Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1psw_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): LYS 1.A N ASP 68.A OD2 no hydrogen 2.836 N/A ILE 2.A N ILE 28.A O no hydrogen 2.784 N/A LEU 3.A N ARG 69.A O no hydrogen 2.993 N/A VAL 4.A N ASP 30.A O no hydrogen 2.751 N/A ILE 5.A N TYR 71.A O no hydrogen 2.792 N/A SER 13.A OG TYR 17.A OH no hydrogen 3.062 N/A GLN 14.A NE2 GLN 142.A O no hydrogen 3.297 N/A SER 15.A OG LEU 139.A O no hydrogen 2.770 N/A LEU 16.A N SER 13.A O no hydrogen 3.005 N/A TYR 17.A N SER 13.A O no hydrogen 3.330 N/A TYR 17.A OH SER 13.A OG no hydrogen 3.062 N/A ARG 18.A N GLN 14.A O no hydrogen 2.852 N/A ARG 18.A NH1 TRP 140.A O no hydrogen 2.684 N/A THR 19.A N SER 15.A O no hydrogen 2.913 N/A THR 19.A OG1 SER 15.A O no hydrogen 2.656 N/A LEU 20.A N LEU 16.A O no hydrogen 2.759 N/A GLN 21.A N TYR 17.A O no hydrogen 3.188 N/A ALA 22.A N THR 19.A O no hydrogen 3.072 N/A ARG 23.A N THR 19.A O no hydrogen 2.961 N/A TYR 24.A N LEU 20.A O no hydrogen 2.907 N/A TYR 24.A OH ALA 123.A O no hydrogen 2.944 N/A ASP 30.A N ILE 2.A O no hydrogen 2.884 N/A VAL 31.A N GLU 47.A O no hydrogen 2.989 N/A CYS 36.A N PRO 33.A O no hydrogen 2.991 N/A ARG 37.A N ALA 34.A O no hydrogen 3.039 N/A LEU 40.A N CYS 36.A O no hydrogen 3.219 N/A SER 41.A N ARG 37.A O no hydrogen 2.979 N/A SER 41.A OG PRO 38.A O no hydrogen 2.577 N/A ARG 42.A N LEU 39.A O no hydrogen 2.912 N/A ARG 42.A NH1 GLU 149.A OE2 no hydrogen 2.767 N/A ARG 42.A NH2 GLN 144.A O no hydrogen 3.157 N/A ARG 42.A NH2 GLU 149.A OE1 no hydrogen 2.827 N/A ARG 42.A NH2 GLU 149.A OE2 no hydrogen 3.277 N/A ASN 46.A N ILE 29.A O no hydrogen 2.712 N/A ASN 46.A ND2 ASP 30.A OD1 no hydrogen 2.988 N/A ARG 55.A N GLU 51.A O no hydrogen 2.783 N/A ARG 55.A NH1 GLU 51.A OE1 no hydrogen 3.549 N/A ARG 56.A N ILE 52.A O no hydrogen 3.289 N/A LYS 57.A N GLY 53.A O no hydrogen 3.405 N/A LEU 58.A N GLU 54.A O no hydrogen 2.756 N/A GLY 59.A N ARG 55.A O no hydrogen 2.825 N/A HIS 60.A N ARG 56.A O no hydrogen 2.814 N/A SER 61.A N LYS 57.A O no hydrogen 3.072 N/A SER 61.A OG LEU 58.A O no hydrogen 2.571 N/A LEU 62.A N GLY 59.A O no hydrogen 3.145 N/A ARG 63.A N HIS 60.A O no hydrogen 3.171 N/A ARG 63.A NE PHE 85.A O no hydrogen 3.254 N/A ARG 63.A NH2 PHE 85.A O no hydrogen 3.562 N/A LYS 65.A N LEU 62.A O no hydrogen 3.130 N/A LYS 65.A NZ GLU 47.A OE1 no hydrogen 3.568 N/A ARG 66.A N ARG 63.A O no hydrogen 2.943 N/A TYR 67.A OH ASP 30.A OD2 no hydrogen 2.619 N/A ASP 68.A N LYS 1.A O no hydrogen 2.739 N/A ARG 69.A N LYS 1.A