#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1wln s SER 2 N 0.00 3.94 -0.23 1.61 1.04 -1.26 -5.06 113.70 113.74 1wln s SER 2 Ca 0.00 -2.85 -0.29 0.00 0.48 0.00 0.00 55.95 53.29 1wln s SER 2 Cb 0.00 -1.30 0.16 0.00 0.10 0.00 0.00 66.02 64.98 1wln s SER 2 CO 0.00 -0.24 1.20 -0.44 0.98 0.00 0.00 173.24 174.74 1wln s SER 3 N -0.00 -0.19 0.00 7.02 0.01 -1.26 -4.96 113.70 114.32 1wln s SER 3 Ca 0.18 0.22 0.00 0.00 1.31 0.00 0.00 55.95 57.66 1wln s SER 3 Cb -0.24 0.18 0.00 0.00 0.21 0.00 0.00 66.02 66.17 1wln s SER 3 CO -0.01 -0.16 0.00 0.61 0.41 0.00 0.00 173.24 174.09 1wln n GLY 4 N 0.72 -1.91 2.09 3.44 0.00 -1.26 -5.06 105.19 103.21 1wln n GLY 4 Ca -0.05 0.88 0.00 0.00 0.00 0.00 0.00 46.02 46.85 1wln n GLY 4 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 1wln n SER 5 N 0.00 -3.46 -3.18 1.61 7.64 -1.26 -4.80 113.62 110.17 1wln n SER 5 Ca 0.00 0.76 -0.20 0.00 1.01 0.00 0.00 58.87 60.44 1wln n SER 5 Cb 0.00 3.30 0.02 0.00 -1.01 0.00 0.00 64.21 66.52 1wln n SER 5 CO 0.00 0.00 0.00 -0.24 -3.01 0.00 0.00 175.04 171.79 1wln n SER 6 N -3.28 -6.69 -3.20 6.43 2.88 -1.26 -5.01 113.62 103.49 1wln n SER 6 Ca 0.00 0.30 0.01 0.00 -1.33 0.00 0.00 58.87 57.86 1wln n SER 6 Cb 0.00 -3.21 -0.01 0.00 -0.75 0.00 0.00 64.21 60.24 1wln n SER 6 CO 0.00 0.00 0.00 -0.83 -1.23 0.00 0.00 175.04 172.98 1wln s GLY 7 N -1.78 -1.23 0.41 0.46 0.00 -1.26 -5.00 107.32 98.92 1wln s GLY 7 Ca 0.25 0.38 0.22 0.00 0.00 0.00 0.00 44.72 45.57 1wln s GLY 7 CO 0.71 3.64 1.70 -0.56 0.00 0.00 0.00 173.10 178.60 1wln h PRO 8 N 7.24 0.00 -0.81 2.90 0.13 -2.01 -2.89 132.00 136.57 1wln h PRO 8 Ca 0.03 0.00 -0.11 0.00 -0.87 0.00 0.00 66.00 65.05 1wln h PRO 8 Cb 1.18 0.00 -0.07 0.00 0.13 0.00 0.00 31.00 32.24 1wln h PRO 8 CO 0.12 0.24 0.14 -0.85 -0.23 0.00 0.00 178.00 177.42 1wln n GLU 9 N -3.27 3.08 -2.71 0.86 0.28 -1.26 -4.06 120.64 113.55 1wln n GLU 9 Ca 0.01 -2.11 -0.08 0.00 -0.16 0.00 0.00 57.16 54.82 1wln n GLU 9 Cb 0.52 -1.95 0.10 0.00 1.43 0.00 0.00 31.44 31.54 1wln n GLU 9 CO 0.00 0.00 0.00 1.63 -0.16 0.00 0.00 177.13 178.60 1wln n LYS 10 N 0.09 1.16 -4.16 3.44 5.02 -1.09 -4.98 118.16 117.64 1wln n LYS 10 Ca 0.26 -2.02 -0.31 0.00 -2.02 0.00 0.00 58.31 54.22 1wln n LYS 10 Cb 1.03 -0.34 -0.08 0.00 -0.02 0.00 0.00 35.03 35.61 1wln n LYS 10 CO 0.00 0.00 0.00 -0.51 -0.52 0.00 0.00 177.40 176.37 1wln s LEU 11 N -3.04 3.54 0.29 -0.35 1.43 -1.25 -3.15 118.68 116.15 1wln s LEU 11 Ca 0.23 -0.09 -0.29 0.00 -1.03 0.00 0.00 54.13 52.95 1wln s LEU 11 Cb 0.39 -2.19 -0.09 0.00 0.03 0.00 0.00 46.19 44.33 1wln s LEU 11 CO -0.07 0.21 1.08 -2.16 0.23 0.00 0.00 176.35 175.64 1wln s PRO 12 N -2.08 4.59 0.19 1.29 0.04 -1.25 -4.14 135.00 133.64 1wln s PRO 12 Ca 0.24 1.73 -0.00 0.00 0.04 0.00 0.00 61.00 63.02 1wln s PRO 12 Cb -0.12 -3.10 -0.04 0.00 0.04 0.00 0.00 34.50 31.28 1wln s PRO 12 CO 0.16 0.19 0.08 1.52 0.04 0.00 0.00 177.00 178.99 1wln s TYR 13 N -1.24 1.19 -0.21 0.56 -0.85 -0.66 0.86 117.35 117.00 1wln s TYR 13 Ca 0.46 -1.24 -0.00 0.00 -0.52 0.00 0.00 57.07 55.77 1wln s TYR 13 Cb -0.30 -0.65 0.02 0.00 0.38 0.00 0.00 41.96 41.41 1wln s TYR 13 CO 0.38 -0.47 -0.13 -0.51 -1.52 0.00 0.00 175.55 173.30 1wln s LEU 14 N -3.17 2.61 -0.41 -3.49 1.43 -0.76 0.15 118.68 115.04 1wln s LEU 14 Ca 0.33 -0.69 -0.13 0.00 -1.03 0.00 0.00 54.13 52.61 1wln s LEU 14 Cb 0.07 -1.58 0.05 0.00 0.03 0.00 0.00 46.19 44.76 1wln s LEU 14 CO 0.09 -0.04 0.28 0.54 0.23 0.00 0.00 176.35 177.45 1wln s VAL 15 N 1.33 4.85 0.18 -1.59 0.11 0.06 -3.00 120.40 122.34 1wln s VAL 15 Ca 0.03 -0.95 -0.32 0.00 -2.93 0.00 0.00 61.98 57.81 1wln s VAL 15 Cb -0.15 -3.79 -0.16 0.00 -1.53 0.00 0.00 36.38 30.75 1wln s VAL 15 CO -0.08 -0.38 1.08 1.21 -3.33 0.00 0.00 175.10 173.59 1wln n GLU 16 N 5.08 1.03 -4.35 1.54 2.13 -1.11 -1.67 120.64 123.29 1wln n GLU 16 Ca -0.11 0.37 -0.24 0.00 0.66 0.00 0.00 57.16 57.83 1wln n GLU 16 Cb 0.45 -1.80 -0.09 0.00 0.27 0.00 0.00 31.44 30.28 1wln n