#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2vkc h LYS 1667N 0.00 0.00 -0.42 0.03 1.57 -2.05 -2.84 116.57 112.86 2vkc h LYS 1667Ca 0.00 0.00 -0.05 0.00 -1.87 0.00 0.00 60.65 58.73 2vkc h LYS 1667Cb 0.00 0.00 -0.02 0.00 0.08 0.00 0.00 32.23 32.29 2vkc h LYS 1667CO 0.00 0.59 0.04 1.05 -0.57 0.00 0.00 179.45 180.56 2vkc h GLU 1668N 0.00 0.65 -0.18 3.15 9.09 -2.05 0.15 114.58 125.39 2vkc h GLU 1668Ca -0.01 -0.14 -0.03 0.00 0.05 0.00 0.00 59.36 59.24 2vkc h GLU 1668Cb 1.31 -0.09 -0.01 0.00 -1.65 0.00 0.00 28.75 28.31 2vkc h GLU 1668CO 0.08 0.64 0.00 0.00 0.05 0.00 0.00 179.01 179.78 2vkc h ALA 1669N 1.42 0.24 -0.27 1.06 0.00 -1.94 0.31 119.26 120.09 2vkc h ALA 1669Ca 0.13 -0.20 -0.05 0.00 0.00 0.00 0.00 54.91 54.80 2vkc h ALA 1669Cb 0.33 -0.07 -0.02 0.00 0.00 0.00 0.00 17.79 18.04 2vkc h ALA 1669CO 0.01 -0.05 -0.06 -0.97 0.00 0.00 0.00 179.25 178.18 2vkc h ASN 1670N 0.08 0.40 -0.04 0.00 -0.00 -1.25 0.36 115.58 115.12 2vkc h ASN 1670Ca 0.05 -0.08 -0.00 0.00 -0.00 0.00 0.00 56.30 56.27 2vkc h ASN 1670Cb 0.37 -0.10 -0.00 0.00 -0.00 0.00 0.00 38.32 38.59 2vkc h ASN 1670CO 0.01 0.50 0.01 -0.74 -0.00 0.00 0.00 177.43 177.21 2vkc h HIS 1671N 0.40 0.06 0.00 0.67 2.76 -0.42 -2.65 115.15 115.97 2vkc h HIS 1671Ca 0.08 -0.01 -0.06 0.00 -2.20 0.00 0.00 60.37 58.19 2vkc h HIS 1671Cb 0.36 -0.02 -0.01 0.00 1.55 0.00 0.00 27.41 29.29 2vkc h HIS 1671CO 0.01 0.24 -0.27 -0.07 -1.30 0.00 0.00 177.93 176.54 2vkc h LEU 1672N -0.14 0.00 -0.70 0.26 3.38 -0.40 -0.52 115.31 117.19 2vkc h LEU 1672Ca 0.01 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.98 2vkc h LEU 1672Cb 0.21 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.96 2vkc h LEU 1672CO -0.00 0.27 0.00 0.00 0.09 0.00 0.00 178.44 178.80 2vkc n ALA 1673N -2.35 1.63 0.05 1.53 0.00 0.07 -2.18 120.51 119.26 2vkc n ALA 1673Ca -0.01 0.08 -0.17 0.00 0.00 0.00 0.00 53.44 53.34 2vkc n ALA 1673Cb 0.37 -1.37 -0.14 0.00 0.00 0.00 0.00 19.45 18.30 2vkc n ALA 1673CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2vkc h ALA 1674N 2.26 0.34 -0.42 0.00 0.00 -0.75 -3.31 119.26 117.38 2vkc h ALA 1674Ca 0.00 -1.20 -0.11 0.00 0.00 0.00 0.00 54.91 53.60 2vkc h ALA 1674Cb 0.34 0.39 -0.02 0.00 0.00 0.00 0.00 17.79 18.50 2vkc h ALA 1674CO 0.00 1.20 -0.19 0.82 0.00 0.00 0.00 179.25 181.08 2vkc h ILE 1675N 0.07 1.27 -0.03 0.00 5.03 -1.35 -1.60 117.51 120.89 2vkc h ILE 1675Ca -0.29 -1.31 -0.03 0.00 -0.12 0.00 0.00 64.86 63.11 2vkc h ILE 1675Cb 2.03 1.15 -0.01 0.00 -3.03 0.00 0.00 36.82 36.96 2vkc h ILE 1675CO 0.14 0.44 -0.12 1.05 -0.68 0.00 0.00 178.15 178.98 2vkc h GLU 1676N 0.72 0.04 0.16 2.37 4.11 -1.61 0.14 114.58 120.50 2vkc h GLU 1676Ca 0.10 -0.01 -0.01 0.00 0.07 0.00 0.00 59.36 59.52 2vkc h GLU 1676Cb 0.71 -0.01 0.00 0.00 0.50 0.00 0.00 28.75 29.95 2vkc h GLU 1676CO 0.05 0.17 -0.07 0.82 0.07 0.00 0.00 179.01 180.05 2vkc h ILE 1677N 0.04 0.99 -0.66 -1.06 1.08 -1.52 -2.36 117.51 114.01 2vkc h ILE 1677Ca 0.01 -0.83 0.09 0.00 -0.39 0.00 0.00 64.86 63.75 2vkc h ILE 1677Cb 0.25 1.47 -0.07 0.00 -3.07 0.00 0.00 36.82 35.40 2vkc h ILE 1677CO 0.02 0.19 0.30 0.15 -0.69 0.00 0.00 178.15 178.11 2vkc h PHE 1678N -0.62 0.53 -0.50 1.37 3.57 -0.55 0.07 116.94 120.81 2vkc h PHE 1678Ca -0.02 0.03 -0.04 0.00 3.53 0.00 0.00 57.97 61.47 2vkc h PHE 1678Cb 0.47 -0.14 -0.02 0.00 2.79 0.00 0.00 35.95 39.05 2vkc h PHE 1678CO 0.05 0.17 0.14 0.93 -2.23 0.00 0.00 178.31 177.37 2vkc h GLU 1679N 0.51 0.78 -0.23 1.11 5.08 -0.76 0.40 114.58 121.48 2vkc h GLU 