#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2dnu h SER 2 N 0.00 -1.16 -3.99 1.61 0.02 -2.13 -3.44 113.55 104.46 2dnu h SER 2 Ca 0.00 0.06 -0.46 0.00 -0.84 0.00 0.00 61.79 60.55 2dnu h SER 2 Cb 0.00 0.34 0.08 0.00 0.14 0.00 0.00 62.40 62.96 2dnu h SER 2 CO 0.00 -0.72 0.28 -0.44 -1.14 0.00 0.00 176.83 174.80 2dnu s SER 3 N -4.20 4.76 0.00 3.07 0.01 -1.26 -4.98 113.70 111.10 2dnu s SER 3 Ca -0.19 0.55 0.00 0.00 1.31 0.00 0.00 55.95 57.62 2dnu s SER 3 Cb 0.03 -1.17 0.00 0.00 0.21 0.00 0.00 66.02 65.09 2dnu s SER 3 CO 0.61 -1.67 0.00 0.61 0.41 0.00 0.00 173.24 173.20 2dnu n GLY 4 N -3.02 -0.18 3.41 3.44 0.00 -1.26 -5.10 105.19 102.48 2dnu n GLY 4 Ca 0.08 -0.02 -0.39 0.00 0.00 0.00 0.00 46.02 45.70 2dnu n GLY 4 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2dnu s SER 5 N -1.56 5.49 -0.67 1.61 0.15 -1.26 -5.02 113.70 112.43 2dnu s SER 5 Ca 0.00 -0.62 -0.34 0.00 0.70 0.00 0.00 55.95 55.69 2dnu s SER 5 Cb 0.00 -1.98 -0.17 0.00 -1.71 0.00 0.00 66.02 62.16 2dnu s SER 5 CO 0.00 -0.22 2.43 -1.20 1.20 0.00 0.00 173.24 175.45 2dnu n SER 6 N 4.96 1.11 -4.92 5.45 7.64 -1.26 -4.90 113.62 121.71 2dnu n SER 6 Ca -0.14 0.22 -0.27 0.00 1.01 0.00 0.00 58.87 59.69 2dnu n SER 6 Cb 0.48 -1.10 -0.04 0.00 -1.01 0.00 0.00 64.21 62.55 2dnu n SER 6 CO 0.00 0.00 0.00 -0.83 -3.01 0.00 0.00 175.04 171.20 2dnu s GLY 7 N 8.56 1.78 -0.12 0.23 0.00 -1.26 -5.05 107.32 111.46 2dnu s GLY 7 Ca 1.21 -1.03 -0.07 0.00 0.00 0.00 0.00 44.72 44.83 2dnu s GLY 7 CO 0.49 -1.03 -0.13 0.83 0.00 0.00 0.00 173.10 173.26 2dnu h GLU 8 N 2.34 0.00 -2.78 2.90 4.39 -1.90 -3.49 114.58 116.03 2dnu h GLU 8 Ca -0.48 0.00 -0.14 0.00 0.34 0.00 0.00 59.36 59.08 2dnu h GLU 8 Cb 1.19 0.00 -0.27 0.00 -0.10 0.00 0.00 28.75 29.57 2dnu h GLU 8 CO 0.69 0.00 -0.33 -1.21 -1.16 0.00 0.00 179.01 176.99 2dnu s GLU 9 N -2.01 0.36 -0.18 2.33 2.02 -1.26 -5.09 118.70 114.88 2dnu s GLU 9 Ca -0.11 0.65 -0.00 0.00 0.02 0.00 0.00 54.97 55.54 2dnu s GLU 9 Cb 0.01 0.02 0.01 0.00 0.10 0.00 0.00 34.13 34.27 2dnu s GLU 9 CO 0.16 -0.13 -0.15 0.15 0.02 0.00 0.00 175.26 175.31 2dnu s LYS 10 N 1.03 3.15 0.52 1.61 1.02 -1.26 -1.48 119.74 124.32 2dnu s LYS 10 Ca -0.07 -0.76 0.06 0.00 0.02 0.00 0.00 55.97 55.22 2dnu s LYS 10 Cb -0.07 -2.66 0.06 0.00 -0.52 0.00 0.00 37.83 34.64 2dnu s LYS 