Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3grp_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): PHE 3.A N GLU 216.A OE1 no hydrogen 2.819 N/A LYS 4.A NZ GLN 30.A OE1 no hydrogen 3.384 N/A LEU 5.A N GLN 30.A O no hydrogen 2.819 N/A GLY 7.A N GLY 31.A O no hydrogen 2.873 N/A ARG 8.A N LEU 5.A O no hydrogen 2.957 N/A ARG 8.A NH2 ASP 215.A OD2 no hydrogen 3.153 N/A LYS 9.A N ASP 83.A OD2 no hydrogen 3.054 N/A LYS 9.A NZ GLU 80.A O no hydrogen 2.931 N/A LYS 9.A NZ GLY 81.A O no hydrogen 2.491 N/A ALA 10.A N ILE 33.A O no hydrogen 2.881 N/A LEU 11.A N ILE 84.A O no hydrogen 2.781 N/A VAL 12.A N GLY 35.A O no hydrogen 2.830 N/A THR 13.A N VAL 86.A O no hydrogen 3.042 N/A THR 13.A OG1 VAL 86.A O no hydrogen 3.389 N/A GLY 14.A N HIS 37.A ND1 no hydrogen 3.323 N/A ALA 15.A N HIS 37.A O no hydrogen 2.804 N/A GLU 21.A N GLY 17.A O no hydrogen 3.011 N/A ALA 22.A N GLY 18.A O no hydrogen 3.108 N/A ILE 23.A N ILE 19.A O no hydrogen 2.814 N/A ALA 24.A N GLY 20.A O no hydrogen 3.064 N/A ARG 25.A N GLU 21.A O no hydrogen 3.009 N/A ARG 25.A NE GLU 21.A OE2 no hydrogen 2.698 N/A ARG 25.A NH1 ASP 50.A OD2 no hydrogen 2.736 N/A ARG 25.A NH2 GLU 21.A OE2 no hydrogen 3.008 N/A ARG 25.A NH2 ASP 50.A OD2 no hydrogen 3.279 N/A CYS 26.A N ALA 22.A O no hydrogen 2.974 N/A PHE 27.A N ILE 23.A O no hydrogen 2.818 N/A HIS 28.A N ALA 24.A O no hydrogen 3.038 N/A HIS 28.A NE2 LYS 53.A O no hydrogen 2.731 N/A ALA 29.A N ARG 25.A O no hydrogen 2.927 N/A GLN 30.A N CYS 26.A O no hydrogen 3.140 N/A GLN 30.A N PHE 27.A O no hydrogen 3.085 N/A GLN 30.A NE2 PHE 3.A O no hydrogen 2.803 N/A GLY 31.A N HIS 28.A O no hydrogen 3.014 N/A ALA 32.A N PHE 27.A O no hydrogen 3.044 N/A ILE 33.A N ARG 8.A O no hydrogen 2.818 N/A VAL 34.A N ASP 54.A O no hydrogen 3.032 N/A GLY 35.A N ALA 10.A O no hydrogen 2.705 N/A LEU 36.A N PHE 56.A O no hydrogen 2.692 N/A HIS 37.A N VAL 12.A O no hydrogen 2.929 N/A HIS 37.A NE2 ALA 60.A O no hydrogen 2.928 N/A GLY 38.A N PHE 58.A O no hydrogen 3.169 N/A LEU 44.A N ARG 40.A O no hydrogen 3.029 N/A LYS 45.A N GLU 41.A O no hydrogen 3.113 N/A GLU 46.A N ASP 42.A O no hydrogen 3.089 N/A ILE 47.A N LYS 43.A O no hydrogen 3.208 N/A ALA 48.A N LEU 44.A O no hydrogen 2.916 N/A ALA 49.A N LYS 45.A O no hydrogen 2.850 N/A ASP 50.A N GLU 46.A O no hydrogen 3.009 N/A LEU 51.A N ILE 47.A O no hydrogen 3.005 N/A GLY 52.A N ALA 48.A O no hydrogen 2.860 N/A LYS 53.A NZ ASP 54.A OD2 no hydrogen 3.268 N/A PHE 56.A N VAL 34.A O no hydrogen 2.845 N/A PHE 58.A N LEU 36.A O no hydrogen 2.869 N/A SER 59.A OG GLU 41.A OE2 no hydrogen 2.931 N/A ASN 61.A N SER 