#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3cfk s LEU 2 N 0.00 4.32 -0.21 4.31 2.96 -1.26 -5.01 118.68 123.79 3cfk s LEU 2 Ca 0.00 1.87 -0.04 0.00 -0.22 0.00 0.00 54.13 55.74 3cfk s LEU 2 Cb 0.00 -3.57 -0.01 0.00 0.50 0.00 0.00 46.19 43.11 3cfk s LEU 2 CO 0.00 -0.51 -0.05 -0.69 -1.32 0.00 0.00 176.35 173.78 3cfk s VAL 3 N 1.69 3.40 -0.20 1.68 1.01 -1.26 -4.99 120.40 121.73 3cfk s VAL 3 Ca 0.56 -0.49 -0.12 0.00 0.00 0.00 0.00 61.98 61.94 3cfk s VAL 3 Cb -0.26 -2.54 -0.05 0.00 0.00 0.00 0.00 36.38 33.54 3cfk s VAL 3 CO 0.25 0.43 0.20 -0.69 0.00 0.00 0.00 175.10 175.29 3cfk s VAL 4 N 1.35 5.36 -0.02 2.92 1.01 -1.26 -2.41 120.40 127.34 3cfk s VAL 4 Ca 0.04 0.33 0.06 0.00 0.00 0.00 0.00 61.98 62.41 3cfk s VAL 4 Cb -0.14 -3.54 -0.01 0.00 0.00 0.00 0.00 36.38 32.68 3cfk s VAL 4 CO -0.02 0.40 -0.22 -0.89 0.00 0.00 0.00 175.10 174.36 3cfk s THR 5 N 0.58 1.74 0.17 3.92 2.01 -0.16 -3.87 115.64 120.03 3cfk s THR 5 Ca 0.11 -0.93 0.05 0.00 0.31 0.00 0.00 61.69 61.23 3cfk s THR 5 Cb -0.12 -1.46 -0.05 0.00 0.01 0.00 0.00 72.50 70.89 3cfk s THR 5 CO 0.01 0.49 -0.09 -1.10 -0.69 0.00 0.00 174.62 173.24 3cfk s GLN 6 N -0.41 1.15 0.41 4.92 -0.21 -1.26 -1.18 119.66 123.07 3cfk s GLN 6 Ca 0.06 -1.51 -0.26 0.00 0.02 0.00 0.00 55.36 53.66 3cfk s GLN 6 Cb -0.09 -0.70 -0.09 0.00 1.00 0.00 0.00 33.01 33.12 3cfk s GLN 6 CO 0.00 0.07 1.43 -1.21 -2.12 0.00 0.00 175.29 173.46 3cfk s GLU 7 N -3.75 3.89 0.05 2.91 8.01 -1.26 -4.87 118.70 123.68 3cfk s GLU 7 Ca 0.19 2.45 -0.24 0.00 0.01 0.00 0.00 54.97 57.38 3cfk s GLU 7 Cb 0.03 -2.80 -0.17 0.00 -4.31 0.00 0.00 34.13 26.88 3cfk s GLU 7 CO 0.03 -0.66 1.56 0.77 0.01 0.00 0.00 175.26 176.97 3cfk h SER 8 N 2.65 -0.00 -4.29 -0.19 0.02 -1.96 -3.32 113.55 106.46 3cfk h SER 8 Ca -0.51 -0.18 -0.13 0.00 -0.84 0.00 0.00 61.79 60.14 3cfk h SER 8 Cb 1.25 0.00 -0.23 0.00 0.14 0.00 0.00 62.40 63.57 3cfk h SER 8 CO 0.62 0.18 -0.27 0.00 -1.14 0.00 0.00 176.83 176.22 3cfk s ALA 9 N -5.47 -0.88 0.05 3.77 0.00 -1.26 -1.08 121.76 116.89 3cfk s ALA 9 Ca -0.14 0.78 0.03 0.00 0.00 0.00 0.00 51.96 52.63 3cfk s ALA 9 Cb 0.04 -0.34 -0.03 0.00 0.00 0.00 0.00 23.12 22.79 3cfk s ALA 9 CO 0.66 -0.21 -0.09 -0.51 0.00 0.00 0.00 175.76 175.62 3cfk s LEU 11 N -0.38 2.27 -0.03 0.00 1.43 0.07 -4.94 118.68 117.09 3cfk s LEU 11 Ca -0.05 -0.57 0.07 0.00 -1.03 0.00 0.00 54.13 52.54 3cfk s LEU 11 Cb -0.03 -0.22 -0.02 0.00 0.03 0.00 0.00 46.19 45.95 3cfk s LEU 11 CO 0.02 -0.19 -0.24 -0.89 0.23 0.00 0.00 176.35 175.28 3cfk s THR 12 N -1.42 1.93 0.02 5.49 2.01 -1.26 -0.27 115.64 122.14 3cfk s THR 12 Ca -0.08 -1.03 -0.10 0.00 0.31 0.00 0.00 61.69 60.79 3cfk s THR 12 Cb -0.10 -1.62 0.01 0.00 0.01 0.00 0.00 72.50 70.81 3cfk s THR 12 CO 0.01 0.54 0.20 0.28 -0.69 0.00 0.00 174.62 174.96 3cfk s THR 13 N -0.42 0.10 0.41 -0.82 -1.32 -0.53 -4.96 115.64 108.09 3cfk s THR 13 Ca 0.05 -0.79 -0.05 0.00 -1.21 0.00 0.00 61.69 59.69 3cfk s THR 13 Cb -0.11 -0.76 -0.04 0.00 -1.51 0.00 0.00 72.50 70.08 3cfk s THR 13 CO 0.01 -0.43 0.69 -0.44 -2.21 0.00 0.00 174.62 172.24 3cfk s SER 14 N -1.82 6.34 0.41 8.08 0.01 -1.26 -0.70 113.70 124.76 3cfk s SER 14 Ca -0.08 0.83 -0.27 0.00 1.31 0.00 0.00 55.95 57.74 3cfk s SER 14 Cb -0.03 -2.20 -0.10 0.00 0.21 0.00 0.00 66.02 63.90 3cfk s SER 14 CO -0.01 -0.42 1.45 -2.84 0.41 0.00 0.00 173.24 171.82 3cfk s PRO 15 N -4.30 3.90 0.00 12.44 0.02 -1.26 -2.02 135.00 143.78 3cfk s PRO 15 Ca 0.46 2.48 0.00 0.00 0.02 0.00 0.00 61.00 63.96 3cfk s PRO 15 Cb -0.10 -2.81 0.00 0.00 0.02 0.00 0.00 34.50 31.60 3cfk s PRO 15 CO 0.38 -0.67 0.00 0.41 -0.33 0.00 0.00 177.00 176.80 3cfk n GLY 16 N 0.53 2.81 3.87 0.52 0.00 0.13 -4.89 105.19 108.16 3cfk n GLY 16 Ca 0.03 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.74 3cfk n GLY 16 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 3cfk s GLU 17 N -0.23 3.61 -0.10 1.61 2.02 -0.86 -4.04 118.70 120.71 3cfk s GLU 17 Ca 0.00 0.70 -0.11 0.00 0.02 0.00 0.00 54.97 55.57 3cfk s GLU 17 Cb 0.00 -2.12 -0.05 0.00 0.10 0.00 0.00 34.13 32.07 3cfk s GLU 17 CO 0.00 -0.51 0.26 0.99 0.02 0.00 0.00 175.26 176.01 3cfk s THR 18 N -3.10 5.31 0.02 3.63 2.01 -1.26 -1.21 115.64 121.03 3cfk s THR 18 Ca 0.54 0.48 0.02 0.00 0.31 0.00 0.00 61.69 63.05 3cfk s THR 18 Cb -0.11 -3.56 -0.01 0.00 0.01 0.00 0.00 72.50 68.83 3cfk s THR 18 CO 0.52 0.53 -0.08 0.54 -0.69 0.00 0.00 174.62 175.45 3cfk s VAL 19 N -0.54 0.58 -0.15 3.82 0.11 -0.72 -4.99 120.40 118.51 3cfk s VAL 19 Ca 0.17 -0.64 0.00 0.00 -2.93 0.00 0.00 61.98 58.58 3cfk s VAL 19 Cb -0.14 -0.55 0.03 0.00 -1.53 0.00 0.00 36.38 34.19 3cfk s VAL 19 CO 0.06 -0.06 -0.10 -0.89 -3.33 0.00 0.00 175.10 170.78 3cfk s THR 20 N -0.66 1.36 -0.06 5.04 2.01 -1.26 -0.56 115.64 121.51 3cfk s THR 20 Ca -0.02 -0.61 -0.13 0.00 0.31 0.00 0.00 61.69 61.24 3cfk s THR 20 Cb -0.06 -1.37 -0.05 0.00 0.01 0.00 0.00 72.50 71.03 3cfk s THR 20 CO 0.00 0.32 0.33 -0.76 -0.69 0.00 0.00 174.62 173.82 3cfk s LEU 21 N 1.55 4.42 0.36 4.42 1.02 0.93 -4.94 118.68 126.44 3cfk s LEU 21 Ca 0.03 0.77 0.09 0.00 0.02 0.00 0.00 54.13 55.04 3cfk s LEU 21 Cb -0.14 -2.43 -0.06 0.00 0.02 0.00 0.00 46.19 43.58 3cfk s LEU 21 CO -0.09 0.30 -0.01 0.42 0.02 0.00 0.00 176.35 177.00 3cfk s THR 22 N -0.79 2.35 -0.20 5.49 -4.23 -1.26 -0.47 115.64 116.53 3cfk s THR 22 Ca 0.21 -2.03 -0.04 0.00 -1.18 0.00 0.00 61.69 58.65 3cfk s THR 22 Cb -0.15 -2.80 0.10 0.00 1.34 0.00 0.00 72.50 70.99 3cfk s THR 22 CO 0.10 -0.14 0.30 0.00 -0.54 0.00 0.00 174.62 174.34 3cfk s ARG 24 N 2.45 1.94 0.10 0.00 1.70 -0.33 -1.50 118.95 123.31 3cfk s ARG 24 Ca 0.07 -1.83 0.08 0.00 -0.47 0.00 0.00 55.73 53.58 3cfk s ARG 24 Cb -0.14 -1.82 -0.03 0.00 -0.57 0.00 0.00 34.95 32.38 3cfk s ARG 24 CO -0.13 0.15 -0.20 0.45 -1.08 0.00 0.00 175.30 174.50 3cfk s SER 25 N -3.65 2.39 0.00 -2.89 0.15 -1.26 -0.99 113.70 107.45 3cfk s SER 25 Ca 0.33 -0.67 0.26 0.00 0.70 0.00 0.00 55.95 56.57 3cfk s SER 25 Cb 0.01 -0.12 0.71 0.00 -1.71 0.00 0.00 66.02 64.90 3cfk s SER 25 CO 0.18 0.04 1.54 -1.54 1.20 0.00 0.00 173.24 174.66 3cfk n SER 26 N 1.13 0.80 0.16 5.45 3.41 -1.01 -3.65 113.62 119.91 3cfk n SER 26 Ca -0.20 -0.64 0.12 0.00 -0.26 0.00 0.00 58.87 57.90 3cfk n SER 26 Cb 0.54 0.15 0.24 0.00 -0.26 0.00 0.00 64.21 64.87 3cfk n SER 26 CO 0.00 0.00 0.00 0.28 -0.16 0.00 0.00 175.04 175.16 3cfk h SER 27 N 0.75 0.00 0.00 4.04 0.02 -1.95 -3.48 113.55 112.93 3cfk h SER 27 Ca 0.00 -0.01 0.00 0.00 -0.84 0.00 0.00 61.79 60.94 3cfk h SER 27 Cb 0.49 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.03 3cfk h SER 27 CO 0.00 0.01 0.00 0.61 -1.14 0.00 0.00 176.83 176.31 3cfk n GLY 27 N 1.19 0.77 3.71 -3.77 0.00 -1.24 -5.09 105.19 100.76 3cfk n GLY 27 Ca 0.04 -1.97 -0.43 0.00 0.00 0.00 0.00 46.02 43.66 3cfk n GLY 27 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3cfk n ALA 27 N -1.00 1.67 -2.40 4.61 0.00 -1.26 -4.28 120.51 117.85 3cfk n ALA 27 Ca 0.00 0.38 -0.42 0.00 0.00 0.00 0.00 53.44 53.40 3cfk n ALA 27 Cb 0.00 -2.33 -0.03 0.00 0.00 0.00 0.00 19.45 17.09 3cfk n ALA 27 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.50 177.58 3cfk s VAL 27 N -0.43 4.17 0.37 0.00 1.01 0.96 -4.99 120.40 121.50 3cfk s VAL 27 Ca 0.62 1.48 0.09 0.00 0.00 0.00 0.00 61.98 64.17 3cfk s VAL 27 Cb -0.57 -3.95 -0.07 0.00 0.00 0.00 0.00 36.38 31.79 3cfk s VAL 27 CO 0.54 -0.05 -0.05 0.28 0.00 0.00 0.00 175.10 175.82 3cfk s THR 28 N 2.75 2.18 0.38 3.92 -1.32 -1.26 -4.67 115.64 117.62 3cfk s THR 28 Ca 0.57 -2.12 0.19 0.00 -1.21 0.00 0.00 61.69 59.12 3cfk s THR 28 Cb -0.25 -2.78 0.38 0.00 -1.51 0.00 0.00 72.50 68.35 3cfk s THR 28 CO 0.20 -0.13 1.69 0.74 -2.21 0.00 0.00 174.62 174.91 3cfk h THR 29 N 1.92 0.35 0.00 5.08 2.02 -1.99 -0.21 112.91 120.08 3cfk h THR 29 Ca -0.43 -0.11 0.00 0.00 0.77 0.00 0.00 66.41 66.64 3cfk h THR 29 Cb 1.25 0.01 0.00 0.00 -1.74 0.00 0.00 68.15 67.66 3cfk h THR 29 CO 0.74 0.06 0.00 -1.20 0.37 0.00 0.00 175.52 175.49 3cfk n SER 30 N -4.83 0.40 -0.02 4.18 7.64 -1.26 -1.51 113.62 118.22 3cfk n SER 30 Ca 0.31 0.64 0.13 0.00 1.01 0.00 0.00 58.87 60.96 3cfk n SER 30 Cb 1.03 -0.71 0.46 0.00 -1.01 0.00 0.00 64.21 63.98 3cfk n SER 30 CO 0.00 0.00 0.00 0.59 -3.01 0.00 0.00 175.04 172.62 3cfk n ASN 31 N -1.99 0.31 -4.03 6.43 5.03 -0.09 -4.85 115.26 116.07 3cfk n ASN 31 Ca 0.01 -0.02 -0.39 0.00 0.87 0.00 0.00 54.58 55.04 3cfk n ASN 31 Cb 0.11 -0.10 0.00 0.00 -1.02 0.00 0.00 39.78 38.77 3cfk n ASN 31 CO 0.00 0.00 0.00 -1.22 -1.83 0.00 0.00 177.26 174.21 3cfk n TYR 32 N -1.39 -1.49 -1.67 3.10 4.01 -0.57 -0.69 117.16 118.46 3cfk n TYR 32 Ca 0.08 0.29 -0.46 0.00 -0.16 0.00 0.00 57.90 57.65 3cfk n TYR 32 Cb 0.33 -3.00 -0.03 0.00 -0.31 0.00 0.00 39.34 36.32 3cfk n TYR 32 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 3cfk n ALA 33 N -4.76 1.16 -2.46 -0.72 0.00 -1.26 -4.27 120.51 108.19 3cfk n ALA 33 Ca -0.16 0.43 -0.27 0.00 0.00 0.00 0.00 53.44 53.44 3cfk n ALA 33 Cb 0.60 -2.30 -0.13 0.00 0.00 0.00 0.00 19.45 17.61 3cfk n ALA 33 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 177.50 178.49 3cfk s THR 34 N 0.40 1.90 -0.05 0.00 2.01 -0.71 -1.15 115.64 118.04 3cfk s THR 34 Ca 0.74 -1.47 0.05 0.00 0.31 0.00 0.00 61.69 61.32 3cfk s THR 34 Cb -0.67 -1.67 -0.00 0.00 0.01 0.00 0.00 72.50 70.16 3cfk s THR 34 CO 0.44 0.12 -0.20 0.26 -0.69 0.00 0.00 174.62 174.56 3cfk s TRP 35 N -0.97 1.98 -0.04 4.92 0.52 -0.62 -1.14 118.94 123.59 3cfk s TRP 35 Ca 0.09 -0.60 0.07 0.00 0.02 0.00 0.00 56.10 55.68 3cfk s TRP 35 Cb -0.10 -1.32 -0.02 0.00 -1.15 0.00 0.00 33.47 30.88 3cfk s TRP 35 CO 0.04 -0.20 -0.24 0.08 0.02 0.00 0.00 176.95 176.64 3cfk s VAL 36 N 0.02 2.19 -0.14 4.03 1.01 0.72 -0.19 120.40 128.04 3cfk s VAL 36 Ca -0.05 -1.04 -0.06 0.00 0.00 0.00 0.00 61.98 60.83 3cfk s VAL 36 Cb -0.13 -1.78 -0.04 0.00 0.00 0.00 0.00 36.38 34.43 3cfk s VAL 36 CO 0.03 0.58 0.08 -1.58 0.00 0.00 0.00 175.10 174.21 3cfk s GLN 37 N -0.46 3.56 -0.16 2.72 0.74 0.97 -1.00 119.66 126.03 3cfk s GLN 37 Ca 0.05 -0.28 0.01 0.00 0.05 0.00 0.00 55.36 55.19 3cfk s GLN 37 Cb -0.11 -3.12 0.00 0.00 1.10 0.00 0.00 33.01 30.88 3cfk s GLN 37 CO 0.01 0.56 -0.16 -2.00 -0.55 0.00 0.00 175.29 173.14 3cfk s GLU 38 N -0.43 3.16 0.26 1.67 2.12 0.11 -0.90 118.70 124.71 3cfk s GLU 38 Ca 0.10 -0.77 0.10 0.00 0.36 0.00 0.00 54.97 54.76 3cfk s GLU 38 Cb -0.12 -2.60 -0.04 0.00 0.26 0.00 0.00 34.13 31.63 3cfk s GLU 38 CO 0.02 -0.02 -0.06 0.15 -0.54 0.00 0.00 175.26 174.81 3cfk s LYS 39 N 0.89 2.14 0.43 4.30 1.02 -0.13 -1.37 119.74 127.01 3cfk s LYS 39 Ca -0.04 -1.49 -0.21 0.00 0.02 0.00 0.00 55.97 54.25 3cfk s LYS 39 Cb -0.15 -2.07 -0.14 0.00 -0.52 0.00 0.00 37.83 34.94 3cfk s LYS 39 CO -0.02 0.36 0.20 -2.30 -0.92 0.00 0.00 175.35 172.68 3cfk n PRO 40 N -0.76 0.16 -1.39 -1.68 -0.02 -1.26 -1.42 135.00 128.63 3cfk n PRO 40 Ca -0.06 0.06 -0.06 0.00 -2.02 0.00 0.00 63.50 61.42 3cfk n PRO 40 Cb 0.59 -1.16 -0.02 0.00 -0.02 0.00 0.00 33.50 32.89 3cfk n PRO 40 CO 0.00 0.00 0.00 -0.25 1.98 0.00 0.00 175.50 177.23 3cfk n ASP 41 N 1.99 -3.40 -3.64 2.55 8.00 -1.26 -4.02 116.55 116.76 3cfk n ASP 41 Ca 0.11 0.11 -0.25 0.00 0.71 0.00 0.00 54.79 55.48 3cfk n ASP 41 Cb 0.41 -1.73 0.04 0.00 -0.02 0.00 0.00 41.12 39.82 3cfk n ASP 41 CO 0.00 0.00 0.00 1.41 -0.39 0.00 0.00 177.20 178.22 3cfk n HIS 42 N -3.10 -1.97 -3.70 1.24 8.25 -0.99 -4.96 115.22 109.99 3cfk n HIS 42 Ca -0.06 0.69 -0.38 0.00 -0.26 0.00 0.00 57.72 57.71 3cfk n HIS 42 Cb 0.28 -3.93 -0.12 0.00 1.12 0.00 0.00 29.99 27.33 3cfk n HIS 42 CO 0.00 0.00 0.00 -0.51 0.64 0.00 0.00 176.34 176.47 3cfk s LEU 43 N -6.42 3.87 0.04 2.41 1.43 -0.51 -4.95 118.68 114.55 3cfk s LEU 43 Ca 0.25 -0.42 0.03 0.00 -1.03 0.00 0.00 54.13 52.95 3cfk s LEU 43 Cb -0.07 -1.97 -0.04 0.00 0.03 0.00 0.00 46.19 44.14 3cfk s LEU 43 CO 0.83 -0.14 0.01 -0.36 0.23 0.00 0.00 176.35 176.92 3cfk s PHE 44 N 1.61 3.06 -0.07 0.29 0.08 -1.26 -0.95 117.98 120.73 3cfk s PHE 44 Ca 0.05 0.04 -0.03 0.00 0.12 0.00 0.00 56.93 57.11 3cfk s PHE 44 Cb -0.16 -1.62 0.04 0.00 -0.57 0.00 0.00 43.02 40.71 3cfk s PHE 44 CO 0.05 0.47 0.11 0.99 -0.10 0.00 0.00 175.22 176.75 3cfk s THR 45 N -1.20 -0.19 0.01 0.64 2.01 -0.07 -4.96 115.64 111.88 3cfk s THR 45 Ca 0.23 0.35 -0.30 0.00 0.31 0.00 0.00 61.69 62.27 3cfk s THR 45 Cb -0.12 -0.26 -0.06 0.00 0.01 0.00 0.00 72.50 72.08 3cfk s THR 45 CO 0.14 0.13 1.47 -0.83 -0.69 0.00 0.00 174.62 174.84 3cfk s GLY 46 N 2.23 1.77 -0.22 4.40 0.00 -1.26 -0.02 107.32 114.22 3cfk s GLY 46 Ca 0.04 0.95 -0.12 0.00 0.00 0.00 0.00 44.72 45.60 3cfk s GLY 46 CO -0.05 2.62 -0.29 1.04 0.00 0.00 0.00 173.10 176.42 3cfk n LEU 47 N 5.52 1.63 -4.08 0.66 4.77 0.73 -4.77 117.00 121.47 3cfk n LEU 47 Ca 0.14 0.28 -0.21 0.00 -0.03 0.00 0.00 56.01 56.19 3cfk n LEU 47 Cb 0.43 -0.67 -0.15 0.00 -2.33 0.00 0.00 43.42 40.70 3cfk n LEU 47 CO 0.60 0.38 -0.46 -0.63 -1.33 0.00 0.00 177.39 175.94 3cfk s ILE 48 N -2.46 0.96 0.23 -0.08 -1.09 -1.13 -1.61 121.20 116.01 3cfk s ILE 48 Ca -0.31 -0.53 0.06 0.00 -2.23 0.00 0.00 60.65 57.64 3cfk s ILE 48 Cb 0.11 -0.80 -0.05 0.00 -1.58 0.00 0.00 42.46 40.14 3cfk s ILE 48 CO 0.40 0.26 -0.09 -0.83 -1.23 0.00 0.00 174.94 173.45 3cfk s GLY 49 N -0.32 1.53 -1.52 6.18 0.00 0.35 -1.58 107.32 111.95 3cfk s GLY 49 Ca 0.05 -1.73 -0.13 0.00 0.00 0.00 0.00 44.72 42.90 3cfk s GLY 49 CO -0.00 -1.74 0.93 0.61 0.00 0.00 0.00 173.10 172.89 3cfk n GLY 50 N -0.43 -0.47 5.00 0.20 0.00 -1.14 -1.38 105.19 106.98 3cfk n GLY 50 Ca -0.07 0.18 0.00 0.00 0.00 0.00 0.00 46.02 46.13 3cfk n GLY 50 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 3cfk n THR 51 N -4.62 0.00 -1.91 2.61 -1.04 -0.30 -4.08 114.28 104.94 3cfk n THR 51 Ca 0.01 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 62.02 3cfk n THR 51 Cb 0.54 0.00 0.00 0.00 -1.82 0.00 0.00 70.33 69.05 3cfk n THR 51 CO 0.00 0.00 0.00 -0.46 -0.64 0.00 0.00 175.07 173.97 3cfk n ASN 52 N 2.37 0.00 -4.54 8.00 6.94 -1.21 -3.12 115.26 123.70 3cfk n ASN 52 Ca 0.00 -1.89 -0.40 0.00 -0.02 0.00 0.00 54.58 52.27 3cfk n ASN 52 Cb 0.00 -0.18 -0.10 0.00 -2.36 0.00 0.00 39.78 37.14 3cfk n ASN 52 CO 0.00 0.00 0.00 -0.54 -1.03 0.00 0.00 177.26 175.69 3cfk s LYS 53 N 0.00 3.59 0.15 -3.83 3.01 -0.48 -4.68 119.74 117.50 3cfk s LYS 53 Ca 0.00 -0.51 -0.30 0.00 -1.01 0.00 0.00 55.97 54.15 3cfk s LYS 53 Cb 0.00 -3.78 -0.07 0.00 -1.01 0.00 