#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3cpw s ARG 2 N 0.00 0.39 0.06 -0.52 3.52 -1.26 -0.95 118.95 120.19 3cpw s ARG 2 Ca 0.00 0.81 0.08 0.00 -0.13 0.00 0.00 55.73 56.49 3cpw s ARG 2 Cb 0.00 -0.00 -0.03 0.00 -1.56 0.00 0.00 34.95 33.36 3cpw s ARG 2 CO 0.00 -0.16 -0.23 0.14 -0.81 0.00 0.00 175.30 174.23 3cpw s VAL 3 N 1.48 1.90 -0.12 7.11 -7.23 -0.28 -5.01 120.40 118.25 3cpw s VAL 3 Ca -0.09 -1.35 0.02 0.00 -1.81 0.00 0.00 61.98 58.75 3cpw s VAL 3 Cb -0.09 -1.65 0.01 0.00 0.56 0.00 0.00 36.38 35.22 3cpw s VAL 3 CO -0.13 0.24 -0.16 -1.61 -0.31 0.00 0.00 175.10 173.12 3cpw s GLU 4 N -1.33 2.38 -0.31 4.82 2.02 -1.26 -2.13 118.70 122.90 3cpw s GLU 4 Ca 0.10 -0.62 -0.06 0.00 0.02 0.00 0.00 54.97 54.41 3cpw s GLU 4 Cb -0.09 -2.02 0.02 0.00 0.10 0.00 0.00 34.13 32.14 3cpw s GLU 4 CO 0.02 -0.07 0.07 -0.51 0.02 0.00 0.00 175.26 174.79 3cpw s LEU 5 N 1.01 3.95 -0.16 1.80 1.43 -0.14 -4.95 118.68 121.62 3cpw s LEU 5 Ca -0.05 -0.89 -0.29 0.00 -1.03 0.00 0.00 54.13 51.86 3cpw s LEU 5 Cb -0.15 -1.85 -0.02 0.00 0.03 0.00 0.00 46.19 44.20 3cpw s LEU 5 CO -0.03 -0.24 1.29 -1.61 0.23 0.00 0.00 176.35 176.00 3cpw s GLU 6 N 1.44 4.22 0.25 1.70 2.02 -1.26 -0.37 118.70 126.70 3cpw s GLU 6 Ca 0.01 1.68 -0.30 0.00 0.02 0.00 0.00 54.97 56.38 3cpw s GLU 6 Cb -0.18 -3.79 -0.09 0.00 0.10 0.00 0.00 34.13 30.17 3cpw s GLU 6 CO 0.02 -0.73 1.07 -1.50 0.02 0.00 0.00 175.26 174.14 3cpw s ILE 7 N 3.57 3.66 0.53 -1.63 2.07 -0.70 -4.96 121.20 123.74 3cpw s ILE 7 Ca 0.56 1.62 -0.21 0.00 -1.41 0.00 0.00 60.65 61.20 3cpw s ILE 7 Cb -0.22 -4.03 -0.06 0.00 0.13 0.00 0.00 42.46 38.27 3cpw s ILE 7 CO 0.16 0.37 1.15 -2.65 -1.91 0.00 0.00 174.94 172.06 3cpw n PRO 8 N 1.47 1.38 0.24 3.50 -0.02 -1.26 -4.90 135.00 135.41 3cpw n PRO 8 Ca -0.01 0.51 0.07 0.00 -2.02 0.00 0.00 63.50 62.05 3cpw n PRO 8 Cb 0.45 -2.32 0.56 0.00 -0.02 0.00 0.00 33.50 32.17 3cpw n PRO 8 CO 0.00 0.00 0.00 1.05 1.98 0.00 0.00 175.50 178.53 3cpw h GLU 9 N 1.18 0.00 0.00 -0.52 4.11 -1.99 -1.05 114.58 116.31 3cpw h GLU 9 Ca -0.49 0.00 -0.02 0.00 0.07 0.00 0.00 59.36 58.92 3cpw h GLU 9 Cb 1.33 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 30.58 3cpw h GLU 9 CO 0.55 0.15 -0.09 0.22 0.07 0.00 0.00 179.01 179.91 3cpw h ASP 10 N 0.00 0.00 -1.97 3.06 1.82 -1.98 -3.45 116.42 113.90 3cpw h ASP 10 Ca -0.00 0.00 -0.53 0.00 -0.39 0.00 0.00 57.03 56.11 3cpw h ASP 10 Cb 0.28 0.00 -0.06 0.00 0.68 0.00 0.00 39.33 40.23 3cpw h ASP 10 CO 0.02 0.09 -0.53 -0.69 -1.61 0.00 0.00 179.24 176.52 3cpw s VAL 11 N -3.77 3.47 -0.04 2.25 1.01 -0.40 -4.48 120.40 118.45 3cpw s VAL 11 Ca 0.00 -1.59 -0.01 0.00 0.00 0.00 0.00 61.98 60.38 3cpw s VAL 11 Cb 0.10 -3.09 0.03 0.00 0.00 0.00 0.00 36.38 33.43 3cpw s VAL 11 CO 0.57 -0.24 0.04 -1.81 0.00 0.00 0.00 175.10 173.67 3cpw s ASP 12 N -3.86 0.85 -0.20 3.32 1.01 -0.88 -4.75 116.67 112.16 3cpw s ASP 12 Ca 0.37 0.05 -0.01 0.00 0.71 0.00 0.00 52.55 53.67 3cpw s ASP 12 Cb -0.05 -0.15 0.00 0.00 1.01 0.00 0.00 42.92 43.74 3cpw s ASP 12 CO 0.24 -0.21 -0.12 0.00 0.21 0.00 0.00 175.17 175.29 3cpw s ALA 13 N 1.80 2.58 0.08 5.23 0.00 -1.26 -1.88 121.76 128.31 3cpw s ALA 13 Ca 0.00 -1.18 0.09 0.00 0.00 0.00 0.00 51.96 50.88 3cpw s ALA 13 Cb -0.12 -1.43 -0.04 0.00 0.00 0.00 0.00 23.12 21.53 3cpw s ALA 13 CO -0.03 -0.36 -0.22 -2.00 0.00 0.00 0.00 175.76 173.15 3cpw s GLU 14 N 1.33 1.78 -0.20 0.00 2.12 -0.22 -4.90 118.70 118.62 3cpw s GLU 14 Ca 0.04 -1.15 -0.09 0.00 0.36 0.00 0.00 54.97 54.14 3cpw s GLU 14 Cb -0.14 -2.06 0.08 0.00 0.26 0.00 0.00 34.13 32.27 3cpw s GLU 14 CO -0.07 0.50 0.45 -1.14 -0.54 0.00 0.00 175.26 174.46 3cpw s GLN 15 N -1.72 0.40 -0.11 4.30 -0.44 -1.26 0.26 119.66 121.09 3cpw s GLN 15 Ca 0.15 0.96 0.02 0.00 -2.50 0.00 0.00 55.36 53.99 3cpw s GLN 15 Cb -0.10 0.18 0.01 0.00 -1.64 0.00 0.00 33.01 31.46 3cpw s GLN 15 CO 0.06 -0.20 -0.17 0.16 0.50 0.00 0.00 175.29 175.64 3cpw s ASP 16 N 1.98 2.58 1.49 6.67 -4.77 -0.90 -4.87 116.67 118.85 3cpw s ASP 16 Ca -0.06 -0.46 0.00 0.00 -3.30 0.00 0.00 52.55 48.72 3cpw s ASP 16 Cb -0.10 -1.17 0.00 0.00 -1.09 0.00 0.00 42.92 40.57 3cpw s ASP 16 CO -0.14 0.04 0.00 1.41 0.70 0.00 0.00 175.17 177.18 3cpw n HIS 17 N 4.09 0.00 -0.16 2.11 8.25 -1.26 -2.69 115.22 125.55 3cpw n HIS 17 Ca -0.19 0.00 0.12 0.00 -0.26 0.00 0.00 57.72 57.38 3cpw n HIS 17 Cb 0.51 0.00 0.30 0.00 1.12 0.00 0.00 29.99 31.92 3cpw n HIS 17 CO 0.00 0.00 0.00 1.28 0.64 0.00 0.00 176.34 178.26 3cpw n LEU 18 N 0.00 3.80 -4.44 2.41 4.77 -1.26 -4.91 117.00 117.37 3cpw n LEU 18 Ca 0.00 -1.84 -0.33 0.00 -0.03 0.00 0.00 56.01 53.81 3cpw n LEU 18 Cb 0.00 -0.43 -0.13 0.00 -2.33 0.00 0.00 43.42 40.53 3cpw n LEU 18 CO 0.00 0.92 -0.40 -1.81 -1.33 0.00 0.00 177.39 174.77 3cpw s ASP 19 N -1.13 4.43 -0.08 -1.43 1.01 -1.10 -1.45 116.67 116.93 3cpw s ASP 19 Ca 0.46 -0.22 0.02 0.00 0.71 0.00 0.00 52.55 53.52 3cpw s ASP 19 Cb 0.25 -1.70 -0.02 0.00 1.01 0.00 0.00 42.92 42.45 3cpw s ASP 19 CO 0.33 0.17 -0.13 -0.63 0.21 0.00 0.00 175.17 175.11 3cpw s ILE 20 N 0.37 3.12 -0.09 0.77 1.01 -0.20 -2.11 121.20 124.07 3cpw s ILE 20 Ca -0.07 -0.68 0.03 0.00 0.00 0.00 0.00 60.65 59.93 3cpw s ILE 20 Cb -0.15 -2.26 0.01 0.00 0.01 0.00 0.00 42.46 40.07 3cpw s ILE 20 CO 0.04 0.57 -0.18 -0.89 0.00 0.00 0.00 174.94 174.48 3cpw s THR 21 N -0.37 1.65 -0.14 2.92 2.01 0.14 -0.98 115.64 120.87 3cpw s THR 21 Ca 0.04 -0.77 0.02 0.00 0.31 0.00 0.00 61.69 61.29 3cpw s THR 21 Cb -0.12 -1.46 0.01 0.00 0.01 0.00 0.00 72.50 70.93 3cpw s THR 21 CO 0.02 0.47 -0.20 -0.69 -0.69 0.00 0.00 174.62 173.53 3cpw s VAL 22 N 0.60 2.23 -0.02 3.82 1.01 0.26 -1.06 120.40 127.25 3cpw s VAL 22 Ca -0.14 -0.93 0.07 0.00 0.00 0.00 0.00 61.98 60.98 3cpw s VAL 22 Cb -0.17 -1.90 -0.02 0.00 0.00 0.00 0.00 36.38 34.30 3cpw s VAL 22 CO 0.05 0.54 -0.24 -1.61 0.00 0.00 0.00 175.10 173.84 3cpw s GLU 23 N 0.75 1.94 0.00 2.72 2.02 -0.79 -0.42 118.70 124.93 3cpw s GLU 23 Ca -0.08 -0.85 0.00 0.00 0.02 0.00 0.00 54.97 54.06 3cpw s GLU 23 Cb -0.16 -1.87 0.00 0.00 0.10 0.00 0.00 34.13 32.20 3cpw s GLU 23 CO -0.00 0.51 0.00 0.41 0.02 0.00 0.00 175.26 176.19 3cpw n GLY 24 N 2.51 3.88 0.26 -1.39 0.00 0.55 -2.07 105.19 108.93 3cpw n GLY 24 Ca -0.16 -1.37 0.15 0.00 0.00 0.00 0.00 46.02 44.64 3cpw n GLY 24 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 3cpw h ASP 25 N 0.00 0.00 0.23 1.61 3.32 -1.63 -3.01 116.42 116.94 3cpw h ASP 25 Ca 0.00 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.05 3cpw h ASP 25 Cb 0.00 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.55 3cpw h ASP 25 CO 0.00 0.02 -0.29 -3.20 -1.72 0.00 0.00 179.24 174.05 3cpw n ASN 26 N -3.12 1.08 0.00 6.45 5.15 0.12 -5.03 115.26 119.92 3cpw n ASN 26 Ca 0.01 -0.91 0.00 0.00 -0.60 0.00 0.00 54.58 53.08 3cpw n ASN 26 Cb 0.38 0.17 0.00 0.00 -0.53 0.00 0.00 39.78 39.80 3cpw n ASN 26 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 3cpw n GLY 27 N 1.35 0.86 3.05 8.20 0.00 -1.14 -4.69 105.19 112.83 3cpw n GLY 27 Ca 0.12 -1.92 -0.10 0.00 0.00 0.00 0.00 46.02 44.11 3cpw n GLY 27 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 3cpw s SER 28 N -4.00 0.58 -0.02 1.61 1.04 -1.26 -0.33 113.70 111.32 3cpw s SER 28 Ca 0.00 -0.69 -0.00 0.00 0.48 0.00 0.00 55.95 55.74 3cpw s SER 28 Cb 0.00 0.10 0.03 0.00 0.10 0.00 0.00 66.02 66.25 3cpw s SER 28 CO 0.00 -0.36 0.03 -0.69 0.98 0.00 0.00 173.24 173.20 3cpw s VAL 29 N -2.26 -0.05 -0.07 5.02 1.01 0.44 -4.84 120.40 119.65 3cpw s VAL 29 Ca -0.06 0.19 0.04 0.00 0.00 0.00 0.00 61.98 62.16 3cpw s VAL 29 Cb -0.04 -0.07 -0.01 0.00 0.00 0.00 0.00 36.38 36.25 3cpw s VAL 29 CO -0.03 0.08 -0.22 -0.89 0.00 0.00 0.00 175.10 174.04 3cpw s THR 30 N 0.93 2.35 0.14 3.92 2.01 -1.26 -0.57 115.64 123.16 3cpw s THR 30 Ca -0.08 -0.95 0.02 0.00 0.31 0.00 0.00 61.69 60.99 3cpw s THR 30 Cb -0.11 -1.89 -0.04 0.00 0.01 0.00 0.00 72.50 70.46 3cpw s THR 30 CO -0.03 0.56 -0.03 -0.13 -0.69 0.00 0.00 174.62 174.31 3cpw s ARG 31 N -0.09 0.97 -0.21 4.92 0.52 -0.15 -4.97 118.95 119.94 3cpw s ARG 31 Ca -0.05 -1.43 -0.04 0.00 -0.52 0.00 0.00 55.73 53.68 3cpw s ARG 31 Cb -0.14 -0.23 -0.02 0.00 0.52 0.00 0.00 34.95 35.08 3cpw s ARG 31 CO 0.04 -0.07 -0.02 0.50 0.02 0.00 0.00 175.30 175.77 3cpw s ARG 32 N -3.88 3.48 -0.55 3.54 3.52 -1.26 -1.04 118.95 122.77 3cpw s ARG 32 Ca 0.18 -0.58 0.02 0.00 -0.13 0.00 0.00 55.73 55.22 3cpw s ARG 32 Cb 0.06 -3.05 0.14 0.00 -1.56 0.00 0.00 34.95 30.54 3cpw s ARG 32 CO -0.00 -0.11 0.30 -0.51 -0.81 0.00 0.00 175.30 174.17 3cpw s LEU 33 N 1.29 4.53 -0.21 -0.88 1.43 -0.53 -5.02 118.68 119.29 3cpw s LEU 33 Ca 0.04 -2.98 0.01 0.00 -1.03 0.00 0.00 54.13 50.16 3cpw s LEU 33 Cb -0.14 -1.69 0.03 0.00 0.03 0.00 0.00 46.19 44.41 3cpw s LEU 33 CO -0.00 -0.26 -0.15 0.86 0.23 0.00 0.00 176.35 177.02 3cpw s TRP 34 N -0.25 2.94 -0.11 0.29 -0.00 -1.26 -4.89 118.94 115.66 3cpw s TRP 34 Ca 0.17 -1.75 -0.19 0.00 -0.00 0.00 0.00 56.10 54.32 3cpw s TRP 34 Cb -0.25 -1.95 0.04 0.00 -0.00 0.00 0.00 33.47 31.32 3cpw s TRP 34 CO -0.01 -0.80 0.47 -0.47 -0.00 0.00 0.00 176.95 176.14 3cpw s TYR 35 N 1.26 -0.45 -0.10 5.86 5.04 -1.26 -5.12 117.35 122.58 3cpw s TYR 35 Ca 0.01 0.96 -0.37 0.00 -2.44 0.00 0.00 57.07 55.23 3cpw s TYR 35 Cb -0.15 0.20 -0.14 0.00 0.35 0.00 0.00 41.96 42.22 3cpw s TYR 35 CO -0.09 -0.37 1.70 -2.30 -1.34 0.00 0.00 175.55 173.15 3cpw n PRO 36 N 1.97 1.61 -2.77 4.97 -0.02 -1.26 -2.55 135.00 136.96 3cpw n PRO 36 Ca -0.17 0.59 -0.21 0.00 -2.02 0.00 0.00 63.50 61.69 3cpw n PRO 36 Cb 0.56 -2.33 0.01 0.00 -0.02 0.00 0.00 33.50 31.73 3cpw n PRO 36 CO 0.00 0.00 0.00 -0.25 1.98 0.00 0.00 175.50 177.23 3cpw n ASP 37 N 5.05 -5.48 -4.13 2.55 8.00 -1.26 -4.99 116.55 116.30 3cpw n ASP 37 Ca 0.23 -0.14 -0.33 0.00 0.71 0.00 0.00 54.79 55.26 3cpw n ASP 37 Cb 0.21 -4.51 -0.15 0.00 -0.02 0.00 0.00 41.12 36.65 3cpw n ASP 37 CO 0.00 0.00 0.00 -0.63 -0.39 0.00 0.00 177.20 176.18 3cpw s ILE 38 N -3.03 2.39 -0.23 0.53 1.01 -1.06 -4.24 121.20 116.58 3cpw s ILE 38 Ca 0.17 -1.26 -0.11 0.00 0.00 0.00 0.00 60.65 59.45 3cpw s ILE 38 Cb -0.08 -2.24 -0.05 0.00 0.01 0.00 0.00 42.46 40.10 3cpw s ILE 38 CO 0.21 0.19 0.16 -1.81 0.00 0.00 0.00 174.94 173.69 3cpw s ASP 39 N 1.22 6.15 -0.15 3.58 1.01 0.44 -4.68 116.67 124.24 3cpw s ASP 39 Ca -0.02 0.15 -0.02 0.00 0.71 0.00 0.00 52.55 53.37 3cpw s ASP 39 Cb -0.17 -2.11 -0.02 0.00 1.01 0.00 0.00 42.92 41.63 3cpw s ASP 39 CO -0.07 0.08 -0.09 -0.69 0.21 0.00 0.00 175.17 174.61 3cpw s VAL 40 N 0.92 3.30 0.09 -1.27 1.01 -1.26 -1.44 120.40 121.76 3cpw s VAL 40 Ca 0.08 -0.56 -0.11 0.00 0.00 0.00 0.00 61.98 61.39 3cpw s VAL 40 Cb -0.13 -2.42 0.01 0.00 0.00 0.00 0.00 36.38 33.84 3cpw s VAL 40 CO 0.03 0.50 0.25 -0.94 0.00 0.00 0.00 175.10 174.95 3cpw s SER 41 N 0.53 0.01 -0.47 3.32 1.04 0.24 -4.97 113.70 113.39 3cpw s SER 41 Ca -0.07 -0.52 -0.12 0.00 0.48 0.00 0.00 55.95 55.72 3cpw s SER 41 Cb -0.15 0.37 0.10 0.00 0.10 0.00 0.00 66.02 66.44 3cpw s SER 41 CO 0.03 -0.75 0.36 -0.69 0.98 0.00 0.00 173.24 173.18 3cpw s VAL 42 N -3.72 4.69 -1.18 5.02 1.01 -1.26 0.12 120.40 125.07 3cpw s VAL 42 Ca 0.03 -1.41 -0.08 0.00 0.00 0.00 0.00 61.98 60.52 3cpw s VAL 42 Cb 0.04 -3.92 0.23 0.00 0.00 0.00 0.00 36.38 32.72 3cpw s VAL 42 CO -0.11 -0.66 1.60 -0.67 0.00 0.00 0.00 175.10 175.27 3cpw n ASP 43 N 5.06 5.66 0.00 3.32 2.03 0.19 -4.93 116.55 127.87 3cpw n ASP 43 Ca -0.11 -3.20 0.00 0.00 0.52 0.00 0.00 54.79 52.00 3cpw n ASP 43 Cb 0.42 -1.40 0.00 0.00 -0.72 0.00 0.00 41.12 39.42 3cpw n ASP 43 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 3cpw n GLY 44 N 2.38 1.22 0.75 0.27 0.00 -1.26 -2.73 105.19 