1679Ca 0.33 -0.17 -0.14 0.00 -1.00 0.00 0.00 59.36 58.37 2vkc h GLU 1679Cb 0.38 -0.11 -0.01 0.00 0.50 0.00 0.00 28.75 29.51 2vkc h GLU 1679CO -0.29 0.74 -0.45 1.57 -1.00 0.00 0.00 179.01 179.59 2vkc h LYS 1680N 0.67 0.58 0.20 2.33 2.10 -0.84 -1.86 116.57 119.75 2vkc h LYS 1680Ca 0.16 -0.32 -0.01 0.00 -2.00 0.00 0.00 60.65 58.48 2vkc h LYS 1680Cb 0.29 0.02 0.00 0.00 -0.90 0.00 0.00 32.23 31.64 2vkc h LYS 1680CO -0.00 0.92 -0.09 0.28 -2.00 0.00 0.00 179.45 178.55 2vkc h VAL 1681N 0.47 0.89 0.00 0.07 2.07 -0.78 -3.16 116.25 115.82 2vkc h VAL 1681Ca 0.03 -0.77 -0.02 0.00 0.82 0.00 0.00 66.70 66.77 2vkc h VAL 1681Cb 0.97 1.33 -0.00 0.00 -1.52 0.00 0.00 31.29 32.06 2vkc h VAL 1681CO 0.09 0.17 -0.07 -0.55 0.02 0.00 0.00 177.57 177.22 2vkc h ASN 1682N -0.67 0.00 -0.91 0.57 -0.00 -0.16 0.29 115.58 114.70 2vkc h ASN 1682Ca -0.03 0.00 0.06 0.00 -0.00 0.00 0.00 56.30 56.34 2vkc h ASN 1682Cb 0.48 0.00 -0.06 0.00 -0.00 0.00 0.00 38.32 38.73 2vkc h ASN 1682CO 0.04 0.07 0.58 0.00 -0.00 0.00 0.00 177.43 178.12 2vkc h ALA 1683N 1.93 1.26 0.00 4.14 0.00 -1.29 -0.20 119.26 125.09 2vkc h ALA 1683Ca -0.00 -0.01 -0.31 0.00 0.00 0.00 0.00 54.91 54.58 2vkc h ALA 1683Cb 0.28 -0.26 -0.06 0.00 0.00 0.00 0.00 17.79 17.75 2vkc h ALA 1683CO 0.01 0.34 -2.17 -1.13 0.00 0.00 0.00 179.25 176.30 2vkc n SER 1684N -4.57 1.26 0.08 0.00 3.41 -0.83 -4.63 113.62 108.33 2vkc n SER 1684Ca 0.13 -0.03 -0.22 0.00 -0.26 0.00 0.00 58.87 58.50 2vkc n SER 1684Cb 0.18 0.56 -0.12 0.00 -0.26 0.00 0.00 64.21 64.57 2vkc n SER 1684CO 0.00 0.00 0.00 -0.07 -0.16 0.00 0.00 175.04 174.81 2vkc h LEU 1685N 0.00 0.90 -0.56 1.04 -0.00 -0.43 -3.36 115.31 112.89 2vkc h LEU 1685Ca -0.46 -0.79 -0.02 0.00 -0.00 0.00 0.00 57.88 56.61 2vkc h LEU 1685Cb 1.96 -0.28 -0.03 0.00 -0.00 0.00 0.00 40.66 42.31 2vkc h LEU 1685CO -0.00 1.59 0.27 0.25 -0.00 0.00 0.00 178.44 180.55 2vkc h LEU 1686N 0.32 0.73 0.00 1.67 6.46 -0.98 -1.37 115.31 122.13 2vkc h LEU 1686Ca -0.17 -0.12 0.00 0.00 -0.12 0.00 0.00 57.88 57.46 2vkc h LEU 1686Cb 1.85 -0.19 0.00 0.00 -0.73 0.00 0.00 40.66 41.59 2vkc h LEU 1686CO 0.23 0.65 0.00 -0.81 -0.62 0.00 0.00 178.44 177.89 2vkc n PRO 1687N -4.56 0.40 -0.35 5.25 -0.04 -1.26 -1.27 135.00 133.17 2vkc n PRO 1687Ca 0.03 0.00 0.07 0.00 -0.04 0.00 0.00 63.50 63.56 2vkc n PRO 1687Cb 0.12 -1.18 0.22 0.00 -0.04 0.00 0.00 33.50 32.62 2vkc n PRO 1687CO 0.00 0.00 0.00 1.04 -0.04 0.00 0.00 175.50 176.50 2vkc n GLN 1688N -0.68 3.01 -3.06 0.54 6.02 -0.53 -4.93 117.38 117.75 2vkc n GLN 1688Ca 0.03 -2.49 -0.18 0.00 -0.01 0.00 0.00 57.00 54.36 2vkc n GLN 1688Cb 0.02 -1.59 0.04 0.00 1.02 0.00 0.00 30.24 29.73 2vkc n GLN 1688CO 0.00 0.00 0.00 0.09 -1.01 0.00 0.00 177.06 176.14 2vkc n ASN 1689N 0.14 -5.18 -4.26 1.08 4.13 -0.39 -4.94 115.26 105.84 2vkc n ASN 1689Ca 0.17 -0.30 -0.30 0.00 1.68 0.00 0.00 54.58 55.83 2vkc n ASN 1689Cb 0.68 -3.92 -0.16 0.00 -1.54 0.00 0.00 39.78 34.84 2vkc n ASN 1689CO 0.00 0.00 0.00 -0.69 0.28 0.00 0.00 177.26 176.85 2vkc s VAL 1690N -3.12 1.93 -0.30 2.41 1.01 -1.14 -1.48 120.40 119.69 2vkc s VAL 1690Ca 0.33 -1.01 0.02 0.00 0.00 0.00 0.00 61.98 61.32 2vkc s VAL 1690Cb -0.14 -1.62 0.09 0.00 0.00 0.00 0.00 36.38 34.70 2vkc s VAL 1690CO 0.40 0.54 0.03 -0.22 0.00 0.00 0.00 175.10 175.85 2vkc s LEU 1691N -0.28 3.62 -0.19 3.92 1.98 0.33 -3.18 118.68 124.88 2vkc s LEU 1691Ca 0.01 -1.77 -0.03 0.00 -2.89 0.00 0.00 54.13 49.45 2vkc s LEU 1691Cb -0.12 -1.35 -0.01 0.00 0.66 0.00 0.00 46.19 45.37 2vkc s LEU 1691CO 0.02 -0.34 -0.07 -0.62 -1.89 0.00 0.00 176.35 173.44 2vkc s ASP 1692N 1.18 4.20 -0.17 3.68 -1.08 -1.26 -0.63 116.67 122.60 2vkc s ASP 1692Ca 0.05 -0.36 0.22 0.00 -0.52 0.00 0.00 52.55 51.94 2vkc s ASP 1692Cb -0.19 -1.69 0.45 0.00 -1.46 0.00 0.00 42.92 40.03 2vkc s ASP 1692CO -0.11 0.05 1.16 0.00 0.52 0.00 0.00 175.17 176.79 2vkc n LEU 1693N 4.31 1.00 -4.69 -1.34 -0.00 -0.78 -4.66 117.00 110.85 2vkc n LEU 1693Ca -0.18 -2.65 -0.42 0.00 -0.00 0.00 0.00 56.01 52.76 2vkc n LEU 1693Cb 0.51 0.26 -0.03 0.00 -0.00 0.00 0.00 43.42 44.17 2vkc n LEU 1693CO 0.30 0.94 1.31 -1.38 -0.00 0.00 0.00 177.39 178.55 2vkc s HIS 1694N -2.03 2.46 0.00 1.47 -3.43 -1.20 -2.30 115.29 110.27 2vkc s HIS 1694Ca 0.26 0.36 0.00 0.00 -0.80 0.00 0.00 55.06 54.89 2vkc s HIS 1694Cb 0.34 -3.94 0.00 0.00 -1.43 0.00 0.00 32.58 27.55 2vkc s HIS 1694CO -0.09 -3.75 0.00 0.41 -2.00 0.00 0.00 174.74 169.32 2vkc n GLY 1695N 3.96 2.34 3.70 -1.38 0.00 -1.26 -4.84 105.19 107.72 2vkc n GLY 1695Ca 0.16 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.89 2vkc n GLY 1695CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2vkc s LEU 1696N 0.00 1.67 0.50 0.99 2.01 -0.97 -4.91 118.68 117.96 2vkc s LEU 1696Ca 0.00 1.10 -0.02 0.00 0.01 0.00 0.00 54.13 55.22 2vkc s LEU 1696Cb 0.00 -3.31 -0.00 0.00 0.01 0.00 0.00 46.19 42.89 2vkc s LEU 1696CO 0.00 -3.01 0.75 -1.00 1.01 0.00 0.00 176.35 174.10 2vkc s HIS 1697N -3.06 3.24 0.17 0.29 3.76 -1.26 -4.84 115.29 113.59 2vkc s HIS 1697Ca 0.65 0.38 -0.17 0.00 -0.15 0.00 0.00 55.06 55.76 2vkc s HIS 1697Cb -0.18 -2.45 0.11 0.00 1.11 0.00 0.00 32.58 31.17 2vkc s HIS 1697CO 0.56 -0.51 1.65 0.28 -0.85 0.00 0.00 174.74 175.88 2vkc h VAL 1698N 0.21 0.52 0.24 -0.90 2.07 -1.96 0.20 116.25 116.63 2vkc h VAL 1698Ca -0.46 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.06 2vkc h VAL 1698Cb 1.25 0.52 -0.02 0.00 -1.52 0.00 0.00 31.29 31.52 2vkc h VAL 1698CO 0.58 0.00 -0.23 0.44 0.02 0.00 0.00 177.57 178.38 2vkc h ASP 1699N -0.04 -0.63 0.06 0.57 5.19 -1.98 -1.86 116.42 117.73 2vkc h ASP 1699Ca 0.20 0.06 -0.00 0.00 -0.62 0.00 0.00 57.03 56.67 2vkc h ASP 1699Cb 0.35 0.22 0.00 0.00 0.18 0.00 0.00 39.33 40.08 2vkc h ASP 1699CO -0.45 -0.35 -0.03 -0.33 -3.12 0.00 0.00 179.24 174.96 2vkc h GLU 1700N -0.50 -0.08 -0.82 3.56 5.08 -1.86 -2.76 114.58 117.20 2vkc h GLU 1700Ca -0.00 0.01 0.12 0.00 -1.00 0.00 0.00 59.36 58.48 2vkc h GLU 1700Cb 0.47 0.02 -0.08 0.00 0.50 0.00 0.00 28.75 29.65 2vkc h GLU 1700CO -0.05 0.23 0.43 0.00 -1.00 0.00 0.00 179.01 178.62 2vkc h ALA 1701N 0.52 1.19 -0.51 3.43 0.00 -0.57 -0.76 119.26 122.57 2vkc h ALA 1701Ca -0.01 0.06 -0.01 0.00 0.00 0.00 0.00 54.91 54.95 2vkc h ALA 1701Cb 0.35 -0.06 -0.02 0.00 0.00 0.00 0.00 17.79 18.06 2vkc h ALA 1701CO 0.01 -0.02 0.27 -0.07 0.00 0.00 0.00 179.25 179.44 2vkc h LEU 1702N 0.67 0.65 -0.11 0.00 3.38 -1.25 0.13 115.31 118.78 2vkc h LEU 1702Ca 0.42 -0.11 0.01 0.00 0.09 0.00 0.00 57.88 58.30 2vkc h LEU 1702Cb 0.51 -0.17 -0.01 0.00 0.09 0.00 0.00 40.66 41.08 2vkc h LEU 1702CO -0.31 0.57 0.02 -0.33 0.09 0.00 0.00 178.44 178.48 2vkc h GLU 1703N 0.68 0.07 -0.57 1.13 5.08 -0.91 0.06 114.58 120.12 2vkc h GLU 1703Ca 0.18 -0.00 -0.11 0.00 -1.00 0.00 0.00 59.36 58.42 2vkc h GLU 1703Cb 0.08 -0.02 -0.02 0.00 0.50 0.00 0.00 28.75 29.29 2vkc h GLU 1703CO -0.03 0.04 -0.08 0.45 -1.00 0.00 0.00 179.01 178.40 2vkc h HIS 1704N 0.07 1.17 -0.00 4.33 3.86 -1.01 -3.13 115.15 120.43 2vkc h HIS 1704Ca 0.05 -0.23 -0.00 0.00 -1.16 0.00 0.00 60.37 59.02 2vkc h HIS 