Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4e40_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): LYS 4.A N ASP 186.A OD2 no hydrogen 2.887 N/A VAL 5.A N ASP 186.A OD2 no hydrogen 3.391 N/A GLU 8.A N ASP 12.A OD2 no hydrogen 3.279 N/A ASP 12.A N ASP 9.A OD2 no hydrogen 2.903 N/A VAL 13.A N ASP 9.A O no hydrogen 3.111 N/A ALA 14.A N SER 10.A O no hydrogen 2.970 N/A ALA 15.A N ASP 11.A O no hydrogen 2.875 N/A ALA 16.A N ASP 12.A O no hydrogen 2.824 N/A CYS 17.A N VAL 13.A O no hydrogen 2.825 N/A CYS 17.A SG SER 161.A O no hydrogen 3.835 N/A GLU 18.A N ALA 14.A O no hydrogen 2.994 N/A LEU 19.A N ALA 15.A O no hydrogen 2.871 N/A ARG 20.A N ALA 16.A O no hydrogen 2.831 N/A ARG 20.A NH1 SER 139.A OG no hydrogen 2.835 N/A ARG 20.A NH2 SER 161.A O no hydrogen 3.445 N/A ALA 21.A N CYS 17.A O no hydrogen 3.097 N/A GLN 22.A N GLU 18.A O no hydrogen 2.977 N/A GLN 22.A NE2 SER 172.A OG no hydrogen 2.690 N/A LEU 23.A N LEU 19.A O no hydrogen 2.886 N/A ALA 24.A N ARG 20.A O no hydrogen 2.879 N/A GLY 25.A N ALA 21.A O no hydrogen 3.115 N/A GLY 25.A N GLN 22.A O no hydrogen 3.015 N/A VAL 26.A N LEU 23.A O no hydrogen 3.127 N/A ALA 29.A N GLY 25.A O no hydrogen 3.020 N/A SER 30.A N VAL 26.A O no hydrogen 2.824 N/A SER 30.A OG VAL 26.A O no hydrogen 3.338 N/A SER 30.A OG SER 27.A O no hydrogen 2.817 N/A SER 30.A OG ALA 124.A O no hydrogen 3.562 N/A GLY 31.A N SER 27.A O no hydrogen 3.098 N/A ILE 32.A N ILE 28.A O no hydrogen 2.965 N/A LEU 33.A N ALA 29.A O no hydrogen 2.879 N/A LEU 34.A N SER 30.A O no hydrogen 2.993 N/A ARG 35.A N GLY 31.A O no hydrogen 3.058 N/A VAL 38.A N LEU 34.A O no hydrogen 3.199 N/A ILE 39.A N ARG 35.A O no hydrogen 3.083 N/A ARG 40.A N.A PRO 36.A O no hydrogen 2.894 N/A ARG 40.A N.B PRO 36.A O no hydrogen 2.869 N/A ARG 40.A NH1.B GLU 211.A OE1.B no hydrogen 3.506 N/A ASN 41.A N ALA 37.A O no hydrogen 2.800 N/A ALA 42.A N VAL 38.A O no hydrogen 3.155 N/A ALA 42.A N ILE 39.A O no hydrogen 3.085 N/A THR 43.A N ARG 40.A O.A no hydrogen 2.773 N/A THR 43.A OG1 ARG 40.A O.A no hydrogen 2.641 N/A THR 43.A OG1 ARG 40.A O.B no hydrogen 2.816 N/A THR 44.A N ASN 41.A O no hydrogen 3.128 N/A THR 44.A OG1 ASN 41.A O no hydrogen 2.928 N/A SER 47.A N THR 43.A O no hydrogen 3.184 N/A SER 47.A OG THR 43.A O no hydrogen 3.346 N/A ARG 48.A N THR 44.A O no hydrogen 2.836 N/A ARG 48.A NH2 ASN 111.A OD1 no hydrogen 2.997 N/A LYS 49.A N GLU 45.A O no hydrogen 2.916 N/A LYS 50.A N PHE 46.A O no hydrogen 2.823 N/A LYS 50.A NZ GLU 225.A OE2 no hydrogen 3.233 N/A SER 51.A N SER 47.A O no hydrogen 2.899 N/A SER 51.A OG ARG 48.A O no hydrogen 2.714 N/A GLU 52.A N ARG 48.A O no hydrogen 2.966 N/A ASP 53.A N.A LYS 49.A O no hydrogen 2.917 N/A ASP 53.A N.B LYS 49.A O no hydrogen 