Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 2wth_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ARG 4.A NE TYR 83.A O no hydrogen 3.112 N/A ARG 4.A NH1 GLU 141.A OE1 no hydrogen 3.169 N/A ARG 4.A NH2 TYR 83.A O no hydrogen 3.419 N/A ARG 4.A NH2 GLU 141.A OE1 no hydrogen 3.236 N/A GLN 5.A NE2 ASP 9.A OD1 no hydrogen 2.969 N/A GLU 6.A N ASN 3.A O no hydrogen 3.214 N/A ILE 7.A N ASN 3.A O no hydrogen 3.310 N/A SER 8.A N ARG 4.A O no hydrogen 3.535 N/A SER 8.A OG ALA 80.A O no hydrogen 3.199 N/A ASP 9.A N GLN 5.A O no hydrogen 3.491 N/A LEU 10.A N GLU 6.A O no hydrogen 3.220 N/A CYS 11.A N ILE 7.A O no hydrogen 2.840 N/A CYS 11.A SG ILE 7.A O no hydrogen 3.432 N/A VAL 12.A N SER 8.A O no hydrogen 2.850 N/A LYS 13.A N ASP 9.A O no hydrogen 2.956 N/A LYS 13.A NZ GLU 16.A OE1 no hydrogen 3.394 N/A LYS 13.A NZ GLU 16.A OE2 no hydrogen 2.691 N/A SER 14.A N LEU 10.A O no hydrogen 3.200 N/A SER 14.A OG LEU 10.A O no hydrogen 2.941 N/A SER 14.A OG CYS 11.A O no hydrogen 2.750 N/A LEU 15.A N VAL 12.A O no hydrogen 3.100 N/A GLU 16.A N LYS 13.A O no hydrogen 3.001 N/A ARG 18.A N LEU 15.A O no hydrogen 2.774 N/A ARG 18.A NE GLY 17.A O no hydrogen 3.322 N/A GLY 21.A N GLN 70.A OE1 no hydrogen 3.158 N/A GLN 25.A NE2 GLN 25.A O no hydrogen 3.124 N/A GLN 25.A NE2 ASN 29.A OD1 no hydrogen 3.246 N/A ILE 27.A N GLU 23.A O no hydrogen 2.770 N/A GLU 28.A N GLN 25.A O no hydrogen 3.133 N/A ASN 29.A N GLN 25.A O no hydrogen 3.292 N/A ASN 29.A ND2 MET 19.A O no hydrogen 3.114 N/A ASN 31.A N ILE 27.A O no hydrogen 3.049 N/A ASN 31.A ND2 VAL 59.A O no hydrogen 2.835 N/A ALA 32.A N GLU 28.A O no hydrogen 2.652 N/A PHE 33.A N ASN 29.A O no hydrogen 3.346 N/A PHE 33.A N GLY 30.A O no hydrogen 3.260 N/A ARG 35.A N ASN 31.A O no hydrogen 3.231 N/A ARG 35.A NH1 GLU 28.A OE1 no hydrogen 3.363 N/A ARG 35.A NH1 GLU 28.A OE2 no hydrogen 2.797 N/A ARG 35.A NH1 ASN 31.A OD1 no hydrogen 2.751 N/A ARG 35.A NH2 GLU 28.A OE2 no hydrogen 2.684 N/A TYR 36.A N ALA 32.A O no hydrogen 3.037 N/A PHE 37.A N PHE 33.A O no hydrogen 2.798 N/A PHE 38.A N TYR 34.A O no hydrogen 2.701 N/A THR 39.A N ARG 35.A O no hydrogen 3.008 N/A THR 39.A OG1 ARG 35.A O no hydrogen 2.544 N/A ASN 40.A N TYR 36.A O no hydrogen 3.089 N/A PHE 41.A N PHE 37.A O no hydrogen 2.983 N/A LEU 44.A N PHE 41.A O no hydrogen 3.062 N/A ARG 45.A N PRO 42.A O no