#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1ark n ALA 2 N 0.00 3.25 0.01 1.79 0.00 -1.26 -4.90 120.51 119.41 1ark n ALA 2 Ca 0.00 -1.29 0.02 0.00 0.00 0.00 0.00 53.44 52.16 1ark n ALA 2 Cb 0.00 -0.49 -0.02 0.00 0.00 0.00 0.00 19.45 18.94 1ark n ALA 2 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1ark n GLY 3 N 0.12 -0.06 0.91 0.00 0.00 -1.26 -4.84 105.19 100.07 1ark n GLY 3 Ca -0.16 -0.08 -0.07 0.00 0.00 0.00 0.00 46.02 45.71 1ark n GLY 3 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1ark n LYS 4 N -1.55 -1.15 -4.25 1.61 5.02 -1.26 -5.08 118.16 111.49 1ark n LYS 4 Ca -0.00 -0.46 -0.20 0.00 -2.02 0.00 0.00 58.31 55.62 1ark n LYS 4 Cb 0.08 -0.39 -0.12 0.00 -0.02 0.00 0.00 35.03 34.59 1ark n LYS 4 CO 0.00 0.00 0.00 0.42 -0.52 0.00 0.00 177.40 177.30 1ark s ILE 5 N -1.57 1.45 0.52 -0.18 1.09 -1.26 -4.83 121.20 116.42 1ark s ILE 5 Ca 0.18 -1.64 0.00 0.00 -1.10 0.00 0.00 60.65 58.10 1ark s ILE 5 Cb -0.01 -1.50 -0.00 0.00 -1.06 0.00 0.00 42.46 39.88 1ark s ILE 5 CO 0.14 -0.29 0.01 -0.36 -0.10 0.00 0.00 174.94 174.33 1ark s PHE 6 N -1.75 1.75 0.05 3.97 0.40 -1.25 -2.21 117.98 118.95 1ark s PHE 6 Ca 0.07 -1.02 -0.27 0.00 -0.60 0.00 0.00 56.93 55.12 1ark s PHE 6 Cb -0.07 -1.57 0.07 0.00 0.51 0.00 0.00 43.02 41.97 1ark s PHE 6 CO 0.04 0.17 0.65 0.50 0.70 0.00 0.00 175.22 177.28 1ark s ARG 7 N -3.90 1.15 0.07 0.44 3.52 -1.13 -3.77 118.95 115.34 1ark s ARG 7 Ca 0.01 -0.13 0.03 0.00 -0.13 0.00 0.00 55.73 55.52 1ark s ARG 7 Cb 0.00 0.54 -0.04 0.00 -1.56 0.00 0.00 34.95 33.89 1ark s ARG 7 CO 0.01 -0.44 0.04 0.00 -0.81 0.00 0.00 175.30 174.10 1ark s ALA 8 N -2.55 3.44 -0.00 6.12 0.00 -0.72 -3.04 121.76 125.01 1ark s ALA 8 Ca -0.04 -1.04 0.23 0.00 0.00 0.00 0.00 51.96 51.11 1ark s ALA 8 Cb -0.01 -1.34 0.38 0.00 0.00 0.00 0.00 23.12 22.15 1ark s ALA 8 CO -0.02 0.72 1.15 -1.33 0.00 0.00 0.00 175.76 176.27 1ark n MET 9 N 0.62 0.01 -3.37 0.00 2.81 -1.26 -3.94 117.12 111.99 1ark n MET 9 Ca -0.10 -1.89 -0.11 0.00 -1.81 0.00 0.00 57.70 53.79 1ark n MET 9 Cb 0.52 -0.08 -0.09 0.00 -0.71 0.00 0.00 33.22 32.86 1ark n MET 9 CO 0.00 0.00 0.00 0.71 1.51 0.00 0.00 175.97 178.19 1ark s TYR 10 N -0.03 -0.73 0.23 2.03 2.02 -1.26 -4.98 117.35 114.63 