GLU 16 CO 0.00 0.00 0.00 -0.51 -0.41 0.00 0.00 177.13 176.21 1wln s LEU 17 N 0.80 2.96 1.20 4.31 1.43 0.22 -4.67 118.68 124.93 1wln s LEU 17 Ca 0.71 -0.96 -0.17 0.00 -1.03 0.00 0.00 54.13 52.68 1wln s LEU 17 Cb -0.86 -1.36 0.24 0.00 0.03 0.00 0.00 46.19 44.24 1wln s LEU 17 CO 0.54 -0.18 0.57 -0.24 0.23 0.00 0.00 176.35 177.27 1wln n SER 18 N -0.91 -2.50 0.00 2.29 2.88 -0.34 -4.39 113.62 110.65 1wln n SER 18 Ca -0.05 -0.30 0.11 0.00 -1.33 0.00 0.00 58.87 57.31 1wln n SER 18 Cb 0.62 -1.06 0.67 0.00 -0.75 0.00 0.00 64.21 63.68 1wln n SER 18 CO 0.00 0.00 0.00 -0.81 -1.23 0.00 0.00 175.04 173.00 1wln n PRO 19 N -3.84 0.75 -0.00 -1.46 -0.04 -1.26 -2.03 135.00 127.12 1wln n PRO 19 Ca 0.03 0.00 0.05 0.00 -0.04 0.00 0.00 63.50 63.54 1wln n PRO 19 Cb 0.56 -1.47 -0.07 0.00 -0.04 0.00 0.00 33.50 32.49 1wln n PRO 19 CO 0.00 0.00 0.00 -0.25 -0.04 0.00 0.00 175.50 175.21 1wln n ASP 20 N -0.97 1.85 -0.04 3.54 8.00 -1.26 -5.00 116.55 122.68 1wln n ASP 20 Ca 0.17 -0.28 0.00 0.00 0.71 0.00 0.00 54.79 55.39 1wln n ASP 20 Cb 0.08 1.28 0.00 0.00 -0.02 0.00 0.00 41.12 42.46 1wln n ASP 20 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1wln n GLY 21 N 1.66 1.41 3.44 0.44 0.00 -0.86 -5.10 105.19 106.18 1wln n GLY 21 Ca -0.00 -0.22 -0.22 0.00 0.00 0.00 0.00 46.02 45.57 1wln n GLY 21 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1wln s SER 22 N -2.26 3.02 -0.63 1.61 0.01 -1.26 -4.87 113.70 109.32 1wln s SER 22 Ca 0.00 -1.15 -0.15 0.00 1.31 0.00 0.00 55.95 55.96 1wln s SER 22 Cb 0.00 -0.21 0.16 0.00 0.21 0.00 0.00 66.02 66.17 1wln s SER 22 CO 0.00 -0.25 0.58 -1.81 0.41 0.00 0.00 173.24 172.18 1wln s ASP 23 N -3.46 6.37 1.32 2.44 1.11 -1.26 -1.20 116.67 121.98 1wln s ASP 23 Ca 0.29 -2.07 -0.20 0.00 0.18 0.00 0.00 52.55 50.75 1wln s ASP 23 Cb 0.02 -2.21 0.32 0.00 1.07 0.00 0.00 42.92 42.12 1wln s ASP 23 CO 0.12 -0.77 0.72 -0.24 1.18 0.00 0.00 175.17 176.18 1wln n SER 24 N 4.85 -3.81 -2.95 0.27 2.88 -1.26 -4.82 113.62 108.78 1wln n SER 24 Ca -0.05 -0.72 -0.33 0.00 -1.33 0.00 0.00 58.87 56.44 1wln n SER 24 Cb 0.42 -0.92 -0.03 0.00 -0.75 0.00 0.00 64.21 62.93 1wln n SER 24 CO 0.00 0.00 0.00 0.54 -1.23 0.00 0.00 175.04 174.35 1wln n ARG 25 N -4.45 3.44 -3.99 -1.46 1.74 -1.26 -4.86 116.66 105.82 1wln n ARG 25 Ca 0.11 -2.85 -0.13 0.00 -0.77 0.00 0.00 57.85 54.21 1wln n ARG 25 Cb 0.50 -2.37 -0.02 0.00 -1.02 0.00 0.00 32.46 29.55 1wln n ARG 25 CO 0.00 0.00 0.00 -0.51 -1.52 0.00 0.00 177.63 175.60 1wln s ASP 26 N 0.40 0.69 -0.42 0.55 1.01 -1.26 -5.13 116.67 112.52 1wln s ASP 26 Ca 0.57 -1.42 -0.10 0.00 0.71 0.00 0.00 52.55 52.31 1wln s ASP 26 Cb 0.29 0.74 0.07 0.00 1.01 0.00 0.00 42.92 45.03 1wln s ASP 26 CO -0.16 -1.46 0.27 -0.54 0.21 0.00 0.00 175.17 173.49 1wln s LYS 27 N -2.68 2.68 0.88 8.23 1.02 -1.26 -5.08 119.74 123.53 1wln s LYS 27 Ca 0.26 -1.40 -0.12 0.00 0.02 0.00 0.00 55.97 54.72 1wln s LYS 27 Cb -0.02 -3.82 0.12 0.00 -0.52 0.00 0.00 37.83 33.59 1wln s LYS 27 CO 0.18 -0.93 1.13 -1.25 -0.92 0.00 0.00 175.35 173.56 1wln s PRO 28 N 1.47 1.38 0.68 -1.68 0.04 -1.26 -5.02 135.00 130.61 1wln s PRO 28 Ca 0.03 0.38 -0.15 0.00 0.04 0.00 0.00 61.00 61.30 1wln s PRO 28 Cb -0.23 -1.86 0.01 0.00 0.04 0.00 0.00 34.50 32.47 1wln s PRO 28 CO 0.03 -2.05 1.14 0.15 0.04 0.00 0.00 177.00 176.31 1wln s LYS 29 N -5.25 2.58 0.11 4.56 -0.14 -1.26 -4.86 119.74 115.49 1wln s LYS 29 Ca 0.63 1.50 0.06 0.00 -1.36 0.00 0.00 55.97 56.79 1wln s LYS 29 Cb -0.15 -1.91 -0.04 0.00 -1.68 0.00 0.00 37.83 34.05 1wln s LYS 29 CO 0.53 -1.44 -0.13 -1.17 -0.76 0.00 0.00 175.35 172.38 1wln s LEU 30 N -4.97 2.39 -0.26 3.17 1.98 -1.26 -2.73 118.68 117.00 1wln s LEU 30 Ca 0.69 -0.79 -0.01 0.00 -2.89 0.00 0.00 54.13 51.12 1wln s LEU 30 Cb -0.23 -0.51 0.14 0.00 0.66 0.00 0.00 46.19 46.24 1wln s LEU 30 CO 0.43 -0.16 0.35 -0.31 -1.89 0.00 0.00 176.35 174.78 1wln s TYR 31 N -2.11 -0.75 -0.13 5.38 2.02 -1.16 -4.96 117.35 115.64 1wln s TYR 31 Ca 0.07 0.50 -0.29 0.00 -0.37 0.00 0.00 57.07 56.98 1wln s TYR 31 Cb -0.05 -0.13 -0.01 0.00 -0.40 0.00 0.00 41.96 41.36 1wln s TYR 31 CO 0.03 -0.79 1.08 1.03 -1.57 0.00 0.00 175.55 175.32 1wln s ARG 32 N 2.49 4.35 -1.28 -0.62 0.52 -1.26 -1.82 118.95 121.33 1wln s ARG 32 Ca 0.11 1.46 -0.16 0.00 -0.52 0.00 0.00 55.73 56.62 1wln s ARG 32 Cb -0.15 -3.59 0.11 0.00 0.52 0.00 0.00 34.95 31.84 1wln s ARG 32 CO -0.21 -0.46 1.68 1.28 0.02 0.00 0.00 175.30 177.61 1wln n LEU 33 N 5.53 5.23 -4.67 2.53 4.77 0.25 -4.97 117.00 125.67 1wln n LEU 33 Ca 0.10 -4.15 -0.31 0.00 -0.03 0.00 0.00 56.01 51.62 1wln n LEU 33 Cb 0.47 -1.69 0.16 0.00 -2.33 0.00 0.00 43.42 40.04 1wln n LEU 33 CO 0.53 0.46 0.69 -1.10 -1.33 0.00 0.00 177.39 176.64 1wln s GLN 34 N 3.10 1.07 0.84 3.23 -0.21 -1.26 -4.50 119.66 121.92 1wln s GLN 34 Ca 0.49 1.60 -0.17 0.00 0.02 0.00 0.00 55.36 57.30 1wln s GLN 34 Cb 0.03 -1.73 -0.13 0.00 1.00 0.00 0.00 33.01 32.17 1wln s GLN 34 CO 0.04 -2.61 -0.47 1.28 -2.12 0.00 0.00 175.29 171.41 1wln n LEU 35 N -4.12 -4.67 0.00 2.90 4.77 -1.26 -4.73 117.00 109.89 1wln n LEU 35 Ca 0.12 0.35 0.00 0.00 -0.03 0.00 0.00 56.01 56.45 1wln n LEU 35 Cb 0.52 -0.83 0.00 0.00 -2.33 0.00 0.00 43.42 40.77 1wln n LEU 35 CO 0.49 -5.40 0.00 -1.20 -1.33 0.00 0.00 177.39 169.95 1wln n SER 36 N 2.75 0.00 -4.77 -1.43 7.64 -1.26 -4.93 113.62 111.62 1wln n SER 36 Ca 0.02 0.00 -0.38 0.00 1.01 0.00 0.00 58.87 59.52 1wln n SER 36 Cb 0.53 0.00 -0.00 0.00 -1.01 0.00 0.00 64.21 63.72 1wln n SER 36 CO 0.00 0.00 0.00 0.54 -3.01 0.00 0.00 175.04 172.57 1wln s VAL 37 N -2.81 2.94 -0.29 0.44 0.11 -1.26 -4.10 120.40 115.43 1wln s VAL 37 Ca 0.00 0.73 0.01 0.00 -2.93 0.00 0.00 61.98 59.80 1wln s VAL 37 Cb 0.00 -3.39 0.08 0.00 -1.53 0.00 0.00 36.38 31.55 1wln s VAL 37 CO 0.00 0.02 0.01 -0.89 -3.33 0.00 0.00 175.10 170.91 1wln s THR 38 N -1.46 1.61 -0.15 5.04 2.01 -0.09 -4.87 115.64 117.73 1wln s THR 38 Ca 0.63 -1.61 -0.29 0.00 0.31 0.00 0.00 61.69 60.72 1wln s THR 38 Cb -0.31 -2.04 -0.01 0.00 0.01 0.00 0.00 72.50 70.14 1wln s THR 38 CO 0.38 -0.39 1.16 -1.61 -0.69 0.00 0.00 174.62 173.47 1wln s GLU 39 N 1.29 4.29 0.13 4.92 8.01 -1.26 0.11 118.70 136.19 1wln s GLU 39 Ca 0.03 1.55 0.02 0.00 0.01 0.00 0.00 54.97 56.59 1wln s GLU 39 Cb -0.19 -3.66 -0.04 0.00 -4.31 0.00 0.00 34.13 25.94 1wln s GLU 39 CO -0.11 -0.58 0.23 0.08 0.01 0.00 0.00 175.26 174.89 1wln s VAL 40 N 2.93 5.15 -4.20 2.63 1.01 0.40 -3.38 120.40 124.94 1wln s VAL 40 Ca 0.51 -0.70 0.00 0.00 0.00 0.00 0.00 61.98 61.80 1wln s VAL 40 Cb -0.20 -3.61 0.00 0.00 0.00 0.00 0.00 36.38 32.57 1wln s VAL 40 CO 0.15 -0.03 0.00 0.61 0.00 0.00 0.00 175.10 175.82 1wln n GLY 41 N -0.28 0.35 0.00 4.51 0.00 -1.12 -0.46 105.19 108.20 1wln n GLY 41 Ca -0.07 -1.31 0.05 0.00 0.00 0.00 0.00 46.02 44.69 1wln n GLY 41 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1wln n THR 42 N 7.55 0.00 -1.70 2.61 -2.24 -0.05 0.14 114.28 120.59 1wln n THR 42 Ca 0.00 -0.25 -0.31 0.00 -2.27 0.00 0.00 64.05 61.22 1wln n THR 42 Cb 0.00 0.76 0.05 0.00 -2.10 0.00 0.00 70.33 69.04 1wln n THR 42 CO 0.00 0.00 0.00 -0.70 -0.57 0.00 0.00 175.07 173.80 1wln s GLU 43 N -2.21 2.88 -0.39 -0.78 -6.30 -1.19 -4.90 118.70 105.80 1wln s GLU 43 Ca 0.01 0.73 -0.02 0.00 -2.50 0.00 0.00 54.97 53.19 1wln s GLU 43 Cb 0.07 -2.00 0.10 0.00 0.00 0.00 0.00 34.13 32.31 1wln s GLU 43 CO 0.43 -1.08 0.17 0.21 0.02 0.00 0.00 175.26 175.01 1wln s LYS 44 N -5.17 2.02 -0.11 4.30 2.20 -1.26 -4.85 119.74 116.87 1wln s LYS 44 Ca 0.58 -1.75 -0.03 0.00 -0.36 0.00 0.00 55.97 54.41 1wln s LYS 44 Cb -0.13 -3.52 -0.25 0.00 -1.51 0.00 0.00 37.83 32.42 1wln s LYS 44 CO 0.54 -1.01 0.39 1.19 -0.36 0.00 0.00 175.35 176.09 1wln n PHE 45 N 4.58 1.14 -3.46 4.03 3.01 -1.26 -5.04 117.46 120.46 1wln n PHE 45 Ca -0.03 0.27 -0.03 0.00 1.01 0.00 0.00 57.45 58.67 1wln n PHE 45 Cb 0.42 -1.16 -0.00 0.00 -0.01 0.00 0.00 39.48 38.73 1wln n PHE 45 CO 0.00 0.00 0.00 -0.25 1.01 0.00 0.00 