Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4kms_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): HIS 3.A NE2 THR 31.A OG1 no hydrogen 2.696 N/A SER 5.A OG GLY 29.A O no hydrogen 3.456 N/A ALA 8.A N THR 31.A O no hydrogen 2.910 N/A ILE 9.A N ILE 82.A O no hydrogen 2.872 N/A VAL 10.A N VAL 33.A O no hydrogen 2.985 N/A THR 11.A N VAL 84.A O no hydrogen 2.898 N/A THR 11.A OG1 VAL 84.A O no hydrogen 3.389 N/A GLY 12.A N ASN 35.A OD1 no hydrogen 3.087 N/A GLY 13.A N ASN 35.A O no hydrogen 2.845 N/A ILE 17.A N GLU 184.A OE2 no hydrogen 2.851 N/A LYS 19.A N ARG 15.A O no hydrogen 3.023 N/A LYS 19.A NZ TYR 50.A OH no hydrogen 3.295 N/A ALA 20.A N GLY 16.A O no hydrogen 2.998 N/A THR 21.A N ILE 17.A O no hydrogen 2.963 N/A THR 21.A OG1 ILE 17.A O no hydrogen 2.843 N/A ALA 22.A N GLY 18.A O no hydrogen 2.828 N/A LEU 23.A N LYS 19.A O no hydrogen 3.009 N/A GLU 24.A N ALA 20.A O no hydrogen 2.942 N/A LEU 25.A N THR 21.A O no hydrogen 2.877 N/A LYS 26.A N ALA 22.A O no hydrogen 3.001 N/A LYS 26.A NZ TYR 50.A O no hydrogen 2.642 N/A ASN 27.A N LEU 23.A O no hydrogen 2.970 N/A LYS 28.A N GLU 24.A O no hydrogen 3.089 N/A GLY 29.A N LYS 26.A O no hydrogen 2.855 N/A LEU 30.A N LEU 25.A O no hydrogen 3.109 N/A THR 31.A N GLU 6.A O no hydrogen 3.017 N/A THR 31.A OG1 HIS 3.A NE2 no hydrogen 2.696 N/A VAL 33.A N ALA 8.A O no hydrogen 2.767 N/A ALA 34.A N LYS 53.A O no hydrogen 2.860 N/A ASN 35.A N VAL 10.A O no hydrogen 2.941 N/A ASN 35.A ND2 TRP 57.A O no hydrogen 3.050 N/A PHE 36.A N LYS 55.A O no hydrogen 3.073 N/A ASP 41.A N ASN 39.A OD1 no hydrogen 3.216 N/A ALA 42.A N ASN 39.A OD1 no hydrogen 3.344 N/A ALA 43.A N ASN 39.A O no hydrogen 3.242 N/A LYS 44.A N TYR 40.A O no hydrogen 2.814 N/A GLU 45.A N ASP 41.A O no hydrogen 2.765 N/A MET 46.A N ALA 42.A O no hydrogen 3.020 N/A GLU 47.A N ALA 43.A O no hydrogen 3.044 N/A GLU 48.A N LYS 44.A O no hydrogen 3.046 N/A LYS 49.A N GLU 45.A O no hydrogen 2.939 N/A LYS 49.A NZ GLU 45.A OE2 no hydrogen 3.127 N/A TYR 50.A N MET 46.A O no hydrogen 2.980 N/A GLY 51.A N GLU 47.A O no hydrogen 2.946 N/A THR 54.A N GLU 47.A OE2 no hydrogen 3.058 N/A THR 54.A OG1 GLU 47.A OE2 no hydrogen 2.670 N/A LYS 55.A N ALA 34.A O no hydrogen 3.043 N/A LYS 55.A NZ GLU 71.A OE1 no hydrogen 2.556 N/A CYS 56.A SG PHE 36.A O no hydrogen 3.635 N/A CYS 56.A SG PHE 37.A O no hydrogen 3.254 N/A CYS 56.A SG TYR 40.A OH no hydrogen 3.377 N/A TRP 57.A N PHE 36.A O no hydrogen 3.114 N/A ASN 58.A N GLU 64.A OE1 no hydrogen 2.880 N/A ALA 60.A N ASN 58.A OD1 no hydrogen 2.883 N/A ASP 61.A N ASN 58.A O no hydrogen 2.949 N/A GLU 64.A N ASP 61.A OD1 no hydrogen 2.859 N/A CYS 65.A N ASP 61.A O no hydrogen 3.097 