#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 4pal n PHE 2 N 0.00 -0.83 -1.47 7.33 1.16 -1.26 -1.95 117.46 120.44 4pal n PHE 2 Ca 0.00 0.44 -0.10 0.00 -1.87 0.00 0.00 57.45 55.92 4pal n PHE 2 Cb 0.00 -0.90 -0.04 0.00 -1.61 0.00 0.00 39.48 36.93 4pal n PHE 2 CO 0.00 0.00 0.00 0.00 -1.87 0.00 0.00 176.76 174.89 4pal n ALA 3 N -1.97 -0.26 -2.66 1.98 0.00 -1.26 -2.22 120.51 114.13 4pal n ALA 3 Ca -0.00 0.16 -0.20 0.00 0.00 0.00 0.00 53.44 53.39 4pal n ALA 3 Cb 0.02 -1.18 0.01 0.00 0.00 0.00 0.00 19.45 18.30 4pal n ALA 3 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 4pal n GLY 4 N -0.28 -0.45 3.82 0.00 0.00 -1.25 -4.88 105.19 102.15 4pal n GLY 4 Ca -0.11 0.01 -0.33 0.00 0.00 0.00 0.00 46.02 45.59 4pal n GLY 4 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 4pal s LEU 6 N -5.99 3.67 0.09 0.99 1.43 -0.82 -5.04 118.68 113.01 4pal s LEU 6 Ca 0.13 1.72 -0.20 0.00 -1.03 0.00 0.00 54.13 54.76 4pal s LEU 6 Cb -0.06 -4.53 -0.07 0.00 0.03 0.00 0.00 46.19 41.56 4pal s LEU 6 CO 0.17 -0.76 0.59 -0.54 0.23 0.00 0.00 176.35 176.04 4pal s LYS 7 N -3.79 4.23 0.41 1.70 1.02 -1.26 -4.66 119.74 117.38 4pal s LYS 7 Ca 0.62 0.77 0.10 0.00 0.02 0.00 0.00 55.97 57.48 4pal s LYS 7 Cb -0.13 -3.22 0.92 0.00 -0.52 0.00 0.00 37.83 34.88 4pal s LYS 7 CO 0.28 0.62 2.00 -0.44 -0.92 0.00 0.00 175.35 176.89 4pal h ASP 8 N 4.43 0.46 0.74 2.83 3.45 -1.96 -0.18 116.42 126.21 4pal h ASP 8 Ca -0.49 0.00 -0.09 0.00 0.43 0.00 0.00 57.03 56.88 4pal h ASP 8 Cb 1.21 -0.10 -0.01 0.00 -0.56 0.00 0.00 39.33 39.87 4pal h ASP 8 CO 0.64 0.30 -0.43 0.00 -1.57 0.00 0.00 179.24 178.18 4pal h ALA 9 N 1.69 1.02 0.00 3.45 0.00 -1.99 -1.38 119.26 122.05 4pal h ALA 9 Ca 0.25 -0.39 -0.19 0.00 0.00 0.00 0.00 54.91 54.58 4pal h ALA 9 Cb 0.31 -0.07 -0.03 0.00 0.00 0.00 0.00 17.79 18.00 4pal h ALA 9 CO -0.07 0.54 -0.94 -0.44 0.00 0.00 0.00 179.25 178.33 4pal h ASP 10 N 0.00 0.00 -0.40 0.00 3.32 -1.42 -2.13 116.42 115.79 4pal h ASP 10 Ca -0.00 0.00 -0.11 0.00 0.02 0.00 0.00 57.03 56.94 4pal h ASP 10 Cb 0.92 0.00 -0.01 0.00 0.22 0.00 0.00 39.33 40.46 4pal h ASP 10 CO 0.06 0.89 -0.17 0.58 -1.72 0.00 0.00 179.24 178.88 4pal h VAL 11 N 0.00 1.28 -0.48 -1.35 2.07 -0.95 0.12 116.25 116.95 4pal h VAL 11 Ca -0.03 -1.30 -0.04 0.00 0.82 0.00 0.00 66.70 66.16 4pal h VAL 11 Cb 1.70 1.28 -0.02 0.00 -1.52 0.00 0.00 31.29 32.73 4pal h VAL 11 CO 0.11 0.43 0.14 0.00 0.02 0.00 0.00 177.57 178.28 4pal h ALA 12 N 0.82 0.62 0.00 1.67 0.00 -1.23 -0.68 119.26 120.46 4pal h ALA 12 Ca 0.09 -0.18 -0.13 0.00 0.00 0.00 0.00 54.91 54.69 4pal h ALA 12 Cb 0.72 -0.18 -0.02 0.00 0.00 0.00 0.00 17.79 18.31 4pal h ALA 12 CO 0.05 0.28 -0.60 0.00 0.00 0.00 0.00 179.25 178.99 4pal h ALA 13 N 1.00 0.94 -0.08 0.00 0.00 -1.30 -1.66 119.26 118.16 4pal h ALA 13 Ca 0.15 -0.55 -0.16 0.00 0.00 0.00 0.00 54.91 54.35 4pal h ALA 13 Cb 0.28 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 17.96 4pal h ALA 13 CO -0.00 0.75 -0.65 0.00 0.00 0.00 0.00 179.25 179.35 4pal h ALA 14 N 1.40 0.73 -0.16 0.00 0.00 -0.51 -1.46 119.26 119.27 4pal h ALA 14 Ca -0.01 -0.57 -0.15 0.00 0.00 0.00 0.00 54.91 54.18 4pal h ALA 14 Cb 1.11 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 18.82 4pal h ALA 14 CO 0.08 0.75 -0.53 -0.07 0.00 0.00 0.00 179.25 179.47 4pal h LEU 15 N 0.24 0.49 -0.95 0.00 3.38 -1.00 -2.90 115.31 114.56 4pal h LEU 15 Ca -0.01 -0.26 -0.06 0.00 0.09 0.00 0.00 57.88 57.64 4pal h LEU 15 Cb 1.19 -0.14 -0.02 0.00 0.09 0.00 0.00 40.66 41.78 4pal h LEU 15 CO 0.11 0.93 0.06 0.00 0.09 