Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4b1r_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): SER 1.A N LEU 33.A O no hydrogen 3.385 N/A SER 1.A OG LEU 33.A O no hydrogen 3.233 N/A ARG 5.A NH2 GLU 57.A OE2 no hydrogen 3.198 N/A SER 7.A OG ASN 4.A OD1 no hydrogen 2.611 N/A VAL 8.A N ASN 4.A O no hydrogen 2.980 N/A ILE 9.A N ARG 5.A O no hydrogen 2.928 N/A ASP 10.A N GLU 6.A O no hydrogen 2.910 N/A ALA 11.A N SER 7.A O no hydrogen 3.140 N/A ALA 12.A N VAL 8.A O no hydrogen 2.942 N/A LEU 13.A N ILE 9.A O no hydrogen 2.805 N/A GLU 14.A N ASP 10.A O no hydrogen 3.102 N/A LEU 15.A N ALA 11.A O no hydrogen 2.836 N/A LEU 16.A N ALA 12.A O no hydrogen 2.800 N/A ASN 17.A N LEU 13.A O no hydrogen 3.138 N/A GLU 18.A N GLU 14.A O no hydrogen 3.224 N/A THR 19.A N LEU 15.A O no hydrogen 2.719 N/A THR 19.A OG1 LEU 15.A O no hydrogen 3.083 N/A THR 19.A OG1 GLY 20.A O no hydrogen 2.708 N/A GLY 20.A N LEU 16.A O no hydrogen 2.777 N/A ILE 21.A N ASP 94.A OD2 no hydrogen 2.910 N/A LEU 24.A N ILE 21.A O no hydrogen 3.181 N/A LYS 28.A N THR 25.A OG1 no hydrogen 3.174 N/A LYS 28.A NZ GLY 23.A O no hydrogen 2.762 N/A LEU 29.A N THR 25.A O no hydrogen 3.022 N/A ALA 30.A N THR 26.A O no hydrogen 2.982 N/A GLN 31.A N ARG 27.A O no hydrogen 3.262 N/A LYS 32.A N LYS 28.A O no hydrogen 2.920 N/A LYS 32.A NZ GLU 14.A OE2 no hydrogen 3.294 N/A LYS 32.A NZ GLU 18.A OE1 no hydrogen 3.051 N/A LYS 32.A NZ GLU 18.A OE2 no hydrogen 2.738 N/A LEU 33.A N LEU 29.A O no hydrogen 2.935 N/A GLY 34.A N GLN 31.A O no hydrogen 3.020 N/A ILE 35.A N ALA 30.A O no hydrogen 2.984 N/A LEU 40.A N GLU 36.A O no hydrogen 3.094 N/A TYR 41.A N GLN 37.A O no hydrogen 2.906 N/A TRP 42.A N PRO 38.A O no hydrogen 3.387 N/A HIS 43.A N LEU 40.A O no hydrogen 2.827 N/A VAL 44.A N LEU 40.A O no hydrogen 2.782 N/A LYS 45.A NZ TYR 41.A O no hydrogen 2.781 N/A LYS 47.A NZ ILE 21.A O no hydrogen 2.596 N/A LYS 47.A NZ LEU 24.A O no hydrogen 2.745 N/A ARG 48.A NE ARG 48.A O no hydrogen 3.164 N/A ARG 48.A NE ASP 52.A OD1 no hydrogen 3.139 N/A ARG 48.A NH2 ASP 52.A OD1 no hydrogen 2.974 N/A ALA 49.A N ASN 46.A OD1 no hydrogen 2.895 N/A LEU 50.A N ASN 46.A O no hydrogen 3.184 N/A LEU 51.A N LYS 47.A O no hydrogen 2.852 N/A ASP 52.A N ARG 48.A O no hydrogen 2.869 N/A ALA 53.A N ALA 49.A O no hydrogen 3.011 N/A LEU 54.A N LEU 50.A O no hydrogen 2.821 N/A ALA 55.A N LEU 51.A O no hydrogen 2.981 