#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 2.23 0.89 0.00 0.00 -1.26 -4.99 121.76 118.62 1o5p s ALA 2 Ca 0.00 -1.38 -0.11 0.00 0.00 0.00 0.00 51.96 50.47 1o5p s ALA 2 Cb 0.00 -0.37 0.13 0.00 0.00 0.00 0.00 23.12 22.88 1o5p s ALA 2 CO 0.00 0.50 1.16 -2.30 0.00 0.00 0.00 175.76 175.12 1o5p n PRO 3 N 1.10 -0.27 -1.91 0.00 -0.02 -0.44 -4.25 135.00 129.22 1o5p n PRO 3 Ca -0.18 -0.01 0.00 0.00 -2.02 0.00 0.00 63.50 61.29 1o5p n PRO 3 Cb 0.53 -2.40 0.00 0.00 -0.02 0.00 0.00 33.50 31.61 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 -3.97 0.00 -3.64 3.45 5.66 0.23 -4.86 114.28 111.14 1o5p n THR 4 Ca 0.12 0.00 -0.06 0.00 -3.05 0.00 0.00 64.05 61.06 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 -2.05 -0.46 1.79 0.00 -1.25 -0.95 121.76 117.83 1o5p s ALA 5 Ca 0.00 2.15 -0.14 0.00 0.00 0.00 0.00 51.96 53.97 1o5p s ALA 5 Cb 0.00 -1.52 0.08 0.00 0.00 0.00 0.00 23.12 21.68 1o5p s ALA 5 CO 0.00 -0.32 0.37 0.95 0.00 0.00 0.00 175.76 176.75 1o5p s THR 6 N 1.00 4.93 -0.15 0.00 -4.23 0.16 -4.77 115.64 112.58 1o5p s THR 6 Ca -0.05 -1.21 0.02 0.00 -1.18 0.00 0.00 61.69 59.27 1o5p s THR 6 Cb -0.04 -3.99 0.01 0.00 1.34 0.00 0.00 72.50 69.82 1o5p s THR 6 CO -0.12 -0.59 -0.20 -0.69 -0.54 0.00 0.00 174.62 172.48 1o5p s VAL 7 N 1.57 2.14 -0.19 2.29 1.01 -1.24 0.13 120.40 126.12 1o5p s VAL 7 Ca 0.04 -0.94 -0.30 0.00 0.00 0.00 0.00 61.98 60.78 1o5p s VAL 7 Cb -0.24 -1.87 0.14 0.00 0.00 0.00 0.00 36.38 34.40 1o5p s VAL 7 CO 0.05 0.54 1.07 -0.89 0.00 0.00 0.00 175.10 175.87 1o5p s THR 8 N 0.96 0.00 0.49 3.92 2.01 -0.67 -4.48 115.64 117.88 1o5p s THR 8 Ca -0.03 0.00 -0.19 0.00 0.31 0.00 0.00 61.69 61.78 1o5p s THR 8 Cb -0.15 -1.00 -0.08 0.00 0.01 0.00 0.00 72.50 71.28 1o5p s THR 8 CO -0.05 0.00 1.01 -2.16 -0.69 0.00 0.00 174.62 172.73 1o5p s PRO 9 N -1.09 3.85 0.05 4.92 0.05 -1.26 -0.95 135.00 140.57 1o5p s PRO 9 Ca 0.01 1.22 0.21 0.00 0.05 0.00 0.00 61.00 62.49 1o5p s PRO 9 Cb -0.01 -2.11 -0.19 0.00 0.05 0.00 0.00 34.50 32.24 1o5p s PRO 9 CO -0.00 -0.37 0.68 -1.13 0.05 0.00 0.00 177.00 176.23 1o5p n SER 10 N -1.14 0.40 -4.22 6.66 3.41 -1.26 -4.78 113.62 112.68 1o5p n SER 10 Ca 0.08 0.16 -0.15 0.00 -0.26 0.00 0.00 58.87 58.70 1o5p n SER 10 Cb 0.53 1.17 -0.11 0.00 -0.26 0.00 0.00 64.21 65.54 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 -5.04 1.73 -0.05 4.04 0.01 -1.26 0.55 113.70 113.69 1o5p s SER 11 Ca -0.05 -0.90 -0.00 0.00 1.31 0.00 0.00 55.95 56.31 1o5p s SER 11 Cb 0.11 -0.02 0.00 0.00 0.21 0.00 0.00 66.02 66.32 1o5p s SER 11 CO 0.85 -0.26 0.03 0.61 0.41 0.00 0.00 173.24 174.87 1o5p n GLY 12 N 0.24 0.75 0.13 3.44 0.00 -1.14 -4.90 105.19 103.70 1o5p n GLY 12 Ca -0.13 -0.71 -0.22 0.00 0.00 0.00 0.00 46.02 44.95 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 -0.48 2.31 -1.34 0.99 4.77 -1.26 -5.05 117.00 116.94 1o5p n LEU 13 Ca -0.00 0.27 0.00 0.00 -0.03 0.00 0.00 56.01 56.25 1o5p n LEU 13 Cb 0.50 -1.01 0.00 0.00 -2.33 0.00 0.00 43.42 40.58 1o5p n LEU 13 CO 0.02 0.62 -0.41 -0.24 -1.33 0.00 0.00 177.39 176.05 1o5p n SER 14 N -3.90 -7.25 -4.49 -1.43 2.88 -1.26 -3.74 113.62 94.43 1o5p n SER 14 Ca -0.36 1.46 -0.44 0.00 -1.33 0.00 0.00 58.87 58.20 1o5p n SER 14 Cb 0.89 -4.10 -0.07 0.00 -0.75 0.00 0.00 64.21 60.17 