Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 5ne1_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ASP 5.A N ASN 1.A O no hydrogen 2.961 N/A ALA 6.A N ALA 2.A O no hydrogen 2.834 N/A ALA 7.A N PRO 3.A O no hydrogen 2.925 N/A ILE 8.A N THR 4.A O no hydrogen 3.021 N/A THR 9.A N ASP 5.A O no hydrogen 3.192 N/A THR 9.A OG1 ASP 5.A O no hydrogen 2.979 N/A ALA 10.A N ALA 6.A O no hydrogen 3.063 N/A ALA 11.A N ILE 8.A O no hydrogen 3.458 N/A ALA 16.A N ASP 13.A OD1 no hydrogen 2.760 N/A LEU 17.A N ASP 13.A O no hydrogen 3.045 N/A GLU 18.A N PHE 14.A O no hydrogen 2.990 N/A LYS 19.A N ALA 15.A O no hydrogen 3.121 N/A ALA 20.A N ALA 16.A O no hydrogen 2.989 N/A CYS 21.A SG LEU 17.A O no hydrogen 3.748 N/A CYS 21.A SG GLU 18.A O no hydrogen 3.714 N/A ALA 22.A N LYS 19.A O no hydrogen 3.081 N/A GLY 23.A N GLU 18.A O no hydrogen 3.218 N/A ARG 24.A N GLN 245.A O no hydrogen 2.845 N/A ARG 24.A NH1 GLU 44.A OE1 no hydrogen 2.956 N/A ARG 24.A NH1 ARG 45.A O no hydrogen 3.199 N/A ARG 24.A NH2 ARG 45.A O no hydrogen 2.836 N/A ARG 24.A NH2 GLN 245.A OE1 no hydrogen 2.860 N/A LEU 25.A N GLU 18.A OE1 no hydrogen 2.727 N/A GLY 26.A N TYR 243.A O no hydrogen 2.779 N/A VAL 27.A N HIS 40.A O no hydrogen 2.885 N/A THR 28.A N THR 241.A O no hydrogen 3.205 N/A THR 28.A OG1 GLN 42.A OE1 no hydrogen 2.831 N/A LEU 29.A N ILE 38.A O no hydrogen 2.991 N/A LEU 30.A N VAL 239.A O no hydrogen 2.854 N/A ASP 31.A N ARG 36.A O no hydrogen 3.188 N/A THR 32.A N PRO 237.A O no hydrogen 3.421 N/A THR 32.A OG1 PRO 237.A O no hydrogen 2.780 N/A ALA 33.A N ASP 31.A OD1 no hydrogen 3.153 N/A SER 34.A OG ASP 31.A OD2 no hydrogen 2.708 N/A GLY 35.A N ASP 31.A O no hydrogen 2.765 N/A ARG 36.A N SER 34.A OG no hydrogen 3.226 N/A ARG 37.A NH1 GLN 42.A OE1 no hydrogen 2.827 N/A ILE 38.A N LEU 29.A O no hydrogen 3.148 N/A HIS 40.A N VAL 27.A O no hydrogen 2.985 N/A HIS 40.A NE2 GLU 18.A OE2 no hydrogen 3.124 N/A ARG 41.A NE GLU 18.A OE1 no hydrogen 2.718 N/A ARG 41.A NE GLU 18.A OE2 no hydrogen 3.480 N/A ARG 41.A NH1 GLU 44.A OE2 no hydrogen 2.817 N/A ARG 41.A NH2 GLU 18.A OE2 no hydrogen 3.090 N/A GLU 44.A N ARG 41.A O no hydrogen 3.266 N/A ARG 45.A NH1 VAL 139.A O no hydrogen 3.116 N/A ARG 45.A NH1 THR 160.A OG1 no hydrogen 3.037 N/A ARG 45.A NH2 VAL 139.A O no hydrogen 3.416 N/A PHE 46.A N THR 161.A O no hydrogen 2.972 N/A MET 48.A N ASP 159.A O no hydrogen 3.046 N/A SER 50.A OG SER 