Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1ak0_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): TRP 1.A N ASP 120.A OD1 no hydrogen 3.321 N/A TRP 1.A N ASP 153.A OD1 no hydrogen 2.783 N/A TRP 1.A NE1 GLY 119.A O no hydrogen 3.001 N/A TRP 1.A NE1 THR 122.A OG1 no hydrogen 3.162 N/A GLY 2.A N ASP 153.A O no hydrogen 2.953 N/A HIS 6.A N GLY 2.A O no hydrogen 3.136 N/A HIS 6.A NE2 ASP 120.A OD1 no hydrogen 2.947 N/A ALA 7.A N ALA 3.A O no hydrogen 3.123 N/A THR 8.A N LEU 4.A O no hydrogen 3.022 N/A THR 8.A OG1 LEU 4.A O no hydrogen 2.713 N/A VAL 9.A N GLY 5.A O no hydrogen 3.034 N/A ALA 10.A N HIS 6.A O no hydrogen 3.168 N/A TYR 11.A N ALA 7.A O no hydrogen 2.879 N/A VAL 12.A N THR 8.A O no hydrogen 2.989 N/A ALA 13.A N VAL 9.A O no hydrogen 3.001 N/A GLN 14.A N ALA 10.A O no hydrogen 2.882 N/A GLN 14.A NE2 SER 34.A O no hydrogen 2.842 N/A HIS 15.A N TYR 11.A O no hydrogen 3.293 N/A HIS 15.A N VAL 12.A O no hydrogen 3.200 N/A TYR 16.A N ALA 13.A O no hydrogen 3.010 N/A TYR 16.A OH GLU 181.A OE2 no hydrogen 2.858 N/A SER 18.A N ASN 261.A OD1 no hydrogen 2.834 N/A SER 18.A OG GLU 20.A OE1 no hydrogen 2.741 N/A ALA 21.A N SER 18.A OG no hydrogen 3.069 N/A ALA 22.A N SER 18.A O no hydrogen 2.914 N/A SER 23.A N PRO 19.A O no hydrogen 3.179 N/A SER 23.A N GLU 20.A O no hydrogen 3.115 N/A SER 23.A OG GLU 20.A O no hydrogen 3.345 N/A TRP 24.A N GLU 20.A O no hydrogen 3.158 N/A ALA 25.A N ALA 21.A O no hydrogen 2.990 N/A GLN 26.A N ALA 22.A O no hydrogen 3.307 N/A GLY 27.A N SER 23.A O no hydrogen 2.968 N/A ILE 28.A N TRP 24.A O no hydrogen 2.914 N/A LEU 29.A N ALA 25.A O no hydrogen 2.780 N/A GLY 30.A N GLY 27.A O no hydrogen 3.122 N/A SER 31.A N GLN 26.A O no hydrogen 3.139 N/A SER 33.A N SER 31.A OG no hydrogen 3.309 N/A SER 33.A OG SER 35.A OG no hydrogen 3.169 N/A SER 35.A N SER 33.A OG no hydrogen 2.914 N/A SER 35.A OG SER 33.A OG no hydrogen 3.169 N/A TYR 36.A N SER 33.A O no hydrogen 3.109 N/A LEU 37.A N GLN 14.A OE1 no hydrogen 2.969 N/A ALA 38.A N GLN 14.A OE1 no hydrogen 3.122 N/A SER 39.A N SER 35.A O no hydrogen 2.933 N/A SER 39.A OG SER 35.A O no hydrogen 2.816 N/A ILE 40.A N LEU 37.A O no hydrogen 3.201 N/A ALA 41.A N ALA 38.A O no hydrogen 3.310 N/A TRP 43.A N ILE 40.A O no hydrogen 3.214 N/A ASP 45.A N SER 42.A O no hydrogen 3.009 N/A GLU 46.A N SER 42.A O no hydrogen 3.393 N/A TYR 47.A N TRP 43.A O no hydrogen 2.893 N/A ARG 48.A N ALA 44.A O no hydrogen 3.283 N/A LEU 49.A N GLU 46.A O no hydrogen 3.050 