Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3fck_B.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLY 4.A N THR 47.A OG1 no hydrogen 2.894 N/A TRP 7.A NE1 CYS 50.A O no hydrogen 2.801 N/A LYS 8.A N GLY 4.A O no hydrogen 2.856 N/A LYS 8.A NZ GLU 5.A OE2 no hydrogen 3.484 N/A LYS 9.A N GLU 5.A O no hydrogen 2.892 N/A HIS 10.A N TRP 7.A O no hydrogen 3.108 N/A LEU 11.A N TRP 7.A O no hydrogen 2.885 N/A SER 12.A N LYS 8.A O no hydrogen 2.963 N/A SER 12.A OG LYS 8.A O no hydrogen 3.065 N/A GLU 14.A N LEU 11.A O no hydrogen 2.911 N/A PHE 15.A N SER 12.A O no hydrogen 3.018 N/A LYS 17.A N GLU 14.A O no hydrogen 3.082 N/A LYS 17.A NZ GLU 14.A OE2 no hydrogen 2.801 N/A TYR 19.A OH GLU 14.A OE1 no hydrogen 2.641 N/A PHE 20.A N LYS 17.A O no hydrogen 2.892 N/A ILE 21.A N LYS 17.A O no hydrogen 3.208 N/A LYS 22.A N PRO 18.A O no hydrogen 3.044 N/A LEU 23.A N TYR 19.A O no hydrogen 2.913 N/A MET 24.A N PHE 20.A O no hydrogen 2.908 N/A GLY 25.A N ILE 21.A O no hydrogen 3.044 N/A PHE 26.A N LYS 22.A O no hydrogen 2.902 N/A VAL 27.A N LEU 23.A O no hydrogen 2.996 N/A ALA 28.A N MET 24.A O no hydrogen 3.041 N/A GLU 29.A N GLY 25.A O no hydrogen 2.966 N/A GLU 30.A N PHE 26.A O no hydrogen 2.949 N/A ARG 31.A N VAL 27.A O no hydrogen 2.916 N/A ARG 31.A NH1 PRO 38.A O no hydrogen 2.855 N/A ARG 31.A NH2 VAL 36.A O no hydrogen 3.058 N/A ARG 31.A NH2 PRO 38.A O no hydrogen 3.234 N/A LYS 32.A N GLU 29.A O no hydrogen 3.075 N/A HIS 33.A N GLU 30.A O no hydrogen 3.164 N/A HIS 33.A NE2 GLU 29.A OE1 no hydrogen 2.740 N/A TYR 34.A N GLU 30.A O no hydrogen 2.782 N/A TYR 37.A N VAL 127.A O no hydrogen 2.829 N/A GLN 42.A N PRO 39.A O no hydrogen 2.912 N/A VAL 43.A N PRO 40.A O no hydrogen 3.450 N/A THR 45.A OG1 GLN 42.A O no hydrogen 3.072 N/A THR 45.A OG1 HIS 72.A O no hydrogen 2.634 N/A THR 47.A N PHE 44.A O no hydrogen 2.915 N/A THR 47.A OG1 PHE 44.A O no hydrogen 2.640 N/A GLN 48.A N THR 45.A O no hydrogen 2.835 N/A CYS 50.A SG ASP 51.A O no hydrogen 3.572 N/A CYS 50.A SG ALA 114.A O no hydrogen 3.641 N/A ILE 52.A N SER 6.A OG no hydrogen 3.074 N/A LYS 53.A N ASP 51.A OD1 no hydrogen 2.927 N/A ASP 54.A N ASP 51.A O no hydrogen 2.848 N/A VAL 55.A N ILE 52.A O no hydrogen 3.410 N/A LYS 56.A N GLY 117.A O no hydrogen 2.719 N/A LYS 56.A NZ LYS 215.A O no hydrogen 2.772 N/A VAL 57.A N GLY 117.A O no hydrogen 3.104 N/A VAL 58.A N VAL 159.A O no hydrogen 2.811 N/A ILE 59.A N LEU 119.A O no hydrogen 2.814 N/A GLY 61.A N LEU 121.A O no