#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 3.45 0.86 0.00 0.00 -1.26 -5.00 121.76 119.81 1o5p s ALA 2 Ca 0.00 -1.99 -0.12 0.00 0.00 0.00 0.00 51.96 49.85 1o5p s ALA 2 Cb 0.00 -0.47 0.11 0.00 0.00 0.00 0.00 23.12 22.76 1o5p s ALA 2 CO 0.00 -0.05 1.18 -2.14 0.00 0.00 0.00 175.76 174.75 1o5p s PRO 3 N -3.83 1.32 0.13 0.00 0.02 -0.33 -4.30 135.00 128.00 1o5p s PRO 3 Ca 0.38 1.67 -0.24 0.00 0.02 0.00 0.00 61.00 62.83 1o5p s PRO 3 Cb 0.01 -1.75 0.08 0.00 0.02 0.00 0.00 34.50 32.86 1o5p s PRO 3 CO 0.22 -2.43 0.67 0.95 -0.33 0.00 0.00 177.00 176.07 1o5p s THR 4 N -2.38 0.00 -0.16 0.99 -4.23 1.01 -4.85 115.64 106.03 1o5p s THR 4 Ca 0.70 -0.04 -0.06 0.00 -1.18 0.00 0.00 61.69 61.11 1o5p s THR 4 Cb -0.26 -1.04 0.07 0.00 1.34 0.00 0.00 72.50 72.61 1o5p s THR 4 CO 0.54 0.00 0.34 0.00 -0.54 0.00 0.00 174.62 174.96 1o5p s ALA 5 N -3.62 -0.85 -0.31 3.99 0.00 -1.26 0.27 121.76 119.99 1o5p s ALA 5 Ca 0.02 1.24 -0.02 0.00 0.00 0.00 0.00 51.96 53.20 1o5p s ALA 5 Cb -0.01 -1.07 0.05 0.00 0.00 0.00 0.00 23.12 22.10 1o5p s ALA 5 CO -0.11 -0.57 0.01 -0.08 0.00 0.00 0.00 175.76 175.01 1o5p s THR 6 N 2.19 2.99 -0.06 0.00 -1.32 -0.27 -4.86 115.64 114.30 1o5p s THR 6 Ca -0.03 -1.45 0.04 0.00 -1.21 0.00 0.00 61.69 59.05 1o5p s THR 6 Cb -0.11 -2.75 -0.02 0.00 -1.51 0.00 0.00 72.50 68.11 1o5p s THR 6 CO -0.11 -0.16 -0.20 -0.69 -2.21 0.00 0.00 174.62 171.26 1o5p s VAL 7 N 1.24 2.52 -0.21 5.08 1.01 -1.26 -0.38 120.40 128.40 1o5p s VAL 7 Ca -0.04 -0.90 -0.30 0.00 0.00 0.00 0.00 61.98 60.74 1o5p s VAL 7 Cb -0.20 -1.96 0.15 0.00 0.00 0.00 0.00 36.38 34.37 1o5p s VAL 7 CO -0.01 0.57 1.15 -0.89 0.00 0.00 0.00 175.10 175.91 1o5p s THR 8 N -0.27 0.00 0.46 3.92 2.01 -0.35 -4.49 115.64 116.91 1o5p s THR 8 Ca 0.00 0.00 -0.20 0.00 0.31 0.00 0.00 61.69 61.80 1o5p s THR 8 Cb -0.13 -1.00 -0.10 0.00 0.01 0.00 0.00 72.50 71.28 1o5p s THR 8 CO 0.03 0.00 0.98 -2.16 -0.69 0.00 0.00 174.62 172.78 1o5p s PRO 9 N -1.19 4.05 0.07 4.92 0.05 -1.26 -0.74 135.00 140.89 1o5p s PRO 9 Ca 0.03 1.19 0.17 0.00 0.05 0.00 0.00 61.00 62.44 1o5p s PRO 9 Cb -0.01 -2.15 -0.13 0.00 0.05 0.00 0.00 34.50 32.27 1o5p s PRO 9 CO -0.03 -0.20 0.84 -1.13 0.05 0.00 0.00 177.00 176.53 1o5p n SER 10 N -0.85 0.87 -4.25 6.66 3.41 -1.26 -4.78 113.62 113.43 1o5p n SER 10 Ca 0.08 0.38 -0.14 0.00 -0.26 0.00 0.00 58.87 58.93 1o5p n SER 10 Cb 0.53 0.15 -0.10 0.00 -0.26 0.00 0.00 64.21 64.53 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 -5.78 1.54 -0.16 4.04 0.01 -1.26 0.46 113.70 112.55 1o5p s SER 11 Ca -0.03 -1.09 -0.01 0.00 1.31 0.00 0.00 55.95 56.14 1o5p s SER 11 Cb 0.09 0.04 0.00 0.00 0.21 0.00 0.00 66.02 66.36 1o5p s SER 11 CO 0.81 -0.45 0.09 0.61 0.41 0.00 0.00 173.24 174.71 1o5p n GLY 12 N -0.22 0.65 0.13 3.44 0.00 -1.15 -4.90 105.19 103.14 1o5p n GLY 12 Ca -0.09 -0.64 -0.21 0.00 0.00 0.00 0.00 46.02 45.08 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 -0.80 2.52 -0.94 0.99 4.77 -1.26 -5.06 117.00 117.22 1o5p n LEU 13 Ca -0.01 0.20 0.00 0.00 -0.03 0.00 0.00 56.01 56.17 1o5p n LEU 13 Cb 0.51 -1.04 0.00 0.00 -2.33 0.00 0.00 43.42 40.56 1o5p n LEU 13 CO 0.06 0.75 -0.28 -0.24 -1.33 0.00 0.00 177.39 176.35 1o5p n SER 14 N -3.66 -5.37 -4.48 -1.43 2.88 -1.26 -3.84 113.62 96.47 1o5p n SER 14 Ca -0.36 0.86 -0.45 0.00 -1.33 0.00 0.00 58.87 57.59 1o5p n SER 14 Cb 0.97 -2.51 -0.08 