Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3vms_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ILE 4.A N LEU 1.A O no hydrogen 2.911 N/A LEU 5.A N LEU 1.A O no hydrogen 3.464 N/A THR 7.A N LYS 3.A O no hydrogen 2.755 N/A THR 7.A OG1 LYS 3.A O no hydrogen 3.270 N/A THR 7.A OG1 ILE 4.A O no hydrogen 2.641 N/A ILE 8.A N LEU 5.A O no hydrogen 3.347 N/A LEU 9.A N LEU 5.A O no hydrogen 3.057 N/A LEU 9.A N LEU 6.A O no hydrogen 2.715 N/A ILE 10.A N LEU 6.A O no hydrogen 3.056 N/A ILE 12.A N ILE 8.A O no hydrogen 3.335 N/A ALA 13.A N LEU 9.A O no hydrogen 2.810 N/A LEU 14.A N ILE 10.A O no hydrogen 2.612 N/A PHE 15.A N ILE 11.A O no hydrogen 2.518 N/A ILE 16.A N ILE 12.A O no hydrogen 2.583 N/A GLY 17.A N ALA 13.A O no hydrogen 2.578 N/A ILE 18.A N LEU 14.A O no hydrogen 2.620 N/A MET 19.A N PHE 15.A O no hydrogen 2.740 N/A TYR 20.A N ILE 16.A O no hydrogen 2.874 N/A PHE 21.A N GLY 17.A O no hydrogen 3.142 N/A LEU 22.A N MET 19.A O no hydrogen 3.285 N/A SER 23.A N TYR 20.A O no hydrogen 2.809 N/A SER 23.A OG TYR 20.A O no hydrogen 2.420 N/A THR 24.A N TYR 20.A O no hydrogen 3.489 N/A GLU 30.A N ASN 27.A O no hydrogen 3.097 N/A ARG 32.A N ASP 29.A O no hydrogen 2.718 N/A ARG 32.A NE GLU 35.A OE2 no hydrogen 2.786 N/A ARG 32.A NH2 GLU 122.A OE2 no hydrogen 2.638 N/A LYS 33.A N GLU 30.A O no hydrogen 2.933 N/A ILE 34.A N LEU 31.A O no hydrogen 3.424 N/A GLU 35.A N ARG 32.A O no hydrogen 3.195 N/A ASN 36.A N LYS 33.A O no hydrogen 3.277 N/A LYS 37.A N ILE 34.A O no hydrogen 2.810 N/A LYS 37.A NZ ASN 129.A O no hydrogen 3.496 N/A SER 39.A OG THR 139.A OG1 no hydrogen 2.909 N/A PHE 40.A N LYS 37.A O no hydrogen 2.957 N/A VAL 41.A N ASN 129.A OD1 no hydrogen 3.212 N/A SER 42.A OG ASP 44.A OD2 no hydrogen 2.752 N/A SER 42.A OG ASN 45.A OD1 no hydrogen 2.801 N/A ALA 43.A N SER 125.A OG no hydrogen 2.909 N/A ASN 45.A N SER 42.A O no hydrogen 2.610 N/A MET 46.A N ALA 43.A O no hydrogen 2.885 N/A TYR 49.A OH ILE 162.A O no hydrogen 2.588 N/A LYS 51.A N PRO 47.A O no hydrogen 3.147 N/A GLY 52.A N GLU 48.A O no hydrogen 2.921 N/A ALA 53.A N TYR 49.A O no hydrogen 2.874 N/A PHE 54.A N LYS 51.A O no hydrogen 3.156 N/A ILE 55.A N LYS 51.A O no hydrogen 3.088 N/A SER 56.A N GLY 52.A O no hydrogen 2.896 N/A SER 56.A OG GLY 52.A O no hydrogen 2.568 N/A GLU 58.A N PHE 54.A O no hydrogen 2.897 N/A ARG 61.A NH1 GLU 60.A OE2 no hydrogen 3.390 N/A ASN 64.A N ARG 61.A O no hydrogen 3.192 N/A HIS 65.A NE2 ASP 59.A OD2 no hydrogen 2.636 N/A GLY 67.A N HIS 65.A ND1 no hydrogen 3.276 N/A THR 73.A N ASP 69.A O no hydrogen 2.955 N/A THR 73.A OG1 ASP 69.A O no hydrogen 2.842 N/A THR 74.A N LEU 70.A O no hydrogen 2.603 N/A THR 74.A OG1 LEU 70.A O no hydrogen 3.270 N/A THR 74.A OG1 LYS 71.A O no hydrogen 3.219 N/A ALA 76.A N GLY 72.A O no hydrogen 3.114 N/A LEU 77.A N THR 73.A O no hydrogen 2.688 N/A PHE 78.A N ARG 75.A O no hydrogen 3.076 N/A SER 79.A N THR 74.A O no hydrogen 3.046 N/A THR 84.A N GLN 87.A OE1 no hydrogen 2.765 N/A THR 84.A