10 CO -0.08 -0.11 0.53 0.66 -0.92 0.00 0.00 175.35 175.43 2dnu n TYR 11 N 4.40 -1.38 -4.63 3.18 4.02 -0.56 -3.99 117.16 118.19 2dnu n TYR 11 Ca -0.20 -2.05 -0.24 0.00 -0.01 0.00 0.00 57.90 55.40 2dnu n TYR 11 Cb 0.51 -0.45 -0.14 0.00 -0.02 0.00 0.00 39.34 39.23 2dnu n TYR 11 CO 0.00 0.00 0.00 0.08 -1.01 0.00 0.00 176.86 175.93 2dnu s VAL 12 N -2.42 1.41 -0.08 -0.72 1.01 -0.19 -2.35 120.40 117.06 2dnu s VAL 12 Ca 0.40 -0.97 -0.18 0.00 0.00 0.00 0.00 61.98 61.23 2dnu s VAL 12 Cb -0.03 -1.22 -0.05 0.00 0.00 0.00 0.00 36.38 35.08 2dnu s VAL 12 CO 0.26 0.22 0.47 0.42 0.00 0.00 0.00 175.10 176.46 2dnu s THR 13 N -0.66 5.13 -0.55 3.92 -4.23 -1.15 -0.23 115.64 117.86 2dnu s THR 13 Ca 0.06 0.94 0.13 0.00 -1.18 0.00 0.00 61.69 61.65 2dnu s THR 13 Cb -0.08 -3.80 -0.16 0.00 1.34 0.00 0.00 72.50 69.81 2dnu s THR 13 CO 0.01 0.39 0.54 1.33 -0.54 0.00 0.00 174.62 176.34 2dnu n VAL 14 N 3.19 0.00 -3.80 2.29 0.24 -1.23 -2.40 118.33 116.62 2dnu n VAL 14 Ca -0.09 -0.20 -0.12 0.00 -2.04 0.00 0.00 64.34 61.89 2dnu n VAL 14 Cb 0.52 0.88 -0.11 0.00 -1.47 0.00 0.00 33.84 33.66 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 -2.37 0.39 0.32 7.34 -0.21 -1.26 -4.87 119.66 119.01 2dnu s GLN 15 Ca 0.04 0.07 -0.29 0.00 0.02 0.00 0.00 55.36 55.20 2dnu s GLN 15 Cb 0.10 0.18 -0.10 0.00 1.00 0.00 0.00 33.01 34.19 2dnu s GLN 15 CO 0.56 -0.08 1.22 -1.25 -2.12 0.00 0.00 175.29 173.62 2dnu s PRO 16 N -0.47 4.42 0.03 2.91 0.04 -1.26 -4.49 135.00 136.18 2dnu s PRO 16 Ca -0.06 2.04 0.08 0.00 0.04 0.00 0.00 61.00 63.11 2dnu s PRO 16 Cb -0.04 -3.07 -0.03 0.00 0.04 0.00 0.00 34.50 31.41 2dnu s PRO 16 CO 0.01 -0.07 -0.24 -0.47 0.04 0.00 0.00 177.00 176.28 2dnu s TYR 17 N -1.17 2.08 -0.33 0.56 5.04 -0.53 -4.97 117.35 118.03 2dnu s TYR 17 Ca 0.48 -0.39 0.03 0.00 -2.44 0.00 0.00 57.07 54.75 2dnu s TYR 17 Cb -0.36 -1.26 0.09 0.00 0.35 0.00 0.00 41.96 40.78 2dnu s TYR 17 CO 0.48 0.09 0.03 0.99 -1.34 0.00 0.00 175.55 175.79 2dnu s THR 18 N -0.76 2.39 0.03 4.34 2.01 -1.26 -2.91 115.64 119.49 2dnu s THR 18 Ca 0.10 -2.14 -0.30 0.00 0.31 0.00 0.00 61.69 59.65 2dnu s THR 18 Cb -0.09 -2.67 -0.06 0.00 0.01 0.00 0.00 72.50 69.69 2dnu s THR 18 CO 0.01 -0.48 1.31 -0.94 -0.69 0.00 0.00 174.62 173.84 2dnu s SER 19 N 1.05 6.94 0.03 3.53 1.04 -1.26 -4.93 113.70 