#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2fne n THR 1946N 0.00 2.76 0.42 2.61 5.66 -1.26 -1.17 114.28 123.30 2fne n THR 1946Ca 0.00 -1.38 0.05 0.00 -3.05 0.00 0.00 64.05 59.67 2fne n THR 1946Cb 0.00 -1.80 0.23 0.00 -1.55 0.00 0.00 70.33 67.21 2fne n THR 1946CO 0.00 0.00 0.00 -0.62 -3.05 0.00 0.00 175.07 171.40 2fne n GLU 1947N 2.00 0.09 -0.23 1.09 1.02 -1.26 -4.17 120.64 119.19 2fne n GLU 1947Ca 0.32 0.24 0.14 0.00 -0.02 0.00 0.00 57.16 57.84 2fne n GLU 1947Cb 0.76 -1.50 0.45 0.00 -0.02 0.00 0.00 31.44 31.13 2fne n GLU 1947CO 0.00 0.00 0.00 -0.97 1.18 0.00 0.00 177.13 177.34 2fne h ASN 1948N 0.00 0.52 -0.42 1.62 -1.24 -1.59 -0.51 115.58 113.96 2fne h ASN 1948Ca 0.00 0.04 -0.04 0.00 0.71 0.00 0.00 56.30 57.00 2fne h ASN 1948Cb 0.11 -0.07 -0.02 0.00 0.73 0.00 0.00 38.32 39.07 2fne h ASN 1948CO 0.00 0.25 0.12 0.17 -1.29 0.00 0.00 177.43 176.68 2fne h LEU 1949N 0.54 0.67 -1.86 0.34 -0.00 -1.88 -2.10 115.31 111.02 2fne h LEU 1949Ca 0.43 -0.11 0.00 0.00 -0.00 0.00 0.00 57.88 58.20 2fne h LEU 1949Cb 0.85 -0.18 0.00 0.00 -0.00 0.00 0.00 40.66 41.33 2fne h LEU 1949CO -0.17 0.67 0.00 1.88 -0.00 0.00 0.00 178.44 180.81 2fne h TYR 1950N 0.71 0.00 -0.10 0.17 0.05 -1.37 -2.43 116.97 114.00 2fne h TYR 1950Ca 0.16 0.00 0.00 0.00 0.05 0.00 0.00 58.73 58.94 2fne h TYR 1950Cb 0.26 0.00 0.00 0.00 1.01 0.00 0.00 36.73 38.00 2fne h TYR 1950CO 0.01 0.00 0.00 1.19 -1.05 0.00 0.00 178.16 178.31 2fne n PHE 1951N -2.79 0.11 -2.35 4.88 0.99 -0.79 -4.80 117.46 112.70 2fne n PHE 1951Ca -0.01 -0.05 -0.43 0.00 -0.00 0.00 0.00 57.45 56.96 2fne n PHE 1951Cb 0.16 0.00 -0.02 0.00 -1.00 0.00 0.00 39.48 38.62 2fne n PHE 1951CO 0.00 0.00 0.00 -0.65 -0.00 0.00 0.00 176.76 176.11 2fne s GLN 1952N -1.89 3.78 0.40 -1.08 -0.21 -0.92 -4.99 119.66 114.74 2fne s GLN 1952Ca 0.34 1.20 -0.26 0.00 0.02 0.00 0.00 55.36 56.66 2fne s GLN 1952Cb 0.20 -3.95 -0.11 0.00 1.00 0.00 0.00 33.01 30.16 2fne s GLN 1952CO 0.31 -1.30 1.27 0.45 -2.12 0.00 0.00 175.29 173.89 2fne n SER 1953N 8.17 2.58 -4.07 5.90 2.88 -1.26 -4.98 113.62 122.84 2fne n SER 1953Ca 0.16 1.14 -0.33 0.00 -1.33 0.00 0.00 58.87 58.51 2fne n SER 1953Cb 0.47 -1.49 -0.14 0.00 -0.75 0.00 0.00 64.21 62.30 2fne n SER 1953CO 0.00 0.00 0.00 -0.04 -1.23 0.00 0.00 175.04 173.77 2fne s MET 1954N -2.10 1.81 0.65 -1.46 -1.94 -1.26 -5.00 119.30 110.00 2fne s MET 1954Ca 0.59 -1.74 -0.15 0.00 -1.71 0.00 0.00 55.69 52.68 2fne s MET 1954Cb -0.53 -3.27 -0.00 0.00 2.01 0.00 0.00 34.83 33.04 2fne s MET 1954CO 0.59 -0.90 1.11 -2.14 -0.01 0.00 0.00 175.02 173.67 2fne s PRO 1955N 1.03 2.84 -0.11 2.03 0.02 -1.26 -2.88 135.00 136.66 2fne s PRO 1955Ca 0.06 1.41 -0.05 0.00 0.02 0.00 0.00 61.00 62.44 2fne s PRO 1955Cb -0.20 -1.95 0.06 0.00 0.02 0.00 0.00 34.50 32.42 2fne s PRO 1955CO -0.06 -1.23 0.24 -1.14 -0.33 0.00 0.00 177.00 174.49 2fne s GLN 1956N -4.04 0.15 0.19 5.54 0.74 -0.13 -4.95 119.66 117.16 2fne s GLN 1956Ca 0.67 0.65 -0.23 0.00 0.05 0.00 0.00 55.36 56.51 2fne s GLN 1956Cb -0.21 -0.09 -0.08 0.00 1.10 0.00 0.00 33.01 33.73 2fne s GLN 1956CO 0.41 -0.25 0.76 0.00 -0.55 0.00 0.00 175.29 175.66 2fne s LYS 1958N -1.49 0.24 -0.29 0.00 1.02 -0.46 -4.98 119.74 113.79 2fne s LYS 1958Ca 0.39 -0.31 -0.01 0.00 0.02 0.00 0.00 55.97 56.07 2fne s LYS 1958Cb -0.20 0.10 0.05 0.00 -0.52 0.00 0.00 37.83 37.25 2fne s LYS 1958CO 0.24 -0.05 -0.03 -1.12 -0.92 0.00 0.00 175.35 173.47 2fne s SER 1959N -0.87 