS 66.A N ARG 62.A O no hydrogen 2.832 N/A HIS 67.A N GLN 63.A O no hydrogen 3.169 N/A SER 68.A N LEU 65.A O no hydrogen 2.860 N/A SER 68.A OG ALA 64.A O no hydrogen 2.734 N/A SER 68.A OG LEU 65.A O no hydrogen 3.247 N/A ALA 70.A N THR 21.A O no hydrogen 3.063 N/A TYR 71.A N SER 69.A OG no hydrogen 2.965 N/A SER 72.A N GLU 77.A O no hydrogen 3.196 N/A LEU 75.A N SER 72.A O no hydrogen 3.331 N/A LEU 75.A N SER 72.A OG no hydrogen 3.250 N/A GLY 76.A N ALA 73.A O no hydrogen 3.300 N/A VAL 79.A N ALA 70.A O no hydrogen 2.876 N/A GLU 82.A N GLU 82.A OE1 no hydrogen 2.474 N/A LEU 84.A N LEU 25.A O no hydrogen 2.871 N/A ASP 86.A N ALA 27.A O no hydrogen 2.926 N/A LEU 87.A N LEU 39.A O no hydrogen 2.884 N/A GLY 88.A N ASP 86.A OD1 no hydrogen 2.831 N/A ILE 90.A N GLY 41.A O no hydrogen 2.772 N/A LYS 99.A N ASP 96.A OD1 no hydrogen 3.423 N/A SER 100.A N ASP 96.A O no hydrogen 3.300 N/A SER 100.A OG HIS 93.A O no hydrogen 3.368 N/A SER 100.A OG ASP 96.A O no hydrogen 2.846 N/A HIS 101.A N ILE 97.A O no hydrogen 3.084 N/A HIS 101.A ND1 ILE 97.A O no hydrogen 3.241 N/A HIS 101.A NE2 SER 127.A O no hydrogen 2.979 N/A HIS 102.A N VAL 98.A O no hydrogen 3.027 N/A HIS 103.A N LYS 99.A O no hydrogen 2.913 N/A ILE 104.A N SER 100.A O no hydrogen 3.050 N/A PHE 105.A N HIS 101.A O no hydrogen 3.164 N/A GLN 106.A N HIS 102.A O no hydrogen 2.885 N/A THR 107.A N HIS 103.A O no hydrogen 2.840 N/A THR 107.A OG1 HIS 103.A O no hydrogen 2.881 N/A ALA 109.A N GLN 106.A O no hydrogen 2.987 N/A LEU 110.A N THR 107.A O no hydrogen 3.048 N/A SER 112.A N HIS 108.A O no hydrogen 2.860 N/A SER 112.A OG HIS 108.A O no hydrogen 3.017 N/A ASP 113.A N ALA 109.A O no hydrogen 2.972 N/A HIS 114.A N LEU 110.A O no hydrogen 2.698 N/A TRP 117.A N HIS 114.A O no hydrogen 2.802 N/A TRP 117.A NE1 ALA 38.A O no hydrogen 3.080 N/A VAL 118.A N GLY 36.A O no hydrogen 2.854 N/A LEU 120.A N ALA 38.A O no hydrogen 3.075 N/A ILE 121.A N ILE 277.A O no hydrogen 2.831 N/A LEU 122.A N ILE 40.A O no hydrogen 2.898 N/A GLY 123.A N ILE 279.A O no hydrogen 2.871 N/A GLY 124.A N ALA 54.A O no hydrogen 3.129 N/A ASP 125.A N LEU 44.A O no hydrogen 2.713 N/A ASN 126.A N GLU 281.A OE1 no hydrogen 2.649 N/A SER 127.A N ASP 125.A OD2 no hydrogen 2.825 N/A SER 127.A OG SER 47.A OG no hydrogen 2.936 N/A SER 127.A OG HIS 101.A NE2 no hydrogen 3.359 N/A SER 127.A OG ASP 125.A OD2 no hydrogen 2.698 N/A ILE 128.A N ASP 125.A O no hydrogen 3.314 N/A SER 129.A N ASN 126.A O no hydrogen 2.981 N/A SER 129.A OG ASN 126.A O no hydrogen 2.929 N/A SER 129.A OG GLU 278.A OE2 no hydrogen 2.880 N/A TYR 130.A OH