Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1pkq_B.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): LYS 3.A N THR 25.A O no hydrogen 2.895 N/A HIS 5.A N LYS 23.A O no hydrogen 2.693 N/A SER 7.A N SER 21.A O no hydrogen 2.931 N/A SER 7.A OG SER 21.A OG no hydrogen 3.288 N/A VAL 12.A N THR 115.A O no hydrogen 3.189 N/A LYS 13.A NZ SER 117.A O no hydrogen 3.026 N/A LYS 13.A NZ ALA 119.A O no hydrogen 2.757 N/A GLY 15.A N LEU 86C.A O no hydrogen 2.964 N/A VAL 18.A N LEU 83.A O no hydrogen 2.911 N/A SER 21.A N SER 7.A O no hydrogen 2.696 N/A SER 21.A OG SER 7.A O no hydrogen 3.338 N/A SER 21.A OG SER 7.A OG no hydrogen 3.288 N/A CYS 22.A N ALA 79.A O no hydrogen 2.712 N/A LYS 23.A N HIS 5.A O no hydrogen 2.637 N/A ALA 24.A N ASN 77.A O no hydrogen 2.994 N/A THR 25.A N LYS 3.A O no hydrogen 3.000 N/A THR 25.A OG1 LYS 3.A O no hydrogen 3.334 N/A SER 30.A OG PRO 53A.A O no hydrogen 2.626 N/A SER 31.A N THR 28.A O no hydrogen 3.129 N/A ILE 34.A N ILE 51.A O no hydrogen 2.854 N/A GLU 35.A N ALA 97.A O no hydrogen 2.505 N/A TRP 36.A N GLY 49.A O no hydrogen 3.084 N/A VAL 37.A N TYR 95.A O no hydrogen 2.971 N/A LYS 38.A N GLU 46.A O no hydrogen 2.830 N/A LYS 38.A NZ ASP 90.A OD2 no hydrogen 3.526 N/A GLN 39.A N VAL 93.A O no hydrogen 3.112 N/A HIS 43.A N ARG 40.A O no hydrogen 2.565 N/A GLU 46.A N LYS 38.A O no hydrogen 2.709 N/A TRP 47.A NE1 GLU 35.A OE1 no hydrogen 3.226 N/A ILE 48.A N TRP 36.A O no hydrogen 2.742 N/A GLU 50.A N ASN 59.A O no hydrogen 3.006 N/A ILE 51.A N ILE 34.A O no hydrogen 2.951 N/A LEU 52.A N ARG 57.A O no hydrogen 3.025 N/A ARG 55.A NH1 SER 30.A OG no hydrogen 3.257 N/A ARG 55.A NH1 SER 31.A OG no hydrogen 3.188 N/A ARG 55.A NH2 SER 31.A OG no hydrogen 3.246 N/A GLY 56.A N LEU 52.A O no hydrogen 2.779 N/A ASN 59.A N GLU 50.A O no hydrogen 3.375 N/A ASN 61.A N ILE 48.A O no hydrogen 2.650 N/A ASN 61.A ND2 TRP 47.A O no hydrogen 3.096 N/A LYS 63.A N ASN 61.A OD1 no hydrogen 3.077 N/A LYS 63.A NZ GLU 46.A OE2 no hydrogen 3.320 N/A PHE 64.A N ASN 61.A O no hydrogen 2.886 N/A LYS 65.A N GLU 62.A O no hydrogen 2.987 N/A LYS 67.A NZ ASP 90.A OD1 no hydrogen 2.679 N/A LYS 67.A NZ SER 84A.A O no hydrogen 2.866 N/A LYS 67.A NZ SER 85B.A O no hydrogen 2.541 N/A ALA 68.A N PHE 64.A O no hydrogen 2.890 N/A PHE 70.A N TYR 60.A OH no hydrogen 3.296 N/A THR 71.A N TYR 80.A O no hydrogen 3.156 N/A GLU 73.A N THR 78.A O no hydrogen 3.012 N/A SER 76.A N GLU 