#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1wcf s MET 1 N 0.00 4.41 0.14 1.57 0.00 -1.26 -5.01 119.30 119.14 1wcf s MET 1 Ca 0.00 1.99 -0.07 0.00 0.00 0.00 0.00 55.69 57.60 1wcf s MET 1 Cb 0.00 -3.23 -0.01 0.00 0.00 0.00 0.00 34.83 31.59 1wcf s MET 1 CO 0.00 -0.24 0.21 1.14 0.00 0.00 0.00 175.02 176.13 1wcf s GLN 2 N 0.17 1.03 0.30 4.11 -2.07 -1.26 -4.43 119.66 117.51 1wcf s GLN 2 Ca 0.57 -1.17 -0.19 0.00 -1.82 0.00 0.00 55.36 52.75 1wcf s GLN 2 Cb -0.35 0.34 0.03 0.00 -1.09 0.00 0.00 33.01 31.94 1wcf s GLN 2 CO 0.36 -0.35 0.72 -0.59 -1.32 0.00 0.00 175.29 174.11 1wcf s PHE 3 N -3.95 -0.08 -0.18 9.60 -0.12 -0.44 -4.99 117.98 117.82 1wcf s PHE 3 Ca 0.15 -0.42 -0.11 0.00 -0.05 0.00 0.00 56.93 56.50 1wcf s PHE 3 Cb 0.04 0.70 -0.05 0.00 -0.63 0.00 0.00 43.02 43.09 1wcf s PHE 3 CO -0.03 -1.30 0.18 -0.51 -0.05 0.00 0.00 175.22 173.51 1wcf s ASP 4 N -2.96 6.30 -0.16 1.98 1.01 -1.26 -0.57 116.67 121.00 1wcf s ASP 4 Ca 0.13 0.34 -0.06 0.00 0.71 0.00 0.00 52.55 53.67 1wcf s ASP 4 Cb -0.05 -2.12 -0.04 0.00 1.01 0.00 0.00 42.92 41.72 1wcf s ASP 4 CO 0.08 0.18 0.05 -0.69 0.21 0.00 0.00 175.17 175.00 1wcf s VAL 5 N 0.23 4.65 -0.29 -1.27 1.01 -0.19 -0.91 120.40 123.62 1wcf s VAL 5 Ca 0.11 -0.09 -0.18 0.00 0.00 0.00 0.00 61.98 61.83 1wcf s VAL 5 Cb -0.12 -3.07 -0.02 0.00 0.00 0.00 0.00 36.38 33.18 1wcf s VAL 5 CO 0.00 0.49 0.50 -0.89 0.00 0.00 0.00 175.10 175.21 1wcf s THR 6 N 0.12 5.05 -0.11 3.92 2.01 -0.14 -0.65 115.64 125.85 1wcf s THR 6 Ca 0.04 0.66 -0.30 0.00 0.31 0.00 0.00 61.69 62.41 1wcf s THR 6 Cb -0.12 -3.87 -0.01 0.00 0.01 0.00 0.00 72.50 68.51 1wcf s THR 6 CO 0.01 -0.02 1.02 -0.63 -0.69 0.00 0.00 174.62 174.30 1wcf s ILE 7 N 2.33 4.76 -0.16 1.82 -1.09 -0.22 -1.62 121.20 127.01 1wcf s ILE 7 Ca 0.20 2.03 -0.00 0.00 -2.23 0.00 0.00 60.65 60.64 1wcf s ILE 7 Cb -0.15 -4.30 -0.23 0.00 -1.58 0.00 0.00 42.46 36.19 1wcf s ILE 7 CO 0.11 -0.01 0.20 -0.62 -1.23 0.00 0.00 174.94 173.39 1wcf n GLU 8 N 5.08 0.71 -3.76 2.79 1.02 0.45 0.25 120.64 127.18 1wcf n GLU 8 Ca 0.09 0.21 -0.27 0.00 -0.02 0.00 0.00 57.16 57.17 1wcf n GLU 8 Cb 0.48 -1.65 -0.17 0.00 -0.02 0.00 0.00 31.44 30.09 1wcf n GLU 8 CO 0.00 0.00 0.00 0.42 1.18 0.00 0.00 177.13 178.73 1wcf s ILE 9 N -2.55 0.59 0.62 -3.67 1.01 -0.34 -4.38 121.20 112.49 1wcf s ILE 9 Ca -0.23 -0.51 -0.18 0.00 0.00 0.00 0.00 60.65 59.73 1wcf s ILE 9 Cb 0.07 -1.03 -0.02 0.00 0.01 0.00 0.00 42.46 41.50 1wcf s ILE 9 CO 0.73 -0.12 1.18 -2.84 0.00 0.00 0.00 174.94 173.88 1wcf s PRO 10 N 1.83 2.86 0.16 2.79 0.02 -1.26 -1.02 135.00 140.38 1wcf s PRO 10 Ca -0.00 1.71 -0.33 0.00 0.02 0.00 0.00 61.00 62.40 1wcf s PRO 10 Cb -0.16 -1.93 -0.16 0.00 0.02 0.00 0.00 34.50 32.27 1wcf s PRO 10 CO -0.08 -1.27 1.14 1.17 -0.33 0.00 0.00 177.00 177.64 1wcf n LYS 11 N -1.88 1.08 -0.20 5.54 4.81 -1.25 -2.46 118.16 123.80 1wcf n LYS 11 Ca 0.13 0.39 0.00 0.00 -0.87 0.00 0.00 58.31 57.95 1wcf n LYS 11 Cb 0.50 -1.87 0.00 0.00 0.02 0.00 0.00 35.03 33.68 1wcf n LYS 11 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 1wcf n GLY 12 N 2.00 0.62 3.77 3.14 0.00 0.39 -4.95 105.19 110.16 1wcf n GLY 12 Ca 0.15 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.78 1wcf n GLY 12 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1wcf s GLN 13 N -0.77 4.49 -0.00 1.61 -1.52 -1.03 -4.69 119.66 117.74 1wcf s GLN 13 Ca 0.00 1.06 0.21 0.00 -1.95 0.00 0.00 55.36 54.68 1wcf s GLN 13 Cb 0.00 -3.30 -0.23 0.00 -0.22 0.00 0.00 33.01 29.26 1wcf s GLN 13 CO 0.00 0.45 0.85 -2.13 -0.25 0.00 0.00 175.29 174.21 1wcf n ARG 14 N 2.15 0.10 -2.75 2.91 0.63 -1.26 -1.49 116.66 116.95 1wcf n ARG 14 Ca -0.05 -0.03 -0.42 0.00 -0.92 0.00 0.00 57.85 56.43 1wcf n ARG 14 Cb 0.50 -1.50 -0.03 0.00 0.45 0.00 0.00 32.46 31.87 1wcf n ARG 14 CO 0.00 0.00 0.00 -0.80 -2.51 0.00 0.00 177.63 174.32 1wcf s ASN 15 N -3.24 7.07 -0.77 6.15 0.01 -1.26 -1.11 114.94 121.79 1wcf s ASN 15 Ca 0.06 1.33 -0.20 0.00 -0.71 0.00 0.00 52.86 53.34 1wcf s ASN 15 Cb 0.16 -2.51 0.11 0.00 0.41 0.00 0.00 41.25 39.42 1wcf s ASN 15 CO 0.87 -0.53 0.96 -0.75 -1.51 0.00 0.00 177.10 176.14 1wcf s LYS 16 N 2.61 3.33 0.38 -0.60 2.20 0.11 -4.97 119.74 122.79 1wcf s LYS 16 Ca 0.43 -1.43 -0.11 0.00 -0.36 0.00 0.00 55.97 54.50 1wcf s LYS 16 Cb -0.16 -4.53 -0.07 0.00 -1.51 0.00 0.00 37.83 31.56 1wcf s LYS 16 CO 0.11 -1.71 0.75 0.71 -0.36 0.00 0.00 175.35 174.85 1wcf s TYR 17 N 2.94 3.46 -0.07 4.03 2.02 -1.26 -0.50 117.35 127.97 1wcf s TYR 17 Ca 0.24 1.04 -0.08 0.00 -0.37 0.00 0.00 57.07 57.89 1wcf s TYR 17 Cb -0.13 -2.43 0.02 0.00 -0.40 0.00 0.00 41.96 39.02 1wcf s TYR 17 CO -0.00 -0.05 0.21 -1.21 -1.57 0.00 0.00 175.55 172.93 1wcf s GLU 18 N -3.69 0.31 0.04 -0.62 2.02 0.18 -4.65 118.70 112.30 1wcf s GLU 18 Ca 0.51 0.17 -0.25 0.00 0.02 0.00 0.00 54.97 55.42 1wcf s GLU 18 Cb -0.10 0.15 -0.05 0.00 0.10 0.00 0.00 34.13 34.22 1wcf s GLU 18 CO 0.29 -0.05 0.77 0.08 0.02 0.00 0.00 175.26 176.37 1wcf s VAL 19 N -0.19 4.74 -0.20 2.63 1.01 -1.26 -0.46 120.40 126.66 1wcf s VAL 19 Ca -0.03 1.63 -0.29 0.00 0.00 0.00 0.00 61.98 63.29 1wcf s VAL 19 Cb -0.03 -4.12 -0.01 0.00 0.00 0.00 0.00 36.38 32.23 1wcf s VAL 19 CO 0.01 0.36 1.24 -0.62 0.00 0.00 0.00 175.10 176.09 1wcf s ASP 20 N -0.02 6.91 0.10 3.32 -1.08 0.13 -4.91 116.67 121.11 1wcf s ASP 20 Ca 0.39 1.54 0.27 0.00 -0.52 0.00 0.00 52.55 54.23 1wcf s ASP 20 Cb -0.20 -2.54 1.02 0.00 -1.46 0.00 0.00 42.92 39.73 