#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 4.26 -0.20 -4.62 2.96 -1.26 -4.98 118.68 114.83 3cfk s LEU 2 Ca 0.00 1.83 -0.02 0.00 -0.22 0.00 0.00 54.13 55.72 3cfk s LEU 2 Cb 0.00 -3.55 -0.00 0.00 0.50 0.00 0.00 46.19 43.14 3cfk s LEU 2 CO 0.00 -0.67 -0.09 -0.69 -1.32 0.00 0.00 176.35 173.58 3cfk s VAL 3 N 2.69 3.01 -0.17 1.68 1.01 -1.26 -5.00 120.40 122.36 3cfk s VAL 3 Ca 0.57 -0.62 -0.12 0.00 0.00 0.00 0.00 61.98 61.81 3cfk s VAL 3 Cb -0.25 -2.34 -0.05 0.00 0.00 0.00 0.00 36.38 33.74 3cfk s VAL 3 CO 0.21 0.46 0.23 -0.69 0.00 0.00 0.00 175.10 175.31 3cfk s VAL 4 N 1.35 5.34 -0.03 2.92 1.01 -1.26 -2.37 120.40 127.37 3cfk s VAL 4 Ca 0.04 0.42 0.06 0.00 0.00 0.00 0.00 61.98 62.49 3cfk s VAL 4 Cb -0.14 -3.57 -0.01 0.00 0.00 0.00 0.00 36.38 32.66 3cfk s VAL 4 CO -0.05 0.43 -0.19 -0.89 0.00 0.00 0.00 175.10 174.39 3cfk s THR 5 N 0.29 1.56 0.14 3.92 2.01 -0.21 -4.01 115.64 119.34 3cfk s THR 5 Ca 0.14 -0.82 0.05 0.00 0.31 0.00 0.00 61.69 61.37 3cfk s THR 5 Cb -0.12 -1.32 -0.04 0.00 0.01 0.00 0.00 72.50 71.03 3cfk s THR 5 CO 0.02 0.44 -0.12 -1.10 -0.69 0.00 0.00 174.62 173.17 3cfk s GLN 6 N -0.27 1.06 0.35 4.92 -0.21 -1.26 -1.29 119.66 122.96 3cfk s GLN 6 Ca 0.03 -1.36 -0.28 0.00 0.02 0.00 0.00 55.36 53.77 3cfk s GLN 6 Cb -0.09 -0.80 -0.12 0.00 1.00 0.00 0.00 33.01 33.00 3cfk s GLN 6 CO 0.01 0.13 1.39 0.39 -2.12 0.00 0.00 175.29 175.08 3cfk n GLU 7 N 0.14 2.37 -0.00 2.91 4.71 -1.26 -4.89 120.64 124.62 3cfk n GLU 7 Ca -0.13 0.83 -0.12 0.00 -0.01 0.00 0.00 57.16 57.74 3cfk n GLU 7 Cb 0.59 -2.48 -0.07 0.00 -1.01 0.00 0.00 31.44 28.47 3cfk n GLU 7 CO 0.00 0.00 0.00 0.77 0.09 0.00 0.00 177.13 177.99 3cfk h SER 8 N 2.87 0.09 -4.25 1.62 0.02 -1.95 -3.35 113.55 108.60 3cfk h SER 8 Ca -0.48 -0.13 -0.12 0.00 -0.84 0.00 0.00 61.79 60.22 3cfk h SER 8 Cb 1.26 -0.02 -0.23 0.00 0.14 0.00 0.00 62.40 63.55 3cfk h SER 8 CO 0.64 0.19 -0.23 0.00 -1.14 0.00 0.00 176.83 176.29 3cfk s ALA 9 N -5.69 -0.97 0.04 3.77 0.00 -1.26 -1.48 121.76 116.17 3cfk s ALA 9 Ca -0.14 0.90 0.03 0.00 0.00 0.00 0.00 51.96 52.75 3cfk s ALA 9 Cb 0.06 -0.41 -0.02 0.00 0.00 0.00 0.00 23.12 22.74 3cfk s ALA 9 CO 0.68 -0.22 -0.09 -0.51 0.00 0.00 0.00 175.76 175.62 3cfk s LEU 11 N -0.30 2.25 -0.03 0.00 1.43 -0.35 -4.95 118.68 116.72 3cfk s LEU 11 Ca -0.04 -0.53 0.07 0.00 -1.03 0.00 0.00 54.13 52.59 3cfk s LEU 11 Cb -0.03 -0.23 -0.02 0.00 0.03 0.00 0.00 46.19 45.94 3cfk s LEU 11 CO 0.02 -0.17 -0.25 -0.89 0.23 0.00 0.00 176.35 175.29 3cfk s THR 12 N -1.29 2.01 0.02 5.49 2.01 -1.26 -0.48 115.64 122.14 3cfk s THR 12 Ca -0.08 -1.07 -0.11 0.00 0.31 0.00 0.00 61.69 60.74 3cfk s THR 12 Cb -0.10 -1.68 0.01 0.00 0.01 0.00 0.00 72.50 70.74 3cfk s THR 12 CO 0.01 0.57 0.22 0.28 -0.69 0.00 0.00 174.62 175.00 3cfk s THR 13 N -0.43 0.09 0.38 -0.82 -1.32 -0.59 -4.97 115.64 107.98 3cfk s THR 13 Ca 0.05 -0.72 -0.07 0.00 -1.21 0.00 0.00 61.69 59.74 3cfk s THR 13 Cb -0.11 -0.73 -0.05 0.00 -1.51 0.00 0.00 72.50 70.10 3cfk s THR 13 CO 0.01 -0.39 0.69 -0.44 -2.21 0.00 0.00 174.62 172.27 3cfk s SER 14 N -1.73 6.41 0.39 8.08 0.01 -1.26 -0.32 113.70 125.29 3cfk s SER 14 Ca -0.10 0.90 -0.27 0.00 1.31 0.00 0.00 55.95 57.79 3cfk s SER 14 Cb -0.04 -2.23 -0.11 0.00 0.21 0.00 0.00 66.02 63.86 3cfk s SER 14 CO -0.00 -0.38 1.41 -2.65 0.41 0.00 0.00 173.24 172.03 3cfk n PRO 15 N -1.47 2.38 0.00 12.44 -0.02 -1.26 -2.07 135.00 145.00 3cfk n PRO 15 Ca 0.00 0.84 0.00 0.00 -2.02 0.00 0.00 63.50 62.32 3cfk n PRO 15 Cb 0.54 -2.55 0.00 0.00 -0.02 0.00 0.00 33.50 31.47 3cfk n PRO 15 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3cfk n GLY 16 N 0.59 2.71 3.88 -1.23 0.00 0.28 -4.90 105.19 106.51 3cfk n GLY 16 Ca 0.03 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.75 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 -0.34 3.49 -0.07 1.61 2.02 -0.88 -4.11 118.70 120.42 3cfk s GLU 17 Ca 0.00 0.62 -0.13 0.00 0.02 0.00 0.00 54.97 55.47 3cfk s GLU 17 Cb 0.00 -2.12 -0.05 0.00 0.10 0.00 0.00 34.13 32.06 3cfk s GLU 17 CO 0.00 -0.57 0.34 0.99 0.02 0.00 0.00 175.26 176.03 3cfk s THR 18 N -3.13 5.20 0.01 3.63 2.01 -1.26 -0.97 115.64 121.12 3cfk s THR 18 Ca 0.54 0.66 0.02 0.00 0.31 0.00 0.00 61.69 63.23 3cfk s THR 18 Cb -0.11 -3.64 -0.01 0.00 0.01 0.00 0.00 72.50 68.75 3cfk s THR 18 CO 0.52 0.52 -0.07 0.54 -0.69 0.00 0.00 174.62 175.44 3cfk s VAL 19 N -0.57 0.57 -0.16 3.82 0.11 -0.64 -4.97 120.40 118.54 3cfk s VAL 19 Ca 0.21 -0.47 0.01 0.00 -2.93 0.00 0.00 61.98 58.79 3cfk s VAL 19 Cb -0.15 -0.51 0.03 0.00 -1.53 0.00 0.00 36.38 34.22 3cfk s VAL 19 CO 0.09 0.05 -0.15 -0.89 -3.33 0.00 0.00 175.10 170.87 3cfk s THR 20 N -0.41 1.69 -0.11 5.04 2.01 -1.26 -0.55 115.64 122.06 3cfk s THR 20 Ca 0.00 -0.77 -0.12 0.00 0.31 0.00 0.00 61.69 61.12 3cfk s THR 20 Cb -0.04 -1.61 -0.05 0.00 0.01 0.00 0.00 72.50 70.82 3cfk s THR 20 CO -0.00 0.42 0.26 -0.76 -0.69 0.00 0.00 174.62 173.86 3cfk s LEU 21 N 1.43 4.35 0.37 4.42 1.02 0.91 -4.95 118.68 126.23 3cfk s LEU 21 Ca 0.04 0.60 0.08 0.00 0.02 0.00 0.00 54.13 54.87 3cfk s LEU 21 Cb -0.13 -2.31 -0.06 0.00 0.02 0.00 0.00 46.19 43.70 3cfk s LEU 21 CO -0.11 0.27 0.06 0.42 0.02 0.00 0.00 176.35 177.01 3cfk s THR 22 N -0.44 2.43 -0.23 5.49 -4.23 -1.26 -0.74 115.64 116.65 3cfk s THR 22 Ca 0.17 -1.90 -0.03 0.00 -1.18 0.00 0.00 61.69 58.75 3cfk s THR 22 Cb -0.14 -2.88 0.12 0.00 1.34 0.00 0.00 72.50 70.94 3cfk s THR 22 CO 0.06 -0.11 0.35 0.00 -0.54 0.00 0.00 174.62 174.38 3cfk s ARG 24 N 2.51 1.94 0.14 0.00 1.70 -0.41 -1.48 118.95 123.35 3cfk s ARG 24 Ca 0.10 -1.85 0.09 0.00 -0.47 0.00 0.00 55.73 53.60 3cfk s ARG 24 Cb -0.15 -1.81 -0.04 0.00 -0.57 0.00 0.00 34.95 32.38 3cfk s ARG 24 CO -0.15 0.14 -0.20 0.45 -1.08 0.00 0.00 175.30 174.46 3cfk s SER 25 N -3.66 2.69 0.00 -2.89 0.15 -1.26 -1.04 113.70 107.69 3cfk s SER 25 Ca 0.34 -0.78 0.25 0.00 0.70 0.00 0.00 55.95 56.46 3cfk s SER 25 Cb 0.01 -0.16 0.58 0.00 -1.71 0.00 0.00 66.02 64.75 3cfk s SER 25 CO 0.18 0.03 1.46 -1.54 1.20 0.00 0.00 173.24 174.56 3cfk n SER 26 N 0.68 1.04 0.08 5.45 3.41 -1.00 -3.85 113.62 119.43 3cfk n SER 26 Ca -0.16 -0.85 0.13 0.00 -0.26 0.00 0.00 58.87 57.73 3cfk n SER 26 Cb 0.55 0.23 0.37 0.00 -0.26 0.00 0.00 64.21 65.10 3cfk n SER 26 CO 0.00 0.00 0.00 -1.20 -0.16 0.00 0.00 175.04 173.68 3cfk n SER 27 N -0.77 0.71 0.00 4.04 7.64 -1.26 -4.97 113.62 119.01 3cfk n SER 27 Ca 0.10 0.44 0.00 0.00 1.01 0.00 0.00 58.87 60.42 3cfk n SER 27 Cb 0.36 -0.52 0.00 0.00 -1.01 0.00 0.00 64.21 63.04 3cfk n SER 27 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 3cfk n GLY 27 N 1.34 0.73 3.69 0.23 0.00 -1.25 -5.09 105.19 104.84 3cfk n GLY 27 Ca 0.05 -2.11 -0.44 0.00 0.00 0.00 0.00 46.02 43.52 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 1.34 -2.42 4.61 0.00 -1.26 -4.33 120.51 117.45 3cfk n ALA 27 Ca 0.00 0.39 -0.42 0.00 0.00 0.00 0.00 53.44 53.41 3cfk n ALA 27 Cb 0.00 -2.29 -0.03 0.00 0.00 0.00 