Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3kkc_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ASP 6.A N ALA 3.A O no hydrogen 2.980 N/A GLN 8.A N LYS 5.A O no hydrogen 3.024 N/A GLN 8.A NE2 GLN 8.A O no hydrogen 3.334 N/A ILE 9.A N LYS 5.A O no hydrogen 2.961 N/A ILE 9.A N ASP 6.A O no hydrogen 2.757 N/A GLN 10.A N ASP 6.A O no hydrogen 2.899 N/A LYS 11.A N ARG 7.A O no hydrogen 3.362 N/A THR 12.A N GLN 8.A O no hydrogen 3.299 N/A THR 12.A OG1 GLN 8.A O no hydrogen 3.017 N/A THR 12.A OG1 ILE 9.A O no hydrogen 3.424 N/A LYS 13.A N ILE 9.A O no hydrogen 3.244 N/A VAL 14.A N GLN 10.A O no hydrogen 3.293 N/A ALA 15.A N LYS 11.A O no hydrogen 3.085 N/A ILE 16.A N THR 12.A O no hydrogen 3.399 N/A TYR 17.A N LYS 13.A O no hydrogen 3.093 N/A TYR 17.A OH ASP 65.A OD2 no hydrogen 2.526 N/A ASN 18.A N VAL 14.A O no hydrogen 2.797 N/A ALA 19.A N ALA 15.A O no hydrogen 2.909 N/A PHE 20.A N ILE 16.A O no hydrogen 2.839 N/A ILE 21.A N TYR 17.A O no hydrogen 3.189 N/A SER 22.A N ASN 18.A O no hydrogen 2.995 N/A LEU 23.A N ALA 19.A O no hydrogen 3.025 N/A LEU 24.A N PHE 20.A O no hydrogen 3.089 N/A LEU 24.A N ILE 21.A O no hydrogen 3.029 N/A GLN 25.A N SER 22.A O no hydrogen 3.356 N/A ASN 27.A N LEU 23.A O no hydrogen 3.027 N/A ASN 27.A ND2 LEU 23.A O no hydrogen 2.724 N/A LYS 31.A N ASP 28.A O no hydrogen 3.061 N/A LYS 31.A NZ ASN 27.A OD1 no hydrogen 2.459 N/A ILE 32.A N ASP 28.A O no hydrogen 3.138 N/A THR 33.A N ASP 36.A OD2 no hydrogen 3.246 N/A THR 33.A OG1 ASP 36.A OD1 no hydrogen 2.605 N/A ASP 36.A N THR 33.A O no hydrogen 2.578 N/A VAL 37.A N THR 33.A O no hydrogen 3.357 N/A ILE 38.A N VAL 34.A O no hydrogen 3.102 N/A GLY 39.A N GLN 35.A O no hydrogen 3.061 N/A ALA 41.A N VAL 37.A O no hydrogen 3.097 N/A ASN 42.A N ILE 38.A O no hydrogen 2.644 N/A ARG 45.A NH1 GLN 35.A OE1 no hydrogen 3.485 N/A ARG 45.A NH2 TYR 49.A OH no hydrogen 3.553 N/A THR 47.A OG1 GLY 44.A O no hydrogen 3.287 N/A PHE 48.A N GLY 44.A O no hydrogen 3.293 N/A TYR 49.A N ARG 45.A O no hydrogen 3.437 N/A SER 50.A N THR 47.A O no hydrogen 2.686 N/A SER 50.A OG THR 47.A O no hydrogen 2.645 N/A HIS 51.A N PHE 48.A O no hydrogen 2.805 N/A TYR 52.A N PHE 48.A O no hydrogen 3.028 N/A LYS 55.A NZ TYR 29.A O no hydrogen 2.755 N/A LYS 55.A NZ ILE 32.A O no hydrogen 2.539 N/A GLU 56.A N SER 54.A OG no hydrogen 3.155 N/A VAL 57.A N SER 54.A O no hydrogen 3.321 N/A LEU 58.A N LYS 55.A O no hydrogen 3.066 N/A LYS 60.A N GLU 56.A O no hydrogen 3.181 N/A