Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 2i1q_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): LEU 4.A N LEU 1.A O no hydrogen 2.968 N/A VAL 7.A N LEU 4.A O no hydrogen 3.017 N/A ALA 12.A N GLY 8.A O no hydrogen 2.880 N/A GLU 13.A N PRO 9.A O no hydrogen 3.194 N/A LYS 14.A N SER 10.A O no hydrogen 3.207 N/A LEU 15.A N THR 11.A O no hydrogen 2.937 N/A VAL 16.A N ALA 12.A O no hydrogen 3.023 N/A GLU 17.A N GLU 13.A O no hydrogen 2.964 N/A ALA 18.A N LYS 14.A O no hydrogen 2.949 N/A GLY 19.A N VAL 16.A O no hydrogen 2.927 N/A TYR 20.A N LEU 15.A O no hydrogen 2.847 N/A TYR 20.A OH GLU 33.A OE2 no hydrogen 2.634 N/A LYS 25.A NZ GLY 19.A O no hydrogen 3.006 N/A LYS 25.A NZ GLU 192.A OE1 no hydrogen 3.105 N/A ILE 26.A N ASP 22.A O no hydrogen 3.349 N/A ALA 27.A N PHE 23.A O no hydrogen 2.813 N/A THR 28.A N MET 24.A O no hydrogen 2.955 N/A THR 28.A OG1 MET 24.A O no hydrogen 2.871 N/A THR 28.A OG1 LYS 25.A O no hydrogen 3.387 N/A ALA 29.A N ILE 26.A O no hydrogen 3.165 N/A THR 30.A OG1 GLU 33.A OE1 no hydrogen 3.316 N/A GLU 33.A N THR 30.A OG1 no hydrogen 3.134 N/A LEU 34.A N THR 30.A O no hydrogen 3.241 N/A THR 35.A N VAL 31.A O no hydrogen 2.827 N/A THR 35.A OG1 VAL 31.A O no hydrogen 2.779 N/A THR 35.A OG1 GLY 32.A O no hydrogen 2.536 N/A ASP 36.A N GLY 32.A O no hydrogen 2.836 N/A ILE 37.A N LEU 34.A O no hydrogen 2.923 N/A ILE 40.A N ILE 37.A O no hydrogen 3.047 N/A ALA 44.A N SER 41.A OG no hydrogen 3.307 N/A ALA 45.A N SER 41.A O no hydrogen 2.978 N/A ALA 46.A N GLU 42.A O no hydrogen 2.852 N/A LYS 47.A N LYS 43.A O no hydrogen 2.823 N/A MET 48.A N ALA 44.A O no hydrogen 2.909 N/A ILE 49.A N ALA 45.A O no hydrogen 3.023 N/A MET 50.A N ALA 46.A O no hydrogen 3.119 N/A GLY 51.A N LYS 47.A O no hydrogen 3.012 N/A ALA 52.A N MET 48.A O no hydrogen 2.808 N/A ARG 53.A N ILE 49.A O no hydrogen 2.943 N/A ARG 53.A NE ALA 27.A O no hydrogen 3.276 N/A ASP 54.A N MET 50.A O no hydrogen 3.064 N/A LEU 55.A N GLY 51.A O no hydrogen 2.939 N/A CYS 56.A N ALA 52.A O no hydrogen 2.881 N/A CYS 56.A SG ALA 52.A O no hydrogen 3.359 N/A ASP 57.A N ASP 54.A O no hydrogen 2.832 N/A LEU 58.A N ARG 53.A O no hydrogen 2.878 N/A LYS 61.A NZ ASP 57.A O no hydrogen 3.043 N/A ASP 65.A N SER 62.A O no hydrogen 3.228 N/A LEU 66.A N GLY 63.A O no hydrogen 3.015 N/A LEU 67.A N ILE 64.A O no hydrogen 2.926 N/A LYS 68.A N ILE 64.A O no hydrogen 3.064 N/A GLN 69.A N ASP 65.A O no hydrogen 3.132 N/A ARG 70.A N LEU 66.A O no