GLU 172.A OE1 no hydrogen 2.695 N/A TYR 130.A OH GLU 172.A OE2 no hydrogen 3.211 N/A SER 131.A OG HIS 101.A O no hydrogen 2.595 N/A THR 132.A N ILE 128.A O no hydrogen 2.999 N/A THR 132.A OG1 ILE 128.A O no hydrogen 3.277 N/A THR 132.A OG1 SER 129.A O no hydrogen 3.254 N/A THR 132.A OG1 GLU 278.A OE1 no hydrogen 2.688 N/A ILE 133.A N SER 129.A O no hydrogen 3.000 N/A LYS 134.A N TYR 130.A O no hydrogen 3.142 N/A LYS 134.A NZ TYR 130.A OH no hydrogen 2.517 N/A ALA 135.A N SER 131.A O no hydrogen 3.307 N/A ILE 136.A N THR 132.A O no hydrogen 3.198 N/A ALA 137.A N ILE 133.A O no hydrogen 2.843 N/A GLN 138.A N LYS 134.A O no hydrogen 3.034 N/A THR 139.A N ILE 136.A O no hydrogen 3.229 N/A LYS 140.A N ILE 136.A O no hydrogen 2.608 N/A LYS 140.A NZ PRO 115.A O no hydrogen 2.825 N/A GLY 141.A N ALA 137.A O no hydrogen 3.000 N/A THR 143.A OG1 GLY 141.A O no hydrogen 2.609 N/A ALA 144.A N PHE 231.A O no hydrogen 2.636 N/A VAL 145.A N HIS 179.A O no hydrogen 3.022 N/A ILE 146.A N PHE 233.A O no hydrogen 2.777 N/A GLN 147.A N ILE 181.A O no hydrogen 2.947 N/A PHE 148.A N SER 235.A O no hydrogen 2.865 N/A ASP 149.A N LEU 183.A O no hydrogen 2.977 N/A HIS 151.A N ASP 149.A OD1 no hydrogen 2.542 N/A HIS 152.A N ASN 190.A OD1 no hydrogen 2.925 N/A HIS 152.A ND1 GLN 182.A OE1 no hydrogen 2.657 N/A ARG 155.A N GLY 163.A O no hydrogen 2.700 N/A ASN 156.A N TYR 194.A OH no hydrogen 3.112 N/A ASN 162.A ND2 GLU 281.A OE1 no hydrogen 3.276 N/A THR 164.A OG1 THR 161.A O no hydrogen 3.012 N/A PHE 166.A N ASP 153.A O no hydrogen 3.180 N/A ARG 167.A N THR 164.A O no hydrogen 2.840 N/A ARG 168.A N THR 164.A O no hydrogen 3.194 N/A LEU 169.A N PRO 165.A O no hydrogen 2.925 N/A LEU 170.A N PHE 166.A O no hydrogen 3.091 N/A ASP 171.A N ARG 167.A O no hydrogen 2.765 N/A GLU 172.A N ARG 168.A O no hydrogen 3.092 N/A GLU 173.A N LEU 170.A O no hydrogen 2.644 N/A HIS 179.A N GLU 176.A O no hydrogen 2.763 N/A LEU 180.A N GLY 177.A O no hydrogen 2.843 N/A ILE 181.A N VAL 145.A O no hydrogen 2.910 N/A GLN 182.A N ASN 204.A O no hydrogen 2.827 N/A GLN 182.A NE2 GLN 147.A OE1 no hydrogen 2.796 N/A GLN 182.A NE2 HIS 152.A O no hydrogen 3.000 N/A LEU 183.A N GLN 147.A O no hydrogen 2.864 N/A GLY 184.A N HIS 206.A O no hydrogen 2.921 N/A ARG 186.A N ALA 150.A O no hydrogen 3.082 N/A ARG 186.A NH2 VAL 239.A O no hydrogen 3.270 N/A ARG 186.A NH2 LEU 240.A O no hydrogen 3.342 N/A SER 189.A N ARG 186.A O no hydrogen 3.049 N/A ASN 190.A ND2 ALA 150.A O no hydrogen 3.054 N/A ASN 190.A ND2 ARG 186.A O no hydrogen 3.540 N/A GLU 195.A N SER 191.A O no hydrogen 2.977 N/A ALA 