67.A OG no hydrogen 3.174 N/A SER 63.A N ASN 61.A OD1 no hydrogen 2.585 N/A SER 63.A OG ASN 61.A OD1 no hydrogen 3.254 N/A ASP 64.A N ASN 61.A O no hydrogen 3.044 N/A SER 67.A N ASP 64.A OD1 no hydrogen 3.157 N/A SER 67.A OG ASN 61.A O no hydrogen 3.523 N/A ILE 68.A N ASP 64.A O no hydrogen 3.000 N/A LYS 69.A N ARG 65.A O no hydrogen 3.040 N/A GLN 70.A N LYS 66.A O no hydrogen 2.957 N/A LEU 71.A N SER 67.A O no hydrogen 3.065 N/A ALA 72.A N ILE 68.A O no hydrogen 3.127 N/A GLU 73.A N LYS 69.A O no hydrogen 3.072 N/A VAL 74.A N GLN 70.A O no hydrogen 2.944 N/A ALA 75.A N LEU 71.A O no hydrogen 2.811 N/A GLU 76.A N ALA 72.A O no hydrogen 3.047 N/A ARG 77.A N GLU 73.A O no hydrogen 3.040 N/A ARG 77.A NH1 GLU 73.A OE2 no hydrogen 3.289 N/A GLU 78.A N VAL 74.A O no hydrogen 2.919 N/A MET 79.A N ALA 75.A O no hydrogen 2.880 N/A GLU 80.A N ARG 77.A O no hydrogen 3.242 N/A GLY 81.A N GLU 76.A O no hydrogen 2.948 N/A ASP 83.A N LYS 9.A O no hydrogen 2.851 N/A ILE 84.A N LYS 9.A O no hydrogen 2.842 N/A LEU 85.A N ARG 129.A O no hydrogen 2.883 N/A VAL 86.A N LEU 11.A O no hydrogen 2.893 N/A ASN 87.A N ILE 131.A O no hydrogen 2.911 N/A ASN 87.A ND2 THR 115.A OG1 no hydrogen 3.012 N/A ASN 87.A ND2 ASN 132.A OD1 no hydrogen 2.763 N/A ASN 88.A N THR 13.A OG1 no hydrogen 2.896 N/A ASN 88.A ND2 THR 13.A O no hydrogen 3.246 N/A ASN 88.A ND2 GLY 14.A O no hydrogen 2.988 N/A ALA 89.A N THR 13.A OG1 no hydrogen 3.026 N/A ILE 91.A N ASN 107.A OD1 no hydrogen 3.046 N/A ARG 94.A NE ASP 99.A OD2 no hydrogen 2.837 N/A ARG 94.A NH2 ASP 99.A OD1 no hydrogen 2.786 N/A GLN 98.A N MET 95.A O no hydrogen 2.834 N/A ASP 99.A N MET 95.A O no hydrogen 3.046 N/A TRP 100.A N GLN 96.A O no hydrogen 2.977 N/A ASP 101.A N ASP 97.A O no hydrogen 2.986 N/A ASP 102.A N GLN 98.A O no hydrogen 2.822 N/A VAL 103.A N ASP 99.A O no hydrogen 3.014 N/A LEU 104.A N TRP 100.A O no hydrogen 3.074 N/A ALA 105.A N ASP 101.A O no hydrogen 2.868 N/A VAL 106.A N ASP 102.A O no hydrogen 2.950 N/A ASN 107.A N VAL 103.A O no hydrogen 2.856 N/A ASN 107.A ND2 ILE 91.A O no hydrogen 3.331 N/A LEU 108.A N LEU 104.A O no hydrogen 3.016 N/A THR 109.A N LEU 104.A O no hydrogen 2.850 N/A ALA 110.A N ALA 105.A O no hydrogen 2.917 N/A SER 112.A N LEU 108.A O no hydrogen 3.187 N/A SER 112.A OG LEU 108.A O no hydrogen 3.321 N/A SER 112.A OG THR 109.A O no hydrogen 2.855 N/A THR 113.A N THR 109.A O no hydrogen 2.826 N/A THR 113.A OG1 THR 109.A O no hydrogen 2.854 N/A LEU 114.A N ALA 110.A O no hydrogen 3.010 N/A THR 115.A N ALA 111.A O no hydrogen 2.886 N/A THR 115.A OG1 ALA 111.A O no hydrogen 2.675 N/A ARG 