#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 0.57 0.00 0.03 1.57 -2.05 -1.69 116.57 115.01 2vkc h LYS 1667Ca 0.00 -0.12 -0.05 0.00 -1.87 0.00 0.00 60.65 58.61 2vkc h LYS 1667Cb 0.00 -0.08 -0.01 0.00 0.08 0.00 0.00 32.23 32.22 2vkc h LYS 1667CO 0.00 0.59 -0.24 0.93 -0.57 0.00 0.00 179.45 180.16 2vkc h GLU 1668N 0.55 0.00 -0.02 3.15 4.39 -2.01 0.32 114.58 120.95 2vkc h GLU 1668Ca 0.12 0.00 -0.22 0.00 0.34 0.00 0.00 59.36 59.59 2vkc h GLU 1668Cb 0.34 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 28.99 2vkc h GLU 1668CO 0.01 0.24 -0.91 0.00 -1.16 0.00 0.00 179.01 177.19 2vkc h ALA 1669N 1.76 0.36 0.00 3.43 0.00 -1.88 -2.47 119.26 120.46 2vkc h ALA 1669Ca -0.00 -0.68 -0.01 0.00 0.00 0.00 0.00 54.91 54.21 2vkc h ALA 1669Cb 0.98 -0.01 -0.00 0.00 0.00 0.00 0.00 17.79 18.76 2vkc h ALA 1669CO 0.03 0.78 -0.06 -0.91 0.00 0.00 0.00 179.25 179.09 2vkc h ASN 1670N 0.29 0.00 -0.39 0.00 2.35 -0.90 -2.22 115.58 114.72 2vkc h ASN 1670Ca -0.08 0.00 -0.15 0.00 -0.55 0.00 0.00 56.30 55.53 2vkc h ASN 1670Cb 1.54 0.00 -0.01 0.00 0.05 0.00 0.00 38.32 39.90 2vkc h ASN 1670CO 0.16 0.06 -0.34 -0.74 -1.65 0.00 0.00 177.43 174.93 2vkc h HIS 1671N 0.00 1.08 -0.02 1.19 2.76 -0.17 -1.18 115.15 118.81 2vkc h HIS 1671Ca -0.00 -0.31 -0.10 0.00 -2.20 0.00 0.00 60.37 57.75 2vkc h HIS 1671Cb 0.74 -0.23 -0.01 0.00 1.55 0.00 0.00 27.41 29.45 2vkc h HIS 1671CO 0.00 1.13 -0.46 -0.07 -1.30 0.00 0.00 177.93 177.23 2vkc h LEU 1672N 0.72 0.06 -0.34 0.26 3.38 -1.08 -2.38 115.31 115.93 2vkc h LEU 1672Ca 0.07 -0.03 0.00 0.00 0.09 0.00 0.00 57.88 58.01 2vkc h LEU 1672Cb 0.93 -0.02 0.00 0.00 0.09 0.00 0.00 40.66 41.66 2vkc h LEU 1672CO 0.09 0.51 -0.05 0.00 0.09 0.00 0.00 178.44 179.08 2vkc n ALA 1673N -2.46 2.69 0.13 1.53 0.00 -0.87 -3.72 120.51 117.82 2vkc n ALA 1673Ca -0.02 -0.29 0.01 0.00 0.00 0.00 0.00 53.44 53.14 2vkc n ALA 1673Cb 0.49 -1.35 0.03 0.00 0.00 0.00 0.00 19.45 18.62 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 3.91 0.64 -0.37 0.00 0.00 -0.67 -3.26 119.26 119.52 2vkc h ALA 1674Ca 0.00 -0.54 -0.01 0.00 0.00 0.00 0.00 54.91 54.35 2vkc h ALA 1674Cb 0.28 -0.10 -0.02 0.00 0.00 0.00 0.00 17.79 17.96 2vkc h ALA 1674CO 0.00 0.75 0.17 0.82 0.00 0.00 0.00 179.25 180.99 2vkc h ILE 1675N 0.00 1.17 0.00 0.00 5.03 -1.72 0.16 117.51 122.15 2vkc h ILE 1675Ca -0.01 -0.48 -0.05 0.00 -0.12 0.00 0.00 64.86 64.21 2vkc h ILE 1675Cb 1.41 0.81 -0.01 0.00 -3.03 0.00 0.00 36.82 36.00 2vkc h ILE 1675CO 0.08 0.18 -0.24 1.05 -0.68 0.00 0.00 178.15 178.54 2vkc h GLU 1676N 0.45 0.00 -0.01 2.37 4.11 -1.81 -2.28 114.58 117.41 2vkc h GLU 1676Ca 0.13 0.00 -0.23 0.00 0.07 0.00 0.00 59.36 59.33 2vkc h GLU 1676Cb 0.12 0.00 0.02 0.00 0.50 0.00 0.00 28.75 29.39 2vkc h GLU 1676CO -0.02 0.24 -0.87 0.82 0.07 0.00 0.00 179.01 179.25 2vkc h ILE 1677N 0.00 1.33 -0.83 -1.06 1.08 -1.41 -3.22 117.51 113.40 2vkc h ILE 1677Ca -0.00 -2.16 0.11 0.00 -0.39 0.00 0.00 64.86 62.42 2vkc h ILE 1677Cb 0.45 2.42 -0.08 0.00 -3.07 0.00 0.00 36.82 36.54 2vkc h ILE 1677CO 0.03 0.66 0.45 0.15 -0.69 0.00 0.00 178.15 178.75 2vkc h PHE 1678N 0.24 0.81 -0.32 1.37 3.57 -0.17 -2.06 116.94 120.38 2vkc h PHE 1678Ca -0.11 0.03 -0.01 0.00 3.53 0.00 0.00 57.97 61.42 2vkc h PHE 1678Cb 1.54 -0.24 -0.01 0.00 2.79 0.00 0.00 35.95 40.03 2vkc h PHE 1678CO 0.12 0.28 0.16 0.93 -2.23 0.00 0.00 178.31 177.57 2vkc h GLU 1679N 0.72 0.45 0.00 1.11 5.08 -1.44 -0.66 114.58 119.84 2vkc h GLU 1679Ca 0.42 -0.06 -0.10 0.00 -1.00 0.00 0.00 59.36 58.61 2vkc h GLU 1679Cb 0.46 -0.08 -0.01 0.00 0.50 0.00 0.00 28.75 29.62 2vkc h GLU 1679CO -0.29 0.42 -0.49 1.57 -1.00 0.00 0.00 179.01 179.22 2vkc h LYS 1680N 0.38 0.00 0.04 2.33 2.10 -1.47 -3.15 116.57 116.79 2vkc h LYS 1680Ca 0.11 0.00 -0.15 0.00 -2.00 0.00 0.00 60.65 58.61 2vkc h LYS 1680Cb 0.11 0.00 -0.01 0.00 -0.90 0.00 0.00 32.23 31.43 2vkc h LYS 1680CO -0.01 0.49 -0.78 -0.24 -2.00 0.00 0.00 179.45 176.90 2vkc h VAL 1681N 0.00 1.34 0.00 0.07 3.04 -1.18 -3.36 116.25 116.15 2vkc h VAL 1681Ca -0.00 -2.33 -0.02 0.00 -1.01 0.00 0.00 66.70 63.33 2vkc h VAL 1681Cb 0.91 2.88 -0.00 0.00 -2.01 0.00 0.00 31.29 33.07 2vkc h VAL 1681CO 0.06 0.56 -0.09 -0.55 -1.01 0.00 0.00 177.57 176.54 2vkc h ASN 1682N -0.77 0.00 -0.96 3.17 7.08 -1.18 -3.08 115.58 119.85 2vkc h ASN 1682Ca -0.19 0.00 0.17 0.00 -3.08 0.00 0.00 56.30 53.20 2vkc h ASN 1682Cb 1.34 0.00 -0.09 0.00 -2.08 0.00 0.00 38.32 37.49 2vkc h ASN 1682CO -0.03 0.09 0.61 0.00 -2.08 0.00 0.00 177.43 176.02 2vkc h ALA 1683N 1.91 1.80 -0.16 4.14 0.00 -1.70 0.20 119.26 125.45 2vkc h ALA 1683Ca -0.00 0.04 0.00 0.00 0.00 0.00 0.00 54.91 54.95 2vkc h ALA 1683Cb 0.47 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 18.15 2vkc h ALA 1683CO 0.01 -0.10 0.00 0.43 0.00 0.00 0.00 179.25 179.59 2vkc n SER 1684N -4.63 2.38 -0.09 0.00 7.64 -1.17 -4.55 113.62 113.20 2vkc n SER 1684Ca 0.20 -1.70 -0.11 0.00 1.01 0.00 0.00 58.87 58.28 2vkc n SER 1684Cb 0.54 -0.10 -0.11 0.00 -1.01 0.00 0.00 64.21 63.53 2vkc n SER 1684CO 0.00 0.00 0.00 0.18 -3.01 0.00 0.00 175.04 172.21 2vkc n LEU 1685N 0.61 1.45 -0.36 -3.43 4.32 -0.18 -4.50 117.00 114.90 2vkc n LEU 1685Ca 0.09 -0.05 0.05 0.00 -0.02 0.00 0.00 56.01 56.08 2vkc n LEU 1685Cb 0.35 -0.14 0.21 0.00 -1.62 0.00 0.00 43.42 42.22 2vkc n LEU 1685CO 0.08 0.61 1.24 -0.07 -1.22 0.00 0.00 177.39 178.03 2vkc h LEU 1686N 0.00 0.96 -2.13 2.23 3.38 -0.54 0.12 115.31 119.33 2vkc h LEU 1686Ca -0.44 0.03 0.00 0.00 0.09 0.00 0.00 57.88 57.56 2vkc h LEU 1686Cb 1.84 -0.17 0.00 0.00 0.09 0.00 0.00 40.66 42.42 2vkc h LEU 1686CO -0.02 0.56 0.06 1.55 0.09 0.00 0.00 178.44 180.68 2vkc h PRO 1687N 1.06 0.00 -0.10 1.13 0.13 -1.83 0.16 132.00 132.56 2vkc h PRO 1687Ca 0.47 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.60 2vkc h PRO 1687Cb 0.35 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.48 2vkc h PRO 1687CO -0.23 0.00 0.00 1.04 -0.23 0.00 0.00 178.00 178.58 2vkc n GLN 1688N -2.67 1.92 -3.44 0.86 6.02 0.36 -4.89 117.38 115.53 2vkc n GLN 1688Ca -0.02 -1.35 -0.17 0.00 -0.01 0.00 0.00 57.00 55.44 2vkc n GLN 1688Cb 0.11 -1.46 0.09 0.00 1.02 0.00 0.00 30.24 30.00 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 0.61 -2.04 -4.01 1.08 4.13 0.05 -4.87 115.26 110.21 2vkc n ASN 1689Ca 0.17 -0.63 -0.31 0.00 1.68 0.00 0.00 54.58 55.49 2vkc n ASN 1689Cb 0.43 -5.09 -0.15 0.00 -1.54 0.00 0.00 39.78 33.43 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 -3.37 1.89 -0.49 2.41 1.01 -0.73 -0.29 120.40 120.82 2vkc s VAL 1690Ca 0.00 -1.46 -0.13 0.00 0.00 0.00 0.00 61.98 60.39 2vkc s VAL 1690Cb -0.00 -2.07 0.10 0.00 0.00 0.00 0.00 36.38 34.41 2vkc s VAL 1690CO 0.73 -0.07 0.40 -0.22 0.00 0.00 0.00 175.10 175.95 2vkc s LEU 1691N 1.23 5.78 -0.16 3.92 1.98 0.10 -2.88 118.68 128.65 2vkc s LEU 1691Ca -0.07 -1.65 -0.02 0.00 -2.89 0.00 0.00 54.13 49.49 2vkc s LEU 1691Cb -0.19 -2.13 -0.01 0.00 0.66 0.00 0.00 46.19 44.51 2vkc s LEU 