0.00 -0.75 0.00 0.00 64.21 61.83 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 -1.33 1.72 0.00 -3.46 5.75 -1.26 -1.96 116.55 116.01 1o5p n ASP 15 Ca 0.00 0.14 0.00 0.00 -0.01 0.00 0.00 54.79 54.92 1o5p n ASP 15 Cb 0.09 -1.25 0.00 0.00 -1.03 0.00 0.00 41.12 38.93 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 6.44 1.54 0.68 6.12 0.00 -1.26 -5.06 105.19 113.65 1o5p n GLY 16 Ca 0.46 0.00 -0.04 0.00 0.00 0.00 0.00 46.02 46.44 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 -0.41 0.00 -4.63 2.61 5.66 -0.83 -4.96 114.28 111.72 1o5p n THR 17 Ca 0.00 -0.36 -0.22 0.00 -3.05 0.00 0.00 64.05 60.41 1o5p n THR 17 Cb 0.00 -0.69 -0.15 0.00 -1.55 0.00 0.00 70.33 67.94 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 -0.02 1.10 0.19 1.08 1.01 -1.26 -1.99 120.40 120.51 1o5p s VAL 18 Ca 0.08 -0.58 0.09 0.00 0.00 0.00 0.00 61.98 61.57 1o5p s VAL 18 Cb -0.01 -0.92 -0.04 0.00 0.00 0.00 0.00 36.38 35.41 1o5p s VAL 18 CO 0.05 0.31 -0.08 0.68 0.00 0.00 0.00 175.10 176.07 1o5p s VAL 19 N -0.23 3.24 -0.35 2.92 -7.23 0.17 -4.75 120.40 114.17 1o5p s VAL 19 Ca 0.03 -1.70 -0.07 0.00 -1.81 0.00 0.00 61.98 58.43 1o5p s VAL 19 Cb -0.06 -2.63 0.04 0.00 0.56 0.00 0.00 36.38 34.29 1o5p s VAL 19 CO -0.00 -0.16 0.13 -0.54 -0.31 0.00 0.00 175.10 174.22 1o5p s LYS 20 N -2.98 2.63 -0.10 4.82 1.02 0.08 -1.07 119.74 124.16 1o5p s LYS 20 Ca 0.26 -1.19 -0.05 0.00 0.02 0.00 0.00 55.97 55.01 1o5p s LYS 20 Cb -0.08 -3.51 -0.04 0.00 -0.52 0.00 0.00 37.83 33.68 1o5p s LYS 20 CO 0.16 -0.69 0.10 0.54 -0.92 0.00 0.00 175.35 174.54 1o5p s VAL 21 N 1.42 5.09 0.11 3.17 0.11 -0.87 -1.22 120.40 128.22 1o5p s VAL 21 Ca -0.01 0.01 0.01 0.00 -2.93 0.00 0.00 61.98 59.06 1o5p s VAL 21 Cb -0.20 -3.22 -0.04 0.00 -1.53 0.00 0.00 36.38 31.39 1o5p s VAL 21 CO 0.03 0.58 -0.02 0.00 -3.33 0.00 0.00 175.10 172.36 1o5p s ALA 22 N -1.02 0.92 0.00 1.54 0.00 0.49 -1.35 121.76 122.34 1o5p s ALA 22 Ca 0.16 -1.38 0.02 0.00 0.00 0.00 0.00 51.96 50.76 1o5p s ALA 22 Cb -0.12 0.37 -0.01 0.00 0.00 0.00 0.00 23.12 23.36 1o5p s ALA 22 CO 0.05 -0.32 -0.07 0.20 0.00 0.00 0.00 175.76 175.62 1o5p s GLY 23 N -3.04 0.34 -0.07 0.00 0.00 0.28 -1.12 107.32 103.71 1o5p s GLY 23 Ca 0.15 -0.36 -0.03 0.00 0.00 0.00 0.00 44.72 44.48 1o5p s GLY 23 CO -0.03 -0.33 0.15 0.00 0.00 0.00 0.00 173.10 172.89 1o5p s ALA 24 N -0.36 -0.18 0.00 3.20 0.00 0.75 0.17 121.76 125.33 1o5p s ALA 24 Ca 0.00 0.59 0.00 0.00 0.00 0.00 0.00 51.96 52.56 1o5p s ALA 24 Cb -0.04 -0.64 0.00 0.00 0.00 0.00 0.00 23.12 22.45 1o5p s ALA 24 CO -0.00 -0.37 0.00 0.41 0.00 0.00 0.00 175.76 175.80 1o5p n GLY 25 N 4.80 1.06 3.97 0.00 0.00 -1.03 0.33 105.19 114.32 1o5p n GLY 25 Ca -0.15 -0.50 -0.24 0.00 0.00 0.00 0.00 46.02 45.13 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 2.96 -0.81 0.99 1.43 -0.56 -1.18 118.68 121.51 1o5p s LEU 26 Ca 0.00 -0.08 -0.29 0.00 -1.03 0.00 0.00 54.13 52.72 1o5p s LEU 26 Cb 0.00 -2.35 -0.16 0.00 0.03 0.00 0.00 46.19 43.70 1o5p s LEU 26 CO 0.00 -1.82 2.59 0.00 0.23 0.00 0.00 176.35 177.35 1o5p n GLN 27 N -2.90 0.39 -1.27 1.70 3.00 -1.26 -4.09 117.38 112.95 1o5p n GLN 27 Ca 0.13 -0.01 -0.19 0.00 -0.01 0.00 0.00 57.00 56.92 1o5p n GLN 27 Cb 0.60 -2.24 -0.10 0.00 0.00 0.00 0.00 30.24 28.49 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 12.59 0.35 0.00 -1.58 0.00 -1.25 -1.23 120.51 129.38 