Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4n9k_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): PHE 3.A N ASP 1.A OD1 no hydrogen 3.473 N/A PHE 3.A N ASP 1.A OD2 no hydrogen 3.216 N/A ALA 4.A N ASP 1.A OD2 no hydrogen 3.303 N/A LYS 5.A N ASP 1.A O no hydrogen 3.129 N/A LEU 6.A N ASP 2.A O no hydrogen 3.236 N/A GLU 7.A N PHE 3.A O no hydrogen 3.035 N/A GLU 8.A N ALA 4.A O no hydrogen 2.980 N/A GLN 9.A N LYS 5.A O no hydrogen 2.817 N/A PHE 10.A N LEU 6.A O no hydrogen 3.069 N/A ASP 11.A N GLU 8.A O no hydrogen 3.410 N/A ALA 12.A N GLU 7.A O no hydrogen 3.132 N/A LYS 13.A N SER 231.A O no hydrogen 2.862 N/A LYS 13.A NZ GLU 33.A OE2 no hydrogen 2.914 N/A LEU 14.A N GLU 7.A OE2 no hydrogen 2.862 N/A GLY 15.A N LEU 229.A O no hydrogen 2.971 N/A ILE 16.A N TYR 29.A O no hydrogen 2.739 N/A PHE 17.A N ALA 227.A O no hydrogen 3.106 N/A ALA 18.A N VAL 27.A O no hydrogen 2.717 N/A LEU 19.A N VAL 225.A O no hydrogen 2.815 N/A ASP 20.A N ARG 25.A O no hydrogen 2.914 N/A THR 21.A N PRO 223.A O no hydrogen 2.996 N/A GLY 22.A N ASP 20.A OD1 no hydrogen 2.661 N/A THR 23.A N ASP 20.A O no hydrogen 3.239 N/A ASN 24.A N ASP 20.A O no hydrogen 2.717 N/A ARG 25.A N THR 23.A OG1 no hydrogen 3.137 N/A VAL 27.A N ALA 18.A O no hydrogen 2.877 N/A TYR 29.A N ILE 16.A O no hydrogen 3.093 N/A TYR 29.A OH GLU 7.A OE1 no hydrogen 2.485 N/A ARG 30.A NE GLU 7.A OE2 no hydrogen 2.869 N/A ARG 30.A NH2 GLU 7.A OE1 no hydrogen 3.191 N/A GLU 33.A N ARG 30.A O no hydrogen 3.151 N/A ARG 34.A NH1 VAL 126.A O no hydrogen 2.966 N/A ARG 34.A NH1 THR 147.A OG1 no hydrogen 2.765 N/A ARG 34.A NH2 VAL 126.A O no hydrogen 3.010 N/A PHE 35.A N SER 148.A O no hydrogen 2.994 N/A PHE 37.A N ASP 146.A O no hydrogen 3.016 N/A SER 39.A OG SER 97.A OG no hydrogen 2.970 N/A THR 40.A N PHE 37.A O no hydrogen 3.322 N/A THR 40.A OG1 PHE 37.A O no hydrogen 2.693 N/A ILE 41.A N ALA 38.A O no hydrogen 3.412 N/A LYS 42.A N SER 39.A O no hydrogen 2.936 N/A LYS 42.A NZ SER 39.A OG no hydrogen 2.831 N/A LYS 42.A NZ SER 97.A O no hydrogen 3.085 N/A LYS 42.A NZ SER 97.A OG no hydrogen 2.978 N/A LYS 42.A NZ ASN 99.A OD1 no hydrogen 2.462 N/A ALA 43.A N THR 40.A O no hydrogen 3.156 N/A THR 45.A N ILE 41.A O no hydrogen 2.928 N/A THR 45.A OG1 ILE 41.A O no hydrogen 2.847 N/A VAL 46.A N LYS 42.A O no hydrogen 3.165 N/A GLY 47.A N ALA 43.A O no hydrogen 3.104 N/A VAL 48.A N LEU 44.A O no hydrogen 3.006 N/A LEU 49.A N THR 45.A O no hydrogen 2.881 N/A LEU 50.A N VAL 46.A O no hydrogen 2.772 N/A GLN 51.A N GLY 47.A O no hydrogen 3.022 N/A GLN 52.A N VAL 48.A O no hydrogen 3.072 N/A GLN 52.A N LEU 49.A O no hydrogen 3.220 N/A LYS 53.A NZ GLN 108.A OE1.B no hydrogen 2.678 N/A