1691CO -0.06 -0.72 -0.09 -0.62 -1.89 0.00 0.00 176.35 172.98 2vkc s ASP 1692N 2.92 4.24 -0.32 3.68 -1.08 -1.26 -0.96 116.67 123.89 2vkc s ASP 1692Ca 0.04 -0.31 0.17 0.00 -0.52 0.00 0.00 52.55 51.93 2vkc s ASP 1692Cb -0.27 -1.68 0.45 0.00 -1.46 0.00 0.00 42.92 39.96 2vkc s ASP 1692CO 0.03 0.11 1.26 0.00 0.52 0.00 0.00 175.17 177.09 2vkc n LEU 1693N 3.92 0.07 -4.70 -1.34 -0.00 -0.72 -4.70 117.00 109.53 2vkc n LEU 1693Ca -0.18 -3.27 -0.42 0.00 -0.00 0.00 0.00 56.01 52.14 2vkc n LEU 1693Cb 0.52 0.28 -0.03 0.00 -0.00 0.00 0.00 43.42 44.19 2vkc n LEU 1693CO 0.31 1.47 1.02 -1.38 -0.00 0.00 0.00 177.39 178.80 2vkc s HIS 1694N -1.86 3.12 0.00 1.47 -3.43 -1.13 -2.92 115.29 110.54 2vkc s HIS 1694Ca 0.21 1.04 0.00 0.00 -0.80 0.00 0.00 55.06 55.50 2vkc s HIS 1694Cb 0.40 -3.55 0.00 0.00 -1.43 0.00 0.00 32.58 27.99 2vkc s HIS 1694CO -0.06 -1.91 0.00 0.41 -2.00 0.00 0.00 174.74 171.18 2vkc n GLY 1695N 3.46 0.39 3.46 -1.38 0.00 -1.24 -4.91 105.19 104.97 2vkc n GLY 1695Ca 0.11 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.85 2vkc n GLY 1695CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 2vkc n LEU 1696N 0.00 0.00 -4.87 0.99 4.32 -1.15 -4.67 117.00 111.62 2vkc n LEU 1696Ca 0.00 -1.21 -0.31 0.00 -0.02 0.00 0.00 56.01 54.47 2vkc n LEU 1696Cb 0.00 -0.96 -0.03 0.00 -1.62 0.00 0.00 43.42 40.81 2vkc n LEU 1696CO 0.00 -1.85 0.54 -1.00 -1.22 0.00 0.00 177.39 173.85 2vkc s HIS 1697N -3.21 3.48 0.32 -1.77 3.76 -1.26 -4.88 115.29 111.73 2vkc s HIS 1697Ca 0.69 1.18 0.21 0.00 -0.15 0.00 0.00 55.06 57.00 2vkc s HIS 1697Cb -0.05 -2.56 1.05 0.00 1.11 0.00 0.00 32.58 32.12 2vkc s HIS 1697CO 0.51 -0.24 1.91 -0.39 -0.85 0.00 0.00 174.74 175.68 2vkc h VAL 1698N 0.88 0.81 -0.23 -0.90 -1.51 -1.96 0.22 116.25 113.56 2vkc h VAL 1698Ca -0.47 -0.97 -0.08 0.00 -1.23 0.00 0.00 66.70 63.95 2vkc h VAL 1698Cb 1.19 1.59 -0.00 0.00 -2.13 0.00 0.00 31.29 31.93 2vkc h VAL 1698CO 0.63 0.24 -0.16 -2.24 -1.23 0.00 0.00 177.57 174.80 2vkc h ASP 1699N 0.00 0.54 -0.20 4.19 2.03 -1.99 -1.24 116.42 119.74 2vkc h ASP 1699Ca -0.00 -0.44 -0.02 0.00 -0.73 0.00 0.00 57.03 55.84 2vkc h ASP 1699Cb 0.57 -0.15 -0.01 0.00 -0.83 0.00 0.00 39.33 38.91 2vkc h ASP 1699CO 0.03 0.87 0.05 -0.33 -1.03 0.00 0.00 179.24 178.83 2vkc h GLU 1700N 0.22 0.33 -0.76 4.15 5.08 -1.75 -1.36 114.58 120.48 2vkc h GLU 1700Ca 0.05 -0.08 0.10 0.00 -1.00 0.00 0.00 59.36 58.42 2vkc h GLU 1700Cb 0.69 -0.04 -0.07 0.00 0.50 0.00 0.00 28.75 29.82 2vkc h GLU 1700CO 0.04 0.46 0.40 0.00 -1.00 0.00 0.00 179.01 178.91 2vkc h ALA 1701N 0.86 1.07 -0.33 3.43 0.00 -0.57 -0.95 119.26 122.77 2vkc h ALA 1701Ca 0.06 0.05 -0.08 0.00 0.00 0.00 0.00 54.91 54.94 2vkc h ALA 1701Cb 0.28 -0.07 -0.01 0.00 0.00 0.00 0.00 17.79 17.98 2vkc h ALA 1701CO 0.00 -0.00 -0.11 -0.07 0.00 0.00 0.00 179.25 179.07 2vkc h LEU 1702N 0.67 0.67 -0.47 0.00 3.38 -0.84 -0.27 115.31 118.44 2vkc h LEU 1702Ca 0.37 -0.38 -0.09 0.00 0.09 0.00 0.00 57.88 57.87 2vkc h LEU 1702Cb 0.39 -0.18 -0.02 0.00 0.09 0.00 0.00 40.66 40.94 2vkc h LEU 1702CO -0.27 0.90 -0.07 1.05 0.09 0.00 0.00 178.44 180.13 2vkc h GLU 1703N 0.44 0.88 -0.31 1.13 4.11 -0.91 0.76 114.58 120.68 2vkc h GLU 1703Ca 0.08 -0.32 -0.12 0.00 0.07 0.00 0.00 59.36 59.07 2vkc h GLU 1703Cb 0.62 -0.06 -0.01 0.00 0.50 0.00 0.00 28.75 29.80 2vkc h GLU 1703CO 0.04 0.96 -0.31 0.45 0.07 0.00 0.00 179.01 180.22 2vkc h HIS 1704N 0.73 0.76 0.44 2.06 3.86 -1.17 -2.86 115.15 118.96 2vkc h HIS 1704Ca 