0.00 19.45 17.13 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 -0.42 4.10 0.31 0.00 1.01 0.14 -4.99 120.40 120.54 3cfk s VAL 27 Ca 0.63 1.48 0.07 0.00 0.00 0.00 0.00 61.98 64.16 3cfk s VAL 27 Cb -0.60 -3.95 -0.06 0.00 0.00 0.00 0.00 36.38 31.77 3cfk s VAL 27 CO 0.54 0.06 -0.05 0.28 0.00 0.00 0.00 175.10 175.93 3cfk s THR 28 N 1.59 1.76 0.44 3.92 -1.32 -1.26 -4.67 115.64 116.10 3cfk s THR 28 Ca 0.58 -2.12 0.27 0.00 -1.21 0.00 0.00 61.69 59.21 3cfk s THR 28 Cb -0.28 -2.56 0.47 0.00 -1.51 0.00 0.00 72.50 68.62 3cfk s THR 28 CO 0.26 -0.23 1.70 0.74 -2.21 0.00 0.00 174.62 174.88 3cfk h THR 29 N 2.18 0.30 0.00 5.08 2.02 -2.00 -0.03 112.91 120.46 3cfk h THR 29 Ca -0.41 -0.07 0.00 0.00 0.77 0.00 0.00 66.41 66.71 3cfk h THR 29 Cb 1.24 0.09 0.00 0.00 -1.74 0.00 0.00 68.15 67.74 3cfk h THR 29 CO 0.69 0.04 0.00 -1.20 0.37 0.00 0.00 175.52 175.41 3cfk n SER 30 N -4.58 0.53 0.03 4.18 7.64 -1.26 -1.85 113.62 118.31 3cfk n SER 30 Ca 0.32 0.66 0.13 0.00 1.01 0.00 0.00 58.87 60.99 3cfk n SER 30 Cb 1.22 -0.76 0.48 0.00 -1.01 0.00 0.00 64.21 64.13 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 -2.12 0.33 -3.97 6.43 5.03 -0.02 -4.81 115.26 116.12 3cfk n ASN 31 Ca 0.01 0.39 -0.34 0.00 0.87 0.00 0.00 54.58 55.51 3cfk n ASN 31 Cb 0.16 -0.42 -0.00 0.00 -1.02 0.00 0.00 39.78 38.50 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 -1.74 -1.59 -1.66 3.10 4.01 -0.77 0.10 117.16 118.61 3cfk n TYR 32 Ca 0.06 0.44 -0.46 0.00 -0.16 0.00 0.00 57.90 57.78 3cfk n TYR 32 Cb 0.37 -3.23 -0.04 0.00 -0.31 0.00 0.00 39.34 36.13 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 -4.56 1.02 -2.42 -0.72 0.00 -1.26 -4.31 120.51 108.25 3cfk n ALA 33 Ca -0.19 0.44 -0.28 0.00 0.00 0.00 0.00 53.44 53.41 3cfk n ALA 33 Cb 0.63 -2.29 -0.13 0.00 0.00 0.00 0.00 19.45 17.65 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 0.57 2.07 -0.04 0.00 2.01 -0.58 -0.99 115.64 118.69 3cfk s THR 34 Ca 0.76 -1.60 0.06 0.00 0.31 0.00 0.00 61.69 61.22 3cfk s THR 34 Cb -0.70 -1.83 -0.01 0.00 0.01 0.00 0.00 72.50 69.97 3cfk s THR 34 CO 0.42 0.11 -0.22 0.26 -0.69 0.00 0.00 174.62 174.50 3cfk s TRP 35 N -1.02 2.10 -0.02 4.92 0.52 -0.64 -1.05 118.94 123.75 3cfk s TRP 35 Ca 0.11 -0.52 0.07 0.00 0.02 0.00 0.00 56.10 55.79 3cfk s TRP 35 Cb -0.10 -1.37 -0.02 0.00 -1.15 0.00 0.00 33.47 30.83 3cfk s TRP 35 CO 0.05 -0.12 -0.23 0.08 0.02 0.00 0.00 176.95 176.74 3cfk s VAL 36 N -0.29 1.81 -0.15 4.03 1.01 0.52 -1.07 120.40 126.26 3cfk s VAL 36 Ca 0.02 -0.98 -0.06 0.00 0.00 0.00 0.00 61.98 60.96 3cfk s VAL 36 Cb -0.11 -1.51 -0.04 0.00 0.00 0.00 0.00 36.38 34.73 3cfk s VAL 36 CO 0.01 0.51 0.04 -1.58 0.00 0.00 0.00 175.10 174.09 3cfk s GLN 37 N -0.53 3.64 -0.16 2.72 0.74 0.38 -0.94 119.66 125.52 3cfk s GLN 37 Ca 0.09 -0.35 -0.00 0.00 0.05 0.00 0.00 55.36 55.14 3cfk s GLN 37 Cb -0.09 -3.07 -0.01 0.00 1.10 0.00 0.00 33.01 30.94 3cfk s GLN 37 CO -0.01 0.43 -0.13 -2.00 -0.55 0.00 0.00 175.29 173.03 3cfk s GLU 38 N -0.10 3.29 0.28 1.67 2.12 0.14 -1.23 118.70 124.87 3cfk s GLU 38 Ca 0.06 -0.71 0.10 0.00 0.36 0.00 0.00 54.97 54.78 3cfk s GLU 38 Cb -0.12 -2.68 -0.05 0.00 0.26 0.00 0.00 34.13 31.54 3cfk s GLU 38 CO 0.01 0.05 -0.07 0.15 -0.54 0.00 0.00 175.26 174.86 3cfk s LYS 39 N 0.76 2.06 0.73 4.30 1.02 0.49 -0.93 119.74 128.16 3cfk s LYS 39 Ca -0.05 -1.58 -0.16 0.00 0.02 0.00 0.00 55.97 54.19 3cfk s LYS 39 Cb -0.15 -2.00 -0.02 0.00 -0.52 0.00 0.00 37.83 35.14 3cfk s LYS 39 CO 0.01 0.32 0.64 -2.30 -0.92 0.00 0.00 175.35 173.10 3cfk n PRO 40 N -0.81 0.33 -1.68 -1.68 -0.02 -1.26 -0.57 135.00 129.30 3cfk n PRO 40 Ca -0.06 0.16 -0.13 0.00 -2.02 0.00 0.00 63.50 61.45 3cfk n PRO 40 Cb 0.60 -1.93 -0.04 0.00 -0.02 0.00 0.00 33.50 32.11 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 -0.68 -4.40 -3.73 2.55 8.00 -1.26 -4.05 116.55 112.98 3cfk n ASP 41 Ca 0.11 0.21 -0.30 0.00 0.71 0.00 0.00 54.79 55.51 3cfk n ASP 41 Cb 0.50 -3.24 0.03 0.00 -0.02 0.00 0.00 41.12 38.39 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 -3.11 -1.86 -3.64 1.24 8.25 -0.88 -4.94 115.22 110.29 3cfk n HIS 42 Ca -0.14 0.50 -0.39 0.00 -0.26 0.00 0.00 57.72 57.43 3cfk n HIS 42 Cb 0.50 -3.51 -0.11 0.00 1.12 0.00 0.00 29.99 27.98 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 -6.57 4.31 -0.10 2.41 1.43 0.26 -4.92 118.68 115.50 3cfk s LEU 43 Ca 0.39 -0.67 -0.04 0.00 -1.03 0.00 0.00 54.13 52.78 3cfk s LEU 43 Cb -0.14 -2.01 -0.04 0.00 0.03 0.00 0.00 46.19 44.03 3cfk s LEU 43 CO 0.86 -0.26 0.05 -0.36 0.23 0.00 0.00 176.35 176.88 3cfk s PHE 44 N 1.60 3.32 -0.04 0.29 0.08 -1.26 -0.38 117.98 121.58 3cfk s PHE 44 Ca 0.04 0.31 -0.01 0.00 0.12 0.00 0.00 56.93 57.38 3cfk s PHE 44 Cb -0.18 -1.85 0.03 0.00 -0.57 0.00 0.00 43.02 40.45 3cfk s PHE 44 CO 0.06 0.56 0.04 0.99 -0.10 0.00 0.00 175.22 176.77 3cfk s THR 45 N -0.90 0.01 -0.01 0.64 2.01 -0.36 -4.98 115.64 112.04 3cfk s THR 45 Ca 0.14 0.32 -0.30 0.00 0.31 0.00 0.00 61.69 62.15 3cfk s THR 45 Cb -0.12 -0.22 -0.05 0.00 0.01 0.00 0.00 72.50 72.12 3cfk s THR 45 CO 0.03 0.18 1.40 -0.83 -0.69 0.00 0.00 174.62 174.71 3cfk s GLY 46 N 1.90 1.84 -0.21 4.40 0.00 -1.26 -0.47 107.32 113.51 3cfk s GLY 46 Ca 0.02 0.86 -0.13 0.00 0.00 0.00 0.00 44.72 45.47 3cfk s GLY 46 CO -0.03 2.53 -0.31 1.04 0.00 0.00 0.00 173.10 176.33 3cfk n LEU 47 N 5.50 1.75 -4.05 0.66 4.77 -0.23 -4.76 117.00 120.64 3cfk n LEU 47 Ca 0.13 0.30 -0.22 0.00 -0.03 0.00 0.00 56.01 56.19 3cfk n LEU 47 Cb 0.44 -0.71 -0.16 0.00 -2.33 0.00 0.00 43.42 40.66 3cfk n LEU 47 CO 0.59 0.25 -0.46 -0.63 -1.33 0.00 0.00 177.39 175.81 3cfk s ILE 48 N -2.55 1.00 0.25 -0.08 -1.09 -1.17 -1.38 121.20 116.18 3cfk s ILE 48 Ca -0.31 -0.48 0.09 0.00 -2.23 0.00 0.00 60.65 57.71 3cfk s ILE 48 Cb 0.10 -0.87 -0.05 0.00 -1.58 0.00 0.00 42.46 40.06 3cfk s ILE 48 CO 0.41 0.30 -0.15 -0.83 -1.23 0.00 0.00 174.94 173.44 3cfk s GLY 49 N 0.10 1.69 -1.45 6.18 0.00 0.85 -1.62 107.32 113.07 3cfk s GLY 49 Ca -0.02 -1.80 -0.06 0.00 0.00 0.00 0.00 44.72 42.84 3cfk s GLY 49 CO 0.01 -1.86 0.70 0.61 0.00 0.00 0.00 173.10 172.56 3cfk n GLY 50 N -0.52 -0.34 5.00 0.20 0.00 -1.17 -1.12 105.19 107.24 3cfk n GLY 50 Ca -0.06 0.15 0.00 0.00 0.00 0.00 0.00 46.02 46.11 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 -4.44 0.00 -1.83 2.61 -1.04 -0.16 -3.98 114.28 105.44 3cfk n THR 51 Ca -0.16 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 61.85 3cfk n THR 51 Cb 0.62 0.00 0.00 0.00 -1.82 0.00 0.00 70.33 69.13 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 2.13 0.06 -4.54 8.00 6.94 -1.19 -3.32 115.26 123.33 3cfk n ASN 52 Ca 0.00 -1.88 -0.40 0.00 -0.02 0.00 0.00 54.58 52.28 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 -0.06 3.57 0.14 -3.83 3.01 -0.27 -4.66 119.74 117.64 3cfk s LYS 53 Ca 0.01 -0.54 -0.30 0.00 -1.01 0.00 0.00 55.97 54.12 3cfk s LYS 53 Cb 0.01 -3.79 -0.07 0.00 -1.01 0.00 0.00 37.83 32.97 3cfk s LYS 53 CO 0.00 -0.43 1.08 0.50 0.51 0.00 0.00 175.35 177.01 3cfk s ARG 54 N 1.80 4.59 0.48 1.68 3.52 -1.26 -0.11 118.95 129.65 3cfk s ARG 54 Ca 0.08 1.66 -0.21 0.00 -0.13 0.00 0.00 55.73 57.13 3cfk s ARG 54 Cb -0.17 -3.32 -0.08 0.00 -1.56 0.00 0.00 34.95 29.82 3cfk s ARG 54 CO 0.11 0.04 1.04 0.00 -0.81 0.00 0.00 175.30 175.68 3cfk s ALA 55 N 0.08 2.88 0.24 6.12 0.00 -0.48 -4.91 121.76 125.70 3cfk s ALA 55 Ca 0.50 0.63 -0.30 0.00 0.00 0.00 0.00 51.96 52.79 3cfk s ALA 55 Cb -0.28 -3.26 -0.15 0.00 0.00 0.00 0.00 23.12 19.44 3cfk s ALA 55 CO 0.33 -0.32 1.05 -2.30 0.00 0.00 0.00 175.76 174.51 3cfk n PRO 56 N -0.90 1.24 0.00 0.00 -0.02 -1.26 -1.66 135.00 132.40 3cfk n PRO 56 Ca 0.09 0.44 0.00 0.00 -2.02 0.00 0.00 63.50 62.01 3cfk n PRO 56 Cb 0.52 -1.84 0.00 0.00 -0.02 0.00 0.00 33.50 32.16 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 1.57 2.83 3.72 -1.23 0.00 -1.26 -5.01 105.19 105.81 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 -1.97 4.46 0.42 1.61 1.01 -0.66 -4.99 120.40 120.29 3cfk s VAL 58 Ca 0.00 1.93 -0.26 0.00 0.00 0.00 0.00 61.98 63.65 3cfk s VAL 58 Cb 0.00 -4.23 -0.10 0.00 0.00 0.00 0.00 36.38 32.05 3cfk s VAL 58 CO 0.00 0.24 1.35 -2.65 0.00 0.00 0.00 175.10 174.04 3cfk n PRO 59 N 3.19 2.11 0.10 2.72 -0.02 -1.26 -4.89 135.00 136.96 3cfk n PRO 59 Ca 0.04 0.75 0.05 0.00 -2.02 0.00 0.00 63.50 62.33 3cfk n PRO 59 Cb 0.49 -2.49 0.50 0.00 -0.02 0.00 0.00 33.50 31.98 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 2.25 1.79 -1.52 3.55 0.00 -1.99 -2.23 119.26 121.12 3cfk h ALA 60 Ca -0.49 -0.03 0.48 0.00 0.00 0.00 0.00 54.91 54.86 3cfk h ALA 60 Cb 1.28 -0.10 -0.10 0.00 0.00 0.00 0.00 17.79 18.87 3cfk h ALA 60 CO 0.61 0.18 1.05 -2.13 0.00 0.00 0.00 179.25 178.96 3cfk n ARG 61 N -4.48 -0.02 -3.53 0.00 0.63 -1.26 -4.43 116.66 103.57 3cfk n ARG 61 Ca 0.01 1.05 -0.37 0.00 -0.92 0.00 0.00 57.85 57.61 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 -4.86 3.59 0.08 -0.14 0.08 -0.84 -0.86 117.98 115.04 3cfk s PHE 62 Ca -0.06 0.79 -0.13 0.00 0.12 0.00 0.00 56.93 57.66 3cfk s PHE 62 Cb 0.26 -2.30 0.02 0.00 -0.57 0.00 0.00 43.02 40.42 3cfk s PHE 62 CO 0.77 0.45 0.29 -1.54 -0.10 0.00 0.00 175.22 175.10 3cfk s SER 63 N -0.32 -0.07 0.13 1.36 1.04 -0.66 -4.94 113.70 110.23 3cfk s SER 63 Ca 0.21 -0.38 0.09 0.00 0.48 0.00 0.00 55.95 56.34 3cfk s SER 63 Cb -0.15 0.38 -0.04 0.00 0.10 0.00 0.00 66.02 66.32 3cfk s SER 63 CO 0.09 -0.72 -0.22 -0.83 0.98 0.00 0.00 173.24 172.54 3cfk s GLY 64 N -2.54 1.39 0.22 7.32 0.00 -1.26 -0.47 107.32 111.97 3cfk s GLY 64 Ca 0.01 -1.38 -0.13 0.00 0.00 0.00 0.00 44.72 43.22 3cfk s GLY 64 CO -0.08 -1.38 0.64 -1.14 0.00 0.00 0.00 173.10 171.13 3cfk n SER 65 N 0.83 -1.47 -4.63 1.64 3.41 -0.29 -4.22 113.62 108.89 3cfk n SER 65 Ca -0.17 -1.92 -0.34 0.00 -0.26 0.00 0.00 58.87 56.17 3cfk n SER 65 Cb 0.54 2.42 -0.10 0.00 -0.26 0.00 0.00 64.21 66.81 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 3.39 -0.20 1.04 1.43 -1.26 -0.44 118.68 122.64 3cfk s LEU 66 Ca 0.14 0.07 0.00 0.00 -1.03 0.00 0.00 54.13 53.30 3cfk s LEU 66 Cb -0.03 -1.76 0.05 0.00 0.03 0.00 0.00 46.19 44.48 3cfk s LEU 66 CO 0.06 0.37 -0.06 -0.63 0.23 0.00 0.00 176.35 176.32 3cfk s ILE 67 N -0.82 1.38 0.00 -0.59 1.01 -0.00 -4.93 121.20 117.25 3cfk s ILE 67 Ca 0.13 -0.94 0.00 0.00 0.00 0.00 0.00 60.65 59.83 3cfk s ILE 67 Cb -0.11 -1.58 0.00 0.00 0.01 0.00 0.00 42.46 40.78 3cfk s ILE 67 CO 0.02 0.04 0.00 0.61 0.00 0.00 0.00 174.94 175.61 3cfk n GLY 68 N 4.76 2.78 0.24 6.18 0.00 -1.26 -1.01 105.19 116.89 3cfk n GLY 68 Ca -0.13 0.31 0.09 0.00 0.00 0.00 0.00 46.02 46.29 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 -2.14 1.61 3.32 -1.97 -3.45 116.42 113.79 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 0.16 -0.59 -0.13 -1.72 0.00 0.00 179.24 176.96 3cfk s ARG 70 N -4.34 2.49 0.29 3.56 0.52 -0.18 0.24 118.95 121.54 3cfk s ARG 70 Ca -0.03 -1.34 -0.13 0.00 -0.52 0.00 0.00 55.73 53.72 3cfk s ARG 70 Cb 0.14 -2.28 -0.08 0.00 0.52 0.00 0.00 34.95 33.25 3cfk s ARG 70 CO 0.63 0.33 0.66 0.00 0.02 0.00 0.00 175.30 176.94 3cfk s ALA 71 N -2.29 3.42 -0.00 2.13 0.00 -0.55 -0.82 121.76 123.66 3cfk s ALA 71 Ca 0.33 -0.10 0.00 0.00 0.00 0.00 0.00 51.96 52.19 3cfk s ALA 71 Cb -0.06 -2.63 0.00 0.00 0.00 0.00 0.00 23.12 20.43 3cfk s ALA 71 CO 0.22 0.39 0.00 0.00 0.00 0.00 0.00 175.76 176.37 3cfk s ALA 72 N -1.94 0.02 -0.22 0.00 0.00 0.41 -0.82 121.76 119.21 3cfk s ALA 72 Ca 0.51 0.02 -0.05 0.00 0.00 0.00 0.00 51.96 52.45 3cfk s ALA 72 Cb -0.11 -0.02 -0.02 0.00 0.00 0.00 0.00 23.12 22.97 3cfk s ALA 72 CO 0.20 -0.01 -0.00 -1.17 0.00 0.00 0.00 175.76 174.77 3cfk s LEU 73 N 0.09 3.12 -0.15 0.00 2.96 0.08 -1.13 118.68 123.65 3cfk s LEU 73 Ca -0.01 -0.29 -0.06 0.00 -0.22 0.00 0.00 54.13 53.54 3cfk s LEU 73 Cb -0.01 -1.81 -0.04 0.00 0.50 0.00 0.00 46.19 44.83 3cfk s LEU 73 CO -0.00 0.00 0.08 -0.89 -1.32 0.00 0.00 176.35 174.22 3cfk s THR 74 N 1.37 4.98 -0.26 3.68 2.01 0.38 -0.06 115.64 127.74 3cfk s THR 74 Ca 0.05 0.02 -0.03 0.00 0.31 0.00 0.00 61.69 62.04 3cfk s THR 74 Cb -0.15 -3.20 0.02 0.00 0.01 0.00 0.00 72.50 69.19 3cfk s THR 74 CO 0.00 0.53 -0.02 -0.63 -0.69 0.00 0.00 174.62 173.82 3cfk s ILE 75 N -0.30 3.20 -0.56 1.82 1.01 0.29 -1.65 121.20 125.01 3cfk s ILE 75 Ca 0.09 -0.92 -0.17 0.00 0.00 0.00 0.00 60.65 59.65 3cfk s ILE 75 Cb -0.12 -2.63 0.12 0.00 0.01 0.00 0.00 42.46 39.84 3cfk s ILE 75 CO 0.01 0.17 0.58 -0.89 0.00 0.00 0.00 174.94 174.81 3cfk s THR 76 N 1.38 5.06 0.00 2.92 2.01 -0.04 -1.62 115.64 125.34 3cfk s THR 76 Ca 0.01 -1.30 0.00 0.00 0.31 0.00 0.00 61.69 60.71 3cfk s THR 76 Cb -0.17 -4.40 0.00 0.00 0.01 0.00 0.00 72.50 67.94 3cfk s THR 76 CO -0.02 -0.97 0.00 0.61 -0.69 0.00 0.00 174.62 173.54 3cfk n GLY 77 N 5.26 0.80 3.66 4.40 0.00 -0.95 -4.75 105.19 113.61 3cfk n GLY 77 Ca -0.12 -0.57 -0.45 0.00 0.00 0.00 0.00 46.02 44.88 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 -0.62 1.00 -2.67 4.61 0.00 -0.14 -4.42 120.51 118.26 3cfk n ALA 78 Ca 0.00 0.42 -0.22 0.00 0.00 0.00 0.00 53.44 53.64 3cfk n ALA 78 Cb 0.22 -2.26 -0.05 0.00 0.00 0.00 0.00 19.45 17.36 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 -0.37 2.68 0.41 0.00 -0.21 -1.26 -0.55 119.66 120.36 3cfk s GLN 79 Ca 0.69 -1.25 0.10 0.00 0.02 0.00 0.00 55.36 54.92 3cfk s GLN 79 Cb -0.66 -2.41 0.92 0.00 1.00 0.00 0.00 33.01 31.85 3cfk s GLN 79 CO 0.49 0.28 2.01 1.79 -2.12 0.00 0.00 175.29 177.74 3cfk h THR 80 N 1.51 1.00 0.00 -0.19 1.35 -1.95 -0.24 112.91 114.40 3cfk h THR 80 Ca -0.46 -0.18 0.00 0.00 -0.55 0.00 0.00 66.41 65.22 3cfk h THR 80 Cb 1.25 0.43 0.00 0.00 -1.73 0.00 0.00 68.15 68.10 3cfk h THR 80 CO 0.60 0.10 0.00 -1.84 -0.25 0.00 0.00 175.52 174.13 3cfk n GLU 81 N -4.47 0.07 0.00 4.72 0.00 -1.25 -2.49 120.64 117.22 3cfk n GLU 81 Ca 0.07 0.21 0.16 0.00 0.00 0.00 0.00 57.16 57.60 3cfk n GLU 81 Cb 0.23 -1.50 0.90 0.00 0.00 0.00 0.00 31.44 