#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2fdr s PHE 4 N 0.00 2.64 -1.93 1.61 0.08 -1.26 -4.63 117.98 114.48 2fdr s PHE 4 Ca 0.00 -0.72 0.20 0.00 0.12 0.00 0.00 56.93 56.52 2fdr s PHE 4 Cb 0.00 -1.72 0.03 0.00 -0.57 0.00 0.00 43.02 40.76 2fdr s PHE 4 CO 0.00 -0.23 1.01 -0.25 -0.10 0.00 0.00 175.22 175.65 2fdr n ASP 5 N 3.24 2.02 -3.69 1.36 10.43 0.76 -4.93 116.55 125.73 2fdr n ASP 5 Ca -0.18 -1.51 -0.13 0.00 2.57 0.00 0.00 54.79 55.54 2fdr n ASP 5 Cb 0.53 0.37 -0.09 0.00 1.84 0.00 0.00 41.12 43.76 2fdr n ASP 5 CO 0.00 0.00 0.00 -0.22 -1.07 0.00 0.00 177.20 175.91 2fdr s LEU 6 N -2.13 -0.02 -0.21 0.64 2.96 -1.17 -4.30 118.68 114.46 2fdr s LEU 6 Ca 0.18 1.05 -0.04 0.00 -0.22 0.00 0.00 54.13 55.10 2fdr s LEU 6 Cb 0.16 1.78 -0.01 0.00 0.50 0.00 0.00 46.19 48.62 2fdr s LEU 6 CO 0.43 -0.18 -0.05 -0.63 -1.32 0.00 0.00 176.35 174.60 2fdr s ILE 7 N 0.38 3.36 -0.24 6.68 1.01 -0.58 -1.52 121.20 130.29 2fdr s ILE 7 Ca -0.01 -0.50 -0.11 0.00 0.00 0.00 0.00 60.65 60.03 2fdr s ILE 7 Cb -0.04 -2.52 -0.05 0.00 0.01 0.00 0.00 42.46 39.86 2fdr s ILE 7 CO -0.01 0.44 0.17 -0.63 0.00 0.00 0.00 174.94 174.91 2fdr s ILE 8 N 1.33 5.36 -0.05 2.92 1.01 -0.09 -1.73 121.20 129.94 2fdr s ILE 8 Ca 0.04 0.21 -0.01 0.00 0.00 0.00 0.00 60.65 60.89 2fdr s ILE 8 Cb -0.14 -3.51 -0.04 0.00 0.01 0.00 0.00 42.46 38.78 2fdr s ILE 8 CO -0.02 0.35 0.02 -0.36 0.00 0.00 0.00 174.94 174.93 2fdr s PHE 9 N 1.03 3.19 0.70 3.97 0.08 0.47 -0.47 117.98 126.95 2fdr s PHE 9 Ca 0.08 0.19 -0.11 0.00 0.12 0.00 0.00 56.93 57.21 2fdr s PHE 9 Cb -0.13 -1.76 0.01 0.00 -0.57 0.00 0.00 43.02 40.57 2fdr s PHE 9 CO 0.04 0.50 1.07 0.34 -0.10 0.00 0.00 175.22 177.07 2fdr s ASP 10 N -1.21 5.38 -0.08 1.36 2.15 -0.88 -1.53 116.67 121.86 2fdr s ASP 10 Ca 0.17 1.39 -0.07 0.00 0.43 0.00 0.00 52.55 54.47 2fdr s ASP 10 Cb -0.12 -2.25 -0.02 0.00 -0.30 0.00 0.00 42.92 40.23 2fdr s ASP 10 CO 0.06 -1.41 -0.13 0.00 -0.17 0.00 0.00 175.17 173.53 2fdr s ASP 12 N -4.81 6.33 0.00 0.00 1.01 -1.26 -0.99 116.67 116.94 2fdr s ASP 12 Ca -0.11 2.54 0.00 0.00 0.71 0.00 0.00 52.55 55.69 2fdr s ASP 12 Cb 0.01 -2.53 0.00 0.00 1.01 0.00 0.00 42.92 41.42 2fdr s ASP 12 CO 0.16 -1.17 0.00 0.61 0.21 0.00 0.00 175.17 174.97 2fdr n GLY 13 N 4.69 0.88 1.18 0.21 0.00 -0.27 -4.78 105.19 107.10 2fdr n GLY 13 Ca 0.21 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.23 2fdr n GLY 13 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 2fdr n VAL 14 N -2.01 0.93 0.02 1.61 0.31 -0.82 -4.47 118.33 113.91 2fdr n VAL 14 Ca 0.00 0.31 -0.21 0.00 -0.01 0.00 0.00 64.34 64.43 2fdr n VAL 14 Cb 0.00 -1.42 -0.14 0.00 -0.91 0.00 0.00 33.84 31.37 2fdr n VAL 14 CO 0.00 0.00 0.00 -0.07 -1.32 0.00 0.00 176.83 175.44 2fdr h LEU 15 N 0.00 0.43 -8.65 7.52 3.38 -1.17 -3.44 115.31 113.39 2fdr h LEU 15 Ca 0.00 -0.90 -0.60 0.00 0.09 0.00 0.00 57.88 56.47 2fdr h LEU 15 Cb 0.10 -0.14 -0.24 0.00 0.09 0.00 0.00 40.66 40.47 2fdr h LEU 15 CO 0.00 1.80 -0.84 0.68 0.09 0.00 0.00 178.44 180.17 2fdr s VAL 16 N -2.57 1.80 -1.45 1.22 -7.23 -0.93 -1.12 120.40 110.13 2fdr s VAL 16 Ca -0.20 -1.39 -0.07 0.00 -1.81 0.00 0.00 61.98 58.51 2fdr s VAL 16 Cb 0.06 -1.59 0.03 0.00 0.56 0.00 0.00 36.38 35.45 2fdr s VAL 16 CO 0.79 0.13 2.62 -0.67 -0.31 0.00 0.00 175.10 177.66 2fdr n ASP 17 N 1.50 8.35 0.06 4.85 2.03 0.10 -1.11 116.55 132.33 2fdr n ASP 17 Ca -0.18 -2.91 0.09 0.00 0.52 0.00 0.00 54.79 52.31 2fdr n ASP 17 Cb 0.53 -1.44 -0.06 0.00 -0.72 0.00 0.00 41.12 39.43 2fdr n ASP 17 CO 0.00 0.00 0.00 -1.54 -1.92 0.00 0.00 177.20 173.74 2fdr n SER 18 N 2.47 0.60 0.11 1.67 3.41 -1.26 -4.20 113.62 116.42 2fdr n SER 18 Ca 0.69 0.24 -0.02 0.00 -0.26 0.00 0.00 58.87 59.52 2fdr n SER 18 Cb 0.24 0.84 0.03 0.00 -0.26 0.00 0.00 64.21 65.06 2fdr n SER 18 CO 0.00 0.00 0.00 -0.33 -0.16 0.00 0.00 175.04 174.55 2fdr h GLU 19 N 0.00 0.00 -0.21 4.33 4.39 -1.91 -2.56 114.58 118.62 2fdr h GLU 19 Ca -0.04 0.00 -0.02 0.00 0.34 0.00 0.00 59.36 59.64 2fdr h GLU 19 Cb 1.12 0.00 -0.01 0.00 -0.10 0.00 0.00 28.75 29.75 2fdr h GLU 19 CO 0.01 0.73 0.05 0.97 -1.16 0.00 0.00 179.01 179.61 2fdr h ILE 20 N 0.00 1.11 -0.07 3.13 6.09 -1.92 0.73 117.51 126.58 2fdr h ILE 20 Ca -0.01 -0.37 -0.16 0.00 -1.37 0.00 0.00 64.86 62.96 2fdr h ILE 20 Cb 1.44 0.90 0.01 0.00 0.47 0.00 0.00 36.82 39.64 2fdr h ILE 20 CO 0.10 0.13 -0.59 0.40 -3.07 0.00 0.00 178.15 175.12 2fdr h ILE 21 N 0.29 1.38 -0.20 2.19 2.04 -1.68 -0.30 117.51 121.22 2fdr h ILE 21 Ca 0.07 -1.94 0.00 0.00 1.00 0.00 0.00 64.86 63.99 2fdr h ILE 21 Cb 0.12 2.33 -0.01 0.00 -0.74 0.00 0.00 36.82 38.51 2fdr h ILE 21 CO -0.00 0.58 0.13 0.00 0.00 0.00 0.00 178.15 178.86 2fdr h ALA 22 N 0.42 0.26 -0.80 1.87 0.00 -1.34 -1.09 119.26 118.58 2fdr h ALA 22 Ca -0.05 -0.02 0.12 0.00 0.00 0.00 0.00 54.91 54.95 2fdr h ALA 22 Cb 1.25 -0.08 -0.08 0.00 0.00 0.00 0.00 17.79 18.88 2fdr h ALA 22 CO 0.12 -0.25 0.42 0.00 0.00 0.00 0.00 179.25 179.54 2fdr h ALA 23 N 1.06 1.17 -0.36 0.00 0.00 -0.79 0.31 119.26 120.64 2fdr h ALA 23 Ca 0.07 0.06 -0.03 0.00 0.00 0.00 0.00 54.91 55.02 2fdr h ALA 23 Cb -0.01 -0.05 -0.02 0.00 0.00 0.00 0.00 17.79 17.71 2fdr h ALA 23 CO -0.02 -0.03 0.11 1.96 0.00 0.00 0.00 179.25 181.27 2fdr h GLN 24 N 0.66 0.57 -0.12 0.00 4.20 -0.77 -0.83 115.11 118.82 2fdr h GLN 24 Ca 0.41 -0.13 -0.01 0.00 0.06 0.00 0.00 58.65 58.99 2fdr h GLN 24 Cb 0.49 -0.08 -0.00 0.00 0.30 0.00 0.00 27.48 28.19 2fdr h GLN 24 CO -0.31 0.60 0.03 0.28 -0.67 0.00 0.00 178.83 178.76 2fdr h VAL 25 N 0.44 1.19 -0.28 -0.54 2.07 -0.68 -2.63 116.25 115.81 2fdr h VAL 25 Ca 0.12 -0.59 -0.06 0.00 0.82 0.00 0.00 66.70 66.99 2fdr h VAL 25 Cb 0.27 1.36 -0.01 0.00 -1.52 0.00 0.00 31.29 31.38 2fdr h VAL 25 CO -0.00 0.17 -0.05 -0.33 0.02 0.00 0.00 177.57 177.38 2fdr h GLU 26 N -0.00 0.53 -0.18 1.57 5.08 -0.93 -1.62 114.58 119.02 2fdr h GLU 26 Ca 0.04 -0.20 -0.07 0.00 -1.00 