176.76 177.52 1wln n ASP 46 N -3.38 -0.36 0.05 4.37 9.92 -1.26 -5.05 116.55 120.84 1wln n ASP 46 Ca -0.30 -1.37 -0.11 0.00 -0.53 0.00 0.00 54.79 52.49 1wln n ASP 46 Cb 1.05 0.64 -0.13 0.00 -0.64 0.00 0.00 41.12 42.03 1wln n ASP 46 CO 0.00 0.00 0.00 -0.78 0.13 0.00 0.00 177.20 176.55 1wln h ASP 47 N 0.41 0.14 -2.28 -2.24 1.82 -2.02 -3.34 116.42 108.91 1wln h ASP 47 Ca -0.06 -0.18 -0.80 0.00 -0.39 0.00 0.00 57.03 55.60 1wln h ASP 47 Cb 0.25 -0.05 -0.28 0.00 0.68 0.00 0.00 39.33 39.94 1wln h ASP 47 CO 0.08 1.15 0.95 0.59 -1.61 0.00 0.00 179.24 180.40 1wln n ASN 48 N -3.34 7.19 -4.22 2.28 3.02 -1.26 -4.96 115.26 113.97 1wln n ASN 48 Ca -0.08 -3.68 -0.20 0.00 -0.03 0.00 0.00 54.58 50.60 1wln n ASN 48 Cb 1.00 -1.15 -0.12 0.00 -0.61 0.00 0.00 39.78 38.90 1wln n ASN 48 CO 0.00 0.00 0.00 -0.44 -2.62 0.00 0.00 177.26 174.20 1wln s SER 49 N -1.46 1.98 -0.09 6.41 0.01 -1.26 -4.85 113.70 114.45 1wln s SER 49 Ca 0.39 -0.69 -0.28 0.00 1.31 0.00 0.00 55.95 56.68 1wln s SER 49 Cb 0.19 -0.08 -0.02 0.00 0.21 0.00 0.00 66.02 66.32 1wln s SER 49 CO -0.12 -0.06 0.91 -0.63 0.41 0.00 0.00 173.24 173.74 1wln s ILE 50 N -1.51 4.87 -0.40 1.44 1.01 -1.22 -5.01 121.20 120.39 1wln s ILE 50 Ca 0.03 1.85 0.01 0.00 0.00 0.00 0.00 60.65 62.54 1wln s ILE 50 Cb -0.08 -4.23 0.11 0.00 0.01 0.00 0.00 42.46 38.27 1wln s ILE 50 CO 0.03 0.09 0.15 -1.58 0.00 0.00 0.00 174.94 173.64 1wln s GLN 51 N 1.57 1.80 -0.01 2.79 0.74 -1.26 -2.78 119.66 122.52 1wln s GLN 51 Ca 0.45 -1.94 -0.07 0.00 0.05 0.00 0.00 55.36 53.85 1wln s GLN 51 Cb -0.18 -3.41 -0.05 0.00 1.10 0.00 0.00 33.01 30.47 1wln s GLN 51 CO 0.19 -1.02 0.25 -0.51 -0.55 0.00 0.00 175.29 173.65 1wln s LEU 52 N 0.87 4.38 -0.15 3.68 1.43 0.37 -4.97 118.68 124.28 1wln s LEU 52 Ca 0.11 0.54 -0.02 0.00 -1.03 0.00 0.00 54.13 53.73 1wln s LEU 52 Cb -0.21 -2.59 0.05 0.00 0.03 0.00 0.00 46.19 43.47 1wln s LEU 52 CO -0.06 0.28 0.01 -0.36 0.23 0.00 0.00 176.35 176.45 1wln s PHE 53 N -1.26 1.08 0.19 0.29 0.08 -1.26 -3.82 117.98 113.27 1wln s PHE 53 Ca 0.26 -0.72 -0.18 0.00 0.12 0.00 0.00 56.93 56.40 1wln s PHE 53 Cb -0.13 -1.03 0.03 0.00 -0.57 0.00 0.00 43.02 41.33 1wln s PHE 53 CO 0.15 -0.54 0.53 0.20 -0.10 0.00 0.00 175.22 175.46 1wln s GLY 54 N 1.84 -0.20 -1.22 4.36 0.00 -1.26 -5.01 107.32 105.83 1wln s GLY 54 Ca 0.01 -0.09 -0.20 0.00 0.00 0.00 0.00 44.72 44.44 1wln s GLY 54 CO -0.07 -0.19 1.88 -1.55 0.00 0.00 0.00 173.10 173.17 1wln n PRO 55 N -0.34 2.37 0.00 2.90 -0.04 -1.26 -2.90 135.00 135.72 1wln n PRO 55 Ca -0.11 -2.76 0.00 0.00 -0.04 0.00 0.00 63.50 60.59 1wln n PRO 55 Cb 0.63 -3.52 0.00 0.00 -0.04 0.00 0.00 33.50 30.57 1wln n PRO 55 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 1wln n GLY 56 N 5.35 0.29 3.42 0.55 0.00 -1.26 -5.02 105.19 108.52 1wln n GLY 56 Ca 0.48 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 46.22 1wln n GLY 56 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1wln s ILE 57 N -0.45 2.35 0.52 -0.61 -1.09 -1.14 -4.40 121.20 116.38 1wln s ILE 57 Ca 0.00 -1.91 0.04 0.00 -2.23 0.00 0.00 60.65 56.55 1wln s ILE 57 Cb 0.00 -2.10 0.01 0.00 -1.58 0.00 0.00 42.46 38.80 1wln s ILE 57 CO 0.00 -0.04 0.26 -1.10 -1.23 0.00 0.00 174.94 172.83 1wln s GLN 58 N -2.44 2.24 -0.06 2.79 -1.52 -1.26 -4.93 119.66 114.47 1wln s GLN 58 Ca 0.18 -2.12 -0.12 0.00 -1.95 0.00 0.00 55.36 51.35 1wln s GLN 58 Cb -0.09 -1.91 -0.08 0.00 -0.22 0.00 0.00 33.01 30.71 1wln s GLN 58 CO 0.09 -0.48 0.49 -1.00 -0.25 0.00 0.00 175.29 174.13 1wln h PRO 59 N 1.01 -0.28 -3.31 2.91 0.13 -1.92 -0.11 132.00 130.42 1wln h PRO 59 Ca -0.40 0.02 -0.79 0.00 -0.87 0.00 0.00 66.00 63.97 1wln h PRO 59 Cb 1.30 0.06 -0.29 0.00 0.13 0.00 0.00 31.00 32.20 1wln h PRO 59 CO 0.64 -0.08 0.47 1.58 -0.23 0.00 0.00 178.00 180.38 1wln n HIS 60 N -4.96 4.25 0.00 1.56 -0.00 -1.26 -2.97 115.22 111.84 1wln n HIS 60 Ca -0.05 -3.56 0.00 0.00 0.46 0.00 0.00 57.72 54.57 1wln n HIS 60 Cb 0.17 -1.49 0.00 0.00 -0.12 0.00 