105.81 3cpw n GLY 44 Ca 0.33 0.32 0.12 0.00 0.00 0.00 0.00 46.02 46.79 3cpw n GLY 44 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 3cpw n ASP 45 N 5.16 2.49 -3.98 1.61 5.75 -1.26 -4.96 116.55 121.35 3cpw n ASP 45 Ca 0.00 -1.77 -0.09 0.00 -0.01 0.00 0.00 54.79 52.92 3cpw n ASP 45 Cb 0.00 0.13 -0.11 0.00 -1.03 0.00 0.00 41.12 40.11 3cpw n ASP 45 CO 0.00 0.00 0.00 0.42 -0.11 0.00 0.00 177.20 177.51 3cpw s THR 46 N -2.15 0.11 -0.10 2.12 -4.23 -1.11 -1.73 115.64 108.57 3cpw s THR 46 Ca 0.27 -0.92 -0.11 0.00 -1.18 0.00 0.00 61.69 59.74 3cpw s THR 46 Cb 0.20 -0.27 -0.05 0.00 1.34 0.00 0.00 72.50 73.72 3cpw s THR 46 CO 0.38 -0.50 0.26 -0.69 -0.54 0.00 0.00 174.62 173.54 3cpw s VAL 47 N -1.48 5.30 -0.11 2.29 1.01 0.50 0.54 120.40 128.45 3cpw s VAL 47 Ca -0.16 0.50 0.03 0.00 0.00 0.00 0.00 61.98 62.35 3cpw s VAL 47 Cb -0.10 -3.56 -0.00 0.00 0.00 0.00 0.00 36.38 32.72 3cpw s VAL 47 CO -0.01 0.54 -0.22 -0.69 0.00 0.00 0.00 175.10 174.72 3cpw s VAL 48 N -0.60 2.25 -0.26 2.92 1.01 0.33 -0.97 120.40 125.08 3cpw s VAL 48 Ca 0.18 -0.95 0.01 0.00 0.00 0.00 0.00 61.98 61.22 3cpw s VAL 48 Cb -0.14 -1.88 0.05 0.00 0.00 0.00 0.00 36.38 34.41 3cpw s VAL 48 CO 0.07 0.55 -0.09 -0.63 0.00 0.00 0.00 175.10 175.00 3cpw s ILE 49 N 0.38 2.45 0.05 2.22 1.01 -0.90 -0.60 121.20 125.82 3cpw s ILE 49 Ca -0.17 -1.40 -0.03 0.00 0.00 0.00 0.00 60.65 59.05 3cpw s ILE 49 Cb -0.17 -2.36 -0.02 0.00 0.01 0.00 0.00 42.46 39.92 3cpw s ILE 49 CO 0.08 0.06 0.04 -1.83 0.00 0.00 0.00 174.94 173.29 3cpw s GLU 50 N 1.19 0.62 0.04 2.79 -1.05 -0.52 -1.13 118.70 120.64 3cpw s GLU 50 Ca -0.05 -0.99 -0.24 0.00 -0.15 0.00 0.00 54.97 53.54 3cpw s GLU 50 Cb -0.19 0.23 0.06 0.00 -0.44 0.00 0.00 34.13 33.79 3cpw s GLU 50 CO -0.05 -0.14 0.55 0.45 0.95 0.00 0.00 175.26 177.02 3cpw s SER 51 N -2.56 -0.48 0.15 0.83 0.15 -0.12 -0.42 113.70 111.24 3cpw s SER 51 Ca 0.01 0.24 0.25 0.00 0.70 0.00 0.00 55.95 57.16 3cpw s SER 51 Cb 0.03 0.51 0.54 0.00 -1.71 0.00 0.00 66.02 65.39 3cpw s SER 51 CO -0.08 -0.72 1.51 0.47 1.20 0.00 0.00 173.24 175.62 3cpw n ASP 52 N 0.42 0.73 -4.90 5.45 8.00 -1.26 -0.93 116.55 124.06 3cpw n ASP 52 Ca -0.18 0.30 -0.32 0.00 0.71 0.00 0.00 54.79 55.30 3cpw n ASP 52 Cb 0.60 -0.22 -0.05 0.00 -0.02 0.00 0.00 41.12 41.43 3cpw n ASP 52 CO 0.00 0.00 0.00 -1.61 -0.39 0.00 0.00 177.20 175.20 3cpw s GLU 53 N -3.13 3.60 -0.09 -1.24 2.02 -1.26 -4.68 118.70 113.91 3cpw s GLU 53 Ca 0.08 -0.13 0.14 0.00 0.02 0.00 0.00 54.97 55.08 3cpw s GLU 53 Cb 0.13 -2.89 0.27 0.00 0.10 0.00 0.00 34.13 31.75 3cpw s GLU 53 CO 0.67 0.50 1.13 -0.40 0.02 0.00 0.00 175.26 177.18 3cpw n ASP 54 N 0.17 1.28 -4.82 -0.19 5.75 -1.26 -4.23 116.55 113.25 3cpw n ASP 54 Ca -0.03 -2.75 -0.31 0.00 -0.01 0.00 0.00 54.79 51.69 3cpw n ASP 54 Cb 0.52 -0.36 0.03 0.00 -1.03 0.00 0.00 41.12 40.27 3cpw n ASP 54 CO 0.00 0.00 0.00 0.54 -0.11 0.00 0.00 177.20 177.63 3cpw s ASN 55 N -2.27 5.66 0.25 -1.12 2.20 -1.26 -4.76 114.94 113.64 3cpw s ASN 55 Ca 0.25 1.64 -0.04 0.00 -0.94 0.00 0.00 52.86 53.77 3cpw s ASN 55 Cb 0.25 -2.50 0.50 0.00 -2.00 0.00 0.00 41.25 37.50 3cpw s ASN 55 CO -0.05 -1.25 1.67 0.00 -2.94 0.00 0.00 177.10 174.53 3cpw h ALA 56 N -0.30 0.98 -0.44 3.54 0.00 -1.98 -0.07 119.26 120.99 3cpw h ALA 56 Ca -0.45 0.19 -0.02 0.00 0.00 0.00 0.00 54.91 54.64 3cpw h ALA 56 Cb 1.21 0.28 -0.02 0.00 0.00 0.00 0.00 17.79 19.25 3cpw h ALA 56 CO 0.58 -0.38 0.20 0.87 0.00 0.00 0.00 179.25 180.52 3cpw h LYS 57 N 0.23 0.61 0.01 0.00 1.57 -2.00 -0.88 116.57 116.10 3cpw h LYS 57 Ca 0.44 -0.07 -0.15 0.00 -1.87 0.00 0.00 60.65 59.00 3cpw h LYS 57 Cb 0.78 -0.12 0.01 0.00 0.08 0.00 0.00 32.23 32.98 3cpw h LYS 57 CO -0.56 0.48 -0.58 1.15 -0.57 0.00 0.00 179.45 179.37 3cpw h THR 58 N 0.61 1.45 -0.59 -0.16 2.02 -1.45 -3.14 112.91 111.65 3cpw h THR 58 Ca 0.15 -2.10 0.03 0.00 0.77 0.00 0.00 66.41 65.26 3cpw h THR 58 Cb 0.08 2.66 -0.03 0.00 -1.74 0.00 0.00 68.15 69.12 3cpw h THR 58 CO -0.02 0.61 0.39 0.24 0.37 0.00 0.00 175.52 177.11 3cpw h MET 59 N -0.17 0.69 0.04 6.66 2.86 -0.84 -1.78 114.93 122.39 3cpw h MET 59 Ca -0.07 -0.04 -0.00 0.00 -2.06 0.00 0.00 59.70 57.52 3cpw h MET 59 Cb 1.30 -0.15 0.00 0.00 0.06 0.00 0.00 31.60 32.81 3cpw h MET 59 CO 0.11 0.45 -0.02 0.77 1.06 0.00 0.00 176.91 179.29 3cpw h SER 60 N 0.71 -0.04 -0.16 1.22 0.02 -1.17 -2.46 113.55 111.67 3cpw h SER 60 Ca 0.23 -0.02 -0.08 0.00 -0.84 0.00 0.00 61.79 61.08 3cpw h SER 60 Cb 0.06 0.01 -0.02 0.00 0.14 0.00 0.00 62.40 62.59 3cpw h SER 60 CO -0.06 -0.01 -0.15 0.74 -1.14 0.00 0.00 176.83 176.21 3cpw h THR 61 N -0.07 1.24 0.22 -2.27 2.02 -1.41 -2.00 112.91 110.64 3cpw h THR 61 Ca -0.00 -1.11 -0.01 0.00 0.77 0.00 0.00 66.41 66.06 3cpw h THR 61 Cb 0.06 1.17 -0.00 0.00 -1.74 0.00 0.00 68.15 67.64 3cpw h THR 61 CO 0.01 0.36 -0.14 0.40 0.37 0.00 0.00 175.52 176.52 3cpw h ILE 62 N 0.50 0.70 0.00 3.11 2.04 -1.17 0.43 117.51 123.12 3cpw h ILE 62 Ca 0.09 0.00 -0.01 0.00 1.00 0.00 0.00 64.86 65.94 3cpw h ILE 62 Cb 0.55 0.70 -0.00 0.00 -0.74 0.00 0.00 36.82 37.33 3cpw h ILE 62 CO 0.04 0.00 -0.04 1.23 0.00 0.00 0.00 178.15 179.37 3cpw h GLY 63 N -0.36 0.00 1.20 5.37 0.00 -1.31 -0.65 103.07 107.32 3cpw h GLY 63 Ca -0.02 0.00 -0.26 0.00 0.00 0.00 0.00 47.33 47.05 3cpw h GLY 63 CO 0.02 0.00 -0.98 -0.84 0.00 0.00 0.00 176.54 174.74 3cpw h THR 64 N 0.00 1.28 -0.75 4.70 2.02 -0.49 -2.90 112.91 116.76 3cpw h THR 64 Ca -0.00 -2.17 -0.06 0.00 0.77 0.00 0.00 66.41 64.95 3cpw h THR 64 Cb 0.09 2.27 -0.03 0.00 -1.74 0.00 0.00 68.15 68.74 3cpw h THR 64 CO 0.01 0.68 0.25 -0.26 0.37 0.00 0.00 175.52 176.56 3cpw h PHE 65 N 0.44 1.19 0.48 3.16 0.05 0.72 -2.33 116.94 120.64 3cpw h PHE 65 Ca -0.11 -0.11 -0.02 0.00 3.82 0.00 0.00 57.97 61.55 3cpw h PHE 65 Cb 1.62 -0.35 -0.01 0.00 2.00 0.00 0.00 35.95 39.22 3cpw