#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 2.64 0.84 0.00 0.00 -1.26 -4.94 121.76 119.03 1o5p s ALA 2 Ca 0.00 -1.48 -0.12 0.00 0.00 0.00 0.00 51.96 50.36 1o5p s ALA 2 Cb 0.00 -0.53 0.10 0.00 0.00 0.00 0.00 23.12 22.70 1o5p s ALA 2 CO 0.00 0.51 1.19 -2.14 0.00 0.00 0.00 175.76 175.32 1o5p s PRO 3 N -2.41 1.43 0.00 0.00 0.02 -0.48 -4.09 135.00 129.47 1o5p s PRO 3 Ca 0.19 1.68 0.00 0.00 0.02 0.00 0.00 61.00 62.90 1o5p s PRO 3 Cb -0.09 -1.76 0.00 0.00 0.02 0.00 0.00 34.50 32.67 1o5p s PRO 3 CO 0.10 -2.36 0.00 -2.37 -0.33 0.00 0.00 177.00 172.05 1o5p n THR 4 N -3.62 0.00 -3.64 0.99 5.66 0.26 -4.85 114.28 109.08 1o5p n THR 4 Ca 0.13 0.00 -0.05 0.00 -3.05 0.00 0.00 64.05 61.08 1o5p n THR 4 Cb 0.51 0.00 -0.07 0.00 -1.55 0.00 0.00 70.33 69.22 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 -2.12 -0.48 1.79 0.00 -1.25 -1.12 121.76 117.57 1o5p s ALA 5 Ca 0.00 2.11 -0.15 0.00 0.00 0.00 0.00 51.96 53.92 1o5p s ALA 5 Cb 0.00 -1.58 0.09 0.00 0.00 0.00 0.00 23.12 21.62 1o5p s ALA 5 CO 0.00 -0.31 0.41 0.95 0.00 0.00 0.00 175.76 176.81 1o5p s THR 6 N 0.97 5.18 -0.20 0.00 -4.23 0.21 -4.77 115.64 112.79 1o5p s THR 6 Ca -0.05 -1.18 0.02 0.00 -1.18 0.00 0.00 61.69 59.30 1o5p s THR 6 Cb -0.04 -4.14 0.03 0.00 1.34 0.00 0.00 72.50 69.69 1o5p s THR 6 CO -0.12 -0.64 -0.17 -0.69 -0.54 0.00 0.00 174.62 172.46 1o5p s VAL 7 N 1.62 2.06 -0.12 2.29 1.01 -1.24 0.13 120.40 126.15 1o5p s VAL 7 Ca 0.04 -1.15 -0.30 0.00 0.00 0.00 0.00 61.98 60.57 1o5p s VAL 7 Cb -0.25 -1.97 0.09 0.00 0.00 0.00 0.00 36.38 34.25 1o5p s VAL 7 CO 0.06 0.35 0.82 -0.89 0.00 0.00 0.00 175.10 175.44 1o5p s THR 8 N 1.24 0.00 0.46 3.92 2.01 -0.64 -4.37 115.64 118.27 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 -0.15 -1.00 -0.10 0.00 0.01 0.00 0.00 72.50 71.26 1o5p s THR 8 CO -0.10 0.00 0.99 -2.16 -0.69 0.00 0.00 174.62 172.65 1o5p s PRO 9 N -0.96 4.03 0.06 4.92 0.04 -1.26 -1.15 135.00 140.68 1o5p s PRO 9 Ca -0.06 1.21 0.18 0.00 0.04 0.00 0.00 61.00 62.37 1o5p s PRO 9 Cb -0.01 -2.14 -0.13 0.00 0.04 0.00 0.00 34.50 32.26 1o5p s PRO 9 CO 0.05 -0.21 0.80 -1.13 0.04 0.00 0.00 177.00 176.55 1o5p n SER 10 N -0.84 0.76 -4.23 6.66 3.41 -1.26 -4.78 113.62 113.33 1o5p n SER 10 Ca 0.08 0.33 -0.13 0.00 -0.26 0.00 0.00 58.87 58.88 1o5p n SER 10 Cb 0.53 0.37 -0.10 0.00 -0.26 0.00 0.00 64.21 64.75 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 -5.61 1.40 -0.17 4.04 0.01 -1.26 0.50 113.70 112.62 1o5p s SER 11 Ca -0.03 -1.08 -0.01 0.00 1.31 0.00 0.00 55.95 56.14 1o5p s SER 11 Cb 0.09 0.07 0.00 0.00 0.21 0.00 0.00 66.02 66.39 1o5p s SER 11 CO 0.82 -0.47 0.09 0.61 0.41 0.00 0.00 173.24 174.70 1o5p n GLY 12 N -0.18 0.64 0.13 3.44 0.00 -1.15 -4.90 105.19 103.17 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 -0.81 2.50 -1.06 0.99 4.77 -1.26 -5.06 117.00 117.07 1o5p n LEU 13 Ca -0.01 0.23 0.00 0.00 -0.03 0.00 0.00 56.01 56.20 1o5p n LEU 13 Cb 0.51 -1.07 0.00 0.00 -2.33 0.00 0.00 43.42 40.53 1o5p n LEU 13 CO 0.06 0.75 -0.31 -0.24 -1.33 0.00 0.00 177.39 176.32 1o5p n SER 14 N -3.67 -5.99 -4.46 -1.43 2.88 -1.26 -3.85 113.62 95.85 1o5p n SER 14 Ca -0.34 0.93 -0.47 0.00 -1.33 0.00 0.00 58.87 57.66 1o5p n SER 14 Cb 0.97 -2.93 -0.08 0.00 -0.75 0.00 0.00 64.21 61.42 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 -1.22 1.78 0.00 -3.46 5.75 -1.26 -1.98 116.55 116.15 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 0.07 -1.24 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 6.52 1.46 0.52 6.12 0.00 -1.26 -5.05 105.19 113.49 1o5p n GLY 16 Ca 0.45 0.00 -0.03 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 -0.28 0.00 -4.29 2.61 5.66 -0.84 -4.97 114.28 112.16 1o5p n THR 17 Ca 0.00 -0.28 -0.18 0.00 -3.05 0.00 0.00 64.05 60.54 1o5p n THR 17 Cb 0.00 -0.66 -0.14 0.00 -1.55 0.00 0.00 70.33 67.98 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 0.03 0.77 0.21 1.08 1.01 -1.26 -2.21 120.40 120.03 1o5p s VAL 18 Ca 0.06 -0.67 0.11 0.00 0.00 0.00 0.00 61.98 61.48 1o5p s VAL 18 Cb -0.00 -0.70 -0.04 0.00 0.00 0.00 0.00 36.38 35.63 1o5p s VAL 18 CO 0.04 0.04 -0.21 0.68 0.00 0.00 0.00 175.10 175.65 1o5p s VAL 19 N -0.59 2.53 -0.39 2.92 -7.23 0.53 -4.76 120.40 113.41 1o5p s VAL 19 Ca 0.00 -2.04 -0.10 0.00 -1.81 0.00 0.00 61.98 58.03 1o5p s VAL 19 Cb -0.06 -2.24 0.04 0.00 0.56 0.00 0.00 36.38 34.68 1o5p s VAL 19 CO 0.00 -0.17 0.22 -0.75 -0.31 0.00 0.00 175.10 174.09 1o5p s LYS 20 N -2.86 2.76 -0.23 4.82 2.20 -0.30 -1.37 119.74 124.76 1o5p s LYS 20 Ca 0.23 -1.18 -0.07 0.00 -0.36 0.00 0.00 55.97 54.59 1o5p s LYS 20 Cb -0.08 -3.74 -0.03 0.00 -1.51 0.00 0.00 37.83 32.48 1o5p s LYS 20 CO 0.12 -0.77 0.05 0.54 -0.36 0.00 0.00 175.35 174.93 1o5p s VAL 21 N 1.52 4.23 0.37 4.02 0.11 -0.85 -1.61 120.40 128.18 1o5p s VAL 21 Ca 0.02 -0.21 0.08 0.00 -2.93 0.00 0.00 61.98 58.95 1o5p s VAL 21 Cb -0.20 -2.96 -0.06 0.00 -1.53 0.00 0.00 36.38 31.63 1o5p s VAL 21 CO 0.05 0.37 0.00 0.00 -3.33 0.00 0.00 175.10 172.20 1o5p s ALA 22 N 1.38 3.18 0.02 1.54 0.00 0.34 -2.25 121.76 125.97 1o5p s ALA 22 Ca 0.05 -2.13 0.03 0.00 0.00 0.00 0.00 51.96 49.92 1o5p s ALA 22 Cb -0.15 -0.12 -0.01 0.00 0.00 0.00 0.00 23.12 22.84 1o5p s ALA 22 CO 0.03 -0.02 -0.10 0.20 0.00 0.00 0.00 175.76 175.86 1o5p s GLY 23 N -3.71 0.57 -0.14 0.00 0.00 0.36 -0.62 107.32 103.78 1o5p s GLY 23 Ca 0.35 -0.59 -0.05 0.00 0.00 0.00 0.00 44.72 44.43 1o5p s GLY 23 CO 0.19 -0.56 0.29 0.00 0.00 0.00 0.00 173.10 173.02 1o5p s ALA 24 N -0.60 -0.67 0.00 3.20 0.00 -0.27 0.22 121.76 123.63 1o5p s ALA 24 Ca 0.01 1.07 0.00 0.00 0.00 0.00 0.00 51.96 53.03 1o5p s ALA 24 Cb -0.06 -0.96 0.00 0.00 0.00 0.00 0.00 23.12 22.10 1o5p s ALA 24 CO 0.00 -0.53 0.00 0.41 0.00 0.00 0.00 175.76 175.65 1o5p n GLY 25 N 5.02 1.07 3.96 0.00 0.00 -0.99 0.93 105.19 115.19 1o5p n GLY 25 Ca -0.12 -0.46 -0.25 0.00 0.00 0.00 0.00 46.02 45.18 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 2.90 -0.87 0.99 1.43 -0.64 -1.39 118.68 121.11 1o5p s LEU 26 Ca 0.00 -0.04 -0.25 0.00 -1.03 0.00 0.00 54.13 52.82 1o5p s LEU 26 Cb 0.00 -2.33 -0.21 0.00 0.03 0.00 0.00 46.19 43.69 1o5p s LEU 26 CO 0.00 -1.98 2.49 0.00 0.23 0.00 0.00 176.35 177.10 1o5p n GLN 27 N -3.04 0.28 -1.16 1.70 3.00 -1.26 -4.10 117.38 112.79 1o5p n GLN 27 Ca 0.13 -0.09 -0.20 0.00 -0.01 0.00 0.00 57.00 56.83 1o5p n GLN 27 Cb 0.60 -2.03 -0.10 0.00 0.00 0.00 0.00 30.24 28.72 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 11.41 0.39 0.00 -1.58 0.00 -1.23 -1.40 120.51 128.10 1o5p n ALA 28 Ca 0.58 -2.10 0.00 0.00 0.00 0.00 0.00 53.44 51.93 1o5p n ALA 28 Cb 0.20 -2.90 0.00 0.00 0.00 0.00 0.00 19.45 16.76 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 5.44 0.39 