#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2dcl s GLU 3 N 0.00 1.97 0.22 7.34 2.02 -1.26 -5.13 118.70 123.86 2dcl s GLU 3 Ca 0.00 -1.01 -0.00 0.00 0.02 0.00 0.00 54.97 53.97 2dcl s GLU 3 Cb 0.00 -2.04 -0.04 0.00 0.10 0.00 0.00 34.13 32.15 2dcl s GLU 3 CO 0.00 0.54 0.13 0.14 0.02 0.00 0.00 175.26 176.08 2dcl s VAL 4 N -0.74 0.13 -0.16 2.63 -7.23 -1.26 -4.91 120.40 108.85 2dcl s VAL 4 Ca 0.11 -2.00 -0.15 0.00 -1.81 0.00 0.00 61.98 58.14 2dcl s VAL 4 Cb -0.10 -2.53 -0.23 0.00 0.56 0.00 0.00 36.38 34.08 2dcl s VAL 4 CO 0.01 0.00 0.30 -0.33 -0.31 0.00 0.00 175.10 174.77 2dcl h GLU 5 N 2.54 0.13 -2.15 4.82 4.39 -1.00 -3.48 114.58 119.83 2dcl h GLU 5 Ca -0.36 -0.23 -0.06 0.00 0.34 0.00 0.00 59.36 59.06 2dcl h GLU 5 Cb 1.25 0.08 -0.21 0.00 -0.10 0.00 0.00 28.75 29.77 2dcl h GLU 5 CO 0.54 1.11 0.06 -1.01 -1.16 0.00 0.00 179.01 178.55 2dcl s HIS 6 N -2.46 -0.71 -0.40 4.33 3.76 -0.91 -5.02 115.29 113.88 2dcl s HIS 6 Ca -0.25 1.71 0.10 0.00 -0.15 0.00 0.00 55.06 56.47 2dcl s HIS 6 Cb 0.06 0.25 0.26 0.00 1.11 0.00 0.00 32.58 34.26 2dcl s HIS 6 CO 0.68 -0.36 1.20 -2.67 -0.85 0.00 0.00 174.74 172.74 2dcl n TRP 7 N 2.62 0.36 -0.08 1.40 4.27 -1.26 -1.56 117.44 123.18 2dcl n TRP 7 Ca -0.14 -0.64 0.01 0.00 -3.89 0.00 0.00 57.50 52.84 2dcl n TRP 7 Cb 0.56 -0.11 0.03 0.00 -1.36 0.00 0.00 31.31 30.43 2dcl n TRP 7 CO 0.00 0.00 0.00 0.27 -2.29 0.00 0.00 177.69 175.67 2dcl n ASN 8 N -0.25 2.17 -4.88 -0.67 6.94 -1.26 -4.92 115.26 112.38 2dcl n ASN 8 Ca 0.11 -2.06 -0.30 0.00 -0.02 0.00 0.00 54.58 52.31 2dcl n ASN 8 Cb 0.50 -0.06 0.01 0.00 -2.36 0.00 0.00 39.78 37.87 2dcl n ASN 8 CO 0.00 0.00 0.00 0.42 -1.03 0.00 0.00 177.26 176.65 2dcl s THR 9 N -1.10 4.55 0.08 5.53 -4.23 -1.25 -3.79 115.64 115.43 2dcl s THR 9 Ca 0.05 0.59 0.03 0.00 -1.18 0.00 0.00 61.69 61.18 2dcl s THR 9 Cb 0.03 -3.79 -0.03 0.00 1.34 0.00 0.00 72.50 70.05 2dcl s THR 9 CO 0.03 -0.96 -0.10 -0.76 -0.54 0.00 0.00 174.62 172.28 2dcl s LEU 10 N -5.07 2.35 -0.27 4.79 1.43 -0.63 -2.58 118.68 118.69 2dcl s LEU 10 Ca 0.53 -0.71 -0.08 0.00 -1.03 0.00 0.00 54.13 52.84 2dcl s LEU 10 Cb -0.11 -0.30 -0.02 0.00 0.03 0.00 0.00 46.19 45.79 2dcl s LEU 10 CO 0.51 -0.22 0.10 -0.60 0.23 0.00 0.00 176.35 176.36 2dcl s ARG 11 N -2.31 3.52 -0.19 1.70 3.52 -0.05 -2.04 118.95 123.10 2dcl s ARG 11 Ca 0.00 -0.58 -0.10 0.00 -0.13 0.00 0.00 55.73 54.93 2dcl s ARG 11 Cb -0.06 -3.41 -0.05 0.00 -1.56 0.00 0.00 34.95 29.88 2dcl s ARG 11 CO 0.00 -0.28 0.13 -1.17 -0.81 0.00 0.00 175.30 173.18 2dcl s LEU 12 N 1.61 4.23 -0.15 -0.88 2.96 0.40 -2.67 118.68 124.18 2dcl s LEU 12 Ca 0.06 0.26 0.00 0.00 -0.22 0.00 0.00 54.13 54.23 2dcl s LEU 12 Cb -0.16 -2.09 0.03 0.00 0.50 0.00 0.00 46.19 44.47 2dcl s LEU 12 CO 0.04 0.21 -0.10 -0.13 -1.32 0.00 0.00 176.35 175.05 2dcl s ARG 13 N 0.19 1.88 -0.33 1.98 0.52 0.22 -0.47 118.95 122.94 2dcl s ARG 13 Ca 0.09 -0.48 -0.08 0.00 -0.52 0.00 0.00 55.73 54.73 2dcl s ARG 13 Cb -0.11 -1.95 0.02 0.00 0.52 0.00 0.00 34.95 33.42 2dcl s ARG 13 CO -0.01 -0.30 0.13 0.42 0.02 0.00 0.00 175.30 175.56 2dcl s ILE 14 N 1.57 4.23 -0.33 1.52 1.01 0.08 -0.85 121.20 128.44 2dcl s ILE 14 Ca 0.04 -0.75 -0.12 0.00 0.00 0.00 0.00 60.65 59.81 2dcl s ILE 14 Cb -0.13 -3.26 -0.02 0.00 0.01 0.00 0.00 42.46 39.05 