0.12 -0.19 -0.02 0.00 -1.16 0.00 0.00 60.37 59.12 2vkc h HIS 1704Cb 0.61 -0.17 0.00 0.00 1.06 0.00 0.00 27.41 28.91 2vkc h HIS 1704CO 0.05 0.89 -0.21 1.25 0.86 0.00 0.00 177.93 180.76 2vkc h LEU 1705N 0.56 -0.50 -0.67 2.43 5.85 -0.71 -2.87 115.31 119.40 2vkc h LEU 1705Ca 0.07 -0.05 0.01 0.00 0.84 0.00 0.00 57.88 58.74 2vkc h LEU 1705Cb 0.81 0.13 -0.03 0.00 0.37 0.00 0.00 40.66 41.93 2vkc h LEU 1705CO 0.07 -0.25 0.45 0.00 -0.34 0.00 0.00 178.44 178.36 2vkc h MET 1706N -0.73 0.89 -0.13 1.25 -0.00 -0.85 0.24 114.93 115.60 2vkc h MET 1706Ca -0.06 -0.05 -0.11 0.00 -0.00 0.00 0.00 59.70 59.47 2vkc h MET 1706Cb 0.52 -0.20 -0.01 0.00 -0.00 0.00 0.00 31.60 31.91 2vkc h MET 1706CO 0.10 0.59 -0.41 0.07 -0.00 0.00 0.00 176.91 177.26 2vkc h ARG 1707N 0.91 0.29 0.00 -0.10 0.11 -1.56 -1.94 114.38 112.10 2vkc h ARG 1707Ca 0.25 -0.14 -0.10 0.00 0.10 0.00 0.00 59.98 60.09 2vkc h ARG 1707Cb -0.10 -0.00 0.01 0.00 1.11 0.00 0.00 29.97 30.98 2vkc h ARG 1707CO -0.05 0.65 -0.38 0.28 0.10 0.00 0.00 179.97 180.57 2vkc h VAL 1708N 0.24 1.51 -0.93 0.08 2.07 -1.18 -3.20 116.25 114.84 2vkc h VAL 1708Ca 0.02 -2.02 0.08 0.00 0.82 0.00 0.00 66.70 65.61 2vkc h VAL 1708Cb 0.83 2.73 -0.07 0.00 -1.52 0.00 0.00 31.29 33.26 2vkc h VAL 1708CO 0.07 0.56 0.58 -0.07 0.02 0.00 0.00 177.57 178.73 2vkc h LEU 1709N -0.37 0.89 -0.28 2.57 3.38 -0.35 0.36 115.31 121.51 2vkc h LEU 1709Ca -0.05 0.03 -0.03 0.00 0.09 0.00 0.00 57.88 57.92 2vkc h LEU 1709Cb 1.13 -0.15 -0.01 0.00 0.09 0.00 0.00 40.66 41.72 2vkc h LEU 1709CO 0.08 0.53 0.07 1.05 0.09 0.00 0.00 178.44 180.25 2vkc h GLU 1710N 1.00 0.44 -0.05 1.13 4.11 -1.48 -0.77 114.58 118.96 2vkc h GLU 1710Ca 0.43 -0.11 -0.14 0.00 0.07 0.00 0.00 59.36 59.61 2vkc h GLU 1710Cb 0.29 -0.06 -0.01 0.00 0.50 0.00 0.00 28.75 29.47 2vkc h GLU 1710CO -0.21 0.53 -0.62 1.57 0.07 0.00 0.00 179.01 180.35 2vkc h LYS 1711N 0.28 0.18 -0.40 1.06 2.10 -1.37 -1.14 116.57 117.27 2vkc h LYS 1711Ca 0.09 -0.13 -0.10 0.00 -2.00 0.00 0.00 60.65 58.51 2vkc h LYS 1711Cb 0.28 0.02 -0.01 0.00 -0.90 0.00 0.00 32.23 31.62 2vkc h LYS 1711CO 0.00 0.74 -0.15 0.87 -2.00 0.00 0.00 179.45 178.91 2vkc h LYS 1712N 0.13 0.81 -0.36 0.07 1.79 -0.19 0.25 116.57 119.08 2vkc h LYS 1712Ca -0.01 -0.34 -0.07 0.00 -2.18 0.00 0.00 60.65 58.06 2vkc h LYS 1712Cb 1.12 -0.03 -0.02 0.00 -1.58 0.00 0.00 32.23 31.72 2vkc h LYS 1712CO 0.09 0.96 -0.07 1.15 -1.08 0.00 0.00 179.45 180.51 2vkc h THR 1713N 0.63 1.23 0.24 -0.16 2.02 -0.90 0.43 112.91 116.39 2vkc h THR 1713Ca 0.10 -0.97 -0.01 0.00 0.77 0.00 0.00 66.41 66.29 2vkc h THR 1713Cb 0.69 1.03 0.00 0.00 -1.74 0.00 0.00 68.15 68.14 2vkc h THR 1713CO 0.05 0.33 -0.12 -0.33 0.37 0.00 0.00 175.52 175.82 2vkc h GLU 1714N 0.55 -0.31 -0.10 6.66 5.08 -0.77 -2.76 114.58 122.92 2vkc h GLU 1714Ca 0.11 0.02 -0.04 0.00 -1.00 0.00 0.00 59.36 58.45 2vkc h GLU 1714Cb 0.45 0.07 -0.01 0.00 0.50 0.00 0.00 28.75 29.76 2vkc h GLU 1714CO 0.02 -0.04 -0.13 1.05 -1.00 0.00 0.00 179.01 178.91 2vkc h GLU 1715N -0.56 0.15 0.34 2.33 4.11 -0.30 0.22 114.58 120.87 2vkc h GLU 1715Ca -0.03 -0.03 -0.00 0.00 0.07 0.00 0.00 59.36 59.36 2vkc h GLU 1715Cb 0.41 -0.02 -0.02 0.00 0.50 0.00 0.00 28.75 29.62 2vkc h GLU 1715CO 0.05 0.29 -0.35 0.35 0.07 0.00 0.00 179.01 179.43 2vkc h PHE 1716N 0.15 -0.94 0.00 2.06 3.57 -0.84 0.63 116.94 121.56 2vkc h PHE 1716Ca 0.03 0.01 0.00 0.00 3.53 0.00 0.00 57.97 61.54 2vkc h PHE 1716Cb 0.32 0.37 0.00 0.00 2.79 0.00 0.00 