1704Cb 0.04 -0.29 -0.00 0.00 1.06 0.00 0.00 27.41 28.21 2vkc h HIS 1704CO -0.11 1.06 -0.00 1.25 0.86 0.00 0.00 177.93 180.99 2vkc h LEU 1705N 0.94 0.00 -1.11 2.43 7.12 -0.51 -3.10 115.31 121.08 2vkc h LEU 1705Ca 0.15 -0.34 0.01 0.00 0.13 0.00 0.00 57.88 57.83 2vkc h LEU 1705Cb 0.65 -0.00 -0.05 0.00 -0.53 0.00 0.00 40.66 40.73 2vkc h LEU 1705CO 0.04 0.34 0.60 0.00 -0.13 0.00 0.00 178.44 179.30 2vkc h MET 1706N -0.34 1.19 -0.28 1.25 -0.00 -1.02 0.66 114.93 116.39 2vkc h MET 1706Ca 0.00 -0.07 -0.15 0.00 -0.00 0.00 0.00 59.70 59.48 2vkc h MET 1706Cb 0.34 -0.27 -0.01 0.00 -0.00 0.00 0.00 31.60 31.67 2vkc h MET 1706CO 0.00 0.79 -0.44 0.07 -0.00 0.00 0.00 176.91 177.33 2vkc h ARG 1707N 1.23 0.71 -0.00 -0.10 0.11 -1.58 -2.51 114.38 112.23 2vkc h ARG 1707Ca 0.34 -0.39 -0.24 0.00 0.10 0.00 0.00 59.98 59.78 2vkc h ARG 1707Cb -0.13 0.02 0.02 0.00 1.11 0.00 0.00 29.97 30.99 2vkc h ARG 1707CO -0.08 1.01 -0.95 0.28 0.10 0.00 0.00 179.97 180.33 2vkc h VAL 1708N 0.58 1.31 -0.44 0.08 2.07 -1.33 -3.08 116.25 115.43 2vkc h VAL 1708Ca 0.04 -2.20 0.01 0.00 0.82 0.00 0.00 66.70 65.36 2vkc h VAL 1708Cb 0.99 2.41 -0.02 0.00 -1.52 0.00 0.00 31.29 33.15 2vkc h VAL 1708CO 0.09 0.68 0.28 0.25 0.02 0.00 0.00 177.57 178.89 2vkc h LEU 1709N 0.31 0.49 -0.50 2.57 6.46 -0.83 0.19 115.31 123.99 2vkc h LEU 1709Ca -0.12 -0.01 -0.07 0.00 -0.12 0.00 0.00 57.88 57.57 2vkc h LEU 1709Cb 1.62 -0.12 -0.02 0.00 -0.73 0.00 0.00 40.66 41.41 2vkc h LEU 1709CO 0.19 0.35 0.05 1.05 -0.62 0.00 0.00 178.44 179.46 2vkc h GLU 1710N 0.58 0.85 -0.14 1.25 4.11 -1.55 -1.85 114.58 117.83 2vkc h GLU 1710Ca 0.16 -0.24 -0.19 0.00 0.07 0.00 0.00 59.36 59.16 2vkc h GLU 1710Cb -0.05 -0.09 0.00 0.00 0.50 0.00 0.00 28.75 29.10 2vkc h GLU 1710CO -0.04 0.86 -0.69 1.57 0.07 0.00 0.00 179.01 180.77 2vkc h LYS 1711N 0.72 0.59 0.00 1.06 2.10 -1.36 -2.63 116.57 117.06 2vkc h LYS 1711Ca 0.15 -0.45 -0.12 0.00 -2.00 0.00 0.00 60.65 58.23 2vkc h LYS 1711Cb 0.44 0.08 -0.02 0.00 -0.90 0.00 0.00 32.23 31.84 2vkc h LYS 1711CO 0.02 1.07 -0.56 0.87 -2.00 0.00 0.00 179.45 178.85 2vkc h LYS 1712N 0.42 0.00 -0.68 0.07 1.79 -0.58 0.42 116.57 118.01 2vkc h LYS 1712Ca -0.03 0.00 -0.04 0.00 -2.18 0.00 0.00 60.65 58.40 2vkc h LYS 1712Cb 1.28 0.00 -0.03 0.00 -1.58 0.00 0.00 32.23 31.90 2vkc h LYS 1712CO 0.13 0.56 0.25 1.15 -1.08 0.00 0.00 179.45 180.46 2vkc h THR 1713N 0.00 1.24 -0.11 -0.16 2.02 -1.17 0.52 112.91 115.25 2vkc h THR 1713Ca -0.01 -0.79 -0.11 0.00 0.77 0.00 0.00 66.41 66.27 2vkc h THR 1713Cb 1.00 0.45 0.00 0.00 -1.74 0.00 0.00 68.15 67.87 2vkc h THR 1713CO 0.07 0.31 -0.38 -0.33 0.37 0.00 0.00 175.52 175.57 2vkc h GLU 1714N 0.99 0.45 -0.96 6.66 5.08 -1.03 -3.17 114.58 122.60 2vkc h GLU 1714Ca 0.23 -0.34 0.12 0.00 -1.00 0.00 0.00 59.36 58.37 2vkc h GLU 1714Cb 0.23 0.06 -0.08 0.00 0.50 0.00 0.00 28.75 29.46 2vkc h GLU 1714CO -0.02 0.96 0.61 0.93 -1.00 0.00 0.00 179.01 180.50 2vkc h GLU 1715N 0.03 0.89 -0.35 2.33 4.39 0.11 0.36 114.58 122.33 2vkc h GLU 1715Ca -0.02 -0.05 0.05 0.00 0.34 0.00 0.00 59.36 59.68 2vkc h GLU 1715Cb 1.01 -0.20 -0.05 0.00 -0.10 0.00 0.00 28.75 29.41 2vkc h GLU 1715CO 0.08 0.59 0.06 0.35 -1.16 0.00 0.00 179.01 178.92 2vkc h PHE 1716N 0.91 0.09 0.00 4.33 3.57 -0.89 0.23 116.94 125.18 2vkc h PHE 1716Ca 0.47 0.02 -0.23 0.00 3.53 0.00 0.00 57.97 61.76 2vkc h PHE 1716Cb 0.52 0.01 -0.04 0.00 2.79 0.00 0.00 35.95 39.23 2vkc h PHE 1716CO -0.00 0.00 -1.54 1.57 -2.23 0.00 0.00 178.31 176.11 2vkc h LYS 1717N 0.17 0.00 0.00 1.11 