Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 2w1c_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ALA 3.A N ASP 6.A OD2 no hydrogen 2.922 N/A ASP 6.A N ALA 3.A O no hydrogen 2.869 N/A PHE 7.A N LEU 4.A O no hydrogen 3.263 N/A GLU 8.A N ARG 25.A O no hydrogen 2.853 N/A GLY 10.A N LEU 23.A O no hydrogen 2.627 N/A LEU 13.A N VAL 21.A O no hydrogen 2.662 N/A GLY 14.A N VAL 21.A O no hydrogen 3.380 N/A GLY 19.A N GLY 16.A O no hydrogen 3.352 N/A VAL 21.A N GLY 14.A O no hydrogen 3.402 N/A TYR 22.A N LEU 35.A O no hydrogen 2.736 N/A LEU 23.A N ARG 11.A O no hydrogen 2.948 N/A ALA 24.A N LEU 33.A O no hydrogen 2.910 N/A ARG 25.A N GLU 8.A O no hydrogen 2.929 N/A ARG 25.A NH2 GLU 8.A OE1 no hydrogen 2.843 N/A GLU 26.A N PHE 31.A O no hydrogen 2.623 N/A LYS 27.A N ASP 6.A O no hydrogen 2.777 N/A LYS 27.A NZ GLU 5.A O no hydrogen 3.256 N/A LYS 27.A NZ PHE 7.A O no hydrogen 2.550 N/A GLN 28.A N GLU 26.A OE1 no hydrogen 2.993 N/A SER 29.A N GLU 26.A O no hydrogen 3.282 N/A LYS 30.A N GLU 26.A O no hydrogen 2.685 N/A LEU 33.A N ALA 24.A O no hydrogen 2.866 N/A ALA 34.A N LEU 84.A O no hydrogen 2.646 N/A LEU 35.A N TYR 22.A O no hydrogen 2.626 N/A LYS 36.A N LEU 82.A O no hydrogen 2.816 N/A VAL 37.A N ASN 20.A O no hydrogen 2.777 N/A LEU 38.A N VAL 80.A O no hydrogen 2.751 N/A PHE 39.A N PHE 18.A O no hydrogen 3.173 N/A LYS 40.A NZ HIS 75.A ND1 no hydrogen 3.098 N/A LYS 40.A NZ ASP 76.A O no hydrogen 3.323 N/A GLN 42.A N PHE 39.A O no hydrogen 3.095 N/A GLN 42.A NE2 LYS 17.A O no hydrogen 3.456 N/A LEU 43.A N PHE 39.A O no hydrogen 3.312 N/A LEU 43.A N LYS 40.A O no hydrogen 2.722 N/A GLU 44.A N LYS 40.A O no hydrogen 3.210 N/A LYS 45.A N ALA 41.A O no hydrogen 3.313 N/A ALA 46.A N GLN 42.A O no hydrogen 3.085 N/A GLY 47.A N GLU 44.A O no hydrogen 2.732 N/A VAL 48.A N LEU 43.A O no hydrogen 2.810 N/A GLU 49.A N GLU 49.A OE2 no hydrogen 3.161 N/A GLN 51.A N VAL 48.A O no hydrogen 2.514 N/A LEU 52.A N VAL 48.A O no hydrogen 3.197 N/A ARG 54.A N GLN 51.A O no hydrogen 2.963 N/A GLU 55.A N GLN 51.A O no hydrogen 2.706 N/A VAL 56.A N LEU 52.A O no hydrogen 2.819 N/A GLU 57.A N ARG 53.A O no hydrogen 3.286 N/A ILE 58.A N ARG 54.A O no hydrogen 2.928 N/A GLN 59.A N GLU 55.A O no hydrogen 3.039 N/A GLN 59.A NE2 LEU 68.A O no hydrogen 2.871 N/A SER 60.A N VAL 56.A O no hydrogen 3.059 N/A SER 60.A N GLU 57.A O no hydrogen 3.313 N/A HIS 61.A N GLU 57.A O no hydrogen 3.361 N/A ARG 63.A N TYR 120.A OH no hydrogen 3.197 N/A ARG 63.A NH1 LEU 62.A O no hydrogen 3.496 N/A ASN 66.A N HIS 64.A ND1 no hydrogen 2.882 N/A ASN 66.A ND2 LEU 144.A O no hydrogen 2.772 N/A ILE 67.A N HIS 64.A O no hydrogen 2.836 N/A LEU 68.A N ILE 146.A O no hydrogen 3.032 N/A ARG 69.A N GLU 