hydrogen 2.840 N/A TYR 65.A OH PHE 76.A O no hydrogen 2.803 N/A GLY 67.A N GLN 70.A OE1 no hydrogen 3.013 N/A GLN 70.A N GLY 67.A O no hydrogen 3.283 N/A HIS 72.A NE2 SER 77.A OG no hydrogen 2.703 N/A CYS 75.A N LEU 120.A O no hydrogen 2.917 N/A CYS 75.A SG ILE 59.A O no hydrogen 3.402 N/A SER 77.A N LEU 74.A O no hydrogen 3.312 N/A SER 77.A OG HIS 72.A NE2 no hydrogen 2.703 N/A SER 77.A OG GLY 108.A O no hydrogen 3.273 N/A VAL 78.A N GLY 108.A O no hydrogen 2.849 N/A VAL 82.A N GLN 79.A O no hydrogen 2.982 N/A GLU 89.A N PRO 85.A O no hydrogen 2.969 N/A ASN 90.A N PRO 86.A O no hydrogen 3.026 N/A ASN 90.A ND2 PRO 187.A O no hydrogen 2.755 N/A ILE 91.A N SER 87.A O no hydrogen 2.952 N/A TYR 92.A N LEU 88.A O no hydrogen 2.887 N/A TYR 92.A OH HIS 107.A O no hydrogen 2.752 N/A LYS 93.A N GLU 89.A O no hydrogen 2.835 N/A GLU 94.A N ASN 90.A O no hydrogen 2.944 N/A LEU 95.A N ILE 91.A O no hydrogen 2.969 N/A SER 96.A N TYR 92.A O no hydrogen 2.951 N/A SER 96.A N LYS 93.A O no hydrogen 3.205 N/A SER 96.A OG LYS 93.A O no hydrogen 2.560 N/A THR 97.A N GLU 94.A O no hydrogen 3.246 N/A THR 97.A OG1 GLU 94.A O no hydrogen 3.087 N/A ASP 98.A N GLU 94.A O no hydrogen 2.924 N/A ILE 99.A N LEU 95.A O no hydrogen 2.808 N/A PHE 102.A N ILE 99.A O no hydrogen 3.027 N/A HIS 104.A NE2 GLU 89.A OE1 no hydrogen 3.103 N/A HIS 104.A NE2 GLU 89.A OE2 no hydrogen 3.053 N/A GLY 106.A N HIS 104.A ND1 no hydrogen 2.922 N/A LEU 110.A N SER 77.A OG no hydrogen 2.752 N/A SER 111.A N ASP 109.A OD2 no hydrogen 2.869 N/A SER 111.A OG ASP 109.A OD2 no hydrogen 2.652 N/A TRP 113.A N LEU 110.A O no hydrogen 2.931 N/A TRP 113.A NE1 TRP 219.A O no hydrogen 2.855 N/A ALA 114.A N LEU 110.A O no hydrogen 3.139 N/A LYS 115.A N SER 111.A O no hydrogen 2.913 N/A GLN 116.A N TRP 113.A O no hydrogen 2.896 N/A GLN 116.A NE2 GLY 112.A O no hydrogen 3.079 N/A GLN 116.A NE2 ASP 218.A O no hydrogen 2.903 N/A GLY 117.A N ALA 114.A O no hydrogen 2.965 N/A VAL 118.A N TRP 113.A O no hydrogen 3.158 N/A LEU 119.A N VAL 57.A O no hydrogen 2.686 N/A LEU 121.A N ILE 59.A O no hydrogen 3.060 N/A ALA 123.A N GLY 61.A O no hydrogen 2.976 N/A VAL 124.A N GLN 62.A O no hydrogen 2.979 N/A THR 126.A OG1 HIS 135.A ND1 no hydrogen 2.734 N/A VAL 127.A N TYR 37.A O no hydrogen 2.864 N/A ARG 128.A N SER 134.A OG no hydrogen 2.827 N/A ARG 128.A NE GLU 30.A OE1 no hydrogen 2.864 N/A ARG 128.A NH1 GLU 30.A OE1 no hydrogen 3.390 N/A ARG 128.A NH1 GLU 30.A OE2 no hydrogen 2.893 N/A ALA 