#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2vkc n LYS 1667N 0.00 0.64 -0.00 0.03 3.00 -1.26 -3.42 118.16 117.15 2vkc n LYS 1667Ca 0.00 -0.05 -0.06 0.00 -0.00 0.00 0.00 58.31 58.20 2vkc n LYS 1667Cb 0.00 -1.65 -0.05 0.00 0.00 0.00 0.00 35.03 33.34 2vkc n LYS 1667CO 0.00 0.00 0.00 0.93 0.00 0.00 0.00 177.40 178.33 2vkc h GLU 1668N 0.00 -0.11 -0.36 1.64 3.07 -2.00 -3.13 114.58 113.70 2vkc h GLU 1668Ca -0.04 0.01 -0.07 0.00 -0.50 0.00 0.00 59.36 58.76 2vkc h GLU 1668Cb 1.11 0.02 -0.02 0.00 -0.84 0.00 0.00 28.75 29.03 2vkc h GLU 1668CO 0.00 0.21 -0.07 0.00 -1.40 0.00 0.00 179.01 177.75 2vkc h ALA 1669N -0.67 1.21 0.00 3.43 0.00 -2.02 -1.41 119.26 119.81 2vkc h ALA 1669Ca -0.01 -0.26 0.00 0.00 0.00 0.00 0.00 54.91 54.64 2vkc h ALA 1669Cb 0.37 -0.15 0.00 0.00 0.00 0.00 0.00 17.79 18.01 2vkc h ALA 1669CO 0.02 0.51 0.00 0.09 0.00 0.00 0.00 179.25 179.87 2vkc n ASN 1670N -4.22 0.00 0.07 0.00 4.13 -1.22 -2.50 115.26 111.53 2vkc n ASN 1670Ca 0.01 -0.84 -0.21 0.00 1.68 0.00 0.00 54.58 55.22 2vkc n ASN 1670Cb 0.31 0.00 -0.11 0.00 -1.54 0.00 0.00 39.78 38.43 2vkc n ASN 1670CO 0.00 0.00 0.00 -0.74 0.28 0.00 0.00 177.26 176.80 2vkc h HIS 1671N 0.00 1.01 -0.45 3.10 2.76 -1.19 -0.54 115.15 119.83 2vkc h HIS 1671Ca 0.00 -0.59 -0.06 0.00 -2.20 0.00 0.00 60.37 57.51 2vkc h HIS 1671Cb 0.00 -0.10 -0.02 0.00 1.55 0.00 0.00 27.41 28.85 2vkc h HIS 1671CO 0.00 1.43 0.03 -0.07 -1.30 0.00 0.00 177.93 178.02 2vkc h LEU 1672N 0.33 0.76 -1.10 0.26 -0.00 -1.60 -2.42 115.31 111.54 2vkc h LEU 1672Ca -0.16 -0.29 -0.06 0.00 -0.00 0.00 0.00 57.88 57.38 2vkc h LEU 1672Cb 1.81 -0.20 -0.02 0.00 -0.00 0.00 0.00 40.66 42.25 2vkc h LEU 1672CO 0.22 0.86 0.02 0.00 -0.00 0.00 0.00 178.44 179.54 2vkc h ALA 1673N 0.93 1.26 -0.67 1.53 0.00 -1.59 -2.70 119.26 118.02 2vkc h ALA 1673Ca 0.13 -0.22 0.02 0.00 0.00 0.00 0.00 54.91 54.84 2vkc h ALA 1673Cb 0.45 -0.18 -0.04 0.00 0.00 0.00 0.00 17.79 18.03 2vkc h ALA 1673CO 0.02 0.50 0.45 0.00 0.00 0.00 0.00 179.25 180.21 2vkc h ALA 1674N 1.40 1.57 0.01 0.00 0.00 -0.59 -0.73 119.26 120.92 2vkc h ALA 1674Ca 0.13 -0.04 -0.00 0.00 0.00 0.00 0.00 54.91 55.00 2vkc h ALA 1674Cb 0.36 -0.25 0.00 0.00 0.00 0.00 0.00 17.79 17.90 2vkc h ALA 1674CO 0.01 0.38 -0.01 0.82 0.00 0.00 0.00 179.25 180.46 2vkc h ILE 1675N 0.86 1.13 -0.26 0.00 1.08 -1.25 0.11 117.51 119.19 2vkc h ILE 1675Ca 0.26 -0.43 -0.16 0.00 -0.39 0.00 0.00 64.86 64.13 2vkc h ILE 1675Cb -0.02 1.42 -0.00 0.00 -3.07 0.00 0.00 36.82 35.14 2vkc h ILE 1675CO -0.06 0.11 -0.50 1.05 -0.69 0.00 0.00 178.15 178.06 2vkc h GLU 1676N -0.20 0.72 -0.35 2.37 4.11 -1.47 -2.22 114.58 117.53 2vkc h GLU 1676Ca -0.00 -0.43 -0.02 0.00 0.07 0.00 0.00 59.36 58.98 2vkc h GLU 1676Cb 0.19 0.04 -0.02 0.00 0.50 0.00 0.00 28.75 29.47 2vkc h GLU 1676CO 0.00 1.05 0.14 0.82 0.07 0.00 0.00 179.01 181.09 2vkc h ILE 1677N 0.56 1.19 -0.48 -1.06 1.08 -1.07 -2.72 117.51 115.02 2vkc h ILE 1677Ca 0.02 -0.58 0.08 0.00 -0.39 0.00 0.00 64.86 63.99 2vkc h ILE 1677Cb 1.07 0.91 -0.06 0.00 -3.07 0.00 0.00 36.82 35.67 2vkc h ILE 1677CO 0.10 0.21 0.11 0.15 -0.69 0.00 0.00 178.15 178.03 2vkc h PHE 1678N 0.42 0.18 0.36 1.37 3.57 -0.59 0.19 116.94 122.44 2vkc h PHE 1678Ca 0.12 0.03 -0.02 0.00 3.53 0.00 0.00 57.97 61.63 2vkc h PHE 1678Cb 0.19 -0.01 0.00 0.00 2.79 0.00 0.00 35.95 38.92 2vkc h PHE 1678CO -0.00 0.02 -0.19 0.93 -2.23 0.00 0.00 178.31 176.84 2vkc h GLU 1679N 0.25 -0.49 -0.12 1.11 5.08 -1.20 -1.54 114.58 117.67 2vkc h GLU 