Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1v4k_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLU 2.A N GLU 2.A OE2 no hydrogen 2.956 N/A GLU 4.A N TYR 1.A O no hydrogen 2.500 N/A LYS 5.A NZ GLU 8.A OE2 no hydrogen 3.322 N/A VAL 6.A N GLU 2.A O no hydrogen 2.965 N/A LYS 7.A N LEU 3.A O no hydrogen 2.699 N/A GLU 8.A N GLU 4.A O no hydrogen 2.893 N/A ARG 9.A N LYS 5.A O no hydrogen 3.017 N/A ARG 9.A NE SER 55.A OG no hydrogen 2.778 N/A ARG 9.A NH2 SER 55.A OG no hydrogen 3.289 N/A ILE 10.A N VAL 6.A O no hydrogen 2.874 N/A ILE 10.A N LYS 7.A O no hydrogen 3.235 N/A GLU 11.A N LYS 7.A O no hydrogen 3.142 N/A GLN 12.A NE2 GLU 8.A O no hydrogen 3.651 N/A ILE 13.A N ARG 9.A O no hydrogen 2.911 N/A LEU 14.A N ILE 10.A O no hydrogen 2.820 N/A SER 15.A N GLU 11.A O no hydrogen 3.257 N/A SER 15.A OG GLU 11.A O no hydrogen 3.164 N/A SER 15.A OG GLN 12.A O no hydrogen 3.132 N/A GLN 16.A N ILE 13.A O no hydrogen 3.298 N/A PHE 17.A N LEU 14.A O no hydrogen 2.669 N/A PHE 18.A N LEU 14.A O no hydrogen 2.683 N/A ILE 22.A N PRO 19.A O no hydrogen 3.156 N/A MET 23.A N PRO 19.A O no hydrogen 3.359 N/A MET 23.A N GLU 20.A O no hydrogen 3.029 N/A LYS 24.A NZ GLN 21.A O no hydrogen 2.501 N/A ASP 25.A N ILE 22.A O no hydrogen 2.864 N/A LEU 26.A N ILE 22.A O no hydrogen 3.207 N/A LEU 26.A N MET 23.A O no hydrogen 2.925 N/A LEU 28.A N LEU 26.A O no hydrogen 2.578 N/A TYR 29.A OH LYS 7.A O no hydrogen 2.583 N/A VAL 35.A N MET 32.A O no hydrogen 3.207 N/A ARG 36.A N MET 32.A O no hydrogen 3.310 N/A LEU 37.A N LEU 33.A O no hydrogen 3.371 N/A SER 38.A N ARG 34.A O no hydrogen 3.122 N/A SER 38.A OG ALA 164.A O no hydrogen 2.647 N/A ILE 39.A N VAL 35.A O no hydrogen 2.963 N/A LEU 40.A N ARG 36.A O no hydrogen 3.169 N/A SER 41.A N LEU 37.A O no hydrogen 3.142 N/A SER 41.A OG LEU 165.A O no hydrogen 2.526 N/A PHE 42.A N SER 38.A O no hydrogen 2.947 N/A LYS 43.A N ILE 39.A O no hydrogen 2.940 N/A ASN 44.A N LEU 40.A O no hydrogen 2.735 N/A ARG 45.A N SER 41.A O no hydrogen 3.045 N/A ARG 45.A NE GLU 174.A OE1 no hydrogen 3.144 N/A GLY 46.A N LYS 43.A O no hydrogen 2.933 N/A VAL 47.A N PHE 42.A O no hydrogen 2.894 N/A ILE 54.A N GLY 50.A O no hydrogen 3.012 N/A SER 55.A N GLU 51.A O no hydrogen 2.726 N/A SER 55.A OG GLU 51.A O no hydrogen 3.283 N/A SER 56.A N ASP 52.A O no hydrogen 2.678 N/A SER 56.A OG ASP 52.A O no hydrogen 3.016 N/A LEU 57.A N ALA 53.A O no hydrogen 2.954 N/A ALA 58.A N ILE 54.A O no