129.A N THR 35.A O no hydrogen 2.799 N/A HIS 130.A N HIS 66.A O no hydrogen 2.842 N/A GLN 131.A N ARG 128.A O no hydrogen 3.068 N/A ASN 133.A N ASP 63.A OD2 no hydrogen 2.725 N/A SER 134.A N GLN 131.A O no hydrogen 3.187 N/A SER 134.A OG GLN 131.A O no hydrogen 2.701 N/A HIS 135.A ND1 THR 126.A OG1 no hydrogen 2.734 N/A HIS 135.A NE2 GLU 30.A OE1 no hydrogen 2.683 N/A LYS 136.A N ASN 133.A O no hydrogen 3.148 N/A GLU 137.A N GLU 141.A OE1 no hydrogen 3.175 N/A GLU 137.A N GLU 141.A OE2 no hydrogen 2.728 N/A TRP 140.A NE1 THR 126.A OG1 no hydrogen 2.827 N/A GLU 141.A N GLU 141.A OE1 no hydrogen 2.770 N/A PHE 143.A N GLY 139.A O no hydrogen 3.322 N/A THR 144.A N TRP 140.A O no hydrogen 2.828 N/A THR 144.A OG1 ALA 123.A O no hydrogen 2.695 N/A THR 144.A OG1 TRP 140.A O no hydrogen 3.115 N/A THR 144.A OG1 GLU 141.A O no hydrogen 3.367 N/A ASP 145.A N GLU 141.A O no hydrogen 2.819 N/A ALA 146.A N GLN 142.A O no hydrogen 2.982 N/A VAL 147.A N PHE 143.A O no hydrogen 3.097 N/A VAL 148.A N THR 144.A O no hydrogen 2.982 N/A SER 149.A N ASP 145.A O no hydrogen 2.818 N/A TRP 150.A N ALA 146.A O no hydrogen 2.958 N/A LEU 151.A N VAL 147.A O no hydrogen 3.048 N/A ASN 152.A N VAL 148.A O no hydrogen 2.851 N/A GLN 153.A N SER 149.A O no hydrogen 2.967 N/A ASN 154.A N TRP 150.A O no hydrogen 2.847 N/A SER 155.A N LEU 151.A O no hydrogen 2.992 N/A SER 155.A OG LEU 151.A O no hydrogen 3.317 N/A GLY 157.A N ARG 178.A O no hydrogen 2.966 N/A LEU 158.A N HIS 179.A ND1 no hydrogen 3.029 N/A VAL 159.A N LYS 56.A O no hydrogen 3.108 N/A PHE 160.A N HIS 180.A O no hydrogen 2.768 N/A LEU 161.A N VAL 58.A O no hydrogen 2.788 N/A LEU 162.A N LEU 182.A O no hydrogen 2.772 N/A GLY 164.A N THR 184.A O no hydrogen 2.900 N/A GLN 168.A N GLY 164.A O no hydrogen 3.041 N/A LYS 169.A N SER 165.A O no hydrogen 2.959 N/A LYS 170.A N TYR 166.A O no hydrogen 3.093 N/A LYS 170.A NZ GLU 141.A O no hydrogen 3.462 N/A LYS 170.A NZ THR 144.A OG1 no hydrogen 2.892 N/A LYS 170.A NZ ASP 145.A OD1 no hydrogen 2.764 N/A GLY 171.A N ALA 167.A O no hydrogen 2.988 N/A SER 172.A N LYS 169.A O no hydrogen 3.155 N/A SER 172.A OG LYS 169.A O no hydrogen 2.908 N/A ILE 174.A N GLY 171.A O no hydrogen 3.300 N/A ASP 175.A N ASN 152.A OD1 no hydrogen 2.850 N/A ARG 176.A NH1 GLY 171.A O no hydrogen 2.894 N/A ARG 176.A NH1 ILE 174.A O no hydrogen 3.014 N/A LYS 177.A N ASP 175.A OD1 no hydrogen 2.831 N/A ARG 178.A N ASP 175.A OD1 no hydrogen 2.874 N/A ARG 178.A NE SER 155.A O no