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 -2.05 1.85 0.00 -3.46 5.75 -1.26 -2.16 116.55 115.22 1o5p n ASP 15 Ca 0.00 0.09 0.00 0.00 -0.01 0.00 0.00 54.79 54.87 1o5p n ASP 15 Cb 0.30 -1.30 0.00 0.00 -1.03 0.00 0.00 41.12 39.10 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 6.36 0.98 2.95 6.12 0.00 -1.26 -5.05 105.19 115.29 1o5p n GLY 16 Ca 0.45 0.00 -0.18 0.00 0.00 0.00 0.00 46.02 46.28 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 0.00 0.00 -4.71 2.61 5.66 -0.92 -4.98 114.28 111.94 1o5p n THR 17 Ca 0.00 -1.61 -0.23 0.00 -3.05 0.00 0.00 64.05 59.16 1o5p n THR 17 Cb 0.00 -0.31 -0.15 0.00 -1.55 0.00 0.00 70.33 68.32 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 -1.98 1.20 0.19 1.08 1.01 -1.26 -2.16 120.40 118.48 1o5p s VAL 18 Ca 0.32 -0.64 0.10 0.00 0.00 0.00 0.00 61.98 61.76 1o5p s VAL 18 Cb -0.03 -1.00 -0.04 0.00 0.00 0.00 0.00 36.38 35.31 1o5p s VAL 18 CO 0.20 0.34 -0.16 0.68 0.00 0.00 0.00 175.10 176.16 1o5p s VAL 19 N -0.33 2.78 -0.39 2.92 -7.23 0.14 -4.75 120.40 113.54 1o5p s VAL 19 Ca 0.05 -1.87 -0.11 0.00 -1.81 0.00 0.00 61.98 58.24 1o5p s VAL 19 Cb -0.06 -2.36 0.04 0.00 0.56 0.00 0.00 36.38 34.55 1o5p s VAL 19 CO -0.00 -0.13 0.24 -0.75 -0.31 0.00 0.00 175.10 174.14 1o5p s LYS 20 N -2.80 2.80 -0.22 4.82 2.20 -0.12 -1.31 119.74 125.10 1o5p s LYS 20 Ca 0.23 -1.17 -0.07 0.00 -0.36 0.00 0.00 55.97 54.61 1o5p s LYS 20 Cb -0.08 -3.80 -0.03 0.00 -1.51 0.00 0.00 37.83 32.41 1o5p s LYS 20 CO 0.13 -0.78 0.05 0.54 -0.36 0.00 0.00 175.35 174.93 1o5p s VAL 21 N 1.55 4.30 0.37 4.02 0.11 -0.90 -1.66 120.40 128.19 1o5p s VAL 21 Ca 0.02 -0.19 0.08 0.00 -2.93 0.00 0.00 61.98 58.97 1o5p s VAL 21 Cb -0.20 -2.98 -0.06 0.00 -1.53 0.00 0.00 36.38 31.61 1o5p s VAL 21 CO 0.06 0.39 0.02 0.00 -3.33 0.00 0.00 175.10 172.23 1o5p s ALA 22 N 1.20 3.21 -0.01 1.54 0.00 0.34 -2.28 121.76 125.75 1o5p s ALA 22 Ca 0.04 -2.12 0.02 0.00 0.00 0.00 0.00 51.96 49.91 1o5p s ALA 22 Cb -0.14 -0.15 -0.00 0.00 0.00 0.00 0.00 23.12 22.82 1o5p s ALA 22 CO 0.03 -0.02 -0.08 0.20 0.00 0.00 0.00 175.76 175.89 1o5p s GLY 23 N -3.72 0.40 -0.10 0.00 0.00 0.35 -0.67 107.32 103.59 1o5p s GLY 23 Ca 0.35 -0.33 -0.04 0.00 0.00 0.00 0.00 44.72 44.71 1o5p s GLY 23 CO 0.19 -0.23 0.21 0.00 0.00 0.00 0.00 173.10 173.27 1o5p s ALA 24 N -0.10 -0.42 0.00 3.20 0.00 -0.13 0.23 121.76 124.55 1o5p s ALA 24 Ca 0.02 0.83 0.00 0.00 0.00 0.00 0.00 51.96 52.81 1o5p s ALA 24 Cb -0.04 -0.74 0.00 0.00 0.00 0.00 0.00 23.12 22.34 1o5p s ALA 24 CO -0.00 -0.38 0.00 0.41 0.00 0.00 0.00 175.76 175.79 1o5p n GLY 25 N 4.74 0.89 3.95 0.00 0.00 -0.92 0.75 105.19 114.61 1o5p n GLY 25 Ca -0.16 -0.57 -0.26 0.00 0.00 0.00 0.00 46.02 45.03 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 2.86 -0.82 0.99 1.43 -0.79 -1.33 118.68 121.02 1o5p s LEU 26 Ca 0.00 0.13 -0.28 0.00 -1.03 0.00 0.00 54.13 52.95 1o5p s LEU 26 Cb 0.00 -2.55 -0.17 0.00 0.03 0.00 0.00 46.19 43.50 1o5p s LEU 26 CO 0.00 -1.93 2.57 0.00 0.23 0.00 0.00 176.35 177.22 1o5p n GLN 27 N -3.07 0.37 -1.27 1.70 3.00 -1.26 -4.06 117.38 112.79 1o5p n GLN 27 Ca 0.12 -0.03 -0.17 0.00 -0.01 0.00 0.00 57.00 56.91 1o5p n GLN 27 Cb 0.60 -2.21 -0.10 0.00 0.00 0.00 0.00 30.24 28.54 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 12.39 0.34 0.00 -1.58 0.00 -1.23 -1.22 120.51 129.20 1o5p n ALA 28 Ca 0.56 -2.05 0.00 0.00 0.00 0.00 0.00 53.44 51.94 1o5p n ALA 28 Cb 0.22 -2.85 0.00 0.00 0.00 0.00 0.00 19.45 16.83 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 5.57 0.47 2.68 0.00 0.00 0.94 -4.83 105.19 110.02 1o5p n GLY 29 Ca 0.34 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 46.14 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 -0.61 -0.22 -0.36 2.61 -4.23 -0.36 -4.88 115.64 107.59 1o5p s THR 30 Ca 0.00 -0.20 -0.36 0.00 -1.18 0.00 0.00 61.69 59.95 1o5p s THR 30 Cb 0.00 -0.67 -0.12 0.00 1.34 0.00 0.00 72.50 73.04 1o5p s THR 30 CO 0.00 -0.29 2.19 0.00 -0.54 0.00 0.00 174.62 175.98 1o5p n ALA 31 N 5.30 1.00 -2.82 3.99 0.00 -1.26 -2.73 120.51 123.99 1o5p n ALA 31 Ca -0.06 -0.04 -0.26 0.00 0.00 0.00 0.00 53.44 53.08 1o5p n ALA 31 Cb 0.49 -2.50 -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 7.21 3.19 0.30 0.00 1.51 0.14 -4.33 117.35 125.37 1o5p s TYR 32 Ca 1.11 -0.01 0.05 0.00 -1.01 0.00 0.00 57.07 57.20 1o5p s TYR 32 Cb -0.92 -1.52 -0.02 0.00 -0.11 0.00 0.00 41.96 39.39 1o5p s TYR 32 CO 0.51 0.52 0.44 0.34 -1.11 0.00 0.00 175.55 176.24 1o5p s ASP 33 N -3.19 6.17 -0.06 2.29 2.15 0.42 -1.58 116.67 122.86 1o5p s ASP 33 Ca 0.32 0.05 -0.03 0.00 0.43 0.00 0.00 52.55 53.32 1o5p s ASP 33 Cb -0.10 -1.65 0.04 0.00 -0.30 0.00 0.00 42.92 40.90 1o5p s ASP 33 CO 0.24 -0.26 0.12 0.54 -0.17 0.00 0.00 175.17 175.64 1o5p s VAL 34 N -2.13 -0.19 0.07 1.11 0.11 -0.85 -1.33 120.40 117.19 1o5p s VAL 34 Ca 0.39 0.38 -0.16 0.00 -2.93 0.00 0.00 61.98 59.67 1o5p s VAL 34 Cb -0.09 -0.23 0.05 0.00 -1.53 0.00 0.00 36.38 34.58 1o5p s VAL 34 CO 0.31 0.16 0.74 0.61 -3.33 0.00 0.00 175.10 173.59 1o5p n GLY 35 N 5.27 0.65 3.43 6.54 0.00 -0.91 -0.30 105.19 119.86 1o5p n GLY 35 Ca -0.05 -1.03 -0.43 0.00 0.00 0.00 0.00 46.02 44.52 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 -2.02 2.93 0.07 1.61 -2.07 -1.26 -2.59 119.66 116.32 1o5p s GLN 36 Ca 0.17 -1.09 0.05 0.00 -1.82 0.00 0.00 55.36 52.67 1o5p s GLN 36 Cb -0.01 -3.94 -0.03 0.00 -1.09 0.00 0.00 33.01 27.94 1o5p s GLN 36 CO 0.02 -0.79 -0.15 0.00 -1.32 0.00 0.00 175.29 173.06 1o5p s ALA 38 N -1.17 1.78 -0.35 0.00 0.00 -0.66 -1.56 121.76 119.80 1o5p s ALA 38 Ca -0.01 -0.90 -0.17 0.00 0.00 0.00 0.00 51.96 50.89 1o5p s ALA 38 Cb -0.10 -0.49 -0.01 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 -0.38 3.19 -0.90 0.00 0.51 -1.26 -1.63 118.94 118.48 1o5p s TRP 39 Ca 0.05 0.07 0.16 0.00 -2.12 0.00 0.00 56.10 54.26 1o5p s TRP 39 Cb -0.09 -2.83 0.59 0.00 -0.81 0.00 0.00 33.47 30.34 1o5p s TRP 39 CO 0.00 -0.51 1.51 1.33 -0.51 0.00 0.00 176.95 178.77 1o5p n VAL 40 N 5.36 1.74 -1.54 4.03 0.24 -0.89 -4.74 118.33 122.52 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 0.67 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 41.86 1o5p n ASP 41 CO 0.00 0.00 0.00 -0.89 -0.39 0.00 0.00 177.20 175.92 1o5p s THR 42 N -2.48 3.48 0.00 -3.53 2.01 -1.26 -2.92 115.64 110.94 1o5p s THR 42 Ca 0.00 0.09 0.00 0.00 0.31 0.00 0.00 61.69 62.09 1o5p s THR 42 Cb 0.00 -4.22 0.00 0.00 0.01 0.00 0.00 72.50 68.29 1o5p s THR 42 CO 0.00 -1.17 0.00 0.61 -0.69 0.00 0.00 174.62 173.37 1o5p n GLY 43 N 5.89 0.76 3.10 4.40 0.00 -1.26 -5.05 105.19 113.03 1o5p n GLY 43 Ca 0.21 -0.68 -0.33 0.00 