#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1wln n SER 2 N 0.00 1.43 -3.83 1.61 7.64 -1.26 -4.99 113.62 114.22 1wln n SER 2 Ca 0.00 0.22 -0.29 0.00 1.01 0.00 0.00 58.87 59.82 1wln n SER 2 Cb 0.00 -0.51 -0.16 0.00 -1.01 0.00 0.00 64.21 62.53 1wln n SER 2 CO 0.00 0.00 0.00 -0.55 -3.01 0.00 0.00 175.04 171.48 1wln s SER 3 N -6.00 3.23 0.00 6.43 0.15 -1.26 -5.06 113.70 111.18 1wln s SER 3 Ca -0.15 -0.92 0.00 0.00 0.70 0.00 0.00 55.95 55.58 1wln s SER 3 Cb 0.03 -0.85 0.00 0.00 -1.71 0.00 0.00 66.02 63.48 1wln s SER 3 CO 0.22 -0.26 0.00 0.61 1.20 0.00 0.00 173.24 175.01 1wln n GLY 4 N 4.89 3.30 3.35 9.45 0.00 -1.26 -5.14 105.19 119.77 1wln n GLY 4 Ca -0.10 -0.04 -0.28 0.00 0.00 0.00 0.00 46.02 45.60 1wln n GLY 4 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1wln s SER 5 N 1.98 3.05 0.00 1.61 0.01 -1.26 -4.88 113.70 114.22 1wln s SER 5 Ca 0.00 -0.67 0.00 0.00 1.31 0.00 0.00 55.95 56.59 1wln s SER 5 Cb 0.00 -0.22 0.00 0.00 0.21 0.00 0.00 66.02 66.01 1wln s SER 5 CO 0.00 0.18 0.00 -0.24 0.41 0.00 0.00 173.24 173.59 1wln n SER 6 N 1.26 0.00 0.00 2.44 2.88 -1.26 -5.06 113.62 113.88 1wln n SER 6 Ca -0.18 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.36 1wln n SER 6 Cb 0.53 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 63.99 1wln n SER 6 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 1wln n GLY 7 N 0.00 1.23 0.12 0.46 0.00 -1.26 -4.98 105.19 100.75 1wln n GLY 7 Ca 0.00 -0.60 -0.16 0.00 0.00 0.00 0.00 46.02 45.26 1wln n GLY 7 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1wln h PRO 8 N 0.00 0.32 0.00 1.61 0.13 -2.00 -3.09 132.00 128.96 1wln h PRO 8 Ca 0.00 -0.31 0.00 0.00 -0.87 0.00 0.00 66.00 64.82 1wln h PRO 8 Cb 0.00 0.08 0.00 0.00 0.13 0.00 0.00 31.00 31.21 1wln h PRO 8 CO 0.00 0.99 0.00 -0.85 -0.23 0.00 0.00 178.00 177.91 1wln n GLU 9 N -4.37 0.38 -1.31 0.86 0.28 -1.26 -2.77 120.64 112.45 1wln n GLU 9 Ca -0.09 0.06 -0.27 0.00 -0.16 0.00 0.00 57.16 56.69 1wln n GLU 9 Cb 0.57 -1.50 0.12 0.00 1.43 0.00 0.00 31.44 32.06 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 -1.25 2.54 -3.80 3.44 5.02 -1.17 -4.90 118.16 118.04 1wln n LYS 10 Ca 0.12 -3.27 -0.32 0.00 -2.02 0.00 0.00 58.31 52.82 1wln n LYS 10 Cb 0.17 -2.20 -0.05 0.00 -0.02 0.00 0.00 35.03 32.93 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 -3.58 4.33 0.38 -0.35 1.43 -1.12 -2.31 118.68 117.46 1wln s LEU 11 Ca 0.59 0.44 -0.25 0.00 -1.03 0.00 0.00 54.13 53.88 1wln s LEU 11 Cb 0.48 -3.00 -0.09 0.00 0.03 0.00 0.00 46.19 43.61 1wln s LEU 11 CO 0.03 0.15 1.06 -2.16 0.23 0.00 0.00 176.35 175.67 1wln s PRO 12 N -2.37 4.25 0.15 1.29 0.04 -1.25 -4.15 135.00 132.95 1wln s PRO 12 Ca 0.35 1.57 -0.02 0.00 0.04 0.00 0.00 61.00 62.94 1wln s PRO 12 Cb -0.13 -2.66 -0.04 0.00 0.04 0.00 0.00 34.50 31.71 1wln s PRO 12 CO 0.24 -0.08 0.10 1.52 0.04 0.00 0.00 177.00 178.82 1wln s TYR 13 N -1.56 0.87 -0.32 0.56 -0.85 -0.34 0.93 117.35 116.64 1wln s TYR 13 Ca 0.55 -1.21 -0.05 0.00 -0.52 0.00 0.00 57.07 55.84 1wln s TYR 13 Cb -0.24 -0.44 0.04 0.00 0.38 0.00 0.00 41.96 41.70 1wln s TYR 13 CO 0.30 -0.58 0.07 -0.51 -1.52 0.00 0.00 175.55 173.32 1wln s LEU 14 N -3.06 4.16 -0.54 -3.49 1.43 -0.82 0.04 118.68 116.39 1wln s LEU 14 Ca 0.27 -1.15 -0.19 0.00 -1.03 0.00 0.00 54.13 52.02 1wln s LEU 14 Cb 0.07 -1.82 0.07 0.00 0.03 0.00 0.00 46.19 44.54 1wln s LEU 14 CO 0.04 -0.30 0.67 0.54 0.23 0.00 0.00 176.35 177.54 1wln s VAL 15 N 1.36 4.82 -0.03 -1.59 0.11 0.14 -2.90 120.40 122.31 1wln s VAL 15 Ca -0.03 -0.63 -0.39 0.00 -2.93 0.00 0.00 61.98 58.00 1wln s VAL 15 Cb -0.19 -4.39 -0.18 0.00 -1.53 0.00 0.00 36.38 30.09 1wln s VAL 15 CO 0.02 -0.95 1.29 1.21 -3.33 0.00 0.00 175.10 173.34 1wln n GLU 16 N 6.33 0.61 -4.13 1.54 2.13 -0.99 -1.80 120.64 124.33 1wln n GLU 16 Ca -0.07 0.22 -0.22 0.00 0.66 0.00 0.00 57.16 57.74 1wln n GLU 16 Cb 0.44 -1.80 -0.06 0.00 0.27 0.00 0.00 31.44 30.30 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 0.78 3.46 1.31 4.31 1.43 0.16 -4.67 118.68 125.46 1wln s LEU 17 Ca 0.90 -0.53 -0.19 0.00 -1.03 0.00 0.00 54.13 53.28 1wln s LEU 17 Cb -1.13 -1.98 0.31 0.00 0.03 0.00 0.00 46.19 43.42 1wln s LEU 17 CO 0.55 -0.12 0.78 -0.24 0.23 0.00 0.00 176.35 177.55 1wln n SER 18 N -1.10 -3.17 0.00 2.29 2.88 -0.59 -4.39 113.62 109.53 1wln n SER 18 Ca -0.05 -0.54 0.12 0.00 -1.33 0.00 0.00 58.87 57.06 1wln n SER 18 Cb 0.59 -1.05 0.64 0.00 -0.75 0.00 0.00 64.21 63.64 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 -4.80 0.54 -0.00 -1.46 -0.04 -1.26 -2.29 135.00 125.69 1wln n PRO 19 Ca 0.08 0.03 0.05 0.00 -0.04 0.00 0.00 63.50 63.62 1wln n PRO 19 Cb 0.56 -1.50 -0.07 0.00 -0.04 0.00 0.00 33.50 32.45 1wln n PRO 19 CO 0.00 0.00 0.00 -3.47 -0.04 0.00 0.00 175.50 171.99 1wln n ASP 20 N -1.14 2.72 -0.03 3.54 2.03 -1.26 -5.01 116.55 117.40 1wln n ASP 20 Ca 0.14 -0.06 0.00 0.00 0.52 0.00 0.00 54.79 55.40 1wln n ASP 20 Cb 0.13 1.38 0.00 0.00 -0.72 0.00 0.00 41.12 41.91 1wln n ASP 20 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 1wln n GLY 21 N 1.92 1.34 3.45 0.27 0.00 -0.97 -5.11 105.19 106.08 1wln n GLY 21 Ca -0.01 -0.07 -0.22 0.00 0.00 0.00 0.00 46.02 45.72 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 -2.09 3.01 -0.67 1.61 0.01 -1.26 -4.84 113.70 109.47 1wln s SER 22 Ca 0.00 -1.16 -0.19 0.00 1.31 0.00 0.00 55.95 55.91 1wln s SER 22 Cb 0.00 -0.21 0.12 0.00 0.21 0.00 0.00 66.02 66.13 1wln s SER 22 CO 0.00 -0.26 0.79 1.51 0.41 0.00 0.00 173.24 175.69 1wln s ASP 23 N -3.47 6.30 1.16 2.44 -4.77 -1.26 -1.54 116.67 115.53 1wln s ASP 23 Ca 0.29 -1.60 -0.17 0.00 -3.30 0.00 0.00 52.55 47.77 1wln s ASP 23 Cb 0.02 -2.32 0.20 0.00 -1.09 0.00 0.00 42.92 39.73 1wln s ASP 23 CO 0.12 -1.09 0.37 -1.54 0.70 0.00 0.00 175.17 173.74 1wln n SER 24 N 6.26 -2.85 -2.85 2.11 3.41 -1.26 -4.80 113.62 113.65 1wln n SER 24 Ca -0.02 -0.36 -0.30 0.00 -0.26 0.00 0.00 58.87 57.93 1wln n SER 24 Cb 0.44 -0.93 -0.06 0.00 -0.26 0.00 0.00 64.21 63.40 1wln n SER 24 CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 175.04 175.42 1wln n ARG 25 N -2.98 3.25 -3.40 4.33 1.74 -1.26 -4.83 116.66 113.51 1wln n ARG 25 Ca 0.05 -2.46 -0.08 0.00 -0.77 0.00 0.00 57.85 54.59 1wln n ARG 25 Cb 0.52 -2.38 0.02 0.00 -1.02 0.00 0.00 32.46 29.61 1wln n ARG 25 CO 0.00 0.00 0.00 -0.25 -1.52 0.00 0.00 177.63 175.86 1wln n ASP 26 N 1.83 -1.98 -4.39 0.55 8.00 -1.26 -5.13 116.55 114.18 1wln n ASP 26 Ca 0.57 -2.39 -0.42 0.00 0.71 0.00 0.00 54.79 53.26 1wln n ASP 26 Cb 0.47 3.30 -0.10 0.00 -0.02 0.00 0.00 41.12 44.77 1wln n ASP 26 CO 0.00 0.00 0.00 -0.75 -0.39 0.00 0.00 177.20 176.06 1wln s LYS 27 N -2.09 2.87 0.76 -1.24 2.20 -1.26 -5.07 119.74 115.91 1wln s LYS 27 Ca 0.14 -1.20 -0.11 0.00 -0.36 0.00 0.00 55.97 54.44 1wln s LYS 27 Cb -0.04 -3.92 0.04 0.00 -1.51 0.00 0.00 37.83 32.40 1wln s LYS 27 CO 0.10 -0.85 1.08 -1.25 -0.36 0.00 0.00 175.35 174.08 1wln s PRO 28 N 1.59 2.43 0.63 4.03 0.04 -1.26 -5.02 135.00 137.44 1wln s PRO 28 Ca 0.04 0.77 -0.16 0.00 0.04 0.00 0.00 61.00 61.68 1wln s PRO 28 Cb -0.21 -1.95 -0.01 0.00 0.04 0.00 0.00 34.50 32.37 1wln s PRO 28 CO 0.07 -1.41 1.14 0.15 0.04 0.00 0.00 177.00 176.99 1wln s LYS 29 N -5.11 2.85 0.01 4.56 -0.14 -1.26 -4.84 119.74 115.82 1wln s LYS 29 Ca 0.60 1.55 0.04 0.00 -1.36 0.00 0.00 55.97 56.80 1wln s LYS 29 Cb -0.14 -1.94 -0.01 0.00 -1.68 0.00 0.00 37.83 34.05 1wln s LYS 29 CO 0.55 -1.24 -0.12 -1.17 -0.76 0.00 0.00 175.35 172.60 1wln s LEU 30 N -4.56 2.09 -0.30 3.17 2.96 -1.26 -2.34 118.68 118.44 1wln s LEU 30 Ca 0.71 -0.32 -0.02 0.00 -0.22 0.00 0.00 54.13 54.28 1wln s LEU 30 Cb -0.24 -0.57 0.10 0.00 0.50 0.00 0.00 46.19 45.99 1wln s LEU 30 CO 0.38 0.08 0.10 -0.31 -1.32 0.00 0.00 176.35 175.28 1wln s TYR 31 N -0.56 1.35 