Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3p3a_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): SER 6.A N ASP 4.A OD1 no hydrogen 3.068 N/A SER 6.A OG ASP 4.A OD1 no hydrogen 2.692 N/A LEU 9.A N SER 6.A O no hydrogen 3.299 N/A LYS 10.A N PRO 7.A O no hydrogen 3.199 N/A GLN 11.A NE2 GLU 8.A O no hydrogen 2.975 N/A TYR 12.A N LEU 9.A O no hydrogen 3.203 N/A TYR 12.A OH ARG 216.A O no hydrogen 2.759 N/A ALA 13.A N LEU 254.A O no hydrogen 3.019 N/A HIS 14.A N TYR 253.A O no hydrogen 2.978 N/A GLU 16.A N GLU 16.A OE1 no hydrogen 2.856 N/A ARG 17.A N HIS 14.A O no hydrogen 3.224 N/A ARG 17.A NE VAL 117.A O no hydrogen 2.834 N/A ARG 17.A NH2 VAL 117.A O no hydrogen 3.155 N/A LEU 18.A N PRO 15.A O no hydrogen 3.254 N/A VAL 19.A N LEU 119.A O no hydrogen 3.068 N/A THR 20.A N ASP 4.A OD2 no hydrogen 2.966 N/A THR 20.A OG1 ASP 4.A OD2 no hydrogen 2.946 N/A TRP 23.A N THR 20.A OG1 no hydrogen 3.317 N/A LEU 24.A N THR 20.A O no hydrogen 3.169 N/A ALA 25.A N ALA 21.A O no hydrogen 2.981 N/A SER 26.A N ASP 22.A O no hydrogen 3.086 N/A SER 26.A OG ASP 22.A O no hydrogen 3.076 N/A ASN 27.A N LEU 24.A O no hydrogen 3.008 N/A ASN 27.A ND2 TRP 23.A O no hydrogen 2.766 N/A ARG 30.A N ASN 27.A O no hydrogen 3.240 N/A VAL 34.A N THR 90.A O no hydrogen 3.016 N/A VAL 36.A N VAL 92.A O no hydrogen 3.023 N/A GLU 37.A N VAL 54.A O no hydrogen 2.854 N/A SER 38.A N TYR 94.A O no hydrogen 2.929 N/A SER 38.A OG TRP 101.A O no hydrogen 2.992 N/A LEU 43.A N ASP 41.A OD1 no hydrogen 2.925 N/A LEU 44.A N ASP 41.A O no hydrogen 3.212 N/A TYR 45.A OH ALA 53.A O no hydrogen 2.777 N/A THR 47.A N LEU 44.A O no hydrogen 3.005 N/A THR 47.A OG1 LEU 44.A O no hydrogen 2.780 N/A GLY 48.A N TYR 45.A O no hydrogen 2.905 N/A HIS 49.A N THR 135.A O no hydrogen 3.039 N/A HIS 49.A ND1 TYR 45.A O no hydrogen 3.029 N/A HIS 49.A NE2 GLU 137.A O no hydrogen 2.934 N/A ILE 50.A N TYR 94.A OH no hydrogen 3.120 N/A ALA 53.A N ILE 50.A O no hydrogen 3.196 N/A VAL 54.A N ILE 35.A O no hydrogen 2.909 N/A LYS 55.A NZ VAL 42.A O no hydrogen 3.451 N/A ILE 56.A N GLU 37.A O no hydrogen 3.271 N/A ASP 57.A N ASP 61.A OD2 no hydrogen 2.847 N/A TRP 58.A NE1 GLU 40.A O no hydrogen 3.195 N/A HIS 59.A N ASP 57.A OD1 no hydrogen 3.121 N/A THR 60.A OG1 ASP 57.A OD2 no hydrogen 3.067 N/A ASP 61.A N ASP 57.A O no hydrogen 2.801 N/A ASN 63.A ND2 TRP 58.A O no hydrogen 3.200 N/A ASP 64.A N ASP 69.A O no hydrogen 2.987 N/A ALA 66.A N ASP 64.A OD2 no hydrogen 2.720 N/A VAL 67.A N ASP 64.A OD2 no hydrogen 2.914 N/A ARG 68.A NH1 GLY 265.A O no