31.07 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 -1.43 0.12 -4.65 -1.84 8.00 -0.10 -4.81 116.55 111.85 3cfk n ASP 82 Ca 0.05 -0.99 -0.42 0.00 0.71 0.00 0.00 54.79 54.14 3cfk n ASP 82 Cb 0.16 -0.02 -0.03 0.00 -0.02 0.00 0.00 41.12 41.21 3cfk n ASP 82 CO 0.00 0.00 0.00 -1.61 -0.39 0.00 0.00 177.20 175.20 3cfk s GLU 83 N -2.04 3.99 -0.01 -1.24 2.02 -1.04 -4.84 118.70 115.55 3cfk s GLU 83 Ca 0.46 2.46 -0.29 0.00 0.02 0.00 0.00 54.97 57.61 3cfk s GLU 83 Cb 0.22 -4.17 0.11 0.00 0.10 0.00 0.00 34.13 30.39 3cfk s GLU 83 CO 0.37 -1.11 1.28 0.00 0.02 0.00 0.00 175.26 175.82 3cfk s ALA 84 N 4.97 -2.29 -0.19 5.21 0.00 -1.22 -4.89 121.76 123.36 3cfk s ALA 84 Ca 0.88 0.44 -0.09 0.00 0.00 0.00 0.00 51.96 53.18 3cfk s ALA 84 Cb -0.40 0.55 -0.05 0.00 0.00 0.00 0.00 23.12 23.23 3cfk s ALA 84 CO 0.39 -1.09 0.12 0.42 0.00 0.00 0.00 175.76 175.60 3cfk s ILE 85 N -2.27 5.30 -0.18 0.00 1.01 -0.11 -0.83 121.20 124.12 3cfk s ILE 85 Ca 0.20 0.15 -0.03 0.00 0.00 0.00 0.00 60.65 60.96 3cfk s ILE 85 Cb 0.03 -3.40 -0.02 0.00 0.01 0.00 0.00 42.46 39.08 3cfk s ILE 85 CO -0.02 0.47 -0.05 -0.31 0.00 0.00 0.00 174.94 175.02 3cfk s TYR 86 N 0.18 2.96 -0.10 3.97 1.51 -0.13 0.25 117.35 125.99 3cfk s TYR 86 Ca 0.08 -0.60 -0.00 0.00 -1.01 0.00 0.00 57.07 55.54 3cfk s TYR 86 Cb -0.11 -2.00 -0.03 0.00 -0.11 0.00 0.00 41.96 39.71 3cfk s TYR 86 CO -0.01 -0.26 -0.08 -0.06 -1.11 0.00 0.00 175.55 174.02 3cfk s PHE 87 N 0.80 2.90 0.19 2.71 0.08 -0.11 -0.60 117.98 123.95 3cfk s PHE 87 Ca -0.02 -0.21 0.05 0.00 0.12 0.00 0.00 56.93 56.88 3cfk s PHE 87 Cb -0.15 -1.78 -0.04 0.00 -0.57 0.00 0.00 43.02 40.48 3cfk s PHE 87 CO 0.02 0.12 0.20 0.00 -0.10 0.00 0.00 175.22 175.46 3cfk s ALA 89 N -1.87 -0.33 -0.12 0.00 0.00 -0.22 -0.41 121.76 118.81 3cfk s ALA 89 Ca 0.32 0.73 -0.04 0.00 0.00 0.00 0.00 51.96 52.97 3cfk s ALA 89 Cb -0.10 -0.48 -0.04 0.00 0.00 0.00 0.00 23.12 22.51 3cfk s ALA 89 CO 0.25 -0.16 0.04 -0.51 0.00 0.00 0.00 175.76 175.38 3cfk s LEU 90 N 1.13 3.78 0.29 0.00 1.43 -0.72 -1.52 118.68 123.06 3cfk s LEU 90 Ca -0.09 0.17 -0.23 0.00 -1.03 0.00 0.00 54.13 52.96 3cfk s LEU 90 Cb -0.11 -1.90 -0.09 0.00 0.03 0.00 0.00 46.19 44.12 3cfk s LEU 90 CO -0.06 0.32 0.84 0.26 0.23 0.00 0.00 176.35 177.94 3cfk s TRP 91 N -0.50 3.64 -0.29 0.29 0.52 0.28 -2.05 118.94 120.83 3cfk s TRP 91 Ca 0.10 1.58 -0.14 0.00 0.02 0.00 0.00 56.10 57.66 3cfk s TRP 91 Cb -0.12 -2.77 0.10 0.00 -1.15 0.00 0.00 33.47 29.53 3cfk s TRP 91 CO 0.02 0.24 0.70 1.21 0.02 0.00 0.00 176.95 179.14 3cfk s ASN 92 N -1.70 -0.98 1.27 2.95 3.84 -0.63 -4.36 114.94 115.33 3cfk s ASN 92 Ca 0.48 1.48 0.00 0.00 0.21 0.00 0.00 52.86 55.03 3cfk s ASN 92 Cb -0.17 1.71 0.00 0.00 -0.55 0.00 0.00 41.25 42.24 3cfk s ASN 92 CO 0.22 -0.22 0.00 -0.24 -2.79 0.00 0.00 177.10 174.06 3cfk n SER 93 N 4.70 0.00 0.05 -4.21 2.88 -1.26 -1.14 113.62 114.64 3cfk n SER 93 Ca -0.17 0.00 -0.18 0.00 -1.33 0.00 0.00 58.87 57.20 3cfk n SER 93 Cb 0.55 0.00 -0.14 0.00 -0.75 0.00 0.00 64.21 63.87 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 0.39 -3.42 -3.46 2.35 -2.02 -3.49 115.58 105.93 3cfk h ASN 94 Ca 0.00 -0.61 -0.48 0.00 -0.55 0.00 0.00 56.30 54.66 3cfk h ASN 94 Cb 0.00 -0.13 0.04 0.00 0.05 0.00 0.00 38.32 38.28 3cfk h ASN 94 CO 0.00 1.52 0.09 -1.00 -1.65 0.00 0.00 177.43 176.39 3cfk s HIS 95 N -2.60 3.37 -0.05 1.19 3.76 -0.29 -5.08 115.29 115.59 3cfk s HIS 95 Ca -0.12 0.62 0.05 0.00 -0.15 0.00 0.00 55.06 55.47 3cfk s HIS 95 Cb 0.07 -2.47 -0.02 0.00 1.11 0.00 0.00 32.58 31.27 3cfk s HIS 95 CO 0.84 -0.50 -0.21 -1.17 -0.85 0.00 0.00 174.74 172.84 3cfk s LEU 96 N -4.79 2.31 -0.12 0.89 2.96 -1.26 -1.60 118.68 117.07 3cfk s LEU 96 Ca 0.50 -0.39 0.00 0.00 -0.22 0.00 0.00 54.13 54.02 3cfk s LEU 96 Cb -0.10 -1.44 0.02 0.00 0.50 0.00 0.00 46.19 45.17 3cfk s LEU 96 CO 0.43 0.29 -0.11 -0.69 -1.32 0.00 0.00 176.35 174.95 3cfk s VAL 97 N -0.40 1.30 0.32 1.68 1.01 -0.87 -4.99 120.40 118.44 3cfk s VAL 97 Ca 0.04 -0.48 -0.20 0.00 0.00 0.00 0.00 61.98 61.33 3cfk s VAL 97 Cb -0.12 -1.25 -0.09 0.00 0.00 0.00 0.00 36.38 34.92 3cfk s VAL 97 CO 0.02 0.41 0.83 -0.36 0.00 0.00 0.00 175.10 175.99 3cfk s PHE 98 N 1.43 3.52 0.92 5.22 0.08 -1.26 -1.76 117.98 126.13 3cfk s PHE 98 Ca 0.02 1.49 -0.14 0.00 0.12 0.00 0.00 56.93 58.41 3cfk s PHE 98 Cb -0.13 -2.72 0.16 0.00 -0.57 0.00 0.00 43.02 39.75 3cfk s PHE 98 CO -0.07 0.15 1.23 0.20 -0.10 0.00 0.00 175.22 176.63 3cfk s GLY 99 N -1.91 1.67 0.09 4.36 0.00 0.45 -4.56 107.32 107.42 3cfk s GLY 99 Ca 0.52 -0.90 0.28 0.00 0.00 0.00 0.00 44.72 44.61 3cfk s GLY 99 CO 0.19 -0.25 1.86 0.61 0.00 0.00 0.00 173.10 175.51 3cfk n GLY 100 N -3.20 -1.58 0.00 0.20 0.00 -1.26 -4.77 105.19 94.58 3cfk n GLY 100 Ca 0.11 -0.07 0.00 0.00 0.00 0.00 0.00 46.02 46.07 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 1.39 1.42 2.92 -0.02 0.00 -1.26 -5.03 105.19 104.61 3cfk n GLY 101 Ca 0.06 -1.69 -0.28 0.00 0.00 0.00 0.00 46.02 44.11 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 -2.40 1.18 -0.06 2.61 2.01 0.23 -4.51 115.64 114.70 3cfk s THR 102 Ca 0.00 -0.51 -0.30 0.00 0.31 0.00 0.00 61.69 61.19 3cfk s THR 102 Cb 0.00 -1.24 -0.04 0.00 0.01 0.00 0.00 72.50 71.23 3cfk s THR 102 CO 0.00 0.28 1.29 -0.54 -0.69 0.00 0.00 174.62 174.96 3cfk s LYS 103 N 1.63 4.30 -0.34 4.92 1.02 -0.55 -0.95 119.74 129.76 3cfk s LYS 103 Ca 0.03 1.78 -0.11 0.00 0.02 0.00 0.00 55.97 57.68 3cfk s LYS 103 Cb -0.14 -3.63 -0.00 0.00 -0.52 0.00 0.00 37.83 33.54 3cfk s LYS 103 CO -0.08 -0.56 0.20 -1.17 -0.92 0.00 0.00 175.35 172.82 3cfk s LEU 104 N 2.63 4.44 -0.20 3.17 2.96 -0.01 -1.21 118.68 130.46 3cfk s LEU 104 Ca 0.59 -0.62 -0.10 0.00 -0.22 0.00 0.00 54.13 53.77 3cfk s LEU 104 Cb -0.26 -2.06 -0.05 0.00 0.50 0.00 0.00 46.19 44.32 3cfk s LEU 104 CO 0.22 -0.27 0.14 -0.70 -1.32 0.00 0.00 176.35 174.43 3cfk s GLU 105 N 1.64 4.18 -0.18 1.98 2.12 0.37 -3.37 118.70 125.44 3cfk s GLU 105 Ca 0.05 -0.21 -0.18 0.00 0.36 0.00 0.00 54.97 54.99 3cfk s GLU 105 Cb -0.18 -3.43 -0.04 0.00 0.26 0.00 0.00 34.13 30.74 3cfk s GLU 105 CO 0.08 0.27 0.47 0.42 -0.54 0.00 0.00 175.26 175.97 3cfk s ILE 106 N 0.44 5.15 0.42 -3.70 -1.09 -1.26 -1.55 121.20 119.61 3cfk s ILE 106 Ca 0.08 0.89 -0.23 0.00 -2.23 0.00 0.00 60.65 59.16 3cfk s ILE 106 Cb -0.11 -3.80 -0.09 0.00 -1.58 0.00 0.00 42.46 36.87 3cfk s ILE 106 CO -0.01 0.24 1.03 -0.75 -1.23 0.00 0.00 174.94 174.22 3cfk s LYS 107 N 1.27 4.11 0.30 2.79 2.20 0.56 -4.93 119.74 126.04 3cfk s LYS 107 Ca 0.23 1.43 -0.11 0.00 -0.36 0.00 0.00 55.97 57.16 3cfk s LYS 107 Cb -0.15 -2.41 0.01 0.00 -1.51 0.00 0.00 37.83 33.76 3cfk s LYS 107 CO 0.09 -0.18 0.53 -0.98 -0.36 0.00 0.00 175.35 174.46 3cfk s ARG 108 N -2.71 1.76 0.59 4.03 1.04 -1.26 -4.48 118.95 117.92 3cfk s ARG 108 Ca 0.60 -1.41 -0.19 0.00 -1.04 0.00 0.00 55.73 53.70 3cfk s ARG 108 Cb -0.19 0.49 -0.04 0.00 -2.04 0.00 0.00 34.95 33.18 3cfk s ARG 108 CO 0.24 -0.75 1.19 0.95 -0.04 0.00 0.00 175.30 176.89 3cfk s THR 109 N -3.50 2.73 0.33 4.99 -4.23 -1.26 -4.92 115.64 109.77 3cfk s THR 109 Ca 0.23 0.45 -0.29 0.00 -1.18 0.00 0.00 61.69 60.90 3cfk s THR 109 Cb -0.01 -3.16 -0.11 0.00 1.34 0.00 0.00 72.50 70.56 3cfk s THR 109 CO 0.12 -0.11 1.54 0.68 -0.54 0.00 0.00 174.62 176.31 3cfk s VAL 110 N -1.67 2.10 -0.09 2.29 -7.23 -1.26 -4.80 120.40 109.73 3cfk s VAL 110 Ca 0.76 0.09 0.01 0.00 -1.81 0.00 0.00 61.98 61.03 3cfk s VAL 110 Cb -0.29 -3.06 0.02 0.00 0.56 0.00 0.00 36.38 33.61 3cfk s VAL 110 CO 0.33 0.02 -0.11 0.00 -0.31 0.00 0.00 175.10 175.03 3cfk s ALA 111 N -0.48 1.35 0.42 1.32 0.00 0.85 -4.92 121.76 120.29 3cfk s ALA 111 Ca 0.59 -0.51 -0.24 0.00 0.00 0.00 0.00 51.96 51.80 3cfk s ALA 111 Cb -0.47 -0.73 -0.08 0.00 0.00 0.00 0.00 23.12 21.84 3cfk s ALA 111 CO 0.54 -0.11 1.10 0.00 0.00 0.00 0.00 175.76 177.29 3cfk s ALA 112 N 1.10 3.05 0.40 0.00 0.00 -1.26 -1.33 121.76 123.72 3cfk s ALA 112 Ca -0.06 0.81 -0.24 0.00 0.00 0.00 0.00 51.96 52.47 3cfk s ALA 112 Cb -0.14 -3.32 -0.09 0.00 0.00 0.00 0.00 23.12 19.57 3cfk s ALA 112 CO -0.02 -0.41 1.08 -1.25 0.00 0.00 0.00 175.76 175.17 3cfk s PRO 113 N -2.56 4.10 0.25 0.00 0.04 -1.26 -4.57 135.00 131.00 3cfk s PRO 113 Ca 0.60 1.60 -0.30 0.00 0.04 0.00 0.00 61.00 62.94 3cfk s PRO 113 Cb -0.25 -2.56 -0.09 0.00 0.04 0.00 0.00 34.50 31.64 3cfk s PRO 113 CO 0.31 -0.22 0.99 -1.12 0.04 0.00 0.00 177.00 177.01 3cfk s SER 114 N -1.46 7.52 -0.03 6.66 0.01 -0.94 -4.86 113.70 120.60 3cfk s SER 114 Ca 0.58 2.05 0.07 0.00 1.31 0.00 0.00 55.95 59.96 3cfk s SER 114 Cb -0.24 -2.62 -0.01 0.00 0.21 0.00 0.00 66.02 63.36 3cfk s SER 114 CO 0.30 0.06 -0.23 -0.69 0.41 0.00 0.00 173.24 173.09 3cfk s VAL 115 N -1.16 1.86 0.02 3.43 1.01 -1.26 -0.66 120.40 123.65 3cfk s VAL 115 Ca 0.42 -0.99 0.01 0.00 0.00 0.00 0.00 61.98 61.42 3cfk s VAL 115 Cb -0.28 -1.56 -0.01 0.00 0.00 0.00 0.00 36.38 34.53 3cfk s VAL 115 CO 0.35 0.52 -0.04 -0.36 0.00 0.00 0.00 175.10 175.57 3cfk s PHE 116 N -0.41 0.36 -0.04 5.22 0.40 -0.53 -4.99 117.98 117.99 3cfk s PHE 116 Ca 0.05 -0.30 0.06 0.00 -0.60 0.00 0.00 56.93 56.14 3cfk s PHE 116 Cb -0.10 -0.23 -0.01 0.00 0.51 0.00 0.00 43.02 43.19 3cfk s PHE 116 CO 0.00 -0.08 -0.22 -1.50 0.70 0.00 0.00 175.22 174.13 3cfk s ILE 117 N -0.79 1.82 -0.16 0.64 2.07 -1.26 -0.56 121.20 122.96 3cfk s ILE 117 Ca -0.07 -0.95 0.02 0.00 -1.41 0.00 0.00 60.65 58.25 3cfk s ILE 117 Cb -0.06 -1.53 0.01 0.00 0.13 0.00 0.00 42.46 41.01 3cfk s ILE 117 CO -0.00 0.51 -0.21 -0.36 -1.91 0.00 0.00 174.94 172.97 3cfk s PHE 118 N -0.21 2.72 0.70 3.50 0.08 0.92 -5.00 117.98 120.69 3cfk s PHE 118 Ca -0.00 -1.46 -0.11 0.00 0.12 0.00 0.00 56.93 55.47 3cfk s PHE 118 Cb -0.12 -1.86 0.02 0.00 -0.57 0.00 0.00 43.02 40.49 3cfk s PHE 118 CO 0.02 -0.69 1.07 -1.25 -0.10 0.00 0.00 175.22 174.27 3cfk s PRO 119 N 1.01 2.78 0.56 0.24 0.04 -1.26 -2.21 135.00 136.16 3cfk s PRO 119 Ca -0.02 1.07 -0.21 0.00 0.04 0.00 0.00 61.00 61.88 3cfk s PRO 119 Cb -0.14 -1.97 -0.04 0.00 0.04 0.00 0.00 34.50 32.39 3cfk s PRO 119 CO -0.06 -1.23 1.29 -1.25 0.04 0.00 0.00 177.00 175.79 3cfk s PRO 120 N -4.84 3.09 0.56 0.56 0.04 -1.20 -4.89 135.00 128.31 3cfk s PRO 120 Ca 0.60 2.07 -0.18 0.00 0.04 0.00 0.00 61.00 63.53 3cfk s PRO 120 Cb -0.15 -2.14 -0.05 0.00 0.04 0.00 0.00 34.50 32.19 3cfk s PRO 120 CO 0.52 -1.18 1.07 -1.54 0.04 0.00 0.00 177.00 175.91 3cfk s SER 121 N -1.20 5.89 0.52 6.66 1.04 -1.26 -4.92 113.70 120.43 3cfk s SER 121 Ca 0.74 1.92 0.20 0.00 0.48 0.00 0.00 55.95 59.28 3cfk s SER 121 Cb -0.36 -2.55 1.32 0.00 0.10 0.00 0.00 66.02 64.53 3cfk s SER 121 CO 0.42 -1.09 2.09 0.44 0.98 0.00 0.00 173.24 176.07 3cfk h ASP 122 N 0.86 0.00 -0.59 7.02 3.32 -2.00 -2.36 116.42 122.67 3cfk h ASP 122 Ca -0.48 0.00 -0.09 0.00 0.02 0.00 0.00 57.03 56.48 3cfk h ASP 122 Cb 1.23 0.00 -0.02 0.00 0.22 0.00 0.00 39.33 40.76 3cfk h ASP 122 CO 0.58 0.00 0.01 -0.33 -1.72 0.00 0.00 179.24 177.77 3cfk h GLU 123 N 0.00 1.04 -0.45 3.56 5.08 -2.00 -2.71 114.58 119.09 3cfk h GLU 123 Ca 0.10 -0.33 -0.09 0.00 -1.00 0.00 0.00 59.36 58.05 3cfk h GLU 123 Cb 0.41 -0.10 -0.02 0.00 0.50 0.00 0.00 28.75 29.55 3cfk h GLU 123 CO -0.00 1.02 -0.06 0.37 -1.00 0.00 0.00 179.01 179.34 3cfk h GLN 124 N 0.94 0.84 -0.47 2.33 4.15 -1.75 -3.10 115.11 118.04 3cfk h GLN 124 Ca 0.17 -0.30 0.02 0.00 0.77 0.00 0.00 58.65 59.31 3cfk h GLN 124 Cb 0.55 -0.06 -0.02 0.00 0.21 0.00 0.00 27.48 28.15 3cfk h GLN 124 CO 0.03 0.92 0.31 -0.07 -1.93 0.00 0.00 178.83 178.10 3cfk h LEU 125 N 0.68 0.49 -1.67 -2.39 3.38 -1.39 0.10 115.31 114.52 3cfk h LEU 125 Ca 0.12 -0.01 0.14 0.00 0.09 0.00 0.00 57.88 58.22 3cfk h LEU 125 Cb 0.58 -0.12 -0.04 0.00 0.09 0.00 0.00 40.66 41.17 3cfk h LEU 125 CO 0.03 0.35 0.47 0.11 0.09 0.00 0.00 178.44 179.49 3cfk h LYS 126 N 0.58 0.33 0.00 1.13 1.57 -1.40 -2.60 116.57 116.17 3cfk h LYS 126 Ca 0.18 -0.02 0.00 0.00 -1.87 0.00 0.00 60.65 58.94 3cfk h LYS 126 Cb 0.03 -0.07 0.00 0.00 0.08 0.00 0.00 32.23 32.26 3cfk h LYS 126 CO -0.04 0.22 -0.12 -1.13 -0.57 0.00 0.00 179.45 177.80 3cfk n SER 127 N -4.46 0.33 0.00 0.86 3.41 0.36 -4.94 113.62 109.18 3cfk n SER 127 Ca 0.13 0.38 0.00 0.00 -0.26 0.00 0.00 58.87 59.12 3cfk n SER 127 Cb 0.52 -0.42 0.00 0.00 -0.26 0.00 0.00 64.21 64.06 3cfk n SER 127 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 3cfk n GLY 128 N 1.44 0.57 3.47 5.00 0.00 -0.98 -5.09 105.19 109.60 3cfk n GLY 128 Ca 0.06 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.86 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 1.48 -0.08 2.61 -4.23 -1.25 -1.50 115.64 110.68 3cfk s THR 129 Ca 0.00 -2.04 -0.03 0.00 -1.18 0.00 0.00 61.69 58.44 3cfk s THR 129 Cb 0.00 -2.73 0.04 0.00 1.34 0.00 0.00 72.50 71.16 3cfk s THR 129 CO 0.00 -0.09 0.12 0.00 -0.54 0.00 0.00 174.62 174.11 3cfk s ALA 130 N -3.10 -0.00 -0.16 3.99 0.00 -0.44 -3.59 121.76 118.46 3cfk s ALA 130 Ca 0.34 0.38 -0.03 0.00 0.00 0.00 0.00 51.96 52.65 3cfk s ALA 130 Cb 0.07 -0.77 -0.02 0.00 0.00 0.00 0.00 23.12 22.40 3cfk s ALA 130 CO 0.15 -0.58 -0.05 -1.12 0.00 0.00 0.00 175.76 174.16 3cfk s SER 131 N 2.24 4.66 -0.19 0.00 0.01 -1.26 -1.94 113.70 117.22 3cfk s SER 131 Ca 0.04 -0.18 -0.05 0.00 1.31 0.00 0.00 55.95 57.08 3cfk s SER 131 Cb -0.12 -1.76 -0.02 0.00 0.21 0.00 0.00 66.02 64.32 3cfk s SER 131 CO -0.05 0.15 -0.01 -0.69 0.41 0.00 0.00 173.24 173.05 3cfk s VAL 132 N 0.46 3.92 -0.09 3.43 1.01 0.12 -3.27 120.40 125.98 3cfk s VAL 132 Ca -0.04 -0.33 -0.00 0.00 0.00 0.00 0.00 61.98 61.61 3cfk s VAL 132 Cb -0.14 -2.76 -0.03 0.00 0.00 0.00 0.00 36.38 33.45 3cfk s VAL 132 CO 0.03 0.45 -0.07 -0.69 0.00 0.00 0.00 175.10 174.82 3cfk s VAL 133 N 0.83 3.67 -0.11 2.92 1.01 -0.94 -0.37 120.40 127.42 3cfk s VAL 133 Ca 0.00 -0.48 0.02 0.00 0.00 0.00 0.00 61.98 61.53 3cfk s VAL 133 Cb -0.14 -2.52 -0.01 0.00 0.00 0.00 0.00 36.38 33.70 3cfk s VAL 133 CO 0.02 