0.00 0.00 178.44 179.63 4pal h ALA 16 N 1.08 1.14 0.00 1.53 0.00 -1.01 -2.62 119.26 119.37 4pal h ALA 16 Ca 0.01 -0.24 -0.04 0.00 0.00 0.00 0.00 54.91 54.64 4pal h ALA 16 Cb 1.04 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 18.62 4pal h ALA 16 CO 0.09 0.56 -0.21 0.00 0.00 0.00 0.00 179.25 179.69 4pal h ALA 17 N 1.28 1.02 -0.19 0.00 0.00 -1.08 -2.66 119.26 117.64 4pal h ALA 17 Ca 0.16 -0.19 -0.14 0.00 0.00 0.00 0.00 54.91 54.74 4pal h ALA 17 Cb 0.38 -0.03 -0.12 0.00 0.00 0.00 0.00 17.79 18.02 4pal h ALA 17 CO 0.01 0.27 -0.60 0.00 0.00 0.00 0.00 179.25 178.93 4pal h SER 19 N 1.30 0.00 -3.76 0.00 4.64 -1.10 -3.42 113.55 111.21 4pal h SER 19 Ca 0.08 0.00 -0.49 0.00 -0.47 0.00 0.00 61.79 60.91 4pal h SER 19 Cb 1.16 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 63.23 4pal h SER 19 CO 0.19 0.39 0.37 0.00 -0.87 0.00 0.00 176.83 176.91 4pal s ALA 20 N -3.67 3.35 0.39 5.18 0.00 -1.26 -5.00 121.76 120.74 4pal s ALA 20 Ca -0.00 0.66 -0.27 0.00 0.00 0.00 0.00 51.96 52.35 4pal s ALA 20 Cb 0.11 -3.23 -0.11 0.00 0.00 0.00 0.00 23.12 19.90 4pal s ALA 20 CO 0.69 0.15 1.43 0.00 0.00 0.00 0.00 175.76 178.03 4pal n ALA 21 N 1.42 2.06 -1.46 0.00 0.00 -1.26 -1.04 120.51 120.23 4pal n ALA 21 Ca -0.02 0.33 -0.16 0.00 0.00 0.00 0.00 53.44 53.59 4pal n ALA 21 Cb 0.47 -2.38 -0.07 0.00 0.00 0.00 0.00 19.45 17.47 4pal n ALA 21 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.50 177.25 4pal n ASP 22 N 0.39 -5.48 -0.58 0.00 10.43 -1.26 -4.86 116.55 115.19 4pal n ASP 22 Ca 0.03 0.39 0.12 0.00 2.57 0.00 0.00 54.79 57.90 4pal n ASP 22 Cb 0.39 -4.36 0.19 0.00 1.84 0.00 0.00 41.12 39.18 4pal n ASP 22 CO 0.00 0.00 0.00 -1.54 -1.07 0.00 0.00 177.20 174.59 4pal n SER 23 N -1.15 2.03 -4.73 -2.24 3.41 -0.20 -4.91 113.62 105.84 4pal n SER 23 Ca -0.16 -1.54 -0.41 0.00 -0.26 0.00 0.00 58.87 56.50 4pal n SER 23 Cb 0.61 0.19 -0.04 0.00 -0.26 0.00 0.00 64.21 64.71 4pal n SER 23 CO 0.00 0.00 0.00 0.12 -0.16 0.00 0.00 175.04 175.00 4pal s PHE 24 N -2.26 3.64 -0.13 7.33 2.19 -1.26 -4.75 117.98 122.74 4pal s PHE 24 Ca 0.26 1.62 -0.02 0.00 0.33 0.00 0.00 56.93 59.12 4pal s PHE 24 Cb 0.19 -3.22 0.04 0.00 -1.31 0.00 0.00 43.02 38.72 4pal s PHE 24 CO 0.44 -0.43 -0.01 0.15 1.83 0.00 0.00 175.22 177.20 4pal s LYS 25 N 0.06 0.86 0.41 10.12 -0.14 -1.26 -4.92 119.74 124.87 4pal s LYS 25 Ca 0.50 -0.19 0.10 0.00 -1.36 0.00 0.00 55.97 55.03 4pal s LYS 25 Cb -0.27 -1.55 0.92 0.00 -1.68 0.00 0.00 37.83 35.26 4pal s LYS 25 CO 0.32 -0.42 1.99 1.12 -0.76 0.00 0.00 175.35 177.61 4pal h HIS 26 N 8.25 0.53 -0.23 3.18 2.07 -1.95 0.14 115.15 127.14 4pal h HIS 26 Ca -0.21 0.01 -0.10 0.00 -2.85 0.00 0.00 60.37 57.23 4pal h HIS 26 Cb 1.12 -0.17 -0.01 0.00 2.57 0.00 0.00 27.41 30.91 4pal h HIS 26 CO 0.41 0.28 -0.27 0.87 -3.07 0.00 0.00 177.93 176.15 4pal h LYS 27 N 0.52 0.46 -0.25 5.12 1.79 -1.98 0.15 116.57 122.38 4pal h LYS 27 Ca 0.25 -0.18 -0.17 0.00 -2.18 0.00 0.00 60.65 58.37 4pal h LYS 27 Cb 0.33 -0.02 0.00 0.00 -1.58 0.00 0.00 32.23 30.96 4pal h LYS 27 CO -0.07 0.69 -0.52 1.49 -1.08 0.00 0.00 179.45 179.96 4pal h GLU 28 N 0.40 0.79 -0.78 3.15 4.81 -1.76 -1.99 114.58 119.19 4pal h GLU 28 Ca 0.06 -0.52 -0.04 0.00 -0.13 0.00 0.00 59.36 58.72 4pal h GLU 28 Cb 0.69 0.07 -0.03 0.00 0.63 0.00 0.00 28.75 30.10 4pal h GLU 28 CO 0.05 1.15 0.32 0.35 -0.73 0.00 0.00 179.01 180.15 4pal h PHE 29 N 0.54 1.19 -0.14 0.92 3.04 -0.24 0.12 116.94 122.37 4pal h PHE 29 Ca 0.01 -0.09 -0.06 0.00 3.98 0.00 0.00 57.97 61.81 4pal h PHE 29 Cb 1.13 -0.36 -0.01 0.00 2.56 