hydrogen 3.278 N/A ARG 68.A NH2 GLY 265.A O no hydrogen 3.046 N/A ASP 69.A N VAL 67.A O no hydrogen 3.025 N/A TYR 70.A N ASP 69.A OD1 no hydrogen 2.870 N/A ILE 71.A N LEU 62.A O no hydrogen 3.148 N/A ASN 72.A N GLN 75.A OE1 no hydrogen 3.042 N/A GLN 75.A N ASN 72.A OD1 no hydrogen 2.991 N/A PHE 76.A N ASN 72.A O no hydrogen 2.990 N/A ALA 77.A N GLY 73.A O no hydrogen 2.994 N/A ALA 78.A N GLU 74.A O no hydrogen 3.234 N/A LEU 79.A N GLN 75.A O no hydrogen 3.117 N/A MET 80.A N PHE 76.A O no hydrogen 2.978 N/A ASP 81.A N ALA 77.A O no hydrogen 3.094 N/A ARG 82.A N ALA 78.A O no hydrogen 3.172 N/A LYS 83.A N LEU 79.A O no hydrogen 3.058 N/A LYS 83.A N MET 80.A O no hydrogen 3.239 N/A LYS 83.A NZ LYS 55.A O no hydrogen 2.883 N/A GLY 84.A N ASP 81.A O no hydrogen 3.189 N/A VAL 85.A N MET 80.A O no hydrogen 3.043 N/A THR 86.A N ASP 89.A OD2 no hydrogen 3.135 N/A ARG 87.A NH1 PHE 112.A O no hydrogen 2.958 N/A ARG 87.A NH1 TYR 146.A OH no hydrogen 3.047 N/A ARG 87.A NH2 PHE 112.A O no hydrogen 3.503 N/A ASP 89.A N THR 86.A O no hydrogen 3.248 N/A THR 90.A N GLY 32.A O no hydrogen 2.882 N/A THR 90.A OG1 ASP 116.A OD2 no hydrogen 2.691 N/A VAL 91.A N ASP 116.A O no hydrogen 3.025 N/A VAL 92.A N VAL 34.A O no hydrogen 3.051 N/A ILE 93.A N ARG 118.A O no hydrogen 2.948 N/A TYR 94.A N VAL 36.A O no hydrogen 3.028 N/A TYR 94.A OH GLU 37.A OE1 no hydrogen 2.573 N/A GLY 95.A N ASN 99.A OD1 no hydrogen 3.078 N/A ASP 96.A N ASP 39.A OD1 no hydrogen 3.033 N/A LYS 97.A NZ GLU 40.A OE1 no hydrogen 2.601 N/A SER 98.A N ASP 125.A OD2 no hydrogen 3.413 N/A ASN 99.A N ASP 96.A O no hydrogen 3.109 N/A ASN 99.A ND2 LEU 120.A O no hydrogen 2.766 N/A TRP 100.A N LYS 97.A O no hydrogen 3.194 N/A TRP 100.A NE1 ARG 243.A O no hydrogen 3.152 N/A ALA 103.A N ASN 99.A O no hydrogen 3.040 N/A ALA 105.A N TRP 101.A O no hydrogen 3.090 N/A MET 106.A N ALA 102.A O no hydrogen 3.039 N/A TRP 107.A N ALA 103.A O no hydrogen 2.975 N/A TRP 107.A NE1 ILE 156.A O no hydrogen 3.165 N/A VAL 108.A N TYR 104.A O no hydrogen 3.054 N/A PHE 109.A N ALA 105.A O no hydrogen 3.064 N/A HIS 110.A N MET 106.A O no hydrogen 3.087 N/A LEU 111.A N TRP 107.A O no hydrogen 3.241 N/A PHE 112.A N PHE 109.A O no hydrogen 3.204 N/A GLY 113.A N HIS 110.A O no hydrogen 3.146 N/A HIS 114.A N PHE 109.A O no hydrogen 3.335 N/A HIS 114.A ND1 TYR 146.A OH no hydrogen 2.681 N/A HIS 114.A NE2 ASP 89.A O no hydrogen 3.144 N/A ARG 118.A N VAL 91.A O no hydrogen 3.001 N/A ARG 118.A NE ASP 116.A OD1 no hydrogen 2.914 N/A ARG 118.A NH1 PRO 2.A O no hydrogen 3.164 N/A