Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 2hwp_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): TRP 5.A N ASP 3.A OD2 no hydrogen 2.672 N/A GLU 6.A N ASP 3.A O no hydrogen 3.128 N/A ILE 7.A N VAL 59.A O no hydrogen 3.213 N/A SER 11.A N PRO 8.A O no hydrogen 2.625 N/A LEU 12.A N ARG 9.A O no hydrogen 2.912 N/A ARG 13.A N THR 27.A O no hydrogen 3.043 N/A LEU 16.A N VAL 23.A O no hydrogen 2.690 N/A GLY 17.A N VAL 23.A O no hydrogen 3.234 N/A TRP 24.A N ILE 36.A O no hydrogen 2.933 N/A MET 25.A N VAL 14.A O no hydrogen 2.919 N/A GLY 26.A N VAL 34.A O no hydrogen 3.100 N/A THR 27.A N ARG 13.A O no hydrogen 3.333 N/A TRP 28.A N THR 32.A O no hydrogen 2.663 N/A ASN 29.A N SER 11.A O no hydrogen 3.055 N/A THR 31.A N TRP 28.A O no hydrogen 3.117 N/A THR 32.A N TRP 28.A O no hydrogen 3.065 N/A THR 32.A OG1 TRP 28.A O no hydrogen 3.247 N/A VAL 34.A N GLY 26.A O no hydrogen 3.172 N/A ALA 35.A N THR 68.A O no hydrogen 2.954 N/A ILE 36.A N TRP 24.A O no hydrogen 2.909 N/A LYS 37.A N ILE 66.A O no hydrogen 3.001 N/A LYS 46.A N ALA 42.A O no hydrogen 3.166 N/A LYS 46.A NZ ASP 3.A OD1 no hydrogen 2.989 N/A LYS 47.A N VAL 44.A O no hydrogen 3.155 N/A ARG 49.A N TYR 106.A OH no hydrogen 2.953 N/A LYS 52.A N HIS 50.A ND1 no hydrogen 2.958 N/A LYS 52.A NZ GLN 99.A OE1 no hydrogen 3.004 N/A LEU 53.A N HIS 50.A O no hydrogen 3.304 N/A VAL 54.A N VAL 132.A O no hydrogen 3.085 N/A GLN 55.A N GLU 69.A OE1 no hydrogen 2.998 N/A GLN 55.A NE2 LEU 56.A O no hydrogen 2.759 N/A TYR 57.A N VAL 67.A O no hydrogen 2.783 N/A ALA 58.A N VAL 67.A O no hydrogen 3.230 N/A VAL 59.A N TRP 5.A O no hydrogen 3.362 N/A VAL 60.A N TYR 65.A O no hydrogen 2.951 N/A SER 61.A N GLU 6.A OE1 no hydrogen 2.722 N/A SER 61.A OG GLU 6.A OE1 no hydrogen 2.987 N/A TYR 65.A N VAL 60.A O no hydrogen 3.372 N/A ILE 66.A N LYS 37.A O no hydrogen 3.364 N/A VAL 67.A N ALA 58.A O no hydrogen 2.784 N/A THR 68.A N ALA 35.A O no hydrogen 2.978 N/A THR 68.A OG1 GLU 69.A O no hydrogen 3.344 N/A GLU 69.A N GLN 55.A O no hydrogen 3.086 N/A SER 72.A OG GLU 126.A OE1 no hydrogen 2.838 N/A LYS 73.A N VAL 124.A O no hydrogen 2.979 N/A LYS 73.A NZ GLU 126.A OE1 no hydrogen 3.288 N/A GLY 74.A N MET 71.A O no hydrogen 3.080 N/A LEU 76.A N ILE 122.A O no hydrogen 2.748 N/A LEU 77.A N ALA 119.A O no hydrogen 3.173 N/A PHE 79.A N CYS 75.A O no hydrogen 2.919 N/A LEU 80.A N LEU 76.A O no hydrogen 