O no hydrogen 3.215 N/A ARG 69.A NH1 TYR 24.A OH no hydrogen 2.866 N/A ARG 69.A NH1 TYR 71.A OH no hydrogen 3.184 N/A ALA 70.A N HIS 90.A O no hydrogen 2.804 N/A TYR 71.A N LEU 3.A O no hydrogen 2.905 N/A VAL 72.A N THR 92.A O no hydrogen 2.908 N/A LEU 73.A N ILE 5.A O no hydrogen 3.045 N/A PHE 77.A N GLU 97.A OE1 no hydrogen 2.762 N/A SER 79.A N SER 76.A OG no hydrogen 3.199 N/A SER 79.A OG SER 76.A O no hydrogen 2.720 N/A ALA 80.A N PHE 77.A O no hydrogen 3.177 N/A LEU 81.A N LYS 78.A O no hydrogen 3.068 N/A LEU 84.A N LEU 81.A O no hydrogen 2.988 N/A PHE 85.A N LEU 81.A O no hydrogen 3.165 N/A ALA 86.A N VAL 82.A O no hydrogen 2.902 N/A GLY 87.A N LEU 84.A O no hydrogen 2.858 N/A ILE 88.A N PRO 83.A O no hydrogen 3.349 N/A ARG 91.A N ASN 103.A OD1 no hydrogen 2.908 N/A ARG 91.A NE LEU 101.A O no hydrogen 2.679 N/A ARG 91.A NH1 ILE 88.A O no hydrogen 2.706 N/A THR 92.A N ALA 70.A O no hydrogen 2.809 N/A THR 92.A OG1 ASP 104.A OD2 no hydrogen 2.687 N/A TRP 94.A NE1 ARG 118.A O no hydrogen 2.920 N/A ARG 95.A N ARG 106.A O no hydrogen 2.929 N/A ARG 95.A NH1 TYR 99.A OH no hydrogen 2.834 N/A GLU 97.A N ASN 75.A O no hydrogen 3.147 N/A ARG 98.A NH1 ASN 75.A O no hydrogen 3.409 N/A LEU 102.A N ARG 98.A O no hydrogen 3.065 N/A ASN 103.A ND2 PRO 89.A O no hydrogen 2.901 N/A ASP 104.A N ARG 91.A O no hydrogen 3.211 N/A ARG 106.A N GLY 93.A O no hydrogen 3.090 N/A ARG 106.A NE ASP 104.A OD1 no hydrogen 3.223 N/A ARG 106.A NE ASP 104.A OD2 no hydrogen 3.429 N/A ARG 106.A NH1 ALA 121.A O no hydrogen 3.514 N/A ARG 106.A NH1 TYR 124.A O no hydrogen 3.263 N/A ARG 106.A NH2 ASP 104.A OD2 no hydrogen 3.072 N/A ARG 106.A NH2 TYR 124.A O no hydrogen 2.768 N/A GLU 111.A N ASP 109.A OD1 no hydrogen 3.192 N/A ALA 112.A N ASP 109.A O no hydrogen 2.763 N/A ALA 112.A N ASP 109.A OD1 no hydrogen 3.282 N/A TRP 113.A N ASP 109.A O no hydrogen 3.125 N/A LEU 115.A N GLU 117.A OE1 no hydrogen 3.109 N/A ARG 118.A N LEU 115.A O no hydrogen 3.190 N/A ARG 118.A NE TRP 113.A O no hydrogen 2.654 N/A ARG 118.A NH2 TRP 113.A O no hydrogen 2.872 N/A ILE 120.A N VAL 116.A O no hydrogen 3.064 N/A ALA 121.A N GLU 117.A O no hydrogen 2.910 N/A LEU 122.A N TYR 119.A O no hydrogen 3.162 N/A ALA 123.A N ILE 120.A O no hydrogen 3.053 N/A TYR 124.A N ALA 121.A O no hydrogen 3.102 N/A ILE 128.A N LYS 126.A O no hydrogen 2.716 N/A THR 130.A N ASP 133.A OD2 no hydrogen 3.473 N/A ALA 131.A N ALA 112.A O no hydrogen 2.982 N/A GLN 132.A N THR 130.A OG1 no hydrogen 3.326 N/A ASP 133.A N THR 130.A O no hydrogen 3.063 N/A