1wcf s ASP 20 CO 0.23 -0.82 1.83 1.41 0.52 0.00 0.00 175.17 178.34 1wcf n HIS 21 N 6.78 0.41 0.11 -5.34 8.25 -1.26 0.15 115.22 124.32 1wcf n HIS 21 Ca 0.14 0.12 -0.23 0.00 -0.26 0.00 0.00 57.72 57.49 1wcf n HIS 21 Cb 0.45 -0.70 -0.15 0.00 1.12 0.00 0.00 29.99 30.71 1wcf n HIS 21 CO 0.00 0.00 0.00 0.93 0.64 0.00 0.00 176.34 177.91 1wcf h GLU 22 N 0.00 0.48 0.00 -0.41 3.07 -1.98 -3.41 114.58 112.34 1wcf h GLU 22 Ca 0.00 -0.80 0.00 0.00 -0.50 0.00 0.00 59.36 58.06 1wcf h GLU 22 Cb 0.57 0.29 0.00 0.00 -0.84 0.00 0.00 28.75 28.77 1wcf h GLU 22 CO 0.00 1.38 -1.58 0.25 -1.40 0.00 0.00 179.01 177.66 1wcf n THR 23 N -3.86 0.00 -0.60 1.13 -2.24 -1.14 -5.00 114.28 102.58 1wcf n THR 23 Ca -0.16 -0.29 0.00 0.00 -2.27 0.00 0.00 64.05 61.33 1wcf n THR 23 Cb 1.01 0.21 0.00 0.00 -2.10 0.00 0.00 70.33 69.45 1wcf n THR 23 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1wcf n GLY 24 N 1.77 1.33 3.78 3.38 0.00 0.12 -5.03 105.19 110.54 1wcf n GLY 24 Ca -0.02 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.64 1wcf n GLY 24 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1wcf s ARG 25 N -0.18 3.71 -0.07 1.61 1.81 -1.25 -4.70 118.95 119.88 1wcf s ARG 25 Ca 0.00 1.63 -0.21 0.00 -1.72 0.00 0.00 55.73 55.43 1wcf s ARG 25 Cb 0.00 -2.27 -0.04 0.00 -0.45 0.00 0.00 34.95 32.19 1wcf s ARG 25 CO 0.00 -0.56 0.59 0.08 -0.68 0.00 0.00 175.30 174.73 1wcf s VAL 26 N -1.69 5.07 0.06 3.52 1.01 -1.26 -0.70 120.40 126.42 1wcf s VAL 26 Ca 0.66 1.22 0.08 0.00 0.00 0.00 0.00 61.98 63.94 1wcf s VAL 26 Cb -0.25 -3.93 -0.03 0.00 0.00 0.00 0.00 36.38 32.17 1wcf s VAL 26 CO 0.29 0.31 -0.23 -0.60 0.00 0.00 0.00 175.10 174.88 1wcf s ARG 27 N 0.53 1.46 -0.41 2.72 3.52 0.39 -4.97 118.95 122.18 1wcf s ARG 27 Ca 0.32 -1.05 -0.29 0.00 -0.13 0.00 0.00 55.73 54.59 1wcf s ARG 27 Cb -0.17 -1.64 0.02 0.00 -1.56 0.00 0.00 34.95 31.60 1wcf s ARG 27 CO 0.15 0.41 1.09 -1.17 -0.81 0.00 0.00 175.30 174.97 1wcf s LEU 28 N -1.36 3.78 -0.04 -0.88 2.96 -1.26 -0.64 118.68 121.24 1wcf s LEU 28 Ca 0.09 0.66 -0.22 0.00 -0.22 0.00 0.00 54.13 54.44 1wcf s LEU 28 Cb -0.09 -3.51 -0.16 0.00 0.50 0.00 0.00 46.19 42.93 1wcf s LEU 28 CO 0.02 -1.09 0.95 -0.78 -1.32 0.00 0.00 176.35 174.14 1wcf h ASP 29 N 8.77 -0.22 -4.52 3.68 -0.00 -1.12 -3.48 116.42 119.53 1wcf h ASP 29 Ca -0.22 -0.32 0.12 0.00 -0.00 0.00 0.00 57.03 56.61 1wcf h ASP 29 Cb 1.06 0.06 -0.17 0.00 -0.00 0.00 0.00 39.33 40.28 1wcf h ASP 29 CO 1.08 0.30 0.54 0.00 -0.00 0.00 0.00 179.24 181.15 1wcf s ARG 30 N -3.68 0.73 0.01 0.28 1.70 -1.19 -5.04 118.95 111.76 1wcf s ARG 30 Ca -0.13 -0.21 -0.28 0.00 -0.47 0.00 0.00 55.73 54.64 1wcf s ARG 30 Cb 0.01 0.34 -0.04 0.00 -0.57 0.00 0.00 34.95 34.69 1wcf s ARG 30 CO 0.49 -0.31 0.91 -0.47 -1.08 0.00 0.00 175.30 174.84 1wcf s TYR 31 N -2.73 3.68 0.70 5.89 5.04 -1.26 -0.71 117.35 127.96 1wcf s TYR 31 Ca 0.04 1.62 -0.16 0.00 -2.44 0.00 0.00 57.07 56.14 1wcf s TYR 31 Cb -0.01 -3.03 0.02 0.00 0.35 0.00 0.00 41.96 39.29 1wcf s TYR 31 CO -0.07 0.07 1.23 -0.51 -1.34 0.00 0.00 175.55 174.94 1wcf s LEU 32 N 0.70 3.41 0.00 6.97 1.43 -0.26 -4.91 118.68 126.01 1wcf s LEU 32 Ca 0.47 2.45 0.25 0.00 -1.03 0.00 0.00 54.13 56.27 1wcf s LEU 32 Cb -0.21 -4.60 0.52 0.00 0.03 0.00 0.00 46.19 41.93 1wcf s LEU 32 CO 0.26 -2.17 1.42 -1.22 0.23 0.00 0.00 176.35 174.87 1wcf n TYR 33 N -2.43 0.00 -4.19 0.29 4.01 -1.26 -4.87 117.16 108.71 1wcf n TYR 33 Ca 0.14 0.00 -0.25 0.00 -0.16 0.00 0.00 57.90 57.63 1wcf n TYR 33 Cb 0.49 -0.25 -0.07 0.00 -0.31 0.00 0.00 39.34 39.21 1wcf n TYR 33 CO 0.00 0.00 0.00 0.95 -0.46 0.00 0.00 176.86 177.35 1wcf s THR 34 N -2.99 3.92 -1.49 -0.72 -4.23 -1.26 -4.86 115.64 104.00 1wcf s THR 34 Ca 0.11 -1.45 -0.09 0.00 -1.18 0.00 0.00 61.69 59.08 1wcf s THR 34 Cb 0.18 -3.02 0.01 0.00 1.34 0.00 0.00 72.50 71.00 1wcf s THR 34 CO 0.70 -0.19 2.61 -0.81 -0.54 0.00 0.00 174.62 176.38 1wcf n PRO 35 N -0.46 3.82 -4.35 3.99 -0.04 -1.26 -4.86 135.00 131.85 1wcf n PRO 35 Ca -0.09 -2.72 -0.18 0.00 -0.04 0.00 0.00 63.50 60.47 1wcf n PRO 35 Cb 0.56 -2.84 -0.10 0.00 -0.04 0.00 0.00 33.50 31.08 1wcf n PRO 35 CO 0.00 0.00 0.00 -1.64 -0.04 0.00 0.00 175.50 173.82 1wcf s MET 36 N 1.25 1.35 -0.08 0.54 -1.94 -1.26 -5.16 119.30 113.99 1wcf s MET 36 Ca 0.60 -1.64 -0.08 0.00 -1.71 0.00 0.00 55.69 52.85 1wcf s MET 36 Cb 0.17 -0.90 0.02 0.00 2.01 0.00 0.00 34.83 36.13 1wcf s MET 36 CO -0.07 0.05 0.23 0.00 -0.01 0.00 0.00 175.02 175.22 1wcf s ALA 37 N -3.17 -0.58 0.16 3.03 0.00 -1.26 -4.38 121.76 115.57 1wcf s ALA 37 Ca 0.25 0.60 -0.34 0.00 0.00 0.00 0.00 51.96 52.47 1wcf s ALA 37 Cb 0.03 -0.33 -0.14 0.00 0.00 0.00 0.00 23.12 22.67 1wcf s ALA 37 CO 0.08 -0.13 1.49 0.66 0.00 0.00 0.00 175.76 177.86 1wcf n TYR 38 N 2.77 2.10 0.34 0.00 4.02 -0.56 -4.69 117.16 121.14 1wcf n TYR 38 Ca -0.14 0.38 0.12 0.00 -0.01 0.00 0.00 57.90 58.25 1wcf n TYR 38 Cb 0.58 -2.48 0.24 0.00 -0.02 0.00 0.00 39.34 37.66 1wcf n TYR 38 CO 0.00 0.00 0.00 -1.00 -1.01 0.00 0.00 176.86 174.85 1wcf h PRO 39 N 5.28 0.00 -4.06 -0.72 0.13 -1.92 0.11 132.00 130.82 1wcf h PRO 39 Ca -0.45 0.00 -0.13 0.00 -0.87 0.00 0.00 66.00 64.55 1wcf h PRO 39 Cb 1.27 0.00 -0.13 0.00 0.13 0.00 0.00 31.00 32.27 1wcf h PRO 39 CO 0.84 0.00 -0.43 0.95 -0.23 0.00 0.00 178.00 179.13 1wcf s THR 40 N -3.18 0.08 0.37 1.56 -4.23 -1.26 -4.86 115.64 104.12 1wcf s THR 40 Ca 0.08 -1.55 -0.28 0.00 -1.18 0.00 0.00 61.69 58.76 1wcf s THR 40 Cb 