4.73 -0.29 2.83 0.01 -1.26 -1.09 113.70 117.77 2fne s SER 1959Ca -0.10 -1.27 -0.05 0.00 1.31 0.00 0.00 55.95 55.84 2fne s SER 1959Cb -0.06 -1.67 0.02 0.00 0.21 0.00 0.00 66.02 64.52 2fne s SER 1959CO -0.00 -0.23 0.04 -0.63 0.41 0.00 0.00 173.24 172.83 2fne s ILE 1960N 1.22 3.59 -0.22 1.44 1.01 0.19 -4.91 121.20 123.52 2fne s ILE 1960Ca -0.06 -0.87 -0.11 0.00 0.00 0.00 0.00 60.65 59.60 2fne s ILE 1960Cb -0.20 -2.88 -0.05 0.00 0.01 0.00 0.00 42.46 39.35 2fne s ILE 1960CO -0.02 0.07 0.20 -0.89 0.00 0.00 0.00 174.94 174.30 2fne s THR 1961N 1.43 5.34 0.06 2.92 2.01 -1.26 0.59 115.64 126.72 2fne s THR 1961Ca 0.01 0.28 0.08 0.00 0.31 0.00 0.00 61.69 62.37 2fne s THR 1961Cb -0.17 -3.54 -0.03 0.00 0.01 0.00 0.00 72.50 68.77 2fne s THR 1961CO 0.00 0.35 -0.21 -0.76 -0.69 0.00 0.00 174.62 173.31 2fne s LEU 1962N 0.97 2.20 -0.22 4.42 1.43 0.14 -4.96 118.68 122.66 2fne s LEU 1962Ca 0.10 -0.56 -0.10 0.00 -1.03 0.00 0.00 54.13 52.53 2fne s LEU 1962Cb -0.13 -0.95 -0.05 0.00 0.03 0.00 0.00 46.19 45.09 2fne s LEU 1962CO 0.04 0.13 0.14 -1.61 0.23 0.00 0.00 176.35 175.28 2fne s GLU 1963N -1.37 4.10 0.27 1.70 8.01 -1.26 0.84 118.70 131.00 2fne s GLU 1963Ca 0.07 -0.26 -0.30 0.00 0.01 0.00 0.00 54.97 54.49 2fne s GLU 1963Cb -0.09 -3.47 -0.12 0.00 -4.31 0.00 0.00 34.13 26.14 2fne s GLU 1963CO 0.02 0.16 1.50 0.54 0.01 0.00 0.00 175.26 177.49 2fne n ARG 1964N 3.96 2.39 -1.91 1.61 1.74 -1.08 -4.78 116.66 118.59 2fne n ARG 1964Ca -0.16 0.85 -0.13 0.00 -0.77 0.00 0.00 57.85 57.64 2fne n ARG 1964Cb 0.52 -2.57 0.06 0.00 -1.02 0.00 0.00 32.46 29.46 2fne n ARG 1964CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 2fne n GLY 1965N 2.07 1.02 0.32 -0.13 0.00 0.44 -4.93 105.19 103.98 2fne n GLY 1965Ca 0.10 -2.05 0.08 0.00 0.00 0.00 0.00 46.02 44.15 2fne n GLY 1965CO 0.00 0.00 0.00 -2.55 0.00 0.00 0.00 173.32 170.77 2fne h PRO 1966N 0.00 0.68 -1.27 1.61 0.11 -1.98 -2.25 132.00 128.91 2fne h PRO 1966Ca -0.19 -0.04 -0.59 0.00 0.11 0.00 0.00 66.00 65.29 2fne h PRO 1966Cb 0.75 -0.15 -0.24 0.00 0.11 0.00 0.00 31.00 31.46 2fne h PRO 1966CO 0.22 0.45 0.76 -0.25 -0.21 0.00 0.00 178.00 178.97 2fne n ASP 1967N -4.81 7.33 0.00 -2.05 8.00 -1.26 -5.03 116.55 118.73 2fne n ASP 1967Ca 0.19 -3.58 0.00 0.00 0.71 0.00 0.00 54.79 52.10 2fne n ASP 1967Cb 0.45 -1.02 0.00 0.00 -0.02 0.00 0.00 41.12 40.53 2fne n ASP 1967CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2fne n GLY 1968N -0.48 2.04 0.17 0.44 0.00 -0.85 -3.47 105.19 103.04 2fne n GLY 1968Ca 0.53 -0.57 0.12 0.00 0.00 0.00 0.00 46.02 46.11 2fne n GLY 1968CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 2fne h LEU 1969N 0.00 0.00 -0.76 0.99 3.38 -1.92 0.13 115.31 117.13 2fne h LEU 1969Ca 0.00 -0.01 0.00 0.00 0.09 0.00 0.00 57.88 57.96 2fne h LEU 1969Cb 0.00 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.75 2fne h LEU 1969CO 0.00 0.01 0.00 0.61 0.09 0.00 0.00 178.44 179.15 2fne n GLY 1970N 1.19 0.82 3.38 0.83 0.00 -1.23 -1.33 105.19 108.86 2fne n GLY 1970Ca 0.04 -0.72 -0.10 0.00 0.00 0.00 0.00 46.02 45.24 2fne n GLY 1970CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 2fne s PHE 1971N -2.76 -0.08 0.19 1.61 -0.12 -1.26 -1.62 117.98 113.94 2fne s PHE 1971Ca 0.00 -0.25 0.08 0.00 -0.05 0.00 0.00 56.93 56.70 2fne s PHE 1971Cb 0.00 0.25 -0.04 0.00 -0.63 0.00 0.00 43.02 42.60 2fne s PHE 1971CO 0.00 -0.77 -0.01 -1.54 -0.05 0.00 0.00 175.22 172.85 2fne s SER 1972N -2.85 