GLU 61.A N VAL 57.A O no hydrogen 3.010 N/A LEU 62.A N LEU 58.A O no hydrogen 2.718 N/A CYS 63.A N LEU 59.A O no hydrogen 2.899 N/A CYS 63.A SG LEU 59.A O no hydrogen 3.250 N/A GLU 64.A N LYS 60.A O no hydrogen 2.669 N/A ASP 65.A N GLU 61.A O no hydrogen 2.783 N/A LEU 66.A N LEU 62.A O no hydrogen 2.701 N/A PHE 67.A N CYS 63.A O no hydrogen 2.757 N/A HIS 68.A N GLU 64.A O no hydrogen 2.978 N/A HIS 69.A N ASP 65.A O no hydrogen 3.025 N/A LEU 70.A N LEU 66.A O no hydrogen 3.130 N/A PHE 71.A N PHE 67.A O no hydrogen 3.130 N/A LYS 72.A NZ GLU 64.A O no hydrogen 3.506 N/A GLU 81.A N THR 78.A OG1 no hydrogen 3.061 N/A TYR 82.A N THR 78.A O no hydrogen 3.153 N/A TYR 82.A OH PHE 71.A O no hydrogen 3.163 N/A LEU 83.A N PHE 79.A O no hydrogen 3.076 N/A VAL 84.A N GLU 80.A O no hydrogen 2.870 N/A HIS 85.A N GLU 81.A O no hydrogen 2.896 N/A ILE 86.A N TYR 82.A O no hydrogen 3.202 N/A LEU 87.A N LEU 83.A O no hydrogen 2.988 N/A LYS 88.A N VAL 84.A O no hydrogen 2.691 N/A HIS 89.A N HIS 85.A O no hydrogen 3.191 N/A PHE 90.A N ILE 86.A O no hydrogen 3.415 N/A GLU 91.A N LEU 87.A O no hydrogen 3.215 N/A GLU 91.A N LYS 88.A O no hydrogen 3.277 N/A GLN 92.A NE2 LYS 88.A O no hydrogen 3.478 N/A ASN 93.A N PHE 90.A O no hydrogen 3.029 N/A ASN 93.A ND2 THR 99.A OG1 no hydrogen 2.741 N/A GLN 94.A N HIS 89.A O no hydrogen 2.953 N/A SER 96.A N ASN 93.A O no hydrogen 2.843 N/A SER 96.A OG ILE 21.A O no hydrogen 2.591 N/A THR 99.A N ASN 93.A OD1 no hydrogen 3.109 N/A LEU 100.A N SER 96.A O no hydrogen 2.759 N/A LEU 101.A N ILE 97.A O no hydrogen 3.217 N/A LEU 102.A N ALA 98.A O no hydrogen 2.918 N/A SER 103.A OG LEU 100.A O no hydrogen 2.634 N/A ASP 104.A N LEU 101.A O no hydrogen 3.368 N/A ASP 105.A N SER 103.A OG no hydrogen 3.129 N/A PHE 108.A N ASP 105.A OD2 no hydrogen 2.881 N/A LEU 109.A N ASP 105.A O no hydrogen 3.033 N/A LEU 110.A N TYR 107.A O no hydrogen 3.278 N/A ARG 111.A N TYR 107.A O no hydrogen 3.171 N/A ARG 111.A NH1 GLU 115.A OE2 no hydrogen 3.362 N/A PHE 112.A N PHE 108.A O no hydrogen 3.073 N/A ARG 113.A N LEU 109.A O no hydrogen 3.249 N/A SER 114.A N LEU 110.A O no hydrogen 3.035 N/A GLU 115.A N ARG 111.A O no hydrogen 3.128 N/A GLU 115.A N PHE 112.A O no hydrogen 3.043 N/A LEU 116.A N PHE 112.A O no hydrogen 3.151 N/A GLU 117.A N ARG 113.A O no hydrogen 3.084 N/A HIS 118.A N GLU 115.A O no hydrogen 2.863 N/A ASP 119.A N GLU 115.A O no hydrogen 2.846 N/A VAL 120.A N LEU 116.A O no hydrogen 3.006 N/A TYR 121.A N LEU 116.A