0.00 0.00 59.36 58.13 2fdr h GLU 26 Cb 0.24 -0.03 -0.01 0.00 0.50 0.00 0.00 28.75 29.44 2fdr h GLU 26 CO -0.00 0.72 -0.22 0.66 -1.00 0.00 0.00 179.01 179.18 2fdr h SER 27 N 0.29 0.32 -0.24 1.42 4.64 -1.20 0.24 113.55 119.02 2fdr h SER 27 Ca 0.07 -0.09 -0.20 0.00 -0.47 0.00 0.00 61.79 61.10 2fdr h SER 27 Cb 0.52 -0.09 0.00 0.00 -0.31 0.00 0.00 62.40 62.53 2fdr h SER 27 CO 0.02 0.55 -0.62 0.03 -0.87 0.00 0.00 176.83 175.94 2fdr h ARG 28 N 0.30 0.85 -0.74 4.77 2.47 -1.34 0.28 114.38 120.98 2fdr h ARG 28 Ca 0.05 -0.59 -0.06 0.00 -1.26 0.00 0.00 59.98 58.12 2fdr h ARG 28 Cb 0.55 0.09 -0.03 0.00 -1.65 0.00 0.00 29.97 28.93 2fdr h ARG 28 CO 0.04 1.21 0.21 -0.07 0.56 0.00 0.00 179.97 181.92 2fdr h LEU 29 N 0.62 1.09 -0.24 3.04 3.38 -0.97 -1.33 115.31 120.90 2fdr h LEU 29 Ca -0.01 -0.22 -0.02 0.00 0.09 0.00 0.00 57.88 57.72 2fdr h LEU 29 Cb 1.24 -0.29 -0.01 0.00 0.09 0.00 0.00 40.66 41.69 2fdr h LEU 29 CO 0.13 1.02 0.06 -0.07 0.09 0.00 0.00 178.44 179.68 2fdr h LEU 30 N 1.10 0.36 -0.38 1.67 3.38 -0.95 -2.71 115.31 117.77 2fdr h LEU 30 Ca 0.23 -0.22 0.02 0.00 0.09 0.00 0.00 57.88 58.00 2fdr h LEU 30 Cb 0.34 -0.09 -0.03 0.00 0.09 0.00 0.00 40.66 40.97 2fdr h LEU 30 CO -0.00 0.48 0.22 0.74 0.09 0.00 0.00 178.44 179.97 2fdr h THR 31 N 0.21 1.04 -0.21 0.22 2.02 -0.57 -0.85 112.91 114.77 2fdr h THR 31 Ca 0.08 -0.16 -0.05 0.00 0.77 0.00 0.00 66.41 67.05 2fdr h THR 31 Cb 0.26 0.55 -0.01 0.00 -1.74 0.00 0.00 68.15 67.21 2fdr h THR 31 CO -0.00 0.08 -0.10 -0.33 0.37 0.00 0.00 175.52 175.54 2fdr h GLU 32 N 0.45 0.34 0.00 6.66 5.08 -1.29 -2.71 114.58 123.11 2fdr h GLU 32 Ca 0.15 -0.08 0.00 0.00 -1.00 0.00 0.00 59.36 58.43 2fdr h GLU 32 Cb 0.00 -0.05 0.00 0.00 0.50 0.00 0.00 28.75 29.21 2fdr h GLU 32 CO -0.07 0.45 0.00 0.00 -1.00 0.00 0.00 179.01 178.39 2fdr n ALA 33 N -2.49 2.41 0.00 3.43 0.00 -0.84 -4.84 120.51 118.19 2fdr n ALA 33 Ca -0.00 -0.14 0.00 0.00 0.00 0.00 0.00 53.44 53.29 2fdr n ALA 33 Cb 0.27 -1.44 0.00 0.00 0.00 0.00 0.00 19.45 18.28 2fdr n ALA 33 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2fdr n GLY 34 N 0.90 1.40 2.69 0.00 0.00 -1.02 -4.64 105.19 104.50 2fdr n GLY 34 Ca 0.16 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.90 2fdr n GLY 34 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 173.32 172.85 2fdr s TYR 35 N -2.00 2.36 0.03 1.61 6.14 -0.39 -5.01 117.35 120.09 2fdr s TYR 35 Ca 0.00 -2.78 -0.30 0.00 0.64 0.00 0.00 57.07 54.63 2fdr s TYR 35 Cb 0.00 -1.92 -0.08 0.00 0.42 0.00 0.00 41.96 40.38 2fdr s TYR 35 CO 0.00 -0.70 1.78 -1.25 0.64 0.00 0.00 175.55 176.02 2fdr s PRO 36 N -0.49 4.17 -0.21 4.97 0.04 -1.26 -2.40 135.00 139.81 2fdr s PRO 36 Ca 0.26 2.43 -0.18 0.00 0.04 0.00 0.00 61.00 63.55 2fdr s PRO 36 Cb -0.07 -3.88 0.06 0.00 0.04 0.00 0.00 34.50 30.64 2fdr s PRO 36 CO -0.13 -0.85 0.55 -1.50 0.04 0.00 0.00 177.00 175.11 2fdr s ILE 37 N 3.61 -0.00 0.50 0.56 2.07 -1.26 -4.97 121.20 121.70 2fdr s ILE 37 Ca 0.80 0.01 -0.03 0.00 -1.41 0.00 0.00 60.65 60.02 2fdr s ILE 37 Cb -0.40 -0.78 -0.01 0.00 0.13 0.00 0.00 42.46 41.41 2fdr s ILE 37 CO 0.35 0.01 0.76 -0.94 -1.91 0.00 0.00 174.94 173.21 2fdr s SER 38 N 0.61 5.85 0.31 4.50 1.04 -1.26 -4.69 113.70 120.06 2fdr s SER 38 Ca -0.03 0.55 0.03 0.00 0.48 0.00 0.00 55.95 56.99 2fdr s SER 38 Cb -0.05 -1.74 0.62 0.00 0.10 0.00 0.00 66.02 64.95 2fdr s SER 38 CO -0.04 -0.78 1.88 -0.37 0.98 0.00 0.00 173.24 174.91 2fdr h VAL 39 N 0.19 0.96 -0.61 5.02 -1.51 -1.94 -2.69 116.25 115.67 2fdr h VAL 39 Ca -0.46 -0.32 0.05 0.00 -1.23 0.00 0.00 66.70 64.74 2fdr h VAL 39 Cb 1.24 -0.05 -0.05 0.00 -2.13 0.00 0.00 31.29 30.31 2fdr h VAL 39 CO 0.59 0.17 0.33 -0.33 -1.23 0.00 0.00 177.57 177.11 2fdr h GLU 40 N 0.93 0.61 -2.35 5.19 3.07 -1.93 -3.25 114.58 116.85 2fdr h GLU 40 Ca 0.44 -0.04 -0.10 0.00 -0.50 0.00 0.00 59.36 59.16 2fdr h GLU 40 Cb 0.42 -0.14 -0.04 0.00 -0.84 0.00 0.00 28.75 28.16 2fdr h GLU 40 CO -0.20 0.40 -0.03 0.39 -1.40 0.00 0.00 179.01 178.18 2fdr n GLU 41 N -4.81 1.10 0.00 2.33 1.02 -1.02 -3.15 120.64 116.11 2fdr n GLU 41 Ca 0.07 -0.51 0.00 0.00 -0.02 0.00 0.00 57.16 56.70 2fdr n GLU 41 Cb 0.15 -1.71 0.00 0.00 -0.02 0.00 0.00 31.44 29.86 2fdr n GLU 41 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 2fdr n GLY 43 N 2.56 0.00 0.35 0.62 0.00 -1.23 -0.05 105.19 107.44 2fdr n GLY 43 Ca 0.22 0.00 -0.03 0.00 0.00 0.00 0.00 46.02 46.21 2fdr n GLY 43 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 2fdr h GLU 44 N 0.00 1.18 0.03 1.61 4.39 -1.88 -2.80 114.58 117.11 2fdr h GLU 44 Ca 0.00 -0.14 -0.33 0.00 0.34 0.00 0.00 59.36 59.24 2fdr h GLU 44 Cb 0.00 -0.23 -0.05 0.00 -0.10 0.00 0.00 28.75 28.37 2fdr h GLU 44 CO 0.00 0.86 -1.95 0.54 -1.16 0.00 0.00 179.01 177.31 2fdr n ARG 45 N -4.34 0.67 -0.08 2.33 1.74 0.92 -4.67 116.66 113.23 2fdr n ARG 45 Ca 0.09 0.22 0.02 0.00 -0.77 0.00 0.00 57.85 57.41 2fdr n ARG 45 Cb 0.10 -1.71 0.03 0.00 -1.02 0.00 0.00 32.46 29.86 2fdr n ARG 45 CO 0.00 0.00 0.00 1.19 -1.52 0.00 0.00 177.63 177.30 2fdr n PHE 46 N -3.10 0.00 -1.65 -1.55 3.72 -1.24 -5.08 117.46 108.56 2fdr n PHE 46 Ca -0.25 -0.41 -0.45 0.00 -0.05 0.00 0.00 57.45 56.29 2fdr n PHE 46 Cb 1.07 -0.06 -0.03 0.00 -0.94 0.00 0.00 39.48 39.52 2fdr n PHE 46 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 2fdr n ALA 47 N -0.50 0.66 -1.16 4.37 0.00 -1.06 -4.81 120.51 118.02 2fdr n ALA 47 Ca 0.03 0.41 0.00 0.00 0.00 0.00 0.00 53.44 53.89 2fdr n ALA 47 Cb 0.46 -2.20 0.00 0.00 0.00 0.00 0.00 19.45 17.70 2fdr n ALA 47 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2fdr n GLY 48 N 1.88 1.05 3.65 0.00 0.00 -1.26 -5.06 105.19 105.46 2fdr n GLY 48 Ca 0.11 -0.37 -0.25 0.00 0.00 0.00 0.00 46.02 45.51 2fdr n GLY 48 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2fdr s THR 50 N -2.33 3.58 0.30 2.61 -4.23 -1.26 -5.03 115.64 109.28 2fdr s THR 50 Ca 0.00 -1.64 0.03 0.00 -1.18 