#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1o1y s HIS -1 N 0.00 2.61 0.27 4.41 3.76 -1.26 -5.00 115.29 120.08 1o1y s HIS -1 Ca 0.00 1.55 -0.30 0.00 -0.15 0.00 0.00 55.06 56.16 1o1y s HIS -1 Cb 0.00 -3.25 -0.14 0.00 1.11 0.00 0.00 32.58 30.31 1o1y s HIS -1 CO 0.00 -1.70 1.27 1.58 -0.85 0.00 0.00 174.74 175.03 1o1y n HIS 0 N -1.92 1.91 -2.82 1.40 -0.00 -1.26 -4.94 115.22 107.58 1o1y n HIS 0 Ca 0.11 0.55 -0.42 0.00 -0.00 0.00 0.00 57.72 57.96 1o1y n HIS 0 Cb 0.51 -2.38 -0.03 0.00 -0.00 0.00 0.00 29.99 28.09 1o1y n HIS 0 CO 0.00 0.00 0.00 0.08 -0.00 0.00 0.00 176.34 176.42 1o1y s VAL 1 N -0.55 4.85 -0.09 3.57 1.01 -1.26 -4.91 120.40 123.03 1o1y s VAL 1 Ca 0.63 1.78 0.03 0.00 0.00 0.00 0.00 61.98 64.43 1o1y s VAL 1 Cb -0.66 -4.20 -0.01 0.00 0.00 0.00 0.00 36.38 31.50 1o1y s VAL 1 CO 0.55 0.03 -0.19 -0.60 0.00 0.00 0.00 175.10 174.89 1o1y s ARG 2 N 2.04 2.88 -0.08 2.72 3.52 -1.26 -1.50 118.95 127.27 1o1y s ARG 2 Ca 0.42 -0.80 -0.00 0.00 -0.13 0.00 0.00 55.73 55.22 1o1y s ARG 2 Cb -0.17 -2.37 -0.03 0.00 -1.56 0.00 0.00 34.95 30.82 1o1y s ARG 2 CO 0.15 0.34 -0.06 0.08 -0.81 0.00 0.00 175.30 175.00 1o1y s VAL 3 N -0.03 3.80 -0.25 7.11 1.01 0.33 -0.44 120.40 131.94 1o1y s VAL 3 Ca -0.06 -0.44 -0.11 0.00 0.00 0.00 0.00 61.98 61.37 1o1y s VAL 3 Cb -0.15 -2.57 -0.05 0.00 0.00 0.00 0.00 36.38 33.61 1o1y s VAL 3 CO 0.05 0.59 0.20 -0.22 0.00 0.00 0.00 175.10 175.72 1o1y s LEU 4 N -0.69 4.10 -0.37 3.92 2.96 -0.34 -1.18 118.68 127.07 1o1y s LEU 4 Ca 0.10 0.14 -0.02 0.00 -0.22 0.00 0.00 54.13 54.13 1o1y s LEU 4 Cb -0.11 -2.17 0.09 0.00 0.50 0.00 0.00 46.19 44.50 1o1y s LEU 4 CO 0.02 0.01 0.13 0.00 -1.32 0.00 0.00 176.35 175.20 1o1y s ALA 5 N 1.28 3.04 -0.36 5.97 0.00 0.23 0.14 121.76 132.05 1o1y s ALA 5 Ca 0.09 -2.31 -0.21 0.00 0.00 0.00 0.00 51.96 49.53 1o1y s ALA 5 Cb -0.14 -2.25 0.01 0.00 0.00 0.00 0.00 23.12 20.73 1o1y s ALA 5 CO 0.06 -1.64 0.67 0.42 0.00 0.00 0.00 175.76 175.28 1o1y s ILE 6 N 1.16 4.84 -0.12 0.00 1.01 0.17 0.05 121.20 128.31 1o1y s ILE 6 Ca 0.05 0.62 0.02 0.00 0.00 0.00 0.00 60.65 61.34 1o1y s ILE 6 Cb -0.22 -4.12 -0.00 0.00 0.01 0.00 0.00 42.46 38.13 1o1y s ILE 6 CO -0.03 -0.37 -0.20 -0.60 0.00 0.00 0.00 174.94 173.74 1o1y s ARG 7 N 2.82 3.15 -0.13 2.79 3.52 -0.55 -1.43 118.95 129.12 1o1y s ARG 7 Ca 0.26 -0.81 0.17 0.00 -0.13 0.00 0.00 55.73 55.22 1o1y s ARG 7 Cb -0.14 -2.43 -0.24 0.00 -1.56 0.00 0.00 34.95 30.57 1o1y s ARG 7 CO 0.16 0.16 0.29 0.72 -0.81 0.00 0.00 175.30 175.81 1o1y n HIS 8 N 3.62 0.30 -3.92 5.12 8.25 -1.26 -3.88 115.22 123.45 1o1y n HIS 8 Ca -0.19 0.11 -0.18 0.00 -0.26 0.00 0.00 57.72 57.20 1o1y n HIS 8 Cb 0.53 -1.01 -0.16 0.00 1.12 0.00 0.00 29.99 30.46 1o1y n HIS 8 CO 0.00 0.00 0.00 0.08 0.64 0.00 0.00 176.34 177.06 1o1y s VAL 9 N -2.63 0.22 0.25 1.59 1.01 -1.26 -4.84 120.40 114.73 1o1y s VAL 9 Ca -0.08 0.09 -0.04 0.00 0.00 0.00 0.00 61.98 61.94 1o1y s VAL 9 Cb 0.07 -0.32 0.22 0.00 0.00 0.00 0.00 36.38 36.35 1o1y s VAL 9 CO 0.83 0.17 1.84 -0.08 0.00 0.00 0.00 175.10 177.86 1o1y h GLU 10 N 7.44 0.91 -0.03 2.72 4.81 -1.98 -0.72 114.58 127.73 1o1y h GLU 10 Ca -0.37 -0.05 -0.08 0.00 -0.13 0.00 0.00 59.36 58.72 1o1y h GLU 10 Cb 1.13 -0.21 -0.01 0.00 0.63 0.00 0.00 28.75 30.30 1o1y h GLU 10 CO 0.43 0.60 -0.37 0.82 -0.73 0.00 0.00 179.01 179.76 1o1y h ILE 11 N 0.94 1.28 -1.57 2.32 1.08 -1.98 -3.32 117.51 116.25 1o1y h ILE 11 Ca 0.39 -1.31 -0.76 0.00 -0.39 0.00 0.00 64.86 62.79 1o1y h ILE 11 Cb 0.24 1.67 -0.16 0.00 -3.07 0.00 0.00 36.82 35.50 1o1y h ILE 11 CO -0.20 0.38 1.87 -0.62 -0.69 0.00 0.00 178.15 178.89 1o1y n GLU 12 N -4.09 3.63 0.00 2.37 1.02 -0.28 -4.91 120.64 118.39 1o1y n GLU 12 Ca -0.02 -3.63 0.00 0.00 -0.02 0.00 0.00 57.16 53.50 1o1y n GLU 12 Cb 0.42 -2.92 0.00 0.00 -0.02 0.00 0.00 31.44 28.92 1o1y n GLU 12 CO 0.00 0.00 0.00 -0.40 1.18 0.00 0.00 177.13 177.91 1o1y n ASP 13 N 3.97 0.37 0.12 1.62 5.68 -1.25 -4.60 116.55 122.46 1o1y n ASP 13 Ca 0.39 0.00 0.11 0.00 -0.50 0.00 0.00 54.79 54.79 1o1y n ASP 13 Cb 0.37 0.00 0.47 0.00 -1.14 0.00 0.00 41.12 40.82 1o1y n ASP 13 CO 0.00 0.00 0.00 0.18 -1.33 0.00 0.00 177.20 176.05 1o1y n LEU 14 N 0.00 0.58 0.00 -2.12 4.77 -1.26 -4.99 117.00 113.98 1o1y n LEU 14 Ca 0.00 0.65 0.00 0.00 -0.03 0.00 0.00 56.01 56.63 1o1y n LEU 14 Cb 0.00 -0.58 0.00 0.00 -2.33 0.00 0.00 43.42 40.51 1o1y n LEU 14 CO 0.00 -0.55 0.00 0.61 -1.33 0.00 0.00 177.39 176.12 1o1y n GLY 15 N -0.10 0.00 0.87 -0.72 0.00 -1.26 -4.93 105.19 99.05 1o1y n GLY 15 Ca 0.02 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.04 1o1y n GLY 15 CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11 1o1y n GLU 18 N -1.67 0.00 -0.17 1.61 2.13 -1.26 -4.90 120.64 116.38 1o1y n GLU 18 Ca 0.00 0.00 -0.07 0.00 0.66 0.00 0.00 57.16 57.75 1o1y n GLU 18 Cb 0.00 0.00 0.02 0.00 0.27 0.00 0.00 31.44 31.73 1o1y n GLU 18 CO 0.00 0.00 0.00 -0.44 -0.41 0.00 0.00 177.13 176.28 1o1y h ASP 19 N 0.00 0.58 -0.46 4.31 3.32 -1.99 -0.08 116.42 122.10 1o1y h ASP 19 Ca 0.00 -0.03 -0.03 0.00 0.02 0.00 0.00 57.03 56.99 1o1y h ASP 19 Cb 0.00 -0.15 -0.02 0.00 0.22 0.00 0.00 39.33 39.38 1o1y h ASP 19 CO 0.00 0.44 0.15 0.40 -1.72 0.00 0.00 179.24 178.51 1o1y h ILE 20 N 0.68 1.22 -0.64 0.35 2.04 -1.98 -0.05 117.51 119.13 1o1y h ILE 20 Ca 0.18 -0.72 -0.04 0.00 1.00 0.00 0.00 64.86 65.28 1o1y h ILE 20 Cb -0.06 0.83 -0.03 0.00 -0.74 0.00 0.00 36.82 36.82 1o1y h ILE 20 CO -0.04 0.26 0.24 -0.26 0.00 0.00 0.00 178.15 178.36 1o1y h PHE 21 N 0.60 0.98 -0.55 1.37 0.04 -1.85 -1.75 116.94 115.78 1o1y h PHE 21 Ca 0.15 -0.08 -0.04 0.00 2.80 0.00 0.00 57.97 60.80 1o1y h PHE 21 Cb 0.25 -0.29 -0.02 0.00 2.20 0.00 0.00 35.95 38.09 1o1y h PHE 21 CO 0.01 0.78 0.19 0.00 -0.60 0.00 0.00 178.31 178.69 1o1y h ARG 22 N 0.90 0.84 -0.86 1.51 3.08 -0.83 0.80 114.38 119.82 1o1y h ARG 22 Ca 0.21 -0.17 0.10 0.00 0.07 0.00 0.00 59.98 60.19 1o1y h ARG 22 Cb 0.23 -0.13 -0.06 0.00 0.08 0.00 0.00 29.97 30.09 1o1y h ARG 22 CO -0.01 0.76 0.56 0.93 -1.07 0.00 0.00 179.97 181.13 1o1y h GLU 23 N 0.76 0.79 -0.52 0.04 5.08 -0.61 -2.14 114.58 117.99 1o1y h GLU 23 Ca 0.18 -0.05 0.00 0.00 -1.00 0.00 0.00 59.36 58.49 1o1y h GLU 23 Cb 0.25 -0.18 0.00 0.00 0.50 0.00 0.00 28.75 29.32 1o1y h GLU 23 CO -0.01 0.53 0.00 1.63 -1.00 0.00 0.00 179.01 180.16 1o1y n LYS 24 N -4.53 2.44 -3.28 2.33 5.02 -0.69 -4.94 118.16 114.51 1o1y n LYS 24 Ca 0.15 -2.21 -0.22 0.00 -2.02 0.00 0.00 58.31 54.01 1o1y n LYS 24 Cb 0.33 -1.50 -0.01 0.00 -0.02 0.00 0.00 35.03 33.84 1o1y n LYS 24 CO 0.00 0.00 0.00 0.09 -0.52 0.00 0.00 177.40 176.97 1o1y n ASN 25 N 1.34 -3.57 -4.71 4.39 4.13 -0.59 -4.96 115.26 111.29 1o1y n ASN 25 Ca 0.20 -0.33 -0.42 0.00 1.68 0.00 0.00 54.58 55.72 1o1y n ASN 25 Cb 0.55 -2.97 -0.03 0.00 -1.54 0.00 0.00 39.78 35.79 1o1y n ASN 25 CO 0.00 0.00 0.00 0.26 0.28 0.00 0.00 177.26 177.80 1o1y s TRP 26 N -2.87 3.46 0.50 3.10 0.51 0.17 -4.87 118.94 118.94 1o1y s TRP 26 Ca 0.36 1.35 -0.21 0.00 -2.12 0.00 0.00 56.10 55.49 1o1y s TRP 26 Cb -0.19 -3.39 -0.07 0.00 -0.81 0.00 0.00 33.47 29.01 1o1y s TRP 26 CO 0.44 -1.13 1.10 -1.12 -0.51 0.00 0.00 176.95 175.73 1o1y s SER 27 N 0.99 6.07 -0.06 2.95 0.01 -0.56 -4.56 113.70 118.54 1o1y s SER 27 Ca 0.58 2.12 -0.12 0.00 1.31 0.00 0.00 55.95 59.83 1o1y s SER 27 Cb -0.29 -2.58 0.02 0.00 0.21 0.00 0.00 66.02 63.39 1o1y s SER 27 CO 0.29 -0.98 0.30 0.72 0.41 0.00 0.00 173.24 173.98 1o1y s PHE 28 N -1.78 -0.23 -0.14 2.43 -0.12 -1.26 -0.51 117.98 116.37 1o1y s PHE 28 Ca 0.68 0.48 0.02 0.00 -0.05 0.00 0.00 56.93 58.06 1o1y s PHE 28 Cb -0.22 0.09 