hydrogen 2.970 N/A ALA 59.A N SER 55.A O no hydrogen 2.861 N/A LEU 60.A N SER 56.A O no hydrogen 3.131 N/A GLU 61.A N LEU 57.A O no hydrogen 3.371 N/A LEU 62.A N ALA 58.A O no hydrogen 2.886 N/A VAL 63.A N ALA 59.A O no hydrogen 3.133 N/A HIS 64.A N LEU 60.A O no hydrogen 3.408 N/A LEU 65.A N GLU 61.A O no hydrogen 2.902 N/A ALA 66.A N LEU 62.A O no hydrogen 2.814 N/A PHE 67.A N VAL 63.A O no hydrogen 3.225 N/A LEU 68.A N HIS 64.A O no hydrogen 3.047 N/A LEU 69.A N LEU 65.A O no hydrogen 2.983 N/A HIS 70.A N ALA 66.A O no hydrogen 3.390 N/A HIS 70.A NE2 VAL 96.A O no hydrogen 2.970 N/A ASP 71.A N PHE 67.A O no hydrogen 2.962 N/A ASP 72.A N LEU 68.A O no hydrogen 2.828 N/A VAL 73.A N LEU 69.A O no hydrogen 3.223 N/A ILE 74.A N HIS 70.A O no hydrogen 3.241 N/A ASP 75.A N ASP 71.A O no hydrogen 2.994 N/A GLY 76.A N ASP 72.A O no hydrogen 2.759 N/A GLY 76.A N VAL 73.A O no hydrogen 3.223 N/A ALA 77.A N ASP 72.A O no hydrogen 3.235 N/A ARG 78.A NE GLU 84.A OE2 no hydrogen 3.222 N/A ARG 78.A NH2 GLU 84.A OE2 no hydrogen 3.111 N/A ARG 80.A N LYS 83.A O no hydrogen 2.548 N/A ARG 80.A NE ASP 72.A OD1 no hydrogen 3.299 N/A ARG 80.A NE ASP 72.A OD2 no hydrogen 3.276 N/A ARG 80.A NH2 ASP 72.A OD1 no hydrogen 3.480 N/A LYS 83.A NZ LYS 24.A O no hydrogen 2.947 N/A LYS 83.A NZ LEU 26.A O no hydrogen 3.223 N/A THR 85.A N ARG 78.A O no hydrogen 2.620 N/A THR 85.A OG1 ALA 77.A O no hydrogen 2.517 N/A THR 85.A OG1 ARG 78.A O no hydrogen 3.009 N/A THR 85.A OG1 ASN 87.A OD1 no hydrogen 3.261 N/A TYR 90.A OH ASP 25.A OD2 no hydrogen 2.898 N/A GLY 91.A N ASN 87.A O no hydrogen 2.696 N/A ALA 95.A N GLY 91.A O no hydrogen 3.238 N/A VAL 96.A N ASP 92.A O no hydrogen 2.746 N/A ALA 97.A N LYS 93.A O no hydrogen 2.952 N/A ALA 98.A N ALA 94.A O no hydrogen 2.968 N/A GLY 99.A N ALA 95.A O no hydrogen 2.976 N/A ASP 100.A N VAL 96.A O no hydrogen 3.147 N/A LEU 101.A N ALA 97.A O no hydrogen 2.926 N/A VAL 102.A N ALA 98.A O no hydrogen 3.041 N/A VAL 104.A N ASP 100.A O no hydrogen 2.972 N/A SER 105.A N LEU 101.A O no hydrogen 2.916 N/A SER 105.A OG VAL 102.A O no hydrogen 2.402 N/A ALA 106.A N VAL 102.A O no hydrogen 3.184 N/A PHE 107.A N LEU 103.A O no hydrogen 3.039 N/A HIS 108.A N VAL 104.A O no hydrogen 2.784 N/A THR 109.A N SER 105.A O no hydrogen 2.866 N/A THR 109.A OG1 SER 105.A O no hydrogen 2.671 N/A VAL 110.A N ALA 106.A O no hydrogen 2.941 N/A GLU 111.A N PHE 107.A O no hydrogen 2.749 N/A GLU 111.A N HIS 