0.01 5.38 2.02 -1.14 -4.93 117.35 119.48 1wln s TYR 31 Ca 0.02 -1.51 -0.30 0.00 -0.37 0.00 0.00 57.07 54.92 1wln s TYR 31 Cb -0.06 -1.50 -0.05 0.00 -0.40 0.00 0.00 41.96 39.95 1wln s TYR 31 CO 0.00 -0.86 1.36 1.03 -1.57 0.00 0.00 175.55 175.51 1wln s ARG 32 N 1.74 4.31 -1.25 -0.62 0.52 -1.26 -1.95 118.95 120.44 1wln s ARG 32 Ca 0.09 1.92 -0.15 0.00 -0.52 0.00 0.00 55.73 57.07 1wln s ARG 32 Cb -0.17 -3.53 0.14 0.00 0.52 0.00 0.00 34.95 31.91 1wln s ARG 32 CO -0.28 -0.52 1.57 1.28 0.02 0.00 0.00 175.30 177.37 1wln n LEU 33 N 5.13 5.22 -4.70 2.53 4.77 0.27 -4.96 117.00 125.25 1wln n LEU 33 Ca 0.12 -4.28 -0.33 0.00 -0.03 0.00 0.00 56.01 51.49 1wln n LEU 33 Cb 0.44 -1.66 0.12 0.00 -2.33 0.00 0.00 43.42 40.00 1wln n LEU 33 CO 0.58 0.57 0.76 -1.10 -1.33 0.00 0.00 177.39 176.87 1wln s GLN 34 N 2.42 1.67 0.81 3.23 -0.21 -1.26 -4.58 119.66 121.74 1wln s GLN 34 Ca 0.46 1.68 -0.17 0.00 0.02 0.00 0.00 55.36 57.36 1wln s GLN 34 Cb 0.00 -1.79 -0.15 0.00 1.00 0.00 0.00 33.01 32.08 1wln s GLN 34 CO 0.03 -2.17 -0.56 1.28 -2.12 0.00 0.00 175.29 171.74 1wln n LEU 35 N -3.35 -5.14 0.00 2.90 4.77 -1.26 -4.70 117.00 110.22 1wln n LEU 35 Ca 0.13 0.34 0.00 0.00 -0.03 0.00 0.00 56.01 56.45 1wln n LEU 35 Cb 0.51 -0.78 0.00 0.00 -2.33 0.00 0.00 43.42 40.82 1wln n LEU 35 CO 0.48 -5.52 0.00 -1.20 -1.33 0.00 0.00 177.39 169.83 1wln n SER 36 N 3.10 0.00 -4.76 -1.43 7.64 -1.26 -4.94 113.62 111.97 1wln n SER 36 Ca 0.01 0.00 -0.35 0.00 1.01 0.00 0.00 58.87 59.54 1wln n SER 36 Cb 0.52 0.02 0.02 0.00 -1.01 0.00 0.00 64.21 63.76 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 -3.01 2.89 -0.25 0.44 0.11 -1.26 -4.10 120.40 115.22 1wln s VAL 37 Ca 0.00 0.55 -0.03 0.00 -2.93 0.00 0.00 61.98 59.57 1wln s VAL 37 Cb 0.00 -3.21 0.08 0.00 -1.53 0.00 0.00 36.38 31.72 1wln s VAL 37 CO 0.00 -0.12 0.08 -0.89 -3.33 0.00 0.00 175.10 170.83 1wln s THR 38 N -1.70 0.47 0.07 5.04 2.01 -0.03 -4.87 115.64 116.63 1wln s THR 38 Ca 0.75 -0.84 -0.30 0.00 0.31 0.00 0.00 61.69 61.61 1wln s THR 38 Cb -0.27 -1.19 -0.05 0.00 0.01 0.00 0.00 72.50 70.99 1wln s THR 38 CO 0.30 -0.47 1.09 -1.61 -0.69 0.00 0.00 174.62 173.25 1wln s GLU 39 N 1.85 4.52 0.35 4.92 2.02 -1.26 -0.04 118.70 131.06 1wln s GLU 39 Ca 0.05 1.63 0.08 0.00 0.02 0.00 0.00 54.97 56.74 1wln s GLU 39 Cb -0.17 -3.37 -0.03 0.00 0.10 0.00 0.00 34.13 30.66 1wln s GLU 39 CO -0.20 -0.09 0.27 0.08 0.02 0.00 0.00 175.26 175.34 1wln s VAL 40 N 0.71 3.33 -0.17 2.63 1.01 0.27 -2.61 120.40 125.58 1wln s VAL 40 Ca 0.54 -1.44 0.00 0.00 0.00 0.00 0.00 61.98 61.08 1wln s VAL 40 Cb -0.26 -3.12 0.00 0.00 0.00 0.00 0.00 36.38 32.99 1wln s VAL 40 CO 0.30 -0.16 0.00 0.61 0.00 0.00 0.00 175.10 175.85 1wln n GLY 41 N -1.34 0.36 0.00 4.51 0.00 -1.25 -0.94 105.19 106.53 1wln n GLY 41 Ca -0.02 -1.46 0.01 0.00 0.00 0.00 0.00 46.02 44.56 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 0.31 0.00 -1.78 2.61 -2.24 -0.24 0.19 114.28 113.12 1wln n THR 42 Ca 0.00 -0.39 -0.32 0.00 -2.27 0.00 0.00 64.05 61.07 1wln n THR 42 Cb 0.00 0.94 0.03 0.00 -2.10 0.00 0.00 70.33 69.20 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 -1.38 3.11 -0.28 -0.78 -6.30 -1.21 -4.92 118.70 106.94 1wln s GLU 43 Ca 0.01 1.06 -0.07 0.00 -2.50 0.00 0.00 54.97 53.47 1wln s GLU 43 Cb 0.02 -2.01 -0.00 0.00 0.00 0.00 0.00 34.13 32.14 1wln s GLU 43 CO 0.12 -0.97 0.08 0.21 0.02 0.00 0.00 175.26 174.72 1wln s LYS 44 N -4.62 3.30 -0.03 4.30 2.20 -1.26 -4.83 119.74 118.80 1wln s LYS 44 Ca 0.60 -0.71 0.01 0.00 -0.36 0.00 0.00 55.97 55.51 1wln s LYS 44 Cb -0.15 -3.36 -0.02 0.00 -1.51 0.00 0.00 37.83 32.79 1wln s LYS 44 CO 0.47 -0.35 -0.02 1.19 -0.36 0.00 0.00 175.35 176.28 1wln n PHE 45 N 4.89 0.00 -3.62 4.03 3.72 -1.26 -5.09 117.46 120.13 1wln n PHE 45 Ca -0.15 0.00 -0.07 0.00 -0.05 0.00 0.00 57.45 57.18 1wln n PHE 45 Cb 0.49 -0.13 -0.06 0.00 -0.94 0.00 0.00 