35.95 39.43 2vkc h PHE 1716CO 0.00 -0.49 -0.89 1.57 -2.23 0.00 0.00 178.31 176.28 2vkc h LYS 1717N -0.72 0.00 0.00 1.11 2.10 -1.18 -3.08 116.57 114.80 2vkc h LYS 1717Ca -0.02 0.00 -0.25 0.00 -2.00 0.00 0.00 60.65 58.38 2vkc h LYS 1717Cb 0.65 0.00 -0.04 0.00 -0.90 0.00 0.00 32.23 31.94 2vkc h LYS 1717CO -0.07 0.00 -1.64 1.04 -2.00 0.00 0.00 179.45 176.78 2vkc n GLN 1718N -2.56 0.55 -0.00 0.07 6.02 0.73 -4.72 117.38 117.46 2vkc n GLN 1718Ca 0.01 0.36 -0.18 0.00 -0.01 0.00 0.00 57.00 57.18 2vkc n GLN 1718Cb 0.52 -1.56 -0.14 0.00 1.02 0.00 0.00 30.24 30.08 2vkc n GLN 1718CO 0.00 0.00 0.00 0.09 -1.01 0.00 0.00 177.06 176.14 2vkc n ASN 1719N -4.39 1.80 0.00 1.08 3.02 0.10 -5.00 115.26 111.87 2vkc n ASN 1719Ca -0.34 0.26 0.00 0.00 -0.03 0.00 0.00 54.58 54.46 2vkc n ASN 1719Cb 0.68 -0.65 0.00 0.00 -0.61 0.00 0.00 39.78 39.20 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 1.89 0.68 0.00 7.41 0.00 0.20 -5.01 105.19 110.36 2vkc n GLY 1720Ca -0.28 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.74 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 0.00 0.42 3.76 -0.02 0.00 -0.85 -4.96 105.19 103.53 2vkc n GLY 1721Ca 0.00 -1.64 -0.41 0.00 0.00 0.00 0.00 46.02 43.98 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 0.65 4.56 0.00 1.61 -0.14 -1.26 -4.80 119.74 120.35 2vkc s LYS 1722Ca 0.00 1.90 0.05 0.00 -1.36 0.00 0.00 55.97 56.56 2vkc s LYS 1722Cb 0.00 -3.17 0.30 0.00 -1.68 0.00 0.00 37.83 33.27 2vkc s LYS 1722CO 0.00 0.08 1.02 -0.35 -0.76 0.00 0.00 175.35 175.34 2vkc n PRO 1723N 1.33 0.81 -4.15 -1.68 -0.04 -1.26 -4.67 135.00 125.34 2vkc n PRO 1723Ca 0.00 0.00 -0.11 0.00 -0.04 0.00 0.00 63.50 63.35 2vkc n PRO 1723Cb 0.44 -1.10 -0.09 0.00 -0.04 0.00 0.00 33.50 32.71 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 -2.00 0.98 -0.07 0.54 1.13 -1.26 -0.53 117.35 116.13 2vkc s TYR 1724Ca 0.07 -1.24 -0.03 0.00 -1.41 0.00 0.00 57.07 54.46 2vkc s TYR 1724Cb 0.03 -0.42 0.04 0.00 -1.10 0.00 0.00 41.96 40.51 2vkc s TYR 1724CO 0.06 -0.68 0.13 -1.17 -2.51 0.00 0.00 175.55 171.38 2vkc s LEU 1725N -3.12 0.02 -0.30 -3.49 2.96 0.13 -4.83 118.68 110.07 2vkc s LEU 1725Ca 0.34 0.27 -0.19 0.00 -0.22 0.00 0.00 54.13 54.33 2vkc s LEU 1725Cb 0.06 0.17 -0.02 0.00 0.50 0.00 0.00 46.19 46.91 2vkc s LEU 1725CO 0.10 -0.24 0.54 -0.55 -1.32 0.00 0.00 176.35 174.88 2vkc s SER 1726N 2.20 6.41 -0.36 3.68 0.15 0.60 -0.38 113.70 126.00 2vkc s SER 1726Ca 0.03 0.33 -0.09 0.00 0.70 0.00 0.00 55.95 56.92 2vkc s SER 1726Cb -0.12 -2.29 0.03 0.00 -1.71 0.00 0.00 66.02 61.93 2vkc s SER 1726CO -0.05 -0.40 0.16 -0.69 1.20 0.00 0.00 173.24 173.46 2vkc s VAL 1727N 2.42 4.24 -0.51 4.45 1.01 0.14 0.02 120.40 132.16 2vkc s VAL 1727Ca 0.21 -0.96 -0.21 0.00 0.00 0.00 0.00 61.98 61.03 2vkc s VAL 1727Cb -0.15 -3.37 0.05 0.00 0.00 0.00 0.00 36.38 32.91 2vkc s VAL 1727CO 0.11 -0.20 0.71 -0.63 0.00 0.00 0.00 175.10 175.09 2vkc s ILE 1728N 1.49 4.75 -0.02 2.22 1.09 -0.13 -0.52 121.20 130.07 2vkc s ILE 1728Ca 0.01 -0.21 0.05 0.00 -1.10 0.00 0.00 60.65 59.40 2vkc s ILE 1728Cb -0.19 -4.34 -0.24 0.00 -1.06 0.00 0.00 42.46 36.62 2vkc s ILE 1728CO 0.05 -0.85 0.75 0.71 -0.10 0.00 0.00 174.94 175.50 2vkc h THR 1729N 5.90 1.01 0.00 2.92 1.35 -1.62 -1.88 112.91 120.59 2vkc h THR 1729Ca -0.27 -2.78 0.00 0.00 -0.55 0.00 0.00 66.41 62.82 2vkc h THR 1729Cb 1.09 2.57 0.00 0.00 -1.73 0.00 0.00 68.15 70.08 2vkc h THR 1729CO 0.98 0.69 0.00 0.61 -0.25 0.00 0.00 175.52 177.55 