hydrogen 3.224 N/A ARG 45.A NE PRO 42.A O no hydrogen 2.900 N/A ARG 45.A NH1 TYR 54.A O no hydrogen 2.758 N/A PHE 48.A N ARG 45.A O no hydrogen 2.983 N/A GLY 50.A N GLU 52.A OE1 no hydrogen 2.768 N/A ALA 51.A N PHE 48.A O no hydrogen 2.835 N/A TYR 54.A N ALA 51.A O no hydrogen 2.801 N/A ASP 57.A N THR 55.A OG1 no hydrogen 3.358 N/A VAL 59.A N THR 55.A O no hydrogen 3.259 N/A LYS 60.A N ALA 56.A O no hydrogen 3.141 N/A LYS 61.A N ASP 57.A O no hydrogen 3.032 N/A SER 62.A N VAL 59.A O no hydrogen 3.145 N/A ARG 64.A NH1 LYS 49.A O no hydrogen 2.975 N/A ARG 64.A NH2 LYS 49.A O no hydrogen 3.275 N/A LYS 67.A N GLU 63.A O no hydrogen 3.068 N/A GLN 68.A N ARG 64.A O no hydrogen 2.865 N/A GLN 68.A NE2 TYR 34.A OH no hydrogen 3.455 N/A GLY 69.A N PHE 65.A O no hydrogen 2.853 N/A GLN 70.A NE2 ASN 26.A O no hydrogen 3.112 N/A ARG 71.A N LYS 67.A O no hydrogen 3.169 N/A ILE 72.A N GLN 68.A O no hydrogen 3.123 N/A LEU 73.A N GLY 69.A O no hydrogen 3.296 N/A LEU 74.A N GLN 70.A O no hydrogen 3.315 N/A ALA 75.A N ARG 71.A O no hydrogen 3.000 N/A ALA 75.A N ILE 72.A O no hydrogen 3.054 N/A CYS 76.A N ILE 72.A O no hydrogen 2.941 N/A CYS 76.A SG ILE 72.A O no hydrogen 3.154 N/A HIS 77.A N LEU 73.A O no hydrogen 3.190 N/A HIS 77.A ND1 LEU 73.A O no hydrogen 2.667 N/A LEU 78.A N LEU 74.A O no hydrogen 3.288 N/A LEU 79.A N ALA 75.A O no hydrogen 3.067 N/A ALA 80.A N CYS 76.A O no hydrogen 3.232 N/A ASN 81.A N HIS 77.A O no hydrogen 2.972 N/A ASN 81.A ND2 HIS 77.A O no hydrogen 2.831 N/A TYR 83.A N LEU 79.A O no hydrogen 3.257 N/A ASN 85.A N VAL 82.A O no hydrogen 2.719 N/A PHE 89.A N ASN 85.A O no hydrogen 2.929 N/A LYS 90.A N GLU 86.A O no hydrogen 2.832 N/A GLY 91.A N GLU 87.A O no hydrogen 2.959 N/A TYR 92.A N VAL 88.A O no hydrogen 2.876 N/A VAL 93.A N PHE 89.A O no hydrogen 3.149 N/A ARG 94.A N LYS 90.A O no hydrogen 3.099 N/A GLU 95.A N GLY 91.A O no hydrogen 3.196 N/A THR 96.A N TYR 92.A O no hydrogen 2.902 N/A THR 96.A OG1 TYR 92.A O no hydrogen 3.135 N/A ILE 97.A N VAL 93.A O no hydrogen 2.821 N/A ASN 98.A N ARG 94.A O no hydrogen 3.048 N/A ARG 99.A N GLU 95.A O no hydrogen 2.998 N/A HIS 100.A N ILE 97.A O no hydrogen 3.043 N/A HIS 100.A ND1 THR 96.A O no hydrogen 2.617 N/A ARG 101.A N ASN 98.A O no hydrogen 3.105 N/A TYR 103.A N HIS 100.A O no hydrogen 3.062 N/A LYS 104.A N ARG 101.A O no hydrogen 