Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 2p91_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): LEU 2.A N GLU 30.A OE1 no hydrogen 2.852 N/A LEU 3.A N GLU 30.A O no hydrogen 2.936 N/A GLU 4.A N GLY 1.A O no hydrogen 3.368 N/A LYS 6.A N LEU 3.A O no hydrogen 2.990 N/A LYS 6.A NZ ASP 232.A OD1 no hydrogen 2.956 N/A LYS 6.A NZ ASP 232.A OD2 no hydrogen 3.527 N/A ARG 7.A N ASP 85.A OD2 no hydrogen 2.811 N/A ALA 8.A N GLN 33.A O no hydrogen 2.952 N/A LEU 9.A N ILE 86.A O no hydrogen 2.904 N/A ILE 10.A N ALA 35.A O no hydrogen 2.732 N/A THR 11.A N VAL 88.A O no hydrogen 3.074 N/A THR 11.A OG1 VAL 88.A O no hydrogen 2.665 N/A ALA 14.A N SER 18.A OG no hydrogen 2.951 N/A ASN 15.A N SER 18.A OG no hydrogen 3.179 N/A ARG 17.A N ASN 15.A OD1 no hydrogen 2.814 N/A SER 18.A N ASN 15.A O no hydrogen 3.334 N/A SER 18.A OG ASN 15.A O no hydrogen 3.331 N/A TYR 21.A N SER 18.A O no hydrogen 3.003 N/A GLY 22.A N SER 18.A O no hydrogen 3.385 N/A ILE 23.A N ILE 19.A O no hydrogen 3.104 N/A ALA 24.A N ALA 20.A O no hydrogen 2.861 N/A LYS 25.A N TYR 21.A O no hydrogen 2.834 N/A LYS 25.A NZ GLU 220.A OE2 no hydrogen 3.404 N/A SER 26.A N GLY 22.A O no hydrogen 3.048 N/A SER 26.A OG GLY 22.A O no hydrogen 3.390 N/A SER 26.A OG ASP 224.A OD1 no hydrogen 2.815 N/A PHE 27.A N ILE 23.A O no hydrogen 2.900 N/A HIS 28.A N ALA 24.A O no hydrogen 2.788 N/A ARG 29.A N LYS 25.A O no hydrogen 3.038 N/A ARG 29.A NE GLU 30.A OE2 no hydrogen 2.974 N/A ARG 29.A NH1 ASP 224.A OD1 no hydrogen 2.849 N/A ARG 29.A NH2 ASP 224.A OD1 no hydrogen 2.825 N/A GLU 30.A N SER 26.A O no hydrogen 3.018 N/A GLY 31.A N HIS 28.A O no hydrogen 2.974 N/A ALA 32.A N PHE 27.A O no hydrogen 2.959 N/A GLN 33.A N LYS 6.A O no hydrogen 2.897 N/A ALA 35.A N ALA 8.A O no hydrogen 3.070 N/A PHE 36.A N LEU 58.A O no hydrogen 2.841 N/A THR 37.A N ILE 10.A O no hydrogen 3.139 N/A TYR 38.A N VAL 60.A O no hydrogen 2.956 N/A LYS 42.A NZ THR 40.A OG1 no hydrogen 3.324 N/A LEU 43.A N THR 40.A O no hydrogen 2.989 N/A GLU 44.A N PRO 41.A O no hydrogen 3.220 N/A LYS 45.A NZ GLU 49.A OE2 no hydrogen 2.889 N/A VAL 47.A N LEU 43.A O no hydrogen 3.043 N/A ARG 48.A N GLU 44.A O no hydrogen 2.896 N/A ARG 48.A NE GLU 44.A OE2 no hydrogen 2.859 N/A ARG 48.A NH2 GLU 44.A OE2 no hydrogen 3.414 N/A GLU 49.A N LYS 45.A O no hydrogen 2.998 N/A ILE 50.A N ARG 46.A O no hydrogen 3.010 N/A ALA 51.A N VAL 47.A O no hydrogen 2.890 N/A LYS 52.A N ARG 48.A O no hydrogen 2.977 N/A GLY 53.A N GLU 49.A O no hydrogen 3.041 N/A PHE 54.A N ALA 51.A O no hydrogen 2.903 N/A GLY 55.A N LYS 52.A O no hydrogen 2.798 N/A SER 56.A N ALA 51.A O no hydrogen 2.862 N/A SER 56.A OG LEU 34.A O no hydrogen 2.706 N/A LEU 58.A N SER 56.A OG no hydrogen 3.147 N/A VAL 60.A N PHE 