#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1aey n LYS 6 N 0.00 3.28 -3.40 1.61 4.76 -1.25 -3.74 118.16 119.42 1aey n LYS 6 Ca 0.00 -1.91 -0.36 0.00 -2.87 0.00 0.00 58.31 53.17 1aey n LYS 6 Cb 0.00 -2.61 -0.06 0.00 -1.84 0.00 0.00 35.03 30.52 1aey n LYS 6 CO 0.00 0.00 0.00 -1.21 -1.37 0.00 0.00 177.40 174.82 1aey s GLU 7 N 1.96 3.96 0.26 1.97 2.02 -1.26 -4.64 118.70 122.97 1aey s GLU 7 Ca 0.68 0.46 -0.29 0.00 0.02 0.00 0.00 54.97 55.84 1aey s GLU 7 Cb 0.21 -3.02 -0.09 0.00 0.10 0.00 0.00 34.13 31.32 1aey s GLU 7 CO -0.05 0.54 0.95 -0.51 0.02 0.00 0.00 175.26 176.21 1aey s LEU 8 N -1.72 4.58 -0.03 1.80 1.43 -1.26 -0.43 118.68 123.04 1aey s LEU 8 Ca 0.34 1.94 0.04 0.00 -1.03 0.00 0.00 54.13 55.41 1aey s LEU 8 Cb -0.16 -3.70 -0.00 0.00 0.03 0.00 0.00 46.19 42.36 1aey s LEU 8 CO 0.18 0.10 -0.14 0.68 0.23 0.00 0.00 176.35 177.40 1aey s VAL 9 N -1.28 1.18 -0.16 -1.59 -7.23 -0.53 -1.40 120.40 109.39 1aey s VAL 9 Ca 0.43 -0.60 -0.11 0.00 -1.81 0.00 0.00 61.98 59.89 1aey s VAL 9 Cb -0.25 -1.01 -0.05 0.00 0.56 0.00 0.00 36.38 35.64 1aey s VAL 9 CO 0.30 0.34 0.21 -0.22 -0.31 0.00 0.00 175.10 175.43 1aey s LEU 10 N -0.05 4.26 -0.14 1.32 0.20 0.64 -0.20 118.68 124.71 1aey s LEU 10 Ca -0.00 0.41 -0.29 0.00 0.69 0.00 0.00 54.13 54.93 1aey s LEU 10 Cb -0.09 -2.22 -0.01 0.00 -0.43 0.00 0.00 46.19 43.44 1aey s LEU 10 CO 0.01 0.18 1.07 0.00 -0.29 0.00 0.00 176.35 177.32 1aey s ALA 11 N 0.16 3.53 0.09 5.97 0.00 0.17 -0.88 121.76 130.79 1aey s ALA 11 Ca 0.13 0.36 -0.01 0.00 0.00 0.00 0.00 51.96 52.44 1aey s ALA 11 Cb -0.12 -3.50 -0.25 0.00 0.00 0.00 0.00 23.12 19.26 1aey s ALA 11 CO 0.02 -0.81 1.20 -0.07 0.00 0.00 0.00 175.76 176.10 1aey h LEU 12 N 8.62 0.29 -8.28 0.00 3.38 -0.92 0.03 115.31 118.42 1aey h LEU 12 Ca -0.27 -0.30 -0.15 0.00 0.09 0.00 0.00 57.88 57.25 1aey h LEU 12 Cb 1.12 -0.09 -0.15 0.00 0.09 0.00 0.00 40.66 41.63 1aey h LEU 12 CO 0.91 1.23 -0.59 -0.31 0.09 0.00 0.00 178.44 179.77 1aey s TYR 13 N -2.71 0.64 0.59 1.13 2.02 -1.19 -4.74 117.35 113.10 1aey s TYR 13 Ca -0.02 -1.07 -0.15 0.00 -0.37 0.00 0.00 57.07 55.46 1aey s TYR 13 Cb 0.08 -0.36 -0.04 0.00 -0.40 0.00 0.00 41.96 41.24 