2.930 N/A ILE 54.A N LYS 50.A O no hydrogen 2.943 N/A LEU 55.A N SER 51.A O no hydrogen 3.049 N/A ALA 56.A N GLU 52.A O no hydrogen 2.967 N/A LYS 57.A N ASP 53.A O.A no hydrogen 2.899 N/A LYS 57.A N ASP 53.A O.B no hydrogen 2.966 N/A LYS 57.A NZ ASP 53.A OD1.A no hydrogen 3.468 N/A LYS 57.A NZ ASP 53.A OD2.A no hydrogen 3.351 N/A GLY 58.A N ILE 54.A O no hydrogen 2.951 N/A GLY 59.A N LEU 55.A O no hydrogen 2.911 N/A ALA 60.A N ALA 56.A O no hydrogen 2.986 N/A ALA 61.A N LYS 57.A O no hydrogen 3.005 N/A VAL 62.A N GLY 58.A O no hydrogen 3.001 N/A GLU 63.A N GLY 59.A O no hydrogen 3.111 N/A ARG 64.A N ALA 60.A O no hydrogen 3.034 N/A ARG 64.A NH2 GLU 239.A OE1.A no hydrogen 3.201 N/A ARG 64.A NH2 GLU 239.A OE2.B no hydrogen 2.615 N/A ALA 65.A N ALA 61.A O no hydrogen 2.899 N/A SER 66.A N VAL 62.A O no hydrogen 2.840 N/A SER 66.A OG VAL 62.A O no hydrogen 3.260 N/A SER 66.A OG HIS 93.A NE2 no hydrogen 2.784 N/A ALA 67.A N GLU 63.A O no hydrogen 2.848 N/A ALA 68.A N ARG 64.A O no hydrogen 3.061 N/A VAL 69.A N ALA 65.A O no hydrogen 3.046 N/A ASP 70.A N SER 66.A O no hydrogen 2.941 N/A ARG 71.A N ALA 67.A O no hydrogen 2.949 N/A VAL 72.A N ALA 68.A O no hydrogen 3.320 N/A VAL 72.A N VAL 69.A O no hydrogen 3.122 N/A SER 73.A N ASP 70.A O no hydrogen 2.974 N/A SER 73.A OG ASP 70.A O no hydrogen 2.994 N/A LEU 75.A N VAL 72.A O no hydrogen 2.948 N/A THR 78.A OG1 ASP 76.A OD1 no hydrogen 3.139 N/A THR 78.A OG1 ASP 76.A OD2 no hydrogen 3.289 N/A ASN 79.A N ASP 76.A O no hydrogen 3.034 N/A ALA 82.A N ASN 79.A OD1 no hydrogen 3.008 N/A GLN 83.A N ASN 79.A O no hydrogen 2.922 N/A LYS 84.A N GLU 80.A O no hydrogen 3.174 N/A VAL 85.A N THR 81.A O no hydrogen 3.037 N/A ARG 86.A N ALA 82.A O no hydrogen 2.884 N/A ARG 86.A NH1 LEU 75.A O no hydrogen 2.806 N/A ARG 86.A NH2 ASP 76.A O no hydrogen 3.205 N/A LYS 87.A N GLN 83.A O no hydrogen 2.943 N/A ALA 88.A N LYS 84.A O no hydrogen 2.945 N/A ALA 89.A N VAL 85.A O no hydrogen 2.911 N/A ALA 90.A N ARG 86.A O no hydrogen 3.051 N/A VAL 91.A N LYS 87.A O no hydrogen 2.972 N/A ALA 92.A N ALA 88.A O no hydrogen 2.983 N/A HIS 93.A N ALA 89.A O no hydrogen 2.980 N/A HIS 93.A NE2 SER 66.A OG no hydrogen 2.784 N/A HIS 94.A N ALA 90.A O no hydrogen 2.912 N/A ALA 95.A N VAL 91.A O no hydrogen 2.851 N/A LEU 96.A N ALA 92.A O no hydrogen 2.979 N/A GLU 97.A N HIS 93.A O no hydrogen 3.172 N/A HIS 98.A ND1 GLU 101.A OE1 no hydrogen 2.865 N/A VAL 99.A N ALA 95.A O no hydrogen 2.884 N/A LYS 100.A N LEU 96.A O no hydrogen 2.944 N/A GLU 101.A N GLU 97.A O no hydrogen 3.059 N/A GLU 102.A N HIS 98.A O no hydrogen 2.916 N/A VAL 103.A N VAL 99.A O no hydrogen 2.869 N/A GLU 104.A N LYS 100.A O no hydrogen 2.913 N/A ILE 105.A N GLU 101.A O no hydrogen 3.088 