Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1cw2_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ARG 2.A NE ASP 123.A OD1 no hydrogen 2.742 N/A ARG 2.A NE ASP 123.A OD2 no hydrogen 3.248 N/A ARG 2.A NH1 ASP 123.A OD1 no hydrogen 2.983 N/A ARG 2.A NH2 PRO 92.A O no hydrogen 3.135 N/A TYR 3.A OH SER 124.A OG no hydrogen 2.799 N/A ASN 5.A N GLU 1.A O no hydrogen 2.890 N/A LEU 6.A N ARG 2.A O no hydrogen 2.945 N/A PHE 7.A N TYR 3.A O no hydrogen 2.850 N/A ALA 8.A N GLU 4.A O no hydrogen 3.097 N/A GLN 9.A N ASN 5.A O no hydrogen 3.001 N/A LEU 10.A N LEU 6.A O no hydrogen 2.936 N/A ASN 11.A N PHE 7.A O no hydrogen 2.842 N/A ASP 12.A N ALA 8.A O no hydrogen 2.921 N/A ARG 13.A N GLN 9.A O no hydrogen 3.262 N/A ARG 13.A N LEU 10.A O no hydrogen 3.087 N/A ARG 13.A NE GLU 15.A OE1 no hydrogen 3.145 N/A ARG 13.A NH1 GLU 15.A OE2 no hydrogen 2.770 N/A ARG 14.A N ASN 11.A O no hydrogen 2.812 N/A ARG 14.A NH1 ASP 12.A O no hydrogen 3.041 N/A GLU 15.A N LEU 10.A O no hydrogen 2.757 N/A GLY 16.A N SER 263.A O no hydrogen 2.780 N/A ALA 17.A N ALA 226.A O no hydrogen 2.854 N/A PHE 18.A N ASP 45.A OD1 no hydrogen 2.793 N/A VAL 19.A N ALA 228.A O no hydrogen 2.974 N/A PHE 21.A N SER 230.A O no hydrogen 2.929 N/A VAL 22.A N GLU 48.A O no hydrogen 3.336 N/A LEU 24.A N GLY 50.A O no hydrogen 2.827 N/A GLY 25.A N SER 32.A OG no hydrogen 3.169 N/A ASP 26.A N THR 23.A O no hydrogen 3.262 N/A SER 32.A N GLY 28.A O no hydrogen 2.843 N/A LEU 33.A N ILE 29.A O no hydrogen 2.889 N/A LYS 34.A N GLU 30.A O no hydrogen 3.123 N/A ILE 35.A N GLN 31.A O no hydrogen 2.804 N/A ILE 36.A N SER 32.A O no hydrogen 2.943 N/A ASP 37.A N LEU 33.A O no hydrogen 3.164 N/A THR 38.A N LYS 34.A O no hydrogen 3.153 N/A THR 38.A OG1 LYS 34.A O no hydrogen 3.048 N/A LEU 39.A N ILE 35.A O no hydrogen 2.913 N/A ILE 40.A N ILE 36.A O no hydrogen 3.131 N/A ASP 41.A N ASP 37.A O no hydrogen 2.914 N/A ALA 42.A N THR 38.A O no hydrogen 2.901 N/A GLY 43.A N ILE 40.A O no hydrogen 3.005 N/A ALA 44.A N LEU 39.A O no hydrogen 3.139 N/A ASP 45.A N PHE 18.A O no hydrogen 3.006 N/A LEU 47.A N PRO 95.A O no hydrogen 2.922 N/A GLU 48.A N PRO 20.A O no hydrogen 3.230 N/A LEU 49.A N GLY 97.A O no hydrogen 2.744 N/A GLY 50.A N VAL 22.A O no hydrogen 3.023 N/A SER 54.A OG ASP 55.A OD1 no hydrogen 2.824 N/A LEU 57.A N ASP 55.A O no hydrogen 2.902 N/A ALA 58.A N TYR 101.A OH no hydrogen 