N/A VAL 56.A N ASP 52.A O no hydrogen 3.346 N/A GLU 57.A N ALA 53.A O no hydrogen 2.937 N/A ILE 58.A N LEU 54.A O no hydrogen 2.709 N/A ALA 60.A N VAL 56.A O no hydrogen 2.966 N/A ARG 61.A N GLU 57.A O no hydrogen 2.771 N/A ARG 61.A NH1 ASP 10.A OD1 no hydrogen 2.588 N/A ARG 61.A NH2 GLU 6.A O no hydrogen 3.397 N/A ARG 61.A NH2 ASP 10.A OD1 no hydrogen 2.612 N/A HIS 62.A N ILE 58.A O no hydrogen 2.912 N/A HIS 62.A NE2 TYR 92.A OH no hydrogen 2.619 N/A HIS 63.A N LEU 59.A O no hydrogen 2.777 N/A HIS 63.A ND1 SER 84.A OG no hydrogen 2.826 N/A ASP 64.A N.A HIS 62.A O no hydrogen 3.066 N/A TYR 65.A N SER 84.A OG no hydrogen 2.996 N/A TYR 65.A OH GLU 72.A OE1 no hydrogen 2.765 N/A TYR 65.A OH GLU 72.A OE2 no hydrogen 3.202 N/A ALA 69.A N GLU 72.A OE1 no hydrogen 2.922 N/A GLU 72.A N ALA 69.A O no hydrogen 3.052 N/A GLN 75.A N GLN 75.A OE1 no hydrogen 2.778 N/A GLN 75.A NE2 GLU 188.A OE1 no hydrogen 2.979 N/A SER 76.A N SER 73.A OG no hydrogen 3.043 N/A SER 76.A OG GLU 72.A OE2 no hydrogen 2.761 N/A PHE 77.A N SER 73.A O no hydrogen 2.770 N/A LEU 78.A N TRP 74.A O no hydrogen 2.932 N/A ARG 79.A N GLN 75.A O no hydrogen 3.047 N/A ARG 79.A NE GLU 181.A OE2 no hydrogen 2.809 N/A ARG 79.A NH2 GLU 181.A OE1 no hydrogen 2.951 N/A ARG 79.A NH2 GLU 181.A OE2 no hydrogen 3.555 N/A ASN 80.A N SER 76.A O no hydrogen 2.864 N/A ASN 80.A ND2 GLU 72.A OE2 no hydrogen 2.876 N/A ASN 81.A N PHE 77.A O no hydrogen 2.730 N/A ASN 81.A ND2 TYR 65.A O no hydrogen 2.914 N/A ALA 82.A N LEU 78.A O no hydrogen 2.895 N/A MET 83.A N ARG 79.A O no hydrogen 3.096 N/A SER 84.A N ASN 80.A O no hydrogen 3.087 N/A SER 84.A OG HIS 63.A ND1 no hydrogen 2.826 N/A SER 84.A OG ASP 64.A OD1.B no hydrogen 3.113 N/A PHE 85.A N ASN 81.A O no hydrogen 3.005 N/A ARG 86.A N ALA 82.A O no hydrogen 3.001 N/A ARG 86.A NH2 ASP 171.A OD2 no hydrogen 3.291 N/A ARG 87.A N MET 83.A O no hydrogen 2.952 N/A ALA 88.A N SER 84.A O no hydrogen 2.886 N/A LEU 89.A N PHE 85.A O no hydrogen 2.944 N/A LEU 90.A N ARG 86.A O no hydrogen 2.992 N/A ARG 91.A N ALA 88.A O no hydrogen 3.322 N/A TYR 92.A OH HIS 62.A NE2 no hydrogen 2.619 N/A ARG 93.A N ASN 17.A OD1 no hydrogen 2.931 N/A GLY 95.A N TYR 92.A O no hydrogen 2.984 N/A ALA 96.A N GLN 148.A OE1 no hydrogen 2.914 N/A LYS 97.A NZ GLU 149.A OE2 no hydrogen 2.367 N/A VAL 98.A N ASP 94.A O no hydrogen 2.800 N/A ALA 99.A N GLY 95.A O no hydrogen 2.924 N/A