0.00 37.83 32.97 3cfk s LYS 53 CO 0.00 -0.42 1.06 0.50 0.51 0.00 0.00 175.35 177.00 3cfk s ARG 54 N 1.82 4.62 0.53 1.68 3.52 -1.26 -0.50 118.95 129.36 3cfk s ARG 54 Ca 0.08 1.63 -0.18 0.00 -0.13 0.00 0.00 55.73 57.13 3cfk s ARG 54 Cb -0.17 -3.32 -0.07 0.00 -1.56 0.00 0.00 34.95 29.84 3cfk s ARG 54 CO 0.11 0.10 1.04 0.00 -0.81 0.00 0.00 175.30 175.74 3cfk s ALA 55 N -0.06 2.84 0.24 6.12 0.00 -0.63 -4.92 121.76 125.35 3cfk s ALA 55 Ca 0.49 0.49 -0.30 0.00 0.00 0.00 0.00 51.96 52.64 3cfk s ALA 55 Cb -0.27 -3.23 -0.14 0.00 0.00 0.00 0.00 23.12 19.47 3cfk s ALA 55 CO 0.33 -0.49 1.14 -2.30 0.00 0.00 0.00 175.76 174.44 3cfk n PRO 56 N -1.41 1.43 0.00 0.00 -0.02 -1.26 -1.83 135.00 131.91 3cfk n PRO 56 Ca 0.09 0.50 0.00 0.00 -2.02 0.00 0.00 63.50 62.07 3cfk n PRO 56 Cb 0.53 -1.98 0.00 0.00 -0.02 0.00 0.00 33.50 32.03 3cfk n PRO 56 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3cfk n GLY 57 N 1.65 2.78 3.72 -1.23 0.00 -1.26 -5.01 105.19 105.84 3cfk n GLY 57 Ca 0.12 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.72 3cfk n GLY 57 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3cfk s VAL 58 N -2.38 4.73 0.41 1.61 1.01 -0.76 -4.99 120.40 120.03 3cfk s VAL 58 Ca 0.00 2.02 -0.26 0.00 0.00 0.00 0.00 61.98 63.74 3cfk s VAL 58 Cb 0.00 -4.30 -0.10 0.00 0.00 0.00 0.00 36.38 31.98 3cfk s VAL 58 CO 0.00 0.23 1.27 -2.65 0.00 0.00 0.00 175.10 173.96 3cfk n PRO 59 N 3.42 1.96 0.05 2.72 -0.02 -1.26 -4.89 135.00 136.99 3cfk n PRO 59 Ca 0.04 0.70 0.05 0.00 -2.02 0.00 0.00 63.50 62.27 3cfk n PRO 59 Cb 0.50 -2.38 0.48 0.00 -0.02 0.00 0.00 33.50 32.08 3cfk n PRO 59 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 3cfk h ALA 60 N 2.16 1.80 -1.43 3.55 0.00 -1.99 -2.15 119.26 121.20 3cfk h ALA 60 Ca -0.48 -0.02 0.46 0.00 0.00 0.00 0.00 54.91 54.87 3cfk h ALA 60 Cb 1.29 -0.12 -0.11 0.00 0.00 0.00 0.00 17.79 18.85 3cfk h ALA 60 CO 0.60 0.18 0.96 -2.13 0.00 0.00 0.00 179.25 178.86 3cfk n ARG 61 N -4.49 -0.02 -3.44 0.00 0.63 -1.26 -4.43 116.66 103.65 3cfk n ARG 61 Ca 0.02 1.08 -0.38 0.00 -0.92 0.00 0.00 57.85 57.65 3cfk n ARG 61 Cb 0.09 -2.24 -0.06 0.00 0.45 0.00 0.00 32.46 30.70 3cfk n ARG 61 CO 0.00 0.00 0.00 -0.06 -2.51 0.00 0.00 177.63 175.06 3cfk s PHE 62 N -4.94 3.64 0.08 -0.14 0.08 -0.81 -1.16 117.98 114.73 3cfk s PHE 62 Ca -0.06 0.93 -0.12 0.00 0.12 0.00 0.00 56.93 57.80 3cfk s PHE 62 Cb 0.27 -2.38 0.02 0.00 -0.57 0.00 0.00 43.02 40.35 3cfk s PHE 62 CO 0.76 0.46 0.28 -1.54 -0.10 0.00 0.00 175.22 175.09 3cfk s SER 63 N -0.43 -0.06 0.12 1.36 1.04 -0.71 -4.95 113.70 110.07 3cfk s SER 63 Ca 0.24 -0.39 0.09 0.00 0.48 0.00 0.00 55.95 56.37 3cfk s SER 63 Cb -0.16 0.38 -0.04 0.00 0.10 0.00 0.00 66.02 66.30 3cfk s SER 63 CO 0.12 -0.71 -0.23 -0.83 0.98 0.00 0.00 173.24 172.57 3cfk s GLY 64 N -2.51 1.37 0.19 7.32 0.00 -1.26 -0.65 107.32 111.77 3cfk s GLY 64 Ca 0.00 -1.35 -0.10 0.00 0.00 0.00 0.00 44.72 43.28 3cfk s GLY 64 CO -0.08 -1.35 0.51 -1.14 0.00 0.00 0.00 173.10 171.04 3cfk n SER 65 N 0.94 -1.22 -4.59 1.64 3.41 -0.64 -4.21 113.62 108.95 3cfk n SER 65 Ca -0.18 -1.78 -0.34 0.00 -0.26 0.00 0.00 58.87 56.30 3cfk n SER 65 Cb 0.54 2.02 -0.11 0.00 -0.26 0.00 0.00 64.21 66.40 3cfk n SER 65 CO 0.00 0.00 0.00 -0.76 -0.16 0.00 0.00 175.04 174.12 3cfk s LEU 66 N 0.00 3.30 -0.24 1.04 1.43 -1.26 -0.48 118.68 122.47 3cfk s LEU 66 Ca 0.11 -0.01 0.01 0.00 -1.03 0.00 0.00 54.13 53.21 3cfk s LEU 66 Cb -0.02 -1.75 0.06 0.00 0.03 0.00 0.00 46.19 44.51 3cfk s LEU 66 CO 0.06 0.31 -0.07 -0.63 0.23 0.00 0.00 176.35 176.25 3cfk s ILE 67 N -0.51 1.71 0.00 -0.59 1.01 -0.04 -4.93 121.20 117.85 3cfk s ILE 67 Ca 0.08 -1.33 0.00 0.00 0.00 0.00 0.00 60.65 59.40 3cfk s ILE 67 Cb -0.12 -1.93 0.00 0.00 0.01 0.00 0.00 42.46 40.42 3cfk s ILE 67 CO 0.02 -0.07 0.00 0.61 0.00 0.00 0.00 174.94 175.50 3cfk n GLY 68 N 4.61 2.68 0.26 6.18 0.00 -1.26 -1.14 105.19 116.51 3cfk n GLY 68 Ca -0.13 0.32 0.12 0.00 0.00 0.00 0.00 46.02 46.34 3cfk n GLY 68 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 3cfk h ASP 69 N 0.00 0.00 -2.12 1.61 3.32 -1.97 -3.45 116.42 113.81 3cfk h ASP 69 Ca 0.00 0.00 -0.54 0.00 0.02 0.00 0.00 57.03 56.51 3cfk h ASP 69 Cb 0.00 0.00 -0.08 0.00 0.22 0.00 0.00 39.33 39.47 3cfk h ASP 69 CO 0.00 0.12 -0.59 -0.13 -1.72 0.00 0.00 179.24 176.92 3cfk s ARG 70 N -4.25 2.45 0.27 3.56 0.52 -0.29 -0.03 118.95 121.17 3cfk s ARG 70 Ca -0.03 -1.38 -0.14 0.00 -0.52 0.00 0.00 55.73 53.67 3cfk s ARG 70 Cb 0.13 -2.25 -0.08 0.00 0.52 0.00 0.00 34.95 33.27 3cfk s ARG 70 CO 0.60 0.30 0.66 0.00 0.02 0.00 0.00 175.30 176.88 3cfk s ALA 71 N -2.31 3.43 -0.01 2.13 0.00 -0.56 -0.86 121.76 123.57 3cfk s ALA 71 Ca 0.33 -0.05 0.01 0.00 0.00 0.00 0.00 51.96 52.25 3cfk s ALA 71 Cb -0.06 -2.65 -0.00 0.00 0.00 0.00 0.00 23.12 20.41 3cfk s ALA 71 CO 0.22 0.40 -0.05 0.00 0.00 0.00 0.00 175.76 176.32 3cfk s ALA 72 N -1.84 0.43 -0.20 0.00 0.00 0.37 -0.65 121.76 119.86 3cfk s ALA 72 Ca 0.50 -0.20 -0.03 0.00 0.00 0.00 0.00 51.96 52.23 3cfk s ALA 72 Cb -0.12 -0.13 -0.01 0.00 0.00 0.00 0.00 23.12 22.87 3cfk s ALA 72 CO 0.19 0.09 -0.05 -1.17 0.00 0.00 0.00 175.76 174.82 3cfk s LEU 73 N -0.04 2.92 -0.13 0.00 2.96 0.38 -1.62 118.68 123.15 3cfk s LEU 73 Ca 0.01 -0.35 -0.03 0.00 -0.22 0.00 0.00 54.13 53.54 3cfk s LEU 73 Cb -0.03 -1.73 -0.03 0.00 0.50 0.00 0.00 46.19 44.90 3cfk s LEU 73 CO -0.00 0.03 -0.01 -0.89 -1.32 0.00 0.00 176.35 174.16 3cfk s THR 74 N 1.17 4.16 -0.28 3.68 2.01 0.17 -0.05 115.64 126.51 3cfk s THR 74 Ca 0.02 -0.28 -0.04 0.00 0.31 0.00 0.00 61.69 61.70 3cfk s THR 74 Cb -0.14 -2.80 0.02 0.00 0.01 0.00 0.00 72.50 69.59 3cfk s THR 74 CO -0.01 0.54 0.01 -0.63 -0.69 0.00 0.00 174.62 173.84 3cfk s ILE 75 N -0.18 3.42 -0.51 1.82 1.01 0.27 -1.74 121.20 125.29 3cfk s ILE 75 Ca 0.04 -0.90 -0.17 0.00 0.00 0.00 0.00 60.65 59.63 3cfk s ILE 75 Cb -0.13 -2.77 0.09 0.00 0.01 0.00 0.00 42.46 39.66 3cfk s ILE 75 CO 0.02 0.11 0.51 -0.89 0.00 0.00 0.00 174.94 174.70 3cfk s THR 76 N 1.40 5.09 0.00 2.92 2.01 -0.30 -1.75 115.64 125.01 3cfk s THR 76 Ca 0.01 -1.05 0.00 0.00 0.31 0.00 0.00 61.69 60.96 3cfk s THR 76 Cb -0.17 -4.27 0.00 0.00 0.01 0.00 0.00 72.50 68.07 3cfk s THR 76 CO -0.01 -0.78 0.00 0.61 -0.69 0.00 0.00 174.62 173.75 3cfk n GLY 77 N 5.22 0.90 3.67 4.40 0.00 -1.03 -4.75 105.19 113.60 3cfk n GLY 77 Ca -0.11 -0.55 -0.45 0.00 0.00 0.00 0.00 46.02 44.91 3cfk n GLY 77 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3cfk n ALA 78 N -0.74 1.09 -2.79 4.61 0.00 -0.35 -4.42 120.51 117.90 3cfk n ALA 78 Ca 0.00 0.41 -0.24 0.00 0.00 0.00 0.00 53.44 53.60 3cfk n ALA 78 Cb 0.25 -2.27 -0.05 0.00 0.00 0.00 0.00 19.45 17.38 3cfk n ALA 78 CO 0.00 0.00 0.00 -0.65 0.00 0.00 0.00 177.50 176.85 3cfk s GLN 79 N -0.53 2.85 0.47 0.00 -0.21 -1.26 -0.69 119.66 120.29 3cfk s GLN 79 Ca 0.67 -0.99 0.17 0.00 0.02 0.00 0.00 55.36 55.23 3cfk s GLN 79 Cb -0.65 -2.57 1.16 0.00 1.00 0.00 0.00 33.01 31.95 3cfk s GLN 79 CO 0.51 0.44 2.02 1.79 -2.12 0.00 0.00 175.29 177.93 3cfk h THR 80 N 1.84 0.89 0.00 -0.19 1.35 -1.95 0.21 112.91 115.06 3cfk h THR 80 Ca -0.48 -0.08 0.00 0.00 -0.55 0.00 0.00 66.41 65.30 3cfk h THR 80 Cb 1.22 