0.57 -0.19 0.00 0.00 0.00 0.00 175.10 175.50 3cfk s LEU 135 N 0.23 2.47 -0.28 0.00 2.96 0.28 -1.18 118.68 123.16 3cfk s LEU 135 Ca -0.12 -0.41 -0.02 0.00 -0.22 0.00 0.00 54.13 53.36 3cfk s LEU 135 Cb -0.16 -1.53 0.04 0.00 0.50 0.00 0.00 46.19 45.04 3cfk s LEU 135 CO 0.07 0.18 -0.01 -0.76 -1.32 0.00 0.00 176.35 174.50 3cfk s LEU 136 N 0.25 3.66 -0.13 -0.68 1.02 0.42 -1.45 118.68 121.77 3cfk s LEU 136 Ca -0.12 -1.07 -0.00 0.00 0.02 0.00 0.00 54.13 52.95 3cfk s LEU 136 Cb -0.16 -1.72 -0.02 0.00 0.02 0.00 0.00 46.19 44.32 3cfk s LEU 136 CO 0.06 -0.21 -0.12 0.21 0.02 0.00 0.00 176.35 176.31 3cfk s ASN 137 N 1.31 4.08 -1.05 2.29 2.47 0.17 -0.02 114.94 124.20 3cfk s ASN 137 Ca -0.02 -0.31 -0.08 0.00 0.42 0.00 0.00 52.86 52.87 3cfk s ASN 137 Cb -0.18 -1.63 -0.06 0.00 -1.45 0.00 0.00 41.25 37.93 3cfk s ASN 137 CO -0.02 0.17 0.89 0.59 -3.72 0.00 0.00 177.10 175.01 3cfk n ASN 138 N 3.52 -6.52 -4.59 -4.21 5.03 -0.82 -2.21 115.26 105.47 3cfk n ASN 138 Ca -0.18 -0.72 -0.24 0.00 0.87 0.00 0.00 54.58 54.30 3cfk n ASN 138 Cb 0.53 -4.93 -0.08 0.00 -1.02 0.00 0.00 39.78 34.27 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 -3.38 2.60 -0.18 3.10 -0.12 0.42 -4.55 117.98 115.87 3cfk s PHE 139 Ca 0.44 -0.24 -0.15 0.00 -0.05 0.00 0.00 56.93 56.92 3cfk s PHE 139 Cb -0.07 -1.19 0.05 0.00 -0.63 0.00 0.00 43.02 41.17 3cfk s PHE 139 CO 0.76 0.60 0.47 -0.47 -0.05 0.00 0.00 175.22 176.53 3cfk s TYR 140 N -2.13 -0.54 0.27 3.49 6.14 -0.44 -0.87 117.35 123.27 3cfk s TYR 140 Ca 0.29 1.29 -0.05 0.00 0.64 0.00 0.00 57.07 59.24 3cfk s TYR 140 Cb -0.07 0.20 0.06 0.00 0.42 0.00 0.00 41.96 42.57 3cfk s TYR 140 CO 0.17 -0.27 0.34 -0.35 0.64 0.00 0.00 175.55 176.09 3cfk n PRO 141 N 3.03 -0.59 0.09 4.97 -0.04 -1.26 -0.11 135.00 141.09 3cfk n PRO 141 Ca -0.15 -0.53 -0.07 0.00 -0.04 0.00 0.00 63.50 62.72 3cfk n PRO 141 Cb 0.57 -0.38 0.02 0.00 -0.04 0.00 0.00 33.50 33.67 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 0.15 -6.66 0.54 2.43 -1.99 -3.45 114.38 105.40 3cfk h ARG 142 Ca -0.11 -0.15 -0.52 0.00 -0.81 0.00 0.00 59.98 58.39 3cfk h ARG 142 Cb 0.32 0.04 0.06 0.00 -0.42 0.00 0.00 29.97 29.96 3cfk h ARG 142 CO 0.08 0.89 0.96 -1.21 -1.51 0.00 0.00 179.97 179.17 3cfk s GLU 143 N -3.27 4.15 -0.28 0.20 2.02 -1.26 -4.96 118.70 115.30 3cfk s GLU 143 Ca -0.02 2.52 -0.17 0.00 0.02 0.00 0.00 54.97 57.32 3cfk s GLU 143 Cb 0.11 -3.09 0.08 0.00 0.10 0.00 0.00 34.13 31.32 3cfk s GLU 143 CO 0.81 -0.69 0.71 0.00 0.02 0.00 0.00 175.26 176.11 3cfk s ALA 144 N 1.04 -1.89 -0.15 5.21 0.00 -1.26 -4.61 121.76 120.10 3cfk s ALA 144 Ca 0.72 2.37 -0.06 0.00 0.00 0.00 0.00 51.96 54.99 3cfk s ALA 144 Cb -0.48 -1.41 -0.04 0.00 0.00 0.00 0.00 23.12 21.19 3cfk s ALA 144 CO 0.33 -0.37 0.05 0.21 0.00 0.00 0.00 175.76 175.98 3cfk s LYS 145 N 1.48 3.63 -0.12 0.00 2.20 -0.53 -4.98 119.74 121.42 3cfk s LYS 145 Ca -0.09 -0.33 0.03 0.00 -0.36 0.00 0.00 55.97 55.22 3cfk s LYS 145 Cb -0.05 -3.09 0.00 0.00 -1.51 0.00 0.00 37.83 33.18 3cfk s LYS 145 CO -0.17 0.46 -0.22 0.08 -0.36 0.00 0.00 175.35 175.14 3cfk s VAL 146 N -0.16 2.21 -0.08 4.02 1.01 -1.26 -1.51 120.40 124.62 3cfk s VAL 146 Ca 0.07 -0.96 0.03 0.00 0.00 0.00 0.00 61.98 61.13 3cfk s VAL 146 Cb -0.12 -1.87 0.01 0.00 0.00 0.00 0.00 36.38 34.40 3cfk s VAL 146 CO 0.01 0.55 -0.18 -1.10 0.00 0.00 0.00 175.10 174.38 3cfk s GLN 147 N 0.49 2.37 -0.07 2.72 -0.21 0.17 -4.97 119.66 120.15 3cfk s GLN 147 Ca -0.14 -0.65 -0.11 0.00 0.02 0.00 0.00 55.36 54.47 3cfk s GLN 147 Cb -0.17 -1.86 -0.05 0.00 1.00 0.00 0.00 33.01 31.94 3cfk s GLN 147 CO 0.05 0.11 0.28 -1.58 -2.12 0.00 0.00 175.29 172.03 3cfk s TRP 148 N 0.47 3.64 -0.01 0.91 0.52 -1.26 -0.41 118.94 122.81 3cfk s TRP 148 Ca -0.16 0.74 0.02 0.00 0.02 0.00 0.00 56.10 56.72 3cfk s TRP 148 Cb -0.17 -2.15 -0.01 0.00 -1.15 0.00 0.00 33.47 30.00 3cfk s TRP 148 CO 0.06 0.63 -0.07 0.15 0.02 0.00 0.00 176.95 177.74 3cfk s LYS 149 N -0.84 0.59 -0.15 4.98 1.02 -0.67 -0.17 119.74 124.51 3cfk s LYS 149 Ca 0.19 -0.26 0.01 0.00 0.02 0.00 0.00 55.97 55.93 3cfk s LYS 149 Cb -0.14 -0.57 0.02 0.00 -0.52 0.00 0.00 37.83 36.62 3cfk s LYS 149 CO 0.08 0.15 -0.15 0.08 -0.92 0.00 0.00 175.35 174.59 3cfk s VAL 150 N -0.16 1.65 -1.66 3.17 1.01 -0.52 -1.29 120.40 122.60 3cfk s VAL 150 Ca 0.03 -0.69 -0.15 0.00 0.00 0.00 0.00 61.98 61.17 3cfk s VAL 150 Cb -0.03 -1.52 0.13 0.00 0.00 0.00 0.00 36.38 34.95 3cfk s VAL 150 CO -0.00 0.47 0.65 0.47 0.00 0.00 0.00 175.10 176.69 3cfk n ASP 151 N 4.63 -2.34 0.00 3.32 8.00 -0.22 -1.12 116.55 128.82 3cfk n ASP 151 Ca -0.18 -1.05 0.00 0.00 0.71 0.00 0.00 54.79 54.27 3cfk n ASP 151 Cb 0.50 -2.62 0.00 0.00 -0.02 0.00 0.00 41.12 38.98 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 -2.71 -1.22 -4.75 -2.24 5.03 -1.26 -5.02 115.26 103.09 3cfk n ASN 152 Ca -0.02 0.00 -0.37 0.00 0.87 0.00 0.00 54.58 55.06 3cfk n ASN 152 Cb 0.54 -0.67 -0.06 0.00 -1.02 0.00 0.00 39.78 38.56 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 -2.88 3.58 0.12 5.41 0.00 -0.28 -5.03 121.76 122.68 3cfk s ALA 153 Ca 0.00 -0.33 -0.31 0.00 0.00 0.00 0.00 51.96 51.32 3cfk s ALA 153 Cb 0.00 -2.46 -0.09 0.00 0.00 0.00 0.00 23.12 20.58 3cfk s ALA 153 CO 0.00 0.15 1.50 -1.17 0.00 0.00 0.00 175.76 176.24 3cfk s LEU 154 N 0.19 4.36 0.29 0.00 0.20 -1.26 -1.43 118.68 121.02 3cfk s LEU 154 Ca 0.21 2.44 -0.12 0.00 0.69 0.00 0.00 54.13 57.36 3cfk s LEU 154 Cb -0.14 -3.58 -0.08 0.00 -0.43 0.00 0.00 46.19 41.96 3cfk s LEU 154 CO 0.08 -0.76 0.65 -1.10 -0.29 0.00 0.00 176.35 174.92 3cfk s GLN 155 N 1.50 3.87 -0.08 1.98 -1.52 0.77 -4.93 119.66 121.25 3cfk s GLN 155 Ca 0.68 0.44 -0.04 0.00 -1.95 0.00 0.00 55.36 54.50 3cfk s GLN 155 Cb -0.39 -2.53 0.04 0.00 -0.22 0.00 0.00 33.01 29.90 3cfk s GLN 155 CO 0.31 0.21 0.18 0.45 -0.25 0.00 0.00 175.29 176.19 3cfk s SER 156 N -2.43 -0.16 -1.80 5.90 0.15 -1.26 -4.71 113.70 109.38 3cfk s SER 156 Ca 0.50 0.37 0.00 0.00 0.70 0.00 0.00 55.95 57.53 3cfk s SER 156 Cb -0.11 0.26 0.00 0.00 -1.71 0.00 0.00 66.02 64.47 3cfk s SER 156 CO 0.21 -0.15 0.00 0.61 1.20 0.00 0.00 173.24 175.11 3cfk n GLY 157 N 4.18 0.23 1.22 9.45 0.00 -1.26 -4.85 105.19 114.16 3cfk n GLY 157 Ca -0.26 0.00 0.04 0.00 0.00 0.00 0.00 46.02 45.80 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 -1.75 1.35 -4.06 1.61 6.94 -1.26 -5.07 115.26 113.02 3cfk n ASN 158 Ca -0.22 -2.74 -0.12 0.00 -0.02 0.00 0.00 54.58 51.48 3cfk n ASN 158 Cb 0.67 -0.39 -0.11 0.00 -2.36 0.00 0.00 39.78 37.58 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 -2.54 0.75 0.16 0.53 1.04 -1.26 -2.08 113.70 110.31 3cfk s SER 159 Ca 0.36 -0.60 0.04 0.00 0.48 0.00 0.00 55.95 56.22 3cfk s SER 159 Cb 0.38 0.06 -0.05 0.00 0.10 0.00 0.00 66.02 66.51 3cfk s SER 159 CO -0.13 -0.26 -0.07 -1.10 0.98 0.00 0.00 173.24 172.66 3cfk s GLN 160 N -1.86 1.11 0.00 4.02 -0.21 -0.47 -4.97 119.66 117.28 3cfk s GLN 160 Ca -0.08 -1.50 -0.09 0.00 0.02 