2.961 N/A ASP 59.A N PRO 56.A O no hydrogen 3.162 N/A GLY 60.A N THR 182.A OG1 no hydrogen 3.010 N/A GLN 64.A N GLY 60.A O no hydrogen 3.009 N/A ASN 65.A N PRO 61.A O no hydrogen 2.913 N/A ALA 66.A N THR 62.A O no hydrogen 3.205 N/A ASN 67.A N ILE 63.A O no hydrogen 3.200 N/A LEU 68.A N GLN 64.A O no hydrogen 3.226 N/A ARG 69.A N ASN 65.A O no hydrogen 2.838 N/A ARG 69.A NE ASP 26.A OD1 no hydrogen 2.792 N/A ARG 69.A NH1 ASP 26.A OD1 no hydrogen 3.363 N/A ARG 69.A NH1 ASP 26.A OD2 no hydrogen 2.721 N/A ALA 70.A N ALA 66.A O no hydrogen 2.988 N/A PHE 71.A N ASN 67.A O no hydrogen 2.934 N/A ALA 72.A N LEU 68.A O no hydrogen 2.869 N/A ALA 73.A N ARG 69.A O no hydrogen 3.122 N/A ALA 73.A N ALA 70.A O no hydrogen 3.088 N/A GLY 74.A N PHE 71.A O no hydrogen 2.845 N/A VAL 75.A N ALA 70.A O no hydrogen 3.169 N/A GLN 79.A N THR 76.A OG1 no hydrogen 3.422 N/A GLN 79.A NE2 GLY 74.A O no hydrogen 3.295 N/A CYS 80.A N THR 76.A O no hydrogen 2.962 N/A CYS 80.A SG THR 76.A O no hydrogen 3.639 N/A PHE 81.A N PRO 77.A O no hydrogen 3.191 N/A GLU 82.A N GLN 79.A O no hydrogen 3.257 N/A MET 83.A N GLN 79.A O no hydrogen 2.978 N/A LEU 84.A N CYS 80.A O no hydrogen 2.813 N/A ALA 85.A N PHE 81.A O no hydrogen 3.060 N/A LEU 86.A N GLU 82.A O no hydrogen 3.261 N/A ILE 87.A N MET 83.A O no hydrogen 2.983 N/A ARG 88.A N LEU 84.A O no hydrogen 3.152 N/A ARG 88.A NE GLY 121.A O no hydrogen 2.679 N/A ARG 88.A NH1 ILE 94.A O no hydrogen 2.575 N/A ARG 88.A NH1 GLY 121.A O no hydrogen 3.521 N/A ARG 88.A NH1 ASP 123.A OD2 no hydrogen 2.850 N/A ARG 88.A NH2 ILE 94.A O no hydrogen 3.557 N/A GLU 89.A N ALA 85.A O no hydrogen 2.969 N/A LYS 90.A N LEU 86.A O no hydrogen 3.102 N/A LYS 90.A N ILE 87.A O no hydrogen 3.341 N/A LYS 90.A NZ ASP 37.A OD1 no hydrogen 2.649 N/A LYS 90.A NZ ASP 37.A OD2 no hydrogen 2.924 N/A HIS 91.A N ILE 87.A O no hydrogen 2.990 N/A HIS 91.A NE2 ASP 37.A OD2 no hydrogen 2.830 N/A ILE 96.A N ASP 123.A OD2 no hydrogen 2.856 N/A GLY 97.A N LEU 47.A O no hydrogen 2.827 N/A LEU 98.A N SER 124.A O no hydrogen 2.982 N/A LEU 99.A N LEU 49.A O no hydrogen 2.843 N/A MET 100.A N LEU 126.A O no hydrogen 2.821 N/A TYR 101.A OH ASP 59.A OD2 no hydrogen 2.858 N/A ALA 102.A N ASP 129.A OD1 no hydrogen 2.739 N/A LEU 104.A N TYR 101.A O no hydrogen 3.286 N/A VAL 105.A N ALA 102.A O no hydrogen 3.172 N/A PHE 106.A N ALA 102.A O no hydrogen 3.017 N/A