0.00 29.99 28.55 1wln n HIS 60 CO 0.00 0.00 0.00 1.58 0.46 0.00 0.00 176.34 178.38 1wln n HIS 61 N 2.19 0.00 -3.94 1.57 -0.00 0.40 -3.11 115.22 112.33 1wln n HIS 61 Ca 0.25 0.00 -0.10 0.00 0.46 0.00 0.00 57.72 58.32 1wln n HIS 61 Cb 0.37 -0.47 -0.02 0.00 -0.12 0.00 0.00 29.99 29.75 1wln n HIS 61 CO 0.00 0.00 0.00 0.00 0.46 0.00 0.00 176.34 176.80 1wln s ASP 63 N -3.07 2.70 -0.31 0.00 1.01 0.45 0.15 116.67 117.60 1wln s ASP 63 Ca 0.20 -0.77 0.02 0.00 0.71 0.00 0.00 52.55 52.71 1wln s ASP 63 Cb -0.03 -0.16 0.09 0.00 1.01 0.00 0.00 42.92 43.83 1wln s ASP 63 CO 0.12 0.03 0.04 -0.76 0.21 0.00 0.00 175.17 174.81 1wln s LEU 64 N -2.28 3.50 -0.27 1.23 1.43 0.12 -2.14 118.68 120.26 1wln s LEU 64 Ca 0.12 -1.77 -0.11 0.00 -1.03 0.00 0.00 54.13 51.34 1wln s LEU 64 Cb -0.08 -1.30 -0.05 0.00 0.03 0.00 0.00 46.19 44.79 1wln s LEU 64 CO 0.06 -0.35 0.20 -0.89 0.23 0.00 0.00 176.35 175.59 1wln s THR 65 N 1.23 5.31 -0.49 5.49 2.01 -1.26 -0.91 115.64 127.02 1wln s THR 65 Ca 0.06 0.20 -0.20 0.00 0.31 0.00 0.00 61.69 62.07 1wln s THR 65 Cb -0.18 -3.54 0.05 0.00 0.01 0.00 0.00 72.50 68.84 1wln s THR 65 CO -0.13 0.26 0.65 0.21 -0.69 0.00 0.00 174.62 174.93 1wln s ASN 66 N 1.62 6.26 -0.29 3.53 2.47 -1.26 -3.55 114.94 123.72 1wln s ASN 66 Ca 0.08 -0.70 0.02 0.00 0.42 0.00 0.00 52.86 52.68 1wln s ASN 66 Cb -0.16 -2.31 0.07 0.00 -1.45 0.00 0.00 41.25 37.40 1wln s ASN 66 CO 0.10 -0.88 -0.05 -0.04 -3.72 0.00 0.00 177.10 172.50 1wln s MET 67 N 2.79 2.11 -1.77 0.43 -1.94 0.23 -4.55 119.30 116.59 1wln s MET 67 Ca 0.18 -1.46 0.00 0.00 -1.71 0.00 0.00 55.69 52.70 1wln s MET 67 Cb -0.17 -3.01 0.00 0.00 2.01 0.00 0.00 34.83 33.66 1wln s MET 67 CO 0.14 -0.67 0.00 -0.25 -0.01 0.00 0.00 175.02 174.24 1wln n ASP 68 N 4.42 -5.02 0.00 3.03 8.00 -1.26 -1.08 116.55 124.64 1wln n ASP 68 Ca -0.10 0.39 0.00 0.00 0.71 0.00 0.00 54.79 55.80 1wln n ASP 68 Cb 0.42 -4.01 0.00 0.00 -0.02 0.00 0.00 41.12 37.51 1wln n ASP 68 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1wln n GLY 69 N -0.91 2.95 3.76 0.44 0.00 -1.26 -4.99 105.19 105.18 1wln n GLY 69 Ca -0.17 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.46 1wln n GLY 69 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1wln s VAL 70 N -2.86 3.67 0.04 1.61 1.01 -0.24 -4.83 120.40 118.81 1wln s VAL 70 Ca 0.00 1.55 0.05 0.00 0.00 0.00 0.00 61.98 63.59 1wln s VAL 70 Cb 0.00 -3.94 -0.02 0.00 0.00 0.00 0.00 36.38 32.42 1wln s VAL 70 CO 0.00 0.27 -0.15 -0.69 0.00 0.00 0.00 175.10 174.53 1wln s VAL 71 N -1.32 1.19 -0.08 2.92 1.01 -1.26 0.75 120.40 123.61 1wln s VAL 71 Ca 0.48 -1.07 -0.01 0.00 0.00 0.00 0.00 61.98 61.38 1wln s VAL 71 Cb -0.28 -1.08 0.03 0.00 0.00 0.00 0.00 36.38 35.05 1wln s VAL 71 CO 0.35 0.00 -0.00 0.42 0.00 0.00 0.00 175.10 175.87 1wln s THR 72 N -0.90 0.44 0.02 3.92 -4.23 -1.23 -1.09 115.64 112.57 1wln s THR 72 Ca 0.02 0.06 -0.30 0.00 -1.18 0.00 0.00 61.69 60.28 1wln s THR 72 Cb -0.08 -0.60 -0.06 0.00 1.34 0.00 0.00 72.50 73.10 1wln s THR 72 CO 0.01 0.25 1.35 0.54 -0.54 0.00 0.00 174.62 176.23 1wln s VAL 73 N 1.95 3.75 -0.24 2.29 0.11 -0.50 -4.12 120.40 123.64 1wln s VAL 73 Ca 0.05 1.18 -0.00 0.00 -2.93 0.00 0.00 61.98 60.27 1wln s VAL 73 Cb -0.12 -3.76 0.07 0.00 -1.53 0.00 0.00 36.38 31.04 1wln s VAL 73 CO -0.06 0.03 -0.01 -0.89 -3.33 0.00 0.00 175.10 170.84 1wln s THR 74 N 1.95 1.28 -0.09 5.04 2.01 -0.91 -0.99 115.64 123.93 1wln s THR 74 Ca 0.62 -1.18 -0.30 0.00 0.31 0.00 0.00 61.69 61.15 1wln s THR 74 Cb -0.31 -1.68 -0.03 0.00 0.01 0.00 0.00 72.50 70.49 1wln s THR 74 CO 0.27 -0.23 1.24 -2.16 -0.69 0.00 0.00 174.62 173.04 1wln s PRO 75 N 1.49 4.30 0.15 4.92 0.04 -1.26 -0.41 135.00 144.23 1wln s PRO 75 Ca -0.02 1.69 0.24 0.00 0.04 0.00 0.00 61.00 62.95 1wln s PRO 75 Cb -0.18 -3.64 0.28 0.00 0.04 0.00 0.00 34.50 31.00 1wln s PRO 75 CO -0.09 -0.55 1.28 0.00 0.04 0.00 0.00 177.00 177.67 1wln h ARG 76 N 7.77 0.00 -4.53 4.56 2.47 -1.02 -3.46 114.38 120.18 1wln h