Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4k46_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): MET 1.A N LYS 79.A O no hydrogen 3.265 N/A ARG 2.A N ASP 104.A OD2 no hydrogen 2.789 N/A ARG 2.A NH1 VAL 102.A O no hydrogen 3.290 N/A ILE 3.A N PHE 81.A O no hydrogen 3.073 N/A ILE 4.A N TYR 105.A O no hydrogen 2.842 N/A LEU 5.A N LEU 83.A O no hydrogen 3.112 N/A LEU 6.A N ILE 107.A O no hydrogen 2.713 N/A ALA 11.A N ALA 8.A O no hydrogen 2.918 N/A LYS 13.A NZ GLY 7.A O no hydrogen 3.217 N/A LYS 13.A NZ ALA 8.A O no hydrogen 3.133 N/A GLN 16.A N GLY 12.A O no hydrogen 3.043 N/A GLN 16.A NE2 VAL 202.A O no hydrogen 3.194 N/A ALA 17.A N LYS 13.A O no hydrogen 2.785 N/A GLN 18.A NE2 GLY 14.A O no hydrogen 3.094 N/A GLN 18.A NE2 GLN 28.A OE1 no hydrogen 3.667 N/A ILE 20.A N GLN 16.A O no hydrogen 2.949 N/A MET 21.A N ALA 17.A O no hydrogen 2.695 N/A ALA 22.A N GLN 18.A O no hydrogen 3.165 N/A LYS 23.A N PHE 19.A O no hydrogen 3.034 N/A LYS 23.A NZ GLU 210.A OE1 no hydrogen 3.125 N/A PHE 24.A N ILE 20.A O no hydrogen 2.942 N/A ILE 29.A N LEU 82.A O.A no hydrogen 2.577 N/A ILE 29.A N LEU 82.A O.B no hydrogen 2.593 N/A THR 31.A OG1 GLY 85.A O no hydrogen 3.105 N/A ASP 33.A N SER 30.A OG no hydrogen 3.168 N/A MET 34.A N SER 30.A O no hydrogen 2.974 N/A LEU 35.A N THR 31.A O no hydrogen 2.916 N/A ARG 36.A N GLY 32.A O no hydrogen 2.933 N/A ARG 36.A NH1 ASP 33.A OD1 no hydrogen 3.033 N/A ALA 37.A N ASP 33.A O no hydrogen 2.929 N/A ALA 38.A N MET 34.A O no hydrogen 3.127 N/A ILE 39.A N LEU 35.A O no hydrogen 2.963 N/A LYS 40.A N ARG 36.A O no hydrogen 3.042 N/A ALA 41.A N ALA 37.A O no hydrogen 3.006 N/A GLY 42.A N ILE 39.A O no hydrogen 2.992 N/A THR 43.A N ALA 38.A O no hydrogen 3.273 N/A THR 43.A OG1 ALA 38.A O no hydrogen 3.253 N/A GLY 46.A N THR 43.A OG1 no hydrogen 2.937 N/A LYS 47.A N THR 43.A O no hydrogen 2.841 N/A LYS 47.A NZ GLY 42.A O no hydrogen 2.934 N/A GLN 48.A N GLU 44.A O no hydrogen 3.083 N/A GLN 48.A NE2 GLU 44.A OE2 no hydrogen 3.526 N/A ALA 49.A N LEU 45.A O no hydrogen 2.865 N/A LYS 50.A N GLY 46.A O no hydrogen 2.961 N/A LYS 50.A NZ ASP 54.A OD2 no hydrogen 2.757 N/A LYS 50.A NZ GLU 157.A OE2 no hydrogen 3.313 N/A SER 51.A OG GLN 48.A O no hydrogen 3.418 N/A ILE 53.A N ALA 49.A O no hydrogen 2.839 N/A ASP 54.A N LYS 50.A O no hydrogen 2.892 N/A ALA 55.A N SER 51.A O no hydrogen 3.028 N/A ALA 55.A N VAL 52.A O no hydrogen 3.151 N/A GLY 56.A N ILE 53.A O no hydrogen 2.984 N/A GLN 57.A N VAL 52.A O no hydrogen 3.086 N/A ILE 63.A N SER 60.A OG no