O no hydrogen 2.776 N/A TYR 121.A OH GLU 136.A OE1 no hydrogen 3.388 N/A LEU 124.A N VAL 120.A O no hydrogen 3.031 N/A ARG 125.A N TYR 121.A O no hydrogen 2.803 N/A ARG 125.A NE GLU 136.A OE1 no hydrogen 2.549 N/A ARG 125.A NH1 ARG 125.A O no hydrogen 3.498 N/A ARG 125.A NH2 GLU 136.A OE2 no hydrogen 3.111 N/A GLU 126.A N PRO 122.A O no hydrogen 3.238 N/A GLU 127.A N ARG 123.A O no hydrogen 3.015 N/A TYR 128.A N LEU 124.A O no hydrogen 3.116 N/A ILE 129.A N ARG 125.A O no hydrogen 3.253 N/A LEU 139.A N PRO 135.A O no hydrogen 3.271 N/A LYS 140.A N GLU 136.A O no hydrogen 2.756 N/A LYS 140.A NZ GLU 117.A OE1 no hydrogen 3.080 N/A GLN 141.A N ASP 137.A O no hydrogen 3.081 N/A PHE 142.A N PHE 138.A O no hydrogen 2.884 N/A LEU 143.A N LEU 139.A O no hydrogen 3.049 N/A LEU 143.A N LYS 140.A O no hydrogen 3.294 N/A LEU 144.A N LYS 140.A O no hydrogen 3.105 N/A SER 145.A N GLN 141.A O no hydrogen 3.248 N/A SER 146.A N PHE 142.A O no hydrogen 3.091 N/A SER 146.A OG PHE 142.A O no hydrogen 3.042 N/A SER 146.A OG LEU 143.A O no hydrogen 3.170 N/A PHE 147.A N LEU 143.A O no hydrogen 2.929 N/A ILE 148.A N LEU 144.A O no hydrogen 3.056 N/A GLU 149.A N SER 145.A O no hydrogen 2.959 N/A THR 150.A N SER 146.A O no hydrogen 2.888 N/A THR 150.A OG1 SER 146.A O no hydrogen 2.962 N/A LEU 151.A N PHE 147.A O no hydrogen 3.031 N/A LYS 152.A N ILE 148.A O no hydrogen 2.952 N/A LYS 152.A NZ GLU 149.A OE2 no hydrogen 3.154 N/A TRP 153.A N GLU 149.A O no hydrogen 3.065 N/A TRP 154.A N THR 150.A O no hydrogen 3.000 N/A LEU 155.A N LEU 151.A O no hydrogen 3.026 N/A HIS 156.A N LYS 152.A O no hydrogen 3.139 N/A HIS 156.A N TRP 153.A O no hydrogen 3.157 N/A GLN 157.A N TRP 154.A O no hydrogen 3.011 N/A ASP 164.A N THR 161.A OG1 no hydrogen 3.018 N/A LEU 165.A N THR 161.A O no hydrogen 3.091 N/A LEU 166.A N VAL 162.A O no hydrogen 2.893 N/A LYS 167.A N GLU 163.A O no hydrogen 2.950 N/A TYR 168.A N ASP 164.A O no hydrogen 2.879 N/A TYR 169.A N LEU 165.A O no hydrogen 2.964 N/A TYR 169.A OH LEU 143.A O no hydrogen 2.989 N/A LEU 170.A N LEU 166.A O no hydrogen 3.074 N/A THR 171.A N LYS 167.A O no hydrogen 2.916 N/A THR 171.A OG1 LYS 167.A O no hydrogen 3.261 N/A THR 171.A OG1 TYR 168.A O no hydrogen 3.397 N/A GLU 173.A N LEU 170.A O no hydrogen 2.906 N/A ARG 174.A N TYR 128.A O no hydrogen 2.886 N/A ARG 174.A NH1 ASP 133.A OD1 no hydrogen 2.525 N/A ARG 174.A NH2 ASP 133.A OD1 no hydrogen 3.288 N/A ARG 174.A NH2 ASP 133.A OD2 no hydrogen 3.150 N/A