#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2dnu n SER 2 N 0.00 -2.09 -3.63 1.61 7.64 -1.26 -5.05 113.62 110.83 2dnu n SER 2 Ca 0.00 -0.21 -0.06 0.00 1.01 0.00 0.00 58.87 59.61 2dnu n SER 2 Cb 0.00 -1.16 -0.02 0.00 -1.01 0.00 0.00 64.21 62.03 2dnu n SER 2 CO 0.00 0.00 0.00 -0.55 -3.01 0.00 0.00 175.04 171.48 2dnu s SER 3 N -2.24 -0.26 -0.30 6.43 0.15 -1.26 -5.08 113.70 111.14 2dnu s SER 3 Ca 0.65 -0.21 -0.09 0.00 0.70 0.00 0.00 55.95 57.01 2dnu s SER 3 Cb -0.22 0.43 0.01 0.00 -1.71 0.00 0.00 66.02 64.53 2dnu s SER 3 CO 0.66 -0.75 0.34 0.61 1.20 0.00 0.00 173.24 175.29 2dnu n GLY 4 N -0.37 -1.93 3.29 9.45 0.00 -1.26 -5.08 105.19 109.29 2dnu n GLY 4 Ca -0.07 0.77 -0.12 0.00 0.00 0.00 0.00 46.02 46.60 2dnu n GLY 4 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2dnu s SER 5 N -1.97 -0.21 -0.24 1.61 1.04 -1.26 -5.08 113.70 107.59 2dnu s SER 5 Ca 0.14 -0.07 -0.13 0.00 0.48 0.00 0.00 55.95 56.37 2dnu s SER 5 Cb -0.04 0.39 -0.10 0.00 0.10 0.00 0.00 66.02 66.37 2dnu s SER 5 CO 0.59 -0.63 -0.32 -1.54 0.98 0.00 0.00 173.24 172.33 2dnu n SER 6 N 0.60 1.77 -2.34 7.02 3.41 -1.26 -5.11 113.62 117.71 2dnu n SER 6 Ca -0.19 0.31 -0.02 0.00 -0.26 0.00 0.00 58.87 58.71 2dnu n SER 6 Cb 0.59 -0.73 -0.02 0.00 -0.26 0.00 0.00 64.21 63.79 2dnu n SER 6 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2dnu n GLY 7 N 1.45 -5.47 0.47 5.00 0.00 -1.26 -5.03 105.19 100.35 2dnu n GLY 7 Ca -0.46 0.63 -0.16 0.00 0.00 0.00 0.00 46.02 46.03 2dnu n GLY 7 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 2dnu n GLU 8 N 1.66 0.36 -3.98 1.61 1.02 -1.26 -5.01 120.64 115.03 2dnu n GLU 8 Ca -0.14 0.15 -0.23 0.00 -0.02 0.00 0.00 57.16 56.92 2dnu n GLU 8 Cb 0.22 -1.10 -0.17 0.00 -0.02 0.00 0.00 31.44 30.37 2dnu n GLU 8 CO 0.00 0.00 0.00 -1.21 1.18 0.00 0.00 177.13 177.10 2dnu s GLU 9 N -2.37 0.96 -0.30 3.49 2.02 -1.26 -5.09 118.70 116.15 2dnu s GLU 9 Ca -0.23 -0.08 -0.14 0.00 0.02 0.00 0.00 54.97 54.55 2dnu s GLU 9 Cb 0.08 -1.09 -0.03 0.00 0.10 0.00 0.00 34.13 33.18 2dnu s GLU 9 CO 0.29 -0.20 0.31 0.15 0.02 0.00 0.00 175.26 175.84 2dnu s LYS 10 N 1.48 3.81 0.42 1.61 1.02 -1.26 -1.59 119.74 125.24 2dnu s LYS 10 Ca -0.02 -0.25 0.07 0.00 0.02 0.00 0.00 55.97 55.80 2dnu s LYS 10 Cb -0.13 -3.72 -0.03 0.00 -0.52 0.00 0.00 37.83 33.43 2dnu s LYS 10 