0.00 0.00 0.00 46.02 45.21 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 2.63 -0.33 1.61 1.01 -1.15 -4.99 120.40 117.18 1o5p s VAL 44 Ca 0.00 -1.76 0.00 0.00 0.00 0.00 0.00 61.98 60.22 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 -0.27 0.05 -0.22 0.00 0.00 0.00 175.10 174.66 1o5p s LEU 45 N 1.12 4.42 -0.43 3.92 2.96 -1.26 -2.10 118.68 127.31 1o5p s LEU 45 Ca -0.01 -1.72 -0.17 0.00 -0.22 0.00 0.00 54.13 52.01 1o5p s LEU 45 Cb -0.20 -1.70 0.03 0.00 0.50 0.00 0.00 46.19 44.82 1o5p s LEU 45 CO -0.04 -0.36 0.41 0.00 -1.32 0.00 0.00 176.35 175.04 1o5p s ALA 46 N 1.11 3.45 0.36 5.97 0.00 -0.64 -3.51 121.76 128.49 1o5p s ALA 46 Ca 0.02 -1.61 0.08 0.00 0.00 0.00 0.00 51.96 50.44 1o5p s ALA 46 Cb -0.20 -3.03 -0.03 0.00 0.00 0.00 0.00 23.12 19.86 1o5p s ALA 46 CO -0.04 -1.58 0.28 0.00 0.00 0.00 0.00 175.76 174.41 1o5p s ASN 48 N -3.99 3.31 0.00 0.00 2.47 -0.87 -1.34 114.94 114.52 1o5p s ASN 48 Ca 0.42 -0.43 0.00 0.00 0.42 0.00 0.00 52.86 53.27 1o5p s ASN 48 Cb -0.04 -0.79 0.00 0.00 -1.45 0.00 0.00 41.25 38.97 1o5p s ASN 48 CO 0.26 0.27 0.58 -0.81 -3.72 0.00 0.00 177.10 173.68 1o5p n PRO 49 N 2.77 0.70 0.00 0.43 -0.04 -1.26 -3.44 135.00 134.16 1o5p n PRO 49 Ca -0.17 0.00 0.10 0.00 -0.04 0.00 0.00 63.50 63.39 1o5p n PRO 49 Cb 0.52 -1.22 -0.06 0.00 -0.04 0.00 0.00 33.50 32.70 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 0.47 4.50 -0.78 0.55 0.00 -1.26 -4.29 120.51 119.70 1o5p n ALA 50 Ca 0.00 -0.57 0.00 0.00 0.00 0.00 0.00 53.44 52.87 1o5p n ALA 50 Cb 0.29 -0.82 0.00 0.00 0.00 0.00 0.00 19.45 18.91 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 -1.38 0.38 -4.57 0.00 9.92 -1.22 -3.24 116.55 116.44 1o5p n ASP 51 Ca 0.05 -1.16 -0.15 0.00 -0.53 0.00 0.00 54.79 53.00 1o5p n ASP 51 Cb 0.34 0.00 -0.10 0.00 -0.64 0.00 0.00 41.12 40.72 1o5p n ASP 51 CO 0.00 0.00 0.00 -0.36 0.13 0.00 0.00 177.20 176.97 1o5p s PHE 52 N -0.16 1.21 0.00 1.24 0.40 -1.25 -3.72 117.98 115.70 1o5p s PHE 52 Ca 0.00 2.15 0.00 0.00 -0.60 0.00 0.00 56.93 58.48 1o5p s PHE 52 Cb 0.00 -3.38 0.00 0.00 0.51 0.00 0.00 43.02 40.15 1o5p s PHE 52 CO 0.00 -1.02 0.00 0.43 0.70 0.00 0.00 175.22 175.33 1o5p n SER 53 N 19.19 0.88 0.00 1.36 7.64 0.58 -4.92 113.62 138.35 1o5p n SER 53 Ca 0.43 -0.70 0.00 0.00 1.01 0.00 0.00 58.87 59.61 1o5p n SER 53 Cb 0.45 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.65 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 -1.49 0.00 -3.74 6.43 2.88 -1.26 -2.01 113.62 114.43 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 -0.06 0.00 -0.75 0.00 0.00 64.21 63.40 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 -0.52 0.09 -0.06 2.46 0.11 -0.61 -4.96 120.40 116.91 1o5p s VAL 55 Ca 0.00 -0.77 -0.07 0.00 -2.93 0.00 0.00 61.98 58.21 1o5p s VAL 55 Cb 0.00 -1.11 -0.04 0.00 -1.53 0.00 0.00 36.38 33.69 1o5p s VAL 55 CO 0.00 -0.42 0.21 -0.89 -3.33 0.00 0.00 175.10 170.66 1o5p s THR 56 N -3.27 5.39 -0.34 5.04 2.01 -1.26 0.28 115.64 123.49 1o5p s THR 56 Ca 0.00 0.21 -0.28 0.00 0.31 0.00 0.00 61.69 61.94 1o5p s THR 56 Cb 0.01 -3.50 -0.04 0.00 0.01 0.00 0.00 72.50 68.99 1o5p s THR 56 CO -0.08 0.51 2.03 0.00 -0.69 0.00 0.00 174.62 176.39 1o5p s ALA 57 N -1.15 2.59 0.00 7.40 0.00 -1.10 -4.68 121.76 124.81 1o5p s ALA 57 Ca 0.21 0.32 0.00 