36.A O no hydrogen 2.954 N/A LYS 61.A NZ ASP 69.A OD2 no hydrogen 2.762 N/A CYS 62.A N TYR 38.A O no hydrogen 2.863 N/A CYS 62.A SG ASP 69.A O no hydrogen 3.694 N/A ASP 63.A N ASP 69.A OD2 no hydrogen 2.734 N/A SER 65.A N ASP 63.A OD1 no hydrogen 3.081 N/A SER 65.A OG ASP 63.A OD1 no hydrogen 2.769 N/A SER 65.A OG ASP 63.A OD2 no hydrogen 3.286 N/A LEU 66.A N ASP 63.A O no hydrogen 2.963 N/A ILE 70.A N LEU 66.A O no hydrogen 3.304 N/A LYS 71.A N ASP 67.A O no hydrogen 3.007 N/A ASN 72.A N GLU 68.A O no hydrogen 2.852 N/A LEU 73.A N ASP 69.A O no hydrogen 2.870 N/A LYS 74.A N ILE 70.A O no hydrogen 3.080 N/A LYS 75.A N LYS 71.A O no hydrogen 3.016 N/A PHE 76.A N ASN 72.A O no hydrogen 2.793 N/A LEU 77.A N LEU 73.A O no hydrogen 2.965 N/A GLU 78.A N LYS 74.A O no hydrogen 2.861 N/A GLU 79.A N LYS 75.A O no hydrogen 3.114 N/A ASN 80.A N PHE 76.A O no hydrogen 3.092 N/A ASN 80.A ND2 PHE 76.A O no hydrogen 2.957 N/A TRP 81.A N LEU 77.A O no hydrogen 2.829 N/A GLY 82.A N LEU 77.A O no hydrogen 2.911 N/A LEU 84.A N LEU 132.A O no hydrogen 2.922 N/A ASP 85.A N ARG 7.A O no hydrogen 2.946 N/A ILE 86.A N ARG 7.A O no hydrogen 2.968 N/A ILE 87.A N ALA 139.A O no hydrogen 3.117 N/A VAL 88.A N LEU 9.A O no hydrogen 2.824 N/A HIS 89.A N VAL 141.A O no hydrogen 2.787 N/A HIS 89.A ND1 THR 142.A OG1 no hydrogen 2.662 N/A HIS 89.A NE2 SER 121.A OG no hydrogen 2.813 N/A SER 90.A N THR 11.A OG1 no hydrogen 3.017 N/A TYR 93.A N SER 118.A OG no hydrogen 3.105 N/A GLU 98.A N PRO 95.A O no hydrogen 2.949 N/A PHE 99.A N LYS 96.A O no hydrogen 3.128 N/A LYS 100.A N GLU 97.A O no hydrogen 3.042 N/A GLY 102.A N ASP 105.A OD2 no hydrogen 2.846 N/A ASP 105.A N GLY 102.A O no hydrogen 2.946 N/A THR 106.A N VAL 103.A O no hydrogen 3.006 N/A THR 106.A OG1 VAL 103.A O no hydrogen 2.695 N/A SER 107.A N GLU 98.A OE1 no hydrogen 2.959 N/A SER 107.A OG GLU 98.A OE2 no hydrogen 2.680 N/A GLY 110.A N SER 107.A OG no hydrogen 2.933 N/A PHE 111.A N SER 107.A O no hydrogen 2.937 N/A LYS 112.A N ARG 108.A O no hydrogen 3.028 N/A ILE 113.A N GLU 109.A O no hydrogen 2.973 N/A ALA 114.A N GLY 110.A O no hydrogen 2.929 N/A MET 115.A N PHE 111.A O no hydrogen 3.018 N/A ASP 116.A N LYS 112.A O no hydrogen 2.997 N/A ILE 117.A N ILE 113.A O no hydrogen 2.929 N/A SER 118.A N ALA 114.A O no hydrogen 2.889 N/A SER 118.A OG ALA 114.A O no hydrogen 2.798 N/A VAL 119.A N MET 115.A O no hydrogen 2.952 N/A TYR 120.A N MET 115.A O no hydrogen 2.950 N/A SER 121.A N ASP 116.A O no hydrogen 3.064 N/A SER 121.A OG HIS 89.A NE2 no hydrogen 2.813 N/A SER 121.A OG ILE 117.A O no hydrogen 2.580 N/A LEU 122.A N VAL 119.A O no hydrogen 3.029 N/A ALA 124.A N TYR 120.A O no hydrogen 2.996 N/A LEU 125.A N SER 121.A O no hydrogen 2.936 N/A THR 126.A