1aey s TYR 13 CO 0.86 -0.51 1.04 -0.51 -1.57 0.00 0.00 175.55 174.86 1aey s ASP 14 N -2.99 5.96 -0.10 2.29 1.11 -1.26 -3.78 116.67 117.91 1aey s ASP 14 Ca 0.17 1.68 -0.07 0.00 0.18 0.00 0.00 52.55 54.52 1aey s ASP 14 Cb 0.07 -2.51 0.04 0.00 1.07 0.00 0.00 42.92 41.58 1aey s ASP 14 CO -0.03 -1.04 0.24 -0.47 1.18 0.00 0.00 175.17 175.05 1aey s TYR 15 N -2.66 -0.30 -0.19 4.23 5.04 0.04 -4.85 117.35 118.65 1aey s TYR 15 Ca 0.61 0.72 -0.08 0.00 -2.44 0.00 0.00 57.07 55.87 1aey s TYR 15 Cb -0.14 0.07 -0.04 0.00 0.35 0.00 0.00 41.96 42.20 1aey s TYR 15 CO 0.40 -0.18 0.07 -0.65 -1.34 0.00 0.00 175.55 173.85 1aey s GLN 16 N 0.73 3.96 0.04 4.97 -0.21 -1.26 -0.72 119.66 127.17 1aey s GLN 16 Ca -0.05 -0.34 -0.36 0.00 0.02 0.00 0.00 55.36 54.63 1aey s GLN 16 Cb -0.06 -3.25 -0.15 0.00 1.00 0.00 0.00 33.01 30.55 1aey s GLN 16 CO -0.04 0.22 1.59 -0.85 -2.12 0.00 0.00 175.29 174.08 1aey n GLU 17 N 3.70 1.73 -0.10 2.91 0.28 -1.26 -4.91 120.64 122.99 1aey n GLU 17 Ca -0.16 0.63 -0.15 0.00 -0.16 0.00 0.00 57.16 57.32 1aey n GLU 17 Cb 0.52 -2.36 -0.06 0.00 1.43 0.00 0.00 31.44 30.97 1aey n GLU 17 CO 0.00 0.00 0.00 1.17 -0.16 0.00 0.00 177.13 178.14 1aey n LYS 18 N 4.00 0.53 -3.39 3.44 4.81 -1.26 -4.98 118.16 121.31 1aey n LYS 18 Ca 0.20 0.40 -0.28 0.00 -0.87 0.00 0.00 58.31 57.75 1aey n LYS 18 Cb 0.24 -1.59 -0.03 0.00 0.02 0.00 0.00 35.03 33.67 1aey n LYS 18 CO 0.00 0.00 0.00 -1.54 1.17 0.00 0.00 177.40 177.03 1aey s SER 19 N -6.38 6.43 0.55 3.14 1.04 -1.26 -4.99 113.70 112.23 1aey s SER 19 Ca -0.27 0.66 0.26 0.00 0.48 0.00 0.00 55.95 57.08 1aey s SER 19 Cb 0.06 -2.12 1.47 0.00 0.10 0.00 0.00 66.02 65.53 1aey s SER 19 CO 0.41 -0.18 2.04 1.55 0.98 0.00 0.00 173.24 178.04 1aey h PRO 20 N 1.69 0.00 0.00 4.02 0.13 -2.03 -0.78 132.00 135.02 1aey h PRO 20 Ca -0.48 0.00 -0.00 0.00 -0.87 0.00 0.00 66.00 64.65 1aey h PRO 20 Cb 1.19 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 32.32 1aey h PRO 20 CO 0.66 0.00 -0.00 0.07 -0.23 0.00 0.00 178.00 178.50 1aey h ARG 21 N 0.00 0.00 -7.40 0.86 -0.00 -1.97 -3.44 114.38 102.43 1aey h ARG 21 Ca 0.16 0.00 -0.50 0.00 -0.00 0.00 0.00 59.98 59.64 1aey h ARG 21 Cb 