#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1aey s LYS 6 N 0.00 1.50 0.82 1.61 3.01 -1.26 -4.92 119.74 120.50 1aey s LYS 6 Ca 0.00 -0.34 -0.12 0.00 -1.01 0.00 0.00 55.97 54.50 1aey s LYS 6 Cb 0.00 -1.28 0.09 0.00 -1.01 0.00 0.00 37.83 35.63 1aey s LYS 6 CO 0.00 -0.00 1.18 -1.21 0.51 0.00 0.00 175.35 175.83 1aey s GLU 7 N 0.73 1.89 -0.00 1.68 2.02 -0.13 -4.77 118.70 120.12 1aey s GLU 7 Ca -0.14 0.11 0.04 0.00 0.02 0.00 0.00 54.97 55.00 1aey s GLU 7 Cb -0.15 -1.94 -0.03 0.00 0.10 0.00 0.00 34.13 32.10 1aey s GLU 7 CO 0.03 -1.65 -0.09 -0.51 0.02 0.00 0.00 175.26 173.06 1aey s LEU 8 N -5.61 3.07 0.01 1.80 2.01 -1.26 0.77 118.68 119.46 1aey s LEU 8 Ca 0.62 -0.17 0.02 0.00 0.01 0.00 0.00 54.13 54.61 1aey s LEU 8 Cb -0.11 -1.75 -0.01 0.00 0.01 0.00 0.00 46.19 44.33 1aey s LEU 8 CO 0.49 0.29 -0.07 0.68 1.01 0.00 0.00 176.35 178.76 1aey s VAL 9 N -0.95 0.51 -0.13 -1.59 -7.23 -0.36 -1.25 120.40 109.40 1aey s VAL 9 Ca 0.16 -0.46 -0.16 0.00 -1.81 0.00 0.00 61.98 59.70 1aey s VAL 9 Cb -0.11 -0.47 -0.04 0.00 0.56 0.00 0.00 36.38 36.32 1aey s VAL 9 CO 0.06 0.01 0.40 -0.22 -0.31 0.00 0.00 175.10 175.04 1aey s LEU 10 N -0.50 4.27 0.17 1.32 2.96 0.64 -0.19 118.68 127.36 1aey s LEU 10 Ca -0.00 0.70 -0.30 0.00 -0.22 0.00 0.00 54.13 54.30 1aey s LEU 10 Cb -0.04 -2.56 -0.07 0.00 0.50 0.00 0.00 46.19 44.02 1aey s LEU 10 CO -0.00 0.06 0.96 0.00 -1.32 0.00 0.00 176.35 176.05 1aey s ALA 11 N 0.45 3.29 -0.14 5.97 0.00 0.31 -0.74 121.76 130.90 1aey s ALA 11 Ca 0.22 0.61 0.10 0.00 0.00 0.00 0.00 51.96 52.89 1aey s ALA 11 Cb -0.14 -3.25 -0.16 0.00 0.00 0.00 0.00 23.12 19.56 1aey s ALA 11 CO 0.08 0.07 0.01 1.28 0.00 0.00 0.00 175.76 177.19 1aey n LEU 12 N 2.21 0.54 -4.12 0.00 4.77 0.16 -0.97 117.00 119.59 1aey n LEU 12 Ca 0.00 -0.02 -0.13 0.00 -0.03 0.00 0.00 56.01 55.84 1aey n LEU 12 Cb 0.48 0.17 -0.11 0.00 -2.33 0.00 0.00 43.42 41.63 1aey n LEU 12 CO 0.51 0.42 -0.40 -0.31 -1.33 0.00 0.00 177.39 176.28 1aey s TYR 13 N -2.34 0.84 -0.91 -1.77 1.51 -1.24 -4.82 117.35 108.62 1aey s TYR 13 Ca -0.10 -0.64 -0.24 0.00 -1.01 0.00 0.00 57.07 55.08 1aey s TYR 13 Cb 0.04 -0.48 0.04 0.00 -0.11 0.00 0.00 41.96 41.45 1aey s TYR 13 CO 0.54 -0.08 1.44 -0.51 -1.11 0.00 0.00 175.55 175.83 1aey s ASP 14 N -2.14 6.28 -0.22 2.29 1.01 -1.26 -3.63 116.67 118.99 1aey s ASP 14 Ca -0.01 -1.04 -0.20 0.00 0.71 0.00 0.00 52.55 52.02 1aey s ASP 14 Cb -0.05 -2.57 -0.03 0.00 1.01 0.00 0.00 42.92 41.29 1aey s ASP 14 CO -0.01 -1.71 0.58 -0.47 0.21 0.00 0.00 175.17 173.77 1aey s TYR 15 N 5.64 3.33 -0.05 4.23 5.04 0.01 -4.90 117.35 130.65 1aey s TYR 15 Ca 0.45 0.81 -0.13 0.00 -2.44 0.00 0.00 57.07 55.76 1aey s TYR 15 Cb -0.03 -2.76 -0.05 0.00 0.35 0.00 0.00 41.96 39.47 1aey s TYR 15 CO -0.01 -0.21 0.35 -0.65 -1.34 0.00 0.00 175.55 173.69 1aey s GLN 16 N 2.04 3.90 0.64 4.97 1.11 -1.26 -0.57 119.66 130.49 1aey s GLN 16 Ca 0.26 0.27 -0.17 0.00 0.01 0.00 0.00 55.36 55.72 1aey s GLN 16 Cb -0.16 -3.26 -0.09 0.00 -1.01 0.00 0.00 33.01 28.50 1aey s GLN 16 CO 0.09 0.61 0.28 -0.85 0.01 0.00 0.00 175.29 175.44 1aey n GLU 17 N 2.21 0.28 -0.03 2.91 0.28 -1.26 -4.86 120.64 120.18 1aey n GLU 17 Ca -0.14 0.12 -0.04 0.00 -0.16 0.00 0.00 57.16 56.94 1aey n GLU 17 Cb 0.53 -1.54 -0.03 0.00 1.43 0.00 0.00 31.44 31.83 1aey n GLU 17 CO 0.00 0.00 0.00 1.63 -0.16 0.00 0.00 177.13 178.60 1aey n LYS 18 N 0.24 0.58 -4.42 3.44 4.76 -1.26 -4.97 118.16 116.53 1aey n LYS 18 Ca 0.09 0.03 -0.22 0.00 -2.87 0.00 0.00 58.31 55.34 1aey n LYS 18 Cb 0.49 -1.11 -0.09 0.00 -1.84 0.00 0.00 35.03 32.48 1aey n LYS 18 CO 0.00 0.00 0.00 -1.12 -1.37 0.00 0.00 177.40 174.91 1aey s SER 19 N -4.39 2.15 0.43 4.39 0.01 -1.26 -5.04 113.70 109.98 1aey s SER 19 Ca -0.07 -1.61 0.14 0.00 1.31 0.00 0.00 55.95 55.73 1aey s SER 19 Cb 0.02 0.41 1.03 0.00 0.21 0.00 0.00 66.02 67.68 1aey s SER 19 CO 0.13 -0.90 1.95 -0.65 0.41 0.00 0.00 173.24 174.19 1aey h PRO 20 N 2.02 0.41 0.02 12.44 0.11 -2.03 -2.18 132.00 142.79 1aey h PRO 20 Ca -0.34 -0.02 -0.21 0.00 0.11 0.00 0.00 66.00 65.53 1aey h PRO 20 Cb 1.26 -0.09 -0.02 0.00 0.11 0.00 0.00 31.00 32.25 1aey h PRO 20 CO 0.54 0.27 -1.00 0.07 -0.21 0.00 0.00 178.00 177.67 1aey h ARG 21 N 0.43 0.05 -7.24 1.05 0.11 -1.97 -3.45 114.38 103.37 1aey h ARG 21 Ca 0.32 -0.08 -0.48 0.00 0.10 0.00 0.00 59.98 59.83 1aey h ARG 21 Cb 0.66 0.03 0.04 0.00 1.11 0.00 0.00 29.97 31.80 1aey h ARG 21 CO -0.09 1.01 0.39 -1.21 0.10 0.00 0.00 179.97 180.16 1aey s GLU 22 N -2.79 3.75 0.05 0.08 8.01 -0.82 -1.04 118.70 125.94 1aey s GLU 22 Ca -0.00 0.94 0.03 0.00 0.01 0.00 0.00 54.97 55.95 1aey s GLU 22 Cb 0.10 -2.10 -0.03 0.00 -4.31 0.00 0.00 34.13 27.79 1aey s GLU 22 CO 0.83 -0.44 -0.09 0.14 0.01 0.00 0.00 175.26 175.70 1aey s VAL 23 N -2.75 0.70 0.36 2.63 -7.23 -0.98 -4.71 120.40 108.42 1aey s VAL 23 Ca 0.59 -1.18 -0.25 0.00 -1.81 0.00 0.00 61.98 59.33 1aey s VAL 23 Cb -0.11 -0.78 -0.10 0.00 0.56 0.00 0.00 36.38 35.95 1aey s VAL 23 CO 0.38 -0.36 0.95 -0.89 -0.31 0.00 0.00 175.10 174.87 1aey s THR 24 N -1.45 4.22 0.11 5.32 2.01 -1.26 -4.05 115.64 120.53 1aey s THR 24 Ca -0.07 1.70 -0.11 0.00 0.31 0.00 0.00 61.69 63.52 1aey s THR 24 Cb -0.09 -3.87 0.01 0.00 0.01 0.00 0.00 72.50 68.55 1aey s THR 24 CO 0.01 0.01 0.26 0.00 -0.69 0.00 0.00 174.62 174.21 1aey s MET 25 N -2.39 0.94 0.27 4.92 0.23 0.26 -4.92 119.30 118.60 1aey s MET 25 Ca 0.54 -0.90 0.07 0.00 -1.03 0.00 0.00 55.69 54.38 1aey s MET 25 Cb -0.16 0.38 -0.03 0.00 -1.53 0.00 0.00 34.83 33.49 1aey s MET 25 CO 0.21 -0.33 0.21 0.15 -2.03 0.00 0.00 175.02 173.23 1aey s LYS 26 N -3.85 2.86 0.46 3.16 1.02 -1.26 -0.81 119.74 121.32 1aey s LYS 26 Ca 0.05 -1.11 -0.25 0.00 0.02 0.00 0.00 55.97 54.68 1aey s LYS 26 Cb 0.04 -2.53 -0.08 0.00 -0.52 0.00 0.00 37.83 34.74 1aey s LYS 26 CO -0.11 0.34 1.37 1.17 -0.92 0.00 0.00 175.35 177.21 1aey n LYS 27 N -1.21 2.06 0.00 1.68 4.81 -1.24 -2.74 118.16 121.52 1aey n LYS 27 Ca -0.07 0.74 0.00 0.00 -0.87 0.00 0.00 58.31 58.11 1aey n LYS 27 Cb 0.58 -2.56 0.00 0.00 0.02 0.00 0.00 35.03 33.08 1aey n LYS 27 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 1aey n GLY 28 N 0.68 2.86 3.71 3.14 0.00 -0.14 -4.96 105.19 110.48 1aey n GLY 28 Ca 0.07 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.66 1aey n GLY 28 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1aey n ASP 29 N 0.00 3.90 -4.47 1.61 8.00 -1.11 -4.62 116.55 119.86 1aey n ASP 29 Ca 0.00 1.06 -0.43 0.00 0.71 0.00 0.00 54.79 56.13 1aey n ASP 29 Cb 0.00 -1.56 -0.04 0.00 -0.02 0.00 0.00 41.12 39.51 1aey n ASP 29 CO 0.00 0.00 0.00 0.27 -0.39 0.00 0.00 177.20 177.08 