0.01 0.00 -0.63 0.00 0.00 43.02 42.27 1o1y s PHE 28 CO 0.26 -0.28 -0.21 -0.51 -0.05 0.00 0.00 175.22 174.42 1o1y s ASP 29 N -0.70 3.19 0.23 1.98 1.01 -0.33 -4.95 116.67 117.10 1o1y s ASP 29 Ca -0.08 -0.58 -0.30 0.00 0.71 0.00 0.00 52.55 52.30 1o1y s ASP 29 Cb -0.04 -1.46 -0.09 0.00 1.01 0.00 0.00 42.92 42.34 1o1y s ASP 29 CO 0.02 0.09 0.97 -0.31 0.21 0.00 0.00 175.17 176.15 1o1y s TYR 30 N 0.76 3.90 -0.31 4.23 1.51 -1.26 -0.60 117.35 125.58 1o1y s TYR 30 Ca -0.08 1.87 0.00 0.00 -1.01 0.00 0.00 57.07 57.85 1o1y s TYR 30 Cb -0.16 -3.04 0.07 0.00 -0.11 0.00 0.00 41.96 38.73 1o1y s TYR 30 CO -0.01 0.27 0.02 -1.17 -1.11 0.00 0.00 175.55 173.55 1o1y s LEU 31 N -1.04 4.15 -1.01 -1.29 2.96 0.11 -4.91 118.68 117.66 1o1y s LEU 31 Ca 0.42 -1.57 -0.12 0.00 -0.22 0.00 0.00 54.13 52.65 1o1y s LEU 31 Cb -0.27 -1.68 0.24 0.00 0.50 0.00 0.00 46.19 44.99 1o1y s LEU 31 CO 0.33 -0.31 1.02 -1.81 -1.32 0.00 0.00 176.35 174.26 1o1y s ASP 32 N 1.25 7.08 0.40 3.68 1.11 -1.26 -1.49 116.67 127.44 1o1y s ASP 32 Ca -0.01 -3.15 0.10 0.00 0.18 0.00 0.00 52.55 49.66 1o1y s ASP 32 Cb -0.20 -2.24 0.84 0.00 1.07 0.00 0.00 42.92 42.40 1o1y s ASP 32 CO -0.04 -0.47 1.95 0.71 1.18 0.00 0.00 175.17 178.51 1o1y h THR 33 N 4.25 1.15 0.00 -1.27 1.35 -1.77 -1.69 112.91 114.93 1o1y h THR 33 Ca 0.17 -0.64 0.00 0.00 -0.55 0.00 0.00 66.41 65.38 1o1y h THR 33 Cb 0.94 1.12 0.00 0.00 -1.73 0.00 0.00 68.15 68.48 1o1y h THR 33 CO 0.95 0.20 0.00 -0.65 -0.25 0.00 0.00 175.52 175.77 1o1y h PRO 34 N 0.23 0.00 -0.12 4.72 0.11 -1.89 -0.16 132.00 134.90 1o1y h PRO 34 Ca 0.05 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.16 1o1y h PRO 34 Cb 0.29 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.40 1o1y h PRO 34 CO 0.01 0.00 0.00 1.63 -0.21 0.00 0.00 178.00 179.43 1o1y n LYS 35 N -2.69 1.46 -0.76 1.05 5.02 -0.64 -4.89 118.16 116.70 1o1y n LYS 35 Ca -0.01 -0.69 0.00 0.00 -2.02 0.00 0.00 58.31 55.59 1o1y n LYS 35 Cb 0.14 -1.33 0.00 0.00 -0.02 0.00 0.00 35.03 33.82 1o1y n LYS 35 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1o1y n GLY 36 N 0.97 0.71 3.76 0.72 0.00 -0.07 -5.04 105.19 106.26 1o1y n GLY 36 Ca 0.14 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.76 1o1y n GLY 36 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1o1y s GLU 37 N -0.24 4.42 0.39 1.61 2.02 -1.17 -5.01 118.70 120.73 1o1y s GLU 37 Ca 0.00 1.95 0.08 0.00 0.02 0.00 0.00 54.97 57.01 1o1y s GLU 37 Cb 0.00 -3.04 -0.07 0.00 0.10 0.00 0.00 34.13 31.12 1o1y s GLU 37 CO 0.00 -0.03 -0.00 0.15 0.02 0.00 0.00 175.26 175.40 1o1y s LYS 38 N -1.75 1.95 0.23 1.61 -0.14 -1.26 -4.42 119.74 115.96 1o1y s LYS 38 Ca 0.49 -2.05 -0.31 0.00 -1.36 0.00 0.00 55.97 52.74 1o1y s LYS 38 Cb -0.34 -1.68 -0.14 0.00 -1.68 0.00 0.00 37.83 33.98 1o1y s LYS 38 CO 0.44 -0.01 1.23 1.28 -0.76 0.00 0.00 175.35 177.54 1o1y n LEU 39 N -0.95 2.25 0.00 3.17 4.77 -1.26 -4.86 117.00 120.12 1o1y n LEU 39 Ca -0.05 1.15 0.11 0.00 -0.03 0.00 0.00 56.01 57.20 1o1y n LEU 39 Cb 0.66 -1.32 0.15 0.00 -2.33 0.00 0.00 43.42 40.58 1o1y n LEU 39 CO 0.48 -0.98 0.31 -1.84 -1.33 0.00 0.00 177.39 174.03 1o1y n GLU 40 N 1.61 0.01 -3.92 3.23 0.28 -1.26 -4.92 120.64 115.67 1o1y n GLU 40 Ca 0.12 0.00 -0.09 0.00 -0.16 0.00 0.00 57.16 57.03 1o1y n GLU 40 Cb 0.29 -1.50 -0.09 0.00 1.43 0.00 0.00 31.44 31.57 1o1y n GLU 40 CO 0.00 0.00 0.00 1.03 -0.16 0.00 0.00 177.13 178.00 1o1y s ARG 41 N -3.00 0.64 0.61 3.44 0.52 -1.26 -5.15 118.95 114.74 1o1y s ARG 41 Ca 0.10 -0.80 -0.19 0.00 -0.52 0.00 0.00 55.73 54.32 1o1y s ARG 41 Cb 0.17 0.25 -0.03 0.00 0.52 0.00 0.00 34.95 35.87 1o1y s ARG 41 CO 0.75 -0.17 1.27 -2.14 0.02 0.00 0.00 175.30 175.02 1o1y s PRO 42 N -2.89 2.82 0.56 3.54 0.02 -1.26 -4.88 135.00 132.91 1o1y s PRO 42 Ca -0.03 1.99 0.26 0.00 0.02 0.00 0.00 61.00 63.24 1o1y s PRO 42 Cb 0.01 -1.94 1.49 0.00 0.02 0.00 0.00 34.50 34.07 1o1y s PRO 42 CO -0.06 -1.37 2.04 -0.07 -0.33 0.00 0.00 177.00 177.22 1o1y h LEU 43 N 0.84 0.00 -1.72 -5.54 3.38 -2.01 0.48 115.31 110.74 1o1y h LEU 43 Ca -0.51 0.00 -0.00 0.00 0.09 0.00 0.00 57.88 57.46 1o1y h LEU 43 Cb 1.32 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 42.07 1o1y h LEU 43 CO 0.55 0.00 -0.01 -0.33 0.09 0.00 0.00 178.44 178.74 1o1y h GLU 44 N 0.00 0.00 0.00 1.13 3.07 -2.02 -1.86 114.58 114.90 1o1y h GLU 44 Ca 0.16 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 59.02 1o1y h GLU 44 Cb 0.71 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.62 1o1y h GLU 44 CO -0.00 0.01 0.00 0.39 -1.40 0.00 0.00 179.01 178.00 1o1y n GLU 45 N -3.10 0.07 -4.07 2.33 1.02 0.16 -4.78 120.64 112.26 1o1y n GLU 45 Ca -0.00 0.30 -0.36 0.00 -0.02 0.00 0.00 57.16 57.08 1o1y n GLU 45 Cb 0.27 -1.62 -0.08 0.00 -0.02 0.00 0.00 31.44 29.98 1o1y n GLU 45 CO 0.00 0.00 0.00 0.71 1.18 0.00 0.00 177.13 179.02 1o1y s TYR 46 N -3.10 3.36 -0.56 -0.32 2.02 -0.70 -4.59 117.35 113.45 1o1y s TYR 46 Ca 0.06 0.29 0.24 0.00 -0.37 0.00 0.00 57.07 57.29 1o1y s TYR 46 Cb 0.10 -1.94 0.27 0.00 -0.40 0.00 0.00 41.96 39.99 1o1y s TYR 46 CO 0.32 0.48 1.26 0.77 -1.57 0.00 0.00 175.55 176.81 1o1y h SER 47 N 5.56 0.00 -4.06 2.29 0.02 -1.05 -3.47 113.55 112.83 1o1y h SER 47 Ca -0.48 -0.18 -0.05 0.00 -0.84 0.00 0.00 61.79 60.23 1o1y h SER 47 Cb 1.20 0.00 -0.21 0.00 0.14 0.00 0.00 62.40 63.52 1o1y h SER 47 CO 0.61 0.09 0.08 -0.22 -1.14 0.00 0.00 176.83 176.25 1o1y s LEU 48 N -4.45 -0.56 -0.10 5.07 2.96 -1.23 -4.19 118.68 116.18 1o1y s LEU 48 Ca 0.05 1.30 0.04 0.00 -0.22 0.00 0.00 54.13 55.30 1o1y s LEU 48 Cb 0.13 2.31 0.00 0.00 0.50 0.00 0.00 46.19 49.13 1o1y s LEU 48 CO 0.74 -0.26 -0.23 -0.69 -1.32 0.00 0.00 176.35 174.58 1o1y s VAL 49 N 0.23 2.02 -0.17 1.68 1.01 -0.36 -1.20 120.40 123.62 1o1y s VAL 49 Ca -0.01 -0.99 -0.02 0.00 0.00 0.00 0.00 61.98 60.96 1o1y s VAL 49 Cb -0.04 -1.75 -0.01 0.00 0.00 0.00 0.00 36.38 34.57 1o1y s VAL 49 CO 0.02 0.55 -0.10 -0.69 0.00 0.00 0.00 175.10 174.88 1o1y s VAL 50 N 0.39 3.12 -0.35 2.92 1.01 0.12 -0.66 120.40 126.96 1o1y s VAL 50 Ca -0.18 -0.61 -0.08 0.00 0.00 0.00 0.00 61.98 61.12 1o1y s VAL 50 Cb -0.18 -2.36 0.04 0.00 0.00 0.00 0.00 36.38 33.88 1o1y s VAL 50 CO 0.08 0.48 0.14 -0.22 0.00 0.00 0.00 175.10 175.58 1o1y s LEU 51 N 0.89 4.45 0.89 3.92 2.96 0.21 -0.66 118.68 131.34 1o1y s LEU 51 Ca -0.02 -1.11 -0.13 0.00 -0.22 0.00 0.00 54.13 52.65 1o1y s LEU 51 Cb -0.15 -1.91 0.16 0.00 0.50 0.00 0.00 46.19 44.79 1o1y s LEU 51 CO 0.00 -0.35 1.23 -0.76 -1.32 0.00 0.00 176.35 175.16 1o1y s LEU 52 N 1.45 2.72 0.00 -0.68 1.43 -0.51 -0.83 118.68 122.25 1o1y s LEU 52 Ca -0.01 0.29 -0.05 0.00 -1.03 0.00 0.00 54.13 53.33 1o1y s LEU 52 Cb -0.19 -2.49 0.07 0.00 0.03 0.00 0.00 46.19 43.60 1o1y s LEU 52 CO 0.04 -2.40 0.39 0.61 0.23 0.00 0.00 176.35 175.21 1o1y n GLY 53 N -3.51 -1.25 0.00 -3.19 0.00 -1.06 -3.33 105.19 92.85 1o1y n GLY 53 Ca 0.13 -1.68 0.00 0.00 0.00 0.00 0.00 46.02 44.47 1o1y n GLY 53 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1o1y n GLY 54 N 2.47 0.88 3.40 -0.02 0.00 -1.26 -4.19 105.19 106.46 1o1y n GLY 54 Ca 0.05 -1.13 -0.44 0.00 0.00 0.00 0.00 46.02 44.49 1o1y n GLY 54 CO 0.00 0.00 0.00 1.58 0.00 0.00 0.00 173.32 174.90 1o1y n TYR 55 N -0.85 4.89 -4.30 1.61 0.18 -1.26 -4.53 117.16 112.89 1o1y n TYR 55 Ca 0.00 -3.44 -0.24 0.00 1.88 0.00 0.00 57.90 56.10 1o1y n TYR 55 Cb 0.00 -2.05 -0.12 0.00 -0.38 0.00 0.00 39.34 36.78 1o1y n TYR 55 CO 0.00 0.00 0.00 0.20 -2.08 0.00 0.00 176.86 174.98 1o1y s GLY 57 N 2.29 1.30 0.58 -7.48 0.00 -1.26 -5.16 107.32 97.59 1o1y s GLY 57 Ca 0.40 -1.31 0.35 0.00 0.00 0.00 0.00 44.72 