0.73 0.00 0.07 0.00 -0.00 0.00 0.00 29.97 30.77 1aey h ARG 21 CO -0.00 0.00 0.42 -1.21 -0.00 0.00 0.00 179.97 179.18 1aey s GLU 22 N -3.23 3.37 0.01 0.08 2.02 -0.30 -1.43 118.70 119.22 1aey s GLU 22 Ca 0.07 0.66 -0.01 0.00 0.02 0.00 0.00 54.97 55.71 1aey s GLU 22 Cb 0.05 -2.06 -0.01 0.00 0.10 0.00 0.00 34.13 32.21 1aey s GLU 22 CO 0.67 -0.72 0.01 0.14 0.02 0.00 0.00 175.26 175.38 1aey s VAL 23 N -3.23 0.08 0.19 2.63 -7.23 -0.87 -4.73 120.40 107.24 1aey s VAL 23 Ca 0.56 -0.64 -0.30 0.00 -1.81 0.00 0.00 61.98 59.79 1aey s VAL 23 Cb -0.11 -0.23 -0.08 0.00 0.56 0.00 0.00 36.38 36.52 1aey s VAL 23 CO 0.53 -0.35 0.96 -0.89 -0.31 0.00 0.00 175.10 175.04 1aey s THR 24 N -1.07 4.19 0.13 5.32 2.01 -1.26 -4.25 115.64 120.72 1aey s THR 24 Ca -0.12 2.05 -0.04 0.00 0.31 0.00 0.00 61.69 63.90 1aey s THR 24 Cb -0.07 -4.31 -0.03 0.00 0.01 0.00 0.00 72.50 68.10 1aey s THR 24 CO -0.00 0.43 0.13 0.00 -0.69 0.00 0.00 174.62 174.48 1aey s MET 25 N -0.76 0.98 0.12 4.92 0.23 0.10 -4.96 119.30 119.92 1aey s MET 25 Ca 0.43 -1.32 0.11 0.00 -1.03 0.00 0.00 55.69 53.88 1aey s MET 25 Cb -0.25 0.29 -0.04 0.00 -1.53 0.00 0.00 34.83 33.29 1aey s MET 25 CO 0.32 -0.30 -0.26 0.15 -2.03 0.00 0.00 175.02 172.89 1aey s LYS 26 N -4.01 1.47 0.31 3.16 1.02 -1.26 -0.78 119.74 119.65 1aey s LYS 26 Ca 0.20 -1.31 -0.28 0.00 0.02 0.00 0.00 55.97 54.60 1aey s LYS 26 Cb 0.06 -1.92 -0.13 0.00 -0.52 0.00 0.00 37.83 35.32 1aey s LYS 26 CO -0.00 0.46 1.19 1.17 -0.92 0.00 0.00 175.35 177.25 1aey n LYS 27 N 1.00 1.82 0.00 1.68 4.81 -1.25 -1.70 118.16 124.52 1aey n LYS 27 Ca -0.18 0.64 0.00 0.00 -0.87 0.00 0.00 58.31 57.90 1aey n LYS 27 Cb 0.53 -2.14 0.00 0.00 0.02 0.00 0.00 35.03 33.44 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 1.02 3.20 3.75 3.14 0.00 -0.00 -4.91 105.19 111.39 1aey n GLY 28 Ca 0.07 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.67 1aey n GLY 28 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1aey s ASP 29 N -0.67 6.38 -0.86 1.61 1.01 -0.69 -4.52 116.67 118.94 1aey s ASP 29 Ca 0.00 2.93 -0.21 0.00 0.71 0.00 0.00 52.55 55.98 1aey s ASP 29 Cb 0.00 -2.63 0.09 0.00 1.01 0.00 0.00 42.92 41.39 1aey s ASP 