ARG 118.A NH2 LEU 1.A O no hydrogen 3.043 N/A ARG 118.A NH2 ASP 116.A OD2 no hydrogen 2.915 N/A LEU 119.A N ARG 17.A O no hydrogen 3.074 N/A LEU 120.A N ILE 93.A O no hydrogen 3.165 N/A ASP 121.A N VAL 19.A O no hydrogen 2.875 N/A GLY 123.A N LEU 120.A O no hydrogen 3.003 N/A ARG 124.A N GLY 95.A O no hydrogen 2.874 N/A ARG 124.A NH1 GLY 48.A O no hydrogen 2.743 N/A ARG 124.A NH2 GLY 48.A O no hydrogen 3.403 N/A LEU 126.A N GLY 122.A O no hydrogen 3.252 N/A TRP 127.A N GLY 123.A O no hydrogen 3.390 N/A TRP 127.A NE1 ASP 133.A O no hydrogen 2.925 N/A VAL 128.A N ARG 124.A O no hydrogen 3.064 N/A SER 129.A N ASP 125.A O no hydrogen 2.882 N/A SER 129.A OG ASP 125.A O no hydrogen 3.276 N/A THR 130.A N LEU 126.A O no hydrogen 3.325 N/A THR 130.A OG1 LEU 126.A O no hydrogen 2.587 N/A THR 130.A OG1 TRP 127.A O no hydrogen 3.397 N/A GLY 131.A N VAL 128.A O no hydrogen 2.987 N/A ARG 132.A N TRP 127.A O no hydrogen 3.200 N/A THR 135.A N HIS 49.A O no hydrogen 2.883 N/A GLU 137.A N THR 135.A OG1 no hydrogen 3.129 N/A ARG 141.A NE GLY 84.A O no hydrogen 3.110 N/A ARG 141.A NH2 GLY 84.A O no hydrogen 3.257 N/A THR 143.A N ASP 81.A O no hydrogen 3.111 N/A TYR 146.A N ASP 81.A OD1 no hydrogen 3.128 N/A TYR 146.A OH HIS 114.A ND1 no hydrogen 2.681 N/A ARG 151.A NE ASP 153.A OD1 no hydrogen 2.846 N/A ARG 151.A NH1 ASP 69.A OD2 no hydrogen 3.437 N/A ARG 151.A NH1 ILE 71.A O no hydrogen 3.049 N/A ARG 151.A NH2 ASP 69.A OD2 no hydrogen 3.039 N/A ARG 151.A NH2 ASP 153.A OD2 no hydrogen 3.215 N/A ASN 152.A N LEU 111.A O no hydrogen 2.975 N/A ILE 156.A N ASP 153.A O no hydrogen 3.130 N/A ARG 157.A N ASP 153.A O no hydrogen 3.057 N/A ARG 157.A NE ASP 264.A OD1 no hydrogen 2.762 N/A ARG 157.A NH1 ASP 69.A OD1 no hydrogen 2.878 N/A ARG 157.A NH1 ASP 153.A OD2 no hydrogen 3.214 N/A ARG 157.A NH2 ASP 69.A OD1 no hydrogen 3.084 N/A ARG 157.A NH2 ASP 264.A OD2 no hydrogen 2.863 N/A ALA 158.A N ASN 262.A O no hydrogen 2.932 N/A PHE 159.A N ASP 162.A OD2 no hydrogen 2.889 N/A VAL 163.A N PHE 159.A O no hydrogen 3.178 N/A LEU 164.A N LYS 160.A O no hydrogen 3.208 N/A ARG 165.A N ASP 161.A O no hydrogen 3.182 N/A ARG 165.A NH2 ASP 162.A OD1 no hydrogen 3.397 N/A VAL 166.A N VAL 163.A O no hydrogen 3.260 N/A LYS 169.A N VAL 166.A O no hydrogen 2.754 N/A GLU 170.A N VAL 166.A O no hydrogen 3.324 N/A ILE 173.A N ILE 235.A O no hydrogen 2.949 N/A ASP 174.A N VAL 201.A O no hydrogen 2.982 N/A VAL 175.A N TYR 237.A O no hydrogen 2.951 N/A ARG 176.A N ASP 174.A OD1 no hydrogen 3.200 N/A ARG 176.A NE ASP 174.A OD1 no hydrogen 