Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 2pin_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): THR 6.A N GLU 9.A OE1 no hydrogen 2.729 N/A THR 6.A OG1 GLU 8.A OE1 no hydrogen 3.012 N/A GLU 9.A N THR 6.A OG1 no hydrogen 3.276 N/A TRP 10.A N THR 6.A O no hydrogen 3.022 N/A GLU 11.A N ASP 7.A O no hydrogen 3.428 N/A LEU 12.A N GLU 8.A O no hydrogen 3.314 N/A ILE 13.A N GLU 9.A O no hydrogen 2.788 N/A LYS 14.A N TRP 10.A O no hydrogen 2.901 N/A LYS 14.A NZ GLU 18.A OE1 no hydrogen 3.227 N/A LYS 14.A NZ GLU 18.A OE2 no hydrogen 2.996 N/A THR 15.A N GLU 11.A O no hydrogen 2.998 N/A THR 15.A OG1 GLU 11.A O no hydrogen 3.013 N/A VAL 16.A N LEU 12.A O no hydrogen 3.031 N/A THR 17.A N ILE 13.A O no hydrogen 3.014 N/A THR 17.A OG1 ILE 13.A O no hydrogen 2.632 N/A THR 17.A OG1 THR 153.A OG1 no hydrogen 2.949 N/A GLU 18.A N LYS 14.A O no hydrogen 3.031 N/A ALA 19.A N THR 15.A O no hydrogen 2.992 N/A HIS 20.A N VAL 16.A O no hydrogen 2.964 N/A VAL 21.A N THR 17.A O no hydrogen 2.916 N/A ALA 22.A N GLU 18.A O no hydrogen 2.968 N/A THR 23.A N HIS 20.A O no hydrogen 3.103 N/A THR 23.A OG1 ALA 19.A O no hydrogen 2.875 N/A THR 23.A OG1 HIS 20.A O no hydrogen 3.170 N/A ASN 24.A N VAL 21.A O no hydrogen 3.377 N/A LYS 31.A N HIS 29.A ND1 no hydrogen 3.416 N/A LYS 33.A NZ GLU 118.A OE1 no hydrogen 3.497 N/A ARG 34.A NH1 ASP 107.A OD2 no hydrogen 3.503 N/A ARG 34.A NH1 THR 114.A OG1 no hydrogen 3.091 N/A ARG 34.A NH2 ASP 107.A OD2 no hydrogen 2.816 N/A LYS 35.A N GLU 118.A O no hydrogen 2.640 N/A LEU 37.A N ALA 120.A O no hydrogen 3.039 N/A ILE 41.A N PRO 38.A O no hydrogen 2.909 N/A VAL 49.A N GLU 230.A OE1 no hydrogen 2.961 N/A ASP 50.A N ASN 128.A O no hydrogen 2.767 N/A ALA 53.A N ASP 50.A OD1 no hydrogen 3.091 N/A PHE 54.A N ASP 50.A O no hydrogen 2.730 N/A SER 55.A N LEU 51.A O no hydrogen 2.840 N/A HIS 56.A N GLU 52.A O no hydrogen 3.232 N/A HIS 56.A ND1 GLU 52.A O no hydrogen 3.170 N/A PHE 57.A N ALA 53.A O no hydrogen 3.285 N/A PHE 57.A N PHE 54.A O no hydrogen 2.891 N/A THR 58.A N PHE 54.A O no hydrogen 3.087 N/A THR 58.A OG1 PHE 54.A O no hydrogen 3.402 N/A THR 58.A OG1 SER 55.A O no hydrogen 3.398 N/A THR 58.A OG1 LEU 235.A O no hydrogen 3.013 N/A ILE 60.A N PHE 57.A O no hydrogen 3.037 N/A ILE 61.A N THR 58.A O no hydrogen 3.355 N/A ILE 65.A N ILE 61.A O no hydrogen 3.035 N/A THR 66.A N THR 62.A O no hydrogen 2.845 N/A THR 66.A OG1 THR 62.A O no hydrogen 3.330 N/A THR 66.A OG1 PRO 63.A O no hydrogen 2.792 N/A ARG 67.A N PRO 63.A O no hydrogen 3.126 N/A VAL 68.A N ALA 64.A O no hydrogen 3.410 N/A VAL 68.A N ILE 65.A O no hydrogen 3.144 N/A VAL 69.A N ILE 65.A O no hydrogen 3.316 N/A ASP 70.A N THR 66.A O no hydrogen 2.992 N/A PHE 71.A N ARG 67.A O no hydrogen 2.794 N/A ALA 