39.48 38.85 1wln n PHE 45 CO 0.00 0.00 0.00 0.34 -0.05 0.00 0.00 176.76 177.05 1wln s ASP 46 N -4.12 -0.25 0.51 4.37 -1.08 -1.26 -4.96 116.67 109.88 1wln s ASP 46 Ca -0.04 0.37 0.34 0.00 -0.52 0.00 0.00 52.55 52.70 1wln s ASP 46 Cb 0.01 0.34 1.47 0.00 -1.46 0.00 0.00 42.92 43.28 1wln s ASP 46 CO 0.08 -0.16 1.76 -0.78 0.52 0.00 0.00 175.17 176.59 1wln h ASP 47 N 2.95 0.11 -0.33 -0.34 1.82 -2.01 1.37 116.42 120.00 1wln h ASP 47 Ca -0.20 0.03 -0.14 0.00 -0.39 0.00 0.00 57.03 56.33 1wln h ASP 47 Cb 1.18 0.01 -0.01 0.00 0.68 0.00 0.00 39.33 41.20 1wln h ASP 47 CO 0.21 0.00 -0.32 0.78 -1.61 0.00 0.00 179.24 178.30 1wln h ASN 48 N 0.09 0.85 -3.43 2.28 2.35 -2.00 -3.45 115.58 112.27 1wln h ASN 48 Ca 0.63 -0.47 -0.56 0.00 -0.55 0.00 0.00 56.30 55.35 1wln h ASN 48 Cb 2.29 -0.24 0.18 0.00 0.05 0.00 0.00 38.32 40.61 1wln h ASN 48 CO -0.10 1.14 -0.17 -1.20 -1.65 0.00 0.00 177.43 175.45 1wln n SER 49 N -4.19 -0.43 -4.86 5.81 7.64 0.47 -4.96 113.62 113.11 1wln n SER 49 Ca -0.03 0.64 -0.32 0.00 1.01 0.00 0.00 58.87 60.17 1wln n SER 49 Cb 0.50 -1.30 -0.06 0.00 -1.01 0.00 0.00 64.21 62.35 1wln n SER 49 CO 0.00 0.00 0.00 -0.63 -3.01 0.00 0.00 175.04 171.40 1wln s ILE 50 N -1.84 4.76 -0.32 0.44 1.01 -1.07 -4.83 121.20 119.36 1wln s ILE 50 Ca 0.69 0.78 -0.02 0.00 0.00 0.00 0.00 60.65 62.11 1wln s ILE 50 Cb -0.36 -3.62 0.11 0.00 0.01 0.00 0.00 42.46 38.60 1wln s ILE 50 CO 0.54 -0.17 0.13 -1.58 0.00 0.00 0.00 174.94 173.85 1wln s GLN 51 N -2.99 0.57 -0.10 2.79 0.74 -1.26 -3.78 119.66 115.63 1wln s GLN 51 Ca 0.52 -0.98 -0.03 0.00 0.05 0.00 0.00 55.36 54.91 1wln s GLN 51 Cb -0.10 -1.70 -0.04 0.00 1.10 0.00 0.00 33.01 32.27 1wln s GLN 51 CO 0.19 -1.03 0.05 -0.51 -0.55 0.00 0.00 175.29 173.44 1wln s LEU 52 N 1.65 3.84 -0.17 3.68 1.43 0.51 -4.97 118.68 124.65 1wln s LEU 52 Ca 0.11 0.25 0.01 0.00 -1.03 0.00 0.00 54.13 53.46 1wln s LEU 52 Cb -0.18 -1.90 0.01 0.00 0.03 0.00 0.00 46.19 44.15 1wln s LEU 52 CO -0.25 0.39 -0.18 -0.36 0.23 0.00 0.00 176.35 176.18 1wln s PHE 53 N -0.93 2.78 0.07 0.29 0.08 -1.26 -3.68 117.98 115.32 1wln s PHE 53 Ca 0.14 -1.37 -0.25 0.00 0.12 0.00 0.00 56.93 55.56 1wln s PHE 53 Cb -0.12 -1.91 0.07 0.00 -0.57 0.00 0.00 43.02 40.49 1wln s PHE 53 CO 0.03 -0.67 0.61 0.20 -0.10 0.00 0.00 175.22 175.29 1wln s GLY 54 N 1.11 -0.57 -1.04 4.36 0.00 -1.26 -5.01 107.32 104.91 1wln s GLY 54 Ca 0.00 0.77 -0.23 0.00 0.00 0.00 0.00 44.72 45.26 1wln s GLY 54 CO -0.07 0.43 1.73 2.56 0.00 0.00 0.00 173.10 177.76 1wln s PRO 55 N -2.69 3.14 0.00 2.90 0.04 -1.26 -1.92 135.00 135.20 1wln s PRO 55 Ca -0.04 -0.97 0.00 0.00 0.04 0.00 0.00 61.00 60.03 1wln s PRO 55 Cb -0.01 -5.27 0.00 0.00 0.04 0.00 0.00 34.50 29.27 1wln s PRO 55 CO -0.04 -2.87 0.00 0.41 0.04 0.00 0.00 177.00 174.54 1wln n GLY 56 N 6.51 0.51 3.78 0.56 0.00 -1.26 -4.92 105.19 110.36 1wln n GLY 56 Ca 0.39 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 46.06 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 -0.66 3.45 0.51 -0.61 -1.09 -0.81 -4.88 121.20 117.12 1wln s ILE 57 Ca 0.00 1.03 0.07 0.00 -2.23 0.00 0.00 60.65 59.52 1wln s ILE 57 Cb 0.00 -3.49 0.03 0.00 -1.58 0.00 0.00 42.46 37.41 1wln s ILE 57 CO 0.00 -0.07 0.45 -1.10 -1.23 0.00 0.00 174.94 172.99 1wln s GLN 58 N -2.82 2.33 -0.07 2.79 -1.52 -1.26 -4.89 119.66 114.23 1wln s GLN 58 Ca 0.64 -1.83 -0.19 0.00 -1.95 0.00 0.00 55.36 52.03 1wln s GLN 58 Cb -0.23 -2.25 -0.14 0.00 -0.22 0.00 0.00 33.01 30.16 1wln s GLN 58 CO 0.28 -0.53 0.71 -1.00 -0.25 0.00 0.00 175.29 174.50 1wln h PRO 59 N 0.76 -0.17 -3.28 2.91 0.13 -1.92 -0.63 132.00 129.80 1wln h PRO 59 Ca -0.37 0.01 -0.79 0.00 -0.87 0.00 0.00 66.00 63.98 1wln h PRO 59 Cb 1.29 0.04 -0.29 0.00 0.13 0.00 0.00 31.00 32.16 1wln h PRO 59 CO 0.55 0.26 0.47 1.58 -0.23 0.00 0.00 178.00 180.63 1wln n HIS 60 N -4.87 4.13 0.04 1.56 -0.00 -1.26 -3.33 115.22 111.49 