0.07 -1.88 -0.11 0.00 1.34 0.00 0.00 72.50 71.92 1wcf s THR 40 CO 0.65 -0.37 1.51 -1.81 -0.54 0.00 0.00 174.62 174.05 1wcf s ASP 41 N -2.99 6.32 -0.01 3.99 1.11 -1.21 -3.80 116.67 120.08 1wcf s ASP 41 Ca 0.19 3.06 0.02 0.00 0.18 0.00 0.00 52.55 56.00 1wcf s ASP 41 Cb 0.05 -2.67 -0.00 0.00 1.07 0.00 0.00 42.92 41.37 1wcf s ASP 41 CO -0.00 -0.90 -0.06 -0.47 1.18 0.00 0.00 175.17 174.92 1wcf s TYR 42 N -1.00 0.57 0.00 4.23 5.04 -0.19 -1.18 117.35 124.82 1wcf s TYR 42 Ca 0.54 -0.11 0.00 0.00 -2.44 0.00 0.00 57.07 55.06 1wcf s TYR 42 Cb -0.47 -0.38 0.00 0.00 0.35 0.00 0.00 41.96 41.46 1wcf s TYR 42 CO 0.62 -0.02 0.00 0.41 -1.34 0.00 0.00 175.55 175.22 1wcf n GLY 43 N 3.00 1.65 3.27 8.97 0.00 0.22 -0.41 105.19 121.89 1wcf n GLY 43 Ca -0.14 0.10 -0.09 0.00 0.00 0.00 0.00 46.02 45.88 1wcf n GLY 43 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 1wcf s PHE 44 N 1.03 0.07 -0.23 1.61 -0.12 -0.64 -0.72 117.98 118.99 1wcf s PHE 44 Ca 0.00 -0.46 -0.20 0.00 -0.05 0.00 0.00 56.93 56.22 1wcf s PHE 44 Cb 0.00 0.05 -0.02 0.00 -0.63 0.00 0.00 43.02 42.42 1wcf s PHE 44 CO 0.00 -0.63 0.61 0.42 -0.05 0.00 0.00 175.22 175.57 1wcf s ILE 45 N -3.86 5.02 0.49 -4.49 1.01 0.23 -0.97 121.20 118.63 1wcf s ILE 45 Ca 0.06 1.12 -0.24 0.00 0.00 0.00 0.00 60.65 61.59 1wcf s ILE 45 Cb 0.04 -3.92 -0.07 0.00 0.01 0.00 0.00 42.46 38.51 1wcf s ILE 45 CO -0.09 0.08 1.40 -0.62 0.00 0.00 0.00 174.94 175.70 1wcf n GLU 46 N 5.36 2.02 -2.75 2.79 -0.58 -0.09 -3.23 120.64 124.17 1wcf n GLU 46 Ca -0.02 0.73 -0.16 0.00 -0.42 0.00 0.00 57.16 57.30 1wcf n GLU 46 Cb 0.49 -2.60 0.02 0.00 -0.57 0.00 0.00 31.44 28.79 1wcf n GLU 46 CO 0.00 0.00 0.00 -0.25 -0.48 0.00 0.00 177.13 176.40 1wcf n ASP 47 N -0.49 -4.73 -4.33 1.62 8.00 -1.26 -4.74 116.55 110.62 1wcf n ASP 47 Ca 0.07 -0.19 -0.21 0.00 0.71 0.00 0.00 54.79 55.17 1wcf n ASP 47 Cb 0.43 -3.62 -0.11 0.00 -0.02 0.00 0.00 41.12 37.80 1wcf n ASP 47 CO 0.00 0.00 0.00 0.42 -0.39 0.00 0.00 177.20 177.23 1wcf s THR 48 N -2.97 1.78 -0.11 -3.53 -4.23 -1.20 -4.49 115.64 100.90 1wcf s THR 48 Ca 0.20 -1.94 -0.03 0.00 -1.18 0.00 0.00 61.69 58.74 1wcf s THR 48 Cb -0.09 -1.84 0.05 0.00 1.34 0.00 0.00 72.50 71.96 1wcf s THR 48 CO 0.24 -0.35 0.11 -0.22 -0.54 0.00 0.00 174.62 173.86 1wcf s LEU 49 N -2.72 0.12 0.97 4.79 2.96 -0.28 -3.97 118.68 120.55 1wcf s LEU 49 Ca 0.16 -0.11 -0.14 0.00 -0.22 0.00 0.00 54.13 53.82 1wcf s LEU 49 Cb -0.05 -0.02 0.17 0.00 0.50 0.00 0.00 46.19 46.79 1wcf s LEU 49 CO 0.06 -0.29 1.14 -0.83 -1.32 0.00 0.00 176.35 175.12 1wcf s GLY 50 N 2.21 1.59 0.50 7.98 0.00 0.66 -4.47 107.32 115.78 1wcf s GLY 50 Ca 0.04 -0.62 0.19 0.00 0.00 0.00 0.00 44.72 44.33 1wcf s GLY 50 CO -0.07 0.01 2.08 -0.55 0.00 0.00 0.00 173.10 174.57 1wcf h ASP 51 N -1.71 0.00 0.14 1.64 3.32 -1.98 -1.66 116.42 116.17 1wcf h ASP 51 Ca -0.50 0.00 0.00 0.00 0.02 0.00 0.00 57.03 56.55 1wcf h ASP 51 Cb 1.32 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.87 1wcf h ASP 51 CO 0.56 0.10 0.00 -0.90 -1.72 0.00 0.00 179.24 177.28 1wcf n ASP 52 N -4.20 0.00 0.00 6.45 5.75 -1.26 -4.89 116.55 118.40 1wcf n ASP 52 Ca -0.03 -0.69 0.00 0.00 -0.01 0.00 0.00 54.79 54.07 1wcf n ASP 52 Cb 0.18 -0.08 0.00 0.00 -1.03 0.00 0.00 41.12 40.19 1wcf n ASP 52 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 1wcf n GLY 53 N 0.89 0.75 3.86 6.12 0.00 -0.62 -5.06 105.19 111.13 1wcf n GLY 53 Ca 0.19 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.98 1wcf n GLY 53 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1wcf s ASP 54 N -2.88 5.80 0.96 1.61 1.01 -1.26 -4.85 116.67 117.05 1wcf s ASP 54 Ca 0.00 -0.10 -0.11 0.00 0.71 0.00 0.00 52.55 53.05 1wcf s ASP 54 Cb 0.00 -1.57 0.17 0.00 1.01 0.00 0.00 42.92 42.53 1wcf s ASP 54 CO 0.00 -0.01 1.11 -2.84 0.21 0.00 0.00 175.17 173.64 1wcf s PRO 55 N -3.62 0.66 0.05 8.23 0.02 -1.25 -0.24 135.00 138.84 1wcf s PRO 55 Ca 0.33 1.33 -0.30 0.00 0.02 0.00 0.00 61.00 62.37 1wcf s PRO 55 Cb -0.09 -1.70 -0.05 0.00 0.02 0.00 0.00 34.50 32.67 1wcf s PRO 55 CO 0.26 -2.80 1.20 -1.17 -0.33 0.00 0.00 177.00 174.16 1wcf s LEU 56 N -6.69 4.36 0.62 -5.54 2.96 -1.26 -4.61 118.68 108.52 1wcf s LEU 56 Ca 0.67 1.99 -0.16 0.00 -0.22 0.00 0.00 54.13 56.40 1wcf s LEU 56 Cb -0.23 -3.58 -0.02 0.00 0.50 0.00 0.00 46.19 42.87 1wcf s LEU 56 CO 0.59 -0.48 1.12 -1.81 -1.32 0.00 0.00 176.35 174.44 1wcf s ASP 57 N 1.12 5.33 0.00 3.68 1.01 -1.26 -0.60 116.67 125.96 1wcf s ASP 57 Ca 0.58 2.05 -0.03 0.00 0.71 0.00 0.00 52.55 55.87 1wcf s ASP 57 Cb -0.29 -2.56 -0.01 0.00 1.01 0.00 0.00 42.92 41.08 1wcf s ASP 57 CO 0.28 -1.48 0.05 0.00 0.21 0.00 0.00 175.17 174.23 1wcf s ALA 58 N -2.15 -0.11 -0.10 5.23 0.00 0.10 -0.98 121.76 123.76 1wcf s ALA 58 Ca 0.69 -0.22 0.02 0.00 0.00 0.00 0.00 51.96 52.45 1wcf s ALA 58 Cb -0.21 0.06 -0.01 0.00 0.00 0.00 0.00 23.12 22.95 1wcf s ALA 58 CO 0.36 -0.14 -0.17 -0.51 0.00 0.00 0.00 175.76 175.31 1wcf s LEU 59 N -0.99 2.54 -0.12 0.00 1.43 0.43 -0.61 118.68 121.37 1wcf s LEU 59 Ca -0.11 -0.36 0.02 0.00 -1.03 0.00 0.00 54.13 52.65 1wcf s LEU 59 Cb -0.06 -1.54 0.01 0.00 0.03 0.00 0.00 46.19 44.63 1wcf s LEU 59 CO 0.00 0.21 -0.16 -0.69 0.23 0.00 0.00 176.35 175.94 1wcf s VAL 60 N 0.06 1.60 0.02 -1.59 1.01 -0.33 -0.58 120.40 120.59 1wcf s VAL 60 Ca -0.07 -0.70 -0.30 0.00 0.00 0.00 0.00 61.98 60.91 1wcf s VAL 60 Cb -0.15 -1.45 -0.04 0.00 0.00 0.00 0.00 36.38 34.74 1wcf s VAL 60 CO 0.05 