73.A O no hydrogen 2.848 N/A SER 76.A OG GLU 73.A O no hydrogen 3.316 N/A SER 76.A OG GLU 73.A OE1 no hydrogen 2.838 N/A SER 76.A OG THR 78.A OG1 no hydrogen 3.099 N/A ASN 77.A N THR 74.A O no hydrogen 3.171 N/A ASN 77.A ND2 ALA 24.A O no hydrogen 3.567 N/A THR 78.A OG1 SER 76.A O no hydrogen 3.102 N/A THR 78.A OG1 SER 76.A OG no hydrogen 3.099 N/A ALA 79.A N CYS 22.A O no hydrogen 2.788 N/A TYR 80.A N THR 71.A O no hydrogen 2.618 N/A TYR 80.A OH GLU 73.A OE1 no hydrogen 2.856 N/A MET 81.A N ILE 20.A O no hydrogen 2.999 N/A GLN 82.A N THR 69.A O no hydrogen 2.835 N/A GLN 82.A NE2 GLU 19.A OE2 no hydrogen 3.409 N/A LEU 83.A N VAL 18.A O no hydrogen 2.784 N/A THR 87.A N ASP 90.A OD1 no hydrogen 2.481 N/A ASP 90.A N THR 87.A O no hydrogen 2.634 N/A SER 91.A N SER 88.A O no hydrogen 2.668 N/A ALA 92.A N VAL 114.A O no hydrogen 2.749 N/A VAL 93.A N GLN 39.A O no hydrogen 2.939 N/A TYR 94.A N THR 112.A O no hydrogen 3.131 N/A TYR 94.A OH ASP 90.A O no hydrogen 2.931 N/A TYR 95.A N VAL 37.A O no hydrogen 2.732 N/A ALA 97.A N GLU 35.A O no hydrogen 2.707 N/A THR 98.A N TYR 107.A O no hydrogen 3.048 N/A THR 98.A OG1 TRP 33.A O no hydrogen 3.429 N/A ASN 100.A N VAL 103.A O no hydrogen 2.680 N/A ASN 104.A N ASN 104.A OD1 no hydrogen 2.459 N/A TYR 107.A N THR 98.A O no hydrogen 3.307 N/A TRP 108.A NE1 MET 105A.A O no hydrogen 3.148 N/A GLY 109.A N CYS 96.A O no hydrogen 3.131 N/A GLN 110.A NE2 GLU 6.A O no hydrogen 2.703 N/A GLN 110.A NE2 GLY 111.A O no hydrogen 3.281 N/A GLY 111.A N GLU 6.A OE2 no hydrogen 2.411 N/A THR 112.A N TYR 94.A O no hydrogen 3.315 N/A VAL 114.A N ALA 92.A O no hydrogen 2.872 N/A THR 115.A N GLY 10.A O no hydrogen 3.232 N/A VAL 116.A N SER 91.A OG no hydrogen 2.895 N/A SER 117.A N VAL 12.A O no hydrogen 2.933 N/A THR 121.A OG1 PRO 207.A O no hydrogen 2.966 N/A LYS 122.A N PHE 151.A O no hydrogen 2.925 N/A SER 125.A N LYS 148.A O no hydrogen 2.911 N/A PHE 127.A N LEU 146.A O no hydrogen 2.996 N/A LEU 129.A N GLY 144.A O no hydrogen 2.558 N/A SER 135.A N SER 132.A O no hydrogen 3.220 N/A SER 135.A OG ALA 142.A O no hydrogen 2.169 N/A THR 136.A N SER 133.A O no hydrogen 3.333 N/A THR 136.A OG1 SER 132.A O no hydrogen 2.489 N/A SER 137.A N THR 140.A O no hydrogen 2.755 N/A THR 140.A N SER 137.A O no hydrogen 2.953 N/A ALA 141.A N VAL 189.A O no hydrogen 2.523 N/A ALA 142.A N SER 135.A O no hydrogen 2.896 N/A LEU 143.A N VAL 187.A O no hydrogen 3.133 N/A CYS 