#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 6.35 0.03 1.61 1.04 -1.26 -4.76 113.70 116.71 1wln s SER 2 Ca 0.00 0.41 0.00 0.00 0.48 0.00 0.00 55.95 56.84 1wln s SER 2 Cb 0.00 -2.23 0.00 0.00 0.10 0.00 0.00 66.02 63.89 1wln s SER 2 CO 0.00 -0.16 0.00 -1.20 0.98 0.00 0.00 173.24 172.86 1wln n SER 3 N 5.07 -9.25 -0.92 7.02 7.64 -1.26 -4.95 113.62 116.97 1wln n SER 3 Ca -0.08 1.84 0.00 0.00 1.01 0.00 0.00 58.87 61.65 1wln n SER 3 Cb 0.51 -5.11 0.00 0.00 -1.01 0.00 0.00 64.21 58.60 1wln n SER 3 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1wln n GLY 4 N 1.87 -1.78 0.00 0.23 0.00 -1.26 -5.12 105.19 99.13 1wln n GLY 4 Ca 0.00 -0.49 0.00 0.00 0.00 0.00 0.00 46.02 45.53 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 0.00 0.00 1.61 7.64 -1.26 -4.96 113.62 116.65 1wln n SER 5 Ca 0.00 0.00 0.00 0.00 1.01 0.00 0.00 58.87 59.88 1wln n SER 5 Cb 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.20 1wln n SER 5 CO 0.00 0.00 0.00 -1.20 -3.01 0.00 0.00 175.04 170.83 1wln n SER 6 N 0.00 0.00 0.00 6.43 7.64 -1.26 -4.63 113.62 121.80 1wln n SER 6 Ca 0.00 0.00 0.00 0.00 1.01 0.00 0.00 58.87 59.88 1wln n SER 6 Cb 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.20 1wln n SER 6 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1wln n GLY 7 N 0.00 0.05 0.14 0.23 0.00 -1.26 -4.94 105.19 99.41 1wln n GLY 7 Ca 0.00 -0.76 0.13 0.00 0.00 0.00 0.00 46.02 45.39 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 0.00 -0.90 1.61 0.13 -2.01 -2.90 132.00 127.93 1wln h PRO 8 Ca 0.00 0.00 -0.27 0.00 -0.87 0.00 0.00 66.00 64.86 1wln h PRO 8 Cb 0.00 0.00 -0.16 0.00 0.13 0.00 0.00 31.00 30.97 1wln h PRO 8 CO 0.00 0.00 0.35 -0.85 -0.23 0.00 0.00 178.00 177.27 1wln n GLU 9 N -2.41 2.59 -2.11 0.86 0.28 -1.26 -3.90 120.64 114.69 1wln n GLU 9 Ca 0.04 -2.33 -0.02 0.00 -0.16 0.00 0.00 57.16 54.68 1wln n GLU 9 Cb 0.35 -1.96 0.05 0.00 1.43 0.00 0.00 31.44 31.30 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 -0.37 0.90 -4.35 3.44 5.02 -1.10 -4.72 118.16 116.98 1wln n LYS 10 Ca 0.38 -1.66 -0.31 0.00 -2.02 0.00 0.00 58.31 54.70 1wln n LYS 10 Cb 1.27 0.03 -0.10 0.00 -0.02 0.00 0.00 35.03 36.21 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 -2.47 3.15 0.16 -0.35 1.43 -1.25 -3.72 118.68 115.63 1wln s LEU 11 Ca 0.13 -0.23 -0.30 0.00 -1.03 0.00 0.00 54.13 52.69 1wln s LEU 11 Cb 0.30 -1.87 -0.07 0.00 0.03 0.00 0.00 46.19 44.58 1wln s LEU 11 CO -0.08 0.23 1.13 -2.16 0.23 0.00 0.00 176.35 175.70 1wln s PRO 12 N -1.79 4.56 0.12 1.29 0.04 -1.26 -4.23 135.00 133.73 1wln s PRO 12 Ca 0.20 1.74 -0.02 0.00 0.04 0.00 0.00 61.00 62.96 1wln s PRO 12 Cb -0.11 -3.28 -0.03 0.00 0.04 0.00 0.00 34.50 31.11 1wln s PRO 12 CO 0.11 0.00 0.08 1.52 0.04 0.00 0.00 177.00 178.75 1wln s TYR 13 N -0.02 0.73 -0.04 0.56 -0.85 -1.11 0.16 117.35 116.79 1wln s TYR 13 Ca 0.51 -1.13 0.05 0.00 -0.52 0.00 0.00 57.07 55.98 1wln s TYR 13 Cb -0.30 -0.40 -0.02 0.00 0.38 0.00 0.00 41.96 41.62 1wln s TYR 13 CO 0.34 -0.53 -0.20 -0.51 -1.52 0.00 0.00 175.55 173.14 1wln s LEU 14 N -3.01 2.39 -0.33 -3.49 2.01 0.32 -1.62 118.68 114.96 1wln s LEU 14 Ca 0.20 -0.34 -0.01 0.00 0.01 0.00 0.00 54.13 53.99 1wln s LEU 14 Cb 0.07 -1.45 0.07 0.00 0.01 0.00 0.00 46.19 44.89 1wln s LEU 14 CO -0.00 0.32 0.05 0.54 1.01 0.00 0.00 176.35 178.26 1wln s VAL 15 N -0.59 2.95 -0.30 -1.59 0.11 -0.96 -0.09 120.40 119.95 1wln s VAL 15 Ca 0.09 -1.64 -0.34 0.00 -2.93 0.00 0.00 61.98 57.15 1wln s VAL 15 Cb -0.11 -2.82 -0.15 0.00 -1.53 0.00 0.00 36.38 31.77 1wln s VAL 15 CO 0.00 -0.29 1.12 1.21 -3.33 0.00 0.00 175.10 173.81 1wln n GLU 16 N 4.57 0.00 -4.53 1.54 2.13 0.09 -1.86 120.64 122.57 1wln n GLU 16 Ca -0.09 0.00 -0.25 0.00 0.66 0.00 0.00 57.16 57.48 1wln n GLU 16 Cb 0.43 -1.13 -0.11 0.00 0.27 0.00 0.00 31.44 30.90 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 1.77 2.66 