85.A OE2 no hydrogen 2.939 N/A TYR 71.A N ILE 83.A O no hydrogen 2.940 N/A PHE 74.A N TYR 81.A O no hydrogen 2.956 N/A HIS 75.A ND1 ASP 76.A O no hydrogen 3.198 N/A ASP 76.A N ARG 79.A O no hydrogen 3.103 N/A ARG 79.A N ASP 76.A OD1 no hydrogen 3.260 N/A VAL 80.A N LEU 38.A O no hydrogen 2.375 N/A TYR 81.A N PHE 74.A O no hydrogen 2.587 N/A LEU 82.A N LYS 36.A O no hydrogen 2.888 N/A ILE 83.A N GLY 72.A O no hydrogen 3.212 N/A LEU 84.A N ALA 34.A O no hydrogen 2.596 N/A GLU 85.A N ARG 69.A O no hydrogen 3.134 N/A LEU 89.A N LEU 138.A O no hydrogen 3.071 N/A GLY 90.A N ALA 87.A O no hydrogen 3.277 N/A VAL 92.A N LEU 136.A O no hydrogen 2.869 N/A TYR 93.A N PRO 133.A O no hydrogen 3.383 N/A TYR 93.A OH GLN 97.A OE1 no hydrogen 3.276 N/A ARG 94.A N THR 91.A OG1 no hydrogen 2.913 N/A GLU 95.A N THR 91.A O no hydrogen 3.067 N/A LEU 96.A N TYR 93.A O no hydrogen 2.784 N/A GLN 97.A N TYR 93.A O no hydrogen 2.974 N/A LYS 98.A N ARG 94.A O no hydrogen 2.934 N/A LYS 98.A NZ GLU 95.A OE1 no hydrogen 3.188 N/A LYS 98.A NZ GLU 95.A OE2 no hydrogen 3.415 N/A LEU 99.A N GLU 95.A O no hydrogen 2.921 N/A SER 100.A OG LEU 99.A O no hydrogen 2.470 N/A LYS 101.A N LEU 99.A O no hydrogen 2.687 N/A LYS 101.A NZ SER 100.A OG no hydrogen 3.401 N/A PHE 102.A N PHE 194.A O no hydrogen 2.842 N/A ARG 106.A N ASP 103.A OD1 no hydrogen 2.771 N/A ARG 106.A NE TYR 110.A OH no hydrogen 3.035 N/A ARG 106.A NH2 TYR 110.A OH no hydrogen 3.200 N/A THR 107.A N ASP 103.A O no hydrogen 2.900 N/A THR 107.A OG1 ASP 103.A O no hydrogen 2.895 N/A ALA 108.A N GLU 104.A O no hydrogen 2.967 N/A THR 109.A OG1 GLN 105.A O no hydrogen 2.236 N/A TYR 110.A N ARG 106.A O no hydrogen 3.255 N/A ILE 111.A N THR 107.A O no hydrogen 2.960 N/A THR 112.A N ALA 108.A O no hydrogen 2.896 N/A THR 112.A OG1 ALA 108.A O no hydrogen 2.765 N/A THR 112.A OG1 SER 259.A OG no hydrogen 2.561 N/A GLU 113.A N THR 109.A O no hydrogen 2.803 N/A LEU 114.A N TYR 110.A O no hydrogen 2.623 N/A ALA 115.A N ILE 111.A O no hydrogen 2.494 N/A ASN 116.A N THR 112.A O no hydrogen 2.915 N/A ALA 117.A N GLU 113.A O no hydrogen 3.031 N/A LEU 118.A N LEU 114.A O no hydrogen 2.809 N/A SER 119.A N ALA 115.A O no hydrogen 2.604 N/A TYR 120.A N ASN 116.A O no hydrogen 3.006 N/A CYS 121.A N LEU 118.A O no hydrogen 2.860 N/A CYS 121.A SG ALA 117.A O no hydrogen 2.894 N/A HIS 122.A N LEU 118.A O no hydrogen 2.915 N/A HIS 122.A NE2 ASP 183.A OD2 no hydrogen 2.870 N/A SER 123.A N SER 119.A O no hydrogen 3.195 N/A SER 123.A OG TYR 120.A O no hydrogen 2.423 N/A LYS 124.A N CYS 121.A O no hydrogen 3.020 N/A ARG 125.A N HIS 122.A O no hydrogen 2.452 N/A VAL 126.A N CYS 121.A O no hydrogen 3.034 N/A ILE 127.A N VAL 153.A O no hydrogen 2.629 N/A HIS 128.A