CO -0.04 -0.35 0.28 0.71 -0.92 0.00 0.00 175.35 175.04 2dnu s TYR 11 N 1.95 2.61 0.07 3.18 1.51 0.67 -3.61 117.35 123.72 2dnu s TYR 11 Ca 0.11 -0.56 0.06 0.00 -1.01 0.00 0.00 57.07 55.68 2dnu s TYR 11 Cb -0.16 -2.06 -0.03 0.00 -0.11 0.00 0.00 41.96 39.60 2dnu s TYR 11 CO 0.11 0.01 -0.18 0.54 -1.11 0.00 0.00 175.55 174.93 2dnu s VAL 12 N -2.55 1.42 -0.09 0.71 0.11 -0.87 -0.32 120.40 118.81 2dnu s VAL 12 Ca 0.44 -1.27 -0.15 0.00 -2.93 0.00 0.00 61.98 58.07 2dnu s VAL 12 Cb 0.00 -1.29 -0.05 0.00 -1.53 0.00 0.00 36.38 33.52 2dnu s VAL 12 CO 0.25 -0.01 0.37 0.42 -3.33 0.00 0.00 175.10 172.79 2dnu s THR 13 N -1.01 5.19 -0.43 5.04 -4.23 -1.03 -1.81 115.64 117.35 2dnu s THR 13 Ca 0.04 0.72 0.17 0.00 -1.18 0.00 0.00 61.69 61.45 2dnu s THR 13 Cb -0.09 -3.69 -0.23 0.00 1.34 0.00 0.00 72.50 69.83 2dnu s THR 13 CO 0.02 0.46 0.57 1.33 -0.54 0.00 0.00 174.62 176.46 2dnu n VAL 14 N 2.82 0.00 -3.83 2.29 0.24 -1.24 -2.42 118.33 116.19 2dnu n VAL 14 Ca -0.12 -0.24 -0.12 0.00 -2.04 0.00 0.00 64.34 61.81 2dnu n VAL 14 Cb 0.52 0.56 -0.10 0.00 -1.47 0.00 0.00 33.84 33.36 2dnu n VAL 14 CO 0.00 0.00 0.00 -1.10 -2.14 0.00 0.00 176.83 173.59 2dnu s GLN 15 N -2.92 0.50 0.58 7.34 -1.52 -1.26 -4.83 119.66 117.55 2dnu s GLN 15 Ca 0.00 -0.22 -0.18 0.00 -1.95 0.00 0.00 55.36 53.01 2dnu s GLN 15 Cb 0.12 0.22 -0.04 0.00 -0.22 0.00 0.00 33.01 33.09 2dnu s GLN 15 CO 0.72 -0.12 1.12 -1.25 -0.25 0.00 0.00 175.29 175.51 2dnu s PRO 16 N -1.11 3.20 0.01 2.91 0.04 -1.26 -4.46 135.00 134.32 2dnu s PRO 16 Ca -0.12 1.55 0.04 0.00 0.04 0.00 0.00 61.00 62.51 2dnu s PRO 16 Cb -0.06 -1.99 -0.01 0.00 0.04 0.00 0.00 34.50 32.48 2dnu s PRO 16 CO 0.02 -0.96 -0.11 -0.47 0.04 0.00 0.00 177.00 175.51 2dnu s TYR 17 N -1.94 1.01 -0.38 0.56 5.04 -0.83 -4.97 117.35 115.85 2dnu s TYR 17 Ca 0.71 -0.24 -0.07 0.00 -2.44 0.00 0.00 57.07 55.04 2dnu s TYR 17 Cb -0.23 -0.63 0.07 0.00 0.35 0.00 0.00 41.96 41.51 2dnu s TYR 17 CO 0.31 -0.01 0.17 0.99 -1.34 0.00 0.00 175.55 175.68 2dnu s THR 18 N -0.46 3.81 -0.23 4.34 2.01 -1.26 -3.01 115.64 120.84 2dnu s THR 18 Ca 0.03 -1.41 -0.29 0.00 0.31 0.00 0.00 61.69 60.33 2dnu s THR 18 Cb -0.05 -3.30 -0.01 0.00 0.01 0.00 0.00 72.50 69.14 2dnu s THR 18 CO 0.00 -0.39 1.34 -0.94 -0.69 0.00 0.00 174.62 173.94 2dnu s SER 19 N 1.75 6.74 -0.03 3.53 1.04 -1.26 -4.92 113.70 120.56 2dnu s SER 19 Ca 0.02 1.49 -0.23 0.00 0.48 0.00 0.00 55.95 57.70 2dnu s SER 19 Cb -0.21 -2.54 -0.21 0.00 0.10 0.00 0.00 66.02 63.15 2dnu s SER 19 CO 0.01 -0.97 1.11 1.56 0.98 0.00 0.00 173.24 175.94 2dnu h GLN 20 N 9.04 0.21 -5.52 4.02 1.08 -1.95 -3.46 115.11 118.53 2dnu h GLN 20 Ca -0.28 -0.18 -0.51 0.00 -1.45 0.00 0.00 58.65 56.23 2dnu h GLN 20 Cb 1.11 0.04 -0.14 0.00 -0.05 0.00 0.00 27.48 28.44 2dnu h GLN 20 CO 1.00 0.86 -0.66 -1.12 -0.95 0.00 0.00 178.83 177.96 2dnu s SER 21 N -6.25 2.85 0.17 1.46 0.01 -1.26 -5.05 113.70 105.63 2dnu s SER 21 Ca -0.15 -1.22 -0.22 0.00 1.31 0.00 0.00 55.95 55.66 2dnu s SER 21 Cb 0.02 -0.18 0.08 0.00 0.21 0.00 0.00 66.02 66.14 2dnu s SER 21 CO 0.74 -0.37 1.59 0.11 0.41 0.00 0.00 173.24 175.73 2dnu h LYS 22 N 2.22 -0.21 -1.18 12.44 1.57 -2.03 0.12 116.57 129.49 2dnu h LYS 22 Ca -0.40 0.01 0.39 0.00 -1.87 0.00 0.00 60.65 58.79 2dnu h LYS 22 Cb 1.24 0.05 -0.10 0.00 0.08 0.00 0.00 32.23 33.49 2dnu h LYS 22 CO 0.68 -0.14 0.78 -0.40 -0.57 0.00 0.00 179.45 179.80 2dnu n ASP 23 N -5.42 0.14 -4.82 0.86 5.75 -1.26 -4.14 116.55 107.66 2dnu n ASP 23 Ca 0.02 1.05 -0.33 0.00 -0.01 0.00 0.00 54.79 55.53 2dnu n ASP 23 Cb 0.34 -0.52 -0.06 0.00 -1.03 0.00 0.00 41.12 39.85 2dnu n ASP 23 CO 0.00 0.00 0.00 -1.61 -0.11 0.00 0.00 177.20 175.48 2dnu s GLU 24 N -4.84 3.16 -0.08 0.11 2.02 0.42 -0.01 118.70 119.49 2dnu s GLU 24 Ca -0.06 -0.47 0.01 0.00 0.02 0.00 0.00 54.97 54.48 2dnu s GLU 24 Cb 0.24 -2.91 -0.03 0.00 0.10 0.00 0.00 34.13 31.53 2dnu s GLU 24 CO 0.66 0.64 -0.09 -1.50 0.02 0.00 0.00 175.26 174.99 2dnu s ILE 25 N -1.27 3.46 -0.17 -1.63 2.07 -1.03 -4.65 121.20 117.97 2dnu s ILE 25 Ca 0.26 -0.56 -0.08 0.00 -1.41 0.00 0.00 60.65 58.86 2dnu s ILE 25 Cb -0.12 -2.41 -0.04 0.00 0.13 0.00 0.00 42.46 40.01 2dnu s ILE 25 CO 0.17 0.58 0.09 -0.83 -1.91 0.00 0.00 174.94 173.03 2dnu s GLY 26 N -0.51 1.97 0.38 1.50 0.00 -1.26 -4.48 107.32 104.93 2dnu s GLY 26 Ca 0.07 -0.72 0.05 0.00 0.00 0.00 0.00 44.72 44.13 2dnu s GLY 26 CO 0.02 -0.02 0.20 -0.11 0.00 0.00 0.00 173.10 173.18 2dnu s PHE 27 N 0.09 1.77 0.47 1.90 -0.12 -1.17 -4.93 117.98 116.00 2dnu s PHE 27 Ca 0.07 -1.47 0.06 0.00 -0.05 0.00 0.00 56.93 55.54 2dnu s PHE 27 Cb -0.12 -0.97 -0.01 0.00 -0.63 0.00 0.00 43.02 41.29 2dnu s PHE 27 CO 