2.10 -1.33 -2.87 116.57 115.75 2vkc h LYS 1717Ca 0.17 0.00 -0.03 0.00 -2.00 0.00 0.00 60.65 58.78 2vkc h LYS 1717Cb 0.20 0.00 -0.00 0.00 -0.90 0.00 0.00 32.23 31.52 2vkc h LYS 1717CO -0.23 0.40 -0.33 1.96 -2.00 0.00 0.00 179.45 179.25 2vkc h GLN 1718N 0.00 0.00 0.00 0.07 4.20 -0.25 -3.40 115.11 115.73 2vkc h GLN 1718Ca -0.22 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.49 2vkc h GLN 1718Cb 1.80 0.00 0.00 0.00 0.30 0.00 0.00 27.48 29.58 2vkc h GLN 1718CO 0.06 0.31 -1.21 0.09 -0.67 0.00 0.00 178.83 177.41 2vkc n ASN 1719N -4.65 0.64 -0.44 1.46 3.02 0.55 -4.98 115.26 110.85 2vkc n ASN 1719Ca -0.08 -0.51 0.00 0.00 -0.03 0.00 0.00 54.58 53.96 2vkc n ASN 1719Cb 0.26 1.14 0.00 0.00 -0.61 0.00 0.00 39.78 40.56 2vkc n ASN 1719CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2vkc n GLY 1720N 1.41 0.73 1.75 7.41 0.00 0.34 -4.99 105.19 111.84 2vkc n GLY 1720Ca 0.02 -0.34 -0.13 0.00 0.00 0.00 0.00 46.02 45.56 2vkc n GLY 1720CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2vkc n GLY 1721N -0.44 -1.04 3.77 -0.02 0.00 -0.90 -4.92 105.19 101.63 2vkc n GLY 1721Ca 0.00 -1.73 -0.39 0.00 0.00 0.00 0.00 46.02 43.91 2vkc n GLY 1721CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2vkc s LYS 1722N -4.23 3.94 0.00 1.61 3.01 -1.26 -4.62 119.74 118.18 2vkc s LYS 1722Ca 0.34 2.01 0.00 0.00 -1.01 0.00 0.00 55.97 57.30 2vkc s LYS 1722Cb -0.01 -2.67 0.00 0.00 -1.01 0.00 0.00 37.83 34.14 2vkc s LYS 1722CO 0.23 -0.47 0.50 -0.35 0.51 0.00 0.00 175.35 175.77 2vkc n PRO 1723N -0.01 0.84 -3.77 -1.68 -0.04 -1.26 -4.71 135.00 124.38 2vkc n PRO 1723Ca 0.05 0.00 -0.10 0.00 -0.04 0.00 0.00 63.50 63.41 2vkc n PRO 1723Cb 0.45 -1.35 -0.05 0.00 -0.04 0.00 0.00 33.50 32.51 2vkc n PRO 1723CO 0.00 0.00 0.00 1.52 -0.04 0.00 0.00 175.50 176.98 2vkc s TYR 1724N -1.18 -0.00 -0.07 0.54 1.13 -1.26 -0.55 117.35 115.95 2vkc s TYR 1724Ca 0.00 -0.35 -0.01 0.00 -1.41 0.00 0.00 57.07 55.31 2vkc s TYR 1724Cb 0.00 0.21 0.03 0.00 -1.10 0.00 0.00 41.96 41.09 2vkc s TYR 1724CO 0.00 -0.77 -0.02 -0.51 -2.51 0.00 0.00 175.55 171.74 2vkc s LEU 1725N -2.87 0.85 -0.45 -3.49 1.43 0.10 -4.84 118.68 109.41 2vkc s LEU 1725Ca 0.09 -0.13 -0.20 0.00 -1.03 0.00 0.00 54.13 52.86 2vkc s LEU 1725Cb 0.01 -0.51 0.03 0.00 0.03 0.00 0.00 46.19 45.75 2vkc s LEU 1725CO -0.06 -0.15 0.61 -0.44 0.23 0.00 0.00 176.35 176.54 2vkc s SER 1726N 1.70 6.29 -0.36 2.29 0.01 -0.55 -0.05 113.70 123.03 2vkc s SER 1726Ca 0.02 -0.46 -0.16 0.00 1.31 0.00 0.00 55.95 56.65 2vkc s SER 1726Cb -0.13 -2.30 -0.00 0.00 0.21 0.00 0.00 66.02 63.80 2vkc s SER 1726CO -0.05 -0.77 0.38 -0.69 0.41 0.00 0.00 173.24 172.52 2vkc s VAL 1727N 2.70 5.15 -0.40 3.43 1.01 0.65 -0.51 120.40 132.43 2vkc s VAL 1727Ca 0.20 -0.06 -0.17 0.00 0.00 0.00 0.00 61.98 61.95 2vkc s VAL 1727Cb -0.15 -3.87 0.01 0.00 0.00 0.00 0.00 36.38 32.37 2vkc s VAL 1727CO 0.17 -0.17 0.43 -0.63 0.00 0.00 0.00 175.10 174.90 2vkc s ILE 1728N 2.04 5.10 -0.28 2.22 1.09 0.20 -0.34 121.20 131.23 2vkc s ILE 1728Ca 0.12 -0.20 0.22 0.00 -1.10 0.00 0.00 60.65 59.69 2vkc s ILE 1728Cb -0.17 -3.98 -0.16 0.00 -1.06 0.00 0.00 42.46 37.09 2vkc s ILE 1728CO 0.12 -0.33 0.83 0.35 -0.10 0.00 0.00 174.94 175.81 2vkc n THR 1729N 5.40 0.26 -1.49 2.92 -2.24 -0.60 -1.86 114.28 116.67 2vkc n THR 1729Ca -0.07 -0.44 -0.03 0.00 -2.27 0.00 0.00 64.05 61.24 2vkc n THR 1729Cb 0.48 -0.04 -0.01 0.00 -2.10 0.00 0.00 70.33 68.66 2vkc n THR 1729CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2vkc n GLY 1730N 1.27 0.47 3.66 