N ASP 183.A OD2 no hydrogen 3.241 N/A HIS 128.A NE2 ALA 147.A O no hydrogen 3.132 N/A HIS 128.A NE2 ASP 148.A O no hydrogen 2.534 N/A ARG 129.A N ASP 183.A OD1 no hydrogen 2.976 N/A ARG 129.A NE TRP 151.A O no hydrogen 3.180 N/A ARG 129.A NH1 HIS 178.A NE2 no hydrogen 3.433 N/A ARG 129.A NH2 TRP 151.A O no hydrogen 2.764 N/A ASP 130.A N HIS 128.A ND1 no hydrogen 3.241 N/A LYS 132.A NZ ASP 130.A OD1 no hydrogen 3.186 N/A ASN 135.A N LYS 132.A O no hydrogen 2.650 N/A ASN 135.A ND2 ASP 130.A O no hydrogen 2.744 N/A ASN 135.A ND2 ASP 130.A OD2 no hydrogen 3.476 N/A LEU 136.A N PRO 133.A O no hydrogen 3.004 N/A LEU 137.A N LYS 145.A O no hydrogen 2.963 N/A LEU 138.A N GLY 90.A O no hydrogen 2.868 N/A GLY 139.A N GLU 143.A O no hydrogen 2.625 N/A GLY 142.A N GLY 139.A O no hydrogen 2.688 N/A GLU 143.A N GLU 143.A OE1 no hydrogen 2.414 N/A LEU 144.A N GLU 113.A OE1 no hydrogen 2.913 N/A LYS 145.A N LEU 137.A O no hydrogen 2.596 N/A LYS 145.A NZ PRO 65.A O no hydrogen 3.163 N/A LYS 145.A NZ GLU 85.A OE1 no hydrogen 2.554 N/A ILE 146.A N ASN 66.A O no hydrogen 3.011 N/A ALA 147.A N ASN 135.A O no hydrogen 2.917 N/A GLY 150.A N ASP 148.A OD2 no hydrogen 3.232 N/A SER 152.A OG ILE 127.A O no hydrogen 3.193 N/A VAL 153.A N ILE 127.A O no hydrogen 2.817 N/A SER 157.A N HIS 178.A O no hydrogen 3.280 N/A SER 157.A OG HIS 154.A O no hydrogen 2.522 N/A TYR 167.A OH GLU 193.A OE1 no hydrogen 2.327 N/A TYR 167.A OH GLU 193.A OE2 no hydrogen 3.098 N/A LEU 168.A N LEU 165.A O no hydrogen 2.705 N/A GLU 171.A N GLU 171.A OE1 no hydrogen 2.630 N/A ILE 173.A N PRO 169.A O no hydrogen 2.970 N/A GLU 174.A N PRO 170.A O no hydrogen 2.704 N/A GLY 175.A N MET 172.A O no hydrogen 3.078 N/A ARG 176.A NH1 GLU 174.A OE1 no hydrogen 2.568 N/A LYS 181.A N ASP 179.A OD1 no hydrogen 3.075 N/A LYS 181.A NZ ARG 243.A O no hydrogen 2.213 N/A LYS 181.A NZ PRO 244.A O no hydrogen 2.879 N/A LEU 184.A N LYS 181.A O no hydrogen 3.093 N/A TRP 185.A N LYS 181.A O no hydrogen 3.352 N/A SER 186.A N VAL 182.A O no hydrogen 2.967 N/A SER 186.A OG VAL 182.A O no hydrogen 3.345 N/A LEU 187.A N ASP 183.A O no hydrogen 2.947 N/A GLY 188.A N LEU 184.A O no hydrogen 3.142 N/A VAL 189.A N TRP 185.A O no hydrogen 3.028 N/A LEU 190.A N SER 186.A O no hydrogen 2.733 N/A CYS 191.A N LEU 187.A O no hydrogen 2.851 N/A TYR 192.A N GLY 188.A O no hydrogen 2.940 N/A TYR 192.A OH THR 219.A O no hydrogen 2.689 N/A GLU 193.A N VAL 189.A O no hydrogen 2.854 N/A PHE 194.A N LEU 190.A O no hydrogen 3.019 N/A LEU 195.A N CYS 191.A O no hydrogen 3.389 N/A LEU 195.A N TYR 192.A O no hydrogen 3.261 N/A VAL 196.A N TYR 192.A O no hydrogen 2.922 N/A GLY 197.A N GLU 193.A O no hydrogen 2.625 N/A GLU 202.A N PRO 199.A O no hydrogen 