72.A N VAL 68.A O no hydrogen 3.084 N/A LYS 73.A N VAL 69.A O no hydrogen 3.094 N/A LYS 74.A N PHE 71.A O no hydrogen 3.133 N/A LEU 75.A N ALA 72.A O no hydrogen 3.142 N/A PHE 78.A N LEU 75.A O no hydrogen 2.845 N/A CYS 79.A N LEU 75.A O no hydrogen 3.227 N/A CYS 79.A SG LYS 73.A O no hydrogen 3.249 N/A CYS 79.A SG LEU 75.A O no hydrogen 3.813 N/A LEU 81.A N PHE 78.A O no hydrogen 3.079 N/A GLN 86.A N PRO 82.A O no hydrogen 2.962 N/A GLN 86.A NE2 PHE 78.A O no hydrogen 3.090 N/A ILE 87.A N CYS 83.A O no hydrogen 3.015 N/A ILE 88.A N GLU 84.A O no hydrogen 3.143 N/A LEU 89.A N ASP 85.A O no hydrogen 2.871 N/A LEU 90.A N GLN 86.A O no hydrogen 2.898 N/A LYS 91.A N ILE 87.A O no hydrogen 3.039 N/A LYS 91.A NZ GLU 242.A OE2 no hydrogen 2.742 N/A LYS 91.A NZ GLU 245.A OE1 no hydrogen 3.334 N/A GLY 92.A N LEU 89.A O no hydrogen 3.019 N/A CYS 93.A N LEU 90.A O no hydrogen 3.233 N/A CYS 93.A SG LEU 89.A O no hydrogen 3.427 N/A CYS 93.A SG LEU 90.A O no hydrogen 3.913 N/A CYS 94.A N LEU 90.A O no hydrogen 2.823 N/A ILE 97.A N CYS 93.A O no hydrogen 2.671 N/A MET 98.A N CYS 94.A O no hydrogen 2.932 N/A SER 99.A N MET 95.A O no hydrogen 2.808 N/A SER 99.A OG MET 95.A O no hydrogen 2.688 N/A LEU 100.A N GLU 96.A O no hydrogen 3.013 N/A ARG 101.A N ILE 97.A O no hydrogen 2.903 N/A ARG 101.A NE GLN 159.A OE1 no hydrogen 2.840 N/A ARG 101.A NH1 HIS 20.A ND1 no hydrogen 3.100 N/A ARG 101.A NH1 THR 23.A OG1 no hydrogen 2.801 N/A ARG 101.A NH2 THR 23.A O no hydrogen 2.807 N/A ALA 102.A N MET 98.A O no hydrogen 3.026 N/A ALA 103.A N SER 99.A O no hydrogen 2.808 N/A VAL 104.A N LEU 100.A O no hydrogen 2.988 N/A ARG 105.A N ALA 102.A O no hydrogen 3.208 N/A TYR 106.A N ALA 103.A O no hydrogen 3.013 N/A ASP 107.A N THR 112.A O no hydrogen 3.066 N/A GLU 109.A N ASP 107.A OD1 no hydrogen 3.328 N/A SER 110.A OG ASP 107.A OD2 no hydrogen 2.659 N/A SER 110.A OG THR 112.A OG1 no hydrogen 3.065 N/A THR 112.A N ASP 107.A O no hydrogen 3.398 N/A THR 112.A OG1 SER 110.A OG no hydrogen 3.065 N/A LEU 113.A N VAL 121.A O no hydrogen 2.926 N/A LEU 115.A N MET 119.A O no hydrogen 2.678 N/A ASN 116.A ND2 ILE 60.A O no hydrogen 2.727 N/A GLY 117.A N THR 114.A O no hydrogen 3.216 N/A GLU 118.A N LEU 115.A O no hydrogen 3.041 N/A MET 119.A N LEU 115.A O no hydrogen 3.123 N/A ALA 120.A N LYS 35.A O no hydrogen 2.887 N/A VAL 121.A N LEU 113.A O no hydrogen 3.062 N/A THR 122.A N GLN 125.A OE1 no hydrogen 2.791 N/A ARG 123.A NE ASP 136.A OD1 no hydrogen 2.668 N/A GLN 125.A N THR 122.A OG1 no hydrogen 3.179 N/A GLN 125.A NE2 LEU 37.A O no hydrogen 2.943 N/A GLN 125.A NE2 ILE 41.A O no hydrogen 3.206 N/A LEU 126.A N THR 122.A O no hydrogen 3.107 N/A LYS 127.A N ARG 123.A O no hydrogen 3.066 N/A LYS 127.A NZ ASP 136.A OD1 no