1679Ca 0.24 0.03 -0.14 0.00 -1.00 0.00 0.00 59.36 58.49 2vkc h GLU 1679Cb 0.30 0.11 -0.01 0.00 0.50 0.00 0.00 28.75 29.65 2vkc h GLU 1679CO -0.29 -0.33 -0.51 1.57 -1.00 0.00 0.00 179.01 178.45 2vkc h LYS 1680N -0.51 0.34 -0.34 2.33 2.10 -1.27 -3.29 116.57 115.93 2vkc h LYS 1680Ca -0.05 -0.20 -0.16 0.00 -2.00 0.00 0.00 60.65 58.25 2vkc h LYS 1680Cb 0.40 0.02 -0.00 0.00 -0.90 0.00 0.00 32.23 31.74 2vkc h LYS 1680CO 0.07 0.77 -0.42 -0.24 -2.00 0.00 0.00 179.45 177.62 2vkc h VAL 1681N 0.26 1.28 0.00 0.07 3.04 -0.36 -2.98 116.25 117.56 2vkc h VAL 1681Ca 0.01 -1.60 -0.02 0.00 -1.01 0.00 0.00 66.70 64.08 2vkc h VAL 1681Cb 0.99 1.50 -0.00 0.00 -2.01 0.00 0.00 31.29 31.77 2vkc h VAL 1681CO 0.08 0.53 -0.11 0.78 -1.01 0.00 0.00 177.57 177.85 2vkc h ASN 1682N 0.68 0.00 -0.89 3.17 -0.26 -1.35 -1.51 115.58 115.41 2vkc h ASN 1682Ca 0.04 0.00 0.01 0.00 -0.56 0.00 0.00 56.30 55.80 2vkc h ASN 1682Cb 1.02 0.00 -0.05 0.00 -1.06 0.00 0.00 38.32 38.24 2vkc h ASN 1682CO 0.10 0.11 0.59 0.00 -1.06 0.00 0.00 177.43 177.17 2vkc h ALA 1683N 1.89 1.14 -0.02 -0.83 0.00 -1.64 0.18 119.26 119.99 2vkc h ALA 1683Ca -0.00 -0.06 0.00 0.00 0.00 0.00 0.00 54.91 54.85 2vkc h ALA 1683Cb 0.23 -0.35 0.00 0.00 0.00 0.00 0.00 17.79 17.67 2vkc h ALA 1683CO 0.01 0.52 -0.29 -1.13 0.00 0.00 0.00 179.25 178.36 2vkc n SER 1684N -4.47 2.25 -0.12 0.00 3.41 -0.93 -4.43 113.62 109.33 2vkc n SER 1684Ca 0.10 -1.63 -0.15 0.00 -0.26 0.00 0.00 58.87 56.93 2vkc n SER 1684Cb 0.02 0.32 -0.12 0.00 -0.26 0.00 0.00 64.21 64.17 2vkc n SER 1684CO 0.00 0.00 0.00 0.18 -0.16 0.00 0.00 175.04 175.06 2vkc n LEU 1685N 0.40 2.20 -0.31 1.04 4.77 -0.62 -4.57 117.00 119.91 2vkc n LEU 1685Ca 0.10 -0.10 -0.03 0.00 -0.03 0.00 0.00 56.01 55.95 2vkc n LEU 1685Cb 0.48 -0.51 0.08 0.00 -2.33 0.00 0.00 43.42 41.14 2vkc n LEU 1685CO 0.22 0.80 1.23 -0.07 -1.33 0.00 0.00 177.39 178.25 2vkc h LEU 1686N 0.00 0.98 -2.63 2.23 3.38 -0.79 -1.58 115.31 116.90 2vkc h LEU 1686Ca -0.54 -0.02 0.00 0.00 0.09 0.00 0.00 57.88 57.40 2vkc h LEU 1686Cb 1.94 -0.24 0.00 0.00 0.09 0.00 0.00 40.66 42.45 2vkc h LEU 1686CO -0.06 0.71 0.04 1.55 0.09 0.00 0.00 178.44 180.77 2vkc h PRO 1687N 1.15 0.00 -0.00 1.13 0.13 -1.81 0.10 132.00 132.71 2vkc h PRO 1687Ca 0.31 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.44 2vkc h PRO 1687Cb -0.13 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.00 2vkc h PRO 1687CO -0.07 0.00 -0.57 1.04 -0.23 0.00 0.00 178.00 178.17 2vkc n GLN 1688N -2.93 0.27 -2.87 0.86 6.02 -0.62 -4.98 117.38 113.14 2vkc n GLN 1688Ca -0.03 -0.19 -0.10 0.00 -0.01 0.00 0.00 57.00 56.67 2vkc n GLN 1688Cb 0.10 -1.50 0.05 0.00 1.02 0.00 0.00 30.24 29.92 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 -1.20 -5.82 -3.89 1.08 4.13 0.35 -5.02 115.26 104.90 2vkc n ASN 1689Ca 0.07 -0.50 -0.16 0.00 1.68 0.00 0.00 54.58 55.67 2vkc n ASN 1689Cb 0.35 -4.27 -0.15 0.00 -1.54 0.00 0.00 39.78 34.17 2vkc n ASN 1689CO 0.00 0.00 0.00 0.54 0.28 0.00 0.00 177.26 178.08 2vkc s VAL 1690N -3.27 0.32 -0.32 2.41 0.11 -1.12 -3.33 120.40 115.20 2vkc s VAL 1690Ca 0.32 -0.09 -0.00 0.00 -2.93 0.00 0.00 61.98 59.28 2vkc s VAL 1690Cb -0.04 -0.33 0.07 0.00 -1.53 0.00 0.00 36.38 34.55 2vkc s VAL 1690CO 0.59 0.13 0.02 -0.22 -3.33 0.00 0.00 175.10 172.29 2vkc s LEU 1691N 0.43 4.17 -0.09 2.54 1.98 0.13 -3.99 118.68 123.84 2vkc s LEU 1691Ca -0.04 -1.54 0.03 0.00 -2.89 0.00 0.00 54.13 49.69 2vkc s LEU 1691Cb -0.08 -1.69 0.01 0.00 0.66 0.00 0.00 46.19 45.08 2vkc