#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 3.42 0.78 0.00 0.00 -1.26 -5.00 121.76 119.70 1o5p s ALA 2 Ca 0.00 -1.29 -0.14 0.00 0.00 0.00 0.00 51.96 50.54 1o5p s ALA 2 Cb 0.00 -2.31 0.07 0.00 0.00 0.00 0.00 23.12 20.88 1o5p s ALA 2 CO 0.00 -1.31 1.20 -1.25 0.00 0.00 0.00 175.76 174.40 1o5p s PRO 3 N -5.15 1.79 0.08 0.00 0.04 0.16 -4.69 135.00 127.22 1o5p s PRO 3 Ca 0.62 1.74 -0.02 0.00 0.04 0.00 0.00 61.00 63.38 1o5p s PRO 3 Cb -0.08 -1.80 -0.03 0.00 0.04 0.00 0.00 34.50 32.63 1o5p s PRO 3 CO 0.44 -2.09 0.03 0.95 0.04 0.00 0.00 177.00 176.37 1o5p s THR 4 N -2.13 0.17 -0.10 1.26 -4.23 1.15 -4.90 115.64 106.86 1o5p s THR 4 Ca 0.73 -1.73 -0.05 0.00 -1.18 0.00 0.00 61.69 59.46 1o5p s THR 4 Cb -0.28 -1.64 0.05 0.00 1.34 0.00 0.00 72.50 71.96 1o5p s THR 4 CO 0.49 -0.79 0.22 0.00 -0.54 0.00 0.00 174.62 174.00 1o5p s ALA 5 N -3.95 -0.48 -0.44 3.99 0.00 -1.26 0.23 121.76 119.86 1o5p s ALA 5 Ca 0.11 0.91 -0.12 0.00 0.00 0.00 0.00 51.96 52.86 1o5p s ALA 5 Cb 0.07 -0.64 0.08 0.00 0.00 0.00 0.00 23.12 22.63 1o5p s ALA 5 CO -0.07 -0.25 0.32 0.95 0.00 0.00 0.00 175.76 176.72 1o5p s THR 6 N 1.39 4.62 -0.19 0.00 -4.23 -0.14 -4.78 115.64 112.31 1o5p s THR 6 Ca -0.08 -1.29 0.01 0.00 -1.18 0.00 0.00 61.69 59.15 1o5p s THR 6 Cb -0.11 -3.81 0.02 0.00 1.34 0.00 0.00 72.50 69.94 1o5p s THR 6 CO -0.08 -0.55 -0.19 -0.69 -0.54 0.00 0.00 174.62 172.57 1o5p s VAL 7 N 1.51 2.12 -0.09 2.29 1.01 -1.24 0.12 120.40 126.12 1o5p s VAL 7 Ca 0.03 -0.98 -0.30 0.00 0.00 0.00 0.00 61.98 60.73 1o5p s VAL 7 Cb -0.24 -1.92 0.09 0.00 0.00 0.00 0.00 36.38 34.31 1o5p s VAL 7 CO 0.04 0.49 0.80 -0.89 0.00 0.00 0.00 175.10 175.54 1o5p s THR 8 N 1.28 0.00 0.56 3.92 2.01 -0.74 -4.38 115.64 118.29 1o5p s THR 8 Ca 0.04 0.00 -0.17 0.00 0.31 0.00 0.00 61.69 61.87 1o5p s THR 8 Cb -0.14 -1.00 -0.05 0.00 0.01 0.00 0.00 72.50 71.32 1o5p s THR 8 CO -0.12 0.00 1.05 -2.16 -0.69 0.00 0.00 174.62 172.70 1o5p s PRO 9 N -1.27 3.47 0.03 4.92 0.05 -1.26 -0.97 135.00 139.96 1o5p s PRO 9 Ca -0.07 1.25 0.20 0.00 0.05 0.00 0.00 61.00 62.43 1o5p s PRO 9 Cb -0.00 -2.05 -0.18 0.00 0.05 0.00 0.00 34.50 32.31 1o5p s PRO 9 CO 0.06 -0.69 0.66 0.43 0.05 0.00 0.00 177.00 177.50 1o5p n SER 10 N -1.70 0.48 -4.20 6.66 7.64 -1.26 -4.81 113.62 116.43 1o5p n SER 10 Ca 0.09 0.20 -0.12 0.00 1.01 0.00 0.00 58.87 60.05 1o5p n SER 10 Cb 0.53 0.87 -0.10 0.00 -1.01 0.00 0.00 64.21 64.50 1o5p n SER 10 CO 0.00 0.00 0.00 -0.44 -3.01 0.00 0.00 175.04 171.59 1o5p s SER 11 N -5.29 1.01 -0.26 6.43 0.01 -1.26 0.58 113.70 114.92 1o5p s SER 11 Ca -0.05 -1.12 -0.01 0.00 1.31 0.00 0.00 55.95 56.07 1o5p s SER 11 Cb 0.10 0.14 0.00 0.00 0.21 0.00 0.00 66.02 66.47 1o5p s SER 11 CO 0.84 -0.57 0.16 0.61 0.41 0.00 0.00 173.24 174.69 1o5p n GLY 12 N -0.15 0.58 0.13 3.44 0.00 -1.14 -4.90 105.19 103.15 1o5p n GLY 12 Ca -0.08 -0.56 -0.22 0.00 0.00 0.00 0.00 46.02 45.16 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 -1.13 2.33 -1.10 0.99 4.77 -1.26 -5.06 117.00 116.53 1o5p n LEU 13 Ca -0.01 0.29 0.00 0.00 -0.03 0.00 0.00 56.01 56.26 1o5p n LEU 13 Cb 0.52 -1.05 0.00 0.00 -2.33 0.00 0.00 43.42 40.55 1o5p n LEU 13 CO 0.10 0.63 -0.33 -0.24 -1.33 0.00 0.00 177.39 176.22 1o5p n SER 14 N -3.87 -6.10 -4.48 -1.43 2.88 -1.26 -3.78 113.62 95.59 1o5p n SER 14 Ca -0.33 1.07 -0.46 0.00 -1.33 0.00 0.00 58.87 57.82 1o5p n SER 14 Cb 0.90 -3.13 -0.08 0.00 -0.75 0.00 0.00 64.21 61.16 