0.00 0.00 0.00 0.00 51.96 52.49 1o5p s ALA 57 Cb -0.13 -4.11 0.00 0.00 0.00 0.00 0.00 23.12 18.88 1o5p s ALA 57 CO 0.10 -3.05 0.00 -0.40 0.00 0.00 0.00 175.76 172.41 1o5p n ASP 58 N 11.77 0.00 -0.12 0.00 5.75 -1.26 0.32 116.55 133.00 1o5p n ASP 58 Ca 0.27 0.00 -0.05 0.00 -0.01 0.00 0.00 54.79 55.00 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 -2.00 0.10 0.00 2.12 0.00 -1.92 -3.10 119.26 114.46 1o5p h ALA 59 Ca 0.00 0.15 -0.29 0.00 0.00 0.00 0.00 54.91 54.77 1o5p h ALA 59 Cb 0.00 0.49 -0.05 0.00 0.00 0.00 0.00 17.79 18.23 1o5p h ALA 59 CO 0.00 -0.56 -2.09 0.09 0.00 0.00 0.00 179.25 176.68 1o5p n ASN 60 N -5.38 1.52 0.00 0.00 5.03 -1.26 -4.55 115.26 110.61 1o5p n ASN 60 Ca 0.02 -0.03 0.00 0.00 0.87 0.00 0.00 54.58 55.44 1o5p n ASN 60 Cb 0.29 0.54 0.00 0.00 -1.02 0.00 0.00 39.78 39.59 1o5p n ASN 60 CO 0.00 0.00 0.00 0.61 -1.83 0.00 0.00 177.26 176.04 1o5p n GLY 61 N 2.18 0.73 3.63 7.41 0.00 -1.17 -1.89 105.19 116.08 1o5p n GLY 61 Ca -0.28 -0.72 -0.34 0.00 0.00 0.00 0.00 46.02 44.67 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 -1.14 5.57 -0.21 1.61 0.01 -1.25 -2.16 113.70 116.13 1o5p s SER 62 Ca 0.00 0.07 -0.03 0.00 1.31 0.00 0.00 55.95 57.30 1o5p s SER 62 Cb 0.00 -1.95 0.06 0.00 0.21 0.00 0.00 66.02 64.34 1o5p s SER 62 CO 0.00 0.18 0.04 0.00 0.41 0.00 0.00 173.24 173.87 1o5p s ALA 63 N 0.36 1.05 -0.23 1.44 0.00 0.14 -4.62 121.76 119.89 1o5p s ALA 63 Ca 0.03 -0.79 -0.01 0.00 0.00 0.00 0.00 51.96 51.18 1o5p s ALA 63 Cb -0.12 -1.22 0.02 0.00 0.00 0.00 0.00 23.12 21.79 1o5p s ALA 63 CO 0.00 -1.23 -0.10 -1.54 0.00 0.00 0.00 175.76 172.90 1o5p s SER 64 N 1.84 4.00 -0.08 0.00 1.04 -1.26 0.13 113.70 119.37 1o5p s SER 64 Ca 0.00 -0.76 -0.08 0.00 0.48 0.00 0.00 55.95 55.59 1o5p s SER 64 Cb -0.17 -1.62 0.02 0.00 0.10 0.00 0.00 66.02 64.35 1o5p s SER 64 CO -0.10 -0.08 0.23 0.28 0.98 0.00 0.00 173.24 174.55 1o5p s THR 65 N 1.33 -0.00 -0.15 2.02 -1.32 -0.97 -5.00 115.64 111.55 1o5p s THR 65 Ca 0.02 0.00 -0.09 0.00 -1.21 0.00 0.00 61.69 60.41 1o5p s THR 65 Cb -0.15 -0.32 -0.05 0.00 -1.51 0.00 0.00 72.50 70.47 1o5p s THR 65 CO -0.07 0.00 0.15 -0.94 -2.21 0.00 0.00 174.62 171.56 1o5p s SER 66 N 0.13 6.33 0.22 8.08 1.04 -1.26 -2.12 113.70 126.11 1o5p s SER 66 Ca -0.00 0.38 0.01 0.00 0.48 0.00 0.00 55.95 56.82 1o5p s SER 66 Cb -0.02 -2.09 -0.05 0.00 0.10 0.00 0.00 66.02 63.97 1o5p s SER 66 CO 0.00 0.29 0.08 -0.76 0.98 0.00 0.00 173.24 173.84 1o5p s LEU 67 N -0.37 1.63 -0.21 2.42 1.02 -0.43 -4.93 118.68 117.81 1o5p s LEU 67 Ca 0.12 -1.33 -0.08 0.00 0.02 0.00 0.00 54.13 52.87 1o5p s LEU 67 Cb -0.12 0.11 -0.04 0.00 0.02 0.00 0.00 46.19 46.16 1o5p s LEU 67 CO 0.02 -0.72 0.08 0.42 0.02 0.00 0.00 176.35 176.16 1o5p s THR 68 N -3.85 4.70 -0.01 5.49 -4.23 -1.20 0.28 115.64 116.82 1o5p s THR 68 Ca 0.34 -0.06 0.04 0.00 -1.18 0.00 0.00 61.69 60.84 1o5p s THR 68 Cb 0.07 -3.15 -0.01 0.00 1.34 0.00 0.00 72.50 70.75 1o5p s THR 68 CO 0.10 0.41 -0.14 0.68 -0.54 0.00 0.00 174.62 175.13 1o5p s VAL 69 N 0.85 1.09 0.00 2.29 -7.23 -0.92 -4.23 120.40 112.24 1o5p s VAL 69 Ca 0.04 -0.59 0.00 0.00 -1.81 0.00 0.00 61.98 59.62 1o5p s VAL 69 Cb -0.14 -0.90 0.00 0.00 0.56 0.00 0.00 36.38 35.90 1o5p s VAL 69 CO 0.02 0.31 0.00 0.54 -0.31 0.00 0.00 175.10 175.66 1o5p n ARG 70 