#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1o5p s ALA 2 N 0.00 3.28 0.89 0.00 0.00 -1.26 -4.99 121.76 119.67 1o5p s ALA 2 Ca 0.00 -1.63 -0.11 0.00 0.00 0.00 0.00 51.96 50.22 1o5p s ALA 2 Cb 0.00 0.27 0.12 0.00 0.00 0.00 0.00 23.12 23.51 1o5p s ALA 2 CO 0.00 -0.14 1.12 -2.30 0.00 0.00 0.00 175.76 174.44 1o5p n PRO 3 N -1.00 -0.25 -1.91 0.00 -0.02 -0.45 -4.22 135.00 127.15 1o5p n PRO 3 Ca -0.09 -0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.39 1o5p n PRO 3 Cb 0.67 -2.37 0.00 0.00 -0.02 0.00 0.00 33.50 31.78 1o5p n PRO 3 CO 0.00 0.00 0.00 -2.37 1.98 0.00 0.00 175.50 175.11 1o5p n THR 4 N -3.92 0.00 -3.64 3.45 5.66 0.29 -4.86 114.28 111.26 1o5p n THR 4 Ca 0.12 0.00 -0.05 0.00 -3.05 0.00 0.00 64.05 61.08 1o5p n THR 4 Cb 0.52 0.00 -0.07 0.00 -1.55 0.00 0.00 70.33 69.23 1o5p n THR 4 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 1o5p s ALA 5 N -1.00 -2.10 -0.34 1.79 0.00 -1.26 -0.97 121.76 117.89 1o5p s ALA 5 Ca 0.00 2.28 -0.04 0.00 0.00 0.00 0.00 51.96 54.20 1o5p s ALA 5 Cb 0.00 -1.58 0.05 0.00 0.00 0.00 0.00 23.12 21.59 1o5p s ALA 5 CO 0.00 -0.36 0.08 -0.08 0.00 0.00 0.00 175.76 175.41 1o5p s THR 6 N 1.41 3.45 -0.05 0.00 -1.32 -0.01 -4.84 115.64 114.27 1o5p s THR 6 Ca -0.09 -1.35 0.05 0.00 -1.21 0.00 0.00 61.69 59.10 1o5p s THR 6 Cb -0.04 -3.02 -0.02 0.00 -1.51 0.00 0.00 72.50 67.91 1o5p s THR 6 CO -0.16 -0.23 -0.21 -0.69 -2.21 0.00 0.00 174.62 171.12 1o5p s VAL 7 N 1.32 2.45 -0.22 5.08 1.01 -1.26 -0.28 120.40 128.50 1o5p s VAL 7 Ca -0.02 -0.94 -0.29 0.00 0.00 0.00 0.00 61.98 60.73 1o5p s VAL 7 Cb -0.20 -1.92 0.15 0.00 0.00 0.00 0.00 36.38 34.42 1o5p s VAL 7 CO 0.01 0.57 1.15 -0.89 0.00 0.00 0.00 175.10 175.94 1o5p s THR 8 N -0.40 0.00 0.49 3.92 2.01 -0.37 -4.46 115.64 116.83 1o5p s THR 8 Ca 0.04 0.00 -0.19 0.00 0.31 0.00 0.00 61.69 61.84 1o5p s THR 8 Cb -0.12 -1.00 -0.08 0.00 0.01 0.00 0.00 72.50 71.31 1o5p s THR 8 CO 0.02 0.00 1.01 -2.16 -0.69 0.00 0.00 174.62 172.80 1o5p s PRO 9 N -0.96 3.86 0.07 4.92 0.05 -1.26 -0.80 135.00 140.88 1o5p s PRO 9 Ca 0.03 1.24 0.17 0.00 0.05 0.00 0.00 61.00 62.49 1o5p s PRO 9 Cb -0.01 -2.11 -0.12 0.00 0.05 0.00 0.00 34.50 32.31 1o5p s PRO 9 CO -0.03 -0.37 0.84 -1.13 0.05 0.00 0.00 177.00 176.37 1o5p n SER 10 N -1.09 0.86 -4.26 6.66 3.41 -1.26 -4.78 113.62 113.16 1o5p n SER 10 Ca 0.08 0.37 -0.14 0.00 -0.26 0.00 0.00 58.87 58.92 1o5p n SER 10 Cb 0.53 0.19 -0.10 0.00 -0.26 0.00 0.00 64.21 64.57 1o5p n SER 10 CO 0.00 0.00 0.00 -0.44 -0.16 0.00 0.00 175.04 174.44 1o5p s SER 11 N -5.73 1.32 -0.27 4.04 0.01 -1.26 0.48 113.70 112.28 1o5p s SER 11 Ca -0.03 -1.20 -0.01 0.00 1.31 0.00 0.00 55.95 56.02 1o5p s SER 11 Cb 0.09 0.10 0.00 0.00 0.21 0.00 0.00 66.02 66.42 1o5p s SER 11 CO 0.81 -0.57 0.19 0.61 0.41 0.00 0.00 173.24 174.68 1o5p n GLY 12 N -0.29 0.59 0.13 3.44 0.00 -1.16 -4.90 105.19 103.01 1o5p n GLY 12 Ca -0.06 -0.54 -0.22 0.00 0.00 0.00 0.00 46.02 45.21 1o5p n GLY 12 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1o5p n LEU 13 N -1.22 2.47 -1.02 0.99 4.77 -1.26 -5.06 117.00 116.68 1o5p n LEU 13 Ca -0.01 0.21 0.00 0.00 -0.03 0.00 0.00 56.01 56.18 1o5p n LEU 13 Cb 0.52 -1.03 0.00 0.00 -2.33 0.00 0.00 43.42 40.57 1o5p n LEU 13 CO 0.11 0.72 -0.30 -0.24 -1.33 0.00 0.00 177.39 176.35 1o5p n SER 14 N -3.71 -5.72 -4.47 -1.43 2.88 -1.26 -3.82 113.62 96.08 1o5p n SER 14 Ca -0.36 0.95 -0.47 0.00 -1.33 0.00 0.00 58.87 57.66 1o5p n SER 14 Cb 0.95 -2.81 -0.07 0.00 -0.75 0.00 0.00 64.21 61.53 1o5p n SER 14 CO 0.00 0.00 0.00 -0.90 -1.23 0.00 0.00 175.04 172.91 1o5p n ASP 