0.92 4.31 1.43 0.68 -4.62 118.68 125.83 1wln s LEU 17 Ca 0.77 -1.27 -0.12 0.00 -1.03 0.00 0.00 54.13 52.48 1wln s LEU 17 Cb -1.09 -0.82 0.14 0.00 0.03 0.00 0.00 46.19 44.45 1wln s LEU 17 CO 0.58 -0.35 1.10 -0.55 0.23 0.00 0.00 176.35 177.35 1wln s SER 18 N -3.59 3.33 0.00 2.29 0.15 -0.82 -3.28 113.70 111.78 1wln s SER 18 Ca 0.33 1.24 0.23 0.00 0.70 0.00 0.00 55.95 58.46 1wln s SER 18 Cb 0.06 -1.91 1.29 0.00 -1.71 0.00 0.00 66.02 63.75 1wln s SER 18 CO 0.16 -2.70 1.77 -0.81 1.20 0.00 0.00 173.24 172.86 1wln n PRO 19 N -3.90 0.53 -0.00 5.44 -0.04 -1.26 -2.23 135.00 133.54 1wln n PRO 19 Ca 0.06 0.04 0.04 0.00 -0.04 0.00 0.00 63.50 63.60 1wln n PRO 19 Cb 0.57 -1.50 -0.05 0.00 -0.04 0.00 0.00 33.50 32.48 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 -1.15 2.06 -0.14 3.54 2.03 -1.26 -5.01 116.55 116.62 1wln n ASP 20 Ca 0.14 -0.28 0.00 0.00 0.52 0.00 0.00 54.79 55.17 1wln n ASP 20 Cb 0.13 1.20 0.00 0.00 -0.72 0.00 0.00 41.12 41.74 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 1.70 0.85 3.43 0.27 0.00 -0.94 -5.12 105.19 105.38 1wln n GLY 21 Ca -0.00 -0.14 -0.22 0.00 0.00 0.00 0.00 46.02 45.67 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 -1.99 2.94 -0.15 1.61 0.01 -1.26 -4.88 113.70 109.97 1wln s SER 22 Ca 0.00 -1.14 -0.08 0.00 1.31 0.00 0.00 55.95 56.04 1wln s SER 22 Cb 0.00 -0.20 -0.04 0.00 0.21 0.00 0.00 66.02 65.99 1wln s SER 22 CO 0.00 -0.25 0.13 1.51 0.41 0.00 0.00 173.24 175.04 1wln s ASP 23 N -3.45 6.29 1.15 2.44 -4.77 -1.26 -1.94 116.67 115.13 1wln s ASP 23 Ca 0.29 0.37 -0.18 0.00 -3.30 0.00 0.00 52.55 49.72 1wln s ASP 23 Cb 0.02 -2.07 0.26 0.00 -1.09 0.00 0.00 42.92 40.04 1wln s ASP 23 CO 0.12 0.31 1.13 -0.94 0.70 0.00 0.00 175.17 176.49 1wln s SER 24 N -0.45 1.40 -0.23 2.11 1.04 -1.26 -4.88 113.70 111.43 1wln s SER 24 Ca 0.12 0.68 -0.04 0.00 0.48 0.00 0.00 55.95 57.20 1wln s SER 24 Cb -0.12 -0.98 -0.04 0.00 0.10 0.00 0.00 66.02 64.98 1wln s SER 24 CO 0.02 -3.83 2.89 0.54 0.98 0.00 0.00 173.24 173.83 1wln n ARG 25 N -4.57 2.03 -1.48 4.02 1.74 -1.26 -4.81 116.66 112.32 1wln n ARG 25 Ca 0.12 -1.51 0.00 0.00 -0.77 0.00 0.00 57.85 55.68 1wln n ARG 25 Cb 0.59 -1.90 0.00 0.00 -1.02 0.00 0.00 32.46 30.13 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 1.44 0.00 -4.57 0.55 8.00 -1.26 -5.12 116.55 115.58 1wln n ASP 26 Ca 0.39 -0.79 -0.41 0.00 0.71 0.00 0.00 54.79 54.70 1wln n ASP 26 Cb 0.68 0.00 -0.08 0.00 -0.02 0.00 0.00 41.12 41.70 1wln n ASP 26 CO 0.00 0.00 0.00 -1.59 -0.39 0.00 0.00 177.20 175.22 1wln s LYS 27 N -1.36 3.75 0.80 -1.24 -2.85 -1.26 -5.06 119.74 112.52 1wln s LYS 27 Ca 0.00 -0.05 -0.11 0.00 -1.00 0.00 0.00 55.97 54.80 1wln s LYS 27 Cb 0.00 -3.76 0.07 0.00 -2.06 0.00 0.00 37.83 32.08 1wln s LYS 27 CO 0.00 -0.54 1.10 -1.25 0.10 0.00 0.00 175.35 174.76 1wln s PRO 28 N 2.33 2.07 0.58 1.78 0.04 -1.26 -5.02 135.00 135.51 1wln s PRO 28 Ca 0.18 0.63 -0.18 0.00 0.04 0.00 0.00 61.00 61.67 1wln s PRO 28 Cb -0.16 -1.92 -0.04 0.00 0.04 0.00 0.00 34.50 32.43 1wln s PRO 28 CO 0.12 -1.63 1.13 0.15 0.04 0.00 0.00 177.00 176.81 1wln s LYS 29 N -5.16 3.16 0.21 4.56 -0.14 -1.26 -4.81 119.74 116.30 1wln s LYS 29 Ca 0.61 1.58 0.10 0.00 -1.36 0.00 0.00 55.97 56.89 1wln s LYS 29 Cb -0.14 -1.98 -0.05 0.00 -1.68 0.00 0.00 37.83 33.98 1wln s LYS 29 CO 0.54 -1.00 -0.18 -1.17 -0.76 0.00 0.00 175.35 172.78 1wln s LEU 30 N -4.12 2.51 -0.23 3.17 2.96 -1.26 -0.74 118.68 120.98 1wln s LEU 30 Ca 0.72 -0.95 -0.04 0.00 -0.22 0.00 0.00 54.13 53.64 1wln s LEU 30 Cb -0.24 -0.90 0.12 0.00 0.50 0.00 0.00 46.19 45.67 1wln s LEU 30 CO 0.31 -0.03 0.37 -0.31 -1.32 0.00 0.00 176.35 175.37 1wln s TYR 31 N -2.38 -0.76 0.11 5.38 2.02 0.88 -4.94 117.35 117.65 1wln s TYR 31 Ca 0.22 0.90 -0.17 0.00 -0.37 0.00 0.00 57.07 57.65 1wln s TYR 31 Cb -0.04 0.03 -0.07 0.00 -0.40 0.00 0.00 41.96 41.48 1wln s TYR 31 CO 0.09 -0.66 