2dcl s ILE 14 CO -0.09 -0.05 0.22 -0.31 0.00 0.00 0.00 174.94 174.71 2dcl s TYR 15 N 1.52 3.22 0.00 3.97 1.51 0.37 -0.81 117.35 127.13 2dcl s TYR 15 Ca 0.02 -0.21 0.00 0.00 -1.01 0.00 0.00 57.07 55.87 2dcl s TYR 15 Cb -0.18 -2.44 0.00 0.00 -0.11 0.00 0.00 41.96 39.23 2dcl s TYR 15 CO 0.04 -0.34 0.00 0.44 -1.11 0.00 0.00 175.55 174.58 2dcl n ILE 16 N 5.08 0.00 -4.77 2.71 -5.35 0.76 -1.99 119.36 115.80 2dcl n ILE 16 Ca -0.13 0.00 -0.33 0.00 -0.27 0.00 0.00 62.75 62.02 2dcl n ILE 16 Cb 0.50 0.00 -0.14 0.00 -1.74 0.00 0.00 39.64 38.26 2dcl n ILE 16 CO 0.00 0.00 0.00 -0.83 -1.76 0.00 0.00 176.55 173.96 2dcl s GLY 17 N -0.57 1.56 0.45 3.28 0.00 -1.26 -1.46 107.32 109.32 2dcl s GLY 17 Ca 0.00 -0.91 0.25 0.00 0.00 0.00 0.00 44.72 44.06 2dcl s GLY 17 CO 0.00 -0.36 1.78 -2.09 0.00 0.00 0.00 173.10 172.43 2dcl h GLU 18 N 6.26 0.23 -0.00 2.90 4.81 -0.62 0.30 114.58 128.46 2dcl h GLU 18 Ca -0.33 -0.01 0.00 0.00 -0.13 0.00 0.00 59.36 58.89 2dcl h GLU 18 Cb 1.19 -0.05 0.00 0.00 0.63 0.00 0.00 28.75 30.52 2dcl h GLU 18 CO 0.55 0.16 -0.41 0.09 -0.73 0.00 0.00 179.01 178.66 2dcl n ASN 19 N -4.48 0.69 -4.75 1.04 3.02 -1.26 -4.84 115.26 104.68 2dcl n ASN 19 Ca 0.26 -0.48 -0.42 0.00 -0.03 0.00 0.00 54.58 53.91 2dcl n ASN 19 Cb 1.02 0.21 -0.01 0.00 -0.61 0.00 0.00 39.78 40.39 2dcl n ASN 19 CO 0.00 0.00 0.00 0.47 -2.62 0.00 0.00 177.26 175.11 2dcl n ASP 20 N -1.19 3.80 -4.42 6.41 8.00 0.11 -4.91 116.55 124.34 2dcl n ASP 20 Ca 0.08 1.17 -0.21 0.00 0.71 0.00 0.00 54.79 56.54 2dcl n ASP 20 Cb 0.34 -1.60 -0.10 0.00 -0.02 0.00 0.00 41.12 39.74 2dcl n ASP 20 CO 0.00 0.00 0.00 -0.54 -0.39 0.00 0.00 177.20 176.27 2dcl s LYS 21 N -1.03 1.53 -0.16 -1.24 1.02 -1.26 -0.63 119.74 117.97 2dcl s LYS 21 Ca 0.60 -1.75 -0.04 0.00 0.02 0.00 0.00 55.97 54.80 2dcl s LYS 21 Cb -0.49 -1.20 0.08 0.00 -0.52 0.00 0.00 37.83 35.69 2dcl s LYS 21 CO 0.54 0.09 0.28 -0.46 -0.92 0.00 0.00 175.35 174.87 2dcl s TRP 22 N -2.96 -0.46 -1.39 3.18 -0.11 0.31 -4.62 118.94 112.88 2dcl s TRP 22 Ca 0.28 0.84 0.00 0.00 1.22 0.00 0.00 56.10 58.44 2dcl s TRP 22 Cb 0.02 -0.07 0.00 0.00 -1.50 0.00 0.00 33.47 31.92 2dcl s TRP 22 CO 0.11 -0.46 0.00 0.39 -4.62 0.00 0.00 176.95 172.38 2dcl n GLU 23 N 5.35 -1.69 0.00 5.86 1.02 -1.26 -1.12 120.64 128.80 2dcl n GLU 23 Ca -0.06 0.78 0.00 0.00 -0.02 0.00 0.00 57.16 57.86 2dcl n GLU 23 Cb 0.50 -5.22 0.00 0.00 -0.02 0.00 0.00 31.44 26.70 2dcl n GLU 23 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 2dcl n GLY 24 N -0.56 1.77 3.85 0.62 0.00 -1.26 -5.09 105.19 104.52 2dcl n GLY 24 Ca -0.16 0.00 -0.21 0.00 0.00 0.00 0.00 46.02 45.65 2dcl n GLY 24 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2dcl s ARG 25 N -0.70 2.53 0.02 1.61 0.52 -0.27 -5.05 118.95 117.61 2dcl s ARG 25 Ca 0.00 -1.51 -0.30 0.00 -0.52 0.00 0.00 55.73 53.39 2dcl s ARG 25 Cb 0.00 -2.35 -0.07 0.00 0.52 0.00 0.00 34.95 33.06 2dcl s ARG 25 CO 0.00 -0.10 1.53 -2.14 0.02 0.00 0.00 175.30 174.61 2dcl s PRO 26 N -4.06 4.24 0.44 3.54 0.02 -1.26 0.12 135.00 138.03 2dcl s PRO 26 Ca 0.45 2.14 0.22 0.00 0.02 0.00 0.00 61.00 63.83 2dcl s PRO 26 Cb -0.03 -3.62 1.20 0.00 0.02 0.00 0.00 34.50 32.07 2dcl s PRO 26 CO 0.27 -0.67 1.83 1.25 -0.33 0.00 0.00 177.00 179.35 2dcl h LEU 27 N 8.61 0.32 -0.07 -5.54 