ASN 107.A N ASN 103.A O no hydrogen 2.796 N/A GLY 109.A N PHE 106.A O no hydrogen 2.806 N/A PHE 113.A N GLY 109.A O no hydrogen 3.208 N/A PHE 113.A N ILE 110.A O no hydrogen 3.140 N/A TYR 114.A N ILE 110.A O no hydrogen 3.329 N/A ALA 115.A N ASP 111.A O no hydrogen 3.047 N/A ARG 116.A N ALA 112.A O no hydrogen 3.171 N/A ARG 116.A NH2 GLN 119.A OE1 no hydrogen 3.231 N/A CYS 117.A N PHE 113.A O no hydrogen 3.010 N/A CYS 117.A SG PHE 113.A O no hydrogen 3.476 N/A GLU 118.A N TYR 114.A O no hydrogen 3.027 N/A GLN 119.A N ALA 115.A O no hydrogen 3.005 N/A VAL 120.A N ARG 116.A O no hydrogen 3.065 N/A GLY 121.A N CYS 117.A O no hydrogen 2.949 N/A GLY 121.A N GLU 118.A O no hydrogen 2.931 N/A VAL 122.A N CYS 117.A O no hydrogen 2.945 N/A ASP 123.A N ILE 96.A O no hydrogen 2.831 N/A SER 124.A N ILE 96.A O no hydrogen 3.105 N/A SER 124.A OG TYR 3.A OH no hydrogen 2.799 N/A VAL 125.A N ALA 148.A O no hydrogen 2.954 N/A LEU 126.A N LEU 98.A O no hydrogen 3.042 N/A ALA 128.A N MET 100.A O no hydrogen 2.833 N/A VAL 130.A N VAL 127.A O no hydrogen 3.285 N/A GLU 133.A N GLU 133.A OE2 no hydrogen 2.861 N/A GLU 134.A N PRO 131.A O no hydrogen 2.921 N/A SER 135.A N VAL 132.A O no hydrogen 3.303 N/A SER 135.A OG VAL 132.A O no hydrogen 2.573 N/A ARG 139.A N SER 135.A O no hydrogen 2.904 N/A ARG 139.A NH2 SER 135.A OG no hydrogen 2.959 N/A GLN 140.A N ALA 136.A O no hydrogen 3.014 N/A ALA 141.A N PRO 137.A O no hydrogen 3.159 N/A ALA 142.A N PHE 138.A O no hydrogen 2.949 N/A LEU 143.A N ARG 139.A O no hydrogen 2.994 N/A ARG 144.A N GLN 140.A O no hydrogen 3.022 N/A HIS 145.A N ALA 141.A O no hydrogen 3.280 N/A HIS 145.A N ALA 142.A O no hydrogen 2.980 N/A HIS 145.A ND1 ALA 141.A O no hydrogen 2.806 N/A ASN 146.A N LEU 143.A O no hydrogen 3.241 N/A ASN 146.A ND2 GLU 118.A OE1 no hydrogen 2.914 N/A ILE 147.A N ALA 142.A O no hydrogen 2.854 N/A ALA 148.A N ASP 123.A O no hydrogen 2.913 N/A ILE 150.A N VAL 125.A O no hydrogen 2.979 N/A CYS 153.A N TYR 174.A O no hydrogen 2.893 N/A CYS 153.A SG PRO 154.A O no hydrogen 3.943 N/A ALA 157.A N PRO 154.A O no hydrogen 3.238 N/A LEU 161.A N ASP 158.A OD1 no hydrogen 3.250 N/A LEU 162.A N ASP 158.A O no hydrogen 3.029 N/A ARG 163.A N ASP 159.A O no hydrogen 2.898 N/A ARG 163.A NE ASP 159.A OD1 no hydrogen 2.923 N/A ARG 163.A NH1 ASP 159.A OD1 no hydrogen 3.494 N/A GLN 164.A N ASP 160.A O no hydrogen 