3.116 N/A ARG 176.A NH2 ASP 174.A OD2 no hydrogen 2.910 N/A ARG 176.A NH2 GLY 195.A O no hydrogen 2.836 N/A SER 177.A OG GLU 180.A OE1 no hydrogen 3.004 N/A GLN 179.A N GLN 179.A OE1 no hydrogen 2.803 N/A TYR 181.A N SER 177.A O no hydrogen 3.102 N/A TYR 181.A OH ALA 200.A O no hydrogen 2.954 N/A THR 182.A N PRO 178.A O no hydrogen 3.093 N/A THR 182.A OG1 GLN 179.A O no hydrogen 3.275 N/A GLY 183.A N GLU 180.A O no hydrogen 3.173 N/A GLU 184.A N THR 182.A OG1 no hydrogen 3.228 N/A ARG 185.A N GLN 179.A O no hydrogen 3.050 N/A LEU 192.A N ASN 272.A OD1 no hydrogen 3.157 N/A ARG 193.A N GLY 271.A O no hydrogen 3.197 N/A ARG 193.A NH1 LEU 192.A O no hydrogen 3.360 N/A HIS 196.A N VAL 279.A O no hydrogen 2.978 N/A HIS 196.A ND1 TYR 181.A O no hydrogen 2.816 N/A HIS 196.A NE2 GLU 283.A O no hydrogen 3.090 N/A HIS 196.A NE2 PRO 284.A O no hydrogen 3.242 N/A ILE 197.A N TYR 237.A OH no hydrogen 3.112 N/A THR 199.A N PRO 284.A O no hydrogen 3.097 N/A THR 199.A OG1 PRO 198.A O no hydrogen 2.558 N/A ALA 200.A N ILE 197.A O no hydrogen 3.029 N/A VAL 201.A N LEU 172.A O no hydrogen 2.959 N/A VAL 203.A N ASP 174.A O no hydrogen 3.116 N/A TRP 205.A N VAL 175.A O no hydrogen 3.197 N/A LYS 207.A N PRO 204.A O no hydrogen 3.208 N/A ALA 208.A N TRP 205.A O no hydrogen 3.248 N/A ALA 209.A N SER 206.A O no hydrogen 3.259 N/A TYR 210.A N ARG 214.A O no hydrogen 3.044 N/A TYR 210.A OH GLU 220.A OE2 no hydrogen 3.178 N/A GLY 213.A N TYR 210.A O no hydrogen 3.436 N/A ARG 214.A N ASP 212.A OD1 no hydrogen 3.130 N/A ARG 214.A NE ASP 212.A OD2 no hydrogen 2.835 N/A ARG 214.A NH2 ASP 212.A OD2 no hydrogen 3.092 N/A PHE 215.A N ASP 121.A OD1 no hydrogen 3.103 N/A ARG 216.A N ALA 208.A O no hydrogen 3.024 N/A ARG 216.A NE LYS 207.A O no hydrogen 3.112 N/A ARG 216.A NE ALA 209.A O no hydrogen 3.199 N/A ARG 216.A NH1 GLU 220.A OE1 no hydrogen 2.835 N/A ARG 216.A NH2 ALA 209.A O no hydrogen 3.240 N/A ALA 217.A N TYR 210.A OH no hydrogen 3.036 N/A ARG 218.A N GLN 11.A OE1 no hydrogen 3.049 N/A ARG 218.A NE GLU 222.A OE2 no hydrogen 2.846 N/A ARG 218.A NH1 GLN 11.A O no hydrogen 2.989 N/A ARG 218.A NH2 GLU 222.A OE2 no hydrogen 3.479 N/A LEU 221.A N ALA 217.A O no hydrogen 3.170 N/A GLU 222.A N ARG 218.A O no hydrogen 2.915 N/A GLU 223.A N ALA 219.A O no hydrogen 3.288 N/A GLU 223.A N GLU 220.A O no hydrogen 3.169 N/A ILE 224.A N GLU 220.A O no hydrogen 3.331 N/A TYR 225.A N LEU 221.A O no hydrogen 2.924 N/A VAL 228.A N TYR 225.A O no hydrogen 3.089 N/A LYS 229.A N ASP 232.A OD2 no hydrogen 2.812 N/A LYS 229.A NZ GLY 