LEU 134.A N ALA 131.A O no hydrogen 3.127 N/A LEU 143.A N ALA 259.A O no hydrogen 3.098 N/A SER 146.A N GLU 149.A OE1 no hydrogen 3.085 N/A GLU 149.A N SER 146.A OG no hydrogen 3.254 N/A LYS 150.A N SER 146.A O no hydrogen 3.132 N/A LYS 150.A NZ GLU 147.A OE2 no hydrogen 3.052 N/A SER 151.A N GLU 147.A O no hydrogen 2.855 N/A TYR 152.A N GLY 148.A O no hydrogen 3.083 N/A THR 153.A N GLU 149.A O no hydrogen 3.009 N/A THR 153.A OG1 GLU 149.A O no hydrogen 2.916 N/A CYS 154.A N LYS 150.A O no hydrogen 2.985 N/A CYS 154.A SG LYS 150.A O no hydrogen 3.326 N/A ASN 155.A N SER 151.A O no hydrogen 3.330 N/A GLN 156.A N TYR 152.A O no hydrogen 2.784 N/A PHE 157.A N THR 153.A O no hydrogen 3.144 N/A PHE 157.A N CYS 154.A O no hydrogen 3.355 N/A SER 158.A N ASN 155.A O no hydrogen 2.986 N/A LEU 159.A N CYS 154.A O no hydrogen 2.847 N/A GLU 162.A N SER 160.A OG no hydrogen 2.992 N/A ARG 163.A NH2 ILE 192.A O no hydrogen 2.800 N/A ARG 163.A NH2 TYR 196.A O no hydrogen 2.811 N/A GLY 166.A N ALA 246.A O no hydrogen 2.965 N/A PHE 167.A N VAL 199.A O no hydrogen 2.778 N/A CYS 168.A N VAL 248.A O no hydrogen 2.972 N/A GLU 172.A N GLU 172.A OE1 no hydrogen 2.893 N/A GLY 174.A N ALA 171.A O no hydrogen 3.254 N/A LYS 177.A N GLY 174.A O no hydrogen 3.112 N/A ARG 178.A N PRO 175.A O no hydrogen 2.896 N/A TRP 179.A N ASN 250.A OD1 no hydrogen 2.817 N/A TRP 179.A NE1 ILE 301.A O no hydrogen 2.860 N/A HIS 181.A N TYR 294.A OH no hydrogen 3.060 N/A HIS 181.A ND1 TYR 294.A OH no hydrogen 2.637 N/A HIS 183.A N PRO 180.A O no hydrogen 2.885 N/A HIS 183.A NE2 ILE 299.A O no hydrogen 2.876 N/A TYR 184.A N PRO 180.A O no hydrogen 3.096 N/A TYR 184.A OH ASN 250.A OD1 no hydrogen 3.072 N/A ALA 185.A N HIS 181.A O no hydrogen 3.061 N/A GLU 186.A N TYR 182.A O no hydrogen 3.036 N/A LEU 187.A N HIS 183.A O no hydrogen 2.952 N/A ALA 188.A N TYR 184.A O no hydrogen 2.928 N/A LYS 189.A N ALA 185.A O no hydrogen 3.010 N/A LYS 189.A NZ ALA 216.A O no hydrogen 3.168 N/A GLN 190.A N GLU 186.A O no hydrogen 3.112 N/A GLN 190.A NE2 GLN 304.A OE1 no hydrogen 3.678 N/A LEU 191.A N LEU 187.A O no hydrogen 2.948 N/A ILE 192.A N ALA 188.A O no hydrogen 2.830 N/A ASP 193.A N LYS 189.A O no hydrogen 3.045 N/A GLU 194.A N GLN 190.A O no hydrogen 3.170 N/A GLU 194.A N LEU 191.A O no hydrogen 2.926 N/A GLY 195.A N ILE 192.A O no hydrogen 3.168 N/A TYR 196.A N LEU 191.A O no hydrogen 3.054 N/A GLN 197.A N PRO 164.A O no hydrogen 2.946 N/A GLN 197.A NE2 SER 160.A O no hydrogen 2.735 N/A GLN 197.A NE2 ARG 163.A O no hydrogen 