1ark s TYR 10 Ca 0.30 0.72 -0.32 0.00 -0.37 0.00 0.00 57.07 57.40 1ark s TYR 10 Cb 0.34 -0.05 -0.13 0.00 -0.40 0.00 0.00 41.96 41.72 1ark s TYR 10 CO -0.15 -0.70 1.45 -0.25 -1.57 0.00 0.00 175.55 174.33 1ark n ASP 11 N 5.36 2.90 -3.77 2.29 8.00 -1.26 -4.44 116.55 125.63 1ark n ASP 11 Ca -0.04 1.13 -0.13 0.00 0.71 0.00 0.00 54.79 56.47 1ark n ASP 11 Cb 0.50 -1.44 -0.12 0.00 -0.02 0.00 0.00 41.12 40.04 1ark n ASP 11 CO 0.00 0.00 0.00 -0.47 -0.39 0.00 0.00 177.20 176.34 1ark s TYR 12 N 0.13 -0.31 -0.46 1.24 5.04 -1.19 -4.84 117.35 116.95 1ark s TYR 12 Ca 0.70 0.74 -0.13 0.00 -2.44 0.00 0.00 57.07 55.94 1ark s TYR 12 Cb -0.64 0.09 0.09 0.00 0.35 0.00 0.00 41.96 41.85 1ark s TYR 12 CO 0.47 -0.17 0.36 1.41 -1.34 0.00 0.00 175.55 176.29 1ark s MET 13 N 0.44 2.82 -0.38 4.97 -2.45 -1.26 -0.45 119.30 122.98 1ark s MET 13 Ca -0.02 -1.47 -0.41 0.00 -1.25 0.00 0.00 55.69 52.53 1ark s MET 13 Cb -0.04 -4.03 -0.16 0.00 1.25 0.00 0.00 34.83 31.85 1ark s MET 13 CO -0.02 -1.06 1.92 0.00 1.05 0.00 0.00 175.02 176.90 1ark n ALA 14 N 5.09 0.02 -0.03 4.11 0.00 -1.20 -4.84 120.51 123.66 1ark n ALA 14 Ca -0.11 0.26 -0.14 0.00 0.00 0.00 0.00 53.44 53.45 1ark n ALA 14 Cb 0.43 -2.22 -0.10 0.00 0.00 0.00 0.00 19.45 17.56 1ark n ALA 14 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1ark h ALA 15 N 8.49 0.06 -3.37 0.00 0.00 -1.89 -3.45 119.26 119.09 1ark h ALA 15 Ca -0.33 -0.33 -0.65 0.00 0.00 0.00 0.00 54.91 53.60 1ark h ALA 15 Cb 1.35 -0.01 -0.12 0.00 0.00 0.00 0.00 17.79 19.01 1ark h ALA 15 CO 1.01 -0.08 -0.67 -0.51 0.00 0.00 0.00 179.25 178.99 1ark s ASP 16 N -5.96 4.92 0.56 0.00 1.11 -1.26 -4.98 116.67 111.05 1ark s ASP 16 Ca -0.16 -0.22 0.30 0.00 0.18 0.00 0.00 52.55 52.66 1ark s ASP 16 Cb 0.02 -1.13 1.46 0.00 1.07 0.00 0.00 42.92 44.34 1ark s ASP 16 CO 0.71 0.17 1.87 0.00 1.18 0.00 0.00 175.17 179.10 1ark h ALA 17 N 3.44 2.61 -0.48 5.23 0.00 -2.01 0.21 119.26 128.25 1ark h ALA 17 Ca -0.48 -0.03 -0.03 0.00 0.00 0.00 0.00 54.91 54.38 1ark h ALA 17 Cb 1.17 0.06 -0.02 0.00 0.00 0.00 0.00 17.79 18.99 1ark h ALA 17 CO 0.58 -0.99 0.19 -0.44 0.00 0.00 0.00 179.25 178.60 1ark h ASP 18 N 0.00 0.63 -3.71 0.00 3.32 -1.94 -3.44 116.42 111.29 1ark h ASP 18 Ca 0.35 -0.07 -0.46 0.00 0.02 0.00 0.00 57.03 56.87 1ark h ASP 18 Cb 1.56 -0.16 0.09 0.00 0.22 0.00 0.00 39.33 41.04 1ark h ASP 18 CO -0.00 0.58 0.26 -1.61 -1.72 0.00 0.00 179.24 176.75 1ark s GLU 19 N -5.31 1.87 0.39 3.56 8.01 0.72 0.17 118.70 128.10 1ark s GLU 19 Ca -0.09 -0.34 0.07 0.00 0.01 0.00 0.00 54.97 54.62 1ark s GLU 19 Cb 0.16 -2.11 -0.08 0.00 -4.31 0.00 0.00 34.13 27.79 1ark s GLU 19 CO 0.77 -1.49 -0.00 0.14 0.01 0.00 0.00 175.26 174.69 1ark s VAL 20 N -3.37 1.95 -0.21 2.63 -7.23 -1.16 -4.51 120.40 108.49 1ark s VAL 20 Ca 0.63 -2.03 -0.08 0.00 -1.81 0.00 0.00 61.98 58.69 1ark s VAL 20 Cb -0.09 -2.91 -0.04 0.00 0.56 0.00 0.00 36.38 33.90 1ark s VAL 20 CO 0.46 -0.04 0.09 -0.55 -0.31 0.00 0.00 175.10 174.75 1ark s SER 21 N -3.67 5.61 0.67 4.85 0.15 -1.26 -3.22 113.70 116.83 1ark s SER 21 Ca 0.35 0.01 -0.08 0.00 0.70 0.00 0.00 55.95 56.93 1ark s SER 21 Cb 0.09 -1.99 0.03 0.00 -1.71 0.00 0.00 66.02 62.44 1ark s SER 21 CO 0.17 0.09 1.00 -0.36 1.20 0.00 0.00 173.24 175.34 1ark s PHE 22 N 0.88 3.11 -0.20 3.44 0.08 0.40 -4.84 117.98 120.85 1ark s PHE 22 Ca 0.05 0.65 -0.08 0.00 0.12 0.00 0.00 56.93 57.66 1ark s PHE 22 Cb -0.14 -3.03 0.09 0.00 -0.57 0.00 0.00 43.02 39.38 1ark s PHE 22 CO 0.03 -1.18 0.44 0.21 -0.10 0.00 0.00 175.22 174.62 1ark s LYS 23 N -5.20 0.37 -0.88 0.44 2.47 -1.26 -3.14 119.74 112.53 1ark s LYS 23 Ca 0.58 1.03 -0.21 0.00 -1.56 0.00 0.00 55.97 55.80 1ark s LYS 23 Cb -0.11 0.31 -0.22 0.00 -1.46 0.00 0.00 37.83 36.35 1ark s LYS 23 CO 0.46 -0.23 2.41 -3.47 0.16 0.00 0.00 175.35 174.69 1ark n ASP 24 N 5.16 0.25 0.00 1.43 2.03 -1.26 -1.25 116.55 122.91 1ark n ASP 24 Ca -0.12 -0.49 0.00 0.00 0.52 0.00 0.00 54.79 54.70 1ark n ASP 24 Cb 0.51 -1.02 0.00 0.00 -0.72 0.00 0.00 41.12 39.89 1ark n ASP 24 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 1ark n GLY 25 N 6.13 1.83 3.92 0.27 0.00 -1.25 -5.09 105.19 110.99 1ark n GLY 25 Ca 0.59 0.00 -0.21 0.00 0.00 0.00 0.00 46.02 46.39 1ark n GLY 25 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1ark s ASP 26 N -1.93 5.04 0.05 1.61 -1.08 -0.38 -4.98 116.67 115.00 1ark s ASP 26 Ca 0.00 -0.82 -0.11 0.00 -0.52 0.00 0.00 52.55 51.10 1ark s ASP 26 Cb 0.00 -0.27 0.01 0.00 -1.46 0.00 0.00 