1o5p n ALA 28 Ca 0.55 -2.15 0.00 0.00 0.00 0.00 0.00 53.44 51.84 1o5p n ALA 28 Cb 0.23 -3.04 0.00 0.00 0.00 0.00 0.00 19.45 16.64 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 5.64 0.32 2.59 0.00 0.00 1.02 -4.82 105.19 109.95 1o5p n GLY 29 Ca 0.37 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 -0.40 -0.03 -0.36 2.61 -4.23 -0.37 -4.88 115.64 107.98 1o5p s THR 30 Ca 0.00 -0.45 -0.35 0.00 -1.18 0.00 0.00 61.69 59.70 1o5p s THR 30 Cb 0.00 -0.78 -0.12 0.00 1.34 0.00 0.00 72.50 72.94 1o5p s THR 30 CO 0.00 -0.47 2.20 0.00 -0.54 0.00 0.00 174.62 175.80 1o5p n ALA 31 N 5.25 1.03 -2.85 3.99 0.00 -1.26 -2.73 120.51 123.94 1o5p n ALA 31 Ca -0.07 -0.06 -0.23 0.00 0.00 0.00 0.00 53.44 53.09 1o5p n ALA 31 Cb 0.46 -2.53 -0.04 0.00 0.00 0.00 0.00 19.45 17.34 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 3.20 0.20 0.00 1.51 0.14 -4.19 117.35 125.54 1o5p s TYR 32 Ca 1.10 -0.07 0.05 0.00 -1.01 0.00 0.00 57.07 57.14 1o5p s TYR 32 Cb -0.89 -1.46 -0.03 0.00 -0.11 0.00 0.00 41.96 39.47 1o5p s TYR 32 CO 0.50 0.51 0.28 -0.51 -1.11 0.00 0.00 175.55 175.21 1o5p s ASP 33 N -3.73 6.10 -0.19 2.29 1.11 0.72 -1.64 116.67 121.33 1o5p s ASP 33 Ca 0.33 0.03 -0.04 0.00 0.18 0.00 0.00 52.55 53.05 1o5p s ASP 33 Cb -0.09 -1.75 0.06 0.00 1.07 0.00 0.00 42.92 42.21 1o5p s ASP 33 CO 0.26 -0.01 0.06 -0.69 1.18 0.00 0.00 175.17 175.97 1o5p s VAL 34 N -1.90 0.27 0.10 -1.27 1.01 -0.91 -0.89 120.40 116.81 1o5p s VAL 34 Ca 0.34 -0.41 -0.08 0.00 0.00 0.00 0.00 61.98 61.83 1o5p s VAL 34 Cb -0.10 -0.85 0.03 0.00 0.00 0.00 0.00 36.38 35.46 1o5p s VAL 34 CO 0.27 -0.25 0.40 0.61 0.00 0.00 0.00 175.10 176.13 1o5p n GLY 35 N 5.14 1.16 3.41 4.51 0.00 -0.91 0.36 105.19 118.85 1o5p n GLY 35 Ca -0.08 -1.04 -0.42 0.00 0.00 0.00 0.00 46.02 44.48 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 2.89 0.06 1.61 -2.07 -1.26 -2.49 119.66 116.37 1o5p s GLN 36 Ca 0.09 -1.11 0.05 0.00 -1.82 0.00 0.00 55.36 52.56 1o5p s GLN 36 Cb -0.01 -3.89 -0.03 0.00 -1.09 0.00 0.00 33.01 27.98 1o5p s GLN 36 CO 0.03 -0.78 -0.14 0.00 -1.32 0.00 0.00 175.29 173.08 1o5p s ALA 38 N -1.15 1.80 -0.35 0.00 0.00 -0.84 -1.75 121.76 119.48 1o5p s ALA 38 Ca -0.01 -0.91 -0.17 0.00 0.00 0.00 0.00 51.96 50.87 1o5p s ALA 38 Cb -0.09 -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 0.44 -1.58 0.00 0.00 0.00 175.76 175.05 1o5p s TRP 39 N -0.38 3.20 -0.88 0.00 0.51 -1.26 -1.89 118.94 118.24 1o5p s TRP 39 Ca 0.05 0.07 0.16 0.00 -2.12 0.00 0.00 56.10 54.27 1o5p s TRP 39 Cb -0.09 -2.80 0.60 0.00 -0.81 0.00 0.00 33.47 30.37 1o5p s TRP 39 CO 0.00 -0.49 1.51 1.33 -0.51 0.00 0.00 176.95 178.80 1o5p n VAL 40 N 5.33 1.77 -1.60 4.03 0.24 -0.90 -4.75 118.33 122.45 1o5p n VAL 40 Ca -0.07 -1.30 0.00 0.00 -2.04 0.00 0.00 64.34 60.93 1o5p n VAL 40 Cb 0.49 0.12 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 0.65 0.00 -4.55 -1.34 8.00 -1.26 -4.95 116.55 113.10 1o5p n ASP 41 Ca 0.22 0.00 -0.37 0.00 0.71 0.00 0.00 54.79 55.34 1o5p n ASP 41 Cb 0.80 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 0.42 -0.39 0.00 0.00 177.20 177.23 1o5p s THR 42 N -2.49 3.47 0.00 -3.53 -4.23 -1.26 -2.92 115.64 104.68 1o5p s THR 42 Ca 0.00 0.12 0.00 0.00 -1.18 0.00 0.00 61.69 60.63 1o5p s THR 42 Cb 0.00 -4.21 0.00 0.00 1.34 0.00 0.00 72.50 69.63 1o5p s THR 42 CO 0.00 -1.17 0.00 0.61 -0.54 0.00 0.00 174.62 173.52 