2.987 N/A GLN 164.A NE2 ASP 160.A O no hydrogen 3.135 N/A VAL 165.A N LEU 161.A O no hydrogen 2.774 N/A ALA 166.A N LEU 162.A O no hydrogen 2.930 N/A SER 167.A N ARG 163.A O no hydrogen 3.152 N/A TYR 168.A N GLN 164.A O no hydrogen 2.929 N/A GLY 169.A N VAL 165.A O no hydrogen 3.036 N/A TYR 172.A N ARG 170.A O no hydrogen 2.861 N/A TYR 172.A OH GLU 48.A OE1 no hydrogen 2.794 N/A THR 173.A N PRO 204.A O no hydrogen 2.833 N/A THR 173.A OG1 ALA 203.A O no hydrogen 2.733 N/A TYR 174.A N PHE 151.A O no hydrogen 3.105 N/A LEU 175.A N LEU 206.A O no hydrogen 2.827 N/A LEU 176.A N CYS 153.A O no hydrogen 3.110 N/A SER 177.A N GLY 208.A O no hydrogen 3.273 N/A SER 177.A OG GLY 208.A O no hydrogen 3.206 N/A SER 177.A OG PHE 209.A O no hydrogen 2.632 N/A ARG 178.A NE ASN 186.A O no hydrogen 3.209 N/A ARG 178.A NH1 SER 179.A O no hydrogen 2.731 N/A ARG 178.A NH1 VAL 181.A O no hydrogen 2.954 N/A ARG 178.A NH2 VAL 181.A O no hydrogen 2.891 N/A ARG 178.A NH2 GLY 183.A O no hydrogen 3.334 N/A THR 182.A N ALA 58.A O no hydrogen 3.186 N/A THR 182.A OG1 ASP 59.A OD1 no hydrogen 2.786 N/A ARG 187.A NH1 SER 212.A OG no hydrogen 3.304 N/A ILE 194.A N LEU 190.A O no hydrogen 2.973 N/A GLU 195.A N HIS 191.A O no hydrogen 3.051 N/A LYS 196.A N HIS 192.A O no hydrogen 2.978 N/A LYS 196.A NZ GLU 199.A OE1 no hydrogen 2.607 N/A LYS 196.A NZ GLU 199.A OE2 no hydrogen 3.279 N/A LYS 196.A NZ TYR 200.A OH no hydrogen 2.792 N/A LEU 197.A N LEU 193.A O no hydrogen 2.834 N/A LYS 198.A N ILE 194.A O no hydrogen 3.329 N/A LYS 198.A NZ GLY 224.A O no hydrogen 2.818 N/A GLU 199.A N GLU 195.A O no hydrogen 2.958 N/A TYR 200.A N LYS 196.A O no hydrogen 3.016 N/A TYR 200.A OH ASP 159.A OD2 no hydrogen 2.937 N/A HIS 201.A N LYS 198.A O no hydrogen 3.105 N/A ALA 202.A N LEU 197.A O no hydrogen 2.927 N/A LEU 206.A N THR 173.A O no hydrogen 2.892 N/A GLN 207.A N GLY 227.A O no hydrogen 3.013 N/A GLY 208.A N LEU 175.A O no hydrogen 2.902 N/A SER 212.A N GLN 216.A OE1 no hydrogen 2.916 N/A SER 213.A N GLN 216.A OE1 no hydrogen 3.158 N/A SER 213.A OG GLN 216.A OE1 no hydrogen 3.087 N/A GLN 216.A N SER 213.A O no hydrogen 3.026 N/A GLN 216.A NE2 GLY 210.A O no hydrogen 2.869 N/A SER 218.A N PRO 214.A O no hydrogen 3.182 N/A SER 218.A OG GLU 215.A O no hydrogen 3.028 N/A ALA 219.A N GLU 215.A O no hydrogen 3.047 N/A ALA 220.A N GLN 216.A O no hydrogen 3.101 N/A VAL 221.A N