110.A OG no hydrogen 2.972 N/A THR 51.A N MET 48.A O no hydrogen 3.099 N/A THR 51.A OG1 MET 48.A O no hydrogen 2.677 N/A THR 51.A OG1 TYR 243.A OH no hydrogen 3.059 N/A PHE 52.A N CYS 49.A O no hydrogen 3.458 N/A LYS 53.A N SER 50.A O no hydrogen 3.064 N/A LYS 53.A NZ SER 50.A OG no hydrogen 2.807 N/A LYS 53.A NZ SER 110.A O no hydrogen 2.825 N/A LYS 53.A NZ SER 110.A OG no hydrogen 3.417 N/A LYS 53.A NZ ASN 112.A OD1 no hydrogen 2.772 N/A LYS 53.A NZ GLU 146.A OE2 no hydrogen 3.245 N/A SER 54.A OG THR 51.A O no hydrogen 3.047 N/A MET 55.A N PHE 52.A O no hydrogen 2.986 N/A LEU 56.A N PHE 52.A O no hydrogen 3.111 N/A ALA 57.A N LYS 53.A O no hydrogen 3.089 N/A ALA 58.A N SER 54.A O no hydrogen 3.203 N/A THR 59.A N MET 55.A O no hydrogen 2.946 N/A THR 59.A OG1 MET 55.A O no hydrogen 2.827 N/A VAL 60.A N LEU 56.A O no hydrogen 3.112 N/A LEU 61.A N ALA 57.A O no hydrogen 3.043 N/A SER 62.A N ALA 58.A O no hydrogen 2.915 N/A SER 62.A OG.B ALA 58.A O no hydrogen 3.326 N/A SER 62.A OG.B THR 59.A O no hydrogen 2.581 N/A GLN 63.A N THR 59.A O no hydrogen 2.982 N/A GLN 63.A NE2 VAL 122.A O no hydrogen 3.156 N/A ALA 64.A N VAL 60.A O no hydrogen 2.905 N/A GLU 65.A N SER 62.A O no hydrogen 3.276 N/A ARG 66.A N GLN 63.A O no hydrogen 3.272 N/A MET 67.A N ALA 64.A O no hydrogen 3.298 N/A LEU 70.A N MET 67.A O no hydrogen 3.245 N/A ASP 72.A N ALA 69.A O no hydrogen 2.954 N/A ARG 73.A N LEU 70.A O no hydrogen 3.145 N/A ARG 74.A NH1 ASP 96.A OD1 no hydrogen 2.784 N/A VAL 75.A N MET 97.A O no hydrogen 2.847 N/A VAL 77.A N LYS 95.A O no hydrogen 2.958 N/A GLY 78.A N ASP 81.A OD2 no hydrogen 2.972 N/A ASP 81.A N GLY 78.A O no hydrogen 2.816 N/A LEU 82.A N GLU 79.A O no hydrogen 3.319 N/A LEU 83.A N THR 113.A OG1 no hydrogen 3.092 N/A HIS 85.A NE2 THR 109.A O no hydrogen 3.088 N/A VAL 88.A N ASP 111.A OD2 no hydrogen 2.991 N/A THR 89.A N ASP 111.A OD2 no hydrogen 2.889 N/A THR 89.A OG1 ASP 111.A OD1 no hydrogen 2.926 N/A THR 89.A OG1 ASP 111.A OD2 no hydrogen 3.052 N/A ARG 90.A N ALA 86.A O no hydrogen 3.160 N/A ARG 91.A N VAL 88.A O no hydrogen 3.147 N/A HIS 92.A N THR 89.A O no hydrogen 2.929 N/A GLY 94.A N VAL 77.A O no hydrogen 2.836 N/A LYS 95.A N HIS 92.A O no hydrogen 3.084 N/A LYS 95.A NZ HIS 92.A ND1 no hydrogen 3.125 N/A LYS 95.A NZ ASP 96.A O no hydrogen 2.948 N/A MET 97.A N VAL 75.A O no hydrogen 3.132 N/A VAL 99.A N ARG 73.A O no hydrogen 2.946 N/A ARG 