1o5p n GLY 43 N 5.85 0.73 3.09 3.99 0.00 -1.26 -5.05 105.19 112.55 1o5p n GLY 43 Ca 0.20 -0.70 -0.33 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 2.58 -0.32 1.61 1.01 -1.15 -4.97 120.40 117.16 1o5p s VAL 44 Ca 0.00 -1.79 0.02 0.00 0.00 0.00 0.00 61.98 60.20 1o5p s VAL 44 Cb 0.00 -2.64 0.08 0.00 0.00 0.00 0.00 36.38 33.83 1o5p s VAL 44 CO 0.00 -0.28 0.02 -0.22 0.00 0.00 0.00 175.10 174.62 1o5p s LEU 45 N 1.10 4.33 -0.43 3.92 2.96 -1.26 -2.12 118.68 127.18 1o5p s LEU 45 Ca -0.01 -1.78 -0.16 0.00 -0.22 0.00 0.00 54.13 51.96 1o5p s LEU 45 Cb -0.20 -1.65 0.03 0.00 0.50 0.00 0.00 46.19 44.86 1o5p s LEU 45 CO -0.04 -0.33 0.39 0.00 -1.32 0.00 0.00 176.35 175.04 1o5p s ALA 46 N 1.05 3.46 0.31 5.97 0.00 -0.79 -3.35 121.76 128.41 1o5p s ALA 46 Ca 0.02 -1.66 0.07 0.00 0.00 0.00 0.00 51.96 50.39 1o5p s ALA 46 Cb -0.20 -3.00 -0.03 0.00 0.00 0.00 0.00 23.12 19.89 1o5p s ALA 46 CO -0.05 -1.57 0.26 0.00 0.00 0.00 0.00 175.76 174.40 1o5p s ASN 48 N -3.95 5.24 0.00 0.00 2.47 -0.91 -0.31 114.94 117.48 1o5p s ASN 48 Ca 0.38 0.02 0.00 0.00 0.42 0.00 0.00 52.86 53.69 1o5p s ASN 48 Cb -0.06 -1.79 0.00 0.00 -1.45 0.00 0.00 41.25 37.95 1o5p s ASN 48 CO 0.26 0.22 0.32 -0.81 -3.72 0.00 0.00 177.10 173.38 1o5p n PRO 49 N 3.20 0.61 -0.07 0.43 -0.05 -1.26 -2.79 135.00 135.07 1o5p n PRO 49 Ca -0.17 0.00 0.05 0.00 -0.05 0.00 0.00 63.50 63.33 1o5p n PRO 49 Cb 0.53 -1.29 0.09 0.00 -0.05 0.00 0.00 33.50 32.78 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 0.15 2.35 -1.90 0.55 0.00 -1.26 -4.37 120.51 116.03 1o5p n ALA 50 Ca 0.00 -0.81 0.02 0.00 0.00 0.00 0.00 53.44 52.64 1o5p n ALA 50 Cb 0.14 -0.38 0.02 0.00 0.00 0.00 0.00 19.45 19.24 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 0.54 0.40 -4.55 0.00 5.75 -1.12 -2.55 116.55 115.02 1o5p n ASP 51 Ca 0.08 -2.17 -0.42 0.00 -0.01 0.00 0.00 54.79 52.27 1o5p n ASP 51 Cb 0.33 -0.24 -0.02 0.00 -1.03 0.00 0.00 41.12 40.16 1o5p n ASP 51 CO 0.00 0.00 0.00 -0.36 -0.11 0.00 0.00 177.20 176.73 1o5p s PHE 52 N -0.42 2.73 0.06 2.11 0.40 -1.25 -2.91 117.98 118.69 1o5p s PHE 52 Ca 0.07 -1.24 0.01 0.00 -0.60 0.00 0.00 56.93 55.16 1o5p s PHE 52 Cb 0.07 -4.66 0.01 0.00 0.51 0.00 0.00 43.02 38.95 1o5p s PHE 52 CO -0.01 -1.82 0.09 0.45 0.70 0.00 0.00 175.22 174.63 1o5p n SER 53 N 8.33 0.21 0.00 1.36 2.88 0.16 -4.90 113.62 121.65 1o5p n SER 53 Ca 0.38 -1.16 0.00 0.00 -1.33 0.00 0.00 58.87 56.77 1o5p n SER 53 Cb 0.49 -0.05 0.00 0.00 -0.75 0.00 0.00 64.21 63.90 1o5p n SER 53 CO 0.00 0.00 0.00 -0.24 -1.23 0.00 0.00 175.04 173.57 1o5p n SER 54 N -2.94 0.00 -3.53 -3.46 2.88 -1.26 -2.13 113.62 103.17 1o5p n SER 54 Ca 0.02 0.00 -0.15 0.00 -1.33 0.00 0.00 58.87 57.41 1o5p n SER 54 Cb 0.06 0.00 -0.05 0.00 -0.75 0.00 0.00 64.21 63.47 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 -0.46 0.01 -0.09 2.46 0.11 -0.65 -4.97 120.40 116.82 1o5p s VAL 55 Ca 0.00 -0.12 -0.09 0.00 -2.93 0.00 0.00 61.98 58.84 1o5p s VAL 55 Cb 0.00 -0.97 -0.04 0.00 -1.53 0.00 0.00 36.38 33.83 1o5p s VAL 55 CO 0.00 -0.06 0.21 -0.89 -3.33 0.00 0.00 175.10 171.03 1o5p s THR 56 N -2.13 5.39 -0.35 5.04 2.01 -1.26 0.24 115.64 124.57 1o5p s THR 56 Ca -0.07 0.37 -0.27 0.00 0.31 0.00 0.00 61.69 62.03 1o5p s THR 56 Cb -0.01 -3.48 -0.05 0.00 0.01 0.00 0.00 72.50 68.98 1o5p s THR 56 CO 0.01 0.61 2.17 0.00 -0.69 0.00 0.00 174.62 176.72 1o5p s