N/A THR 50.A N TYR 47.A O no hydrogen 3.023 N/A THR 50.A OG1 TYR 47.A O no hydrogen 2.822 N/A GLY 53.A N THR 50.A OG1 no hydrogen 2.922 N/A LYS 54.A N THR 50.A O no hydrogen 2.840 N/A TRP 55.A NE1 TYR 47.A OH no hydrogen 3.141 N/A SER 56.A N GLY 53.A O no hydrogen 2.825 N/A SER 56.A OG GLY 53.A O no hydrogen 2.721 N/A ALA 57.A N LYS 54.A O no hydrogen 3.323 N/A SER 58.A OG SER 83.A O no hydrogen 2.968 N/A SER 58.A OG GLY 84.A O no hydrogen 3.448 N/A LEU 59.A N SER 56.A O no hydrogen 3.024 N/A HIS 60.A N ALA 57.A O no hydrogen 3.366 N/A ILE 62.A N HIS 126.A O no hydrogen 2.890 N/A ALA 64.A N ILE 62.A O no hydrogen 2.987 N/A GLU 65.A N ASP 79.A OD1 no hydrogen 2.880 N/A ASN 67.A N ASN 71.A O no hydrogen 2.793 N/A ASN 71.A N ASN 67.A O no hydrogen 2.829 N/A CYS 72.A SG ASN 213.A O no hydrogen 3.653 N/A ASN 73.A N ASP 66.A OD2 no hydrogen 2.888 N/A ASP 75.A N ASP 79.A OD2 no hydrogen 2.951 N/A ARG 78.A N ASP 75.A OD1 no hydrogen 3.055 N/A ARG 78.A NE ASP 79.A OD1 no hydrogen 2.899 N/A ARG 78.A NH2 ASN 73.A O no hydrogen 3.087 N/A ARG 78.A NH2 ASP 79.A OD2 no hydrogen 2.970 N/A ASP 79.A N ASP 75.A O no hydrogen 2.804 N/A CYS 80.A N TYR 76.A O no hydrogen 2.980 N/A GLY 84.A N GLY 81.A O no hydrogen 3.346 N/A CYS 85.A N SER 88.A OG no hydrogen 3.120 N/A SER 86.A N PHE 61.A O no hydrogen 3.025 N/A SER 88.A OG CYS 85.A O no hydrogen 3.042 N/A ALA 89.A N CYS 85.A O no hydrogen 2.948 N/A ILE 90.A N SER 86.A O no hydrogen 2.996 N/A ALA 91.A N ILE 87.A O no hydrogen 3.265 N/A ASN 92.A N SER 88.A O no hydrogen 2.940 N/A TYR 93.A N ALA 89.A O no hydrogen 3.100 N/A THR 94.A N ILE 90.A O no hydrogen 3.049 N/A THR 94.A OG1 ILE 90.A O no hydrogen 2.697 N/A GLN 95.A N ALA 91.A O no hydrogen 3.360 N/A ARG 96.A N ASN 92.A O no hydrogen 3.112 N/A VAL 97.A N TYR 93.A O no hydrogen 3.168 N/A SER 98.A OG THR 94.A O no hydrogen 3.465 N/A ASP 99.A N ARG 96.A O no hydrogen 3.335 N/A SER 101.A N ASP 99.A OD1 no hydrogen 2.907 N/A LEU 102.A N ASP 99.A O no hydrogen 3.456 N/A SER 103.A N ASN 106.A OD1 no hydrogen 3.043 N/A ASN 106.A N SER 103.A O no hydrogen 2.931 N/A ASN 106.A N SER 103.A OG no hydrogen 3.208 N/A HIS 107.A N SER 103.A O no hydrogen 3.009 N/A HIS 107.A ND1 ARG 96.A O no hydrogen 3.022 N/A ALA 108.A N SER 104.A O no hydrogen 2.938 N/A GLU 109.A N GLU 105.A O no hydrogen 3.188 N/A ALA 110.A N ASN 106.A O no hydrogen 3.023 N/A LEU 111.A N HIS 107.A O no hydrogen 3.005 N/A ARG 112.A N ALA 108.A O no hydrogen 2.999 N/A PHE 113.A N GLU 109.A