226.A O no hydrogen 3.233 N/A ASP 232.A N LYS 229.A O no hydrogen 2.899 N/A LYS 233.A N GLU 170.A OE1 no hydrogen 2.693 N/A ILE 235.A N PRO 171.A O no hydrogen 3.185 N/A VAL 236.A N ARG 261.A O no hydrogen 3.043 N/A TYR 237.A N ILE 173.A O no hydrogen 3.103 N/A TYR 237.A OH ASP 174.A OD2 no hydrogen 2.664 N/A CYS 238.A N SER 266.A OG no hydrogen 3.233 N/A CYS 238.A SG.B ILE 240.A O no hydrogen 2.998 N/A ARG 239.A NE GLU 189.A OE1 no hydrogen 2.724 N/A ARG 239.A NH1 GLU 180.A OE2 no hydrogen 3.085 N/A ARG 239.A NH2 GLU 189.A OE1 no hydrogen 3.051 N/A GLU 242.A N GLU 242.A OE1 no hydrogen 2.881 N/A ARG 243.A N ILE 240.A O no hydrogen 3.034 N/A ARG 243.A NE GLU 189.A OE1 no hydrogen 3.163 N/A ARG 243.A NH1 GLU 40.A OE1 no hydrogen 3.125 N/A ARG 243.A NH2 GLU 40.A OE2 no hydrogen 3.135 N/A ARG 243.A NH2 GLU 189.A OE2 no hydrogen 3.165 N/A SER 244.A N GLY 241.A O no hydrogen 3.321 N/A SER 244.A OG GLY 241.A O no hydrogen 3.441 N/A SER 244.A OG ASN 262.A OD1 no hydrogen 2.712 N/A SER 245.A OG GLY 241.A O no hydrogen 3.364 N/A HIS 246.A NE2 SER 98.A O no hydrogen 3.080 N/A TRP 248.A N SER 244.A O no hydrogen 3.375 N/A PHE 249.A N SER 245.A O no hydrogen 3.013 N/A VAL 250.A N HIS 246.A O no hydrogen 3.130 N/A LEU 251.A N THR 247.A O no hydrogen 2.986 N/A THR 252.A N TRP 248.A O no hydrogen 3.005 N/A THR 252.A OG1 TRP 248.A O no hydrogen 2.738 N/A TYR 253.A N PHE 249.A O no hydrogen 2.880 N/A LEU 254.A N VAL 250.A O no hydrogen 3.165 N/A LEU 255.A N VAL 250.A O no hydrogen 3.131 N/A HIS 257.A N LEU 251.A O no hydrogen 3.074 N/A ARG 261.A N PRO 234.A O no hydrogen 2.940 N/A ASN 262.A N ILE 156.A O no hydrogen 2.937 N/A ASN 262.A ND2 GLY 241.A O no hydrogen 3.100 N/A TYR 263.A N VAL 236.A O no hydrogen 2.989 N/A TYR 263.A OH GLU 269.A OE1 no hydrogen 2.637 N/A SER 266.A OG TYR 263.A O no hydrogen 2.791 N/A TRP 267.A N CYS 238.A O no hydrogen 2.840 N/A TRP 267.A NE1 ARG 193.A O no hydrogen 2.981 N/A THR 268.A N ARG 239.A O no hydrogen 3.180 N/A THR 268.A OG1 ARG 239.A O no hydrogen 3.026 N/A THR 268.A OG1 GLY 265.A O no hydrogen 3.343 N/A GLU 269.A N GLY 265.A O no hydrogen 3.285 N/A GLU 269.A N SER 266.A O no hydrogen 3.247 N/A TRP 270.A N SER 266.A O no hydrogen 3.060 N/A TRP 270.A NE1 PRO 277.A O no hydrogen 3.052 N/A GLY 271.A N TRP 267.A O no hydrogen 2.793 N/A ASN 272.A N GLU 269.A O no hydrogen 3.296 N/A ASN 272.A ND2 GLY 190.A O no hydrogen 3.462 N/A ASN 272.A ND2 THR 268.A O no hydrogen 2.859 N/A VAL 279.A N HIS 196.A O no hydrogen 3.134 N/A GLY 281.A N THR 182.A O no hydrogen 2.995 N/A