2vkc n GLY 1730N 1.61 -0.14 3.08 5.82 0.00 -0.36 -3.70 105.19 111.50 2vkc n GLY 1730Ca -0.16 0.01 -0.08 0.00 0.00 0.00 0.00 46.02 45.78 2vkc n GLY 1730CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 173.32 171.19 2vkc n ARG 1731N -2.31 -1.80 0.00 1.61 0.63 -0.74 -4.75 116.66 109.31 2vkc n ARG 1731Ca 0.00 1.67 0.00 0.00 -0.92 0.00 0.00 57.85 58.60 2vkc n ARG 1731Cb 0.00 -5.14 0.00 0.00 0.45 0.00 0.00 32.46 27.77 2vkc n ARG 1731CO 0.00 0.00 0.00 0.41 -2.51 0.00 0.00 177.63 175.53 2vkc n GLY 1732N -1.07 0.28 3.58 5.14 0.00 -0.95 -4.93 105.19 107.24 2vkc n GLY 1732Ca 0.01 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.63 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 0.00 5.36 0.04 1.61 3.84 -1.26 -4.17 114.94 120.36 2vkc s ASN 1733Ca 0.00 1.16 0.00 0.00 0.21 0.00 0.00 52.86 54.23 2vkc s ASN 1733Cb 0.00 -2.52 0.00 0.00 -0.55 0.00 0.00 41.25 38.18 2vkc s ASN 1733CO 0.00 -2.16 0.00 1.57 -2.79 0.00 0.00 177.10 173.72 2vkc n HIS 1734N 12.30 -2.19 -2.54 0.43 -0.00 -1.26 -1.61 115.22 120.35 2vkc n HIS 1734Ca 0.27 0.12 -0.22 0.00 0.46 0.00 0.00 57.72 58.34 2vkc n HIS 1734Cb 0.49 0.74 0.05 0.00 -0.12 0.00 0.00 29.99 31.16 2vkc n HIS 1734CO 0.00 0.00 0.00 -1.54 0.46 0.00 0.00 176.34 175.26 2vkc s SER 1735N -2.61 5.09 0.42 0.26 1.04 -1.26 -4.97 113.70 111.68 2vkc s SER 1735Ca 0.00 0.05 0.08 0.00 0.48 0.00 0.00 55.95 56.57 2vkc s SER 1735Cb 0.00 -0.84 0.90 0.00 0.10 0.00 0.00 66.02 66.18 2vkc s SER 1735CO 0.00 -1.30 2.06 0.06 0.98 0.00 0.00 173.24 175.03 2vkc h GLN 1736N -0.13 0.49 -0.29 4.02 -0.00 -1.99 -1.84 115.11 115.38 2vkc h GLN 1736Ca -0.42 -0.03 0.00 0.00 -0.00 0.00 0.00 58.65 58.20 2vkc h GLN 1736Cb 1.30 -0.11 0.00 0.00 -0.00 0.00 0.00 27.48 28.67 2vkc h GLN 1736CO 0.53 0.32 0.00 0.41 -0.00 0.00 0.00 178.83 180.09 2vkc n GLY 1737N -1.48 0.46 2.66 0.06 0.00 -1.26 -4.49 105.19 101.14 2vkc n GLY 1737Ca 0.03 -0.37 -0.41 0.00 0.00 0.00 0.00 46.02 45.27 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 1.05 4.81 3.56 -0.02 0.00 -0.69 -4.93 105.19 108.96 2vkc n GLY 1738Ca 0.12 -1.95 -0.41 0.00 0.00 0.00 0.00 46.02 43.79 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 0.47 3.67 -0.44 1.61 1.01 -1.26 -4.29 120.40 121.17 2vkc s VAL 1739Ca 0.49 0.47 0.03 0.00 0.00 0.00 0.00 61.98 62.96 2vkc s VAL 1739Cb 0.14 -4.51 0.15 0.00 0.00 0.00 0.00 36.38 32.16 2vkc s VAL 1739CO -0.05 -1.37 0.30 0.00 0.00 0.00 0.00 175.10 173.98 2vkc s ALA 1740N 6.59 1.83 -0.62 5.51 0.00 -1.26 -4.96 121.76 128.85 2vkc s ALA 1740Ca 0.49 -2.53 0.15 0.00 0.00 0.00 0.00 51.96 50.07 2vkc s ALA 1740Cb -0.10 -1.76 0.72 0.00 0.00 0.00 0.00 23.12 21.98 2vkc s ALA 1740CO 0.20 -2.05 1.46 0.54 0.00 0.00 0.00 175.76 175.91 2vkc n ARG 1741N 3.24 0.09 -0.21 0.00 1.74 -1.26 -1.29 116.66 118.97 2vkc n ARG 1741Ca 0.18 0.48 0.09 0.00 -0.77 0.00 0.00 57.85 57.82 2vkc n ARG 1741Cb 0.39 -1.73 0.37 0.00 -1.02 0.00 0.00 32.46 30.47 2vkc n ARG 1741CO 0.00 0.00 0.00 0.82 -1.52 0.00 0.00 177.63 176.93 2vkc h ILE 1742N 0.00 0.96 0.79 0.55 2.04 -1.91 -1.71 117.51 118.23 2vkc h ILE 1742Ca 0.00 -0.25 -0.04 0.00 1.00 0.00 0.00 64.86 65.58 2vkc h ILE 1742Cb 0.13 0.18 0.01 0.00 -0.74 0.00 0.00 36.82 36.40 2vkc h ILE 1742CO 0.00 0.13 -0.38 0.50 0.00 0.00 0.00 178.15 178.40 2vkc h LYS 1743N 0.72 -1.03 -0.63 2.37 3.64 -1.48 0.12 116.57 120.28 2vkc h LYS 1743Ca 0.35 0.07 0.02 0.00 -1.27 0.00 0.00 60.65 59.83 2vkc h LYS 1743Cb 0.43 0.23 -0.03 0.00 -0.41 0.00 