O no hydrogen 2.956 N/A LEU 114.A N ALA 110.A O no hydrogen 2.926 N/A VAL 115.A N LEU 111.A O no hydrogen 2.934 N/A HIS 116.A N ARG 112.A O no hydrogen 3.349 N/A HIS 116.A ND1 ALA 41.A O no hydrogen 2.682 N/A PHE 117.A N PHE 113.A O no hydrogen 2.960 N/A ILE 118.A N LEU 114.A O no hydrogen 3.121 N/A GLY 119.A N HIS 116.A O no hydrogen 3.245 N/A ASP 120.A N HIS 116.A O no hydrogen 2.992 N/A MET 121.A N PHE 117.A O no hydrogen 3.076 N/A THR 122.A N GLY 119.A O no hydrogen 3.032 N/A THR 122.A OG1 GLY 119.A O no hydrogen 3.102 N/A THR 122.A OG1 GLN 248.A O no hydrogen 2.943 N/A GLN 123.A N ASP 120.A O no hydrogen 3.136 N/A GLN 123.A NE2 ASP 153.A OD1 no hydrogen 2.994 N/A LEU 125.A N GLN 123.A OE1 no hydrogen 2.747 N/A HIS 126.A N GLN 123.A O no hydrogen 2.856 N/A HIS 126.A ND1 HIS 60.A O no hydrogen 2.714 N/A ASP 127.A N PRO 124.A O no hydrogen 3.030 N/A ALA 129.A N ALA 64.A O no hydrogen 3.070 N/A TYR 130.A N GLU 128.A OE2 no hydrogen 2.910 N/A GLY 133.A N ALA 129.A O no hydrogen 3.156 N/A GLY 134.A N TYR 130.A O no hydrogen 2.893 N/A ASN 135.A N VAL 132.A O no hydrogen 2.974 N/A ASN 135.A ND2 VAL 132.A O no hydrogen 3.105 N/A LYS 136.A N ALA 131.A O no hydrogen 2.939 N/A ILE 137.A N GLY 134.A O no hydrogen 3.156 N/A VAL 139.A N ASP 146.A O no hydrogen 3.009 N/A PHE 141.A N TYR 144.A O no hydrogen 2.942 N/A ASP 142.A N ASP 232.A OD1 no hydrogen 2.764 N/A GLY 143.A N ASP 232.A OD2 no hydrogen 2.831 N/A TYR 144.A N PHE 141.A O no hydrogen 2.953 N/A ASP 146.A N VAL 139.A O no hydrogen 3.097 N/A LEU 148.A N ILE 137.A O no hydrogen 2.868 N/A HIS 149.A ND1 GLY 133.A O no hydrogen 2.652 N/A SER 150.A N ASN 147.A OD1 no hydrogen 2.887 N/A SER 150.A OG ASN 147.A O no hydrogen 3.168 N/A ASP 151.A N ASN 147.A O no hydrogen 3.205 N/A TRP 152.A N LEU 148.A O no hydrogen 3.135 N/A TRP 152.A NE1 TYR 237.A OH no hydrogen 2.979 N/A ASP 153.A N HIS 149.A O no hydrogen 2.904 N/A THR 154.A N SER 150.A O no hydrogen 2.898 N/A TYR 155.A N SER 150.A O no hydrogen 3.134 N/A MET 156.A N ASP 151.A O no hydrogen 2.892 N/A GLN 158.A N THR 154.A O no hydrogen 2.997 N/A LYS 159.A N TYR 155.A O no hydrogen 2.969 N/A LYS 159.A NZ ASP 142.A OD2 no hydrogen 3.059 N/A LEU 160.A N MET 156.A O no hydrogen 3.040 N/A ILE 161.A N PRO 157.A O no hydrogen 3.078 N/A GLY 162.A N GLN 158.A O no hydrogen 2.765 N/A ALA 165.A N ASP 168.A OD2 no hydrogen 2.945 N/A ASP 168.A N ALA 165.A O no hydrogen 2.842 N/A ALA 169.A N ALA 165.A O no hydrogen 3.154 N/A GLU 170.A N LEU 166.A