h PHE 65 CO 0.10 0.93 -0.36 0.37 -0.18 0.00 0.00 178.31 179.16 3cpw h GLN 66 N 1.11 -0.78 -0.36 1.51 4.15 -1.12 -1.60 115.11 118.03 3cpw h GLN 66 Ca 0.24 0.05 0.10 0.00 0.77 0.00 0.00 58.65 59.82 3cpw h GLN 66 Cb 0.28 0.18 -0.01 0.00 0.21 0.00 0.00 27.48 28.13 3cpw h GLN 66 CO -0.01 -0.52 0.27 0.77 -1.93 0.00 0.00 178.83 177.41 3cpw h SER 67 N -0.80 0.00 -0.12 -0.69 0.02 -1.50 0.42 113.55 110.86 3cpw h SER 67 Ca -0.06 0.00 -0.14 0.00 -0.84 0.00 0.00 61.79 60.74 3cpw h SER 67 Cb 0.67 0.00 -0.01 0.00 0.14 0.00 0.00 62.40 63.20 3cpw h SER 67 CO 0.02 0.00 -0.41 0.45 -1.14 0.00 0.00 176.83 175.75 3cpw h HIS 68 N 0.00 0.79 -0.00 3.45 3.86 -1.05 -1.34 115.15 120.86 3cpw h HIS 68 Ca 0.17 -0.24 -0.20 0.00 -1.16 0.00 0.00 60.37 58.95 3cpw h HIS 68 Cb 0.71 -0.17 0.02 0.00 1.06 0.00 0.00 27.41 29.03 3cpw h HIS 68 CO 0.00 0.96 -0.77 0.82 0.86 0.00 0.00 177.93 179.80 3cpw h ILE 69 N 0.54 1.37 -0.51 2.45 2.04 -0.00 -2.56 117.51 120.84 3cpw h ILE 69 Ca 0.04 -2.14 -0.05 0.00 1.00 0.00 0.00 64.86 63.72 3cpw h ILE 69 Cb 0.94 2.51 -0.02 0.00 -0.74 0.00 0.00 36.82 39.51 3cpw h ILE 69 CO 0.09 0.64 0.13 -0.33 0.00 0.00 0.00 178.15 178.67 3cpw h GLU 70 N 0.09 0.77 -0.21 2.37 5.08 -1.11 -0.73 114.58 120.84 3cpw h GLU 70 Ca -0.10 -0.15 -0.05 0.00 -1.00 0.00 0.00 59.36 58.06 3cpw h GLU 70 Cb 1.46 -0.12 -0.01 0.00 0.50 0.00 0.00 28.75 30.58 3cpw h GLU 70 CO 0.15 0.69 -0.10 -0.91 -1.00 0.00 0.00 179.01 177.84 3cpw h ASN 71 N 0.74 0.31 -0.17 1.42 2.35 -1.22 -0.16 115.58 118.85 3cpw h ASN 71 Ca 0.17 -0.06 -0.17 0.00 -0.55 0.00 0.00 56.30 55.68 3cpw h ASN 71 Cb 0.27 -0.08 -0.00 0.00 0.05 0.00 0.00 38.32 38.55 3cpw h ASN 71 CO -0.00 0.45 -0.53 0.24 -1.65 0.00 0.00 177.43 175.94 3cpw h MET 72 N 0.31 0.75 0.56 0.81 2.86 -0.80 0.16 114.93 119.59 3cpw h MET 72 Ca 0.06 -0.47 -0.03 0.00 -2.06 0.00 0.00 59.70 57.21 3cpw h MET 72 Cb 0.38 0.05 0.00 0.00 0.06 0.00 0.00 31.60 32.09 3cpw h MET 72 CO 0.02 1.09 -0.30 0.74 1.06 0.00 0.00 176.91 179.52 3cpw h PHE 73 N 0.58 -0.78 -0.83 -0.22 0.05 -0.42 -1.61 116.94 113.72 3cpw h PHE 73 Ca 0.02 -0.01 0.08 0.00 3.82 0.00 0.00 57.97 61.87 3cpw h PHE 73 Cb 1.11 0.27 -0.07 0.00 2.00 0.00 0.00 35.95 39.26 3cpw h PHE 73 CO 0.06 -0.47 0.50 1.25 -0.18 0.00 0.00 178.31 179.47 3cpw h HIS 74 N -0.80 0.91 -0.81 -0.55 2.76 -0.95 -2.58 115.15 113.14 3cpw h HIS 74 Ca -0.07 0.03 -0.03 0.00 -2.20 0.00 0.00 60.37 58.10 3cpw h HIS 74 Cb 0.63 -0.29 -0.04 0.00 1.55 0.00 0.00 27.41 29.26 3cpw h HIS 74 CO -0.06 0.42 0.40 0.78 -1.30 0.00 0.00 177.93 178.17 3cpw h GLY 75 N 0.87 1.23 1.92 5.26 0.00 -0.38 0.35 103.07 112.33 3cpw h GLY 75 Ca 0.38 -0.60 0.00 0.00 0.00 0.00 0.00 47.33 47.11 3cpw h GLY 75 CO -0.21 0.57 0.00 3.33 0.00 0.00 0.00 176.54 180.23 3cpw n VAL 76 N -4.32 0.18 0.00 4.60 0.24 -0.63 -2.77 118.33 115.63 3cpw n VAL 76 Ca 0.08 0.04 0.00 0.00 -2.04 0.00 0.00 64.34 62.42 3cpw n VAL 76 Cb 0.13 -0.59 0.00 0.00 -1.47 0.00 0.00 33.84 31.91 3cpw n VAL 76 CO 0.00 0.00 0.00 0.35 -2.14 0.00 0.00 176.83 175.04 3cpw n THR 77 N -1.46 0.00 0.17 3.34 -2.24 -1.04 0.14 114.28 113.19 3cpw n THR 77 Ca 0.08 0.00 0.02 0.00 -2.27 0.00 0.00 64.05 61.87 3cpw n THR 77 Cb 0.29 -0.55 0.30 0.00 -2.10 0.00 0.00 70.33 68.28 3cpw n THR 77 CO 0.00 0.00 0.00 -0.33 -0.57 0.00 0.00 175.07 174.17 3cpw h GLU 78 N 0.00 0.00 0.00 -0.78 5.08 -1.56 -3.41 114.58 113.91 3cpw h GLU 78 Ca 0.00 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.36 3cpw h GLU 78 Cb 0.00 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.25 3cpw h GLU 78 CO 0.00 0.44 0.00 0.41 -1.00 0.00 0.00 179.01 178.86 3cpw n GLY 79 N -0.22 -1.59 3.31 -3.84 0.00 0.03 -4.97 105.19 97.92 3cpw n GLY 79 Ca -0.02 -1.54 -0.31 0.00 0.00 0.00 0.00 46.02 44.16 3cpw n GLY 79 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 3cpw s TRP 80 N -1.65 2.33 -0.06 1.61 0.52 -0.12 -4.69 118.94 116.88 3cpw s TRP 80 Ca 0.00 -0.44 -0.03 0.00 0.02 0.00 0.00 56.10 55.65 3cpw s TRP 80 Cb 0.00 -1.49 0.04 0.00 -1.15 0.00 0.00 33.47 30.86 3cpw s TRP 80 CO 0.00 -0.03 0.14 -1.21 0.02 0.00 0.00 176.95 175.87 3cpw s GLU 81 N -0.65 0.09 -0.02 4.98 2.02 -1.26 -1.42 118.70 122.45 3cpw s GLU 81 Ca 0.10 0.35 0.05 0.00 0.02 0.00 0.00 54.97 55.49 3cpw s GLU 81 Cb -0.10 -0.16 -0.03 0.00 0.10 0.00 0.00 34.13 33.94 3cpw s GLU 81 CO -0.01 -0.15 -0.17 0.71 0.02 0.00 0.00 175.26 175.66 3cpw s TYR 82 N 1.07 2.62 -0.12 1.61 1.51 0.11 -3.74 117.35 120.41 3cpw s TYR 82 Ca -0.08 -0.22 -0.01 0.00 -1.01 0.00 0.00 57.07 55.74 3cpw s TYR 82 Cb -0.11 -1.57 -0.03 0.00 -0.11 0.00 0.00 41.96 40.15 3cpw s TYR 82 CO -0.05 0.17 -0.07 0.20 -1.11 0.00 0.00 175.55 174.69 3cpw s GLY 83 N -0.91 1.67 0.14 0.71 0.00 -0.71 -0.56 107.32 107.66 3cpw s GLY 83 Ca 0.12 -0.86 0.08 0.00 0.00 0.00 0.00 44.72 44.06 3cpw s GLY 83 CO 0.02 -0.30 -0.18 1.06 0.00 0.00 0.00 173.10 173.70 3cpw s MET 84 N -0.04 1.19 -0.06 2.90 -1.94 0.82 0.24 119.30 122.41 3cpw s MET 84 Ca -0.00 -1.32 0.04 0.00 -1.71 0.00 0.00 55.69 52.70 3cpw s MET 84 Cb -0.13 -1.26 0.00 0.00 2.01 0.00 0.00 34.83 35.45 3cpw s MET 84 CO 0.03 0.26 -0.17 -1.21 -0.01 0.00 0.00 175.02 173.92 3cpw s GLU 85 N -2.57 2.01 -0.15 2.03 2.02 -0.06 0.18 118.70 122.17 3cpw s GLU 85 Ca 0.12 -0.62 -0.17 0.00 0.02 0.00 0.00 54.97 54.33 3cpw s GLU 85 Cb -0.07 -1.67 -0.04 0.00 0.10 0.00 0.00 34.13 32.46 3cpw s GLU 85 CO 0.05 0.18 0.43 0.54 0.02 0.00 0.00 175.26 176.49 3cpw s VAL 86 N 0.25 5.20 -0.02 2.63 0.11 -0.92 -0.81 120.40 126.84 3cpw s VAL 86 Ca -0.09 0.84 0.02 0.00 -2.93 0.00 0.00 61.98 59.82 3cpw s VAL 86 Cb -0.14 -3.77 0.00 0.00 -1.53 0.00 0.00 36.38 30.94 3cpw s VAL 86 CO 0.04 0.31 -0.08 0.12 -3.33 0.00 0.00 175.10 172.16 3cpw s PHE 87 N 0.82 0.84 0.02 1.54 5.36 -0.50 -4.89 117.98 121.18 3cpw s PHE 87 Ca 0.23 -0.20 -0.04 0.00 -0.96 0.00 