5.85 -1.13 -1.03 115.31 122.31 2dcl h LEU 27 Ca -0.40 0.05 -0.25 0.00 0.84 0.00 0.00 57.88 58.12 2dcl h LEU 27 Cb 1.19 -0.01 0.01 0.00 0.37 0.00 0.00 40.66 42.22 2dcl h LEU 27 CO 0.92 0.10 -1.04 0.10 -0.34 0.00 0.00 178.44 178.18 2dcl h TYR 28 N 0.30 0.68 -0.40 1.25 -0.00 -1.89 -2.16 116.97 114.76 2dcl h TYR 28 Ca 0.52 -0.40 -0.08 0.00 0.00 0.00 0.00 58.73 58.77 2dcl h TYR 28 Cb 1.48 -0.07 -0.02 0.00 0.00 0.00 0.00 36.73 38.12 2dcl h TYR 28 CO -0.00 1.24 -0.07 0.87 -0.00 0.00 0.00 178.16 180.19 2dcl h LYS 29 N 0.23 0.68 -0.26 0.10 1.57 -1.62 -1.42 116.57 115.84 2dcl h LYS 29 Ca -0.11 -0.20 -0.11 0.00 -1.87 0.00 0.00 60.65 58.37 2dcl h LYS 29 Cb 1.69 -0.07 -0.00 0.00 0.08 0.00 0.00 32.23 33.93 2dcl h LYS 29 CO 0.18 0.74 -0.26 -0.24 -0.57 0.00 0.00 179.45 179.30 2dcl h VAL 30 N 0.62 1.31 0.18 0.50 3.04 -1.28 -2.26 116.25 118.36 2dcl h VAL 30 Ca 0.12 -1.43 -0.01 0.00 -1.01 0.00 0.00 66.70 64.37 2dcl h VAL 30 Cb 0.50 1.64 0.00 0.00 -2.01 0.00 0.00 31.29 31.42 2dcl h VAL 30 CO 0.03 0.45 -0.09 0.40 -1.01 0.00 0.00 177.57 177.35 2dcl h ILE 31 N 0.36 0.84 -0.92 3.17 2.04 -1.21 -1.34 117.51 120.45 2dcl h ILE 31 Ca 0.04 -0.06 0.10 0.00 1.00 0.00 0.00 64.86 65.94 2dcl h ILE 31 Cb 0.83 0.87 -0.07 0.00 -0.74 0.00 0.00 36.82 37.71 2dcl h ILE 31 CO 0.07 0.01 0.59 0.58 0.00 0.00 0.00 178.15 179.40 2dcl h VAL 32 N -0.27 0.97 0.23 1.67 2.07 -1.28 0.11 116.25 119.74 2dcl h VAL 32 Ca -0.02 -0.32 -0.01 0.00 0.82 0.00 0.00 66.70 67.17 2dcl h VAL 32 Cb 0.21 -0.03 -0.00 0.00 -1.52 0.00 0.00 31.29 29.94 2dcl h VAL 32 CO 0.04 0.17 -0.14 -0.08 0.02 0.00 0.00 177.57 177.58 2dcl h GLU 33 N 0.92 -0.34 0.12 1.57 4.81 -1.02 -0.83 114.58 119.81 2dcl h GLU 33 Ca 0.43 0.02 0.01 0.00 -0.13 0.00 0.00 59.36 59.69 2dcl h GLU 33 Cb 0.40 0.08 -0.04 0.00 0.63 0.00 0.00 28.75 29.82 2dcl h GLU 33 CO -0.19 -0.22 -0.44 0.87 -0.73 0.00 0.00 179.01 178.29 2dcl h LYS 34 N -0.35 -0.62 -1.17 1.92 1.79 -0.03 -1.03 116.57 117.08 2dcl h LYS 34 Ca -0.02 0.04 0.34 0.00 -2.18 0.00 0.00 60.65 58.83 2dcl h LYS 34 Cb 0.29 0.14 -0.11 0.00 -1.58 0.00 0.00 32.23 30.98 2dcl h LYS 34 CO 0.02 -0.41 0.76 -0.07 -1.08 0.00 0.00 179.45 178.67 2dcl h LEU 35 N -0.64 0.34 -0.21 2.94 3.38 -0.68 0.57 115.31 121.00 2dcl h LEU 35 Ca -0.01 0.10 -0.13 0.00 0.09 0.00 0.00 57.88 57.93 2dcl h LEU 35 Cb 0.64 0.06 -0.02 0.00 0.09 0.00 0.00 40.66 41.43 2dcl h LEU 35 CO -0.23 -0.03 -0.64 -0.09 0.09 0.00 0.00 178.44 177.54 2dcl h ARG 36 N 0.24 0.00 0.00 1.13 2.43 -0.17 -1.89 114.38 116.13 2dcl h ARG 36 Ca 0.69 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.86 2dcl h ARG 36 Cb 1.99 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 31.54 2dcl h ARG 36 CO -0.33 0.64 -0.80 0.39 -1.51 0.00 0.00 179.97 178.36 2dcl n GLU 37 N -3.35 0.32 0.00 0.20 1.02 0.18 -3.50 120.64 115.51 2dcl n GLU 37 Ca 0.01 0.06 0.14 0.00 -0.02 0.00 0.00 57.16 57.34 2dcl n GLU 37 Cb 0.75 -1.67 0.48 0.00 -0.02 0.00 0.00 31.44 30.99 2dcl n GLU 37 CO 0.00 0.00 0.00 -1.33 1.18 0.00 0.00 177.13 176.98 2dcl n MET 38 N -2.11 1.27 -2.31 3.49 2.81 0.14 -4.95 117.12 115.46 2dcl n MET 38 Ca 0.02 -0.72 -0.06 0.00 -1.81 0.00 0.00 57.70 55.14 2dcl n MET 38 Cb 0.45 -1.49 0.00 0.00 -0.71 0.00 0.00 33.22 31.48 2dcl n MET 38 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 