hydrogen 3.337 N/A ARG 70.A NH1 GLU 92.A OE2 no hydrogen 3.098 N/A ARG 70.A NH2 GLU 92.A OE1 no hydrogen 2.641 N/A ARG 70.A NH2 GLU 92.A OE2 no hydrogen 3.402 N/A SER 71.A N LEU 67.A O no hydrogen 2.963 N/A SER 71.A N LYS 68.A O no hydrogen 3.261 N/A SER 71.A OG LEU 67.A O no hydrogen 2.987 N/A THR 72.A N GLN 69.A O no hydrogen 3.180 N/A THR 72.A OG1 GLN 69.A O no hydrogen 2.740 N/A VAL 73.A N ARG 70.A O no hydrogen 3.329 N/A TRP 74.A N SER 93.A OG no hydrogen 2.983 N/A TRP 74.A NE1 ASN 245.A O no hydrogen 2.792 N/A LYS 75.A N PHE 125.A O no hydrogen 2.852 N/A LYS 75.A NZ GLY 88.A O no hydrogen 2.863 N/A LEU 76.A N LEU 91.A O no hydrogen 2.774 N/A SER 77.A N PHE 123.A O no hydrogen 2.899 N/A SER 77.A OG ASP 84.A OD1 no hydrogen 2.722 N/A THR 78.A N ASP 84.A OD2 no hydrogen 2.832 N/A THR 78.A OG1 ASP 84.A OD2 no hydrogen 2.803 N/A SER 79.A N SER 77.A OG no hydrogen 3.174 N/A SER 80.A N THR 78.A OG1 no hydrogen 3.243 N/A SER 80.A OG ASP 311.A OXT no hydrogen 3.222 N/A SER 81.A N ASP 311.A O no hydrogen 3.391 N/A SER 81.A N ASP 311.A OXT no hydrogen 2.967 N/A SER 81.A OG ASP 311.A O no hydrogen 2.958 N/A LEU 83.A N SER 80.A OG no hydrogen 3.153 N/A ASP 84.A N SER 80.A O no hydrogen 2.937 N/A SER 85.A N SER 81.A O no hydrogen 3.056 N/A VAL 86.A N GLU 82.A O no hydrogen 2.947 N/A LEU 87.A N LEU 83.A O no hydrogen 2.932 N/A GLY 88.A N SER 85.A O no hydrogen 2.905 N/A GLY 89.A N ASP 84.A O no hydrogen 2.691 N/A LEU 91.A N LEU 76.A O no hydrogen 2.792 N/A SER 93.A N TRP 74.A O no hydrogen 2.947 N/A SER 93.A OG TRP 74.A O no hydrogen 3.290 N/A SER 93.A OG ASN 245.A OD1 no hydrogen 2.689 N/A GLN 94.A N CYS 246.A O no hydrogen 2.955 N/A GLN 94.A NE2 THR 72.A OG1 no hydrogen 3.030 N/A GLN 94.A NE2 ASN 245.A OD1 no hydrogen 2.959 N/A SER 95.A OG GLN 94.A O no hydrogen 3.056 N/A VAL 96.A N THR 272.A OG1 no hydrogen 2.898 N/A THR 97.A N VAL 248.A O no hydrogen 2.902 N/A GLU 98.A N PHE 273.A O no hydrogen 2.869 N/A PHE 99.A N VAL 250.A O no hydrogen 2.849 N/A ALA 100.A N PHE 275.A O no hydrogen 2.986 N/A GLY 101.A N ASN 252.A O no hydrogen 3.331 N/A SER 105.A N VAL 102.A O no hydrogen 3.199 N/A SER 105.A OG VAL 102.A O no hydrogen 2.717 N/A LYS 107.A NZ GLY 101.A O no hydrogen 2.877 N/A THR 108.A OG1 ASP 207.A OD1 no hydrogen 3.528 N/A THR 108.A OG1 ASP 207.A OD2 no hydrogen 2.667 N/A ILE 110.A N GLY 106.A O no hydrogen 2.957 N/A MET 111.A N LYS 107.A O no hydrogen 3.170 N/A HIS 112.A N THR 108.A O no hydrogen 3.023 N/A