0.00 0.00 61.69 58.90 2fdr s THR 50 Cb 0.00 -2.85 0.29 0.00 1.34 0.00 0.00 72.50 71.28 2fdr s THR 50 CO 0.00 -0.22 1.83 -0.25 -0.54 0.00 0.00 174.62 175.44 2fdr h TRP 51 N 2.36 1.08 -0.09 3.99 -0.00 -1.99 -1.25 115.95 120.05 2fdr h TRP 51 Ca -0.46 0.03 -0.00 0.00 -0.00 0.00 0.00 58.89 58.46 2fdr h TRP 51 Cb 1.22 -0.34 -0.00 0.00 -0.00 0.00 0.00 29.16 30.04 2fdr h TRP 51 CO 0.65 0.40 0.05 -0.22 -0.00 0.00 0.00 178.44 179.32 2fdr h LYS 52 N 0.91 0.13 -0.11 2.65 3.64 -2.00 -2.34 116.57 119.45 2fdr h LYS 52 Ca 0.50 -0.01 -0.12 0.00 -1.27 0.00 0.00 60.65 59.74 2fdr h LYS 52 Cb 0.58 -0.03 -0.01 0.00 -0.41 0.00 0.00 32.23 32.37 2fdr h LYS 52 CO -0.27 0.16 -0.46 -0.91 -2.27 0.00 0.00 179.45 175.70 2fdr h ASN 53 N 0.06 0.30 -0.36 4.20 2.35 -1.91 -2.37 115.58 117.86 2fdr h ASN 53 Ca 0.03 -0.14 0.02 0.00 -0.55 0.00 0.00 56.30 55.67 2fdr h ASN 53 Cb 0.07 -0.08 -0.03 0.00 0.05 0.00 0.00 38.32 38.33 2fdr h ASN 53 CO -0.01 0.72 0.19 0.40 -1.65 0.00 0.00 177.43 177.08 2fdr h ILE 54 N 0.23 1.00 -0.35 2.81 2.04 -1.16 0.65 117.51 122.72 2fdr h ILE 54 Ca 0.01 -0.13 -0.09 0.00 1.00 0.00 0.00 64.86 65.66 2fdr h ILE 54 Cb 0.90 0.58 -0.02 0.00 -0.74 0.00 0.00 36.82 37.55 2fdr h ILE 54 CO 0.07 0.07 -0.14 -0.07 0.00 0.00 0.00 178.15 178.09 2fdr h LEU 55 N 0.38 0.61 -0.58 1.44 3.38 -1.27 0.22 115.31 119.50 2fdr h LEU 55 Ca 0.15 -0.18 -0.07 0.00 0.09 0.00 0.00 57.88 57.87 2fdr h LEU 55 Cb 0.04 -0.17 -0.02 0.00 0.09 0.00 0.00 40.66 40.60 2fdr h LEU 55 CO -0.09 0.78 0.10 -0.07 0.09 0.00 0.00 178.44 179.24 2fdr h LEU 56 N 0.57 0.92 -0.90 1.67 3.38 -1.16 -1.81 115.31 117.99 2fdr h LEU 56 Ca 0.10 -0.26 -0.10 0.00 0.09 0.00 0.00 57.88 57.71 2fdr h LEU 56 Cb 0.57 -0.25 -0.01 0.00 0.09 0.00 0.00 40.66 41.06 2fdr h LEU 56 CO 0.04 0.95 -0.25 -0.61 0.09 0.00 0.00 178.44 178.66 2fdr h GLN 57 N 0.87 0.53 -0.30 1.13 4.15 -0.31 -0.92 115.11 120.25 2fdr h GLN 57 Ca 0.18 -0.20 -0.11 0.00 0.77 0.00 0.00 58.65 59.29 2fdr h GLN 57 Cb 0.41 -0.03 -0.01 0.00 0.21 0.00 0.00 27.48 28.06 2fdr h GLN 57 CO 0.01 0.74 -0.23 0.28 -1.93 0.00 0.00 178.83 177.69 2fdr h VAL 58 N 0.47 1.30 -0.54 2.39 2.07 -0.83 0.00 116.25 121.11 2fdr h VAL 58 Ca 0.07 -1.38 -0.11 0.00 0.82 0.00 0.00 66.70 66.10 2fdr h VAL 58 Cb 0.68 1.52 -0.02 0.00 -1.52 0.00 0.00 31.29 31.95 2fdr h VAL 58 CO 0.05 0.44 -0.10 1.05 0.02 0.00 0.00 177.57 179.04 2fdr h GLU 59 N 0.45 1.01 -0.61 1.57 4.11 -1.29 0.20 114.58 120.02 2fdr h GLU 59 Ca 0.06 -0.37 0.03 0.00 0.07 0.00 0.00 59.36 59.14 2fdr h GLU 59 Cb 0.79 -0.07 -0.04 0.00 0.50 0.00 0.00 28.75 29.93 2fdr h GLU 59 CO 0.06 1.06 0.38 1.03 0.07 0.00 0.00 179.01 181.60 2fdr h SER 60 N 0.89 0.61 0.71 3.06 0.87 -1.08 0.14 113.55 118.74 2fdr h SER 60 Ca 0.14 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.70 2fdr h SER 60 Cb 0.66 -0.13 0.00 0.00 -0.44 0.00 0.00 62.40 62.50 2fdr h SER 60 CO 0.05 0.43 -1.14 -0.62 -0.53 0.00 0.00 176.83 175.02 2fdr n GLU 61 N -4.73 0.52 0.00 2.24 1.02 -0.02 -4.60 120.64 115.07 2fdr n GLU 61 Ca 0.06 0.04 0.00 0.00 -0.02 0.00 0.00 57.16 57.24 2fdr n GLU 61 Cb 0.08 -1.72 0.00 0.00 -0.02 0.00 0.00 31.44 29.78 2fdr n GLU 61 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 2fdr n ALA 62 N -2.09 0.09 -1.54 0.62 0.00 0.70 -5.04 120.51 113.25 2fdr n ALA 62 Ca 0.00 -0.04 -0.17 0.00 0.00 0.00 0.00 53.44 53.23 2fdr n ALA 62 Cb 0.52 0.00 -0.07 0.00 0.00 0.00 0.00 19.45 19.90 2fdr n ALA 62 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.50 177.93 2fdr n SER 63 N 0.00 -4.53 -4.70 0.00 7.64 0.48 -4.92 113.62 107.60 2fdr n SER 63 Ca 0.00 0.41 -0.42 0.00 1.01 0.00 0.00 58.87 59.87 2fdr n SER 63 Cb 0.27 -4.07 -0.03 0.00 -1.01 0.00 0.00 64.21 59.37 2fdr n SER 63 CO 0.00 0.00 0.00 -0.63 -3.01 0.00 0.00 175.04 171.40 2fdr s ILE 64 N -2.47 2.68 -0.12 0.44 -1.09 -1.26 -4.92 121.20 114.47 2fdr s ILE 64 Ca 0.00 0.25 -0.29 0.00 -2.23 0.00 0.00 60.65 58.38 2fdr s ILE 64 Cb 0.00 -3.16 -0.06 0.00 -1.58 0.00 0.00 42.46 37.66 2fdr s ILE 64 CO 0.00 0.00 1.90 -2.84 -1.23 0.00 0.00 174.94 172.77 2fdr s PRO 65 N 2.38 3.77 -0.17 2.79 0.02 -1.26 -4.54 135.00 137.99 2fdr s PRO 65 Ca 0.77 2.13 -0.04 0.00 0.02 0.00 0.00 61.00 63.87 2fdr s PRO 65 Cb -0.44 -4.16 0.06 0.00 0.02 0.00 0.00 34.50 29.98 2fdr s PRO 65 CO 0.34 -1.36 0.08 -0.51 -0.33 0.00 0.00 177.00 175.22 2fdr s LEU 66 N 5.67 0.52 0.85 -5.54 1.43 -1.26 -4.93 118.68 115.42 2fdr s LEU 66 Ca 0.85 -0.62 -0.12 0.00 -1.03 0.00 0.00 54.13 53.21 2fdr s LEU 66 Cb -0.34 -0.31 0.13 0.00 0.03 0.00 0.00 46.19 45.70 2fdr s LEU 66 CO 0.35 -0.33 1.20 -0.94 0.23 0.00 0.00 176.35 176.86 2fdr s SER 67 N 2.08 3.97 0.43 2.29 1.04 -1.26 -4.98 113.70 117.27 2fdr s SER 67 Ca 0.02 0.45 0.23 0.00 0.48 0.00 0.00 55.95 57.12 2fdr s SER 67 Cb -0.16 -0.77 0.34 0.00 0.10 0.00 0.00 66.02 65.53 2fdr s SER 67 CO -0.08 -2.20 1.59 0.00 0.98 0.00 0.00 173.24 173.53 2fdr h ALA 68 N -1.19 0.98 -0.01 5.32 0.00 -2.02 -3.15 119.26 119.19 2fdr h ALA 68 Ca -0.44 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.47 2fdr h ALA 68 Cb 1.28 0.00 -0.00 0.00 0.00 0.00 0.00 17.79 19.07 2fdr h ALA 68 CO 0.52 0.00 0.06 0.77 0.00 0.00 0.00 179.25 180.60 2fdr h SER 69 N 0.00 0.00 0.01 0.00 0.02 -2.02 -1.71 113.55 109.85 2fdr h SER 69 Ca 0.00 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.95 2fdr h SER 69 Cb 0.99 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.53 2fdr h SER 69 CO 0.00 0.00 -0.12 -0.11 -1.14 0.00 0.00 176.83 175.46 2fdr n LEU 70 N -3.22 2.14 0.09 5.07 0.00 -1.19 -3.30 117.00 116.59 2fdr n LEU 70 Ca -0.03 -0.72 -0.04 0.00 0.00 0.00 0.00 56.01 55.22 2fdr n LEU 70 Cb 0.13 -0.02 -0.01 0.00 0.00 0.00 0.00 43.42 43.52 2fdr n LEU 70 CO 0.21 0.37 0.28 -0.07 0.00 0.00 0.00 177.39 178.17 2fdr h LEU 71 N 3.17 0.00 0.00 -1.96 4.07 -1.48 -3.28 115.31 115.83 2fdr h LEU 71 Ca 0.00 0.00 -0.22 0.00 0.08 0.00 0.00 57.88 57.74 2fdr h LEU 