4.69 0.11 1.98 1.04 -0.04 -4.99 113.70 113.65 2fne s SER 1972Ca 0.07 -0.46 0.08 0.00 0.48 0.00 0.00 55.95 56.12 2fne s SER 1972Cb 0.01 -0.96 -0.04 0.00 0.10 0.00 0.00 66.02 65.13 2fne s SER 1972CO -0.07 0.07 -0.20 0.27 0.98 0.00 0.00 173.24 174.29 2fne s ILE 1973N -1.84 1.72 0.20 -1.02 -4.36 -1.26 -0.68 121.20 113.96 2fne s ILE 1973Ca 0.28 -1.62 0.04 0.00 -0.26 0.00 0.00 60.65 59.09 2fne s ILE 1973Cb -0.09 -1.61 -0.05 0.00 1.25 0.00 0.00 42.46 41.97 2fne s ILE 1973CO 0.19 -0.12 -0.04 0.68 0.24 0.00 0.00 174.94 175.89 2fne s VAL 1974N -1.36 1.09 0.00 8.37 -7.23 -0.11 -4.85 120.40 116.31 2fne s VAL 1974Ca 0.08 -2.05 0.00 0.00 -1.81 0.00 0.00 61.98 58.20 2fne s VAL 1974Cb -0.09 -2.17 0.00 0.00 0.56 0.00 0.00 36.38 34.68 2fne s VAL 1974CO 0.05 -0.47 0.00 0.61 -0.31 0.00 0.00 175.10 174.97 2fne n GLY 1975N -0.34 -1.73 0.00 2.32 0.00 -1.26 -1.19 105.19 102.98 2fne n GLY 1975Ca -0.07 -2.08 0.00 0.00 0.00 0.00 0.00 46.02 43.88 2fne n GLY 1975CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2fne n GLY 1976N -0.00 3.35 3.73 -0.02 0.00 -0.39 -4.01 105.19 107.85 2fne n GLY 1976Ca 0.00 -1.93 -0.42 0.00 0.00 0.00 0.00 46.02 43.68 2fne n GLY 1976CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 173.32 172.85 2fne s TYR 1977N -2.85 2.95 -1.64 1.61 5.04 0.18 -0.91 117.35 121.73 2fne s TYR 1977Ca 0.00 0.69 0.00 0.00 -2.44 0.00 0.00 57.07 55.32 2fne s TYR 1977Cb 0.00 -3.98 0.00 0.00 0.35 0.00 0.00 41.96 38.33 2fne s TYR 1977CO 0.00 -3.48 0.00 0.41 -1.34 0.00 0.00 175.55 171.14 2fne n GLY 1978N 3.10 0.47 3.85 8.97 0.00 -1.26 -4.28 105.19 116.03 2fne n GLY 1978Ca 0.11 -0.16 -0.30 0.00 0.00 0.00 0.00 46.02 45.67 2fne n GLY 1978CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2fne s SER 1979N -2.45 5.26 0.57 1.61 1.04 -0.95 -4.87 113.70 113.91 2fne s SER 1979Ca 0.00 1.31 0.28 0.00 0.48 0.00 0.00 55.95 58.02 2fne s SER 1979Cb 0.00 -2.14 1.50 0.00 0.10 0.00 0.00 66.02 65.47 2fne s SER 1979CO 0.00 -1.48 1.97 -0.65 0.98 0.00 0.00 173.24 174.06 2fne h PRO 1980N -0.75 0.00 -0.01 4.02 0.11 -1.93 0.21 132.00 133.65 2fne h PRO 1980Ca -0.45 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.66 2fne h PRO 1980Cb 1.24 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.35 2fne h PRO 1980CO 0.61 0.00 -0.01 0.72 -0.21 0.00 0.00 178.00 179.11 2fne n HIS 1981N -3.96 0.00 0.00 0.65 8.25 -1.26 -5.04 115.22 113.86 2fne n HIS 1981Ca 0.08 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.54 2fne n HIS 1981Cb 0.58 -0.01 0.00 0.00 1.12 0.00 0.00 29.99 31.68 2fne n HIS 1981CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 2fne n GLY 1982N 1.12 -1.00 3.54 -1.41 0.00 0.73 -4.90 105.19 103.27 2fne n GLY 1982Ca 0.21 -2.17 -0.41 0.00 0.00 0.00 0.00 46.02 43.64 2fne n GLY 1982CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 2fne s ASP 1983N -3.53 6.32 0.25 1.61 1.01 -1.26 -2.24 116.67 118.84 2fne s ASP 1983Ca 0.00 -0.96 0.11 0.00 0.71 0.00 0.00 52.55 52.41 2fne s ASP 1983Cb 0.00 -2.55 -0.05 0.00 1.01 0.00 0.00 42.92 41.34 2fne s ASP 1983CO 0.00 -1.64 -0.17 -0.76 0.21 0.00 0.00 175.17 172.81 2fne s LEU 1984N 5.18 2.68 1.28 1.23 1.43 -0.09 -4.91 118.68 125.47 2fne s LEU 1984Ca 0.38 -0.91 -0.20 0.00 -1.03 0.00 0.00 54.13 52.37 2fne s LEU 1984Cb -0.05 -1.25 0.31 0.00 0.03 0.00 0.00 46.19 45.24 2fne s LEU 1984CO 0.03 0.05 1.05 -2.84 0.23 0.00 0.00 176.35 174.88 2fne s PRO 1985N -3.33 -1.79 -0.28 1.29 0.02 -1.26 -1.26 135.00 128.39 2fne s PRO 1985Ca 0.28 0.03 -0.21 0.00 0.02 0.00 0.00 61.00 61.13 2fne s PRO 1985Cb -0.06 -1.52 -0.01 0.00 0.02 0.00 0.00 34.50 32.93 2fne s PRO 1985CO 0.15 -4.11 0.65 0.42 -0.33 0.00 0.00 177.00 173.78 2fne s ILE 1986N -2.74 4.94 -0.02 2.83 -1.09 -1.26 -2.12 121.20 121.73 2fne s ILE 1986Ca 0.70 1.02 0.02 0.00 -2.23 0.00 0.00 60.65 60.16 2fne s ILE 1986Cb -0.11 -3.98 -0.03 0.00 -1.58 0.00 0.00 42.46 36.75 2fne s ILE 1986CO 0.57 -0.07 -0.06 -0.31 -1.23 0.00 0.00 174.94 173.84 2fne s TYR 1987N 2.59 2.93 0.03 3.97 1.51 -0.33 -0.96 117.35 127.08 2fne s TYR 1987Ca 0.26 -0.00 -0.30 0.00 -1.01 0.00 0.00 57.07 56.02 2fne s TYR 1987Cb -0.15 -1.65 -0.06 0.00 -0.11 0.00 0.00 41.96 39.99 2fne s TYR 1987CO 0.10 0.37 1.41 0.08 -1.11 0.00 0.00 175.55 176.40 2fne s VAL 1988N -0.94 3.61 -0.09 0.71 1.01 0.09 -0.94 120.40 123.84 2fne s VAL 1988Ca 0.16 1.04 -0.09 0.00 0.00 0.00 0.00 61.98 63.09 2fne s VAL 1988Cb -0.11 -3.67 -0.03 0.00 0.00 0.00 0.00 36.38 32.58 2fne s VAL 1988CO 0.06 0.01 -0.17 1.17 0.00 0.00 0.00 175.10 176.17 2fne n LYS 1989N 5.11 0.27 -4.90 2.72 4.81 0.14 -0.55 118.16 125.77 2fne n LYS 1989Ca 0.13 0.18 -0.27 0.00 -0.87 0.00 0.00 58.31 57.48 2fne n LYS 1989Cb 0.43 -1.06 -0.16 0.00 0.02 0.00 0.00 35.03 34.27 2fne n LYS 1989CO 0.00 0.00 0.00 0.99 1.17 0.00 0.00 177.40 179.56 2fne s THR 1990N -1.94 1.51 -0.25 3.15 2.01 -1.23 -4.33 115.64 114.56 2fne s THR 1990Ca -0.14 -0.77 -0.07 0.00 0.31 0.00 0.00 61.69 61.03 2fne s THR 1990Cb 0.02 -1.29 -0.02 0.00 0.01 0.00 0.00 72.50 71.22 2fne s THR 1990CO 0.20 0.43 0.05 -0.69 -0.69 0.00 0.00 174.62 173.92 2fne s VAL 1991N -0.07 4.09 0.15 3.82 1.01 -1.26 -0.86 120.40 127.28 2fne s VAL 1991Ca -0.02 -0.29 -0.19 0.00 0.00 0.00 0.00 61.98 61.48 2fne s VAL 1991Cb -0.11 -2.92 -0.07 0.00 0.00 0.00 0.00 36.38 33.27 2fne s VAL 1991CO 0.02 0.33 0.63 -0.36 0.00 0.00 0.00 175.10 175.72 2fne s PHE 1992N 1.58 3.71 0.45 5.22 0.08 -0.64 -4.94 117.98 123.44 2fne s PHE 1992Ca 0.06 1.29 -0.25 0.00 0.12 0.00 0.00 56.93 58.14 2fne s PHE 1992Cb -0.15 -2.53 -0.09 0.00 -0.57 0.00 0.00 43.02 39.69 2fne s PHE 1992CO 0.02 0.46 1.43 0.00 -0.10 0.00 0.00 175.22 177.03 2fne n ALA 1993N 1.14 2.05 -0.17 5.36 0.00 -1.26 -2.71 120.51 124.92 2fne n ALA 1993Ca -0.06 0.25 0.00 0.00 0.00 0.00 0.00 53.44 53.64 2fne n ALA 1993Cb 0.51 -2.39 0.00 0.00 0.00 0.00 0.00 19.45 17.57 2fne n ALA 1993CO 0.00 0.00 0.00 0.36 0.00 0.00 0.00 177.50 177.86 2fne n LYS 1994N -0.15 0.00 -2.15 0.00 2.85 -1.26 -5.01 118.16 112.45 2fne n LYS 1994Ca 0.05 0.00 -0.27 0.00 -1.05 0.00 0.00 58.31 57.04 2fne n LYS 1994Cb 0.41 -1.91 0.08 0.00 -0.65 0.00 0.00 35.03 32.96 2fne n LYS 1994CO 0.00 0.00 0.00 0.20 -0.05 0.00 0.00 177.40 177.55 2fne s GLY 1995N -2.00 1.68 0.13 2.58 0.00 -1.10 -4.87 107.32 103.74 2fne s GLY 1995Ca 0.00 -0.93 -0.16 0.00 0.00 0.00 0.00 44.72 43.63 2fne s GLY 1995CO 0.00 -0.48 1.71 0.00 0.00 0.00 0.00 173.10 174.33 2fne h ALA 1996N -0.75 0.49 -0.58 3.20 0.00 -1.81 0.00 119.26 119.82 2fne h ALA 1996Ca -0.44 -0.11 0.03 0.00 0.00 0.00 0.00 54.91 54.39 2fne h ALA 1996Cb 1.31 -0.15 -0.04 0.00 0.00 0.00 0.00 17.79 18.91 2fne h ALA 1996CO 0.59 0.05 0.34 0.00 0.00 0.00 0.00 179.25 180.24 2fne h ALA 1997N 1.03 0.75 -0.31 0.00 0.00 -1.45 -0.36 119.26 118.92 2fne h ALA 1997Ca 0.13 -0.01 -0.00 0.00 0.00 0.00 0.00 54.91 55.03 2fne h ALA 1997Cb 0.12 -0.16 -0.01 0.00 0.00 0.00 0.00 17.79 17.73 