2.934 N/A ASP 106.A N TYR 47.A OH no hydrogen 3.067 N/A ALA 108.A N ASP 106.A O no hydrogen 2.668 N/A LEU 109.A N ASP 106.A O no hydrogen 2.996 N/A MET 111.A N ALA 108.A O no hydrogen 3.254 N/A ALA 112.A N ALA 108.A O no hydrogen 3.361 N/A PHE 113.A N LEU 109.A O no hydrogen 2.915 N/A PHE 114.A N MET 111.A O no hydrogen 3.350 N/A THR 115.A OG1 ALA 112.A O no hydrogen 3.447 N/A VAL 116.A N ALA 112.A O no hydrogen 3.219 N/A PHE 117.A N PHE 113.A O no hydrogen 2.640 N/A THR 118.A N PHE 114.A O no hydrogen 2.759 N/A THR 118.A OG1 PHE 114.A O no hydrogen 2.583 N/A THR 118.A OG1 THR 115.A O no hydrogen 3.251 N/A GLY 119.A N THR 115.A O no hydrogen 2.843 N/A TYR 120.A N PHE 117.A O no hydrogen 2.993 N/A LEU 121.A N PHE 117.A O no hydrogen 2.860 N/A GLU 122.A N THR 118.A O no hydrogen 2.751 N/A SER 123.A N TYR 120.A O no hydrogen 2.968 N/A VAL 124.A N TYR 120.A O no hydrogen 3.062 N/A GLN 131.A N ASN 128.A OD1 no hydrogen 2.717 N/A LYS 132.A N ASN 128.A O no hydrogen 2.827 N/A ALA 133.A N ASP 129.A O no hydrogen 3.050 N/A ALA 134.A N GLN 130.A O no hydrogen 3.068 N/A TRP 135.A N GLN 131.A O no hydrogen 3.039 N/A MET 136.A N LYS 132.A O no hydrogen 3.167 N/A ALA 137.A N ALA 133.A O no hydrogen 2.755 N/A LEU 138.A N ALA 134.A O no hydrogen 2.731 N/A GLY 139.A N TRP 135.A O no hydrogen 2.682 N/A LYS 140.A N MET 136.A O no hydrogen 2.827 N/A GLU 141.A N ALA 137.A O no hydrogen 3.063 N/A PHE 142.A N LEU 138.A O no hydrogen 2.545 N/A ASN 143.A N GLY 139.A O no hydrogen 2.647 N/A ALA 144.A N LYS 140.A O no hydrogen 2.595 N/A GLU 145.A N GLU 141.A O no hydrogen 3.202 N/A SER 146.A N PHE 142.A O no hydrogen 2.699 N/A SER 146.A OG PHE 142.A O no hydrogen 2.703 N/A GLN 147.A N ASN 143.A O no hydrogen 2.953 N/A GLN 147.A NE2 PRO 107.A O no hydrogen 3.070 N/A GLN 147.A NE2 ASN 143.A OD1 no hydrogen 3.117 N/A THR 148.A N ALA 144.A O no hydrogen 3.432 N/A THR 148.A OG1 ALA 144.A O no hydrogen 3.397 N/A HIS 149.A N GLU 145.A O no hydrogen 2.841 N/A HIS 149.A NE2 ASN 98.A OD1 no hydrogen 2.826 N/A LEU 150.A N SER 146.A O no hydrogen 3.057 N/A LYS 151.A N GLN 147.A O no hydrogen 2.821 N/A ASN 152.A N THR 148.A O no hydrogen 2.970 N/A SER 153.A N HIS 149.A O no hydrogen 2.921 N/A SER 153.A OG HIS 149.A O no hydrogen 3.133 N/A LEU 155.A N LEU 150.A O no hydrogen 3.009 N/A VAL 158.A N GLN 147.A OE1 no hydrogen 2.630 N/A