0.00 56.93 55.96 3cpw s PHE 87 Cb -0.15 -0.61 -0.01 0.00 -0.34 0.00 0.00 43.02 41.91 3cpw s PHE 87 CO 0.09 -0.09 0.05 1.52 -1.46 0.00 0.00 175.22 175.32 3cpw s TYR 88 N 0.22 0.21 -0.25 10.12 -0.85 -1.26 -0.24 117.35 125.30 3cpw s TYR 88 Ca -0.03 -0.47 -0.03 0.00 -0.52 0.00 0.00 57.07 56.02 3cpw s TYR 88 Cb -0.08 -0.16 -0.17 0.00 0.38 0.00 0.00 41.96 41.93 3cpw s TYR 88 CO 0.00 -0.28 -0.17 -1.13 -1.52 0.00 0.00 175.55 172.45 3cpw n SER 89 N 1.19 1.99 0.00 -0.18 3.41 -1.26 -4.92 113.62 113.85 3cpw n SER 89 Ca -0.21 0.01 0.00 0.00 -0.26 0.00 0.00 58.87 58.41 3cpw n SER 89 Cb 0.57 -0.56 0.00 0.00 -0.26 0.00 0.00 64.21 63.96 3cpw n SER 89 CO 0.00 0.00 0.00 1.57 -0.16 0.00 0.00 175.04 176.45 3cpw n HIS 90 N -3.52 -0.04 -3.20 7.33 -0.00 -1.26 -5.03 115.22 109.51 3cpw n HIS 90 Ca -0.46 0.01 -0.40 0.00 -0.00 0.00 0.00 57.72 56.87 3cpw n HIS 90 Cb 0.97 0.13 -0.07 0.00 -0.00 0.00 0.00 29.99 31.02 3cpw n HIS 90 CO 0.00 0.00 0.00 -0.06 -0.00 0.00 0.00 176.34 176.28 3cpw s PHE 91 N -2.00 3.26 -0.13 1.57 0.40 -1.26 -5.01 117.98 114.81 3cpw s PHE 91 Ca 0.00 0.67 -0.29 0.00 -0.60 0.00 0.00 56.93 56.71 3cpw s PHE 91 Cb 0.00 -2.77 -0.06 0.00 0.51 0.00 0.00 43.02 40.70 3cpw s PHE 91 CO 0.00 -0.31 2.15 -2.30 0.70 0.00 0.00 175.22 175.46 3cpw n PRO 92 N 5.61 2.26 -2.83 0.24 -0.02 -1.26 -4.66 135.00 134.34 3cpw n PRO 92 Ca -0.03 0.70 -0.41 0.00 -2.02 0.00 0.00 63.50 61.75 3cpw n PRO 92 Cb 0.49 -3.17 -0.04 0.00 -0.02 0.00 0.00 33.50 30.76 3cpw n PRO 92 CO 0.00 0.00 0.00 1.41 1.98 0.00 0.00 175.50 178.89 3cpw s MET 93 N 5.75 4.58 -0.36 -0.52 1.75 -1.26 -4.74 119.30 124.50 3cpw s MET 93 Ca 0.97 1.28 -0.04 0.00 -1.25 0.00 0.00 55.69 56.65 3cpw s MET 93 Cb -0.37 -3.40 0.07 0.00 2.84 0.00 0.00 34.83 33.98 3cpw s MET 93 CO 0.37 0.16 0.12 -0.65 -0.65 0.00 0.00 175.02 174.37 3cpw s GLN 94 N 0.29 2.30 -0.22 4.11 -0.21 -0.36 -4.97 119.66 120.61 3cpw s GLN 94 Ca 0.45 -1.49 -0.12 0.00 0.02 0.00 0.00 55.36 54.22 3cpw s GLN 94 Cb -0.21 -3.44 -0.05 0.00 1.00 0.00 0.00 33.01 30.31 3cpw s GLN 94 CO 0.26 -0.84 0.21 0.08 -2.12 0.00 0.00 175.29 172.89 3cpw s VAL 95 N 1.25 5.33 0.02 1.09 1.01 -1.26 -0.61 120.40 127.23 3cpw s VAL 95 Ca 0.01 0.32 -0.06 0.00 0.00 0.00 0.00 61.98 62.25 3cpw s VAL 95 Cb -0.21 -3.55 -0.01 0.00 0.00 0.00 0.00 36.38 32.61 3cpw s VAL 95 CO -0.01 0.34 0.10 0.20 0.00 0.00 0.00 175.10 175.73 3cpw s ASN 96 N 0.91 0.13 -0.28 3.32 -0.87 0.82 -5.00 114.94 113.97 3cpw s ASN 96 Ca 0.11 -0.41 -0.12 0.00 -1.57 0.00 0.00 52.86 50.86 3cpw s ASN 96 Cb -0.13 0.21 -0.04 0.00 -0.02 0.00 0.00 41.25 41.26 3cpw s ASN 96 CO 0.04 -0.44 0.24 -0.69 -2.57 0.00 0.00 177.10 173.67 3cpw s VAL 97 N -2.08 5.28 -0.31 1.60 1.01 -1.26 0.13 120.40 124.77 3cpw s VAL 97 Ca -0.09 0.23 -0.02 0.00 0.00 0.00 0.00 61.98 62.10 3cpw s VAL 97 Cb -0.04 -3.58 0.10 0.00 0.00 0.00 0.00 36.38 32.86 3cpw s VAL 97 CO -0.02 0.21 0.12 -1.61 0.00 0.00 0.00 175.10 173.80 3cpw s GLU 98 N 1.83 0.55 3.72 2.72 2.02 -0.51 -4.94 118.70 124.08 3cpw s GLU 98 Ca 0.09 -0.95 0.00 0.00 0.02 0.00 0.00 54.97 54.13 3cpw s GLU 98 Cb -0.16 -1.69 0.00 0.00 0.10 0.00 0.00 34.13 32.38 3cpw s GLU 98 CO 0.11 -1.02 0.00 0.41 0.02 0.00 0.00 175.26 174.78 3cpw n GLY 99 N 4.88 1.21 1.11 -1.39 0.00 -1.26 -3.68 105.19 106.06 3cpw n GLY 99 Ca -0.02 -0.89 -0.04 0.00 0.00 0.00 0.00 46.02 45.07 3cpw n GLY 99 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 3cpw n ASP 100 N 4.23 2.62 -3.73 1.61 8.00 -1.26 -4.99 116.55 123.04 3cpw n ASP 100 Ca 0.00 -3.83 -0.13 0.00 0.71 0.00 0.00 54.79 51.53 3cpw n ASP 100 Cb 0.00 -0.58 -0.09 0.00 -0.02 0.00 0.00 41.12 40.42 3cpw n ASP 100 CO 0.00 0.00 0.00 -1.83 -0.39 0.00 0.00 177.20 174.98 3cpw s GLU 101 N -3.31 0.57 -0.16 -1.24 -1.05 -1.24 0.68 118.70 112.95 3cpw s GLU 101 Ca 0.44 0.30 -0.19 0.00 -0.15 0.00 0.00 54.97 55.37 3cpw s GLU 101 Cb 0.40 0.27 -0.04 0.00 -0.44 0.00 0.00 34.13 34.32 3cpw s GLU 101 CO -0.02 -0.11 0.54 0.54 0.95 0.00 0.00 175.26 177.15 3cpw s VAL 102 N -0.36 5.12 -0.14 1.83 0.11 -0.45 -1.43 120.40 125.07 3cpw s VAL 102 Ca -0.05 1.03 -0.06 0.00 -2.93 0.00 0.00 61.98 59.97 3cpw s VAL 102 Cb -0.03 -3.87 -0.04 0.00 -1.53 0.00 0.00 36.38 30.91 3cpw s VAL 102 CO 0.02 0.23 0.07 -0.69 -3.33 0.00 0.00 175.10 171.40 3cpw s VAL 103 N 1.21 4.89 -0.15 2.04 1.01 0.36 -2.40 120.40 127.36 3cpw s VAL 103 Ca 0.27 -0.01 0.02 0.00 0.00 0.00 0.00 61.98 62.25 3cpw s VAL 103 Cb -0.16 -3.15 0.01 0.00 0.00 0.00 0.00 36.38 33.09 3cpw s VAL 103 CO 0.11 0.54 -0.21 -0.63 0.00 0.00 0.00 175.10 174.91 3cpw s ILE 104 N -0.36 2.03 0.13 2.22 1.01 0.12 -0.13 121.20 126.23 3cpw s ILE 104 Ca 0.09 -0.95 0.09 0.00 0.00 0.00 0.00 60.65 59.88 3cpw s ILE 104 Cb -0.12 -1.81 -0.04 0.00 0.01 0.00 0.00 42.46 40.50 3cpw s ILE 104 CO 0.02 0.54 -0.17 -1.61 0.00 0.00 0.00 174.94 173.72 3cpw s GLU 105 N 0.95 1.81 -1.23 2.79 2.02 0.22 -0.97 118.70 124.29 3cpw s GLU 105 Ca -0.04 -1.22 -0.02 0.00 0.02 0.00 0.00 54.97 53.71 3cpw s GLU 105 Cb -0.15 -2.10 0.00 0.00 0.10 0.00 0.00 34.13 31.98 3cpw s GLU 105 CO -0.05 0.47 0.26 -1.71 0.02 0.00 0.00 175.26 174.25 3cpw n ASN 106 N 0.64 -4.84 -4.69 -0.19 4.05 -1.24 -1.22 115.26 107.76 3cpw n ASN 106 Ca -0.15 -0.13 -0.42 0.00 0.45 0.00 0.00 54.58 54.33 3cpw n ASN 106 Cb 0.53 -3.81 -0.03 0.00 1.23 0.00 0.00 39.78 37.70 3cpw n ASN 106 CO 0.00 0.00 0.00 0.12 -3.05 0.00 0.00 177.26 174.33 3cpw s PHE 107 N -2.91 2.79 -0.67 1.20 5.36 -1.26 -2.51 117.98 119.99 3cpw s PHE 107 Ca 0.13 0.72 0.00 0.00 -0.96 0.00 0.00 56.93 56.82 3cpw s PHE 107 Cb -0.06 -3.73 0.00 0.00 -0.34 0.00 0.00 43.02 38.89 3cpw s PHE 107 CO 0.16 -2.74 0.00 1.28 -1.46 0.00 0.00 175.22 172.46 3cpw n LEU 108 N 5.31 -0.61 0.00 6.12 4.32 -1.26 0.13 117.00 131.01 3cpw n LEU 108 Ca 0.14 0.27 0.00 0.00 -0.02 0.00 0.00 56.01 56.39 3cpw