s LEU 1691CO -0.01 -0.31 -0.20 -0.62 -1.89 0.00 0.00 176.35 173.32 2vkc s ASP 1692N 1.28 2.64 -0.34 3.68 2.15 -1.26 -0.25 116.67 124.56 2vkc s ASP 1692Ca -0.01 -0.47 0.13 0.00 0.43 0.00 0.00 52.55 52.63 2vkc s ASP 1692Cb -0.20 -1.21 0.41 0.00 -0.30 0.00 0.00 42.92 41.62 2vkc s ASP 1692CO -0.03 0.11 1.49 0.00 -0.17 0.00 0.00 175.17 176.57 2vkc n LEU 1693N 3.69 -1.30 -4.73 -1.34 -0.00 -1.08 -4.77 117.00 107.47 2vkc n LEU 1693Ca -0.20 -3.24 -0.42 0.00 -0.00 0.00 0.00 56.01 52.15 2vkc n LEU 1693Cb 0.52 0.11 -0.03 0.00 -0.00 0.00 0.00 43.42 44.02 2vkc n LEU 1693CO 0.27 1.70 0.96 -1.38 -0.00 0.00 0.00 177.39 178.94 2vkc s HIS 1694N -0.14 3.33 0.00 1.47 -3.43 -1.23 -3.12 115.29 112.16 2vkc s HIS 1694Ca 0.12 1.21 0.00 0.00 -0.80 0.00 0.00 55.06 55.58 2vkc s HIS 1694Cb 0.44 -3.55 0.00 0.00 -1.43 0.00 0.00 32.58 28.03 2vkc s HIS 1694CO -0.12 -1.76 0.00 0.41 -2.00 0.00 0.00 174.74 171.28 2vkc n GLY 1695N 2.81 0.32 3.93 -1.38 0.00 -1.25 -4.78 105.19 104.84 2vkc n GLY 1695Ca 0.08 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.82 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 2.71 0.63 0.99 1.02 -1.18 -4.52 118.68 118.33 2vkc s LEU 1696Ca 0.00 0.37 -0.15 0.00 0.02 0.00 0.00 54.13 54.37 2vkc s LEU 1696Cb 0.00 -2.71 -0.02 0.00 0.02 0.00 0.00 46.19 43.48 2vkc s LEU 1696CO 0.00 -2.15 1.07 -1.00 0.02 0.00 0.00 176.35 174.29 2vkc s HIS 1697N -3.57 2.90 0.21 0.29 3.76 -1.26 -4.75 115.29 112.87 2vkc s HIS 1697Ca 0.67 1.51 -0.05 0.00 -0.15 0.00 0.00 55.06 57.04 2vkc s HIS 1697Cb -0.07 -3.03 0.16 0.00 1.11 0.00 0.00 32.58 30.74 2vkc s HIS 1697CO 0.49 -1.28 1.60 -0.39 -0.85 0.00 0.00 174.74 174.31 2vkc h VAL 1698N 0.17 1.28 -0.49 -0.90 -1.51 -1.95 0.66 116.25 113.50 2vkc h VAL 1698Ca -0.46 -1.40 -0.07 0.00 -1.23 0.00 0.00 66.70 63.54 2vkc h VAL 1698Cb 1.23 1.29 -0.02 0.00 -2.13 0.00 0.00 31.29 31.65 2vkc h VAL 1698CO 0.56 0.46 0.04 -0.78 -1.23 0.00 0.00 177.57 176.63 2vkc h ASP 1699N 0.65 0.80 -0.01 4.19 3.58 -1.98 -0.22 116.42 123.44 2vkc h ASP 1699Ca 0.08 -0.28 -0.00 0.00 0.42 0.00 0.00 57.03 57.25 2vkc h ASP 1699Cb 0.79 -0.21 0.00 0.00 1.72 0.00 0.00 39.33 41.63 2vkc h ASP 1699CO 0.07 0.89 -0.01 1.05 -2.88 0.00 0.00 179.24 178.35 2vkc h GLU 1700N 0.70 0.02 -0.80 0.28 4.11 -1.89 -2.50 114.58 114.50 2vkc h GLU 1700Ca 0.14 -0.01 0.15 0.00 0.07 0.00 0.00 59.36 59.71 2vkc h GLU 1700Cb 0.45 0.00 -0.06 0.00 0.50 0.00 0.00 28.75 29.64 2vkc h GLU 1700CO 0.02 0.59 0.53 0.00 0.07 0.00 0.00 179.01 180.22 2vkc h ALA 1701N 0.43 2.05 -0.49 1.06 0.00 -0.87 -0.92 119.26 120.52 2vkc h ALA 1701Ca 0.00 0.00 -0.08 0.00 0.00 0.00 0.00 54.91 54.84 2vkc h ALA 1701Cb 0.59 -0.07 -0.02 0.00 0.00 0.00 0.00 17.79 18.29 2vkc h ALA 1701CO 0.00 -0.27 0.01 -0.07 0.00 0.00 0.00 179.25 178.92 2vkc h LEU 1702N 0.48 0.84 -0.73 0.00 3.38 -0.83 0.23 115.31 118.68 2vkc h LEU 1702Ca 0.40 -0.30 -0.11 0.00 0.09 0.00 0.00 57.88 57.95 2vkc h LEU 1702Cb 0.84 -0.22 -0.01 0.00 0.09 0.00 0.00 40.66 41.35 2vkc h LEU 1702CO -0.14 0.93 -0.24 1.05 0.09 0.00 0.00 178.44 180.13 2vkc h GLU 1703N 0.71 0.72 -0.10 1.13 -0.00 -0.78 -0.88 114.58 115.39 2vkc h GLU 1703Ca 0.14 -0.29 -0.11 0.00 -0.00 0.00 0.00 59.36 59.09 2vkc h GLU 1703Cb 0.50 -0.03 -0.01 0.00 -0.00 0.00 0.00 28.75 29.21 2vkc h GLU 1703CO 0.02 0.89 -0.45 0.45 -0.00 0.00 0.00 179.01 179.93 2vkc h HIS 1704N 0.63 0.27 0.20 2.06 -0.00 -0.98 -2.80 115.15 114.53 2vkc h HIS 1704Ca 0.09 -0.08 -0.01 0.00 -0.00 0.00 0.00 60.37 60.37 2vkc h