2dcl n GLY 39 N 1.24 0.26 3.78 3.03 0.00 -1.20 -5.03 105.19 107.28 2dcl n GLY 39 Ca 0.16 -0.58 -0.36 0.00 0.00 0.00 0.00 46.02 45.24 2dcl n GLY 39 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2dcl s ILE 40 N -2.52 3.27 0.24 -0.61 1.09 -0.71 -4.94 121.20 117.02 2dcl s ILE 40 Ca 0.05 0.87 -0.10 0.00 -1.10 0.00 0.00 60.65 60.37 2dcl s ILE 40 Cb -0.02 -3.40 0.33 0.00 -1.06 0.00 0.00 42.46 38.31 2dcl s ILE 40 CO 0.06 -0.09 1.60 0.00 -0.10 0.00 0.00 174.94 176.41 2dcl h ALA 41 N 1.70 0.58 0.00 9.38 0.00 -1.89 -3.47 119.26 125.56 2dcl h ALA 41 Ca -0.50 0.30 0.00 0.00 0.00 0.00 0.00 54.91 54.71 2dcl h ALA 41 Cb 1.25 0.57 0.00 0.00 0.00 0.00 0.00 17.79 19.61 2dcl h ALA 41 CO 0.59 -0.42 0.00 0.41 0.00 0.00 0.00 179.25 179.83 2dcl n GLY 42 N -1.50 -1.53 3.43 0.00 0.00 -1.26 -5.10 105.19 99.23 2dcl n GLY 42 Ca 0.12 -1.05 -0.15 0.00 0.00 0.00 0.00 46.02 44.94 2dcl n GLY 42 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2dcl s ALA 43 N -1.72 -1.51 -0.05 4.61 0.00 -1.26 -4.30 121.76 117.53 2dcl s ALA 43 Ca 0.00 0.81 0.00 0.00 0.00 0.00 0.00 51.96 52.77 2dcl s ALA 43 Cb 0.00 0.34 0.03 0.00 0.00 0.00 0.00 23.12 23.48 2dcl s ALA 43 CO 0.00 -0.50 -0.01 0.99 0.00 0.00 0.00 175.76 176.23 2dcl s THR 44 N -2.23 0.36 -0.13 0.00 2.01 0.00 -4.96 115.64 110.70 2dcl s THR 44 Ca -0.06 0.03 -0.03 0.00 0.31 0.00 0.00 61.69 61.93 2dcl s THR 44 Cb -0.01 -0.46 -0.03 0.00 0.01 0.00 0.00 72.50 72.02 2dcl s THR 44 CO 0.00 0.21 -0.02 -0.69 -0.69 0.00 0.00 174.62 173.44 2dcl s VAL 45 N 1.30 4.10 0.22 3.82 1.01 -1.26 0.24 120.40 129.83 2dcl s VAL 45 Ca -0.05 -0.30 0.11 0.00 0.00 0.00 0.00 61.98 61.74 2dcl s VAL 45 Cb -0.13 -2.77 -0.05 0.00 0.00 0.00 0.00 36.38 33.43 2dcl s VAL 45 CO -0.02 0.53 -0.22 -0.31 0.00 0.00 0.00 175.10 175.08 2dcl s TYR 46 N -0.14 2.32 -0.18 5.22 1.51 0.40 -4.97 117.35 121.50 2dcl s TYR 46 Ca 0.04 -0.34 -0.01 0.00 -1.01 0.00 0.00 57.07 55.75 2dcl s TYR 46 Cb -0.13 -1.10 0.05 0.00 -0.11 0.00 0.00 41.96 40.67 2dcl s TYR 46 CO 0.02 0.57 -0.04 0.50 -1.11 0.00 0.00 175.55 175.49 2dcl s ARG 47 N -2.93 1.38 1.10 -0.62 3.52 -1.26 -0.96 118.95 119.18 2dcl s ARG 47 Ca 0.24 -0.60 -0.17 0.00 -0.13 0.00 0.00 55.73 55.07 2dcl s ARG 47 Cb -0.07 -2.13 0.24 0.00 -1.56 0.00 0.00 34.95 31.44 2dcl s ARG 47 CO 0.12 -0.49 1.16 0.20 -0.81 0.00 0.00 175.30 175.48 2dcl s GLY 48 N 1.61 1.62 -0.03 8.12 0.00 -0.56 -4.97 107.32 113.11 2dcl s GLY 48 Ca -0.01 -0.92 0.21 0.00 0.00 0.00 0.00 44.72 44.00 2dcl s GLY 48 CO -0.07 -0.11 0.49 0.29 0.00 0.00 0.00 173.10 173.69 2dcl n ILE 49 N -4.39 0.49 -3.52 0.90 -5.35 -1.26 -4.49 119.36 101.74 2dcl n ILE 49 Ca 0.12 -0.60 -0.16 0.00 -0.27 0.00 0.00 62.75 61.84 2dcl n ILE 49 Cb 0.59 -0.21 -0.05 0.00 -1.74 0.00 0.00 39.64 38.22 2dcl n ILE 49 CO 0.00 0.00 0.00 -0.47 -1.76 0.00 0.00 176.55 174.32 2dcl s TYR 50 N -3.22 -0.59 0.00 4.28 5.04 -1.26 -4.93 117.35 116.67 2dcl s TYR 50 Ca -0.07 0.95 -0.28 0.00 -2.44 0.00 0.00 57.07 55.24 2dcl s TYR 50 Cb 0.11 0.43 0.09 0.00 0.35 0.00 0.00 41.96 42.95 2dcl s TYR 50 CO 0.87 -0.57 0.80 0.20 -1.34 0.00 0.00 175.55 175.50 2dcl s GLY 51 N -1.31 -0.49 -0.15 8.97 0.00 -1.26 -4.81 107.32 108.26 2dcl s GLY 51 Ca -0.08 1.10 -0.10 0.00 0.00 0.00 0.00 44.72 45.64 2dcl s