15 N -1.41 1.93 0.00 -3.46 5.75 -1.26 -1.99 116.55 116.10 1o5p n ASP 15 Ca 0.00 0.24 0.00 0.00 -0.01 0.00 0.00 54.79 55.02 1o5p n ASP 15 Cb 0.12 -1.27 0.00 0.00 -1.03 0.00 0.00 41.12 38.94 1o5p n ASP 15 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 1o5p n GLY 16 N 6.46 1.42 0.00 6.12 0.00 -1.26 -5.06 105.19 112.87 1o5p n GLY 16 Ca 0.44 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.46 1o5p n GLY 16 CO 0.00 0.00 0.00 -0.37 0.00 0.00 0.00 173.32 172.95 1o5p n THR 17 N -0.55 0.00 -4.25 2.61 5.66 -0.84 -4.96 114.28 111.95 1o5p n THR 17 Ca 0.00 0.00 -0.17 0.00 -3.05 0.00 0.00 64.05 60.83 1o5p n THR 17 Cb 0.00 -0.88 -0.14 0.00 -1.55 0.00 0.00 70.33 67.76 1o5p n THR 17 CO 0.00 0.00 0.00 -0.69 -3.05 0.00 0.00 175.07 171.33 1o5p s VAL 18 N 0.79 0.63 0.21 1.08 1.01 -1.26 -2.15 120.40 120.71 1o5p s VAL 18 Ca 0.00 -0.51 0.11 0.00 0.00 0.00 0.00 61.98 61.58 1o5p s VAL 18 Cb 0.00 -0.56 -0.05 0.00 0.00 0.00 0.00 36.38 35.77 1o5p s VAL 18 CO 0.00 0.06 -0.23 0.68 0.00 0.00 0.00 175.10 175.61 1o5p s VAL 19 N -0.44 2.39 -0.39 2.92 -7.23 0.54 -4.76 120.40 113.44 1o5p s VAL 19 Ca 0.01 -2.09 -0.11 0.00 -1.81 0.00 0.00 61.98 57.97 1o5p s VAL 19 Cb -0.04 -2.17 0.04 0.00 0.56 0.00 0.00 36.38 34.76 1o5p s VAL 19 CO 0.00 -0.17 0.23 -0.75 -0.31 0.00 0.00 175.10 174.11 1o5p s LYS 20 N -2.82 2.82 -0.09 4.82 2.20 0.02 -1.38 119.74 125.30 1o5p s LYS 20 Ca 0.22 -1.14 -0.05 0.00 -0.36 0.00 0.00 55.97 54.65 1o5p s LYS 20 Cb -0.07 -3.79 -0.04 0.00 -1.51 0.00 0.00 37.83 32.42 1o5p s LYS 20 CO 0.11 -0.76 0.11 0.54 -0.36 0.00 0.00 175.35 174.99 1o5p s VAL 21 N 1.56 5.17 0.08 4.02 0.11 -0.83 -1.23 120.40 129.28 1o5p s VAL 21 Ca 0.02 0.03 0.01 0.00 -2.93 0.00 0.00 61.98 59.11 1o5p s VAL 21 Cb -0.20 -3.26 -0.04 0.00 -1.53 0.00 0.00 36.38 31.35 1o5p s VAL 21 CO 0.07 0.57 -0.05 0.00 -3.33 0.00 0.00 175.10 172.36 1o5p s ALA 22 N -1.03 0.82 0.02 1.54 0.00 0.61 -1.44 121.76 122.29 1o5p s ALA 22 Ca 0.16 -1.31 0.04 0.00 0.00 0.00 0.00 51.96 50.86 1o5p s ALA 22 Cb -0.12 0.21 -0.02 0.00 0.00 0.00 0.00 23.12 23.20 1o5p s ALA 22 CO 0.05 -0.29 -0.14 0.20 0.00 0.00 0.00 175.76 175.59 1o5p s GLY 23 N -3.00 0.73 -0.10 0.00 0.00 0.28 -0.83 107.32 104.39 1o5p s GLY 23 Ca 0.11 -0.73 -0.04 0.00 0.00 0.00 0.00 44.72 44.05 1o5p s GLY 23 CO -0.06 -0.69 0.22 0.00 0.00 0.00 0.00 173.10 172.57 1o5p s ALA 24 N -0.67 -0.46 0.00 3.20 0.00 -0.14 0.15 121.76 123.84 1o5p s ALA 24 Ca 0.02 0.87 0.00 0.00 0.00 0.00 0.00 51.96 52.86 1o5p s ALA 24 Cb -0.07 -0.74 0.00 0.00 0.00 0.00 0.00 23.12 22.31 1o5p s ALA 24 CO 0.01 -0.36 0.00 0.41 0.00 0.00 0.00 175.76 175.81 1o5p n GLY 25 N 4.68 0.93 3.96 0.00 0.00 -1.02 0.10 105.19 113.84 1o5p n GLY 25 Ca -0.18 -0.54 -0.26 0.00 0.00 0.00 0.00 46.02 45.04 1o5p n GLY 25 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1o5p s LEU 26 N 0.00 2.87 -0.85 0.99 1.43 -0.77 -1.34 118.68 121.02 1o5p s LEU 26 Ca 0.00 0.06 -0.25 0.00 -1.03 0.00 0.00 54.13 52.90 1o5p s LEU 26 Cb 0.00 -2.42 -0.20 0.00 0.03 0.00 0.00 46.19 43.60 1o5p s LEU 26 CO 0.00 -2.00 2.51 0.00 0.23 0.00 0.00 176.35 177.09 1o5p n GLN 27 N -3.10 0.31 -1.23 1.70 3.00 -1.26 -4.07 117.38 112.74 1o5p n GLN 27 Ca 0.13 -0.08 -0.17 0.00 -0.01 0.00 0.00 57.00 56.86 1o5p n GLN 27 Cb 0.60 -2.11 -0.09 0.00 0.00 0.00 0.00 30.24 28.64 1o5p n GLN 27 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.06 177.06 1o5p n ALA 28 N 11.77 0.36 0.00 -1.58 0.00 -1.23 -1.27 120.51 128.56 1o5p n ALA 28 Ca 0.57 -2.02 0.00 0.00 0.00 0.00 0.00 53.44 51.99 1o5p n ALA 28 Cb 0.22 -2.77 0.00 0.00 0.00 0.00 