N/A VAL 106.A N GLU 102.A O no hydrogen 3.009 N/A ALA 107.A N VAL 103.A O no hydrogen 2.969 N/A LYS 108.A N GLU 104.A O no hydrogen 2.996 N/A LYS 109.A N ILE 105.A O no hydrogen 2.932 N/A LYS 109.A NZ GLU 216.A OE1 no hydrogen 2.825 N/A VAL 110.A N VAL 106.A O no hydrogen 2.902 N/A ASN 111.A N ALA 107.A O no hydrogen 2.992 N/A GLU 112.A N LYS 108.A O no hydrogen 2.864 N/A ILE 113.A N LYS 109.A O no hydrogen 2.861 N/A ILE 114.A N VAL 110.A O no hydrogen 3.009 N/A GLU 115.A N ASN 111.A O no hydrogen 2.957 N/A LEU 116.A N GLU 112.A O no hydrogen 2.911 N/A THR 117.A N ILE 113.A O no hydrogen 2.843 N/A THR 117.A OG1 ILE 113.A O no hydrogen 2.786 N/A ALA 118.A N ILE 114.A O no hydrogen 3.056 N/A GLY 119.A N GLU 115.A O no hydrogen 3.019 N/A ALA 120.A N LEU 116.A O no hydrogen 2.865 N/A THR 121.A N THR 117.A O no hydrogen 2.846 N/A THR 121.A OG1 THR 117.A O no hydrogen 2.816 N/A GLU 122.A N ALA 118.A O no hydrogen 3.225 N/A HIS 123.A N GLY 119.A O no hydrogen 2.930 N/A ALA 124.A N ALA 120.A O no hydrogen 2.879 N/A LYS 125.A N THR 121.A O no hydrogen 3.048 N/A LYS 125.A NZ GLU 122.A OE2 no hydrogen 3.067 N/A GLY 126.A N GLU 122.A O no hydrogen 2.965 N/A ALA 127.A N HIS 123.A O no hydrogen 2.872 N/A LYS 128.A N ALA 124.A O no hydrogen 2.943 N/A LYS 128.A NZ SER 27.A OG no hydrogen 2.768 N/A LYS 128.A NZ ASP 132.A OD2 no hydrogen 2.959 N/A ALA 129.A N LYS 125.A O no hydrogen 2.965 N/A ASN 130.A N GLY 126.A O no hydrogen 2.993 N/A ASN 130.A ND2 GLY 126.A O no hydrogen 2.889 N/A GLY 131.A N ALA 127.A O no hydrogen 2.814 N/A ASP 132.A N LYS 128.A O no hydrogen 2.896 N/A ALA 133.A N ALA 129.A O no hydrogen 3.030 N/A SER 134.A N ASN 130.A O no hydrogen 2.901 N/A SER 134.A OG ASN 130.A O no hydrogen 2.857 N/A SER 134.A OG GLY 131.A O no hydrogen 3.509 N/A ALA 135.A N GLY 131.A O no hydrogen 2.914 N/A VAL 136.A N ASP 132.A O no hydrogen 3.148 N/A LYS 137.A N ALA 133.A O no hydrogen 3.327 N/A LYS 137.A NZ GLY 1.A O no hydrogen 2.816 N/A LYS 137.A NZ ALA 188.A O no hydrogen 3.137 N/A VAL 138.A N SER 134.A O no hydrogen 2.986 N/A SER 139.A N ALA 135.A O no hydrogen 2.812 N/A SER 139.A OG ALA 135.A O no hydrogen 2.994 N/A ASN 140.A N VAL 136.A O no hydrogen 2.899 N/A ASN 140.A ND2 GLU 2.A OE2 no hydrogen 2.812 N/A LEU 141.A N LYS 137.A O no hydrogen 3.087 N/A LEU 142.A N VAL 138.A O no hydrogen 2.991 N/A ALA 143.A N SER 139.A O no hydrogen 2.886 N/A ARG 144.A N ASN 140.A O no hydrogen 2.883 N/A ARG 144.A NH1 GLU 2.A OE2 no hydrogen 3.179 N/A ALA 145.A N LEU 141.A O no hydrogen 3.077 N/A LYS 146.A N LEU 142.A O no hydrogen 3.380 N/A LYS 146.A N ALA 143.A O no hydrogen 3.250 N/A GLU 147.A N ARG 144.A O no hydrogen 2.843 N/A SER 148.A N ALA 145.A O no hydrogen 3.060 N/A ASN 150.A N SER 148.A