N/A CYS 65.A SG ASN 58.A O no hydrogen 3.971 N/A CYS 65.A SG VAL 59.A O no hydrogen 3.428 N/A CYS 65.A SG ASP 61.A O no hydrogen 3.416 N/A ARG 66.A N PHE 62.A O no hydrogen 3.122 N/A ARG 66.A NH2 SER 119.A OG no hydrogen 2.719 N/A GLN 67.A N GLU 63.A O no hydrogen 2.934 N/A GLN 67.A NE2 GLU 71.A OE2 no hydrogen 2.786 N/A ALA 68.A N GLU 64.A O no hydrogen 2.937 N/A VAL 69.A N CYS 65.A O no hydrogen 3.053 N/A LYS 70.A N ARG 66.A O no hydrogen 3.045 N/A LYS 70.A NZ GLU 74.A OE2 no hydrogen 3.044 N/A GLU 71.A N GLN 67.A O no hydrogen 2.981 N/A ILE 72.A N ALA 68.A O no hydrogen 2.895 N/A GLU 73.A N VAL 69.A O no hydrogen 2.896 N/A GLU 74.A N LYS 70.A O no hydrogen 2.946 N/A GLU 75.A N GLU 71.A O no hydrogen 3.155 N/A PHE 76.A N ILE 72.A O no hydrogen 3.227 N/A LYS 77.A N GLU 73.A O no hydrogen 2.750 N/A LYS 78.A NZ HIS 3.A O no hydrogen 2.716 N/A SER 81.A N ILE 7.A O no hydrogen 3.034 N/A SER 81.A OG GLU 6.A OE1 no hydrogen 2.524 N/A ILE 82.A N ILE 7.A O no hydrogen 3.060 N/A LEU 83.A N ARG 132.A O no hydrogen 2.962 N/A VAL 84.A N ILE 9.A O no hydrogen 2.830 N/A ASN 85.A N VAL 134.A O no hydrogen 2.848 N/A ASN 85.A ND2 SER 118.A OG no hydrogen 3.273 N/A ASN 85.A ND2 ASN 135.A OD1 no hydrogen 2.790 N/A ASN 86.A N THR 11.A OG1 no hydrogen 2.804 N/A ASN 86.A ND2 THR 11.A O no hydrogen 3.302 N/A ASN 86.A ND2 GLY 12.A O no hydrogen 3.284 N/A ILE 89.A N ASN 110.A OD1 no hydrogen 2.931 N/A LYS 91.A NZ ASP 105.A OD2 no hydrogen 2.753 N/A LYS 93.A NZ ASP 102.A OD2 no hydrogen 3.318 N/A ARG 97.A N MET 94.A O no hydrogen 2.817 N/A MET 98.A N LEU 95.A O no hydrogen 3.075 N/A SER 99.A N ASP 102.A OD2 no hydrogen 2.913 N/A GLN 101.A NE2 ASP 105.A OD2 no hydrogen 2.803 N/A ASP 102.A N SER 99.A OG no hydrogen 2.890 N/A TRP 103.A N SER 99.A O no hydrogen 3.146 N/A ASN 104.A N HIS 100.A O no hydrogen 2.954 N/A ASP 105.A N GLN 101.A O no hydrogen 2.900 N/A ILE 107.A N TRP 103.A O no hydrogen 3.026 N/A ASN 108.A N ASN 104.A O no hydrogen 2.829 N/A ASN 108.A ND2 ALA 60.A O no hydrogen 3.634 N/A VAL 109.A N ASP 105.A O no hydrogen 3.020 N/A ASN 110.A N VAL 106.A O no hydrogen 2.857 N/A ASN 110.A ND2 ILE 89.A O no hydrogen 3.106 N/A LEU 111.A N ILE 107.A O no hydrogen 2.874 N/A ASN 112.A N ILE 107.A O no hydrogen 3.026 N/A ASN 112.A ND2 ASN 108.A OD1 no hydrogen 3.108 N/A SER 113.A N ASN 108.A O no hydrogen 3.194 N/A SER 113.A OG VAL 109.A O no hydrogen 2.597 N/A SER 113.A OG ASN 110.A O no hydrogen 3.531 N/A CYS 114.A N LEU 111.A O no hydrogen 2.953 N/A CYS 114.A SG ASN 135.A OD1 no hydrogen 3.919 N/A ASN 116.A N ASN 112.A O no hydrogen 2.778 N/A ASN 116.A ND2 VAL 59.A O no hydrogen 3.040 N/A MET 117.A N SER 113.A O no hydrogen 2.972 N/A SER 