0.00 19.45 16.90 1o5p n ALA 28 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1o5p n GLY 29 N 5.48 0.54 2.90 0.00 0.00 0.90 -4.83 105.19 110.17 1o5p n GLY 29 Ca 0.33 0.00 -0.14 0.00 0.00 0.00 0.00 46.02 46.21 1o5p n GLY 29 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1o5p s THR 30 N -0.69 -0.45 -0.03 2.61 -4.23 -0.39 -4.89 115.64 107.57 1o5p s THR 30 Ca 0.00 0.02 -0.39 0.00 -1.18 0.00 0.00 61.69 60.14 1o5p s THR 30 Cb 0.00 -0.65 -0.19 0.00 1.34 0.00 0.00 72.50 73.00 1o5p s THR 30 CO 0.00 -0.08 1.26 0.00 -0.54 0.00 0.00 174.62 175.26 1o5p n ALA 31 N 5.34 -2.24 -2.43 3.99 0.00 -1.26 -2.73 120.51 121.18 1o5p n ALA 31 Ca -0.05 0.55 -0.28 0.00 0.00 0.00 0.00 53.44 53.66 1o5p n ALA 31 Cb 0.50 -1.92 -0.13 0.00 0.00 0.00 0.00 19.45 17.90 1o5p n ALA 31 CO 0.00 0.00 0.00 0.71 0.00 0.00 0.00 177.50 178.21 1o5p s TYR 32 N 0.69 2.17 0.18 0.00 2.02 0.16 -4.54 117.35 118.03 1o5p s TYR 32 Ca 0.90 -0.39 0.03 0.00 -0.37 0.00 0.00 57.07 57.25 1o5p s TYR 32 Cb -1.16 -1.18 -0.03 0.00 -0.40 0.00 0.00 41.96 39.18 1o5p s TYR 32 CO 0.56 0.30 0.29 -0.51 -1.57 0.00 0.00 175.55 174.62 1o5p s ASP 33 N -1.99 6.26 -0.12 2.29 1.01 0.71 -1.63 116.67 123.21 1o5p s ASP 33 Ca 0.12 0.12 -0.03 0.00 0.71 0.00 0.00 52.55 53.46 1o5p s ASP 33 Cb -0.10 -1.86 0.05 0.00 1.01 0.00 0.00 42.92 42.02 1o5p s ASP 33 CO 0.05 0.02 0.06 0.54 0.21 0.00 0.00 175.17 176.05 1o5p s VAL 34 N -1.81 0.06 0.29 -1.27 0.11 -0.93 -0.91 120.40 115.94 1o5p s VAL 34 Ca 0.34 0.02 -0.14 0.00 -2.93 0.00 0.00 61.98 59.27 1o5p s VAL 34 Cb -0.10 -0.49 0.05 0.00 -1.53 0.00 0.00 36.38 34.30 1o5p s VAL 34 CO 0.28 -0.04 0.71 0.61 -3.33 0.00 0.00 175.10 173.34 1o5p n GLY 35 N 5.23 1.04 3.47 6.54 0.00 -0.91 -0.20 105.19 120.36 1o5p n GLY 35 Ca -0.06 -1.19 -0.41 0.00 0.00 0.00 0.00 46.02 44.36 1o5p n GLY 35 CO 0.00 0.00 0.00 -0.86 0.00 0.00 0.00 173.32 172.46 1o5p s GLN 36 N -2.07 3.18 0.10 1.61 -2.07 -1.26 -2.54 119.66 116.61 1o5p s GLN 36 Ca 0.15 -0.86 0.05 0.00 -1.82 0.00 0.00 55.36 52.88 1o5p s GLN 36 Cb -0.04 -3.84 -0.03 0.00 -1.09 0.00 0.00 33.01 28.01 1o5p s GLN 36 CO 0.09 -0.60 -0.13 0.00 -1.32 0.00 0.00 175.29 173.33 1o5p s ALA 38 N -1.89 1.37 -0.36 0.00 0.00 -0.67 -1.06 121.76 119.16 1o5p s ALA 38 Ca 0.04 -0.62 -0.17 0.00 0.00 0.00 0.00 51.96 51.21 1o5p s ALA 38 Cb -0.06 -0.45 -0.00 0.00 0.00 0.00 0.00 23.12 22.60 1o5p s ALA 38 CO 0.02 0.25 0.47 -1.58 0.00 0.00 0.00 175.76 174.93 1o5p s TRP 39 N 0.02 3.18 -0.81 0.00 0.51 -1.26 -1.66 118.94 118.93 1o5p s TRP 39 Ca -0.03 0.06 0.16 0.00 -2.12 0.00 0.00 56.10 54.17 1o5p s TRP 39 Cb -0.10 -2.87 0.55 0.00 -0.81 0.00 0.00 33.47 30.24 1o5p s TRP 39 CO 0.01 -0.54 1.47 1.33 -0.51 0.00 0.00 176.95 178.72 1o5p n VAL 40 N 5.39 1.73 -1.49 4.03 0.24 -0.89 -4.72 118.33 122.63 1o5p n VAL 40 Ca -0.06 -1.33 0.00 0.00 -2.04 0.00 0.00 64.34 60.91 1o5p n VAL 40 Cb 0.49 0.13 0.00 0.00 -1.47 0.00 0.00 33.84 32.98 1o5p n VAL 40 CO 0.00 0.00 0.00 0.47 -2.14 0.00 0.00 176.83 175.16 1o5p n ASP 41 N 0.51 0.00 -4.55 -1.34 9.92 -1.26 -4.95 116.55 114.87 1o5p n ASP 41 Ca 0.21 0.00 -0.35 0.00 -0.53 0.00 0.00 54.79 54.12 1o5p n ASP 41 Cb 0.76 0.00 -0.04 0.00 -0.64 0.00 0.00 41.12 41.21 1o5p n ASP 41 CO 0.00 0.00 0.00 0.28 0.13 0.00 0.00 177.20 177.61 1o5p s THR 42 N -2.45 3.38 0.00 -3.53 -1.32 -1.26 -2.74 115.64 107.72 1o5p s THR 42 Ca 0.00 0.03 0.00 0.00 -1.21 0.00 0.00 61.69 60.51 1o5p s THR 42 Cb 0.00 -3.96 0.00 0.00 -1.51 0.00 0.00 72.50 67.03 1o5p s THR 42 CO 0.00 -0.92 0.00 0.61 -2.21 0.00 0.00 174.62 172.10 1o5p n GLY 43 N 6.04 0.69 3.15 6.08 0.00 -1.26 -5.04 105.19 114.84 1o5p n GLY 43 Ca 0.26 -0.73 -0.35 0.00 0.00 0.00 0.00 46.02 45.20 1o5p n GLY 43 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1o5p s VAL 44 N -2.00 3.05 -0.31 1.61 1.01 -1.11 -4.96 120.40 117.69 1o5p s VAL 44 Ca 0.00 -1.65 0.00 0.00 0.00 0.00 0.00 61.98 60.33 1o5p s VAL 44 Cb 0.00 -2.89 0.07 0.00 0.00 0.00 0.00 36.38 33.56 1o5p s VAL 44 CO 0.00 -0.32 0.01 -0.22 0.00 0.00 0.00 175.10 174.57 1o5p s LEU 45 N 1.20 4.15 -0.39 3.92 2.96 -1.26 -2.09 118.68 127.16 1o5p s LEU 45 Ca 0.00 -1.59 -0.17 0.00 -0.22 0.00 0.00 54.13 52.15 1o5p s LEU 45 Cb -0.21 -1.67 0.01 0.00 0.50 0.00 0.00 46.19 44.82 1o5p s LEU 45 CO -0.02 -0.31 0.45 0.00 -1.32 0.00 0.00 176.35 175.15 1o5p s ALA 46 N 1.13 3.44 0.03 5.97 0.00 -0.67 -3.37 121.76 128.29 1o5p s ALA 46 Ca -0.01 -1.35 -0.01 0.00 0.00 0.00 0.00 51.96 50.60 1o5p s ALA 46 Cb -0.20 -3.01 -0.04 0.00 0.00 0.00 0.00 23.12 19.86 1o5p s ALA 46 CO -0.04 -1.43 0.16 0.00 0.00 0.00 0.00 175.76 174.44 1o5p s ASN 48 N -2.14 5.61 0.00 0.00 2.47 -0.82 -1.20 114.94 118.86 1o5p s ASN 48 Ca 0.29 0.01 0.00 0.00 0.42 0.00 0.00 52.86 53.58 1o5p s ASN 48 Cb -0.13 -1.99 0.00 0.00 -1.45 0.00 0.00 41.25 37.69 1o5p s ASN 48 CO 0.21 0.09 0.37 -0.81 -3.72 0.00 0.00 177.10 173.24 1o5p n PRO 49 N 4.09 0.53 -0.04 0.43 -0.05 -1.26 -2.98 135.00 135.72 1o5p n PRO 49 Ca -0.16 0.00 0.06 0.00 -0.05 0.00 0.00 63.50 63.35 1o5p n PRO 49 Cb 0.52 -1.25 0.07 0.00 -0.05 0.00 0.00 33.50 32.79 1o5p n PRO 49 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 175.50 175.45 1o5p n ALA 50 N 0.43 2.42 -1.60 0.55 0.00 -1.26 -4.41 120.51 116.64 1o5p n ALA 50 Ca 0.00 -0.71 0.00 0.00 0.00 0.00 0.00 53.44 52.73 1o5p n ALA 50 Cb 0.18 -0.41 0.00 0.00 0.00 0.00 0.00 19.45 19.22 1o5p n ALA 50 CO 0.00 0.00 0.00 -0.40 0.00 0.00 0.00 177.50 177.10 1o5p n ASP 51 N 0.65 0.05 -4.56 0.00 5.68 -1.16 -2.29 116.55 114.92 1o5p n ASP 51 Ca 0.08 -1.64 -0.40 0.00 -0.50 0.00 0.00 54.79 52.33 1o5p n ASP 51 Cb 0.33 -0.13 -0.03 0.00 -1.14 0.00 0.00 41.12 40.15 1o5p n ASP 51 CO 0.00 0.00 0.00 -0.36 -1.33 0.00 0.00 177.20 175.51 1o5p s PHE 52 N -0.05 2.43 0.00 2.11 0.40 -1.25 -3.30 117.98 118.32 1o5p s PHE 52 Ca 0.00 -0.60 0.00 0.00 -0.60 0.00 0.00 56.93 55.74 1o5p s PHE 52 Cb 0.00 -4.63 0.00 0.00 0.51 0.00 0.00 43.02 38.90 1o5p s PHE 52 CO 0.00 -1.95 0.00 0.43 0.70 0.00 0.00 175.22 174.40 1o5p n SER 53 N 9.40 0.87 0.00 1.36 7.64 0.72 -4.92 113.62 128.68 1o5p n SER 53 Ca 0.29 -0.57 0.00 0.00 1.01 0.00 0.00 58.87 59.60 1o5p n SER 53 Cb 0.50 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.70 1o5p n SER 53 CO 0.00 0.00 0.00 -0.24 -3.01 0.00 0.00 175.04 171.79 1o5p n SER 54 N -1.22 0.00 -3.65 6.43 2.88 -1.26 -2.18 113.62 114.61 1o5p n SER 54 Ca 0.00 0.00 -0.11 0.00 -1.33 0.00 0.00 58.87 57.43 1o5p n SER 54 Cb 0.00 0.00 -0.05 0.00 -0.75 0.00 0.00 64.21 63.41 1o5p n SER 54 CO 0.00 0.00 0.00 0.54 -1.23 0.00 0.00 175.04 174.35 1o5p s VAL 55 N -0.53 0.07 0.03 2.46 0.11 -0.64 -4.96 120.40 116.94 1o5p s VAL 55 Ca 0.00 -0.55 -0.05 0.00 -2.93 0.00 0.00 61.98 58.45 1o5p s VAL 55 Cb 0.00 -1.08 -0.05 0.00 -1.53 0.00 0.00 36.38 33.72 1o5p s VAL 55 CO 0.00 -0.30 0.27 -0.89 -3.33 0.00 0.00 175.10 170.85 1o5p s THR 56 N -3.26 5.30 -0.36 5.04 2.01 -1.26 0.38 115.64 123.49 1o5p s THR 56 Ca -0.00 0.07 -0.28 0.00 0.31 0.00 0.00 61.69 61.79 1o5p s THR 56 Cb 0.01 -3.58 -0.03 0.00 0.01 0.00 0.00 72.50 68.91 1o5p s THR 56 CO -0.08 0.30 1.92 0.00 -0.69 0.00 0.00 174.62 176.07 1o5p s ALA 57 N -1.37 2.67 0.00 7.40 0.00 -1.11 -4.70 121.76 124.66 1o5p s ALA 57 