Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 5boc_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLU 4.A N LEU 86.A O no hydrogen 3.219 N/A ALA 8.A N GLY 5.A O no hydrogen 3.242 N/A ARG 10.A N LEU 6.A O no hydrogen 3.134 N/A ARG 10.A NH1 ALA 95.A O no hydrogen 2.755 N/A ARG 10.A NH1 ASP 145.A OD2 no hydrogen 2.934 N/A ARG 10.A NH2 ASP 145.A OD2 no hydrogen 2.806 N/A LYS 11.A N ASP 7.A O no hydrogen 3.011 N/A ARG 12.A N ALA 8.A O no hydrogen 3.287 N/A ARG 12.A N VAL 9.A O no hydrogen 3.110 N/A MET 15.A N ARG 12.A O no hydrogen 3.134 N/A TYR 16.A N PRO 13.A O no hydrogen 2.949 N/A ILE 17.A N PRO 13.A O no hydrogen 2.957 N/A GLY 18.A N GLY 14.A O no hydrogen 2.876 N/A SER 19.A OG ASP 21.A OD1 no hydrogen 2.612 N/A GLY 24.A N ASP 21.A OD1 no hydrogen 3.434 N/A LEU 25.A N ASP 21.A O no hydrogen 2.958 N/A HIS 26.A N GLY 22.A O no hydrogen 3.095 N/A HIS 26.A ND1 GLY 22.A O no hydrogen 2.876 N/A HIS 27.A N ALA 23.A O no hydrogen 3.090 N/A HIS 27.A N GLY 24.A O no hydrogen 3.073 N/A HIS 27.A ND1.A ILE 17.A O no hydrogen 2.532 N/A LEU 28.A N LEU 25.A O no hydrogen 3.283 N/A TRP 30.A N HIS 26.A O no hydrogen 3.114 N/A GLU 31.A N HIS 27.A O no hydrogen 2.977 N/A ILE 32.A N LEU 28.A O no hydrogen 3.218 N/A VAL 33.A N VAL 29.A O no hydrogen 2.929 N/A ASP 34.A N.A TRP 30.A O no hydrogen 2.895 N/A ASP 34.A N.B TRP 30.A O no hydrogen 2.895 N/A ASP 34.A N.C TRP 30.A O no hydrogen 2.893 N/A ASN 35.A N ILE 32.A O no hydrogen 3.255 N/A ASN 35.A ND2 GLU 31.A O no hydrogen 2.684 N/A VAL 37.A N VAL 33.A O no hydrogen 2.845 N/A ASP 38.A N ASP 34.A O.A no hydrogen 2.780 N/A ASP 38.A N ASP 34.A O.B no hydrogen 2.778 N/A ASP 38.A N ASP 34.A O.C no hydrogen 2.790 N/A GLU 39.A N ASN 35.A O no hydrogen 3.297 N/A ALA 40.A N ALA 36.A O no hydrogen 3.049 N/A LEU 41.A N VAL 37.A O no hydrogen 2.831 N/A SER 42.A N ASP 38.A O no hydrogen 3.053 N/A SER 42.A OG ASP 38.A O no hydrogen 3.277 N/A GLY 43.A N ALA 40.A O no hydrogen 2.757 N/A PHE 44.A N GLU 39.A O no hydrogen 3.045 N/A ARG 47.A NE ASP 49.A OD1 no hydrogen 3.211 N/A ARG 47.A NE ASP 49.A OD2 no hydrogen 2.902 N/A ARG 47.A NH2 ASP 49.A OD1 no hydrogen 2.721 N/A ARG 47.A NH2 GLU 187.A OE2 no hydrogen 2.939 N/A ILE 48.A N THR 174.A O no hydrogen 2.753 N/A ASP 49.A N GLN 61.A O no hydrogen 2.923 N/A VAL 50.A N SER 176.A O no hydrogen 2.952 N/A THR 51.A N THR 59.A O no hydrogen 2.807 N/A ILE 52.A N THR 178.A O no hydrogen 2.837 N/A ASN 53.A N SER 57.A O no hydrogen 2.782 N/A ASN 53.A ND2 SER 57.A OG no hydrogen 2.876 N/A ASN 53.A ND2 THR 59.A OG1 no hydrogen 2.932 N/A GLY 56.A N ASN 53.A O no hydrogen 2.987 N/A SER 57.A N ASP 55.A OD1 no hydrogen 3.072 N/A SER 57.A OG ASP 55.A OD1 no hydrogen 2.695 N/A LEU 58.A N PHE 142.A O no hydrogen 3.135 N/A THR 59.A N THR 51.A O no hydrogen 2.805 N/A THR 59.A OG1 THR 141.A OG1 no hydrogen 2.728 N/A VAL 60.A N VAL 140.A O no hydrogen 2.899 N/A GLN 61.A N ASP 49.A O no hydrogen 2.874 N/A ASP 62.A N THR 138.A O no hydrogen 2.849 N/A GLY 64.A N ASP 62.A OD1 no