2.687 N/A VAL 198.A N TRP 224.A O no hydrogen 2.739 N/A VAL 199.A N ILE 165.A O no hydrogen 2.992 N/A LEU 200.A N ARG 226.A O no hydrogen 2.816 N/A PHE 201.A N PHE 167.A O no hydrogen 2.808 N/A SER 203.A N ASP 206.A OD2 no hydrogen 2.960 N/A SER 203.A OG ASP 206.A OD2 no hydrogen 3.332 N/A ASP 206.A N SER 203.A O no hydrogen 2.858 N/A HIS 207.A N ALA 204.A O no hydrogen 3.223 N/A HIS 207.A ND1 ALA 229.A O no hydrogen 3.034 N/A GLY 210.A N ASP 206.A O no hydrogen 2.953 N/A ASN 211.A N HIS 207.A O no hydrogen 2.948 N/A ASN 211.A ND2 HIS 207.A NE2 no hydrogen 3.433 N/A GLU 212.A N GLU 208.A O no hydrogen 2.923 N/A ILE 213.A N ALA 209.A O no hydrogen 3.156 N/A LEU 214.A N GLY 210.A O no hydrogen 3.098 N/A ALA 215.A N ASN 211.A O no hydrogen 2.913 N/A ALA 216.A N ILE 213.A O no hydrogen 3.102 N/A LEU 217.A N LEU 214.A O no hydrogen 3.019 N/A ASN 218.A N GLN 221.A OE1 no hydrogen 2.898 N/A GLN 221.A N ASN 218.A OD1 no hydrogen 2.676 N/A GLN 222.A N ASN 218.A O no hydrogen 2.865 N/A ALA 223.A N THR 219.A O no hydrogen 3.302 N/A TRP 224.A N GLN 221.A O no hydrogen 2.817 N/A CYS 225.A N GLN 222.A O no hydrogen 3.315 N/A ARG 226.A N VAL 198.A O no hydrogen 2.911 N/A ARG 226.A NE PHE 157.A O no hydrogen 2.932 N/A ASN 227.A ND2 HIS 207.A O no hydrogen 3.077 N/A ASN 227.A ND2 ASN 211.A OD1 no hydrogen 3.130 N/A LEU 228.A N LEU 200.A O no hydrogen 2.861 N/A ALA 229.A N ASN 227.A OD1 no hydrogen 3.130 N/A GLY 230.A N GLY 202.A O no hydrogen 2.954 N/A GLU 231.A N LEU 228.A O no hydrogen 2.947 N/A GLN 233.A N GLN 236.A OE1 no hydrogen 2.949 N/A GLN 236.A NE2 GLN 156.A OE1 no hydrogen 3.088 N/A ALA 237.A N GLN 233.A O no hydrogen 2.931 N/A VAL 238.A N LEU 234.A O no hydrogen 2.893 N/A ILE 239.A N ASP 235.A O no hydrogen 3.223 N/A LEU 240.A N GLN 236.A O no hydrogen 2.967 N/A ILE 241.A N ALA 237.A O no hydrogen 2.896 N/A ALA 242.A N VAL 238.A O no hydrogen 3.057 N/A ALA 243.A N ILE 239.A O no hydrogen 3.106 N/A ALA 243.A N LEU 240.A O no hydrogen 3.059 N/A CYS 244.A N ILE 241.A O no hydrogen 3.028 N/A CYS 244.A SG LEU 240.A O no hydrogen 3.384 N/A ILE 247.A N PRO 263.A O no hydrogen 2.936 N/A VAL 248.A N GLY 166.A O no hydrogen 2.899 N/A THR 249.A N VAL 265.A O no hydrogen 3.048 N/A THR 249.A OG1 CYS 168.A O no hydrogen 3.477 N/A THR 249.A OG1 ASN 250.A O no hydrogen 2.862 N/A ASN 250.A ND2 PRO 169.A O no hydrogen 2.883 N/A ASN 250.A ND2 GLY 170.A O no hydrogen 2.895 N/A SER 252.A OG THR 249.A OG1 no hydrogen 3.351 N/A SER 252.A OG ASN 250.A O no hydrogen 3.517 N/A GLY 253.A N GLU 172.A