hydrogen 3.187 N/A LYS 127.A NZ ASP 136.A OD2 no hydrogen 2.767 N/A ASN 128.A N GLY 124.A O no hydrogen 2.861 N/A ASN 128.A ND2 GLY 42.A O no hydrogen 3.162 N/A GLY 130.A N LYS 127.A O no hydrogen 3.059 N/A LEU 131.A N LEU 126.A O no hydrogen 3.304 N/A GLY 132.A N LYS 127.A O no hydrogen 2.991 N/A VAL 134.A N LEU 131.A O no hydrogen 2.968 N/A SER 135.A N GLY 132.A O no hydrogen 3.157 N/A SER 135.A OG ARG 123.A O no hydrogen 3.010 N/A ASP 136.A N VAL 133.A O no hydrogen 2.739 N/A ALA 137.A N VAL 133.A O no hydrogen 3.149 N/A ILE 138.A N VAL 134.A O no hydrogen 2.977 N/A PHE 139.A N SER 135.A O no hydrogen 2.952 N/A ARG 140.A N ASP 136.A O no hydrogen 2.874 N/A LEU 141.A N ALA 137.A O no hydrogen 3.059 N/A GLY 142.A N ILE 138.A O no hydrogen 2.974 N/A MET 143.A N PHE 139.A O no hydrogen 2.961 N/A SER 144.A N ARG 140.A O no hydrogen 3.067 N/A SER 144.A OG LEU 141.A O no hydrogen 3.004 N/A LEU 145.A N LEU 141.A O no hydrogen 3.085 N/A SER 146.A OG GLY 142.A O no hydrogen 3.563 N/A PHE 148.A N LEU 145.A O no hydrogen 3.167 N/A ASN 149.A N SER 146.A O no hydrogen 3.224 N/A ASP 151.A N GLU 154.A OE1 no hydrogen 2.784 N/A THR 153.A OG1 THR 17.A OG1 no hydrogen 2.949 N/A GLU 154.A N ASP 151.A OD1 no hydrogen 2.694 N/A VAL 155.A N ASP 151.A O no hydrogen 3.113 N/A ALA 156.A N ASP 152.A O no hydrogen 2.813 N/A LEU 157.A N THR 153.A O no hydrogen 2.811 N/A LEU 158.A N GLU 154.A O no hydrogen 2.914 N/A GLN 159.A N VAL 155.A O no hydrogen 2.796 N/A GLN 159.A NE2 HIS 20.A ND1 no hydrogen 3.205 N/A ALA 160.A N ALA 156.A O no hydrogen 2.844 N/A VAL 161.A N LEU 157.A O no hydrogen 2.927 N/A LEU 162.A N LEU 158.A O no hydrogen 3.066 N/A LEU 163.A N GLN 159.A O no hydrogen 2.870 N/A MET 164.A N ALA 160.A O no hydrogen 2.983 N/A SER 165.A N LEU 163.A O no hydrogen 2.798 N/A SER 165.A OG LEU 162.A O no hydrogen 2.778 N/A ARG 168.A NH1 GLU 96.A OE2 no hydrogen 3.271 N/A ARG 168.A NH2 GLU 96.A OE1 no hydrogen 2.837 N/A ARG 168.A NH2 GLU 96.A OE2 no hydrogen 3.075 N/A ARG 168.A NH2 LEU 162.A O no hydrogen 3.294 N/A LEU 171.A N ARG 168.A O no hydrogen 3.246 N/A ALA 172.A N ASP 85.A OD1 no hydrogen 2.937 N/A CYS 173.A N ASP 85.A OD2 no hydrogen 2.953 N/A ARG 176.A NE TYR 180.A OH no hydrogen 2.891 N/A ILE 177.A N CYS 173.A O no hydrogen 2.983 N/A GLU 178.A N VAL 174.A O no hydrogen 3.052 N/A LYS 179.A N GLU 175.A O no hydrogen 3.007 N/A TYR 180.A N ARG 176.A O no hydrogen 3.175 N/A GLN 181.A N ILE 177.A O no hydrogen 2.949 N/A ASP 182.A N GLU 178.A O no hydrogen 3.094 N/A SER 183.A N LYS 179.A O no hydrogen 3.205 N/A SER 183.A OG LYS 179.A O no hydrogen 3.494 N/A PHE 184.A N TYR 180.A O no hydrogen 3.271 N/A LEU 185.A N GLN 181.A O no hydrogen 2.875 N/A LEU 186.A N ASP 182.A O no hydrogen 2.802 N/A ALA 187.A N