2.97 0.00 0.00 0.90 -4.82 105.19 110.08 1o5p n GLY 29 Ca 0.35 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 46.24 1o5p n GLY 29 CO 0.00 0.00 0.00 -1.08 0.00 0.00 0.00 173.32 172.24 1o5p s THR 30 N -0.48 -0.48 -0.01 2.61 -1.32 -0.49 -4.89 115.64 110.59 1o5p s THR 30 Ca 0.00 0.09 -0.39 0.00 -1.21 0.00 0.00 61.69 60.18 1o5p s THR 30 Cb 0.00 -0.62 -0.19 0.00 -1.51 0.00 0.00 72.50 70.18 1o5p s THR 30 CO 0.00 -0.02 1.21 0.00 -2.21 0.00 0.00 174.62 173.60 1o5p n ALA 31 N 5.35 -2.54 -2.41 11.08 0.00 -1.26 -2.71 120.51 128.02 1o5p n ALA 31 Ca -0.06 0.56 -0.28 0.00 0.00 0.00 0.00 53.44 53.66 1o5p n ALA 31 Cb 0.50 -1.89 -0.14 0.00 0.00 0.00 0.00 19.45 17.92 1o5p n ALA 31 CO 0.00 0.00 0.00 0.71 0.00 0.00 0.00 177.50 178.21 1o5p s TYR 32 N 0.43 2.16 0.34 0.00 2.02 0.18 -4.39 117.35 118.08 1o5p s TYR 32 Ca 0.90 -0.40 0.05 0.00 -0.37 0.00 0.00 57.07 57.26 1o5p s TYR 32 Cb -1.17 -1.24 -0.01 0.00 -0.40 0.00 0.00 41.96 39.14 1o5p s TYR 32 CO 0.55 0.19 0.48 0.34 -1.57 0.00 0.00 175.55 175.55 1o5p s ASP 33 N -1.55 6.01 -0.19 2.29 2.15 0.75 -1.52 116.67 124.60 1o5p s ASP 33 Ca 0.11 -0.07 -0.04 0.00 0.43 0.00 0.00 52.55 52.97 1o5p s ASP 33 Cb -0.10 -1.37 0.10 0.00 -0.30 0.00 0.00 42.92 41.24 1o5p s ASP 33 CO 0.03 -0.42 0.32 0.54 -0.17 0.00 0.00 175.17 175.48 1o5p s VAL 34 N -2.20 -0.50 0.08 1.11 0.11 -0.74 -1.14 120.40 117.12 1o5p s VAL 34 Ca 0.44 0.08 -0.09 0.00 -2.93 0.00 0.00 61.98 59.47 1o5p s VAL 34 Cb -0.10 -0.64 0.03 0.00 -1.53 0.00 0.00 36.38 34.14 1o5p s VAL 34 CO 0.32 -0.02 0.44 0.61 -3.33 0.00 0.00 175.10 173.12 1o5p n GLY 35 N 5.36 1.02 3.43 6.54 0.00 -0.91 -0.34 105.19 120.28 1o5p n GLY 35 Ca -0.06 -1.02 -0.43 0.00 0.00 0.00 0.00 46.02 44.51 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 2.94 0.06 1.61 -2.07 -1.26 -2.54 119.66 116.38 1o5p s GLN 36 Ca 0.10 -1.11 0.05 0.00 -1.82 0.00 0.00 55.36 52.58 1o5p s GLN 36 Cb -0.01 -3.97 -0.03 0.00 -1.09 0.00 0.00 33.01 27.91 1o5p s GLN 36 CO 0.03 -0.81 -0.14 0.00 -1.32 0.00 0.00 175.29 173.04 1o5p s ALA 38 N -1.15 1.59 -0.35 0.00 0.00 -0.81 -1.84 121.76 119.21 1o5p s ALA 38 Ca -0.01 -0.80 -0.17 0.00 0.00 0.00 0.00 51.96 50.98 1o5p s ALA 38 Cb -0.09 -0.43 -0.01 0.00 0.00 0.00 0.00 23.12 22.59 1o5p s ALA 38 CO 0.02 0.37 0.45 -1.58 0.00 0.00 0.00 175.76 175.02 1o5p s TRP 39 N -0.36 3.19 -0.73 0.00 0.51 -1.26 -1.83 118.94 118.47 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 -0.08 -2.82 0.57 0.00 -0.81 0.00 0.00 33.47 30.33 1o5p s TRP 39 CO -0.00 -0.50 1.49 1.33 -0.51 0.00 0.00 176.95 178.75 1o5p n VAL 40 N 5.35 1.84 -1.43 4.03 0.24 -0.90 -4.73 118.33 122.73 1o5p n VAL 40 Ca -0.07 -1.38 0.00 0.00 -2.04 0.00 0.00 64.34 60.86 1o5p n VAL 40 Cb 0.49 0.07 0.00 0.00 -1.47 0.00 0.00 33.84 32.93 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 0.45 0.00 -4.55 -1.34 9.92 -1.26 -4.95 116.55 114.81 1o5p n ASP 41 Ca 0.21 0.00 -0.37 0.00 -0.53 0.00 0.00 54.79 54.11 1o5p n ASP 41 Cb 0.80 0.00 -0.03 0.00 -0.64 0.00 0.00 41.12 41.25 1o5p n ASP 41 CO 0.00 0.00 0.00 0.42 0.13 0.00 0.00 177.20 177.75 1o5p s THR 42 N -2.44 3.46 0.00 -3.53 -4.23 -1.26 -2.89 115.64 104.75 1o5p s THR 42 Ca 0.00 0.07 0.00 0.00 -1.18 0.00 0.00 61.69 60.58 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 5.94 0.70 3.11 3.99 0.00 -1.26 -5.05 105.19 112.63 1o5p n GLY 43 Ca 0.22 -0.72 -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 2.74 -0.33 1.61 1.01 -1.14 -4.97 120.40 117.32 1o5p s VAL 44 Ca 0.00 -1.74 0.01 0.00 0.00 0.00 0.00 61.98 60.25 1o5p s VAL 44 Cb 0.00 -2.72 0.08 0.00 0.00 0.00 0.00 36.38 33.74 1o5p s VAL 44 CO 0.00 -0.29 0.04 -0.22 0.00 0.00 0.00 175.10 174.63 1o5p s LEU 45 N 1.14 4.38 -0.42 3.92 2.96 -1.26 -2.13 118.68 127.27 1o5p s LEU 45 Ca -0.01 -1.73 -0.16 0.00 -0.22 0.00 0.00 54.13 52.01 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 -0.04 -0.35 0.39 0.00 -1.32 0.00 0.00 176.35 175.03 1o5p s ALA 46 N 1.10 3.45 0.33 5.97 0.00 -0.76 -3.44 121.76 128.41 1o5p s ALA 46 Ca 0.02 -1.64 0.08 0.00 0.00 0.00 0.00 51.96 50.42 1o5p s ALA 46 Cb -0.20 -3.00 -0.03 0.00 0.00 0.00 0.00 23.12 19.88 1o5p s ALA 46 CO -0.05 -1.56 0.23 0.00 0.00 0.00 0.00 175.76 174.38 1o5p s ASN 48 N -3.93 4.87 0.00 0.00 2.47 -0.86 0.15 114.94 117.64 1o5p s ASN 48 Ca 0.39 -0.11 0.00 0.00 0.42 0.00 0.00 52.86 53.56 1o5p s ASN 48 Cb -0.05 -1.80 0.00 0.00 -1.45 0.00 0.00 41.25 37.95 1o5p s ASN 48 CO 0.25 0.17 0.28 -0.81 -3.72 0.00 0.00 177.10 173.27 1o5p n PRO 49 N 3.52 0.55 -0.02 0.43 -0.05 -1.26 -2.74 135.00 135.42 1o5p n PRO 49 Ca -0.17 0.00 0.07 0.00 -0.05 0.00 0.00 63.50 63.35 1o5p n PRO 49 Cb 0.52 -1.27 0.07 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 0.21 2.45 -1.79 0.55 0.00 -1.26 -4.34 120.51 116.33 1o5p n ALA 50 Ca 0.00 -0.67 0.01 0.00 0.00 0.00 0.00 53.44 52.78 1o5p n ALA 50 Cb 0.14 -0.48 0.02 0.00 0.00 0.00 0.00 19.45 19.12 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 0.79 0.34 -4.52 0.00 5.75 -1.11 -2.36 116.55 115.43 1o5p n ASP 51 Ca 0.09 -2.09 -0.42 0.00 -0.01 0.00 0.00 54.79 52.36 1o5p n ASP 51 Cb 0.36 -0.22 -0.03 0.00 -1.03 0.00 0.00 41.12 40.21 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 -0.40 2.69 0.06 2.11 0.40 -1.25 -3.06 117.98 118.53 1o5p s PHE 52 Ca 0.04 -0.94 0.01 0.00 -0.60 0.00 0.00 56.93 55.43 1o5p s PHE 52 Cb 0.04 -4.56 0.01 0.00 0.51 0.00 0.00 43.02 39.01 1o5p s PHE 52 CO 0.00 -1.81 0.04 0.43 0.70 0.00 0.00 175.22 174.59 1o5p n SER 53 N 8.21 1.15 0.00 1.36 7.64 0.53 -4.92 113.62 127.59 1o5p n SER 53 Ca 0.27 -1.20 0.00 0.00 1.01 0.00 0.00 58.87 58.96 1o5p n SER 53 Cb 0.50 -0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.70 1o5p n SER 53 CO 0.00 0.00 0.00 -0.24 -3.01 0.00 0.00 175.04 171.79 1o5p n SER 54 N -2.01 0.00 -3.60 6.43 2.88 -1.26 -1.80 113.62 114.26 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 0.07 0.00 -0.04 0.00 -0.75 0.00 0.00 64.21 63.48 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 -0.80 0.06 0.03 2.46 0.11 -0.58 -4.95 120.40 116.73 1o5p s VAL 55 Ca 0.00 -0.46 -0.06 0.00 -2.93 0.00 0.00 61.98 58.53 1o5p s VAL 55 Cb 0.00 -1.12 -0.05 0.00 -1.53 0.00 0.00 36.38 33.68 1o5p s VAL 55 CO 0.00 -0.25 0.28 -0.89 -3.33 0.00 0.00 175.10 170.91 1o5p s THR 56 N -3.67 5.28 -0.37 5.04 2.01 -1.26 0.48 115.64 123.15 1o5p s THR 56 Ca 0.02 0.12 -0.28 0.00 0.31 0.00 0.00 61.69 61.86 1o5p s THR 56 Cb 0.01 -3.58 -0.02 0.00 0.01 0.00 0.00 72.50 68.92 1o5p s THR 56 CO -0.11 0.30 1.84 0.00 -0.69 0.00 0.00 174.62 175.96 1o5p s ALA 57 N -1.37 2.72 0.00 7.40 0.00 -1.10 -4.69 121.76 124.72 1o5p s ALA 57 Ca 0.30 0.14 0.00 0.00 0.00 0.00 0.00 51.96 52.41 1o5p s ALA 57 Cb -0.13 -4.07 0.00 0.00 0.00 0.00 0.00 23.12 