0.63 0.00 0.00 -1.73 0.00 0.00 68.15 68.27 3cfk h THR 80 CO 0.62 0.04 0.00 -1.84 -0.25 0.00 0.00 175.52 174.09 3cfk n GLU 81 N -4.46 0.11 0.00 4.72 0.00 -1.24 -2.73 120.64 117.04 3cfk n GLU 81 Ca 0.07 0.19 0.15 0.00 0.00 0.00 0.00 57.16 57.57 3cfk n GLU 81 Cb 0.36 -1.50 0.85 0.00 0.00 0.00 0.00 31.44 31.15 3cfk n GLU 81 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.13 176.88 3cfk n ASP 82 N -1.39 0.07 -4.65 -1.84 8.00 0.06 -4.82 116.55 111.98 3cfk n ASP 82 Ca 0.06 -0.67 -0.43 0.00 0.71 0.00 0.00 54.79 54.46 3cfk n ASP 82 Cb 0.15 -0.11 -0.03 0.00 -0.02 0.00 0.00 41.12 41.11 3cfk n ASP 82 CO 0.00 0.00 0.00 -0.62 -0.39 0.00 0.00 177.20 176.19 3cfk n GLU 83 N -1.07 2.69 -3.78 -1.24 1.02 -1.11 -4.85 120.64 112.30 3cfk n GLU 83 Ca 0.20 0.97 0.03 0.00 -0.02 0.00 0.00 57.16 58.33 3cfk n GLU 83 Cb 0.18 -3.00 0.00 0.00 -0.02 0.00 0.00 31.44 28.60 3cfk n GLU 83 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 3cfk s ALA 84 N 4.88 -2.40 -0.17 0.62 0.00 -1.22 -4.88 121.76 118.59 3cfk s ALA 84 Ca 0.91 0.44 -0.07 0.00 0.00 0.00 0.00 51.96 53.24 3cfk s ALA 84 Cb -0.45 0.59 -0.04 0.00 0.00 0.00 0.00 23.12 23.21 3cfk s ALA 84 CO 0.42 -1.10 0.07 0.42 0.00 0.00 0.00 175.76 175.57 3cfk s ILE 85 N -2.17 4.86 -0.18 0.00 1.01 -0.47 -1.00 121.20 123.25 3cfk s ILE 85 Ca 0.21 -0.02 -0.02 0.00 0.00 0.00 0.00 60.65 60.83 3cfk s ILE 85 Cb 0.03 -3.17 -0.01 0.00 0.01 0.00 0.00 42.46 39.32 3cfk s ILE 85 CO -0.03 0.49 -0.08 -0.31 0.00 0.00 0.00 174.94 175.01 3cfk s TYR 86 N 0.10 2.91 -0.10 3.97 1.51 -0.64 0.07 117.35 125.17 3cfk s TYR 86 Ca 0.06 -0.76 -0.01 0.00 -1.01 0.00 0.00 57.07 55.34 3cfk s TYR 86 Cb -0.12 -1.99 -0.03 0.00 -0.11 0.00 0.00 41.96 39.71 3cfk s TYR 86 CO 0.01 -0.36 -0.04 -0.06 -1.11 0.00 0.00 175.55 173.98 3cfk s PHE 87 N 0.91 3.01 0.15 2.71 0.08 -0.17 -1.35 117.98 123.33 3cfk s PHE 87 Ca -0.01 -0.05 0.04 0.00 0.12 0.00 0.00 56.93 57.03 3cfk s PHE 87 Cb -0.15 -1.81 -0.04 0.00 -0.57 0.00 0.00 43.02 40.46 3cfk s PHE 87 CO 0.00 0.24 0.17 0.00 -0.10 0.00 0.00 175.22 175.53 3cfk s ALA 89 N -1.72 0.19 -0.03 0.00 0.00 -0.29 -0.26 121.76 119.64 3cfk s ALA 89 Ca 0.32 -0.06 0.06 0.00 0.00 0.00 0.00 51.96 52.28 3cfk s ALA 89 Cb -0.10 -0.08 -0.02 0.00 0.00 0.00 0.00 23.12 22.91 3cfk s ALA 89 CO 0.25 0.03 -0.20 -0.51 0.00 0.00 0.00 175.76 175.33 3cfk s LEU 90 N 0.09 2.41 0.26 0.00 1.43 0.16 -1.74 118.68 121.29 3cfk s LEU 90 Ca -0.01 -0.34 -0.17 0.00 -1.03 0.00 0.00 54.13 52.59 3cfk s LEU 90 Cb -0.03 -1.45 -0.08 0.00 0.03 0.00 0.00 46.19 44.66 3cfk s LEU 90 CO -0.00 0.33 0.72 0.26 0.23 0.00 0.00 176.35 177.88 3cfk s TRP 91 N -0.69 3.53 -0.25 0.29 0.52 0.13 -0.42 118.94 122.05 3cfk s TRP 91 Ca 0.11 1.29 -0.04 0.00 0.02 0.00 0.00 56.10 57.48 3cfk s TRP 91 Cb -0.10 -2.57 0.13 0.00 -1.15 0.00 0.00 33.47 29.78 3cfk s TRP 91 CO 0.00 0.24 0.47 1.21 0.02 0.00 0.00 176.95 178.89 3cfk s ASN 92 N -1.92 -0.43 0.00 2.95 3.84 0.34 -4.53 114.94 115.19 3cfk s ASN 92 Ca 0.47 0.75 0.00 0.00 0.21 0.00 0.00 52.86 54.29 3cfk s ASN 92 Cb -0.14 1.56 0.00 0.00 -0.55 0.00 0.00 41.25 42.12 3cfk s ASN 92 CO 0.19 -0.26 0.00 -0.24 -2.79 0.00 0.00 177.10 174.00 3cfk n SER 93 N 5.40 0.00 0.16 -4.21 2.88 -1.26 0.33 113.62 116.91 3cfk n SER 93 Ca -0.05 0.00 0.12 0.00 -1.33 0.00 0.00 58.87 57.61 3cfk n SER 93 Cb 0.50 0.00 0.59 0.00 -0.75 0.00 0.00 64.21 64.55 3cfk n SER 93 CO 0.00 0.00 0.00 0.78 -1.23 0.00 0.00 175.04 174.59 3cfk h ASN 94 N 0.00 0.00 -3.40 -3.46 4.21 -2.03 -3.47 115.58 107.42 3cfk h ASN 94 Ca 0.00 0.00 -0.45 0.00 1.21 0.00 0.00 56.30 57.06 3cfk h ASN 94 Cb 0.00 0.00 -0.14 0.00 -1.12 0.00 0.00 38.32 37.06 3cfk h ASN 94 CO 0.00 0.00 -0.63 -1.00 -1.29 0.00 0.00 177.43 174.51 3cfk s HIS 95 N -3.50 1.85 -0.08 1.19 3.76 0.15 -5.15 115.29 113.50 3cfk s HIS 95 Ca -0.00 -0.92 0.04 0.00 -0.15 0.00 0.00 55.06 54.03 3cfk s HIS 95 Cb 0.08 -1.15 -0.01 0.00 1.11 0.00 0.00 32.58 32.60 3cfk s HIS 95 CO 0.28 0.02 -0.22 -1.17 -0.85 0.00 0.00 174.74 172.80 3cfk s LEU 96 N -3.43 2.24 -0.13 0.89 2.96 -1.26 -0.50 118.68 119.45 3cfk s LEU 96 Ca 0.34 -0.47 -0.00 0.00 -0.22 0.00 0.00 54.13 53.78 3cfk s LEU 96 Cb 0.07 -1.44 0.02 0.00 0.50 0.00 0.00 46.19 45.35 3cfk s LEU 96 CO 0.13 0.22 -0.11 -0.69 -1.32 0.00 0.00 176.35 174.59 3cfk s VAL 97 N -0.00 1.29 0.28 1.68 1.01 0.44 -4.94 120.40 120.16 3cfk s VAL 97 Ca -0.07 -0.47 -0.24 0.00 0.00 0.00 0.00 61.98 61.20 3cfk s VAL 97 Cb -0.15 -1.26 -0.09 0.00 0.00 0.00 0.00 36.38 34.88 3cfk s VAL 97 CO 0.05 0.40 0.86 -0.36 0.00 0.00 0.00 175.10 176.05 3cfk s PHE 98 N 1.60 3.69 0.98 5.22 0.08 -1.26 -0.67 117.98 127.63 3cfk s PHE 98 Ca 0.05 1.64 -0.14 0.00 0.12 0.00 0.00 56.93 58.60 3cfk s PHE 98 Cb -0.13 -2.81 0.18 0.00 -0.57 0.00 0.00 43.02 39.69 3cfk s PHE 98 CO -0.09 0.27 1.16 0.20 -0.10 0.00 0.00 175.22 176.66 3cfk s GLY 99 N -1.60 1.61 0.10 4.36 0.00 0.63 -4.55 107.32 107.87 3cfk s GLY 99 Ca 0.47 -0.71 0.27 0.00 0.00 0.00 0.00 44.72 44.75 3cfk s GLY 99 CO 0.23 -0.05 1.84 0.61 0.00 0.00 0.00 173.10 175.73 3cfk n GLY 100 N -2.14 -1.57 0.00 0.20 0.00 -1.25 -4.77 105.19 95.65 3cfk n GLY 100 Ca 0.09 -0.06 0.00 0.00 0.00 0.00 0.00 46.02 46.05 3cfk n GLY 100 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3cfk n GLY 101 N 1.32 1.42 2.95 -0.02 0.00 -1.26 -5.03 105.19 104.58 3cfk n GLY 101 Ca 0.06 -1.67 -0.29 0.00 0.00 0.00 0.00 46.02 44.12 3cfk n GLY 101 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3cfk s THR 102 N -2.30 1.39 -0.06 2.61 2.01 -0.46 -4.44 115.64 114.40 3cfk s THR 102 Ca 0.00 -0.75 -0.30 0.00 0.31 0.00 0.00 61.69 60.95 3cfk s THR 102 Cb 0.00 -1.47 -0.04 0.00 0.01 0.00 0.00 72.50 71.00 3cfk s THR 102 CO 0.00 0.22 1.35 -0.54 -0.69 0.00 0.00 174.62 174.96 3cfk s LYS 103 N 1.52 4.27 -0.35 4.92 1.02 -0.24 -1.62 119.74 129.27 3cfk s LYS 103 Ca 0.01 1.84 -0.12 0.00 0.02 0.00 0.00 55.97 57.73 3cfk s LYS 103 Cb -0.15 -3.67 -0.00 0.00 -0.52 0.00 0.00 37.83 33.49 3cfk s LYS 103 CO -0.08 -0.61 0.22 -1.17 -0.92 0.00 0.00 175.35 172.78 3cfk s LEU 104 N 2.85 4.52 -0.18 3.17 2.96 -0.17 -0.75 118.68 131.07 3cfk s LEU 104 Ca 0.61 -0.62 -0.11 0.00 -0.22 0.00 0.00 54.13 53.78 3cfk s LEU 104 Cb -0.27 -2.08 -0.05 0.00 0.50 0.00 0.00 46.19 44.29 3cfk s LEU 104 CO 0.23 -0.28 0.20 -0.70 -1.32 0.00 0.00 176.35 174.47 3cfk s GLU 105 N 1.65 4.17 -0.19 1.98 2.12 0.63 -3.45 118.70 125.62 3cfk s GLU 105 Ca 0.05 -0.09 -0.17 0.00 0.36 0.00 0.00 54.97 55.13 3cfk s GLU 105 Cb -0.18 -3.41 -0.04 0.00 0.26 0.00 0.00 34.13 30.77 3cfk s GLU 105 CO 0.08 0.31 0.43 0.42 -0.54 0.00 0.00 175.26 175.96 3cfk s ILE 106 N 0.31 5.19 0.51 -3.70 -1.09 -1.26 -1.45 121.20 119.70 3cfk s ILE 106 Ca 0.12 0.78 -0.19 0.00 -2.23 0.00 0.00 60.65 59.13 3cfk s ILE 106 Cb -0.12 -3.76 -0.07 0.00 -1.58 0.00 0.00 42.46 36.93 3cfk s ILE 106 CO 0.01 0.26 1.04 -0.75 -1.23 0.00 0.00 174.94 174.27 3cfk s LYS 107 N 1.22 3.69 0.32 2.79 2.20 0.12 -4.94 119.74 125.15 3cfk s LYS 107 Ca 0.21 1.32 -0.11 0.00 -0.36 0.00 0.00 55.97 57.02 3cfk s LYS 107 Cb -0.15 -2.08 0.02 0.00 -1.51 0.00 0.00 37.83 34.11 3cfk s LYS 107 CO 0.08 -0.52 0.59 -0.98 -0.36 0.00 0.00 175.35 174.17 3cfk s ARG 108 N -3.45 1.90 