71 Cb 0.75 0.00 -0.04 0.00 1.08 0.00 0.00 40.66 42.45 2fdr h LEU 71 CO 0.00 0.84 -1.75 0.47 -1.08 0.00 0.00 178.44 176.92 2fdr n ASP 72 N -3.48 0.57 -0.17 -0.43 8.00 -1.24 -3.56 116.55 116.24 2fdr n ASP 72 Ca -0.00 0.26 -0.02 0.00 0.71 0.00 0.00 54.79 55.73 2fdr n ASP 72 Cb 0.82 0.52 0.20 0.00 -0.02 0.00 0.00 41.12 42.64 2fdr n ASP 72 CO 0.00 0.00 0.00 0.50 -0.39 0.00 0.00 177.20 177.31 2fdr h LYS 73 N 0.00 0.91 0.58 -1.24 3.64 -1.69 -2.18 116.57 116.59 2fdr h LYS 73 Ca -0.25 -0.14 -0.03 0.00 -1.27 0.00 0.00 60.65 58.96 2fdr h LYS 73 Cb 1.74 -0.16 0.01 0.00 -0.41 0.00 0.00 32.23 33.41 2fdr h LYS 73 CO 0.04 0.74 -0.28 1.03 -2.27 0.00 0.00 179.45 178.71 2fdr h SER 74 N 0.90 -0.66 -0.62 4.20 0.87 -1.68 -1.38 113.55 115.17 2fdr h SER 74 Ca 0.21 -0.03 0.02 0.00 -1.23 0.00 0.00 61.79 60.76 2fdr h SER 74 Cb 0.17 0.17 -0.03 0.00 -0.44 0.00 0.00 62.40 62.26 2fdr h SER 74 CO -0.02 -0.38 0.40 -0.08 -0.53 0.00 0.00 176.83 176.22 2fdr h GLU 75 N -0.93 0.77 -0.00 2.24 4.81 -1.59 0.11 114.58 119.98 2fdr h GLU 75 Ca -0.08 -0.05 -0.20 0.00 -0.13 0.00 0.00 59.36 58.90 2fdr h GLU 75 Cb 0.65 -0.17 -0.01 0.00 0.63 0.00 0.00 28.75 29.84 2fdr h GLU 75 CO 0.13 0.51 -0.87 1.57 -0.73 0.00 0.00 179.01 179.62 2fdr h LYS 76 N 0.80 0.24 -0.04 1.92 2.10 -1.47 -1.01 116.57 119.11 2fdr h LYS 76 Ca 0.24 -0.25 -0.01 0.00 -2.00 0.00 0.00 60.65 58.63 2fdr h LYS 76 Cb -0.04 0.07 -0.00 0.00 -0.90 0.00 0.00 32.23 31.36 2fdr h LYS 76 CO -0.07 0.97 -0.00 1.25 -2.00 0.00 0.00 179.45 179.59 2fdr h LEU 77 N 0.13 0.07 -0.45 7.07 5.85 -1.01 -3.17 115.31 123.81 2fdr h LEU 77 Ca -0.05 -0.34 0.09 0.00 0.84 0.00 0.00 57.88 58.42 2fdr h LEU 77 Cb 1.49 -0.02 -0.08 0.00 0.37 0.00 0.00 40.66 42.43 2fdr h LEU 77 CO 0.14 0.39 -0.03 0.25 -0.34 0.00 0.00 178.44 178.84 2fdr h LEU 78 N -0.26 -0.26 -0.15 2.25 5.85 -0.80 0.29 115.31 122.23 2fdr h LEU 78 Ca 0.01 0.11 0.00 0.00 0.84 0.00 0.00 57.88 58.84 2fdr h LEU 78 Cb 0.36 0.22 0.00 0.00 0.37 0.00 0.00 40.66 41.60 2fdr h LEU 78 CO 0.00 -0.09 0.00 0.47 -0.34 0.00 0.00 178.44 178.48 2fdr n ASP 79 N -5.25 0.00 0.00 1.25 10.43 -0.39 -0.38 116.55 122.21 2fdr n ASP 79 Ca 0.04 0.00 0.00 0.00 2.57 0.00 0.00 54.79 57.40 2fdr n ASP 79 Cb 0.24 0.00 0.00 0.00 1.84 0.00 0.00 41.12 43.20 2fdr n ASP 79 CO 0.00 0.00 0.00 0.54 -1.07 0.00 0.00 177.20 176.67 2fdr n ARG 81 N -0.21 0.00 0.00 -1.24 5.12 0.09 -2.07 116.66 118.36 2fdr n ARG 81 Ca 0.00 0.00 -0.11 0.00 -1.93 0.00 0.00 57.85 55.81 2fdr n ARG 81 Cb 0.00 0.00 -0.06 0.00 -1.16 0.00 0.00 32.46 31.24 2fdr n ARG 81 CO 0.00 0.00 0.00 -0.07 -1.93 0.00 0.00 177.63 175.63 2fdr h LEU 82 N 0.00 0.09 -1.08 0.55 3.38 -0.95 0.12 115.31 117.43 2fdr h LEU 82 Ca 0.00 -0.04 -0.05 0.00 0.09 0.00 0.00 57.88 57.88 2fdr h LEU 82 Cb 0.00 -0.02 -0.02 0.00 0.09 0.00 0.00 40.66 40.70 2fdr h LEU 82 CO 0.00 0.11 0.10 -0.08 0.09 0.00 0.00 178.44 178.66 2fdr h GLU 83 N 0.07 0.76 0.20 1.13 4.81 -1.65 -1.41 114.58 118.49 2fdr h GLU 83 Ca 0.03 -0.16 -0.31 0.00 -0.13 0.00 0.00 59.36 58.79 2fdr h GLU 83 Cb 0.03 -0.11 0.03 0.00 0.63 0.00 0.00 28.75 29.33 2fdr h GLU 83 CO -0.01 0.70 -1.34 -0.09 -0.73 0.00 0.00 179.01 177.54 2fdr h ARG 84 N 0.73 0.56 0.00 1.92 2.43 -1.79 -3.42 114.38 114.81 2fdr h ARG 84 Ca 0.16 -0.87 0.00 0.00 -0.81 0.00 0.00 59.98 58.46 2fdr h ARG 84 Cb 0.30 0.31 0.00 0.00 -0.42 0.00 0.00 29.97 30.16 2fdr h ARG 84 CO 0.00 1.41 -0.50 -0.25 -1.51 0.00 0.00 179.97 179.12 2fdr n ASP 85 N -3.78 2.38 -4.73 -3.80 8.00 0.40 -5.06 116.55 109.96 2fdr n ASP 85 Ca -0.15 -0.26 -0.42 0.00 0.71 0.00 0.00 54.79 54.66 2fdr n ASP 85 Cb 1.04 1.01 -0.02 0.00 -0.02 0.00 0.00 41.12 43.13 2fdr n ASP 85 CO 0.00 0.00 0.00 0.55 -0.39 0.00 0.00 177.20 177.36 2fdr n VAL 86 N -1.25 0.67 -4.56 2.53 3.14 -0.54 -4.99 118.33 113.32 2fdr n VAL 86 Ca 0.00 -0.17 -0.31 0.00 -2.96 0.00 0.00 64.34 60.90 2fdr n VAL 86 Cb 0.01 -1.89 -0.11 0.00 -1.06 0.00 0.00 33.84 30.78 2fdr n VAL 86 CO 0.00 0.00 0.00 -0.54 -6.46 0.00 0.00 176.83 169.83 2fdr s LYS 87 N 0.05 2.34 0.64 1.45 -0.14 -1.26 -4.79 119.74 118.02 2fdr s LYS 87 Ca 0.68 -0.84 -0.18 0.00 -1.36 0.00 0.00 55.97 54.27 2fdr s LYS 87 Cb -0.53 -2.36 -0.02 0.00 -1.68 0.00 0.00 37.83 33.25 2fdr s LYS 87 CO 0.44 0.57 1.30 -1.50 -0.76 0.00 0.00 175.35 175.40 2fdr s ILE 88 N -0.96 2.04 0.19 2.17 2.07 -1.26 0.01 121.20 125.46 2fdr s ILE 88 Ca 0.16 0.02 -0.30 0.00 -1.41 0.00 0.00 60.65 59.12 2fdr s ILE 88 Cb -0.11 -3.01 -0.08 0.00 0.13 0.00 0.00 42.46 39.39 2fdr s ILE 88 CO 0.06 -0.00 1.03 -0.63 -1.91 0.00 0.00 174.94 173.49 2fdr s ILE 89 N -1.38 3.99 0.32 2.00 -1.09 -0.27 -4.63 121.20 120.13 2fdr s ILE 89 Ca 0.82 1.81 -0.28 0.00 -2.23 0.00 0.00 60.65 60.76 2fdr s ILE 89 Cb -0.38 -4.15 -0.13 0.00 -1.58 0.00 0.00 42.46 36.22 2fdr s ILE 89 CO 0.41 0.35 1.27 0.47 -1.23 0.00 0.00 174.94 176.21 2fdr n ASP 90 N 2.07 2.59 0.00 3.58 10.43 -1.26 -2.59 116.55 131.37 2fdr n ASP 90 Ca 0.01 1.20 0.00 0.00 2.57 0.00 0.00 54.79 58.56 2fdr n ASP 90 Cb 0.47 -1.45 0.00 0.00 1.84 0.00 0.00 41.12 41.98 2fdr n ASP 90 CO 0.00 0.00 0.00 0.61 -1.07 0.00 0.00 177.20 176.74 2fdr n GLY 91 N 1.03 2.06 0.36 0.44 0.00 -1.26 -4.64 105.19 103.18 2fdr n GLY 91 Ca 0.06 0.00 -0.17 0.00 0.00 0.00 0.00 46.02 45.91 2fdr n GLY 91 CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 2fdr h VAL 92 N 0.00 0.36 -0.68 1.61 2.07 -1.87 0.86 116.25 118.59 2fdr h VAL 92 Ca 0.00 0.00 0.14 0.00 0.82 0.00 0.00 66.70 67.66 2fdr h VAL 92 Cb 0.00 0.36 -0.11 0.00 -1.52 0.00 0.00 31.29 30.02 2fdr h VAL 92 CO 0.00 0.00 0.12 0.11 0.02 0.00 0.00 177.57 177.82 2fdr h LYS 93 N -0.82 0.22 0.01 1.57 1.57 -1.91 0.44 116.57 117.64 2fdr h LYS 93 Ca -0.07 -0.01 0.00 0.00 -1.87 0.00 0.00 60.65 58.70 2fdr h LYS 93 Cb 0.65 -0.05 -0.01 0.00 0.08 0.00 0.00 32.23 32.91 2fdr h LYS 93 CO 0.10 0.14 -0.03 0.35 -0.57 0.00 0.00 179.45 179.44 2fdr h PHE 94 N 0.22 -0.07 0.40 -1.35 3.57 -1.89 -0.51 116.94 117.32 2fdr h PHE 94 Ca 0.38 0.00 -0.01 0.00 3.53 0.00 0.00 57.97 61.87 2fdr h PHE 94 Cb 0.62 0.03 -0.01 0.00 2.79 0.00 0.00 35.95 39.38 2fdr h PHE 94 CO -0.29 -0.05 -0.27 0.00 -2.23 0.00 0.00 178.31 175.47 2fdr h ALA 95 N 0.93 -0.66 -0.38 2.41 0.00 0.12 -2.79 119.26 118.90 2fdr h ALA 95 Ca 0.01 -0.12 0.08 0.00 0.00 0.00 0.00 54.91 54.88 2fdr h ALA 95 Cb 0.07 0.35 -0.02 0.00 0.00 0.00 0.00 17.79 18.19 2fdr h ALA 95 CO -0.02 -0.89 0.26 -0.07 0.00 0.00 0.00 179.25 178.53 2fdr h LEU 96 N -0.66 0.12 -0.48 0.00 3.38 -0.78 -0.15 115.31 116.75 2fdr h LEU 96 Ca -0.04 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.93 2fdr h LEU 96 Cb 0.55 -0.02 0.00 0.00 0.09 0.00 0.00 40.66 41.28 2fdr h LEU 96 CO 0.02 0.08 0.00 -1.54 0.09 0.00 0.00 178.44 177.09 2fdr n SER 97 N -4.46 0.69 0.00 -0.43 3.41 -0.21 -3.98 113.62 108.64 2fdr n SER 97 Ca 0.05 0.64 0.00 0.00 -0.26 0.00 0.00 58.87 59.30 2fdr n SER 97 Cb 0.35 -0.79 0.00 0.00 -0.26 0.00 0.00 64.21 63.51 2fdr n SER 97 CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 175.04 175.42 2fdr n ARG 98 N -2.22 3.48 -2.83 4.33 1.74 -0.17 -5.01 116.66 115.97 2fdr n ARG 98 Ca 0.03 0.00 -0.40 0.00 -0.77 0.00 0.00 57.85 56.71 2fdr n ARG 98 Cb 0.29 -0.74 -0.06 0.00 -1.02 0.00 0.00 32.46 30.93 2fdr n ARG 98 CO 0.00 0.00 0.00 -0.51 -1.52 0.00 0.00 177.63 175.60 2fdr s LEU 99 N -2.43 4.59 -0.01 0.55 1.43 -0.56 -4.97 118.68 117.28 2fdr s LEU 99 Ca 0.00 1.80 0.21 0.00 -1.03 0.00 0.00 54.13 55.10 2fdr s LEU 99 Cb 0.00 -3.48 -0.25 0.00 0.03 0.00 0.00 46.19 42.49 2fdr s LEU 99 CO 0.00 0.13 0.79 0.35 0.23 0.00 0.00 176.35 177.84 2fdr n THR 100 N 1.82 0.00 -2.65 5.49 -2.24 -1.26 -4.96 114.28 110.48 2fdr n THR 100 Ca -0.02 -0.12 -0.40 0.00 -2.27 0.00 0.00 64.05 61.24 2fdr n THR 100 Cb 0.48 0.79 -0.05 0.00 -2.10 0.00 0.00 70.33 69.44 2fdr n THR 100 CO 0.00 0.00 0.00 -0.89 -0.57 0.00 0.00 175.07 173.61 2fdr s THR 101 N -3.06 3.86 0.84 4.28 2.01 -1.26 -5.03 115.64 117.28 2fdr s THR 101 Ca 0.04 1.87 -0.13 0.00 0.31 0.00 0.00 61.69 63.79 2fdr s THR 101 Cb 0.15 -4.19 0.07 0.00 0.01 0.00 0.00 72.50 68.54 2fdr s THR 101 CO 0.85 0.45 0.97 -2.65 -0.69 0.00 0.00 174.62 173.55 2fdr n PRO 102 N 1.37 -0.01 -4.02 4.92 -0.02 -1.26 -4.80 135.00 131.18 2fdr n PRO 102 Ca -0.02 0.07 -0.08 0.00 -2.02 0.00 0.00 63.50 61.45 2fdr n PRO 102 Cb 0.46 -2.25 -0.10 0.00 -0.02 0.00 0.00 33.50 31.59 2fdr n PRO 102 CO 0.00 0.00 0.00 -0.98 1.98 0.00 0.00 175.50 176.50 2fdr s ARG 103 N -3.96 0.52 0.29 -0.52 1.70 -1.26 -1.53 118.95 114.18 2fdr s ARG 103 Ca 0.68 -0.93 -0.12 0.00 -0.47 0.00 0.00 55.73 54.90 2fdr s ARG 103 Cb -0.27 0.19 0.01 0.00 -0.57 0.00 0.00 34.95 34.30 2fdr s ARG 103 CO 0.56 -0.10 0.54 0.00 -1.08 0.00 0.00 175.30 175.22 2fdr s ILE 105 N -3.57 2.81 -0.18 0.00 1.01 -0.58 -0.39 121.20 120.30 2fdr s ILE 105 Ca 0.22 -0.73 0.01 0.00 0.00 0.00 0.00 60.65 60.14 2fdr s ILE 105 Cb -0.02 -2.18 0.03 0.00 0.01 0.00 0.00 42.46 40.30 2fdr s ILE 105 CO 0.12 0.52 -0.14 0.00 0.00 0.00 0.00 174.94 175.43 2fdr s SER 107 N 1.39 0.83 0.41 0.00 0.15 -0.27 -4.21 113.70 111.99 2fdr s SER 107 Ca 0.02 -0.76 0.23 0.00 0.70 0.00 0.00 55.95 56.14 2fdr s SER 107 Cb -0.14 0.09 0.39 0.00 -1.71 0.00 0.00 66.02 64.65 2fdr s SER 107 CO -0.10 -0.36 1.62 0.78 1.20 0.00 0.00 173.24 176.38 2fdr h ASN 108 N 3.80 0.00 -4.08 5.45 4.21 -1.96 0.78 115.58 123.78 2fdr h ASN 108 Ca -0.35 -0.00 -0.54 0.00 1.21 0.00 0.00 56.30 56.62 2fdr h ASN 108 Cb 1.18 0.00 0.13 0.00 -1.12 0.00 0.00 38.32 38.51 2fdr h ASN 108 CO 0.52 0.00 0.54 -0.44 -1.29 0.00 0.00 177.43 176.76 2fdr s SER 109 N -5.98 5.11 0.86 5.81 0.01 -1.26 -4.48 113.70 113.77 2fdr s SER 109 Ca 0.07 2.60 -0.12 0.00 1.31 0.00 0.00 55.95 59.81 2fdr s SER 109 Cb 0.06 -2.62 0.11 0.00 0.21 0.00 0.00 66.02 63.78 2fdr s SER 109 CO 0.66 -1.66 1.18 -0.94 0.41 0.00 0.00 173.24 172.89 2fdr s SER 110 N -1.27 3.27 0.26 2.44 1.04 -1.26 -4.53 113.70 113.65 2fdr s SER 110 Ca 0.76 2.27 -0.05 0.00 0.48 0.00 0.00 55.95 59.42 2fdr s SER 110 Cb -0.36 -2.58 0.30 0.00 0.10 0.00 0.00 66.02 63.48 2fdr s SER 110 CO 0.41 -2.87 1.88 0.28 0.98 0.00 0.00 173.24 173.91 2fdr h SER 111 N -1.38 1.03 -0.07 7.02 0.02 -1.94 -1.73 113.55 116.50 2fdr h SER 111 Ca -0.45 -0.09 -0.00 0.00 -0.84 0.00 0.00 61.79 60.42 2fdr h SER 111 Cb 1.28 -0.26 -0.00 0.00 0.14 0.00 0.00 62.40 63.56 2fdr h SER 111 CO 0.44 0.83 0.04 -0.74 -1.14 0.00 0.00 176.83 176.26 2fdr h HIS 112 N 1.16 0.09 -0.56 3.45 -0.00 -1.99 -0.04 115.15 117.25 2fdr h HIS 112 Ca 0.29 0.00 -0.01 0.00 -0.00 0.00 0.00 60.37 60.65 2fdr h HIS 112 Cb 0.03 -0.03 -0.03 0.00 -0.00 0.00 0.00 27.41 27.38 2fdr h HIS 112 CO 0.01 0.09 0.31 -0.09 -0.00 0.00 0.00 177.93 178.25 2fdr h ARG 113 N 0.06 0.79 -0.39 5.26 2.43 -1.86 -2.74 114.38 117.94 2fdr h ARG 113 Ca 0.02 -0.09 0.04 0.00 -0.81 0.00 0.00 59.98 59.15 2fdr h ARG 113 Cb 0.02 -0.15 -0.04 0.00 -0.42 0.00 0.00 29.97 29.38 2fdr h ARG 113 CO -0.00 0.60 0.16 -0.07 -1.51 0.00 0.00 179.97 179.14 2fdr h LEU 114 N 0.76 0.19 -6.81 3.80 3.38 -1.17 -3.41 115.31 112.06 2fdr h LEU 114 Ca 0.20 0.03 -0.51 0.00 0.09 0.00 0.00 57.88 57.69 2fdr h LEU 114 Cb 0.04 0.01 0.12 0.00 0.09 0.00 0.00 40.66 40.92 2fdr h LEU 114 CO -0.03 0.15 1.39 -0.67 0.09 0.00 0.00 178.44 179.37 2fdr n ASP 115 N -4.98 1.00 0.00 -0.43 2.03 -0.04 -4.45 116.55 109.68 2fdr n ASP 115 Ca 0.02 -2.44 0.00 0.00 0.52 0.00 0.00 54.79 52.89 2fdr n ASP 115 Cb 0.12 -0.55 0.00 0.00 -0.72 0.00 0.00 41.12 39.98 2fdr n ASP 115 CO 0.00 0.00 0.00 0.18 -1.92 0.00 0.00 177.20 175.46 2fdr n LEU 118 N 8.30 0.00 0.04 -2.67 4.77 -1.26 -4.49 117.00 121.69 2fdr n LEU 118 Ca 0.41 0.00 -0.13 0.00 -0.03 0.00 0.00 56.01 56.26 2fdr n LEU 118 Cb 0.36 0.00 -0.08 0.00 -2.33 0.00 0.00 43.42 41.37 2fdr n LEU 118 CO 1.09 0.00 0.74 0.74 -1.33 0.00 0.00 177.39 178.63 2fdr h THR 119 N 0.00 1.11 -0.44 -5.08 2.02 -1.95 0.20 112.91 108.78 2fdr h THR 119 Ca 0.00 -0.51 0.08 0.00 0.77 0.00 0.00 66.41 66.75 2fdr h THR 119 Cb 0.00 1.46 -0.08 0.00 -1.74 0.00 0.00 68.15 67.79 2fdr h THR 119 CO 0.00 0.13 -0.04 0.50 0.37 0.00 0.00 175.52 176.48 2fdr h LYS 120 N -0.29 0.07 -0.05 6.66 3.64 -1.95 -0.33 116.57 124.32 2fdr h LYS 120 Ca -0.01 -0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.37 2fdr h LYS 120 Cb 0.26 -0.02 0.00 0.00 -0.41 0.00 0.00 32.23 32.06 2fdr h LYS 120 CO 0.01 0.04 0.00 1.33 -2.27 0.00 0.00 179.45 178.57 2fdr n VAL 121 N -5.25 0.06 -1.36 2.00 0.24 -1.23 -4.91 118.33 107.88 2fdr n VAL 121 Ca 0.04 -0.17 -0.08 0.00 -2.04 0.00 0.00 64.34 62.09 2fdr n VAL 121 Cb 0.24 0.07 -0.03 0.00 -1.47 0.00 0.00 33.84 32.65 2fdr n VAL 121 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 2fdr n GLY 122 N 1.04 0.83 0.06 7.63 0.00 -0.13 -4.90 105.19 109.72 2fdr n GLY 122 Ca 0.18 -0.69 0.11 0.00 0.00 0.00 0.00 46.02 45.63 2fdr n GLY 122 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 2fdr n LEU 123 N -0.89 0.60 -0.21 0.99 4.77 0.64 -4.56 117.00 118.34 2fdr n LEU 123 Ca -0.08 0.15 0.02 0.00 -0.03 0.00 0.00 56.01 56.07 2fdr n LEU 123 Cb 0.29 -0.07 0.13 0.00 -2.33 0.00 0.00 43.42 41.45 2fdr n LEU 123 CO 0.11 -0.07 0.92 0.50 -1.33 0.00 0.00 177.39 177.52 2fdr h LYS 124 N 0.00 0.25 0.00 3.23 3.64 -1.70 -0.49 116.57 121.50 2fdr h LYS 124 Ca 0.00 -0.01 0.00 0.00 -1.27 0.00 0.00 60.65 59.37 2fdr h LYS 124 Cb 0.89 -0.06 0.00 0.00 -0.41 0.00 0.00 32.23 32.66 2fdr h LYS 124 CO 0.00 0.16 0.00 -1.35 -2.27 0.00 0.00 179.45 175.99 2fdr h PRO 125 N 0.25 0.00 -0.01 1.90 0.11 -1.89 0.80 132.00 133.17 2fdr h PRO 125 Ca 0.35 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.46 2fdr h PRO 125 Cb 0.54 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.65 2fdr h PRO 125 CO -0.45 0.00 -0.14 0.66 -0.21 0.00 0.00 178.00 177.86 2fdr n TYR 126 N -2.91 0.00 0.00 0.65 4.02 -0.19 -4.40 117.16 114.33 2fdr n TYR 126 Ca -0.02 0.00 0.00 0.00 -0.01 0.00 0.00 57.90 57.87 2fdr n TYR 126 Cb 0.10 -0.15 0.00 0.00 -0.02 0.00 0.00 39.34 39.27 2fdr n TYR 126 CO 0.00 0.00 0.00 1.19 -1.01 0.00 0.00 176.86 177.04 2fdr n PHE 127 N -0.82 0.00 -1.67 -0.72 3.01 -0.48 -4.95 117.46 111.83 2fdr n PHE 127 Ca 0.14 0.00 -0.43 0.00 1.01 0.00 0.00 57.45 58.17 2fdr n PHE 127 Cb 0.30 0.00 -0.01 0.00 -0.01 0.00 0.00 39.48 39.76 2fdr n PHE 127 CO 0.00 0.00 0.00 0.00 1.01 0.00 0.00 176.76 177.77 2fdr n ALA 128 N -2.21 0.88 0.38 4.37 0.00 0.15 -0.43 120.51 123.66 2fdr n ALA 128 Ca 0.00 0.37 0.04 0.00 0.00 0.00 0.00 53.44 53.86 2fdr n ALA 128 Cb 0.35 -2.19 0.19 0.00 0.00 0.00 0.00 19.45 17.79 2fdr n ALA 128 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 177.50 177.15 2fdr n PRO 129 N 0.63 2.49 -2.16 0.00 -0.04 -1.26 -4.96 135.00 129.70 2fdr n PRO 129 Ca 0.06 -1.47 -0.40 0.00 -0.04 0.00 0.00 63.50 61.65 2fdr n PRO 129 Cb 0.35 -1.63 0.00 0.00 -0.04 0.00 0.00 33.50 32.18 2fdr n PRO 129 CO 0.00 0.00 0.00 0.72 -0.04 0.00 0.00 175.50 176.18 2fdr n HIS 130 N 0.42 2.63 -3.90 0.54 8.25 0.43 -4.81 115.22 118.79 2fdr n HIS 130 Ca 0.13 -2.73 -0.30 0.00 -0.26 0.00 0.00 57.72 54.56 2fdr n HIS 130 Cb 0.55 -1.64 -0.15 0.00 1.12 0.00 0.00 29.99 29.86 2fdr n HIS 130 CO 0.00 0.00 0.00 0.42 0.64 0.00 0.00 176.34 177.40 2fdr s ILE 131 N -2.10 1.46 -0.18 1.59 1.01 -1.26 -1.53 121.20 120.18 2fdr s ILE 131 Ca 0.50 -1.38 -0.01 0.00 0.00 0.00 0.00 60.65 59.76 2fdr s ILE 131 Cb 0.19 -1.85 -0.00 0.00 0.01 0.00 0.00 42.46 40.81 2fdr s ILE 131 CO -0.11 -0.29 -0.12 -0.31 0.00 0.00 0.00 174.94 174.11 2fdr s TYR 132 N 1.39 2.85 -0.20 3.97 1.51 0.33 -5.00 117.35 122.21 2fdr s TYR 132 Ca -0.00 -1.10 -0.08 0.00 -1.01 0.00 0.00 57.07 54.88 2fdr s TYR 132 Cb -0.18 -1.97 -0.04 0.00 -0.11 0.00 0.00 41.96 39.65 2fdr s TYR 132 CO -0.10 -0.55 0.07 0.45 -1.11 0.00 0.00 175.55 174.31 2fdr s SER 133 N 1.13 5.64 0.62 2.29 0.15 -1.26 -1.12 113.70 121.15 2fdr s SER 133 Ca 0.01 0.06 0.40 0.00 0.70 0.00 0.00 55.95 57.11 2fdr s SER 133 Cb -0.14 -1.98 2.06 0.00 -1.71 0.00 0.00 66.02 64.25 2fdr s SER 133 CO -0.04 0.14 2.25 0.00 1.20 0.00 0.00 173.24 176.79 2fdr h ALA 134 N 6.94 1.05 0.00 5.45 0.00 -1.07 -1.85 119.26 129.78 2fdr h ALA 134 Ca -0.37 -0.01 -0.06 0.00 0.00 0.00 0.00 54.91 54.47 2fdr h ALA 134 Cb 1.17 -0.00 -0.01 0.00 0.00 0.00 0.00 17.79 18.95 2fdr h ALA 134 CO 0.69 0.01 -0.29 0.87 0.00 0.00 0.00 179.25 180.53 2fdr h LYS 135 N 0.00 0.00 0.00 0.00 1.57 -1.80 -3.10 116.57 113.23 2fdr h LYS 135 Ca -0.00 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 2fdr h LYS 135 Cb 0.16 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.47 2fdr h LYS 135 CO 0.00 0.29 -0.20 -0.44 -0.57 0.00 0.00 179.45 178.53 2fdr h ASP 136 N 0.00 0.00 1.04 0.86 3.32 -1.71 -3.32 116.42 116.62 2fdr h ASP 136 Ca -0.00 -0.04 -0.12 0.00 0.02 0.00 0.00 57.03 56.88 2fdr h ASP 136 Cb 0.75 0.00 -0.02 0.00 0.22 0.00 0.00 39.33 40.28 2fdr h ASP 136 CO 0.04 0.02 -0.57 -0.07 -1.72 0.00 0.00 179.24 176.93 2fdr h LEU 137 N 0.00 0.00 0.00 1.55 3.38 -1.57 -3.49 115.31 115.17 2fdr h LEU 137 Ca 0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 2fdr h LEU 137 Cb 0.82 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.57 2fdr h LEU 137 CO 0.00 0.57 0.00 0.61 0.09 0.00 0.00 178.44 179.71 2fdr n GLY 138 N 0.76 3.00 3.76 0.83 0.00 -1.25 -5.02 105.19 107.27 2fdr n GLY 138 Ca 0.00 -1.31 -0.40 0.00 0.00 0.00 0.00 46.02 44.31 2fdr n GLY 138 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2fdr s ALA 139 N -2.00 3.43 -1.38 4.61 0.00 -1.26 -3.67 121.76 121.49 2fdr s ALA 139 Ca 0.00 0.99 -0.03 0.00 0.00 0.00 0.00 51.96 52.92 2fdr s ALA 139 Cb 0.00 -3.37 0.00 0.00 0.00 0.00 0.00 23.12 19.76 2fdr s ALA 139 CO 0.00 -0.29 0.40 -3.47 0.00 0.00 0.00 175.76 172.40 2fdr n ASP 140 N 1.11 -5.43 -0.83 0.00 4.64 -1.26 -4.87 116.55 109.91 2fdr n ASP 140 Ca -0.01 -0.19 0.07 0.00 -1.38 0.00 0.00 54.79 53.28 2fdr n ASP 140 Cb 0.44 -4.32 0.21 0.00 -1.04 0.00 0.00 41.12 36.41 2fdr n ASP 140 CO 0.00 0.00 0.00 0.54 -0.82 0.00 0.00 177.20 176.92 2fdr n ARG 141 N -3.37 2.98 -2.13 -0.67 1.74 -1.24 -5.03 116.66 108.94 2fdr n ARG 141 Ca -0.12 -2.38 -0.36 0.00 -0.77 0.00 0.00 57.85 54.22 2fdr n ARG 141 Cb 0.62 -1.50 0.02 0.00 -1.02 0.00 0.00 32.46 30.57 2fdr n ARG 141 CO 0.00 0.00 0.00 0.54 -1.52 0.00 0.00 177.63 176.65 2fdr s VAL 142 N -1.60 2.86 0.33 1.55 0.11 -1.26 -4.32 120.40 118.07 2fdr s VAL 142 Ca 0.32 0.56 -0.28 0.00 -2.93 0.00 0.00 61.98 59.65 2fdr s VAL 142 Cb 0.21 -3.24 -0.12 0.00 -1.53 0.00 0.00 36.38 31.69 2fdr s VAL 142 CO 0.15 -0.09 1.30 0.29 -3.33 0.00 0.00 175.10 173.42 2fdr n LYS 143 N -1.25 2.12 0.00 1.54 5.02 -1.26 -1.32 118.16 123.00 2fdr n LYS 143 Ca 0.12 0.74 0.09 0.00 -2.02 0.00 0.00 58.31 57.24 2fdr n LYS 143 Cb 0.49 -2.33 0.51 0.00 -0.02 0.00 0.00 35.03 33.69 2fdr n LYS 143 CO 0.00 0.00 0.00 -0.35 -0.52 0.00 0.00 177.40 176.53 2fdr n PRO 144 N 0.69 0.45 -1.77 1.97 -0.04 -1.25 -4.87 135.00 130.18 2fdr n PRO 144 Ca 0.05 0.05 -0.38 0.00 -0.04 0.00 0.00 63.50 63.18 2fdr n PRO 144 Cb 0.36 -1.50 0.05 0.00 -0.04 0.00 0.00 33.50 32.36 2fdr n PRO 144 CO 0.00 0.00 0.00 0.15 -0.04 0.00 0.00 175.50 175.61 2fdr s LYS 145 N -2.25 3.02 0.00 0.54 1.02 -0.44 -2.95 119.74 118.68 2fdr s LYS 145 Ca 0.23 2.21 0.24 0.00 0.02 0.00 0.00 55.97 58.67 2fdr s LYS 145 Cb 0.13 -2.17 1.14 0.00 -0.52 0.00 0.00 37.83 36.40 2fdr s LYS 145 CO 0.24 -1.28 1.77 -0.35 -0.92 0.00 0.00 175.35 174.82 2fdr n PRO 146 N -1.21 0.24 -0.09 -1.68 -0.04 -1.26 -4.54 135.00 126.42 2fdr n PRO 146 Ca 0.11 0.07 -0.10 0.00 -0.04 0.00 0.00 63.50 63.55 2fdr n PRO 146 Cb 0.46 -1.50 -0.04 0.00 -0.04 0.00 0.00 33.50 32.37 2fdr n PRO 146 CO 0.00 0.00 0.00 -0.44 -0.04 0.00 0.00 175.50 175.02 2fdr h ASP 147 N 0.00 -1.33 -0.71 3.54 5.19 -1.89 -1.59 116.42 119.63 2fdr h ASP 147 Ca 0.00 0.20 0.03 0.00 -0.62 0.00 0.00 57.03 56.64 2fdr h ASP 147 Cb 0.27 0.58 -0.04 0.00 0.18 0.00 0.00 39.33 40.32 2fdr h ASP 147 CO 0.00 -0.37 0.47 -0.29 -3.12 0.00 0.00 179.24 175.93 2fdr h ILE 148 N -0.35 1.12 -0.16 0.35 6.09 -1.80 -0.69 117.51 122.07 2fdr h ILE 148 Ca 0.13 -0.30 -0.04 0.00 -1.37 0.00 0.00 64.86 63.27 2fdr h ILE 148 Cb 0.58 0.16 -0.00 0.00 0.47 0.00 0.00 36.82 38.03 2fdr h ILE 148 CO -0.52 0.16 -0.07 -0.26 -3.07 0.00 0.00 178.15 174.39 2fdr h PHE 149 N 0.89 0.38 -0.70 2.19 0.04 -1.64 -1.62 116.94 116.48 2fdr h PHE 149 Ca 0.28 -0.09 -0.01 0.00 2.80 0.00 0.00 57.97 60.94 2fdr h PHE 149 Cb 0.02 -0.09 -0.03 0.00 2.20 0.00 0.00 35.95 38.05 2fdr h PHE 149 CO -0.00 0.64 0.38 -0.07 -0.60 0.00 0.00 178.31 178.66 2fdr h LEU 150 N 0.01 0.86 -0.03 1.54 3.38 -1.09 -0.62 115.31 119.37 2fdr h LEU 150 Ca 0.04 -0.07 -0.00 0.00 0.09 0.00 0.00 57.88 57.94 2fdr h LEU 150 Cb 0.54 -0.22 -0.00 0.00 0.09 0.00 0.00 40.66 41.07 2fdr h LEU 150 CO 0.02 0.70 0.01 -0.74 0.09 0.00 0.00 178.44 178.52 2fdr h HIS 151 N 0.97 0.05 -0.48 1.13 2.76 -1.03 -1.82 115.15 116.73 2fdr h HIS 151 Ca 0.25 -0.00 0.01 0.00 -2.20 0.00 0.00 60.37 58.42 2fdr h HIS 151 Cb 0.03 -0.01 -0.03 0.00 1.55 0.00 0.00 27.41 28.95 2fdr h HIS 151 CO 0.01 0.18 0.31 0.78 -1.30 0.00 0.00 177.93 177.91 2fdr h GLY 152 N -0.10 0.68 0.97 5.26 0.00 -0.96 -2.04 103.07 106.87 2fdr h GLY 152 Ca 0.01 -0.24 -0.01 0.00 0.00 0.00 0.00 47.33 47.09 2fdr h GLY 152 CO -0.00 0.23 0.22 0.00 0.00 0.00 0.00 176.54 176.99 2fdr h ALA 153 N 1.19 0.54 -0.61 3.60 0.00 -1.08 -2.85 119.26 120.04 2fdr h ALA 153 Ca 0.18 -0.09 0.01 0.00 0.00 0.00 0.00 54.91 55.01 2fdr h ALA 153 Cb -0.04 -0.17 -0.03 0.00 0.00 0.00 0.00 17.79 17.55 2fdr h ALA 153 CO -0.05 0.07 0.41 0.00 0.00 0.00 0.00 179.25 179.68 2fdr h ALA 154 N 1.07 1.58 0.00 0.00 0.00 -1.21 -1.30 119.26 119.40 2fdr h ALA 154 Ca 0.15 -0.04 -0.00 0.00 0.00 0.00 0.00 54.91 55.02 2fdr h ALA 154 Cb 0.07 -0.24 -0.00 0.00 0.00 0.00 0.00 17.79 17.62 2fdr h ALA 154 CO -0.02 0.39 -0.00 1.96 0.00 0.00 0.00 179.25 181.57 2fdr h GLN 155 N 0.82 0.00 -0.02 0.00 1.08 -1.12 -1.48 115.11 114.38 2fdr h GLN 155 Ca 0.23 0.00 0.00 0.00 -1.45 0.00 0.00 58.65 57.43 2fdr h GLN 155 Cb -0.07 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 27.36 2fdr h GLN 155 CO -0.05 0.00 -0.38 1.19 -0.95 0.00 0.00 178.83 178.64 2fdr n PHE 156 N -4.04 0.00 -2.30 2.96 3.72 -0.58 -4.97 117.46 112.25 2fdr n PHE 156 Ca -0.03 0.00 -0.15 0.00 -0.05 0.00 0.00 57.45 57.22 2fdr n PHE 156 Cb 0.08 -0.02 -0.01 0.00 -0.94 0.00 0.00 39.48 38.59 2fdr n PHE 156 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 2fdr n GLY 157 N 1.39 -0.23 3.71 1.37 0.00 -0.56 -5.00 105.19 105.86 2fdr n GLY 157 Ca 0.11 -0.26 -0.35 0.00 0.00 0.00 0.00 46.02 45.51 2fdr n GLY 157 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2fdr s VAL 158 N -2.74 5.02 0.40 1.61 1.01 -0.75 -5.01 120.40 119.94 2fdr s VAL 158 Ca 0.01 0.04 -0.26 0.00 0.00 0.00 0.00 61.98 61.78 2fdr s VAL 158 Cb -0.00 -3.24 -0.09 0.00 0.00 0.00 0.00 36.38 33.05 2fdr s VAL 158 CO 0.01 0.50 1.22 -0.94 0.00 0.00 0.00 175.10 175.89 2fdr s SER 159 N -0.04 6.47 0.43 3.32 1.04 -1.26 -4.43 113.70 119.23 2fdr s SER 159 Ca 0.08 2.46 0.14 0.00 0.48 0.00 0.00 55.95 59.11 2fdr s SER 159 Cb -0.12 -2.62 1.02 0.00 0.10 0.00 0.00 66.02 64.39 2fdr s SER 159 CO 0.01 -0.72 1.97 -0.65 0.98 0.00 0.00 173.24 174.82 2fdr h PRO 160 N 2.70 0.42 0.00 4.02 0.11 -1.86 0.74 132.00 138.13 2fdr h PRO 160 Ca -0.49 -0.03 0.00 0.00 0.11 0.00 0.00 66.00 65.60 2fdr h PRO 160 Cb 1.24 -0.09 0.00 0.00 0.11 0.00 0.00 31.00 32.25 2fdr h PRO 160 CO 0.63 0.28 0.00 -0.40 -0.21 0.00 0.00 178.00 178.29 2fdr n ASP 161 N -4.47 0.36 -1.28 -2.05 5.75 -1.23 -1.76 116.55 111.86 2fdr n ASP 161 Ca 0.11 0.63 0.08 0.00 -0.01 0.00 0.00 54.79 55.60 2fdr n ASP 161 Cb 0.39 -0.69 0.30 0.00 -1.03 0.00 0.00 41.12 40.09 2fdr