OG no hydrogen 3.029 N/A TYR 152.A N ASN 150.A OD1 no hydrogen 2.920 N/A VAL 153.A N ASN 150.A OD1 no hydrogen 3.175 N/A LYS 154.A N ASN 150.A O no hydrogen 2.918 N/A GLU 155.A N GLN 151.A O no hydrogen 2.959 N/A ALA 156.A N TYR 152.A O no hydrogen 2.963 N/A ALA 157.A N VAL 153.A O no hydrogen 2.878 N/A GLU 158.A N LYS 154.A O no hydrogen 2.993 N/A GLU 159.A N GLU 155.A O no hydrogen 3.153 N/A GLU 159.A N ALA 156.A O no hydrogen 3.230 N/A CYS 160.A N ALA 157.A O no hydrogen 3.119 N/A CYS 160.A SG SER 161.A O no hydrogen 3.793 N/A ASN 165.A N ALA 21.A O no hydrogen 3.036 N/A ASN 165.A ND2 GLU 18.A OE2 no hydrogen 3.439 N/A ASP 167.A N ASN 165.A OD1 no hydrogen 2.714 N/A THR 169.A N SER 172.A OG no hydrogen 3.023 N/A SER 172.A N THR 169.A OG1 no hydrogen 2.905 N/A SER 172.A OG THR 169.A O no hydrogen 3.217 N/A LEU 173.A N THR 169.A O no hydrogen 2.900 N/A ALA 174.A N ALA 170.A O no hydrogen 2.915 N/A ALA 175.A N LYS 171.A O no hydrogen 3.031 N/A ALA 176.A N SER 172.A O no hydrogen 3.017 N/A LEU 177.A N LEU 173.A O no hydrogen 2.916 N/A ASP 178.A N ALA 174.A O no hydrogen 2.966 N/A LYS 179.A N ALA 175.A O no hydrogen 3.304 N/A LYS 179.A N ALA 176.A O no hydrogen 3.309 N/A LEU 180.A N LEU 177.A O no hydrogen 3.012 N/A LYS 184.A N LEU 180.A O no hydrogen 2.908 N/A LYS 184.A NZ ASP 178.A OD1 no hydrogen 2.870 N/A GLU 185.A N PRO 181.A O no hydrogen 3.111 N/A ASP 186.A N VAL 183.A O no hydrogen 3.121 N/A ALA 188.A N ASP 186.A OD1 no hydrogen 2.845 N/A VAL 189.A N ASP 186.A O no hydrogen 3.025 N/A LYS 190.A N ASP 186.A O no hydrogen 2.794 N/A LYS 190.A NZ GLU 185.A OE2 no hydrogen 2.495 N/A PHE 193.A N VAL 189.A O no hydrogen 2.850 N/A GLN 194.A N LYS 190.A O no hydrogen 3.103 N/A SER 195.A N THR 191.A O no hydrogen 2.896 N/A SER 195.A OG THR 192.A O no hydrogen 2.739 N/A ILE 196.A N THR 192.A O no hydrogen 3.079 N/A LEU 197.A N PHE 193.A O no hydrogen 3.283 N/A THR 198.A N GLN 194.A O no hydrogen 2.990 N/A THR 198.A OG1 GLN 194.A O no hydrogen 3.119 N/A THR 198.A OG1 SER 195.A O no hydrogen 3.131 N/A SER 199.A N SER 195.A O no hydrogen 2.833 N/A SER 199.A OG SER 195.A O no hydrogen 2.964 N/A LEU 200.A N ILE 196.A O no hydrogen 2.855 N/A ASP 201.A N.A LEU 197.A O no hydrogen 2.965 N/A ASP 201.A N.B LEU 197.A O no hydrogen 2.949 N/A ASN 202.A N THR 198.A O no hydrogen 2.903 N/A LEU 203.A N SER 199.A O no hydrogen 2.874 N/A ASP 204.A N LEU 200.A O no hydrogen 2.981 N/A LYS 205.A N ASP 201.A O.A no hydrogen 3.115 N/A LYS 205.A N ASP 201.A O.B no hydrogen 2.916 N/A LYS 205.A NZ ASP 201.A OD1.B no hydrogen 3.262 N/A LYS 205.A NZ ASP 201.A OD2.B no hydrogen 2.749 N/A ASP 206.A N ASN 202.A O no hydrogen 2.869 N/A VAL 207.A N LEU 203.A O no hydrogen 3.031 N/A LYS 208.A N ASP 204.A