GLN 113.A N GLN 109.A O no hydrogen 2.861 N/A GLN 113.A NE2 GLN 113.A O no hydrogen 3.591 N/A GLN 113.A NE2 ASN 117.A OD1 no hydrogen 3.008 N/A SER 114.A N ILE 110.A O no hydrogen 2.964 N/A SER 114.A OG ILE 110.A O no hydrogen 2.823 N/A CYS 115.A N MET 111.A O no hydrogen 3.234 N/A CYS 115.A SG MET 111.A O no hydrogen 3.539 N/A VAL 116.A N HIS 112.A O no hydrogen 3.123 N/A ASN 117.A N GLN 113.A O no hydrogen 2.772 N/A ASN 117.A ND2 SER 77.A O no hydrogen 2.891 N/A ASN 117.A ND2 SER 79.A OG no hydrogen 2.833 N/A LEU 118.A N SER 114.A O no hydrogen 3.003 N/A GLN 119.A N VAL 116.A O no hydrogen 2.989 N/A GLN 119.A NE2 PRO 139.A O no hydrogen 3.028 N/A ASN 120.A N ASN 117.A O no hydrogen 2.934 N/A GLU 122.A N ASN 120.A OD1 no hydrogen 3.131 N/A PHE 123.A N ASN 120.A O no hydrogen 2.710 N/A LEU 124.A N PRO 121.A O no hydrogen 3.354 N/A PHE 125.A N LYS 75.A O no hydrogen 2.761 N/A GLU 129.A N ASP 127.A OD1 no hydrogen 2.716 N/A ALA 130.A N ASP 127.A O no hydrogen 2.842 N/A VAL 131.A N ASP 127.A O no hydrogen 2.730 N/A GLU 135.A N SER 132.A O no hydrogen 3.011 N/A GLU 135.A N SER 132.A OG no hydrogen 3.244 N/A VAL 136.A N LYS 133.A O no hydrogen 3.304 N/A ALA 137.A N GLY 134.A O no hydrogen 3.285 N/A LYS 140.A N ASN 200.A O no hydrogen 2.937 N/A ALA 141.A N ASN 172.A O no hydrogen 2.951 N/A VAL 142.A N LEU 203.A O no hydrogen 2.874 N/A TYR 143.A N PHE 174.A O no hydrogen 2.595 N/A TYR 143.A OH HIS 112.A NE2 no hydrogen 3.199 N/A TYR 143.A OH ASP 207.A OD2 no hydrogen 3.157 N/A ILE 144.A N VAL 205.A O no hydrogen 2.821 N/A ASP 145.A N ALA 176.A O no hydrogen 2.926 N/A THR 146.A N ASP 207.A O no hydrogen 2.728 N/A THR 146.A OG1 GLN 184.A OE1 no hydrogen 3.169 N/A GLU 147.A N ASP 145.A OD1 no hydrogen 3.268 N/A THR 149.A N ASP 145.A OD1 no hydrogen 3.162 N/A PHE 150.A N ASP 145.A OD2 no hydrogen 3.022 N/A ARG 151.A NH1 GLY 148.A O no hydrogen 3.029 N/A ARG 151.A NH1 PHE 150.A O no hydrogen 2.747 N/A GLU 153.A N GLU 153.A OE2 no hydrogen 2.639 N/A ARG 154.A N ARG 151.A O no hydrogen 2.983 N/A ARG 154.A NE GLN 109.A OE1 no hydrogen 2.754 N/A ARG 154.A NH1 GLN 109.A OE1 no hydrogen 2.997 N/A ARG 154.A NH1 THR 305.A O no hydrogen 2.748 N/A ARG 154.A NH2 GLN 157.A OE1 no hydrogen 2.814 N/A ARG 154.A NH2 THR 305.A O no hydrogen 3.412 N/A ARG 154.A NH2 GLU 306.A O no hydrogen 2.910 N/A ILE 155.A N ARG 151.A O no hydrogen 3.248 N/A MET 156.A N PRO 152.A O no hydrogen 2.950 N/A GLN 157.A N GLU 153.A O no hydrogen 2.995 