0.00 0.00 55.36 53.71 3cfk s GLN 160 Cb -0.08 -0.56 0.01 0.00 1.00 0.00 0.00 33.01 33.37 3cfk s GLN 160 CO -0.01 0.02 0.17 -2.00 -2.12 0.00 0.00 175.29 171.35 3cfk s GLU 161 N -3.79 0.53 -0.23 2.91 2.12 -1.26 -0.91 118.70 118.07 3cfk s GLU 161 Ca 0.19 -0.38 -0.18 0.00 0.36 0.00 0.00 54.97 54.97 3cfk s GLU 161 Cb 0.04 0.22 0.06 0.00 0.26 0.00 0.00 34.13 34.71 3cfk s GLU 161 CO 0.02 -0.13 0.59 0.45 -0.54 0.00 0.00 175.26 175.65 3cfk s SER 162 N -1.41 -0.68 0.01 -1.70 0.15 -0.41 -5.01 113.70 104.66 3cfk s SER 162 Ca -0.14 1.23 0.06 0.00 0.70 0.00 0.00 55.95 57.79 3cfk s SER 162 Cb -0.07 1.19 -0.02 0.00 -1.71 0.00 0.00 66.02 65.42 3cfk s SER 162 CO 0.02 -0.21 -0.18 0.54 1.20 0.00 0.00 173.24 174.61 3cfk s VAL 163 N 0.75 1.39 0.78 4.45 0.11 -1.26 -0.94 120.40 125.68 3cfk s VAL 163 Ca -0.04 -0.93 -0.12 0.00 -2.93 0.00 0.00 61.98 57.97 3cfk s VAL 163 Cb -0.05 -1.20 0.06 0.00 -1.53 0.00 0.00 36.38 33.66 3cfk s VAL 163 CO -0.06 0.25 1.13 0.42 -3.33 0.00 0.00 175.10 173.52 3cfk s THR 164 N -0.61 2.70 0.72 5.04 -4.23 -0.32 -5.01 115.64 113.92 3cfk s THR 164 Ca 0.06 0.23 -0.11 0.00 -1.18 0.00 0.00 61.69 60.68 3cfk s THR 164 Cb -0.07 -3.17 0.02 0.00 1.34 0.00 0.00 72.50 70.62 3cfk s THR 164 CO 0.00 -0.30 1.07 -1.61 -0.54 0.00 0.00 174.62 173.25 3cfk s GLU 165 N -5.41 2.76 0.23 3.99 2.02 -1.26 -4.66 118.70 116.37 3cfk s GLU 165 Ca 0.61 0.77 -0.32 0.00 0.02 0.00 0.00 54.97 56.05 3cfk s GLU 165 Cb -0.12 -1.98 -0.12 0.00 0.10 0.00 0.00 34.13 32.01 3cfk s GLU 165 CO 0.51 -1.18 1.66 0.94 0.02 0.00 0.00 175.26 177.21 3cfk n GLN 166 N -3.16 2.67 -2.10 1.61 7.27 -1.26 -4.77 117.38 117.65 3cfk n GLN 166 Ca 0.07 0.96 -0.42 0.00 0.07 0.00 0.00 57.00 57.68 3cfk n GLN 166 Cb 0.55 -2.77 -0.03 0.00 2.41 0.00 0.00 30.24 30.40 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 0.91 6.76 0.00 1.69 -1.08 0.22 -4.89 116.67 120.28 3cfk s ASP 167 Ca 0.72 2.52 0.20 0.00 -0.52 0.00 0.00 52.55 55.47 3cfk s ASP 167 Cb -0.52 -2.61 0.93 0.00 -1.46 0.00 0.00 42.92 39.26 3cfk s ASP 167 CO 0.38 -0.65 1.64 -1.54 0.52 0.00 0.00 175.17 175.53 3cfk n SER 168 N 2.83 0.00 -0.04 -0.34 3.41 -1.26 -1.56 113.62 116.66 3cfk n SER 168 Ca 0.08 0.28 -0.07 0.00 -0.26 0.00 0.00 58.87 58.90 3cfk n SER 168 Cb 0.41 -0.41 -0.02 0.00 -0.26 0.00 0.00 64.21 63.93 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 -1.41 0.32 0.00 4.33 5.02 -1.26 -3.90 118.16 121.25 3cfk n LYS 169 Ca 0.07 0.13 0.12 0.00 -2.02 0.00 0.00 58.31 56.61 3cfk n LYS 169 Cb 0.20 -1.05 0.22 0.00 -0.02 0.00 0.00 35.03 34.38 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 -4.01 1.68 -1.42 4.39 5.68 -1.26 -4.97 116.55 116.65 3cfk n ASP 170 Ca -0.12 -1.32 -0.16 0.00 -0.50 0.00 0.00 54.79 52.69 3cfk n ASP 170 Cb 0.38 0.24 -0.04 0.00 -1.14 0.00 0.00 41.12 40.55 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 -0.10 -4.81 -4.97 -1.12 7.64 -0.60 -5.00 113.62 104.66 3cfk n SER 171 Ca 0.12 0.24 -0.19 0.00 1.01 0.00 0.00 58.87 60.04 3cfk n SER 171 Cb 0.42 -3.78 -0.01 0.00 -1.01 0.00 0.00 64.21 59.84 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 -2.65 4.00 0.23 0.44 -4.23 -1.26 -4.64 115.64 107.52 3cfk s THR 172 Ca 0.00 -1.04 0.09 0.00 -1.18 0.00 0.00 61.69 59.56 3cfk s THR 172 Cb 0.00 -3.38 -0.04 0.00 1.34 0.00 0.00 72.50 70.42 3cfk s THR 172 CO 0.00 -0.16 0.00 -0.31 -0.54 0.00 0.00 174.62 173.61 3cfk s TYR 173 N -2.19 2.75 0.08 3.99 2.02 -0.05 -0.61 117.35 123.35 3cfk s TYR 173 Ca 0.45 -0.19 0.04 0.00 -0.37 0.00 0.00 57.07 56.99 3cfk s TYR 173 Cb -0.09 -1.26 -0.03 0.00 -0.40 0.00 0.00 41.96 40.18 3cfk s TYR 173 CO 0.31 0.58 -0.11 -1.12 -1.57 0.00 0.00 175.55 173.64 3cfk s SER 174 N -3.42 1.39 -0.00 2.29 0.01 -1.26 -0.44 113.70 112.27 3cfk s SER 174 Ca 0.30 -0.72 0.00 0.00 1.31 0.00 0.00 55.95 56.84 3cfk s SER 174 Cb -0.07 0.00 -0.00 0.00 0.21 0.00 0.00 66.02 66.16 3cfk s SER 174 CO 0.19 -0.21 -0.01 -0.22 0.41 0.00 0.00 173.24 173.41 3cfk s LEU 175 N -2.14 2.00 -0.06 2.44 0.20 0.97 -1.18 118.68 120.92 3cfk s LEU 175 Ca 0.01 -0.01 0.04 0.00 0.69 0.00 0.00 54.13 54.86 3cfk s LEU 175 Cb -0.06 -0.03 0.00 0.00 -0.43 0.00 0.00 46.19 45.68 3cfk s LEU 175 CO 0.01 0.01 -0.18 -0.55 -0.29 0.00 0.00 176.35 175.34 3cfk s SER 176 N -0.01 2.38 -0.03 3.68 0.15 -0.12 -0.44 113.70 119.32 3cfk s SER 176 Ca 0.00 -0.40 0.04 0.00 0.70 0.00 0.00 55.95 56.28 3cfk s SER 176 Cb -0.00 -0.85 -0.00 0.00 -1.71 0.00 0.00 66.02 63.45 3cfk s SER 176 CO -0.00 0.14 -0.13 -0.55 1.20 0.00 0.00 173.24 173.90 3cfk s SER 177 N 0.22 1.64 -0.12 5.45 0.15 -0.32 -1.29 113.70 119.43 3cfk s SER 177 Ca -0.10 -0.26 0.03 0.00 0.70 0.00 0.00 55.95 56.32 3cfk s SER 177 Cb -0.14 -0.39 -0.00 0.00 -1.71 0.00 0.00 66.02 63.78 3cfk s SER 177 CO 0.04 0.12 -0.21 -0.89 1.20 0.00 0.00 173.24 173.50 3cfk s THR 178 N 0.03 2.27 -0.24 6.45 2.01 -0.09 0.22 115.64 126.29 3cfk s THR 178 Ca -0.02 -0.93 -0.09 0.00 0.31 0.00 0.00 61.69 60.97 3cfk s THR 178 Cb -0.09 -1.90 -0.04 0.00 0.01 0.00 0.00 72.50 70.48 3cfk s THR 178 CO 0.01 0.55 0.11 -0.22 -0.69 0.00 0.00 174.62 174.38 3cfk s LEU 179 N 0.50 3.76 -0.17 4.42 2.96 0.50 -1.37 118.68 129.26 3cfk s LEU 179 Ca -0.14 -0.05 -0.03 0.00 -0.22 0.00 0.00 54.13 53.69 3cfk s LEU 179 Cb -0.17 -2.01 -0.02 0.00 0.50 0.00 0.00 46.19 44.50 3cfk s LEU 179 CO 0.05 0.02 -0.05 -0.89 -1.32 0.00 0.00 176.35 174.16 3cfk s THR 180 N 1.32 3.59 0.18 3.68 2.01 -0.88 -0.70 115.64 124.84 3cfk s THR 180 Ca 0.06 -0.45 0.00 0.00 0.31 0.00 0.00 61.69 61.61 3cfk s THR 180 Cb -0.15 -2.59 -0.04 0.00 0.01 0.00 0.00 72.50 69.73 3cfk s THR 180 CO 0.05 0.47 0.06 -1.48 -0.69 0.00 0.00 174.62 173.03 3cfk s LEU 181 N 0.75 1.74 0.66 4.42 2.34 -0.82 -4.88 118.68 122.89 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 0.15 -0.01 0.00 -0.56 0.00 0.00 46.19 45.63 3cfk s LEU 181 CO 0.02 -0.70 1.07 -0.94 -1.06 0.00 0.00 176.35 174.74 3cfk s SER 182 N -3.16 5.38 0.17 1.48 1.04 -1.26 -1.33 113.70 116.01 3cfk s SER 182 Ca 0.30 1.79 -0.15 0.00 0.48 0.00 0.00 55.95 58.37 3cfk s SER 182 Cb 0.07 -2.52 0.10 0.00 0.10 0.00 0.00 66.02 63.77 3cfk s SER 182 CO 0.07 -1.44 1.74 0.50 0.98 0.00 0.00 173.24 175.08 3cfk h LYS 183 N -0.17 0.25 -0.61 4.02 3.64 -1.52 0.14 116.57 122.32 3cfk h LYS 183 Ca -0.46 -0.02 0.07 0.00 -1.27 0.00 0.00 60.65 58.98 3cfk h LYS 183 Cb 1.22 -0.06 -0.06 0.00 -0.41 0.00 0.00 32.23 32.93 3cfk h LYS 183 CO 0.56 0.17 0.30 0.00 -2.27 0.00 0.00 179.45 178.21 3cfk h ALA 184 N 1.28 0.81 -0.20 5.00 0.00 -1.93 -0.98 119.26 123.24 3cfk h ALA 184 Ca 0.19 0.04 -0.14 0.00 0.00 0.00 0.00 54.91 55.00 3cfk h ALA 184 Cb 0.20 -0.06 -0.01 0.00 0.00 0.00 0.00 17.79 17.93 3cfk h ALA 184 CO -0.22 -0.06 -0.44 -0.44 0.00 0.00 0.00 179.25 178.09 3cfk h ASP 185 N 0.56 0.54 -0.24 0.00 3.32 -1.77 -2.85 116.42 115.98 3cfk h ASP 185 Ca 0.29 -0.25 -0.02 0.00 0.02 0.00 0.00 57.03 57.07 3cfk h ASP 185 Cb 0.24 -0.15 -0.02 0.00 0.22 0.00 0.00 39.33 39.62 