OG1 GLY 67.A O no hydrogen 2.847 N/A ILE 85.A N ASP 59.A OD2 no hydrogen 2.823 N/A THR 86.A OG1 GLU 115.A OE2 no hydrogen 2.685 N/A GLN 87.A N THR 84.A O no hydrogen 2.939 N/A GLN 87.A N THR 84.A OG1 no hydrogen 2.863 N/A GLN 88.A N THR 84.A O no hydrogen 2.915 N/A GLN 88.A NE2 GLU 58.A OE1 no hydrogen 2.958 N/A GLN 88.A NE2 SER 83.A O no hydrogen 3.080 N/A VAL 89.A N ILE 85.A O no hydrogen 3.429 N/A VAL 90.A N THR 86.A O no hydrogen 3.204 N/A LYS 91.A N GLN 87.A O no hydrogen 2.864 N/A LYS 91.A NZ SER 83.A OG no hydrogen 3.334 N/A ASN 92.A N GLN 88.A O no hydrogen 2.675 N/A TYR 93.A N VAL 89.A O no hydrogen 3.012 N/A TYR 93.A OH GLU 30.A OE1 no hydrogen 2.995 N/A PHE 94.A N VAL 90.A O no hydrogen 2.914 N/A TYR 95.A OH ASP 26.A OD1 no hydrogen 3.306 N/A ASP 98.A N TYR 95.A O no hydrogen 3.243 N/A SER 100.A OG THR 102.A OG1 no hydrogen 2.927 N/A THR 102.A OG1 SER 100.A OG no hydrogen 2.927 N/A ARG 103.A N SER 100.A O no hydrogen 2.682 N/A LYS 104.A N SER 100.A O no hydrogen 2.942 N/A VAL 105.A N PHE 101.A O no hydrogen 3.200 N/A GLU 107.A N ARG 103.A O no hydrogen 2.687 N/A LEU 108.A N VAL 105.A O no hydrogen 2.770 N/A PHE 109.A N VAL 105.A O no hydrogen 3.369 N/A VAL 110.A N LYS 106.A O no hydrogen 2.870 N/A ALA 111.A N GLU 107.A O no hydrogen 3.263 N/A HIS 112.A N LEU 108.A O no hydrogen 3.275 N/A ARG 113.A NH1 SER 23.A O no hydrogen 3.200 N/A ARG 113.A NH1 ASP 26.A O no hydrogen 2.779 N/A ARG 113.A NH2 SER 23.A OG no hydrogen 2.866 N/A VAL 114.A N VAL 110.A O no hydrogen 3.191 N/A GLU 115.A N ALA 111.A O no hydrogen 3.193 N/A GLU 115.A N HIS 112.A O no hydrogen 3.179 N/A LYS 116.A N HIS 112.A O no hydrogen 2.936 N/A GLN 117.A N ARG 113.A O no hydrogen 2.759 N/A TYR 118.A N VAL 114.A O no hydrogen 3.046 N/A ASN 119.A N GLU 122.A OE1 no hydrogen 2.974 N/A LYS 120.A NZ PHE 62.A O no hydrogen 2.907 N/A LYS 120.A NZ HIS 65.A O no hydrogen 3.145 N/A LYS 120.A NZ GLU 115.A OE2 no hydrogen 2.751 N/A GLU 122.A N ASN 119.A OD1 no hydrogen 2.774 N/A ILE 123.A N ASN 119.A O no hydrogen 2.860 N/A LEU 124.A N LYS 120.A O no hydrogen 3.114 N/A SER 125.A N ASN 121.A O no hydrogen 3.101 N/A SER 125.A N GLU 122.A O no hydrogen 2.677 N/A SER 125.A OG ASN 121.A O no hydrogen 2.970 N/A PHE 126.A N GLU 122.A O no hydrogen 3.193 N/A PHE 126.A N ILE 123.A O no hydrogen 2.535 N/A TYR 127.A N ILE 123.A O no hydrogen 3.116 N/A TYR 127.A OH GLN 88.A OE1 no hydrogen 3.001 N/A LEU 128.A N LEU 124.A O no hydrogen 3.134 N/A ASN 129.A N PHE 126.A O no hydrogen 3.117 N/A ASN 129.A ND2 VAL 41.A O no hydrogen 2.515 N/A ASN 129.A ND2 SER 125.A O no hydrogen 2.564 N/A ASN 130.A N TYR 127.A O no hydrogen 3.216 N/A ILE 131.A N TYR 138.A O no hydrogen 2.878 N/A PHE 133.A N GLN 137.A O no hydrogen 2.740 N/A ASN 136.A N TYR 132.A OH no hydrogen 2.808 N/A THR 139.A OG1 SER 39.A OG no hydrogen 2.909 N/A LEU 140.A N LEU 128.A O no hydrogen 3.136 N/A GLY 142.A N THR 139.A OG1 no hydrogen 2.945 N/A ALA 143.A N THR 139.A O no hydrogen 2.793 N/A ALA 144.A N LEU 140.A