42.92 41.20 1ark s ASP 26 CO 0.00 -0.85 0.24 0.00 0.52 0.00 0.00 175.17 175.08 1ark s ALA 27 N -2.54 -0.47 -0.05 3.66 0.00 -1.26 -1.76 121.76 119.34 1ark s ALA 27 Ca 0.48 -0.23 0.06 0.00 0.00 0.00 0.00 51.96 52.27 1ark s ALA 27 Cb -0.04 0.34 -0.01 0.00 0.00 0.00 0.00 23.12 23.41 1ark s ALA 27 CO 0.29 -0.41 -0.25 0.42 0.00 0.00 0.00 175.76 175.80 1ark s ILE 28 N -2.81 2.04 0.00 0.00 -1.09 -1.25 -3.03 121.20 115.06 1ark s ILE 28 Ca -0.03 -1.07 0.00 0.00 -2.23 0.00 0.00 60.65 57.32 1ark s ILE 28 Cb 0.00 -1.72 0.00 0.00 -1.58 0.00 0.00 42.46 39.16 1ark s ILE 28 CO -0.05 0.57 0.00 2.30 -1.23 0.00 0.00 174.94 176.53 1ark n ILE 29 N 2.89 0.00 -3.48 2.92 -5.35 -1.26 -3.75 119.36 111.33 1ark n ILE 29 Ca -0.17 0.00 -0.41 0.00 -0.27 0.00 0.00 62.75 61.90 1ark n ILE 29 Cb 0.52 -0.25 -0.03 0.00 -1.74 0.00 0.00 39.64 38.13 1ark n ILE 29 CO 0.00 0.00 0.00 0.20 -1.76 0.00 0.00 176.55 174.99 1ark s ASN 30 N -1.55 6.60 0.00 7.28 0.01 -1.26 -4.75 114.94 121.27 1ark s ASN 30 Ca 0.00 -3.49 0.00 0.00 -0.71 0.00 0.00 52.86 48.66 1ark s ASN 30 Cb 0.00 -2.07 0.00 0.00 0.41 0.00 0.00 41.25 39.59 1ark s ASN 30 CO 0.00 -0.28 0.00 0.52 -1.51 0.00 0.00 177.10 175.83 1ark n VAL 31 N 2.76 0.00 -3.57 1.60 0.31 -1.26 -5.07 118.33 113.09 1ark n VAL 31 Ca 0.21 0.00 -0.12 0.00 -0.01 0.00 0.00 64.34 64.42 1ark n VAL 31 Cb 0.39 -0.80 -0.05 0.00 -0.91 0.00 0.00 33.84 32.47 1ark n VAL 31 CO 0.00 0.00 0.00 -1.10 -1.32 0.00 0.00 176.83 174.41 1ark s GLN 32 N 0.00 0.66 0.00 5.55 -0.21 -1.03 -5.05 119.66 119.59 1ark s GLN 32 Ca 0.00 0.20 0.00 0.00 0.02 0.00 0.00 55.36 55.58 1ark s GLN 32 Cb 0.00 0.31 0.00 0.00 1.00 0.00 0.00 33.01 34.32 1ark s GLN 32 CO 0.00 -0.20 0.00 0.00 -2.12 0.00 0.00 175.29 172.97 1ark n ALA 33 N 0.86 0.00 0.00 6.09 0.00 -1.26 -1.87 120.51 124.33 1ark n ALA 33 Ca -0.12 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.32 1ark n ALA 33 Cb 0.58 0.00 0.00 0.00 0.00 0.00 0.00 19.45 20.03 1ark n ALA 33 CO 0.00 0.00 0.00 -0.89 0.00 0.00 0.00 177.50 176.61 1ark n ILE 34 N 0.00 0.00 -0.52 0.00 5.41 -1.26 -4.85 119.36 118.13 1ark n ILE 34 Ca 0.00 0.00 -0.29 0.00 1.00 0.00 0.00 62.75 63.46 1ark n ILE 34 Cb 0.00 0.00 0.23 0.00 -0.71 0.00 0.00 39.64 39.16 1ark n ILE 34 