120.10 2dnu s SER 19 Ca 0.06 2.08 -0.07 0.00 0.48 0.00 0.00 55.95 58.50 2dnu s SER 19 Cb -0.20 -2.57 -0.30 0.00 0.10 0.00 0.00 66.02 63.05 2dnu s SER 19 CO -0.07 -0.61 0.98 1.56 0.98 0.00 0.00 173.24 176.08 2dnu h GLN 20 N 7.26 0.34 -5.44 4.02 1.08 -1.97 -3.46 115.11 116.94 2dnu h GLN 20 Ca -0.39 -0.59 -0.52 0.00 -1.45 0.00 0.00 58.65 55.69 2dnu h GLN 20 Cb 1.19 0.22 -0.14 0.00 -0.05 0.00 0.00 27.48 28.71 2dnu h GLN 20 CO 0.86 1.25 -0.63 -1.12 -0.95 0.00 0.00 178.83 178.25 2dnu s SER 21 N -7.22 2.92 0.17 1.46 0.01 -1.26 -5.05 113.70 104.72 2dnu s SER 21 Ca -0.08 -1.32 -0.15 0.00 1.31 0.00 0.00 55.95 55.72 2dnu s SER 21 Cb 0.06 -0.20 0.11 0.00 0.21 0.00 0.00 66.02 66.20 2dnu s SER 21 CO 0.89 -0.48 1.74 0.11 0.41 0.00 0.00 173.24 175.91 2dnu h LYS 22 N 2.07 0.27 -0.99 12.44 1.57 -2.02 -1.91 116.57 128.00 2dnu h LYS 22 Ca -0.41 -0.02 0.40 0.00 -1.87 0.00 0.00 60.65 58.75 2dnu h LYS 22 Cb 1.24 -0.06 -0.18 0.00 0.08 0.00 0.00 32.23 33.31 2dnu h LYS 22 CO 0.72 0.18 0.48 -0.25 -0.57 0.00 0.00 179.45 180.01 2dnu n ASP 23 N -5.04 0.30 -4.93 0.86 8.00 -1.26 -4.32 116.55 110.16 2dnu n ASP 23 Ca 0.03 1.65 -0.27 0.00 0.71 0.00 0.00 54.79 56.90 2dnu n ASP 23 Cb 0.17 -0.78 -0.03 0.00 -0.02 0.00 0.00 41.12 40.45 2dnu n ASP 23 CO 0.00 0.00 0.00 -1.61 -0.39 0.00 0.00 177.20 175.20 2dnu s GLU 24 N -5.55 3.49 -0.05 -1.24 8.01 -0.72 0.01 118.70 122.65 2dnu s GLU 24 Ca -0.09 -0.43 0.06 0.00 0.01 0.00 0.00 54.97 54.52 2dnu s GLU 24 Cb 0.33 -2.90 -0.01 0.00 -4.31 0.00 0.00 34.13 27.24 2dnu s GLU 24 CO 0.77 0.47 -0.23 -1.50 0.01 0.00 0.00 175.26 174.77 2dnu s ILE 25 N -1.78 1.90 -0.19 -1.63 2.07 -1.19 -4.70 121.20 115.68 2dnu s ILE 25 Ca 0.37 -0.99 -0.07 0.00 -1.41 0.00 0.00 60.65 58.55 2dnu s ILE 25 Cb -0.11 -1.60 -0.04 0.00 0.13 0.00 0.00 42.46 40.84 2dnu s ILE 25 CO 0.29 0.53 0.06 -0.83 -1.91 0.00 0.00 174.94 173.08 2dnu s GLY 26 N -0.20 1.90 0.27 1.50 0.00 -1.26 -4.51 107.32 105.02 2dnu s GLY 26 Ca -0.01 -0.76 0.04 0.00 0.00 0.00 0.00 44.72 43.99 2dnu s GLY 26 CO 0.02 0.08 0.01 -0.11 0.00 0.00 0.00 173.10 173.10 2dnu s PHE 27 N 0.42 1.78 0.38 1.90 -0.12 -1.14 -4.91 117.98 116.29 2dnu s PHE 27 Ca 0.03 -0.89 0.02 0.00 -0.05 0.00 0.00 56.93 56.04 2dnu s PHE 27 Cb -0.12 -1.07 -0.02 0.00 -0.63 0.00 0.00 43.02 41.17 2dnu s PHE 27 CO 