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 -1.55 1.87 0.00 -3.46 5.75 -1.26 -2.00 116.55 115.90 1o5p n ASP 15 Ca 0.00 0.17 0.00 0.00 -0.01 0.00 0.00 54.79 54.95 1o5p n ASP 15 Cb 0.15 -1.28 0.00 0.00 -1.03 0.00 0.00 41.12 38.97 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 6.42 1.48 0.00 6.12 0.00 -1.26 -5.06 105.19 112.89 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 -0.45 0.00 -4.12 2.61 5.66 -0.85 -4.95 114.28 112.17 1o5p n THR 17 Ca 0.00 0.00 -0.15 0.00 -3.05 0.00 0.00 64.05 60.85 1o5p n THR 17 Cb 0.00 -0.92 -0.14 0.00 -1.55 0.00 0.00 70.33 67.72 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 0.90 0.43 0.20 1.08 1.01 -1.26 -2.09 120.40 120.67 1o5p s VAL 18 Ca 0.00 -0.47 0.11 0.00 0.00 0.00 0.00 61.98 61.63 1o5p s VAL 18 Cb 0.00 -0.41 -0.04 0.00 0.00 0.00 0.00 36.38 35.92 1o5p s VAL 18 CO 0.00 -0.03 -0.23 0.68 0.00 0.00 0.00 175.10 175.51 1o5p s VAL 19 N -0.49 2.31 -0.37 2.92 -7.23 0.94 -4.71 120.40 113.77 1o5p s VAL 19 Ca -0.02 -2.05 -0.09 0.00 -1.81 0.00 0.00 61.98 58.01 1o5p s VAL 19 Cb -0.04 -2.11 0.04 0.00 0.56 0.00 0.00 36.38 34.83 1o5p s VAL 19 CO -0.00 -0.16 0.19 -0.75 -0.31 0.00 0.00 175.10 174.07 1o5p s LYS 20 N -2.74 2.72 -0.23 4.82 2.20 -0.14 -1.11 119.74 125.25 1o5p s LYS 20 Ca 0.21 -1.18 -0.07 0.00 -0.36 0.00 0.00 55.97 54.56 1o5p s LYS 20 Cb -0.07 -3.67 -0.03 0.00 -1.51 0.00 0.00 37.83 32.55 1o5p s LYS 20 CO 0.10 -0.74 0.07 0.54 -0.36 0.00 0.00 175.35 174.96 1o5p s VAL 21 N 1.49 4.42 0.35 4.02 0.11 -0.85 -1.79 120.40 128.14 1o5p s VAL 21 Ca 0.01 -0.14 0.08 0.00 -2.93 0.00 0.00 61.98 59.00 1o5p s VAL 21 Cb -0.20 -3.05 -0.05 0.00 -1.53 0.00 0.00 36.38 31.55 1o5p s VAL 21 CO 0.05 0.36 0.08 0.00 -3.33 0.00 0.00 175.10 172.26 1o5p s ALA 22 N 1.34 3.35 -0.21 1.54 0.00 0.33 -2.25 121.76 125.86 1o5p s ALA 22 Ca 0.05 -1.95 -0.04 0.00 0.00 0.00 0.00 51.96 50.02 1o5p s ALA 22 Cb -0.15 -0.47 0.09 0.00 0.00 0.00 0.00 23.12 22.59 1o5p s ALA 22 CO 0.04 0.02 0.18 0.20 0.00 0.00 0.00 175.76 176.19 1o5p s GLY 23 N -3.78 0.16 -0.02 0.00 0.00 0.22 -0.97 107.32 102.93 1o5p s GLY 23 Ca 0.37 -0.15 0.06 0.00 0.00 0.00 0.00 44.72 45.00 1o5p s GLY 23 CO 0.21 2.06 -0.19 0.00 0.00 0.00 0.00 173.10 175.18 1o5p s ALA 24 N 2.24 2.48 0.00 3.20 0.00 0.64 0.66 121.76 130.98 1o5p s ALA 24 Ca 0.06 -1.08 0.00 0.00 0.00 0.00 0.00 51.96 50.94 1o5p s ALA 24 Cb -0.16 -0.77 0.00 0.00 0.00 0.00 0.00 23.12 22.19 1o5p s ALA 24 CO -0.16 0.55 0.00 0.41 0.00 0.00 0.00 175.76 176.56 1o5p n GLY 25 N 2.17 0.75 3.99 0.00 0.00 -0.91 0.36 105.19 111.55 1o5p n GLY 25 Ca -0.17 -0.69 -0.20 0.00 0.00 0.00 0.00 46.02 44.97 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 3.37 -0.82 0.99 1.43 -0.96 -0.67 118.68 122.02 1o5p s LEU 26 Ca 0.00 -0.21 -0.31 0.00 -1.03 0.00 0.00 54.13 52.58 1o5p s LEU 26 Cb 0.00 -2.69 -0.18 0.00 0.03 0.00 0.00 46.19 43.35 1o5p s LEU 26 CO 0.00 -1.08 2.57 0.00 0.23 0.00 0.00 176.35 178.08 1o5p n GLN 27 N -2.21 0.29 -1.30 1.70 3.00 -1.26 -4.03 117.38 113.56 1o5p n GLN 27 Ca 0.09 0.01 -0.17 0.00 -0.01 0.00 0.00 57.00 56.92 1o5p n GLN 27 Cb 0.60 -1.99 -0.10 0.00 0.00 0.00 0.00 30.24 28.74 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 11.50 0.33 0.00 -1.58 0.00 -1.23 -1.20 120.51 128.33 1o5p n ALA 28 Ca 0.57 -2.10 0.00 0.00 0.00 0.00 0.00 53.44 51.92 1o5p n ALA 28 Cb 0.15 -2.95 0.00 0.00 0.00 0.00 0.00 19.45 16.65 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 