116.A N SER 112.A O no hydrogen 3.022 N/A GLU 117.A N THR 113.A O no hydrogen 3.185 N/A LEU 118.A N LEU 114.A O no hydrogen 3.151 N/A LEU 118.A N THR 115.A O no hydrogen 3.049 N/A ILE 119.A N THR 115.A O no hydrogen 3.068 N/A SER 121.A OG GLU 76.A OE1 no hydrogen 2.442 N/A MET 123.A N ILE 119.A O no hydrogen 2.702 N/A ARG 124.A N HIS 120.A O no hydrogen 2.999 N/A ARG 124.A NH1 SER 121.A OG no hydrogen 3.384 N/A ARG 125.A N SER 121.A O no hydrogen 3.053 N/A ARG 126.A N MET 123.A O no hydrogen 3.146 N/A ARG 126.A NH1 SER 161.A O no hydrogen 3.045 N/A TYR 127.A N MET 122.A O no hydrogen 3.135 N/A GLY 128.A N ASN 163.A O no hydrogen 3.220 N/A ARG 129.A N ASP 83.A O no hydrogen 2.942 N/A ARG 129.A NE LEU 212.A O no hydrogen 3.252 N/A ARG 129.A NE SER 214.A O no hydrogen 3.389 N/A ARG 129.A NH1 GLY 128.A O no hydrogen 2.895 N/A ARG 129.A NH2 SER 214.A O no hydrogen 3.011 N/A ILE 130.A N THR 165.A O no hydrogen 2.811 N/A ILE 131.A N LEU 85.A O no hydrogen 2.837 N/A ASN 132.A N ASN 167.A O no hydrogen 2.860 N/A ILE 133.A N ASN 87.A O no hydrogen 2.812 N/A THR 134.A N ILE 169.A O no hydrogen 2.859 N/A THR 134.A OG1 SER 135.A O no hydrogen 3.165 N/A CYS 142.A N GLN 138.A O no hydrogen 2.874 N/A CYS 142.A SG GLN 138.A O no hydrogen 3.280 N/A ALA 143.A N THR 139.A O no hydrogen 3.132 N/A ALA 144.A N ASN 140.A O no hydrogen 3.123 N/A LYS 145.A N TYR 141.A O no hydrogen 2.924 N/A ALA 146.A N CYS 142.A O no hydrogen 2.885 N/A GLY 147.A N ALA 143.A O no hydrogen 2.876 N/A LEU 148.A N ALA 144.A O no hydrogen 2.864 N/A ILE 149.A N LYS 145.A O no hydrogen 2.947 N/A GLY 150.A N ALA 146.A O no hydrogen 2.959 N/A PHE 151.A N GLY 147.A O no hydrogen 2.794 N/A SER 152.A N LEU 148.A O no hydrogen 2.823 N/A SER 152.A OG LEU 148.A O no hydrogen 2.867 N/A LYS 153.A N ILE 149.A O no hydrogen 2.986 N/A LYS 153.A NZ GLY 222.A O no hydrogen 3.523 N/A ALA 154.A N GLY 150.A O no hydrogen 3.122 N/A LEU 155.A N PHE 151.A O no hydrogen 2.958 N/A ALA 156.A N SER 152.A O no hydrogen 2.960 N/A GLN 157.A N LYS 153.A O no hydrogen 3.415 N/A GLU 158.A N ALA 154.A O no hydrogen 3.251 N/A ILE 159.A N LEU 155.A O no hydrogen 3.030 N/A ARG 162.A N ILE 159.A O no hydrogen 3.003 N/A ASN 163.A N ALA 160.A O no hydrogen 2.960 N/A ASN 163.A ND2 ARG 126.A O no hydrogen 3.610 N/A THR 165.A N GLY 128.A O no hydrogen 3.148 N/A VAL 166.A N THR 221.A OG1 no hydrogen 2.970 N/A ASN 167.A N ILE 130.A O no hydrogen 3.022 N/A ASN 167.A ND2 LEU 220.A O no hydrogen 2.944 N/A CYS 168.A N GLN 223.A O no hydrogen 2.862 N/A CYS 168.A SG SER 152.A OG no hydrogen 3.196 N/A ILE 169.A N ASN 132.A O no hydrogen 