OE1 no hydrogen 2.933 N/A GLY 253.A N GLU 172.A OE2 no hydrogen 3.273 N/A ALA 257.A N LEU 254.A O no hydrogen 2.985 N/A ALA 259.A N HIS 255.A O no hydrogen 2.999 N/A LEU 260.A N VAL 256.A O no hydrogen 3.104 N/A LEU 260.A N ALA 257.A O no hydrogen 3.123 N/A ASN 261.A N ALA 258.A O no hydrogen 3.051 N/A ARG 262.A N ALA 257.A O no hydrogen 3.281 N/A ARG 262.A NH1 CYS 244.A O no hydrogen 2.803 N/A ARG 262.A NH1 GLU 317.A OE2 no hydrogen 2.729 N/A ARG 262.A NH2 GLU 317.A OE2 no hydrogen 3.023 N/A LEU 264.A N LYS 282.A O no hydrogen 3.231 N/A VAL 265.A N ILE 247.A O no hydrogen 2.903 N/A ALA 266.A N ARG 284.A O no hydrogen 2.844 N/A LEU 267.A N THR 249.A O no hydrogen 2.839 N/A TYR 268.A N ILE 286.A O no hydrogen 2.873 N/A SER 271.A OG ASP 251.A OD2 no hydrogen 2.999 N/A ASP 274.A N SER 272.A OG no hydrogen 3.393 N/A SER 280.A N PRO 278.A O no hydrogen 3.181 N/A SER 280.A OG ASN 261.A OD1 no hydrogen 3.452 N/A LYS 282.A N SER 280.A OG no hydrogen 3.252 N/A ALA 283.A N SER 280.A O no hydrogen 3.488 N/A ARG 284.A N LEU 264.A O no hydrogen 2.945 N/A ARG 284.A NH1 HIS 281.A O no hydrogen 3.201 N/A ARG 284.A NH1 ALA 283.A O no hydrogen 3.049 N/A ILE 286.A N ALA 266.A O no hydrogen 2.904 N/A ARG 287.A NE GLY 269.A O no hydrogen 2.988 N/A ARG 287.A NH2 GLY 269.A O no hydrogen 3.300 N/A ARG 287.A NH2 GLY 291.A O no hydrogen 3.044 N/A TYR 294.A OH HIS 181.A ND1 no hydrogen 2.637 N/A GLN 296.A NE2 ASP 300.A OD1 no hydrogen 2.789 N/A SER 297.A N HIS 295.A ND1 no hydrogen 3.150 N/A SER 297.A OG HIS 295.A ND1 no hydrogen 2.853 N/A LEU 298.A N HIS 295.A O no hydrogen 3.028 N/A ILE 299.A N HIS 295.A O no hydrogen 3.088 N/A ASP 300.A N GLN 296.A O no hydrogen 2.824 N/A ILE 301.A N LEU 298.A O no hydrogen 3.066 N/A GLN 304.A NE2 GLU 308.A OE2 no hydrogen 3.360 N/A ARG 305.A N THR 302.A OG1 no hydrogen 3.116 N/A VAL 306.A N THR 302.A O no hydrogen 3.245 N/A LEU 307.A N PRO 303.A O no hydrogen 2.781 N/A GLU 308.A N GLN 304.A O no hydrogen 3.038 N/A GLU 309.A N ARG 305.A O no hydrogen 3.213 N/A LEU 310.A N VAL 306.A O no hydrogen 2.853 N/A ASN 311.A N LEU 307.A O no hydrogen 2.842 N/A ASN 311.A ND2 GLU 194.A OE2 no hydrogen 3.032 N/A ALA 312.A N GLU 308.A O no hydrogen 3.339 N/A LEU 313.A N GLU 309.A O no hydrogen 3.327 N/A LEU 314.A N LEU 310.A O no hydrogen 2.913 N/A LEU 315.A N ASN 311.A O no hydrogen 2.966 N/A GLN 316.A N ALA 312.A O no hydrogen 3.133 N/A GLU 317.A N LEU 313.A O no hydrogen 3.172 N/A GLU 318.A N LEU 314.A O no hydrogen 3.223 N/A ALA 319.A N LEU 315.A O no hydrogen 2.930 N/A