LEU 100.A N ALA 96.A O no hydrogen 2.942 N/A THR 102.A N LEU 100.A O no hydrogen 2.755 N/A THR 102.A OG1 ALA 99.A O no hydrogen 2.872 N/A LYS 107.A N ASP 105.A OD2 no hydrogen 3.331 N/A GLN 108.A N ASP 105.A O no hydrogen 2.903 N/A TYR 109.A N ASP 105.A O no hydrogen 2.947 N/A VAL 112.A N GLN 108.A O no hydrogen 2.871 N/A GLU 113.A N TYR 109.A O no hydrogen 2.876 N/A THR 114.A N ASP 110.A O no hydrogen 3.310 N/A THR 114.A OG1 ASP 110.A O no hydrogen 2.639 N/A GLN 115.A N THR 111.A O no hydrogen 3.248 N/A GLN 115.A NE2 SER 66.A O no hydrogen 2.757 N/A LEU 116.A N VAL 112.A O no hydrogen 2.995 N/A ARG 117.A N.A GLU 113.A O no hydrogen 2.780 N/A ARG 117.A N.C GLU 113.A O no hydrogen 2.773 N/A PHE 118.A N THR 114.A O no hydrogen 2.770 N/A MET 119.A N GLN 115.A O no hydrogen 3.036 N/A THR 120.A N LEU 116.A O no hydrogen 3.028 N/A THR 120.A OG1 LEU 116.A O no hydrogen 3.455 N/A THR 120.A OG1 ARG 117.A O.A no hydrogen 2.561 N/A THR 120.A OG1 ARG 117.A O.C no hydrogen 2.539 N/A GLU 121.A N ARG 117.A O.A no hydrogen 2.733 N/A GLU 121.A N ARG 117.A O.C no hydrogen 2.739 N/A ASN 122.A N MET 119.A O no hydrogen 2.910 N/A ASN 122.A ND2 PHE 118.A O no hydrogen 2.584 N/A GLY 123.A N THR 120.A O no hydrogen 3.303 N/A PHE 124.A N MET 119.A O no hydrogen 3.372 N/A ASP 128.A N SER 125.A OG.A no hydrogen 2.985 N/A ASP 128.A N SER 125.A OG.B no hydrogen 3.064 N/A GLY 129.A N SER 125.A O no hydrogen 2.745 N/A LEU 130.A N LEU 126.A O no hydrogen 2.620 N/A TYR 131.A N ARG 127.A O no hydrogen 2.730 N/A ALA 132.A N ASP 128.A O no hydrogen 2.960 N/A ILE 133.A N GLY 129.A O no hydrogen 3.059 N/A SER 134.A N LEU 130.A O no hydrogen 2.901 N/A SER 134.A OG.A LEU 130.A O no hydrogen 2.973 N/A SER 134.A OG.B LEU 130.A O no hydrogen 3.321 N/A SER 134.A OG.B TYR 131.A O no hydrogen 3.187 N/A ALA 135.A N TYR 131.A O no hydrogen 2.822 N/A VAL 136.A N ALA 132.A O no hydrogen 3.058 N/A SER 137.A N ILE 133.A O no hydrogen 3.037 N/A SER 137.A OG ILE 133.A O no hydrogen 2.970 N/A HIS 138.A N SER 134.A O no hydrogen 2.841 N/A PHE 139.A N ALA 135.A O no hydrogen 2.906 N/A THR 140.A N VAL 136.A O no hydrogen 2.949 N/A THR 140.A OG1 VAL 136.A O no hydrogen 2.683 N/A LEU 141.A N SER 137.A O no hydrogen 2.861 N/A GLY 142.A N HIS 138.A O no hydrogen 2.846 N/A ALA 143.A N PHE 139.A O no hydrogen 2.936 N/A VAL 144.A N THR 140.A O no hydrogen 2.953 N/A LEU 145.A N LEU 141.A O no hydrogen 