5.66 0.44 2.59 0.00 0.00 0.93 -4.83 105.19 109.98 1o5p n GLY 29 Ca 0.36 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 46.11 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 -0.56 -0.06 -0.36 2.61 -4.23 -0.34 -4.87 115.64 107.82 1o5p s THR 30 Ca 0.00 -0.36 -0.36 0.00 -1.18 0.00 0.00 61.69 59.78 1o5p s THR 30 Cb 0.00 -0.72 -0.12 0.00 1.34 0.00 0.00 72.50 73.00 1o5p s THR 30 CO 0.00 -0.42 2.18 0.00 -0.54 0.00 0.00 174.62 175.85 1o5p n ALA 31 N 5.26 0.98 -2.84 3.99 0.00 -1.26 -2.71 120.51 123.93 1o5p n ALA 31 Ca -0.07 -0.03 -0.27 0.00 0.00 0.00 0.00 53.44 53.08 1o5p n ALA 31 Cb 0.47 -2.49 -0.05 0.00 0.00 0.00 0.00 19.45 17.38 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 7.16 3.26 0.21 0.00 2.02 0.15 -4.58 117.35 125.56 1o5p s TYR 32 Ca 1.11 0.03 0.05 0.00 -0.37 0.00 0.00 57.07 57.89 1o5p s TYR 32 Cb -0.93 -1.57 -0.03 0.00 -0.40 0.00 0.00 41.96 39.02 1o5p s TYR 32 CO 0.51 0.52 0.27 -0.51 -1.57 0.00 0.00 175.55 174.77 1o5p s ASP 33 N -3.08 6.02 -0.11 2.29 1.11 0.75 -1.61 116.67 122.05 1o5p s ASP 33 Ca 0.32 -0.01 -0.03 0.00 0.18 0.00 0.00 52.55 53.01 1o5p s ASP 33 Cb -0.11 -1.71 0.04 0.00 1.07 0.00 0.00 42.92 42.22 1o5p s ASP 33 CO 0.25 -0.01 0.07 0.54 1.18 0.00 0.00 175.17 177.19 1o5p s VAL 34 N -1.93 -0.01 0.28 -1.27 0.11 -0.92 -1.07 120.40 115.58 1o5p s VAL 34 Ca 0.33 0.09 -0.14 0.00 -2.93 0.00 0.00 61.98 59.33 1o5p s VAL 34 Cb -0.09 -0.42 0.05 0.00 -1.53 0.00 0.00 36.38 34.39 1o5p s VAL 34 CO 0.27 -0.03 0.73 0.61 -3.33 0.00 0.00 175.10 173.35 1o5p n GLY 35 N 5.26 1.00 3.39 6.54 0.00 -0.90 -0.25 105.19 120.23 1o5p n GLY 35 Ca -0.05 -1.19 -0.41 0.00 0.00 0.00 0.00 46.02 44.37 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 -2.06 2.85 0.06 1.61 -2.07 -1.26 -2.53 119.66 116.26 1o5p s GLN 36 Ca 0.15 -1.09 0.05 0.00 -1.82 0.00 0.00 55.36 52.65 1o5p s GLN 36 Cb -0.04 -3.81 -0.03 0.00 -1.09 0.00 0.00 33.01 28.05 1o5p s GLN 36 CO 0.08 -0.73 -0.13 0.00 -1.32 0.00 0.00 175.29 173.19 1o5p s ALA 38 N -1.20 1.80 -0.35 0.00 0.00 -0.76 -1.80 121.76 119.45 1o5p s ALA 38 Ca -0.02 -0.91 -0.17 0.00 0.00 0.00 0.00 51.96 50.86 1o5p s ALA 38 Cb -0.10 -0.49 -0.00 0.00 0.00 0.00 0.00 23.12 22.53 1o5p s ALA 38 CO 0.02 0.41 0.45 -1.58 0.00 0.00 0.00 175.76 175.06 1o5p s TRP 39 N -0.39 3.19 -0.91 0.00 0.51 -1.26 -1.74 118.94 118.35 1o5p s TRP 39 Ca 0.05 0.05 0.16 0.00 -2.12 0.00 0.00 56.10 54.24 1o5p s TRP 39 Cb -0.09 -2.83 0.59 0.00 -0.81 0.00 0.00 33.47 30.33 1o5p s TRP 39 CO 0.00 -0.52 1.51 1.33 -0.51 0.00 0.00 176.95 178.76 1o5p n VAL 40 N 5.36 1.74 -1.57 4.03 0.24 -0.89 -4.74 118.33 122.51 1o5p n VAL 40 Ca -0.07 -1.29 0.00 0.00 -2.04 0.00 0.00 64.34 60.94 1o5p n VAL 40 Cb 0.49 0.14 0.00 0.00 -1.47 0.00 0.00 33.84 33.00 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 0.68 0.00 -4.55 -1.34 8.00 -1.26 -4.95 116.55 113.12 1o5p n ASP 41 Ca 0.22 0.00 -0.37 0.00 0.71 0.00 0.00 54.79 55.35 1o5p n ASP 41 Cb 0.79 0.00 -0.03 0.00 -0.02 0.00 0.00 41.12 41.85 1o5p n ASP 41 CO 0.00 0.00 0.00 0.42 -0.39 0.00 0.00 177.20 177.23 1o5p s THR 42 N -2.48 3.46 0.00 -3.53 -4.23 -1.26 -2.88 115.64 104.72 1o5p s THR 42 Ca 0.00 0.08 0.00 0.00 -1.18 0.00 0.00 61.69 60.59 1o5p s THR 42 Cb 0.00 -4.17 0.00 0.00 1.34 0.00 0.00 72.50 69.67 1o5p s THR 42 CO 0.00 -1.13 0.00 0.61 -0.54 0.00 0.00 174.62 173.56 1o5p n GLY 43 N 5.92 0.72 3.13 3.99 0.00 -1.26 -5.05 105.19 112.64 1o5p