100.A N LEU 71.A O no hydrogen 3.097 N/A ARG 100.A NH1 ASP 72.A OD1 no hydrogen 2.827 N/A ARG 100.A NH2 ASP 72.A OD1 no hydrogen 3.213 N/A ASP 101.A N THR 98.A OG1 no hydrogen 3.057 N/A LEU 102.A N THR 98.A O no hydrogen 3.118 N/A CYS 103.A N VAL 99.A O no hydrogen 3.110 N/A CYS 103.A SG VAL 99.A O no hydrogen 3.572 N/A ARG 104.A N ARG 100.A O no hydrogen 3.125 N/A ARG 104.A NH1 ASP 193.A OD2 no hydrogen 3.517 N/A ARG 104.A NH2 ASP 193.A OD2 no hydrogen 2.826 N/A ALA 105.A N ASP 101.A O no hydrogen 3.034 N/A THR 106.A N LEU 102.A O no hydrogen 3.015 N/A THR 106.A OG1 ASP 111.A O no hydrogen 3.130 N/A ILE 107.A N CYS 103.A O no hydrogen 3.175 N/A ILE 108.A N ARG 104.A O no hydrogen 3.057 N/A THR 109.A N ALA 105.A O no hydrogen 3.162 N/A THR 109.A OG1 ALA 105.A O no hydrogen 2.720 N/A ASP 111.A N THR 109.A OG1 no hydrogen 3.278 N/A ASN 112.A N HIS 85.A O no hydrogen 3.108 N/A THR 113.A OG1 ASP 81.A O no hydrogen 2.883 N/A ALA 114.A N ASP 111.A OD1 no hydrogen 2.916 N/A ALA 115.A N ASP 111.A O no hydrogen 3.321 N/A ASN 116.A N ASN 112.A O no hydrogen 3.193 N/A ASN 116.A ND2 GLU 146.A O no hydrogen 2.935 N/A LEU 117.A N THR 113.A O no hydrogen 3.010 N/A LEU 118.A N ALA 114.A O no hydrogen 3.106 N/A PHE 119.A N ALA 115.A O no hydrogen 2.994 N/A GLY 120.A N ASN 116.A O no hydrogen 3.228 N/A VAL 121.A N LEU 117.A O no hydrogen 3.269 N/A VAL 122.A N LEU 118.A O no hydrogen 3.076 N/A GLY 123.A N PHE 119.A O no hydrogen 2.988 N/A GLY 124.A N PHE 119.A O no hydrogen 2.705 N/A ALA 127.A N GLY 124.A O no hydrogen 2.867 N/A VAL 128.A N GLY 124.A O no hydrogen 3.406 N/A THR 129.A N PRO 125.A O no hydrogen 2.951 N/A THR 129.A OG1 PRO 125.A O no hydrogen 3.229 N/A THR 129.A OG1 SER 142.A O no hydrogen 2.934 N/A ALA 130.A N PRO 126.A O no hydrogen 2.984 N/A PHE 131.A N ALA 127.A O no hydrogen 3.108 N/A LEU 132.A N VAL 128.A O no hydrogen 3.038 N/A ARG 133.A N THR 129.A O no hydrogen 2.961 N/A ARG 133.A NH1 ASP 137.A O no hydrogen 2.831 N/A ARG 133.A NH1 SER 140.A O no hydrogen 2.898 N/A ARG 133.A NH2 SER 140.A O no hydrogen 3.137 N/A ALA 134.A N ALA 130.A O no hydrogen 3.066 N/A SER 135.A N PHE 131.A O no hydrogen 3.016 N/A SER 135.A N LEU 132.A O no hydrogen 3.139 N/A SER 135.A OG LEU 132.A O no hydrogen 2.679 N/A GLY 136.A N ARG 133.A O no hydrogen 3.174 N/A ASP 137.A N LEU 132.A O no hydrogen 3.036 N/A VAL 139.A N ASP 137.A OD1 no hydrogen 2.888 N/A SER 140.A N ASP 