0.00 0.04 0.57 -1.21 -0.05 0.00 0.00 175.22 174.58 2dnu s GLU 28 N -3.85 3.24 -0.33 1.99 2.02 -1.26 -1.45 118.70 119.07 2dnu s GLU 28 Ca 0.32 -0.54 -0.28 0.00 0.02 0.00 0.00 54.97 54.48 2dnu s GLU 28 Cb 0.06 -2.66 0.02 0.00 0.10 0.00 0.00 34.13 31.65 2dnu s GLU 28 CO 0.12 -0.02 1.04 0.21 0.02 0.00 0.00 175.26 176.63 2dnu s LYS 29 N -4.37 4.03 0.00 1.61 2.20 -1.26 -3.86 119.74 118.09 2dnu s LYS 29 Ca 0.44 0.97 0.00 0.00 -0.36 0.00 0.00 55.97 57.02 2dnu s LYS 29 Cb -0.10 -3.75 0.00 0.00 -1.51 0.00 0.00 37.83 32.48 2dnu s LYS 29 CO 0.35 -0.90 0.00 0.41 -0.36 0.00 0.00 175.35 174.85 2dnu n GLY 30 N 3.97 1.77 3.54 5.54 0.00 -1.01 -4.96 105.19 114.05 2dnu n GLY 30 Ca 0.11 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.87 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 0.73 -0.09 1.61 -7.23 -1.25 -5.00 120.40 107.16 2dnu s VAL 31 Ca 0.00 -2.00 -0.00 0.00 -1.81 0.00 0.00 61.98 58.17 2dnu s VAL 31 Cb 0.00 -2.36 -0.03 0.00 0.56 0.00 0.00 36.38 34.55 2dnu s VAL 31 CO 0.00 0.00 -0.07 -0.89 -0.31 0.00 0.00 175.10 173.83 2dnu s THR 32 N -3.17 3.68 0.04 5.32 2.01 -1.26 -2.94 115.64 119.32 2dnu s THR 32 Ca 0.22 -0.47 0.06 0.00 0.31 0.00 0.00 61.69 61.81 2dnu s THR 32 Cb 0.03 -2.53 -0.02 0.00 0.01 0.00 0.00 72.50 69.98 2dnu s THR 32 CO 0.13 0.57 -0.18 0.68 -0.69 0.00 0.00 174.62 175.13 2dnu s VAL 33 N -0.43 1.44 -0.37 3.82 -7.23 -0.99 -4.93 120.40 111.70 2dnu s VAL 33 Ca 0.06 -1.12 -0.10 0.00 -1.81 0.00 0.00 61.98 59.02 2dnu s VAL 33 Cb -0.12 -1.27 0.03 0.00 0.56 0.00 0.00 36.38 35.58 2dnu s VAL 33 CO 0.02 0.12 0.18 -1.61 -0.31 0.00 0.00 175.10 173.50 2dnu s GLU 34 N -1.17 2.76 -0.10 4.82 0.41 -1.05 -1.50 118.70 122.87 2dnu s GLU 34 Ca 0.05 -1.12 -0.30 0.00 -0.41 0.00 0.00 54.97 53.19 2dnu s GLU 34 Cb -0.08 -3.67 -0.03 0.00 -1.78 0.00 0.00 34.13 28.57 2dnu s GLU 34 CO 0.02 -0.70 1.26 0.08 -0.49 0.00 0.00 175.26 175.42 2dnu s VAL 35 N 1.51 4.21 -0.22 2.63 1.01 -0.55 -0.09 120.40 128.90 2dnu s VAL 35 Ca 0.01 1.51 -0.17 0.00 0.00 0.00 0.00 61.98 63.32 2dnu s VAL 35 Cb -0.19 -3.97 -0.13 0.00 0.00 0.00 0.00 36.38 32.08 2dnu s VAL 35 CO 0.06 -0.07 -0.06 -0.38 0.00 0.00 0.00 175.10 174.65 2dnu n ILE 36 N 5.00 1.51 -4.62 2.22 5.41 0.14 -4.25 119.36 124.77 2dnu n ILE 36 Ca 0.13 -0.07 -0.28 0.00 1.00 0.00 0.00 62.75 63.52 