#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 3.25 0.81 0.00 0.00 -1.26 -5.04 121.76 119.52 1o5p s ALA 2 Ca 0.00 -1.38 -0.13 0.00 0.00 0.00 0.00 51.96 50.45 1o5p s ALA 2 Cb 0.00 -1.02 0.09 0.00 0.00 0.00 0.00 23.12 22.18 1o5p s ALA 2 CO 0.00 0.45 1.20 -2.14 0.00 0.00 0.00 175.76 175.27 1o5p s PRO 3 N -3.08 1.62 0.10 0.00 0.02 0.05 -4.63 135.00 129.09 1o5p s PRO 3 Ca 0.28 1.72 -0.10 0.00 0.02 0.00 0.00 61.00 62.93 1o5p s PRO 3 Cb -0.09 -1.78 0.00 0.00 0.02 0.00 0.00 34.50 32.66 1o5p s PRO 3 CO 0.19 -2.22 0.23 0.95 -0.33 0.00 0.00 177.00 175.83 1o5p s THR 4 N -2.21 0.12 -0.10 0.99 -4.23 1.10 -4.90 115.64 106.42 1o5p s THR 4 Ca 0.72 -1.11 -0.04 0.00 -1.18 0.00 0.00 61.69 60.08 1o5p s THR 4 Cb -0.28 -1.36 0.05 0.00 1.34 0.00 0.00 72.50 72.25 1o5p s THR 4 CO 0.51 -0.57 0.22 0.00 -0.54 0.00 0.00 174.62 174.24 1o5p s ALA 5 N -3.86 -0.46 -0.43 3.99 0.00 -1.26 0.25 121.76 120.00 1o5p s ALA 5 Ca 0.06 0.88 -0.10 0.00 0.00 0.00 0.00 51.96 52.79 1o5p s ALA 5 Cb 0.04 -0.69 0.08 0.00 0.00 0.00 0.00 23.12 22.55 1o5p s ALA 5 CO -0.10 -0.31 0.28 0.95 0.00 0.00 0.00 175.76 176.58 1o5p s THR 6 N 1.57 4.40 -0.21 0.00 -4.23 -0.18 -4.78 115.64 112.21 1o5p s THR 6 Ca -0.06 -1.33 0.00 0.00 -1.18 0.00 0.00 61.69 59.12 1o5p s THR 6 Cb -0.11 -3.67 0.02 0.00 1.34 0.00 0.00 72.50 70.08 1o5p s THR 6 CO -0.08 -0.51 -0.14 -0.69 -0.54 0.00 0.00 174.62 172.66 1o5p s VAL 7 N 1.46 2.39 -0.10 2.29 1.01 -1.24 0.13 120.40 126.34 1o5p s VAL 7 Ca 0.03 -0.99 -0.30 0.00 0.00 0.00 0.00 61.98 60.72 1o5p s VAL 7 Cb -0.23 -2.11 0.08 0.00 0.00 0.00 0.00 36.38 34.12 1o5p s VAL 7 CO 0.03 0.39 0.73 -0.89 0.00 0.00 0.00 175.10 175.36 1o5p s THR 8 N 1.30 0.00 0.45 3.92 2.01 -0.60 -4.32 115.64 118.40 1o5p s THR 8 Ca 0.02 0.00 -0.21 0.00 0.31 0.00 0.00 61.69 61.82 1o5p s THR 8 Cb -0.15 -1.00 -0.10 0.00 0.01 0.00 0.00 72.50 71.26 1o5p s THR 8 CO -0.09 0.00 0.98 -2.16 -0.69 0.00 0.00 174.62 172.66 1o5p s PRO 9 N -0.95 4.09 0.08 4.92 0.05 -1.26 -1.05 135.00 140.88 1o5p s PRO 9 Ca -0.08 1.20 0.19 0.00 0.05 0.00 0.00 61.00 62.37 1o5p s PRO 9 Cb -0.01 -2.16 -0.13 0.00 0.05 0.00 0.00 34.50 32.25 1o5p s PRO 9 CO 0.07 -0.16 0.79 -1.13 0.05 0.00 0.00 177.00 176.62 1o5p n SER 10 N -0.73 0.67 -4.24 6.66 3.41 -1.26 -4.78 113.62 113.35 1o5p n SER 10 Ca 0.08 0.28 -0.14 0.00 -0.26 0.00 0.00 58.87 58.83 1o5p n SER 10 Cb 0.53 0.58 -0.10 0.00 -0.26 0.00 0.00 64.21 64.96 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 -5.44 1.61 -0.22 4.04 0.01 -1.26 0.50 113.70 112.94 1o5p s SER 11 Ca -0.03 -1.05 -0.01 0.00 1.31 0.00 0.00 55.95 56.16 1o5p s SER 11 Cb 0.10 0.03 0.00 0.00 0.21 0.00 0.00 66.02 66.35 1o5p s SER 11 CO 0.82 -0.40 0.14 0.61 0.41 0.00 0.00 173.24 174.81 1o5p n GLY 12 N -0.20 0.62 0.13 3.44 0.00 -1.14 -4.90 105.19 103.15 1o5p n GLY 12 Ca -0.10 -0.59 -0.22 0.00 0.00 0.00 0.00 46.02 45.12 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 -1.01 2.36 -0.99 0.99 4.77 -1.26 -5.06 117.00 116.80 1o5p n LEU 13 Ca -0.01 0.27 0.00 0.00 -0.03 0.00 0.00 56.01 56.25 1o5p n LEU 13 Cb 0.51 -1.05 0.00 0.00 -2.33 0.00 0.00 43.42 40.55 1o5p n LEU 13 CO 0.09 0.65 -0.29 -0.24 -1.33 0.00 0.00 177.39 176.27 1o5p n SER 14 N -3.83 -5.55 -4.46 -1.43 2.88 -1.26 -3.87 113.62 96.10 1o5p n SER 14 Ca -0.33 0.93 -0.47 0.00 -1.33 0.00 0.00 58.87 57.66 1o5p n SER 14 Cb 0.92 -2.68 -0.08 0.00 -0.75 0.00 0.00 64.21 61.62 