0.00 0.00 35.95 39.27 4pal h PHE 29 CO 0.08 0.89 -0.20 0.74 -2.02 0.00 0.00 178.31 177.81 4pal h PHE 30 N 1.13 0.25 -0.02 0.41 0.05 -0.38 0.17 116.94 118.55 4pal h PHE 30 Ca 0.26 -0.04 -0.07 0.00 3.82 0.00 0.00 57.97 61.94 4pal h PHE 30 Cb 0.20 -0.07 0.00 0.00 2.00 0.00 0.00 35.95 38.09 4pal h PHE 30 CO 0.02 0.43 -0.27 0.00 -0.18 0.00 0.00 178.31 178.30 4pal h ALA 31 N 1.58 0.06 -0.13 2.45 0.00 -0.95 -0.66 119.26 121.62 4pal h ALA 31 Ca 0.04 -0.45 0.01 0.00 0.00 0.00 0.00 54.91 54.51 4pal h ALA 31 Cb 0.48 0.01 -0.01 0.00 0.00 0.00 0.00 17.79 18.27 4pal h ALA 31 CO 0.03 0.11 0.05 0.87 0.00 0.00 0.00 179.25 180.31 4pal h LYS 32 N -0.38 0.11 0.00 0.00 1.57 -0.31 -2.51 116.57 115.06 4pal h LYS 32 Ca -0.03 -0.01 0.00 0.00 -1.87 0.00 0.00 60.65 58.75 4pal h LYS 32 Cb 0.98 -0.03 0.00 0.00 0.08 0.00 0.00 32.23 33.27 4pal h LYS 32 CO 0.06 0.08 0.00 1.55 -0.57 0.00 0.00 179.45 180.56 4pal n VAL 33 N -5.05 1.00 0.00 0.50 3.14 0.56 -4.76 118.33 113.72 4pal n VAL 33 Ca -0.04 0.36 0.00 0.00 -2.96 0.00 0.00 64.34 61.70 4pal n VAL 33 Cb 0.05 -1.27 0.00 0.00 -1.06 0.00 0.00 33.84 31.56 4pal n VAL 33 CO 0.00 0.00 0.00 0.61 -6.46 0.00 0.00 176.83 170.98 4pal n GLY 34 N -0.39 0.51 0.08 7.55 0.00 -0.94 -4.55 105.19 107.45 4pal n GLY 34 Ca 0.01 0.00 -0.06 0.00 0.00 0.00 0.00 46.02 45.98 4pal n GLY 34 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 4pal h LEU 35 N 0.00 0.00 -2.40 0.99 5.85 -1.38 -3.26 115.31 115.10 4pal h LEU 35 Ca 0.00 0.00 0.03 0.00 0.84 0.00 0.00 57.88 58.75 4pal h LEU 35 Cb 0.00 0.00 -0.00 0.00 0.37 0.00 0.00 40.66 41.03 4pal h LEU 35 CO 0.00 0.90 0.14 0.00 -0.34 0.00 0.00 178.44 179.14 4pal h ALA 36 N 1.10 1.53 -0.14 1.25 0.00 -1.65 -0.28 119.26 121.07 4pal h ALA 36 Ca -0.17 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.74 4pal h ALA 36 Cb 1.83 0.01 0.00 0.00 0.00 0.00 0.00 17.79 19.63 4pal h ALA 36 CO 0.09 -0.19 0.00 -1.13 0.00 0.00 0.00 179.25 178.02 4pal n SER 37 N -3.54 2.98 -4.74 0.00 3.41 -1.23 -4.85 113.62 105.64 4pal n SER 37 Ca -0.01 -1.92 -0.29 0.00 -0.26 0.00 0.00 58.87 56.40 4pal n SER 37 Cb 0.24 -0.08 0.14 0.00 -0.26 0.00 0.00 64.21 64.25 4pal n SER 37 CO 0.00 0.00 0.00 -0.54 -0.16 0.00 0.00 175.04 174.34 4pal s LYS 38 N -1.66 1.06 0.66 4.33 -0.14 -0.12 -5.02 119.74 118.86 4pal s LYS 38 Ca 0.29 0.51 -0.15 0.00 -1.36 0.00 0.00 55.97 55.26 4pal s LYS 38 Cb 0.19 -1.81 0.00 0.00 -1.68 0.00 0.00 37.83 34.53 4pal s LYS 38 CO 0.28 -2.30 1.11 -1.54 -0.76 0.00 0.00 175.35 172.14 4pal s SER 39 N -3.71 5.07 0.55 2.83 1.04 -1.26 -4.76 113.70 113.46 4pal s SER 39 Ca 0.64 1.99 0.26 0.00 0.48 0.00 0.00 55.95 59.33 4pal s SER 39 Cb -0.17 -2.55 1.46 0.00 0.10 0.00 0.00 66.02 64.87 4pal s SER 39 CO 0.56 -1.65 2.00 0.25 0.98 0.00 0.00 173.24 175.38 4pal h LEU 40 N -0.02 0.00 -0.46 2.42 5.85 -1.96 0.12 115.31 121.25 4pal h LEU 40 Ca -0.47 0.00 -0.17 0.00 0.84 0.00 0.00 57.88 58.08 4pal h LEU 40 Cb 1.25 0.00 -0.00 0.00 0.37 0.00 0.00 40.66 42.27 4pal h LEU 40 CO 0.54 0.00 -0.62 0.44 -0.34 0.00 0.00 178.44 178.46 4pal h ASP 41 N 0.00 0.61 0.66 1.25 5.19 -1.99 -1.29 116.42 120.85 4pal h ASP 41 Ca 0.20 -0.35 -0.20 0.00 -0.62 0.00 0.00 57.03 56.06 4pal h ASP 41 Cb 0.91 -0.18 -0.01 0.00 0.18 0.00 0.00 39.33 40.23 4pal h ASP 41 CO -0.00 1.08 -0.92 0.44 -3.12 0.00 0.00 179.24 176.72 4pal h ASP 42 N 0.40 0.21 -0.90 6.45 3.32 -1.23 -2.18 116.42 122.49 4pal h ASP 42 Ca -0.01 -0.18 0.07 0.00 0.02 0.00 0.00 57.03 56.93 4pal h ASP 42 Cb 1.17 -0.07 -0.07 0.00 0.22 0.00 0.00 39.33 40.59 4pal h ASP 42 CO 