CO 0.00 0.00 0.00 -0.67 0.00 0.00 0.00 176.55 175.88 1ark n ASP 35 N 1.19 -2.41 -0.63 4.38 2.03 -1.26 -4.71 116.55 115.14 1ark n ASP 35 Ca 0.00 -0.26 0.00 0.00 0.52 0.00 0.00 54.79 55.05 1ark n ASP 35 Cb 0.00 -1.07 0.00 0.00 -0.72 0.00 0.00 41.12 39.33 1ark n ASP 35 CO 0.00 0.00 0.00 1.21 -1.92 0.00 0.00 177.20 176.49 1ark n GLU 36 N -3.72 0.00 -0.03 -0.67 2.13 -1.26 -4.31 120.64 112.79 1ark n GLU 36 Ca 0.03 0.00 -0.01 0.00 0.66 0.00 0.00 57.16 57.84 1ark n GLU 36 Cb 0.57 0.00 -0.13 0.00 0.27 0.00 0.00 31.44 32.14 1ark n GLU 36 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 1ark n GLY 37 N 0.00 -1.07 3.58 8.31 0.00 -1.26 -4.96 105.19 109.79 1ark n GLY 37 Ca 0.00 -0.31 -0.24 0.00 0.00 0.00 0.00 46.02 45.47 1ark n GLY 37 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 1ark s TRP 38 N -2.92 2.48 0.60 1.61 0.52 -1.26 -4.66 118.94 115.30 1ark s TRP 38 Ca -0.07 -0.39 -0.02 0.00 0.02 0.00 0.00 56.10 55.64 1ark s TRP 38 Cb 0.09 -1.30 0.04 0.00 -1.15 0.00 0.00 33.47 31.15 1ark s TRP 38 CO 0.84 0.58 0.85 1.41 0.02 0.00 0.00 176.95 180.66 1ark s MET 39 N -3.64 2.46 -0.09 4.98 -2.45 0.43 -4.69 119.30 116.30 1ark s MET 39 Ca 0.33 -0.58 -0.06 0.00 -1.25 0.00 0.00 55.69 54.12 1ark s MET 39 Cb -0.02 -2.38 0.03 0.00 1.25 0.00 0.00 34.83 33.71 1ark s MET 39 CO 0.18 -0.87 0.22 -0.47 1.05 0.00 0.00 175.02 175.13 1ark s TYR 40 N -2.92 -0.26 -0.02 4.11 5.04 -0.78 0.73 117.35 123.25 1ark s TYR 40 Ca 0.58 0.63 -0.20 0.00 -2.44 0.00 0.00 57.07 55.63 1ark s TYR 40 Cb -0.10 0.06 0.07 0.00 0.35 0.00 0.00 41.96 42.33 1ark s TYR 40 CO 0.41 -0.15 0.91 0.41 -1.34 0.00 0.00 175.55 175.79 1ark n GLY 41 N 3.45 0.32 3.46 8.97 0.00 -1.19 -2.46 105.19 117.73 1ark n GLY 41 Ca -0.18 -0.98 -0.33 0.00 0.00 0.00 0.00 46.02 44.53 1ark n GLY 41 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1ark s THR 42 N -2.05 3.12 0.10 2.61 2.01 -1.26 -2.82 115.64 117.35 1ark s THR 42 Ca 0.22 -0.68 -0.31 0.00 0.31 0.00 0.00 61.69 61.22 1ark s THR 42 Cb -0.00 -2.25 -0.07 0.00 0.01 0.00 0.00 72.50 70.18 1ark s THR 42 CO -0.01 0.57 1.35 -0.69 -0.69 0.00 0.00 174.62 175.15 1ark s VAL 43 N -0.43 3.48 -0.76 3.82 1.01 -0.29 -4.12 120.40 123.10 1ark s VAL 43 Ca 0.05 1.06 0.26 0.00 