3.139 N/A TYR 206.A OH LEU 161.A O no hydrogen 2.732 N/A GLU 208.A N THR 205.A OG1 no hydrogen 3.244 N/A THR 209.A N THR 205.A O no hydrogen 3.076 N/A THR 209.A OG1 THR 205.A O no hydrogen 2.513 N/A TYR 210.A N TYR 206.A O no hydrogen 3.181 N/A LYS 211.A N GLN 207.A O no hydrogen 3.299 N/A ARG 212.A N GLU 208.A O no hydrogen 2.719 N/A ARG 212.A NH2 GLU 217.A O no hydrogen 3.158 N/A ILE 213.A N THR 209.A O no hydrogen 2.622 N/A SER 214.A N TYR 210.A O no hydrogen 2.851 N/A SER 214.A OG GLU 174.A OE2 no hydrogen 2.892 N/A ARG 215.A N LYS 211.A O no hydrogen 2.835 N/A ARG 215.A N ARG 212.A O no hydrogen 3.347 N/A VAL 216.A N ILE 213.A O no hydrogen 3.064 N/A GLU 217.A N ARG 212.A O no hydrogen 2.905 N/A VAL 224.A N PRO 221.A O no hydrogen 3.121 N/A THR 225.A OG1 GLU 104.A OE2 no hydrogen 2.438 N/A ARG 229.A N THR 225.A O no hydrogen 2.895 N/A ARG 229.A NE VAL 224.A O no hydrogen 2.937 N/A ARG 229.A NH2 ASP 222.A O no hydrogen 3.325 N/A ARG 229.A NH2 VAL 224.A O no hydrogen 3.527 N/A ASP 230.A N GLU 226.A O no hydrogen 2.747 N/A LEU 231.A N GLY 227.A O no hydrogen 3.032 N/A ILE 232.A N ALA 228.A O no hydrogen 2.899 N/A SER 233.A N ARG 229.A O no hydrogen 2.744 N/A SER 233.A OG ARG 229.A O no hydrogen 2.929 N/A ARG 234.A N ASP 230.A O no hydrogen 2.831 N/A ARG 234.A NE ASP 230.A OD2 no hydrogen 2.199 N/A LEU 235.A N ILE 232.A O no hydrogen 2.934 N/A LEU 236.A N ILE 232.A O no hydrogen 2.945 N/A HIS 238.A NE2 GLU 174.A OE2 no hydrogen 3.229 N/A GLN 242.A N ASN 239.A O no hydrogen 2.878 N/A GLN 242.A NE2 ASN 239.A OD1 no hydrogen 2.657 N/A ARG 243.A N PRO 240.A O no hydrogen 3.121 N/A ARG 243.A NE LYS 237.A O no hydrogen 2.936 N/A ARG 243.A NH1 GLU 171.A OE1 no hydrogen 3.483 N/A ARG 243.A NH1 GLU 171.A OE2 no hydrogen 2.449 N/A ARG 243.A NH1 LYS 181.A O no hydrogen 3.432 N/A ARG 243.A NH2 GLU 171.A OE1 no hydrogen 2.974 N/A ARG 243.A NH2 LYS 237.A O no hydrogen 2.772 N/A MET 245.A N GLU 248.A OE1 no hydrogen 2.618 N/A GLU 248.A N MET 245.A O no hydrogen 2.813 N/A VAL 249.A N MET 245.A O no hydrogen 3.390 N/A VAL 249.A N LEU 246.A O no hydrogen 2.802 N/A LEU 250.A N LEU 246.A O no hydrogen 3.173 N/A GLU 251.A N ARG 247.A O no hydrogen 3.082 N/A HIS 252.A N VAL 249.A O no hydrogen 3.277 N/A HIS 252.A NE2 ASP 230.A OD2 no hydrogen 3.048 N/A TRP 254.A N HIS 252.A ND1 no hydrogen 3.053 N/A TRP 254.A NE1 GLU 104.A OE2 no hydrogen 2.534 N/A THR 256.A N HIS 252.A O no hydrogen 3.094 N/A THR 256.A OG1 HIS 252.A O no hydrogen 3.343 N/A ALA 257.A N PRO 253.A O no hydrogen 3.117 N/A ASN 258.A N ILE 255.A O no hydrogen 2.641 N/A ASN 258.A ND2 TRP 254.A O no hydrogen 2.658 N/A SER 259.A N ILE 255.A O no hydrogen 2.626 N/A SER 259.A OG THR 112.A OG1 no hydrogen 2.561 N/A