145.A N SER 185.A O no hydrogen 2.786 N/A VAL 147.A N LEU 183.A O no hydrogen 2.535 N/A LYS 148.A N SER 125.A O no hydrogen 2.768 N/A TYR 150.A N TYR 181.A O no hydrogen 3.230 N/A PHE 151.A N LYS 122.A O no hydrogen 3.429 N/A THR 156.A N ASN 204.A O no hydrogen 2.742 N/A SER 158.A N ASN 202.A O no hydrogen 2.965 N/A TRP 159.A NE1 SER 185.A OG no hydrogen 3.173 N/A ASN 160.A N ILE 200.A O no hydrogen 2.800 N/A GLY 162.A N TRP 159.A O no hydrogen 3.149 N/A ALA 163.A N ASN 160.A O no hydrogen 3.158 N/A VAL 168.A N THR 165.A O no hydrogen 3.349 N/A HIS 169.A N VAL 186.A O no hydrogen 2.774 N/A THR 170.A OG1 SER 185.A OG no hydrogen 3.349 N/A PHE 171.A N SER 184.A O no hydrogen 3.103 N/A GLN 176.A N LEU 180.A O no hydrogen 2.857 N/A GLY 179.A N GLN 176.A O no hydrogen 2.697 N/A TYR 181.A N TYR 150.A O no hydrogen 2.744 N/A SER 182.A N VAL 174.A O no hydrogen 3.227 N/A LEU 183.A N VAL 147.A O no hydrogen 2.686 N/A SER 185.A N CYS 145.A O no hydrogen 2.779 N/A SER 185.A OG THR 170.A OG1 no hydrogen 3.349 N/A VAL 186.A N HIS 169.A O no hydrogen 2.854 N/A VAL 187.A N LEU 143.A O no hydrogen 3.448 N/A VAL 189.A N ALA 141.A O no hydrogen 2.574 N/A SER 191.A N GLY 139.A O no hydrogen 2.796 N/A SER 191.A OG GLY 138.A O no hydrogen 3.503 N/A SER 193.A OG PRO 190.A O no hydrogen 2.375 N/A SER 193.A OG TYR 199.A OH no hydrogen 3.008 N/A LEU 194.A N PRO 190.A O no hydrogen 3.376 N/A GLY 195.A N SER 192.A O no hydrogen 3.081 N/A THR 196.A N SER 193.A O no hydrogen 2.808 N/A GLN 197.A N SER 193.A O no hydrogen 2.905 N/A TYR 199.A OH SER 193.A OG no hydrogen 3.008 N/A ILE 200.A N ASN 160.A OD1 no hydrogen 3.207 N/A CYS 201.A N LYS 214.A O no hydrogen 3.152 N/A CYS 201.A SG LYS 214.A O no hydrogen 3.731 N/A ASN 202.A N SER 158.A O no hydrogen 2.385 N/A ASN 202.A ND2 SER 158.A OG no hydrogen 2.990 N/A VAL 203.A N VAL 212.A O no hydrogen 2.927 N/A HIS 205.A N THR 210.A O no hydrogen 2.889 N/A HIS 205.A NE2 PRO 152.A O no hydrogen 2.964 N/A SER 208.A N HIS 205.A O no hydrogen 2.891 N/A SER 208.A OG THR 210.A OG1 no hydrogen 2.259 N/A ASN 209.A N LYS 206.A O no hydrogen 2.692 N/A THR 210.A OG1 SER 208.A OG no hydrogen 2.259 N/A LYS 214.A N CYS 201.A O no hydrogen 3.381 N/A VAL 216.A N TYR 199.A O no hydrogen 2.870 N/A SER 84A.A N LYS 67.A O no hydrogen 2.991 N/A SER 84A.A OG GLY 66.A O no hydrogen 3.456 N/A SER 84A.A OG LYS 67.A O no hydrogen 2.853 N/A LEU 86C.A N ALA 16.A O no hydrogen 3.106 N/A