3.38 0.00 -1.15 -4.25 105.19 108.56 2vkc n GLY 1730Ca -0.01 -0.85 -0.43 0.00 0.00 0.00 0.00 46.02 44.73 2vkc n GLY 1730CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 2vkc s ARG 1731N -3.05 4.21 -0.71 1.61 3.00 -1.17 -2.43 118.95 120.40 2vkc s ARG 1731Ca 0.00 1.76 -0.00 0.00 -1.00 0.00 0.00 55.73 56.49 2vkc s ARG 1731Cb 0.00 -3.82 -0.00 0.00 0.00 0.00 0.00 34.95 31.13 2vkc s ARG 1731CO 0.00 -0.76 0.60 0.41 0.00 0.00 0.00 175.30 175.55 2vkc n GLY 1732N 3.76 -0.07 1.99 8.12 0.00 -1.11 -1.76 105.19 116.12 2vkc n GLY 1732Ca 0.15 -0.09 -0.37 0.00 0.00 0.00 0.00 46.02 45.71 2vkc n GLY 1732CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 2vkc n ASN 1733N -2.31 0.49 0.00 1.61 5.15 -1.02 -3.37 115.26 115.82 2vkc n ASN 1733Ca -0.16 0.46 0.00 0.00 -0.60 0.00 0.00 54.58 54.27 2vkc n ASN 1733Cb 0.60 -0.54 0.00 0.00 -0.53 0.00 0.00 39.78 39.31 2vkc n ASN 1733CO 0.00 0.00 0.00 1.57 1.40 0.00 0.00 177.26 180.23 2vkc n HIS 1734N 4.14 0.00 -3.16 1.20 -0.00 -1.26 -3.92 115.22 112.22 2vkc n HIS 1734Ca 0.31 0.00 0.03 0.00 0.46 0.00 0.00 57.72 58.51 2vkc n HIS 1734Cb -0.03 0.00 -0.00 0.00 -0.12 0.00 0.00 29.99 29.84 2vkc n HIS 1734CO 0.00 0.00 0.00 -1.12 0.46 0.00 0.00 176.34 175.68 2vkc s SER 1735N -4.00 -1.51 0.00 0.26 0.01 -1.22 -3.86 113.70 103.39 2vkc s SER 1735Ca 0.00 -0.22 0.00 0.00 1.31 0.00 0.00 55.95 57.04 2vkc s SER 1735Cb 0.00 1.93 0.00 0.00 0.21 0.00 0.00 66.02 68.16 2vkc s SER 1735CO 0.00 -0.23 0.00 1.67 0.41 0.00 0.00 173.24 175.09 2vkc n GLN 1736N 4.95 0.00 -3.61 12.44 -0.06 -1.25 -5.17 117.38 124.68 2vkc n GLN 1736Ca 0.08 0.00 0.00 0.00 -2.00 0.00 0.00 57.00 55.08 2vkc n GLN 1736Cb 0.56 0.00 0.00 0.00 -4.06 0.00 0.00 30.24 26.74 2vkc n GLN 1736CO 0.00 0.00 0.00 0.41 -0.20 0.00 0.00 177.06 177.27 2vkc n GLY 1737N -0.60 -2.03 0.00 1.69 0.00 -1.26 -4.99 105.19 98.00 2vkc n GLY 1737Ca 0.00 -1.17 0.00 0.00 0.00 0.00 0.00 46.02 44.85 2vkc n GLY 1737CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2vkc n GLY 1738N -0.48 4.69 3.64 -0.02 0.00 -1.26 -3.54 105.19 108.22 2vkc n GLY 1738Ca 0.00 -1.08 -0.41 0.00 0.00 0.00 0.00 46.02 44.52 2vkc n GLY 1738CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2vkc s VAL 1739N -1.11 4.91 -0.39 1.61 1.01 -1.26 -2.73 120.40 122.43 2vkc s VAL 1739Ca 0.00 1.39 0.01 0.00 0.00 0.00 0.00 61.98 63.38 2vkc s VAL 1739Cb 0.00 -4.04 0.12 0.00 0.00 0.00 0.00 36.38 32.46 2vkc s VAL 1739CO 0.00 -0.02 0.19 0.00 0.00 0.00 0.00 175.10 175.27 2vkc s ALA 1740N 2.60 1.84 -0.61 5.51 0.00 -1.26 -4.94 121.76 124.89 2vkc s ALA 1740Ca 0.32 -2.23 0.12 0.00 0.00 0.00 0.00 51.96 50.17 2vkc s ALA 1740Cb -0.15 -1.78 0.62 0.00 0.00 0.00 0.00 23.12 21.80 2vkc s ALA 1740CO 0.08 -1.94 1.36 0.54 0.00 0.00 0.00 175.76 175.80 2vkc n ARG 1741N 4.02 0.07 -0.25 0.00 5.12 -1.26 -1.70 116.66 122.66 2vkc n ARG 1741Ca 0.06 0.55 -0.07 0.00 -1.93 0.00 0.00 57.85 56.45 2vkc n ARG 1741Cb 0.37 -1.73 0.04 0.00 -1.16 0.00 0.00 32.46 29.99 2vkc n ARG 1741CO 0.00 0.00 0.00 0.82 -1.93 0.00 0.00 177.63 176.52 2vkc h ILE 1742N 0.00 1.25 0.72 0.55 2.04 -1.91 -2.81 117.51 117.36 2vkc h ILE 1742Ca 0.00 -0.82 -0.04 0.00 1.00 0.00 0.00 64.86 65.01 2vkc h ILE 1742Cb 0.03 0.49 0.01 0.00 -0.74 0.00 0.00 36.82 36.61 2vkc h ILE 1742CO 0.00 0.32 -0.35 0.50 0.00 0.00 0.00 178.15 178.62 2vkc h LYS 1743N 0.98 -0.93 -0.53 2.37 3.64 -1.66 0.13 116.57 120.57 2vkc h LYS 1743Ca 0.22 0.06 0.10 0.00 -1.27 0.00 0.00 60.65 59.77 2vkc h LYS 1743Cb 0.25 0.21 -0.03 0.00 -0.41 0.00 0.00 32.23 