1aey s ILE 30 N 1.26 4.28 0.34 0.53 -4.36 -1.26 -0.53 121.20 121.46 1aey s ILE 30 Ca 0.76 -0.17 -0.10 0.00 -0.26 0.00 0.00 60.65 60.87 1aey s ILE 30 Cb -0.52 -4.68 -0.07 0.00 1.25 0.00 0.00 42.46 38.44 1aey s ILE 30 CO 0.33 -1.43 0.69 -0.76 0.24 0.00 0.00 174.94 174.02 1aey s LEU 31 N 4.19 3.97 -0.71 0.37 1.43 0.74 -4.90 118.68 123.77 1aey s LEU 31 Ca 0.25 1.06 -0.09 0.00 -1.03 0.00 0.00 54.13 54.32 1aey s LEU 31 Cb -0.15 -3.90 0.18 0.00 0.03 0.00 0.00 46.19 42.35 1aey s LEU 31 CO 0.12 -0.27 0.59 -0.89 0.23 0.00 0.00 176.35 176.13 1aey s THR 32 N -2.15 4.71 0.07 5.49 2.01 -1.05 -1.22 115.64 123.50 1aey s THR 32 Ca 0.50 -2.58 -0.30 0.00 0.31 0.00 0.00 61.69 59.62 1aey s THR 32 Cb -0.10 -3.98 -0.05 0.00 0.01 0.00 0.00 72.50 68.38 1aey s THR 32 CO 0.26 -0.94 1.00 -0.22 -0.69 0.00 0.00 174.62 174.03 1aey s LEU 33 N 0.22 4.44 -0.16 4.42 0.20 0.23 -0.29 118.68 127.74 1aey s LEU 33 Ca 0.16 1.79 -0.01 0.00 0.69 0.00 0.00 54.13 56.76 1aey s LEU 33 Cb -0.16 -3.58 -0.23 0.00 -0.43 0.00 0.00 46.19 41.78 1aey s LEU 33 CO -0.06 -0.18 0.20 -0.11 -0.29 0.00 0.00 176.35 175.91 1aey n LEU 34 N 3.23 2.45 -3.19 -0.68 7.94 0.37 -0.96 117.00 126.15 1aey n LEU 34 Ca 0.04 0.11 0.01 0.00 -1.11 0.00 0.00 56.01 55.07 1aey n LEU 34 Cb 0.49 -0.86 -0.02 0.00 0.53 0.00 0.00 43.42 43.56 1aey n LEU 34 CO 0.52 0.82 0.11 0.21 -1.11 0.00 0.00 177.39 177.94 1aey s ASN 35 N -6.72 -1.04 -0.28 1.96 2.47 -0.45 -4.89 114.94 105.99 1aey s ASN 35 Ca -0.24 0.67 0.12 0.00 0.42 0.00 0.00 52.86 53.83 1aey s ASN 35 Cb 0.07 1.92 0.68 0.00 -1.45 0.00 0.00 41.25 42.48 1aey s ASN 35 CO 0.73 -0.27 1.68 -1.54 -3.72 0.00 0.00 177.10 173.97 1aey n SER 36 N 5.41 4.44 -0.29 -4.21 3.41 -1.26 -0.99 113.62 120.13 1aey n SER 36 Ca -0.01 -3.22 -0.04 0.00 -0.26 0.00 0.00 58.87 55.34 1aey n SER 36 Cb 0.51 -0.68 0.07 0.00 -0.26 0.00 0.00 64.21 63.85 1aey n SER 36 CO 0.00 0.00 0.00 0.71 -0.16 0.00 0.00 175.04 175.59 1aey h THR 37 N 2.40 1.21 -4.40 6.66 1.35 -1.96 -3.45 112.91 114.73 1aey h THR 37 Ca 0.17 -0.41 -0.50 0.00 -0.55 0.00 0.00 66.41 65.12 1aey h THR 37 Cb 2.02 0.06 0.08 0.00 -1.73 0.00 0.00 68.15 68.58 1aey h THR 37 CO 0.56 0.21 0.40 0.20 -0.25 0.00 0.00 175.52 