O no hydrogen 3.013 N/A SER 209.A N.A LYS 205.A O no hydrogen 2.882 N/A SER 209.A N.B LYS 205.A O no hydrogen 2.894 N/A SER 209.A OG.A LYS 205.A O no hydrogen 3.185 N/A VAL 210.A N ASP 206.A O no hydrogen 2.874 N/A GLU 211.A N.A VAL 207.A O no hydrogen 3.044 N/A GLU 211.A N.B VAL 207.A O no hydrogen 3.054 N/A GLN 212.A N LYS 208.A O no hydrogen 3.047 N/A ARG 213.A N SER 209.A O.A no hydrogen 2.778 N/A ARG 213.A N SER 209.A O.B no hydrogen 2.786 N/A ARG 213.A NE GLU 216.A OE1 no hydrogen 2.855 N/A ARG 213.A NH1 GLN 212.A OE1 no hydrogen 3.445 N/A ARG 213.A NH1 GLU 216.A OE1 no hydrogen 3.460 N/A ARG 213.A NH1 GLU 216.A OE2 no hydrogen 2.835 N/A ALA 214.A N VAL 210.A O no hydrogen 2.903 N/A GLU 215.A N GLU 211.A O.A no hydrogen 3.184 N/A GLU 215.A N GLU 211.A O.B no hydrogen 2.958 N/A GLU 216.A N GLN 212.A O no hydrogen 3.027 N/A LEU 217.A N ARG 213.A O no hydrogen 2.794 N/A GLU 218.A N ALA 214.A O no hydrogen 3.112 N/A THR 219.A N GLU 215.A O no hydrogen 2.927 N/A THR 219.A OG1 GLU 215.A O no hydrogen 3.243 N/A ALA 220.A N GLU 216.A O no hydrogen 2.994 N/A LEU 221.A N LEU 217.A O no hydrogen 2.943 N/A GLU 222.A N GLU 218.A O no hydrogen 3.014 N/A LYS 223.A N THR 219.A O no hydrogen 3.036 N/A ALA 224.A N ALA 220.A O no hydrogen 2.803 N/A GLU 225.A N LEU 221.A O no hydrogen 2.869 N/A ARG 226.A N GLU 222.A O no hydrogen 2.963 N/A GLN 227.A N LYS 223.A O no hydrogen 2.930 N/A LEU 228.A N ALA 224.A O no hydrogen 2.855 N/A GLU 229.A N GLU 225.A O no hydrogen 3.008 N/A LYS 230.A N ARG 226.A O no hydrogen 3.116 N/A ALA 231.A N GLN 227.A O no hydrogen 2.949 N/A GLU 232.A N LEU 228.A O no hydrogen 2.787 N/A LYS 233.A N GLU 229.A O no hydrogen 2.986 N/A ALA 234.A N LYS 230.A O no hydrogen 2.963 N/A ALA 235.A N ALA 231.A O no hydrogen 2.897 N/A GLU 236.A N.A GLU 232.A O no hydrogen 2.961 N/A GLU 236.A N.B GLU 232.A O no hydrogen 2.946 N/A GLU 237.A N LYS 233.A O no hydrogen 3.028 N/A ALA 238.A N ALA 234.A O no hydrogen 2.978 N/A GLU 239.A N.A ALA 235.A O no hydrogen 2.966 N/A GLU 239.A N.B ALA 235.A O no hydrogen 2.955 N/A THR 240.A N GLU 236.A O.A no hydrogen 2.760 N/A THR 240.A N GLU 236.A O.B no hydrogen 2.929 N/A THR 240.A OG1 GLU 236.A O.A no hydrogen 3.179 N/A THR 240.A OG1 GLU 236.A O.B no hydrogen 2.929 N/A GLU 241.A N GLU 237.A O no hydrogen 2.865 N/A SER 242.A N ALA 238.A O no hydrogen 3.031 N/A SER 242.A OG ALA 68.A O no hydrogen 3.113 N/A SER 243.A N GLU 239.A O.A no hydrogen 2.991 N/A SER 243.A N GLU 239.A O.B no hydrogen 3.144 N/A SER 243.A OG GLU 239.A O.A no hydrogen 3.222 N/A SER 243.A OG GLU 239.A O.B no hydrogen 3.061 N/A LYS 244.A N THR 240.A O no hydrogen 3.458 N/A LYS 244.A NZ GLU 241.A OE2 no hydrogen 3.135 N/A VAL 245.A N SER 242.A O no hydrogen 2.967 N/A