ARG 76 Ca -0.31 0.00 -0.41 0.00 -1.26 0.00 0.00 59.98 57.99 1wln h ARG 76 Cb 1.14 0.00 -0.31 0.00 -1.65 0.00 0.00 29.97 29.15 1wln h ARG 76 CO 0.92 0.00 -0.78 -1.12 0.56 0.00 0.00 179.97 179.54 1wln s SER 77 N -4.53 1.12 0.11 7.04 0.01 -1.18 -5.01 113.70 111.26 1wln s SER 77 Ca 0.05 -0.17 -0.14 0.00 1.31 0.00 0.00 55.95 57.00 1wln s SER 77 Cb 0.12 -0.30 -0.09 0.00 0.21 0.00 0.00 66.02 65.96 1wln s SER 77 CO 0.73 0.06 1.40 -0.03 0.41 0.00 0.00 173.24 175.81 1wln h MET 78 N 6.39 0.78 -0.69 12.44 4.05 -1.92 -2.93 114.93 133.05 1wln h MET 78 Ca -0.33 -0.46 0.13 0.00 -0.28 0.00 0.00 59.70 58.76 1wln h MET 78 Cb 1.17 0.04 -0.04 0.00 -0.80 0.00 0.00 31.60 31.97 1wln h MET 78 CO 0.49 1.09 0.46 -0.44 0.23 0.00 0.00 176.91 178.74 1wln h ASP 79 N 0.53 0.37 -1.82 1.39 5.19 -1.98 -3.37 116.42 116.74 1wln h ASP 79 Ca 0.03 0.02 -0.47 0.00 -0.62 0.00 0.00 57.03 55.98 1wln h ASP 79 Cb 1.01 -0.06 -0.03 0.00 0.18 0.00 0.00 39.33 40.43 1wln h ASP 79 CO 0.10 0.21 1.34 0.00 -3.12 0.00 0.00 179.24 177.76 1wln s ALA 80 N -5.39 2.03 -0.20 3.45 0.00 -1.11 -4.91 121.76 115.63 1wln s ALA 80 Ca -0.08 -0.61 -0.29 0.00 0.00 0.00 0.00 51.96 50.98 1wln s ALA 80 Cb 0.20 -4.33 -0.02 0.00 0.00 0.00 0.00 23.12 18.97 1wln s ALA 80 CO 0.76 -4.08 1.49 -1.21 0.00 0.00 0.00 175.76 172.72 1wln s GLU 81 N 7.26 3.97 -0.24 0.00 8.01 -1.26 -4.89 118.70 131.54 1wln s GLU 81 Ca 0.72 1.67 0.00 0.00 0.01 0.00 0.00 54.97 57.37 1wln s GLU 81 Cb -0.13 -3.94 0.07 0.00 -4.31 0.00 0.00 34.13 25.81 1wln s GLU 81 CO 0.20 -1.07 -0.02 0.99 0.01 0.00 0.00 175.26 175.36 1wln s THR 82 N 4.52 1.37 -0.21 3.63 2.01 -1.26 -2.41 115.64 123.29 1wln s THR 82 Ca 0.66 -1.20 -0.03 0.00 0.31 0.00 0.00 61.69 61.43 1wln s THR 82 Cb -0.24 -1.72 -0.00 0.00 0.01 0.00 0.00 72.50 70.55 1wln s THR 82 CO 0.25 -0.19 -0.08 -0.31 -0.69 0.00 0.00 174.62 173.61 1wln s TYR 83 N 1.45 2.92 -0.84 4.92 2.02 -1.01 -2.43 117.35 124.39 1wln s TYR 83 Ca -0.03 -1.08 -0.17 0.00 -0.37 0.00 0.00 57.07 55.43 1wln s TYR 83 Cb -0.18 -2.07 0.17 0.00 -0.40 0.00 0.00 41.96 39.48 1wln s TYR 83 CO -0.08 -0.60 0.90 0.08 -1.57 0.00 0.00 175.55 174.29 1wln s VAL 84 N 1.43 5.16 0.00 0.71 1.01 0.45 -0.80 120.40 128.36 1wln s VAL 84 Ca 0.05 -1.93 0.00 0.00 0.00 0.00 0.00 61.98 60.11 1wln s VAL 84 Cb -0.14 -4.60 0.00 0.00 0.00 0.00 0.00 36.38 31.64 1wln s VAL 84 CO -0.05 -1.23 0.00 -0.67 0.00 0.00 0.00 175.10 173.14 1wln n ASP 85 N 5.31 -1.79 -0.04 3.32 -0.08 -1.06 -3.37 116.55 118.83 1wln n ASP 85 Ca 0.15 0.00 -0.01 0.00 -1.51 0.00 0.00 54.79 53.42 1wln n ASP 85 Cb 0.47 -0.49 -0.00 0.00 2.34 0.00 0.00 41.12 43.44 1wln n ASP 85 CO 0.00 0.00 0.00 0.61 0.12 0.00 0.00 177.20 177.93 1wln n GLY 86 N -0.57 0.48 3.09 0.27 0.00 -1.26 -5.00 105.19 102.20 1wln n GLY 86 Ca 0.00 -0.30 -0.32 0.00 0.00 0.00 0.00 46.02 45.40 1wln n GLY 86 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1wln s GLN 87 N -0.77 2.71 0.55 1.61 -0.21 -1.22 -5.03 119.66 117.31 1wln s GLN 87 Ca 0.00 -0.86 -0.17 0.00 0.02 0.00 0.00 55.36 54.34 1wln s GLN 87 Cb 0.00 -2.53 -0.06 0.00 1.00 0.00 0.00 33.01 31.42 1wln s GLN 87 CO 0.00 -0.28 1.05 0.50 -2.12 0.00 0.00 175.29 174.44 1wln s ARG 88 N 1.30 3.51 0.47 2.91 3.52 -1.26 0.17 118.95 129.57 1wln s ARG 88 Ca 0.03 1.26 0.04 0.00 -0.13 0.00 0.00 55.73 56.93 1wln s ARG 88 Cb -0.14 -2.06 -0.03 0.00 -1.56 0.00 0.00 34.95 31.16 1wln s ARG 88 CO -0.11 -0.66 0.10 0.96 -0.81 0.00 0.00 175.30 174.78 1wln s ILE 89 N -2.27 1.68 0.00 4.11 -4.36 -1.02 -4.87 121.20 114.47 1wln s ILE 89 Ca 0.65 -1.86 0.00 0.00 -0.26 0.00 0.00 60.65 59.18 1wln s ILE 89 Cb -0.16 -2.53 0.00 0.00 1.25 0.00 0.00 42.46 41.01 1wln s ILE 89 CO 0.31 0.00 0.75 -0.24 0.24 0.00 0.00 174.94 176.00 1wln n SER 90 N -1.27 0.00 0.00 4.36 2.88 -1.26 -4.91 113.62 113.42 1wln n SER 90 Ca -0.09 -1.56 0.00 0.00 -1.33 0.00 0.00 58.87 55.88 1wln n SER 90 Cb 0.66 -0.11 0.00 0.00 -0.75 0.00 0.00 64.21 64.01 1wln n SER 90 CO 0.00 0.00 0.00 -1.84 -1.23 0.00 0.00 175.04 171.97 1wln n GLU 91 N 0.00 -2.28 -1.51 -1.46 0.28 -1.26 -5.01 120.64 109.39 1wln n GLU 91 Ca 0.00 0.00 -0.42 0.00 -0.16 0.00 0.00 57.16 56.58 1wln n GLU 91 Cb 0.61 0.00 -0.06 0.00 1.43 0.00 0.00 31.44 33.42 1wln n GLU 91 CO 0.00 0.00 0.00 2.41 -0.16 0.00 0.00 177.13 179.38 1wln n THR 92 N 1.50 0.07 -4.22 3.84 -1.04 -1.25 -4.63 114.28 108.56 1wln n THR 92 Ca 0.00 -0.45 -0.34 0.00 -2.04 0.00 0.00 64.05 61.22 1wln n THR 92 Cb 0.00 -2.02 -0.14 0.00 -1.82 0.00 0.00 70.33 66.35 1wln n THR 92 CO 0.00 0.00 0.00 -0.89 -0.64 0.00 0.00 175.07 173.54 1wln s THR 93 N 9.65 3.12 0.44 12.58 2.01 -0.16 -4.92 115.64 138.36 1wln s THR 93 Ca 1.09 -0.60 -0.24 0.00 0.31 0.00 0.00 61.69 62.25 1wln s THR 93 Cb -0.59 -2.37 -0.10 0.00 0.01 0.00 0.00 72.50 69.44 1wln s THR 93 CO 0.38 0.47 1.05 0.80 -0.69 0.00 0.00 174.62 176.63 1wln n MET 94 N 4.34 1.39 -4.86 4.92 1.56 -1.26 -1.40 117.12 121.80 1wln n MET 94 Ca -0.19 0.50 -0.31 0.00 -0.27 0.00 0.00 57.70 57.43 1wln n MET 94 Cb 0.51 -2.11 -0.13 0.00 2.15 0.00 0.00 33.22 33.64 1wln n MET 94 CO 0.00 0.00 0.00 -0.51 -0.73 0.00 0.00 175.97 174.73 1wln s LEU 95 N -0.87 2.54 -0.03 -0.89 1.43 -0.25 -4.82 118.68 115.79 1wln s LEU 95 Ca 0.64 -0.36 0.05 0.00 -1.03 0.00 0.00 54.13 53.44 1wln s LEU 95 Cb -0.53 -1.49 -0.01 0.00 0.03 0.00 0.00 46.19 44.18 1wln s LEU 95 CO 0.56 0.30 -0.20 -1.10 0.23 0.00 0.00 176.35 176.14 1wln s GLN 96 N -1.04 1.87 0.01 1.70 -0.21 -1.26 -4.55 119.66 116.19 1wln s GLN 96 Ca 0.13 -0.71 -0.38 0.00 0.02 0.00 0.00 55.36 54.41 1wln s GLN 96 Cb -0.10 -1.68 -0.18 0.00 1.00 0.00 0.00 33.01 32.05 1wln s GLN 96 CO 0.02 0.35 1.31 -1.13 -2.12 0.00 0.00 175.29 173.73 1wln n SER 97 N 2.87 1.26 0.00 5.90 3.41 -1.26 -0.48 113.62 125.33 1wln n SER 97 Ca -0.17 1.13 0.00 0.00 -0.26 0.00 0.00 58.87 59.57 1wln n SER 97 Cb 0.53 -1.10 0.00 0.00 -0.26 0.00 0.00 64.21 63.37 1wln n SER 97 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1wln n GLY 98 N 2.45 3.10 3.42 5.00 0.00 0.57 -4.93 105.19 114.80 1wln n GLY 98 Ca 0.20 -0.94 -0.44 0.00 0.00 0.00 0.00 46.02 44.84 1wln n GLY 98 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 173.32 174.35 1wln n MET 99 N 0.00 0.41 -2.70 1.61 2.00 0.37 -4.49 117.12 114.31 1wln n MET 99 Ca 0.00 0.15 -0.24 0.00 0.00 0.00 0.00 57.70 57.60 1wln n MET 99 Cb 0.00 -1.31 0.02 0.00 0.00 0.00 0.00 33.22 31.93 1wln n MET 99 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 175.97 177.00 1wln s ARG 100 N -1.30 2.96 -0.22 0.03 0.52 -1.26 -0.85 118.95 118.83 1wln s ARG 100 Ca 0.62 -0.29 -0.04 0.00 -0.52 0.00 0.00 55.73 55.51 1wln s ARG 100 Cb -0.71 -2.42 0.10 0.00 0.52 0.00 0.00 34.95 32.44 1wln s ARG 100 CO 0.59 -0.49 0.24 -0.51 0.02 0.00 0.00 175.30 175.15 1wln s LEU 101 N -4.77 -0.16 -0.33 2.53 1.02 0.54 -2.57 118.68 114.94 1wln s LEU 101 Ca 0.51 -0.25 -0.14 0.00 0.02 0.00 0.00 54.13 54.27 1wln s LEU 101 Cb -0.10 0.45 -0.02 0.00 0.02 0.00 0.00 46.19 46.54 1wln s LEU 101 CO 0.41 -0.33 0.31 -1.58 0.02 0.00 0.00 176.35 175.18 1wln s GLN 102 N 2.35 3.59 -0.41 1.70 0.74 0.02 0.10 119.66 127.75 1wln s GLN 102 Ca 0.08 -0.47 -0.06 0.00 0.05 0.00 0.00 55.36 54.96 1wln s GLN 102 Cb -0.16 -3.79 0.09 0.00 1.10 0.00 0.00 33.01 30.26 1wln s GLN 102 CO -0.15 -0.46 0.23 -0.06 -0.55 0.00 0.00 175.29 174.30 1wln s PHE 103 N 1.90 3.44 -0.41 1.67 0.08 0.38 -2.39 117.98 122.65 1wln s PHE 103 Ca 0.10 -1.96 -0.02 0.00 0.12 0.00 0.00 56.93 55.17 1wln s PHE 103 Cb -0.17 -3.06 0.00 0.00 -0.57 0.00 0.00 43.02 39.22 1wln s PHE 103 CO 0.11 -0.92 0.21 0.41 -0.10 0.00 0.00 175.22 174.94 1wln n GLY 104 N 4.76 0.41 3.93 4.36 0.00 -1.01 -1.96 105.19 115.68 1wln n GLY 104 Ca -0.07 -0.50 -0.32 0.00 0.00 0.00 0.00 46.02 45.13 1wln n GLY 104 CO 0.00 0.00 0.00 -0.37 0.00 0.00 0.00 173.32 172.95 1wln n THR 105 N -3.46 -0.20 0.00 2.61 5.66 -1.26 -4.46 114.28 113.17 1wln n THR 105 Ca -0.02 -0.10 0.00 0.00 -3.05 0.00 0.00 64.05 60.88 1wln n THR 105 