0.46 1.06 -0.76 0.00 0.00 0.00 175.10 175.91 1wcf s LEU 61 N 0.99 4.36 0.04 3.92 1.43 -0.46 -3.33 118.68 125.63 1wcf s LEU 61 Ca -0.06 1.78 -0.06 0.00 -1.03 0.00 0.00 54.13 54.76 1wcf s LEU 61 Cb -0.15 -3.57 -0.01 0.00 0.03 0.00 0.00 46.19 42.49 1wcf s LEU 61 CO -0.02 -0.35 0.10 -0.76 0.23 0.00 0.00 176.35 175.55 1wcf s LEU 62 N 1.10 1.77 0.45 1.79 1.43 -1.26 -4.25 118.68 119.70 1wcf s LEU 62 Ca 0.54 -0.52 0.25 0.00 -1.03 0.00 0.00 54.13 53.37 1wcf s LEU 62 Cb -0.24 0.63 0.68 0.00 0.03 0.00 0.00 46.19 47.29 1wcf s LEU 62 CO 0.28 -0.51 1.73 1.55 0.23 0.00 0.00 176.35 179.62 1wcf h PRO 63 N 3.64 0.00 -2.74 1.29 0.13 -2.04 -3.44 132.00 128.83 1wcf h PRO 63 Ca -0.32 0.00 -0.13 0.00 -0.87 0.00 0.00 66.00 64.68 1wcf h PRO 63 Cb 1.19 0.00 -0.25 0.00 0.13 0.00 0.00 31.00 32.06 1wcf h PRO 63 CO 0.50 0.11 -0.28 -1.14 -0.23 0.00 0.00 178.00 176.96 1wcf s GLN 64 N -3.37 0.42 0.82 0.86 0.74 -1.26 -5.16 119.66 112.70 1wcf s GLN 64 Ca 0.04 0.63 -0.10 0.00 0.05 0.00 0.00 55.36 55.98 1wcf s GLN 64 Cb 0.07 0.12 0.08 0.00 1.10 0.00 0.00 33.01 34.38 1wcf s GLN 64 CO 0.64 -0.10 1.11 -2.14 -0.55 0.00 0.00 175.29 174.25 1wcf s PRO 65 N 0.69 1.87 0.00 1.67 0.02 -1.26 -5.07 135.00 132.92 1wcf s PRO 65 Ca -0.04 1.29 0.00 0.00 0.02 0.00 0.00 61.00 62.27 1wcf s PRO 65 Cb -0.05 -1.84 0.00 0.00 0.02 0.00 0.00 34.50 32.62 1wcf s PRO 65 CO -0.05 -1.95 0.00 1.33 -0.33 0.00 0.00 177.00 176.00 1wcf n VAL 66 N -3.73 0.00 -4.41 3.83 0.24 -1.26 -5.06 118.33 107.94 1wcf n VAL 66 Ca 0.10 0.00 -0.27 0.00 -2.04 0.00 0.00 64.34 62.13 1wcf n VAL 66 Cb 0.53 -0.76 -0.12 0.00 -1.47 0.00 0.00 33.84 32.01 1wcf n VAL 66 CO 0.00 0.00 0.00 -0.36 -2.14 0.00 0.00 176.83 174.33 1wcf s PHE 67 N 2.22 2.26 0.22 6.34 0.08 -1.26 -4.67 117.98 123.17 1wcf s PHE 67 Ca 0.00 -0.37 -0.32 0.00 0.12 0.00 0.00 56.93 56.36 1wcf s PHE 67 Cb 0.00 -1.13 -0.13 0.00 -0.57 0.00 0.00 43.02 41.19 1wcf s PHE 67 CO 0.00 0.47 1.54 -2.30 -0.10 0.00 0.00 175.22 174.84 1wcf n PRO 68 N 0.32 2.32 0.00 0.24 -0.02 -1.26 -2.39 135.00 134.20 1wcf n PRO 68 Ca -0.13 0.83 0.00 0.00 -2.02 0.00 0.00 63.50 62.18 1wcf n PRO 68 Cb 0.56 -2.57 0.00 0.00 -0.02 0.00 0.00 33.50 31.46 1wcf n PRO 68 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1wcf n GLY 69 N 2.79 0.26 3.74 -1.23 0.00 0.14 -5.00 105.19 105.89 1wcf n GLY 69 Ca 0.13 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.74 1wcf n GLY 69 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1wcf s VAL 70 N -2.00 4.20 0.14 1.61 1.01 -1.01 -4.76 120.40 119.60 1wcf s VAL 70 Ca 0.00 1.97 -0.25 0.00 0.00 0.00 0.00 61.98 63.70 1wcf s VAL 70 Cb 0.00 -4.26 -0.07 0.00 0.00 0.00 0.00 36.38 32.05 1wcf s VAL 70 CO 0.00 0.37 0.77 -0.76 0.00 0.00 0.00 175.10 175.48 1wcf s LEU 71 N -0.52 4.57 -0.06 3.92 1.43 -1.26 -1.06 118.68 125.69 1wcf s LEU 71 Ca 0.45 1.60 -0.01 0.00 -1.03 0.00 0.00 54.13 55.14 1wcf s LEU 71 Cb -0.26 -3.27 0.03 0.00 0.03 0.00 0.00 46.19 42.72 1wcf s LEU 71 CO 0.32 0.17 -0.01 0.54 0.23 0.00 0.00 176.35 177.61 1wcf s VAL 72 N -0.93 0.39 0.01 -1.59 0.11 0.18 -4.97 120.40 113.60 1wcf s VAL 72 Ca 0.36 0.07 -0.30 0.00 -2.93 0.00 0.00 61.98 59.18 1wcf s VAL 72 Cb -0.22 -0.52 -0.06 0.00 -1.53 0.00 0.00 36.38 34.05 1wcf s VAL 72 CO 0.25 0.24 1.45 0.00 -3.33 0.00 0.00 175.10 173.72 1wcf s ALA 73 N 1.70 3.60 0.06 1.54 0.00 -1.26 -1.02 121.76 126.38 1wcf s ALA 73 Ca 0.01 0.94 -0.02 0.00 0.00 0.00 0.00 51.96 52.89 1wcf s ALA 73 Cb -0.13 -3.62 -0.04 0.00 0.00 0.00 0.00 23.12 19.34 1wcf s ALA 73 CO -0.04 -0.96 0.00 0.00 0.00 0.00 0.00 175.76 174.77 1wcf s ALA 74 N 2.46 0.45 0.06 0.00 0.00 0.27 -0.93 121.76 124.06 1wcf s ALA 74 Ca 0.66 -1.16 0.04 0.00 0.00 0.00 0.00 51.96 51.50 1wcf s ALA 74 Cb -0.33 0.34 -0.03 0.00 0.00 0.00 0.00 23.12 23.11 1wcf s ALA 74 CO 0.28 -0.40 -0.13 -0.98 0.00 0.00 0.00 175.76 174.53 1wcf s ARG 75 N -3.92 0.79 0.25 0.00 1.70 -0.09 -1.33 118.95 116.34 1wcf s ARG 75 Ca 0.08 -0.84 -0.21 0.00 -0.47 0.00 0.00 55.73 54.28 1wcf s ARG 75 Cb 0.08 -0.76 -0.09 0.00 -0.57 0.00 0.00 34.95 33.61 1wcf s ARG 75 CO -0.09 0.17 0.78 -1.25 -1.08 0.00 0.00 175.30 173.83 1wcf s PRO 76 N -1.49 4.34 0.00 3.89 0.04 -1.26 -1.54 135.00 138.97 1wcf s PRO 76 Ca -0.02 0.99 0.00 0.00 0.04 0.00 0.00 61.00 62.01 1wcf s PRO 76 Cb -0.09 -2.85 0.00 0.00 0.04 0.00 0.00 34.50 31.60 1wcf s PRO 76 CO 0.02 0.36 0.44 1.33 0.04 0.00 0.00 177.00 179.19 1wcf n VAL 77 N 0.67 0.15 -1.80 -0.36 0.24 0.60 -4.91 118.33 112.92 1wcf n VAL 77 Ca -0.01 -0.40 0.00 0.00 -2.04 0.00 0.00 64.34 61.89 1wcf n VAL 77 Cb 0.51 1.19 0.00 0.00 -1.47 0.00 0.00 33.84 34.07 1wcf n VAL 77 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 1wcf n GLY 78 N -0.08 -2.10 3.27 7.63 0.00 -1.19 -1.38 105.19 111.35 1wcf n GLY 78 Ca 0.00 -1.24 -0.13 0.00 0.00 0.00 0.00 46.02 44.65 1wcf n GLY 78 CO 0.00 0.00 0.00 -0.29 0.00 0.00 0.00 173.32 173.03 1wcf s MET 79 N -1.89 0.55 -0.42 1.61 1.75 -0.54 -0.81 119.30 119.56 1wcf s MET 79 Ca 0.00 0.25 -0.17 0.00 -1.25 0.00 0.00 55.69 54.52 1wcf s MET 79 Cb 0.00 0.26 0.02 0.00 2.84 0.00 0.00 34.83 37.95 1wcf s MET 79 CO 0.00 -0.11 0.43 0.12 -0.65 0.00 0.00 175.02 174.81 1wcf s PHE 80 N -0.43 3.17 -0.03 4.11 5.36 0.55 -0.58 117.98 130.14 1wcf s PHE 80 Ca -0.06 -0.37 -0.23 0.00 -0.96 0.00 0.00 56.93 55.32 1wcf s PHE 80 Cb -0.03 -2.88 -0.04 0.00 -0.34 0.00 0.00 43.02 39.72 1wcf s PHE 80 CO 0.02 -0.69 0.70 1.03 -1.46 0.00 0.00 175.22 