3cfk h ASP 185 CO -0.21 0.91 0.12 0.22 -1.72 0.00 0.00 179.24 178.55 3cfk h TYR 186 N 0.41 0.40 0.00 4.55 3.20 -0.05 -2.58 116.97 122.90 3cfk h TYR 186 Ca 0.03 -0.01 0.00 0.00 3.14 0.00 0.00 58.73 61.89 3cfk h TYR 186 Cb 0.94 -0.13 0.00 0.00 1.54 0.00 0.00 36.73 39.08 3cfk h TYR 186 CO 0.03 0.32 0.00 0.39 -1.64 0.00 0.00 178.16 177.27 3cfk n GLU 187 N -4.42 0.06 0.00 1.82 -0.58 -0.44 -3.34 120.64 113.76 3cfk n GLU 187 Ca 0.01 0.08 0.13 0.00 -0.42 0.00 0.00 57.16 56.96 3cfk n GLU 187 Cb 0.13 -1.58 0.36 0.00 -0.57 0.00 0.00 31.44 29.78 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 -1.69 0.20 -4.32 3.49 5.02 -0.97 -4.92 118.16 114.96 3cfk n LYS 188 Ca 0.06 -0.10 -0.20 0.00 -2.02 0.00 0.00 58.31 56.05 3cfk n LYS 188 Cb 0.34 -1.50 -0.13 0.00 -0.02 0.00 0.00 35.03 33.73 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 -2.87 1.32 -0.18 2.13 3.76 -1.21 -5.08 115.29 113.16 3cfk s HIS 189 Ca 0.15 -0.39 -0.14 0.00 -0.15 0.00 0.00 55.06 54.53 3cfk s HIS 189 Cb 0.18 -0.77 -0.08 0.00 1.11 0.00 0.00 32.58 33.02 3cfk s HIS 189 CO 0.62 0.06 -0.14 1.17 -0.85 0.00 0.00 174.74 175.60 3cfk n LYS 190 N 1.67 0.51 -3.56 1.40 4.81 -1.26 -4.72 118.16 117.00 3cfk n LYS 190 Ca -0.19 0.44 -0.38 0.00 -0.87 0.00 0.00 58.31 57.31 3cfk n LYS 190 Cb 0.54 -1.63 -0.10 0.00 0.02 0.00 0.00 35.03 33.86 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 -2.44 5.29 -0.22 3.15 1.01 -1.26 -0.78 120.40 125.15 3cfk s VAL 191 Ca -0.24 0.25 -0.02 0.00 0.00 0.00 0.00 61.98 61.97 3cfk s VAL 191 Cb 0.05 -3.56 0.01 0.00 0.00 0.00 0.00 36.38 32.88 3cfk s VAL 191 CO 0.38 0.25 -0.09 -0.31 0.00 0.00 0.00 175.10 175.33 3cfk s TYR 192 N 1.69 2.95 0.06 5.22 1.51 -0.75 -1.06 117.35 126.97 3cfk s TYR 192 Ca 0.09 -1.35 0.08 0.00 -1.01 0.00 0.00 57.07 54.88 3cfk s TYR 192 Cb -0.16 -2.04 -0.03 0.00 -0.11 0.00 0.00 41.96 39.63 3cfk s TYR 192 CO 0.10 -0.68 -0.22 0.00 -1.11 0.00 0.00 175.55 173.63 3cfk s ALA 193 N 1.37 1.90 -0.21 3.71 0.00 -0.42 -1.72 121.76 126.40 3cfk s ALA 193 Ca 0.04 -1.16 -0.00 0.00 0.00 0.00 0.00 51.96 50.83 3cfk s ALA 193 Cb -0.15 -0.35 0.02 0.00 0.00 0.00 0.00 23.12 22.64 3cfk s ALA 193 CO -0.06 0.42 -0.14 0.00 0.00 0.00 0.00 175.76 175.98 3cfk s GLU 195 N 1.32 3.40 -0.13 0.00 2.12 0.46 -1.06 118.70 124.80 3cfk s GLU 195 Ca 0.03 -0.67 0.01 0.00 0.36 0.00 0.00 54.97 54.70 3cfk s GLU 195 Cb -0.14 -2.70 0.02 0.00 0.26 0.00 0.00 34.13 31.57 3cfk s GLU 195 CO -0.09 0.15 -0.12 0.08 -0.54 0.00 0.00 175.26 174.74 3cfk s VAL 196 N 0.51 1.38 -0.08 3.70 1.01 0.47 -0.66 120.40 126.73 3cfk s VAL 196 Ca -0.08 -0.53 -0.01 0.00 0.00 0.00 0.00 61.98 61.37 3cfk s VAL 196 Cb -0.15 -1.31 -0.03 0.00 0.00 0.00 0.00 36.38 34.89 3cfk s VAL 196 CO 0.04 0.42 -0.03 0.42 0.00 0.00 0.00 175.10 175.95 3cfk s THR 197 N 1.40 4.00 -0.04 3.92 -4.23 -0.57 -1.95 115.64 118.18 3cfk s THR 197 Ca 0.02 -0.36 -0.29 0.00 -1.18 0.00 0.00 61.69 59.87 3cfk s THR 197 Cb -0.13 -2.66 0.06 0.00 1.34 0.00 0.00 72.50 71.11 3cfk s THR 197 CO -0.07 0.60 0.64 -2.28 -0.54 0.00 0.00 174.62 172.96 3cfk s HIS 198 N -0.77 -0.60 0.43 3.99 2.46 -1.26 -1.45 115.29 118.08 3cfk s HIS 198 Ca 0.12 1.00 0.14 0.00 0.47 0.00 0.00 55.06 56.79 3cfk s HIS 198 Cb -0.11 0.38 1.02 0.00 -0.13 0.00 0.00 32.58 33.74 3cfk s HIS 198 CO 0.02 -0.60 1.96 0.37 -2.47 0.00 0.00 174.74 174.02 3cfk h GLN 199 N 3.04 0.42 0.00 2.88 4.15 -1.93 -0.44 115.11 123.23 3cfk h GLN 199 Ca -0.28 -0.03 0.00 0.00 0.77 0.00 0.00 58.65 59.12 3cfk h GLN 199 Cb 1.15 -0.10 0.00 0.00 0.21 0.00 0.00 27.48 28.75 3cfk h GLN 199 CO 0.39 0.28 0.00 0.41 -1.93 0.00 0.00 178.83 177.98 3cfk n GLY 200 N -1.51 -1.28 3.67 2.39 0.00 -1.26 -4.65 105.19 102.54 3cfk n GLY 200 Ca 0.11 -0.04 -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 -3.37 3.88 0.10 0.99 1.43 -0.18 -4.59 118.68 116.95 3cfk s LEU 201 Ca 0.09 0.13 0.27 0.00 -1.03 0.00 0.00 54.13 53.60 3cfk s LEU 201 Cb 0.13 -1.97 1.02 0.00 0.03 0.00 0.00 46.19 45.40 3cfk s LEU 201 CO 0.40 0.21 1.85 -1.54 0.23 0.00 0.00 176.35 177.50 3cfk n SER 202 N 3.31 0.40 -3.50 2.29 3.41 -1.26 -4.66 113.62 113.61 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 -0.65 -0.05 0.00 -0.26 0.00 0.00 64.21 63.78 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 -3.75 -0.60 0.50 4.04 1.04 -1.26 -5.15 113.70 108.52 3cfk s SER 203 Ca 0.12 0.47 -0.23 0.00 0.48 0.00 0.00 55.95 56.79 3cfk s SER 203 Cb 0.16 0.53 -0.06 0.00 0.10 0.00 0.00 66.02 66.74 3cfk s SER 203 CO 0.56 -0.69 1.36 -2.84 0.98 0.00 0.00 173.24 172.61 3cfk s PRO 204 N -1.97 3.43 -0.13 4.02 0.02 -1.26 -4.97 135.00 134.14 3cfk s PRO 204 Ca -0.06 2.25 -0.11 0.00 0.02 0.00 0.00 61.00 63.09 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 -0.97 0.24 0.08 -0.33 0.00 0.00 177.00 176.04 3cfk s VAL 205 N -1.29 5.34 -0.10 3.83 1.01 -0.82 -4.90 120.40 123.48 3cfk s VAL 205 Ca 0.66 0.43 0.03 0.00 0.00 0.00 0.00 61.98 63.10 3cfk s VAL 205 Cb -0.40 -3.55 -0.01 0.00 0.00 0.00 0.00 36.38 32.42 3cfk s VAL 205 CO 0.49 0.50 -0.18 -0.89 0.00 0.00 0.00 175.10 175.02 3cfk s THR 206 N -0.25 2.64 -0.03 3.92 2.01 -1.26 -0.39 115.64 122.27 3cfk s THR 206 Ca 0.16 -0.83 0.07 0.00 0.31 0.00 0.00 61.69 61.39 3cfk s THR 206 Cb -0.13 -2.05 -0.02 0.00 0.01 0.00 0.00 72.50 70.31 3cfk s THR 206 CO 0.04 0.55 -0.24 -0.54 -0.69 0.00 0.00 174.62 173.74 3cfk s LYS 207 N 0.07 2.29 0.19 4.92 -0.14 -0.23 -4.98 119.74 121.86 3cfk s LYS 207 Ca -0.08 -0.89 -0.12 0.00 -1.36 0.00 0.00 55.97 53.53 3cfk s LYS 207 Cb -0.15 -2.12 0.00 0.00 -1.68 0.00 0.00 37.83 33.88 3cfk s LYS 207 CO 0.05 0.52 0.38 -1.54 -0.76 0.00 0.00 175.35 174.00 3cfk s SER 208 N -0.50 -0.06 0.07 2.83 1.04 -1.26 -0.46 113.70 115.35 3cfk s SER 208 Ca 0.07 -0.80 -0.04 0.00 0.48 0.00 0.00 55.95 55.65 3cfk s SER 208 Cb -0.11 0.50 -0.02 0.00 0.10 0.00 0.00 66.02 66.49 3cfk s SER 208 CO 0.00 -0.98 0.07 0.72 0.98 0.00 0.00 173.24 174.03 3cfk s PHE 209 N -3.96 0.35 -0.26 5.02 -0.12 -0.70 -5.00 117.98 113.30 3cfk s PHE 209 Ca 0.17 -0.84 -0.09 0.00 -0.05 0.00 0.00 56.93 56.12 3cfk s PHE 209 Cb 0.01 -0.24 -0.04 0.00 -0.63 0.00 0.00 43.02 42.13 3cfk s PHE 209 CO 0.01 -0.45 0.13 -0.80 -0.05 0.00 0.00 175.22 174.06 3cfk s ASN 210 N -2.87 5.57 0.08 1.98 0.01 -1.26 -1.82 114.94 116.62 3cfk s ASN 210 Ca 0.06 -0.11 -0.37 0.00 -0.71 0.00 0.00 52.86 51.73 3cfk s ASN 210 Cb 0.06 -2.02 -0.17 0.00 0.41 0.00 0.00 41.25 39.53 3cfk s ASN 210 CO -0.10 -0.04 1.30 -1.14 -1.51 0.00 0.00 177.10 175.61 3cfk n ARG 211 N 4.96 0.98 -3.11 -0.60 0.63 0.04 -1.79 116.66 117.77 3cfk n ARG 211 Ca -0.15 0.35 -0.16 0.00 -0.92 0.00 0.00 57.85 56.97 3cfk n ARG 211 Cb 0.52 -1.97 0.05 0.00 0.45 0.00 0.00 32.46 31.50 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 2.36 -0.11 0.00 5.14 0.00 -1.26 -4.99 105.19 106.34 3cfk n GLY 212 Ca 0.19 -0.07 0.00 0.00 0.00 0.00 0.00 46.02 46.14 3cfk n GLY 212 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50