N LEU 122.A O no hydrogen 2.964 N/A THR 126.A OG1 LEU 122.A O no hydrogen 2.731 N/A ARG 127.A N ILE 123.A O no hydrogen 2.913 N/A ARG 127.A NH2 TYR 120.A OH no hydrogen 2.784 N/A GLU 128.A N ALA 124.A O no hydrogen 2.933 N/A LEU 129.A N LEU 125.A O no hydrogen 2.986 N/A LEU 130.A N THR 126.A O no hydrogen 3.014 N/A LEU 132.A N LEU 129.A O no hydrogen 3.012 N/A MET 133.A N LEU 130.A O no hydrogen 2.903 N/A GLU 134.A N PRO 131.A O no hydrogen 3.090 N/A ARG 136.A N MET 133.A O no hydrogen 2.926 N/A GLY 138.A N HIS 181.A ND1 no hydrogen 3.121 N/A ALA 139.A N ASP 85.A O no hydrogen 2.913 N/A ILE 140.A N ARG 182.A O no hydrogen 2.885 N/A VAL 141.A N ILE 87.A O no hydrogen 2.932 N/A THR 142.A N ASN 184.A O no hydrogen 3.052 N/A THR 142.A OG1 HIS 89.A ND1 no hydrogen 2.662 N/A THR 142.A OG1 HIS 89.A O no hydrogen 3.359 N/A SER 144.A N ILE 186.A O no hydrogen 2.719 N/A SER 144.A OG GLU 166.A OE2 no hydrogen 2.619 N/A TYR 145.A N SER 144.A OG no hydrogen 2.750 N/A TYR 146.A OH HIS 249.A O no hydrogen 3.404 N/A ALA 148.A N TYR 145.A O no hydrogen 2.795 N/A GLU 149.A N TYR 146.A O no hydrogen 2.887 N/A LYS 150.A N TYR 146.A O no hydrogen 3.025 N/A HIS 154.A ND1 PHE 99.A O no hydrogen 2.883 N/A TYR 155.A N VAL 152.A O no hydrogen 2.915 N/A ASN 156.A ND2 GLU 98.A O no hydrogen 2.870 N/A ASN 156.A ND2 GLY 101.A O no hydrogen 2.998 N/A MET 158.A N TYR 155.A O no hydrogen 3.032 N/A GLY 159.A N ASN 156.A O no hydrogen 2.762 N/A ALA 161.A N VAL 157.A O no hydrogen 2.869 N/A LYS 162.A N MET 158.A O no hydrogen 2.786 N/A LYS 162.A NZ LEU 143.A O no hydrogen 2.653 N/A ALA 163.A N GLY 159.A O no hydrogen 3.217 N/A ALA 164.A N ILE 160.A O no hydrogen 3.036 N/A LEU 165.A N ALA 161.A O no hydrogen 2.775 N/A GLU 166.A N LYS 162.A O no hydrogen 2.935 N/A SER 167.A N ALA 163.A O no hydrogen 3.198 N/A THR 168.A N ALA 164.A O no hydrogen 2.843 N/A THR 168.A OG1 ALA 164.A O no hydrogen 2.744 N/A VAL 169.A N LEU 165.A O no hydrogen 2.899 N/A ARG 170.A N GLU 166.A O no hydrogen 3.275 N/A TYR 171.A N SER 167.A O no hydrogen 3.080 N/A LEU 172.A N THR 168.A O no hydrogen 2.886 N/A ALA 173.A N VAL 169.A O no hydrogen 2.882 N/A TYR 174.A N ARG 170.A O no hydrogen 3.223 N/A ASP 175.A N TYR 171.A O no hydrogen 2.985 N/A ILE 176.A N LEU 172.A O no hydrogen 2.810 N/A ALA 177.A N ALA 173.A O no hydrogen 3.117 N/A HIS 179.A N ILE 176.A O no hydrogen 2.959 N/A GLY 180.A N ALA 177.A O no hydrogen 2.898 N/A HIS 181.A N ILE 176.A O no hydrogen 3.139 N/A ARG 182.A N GLY 138.A O no hydrogen 3.035 N/A ARG 182.A NH1 LEU 229.A O no hydrogen 3.016 N/A ARG 182.A NH1 ILE 237.A O no hydrogen 2.979 N/A ARG 182.A NH2 LEU 229.A O no hydrogen 3.010 N/A ILE 183.A N THR 238.A OG1 no hydrogen 3.084 N/A ASN 184.A N ILE 140.A O no hydrogen 