Ca 0.30 0.22 0.00 0.00 0.00 0.00 0.00 51.96 52.48 1o5p s ALA 57 Cb -0.13 -4.08 0.00 0.00 0.00 0.00 0.00 23.12 18.91 1o5p s ALA 57 CO 0.18 -2.94 0.00 -3.47 0.00 0.00 0.00 175.76 169.53 1o5p n ASP 58 N 11.21 0.00 -0.13 0.00 2.03 -1.26 0.31 116.55 128.71 1o5p n ASP 58 Ca 0.25 0.00 -0.05 0.00 0.52 0.00 0.00 54.79 55.51 1o5p n ASP 58 Cb 0.48 0.00 0.01 0.00 -0.72 0.00 0.00 41.12 40.89 1o5p n ASP 58 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 1o5p h ALA 59 N -2.00 0.13 0.00 -1.67 0.00 -1.92 -3.09 119.26 110.70 1o5p h ALA 59 Ca 0.00 0.15 -0.29 0.00 0.00 0.00 0.00 54.91 54.78 1o5p h ALA 59 Cb 0.00 0.48 -0.05 0.00 0.00 0.00 0.00 17.79 18.22 1o5p h ALA 59 CO 0.00 -0.55 -2.08 0.09 0.00 0.00 0.00 179.25 176.71 1o5p n ASN 60 N -5.38 1.49 0.00 0.00 3.02 -1.26 -4.56 115.26 108.56 1o5p n ASN 60 Ca 0.03 -0.03 0.00 0.00 -0.03 0.00 0.00 54.58 54.55 1o5p n ASN 60 Cb 0.29 0.60 0.00 0.00 -0.61 0.00 0.00 39.78 40.06 1o5p n ASN 60 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1o5p n GLY 61 N 2.17 0.71 3.66 7.41 0.00 -1.17 -1.84 105.19 116.13 1o5p n GLY 61 Ca -0.28 -0.77 -0.35 0.00 0.00 0.00 0.00 46.02 44.62 1o5p n GLY 61 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1o5p s SER 62 N -1.19 5.90 -0.20 1.61 0.01 -1.25 -2.44 113.70 116.15 1o5p s SER 62 Ca 0.00 0.11 -0.04 0.00 1.31 0.00 0.00 55.95 57.34 1o5p s SER 62 Cb 0.00 -2.04 0.06 0.00 0.21 0.00 0.00 66.02 64.26 1o5p s SER 62 CO 0.00 0.13 0.07 0.00 0.41 0.00 0.00 173.24 173.85 1o5p s ALA 63 N 0.63 0.78 -0.17 1.44 0.00 0.12 -4.61 121.76 119.96 1o5p s ALA 63 Ca 0.06 -0.62 0.01 0.00 0.00 0.00 0.00 51.96 51.40 1o5p s ALA 63 Cb -0.12 -1.16 0.02 0.00 0.00 0.00 0.00 23.12 21.86 1o5p s ALA 63 CO 0.01 -1.23 -0.18 -1.54 0.00 0.00 0.00 175.76 172.82 1o5p s SER 64 N 1.97 2.93 -0.02 0.00 1.04 -1.26 0.10 113.70 118.47 1o5p s SER 64 Ca 0.01 -0.58 -0.09 0.00 0.48 0.00 0.00 55.95 55.78 1o5p s SER 64 Cb -0.17 -1.35 0.01 0.00 0.10 0.00 0.00 66.02 64.61 1o5p s SER 64 CO -0.11 -0.02 0.18 0.28 0.98 0.00 0.00 173.24 174.54 1o5p s THR 65 N 1.37 0.06 -0.10 2.02 -1.32 -0.52 -4.99 115.64 112.16 1o5p s THR 65 Ca 0.05 -0.52 -0.09 0.00 -1.21 0.00 0.00 61.69 59.92 1o5p s THR 65 Cb -0.13 -0.44 -0.04 0.00 -1.51 0.00 0.00 72.50 70.38 1o5p s THR 65 CO -0.12 -0.28 0.19 -0.94 -2.21 0.00 0.00 174.62 171.26 1o5p s SER 66 N -1.08 6.47 0.05 8.08 1.04 -1.26 -1.96 113.70 125.05 1o5p s SER 66 Ca -0.12 0.56 -0.05 0.00 0.48 0.00 0.00 55.95 56.82 1o5p s SER 66 Cb -0.06 -2.11 -0.02 0.00 0.10 0.00 0.00 66.02 63.94 1o5p s SER 66 CO 0.02 0.39 0.09 -1.48 0.98 0.00 0.00 173.24 173.24 1o5p s LEU 67 N -1.00 1.86 0.08 2.42 0.05 -0.48 -4.95 118.68 116.66 1o5p s LEU 67 Ca 0.17 -0.67 -0.23 0.00 0.05 0.00 0.00 54.13 53.44 1o5p s LEU 67 Cb -0.13 0.63 -0.07 0.00 -2.05 0.00 0.00 46.19 44.57 1o5p s LEU 67 CO 0.06 -0.59 0.70 0.28 -0.55 0.00 0.00 176.35 176.24 1o5p s THR 68 N -3.26 4.64 -0.10 5.48 -1.32 -0.97 -0.34 115.64 119.78 1o5p s THR 68 Ca 0.01 1.50 -0.11 0.00 -1.21 0.00 0.00 61.69 61.87 1o5p s THR 68 Cb 0.03 -4.04 0.03 0.00 -1.51 0.00 0.00 72.50 67.00 1o5p s THR 68 CO -0.08 0.47 0.30 0.68 -2.21 0.00 0.00 174.62 173.79 1o5p s VAL 69 N -0.69 0.01 0.02 5.08 -7.23 -0.91 -3.80 120.40 112.87 1o5p s VAL 69 Ca 0.34 -0.07 0.00 0.00 -1.81 0.00 0.00 61.98 60.44 1o5p s VAL 69 Cb -0.21 -0.46 -0.00 0.00 0.56 0.00 0.00 36.38 36.28 1o5p s VAL 69 CO 0.22 -0.04 0.03 -2.11 -0.31 0.00 0.00 175.10 172.89 1o5p n ARG 70 N 2.68 0.04 0.00 4.82 1.85 -1.26 -4.22 116.66 120.57 1o5p n ARG 70 Ca -0.14 -0.22 0.00 0.00 -1.00 0.00 0.00 57.85 56.49 1o5p n