0.56 1.03 -1.57 0.00 0.00 175.55 175.01 1wln s ARG 32 N 2.53 4.10 -1.11 -0.62 0.52 -1.26 0.12 118.95 123.23 1wln s ARG 32 Ca 0.10 0.63 -0.08 0.00 -0.52 0.00 0.00 55.73 55.86 1wln s ARG 32 Cb -0.15 -3.09 0.28 0.00 0.52 0.00 0.00 34.95 32.52 1wln s ARG 32 CO -0.15 0.56 1.17 1.28 0.02 0.00 0.00 175.30 178.18 1wln n LEU 33 N 1.28 5.64 -4.65 2.53 4.77 0.43 -4.93 117.00 122.08 1wln n LEU 33 Ca -0.08 -5.07 -0.29 0.00 -0.03 0.00 0.00 56.01 50.54 1wln n LEU 33 Cb 0.51 -1.44 0.18 0.00 -2.33 0.00 0.00 43.42 40.35 1wln n LEU 33 CO 0.42 1.41 0.62 -1.10 -1.33 0.00 0.00 177.39 177.41 1wln s GLN 34 N -1.55 0.35 0.91 3.23 -0.21 -1.26 -4.51 119.66 116.63 1wln s GLN 34 Ca 0.31 0.71 -0.17 0.00 0.02 0.00 0.00 55.36 56.23 1wln s GLN 34 Cb -0.07 -1.71 -0.14 0.00 1.00 0.00 0.00 33.01 32.08 1wln s GLN 34 CO -0.05 -2.83 -0.62 1.28 -2.12 0.00 0.00 175.29 170.95 1wln n LEU 35 N -4.27 -5.29 0.00 2.90 4.77 -1.26 -4.63 117.00 109.22 1wln n LEU 35 Ca 0.05 0.27 0.00 0.00 -0.03 0.00 0.00 56.01 56.30 1wln n LEU 35 Cb 0.56 -0.80 0.00 0.00 -2.33 0.00 0.00 43.42 40.85 1wln n LEU 35 CO 0.57 -5.70 0.00 -1.20 -1.33 0.00 0.00 177.39 169.73 1wln n SER 36 N 3.06 0.00 -4.73 -1.43 7.64 -1.26 -4.91 113.62 111.99 1wln n SER 36 Ca 0.00 0.00 -0.35 0.00 1.01 0.00 0.00 58.87 59.53 1wln n SER 36 Cb 0.54 0.00 -0.09 0.00 -1.01 0.00 0.00 64.21 63.66 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 -0.10 4.61 -0.18 0.44 0.11 -1.26 -3.08 120.40 120.95 1wln s VAL 37 Ca 0.00 -0.13 -0.00 0.00 -2.93 0.00 0.00 61.98 58.92 1wln s VAL 37 Cb 0.00 -2.96 0.01 0.00 -1.53 0.00 0.00 36.38 31.89 1wln s VAL 37 CO 0.00 0.61 -0.15 -0.89 -3.33 0.00 0.00 175.10 171.33 1wln s THR 38 N -0.89 2.54 -0.21 5.04 2.01 0.28 -4.84 115.64 119.57 1wln s THR 38 Ca 0.13 -0.79 -0.13 0.00 0.31 0.00 0.00 61.69 61.22 1wln s THR 38 Cb -0.12 -2.09 -0.05 0.00 0.01 0.00 0.00 72.50 70.26 1wln s THR 38 CO 0.03 0.51 0.25 -1.61 -0.69 0.00 0.00 174.62 173.10 1wln s GLU 39 N 1.14 4.15 0.05 4.92 8.01 -1.26 0.17 118.70 135.88 1wln s GLU 39 Ca 0.01 -0.06 0.01 0.00 0.01 0.00 0.00 54.97 54.94 1wln s GLU 39 Cb -0.14 -3.51 -0.04 0.00 -4.31 0.00 0.00 34.13 26.13 1wln s GLU 39 CO -0.06 0.09 0.11 0.08 0.01 0.00 0.00 175.26 175.48 1wln s VAL 40 N 0.96 4.78 -0.68 2.63 1.01 -0.19 -3.45 120.40 125.47 1wln s VAL 40 Ca 0.13 -0.56 0.00 0.00 0.00 0.00 0.00 61.98 61.54 1wln s VAL 40 Cb -0.13 -3.27 0.00 0.00 0.00 0.00 0.00 36.38 32.98 1wln s VAL 40 CO 0.05 0.21 0.00 0.61 0.00 0.00 0.00 175.10 175.97 1wln n GLY 41 N 0.68 -0.08 0.25 4.51 0.00 -1.07 0.19 105.19 109.68 1wln n GLY 41 Ca -0.09 -0.83 0.02 0.00 0.00 0.00 0.00 46.02 45.12 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 1.22 0.77 -4.02 2.61 -2.24 0.24 0.18 114.28 113.04 1wln n THR 42 Ca 0.00 -0.89 -0.21 0.00 -2.27 0.00 0.00 64.05 60.68 1wln n THR 42 Cb 0.00 0.64 -0.03 0.00 -2.10 0.00 0.00 70.33 68.84 1wln n THR 42 CO 0.00 0.00 0.00 -1.61 -0.57 0.00 0.00 175.07 172.89 1wln s GLU 43 N -0.86 3.23 -0.28 -0.78 0.41 -1.22 -4.89 118.70 114.31 1wln s GLU 43 Ca 0.09 -0.88 -0.07 0.00 -0.41 0.00 0.00 54.97 53.69 1wln s GLU 43 Cb 0.05 -2.76 -0.01 0.00 -1.78 0.00 0.00 34.13 29.64 1wln s GLU 43 CO 0.07 0.41 0.08 0.21 -0.49 0.00 0.00 175.26 175.54 1wln s LYS 44 N -3.93 3.34 0.00 1.61 2.47 -1.26 -4.84 119.74 117.13 1wln s LYS 44 Ca 0.34 -0.69 0.06 0.00 -1.56 0.00 0.00 55.97 54.12 1wln s LYS 44 Cb -0.09 -3.35 -0.05 0.00 -1.46 0.00 0.00 37.83 32.88 1wln s LYS 44 CO 0.27 -0.33 0.27 1.19 0.16 0.00 0.00 175.35 176.91 1wln n PHE 45 N 4.90 0.00 -3.49 4.03 3.01 -1.26 -5.09 117.46 119.55 1wln n PHE 45 Ca -0.15 0.00 0.00 0.00 1.01 0.00 0.00 57.45 58.31 1wln n PHE 45 Cb 0.50 0.00 0.00 0.00 -0.01 0.00 0.00 39.48 39.97 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 -1.04 0.00 0.01 4.37 9.92 -1.26 -4.99 116.55 123.56 1wln n ASP 46 Ca 0.01 0.00 -0.03 0.00 -0.53 0.00 0.00 54.79 54.24 