0.00 -0.56 0.27 -1.83 -0.05 0.00 0.00 175.22 173.05 2dnu s GLU 28 N -3.58 2.28 -0.35 1.99 -1.05 -1.26 -1.96 118.70 114.77 2dnu s GLU 28 Ca 0.30 -1.91 -0.21 0.00 -0.15 0.00 0.00 54.97 52.99 2dnu s GLU 28 Cb 0.02 -2.03 0.00 0.00 -0.44 0.00 0.00 34.13 31.68 2dnu s GLU 28 CO 0.20 -0.32 0.69 0.21 0.95 0.00 0.00 175.26 176.99 2dnu s LYS 29 N -4.06 3.74 0.00 -4.83 2.20 -1.26 -4.14 119.74 111.38 2dnu s LYS 29 Ca 0.36 0.19 0.00 0.00 -0.36 0.00 0.00 55.97 56.16 2dnu s LYS 29 Cb 0.01 -3.79 0.00 0.00 -1.51 0.00 0.00 37.83 32.53 2dnu s LYS 29 CO 0.21 -0.75 0.00 0.41 -0.36 0.00 0.00 175.35 174.86 2dnu n GLY 30 N 4.57 1.56 3.29 5.54 0.00 -1.02 -4.96 105.19 114.17 2dnu n GLY 30 Ca 0.00 0.00 -0.16 0.00 0.00 0.00 0.00 46.02 45.86 2dnu n GLY 30 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 2dnu s VAL 31 N -2.00 1.25 -0.09 1.61 -7.23 -1.26 -5.00 120.40 107.68 2dnu s VAL 31 Ca 0.00 -2.08 -0.14 0.00 -1.81 0.00 0.00 61.98 57.95 2dnu s VAL 31 Cb 0.00 -2.03 -0.05 0.00 0.56 0.00 0.00 36.38 34.86 2dnu s VAL 31 CO 0.00 -0.59 0.34 -0.89 -0.31 0.00 0.00 175.10 173.64 2dnu s THR 32 N -3.28 5.21 0.15 5.32 2.01 -1.26 -2.47 115.64 121.33 2dnu s THR 32 Ca 0.21 0.66 0.07 0.00 0.31 0.00 0.00 61.69 62.95 2dnu s THR 32 Cb 0.03 -3.65 -0.04 0.00 0.01 0.00 0.00 72.50 68.84 2dnu s THR 32 CO 0.04 0.48 -0.16 0.68 -0.69 0.00 0.00 174.62 174.97 2dnu s VAL 33 N -0.29 1.63 -0.34 3.82 -7.23 0.56 -4.91 120.40 113.65 2dnu s VAL 33 Ca 0.20 -1.89 -0.03 0.00 -1.81 0.00 0.00 61.98 58.45 2dnu s VAL 33 Cb -0.14 -1.77 0.06 0.00 0.56 0.00 0.00 36.38 35.09 2dnu s VAL 33 CO 0.08 -0.39 0.08 -1.61 -0.31 0.00 0.00 175.10 172.95 2dnu s GLU 34 N -2.88 2.34 -0.48 4.82 8.01 -1.06 -0.24 118.70 129.21 2dnu s GLU 34 Ca 0.14 -1.41 -0.28 0.00 0.01 0.00 0.00 54.97 53.44 2dnu s GLU 34 Cb -0.05 -3.34 0.00 0.00 -4.31 0.00 0.00 34.13 26.43 2dnu s GLU 34 CO 0.05 -0.76 1.56 0.08 0.01 0.00 0.00 175.26 176.20 2dnu s VAL 35 N 1.25 3.69 -0.06 2.63 1.01 -0.62 -0.23 120.40 128.07 2dnu s VAL 35 Ca -0.01 0.63 -0.06 0.00 0.00 0.00 0.00 61.98 62.54 2dnu s VAL 35 Cb -0.21 -4.15 -0.03 0.00 0.00 0.00 0.00 36.38 31.99 2dnu s VAL 35 CO -0.01 -0.88 0.27 0.40 0.00 0.00 0.00 175.10 174.88 2dnu h ILE 36 N 6.56 0.00 -3.51 2.22 2.04 0.39 -3.38 117.51 121.83 2dnu h ILE 36 Ca -0.28 -0.67 -0.32 0.00 1.00 0.00 0.00 