2dnu n ILE 36 Cb 0.45 -2.08 -0.10 0.00 -0.71 0.00 0.00 39.64 37.20 2dnu n ILE 36 CO 0.00 0.00 0.00 -0.13 0.00 0.00 0.00 176.55 176.42 2dnu s ARG 37 N -2.43 1.95 -0.23 0.38 0.52 -0.85 -5.02 118.95 113.28 2dnu s ARG 37 Ca -0.29 -2.13 -0.04 0.00 -0.52 0.00 0.00 55.73 52.74 2dnu s ARG 37 Cb 0.08 -1.49 0.08 0.00 0.52 0.00 0.00 34.95 34.14 2dnu s ARG 37 CO 0.49 -0.13 0.13 0.15 0.02 0.00 0.00 175.30 175.96 2dnu s LYS 38 N -3.76 0.14 0.74 3.54 -0.14 -1.26 -3.04 119.74 115.96 2dnu s LYS 38 Ca 0.30 -0.25 -0.09 0.00 -1.36 0.00 0.00 55.97 54.58 2dnu s LYS 38 Cb 0.08 -1.42 0.16 0.00 -1.68 0.00 0.00 37.83 34.98 2dnu s LYS 38 CO 0.15 -0.84 1.01 -1.71 -0.76 0.00 0.00 175.35 173.21 2dnu n ASN 39 N 5.27 0.48 0.00 2.83 2.85 -0.43 -5.03 115.26 121.22 2dnu n ASN 39 Ca -0.06 -1.61 0.00 0.00 -0.11 0.00 0.00 54.58 52.80 2dnu n ASN 39 Cb 0.46 -0.74 0.00 0.00 1.24 0.00 0.00 39.78 40.74 2dnu n ASN 39 CO 0.00 0.00 0.00 0.18 -2.11 0.00 0.00 177.26 175.33 2dnu n LEU 40 N 0.00 0.00 -1.33 1.20 4.32 -1.26 -4.63 117.00 115.30 2dnu n LEU 40 Ca 0.14 -0.18 -0.06 0.00 -0.02 0.00 0.00 56.01 55.89 2dnu n LEU 40 Cb 0.49 0.00 0.04 0.00 -1.62 0.00 0.00 43.42 42.33 2dnu n LEU 40 CO 0.35 0.00 0.72 -1.84 -1.22 0.00 0.00 177.39 175.40 2dnu n GLU 41 N -1.30 1.32 -2.90 3.23 0.28 -1.26 -4.77 120.64 115.24 2dnu n GLU 41 Ca 0.00 -0.77 -0.10 0.00 -0.16 0.00 0.00 57.16 56.13 2dnu n GLU 41 Cb 0.00 -1.30 0.04 0.00 1.43 0.00 0.00 31.44 31.61 2dnu n GLU 41 CO 0.00 0.00 0.00 0.41 -0.16 0.00 0.00 177.13 177.38 2dnu n GLY 42 N 0.12 0.16 2.98 -1.84 0.00 -1.26 -5.04 105.19 100.30 2dnu n GLY 42 Ca 0.15 -0.22 -0.14 0.00 0.00 0.00 0.00 46.02 45.82 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 -3.16 -0.29 -0.18 1.61 0.52 -1.26 -4.56 118.94 111.61 2dnu s TRP 43 Ca 0.18 0.73 0.01 0.00 0.02 0.00 0.00 56.10 57.04 2dnu s TRP 43 Cb -0.08 -0.06 0.03 0.00 -1.15 0.00 0.00 33.47 32.22 2dnu s TRP 43 CO 0.35 -0.25 -0.14 -1.58 0.02 0.00 0.00 176.95 175.35 2dnu s TRP 44 N 1.69 2.49 -0.30 -1.98 0.52 -0.77 -1.32 118.94 119.27 2dnu s TRP 44 Ca -0.05 -1.55 -0.29 0.00 0.02 0.00 0.00 56.10 54.24 2dnu s TRP 44 Cb -0.11 -1.72 0.00 0.00 -1.15 0.00 0.00 33.47 30.49 2dnu s TRP 44 CO -0.07 -0.75 1.33 -0.47 0.02 0.00 0.00 176.95 177.01 2dnu s TYR 45 N 1.38 2.62 0.37 -1.98 5.04 -1.17 -1.73 