GLY 51 CO 0.06 0.51 0.38 -0.11 0.00 0.00 0.00 173.10 173.95 2dcl s PHE 52 N -2.62 -0.51 0.00 1.90 -0.12 -1.26 -4.92 117.98 110.46 2dcl s PHE 52 Ca 0.00 1.14 0.00 0.00 -0.05 0.00 0.00 56.93 58.02 2dcl s PHE 52 Cb -0.01 0.20 0.00 0.00 -0.63 0.00 0.00 43.02 42.58 2dcl s PHE 52 CO -0.05 -0.28 0.00 0.41 -0.05 0.00 0.00 175.22 175.25 2dcl n GLY 53 N 3.77 0.00 0.00 1.99 0.00 -1.26 -5.22 105.19 104.47 2dcl n GLY 53 Ca -0.20 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.82 2dcl n GLY 53 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 2dcl n THR 68 N -0.98 0.00 -2.39 2.61 -1.04 -1.26 -5.20 114.28 106.03 2dcl n THR 68 Ca 0.00 0.00 -0.42 0.00 -2.04 0.00 0.00 64.05 61.59 2dcl n THR 68 Cb 0.12 0.00 -0.03 0.00 -1.82 0.00 0.00 70.33 68.61 2dcl n THR 68 CO 0.00 0.00 0.00 -0.62 -0.64 0.00 0.00 175.07 173.81 2dcl s ASP 69 N 0.00 7.01 -0.16 8.00 -1.08 -1.26 -5.03 116.67 124.14 2dcl s ASP 69 Ca 0.00 1.95 -0.12 0.00 -0.52 0.00 0.00 52.55 53.86 2dcl s ASP 69 Cb 0.00 -2.57 -0.05 0.00 -1.46 0.00 0.00 42.92 38.85 2dcl s ASP 69 CO 0.00 -0.58 0.25 -0.76 0.52 0.00 0.00 175.17 174.59 2dcl s LEU 70 N 1.90 4.25 0.32 -1.34 1.43 -1.26 -4.65 118.68 119.34 2dcl s LEU 70 Ca 0.59 0.46 -0.29 0.00 -1.03 0.00 0.00 54.13 53.85 2dcl s LEU 70 Cb -0.28 -2.29 -0.11 0.00 0.03 0.00 0.00 46.19 43.54 2dcl s LEU 70 CO 0.25 0.15 1.42 -2.16 0.23 0.00 0.00 176.35 176.24 2dcl s PRO 71 N 0.27 4.24 -0.10 1.29 0.04 -1.26 0.12 135.00 139.60 2dcl s PRO 71 Ca 0.15 2.37 0.03 0.00 0.04 0.00 0.00 61.00 63.58 2dcl s PRO 71 Cb -0.13 -3.05 0.01 0.00 0.04 0.00 0.00 34.50 31.38 2dcl s PRO 71 CO 0.03 -0.38 -0.18 0.42 0.04 0.00 0.00 177.00 176.92 2dcl s ILE 72 N -0.75 1.68 -0.20 0.56 -1.09 -0.54 -1.50 121.20 119.36 2dcl s ILE 72 Ca 0.54 -0.78 0.01 0.00 -2.23 0.00 0.00 60.65 58.20 2dcl s ILE 72 Cb -0.43 -1.49 0.04 0.00 -1.58 0.00 0.00 42.46 38.99 2dcl s ILE 72 CO 0.53 0.48 -0.15 -0.63 -1.23 0.00 0.00 174.94 173.93 2dcl s ILE 73 N 0.68 1.97 -0.19 2.92 1.09 -0.13 -0.17 121.20 127.37 2dcl s ILE 73 Ca -0.12 -1.12 -0.12 0.00 -1.10 0.00 0.00 60.65 58.19 2dcl s ILE 73 Cb -0.16 -1.91 -0.05 0.00 -1.06 0.00 0.00 42.46 39.28 2dcl s ILE 73 CO 0.03 0.31 0.20 -0.69 -0.10 0.00 0.00 174.94 174.68 2dcl s VAL 74 N 1.28 5.36 -0.06 2.92 1.01 0.01 -0.45 120.40 130.46 2dcl s VAL 74 Ca 0.00 0.32 0.03 0.00 0.00 0.00 0.00 61.98 62.33 2dcl s VAL 74 Cb -0.15 -3.54 -0.02 0.00 0.00 0.00 0.00 36.38 32.66 2dcl s VAL 74 CO -0.10 0.40 -0.14 -0.70 0.00 0.00 0.00 175.10 174.56 2dcl s GLU 75 N 0.55 2.65 -0.03 2.72 2.12 0.14 -0.74 118.70 126.10 2dcl s GLU 75 Ca 0.11 -0.69 -0.00 0.00 0.36 0.00 0.00 54.97 54.75 2dcl s GLU 75 Cb -0.12 -2.42 0.03 0.00 0.26 0.00 0.00 34.13 31.87 2dcl s GLU 75 CO 0.01 0.56 0.01 0.08 -0.54 0.00 0.00 175.26 175.39 2dcl s VAL 76 N -0.56 0.11 -0.17 3.70 1.01 0.38 -0.82 120.40 124.06 2dcl s VAL 76 Ca 0.08 0.16 -0.01 0.00 0.00 0.00 0.00 61.98 62.21 2dcl s VAL 76 Cb -0.11 -0.24 -0.00 0.00 0.00 0.00 0.00 36.38 36.02 2dcl s VAL 76 CO 0.01 0.15 -0.13 -0.69 0.00 0.00 0.00 175.10 174.44 2dcl s VAL 77 N 1.24 2.80 0.11 2.92 1.01 -1.26 0.15 120.40 127.37 2dcl s VAL 77 Ca -0.07 -0.72 -0.22 0.00 0.00 0.00 0.00 61.98 60.97 2dcl s VAL 77 Cb -0.13 -2.20 0.08 0.00 0.00 0.00 0.00 36.38 34.12 2dcl s VAL 77 CO -0.02 0.50 