ARG 70 Cb 0.58 0.19 0.00 0.00 -1.05 0.00 0.00 32.46 32.18 1o5p n ARG 70 CO 0.00 0.00 0.00 2.89 -0.01 0.00 0.00 177.63 180.51 1o5p n ARG 71 N -0.04 0.00 -1.73 2.89 -4.01 -1.26 -4.62 116.66 107.88 1o5p n ARG 71 Ca 0.00 0.00 -0.42 0.00 -1.04 0.00 0.00 57.85 56.39 1o5p n ARG 71 Cb 0.04 -0.21 -0.01 0.00 -3.04 0.00 0.00 32.46 29.24 1o5p n ARG 71 CO 0.00 0.00 0.00 0.43 -3.04 0.00 0.00 177.63 175.02 1o5p n SER 72 N 0.00 3.36 -3.63 2.89 7.64 -1.26 -1.97 113.62 120.64 1o5p n SER 72 Ca 0.00 1.19 -0.11 0.00 1.01 0.00 0.00 58.87 60.95 1o5p n SER 72 Cb 0.00 -1.54 -0.07 0.00 -1.01 0.00 0.00 64.21 61.59 1o5p n SER 72 CO 0.00 0.00 0.00 0.72 -3.01 0.00 0.00 175.04 172.75 1o5p s PHE 73 N -0.62 -0.75 -0.31 1.43 -0.71 -0.78 -4.82 117.98 111.42 1o5p s PHE 73 Ca 0.59 1.76 -0.29 0.00 -1.04 0.00 0.00 56.93 57.95 1o5p s PHE 73 Cb -0.54 0.35 -0.12 0.00 -1.21 0.00 0.00 43.02 41.50 1o5p s PHE 73 CO 0.57 -0.37 1.03 0.39 -1.34 0.00 0.00 175.22 175.50 1o5p n GLU 74 N 2.89 0.00 -1.70 1.99 -0.58 -1.26 -1.46 120.64 120.52 1o5p n GLU 74 Ca -0.15 0.00 -0.34 0.00 -0.42 0.00 0.00 57.16 56.25 1o5p n GLU 74 Cb 0.56 -0.93 0.00 0.00 -0.57 0.00 0.00 31.44 30.50 1o5p n GLU 74 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 1o5p n GLY 75 N 2.72 5.02 3.53 0.62 0.00 -0.50 -2.44 105.19 114.14 1o5p n GLY 75 Ca 0.21 -2.20 -0.64 0.00 0.00 0.00 0.00 46.02 43.38 1o5p n GLY 75 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 1o5p n PHE 76 N 0.04 1.49 -2.99 1.61 3.01 -0.34 -2.33 117.46 117.95 1o5p n PHE 76 Ca 0.52 0.98 -0.40 0.00 1.01 0.00 0.00 57.45 59.55 1o5p n PHE 76 Cb 0.38 -2.26 -0.04 0.00 -0.01 0.00 0.00 39.48 37.55 1o5p n PHE 76 CO 0.00 0.00 0.00 -1.17 1.01 0.00 0.00 176.76 176.60 1o5p s LEU 77 N 4.33 4.25 -0.30 4.37 2.96 -0.64 -1.47 118.68 132.19 1o5p s LEU 77 Ca 1.12 1.17 -0.02 0.00 -0.22 0.00 0.00 54.13 56.18 1o5p s LEU 77 Cb -1.50 -3.14 -0.03 0.00 0.50 0.00 0.00 46.19 42.03 1o5p s LEU 77 CO 0.75 -0.23 1.40 0.33 -1.32 0.00 0.00 176.35 177.28 1o5p n PHE 78 N 4.39 0.44 -1.98 5.38 7.35 -1.22 -2.89 117.46 128.94 1o5p n PHE 78 Ca 0.01 -0.94 0.00 0.00 -0.76 0.00 0.00 57.45 55.76 1o5p n PHE 78 Cb 0.50 -0.96 0.00 0.00 0.35 0.00 0.00 39.48 39.37 1o5p n PHE 78 CO 0.00 0.00 0.00 -3.47 -0.76 0.00 0.00 176.76 172.53 1o5p n ASP 79 N 4.31 0.00 0.00 -2.13 2.03 -1.26 -4.98 116.55 114.52 1o5p n ASP 79 Ca 0.16 -0.98 0.00 0.00 0.52 0.00 0.00 54.79 54.50 1o5p n ASP 79 Cb 0.08 0.00 0.00 0.00 -0.72 0.00 0.00 41.12 40.48 1o5p n ASP 79 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 1o5p n GLY 80 N 0.00 2.75 3.91 0.27 0.00 -1.14 -4.99 105.19 105.99 1o5p n GLY 80 Ca 0.00 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.75 1o5p n GLY 80 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1o5p s THR 81 N -1.04 5.04 -0.14 2.61 -4.23 -1.26 -4.96 115.64 111.67 1o5p s THR 81 Ca 0.00 -0.07 -0.05 0.00 -1.18 0.00 0.00 61.69 60.39 1o5p s THR 81 Cb 0.00 -3.77 -0.04 0.00 1.34 0.00 0.00 72.50 70.03 1o5p s THR 81 CO 0.00 -0.41 0.04 0.00 -0.54 0.00 0.00 174.62 173.71 1o5p s ARG 82 N -3.80 3.52 0.27 3.99 1.70 -1.26 -1.62 118.95 121.76 1o5p s ARG 82 Ca 0.43 -0.36 0.24 0.00 -0.47 0.00 0.00 55.73 55.57 1o5p s ARG 82 Cb -0.10 -3.03 0.48 0.00 -0.57 0.00 0.00 34.95 31.73 1o5p s ARG 82 CO 0.32 0.49 1.56 2.35 -1.08 0.00 0.00 175.30 178.94 1o5p h TRP 83 N 5.94 0.00 0.00 5.89 7.01 -1.79 -3.46 115.95 129.54 1o5p h TRP 83 Ca -0.43 0.00 0.00 0.00 2.11 0.00 0.00 58.89 60.57 1o5p h TRP 83 Cb 1.19 0.00 0.00 0.00 -2.10 0.00 0.00 29.16 28.25 1o5p h TRP 83 CO 0.61 0.00 0.00 0.41 -2.79 0.00 0.00 178.44 