hydrogen 3.124 N/A ILE 64.A N SER 60.A O no hydrogen 3.042 N/A LEU 65.A N ASP 61.A O no hydrogen 2.833 N/A GLY 66.A N ASP 62.A O no hydrogen 3.291 N/A LEU 67.A N ILE 63.A O no hydrogen 3.105 N/A VAL 68.A N ILE 64.A O no hydrogen 2.971 N/A LYS 69.A N LEU 65.A O no hydrogen 2.911 N/A GLU 70.A N GLY 66.A O no hydrogen 3.154 N/A ARG 71.A N LEU 67.A O no hydrogen 3.020 N/A ARG 71.A NH1 ARG 71.A O no hydrogen 3.212 N/A ARG 71.A NH1 ASP 76.A OD1 no hydrogen 3.360 N/A ARG 71.A NH1 ASP 76.A OD2 no hydrogen 2.958 N/A ARG 71.A NH2 ASP 76.A OD1 no hydrogen 2.955 N/A ILE 72.A N VAL 68.A O no hydrogen 2.912 N/A GLN 74.A N ARG 71.A O no hydrogen 3.105 N/A CYS 77.A N GLN 74.A O no hydrogen 3.177 N/A CYS 77.A SG ARG 71.A O no hydrogen 3.878 N/A CYS 77.A SG ASP 76.A OD2 no hydrogen 3.529 N/A ALA 78.A N ASP 75.A O no hydrogen 3.057 N/A GLY 80.A N CYS 77.A O no hydrogen 3.244 N/A PHE 81.A N MET 1.A O no hydrogen 3.014 N/A LEU 82.A N.A PRO 27.A O no hydrogen 2.823 N/A LEU 82.A N.B PRO 27.A O no hydrogen 2.830 N/A LEU 83.A N ILE 3.A O no hydrogen 2.765 N/A ASP 84.A N ILE 29.A O no hydrogen 2.931 N/A ARG 88.A N GLN 92.A OE1 no hydrogen 2.838 N/A ARG 88.A NH1 GLY 85.A O no hydrogen 3.226 N/A THR 89.A OG1 ASP 61.A OD1 no hydrogen 2.803 N/A GLN 92.A N THR 89.A OG1 no hydrogen 3.255 N/A GLN 92.A NE2 ASP 61.A OD1 no hydrogen 2.950 N/A ALA 93.A N THR 89.A O no hydrogen 3.167 N/A ASP 94.A N ILE 90.A O no hydrogen 2.878 N/A GLY 95.A N PRO 91.A O no hydrogen 2.916 N/A LEU 96.A N GLN 92.A O no hydrogen 3.099 N/A LYS 97.A N ALA 93.A O no hydrogen 2.883 N/A LYS 97.A NZ GLU 185.A OE1 no hydrogen 3.450 N/A GLU 98.A N ASP 94.A O no hydrogen 2.743 N/A VAL 99.A N GLY 95.A O no hydrogen 3.425 N/A GLY 100.A N LYS 97.A O no hydrogen 2.936 N/A VAL 101.A N LEU 96.A O no hydrogen 3.187 N/A ASP 104.A N ARG 2.A O no hydrogen 2.763 N/A TYR 105.A N ARG 2.A O no hydrogen 3.272 N/A VAL 106.A N GLN 192.A O no hydrogen 2.854 N/A ILE 107.A N ILE 4.A O no hydrogen 2.709 N/A GLU 108.A N LEU 194.A O no hydrogen 2.712 N/A PHE 109.A N LEU 6.A O no hydrogen 2.884 N/A ASP 110.A N PHE 196.A O no hydrogen 2.912 N/A ILE 116.A N ALA 112.A O no hydrogen 3.072 N/A VAL 117.A N ASP 113.A O no hydrogen 2.884 N/A GLU 118.A N SER 114.A O no hydrogen 3.180 N/A ARG 119.A N VAL 115.A O no hydrogen 2.934 N/A ARG 119.A NH1 GLY 10.A O no hydrogen 2.930 N/A ARG 119.A NH1 ALA 11.A O no hydrogen 2.846 N/A ARG 119.A NH2 GLY 198.A O no hydrogen 2.680 N/A MET 120.A N ILE 116.A O no hydrogen 3.029 N/A GLY 122.A N ARG 119.A O no hydrogen 3.335 N/A ARG 123.A