108.A O no hydrogen 3.175 N/A GLU 112.A N HIS 108.A O no hydrogen 3.147 N/A ILE 113.A N THR 109.A O no hydrogen 3.390 N/A GLY 114.A N GLU 111.A O no hydrogen 3.137 N/A ASN 115.A ND2 LEU 170.A O no hydrogen 2.936 N/A LEU 118.A N ASN 115.A OD1 no hydrogen 2.916 N/A ARG 119.A N ASN 115.A O no hydrogen 2.920 N/A ARG 120.A N ASN 116.A O no hydrogen 3.181 N/A ALA 121.A N LYS 117.A O no hydrogen 2.973 N/A PHE 122.A N LEU 118.A O no hydrogen 3.259 N/A LEU 123.A N ARG 119.A O no hydrogen 3.383 N/A ASN 124.A N ARG 120.A O no hydrogen 2.898 N/A VAL 125.A N ALA 121.A O no hydrogen 2.831 N/A ILE 126.A N PHE 122.A O no hydrogen 2.750 N/A GLY 127.A N LEU 123.A O no hydrogen 2.835 N/A LYS 128.A N ASN 124.A O no hydrogen 3.063 N/A LYS 128.A NZ ASN 124.A OD1 no hydrogen 2.511 N/A MET 129.A N VAL 125.A O no hydrogen 3.072 N/A SER 130.A N ILE 126.A O no hydrogen 3.306 N/A GLU 131.A N GLY 127.A O no hydrogen 3.054 N/A ALA 132.A N LYS 128.A O no hydrogen 3.001 N/A GLU 133.A N MET 129.A O no hydrogen 3.032 N/A LEU 134.A N SER 130.A O no hydrogen 3.144 N/A ILE 135.A N GLU 131.A O no hydrogen 2.912 N/A GLU 136.A N ALA 132.A O no hydrogen 2.788 N/A GLN 137.A N GLU 133.A O no hydrogen 3.126 N/A LEU 138.A N LEU 134.A O no hydrogen 2.892 N/A SER 139.A N GLU 136.A O no hydrogen 3.262 N/A SER 139.A OG ILE 135.A O no hydrogen 3.091 N/A ARG 140.A N GLN 137.A O no hydrogen 3.287 N/A LYS 142.A N SER 139.A O no hydrogen 3.461 N/A THR 145.A N GLU 148.A OE2 no hydrogen 3.476 N/A THR 145.A OG1 GLU 148.A OE2 no hydrogen 3.477 N/A TYR 149.A N THR 145.A O no hydrogen 3.005 N/A TYR 149.A OH ASP 195.A OD1 no hydrogen 2.768 N/A LEU 150.A N LYS 146.A O no hydrogen 3.009 N/A ARG 151.A N GLU 147.A O no hydrogen 3.235 N/A ILE 152.A N GLU 148.A O no hydrogen 3.059 N/A ILE 152.A N TYR 149.A O no hydrogen 3.253 N/A VAL 153.A N TYR 149.A O no hydrogen 3.017 N/A GLU 154.A N LEU 150.A O no hydrogen 2.781 N/A LYS 156.A N ILE 152.A O no hydrogen 3.003 N/A LYS 156.A NZ GLU 136.A OE1 no hydrogen 2.949 N/A SER 157.A N VAL 153.A O no hydrogen 2.772 N/A SER 157.A OG GLY 187.A O no hydrogen 2.755 N/A GLY 158.A N VAL 153.A O no hydrogen 2.838 N/A ALA 159.A N GLU 154.A O no hydrogen 2.563 N/A GLY 162.A N GLY 158.A O no hydrogen 2.749 N/A LEU 163.A N ALA 159.A O no hydrogen 3.119 N/A ALA 164.A N LEU 160.A O no hydrogen 3.108 N/A LEU 165.A N PHE 161.A O no hydrogen 3.182 N/A GLN 166.A N GLY 162.A O no hydrogen 3.205 N/A GLN 166.A NE2 LEU 175.A O no