2fne h ALA 1997CO -0.02 0.06 0.19 1.03 0.00 0.00 0.00 179.25 180.52 2fne h SER 1998N 0.68 0.37 -0.62 0.00 0.87 -1.66 -1.85 113.55 111.33 2fne h SER 1998Ca 0.23 -0.05 -0.03 0.00 -1.23 0.00 0.00 61.79 60.72 2fne h SER 1998Cb 0.04 -0.09 -0.03 0.00 -0.44 0.00 0.00 62.40 61.88 2fne h SER 1998CO -0.11 0.30 0.28 -0.33 -0.53 0.00 0.00 176.83 176.45 2fne h GLU 1999N 0.40 0.94 -0.41 2.24 3.07 -0.53 -0.99 114.58 119.30 2fne h GLU 1999Ca 0.11 -0.14 -0.09 0.00 -0.50 0.00 0.00 59.36 58.75 2fne h GLU 1999Cb 0.00 -0.17 -0.02 0.00 -0.84 0.00 0.00 28.75 27.73 2fne h GLU 1999CO -0.02 0.75 -0.10 0.22 -1.40 0.00 0.00 179.01 178.46 2fne h ASP 2000N 0.93 0.71 0.00 1.42 1.82 -1.03 -3.48 116.42 116.80 2fne h ASP 2000Ca 0.22 -0.20 0.00 0.00 -0.39 0.00 0.00 57.03 56.66 2fne h ASP 2000Cb 0.14 -0.19 0.00 0.00 0.68 0.00 0.00 39.33 39.96 2fne h ASP 2000CO -0.02 0.84 0.00 0.61 -1.61 0.00 0.00 179.24 179.06 2fne n GLY 2001N -0.50 1.27 0.12 -0.78 0.00 -0.38 -4.92 105.19 100.00 2fne n GLY 2001Ca 0.01 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.79 2fne n GLY 2001CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2fne n ARG 2002N -2.00 0.57 -1.68 1.61 1.74 -1.26 -4.97 116.66 110.67 2fne n ARG 2002Ca 0.00 0.43 -0.40 0.00 -0.77 0.00 0.00 57.85 57.11 2fne n ARG 2002Cb 0.00 -1.63 0.02 0.00 -1.02 0.00 0.00 32.46 29.83 2fne n ARG 2002CO 0.00 0.00 0.00 -0.11 -1.52 0.00 0.00 177.63 176.00 2fne n LEU 2003N -4.36 3.92 -3.69 0.55 7.94 -1.26 -5.01 117.00 115.09 2fne n LEU 2003Ca -0.41 1.06 -0.11 0.00 -1.11 0.00 0.00 56.01 55.44 2fne n LEU 2003Cb 0.76 -1.47 -0.06 0.00 0.53 0.00 0.00 43.42 43.18 2fne n LEU 2003CO 0.12 -0.88 0.10 -1.59 -1.11 0.00 0.00 177.39 174.03 2fne s LYS 2004N -2.29 0.98 0.09 1.96 -2.85 -1.26 -4.93 119.74 111.44 2fne s LYS 2004Ca 0.64 -0.66 -0.36 0.00 -1.00 0.00 0.00 55.97 54.58 2fne s LYS 2004Cb -0.50 0.43 -0.17 0.00 -2.06 0.00 0.00 37.83 35.52 2fne s LYS 2004CO 0.56 -0.36 1.18 -2.13 0.10 0.00 0.00 175.35 174.70 2fne n ARG 2005N 0.02 0.76 0.00 1.78 0.63 -1.26 -1.76 116.66 116.82 2fne n ARG 2005Ca -0.17 0.27 0.00 0.00 -0.92 0.00 0.00 57.85 57.04 2fne n ARG 2005Cb 0.62 -1.81 0.00 0.00 0.45 0.00 0.00 32.46 31.73 2fne n ARG 2005CO 0.00 0.00 0.00 0.41 -2.51 0.00 0.00 177.63 175.53 2fne n GLY 2006N 2.08 2.78 3.68 5.14 0.00 0.29 -4.74 105.19 114.43 2fne n GLY 2006Ca 0.18 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.77 2fne n GLY 2006CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 2fne n ASP 2007N 0.00 2.58 -4.57 1.61 8.00 -0.72 -4.72 116.55 118.72 2fne n ASP 2007Ca 0.00 1.20 -0.36 0.00 0.71 0.00 0.00 54.79 56.35 2fne n ASP 2007Cb 0.00 -1.46 -0.11 0.00 -0.02 0.00 0.00 41.12 39.53 2fne n ASP 2007CO 0.00 0.00 0.00 -1.58 -0.39 0.00 0.00 177.20 175.23 2fne s GLN 2008N -1.84 3.88 -0.35 -1.24 0.74 -0.21 -0.74 119.66 119.92 2fne s GLN 2008Ca 0.56 -0.37 -0.25 0.00 0.05 0.00 0.00 55.36 55.35 2fne s GLN 2008Cb -0.59 -3.36 0.01 0.00 1.10 0.00 0.00 33.01 30.17 2fne s GLN 2008CO 0.62 0.03 0.88 0.42 -0.55 0.00 0.00 175.29 176.69 2fne s ILE 2009N 1.07 4.66 -0.07 -2.34 -1.09 -0.14 -0.55 121.20 122.75 2fne s ILE 2009Ca 0.05 1.19 -0.07 0.00 -2.23 0.00 0.00 60.65 59.58 2fne s ILE 2009Cb -0.14 -4.27 -0.28 0.00 -1.58 0.00 0.00 42.46 36.18 2fne s ILE 2009CO 0.04 -0.44 0.58 0.40 -1.23 0.00 0.00 174.94 174.28 2fne h ILE 2010N 5.74 0.84 -2.86 2.92 1.08 -0.87 -3.42 117.51 120.94 2fne h ILE 2010Ca -0.23 -2.49 -0.07 0.00 -0.39 0.00 0.00 64.86 61.67 2fne h ILE 2010Cb 1.08 2.65 -0.17 0.00 -3.07 0.00 0.00 36.82 37.32 2fne h ILE 2010CO 0.95 0.85 -0.04 0.00 -0.69 0.00 0.00 178.15 179.22 2fne s ALA 2011N -2.58 -1.17 -0.20 1.87 0.00 -1.06 -1.08 121.76 117.55 2fne s ALA 2011Ca -0.17 0.49 -0.00 0.00 0.00 0.00 0.00 51.96 52.28 2fne s ALA 2011Cb 0.06 0.32 0.05 0.00 0.00 0.00 0.00 23.12 23.55 2fne s ALA 2011CO 0.82 -0.46 -0.05 0.08 0.00 0.00 0.00 175.76 176.16 2fne s VAL 2012N -2.30 1.24 -1.64 0.00 1.01 -0.66 -1.46 120.40 116.58 2fne s VAL 2012Ca -0.06 -0.86 -0.14 0.00 0.00 0.00 0.00 61.98 60.92 2fne s VAL 2012Cb -0.01 -1.47 0.12 0.00 0.00 0.00 0.00 36.38 35.02 2fne s VAL 2012CO -0.01 0.02 0.69 0.59 0.00 0.00 0.00 175.10 176.39 2fne n ASN 2013N 4.81 -2.56 0.00 3.32 3.02 0.08 -1.06 115.26 122.87 2fne n ASN 2013Ca -0.12 -1.02 0.00 0.00 -0.03 0.00 0.00 54.58 53.41 2fne n ASN 2013Cb 0.46 -2.78 0.00 0.00 -0.61 0.00 0.00 39.78 36.85 2fne n ASN 2013CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2fne n GLY 2014N -1.57 1.78 3.64 7.41 0.00 -1.26 -5.02 105.19 110.16 2fne n GLY 2014Ca -0.02 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.59 2fne n GLY 2014CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 2fne s GLN 2015N -0.07 4.15 0.28 1.61 -0.21 -0.22 -5.01 119.66 120.19 2fne s GLN 2015Ca 0.00 0.84 -0.30 0.00 0.02 0.00 0.00 55.36 55.92 2fne s GLN 2015Cb 0.00 -3.66 -0.10 0.00 1.00 0.00 0.00 33.01 30.25 2fne s GLN 2015CO 0.00 -0.52 1.46 0.45 -2.12 0.00 0.00 175.29 174.56 2fne s SER 2016N 1.39 6.58 -0.11 5.90 0.15 -1.26 -1.65 113.70 124.69 2fne s SER 2016Ca 0.33 2.77 0.14 0.00 0.70 0.00 0.00 55.95 59.90 2fne s SER 2016Cb -0.15 -2.63 0.61 0.00 -1.71 0.00 0.00 66.02 62.14 2fne s SER 2016CO 0.08 -0.74 1.49 0.18 1.20 0.00 0.00 173.24 175.45 2fne n LEU 2017N 1.91 4.18 -4.64 3.45 4.77 -0.24 -4.92 117.00 121.50 2fne n LEU 2017Ca 0.06 -2.11 -0.42 0.00 -0.03 0.00 0.00 56.01 53.50 2fne n LEU 2017Cb 0.40 -0.55 -0.03 0.00 -2.33 0.00 0.00 43.42 40.91 2fne n LEU 2017CO 0.61 0.67 1.60 -0.70 -1.33 0.00 0.00 177.39 178.23 2fne s GLU 2018N -1.91 3.91 -0.31 3.23 2.12 -1.26 -2.59 118.70 121.89 2fne s GLU 2018Ca 0.43 2.34 0.00 0.00 0.36 0.00 0.00 54.97 58.10 2fne s GLU 2018Cb 0.28 -4.17 0.00 0.00 0.26 0.00 0.00 34.13 30.51 2fne s GLU 2018CO 0.19 -1.21 0.00 0.41 -0.54 0.00 0.00 175.26 174.11 2fne n GLY 2019N 4.74 0.58 3.84 -1.50 0.00 -1.26 -5.00 105.19 106.59 2fne n GLY 2019Ca 0.21 -0.32 -0.32 0.00 0.00 0.00 0.00 46.02 45.60 2fne n GLY 2019CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 2fne s VAL 2020N -1.92 4.45 0.83 1.61 -7.23 -1.07 -4.62 120.40 112.45 2fne s VAL 2020Ca 0.00 1.06 -0.12 0.00 -1.81 0.00 0.00 61.98 61.11 2fne s VAL 2020Cb 0.00 -3.69 0.09 0.00 0.56 0.00 0.00 36.38 33.34 2fne s VAL 2020CO 0.00 -0.78 1.11 0.42 -0.31 0.00 0.00 175.10 175.54 2fne s THR 2021N -2.75 2.74 0.16 5.32 -4.23 -1.26 -0.65 115.64 114.96 2fne s THR 2021Ca 0.59 0.24 -0.16 0.00 -1.18 0.00 0.00 61.69 61.18 2fne s THR 2021Cb -0.11 -2.99 0.02 0.00 1.34 0.00 0.00 72.50 70.76 2fne s THR 2021CO 0.39 -0.31 1.79 -0.74 -0.54 0.00 0.00 174.62 175.20 2fne h HIS 2022N -1.21 0.40 -0.22 3.99 2.76 -1.75 -1.37 115.15 117.76 2fne h HIS 2022Ca -0.48 0.01 -0.07 0.00 -2.20 0.00 0.00 60.37 57.63 2fne h HIS 2022Cb 1.29 -0.12 -0.01 0.00 1.55 0.00 0.00 27.41 30.11 2fne h HIS 2022CO 0.41 0.23 -0.18 1.05 -1.30 0.00 0.00 177.93 178.14 2fne h GLU 2023N 0.44 0.38 -0.48 5.26 