1wln n ASP 46 Cb 0.09 0.00 -0.11 0.00 -0.64 0.00 0.00 41.12 40.47 1wln n ASP 46 CO 0.00 0.00 0.00 -0.67 0.13 0.00 0.00 177.20 176.66 1wln n ASP 47 N 1.31 0.78 -1.93 -2.24 -0.08 -1.26 -3.89 116.55 109.25 1wln n ASP 47 Ca 0.00 0.35 -0.19 0.00 -1.51 0.00 0.00 54.79 53.44 1wln n ASP 47 Cb 0.00 0.20 0.10 0.00 2.34 0.00 0.00 41.12 43.76 1wln n ASP 47 CO 0.00 0.00 0.00 0.59 0.12 0.00 0.00 177.20 177.91 1wln n ASN 48 N -2.91 4.68 -4.63 1.67 4.13 -1.26 -4.90 115.26 112.04 1wln n ASN 48 Ca -0.13 -3.20 -0.30 0.00 1.68 0.00 0.00 54.58 52.63 1wln n ASN 48 Cb 0.92 -0.83 -0.09 0.00 -1.54 0.00 0.00 39.78 38.23 1wln n ASN 48 CO 0.00 0.00 0.00 -0.44 0.28 0.00 0.00 177.26 177.10 1wln s SER 49 N -0.61 4.75 -0.16 6.41 0.01 -1.25 -4.82 113.70 118.02 1wln s SER 49 Ca 0.41 -0.23 -0.18 0.00 1.31 0.00 0.00 55.95 57.26 1wln s SER 49 Cb 0.34 -1.06 -0.04 0.00 0.21 0.00 0.00 66.02 65.47 1wln s SER 49 CO 0.05 0.20 0.47 -0.63 0.41 0.00 0.00 173.24 173.74 1wln s ILE 50 N -1.21 5.17 -0.31 1.44 1.01 -1.22 -4.98 121.20 121.09 1wln s ILE 50 Ca 0.22 0.89 -0.04 0.00 0.00 0.00 0.00 60.65 61.72 1wln s ILE 50 Cb -0.11 -3.80 0.04 0.00 0.01 0.00 0.00 42.46 38.59 1wln s ILE 50 CO 0.14 0.26 0.05 -1.58 0.00 0.00 0.00 174.94 173.81 1wln s GLN 51 N 1.11 2.61 -0.11 2.79 0.74 -1.26 -2.61 119.66 122.93 1wln s GLN 51 Ca 0.24 -1.16 -0.02 0.00 0.05 0.00 0.00 55.36 54.46 1wln s GLN 51 Cb -0.15 -3.30 -0.03 0.00 1.10 0.00 0.00 33.01 30.62 1wln s GLN 51 CO 0.09 -0.60 -0.02 -0.51 -0.55 0.00 0.00 175.29 173.70 1wln s LEU 52 N 1.35 3.41 -0.22 3.68 2.01 0.48 -4.94 118.68 124.45 1wln s LEU 52 Ca -0.02 0.02 0.01 0.00 0.01 0.00 0.00 54.13 54.15 1wln s LEU 52 Cb -0.19 -1.79 0.05 0.00 0.01 0.00 0.00 46.19 44.26 1wln s LEU 52 CO 0.01 0.29 -0.10 -0.36 1.01 0.00 0.00 176.35 177.19 1wln s PHE 53 N -0.35 2.63 0.06 0.29 0.08 -1.26 -3.81 117.98 115.61 1wln s PHE 53 Ca 0.06 -1.79 -0.28 0.00 0.12 0.00 0.00 56.93 55.05 1wln s PHE 53 Cb -0.12 -1.72 0.09 0.00 -0.57 0.00 0.00 43.02 40.70 1wln s PHE 53 CO 0.02 -0.78 1.01 0.20 -0.10 0.00 0.00 175.22 175.57 1wln s GLY 54 N 1.32 -0.33 -0.53 4.36 0.00 -1.26 -5.01 107.32 105.87 1wln s GLY 54 Ca -0.03 0.57 -0.28 0.00 0.00 0.00 0.00 44.72 44.98 1wln s GLY 54 CO -0.07 0.15 1.48 2.56 0.00 0.00 0.00 173.10 177.22 1wln s PRO 55 N -3.03 3.27 0.00 2.90 0.04 -1.26 -2.52 135.00 134.40 1wln s PRO 55 Ca 0.10 0.59 0.00 0.00 0.04 0.00 0.00 61.00 61.74 1wln s PRO 55 Cb -0.00 -4.14 0.00 0.00 0.04 0.00 0.00 34.50 30.40 1wln s PRO 55 CO -0.02 -1.96 0.00 0.41 0.04 0.00 0.00 177.00 175.47 1wln n GLY 56 N 5.29 1.66 3.89 0.56 0.00 -1.26 -4.99 105.19 110.35 1wln n GLY 56 Ca 0.14 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.88 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 -2.00 5.11 0.44 -0.61 -1.09 -1.05 -4.70 121.20 117.30 1wln s ILE 57 Ca 0.00 -0.63 0.01 0.00 -2.23 0.00 0.00 60.65 57.79 1wln s ILE 57 Cb 0.00 -3.55 -0.00 0.00 -1.58 0.00 0.00 42.46 37.33 1wln s ILE 57 CO 0.00 0.03 0.02 0.00 -1.23 0.00 0.00 174.94 173.76 1wln n GLN 58 N -0.03 0.86 0.08 2.79 1.13 -1.26 -4.90 117.38 116.05 1wln n GLN 58 Ca -0.07 -3.26 -0.06 0.00 -1.94 0.00 0.00 57.00 51.67 1wln n GLN 58 Cb 0.53 1.02 -0.04 0.00 0.11 0.00 0.00 30.24 31.86 1wln n GLN 58 CO 0.00 0.00 0.00 -1.00 -1.44 0.00 0.00 177.06 174.62 1wln h PRO 59 N 0.00 -0.29 -3.14 -1.09 0.13 -1.90 0.69 132.00 126.40 1wln h PRO 59 Ca -0.36 0.02 -0.78 0.00 -0.87 0.00 0.00 66.00 64.01 1wln h PRO 59 Cb 1.13 0.07 -0.30 0.00 0.13 0.00 0.00 31.00 32.03 1wln h PRO 59 CO 0.59 -0.11 0.50 1.58 -0.23 0.00 0.00 178.00 180.33 1wln n HIS 60 N -4.97 3.61 0.07 1.56 -0.00 -1.26 -3.37 115.22 110.86 1wln n HIS 60 Ca -0.05 -3.31 -0.03 0.00 -0.00 0.00 0.00 57.72 54.33 1wln n HIS 60 Cb 0.16 -1.36 -0.02 0.00 -0.00 0.00 0.00 29.99 28.78 1wln n HIS 60 CO 0.00 0.00 0.00 1.25 -0.00 0.00 0.00 176.34 177.59 1wln h HIS 61 N 5.83 -0.22 -3.51 