Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3kyi_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): TRP 5.A N MET 1.A O no hydrogen 3.426 N/A ALA 6.A N ASP 2.A O no hydrogen 3.321 N/A LEU 7.A N GLU 3.A O no hydrogen 2.938 N/A TYR 8.A N ILE 4.A O no hydrogen 3.032 N/A TYR 8.A OH THR 100.A OG1 no hydrogen 3.041 N/A ALA 9.A N TRP 5.A O no hydrogen 3.055 N/A ASP 10.A N ALA 6.A O no hydrogen 3.084 N/A ASP 11.A N LEU 7.A O no hydrogen 2.801 N/A GLY 12.A N TYR 8.A O no hydrogen 2.947 N/A ALA 13.A N ALA 9.A O no hydrogen 3.212 N/A GLN 14.A N ASP 10.A O no hydrogen 2.960 N/A ALA 15.A N ASP 11.A O no hydrogen 2.947 N/A LEU 16.A N GLY 12.A O no hydrogen 2.946 N/A ASP 17.A N ALA 13.A O no hydrogen 2.774 N/A ALA 18.A N GLN 14.A O no hydrogen 3.411 N/A MET 19.A N ALA 15.A O no hydrogen 2.874 N/A GLU 20.A N LEU 16.A O no hydrogen 2.837 N/A ALA 21.A N ASP 17.A O no hydrogen 2.919 N/A SER 22.A N ALA 18.A O no hydrogen 3.193 N/A LEU 23.A N MET 19.A O no hydrogen 3.354 N/A LEU 24.A N GLU 20.A O no hydrogen 2.893 N/A ALA 25.A N ALA 21.A O no hydrogen 3.041 N/A LEU 26.A N SER 22.A O no hydrogen 3.090 N/A GLN 27.A N LEU 23.A O no hydrogen 2.948 N/A ALA 28.A N LEU 24.A O no hydrogen 2.925 N/A GLY 29.A N ALA 25.A O no hydrogen 3.188 N/A ALA 33.A N ASP 31.A OD2 no hydrogen 3.081 N/A HIS 35.A N ALA 32.A O no hydrogen 2.801 N/A HIS 35.A NE2 GLU 30.A OE1 no hydrogen 2.818 N/A VAL 36.A N ALA 32.A O no hydrogen 2.696 N/A LEU 39.A N HIS 35.A O no hydrogen 3.410 N/A PHE 40.A N VAL 36.A O no hydrogen 3.288 N/A ARG 41.A N GLY 37.A O no hydrogen 3.122 N/A ALA 42.A N PRO 38.A O no hydrogen 3.136 N/A VAL 43.A N LEU 39.A O no hydrogen 2.883 N/A THR 44.A OG1 ARG 41.A O no hydrogen 2.585 N/A PHE 45.A N ALA 42.A O no hydrogen 3.218 N/A LYS 46.A N VAL 43.A O no hydrogen 2.932 N/A LYS 46.A NZ GLU 65.A OE1 no hydrogen 3.186 N/A LYS 46.A NZ GLU 65.A OE2 no hydrogen 3.142 N/A ASN 48.A N THR 44.A O no hydrogen 3.147 N/A SER 49.A N PHE 45.A O no hydrogen 3.324 N/A SER 49.A OG PHE 45.A O no hydrogen 3.192 N/A SER 49.A OG LYS 46.A O no hydrogen 2.719 N/A ARG 50.A N LYS 46.A O no hydrogen 3.063 N/A VAL 51.A N GLY 47.A O no hydrogen 3.264 N/A LEU 52.A N ASN 48.A O no hydrogen 3.338 N/A GLY 53.A N ARG 50.A O no hydrogen 3.402 N/A LEU 54.A N SER 49.A O no hydrogen 2.760 N/A VAL 56.A N ASP 106.A OD2 no hydrogen 2.790 N/A GLU 58.A N LEU 54.A O no hydrogen 2.808 N/A SER 59.A N SER 55.A O no hydrogen 2.953 N/A SER 59.A OG SER 55.A O no hydrogen 3.288 N/A SER 59.A OG VAL 56.A O no hydrogen 2.614 N/A ARG 60.A N VAL 56.A O no hydrogen 3.130 N/A ARG 60.A NE SER 112.A OG no hydrogen 2.797 N/A ARG 60.A NH1 SER 59.A OG no hydrogen 3.355 N/A ALA 61.A N VAL 57.A O no hydrogen 3.171 N/A HIS 62.A N GLU 58.A O no hydrogen 2.884 N/A LEU 63.A N SER 59.A O no hydrogen 3.350 N/A CYS 64.A SG ARG 60.A O