n GLY 43 Ca 0.22 -0.70 -0.34 0.00 0.00 0.00 0.00 46.02 45.19 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 2.83 -0.33 1.61 1.01 -1.14 -4.98 120.40 117.40 1o5p s VAL 44 Ca 0.00 -1.69 0.01 0.00 0.00 0.00 0.00 61.98 60.30 1o5p s VAL 44 Cb 0.00 -2.75 0.08 0.00 0.00 0.00 0.00 36.38 33.71 1o5p s VAL 44 CO 0.00 -0.28 0.04 -0.22 0.00 0.00 0.00 175.10 174.64 1o5p s LEU 45 N 1.16 4.39 -0.43 3.92 2.96 -1.26 -2.10 118.68 127.32 1o5p s LEU 45 Ca -0.01 -1.75 -0.17 0.00 -0.22 0.00 0.00 54.13 51.99 1o5p s LEU 45 Cb -0.20 -1.68 0.03 0.00 0.50 0.00 0.00 46.19 44.83 1o5p s LEU 45 CO -0.03 -0.35 0.41 0.00 -1.32 0.00 0.00 176.35 175.06 1o5p s ALA 46 N 1.09 3.45 0.38 5.97 0.00 -0.71 -3.39 121.76 128.54 1o5p s ALA 46 Ca 0.02 -1.62 0.08 0.00 0.00 0.00 0.00 51.96 50.44 1o5p s ALA 46 Cb -0.20 -3.03 -0.02 0.00 0.00 0.00 0.00 23.12 19.86 1o5p s ALA 46 CO -0.05 -1.59 0.36 0.00 0.00 0.00 0.00 175.76 174.48 1o5p s ASN 48 N -4.09 4.34 0.00 0.00 2.47 -0.78 -1.12 114.94 115.76 1o5p s ASN 48 Ca 0.46 -0.25 0.00 0.00 0.42 0.00 0.00 52.86 53.48 1o5p s ASN 48 Cb -0.05 -1.69 0.00 0.00 -1.45 0.00 0.00 41.25 38.06 1o5p s ASN 48 CO 0.28 0.16 0.42 -0.81 -3.72 0.00 0.00 177.10 173.42 1o5p n PRO 49 N 3.61 0.64 0.00 0.43 -0.05 -1.26 -2.96 135.00 135.40 1o5p n PRO 49 Ca -0.18 0.00 0.06 0.00 -0.05 0.00 0.00 63.50 63.33 1o5p n PRO 49 Cb 0.52 -1.28 0.04 0.00 -0.05 0.00 0.00 33.50 32.74 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 0.33 2.54 -1.51 0.55 0.00 -1.26 -4.42 120.51 116.74 1o5p n ALA 50 Ca 0.00 -0.57 0.01 0.00 0.00 0.00 0.00 53.44 52.88 1o5p n ALA 50 Cb 0.21 -0.38 0.02 0.00 0.00 0.00 0.00 19.45 19.29 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 0.51 0.41 -4.56 0.00 5.68 -1.15 -2.46 116.55 114.97 1o5p n ASP 51 Ca 0.06 -1.87 -0.41 0.00 -0.50 0.00 0.00 54.79 52.07 1o5p n ASP 51 Cb 0.27 -0.16 -0.03 0.00 -1.14 0.00 0.00 41.12 40.06 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 -0.41 2.51 0.00 2.11 0.08 -1.25 -3.26 117.98 117.76 1o5p s PHE 52 Ca 0.04 -0.81 0.00 0.00 0.12 0.00 0.00 56.93 56.28 1o5p s PHE 52 Cb 0.03 -4.68 0.00 0.00 -0.57 0.00 0.00 43.02 37.80 1o5p s PHE 52 CO 0.00 -1.93 0.00 0.43 -0.10 0.00 0.00 175.22 173.62 1o5p n SER 53 N 9.01 0.73 0.00 1.36 7.64 0.65 -4.92 113.62 128.09 1o5p n SER 53 Ca 0.33 -0.63 0.00 0.00 1.01 0.00 0.00 58.87 59.59 1o5p n SER 53 Cb 0.51 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.71 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 -1.42 0.00 -3.61 6.43 2.88 -1.26 -2.16 113.62 114.47 1o5p n SER 54 Ca 0.00 0.00 -0.12 0.00 -1.33 0.00 0.00 58.87 57.42 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 -0.64 0.05 -0.05 2.46 0.11 -0.63 -4.96 120.40 116.73 1o5p s VAL 55 Ca 0.00 -0.40 -0.07 0.00 -2.93 0.00 0.00 61.98 58.58 1o5p s VAL 55 Cb 0.00 -1.02 -0.04 0.00 -1.53 0.00 0.00 36.38 33.78 1o5p s VAL 55 CO 0.00 -0.22 0.21 -0.89 -3.33 0.00 0.00 175.10 170.88 1o5p s THR 56 N -2.94 5.38 -0.35 5.04 2.01 -1.26 0.31 115.64 123.83 1o5p s THR 56 Ca -0.02 0.23 -0.27 0.00 0.31 0.00 0.00 61.69 61.93 1o5p s THR 56 Cb 0.00 -3.50 -0.05 0.00 0.01 0.00 0.00 72.50 68.96 1o5p s THR 56 CO -0.06 0.50 2.19 0.00 -0.69 0.00 0.00 174.62 176.57 1o5p s ALA 57 N -1.15 2.36 0.00 7.40 0.00 -1.10 -4.72 121.76 124.55 1o5p s ALA 57 Ca 0.21 0.35 0.00 0.00 0.00 0.00 0.00 51.96 52.52 1o5p s ALA 57 Cb -0.13 -4.17 0.00 0.00 0.00 0.00 0.00 23.12 18.82 1o5p s ALA 57 CO 0.10 -3.38 0.00 -0.40 0.00 0.00 0.00 175.76 172.08 1o5p n ASP 58 N 12.91 0.00 -0.11 0.00 5.75 -1.26 0.31 116.55 134.14 1o5p n ASP 58 Ca 0.30 0.00 -0.05 0.00 -0.01 0.00 0.00 54.79 55.03 1o5p n ASP 58 Cb 0.49 0.00 0.01 0.00 -1.03 0.00 0.00 41.12 40.59 1o5p n ASP 58 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 1o5p h ALA 59 N -2.04 0.23 0.00 2.12 0.00 -1.92 -3.14 119.26 114.52 1o5p h ALA 59 Ca 0.00 0.15 -0.30 0.00 0.00 0.00 0.00 54.91 54.76 1o5p h ALA 59 Cb 0.00 0.33 -0.06 0.00 0.00 0.00 0.00 17.79 18.06 1o5p h ALA 59 CO 0.00 -0.47 -2.14 -1.71 0.00 0.00 0.00 179.25 174.93 1o5p n ASN 60 N -5.32 1.65 0.00 0.00 2.85 -1.26 -4.55 115.26 108.63 1o5p n ASN 60 Ca 0.02 -0.05 0.00 0.00 -0.11 0.00 0.00 54.58 54.44 1o5p n ASN 60 Cb 0.23 0.34 0.00 0.00 1.24 0.00 0.00 39.78 41.59 1o5p n ASN 60 CO 0.00 0.00 0.00 0.61 -2.11 0.00 0.00 177.26 175.76 1o5p n GLY 61 N 2.24 0.68 3.55 8.20 0.00 -1.19 -2.27 105.19 116.40 1o5p n GLY 61 Ca -0.31 -0.78 -0.36 0.00 0.00 0.00 0.00 46.02 44.57 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 -1.06 5.52 -0.20 1.61 0.01 -1.21 -2.14 113.70 116.23 1o5p s SER 62 Ca 0.00 -0.05 -0.03 0.00 1.31 0.00 0.00 55.95 57.19 1o5p s SER 62 Cb 0.00 -1.98 0.06 0.00 0.21 0.00 0.00 66.02 64.31 1o5p s SER 62 CO 0.00 0.05 0.03 0.00 0.41 0.00 0.00 173.24 173.73 1o5p s ALA 63 N 1.14 1.08 -0.23 1.44 0.00 0.21 -4.60 121.76 120.79 1o5p s ALA 63 Ca 0.05 -0.78 -0.01 0.00 0.00 0.00 0.00 51.96 51.22 1o5p s ALA 63 Cb -0.14 -1.22 0.02 0.00 0.00 0.00 0.00 23.12 21.78 1o5p s ALA 63 CO 0.04 -1.20 -0.10 -1.12 0.00 0.00 0.00 175.76 173.37 1o5p s SER 64 N 1.82 4.00 -0.01 0.00 0.01 -1.26 0.73 113.70 118.99 1o5p s SER 64 Ca -0.01 -0.79 -0.01 0.00 1.31 0.00 0.00 55.95 56.45 1o5p s SER 64 Cb -0.17 -1.61 0.00 0.00 0.21 0.00 0.00 66.02 64.45 1o5p s SER 64 CO -0.09 -0.08 0.03 0.28 0.41 0.00 0.00 173.24 173.79 1o5p s THR 65 N 1.32 0.00 -0.12 1.44 -1.32 -0.95 -4.98 115.64 111.02 1o5p s THR 65 Ca 0.01 -0.02 -0.09 0.00 -1.21 0.00 0.00 61.69 60.39 1o5p s THR 65 Cb -0.16 -0.06 -0.04 0.00 -1.51 0.00 0.00 72.50 70.73 1o5p s THR 65 CO -0.07 -0.01 0.18 -0.94 -2.21 0.00 0.00 174.62 171.58 1o5p s SER 66 N -0.01 6.42 0.05 8.08 1.04 -1.26 -2.01 113.70 126.00 1o5p s SER 66 Ca -0.00 0.50 -0.01 0.00 0.48 0.00 0.00 55.95 56.91 1o5p s SER 66 Cb -0.00 -2.10 -0.04 0.00 0.10 0.00 0.00 66.02 63.98 1o5p s SER 66 CO 0.00 0.34 -0.02 -1.48 0.98 0.00 0.00 173.24 173.06 1o5p s LEU 67 N -0.70 2.40 0.03 2.42 0.05 -0.27 -4.94 118.68 117.67 1o5p s LEU 67 Ca 0.15 -0.93 -0.22 0.00 0.05 0.00 0.00 54.13 53.18 1o5p s LEU 67 Cb -0.12 0.24 -0.06 0.00 -2.05 0.00 0.00 46.19 44.20 1o5p s LEU 67 CO 0.04 -0.58 0.65 0.28 -0.55 0.00 0.00 176.35 176.19 1o5p s THR 68 N -3.67 4.81 -0.07 5.48 -1.32 -1.03 -0.04 115.64 119.80 1o5p s THR 68 Ca 0.05 1.37 -0.07 0.00 -1.21 0.00 0.00 61.69 61.83 1o5p s THR 68 Cb 0.06 -3.99 0.02 0.00 -1.51 0.00 0.00 72.50 67.08 1o5p s THR 68 CO -0.09 0.43 0.20 0.68 -2.21 0.00 0.00 174.62 173.62 1o5p s VAL 69 N -0.32 0.00 0.00 5.08 -7.23 -0.89 -3.80 120.40 113.24 1o5p s VAL 69 Ca 0.33 -0.02 0.00 0.00 -1.81 0.00 0.00 61.98 60.48 1o5p s VAL 69 Cb -0.19 -0.29 0.00 0.00 0.56 0.00 0.00 36.38 36.46 1o5p s VAL 69 CO 0.19 -0.01 0.00 -2.11 -0.31 0.00 0.00 175.10 172.86 1o5p n ARG 70 N 2.92 0.00 0.00 4.82 1.85 -1.26 -4.16 116.66 120.82 1o5p n ARG 70 Ca -0.13 0.00 0.00 0.00 -1.00 0.00 0.00 57.85 56.72 1o5p n ARG 70 Cb 0.59 0.00 