HIS 1704Cb 0.73 -0.06 0.00 0.00 -0.00 0.00 0.00 27.41 28.09 2vkc h HIS 1704CO 0.04 0.64 -0.10 1.25 -0.00 0.00 0.00 177.93 179.76 2vkc h LEU 1705N 0.19 -0.23 -1.02 2.43 5.85 -0.68 -3.30 115.31 118.55 2vkc h LEU 1705Ca 0.01 -0.30 0.07 0.00 0.84 0.00 0.00 57.88 58.50 2vkc h LEU 1705Cb 0.87 0.06 -0.07 0.00 0.37 0.00 0.00 40.66 41.89 2vkc h LEU 1705CO 0.07 0.27 0.65 0.00 -0.34 0.00 0.00 178.44 179.09 2vkc h MET 1706N -0.83 1.13 -0.60 1.25 -0.00 -1.09 0.11 114.93 114.89 2vkc h MET 1706Ca -0.03 -0.07 -0.05 0.00 -0.00 0.00 0.00 59.70 59.55 2vkc h MET 1706Cb 0.52 -0.25 -0.02 0.00 -0.00 0.00 0.00 31.60 31.84 2vkc h MET 1706CO 0.05 0.75 0.17 0.07 -0.00 0.00 0.00 176.91 177.94 2vkc h ARG 1707N 1.16 0.94 0.03 -0.10 0.11 -1.64 -1.25 114.38 113.62 2vkc h ARG 1707Ca 0.44 -0.21 -0.22 0.00 0.10 0.00 0.00 59.98 60.08 2vkc h ARG 1707Cb 0.19 -0.13 0.02 0.00 1.11 0.00 0.00 29.97 31.16 2vkc h ARG 1707CO -0.18 0.85 -0.89 0.28 0.10 0.00 0.00 179.97 180.13 2vkc h VAL 1708N 0.86 1.35 -0.77 0.08 2.07 -1.37 -3.16 116.25 115.31 2vkc h VAL 1708Ca 0.19 -2.23 -0.02 0.00 0.82 0.00 0.00 66.70 65.46 2vkc h VAL 1708Cb 0.31 2.56 -0.04 0.00 -1.52 0.00 0.00 31.29 32.61 2vkc h VAL 1708CO -0.00 0.67 0.40 0.25 0.02 0.00 0.00 177.57 178.91 2vkc h LEU 1709N 0.14 0.98 -0.45 2.57 5.85 -0.69 0.11 115.31 123.81 2vkc h LEU 1709Ca -0.12 -0.11 -0.14 0.00 0.84 0.00 0.00 57.88 58.35 2vkc h LEU 1709Cb 1.58 -0.25 -0.01 0.00 0.37 0.00 0.00 40.66 42.35 2vkc h LEU 1709CO 0.17 0.81 -0.27 1.05 -0.34 0.00 0.00 178.44 179.86 2vkc h GLU 1710N 1.07 0.98 -0.05 1.25 4.11 -1.33 -1.83 114.58 118.77 2vkc h GLU 1710Ca 0.27 -0.45 -0.21 0.00 0.07 0.00 0.00 59.36 59.04 2vkc h GLU 1710Cb 0.06 -0.02 -0.00 0.00 0.50 0.00 0.00 28.75 29.30 2vkc h GLU 1710CO -0.04 1.12 -0.82 1.57 0.07 0.00 0.00 179.01 180.91 2vkc h LYS 1711N 0.82 0.45 0.00 1.06 2.10 -1.41 -2.68 116.57 116.91 2vkc h LYS 1711Ca 0.09 -0.41 -0.10 0.00 -2.00 0.00 0.00 60.65 58.24 2vkc h LYS 1711Cb 0.86 0.10 -0.01 0.00 -0.90 0.00 0.00 32.23 32.27 2vkc h LYS 1711CO 0.08 1.06 -0.45 0.87 -2.00 0.00 0.00 179.45 179.00 2vkc h LYS 1712N 0.29 0.00 -0.15 0.07 1.57 -0.79 0.18 116.57 117.73 2vkc h LYS 1712Ca -0.05 0.00 -0.09 0.00 -1.87 0.00 0.00 60.65 58.64 2vkc h LYS 1712Cb 1.43 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 33.72 2vkc h LYS 1712CO 0.14 0.45 -0.29 1.15 -0.57 0.00 0.00 179.45 180.34 2vkc h THR 1713N 0.00 1.26 -0.06 -0.16 2.02 -1.29 0.85 112.91 115.54 2vkc h THR 1713Ca -0.00 -1.24 -0.03 0.00 0.77 0.00 0.00 66.41 65.90 2vkc h THR 1713Cb 1.26 1.46 0.00 0.00 -1.74 0.00 0.00 68.15 69.13 2vkc h THR 1713CO 0.06 0.38 -0.10 -0.08 0.37 0.00 0.00 175.52 176.15 2vkc h GLU 1714N 0.26 0.17 -0.84 6.66 4.57 -1.10 -2.65 114.58 121.65 2vkc h GLU 1714Ca 0.04 -0.10 0.10 0.00 -1.18 0.00 0.00 59.36 58.22 2vkc h GLU 1714Cb 0.64 0.01 -0.06 0.00 -0.16 0.00 0.00 28.75 29.19 2vkc h GLU 1714CO 0.05 0.67 0.54 0.93 -1.18 0.00 0.00 179.01 180.03 2vkc h GLU 1715N -0.32 0.74 -0.53 1.92 5.08 -0.45 0.33 114.58 121.35 2vkc h GLU 1715Ca 0.00 -0.04 0.03 0.00 -1.00 0.00 0.00 59.36 58.35 2vkc h GLU 1715Cb 0.66 -0.17 -0.04 0.00 0.50 0.00 0.00 28.75 29.71 2vkc h GLU 1715CO 0.02 0.49 0.31 0.35 -1.00 0.00 0.00 179.01 179.19 2vkc h PHE 1716N 0.76 0.59 0.00 4.33 3.57 -0.70 0.42 116.94 125.91 2vkc h PHE 1716Ca 0.39 0.02 -0.18 0.00 3.53 0.00 0.00 57.97 61.73 2vkc h PHE 1716Cb 0.48 -0.19 -0.03 0.00 2.79 0.00 0.00 35.95 39.00 2vkc h PHE 1716CO -0.00 0.33 -1.41 1.57 -2.23 0.00 0.00 178.31 