0.11 1.02 0.56 0.58 -1.72 0.00 0.00 179.24 179.79 4pal h VAL 43 N 0.08 1.03 -0.36 -1.35 2.07 -0.80 -1.67 116.25 115.25 4pal h VAL 43 Ca -0.04 -0.34 -0.14 0.00 0.82 0.00 0.00 66.70 66.99 4pal h VAL 43 Cb 1.57 -0.06 -0.01 0.00 -1.52 0.00 0.00 31.29 31.27 4pal h VAL 43 CO 0.14 0.18 -0.34 0.11 0.02 0.00 0.00 177.57 177.68 4pal h LYS 44 N 1.01 0.83 -0.70 1.57 1.57 -1.13 -1.38 116.57 118.34 4pal h LYS 44 Ca 0.40 -0.40 0.01 0.00 -1.87 0.00 0.00 60.65 58.79 4pal h LYS 44 Cb 0.21 -0.00 -0.04 0.00 0.08 0.00 0.00 32.23 32.49 4pal h LYS 44 CO -0.19 1.04 0.45 0.87 -0.57 0.00 0.00 179.45 181.06 4pal h LYS 45 N 0.69 0.89 -0.12 3.15 1.57 -0.87 -1.13 116.57 120.75 4pal h LYS 45 Ca 0.07 -0.05 0.00 0.00 -1.87 0.00 0.00 60.65 58.79 4pal h LYS 45 Cb 0.90 -0.20 -0.01 0.00 0.08 0.00 0.00 32.23 33.00 4pal h LYS 45 CO 0.08 0.59 0.08 0.00 -0.57 0.00 0.00 179.45 179.63 4pal h ALA 46 N 1.27 0.15 -0.83 3.86 0.00 -1.17 -1.98 119.26 120.56 4pal h ALA 46 Ca 0.26 -0.01 0.18 0.00 0.00 0.00 0.00 54.91 55.34 4pal h ALA 46 Cb -0.07 -0.05 -0.11 0.00 0.00 0.00 0.00 17.79 17.56 4pal h ALA 46 CO -0.07 -0.35 0.34 0.35 0.00 0.00 0.00 179.25 179.51 4pal h PHE 47 N 0.15 0.56 0.00 0.00 3.57 -0.45 -1.23 116.94 119.55 4pal h PHE 47 Ca 0.04 0.04 0.00 0.00 3.53 0.00 0.00 57.97 61.58 4pal h PHE 47 Cb -0.01 -0.12 0.00 0.00 2.79 0.00 0.00 35.95 38.61 4pal h PHE 47 CO -0.07 0.01 0.00 1.88 -2.23 0.00 0.00 178.31 177.90 4pal h TYR 48 N 0.42 0.00 -0.12 0.41 0.05 -0.95 0.80 116.97 117.58 4pal h TYR 48 Ca 0.48 0.00 -0.13 0.00 0.05 0.00 0.00 58.73 59.13 4pal h TYR 48 Cb 0.82 0.00 0.00 0.00 1.01 0.00 0.00 36.73 38.57 4pal h TYR 48 CO -0.16 0.00 -0.44 0.28 -1.05 0.00 0.00 178.16 176.78 4pal h VAL 49 N 0.00 1.36 0.00 -2.88 2.07 -0.83 -3.28 116.25 112.70 4pal h VAL 49 Ca 0.00 -1.75 -0.06 0.00 0.82 0.00 0.00 66.70 65.71 4pal h VAL 49 Cb 0.87 2.13 -0.01 0.00 -1.52 0.00 0.00 31.29 32.76 4pal h VAL 49 CO 0.00 0.53 -0.28 0.40 0.02 0.00 0.00 177.57 178.24 4pal h ILE 50 N 0.12 0.77 -0.87 4.57 2.04 -0.60 -3.28 117.51 120.26 4pal h ILE 50 Ca -0.02 -1.16 -0.60 0.00 1.00 0.00 0.00 64.86 64.08 4pal h ILE 50 Cb 1.08 1.72 -0.08 0.00 -0.74 0.00 0.00 36.82 38.80 4pal h ILE 50 CO 0.09 0.27 1.81 -0.62 0.00 0.00 0.00 178.15 179.71 4pal s ASP 51 N -6.36 6.44 0.25 1.72 2.15 0.22 -4.81 116.67 116.28 4pal s ASP 51 Ca -0.01 -2.01 0.05 0.00 0.43 0.00 0.00 52.55 51.01 4pal s ASP 51 Cb 0.12 -2.58 0.30 0.00 -0.30 0.00 0.00 42.92 40.46 4pal s ASP 51 CO 0.65 -1.58 1.60 1.56 -0.17 0.00 0.00 175.17 177.24 4pal h GLN 52 N 8.59 0.25 -0.30 4.34 4.20 -1.81 -2.78 115.11 127.61 4pal h GLN 52 Ca 0.34 -0.16 0.00 0.00 0.06 0.00 0.00 58.65 58.89 4pal h GLN 52 Cb 0.92 0.02 0.00 0.00 0.30 0.00 0.00 27.48 28.72 4pal h GLN 52 CO 1.41 0.73 0.00 -0.40 -0.67 0.00 0.00 178.83 179.90 4pal n ASP 53 N -3.92 2.24 -1.22 1.46 5.68 -1.26 -4.92 116.55 114.61 4pal n ASP 53 Ca -0.02 -1.86 -0.13 0.00 -0.50 0.00 0.00 54.79 52.28 4pal n ASP 53 Cb 0.58 -0.19 -0.03 0.00 -1.14 0.00 0.00 41.12 40.33 4pal n ASP 53 CO 0.00 0.00 0.00 0.29 -1.33 0.00 0.00 177.20 176.16 4pal n LYS 54 N 0.71 -0.95 0.23 0.11 4.76 -1.05 -4.89 118.16 117.08 4pal n LYS 54 Ca 0.16 0.78 0.16 0.00 -2.87 0.00 0.00 58.31 56.54 4pal n LYS 54 Cb 0.40 -4.91 0.61 0.00 -1.84 0.00 0.00 35.03 29.29 4pal n LYS 54 CO 0.00 0.00 0.00 0.66 -1.37 0.00 0.00 177.40 176.69 4pal h SER 55 N 0.00 0.00 0.00 4.39 4.64 -1.91 -3.46 113.55 117.21 4pal h SER 55 Ca -0.28 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.04 4pal h SER 55 Cb 1.03 