ALA 57 N -1.04 2.39 0.00 7.40 0.00 -1.10 -4.70 121.76 124.70 1o5p s ALA 57 Ca 0.17 0.35 0.00 0.00 0.00 0.00 0.00 51.96 52.48 1o5p s ALA 57 Cb -0.13 -4.16 0.00 0.00 0.00 0.00 0.00 23.12 18.83 1o5p s ALA 57 CO 0.06 -3.34 0.00 -3.47 0.00 0.00 0.00 175.76 169.01 1o5p n ASP 58 N 12.76 0.00 -0.08 0.00 -0.08 -1.26 0.34 116.55 128.22 1o5p n ASP 58 Ca 0.30 0.00 -0.06 0.00 -1.51 0.00 0.00 54.79 53.51 1o5p n ASP 58 Cb 0.49 0.00 -0.00 0.00 2.34 0.00 0.00 41.12 43.95 1o5p n ASP 58 CO 0.00 0.00 0.00 0.00 0.12 0.00 0.00 177.20 177.32 1o5p h ALA 59 N -2.00 0.10 0.00 -1.67 0.00 -1.92 -3.11 119.26 110.67 1o5p h ALA 59 Ca 0.00 0.12 -0.36 0.00 0.00 0.00 0.00 54.91 54.67 1o5p h ALA 59 Cb 0.00 0.37 -0.07 0.00 0.00 0.00 0.00 17.79 18.09 1o5p h ALA 59 CO 0.00 -0.54 -2.36 -1.71 0.00 0.00 0.00 179.25 174.65 1o5p n ASN 60 N -5.33 1.09 0.00 0.00 5.15 -1.26 -4.53 115.26 110.38 1o5p n ASN 60 Ca 0.01 -0.06 0.00 0.00 -0.60 0.00 0.00 54.58 53.93 1o5p n ASN 60 Cb 0.24 0.36 0.00 0.00 -0.53 0.00 0.00 39.78 39.85 1o5p n ASN 60 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 1o5p n GLY 61 N 2.05 0.77 3.73 8.20 0.00 -1.17 -1.49 105.19 117.28 1o5p n GLY 61 Ca -0.37 -0.77 -0.35 0.00 0.00 0.00 0.00 46.02 44.53 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 -1.51 6.28 -0.20 1.61 0.01 -1.25 -2.47 113.70 116.17 1o5p s SER 62 Ca 0.00 0.32 -0.04 0.00 1.31 0.00 0.00 55.95 57.54 1o5p s SER 62 Cb 0.00 -2.12 0.07 0.00 0.21 0.00 0.00 66.02 64.18 1o5p s SER 62 CO 0.00 0.17 0.08 0.00 0.41 0.00 0.00 173.24 173.89 1o5p s ALA 63 N 0.34 0.69 -0.15 1.44 0.00 0.13 -4.63 121.76 119.58 1o5p s ALA 63 Ca 0.11 -0.57 0.00 0.00 0.00 0.00 0.00 51.96 51.50 1o5p s ALA 63 Cb -0.12 -1.14 0.02 0.00 0.00 0.00 0.00 23.12 21.88 1o5p s ALA 63 CO -0.00 -1.24 -0.15 -1.12 0.00 0.00 0.00 175.76 173.25 1o5p s SER 64 N 2.02 2.70 -0.05 0.00 0.01 -1.26 0.10 113.70 117.22 1o5p s SER 64 Ca 0.02 -0.49 -0.07 0.00 1.31 0.00 0.00 55.95 56.72 1o5p s SER 64 Cb -0.16 -1.19 0.01 0.00 0.21 0.00 0.00 66.02 64.89 1o5p s SER 64 CO -0.12 -0.05 0.18 0.28 0.41 0.00 0.00 173.24 173.94 1o5p s THR 65 N 1.43 0.02 -0.14 1.44 -1.32 -0.46 -4.99 115.64 111.63 1o5p s THR 65 Ca 0.04 -0.19 -0.09 0.00 -1.21 0.00 0.00 61.69 60.24 1o5p s THR 65 Cb -0.13 -0.32 -0.04 0.00 -1.51 0.00 0.00 72.50 70.50 1o5p s THR 65 CO -0.10 -0.10 0.17 -0.94 -2.21 0.00 0.00 174.62 171.43 1o5p s SER 66 N -0.32 6.37 0.17 8.08 1.04 -1.26 -2.04 113.70 125.74 1o5p s SER 66 Ca -0.04 0.44 0.01 0.00 0.48 0.00 0.00 55.95 56.84 1o5p s SER 66 Cb -0.03 -2.10 -0.04 0.00 0.10 0.00 0.00 66.02 63.95 1o5p s SER 66 CO 0.01 0.31 0.03 -1.48 0.98 0.00 0.00 173.24 173.08 1o5p s LEU 67 N -0.50 1.97 -0.22 2.42 0.05 -0.23 -4.93 118.68 117.25 1o5p s LEU 67 Ca 0.14 -1.20 -0.14 0.00 0.05 0.00 0.00 54.13 52.98 1o5p s LEU 67 Cb -0.12 0.06 -0.04 0.00 -2.05 0.00 0.00 46.19 44.03 1o5p s LEU 67 CO 0.03 -0.63 0.29 0.42 -0.55 0.00 0.00 176.35 175.91 1o5p s THR 68 N -3.78 5.27 0.01 5.48 -4.23 -1.06 0.43 115.64 117.76 1o5p s THR 68 Ca 0.25 0.48 0.02 0.00 -1.18 0.00 0.00 61.69 61.26 1o5p s THR 68 Cb 0.07 -3.63 -0.01 0.00 1.34 0.00 0.00 72.50 70.27 1o5p s THR 68 CO 0.04 0.30 -0.05 0.68 -0.54 0.00 0.00 174.62 175.05 1o5p s VAL 69 N 1.16 0.39 0.11 2.29 -7.23 -0.84 -4.15 120.40 112.12 1o5p s VAL 69 Ca 0.14 -0.43 -0.00 0.00 -1.81 0.00 0.00 61.98 59.88 1o5p s VAL 69 Cb -0.14 -0.37 