#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2dnu s SER 2 N 0.00 5.09 -0.21 1.61 0.01 -1.26 -5.03 113.70 113.91 2dnu s SER 2 Ca 0.00 -2.90 -0.14 0.00 1.31 0.00 0.00 55.95 54.21 2dnu s SER 2 Cb 0.00 -1.82 0.06 0.00 0.21 0.00 0.00 66.02 64.47 2dnu s SER 2 CO 0.00 -0.34 0.53 -0.55 0.41 0.00 0.00 173.24 173.29 2dnu s SER 3 N 0.50 -0.65 0.00 2.44 0.15 -1.26 -5.10 113.70 109.78 2dnu s SER 3 Ca 0.17 1.13 0.00 0.00 0.70 0.00 0.00 55.95 57.95 2dnu s SER 3 Cb -0.21 1.06 0.00 0.00 -1.71 0.00 0.00 66.02 65.16 2dnu s SER 3 CO -0.03 -0.20 0.00 0.61 1.20 0.00 0.00 173.24 174.82 2dnu n GLY 4 N 3.77 0.59 4.35 9.45 0.00 -1.26 -4.98 105.19 117.10 2dnu n GLY 4 Ca -0.19 0.62 -0.38 0.00 0.00 0.00 0.00 46.02 46.07 2dnu n GLY 4 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 2dnu n SER 5 N 0.00 -2.11 0.14 1.61 3.41 -1.26 -4.83 113.62 110.58 2dnu n SER 5 Ca 0.00 -1.13 -0.14 0.00 -0.26 0.00 0.00 58.87 57.33 2dnu n SER 5 Cb 0.00 -2.21 -0.07 0.00 -0.26 0.00 0.00 64.21 61.67 2dnu n SER 5 CO 0.00 0.00 0.00 0.28 -0.16 0.00 0.00 175.04 175.16 2dnu h SER 6 N -1.30 -1.13 -2.49 4.04 0.02 -1.99 -3.32 113.55 107.38 2dnu h SER 6 Ca -0.60 0.12 -0.69 0.00 -0.84 0.00 0.00 61.79 59.78 2dnu h SER 6 Cb 1.39 0.42 -0.18 0.00 0.14 0.00 0.00 62.40 64.17 2dnu h SER 6 CO 0.81 -0.48 0.76 -0.83 -1.14 0.00 0.00 176.83 175.95 2dnu s GLY 7 N -2.35 1.90 -0.15 -3.77 0.00 -1.26 -4.82 107.32 96.87 2dnu s GLY 7 Ca -0.16 -2.68 -0.11 0.00 0.00 0.00 0.00 44.72 41.76 2dnu s GLY 7 CO 0.63 1.98 -0.21 1.18 0.00 0.00 0.00 173.10 176.68 2dnu n GLU 8 N 6.56 0.47 -3.70 2.90 1.02 -1.25 -4.92 120.64 121.72 2dnu n GLU 8 Ca 0.20 0.47 -0.28 0.00 -0.02 0.00 0.00 57.16 57.52 2dnu n GLU 8 Cb 0.48 -1.64 -0.16 0.00 -0.02 0.00 0.00 31.44 30.10 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 0.56 -0.42 3.49 0.41 -1.26 -5.07 118.70 114.05 2dnu s GLU 9 Ca -0.18 -0.54 -0.23 0.00 -0.41 0.00 0.00 54.97 53.62 2dnu s GLU 9 Cb 0.02 -1.95 0.02 0.00 -1.78 0.00 0.00 34.13 30.44 2dnu s GLU 9 CO 0.26 -0.76 0.77 0.15 -0.49 0.00 0.00 175.26 175.19 2dnu s LYS 10 N 1.86 3.53 0.33 1.61 1.02 -1.26 -0.99 119.74 125.83 2dnu s LYS 10 Ca 0.03 0.03 0.07 0.00 0.02 0.00 0.00 55.97 56.11 2dnu s LYS 10 Cb -0.17 -3.89 -0.02 0.00 -0.52 0.00 0.00 37.83 33.23 2dnu s LYS 10 CO -0.15 -1.01 0.34 0.71 -0.92 0.00 0.00 175.35 174.33 2dnu s TYR 11 N 3.18 3.00 0.06 3.18 1.51 -0.31 -2.33 117.35 125.65 2dnu s TYR 11 Ca 0.30 -0.26 0.09 0.00 -1.01 0.00 0.00 57.07 56.19 2dnu s TYR 11 Cb -0.13 -1.83 -0.03 0.00 -0.11 0.00 0.00 41.96 39.86 2dnu s TYR 11 CO 0.20 0.15 -0.26 0.08 -1.11 0.00 0.00 175.55 174.62 2dnu s VAL 12 N -2.24 2.10 -0.36 0.71 1.01 0.51 -0.22 120.40 121.90 2dnu s VAL 12 Ca 0.41 -1.45 -0.17 0.00 0.00 0.00 0.00 61.98 60.77 2dnu s VAL 12 Cb -0.07 -1.81 -0.00 0.00 0.00 0.00 0.00 36.38 34.49 2dnu s VAL 12 CO 0.28 0.28 0.44 0.42 0.00 0.00 0.00 175.10 176.51 2dnu s THR 13 N -0.87 5.09 -1.25 3.92 -4.23 -1.18 -0.42 115.64 116.70 2dnu s THR 13 Ca 0.12 0.06 0.27 0.00 -1.18 0.00 0.00 61.69 60.96 2dnu s THR 13 Cb -0.10 -3.93 0.21 0.00 1.34 0.00 0.00 72.50 70.02 2dnu s THR 13 CO 0.03 -0.22 1.68 1.33 -0.54 0.00 0.00 174.62 176.90 2dnu n VAL 14 N 5.36 0.00 -3.74 2.29 0.24 -1.24 -1.09 118.33 120.15 2dnu n VAL 14 Ca -0.07 -0.03 -0.13 0.00 -2.04 0.00 0.00 64.34 62.07 2dnu n VAL 14 Cb 0.49 -0.01 -0.09 0.00 -1.47 0.00 0.00 33.84 32.75 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 -2.81 0.58 0.60 7.34 -0.21 -1.26 -4.84 119.66 119.05 2dnu s GLN 15 Ca 0.18 0.17 -0.17 0.00 0.02 0.00 0.00 55.36 55.55 2dnu s GLN 15 Cb 0.19 0.27 -0.03 0.00 1.00 0.00 0.00 33.01 34.43 2dnu s GLN 15 CO 0.58 -0.13 1.12 -1.25 -2.12 0.00 0.00 175.29 173.49 2dnu s PRO 16 N -0.59 3.09 -0.04 2.91 0.04 -1.26 -4.51 135.00 134.63 2dnu s PRO 16 Ca -0.07 1.51 0.01 0.00 0.04 0.00 0.00 61.00 62.49 2dnu s PRO 16 Cb -0.04 -1.98 0.02 0.00 0.04 0.00 0.00 34.50 32.54 2dnu s PRO 16 CO 0.03 -1.04 -0.06 -0.47 0.04 0.00 0.00 177.00 175.50 2dnu s TYR 17 N -2.04 0.80 -0.40 0.56 5.04 -0.03 -4.96 117.35 116.32 2dnu s TYR 17 Ca 0.70 -0.22 -0.15 0.00 -2.44 0.00 0.00 57.07 54.96 2dnu s TYR 17 Cb -0.22 -0.66 0.01 0.00 0.35 0.00 0.00 41.96 41.44 2dnu s TYR 17 CO 0.34 -0.16 0.32 0.99 -1.34 0.00 0.00 175.55 175.69 2dnu s THR 18 N 0.67 5.23 0.13 4.34 2.01 -1.26 -1.92 115.64 124.84 2dnu s THR 18 Ca -0.09 -0.50 -0.30 0.00 0.31 0.00 0.00 61.69 61.11 2dnu s THR 18 Cb -0.13 -3.91 -0.07 0.00 0.01 0.00 0.00 72.50 68.41 2dnu s THR 18 CO 0.01 -0.27 1.16 -0.94 -0.69 0.00 0.00 174.62 173.88 2dnu s SER 19 N 1.71 7.16 -0.05 3.53 1.04 -1.26 -4.88 113.70 