118.A N CYS 114.A O no hydrogen 2.987 N/A SER 118.A OG CYS 114.A O no hydrogen 2.742 N/A SER 119.A N PHE 115.A O no hydrogen 2.823 N/A SER 119.A OG PHE 115.A O no hydrogen 2.815 N/A SER 119.A OG ASN 116.A O no hydrogen 3.186 N/A SER 120.A N ASN 116.A O no hydrogen 3.306 N/A SER 120.A OG ASN 116.A O no hydrogen 3.549 N/A SER 120.A OG MET 117.A O no hydrogen 2.844 N/A VAL 121.A N SER 118.A O no hydrogen 3.330 N/A MET 125.A N VAL 121.A O no hydrogen 3.226 N/A ARG 126.A N MET 122.A O no hydrogen 2.861 N/A ARG 126.A NH1 GLU 165.A O no hydrogen 3.401 N/A ASN 127.A N GLU 123.A O no hydrogen 2.951 N/A ASN 127.A ND2 GLN 124.A OE1 no hydrogen 3.258 N/A GLN 128.A N GLN 124.A O no hydrogen 3.039 N/A GLN 128.A NE2 SER 81.A OG no hydrogen 3.026 N/A GLN 128.A NE2 TYR 130.A O no hydrogen 2.895 N/A ASP 129.A N ARG 126.A O no hydrogen 3.087 N/A TYR 130.A N MET 125.A O no hydrogen 3.062 N/A GLY 131.A N ASN 170.A O no hydrogen 3.087 N/A ARG 132.A N SER 81.A O no hydrogen 2.951 N/A ARG 132.A NE ASP 218.A O no hydrogen 3.091 N/A ARG 132.A NH1 GLY 131.A O no hydrogen 2.889 N/A ARG 132.A NH1 ASN 170.A O no hydrogen 3.029 N/A ARG 132.A NH1 ASN 170.A OD1 no hydrogen 3.086 N/A ARG 132.A NH2 ASN 170.A OD1 no hydrogen 3.035 N/A ARG 132.A NH2 GLU 219.A O no hydrogen 2.973 N/A ILE 133.A N THR 172.A O no hydrogen 2.866 N/A VAL 134.A N LEU 83.A O no hydrogen 2.868 N/A ASN 135.A N ASN 174.A O no hydrogen 2.805 N/A ASN 135.A ND2 THR 159.A OG1 no hydrogen 2.909 N/A ILE 136.A N ASN 85.A O no hydrogen 2.805 N/A SER 137.A N ILE 176.A O no hydrogen 2.981 N/A ILE 139.A N PRO 178.A O no hydrogen 2.929 N/A ASN 140.A ND2 ASP 92.A OD1 no hydrogen 2.753 N/A GLN 142.A N ASN 140.A OD1 no hydrogen 3.251 N/A ASN 147.A ND2 LYS 91.A O no hydrogen 2.871 N/A ASN 147.A ND2 ASP 102.A O no hydrogen 3.013 N/A TYR 148.A N ASN 147.A OD1 no hydrogen 2.884 N/A TYR 148.A OH SER 138.A O no hydrogen 2.348 N/A SER 149.A N GLN 145.A O no hydrogen 2.975 N/A SER 149.A OG GLN 145.A O no hydrogen 3.320 N/A ALA 150.A N THR 146.A O no hydrogen 2.994 N/A ALA 151.A N ASN 147.A O no hydrogen 3.006 N/A LYS 152.A N TYR 148.A O no hydrogen 2.920 N/A ALA 153.A N SER 149.A O no hydrogen 2.977 N/A GLY 154.A N ALA 150.A O no hydrogen 2.920 N/A ILE 155.A N ALA 151.A O no hydrogen 2.923 N/A ILE 156.A N LYS 152.A O no hydrogen 3.163 N/A GLY 157.A N ALA 153.A O no hydrogen 2.931 N/A PHE 158.A N GLY 154.A O no hydrogen 2.751 N/A THR 159.A N ILE 155.A O no hydrogen 2.829 N/A THR 159.A OG1 ILE 155.A O no hydrogen 2.712 N/A LYS 160.A N ILE 156.A O no hydrogen 3.076 N/A ALA 161.A N GLY 157.A O no hydrogen 3.043 N/A LEU 162.A N PHE 158.A O no hydrogen 2.825 N/A ALA 163.A N THR 159.A O no hydrogen 2.900 