N/A MET 158.A N ARG 154.A O no hydrogen 2.906 N/A ALA 159.A N ILE 155.A O no hydrogen 2.826 N/A GLU 160.A N MET 156.A O no hydrogen 2.908 N/A HIS 161.A N GLN 157.A O no hydrogen 3.147 N/A ALA 162.A N MET 158.A O no hydrogen 3.111 N/A ALA 162.A N ALA 159.A O no hydrogen 3.056 N/A GLY 163.A N GLU 160.A O no hydrogen 2.996 N/A ILE 164.A N ALA 159.A O no hydrogen 2.856 N/A GLN 167.A NE2 ASP 171.A OD1 no hydrogen 2.813 N/A THR 168.A N ASP 165.A O no hydrogen 3.152 N/A THR 168.A N ASP 165.A OD2 no hydrogen 3.010 N/A THR 168.A OG1 ASP 165.A OD2 no hydrogen 2.663 N/A VAL 169.A N ASP 165.A O no hydrogen 3.416 N/A VAL 169.A N GLY 166.A O no hydrogen 2.974 N/A LEU 170.A N GLY 166.A O no hydrogen 3.164 N/A ASP 171.A N GLN 167.A O no hydrogen 2.832 N/A ASN 172.A N THR 168.A O no hydrogen 3.126 N/A ASN 172.A N VAL 169.A O no hydrogen 3.074 N/A THR 173.A N LEU 170.A O no hydrogen 3.382 N/A THR 173.A OG1 VAL 169.A O no hydrogen 2.651 N/A PHE 174.A N ALA 141.A O no hydrogen 2.717 N/A ALA 176.A N TYR 143.A O no hydrogen 2.918 N/A ALA 178.A N ASP 145.A O no hydrogen 2.904 N/A SER 181.A N GLU 216.A OE1 no hydrogen 2.569 N/A SER 181.A OG GLU 216.A OE1 no hydrogen 3.373 N/A SER 181.A OG GLU 216.A OE2 no hydrogen 2.458 N/A GLN 184.A N ASN 180.A O no hydrogen 3.082 N/A GLN 184.A NE2 LEU 209.A O no hydrogen 2.969 N/A MET 185.A N SER 181.A O no hydrogen 2.879 N/A LEU 186.A N ASP 182.A O no hydrogen 2.961 N/A PHE 187.A N MET 183.A O no hydrogen 2.864 N/A ALA 188.A N GLN 184.A O no hydrogen 3.216 N/A GLU 189.A N MET 185.A O no hydrogen 2.977 N/A LYS 190.A N LEU 186.A O no hydrogen 2.833 N/A LYS 190.A N PHE 187.A O no hydrogen 3.009 N/A ILE 191.A N ALA 188.A O no hydrogen 3.260 N/A ASP 193.A N LYS 190.A O no hydrogen 2.996 N/A ILE 195.A N ILE 191.A O no hydrogen 3.138 N/A GLN 196.A N GLU 192.A O no hydrogen 2.916 N/A GLU 197.A N ASP 193.A O no hydrogen 2.925 N/A GLU 197.A N LEU 194.A O no hydrogen 3.167 N/A GLY 198.A N ILE 195.A O no hydrogen 2.865 N/A ASN 199.A N LEU 194.A O no hydrogen 3.071 N/A ASN 199.A ND2 LEU 194.A O no hydrogen 2.978 N/A ASN 200.A ND2 GLU 135.A O no hydrogen 2.970 N/A ASN 200.A ND2 ALA 137.A O no hydrogen 2.869 N/A ILE 201.A N ASN 199.A O no hydrogen 2.844 N/A LYS 202.A N LYS 140.A O no hydrogen 2.889 N/A LYS 202.A NZ ASN 200.A OD1 no hydrogen 2.854 N/A LYS 202.A NZ PHE 244.A O no hydrogen 3.199 N/A VAL 204.A N VAL 247.A O no hydrogen 2.874 N/A VAL 205.A N VAL 142.A O no hydrogen 2.777 N/A ILE 206.A N LEU 249.A