176.57 2vkc h LYS 1717N 0.62 0.00 0.00 1.11 2.10 -0.97 -2.93 116.57 116.50 2vkc h LYS 1717Ca 0.22 0.00 -0.02 0.00 -2.00 0.00 0.00 60.65 58.85 2vkc h LYS 1717Cb 0.04 0.00 -0.00 0.00 -0.90 0.00 0.00 32.23 31.36 2vkc h LYS 1717CO -0.10 0.31 -0.21 1.96 -2.00 0.00 0.00 179.45 179.41 2vkc h GLN 1718N 0.00 0.00 0.06 0.07 4.20 -0.31 -3.42 115.11 115.71 2vkc h GLN 1718Ca -0.17 0.00 -0.36 0.00 0.06 0.00 0.00 58.65 58.18 2vkc h GLN 1718Cb 1.61 0.00 -0.04 0.00 0.30 0.00 0.00 27.48 29.35 2vkc h GLN 1718CO 0.05 0.27 -2.14 0.09 -0.67 0.00 0.00 178.83 176.43 2vkc n ASN 1719N -4.69 1.70 -0.37 1.46 3.02 0.72 -5.00 115.26 112.10 2vkc n ASN 1719Ca -0.06 0.11 0.00 0.00 -0.03 0.00 0.00 54.58 54.60 2vkc n ASN 1719Cb 0.20 -0.43 0.00 0.00 -0.61 0.00 0.00 39.78 38.94 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 1.99 0.70 0.00 7.41 0.00 0.11 -5.00 105.19 110.41 2vkc n GLY 1720Ca -0.34 -0.27 0.00 0.00 0.00 0.00 0.00 46.02 45.41 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 -0.37 -0.04 3.29 -0.02 0.00 -1.18 -4.94 105.19 101.93 2vkc n GLY 1721Ca 0.00 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.71 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 0.00 2.37 -0.00 1.61 -0.14 -1.26 -4.99 119.74 117.32 2vkc s LYS 1722Ca 0.00 -0.91 0.00 0.00 -1.36 0.00 0.00 55.97 53.70 2vkc s LYS 1722Cb 0.00 -2.12 0.02 0.00 -1.68 0.00 0.00 37.83 34.05 2vkc s LYS 1722CO 0.00 0.46 0.58 -0.35 -0.76 0.00 0.00 175.35 175.28 2vkc n PRO 1723N 2.73 1.08 -3.86 -1.68 -0.04 -1.26 -4.62 135.00 127.35 2vkc n PRO 1723Ca -0.17 -0.07 -0.09 0.00 -0.04 0.00 0.00 63.50 63.13 2vkc n PRO 1723Cb 0.52 -1.46 -0.05 0.00 -0.04 0.00 0.00 33.50 32.46 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 -1.13 0.13 -0.08 0.54 1.13 -1.26 -0.42 117.35 116.25 2vkc s TYR 1724Ca 0.01 -0.49 -0.03 0.00 -1.41 0.00 0.00 57.07 55.15 2vkc s TYR 1724Cb 0.01 0.22 0.05 0.00 -1.10 0.00 0.00 41.96 41.13 2vkc s TYR 1724CO 0.00 -0.87 0.14 -0.51 -2.51 0.00 0.00 175.55 171.80 2vkc s LEU 1725N -2.93 -0.01 -0.28 -3.49 1.43 0.81 -4.86 118.68 109.35 2vkc s LEU 1725Ca 0.14 0.22 -0.18 0.00 -1.03 0.00 0.00 54.13 53.28 2vkc s LEU 1725Cb 0.00 0.16 -0.02 0.00 0.03 0.00 0.00 46.19 46.37 2vkc s LEU 1725CO 0.00 -0.25 0.52 -0.44 0.23 0.00 0.00 176.35 176.41 2vkc s SER 1726N 2.26 6.41 -0.22 2.29 0.01 -1.21 -0.27 113.70 122.97 2vkc s SER 1726Ca 0.04 0.41 -0.07 0.00 1.31 0.00 0.00 55.95 57.64 2vkc s SER 1726Cb -0.12 -2.28 -0.04 0.00 0.21 0.00 0.00 66.02 63.79 2vkc s SER 1726CO -0.05 -0.34 0.07 -0.69 0.41 0.00 0.00 173.24 172.64 2vkc s VAL 1727N 2.35 4.55 -0.47 3.43 1.01 0.13 0.21 120.40 131.61 2vkc s VAL 1727Ca 0.21 -0.10 -0.14 0.00 0.00 0.00 0.00 61.98 61.95 2vkc s VAL 1727Cb -0.15 -3.09 0.08 0.00 0.00 0.00 0.00 36.38 33.22 2vkc s VAL 1727CO 0.10 0.39 0.38 -0.63 0.00 0.00 0.00 175.10 175.34 2vkc s ILE 1728N 1.06 4.99 -0.30 2.22 1.09 0.65 -0.88 121.20 130.03 2vkc s ILE 1728Ca 0.04 -1.22 0.22 0.00 -1.10 0.00 0.00 60.65 58.59 2vkc s ILE 1728Cb -0.14 -4.04 0.11 0.00 -1.06 0.00 0.00 42.46 37.33 2vkc s ILE 1728CO 0.03 -0.61 1.23 0.71 -0.10 0.00 0.00 174.94 176.20 2vkc h THR 1729N 5.85 0.05 0.00 2.92 1.35 -1.29 -2.86 112.91 118.93 2vkc h THR 1729Ca -0.27 -1.08 0.00 0.00 -0.55 0.00 0.00 66.41 64.51 2vkc h THR 1729Cb 1.10 1.72 0.00 0.00 -1.73 0.00 0.00 68.15 69.24 2vkc h THR 1729CO 0.88 0.03 0.00 0.61 -0.25 0.00 0.00 175.52 176.78 2vkc n GLY 1730N 1.16 3.45 2.26 5.82 0.00 -1.06 -3.96 105.19 112.87 2vkc n GLY 1730Ca 0.01 -0.27 -0.31 0.00 0.00 0.00 0.00 46.02 45.45 2vkc n GLY 1730CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2vkc n ARG 1731N 0.00 3.15 0.00 1.61 1.74 -1.23 -2.98 116.66 118.95 2vkc n ARG 1731Ca 0.00 -1.84 0.00 0.00 -0.77 0.00 0.00 57.85 55.24 2vkc n ARG 1731Cb 0.00 -2.57 0.00 0.00 -1.02 0.00 0.00 32.46 28.87 2vkc n ARG 1731CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 2vkc n GLY 1732N 3.33 0.00 3.57 -0.13 0.00 -1.26 -4.90 105.19 105.80 2vkc n GLY 1732Ca 0.67 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 46.28 2vkc n GLY 1732CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 2vkc s ASN 1733N -1.87 6.11 -0.04 1.61 2.47 -1.22 -4.18 114.94 117.83 2vkc s ASN 1733Ca 0.00 0.24 0.06 0.00 0.42 0.00 0.00 52.86 53.58 2vkc s ASN 1733Cb 0.00 -2.55 -0.09 0.00 -1.45 0.00 0.00 41.25 37.16 2vkc s ASN 1733CO 0.00 -1.73 0.08 0.00 -3.72 0.00 0.00 177.10 171.73 2vkc n HIS 1734N 9.64 0.00 -2.73 0.43 1.44 -1.26 -3.12 115.22 119.62 2vkc n HIS 1734Ca 0.12 0.00 0.00 0.00 -2.01 0.00 0.00 57.72 55.83 2vkc n HIS 1734Cb 0.49 -0.25 0.00 0.00 0.12 0.00 0.00 29.99 30.35 2vkc n HIS 1734CO 0.00 0.00 0.00 -1.13 -2.81 0.00 0.00 176.34 172.40 2vkc n SER 1735N -2.02 0.00 0.09 4.39 3.41 -1.26 -4.99 113.62 113.23 2vkc n SER 1735Ca -0.07 -0.18 0.09 0.00 -0.26 0.00 0.00 58.87 58.45 2vkc n SER 1735Cb 0.48 0.00 0.40 0.00 -0.26 0.00 0.00 64.21 64.83 2vkc n SER 1735CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2vkc n GLN 1736N 0.00 0.11 -0.14 4.33 -0.00 -1.26 -1.45 117.38 118.97 2vkc n GLN 1736Ca 0.00 0.44 0.09 0.00 -0.00 0.00 0.00 57.00 57.53 2vkc n GLN 1736Cb 0.00 -1.75 0.28 0.00 -0.00 0.00 0.00 30.24 28.77 2vkc n GLN 1736CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.06 177.47 2vkc n GLY 1737N -0.52 0.64 3.38 2.61 0.00 -1.26 -4.75 105.19 105.29 2vkc n GLY 1737Ca 0.01 -0.45 -0.45 0.00 0.00 0.00 0.00 46.02 45.14 2vkc n GLY 1737CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2vkc s GLY 1738N -1.33 1.76 -0.94 -0.02 0.00 -0.53 -4.94 107.32 101.32 2vkc s GLY 1738Ca 0.31 -2.20 -0.24 0.00 0.00 0.00 0.00 44.72 42.59 2vkc s GLY 1738CO 0.23 1.59 1.66 0.14 0.00 0.00 0.00 173.10 176.73 2vkc s VAL 1739N 2.73 3.69 -0.41 1.40 1.01 -1.26 -4.50 120.40 123.07 2vkc s VAL 1739Ca 0.12 -0.50 0.06 0.00 0.00 0.00 0.00 61.98 61.66 2vkc s VAL 1739Cb -0.24 -4.58 0.21 0.00 0.00 0.00 0.00 36.38 31.77 2vkc s VAL 1739CO 0.07 -1.49 0.45 0.00 0.00 0.00 0.00 175.10 174.12 2vkc n ALA 1740N 11.15 2.43 0.50 5.51 0.00 -1.26 -4.84 120.51 133.99 2vkc n ALA 1740Ca 0.34 -3.14 0.10 0.00 0.00 0.00 0.00 53.44 50.74 2vkc n ALA 1740Cb 0.49 -0.81 0.41 0.00 0.00 0.00 0.00 19.45 19.54 2vkc n ALA 1740CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 2vkc n ARG 1741N 2.15 0.10 0.07 0.00 5.12 -1.26 -1.83 116.66 121.01 2vkc n ARG 1741Ca 0.25 0.30 0.00 0.00 -1.93 0.00 0.00 57.85 56.47 2vkc n ARG 1741Cb 0.51 -1.67 0.31 0.00 -1.16 0.00 0.00 32.46 30.45 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 1.22 0.74 0.55 2.04 -1.85 -3.01 117.51 117.20 2vkc h ILE 1742Ca 0.00 -0.98 -0.04 0.00 1.00 0.00 0.00 64.86 64.85 2vkc h ILE 1742Cb 0.35 1.24 0.01 0.00 -0.74 0.00 0.00 36.82 37.68 2vkc h ILE 1742CO 0.00 0.31 -0.35 0.50 0.00 0.00 0.00 178.15 178.60 2vkc h LYS 1743N 0.32 -0.95 -0.46 2.37 3.64 -1.64 0.23 116.57 120.08 2vkc h LYS 1743Ca 0.06 0.07 0.04 0.00 -1.27 0.00 0.00 60.65 59.54 2vkc h LYS 1743Cb 0.48 0.22 -0.02 0.00 -0.41 0.00 0.00 32.23 32.49 2vkc h LYS 1743CO 0.03 -0.62 0.31 -1.00 -2.27 0.00 0.00 179.45 175.90 2vkc h PRO 1744N -1.08 0.47 -0.05 1.90 0.13 -1.73 0.22 132.00 131.86 2vkc h PRO 1744Ca -0.10 -0.03 -0.01 0.00 -0.87 0.00 0.00 66.00 64.99 2vkc h PRO 1744Cb 0.78 -0.11 -0.00 0.00 0.13 0.00 0.00 31.00 31.80 2vkc h PRO 1744CO 0.17 0.31 -0.02 0.00 -0.23 0.00 0.00 178.00 178.22 2vkc h ALA 1745N 1.74 0.06 -0.58 -0.56 0.00 -1.37 -2.44 119.26 116.11 2vkc h ALA 1745Ca 0.19 -0.23 -0.08 0.00 0.00 0.00 0.00 54.91 54.79 2vkc h ALA 1745Cb 0.14 -0.02 -0.02 0.00 0.00 0.00 0.00 17.79 17.90 2vkc h ALA 1745CO -0.05 -0.19 0.07 0.28 0.00 0.00 0.00 179.25 179.36 2vkc h VAL 1746N -0.30 1.26 -0.31 0.00 2.07 0.01 -2.10 116.25 116.87 2vkc h VAL 1746Ca 0.01 -1.03 0.05 0.00 0.82 0.00 0.00 66.70 66.56 2vkc h VAL 1746Cb 0.47 0.79 -0.05 0.00 -1.52 0.00 0.00 31.29 30.98 2vkc h VAL 1746CO 0.01 0.37 0.02 0.40 0.02 0.00 0.00 177.57 178.39 2vkc h ILE 1747N 0.87 0.80 -0.62 4.57 2.04 -0.57 0.18 117.51 124.77 2vkc h ILE 1747Ca 0.17 -0.04 0.05 0.00 1.00 0.00 0.00 64.86 66.04 2vkc h ILE 1747Cb 0.45 0.67 -0.04 0.00 -0.74 0.00 0.00 36.82 37.17 2vkc h ILE 1747CO 0.02 0.02 0.41 0.50 0.00 0.00 0.00 178.15 179.10 2vkc h LYS 1748N 0.12 0.66 0.06 2.37 3.64 -1.31 -1.74 116.57 120.36 2vkc h LYS 1748Ca 0.15 -0.04 -0.00 0.00 -1.27 0.00 0.00 60.65 59.49 2vkc h LYS 1748Cb 0.19 -0.15 0.00 0.00 -0.41 0.00 0.00 32.23 31.86 2vkc h LYS 1748CO -0.23 0.43 -0.03 -0.92 -2.27 0.00 0.00 179.45 176.44 2vkc h TYR 1749N 0.68 -0.07 -0.23 1.91 5.03 -0.30 -2.23 116.97 121.76 2vkc h TYR 1749Ca 0.26 -0.00 0.00 0.00 2.58 0.00 0.00 58.73 61.57 2vkc h TYR 1749Cb 0.17 0.02 -0.01 0.00 1.55 0.00 0.00 36.73 38.47 2vkc h TYR 1749CO -0.00 0.24 0.15 -0.07 -1.32 0.00 0.00 178.16 177.16 2vkc h LEU 1750N -0.38 0.27 -1.01 2.82 -0.00 -0.71 -2.60 115.31 113.70 2vkc h LEU 1750Ca -0.01 -0.01 -0.04 0.00 -0.00 0.00 0.00 57.88 57.82 2vkc h LEU 1750Cb 0.34 -0.07 -0.03 0.00 -0.00 0.00 0.00 40.66 40.90 2vkc h LEU 1750CO 0.01 0.19 0.24 0.16 -0.00 0.00 0.00 178.44 179.05 2vkc h ILE 1751N 0.31 1.23 0.00 1.22 -0.00 -1.38 0.84 117.51 119.73 2vkc h ILE 1751Ca 0.08 -0.74 0.00 0.00 -0.00 0.00 0.00 64.86 64.21 2vkc h ILE 1751Cb -0.04 0.47 0.00 0.00 -0.00 0.00 0.00 36.82 37.26 2vkc h ILE 1751CO -0.02 0.29 0.00 0.28 -0.00 0.00 0.00 178.15 178.70 2vkc h SER 1752N 0.94 0.00 -0.22 2.16 0.02 -1.03 -1.26 113.55 114.17 2vkc h SER 1752Ca 0.22 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.17 2vkc h SER 1752Cb 0.20 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.74 2vkc h SER 1752CO -0.02 0.00 0.00 1.41 -1.14 0.00 0.00 176.83 177.08 2vkc n HIS 1753N -3.00 0.28 -3.39 3.45 8.25 -0.91 -5.00 115.22 114.91 2vkc n HIS 1753Ca -0.00 -0.30 -0.17 0.00 -0.26 0.00 0.00 57.72 57.00 2vkc n HIS 1753Cb 0.25 -0.02 0.09 0.00 1.12 0.00 0.00 29.99 31.43 2vkc n HIS 1753CO 0.00 0.00 0.00 0.43 0.64 0.00 0.00 176.34 177.41 2vkc n SER 1754N 0.57 -3.06 -4.75 0.41 7.64 -0.47 -5.03 113.62 108.92 2vkc n SER 1754Ca 0.10 -0.64 -0.24 0.00 1.01 0.00 0.00 58.87 59.10 2vkc n SER 1754Cb 0.37 -5.14 0.09 0.00 -1.01 0.00 0.00 64.21 58.52 2vkc n SER 1754CO 0.00 0.00 0.00 -0.36 -3.01 0.00 0.00 175.04 171.67 2vkc s PHE 1755N -3.37 2.14 -0.22 1.43 0.08 0.18 -5.01 117.98 113.21 2vkc s PHE 1755Ca 0.10 -0.04 -0.01 0.00 0.12 0.00 0.00 56.93 57.10 2vkc s PHE 1755Cb -0.01 -3.05 0.02 0.00 -0.57 0.00 0.00 43.02 39.40 2vkc s PHE 1755CO 0.73 -1.52 -0.09 1.03 -0.10 0.00 0.00 175.22 175.27 2vkc s ARG 1756N -5.12 2.98 0.09 0.44 3.00 -1.24 -4.74 118.95 