9.09 -1.93 -1.61 114.58 125.73 2fne h GLU 2023Ca 0.16 -0.12 -0.03 0.00 0.05 0.00 0.00 59.36 59.42 2fne h GLU 2023Cb 0.04 -0.04 -0.02 0.00 -1.65 0.00 0.00 28.75 27.08 2fne h GLU 2023CO -0.09 0.55 0.17 0.93 0.05 0.00 0.00 179.01 180.62 2fne h GLU 2024N 0.35 0.73 -0.34 1.06 5.08 -1.79 -1.06 114.58 118.61 2fne h GLU 2024Ca 0.06 -0.15 -0.02 0.00 -1.00 0.00 0.00 59.36 58.26 2fne h GLU 2024Cb 0.52 -0.11 -0.02 0.00 0.50 0.00 0.00 28.75 29.65 2fne h GLU 2024CO 0.03 0.68 0.14 0.00 -1.00 0.00 0.00 179.01 178.86 2fne h ALA 2025N 1.02 0.44 -0.17 3.43 0.00 -0.82 -2.02 119.26 121.13 2fne h ALA 2025Ca 0.16 -0.12 0.02 0.00 0.00 0.00 0.00 54.91 54.96 2fne h ALA 2025Cb 0.24 -0.13 -0.02 0.00 0.00 0.00 0.00 17.79 17.88 2fne h ALA 2025CO -0.01 0.03 0.06 0.28 0.00 0.00 0.00 179.25 179.62 2fne h VAL 2026N 0.40 0.97 -0.28 0.00 2.07 -1.20 -0.97 116.25 117.25 2fne h VAL 2026Ca 0.11 -0.05 0.07 0.00 0.82 0.00 0.00 66.70 67.65 2fne h VAL 2026Cb 0.17 0.80 -0.07 0.00 -1.52 0.00 0.00 31.29 30.66 2fne h VAL 2026CO -0.01 0.03 -0.24 0.00 0.02 0.00 0.00 177.57 177.36 2fne h ALA 2027N 1.10 -0.11 -0.33 1.67 0.00 -1.02 0.14 119.26 120.71 2fne h ALA 2027Ca 0.07 0.09 0.03 0.00 0.00 0.00 0.00 54.91 55.10 2fne h ALA 2027Cb 0.04 0.52 -0.03 0.00 0.00 0.00 0.00 17.79 18.32 2fne h ALA 2027CO -0.07 -0.66 0.13 0.82 0.00 0.00 0.00 179.25 179.47 2fne h ILE 2028N -0.23 0.93 -0.25 0.00 2.04 -1.11 -1.47 117.51 117.41 2fne h ILE 2028Ca 0.15 -0.10 -0.12 0.00 1.00 0.00 0.00 64.86 65.79 2fne h ILE 2028Cb 0.46 0.62 -0.01 0.00 -0.74 0.00 0.00 36.82 37.16 2fne h ILE 2028CO -0.41 0.05 -0.35 -0.07 0.00 0.00 0.00 178.15 177.37 2fne h LEU 2029N 0.28 0.56 -0.08 1.44 3.38 -0.72 -3.04 115.31 117.13 2fne h LEU 2029Ca 0.15 -0.23 -0.24 0.00 0.09 0.00 0.00 57.88 57.65 2fne h LEU 2029Cb 0.10 -0.15 0.00 0.00 0.09 0.00 0.00 40.66 40.70 2fne h LEU 2029CO -0.14 0.86 -1.04 0.50 0.09 0.00 0.00 178.44 178.71 2fne h LYS 2030N 0.45 0.34 -0.09 1.13 1.63 -0.58 -3.31 116.57 116.15 2fne h LYS 2030Ca 0.05 -0.44 0.00 0.00 -0.85 0.00 0.00 60.65 59.41 2fne h LYS 2030Cb 0.82 0.14 0.00 0.00 -0.60 0.00 0.00 32.23 32.59 2fne h LYS 2030CO 0.07 1.13 0.00 2.89 -3.45 0.00 0.00 179.45 180.09 2fne n ARG 2031N -3.67 1.86 -2.94 1.90 1.85 -0.57 -4.85 116.66 110.25 2fne n ARG 2031Ca -0.07 -1.27 -0.40 0.00 -1.00 0.00 0.00 57.85 55.11 2fne n ARG 2031Cb 0.90 -1.46 -0.06 0.00 -1.05 0.00 0.00 32.46 30.79 2fne n ARG 2031CO 0.00 0.00 0.00 0.95 -0.01 0.00 0.00 177.63 178.57 2fne s THR 2032N -1.91 4.33 -0.04 8.89 -4.23 -1.15 -5.05 115.64 116.47 2fne s THR 2032Ca 0.35 1.78 0.07 0.00 -1.18 0.00 0.00 61.69 62.70 2fne s THR 2032Cb 0.20 -4.17 -0.02 0.00 1.34 0.00 0.00 72.50 69.85 2fne s THR 2032CO 0.31 0.51 -0.25 -0.54 -0.54 0.00 0.00 174.62 174.11 2fne s LYS 2033N -1.10 2.37 4.86 3.99 3.01 -1.26 -5.02 119.74 126.59 2fne s LYS 2033Ca 0.37 -0.90 0.00 0.00 -1.01 0.00 0.00 55.97 54.43 2fne s LYS 2033Cb -0.24 -2.13 0.00 0.00 -1.01 0.00 0.00 37.83 34.46 2fne s LYS 2033CO 0.27 0.47 0.00 0.41 0.51 0.00 0.00 175.35 177.01 2fne n GLY 2034N 2.70 1.69 3.69 -3.33 0.00 -1.26 -4.79 105.19 103.90 2fne n GLY 2034Ca -0.17 -0.69 -0.40 0.00 0.00 0.00 0.00 46.02 44.76 2fne n GLY 2034CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2fne s THR 2035N 0.00 5.01 -0.12 2.61 2.01 -1.26 -2.63 115.64 121.26 2fne s THR 2035Ca 0.00 1.42 0.03 0.00 0.31 0.00 0.00 61.69 63.44 2fne s THR 2035Cb 0.00 -4.03 0.01 0.00 0.01 0.00 0.00 