44.16 1o1y s GLY 57 CO -0.01 -1.32 2.16 0.00 0.00 0.00 0.00 173.10 173.93 1o1y h ALA 58 N 3.90 1.14 -0.58 3.20 0.00 -1.95 -1.81 119.26 123.16 1o1y h ALA 58 Ca -0.46 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 54.41 1o1y h ALA 58 Cb 1.18 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.97 1o1y h ALA 58 CO 0.42 0.06 0.00 0.66 0.00 0.00 0.00 179.25 180.38 1o1y n TYR 59 N -3.34 1.23 -1.56 0.00 4.02 -1.26 -4.70 117.16 111.56 1o1y n TYR 59 Ca -0.02 -0.61 -0.36 0.00 -0.01 0.00 0.00 57.90 56.90 1o1y n TYR 59 Cb 0.19 -0.19 0.06 0.00 -0.02 0.00 0.00 39.34 39.38 1o1y n TYR 59 CO 0.00 0.00 0.00 0.39 -1.01 0.00 0.00 176.86 176.24 1o1y n GLU 60 N 0.94 2.66 0.22 -0.72 1.02 -0.68 -4.66 120.64 119.42 1o1y n GLU 60 Ca 0.23 -3.27 0.06 0.00 -0.02 0.00 0.00 57.16 54.16 1o1y n GLU 60 Cb 0.80 -2.25 0.50 0.00 -0.02 0.00 0.00 31.44 30.47 1o1y n GLU 60 CO 0.00 0.00 0.00 0.93 1.18 0.00 0.00 177.13 179.24 1o1y h GLU 61 N 2.43 0.00 -0.30 3.49 5.08 -1.83 -0.70 114.58 122.75 1o1y h GLU 61 Ca 0.57 0.00 -0.14 0.00 -1.00 0.00 0.00 59.36 58.79 1o1y h GLU 61 Cb 0.49 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 29.73 1o1y h GLU 61 CO 1.47 0.21 -0.37 0.93 -1.00 0.00 0.00 179.01 180.24 1o1y h GLU 62 N 0.00 0.79 -0.49 2.33 5.08 -1.96 -2.32 114.58 118.01 1o1y h GLU 62 Ca -0.00 -0.44 -0.13 0.00 -1.00 0.00 0.00 59.36 57.79 1o1y h GLU 62 Cb 0.38 0.03 -0.01 0.00 0.50 0.00 0.00 28.75 29.65 1o1y h GLU 62 CO 0.03 1.07 -0.19 0.87 -1.00 0.00 0.00 179.01 179.79 1o1y h LYS 63 N 0.55 0.98 -2.67 2.33 1.57 -1.88 -3.38 116.57 114.07 1o1y h LYS 63 Ca 0.04 -0.40 -0.61 0.00 -1.87 0.00 0.00 60.65 57.81 1o1y h LYS 63 Cb 0.96 -0.04 -0.41 0.00 0.08 0.00 0.00 32.23 32.82 1o1y h LYS 63 CO 0.09 1.07 -0.70 0.66 -0.57 0.00 0.00 179.45 180.00 1o1y n TYR 64 N -4.12 2.21 0.30 -1.35 4.01 -0.29 -4.98 117.16 112.94 1o1y n TYR 64 Ca 0.00 -4.02 0.17 0.00 -0.16 0.00 0.00 57.90 53.90 1o1y n TYR 64 Cb 0.44 -0.41 0.98 0.00 -0.31 0.00 0.00 39.34 40.04 1o1y n TYR 64 CO 0.00 0.00 0.00 -1.35 -0.46 0.00 0.00 176.86 175.05 1o1y h PRO 65 N 5.07 0.00 -0.19 -0.72 0.11 -1.61 -1.33 132.00 133.34 1o1y h PRO 65 Ca 0.18 0.00 0.05 0.00 0.11 0.00 0.00 66.00 66.34 1o1y h PRO 65 Cb 0.77 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 31.88 1o1y h PRO 65 CO 0.65 0.00 0.19 0.27 -0.21 0.00 0.00 178.00 178.90 1o1y h PHE 66 N 0.00 0.00 -0.26 0.65 -5.15 -1.88 -1.95 116.94 108.35 1o1y h PHE 66 Ca 0.01 0.00 -0.04 0.00 -0.20 0.00 0.00 57.97 57.74 1o1y h PHE 66 Cb 0.09 0.00 -0.01 0.00 0.22 0.00 0.00 35.95 36.24 1o1y h PHE 66 CO 0.00 0.00 -0.02 -0.07 -2.00 0.00 0.00 178.31 176.22 1o1y h LEU 67 N 0.00 0.37 -0.55 2.10 3.38 -1.55 -2.36 115.31 116.70 1o1y h LEU 67 Ca 0.09 -0.06 0.03 0.00 0.09 0.00 0.00 57.88 58.03 1o1y h LEU 67 Cb 0.47 -0.10 -0.04 0.00 0.09 0.00 0.00 40.66 41.08 1o1y h LEU 67 CO -0.00 0.45 0.32 0.50 0.09 0.00 0.00 178.44 179.80 1o1y h LYS 68 N 0.39 0.61 -0.59 1.13 1.63 -1.54 0.18 116.57 118.38 1o1y h LYS 68 Ca 0.09 -0.04 -0.03 0.00 -0.85 0.00 0.00 60.65 59.82 1o1y h LYS 68 Cb 0.29 -0.14 -0.03 0.00 -0.60 0.00 0.00 32.23 31.76 1o1y h LYS 68 CO 0.01 0.40 0.27 -0.92 -3.45 0.00 0.00 179.45 175.76 1o1y h TYR 69 N 0.63 0.87 -0.50 1.91 3.20 -1.59 -2.32 116.97 119.16 1o1y h TYR 69 Ca 0.23 -0.05 -0.01 0.00 3.14 0.00 0.00 58.73 62.04 1o1y h TYR 69 Cb 0.05 -0.27 -0.02 0.00 1.54 0.00 0.00 36.73 38.03 1o1y h TYR 69 CO -0.07 0.67 0.27 0.93 -1.64 0.00 0.00 178.16 178.33 1o1y h GLU 70 N 0.81 0.71 -0.89 1.82 5.08 -0.92 -0.90 114.58 120.29 1o1y h GLU 70 Ca 0.20 -0.08 0.04 0.00 -1.00 0.00 0.00 59.36 58.52 1o1y h GLU 70 Cb 0.15 -0.14 -0.05 0.00 0.50 0.00 0.00 28.75 29.21 1o1y h GLU 70 CO -0.02 0.55 0.58 0.74 -1.00 0.00 0.00 179.01 179.86 1o1y h PHE 71 N 0.67 1.06 -0.66 4.33 0.05 -0.52 -0.81 116.94 121.08 1o1y h PHE 71 Ca 0.18 0.03 -0.03 0.00 3.82 0.00 0.00 57.97 61.96 1o1y h PHE 71 Cb 0.06 -0.35 -0.03 0.00 2.00 0.00 0.00 35.95 37.62 1o1y h PHE 71 CO -0.02 0.61 0.28 1.96 -0.18 0.00 0.00 178.31 180.97 1o1y h GLN 72 N 1.09 0.97 -0.62 1.51 4.20 -0.91 -1.97 115.11 119.38 1o1y h GLN 72 Ca 0.36 -0.16 -0.04 0.00 0.06 0.00 0.00 58.65 58.87 1o1y h GLN 72 Cb 0.05 -0.16 -0.03 0.00 0.30 0.00 0.00 27.48 27.64 1o1y h GLN 72 CO -0.11 0.80 0.24 -0.07 -0.67 0.00 0.00 178.83 179.02 1o1y h LEU 73 N 0.92 0.87 -0.58 1.46 3.38 -0.36 -2.01 115.31 118.99 1o1y h LEU 73 Ca 0.22 -0.18 0.02 0.00 0.09 0.00 0.00 57.88 58.03 1o1y h LEU 73 Cb 0.17 -0.23 -0.03 0.00 0.09 0.00 0.00 40.66 40.66 1o1y h LEU 73 CO -0.02 0.81 0.37 0.40 0.09 0.00 0.00 178.44 180.09 1o1y h ILE 74 N 0.88 1.10 -0.67 1.22 2.04 -0.88 0.23 117.51 121.43 1o1y h ILE 74 Ca 0.21 -0.25 0.03 0.00 1.00 0.00 0.00 64.86 65.84 1o1y h ILE 74 Cb 0.22 0.30 -0.04 0.00 -0.74 0.00 0.00 36.82 36.55 1o1y h ILE 74 CO -0.02 0.14 0.41 -0.33 0.00 0.00 0.00 178.15 178.35 1o1y h GLU 75 N 0.74 0.78 -0.39 2.37 5.08 -1.14 -0.67 114.58 121.36 1o1y h GLU 75 Ca 0.23 -0.05 -0.14 0.00 -1.00 0.00 0.00 59.36 58.40 1o1y h GLU 75 Cb -0.03 -0.18 -0.01 0.00 0.50 0.00 0.00 28.75 29.03 1o1y h GLU 75 CO -0.08 0.52 -0.31 0.93 -1.00 0.00 0.00 179.01 179.07 1o1y h GLU 76 N 0.81 0.86 -0.78 2.33 5.08 -0.60 -1.58 114.58 120.70 1o1y h GLU 76 Ca 0.27 -0.41 -0.04 0.00 -1.00 0.00 0.00 59.36 58.18 1o1y h GLU 76 Cb 0.03 -0.01 -0.03 0.00 0.50 0.00 0.00 28.75 29.23 1o1y h GLU 76 CO -0.11 1.05 0.34 0.82 -1.00 0.00 0.00 179.01 180.11 1o1y h ILE 77 N 0.72 1.25 -0.45 3.13 2.04 -0.06 -0.28 117.51 123.87 1o1y h ILE 77 Ca 0.08 -0.77 -0.08 0.00 1.00 0.00 0.00 64.86 65.09 1o1y h ILE 77 Cb 0.87 0.31 -0.02 0.00 -0.74 0.00 0.00 36.82 37.25 1o1y h ILE 77 CO 0.08 0.32 -0.02 -0.07 0.00 0.00 0.00 178.15 178.46 1o1y h LEU 78 N 1.12 0.80 -0.97 1.44 3.38 -0.98 -0.73 115.31 119.37 1o1y h LEU 78 Ca 0.26 -0.32 -0.05 0.00 0.09 0.00 0.00 57.88 57.86 1o1y h LEU 78 Cb 0.18 -0.22 -0.03 0.00 0.09 0.00 0.00 40.66 40.69 1o1y h LEU 78 CO -0.03 0.93 0.14 0.50 0.09 0.00 0.00 178.44 180.07 1o1y h LYS 79 N 0.66 0.89 -0.01 1.13 3.64 -0.88 -2.49 116.57 119.50 1o1y h LYS 79 Ca 0.13 -0.19 0.00 0.00 -1.27 0.00 0.00 60.65 59.32 1o1y h LYS 79 Cb 0.53 -0.13 0.00 0.00 -0.41 0.00 0.00 32.23 32.22 1o1y h LYS 79 CO 0.03 0.79 -0.20 1.63 -2.27 0.00 0.00 179.45 179.43 1o1y n LYS 80 N -4.27 0.92 -3.75 1.90 5.02 -0.15 -4.94 118.16 112.89 1o1y n LYS 80 Ca 0.04 -0.51 -0.26 0.00 -2.02 0.00 0.00 58.31 55.57 1o1y n LYS 80 Cb 0.23 -1.49 0.04 0.00 -0.02 0.00 0.00 35.03 33.80 1o1y n LYS 80 CO 0.00 0.00 0.00 0.39 -0.52 0.00 0.00 177.40 177.27 1o1y n GLU 81 N -0.59 -5.99 -2.83 1.97 1.02 -0.34 -4.97 120.64 108.91 1o1y n GLU 81 Ca 0.14 0.67 -0.41 0.00 -0.02 0.00 0.00 57.16 57.54 1o1y n GLU 81 Cb 0.33 -5.53 -0.05 0.00 -0.02 0.00 0.00 31.44 26.18 1o1y n GLU 81 CO 0.00 0.00 0.00 0.42 1.18 0.00 0.00 177.13 178.73 1o1y s ILE 82 N -3.41 4.56 0.24 -3.67 1.01 -0.84 -4.91 121.20 114.18 1o1y s ILE 82 Ca 0.42 1.91 -0.31 0.00 0.00 0.00 0.00 60.65 62.67 1o1y s ILE 82 Cb -0.20 -4.25 -0.14 0.00 0.01 0.00 0.00 42.46 37.88 1o1y s ILE 82 CO 0.80 0.35 1.27 -2.65 0.00 0.00 0.00 174.94 174.70 1o1y n PRO 83 N 2.72 1.69 -3.79 2.79 -0.02 -1.26 -4.72 135.00 132.41 1o1y n PRO 83 Ca 0.00 0.60 -0.14 0.00 -2.02 0.00 0.00 63.50 61.95 1o1y n PRO 83 Cb 0.49 -2.16 -0.15 0.00 -0.02 0.00 0.00 33.50 31.66 1o1y n PRO 83 CO 0.00 0.00 0.00 0.12 1.98 0.00 0.00 175.50 177.60 1o1y s PHE 84 N -0.34 -0.03 -0.20 6.00 5.36 -0.81 -1.23 117.98 126.73 1o1y s PHE 84 Ca 0.67 0.18 0.00 0.00 -0.96 0.00 0.00 56.93 56.83 1o1y s PHE 84 Cb -0.71 -0.13 0.05 0.00 -0.34 0.00 0.00 43.02 41.89 1o1y s PHE 84 CO 0.53 -0.08 -0.07 -1.17 -1.46 0.00 0.00 