0.56 4.03 1.04 -1.26 -4.53 118.95 117.24 3cfk s ARG 108 Ca 0.66 -1.45 -0.19 0.00 -1.04 0.00 0.00 55.73 53.71 3cfk s ARG 108 Cb -0.16 0.52 -0.05 0.00 -2.04 0.00 0.00 34.95 33.22 3cfk s ARG 108 CO 0.24 -0.83 1.15 0.95 -0.04 0.00 0.00 175.30 176.78 3cfk s THR 109 N -3.18 3.00 0.30 4.99 -4.23 -1.26 -4.94 115.64 110.32 3cfk s THR 109 Ca 0.22 0.63 -0.30 0.00 -1.18 0.00 0.00 61.69 61.06 3cfk s THR 109 Cb -0.02 -3.25 -0.11 0.00 1.34 0.00 0.00 72.50 70.45 3cfk s THR 109 CO 0.13 -0.13 1.54 0.68 -0.54 0.00 0.00 174.62 176.30 3cfk s VAL 110 N -1.71 2.19 -0.10 2.29 -7.23 -1.26 -4.83 120.40 109.76 3cfk s VAL 110 Ca 0.74 0.17 0.01 0.00 -1.81 0.00 0.00 61.98 61.09 3cfk s VAL 110 Cb -0.26 -3.11 0.02 0.00 0.56 0.00 0.00 36.38 33.59 3cfk s VAL 110 CO 0.29 0.03 -0.11 0.00 -0.31 0.00 0.00 175.10 175.00 3cfk s ALA 111 N -0.21 1.38 0.44 1.32 0.00 0.65 -4.94 121.76 120.39 3cfk s ALA 111 Ca 0.60 -0.54 -0.23 0.00 0.00 0.00 0.00 51.96 51.79 3cfk s ALA 111 Cb -0.46 -0.78 -0.08 0.00 0.00 0.00 0.00 23.12 21.79 3cfk s ALA 111 CO 0.50 -0.18 1.13 0.00 0.00 0.00 0.00 175.76 177.21 3cfk s ALA 112 N 1.22 3.03 0.37 0.00 0.00 -1.26 -1.36 121.76 123.76 3cfk s ALA 112 Ca -0.04 0.87 -0.25 0.00 0.00 0.00 0.00 51.96 52.54 3cfk s ALA 112 Cb -0.14 -3.35 -0.09 0.00 0.00 0.00 0.00 23.12 19.54 3cfk s ALA 112 CO -0.03 -0.51 1.07 -1.25 0.00 0.00 0.00 175.76 175.04 3cfk s PRO 113 N -2.60 4.26 0.20 0.00 0.04 -1.26 -4.55 135.00 131.09 3cfk s PRO 113 Ca 0.61 1.60 -0.30 0.00 0.04 0.00 0.00 61.00 62.96 3cfk s PRO 113 Cb -0.27 -2.70 -0.08 0.00 0.04 0.00 0.00 34.50 31.49 3cfk s PRO 113 CO 0.33 -0.07 1.03 -1.12 0.04 0.00 0.00 177.00 177.21 3cfk s SER 114 N -1.37 7.41 -0.05 6.66 0.01 -0.88 -4.85 113.70 120.62 3cfk s SER 114 Ca 0.55 2.04 0.06 0.00 1.31 0.00 0.00 55.95 59.90 3cfk s SER 114 Cb -0.25 -2.61 -0.01 0.00 0.21 0.00 0.00 66.02 63.36 3cfk s SER 114 CO 0.31 -0.08 -0.25 -0.69 0.41 0.00 0.00 173.24 172.95 3cfk s VAL 115 N -0.62 2.08 0.01 3.43 1.01 -1.26 -0.67 120.40 124.40 3cfk s VAL 115 Ca 0.46 -1.06 0.01 0.00 0.00 0.00 0.00 61.98 61.39 3cfk s VAL 115 Cb -0.28 -1.75 -0.01 0.00 0.00 0.00 0.00 36.38 34.34 3cfk s VAL 115 CO 0.34 0.57 -0.04 -0.36 0.00 0.00 0.00 175.10 175.62 3cfk s PHE 116 N -0.21 0.31 -0.02 5.22 0.40 -0.60 -4.99 117.98 118.08 3cfk s PHE 116 Ca -0.02 -0.26 0.07 0.00 -0.60 0.00 0.00 56.93 56.12 3cfk s PHE 116 Cb -0.13 -0.20 -0.02 0.00 0.51 0.00 0.00 43.02 43.18 3cfk s PHE 116 CO 0.03 -0.07 -0.24 -1.50 0.70 0.00 0.00 175.22 174.15 3cfk s ILE 117 N -0.68 1.88 -0.16 0.64 2.07 -1.26 -0.22 121.20 123.47 3cfk s ILE 117 Ca -0.06 -1.01 0.01 0.00 -1.41 0.00 0.00 60.65 58.19 3cfk s ILE 117 Cb -0.05 -1.56 0.02 0.00 0.13 0.00 0.00 42.46 41.00 3cfk s ILE 117 CO -0.00 0.53 -0.18 -0.36 -1.91 0.00 0.00 174.94 173.02 3cfk s PHE 118 N -0.48 2.47 0.75 3.50 0.08 0.69 -5.01 117.98 119.99 3cfk s PHE 118 Ca 0.07 -1.40 -0.11 0.00 0.12 0.00 0.00 56.93 55.62 3cfk s PHE 118 Cb -0.10 -1.75 0.04 0.00 -0.57 0.00 0.00 43.02 40.65 3cfk s PHE 118 CO -0.00 -0.71 1.08 -1.25 -0.10 0.00 0.00 175.22 174.24 3cfk s PRO 119 N 1.29 2.43 0.57 0.24 0.04 -1.26 -2.16 135.00 136.15 3cfk s PRO 119 Ca 0.03 1.12 -0.21 0.00 0.04 0.00 0.00 61.00 61.98 3cfk s PRO 119 Cb -0.13 -1.92 -0.04 0.00 0.04 0.00 0.00 34.50 32.45 3cfk s PRO 119 CO -0.10 -1.51 1.32 -1.25 0.04 0.00 0.00 177.00 175.50 3cfk s PRO 120 N -4.94 3.01 0.56 0.56 0.04 -1.19 -4.87 135.00 128.17 3cfk s PRO 120 Ca 0.60 2.13 -0.18 0.00 0.04 0.00 0.00 61.00 63.59 3cfk s PRO 120 Cb -0.16 -2.13 -0.05 0.00 0.04 0.00 0.00 34.50 32.20 3cfk s PRO 120 CO 0.56 -1.26 1.08 -1.54 0.04 0.00 0.00 177.00 175.88 3cfk s SER 121 N -1.15 5.81 0.53 6.66 1.04 -1.26 -4.92 113.70 120.41 3cfk s SER 121 Ca 0.74 1.96 0.21 0.00 0.48 0.00 0.00 55.95 59.34 3cfk s SER 121 Cb -0.38 -2.55 1.36 0.00 0.10 0.00 0.00 66.02 64.54 3cfk s SER 121 CO 0.44 -1.15 2.08 0.44 0.98 0.00 0.00 173.24 176.03 3cfk h ASP 122 N 0.85 0.00 -0.51 7.02 3.32 -2.00 -2.45 116.42 122.65 3cfk h ASP 122 Ca -0.48 0.00 -0.11 0.00 0.02 0.00 0.00 57.03 56.45 3cfk h ASP 122 Cb 1.23 0.00 -0.02 0.00 0.22 0.00 0.00 39.33 40.77 3cfk h ASP 122 CO 0.57 0.00 -0.12 -0.33 -1.72 0.00 0.00 179.24 177.64 3cfk h GLU 123 N 0.00 0.99 -0.43 3.56 5.08 -2.00 -2.66 114.58 119.12 3cfk h GLU 123 Ca 0.11 -0.38 -0.09 0.00 -1.00 0.00 0.00 59.36 58.01 3cfk h GLU 123 Cb 0.47 -0.06 -0.01 0.00 0.50 0.00 0.00 28.75 29.65 3cfk h GLU 123 CO -0.00 1.05 -0.09 0.37 -1.00 0.00 0.00 179.01 179.34 3cfk h GLN 124 N 0.86 0.82 -0.65 2.33 4.15 -1.77 -3.03 115.11 117.83 3cfk h GLN 124 Ca 0.13 -0.31 0.05 0.00 0.77 0.00 0.00 58.65 59.29 3cfk h GLN 124 Cb 0.69 -0.05 -0.04 0.00 0.21 0.00 0.00 27.48 28.29 3cfk h GLN 124 CO 0.05 0.93 0.43 -0.07 -1.93 0.00 0.00 178.83 178.24 3cfk h LEU 125 N 0.65 0.61 -1.70 -2.39 3.38 -1.38 0.13 115.31 114.61 3cfk h LEU 125 Ca 0.11 -0.00 0.17 0.00 0.09 0.00 0.00 57.88 58.24 3cfk h LEU 125 Cb 0.62 -0.14 -0.04 0.00 0.09 0.00 0.00 40.66 41.19 3cfk h LEU 125 CO 0.04 0.41 0.50 0.11 0.09 0.00 0.00 178.44 179.59 3cfk h LYS 126 N 0.71 0.27 0.00 1.13 1.57 -1.34 -2.40 116.57 116.51 3cfk h LYS 126 Ca 0.27 -0.02 0.00 0.00 -1.87 0.00 0.00 60.65 59.03 3cfk h LYS 126 Cb 0.17 -0.06 0.00 0.00 0.08 0.00 0.00 32.23 32.42 3cfk h LYS 126 CO -0.08 0.18 -0.16 0.66 -0.57 0.00 0.00 179.45 179.48 3cfk h SER 127 N 0.28 0.00 0.00 0.86 4.64 -0.81 -3.47 113.55 115.05 3cfk h SER 127 Ca 0.36 -0.05 0.00 0.00 -0.47 0.00 0.00 61.79 61.63 3cfk h SER 127 Cb 1.00 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.09 3cfk h SER 127 CO -0.09 0.03 0.00 0.61 -0.87 0.00 0.00 176.83 176.51 3cfk n GLY 128 N 1.30 0.77 3.48 -0.77 0.00 -0.90 -5.10 105.19 103.96 3cfk n GLY 128 Ca 0.05 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.84 3cfk n GLY 128 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 3cfk s THR 129 N -2.00 1.54 -0.04 2.61 -4.23 -1.25 -1.53 115.64 110.75 3cfk s THR 129 Ca 0.00 -2.05 -0.02 0.00 -1.18 0.00 0.00 61.69 58.45 3cfk s THR 129 Cb 0.00 -2.71 0.03 0.00 1.34 0.00 0.00 72.50 71.16 3cfk s THR 129 CO 0.00 -0.11 0.05 0.00 -0.54 0.00 0.00 174.62 174.02 3cfk s ALA 130 N -3.06 0.23 -0.15 3.99 0.00 -0.49 -3.56 121.76 118.72 3cfk s ALA 130 Ca 0.34 0.19 -0.03 0.00 0.00 0.00 0.00 51.96 52.46 3cfk s ALA 130 Cb 0.07 -0.55 -0.02 0.00 0.00 0.00 0.00 23.12 22.61 3cfk s ALA 130 CO 0.15 -0.41 -0.06 -1.12 0.00 0.00 0.00 175.76 174.32 3cfk s SER 131 N 1.94 4.60 -0.20 0.00 0.01 -1.26 -2.10 113.70 116.69 3cfk s SER 131 Ca 0.02 -0.18 -0.05 0.00 1.31 0.00 0.00 55.95 57.05 3cfk s SER 131 Cb -0.12 -1.74 -0.02 0.00 0.21 0.00 0.00 66.02 64.34 3cfk s SER 131 CO -0.03 0.16 -0.00 -0.69 0.41 0.00 0.00 173.24 173.09 3cfk s VAL 132 N 0.41 3.92 -0.09 3.43 1.01 0.04 -3.20 120.40 125.91 3cfk s VAL 132 Ca -0.05 -0.33 -0.01 0.00 0.00 0.00 0.00 61.98 61.59 3cfk s VAL 132 Cb -0.15 -2.77 -0.03 0.00 0.00 0.00 0.00 36.38 33.43 3cfk s VAL 132 CO 0.03 0.43 -0.04 -0.69 0.00 0.00 0.00 175.10 174.83 3cfk s VAL 133 N 1.00 3.91 -0.14 2.92 1.01 -0.92 -0.78 120.40 127.41 3cfk s VAL 133 Ca 0.02 -0.39 0.02 0.00 0.00 0.00 0.00 61.98 61.63 3cfk s VAL 133 Cb -0.14 -2.63 0.01 0.00 0.00 0.00 0.00 36.38 33.61 3cfk s VAL 