hydrogen 2.735 N/A ARG 178.A NH2 SER 155.A O no hydrogen 3.085 N/A HIS 179.A N ASP 175.A O no hydrogen 2.859 N/A HIS 179.A NE2 ASN 152.A O no hydrogen 2.885 N/A HIS 180.A N LEU 158.A O no hydrogen 2.727 N/A HIS 180.A NE2 SER 212.A OG no hydrogen 2.769 N/A LEU 182.A N PHE 160.A O no hydrogen 2.828 N/A THR 184.A N LEU 162.A O no hydrogen 3.106 N/A ALA 185.A N THR 184.A OG1 no hydrogen 2.783 N/A SER 188.A N HIS 186.A ND1 no hydrogen 2.961 N/A LEU 190.A N SER 188.A OG no hydrogen 3.248 N/A SER 191.A N SER 188.A O no hydrogen 2.944 N/A SER 191.A OG HIS 186.A O no hydrogen 2.662 N/A SER 191.A OG SER 188.A O no hydrogen 3.438 N/A VAL 192.A N SER 188.A O no hydrogen 2.755 N/A ARG 194.A N SER 191.A O no hydrogen 2.813 N/A PHE 197.A N VAL 192.A O no hydrogen 2.985 N/A GLY 198.A N GLU 94.A OE1 no hydrogen 2.777 N/A CYS 199.A N PHE 196.A O no hydrogen 2.991 N/A CYS 199.A SG PHE 196.A O no hydrogen 3.210 N/A ARG 200.A N GLU 94.A OE2 no hydrogen 2.907 N/A ARG 200.A NE ASP 98.A OD2 no hydrogen 2.577 N/A ARG 200.A NH1 ASP 98.A O no hydrogen 2.818 N/A ARG 200.A NH1 ASP 98.A OD2 no hydrogen 3.049 N/A SER 203.A N ASP 98.A OD1 no hydrogen 2.811 N/A SER 203.A OG ASP 98.A OD1 no hydrogen 3.494 N/A SER 203.A OG ASP 98.A OD2 no hydrogen 2.610 N/A SER 203.A OG ARG 200.A O no hydrogen 3.189 N/A LYS 204.A N ARG 200.A O no hydrogen 3.144 N/A LYS 204.A NZ CYS 199.A O no hydrogen 2.700 N/A THR 205.A N HIS 201.A O no hydrogen 2.819 N/A THR 205.A OG1 HIS 201.A O no hydrogen 2.713 N/A ASN 206.A N PHE 202.A O no hydrogen 3.421 N/A ASN 206.A ND2 ILE 217.A O no hydrogen 3.057 N/A GLU 207.A N SER 203.A O no hydrogen 3.176 N/A LEU 208.A N LYS 204.A O no hydrogen 3.013 N/A LEU 209.A N THR 205.A O no hydrogen 2.867 N/A GLN 210.A N ASN 206.A O no hydrogen 3.068 N/A LYS 211.A N GLU 207.A O no hydrogen 3.158 N/A SER 212.A N LEU 208.A O no hydrogen 2.950 N/A SER 212.A N LEU 209.A O no hydrogen 3.072 N/A SER 212.A OG GLY 157.A O no hydrogen 3.143 N/A SER 212.A OG LEU 208.A O no hydrogen 3.171 N/A GLY 213.A N GLN 210.A O no hydrogen 2.874 N/A LYS 214.A N LEU 209.A O no hydrogen 2.801 N/A LYS 214.A NZ ASN 156.A O no hydrogen 2.809 N/A ILE 217.A N ASN 206.A OD1 no hydrogen 2.826 N/A ASP 218.A N GLN 116.A OE1 no hydrogen 2.808 N/A TRP 219.A NE1 PHE 202.A O no hydrogen 3.016 N/A LYS 220.A N ASP 218.A OD2 no hydrogen 3.039 N/A LYS 220.A NZ ASP 218.A OD2 no hydrogen 2.750 N/A GLU 221.A N ASP 218.A O no hydrogen 3.002 N/A LEU 222.A N LYS 220.A O no hydrogen 2.836 N/A