O no hydrogen 2.852 N/A SER 171.A N SER 167.A O no hydrogen 3.128 N/A SER 171.A OG ASP 168.A O no hydrogen 3.132 N/A TRP 172.A N ASP 168.A O no hydrogen 3.085 N/A TRP 172.A NE1 GLU 246.A OE1 no hydrogen 3.194 N/A ALA 173.A N ALA 169.A O no hydrogen 2.937 N/A LYS 174.A N GLU 170.A O no hydrogen 3.113 N/A LYS 174.A NZ LYS 174.A O no hydrogen 3.438 N/A THR 175.A N SER 171.A O no hydrogen 3.453 N/A THR 175.A OG1 TRP 172.A O no hydrogen 3.056 N/A LEU 176.A N TRP 172.A O no hydrogen 3.109 N/A VAL 177.A N ALA 173.A O no hydrogen 2.798 N/A GLN 178.A N LYS 174.A O no hydrogen 3.040 N/A ASN 179.A N THR 175.A O no hydrogen 3.046 N/A ILE 180.A N LEU 176.A O no hydrogen 3.031 N/A ILE 180.A N VAL 177.A O no hydrogen 2.978 N/A GLU 181.A N VAL 177.A O no hydrogen 2.957 N/A SER 182.A N GLN 178.A O no hydrogen 2.753 N/A SER 182.A OG SER 182.A O no hydrogen 2.560 N/A GLY 183.A N THR 186.A OG1 no hydrogen 2.942 N/A TYR 185.A N ASN 179.A O no hydrogen 2.897 N/A THR 186.A N GLY 183.A O no hydrogen 3.307 N/A THR 186.A OG1 ASN 179.A O no hydrogen 3.486 N/A THR 186.A OG1 ILE 180.A O no hydrogen 3.028 N/A THR 186.A OG1 GLY 183.A O no hydrogen 3.096 N/A GLN 188.A N TYR 185.A O no hydrogen 2.801 N/A GLN 188.A NE2 ASN 184.A O no hydrogen 3.686 N/A ALA 189.A N TYR 185.A O no hydrogen 2.868 N/A GLY 191.A N GLN 188.A O no hydrogen 2.823 N/A TRP 192.A N ALA 189.A O no hydrogen 3.027 N/A ASP 196.A N ILE 193.A O no hydrogen 3.033 N/A ASN 197.A N THR 204.A OG1 no hydrogen 3.170 N/A ILE 198.A N GLU 262.A OE1 no hydrogen 3.034 N/A SER 199.A N ASN 197.A OD1 no hydrogen 3.062 N/A SER 199.A OG ASN 197.A OD1 no hydrogen 2.850 N/A GLU 200.A N ASN 197.A O no hydrogen 2.774 N/A THR 204.A N GLU 200.A O no hydrogen 2.959 N/A THR 204.A OG1 ASN 197.A O no hydrogen 3.486 N/A THR 204.A OG1 GLU 200.A O no hydrogen 3.006 N/A ALA 205.A N PRO 201.A O no hydrogen 2.916 N/A THR 206.A N ILE 202.A O no hydrogen 2.863 N/A THR 206.A OG1 ILE 202.A O no hydrogen 2.707 N/A ARG 207.A N THR 203.A O no hydrogen 3.214 N/A ARG 207.A N THR 204.A O no hydrogen 2.890 N/A ARG 207.A NE ASP 196.A OD1 no hydrogen 3.503 N/A ARG 207.A NH2 ASP 196.A OD1 no hydrogen 3.088 N/A TRP 208.A N THR 204.A O no hydrogen 3.138 N/A TRP 208.A NE1 ASP 196.A OD2 no hydrogen 3.031 N/A ALA 209.A N ALA 205.A O no hydrogen 2.954 N/A SER 210.A N THR 206.A O no hydrogen 2.904 N/A SER 210.A OG THR 206.A O no hydrogen 2.945 N/A ASP 211.A N ARG 207.A O no hydrogen 3.004 N/A ALA 212.A N TRP 208.A O no hydrogen 3.225 N/A ASN 