N 2.74 1.64 0.00 4.82 1.74 -1.26 -4.34 116.66 122.00 1o5p n ARG 70 Ca -0.14 0.00 0.00 0.00 -0.77 0.00 0.00 57.85 56.94 1o5p n ARG 70 Cb 0.55 0.00 0.00 0.00 -1.02 0.00 0.00 32.46 31.99 1o5p n ARG 70 CO 0.00 0.00 0.00 0.54 -1.52 0.00 0.00 177.63 176.65 1o5p n ARG 71 N 0.00 0.00 -2.38 5.56 1.74 -1.26 -4.74 116.66 115.58 1o5p n ARG 71 Ca 0.00 0.21 -0.41 0.00 -0.77 0.00 0.00 57.85 56.89 1o5p n ARG 71 Cb 0.00 -0.75 -0.04 0.00 -1.02 0.00 0.00 32.46 30.65 1o5p n ARG 71 CO 0.00 0.00 0.00 -1.54 -1.52 0.00 0.00 177.63 174.57 1o5p s SER 72 N -1.87 7.11 -0.24 0.55 1.04 -1.26 0.35 113.70 119.38 1o5p s SER 72 Ca 0.00 2.29 -0.19 0.00 0.48 0.00 0.00 55.95 58.53 1o5p s SER 72 Cb 0.00 -2.62 0.07 0.00 0.10 0.00 0.00 66.02 63.57 1o5p s SER 72 CO 0.00 -0.32 0.63 0.72 0.98 0.00 0.00 173.24 175.25 1o5p s PHE 73 N -0.50 -0.81 -0.31 5.02 -0.71 -0.76 -4.86 117.98 115.05 1o5p s PHE 73 Ca 0.50 1.79 -0.34 0.00 -1.04 0.00 0.00 56.93 57.84 1o5p s PHE 73 Cb -0.33 0.37 -0.15 0.00 -1.21 0.00 0.00 43.02 41.70 1o5p s PHE 73 CO 0.40 -0.40 1.12 0.39 -1.34 0.00 0.00 175.22 175.38 1o5p n GLU 74 N 3.44 0.00 -1.25 1.99 -0.58 -1.26 -1.54 120.64 121.44 1o5p n GLU 74 Ca -0.17 0.00 -0.21 0.00 -0.42 0.00 0.00 57.16 56.36 1o5p n GLU 74 Cb 0.57 -1.11 -0.06 0.00 -0.57 0.00 0.00 31.44 30.26 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 2.66 3.94 3.36 0.62 0.00 -0.30 -3.22 105.19 112.25 1o5p n GLY 75 Ca 0.22 -1.54 -0.62 0.00 0.00 0.00 0.00 46.02 44.08 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 1.16 1.32 -3.04 1.61 3.01 -0.45 -2.17 117.46 118.91 1o5p n PHE 76 Ca 0.43 0.87 -0.40 0.00 1.01 0.00 0.00 57.45 59.36 1o5p n PHE 76 Cb 0.63 -2.25 -0.05 0.00 -0.01 0.00 0.00 39.48 37.81 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 5.05 4.23 -0.27 4.37 2.96 -0.75 -1.97 118.68 132.30 1o5p s LEU 77 Ca 1.14 1.07 -0.02 0.00 -0.22 0.00 0.00 54.13 56.10 1o5p s LEU 77 Cb -1.48 -3.05 -0.02 0.00 0.50 0.00 0.00 46.19 42.14 1o5p s LEU 77 CO 0.70 -0.22 1.35 0.33 -1.32 0.00 0.00 176.35 177.19 1o5p n PHE 78 N 4.48 0.40 -1.99 5.38 7.35 -1.23 -2.89 117.46 128.96 1o5p n PHE 78 Ca -0.00 -0.90 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 -0.25 -0.76 0.00 0.00 176.76 175.75 1o5p n ASP 79 N 4.42 0.00 0.00 -2.13 9.92 -1.26 -4.98 116.55 122.51 1o5p n ASP 79 Ca 0.15 -0.99 0.00 0.00 -0.53 0.00 0.00 54.79 53.42 1o5p n ASP 79 Cb 0.07 0.00 0.00 0.00 -0.64 0.00 0.00 41.12 40.55 1o5p n ASP 79 CO 0.00 0.00 0.00 0.61 0.13 0.00 0.00 177.20 177.94 1o5p n GLY 80 N 0.00 2.82 3.94 0.44 0.00 -1.14 -4.99 105.19 106.26 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 -1.08 5.10 -0.14 2.61 -4.23 -1.26 -4.97 115.64 111.67 1o5p s THR 81 Ca 0.00 -0.44 -0.05 0.00 -1.18 0.00 0.00 61.69 60.03 1o5p s THR 81 Cb 0.00 -3.86 -0.03 0.00 1.34 0.00 0.00 72.50 69.94 1o5p s THR 81 CO 0.00 -0.57 0.02 0.00 -0.54 0.00 0.00 174.62 173.53 1o5p s ARG 82 N -4.34 3.58 0.41 3.99 1.70 -1.26 -1.81 118.95 121.22 1o5p s ARG 82 Ca 0.40 -0.40 0.23 0.00 -0.47 0.00 0.00 55.73 55.49 1o5p s ARG 82 Cb -0.10 -3.01 0.29 0.00 -0.57 0.00 0.00 34.95 31.57 1o5p s ARG 82 CO 0.36 0.42 1.55 2.35 -1.08 0.00 0.00 175.30 178.90 1o5p h TRP 83 N 6.16 0.00 0.00 5.89 7.01 -1.76 -3.46 115.95 129.79 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 0.03 