0.00 0.00 0.56 0.00 0.00 36.38 36.43 1o5p s VAL 69 CO 0.06 -0.03 0.15 -2.11 -0.31 0.00 0.00 175.10 172.86 1o5p n ARG 70 N 2.57 0.21 0.00 4.82 1.85 -1.26 -4.26 116.66 120.59 1o5p n ARG 70 Ca -0.15 -0.92 0.00 0.00 -1.00 0.00 0.00 57.85 55.78 1o5p n ARG 70 Cb 0.57 0.87 0.00 0.00 -1.05 0.00 0.00 32.46 32.85 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 -0.19 0.00 -1.72 2.89 1.85 -1.26 -4.57 116.66 113.67 1o5p n ARG 71 Ca 0.01 0.00 -0.41 0.00 -1.00 0.00 0.00 57.85 56.44 1o5p n ARG 71 Cb 0.19 0.00 0.01 0.00 -1.05 0.00 0.00 32.46 31.60 1o5p n ARG 71 CO 0.00 0.00 0.00 0.43 -0.01 0.00 0.00 177.63 178.05 1o5p n SER 72 N 0.00 2.88 -3.64 2.89 7.64 -1.26 -1.93 113.62 120.21 1o5p n SER 72 Ca 0.00 1.16 -0.09 0.00 1.01 0.00 0.00 58.87 60.94 1o5p n SER 72 Cb 0.00 -1.52 -0.07 0.00 -1.01 0.00 0.00 64.21 61.61 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 -1.16 -0.79 -0.26 1.43 -0.71 -0.69 -4.81 117.98 110.99 1o5p s PHE 73 Ca 0.58 1.74 -0.33 0.00 -1.04 0.00 0.00 56.93 57.88 1o5p s PHE 73 Cb -0.51 0.42 -0.15 0.00 -1.21 0.00 0.00 43.02 41.56 1o5p s PHE 73 CO 0.60 -0.39 1.06 0.39 -1.34 0.00 0.00 175.22 175.55 1o5p n GLU 74 N 3.26 0.00 -1.91 1.99 -0.58 -1.26 -1.75 120.64 120.38 1o5p n GLU 74 Ca -0.16 0.00 -0.36 0.00 -0.42 0.00 0.00 57.16 56.22 1o5p n GLU 74 Cb 0.57 -1.10 0.00 0.00 -0.57 0.00 0.00 31.44 30.33 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 2.41 5.23 3.37 0.62 0.00 -0.54 -2.37 105.19 113.90 1o5p n GLY 75 Ca 0.20 -2.26 -0.62 0.00 0.00 0.00 0.00 46.02 43.34 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 0.24 1.34 -2.86 1.61 3.01 0.57 -2.31 117.46 119.07 1o5p n PHE 76 Ca 0.52 0.88 -0.41 0.00 1.01 0.00 0.00 57.45 59.45 1o5p n PHE 76 Cb 0.34 -2.24 -0.04 0.00 -0.01 0.00 0.00 39.48 37.53 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 4.91 4.24 -0.26 4.37 2.96 -0.59 -2.00 118.68 132.32 1o5p s LEU 77 Ca 1.13 1.31 -0.02 0.00 -0.22 0.00 0.00 54.13 56.33 1o5p s LEU 77 Cb -1.48 -3.31 -0.02 0.00 0.50 0.00 0.00 46.19 41.88 1o5p s LEU 77 CO 0.70 -0.33 1.33 0.33 -1.32 0.00 0.00 176.35 177.06 1o5p n PHE 78 N 4.72 0.39 -1.95 5.38 7.35 -1.21 -2.89 117.46 129.23 1o5p n PHE 78 Ca 0.04 -0.89 0.00 0.00 -0.76 0.00 0.00 57.45 55.85 1o5p n PHE 78 Cb 0.50 -0.91 0.00 0.00 0.35 0.00 0.00 39.48 39.42 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 4.49 0.00 0.00 -2.13 2.03 -1.26 -4.98 116.55 114.70 1o5p n ASP 79 Ca 0.14 -0.95 0.00 0.00 0.52 0.00 0.00 54.79 54.49 1o5p n ASP 79 Cb 0.06 0.00 0.00 0.00 -0.72 0.00 0.00 41.12 40.46 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 3.94 0.27 0.00 -1.14 -4.99 105.19 106.02 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 -1.05 5.10 -0.12 2.61 -4.23 -1.26 -4.96 115.64 111.74 1o5p s THR 81 Ca 0.00 -0.44 -0.03 0.00 -1.18 0.00 0.00 61.69 60.04 1o5p s THR 81 Cb 0.00 -3.85 -0.03 0.00 1.34 0.00 0.00 72.50 69.95 1o5p s THR 81 CO 0.00 -0.54 0.01 0.00 -0.54 0.00 0.00 174.62 173.54 1o5p s ARG 82 N -4.26 3.32 0.37 3.99 1.70 -1.26 -1.54 118.95 121.28 1o5p s ARG 82 Ca 0.40 -0.42 0.24 0.00 -0.47 0.00 0.00 55.73 55.48 1o5p s ARG 82 Cb -0.10 -2.90 0.41 0.00 -0.57 0.00 0.00 34.95 31.80 1o5p s ARG 82 CO 0.36 0.53 1.60 2.35 -1.08 0.00 0.00 175.30 179.05 1o5p h TRP 83 N 5.77 0.00 0.00 5.89 7.01 -1.78 -3.45 115.95 129.38 1o5p h TRP 83 Ca -0.44 0.00 0.00 0.00 2.11 0.00 0.00 58.89 