hydrogen 2.974 N/A ARG 65.A N GLU 39.A OE2 no hydrogen 3.249 N/A ARG 65.A NE GLU 39.A OE2 no hydrogen 3.303 N/A ARG 65.A NH2 GLU 39.A OE1 no hydrogen 2.336 N/A MET 67.A N THR 138.A OG1 no hydrogen 3.141 N/A HIS 72.A N ILE 76.A O no hydrogen 2.577 N/A ALA 73.A N HIS 72.A ND1 no hydrogen 2.877 N/A ILE 76.A N ALA 73.A O no hydrogen 2.909 N/A THR 78.A N GLY 70.A O no hydrogen 3.096 N/A THR 78.A OG1 GLY 70.A O no hydrogen 3.566 N/A GLU 80.A N PRO 77.A O no hydrogen 2.985 N/A VAL 81.A N PRO 77.A O no hydrogen 3.179 N/A ILE 82.A N THR 78.A O no hydrogen 3.134 N/A PHE 83.A N VAL 79.A O no hydrogen 3.137 N/A THR 84.A N VAL 81.A O no hydrogen 3.398 N/A THR 84.A OG1 GLU 80.A O no hydrogen 2.573 N/A ILE 85.A N VAL 81.A O no hydrogen 3.094 N/A LEU 86.A N GLU 4.A O no hydrogen 2.938 N/A SER 90.A OG ILE 82.A O no hydrogen 3.305 N/A SER 91.A OG VAL 88.A O no hydrogen 2.965 N/A VAL 92.A N VAL 88.A O no hydrogen 3.375 N/A VAL 93.A N GLY 89.A O no hydrogen 3.151 N/A ASN 94.A N SER 90.A O no hydrogen 3.016 N/A ASN 94.A ND2 PHE 83.A O no hydrogen 2.797 N/A ASN 94.A ND2 GLY 119.A O no hydrogen 3.572 N/A ALA 95.A N SER 91.A O no hydrogen 2.838 N/A LEU 96.A N VAL 92.A O no hydrogen 3.087 N/A LEU 96.A N VAL 93.A O no hydrogen 3.198 N/A SER 97.A N ASN 94.A O no hydrogen 3.245 N/A SER 97.A OG VAL 93.A O no hydrogen 2.544 N/A SER 98.A N MET 143.A O no hydrogen 2.810 N/A SER 98.A OG MET 143.A O no hydrogen 3.396 N/A LEU 100.A N PHE 115.A O no hydrogen 2.914 N/A GLU 101.A N THR 141.A O no hydrogen 2.750 N/A VAL 102.A N GLN 113.A O no hydrogen 3.079 N/A GLU 103.A N LYS 139.A O no hydrogen 2.675 N/A ILE 104.A N TYR 111.A O no hydrogen 2.838 N/A THR 105.A N GLY 137.A O no hydrogen 2.919 N/A ARG 106.A N ALA 109.A O no hydrogen 3.075 N/A ARG 106.A NE ASP 107.A OD2 no hydrogen 3.116 N/A ARG 106.A NH1 GLY 66.A O no hydrogen 2.935 N/A ALA 109.A N ARG 106.A O no hydrogen 3.020 N/A VAL 110.A N GLY 129.A O no hydrogen 2.891 N/A TYR 111.A N ILE 104.A O no hydrogen 2.791 N/A LYS 112.A N LYS 126.A O no hydrogen 2.798 N/A LYS 112.A NZ GLU 101.A OE1 no hydrogen 3.552 N/A GLN 113.A N VAL 102.A O no hydrogen 3.106 N/A GLN 113.A NE2 GLU 80.A OE1 no hydrogen 2.948 N/A GLN 113.A NE2 THR 123.A O no hydrogen 3.066 N/A ARG 114.A N THR 123.A OG1 no hydrogen 3.194 N/A ARG 114.A NE GLU 116.A OE2 no hydrogen 2.845 N/A ARG 114.A NH1 GLU 101.A OE2 no hydrogen 2.519 N/A ARG 114.A NH2 GLU 116.A OE2 no hydrogen 3.029 N/A PHE 115.A N LEU 100.A O no hydrogen 2.759 N/A GLU 116.A N LYS 120.A O no hydrogen 2.686 N/A ASN 117.A N SER 98.A O no hydrogen 2.838 N/A GLY 118.A N SER 97.A O no hydrogen 2.997 N/A LYS 120.A N GLU 116.A O no hydrogen 2.883 N/A LYS 120.A NZ ASN 117.A O no hydrogen 2.739 N/A VAL 122.A N ARG 114.A O no hydrogen 2.969 N/A THR 123.A OG1 THR 124.A O no hydrogen 2.939 N/A LYS 126.A N LYS 112.A O no hydrogen 2.982 N/A ILE 128.A N VAL 110.A O no hydrogen 2.698 N/A GLY 129.A N VAL 110.A O no hydrogen 3.425 N/A ALA 131.A N GLY 108.A O no hydrogen 3.124 N/A LYS 133.A NZ ASP 107.A O no