n LEU 108 Cb 0.43 -1.53 0.00 0.00 -1.62 0.00 0.00 43.42 40.70 3cpw n LEU 108 CO 0.59 -0.19 0.00 0.61 -1.22 0.00 0.00 177.39 177.19 3cpw n GLY 109 N -0.47 1.47 3.53 -0.72 0.00 -1.04 -5.00 105.19 102.95 3cpw n GLY 109 Ca -0.08 0.00 -0.46 0.00 0.00 0.00 0.00 46.02 45.48 3cpw n GLY 109 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 3cpw n GLU 110 N -2.00 0.89 0.05 1.61 1.02 0.12 -4.87 120.64 117.45 3cpw n GLU 110 Ca 0.00 0.31 -0.09 0.00 -0.02 0.00 0.00 57.16 57.36 3cpw n GLU 110 Cb 0.00 -1.58 -0.13 0.00 -0.02 0.00 0.00 31.44 29.71 3cpw n GLU 110 CO 0.00 0.00 0.00 0.87 1.18 0.00 0.00 177.13 179.18 3cpw h LYS 111 N 1.81 0.05 -5.71 3.49 1.57 -1.96 -3.29 116.57 112.53 3cpw h LYS 111 Ca -0.36 -0.09 -0.59 0.00 -1.87 0.00 0.00 60.65 57.74 3cpw h LYS 111 Cb 1.37 0.03 -0.09 0.00 0.08 0.00 0.00 32.23 33.63 3cpw h LYS 111 CO 0.60 0.92 0.11 0.00 -0.57 0.00 0.00 179.45 180.51 3cpw s ALA 112 N -2.67 3.52 0.18 3.86 0.00 -1.26 -4.88 121.76 120.51 3cpw s ALA 112 Ca -0.02 -0.22 -0.31 0.00 0.00 0.00 0.00 51.96 51.41 3cpw s ALA 112 Cb 0.09 -2.95 -0.10 0.00 0.00 0.00 0.00 23.12 20.16 3cpw s ALA 112 CO 0.83 -0.48 1.49 -2.14 0.00 0.00 0.00 175.76 175.46 3cpw s PRO 113 N 1.72 4.25 0.07 0.00 0.02 -1.26 -4.81 135.00 134.99 3cpw s PRO 113 Ca 0.30 2.28 -0.14 0.00 0.02 0.00 0.00 61.00 63.46 3cpw s PRO 113 Cb -0.16 -3.16 -0.06 0.00 0.02 0.00 0.00 34.50 31.14 3cpw s PRO 113 CO 0.11 -0.51 0.47 1.03 -0.33 0.00 0.00 177.00 177.77 3cpw s ARG 114 N 0.60 3.95 0.16 5.54 0.52 -0.14 -4.92 118.95 124.66 3cpw s ARG 114 Ca 0.65 0.44 -0.13 0.00 -0.52 0.00 0.00 55.73 56.17 3cpw s ARG 114 Cb -0.42 -3.10 0.01 0.00 0.52 0.00 0.00 34.95 31.96 3cpw s ARG 114 CO 0.35 0.60 0.37 -0.98 0.02 0.00 0.00 175.30 175.66 3cpw s ARG 115 N -1.48 1.17 -0.16 3.54 1.70 -1.26 0.15 118.95 122.61 3cpw s ARG 115 Ca 0.30 -0.97 -0.14 0.00 -0.47 0.00 0.00 55.73 54.45 3cpw s ARG 115 Cb -0.16 0.43 0.04 0.00 -0.57 0.00 0.00 34.95 34.69 3cpw s ARG 115 CO 0.17 -0.45 0.41 -0.08 -1.08 0.00 0.00 175.30 174.27 3cpw s THR 116 N -3.90 -0.00 0.22 4.99 -1.32 -1.01 -5.02 115.64 109.60 3cpw s THR 116 Ca 0.11 0.01 -0.26 0.00 -1.21 0.00 0.00 61.69 60.34 3cpw s THR 116 Cb 0.02 -0.58 -0.09 0.00 -1.51 0.00 0.00 72.50 70.34 3cpw s THR 116 CO -0.04 0.01 0.85 -0.89 -2.21 0.00 0.00 174.62 172.34 3cpw s THR 117 N 0.40 4.27 0.22 5.08 2.01 -1.26 -1.35 115.64 125.01 3cpw s THR 117 Ca -0.01 1.81 -0.30 0.00 0.31 0.00 0.00 61.69 63.49 3cpw s THR 117 Cb -0.04 -4.15 -0.08 0.00 0.01 0.00 0.00 72.50 68.24 3cpw s THR 117 CO -0.01 0.42 1.03 -0.63 -0.69 0.00 0.00 174.62 174.73 3cpw s ILE 118 N -1.28 3.89 -0.05 1.82 1.01 0.21 -4.92 121.20 121.89 3cpw s ILE 118 Ca 0.41 1.80 -0.19 0.00 0.00 0.00 0.00 60.65 62.66 3cpw s ILE 118 Cb -0.23 -4.14 -0.05 0.00 0.01 0.00 0.00 42.46 38.05 3cpw s ILE 118 CO 0.27 0.38 0.54 -1.00 0.00 0.00 0.00 174.94 175.13 3cpw s HIS 119 N -0.82 3.61 0.00 3.97 3.76 -1.26 -4.92 115.29 119.63 3cpw s HIS 119 Ca 0.45 1.06 0.00 0.00 -0.15 0.00 0.00 55.06 56.42 3cpw s HIS 119 Cb -0.28 -2.57 0.00 0.00 1.11 0.00 0.00 32.58 30.84 3cpw s HIS 119 CO 0.35 0.29 0.00 0.41 -0.85 0.00 0.00 174.74 174.94 3cpw n GLY 120 N 2.74 2.04 2.17 -2.22 0.00 -1.26 -2.83 105.19 105.83 3cpw n GLY 120 Ca -0.07 -0.47 -0.28 0.00 0.00 0.00 0.00 46.02 45.19 3cpw n GLY 120 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 3cpw n ASP 121 N -0.98 7.24 -4.72 1.61 8.00 -1.26 -4.96 116.55 121.48 3cpw n ASP 121 Ca 0.00 -3.51 -0.41 0.00 0.71 0.00 0.00 54.79 51.57 3cpw n ASP 121 Cb 0.00 -1.01 -0.04 0.00 -0.02 0.00 0.00 41.12 40.05 3cpw n ASP 121 CO 0.00 0.00 0.00 -0.89 -0.39 0.00 0.00 177.20 175.92 3cpw s THR 122 N -3.85 4.62 -0.22 -3.53 2.01 -1.13 -4.77 115.64 108.76 3cpw s THR 122 Ca 0.52 2.04 -0.09 0.00 0.31 0.00 0.00 61.69 64.48 3cpw s THR 122 Cb 0.41 -4.31 -0.04 0.00 0.01 0.00 0.00 72.50 68.57 3cpw s THR 122 CO -0.01 0.25 0.10 -1.81 -0.69 0.00 0.00 174.62 172.46 3cpw s ASP 123 N 0.41 5.72 -0.37 3.53 1.01 0.53 -4.90 116.67 122.61 3cpw s ASP 123 Ca 0.49 0.04 -0.01 0.00 0.71 0.00 0.00 52.55 53.78 3cpw s ASP 123 Cb -0.23 -2.01 0.09 0.00 1.01 0.00 0.00 42.92 41.79 3cpw s ASP 123 CO 0.29 0.09 0.12 -0.69 0.21 0.00 0.00 175.17 175.19 3cpw s VAL 124 N 0.88 2.97 -0.22 -1.27 1.01 -1.26 -1.23 120.40 121.28 3cpw s VAL 124 Ca 0.05 -1.96 -0.08 0.00 0.00 0.00 0.00 61.98 59.99 3cpw s VAL 124 Cb -0.13 -2.99 -0.04 0.00 0.00 0.00 0.00 36.38 33.22 3cpw s VAL 124 CO 0.03 -0.53 0.09 -1.61 0.00 0.00 0.00 175.10 173.08 3cpw s GLU 125 N 1.11 3.86 -0.09 2.72 2.02 -0.94 -4.92 118.70 122.46 3cpw s GLU 125 Ca 0.06 -0.38 0.00 0.00 0.02 0.00 0.00 54.97 54.66 3cpw s GLU 125 Cb -0.21 -3.33 -0.03 0.00 0.10 0.00 0.00 34.13 30.66 3cpw s GLU 125 CO -0.04 0.04 -0.09 -1.50 0.02 0.00 0.00 175.26 173.68 3cpw s ILE 126 N 1.04 3.49 -0.24 -1.63 2.07 -1.26 -1.07 121.20 123.60 3cpw s ILE 126 Ca 0.05 -0.54 -0.04 0.00 -1.41 0.00 0.00 60.65 58.71 3cpw s ILE 126 Cb -0.14 -2.45 0.09 0.00 0.13 0.00 0.00 42.46 40.09 3cpw s ILE 126 CO 0.03 0.56 0.12 -0.62 -1.91 0.00 0.00 174.94 173.13 3cpw s ASP 127 N -0.32 3.02 1.66 4.50 -1.08 0.61 -5.01 116.67 120.05 3cpw s ASP 127 Ca 0.04 -1.01 0.00 0.00 -0.52 0.00 0.00 52.55 51.06 3cpw s ASP 127 Cb -0.13 -0.28 0.00 0.00 -1.46 0.00 0.00 42.92 41.06 3cpw s ASP 127 CO 0.02 -0.40 0.00 0.61 0.52 0.00 0.00 175.17 175.92 3cpw n GLY 128 N 5.26 2.64 1.51 2.66 0.00 -1.26 -1.79 105.19 114.21 3cpw n GLY 128 Ca -0.06 -0.29 -0.00 0.00 0.00 0.00 0.00 46.02 45.67 3cpw n GLY 128 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 3cpw n GLU 129 N 13.42 3.18 -4.86 1.61 -0.58 -1.26 -4.86 120.64 127.30 3cpw n GLU 129 Ca 0.00 -2.05 -0.25 0.00 -0.42 0.00 0.00 57.16 54.43 3cpw n GLU 129 Cb 0.00 -1.96 -0.16 0.00 -0.57 0.00 0.00 31.44 28.76 3cpw n GLU 129 CO 0.00 0.00 0.00 -1.21 -0.48 0.00 0.00 