2.983 N/A LYS 81.A N LEU 77.A O no hydrogen 3.138 N/A GLY 82.A N PHE 79.A O no hydrogen 3.183 N/A GLY 85.A N GLY 82.A O no hydrogen 3.471 N/A ARG 89.A N GLN 92.A OE1 no hydrogen 2.843 N/A ARG 89.A NH1 LYS 86.A O no hydrogen 2.758 N/A ARG 89.A NH1 LEU 88.A O no hydrogen 2.767 N/A ARG 89.A NH2 LYS 86.A O no hydrogen 3.421 N/A LEU 90.A N LEU 245.A OXT no hydrogen 3.018 N/A LEU 93.A N ARG 89.A O no hydrogen 2.990 N/A VAL 94.A N LEU 90.A O no hydrogen 2.517 N/A ASP 95.A N PRO 91.A O no hydrogen 2.991 N/A MET 96.A N GLN 92.A O no hydrogen 3.009 N/A ALA 97.A N LEU 93.A O no hydrogen 2.803 N/A ALA 98.A N VAL 94.A O no hydrogen 2.851 N/A GLN 99.A N ASP 95.A O no hydrogen 3.083 N/A GLN 99.A NE2 ASP 95.A O no hydrogen 3.534 N/A GLN 99.A NE2 ASP 95.A OD2 no hydrogen 2.606 N/A GLN 99.A NE2 LEU 128.A O no hydrogen 2.998 N/A ILE 100.A N MET 96.A O no hydrogen 3.195 N/A ALA 101.A N ALA 97.A O no hydrogen 2.826 N/A SER 102.A N ALA 98.A O no hydrogen 2.990 N/A GLY 103.A N GLN 99.A O no hydrogen 3.069 N/A MET 104.A N ILE 100.A O no hydrogen 2.836 N/A ALA 105.A N ALA 101.A O no hydrogen 2.553 N/A TYR 106.A N SER 102.A O no hydrogen 3.088 N/A VAL 107.A N GLY 103.A O no hydrogen 3.080 N/A GLU 108.A N MET 104.A O no hydrogen 2.739 N/A ARG 109.A N ALA 105.A O no hydrogen 2.875 N/A MET 110.A N TYR 106.A O no hydrogen 2.901 N/A ASN 111.A N GLU 108.A O no hydrogen 3.178 N/A TYR 112.A N VAL 107.A O no hydrogen 3.023 N/A HIS 114.A N ASP 156.A OD2 no hydrogen 2.546 N/A HIS 114.A NE2 ALA 133.A O no hydrogen 3.164 N/A ARG 115.A N ASP 156.A OD1 no hydrogen 2.894 N/A ASP 116.A N HIS 114.A ND1 no hydrogen 2.985 N/A ALA 119.A N GLU 166.A OE2 no hydrogen 2.603 N/A ASN 121.A N ARG 118.A O no hydrogen 2.725 N/A ASN 121.A ND2 ASP 116.A O no hydrogen 2.578 N/A ILE 122.A N ALA 119.A O no hydrogen 3.342 N/A LEU 123.A N LYS 131.A O no hydrogen 2.952 N/A VAL 124.A N GLY 74.A O no hydrogen 2.927 N/A GLY 125.A N VAL 129.A O no hydrogen 2.591 N/A VAL 129.A N GLU 126.A O no hydrogen 3.226 N/A CYS 130.A N GLN 99.A OE1 no hydrogen 2.892 N/A CYS 130.A SG LEU 128.A O no hydrogen 4.031 N/A LYS 131.A N LEU 123.A O no hydrogen 2.833 N/A LYS 131.A NZ GLU 69.A OE1 no hydrogen 2.722 N/A LYS 131.A NZ GLU 69.A OE2 no hydrogen 2.523 N/A VAL 132.A N LYS 52.A O no hydrogen 2.726 N/A ALA 133.A N ASN 121.A O no hydrogen 2.940 N/A LYS 139.A NZ MET 178.A O no hydrogen 3.360 N/A LYS 139.A NZ ASN 180.A