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.12 4pal h SER 55 CO 0.37 0.00 0.00 0.61 -0.87 0.00 0.00 176.83 176.94 4pal n GLY 56 N 0.09 0.75 3.26 -0.77 0.00 -1.26 -5.04 105.19 102.22 4pal n GLY 56 Ca 0.01 0.00 -0.17 0.00 0.00 0.00 0.00 46.02 45.86 4pal n GLY 56 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 4pal s PHE 57 N -2.68 1.41 -0.56 1.61 0.08 -1.26 -4.24 117.98 112.34 4pal s PHE 57 Ca 0.00 -0.62 -0.20 0.00 0.12 0.00 0.00 56.93 56.24 4pal s PHE 57 Cb 0.00 -0.72 0.08 0.00 -0.57 0.00 0.00 43.02 41.81 4pal s PHE 57 CO 0.00 0.16 0.71 0.42 -0.10 0.00 0.00 175.22 176.42 4pal s ILE 58 N -2.63 4.76 0.73 0.64 1.01 0.21 -4.77 121.20 121.16 4pal s ILE 58 Ca 0.13 -0.67 -0.12 0.00 0.00 0.00 0.00 60.65 60.00 4pal s ILE 58 Cb -0.02 -4.44 0.03 0.00 0.01 0.00 0.00 42.46 38.04 4pal s ILE 58 CO 0.03 -1.04 1.09 -1.61 0.00 0.00 0.00 174.94 173.41 4pal s GLU 59 N 2.88 2.52 0.35 2.79 8.01 -1.26 -0.50 118.70 133.48 4pal s GLU 59 Ca 0.15 1.18 0.03 0.00 0.01 0.00 0.00 54.97 56.34 4pal s GLU 59 Cb -0.21 -1.93 0.63 0.00 -4.31 0.00 0.00 34.13 28.31 4pal s GLU 59 CO 0.09 -1.44 1.97 1.49 0.01 0.00 0.00 175.26 177.39 4pal h GLU 60 N -0.75 0.74 0.00 1.61 4.81 -1.97 0.70 114.58 119.72 4pal h GLU 60 Ca -0.44 -0.07 -0.06 0.00 -0.13 0.00 0.00 59.36 58.65 4pal h GLU 60 Cb 1.23 -0.15 -0.01 0.00 0.63 0.00 0.00 28.75 30.45 4pal h GLU 60 CO 0.53 0.55 -0.29 0.38 -0.73 0.00 0.00 179.01 179.45 4pal h ASP 61 N 0.75 0.00 0.28 1.04 2.03 -1.97 -0.92 116.42 117.64 4pal h ASP 61 Ca 0.19 0.00 -0.19 0.00 -0.73 0.00 0.00 57.03 56.31 4pal h ASP 61 Cb 0.03 0.00 -0.00 0.00 -0.83 0.00 0.00 39.33 38.52 4pal h ASP 61 CO -0.03 0.29 -0.74 -0.33 -1.03 0.00 0.00 179.24 177.39 4pal h GLU 62 N 0.00 0.39 -0.23 4.15 5.08 -1.61 -3.19 114.58 119.16 4pal h GLU 62 Ca -0.00 -0.33 -0.12 0.00 -1.00 0.00 0.00 59.36 57.91 4pal h GLU 62 Cb 0.52 0.07 -0.01 0.00 0.50 0.00 0.00 28.75 29.83 4pal h GLU 62 CO 0.04 0.97 -0.37 1.25 -1.00 0.00 0.00 179.01 179.89 4pal h LEU 63 N 0.26 0.54 -2.06 1.33 5.85 -0.07 -2.37 115.31 118.80 4pal h LEU 63 Ca -0.03 -0.23 0.11 0.00 0.84 0.00 0.00 57.88 58.57 4pal h LEU 63 Cb 1.32 -0.15 -0.02 0.00 0.37 0.00 0.00 40.66 42.19 4pal h LEU 63 CO 0.13 0.87 0.35 0.50 -0.34 0.00 0.00 178.44 179.94 4pal h LYS 64 N 0.43 0.00 -0.55 1.25 3.64 -1.19 -1.49 116.57 118.66 4pal h LYS 64 Ca 0.04 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.42 4pal h LYS 64 Cb 0.85 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.67 4pal h LYS 64 CO 0.07 0.00 0.00 1.28 -2.27 0.00 0.00 179.45 178.53 4pal n LEU 65 N -3.98 4.37 -0.32 5.20 4.77 -0.92 -0.83 117.00 125.29 4pal n LEU 65 Ca 0.06 -2.46 0.18 0.00 -0.03 0.00 0.00 56.01 53.77 4pal n LEU 65 Cb 0.53 -0.52 0.38 0.00 -2.33 0.00 0.00 43.42 41.47 4pal n LEU 65 CO 0.31 0.79 1.00 0.15 -1.33 0.00 0.00 177.39 178.30 4pal h PHE 66 N 3.46 0.56 0.00 -1.77 3.04 -0.98 -0.19 116.94 121.05 4pal h PHE 66 Ca 0.00 0.05 0.00 0.00 3.98 0.00 0.00 57.97 62.00 4pal h PHE 66 Cb 1.34 -0.09 0.00 0.00 2.56 0.00 0.00 35.95 39.76 4pal h PHE 66 CO 0.65 -0.23 0.00 -0.07 -2.02 0.00 0.00 178.31 176.63 4pal h LEU 67 N 0.22 0.00 0.00 0.59 3.38 -1.83 -2.78 115.31 114.89 4pal h LEU 67 Ca 0.64 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.61 4pal h LEU 67 Cb 1.40 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.15 4pal h LEU 67 CO -0.67 0.00 0.00 0.00 0.09 0.00 0.00 178.44 177.86 4pal n GLN 68 N -2.86 0.82 0.17 1.13 6.02 -0.08 -1.14 117.38 121.42 4pal n GLN 68 Ca 0.03 0.00 0.12 0.00 -0.01 0.00 0.00 57.00 57.15 4pal n GLN 68 Cb 0.43 -1.50 0.28 