O no hydrogen 2.925 N/A ASN 145.A N GLU 141.A O no hydrogen 3.060 N/A HIS 146.A N GLY 142.A O no hydrogen 2.923 N/A HIS 146.A NE2 ASP 135.A OD2 no hydrogen 2.826 N/A TYR 147.A N ALA 143.A O no hydrogen 2.921 N/A TYR 147.A OH PHE 133.A O no hydrogen 2.476 N/A PHE 148.A N ALA 144.A O no hydrogen 2.928 N/A GLY 149.A N ALA 144.A O no hydrogen 3.166 N/A THR 151.A N SER 160.A O no hydrogen 2.923 N/A THR 151.A OG1 GLU 141.A OE2 no hydrogen 3.353 N/A VAL 152.A N GLU 141.A OE1 no hydrogen 3.304 N/A ASN 153.A N THR 151.A OG1 no hydrogen 2.982 N/A LYS 154.A N ASN 45.A O no hydrogen 2.803 N/A LYS 154.A NZ ASP 44.A O no hydrogen 2.884 N/A SER 156.A N ASN 153.A O no hydrogen 2.660 N/A SER 156.A OG MET 159.A O no hydrogen 3.092 N/A SER 160.A OG HIS 161.A O no hydrogen 3.164 N/A GLN 166.A N THR 163.A OG1 no hydrogen 3.345 N/A GLN 166.A NE2 THR 150.A OG1 no hydrogen 2.725 N/A SER 167.A N THR 163.A O no hydrogen 3.393 N/A SER 167.A OG THR 163.A O no hydrogen 3.149 N/A SER 167.A OG VAL 164.A O no hydrogen 3.523 N/A ALA 168.A N LEU 165.A O no hydrogen 2.911 N/A ILE 169.A N LEU 165.A O no hydrogen 3.260 N/A LEU 170.A N GLN 166.A O no hydrogen 3.024 N/A ALA 171.A N SER 167.A O no hydrogen 2.842 N/A SER 172.A N ALA 168.A O no hydrogen 3.084 N/A SER 172.A N ILE 169.A O no hydrogen 3.087 N/A SER 172.A OG ALA 168.A O no hydrogen 2.443 N/A ALA 176.A N LYS 173.A O no hydrogen 2.467 N/A TYR 180.A N PRO 177.A O no hydrogen 2.828 N/A TYR 180.A OH ASN 188.A O no hydrogen 3.236 N/A ASN 181.A ND2 ASN 183.A OD1 no hydrogen 3.168 N/A THR 190.A N SER 186.A O no hydrogen 2.567 N/A THR 190.A OG1 SER 186.A O no hydrogen 3.241 N/A THR 190.A OG1 GLU 187.A O no hydrogen 3.285 N/A ARG 192.A N PHE 189.A O no hydrogen 2.643 N/A ARG 192.A NE SER 172.A O no hydrogen 2.721 N/A VAL 193.A N PHE 189.A O no hydrogen 3.029 N/A THR 195.A N GLN 191.A O no hydrogen 3.180 N/A THR 195.A OG1 GLN 191.A O no hydrogen 2.938 N/A ASN 196.A ND2 ALA 53.A O no hydrogen 3.638 N/A ASN 196.A ND2 ALA 168.A O no hydrogen 3.119 N/A LEU 197.A N VAL 193.A O no hydrogen 3.103 N/A GLU 198.A N SER 194.A O no hydrogen 3.113 N/A MET 200.A N ASN 196.A O no hydrogen 3.120 N/A LYS 201.A N LEU 197.A O no hydrogen 3.345 N/A GLN 202.A N GLU 198.A O no hydrogen 2.763 N/A GLN 203.A N LYS 199.A O no hydrogen 3.175 N/A GLN 203.A NE2 SER 56.A O no hydrogen 3.319 N/A ASN 204.A N LYS 201.A O no hydrogen 3.100 N/A TYR 205.A N MET 200.A O no hydrogen 2.817 N/A ASN 207.A N GLN 210.A OE1 no hydrogen 3.187 N/A GLN 210.A N ASN 207.A OD1 no hydrogen 2.717 N/A TYR 211.A N ASN 207.A O no hydrogen 2.836 N/A GLN 212.A N GLU 208.A O no hydrogen 3.213 N/A GLN 212.A NE2 GLU 208.A O no hydrogen 3.530 N/A ALA 214.A N GLN 210.A O no hydrogen 3.133 N/A MET 215.A N TYR 211.A O no hydrogen 3.236 N/A SER 216.A N GLN 212.A O no hydrogen 2.827 N/A GLN 217.A N GLN 213.A O no hydrogen 2.948 N/A LEU 218.A N ALA 214.A O no hydrogen 2.413 N/A ASN 219.A N MET 215.A O no hydrogen 3.162 N/A ASN 219.A ND2 MET 215.A O no hydrogen 2.958 N/A