1.05 -0.67 0.00 0.00 0.00 175.10 175.95 2dcl n ASP 78 N 4.18 -1.46 -4.72 3.32 -0.08 -0.86 -4.48 116.55 112.45 2dcl n ASP 78 Ca -0.19 -1.65 -0.43 0.00 -1.51 0.00 0.00 54.79 51.02 2dcl n ASP 78 Cb 0.51 2.34 -0.01 0.00 2.34 0.00 0.00 41.12 46.31 2dcl n ASP 78 CO 0.00 0.00 0.00 0.54 0.12 0.00 0.00 177.20 177.86 2dcl n ARG 79 N -0.74 2.40 0.01 -0.67 1.74 -1.26 -1.60 116.66 116.54 2dcl n ARG 79 Ca 0.00 0.85 0.01 0.00 -0.77 0.00 0.00 57.85 57.94 2dcl n ARG 79 Cb 0.55 -2.55 0.04 0.00 -1.02 0.00 0.00 32.46 29.47 2dcl n ARG 79 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 2dcl n GLY 80 N 1.64 -0.47 0.11 -0.13 0.00 -1.25 -0.22 105.19 104.88 2dcl n GLY 80 Ca 0.08 0.01 0.12 0.00 0.00 0.00 0.00 46.02 46.23 2dcl n GLY 80 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 173.32 173.77 2dcl h HIS 81 N 0.00 0.00 0.07 1.61 3.86 -1.91 -2.77 115.15 116.01 2dcl h HIS 81 Ca 0.00 0.00 -0.37 0.00 -1.16 0.00 0.00 60.37 58.84 2dcl h HIS 81 Cb 0.12 0.00 -0.04 0.00 1.06 0.00 0.00 27.41 28.55 2dcl h HIS 81 CO 0.00 0.00 -2.17 0.09 0.86 0.00 0.00 177.93 176.71 2dcl n ASN 82 N -2.52 2.06 -0.21 2.45 4.13 0.70 -3.67 115.26 118.20 2dcl n ASN 82 Ca 0.02 0.09 0.01 0.00 1.68 0.00 0.00 54.58 56.37 2dcl n ASN 82 Cb 0.51 -0.69 0.12 0.00 -1.54 0.00 0.00 39.78 38.17 2dcl n ASN 82 CO 0.00 0.00 0.00 0.40 0.28 0.00 0.00 177.26 177.94 2dcl h ILE 83 N -0.01 0.70 -0.28 2.41 5.03 -1.42 0.27 117.51 124.22 2dcl h ILE 83 Ca -0.49 -0.12 -0.11 0.00 -0.12 0.00 0.00 64.86 64.03 2dcl h ILE 83 Cb 1.95 0.33 -0.01 0.00 -3.03 0.00 0.00 36.82 36.06 2dcl h ILE 83 CO 0.00 0.06 -0.28 -0.33 -0.68 0.00 0.00 178.15 176.93 2dcl h GLU 84 N 0.35 0.56 -0.82 2.37 3.07 -1.67 0.22 114.58 118.66 2dcl h GLU 84 Ca 0.32 -0.23 -0.01 0.00 -0.50 0.00 0.00 59.36 58.95 2dcl h GLU 84 Cb 0.44 -0.02 -0.04 0.00 -0.84 0.00 0.00 28.75 28.29 2dcl h GLU 84 CO -0.36 0.78 0.49 -0.22 -1.40 0.00 0.00 179.01 178.31 2dcl h LYS 85 N 0.48 1.11 -0.35 2.33 3.64 -1.11 -1.98 116.57 120.70 2dcl h LYS 85 Ca 0.06 -0.10 -0.17 0.00 -1.27 0.00 0.00 60.65 59.17 2dcl h LYS 85 Cb 0.73 -0.23 -0.00 0.00 -0.41 0.00 0.00 32.23 32.32 2dcl h LYS 85 CO 0.06 0.78 -0.45 0.28 -2.27 0.00 0.00 179.45 177.85 2dcl h VAL 86 N 1.13 1.27 -0.02 2.00 2.07 0.33 -3.18 116.25 119.85 2dcl h VAL 86 Ca 0.29 -1.63 0.01 0.00 0.82 0.00 0.00 66.70 66.20 2dcl h VAL 86 Cb -0.04 1.48 -0.02 0.00 -1.52 0.00 0.00 31.29 31.19 2dcl h VAL 86 CO -0.05 0.54 -0.06 0.58 0.02 0.00 0.00 177.57 178.60 2dcl h VAL 87 N 0.73 0.84 -0.11 2.57 2.07 -0.02 -2.74 116.25 119.58 2dcl h VAL 87 Ca 0.04 0.00 0.04 0.00 0.82 0.00 0.00 66.70 67.61 2dcl h VAL 87 Cb 1.05 0.84 -0.06 0.00 -1.52 0.00 0.00 31.29 31.60 2dcl h VAL 87 CO 0.11 0.00 -0.32 0.78 0.02 0.00 0.00 177.57 178.16 2dcl h ASN 88 N -0.09 -0.99 0.24 0.57 2.35 -1.42 0.11 115.58 116.34 2dcl h ASN 88 Ca 0.03 0.14 0.00 0.00 -0.55 0.00 0.00 56.30 55.92 2dcl h ASN 88 Cb 0.13 0.42 0.00 0.00 0.05 0.00 0.00 38.32 38.92 2dcl h ASN 88 CO -0.07 -0.36 0.00 1.33 -1.65 0.00 0.00 177.43 176.67 2dcl n VAL 89 N -5.41 1.37 -0.01 2.81 0.24 -1.16 -3.20 118.33 112.98 2dcl n VAL 89 Ca -0.03 0.34 0.00 0.00 -2.04 0.00 0.00 64.34 62.61 2dcl n VAL 89 Cb 0.33 -1.21 -0.02 0.00 -1.47 0.00 0.00 33.84 31.46 2dcl n VAL 89 CO 0.00 0.00 0.00 -0.38 -2.14 0.00 0.00 176.83 