0.00 0.00 0.00 61.98 63.36 1ark s VAL 43 Cb -0.12 -3.68 0.28 0.00 0.00 0.00 0.00 36.38 32.86 1ark s VAL 43 CO 0.02 0.08 1.79 0.00 0.00 0.00 0.00 175.10 176.99 1ark n GLN 44 N 3.97 0.23 0.05 2.72 1.13 -1.17 -0.45 117.38 123.86 1ark n GLN 44 Ca 0.11 0.20 -0.20 0.00 -1.94 0.00 0.00 57.00 55.16 1ark n GLN 44 Cb 0.43 -1.77 -0.14 0.00 0.11 0.00 0.00 30.24 28.87 1ark n GLN 44 CO 0.00 0.00 0.00 -0.09 -1.44 0.00 0.00 177.06 175.53 1ark h ARG 45 N 0.00 0.31 0.00 -1.09 2.43 -1.90 -3.42 114.38 110.70 1ark h ARG 45 Ca 0.00 -0.52 -0.20 0.00 -0.81 0.00 0.00 59.98 58.45 1ark h ARG 45 Cb 0.70 0.19 -0.03 0.00 -0.42 0.00 0.00 29.97 30.41 1ark h ARG 45 CO 0.00 1.20 -1.70 0.25 -1.51 0.00 0.00 179.97 178.21 1ark n THR 46 N -3.50 0.70 0.00 0.20 -2.24 -1.24 -5.03 114.28 103.17 1ark n THR 46 Ca -0.25 -0.23 0.00 0.00 -2.27 0.00 0.00 64.05 61.30 1ark n THR 46 Cb 1.06 -1.21 0.00 0.00 -2.10 0.00 0.00 70.33 68.08 1ark n THR 46 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1ark n GLY 47 N 2.65 2.16 3.77 3.38 0.00 0.41 -5.02 105.19 112.53 1ark n GLY 47 Ca -0.23 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.38 1ark n GLY 47 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1ark n ARG 48 N -0.72 2.66 -5.01 1.61 1.74 -1.26 -4.36 116.66 111.32 1ark n ARG 48 Ca 0.00 0.93 -0.32 0.00 -0.77 0.00 0.00 57.85 57.69 1ark n ARG 48 Cb 0.00 -2.66 -0.16 0.00 -1.02 0.00 0.00 32.46 28.62 1ark n ARG 48 CO 0.00 0.00 0.00 0.99 -1.52 0.00 0.00 177.63 177.10 1ark s THR 49 N -1.09 2.50 0.00 0.55 2.01 -1.26 -1.14 115.64 117.21 1ark s THR 49 Ca 0.53 -0.86 0.00 0.00 0.31 0.00 0.00 61.69 61.67 1ark s THR 49 Cb -0.48 -2.00 0.00 0.00 0.01 0.00 0.00 72.50 70.03 1ark s THR 49 CO 0.63 0.54 0.00 0.61 -0.69 0.00 0.00 174.62 175.72 1ark n GLY 50 N 3.54 3.10 3.84 4.40 0.00 -1.13 -4.90 105.19 114.04 1ark n GLY 50 Ca -0.19 -0.73 -0.34 0.00 0.00 0.00 0.00 46.02 44.76 1ark n GLY 50 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 1ark s MET 51 N 1.13 4.05 -0.06 1.61 -1.94 0.44 -3.17 119.30 121.37 1ark s MET 51 Ca 0.00 0.65 0.03 0.00 -1.71 0.00 0.00 55.69 54.66 1ark s MET 51 Cb 0.00 -2.69 0.00 0.00 2.01 0.00 0.00 34.83 34.15 1ark s MET 51 CO 0.00 0.31 -0.15 -0.51 -0.01 0.00 0.00 175.02 