174.82 1wcf s ARG 81 N 2.13 4.43 0.15 10.12 1.81 0.56 -0.79 118.95 137.36 1wcf s ARG 81 Ca 0.12 0.91 -0.23 0.00 -1.72 0.00 0.00 55.73 54.80 1wcf s ARG 81 Cb -0.17 -3.41 0.07 0.00 -0.45 0.00 0.00 34.95 30.99 1wcf s ARG 81 CO 0.13 0.16 0.63 0.00 -0.68 0.00 0.00 175.30 175.55 1wcf s MET 82 N 0.44 1.27 0.05 3.54 0.23 -1.25 -0.84 119.30 122.74 1wcf s MET 82 Ca 0.37 -0.48 0.08 0.00 -1.03 0.00 0.00 55.69 54.62 1wcf s MET 82 Cb -0.18 0.58 -0.03 0.00 -1.53 0.00 0.00 34.83 33.66 1wcf s MET 82 CO 0.19 -0.56 -0.23 0.54 -2.03 0.00 0.00 175.02 172.94 1wcf s VAL 83 N -3.71 1.84 0.00 5.16 0.11 -0.44 -0.85 120.40 122.51 1wcf s VAL 83 Ca 0.02 -1.29 0.00 0.00 -2.93 0.00 0.00 61.98 57.78 1wcf s VAL 83 Cb -0.01 -1.59 0.00 0.00 -1.53 0.00 0.00 36.38 33.25 1wcf s VAL 83 CO -0.12 0.25 0.00 -0.90 -3.33 0.00 0.00 175.10 171.00 1wcf n ASP 84 N 1.78 1.87 0.15 3.54 3.85 0.27 -0.57 116.55 127.44 1wcf n ASP 84 Ca -0.17 -0.16 0.11 0.00 -0.71 0.00 0.00 54.79 53.86 1wcf n ASP 84 Cb 0.53 0.00 0.56 0.00 -1.35 0.00 0.00 41.12 40.86 1wcf n ASP 84 CO 0.00 0.00 0.00 -1.84 -1.01 0.00 0.00 177.20 174.35 1wcf n GLU 85 N -0.01 0.16 -0.12 0.11 0.00 -1.20 -1.85 120.64 117.74 1wcf n GLU 85 Ca 0.00 0.57 0.06 0.00 0.00 0.00 0.00 57.16 57.79 1wcf n GLU 85 Cb 0.00 -1.94 0.12 0.00 0.00 0.00 0.00 31.44 29.63 1wcf n GLU 85 CO 0.00 0.00 0.00 0.72 0.00 0.00 0.00 177.13 177.85 1wcf n HIS 86 N -2.27 0.32 0.00 -1.84 8.25 -1.26 -5.07 115.22 113.35 1wcf n HIS 86 Ca -0.00 -0.33 0.00 0.00 -0.26 0.00 0.00 57.72 57.13 1wcf n HIS 86 Cb 0.10 -0.02 0.00 0.00 1.12 0.00 0.00 29.99 31.20 1wcf n HIS 86 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1wcf n GLY 87 N 0.61 -0.49 3.71 -1.41 0.00 -0.77 -5.02 105.19 101.82 1wcf n GLY 87 Ca 0.10 -2.01 -0.42 0.00 0.00 0.00 0.00 46.02 43.69 1wcf n GLY 87 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1wcf n GLY 88 N 0.00 0.65 2.65 -0.02 0.00 -1.26 -0.56 105.19 106.65 1wcf n GLY 88 Ca 0.00 0.26 -0.10 0.00 0.00 0.00 0.00 46.02 46.17 1wcf n GLY 88 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 1wcf n ASP 89 N 0.45 -2.00 -4.79 1.61 2.03 -0.03 -4.82 116.55 108.99 1wcf n ASP 89 Ca 0.05 -3.50 -0.32 0.00 0.52 0.00 0.00 54.79 51.54 1wcf n ASP 89 Cb 0.38 1.51 0.04 0.00 -0.72 0.00 0.00 41.12 42.33 1wcf n ASP 89 CO 0.00 0.00 0.00 -1.81 -1.92 0.00 0.00 177.20 173.47 1wcf s ASP 90 N -1.50 5.32 -0.08 1.67 1.01 -1.25 -4.55 116.67 117.28 1wcf s ASP 90 Ca 0.27 1.81 0.01 0.00 0.71 0.00 0.00 52.55 55.35 1wcf s ASP 90 Cb 0.28 -2.53 0.02 0.00 1.01 0.00 0.00 42.92 41.70 1wcf s ASP 90 CO -0.10 -1.49 -0.11 -0.54 0.21 0.00 0.00 175.17 173.15 1wcf s LYS 91 N -4.47 1.65 -0.04 8.23 3.01 0.03 -4.00 119.74 124.14 1wcf s LYS 91 Ca 0.62 -0.36 -0.29 0.00 -1.01 0.00 0.00 55.97 54.93 1wcf s LYS 91 Cb -0.17 -1.46 -0.03 0.00 -1.01 0.00 0.00 37.83 35.17 1wcf s LYS 91 CO 0.46 -0.07 0.93 0.08 0.51 0.00 0.00 175.35 177.26 1wcf s VAL 92 N 0.98 4.88 -0.13 3.17 1.01 -0.15 -0.33 120.40 129.84 1wcf s VAL 92 Ca -0.08 1.93 -0.16 0.00 0.00 0.00 0.00 61.98 63.66 1wcf s VAL 92 Cb -0.15 -4.26 -0.04 0.00 0.00 0.00 0.00 36.38 31.93 1wcf s VAL 92 CO -0.00 0.14 0.39 -0.22 0.00 0.00 0.00 175.10 175.41 1wcf s LEU 93 N 1.25 4.27 0.11 3.92 2.96 0.01 -0.42 118.68 130.77 1wcf s LEU 93 Ca 0.48 0.68 0.01 0.00 -0.22 0.00 0.00 54.13 55.09 1wcf s LEU 93 Cb -0.20 -2.55 -0.04 0.00 0.50 0.00 0.00 46.19 43.90 1wcf s LEU 93 CO 0.23 0.05 -0.05 0.00 -1.32 0.00 0.00 176.35 175.27 1wcf s VAL 95 N -3.66 1.37 0.24 0.00 -7.23 -0.59 -1.35 120.40 109.18 1wcf s VAL 95 Ca 0.14 -2.05 -0.31 0.00 -1.81 0.00 0.00 61.98 57.94 1wcf s VAL 95 Cb 0.06 -1.86 -0.12 0.00 0.56 0.00 0.00 36.38 35.02 1wcf s VAL 95 CO -0.04 -0.65 1.62 -2.65 -0.31 0.00 0.00 175.10 173.07 1wcf n PRO 96 N -0.14 2.58 -2.78 4.82 -0.02 -1.26 -0.92 135.00 137.29 1wcf n PRO 96 Ca -0.10 0.92 -0.36 0.00 -2.02 0.00 0.00 63.50 61.94 1wcf n PRO 96 Cb 0.60 -2.71 -0.06 0.00 -0.02 0.00 0.00 33.50 31.30 1wcf n PRO 96 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1wcf s ALA 97 N 0.52 3.18 -0.24 3.55 0.00 -0.11 -3.93 121.76 124.72 1wcf s ALA 97 Ca 0.70 0.51 0.00 0.00 0.00 0.00 0.00 51.96 53.18 1wcf s ALA 97 Cb -0.54 -3.18 0.00 0.00 0.00 0.00 0.00 23.12 19.40 1wcf s ALA 97 CO 0.42 0.15 0.00 0.41 0.00 0.00 0.00 175.76 176.74 1wcf n GLY 98 N 0.39 0.53 3.14 0.00 0.00 -1.26 -4.84 105.19 103.15 1wcf n GLY 98 Ca 0.03 -0.27 -0.34 0.00 0.00 0.00 0.00 46.02 45.44 1wcf n GLY 98 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1wcf s ASP 99 N -2.33 4.68 0.30 1.61 -1.08 -1.25 -4.99 116.67 113.60 1wcf s ASP 99 Ca 0.00 -1.26 0.23 0.00 -0.52 0.00 0.00 52.55 51.00 1wcf s ASP 99 Cb 0.00 -1.65 1.10 0.00 -1.46 0.00 0.00 42.92 40.90 1wcf s ASP 99 CO 0.00 -0.22 1.70 -0.81 0.52 0.00 0.00 175.17 176.36 1wcf n PRO 100 N 4.57 0.17 0.13 4.34 -0.04 -1.26 -1.53 135.00 141.38 1wcf n PRO 100 Ca -0.14 0.53 0.11 0.00 -0.04 0.00 0.00 63.50 63.97 1wcf n PRO 100 Cb 0.43 -1.93 0.50 0.00 -0.04 0.00 0.00 33.50 32.46 1wcf n PRO 100 CO 0.00 0.00 0.00 0.54 -0.04 0.00 0.00 175.50 176.00 1wcf n ARG 101 N -2.27 0.16 -0.16 0.54 1.74 -1.26 -2.03 116.66 113.39 1wcf n ARG 101 Ca 0.00 0.48 0.06 0.00 -0.77 0.00 0.00 57.85 57.62 1wcf n ARG 101 Cb 0.14 -1.87 0.15 0.00 -1.02 0.00 0.00 32.46 29.85 1wcf n ARG 101 CO 0.00 0.00 0.00 0.91 -1.52 0.00 0.00 177.63 177.02 1wcf n TRP 102 N -2.19 0.41 0.30 -1.55 7.02 -0.58 -4.63 117.44 116.21 1wcf n TRP 102 Ca 0.01 -0.39 