32.25 2vkc h LYS 1743CO -0.01 -0.60 0.36 -1.00 -2.27 0.00 0.00 179.45 175.92 2vkc h PRO 1744N -1.05 0.29 -0.01 1.90 0.13 -1.74 0.12 132.00 131.64 2vkc h PRO 1744Ca -0.10 -0.02 -0.01 0.00 -0.87 0.00 0.00 66.00 65.01 2vkc h PRO 1744Cb 0.76 -0.06 -0.00 0.00 0.13 0.00 0.00 31.00 31.83 2vkc h PRO 1744CO 0.16 0.19 -0.02 0.00 -0.23 0.00 0.00 178.00 178.10 2vkc h ALA 1745N 1.73 0.02 -0.63 -0.56 0.00 -1.21 -2.90 119.26 115.71 2vkc h ALA 1745Ca 0.25 -0.28 -0.09 0.00 0.00 0.00 0.00 54.91 54.79 2vkc h ALA 1745Cb 0.58 -0.00 -0.02 0.00 0.00 0.00 0.00 17.79 18.34 2vkc h ALA 1745CO -0.06 -0.19 0.06 0.28 0.00 0.00 0.00 179.25 179.34 2vkc h VAL 1746N -0.48 1.26 -0.72 0.00 2.07 -0.19 -2.48 116.25 115.72 2vkc h VAL 1746Ca 0.00 -1.09 0.11 0.00 0.82 0.00 0.00 66.70 66.54 2vkc h VAL 1746Cb 0.56 0.73 -0.08 0.00 -1.52 0.00 0.00 31.29 30.98 2vkc h VAL 1746CO 0.01 0.40 0.33 0.40 0.02 0.00 0.00 177.57 178.73 2vkc h ILE 1747N 0.99 0.79 -0.01 4.57 2.04 -0.80 0.69 117.51 125.77 2vkc h ILE 1747Ca 0.19 -0.19 -0.07 0.00 1.00 0.00 0.00 64.86 65.78 2vkc h ILE 1747Cb 0.50 0.19 -0.01 0.00 -0.74 0.00 0.00 36.82 36.76 2vkc h ILE 1747CO 0.02 0.10 -0.34 0.50 0.00 0.00 0.00 178.15 178.43 2vkc h LYS 1748N 0.55 0.02 -0.08 2.37 3.64 -1.28 -2.25 116.57 119.54 2vkc h LYS 1748Ca 0.37 -0.01 -0.02 0.00 -1.27 0.00 0.00 60.65 59.72 2vkc h LYS 1748Cb 0.44 -0.00 -0.00 0.00 -0.41 0.00 0.00 32.23 32.26 2vkc h LYS 1748CO -0.31 0.36 -0.04 -0.92 -2.27 0.00 0.00 179.45 176.28 2vkc h TYR 1749N 0.02 0.19 0.01 1.91 5.03 -0.45 -2.65 116.97 121.03 2vkc h TYR 1749Ca -0.00 -0.05 -0.00 0.00 2.58 0.00 0.00 58.73 61.26 2vkc h TYR 1749Cb 0.62 -0.04 0.00 0.00 1.55 0.00 0.00 36.73 38.85 2vkc h TYR 1749CO 0.00 0.53 -0.01 -0.07 -1.32 0.00 0.00 178.16 177.29 2vkc h LEU 1750N -0.21 -0.01 -1.33 2.82 -0.00 -0.94 -2.80 115.31 112.83 2vkc h LEU 1750Ca 0.02 -0.05 -0.04 0.00 -0.00 0.00 0.00 57.88 57.81 2vkc h LEU 1750Cb 0.48 0.00 -0.02 0.00 -0.00 0.00 0.00 40.66 41.12 2vkc h LEU 1750CO 0.01 0.04 0.03 0.16 -0.00 0.00 0.00 178.44 178.68 2vkc h ILE 1751N -0.06 1.18 0.00 1.22 -0.00 -1.50 -0.35 117.51 118.00 2vkc h ILE 1751Ca -0.00 -0.67 0.00 0.00 -0.00 0.00 0.00 64.86 64.19 2vkc h ILE 1751Cb 0.06 0.90 0.00 0.00 -0.00 0.00 0.00 36.82 37.78 2vkc h ILE 1751CO 0.00 0.23 0.00 0.28 -0.00 0.00 0.00 178.15 178.66 2vkc h SER 1752N 0.47 0.00 -0.33 2.16 0.02 -1.28 -2.17 113.55 112.41 2vkc h SER 1752Ca 0.11 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.06 2vkc h SER 1752Cb 0.26 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.80 2vkc h SER 1752CO 0.00 0.00 0.00 1.41 -1.14 0.00 0.00 176.83 177.10 2vkc n HIS 1753N -2.54 0.44 -2.72 3.45 8.25 -0.55 -4.98 115.22 116.58 2vkc n HIS 1753Ca 0.02 -0.48 -0.17 0.00 -0.26 0.00 0.00 57.72 56.83 2vkc n HIS 1753Cb 0.29 -0.03 0.02 0.00 1.12 0.00 0.00 29.99 31.40 2vkc n HIS 1753CO 0.00 0.00 0.00 0.45 0.64 0.00 0.00 176.34 177.43 2vkc n SER 1754N 0.52 -5.13 -4.45 0.41 2.88 -0.73 -5.01 113.62 102.10 2vkc n SER 1754Ca 0.11 -0.17 -0.29 0.00 -1.33 0.00 0.00 58.87 57.19 2vkc n SER 1754Cb 0.42 -4.04 0.15 0.00 -0.75 0.00 0.00 64.21 59.98 2vkc n SER 1754CO 0.00 0.00 0.00 -0.36 -1.23 0.00 0.00 175.04 173.45 2vkc s PHE 1755N -2.99 2.13 -0.16 0.66 0.08 -0.25 -5.01 117.98 112.44 2vkc s PHE 1755Ca 0.18 0.51 0.00 0.00 0.12 0.00 0.00 56.93 57.74 2vkc s PHE 1755Cb -0.08 -3.83 0.03 0.00 -0.57 0.00 0.00 43.02 38.57 2vkc s PHE 1755CO 0.22 -2.33 -0.12 1.03 -0.10 0.00 0.00 175.22 173.91 2vkc s ARG 1756N -5.73 2.15 0.05 0.44 3.00 -1.26 -4.72 118.95 112.88 2vkc s ARG 1756Ca 0.69 -0.64 -0.01 0.00 0.00 0.00 0.00 55.73 55.77 2vkc s ARG 1756Cb -0.07 -2.19 -0.03 0.00 0.00 0.00 0.00 34.95 32.66 2vkc s ARG 1756CO 0.52 -0.31 -0.01 -0.59 0.00 0.00 0.00 175.30 174.90 2vkc s PHE 1757N 1.47 0.44 -0.15 -0.53 -0.71 -1.26 0.32 117.98 117.56 2vkc s PHE 1757Ca 0.03 -0.93 -0.11 0.00 -1.04 0.00 0.00 56.93 54.88 2vkc s PHE 1757Cb -0.14 -0.33 0.05 0.00 -1.21 0.00 0.00 43.02 41.39 2vkc s PHE 1757CO -0.10 -0.35 0.39 0.45 -1.34 0.00 0.00 175.22 174.27 2vkc s SER 1758N -2.62 -0.44 -0.11 1.98 0.15 -0.17 -4.94 113.70 107.55 2vkc s SER 1758Ca 0.02 0.81 -0.29 0.00 0.70 0.00 0.00 55.95 57.19 2vkc s SER 1758Cb 0.04 0.76 -0.01 0.00 -1.71 0.00 0.00 66.02 65.10 2vkc s SER 1758CO -0.08 -0.16 1.01 -0.70 1.20 0.00 0.00 173.24 174.50 2vkc s GLU 1759N 0.77 4.42 -0.04 5.44 2.12 -1.26 0.18 118.70 130.34 2vkc s GLU 1759Ca -0.05 1.39 -0.10 0.00 0.36 0.00 0.00 54.97 56.57 2vkc s GLU 1759Cb -0.06 -3.54 -0.06 0.00 0.26 0.00 0.00 34.13 30.73 2vkc s GLU 1759CO -0.06 -0.32 0.50 0.82 -0.54 0.00 0.00 175.26 175.66 2vkc h ILE 1760N 5.10 0.00 0.00 -3.70 2.04 -1.52 -3.48 117.51 115.96 2vkc h ILE 1760Ca -0.31 -0.51 0.00 0.00 1.00 0.00 0.00 64.86 65.04 2vkc h ILE 1760Cb 1.15 0.00 0.00 0.00 -0.74 0.00 0.00 36.82 37.23 2vkc h ILE 1760CO 0.86 0.00 0.00 1.17 0.00 0.00 0.00 178.15 180.18 2vkc n LYS 1761N -4.41 0.00 0.00 2.37 4.81 -1.26 -5.02 118.16 114.65 2vkc n LYS 1761Ca -0.05 0.00 0.00 0.00 -0.87 0.00 0.00 58.31 57.39 2vkc n LYS 1761Cb 0.14 0.00 0.00 0.00 0.02 0.00 0.00 35.03 35.19 2vkc n LYS 1761CO 0.00 0.00 0.00 -2.30 1.17 0.00 0.00 177.40 176.27 2vkc n PRO 1762N 0.00 0.00 -2.25 1.64 -0.01 -1.25 0.40 135.00 133.53 2vkc n PRO 1762Ca 0.00 0.00 -0.17 0.00 -0.01 0.00 0.00 63.50 63.32 2vkc n PRO 1762Cb 0.00 0.00 -0.01 0.00 -0.01 0.00 0.00 33.50 33.48 2vkc n PRO 1762CO 0.00 0.00 0.00 0.41 -0.01 0.00 0.00 175.50 175.90 2vkc n GLY 1763N 0.00 -0.15 3.39 -1.23 0.00 -0.72 -2.95 105.19 103.52 2vkc n GLY 1763Ca 0.00 -0.16 -0.43 0.00 0.00 0.00 0.00 46.02 45.44 2vkc n GLY 1763CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2vkc s LEU 1765N 1.61 4.18 -0.46 0.00 1.43 0.54 -1.15 118.68 124.83 2vkc s LEU 1765Ca 0.04 0.20 -0.21 0.00 -1.03 0.00 0.00 54.13 53.13 2vkc s LEU 1765Cb -0.21 -2.97 0.03 0.00 0.03 0.00 0.00 46.19 43.06 2vkc s LEU 1765CO 0.07 -0.76 0.67 -0.75 0.23 0.00 0.00 176.35 175.82 2vkc s LYS 1766N 3.09 3.26 -0.10 1.70 2.20 0.13 -0.25 119.74 129.77 2vkc s LYS 1766Ca 0.30 -0.43 -0.12 0.00 -0.36 0.00 0.00 55.97 55.36 2vkc s LYS 1766Cb -0.13 -3.98 -0.05 0.00 -1.51 0.00 0.00 37.83 32.16 2vkc s LYS 1766CO 0.18 -1.09 0.27 0.08 -0.36 0.00 0.00 175.35 174.43 2vkc s VAL 1767N 2.91 5.29 -0.07 4.02 1.01 0.93 -1.00 120.40 133.49 2vkc s VAL 1767Ca 0.22 0.52 -0.10 0.00 0.00 0.00 0.00 61.98 62.62 2vkc s VAL 1767Cb -0.15 -3.57 -0.05 0.00 0.00 0.00 0.00 36.38 32.61 2vkc s VAL 1767CO 0.18 0.53 0.26 -0.04 0.00 0.00 0.00 175.10 176.03 2vkc s MET 1768N -0.53 3.65 0.27 2.72 -1.94 0.15 0.03 119.30 123.64 2vkc s MET 1768Ca 0.18 0.10 -0.09 0.00 -1.71 0.00 0.00 55.69 54.18 2vkc s MET 1768Cb -0.14 -3.20 -0.07 0.00 2.01 0.00 0.00 34.83 33.44 2vkc s MET 1768CO 0.07 0.74 0.58 -0.51 -0.01 0.00 0.00 175.02 175.89 2vkc s LEU 1769N -1.06 4.09 0.00 -0.03 1.43 0.28 -4.14 118.68 119.25 2vkc s LEU 1769Ca 0.19 0.90 0.09 0.00 -1.03 0.00 0.00 54.13 54.28 2vkc s LEU 1769Cb -0.14 -3.69 0.07 0.00 0.03 0.00 0.00 46.19 42.45 2vkc s LEU 1769CO 0.08 -0.15 0.77 2.29 0.23 0.00 0.00 176.35 179.57