1wln n HIS 60 Ca -0.07 -3.51 -0.02 0.00 0.46 0.00 0.00 57.72 54.58 1wln n HIS 60 Cb 0.25 -1.46 -0.01 0.00 -0.12 0.00 0.00 29.99 28.65 1wln n HIS 60 CO 0.00 0.00 0.00 1.25 0.46 0.00 0.00 176.34 178.05 1wln h HIS 61 N 6.09 -0.10 -3.31 1.57 2.76 -1.22 -2.74 115.15 118.19 1wln h HIS 61 Ca 0.19 -0.00 -0.08 0.00 -2.20 0.00 0.00 60.37 58.28 1wln h HIS 61 Cb 0.77 0.03 -0.03 0.00 1.55 0.00 0.00 27.41 29.74 1wln h HIS 61 CO 0.83 -0.06 0.14 0.00 -1.30 0.00 0.00 177.93 177.53 1wln s ASP 63 N -3.10 1.82 -0.28 0.00 1.11 0.85 0.95 116.67 118.03 1wln s ASP 63 Ca 0.19 -0.46 0.02 0.00 0.18 0.00 0.00 52.55 52.48 1wln s ASP 63 Cb -0.04 -0.13 0.06 0.00 1.07 0.00 0.00 42.92 43.88 1wln s ASP 63 CO 0.13 0.06 -0.06 -0.76 1.18 0.00 0.00 175.17 175.72 1wln s LEU 64 N -1.11 3.69 -0.20 1.23 1.43 0.94 -1.84 118.68 122.82 1wln s LEU 64 Ca 0.03 -1.42 -0.05 0.00 -1.03 0.00 0.00 54.13 51.65 1wln s LEU 64 Cb -0.08 -1.61 -0.03 0.00 0.03 0.00 0.00 46.19 44.51 1wln s LEU 64 CO 0.01 -0.23 0.01 -0.89 0.23 0.00 0.00 176.35 175.49 1wln s THR 65 N 1.13 4.06 -0.42 5.49 2.01 -1.26 -0.85 115.64 125.79 1wln s THR 65 Ca -0.06 -0.28 -0.21 0.00 0.31 0.00 0.00 61.69 61.44 1wln s THR 65 Cb -0.20 -2.84 0.02 0.00 0.01 0.00 0.00 72.50 69.49 1wln s THR 65 CO -0.04 0.43 0.68 0.21 -0.69 0.00 0.00 174.62 175.20 1wln s ASN 66 N 0.97 6.37 -0.34 3.53 2.47 -1.26 -3.42 114.94 123.26 1wln s ASN 66 Ca 0.02 -0.18 0.02 0.00 0.42 0.00 0.00 52.86 53.14 1wln s ASN 66 Cb -0.14 -2.34 0.09 0.00 -1.45 0.00 0.00 41.25 37.41 1wln s ASN 66 CO 0.02 -0.77 0.05 -0.04 -3.72 0.00 0.00 177.10 172.64 1wln s MET 67 N 2.91 1.77 -1.71 0.43 -1.94 0.48 -4.55 119.30 116.70 1wln s MET 67 Ca 0.25 -1.74 0.00 0.00 -1.71 0.00 0.00 55.69 52.49 1wln s MET 67 Cb -0.14 -3.23 0.00 0.00 2.01 0.00 0.00 34.83 33.47 1wln s MET 67 CO 0.19 -0.89 0.00 -3.47 -0.01 0.00 0.00 175.02 170.84 1wln n ASP 68 N 4.37 -5.34 0.00 3.03 2.03 -1.26 -0.97 116.55 118.42 1wln n ASP 68 Ca -0.01 0.13 0.00 0.00 0.52 0.00 0.00 54.79 55.43 1wln n ASP 68 Cb 0.42 -4.42 0.00 0.00 -0.72 0.00 0.00 41.12 36.40 1wln n ASP 68 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 1wln n GLY 69 N -0.92 3.12 3.78 0.27 0.00 -1.26 -5.04 105.19 105.14 1wln n GLY 69 Ca -0.21 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.45 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 -2.95 3.86 0.03 1.61 1.01 -0.14 -4.81 120.40 119.01 1wln s VAL 70 Ca 0.00 1.43 0.05 0.00 0.00 0.00 0.00 61.98 63.46 1wln s VAL 70 Cb 0.00 -3.75 -0.02 0.00 0.00 0.00 0.00 36.38 32.61 1wln s VAL 70 CO 0.00 0.02 -0.13 -0.69 0.00 0.00 0.00 175.10 174.30 1wln s VAL 71 N -1.67 1.06 -0.10 2.92 1.01 -1.26 0.18 120.40 122.54 1wln s VAL 71 Ca 0.56 -0.93 -0.01 0.00 0.00 0.00 0.00 61.98 61.60 1wln s VAL 71 Cb -0.21 -0.96 0.03 0.00 0.00 0.00 0.00 36.38 35.24 1wln s VAL 71 CO 0.26 0.03 -0.02 0.42 0.00 0.00 0.00 175.10 175.79 1wln s THR 72 N -0.78 0.61 -0.02 3.92 -4.23 -1.22 -1.23 115.64 112.68 1wln s THR 72 Ca 0.02 -0.07 -0.30 0.00 -1.18 0.00 0.00 61.69 60.15 1wln s THR 72 Cb -0.07 -0.75 -0.05 0.00 1.34 0.00 0.00 72.50 72.97 1wln s THR 72 CO 0.01 0.26 1.38 0.54 -0.54 0.00 0.00 174.62 176.26 1wln s VAL 73 N 1.87 3.82 -0.29 2.29 0.11 -0.64 -4.08 120.40 123.48 1wln s VAL 73 Ca 0.04 1.17 0.02 0.00 -2.93 0.00 0.00 61.98 60.28 1wln s VAL 73 Cb -0.13 -3.75 0.08 0.00 -1.53 0.00 0.00 36.38 31.05 1wln s VAL 73 CO -0.06 -0.01 0.02 -0.89 -3.33 0.00 0.00 175.10 170.82 1wln s THR 74 N 2.53 1.67 -0.13 5.04 2.01 -0.77 -1.53 115.64 124.45 1wln s THR 74 Ca 0.63 -1.69 -0.29 0.00 0.31 0.00 0.00 61.69 60.64 1wln s THR 74 Cb -0.30 -2.11 -0.02 0.00 0.01 0.00 0.00 72.50 70.08 1wln s THR 74 CO 0.25 -0.42 1.26 -2.16 -0.69 0.00 0.00 174.62 172.86 1wln s PRO 75 N 1.26 4.26 -0.30 4.92 0.04 -1.26 -0.10 135.00 143.81 1wln s PRO 75 Ca 0.04 1.68 0.08 0.00 0.04 0.00 0.00 61.00 62.84 1wln s PRO 75 Cb -0.19 -3.72 