64.86 64.59 2dnu h ILE 36 Cb 1.12 0.00 -0.15 0.00 -0.74 0.00 0.00 36.82 37.06 2dnu h ILE 36 CO 1.13 0.00 -0.69 -0.13 0.00 0.00 0.00 178.15 178.46 2dnu s ARG 37 N -2.20 1.10 0.04 2.37 0.52 -0.97 -5.00 118.95 114.81 2dnu s ARG 37 Ca -0.03 -1.50 0.09 0.00 -0.52 0.00 0.00 55.73 53.76 2dnu s ARG 37 Cb 0.00 -0.48 -0.03 0.00 0.52 0.00 0.00 34.95 34.96 2dnu s ARG 37 CO 0.09 -0.02 -0.25 0.15 0.02 0.00 0.00 175.30 175.29 2dnu s LYS 38 N -3.82 1.77 0.31 3.54 1.02 -1.26 -0.80 119.74 120.50 2dnu s LYS 38 Ca 0.20 -1.06 0.10 0.00 0.02 0.00 0.00 55.97 55.23 2dnu s LYS 38 Cb 0.04 -1.91 -0.06 0.00 -0.52 0.00 0.00 37.83 35.39 2dnu s LYS 38 CO 0.02 0.50 -0.13 1.21 -0.92 0.00 0.00 175.35 176.04 2dnu s ASN 39 N -1.15 3.55 0.07 2.83 3.84 0.24 -4.96 114.94 119.35 2dnu s ASN 39 Ca 0.11 -1.14 -0.03 0.00 0.21 0.00 0.00 52.86 52.01 2dnu s ASN 39 Cb -0.10 -0.31 -0.28 0.00 -0.55 0.00 0.00 41.25 40.02 2dnu s ASN 39 CO 0.02 -0.14 1.11 -0.07 -2.79 0.00 0.00 177.10 175.22 2dnu h LEU 40 N 2.14 0.39 -4.36 3.21 3.38 -2.02 -3.34 115.31 114.71 2dnu h LEU 40 Ca -0.41 -0.43 -0.30 0.00 0.09 0.00 0.00 57.88 56.83 2dnu h LEU 40 Cb 1.25 -0.13 -0.04 0.00 0.09 0.00 0.00 40.66 41.83 2dnu h LEU 40 CO 0.67 1.34 0.78 -0.62 0.09 0.00 0.00 178.44 180.70 2dnu n GLU 41 N -3.50 2.27 -4.45 1.13 1.02 -1.26 -4.65 120.64 111.19 2dnu n GLU 41 Ca -0.09 -1.23 -0.41 0.00 -0.02 0.00 0.00 57.16 55.41 2dnu n GLU 41 Cb 1.02 -2.17 -0.06 0.00 -0.02 0.00 0.00 31.44 30.20 2dnu n GLU 41 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 2dnu n GLY 42 N 2.84 -0.41 3.02 0.62 0.00 -1.26 -4.90 105.19 105.10 2dnu n GLY 42 Ca 0.49 0.09 -0.31 0.00 0.00 0.00 0.00 46.02 46.28 2dnu n GLY 42 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 2dnu s TRP 43 N -3.27 2.66 -0.28 1.61 0.23 -1.25 -3.63 118.94 115.02 2dnu s TRP 43 Ca 0.81 -1.80 0.02 0.00 -2.03 0.00 0.00 56.10 53.10 2dnu s TRP 43 Cb -0.46 -1.73 0.06 0.00 0.03 0.00 0.00 33.47 31.37 2dnu s TRP 43 CO 1.00 -0.79 -0.06 -1.58 0.96 0.00 0.00 176.95 176.48 2dnu s TRP 44 N 1.31 3.32 -0.17 -1.98 0.52 -0.53 0.83 118.94 122.24 2dnu s TRP 44 Ca -0.03 -2.29 -0.29 0.00 0.02 0.00 0.00 56.10 53.51 2dnu s TRP 44 Cb -0.17 -2.09 -0.04 0.00 -1.15 0.00 0.00 33.47 30.03 2dnu s TRP 44 CO -0.08 -0.87 1.66 -0.47 0.02 0.00 0.00 176.95 177.21 2dnu s TYR 45 N 1.12 2.02 