72.50 68.48 2fne s THR 2035CO 0.00 0.17 -0.21 -0.69 -0.69 0.00 0.00 174.62 173.20 2fne s VAL 2036N 1.33 1.94 -0.29 3.82 1.01 0.25 -4.96 120.40 123.49 2fne s VAL 2036Ca 0.35 -0.92 -0.09 0.00 0.00 0.00 0.00 61.98 61.32 2fne s VAL 2036Cb -0.17 -1.71 -0.01 0.00 0.00 0.00 0.00 36.38 34.48 2fne s VAL 2036CO 0.15 0.53 0.12 -0.89 0.00 0.00 0.00 175.10 175.01 2fne s THR 2037N 0.68 4.50 -0.31 3.92 2.01 -1.26 0.27 115.64 125.45 2fne s THR 2037Ca -0.11 -0.34 -0.11 0.00 0.31 0.00 0.00 61.69 61.44 2fne s THR 2037Cb -0.16 -3.23 -0.03 0.00 0.01 0.00 0.00 72.50 69.09 2fne s THR 2037CO 0.02 0.16 0.19 -0.76 -0.69 0.00 0.00 174.62 173.53 2fne s LEU 2038N 1.61 4.16 -0.22 4.42 1.43 0.20 -0.74 118.68 129.54 2fne s LEU 2038Ca 0.05 -0.31 -0.23 0.00 -1.03 0.00 0.00 54.13 52.62 2fne s LEU 2038Cb -0.16 -2.08 -0.02 0.00 0.03 0.00 0.00 46.19 43.96 2fne s LEU 2038CO 0.05 -0.15 0.72 -0.32 0.23 0.00 0.00 176.35 176.89 2fne s MET 2039N 1.69 4.20 0.02 1.70 -2.45 -0.54 -0.63 119.30 123.29 2fne s MET 2039Ca 0.06 0.77 0.02 0.00 -1.25 0.00 0.00 55.69 55.29 2fne s MET 2039Cb -0.17 -3.61 -0.01 0.00 1.25 0.00 0.00 34.83 32.29 2fne s MET 2039CO 0.09 -0.37 -0.08 0.14 1.05 0.00 0.00 175.02 175.85 2fne s VAL 2040N 2.35 0.57 -0.32 10.11 -7.23 -0.25 -0.15 120.40 125.49 2fne s VAL 2040Ca 0.32 -0.66 -0.12 0.00 -1.81 0.00 0.00 61.98 59.71 2fne s VAL 2040Cb -0.16 -0.55 -0.02 0.00 0.56 0.00 0.00 36.38 36.21 2fne s VAL 2040CO 0.09 -0.08 0.21 -0.22 -0.31 0.00 0.00 175.10 174.80 2fne s LEU 2041N -0.81 4.33 0.48 1.32 2.96 0.29 -1.35 118.68 125.89 2fne s LEU 2041Ca -0.03 -0.33 0.03 0.00 -0.22 0.00 0.00 54.13 53.59 2fne s LEU 2041Cb -0.06 -2.11 -0.03 0.00 0.50 0.00 0.00 46.19 44.49 2fne s LEU 2041CO 0.00 -0.18 0.01 -0.55 -1.32 0.00 0.00 176.35 174.31 2fne s SER 2042N 1.72 4.02 0.20 3.68 0.15 -0.18 -1.04 113.70 122.24 2fne s SER 2042Ca 0.06 -1.58 0.01 0.00 0.70 0.00 0.00 55.95 55.15 2fne s SER 2042Cb -0.17 0.27 -0.05 0.00 -1.71 0.00 0.00 66.02 64.37 2fne s SER 2042CO 0.10 -0.75 0.04 -0.55 1.20 0.00 0.00 173.24 173.29 2fne s SER 2043N -3.82 1.07 0.24 5.45 0.15 -1.26 -0.96 113.70 114.56 2fne s SER 2043Ca 0.14 -1.26 0.00 0.00 0.70 0.00 0.00 55.95 55.54 2fne s SER 2043Cb 0.04 0.16 0.28 0.00 -1.71 0.00 0.00 66.02 64.79 2fne s SER 2043CO 0.07 -0.65 1.63 -2.24 1.20 0.00 0.00 173.24 173.25 2fne h ASP 2044N 2.61 0.54 -4.01 5.45 2.03 -1.89 -3.45 116.42 117.69 2fne h ASP 2044Ca -0.37 -0.23 -0.54 0.00 -0.73 0.00 0.00 57.03 55.16 2fne h ASP 2044Cb 1.22 -0.15 0.12 0.00 -0.83 0.00 0.00 39.33 39.69 2fne h ASP 2044CO 0.61 0.86 0.64 -0.70 -1.03 0.00 0.00 179.24 179.63 2fne s GLU 2045N -4.28 3.51 -0.05 4.15 2.12 -1.26 -5.04 118.70 117.85 2fne s GLU 2045Ca -0.07 2.27 0.01 0.00 0.36 0.00 0.00 54.97 57.55 2fne s GLU 2045Cb 0.13 -2.50 0.02 0.00 0.26 0.00 0.00 34.13 32.04 2fne s GLU 2045CO 0.81 -0.91 -0.06 0.99 -0.54 0.00 0.00 175.26 175.55 2fne s THR 2046N -1.27 0.66 0.20 -1.70 2.01 -1.26 -5.09 115.64 109.19 2fne s THR 2046Ca 0.65 -0.20 -0.30 0.00 0.31 0.00 0.00 61.69 62.15 2fne s THR 2046Cb -0.41 -0.66 -0.08 0.00 0.01 0.00 0.00 72.50 71.36 2fne s THR 2046CO 0.51 0.25 1.09 -0.44 -0.69 0.00 0.00 174.62 175.33 2fne s SER 2047N 0.85 7.30 0.00 3.53 0.01 -1.26 -5.18 113.70 118.94 2fne s SER 2047Ca -0.12 2.11 0.00 0.00 1.31 0.00 0.00 55.95 59.25 2fne s SER 2047Cb -0.15 -2.61 0.00 0.00 0.21 0.00 0.00 66.02 63.47 2fne s SER 2047CO 0.01 -0.17 0.14 1.33 0.41 0.00 0.00 173.24 174.95