176.64 1aey s ASN 38 N -5.96 5.60 0.17 5.36 -0.87 -1.26 -4.97 114.94 113.01 1aey s ASN 38 Ca -0.13 1.30 0.14 0.00 -1.57 0.00 0.00 52.86 52.60 1aey s ASN 38 Cb 0.15 -2.18 -0.05 0.00 -0.02 0.00 0.00 41.25 39.15 1aey s ASN 38 CO 0.79 -1.26 1.19 0.07 -2.57 0.00 0.00 177.10 175.32 1aey h LYS 39 N -0.59 0.00 0.00 -0.60 5.09 -2.01 -3.43 116.57 115.02 1aey h LYS 39 Ca -0.45 0.00 0.00 0.00 0.09 0.00 0.00 60.65 60.29 1aey h LYS 39 Cb 1.23 0.00 0.00 0.00 0.10 0.00 0.00 32.23 33.56 1aey h LYS 39 CO 0.62 0.51 -0.28 -0.40 -2.09 0.00 0.00 179.45 177.81 1aey n ASP 40 N -3.13 0.75 -4.33 7.07 5.68 -1.26 -4.72 116.55 116.62 1aey n ASP 40 Ca -0.03 0.12 -0.46 0.00 -0.50 0.00 0.00 54.79 53.92 1aey n ASP 40 Cb 0.81 -0.44 -0.04 0.00 -1.14 0.00 0.00 41.12 40.32 1aey n ASP 40 CO 0.00 0.00 0.00 0.26 -1.33 0.00 0.00 177.20 176.13 1aey s TRP 41 N -1.72 3.47 0.39 2.11 0.52 -1.26 -0.62 118.94 121.82 1aey s TRP 41 Ca -0.08 -1.60 -0.23 0.00 0.02 0.00 0.00 56.10 54.21 1aey s TRP 41 Cb 0.01 -3.84 -0.10 0.00 -1.15 0.00 0.00 33.47 28.39 1aey s TRP 41 CO 0.12 -1.04 0.95 -1.58 0.02 0.00 0.00 176.95 175.43 1aey s TRP 42 N 1.04 3.46 -0.15 -1.98 0.52 -0.89 -4.48 118.94 116.46 1aey s TRP 42 Ca 0.11 1.68 -0.04 0.00 0.02 0.00 0.00 56.10 57.87 1aey s TRP 42 Cb -0.20 -2.89 -0.03 0.00 -1.15 0.00 0.00 33.47 29.20 1aey s TRP 42 CO -0.03 -0.00 -0.01 0.21 0.02 0.00 0.00 176.95 177.14 1aey s LYS 43 N -2.72 3.64 0.06 4.98 2.20 -0.16 -0.72 119.74 127.03 1aey s LYS 43 Ca 0.57 -0.47 0.03 0.00 -0.36 0.00 0.00 55.97 55.74 1aey s LYS 43 Cb -0.13 -2.96 -0.03 0.00 -1.51 0.00 0.00 37.83 33.20 1aey s LYS 43 CO 0.18 0.31 -0.09 0.14 -0.36 0.00 0.00 175.35 175.53 1aey s VAL 44 N 0.19 0.71 0.03 4.02 -7.23 -0.03 -0.48 120.40 117.62 1aey s VAL 44 Ca -0.00 -1.31 -0.26 0.00 -1.81 0.00 0.00 61.98 58.59 1aey s VAL 44 Cb -0.13 -0.93 -0.05 0.00 0.56 0.00 0.00 36.38 35.83 1aey s VAL 44 CO 0.02 -0.45 0.82 -0.70 -0.31 0.00 0.00 175.10 174.49 1aey s GLU 45 N -2.07 4.53 -0.26 4.82 2.12 0.60 -1.23 118.70 127.20 1aey s GLU 45 Ca -0.04 1.16 -0.01 0.00 0.36 0.00 0.00 54.97 56.45 1aey s GLU 45 Cb -0.07 -3.39 0.15 0.00 0.26 0.00 0.00 34.13 31.07 1aey s GLU 45 CO 0.00 0.19 0.41 0.54 -0.54 