196.A N GLN 192.A O no hydrogen 2.952 N/A TYR 197.A N ALA 193.A O no hydrogen 2.773 N/A TYR 197.A OH ASP 171.A OD1 no hydrogen 2.605 N/A ALA 198.A N TYR 194.A O no hydrogen 2.993 N/A LYS 199.A N GLU 195.A O no hydrogen 2.707 N/A LYS 199.A NZ GLU 195.A OE2 no hydrogen 3.523 N/A LYS 200.A N ALA 196.A O no hydrogen 2.723 N/A HIS 201.A N TYR 197.A O no hydrogen 3.307 N/A HIS 201.A N ALA 198.A O no hydrogen 3.013 N/A HIS 201.A ND1 TYR 197.A O no hydrogen 2.960 N/A ASN 202.A N LYS 199.A O no hydrogen 3.158 N/A VAL 203.A N ALA 198.A O no hydrogen 3.289 N/A ASN 204.A N LEU 180.A O no hydrogen 2.929 N/A ASN 204.A ND2 GLN 178.A O no hydrogen 3.001 N/A ASN 204.A ND2 LEU 180.A O no hydrogen 3.264 N/A HIS 206.A N GLN 182.A O no hydrogen 2.818 N/A ARG 210.A NH1 GLU 260.A OE1 no hydrogen 3.343 N/A ARG 210.A NH1 GLU 260.A OE2 no hydrogen 2.454 N/A ARG 210.A NH2 GLY 255.A O no hydrogen 3.199 N/A ARG 210.A NH2 GLU 260.A OE1 no hydrogen 2.953 N/A GLU 211.A N ASP 208.A O no hydrogen 3.072 N/A LYS 212.A NZ GLU 220.A OE1 no hydrogen 2.796 N/A GLY 213.A N ILE 209.A O no hydrogen 2.689 N/A THR 217.A N GLY 213.A O no hydrogen 3.014 N/A THR 217.A OG1 GLY 213.A O no hydrogen 2.828 N/A ILE 218.A N LEU 214.A O no hydrogen 3.006 N/A LYS 219.A N ILE 215.A O no hydrogen 2.851 N/A GLU 220.A N PRO 216.A O no hydrogen 3.254 N/A GLU 220.A N THR 217.A O no hydrogen 3.218 N/A ILE 221.A N THR 217.A O no hydrogen 3.161 N/A ILE 221.A N ILE 218.A O no hydrogen 3.130 N/A LEU 222.A N ILE 218.A O no hydrogen 2.753 N/A VAL 225.A N ILE 221.A O no hydrogen 3.279 N/A GLN 226.A N LEU 222.A O no hydrogen 2.900 N/A ASP 227.A N PRO 223.A O no hydrogen 3.015 N/A LYS 228.A N VAL 225.A O no hydrogen 2.951 N/A THR 229.A N GLN 226.A O no hydrogen 3.306 N/A THR 229.A OG1 VAL 225.A O no hydrogen 3.037 N/A ASP 230.A N THR 142.A O no hydrogen 2.977 N/A PHE 231.A N THR 142.A O no hydrogen 3.111 N/A ILE 232.A N ASN 273.A O no hydrogen 3.233 N/A PHE 233.A N ALA 144.A O no hydrogen 2.714 N/A ILE 234.A N GLY 276.A O no hydrogen 3.079 N/A SER 235.A N ILE 146.A O no hydrogen 2.806 N/A SER 235.A OG GLU 278.A OE2 no hydrogen 2.501 N/A VAL 236.A N GLU 278.A O no hydrogen 2.746 N/A ASP 237.A N PHE 148.A O no hydrogen 2.937 N/A VAL 239.A N ASP 237.A O no hydrogen 2.901 N/A ASP 241.A N LEU 256.A O no hydrogen 2.854 N/A GLN 242.A N GLY 252.A O no hydrogen 3.045 N/A SER 243.A N ASP 241.A OD2 no hydrogen 2.864 N/A SER 243.A OG ASP 241.A OD2 no hydrogen 2.709 N/A SER 243.A OG HIS 244.A ND1 no hydrogen 3.133 N/A HIS 244.A N ASP 241.A O no hydrogen 2.822 N/A HIS 244.A ND1 SER 243.A OG no hydrogen 3.133 N/A ALA 