114.37 2vkc s ARG 1756Ca 0.64 -0.87 -0.08 0.00 0.00 0.00 0.00 55.73 55.42 2vkc s ARG 1756Cb -0.07 -2.88 -0.00 0.00 0.00 0.00 0.00 34.95 31.99 2vkc s ARG 1756CO 0.44 -0.31 0.18 -0.59 0.00 0.00 0.00 175.30 175.02 2vkc s PHE 1757N 1.35 0.20 -0.21 -0.53 -0.71 -1.26 0.81 117.98 117.63 2vkc s PHE 1757Ca 0.02 -0.63 -0.16 0.00 -1.04 0.00 0.00 56.93 55.12 2vkc s PHE 1757Cb -0.15 -0.08 0.06 0.00 -1.21 0.00 0.00 43.02 41.64 2vkc s PHE 1757CO -0.06 -0.55 0.55 0.45 -1.34 0.00 0.00 175.22 174.26 2vkc s SER 1758N -2.88 -0.64 0.15 1.98 0.15 0.26 -4.97 113.70 107.76 2vkc s SER 1758Ca 0.06 1.14 -0.30 0.00 0.70 0.00 0.00 55.95 57.56 2vkc s SER 1758Cb 0.05 1.10 -0.07 0.00 -1.71 0.00 0.00 66.02 65.39 2vkc s SER 1758CO -0.10 -0.20 1.00 -0.70 1.20 0.00 0.00 173.24 174.44 2vkc s GLU 1759N 0.80 4.69 -0.01 5.44 2.12 -1.26 -0.03 118.70 130.45 2vkc s GLU 1759Ca -0.04 1.54 -0.05 0.00 0.36 0.00 0.00 54.97 56.78 2vkc s GLU 1759Cb -0.05 -3.33 -0.03 0.00 0.26 0.00 0.00 34.13 30.98 2vkc s GLU 1759CO -0.06 0.21 0.52 0.82 -0.54 0.00 0.00 175.26 176.21 2vkc h ILE 1760N 3.81 0.00 0.00 -3.70 2.04 -1.01 -3.47 117.51 115.18 2vkc h ILE 1760Ca -0.44 -0.17 0.00 0.00 1.00 0.00 0.00 64.86 65.25 2vkc h ILE 1760Cb 1.21 0.00 0.00 0.00 -0.74 0.00 0.00 36.82 37.29 2vkc h ILE 1760CO 0.71 0.00 0.00 1.17 0.00 0.00 0.00 178.15 180.03 2vkc n LYS 1761N -2.98 0.00 -0.15 2.37 4.81 -1.26 -5.03 118.16 115.91 2vkc n LYS 1761Ca -0.02 0.00 -0.02 0.00 -0.87 0.00 0.00 58.31 57.40 2vkc n LYS 1761Cb 0.07 0.00 -0.02 0.00 0.02 0.00 0.00 35.03 35.10 2vkc n LYS 1761CO 0.00 0.00 0.00 -0.35 1.17 0.00 0.00 177.40 178.22 2vkc n PRO 1762N 0.00 0.00 -2.40 1.64 -0.04 -1.23 -0.61 135.00 132.36 2vkc n PRO 1762Ca 0.00 0.00 -0.10 0.00 -0.04 0.00 0.00 63.50 63.36 2vkc n PRO 1762Cb 0.00 -0.11 -0.01 0.00 -0.04 0.00 0.00 33.50 33.35 2vkc n PRO 1762CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 2vkc n GLY 1763N 0.58 -0.44 3.09 0.55 0.00 -1.16 -3.51 105.19 104.29 2vkc n GLY 1763Ca 0.06 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.75 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 1.09 4.11 -0.26 0.00 1.43 -0.06 -0.28 118.68 124.71 2vkc s LEU 1765Ca -0.02 0.50 -0.11 0.00 -1.03 0.00 0.00 54.13 53.47 2vkc s LEU 1765Cb -0.20 -2.56 -0.05 0.00 0.03 0.00 0.00 46.19 43.41 2vkc s LEU 1765CO -0.05 -0.15 0.18 -0.75 0.23 0.00 0.00 176.35 175.81 2vkc s LYS 1766N 1.70 4.02 -0.13 1.70 2.20 0.96 0.19 119.74 130.36 2vkc s LYS 1766Ca 0.19 -0.29 -0.03 0.00 -0.36 0.00 0.00 55.97 55.49 2vkc s LYS 1766Cb -0.15 -3.60 -0.03 0.00 -1.51 0.00 0.00 37.83 32.54 2vkc s LYS 1766CO 0.09 -0.05 -0.02 0.08 -0.36 0.00 0.00 175.35 175.09 2vkc s VAL 1767N 1.39 4.09 -0.24 4.02 1.01 0.62 -0.57 120.40 130.71 2vkc s VAL 1767Ca 0.07 -0.30 -0.08 0.00 0.00 0.00 0.00 61.98 61.67 2vkc s VAL 1767Cb -0.15 -2.77 -0.04 0.00 0.00 0.00 0.00 36.38 33.43 2vkc s VAL 1767CO 0.08 0.53 0.09 -0.04 0.00 0.00 0.00 175.10 175.75 2vkc s MET 1768N -0.05 3.80 0.46 2.72 1.00 0.24 -0.13 119.30 127.34 2vkc s MET 1768Ca 0.02 -0.41 -0.23 0.00 0.00 0.00 0.00 55.69 55.08 2vkc s MET 1768Cb -0.13 -3.35 -0.07 0.00 0.00 0.00 0.00 34.83 31.27 2vkc s MET 1768CO 0.02 -0.05 1.15 -0.51 0.00 0.00 0.00 175.02 175.63 2vkc s LEU 1769N 1.28 3.99 0.00 -0.03 1.43 0.44 -3.62 118.68 122.18 2vkc s LEU 1769Ca 0.05 2.27 0.12 0.00 -1.03 0.00 0.00 54.13 55.54 2vkc s LEU 1769Cb -0.15 -4.27 0.09 0.00 0.03 0.00 0.00 46.19 41.89 2vkc s LEU 1769CO 0.04 -0.91 0.87 2.29 0.23 0.00 0.00 176.35 178.86