0.00 1.02 0.00 0.00 30.24 30.47 4pal n GLN 68 CO 0.00 0.00 0.00 -0.91 -1.01 0.00 0.00 177.06 175.14 4pal h ASN 69 N 0.00 0.00 0.00 1.08 4.21 -1.57 -3.24 115.58 116.06 4pal h ASN 69 Ca 0.00 0.00 -0.32 0.00 1.21 0.00 0.00 56.30 57.19 4pal h ASN 69 Cb 0.00 0.00 -0.06 0.00 -1.12 0.00 0.00 38.32 37.14 4pal h ASN 69 CO 0.00 0.00 -2.20 0.49 -1.29 0.00 0.00 177.43 174.43 4pal n PHE 70 N -2.71 0.00 -3.66 1.19 3.72 -0.30 -4.75 117.46 110.96 4pal n PHE 70 Ca 0.05 0.00 -0.07 0.00 -0.05 0.00 0.00 57.45 57.38 4pal n PHE 70 Cb 0.48 -0.86 -0.08 0.00 -0.94 0.00 0.00 39.48 38.08 4pal n PHE 70 CO 0.00 0.00 0.00 0.45 -0.05 0.00 0.00 176.76 177.16 4pal s SER 71 N -5.18 -0.81 0.52 4.37 0.15 -0.83 -4.71 113.70 107.21 4pal s SER 71 Ca -0.09 1.32 0.21 0.00 0.70 0.00 0.00 55.95 58.08 4pal s SER 71 Cb 0.05 1.36 1.38 0.00 -1.71 0.00 0.00 66.02 67.10 4pal s SER 71 CO 0.71 -0.22 2.13 -0.65 1.20 0.00 0.00 173.24 176.41 4pal h PRO 72 N 7.28 0.00 -0.69 5.44 0.11 -1.87 -0.62 132.00 141.65 4pal h PRO 72 Ca -0.29 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.82 4pal h PRO 72 Cb 1.19 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.30 4pal h PRO 72 CO 0.18 0.06 0.00 -1.13 -0.21 0.00 0.00 178.00 176.90 4pal n SER 73 N -4.21 4.29 -4.72 -2.05 3.41 -1.26 -4.93 113.62 104.14 4pal n SER 73 Ca -0.03 -2.23 -0.33 0.00 -0.26 0.00 0.00 58.87 56.02 4pal n SER 73 Cb 0.14 -0.53 0.10 0.00 -0.26 0.00 0.00 64.21 63.66 4pal n SER 73 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 4pal s ALA 74 N -1.45 2.08 0.65 7.33 0.00 -0.24 -4.97 121.76 125.15 4pal s ALA 74 Ca 0.49 0.75 -0.13 0.00 0.00 0.00 0.00 51.96 53.07 4pal s ALA 74 Cb 0.29 -3.43 -0.01 0.00 0.00 0.00 0.00 23.12 19.97 4pal s ALA 74 CO 0.28 -1.92 1.06 -0.98 0.00 0.00 0.00 175.76 174.20 4pal s ARG 75 N -4.12 3.11 0.66 0.00 1.70 -1.26 -4.70 118.95 114.34 4pal s ARG 75 Ca 0.71 1.05 -0.15 0.00 -0.47 0.00 0.00 55.73 56.87 4pal s ARG 75 Cb -0.26 -2.01 0.00 0.00 -0.57 0.00 0.00 34.95 32.11 4pal s ARG 75 CO 0.47 -0.97 1.12 0.00 -1.08 0.00 0.00 175.30 174.85 4pal s ALA 76 N -2.81 2.43 0.48 7.88 0.00 -1.26 -4.59 121.76 123.89 4pal s ALA 76 Ca 0.60 0.58 -0.21 0.00 0.00 0.00 0.00 51.96 52.94 4pal s ALA 76 Cb -0.15 -3.33 -0.08 0.00 0.00 0.00 0.00 23.12 19.56 4pal s ALA 76 CO 0.47 -1.33 1.06 -0.51 0.00 0.00 0.00 175.76 175.46 4pal s LEU 77 N -4.88 3.89 0.94 0.00 1.43 -0.01 -5.04 118.68 115.02 4pal s LEU 77 Ca 0.68 2.01 -0.12 0.00 -1.03 0.00 0.00 54.13 55.66 4pal s LEU 77 Cb -0.21 -4.48 0.16 0.00 0.03 0.00 0.00 46.19 41.69 4pal s LEU 77 CO 0.42 -0.81 1.13 0.42 0.23 0.00 0.00 176.35 177.74 4pal s THR 78 N -1.86 1.99 0.41 5.49 -4.23 -1.26 -4.78 115.64 111.40 4pal s THR 78 Ca 0.66 0.00 0.10 0.00 -1.18 0.00 0.00 61.69 61.27 4pal s THR 78 Cb -0.19 -2.68 0.30 0.00 1.34 0.00 0.00 72.50 71.27 4pal s THR 78 CO 0.23 0.00 2.00 0.44 -0.54 0.00 0.00 174.62 176.75 4pal h ASP 79 N -1.63 0.45 -0.10 3.99 5.19 -1.99 0.19 116.42 122.52 4pal h ASP 79 Ca -0.52 0.00 -0.04 0.00 -0.62 0.00 0.00 57.03 55.86 4pal h ASP 79 Cb 1.33 -0.10 -0.00 0.00 0.18 0.00 0.00 39.33 40.74 4pal h ASP 79 CO 0.60 0.29 -0.08 0.00 -3.12 0.00 0.00 179.24 176.94 4pal h ALA 80 N 1.70 0.15 -0.78 3.45 0.00 -1.99 -1.32 119.26 120.47 4pal h ALA 80 Ca 0.24 -0.28 0.00 0.00 0.00 0.00 0.00 54.91 54.88 4pal h ALA 80 Cb 0.30 -0.03 -0.04 0.00 0.00 0.00 0.00 17.79 18.02 4pal h ALA 80 CO -0.07 -0.04 0.49 0.93 0.00 0.00 0.00 179.25 180.56 4pal h GLU 81 N -0.15 1.05 -0.36 0.00 5.08 -1.64 -2.36 114.58 116.20 4pal h GLU 81 Ca 0.02 -0.08 -0.00 0.00 -1.00 