176.67 1o5p n GLY 84 N 1.23 0.99 3.58 2.65 0.00 -1.26 -4.86 105.19 107.51 1o5p n GLY 84 Ca 0.04 -2.14 -0.40 0.00 0.00 0.00 0.00 46.02 43.52 1o5p n GLY 84 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1o5p s THR 85 N -1.36 3.13 -0.59 2.61 -4.23 -1.26 -1.40 115.64 112.54 1o5p s THR 85 Ca 0.00 0.12 -0.28 0.00 -1.18 0.00 0.00 61.69 60.35 1o5p s THR 85 Cb 0.00 -3.24 0.01 0.00 1.34 0.00 0.00 72.50 70.61 1o5p s THR 85 CO 0.00 -0.19 1.42 -0.69 -0.54 0.00 0.00 174.62 174.62 1o5p s VAL 86 N 9.50 3.75 -0.26 2.29 1.01 -0.54 -4.62 120.40 131.53 1o5p s VAL 86 Ca 0.92 0.61 -0.28 0.00 0.00 0.00 0.00 61.98 63.23 1o5p s VAL 86 Cb -0.23 -4.47 -0.04 0.00 0.00 0.00 0.00 36.38 31.63 1o5p s VAL 86 CO 0.30 -1.25 2.11 -1.81 0.00 0.00 0.00 175.10 174.45 1o5p s ASP 87 N 4.56 5.53 0.00 3.32 1.01 -1.26 -1.86 116.67 127.96 1o5p s ASP 87 Ca 0.51 1.68 0.09 0.00 0.71 0.00 0.00 52.55 55.54 1o5p s ASP 87 Cb -0.10 -2.51 0.47 0.00 1.01 0.00 0.00 42.92 41.78 1o5p s ASP 87 CO 0.23 -1.94 1.13 0.00 0.21 0.00 0.00 175.17 174.80 1o5p n THR 89 N -1.22 0.10 -0.00 0.00 -2.24 -1.26 -4.07 114.28 105.59 1o5p n THR 89 Ca 0.05 -0.19 -0.01 0.00 -2.27 0.00 0.00 64.05 61.63 1o5p n THR 89 Cb 0.06 0.07 -0.00 0.00 -2.10 0.00 0.00 70.33 68.36 1o5p n THR 89 CO 0.00 0.00 0.00 0.35 -0.57 0.00 0.00 175.07 174.85 1o5p n THR 90 N -0.20 0.05 -3.53 4.28 -2.24 -0.44 -5.08 114.28 107.12 1o5p n THR 90 Ca 0.16 -0.01 -0.21 0.00 -2.27 0.00 0.00 64.05 61.71 1o5p n THR 90 Cb 0.21 -1.42 0.03 0.00 -2.10 0.00 0.00 70.33 67.05 1o5p n THR 90 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1o5p n ALA 91 N -2.99 0.92 -2.96 6.98 0.00 -1.20 -5.09 120.51 116.16 1o5p n ALA 91 Ca -0.02 -1.98 -0.38 0.00 0.00 0.00 0.00 53.44 51.06 1o5p n ALA 91 Cb 0.51 0.71 -0.12 0.00 0.00 0.00 0.00 19.45 20.55 1o5p n ALA 91 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1o5p s ALA 92 N -2.69 3.21 -0.22 0.00 0.00 -1.26 -4.72 121.76 116.08 1o5p s ALA 92 Ca 0.39 -1.41 -0.14 0.00 0.00 0.00 0.00 51.96 50.80 1o5p s ALA 92 Cb -0.03 -2.31 -0.04 0.00 0.00 0.00 0.00 23.12 20.73 1o5p s ALA 92 CO 0.25 -0.92 0.29 0.00 0.00 0.00 0.00 175.76 175.39 1o5p s GLN 94 N 1.24 3.07 -0.41 0.00 1.11 -0.22 -2.50 119.66 121.95 1o5p s GLN 94 Ca 0.14 -0.52 -0.15 0.00 0.01 0.00 0.00 55.36 54.84 1o5p s GLN 94 Cb -0.14 -2.85 0.02 0.00 -1.01 0.00 0.00 33.01 29.03 1o5p s GLN 94 CO 0.07 0.63 0.30 0.08 0.01 0.00 0.00 175.29 176.37 1o5p s VAL 95 N -1.26 5.20 0.15 1.09 1.01 0.14 -2.23 120.40 124.49 1o5p s VAL 95 Ca 0.25 -0.70 0.01 0.00 0.00 0.00 0.00 61.98 61.54 1o5p s VAL 95 Cb -0.12 -3.90 -0.00 0.00 0.00 0.00 0.00 36.38 32.35 1o5p s VAL 95 CO 0.17 -0.32 0.18 0.61 0.00 0.00 0.00 175.10 175.75 1o5p n GLY 96 N 5.15 2.96 3.36 4.51 0.00 -1.05 0.30 105.19 120.41 1o5p n GLY 96 Ca -0.11 -1.57 -0.28 0.00 0.00 0.00 0.00 46.02 44.05 1o5p n GLY 96 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1o5p n LEU 97 N 0.00 0.00 -3.66 0.99 4.32 -1.25 -2.14 117.00 115.26 1o5p n LEU 97 Ca 0.01 -2.85 0.00 0.00 -0.02 0.00 0.00 56.01 53.16 1o5p n LEU 97 Cb 0.26 0.24 -0.01 0.00 -1.62 0.00 0.00 43.42 42.29 1o5p n LEU 97 CO 0.13 -0.45 0.97 -0.94 -1.22 0.00 0.00 177.39 175.89 1o5p s SER 98 N -3.65 -0.09 0.00 -1.43 1.04 -0.09 -4.33 113.70 105.16 1o5p s SER 98 Ca 0.07 -0.21 0.15 0.00 0.48 0.00 0.00 55.95 56.43 1o5p s SER 98 Cb -0.01 0.25 -0.14 0.00 0.10 0.00 0.00 66.02 66.22 1o5p s SER 98 CO 0.04 -0.46 0.65 0.47 0.98 0.00 0.00 173.24 174.93 1o5p n ASP 99 N -0.50 0.81 -1.61 7.02 8.00 -1.24 0.25 116.55 129.28 1o5p n ASP 99 Ca -0.08 -0.90 -0.09 0.00 0.71 0.00 