2.859 N/A ALA 170.A N LEU 225.A O no hydrogen 2.897 N/A GLY 172.A N ILE 227.A O no hydrogen 2.940 N/A LYS 175.A N GLY 200.A O no hydrogen 2.963 N/A SER 176.A N THR 179.A OG1 no hydrogen 2.972 N/A THR 179.A N SER 176.A OG no hydrogen 3.399 N/A THR 179.A OG1 SER 176.A O no hydrogen 3.157 N/A ASP 180.A N SER 176.A O no hydrogen 2.870 N/A LYS 181.A N MET 178.A O no hydrogen 3.299 N/A LEU 182.A N THR 179.A O no hydrogen 3.093 N/A ASN 183.A N GLN 186.A OE1 no hydrogen 3.018 N/A GLN 186.A N ASN 183.A OD1 no hydrogen 2.924 N/A LYS 187.A N ASN 183.A O no hydrogen 2.841 N/A GLU 188.A N GLU 184.A O no hydrogen 2.815 N/A ALA 189.A N LYS 185.A O no hydrogen 2.873 N/A ILE 190.A N GLN 186.A O no hydrogen 2.990 N/A MET 191.A N LYS 187.A O no hydrogen 2.978 N/A ALA 192.A N GLU 188.A O no hydrogen 3.131 N/A MET 193.A N ILE 190.A O no hydrogen 2.987 N/A ILE 194.A N MET 191.A O no hydrogen 3.033 N/A MET 196.A N GLY 229.A O no hydrogen 3.130 N/A LYS 197.A N ILE 194.A O no hydrogen 2.820 N/A LYS 197.A NZ MET 191.A O no hydrogen 2.899 N/A LYS 197.A NZ ILE 194.A O no hydrogen 2.839 N/A ARG 198.A NH1 MET 199.A O no hydrogen 3.349 N/A ARG 198.A NH1 GLU 204.A OE1 no hydrogen 2.974 N/A ARG 198.A NH1 GLU 204.A OE2 no hydrogen 3.344 N/A ARG 198.A NH2 GLU 204.A OE2 no hydrogen 2.798 N/A GLY 200.A N PHE 173.A O no hydrogen 2.929 N/A ILE 201.A N GLU 204.A OE1 no hydrogen 2.938 N/A GLU 204.A N ILE 201.A O no hydrogen 2.864 N/A ALA 206.A N GLY 202.A O no hydrogen 3.014 N/A PHE 207.A N GLU 203.A O no hydrogen 2.850 N/A ALA 208.A N GLU 204.A O no hydrogen 3.415 N/A THR 209.A N ILE 205.A O no hydrogen 3.058 N/A THR 209.A OG1 ILE 205.A O no hydrogen 3.115 N/A VAL 210.A N ALA 206.A O no hydrogen 2.949 N/A TYR 211.A N PHE 207.A O no hydrogen 2.938 N/A LEU 212.A N ALA 208.A O no hydrogen 2.963 N/A ALA 213.A N THR 209.A O no hydrogen 2.852 N/A SER 214.A N VAL 210.A O no hydrogen 3.044 N/A SER 214.A N TYR 211.A O no hydrogen 3.211 N/A SER 214.A OG TYR 211.A O no hydrogen 2.701 N/A SER 214.A OG GLU 216.A OE2 no hydrogen 3.353 N/A GLU 216.A N GLU 216.A OE2 no hydrogen 2.683 N/A ALA 217.A N SER 214.A O no hydrogen 3.278 N/A ALA 218.A N ASP 215.A O no hydrogen 3.278 N/A LEU 220.A N ALA 217.A O no hydrogen 3.126 N/A THR 221.A OG1 VAL 166.A O no hydrogen 3.496 N/A GLY 222.A N VAL 166.A O no hydrogen 2.752 N/A GLN 223.A N ASN 167.A OD1 no hydrogen 2.938 N/A LEU 225.A N CYS 168.A O no hydrogen 2.794 N/A ILE 227.A N ALA 170.A O no hydrogen 3.060 N/A GLY 230.A N ASN 228.A OD1 no hydrogen 3.147 N/A MET 231.A N ASN 228.A O no hydrogen 3.356 N/A MET 231.A N ASN 228.A OD1 no hydrogen 3.045 N/A