0.41 -1.98 5.04 0.02 -3.22 117.35 120.75 2dnu s TYR 45 Ca -0.06 0.44 0.05 0.00 -2.44 0.00 0.00 57.07 55.06 2dnu s TYR 45 Cb -0.20 -3.96 -0.06 0.00 0.35 0.00 0.00 41.96 38.09 2dnu s TYR 45 CO -0.04 -3.26 0.03 0.96 -1.34 0.00 0.00 175.55 171.89 2dnu s ILE 46 N 5.02 1.56 -0.11 3.14 -4.36 -1.07 0.10 121.20 125.48 2dnu s ILE 46 Ca 0.73 -2.00 0.02 0.00 -0.26 0.00 0.00 60.65 59.15 2dnu s ILE 46 Cb -0.28 -2.76 0.01 0.00 1.25 0.00 0.00 42.46 40.68 2dnu s ILE 46 CO 0.30 0.00 -0.18 -0.60 0.24 0.00 0.00 174.94 174.69 2dnu s ARG 47 N -3.79 2.54 -0.11 0.37 3.52 0.68 -2.36 118.95 119.81 2dnu s ARG 47 Ca 0.30 -0.69 -0.07 0.00 -0.13 0.00 0.00 55.73 55.14 2dnu s ARG 47 Cb 0.08 -2.06 0.04 0.00 -1.56 0.00 0.00 34.95 31.44 2dnu s ARG 47 CO 0.15 0.01 0.26 -0.47 -0.81 0.00 0.00 175.30 174.44 2dnu s TYR 48 N 0.78 -0.33 -1.29 5.12 5.04 -0.23 -2.56 117.35 123.88 2dnu s TYR 48 Ca -0.10 0.78 -0.08 0.00 -2.44 0.00 0.00 57.07 55.23 2dnu s TYR 48 Cb -0.16 0.08 0.01 0.00 0.35 0.00 0.00 41.96 42.25 2dnu s TYR 48 CO 0.01 -0.20 1.08 1.28 -1.34 0.00 0.00 175.55 176.38 2dnu n LEU 49 N 3.65 -3.28 -3.03 6.97 4.77 -1.26 -2.12 117.00 122.70 2dnu n LEU 49 Ca -0.20 -0.49 -0.22 0.00 -0.03 0.00 0.00 56.01 55.07 2dnu n LEU 49 Cb 0.55 -2.88 0.04 0.00 -2.33 0.00 0.00 43.42 38.80 2dnu n LEU 49 CO 0.15 0.59 0.01 0.61 -1.33 0.00 0.00 177.39 177.43 2dnu n GLY 50 N -1.90 -0.51 3.08 -0.72 0.00 -1.26 -4.99 105.19 98.89 2dnu n GLY 50 Ca 0.00 0.13 -0.13 0.00 0.00 0.00 0.00 46.02 46.03 2dnu n GLY 50 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 2dnu s LYS 51 N -5.73 0.24 -0.24 1.61 2.36 -0.90 -5.14 119.74 111.93 2dnu s LYS 51 Ca 0.32 0.41 -0.09 0.00 -2.55 0.00 0.00 55.97 54.06 2dnu s LYS 51 Cb -0.14 0.01 -0.04 0.00 -1.05 0.00 0.00 37.83 36.61 2dnu s LYS 51 CO 0.39 -0.09 0.12 -1.21 1.55 0.00 0.00 175.35 176.11 2dnu s GLU 52 N 0.65 3.92 0.33 4.03 8.01 -1.26 -1.07 118.70 133.31 2dnu s GLU 52 Ca -0.04 -0.35 0.01 0.00 0.01 0.00 0.00 54.97 54.60 2dnu s GLU 52 Cb -0.06 -3.44 -0.00 0.00 -4.31 0.00 0.00 34.13 26.32 2dnu s GLU 52 CO -0.04 -0.00 0.42 0.41 0.01 0.00 0.00 175.26 176.06 2dnu n GLY 53 N 4.44 2.36 3.80 -1.39 0.00 -1.00 -4.97 105.19 108.43 2dnu n GLY 53 Ca -0.15 -1.67 -0.38 0.00 0.00 0.00 0.00 46.02 43.81 2dnu n GLY 53 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 