175.22 172.97 1o1y s LEU 85 N 0.76 2.18 -0.18 6.12 2.96 0.17 -0.51 118.68 130.17 1o1y s LEU 85 Ca -0.06 -0.94 -0.07 0.00 -0.22 0.00 0.00 54.13 52.84 1o1y s LEU 85 Cb -0.09 -1.11 -0.04 0.00 0.50 0.00 0.00 46.19 45.46 1o1y s LEU 85 CO -0.03 -0.20 0.05 -0.83 -1.32 0.00 0.00 176.35 174.03 1o1y s GLY 86 N 1.47 1.87 -0.19 7.98 0.00 0.30 -0.62 107.32 118.14 1o1y s GLY 86 Ca -0.02 -0.78 0.14 0.00 0.00 0.00 0.00 44.72 44.06 1o1y s GLY 86 CO -0.07 0.06 1.25 1.39 0.00 0.00 0.00 173.10 175.72 1o1y n ILE 87 N 3.60 2.15 0.00 0.90 5.41 -0.01 -0.67 119.36 130.75 1o1y n ILE 87 Ca -0.17 -2.72 0.00 0.00 1.00 0.00 0.00 62.75 60.87 1o1y n ILE 87 Cb 0.52 -0.25 0.00 0.00 -0.71 0.00 0.00 39.64 39.20 1o1y n ILE 87 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 176.55 176.44 1o1y n LEU 89 N -1.19 0.00 -0.30 1.39 7.94 -1.26 -2.57 117.00 121.02 1o1y n LEU 89 Ca 0.20 0.00 0.06 0.00 -1.11 0.00 0.00 56.01 55.16 1o1y n LEU 89 Cb 0.74 0.00 0.21 0.00 0.53 0.00 0.00 43.42 44.90 1o1y n LEU 89 CO 0.03 0.00 1.12 1.23 -1.11 0.00 0.00 177.39 178.66 1o1y h GLY 90 N 0.00 1.38 1.30 -3.96 0.00 -1.71 -1.83 103.07 98.26 1o1y h GLY 90 Ca 0.00 -0.28 -0.12 0.00 0.00 0.00 0.00 47.33 46.93 1o1y h GLY 90 CO 0.00 0.02 -0.25 1.48 0.00 0.00 0.00 176.54 177.78 1o1y h SER 91 N 0.69 0.81 0.00 0.19 4.64 -1.68 -2.03 113.55 116.17 1o1y h SER 91 Ca 0.45 -0.31 0.00 0.00 -0.47 0.00 0.00 61.79 61.46 1o1y h SER 91 Cb 0.58 -0.22 0.00 0.00 -0.31 0.00 0.00 62.40 62.45 1o1y h SER 91 CO -0.33 1.03 0.00 0.00 -0.87 0.00 0.00 176.83 176.66 1o1y n GLN 92 N -4.10 0.47 0.00 4.77 6.02 -0.69 -1.34 117.38 122.51 1o1y n GLN 92 Ca -0.00 0.00 0.00 0.00 -0.01 0.00 0.00 57.00 56.99 1o1y n GLN 92 Cb 0.45 -1.26 0.00 0.00 1.02 0.00 0.00 30.24 30.45 1o1y n GLN 92 CO 0.00 0.00 0.00 -0.11 -1.01 0.00 0.00 177.06 175.94 1o1y n LEU 94 N 0.65 0.00 -0.24 1.08 7.94 -0.76 -1.33 117.00 124.34 1o1y n LEU 94 Ca 0.00 0.00 0.00 0.00 -1.11 0.00 0.00 56.01 54.90 1o1y n LEU 94 Cb 0.21 0.00 0.12 0.00 0.53 0.00 0.00 43.42 44.28 1o1y n LEU 94 CO 0.00 0.00 1.09 0.00 -1.11 0.00 0.00 177.39 177.37 1o1y h ALA 95 N 0.00 0.96 -0.37 1.96 0.00 -1.49 -1.83 119.26 118.50 1o1y h ALA 95 Ca 0.00 0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.95 1o1y h ALA 95 Cb 0.00 -0.10 -0.02 0.00 0.00 0.00 0.00 17.79 17.67 1o1y h ALA 95 CO 0.00 0.03 0.24 -0.22 0.00 0.00 0.00 179.25 179.30 1o1y h LYS 96 N 0.67 0.48 -0.35 0.00 3.64 -1.29 -0.60 116.57 119.12 1o1y h LYS 96 Ca 0.33 -0.03 0.00 0.00 -1.27 0.00 0.00 60.65 59.68 1o1y h LYS 96 Cb 0.27 -0.11 -0.02 0.00 -0.41 0.00 0.00 32.23 31.96 1o1y h LYS 96 CO -0.22 0.32 0.22 0.28 -2.27 0.00 0.00 179.45 177.78 1o1y h VAL 97 N 0.50 1.10 -0.24 2.00 2.07 -1.72 -0.63 116.25 119.31 1o1y h VAL 97 Ca 0.14 -0.20 0.00 0.00 0.82 0.00 0.00 66.70 67.46 1o1y h VAL 97 Cb -0.05 0.59 0.00 0.00 -1.52 0.00 0.00 31.29 30.30 1o1y h VAL 97 CO -0.03 0.10 0.00 0.18 0.02 0.00 0.00 177.57 177.84 1o1y n LEU 98 N -4.47 1.33 0.00 2.57 4.77 -0.73 -4.90 117.00 115.58 1o1y n LEU 98 Ca 0.02 -0.66 0.00 0.00 -0.03 0.00 0.00 56.01 55.34 1o1y n LEU 98 Cb 0.07 -0.16 0.00 0.00 -2.33 0.00 0.00 43.42 41.00 1o1y n LEU 98 CO 0.35 0.33 0.00 0.61 -1.33 0.00 0.00 177.39 177.35 1o1y n GLY 99 N 0.91 0.73 3.90 -0.72 0.00 -0.24 -4.44 105.19 105.33 1o1y n GLY 99 Ca 0.09 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.79 1o1y n GLY 99 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1o1y s ALA 100 N -2.14 3.87 0.42 4.61 0.00 -0.29 -4.98 121.76 123.26 1o1y s ALA 100 Ca 0.00 -0.65 -0.23 0.00 0.00 0.00 0.00 51.96 51.08 1o1y s ALA 100 Cb 0.00 -2.03 -0.09 0.00 0.00 0.00 0.00 23.12 21.01 1o1y s ALA 100 CO 0.00 0.72 1.06 -1.12 0.00 0.00 0.00 175.76 176.42 1o1y s SER 101 N -2.38 6.61 0.00 0.00 0.01 -1.26 -3.73 113.70 112.95 1o1y s SER 101 Ca 0.38 2.05 0.07 0.00 1.31 0.00 0.00 55.95 59.76 1o1y s SER 101 Cb -0.13 -2.58 -0.03 0.00 0.21 0.00 0.00 66.02 63.50 1o1y s SER 101 CO 0.25 -0.60 -0.23 -0.69 0.41 0.00 0.00 173.24 172.39 1o1y s VAL 102 N -1.71 2.37 0.10 3.43 1.01 -1.26 -1.46 120.40 122.88 1o1y s VAL 102 Ca 0.60 -1.12 -0.26 0.00 0.00 0.00 0.00 61.98 61.20 1o1y s VAL 102 Cb -0.22 -1.90 0.08 0.00 0.00 0.00 0.00 36.38 34.35 1o1y s VAL 102 CO 0.27 0.49 0.81 -0.72 0.00 0.00 0.00 175.10 175.95 1o1y s TYR 103 N -0.73 -0.34 0.18 5.22 -0.85 -0.45 -5.00 117.35 115.38 1o1y s TYR 103 Ca 0.11 0.11 -0.32 0.00 -0.52 0.00 0.00 57.07 56.46 1o1y s TYR 103 Cb -0.10 0.58 -0.11 0.00 0.38 0.00 0.00 41.96 42.71 1o1y s TYR 103 CO 0.01 -0.76 1.64 0.50 -1.52 0.00 0.00 175.55 175.42 1o1y s ARG 104 N -3.41 4.18 0.32 -3.49 3.52 -1.26 -0.16 118.95 118.64 1o1y s ARG 104 Ca 0.06 2.47 -0.29 0.00 -0.13 0.00 0.00 55.73 57.84 1o1y s ARG 104 Cb -0.02 -3.14 -0.11 0.00 -1.56 0.00 0.00 34.95 30.13 1o1y s ARG 104 CO -0.06 -0.67 1.45 0.20 -0.81 0.00 0.00 175.30 175.41 1o1y s GLY 105 N 1.21 2.63 0.00 8.12 0.00 0.42 -4.77 107.32 114.94 1o1y s GLY 105 Ca 0.72 1.44 0.22 0.00 0.00 0.00 0.00 44.72 47.10 1o1y s GLY 105 CO 0.32 2.24 1.45 0.28 0.00 0.00 0.00 173.10 177.39 1o1y n LYS 106 N 1.36 2.19 -0.63 2.90 4.76 -1.26 -4.13 118.16 123.36 1o1y n LYS 106 Ca 0.04 -1.79 0.03 0.00 -2.87 0.00 0.00 58.31 53.71 1o1y n LYS 106 Cb 0.40 -1.47 0.20 0.00 -1.84 0.00 0.00 35.03 32.32 1o1y n LYS 106 CO 0.00 0.00 0.00 0.09 -1.37 0.00 0.00 177.40 176.12 1o1y n ASN 107 N 1.03 2.14 0.00 4.39 3.02 -1.26 -5.08 115.26 119.49 1o1y n ASN 107 Ca 0.18 -3.76 0.00 0.00 -0.03 0.00 0.00 54.58 50.97 1o1y n ASN 107 Cb 0.50 -0.56 0.00 0.00 -0.61 0.00 0.00 39.78 39.11 1o1y n ASN 107 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1o1y n GLY 108 N -1.12 -1.86 3.79 7.41 0.00 -1.26 -4.94 105.19 107.21 1o1y n GLY 108 Ca 0.24 -1.52 -0.34 0.00 0.00 0.00 0.00 46.02 44.40 1o1y n GLY 108 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1o1y s GLU 109 N -2.53 3.51 -0.37 1.61 2.02 -1.26 -4.88 118.70 116.81 1o1y s GLU 109 Ca 0.00 1.34 -0.07 0.00 0.02 0.00 0.00 54.97 56.26 1o1y s GLU 109 Cb 0.00 -2.05 0.06 0.00 0.10 0.00 0.00 34.13 32.23 1o1y s GLU 109 CO 0.00 -0.67 0.16 -1.21 0.02 0.00 0.00 175.26 173.57 1o1y s GLU 110 N -3.59 2.57 -0.24 1.61 2.02 -0.40 -5.00 118.70 115.67 1o1y s GLU 110 Ca 0.67 -1.32 -0.01 0.00 0.02 0.00 0.00 54.97 54.33 1o1y s GLU 110 Cb -0.17 -3.58 0.07 0.00 0.10 0.00 0.00 34.13 30.55 1o1y s GLU 110 CO 0.28 -0.79 0.02 0.42 0.02 0.00 0.00 175.26 175.21 1o1y s ILE 111 N 1.39 0.99 -2.77 -1.63 1.01 -1.25 -1.18 121.20 117.76 1o1y s ILE 111 Ca 0.01 -1.01 0.00 0.00 0.00 0.00 0.00 60.65 59.65 1o1y s ILE 111 Cb -0.21 -1.47 0.00 0.00 0.01 0.00 0.00 42.46 40.79 1o1y s ILE 111 CO 0.02 -0.28 0.00 0.61 0.00 0.00 0.00 174.94 175.29 1o1y n GLY 112 N 4.86 0.70 3.59 6.18 0.00 0.11 -4.97 105.19 115.66 1o1y n GLY 112 Ca -0.08 -1.97 -0.36 0.00 0.00 0.00 0.00 46.02 43.61 1o1y n GLY 112 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 1o1y s TRP 113 N -1.86 3.22 0.04 1.61 0.52 -1.26 -0.63 118.94 120.58 1o1y s TRP 113 Ca 0.00 0.00 -0.01 0.00 0.02 0.00 0.00 56.10 56.11 1o1y s TRP 113 Cb 0.00 -2.18 -0.03 0.00 -1.15 0.00 0.00 33.47 30.11 1o1y s TRP 113 CO 0.00 -0.01 -0.03 0.71 0.02 0.00 0.00 176.95 177.65 1o1y s TYR 114 N 0.91 0.41 0.36 -1.98 1.51 -0.15 -4.95 117.35 113.46 1o1y s TYR 114 Ca 0.05 -0.84 -0.25 0.00 -1.01 0.00 0.00 57.07 55.02 1o1y s TYR 114 Cb -0.14 -0.30 -0.10 0.00 -0.11 0.00 0.00 41.96 41.31 1o1y s TYR 114 CO 0.03 -0.30 0.99 -0.06 -1.11 0.00 0.00 175.55 175.09 1o1y s PHE 115 N -2.92 3.50 0.13 2.71 0.08 -1.26 -0.67 117.98 119.54 1o1y s PHE 115 Ca -0.02 1.71 0.07 0.00 0.12 0.00 0.00 56.93 58.81 1o1y s PHE 115 Cb 0.01 -3.00 -0.04 0.00 -0.57 0.00 0.00 43.02 39.41 1o1y s PHE 115 CO -0.06 -0.15 -0.18 0.14 -0.10 0.00 0.00 175.22 174.87 1o1y s VAL 116 N -1.67 1.61 -0.03 -0.44 -7.23 -0.33 -4.65 120.40 107.67 1o1y s VAL 116 Ca 0.54 -1.72 0.07 0.00 -1.81 0.00 0.00 61.98 59.06 1o1y s VAL 116 Cb -0.19 -1.63 -0.02 0.00 0.56 0.00 0.00 36.38 35.10 1o1y s VAL 116 CO 0.25 -0.27 -0.25 -1.61 -0.31 0.00 0.00 175.10 172.91 1o1y s GLU 117 N -2.45 2.10 -0.26 4.82 8.01 -0.17 -1.19 118.70 129.57 1o1y s GLU 117 Ca 0.10 -0.88 -0.20 0.00 0.01 0.00 0.00 54.97 54.00 1o1y s GLU 117 Cb -0.07 -1.97 -0.02 0.00 -4.31 0.00 0.00 34.13 27.76 1o1y s GLU 117 CO 0.05 0.50 0.62 0.21 0.01 0.00 0.00 175.26 176.64 1o1y s LYS 118 N -0.49 4.09 -0.15 1.61 2.20 0.03 -0.73 119.74 126.31 1o1y s LYS 118 Ca 0.07 0.51 0.17 0.00 -0.36 0.00 0.00 55.97 56.36 1o1y s LYS 118 Cb -0.10 -3.65 0.34 0.00 -1.51 0.00 0.00 37.83 32.90 1o1y s LYS 118 CO -0.00 -0.41 1.20 1.33 -0.36 0.00 0.00 175.35 177.10 1o1y n VAL 119 N 5.20 2.00 -3.77 4.02 0.24 0.06 -4.87 118.33 121.21 1o1y n VAL 119 Ca -0.01 -2.40 -0.13 0.00 -2.04 0.00 0.00 64.34 59.76 1o1y n VAL 119 Cb 0.49 -0.24 -0.09 0.00 -1.47 0.00 0.00 33.84 32.53 1o1y n VAL 119 CO 0.00 0.00 0.00 -0.55 -2.14 0.00 0.00 176.83 174.14 1o1y s SER 120 N -2.83 -0.19 -0.11 -1.34 0.15 -1.25 -4.84 113.70 103.28 1o1y s SER 120 Ca 0.34 0.12 0.08 0.00 0.70 0.00 0.00 55.95 57.19 1o1y s SER 120 Cb 0.30 0.34 0.42 0.00 -1.71 0.00 0.00 66.02 65.38 1o1y s SER 120 CO 0.02 -0.41 1.17 0.47 1.20 0.00 0.00 173.24 175.69 1o1y n ASP 121 N 1.46 3.37 -4.57 5.45 8.00 -1.26 -4.96 116.55 124.04 1o1y n ASP 121 Ca -0.21 -2.45 -0.52 0.00 0.71 0.00 0.00 54.79 52.33 1o1y n ASP 121 Cb 0.56 -0.57 -0.05 0.00 -0.02 0.00 0.00 41.12 41.04 1o1y n ASP 121 CO 0.00 0.00 0.00 -3.20 -0.39 0.00 0.00 177.20 173.61 1o1y n ASN 122 N 0.36 1.24 0.03 -2.24 2.85 -1.26 -4.79 115.26 111.45 1o1y n ASN 122 Ca 0.14 1.13 0.08 0.00 -0.11 0.00 0.00 54.58 55.82 1o1y n ASN 122 Cb 0.71 -1.16 0.50 0.00 1.24 0.00 0.00 39.78 41.07 1o1y n ASN 122 CO 0.00 0.00 0.00 0.07 -2.11 0.00 0.00 177.26 175.22 1o1y h LYS 123 N 3.83 0.37 0.00 1.20 2.10 -2.00 -1.72 116.57 120.35 1o1y h LYS 123 Ca -0.46 -0.02 -0.02 0.00 -2.00 0.00 0.00 60.65 58.15 1o1y h LYS 123 Cb 1.35 -0.08 -0.00 0.00 -0.90 0.00 0.00 32.23 32.60 1o1y h LYS 123 CO 0.73 0.24 -0.10 0.74 -2.00 0.00 0.00 179.45 179.06 1o1y h PHE 124 N 0.38 0.00 -0.29 0.07 0.04 -1.95 -2.73 116.94 112.46 1o1y h PHE 124 Ca 0.16 0.00 0.00 0.00 2.80 0.00 0.00 57.97 60.93 1o1y h PHE 124 Cb 0.17 0.00 0.00 0.00 2.20 0.00 0.00 35.95 38.32 1o1y h PHE 124 CO -0.00 0.10 0.00 1.19 -0.60 0.00 0.00 178.31 179.00 1o1y n PHE 125 N -4.31 0.81 -0.10 -0.55 3.72 -0.66 -4.35 117.46 112.02 1o1y n PHE 125 Ca -0.03 -0.75 0.17 0.00 -0.05 0.00 0.00 57.45 56.79 1o1y n PHE 125 Cb 0.18 -0.22 0.57 0.00 -0.94 0.00 0.00 39.48 39.07 1o1y n PHE 125 CO 0.00 0.00 0.00 -0.09 -0.05 0.00 0.00 176.76 176.62 1o1y h ARG 126 N 1.91 0.25 -0.00 -1.08 2.43 -1.35 0.12 114.38 116.66 1o1y h ARG 126 Ca 0.00 -0.02 0.00 0.00 -0.81 0.00 0.00 59.98 59.15 1o1y h ARG 126 Cb 1.22 -0.06 0.00 0.00 -0.42 0.00 0.00 29.97 30.71 1o1y h ARG 126 CO 0.16 0.17 -0.07 0.39 -1.51 0.00 0.00 179.97 179.10 1o1y n GLU 127 N -4.44 0.15 -2.82 0.20 -0.58 -1.26 -4.87 120.64 107.02 1o1y n GLU 127 Ca 0.12 -0.02 -0.35 0.00 -0.42 0.00 0.00 57.16 56.49 1o1y n GLU 127 Cb 0.55 -1.50 -0.07 0.00 -0.57 0.00 0.00 31.44 29.85 1o1y n GLU 127 CO 0.00 0.00 0.00 -0.06 -0.48 0.00 0.00 177.13 176.59 1o1y s PHE 128 N -2.87 3.52 0.82 -0.32 0.40 0.03 -5.02 117.98 114.53 1o1y s PHE 128 Ca 0.18 1.68 -0.12 0.00 -0.60 0.00 0.00 56.93 58.07 1o1y s PHE 128 Cb 0.19 -2.87 0.09 0.00 0.51 0.00 0.00 43.02 40.94 1o1y s PHE 128 CO 0.53 0.07 1.18 -1.25 0.70 0.00 0.00 175.22 176.45 1o1y s PRO 129 N -2.56 1.81 0.35 0.24 0.04 -1.26 -4.97 135.00 128.64 1o1y s PRO 129 Ca 0.55 -0.01 0.08 0.00 0.04 0.00 0.00 61.00 61.66 1o1y s PRO 129 Cb -0.14 -1.96 0.64 0.00 0.04 0.00 0.00 34.50 33.08 1o1y s PRO 129 CO 0.19 -1.67 1.83 -0.44 0.04 0.00 0.00 177.00 176.95 1o1y h ASP 130 N -1.08 0.28 -3.35 6.66 3.45 -1.94 -3.40 116.42 117.03 1o1y h ASP 130 Ca -0.46 -0.07 -0.36 0.00 0.43 0.00 0.00 57.03 56.57 1o1y h ASP 130 Cb 1.32 -0.07 -0.38 0.00 -0.56 0.00 0.00 39.33 39.63 1o1y h ASP 130 CO 0.61 0.50 -0.74 -0.60 -1.57 0.00 0.00 179.24 177.44 1o1y s ARG 131 N -4.57 0.00 -0.03 3.56 3.52 -1.26 -0.79 118.95 119.38 1o1y s ARG 131 Ca -0.05 0.31 0.01 0.00 -0.13 0.00 0.00 55.73 55.87 1o1y s ARG 131 Cb 0.15 -0.51 0.01 0.00 -1.56 0.00 0.00 34.95 33.04 1o1y s ARG 131 CO 0.75 -0.29 -0.05 -1.17 -0.81 0.00 0.00 175.30 173.73 1o1y s LEU 132 N 1.94 1.56 -0.16 -0.88 2.96 -0.33 -4.99 118.68 118.77 1o1y s LEU 132 Ca 0.02 -0.12 -0.25 0.00 -0.22 0.00 0.00 54.13 53.56 1o1y s LEU 132 Cb -0.12 -0.41 -0.02 0.00 0.50 0.00 0.00 46.19 46.14 1o1y s LEU 132 CO -0.03 -0.01 0.80 -0.60 -1.32 0.00 0.00 176.35 175.19 1o1y s ARG 133 N 0.55 4.30 0.18 1.98 3.52 -1.26 -1.19 118.95 127.03 1o1y s ARG 133 Ca -0.07 0.96 0.02 0.00 -0.13 0.00 0.00 55.73 56.50 1o1y s ARG 133 Cb -0.11 -3.56 -0.05 0.00 -1.56 0.00 0.00 34.95 29.67 1o1y s ARG 133 CO 0.00 -0.28 0.01 0.14 -0.81 0.00 0.00 175.30 174.36 1o1y s VAL 134 N 1.99 0.68 -0.17 7.11 -7.23 0.15 -4.94 120.40 117.99 1o1y s VAL 134 Ca 0.37 -1.98 -0.11 0.00 -1.81 0.00 0.00 61.98 58.44 1o1y s VAL 134 Cb -0.17 -2.17 -0.05 0.00 0.56 0.00 0.00 36.38 34.55 1o1y s VAL 134 CO 0.13 -0.43 0.20 0.12 -0.31 0.00 0.00 175.10 174.81 1o1y s PHE 135 N -3.66 3.46 0.02 2.82 5.36 -0.85 -0.98 117.98 124.15 1o1y s PHE 135 Ca 0.25 0.46 0.08 0.00 -0.96 0.00 0.00 56.93 56.77 1o1y s PHE 135 Cb 0.06 -2.21 -0.02 0.00 -0.34 0.00 0.00 43.02 40.51 1o1y s PHE 135 CO 0.05 0.32 -0.25 -0.65 -1.46 0.00 0.00 175.22 173.24 1o1y s GLN 136 N 0.22 1.79 -0.47 10.12 -1.52 0.20 -0.28 119.66 129.73 1o1y s GLN 136 Ca 0.12 -0.99 0.06 0.00 -1.95 0.00 0.00 55.36 52.60 1o1y s GLN 136 Cb -0.12 -1.87 0.21 0.00 -0.22 0.00 0.00 33.01 31.01 1o1y s GLN 136 CO 0.01 0.49 0.64 1.87 -0.25 0.00 0.00 175.29 178.05 1o1y n TRP 137 N 2.04 -2.48 -3.67 0.91 -0.00 -1.01 -0.71 117.44 112.53 1o1y n TRP 137 Ca -0.17 -2.27 -0.15 0.00 -0.00 0.00 0.00 57.50 54.91 1o1y n TRP 137 Cb 0.52 0.92 -0.08 0.00 -0.00 0.00 0.00 31.31 32.67 1o1y n TRP 137 CO 0.00 0.00 0.00 -3.38 -0.00 0.00 0.00 177.69 174.31 1o1y s HIS 138 N 0.31 -0.38 -0.04 5.87 -3.43 -0.33 -5.00 115.29 112.30 1o1y s HIS 138 Ca 0.32 0.65 0.06 0.00 -0.80 0.00 0.00 55.06 55.29 1o1y s HIS 138 Cb 0.09 0.22 -0.09 0.00 -1.43 0.00 0.00 32.58 31.36 1o1y s HIS 138 CO -0.14 -0.46 0.15 0.41 -2.00 0.00 0.00 174.74 172.69 1o1y n GLY 139 N 1.22 -0.21 3.96 -1.38 0.00 -1.26 -1.27 105.19 106.25 1o1y n GLY 139 Ca -0.20 -0.15 -0.23 0.00 0.00 0.00 0.00 46.02 45.44 1o1y n GLY 139 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1o1y s ASP 140 N -2.60 6.29 0.00 1.61 1.01 -1.26 -0.44 116.67 121.28 1o1y s ASP 140 Ca -0.02 0.09 0.00 0.00 0.71 0.00 0.00 52.55 53.33 1o1y s ASP 140 Cb 0.04 -1.86 0.00 0.00 1.01 0.00 0.00 42.92 42.12 1o1y s ASP 140 CO 0.26 -0.03 0.00 1.07 0.21 0.00 0.00 175.17 176.68 1o1y n THR 141 N -1.14 0.00 -3.70 -1.27 5.66 0.77 -4.71 114.28 109.89 1o1y n THR 141 Ca -0.08 0.00 -0.10 0.00 -3.05 0.00 0.00 64.05 60.82 1o1y n THR 141 Cb 0.56 0.00 -0.05 0.00 -1.55 0.00 0.00 70.33 69.29 1o1y n THR 141 CO 0.00 0.00 0.00 0.72 -3.05 0.00 0.00 175.07 172.74 1o1y s PHE 142 N -1.94 -0.09 0.52 1.09 -0.71 -1.26 -1.35 117.98 114.25 1o1y s PHE 142 Ca 0.00 -0.25 -0.17 0.00 -1.04 0.00 0.00 56.93 55.47 1o1y s PHE 142 Cb 0.00 0.19 -0.07 0.00 -1.21 0.00 0.00 43.02 41.93 