137.A OD1 no hydrogen 2.996 N/A SER 140.A OG ASP 137.A OD1 no hydrogen 3.465 N/A SER 140.A OG ASP 137.A OD2 no hydrogen 2.846 N/A SER 140.A OG THR 161.A OG1 no hydrogen 2.855 N/A ARG 141.A N THR 160.A O no hydrogen 3.149 N/A ARG 141.A NE ASP 143.A OD2 no hydrogen 2.969 N/A ARG 141.A NH2 ASP 143.A OD1 no hydrogen 2.880 N/A ARG 141.A NH2 ASP 143.A OD2 no hydrogen 3.511 N/A SER 142.A N THR 129.A OG1 no hydrogen 2.980 N/A ASP 143.A N ASP 159.A OD1 no hydrogen 2.860 N/A ARG 144.A N ASP 159.A OD1 no hydrogen 3.050 N/A ARG 144.A NE ASP 159.A OD2 no hydrogen 2.574 N/A ARG 144.A NH1 SER 151.A O no hydrogen 3.236 N/A ARG 144.A NH2 SER 151.A O no hydrogen 3.565 N/A ARG 144.A NH2 ASP 159.A OD2 no hydrogen 2.837 N/A GLU 146.A N ASN 116.A OD1 no hydrogen 3.067 N/A GLU 148.A N GLU 148.A OE1 no hydrogen 2.889 N/A LEU 149.A N LEU 145.A O no hydrogen 3.090 N/A ASN 150.A N PRO 147.A O no hydrogen 3.172 N/A ASN 150.A ND2 GLU 146.A OE1 no hydrogen 3.071 N/A ASN 150.A ND2 PRO 147.A O no hydrogen 3.245 N/A SER 151.A N GLU 148.A O no hydrogen 3.009 N/A ASP 156.A N ALA 153.A O no hydrogen 2.982 N/A ARG 158.A N ASP 156.A OD1 no hydrogen 3.042 N/A ARG 158.A NE ASP 156.A OD1 no hydrogen 3.371 N/A ARG 158.A NE ASP 156.A OD2 no hydrogen 3.157 N/A ARG 158.A NH2 ASP 156.A OD2 no hydrogen 2.951 N/A ASP 159.A N ASP 143.A OD2 no hydrogen 2.927 N/A THR 160.A OG1 PRO 157.A O no hydrogen 2.650 N/A THR 161.A N PHE 46.A O no hydrogen 3.182 N/A THR 161.A OG1 SER 140.A OG no hydrogen 2.855 N/A THR 161.A OG1 THR 162.A O no hydrogen 3.194 N/A ALA 164.A N GLN 42.A O no hydrogen 3.086 N/A ALA 165.A N THR 162.A OG1 no hydrogen 3.017 N/A MET 166.A N THR 162.A O no hydrogen 3.021 N/A ALA 167.A N PRO 163.A O no hydrogen 3.155 N/A ALA 168.A N ALA 164.A O no hydrogen 3.116 N/A THR 169.A N ALA 165.A O no hydrogen 2.972 N/A THR 169.A OG1 ASP 137.A OD2 no hydrogen 2.534 N/A THR 169.A OG1 ALA 165.A O no hydrogen 3.196 N/A LEU 170.A N MET 166.A O no hydrogen 2.904 N/A GLN 171.A N ALA 167.A O no hydrogen 3.169 N/A GLN 171.A NE2 THR 32.A O no hydrogen 3.534 N/A ARG 172.A N ALA 168.A O no hydrogen 3.041 N/A VAL 173.A N THR 169.A O no hydrogen 2.882 N/A VAL 174.A N LEU 170.A O no hydrogen 2.890 N/A LEU 175.A N GLN 171.A O no hydrogen 2.939 N/A GLN 180.A N GLU 65.A OE2 no hydrogen 2.923 N/A SER 183.A OG GLU 65.A OE2 no hydrogen 2.875 N/A ARG 184.A N GLN 180.A O no hydrogen 2.999 N/A GLN 185.A N PRO 181.A O