ASP 57.A N SER 54.A O no hydrogen 2.927 N/A ASP 57.A N SER 54.A OG no hydrogen 2.860 N/A LEU 58.A N ILE 55.A O no hydrogen 2.985 N/A ASN 59.A N GLU 56.A O no hydrogen 3.009 N/A GLN 60.A N ASP 57.A O no hydrogen 3.209 N/A GLN 60.A NE2 GLN 108.A OE1.B no hydrogen 2.895 N/A ARG 61.A NH1 THR 82.A O no hydrogen 2.944 N/A ILE 62.A N MET 84.A O no hydrogen 2.726 N/A TYR 64.A OH THR 76.A O no hydrogen 2.512 N/A THR 65.A N ASP 68.A OD2 no hydrogen 2.961 N/A ASP 67.A N THR 65.A OG1 no hydrogen 3.156 N/A ASP 68.A N THR 65.A O no hydrogen 2.863 N/A LEU 69.A N ARG 66.A O no hydrogen 2.872 N/A VAL 70.A N ASN 73.A OD1 no hydrogen 3.002 N/A ASN 73.A ND2 VAL 70.A O no hydrogen 3.129 N/A ILE 75.A N ASP 98.A OD2 no hydrogen 2.846 N/A THR 76.A N ASP 98.A OD2 no hydrogen 2.746 N/A THR 76.A OG1 ASP 98.A OD1 no hydrogen 2.615 N/A THR 76.A OG1 ASP 98.A OD2 no hydrogen 2.942 N/A GLU 77.A N ASN 73.A O no hydrogen 2.995 N/A LYS 78.A N ILE 75.A O no hydrogen 2.997 N/A LYS 78.A NZ GLU 77.A OE2 no hydrogen 3.366 N/A HIS 79.A N THR 76.A O no hydrogen 3.262 N/A THR 82.A N HIS 79.A O no hydrogen 3.168 N/A THR 82.A OG1 HIS 79.A O no hydrogen 3.240 N/A THR 82.A OG1 GLY 83.A O no hydrogen 3.055 N/A MET 84.A N ILE 62.A O no hydrogen 3.110 N/A THR 85.A N GLU 88.A OE1 no hydrogen 2.967 N/A LEU 86.A N GLN 60.A O no hydrogen 2.955 N/A LYS 87.A N LEU 58.A O no hydrogen 2.913 N/A GLU 88.A N THR 85.A OG1 no hydrogen 3.295 N/A LEU 89.A N THR 85.A O no hydrogen 2.783 N/A ALA 90.A N LEU 86.A O no hydrogen 2.870 N/A ASP 91.A N LYS 87.A O no hydrogen 2.881 N/A ALA 92.A N GLU 88.A O no hydrogen 3.001 N/A SER 93.A N LEU 89.A O no hydrogen 2.870 N/A LEU 94.A N ALA 90.A O no hydrogen 3.041 N/A ARG 95.A N ASP 91.A O no hydrogen 2.793 N/A ARG 95.A NE ASP 91.A OD1 no hydrogen 3.440 N/A ARG 95.A NE ASP 91.A OD2 no hydrogen 2.909 N/A ARG 95.A NH1 ARG 180.A O no hydrogen 2.969 N/A TYR 96.A N ALA 92.A O no hydrogen 3.109 N/A SER 97.A OG SER 39.A OG no hydrogen 2.970 N/A ASP 98.A N ALA 92.A O no hydrogen 3.295 N/A ASN 99.A N TYR 72.A O no hydrogen 2.996 N/A ASN 99.A ND2 ASN 71.A OD1 no hydrogen 2.809 N/A ALA 101.A N ASP 98.A OD1 no hydrogen 2.946 N/A GLN 102.A N ASP 98.A O no hydrogen 3.211 N/A GLN 102.A NE2 THR 45.A OG1 no hydrogen 3.076 N/A ASN 103.A N ASN 99.A O no hydrogen 3.093 N/A ASN 103.A ND2 SER 133.A O no hydrogen 2.741 N/A LEU 104.A N ALA 100.A O no hydrogen 3.057 N/A ILE 105.A N ALA 101.A O no hydrogen 3.037 N/A LEU 106.A N GLN 102.A O no hydrogen 2.768 N/A LYS 107.A N ASN 103.A O no hydrogen 3.039 N/A GLN 108.A N LEU 104.A O no hydrogen 3.153 N/A ILE 109.A N ILE 105.A O no hydrogen 3.147 N/A ILE 109.A N LEU 106.A O no hydrogen 3.175 N/A GLY 110.A N LYS 107.A O