0.46 0.00 0.04 0.00 0.00 34.50 31.09 1wln s PRO 75 CO -0.12 -0.65 1.32 0.54 0.04 0.00 0.00 177.00 178.14 1wln n ARG 76 N 6.28 2.63 -4.24 4.56 5.12 -0.28 -4.91 116.66 125.81 1wln n ARG 76 Ca 0.13 -3.67 -0.17 0.00 -1.93 0.00 0.00 57.85 52.21 1wln n ARG 76 Cb 0.45 -2.01 -0.13 0.00 -1.16 0.00 0.00 32.46 29.61 1wln n ARG 76 CO 0.00 0.00 0.00 -1.12 -1.93 0.00 0.00 177.63 174.58 1wln s SER 77 N -3.15 1.09 -1.14 0.55 0.01 -1.03 -4.75 113.70 105.29 1wln s SER 77 Ca 0.47 -0.33 -0.03 0.00 1.31 0.00 0.00 55.95 57.37 1wln s SER 77 Cb 0.41 -0.07 0.24 0.00 0.21 0.00 0.00 66.02 66.81 1wln s SER 77 CO -0.00 -0.00 2.06 1.15 0.41 0.00 0.00 173.24 176.85 1wln n MET 78 N 2.25 5.07 0.00 12.44 0.00 -1.26 -3.96 117.12 131.65 1wln n MET 78 Ca -0.17 -4.17 0.00 0.00 0.00 0.00 0.00 57.70 53.36 1wln n MET 78 Cb 0.56 -2.53 0.00 0.00 0.00 0.00 0.00 33.22 31.25 1wln n MET 78 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 175.97 175.72 1wln n ASP 79 N 0.63 0.00 -4.57 3.17 8.00 -1.26 -5.09 116.55 117.43 1wln n ASP 79 Ca 0.53 0.00 -0.39 0.00 0.71 0.00 0.00 54.79 55.64 1wln n ASP 79 Cb 0.26 0.00 -0.03 0.00 -0.02 0.00 0.00 41.12 41.32 1wln n ASP 79 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1wln n ALA 80 N 0.00 1.18 -2.64 2.24 0.00 -1.25 -4.90 120.51 115.14 1wln n ALA 80 Ca 0.00 -0.64 -0.42 0.00 0.00 0.00 0.00 53.44 52.38 1wln n ALA 80 Cb 0.00 -3.07 -0.03 0.00 0.00 0.00 0.00 19.45 16.35 1wln n ALA 80 CO 0.00 0.00 0.00 -1.21 0.00 0.00 0.00 177.50 176.29 1wln s GLU 81 N 7.50 4.09 -0.31 0.00 8.01 -1.26 -4.88 118.70 131.85 1wln s GLU 81 Ca 1.00 0.94 0.02 0.00 0.01 0.00 0.00 54.97 56.94 1wln s GLU 81 Cb -0.28 -3.70 0.09 0.00 -4.31 0.00 0.00 34.13 25.94 1wln s GLU 81 CO 0.31 -0.69 0.04 0.99 0.01 0.00 0.00 175.26 175.92 1wln s THR 82 N 3.16 1.65 -0.36 3.63 2.01 -1.25 0.11 115.64 124.59 1wln s THR 82 Ca 0.38 -1.79 -0.12 0.00 0.31 0.00 0.00 61.69 60.47 1wln s THR 82 Cb -0.14 -2.16 0.00 0.00 0.01 0.00 0.00 72.50 70.21 1wln s THR 82 CO 0.11 -0.52 0.23 -0.31 -0.69 0.00 0.00 174.62 173.44 1wln s TYR 83 N 1.25 3.22 -0.92 4.92 2.02 -0.90 -2.42 117.35 124.52 1wln s TYR 83 Ca 0.07 -0.48 -0.21 0.00 -0.37 0.00 0.00 57.07 56.08 1wln s TYR 83 Cb -0.18 -2.48 0.09 0.00 -0.40 0.00 0.00 41.96 38.99 1wln s TYR 83 CO -0.13 -0.48 1.21 0.08 -1.57 0.00 0.00 175.55 174.66 1wln s VAL 84 N 1.67 4.39 -0.22 0.71 1.01 0.35 -1.52 120.40 126.79 1wln s VAL 84 Ca 0.05 -1.10 -0.00 0.00 0.00 0.00 0.00 61.98 60.93 1wln s VAL 84 Cb -0.18 -4.86 0.00 0.00 0.00 0.00 0.00 36.38 31.34 1wln s VAL 84 CO 0.09 -1.65 0.01 -0.67 0.00 0.00 0.00 175.10 172.88 1wln n ASP 85 N 7.53 -1.72 0.00 3.32 -0.08 -0.71 -3.12 116.55 121.78 1wln n ASP 85 Ca 0.23 -0.01 0.00 0.00 -1.51 0.00 0.00 54.79 53.50 1wln n ASP 85 Cb 0.49 -1.07 0.00 0.00 2.34 0.00 0.00 41.12 42.88 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 -0.97 0.65 3.01 0.27 0.00 -1.24 -4.97 105.19 101.95 1wln n GLY 86 Ca -0.03 -0.40 -0.31 0.00 0.00 0.00 0.00 46.02 45.28 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 -0.88 2.08 0.00 1.61 -0.21 -1.18 -5.01 119.66 116.07 1wln s GLN 87 Ca 0.00 -1.02 -0.30 0.00 0.02 0.00 0.00 55.36 54.05 1wln s GLN 87 Cb 0.00 -2.61 -0.04 0.00 1.00 0.00 0.00 33.01 31.36 1wln s GLN 87 CO 0.00 -0.49 1.20 0.50 -2.12 0.00 0.00 175.29 174.37 1wln s ARG 88 N 1.30 4.40 0.52 2.91 3.52 -1.26 0.13 118.95 130.46 1wln s ARG 88 Ca -0.04 1.71 -0.01 0.00 -0.13 0.00 0.00 55.73 57.27 1wln s ARG 88 Cb -0.18 -3.46 0.01 0.00 -1.56 0.00 0.00 34.95 29.77 1wln s ARG 88 CO -0.07 -0.35 0.75 0.96 -0.81 0.00 0.00 175.30 175.79 1wln s ILE 89 N 1.65 3.44 -0.01 4.11 -4.36 -1.02 -4.95 121.20 120.07 1wln s ILE 89 Ca 0.57 -0.46 0.01 0.00 -0.26 0.00 0.00 60.65 60.51 1wln s ILE 89 Cb -0.27 -3.30 0.01 0.00 1.25 0.00 0.00 42.46 40.15 1wln s ILE 89 CO 0.26 -0.23 0.70 -0.24 0.24 0.00 0.00 174.94 175.66 1wln n SER 90 N -2.28 