OD1 no hydrogen 3.458 N/A TRP 140.A N PRO 137.A O no hydrogen 3.251 N/A THR 141.A N ILE 138.A O no hydrogen 3.261 N/A THR 141.A OG1 PRO 137.A O no hydrogen 2.850 N/A GLU 144.A N GLU 144.A OE1 no hydrogen 3.131 N/A ALA 145.A N ALA 142.A O no hydrogen 2.980 N/A ALA 146.A N ALA 142.A O no hydrogen 2.742 N/A LEU 147.A N PRO 143.A O no hydrogen 2.866 N/A ARG 150.A N GLU 144.A O no hydrogen 3.151 N/A PHE 151.A N GLY 149.A O no hydrogen 3.029 N/A THR 152.A N SER 155.A OG no hydrogen 2.698 N/A LYS 154.A NZ ARG 218.A O no hydrogen 2.470 N/A SER 155.A N THR 152.A OG1 no hydrogen 3.285 N/A SER 155.A OG THR 152.A O no hydrogen 2.759 N/A ASP 156.A N THR 152.A O no hydrogen 2.965 N/A VAL 157.A N ILE 153.A O no hydrogen 2.891 N/A TRP 158.A N LYS 154.A O no hydrogen 3.281 N/A SER 159.A N SER 155.A O no hydrogen 3.070 N/A SER 159.A OG TRP 140.A O no hydrogen 2.490 N/A PHE 160.A N ASP 156.A O no hydrogen 2.923 N/A GLY 161.A N VAL 157.A O no hydrogen 3.127 N/A ILE 162.A N TRP 158.A O no hydrogen 3.292 N/A LEU 163.A N SER 159.A O no hydrogen 2.822 N/A LEU 164.A N PHE 160.A O no hydrogen 2.844 N/A THR 165.A N GLY 161.A O no hydrogen 3.379 N/A THR 165.A OG1 ILE 162.A O no hydrogen 2.544 N/A GLU 166.A N ILE 162.A O no hydrogen 2.974 N/A LEU 167.A N LEU 163.A O no hydrogen 2.819 N/A THR 168.A N LEU 164.A O no hydrogen 2.914 N/A THR 168.A OG1 LEU 164.A O no hydrogen 3.353 N/A THR 168.A OG1 THR 165.A O no hydrogen 3.507 N/A THR 169.A N THR 165.A O no hydrogen 2.984 N/A THR 169.A OG1 THR 165.A O no hydrogen 2.908 N/A LYS 170.A N LEU 167.A O no hydrogen 3.278 N/A LYS 170.A NZ GLY 85.A O no hydrogen 3.066 N/A LYS 170.A NZ LEU 88.A O no hydrogen 2.865 N/A LYS 170.A NZ ASN 244.A O no hydrogen 2.726 N/A GLY 171.A N GLU 166.A O no hydrogen 2.654 N/A ARG 172.A N THR 169.A OG1 no hydrogen 3.037 N/A MET 178.A N TYR 175.A O no hydrogen 2.963 N/A VAL 183.A N VAL 179.A O no hydrogen 2.929 N/A LEU 184.A N ASN 180.A O no hydrogen 2.988 N/A ASP 185.A N ARG 181.A O no hydrogen 3.042 N/A GLN 186.A N GLU 182.A O no hydrogen 2.899 N/A VAL 187.A N VAL 183.A O no hydrogen 2.848 N/A GLU 188.A N LEU 184.A O no hydrogen 3.021 N/A ARG 189.A N ASP 185.A O no hydrogen 3.150 N/A GLY 190.A N VAL 187.A O no hydrogen 2.715 N/A TYR 191.A N GLN 186.A O no hydrogen 2.875 N/A ARG 192.A NE TRP 211.A O no hydrogen 2.995 N/A ARG 192.A NH1 VAL 187.A O no hydrogen 3.436 N/A ARG 192.A NH1 TYR 191.A O