0.00 0.41 -2.79 0.00 0.00 178.44 176.67 1o5p n GLY 84 N 1.11 1.58 3.60 2.65 0.00 -1.26 -4.92 105.19 107.96 1o5p n GLY 84 Ca 0.03 -2.17 -0.43 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 -1.58 3.18 -0.61 2.61 -4.23 -1.26 -1.15 115.64 112.61 1o5p s THR 85 Ca 0.00 0.19 -0.26 0.00 -1.18 0.00 0.00 61.69 60.43 1o5p s THR 85 Cb 0.00 -3.25 0.04 0.00 1.34 0.00 0.00 72.50 70.63 1o5p s THR 85 CO 0.00 -0.16 1.12 -0.69 -0.54 0.00 0.00 174.62 174.36 1o5p s VAL 86 N 7.78 4.08 -0.29 2.29 1.01 -0.59 -4.75 120.40 129.94 1o5p s VAL 86 Ca 0.93 0.55 -0.28 0.00 0.00 0.00 0.00 61.98 63.17 1o5p s VAL 86 Cb -0.29 -4.71 -0.03 0.00 0.00 0.00 0.00 36.38 31.35 1o5p s VAL 86 CO 0.35 -1.39 1.82 -1.81 0.00 0.00 0.00 175.10 174.07 1o5p s ASP 87 N 3.13 5.94 0.00 3.32 1.11 -1.26 -1.83 116.67 127.08 1o5p s ASP 87 Ca 0.37 1.47 0.06 0.00 0.18 0.00 0.00 52.55 54.63 1o5p s ASP 87 Cb -0.10 -2.53 0.32 0.00 1.07 0.00 0.00 42.92 41.68 1o5p s ASP 87 CO 0.21 -1.64 1.03 0.00 1.18 0.00 0.00 175.17 175.94 1o5p n THR 89 N -1.26 0.07 -0.02 0.00 -2.24 -1.26 -4.15 114.28 105.42 1o5p n THR 89 Ca 0.03 -0.20 -0.04 0.00 -2.27 0.00 0.00 64.05 61.57 1o5p n THR 89 Cb 0.05 0.17 -0.01 0.00 -2.10 0.00 0.00 70.33 68.43 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 -0.12 0.34 -3.26 4.28 -2.24 -0.12 -5.07 114.28 108.08 1o5p n THR 90 Ca 0.18 -0.01 -0.22 0.00 -2.27 0.00 0.00 64.05 61.74 1o5p n THR 90 Cb 0.26 -1.57 0.05 0.00 -2.10 0.00 0.00 70.33 66.97 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 -3.24 1.16 -2.91 6.98 0.00 -1.17 -5.09 120.51 116.25 1o5p n ALA 91 Ca -0.07 -2.18 -0.38 0.00 0.00 0.00 0.00 53.44 50.80 1o5p n ALA 91 Cb 0.50 0.68 -0.12 0.00 0.00 0.00 0.00 19.45 20.51 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 -2.74 3.25 -0.25 0.00 0.00 -1.26 -4.72 121.76 116.04 1o5p s ALA 92 Ca 0.54 -1.41 -0.14 0.00 0.00 0.00 0.00 51.96 50.96 1o5p s ALA 92 Cb -0.04 -2.36 -0.04 0.00 0.00 0.00 0.00 23.12 20.67 1o5p s ALA 92 CO 0.35 -0.93 0.31 0.00 0.00 0.00 0.00 175.76 175.49 1o5p s GLN 94 N 1.64 3.29 -0.38 0.00 -0.21 -0.60 -2.46 119.66 120.94 1o5p s GLN 94 Ca 0.13 -0.37 -0.12 0.00 0.02 0.00 0.00 55.36 55.02 1o5p s GLN 94 Cb -0.15 -3.01 0.02 0.00 1.00 0.00 0.00 33.01 30.87 1o5p s GLN 94 CO 0.09 0.67 0.24 0.08 -2.12 0.00 0.00 175.29 174.25 1o5p s VAL 95 N -1.25 4.85 0.00 1.09 1.01 0.13 -2.28 120.40 123.95 1o5p s VAL 95 Ca 0.25 -0.74 0.00 0.00 0.00 0.00 0.00 61.98 61.48 1o5p s VAL 95 Cb -0.12 -3.69 0.00 0.00 0.00 0.00 0.00 36.38 32.57 1o5p s VAL 95 CO 0.16 -0.24 0.00 0.61 0.00 0.00 0.00 175.10 175.63 1o5p n GLY 96 N 5.06 2.73 3.74 4.51 0.00 -1.07 0.27 105.19 120.43 1o5p n GLY 96 Ca -0.12 -1.22 -0.32 0.00 0.00 0.00 0.00 46.02 44.36 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 2.39 0.14 0.99 1.02 -1.23 -2.15 118.68 119.83 1o5p s LEU 97 Ca 0.00 -1.61 -0.25 0.00 0.02 0.00 0.00 54.13 52.29 1o5p s LEU 97 Cb 0.00 -0.76 0.08 0.00 0.02 0.00 0.00 46.19 45.53 1o5p s LEU 97 CO 0.00 -0.79 1.05 -0.55 0.02 0.00 0.00 176.35 176.08 1o5p s SER 98 N -3.85 -0.09 0.00 2.29 0.15 -0.44 -4.16 113.70 107.60 1o5p s SER 98 Ca 0.10 -0.46 0.00 0.00 0.70 0.00 0.00 55.95 56.30 1o5p s SER 98 Cb 0.03 0.43 0.00 0.00 -1.71 0.00 0.00 66.02 64.77 1o5p s SER 98 CO 0.05 -0.83 0.00 -0.90 1.20 0.00 0.00 173.24 