1.57 2.76 0.19 -3.34 115.15 118.44 1wln h HIS 61 Ca 0.19 -0.00 -0.05 0.00 -2.20 0.00 0.00 60.37 58.31 1wln h HIS 61 Cb 0.73 0.08 -0.11 0.00 1.55 0.00 0.00 27.41 29.65 1wln h HIS 61 CO 0.87 -0.12 -0.10 0.00 -1.30 0.00 0.00 177.93 177.28 1wln s ASP 63 N -2.90 4.50 -0.31 0.00 1.11 -0.47 -1.02 116.67 117.58 1wln s ASP 63 Ca 0.11 -0.16 -0.04 0.00 0.18 0.00 0.00 52.55 52.64 1wln s ASP 63 Cb 0.01 -1.54 0.04 0.00 1.07 0.00 0.00 42.92 42.51 1wln s ASP 63 CO -0.03 0.23 0.04 -0.76 1.18 0.00 0.00 175.17 175.82 1wln s LEU 64 N 0.01 4.01 0.04 1.23 1.43 0.45 -2.50 118.68 123.34 1wln s LEU 64 Ca -0.01 -1.18 0.03 0.00 -1.03 0.00 0.00 54.13 51.93 1wln s LEU 64 Cb -0.14 -1.77 -0.04 0.00 0.03 0.00 0.00 46.19 44.27 1wln s LEU 64 CO 0.03 -0.27 0.00 -0.89 0.23 0.00 0.00 176.35 175.45 1wln s THR 65 N 1.32 4.11 -0.29 5.49 2.01 -1.26 0.10 115.64 127.13 1wln s THR 65 Ca -0.03 -0.75 0.03 0.00 0.31 0.00 0.00 61.69 61.24 1wln s THR 65 Cb -0.19 -2.89 0.07 0.00 0.01 0.00 0.00 72.50 69.50 1wln s THR 65 CO 0.00 0.27 -0.05 0.21 -0.69 0.00 0.00 174.62 174.36 1wln s ASN 66 N -1.87 4.58 -0.37 3.53 2.47 -1.18 -3.69 114.94 118.42 1wln s ASN 66 Ca 0.22 -1.58 0.03 0.00 0.42 0.00 0.00 52.86 51.94 1wln s ASN 66 Cb -0.12 -1.59 0.10 0.00 -1.45 0.00 0.00 41.25 38.20 1wln s ASN 66 CO 0.14 -0.25 0.10 -0.04 -3.72 0.00 0.00 177.10 173.33 1wln s MET 67 N 1.07 1.62 -0.68 0.43 -1.94 0.29 -4.52 119.30 115.58 1wln s MET 67 Ca -0.03 -1.93 0.00 0.00 -1.71 0.00 0.00 55.69 52.01 1wln s MET 67 Cb -0.20 -3.29 0.00 0.00 2.01 0.00 0.00 34.83 33.35 1wln s MET 67 CO -0.05 -0.98 0.00 -3.47 -0.01 0.00 0.00 175.02 170.51 1wln n ASP 68 N 4.22 -3.54 0.00 3.03 -0.08 -1.26 -2.31 116.55 116.60 1wln n ASP 68 Ca 0.03 0.13 0.00 0.00 -1.51 0.00 0.00 54.79 53.44 1wln n ASP 68 Cb 0.41 -1.89 0.00 0.00 2.34 0.00 0.00 41.12 41.98 1wln n ASP 68 CO 0.00 0.00 0.00 0.61 0.12 0.00 0.00 177.20 177.93 1wln n GLY 69 N -1.93 3.01 3.77 0.27 0.00 -1.26 -5.04 105.19 104.01 1wln n GLY 69 Ca -0.07 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.57 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 -2.68 3.67 -0.02 1.61 1.01 -0.98 -4.76 120.40 118.26 1wln s VAL 70 Ca 0.00 1.43 0.02 0.00 0.00 0.00 0.00 61.98 63.43 1wln s VAL 70 Cb 0.00 -3.82 0.00 0.00 0.00 0.00 0.00 36.38 32.57 1wln s VAL 70 CO 0.00 0.16 -0.05 -0.69 0.00 0.00 0.00 175.10 174.51 1wln s VAL 71 N -1.46 0.48 -0.08 2.92 1.01 -1.26 -0.54 120.40 121.47 1wln s VAL 71 Ca 0.52 -0.21 -0.02 0.00 0.00 0.00 0.00 61.98 62.28 1wln s VAL 71 Cb -0.26 -0.44 0.03 0.00 0.00 0.00 0.00 36.38 35.72 1wln s VAL 71 CO 0.32 0.16 0.02 0.42 0.00 0.00 0.00 175.10 176.02 1wln s THR 72 N 0.17 0.25 -0.10 3.92 -4.23 -1.24 -1.68 115.64 112.74 1wln s THR 72 Ca -0.02 0.14 -0.29 0.00 -1.18 0.00 0.00 61.69 60.34 1wln s THR 72 Cb -0.06 -0.47 -0.04 0.00 1.34 0.00 0.00 72.50 73.26 1wln s THR 72 CO -0.00 0.19 1.56 0.54 -0.54 0.00 0.00 174.62 176.37 1wln s VAL 73 N 2.02 3.75 -0.30 2.29 0.11 0.38 -4.32 120.40 124.34 1wln s VAL 73 Ca 0.05 0.90 0.03 0.00 -2.93 0.00 0.00 61.98 60.03 1wln s VAL 73 Cb -0.13 -3.60 0.08 0.00 -1.53 0.00 0.00 36.38 31.20 1wln s VAL 73 CO -0.05 -0.10 -0.03 -0.89 -3.33 0.00 0.00 175.10 170.70 1wln s THR 74 N 4.03 2.28 -0.21 5.04 2.01 -1.04 -1.07 115.64 126.68 1wln s THR 74 Ca 0.69 -1.95 -0.29 0.00 0.31 0.00 0.00 61.69 60.45 1wln s THR 74 Cb -0.30 -2.50 -0.01 0.00 0.01 0.00 0.00 72.50 69.70 1wln s THR 74 CO 0.26 -0.30 1.30 -2.16 -0.69 0.00 0.00 174.62 173.03 1wln s PRO 75 N 1.02 4.11 -0.22 4.92 0.04 -1.26 -1.37 135.00 142.24 1wln s PRO 75 Ca 0.00 1.54 0.11 0.00 0.04 0.00 0.00 61.00 62.69 1wln s PRO 75 Cb -0.20 -3.82 0.43 0.00 0.04 0.00 0.00 34.50 30.95 1wln s PRO 75 CO -0.06 -0.87 1.23 0.54 0.04 0.00 0.00 177.00 177.89 1wln n ARG 76 N 6.89 1.77 -4.00 4.56 5.12 -1.22 -4.92 116.66 124.86 1wln n ARG 76 Ca 0.14 -3.38 -0.23 0.00 -1.93 0.00 0.00 57.85 