117.35 121.87 2dnu s TYR 45 Ca 0.02 0.83 0.06 0.00 -2.44 0.00 0.00 57.07 55.53 2dnu s TYR 45 Cb -0.15 -3.95 -0.07 0.00 0.35 0.00 0.00 41.96 38.14 2dnu s TYR 45 CO -0.10 -1.83 0.01 0.96 -1.34 0.00 0.00 175.55 173.26 2dnu s ILE 46 N 4.53 1.72 -0.08 3.14 -4.36 -0.41 0.26 121.20 125.99 2dnu s ILE 46 Ca 0.58 -2.02 0.03 0.00 -0.26 0.00 0.00 60.65 58.97 2dnu s ILE 46 Cb -0.17 -2.87 0.01 0.00 1.25 0.00 0.00 42.46 40.68 2dnu s ILE 46 CO 0.24 -0.03 -0.17 -0.60 0.24 0.00 0.00 174.94 174.62 2dnu s ARG 47 N -3.77 2.25 -0.05 0.37 3.52 0.87 -0.78 118.95 121.37 2dnu s ARG 47 Ca 0.35 -0.60 -0.03 0.00 -0.13 0.00 0.00 55.73 55.32 2dnu s ARG 47 Cb 0.09 -1.79 0.03 0.00 -1.56 0.00 0.00 34.95 31.72 2dnu s ARG 47 CO 0.17 0.07 0.11 -0.47 -0.81 0.00 0.00 175.30 174.37 2dnu s TYR 48 N 0.59 -0.11 -1.55 5.12 5.04 0.43 -2.53 117.35 124.34 2dnu s TYR 48 Ca -0.15 0.36 -0.03 0.00 -2.44 0.00 0.00 57.07 54.81 2dnu s TYR 48 Cb -0.16 -0.07 0.00 0.00 0.35 0.00 0.00 41.96 42.07 2dnu s TYR 48 CO 0.05 -0.12 0.39 1.28 -1.34 0.00 0.00 175.55 175.81 2dnu n LEU 49 N 3.85 -2.40 -0.96 6.97 4.77 -1.26 -1.72 117.00 126.25 2dnu n LEU 49 Ca -0.23 -0.19 -0.09 0.00 -0.03 0.00 0.00 56.01 55.48 2dnu n LEU 49 Cb 0.54 -2.84 -0.01 0.00 -2.33 0.00 0.00 43.42 38.78 2dnu n LEU 49 CO 0.20 0.08 -0.11 0.61 -1.33 0.00 0.00 177.39 176.84 2dnu n GLY 50 N -1.34 0.19 2.81 -0.72 0.00 -1.26 -5.02 105.19 99.85 2dnu n GLY 50 Ca -0.15 -0.53 -0.19 0.00 0.00 0.00 0.00 46.02 45.15 2dnu n GLY 50 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2dnu s LYS 51 N -4.14 0.44 -0.27 1.61 1.02 -0.70 -5.13 119.74 112.58 2dnu s LYS 51 Ca 0.00 0.08 -0.15 0.00 0.02 0.00 0.00 55.97 55.92 2dnu s LYS 51 Cb 0.00 -0.67 -0.04 0.00 -0.52 0.00 0.00 37.83 36.60 2dnu s LYS 51 CO 0.00 -0.18 0.36 -1.21 -0.92 0.00 0.00 175.35 173.40 2dnu s GLU 52 N 1.34 4.02 0.35 1.68 8.01 -1.26 -0.42 118.70 132.41 2dnu s GLU 52 Ca -0.05 0.03 0.03 0.00 0.01 0.00 0.00 54.97 54.98 2dnu s GLU 52 Cb -0.13 -3.65 -0.01 0.00 -4.31 0.00 0.00 34.13 26.03 2dnu s GLU 52 CO -0.02 -0.25 0.39 0.20 0.01 0.00 0.00 175.26 175.58 2dnu s GLY 53 N 1.60 1.96 -0.19 -1.39 0.00 0.04 -4.95 107.32 104.38 2dnu s GLY 53 Ca 0.15 -1.82 -0.18 0.00 0.00 0.00 0.00 44.72 42.87 2dnu s GLY 53 CO 0.10 -1.24 0.48 -0.98 0.00 0.00 0.00 173.10 171.46 2dnu s