0.52 0.00 4.36 2.88 -1.26 -4.87 113.62 112.98 1wln n SER 90 Ca 0.04 -1.43 0.00 0.00 -1.33 0.00 0.00 58.87 56.15 1wln n SER 90 Cb 0.58 -0.04 0.00 0.00 -0.75 0.00 0.00 64.21 64.00 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 -0.17 -2.20 -1.50 -1.46 0.28 -1.26 -5.01 120.64 109.33 1wln n GLU 91 Ca 0.01 0.00 -0.42 0.00 -0.16 0.00 0.00 57.16 56.59 1wln n GLU 91 Cb 0.48 0.00 -0.08 0.00 1.43 0.00 0.00 31.44 33.26 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 0.13 0.01 -4.00 3.84 -1.04 -1.25 -4.70 114.28 107.28 1wln n THR 92 Ca 0.00 -0.37 -0.34 0.00 -2.04 0.00 0.00 64.05 61.30 1wln n THR 92 Cb 0.00 -1.65 -0.15 0.00 -1.82 0.00 0.00 70.33 66.71 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 9.75 2.98 0.32 12.58 2.01 -0.59 -4.92 115.64 137.77 1wln s THR 93 Ca 1.15 -0.63 -0.29 0.00 0.31 0.00 0.00 61.69 62.23 1wln s THR 93 Cb -0.76 -2.33 -0.12 0.00 0.01 0.00 0.00 72.50 69.30 1wln s THR 93 CO 0.41 0.46 1.36 0.80 -0.69 0.00 0.00 174.62 176.96 1wln n MET 94 N 4.70 2.20 -4.07 4.92 1.56 -1.26 -1.61 117.12 123.57 1wln n MET 94 Ca -0.19 0.78 -0.31 0.00 -0.27 0.00 0.00 57.70 57.71 1wln n MET 94 Cb 0.51 -2.41 -0.07 0.00 2.15 0.00 0.00 33.22 33.40 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 -0.79 3.78 -0.03 -0.89 1.43 -0.37 -4.87 118.68 116.93 1wln s LEU 95 Ca 0.59 -0.01 0.03 0.00 -1.03 0.00 0.00 54.13 53.71 1wln s LEU 95 Cb -0.57 -2.43 0.00 0.00 0.03 0.00 0.00 46.19 43.22 1wln s LEU 95 CO 0.58 0.19 -0.11 -1.10 0.23 0.00 0.00 176.35 176.14 1wln s GLN 96 N -2.30 1.12 0.09 1.70 -0.21 -1.26 -4.62 119.66 114.18 1wln s GLN 96 Ca 0.28 -0.38 -0.36 0.00 0.02 0.00 0.00 55.36 54.92 1wln s GLN 96 Cb -0.12 -1.03 -0.17 0.00 1.00 0.00 0.00 33.01 32.69 1wln s GLN 96 CO 0.21 0.16 1.20 -1.13 -2.12 0.00 0.00 175.29 173.61 1wln n SER 97 N 3.19 1.05 0.00 5.90 3.41 -1.26 -0.55 113.62 125.37 1wln n SER 97 Ca -0.18 1.13 0.00 0.00 -0.26 0.00 0.00 58.87 59.57 1wln n SER 97 Cb 0.54 -1.12 0.00 0.00 -0.26 0.00 0.00 64.21 63.38 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 2.14 2.89 3.61 5.00 0.00 0.17 -4.95 105.19 114.06 1wln n GLY 98 Ca 0.18 -0.57 -0.43 0.00 0.00 0.00 0.00 46.02 45.20 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 1.46 -2.70 1.61 2.00 0.29 -4.67 117.12 115.11 1wln n MET 99 Ca 0.00 0.52 -0.24 0.00 0.00 0.00 0.00 57.70 57.97 1wln n MET 99 Cb 0.00 -2.01 0.02 0.00 0.00 0.00 0.00 33.22 31.23 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 -1.83 2.95 -0.19 0.03 0.52 -1.26 -1.13 118.95 118.04 1wln s ARG 100 Ca 0.60 -0.31 -0.04 0.00 -0.52 0.00 0.00 55.73 55.46 1wln s ARG 100 Cb -0.61 -2.43 0.08 0.00 0.52 0.00 0.00 34.95 32.52 1wln s ARG 100 CO 0.59 -0.50 0.18 -0.51 0.02 0.00 0.00 175.30 175.08 1wln s LEU 101 N -4.76 0.01 -0.42 2.53 1.02 0.35 -1.73 118.68 115.68 1wln s LEU 101 Ca 0.51 -0.28 -0.10 0.00 0.02 0.00 0.00 54.13 54.28 1wln s LEU 101 Cb -0.10 0.21 0.07 0.00 0.02 0.00 0.00 46.19 46.38 1wln s LEU 101 CO 0.41 -0.33 0.27 -1.58 0.02 0.00 0.00 176.35 175.14 1wln s GLN 102 N 2.27 2.71 -0.55 1.70 0.74 -0.57 0.75 119.66 126.72 1wln s GLN 102 Ca 0.05 -1.35 -0.20 0.00 0.05 0.00 0.00 55.36 53.91 1wln s GLN 102 Cb -0.16 -3.82 0.07 0.00 1.10 0.00 0.00 33.01 30.21 1wln s GLN 102 CO -0.11 -0.90 0.71 -0.06 -0.55 0.00 0.00 175.29 174.38 1wln s PHE 103 N 1.49 2.98 0.00 1.67 0.40 -0.17 -2.11 117.98 122.23 1wln s PHE 103 Ca 0.03 -0.61 0.00 0.00 -0.60 0.00 0.00 56.93 55.75 1wln s PHE 103 Cb -0.22 -3.79 0.00 0.00 0.51 0.00 0.00 43.02 39.52 1wln s PHE 103 CO 0.04 -1.19 0.00 0.41 0.70 0.00 0.00 175.22 175.18 1wln n GLY 104 N 5.21 1.42 0.00 4.36 0.00 0.12 -3.97 105.19 112.33 1wln n GLY 104 Ca -0.06 -0.39 0.00 0.00 0.00 0.00 0.00 46.02 45.56 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 0.00 0.00 0.00 2.61 5.66 -1.26 -4.77 114.28 116.52 1wln n THR 105 Ca 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 