52.46 1wln n ARG 76 Cb 0.45 -1.69 -0.17 0.00 -1.16 0.00 0.00 32.46 29.90 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 -3.23 1.53 -1.62 0.55 0.01 -1.25 -4.96 113.70 104.74 1wln s SER 77 Ca 0.40 -0.17 -0.10 0.00 1.31 0.00 0.00 55.95 57.39 1wln s SER 77 Cb 0.38 -0.57 -0.08 0.00 0.21 0.00 0.00 66.02 65.96 1wln s SER 77 CO -0.06 -0.11 2.93 0.80 0.41 0.00 0.00 173.24 177.21 1wln n MET 78 N 4.62 3.69 0.00 12.44 1.56 -1.26 -2.91 117.12 135.26 1wln n MET 78 Ca -0.15 -2.23 0.00 0.00 -0.27 0.00 0.00 57.70 55.04 1wln n MET 78 Cb 0.50 -2.82 0.00 0.00 2.15 0.00 0.00 33.22 33.06 1wln n MET 78 CO 0.00 0.00 0.00 -0.25 -0.73 0.00 0.00 175.97 174.99 1wln n ASP 79 N 3.66 0.00 -4.56 6.12 8.00 -1.26 -5.09 116.55 123.42 1wln n ASP 79 Ca 0.78 0.00 -0.39 0.00 0.71 0.00 0.00 54.79 55.89 1wln n ASP 79 Cb 0.24 0.00 -0.03 0.00 -0.02 0.00 0.00 41.12 41.31 1wln n ASP 79 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1wln s ALA 80 N 0.00 2.16 -0.05 2.24 0.00 -1.14 -4.92 121.76 120.05 1wln s ALA 80 Ca 0.00 -0.17 -0.30 0.00 0.00 0.00 0.00 51.96 51.49 1wln s ALA 80 Cb 0.00 -4.25 -0.03 0.00 0.00 0.00 0.00 23.12 18.84 1wln s ALA 80 CO 0.00 -3.77 1.18 -1.21 0.00 0.00 0.00 175.76 171.96 1wln s GLU 81 N 7.13 4.37 -0.21 0.00 8.01 -1.26 -4.83 118.70 131.91 1wln s GLU 81 Ca 0.82 1.65 -0.00 0.00 0.01 0.00 0.00 54.97 57.45 1wln s GLU 81 Cb -0.17 -3.54 0.06 0.00 -4.31 0.00 0.00 34.13 26.17 1wln s GLU 81 CO 0.26 -0.41 -0.04 0.99 0.01 0.00 0.00 175.26 176.07 1wln s THR 82 N 2.08 1.27 -0.23 3.63 2.01 -1.26 -2.11 115.64 121.03 1wln s THR 82 Ca 0.55 -0.99 -0.01 0.00 0.31 0.00 0.00 61.69 61.55 1wln s THR 82 Cb -0.24 -1.56 0.02 0.00 0.01 0.00 0.00 72.50 70.72 1wln s THR 82 CO 0.22 -0.08 -0.08 -0.31 -0.69 0.00 0.00 174.62 173.69 1wln s TYR 83 N 1.52 3.01 -0.86 4.92 2.02 -1.09 -2.13 117.35 124.75 1wln s TYR 83 Ca -0.04 -1.48 -0.18 0.00 -0.37 0.00 0.00 57.07 55.00 1wln s TYR 83 Cb -0.18 -2.04 0.15 0.00 -0.40 0.00 0.00 41.96 39.49 1wln s TYR 83 CO -0.07 -0.71 0.98 0.08 -1.57 0.00 0.00 175.55 174.26 1wln s VAL 84 N 1.34 4.95 0.00 0.71 1.01 0.22 -0.02 120.40 128.61 1wln s VAL 84 Ca 0.02 -1.70 0.00 0.00 0.00 0.00 0.00 61.98 60.30 1wln s VAL 84 Cb -0.16 -4.66 0.00 0.00 0.00 0.00 0.00 36.38 31.56 1wln s VAL 84 CO -0.06 -1.34 0.00 -0.67 0.00 0.00 0.00 175.10 173.03 1wln n ASP 85 N 5.90 -0.98 0.00 3.32 2.03 0.90 -3.35 116.55 124.37 1wln n ASP 85 Ca 0.16 0.00 0.00 0.00 0.52 0.00 0.00 54.79 55.47 1wln n ASP 85 Cb 0.48 -0.43 0.00 0.00 -0.72 0.00 0.00 41.12 40.44 1wln n ASP 85 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 1wln n GLY 86 N -0.93 0.69 3.21 0.27 0.00 -1.25 -4.95 105.19 102.24 1wln n GLY 86 Ca 0.00 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.67 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 -0.25 2.85 0.62 1.61 -0.21 -1.21 -5.00 119.66 118.07 1wln s GLN 87 Ca 0.00 -0.97 -0.17 0.00 0.02 0.00 0.00 55.36 54.24 1wln s GLN 87 Cb 0.00 -3.02 -0.02 0.00 1.00 0.00 0.00 33.01 30.97 1wln s GLN 87 CO 0.00 -0.41 1.12 0.50 -2.12 0.00 0.00 175.29 174.38 1wln s ARG 88 N 1.34 2.99 0.11 2.91 3.52 -1.26 0.73 118.95 129.29 1wln s ARG 88 Ca 0.00 1.47 0.09 0.00 -0.13 0.00 0.00 55.73 57.16 1wln s ARG 88 Cb -0.17 -1.97 -0.04 0.00 -1.56 0.00 0.00 34.95 31.22 1wln s ARG 88 CO -0.04 -1.11 -0.22 0.96 -0.81 0.00 0.00 175.30 174.08 1wln s ILE 89 N -2.14 1.81 -0.13 4.11 -4.36 -0.91 -4.86 121.20 114.72 1wln s ILE 89 Ca 0.69 -1.60 0.06 0.00 -0.26 0.00 0.00 60.65 59.54 1wln s ILE 89 Cb -0.22 -1.64 -0.08 0.00 1.25 0.00 0.00 42.46 41.77 1wln s ILE 89 CO 0.36 -0.05 0.18 -1.20 0.24 0.00 0.00 174.94 174.48 1wln n SER 90 N 1.02 2.04 -2.70 4.36 7.64 -1.26 -4.82 113.62 119.90 1wln n SER 90 Ca -0.19 -0.30 -0.14 0.00 1.01 0.00 0.00 58.87 59.25 1wln n SER 90 Cb 0.54 1.14 -0.05 0.00 -1.01 0.00 0.00 64.21 64.82 1wln n SER 90 CO 0.00 0.00 0.00 -0.62 -3.01 0.00 0.00 175.04 