3.025 N/A ASN 184.A ND2 ILE 237.A O no hydrogen 3.018 N/A ALA 185.A N GLU 240.A O no hydrogen 2.794 N/A ILE 186.A N THR 142.A O no hydrogen 2.841 N/A SER 187.A N VAL 242.A O no hydrogen 2.832 N/A ALA 188.A N SER 144.A O no hydrogen 3.074 N/A GLY 189.A N VAL 244.A O no hydrogen 3.026 N/A ALA 196.A N THR 193.A OG1 no hydrogen 3.046 N/A PHE 200.A N ILE 197.A O no hydrogen 3.080 N/A LEU 203.A N GLY 199.A O no hydrogen 2.948 N/A MET 204.A N PHE 200.A O no hydrogen 2.836 N/A GLU 205.A N HIS 201.A O no hydrogen 2.891 N/A HIS 206.A N LEU 202.A O no hydrogen 2.832 N/A HIS 206.A NE2 PHE 254.A O no hydrogen 2.752 N/A THR 207.A N LEU 203.A O no hydrogen 2.854 N/A THR 207.A OG1 LEU 203.A O no hydrogen 2.947 N/A THR 208.A N MET 204.A O no hydrogen 2.976 N/A THR 208.A OG1 MET 204.A O no hydrogen 3.179 N/A LYS 209.A N GLU 205.A O no hydrogen 2.963 N/A LYS 209.A NZ GLU 205.A OE2 no hydrogen 2.944 N/A VAL 210.A N HIS 206.A O no hydrogen 3.072 N/A ASN 211.A N THR 207.A O no hydrogen 2.990 N/A ASN 211.A ND2 LYS 215.A O no hydrogen 2.793 N/A PHE 213.A N ASN 211.A OD1 no hydrogen 2.926 N/A GLY 214.A N ASN 211.A O no hydrogen 2.966 N/A THR 218.A N ASP 221.A OD2 no hydrogen 2.860 N/A THR 218.A OG1 GLU 220.A OE1 no hydrogen 3.482 N/A GLU 220.A N GLU 220.A OE1 no hydrogen 2.916 N/A ASP 221.A N THR 218.A OG1 no hydrogen 3.189 N/A VAL 222.A N THR 218.A O no hydrogen 3.420 N/A GLY 223.A N ILE 219.A O no hydrogen 2.916 N/A ASP 224.A N GLU 220.A O no hydrogen 2.916 N/A THR 225.A N ASP 221.A O no hydrogen 3.316 N/A THR 225.A OG1 ASP 221.A O no hydrogen 3.084 N/A ALA 226.A N VAL 222.A O no hydrogen 2.877 N/A VAL 227.A N GLY 223.A O no hydrogen 2.939 N/A PHE 228.A N ASP 224.A O no hydrogen 3.312 N/A LEU 229.A N THR 225.A O no hydrogen 2.944 N/A CYS 230.A N ALA 226.A O no hydrogen 2.811 N/A CYS 230.A SG ALA 226.A O no hydrogen 3.372 N/A SER 231.A N PHE 228.A O no hydrogen 3.048 N/A SER 231.A OG PHE 228.A O no hydrogen 2.767 N/A TRP 233.A N SER 231.A OG no hydrogen 3.165 N/A ALA 234.A N SER 231.A O no hydrogen 3.224 N/A ARG 235.A N ASP 232.A O no hydrogen 3.307 N/A ILE 237.A N ALA 234.A O no hydrogen 2.887 N/A THR 238.A OG1 ILE 183.A O no hydrogen 3.475 N/A GLY 239.A N ILE 183.A O no hydrogen 2.709 N/A GLU 240.A N ASN 184.A OD1 no hydrogen 2.937 N/A VAL 241.A N GLU 240.A OE1 no hydrogen 2.927 N/A VAL 242.A N ALA 185.A O no hydrogen 2.858 N/A HIS 243.A NE2 GLU 149.A OE1 no hydrogen 2.583 N/A VAL 244.A N SER 187.A O no hydrogen 2.894 N/A ASN 246.A ND2 LYS 215.A O no hydrogen 2.721 N/A GLY 247.A N ASP 245.A OD1 no hydrogen 2.863 N/A TYR 248.A N ASP 245.A O no hydrogen 3.225 N/A HIS 249.A N ASP 245.A OD2 no hydrogen 2.909 N/A ILE 250.A N GLY 247.A O no hydrogen 3.023 N/A MET 251.A N TYR 248.A O no hydrogen 3.076 N/A