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 -1.42 1.89 0.00 -3.46 5.75 -1.26 -1.96 116.55 116.10 1o5p n ASP 15 Ca 0.00 0.25 0.00 0.00 -0.01 0.00 0.00 54.79 55.03 1o5p n ASP 15 Cb 0.11 -1.26 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 6.48 1.51 1.52 6.12 0.00 -1.26 -5.05 105.19 114.51 1o5p n GLY 16 Ca 0.44 0.00 -0.09 0.00 0.00 0.00 0.00 46.02 46.37 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 -0.67 0.00 -4.57 2.61 5.66 -0.83 -4.97 114.28 111.51 1o5p n THR 17 Ca 0.00 -0.82 -0.22 0.00 -3.05 0.00 0.00 64.05 59.97 1o5p n THR 17 Cb 0.00 -0.54 -0.15 0.00 -1.55 0.00 0.00 70.33 68.08 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 -0.77 1.00 0.20 1.08 1.01 -1.26 -2.10 120.40 119.57 1o5p s VAL 18 Ca 0.18 -0.53 0.10 0.00 0.00 0.00 0.00 61.98 61.73 1o5p s VAL 18 Cb -0.01 -0.85 -0.04 0.00 0.00 0.00 0.00 36.38 35.47 1o5p s VAL 18 CO 0.11 0.29 -0.12 0.68 0.00 0.00 0.00 175.10 176.06 1o5p s VAL 19 N -0.19 2.98 -0.36 2.92 -7.23 0.18 -4.74 120.40 113.96 1o5p s VAL 19 Ca 0.03 -1.84 -0.08 0.00 -1.81 0.00 0.00 61.98 58.28 1o5p s VAL 19 Cb -0.06 -2.49 0.04 0.00 0.56 0.00 0.00 36.38 34.43 1o5p s VAL 19 CO -0.00 -0.17 0.15 -0.75 -0.31 0.00 0.00 175.10 174.02 1o5p s LYS 20 N -2.97 2.67 -0.22 4.82 2.20 -0.22 -0.54 119.74 125.48 1o5p s LYS 20 Ca 0.25 -1.19 -0.08 0.00 -0.36 0.00 0.00 55.97 54.60 1o5p s LYS 20 Cb -0.08 -3.58 -0.04 0.00 -1.51 0.00 0.00 37.83 32.62 1o5p s LYS 20 CO 0.15 -0.71 0.08 0.54 -0.36 0.00 0.00 175.35 175.04 1o5p s VAL 21 N 1.45 4.64 0.34 4.02 0.11 -0.84 -1.55 120.40 128.58 1o5p s VAL 21 Ca 0.00 -0.07 0.09 0.00 -2.93 0.00 0.00 61.98 59.06 1o5p s VAL 21 Cb -0.20 -3.13 -0.05 0.00 -1.53 0.00 0.00 36.38 31.47 1o5p s VAL 21 CO 0.04 0.39 0.03 0.00 -3.33 0.00 0.00 175.10 172.23 1o5p s ALA 22 N 1.00 3.25 -0.21 1.54 0.00 0.35 -2.32 121.76 125.37 1o5p s ALA 22 Ca 0.04 -1.96 -0.04 0.00 0.00 0.00 0.00 51.96 50.00 1o5p s ALA 22 Cb -0.14 -0.40 0.09 0.00 0.00 0.00 0.00 23.12 22.67 1o5p s ALA 22 CO 0.03 0.05 0.18 0.20 0.00 0.00 0.00 175.76 176.22 1o5p s GLY 23 N -3.74 0.14 -0.03 0.00 0.00 0.24 -1.01 107.32 102.92 1o5p s GLY 23 Ca 0.35 -0.10 0.07 0.00 0.00 0.00 0.00 44.72 45.04 1o5p s GLY 23 CO 0.20 2.08 -0.22 0.00 0.00 0.00 0.00 173.10 175.15 1o5p s ALA 24 N 2.25 2.31 0.00 3.20 0.00 0.70 0.75 121.76 130.97 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 -0.68 0.00 0.00 0.00 0.00 0.00 23.12 22.28 1o5p s ALA 24 CO -0.16 0.53 0.00 0.41 0.00 0.00 0.00 175.76 176.54 1o5p n GLY 25 N 2.42 0.65 3.97 0.00 0.00 -0.81 0.35 105.19 111.77 1o5p n GLY 25 Ca -0.16 -0.75 -0.22 0.00 0.00 0.00 0.00 46.02 44.89 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 3.16 -0.85 0.99 1.43 -0.82 -0.77 118.68 121.82 1o5p s LEU 26 Ca 0.00 -0.07 -0.30 0.00 -1.03 0.00 0.00 54.13 52.73 1o5p s LEU 26 Cb 0.00 -2.66 -0.18 0.00 0.03 0.00 0.00 46.19 43.38 1o5p s LEU 26 CO 0.00 -1.36 2.61 0.00 0.23 0.00 0.00 176.35 177.83 1o5p n GLN 27 N -2.51 0.28 -1.27 1.70 3.00 -1.26 -4.08 117.38 113.24 1o5p n GLN 27 Ca 0.10 0.00 -0.18 0.00 -0.01 0.00 0.00 57.00 56.91 1o5p n GLN 27 Cb 0.60 -2.01 -0.10 0.00 0.00 0.00 0.00 30.24 28.73 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 11.80 0.34 0.00 -1.58 0.00 -1.24 -1.21 120.51 128.62 1o5p n ALA 28 Ca 0.58 -2.13 0.00 0.00 0.00 0.00 0.00 53.44 51.89 1o5p n ALA 28 Cb 0.16 -2.99 0.00 0.00 0.00 0.00 0.00 19.45 16.62 