18.92 1o5p s ALA 57 CO 0.18 -2.88 0.00 -3.47 0.00 0.00 0.00 175.76 169.59 1o5p n ASP 58 N 10.89 0.00 -0.14 0.00 2.03 -1.26 0.31 116.55 128.37 1o5p n ASP 58 Ca 0.23 0.00 -0.05 0.00 0.52 0.00 0.00 54.79 55.50 1o5p n ASP 58 Cb 0.48 0.00 0.02 0.00 -0.72 0.00 0.00 41.12 40.90 1o5p n ASP 58 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 1o5p h ALA 59 N -2.00 0.13 0.00 -1.67 0.00 -1.93 -3.07 119.26 110.72 1o5p h ALA 59 Ca 0.00 0.16 -0.28 0.00 0.00 0.00 0.00 54.91 54.79 1o5p h ALA 59 Cb 0.00 0.52 -0.05 0.00 0.00 0.00 0.00 17.79 18.26 1o5p h ALA 59 CO 0.00 -0.56 -2.05 0.09 0.00 0.00 0.00 179.25 176.73 1o5p n ASN 60 N -5.40 1.53 0.00 0.00 3.02 -1.26 -4.56 115.26 108.58 1o5p n ASN 60 Ca 0.03 -0.02 0.00 0.00 -0.03 0.00 0.00 54.58 54.56 1o5p n ASN 60 Cb 0.31 0.63 0.00 0.00 -0.61 0.00 0.00 39.78 40.10 1o5p n ASN 60 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1o5p n GLY 61 N 2.17 0.75 3.63 7.41 0.00 -1.16 -1.62 105.19 116.37 1o5p n GLY 61 Ca -0.27 -0.74 -0.35 0.00 0.00 0.00 0.00 46.02 44.66 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 -1.37 5.66 -0.20 1.61 0.01 -1.25 -2.33 113.70 115.82 1o5p s SER 62 Ca 0.00 0.07 -0.04 0.00 1.31 0.00 0.00 55.95 57.29 1o5p s SER 62 Cb 0.00 -1.98 0.07 0.00 0.21 0.00 0.00 66.02 64.32 1o5p s SER 62 CO 0.00 0.15 0.07 0.00 0.41 0.00 0.00 173.24 173.87 1o5p s ALA 63 N 0.51 0.75 -0.24 1.44 0.00 0.13 -4.66 121.76 119.69 1o5p s ALA 63 Ca 0.04 -0.61 -0.02 0.00 0.00 0.00 0.00 51.96 51.37 1o5p s ALA 63 Cb -0.13 -1.16 0.02 0.00 0.00 0.00 0.00 23.12 21.86 1o5p s ALA 63 CO 0.01 -1.24 -0.06 -1.12 0.00 0.00 0.00 175.76 173.35 1o5p s SER 64 N 1.99 4.26 -0.03 0.00 0.01 -1.26 0.13 113.70 118.80 1o5p s SER 64 Ca 0.02 -0.74 -0.04 0.00 1.31 0.00 0.00 55.95 56.49 1o5p s SER 64 Cb -0.17 -1.68 0.01 0.00 0.21 0.00 0.00 66.02 64.39 1o5p s SER 64 CO -0.12 -0.10 0.10 0.28 0.41 0.00 0.00 173.24 173.82 1o5p s THR 65 N 1.37 0.02 -0.15 1.44 -1.32 -0.95 -4.98 115.64 111.06 1o5p s THR 65 Ca 0.02 -0.17 -0.08 0.00 -1.21 0.00 0.00 61.69 60.25 1o5p s THR 65 Cb -0.16 -0.21 -0.04 0.00 -1.51 0.00 0.00 72.50 70.58 1o5p s THR 65 CO -0.04 -0.09 0.12 -0.94 -2.21 0.00 0.00 174.62 171.45 1o5p s SER 66 N -0.27 6.21 0.04 8.08 1.04 -1.26 -2.00 113.70 125.54 1o5p s SER 66 Ca -0.03 0.35 -0.02 0.00 0.48 0.00 0.00 55.95 56.73 1o5p s SER 66 Cb -0.02 -2.03 -0.03 0.00 0.10 0.00 0.00 66.02 64.04 1o5p s SER 66 CO 0.00 0.32 0.01 -1.48 0.98 0.00 0.00 173.24 173.07 1o5p s LEU 67 N -0.51 2.25 0.09 2.42 0.05 -0.47 -4.94 118.68 117.57 1o5p s LEU 67 Ca 0.12 -0.78 -0.22 0.00 0.05 0.00 0.00 54.13 53.30 1o5p s LEU 67 Cb -0.12 0.30 -0.07 0.00 -2.05 0.00 0.00 46.19 44.25 1o5p s LEU 67 CO 0.02 -0.52 0.66 0.28 -0.55 0.00 0.00 176.35 176.24 1o5p s THR 68 N -3.13 4.64 -0.09 5.48 -1.32 -1.00 -0.34 115.64 119.89 1o5p s THR 68 Ca -0.00 1.42 -0.13 0.00 -1.21 0.00 0.00 61.69 61.77 1o5p s THR 68 Cb 0.02 -4.00 0.03 0.00 -1.51 0.00 0.00 72.50 67.03 1o5p s THR 68 CO -0.07 0.51 0.32 0.68 -2.21 0.00 0.00 174.62 173.85 1o5p s VAL 69 N -0.89 0.02 0.29 5.08 -7.23 -0.94 -3.81 120.40 112.92 1o5p s VAL 69 Ca 0.32 -0.17 -0.01 0.00 -1.81 0.00 0.00 61.98 60.32 1o5p s VAL 69 Cb -0.21 -0.52 0.00 0.00 0.56 0.00 0.00 36.38 36.22 1o5p s VAL 69 CO 0.22 -0.10 0.39 -2.11 -0.31 0.00 0.00 175.10 173.19 1o5p n ARG 70 N 2.32 0.56 0.00 4.82 1.85 -1.26 -4.26 