0.19 0.00 -1.02 0.00 0.00 57.50 56.29 1wcf n TRP 102 Cb 0.17 -0.02 0.88 0.00 -2.42 0.00 0.00 31.31 29.92 1wcf n TRP 102 CO 0.00 0.00 0.00 -0.44 -2.02 0.00 0.00 177.69 175.23 1wcf h ASP 103 N 2.33 0.00 0.84 -0.99 3.32 -1.52 -0.48 116.42 119.93 1wcf h ASP 103 Ca 0.00 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.05 1wcf h ASP 103 Cb 0.71 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.26 1wcf h ASP 103 CO 0.00 0.02 0.00 0.00 -1.72 0.00 0.00 179.24 177.54 1wcf n HIS 104 N -3.15 0.76 -3.56 4.55 1.44 -1.26 -4.45 115.22 109.56 1wcf n HIS 104 Ca -0.01 0.28 -0.41 0.00 -2.01 0.00 0.00 57.72 55.58 1wcf n HIS 104 Cb 0.22 -0.96 -0.09 0.00 0.12 0.00 0.00 29.99 29.28 1wcf n HIS 104 CO 0.00 0.00 0.00 0.08 -2.81 0.00 0.00 176.34 173.61 1wcf s VAL 105 N -3.26 4.28 -0.04 0.61 1.01 -0.19 -4.87 120.40 117.95 1wcf s VAL 105 Ca 0.06 -1.63 0.05 0.00 0.00 0.00 0.00 61.98 60.45 1wcf s VAL 105 Cb 0.10 -3.75 -0.07 0.00 0.00 0.00 0.00 36.38 32.67 1wcf s VAL 105 CO 0.42 -0.69 0.04 0.00 0.00 0.00 0.00 175.10 174.87 1wcf n GLN 106 N 4.93 2.47 -4.04 2.72 1.13 -1.26 -4.99 117.38 118.34 1wcf n GLN 106 Ca -0.09 -0.01 -0.13 0.00 -1.94 0.00 0.00 57.00 54.83 1wcf n GLN 106 Cb 0.41 -1.12 -0.04 0.00 0.11 0.00 0.00 30.24 29.60 1wcf n GLN 106 CO 0.00 0.00 0.00 0.34 -1.44 0.00 0.00 177.06 175.96 1wcf s ASP 107 N -3.36 0.59 0.46 1.08 -1.08 -1.26 -4.69 116.67 108.41 1wcf s ASP 107 Ca -0.02 -1.33 0.20 0.00 -0.52 0.00 0.00 52.55 50.87 1wcf s ASP 107 Cb 0.02 0.66 1.10 0.00 -1.46 0.00 0.00 42.92 43.25 1wcf s ASP 107 CO 0.20 -1.30 1.97 -0.29 0.52 0.00 0.00 175.17 176.27 1wcf h ILE 108 N 2.14 0.90 0.00 4.11 6.09 -1.54 -0.70 117.51 128.51 1wcf h ILE 108 Ca -0.28 -0.80 0.00 0.00 -1.37 0.00 0.00 64.86 62.41 1wcf h ILE 108 Cb 1.24 1.46 0.00 0.00 0.47 0.00 0.00 36.82 40.00 1wcf h ILE 108 CO 0.39 0.21 0.00 0.61 -3.07 0.00 0.00 178.15 176.28 1wcf n GLY 109 N -0.65 -1.12 0.21 8.18 0.00 -1.26 -2.66 105.19 107.88 1wcf n GLY 109 Ca -0.02 -0.03 0.14 0.00 0.00 0.00 0.00 46.02 46.11 1wcf n GLY 109 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1wcf n ASP 110 N -1.67 0.78 -4.66 1.61 8.00 -0.27 -4.78 116.55 115.56 1wcf n ASP 110 Ca 0.04 -0.88 -0.35 0.00 0.71 0.00 0.00 54.79 54.31 1wcf n ASP 110 Cb 0.20 0.00 -0.09 0.00 -0.02 0.00 0.00 41.12 41.22 1wcf n ASP 110 CO 0.00 0.00 0.00 -0.69 -0.39 0.00 0.00 177.20 176.12 1wcf s VAL 111 N -2.34 5.00 0.44 2.53 1.01 -1.09 -4.84 120.40 121.12 1wcf s VAL 111 Ca 0.31 0.04 -0.26 0.00 0.00 0.00 0.00 61.98 62.08 1wcf s VAL 111 Cb 0.20 -3.27 -0.09 0.00 0.00 0.00 0.00 36.38 33.23 1wcf s VAL 111 CO 0.45 0.45 1.45 -2.84 0.00 0.00 0.00 175.10 174.60 1wcf s PRO 112 N 0.41 3.72 0.40 2.72 0.02 -1.26 -4.82 135.00 136.19 1wcf s PRO 112 Ca 0.05 2.46 0.09 0.00 0.02 0.00 0.00 61.00 63.62 1wcf s PRO 112 Cb -0.12 -2.69 0.88 0.00 0.02 0.00 0.00 34.50 32.59 1wcf s PRO 112 CO -0.00 -0.81 1.99 0.00 -0.33 0.00 0.00 177.00 177.85 1wcf h ALA 113 N 2.38 1.82 -0.89 -1.55 0.00 -1.95 -1.29 119.26 117.79 1wcf h ALA 113 Ca -0.51 -0.02 0.01 0.00 0.00 0.00 0.00 54.91 54.39 1wcf h ALA 113 Cb 1.26 -0.14 -0.05 0.00 0.00 0.00 0.00 17.79 18.86 1wcf h ALA 113 CO 0.61 0.08 0.59 0.74 0.00 0.00 0.00 179.25 181.27 1wcf h PHE 114 N 0.57 1.11 -0.11 0.00 -1.00 -1.99 0.19 116.94 115.72 1wcf h PHE 114 Ca 0.26 0.03 -0.10 0.00 2.81 0.00 0.00 57.97 60.96 1wcf h PHE 114 Cb 0.29 -0.38 0.00 0.00 3.61 0.00 0.00 35.95 39.48 1wcf h PHE 114 CO -0.00 0.69 -0.33 0.93 -1.61 0.00 0.00 178.31 177.99 1wcf h GLU 115 N 1.19 0.41 -0.71 1.51 5.08 -1.62 -2.06 114.58 118.39 1wcf h GLU 115 Ca 0.33 -0.30 -0.05 0.00 -1.00 0.00 0.00 59.36 58.34 1wcf h GLU 115 Cb -0.11 0.05 -0.03 0.00 0.50 0.00 0.00 28.75 29.15 1wcf h GLU 115 CO -0.08 0.92 0.26 -0.07 -1.00 0.00 0.00 179.01 179.05 1wcf h LEU 116 N -0.02 0.98 -0.65 1.33 3.38 -1.12 -1.59 115.31 117.62 1wcf h LEU 116 Ca -0.01 -0.15 -0.13 0.00 0.09 0.00 0.00 57.88 57.68 1wcf h LEU 116 Cb 0.95 -0.26 -0.01 0.00 0.09 0.00 0.00 40.66 41.43 1wcf h LEU 116 CO 0.07 0.89 -0.30 0.44 0.09 0.00 0.00 178.44 179.63 1wcf h ASP 117 N 1.04 0.75 -0.56 -0.43 3.32 -0.65 -1.22 116.42 118.67 1wcf h ASP 117 Ca 0.24 -0.30 -0.11 0.00 0.02 0.00 0.00 57.03 56.88 1wcf h ASP 117 Cb 0.23 -0.21 -0.02 0.00 0.22 0.00 0.00 39.33 39.55 1wcf h ASP 117 CO -0.02 1.00 -0.09 0.00 -1.72 0.00 0.00 179.24 178.41 1wcf h ALA 118 N 1.05 0.77 -0.22 3.45 0.00 -1.00 -1.04 119.26 122.26 1wcf h ALA 118 Ca 0.07 -0.35 0.02 0.00 0.00 0.00 0.00 54.91 54.65 1wcf h ALA 118 Cb 0.82 -0.20 -0.02 0.00 0.00 0.00 0.00 17.79 18.39 1wcf h ALA 118 CO 0.07 0.67 0.10 0.82 0.00 0.00 0.00 179.25 180.92 1wcf h ILE 119 N 0.93 0.99 -0.70 0.00 2.04 -1.10 -1.58 117.51 118.09 1wcf h ILE 119 Ca 0.15 -0.08 0.02 0.00 1.00 0.00 0.00 64.86 65.95 1wcf h ILE 119 Cb 0.67 0.74 -0.04 0.00 -0.74 0.00 0.00 36.82 37.45 1wcf h ILE 119 CO 0.05 0.04 0.45 0.50 0.00 0.00 0.00 178.15 179.19 1wcf h LYS 120 N 0.23 0.88 -1.00 2.37 3.64 -1.10 -2.39 116.57 119.20 1wcf h LYS 120 Ca 0.09 -0.05 0.02 0.00 -1.27 0.00 0.00 60.65 59.44 1wcf h LYS 120 Cb 0.03 -0.20 -0.05 0.00 -0.41 0.00 0.00 32.23 31.60 1wcf h LYS 120 CO -0.07 0.58 0.66 1.25 -2.27 0.00 0.00 179.45 179.60 1wcf h HIS 121 N 0.91 1.24 0.16 1.91 2.76 -0.91 -0.48 115.15 120.74 1wcf h HIS 121 Ca 0.27 0.03 -0.00 0.00 -2.20 0.00 0.00 60.37 58.46 1wcf h HIS 121 Cb -0.05 -0.42 -0.00 0.00 1.55 0.00 0.00 27.41 28.48 1wcf h HIS 121 CO -0.03 0.76 -0.10 0.35 -1.30 