VAL 217.A O no hydrogen 3.083 N/A ARG 222.A N SER 218.A O no hydrogen 2.889 N/A ARG 222.A NH1 SER 218.A OG no hydrogen 3.426 N/A ARG 222.A NH2 GLU 215.A OE1 no hydrogen 3.043 N/A ALA 223.A N ALA 219.A O no hydrogen 2.938 N/A GLY 224.A N VAL 221.A O no hydrogen 3.160 N/A ALA 225.A N ALA 220.A O no hydrogen 3.152 N/A ALA 226.A N ALA 205.A O no hydrogen 2.771 N/A ALA 228.A N ALA 17.A O no hydrogen 2.957 N/A ILE 229.A N GLN 207.A O no hydrogen 2.736 N/A SER 230.A N VAL 19.A O no hydrogen 3.020 N/A SER 230.A OG ILE 211.A O no hydrogen 2.843 N/A ILE 234.A N GLY 231.A O no hydrogen 2.855 N/A VAL 235.A N GLY 231.A O no hydrogen 2.896 N/A LYS 236.A N SER 232.A O no hydrogen 2.841 N/A ILE 237.A N ILE 234.A O no hydrogen 3.085 N/A GLU 239.A N VAL 235.A O no hydrogen 2.960 N/A LYS 240.A N LYS 236.A O no hydrogen 2.915 N/A LYS 240.A NZ GLU 251.A OE1 no hydrogen 2.454 N/A LYS 240.A NZ GLU 251.A OE2 no hydrogen 3.025 N/A ASN 241.A N ILE 237.A O no hydrogen 3.154 N/A ASN 241.A N ILE 238.A O no hydrogen 3.156 N/A ASN 241.A ND2 GLN 247.A OE1 no hydrogen 2.965 N/A SER 244.A N ASN 241.A O no hydrogen 2.972 N/A MET 248.A N SER 244.A O no hydrogen 2.958 N/A LEU 249.A N PRO 245.A O no hydrogen 3.185 N/A ALA 250.A N LYS 246.A O no hydrogen 3.243 N/A GLU 251.A N GLN 247.A O no hydrogen 2.897 N/A LEU 252.A N MET 248.A O no hydrogen 2.838 N/A ARG 253.A N LEU 249.A O no hydrogen 2.943 N/A ARG 253.A NH1 ASP 41.A OD1 no hydrogen 2.848 N/A ARG 253.A NH2 ASP 41.A OD1 no hydrogen 2.778 N/A SER 254.A N ALA 250.A O no hydrogen 3.335 N/A SER 254.A OG ALA 250.A O no hydrogen 3.336 N/A PHE 255.A N GLU 251.A O no hydrogen 3.236 N/A VAL 256.A N LEU 252.A O no hydrogen 3.048 N/A SER 257.A N ARG 253.A O no hydrogen 3.017 N/A SER 257.A OG ALA 42.A O no hydrogen 3.553 N/A SER 257.A OG ARG 253.A O no hydrogen 2.814 N/A ALA 258.A N SER 254.A O no hydrogen 3.030 N/A MET 259.A N PHE 255.A O no hydrogen 2.875 N/A LYS 260.A N VAL 256.A O no hydrogen 2.793 N/A LYS 260.A NZ GLU 15.A OE2 no hydrogen 2.988 N/A LYS 260.A NZ ASP 45.A OD1 no hydrogen 2.785 N/A LYS 260.A NZ SER 263.A OG no hydrogen 2.769 N/A ALA 261.A N SER 257.A O no hydrogen 2.955 N/A ALA 262.A N ALA 258.A O no hydrogen 3.315 N/A SER 263.A N LYS 260.A O no hydrogen 3.033 N/A SER 263.A OG GLY 16.A O no hydrogen 2.935 N/A SER 263.A OG LYS 260.A O no hydrogen 2.732 N/A ARG 264.A N ALA 261.A O no hydrogen 3.125 N/A