120.94 2dnu s SER 19 Ca 0.07 2.08 0.13 0.00 0.48 0.00 0.00 55.95 58.70 2dnu s SER 19 Cb -0.18 -2.59 -0.23 0.00 0.10 0.00 0.00 66.02 63.11 2dnu s SER 19 CO 0.11 -0.35 0.63 0.00 0.98 0.00 0.00 173.24 174.60 2dnu n GLN 20 N 3.04 0.64 -3.73 4.02 1.13 -1.26 -4.88 117.38 116.33 2dnu n GLN 20 Ca 0.06 0.28 -0.10 0.00 -1.94 0.00 0.00 57.00 55.30 2dnu n GLN 20 Cb 0.46 -1.78 -0.04 0.00 0.11 0.00 0.00 30.24 28.99 2dnu n GLN 20 CO 0.00 0.00 0.00 -1.12 -1.44 0.00 0.00 177.06 174.50 2dnu s SER 21 N -6.07 -0.23 0.13 1.08 0.01 -1.26 -5.04 113.70 102.31 2dnu s SER 21 Ca -0.05 -0.48 -0.24 0.00 1.31 0.00 0.00 55.95 56.48 2dnu s SER 21 Cb 0.08 0.55 -0.04 0.00 0.21 0.00 0.00 66.02 66.81 2dnu s SER 21 CO 0.82 -1.00 1.24 0.29 0.41 0.00 0.00 173.24 175.00 2dnu n LYS 22 N -0.31 -0.35 -0.24 12.44 4.01 -1.26 0.11 118.16 132.57 2dnu n LYS 22 Ca -0.11 1.21 0.17 0.00 -0.51 0.00 0.00 58.31 59.07 2dnu n LYS 22 Cb 0.63 -1.78 0.32 0.00 -0.51 0.00 0.00 35.03 33.69 2dnu n LYS 22 CO 0.00 0.00 0.00 -0.40 -1.11 0.00 0.00 177.40 175.89 2dnu n ASP 23 N -5.01 0.09 -4.92 4.39 5.75 -1.26 -4.20 116.55 111.39 2dnu n ASP 23 Ca 0.02 1.21 -0.30 0.00 -0.01 0.00 0.00 54.79 55.71 2dnu n ASP 23 Cb 0.21 -0.52 -0.04 0.00 -1.03 0.00 0.00 41.12 39.75 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 -5.36 3.49 -0.05 0.11 2.02 0.30 -0.16 118.70 119.05 2dnu s GLU 24 Ca -0.08 -0.37 0.05 0.00 0.02 0.00 0.00 54.97 54.59 2dnu s GLU 24 Cb 0.23 -2.95 -0.01 0.00 0.10 0.00 0.00 34.13 31.50 2dnu s GLU 24 CO 0.56 0.53 -0.22 -1.50 0.02 0.00 0.00 175.26 174.66 2dnu s ILE 25 N -1.64 1.78 -0.16 -1.63 2.07 -1.25 -4.52 121.20 115.86 2dnu s ILE 25 Ca 0.37 -0.91 -0.07 0.00 -1.41 0.00 0.00 60.65 58.63 2dnu s ILE 25 Cb -0.12 -1.52 -0.04 0.00 0.13 0.00 0.00 42.46 40.91 2dnu s ILE 25 CO 0.27 0.50 0.09 -0.83 -1.91 0.00 0.00 174.94 173.06 2dnu s GLY 26 N -0.05 1.99 0.19 1.50 0.00 -1.26 -4.47 107.32 105.23 2dnu s GLY 26 Ca -0.04 -0.71 -0.00 0.00 0.00 0.00 0.00 44.72 43.96 2dnu s GLY 26 CO 0.03 -0.11 0.09 -0.11 0.00 0.00 0.00 173.10 173.00 2dnu s PHE 27 N -0.13 1.18 0.55 1.90 -0.12 -0.81 -4.89 117.98 115.66 2dnu s PHE 27 Ca 0.08 -1.26 0.04 0.00 -0.05 0.00 0.00 56.93 55.74 2dnu s PHE 27 Cb -0.12 -0.63 0.06 0.00 -0.63 0.00 0.00 43.02 41.70 2dnu s PHE 27 CO 0.01 -0.50 