174.31 2dcl n ILE 90 N -1.46 0.09 -0.34 1.34 5.41 -0.75 -4.67 119.36 118.97 2dcl n ILE 90 Ca 0.02 -0.10 0.22 0.00 1.00 0.00 0.00 62.75 63.89 2dcl n ILE 90 Cb 0.08 -0.18 0.46 0.00 -0.71 0.00 0.00 39.64 39.30 2dcl n ILE 90 CO 0.00 0.00 0.00 0.11 0.00 0.00 0.00 176.55 176.66 2dcl h LYS 91 N 0.00 0.42 0.05 0.38 1.57 -0.78 -0.80 116.57 117.41 2dcl h LYS 91 Ca -0.04 -0.03 -0.25 0.00 -1.87 0.00 0.00 60.65 58.47 2dcl h LYS 91 Cb 0.61 -0.09 0.01 0.00 0.08 0.00 0.00 32.23 32.84 2dcl h LYS 91 CO 0.00 0.28 -1.07 -1.00 -0.57 0.00 0.00 179.45 177.09 2dcl h PRO 92 N 0.43 0.44 0.00 3.15 0.13 -1.84 -3.28 132.00 131.02 2dcl h PRO 92 Ca 0.67 -0.54 -0.03 0.00 -0.87 0.00 0.00 66.00 65.23 2dcl h PRO 92 Cb 1.51 0.17 -0.00 0.00 0.13 0.00 0.00 31.00 32.81 2dcl h PRO 92 CO -0.46 1.19 -0.15 0.52 -0.23 0.00 0.00 178.00 178.88 2dcl h MET 93 N 0.22 0.00 -4.38 0.86 2.86 -1.44 -3.35 114.93 109.70 2dcl h MET 93 Ca -0.11 0.00 -0.75 0.00 -2.06 0.00 0.00 59.70 56.77 2dcl h MET 93 Cb 1.73 0.00 -0.20 0.00 0.06 0.00 0.00 31.60 33.19 2dcl h MET 93 CO 0.19 0.15 1.23 -0.89 1.06 0.00 0.00 176.91 178.64 2dcl n ILE 94 N -3.76 4.35 -0.16 -1.22 5.41 -0.89 -4.84 119.36 118.26 2dcl n ILE 94 Ca -0.02 -4.86 0.11 0.00 1.00 0.00 0.00 62.75 58.98 2dcl n ILE 94 Cb 0.26 -2.47 0.44 0.00 -0.71 0.00 0.00 39.64 37.15 2dcl n ILE 94 CO 0.00 0.00 0.00 0.11 0.00 0.00 0.00 176.55 176.66 2dcl h LYS 95 N 6.88 0.54 -2.06 0.38 1.57 -1.84 -3.41 116.57 118.64 2dcl h LYS 95 Ca 0.30 -0.03 0.01 0.00 -1.87 0.00 0.00 60.65 59.05 2dcl h LYS 95 Cb 0.85 -0.12 -0.21 0.00 0.08 0.00 0.00 32.23 32.82 2dcl h LYS 95 CO 1.23 0.36 -0.02 0.34 -0.57 0.00 0.00 179.45 180.79 2dcl s ASP 96 N -6.08 -0.92 0.00 0.86 3.68 -1.26 -5.12 116.67 107.83 2dcl s ASP 96 Ca -0.09 1.47 0.00 0.00 2.13 0.00 0.00 52.55 56.06 2dcl s ASP 96 Cb 0.20 1.40 0.00 0.00 -1.45 0.00 0.00 42.92 43.07 2dcl s ASP 96 CO 0.77 -0.23 0.00 0.61 0.13 0.00 0.00 175.17 176.44 2dcl n GLY 97 N 4.40 -0.57 3.60 2.66 0.00 -1.26 -4.82 105.19 109.20 2dcl n GLY 97 Ca -0.20 -0.30 -0.13 0.00 0.00 0.00 0.00 46.02 45.39 2dcl n GLY 97 CO 0.00 0.00 0.00 -0.29 0.00 0.00 0.00 173.32 173.03 2dcl s MET 98 N -1.40 0.76 -0.04 1.61 1.75 -0.84 -5.03 119.30 116.12 2dcl s MET 98 Ca 0.00 0.56 0.05 0.00 -1.25 0.00 0.00 55.69 55.05 2dcl s MET 98 Cb 0.00 0.37 -0.01 0.00 2.84 0.00 0.00 34.83 38.03 2dcl s MET 98 CO 0.00 -0.16 -0.17 0.42 -0.65 0.00 0.00 175.02 174.46 2dcl s ILE 99 N -0.31 1.42 0.08 10.11 1.01 -1.26 -0.48 121.20 131.78 2dcl s ILE 99 Ca -0.02 -0.73 0.02 0.00 0.00 0.00 0.00 60.65 59.92 2dcl s ILE 99 Cb -0.03 -1.21 -0.04 0.00 0.01 0.00 0.00 42.46 41.19 2dcl s ILE 99 CO 0.01 0.41 -0.07 -0.89 0.00 0.00 0.00 174.94 174.40 2dcl s THR 100 N -0.06 0.67 -0.16 2.92 2.01 -0.03 -4.99 115.64 116.00 2dcl s THR 100 Ca -0.01 -1.72 -0.20 0.00 0.31 0.00 0.00 61.69 60.07 2dcl s THR 100 Cb -0.10 -1.41 0.05 0.00 0.01 0.00 0.00 72.50 71.04 2dcl s THR 100 CO 0.02 -0.74 0.53 0.54 -0.69 0.00 0.00 174.62 174.27 2dcl s VAL 101 N -3.04 0.01 0.04 3.82 0.11 -1.26 -0.61 120.40 119.47 2dcl s VAL 101 Ca 0.06 -0.06 -0.27 0.00 -2.93 0.00 0.00 61.98 58.78 2dcl s VAL 101 Cb 0.01 -0.77 0.08 0.00 -1.53 0.00 0.00 36.38 34.17 2dcl s VAL 101 CO -0.03 -0.03 0.68 -1.83 -3.33 0.00 0.00 175.10 170.55 2dcl s GLU 102 N -0.13 1.11 0.76 1.54 1.03 -1.09 -4.99 118.70 116.93 2dcl s GLU 102 Ca -0.03 -0.11 -0.14 0.00 0.03 0.00 0.00 54.97 54.72 2dcl s GLU 102 Cb -0.03 0.52 0.06 0.00 -0.80 0.00 0.00 34.13 33.87 2dcl s GLU 102 CO 0.03 -0.42 1.21 -2.14 -1.33 0.00 0.00 175.26 172.60 2dcl s PRO 103 N -2.45 1.91 -0.05 -4.83 0.02 -1.26 -0.87 135.00 127.47 2dcl s PRO 103 Ca -0.04 1.77 -0.29 0.00 0.02 0.00 0.00 61.00 62.46 2dcl s PRO 103 Cb -0.01 -1.80 0.09 0.00 0.02 0.00 0.00 34.50 32.80 2dcl s PRO 103 CO -0.02 -2.01 0.80 -0.08 -0.33 0.00 0.00 177.00 175.36 2dcl s THR 104 N -2.04 0.00 -0.18 0.99 -1.32 -1.07 -4.72 115.64 107.30 2dcl s THR 104 Ca 0.74 0.00 -0.05 0.00 -1.21 0.00 0.00 61.69 61.17 2dcl s THR 104 Cb -0.29 -1.00 -0.03 0.00 -1.51 0.00 0.00 72.50 69.67 2dcl s THR 104 CO 0.48 0.00 0.00 -0.63 -2.21 0.00 0.00 174.62 172.26 2dcl s ILE 105 N -1.75 4.13 -0.41 5.08 1.01 -1.26 -3.77 121.20 124.23 2dcl s ILE 105 Ca -0.04 -0.26 -0.21 0.00 0.00 0.00 0.00 60.65 60.14 2dcl s ILE 105 Cb -0.00 -2.85 0.02 0.00 0.01 0.00 0.00 42.46 39.63 2dcl s ILE 105 CO 0.02 0.45 0.65 -0.69 0.00 0.00 0.00 174.94 175.37 2dcl s VAL 106 N 0.68 4.84 -0.17 2.92 1.01 -0.60 -4.92 120.40 124.16 2dcl s VAL 106 Ca 0.00 0.31 0.18 0.00 0.00 0.00 0.00 61.98 62.47 2dcl s VAL 106 Cb -0.14 -4.16 -0.03 0.00 0.00 0.00 0.00 36.38 32.05 2dcl s VAL 106 CO 0.02 -0.49 1.07 -0.07 0.00 0.00 0.00 175.10 175.63 2dcl h LEU 107 N 9.59 0.00 -7.49 3.92 3.38 -1.93 0.46 115.31 123.25 2dcl h LEU 107 Ca -0.26 0.00 0.15 0.00 0.09 0.00 0.00 57.88 57.87 2dcl h LEU 107 Cb 1.10 0.00 -0.10 0.00 0.09 0.00 0.00 40.66 41.75 2dcl h LEU 107 CO 0.87 0.42 0.47 0.86 0.09 0.00 0.00 178.44 181.15 2dcl s TRP 108 N -3.03 -0.20 0.00 1.13 -0.00 -1.26 -3.70 118.94 111.88 2dcl s TRP 108 Ca -0.00 -0.07 0.00 0.00 -0.00 0.00 0.00 56.10 56.03 2dcl s TRP 108 Cb 0.08 0.61 0.00 0.00 -0.00 0.00 0.00 33.47 34.17 2dcl s TRP 108 CO 0.78 -0.77 0.00 0.28 -0.00 0.00 0.00 176.95 177.24 2dcl n VAL 109 N -0.41 0.00 -1.67 5.86 0.31 -1.26 -4.96 118.33 116.20 2dcl n VAL 109 Ca -0.07 0.00 -0.00 0.00 -0.01 0.00 0.00 64.34 64.26 2dcl n VAL 109 Cb 0.61 -0.09 0.00 0.00 -0.91 0.00 0.00 33.84 33.45 2dcl n VAL 109 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 2dcl n GLY 110 N 1.18 -0.57 0.03 2.92 0.00 -1.26 -5.02 105.19 102.47 2dcl n GLY 110 Ca 0.00 -0.04 -0.04 0.00 0.00 0.00 0.00 46.02 45.94 2dcl n GLY 110 CO 0.00 0.00 0.00 -0.37 0.00 0.00 0.00 173.32 172.95 2dcl n THR 111 N -0.81 0.31 -3.91 2.61 5.66 -1.26 -5.00 114.28 111.87 2dcl n THR 111 Ca 0.01 -0.12 -0.23 0.00 -3.05 0.00 0.00 64.05 60.65 2dcl n THR 111 Cb 0.30 -0.71 -0.17 0.00 -1.55 0.00 0.00 70.33 68.20 2dcl n THR 111 CO 0.00 0.00 0.00 -1.10 -3.05 0.00 0.00 175.07 170.92 2dcl s GLN 112 N -2.11 0.95 -0.08 1.09 -0.21 -1.26 -5.14 119.66 112.90 2dcl s GLN 112 Ca -0.07 -0.05 -0.17 0.00 0.02 0.00 0.00 55.36 55.10 2dcl s GLN 112 Cb 0.02 -1.13 -0.05 0.00 1.00 0.00 0.00 33.01 32.85 2dcl s GLN 112 CO 0.13 -0.24 0.44 -1.21 -2.12 0.00 0.00 175.29 172.29 2dcl s GLU 113 N 1.65 4.21 0.00 2.91 2.02 -1.26 -5.14 118.70 123.08 2dcl s GLU 113 Ca 0.01 0.40 0.00 0.00 0.02 0.00 0.00 54.97 55.40 2dcl s GLU 113 Cb -0.13 -3.37 0.00 0.00 0.10 0.00 0.00 34.13 30.74 2dcl s GLU 113 CO -0.05 0.34 0.00 0.39 0.02 0.00 0.00 175.26 175.96