no hydrogen 3.004 N/A GLY 111.A N LEU 106.A O no hydrogen 2.665 N/A SER 114.A OG ILE 109.A O no hydrogen 2.647 N/A LEU 115.A N GLY 111.A O no hydrogen 2.900 N/A LYS 116.A N PRO 112.A O no hydrogen 2.771 N/A LYS 116.A NZ GLU 130.A OE1 no hydrogen 3.262 N/A LYS 117.A N GLU 113.A O no hydrogen 3.063 N/A GLU 118.A N SER 114.A O no hydrogen 3.131 N/A LEU 119.A N LEU 115.A O no hydrogen 2.993 N/A ARG 120.A N LYS 116.A O no hydrogen 2.987 N/A ARG 120.A NH1 ASP 124.A O no hydrogen 2.646 N/A ARG 120.A NH1 THR 127.A O no hydrogen 2.853 N/A ARG 120.A NH2 THR 127.A O no hydrogen 3.013 N/A ARG 120.A NH2 ASN 128.A OD1 no hydrogen 2.846 N/A LYS 121.A N LYS 117.A O no hydrogen 2.826 N/A LYS 121.A NZ GLU 118.A OE1 no hydrogen 2.784 N/A LYS 121.A NZ GLU 118.A OE2 no hydrogen 3.300 N/A ILE 122.A N GLU 118.A O no hydrogen 3.118 N/A ILE 122.A N LEU 119.A O no hydrogen 3.082 N/A GLY 123.A N ARG 120.A O no hydrogen 3.042 N/A ASP 124.A N LEU 119.A O no hydrogen 2.926 N/A VAL 126.A N ASP 124.A OD1 no hydrogen 2.863 N/A THR 127.A N ASP 124.A OD1 no hydrogen 2.940 N/A THR 127.A OG1 ASP 124.A OD1 no hydrogen 3.304 N/A THR 127.A OG1 ASP 124.A OD2 no hydrogen 2.630 N/A THR 127.A OG1 SER 148.A OG no hydrogen 2.761 N/A ASN 128.A N THR 147.A O no hydrogen 3.056 N/A ASN 128.A ND2 THR 144.A O no hydrogen 3.330 N/A GLU 130.A N ASP 146.A OD1 no hydrogen 2.690 N/A ARG 131.A N ASP 146.A OD1 no hydrogen 2.999 N/A ARG 131.A NE ASP 146.A OD2 no hydrogen 2.651 N/A ARG 131.A NH1 GLU 138.A O no hydrogen 3.130 N/A ARG 131.A NH2 GLU 138.A O no hydrogen 2.821 N/A ARG 131.A NH2 ASP 146.A OD2 no hydrogen 3.009 N/A SER 133.A N ASN 103.A OD1 no hydrogen 2.957 N/A GLU 135.A N GLU 135.A OE1 no hydrogen 2.768 N/A LEU 136.A N PHE 132.A O no hydrogen 2.977 N/A ASN 137.A N PRO 134.A O no hydrogen 3.011 N/A GLU 138.A N GLU 135.A O no hydrogen 3.063 N/A ASN 140.A N GLU 143.A OE1 no hydrogen 3.036 N/A ASN 140.A ND2 GLU 143.A OE2 no hydrogen 2.898 N/A GLU 143.A N ASN 140.A O no hydrogen 3.025 N/A GLN 145.A N GLN 145.A OE1.A no hydrogen 2.883 N/A GLN 145.A NE2.A GLU 143.A OE1 no hydrogen 2.653 N/A GLN 145.A NE2.B GLU 143.A OE1 no hydrogen 3.222 N/A ASP 146.A N ASN 128.A O no hydrogen 2.667 N/A THR 147.A N THR 144.A O no hydrogen 3.249 N/A THR 147.A OG1 THR 144.A O no hydrogen 2.732 N/A SER 148.A N PHE 35.A O no hydrogen 3.029 N/A SER 148.A OG THR 127.A OG1 no hydrogen 2.761 N/A THR 149.A N SER 148.A OG no hydrogen 2.788 N/A ARG 151.A N PRO 31.A O no hydrogen 3.125 N/A ARG 151.A NE ASP 32.A OD1 no hydrogen 2.636 N/A ARG 151.A NH2 ASP 32.A OD1 no hydrogen 3.424 N/A ARG 151.A NH2 ASP 32.A OD2 no hydrogen 2.947 N/A ALA 152.A N THR 149.A OG1 no hydrogen 3.151 N/A LEU 153.A N THR 