0.00 0.00 177.93 177.61 1wcf h PHE 122 N 1.32 -0.26 -0.05 5.26 3.57 -0.79 -1.83 116.94 124.16 1wcf h PHE 122 Ca 0.38 -0.00 -0.14 0.00 3.53 0.00 0.00 57.97 61.74 1wcf h PHE 122 Cb -0.10 0.09 -0.01 0.00 2.79 0.00 0.00 35.95 38.72 1wcf h PHE 122 CO -0.00 -0.16 -0.59 0.74 -2.23 0.00 0.00 178.31 176.07 1wcf h PHE 123 N -0.26 0.20 -0.12 0.41 0.04 -1.13 0.66 116.94 116.75 1wcf h PHE 123 Ca -0.01 -0.08 -0.08 0.00 2.80 0.00 0.00 57.97 60.60 1wcf h PHE 123 Cb 0.22 -0.04 -0.01 0.00 2.20 0.00 0.00 35.95 38.32 1wcf h PHE 123 CO -0.09 0.71 -0.28 0.28 -0.60 0.00 0.00 178.31 178.33 1wcf h VAL 124 N 0.12 1.25 0.00 -0.55 2.07 -0.99 -3.36 116.25 114.79 1wcf h VAL 124 Ca -0.00 -1.16 0.00 0.00 0.82 0.00 0.00 66.70 66.36 1wcf h VAL 124 Cb 1.07 1.47 0.00 0.00 -1.52 0.00 0.00 31.29 32.31 1wcf h VAL 124 CO 0.09 0.35 -1.23 1.41 0.02 0.00 0.00 177.57 178.20 1wcf n HIS 125 N -4.15 0.00 0.28 1.57 8.25 -0.70 -4.59 115.22 115.89 1wcf n HIS 125 Ca -0.01 0.00 0.14 0.00 -0.26 0.00 0.00 57.72 57.59 1wcf n HIS 125 Cb 0.37 -0.16 0.83 0.00 1.12 0.00 0.00 29.99 32.16 1wcf n HIS 125 CO 0.00 0.00 0.00 0.10 0.64 0.00 0.00 176.34 177.08 1wcf h TYR 126 N 0.00 0.00 -0.64 4.41 -0.00 -1.02 -0.24 116.97 119.48 1wcf h TYR 126 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 58.73 58.73 1wcf h TYR 126 Cb 0.35 0.00 0.00 0.00 0.00 0.00 0.00 36.73 37.08 1wcf h TYR 126 CO 0.00 0.05 0.00 1.63 -0.00 0.00 0.00 178.16 179.84 1wcf n LYS 127 N -3.78 3.67 -0.27 0.10 5.02 -1.26 -4.22 118.16 117.41 1wcf n LYS 127 Ca -0.03 -2.87 0.13 0.00 -2.02 0.00 0.00 58.31 53.53 1wcf n LYS 127 Cb 0.15 -1.87 0.40 0.00 -0.02 0.00 0.00 35.03 33.69 1wcf n LYS 127 CO 0.00 0.00 0.00 -0.44 -0.52 0.00 0.00 177.40 176.44 1wcf h ASP 128 N 4.01 0.62 -0.61 4.39 3.32 -1.32 -1.09 116.42 125.73 1wcf h ASP 128 Ca 0.00 0.05 0.00 0.00 0.02 0.00 0.00 57.03 57.10 1wcf h ASP 128 Cb 1.42 -0.07 0.00 0.00 0.22 0.00 0.00 39.33 40.90 1wcf h ASP 128 CO 0.22 0.29 0.00 0.18 -1.72 0.00 0.00 179.24 178.21 1wcf n LEU 129 N -4.58 3.48 -4.52 1.55 4.77 -1.26 -4.81 117.00 111.62 1wcf n LEU 129 Ca 0.18 -1.70 -0.41 0.00 -0.03 0.00 0.00 56.01 54.06 1wcf n LEU 129 Cb 0.53 -0.41 -0.10 0.00 -2.33 0.00 0.00 43.42 41.11 1wcf n LEU 129 CO 0.29 0.85 -0.10 -1.61 -1.33 0.00 0.00 177.39 175.48 1wcf s GLU 130 N -1.19 3.45 0.27 3.23 2.02 -0.41 -5.00 118.70 121.06 1wcf s GLU 130 Ca 0.43 -0.66 -0.31 0.00 0.02 0.00 0.00 54.97 54.46 1wcf s GLU 130 Cb 0.23 -3.82 -0.12 0.00 0.10 0.00 0.00 34.13 30.51 1wcf s GLU 130 CO 0.30 -0.48 1.54 -2.30 0.02 0.00 0.00 175.26 174.34 1wcf n PRO 131 N 5.14 2.47 -0.80 0.39 -0.02 -1.26 -2.51 135.00 138.40 1wcf n PRO 131 Ca -0.12 0.88 0.00 0.00 -2.02 0.00 0.00 63.50 62.24 1wcf n PRO 131 Cb 0.49 -2.62 0.00 0.00 -0.02 0.00 0.00 33.50 31.35 1wcf n PRO 131 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1wcf n GLY 132 N 2.30 1.16 3.46 -1.23 0.00 -1.26 -5.01 105.19 104.62 1wcf n GLY 132 Ca 0.10 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.82 1wcf n GLY 132 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1wcf s LYS 133 N -0.09 2.07 0.21 1.61 1.02 -1.04 -4.81 119.74 118.70 1wcf s LYS 133 Ca 0.00 -0.98 -0.23 0.00 0.02 0.00 0.00 55.97 54.78 1wcf s LYS 133 Cb 0.00 -2.19 0.05 0.00 -0.52 0.00 0.00 37.83 35.17 1wcf s LYS 133 CO 0.00 0.54 0.90 -0.59 -0.92 0.00 0.00 175.35 175.28 1wcf s PHE 134 N -0.94 -0.09 -0.03 3.18 -0.12 -1.26 -4.77 117.98 113.94 1wcf s PHE 134 Ca 0.15 -0.30 0.01 0.00 -0.05 0.00 0.00 56.93 56.74 1wcf s PHE 134 Cb -0.11 0.68 0.02 0.00 -0.63 0.00 0.00 43.02 42.99 1wcf s PHE 134 CO 0.06 -1.01 -0.03 0.08 -0.05 0.00 0.00 175.22 174.27 1wcf s VAL 135 N -3.20 0.39 0.32 -2.49 1.01 -1.26 -3.21 120.40 111.96 1wcf s VAL 135 Ca 0.13 -0.06 0.05 0.00 0.00 0.00 0.00 61.98 62.11 1wcf s VAL 135 Cb -0.03 -0.44 -0.03 0.00 0.00 0.00 0.00 36.38 35.89 1wcf s VAL 135 CO 0.05 0.19 0.29 -0.54 0.00 0.00 0.00 175.10 175.08 1wcf s LYS 136 N 0.85 1.72 -1.33 2.72 1.02 0.27 -4.82 119.74 120.17 1wcf s LYS 136 Ca -0.10 -1.95 -0.12 0.00 0.02 0.00 0.00 55.97 53.82 1wcf s LYS 136 Cb -0.13 0.33 0.01 0.00 -0.52 0.00 0.00 37.83 37.52 1wcf s LYS 136 CO -0.00 -0.64 0.48 0.00 -0.92 0.00 0.00 175.35 174.27 1wcf n ALA 137 N -0.58 -2.26 -3.12 5.17 0.00 -1.26 -1.32 120.51 117.14 1wcf n ALA 137 Ca 0.06 -0.35 -0.35 0.00 0.00 0.00 0.00 53.44 52.80 1wcf n ALA 137 Cb 0.63 -2.21 -0.13 0.00 0.00 0.00 0.00 19.45 17.74 1wcf n ALA 137 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1wcf s ALA 138 N -3.84 3.00 0.17 0.00 0.00 -1.25 -3.85 121.76 115.99 1wcf s ALA 138 Ca 0.21 -0.99 -0.24 0.00 0.00 0.00 0.00 51.96 50.95 1wcf s ALA 138 Cb -0.09 -1.74 0.06 0.00 0.00 0.00 0.00 23.12 21.35 1wcf s ALA 138 CO 0.92 -0.13 0.73 -0.51 0.00 0.00 0.00 175.76 176.77 1wcf s ASP 139 N 0.97 -0.39 -0.11 0.00 1.11 -0.02 -4.99 116.67 113.25 1wcf s ASP 139 Ca 0.01 -0.24 -0.09 0.00 0.18 0.00 0.00 52.55 52.41 1wcf s ASP 139 Cb -0.14 0.59 -0.04 0.00 1.07 0.00 0.00 42.92 44.39 1wcf s ASP 139 CO 0.02 -1.02 0.21 0.26 1.18 0.00 0.00 175.17 175.82 1wcf s TRP 140 N -3.63 3.60 0.31 4.23 0.52 -1.26 -0.32 118.94 122.38 1wcf s TRP 140 Ca 0.06 0.61 0.05 0.00 0.02 0.00 0.00 56.10 56.85 1wcf s TRP 140 Cb -0.03 -2.06 -0.06 0.00 -1.15 0.00 0.00 33.47 30.17 1wcf s TRP 140 CO -0.04 0.64 -0.00 0.14 0.02 0.00 0.00 176.95 177.71 1wcf s VAL 141 N -0.79 1.48 0.82 4.03 -7.23 0.25 -4.97 120.40 113.99 1wcf s VAL 141 Ca 0.16 -2.05 -0.10 0.00 -1.81 