133 CO 0.02 0.58 -0.21 0.00 0.00 0.00 0.00 175.10 175.49 3cfk s LEU 135 N 0.74 2.93 -0.29 0.00 2.96 0.69 -1.08 118.68 124.62 3cfk s LEU 135 Ca -0.09 -0.24 -0.03 0.00 -0.22 0.00 0.00 54.13 53.55 3cfk s LEU 135 Cb -0.16 -1.67 0.04 0.00 0.50 0.00 0.00 46.19 44.89 3cfk s LEU 135 CO 0.00 0.18 0.01 -0.76 -1.32 0.00 0.00 176.35 174.47 3cfk s LEU 136 N 0.26 3.79 -0.14 -0.68 1.02 0.49 -1.57 118.68 121.85 3cfk s LEU 136 Ca -0.07 -1.07 -0.01 0.00 0.02 0.00 0.00 54.13 53.00 3cfk s LEU 136 Cb -0.15 -1.75 -0.02 0.00 0.02 0.00 0.00 46.19 44.29 3cfk s LEU 136 CO 0.04 -0.23 -0.10 0.21 0.02 0.00 0.00 176.35 176.30 3cfk s ASN 137 N 1.33 4.26 -0.90 2.29 2.47 0.16 -0.10 114.94 124.44 3cfk s ASN 137 Ca -0.02 -0.27 -0.03 0.00 0.42 0.00 0.00 52.86 52.95 3cfk s ASN 137 Cb -0.19 -1.67 -0.04 0.00 -1.45 0.00 0.00 41.25 37.91 3cfk s ASN 137 CO -0.01 0.16 0.82 0.59 -3.72 0.00 0.00 177.10 174.94 3cfk n ASN 138 N 3.57 -7.14 -4.36 -4.21 5.03 -0.75 -2.07 115.26 105.33 3cfk n ASN 138 Ca -0.18 -0.42 -0.23 0.00 0.87 0.00 0.00 54.58 54.62 3cfk n ASN 138 Cb 0.53 -5.24 -0.11 0.00 -1.02 0.00 0.00 39.78 33.94 3cfk n ASN 138 CO 0.00 0.00 0.00 0.72 -1.83 0.00 0.00 177.26 176.15 3cfk s PHE 139 N -3.21 1.94 -0.20 3.10 -0.71 -0.08 -4.53 117.98 114.29 3cfk s PHE 139 Ca 0.25 -0.44 -0.17 0.00 -1.04 0.00 0.00 56.93 55.53 3cfk s PHE 139 Cb -0.03 -0.96 0.05 0.00 -1.21 0.00 0.00 43.02 40.87 3cfk s PHE 139 CO 0.74 0.38 0.52 -0.47 -1.34 0.00 0.00 175.22 175.05 3cfk s TYR 140 N -2.01 -0.60 0.35 3.49 6.14 -0.46 -0.39 117.35 123.86 3cfk s TYR 140 Ca 0.18 1.43 -0.06 0.00 0.64 0.00 0.00 57.07 59.25 3cfk s TYR 140 Cb -0.06 0.23 0.08 0.00 0.42 0.00 0.00 41.96 42.63 3cfk s TYR 140 CO 0.08 -0.30 0.39 -0.35 0.64 0.00 0.00 175.55 176.01 3cfk n PRO 141 N 3.05 -1.01 0.10 4.97 -0.04 -1.26 -0.25 135.00 140.56 3cfk n PRO 141 Ca -0.15 -0.62 -0.04 0.00 -0.04 0.00 0.00 63.50 62.66 3cfk n PRO 141 Cb 0.56 -0.48 0.04 0.00 -0.04 0.00 0.00 33.50 33.59 3cfk n PRO 141 CO 0.00 0.00 0.00 -0.09 -0.04 0.00 0.00 175.50 175.37 3cfk h ARG 142 N 0.00 0.00 -6.58 0.54 2.43 -1.99 -3.45 114.38 105.34 3cfk h ARG 142 Ca -0.14 0.00 -0.53 0.00 -0.81 0.00 0.00 59.98 58.51 3cfk h ARG 142 Cb 0.39 0.00 0.04 0.00 -0.42 0.00 0.00 29.97 29.98 3cfk h ARG 142 CO 0.09 0.78 0.94 -1.21 -1.51 0.00 0.00 179.97 179.06 3cfk s GLU 143 N -3.20 4.19 -0.27 0.20 2.02 -1.26 -4.97 118.70 115.41 3cfk s GLU 143 Ca -0.00 2.41 -0.18 0.00 0.02 0.00 0.00 54.97 57.22 3cfk s GLU 143 Cb 0.11 -3.26 0.07 0.00 0.10 0.00 0.00 34.13 31.16 3cfk s GLU 143 CO 0.79 -0.67 0.67 0.00 0.02 0.00 0.00 175.26 176.07 3cfk s ALA 144 N 1.55 -1.77 -0.13 5.21 0.00 -1.26 -4.62 121.76 120.74 3cfk s ALA 144 Ca 0.72 2.23 -0.04 0.00 0.00 0.00 0.00 51.96 54.87 3cfk s ALA 144 Cb -0.44 -1.31 -0.03 0.00 0.00 0.00 0.00 23.12 21.33 3cfk s ALA 144 CO 0.32 -0.36 0.02 0.21 0.00 0.00 0.00 175.76 175.96 3cfk s LYS 145 N 1.27 3.44 -0.13 0.00 2.20 -0.59 -4.99 119.74 120.94 3cfk s LYS 145 Ca -0.07 -0.39 0.03 0.00 -0.36 0.00 0.00 55.97 55.18 3cfk s LYS 145 Cb -0.05 -2.97 0.01 0.00 -1.51 0.00 0.00 37.83 33.30 3cfk s LYS 145 CO -0.14 0.50 -0.22 0.08 -0.36 0.00 0.00 175.35 175.21 3cfk s VAL 146 N -0.30 2.13 -0.09 4.02 1.01 -1.26 -1.78 120.40 124.12 3cfk s VAL 146 Ca 0.07 -0.97 0.03 0.00 0.00 0.00 0.00 61.98 61.12 3cfk s VAL 146 Cb -0.12 -1.84 0.00 0.00 0.00 0.00 0.00 36.38 34.42 3cfk s VAL 146 CO 0.02 0.55 -0.21 -1.10 0.00 0.00 0.00 175.10 174.36 3cfk s GLN 147 N 0.69 2.69 -0.10 2.72 -0.21 0.62 -4.96 119.66 121.11 3cfk s GLN 147 Ca -0.10 -0.75 -0.11 0.00 0.02 0.00 0.00 55.36 54.42 3cfk s GLN 147 Cb -0.16 -2.08 -0.05 0.00 1.00 0.00 0.00 33.01 31.73 3cfk s GLN 147 CO 0.01 0.12 0.25 -1.58 -2.12 0.00 0.00 175.29 171.98 3cfk s TRP 148 N 0.47 3.59 -0.01 0.91 0.52 -1.26 -0.11 118.94 123.04 3cfk s TRP 148 Ca -0.17 0.67 0.03 0.00 0.02 0.00 0.00 56.10 56.64 3cfk s TRP 148 Cb -0.17 -2.15 -0.00 0.00 -1.15 0.00 0.00 33.47 29.99 3cfk s TRP 148 CO 0.07 0.56 -0.09 0.15 0.02 0.00 0.00 176.95 177.66 3cfk s LYS 149 N -0.58 0.80 -0.17 4.98 1.02 -0.58 -0.52 119.74 124.70 3cfk s LYS 149 Ca 0.17 -0.32 0.01 0.00 0.02 0.00 0.00 55.97 55.85 3cfk s LYS 149 Cb -0.14 -0.77 0.03 0.00 -0.52 0.00 0.00 37.83 36.44 3cfk s LYS 149 CO 0.06 0.17 -0.13 0.08 -0.92 0.00 0.00 175.35 174.61 3cfk s VAL 150 N -0.08 1.59 -1.63 3.17 1.01 -0.68 -1.09 120.40 122.70 3cfk s VAL 150 Ca 0.01 -0.77 -0.13 0.00 0.00 0.00 0.00 61.98 61.09 3cfk s VAL 150 Cb -0.05 -1.56 0.11 0.00 0.00 0.00 0.00 36.38 34.88 3cfk s VAL 150 CO -0.00 0.35 0.67 0.47 0.00 0.00 0.00 175.10 176.58 3cfk n ASP 151 N 4.74 -2.42 0.00 3.32 8.00 0.12 -1.90 116.55 128.41 3cfk n ASP 151 Ca -0.16 -1.02 0.00 0.00 0.71 0.00 0.00 54.79 54.32 3cfk n ASP 151 Cb 0.49 -2.78 0.00 0.00 -0.02 0.00 0.00 41.12 38.80 3cfk n ASP 151 CO 0.00 0.00 0.00 0.59 -0.39 0.00 0.00 177.20 177.40 3cfk n ASN 152 N -2.75 -2.30 -4.70 -2.24 5.03 -1.26 -5.01 115.26 102.02 3cfk n ASN 152 Ca -0.03 0.00 -0.38 0.00 0.87 0.00 0.00 54.58 55.04 3cfk n ASN 152 Cb 0.55 -1.28 -0.07 0.00 -1.02 0.00 0.00 39.78 37.96 3cfk n ASN 152 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.26 175.43 3cfk s ALA 153 N -2.20 3.53 0.15 5.41 0.00 -0.80 -5.03 121.76 122.82 3cfk s ALA 153 Ca 0.00 -0.38 -0.31 0.00 0.00 0.00 0.00 51.96 51.27 3cfk s ALA 153 Cb 0.00 -2.60 -0.09 0.00 0.00 0.00 0.00 23.12 20.43 3cfk s ALA 153 CO 0.00 -0.12 1.47 -1.17 0.00 0.00 0.00 175.76 175.94 3cfk s LEU 154 N 0.92 4.37 0.22 0.00 2.96 -1.26 -1.69 118.68 124.21 3cfk s LEU 154 Ca 0.21 2.48 -0.12 0.00 -0.22 0.00 0.00 54.13 56.48 3cfk s LEU 154 Cb -0.15 -3.59 -0.08 0.00 0.50 0.00 0.00 46.19 42.88 3cfk s LEU 154 CO 0.08 -0.73 0.59 -1.10 -1.32 0.00 0.00 176.35 173.87 3cfk s GLN 155 N 1.02 3.91 -0.07 1.98 -1.52 0.33 -4.95 119.66 120.36 3cfk s GLN 155 Ca 0.67 0.44 -0.03 0.00 -1.95 0.00 0.00 55.36 54.48 3cfk s GLN 155 Cb -0.40 -2.69 0.04 0.00 -0.22 0.00 0.00 33.01 29.73 3cfk s GLN 155 CO 0.31 0.33 0.16 0.45 -0.25 0.00 0.00 175.29 176.29 3cfk s SER 156 N -2.13 -0.07 -1.96 5.90 0.15 -1.26 -4.72 113.70 109.61 3cfk s SER 156 Ca 0.46 0.32 0.00 0.00 0.70 0.00 0.00 55.95 57.43 3cfk s SER 156 Cb -0.12 0.21 0.00 0.00 -1.71 0.00 0.00 66.02 64.40 3cfk s SER 156 CO 0.20 -0.16 0.00 0.61 1.20 0.00 0.00 173.24 175.09 3cfk n GLY 157 N 4.28 0.53 1.37 9.45 0.00 -1.26 -4.84 105.19 114.72 3cfk n GLY 157 Ca -0.25 -0.01 0.03 0.00 0.00 0.00 0.00 46.02 45.79 3cfk n GLY 157 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 3cfk n ASN 158 N -1.72 1.41 -4.08 1.61 6.94 -1.26 -5.06 115.26 113.10 3cfk n ASN 158 Ca -0.23 -2.62 -0.11 0.00 -0.02 0.00 0.00 54.58 51.59 3cfk n ASN 158 Cb 0.69 -0.38 -0.11 0.00 -2.36 0.00 0.00 39.78 37.61 3cfk n ASN 158 CO 0.00 0.00 0.00 -0.94 -1.03 0.00 0.00 177.26 175.29 3cfk s SER 159 N -2.57 0.81 0.13 0.53 1.04 -1.26 -2.18 113.70 110.20 3cfk s SER 159 Ca 0.35 -0.68 0.03 0.00 0.48 0.00 0.00 55.95 56.13 3cfk s SER 159 Cb 0.38 0.07 -0.04 0.00 0.10 0.00 0.00 66.02 66.53 3cfk s SER 159 CO -0.12 -0.31 -0.08 -1.10 0.98 0.00 0.00 173.24 172.61 3cfk s GLN 160 N -2.26 0.98 -0.02 4.02 -0.21 -0.60 -4.97 119.66 116.59 3cfk s GLN 160 Ca -0.04 -1.42 -0.09 0.00 0.02 0.00 0.00 55.36 