0.00 0.00 -1.05 0.00 0.00 32.46 32.00 1o5p n ARG 70 CO 0.00 0.00 0.00 0.54 -0.01 0.00 0.00 177.63 178.16 1o5p n ARG 71 N 0.00 0.00 -2.10 2.89 3.00 -1.26 -4.76 116.66 114.43 1o5p n ARG 71 Ca 0.00 0.00 -0.41 0.00 -0.01 0.00 0.00 57.85 57.43 1o5p n ARG 71 Cb 0.00 -0.44 -0.03 0.00 0.00 0.00 0.00 32.46 31.99 1o5p n ARG 71 CO 0.00 0.00 0.00 -1.12 0.00 0.00 0.00 177.63 176.51 1o5p s SER 72 N -1.06 6.75 0.08 0.55 0.01 -1.26 -1.16 113.70 117.62 1o5p s SER 72 Ca 0.00 2.55 -0.23 0.00 1.31 0.00 0.00 55.95 59.59 1o5p s SER 72 Cb 0.00 -2.62 0.06 0.00 0.21 0.00 0.00 66.02 63.67 1o5p s SER 72 CO 0.00 -0.63 0.55 0.72 0.41 0.00 0.00 173.24 174.29 1o5p s PHE 73 N 0.07 -0.46 -0.21 2.43 -0.12 -0.80 -4.86 117.98 114.03 1o5p s PHE 73 Ca 0.58 0.43 -0.39 0.00 -0.05 0.00 0.00 56.93 57.51 1o5p s PHE 73 Cb -0.40 0.41 -0.15 0.00 -0.63 0.00 0.00 43.02 42.25 1o5p s PHE 73 CO 0.41 -0.72 1.70 0.39 -0.05 0.00 0.00 175.22 176.95 1o5p n GLU 74 N 0.13 1.25 -1.35 1.99 -0.58 -1.26 0.28 120.64 121.09 1o5p n GLU 74 Ca -0.18 0.46 -0.24 0.00 -0.42 0.00 0.00 57.16 56.79 1o5p n GLU 74 Cb 0.62 -2.15 -0.06 0.00 -0.57 0.00 0.00 31.44 29.28 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 3.97 4.13 3.48 0.62 0.00 -0.30 -3.21 105.19 113.88 1o5p n GLY 75 Ca 0.25 -1.70 -0.63 0.00 0.00 0.00 0.00 46.02 43.94 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 1.03 1.45 -3.05 1.61 3.72 -0.27 -2.19 117.46 119.76 1o5p n PHE 76 Ca 0.46 0.92 -0.40 0.00 -0.05 0.00 0.00 57.45 58.38 1o5p n PHE 76 Cb 0.60 -2.27 -0.05 0.00 -0.94 0.00 0.00 39.48 36.82 1o5p n PHE 76 CO 0.00 0.00 0.00 -1.17 -0.05 0.00 0.00 176.76 175.54 1o5p s LEU 77 N 4.66 4.24 -0.27 4.37 2.96 -0.73 -1.84 118.68 132.07 1o5p s LEU 77 Ca 1.13 1.06 -0.02 0.00 -0.22 0.00 0.00 54.13 56.08 1o5p s LEU 77 Cb -1.48 -3.03 -0.03 0.00 0.50 0.00 0.00 46.19 42.16 1o5p s LEU 77 CO 0.73 -0.21 1.35 0.33 -1.32 0.00 0.00 176.35 177.23 1o5p n PHE 78 N 4.40 0.40 -1.95 5.38 7.35 -1.22 -2.88 117.46 128.94 1o5p n PHE 78 Ca -0.01 -0.89 0.00 0.00 -0.76 0.00 0.00 57.45 55.79 1o5p n PHE 78 Cb 0.50 -0.92 0.00 0.00 0.35 0.00 0.00 39.48 39.41 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 4.37 0.00 0.00 -2.13 2.03 -1.26 -4.98 116.55 114.58 1o5p n ASP 79 Ca 0.15 -0.96 0.00 0.00 0.52 0.00 0.00 54.79 54.50 1o5p n ASP 79 Cb 0.07 0.00 0.00 0.00 -0.72 0.00 0.00 41.12 40.47 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 2.80 3.93 0.27 0.00 -1.14 -4.99 105.19 106.05 1o5p n GLY 80 Ca 0.00 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.76 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 -1.03 5.03 -0.14 2.61 -4.23 -1.26 -4.96 115.64 111.66 1o5p s THR 81 Ca 0.00 -0.19 -0.04 0.00 -1.18 0.00 0.00 61.69 60.28 1o5p s THR 81 Cb 0.00 -3.85 -0.03 0.00 1.34 0.00 0.00 72.50 69.96 1o5p s THR 81 CO 0.00 -0.62 0.01 0.00 -0.54 0.00 0.00 174.62 173.47 1o5p s ARG 82 N -4.35 3.53 0.31 3.99 1.70 -1.26 -1.77 118.95 121.10 1o5p s ARG 82 Ca 0.43 -0.42 0.24 0.00 -0.47 0.00 0.00 55.73 55.50 1o5p s ARG 82 Cb -0.10 -2.97 0.40 0.00 -0.57 0.00 0.00 34.95 31.71 1o5p s ARG 82 CO 0.38 0.42 1.53 2.35 -1.08 0.00 0.00 175.30 178.89 1o5p h TRP 83 N 6.15 0.00 0.00 5.89 7.01 -1.77 -3.46 115.95 129.78 1o5p h TRP 83 Ca -0.40 0.00 0.00 0.00 2.11 0.00 0.00 58.89 60.60 1o5p h TRP 83 Cb 1.18 0.00 0.00 0.00 -2.10 0.00 0.00 29.16 28.24 1o5p h TRP 83 CO 0.58 0.00 0.00 0.41 -2.79 0.00 0.00 178.44 176.64 1o5p n GLY 84 N 1.19 