149.A O no hydrogen 3.029 N/A VAL 154.A N ALA 150.A O no hydrogen 2.994 N/A THR 155.A N ARG 151.A O no hydrogen 2.911 N/A THR 155.A OG1 ARG 151.A O no hydrogen 2.725 N/A SER 156.A N ALA 152.A O no hydrogen 2.874 N/A SER 156.A OG ASP 124.A OD2 no hydrogen 2.666 N/A SER 156.A OG ALA 152.A O no hydrogen 3.298 N/A LEU 157.A N LEU 153.A O no hydrogen 2.979 N/A ARG 158.A N VAL 154.A O no hydrogen 2.944 N/A ALA 159.A N THR 155.A O no hydrogen 3.050 N/A PHE 160.A N SER 156.A O no hydrogen 3.192 N/A ALA 161.A N LEU 157.A O no hydrogen 2.901 N/A LEU 162.A N ARG 158.A O no hydrogen 2.843 N/A GLU 163.A N ARG 158.A O no hydrogen 3.121 N/A SER 168.A OG.B GLU 172.A OE2 no hydrogen 3.115 N/A LYS 170.A N PRO 167.A O no hydrogen 3.009 N/A LYS 170.A NZ LEU 50.A O no hydrogen 3.176 N/A LYS 170.A NZ LYS 53.A O no hydrogen 2.640 N/A ARG 171.A N PRO 167.A O no hydrogen 2.984 N/A ARG 171.A NH1 LEU 166.A O no hydrogen 2.670 N/A GLU 172.A N SER 168.A O no hydrogen 2.818 N/A LEU 173.A N GLU 169.A O no hydrogen 3.447 N/A LEU 174.A N LYS 170.A O no hydrogen 3.203 N/A ILE 175.A N ARG 171.A O no hydrogen 3.032 N/A ASP 176.A N GLU 172.A O no hydrogen 2.942 N/A TRP 177.A N LEU 173.A O no hydrogen 2.901 N/A MET 178.A N LEU 174.A O no hydrogen 3.090 N/A LYS 179.A N ILE 175.A O no hydrogen 2.875 N/A LYS 179.A NZ GLU 197.A OE1 no hydrogen 3.270 N/A ARG 180.A N ASP 176.A O no hydrogen 3.247 N/A ARG 180.A N TRP 177.A O no hydrogen 3.254 N/A ARG 180.A NE ASP 176.A OD1 no hydrogen 3.148 N/A ARG 180.A NE ASP 176.A OD2 no hydrogen 3.455 N/A ARG 180.A NH2 ASP 176.A OD2 no hydrogen 3.008 N/A ASN 181.A N MET 178.A O no hydrogen 3.150 N/A ASN 181.A ND2 THR 183.A OG1 no hydrogen 2.961 N/A ASN 181.A ND2 ASP 200.A OD1 no hydrogen 3.000 N/A ASN 181.A ND2 ASP 200.A OD2 no hydrogen 3.232 N/A THR 182.A N ARG 95.A O no hydrogen 2.968 N/A THR 182.A OG1 ARG 95.A O no hydrogen 2.686 N/A THR 183.A N ASN 181.A OD1 no hydrogen 3.094 N/A THR 183.A OG1 ASN 181.A OD1 no hydrogen 3.007 N/A THR 183.A OG1 THR 202.A OG1 no hydrogen 2.647 N/A LEU 187.A N GLY 184.A O no hydrogen 3.175 N/A ILE 188.A N ASP 212.A OD2 no hydrogen 3.031 N/A ARG 189.A NE ASP 200.A OD1 no hydrogen 3.073 N/A ARG 189.A NH1 LYS 179.A O no hydrogen 3.366 N/A ARG 189.A NH1 VAL 198.A O no hydrogen 2.839 N/A ARG 189.A NH2 LYS 179.A O no hydrogen 3.051 N/A ARG 189.A NH2 ASP 200.A OD1 no hydrogen 2.844 N/A ALA 190.A N LEU 187.A O no hydrogen 2.952 N/A GLY 191.A N ILE 188.A O no hydrogen 2.749 N/A VAL 192.A N ARG 189.A O no hydrogen 3.334 N/A TRP 196.A N PRO 193.A O no hydrogen 3.232 N/A ALA 199.A N ILE 215.A O no hydrogen 2.865 N/A ASP 200.A N MET 178.A O no hydrogen 3.201 N/A LYS 201.A N ILE 213.A O no hydrogen 