60.56 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 0.60 0.00 0.00 0.41 -2.79 0.00 0.00 178.44 176.66 1o5p n GLY 84 N 1.15 1.06 3.58 2.65 0.00 -1.26 -4.89 105.19 107.47 1o5p n GLY 84 Ca 0.04 -2.21 -0.40 0.00 0.00 0.00 0.00 46.02 43.44 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 -1.25 3.26 -0.56 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 -3.47 0.02 0.00 1.34 0.00 0.00 72.50 70.39 1o5p s THR 85 CO 0.00 -0.37 1.34 -0.69 -0.54 0.00 0.00 174.62 174.35 1o5p s VAL 86 N 8.76 3.87 -0.26 2.29 1.01 -0.72 -4.68 120.40 130.67 1o5p s VAL 86 Ca 0.84 0.76 -0.28 0.00 0.00 0.00 0.00 61.98 63.30 1o5p s VAL 86 Cb -0.21 -4.53 -0.03 0.00 0.00 0.00 0.00 36.38 31.61 1o5p s VAL 86 CO 0.29 -1.21 1.89 -1.81 0.00 0.00 0.00 175.10 174.27 1o5p s ASP 87 N 3.89 5.89 0.00 3.32 1.01 -1.26 -1.70 116.67 127.82 1o5p s ASP 87 Ca 0.49 1.61 0.06 0.00 0.71 0.00 0.00 52.55 55.43 1o5p s ASP 87 Cb -0.10 -2.52 0.32 0.00 1.01 0.00 0.00 42.92 41.63 1o5p s ASP 87 CO 0.25 -1.66 1.03 0.00 0.21 0.00 0.00 175.17 175.01 1o5p n THR 89 N -1.26 0.00 -0.05 0.00 -2.24 -1.26 -4.12 114.28 105.35 1o5p n THR 89 Ca 0.03 -0.16 -0.10 0.00 -2.27 0.00 0.00 64.05 61.55 1o5p n THR 89 Cb 0.05 0.15 -0.03 0.00 -2.10 0.00 0.00 70.33 68.40 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 -0.24 0.51 -3.50 4.28 -2.24 -0.17 -5.06 114.28 107.86 1o5p n THR 90 Ca 0.21 -0.13 -0.22 0.00 -2.27 0.00 0.00 64.05 61.64 1o5p n THR 90 Cb 0.27 -1.63 0.03 0.00 -2.10 0.00 0.00 70.33 66.90 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 -3.42 0.95 -2.91 6.98 0.00 -1.19 -5.09 120.51 115.84 1o5p n ALA 91 Ca -0.18 -2.02 -0.38 0.00 0.00 0.00 0.00 53.44 50.86 1o5p n ALA 91 Cb 0.63 0.71 -0.12 0.00 0.00 0.00 0.00 19.45 20.67 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 -2.70 3.25 -0.25 0.00 0.00 -1.26 -4.72 121.76 116.08 1o5p s ALA 92 Ca 0.41 -1.41 -0.14 0.00 0.00 0.00 0.00 51.96 50.83 1o5p s ALA 92 Cb -0.03 -2.36 -0.04 0.00 0.00 0.00 0.00 23.12 20.69 1o5p s ALA 92 CO 0.26 -0.92 0.30 0.00 0.00 0.00 0.00 175.76 175.40 1o5p s GLN 94 N 1.63 3.27 -0.37 0.00 -0.21 -0.72 -2.56 119.66 120.70 1o5p s GLN 94 Ca 0.13 -0.43 -0.11 0.00 0.02 0.00 0.00 55.36 54.97 1o5p s GLN 94 Cb -0.15 -2.98 0.03 0.00 1.00 0.00 0.00 33.01 30.91 1o5p s GLN 94 CO 0.09 0.65 0.21 0.08 -2.12 0.00 0.00 175.29 174.19 1o5p s VAL 95 N -1.32 4.58 0.00 1.09 1.01 0.12 -2.27 120.40 123.61 1o5p s VAL 95 Ca 0.27 -0.86 0.00 0.00 0.00 0.00 0.00 61.98 61.39 1o5p s VAL 95 Cb -0.12 -3.55 0.00 0.00 0.00 0.00 0.00 36.38 32.70 1o5p s VAL 95 CO 0.19 -0.23 0.00 0.61 0.00 0.00 0.00 175.10 175.67 1o5p n GLY 96 N 5.00 2.88 3.87 4.51 0.00 -1.04 0.25 105.19 120.66 1o5p n GLY 96 Ca -0.12 -1.28 -0.29 0.00 0.00 0.00 0.00 46.02 44.33 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 2.46 0.00 0.99 1.02 -1.23 -2.14 118.68 119.78 1o5p s LEU 97 Ca 0.00 -1.44 -0.29 0.00 0.02 0.00 0.00 54.13 52.42 1o5p s LEU 97 Cb 0.00 -0.96 0.10 0.00 0.02 0.00 0.00 46.19 45.35 1o5p s LEU 97 CO 0.00 -1.10 1.01 -0.94 0.02 0.00 0.00 176.35 175.34 1o5p s SER 98 N -4.18 -0.24 0.00 2.29 1.04 -0.07 -4.31 113.70 108.23 1o5p s SER 98 Ca 0.21 -0.12 0.00 0.00 0.48 0.00 0.00 55.95 56.52 1o5p s SER 98 Cb -0.02 0.34 0.00 0.00 0.10 0.00 0.00 66.02 66.44 1o5p s SER 98 CO 0.14 -0.58 0.00 -0.90 0.98 0.00 0.00 173.24 172.87 1o5p n ASP 99 N -0.31 0.84 -1.37 7.02 5.75 -1.22 0.26 116.55 127.52 1o5p n ASP 99 Ca -0.06 -0.08 -0.10 0.00 -0.01 0.00 0.00 54.79 54.53 1o5p n ASP 99 Cb 0.61 0.00 0.11 0.00 -1.03 0.00 0.00 41.12 40.81 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 4.39 -0.00 2.12 0.00 -1.26 -4.66 120.51 118.10 1o5p n ALA 100 Ca 0.00 -3.57 -0.00 0.00 0.00 0.00 0.00 53.44 49.87 1o5p n ALA 100 Cb 0.00 -0.34 -0.00 0.00 0.00 0.00 0.00 19.45 19.11 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 1.99 0.00 0.00 0.00 -1.26 -5.02 120.51 115.32 1o5p n ALA 101 Ca 0.32 -0.04 0.00 0.00 0.00 0.00 0.00 53.44 53.73 1o5p n ALA 101 Cb 0.84 0.30 0.00 0.00 0.00 0.00 0.00 19.45 20.59 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 3.09 0.83 3.09 0.00 0.00 -1.26 -5.14 105.19 105.79 1o5p n GLY 102 Ca -0.01 -0.07 -0.08 0.00 0.00 0.00 0.00 46.02 45.87 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 -0.24 1.61 5.03 -1.26 -4.98 115.26 113.55 1o5p n ASN 103 Ca 0.00 -2.33 0.00 0.00 0.87 0.00 0.00 54.58 53.12 1o5p n ASN 103 Cb 0.00 3.12 0.00 0.00 -1.02 0.00 0.00 39.78 41.88 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 2.36 2.99 7.41 0.00 -1.26 -3.37 105.19 112.87 1o5p n GLY 104 Ca -0.07 -0.79 -0.19 0.00 0.00 0.00 0.00 46.02 44.97 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 -1.31 -1.81 1.61 -0.02 -1.26 -4.89 135.00 127.32 1o5p n PRO 105 Ca 0.00 -0.39 -0.15 0.00 -2.02 0.00 0.00 63.50 60.95 1o5p n PRO 105 Cb 0.00 -1.32 0.08 0.00 -0.02 0.00 0.00 33.50 32.24 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 -0.28 0.09 -4.55 -0.52 0.28 -1.26 -4.59 120.64 109.82 1o5p n GLU 106 Ca 0.03 -1.69 -0.25 0.00 -0.16 0.00 0.00 57.16 55.08 1o5p n GLU 106 Cb 0.38 -0.45 -0.11 0.00 1.43 0.00 0.00 31.44 32.69 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 -4.16 2.29 -0.17 -1.84 0.00 -1.26 -3.56 107.32 98.63 1o5p s GLY 107 Ca 0.42 -2.18 -0.06 0.00 0.00 0.00 0.00 44.72 42.90 1o5p s GLY 107 CO 0.28 -1.99 0.03 0.14 0.00 0.00 0.00 173.10 171.55 1o5p s VAL 108 N -2.88 4.47 -0.05 1.40 1.01 0.14 -4.74 120.40 119.75 1o5p s VAL 108 Ca 0.35 -0.15 -0.30 0.00 0.00 0.00 0.00 61.98 61.88 1o5p s VAL 108 Cb 0.08 -2.99 -0.05 0.00 0.00 0.00 0.00 36.38 33.42 1o5p s VAL 108 CO 0.17 0.48 1.42 0.00 0.00 0.00 0.00 175.10 177.16 1o5p s ALA 109 N 0.30 3.60 0.45 5.51 0.00 -1.26 0.15 121.76 130.52 1o5p s ALA 109 Ca 0.01 0.79 0.05 0.00 0.00 0.00 0.00 51.96 52.81 1o5p s ALA 109 Cb -0.13 -3.63 0.01 0.00 0.00 0.00 0.00 23.12 19.37 1o5p s ALA 109 CO 0.01 -1.07 0.62 0.96 0.00 0.00 0.00 175.76 176.28 1o5p s ILE 110 N 2.99 3.11 0.07 0.00 -4.36 -1.06 -4.83 121.20 117.12 1o5p s ILE 110 Ca 0.64 -0.87 0.02 0.00 -0.26 0.00 0.00 60.65 60.17 1o5p s ILE 110 Cb -0.29 -3.08 -0.03 0.00 1.25 0.00 0.00 42.46 40.30 1o5p s ILE 110 CO 0.24 -0.04 -0.07 -0.55 0.24 0.00 0.00 174.94 174.77 1o5p s SER 111 N -4.34 0.93 -0.38 4.36 0.15 0.17 -4.75 113.70 109.85 1o5p s SER 111 Ca 0.54 -0.79 0.01 0.00 0.70 0.00 0.00 55.95 56.41 1o5p s SER 111 Cb -0.10 0.08 0.12 0.00 -1.71 0.00 0.00 66.02 64.41 1o5p s SER 111 CO 0.35 -0.36 0.18 -0.36 1.20 0.00 0.00 173.24 174.25 1o5p s PHE 112 N -2.60 1.82 -0.73 3.44 0.08 -1.26 -2.95 117.98 115.78 1o5p s PHE 112 Ca 0.01 -2.12 0.00 0.00 0.12 0.00 0.00 56.93 54.94 1o5p s PHE 112 Cb -0.02 -1.77 0.00 0.00 -0.57 0.00 0.00 43.02 40.66 1o5p s PHE 112 CO -0.03 -0.83 0.18 0.27 -0.10 0.00 0.00 175.22 174.72