1.34 3.61 2.65 0.00 -1.26 -4.90 105.19 107.82 1o5p n GLY 84 Ca 0.04 -2.15 -0.43 0.00 0.00 0.00 0.00 46.02 43.48 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 -1.52 3.13 -0.65 2.61 -4.23 -1.26 -1.15 115.64 112.57 1o5p s THR 85 Ca 0.00 0.14 -0.25 0.00 -1.18 0.00 0.00 61.69 60.39 1o5p s THR 85 Cb 0.00 -3.16 0.04 0.00 1.34 0.00 0.00 72.50 70.73 1o5p s THR 85 CO 0.00 -0.08 1.11 -0.69 -0.54 0.00 0.00 174.62 174.42 1o5p s VAL 86 N 7.25 4.07 -0.32 2.29 1.01 0.14 -4.70 120.40 130.14 1o5p s VAL 86 Ca 0.93 0.28 -0.28 0.00 0.00 0.00 0.00 61.98 62.91 1o5p s VAL 86 Cb -0.32 -4.74 -0.03 0.00 0.00 0.00 0.00 36.38 31.28 1o5p s VAL 86 CO 0.35 -1.50 2.01 -1.81 0.00 0.00 0.00 175.10 174.16 1o5p s ASP 87 N 3.39 5.57 0.00 3.32 1.11 -1.26 -1.90 116.67 126.89 1o5p s ASP 87 Ca 0.32 1.45 0.04 0.00 0.18 0.00 0.00 52.55 54.54 1o5p s ASP 87 Cb -0.11 -2.52 0.20 0.00 1.07 0.00 0.00 42.92 41.56 1o5p s ASP 87 CO 0.17 -1.94 0.88 0.00 1.18 0.00 0.00 175.17 175.46 1o5p n THR 89 N -1.21 0.44 0.00 0.00 -2.24 -1.26 -4.11 114.28 105.90 1o5p n THR 89 Ca 0.02 -0.42 0.00 0.00 -2.27 0.00 0.00 64.05 61.38 1o5p n THR 89 Cb 0.03 0.18 0.00 0.00 -2.10 0.00 0.00 70.33 68.44 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 0.40 0.00 -3.64 4.28 -2.24 -0.33 -5.09 114.28 107.66 1o5p n THR 90 Ca 0.10 0.00 -0.25 0.00 -2.27 0.00 0.00 64.05 61.64 1o5p n THR 90 Cb 0.27 -1.08 0.02 0.00 -2.10 0.00 0.00 70.33 67.45 1o5p n THR 90 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1o5p s ALA 91 N -1.95 4.57 -0.36 6.98 0.00 -1.22 -5.09 121.76 124.70 1o5p s ALA 91 Ca 0.00 -1.48 -0.12 0.00 0.00 0.00 0.00 51.96 50.36 1o5p s ALA 91 Cb 0.00 -0.94 0.01 0.00 0.00 0.00 0.00 23.12 22.19 1o5p s ALA 91 CO 0.00 -0.61 0.22 0.00 0.00 0.00 0.00 175.76 175.36 1o5p s ALA 92 N -2.77 3.35 -0.25 0.00 0.00 -1.26 -4.76 121.76 116.06 1o5p s ALA 92 Ca 0.42 -1.58 -0.14 0.00 0.00 0.00 0.00 51.96 50.66 1o5p s ALA 92 Cb -0.03 -2.60 -0.04 0.00 0.00 0.00 0.00 23.12 20.44 1o5p s ALA 92 CO 0.26 -1.21 0.32 0.00 0.00 0.00 0.00 175.76 175.14 1o5p s GLN 94 N 1.72 3.11 -0.37 0.00 -0.21 -0.74 -2.54 119.66 120.63 1o5p s GLN 94 Ca 0.14 -0.57 -0.10 0.00 0.02 0.00 0.00 55.36 54.85 1o5p s GLN 94 Cb -0.15 -2.86 0.03 0.00 1.00 0.00 0.00 33.01 31.03 1o5p s GLN 94 CO 0.09 0.60 0.19 0.08 -2.12 0.00 0.00 175.29 174.12 1o5p s VAL 95 N -1.40 4.42 0.05 1.09 1.01 0.14 -2.19 120.40 123.53 1o5p s VAL 95 Ca 0.30 -0.93 -0.00 0.00 0.00 0.00 0.00 61.98 61.35 1o5p s VAL 95 Cb -0.12 -3.49 0.00 0.00 0.00 0.00 0.00 36.38 32.77 1o5p s VAL 95 CO 0.23 -0.24 0.07 0.61 0.00 0.00 0.00 175.10 175.77 1o5p n GLY 96 N 4.96 2.98 3.47 4.51 0.00 -1.05 0.31 105.19 120.38 1o5p n GLY 96 Ca -0.12 -1.40 -0.28 0.00 0.00 0.00 0.00 46.02 44.22 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 -3.58 0.99 4.32 -1.23 -2.13 117.00 115.37 1o5p n LEU 97 Ca 0.00 -2.84 0.03 0.00 -0.02 0.00 0.00 56.01 53.18 1o5p n LEU 97 Cb 0.08 0.16 -0.00 0.00 -1.62 0.00 0.00 43.42 42.03 1o5p n LEU 97 CO 0.04 -0.49 1.18 -0.94 -1.22 0.00 0.00 177.39 175.96 1o5p s SER 98 N -3.80 -0.02 0.00 -1.43 1.04 -0.24 -4.37 113.70 104.88 1o5p s SER 98 Ca 0.14 -0.04 0.00 0.00 0.48 0.00 0.00 55.95 56.53 1o5p s SER 98 Cb -0.01 0.05 0.00 0.00 0.10 0.00 0.00 66.02 66.16 1o5p s SER 98 CO 0.09 -0.09 0.00 -0.90 0.98 0.00 0.00 173.24 173.32 1o5p n ASP 99 N -0.46 1.65 -1.62 7.02 5.75 -1.24 0.27 116.55 127.91 1o5p n ASP 99 Ca -0.09 0.00 -0.16 