172.77 1o5p n ASP 99 N -0.76 1.59 -1.62 5.45 5.75 -1.23 0.16 116.55 125.88 1o5p n ASP 99 Ca -0.05 0.00 -0.16 0.00 -0.01 0.00 0.00 54.79 54.57 1o5p n ASP 99 Cb 0.60 0.00 0.09 0.00 -1.03 0.00 0.00 41.12 40.79 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 4.76 -0.03 2.12 0.00 -1.26 -4.62 120.51 118.48 1o5p n ALA 100 Ca 0.00 -3.57 -0.03 0.00 0.00 0.00 0.00 53.44 49.84 1o5p n ALA 100 Cb 0.00 -0.52 -0.04 0.00 0.00 0.00 0.00 19.45 18.90 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 -0.88 1.88 0.00 0.00 0.00 -1.26 -5.01 120.51 115.24 1o5p n ALA 101 Ca 0.39 -0.31 0.00 0.00 0.00 0.00 0.00 53.44 53.52 1o5p n ALA 101 Cb 0.89 0.20 0.00 0.00 0.00 0.00 0.00 19.45 20.54 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 2.83 1.06 3.07 0.00 0.00 -1.26 -5.14 105.19 105.75 1o5p n GLY 102 Ca -0.09 -0.07 -0.07 0.00 0.00 0.00 0.00 46.02 45.79 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 -1.87 -0.13 1.61 5.03 -1.26 -5.00 115.26 113.64 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 1.96 2.93 7.41 0.00 -1.26 -3.58 105.19 112.20 1o5p n GLY 104 Ca -0.07 -0.72 -0.12 0.00 0.00 0.00 0.00 46.02 45.11 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 -1.81 -0.94 1.61 -0.02 -1.26 -4.92 135.00 127.66 1o5p n PRO 105 Ca 0.00 -0.54 -0.02 0.00 -2.02 0.00 0.00 63.50 60.92 1o5p n PRO 105 Cb 0.00 -1.34 0.01 0.00 -0.02 0.00 0.00 33.50 32.15 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 -0.88 0.73 -4.43 -0.52 0.28 -1.26 -4.67 120.64 109.88 1o5p n GLU 106 Ca 0.05 -0.24 -0.21 0.00 -0.16 0.00 0.00 57.16 56.59 1o5p n GLU 106 Cb 0.23 -0.04 -0.10 0.00 1.43 0.00 0.00 31.44 32.96 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 -2.45 1.83 -0.20 -1.84 0.00 -1.26 -3.57 107.32 99.84 1o5p s GLY 107 Ca 0.05 -1.90 -0.12 0.00 0.00 0.00 0.00 44.72 42.76 1o5p s GLY 107 CO 0.04 -1.85 0.20 0.14 0.00 0.00 0.00 173.10 171.63 1o5p s VAL 108 N -2.98 5.36 -0.12 1.40 1.01 0.14 -4.71 120.40 120.49 1o5p s VAL 108 Ca 0.29 0.32 -0.29 0.00 0.00 0.00 0.00 61.98 62.30 1o5p s VAL 108 Cb 0.03 -3.54 -0.03 0.00 0.00 0.00 0.00 36.38 32.85 1o5p s VAL 108 CO 0.12 0.39 1.33 0.00 0.00 0.00 0.00 175.10 176.94 1o5p s ALA 109 N 0.62 3.63 0.42 5.51 0.00 -1.26 0.18 121.76 130.87 1o5p s ALA 109 Ca 0.11 0.58 0.06 0.00 0.00 0.00 0.00 51.96 52.71 1o5p s ALA 109 Cb -0.12 -3.63 0.01 0.00 0.00 0.00 0.00 23.12 19.38 1o5p s ALA 109 CO 0.02 -1.15 0.59 0.96 0.00 0.00 0.00 175.76 176.18 1o5p s ILE 110 N 3.38 3.34 0.10 0.00 -4.36 -1.03 -4.81 121.20 117.81 1o5p s ILE 110 Ca 0.59 -0.88 0.02 0.00 -0.26 0.00 0.00 60.65 60.12 1o5p s ILE 110 Cb -0.25 -3.16 -0.04 0.00 1.25 0.00 0.00 42.46 40.26 1o5p s ILE 110 CO 0.19 -0.08 -0.08 -0.44 0.24 0.00 0.00 174.94 174.77 1o5p s SER 111 N -4.30 1.23 -0.10 4.36 0.01 0.19 -4.67 113.70 110.42 1o5p s SER 111 Ca 0.52 -0.95 -0.01 0.00 1.31 0.00 0.00 55.95 56.83 1o5p s SER 111 Cb -0.10 0.07 0.03 0.00 0.21 0.00 0.00 66.02 66.22 1o5p s SER 111 CO 0.34 -0.40 -0.04 -0.36 0.41 0.00 0.00 173.24 173.19 1o5p s PHE 112 N -3.26 1.11 -1.64 2.43 0.08 -1.26 -2.87 117.98 112.57 1o5p s PHE 112 Ca 0.10 -0.50 0.00 0.00 0.12 0.00 0.00 56.93 56.65 1o5p s PHE 112 Cb 0.03 -1.04 0.00 0.00 -0.57 0.00 0.00 43.02 41.44 1o5p s PHE 112 CO -0.03 -0.44 0.41 0.27 -0.10 0.00 0.00 175.22 175.33