no hydrogen 3.029 N/A GLN 186.A N ALA 182.A O no hydrogen 3.242 N/A LEU 187.A N SER 183.A O no hydrogen 3.014 N/A ALA 188.A N ARG 184.A O no hydrogen 2.853 N/A ASP 189.A N GLN 185.A O no hydrogen 2.976 N/A TRP 190.A N GLN 186.A O no hydrogen 3.206 N/A LEU 191.A N LEU 187.A O no hydrogen 3.194 N/A ILE 192.A N ALA 188.A O no hydrogen 2.963 N/A ASP 193.A N ASP 189.A O no hydrogen 3.007 N/A ASN 194.A N LEU 191.A O no hydrogen 3.356 N/A ASN 194.A ND2 THR 196.A OG1 no hydrogen 3.356 N/A ASN 194.A ND2 ASP 213.A OD1 no hydrogen 3.010 N/A ASN 194.A ND2 ASP 213.A OD2 no hydrogen 3.165 N/A GLU 195.A N ILE 108.A O no hydrogen 3.241 N/A THR 196.A N ASN 194.A OD1 no hydrogen 3.470 N/A THR 196.A OG1 ASN 194.A OD1 no hydrogen 3.248 N/A THR 196.A OG1 THR 215.A OG1 no hydrogen 2.763 N/A CYS 200.A N GLY 197.A O no hydrogen 3.157 N/A LEU 201.A N ASP 225.A OD2 no hydrogen 3.037 N/A ARG 202.A NE ASP 213.A OD1 no hydrogen 2.897 N/A ARG 202.A NH2 ILE 192.A O no hydrogen 3.375 N/A ARG 202.A NH2 VAL 211.A O no hydrogen 3.176 N/A ARG 202.A NH2 ASP 213.A OD1 no hydrogen 2.919 N/A ALA 203.A N CYS 200.A O no hydrogen 2.975 N/A GLY 204.A N LEU 201.A O no hydrogen 3.061 N/A LEU 205.A N ARG 202.A O no hydrogen 3.273 N/A GLY 206.A N ASP 266.A OD2 no hydrogen 3.205 N/A ARG 208.A NE ASP 266.A OD1 no hydrogen 3.337 N/A ARG 208.A NH1 GLY 270.A OXT no hydrogen 2.810 N/A ARG 208.A NH2 ASP 266.A OD1 no hydrogen 2.793 N/A ARG 208.A NH2 GLY 270.A OXT no hydrogen 2.987 N/A TRP 209.A N GLY 206.A O no hydrogen 3.179 N/A TRP 209.A NE1 ASP 266.A OD1 no hydrogen 3.044 N/A ARG 210.A N TRP 230.A O no hydrogen 2.729 N/A GLY 212.A N VAL 228.A O no hydrogen 3.134 N/A ASP 213.A N LEU 191.A O no hydrogen 3.055 N/A LYS 214.A N ILE 226.A O no hydrogen 2.956 N/A LYS 214.A NZ SER 110.A OG no hydrogen 3.100 N/A LYS 214.A NZ THR 215.A O no hydrogen 2.984 N/A THR 215.A OG1 THR 196.A OG1 no hydrogen 2.763 N/A GLY 216.A N ASN 224.A O no hydrogen 2.987 N/A ASN 218.A N ALA 222.A O no hydrogen 3.117 N/A ASN 218.A ND2 ASN 150.A O no hydrogen 3.196 N/A GLU 220.A N ASN 218.A OD1 no hydrogen 3.027 N/A ASP 221.A N ASN 218.A OD1 no hydrogen 3.070 N/A ALA 222.A N ASN 218.A OD1 no hydrogen 3.059 N/A ARG 223.A N LEU 244.A O no hydrogen 2.980 N/A ARG 223.A NH1 TYR 251.A O no hydrogen 2.934 N/A ASN 224.A N GLY 216.A O no hydrogen 2.803 N/A ASN 224.A ND2 PRO 47.A O no hydrogen 2.971 N/A ASN 224.A ND2 MET 48.A O no hydrogen 