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 5.63 0.39 2.60 0.00 0.00 0.99 -4.82 105.19 109.98 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 -0.49 -0.03 -0.32 2.61 -4.23 -0.35 -4.87 115.64 107.96 1o5p s THR 30 Ca 0.00 -0.38 -0.34 0.00 -1.18 0.00 0.00 61.69 59.79 1o5p s THR 30 Cb 0.00 -0.73 -0.10 0.00 1.34 0.00 0.00 72.50 73.00 1o5p s THR 30 CO 0.00 -0.41 2.18 0.00 -0.54 0.00 0.00 174.62 175.85 1o5p n ALA 31 N 5.25 1.17 -2.79 3.99 0.00 -1.26 -2.72 120.51 124.15 1o5p n ALA 31 Ca -0.07 -0.07 -0.24 0.00 0.00 0.00 0.00 53.44 53.06 1o5p n ALA 31 Cb 0.47 -2.60 -0.05 0.00 0.00 0.00 0.00 19.45 17.27 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 7.33 3.08 0.34 0.00 2.02 0.14 -4.63 117.35 125.62 1o5p s TYR 32 Ca 1.08 -0.08 0.07 0.00 -0.37 0.00 0.00 57.07 57.76 1o5p s TYR 32 Cb -0.78 -1.43 -0.01 0.00 -0.40 0.00 0.00 41.96 39.34 1o5p s TYR 32 CO 0.47 0.53 0.45 0.34 -1.57 0.00 0.00 175.55 175.77 1o5p s ASP 33 N -3.44 5.91 -0.10 2.29 2.15 0.83 -1.27 116.67 123.04 1o5p s ASP 33 Ca 0.31 -0.22 -0.04 0.00 0.43 0.00 0.00 52.55 53.04 1o5p s ASP 33 Cb -0.09 -1.20 0.05 0.00 -0.30 0.00 0.00 42.92 41.38 1o5p s ASP 33 CO 0.23 -0.43 0.19 0.54 -0.17 0.00 0.00 175.17 175.54 1o5p s VAL 34 N -2.19 -0.28 0.08 1.11 0.11 -0.73 -1.63 120.40 116.87 1o5p s VAL 34 Ca 0.45 0.31 -0.21 0.00 -2.93 0.00 0.00 61.98 59.60 1o5p s VAL 34 Cb -0.09 -0.34 0.07 0.00 -1.53 0.00 0.00 36.38 34.49 1o5p s VAL 34 CO 0.31 0.13 0.99 0.61 -3.33 0.00 0.00 175.10 173.81 1o5p n GLY 35 N 5.19 0.50 3.43 6.54 0.00 -0.95 -1.08 105.19 118.82 1o5p n GLY 35 Ca -0.08 -1.07 -0.43 0.00 0.00 0.00 0.00 46.02 44.44 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 -2.03 2.94 0.07 1.61 -2.07 -1.26 -2.62 119.66 116.30 1o5p s GLN 36 Ca 0.23 -1.11 0.05 0.00 -1.82 0.00 0.00 55.36 52.71 1o5p s GLN 36 Cb -0.02 -3.98 -0.03 0.00 -1.09 0.00 0.00 33.01 27.90 1o5p s GLN 36 CO 0.02 -0.81 -0.15 0.00 -1.32 0.00 0.00 175.29 173.03 1o5p s ALA 38 N -1.19 1.69 -0.35 0.00 0.00 -0.80 -1.82 121.76 119.30 1o5p s ALA 38 Ca -0.00 -0.85 -0.17 0.00 0.00 0.00 0.00 51.96 50.93 1o5p s ALA 38 Cb -0.10 -0.46 -0.01 0.00 0.00 0.00 0.00 23.12 22.55 1o5p s ALA 38 CO 0.02 0.39 0.45 -1.58 0.00 0.00 0.00 175.76 175.04 1o5p s TRP 39 N -0.35 3.19 -0.75 0.00 0.51 -1.26 -1.82 118.94 118.46 1o5p s TRP 39 Ca 0.05 0.08 0.16 0.00 -2.12 0.00 0.00 56.10 54.27 1o5p s TRP 39 Cb -0.09 -2.81 0.58 0.00 -0.81 0.00 0.00 33.47 30.34 1o5p s TRP 39 CO 0.00 -0.49 1.49 1.33 -0.51 0.00 0.00 176.95 178.77 1o5p n VAL 40 N 5.34 1.84 -1.23 4.03 0.24 -0.90 -4.72 118.33 122.92 1o5p n VAL 40 Ca -0.07 -1.37 0.00 0.00 -2.04 0.00 0.00 64.34 60.87 1o5p n VAL 40 Cb 0.49 0.08 0.00 0.00 -1.47 0.00 0.00 33.84 32.94 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 0.48 0.00 -4.55 -1.34 8.00 -1.26 -4.95 116.55 112.92 1o5p n ASP 41 Ca 0.21 0.00 -0.37 0.00 0.71 0.00 0.00 54.79 55.34 1o5p n ASP 41 Cb 0.81 0.00 -0.03 0.00 -0.02 0.00 0.00 41.12 41.87 1o5p n ASP 41 CO 0.00 0.00 0.00 0.28 -0.39 0.00 0.00 177.20 177.09 1o5p s THR 42 N -2.37 3.42 0.00 -3.53 -1.32 -1.26 -2.82 115.64 107.75 1o5p s THR 42 Ca 0.00 0.13 0.00 0.00 -1.21 0.00 0.00 61.69 60.61 1o5p s THR 42 Cb 0.00 -4.08 0.00 0.00 -1.51 0.00 0.00 72.50 66.91 1o5p s THR 42 CO 0.00 -1.04 0.00 0.61 -2.21 0.00 0.00 174.62 171.98 1o5p n GLY 43 N 5.84 0.65 3.09 6.08 0.00 -1.26 -5.04 105.19 114.56 1o5p n GLY 43 Ca 0.21 -0.75 -0.33 