N/A ARG 164.A N LYS 160.A O no hydrogen 3.066 N/A GLU 165.A N ALA 161.A O no hydrogen 3.006 N/A THR 166.A N LEU 162.A O no hydrogen 2.983 N/A THR 166.A OG1 LEU 162.A O no hydrogen 2.757 N/A THR 166.A OG1 ALA 163.A O no hydrogen 3.312 N/A ALA 167.A N ARG 164.A O no hydrogen 3.333 N/A LYS 169.A N THR 166.A O no hydrogen 2.978 N/A ASN 170.A N ASP 129.A OD1 no hydrogen 2.836 N/A THR 172.A N GLY 131.A O no hydrogen 3.083 N/A VAL 173.A N THR 225.A OG1 no hydrogen 3.146 N/A ASN 174.A N ILE 133.A O no hydrogen 2.958 N/A ASN 174.A ND2 ILE 224.A O no hydrogen 3.006 N/A CYS 175.A N GLU 227.A O no hydrogen 2.771 N/A CYS 175.A SG ASN 135.A O no hydrogen 3.412 N/A ILE 176.A N ASN 135.A O no hydrogen 2.896 N/A ALA 177.A N ILE 229.A O no hydrogen 2.865 N/A GLY 179.A N ILE 231.A O no hydrogen 2.835 N/A ALA 182.A N GLY 204.A O no hydrogen 2.758 N/A GLU 184.A N ILE 181.A O no hydrogen 3.042 N/A LEU 191.A N PRO 187.A O no hydrogen 2.935 N/A ALA 192.A N GLU 188.A O no hydrogen 2.960 N/A LYS 193.A N ASP 189.A O no hydrogen 3.004 N/A ILE 194.A N VAL 190.A O no hydrogen 2.965 N/A ILE 195.A N LEU 191.A O no hydrogen 2.943 N/A ASN 196.A N ALA 192.A O no hydrogen 2.965 N/A SER 197.A N LYS 193.A O no hydrogen 3.023 N/A SER 197.A N ILE 194.A O no hydrogen 2.959 N/A SER 197.A OG ILE 194.A O no hydrogen 2.540 N/A ILE 198.A N ILE 195.A O no hydrogen 2.998 N/A LYS 200.A N GLY 233.A O no hydrogen 3.174 N/A LYS 201.A N ILE 198.A O no hydrogen 2.642 N/A LYS 201.A NZ ASN 196.A O no hydrogen 2.842 N/A LYS 201.A NZ ASN 196.A OD1 no hydrogen 3.273 N/A ARG 202.A NH1 LEU 203.A O no hydrogen 2.941 N/A ARG 202.A NH1 GLU 208.A OE2 no hydrogen 2.913 N/A ARG 202.A NH2 GLU 208.A OE1 no hydrogen 2.889 N/A GLY 204.A N TYR 180.A O no hydrogen 2.836 N/A GLN 205.A N GLU 208.A OE2 no hydrogen 2.839 N/A GLU 208.A N GLN 205.A O no hydrogen 2.902 N/A ILE 209.A N PRO 206.A O no hydrogen 2.985 N/A ALA 210.A N PRO 206.A O no hydrogen 2.986 N/A ARG 211.A N GLU 207.A O no hydrogen 2.913 N/A VAL 213.A N ILE 209.A O no hydrogen 3.029 N/A ALA 214.A N ALA 210.A O no hydrogen 2.951 N/A PHE 215.A N ARG 211.A O no hydrogen 2.945 N/A LEU 216.A N ALA 212.A O no hydrogen 3.080 N/A VAL 217.A N VAL 213.A O no hydrogen 2.917 N/A ASN 220.A N ASP 218.A OD1 no hydrogen 2.834 N/A ALA 221.A N ASP 218.A O no hydrogen 3.018 N/A ILE 224.A N ALA 221.A O no hydrogen 3.162 N/A GLY 226.A N VAL 173.A O no hydrogen 2.744 N/A GLU 227.A N ASN 174.A OD1 no hydrogen 2.936 N/A ILE 229.A N CYS 175.A O no hydrogen 2.800 N/A ILE 231.A N ALA 177.A O no hydrogen 3.057 N/A GLY 234.A N ASN 232.A OD1 no hydrogen 2.709 N/A HIS 235.A N ASN 232.A O no hydrogen 3.151 N/A HIS 235.A ND1 SER 197.A O no hydrogen 3.085 N/A