0.00 0.00 59.36 58.29 4pal h GLU 81 Cb 0.56 -0.23 -0.02 0.00 0.50 0.00 0.00 28.75 29.57 4pal h GLU 81 CO 0.02 0.72 0.21 1.15 -1.00 0.00 0.00 179.01 180.11 4pal h THR 82 N 1.06 1.13 -0.54 1.13 2.02 -0.48 -2.17 112.91 115.07 4pal h THR 82 Ca 0.28 -0.30 -0.05 0.00 0.77 0.00 0.00 66.41 67.11 4pal h THR 82 Cb -0.07 0.68 -0.02 0.00 -1.74 0.00 0.00 68.15 67.00 4pal h THR 82 CO -0.06 0.13 0.16 0.11 0.37 0.00 0.00 175.52 176.23 4pal h LYS 83 N 0.46 0.85 -0.03 6.66 1.57 -1.23 0.27 116.57 125.11 4pal h LYS 83 Ca 0.13 -0.19 0.01 0.00 -1.87 0.00 0.00 60.65 58.73 4pal h LYS 83 Cb 0.02 -0.12 -0.01 0.00 0.08 0.00 0.00 32.23 32.21 4pal h LYS 83 CO -0.02 0.78 -0.01 0.00 -0.57 0.00 0.00 179.45 179.63 4pal h ALA 84 N 1.03 0.02 -0.33 3.86 0.00 -1.39 -1.76 119.26 120.69 4pal h ALA 84 Ca 0.17 0.01 -0.01 0.00 0.00 0.00 0.00 54.91 55.09 4pal h ALA 84 Cb 0.30 0.03 -0.02 0.00 0.00 0.00 0.00 17.79 18.10 4pal h ALA 84 CO -0.00 -0.50 0.18 0.35 0.00 0.00 0.00 179.25 179.28 4pal h PHE 85 N -0.00 0.46 -0.87 0.00 3.04 -0.87 -2.69 116.94 116.00 4pal h PHE 85 Ca 0.02 -0.01 0.03 0.00 3.98 0.00 0.00 57.97 61.98 4pal h PHE 85 Cb 0.03 -0.15 -0.05 0.00 2.56 0.00 0.00 35.95 38.34 4pal h PHE 85 CO -0.10 0.38 0.57 1.25 -2.02 0.00 0.00 178.31 178.38 4pal h LEU 86 N 0.41 0.96 -0.37 0.59 5.85 -0.84 0.16 115.31 122.07 4pal h LEU 86 Ca 0.12 -0.02 -0.06 0.00 0.84 0.00 0.00 57.88 58.76 4pal h LEU 86 Cb 0.07 -0.23 -0.01 0.00 0.37 0.00 0.00 40.66 40.87 4pal h LEU 86 CO -0.02 0.67 -0.29 0.00 -0.34 0.00 0.00 178.44 178.46 4pal h ALA 87 N 1.48 0.86 0.07 1.25 0.00 -1.25 0.25 119.26 121.93 4pal h ALA 87 Ca 0.33 -0.26 -0.30 0.00 0.00 0.00 0.00 54.91 54.68 4pal h ALA 87 Cb -0.04 -0.05 -0.02 0.00 0.00 0.00 0.00 17.79 17.69 4pal h ALA 87 CO -0.09 0.36 -1.56 0.22 0.00 0.00 0.00 179.25 178.18 4pal h ASP 88 N 0.00 0.24 0.78 0.00 3.58 -1.13 -3.35 116.42 116.54 4pal h ASP 88 Ca -0.00 -0.38 -0.25 0.00 0.42 0.00 0.00 57.03 56.82 4pal h ASP 88 Cb 1.09 -0.08 -0.02 0.00 1.72 0.00 0.00 39.33 42.03 4pal h ASP 88 CO 0.04 1.32 -1.22 1.23 -2.88 0.00 0.00 179.24 177.73 4pal h GLY 89 N 2.25 0.11 -7.25 -0.78 0.00 -0.33 -3.40 103.07 93.67 4pal h GLY 89 Ca -0.25 -0.28 -0.77 0.00 0.00 0.00 0.00 47.33 46.03 4pal h GLY 89 CO 0.13 0.25 1.19 1.34 0.00 0.00 0.00 176.54 179.45 4pal n ASP 90 N -3.37 5.47 0.18 0.19 4.64 0.86 -4.41 116.55 120.11 4pal n ASP 90 Ca -0.06 -3.10 0.04 0.00 -1.38 0.00 0.00 54.79 50.29 4pal n ASP 90 Cb 0.99 -1.45 0.32 0.00 -1.04 0.00 0.00 41.12 39.94 4pal n ASP 90 CO 0.00 0.00 0.00 0.11 -0.82 0.00 0.00 177.20 176.49 4pal h LYS 91 N 6.41 0.00 -0.12 -0.67 1.79 -1.82 -2.68 116.57 119.48 4pal h LYS 91 Ca 0.28 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.75 4pal h LYS 91 Cb 0.77 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 31.42 4pal h LYS 91 CO 1.29 0.41 0.00 -0.40 -1.08 0.00 0.00 179.45 179.67 4pal n ASP 92 N -3.63 1.26 -0.16 0.86 5.68 -1.26 -4.92 116.55 114.38 4pal n ASP 92 Ca -0.01 -1.63 -0.02 0.00 -0.50 0.00 0.00 54.79 52.64 4pal n ASP 92 Cb 0.51 -0.08 -0.01 0.00 -1.14 0.00 0.00 41.12 40.40 4pal n ASP 92 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 4pal n GLY 93 N 1.05 0.55 0.87 6.12 0.00 -1.01 -4.88 105.19 107.90 4pal n GLY 93 Ca 0.16 -0.52 0.11 0.00 0.00 0.00 0.00 46.02 45.77 4pal n GLY 93 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 4pal n ASP 94 N 0.74 2.61 0.00 1.61 5.75 -1.26 -4.91 116.55 121.09 4pal n ASP 94 Ca -0.02 -1.87 0.00 0.00 -0.01 0.00 0.00 54.79 52.89 4pal n ASP 94 Cb 0.11 -0.18 0.00 0.00 -1.03 0.00 0.00 