2.801 N/A LYS 201.A NZ SER 97.A OG no hydrogen 2.764 N/A LYS 201.A NZ THR 202.A O no hydrogen 2.736 N/A THR 202.A OG1 THR 183.A OG1 no hydrogen 2.647 N/A GLY 203.A N ASN 211.A O no hydrogen 2.907 N/A ALA 205.A N THR 209.A O no hydrogen 2.966 N/A SER 206.A N ASN 137.A O no hydrogen 3.147 N/A SER 206.A OG ASN 137.A O no hydrogen 2.807 N/A TYR 207.A N LYS 235.A O no hydrogen 2.817 N/A THR 209.A N ALA 205.A O no hydrogen 3.003 N/A THR 209.A N SER 206.A O no hydrogen 3.342 N/A THR 209.A OG1 SER 206.A O no hydrogen 2.756 N/A ARG 210.A N SER 230.A O no hydrogen 3.070 N/A ARG 210.A NE ASP 241.A OD1 no hydrogen 2.752 N/A ARG 210.A NH1 GLY 203.A O no hydrogen 3.155 N/A ARG 210.A NH2 ASP 241.A OD1 no hydrogen 3.067 N/A ASN 211.A N GLY 203.A O no hydrogen 2.883 N/A ASN 211.A ND2 ALA 36.A O no hydrogen 2.913 N/A ASN 211.A ND2 PHE 37.A O no hydrogen 3.250 N/A ASP 212.A N VAL 228.A O no hydrogen 3.041 N/A ILE 213.A N LYS 201.A O no hydrogen 2.967 N/A ALA 214.A N LEU 226.A O no hydrogen 2.801 N/A ILE 215.A N ALA 199.A O no hydrogen 2.766 N/A ILE 216.A N VAL 224.A O no hydrogen 2.794 N/A TRP 217.A N GLU 197.A O no hydrogen 3.004 N/A LYS 220.A NZ LYS 220.A O no hydrogen 2.668 N/A VAL 224.A N ILE 216.A O no hydrogen 2.908 N/A VAL 225.A N LEU 19.A O no hydrogen 2.972 N/A LEU 226.A N ALA 214.A O no hydrogen 2.938 N/A ALA 227.A N PHE 17.A O no hydrogen 2.894 N/A VAL 228.A N ASP 212.A O no hydrogen 2.964 N/A LEU 229.A N GLY 15.A O no hydrogen 2.760 N/A SER 230.A N ASN 211.A OD1 no hydrogen 3.214 N/A SER 230.A OG ARG 210.A O no hydrogen 2.687 N/A SER 231.A N LYS 13.A O no hydrogen 3.124 N/A ARG 232.A N TYR 207.A O no hydrogen 2.767 N/A ARG 232.A NE ASP 11.A O no hydrogen 3.047 N/A ARG 232.A NH1 LYS 238.A O no hydrogen 2.725 N/A ARG 232.A NH2 ASP 11.A O no hydrogen 3.557 N/A ARG 232.A NH2 ASP 11.A OD2 no hydrogen 3.081 N/A ALA 237.A N LYS 234.A O no hydrogen 3.104 N/A LYS 242.A N ASP 240.A OD1 no hydrogen 2.967 N/A LEU 243.A N ASP 240.A O no hydrogen 2.886 N/A ILE 244.A N ASP 241.A O no hydrogen 2.886 N/A ALA 245.A N ASP 241.A O no hydrogen 3.212 N/A GLU 246.A N LYS 242.A O no hydrogen 2.925 N/A ALA 247.A N LEU 243.A O no hydrogen 2.856 N/A THR 248.A N ILE 244.A O no hydrogen 2.988 N/A THR 248.A OG1 ILE 244.A O no hydrogen 2.607 N/A LYS 249.A N ALA 245.A O no hydrogen 3.105 N/A LYS 249.A NZ GLU 246.A OE2 no hydrogen 3.060 N/A VAL 250.A N GLU 246.A O no hydrogen 3.260 N/A VAL 251.A N ALA 247.A O no hydrogen 3.153 N/A MET 252.A N THR 248.A O no hydrogen 3.036 N/A LYS 253.A N LYS 249.A O no hydrogen 3.047 N/A ALA 254.A N VAL 250.A O no hydrogen 2.853 N/A LEU 255.A N VAL 251.A O no hydrogen 3.069 N/A ASN 256.A N LYS 253.A O no hydrogen 3.196 N/A