53.83 3cfk s GLN 160 Cb -0.05 -0.42 0.01 0.00 1.00 0.00 0.00 33.01 33.55 3cfk s GLN 160 CO -0.02 0.02 0.19 -2.00 -2.12 0.00 0.00 175.29 171.36 3cfk s GLU 161 N -3.80 0.48 -0.20 2.91 2.12 -1.26 -0.79 118.70 118.16 3cfk s GLU 161 Ca 0.16 -0.21 -0.16 0.00 0.36 0.00 0.00 54.97 55.12 3cfk s GLU 161 Cb 0.04 0.21 0.05 0.00 0.26 0.00 0.00 34.13 34.69 3cfk s GLU 161 CO -0.01 -0.11 0.51 0.45 -0.54 0.00 0.00 175.26 175.56 3cfk s SER 162 N -1.05 -0.56 0.02 -1.70 0.15 -0.57 -5.01 113.70 104.97 3cfk s SER 162 Ca -0.11 1.05 0.05 0.00 0.70 0.00 0.00 55.95 57.63 3cfk s SER 162 Cb -0.06 1.03 -0.02 0.00 -1.71 0.00 0.00 66.02 65.27 3cfk s SER 162 CO 0.02 -0.19 -0.14 0.54 1.20 0.00 0.00 173.24 174.67 3cfk s VAL 163 N 0.55 1.12 0.79 4.45 0.11 -1.26 -1.02 120.40 125.15 3cfk s VAL 163 Ca -0.02 -0.83 -0.12 0.00 -2.93 0.00 0.00 61.98 58.08 3cfk s VAL 163 Cb -0.04 -0.98 0.06 0.00 -1.53 0.00 0.00 36.38 33.89 3cfk s VAL 163 CO -0.03 0.14 1.15 0.42 -3.33 0.00 0.00 175.10 173.45 3cfk s THR 164 N -0.62 2.45 0.68 5.04 -4.23 -0.07 -5.00 115.64 113.88 3cfk s THR 164 Ca 0.03 0.15 -0.11 0.00 -1.18 0.00 0.00 61.69 60.58 3cfk s THR 164 Cb -0.07 -3.12 -0.00 0.00 1.34 0.00 0.00 72.50 70.64 3cfk s THR 164 CO 0.01 -0.19 1.05 -1.61 -0.54 0.00 0.00 174.62 173.34 3cfk s GLU 165 N -5.49 3.09 0.18 3.99 2.02 -1.26 -4.65 118.70 116.58 3cfk s GLU 165 Ca 0.61 0.85 -0.33 0.00 0.02 0.00 0.00 54.97 56.12 3cfk s GLU 165 Cb -0.11 -2.02 -0.13 0.00 0.10 0.00 0.00 34.13 31.97 3cfk s GLU 165 CO 0.50 -0.96 1.67 0.94 0.02 0.00 0.00 175.26 177.43 3cfk n GLN 166 N -3.02 2.49 -2.04 1.61 7.27 -1.26 -4.77 117.38 117.66 3cfk n GLN 166 Ca 0.07 0.90 -0.41 0.00 0.07 0.00 0.00 57.00 57.62 3cfk n GLN 166 Cb 0.54 -2.71 -0.02 0.00 2.41 0.00 0.00 30.24 30.45 3cfk n GLN 166 CO 0.00 0.00 0.00 0.34 0.07 0.00 0.00 177.06 177.47 3cfk s ASP 167 N 1.16 6.69 0.01 1.69 -1.08 0.16 -4.89 116.67 120.41 3cfk s ASP 167 Ca 0.77 2.62 0.19 0.00 -0.52 0.00 0.00 52.55 55.62 3cfk s ASP 167 Cb -0.58 -2.62 0.81 0.00 -1.46 0.00 0.00 42.92 39.07 3cfk s ASP 167 CO 0.35 -0.68 1.61 -1.54 0.52 0.00 0.00 175.17 175.43 3cfk n SER 168 N 2.46 0.04 -0.06 -0.34 3.41 -1.26 -1.62 113.62 116.26 3cfk n SER 168 Ca 0.07 0.51 -0.09 0.00 -0.26 0.00 0.00 58.87 59.09 3cfk n SER 168 Cb 0.41 -0.52 -0.03 0.00 -0.26 0.00 0.00 64.21 63.81 3cfk n SER 168 CO 0.00 0.00 0.00 0.29 -0.16 0.00 0.00 175.04 175.17 3cfk n LYS 169 N -1.54 0.36 0.00 4.33 5.02 -1.26 -3.70 118.16 121.36 3cfk n LYS 169 Ca 0.04 0.15 0.12 0.00 -2.02 0.00 0.00 58.31 56.61 3cfk n LYS 169 Cb 0.22 -1.13 0.24 0.00 -0.02 0.00 0.00 35.03 34.35 3cfk n LYS 169 CO 0.00 0.00 0.00 -0.40 -0.52 0.00 0.00 177.40 176.48 3cfk n ASP 170 N -4.06 1.53 -1.55 4.39 5.68 -1.26 -4.97 116.55 116.31 3cfk n ASP 170 Ca -0.16 -1.23 -0.16 0.00 -0.50 0.00 0.00 54.79 52.74 3cfk n ASP 170 Cb 0.45 0.24 -0.04 0.00 -1.14 0.00 0.00 41.12 40.63 3cfk n ASP 170 CO 0.00 0.00 0.00 -1.20 -1.33 0.00 0.00 177.20 174.67 3cfk n SER 171 N -0.25 -4.94 -4.93 -1.12 7.64 -0.64 -4.99 113.62 104.39 3cfk n SER 171 Ca 0.12 0.21 -0.20 0.00 1.01 0.00 0.00 58.87 60.01 3cfk n SER 171 Cb 0.41 -3.96 -0.02 0.00 -1.01 0.00 0.00 64.21 59.63 3cfk n SER 171 CO 0.00 0.00 0.00 0.42 -3.01 0.00 0.00 175.04 172.45 3cfk s THR 172 N -2.71 3.94 0.25 0.44 -4.23 -1.26 -4.64 115.64 107.43 3cfk s THR 172 Ca 0.00 -1.14 0.09 0.00 -1.18 0.00 0.00 61.69 59.46 3cfk s THR 172 Cb 0.00 -3.35 -0.04 0.00 1.34 0.00 0.00 72.50 70.45 3cfk s THR 172 CO 0.00 -0.18 0.02 -0.31 -0.54 0.00 0.00 174.62 173.62 3cfk s TYR 173 N -2.21 2.77 0.06 3.99 2.02 0.47 -0.66 117.35 123.79 3cfk s TYR 173 Ca 0.43 -0.20 0.03 0.00 -0.37 0.00 0.00 57.07 56.96 3cfk s TYR 173 Cb -0.08 -1.24 -0.03 0.00 -0.40 0.00 0.00 41.96 40.21 3cfk s TYR 173 CO 0.29 0.60 -0.10 -1.12 -1.57 0.00 0.00 175.55 173.64 3cfk s SER 174 N -3.61 1.26 0.00 2.29 0.01 -1.26 -0.90 113.70 111.48 3cfk s SER 174 Ca 0.31 -0.63 0.01 0.00 1.31 0.00 0.00 55.95 56.95 3cfk s SER 174 Cb -0.07 0.00 -0.01 0.00 0.21 0.00 0.00 66.02 66.16 3cfk s SER 174 CO 0.20 -0.18 -0.05 -0.22 0.41 0.00 0.00 173.24 173.41 3cfk s LEU 175 N -1.83 2.03 -0.06 2.44 0.20 0.86 -0.90 118.68 121.42 3cfk s LEU 175 Ca -0.04 -0.12 0.03 0.00 0.69 0.00 0.00 54.13 54.69 3cfk s LEU 175 Cb -0.08 -0.22 0.00 0.00 -0.43 0.00 0.00 46.19 45.46 3cfk s LEU 175 CO 0.01 0.03 -0.16 -0.55 -0.29 0.00 0.00 176.35 175.39 3cfk s SER 176 N -0.23 2.10 -0.02 3.68 0.15 -0.19 -0.38 113.70 118.81 3cfk s SER 176 Ca 0.01 -0.36 0.05 0.00 0.70 0.00 0.00 55.95 56.35 3cfk s SER 176 Cb -0.02 -0.81 -0.01 0.00 -1.71 0.00 0.00 66.02 63.46 3cfk s SER 176 CO -0.00 0.10 -0.16 -0.55 1.20 0.00 0.00 173.24 173.83 3cfk s SER 177 N 0.36 1.97 -0.13 5.45 0.15 -0.24 -1.52 113.70 119.75 3cfk s SER 177 Ca -0.11 -0.31 0.02 0.00 0.70 0.00 0.00 55.95 56.25 3cfk s SER 177 Cb -0.14 -0.36 0.00 0.00 -1.71 0.00 0.00 66.02 63.81 3cfk s SER 177 CO 0.04 0.18 -0.20 -0.89 1.20 0.00 0.00 173.24 173.56 3cfk s THR 178 N -0.20 2.30 -0.24 6.45 2.01 0.03 -0.54 115.64 125.45 3cfk s THR 178 Ca 0.02 -0.91 -0.10 0.00 0.31 0.00 0.00 61.69 61.01 3cfk s THR 178 Cb -0.08 -1.92 -0.05 0.00 0.01 0.00 0.00 72.50 70.45 3cfk s THR 178 CO 0.00 0.54 0.15 -0.22 -0.69 0.00 0.00 174.62 174.41 3cfk s LEU 179 N 0.62 4.04 -0.18 4.42 2.96 0.04 -1.56 118.68 129.03 3cfk s LEU 179 Ca -0.11 0.07 -0.03 0.00 -0.22 0.00 0.00 54.13 53.84 3cfk s LEU 179 Cb -0.16 -2.09 -0.02 0.00 0.50 0.00 0.00 46.19 44.42 3cfk s LEU 179 CO 0.03 0.05 -0.06 -0.89 -1.32 0.00 0.00 176.35 174.15 3cfk s THR 180 N 1.17 3.45 0.17 3.68 2.01 -0.93 -0.78 115.64 124.41 3cfk s THR 180 Ca 0.07 -0.50 -0.00 0.00 0.31 0.00 0.00 61.69 61.57 3cfk s THR 180 Cb -0.14 -2.52 -0.04 0.00 0.01 0.00 0.00 72.50 69.81 3cfk s THR 180 CO 0.05 0.47 0.07 -1.48 -0.69 0.00 0.00 174.62 173.04 3cfk s LEU 181 N 0.82 1.66 0.67 4.42 2.34 -0.89 -4.88 118.68 122.82 3cfk s LEU 181 Ca -0.02 -1.27 -0.13 0.00 0.06 0.00 0.00 54.13 52.77 3cfk s LEU 181 Cb -0.15 0.23 -0.00 0.00 -0.56 0.00 0.00 46.19 45.72 3cfk s LEU 181 CO 0.01 -0.73 1.07 -0.94 -1.06 0.00 0.00 176.35 174.71 3cfk s SER 182 N -3.12 5.32 0.16 1.48 1.04 -1.26 -1.40 113.70 115.91 3cfk s SER 182 Ca 0.29 1.79 -0.17 0.00 0.48 0.00 0.00 55.95 58.34 3cfk s SER 182 Cb 0.07 -2.52 0.08 0.00 0.10 0.00 0.00 66.02 63.75 3cfk s SER 182 CO 0.06 -1.49 1.71 0.50 0.98 0.00 0.00 173.24 175.00 3cfk h LYS 183 N -0.26 0.13 -0.73 4.02 3.64 -1.53 0.68 116.57 122.52 3cfk h LYS 183 Ca -0.45 -0.01 0.06 0.00 -1.27 0.00 0.00 60.65 58.98 3cfk h LYS 183 Cb 1.22 -0.03 -0.06 0.00 -0.41 0.00 0.00 32.23 32.96 3cfk h LYS 183 CO 0.56 0.08 0.42 0.00 -2.27 0.00 0.00 179.45 178.24 3cfk h ALA 184 N 1.30 0.99 -0.19 5.00 0.00 -1.93 -0.68 119.26 123.75 3cfk h ALA 184 Ca 0.17 0.01 -0.14 0.00 0.00 0.00 0.00 54.91 54.95 3cfk h ALA 184 Cb 0.23 -0.15 -0.01 0.00 0.00 0.00 0.00 17.79 17.86 3cfk h ALA 184 CO -0.27 0.10 -0.49 -0.44 0.00 0.00 0.00 179.25 178.16 3cfk h ASP 185 N 0.76 0.54 -0.33 0.00 5.19 -1.84 -2.98 116.42 117.76 3cfk h ASP 185 Ca 0.33 -0.27 -0.02 0.00 -0.62 0.00 0.00 57.03 56.45 3cfk h ASP 185 Cb 0.20 -0.15 -0.02 0.00 0.18 0.00 0.00 39.33 39.54 3cfk h ASP 185 CO -0.19 0.94 0.14 0.22 -3.12 0.00 0.00 179.24 