0.77 -1.21 -0.05 0.00 0.00 175.22 174.24 2dnu s GLU 28 N -4.08 2.41 -0.32 1.99 2.02 -1.26 -0.85 118.70 118.61 2dnu s GLU 28 Ca 0.34 -1.14 -0.19 0.00 0.02 0.00 0.00 54.97 54.00 2dnu s GLU 28 Cb 0.07 -2.56 -0.01 0.00 0.10 0.00 0.00 34.13 31.73 2dnu s GLU 28 CO 0.09 -0.77 0.55 0.21 0.02 0.00 0.00 175.26 175.37 2dnu s LYS 29 N -4.71 3.80 0.00 1.61 2.20 -1.26 -4.14 119.74 117.24 2dnu s LYS 29 Ca 0.59 0.08 0.00 0.00 -0.36 0.00 0.00 55.97 56.29 2dnu s LYS 29 Cb -0.08 -3.75 0.00 0.00 -1.51 0.00 0.00 37.83 32.48 2dnu s LYS 29 CO 0.38 -0.57 0.00 0.41 -0.36 0.00 0.00 175.35 175.22 2dnu n GLY 30 N 4.61 1.91 3.21 5.54 0.00 -0.25 -4.95 105.19 115.25 2dnu n GLY 30 Ca -0.03 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.72 2dnu n GLY 30 CO 0.00 0.00 0.00 3.33 0.00 0.00 0.00 173.32 176.65 2dnu n VAL 31 N -0.26 0.00 -4.93 1.61 0.24 -1.26 -4.99 118.33 108.75 2dnu n VAL 31 Ca 0.00 -2.02 -0.33 0.00 -2.04 0.00 0.00 64.34 59.96 2dnu n VAL 31 Cb 0.00 0.24 -0.14 0.00 -1.47 0.00 0.00 33.84 32.47 2dnu n VAL 31 CO 0.00 0.00 0.00 -0.89 -2.14 0.00 0.00 176.83 173.80 2dnu s THR 32 N -2.51 2.89 0.29 3.34 2.01 -1.26 -3.12 115.64 117.27 2dnu s THR 32 Ca 0.10 -0.77 0.06 0.00 0.31 0.00 0.00 61.69 61.39 2dnu s THR 32 Cb -0.01 -2.14 -0.06 0.00 0.01 0.00 0.00 72.50 70.30 2dnu s THR 32 CO 0.06 0.57 -0.03 0.68 -0.69 0.00 0.00 174.62 175.22 2dnu s VAL 33 N -0.35 1.51 -0.22 3.82 -7.23 0.69 -4.92 120.40 113.70 2dnu s VAL 33 Ca 0.03 -2.08 0.01 0.00 -1.81 0.00 0.00 61.98 58.13 2dnu s VAL 33 Cb -0.12 -2.54 0.05 0.00 0.56 0.00 0.00 36.38 34.33 2dnu s VAL 33 CO 0.02 -0.23 -0.11 -1.61 -0.31 0.00 0.00 175.10 172.87 2dnu s GLU 34 N -3.77 2.14 -0.37 4.82 2.02 -1.20 -1.16 118.70 121.18 2dnu s GLU 34 Ca 0.31 -1.02 -0.29 0.00 0.02 0.00 0.00 54.97 54.00 2dnu s GLU 34 Cb 0.05 -2.60 0.01 0.00 0.10 0.00 0.00 34.13 31.69 2dnu s GLU 34 CO 0.13 -0.47 1.30 0.08 0.02 0.00 0.00 175.26 176.31 2dnu s VAL 35 N 1.29 4.10 -0.13 2.63 1.01 -0.17 -1.58 120.40 127.55 2dnu s VAL 35 Ca -0.04 1.19 -0.08 0.00 0.00 0.00 0.00 61.98 63.05 2dnu s VAL 35 Cb -0.17 -4.26 -0.03 0.00 0.00 0.00 0.00 36.38 31.92 2dnu s VAL 35 CO -0.07 -0.66 -0.15 0.40 0.00 0.00 0.00 175.10 174.61 2dnu h ILE 36 N 6.16 0.00 -2.92 2.22 2.04 -0.77 -3.38 117.51 120.86 2dnu h ILE 36 Ca -0.26 -1.00 -0.56 0.00 1.00 0.00 0.00 64.86 64.05 2dnu h ILE 36 Cb 1.09 0.00 -0.16 0.00 -0.74 0.00 0.00 36.82 37.01 2dnu h ILE 36 CO 1.07 0.00 -0.78 -0.13 0.00 0.00 0.00 178.15 178.31 2dnu s ARG 37 N -2.15 1.44 -0.11 2.37 0.52 -1.08 -5.01 118.95 114.93 2dnu s ARG 37 Ca -0.13 -1.56 0.02 0.00 -0.52 0.00 0.00 55.73 53.55 2dnu s ARG 37 Cb 0.02 -1.51 0.01 0.00 0.52 0.00 0.00 34.95 33.99 2dnu s ARG 37 CO 0.19 0.30 -0.19 0.15 0.02 0.00 0.00 175.30 175.77 2dnu s LYS 38 N -3.10 2.57 0.54 3.54 1.02 -1.26 -1.91 119.74 121.13 2dnu s LYS 38 Ca 0.22 -0.70 0.07 0.00 0.02 0.00 0.00 55.97 55.58 2dnu s LYS 38 Cb -0.05 -2.08 0.07 0.00 -0.52 0.00 0.00 37.83 35.25 2dnu s LYS 38 CO 0.09 0.01 0.57 -1.71 -0.92 0.00 0.00 175.35 173.40 2dnu n ASN 39 N 3.98 2.35 -0.01 2.83 5.15 -0.35 -5.02 115.26 124.19 2dnu n ASN 39 Ca -0.20 -2.64 0.07 0.00 -0.60 0.00 0.00 54.58 51.21 2dnu n ASN 39 Cb 0.52 -0.22 -0.10 0.00 -0.53 0.00 0.00 39.78 39.45 2dnu n ASN 39 CO 0.00 0.00 0.00 0.18 1.40 0.00 0.00 177.26 178.84 2dnu n LEU 40 N 0.00 0.05 -2.62 1.20 4.77 -1.26 -4.58 117.00 114.55 2dnu n LEU 40 Ca 0.07 -0.04 -0.31 0.00 -0.03 0.00 0.00 56.01 55.70 2dnu n LEU 40 Cb 0.58 0.00 -0.02 0.00 -2.33 0.00 0.00 43.42 41.65 2dnu n LEU 40 CO 0.36 0.01 1.57 -0.62 -1.33 0.00 0.00 177.39 177.38 2dnu n GLU 41 N -1.91 2.51 -4.02 3.23 4.71 -1.26 -4.80 120.64 119.10 2dnu n GLU 41 Ca -0.02 -2.73 -0.29 0.00 -0.01 0.00 0.00 57.16 54.11 2dnu n GLU 41 Cb 0.33 -2.18 -0.02 0.00 -1.01 0.00 0.00 31.44 28.57 2dnu n GLU 41 CO 0.00 0.00 0.00 0.41 0.09 0.00 0.00 177.13 177.63 2dnu n GLY 42 N 0.39 -0.31 2.70 0.62 0.00 -1.26 -4.95 105.19 102.38 2dnu n GLY 42 Ca 0.50 0.15 -0.28 0.00 0.00 0.00 0.00 46.02 46.40 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 -3.70 0.88 -0.33 1.61 0.23 -1.26 -3.90 118.94 112.48 2dnu s TRP 43 Ca 0.28 -0.81 -0.01 0.00 -2.03 0.00 0.00 56.10 53.54 2dnu s TRP 43 Cb -0.15 -1.00 0.07 0.00 0.03 0.00 0.00 33.47 32.43 2dnu s TRP 43 CO 0.89 -0.62 0.04 -1.58 0.96 0.00 0.00 176.95 176.65 2dnu s TRP 44 N 1.91 3.41 -0.07 -1.98 0.52 -0.68 -1.22 118.94 120.83 2dnu s TRP 44 Ca 0.01 -2.22 -0.29 0.00 0.02 0.00 0.00 56.10 53.61 2dnu s TRP 44 Cb -0.17 -2.47 -0.07 0.00 -1.15 0.00 0.00 33.47 29.61 2dnu s TRP 44 CO -0.10 -0.87 1.93 -0.47 0.02 0.00 0.00 176.95 177.45 