174.66 1ark s LEU 52 N -2.45 1.81 -0.21 -0.03 1.02 0.22 -2.98 118.68 116.06 1ark s LEU 52 Ca 0.47 -0.34 -0.29 0.00 0.02 0.00 0.00 54.13 53.98 1ark s LEU 52 Cb -0.13 -0.93 -0.02 0.00 0.02 0.00 0.00 46.19 45.13 1ark s LEU 52 CO 0.19 0.10 1.48 -2.16 0.02 0.00 0.00 176.35 175.98 1ark s PRO 53 N 0.35 3.95 0.57 1.29 0.04 -1.26 0.16 135.00 140.11 1ark s PRO 53 Ca -0.10 1.63 0.26 0.00 0.04 0.00 0.00 61.00 62.83 1ark s PRO 53 Cb -0.14 -3.94 1.60 0.00 0.04 0.00 0.00 34.50 32.06 1ark s PRO 53 CO 0.04 -1.09 2.13 0.00 0.04 0.00 0.00 177.00 178.12 1ark h ALA 54 N 9.76 1.86 0.00 8.56 0.00 -1.88 0.25 119.26 137.81 1ark h ALA 54 Ca -0.31 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.59 1ark h ALA 54 Cb 1.13 0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.93 1ark h ALA 54 CO 1.00 -0.22 0.00 -1.71 0.00 0.00 0.00 179.25 178.31 1ark n ASN 55 N -4.00 0.00 -0.01 0.00 5.15 -1.26 -3.97 115.26 111.17 1ark n ASN 55 Ca 0.01 0.02 -0.02 0.00 -0.60 0.00 0.00 54.58 53.99 1ark n ASN 55 Cb 0.27 -0.27 -0.01 0.00 -0.53 0.00 0.00 39.78 39.24 1ark n ASN 55 CO 0.00 0.00 0.00 -1.22 1.40 0.00 0.00 177.26 177.44 1ark n TYR 56 N -1.27 0.00 -1.44 1.20 4.02 0.07 -5.03 117.16 114.71 1ark n TYR 56 Ca 0.08 0.00 -0.29 0.00 -0.01 0.00 0.00 57.90 57.68 1ark n TYR 56 Cb 0.13 -0.10 0.14 0.00 -0.02 0.00 0.00 39.34 39.48 1ark n TYR 56 CO 0.00 0.00 0.00 0.14 -1.01 0.00 0.00 176.86 175.99 1ark s VAL 57 N -1.49 2.28 -0.06 -0.72 -7.23 -1.18 -4.41 120.40 107.59 1ark s VAL 57 Ca -0.06 0.09 -0.31 0.00 -1.81 0.00 0.00 61.98 59.89 1ark s VAL 57 Cb 0.01 -2.76 0.11 0.00 0.56 0.00 0.00 36.38 34.30 1ark s VAL 57 CO 0.09 -0.12 1.02 -1.83 -0.31 0.00 0.00 175.10 173.95 1ark s GLU 58 N -5.16 0.65 0.49 4.82 -1.05 -1.17 -4.83 118.70 112.45 1ark s GLU 58 Ca 0.63 -0.26 -0.21 0.00 -0.15 0.00 0.00 54.97 54.98 1ark s GLU 58 Cb -0.16 0.29 -0.07 0.00 -0.44 0.00 0.00 34.13 33.75 1ark s GLU 58 CO 0.55 -0.29 1.13 0.00 0.95 0.00 0.00 175.26 177.60 1ark s ALA 59 N -2.86 2.87 0.00 -0.84 0.00 -1.26 -2.83 121.76 116.84 1ark s ALA 59 Ca 0.07 0.84 0.00 0.00 0.00 0.00 0.00 51.96 52.87 1ark s ALA 59 Cb -0.01 -3.35 0.00 0.00 0.00 0.00 0.00 23.12 19.76 1ark s ALA 59 CO -0.06 -0.63 0.26 0.44 0.00 0.00 0.00 175.76 175.77