hydrogen 2.930 N/A GLN 166.A NE2 GLY 176.A O no hydrogen 3.541 N/A LEU 170.A N GLN 166.A O no hydrogen 3.331 N/A LEU 171.A N LEU 167.A O no hydrogen 2.959 N/A GLU 172.A N ALA 169.A O no hydrogen 2.935 N/A GLY 173.A N LEU 170.A O no hydrogen 3.021 N/A GLU 174.A N ALA 169.A O no hydrogen 2.692 N/A TYR 180.A N GLY 176.A O no hydrogen 3.148 N/A ASN 181.A N GLU 177.A O no hydrogen 2.905 N/A LEU 182.A N ASP 178.A O no hydrogen 2.921 N/A GLY 183.A N LEU 179.A O no hydrogen 2.965 N/A VAL 184.A N TYR 180.A O no hydrogen 3.034 N/A THR 185.A N ASN 181.A O no hydrogen 3.162 N/A THR 185.A OG1 ASN 181.A O no hydrogen 3.231 N/A ILE 186.A N LEU 182.A O no hydrogen 2.861 N/A GLY 187.A N GLY 183.A O no hydrogen 2.612 N/A THR 188.A N VAL 184.A O no hydrogen 3.064 N/A THR 188.A OG1 VAL 184.A O no hydrogen 2.838 N/A ILE 189.A N THR 185.A O no hydrogen 3.120 N/A TYR 190.A N ILE 186.A O no hydrogen 2.872 N/A GLN 191.A N GLY 187.A O no hydrogen 3.038 N/A GLN 191.A NE2 GLN 191.A O no hydrogen 3.356 N/A GLN 191.A NE2 ASP 195.A OD2 no hydrogen 2.989 N/A MET 192.A N THR 188.A O no hydrogen 2.916 N/A PHE 193.A N ILE 189.A O no hydrogen 2.947 N/A ASP 194.A N TYR 190.A O no hydrogen 3.101 N/A ASP 195.A N GLN 191.A O no hydrogen 2.848 N/A ILE 196.A N MET 192.A O no hydrogen 3.188 N/A MET 197.A N PHE 193.A O no hydrogen 3.048 N/A ASP 198.A N ASP 194.A O no hydrogen 3.150 N/A PHE 199.A N ASP 195.A O no hydrogen 3.046 N/A ALA 200.A N ILE 196.A O no hydrogen 2.964 N/A GLY 201.A N MET 197.A O no hydrogen 2.778 N/A MET 202.A N PHE 199.A O no hydrogen 3.329 N/A LYS 204.A NZ GLU 203.A OE2 no hydrogen 3.092 N/A GLY 206.A N PHE 210.A O no hydrogen 2.695 N/A GLY 209.A N GLY 206.A O no hydrogen 2.985 N/A PHE 210.A N ASP 208.A OD1 no hydrogen 3.378 N/A LYS 214.A N ASP 198.A OD2 no hydrogen 2.730 N/A LYS 214.A NZ ASP 194.A OD2 no hydrogen 3.210 N/A GLY 216.A N LEU 213.A O no hydrogen 2.920 N/A ALA 218.A N ASN 215.A O no hydrogen 3.272 N/A SER 219.A N VAL 217.A O no hydrogen 2.588 N/A PHE 220.A N ASP 195.A OD1 no hydrogen 2.966 N/A VAL 223.A N SER 219.A O no hydrogen 2.785 N/A THR 224.A N PHE 220.A O no hydrogen 2.841 N/A THR 224.A OG1 PHE 220.A O no hydrogen 2.702 N/A ALA 225.A N PRO 221.A O no hydrogen 3.040 N/A MET 226.A N LEU 222.A O no hydrogen 2.999 N/A GLU 227.A N VAL 223.A O no hydrogen 2.968 N/A GLU 227.A N THR 224.A O no hydrogen 3.292 N/A LYS 228.A N THR 224.A O no hydrogen 3.259 N/A PHE 229.A N ALA 225.A O no hydrogen 