SER 183.A O no hydrogen 3.212 N/A PHE 188.A N PHE 184.A O no hydrogen 2.720 N/A GLU 189.A N LEU 185.A O no hydrogen 2.599 N/A HIS 190.A N LEU 186.A O no hydrogen 2.870 N/A HIS 190.A ND1 GLU 9.A OE1 no hydrogen 2.559 N/A TYR 191.A N ALA 187.A O no hydrogen 2.838 N/A TYR 191.A OH ASP 151.A OD2 no hydrogen 2.568 N/A ILE 192.A N PHE 188.A O no hydrogen 2.851 N/A ASN 193.A N GLU 189.A O no hydrogen 3.383 N/A ASN 193.A ND2 PRO 3.A O no hydrogen 2.824 N/A TYR 194.A N HIS 190.A O no hydrogen 3.196 N/A ARG 195.A N TYR 191.A O no hydrogen 3.016 N/A ARG 195.A NE GLU 154.A OE2 no hydrogen 3.363 N/A ARG 195.A NH1 GLU 154.A OE1 no hydrogen 3.322 N/A LYS 196.A N ILE 192.A O no hydrogen 3.035 N/A LYS 196.A NZ TYR 194.A O no hydrogen 2.790 N/A HIS 197.A NE2 GLU 154.A OE2 no hydrogen 2.670 N/A LYS 205.A N HIS 201.A O no hydrogen 3.127 N/A LYS 205.A NZ THR 200.A O no hydrogen 2.707 N/A LEU 206.A N PHE 202.A O no hydrogen 2.895 N/A LEU 207.A N TRP 203.A O no hydrogen 3.003 N/A MET 208.A N PRO 204.A O no hydrogen 3.134 N/A LYS 209.A N LYS 205.A O no hydrogen 3.260 N/A LYS 209.A N LEU 206.A O no hydrogen 2.747 N/A VAL 210.A N LEU 207.A O no hydrogen 3.121 N/A THR 211.A N MET 208.A O no hydrogen 2.943 N/A ASP 212.A N MET 208.A O no hydrogen 3.183 N/A LEU 213.A N LYS 209.A O no hydrogen 2.918 N/A ARG 214.A N VAL 210.A O no hydrogen 3.139 N/A ARG 214.A NH1 ASP 167.A OD1 no hydrogen 3.123 N/A ARG 214.A NH2 ASP 167.A OD1 no hydrogen 2.786 N/A MET 215.A N THR 211.A O no hydrogen 3.167 N/A ILE 216.A N ASP 212.A O no hydrogen 2.905 N/A GLY 217.A N LEU 213.A O no hydrogen 3.002 N/A ALA 218.A N ARG 214.A O no hydrogen 3.134 N/A CYS 219.A N MET 215.A O no hydrogen 2.790 N/A CYS 219.A SG MET 215.A O no hydrogen 3.503 N/A HIS 220.A N ILE 216.A O no hydrogen 3.092 N/A ALA 221.A N ALA 218.A O no hydrogen 2.947 N/A SER 222.A N ALA 218.A O no hydrogen 3.344 N/A SER 222.A OG CYS 219.A O no hydrogen 2.927 N/A ARG 223.A N CYS 219.A O no hydrogen 3.020 N/A ARG 223.A NE GLY 130.A O no hydrogen 2.967 N/A PHE 224.A N HIS 220.A O no hydrogen 2.765 N/A PHE 224.A N ALA 221.A O no hydrogen 3.209 N/A HIS 226.A N ARG 223.A O no hydrogen 3.293 N/A MET 227.A N ARG 223.A O no hydrogen 3.411 N/A LYS 228.A N PHE 224.A O no hydrogen 3.174 N/A VAL 229.A N HIS 226.A O no hydrogen 3.214 N/A GLU 230.A N HIS 226.A O no hydrogen 3.009 N/A CYS 231.A N MET 227.A O no hydrogen 2.810 N/A LEU 235.A N PRO 232.A O no hydrogen 3.125 N/A PHE 236.A N THR 233.A O no hydrogen 2.963 N/A PHE 240.A N PRO 237.A O no hydrogen 2.957 N/A LEU 241.A N PRO 237.A O no hydrogen 3.061 N/A LEU 241.A N PRO 238.A O no hydrogen 3.160 N/A GLU 242.A N PRO 238.A O no hydrogen 3.225 N/A VAL 243.A N LEU 239.A O no hydrogen 3.252 N/A GLU 245.A N GLU 242.A O no hydrogen 3.129 N/A