3.278 N/A ASP 225.A N ALA 242.A O no hydrogen 2.960 N/A ILE 226.A N LYS 214.A O no hydrogen 3.073 N/A ALA 227.A N LEU 240.A O no hydrogen 2.884 N/A VAL 228.A N GLY 212.A O no hydrogen 2.857 N/A LEU 229.A N TRP 238.A O no hydrogen 2.756 N/A TRP 230.A N ARG 210.A O no hydrogen 2.956 N/A VAL 232.A N ARG 208.A O no hydrogen 3.108 N/A GLY 234.A N PRO 231.A O no hydrogen 2.958 N/A TRP 238.A N LEU 229.A O no hydrogen 2.900 N/A VAL 239.A N LEU 30.A O no hydrogen 2.908 N/A LEU 240.A N ALA 227.A O no hydrogen 2.987 N/A THR 241.A N THR 28.A O no hydrogen 3.051 N/A THR 241.A OG1 PRO 163.A O no hydrogen 2.892 N/A ALA 242.A N ASP 225.A O no hydrogen 2.899 N/A TYR 243.A N GLY 26.A O no hydrogen 2.795 N/A TYR 243.A OH THR 51.A OG1 no hydrogen 3.059 N/A LEU 244.A N ARG 223.A O no hydrogen 3.193 N/A LEU 244.A N ASN 224.A OD1 no hydrogen 3.296 N/A GLN 245.A N ARG 24.A O no hydrogen 2.986 N/A GLN 245.A NE2 ASP 221.A OD1 no hydrogen 3.397 N/A ALA 246.A N ASP 221.A O no hydrogen 3.066 N/A SER 250.A N GLN 253.A OE1 no hydrogen 2.873 N/A SER 250.A OG GLN 253.A OE1 no hydrogen 3.230 N/A GLN 253.A N SER 250.A OG no hydrogen 3.249 N/A GLN 253.A NE2 ASP 5.A OD1 no hydrogen 2.880 N/A ARG 254.A N SER 250.A O no hydrogen 3.001 N/A ARG 254.A NE ALA 246.A O no hydrogen 3.036 N/A ARG 254.A NH1 ALA 246.A O no hydrogen 3.503 N/A ALA 255.A N TYR 251.A O no hydrogen 3.375 N/A SER 256.A N.A GLU 252.A O no hydrogen 3.142 N/A SER 256.A N.B GLU 252.A O no hydrogen 3.160 N/A SER 256.A OG.A GLU 252.A O no hydrogen 3.366 N/A SER 256.A OG.B GLN 253.A O no hydrogen 2.666 N/A VAL 257.A N GLN 253.A O no hydrogen 2.926 N/A LEU 258.A N ARG 254.A O no hydrogen 3.111 N/A ALA 259.A N ALA 255.A O no hydrogen 2.881 N/A GLN 260.A N SER 256.A O.A no hydrogen 3.091 N/A GLN 260.A N SER 256.A O.B no hydrogen 3.158 N/A GLN 260.A NE2 THR 9.A O no hydrogen 3.173 N/A GLN 260.A NE2 ALA 11.A O no hydrogen 2.884 N/A VAL 261.A N VAL 257.A O no hydrogen 3.131 N/A GLY 262.A N LEU 258.A O no hydrogen 3.235 N/A ARG 263.A N ALA 259.A O no hydrogen 3.097 N/A ARG 263.A NH1 GLN 260.A OE1 no hydrogen 3.153 N/A ILE 264.A N GLN 260.A O no hydrogen 3.051 N/A ALA 265.A N VAL 261.A O no hydrogen 2.926 N/A ASP 266.A N GLY 262.A O no hydrogen 3.017 N/A ARG 267.A N ARG 263.A O no hydrogen 3.237 N/A LEU 268.A N ILE 264.A O no hydrogen 2.978 N/A ILE 269.A N ALA 265.A O no hydrogen 2.996 N/A GLY 270.A N ASP 266.A O no hydrogen 3.150 N/A