116.66 120.69 1o5p n ARG 70 Ca -0.16 -2.39 0.00 0.00 -1.00 0.00 0.00 57.85 54.30 1o5p n ARG 70 Cb 0.57 2.25 0.00 0.00 -1.05 0.00 0.00 32.46 34.23 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 -0.49 0.00 -1.96 2.89 1.85 -1.26 -4.48 116.66 113.21 1o5p n ARG 71 Ca 0.01 0.00 -0.38 0.00 -1.00 0.00 0.00 57.85 56.48 1o5p n ARG 71 Cb 0.49 -0.05 0.01 0.00 -1.05 0.00 0.00 32.46 31.86 1o5p n ARG 71 CO 0.00 0.00 0.00 -1.12 -0.01 0.00 0.00 177.63 176.50 1o5p s SER 72 N -2.62 5.81 -0.22 2.89 0.01 -1.26 -1.68 113.70 116.63 1o5p s SER 72 Ca 0.00 2.65 -0.27 0.00 1.31 0.00 0.00 55.95 59.64 1o5p s SER 72 Cb 0.00 -2.63 0.10 0.00 0.21 0.00 0.00 66.02 63.69 1o5p s SER 72 CO 0.00 -1.19 0.86 0.72 0.41 0.00 0.00 173.24 174.04 1o5p s PHE 73 N -1.34 -0.60 -0.41 2.43 -0.71 -0.64 -4.82 117.98 111.88 1o5p s PHE 73 Ca 0.65 1.34 -0.40 0.00 -1.04 0.00 0.00 56.93 57.48 1o5p s PHE 73 Cb -0.37 0.35 -0.17 0.00 -1.21 0.00 0.00 43.02 41.61 1o5p s PHE 73 CO 0.46 -0.36 1.36 0.39 -1.34 0.00 0.00 175.22 175.73 1o5p n GLU 74 N 1.94 0.00 -1.92 1.99 -0.58 -1.26 -0.99 120.64 119.81 1o5p n GLU 74 Ca -0.14 0.00 -0.36 0.00 -0.42 0.00 0.00 57.16 56.24 1o5p n GLU 74 Cb 0.56 -1.30 0.01 0.00 -0.57 0.00 0.00 31.44 30.14 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 3.36 5.26 3.46 0.62 0.00 -0.53 -2.18 105.19 115.17 1o5p n GLY 75 Ca 0.26 -2.29 -0.63 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 0.13 1.44 -3.00 1.61 3.01 0.12 -2.35 117.46 118.43 1o5p n PHE 76 Ca 0.52 0.95 -0.40 0.00 1.01 0.00 0.00 57.45 59.52 1o5p n PHE 76 Cb 0.33 -2.23 -0.05 0.00 -0.01 0.00 0.00 39.48 37.52 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 4.46 4.24 -0.27 4.37 2.96 -0.65 -1.90 118.68 131.88 1o5p s LEU 77 Ca 1.11 1.13 -0.02 0.00 -0.22 0.00 0.00 54.13 56.13 1o5p s LEU 77 Cb -1.48 -3.11 -0.03 0.00 0.50 0.00 0.00 46.19 42.07 1o5p s LEU 77 CO 0.73 -0.25 1.36 0.33 -1.32 0.00 0.00 176.35 177.20 1o5p n PHE 78 N 4.52 0.41 -1.97 5.38 7.35 -1.22 -2.89 117.46 129.04 1o5p n PHE 78 Ca 0.01 -0.90 0.00 0.00 -0.76 0.00 0.00 57.45 55.80 1o5p n PHE 78 Cb 0.50 -0.93 0.00 0.00 0.35 0.00 0.00 39.48 39.40 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 4.38 0.00 0.00 -2.13 2.03 -1.26 -4.98 116.55 114.59 1o5p n ASP 79 Ca 0.15 -0.97 0.00 0.00 0.52 0.00 0.00 54.79 54.49 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 2.77 3.93 0.27 0.00 -1.14 -4.99 105.19 106.03 1o5p n GLY 80 Ca 0.00 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.77 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 -1.06 5.07 -0.12 2.61 -4.23 -1.26 -4.96 115.64 111.70 1o5p s THR 81 Ca 0.00 -0.28 -0.03 0.00 -1.18 0.00 0.00 61.69 60.19 1o5p s THR 81 Cb 0.00 -3.83 -0.03 0.00 1.34 0.00 0.00 72.50 69.98 1o5p s THR 81 CO 0.00 -0.52 0.01 0.00 -0.54 0.00 0.00 174.62 173.58 1o5p s ARG 82 N -4.14 3.32 0.25 3.99 1.70 -1.26 -1.64 118.95 121.17 1o5p s ARG 82 Ca 0.41 -0.40 0.24 0.00 -0.47 0.00 0.00 55.73 55.52 1o5p s ARG 82 Cb -0.10 -2.91 0.49 0.00 -0.57 0.00 0.00 34.95 31.86 1o5p s ARG 82 CO 0.35 0.54 1.55 2.35 -1.08 0.00 0.00 175.30 179.01 1o5p h TRP 83 N 5.71 0.00 0.00 5.89 7.01 -1.79 -3.46 115.95 129.32 1o5p h TRP 83 Ca -0.45 0.00 0.00 0.00 2.11 0.00 0.00 58.89 60.55 1o5p h TRP 83 Cb 1.19 0.00 0.00 0.00 -2.10 0.00 0.00 29.16 28.25 1o5p h TRP 83 CO 0.61 0.00 0.00 0.41 -2.79 0.00 0.00 