0.00 32.23 32.45 2vkc h LYS 1743CO -0.13 -0.67 0.42 -1.00 -2.27 0.00 0.00 179.45 175.80 2vkc h PRO 1744N -1.17 0.77 -0.22 1.90 0.13 -1.72 0.11 132.00 131.80 2vkc h PRO 1744Ca -0.11 -0.05 -0.02 0.00 -0.87 0.00 0.00 66.00 64.96 2vkc h PRO 1744Cb 0.83 -0.17 -0.01 0.00 0.13 0.00 0.00 31.00 31.78 2vkc h PRO 1744CO 0.18 0.51 0.07 0.00 -0.23 0.00 0.00 178.00 178.53 2vkc h ALA 1745N 1.62 0.28 -0.21 -0.56 0.00 -1.17 -2.37 119.26 116.85 2vkc h ALA 1745Ca 0.24 -0.13 -0.08 0.00 0.00 0.00 0.00 54.91 54.95 2vkc h ALA 1745Cb 0.01 -0.08 -0.00 0.00 0.00 0.00 0.00 17.79 17.71 2vkc h ALA 1745CO -0.06 -0.10 -0.18 0.28 0.00 0.00 0.00 179.25 179.19 2vkc h VAL 1746N 0.18 1.32 -0.67 0.00 2.07 -0.40 -3.01 116.25 115.74 2vkc h VAL 1746Ca 0.07 -1.31 0.12 0.00 0.82 0.00 0.00 66.70 66.40 2vkc h VAL 1746Cb 0.21 1.70 -0.09 0.00 -1.52 0.00 0.00 31.29 31.60 2vkc h VAL 1746CO -0.00 0.40 0.22 0.40 0.02 0.00 0.00 177.57 178.61 2vkc h ILE 1747N 0.18 0.67 -0.97 4.57 2.04 -0.73 0.87 117.51 124.14 2vkc h ILE 1747Ca 0.04 -0.12 0.07 0.00 1.00 0.00 0.00 64.86 65.84 2vkc h ILE 1747Cb 0.71 0.27 -0.06 0.00 -0.74 0.00 0.00 36.82 37.00 2vkc h ILE 1747CO 0.05 0.07 0.63 0.50 0.00 0.00 0.00 178.15 179.39 2vkc h LYS 1748N 0.36 1.09 -0.26 2.37 3.64 -1.42 -0.92 116.57 121.44 2vkc h LYS 1748Ca 0.36 -0.07 -0.04 0.00 -1.27 0.00 0.00 60.65 59.63 2vkc h LYS 1748Cb 0.52 -0.25 -0.01 0.00 -0.41 0.00 0.00 32.23 32.09 2vkc h LYS 1748CO -0.39 0.72 0.02 -0.92 -2.27 0.00 0.00 179.45 176.61 2vkc h TYR 1749N 1.13 0.48 -0.11 1.91 5.03 -0.71 -2.30 116.97 122.40 2vkc h TYR 1749Ca 0.42 -0.08 -0.01 0.00 2.58 0.00 0.00 58.73 61.64 2vkc h TYR 1749Cb 0.18 -0.13 -0.00 0.00 1.55 0.00 0.00 36.73 38.33 2vkc h TYR 1749CO -0.00 0.58 0.02 -0.07 -1.32 0.00 0.00 178.16 177.37 2vkc h LEU 1750N 0.24 0.18 -1.06 2.82 -0.00 -0.81 -2.93 115.31 113.74 2vkc h LEU 1750Ca 0.08 -0.26 -0.04 0.00 -0.00 0.00 0.00 57.88 57.65 2vkc h LEU 1750Cb 0.38 -0.05 -0.03 0.00 -0.00 0.00 0.00 40.66 40.97 2vkc h LEU 1750CO 0.01 0.39 0.20 0.16 -0.00 0.00 0.00 178.44 179.21 2vkc h ILE 1751N -0.05 1.22 0.00 1.22 -0.00 -1.21 0.18 117.51 118.88 2vkc h ILE 1751Ca 0.03 -0.73 -0.03 0.00 -0.00 0.00 0.00 64.86 64.14 2vkc h ILE 1751Cb 0.29 0.55 -0.00 0.00 -0.00 0.00 0.00 36.82 37.66 2vkc h ILE 1751CO 0.00 0.28 -0.13 0.28 -0.00 0.00 0.00 178.15 178.59 2vkc h SER 1752N 0.86 0.00 -0.50 2.16 0.02 -1.37 -2.18 113.55 112.53 2vkc h SER 1752Ca 0.20 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.15 2vkc h SER 1752Cb 0.22 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.76 2vkc h SER 1752CO -0.01 0.13 0.00 1.41 -1.14 0.00 0.00 176.83 177.22 2vkc n HIS 1753N -3.33 0.75 -3.35 3.45 8.25 -0.83 -4.96 115.22 115.19 2vkc n HIS 1753Ca -0.00 -0.53 -0.21 0.00 -0.26 0.00 0.00 57.72 56.72 2vkc n HIS 1753Cb 0.34 -0.05 0.06 0.00 1.12 0.00 0.00 29.99 31.47 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 0.92 -5.91 -4.64 0.41 7.64 -0.75 -5.00 113.62 106.29 2vkc n SER 1754Ca 0.18 -0.43 -0.29 0.00 1.01 0.00 0.00 58.87 59.34 2vkc n SER 1754Cb 0.55 -4.57 0.12 0.00 -1.01 0.00 0.00 64.21 59.30 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 -3.25 2.48 -0.21 1.43 0.08 -0.02 -5.02 117.98 113.47 2vkc s PHE 1755Ca 0.47 0.61 0.02 0.00 0.12 0.00 0.00 56.93 58.14 2vkc s PHE 1755Cb -0.21 -3.70 0.03 0.00 -0.57 0.00 0.00 43.02 38.58 2vkc s PHE 1755CO 0.58 -2.10 -0.17 1.03 -0.10 0.00 0.00 175.22 174.46 2vkc s ARG 1756N -5.67 2.72 0.18 0.44 0.52 -1.25 -4.76 118.95 111.13 2vkc s ARG 1756Ca 0.66 -1.02 -0.03 0.00 -0.52 0.00 0.00 55.73 54.82 2vkc s ARG 1756Cb -0.09 -2.69 -0.03 0.00 0.52 0.00 0.00 34.95 32.66 2vkc s ARG 1756CO 0.50 -0.34 0.17 -0.59 0.02 0.00 0.00 175.30 175.06 2vkc s PHE 1757N 1.22 0.90 -0.27 -0.53 -0.71 -1.26 0.77 117.98 118.11 2vkc s PHE 1757Ca -0.00 -1.19 -0.22 0.00 -1.04 0.00 0.00 56.93 54.47 2vkc s PHE 1757Cb -0.16 -0.39 0.07 0.00 -1.21 0.00 0.00 43.02 41.34 2vkc s PHE 1757CO -0.10 -0.66 0.70 0.45 -1.34 0.00 0.00 175.22 174.27 2vkc s SER 1758N -3.09 -0.78 0.08 1.98 0.15 -0.11 -4.96 113.70 106.96 2vkc s SER 1758Ca 0.31 1.44 -0.30 0.00 0.70 0.00 0.00 55.95 58.10 2vkc s SER 1758Cb 0.06 1.42 -0.05 0.00 -1.71 0.00 0.00 66.02 65.74 2vkc s SER 1758CO 0.08 -0.24 1.02 -0.70 1.20 0.00 0.00 173.24 174.59 2vkc s GLU 1759N 0.68 4.61 0.01 5.44 2.12 -1.26 0.37 118.70 130.66 2vkc s GLU 1759Ca -0.02 1.52 -0.25 0.00 0.36 0.00 0.00 54.97 56.57 2vkc s GLU 1759Cb -0.05 -3.38 -0.15 0.00 0.26 0.00 0.00 34.13 30.81 2vkc s GLU 1759CO -0.04 0.05 1.13 0.82 -0.54 0.00 0.00 175.26 176.68 2vkc h ILE 1760N 4.29 0.28 0.00 -3.70 2.04 -1.14 -3.47 117.51 115.81 2vkc h ILE 1760Ca -0.42 -0.43 0.00 0.00 1.00 0.00 0.00 64.86 65.01 2vkc h ILE 1760Cb 1.21 0.39 0.00 0.00 -0.74 0.00 0.00 36.82 37.68 2vkc h ILE 1760CO 0.74 0.04 0.00 0.29 0.00 0.00 0.00 178.15 179.22 2vkc n LYS 1761N -5.28 0.00 -0.66 2.37 5.02 -1.26 -5.07 118.16 113.29 2vkc n LYS 1761Ca -0.11 0.00 -0.10 0.00 -2.02 0.00 0.00 58.31 56.08 2vkc n LYS 1761Cb 0.32 0.00 -0.10 0.00 -0.02 0.00 0.00 35.03 35.23 2vkc n LYS 1761CO 0.00 0.00 0.00 -0.35 -0.52 0.00 0.00 177.40 176.53 2vkc n PRO 1762N 0.00 0.00 -2.47 1.97 -0.04 -1.25 -1.57 135.00 131.64 2vkc n PRO 1762Ca 0.00 0.00 -0.21 0.00 -0.04 0.00 0.00 63.50 63.25 2vkc n PRO 1762Cb 0.00 -0.46 -0.01 0.00 -0.04 0.00 0.00 33.50 33.00 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 2.45 -0.50 2.84 0.55 0.00 -0.63 -2.25 105.19 107.64 2vkc n GLY 1763Ca 0.30 0.01 -0.29 0.00 0.00 0.00 0.00 46.02 46.04 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 1.64 4.13 -0.32 0.00 1.43 0.32 -0.47 118.68 125.41 2vkc s LEU 1765Ca -0.03 0.49 -0.11 0.00 -1.03 0.00 0.00 54.13 53.45 2vkc s LEU 1765Cb -0.18 -2.52 -0.01 0.00 0.03 0.00 0.00 46.19 43.51 2vkc s LEU 1765CO -0.07 -0.10 0.20 -0.75 0.23 0.00 0.00 176.35 175.85 2vkc s LYS 1766N 1.46 3.45 -0.09 1.70 2.20 0.16 0.24 119.74 128.86 2vkc s LYS 1766Ca 0.19 -0.66 -0.04 0.00 -0.36 0.00 0.00 55.97 55.10 2vkc s LYS 1766Cb -0.15 -3.70 -0.04 0.00 -1.51 0.00 0.00 37.83 32.44 2vkc s LYS 1766CO 0.08 -0.42 0.06 0.08 -0.36 0.00 0.00 175.35 174.80 2vkc s VAL 1767N 1.68 4.83 -0.15 4.02 1.01 0.49 -0.93 120.40 131.34 2vkc s VAL 1767Ca 0.05 -0.07 -0.08 0.00 0.00 0.00 0.00 61.98 61.89 2vkc s VAL 1767Cb -0.17 -3.07 -0.04 0.00 0.00 0.00 0.00 36.38 33.09 2vkc s VAL 1767CO 0.09 0.60 0.11 -0.04 0.00 0.00 0.00 175.10 175.85 2vkc s MET 1768N -0.99 3.74 0.35 2.72 -1.94 0.23 0.22 119.30 123.64 2vkc s MET 1768Ca 0.15 -0.22 -0.25 0.00 -1.71 0.00 0.00 55.69 53.65 2vkc s MET 1768Cb -0.12 -3.23 -0.10 0.00 2.01 0.00 0.00 34.83 33.39 2vkc s MET 1768CO 0.04 0.52 0.95 -0.51 -0.01 0.00 0.00 175.02 176.01 2vkc s LEU 1769N -0.30 4.23 0.00 -0.03 1.43 0.31 -3.87 118.68 120.44 2vkc s LEU 1769Ca 0.10 1.81 0.00 0.00 -1.03 0.00 0.00 54.13 55.01 2vkc s LEU 1769Cb -0.12 -4.16 0.00 0.00 0.03 0.00 0.00 46.19 41.94 2vkc s LEU 1769CO 0.01 -0.16 0.15 2.29 0.23 0.00 0.00 176.35 178.87