hydrogen 3.265 N/A LYS 135.A N LEU 132.A O no hydrogen 3.035 N/A THR 136.A OG1 GLY 64.A O no hydrogen 2.550 N/A GLY 137.A N THR 105.A O no hydrogen 2.898 N/A THR 138.A N ASP 62.A O no hydrogen 3.355 N/A THR 138.A N ASP 62.A OD1 no hydrogen 3.083 N/A LYS 139.A N GLU 103.A O no hydrogen 2.820 N/A LYS 139.A NZ GLU 103.A OE1.B no hydrogen 3.484 N/A LYS 139.A NZ GLU 103.A OE2.A no hydrogen 3.554 N/A VAL 140.A N VAL 60.A O no hydrogen 2.956 N/A THR 141.A N GLU 101.A O no hydrogen 2.836 N/A THR 141.A OG1 THR 59.A OG1 no hydrogen 2.728 N/A PHE 142.A N LEU 58.A O no hydrogen 3.049 N/A MET 143.A N TRP 99.A O no hydrogen 2.847 N/A ASP 145.A N LEU 96.A O no hydrogen 2.962 N/A THR 147.A N ASP 145.A OD1 no hydrogen 2.972 N/A THR 147.A OG1 ASP 145.A OD1 no hydrogen 2.674 N/A ILE 148.A N ASP 145.A O no hydrogen 3.033 N/A PHE 149.A N ASP 145.A O no hydrogen 3.107 N/A SER 150.A N THR 20.A O no hydrogen 2.987 N/A SER 150.A OG THR 20.A O no hydrogen 3.451 N/A ASP 153.A N THR 151.A OG1 no hydrogen 3.298 N/A LYS 155.A N HIS 26.A NE2 no hydrogen 2.933 N/A ILE 159.A N LYS 155.A O no hydrogen 3.115 N/A SER 160.A N TYR 156.A O no hydrogen 2.891 N/A GLU 161.A N ASN 157.A O no hydrogen 3.152 N/A ARG 162.A N.A THR 158.A O no hydrogen 3.324 N/A ARG 162.A N.B THR 158.A O no hydrogen 3.326 N/A ARG 162.A NH2.A ASP 34.A OD1.B no hydrogen 3.567 N/A LEU 163.A N ILE 159.A O no hydrogen 2.898 N/A ASN 164.A N SER 160.A O no hydrogen 2.967 N/A GLU 165.A N GLU 161.A O no hydrogen 3.064 N/A SER 166.A N ARG 162.A O.A no hydrogen 2.918 N/A SER 166.A N ARG 162.A O.B no hydrogen 3.004 N/A SER 166.A OG ARG 162.A O.A no hydrogen 2.950 N/A SER 166.A OG ARG 162.A O.B no hydrogen 2.852 N/A ALA 167.A N LEU 163.A O no hydrogen 2.889 N/A PHE 168.A N ASN 164.A O no hydrogen 2.952 N/A LEU 169.A N GLU 165.A O no hydrogen 2.962 N/A LEU 170.A N SER 166.A O no hydrogen 2.913 N/A LYS 171.A N ALA 167.A O no hydrogen 3.092 N/A LYS 171.A NZ PHE 168.A O no hydrogen 2.866 N/A ASN 172.A N TYR 190.A O no hydrogen 2.668 N/A ASN 172.A ND2 ASN 192.A OD1 no hydrogen 2.945 N/A THR 174.A N ASP 46.A O no hydrogen 2.930 N/A THR 174.A OG1 HIS 189.A ND1 no hydrogen 2.573 N/A LEU 175.A N PHE 188.A O no hydrogen 2.869 N/A SER 176.A N ILE 48.A O no hydrogen 2.998 N/A SER 176.A OG ASP 49.A OD1 no hydrogen 2.464 N/A LEU 177.A N ILE 186.A O no hydrogen 2.961 N/A THR 178.A N VAL 50.A O no hydrogen 3.012 N/A ASP 179.A N GLU 184.A O no hydrogen 2.707 N/A LYS 180.A N ILE 52.A O no hydrogen 2.911 N/A ARG 181.A N ASP 179.A OD1 no hydrogen 2.946 N/A ARG 181.A NE ASP 179.A OD1 no hydrogen 2.997 N/A ARG 181.A NH1 PHE 154.A O no hydrogen 3.121 N/A ARG 181.A NH2 PHE 154.A O no hydrogen 2.619 N/A ARG 181.A NH2 ASP 179.A OD2 no hydrogen 3.072 N/A THR 182.A N ASP 179.A O no hydrogen 3.346 N/A THR 182.A OG1 GLU 184.A OE2 no hydrogen 2.655 N/A ILE 186.A N LEU 177.A O no hydrogen 2.971 N/A PHE 188.A N LEU 175.A O no hydrogen 2.757 N/A HIS 189.A ND1 THR 174.A OG1 no hydrogen 2.573 N/A TYR 190.A OH ASN 164.A OD1 no hydrogen 2.572 N/A