0.00 0.00 175.26 175.85 1aey s VAL 46 N 0.25 -0.65 0.00 3.70 0.11 -0.04 -2.53 120.40 121.25 1aey s VAL 46 Ca 0.42 -0.15 0.00 0.00 -2.93 0.00 0.00 61.98 59.32 1aey s VAL 46 Cb -0.21 -0.89 0.00 0.00 -1.53 0.00 0.00 36.38 33.75 1aey s VAL 46 CO 0.24 -0.17 0.00 -3.20 -3.33 0.00 0.00 175.10 168.64 1aey n ASN 47 N 5.37 0.00 0.00 3.54 5.15 -1.26 -1.54 115.26 126.51 1aey n ASN 47 Ca -0.02 0.00 0.00 0.00 -0.60 0.00 0.00 54.58 53.96 1aey n ASN 47 Cb 0.50 0.00 0.00 0.00 -0.53 0.00 0.00 39.78 39.75 1aey n ASN 47 CO 0.00 0.00 0.00 -0.90 1.40 0.00 0.00 177.26 177.76 1aey n ASP 48 N 1.43 0.34 -4.50 1.20 5.75 -1.26 -5.10 116.55 114.42 1aey n ASP 48 Ca 0.00 -0.13 -0.24 0.00 -0.01 0.00 0.00 54.79 54.40 1aey n ASP 48 Cb 0.00 0.34 -0.10 0.00 -1.03 0.00 0.00 41.12 40.33 1aey n ASP 48 CO 0.00 0.00 0.00 -0.13 -0.11 0.00 0.00 177.20 176.96 1aey s ARG 49 N -0.41 1.77 -0.60 0.11 0.52 -0.59 -5.09 118.95 114.67 1aey s ARG 49 Ca 0.00 -1.69 0.01 0.00 -0.52 0.00 0.00 55.73 53.53 1aey s ARG 49 Cb 0.00 -1.84 0.15 0.00 0.52 0.00 0.00 34.95 33.78 1aey s ARG 49 CO 0.00 0.34 0.37 -0.65 0.02 0.00 0.00 175.30 175.39 1aey s GLN 50 N -3.47 2.30 0.45 3.54 -0.21 -1.26 -0.86 119.66 120.16 1aey s GLN 50 Ca 0.30 -2.71 0.03 0.00 0.02 0.00 0.00 55.36 53.00 1aey s GLN 50 Cb -0.05 -3.51 -0.02 0.00 1.00 0.00 0.00 33.01 30.43 1aey s GLN 50 CO 0.15 -1.16 0.07 0.20 -2.12 0.00 0.00 175.29 172.44 1aey s GLY 51 N -0.08 2.78 0.15 3.09 0.00 -0.36 -4.88 107.32 108.02 1aey s GLY 51 Ca 0.18 -0.90 -0.11 0.00 0.00 0.00 0.00 44.72 43.89 1aey s GLY 51 CO -0.03 -2.00 0.49 -1.36 0.00 0.00 0.00 173.10 170.20 1aey s PHE 52 N -3.05 3.54 0.03 1.90 0.08 -0.20 -0.85 117.98 119.43 1aey s PHE 52 Ca 0.16 0.88 0.04 0.00 0.12 0.00 0.00 56.93 58.14 1aey s PHE 52 Cb 0.02 -2.24 -0.02 0.00 -0.57 0.00 0.00 43.02 40.21 1aey s PHE 52 CO 0.10 0.41 -0.12 0.14 -0.10 0.00 0.00 175.22 175.65 1aey s VAL 53 N -1.56 0.93 -0.16 -0.44 -7.23 0.11 -2.32 120.40 109.72 1aey s VAL 53 Ca 0.39 -0.93 -0.30 0.00 -1.81 0.00 0.00 61.98 59.34 1aey s VAL 53 Cb -0.13 -0.86 -0.08 0.00 0.56 0.00 0.00 36.38 35.87 1aey s VAL 53 CO 0.20 -0.05 2.12 -2.65 -0.31 0.00 0.00 175.10 174.41 1aey n PRO 54 N 1.94 2.08 -0.40 4.82 -0.02 -1.26 -2.09 135.00 140.06 1aey n PRO 54 Ca -0.18 0.65 0.32 0.00 -2.02 0.00 0.00 63.50 62.27 1aey n PRO 54 Cb 0.55 -3.00 0.60 0.00 -0.02 0.00 0.00 33.50 31.63 1aey n PRO 54 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1aey h ALA 55 N 12.94 2.56 -0.34 3.55 0.00 -1.15 0.04 119.26 136.86 1aey h ALA 55 Ca -0.42 0.10 0.08 0.00 0.00 0.00 0.00 54.91 54.67 1aey h ALA 55 Cb 1.26 0.16 -0.02 0.00 0.00 0.00 0.00 17.79 19.19 1aey h ALA 55 CO 0.96 -1.13 0.24 0.00 0.00 0.00 0.00 179.25 179.32 1aey h ALA 56 N 1.62 2.17 -0.46 0.00 0.00 -1.86 -2.83 119.26 117.90 1aey h ALA 56 Ca 0.75 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.65 1aey h ALA 56 Cb 2.24 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 20.02 1aey h ALA 56 CO -0.40 -0.25 0.00 0.66 0.00 0.00 0.00 179.25 179.26 1aey n TYR 57 N -4.46 1.05 -4.30 0.00 4.01 -0.00 -4.91 117.16 108.54 1aey n TYR 57 Ca 0.05 -0.65 -0.21 0.00 -0.16 0.00 0.00 57.90 56.93 1aey n TYR 57 Cb 0.33 -0.20 -0.13 0.00 -0.31 0.00 0.00 39.34 39.03 1aey n TYR 57 CO 0.00 0.00 0.00 0.14 -0.46 0.00 0.00 176.86 176.54 1aey s VAL 58 N -1.87 1.29 -0.12 -0.72 -7.23 -1.07 -0.66 120.40 110.02 1aey s VAL 58 Ca 0.41 -1.25 -0.01 0.00 -1.81 0.00 0.00 61.98 59.32 1aey s VAL 58 Cb 0.27 -1.19 -0.02 0.00 0.56 0.00 0.00 36.38 36.00 1aey s VAL 58 CO 0.18 -0.07 -0.07 -0.75 -0.31 0.00 0.00 175.10 174.07 1aey s LYS 59 N -1.53 3.33 0.28 4.82 2.20 0.09 -4.93 119.74 124.00 1aey s LYS 59 Ca 0.02 -0.57 -0.29 0.00 -0.36 0.00 0.00 55.97 54.76 1aey s LYS 59 Cb -0.09 -2.74 -0.10 0.00 -1.51 0.00 0.00 37.83 33.39 1aey s LYS 59 CO 0.02 0.35 1.26 0.21 -0.36 0.00 0.00 175.35 176.84 1aey s LYS 60 N 0.03 4.43 -0.13 4.03 2.20 -1.26 -0.26 119.74 128.78 1aey s LYS 60 Ca -0.01 2.07 -0.04 0.00 -0.36 0.00 0.00 55.97 57.63 1aey s LYS 60 Cb -0.14 -3.14 -0.25 0.00 -1.51 0.00 0.00 37.83 32.80 1aey s LYS 60 CO 0.03 -0.12 0.33 1.28 -0.36 0.00 0.00 175.35 176.51 1aey n LEU 61 N 1.50 2.48 -0.23 5.43 4.77 -0.38 -4.85 117.00 125.72 1aey n LEU 61 Ca 0.02 0.19 0.15 0.00 -0.03 0.00 0.00 56.01 56.34 1aey n LEU 61 Cb 0.43 -0.96 0.75 0.00 -2.33 0.00 0.00 43.42 41.31 1aey n LEU 61 CO 0.58 0.82 1.00 0.47 -1.33 0.00 0.00 177.39 178.92