29 CO 0.00 -0.92 1.15 0.27 0.21 0.00 0.00 175.17 175.88 1aey s ILE 30 N 0.19 4.41 0.74 0.77 -4.36 -1.26 -0.66 121.20 121.03 1aey s ILE 30 Ca 0.65 -0.97 -0.09 0.00 -0.26 0.00 0.00 60.65 59.98 1aey s ILE 30 Cb -0.48 -4.81 0.06 0.00 1.25 0.00 0.00 42.46 38.48 1aey s ILE 30 CO 0.45 -1.59 1.08 -0.76 0.24 0.00 0.00 174.94 174.36 1aey s LEU 31 N 3.66 2.72 -0.07 0.37 1.43 0.73 -4.90 118.68 122.61 1aey s LEU 31 Ca 0.32 0.64 0.02 0.00 -1.03 0.00 0.00 54.13 54.08 1aey s LEU 31 Cb -0.08 -3.25 0.01 0.00 0.03 0.00 0.00 46.19 42.91 1aey s LEU 31 CO -0.03 -1.68 -0.11 -0.89 0.23 0.00 0.00 176.35 173.87 1aey s THR 32 N -3.37 1.10 0.72 5.49 2.01 -1.13 -1.45 115.64 119.01 1aey s THR 32 Ca 0.60 -0.44 -0.09 0.00 0.31 0.00 0.00 61.69 62.07 1aey s THR 32 Cb -0.11 -1.02 0.05 0.00 0.01 0.00 0.00 72.50 71.43 1aey s THR 32 CO 0.47 0.35 1.06 -0.22 -0.69 0.00 0.00 174.62 175.59 1aey s LEU 33 N 0.79 2.78 0.00 4.42 2.96 0.42 0.37 118.68 130.43 1aey s LEU 33 Ca -0.12 0.67 0.00 0.00 -0.22 0.00 0.00 54.13 54.46 1aey s LEU 33 Cb -0.15 -3.31 0.00 0.00 0.50 0.00 0.00 46.19 43.22 1aey s LEU 33 CO 0.02 -1.59 0.00 -0.11 -1.32 0.00 0.00 176.35 173.35 1aey n LEU 34 N -3.01 0.00 -3.55 -0.68 7.94 0.20 -3.79 117.00 114.11 1aey n LEU 34 Ca 0.07 0.00 -0.05 0.00 -1.11 0.00 0.00 56.01 54.93 1aey n LEU 34 Cb 0.60 0.00 -0.06 0.00 0.53 0.00 0.00 43.42 44.48 1aey n LEU 34 CO 0.54 0.00 0.10 0.21 -1.11 0.00 0.00 177.39 177.14 1aey s ASN 35 N -1.35 -0.61 0.00 1.96 2.47 0.48 -4.94 114.94 112.95 1aey s ASN 35 Ca 0.00 1.06 0.11 0.00 0.42 0.00 0.00 52.86 54.45 1aey s ASN 35 Cb 0.00 1.72 0.20 0.00 -1.45 0.00 0.00 41.25 41.72 1aey s ASN 35 CO 0.00 -0.24 1.06 -1.54 -3.72 0.00 0.00 177.10 172.66 1aey n SER 36 N 5.41 2.44 0.04 -4.21 3.41 -1.26 -1.09 113.62 118.36 1aey n SER 36 Ca -0.08 -1.74 0.21 0.00 -0.26 0.00 0.00 58.87 57.00 1aey n SER 36 Cb 0.50 -0.12 0.72 0.00 -0.26 0.00 0.00 64.21 65.05 1aey n SER 36 CO 0.00 0.00 0.00 0.74 -0.16 0.00 0.00 175.04 175.62 1aey h THR 37 N 2.11 0.59 -4.14 6.66 2.02 -1.95 -3.42 112.91 114.77 1aey h THR 37 Ca 0.00 0.00 -0.46 0.00 0.77 0.00 0.00 66.41 66.72 1aey h THR 37 Cb 0.60 0.71 0.00 0.00 -1.74 0.00 0.00 68.15 