no hydrogen 2.741 N/A ARG 192.A NH2 TRP 211.A O no hydrogen 2.891 N/A CYS 195.A SG PRO 196.A O no hydrogen 3.616 N/A CYS 195.A SG CYS 199.A O no hydrogen 2.877 N/A CYS 199.A N PRO 196.A O no hydrogen 2.948 N/A CYS 199.A SG PRO 200.A O no hydrogen 3.691 N/A SER 202.A OG GLU 236.A OE2 no hydrogen 2.787 N/A LEU 203.A N PRO 200.A O no hydrogen 2.959 N/A HIS 204.A N PRO 200.A O no hydrogen 3.302 N/A HIS 204.A NE2 MET 193.A O no hydrogen 2.815 N/A ASP 205.A N GLU 201.A O no hydrogen 2.700 N/A LEU 206.A N SER 202.A O no hydrogen 3.204 N/A MET 207.A N LEU 203.A O no hydrogen 3.343 N/A CYS 208.A N HIS 204.A O no hydrogen 2.950 N/A CYS 208.A SG HIS 204.A O no hydrogen 3.471 N/A GLN 209.A N ASP 205.A O no hydrogen 2.893 N/A CYS 210.A N LEU 206.A O no hydrogen 3.135 N/A CYS 210.A SG LEU 206.A O no hydrogen 3.265 N/A TRP 211.A N CYS 208.A O no hydrogen 2.979 N/A ARG 212.A NH1 GLU 217.A O no hydrogen 3.210 N/A GLU 217.A N ASP 214.A O no hydrogen 2.754 N/A ARG 218.A N PRO 215.A O no hydrogen 2.808 N/A ARG 218.A NE LYS 154.A O no hydrogen 3.362 N/A ARG 218.A NH1 GLU 144.A OE1 no hydrogen 3.435 N/A ARG 218.A NH1 ARG 212.A O no hydrogen 2.614 N/A ARG 218.A NH2 GLU 144.A OE1 no hydrogen 3.249 N/A ARG 218.A NH2 GLU 144.A OE2 no hydrogen 2.600 N/A ARG 218.A NH2 LYS 154.A O no hydrogen 3.167 N/A PHE 221.A N GLU 108.A OE1 no hydrogen 3.100 N/A PHE 221.A N GLU 108.A OE2 no hydrogen 3.128 N/A GLU 222.A N GLU 108.A OE1 no hydrogen 3.444 N/A TYR 223.A N THR 220.A OG1 no hydrogen 2.976 N/A LEU 224.A N THR 220.A O no hydrogen 3.060 N/A GLN 225.A N PHE 221.A O no hydrogen 2.614 N/A GLN 225.A NE2 GLU 229.A OE2 no hydrogen 2.849 N/A ALA 226.A N GLU 222.A O no hydrogen 3.030 N/A PHE 227.A N TYR 223.A O no hydrogen 2.876 N/A LEU 228.A N LEU 224.A O no hydrogen 2.927 N/A GLU 229.A N GLN 225.A O no hydrogen 2.938 N/A ASP 230.A N ALA 226.A O no hydrogen 3.270 N/A TYR 231.A N LEU 228.A O no hydrogen 3.044 N/A TYR 231.A OH SER 202.A OG no hydrogen 2.636 N/A THR 233.A N ASP 230.A O no hydrogen 2.978 N/A SER 234.A N ASP 230.A O no hydrogen 2.941 N/A THR 235.A N TYR 231.A O no hydrogen 3.067 N/A GLU 236.A N TYR 231.A O no hydrogen 2.864 N/A TYR 239.A OH LEU 245.A OXT no hydrogen 2.539 N/A GLY 242.A N LEU 245.A O no hydrogen 2.863 N/A ASN 244.A N GLU 198.A OE1 no hydrogen 2.775 N/A ASN 244.A N GLU 198.A OE2 no hydrogen 3.143 N/A LEU 245.A N GLU 198.A OE1 no hydrogen 2.947 N/A