0.00 -0.01 0.00 0.00 54.79 54.54 1o5p n ASP 99 Cb 0.63 0.00 0.10 0.00 -1.03 0.00 0.00 41.12 40.82 1o5p n ASP 99 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 1o5p n ALA 100 N -3.00 4.79 -0.03 2.12 0.00 -1.26 -4.60 120.51 118.53 1o5p n ALA 100 Ca 0.00 -3.53 -0.03 0.00 0.00 0.00 0.00 53.44 49.88 1o5p n ALA 100 Cb 0.00 -0.59 -0.03 0.00 0.00 0.00 0.00 19.45 18.83 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 -0.90 1.88 0.00 0.00 0.00 -1.26 -5.02 120.51 115.21 1o5p n ALA 101 Ca 0.39 -0.29 0.00 0.00 0.00 0.00 0.00 53.44 53.54 1o5p n ALA 101 Cb 0.90 0.23 0.00 0.00 0.00 0.00 0.00 19.45 20.58 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 2.89 1.14 3.08 0.00 0.00 -1.26 -5.14 105.19 105.90 1o5p n GLY 102 Ca -0.09 -0.08 -0.07 0.00 0.00 0.00 0.00 46.02 45.78 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 0.00 -1.86 -0.30 1.61 5.03 -1.26 -4.99 115.26 113.48 1o5p n ASN 103 Ca 0.00 -2.28 0.00 0.00 0.87 0.00 0.00 54.58 53.17 1o5p n ASN 103 Cb 0.00 3.10 0.00 0.00 -1.02 0.00 0.00 39.78 41.86 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 -0.44 1.82 3.07 7.41 0.00 -1.26 -3.67 105.19 112.12 1o5p n GLY 104 Ca -0.07 -0.76 -0.28 0.00 0.00 0.00 0.00 46.02 44.91 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 -0.99 -1.99 1.61 -0.02 -1.26 -4.89 135.00 127.46 1o5p n PRO 105 Ca 0.00 -0.29 -0.18 0.00 -2.02 0.00 0.00 63.50 61.01 1o5p n PRO 105 Cb 0.00 -1.32 0.10 0.00 -0.02 0.00 0.00 33.50 32.26 1o5p n PRO 105 CO 0.00 0.00 0.00 -0.85 1.98 0.00 0.00 175.50 176.63 1o5p n GLU 106 N 0.09 -0.13 -4.59 -0.52 0.28 -1.26 -4.51 120.64 110.00 1o5p n GLU 106 Ca 0.01 -1.99 -0.27 0.00 -0.16 0.00 0.00 57.16 54.75 1o5p n GLU 106 Cb 0.55 -0.60 -0.11 0.00 1.43 0.00 0.00 31.44 32.71 1o5p n GLU 106 CO 0.00 0.00 0.00 0.20 -0.16 0.00 0.00 177.13 177.17 1o5p s GLY 107 N -4.60 2.38 -0.14 -1.84 0.00 -1.26 -3.56 107.32 98.29 1o5p s GLY 107 Ca 0.52 -2.22 -0.04 0.00 0.00 0.00 0.00 44.72 42.98 1o5p s GLY 107 CO 0.35 -2.07 -0.01 0.14 0.00 0.00 0.00 173.10 171.51 1o5p s VAL 108 N -2.67 4.17 -0.05 1.40 1.01 0.15 -4.76 120.40 119.65 1o5p s VAL 108 Ca 0.34 -0.27 -0.30 0.00 0.00 0.00 0.00 61.98 61.75 1o5p s VAL 108 Cb 0.07 -2.82 -0.04 0.00 0.00 0.00 0.00 36.38 33.59 1o5p s VAL 108 CO 0.17 0.52 1.29 0.00 0.00 0.00 0.00 175.10 177.08 1o5p s ALA 109 N 0.04 3.55 0.49 5.51 0.00 -1.26 0.26 121.76 130.35 1o5p s ALA 109 Ca 0.02 0.70 0.06 0.00 0.00 0.00 0.00 51.96 52.74 1o5p s ALA 109 Cb -0.13 -3.56 0.03 0.00 0.00 0.00 0.00 23.12 19.46 1o5p s ALA 109 CO 0.02 -0.88 0.68 0.96 0.00 0.00 0.00 175.76 176.54 1o5p s ILE 110 N 2.49 2.74 0.05 0.00 -4.36 -1.05 -4.84 121.20 116.22 1o5p s ILE 110 Ca 0.59 -0.90 0.00 0.00 -0.26 0.00 0.00 60.65 60.09 1o5p s ILE 110 Cb -0.27 -2.84 -0.03 0.00 1.25 0.00 0.00 42.46 40.57 1o5p s ILE 110 CO 0.23 0.00 -0.05 -0.55 0.24 0.00 0.00 174.94 174.81 1o5p s SER 111 N -4.44 0.66 -0.36 4.36 0.15 0.20 -4.76 113.70 109.51 1o5p s SER 111 Ca 0.57 -0.81 0.00 0.00 0.70 0.00 0.00 55.95 56.41 1o5p s SER 111 Cb -0.09 0.12 0.12 0.00 -1.71 0.00 0.00 66.02 64.46 1o5p s SER 111 CO 0.36 -0.43 0.16 -0.36 1.20 0.00 0.00 173.24 174.18 1o5p s PHE 112 N -2.84 1.51 -1.64 3.44 0.08 -1.26 -2.87 117.98 114.40 1o5p s PHE 112 Ca -0.00 -1.87 0.00 0.00 0.12 0.00 0.00 56.93 55.18 1o5p s PHE 112 Cb 0.00 -1.57 0.00 0.00 -0.57 0.00 0.00 43.02 40.88 1o5p s PHE 112 CO -0.05 -0.84 0.41 0.27 -0.10 0.00 0.00 175.22 174.92