178.44 176.67 1o5p n GLY 84 N 1.25 1.16 3.57 2.65 0.00 -1.26 -4.87 105.19 107.69 1o5p n GLY 84 Ca 0.04 -2.16 -0.39 0.00 0.00 0.00 0.00 46.02 43.51 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 -1.41 3.21 -0.45 2.61 -4.23 -1.26 -1.46 115.64 112.65 1o5p s THR 85 Ca 0.00 0.16 -0.28 0.00 -1.18 0.00 0.00 61.69 60.39 1o5p s THR 85 Cb 0.00 -3.44 0.00 0.00 1.34 0.00 0.00 72.50 70.40 1o5p s THR 85 CO 0.00 -0.39 1.51 -0.69 -0.54 0.00 0.00 174.62 174.51 1o5p s VAL 86 N 9.71 3.76 -0.23 2.29 1.01 -0.16 -4.57 120.40 132.20 1o5p s VAL 86 Ca 0.84 0.73 -0.29 0.00 0.00 0.00 0.00 61.98 63.27 1o5p s VAL 86 Cb -0.18 -4.15 -0.04 0.00 0.00 0.00 0.00 36.38 32.01 1o5p s VAL 86 CO 0.27 -0.82 1.91 -1.81 0.00 0.00 0.00 175.10 174.64 1o5p s ASP 87 N 4.73 5.92 0.00 3.32 1.01 -1.26 -1.63 116.67 128.76 1o5p s ASP 87 Ca 0.62 1.70 0.04 0.00 0.71 0.00 0.00 52.55 55.63 1o5p s ASP 87 Cb -0.14 -2.52 0.22 0.00 1.01 0.00 0.00 42.92 41.49 1o5p s ASP 87 CO 0.30 -1.62 0.94 0.00 0.21 0.00 0.00 175.17 174.99 1o5p n THR 89 N -1.25 0.00 -0.09 0.00 -2.24 -1.26 -4.17 114.28 105.26 1o5p n THR 89 Ca 0.02 -0.16 -0.19 0.00 -2.27 0.00 0.00 64.05 61.44 1o5p n THR 89 Cb 0.03 0.36 -0.07 0.00 -2.10 0.00 0.00 70.33 68.55 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 -0.38 1.04 -3.78 4.28 -2.24 -0.20 -5.04 114.28 107.97 1o5p n THR 90 Ca 0.15 -0.28 -0.21 0.00 -2.27 0.00 0.00 64.05 61.44 1o5p n THR 90 Cb 0.34 -1.67 0.00 0.00 -2.10 0.00 0.00 70.33 66.89 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 -3.74 0.70 -2.82 6.98 0.00 -1.21 -5.10 120.51 115.32 1o5p n ALA 91 Ca -0.37 -1.78 -0.39 0.00 0.00 0.00 0.00 53.44 50.90 1o5p n ALA 91 Cb 0.78 0.73 -0.11 0.00 0.00 0.00 0.00 19.45 20.84 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 -2.64 3.32 -0.27 0.00 0.00 -1.26 -4.73 121.76 116.18 1o5p s ALA 92 Ca 0.26 -1.36 -0.14 0.00 0.00 0.00 0.00 51.96 50.72 1o5p s ALA 92 Cb -0.02 -2.41 -0.04 0.00 0.00 0.00 0.00 23.12 20.65 1o5p s ALA 92 CO 0.17 -0.88 0.34 0.00 0.00 0.00 0.00 175.76 175.39 1o5p s GLN 94 N 1.96 3.11 -0.40 0.00 -0.21 -0.76 -2.44 119.66 120.91 1o5p s GLN 94 Ca 0.14 -0.46 -0.13 0.00 0.02 0.00 0.00 55.36 54.92 1o5p s GLN 94 Cb -0.16 -2.89 0.03 0.00 1.00 0.00 0.00 33.01 30.99 1o5p s GLN 94 CO 0.10 0.65 0.26 0.08 -2.12 0.00 0.00 175.29 174.26 1o5p s VAL 95 N -1.20 4.92 0.12 1.09 1.01 0.13 -2.30 120.40 124.17 1o5p s VAL 95 Ca 0.23 -0.78 -0.01 0.00 0.00 0.00 0.00 61.98 61.42 1o5p s VAL 95 Cb -0.12 -3.75 0.00 0.00 0.00 0.00 0.00 36.38 32.51 1o5p s VAL 95 CO 0.14 -0.29 0.17 0.61 0.00 0.00 0.00 175.10 175.73 1o5p n GLY 96 N 5.08 2.71 3.35 4.51 0.00 -1.05 0.31 105.19 120.09 1o5p n GLY 96 Ca -0.11 -1.43 -0.24 0.00 0.00 0.00 0.00 46.02 44.23 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 -3.62 0.99 4.32 -1.24 -2.15 117.00 115.31 1o5p n LEU 97 Ca -0.00 -2.60 -0.00 0.00 -0.02 0.00 0.00 56.01 53.38 1o5p n LEU 97 Cb 0.20 0.04 -0.01 0.00 -1.62 0.00 0.00 43.42 42.03 1o5p n LEU 97 CO 0.10 -0.52 1.03 -0.94 -1.22 0.00 0.00 177.39 175.84 1o5p s SER 98 N -3.79 -0.08 0.00 -1.43 1.04 -0.29 -4.34 113.70 104.81 1o5p s SER 98 Ca 0.22 -0.11 0.00 0.00 0.48 0.00 0.00 55.95 56.54 1o5p s SER 98 Cb -0.02 0.17 0.00 0.00 0.10 0.00 0.00 66.02 66.27 1o5p s SER 98 CO 0.14 -0.31 0.00 -0.90 0.98 0.00 0.00 173.24 173.15 1o5p n ASP 99 N -0.39 1.77 -1.52 7.02 5.75 -1.24 0.27 116.55 128.21 1o5p n ASP 99 Ca -0.06 -0.15 -0.14 0.00 -0.01 0.00 0.00 54.79 54.44 1o5p n ASP 99 Cb 0.62 0.00 0.10 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 4.64 -0.03 2.12 0.00 -1.26 -4.61 120.51 118.37 1o5p n ALA 100 Ca 0.00 -3.54 -0.03 0.00 0.00 0.00 0.00 53.44 49.87 1o5p n ALA 100 Cb 0.00 -0.50 -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 -0.90 1.85 0.00 0.00 0.00 -1.26 -5.01 120.51 115.19 1o5p n ALA 101 Ca 0.37 -0.38 0.00 0.00 0.00 0.00 0.00 53.44 53.43 1o5p n ALA 101 Cb 0.88 0.15 0.00 0.00 0.00 0.00 0.00 19.45 20.48 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 2.70 1.04 2.91 0.00 0.00 -1.26 -5.14 105.19 105.44 1o5p n GLY 102 Ca -0.10 -0.07 -0.06 0.00 0.00 0.00 0.00 46.02 45.80 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 -1.66 -0.15 1.61 5.03 -1.26 -5.00 115.26 113.82 1o5p n ASN 103 Ca 0.00 -2.09 0.00 0.00 0.87 0.00 0.00 54.58 53.36 1o5p n ASN 103 Cb 0.00 2.76 0.00 0.00 -1.02 0.00 0.00 39.78 41.52 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 -0.45 2.28 2.75 7.41 0.00 -1.26 -3.58 105.19 112.34 1o5p n GLY 104 Ca -0.06 -0.75 -0.12 0.00 0.00 0.00 0.00 46.02 45.10 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 -0.71 -1.47 1.61 -0.01 -1.26 -4.92 135.00 128.24 1o5p n PRO 105 Ca 0.00 -0.55 -0.09 0.00 -0.01 0.00 0.00 63.50 62.85 1o5p n PRO 105 Cb 0.00 -1.28 0.05 0.00 -0.01 0.00 0.00 33.50 32.25 1o5p n PRO 105 CO 0.00 0.00 0.00 -0.85 -0.01 0.00 0.00 175.50 174.64 1o5p n GLU 106 N -0.56 0.40 -4.50 -0.52 0.28 -1.26 -4.66 120.64 109.82 1o5p n GLU 106 Ca 0.05 -1.13 -0.24 0.00 -0.16 0.00 0.00 57.16 55.68 1o5p n GLU 106 Cb 0.23 -0.24 -0.10 0.00 1.43 0.00 0.00 31.44 32.75 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 -3.43 2.04 -0.20 -1.84 0.00 -1.26 -3.62 107.32 99.01 1o5p s GLY 107 Ca 0.27 -2.00 -0.09 0.00 0.00 0.00 0.00 44.72 42.89 1o5p s GLY 107 CO 0.18 -1.97 0.12 0.14 0.00 0.00 0.00 173.10 171.57 1o5p s VAL 108 N -2.72 5.26 -0.14 1.40 1.01 0.15 -4.72 120.40 120.64 1o5p s VAL 108 Ca 0.31 0.14 -0.29 0.00 0.00 0.00 0.00 61.98 62.13 1o5p s VAL 108 Cb 0.02 -3.40 -0.03 0.00 0.00 0.00 0.00 36.38 32.97 1o5p s VAL 108 CO 0.15 0.43 1.44 0.00 0.00 0.00 0.00 175.10 177.12 1o5p s ALA 109 N 0.44 3.59 0.46 5.51 0.00 -1.26 0.17 121.76 130.67 1o5p s ALA 109 Ca 0.07 0.61 0.06 0.00 0.00 0.00 0.00 51.96 52.70 1o5p s ALA 109 Cb -0.12 -3.70 0.02 0.00 0.00 0.00 0.00 23.12 19.33 1o5p s ALA 109 CO -0.01 -1.36 0.63 0.96 0.00 0.00 0.00 175.76 175.98 1o5p s ILE 110 N 3.90 2.90 0.05 0.00 -4.36 -1.02 -4.83 121.20 117.84 1o5p s ILE 110 Ca 0.63 -0.90 0.00 0.00 -0.26 0.00 0.00 60.65 60.12 1o5p s ILE 110 Cb -0.26 -3.00 -0.03 0.00 1.25 0.00 0.00 42.46 40.42 1o5p s ILE 110 CO 0.22 0.00 -0.05 -0.55 0.24 0.00 0.00 174.94 174.80 1o5p s SER 111 N -4.37 0.61 -0.33 4.36 0.15 0.18 -4.72 113.70 109.58 1o5p s SER 111 Ca 0.56 -0.76 0.00 0.00 0.70 0.00 0.00 55.95 56.45 1o5p s SER 111 Cb -0.10 0.12 0.10 0.00 -1.71 0.00 0.00 66.02 64.43 1o5p s SER 111 CO 0.35 -0.41 0.10 -0.36 1.20 0.00 0.00 173.24 174.12 1o5p s PHE 112 N -2.64 2.09 -1.91 3.44 0.08 -1.26 -2.92 117.98 114.86 1o5p s PHE 112 Ca -0.02 -2.02 0.00 0.00 0.12 0.00 0.00 56.93 55.01 1o5p s PHE 112 Cb -0.01 -1.94 0.00 0.00 -0.57 0.00 0.00 43.02 40.49 1o5p s PHE 112 CO -0.04 -0.88 0.48 0.27 -0.10 0.00 0.00 175.22 174.94