0.00 0.00 0.00 0.00 46.02 45.15 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 2.59 -0.32 1.61 1.01 -1.13 -4.97 120.40 117.19 1o5p s VAL 44 Ca 0.00 -1.80 0.01 0.00 0.00 0.00 0.00 61.98 60.19 1o5p s VAL 44 Cb 0.00 -2.65 0.08 0.00 0.00 0.00 0.00 36.38 33.81 1o5p s VAL 44 CO 0.00 -0.29 0.03 -0.22 0.00 0.00 0.00 175.10 174.62 1o5p s LEU 45 N 1.10 4.33 -0.42 3.92 2.96 -1.26 -2.12 118.68 127.18 1o5p s LEU 45 Ca -0.01 -1.75 -0.16 0.00 -0.22 0.00 0.00 54.13 51.99 1o5p s LEU 45 Cb -0.20 -1.66 0.03 0.00 0.50 0.00 0.00 46.19 44.85 1o5p s LEU 45 CO -0.04 -0.34 0.40 0.00 -1.32 0.00 0.00 176.35 175.05 1o5p s ALA 46 N 1.07 3.45 0.36 5.97 0.00 -0.76 -3.41 121.76 128.44 1o5p s ALA 46 Ca 0.02 -1.63 0.08 0.00 0.00 0.00 0.00 51.96 50.42 1o5p s ALA 46 Cb -0.20 -3.01 -0.03 0.00 0.00 0.00 0.00 23.12 19.88 1o5p s ALA 46 CO -0.05 -1.57 0.31 0.00 0.00 0.00 0.00 175.76 174.44 1o5p s ASN 48 N -4.02 5.01 0.00 0.00 3.84 -0.83 -0.39 114.94 118.55 1o5p s ASN 48 Ca 0.43 -0.02 0.00 0.00 0.21 0.00 0.00 52.86 53.48 1o5p s ASN 48 Cb -0.05 -1.68 0.00 0.00 -0.55 0.00 0.00 41.25 38.97 1o5p s ASN 48 CO 0.27 0.24 0.55 -0.81 -2.79 0.00 0.00 177.10 174.56 1o5p n PRO 49 N 3.07 0.73 0.00 0.43 -0.04 -1.26 -3.28 135.00 134.65 1o5p n PRO 49 Ca -0.18 0.00 0.07 0.00 -0.04 0.00 0.00 63.50 63.36 1o5p n PRO 49 Cb 0.53 -1.25 -0.00 0.00 -0.04 0.00 0.00 33.50 32.74 1o5p n PRO 49 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1o5p n ALA 50 N 0.39 3.11 -0.66 0.55 0.00 -1.26 -4.42 120.51 118.22 1o5p n ALA 50 Ca 0.00 -0.51 0.00 0.00 0.00 0.00 0.00 53.44 52.93 1o5p n ALA 50 Cb 0.28 -0.51 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 -0.25 0.00 0.00 0.00 177.50 177.25 1o5p n ASP 51 N -0.20 0.54 -4.58 0.00 8.00 -1.21 -3.35 116.55 115.76 1o5p n ASP 51 Ca 0.06 -1.20 -0.14 0.00 0.71 0.00 0.00 54.79 54.21 1o5p n ASP 51 Cb 0.30 0.00 -0.12 0.00 -0.02 0.00 0.00 41.12 41.28 1o5p n ASP 51 CO 0.00 0.00 0.00 -0.36 -0.39 0.00 0.00 177.20 176.45 1o5p s PHE 52 N -0.20 1.20 0.00 1.24 0.40 -1.25 -3.89 117.98 115.48 1o5p s PHE 52 Ca 0.00 2.39 0.00 0.00 -0.60 0.00 0.00 56.93 58.72 1o5p s PHE 52 Cb 0.00 -3.30 0.00 0.00 0.51 0.00 0.00 43.02 40.23 1o5p s PHE 52 CO 0.00 -0.62 0.00 0.43 0.70 0.00 0.00 175.22 175.73 1o5p n SER 53 N 19.93 0.53 0.00 1.36 7.64 -0.24 -4.91 113.62 137.93 1o5p n SER 53 Ca 0.41 -0.96 0.00 0.00 1.01 0.00 0.00 58.87 59.33 1o5p n SER 53 Cb 0.47 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.67 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 -2.37 0.00 -3.77 6.43 2.88 -1.26 -1.77 113.62 113.76 1o5p n SER 54 Ca 0.00 0.00 -0.10 0.00 -1.33 0.00 0.00 58.87 57.44 1o5p n SER 54 Cb 0.00 0.00 -0.07 0.00 -0.75 0.00 0.00 64.21 63.39 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 -0.57 0.10 -0.09 2.46 0.11 -0.39 -4.93 120.40 117.09 1o5p s VAL 55 Ca 0.00 -0.84 -0.09 0.00 -2.93 0.00 0.00 61.98 58.12 1o5p s VAL 55 Cb 0.00 -1.13 -0.04 0.00 -1.53 0.00 0.00 36.38 33.68 1o5p s VAL 55 CO 0.00 -0.46 0.21 -0.89 -3.33 0.00 0.00 175.10 170.62 1o5p s THR 56 N -3.29 5.39 -0.34 5.04 2.01 -1.26 0.25 115.64 123.43 1o5p s THR 56 Ca 0.00 0.36 -0.27 0.00 0.31 0.00 0.00 61.69 62.09 1o5p s THR 56 Cb 0.02 -3.48 -0.05 0.00 0.01 0.00 0.00 72.50 69.00 1o5p s THR 56 CO -0.08 0.60 2.16 0.00 -0.69 0.00 0.00 174.62 176.61 1o5p s ALA 57 N -1.05 2.42 0.00 7.40 0.00 -1.10 -4.70 121.76 124.73 1o5p s ALA 57 Ca 