0.00 0.00 61.98 58.18 1wcf s VAL 141 Cb -0.13 -2.66 0.13 0.00 0.56 0.00 0.00 36.38 34.29 1wcf s VAL 141 CO 0.05 -0.14 1.16 1.51 -0.31 0.00 0.00 175.10 177.37 1wcf s ASP 142 N -3.49 4.02 0.23 4.85 1.47 -1.26 -1.46 116.67 121.03 1wcf s ASP 142 Ca 0.33 0.29 -0.07 0.00 1.18 0.00 0.00 52.55 54.28 1wcf s ASP 142 Cb 0.07 -0.63 0.27 0.00 -0.34 0.00 0.00 42.92 42.28 1wcf s ASP 142 CO 0.14 -2.14 1.87 -0.09 0.68 0.00 0.00 175.17 175.63 1wcf h ARG 143 N -1.07 1.00 -0.90 2.11 2.43 -1.89 -1.16 114.38 114.91 1wcf h ARG 143 Ca -0.43 -0.06 0.00 0.00 -0.81 0.00 0.00 59.98 58.68 1wcf h ARG 143 Cb 1.28 -0.23 -0.04 0.00 -0.42 0.00 0.00 29.97 30.56 1wcf h ARG 143 CO 0.49 0.66 0.56 0.00 -1.51 0.00 0.00 179.97 180.17 1wcf h ALA 144 N 1.36 1.30 -0.38 2.80 0.00 -1.93 0.11 119.26 122.52 1wcf h ALA 144 Ca 0.34 -0.09 -0.14 0.00 0.00 0.00 0.00 54.91 55.03 1wcf h ALA 144 Cb 0.04 -0.36 -0.01 0.00 0.00 0.00 0.00 17.79 17.46 1wcf h ALA 144 CO -0.13 0.62 -0.31 1.49 0.00 0.00 0.00 179.25 180.92 1wcf h GLU 145 N 1.23 0.88 -0.61 0.00 4.81 -1.83 -2.05 114.58 117.01 1wcf h GLU 145 Ca 0.32 -0.44 0.02 0.00 -0.13 0.00 0.00 59.36 59.13 1wcf h GLU 145 Cb -0.09 0.00 -0.04 0.00 0.63 0.00 0.00 28.75 29.26 1wcf h GLU 145 CO -0.06 1.09 0.38 0.00 -0.73 0.00 0.00 179.01 179.69 1wcf h ALA 146 N 0.78 0.78 -0.66 2.92 0.00 -0.65 -1.74 119.26 120.68 1wcf h ALA 146 Ca 0.07 -0.03 -0.05 0.00 0.00 0.00 0.00 54.91 54.90 1wcf h ALA 146 Cb 0.90 -0.21 -0.03 0.00 0.00 0.00 0.00 17.79 18.45 1wcf h ALA 146 CO 0.08 0.15 0.21 0.93 0.00 0.00 0.00 179.25 180.62 1wcf h GLU 147 N 0.77 1.00 -0.77 0.00 5.08 -0.69 0.15 114.58 120.12 1wcf h GLU 147 Ca 0.23 -0.20 -0.03 0.00 -1.00 0.00 0.00 59.36 58.36 1wcf h GLU 147 Cb -0.03 -0.15 -0.04 0.00 0.50 0.00 0.00 28.75 29.03 1wcf h GLU 147 CO -0.08 0.86 0.35 0.00 -1.00 0.00 0.00 179.01 179.14 1wcf h ALA 148 N 1.26 1.16 -0.47 3.43 0.00 -0.96 0.51 119.26 124.18 1wcf h ALA 148 Ca 0.22 -0.17 -0.12 0.00 0.00 0.00 0.00 54.91 54.84 1wcf h ALA 148 Cb 0.27 -0.31 -0.01 0.00 0.00 0.00 0.00 17.79 17.74 1wcf h ALA 148 CO -0.01 0.63 -0.19 0.93 0.00 0.00 0.00 179.25 180.61 1wcf h GLU 149 N 1.11 0.94 -0.23 0.00 4.39 -0.74 -1.66 114.58 118.39 1wcf h GLU 149 Ca 0.26 -0.38 -0.01 0.00 0.34 0.00 0.00 59.36 59.57 1wcf h GLU 149 Cb 0.14 -0.04 -0.01 0.00 -0.10 0.00 0.00 28.75 28.74 1wcf h GLU 149 CO -0.03 1.04 0.09 0.28 -1.16 0.00 0.00 179.01 179.23 1wcf h VAL 150 N 0.82 1.16 -0.53 3.13 2.07 -0.63 -2.59 116.25 119.68 1wcf h VAL 150 Ca 0.11 -0.50 0.03 0.00 0.82 0.00 0.00 66.70 67.17 1wcf h VAL 150 Cb 0.75 1.07 -0.04 0.00 -1.52 0.00 0.00 31.29 31.55 1wcf h VAL 150 CO 0.06 0.16 0.31 -0.61 0.02 0.00 0.00 177.57 177.51 1wcf h GLN 151 N 0.22 0.59 -0.18 1.57 5.75 -0.74 -0.32 115.11 122.00 1wcf h GLN 151 Ca 0.08 -0.04 -0.05 0.00 -0.15 0.00 0.00 58.65 58.49 1wcf h GLN 151 Cb 0.17 -0.13 -0.01 0.00 1.07 0.00 0.00 27.48 28.58 1wcf h GLN 151 CO -0.01 0.39 -0.09 0.07 -2.65 0.00 0.00 178.83 176.54 1wcf h ARG 152 N 0.61 0.28 -0.00 1.69 0.11 -1.26 -1.20 114.38 114.60 1wcf h ARG 152 Ca 0.22 -0.06 -0.16 0.00 0.10 0.00 0.00 59.98 60.08 1wcf h ARG 152 Cb 0.05 -0.04 -0.02 0.00 1.11 0.00 0.00 29.97 31.07 1wcf h ARG 152 CO -0.11 0.39 -0.76 0.66 0.10 0.00 0.00 179.97 180.25 1wcf h SER 153 N 0.27 0.06 -0.44 0.08 4.64 -0.88 -1.31 113.55 115.97 1wcf h SER 153 Ca 0.06 -0.05 -0.07 0.00 -0.47 0.00 0.00 61.79 61.26 1wcf h SER 153 Cb 0.34 -0.02 -0.02 0.00 -0.31 0.00 0.00 62.40 62.39 1wcf h SER 153 CO 0.02 0.80 -0.00 0.58 -0.87 0.00 0.00 176.83 177.35 1wcf h VAL 154 N 0.03 1.26 -0.69 0.95 2.07 -0.68 -0.48 116.25 118.70 1wcf h VAL 154 Ca -0.01 -1.04 -0.00 0.00 0.82 0.00 0.00 66.70 66.46 1wcf h VAL 154 Cb 1.34 1.07 -0.03 0.00 -1.52 0.00 0.00 31.29 32.15 1wcf h VAL 154 CO 0.10 0.36 0.42 -0.33 0.02 0.00 0.00 177.57 178.14 1wcf h GLU 155 N 0.61 0.94 -0.57 1.57 5.08 -1.07 -1.29 114.58 119.86 1wcf h GLU 155 Ca 0.12 -0.09 -0.03 0.00 -1.00 0.00 0.00 59.36 58.37 1wcf h GLU 155 Cb 0.49 -0.20 -0.03 0.00 0.50 0.00 0.00 28.75 29.52 1wcf h GLU 155 CO 0.02 0.67 0.23 -0.09 -1.00 0.00 0.00 179.01 178.85 1wcf h ARG 156 N 0.94 0.84 -0.38 2.33 9.65 -1.16 -0.69 114.38 125.92 1wcf h ARG 156 Ca 0.25 -0.15 0.03 0.00 -1.10 0.00 0.00 59.98 59.01 1wcf h ARG 156 Cb -0.03 -0.14 -0.03 0.00 -1.39 0.00 0.00 29.97 28.38 1wcf h ARG 156 CO -0.05 0.72 0.20 0.35 2.80 0.00 0.00 179.97 183.99 1wcf h PHE 157 N 0.77 0.36 -0.23 2.20 3.57 -0.84 -2.34 116.94 120.43 1wcf h PHE 157 Ca 0.19 0.01 -0.09 0.00 3.53 0.00 0.00 57.97 61.62 1wcf h PHE 157 Cb 0.19 -0.11 -0.01 0.00 2.79 0.00 0.00 35.95 38.81 1wcf h PHE 157 CO 0.01 0.20 -0.24 0.87 -2.23 0.00 0.00 178.31 176.92 1wcf h LYS 158 N 0.40 0.43 0.00 1.11 1.57 -0.98 -2.40 116.57 116.69 1wcf h LYS 158 Ca 0.16 -0.15 -0.04 0.00 -1.87 0.00 0.00 60.65 58.75 1wcf h LYS 158 Cb 0.05 -0.03 -0.01 0.00 0.08 0.00 0.00 32.23 32.33 1wcf h LYS 158 CO -0.10 0.64 -0.17 0.00 -0.57 0.00 0.00 179.45 179.25 1wcf h ALA 159 N 1.37 1.25 -0.00 3.86 0.00 -0.78 -2.87 119.26 122.09 1wcf h ALA 159 Ca 0.06 -0.16 0.00 0.00 0.00 0.00 0.00 54.91 54.81 1wcf h ALA 159 Cb 0.63 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.39 1wcf h ALA 159 CO 0.04 0.22 -0.21 0.41 0.00 0.00 0.00 179.25 179.71 1wcf n GLY 160 N -0.49 -1.35 0.58 0.00 0.00 -0.91 -5.10 105.19 97.92 1wcf n GLY 160 Ca -0.01 -0.22 0.14 0.00 0.00 0.00 0.00 46.02 45.92 1wcf n GLY 160 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02