0.00 54.79 54.43 1o5p n ASP 99 Cb 0.62 0.93 0.03 0.00 -0.02 0.00 0.00 41.12 42.69 1o5p n ASP 99 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1o5p n ALA 100 N -1.20 -0.47 0.00 2.24 0.00 -1.26 -4.78 120.51 115.04 1o5p n ALA 100 Ca 0.03 0.15 0.00 0.00 0.00 0.00 0.00 53.44 53.62 1o5p n ALA 100 Cb 0.24 -2.31 0.00 0.00 0.00 0.00 0.00 19.45 17.38 1o5p n ALA 100 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1o5p n ALA 101 N -3.37 1.52 0.00 0.00 0.00 -1.26 -5.04 120.51 112.36 1o5p n ALA 101 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.44 1o5p n ALA 101 Cb 0.52 0.05 0.00 0.00 0.00 0.00 0.00 19.45 20.02 1o5p n ALA 101 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1o5p n GLY 102 N 1.24 0.00 3.10 0.00 0.00 -1.26 -5.15 105.19 103.12 1o5p n GLY 102 Ca 0.00 -0.02 -0.06 0.00 0.00 0.00 0.00 46.02 45.94 1o5p n GLY 102 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1o5p n ASN 103 N -1.05 -1.80 -0.59 1.61 5.03 -1.26 -5.07 115.26 112.13 1o5p n ASN 103 Ca 0.00 -2.20 0.00 0.00 0.87 0.00 0.00 54.58 53.25 1o5p n ASN 103 Cb 0.00 2.99 0.00 0.00 -1.02 0.00 0.00 39.78 41.75 1o5p n ASN 103 CO 0.00 0.00 0.00 0.61 -1.83 0.00 0.00 177.26 176.04 1o5p n GLY 104 N -0.47 0.88 1.75 7.41 0.00 -1.26 -3.65 105.19 109.86 1o5p n GLY 104 Ca -0.06 -0.75 -0.09 0.00 0.00 0.00 0.00 46.02 45.12 1o5p n GLY 104 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 1o5p n PRO 105 N 0.00 -0.74 -2.58 1.61 -0.02 -1.26 -4.95 135.00 127.05 1o5p n PRO 105 Ca 0.00 -0.42 -0.20 0.00 -2.02 0.00 0.00 63.50 60.87 1o5p n PRO 105 Cb 0.00 -0.85 0.09 0.00 -0.02 0.00 0.00 33.50 32.72 1o5p n PRO 105 CO 0.00 0.00 0.00 0.39 1.98 0.00 0.00 175.50 177.87 1o5p n GLU 106 N -1.12 0.26 -4.35 -0.52 -0.58 -1.26 -4.70 120.64 108.37 1o5p n GLU 106 Ca 0.04 -2.65 -0.24 0.00 -0.42 0.00 0.00 57.16 53.89 1o5p n GLU 106 Cb 0.17 -0.43 -0.09 0.00 -0.57 0.00 0.00 31.44 30.53 1o5p n GLU 106 CO 0.00 0.00 0.00 0.20 -0.48 0.00 0.00 177.13 176.85 1o5p s GLY 107 N -4.66 1.74 -0.20 0.62 0.00 -1.26 -3.86 107.32 99.69 1o5p s GLY 107 Ca 0.58 -1.69 -0.11 0.00 0.00 0.00 0.00 44.72 43.50 1o5p s GLY 107 CO 0.38 -1.75 0.18 0.14 0.00 0.00 0.00 173.10 172.05 1o5p s VAL 108 N -2.24 5.36 -0.15 1.40 1.01 0.15 -4.73 120.40 121.21 1o5p s VAL 108 Ca 0.29 0.29 -0.29 0.00 0.00 0.00 0.00 61.98 62.27 1o5p s VAL 108 Cb -0.06 -3.52 -0.03 0.00 0.00 0.00 0.00 36.38 32.76 1o5p s VAL 108 CO 0.17 0.39 1.41 0.00 0.00 0.00 0.00 175.10 177.08 1o5p s ALA 109 N 0.63 3.60 0.51 5.51 0.00 -1.26 0.25 121.76 130.99 1o5p s ALA 109 Ca 0.10 0.58 0.06 0.00 0.00 0.00 0.00 51.96 52.70 1o5p s ALA 109 Cb -0.12 -3.69 0.04 0.00 0.00 0.00 0.00 23.12 19.35 1o5p s ALA 109 CO 0.01 -1.34 0.70 0.96 0.00 0.00 0.00 175.76 176.09 1o5p s ILE 110 N 3.86 2.66 0.04 0.00 -4.36 -1.04 -4.85 121.20 117.52 1o5p s ILE 110 Ca 0.62 -0.90 -0.02 0.00 -0.26 0.00 0.00 60.65 60.09 1o5p s ILE 110 Cb -0.25 -2.77 -0.03 0.00 1.25 0.00 0.00 42.46 40.66 1o5p s ILE 110 CO 0.21 0.00 -0.01 -0.55 0.24 0.00 0.00 174.94 174.83 1o5p s SER 111 N -4.47 0.38 -0.15 4.36 0.15 0.18 -4.71 113.70 109.43 1o5p s SER 111 Ca 0.58 -0.81 -0.02 0.00 0.70 0.00 0.00 55.95 56.41 1o5p s SER 111 Cb -0.09 0.18 0.04 0.00 -1.71 0.00 0.00 66.02 64.45 1o5p s SER 111 CO 0.36 -0.52 -0.01 -0.36 1.20 0.00 0.00 173.24 173.92 1o5p s PHE 112 N -3.15 1.18 -0.38 3.44 0.40 -1.26 -2.97 117.98 115.23 1o5p s PHE 112 Ca -0.00 -0.75 0.00 0.00 -0.60 0.00 0.00 56.93 55.57 1o5p s PHE 112 Cb 0.02 -1.07 0.00 0.00 0.51 0.00 0.00 43.02 42.48 1o5p s PHE 112 CO -0.07 -0.54 0.09 0.27 0.70 0.00 0.00 175.22 175.68