2dnu s TYR 45 N 1.16 1.47 0.32 -1.98 5.04 -0.80 -3.44 117.35 119.11 2dnu s TYR 45 Ca -0.00 0.00 0.06 0.00 -2.44 0.00 0.00 57.07 54.69 2dnu s TYR 45 Cb -0.20 -4.09 -0.06 0.00 0.35 0.00 0.00 41.96 37.95 2dnu s TYR 45 CO -0.03 -4.61 -0.01 0.96 -1.34 0.00 0.00 175.55 170.52 2dnu s ILE 46 N 5.40 1.56 -0.13 3.14 -4.36 -1.08 -0.03 121.20 125.71 2dnu s ILE 46 Ca 0.87 -2.07 0.01 0.00 -0.26 0.00 0.00 60.65 59.20 2dnu s ILE 46 Cb -0.36 -2.65 0.02 0.00 1.25 0.00 0.00 42.46 40.72 2dnu s ILE 46 CO 0.37 -0.15 -0.13 -0.60 0.24 0.00 0.00 174.94 174.66 2dnu s ARG 47 N -3.78 2.06 -0.04 0.37 3.52 -0.61 -1.99 118.95 118.49 2dnu s ARG 47 Ca 0.33 -0.48 0.01 0.00 -0.13 0.00 0.00 55.73 55.46 2dnu s ARG 47 Cb 0.06 -1.89 0.02 0.00 -1.56 0.00 0.00 34.95 31.58 2dnu s ARG 47 CO 0.14 -0.19 -0.05 -0.47 -0.81 0.00 0.00 175.30 173.92 2dnu s TYR 48 N 1.38 0.78 -1.38 5.12 5.04 -0.31 -3.24 117.35 124.75 2dnu s TYR 48 Ca 0.01 -0.22 -0.07 0.00 -2.44 0.00 0.00 57.07 54.36 2dnu s TYR 48 Cb -0.13 -0.66 0.01 0.00 0.35 0.00 0.00 41.96 41.52 2dnu s TYR 48 CO -0.07 -0.18 0.87 1.28 -1.34 0.00 0.00 175.55 176.11 2dnu n LEU 49 N 3.91 -3.01 -2.30 6.97 4.77 -1.26 -2.10 117.00 123.97 2dnu n LEU 49 Ca -0.24 -0.40 -0.17 0.00 -0.03 0.00 0.00 56.01 55.17 2dnu n LEU 49 Cb 0.51 -2.88 0.03 0.00 -2.33 0.00 0.00 43.42 38.75 2dnu n LEU 49 CO 0.24 0.44 -0.00 0.61 -1.33 0.00 0.00 177.39 177.35 2dnu n GLY 50 N -1.73 -0.21 2.77 -0.72 0.00 -1.26 -5.01 105.19 99.03 2dnu n GLY 50 Ca -0.05 -0.10 -0.16 0.00 0.00 0.00 0.00 46.02 45.71 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 -5.40 -0.02 -0.21 1.61 2.20 -0.89 -5.13 119.74 111.89 2dnu s LYS 51 Ca 0.23 0.32 -0.14 0.00 -0.36 0.00 0.00 55.97 56.01 2dnu s LYS 51 Cb -0.10 -0.32 -0.04 0.00 -1.51 0.00 0.00 37.83 35.86 2dnu s LYS 51 CO 0.28 -0.23 0.33 -1.21 -0.36 0.00 0.00 175.35 174.16 2dnu s GLU 52 N 1.55 4.14 0.16 4.03 2.02 -1.26 -1.16 118.70 128.18 2dnu s GLU 52 Ca -0.04 0.07 -0.00 0.00 0.02 0.00 0.00 54.97 55.02 2dnu s GLU 52 Cb -0.12 -3.54 0.00 0.00 0.10 0.00 0.00 34.13 30.57 2dnu s GLU 52 CO -0.04 -0.02 0.22 0.41 0.02 0.00 0.00 175.26 175.85 2dnu n GLY 53 N 4.03 2.77 3.57 -1.39 0.00 -0.84 -4.91 105.19 108.41 2dnu n GLY 53 Ca -0.10 -1.53 -0.37 0.00 0.00 0.00 0.00 46.02 44.02 