2dnu s TRP 54 N -3.08 3.71 -0.06 1.61 0.52 0.99 -2.59 118.94 120.05 2dnu s TRP 54 Ca 0.30 1.09 -0.10 0.00 0.02 0.00 0.00 56.10 57.42 2dnu s TRP 54 Cb -0.00 -2.45 0.02 0.00 -1.15 0.00 0.00 33.47 29.89 2dnu s TRP 54 CO 0.22 0.50 0.24 0.00 0.02 0.00 0.00 176.95 177.93 2dnu s ALA 55 N -0.66 -0.59 0.04 0.98 0.00 -1.20 -2.47 121.76 117.85 2dnu s ALA 55 Ca 0.27 0.46 -0.31 0.00 0.00 0.00 0.00 51.96 52.38 2dnu s ALA 55 Cb -0.17 -0.20 -0.06 0.00 0.00 0.00 0.00 23.12 22.68 2dnu s ALA 55 CO 0.15 -0.17 1.41 -1.25 0.00 0.00 0.00 175.76 175.91 2dnu s PRO 56 N -0.48 4.29 0.65 0.00 0.04 -1.26 -1.46 135.00 136.78 2dnu s PRO 56 Ca -0.06 2.02 0.36 0.00 0.04 0.00 0.00 61.00 63.36 2dnu s PRO 56 Cb -0.04 -3.47 1.99 0.00 0.04 0.00 0.00 34.50 33.02 2dnu s PRO 56 CO 0.01 -0.54 2.16 0.00 0.04 0.00 0.00 177.00 178.68 2dnu h ALA 57 N 7.53 1.30 0.00 8.56 0.00 -1.89 -0.15 119.26 134.62 2dnu h ALA 57 Ca -0.40 -0.00 -0.03 0.00 0.00 0.00 0.00 54.91 54.48 2dnu h ALA 57 Cb 1.19 0.00 -0.00 0.00 0.00 0.00 0.00 17.79 18.98 2dnu h ALA 57 CO 0.89 -0.18 -0.15 0.77 0.00 0.00 0.00 179.25 180.58 2dnu h SER 58 N 0.00 0.00 -0.48 0.00 0.02 -1.90 -1.10 113.55 110.09 2dnu h SER 58 Ca 0.02 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.97 2dnu h SER 58 Cb 0.33 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.87 2dnu h SER 58 CO -0.00 0.15 0.00 -1.22 -1.14 0.00 0.00 176.83 174.62 2dnu n TYR 59 N -4.30 1.42 -3.93 3.45 4.02 -0.07 -4.88 117.16 112.87 2dnu n TYR 59 Ca -0.03 -0.52 -0.12 0.00 -0.01 0.00 0.00 57.90 57.22 2dnu n TYR 59 Cb 0.22 -0.32 -0.14 0.00 -0.02 0.00 0.00 39.34 39.09 2dnu n TYR 59 CO 0.00 0.00 0.00 -0.51 -1.01 0.00 0.00 176.86 175.34 2dnu s LEU 60 N -1.86 2.04 -0.04 7.72 1.43 -0.42 -3.67 118.68 123.89 2dnu s LEU 60 Ca 0.42 -0.10 -0.03 0.00 -1.03 0.00 0.00 54.13 53.39 2dnu s LEU 60 Cb 0.29 -0.03 0.01 0.00 0.03 0.00 0.00 46.19 46.50 2dnu s LEU 60 CO 0.16 -0.04 0.09 -1.59 0.23 0.00 0.00 176.35 175.20 2dnu s LYS 61 N -0.26 0.09 0.03 1.70 -2.85 -0.75 -4.89 119.74 112.81 2dnu s LYS 61 Ca -0.02 0.16 -0.34 0.00 -1.00 0.00 0.00 55.97 54.77 2dnu s LYS 61 Cb -0.02 0.00 -0.13 0.00 -2.06 0.00 0.00 37.83 35.63 2dnu s LYS 61 CO -0.00 -0.04 1.74 1.17 0.10 0.00 0.00 175.35 178.31 2dnu n LYS 62 N 3.26 2.17 -3.05 1.78 4.81 -1.26 -2.06 118.16 123.81 2dnu n LYS 62 