O no hydrogen 2.860 N/A ASP 207.A N ILE 144.A O no hydrogen 3.085 N/A LEU 209.A N THR 251.A O no hydrogen 3.035 N/A THR 210.A N SER 208.A OG no hydrogen 3.309 N/A THR 210.A OG1 ASN 252.A OD1 no hydrogen 2.516 N/A SER 211.A N SER 208.A OG no hydrogen 3.331 N/A THR 212.A OG1 GLN 184.A OE1 no hydrogen 2.680 N/A ARG 214.A N THR 210.A O no hydrogen 2.919 N/A ARG 214.A NH1 GLN 253.A OE1 no hydrogen 2.786 N/A ASN 215.A N SER 211.A O no hydrogen 3.241 N/A ASN 215.A N THR 212.A O no hydrogen 3.107 N/A GLU 216.A N THR 212.A O no hydrogen 3.013 N/A GLU 216.A N PHE 213.A O no hydrogen 3.229 N/A TYR 217.A N PHE 213.A O no hydrogen 3.034 N/A LYS 222.A N GLY 219.A O no hydrogen 2.782 N/A ARG 226.A N LYS 222.A O no hydrogen 3.263 N/A GLN 227.A N LEU 223.A O no hydrogen 2.897 N/A GLN 228.A N ALA 224.A O no hydrogen 3.012 N/A LYS 229.A N GLU 225.A O no hydrogen 3.338 N/A LYS 229.A NZ SER 181.A OG no hydrogen 2.838 N/A LYS 229.A NZ ASP 182.A OD1 no hydrogen 2.630 N/A LYS 229.A NZ TYR 217.A OH no hydrogen 3.107 N/A LEU 230.A N ARG 226.A O no hydrogen 2.890 N/A GLY 231.A N GLN 227.A O no hydrogen 2.849 N/A ARG 232.A N GLN 228.A O no hydrogen 3.062 N/A ARG 232.A NH2 GLN 228.A OE1 no hydrogen 2.988 N/A HIS 233.A N LYS 229.A O no hydrogen 3.048 N/A MET 234.A N LEU 230.A O no hydrogen 2.963 N/A ALA 235.A N GLY 231.A O no hydrogen 2.955 N/A THR 236.A N ARG 232.A O no hydrogen 3.017 N/A THR 236.A OG1 ARG 232.A O no hydrogen 3.180 N/A LEU 237.A N HIS 233.A O no hydrogen 3.009 N/A ASN 238.A N MET 234.A O no hydrogen 2.883 N/A ASN 238.A ND2 MET 234.A O no hydrogen 3.340 N/A ASN 238.A ND2 ALA 270.A O no hydrogen 3.115 N/A LYS 239.A N ALA 235.A O no hydrogen 2.977 N/A LYS 239.A NZ THR 28.A O no hydrogen 3.343 N/A LYS 239.A NZ THR 28.A OG1 no hydrogen 3.380 N/A LEU 240.A N THR 236.A O no hydrogen 2.936 N/A ALA 241.A N LEU 237.A O no hydrogen 2.975 N/A ASP 242.A N ASN 238.A O no hydrogen 3.144 N/A LEU 243.A N LYS 239.A O no hydrogen 2.844 N/A PHE 244.A N LEU 240.A O no hydrogen 3.086 N/A ASN 245.A N ASP 242.A O no hydrogen 3.465 N/A ASN 245.A ND2 THR 72.A O no hydrogen 3.055 N/A ASN 245.A ND2 GLU 135.A OE1 no hydrogen 2.843 N/A CYS 246.A N ALA 241.A O no hydrogen 3.101 N/A VAL 247.A N LYS 202.A O no hydrogen 2.976 N/A VAL 248.A N SER 95.A O no hydrogen 3.285 N/A LEU 249.A N VAL 204.A O no hydrogen 2.742 N/A VAL 250.A N THR 97.A O no hydrogen 2.960 N/A THR 251.A N ILE 206.A O no hydrogen 3.010 N/A THR 251.A OG1 ASP 207.A OD1 no hydrogen 