1o1y s PHE 142 CO 0.00 -0.69 1.01 -0.51 -1.34 0.00 0.00 175.22 173.68 1o1y s ASP 143 N -2.83 6.40 -0.12 1.98 1.01 -0.54 -4.67 116.67 117.90 1o1y s ASP 143 Ca 0.05 1.69 -0.30 0.00 0.71 0.00 0.00 52.55 54.70 1o1y s ASP 143 Cb 0.02 -2.52 -0.02 0.00 1.01 0.00 0.00 42.92 41.41 1o1y s ASP 143 CO -0.10 -0.74 1.23 -0.22 0.21 0.00 0.00 175.17 175.54 1o1y s LEU 144 N -4.03 4.22 0.64 1.23 2.96 -1.26 -4.71 118.68 117.73 1o1y s LEU 144 Ca 0.61 1.74 -0.18 0.00 -0.22 0.00 0.00 54.13 56.08 1o1y s LEU 144 Cb -0.12 -3.55 -0.02 0.00 0.50 0.00 0.00 46.19 43.01 1o1y s LEU 144 CO 0.30 -0.68 1.29 -2.84 -1.32 0.00 0.00 176.35 173.10 1o1y s PRO 145 N 2.90 2.62 0.21 0.98 0.02 -1.26 -4.88 135.00 135.59 1o1y s PRO 145 Ca 0.55 2.06 -0.09 0.00 0.02 0.00 0.00 61.00 63.54 1o1y s PRO 145 Cb -0.23 -1.88 0.23 0.00 0.02 0.00 0.00 34.50 32.64 1o1y s PRO 145 CO 0.18 -1.54 1.84 -0.09 -0.33 0.00 0.00 177.00 177.06 1o1y h ARG 146 N 0.63 0.83 -0.00 5.54 2.43 -1.94 -1.35 114.38 120.52 1o1y h ARG 146 Ca -0.51 -0.05 0.00 0.00 -0.81 0.00 0.00 59.98 58.61 1o1y h ARG 146 Cb 1.33 -0.19 0.00 0.00 -0.42 0.00 0.00 29.97 30.69 1o1y h ARG 146 CO 0.54 0.55 -0.04 0.54 -1.51 0.00 0.00 179.97 180.04 1o1y n ARG 147 N -4.67 0.89 -3.32 0.20 1.74 -1.26 -4.90 116.66 105.33 1o1y n ARG 147 Ca 0.09 -0.23 -0.30 0.00 -0.77 0.00 0.00 57.85 56.64 1o1y n ARG 147 Cb 0.12 -1.50 -0.04 0.00 -1.02 0.00 0.00 32.46 30.02 1o1y n ARG 147 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 1o1y s ALA 148 N -2.27 3.59 -0.22 7.54 0.00 -0.51 -4.85 121.76 125.03 1o1y s ALA 148 Ca 0.36 -0.46 -0.13 0.00 0.00 0.00 0.00 51.96 51.73 1o1y s ALA 148 Cb 0.21 -2.37 -0.04 0.00 0.00 0.00 0.00 23.12 20.92 1o1y s ALA 148 CO 0.42 0.29 0.29 0.99 0.00 0.00 0.00 175.76 177.75 1o1y s THR 149 N -2.04 5.27 0.09 0.00 2.01 0.21 -4.86 115.64 116.33 1o1y s THR 149 Ca 0.45 0.46 -0.31 0.00 0.31 0.00 0.00 61.69 62.61 1o1y s THR 149 Cb -0.11 -3.62 -0.07 0.00 0.01 0.00 0.00 72.50 68.71 1o1y s THR 149 CO 0.28 0.29 1.31 -0.60 -0.69 0.00 0.00 174.62 175.21 1o1y s ARG 150 N 1.22 4.36 -0.10 4.92 3.52 -1.26 -1.26 118.95 130.35 1o1y s ARG 150 Ca 0.14 1.95 0.05 0.00 -0.13 0.00 0.00 55.73 57.74 1o1y s ARG 150 Cb -0.14 -3.29 -0.10 0.00 -1.56 0.00 0.00 34.95 29.86 1o1y s ARG 150 CO 0.06 -0.37 -0.02 0.28 -0.81 0.00 0.00 175.30 174.45 1o1y n VAL 151 N 3.94 0.63 -4.51 7.11 0.31 0.09 -4.36 118.33 121.54 1o1y n VAL 151 Ca 0.10 -0.33 -0.22 0.00 -0.01 0.00 0.00 64.34 63.88 1o1y n VAL 151 Cb 0.44 -0.81 -0.14 0.00 -0.91 0.00 0.00 33.84 32.41 1o1y n VAL 151 CO 0.00 0.00 0.00 -0.36 -1.32 0.00 0.00 176.83 175.15 1o1y s PHE 152 N -2.22 1.38 0.38 3.52 0.08 -0.94 -0.76 117.98 119.42 1o1y s PHE 152 Ca -0.08 -0.33 0.03 0.00 0.12 0.00 0.00 56.93 56.67 1o1y s PHE 152 Cb 0.03 -0.84 -0.01 0.00 -0.57 0.00 0.00 43.02 41.63 1o1y s PHE 152 CO 0.33 0.03 0.12 -2.37 -0.10 0.00 0.00 175.22 173.23 1o1y n THR 153 N 2.14 0.00 -3.85 0.64 5.66 0.10 -1.00 114.28 117.97 1o1y n THR 153 Ca -0.17 -2.17 -0.08 0.00 -3.05 0.00 0.00 64.05 58.59 1o1y n THR 153 Cb 0.54 0.75 -0.03 0.00 -1.55 0.00 0.00 70.33 70.04 1o1y n THR 153 CO 0.00 0.00 0.00 -0.94 -3.05 0.00 0.00 175.07 171.08 1o1y s SER 154 N -3.31 -0.25 0.16 1.09 1.04 -0.49 -1.00 113.70 110.95 1o1y s SER 154 Ca 0.17 -0.62 -0.14 0.00 0.48 0.00 0.00 55.95 55.84 1o1y s SER 154 Cb 0.01 0.69 0.05 0.00 0.10 0.00 0.00 66.02 66.87 1o1y s SER 154 CO 0.12 -1.27 1.75 -0.08 0.98 0.00 0.00 173.24 174.74 1o1y h GLU 155 N 2.05 0.74 0.09 4.02 4.81 -1.99 -3.28 114.58 121.03 1o1y h GLU 155 Ca -0.22 -0.10 -0.26 0.00 -0.13 0.00 0.00 59.36 58.66 1o1y h GLU 155 Cb 1.25 -0.14 -0.00 0.00 0.63 0.00 0.00 28.75 30.50 1o1y h GLU 155 CO 0.27 0.60 -1.15 0.87 -0.73 0.00 0.00 179.01 178.87 1o1y h LYS 156 N 0.69 0.26 -3.76 1.92 1.57 -1.94 -3.45 116.57 111.85 1o1y h LYS 156 Ca 0.18 -0.40 -0.45 0.00 -1.87 0.00 0.00 60.65 58.11 1o1y h LYS 156 Cb 0.09 0.14 -0.38 0.00 0.08 0.00 0.00 32.23 32.17 1o1y h LYS 156 CO -0.02 1.16 -0.77 0.71 -0.57 0.00 0.00 179.45 179.96 1o1y s TYR 157 N -2.78 0.78 0.34 -1.35 2.02 -1.24 -4.72 117.35 110.39 1o1y s TYR 157 Ca -0.04 -0.25 0.02 0.00 -0.37 0.00 0.00 57.07 56.43 1o1y s TYR 157 Cb 0.08 -0.86 0.61 0.00 -0.40 0.00 0.00 41.96 41.39 1o1y s TYR 157 CO 0.87 -0.36 2.00 1.49 -1.57 0.00 0.00 175.55 177.98 1o1y h GLU 158 N 8.31 0.85 -4.21 -0.62 4.81 -1.88 -1.29 114.58 120.55 1o1y h GLU 158 Ca -0.21 -0.06 -0.71 0.00 -0.13 0.00 0.00 59.36 58.25 1o1y h GLU 158 Cb 1.13 -0.19 -0.32 0.00 0.63 0.00 0.00 28.75 30.00 1o1y h GLU 158 CO 0.28 0.58 -0.41 -0.80 -0.73 0.00 0.00 179.01 177.93 1o1y s ASN 159 N -6.47 5.55 -0.07 1.04 0.01 -1.26 -4.22 114.94 109.52 1o1y s ASN 159 Ca -0.10 -2.16 0.16 0.00 -0.71 0.00 0.00 52.86 50.05 1o1y s ASN 159 Cb 0.18 -1.94 -0.23 0.00 0.41 0.00 0.00 41.25 39.66 1o1y s ASN 159 CO 0.77 -0.59 0.25 0.00 -1.51 0.00 0.00 177.10 176.02 1o1y n GLN 160 N 4.51 0.88 -3.58 -0.60 1.13 -0.17 -4.74 117.38 114.80 1o1y n GLN 160 Ca -0.02 -0.10 -0.11 0.00 -1.94 0.00 0.00 57.00 54.83 1o1y n GLN 160 Cb 0.41 -1.40 -0.06 0.00 0.11 0.00 0.00 30.24 29.30 1o1y n GLN 160 CO 0.00 0.00 0.00 0.20 -1.44 0.00 0.00 177.06 175.82 1o1y s GLY 161 N -4.31 -0.30 0.16 1.08 0.00 -0.96 -0.47 107.32 102.52 1o1y s GLY 161 Ca -0.07 2.07 -0.13 0.00 0.00 0.00 0.00 44.72 46.60 1o1y s GLY 161 CO 0.67 1.23 0.37 -0.11 0.00 0.00 0.00 173.10 175.27 1o1y s PHE 162 N -0.75 0.10 0.00 1.90 -0.71 -0.17 -0.73 117.98 117.63 1o1y s PHE 162 Ca -0.02 -0.46 0.03 0.00 -1.04 0.00 0.00 56.93 55.44 1o1y s PHE 162 Cb -0.02 0.14 -0.01 0.00 -1.21 0.00 0.00 43.02 41.92 1o1y s PHE 162 CO 0.01 -0.76 -0.10 0.54 -1.34 0.00 0.00 175.22 173.58 1o1y s VAL 163 N -3.90 0.75 -0.24 -2.49 0.11 -0.39 -1.04 120.40 113.20 1o1y s VAL 163 Ca 0.11 -0.54 -0.04 0.00 -2.93 0.00 0.00 61.98 58.58 1o1y s VAL 163 Cb 0.02 -0.66 0.09 0.00 -1.53 0.00 0.00 36.38 34.30 1o1y s VAL 163 CO -0.04 0.12 0.16 -0.47 -3.33 0.00 0.00 175.10 171.54 1o1y s TYR 164 N -0.41 0.05 0.00 1.54 5.04 0.57 -0.62 117.35 123.52 1o1y s TYR 164 Ca 0.02 -0.40 0.00 0.00 -2.44 0.00 0.00 57.07 54.25 1o1y s TYR 164 Cb -0.05 -0.67 0.00 0.00 0.35 0.00 0.00 41.96 41.59 1o1y s TYR 164 CO -0.00 -0.71 0.00 0.41 -1.34 0.00 0.00 175.55 173.91 1o1y n GLY 165 N 5.28 3.28 1.08 8.97 0.00 -1.26 -1.02 105.19 121.52 1o1y n GLY 165 Ca -0.06 -0.13 0.09 0.00 0.00 0.00 0.00 46.02 45.92 1o1y n GLY 165 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1o1y n LYS 166 N 13.43 2.39 -4.04 1.61 5.02 -1.26 -4.90 118.16 130.41 1o1y n LYS 166 Ca 0.00 -2.09 -0.35 0.00 -2.02 0.00 0.00 58.31 53.85 1o1y n LYS 166 Cb 0.00 -1.47 -0.09 0.00 -0.02 0.00 0.00 35.03 33.45 1o1y n LYS 166 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1o1y s ALA 167 N -1.27 3.48 -0.05 7.82 0.00 -0.19 -1.93 121.76 129.62 1o1y s ALA 167 Ca 0.39 -0.73 0.04 0.00 0.00 0.00 0.00 51.96 51.66 1o1y s ALA 167 Cb 0.20 -1.86 -0.00 0.00 0.00 0.00 0.00 23.12 21.47 1o1y s ALA 167 CO 0.26 0.34 -0.18 0.08 0.00 0.00 0.00 175.76 176.25 1o1y s VAL 168 N -0.12 1.52 -0.11 0.00 1.01 0.33 -0.32 120.40 122.72 1o1y s VAL 168 Ca 0.07 -0.76 0.03 0.00 0.00 0.00 0.00 61.98 61.32 1o1y s VAL 168 Cb -0.12 -1.31 0.01 0.00 0.00 0.00 0.00 36.38 34.95 1o1y s VAL 168 CO 0.01 0.44 -0.21 -0.83 0.00 0.00 0.00 175.10 174.50 1o1y s GLY 169 N 0.08 1.26 -0.11 4.51 0.00 -0.21 -0.54 107.32 112.31 1o1y s GLY 169 Ca -0.06 -0.93 0.02 0.00 0.00 0.00 0.00 44.72 43.76 1o1y s GLY 169 CO 0.03 -0.14 -0.18 1.08 0.00 0.00 0.00 173.10 173.89 1o1y s LEU 170 N 0.58 1.86 0.30 0.66 1.43 0.16 -1.00 118.68 122.67 1o1y s LEU 170 Ca -0.14 -0.48 0.07 0.00 -1.03 0.00 