2.902 N/A ARG 233.A N PHE 229.A O no hydrogen 3.230 N/A GLN 234.A N PRO 230.A O no hydrogen 2.982 N/A GLN 234.A NE2 ASN 238.A OD1 no hydrogen 3.470 N/A MET 235.A N GLU 231.A O no hydrogen 3.215 N/A PHE 236.A N ALA 232.A O no hydrogen 3.214 N/A GLU 237.A N ARG 233.A O no hydrogen 3.207 N/A ASN 238.A N GLN 234.A O no hydrogen 2.822 N/A ASN 238.A N MET 235.A O no hydrogen 3.075 N/A ARG 239.A N PHE 236.A O no hydrogen 2.899 N/A ARG 239.A NH1 PHE 236.A O no hydrogen 3.281 N/A ASP 240.A N MET 235.A O no hydrogen 2.858 N/A TRP 241.A N ARG 239.A O no hydrogen 2.855 N/A TRP 241.A NE1 GLY 209.A O no hydrogen 2.917 N/A GLY 243.A N ASP 240.A OD1 no hydrogen 3.405 N/A LEU 244.A N ASP 240.A O no hydrogen 2.743 N/A MET 245.A N TRP 241.A O no hydrogen 2.706 N/A SER 246.A N SER 242.A O no hydrogen 2.924 N/A SER 246.A OG SER 242.A O no hydrogen 3.209 N/A PHE 247.A N GLY 243.A O no hydrogen 2.971 N/A MET 248.A N LEU 244.A O no hydrogen 2.912 N/A ARG 249.A N MET 245.A O no hydrogen 2.969 N/A GLU 250.A N SER 246.A O no hydrogen 3.158 N/A LYS 251.A N PHE 247.A O no hydrogen 2.952 N/A GLY 252.A N ARG 249.A O no hydrogen 3.176 N/A ILE 253.A N MET 248.A O no hydrogen 3.176 N/A GLU 256.A N GLY 252.A O no hydrogen 3.194 N/A CYS 257.A N ILE 253.A O no hydrogen 2.764 N/A CYS 257.A SG THR 224.A OG1 no hydrogen 3.212 N/A CYS 257.A SG ILE 253.A O no hydrogen 3.314 N/A GLU 258.A N LEU 254.A O no hydrogen 2.933 N/A GLU 259.A N LYS 255.A O no hydrogen 2.998 N/A THR 260.A N GLU 256.A O no hydrogen 2.787 N/A THR 260.A OG1 GLU 256.A O no hydrogen 3.372 N/A LEU 261.A N CYS 257.A O no hydrogen 2.894 N/A LYS 262.A N GLU 258.A O no hydrogen 3.067 N/A LYS 262.A NZ GLU 258.A O no hydrogen 3.184 N/A VAL 263.A N GLU 259.A O no hydrogen 3.115 N/A LEU 264.A N THR 260.A O no hydrogen 3.336 N/A VAL 265.A N LEU 261.A O no hydrogen 3.024 N/A LYS 266.A N LYS 262.A O no hydrogen 2.923 N/A ASN 267.A N VAL 263.A O no hydrogen 2.984 N/A ASN 267.A ND2 GLU 271.A OE1 no hydrogen 3.253 N/A VAL 268.A N LEU 264.A O no hydrogen 3.274 N/A ILE 269.A N VAL 265.A O no hydrogen 3.229 N/A ILE 269.A N LYS 266.A O no hydrogen 2.631 N/A ILE 270.A N LYS 266.A O no hydrogen 2.695 N/A GLU 271.A N ASN 267.A O no hydrogen 2.991 N/A ASN 272.A N ILE 269.A O no hydrogen 3.323 N/A ASN 272.A ND2 VAL 268.A O no hydrogen 3.143 N/A LEU 275.A N ASN 272.A O no hydrogen 2.753 N/A ARG 276.A N SER 273.A O no hydrogen 2.928 N/A ARG 276.A NH2 ILE 269.A O no hydrogen 3.003 N/A