171.41 1wln n GLU 91 N -1.43 0.38 -1.54 1.43 -0.58 -1.26 -4.91 120.64 112.73 1wln n GLU 91 Ca -0.00 -2.50 -0.39 0.00 -0.42 0.00 0.00 57.16 53.85 1wln n GLU 91 Cb 0.12 2.14 -0.05 0.00 -0.57 0.00 0.00 31.44 33.08 1wln n GLU 91 CO 0.00 0.00 0.00 2.41 -0.48 0.00 0.00 177.13 179.06 1wln n THR 92 N -0.48 0.02 -4.01 2.62 -1.04 -1.26 -4.64 114.28 105.49 1wln n THR 92 Ca 0.05 -0.60 -0.35 0.00 -2.04 0.00 0.00 64.05 61.11 1wln n THR 92 Cb 0.47 -2.37 -0.10 0.00 -1.82 0.00 0.00 70.33 66.51 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 10.74 4.81 0.78 12.58 2.01 -0.23 -4.91 115.64 141.41 1wln s THR 93 Ca 1.04 -0.03 -0.13 0.00 0.31 0.00 0.00 61.69 62.88 1wln s THR 93 Cb -0.40 -3.16 0.06 0.00 0.01 0.00 0.00 72.50 69.01 1wln s THR 93 CO 0.33 0.47 1.17 -0.32 -0.69 0.00 0.00 174.62 175.58 1wln s MET 94 N 0.29 1.92 -0.05 4.92 1.75 -1.26 -0.47 119.30 126.40 1wln s MET 94 Ca 0.04 1.61 0.04 0.00 -1.25 0.00 0.00 55.69 56.14 1wln s MET 94 Cb -0.12 -1.82 -0.02 0.00 2.84 0.00 0.00 34.83 35.70 1wln s MET 94 CO 0.00 -1.97 -0.18 -0.51 -0.65 0.00 0.00 175.02 171.71 1wln s LEU 95 N -5.58 2.52 0.20 4.11 1.43 -0.67 -4.75 118.68 115.92 1wln s LEU 95 Ca 0.70 -0.30 0.11 0.00 -1.03 0.00 0.00 54.13 53.61 1wln s LEU 95 Cb -0.26 -1.49 -0.04 0.00 0.03 0.00 0.00 46.19 44.43 1wln s LEU 95 CO 0.49 0.31 -0.23 -1.10 0.23 0.00 0.00 176.35 176.06 1wln s GLN 96 N -0.53 1.49 -0.02 1.70 -0.21 -1.26 -4.76 119.66 116.06 1wln s GLN 96 Ca 0.07 -1.53 -0.30 0.00 0.02 0.00 0.00 55.36 53.63 1wln s GLN 96 Cb -0.11 -1.75 -0.06 0.00 1.00 0.00 0.00 33.01 32.09 1wln s GLN 96 CO 0.01 0.37 1.58 -1.54 -2.12 0.00 0.00 175.29 173.59 1wln s SER 97 N -2.74 6.71 0.00 5.90 1.04 -1.25 -2.15 113.70 121.21 1wln s SER 97 Ca 0.21 2.23 0.00 0.00 0.48 0.00 0.00 55.95 58.87 1wln s SER 97 Cb -0.07 -2.55 0.00 0.00 0.10 0.00 0.00 66.02 63.50 1wln s SER 97 CO 0.10 -0.86 0.00 0.61 0.98 0.00 0.00 173.24 174.06 1wln n GLY 98 N 3.97 2.17 3.74 7.32 0.00 0.22 -4.97 105.19 117.64 1wln n GLY 98 Ca 0.16 -0.28 -0.40 0.00 0.00 0.00 0.00 46.02 45.50 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 2.13 -3.22 1.61 2.00 -0.91 -4.66 117.12 114.08 1wln n MET 99 Ca 0.00 0.76 -0.31 0.00 0.00 0.00 0.00 57.70 58.15 1wln n MET 99 Cb 0.00 -2.54 -0.05 0.00 0.00 0.00 0.00 33.22 30.63 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 -2.36 3.84 -0.27 0.03 0.52 -1.26 -1.34 118.95 118.11 1wln s ARG 100 Ca 0.61 0.40 0.01 0.00 -0.52 0.00 0.00 55.73 56.23 1wln s ARG 100 Cb -0.47 -2.53 0.08 0.00 0.52 0.00 0.00 34.95 32.55 1wln s ARG 100 CO 0.58 0.19 -0.00 -0.51 0.02 0.00 0.00 175.30 175.57 1wln s LEU 101 N -3.15 2.90 -0.06 2.53 1.43 0.90 -0.07 118.68 123.16 1wln s LEU 101 Ca 0.50 -1.45 -0.18 0.00 -1.03 0.00 0.00 54.13 51.97 1wln s LEU 101 Cb -0.11 -1.19 -0.05 0.00 0.03 0.00 0.00 46.19 44.87 1wln s LEU 101 CO 0.23 -0.30 0.49 -1.58 0.23 0.00 0.00 176.35 175.42 1wln s GLN 102 N 1.35 4.25 -0.60 1.70 0.74 0.96 0.30 119.66 128.37 1wln s GLN 102 Ca 0.00 0.51 0.06 0.00 0.05 0.00 0.00 55.36 55.99 1wln s GLN 102 Cb -0.19 -3.37 0.24 0.00 1.10 0.00 0.00 33.01 30.80 1wln s GLN 102 CO -0.10 0.32 0.67 1.19 -0.55 0.00 0.00 175.29 176.82 1wln n PHE 103 N 3.04 2.79 -0.40 1.67 3.72 -0.40 -2.66 117.46 125.22 1wln n PHE 103 Ca -0.08 -4.05 0.00 0.00 -0.05 0.00 0.00 57.45 53.27 1wln n PHE 103 Cb 0.52 -0.51 0.00 0.00 -0.94 0.00 0.00 39.48 38.55 1wln n PHE 103 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 1wln n GLY 104 N 1.11 1.06 3.53 1.37 0.00 -0.90 -4.09 105.19 107.26 1wln n GLY 104 Ca 0.27 -0.11 -0.22 0.00 0.00 0.00 0.00 46.02 45.96 1wln n GLY 104 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1wln n THR 105 N -0.50 -0.36 0.00 2.61 -2.24 -1.26 -4.50 114.28 108.03 1wln n THR 105 Ca 0.00 -0.18 0.00 0.00 -2.27 0.00 0.00 64.05 61.60 1wln n THR 105 Cb 0.08 -0.49 0.00 0.00 -2.10 0.00 0.00 70.33 67.82 1wln n THR 