Cb 0.53 -0.50 0.00 0.00 -1.55 0.00 0.00 70.33 68.81 1wln n THR 105 CO 0.00 0.00 0.00 -0.24 -3.05 0.00 0.00 175.07 171.78 1wln n SER 106 N -1.90 0.00 -4.38 1.09 2.88 -1.23 -5.05 113.62 105.03 1wln n SER 106 Ca 0.00 0.00 -0.44 0.00 -1.33 0.00 0.00 58.87 57.10 1wln n SER 106 Cb 0.41 0.15 -0.08 0.00 -0.75 0.00 0.00 64.21 63.94 1wln n SER 106 CO 0.00 0.00 0.00 -1.00 -1.23 0.00 0.00 175.04 172.81 1wln s HIS 107 N -1.63 3.25 -0.17 0.66 4.02 -0.83 -4.88 115.29 115.70 1wln s HIS 107 Ca 0.00 -0.96 -0.06 0.00 1.02 0.00 0.00 55.06 55.05 1wln s HIS 107 Cb 0.00 -3.18 -0.04 0.00 -1.02 0.00 0.00 32.58 28.35 1wln s HIS 107 CO 0.00 -0.80 0.03 0.08 1.02 0.00 0.00 174.74 175.06 1wln s VAL 108 N 1.63 4.48 0.29 -0.90 1.01 -1.26 0.14 120.40 125.80 1wln s VAL 108 Ca 0.04 -0.14 0.03 0.00 0.00 0.00 0.00 61.98 61.91 1wln s VAL 108 Cb -0.24 -3.01 -0.06 0.00 0.00 0.00 0.00 36.38 33.07 1wln s VAL 108 CO 0.06 0.47 0.04 -0.36 0.00 0.00 0.00 175.10 175.31 1wln s PHE 109 N 0.39 1.79 -0.16 5.22 0.40 0.29 0.71 117.98 126.63 1wln s PHE 109 Ca 0.01 -0.97 -0.00 0.00 -0.60 0.00 0.00 56.93 55.37 1wln s PHE 109 Cb -0.13 -1.11 0.04 0.00 0.51 0.00 0.00 43.02 42.33 1wln s PHE 109 CO 0.01 -0.04 -0.06 0.21 0.70 0.00 0.00 175.22 176.04 1wln s LYS 110 N -3.90 1.53 0.19 0.44 2.36 -0.67 0.20 119.74 119.90 1wln s LYS 110 Ca 0.34 -0.49 -0.30 0.00 -2.55 0.00 0.00 55.97 52.97 1wln s LYS 110 Cb 0.07 -1.96 -0.08 0.00 -1.05 0.00 0.00 37.83 34.81 1wln s LYS 110 CO 0.13 -0.39 0.96 0.12 1.55 0.00 0.00 175.35 177.72 1wln s PHE 111 N 1.62 3.90 0.12 4.03 2.19 -0.03 -0.76 117.98 129.05 1wln s PHE 111 Ca 0.02 1.86 0.04 0.00 0.33 0.00 0.00 56.93 59.18 1wln s PHE 111 Cb -0.15 -3.03 -0.04 0.00 -1.31 0.00 0.00 43.02 38.50 1wln s PHE 111 CO -0.08 0.29 -0.11 0.54 1.83 0.00 0.00 175.22 177.70 1wln s VAL 112 N -0.73 1.08 -0.33 3.12 0.11 0.12 0.21 120.40 123.98 1wln s VAL 112 Ca 0.44 -1.79 -0.01 0.00 -2.93 0.00 0.00 61.98 57.69 1wln s VAL 112 Cb -0.25 -1.54 0.12 0.00 -1.53 0.00 0.00 36.38 33.17 1wln s VAL 112 CO 0.32 -0.59 0.16 -0.62 -3.33 0.00 0.00 175.10 171.04 1wln s ASP 113 N -2.67 3.49 0.00 3.54 -1.08 -1.26 -1.65 116.67 117.04 1wln s ASP 113 Ca 0.10 -1.82 0.23 0.00 -0.52 0.00 0.00 52.55 50.53 1wln s ASP 113 Cb -0.02 -0.57 1.35 0.00 -1.46 0.00 0.00 42.92 42.23 1wln s ASP 113 CO 0.01 -0.37 1.74 -0.81 0.52 0.00 0.00 175.17 176.25 1wln n PRO 114 N 4.57 0.75 -0.16 4.34 -0.04 -1.26 -3.11 135.00 140.08 1wln n PRO 114 Ca 0.02 0.00 -0.08 0.00 -0.04 0.00 0.00 63.50 63.40 1wln n PRO 114 Cb 0.39 -1.47 0.07 0.00 -0.04 0.00 0.00 33.50 32.45 1wln n PRO 114 CO 0.00 0.00 0.00 0.77 -0.04 0.00 0.00 175.50 176.23 1wln h SER 115 N 0.00 0.94 0.00 3.54 0.02 -1.85 -3.45 113.55 112.75 1wln h SER 115 Ca 0.00 -0.28 0.00 0.00 -0.84 0.00 0.00 61.79 60.67 1wln h SER 115 Cb 0.00 -0.25 0.00 0.00 0.14 0.00 0.00 62.40 62.29 1wln h SER 115 CO 0.00 1.03 0.00 0.61 -1.14 0.00 0.00 176.83 177.33 1wln n GLY 116 N -0.42 3.04 3.80 -3.77 0.00 -1.18 -5.08 105.19 101.58 1wln n GLY 116 Ca 0.02 -1.51 -0.33 0.00 0.00 0.00 0.00 46.02 44.20 1wln n GLY 116 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1wln s PRO 117 N -5.10 3.57 0.20 1.61 0.04 -1.26 -4.86 135.00 129.19 1wln s PRO 117 Ca 0.00 1.25 0.00 0.00 0.04 0.00 0.00 61.00 62.29 1wln s PRO 117 Cb 0.00 -2.07 0.00 0.00 0.04 0.00 0.00 34.50 32.47 1wln s PRO 117 CO 0.00 -0.61 0.00 0.43 0.04 0.00 0.00 177.00 176.86 1wln n SER 118 N -1.54 -4.71 0.17 6.66 7.64 -1.26 -5.00 113.62 115.58 1wln n SER 118 Ca 0.09 0.36 0.00 0.00 1.01 0.00 0.00 58.87 60.32 1wln n SER 118 Cb 0.53 -2.73 0.00 0.00 -1.01 0.00 0.00 64.21 60.99 1wln n SER 118 CO 0.00 0.00 0.00 -1.20 -3.01 0.00 0.00 175.04 170.83 1wln n SER 119 N -4.36 -3.08 0.00 6.43 7.64 -1.26 -5.18 113.62 113.81 1wln n SER 119 Ca 0.00 0.66 0.00 0.00 1.01 0.00 0.00 58.87 60.54 1wln n SER 119 Cb 0.59 3.00 0.00 0.00 -1.01 0.00 0.00 64.21 66.79 1wln n SER 119 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64