245.A N ASP 241.A O no hydrogen 3.015 N/A GLY 247.A N THR 291.A OG1 no hydrogen 3.069 N/A CYS 248.A SG ALA 245.A O no hydrogen 3.891 N/A CYS 248.A SG GLU 281.A O no hydrogen 3.464 N/A GLY 254.A N ASP 241.A OD1 no hydrogen 2.706 N/A GLY 255.A N ASP 241.A OD1 no hydrogen 3.236 N/A LEU 256.A N VAL 239.A O no hydrogen 3.054 N/A TYR 257.A N GLU 260.A OE1 no hydrogen 3.119 N/A LEU 261.A N TYR 257.A O no hydrogen 3.099 N/A LEU 262.A N THR 258.A O no hydrogen 2.859 N/A GLU 263.A N ASP 259.A O no hydrogen 3.116 N/A ALA 264.A N GLU 260.A O no hydrogen 3.407 N/A VAL 265.A N LEU 261.A O no hydrogen 2.907 N/A LYS 266.A N LEU 262.A O no hydrogen 2.921 N/A TYR 267.A N GLU 263.A O no hydrogen 2.914 N/A ILE 268.A N ALA 264.A O no hydrogen 2.944 N/A ALA 269.A N VAL 265.A O no hydrogen 2.966 N/A GLN 271.A N ILE 268.A O no hydrogen 3.030 N/A GLN 271.A NE2 TYR 267.A O no hydrogen 3.088 N/A ALA 275.A N ILE 232.A O no hydrogen 3.029 N/A ILE 277.A N PRO 119.A O no hydrogen 2.986 N/A GLU 278.A N ILE 234.A O no hydrogen 2.888 N/A ILE 279.A N ILE 121.A O no hydrogen 3.005 N/A VAL 280.A N VAL 236.A O no hydrogen 2.917 N/A GLU 281.A N GLY 124.A O no hydrogen 3.293 N/A ASP 283.A N GLY 247.A O no hydrogen 2.857 N/A THR 285.A N ASP 283.A OD1 no hydrogen 2.813 N/A THR 285.A OG1 ASP 283.A OD1 no hydrogen 2.465 N/A THR 285.A OG1 ASP 283.A OD2 no hydrogen 3.366 N/A LEU 286.A N ASP 283.A O no hydrogen 2.868 N/A ASP 287.A N PRO 284.A O no hydrogen 3.396 N/A PHE 288.A N ASP 287.A OD1 no hydrogen 2.936 N/A THR 291.A OG1 ASP 287.A OD1 no hydrogen 2.788 N/A THR 291.A OG1 ASP 287.A OD2 no hydrogen 3.383 N/A SER 292.A OG THR 60.A OG1 no hydrogen 2.568 N/A ARG 293.A N ASP 290.A O no hydrogen 2.899 N/A ARG 293.A NE ASP 290.A OD1 no hydrogen 2.618 N/A ARG 293.A NE ASP 290.A OD2 no hydrogen 3.195 N/A ALA 295.A N THR 291.A O no hydrogen 2.862 N/A ALA 296.A N SER 292.A O no hydrogen 2.813 N/A HIS 297.A N ARG 293.A O no hydrogen 2.951 N/A VAL 298.A N ALA 294.A O no hydrogen 2.987 N/A LEU 299.A N ALA 295.A O no hydrogen 3.232 N/A LEU 300.A N ALA 296.A O no hydrogen 3.100 N/A HIS 301.A N HIS 297.A O no hydrogen 2.961 N/A HIS 301.A ND1 HIS 297.A O no hydrogen 2.947 N/A ALA 302.A N VAL 298.A O no hydrogen 2.952 N/A LEU 303.A N LEU 299.A O no hydrogen 2.739 N/A LYS 304.A N LEU 300.A O no hydrogen 2.846 N/A LYS 304.A NZ GLU 74.A OE2 no hydrogen 3.357 N/A GLY 305.A N HIS 301.A O no hydrogen 2.970 N/A LYS 306.A NZ GLU 77.A OE1 no hydrogen 3.369 N/A LYS 306.A NZ HIS 78.A O no hydrogen 2.708 N/A LEU 307.A N LYS 304.A O no hydrogen 3.135 N/A LEU 307.A N GLY 305.A O no hydrogen 3.005 N/A