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 -3.85 3.20 0.03 1.61 0.52 0.77 -2.63 118.94 118.59 2dnu s TRP 54 Ca 0.14 0.01 0.06 0.00 0.02 0.00 0.00 56.10 56.33 2dnu s TRP 54 Cb -0.00 -2.33 -0.02 0.00 -1.15 0.00 0.00 33.47 29.96 2dnu s TRP 54 CO 0.10 -0.17 -0.17 0.00 0.02 0.00 0.00 176.95 176.73 2dnu s ALA 55 N 1.63 1.43 0.08 0.98 0.00 -1.22 -3.76 121.76 120.91 2dnu s ALA 55 Ca 0.07 -0.88 -0.31 0.00 0.00 0.00 0.00 51.96 50.84 2dnu s ALA 55 Cb -0.15 -0.28 -0.07 0.00 0.00 0.00 0.00 23.12 22.62 2dnu s ALA 55 CO 0.09 0.31 1.38 -1.25 0.00 0.00 0.00 175.76 176.29 2dnu s PRO 56 N -0.98 4.32 0.42 0.00 0.04 -1.26 -1.69 135.00 135.85 2dnu s PRO 56 Ca 0.05 2.03 0.28 0.00 0.04 0.00 0.00 61.00 63.39 2dnu s PRO 56 Cb -0.08 -3.33 1.51 0.00 0.04 0.00 0.00 34.50 32.63 2dnu s PRO 56 CO 0.01 -0.45 1.85 0.00 0.04 0.00 0.00 177.00 178.44 2dnu h ALA 57 N 7.06 1.01 0.00 8.56 0.00 -1.90 -0.26 119.26 133.73 2dnu h ALA 57 Ca -0.41 0.00 -0.06 0.00 0.00 0.00 0.00 54.91 54.44 2dnu h ALA 57 Cb 1.20 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 18.98 2dnu h ALA 57 CO 0.87 -0.01 -0.29 0.77 0.00 0.00 0.00 179.25 180.59 2dnu h SER 58 N 0.00 0.00 -0.62 0.00 0.02 -1.90 -2.73 113.55 108.32 2dnu h SER 58 Ca 0.00 0.00 -0.11 0.00 -0.84 0.00 0.00 61.79 60.84 2dnu h SER 58 Cb 0.02 0.00 -0.06 0.00 0.14 0.00 0.00 62.40 62.50 2dnu h SER 58 CO 0.00 0.29 0.13 -1.22 -1.14 0.00 0.00 176.83 174.89 2dnu n TYR 59 N -3.50 2.15 -3.96 3.45 4.02 -0.11 -4.91 117.16 114.31 2dnu n TYR 59 Ca -0.00 -0.99 -0.14 0.00 -0.01 0.00 0.00 57.90 56.75 2dnu n TYR 59 Cb 0.45 -0.58 -0.15 0.00 -0.02 0.00 0.00 39.34 39.04 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 -2.90 1.77 -0.04 7.72 1.43 -1.03 -3.65 118.68 121.98 2dnu s LEU 60 Ca 0.54 -0.03 0.01 0.00 -1.03 0.00 0.00 54.13 53.62 2dnu s LEU 60 Cb 0.42 -0.13 0.02 0.00 0.03 0.00 0.00 46.19 46.53 2dnu s LEU 60 CO 0.14 -0.01 -0.06 -1.59 0.23 0.00 0.00 176.35 175.06 2dnu s LYS 61 N 0.25 0.88 -0.01 1.70 -2.85 0.44 -4.90 119.74 115.25 2dnu s LYS 61 Ca -0.02 -0.17 -0.32 0.00 -1.00 0.00 0.00 55.97 54.46 2dnu s LYS 61 Cb -0.04 -0.85 -0.10 0.00 -2.06 0.00 0.00 37.83 34.78 2dnu s LYS 61 CO -0.01 -0.02 1.92 1.17 0.10 0.00 0.00 175.35 178.52 2dnu n LYS 62 N 3.79 2.56 -2.02 1.78 3.00 -1.26 -0.36 118.16 125.64 2dnu n LYS 62 