0.00 54.13 52.55 1o1y s LEU 170 Cb -0.17 -1.20 0.49 0.00 0.03 0.00 0.00 46.19 45.34 1o1y s LEU 170 CO 0.04 0.05 1.72 -0.61 0.23 0.00 0.00 176.35 177.78 1o1y h GLN 171 N 7.29 0.23 -6.62 1.70 5.75 -1.06 -3.36 115.11 119.04 1o1y h GLN 171 Ca -0.30 -0.10 -0.45 0.00 -0.15 0.00 0.00 58.65 57.64 1o1y h GLN 171 Cb 1.19 -0.00 0.03 0.00 1.07 0.00 0.00 27.48 29.76 1o1y h GLN 171 CO 0.50 0.59 -0.14 -0.59 -2.65 0.00 0.00 178.83 176.54 1o1y s PHE 172 N -4.18 2.12 -0.18 3.99 -0.71 -1.26 -4.81 117.98 112.94 1o1y s PHE 172 Ca -0.04 -0.50 -0.02 0.00 -1.04 0.00 0.00 56.93 55.33 1o1y s PHE 172 Cb 0.14 -2.39 -0.00 0.00 -1.21 0.00 0.00 43.02 39.55 1o1y s PHE 172 CO 0.77 -0.88 -0.11 -1.01 -1.34 0.00 0.00 175.22 172.66 1o1y s HIS 173 N -2.58 2.87 -0.68 3.49 3.76 0.62 -4.92 115.29 117.84 1o1y s HIS 173 Ca 0.59 -0.98 0.07 0.00 -0.15 0.00 0.00 55.06 54.59 1o1y s HIS 173 Cb -0.08 -1.98 0.14 0.00 1.11 0.00 0.00 32.58 31.77 1o1y s HIS 173 CO 0.37 -0.48 0.98 0.44 -0.85 0.00 0.00 174.74 175.20 1o1y n ILE 174 N 4.32 0.61 1.05 0.60 -5.35 -1.26 -2.01 119.36 117.31 1o1y n ILE 174 Ca -0.19 -0.80 0.12 0.00 -0.27 0.00 0.00 62.75 61.61 1o1y n ILE 174 Cb 0.51 0.75 0.10 0.00 -1.74 0.00 0.00 39.64 39.26 1o1y n ILE 174 CO 0.00 0.00 0.00 -1.84 -1.76 0.00 0.00 176.55 172.95 1o1y n GLU 175 N 0.22 1.70 -3.22 6.28 0.00 -1.26 -4.49 120.64 119.87 1o1y n GLU 175 Ca 0.06 -1.37 -0.45 0.00 0.00 0.00 0.00 57.16 55.40 1o1y n GLU 175 Cb 0.28 -1.47 -0.05 0.00 0.00 0.00 0.00 31.44 30.20 1o1y n GLU 175 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.13 177.21 1o1y s VAL 176 N -2.24 5.02 0.00 3.84 1.01 -1.26 -4.47 120.40 122.30 1o1y s VAL 176 Ca 0.24 -1.17 0.00 0.00 0.00 0.00 0.00 61.98 61.05 1o1y s VAL 176 Cb 0.19 -4.38 0.00 0.00 0.00 0.00 0.00 36.38 32.19 1o1y s VAL 176 CO 0.44 -0.94 0.00 0.61 0.00 0.00 0.00 175.10 175.20 1o1y n GLY 177 N 5.25 1.04 0.26 4.51 0.00 -1.26 -4.91 105.19 110.08 1o1y n GLY 177 Ca -0.11 -2.00 -0.09 0.00 0.00 0.00 0.00 46.02 43.82 1o1y n GLY 177 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1o1y h ALA 178 N -0.24 0.72 -0.44 4.61 0.00 -1.90 -3.10 119.26 118.92 1o1y h ALA 178 Ca 0.00 -0.22 -0.01 0.00 0.00 0.00 0.00 54.91 54.68 1o1y h ALA 178 Cb 0.00 -0.21 -0.02 0.00 0.00 0.00 0.00 17.79 17.56 1o1y h ALA 178 CO 0.00 0.43 0.24 -0.09 0.00 0.00 0.00 179.25 179.83 1o1y h ARG 179 N 0.78 0.61 -1.64 0.00 2.43 -1.96 -1.55 114.38 113.05 1o1y h ARG 179 Ca 0.17 -0.07 0.00 0.00 -0.81 0.00 0.00 59.98 59.27 1o1y h ARG 179 Cb 0.36 -0.12 0.00 0.00 -0.42 0.00 0.00 29.97 29.79 1o1y h ARG 179 CO 0.00 0.48 0.00 2.41 -1.51 0.00 0.00 179.97 181.36 1o1y n THR 180 N -4.71 0.42 0.00 0.20 -1.04 -1.17 -3.15 114.28 104.83 1o1y n THR 180 Ca 0.01 -0.02 0.00 0.00 -2.04 0.00 0.00 64.05 62.00 1o1y n THR 180 Cb 0.08 -0.74 0.00 0.00 -1.82 0.00 0.00 70.33 67.85 1o1y n THR 180 CO 0.00 0.00 0.00 0.29 -0.64 0.00 0.00 175.07 174.72 1o1y n LYS 182 N 0.89 0.00 -0.18 -2.82 5.02 -0.58 -1.43 118.16 119.06 1o1y n LYS 182 Ca 0.00 0.00 -0.10 0.00 -2.02 0.00 0.00 58.31 56.19 1o1y n LYS 182 Cb 0.19 0.00 0.01 0.00 -0.02 0.00 0.00 35.03 35.21 1o1y n LYS 182 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1o1y h ARG 183 N 0.00 0.90 -0.35 1.97 2.47 -1.83 -2.60 114.38 114.94 1o1y h ARG 183 Ca 0.00 -0.28 -0.07 0.00 -1.26 0.00 0.00 59.98 58.38 1o1y h ARG 183 Cb 0.00 -0.09 -0.01 0.00 -1.65 0.00 0.00 29.97 28.22 1o1y h ARG 183 CO 0.00 0.91 -0.04 -1.49 0.56 0.00 0.00 179.97 179.92 1o1y h TRP 184 N 0.77 0.72 -0.19 3.04 4.06 -1.57 -0.46 115.95 122.32 1o1y h TRP 184 Ca 0.15 -0.14 -0.08 0.00 2.06 0.00 0.00 58.89 60.88 1o1y h TRP 184 Cb 0.49 -0.18 -0.01 0.00 -1.00 0.00 0.00 29.16 28.46 1o1y h TRP 184 CO 0.04 0.78 -0.23 -0.84 -3.56 0.00 0.00 178.44 174.62 1o1y h ILE 185 N 0.45 1.25 -0.28 1.49 3.07 -1.83 0.31 117.51 121.96 1o1y h ILE 185 Ca 0.09 -1.15 -0.12 0.00 1.55 0.00 0.00 64.86 65.24 1o1y h ILE 185 Cb 0.52 1.36 -0.00 0.00 -0.27 0.00 0.00 36.82 38.42 1o1y h ILE 185 CO 0.03 0.36 -0.28 -0.08 -1.05 0.00 0.00 178.15 177.12 1o1y h GLU 186 N 0.32 0.69 -0.30 0.16 4.57 -1.38 -2.10 114.58 116.53 1o1y h GLU 186 Ca 0.05 -0.36 -0.07 0.00 -1.18 0.00 0.00 59.36 57.80 1o1y h GLU 186 Cb 0.59 0.01 -0.02 0.00 -0.16 0.00 0.00 28.75 29.17 1o1y h GLU 186 CO 0.04 0.98 -0.10 0.00 -1.18 0.00 0.00 179.01 178.75 1o1y h ALA 187 N 0.70 1.28 -0.10 2.92 0.00 -0.61 -3.22 119.26 120.23 1o1y h ALA 187 Ca 0.05 -0.25 -0.04 0.00 0.00 0.00 0.00 54.91 54.66 1o1y h ALA 187 Cb 0.85 -0.14 -0.03 0.00 0.00 0.00 0.00 17.79 18.47 1o1y h ALA 187 CO 0.07 0.48 -0.28 0.66 0.00 0.00 0.00 179.25 180.18 1o1y n TYR 188 N -4.22 0.32 -0.25 0.00 0.53 0.06 -4.78 117.16 108.81 1o1y n TYR 188 Ca 0.01 -1.40 0.01 0.00 -1.02 0.00 0.00 57.90 55.50 1o1y n TYR 188 Cb 0.30 -0.29 0.14 0.00 -1.03 0.00 0.00 39.34 38.46 1o1y n TYR 188 CO 0.00 0.00 0.00 -0.22 -1.02 0.00 0.00 176.86 175.62 1o1y h LYS 189 N 0.86 0.64 -0.06 -0.72 3.64 -1.39 -0.67 116.57 118.88 1o1y h LYS 189 Ca 0.05 -0.04 -0.20 0.00 -1.27 0.00 0.00 60.65 59.19 1o1y h LYS 189 Cb 1.19 -0.14 0.00 0.00 -0.41 0.00 0.00 32.23 32.86 1o1y h LYS 189 CO 0.11 0.42 -0.81 -0.44 -2.27 0.00 0.00 179.45 176.46 1o1y h ASP 190 N 0.66 0.57 -0.42 4.20 3.32 -1.87 -1.13 116.42 121.74 1o1y h ASP 190 Ca 0.35 -0.40 -0.03 0.00 0.02 0.00 0.00 57.03 56.98 1o1y h ASP 190 Cb 0.34 -0.17 -0.02 0.00 0.22 0.00 0.00 39.33 39.70 1o1y h ASP 190 CO -0.25 1.17 0.16 -0.08 -1.72 0.00 0.00 179.24 178.52 1o1y h GLU 191 N 0.30 0.63 -0.73 3.56 4.81 -1.85 0.82 114.58 122.12 1o1y h GLU 191 Ca -0.05 -0.12 0.00 0.00 -0.13 0.00 0.00 59.36 59.06 1o1y h GLU 191 Cb 1.42 -0.10 -0.04 0.00 0.63 0.00 0.00 28.75 30.66 1o1y h GLU 191 CO 0.14 0.59 0.47 -0.07 -0.73 0.00 0.00 179.01 179.42 1o1y h LEU 192 N 0.53 0.85 -0.33 1.64 3.38 -1.08 -1.66 115.31 118.64 1o1y h LEU 192 Ca 0.14 -0.03 -0.01 0.00 0.09 0.00 0.00 57.88 58.06 1o1y h LEU 192 Cb 0.20 -0.21 -0.02 0.00 0.09 0.00 0.00 40.66 40.72 1o1y h LEU 192 CO -0.01 0.63 0.16 -0.33 0.09 0.00 0.00 178.44 178.98 1o1y h GLU 193 N 0.99 0.48 -0.81 1.13 5.08 -0.90 -0.30 114.58 120.26 1o1y h GLU 193 Ca 0.27 -0.07 0.06 0.00 -1.00 0.00 0.00 59.36 58.62 1o1y h GLU 193 Cb -0.09 -0.09 -0.06 0.00 0.50 0.00 0.00 28.75 29.01 1o1y h GLU 193 CO -0.06 0.44 0.49 -0.22 -1.00 0.00 0.00 179.01 178.66 1o1y h LYS 194 N 0.40 0.85 -0.01 2.33 3.64 -0.62 -1.54 116.57 121.63 1o1y h LYS 194 Ca 0.11 -0.05 0.00 0.00 -1.27 0.00 0.00 60.65 59.44 1o1y h LYS 194 Cb 0.12 -0.19 0.00 0.00 -0.41 0.00 0.00 32.23 31.75 1o1y h LYS 194 CO -0.01 0.56 -0.04 1.63 -2.27 0.00 0.00 179.45 179.32 1o1y n LYS 195 N -4.68 1.43 -3.69 1.90 5.02 -0.64 -4.94 118.16 112.56 1o1y n LYS 195 Ca 0.11 -0.74 -0.22 0.00 -2.02 0.00 0.00 58.31 55.44 1o1y n LYS 195 Cb 0.19 -1.48 0.04 0.00 -0.02 0.00 0.00 35.03 33.76 1o1y n LYS 195 CO 0.00 0.00 0.00 1.63 -0.52 0.00 0.00 177.40 178.51 1o1y n LYS 196 N -0.14 -5.53 -3.96 1.97 5.02 -0.24 -4.98 118.16 110.30 1o1y n LYS 196 Ca 0.19 0.67 -0.35 0.00 -2.02 0.00 0.00 58.31 56.79 1o1y n LYS 196 Cb 0.32 -5.40 -0.11 0.00 -0.02 0.00 0.00 35.03 29.82 1o1y n LYS 196 CO 0.00 0.00 0.00 0.42 -0.52 0.00 0.00 177.40 177.30 1o1y s ILE 197 N -3.53 4.50 -0.39 -0.18 1.01 -0.50 -5.04 121.20 117.07 1o1y s ILE 197 Ca 0.17 -0.12 -0.29 0.00 0.00 0.00 0.00 60.65 60.40 1o1y s ILE 197 Cb -0.08 -3.05 0.02 0.00 0.01 0.00 0.00 42.46 39.35 1o1y s ILE 197 CO 0.80 0.41 1.23 -0.62 0.00 0.00 0.00 174.94 176.75 1o1y s ASP 198 N 0.88 6.63 0.38 3.58 -1.08 -1.26 -4.60 116.67 121.19 1o1y s ASP 198 Ca 0.03 0.82 0.16 0.00 -0.52 0.00 0.00 52.55 53.05 1o1y s ASP 198 Cb -0.14 -2.54 0.74 0.00 -1.46 0.00 0.00 42.92 39.52 1o1y s ASP 198 CO 0.02 -1.19 1.80 1.55 0.52 0.00 0.00 175.17 177.87 1o1y h PRO 199 N 9.37 0.00 -0.50 4.34 0.13 -1.97 -2.83 132.00 140.54 1o1y h PRO 199 Ca -0.24 0.00 0.03 0.00 -0.87 0.00 0.00 66.00 64.92 1o1y h PRO 199 Cb 1.08 0.00 -0.04 0.00 0.13 0.00 0.00 31.00 32.17 1o1y h PRO 199 CO 1.08 0.38 0.27 0.00 -0.23 0.00 0.00 178.00 179.50 1o1y h ARG 200 N 0.00 0.52 -0.29 0.86 -0.00 -2.00 -1.62 114.38 111.85 1o1y h ARG 200 Ca -0.00 -0.03 -0.19 0.00 -0.50 0.00 0.00 59.98 59.26 1o1y h ARG 200 Cb 0.76 -0.12 0.00 0.00 0.00 0.00 0.00 29.97 30.61 1o1y h ARG 200 CO 0.05 0.35 -0.54 -0.07 0.00 0.00 0.00 179.97 179.75 1o1y h LEU 201 N 0.54 0.97 -0.84 3.04 3.38 -1.93 -0.92 115.31 119.55 1o1y h LEU 201 Ca 0.21 -0.52 0.13 0.00 0.09 0.00 0.00 57.88 57.79 1o1y h LEU 201 Cb 0.08 -0.28 -0.09 0.00 0.09 0.00 0.00 40.66 40.46 1o1y h LEU 201 CO -0.12 1.32 0.45 -0.07 0.09 0.00 0.00 178.44 180.10 1o1y h LEU 202 N 0.67 0.58 -0.10 1.67 3.38 -1.28 -1.15 115.31 119.08 1o1y h LEU 202 Ca 0.02 0.08 -0.18 0.00 0.09 0.00 0.00 57.88 57.88 1o1y h LEU 202 Cb 1.15 -0.02 0.01 0.00 0.09 0.00 0.00 40.66 41.89 1o1y h LEU 202 CO 0.12 0.27 -0.65 0.25 0.09 0.00 0.00 178.44 178.52 1o1y h LEU 203 N 0.68 0.74 -0.68 1.67 5.85 -1.05 -1.61 115.31 120.91 1o1y h LEU 203 Ca 0.44 -0.66 -0.02 0.00 0.84 0.00 0.00 57.88 58.48 1o1y h LEU 203 Cb 0.56 -0.22 -0.03 0.00 0.37 0.00 0.00 40.66 41.34 1o1y h LEU 203 CO -0.33 1.29 0.36 -0.33 -0.34 0.00 0.00 178.44 179.09 1o1y h GLU 204 N 0.25 0.97 -0.66 1.25 5.08 -1.02 -0.69 114.58 119.75 1o1y h GLU 204 Ca -0.05 -0.12 -0.08 0.00 -1.00 0.00 0.00 59.36 58.10 1o1y h GLU 204 Cb 1.30 -0.18 -0.03 0.00 0.50 0.00 0.00 28.75 30.34 1o1y h GLU 204 CO 0.13 0.74 0.09 1.15 -1.00 0.00 0.00 179.01 180.13 1o1y h THR 205 N 0.94 1.26 -0.63 1.13 2.02 -1.22 -1.97 112.91 114.45 1o1y h THR 205 Ca 0.24 -1.06 0.06 0.00 0.77 0.00 0.00 66.41 66.42 1o1y h THR 205 Cb 0.07 0.66 -0.05 0.00 -1.74 0.00 0.00 68.15 67.08 1o1y h THR 205 CO -0.04 0.40 0.35 0.00 0.37 0.00 0.00 175.52 176.60 1o1y h ALA 206 N 1.04 0.84 -0.83 6.16 0.00 -0.64 -0.10 119.26 125.73 1o1y h ALA 206 Ca 0.20 0.02 -0.02 0.00 0.00 0.00 0.00 54.91 55.11 1o1y h ALA 206 Cb 0.46 -0.11 -0.04 0.00 0.00 0.00 0.00 17.79 18.10 1o1y h ALA 206 CO 0.02 0.02 0.45 0.93 0.00 0.00 0.00 179.25 180.67 1o1y h GLU 207 N 0.65 1.15 -0.05 0.00 5.08 -0.82 -0.70 114.58 119.89 1o1y h GLU 207 Ca 0.28 -0.13 -0.17 0.00 -1.00 0.00 0.00 59.36 58.34 1o1y h GLU 207 Cb 0.17 -0.23 -0.01 0.00 0.50 0.00 0.00 28.75 29.19 1o1y h GLU 207 CO -0.18 0.85 -0.73 -0.09 -1.00 0.00 0.00 179.01 177.86 1o1y h ARG 208 N 1.16 0.27 0.00 2.33 2.43 -0.63 -3.32 114.38 116.62 1o1y h ARG 208 Ca 0.29 -0.22 0.00 0.00 -0.81 0.00 0.00 59.98 59.24 1o1y h ARG 208 Cb 0.03 0.05 0.00 0.00 -0.42 0.00 0.00 29.97 29.63 1o1y h ARG 208 CO -0.05 0.88 -1.22 0.39 -1.51 0.00 0.00 179.97 178.46 1o1y n GLU 209 N -3.79 0.48 -0.11 0.20 -0.58 -0.12 -4.61 120.64 112.11 1o1y n GLU 209 Ca -0.03 0.00 -0.01 0.00 -0.42 0.00 0.00 57.16 56.70 1o1y n GLU 209 Cb 0.70 -1.66 0.24 0.00 -0.57 0.00 0.00 31.44 30.15 1o1y n GLU 209 CO 0.00 0.00 0.00 1.05 -0.48 0.00 0.00 177.13 177.70 1o1y h GLU 210 N 0.00 0.77 -0.26 3.49 4.11 -1.23 -1.33 114.58 120.13 1o1y h GLU 210 Ca 0.00 -0.13 -0.04 0.00 0.07 0.00 0.00 59.36 59.26 1o1y h GLU 210 Cb 0.89 -0.13 -0.01 0.00 0.50 0.00 0.00 28.75 30.00 1o1y h GLU 210 CO 0.00 0.66 -0.00 -0.22 0.07 0.00 0.00 179.01 179.52 1o1y h LYS 211 N 0.75 0.46 -0.38 1.06 3.64 -1.82 0.58 116.57 120.86 1o1y h LYS 211 Ca 0.17 -0.15 -0.03 0.00 -1.27 0.00 0.00 60.65 59.38 1o1y h LYS 211 Cb 0.21 -0.04 -0.02 0.00 -0.41 0.00 0.00 32.23 31.98 1o1y h LYS 211 CO -0.01 0.63 0.13 0.28 -2.27 0.00 0.00 179.45 178.21 1o1y h VAL 212 N 0.23 1.21 -0.54 2.00 2.07 -1.81 -2.02 116.25 117.39 1o1y h VAL 212 Ca 0.07 -0.66 -0.08 0.00 0.82 0.00 0.00 66.70 66.85 1o1y h VAL 212 Cb 0.42 0.93 -0.02 0.00 -1.52 0.00 0.00 31.29 31.11 1o1y h VAL 212 CO 0.01 0.23 0.03 -0.07 0.02 0.00 0.00 177.57 177.79 1o1y h LEU 213 N 0.46 0.91 -0.86 2.57 3.38 -1.18 -2.08 115.31 118.51 1o1y h LEU 213 Ca 0.12 -0.29 -0.01 0.00 0.09 0.00 0.00 57.88 57.79 1o1y h LEU 213 Cb 0.23 -0.24 -0.04 0.00 0.09 0.00 0.00 40.66 40.70 1o1y h LEU 213 CO -0.01 0.98 0.49 0.50 0.09 0.00 0.00 178.44 180.49 1o1y h LYS 214 N 0.81 1.18 -0.58 1.13 3.64 -0.75 -0.65 116.57 121.34 1o1y h LYS 214 Ca 0.16 -0.12 -0.02 0.00 -1.27 0.00 0.00 60.65 59.39 1o1y h LYS 214 Cb 0.50 -0.24 -0.03 0.00 -0.41 0.00 0.00 32.23 32.05 1o1y h LYS 214 CO 0.02 0.85 0.28 0.78 -2.27 0.00 0.00 179.45 179.11 1o1y h GLY 215 N 1.19 0.90 1.06 5.01 0.00 -1.05 -0.70 103.07 109.48 1o1y h GLY 215 Ca 0.30 -0.45 -0.09 0.00 0.00 0.00 0.00 47.33 47.10 1o1y h GLY 215 CO -0.05 0.43 0.05 1.41 0.00 0.00 0.00 176.54 178.38 1o1y h LEU 216 N 0.80 1.02 -0.53 3.11 3.38 -1.02 -2.04 115.31 120.03 1o1y h LEU 216 Ca 0.20 -0.28 -0.02 0.00 0.09 0.00 0.00 57.88 57.87 1o1y h LEU 216 Cb 0.12 -0.27 -0.02 0.00 0.09 0.00 0.00 40.66 40.58 1o1y h LEU 216 CO -0.02 1.05 0.25 0.25 0.09 0.00 0.00 178.44 180.05 1o1y h LEU 217 N 0.96 0.70 -0.56 1.67 5.85 -0.97 0.20 115.31 123.16 1o1y h LEU 217 Ca 0.18 -0.14 0.04 0.00 0.84 0.00 0.00 57.88 58.80 1o1y h LEU 217 Cb 0.49 -0.18 -0.04 0.00 0.37 0.00 0.00 40.66 41.30 1o1y h LEU 217 CO 0.02 0.64 0.32 0.03 -0.34 0.00 0.00 178.44 179.11 1o1y h ARG 218 N 0.70 0.60 0.00 1.25 3.08 -1.00 -0.63 114.38 118.38 1o1y h ARG 218 Ca 0.18 -0.04 -0.00 0.00 0.07 0.00 0.00 59.98 60.19 1o1y h ARG 218 Cb 0.13 -0.13 0.00 0.00 0.08 0.00 0.00 29.97 30.05 1o1y h ARG 218 CO -0.02 0.39 -0.00 1.03 -1.07 0.00 0.00 179.97 180.30 1o1y h SER 219 N 0.61 -0.00 -0.26 7.04 0.87 -0.74 -0.42 113.55 120.65 1o1y h SER 219 Ca 0.24 -0.11 0.06 0.00 -1.23 0.00 0.00 61.79 60.75 1o1y h SER 219 Cb 0.09 0.00 -0.07 0.00 -0.44 0.00 0.00 62.40 61.98 1o1y h SER 219 CO -0.13 0.11 -0.17 0.25 -0.53 0.00 0.00 176.83 176.36 1o1y h LEU 220 N -0.11 -0.54 -0.57 2.23 5.85 -0.75 -1.89 115.31 119.53 1o1y h LEU 220 Ca -0.00 0.12 -0.05 0.00 0.84 0.00 0.00 57.88 58.79 1o1y h LEU 220 Cb 0.11 0.28 -0.02 0.00 0.37 0.00 0.00 40.66 41.40 1o1y h LEU 220 CO 0.00 -0.20 0.17 -0.07 -0.34 0.00 0.00 178.44 177.99 1o1y h LEU 221 N -0.14 0.83 -0.70 2.25 3.38 -0.91 -2.64 115.31 117.38 1o1y h LEU 221 Ca 0.14 -0.21 -0.01 0.00 0.09 0.00 0.00 57.88 57.89 1o1y h LEU 221 Cb 0.36 -0.22 -0.03 0.00 0.09 0.00 0.00 40.66 40.86 1o1y h LEU 221 CO -0.35 0.83 0.39 -0.33 0.09 0.00 0.00 178.44 179.07 1o1y h GLU 222 N 0.80 0.97 -1.61 1.13 5.08 -0.97 -2.28 114.58 117.70 1o1y h GLU 222 Ca 0.18 -0.11 0.00 0.00 -1.00 0.00 0.00 59.36 58.43 1o1y h GLU 222 Cb 0.30 -0.19 0.00 0.00 0.50 0.00 0.00 28.75 29.36 1o1y h GLU 222 CO -0.00 0.72 0.00 0.54 -1.00 0.00 0.00 179.01 179.26 1o1y n ARG 223 N -4.51 0.43 0.00 2.33 1.74 -0.72 -1.99 116.66 113.95 1o1y n ARG 223 Ca 0.06 0.00 0.00 0.00 -0.77 0.00 0.00 57.85 57.14 1o1y n ARG 223 Cb 0.08 -1.28 0.00 0.00 -1.02 0.00 0.00 32.46 30.24 1o1y n ARG 223 CO 0.00 0.00 0.00 1.33 -1.52 0.00 0.00 177.63 177.44 1o1y n VAL 225 N 0.88 0.00 -1.76 1.55 0.24 -0.86 -4.93 118.33 113.45 1o1y n VAL 225 Ca 0.00 0.00 -0.42 0.00 -2.04 0.00 0.00 64.34 61.88 1o1y n VAL 225 Cb 0.22 0.00 -0.02 0.00 -1.47 0.00 0.00 33.84 32.57 1o1y n VAL 225 CO 0.00 0.00 0.00 -0.70 -2.14 0.00 0.00 176.83 173.99 1o1y s GLU 226 N 0.00 4.11 0.00 7.34 2.12 -0.84 -5.09 118.70 126.34 1o1y s GLU 226 Ca 0.00 2.60 0.05 0.00 0.36 0.00 0.00 54.97 57.98 1o1y s GLU 226 Cb 0.00 -3.02 0.04 0.00 0.26 0.00 0.00 34.13 31.41 1o1y s GLU 226 CO 0.00 -0.65 0.67 -1.13 -0.54 0.00 0.00 175.26 173.61