N MET 120.A O no hydrogen 3.258 N/A ARG 123.A NE ASP 159.A OD2 no hydrogen 2.785 N/A ARG 123.A NH2 ASP 159.A OD1 no hydrogen 2.816 N/A ARG 123.A NH2 ASP 159.A OD2 no hydrogen 3.504 N/A ARG 124.A N TYR 133.A O no hydrogen 2.960 N/A ARG 124.A NH1 ALA 121.A O no hydrogen 3.287 N/A ARG 124.A NH1 ARG 123.A O no hydrogen 2.846 N/A ALA 125.A N VAL 154.A O no hydrogen 2.945 N/A HIS 126.A N ARG 131.A O no hydrogen 2.832 N/A HIS 126.A ND1 SER 129.A OG no hydrogen 2.682 N/A HIS 126.A NE2 GLU 151.A OE1 no hydrogen 2.665 N/A SER 129.A OG HIS 126.A ND1 no hydrogen 2.682 N/A GLY 130.A N HIS 126.A O no hydrogen 2.805 N/A ARG 131.A N SER 129.A OG no hydrogen 3.025 N/A ARG 131.A NE ASP 146.A OD1 no hydrogen 2.936 N/A ARG 131.A NE ASP 146.A OD2 no hydrogen 3.440 N/A ARG 131.A NH2 ASP 146.A OD2 no hydrogen 2.932 N/A TYR 133.A N ARG 124.A O no hydrogen 2.699 N/A TYR 133.A OH ASP 146.A OD1 no hydrogen 2.489 N/A HIS 134.A N ASN 138.A O no hydrogen 2.955 N/A ASN 135.A N GLY 122.A O no hydrogen 3.022 N/A VAL 136.A N HIS 134.A ND1 no hydrogen 3.015 N/A TYR 137.A N HIS 134.A ND1 no hydrogen 3.001 N/A TYR 137.A OH GLU 118.A OE1 no hydrogen 3.040 N/A ASN 138.A N HIS 134.A O no hydrogen 2.984 N/A LYS 141.A N.A ASP 147.A OD1 no hydrogen 2.900 N/A LYS 141.A N.B ASP 147.A OD1 no hydrogen 2.902 N/A LYS 141.A NZ.A ASP 147.A OD2 no hydrogen 3.303 N/A LYS 145.A N VAL 142.A O no hydrogen 3.153 N/A ASP 146.A N GLU 151.A O no hydrogen 2.846 N/A ASP 147.A N TYR 133.A OH no hydrogen 3.066 N/A VAL 148.A N ASP 146.A OD2 no hydrogen 3.334 N/A THR 149.A N ASP 146.A OD2 no hydrogen 2.934 N/A THR 149.A OG1 HIS 126.A NE2 no hydrogen 3.277 N/A THR 149.A OG1 ASP 146.A OD2 no hydrogen 2.850 N/A GLY 150.A N ASP 146.A O no hydrogen 2.985 N/A GLU 151.A N THR 149.A OG1 no hydrogen 3.184 N/A LEU 153.A N GLY 144.A O no hydrogen 2.902 N/A VAL 154.A N ALA 125.A O no hydrogen 2.824 N/A ARG 156.A NE ASP 158.A OD1 no hydrogen 3.083 N/A ARG 156.A NH2 ASP 158.A OD1 no hydrogen 3.463 N/A ARG 156.A NH2 ASP 158.A OD2 no hydrogen 2.948 N/A ASP 159.A N ARG 156.A O no hydrogen 3.039 N/A LYS 160.A N.A GLU 157.A O no hydrogen 3.407 N/A LYS 160.A N.B GLU 157.A O no hydrogen 3.382 N/A LYS 160.A NZ.A THR 163.A OG1 no hydrogen 3.187 N/A VAL 164.A N LYS 160.A O.A no hydrogen 3.108 N/A VAL 164.A N LYS 160.A O.B no hydrogen 2.954 N/A LEU 165.A N GLU 161.A O no hydrogen 3.314 N/A ALA 166.A N GLU 162.A O no hydrogen 3.157 N/A ARG 167.A N THR 163.A O no hydrogen 2.843 N/A ARG 167.A NH2 ASP 158.A O no hydrogen 3.075 N/A ARG 167.A NH2 ASP 159.A OD1 no