TRP 54 N -3.18 3.39 0.03 1.90 0.52 0.10 -1.29 118.94 120.41 2dnu s TRP 54 Ca 0.36 0.74 0.05 0.00 0.02 0.00 0.00 56.10 57.27 2dnu s TRP 54 Cb 0.01 -2.62 -0.02 0.00 -1.15 0.00 0.00 33.47 29.69 2dnu s TRP 54 CO 0.25 -0.05 -0.16 0.00 0.02 0.00 0.00 176.95 177.01 2dnu s ALA 55 N 1.44 1.31 -0.09 0.98 0.00 -0.70 -3.19 121.76 121.51 2dnu s ALA 55 Ca 0.23 -0.83 -0.30 0.00 0.00 0.00 0.00 51.96 51.06 2dnu s ALA 55 Cb -0.15 -0.25 -0.04 0.00 0.00 0.00 0.00 23.12 22.68 2dnu s ALA 55 CO 0.09 0.28 1.52 -1.25 0.00 0.00 0.00 175.76 176.40 2dnu s PRO 56 N -0.96 4.20 0.66 0.00 0.04 -1.26 -1.84 135.00 135.83 2dnu s PRO 56 Ca 0.04 2.01 0.33 0.00 0.04 0.00 0.00 61.00 63.41 2dnu s PRO 56 Cb -0.08 -3.90 1.78 0.00 0.04 0.00 0.00 34.50 32.34 2dnu s PRO 56 CO 0.01 -0.79 2.01 0.00 0.04 0.00 0.00 177.00 178.27 2dnu h ALA 57 N 9.05 1.33 0.00 8.56 0.00 -1.89 0.26 119.26 136.57 2dnu h ALA 57 Ca -0.35 -0.00 -0.04 0.00 0.00 0.00 0.00 54.91 54.52 2dnu h ALA 57 Cb 1.15 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 18.94 2dnu h ALA 57 CO 0.96 -0.29 -0.18 0.77 0.00 0.00 0.00 179.25 180.51 2dnu h SER 58 N 0.00 0.00 -0.55 0.00 0.02 -1.93 -2.29 113.55 108.80 2dnu h SER 58 Ca 0.01 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.96 2dnu h SER 58 Cb 0.56 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.10 2dnu h SER 58 CO -0.00 0.18 0.00 -1.22 -1.14 0.00 0.00 176.83 174.65 2dnu n TYR 59 N -3.46 1.66 -4.25 3.45 4.02 0.92 -4.89 117.16 114.61 2dnu n TYR 59 Ca -0.01 -0.60 -0.17 0.00 -0.01 0.00 0.00 57.90 57.11 2dnu n TYR 59 Cb 0.35 -0.37 -0.14 0.00 -0.02 0.00 0.00 39.34 39.16 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 -2.15 2.06 -0.04 7.72 1.43 -0.86 -3.51 118.68 123.32 2dnu s LEU 60 Ca 0.48 -0.22 0.02 0.00 -1.03 0.00 0.00 54.13 53.39 2dnu s LEU 60 Cb 0.34 -0.37 0.01 0.00 0.03 0.00 0.00 46.19 46.20 2dnu s LEU 60 CO 0.18 0.05 -0.10 -1.59 0.23 0.00 0.00 176.35 175.11 2dnu s LYS 61 N -0.45 1.20 -0.11 1.70 -2.85 0.67 -4.91 119.74 114.99 2dnu s LYS 61 Ca 0.01 -0.33 -0.31 0.00 -1.00 0.00 0.00 55.97 54.34 2dnu s LYS 61 Cb -0.04 -1.07 -0.09 0.00 -2.06 0.00 0.00 37.83 34.57 2dnu s LYS 61 CO -0.00 0.07 2.06 1.17 0.10 0.00 0.00 175.35 178.75 2dnu n LYS 62 N 3.52 2.24 -0.35 1.78 0.00 -1.26 -1.02 118.16 123.06 2dnu n LYS 62 Ca -0.21 0.75 -0.29 0.00 0.00 0.00 0.00 58.31 58.56 2dnu n LYS 62 Cb 0.53 -2.95 0.27 0.00 0.00 0.00 0.00 35.03 32.89 2dnu n LYS 62 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.40 177.40 2dnu n ALA 63 N 8.92 -4.12 -3.65 3.14 0.00 -1.26 -4.91 120.51 118.63 2dnu n ALA 63 Ca 0.26 -1.60 -0.15 0.00 0.00 0.00 0.00 53.44 51.95 2dnu n ALA 63 Cb 0.38 -1.72 -0.14 0.00 0.00 0.00 0.00 19.45 17.96 2dnu n ALA 63 CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 177.50 177.65 2dnu s LYS 64 N -4.64 0.11 -0.60 0.00 -0.14 -1.26 -5.08 119.74 108.13 2dnu s LYS 64 Ca 0.66 0.64 -0.20 0.00 -1.36 0.00 0.00 55.97 55.72 2dnu s LYS 64 Cb -0.18 -0.21 0.10 0.00 -1.68 0.00 0.00 37.83 35.86 2dnu s LYS 64 CO 0.60 -0.32 0.74 0.34 -0.76 0.00 0.00 175.35 175.95 2dnu s ASP 65 N 2.37 6.18 -0.41 2.83 2.15 -1.26 -4.89 116.67 123.64 2dnu s ASP 65 Ca 0.02 -1.34 0.04 0.00 0.43 0.00 0.00 52.55 51.71 2dnu s ASP 65 Cb -0.12 -2.32 0.45 0.00 -0.30 0.00 0.00 42.92 40.63 2dnu s ASP 65 CO -0.08 -1.16 1.41 -1.54 -0.17 0.00 0.00 175.17 173.64 2dnu n SER 66 N 6.55 5.67 0.00 -0.34 3.41 -1.26 -4.90 113.62 122.76 2dnu n SER 66 Ca -0.08 -3.76 0.00 0.00 -0.26 0.00 0.00 58.87 54.77 2dnu n SER 66 Cb 0.43 -0.53 0.00 0.00 -0.26 0.00 0.00 64.21 63.85 2dnu n SER 66 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2dnu n GLY 67 N -0.74 -2.72 3.57 5.00 0.00 -1.26 -4.10 105.19 104.94 2dnu n GLY 67 Ca 0.49 0.13 -0.27 0.00 0.00 0.00 0.00 46.02 46.36 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 -0.66 2.53 -0.18 1.61 0.04 -1.26 -4.94 135.00 132.14 2dnu s PRO 68 Ca 0.00 -0.70 -0.29 0.00 0.04 0.00 0.00 61.00 60.04 2dnu s PRO 68 Cb 0.00 -5.15 -0.00 0.00 0.04 0.00 0.00 34.50 29.39 2dnu s PRO 68 CO 0.00 -3.66 1.07 0.45 0.04 0.00 0.00 177.00 174.91 2dnu s SER 69 N 7.31 7.11 -0.21 6.66 0.15 -1.26 -5.02 113.70 128.43 2dnu s SER 69 Ca 0.69 1.49 -0.09 0.00 0.70 0.00 0.00 55.95 58.74 2dnu s SER 69 Cb -0.04 -2.54 -0.04 0.00 -1.71 0.00 0.00 66.02 61.68 2dnu s SER 69 CO 0.06 -0.62 0.11 -0.44 1.20 0.00 0.00 173.24 173.55 2dnu s SER 70 N 1.30 5.85 0.00 5.45 0.01 -1.26 -5.25 113.70 119.79 2dnu s SER 70 Ca 0.47 0.08 0.06 0.00 1.31 0.00 0.00 55.95 57.88 2dnu s SER 70 Cb -0.17 -2.03 0.38 0.00 0.21 0.00 0.00 66.02 64.41 2dnu s SER 70 CO 0.11 0.11 0.85 0.61 0.41 0.00 0.00 173.24 175.33