64.05 61.00 1wln n THR 105 Cb 0.00 0.00 0.00 0.00 -1.55 0.00 0.00 70.33 68.78 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 0.00 0.00 -4.64 1.09 2.88 -1.26 -5.06 113.62 106.63 1wln n SER 106 Ca 0.00 0.00 -0.37 0.00 -1.33 0.00 0.00 58.87 57.17 1wln n SER 106 Cb 0.00 0.00 -0.10 0.00 -0.75 0.00 0.00 64.21 63.36 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 -0.97 3.29 -0.13 0.66 4.02 -1.25 -4.86 115.29 116.04 1wln s HIS 107 Ca 0.00 0.24 -0.01 0.00 1.02 0.00 0.00 55.06 56.31 1wln s HIS 107 Cb 0.00 -2.34 0.03 0.00 -1.02 0.00 0.00 32.58 29.25 1wln s HIS 107 CO 0.00 -0.02 -0.06 0.08 1.02 0.00 0.00 174.74 175.76 1wln s VAL 108 N 1.33 1.03 0.47 -0.90 1.01 -1.26 -1.00 120.40 121.08 1wln s VAL 108 Ca 0.09 -0.40 0.06 0.00 0.00 0.00 0.00 61.98 61.73 1wln s VAL 108 Cb -0.14 -1.11 -0.02 0.00 0.00 0.00 0.00 36.38 35.10 1wln s VAL 108 CO 0.07 0.28 0.21 -0.36 0.00 0.00 0.00 175.10 175.30 1wln s PHE 109 N 1.69 2.17 -0.11 5.22 0.40 0.23 0.37 117.98 127.96 1wln s PHE 109 Ca 0.03 -0.74 -0.01 0.00 -0.60 0.00 0.00 56.93 55.62 1wln s PHE 109 Cb -0.13 -1.88 0.03 0.00 0.51 0.00 0.00 43.02 41.55 1wln s PHE 109 CO -0.08 0.00 -0.01 0.21 0.70 0.00 0.00 175.22 176.04 1wln s LYS 110 N -4.01 0.84 0.27 0.44 2.20 -0.74 0.13 119.74 118.87 1wln s LYS 110 Ca 0.32 -0.10 -0.28 0.00 -0.36 0.00 0.00 55.97 55.54 1wln s LYS 110 Cb 0.02 -1.38 -0.09 0.00 -1.51 0.00 0.00 37.83 34.87 1wln s LYS 110 CO 0.18 -0.37 0.95 0.12 -0.36 0.00 0.00 175.35 175.87 1wln s PHE 111 N 1.88 3.86 0.05 4.03 2.19 -0.28 0.25 117.98 129.96 1wln s PHE 111 Ca 0.04 1.86 0.01 0.00 0.33 0.00 0.00 56.93 59.17 1wln s PHE 111 Cb -0.13 -2.97 -0.03 0.00 -1.31 0.00 0.00 43.02 38.58 1wln s PHE 111 CO -0.06 0.34 -0.05 0.54 1.83 0.00 0.00 175.22 177.81 1wln s VAL 112 N -1.35 0.39 -0.31 3.12 0.11 0.11 0.45 120.40 122.92 1wln s VAL 112 Ca 0.45 -1.38 -0.02 0.00 -2.93 0.00 0.00 61.98 58.09 1wln s VAL 112 Cb -0.23 -0.95 0.10 0.00 -1.53 0.00 0.00 36.38 33.77 1wln s VAL 112 CO 0.29 -0.66 0.13 -0.62 -3.33 0.00 0.00 175.10 170.91 1wln s ASP 113 N -2.17 3.76 0.00 3.54 -1.08 -1.26 -1.20 116.67 118.26 1wln s ASP 113 Ca -0.03 -1.61 0.24 0.00 -0.52 0.00 0.00 52.55 50.63 1wln s ASP 113 Cb -0.03 -0.66 1.33 0.00 -1.46 0.00 0.00 42.92 42.10 1wln s ASP 113 CO -0.03 -0.41 1.78 -0.81 0.52 0.00 0.00 175.17 176.22 1wln n PRO 114 N 4.86 0.59 -0.13 4.34 -0.04 -1.26 -3.04 135.00 140.32 1wln n PRO 114 Ca -0.02 0.03 -0.07 0.00 -0.04 0.00 0.00 63.50 63.40 1wln n PRO 114 Cb 0.41 -1.50 0.09 0.00 -0.04 0.00 0.00 33.50 32.46 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 0.86 -3.67 3.54 0.02 -1.77 -3.45 113.55 109.08 1wln h SER 115 Ca 0.00 -0.26 0.00 0.00 -0.84 0.00 0.00 61.79 60.69 1wln h SER 115 Cb 0.08 -0.23 0.00 0.00 0.14 0.00 0.00 62.40 62.39 1wln h SER 115 CO 0.00 0.98 0.00 0.61 -1.14 0.00 0.00 176.83 177.28 1wln n GLY 116 N -0.40 -2.49 3.77 -3.77 0.00 -1.17 -5.03 105.19 96.10 1wln n GLY 116 Ca 0.02 -1.22 -0.30 0.00 0.00 0.00 0.00 46.02 44.52 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 -5.76 0.16 0.34 1.61 0.04 -1.26 -5.02 135.00 125.11 1wln s PRO 117 Ca 0.00 -0.08 0.00 0.00 0.04 0.00 0.00 61.00 60.96 1wln s PRO 117 Cb 0.00 -1.76 0.00 0.00 0.04 0.00 0.00 34.50 32.78 1wln s PRO 117 CO 0.00 -2.79 0.00 0.45 0.04 0.00 0.00 177.00 174.70 1wln n SER 118 N -4.10 -1.76 0.13 6.66 2.88 -1.26 -4.97 113.62 111.20 1wln n SER 118 Ca 0.12 0.62 -0.09 0.00 -1.33 0.00 0.00 58.87 58.19 1wln n SER 118 Cb 0.59 1.78 -0.06 0.00 -0.75 0.00 0.00 64.21 65.77 1wln n SER 118 CO 0.00 0.00 0.00 -1.28 -1.23 0.00 0.00 175.04 172.53 1wln h SER 119 N 0.00 -0.34 0.00 -3.46 0.87 -2.05 -3.58 113.55 104.98 1wln h SER 119 Ca 0.00 -0.14 0.00 0.00 -1.23 0.00 0.00 61.79 60.42 1wln h SER 119 Cb 0.00 0.09 0.00 0.00 -0.44 0.00 0.00 62.40 62.05 1wln h SER 119 CO 0.00 0.13 0.00 0.61 -0.53 0.00 0.00 176.83 177.04