105 CO 0.00 0.00 0.00 -1.54 -0.57 0.00 0.00 175.07 172.96 1wln n SER 106 N -1.48 0.00 -3.98 3.42 3.41 -1.26 -5.05 113.62 108.68 1wln n SER 106 Ca -0.09 0.00 -0.31 0.00 -0.26 0.00 0.00 58.87 58.21 1wln n SER 106 Cb 0.37 0.09 -0.15 0.00 -0.26 0.00 0.00 64.21 64.25 1wln n SER 106 CO 0.00 0.00 0.00 -1.00 -0.16 0.00 0.00 175.04 173.88 1wln s HIS 107 N -1.79 3.06 0.34 7.33 4.02 -1.26 -4.74 115.29 122.25 1wln s HIS 107 Ca 0.00 -2.38 0.07 0.00 1.02 0.00 0.00 55.06 53.77 1wln s HIS 107 Cb 0.00 -2.20 -0.02 0.00 -1.02 0.00 0.00 32.58 29.34 1wln s HIS 107 CO 0.00 -0.88 0.35 0.14 1.02 0.00 0.00 174.74 175.37 1wln s VAL 108 N 1.16 3.69 0.11 -0.90 -7.23 -1.21 -1.28 120.40 114.75 1wln s VAL 108 Ca 0.02 -1.25 -0.12 0.00 -1.81 0.00 0.00 61.98 58.81 1wln s VAL 108 Cb -0.19 -3.25 0.01 0.00 0.56 0.00 0.00 36.38 33.51 1wln s VAL 108 CO -0.09 -0.17 0.30 -0.36 -0.31 0.00 0.00 175.10 174.47 1wln s PHE 109 N -2.27 0.01 -0.29 2.82 0.40 0.15 0.25 117.98 119.04 1wln s PHE 109 Ca 0.42 -0.38 -0.04 0.00 -0.60 0.00 0.00 56.93 56.33 1wln s PHE 109 Cb -0.07 0.09 0.03 0.00 0.51 0.00 0.00 43.02 43.58 1wln s PHE 109 CO 0.28 -0.64 0.03 0.21 0.70 0.00 0.00 175.22 175.80 1wln s LYS 110 N -3.84 2.77 -0.00 0.44 2.20 -0.78 0.31 119.74 120.83 1wln s LYS 110 Ca 0.05 -1.05 -0.30 0.00 -0.36 0.00 0.00 55.97 54.31 1wln s LYS 110 Cb 0.03 -3.24 -0.03 0.00 -1.51 0.00 0.00 37.83 33.08 1wln s LYS 110 CO -0.10 -0.52 1.02 0.12 -0.36 0.00 0.00 175.35 175.51 1wln s PHE 111 N 1.37 3.61 0.04 4.03 2.19 -0.45 -2.25 117.98 126.52 1wln s PHE 111 Ca -0.01 1.62 0.06 0.00 0.33 0.00 0.00 56.93 58.93 1wln s PHE 111 Cb -0.18 -3.17 -0.02 0.00 -1.31 0.00 0.00 43.02 38.33 1wln s PHE 111 CO -0.00 -0.24 -0.17 0.08 1.83 0.00 0.00 175.22 176.72 1wln s VAL 112 N 1.13 1.34 -0.47 3.12 1.01 -0.64 0.73 120.40 126.62 1wln s VAL 112 Ca 0.53 -1.08 -0.04 0.00 0.00 0.00 0.00 61.98 61.40 1wln s VAL 112 Cb -0.22 -1.19 0.12 0.00 0.00 0.00 0.00 36.38 35.09 1wln s VAL 112 CO 0.27 0.09 0.28 -0.62 0.00 0.00 0.00 175.10 175.13 1wln s ASP 113 N -1.14 5.31 0.00 3.32 -1.08 -1.26 -2.74 116.67 119.09 1wln s ASP 113 Ca 0.04 -2.23 0.23 0.00 -0.52 0.00 0.00 52.55 50.07 1wln s ASP 113 Cb -0.08 -1.86 1.19 0.00 -1.46 0.00 0.00 42.92 40.71 1wln s ASP 113 CO 0.01 -0.52 1.75 -0.81 0.52 0.00 0.00 175.17 176.13 1wln n PRO 114 N 4.35 0.39 0.08 4.34 -0.04 -1.26 -3.33 135.00 139.53 1wln n PRO 114 Ca -0.00 0.06 -0.13 0.00 -0.04 0.00 0.00 63.50 63.39 1wln n PRO 114 Cb 0.40 -1.50 -0.08 0.00 -0.04 0.00 0.00 33.50 32.28 1wln n PRO 114 CO 0.00 0.00 0.00 1.03 -0.04 0.00 0.00 175.50 176.49 1wln h SER 115 N 0.00 -0.18 -1.73 3.54 0.87 -1.85 -3.42 113.55 110.78 1wln h SER 115 Ca 0.00 -0.25 0.00 0.00 -1.23 0.00 0.00 61.79 60.31 1wln h SER 115 Cb 0.18 0.05 0.00 0.00 -0.44 0.00 0.00 62.40 62.19 1wln h SER 115 CO 0.00 0.17 0.00 0.61 -0.53 0.00 0.00 176.83 177.08 1wln n GLY 116 N -0.25 3.70 3.77 5.77 0.00 -1.21 -5.03 105.19 111.93 1wln n GLY 116 Ca -0.09 -1.52 -0.29 0.00 0.00 0.00 0.00 46.02 44.11 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 -4.64 0.26 -0.04 1.61 0.04 -1.26 -4.61 135.00 126.36 1wln s PRO 117 Ca 0.00 -0.04 -0.00 0.00 0.04 0.00 0.00 61.00 61.00 1wln s PRO 117 Cb 0.00 -1.77 0.00 0.00 0.04 0.00 0.00 34.50 32.77 1wln s PRO 117 CO 0.00 -2.73 0.00 0.43 0.04 0.00 0.00 177.00 174.74 1wln n SER 118 N -4.07 -6.74 -3.83 6.66 7.64 -1.26 -4.95 113.62 107.07 1wln n SER 118 Ca 0.11 0.56 -0.30 0.00 1.01 0.00 0.00 58.87 60.25 1wln n SER 118 Cb 0.59 -2.01 -0.15 0.00 -1.01 0.00 0.00 64.21 61.64 1wln n SER 118 CO 0.00 0.00 0.00 -0.55 -3.01 0.00 0.00 175.04 171.48 1wln s SER 119 N -1.00 4.18 0.00 6.43 0.15 -1.26 -5.26 113.70 116.94 1wln s SER 119 Ca -0.00 -2.09 0.00 0.00 0.70 0.00 0.00 55.95 54.56 1wln s SER 119 Cb 0.00 -1.17 0.00 0.00 -1.71 0.00 0.00 66.02 63.14 1wln s SER 119 CO 0.09 -0.36 0.24 0.61 1.20 0.00 0.00 173.24 175.02