hydrogen 2.953 N/A LEU 168.A N VAL 164.A O no hydrogen 2.957 N/A GLY 169.A N LEU 165.A O no hydrogen 3.109 N/A VAL 170.A N ALA 166.A O no hydrogen 2.938 N/A TYR 171.A N ARG 167.A O no hydrogen 2.763 N/A HIS 172.A N.A LEU 168.A O no hydrogen 2.952 N/A HIS 172.A N.B LEU 168.A O no hydrogen 2.918 N/A HIS 172.A NE2.A ASP 113.A OD1 no hydrogen 2.601 N/A HIS 172.A NE2.A ASP 113.A OD2 no hydrogen 3.070 N/A ASN 173.A N GLY 169.A O no hydrogen 3.073 N/A GLN 174.A N VAL 170.A O no hydrogen 2.791 N/A THR 175.A N TYR 171.A O no hydrogen 2.881 N/A THR 175.A OG1 ARG 88.A O no hydrogen 2.658 N/A ALA 176.A N TYR 171.A O no hydrogen 2.773 N/A LEU 178.A N THR 175.A O no hydrogen 2.966 N/A ILE 179.A N ALA 176.A O no hydrogen 2.948 N/A TYR 181.A N PRO 177.A O no hydrogen 3.020 N/A TYR 181.A OH ASP 94.A OD1 no hydrogen 2.809 N/A TYR 182.A N LEU 178.A O no hydrogen 2.875 N/A GLY 183.A N ILE 179.A O no hydrogen 2.917 N/A LYS 184.A N ALA 180.A O no hydrogen 2.904 N/A GLU 185.A N TYR 181.A O no hydrogen 3.128 N/A ALA 186.A N TYR 182.A O no hydrogen 2.851 N/A GLU 187.A N GLY 183.A O no hydrogen 3.015 N/A ALA 188.A N LYS 184.A O no hydrogen 2.984 N/A GLY 189.A N ALA 186.A O no hydrogen 2.973 N/A ASN 190.A N GLU 185.A O no hydrogen 2.934 N/A ASN 190.A ND2 GLU 185.A OE1 no hydrogen 2.916 N/A THR 191.A OG1.A VAL 103.A O no hydrogen 3.159 N/A THR 191.A OG1.A GLN 192.A O no hydrogen 3.368 N/A THR 191.A OG1.B VAL 103.A O no hydrogen 3.194 N/A GLN 192.A N ASP 104.A O no hydrogen 2.933 N/A TYR 193.A OH GLU 108.A OE2 no hydrogen 2.489 N/A LEU 194.A N VAL 106.A O no hydrogen 2.890 N/A PHE 196.A N GLU 108.A O no hydrogen 2.828 N/A GLY 198.A N ASP 110.A O no hydrogen 3.000 N/A THR 199.A N ASP 197.A OD1 no hydrogen 3.046 N/A THR 199.A OG1 ASP 197.A OD1 no hydrogen 2.815 N/A THR 199.A OG1 ASP 197.A OD2 no hydrogen 3.428 N/A LYS 200.A NZ GLU 208.A OE1 no hydrogen 3.493 N/A LYS 200.A NZ GLU 208.A OE2 no hydrogen 2.530 N/A GLU 204.A N ALA 201.A O no hydrogen 2.868 N/A VAL 205.A N ALA 201.A O no hydrogen 2.918 N/A SER 206.A N VAL 202.A O no hydrogen 2.965 N/A SER 206.A OG GLN 16.A OE1 no hydrogen 2.623 N/A SER 206.A OG VAL 202.A O no hydrogen 3.163 N/A ALA 207.A N ALA 203.A O no hydrogen 3.020 N/A GLU 208.A N GLU 204.A O no hydrogen 3.166 N/A LEU 209.A N VAL 205.A O no hydrogen 3.081 N/A GLU 210.A N SER 206.A O no hydrogen 2.935 N/A LYS 211.A N ALA 207.A O no hydrogen 3.174 N/A ALA 212.A N GLU 208.A O no hydrogen 2.988 N/A ALA 212.A N LEU 209.A O no hydrogen 3.192 N/A LEU 213.A N LEU 209.A O no hydrogen 2.942 N/A