0.17 0.37 0.00 0.00 0.00 0.00 0.00 51.96 52.50 1o5p s ALA 57 Cb -0.13 -4.15 0.00 0.00 0.00 0.00 0.00 23.12 18.84 1o5p s ALA 57 CO 0.07 -3.29 0.00 -0.40 0.00 0.00 0.00 175.76 172.13 1o5p n ASP 58 N 12.62 0.00 -0.11 0.00 5.75 -1.26 0.33 116.55 133.88 1o5p n ASP 58 Ca 0.30 0.00 -0.05 0.00 -0.01 0.00 0.00 54.79 55.02 1o5p n ASP 58 Cb 0.48 0.00 0.01 0.00 -1.03 0.00 0.00 41.12 40.58 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 -2.01 0.21 0.00 2.12 0.00 -1.92 -3.13 119.26 114.53 1o5p h ALA 59 Ca 0.00 0.14 -0.32 0.00 0.00 0.00 0.00 54.91 54.74 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 -0.48 -2.20 -1.71 0.00 0.00 0.00 179.25 174.86 1o5p n ASN 60 N -5.31 1.55 0.00 0.00 4.05 -1.26 -4.55 115.26 109.74 1o5p n ASN 60 Ca 0.02 -0.06 0.00 0.00 0.45 0.00 0.00 54.58 54.99 1o5p n ASN 60 Cb 0.23 0.29 0.00 0.00 1.23 0.00 0.00 39.78 41.52 1o5p n ASN 60 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 177.26 174.82 1o5p n GLY 61 N 2.20 0.75 3.57 8.20 0.00 -1.18 -1.95 105.19 116.78 1o5p n GLY 61 Ca -0.33 -0.72 -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 -1.27 5.38 -0.21 1.61 0.01 -1.22 -1.93 113.70 116.08 1o5p s SER 62 Ca 0.00 -0.02 -0.03 0.00 1.31 0.00 0.00 55.95 57.22 1o5p s SER 62 Cb 0.00 -1.93 0.06 0.00 0.21 0.00 0.00 66.02 64.37 1o5p s SER 62 CO 0.00 0.13 0.04 0.00 0.41 0.00 0.00 173.24 173.81 1o5p s ALA 63 N 0.65 1.09 -0.21 1.44 0.00 0.23 -4.65 121.76 120.31 1o5p s ALA 63 Ca 0.02 -0.80 0.02 0.00 0.00 0.00 0.00 51.96 51.20 1o5p s ALA 63 Cb -0.13 -1.23 0.04 0.00 0.00 0.00 0.00 23.12 21.80 1o5p s ALA 63 CO 0.02 -1.21 -0.16 -1.12 0.00 0.00 0.00 175.76 173.29 1o5p s SER 64 N 1.82 3.63 -0.05 0.00 0.01 -1.26 0.80 113.70 118.65 1o5p s SER 64 Ca -0.01 -0.94 -0.08 0.00 1.31 0.00 0.00 55.95 56.23 1o5p s SER 64 Cb -0.17 -1.48 0.01 0.00 0.21 0.00 0.00 66.02 64.59 1o5p s SER 64 CO -0.09 -0.08 0.20 0.28 0.41 0.00 0.00 173.24 173.95 1o5p s THR 65 N 1.23 0.03 -0.12 1.44 -1.32 -0.98 -5.00 115.64 110.92 1o5p s THR 65 Ca -0.01 -0.25 -0.09 0.00 -1.21 0.00 0.00 61.69 60.13 1o5p s THR 65 Cb -0.16 -0.37 -0.04 0.00 -1.51 0.00 0.00 72.50 70.42 1o5p s THR 65 CO -0.10 -0.14 0.19 -0.94 -2.21 0.00 0.00 174.62 171.43 1o5p s SER 66 N -0.46 6.42 0.26 8.08 1.04 -1.26 -1.98 113.70 125.80 1o5p s SER 66 Ca -0.06 0.49 0.03 0.00 0.48 0.00 0.00 55.95 56.90 1o5p s SER 66 Cb -0.04 -2.11 -0.05 0.00 0.10 0.00 0.00 66.02 63.92 1o5p s SER 66 CO 0.01 0.33 0.04 -0.76 0.98 0.00 0.00 173.24 173.84 1o5p s LEU 67 N -0.64 2.04 -0.24 2.42 1.02 0.30 -4.92 118.68 118.67 1o5p s LEU 67 Ca 0.15 -1.30 -0.09 0.00 0.02 0.00 0.00 54.13 52.91 1o5p s LEU 67 Cb -0.13 -0.22 -0.04 0.00 0.02 0.00 0.00 46.19 45.82 1o5p s LEU 67 CO 0.04 -0.59 0.12 0.42 0.02 0.00 0.00 176.35 176.36 1o5p s THR 68 N -3.48 4.92 0.01 5.49 -4.23 -1.21 0.49 115.64 117.63 1o5p s THR 68 Ca 0.33 0.03 0.02 0.00 -1.18 0.00 0.00 61.69 60.88 1o5p s THR 68 Cb 0.07 -3.29 -0.01 0.00 1.34 0.00 0.00 72.50 70.61 1o5p s THR 68 CO 0.12 0.35 -0.06 0.68 -0.54 0.00 0.00 174.62 175.16 1o5p s VAL 69 N 1.22 0.46 0.24 2.29 -7.23 -0.89 -4.35 120.40 112.14 1o5p s VAL 69 Ca 0.06 -0.56 0.02 0.00 -1.81 0.00 0.00 61.98 59.68 1o5p s VAL 69 Cb -0.14 -0.45 -0.01 0.00 0.56 0.00 0.00 36.38 36.34 1o5p s VAL 69 CO 0.05 -0.08 0.28 -2.11 -0.31 0.00 0.00 175.10 172.93 1o5p n ARG 70 N 2.36 0.40 0.00 4.82 1.85 -1.26 -4.19 116.66 120.64 1o5p n ARG 70 Ca -0.17 -2.13 0.00 0.00 -1.00 0.00 0.00 57.85 54.55 1o5p n ARG 70 Cb 0.57 1.91 0.00 0.00 -1.05 0.00 0.00 32.46 33.89 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 -0.42 0.00 -2.02 2.89 0.00 -1.26 -4.58 116.66 111.26 1o5p n ARG 71 Ca 0.03 0.00 -0.37 0.00 -0.00 0.00 0.00 57.85 57.51 1o5p n ARG 71 Cb 0.42 -0.26 0.02 0.00 -0.00 0.00 0.00 32.46 32.64 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 -2.35 5.45 -0.27 2.89 0.01 -1.26 -1.64 113.70 116.53 1o5p s SER 72 Ca 0.00 2.45 -0.25 0.00 1.31 0.00 0.00 55.95 59.46 1o5p s SER 72 Cb 0.00 -2.61 0.12 0.00 0.21 0.00 0.00 66.02 63.74 1o5p s SER 72 CO 0.00 -1.42 1.01 0.72 0.41 0.00 0.00 173.24 173.96 1o5p s PHE 73 N -1.51 -0.49 -0.33 2.43 -0.71 -0.58 -4.82 117.98 111.96 1o5p s PHE 73 Ca 0.73 1.18 -0.38 0.00 -1.04 0.00 0.00 56.93 57.42 1o5p s PHE 73 Cb -0.32 0.36 -0.16 0.00 -1.21 0.00 0.00 43.02 41.68 1o5p s PHE 73 CO 0.37 -0.25 1.23 0.39 -1.34 0.00 0.00 175.22 175.62 1o5p n GLU 74 N 2.15 0.00 -1.88 1.99 -0.58 -1.26 -1.34 120.64 119.71 1o5p n GLU 74 Ca -0.12 0.00 -0.36 0.00 -0.42 0.00 0.00 57.16 56.25 1o5p n GLU 74 Cb 0.56 -1.24 0.01 0.00 -0.57 0.00 0.00 31.44 30.20 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 2.87 5.23 3.34 0.62 0.00 -0.54 -2.61 105.19 114.10 1o5p n GLY 75 Ca 0.24 -2.29 -0.61 0.00 0.00 0.00 0.00 46.02 43.36 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 0.08 1.38 -2.97 1.61 3.01 0.47 -2.30 117.46 118.75 1o5p n PHE 76 Ca 0.52 0.91 -0.41 0.00 1.01 0.00 0.00 57.45 59.49 1o5p n PHE 76 Cb 0.33 -2.17 -0.04 0.00 -0.01 0.00 0.00 39.48 37.59 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 4.39 4.24 -0.31 4.37 2.96 -0.63 -1.93 118.68 131.76 1o5p s LEU 77 Ca 1.08 1.17 -0.02 0.00 -0.22 0.00 0.00 54.13 56.14 1o5p s LEU 77 Cb -1.44 -3.16 -0.03 0.00 0.50 0.00 0.00 46.19 42.07 1o5p s LEU 77 CO 0.71 -0.26 1.41 0.33 -1.32 0.00 0.00 176.35 177.21 1o5p n PHE 78 N 4.55 0.46 -2.00 5.38 7.35 -1.22 -2.92 117.46 129.06 1o5p n PHE 78 Ca 0.02 -0.97 0.00 0.00 -0.76 0.00 0.00 57.45 55.73 1o5p n PHE 78 Cb 0.50 -0.97 0.00 0.00 0.35 0.00 0.00 39.48 39.36 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 4.41 0.00 0.00 -2.13 2.03 -1.26 -4.98 116.55 114.62 1o5p n ASP 79 Ca 0.17 -1.02 0.00 0.00 0.52 0.00 0.00 54.79 54.45 1o5p n ASP 79 Cb 0.08 -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 2.79 3.95 0.27 0.00 -1.15 -4.99 105.19 106.06 1o5p n GLY 80 Ca 0.00 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 45.78 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 -1.13 5.19 -0.09 2.61 -4.23 -1.26 -4.97 115.64 111.75 1o5p s THR 81 Ca 0.00 -0.62 -0.04 0.00 -1.18 0.00 0.00 61.69 59.85 1o5p s THR 81 Cb 0.00 -3.83 -0.04 0.00 1.34 0.00 0.00 72.50 69.98 1o5p s THR 81 CO 0.00 -0.37 0.06 0.00 -0.54 0.00 0.00 174.62 173.76 1o5p s ARG 82 N -3.93 3.15 0.24 3.99 1.70 -1.26 -1.61 118.95 121.24 1o5p s ARG 82 Ca 0.37 -0.31 0.24 0.00 -0.47 0.00 0.00 55.73 55.56 1o5p s ARG 82 Cb -0.10 -2.94 0.35 0.00 -0.57 0.00 0.00 34.95 31.69 1o5p s ARG 82 CO 0.32 0.73 1.42 2.35 -1.08 0.00 0.00 175.30 179.03 1o5p h TRP 83 N 5.05 0.00 0.00 5.89 7.01 -1.78 -3.45 115.95 128.67 1o5p h TRP 83 Ca -0.52 0.00 0.00 0.00 2.11 0.00 0.00 58.89 60.48 1o5p h TRP 83 Cb 1.21 0.00 0.00 0.00 -2.10 0.00 0.00 29.16 28.27 1o5p h TRP 83 CO 0.68 0.00 0.00 0.41 -2.79 0.00 0.00 178.44 176.74 1o5p n GLY 84 N 1.23 1.18 3.57 2.65 0.00 -1.26 -4.89 105.19 107.67 1o5p n GLY 84 Ca 0.03 -2.20 -0.40 0.00 0.00 0.00 0.00 46.02 43.45 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 -1.34 3.28 -0.48 2.61 -4.23 -1.26 -1.47 115.64 112.74 1o5p s THR 85 Ca 0.00 0.23 -0.28 0.00 -1.18 0.00 0.00 61.69 60.46 1o5p s THR 85 Cb 0.00 -3.53 0.01 0.00 1.34 0.00 0.00 72.50 70.33 1o5p s THR 85 CO 0.00 -0.44 1.39 -0.69 -0.54 0.00 0.00 174.62 174.35 1o5p s VAL 86 N 8.95 3.88 -0.25 2.29 1.01 -0.45 -4.64 120.40 131.19 1o5p s VAL 86 Ca 0.82 0.84 -0.29 0.00 0.00 0.00 0.00 61.98 63.35 1o5p s VAL 86 Cb -0.19 -4.33 -0.03 0.00 0.00 0.00 0.00 36.38 31.83 1o5p s VAL 86 CO 0.28 -0.95 1.72 -1.81 0.00 0.00 0.00 175.10 174.34 1o5p s ASP 87 N 4.05 6.17 0.00 3.32 1.11 -1.26 -1.53 116.67 128.53 1o5p s ASP 87 Ca 0.56 1.57 0.04 0.00 0.18 0.00 0.00 52.55 54.90 1o5p s ASP 87 Cb -0.12 -2.53 0.19 0.00 1.07 0.00 0.00 42.92 41.54 1o5p s ASP 87 CO 0.29 -1.44 0.92 0.00 1.18 0.00 0.00 175.17 176.12 1o5p n THR 89 N -1.25 0.00 -0.09 0.00 -2.24 -1.26 -4.12 114.28 105.31 1o5p n THR 89 Ca 0.02 -0.15 -0.19 0.00 -2.27 0.00 0.00 64.05 61.46 1o5p n THR 89 Cb 0.03 0.28 -0.07 0.00 -2.10 0.00 0.00 70.33 68.46 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 -0.44 1.03 -3.90 4.28 -2.24 -0.11 -5.04 114.28 107.86 1o5p n THR 90 Ca 0.16 -0.29 -0.21 0.00 -2.27 0.00 0.00 64.05 61.44 1o5p n THR 90 Cb 0.32 -1.63 -0.01 0.00 -2.10 0.00 0.00 70.33 66.92 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 -3.68 0.63 -2.83 6.98 0.00 -1.21 -5.10 120.51 115.30 1o5p n ALA 91 Ca -0.36 -1.75 -0.39 0.00 0.00 0.00 0.00 53.44 50.94 1o5p n ALA 91 Cb 0.78 0.75 -0.12 0.00 0.00 0.00 0.00 19.45 20.87 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 -2.63 3.31 -0.25 0.00 0.00 -1.26 -4.72 121.76 116.20 1o5p s ALA 92 Ca 0.22 -1.35 -0.14 0.00 0.00 0.00 0.00 51.96 50.69 1o5p s ALA 92 Cb -0.02 -2.39 -0.04 0.00 0.00 0.00 0.00 23.12 20.67 1o5p s ALA 92 CO 0.14 -0.85 0.32 0.00 0.00 0.00 0.00 175.76 175.36 1o5p s GLN 94 N 1.66 3.02 -0.35 0.00 -0.21 -0.76 -2.53 119.66 120.49 1o5p s GLN 94 Ca 0.14 -0.59 -0.09 0.00 0.02 0.00 0.00 55.36 54.83 1o5p s GLN 94 Cb -0.15 -2.81 0.02 0.00 1.00 0.00 0.00 33.01 31.07 1o5p s GLN 94 CO 0.09 0.60 0.16 0.08 -2.12 0.00 0.00 175.29 174.09 1o5p s VAL 95 N -1.35 4.29 0.03 1.09 1.01 0.19 -2.18 120.40 123.47 1o5p s VAL 95 Ca 0.28 -0.85 -0.01 0.00 0.00 0.00 0.00 61.98 61.41 1o5p s VAL 95 Cb -0.12 -3.35 0.00 0.00 0.00 0.00 0.00 36.38 32.91 1o5p s VAL 95 CO 0.21 -0.14 0.04 0.61 0.00 0.00 0.00 175.10 175.82 1o5p n GLY 96 N 4.93 2.58 3.77 4.51 0.00 -1.08 0.32 105.19 120.23 1o5p n GLY 96 Ca -0.13 -1.24 -0.29 0.00 0.00 0.00 0.00 46.02 44.37 1o5p n GLY 96 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1o5p s LEU 97 N 0.00 2.68 0.00 0.99 1.02 -1.25 -2.23 118.68 119.90 1o5p s LEU 97 Ca 0.02 -1.37 0.00 0.00 0.02 0.00 0.00 54.13 52.80 1o5p s LEU 97 Cb -0.00 -1.05 0.00 0.00 0.02 0.00 0.00 46.19 45.16 1o5p s LEU 97 CO 0.01 -0.78 0.00 -0.24 0.02 0.00 0.00 176.35 175.36 1o5p n SER 98 N -1.34 0.00 -0.29 2.29 2.88 -0.65 -4.31 113.62 112.20 1o5p n SER 98 Ca -0.08 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.46 1o5p n SER 98 Cb 0.66 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 64.12 1o5p n SER 98 CO 0.00 0.00 0.00 -0.90 -1.23 0.00 0.00 175.04 172.91 1o5p n ASP 99 N 0.00 0.00 -1.61 -3.46 5.75 -1.24 0.29 116.55 116.28 1o5p n ASP 99 Ca 0.00 -0.13 -0.15 0.00 -0.01 0.00 0.00 54.79 54.50 1o5p n ASP 99 Cb 0.00 0.00 0.11 0.00 -1.03 0.00 0.00 41.12 40.20 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 -0.05 2.12 0.00 -1.26 -4.58 120.51 118.53 1o5p n ALA 100 Ca 0.00 -3.51 -0.05 0.00 0.00 0.00 0.00 53.44 49.88 1o5p n ALA 100 Cb 0.00 -0.62 -0.07 0.00 0.00 0.00 0.00 19.45 18.76 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 -0.91 1.76 0.00 0.00 0.00 -1.26 -5.00 120.51 115.10 1o5p n ALA 101 Ca 0.40 -0.59 0.00 0.00 0.00 0.00 0.00 53.44 53.24 1o5p n ALA 101 Cb 0.90 0.09 0.00 0.00 0.00 0.00 0.00 19.45 20.44 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 2.53 0.98 2.77 0.00 0.00 -1.26 -5.14 105.19 105.07 1o5p n GLY 102 Ca -0.17 -0.07 -0.04 0.00 0.00 0.00 0.00 46.02 45.75 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 -1.39 -0.16 1.61 5.03 -1.26 -5.01 115.26 114.07 1o5p n ASN 103 Ca 0.00 -1.82 0.00 0.00 0.87 0.00 0.00 54.58 53.63 1o5p n ASN 103 Cb 0.00 2.28 0.00 0.00 -1.02 0.00 0.00 39.78 41.04 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 -0.48 1.78 2.80 7.41 0.00 -1.26 -3.64 105.19 111.79 1o5p n GLY 104 Ca -0.03 -0.71 -0.11 0.00 0.00 0.00 0.00 46.02 45.16 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 -0.59 -2.83 1.61 -0.02 -1.26 -4.90 135.00 127.01 1o5p n PRO 105 Ca 0.00 -0.53 -0.20 0.00 -2.02 0.00 0.00 63.50 60.74 1o5p n PRO 105 Cb 0.00 -1.29 0.06 0.00 -0.02 0.00 0.00 33.50 32.25 1o5p n PRO 105 CO 0.00 0.00 0.00 -1.83 1.98 0.00 0.00 175.50 175.65 1o5p s GLU 106 N -3.08 2.31 0.49 -0.52 -1.05 -1.26 -4.65 118.70 110.93 1o5p s GLU 106 Ca 0.25 -1.24 0.05 0.00 -0.15 0.00 0.00 54.97 53.87 1o5p s GLU 106 Cb -0.04 -2.56 -0.01 0.00 -0.44 0.00 0.00 34.13 31.08 1o5p s GLU 106 CO 0.21 -0.85 0.20 0.20 0.95 0.00 0.00 175.26 175.96 1o5p s GLY 107 N -4.57 2.58 0.15 -3.83 0.00 -1.26 -3.81 107.32 96.59 1o5p s GLY 107 Ca 0.61 -1.26 0.07 0.00 0.00 0.00 0.00 44.72 44.13 1o5p s GLY 107 CO 0.39 -2.02 0.01 0.14 0.00 0.00 0.00 173.10 171.62 1o5p s VAL 108 N -2.75 3.84 -0.22 1.40 1.01 0.15 -4.82 120.40 119.01 1o5p s VAL 108 Ca 0.27 -1.29 -0.16 0.00 0.00 0.00 0.00 61.98 60.80 1o5p s VAL 108 Cb 0.01 -2.91 -0.04 0.00 0.00 0.00 0.00 36.38 33.45 1o5p s VAL 108 CO 0.16 -0.05 0.41 0.00 0.00 0.00 0.00 175.10 175.62 1o5p s ALA 109 N -1.62 3.56 0.46 5.51 0.00 -1.26 0.54 121.76 128.95 1o5p s ALA 109 Ca 0.27 -0.57 0.06 0.00 0.00 0.00 0.00 51.96 51.72 1o5p s ALA 109 Cb -0.10 -2.68 0.02 0.00 0.00 0.00 0.00 23.12 20.36 1o5p s ALA 109 CO 0.19 -0.40 0.63 0.96 0.00 0.00 0.00 175.76 177.13 1o5p s ILE 110 N 1.54 2.96 0.05 0.00 -4.36 -1.05 -4.81 121.20 115.52 1o5p s ILE 110 Ca 0.19 -0.89 0.00 0.00 -0.26 0.00 0.00 60.65 59.69 1o5p s ILE 110 Cb -0.15 -3.02 -0.03 0.00 1.25 0.00 0.00 42.46 40.50 1o5p s ILE 110 CO 0.08 -0.01 -0.05 -0.55 0.24 0.00 0.00 174.94 174.66 1o5p s SER 111 N -4.36 0.61 -0.45 4.36 0.15 0.18 -4.74 113.70 109.45 1o5p s SER 111 Ca 0.55 -0.76 0.02 0.00 0.70 0.00 0.00 55.95 56.46 1o5p s SER 111 Cb -0.10 0.12 0.14 0.00 -1.71 0.00 0.00 66.02 64.47 1o5p s SER 111 CO 0.35 -0.41 0.27 -0.36 1.20 0.00 0.00 173.24 174.29 1o5p s PHE 112 N -2.62 1.85 -0.44 3.44 0.08 -1.26 -2.88 117.98 116.16 1o5p s PHE 112 Ca -0.02 -2.39 0.00 0.00 0.12 0.00 0.00 56.93 54.64 1o5p s PHE 112 Cb -0.02 -1.72 0.00 0.00 -0.57 0.00 0.00 43.02 40.72 1o5p s PHE 112 CO -0.04 -0.77 0.11 0.27 -0.10 0.00 0.00 175.22 174.68