no hydrogen 3.322 N/A GLU 65.A N ALA 61.A O no hydrogen 3.119 N/A ASP 66.A N HIS 62.A O no hydrogen 3.057 N/A LEU 67.A N LEU 63.A O no hydrogen 3.194 N/A ILE 68.A N CYS 64.A O no hydrogen 3.030 N/A GLY 69.A N GLU 65.A O no hydrogen 2.837 N/A LEU 70.A N ASP 66.A O no hydrogen 2.964 N/A VAL 71.A N ILE 68.A O no hydrogen 3.059 N/A ARG 72.A N ILE 68.A O no hydrogen 2.970 N/A ARG 72.A NE ASP 73.A OD2 no hydrogen 2.880 N/A ASP 73.A N GLY 69.A O no hydrogen 2.796 N/A VAL 76.A N LEU 70.A O no hydrogen 3.029 N/A VAL 83.A N ASP 79.A O no hydrogen 3.367 N/A GLU 84.A N GLY 80.A O no hydrogen 2.904 N/A ILE 85.A N GLU 81.A O no hydrogen 2.992 N/A LEU 86.A N ILE 82.A O no hydrogen 3.125 N/A LEU 87.A N VAL 83.A O no hydrogen 2.831 N/A PHE 88.A N GLU 84.A O no hydrogen 3.087 N/A ALA 89.A N ILE 85.A O no hydrogen 2.802 N/A SER 90.A N LEU 86.A O no hydrogen 2.907 N/A ASP 91.A N LEU 87.A O no hydrogen 3.329 N/A THR 92.A N PHE 88.A O no hydrogen 3.046 N/A THR 92.A OG1 PHE 88.A O no hydrogen 2.726 N/A LEU 93.A N ALA 89.A O no hydrogen 2.763 N/A ARG 94.A N SER 90.A O no hydrogen 2.976 N/A ARG 94.A NH2 GLU 20.A OE1 no hydrogen 2.757 N/A ALA 95.A N ASP 91.A O no hydrogen 3.194 N/A MET 96.A N THR 92.A O no hydrogen 2.903 N/A LEU 97.A N LEU 93.A O no hydrogen 2.746 N/A GLU 98.A N ARG 94.A O no hydrogen 3.146 N/A GLU 99.A N ALA 95.A O no hydrogen 3.196 N/A THR 100.A N MET 96.A O no hydrogen 2.995 N/A THR 100.A OG1 TYR 8.A OH no hydrogen 3.041 N/A THR 100.A OG1 MET 96.A O no hydrogen 2.757 N/A THR 100.A OG1 LEU 97.A O no hydrogen 3.117 N/A ALA 101.A N LEU 97.A O no hydrogen 3.024 N/A ALA 102.A N GLU 98.A O no hydrogen 3.431 N/A SER 103.A N GLU 99.A O no hydrogen 3.001 N/A SER 103.A OG GLU 99.A O no hydrogen 2.813 N/A SER 103.A OG ALA 105.A O no hydrogen 3.246 N/A ARG 104.A N THR 100.A O no hydrogen 2.840 N/A ARG 104.A NH1 ASP 2.A OD1 no hydrogen 3.239 N/A VAL 107.A N ASP 106.A OD1 no hydrogen 2.912 N/A SER 112.A OG GLY 109.A O no hydrogen 3.099 N/A MET 116.A N SER 112.A O no hydrogen 3.253 N/A ASP 117.A N GLU 113.A O no hydrogen 3.336 N/A GLN 118.A N ALA 114.A O no hydrogen 2.982 N/A LEU 119.A N LEU 115.A O no hydrogen 2.841 N/A ARG 120.A N MET 116.A O no hydrogen 3.062 N/A SER 121.A N ASP 117.A O no hydrogen 2.842 N/A LYS 122.A N GLN 118.A O no hydrogen 3.495 N/A LYS 122.A NZ GLU 81.A OE1 no hydrogen 2.820 N/A ILE 123.A N LEU 119.A O no hydrogen 3.060 N/A ALA 124.A N ARG 120.A O no hydrogen 3.250 N/A ARG 125.A N SER 121.A O no hydrogen 3.150 N/A ARG 125.A NE SER 121.A O no hydrogen 3.094 N/A ARG 125.A NH1 GLU 81.A OE2 no hydrogen 2.877 N/A ARG 125.A NH2 GLU 81.A OE2 no hydrogen 3.129 N/A CYS 126.A N LYS 122.A O no hydrogen 2.849 N/A CYS 126.A SG LYS 122.A O no hydrogen 3.236 N/A SER 127.A N ILE 123.A O no hydrogen 3.118 N/A SER 127.A OG ILE 123.A O no hydrogen 3.104 N/A