2.757 N/A GLU 146.A N GLY 142.A O no hydrogen 3.238 N/A GLN 147.A N ALA 143.A O no hydrogen 3.356 N/A GLN 148.A N VAL 144.A O no hydrogen 2.974 N/A GLN 148.A NE2 LEU 89.A O no hydrogen 2.913 N/A GLN 148.A NE2 TYR 92.A O no hydrogen 3.290 N/A GLU 149.A N LEU 145.A O no hydrogen 2.766 N/A HIS 150.A N GLU 146.A O no hydrogen 3.247 N/A THR 151.A N GLN 147.A O no hydrogen 3.043 N/A THR 151.A OG1 GLN 147.A O no hydrogen 3.290 N/A THR 151.A OG1 GLN 148.A O no hydrogen 3.381 N/A ALA 152.A N GLN 148.A O no hydrogen 3.253 N/A ALA 153.A N GLU 149.A O no hydrogen 3.145 N/A LEU 154.A N HIS 150.A O no hydrogen 3.269 N/A THR 155.A OG1 ALA 152.A O no hydrogen 3.299 N/A ARG 161.A N PRO 157.A O no hydrogen 2.609 N/A GLU 162.A N PRO 158.A O no hydrogen 2.840 N/A ALA 163.A N LEU 159.A O no hydrogen 2.480 N/A LEU 164.A N LEU 160.A O no hydrogen 2.822 N/A GLN 165.A N ARG 161.A O no hydrogen 3.258 N/A ILE 166.A N GLU 162.A O no hydrogen 2.930 N/A MET 167.A N ALA 163.A O no hydrogen 2.524 N/A ASP 168.A N GLN 165.A O no hydrogen 3.159 N/A SER 169.A N ILE 166.A O no hydrogen 3.123 N/A SER 169.A OG ILE 166.A O no hydrogen 2.684 N/A GLY 172.A N ASP 170.A OD1 no hydrogen 3.410 N/A GLN 174.A N ASP 170.A OD2 no hydrogen 3.180 N/A GLN 174.A NE2 ASP 170.A OD1 no hydrogen 3.324 N/A PHE 176.A N GLY 172.A O no hydrogen 2.940 N/A LEU 177.A N GLU 173.A O no hydrogen 2.907 N/A HIS 178.A N GLN 174.A O no hydrogen 3.036 N/A GLY 179.A N ALA 175.A O no hydrogen 3.051 N/A LEU 180.A N PHE 176.A O no hydrogen 2.831 N/A GLU 181.A N LEU 177.A O no hydrogen 3.201 N/A SER 182.A N HIS 178.A O no hydrogen 3.150 N/A SER 182.A OG HIS 178.A O no hydrogen 3.407 N/A LEU 183.A N GLY 179.A O no hydrogen 2.901 N/A ILE 184.A N LEU 180.A O no hydrogen 2.970 N/A ARG 185.A N GLU 181.A O no hydrogen 3.078 N/A GLY 186.A N SER 182.A O no hydrogen 2.971 N/A PHE 187.A N LEU 183.A O no hydrogen 3.036 N/A GLU 188.A N ILE 184.A O no hydrogen 2.918 N/A VAL 189.A N ARG 185.A O no hydrogen 2.844 N/A GLN 190.A N GLY 186.A O no hydrogen 3.239 N/A LEU 191.A N PHE 187.A O no hydrogen 2.995 N/A THR 192.A N GLU 188.A O no hydrogen 2.939 N/A THR 192.A OG1 GLU 188.A O no hydrogen 3.079 N/A ALA 193.A N VAL 189.A O no hydrogen 3.113 N/A ALA 193.A N GLN 190.A O no hydrogen 3.203 N/A LEU 194.A N LEU 191.A O no hydrogen 3.235 N/A GLN 196.A N.A ALA 193.A O no hydrogen 2.869 N/A GLN 196.A N.B ALA 193.A O no hydrogen 2.857 N/A