67.73 1aey h THR 37 CO 0.00 0.00 0.36 0.20 0.37 0.00 0.00 175.52 176.45 1aey s ASN 38 N -5.86 6.70 -0.34 4.18 -0.87 -1.26 -4.98 114.94 112.51 1aey s ASN 38 Ca -0.05 1.63 0.09 0.00 -1.57 0.00 0.00 52.86 52.96 1aey s ASN 38 Cb 0.18 -2.52 0.65 0.00 -0.02 0.00 0.00 41.25 39.54 1aey s ASN 38 CO 0.66 -0.53 1.73 2.29 -2.57 0.00 0.00 177.10 178.68 1aey n LYS 39 N -1.24 2.80 0.05 -0.60 2.85 -1.26 -4.69 118.16 116.07 1aey n LYS 39 Ca 0.07 -3.07 0.00 0.00 -1.05 0.00 0.00 58.31 54.26 1aey n LYS 39 Cb 0.54 -2.08 0.00 0.00 -0.65 0.00 0.00 35.03 32.84 1aey n LYS 39 CO 0.00 0.00 0.00 -3.47 -0.05 0.00 0.00 177.40 173.88 1aey n ASP 40 N -0.70 -0.88 -3.86 -5.58 -0.08 -1.26 -4.93 116.55 99.26 1aey n ASP 40 Ca 0.43 0.19 -0.29 0.00 -1.51 0.00 0.00 54.79 53.61 1aey n ASP 40 Cb 1.34 1.20 -0.16 0.00 2.34 0.00 0.00 41.12 45.84 1aey n ASP 40 CO 0.00 0.00 0.00 0.26 0.12 0.00 0.00 177.20 177.58 1aey s TRP 41 N -2.00 1.90 0.37 -0.67 0.52 -1.26 -0.35 118.94 117.44 1aey s TRP 41 Ca 0.00 -1.45 -0.18 0.00 0.02 0.00 0.00 56.10 54.49 1aey s TRP 41 Cb 0.00 -1.40 -0.10 0.00 -1.15 0.00 0.00 33.47 30.82 1aey s TRP 41 CO 0.00 -0.72 0.83 -1.58 0.02 0.00 0.00 176.95 175.50 1aey s TRP 42 N 1.56 3.36 -0.15 -1.98 0.51 -0.36 -4.64 118.94 117.24 1aey s TRP 42 Ca -0.03 1.41 -0.10 0.00 -2.12 0.00 0.00 56.10 55.25 1aey s TRP 42 Cb -0.18 -2.68 -0.05 0.00 -0.81 0.00 0.00 33.47 29.75 1aey s TRP 42 CO -0.07 0.02 0.20 0.21 -0.51 0.00 0.00 176.95 176.79 1aey s LYS 43 N -3.01 3.94 0.00 4.98 2.20 -0.25 -0.84 119.74 126.76 1aey s LYS 43 Ca 0.57 -0.06 -0.05 0.00 -0.36 0.00 0.00 55.97 56.07 1aey s LYS 43 Cb -0.10 -3.33 -0.00 0.00 -1.51 0.00 0.00 37.83 32.89 1aey s LYS 43 CO 0.16 0.48 0.09 0.14 -0.36 0.00 0.00 175.35 175.86 1aey s VAL 44 N -0.21 0.08 -0.58 4.02 -7.23 0.18 -0.38 120.40 116.29 1aey s VAL 44 Ca 0.14 -0.68 -0.27 0.00 -1.81 0.00 0.00 61.98 59.36 1aey s VAL 44 Cb -0.12 -0.37 0.03 0.00 0.56 0.00 0.00 36.38 36.48 1aey s VAL 44 CO 0.03 -0.37 1.11 -0.70 -0.31 0.00 0.00 175.10 174.85 1aey s GLU 45 N -1.27 3.43 -0.15 4.82 2.12 0.16 -0.49 118.70 127.32 1aey s GLU 45 Ca -0.14 0.04 -0.00 0.00 0.36 0.00 0.00 54.97 55.23 1aey s GLU 45 Cb -0.08 -4.04 0.03 0.00 0.26 0.00 0.00 34.13 30.31 1aey s GLU 45 CO 0.01 -1.64 -0.09 0.54 -0.54 0.00 0.00 175.26 173.55 1aey s VAL 46 N 4.63 1.26 0.00 3.70 0.11 0.10 -2.84 120.40 127.36 1aey s VAL 46 Ca 0.38 -0.59 0.00 0.00 -2.93 0.00 0.00 61.98 58.84 1aey s VAL 46 Cb -0.09 -1.32 0.00 0.00 -1.53 0.00 0.00 36.38 33.44 1aey s VAL 46 CO 0.23 0.27 0.00 -3.20 -3.33 0.00 0.00 175.10 169.07 1aey n ASN 47 N 4.84 0.00 0.00 3.54 5.15 -1.26 -0.97 115.26 126.56 1aey n ASN 47 Ca -0.14 0.00 0.00 0.00 -0.60 0.00 0.00 54.58 53.84 1aey n ASN 47 Cb 0.49 0.00 0.00 0.00 -0.53 0.00 0.00 39.78 39.74 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 0.66 0.33 -3.95 1.20 5.75 -1.26 -5.09 116.55 114.19 1aey n ASP 48 Ca 0.00 -0.71 -0.16 0.00 -0.01 0.00 0.00 54.79 53.91 1aey n ASP 48 Cb 0.00 0.23 -0.15 0.00 -1.03 0.00 0.00 41.12 40.17 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 -0.23 0.43 -1.27 0.11 0.52 -0.14 -5.06 118.95 113.31 1aey s ARG 49 Ca 0.00 -0.17 -0.06 0.00 -0.52 0.00 0.00 55.73 54.98 1aey s ARG 49 Cb 0.00 -0.43 0.16 0.00 0.52 0.00 0.00 34.95 35.21 1aey s ARG 49 CO 0.00 0.09 2.11 1.04 0.02 0.00 0.00 175.30 178.56 1aey n GLN 50 N 3.07 4.31 -4.28 3.54 3.00 -1.26 -0.72 117.38 125.04 1aey n GLN 50 Ca -0.14 -3.64 -0.28 0.00 -0.01 0.00 0.00 57.00 52.93 1aey n GLN 50 Cb 0.57 -2.71 -0.06 0.00 0.00 0.00 0.00 30.24 28.04 1aey n GLN 50 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.06 177.26 1aey s GLY 51 N 0.26 2.54 0.21 1.08 0.00 0.36 -4.66 107.32 107.11 1aey s GLY 51 Ca 0.46 -1.46 -0.20 0.00 0.00 0.00 0.00 44.72 43.52 1aey s GLY 51 CO -0.05 -2.01 0.72 -1.36 0.00 0.00 0.00 173.10 170.40 1aey s PHE 52 N -2.73 3.69 0.06 1.90 0.08 -0.52 -0.64 117.98 119.83 1aey s PHE 52 Ca 0.29 1.41 0.04 0.00 0.12 0.00 0.00 56.93 58.79 1aey s PHE 52 Cb 0.02 -2.63 -0.03 0.00 -0.57 0.00 0.00 43.02 39.82 1aey s PHE 52 CO 0.17 0.37 -0.12 0.14 -0.10 0.00 0.00 175.22 175.68 1aey s VAL 53 N -1.45 0.91 -0.10 -0.44 -7.23 -0.02 -2.04 120.40 110.03 1aey s VAL 53 Ca 0.41 -1.22 -0.33 0.00 -1.81 0.00 0.00 61.98 59.03 1aey s VAL 53 Cb -0.18 -0.91 -0.11 0.00 0.56 0.00 0.00 36.38 35.75 1aey s VAL 53 CO 0.21 -0.28 1.96 -2.65 -0.31 