Ca -0.15 0.79 -0.35 0.00 -0.87 0.00 0.00 58.31 57.73 2dnu n LYS 62 Cb 0.58 -2.60 -0.06 0.00 0.02 0.00 0.00 35.03 32.96 2dnu n LYS 62 CO 0.00 0.00 0.00 0.00 1.17 0.00 0.00 177.40 178.57 2dnu s ALA 63 N 2.57 3.35 -0.02 3.14 0.00 -1.24 -4.89 121.76 124.67 2dnu s ALA 63 Ca 0.86 0.20 0.01 0.00 0.00 0.00 0.00 51.96 53.04 2dnu s ALA 63 Cb -0.68 -2.88 0.01 0.00 0.00 0.00 0.00 23.12 19.57 2dnu s ALA 63 CO 0.45 0.30 -0.04 0.21 0.00 0.00 0.00 175.76 176.67 2dnu s LYS 64 N -2.22 0.54 -0.14 0.00 2.20 -1.26 -5.00 119.74 113.86 2dnu s LYS 64 Ca 0.47 -0.12 -0.03 0.00 -0.36 0.00 0.00 55.97 55.93 2dnu s LYS 64 Cb -0.15 -0.57 -0.03 0.00 -1.51 0.00 0.00 37.83 35.57 2dnu s LYS 64 CO 0.20 0.01 -0.04 -0.51 -0.36 0.00 0.00 175.35 174.66 2dnu s ASP 65 N 0.39 4.82 -0.00 1.43 1.11 -1.26 -5.03 116.67 118.13 2dnu s ASP 65 Ca -0.04 -0.09 -0.24 0.00 0.18 0.00 0.00 52.55 52.35 2dnu s ASP 65 Cb -0.08 -1.68 -0.17 0.00 1.07 0.00 0.00 42.92 42.06 2dnu s ASP 65 CO -0.00 0.21 1.19 0.28 1.18 0.00 0.00 175.17 178.03 2dnu h SER 66 N 6.38 -0.25 -0.88 0.27 0.02 -2.04 -3.46 113.55 113.58 2dnu h SER 66 Ca -0.35 -0.25 0.00 0.00 -0.84 0.00 0.00 61.79 60.35 2dnu h SER 66 Cb 1.19 0.07 0.00 0.00 0.14 0.00 0.00 62.40 63.79 2dnu h SER 66 CO 0.61 0.15 0.00 0.61 -1.14 0.00 0.00 176.83 177.06 2dnu n GLY 67 N -0.10 0.64 3.55 -3.77 0.00 -1.26 -4.96 105.19 99.29 2dnu n GLY 67 Ca -0.09 -1.82 -0.39 0.00 0.00 0.00 0.00 46.02 43.73 2dnu n GLY 67 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2dnu s PRO 68 N 1.52 2.70 0.95 1.61 0.04 -1.26 -4.97 135.00 135.59 2dnu s PRO 68 Ca 0.00 0.67 -0.12 0.00 0.04 0.00 0.00 61.00 61.60 2dnu s PRO 68 Cb 0.00 -4.37 0.11 0.00 0.04 0.00 0.00 34.50 30.28 2dnu s PRO 68 CO 0.00 -2.64 0.80 -1.13 0.04 0.00 0.00 177.00 174.07 2dnu n SER 69 N 12.48 -0.86 -4.75 6.66 3.41 -1.26 -4.98 113.62 124.32 2dnu n SER 69 Ca 0.20 0.33 -0.37 0.00 -0.26 0.00 0.00 58.87 58.78 2dnu n SER 69 Cb 0.52 -1.34 -0.07 0.00 -0.26 0.00 0.00 64.21 63.06 2dnu n SER 69 CO 0.00 0.00 0.00 -0.55 -0.16 0.00 0.00 175.04 174.33 2dnu s SER 70 N -2.35 6.45 0.00 4.04 0.15 -1.26 -5.20 113.70 115.54 2dnu s SER 70 Ca 0.63 0.53 0.00 0.00 0.70 0.00 0.00 55.95 57.81 2dnu s SER 70 Cb -0.22 -2.17 0.00 0.00 -1.71 0.00 0.00 66.02 61.92 2dnu s SER 70 CO 0.63 0.16 0.00 0.61 1.20 0.00 0.00 173.24 175.83