177.13 175.44 3cpw s GLU 130 N -2.16 1.54 0.08 3.49 2.02 -0.74 -2.16 118.70 120.77 3cpw s GLU 130 Ca 0.36 -0.64 0.08 0.00 0.02 0.00 0.00 54.97 54.79 3cpw s GLU 130 Cb 0.28 -1.45 -0.03 0.00 0.10 0.00 0.00 34.13 33.04 3cpw s GLU 130 CO 0.10 0.35 -0.21 -0.51 0.02 0.00 0.00 175.26 175.01 3cpw s LEU 131 N -0.31 2.25 -0.20 1.80 1.43 0.13 -0.28 118.68 123.50 3cpw s LEU 131 Ca 0.04 -0.63 -0.04 0.00 -1.03 0.00 0.00 54.13 52.48 3cpw s LEU 131 Cb -0.08 -0.91 0.07 0.00 0.03 0.00 0.00 46.19 45.29 3cpw s LEU 131 CO -0.00 0.09 0.07 0.28 0.23 0.00 0.00 176.35 177.02 3cpw s THR 132 N -1.04 0.22 -0.13 5.49 -1.32 -0.23 -0.13 115.64 118.50 3cpw s THR 132 Ca 0.07 -0.44 -0.17 0.00 -1.21 0.00 0.00 61.69 59.94 3cpw s THR 132 Cb -0.10 -0.85 -0.04 0.00 -1.51 0.00 0.00 72.50 70.00 3cpw s THR 132 CO 0.03 -0.31 0.43 -0.69 -2.21 0.00 0.00 174.62 171.88 3cpw s VAL 133 N 1.99 5.22 0.05 5.08 1.01 0.27 -2.22 120.40 131.81 3cpw s VAL 133 Ca 0.02 0.85 -0.18 0.00 0.00 0.00 0.00 61.98 62.67 3cpw s VAL 133 Cb -0.17 -3.77 0.04 0.00 0.00 0.00 0.00 36.38 32.48 3cpw s VAL 133 CO -0.12 0.34 0.42 -0.94 0.00 0.00 0.00 175.10 174.81 3cpw s SER 134 N 0.57 -0.29 0.00 3.32 1.04 -0.36 0.05 113.70 118.02 3cpw s SER 134 Ca 0.24 -0.03 0.00 0.00 0.48 0.00 0.00 55.95 56.64 3cpw s SER 134 Cb -0.15 0.44 0.00 0.00 0.10 0.00 0.00 66.02 66.41 3cpw s SER 134 CO 0.09 -0.69 0.00 0.61 0.98 0.00 0.00 173.24 174.22 3cpw n GLY 135 N 0.40 -0.59 0.08 7.32 0.00 -0.51 -0.34 105.19 111.55 3cpw n GLY 135 Ca -0.18 -1.15 -0.10 0.00 0.00 0.00 0.00 46.02 44.59 3cpw n GLY 135 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 3cpw h PRO 136 N 0.00 0.07 -5.74 1.61 0.13 -1.84 -0.28 132.00 125.95 3cpw h PRO 136 Ca 0.00 -0.11 -0.62 0.00 -0.87 0.00 0.00 66.00 64.40 3cpw h PRO 136 Cb 0.00 0.04 -0.13 0.00 0.13 0.00 0.00 31.00 31.04 3cpw h PRO 136 CO 0.00 0.92 0.49 0.34 -0.23 0.00 0.00 178.00 179.52 3cpw s ASP 137 N -6.66 6.33 0.44 1.44 -1.08 -1.26 -4.30 116.67 111.59 3cpw s ASP 137 Ca -0.02 -0.42 0.12 0.00 -0.52 0.00 0.00 52.55 51.71 3cpw s ASP 137 Cb 0.09 -2.42 0.99 0.00 -1.46 0.00 0.00 42.92 40.12 3cpw s ASP 137 CO 0.83 -1.17 2.02 -0.29 0.52 0.00 0.00 175.17 177.08 3cpw h ILE 138 N 6.00 1.11 0.18 4.11 2.10 -1.89 -0.75 117.51 128.37 3cpw h ILE 138 Ca -0.26 -0.44 -0.01 0.00 1.08 0.00 0.00 64.86 65.23 3cpw h ILE 138 Cb 1.08 1.09 0.00 0.00 -1.09 0.00 0.00 36.82 37.90 3cpw h ILE 138 CO 1.07 0.14 -0.09 -0.33 -1.08 0.00 0.00 178.15 177.86 3cpw h GLU 139 N 0.14 -0.24 -0.19 2.19 4.39 -1.98 0.33 114.58 119.22 3cpw h GLU 139 Ca 0.03 0.02 -0.01 0.00 0.34 0.00 0.00 59.36 59.74 3cpw h GLU 139 Cb 0.20 0.05 -0.01 0.00 -0.10 0.00 0.00 28.75 28.89 3cpw h GLU 139 CO 0.01 -0.08 0.06 0.00 -1.16 0.00 0.00 179.01 177.84 3cpw h ALA 140 N 0.46 0.25 0.40 3.43 0.00 -1.79 -2.03 119.26 119.98 3cpw h ALA 140 Ca -0.03 -0.13 -0.02 0.00 0.00 0.00 0.00 54.91 54.73 3cpw h ALA 140 Cb 0.27 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 17.99 3cpw h ALA 140 CO 0.04 -0.13 -0.19 0.28 0.00 0.00 0.00 179.25 179.25 3cpw h VAL 141 N 0.13 0.59 -0.85 0.00 2.07 -1.13 -1.58 116.25 115.48 3cpw h VAL 141 Ca 0.06 -0.28 0.21 0.00 0.82 0.00 0.00 66.70 67.51 3cpw h VAL 141 Cb 0.23 0.73 -0.13 0.00 -1.52 0.00 0.00 31.29 30.60 3cpw h VAL 141 CO -0.00 0.05 0.28 1.23 0.02 0.00 0.00 177.57 179.15 3cpw h GLY 142 N -0.71 1.34 0.65 2.17 0.00 -0.33 -1.16 103.07 105.04 3cpw h GLY 142 Ca -0.06 -0.08 -0.02 0.00 0.00 0.00 0.00 47.33 47.17 3cpw h GLY 142 CO 0.09 -0.29 -0.03 1.46 0.00 0.00 0.00 176.54 177.77 3cpw h GLN 143 N 0.30 0.13 -0.47 4.80 1.08 -1.24 -2.00 115.11 117.70 3cpw h GLN 143 Ca 0.52 -0.06 0.09 0.00 -1.45 0.00 0.00 58.65 57.76 3cpw h GLN 143 Cb 0.99 -0.00 -0.09 0.00 -0.05 0.00 0.00 27.48 28.33 3cpw h GLN 143 CO -0.57 0.51 -0.09 1.15 -0.95 0.00 0.00 178.83 178.87 3cpw h THR 144 N -0.26 0.55 0.73 -0.54 2.02 -0.40 1.70 112.91 116.71 3cpw h THR 144 Ca 0.01 -0.01 -0.03 0.00 0.77 0.00 0.00 66.41 67.16 3cpw h THR 144 Cb 0.47 0.52 -0.01 0.00 -1.74 0.00 0.00 68.15 67.40 3cpw h THR 144 CO 0.01 0.00 -0.49 0.00 0.37 0.00 0.00 175.52 175.41 3cpw h ALA 145 N 1.46 -1.25 -0.62 6.16 0.00 -1.24 -0.86 119.26 122.90 3cpw h ALA 145 Ca 0.23 -0.24 0.13 0.00 0.00 0.00 0.00 54.91 55.03 3cpw h ALA 145 Cb 0.35 0.64 -0.11 0.00 0.00 0.00 0.00 17.79 18.67 3cpw h ALA 145 CO -0.47 -1.22 -0.02 0.00 0.00 0.00 0.00 179.25 177.54 3cpw h ALA 146 N -1.12 0.59 -0.94 0.00 0.00 -0.54 0.19 119.26 117.43 3cpw h ALA 146 Ca -0.10 0.20 0.10 0.00 0.00 0.00 0.00 54.91 55.12 3cpw h ALA 146 Cb 0.94 0.35 -0.08 0.00 0.00 0.00 0.00 17.79 19.00 3cpw h ALA 146 CO 0.07 -0.40 0.57 -0.44 0.00 0.00 0.00 179.25 179.05 3cpw h ASP 147 N 0.10 0.84 -0.74 0.00 3.32 0.29 0.16 116.42 120.39 3cpw h ASP 147 Ca 0.32 0.04 -0.02 0.00 0.02 0.00 0.00 57.03 57.39 3cpw h ASP 147 Cb 0.52 -0.12 -0.03 0.00 0.22 0.00 0.00 39.33 39.91 3cpw h ASP 147 CO -0.55 0.47 0.37 0.40 -1.72 0.00 0.00 179.24 178.21 3cpw h ILE 148 N 0.94 1.24 -0.29 0.35 2.04 0.47 0.21 117.51 122.46 3cpw h ILE 148 Ca 0.45 -0.64 -0.17 0.00 1.00 0.00 0.00 64.86 65.50 3cpw h ILE 148 Cb 0.41 0.30 -0.00 0.00 -0.74 0.00 0.00 36.82 36.79 3cpw h ILE 148 CO -0.25 0.27 -0.48 -0.08 0.00 0.00 0.00 178.15 177.61 3cpw h GLU 149 N 1.03 0.80 0.00 2.37 4.81 -0.72 -2.67 114.58 120.19 3cpw h GLU 149 Ca 0.25 -0.47 -0.04 0.00 -0.13 0.00 0.00 59.36 58.98 3cpw h GLU 149 Cb 0.10 0.04 -0.01 0.00 0.63 0.00 0.00 28.75 29.51 3cpw h GLU 149 CO -0.03 1.10 -0.20 1.96 -0.73 0.00 0.00 179.01 181.10 3cpw h GLN 150 N 0.63 0.00 0.00 1.92 1.08 -0.44 -2.63 115.11 115.67 3cpw h GLN 150 Ca 0.03 0.00 0.00 0.00 -1.45 0.00 0.00 58.65 57.23 3cpw h GLN 150 Cb 1.06 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 28.49 3cpw h GLN 150 CO 0.11 0.20 0.00 -0.11 -0.95 0.00 0.00 178.83 178.08 3cpw n LEU 151 N -3.87 