Ca -0.23 0.94 -0.41 0.00 -0.00 0.00 0.00 58.31 58.61 2dnu n LYS 62 Cb 0.52 -2.84 -0.02 0.00 0.00 0.00 0.00 35.03 32.69 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 6.98 3.96 -3.44 3.14 0.00 -0.98 -4.81 120.51 125.35 2dnu n ALA 63 Ca 0.21 -3.67 -0.34 0.00 0.00 0.00 0.00 53.44 49.63 2dnu n ALA 63 Cb 0.35 -3.57 -0.05 0.00 0.00 0.00 0.00 19.45 16.18 2dnu n ALA 63 CO 0.00 0.00 0.00 0.36 0.00 0.00 0.00 177.50 177.86 2dnu n LYS 64 N 7.40 2.99 -1.69 0.00 2.85 -1.26 -4.96 118.16 123.49 2dnu n LYS 64 Ca 0.50 -4.56 -0.53 0.00 -1.05 0.00 0.00 58.31 52.67 2dnu n LYS 64 Cb 0.43 -2.38 -0.06 0.00 -0.65 0.00 0.00 35.03 32.37 2dnu n LYS 64 CO 0.00 0.00 0.00 -3.47 -0.05 0.00 0.00 177.40 173.88 2dnu n ASP 65 N 1.61 2.93 -4.13 -5.58 -0.08 -1.26 -4.95 116.55 105.09 2dnu n ASP 65 Ca 0.25 1.00 -0.10 0.00 -1.51 0.00 0.00 54.79 54.44 2dnu n ASP 65 Cb 0.37 -1.26 -0.10 0.00 2.34 0.00 0.00 41.12 42.47 2dnu n ASP 65 CO 0.00 0.00 0.00 -0.55 0.12 0.00 0.00 177.20 176.77 2dnu s SER 66 N 3.95 0.90 0.55 1.67 0.15 -1.26 -5.17 113.70 114.49 2dnu s SER 66 Ca 0.96 -0.94 0.08 0.00 0.70 0.00 0.00 55.95 56.75 2dnu s SER 66 Cb -0.87 0.12 0.08 0.00 -1.71 0.00 0.00 66.02 63.63 2dnu s SER 66 CO 0.58 -0.47 0.66 0.61 1.20 0.00 0.00 173.24 175.83 2dnu n GLY 67 N 0.22 2.21 0.21 9.45 0.00 -1.26 -5.03 105.19 110.99 2dnu n GLY 67 Ca -0.14 -2.25 -0.05 0.00 0.00 0.00 0.00 46.02 43.58 2dnu n GLY 67 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2dnu h PRO 68 N 0.00 0.41 -7.19 1.61 0.13 -2.04 -3.45 132.00 121.48 2dnu h PRO 68 Ca -0.29 -0.22 -0.47 0.00 -0.87 0.00 0.00 66.00 64.15 2dnu h PRO 68 Cb 1.22 0.01 0.02 0.00 0.13 0.00 0.00 31.00 32.37 2dnu h PRO 68 CO 0.42 0.78 0.37 0.45 -0.23 0.00 0.00 178.00 179.79 2dnu s SER 69 N -6.87 6.61 -0.26 1.44 0.15 -1.26 -5.03 113.70 108.48 2dnu s SER 69 Ca -0.06 1.55 -0.17 0.00 0.70 0.00 0.00 55.95 57.97 2dnu s SER 69 Cb 0.13 -2.50 -0.03 0.00 -1.71 0.00 0.00 66.02 61.90 2dnu s SER 69 CO 0.80 -0.59 0.49 -0.44 1.20 0.00 0.00 173.24 174.70 2dnu s SER 70 N -3.09 6.40 0.00 5.45 0.01 -1.26 -5.14 113.70 116.06 2dnu s SER 70 Ca 0.59 0.47 0.00 0.00 1.31 0.00 0.00 55.95 58.32 2dnu s SER 70 Cb -0.10 -2.27 0.00 0.00 0.21 0.00 0.00 66.02 63.86 2dnu s SER 70 CO 0.32 -0.27 0.00 0.61 0.41 0.00 0.00 173.24 174.31