41.12 40.01 4pal n ASP 94 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 4pal n GLY 95 N 1.33 0.74 3.52 6.12 0.00 -1.26 -5.04 105.19 110.59 4pal n GLY 95 Ca 0.18 0.00 -0.09 0.00 0.00 0.00 0.00 46.02 46.10 4pal n GLY 95 CO 0.00 0.00 0.00 -3.16 0.00 0.00 0.00 173.32 170.16 4pal s MET 96 N -0.41 1.41 -0.28 1.61 0.23 -1.26 -4.37 119.30 116.23 4pal s MET 96 Ca 0.00 -1.05 -0.11 0.00 -1.03 0.00 0.00 55.69 53.50 4pal s MET 96 Cb 0.00 0.48 -0.05 0.00 -1.53 0.00 0.00 34.83 33.73 4pal s MET 96 CO 0.00 -0.58 0.18 0.42 -2.03 0.00 0.00 175.02 173.01 4pal s ILE 97 N -3.94 5.28 0.44 3.16 1.01 0.34 -4.66 121.20 122.84 4pal s ILE 97 Ca 0.15 0.16 0.02 0.00 0.00 0.00 0.00 60.65 60.98 4pal s ILE 97 Cb -0.00 -3.51 0.00 0.00 0.01 0.00 0.00 42.46 38.96 4pal s ILE 97 CO 0.02 0.26 0.64 -0.83 0.00 0.00 0.00 174.94 175.03 4pal s GLY 98 N 1.72 1.65 0.31 6.18 0.00 -1.26 -0.62 107.32 115.29 4pal s GLY 98 Ca 0.07 -1.24 0.03 0.00 0.00 0.00 0.00 44.72 43.58 4pal s GLY 98 CO 0.10 -1.06 1.81 -0.24 0.00 0.00 0.00 173.10 173.71 4pal h VAL 99 N 0.46 1.22 -0.27 1.40 3.04 -2.00 -1.08 116.25 119.03 4pal h VAL 99 Ca -0.45 -0.96 -0.16 0.00 -1.01 0.00 0.00 66.70 64.13 4pal h VAL 99 Cb 1.26 1.04 -0.00 0.00 -2.01 0.00 0.00 31.29 31.58 4pal h VAL 99 CO 0.54 0.32 -0.45 0.44 -1.01 0.00 0.00 177.57 177.42 4pal h ASP 100 N 0.53 0.86 -0.07 3.17 5.19 -1.96 -1.97 116.42 122.17 4pal h ASP 100 Ca 0.10 -0.52 -0.07 0.00 -0.62 0.00 0.00 57.03 55.92 4pal h ASP 100 Cb 0.44 -0.25 -0.01 0.00 0.18 0.00 0.00 39.33 39.69 4pal h ASP 100 CO 0.02 1.22 -0.17 1.05 -3.12 0.00 0.00 179.24 178.25 4pal h GLU 101 N 0.54 0.43 -0.23 3.56 4.11 -1.86 -1.58 114.58 119.54 4pal h GLU 101 Ca 0.02 -0.13 -0.01 0.00 0.07 0.00 0.00 59.36 59.31 4pal h GLU 101 Cb 1.05 -0.04 -0.01 0.00 0.50 0.00 0.00 28.75 30.24 4pal h GLU 101 CO 0.10 0.59 0.09 0.35 0.07 0.00 0.00 179.01 180.22 4pal h PHE 102 N 0.40 0.35 -0.94 2.06 3.04 -0.99 -1.26 116.94 119.60 4pal h PHE 102 Ca 0.07 -0.03 0.02 0.00 3.98 0.00 0.00 57.97 62.01 4pal h PHE 102 Cb 0.53 -0.11 -0.05 0.00 2.56 0.00 0.00 35.95 38.88 4pal h PHE 102 CO 0.02 0.38 0.62 0.00 -2.02 0.00 0.00 178.31 177.31 4pal h ALA 103 N 0.94 1.22 -0.50 2.41 0.00 -1.16 -1.59 119.26 120.57 4pal h ALA 103 Ca 0.08 -0.06 -0.07 0.00 0.00 0.00 0.00 54.91 54.86 4pal h ALA 103 Cb 0.18 -0.37 -0.02 0.00 0.00 0.00 0.00 17.79 17.58 4pal h ALA 103 CO -0.01 0.56 0.03 0.00 0.00 0.00 0.00 179.25 179.83 4pal h ALA 104 N 1.36 0.67 -0.75 0.00 0.00 -1.20 -0.34 119.26 119.01 4pal h ALA 104 Ca 0.36 -0.27 0.01 0.00 0.00 0.00 0.00 54.91 55.01 4pal h ALA 104 Cb -0.09 -0.19 -0.04 0.00 0.00 0.00 0.00 17.79 17.47 4pal h ALA 104 CO -0.09 0.45 0.49 1.98 0.00 0.00 0.00 179.25 182.08 4pal h MET 105 N 0.73 0.98 -0.14 0.00 1.85 -1.06 -1.06 114.93 116.23 4pal h MET 105 Ca 0.14 -0.06 -0.20 0.00 -0.61 0.00 0.00 59.70 58.98 4pal h MET 105 Cb 0.48 -0.22 0.00 0.00 0.43 0.00 0.00 31.60 32.29 4pal h MET 105 CO 0.02 0.65 -0.72 0.82 -0.40 0.00 0.00 176.91 177.27 4pal h ILE 106 N 1.01 1.32 -0.21 1.77 2.04 -0.93 -3.08 117.51 119.43 4pal h ILE 106 Ca 0.28 -2.00 0.00 0.00 1.00 0.00 0.00 64.86 64.14 4pal h ILE 106 Cb -0.11 1.98 0.00 0.00 -0.74 0.00 0.00 36.82 37.96 4pal h ILE 106 CO -0.06 0.62 0.00 0.29 0.00 0.00 0.00 178.15 179.00 4pal n LYS 107 N -3.91 1.85 0.00 2.37 4.76 -0.17 -4.84 118.16 118.23 4pal n LYS 107 Ca -0.06 -1.28 0.16 0.00 -2.87 0.00 0.00 58.31 54.26 4pal n LYS 107 Cb 0.71 -1.40 0.89 0.00 -1.84 0.00 0.00 35.03 33.38 4pal n LYS 107 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03