0.00 0.00 175.10 174.04 1aey n PRO 54 N 1.36 2.22 -0.10 4.82 -0.02 -1.26 -1.23 135.00 140.79 1aey n PRO 54 Ca -0.22 0.79 0.23 0.00 -2.02 0.00 0.00 63.50 62.28 1aey n PRO 54 Cb 0.54 -2.76 0.67 0.00 -0.02 0.00 0.00 33.50 31.93 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 10.28 2.56 -0.94 3.55 0.00 -1.00 -1.32 119.26 132.39 1aey h ALA 55 Ca -0.47 -0.02 0.08 0.00 0.00 0.00 0.00 54.91 54.51 1aey h ALA 55 Cb 1.27 0.03 -0.07 0.00 0.00 0.00 0.00 17.79 19.02 1aey h ALA 55 CO 0.95 -0.77 0.59 0.00 0.00 0.00 0.00 179.25 180.03 1aey h ALA 56 N 1.65 1.34 -0.70 0.00 0.00 -1.89 -3.09 119.26 116.58 1aey h ALA 56 Ca 0.34 -0.00 -0.24 0.00 0.00 0.00 0.00 54.91 55.01 1aey h ALA 56 Cb 1.26 -0.24 -0.14 0.00 0.00 0.00 0.00 17.79 18.66 1aey h ALA 56 CO -0.03 0.31 0.30 0.66 0.00 0.00 0.00 179.25 180.49 1aey n TYR 57 N -4.59 2.28 -4.07 0.00 4.01 -0.50 -4.86 117.16 109.44 1aey n TYR 57 Ca 0.15 -1.18 -0.13 0.00 -0.16 0.00 0.00 57.90 56.58 1aey n TYR 57 Cb 0.23 -0.67 -0.12 0.00 -0.31 0.00 0.00 39.34 38.47 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 -2.72 0.48 -0.02 -0.72 -7.23 -1.17 -0.22 120.40 108.81 1aey s VAL 58 Ca 0.49 -0.94 0.07 0.00 -1.81 0.00 0.00 61.98 59.78 1aey s VAL 58 Cb 0.39 -0.54 -0.02 0.00 0.56 0.00 0.00 36.38 36.78 1aey s VAL 58 CO 0.12 -0.32 -0.22 -1.59 -0.31 0.00 0.00 175.10 172.77 1aey s LYS 59 N -1.36 1.80 0.25 4.82 0.00 -0.06 -4.85 119.74 120.34 1aey s LYS 59 Ca -0.09 -0.78 -0.29 0.00 0.00 0.00 0.00 55.97 54.81 1aey s LYS 59 Cb -0.09 -1.73 -0.09 0.00 0.00 0.00 0.00 37.83 35.92 1aey s LYS 59 CO 0.00 0.46 0.92 0.21 0.00 0.00 0.00 175.35 176.95 1aey s LYS 60 N -0.49 4.77 -0.59 1.78 2.20 -1.26 -0.26 119.74 125.89 1aey s LYS 60 Ca 0.08 1.42 -0.02 0.00 -0.36 0.00 0.00 55.97 57.09 1aey s LYS 60 Cb -0.09 -3.18 0.34 0.00 -1.51 0.00 0.00 37.83 33.40 1aey s LYS 60 CO -0.01 0.48 2.09 1.28 -0.36 0.00 0.00 175.35 178.84 1aey n LEU 61 N 1.31 7.28 -0.96 5.43 4.77 -0.49 -4.89 117.00 129.45 1aey n LEU 61 Ca -0.02 -4.10 0.12 0.00 -0.03 0.00 0.00 56.01 51.98 1aey n LEU 61 Cb 0.48 -1.03 0.10 0.00 -2.33 0.00 0.00 43.42 40.64 1aey n LEU 61 CO 0.48 1.47 0.63 -0.90 -1.33 0.00 0.00 177.39 177.75