177.23 3cfk h TYR 186 N 0.40 0.55 0.00 4.55 3.20 -0.03 -2.75 116.97 122.88 3cfk h TYR 186 Ca 0.02 -0.02 0.00 0.00 3.14 0.00 0.00 58.73 61.87 3cfk h TYR 186 Cb 1.00 -0.17 0.00 0.00 1.54 0.00 0.00 36.73 39.10 3cfk h TYR 186 CO 0.04 0.45 0.00 0.39 -1.64 0.00 0.00 178.16 177.39 3cfk n GLU 187 N -4.37 0.12 0.00 1.82 -0.58 -0.34 -3.37 120.64 113.92 3cfk n GLU 187 Ca 0.02 0.18 0.13 0.00 -0.42 0.00 0.00 57.16 57.07 3cfk n GLU 187 Cb 0.15 -1.67 0.38 0.00 -0.57 0.00 0.00 31.44 29.74 3cfk n GLU 187 CO 0.00 0.00 0.00 1.63 -0.48 0.00 0.00 177.13 178.28 3cfk n LYS 188 N -1.88 0.17 -4.19 3.49 5.02 -1.04 -4.92 118.16 114.82 3cfk n LYS 188 Ca 0.05 -0.08 -0.19 0.00 -2.02 0.00 0.00 58.31 56.07 3cfk n LYS 188 Cb 0.33 -1.50 -0.12 0.00 -0.02 0.00 0.00 35.03 33.72 3cfk n LYS 188 CO 0.00 0.00 0.00 -1.01 -0.52 0.00 0.00 177.40 175.87 3cfk s HIS 189 N -2.88 1.29 -0.22 2.13 3.76 -1.22 -5.08 115.29 113.08 3cfk s HIS 189 Ca 0.15 -0.45 -0.16 0.00 -0.15 0.00 0.00 55.06 54.44 3cfk s HIS 189 Cb 0.18 -0.72 -0.12 0.00 1.11 0.00 0.00 32.58 33.03 3cfk s HIS 189 CO 0.62 0.08 -0.16 1.17 -0.85 0.00 0.00 174.74 175.60 3cfk n LYS 190 N 1.25 0.55 -3.67 1.40 4.81 -1.26 -4.72 118.16 116.51 3cfk n LYS 190 Ca -0.21 0.39 -0.37 0.00 -0.87 0.00 0.00 58.31 57.25 3cfk n LYS 190 Cb 0.54 -1.59 -0.11 0.00 0.02 0.00 0.00 35.03 33.89 3cfk n LYS 190 CO 0.00 0.00 0.00 0.08 1.17 0.00 0.00 177.40 178.65 3cfk s VAL 191 N -2.50 5.07 -0.20 3.15 1.01 -1.26 -0.58 120.40 125.10 3cfk s VAL 191 Ca -0.30 0.09 -0.01 0.00 0.00 0.00 0.00 61.98 61.75 3cfk s VAL 191 Cb 0.08 -3.39 0.01 0.00 0.00 0.00 0.00 36.38 33.09 3cfk s VAL 191 CO 0.47 0.31 -0.14 -0.31 0.00 0.00 0.00 175.10 175.43 3cfk s TYR 192 N 1.46 2.87 0.03 5.22 1.51 -0.90 -0.70 117.35 126.84 3cfk s TYR 192 Ca 0.07 -1.43 0.07 0.00 -1.01 0.00 0.00 57.07 54.77 3cfk s TYR 192 Cb -0.15 -1.99 -0.02 0.00 -0.11 0.00 0.00 41.96 39.69 3cfk s TYR 192 CO 0.07 -0.72 -0.20 0.00 -1.11 0.00 0.00 175.55 173.60 3cfk s ALA 193 N 1.35 1.65 -0.22 3.71 0.00 -0.25 -1.81 121.76 126.20 3cfk s ALA 193 Ca 0.05 -0.99 -0.01 0.00 0.00 0.00 0.00 51.96 51.01 3cfk s ALA 193 Cb -0.14 -0.33 0.02 0.00 0.00 0.00 0.00 23.12 22.66 3cfk s ALA 193 CO -0.09 0.37 -0.10 0.00 0.00 0.00 0.00 175.76 175.94 3cfk s GLU 195 N 1.35 3.40 -0.11 0.00 2.12 0.84 -1.06 118.70 125.23 3cfk s GLU 195 Ca 0.03 -0.66 0.01 0.00 0.36 0.00 0.00 54.97 54.71 3cfk s GLU 195 Cb -0.15 -2.67 0.02 0.00 0.26 0.00 0.00 34.13 31.59 3cfk s GLU 195 CO -0.07 0.24 -0.13 0.08 -0.54 0.00 0.00 175.26 174.84 3cfk s VAL 196 N 0.30 1.37 -0.07 3.70 1.01 0.32 -0.28 120.40 126.76 3cfk s VAL 196 Ca -0.09 -0.54 0.00 0.00 0.00 0.00 0.00 61.98 61.35 3cfk s VAL 196 Cb -0.15 -1.28 -0.03 0.00 0.00 0.00 0.00 36.38 34.91 3cfk s VAL 196 CO 0.05 0.42 -0.06 0.42 0.00 0.00 0.00 175.10 175.93 3cfk s THR 197 N 1.23 3.78 0.00 3.92 -4.23 -0.73 -1.67 115.64 117.93 3cfk s THR 197 Ca -0.02 -0.45 -0.26 0.00 -1.18 0.00 0.00 61.69 59.78 3cfk s THR 197 Cb -0.14 -2.55 0.06 0.00 1.34 0.00 0.00 72.50 71.21 3cfk s THR 197 CO -0.05 0.60 0.58 -2.28 -0.54 0.00 0.00 174.62 172.93 3cfk s HIS 198 N -0.82 -0.52 0.46 3.99 2.46 -1.26 -1.54 115.29 118.05 3cfk s HIS 198 Ca 0.13 0.76 0.15 0.00 0.47 0.00 0.00 55.06 56.56 3cfk s HIS 198 Cb -0.11 0.36 1.10 0.00 -0.13 0.00 0.00 32.58 33.80 3cfk s HIS 198 CO 0.02 -0.61 2.01 0.37 -2.47 0.00 0.00 174.74 174.05 3cfk h GLN 199 N 2.95 0.31 0.00 2.88 4.15 -1.94 -0.74 115.11 122.72 3cfk h GLN 199 Ca -0.29 -0.02 0.00 0.00 0.77 0.00 0.00 58.65 59.11 3cfk h GLN 199 Cb 1.18 -0.07 0.00 0.00 0.21 0.00 0.00 27.48 28.80 3cfk h GLN 199 CO 0.40 0.20 0.00 0.41 -1.93 0.00 0.00 178.83 177.91 3cfk n GLY 200 N -1.54 -1.35 3.69 2.39 0.00 -1.26 -4.68 105.19 102.44 3cfk n GLY 200 Ca 0.08 -0.01 -0.35 0.00 0.00 0.00 0.00 46.02 45.74 3cfk n GLY 200 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3cfk s LEU 201 N -3.79 3.99 0.09 0.99 1.43 -0.29 -4.60 118.68 116.50 3cfk s LEU 201 Ca 0.08 0.17 0.27 0.00 -1.03 0.00 0.00 54.13 53.62 3cfk s LEU 201 Cb 0.12 -2.01 1.03 0.00 0.03 0.00 0.00 46.19 45.37 3cfk s LEU 201 CO 0.44 0.21 1.84 -1.54 0.23 0.00 0.00 176.35 177.52 3cfk n SER 202 N 3.32 0.35 -3.50 2.29 3.41 -1.26 -4.68 113.62 113.55 3cfk n SER 202 Ca -0.17 0.54 -0.15 0.00 -0.26 0.00 0.00 58.87 58.83 3cfk n SER 202 Cb 0.52 -0.63 -0.05 0.00 -0.26 0.00 0.00 64.21 63.80 3cfk n SER 202 CO 0.00 0.00 0.00 -0.94 -0.16 0.00 0.00 175.04 173.94 3cfk s SER 203 N -3.65 -0.58 0.50 4.04 1.04 -1.26 -5.15 113.70 108.64 3cfk s SER 203 Ca 0.12 0.45 -0.23 0.00 0.48 0.00 0.00 55.95 56.77 3cfk s SER 203 Cb 0.16 0.52 -0.06 0.00 0.10 0.00 0.00 66.02 66.73 3cfk s SER 203 CO 0.54 -0.67 1.36 -2.84 0.98 0.00 0.00 173.24 172.62 3cfk s PRO 204 N -1.95 3.40 -0.18 4.02 0.02 -1.26 -4.98 135.00 134.07 3cfk s PRO 204 Ca -0.06 2.26 -0.10 0.00 0.02 0.00 0.00 61.00 63.12 3cfk s PRO 204 Cb -0.00 -2.43 -0.05 0.00 0.02 0.00 0.00 34.50 32.04 3cfk s PRO 204 CO 0.02 -0.99 0.16 0.08 -0.33 0.00 0.00 177.00 175.94 3cfk s VAL 205 N -1.28 5.40 -0.11 3.83 1.01 -0.67 -4.91 120.40 123.67 3cfk s VAL 205 Ca 0.67 0.26 0.01 0.00 0.00 0.00 0.00 61.98 62.92 3cfk s VAL 205 Cb -0.41 -3.49 -0.02 0.00 0.00 0.00 0.00 36.38 32.47 3cfk s VAL 205 CO 0.50 0.46 -0.14 -0.89 0.00 0.00 0.00 175.10 175.02 3cfk s THR 206 N 0.18 2.95 -0.06 3.92 2.01 -1.26 -0.52 115.64 122.87 3cfk s THR 206 Ca 0.10 -0.71 0.05 0.00 0.31 0.00 0.00 61.69 61.45 3cfk s THR 206 Cb -0.12 -2.21 -0.01 0.00 0.01 0.00 0.00 72.50 70.17 3cfk s THR 206 CO -0.00 0.54 -0.22 -0.54 -0.69 0.00 0.00 174.62 173.71 3cfk s LYS 207 N 0.09 2.56 0.20 4.92 -0.14 -0.23 -4.98 119.74 122.17 3cfk s LYS 207 Ca -0.06 -0.85 -0.07 0.00 -1.36 0.00 0.00 55.97 53.62 3cfk s LYS 207 Cb -0.15 -2.23 -0.02 0.00 -1.68 0.00 0.00 37.83 33.76 3cfk s LYS 207 CO 0.05 0.43 0.28 -1.54 -0.76 0.00 0.00 175.35 173.81 3cfk s SER 208 N -0.27 0.05 0.08 2.83 1.04 -1.26 -0.55 113.70 115.62 3cfk s SER 208 Ca -0.00 -1.11 -0.08 0.00 0.48 0.00 0.00 55.95 55.24 3cfk s SER 208 Cb -0.13 0.46 -0.00 0.00 0.10 0.00 0.00 66.02 66.45 3cfk s SER 208 CO 0.03 -0.95 0.18 0.72 0.98 0.00 0.00 173.24 174.19 3cfk s PHE 209 N -4.06 0.16 -0.25 5.02 -0.12 -0.75 -5.01 117.98 112.98 3cfk s PHE 209 Ca 0.28 -0.57 -0.08 0.00 -0.05 0.00 0.00 56.93 56.51 3cfk s PHE 209 Cb 0.04 -0.07 -0.03 0.00 -0.63 0.00 0.00 43.02 42.32 3cfk s PHE 209 CO 0.08 -0.52 0.09 -0.80 -0.05 0.00 0.00 175.22 174.02 3cfk s ASN 210 N -2.76 5.33 0.08 1.98 0.01 -1.26 -2.13 114.94 116.19 3cfk s ASN 210 Ca 0.04 -0.14 -0.37 0.00 -0.71 0.00 0.00 52.86 51.67 3cfk s ASN 210 Cb 0.04 -1.96 -0.17 0.00 0.41 0.00 0.00 41.25 39.57 3cfk s ASN 210 CO -0.10 -0.01 1.29 -1.14 -1.51 0.00 0.00 177.10 175.63 3cfk n ARG 211 N 4.80 0.98 -2.82 -0.60 0.63 0.25 -1.88 116.66 118.02 3cfk n ARG 211 Ca -0.16 0.35 -0.14 0.00 -0.92 0.00 0.00 57.85 56.98 3cfk n ARG 211 Cb 0.52 -1.97 0.03 0.00 0.45 0.00 0.00 32.46 31.48 3cfk n ARG 211 CO 0.00 0.00 0.00 0.41 -2.51 0.00 0.00 177.63 175.53 3cfk n GLY 212 N 2.35 -0.05 0.00 5.14 0.00 -1.26 -4.98 105.19 106.40 3cfk n GLY 212 Ca 0.18 -0.19 0.00 0.00 0.00 0.00 0.00 46.02 46.01 3cfk n GLY 212 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50