0.43 -0.43 1.46 7.94 0.04 -1.39 117.00 121.17 3cpw n LEU 151 Ca -0.02 0.68 0.08 0.00 -1.11 0.00 0.00 56.01 55.64 3cpw n LEU 151 Cb 0.30 -0.70 0.18 0.00 0.53 0.00 0.00 43.42 43.73 3cpw n LEU 151 CO 0.34 -0.75 0.59 0.35 -1.11 0.00 0.00 177.39 176.81 3cpw n THR 152 N -2.05 2.08 -1.99 1.96 -2.24 -0.99 -4.93 114.28 106.12 3cpw n THR 152 Ca -0.00 -2.31 -0.40 0.00 -2.27 0.00 0.00 64.05 59.06 3cpw n THR 152 Cb 0.07 -0.25 -0.01 0.00 -2.10 0.00 0.00 70.33 68.04 3cpw n THR 152 CO 0.00 0.00 0.00 -0.60 -0.57 0.00 0.00 175.07 173.90 3cpw s ARG 153 N -2.94 4.13 -0.04 -0.78 3.52 -0.49 -4.87 118.95 117.49 3cpw s ARG 153 Ca 0.36 2.31 0.01 0.00 -0.13 0.00 0.00 55.73 58.29 3cpw s ARG 153 Cb 0.32 -2.92 0.02 0.00 -1.56 0.00 0.00 34.95 30.80 3cpw s ARG 153 CO 0.03 -0.41 -0.04 -1.50 -0.81 0.00 0.00 175.30 172.57 3cpw s ILE 154 N -1.17 0.45 -0.06 4.11 2.07 -1.26 -5.02 121.20 120.32 3cpw s ILE 154 Ca 0.53 -0.09 0.04 0.00 -1.41 0.00 0.00 60.65 59.71 3cpw s ILE 154 Cb -0.41 -0.48 -0.06 0.00 0.13 0.00 0.00 42.46 41.63 3cpw s ILE 154 CO 0.55 0.20 -0.00 0.59 -1.91 0.00 0.00 174.94 174.36 3cpw n ASN 155 N 3.94 3.59 0.03 4.50 3.02 -1.26 -4.76 115.26 124.33 3cpw n ASN 155 Ca -0.25 -0.01 -0.10 0.00 -0.03 0.00 0.00 54.58 54.19 3cpw n ASN 155 Cb 0.51 0.42 -0.04 0.00 -0.61 0.00 0.00 39.78 40.07 3cpw n ASN 155 CO 0.00 0.00 0.00 -2.24 -2.62 0.00 0.00 177.26 172.40 3cpw h ASP 156 N 0.00 -0.43 -1.73 6.41 2.03 -2.05 -3.45 116.42 117.20 3cpw h ASP 156 Ca -0.15 0.07 -0.51 0.00 -0.73 0.00 0.00 57.03 55.71 3cpw h ASP 156 Cb 1.31 0.19 -0.05 0.00 -0.83 0.00 0.00 39.33 39.95 3cpw h ASP 156 CO -0.00 -0.20 -0.45 -0.54 -1.03 0.00 0.00 179.24 177.02 3cpw s LYS 157 N -6.14 2.54 -0.13 4.15 1.02 -1.26 -5.06 119.74 114.85 3cpw s LYS 157 Ca -0.14 -1.48 -0.29 0.00 0.02 0.00 0.00 55.97 54.08 3cpw s LYS 157 Cb 0.09 -2.33 -0.06 0.00 -0.52 0.00 0.00 37.83 35.01 3cpw s LYS 157 CO 0.67 -0.01 2.00 0.34 -0.92 0.00 0.00 175.35 177.43 3cpw s ASP 158 N -3.99 6.01 0.46 2.83 -1.08 -1.26 -4.88 116.67 114.76 3cpw s ASP 158 Ca 0.42 2.10 0.22 0.00 -0.52 0.00 0.00 52.55 54.77 3cpw s ASP 158 Cb -0.03 -2.52 1.14 0.00 -1.46 0.00 0.00 42.92 40.05 3cpw s ASP 158 CO 0.26 -1.49 1.97 0.58 0.52 0.00 0.00 175.17 177.01 3cpw h VAL 159 N 6.39 0.82 0.00 1.11 2.07 -1.89 -2.47 116.25 122.27 3cpw h VAL 159 Ca -0.42 -0.80 -0.03 0.00 0.82 0.00 0.00 66.70 66.26 3cpw h VAL 159 Cb 1.22 1.48 -0.00 0.00 -1.52 0.00 0.00 31.29 32.47 3cpw h VAL 159 CO 0.96 0.20 -0.15 0.03 0.02 0.00 0.00 177.57 178.63 3cpw h ARG 160 N 0.00 0.00 0.02 1.57 3.08 -2.01 -3.24 114.38 113.79 3cpw h ARG 160 Ca -0.00 0.00 -0.40 0.00 0.07 0.00 0.00 59.98 59.65 3cpw h ARG 160 Cb 0.46 0.00 -0.06 0.00 0.08 0.00 0.00 29.97 30.45 3cpw h ARG 160 CO 0.03 0.15 -2.33 0.28 -1.07 0.00 0.00 179.97 177.03 3cpw n VAL 161 N -3.66 1.55 -3.28 2.04 0.31 -1.06 -4.73 118.33 109.50 3cpw n VAL 161 Ca -0.02 -0.46 -0.46 0.00 -0.01 0.00 0.00 64.34 63.39 3cpw n VAL 161 Cb 0.27 -1.68 -0.02 0.00 -0.91 0.00 0.00 33.84 31.50 3cpw n VAL 161 CO 0.00 0.00 0.00 -0.36 -1.32 0.00 0.00 176.83 175.15 3cpw s PHE 162 N -2.51 3.72 -1.42 3.52 0.40 -0.96 -4.86 117.98 115.87 3cpw s PHE 162 Ca -0.34 -1.97 0.19 0.00 -0.60 0.00 0.00 56.93 54.21 3cpw s PHE 162 Cb 0.11 -3.88 0.66 0.00 0.51 0.00 0.00 43.02 40.41 3cpw s PHE 162 CO 0.58 -1.05 1.56 1.04 0.70 0.00 0.00 175.22 178.06 3cpw n GLN 163 N 4.21 3.26 -1.90 0.44 6.02 -1.25 -4.61 117.38 123.54 3cpw n GLN 163 Ca 0.16 -2.74 -0.38 0.00 -0.01 0.00 0.00 57.00 54.02 3cpw n GLN 163 Cb 0.47 -1.72 0.02 0.00 1.02 0.00 0.00 30.24 30.03 3cpw n GLN 163 CO 0.00 0.00 0.00 -0.51 -1.01 0.00 0.00 177.06 175.54 3cpw s ASP 164 N -0.98 5.60 0.00 1.08 1.11 -1.26 -4.84 116.67 117.38 3cpw s ASP 164 Ca 0.48 2.68 0.00 0.00 0.18 0.00 0.00 52.55 55.89 3cpw s ASP 164 Cb 0.29 -2.63 0.00 0.00 1.07 0.00 0.00 42.92 41.64 3cpw s ASP 164 CO 0.27 -1.34 0.00 0.61 1.18 0.00 0.00 175.17 175.89 3cpw n GLY 165 N 0.65 2.95 3.81 0.21 0.00 0.67 -4.97 105.19 108.50 3cpw n GLY 165 Ca 0.09 -1.58 -0.36 0.00 0.00 0.00 0.00 46.02 44.17 3cpw n GLY 165 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3cpw s VAL 166 N -2.00 5.40 0.07 1.61 1.01 -1.26 -1.41 120.40 123.83 3cpw s VAL 166 Ca 0.00 0.32 0.07 0.00 0.00 0.00 0.00 61.98 62.37 3cpw s VAL 166 Cb 0.00 -3.49 -0.03 0.00 0.00 0.00 0.00 36.38 32.86 3cpw s VAL 166 CO 0.00 0.54 -0.18 -0.31 0.00 0.00 0.00 175.10 175.15 3cpw s TYR 167 N -0.46 1.54 0.03 5.22 1.51 0.01 -4.30 117.35 120.90 3cpw s TYR 167 Ca 0.14 -0.41 -0.30 0.00 -1.01 0.00 0.00 57.07 55.49 3cpw s TYR 167 Cb -0.12 -0.87 -0.07 0.00 -0.11 0.00 0.00 41.96 40.79 3cpw s TYR 167 CO 0.03 0.12 1.49 0.42 -1.11 0.00 0.00 175.55 176.50 3cpw s ILE 168 N -1.07 3.45 -0.22 2.71 -1.09 -1.26 -0.88 121.20 122.84 3cpw s ILE 168 Ca 0.03 0.87 0.09 0.00 -2.23 0.00 0.00 60.65 59.41 3cpw s ILE 168 Cb -0.09 -3.56 -0.19 0.00 -1.58 0.00 0.00 42.46 37.04 3cpw s ILE 168 CO 0.03 -0.00 -0.09 0.41 -1.23 0.00 0.00 174.94 174.06 3cpw n THR 169 N 4.66 1.34 -3.77 2.92 -1.04 0.66 -4.90 114.28 114.16 3cpw n THR 169 Ca 0.14 -0.65 -0.22 0.00 -2.04 0.00 0.00 64.05 61.28 3cpw n THR 169 Cb 0.42 -0.96 -0.18 0.00 -1.82 0.00 0.00 70.33 67.79 3cpw n THR 169 CO 0.00 0.00 0.00 -0.13 -0.64 0.00 0.00 175.07 174.30 3cpw s ARG 170 N -2.47 0.40 -0.07 -2.82 0.52 -0.72 -4.94 118.95 108.84 3cpw s ARG 170 Ca -0.22 0.17 -0.13 0.00 -0.52 0.00 0.00 55.73 55.03 3cpw s ARG 170 Cb 0.07 -0.80 -0.05 0.00 0.52 0.00 0.00 34.95 34.69 3cpw s ARG 170 CO 0.66 -0.29 0.33 0.15 0.02 0.00 0.00 175.30 176.16 3cpw s LYS 171 N 1.92 3.94 0.00 3.54 1.02 -1.26 -1.74 119.74 127.16 3cpw s LYS 171 Ca 0.03 0.22 0.08 0.00 0.02 0.00 0.00 55.97 56.32 3cpw s LYS 171 Cb -0.12 -3.28 0.46 0.00 -0.52 0.00 0.00 37.83 34.37 3cpw s LYS 171 CO -0.04 0.56 0.92 -0.35 -0.92 0.00 0.00 175.35 175.51