213.A N ALA 209.A O no hydrogen 2.818 N/A ASN 213.A ND2 ASP 66.A OD2 no hydrogen 2.945 N/A ASN 213.A ND2 ASP 127.A O no hydrogen 2.917 N/A ALA 214.A N SER 210.A O no hydrogen 3.088 N/A LEU 215.A N ALA 212.A O no hydrogen 3.112 N/A VAL 216.A N ASN 213.A O no hydrogen 3.035 N/A CYS 217.A SG PRO 69.A O no hydrogen 3.230 N/A THR 218.A OG1 ALA 214.A O no hydrogen 3.556 N/A VAL 219.A N LEU 215.A O no hydrogen 2.837 N/A VAL 220.A N LEU 215.A O no hydrogen 2.907 N/A MET 221.A N VAL 216.A O no hydrogen 3.024 N/A GLY 224.A N MET 221.A O no hydrogen 3.245 N/A LEU 228.A N ALA 225.A O no hydrogen 2.813 N/A GLN 229.A N ALA 226.A O no hydrogen 3.299 N/A GLN 229.A NE2 ASN 138.A O no hydrogen 3.015 N/A LEU 233.A N THR 140.A O no hydrogen 2.766 N/A TYR 234.A N ASP 232.A OD1 no hydrogen 2.892 N/A TYR 237.A OH VAL 220.A O no hydrogen 2.760 N/A TYR 238.A N LEU 233.A O no hydrogen 3.100 N/A ASP 239.A N PRO 235.A O no hydrogen 2.775 N/A SER 240.A N THR 236.A O no hydrogen 3.330 N/A SER 240.A OG TYR 237.A O no hydrogen 2.853 N/A VAL 241.A N TYR 238.A O no hydrogen 3.145 N/A ILE 242.A N TYR 238.A O no hydrogen 3.011 N/A THR 244.A N VAL 241.A O no hydrogen 2.954 N/A ILE 245.A N VAL 241.A O no hydrogen 3.137 N/A GLU 246.A N ILE 242.A O no hydrogen 3.222 N/A LEU 247.A N ASP 243.A O no hydrogen 3.124 N/A GLN 248.A N THR 244.A O no hydrogen 2.878 N/A GLN 248.A NE2 THR 122.A O no hydrogen 2.857 N/A ILE 249.A N ILE 245.A O no hydrogen 3.063 N/A ALA 250.A N GLU 246.A O no hydrogen 3.010 N/A LYS 251.A N LEU 247.A O no hydrogen 3.020 N/A LYS 251.A NZ ASP 211.A OD1 no hydrogen 3.432 N/A LYS 251.A NZ ASP 211.A OD2 no hydrogen 2.782 N/A LYS 251.A NZ GLN 248.A OE1 no hydrogen 2.997 N/A GLY 252.A N GLN 248.A O no hydrogen 3.168 N/A GLY 253.A N ILE 249.A O no hydrogen 3.134 N/A TYR 254.A N ALA 250.A O no hydrogen 2.991 N/A ARG 255.A N LYS 251.A O no hydrogen 2.871 N/A ARG 255.A NE TRP 192.A O no hydrogen 3.024 N/A ARG 255.A NH2 ASP 211.A OD2 no hydrogen 3.302 N/A LEU 256.A N GLY 252.A O no hydrogen 2.963 N/A ALA 257.A N GLY 253.A O no hydrogen 3.121 N/A ASN 258.A N TYR 254.A O no hydrogen 3.170 N/A TRP 259.A N ARG 255.A O no hydrogen 2.986 N/A TRP 259.A NE1 THR 94.A OG1 no hydrogen 2.990 N/A ILE 260.A N LEU 256.A O no hydrogen 3.058 N/A ASN 261.A N ALA 257.A O no hydrogen 3.059 N/A ASN 261.A ND2 TYR 16.A O no hydrogen 3.209 N/A GLU 262.A N ASN 258.A O no hydrogen 3.047 N/A ILE 263.A N TRP 259.A O no hydrogen 3.061 N/A HIS 264.A N ILE 260.A O no hydrogen 2.930 N/A