2.542 N/A ASN 252.A N PHE 99.A O no hydrogen 2.952 N/A ASN 252.A ND2 GLU 98.A OE2 no hydrogen 2.659 N/A ASN 252.A ND2 ILE 262.A O no hydrogen 2.700 N/A GLN 253.A NE2 GLU 147.A OE2 no hydrogen 3.180 N/A SER 255.A N GLN 260.A O no hydrogen 3.118 N/A GLN 260.A N SER 255.A O no hydrogen 3.190 N/A ILE 262.A N GLN 253.A O no hydrogen 3.071 N/A GLY 268.A N GLY 264.A O no hydrogen 3.437 N/A HIS 269.A N HIS 265.A O no hydrogen 2.827 N/A ALA 270.A N ILE 266.A O no hydrogen 2.872 N/A ALA 271.A N VAL 267.A O no hydrogen 2.882 N/A THR 272.A N VAL 96.A O no hydrogen 2.800 N/A THR 272.A OG1 VAL 96.A O no hydrogen 3.336 N/A PHE 273.A N VAL 96.A O no hydrogen 3.091 N/A ARG 274.A N ASP 291.A O no hydrogen 2.898 N/A ARG 274.A NE GLU 98.A OE1 no hydrogen 2.456 N/A ARG 274.A NH2 GLU 98.A OE1 no hydrogen 3.083 N/A ARG 274.A NH2 GLU 98.A OE2 no hydrogen 3.077 N/A PHE 275.A N GLU 98.A O no hydrogen 2.831 N/A PHE 276.A N LYS 288.A O no hydrogen 2.954 N/A VAL 277.A N ALA 100.A O no hydrogen 2.754 N/A ARG 278.A N VAL 286.A O no hydrogen 2.794 N/A ARG 278.A NH2 GLU 299.A OE1 no hydrogen 3.307 N/A LYS 279.A NZ PHE 103.A O no hydrogen 3.078 N/A GLY 280.A N LYS 284.A O no hydrogen 2.763 N/A LYS 284.A N LYS 281.A O no hydrogen 3.022 N/A LYS 284.A NZ ASP 311.A OD2 no hydrogen 3.322 N/A ARG 285.A N PHE 302.A O no hydrogen 2.717 N/A ARG 285.A NE SER 105.A O no hydrogen 2.916 N/A ARG 285.A NH1 GLY 282.A O no hydrogen 3.285 N/A ARG 285.A NH1 LYS 284.A O no hydrogen 3.213 N/A ARG 285.A NH2 GLY 104.A O no hydrogen 3.116 N/A VAL 286.A N ARG 278.A O no hydrogen 2.925 N/A ALA 287.A N ALA 300.A O no hydrogen 2.810 N/A LYS 288.A N PHE 276.A O no hydrogen 2.818 N/A LEU 289.A N ALA 298.A O no hydrogen 2.758 N/A TYR 290.A N ARG 274.A O no hydrogen 2.979 N/A LEU 295.A N SER 292.A OG no hydrogen 2.966 N/A ALA 298.A N LEU 289.A O no hydrogen 3.111 N/A ALA 300.A N ALA 287.A O no hydrogen 2.846 N/A ILE 301.A N GLU 82.A OE1 no hydrogen 2.866 N/A PHE 302.A N ARG 285.A O no hydrogen 2.925 N/A ARG 303.A N GLN 310.A O no hydrogen 3.001 N/A ARG 303.A NE ASP 283.A OD1 no hydrogen 2.956 N/A ARG 303.A NH1 ASP 283.A OD2 no hydrogen 3.115 N/A ILE 304.A N ASP 283.A O no hydrogen 3.042 N/A THR 305.A N GLY 308.A O no hydrogen 2.907 N/A THR 305.A OG1 GLN 310.A OE1 no hydrogen 2.654 N/A LYS 307.A N THR 305.A OG1 no hydrogen 3.076 N/A GLY 308.A N THR 305.A O no hydrogen 2.806 N/A ILE 309.A N GLN 113.A OE1 no hydrogen 2.776 N/A GLN 310.A N ARG 303.A O no hydrogen 3.018 N/A