n ASP 161 CO 0.00 0.00 0.00 0.54 -0.11 0.00 0.00 177.20 177.63 2fdr n ARG 162 N -1.94 3.54 -4.76 0.11 1.74 0.25 -4.88 116.66 110.71 2fdr n ARG 162 Ca 0.00 -2.78 -0.33 0.00 -0.77 0.00 0.00 57.85 53.97 2fdr n ARG 162 Cb 0.09 -1.83 -0.13 0.00 -1.02 0.00 0.00 32.46 29.57 2fdr n ARG 162 CO 0.00 0.00 0.00 0.08 -1.52 0.00 0.00 177.63 176.19 2fdr s VAL 163 N -2.12 3.27 -0.07 1.55 1.01 -0.72 -0.17 120.40 123.14 2fdr s VAL 163 Ca 0.44 -0.62 0.02 0.00 0.00 0.00 0.00 61.98 61.82 2fdr s VAL 163 Cb 0.31 -2.33 -0.03 0.00 0.00 0.00 0.00 36.38 34.34 2fdr s VAL 163 CO 0.17 0.57 -0.12 0.54 0.00 0.00 0.00 175.10 176.26 2fdr s VAL 164 N -0.36 3.27 -0.05 2.92 0.11 -0.58 -2.69 120.40 123.03 2fdr s VAL 164 Ca 0.04 -0.63 0.03 0.00 -2.93 0.00 0.00 61.98 58.49 2fdr s VAL 164 Cb -0.12 -2.32 -0.03 0.00 -1.53 0.00 0.00 36.38 32.38 2fdr s VAL 164 CO 0.02 0.58 -0.12 -0.69 -3.33 0.00 0.00 175.10 171.56 2fdr s VAL 165 N -0.54 3.26 -0.27 2.04 1.01 0.24 -0.92 120.40 125.23 2fdr s VAL 165 Ca 0.08 -0.67 -0.06 0.00 0.00 0.00 0.00 61.98 61.32 2fdr s VAL 165 Cb -0.12 -2.30 -0.00 0.00 0.00 0.00 0.00 36.38 33.96 2fdr s VAL 165 CO 0.02 0.58 0.06 -0.69 0.00 0.00 0.00 175.10 175.06 2fdr s VAL 166 N -0.77 3.93 0.01 2.92 1.01 0.38 -0.29 120.40 127.59 2fdr s VAL 166 Ca 0.12 -0.56 0.01 0.00 0.00 0.00 0.00 61.98 61.56 2fdr s VAL 166 Cb -0.11 -2.95 -0.01 0.00 0.00 0.00 0.00 36.38 33.31 2fdr s VAL 166 CO 0.01 0.19 -0.04 -1.61 0.00 0.00 0.00 175.10 173.65 2fdr s GLU 167 N 1.52 0.32 0.00 2.72 0.41 -0.77 -2.08 118.70 120.82 2fdr s GLU 167 Ca 0.04 -0.36 0.13 0.00 -0.41 0.00 0.00 54.97 54.37 2fdr s GLU 167 Cb -0.16 -0.18 0.04 0.00 -1.78 0.00 0.00 34.13 32.05 2fdr s GLU 167 CO 0.02 0.04 0.81 -0.40 -0.49 0.00 0.00 175.26 175.24 2fdr n ASP 168 N 2.36 1.69 -4.29 -0.19 5.75 -1.26 -0.45 116.55 120.15 2fdr n ASP 168 Ca -0.17 -1.34 -0.28 0.00 -0.01 0.00 0.00 54.79 52.98 2fdr n ASP 168 Cb 0.57 0.28 -0.15 0.00 -1.03 0.00 0.00 41.12 40.80 2fdr n ASP 168 CO 0.00 0.00 0.00 -0.94 -0.11 0.00 0.00 177.20 176.15 2fdr s SER 169 N -1.42 2.81 0.22 -1.12 1.04 -1.26 -4.89 113.70 109.08 2fdr s SER 169 Ca 0.13 -0.53 -0.08 0.00 0.48 0.00 0.00 55.95 55.94 2fdr s SER 169 Cb 0.11 -0.26 0.28 0.00 0.10 0.00 0.00 66.02 66.25 2fdr s SER 169 CO 0.26 0.22 1.81 0.58 0.98 0.00 0.00 173.24 177.10 2fdr h VAL 170 N 4.34 0.95 -0.72 5.02 2.07 -1.95 -1.41 116.25 124.55 2fdr h VAL 170 Ca -0.44 -0.25 -0.02 0.00 0.82 0.00 0.00 66.70 66.81 2fdr h VAL 170 Cb 1.15 0.17 -0.03 0.00 -1.52 0.00 0.00 31.29 31.05 2fdr h VAL 170 CO 0.44 0.13 0.38 0.45 0.02 0.00 0.00 177.57 178.99 2fdr h HIS 171 N 0.72 1.01 -0.39 1.57 3.86 -1.96 -0.96 115.15 119.01 2fdr h HIS 171 Ca 0.33 -0.03 -0.05 0.00 -1.16 0.00 0.00 60.37 59.45 2fdr h HIS 171 Cb 0.23 -0.32 -0.02 0.00 1.06 0.00 0.00 27.41 28.36 2fdr h HIS 171 CO -0.07 0.73 0.02 0.78 0.86 0.00 0.00 177.93 180.25 2fdr h GLY 172 N 1.00 0.66 0.92 2.45 0.00 -1.81 -1.17 103.07 105.11 2fdr h GLY 172 Ca 0.25 -0.39 -0.11 0.00 0.00 0.00 0.00 47.33 47.08 2fdr h GLY 172 CO -0.04 0.37 -0.26 -2.22 0.00 0.00 0.00 176.54 174.40 2fdr h ILE 173 N 0.59 1.31 -0.43 2.60 2.04 -0.69 -1.05 117.51 121.88 2fdr h ILE 173 Ca 0.13 -1.42 -0.05 0.00 1.00 0.00 0.00 64.86 64.51 2fdr h ILE 173 Cb 0.34 1.66 -0.02 0.00 -0.74 0.00 0.00 36.82 38.06 2fdr h ILE 173 CO 0.01 0.45 0.06 0.45 0.00 0.00 0.00 178.15 179.12 2fdr h HIS 174 N 0.33 0.77 -0.45 1.37 3.86 -1.12 -0.45 115.15 119.46 2fdr h HIS 174 Ca 0.04 -0.11 0.09 0.00 -1.16 0.00 0.00 60.37 59.23 2fdr h HIS 174 Cb 0.82 -0.21 -0.09 0.00 1.06 0.00 0.00 27.41 28.99 2fdr h HIS 174 CO 0.08 0.74 -0.11 0.78 0.86 0.00 0.00 177.93 180.28 2fdr h GLY 175 N 0.58 0.33 1.14 2.45 0.00 -1.10 0.18 103.07 106.65 2fdr h GLY 175 Ca 0.13 0.15 -0.12 0.00 0.00 0.00 0.00 47.33 47.48 2fdr h GLY 175 CO 0.01 -0.17 -0.17 0.00 0.00 0.00 0.00 176.54 176.21 2fdr h ALA 176 N 1.45 0.75 -0.35 3.60 0.00 -0.83 -1.92 119.26 121.95 2fdr h ALA 176 Ca 0.22 -0.37 -0.10 0.00 0.00 0.00 0.00 54.91 54.66 2fdr h ALA 176 Cb 0.33 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 17.93 2fdr h ALA 176 CO -0.46 0.67 -0.15 0.00 0.00 0.00 0.00 179.25 179.31 2fdr h ARG 177 N 0.86 0.73 -0.12 0.00 2.47 -0.74 -2.45 114.38 115.13 2fdr h ARG 177 Ca 0.12 -0.31 0.04 0.00 -1.26 0.00 0.00 59.98 58.57 2fdr h ARG 177 Cb 0.74 -0.02 -0.00 0.00 -1.65 0.00 0.00 29.97 29.03 2fdr h ARG 177 CO 0.06 0.91 0.12 0.00 0.56 0.00 0.00 179.97 181.62 2fdr h ALA 178 N 0.79 1.81 -0.00 0.04 0.00 -0.45 -0.35 119.26 121.10 2fdr h ALA 178 Ca 0.08 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.99 2fdr h ALA 178 Cb 0.69 0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.49 2fdr h ALA 178 CO 0.05 -0.18 -0.13 0.00 0.00 0.00 0.00 179.25 178.98 2fdr n ALA 179 N -2.39 2.80 -1.32 0.00 0.00 -0.74 -4.89 120.51 113.97 2fdr n ALA 179 Ca -0.00 -0.28 0.00 0.00 0.00 0.00 0.00 53.44 53.16 2fdr n ALA 179 Cb 0.23 -1.31 0.00 0.00 0.00 0.00 0.00 19.45 18.37 2fdr n ALA 179 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2fdr n GLY 180 N 1.30 0.27 3.18 0.00 0.00 -0.14 -4.76 105.19 105.04 2fdr n GLY 180 Ca 0.14 -0.30 -0.21 0.00 0.00 0.00 0.00 46.02 45.65 2fdr n GLY 180 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2fdr s ARG 182 N -2.88 0.99 -0.05 1.61 0.52 -1.09 -3.57 118.95 114.48 2fdr s ARG 182 Ca 0.00 -0.86 0.04 0.00 -0.52 0.00 0.00 55.73 54.39 2fdr s ARG 182 Cb 0.00 -1.04 0.00 0.00 0.52 0.00 0.00 34.95 34.43 2fdr s ARG 182 CO 0.00 0.25 -0.15 0.08 0.02 0.00 0.00 175.30 175.50 2fdr s VAL 183 N -0.96 1.32 -0.23 3.52 1.01 -1.26 -0.59 120.40 123.21 2fdr s VAL 183 Ca 0.02 -0.64 -0.06 0.00 0.00 0.00 0.00 61.98 61.30 2fdr s VAL 183 Cb -0.09 -1.14 -0.02 0.00 0.00 0.00 0.00 36.38 35.13 2fdr s VAL 183 CO 0.02 0.39 0.03 -0.63 0.00 0.00 0.00 175.10 174.90 2fdr s ILE 184 N 0.16 4.00 0.23 2.22 1.01 0.60 -0.56 121.20 128.85 2fdr s ILE 184 Ca -0.06 -0.28 -0.24 0.00 0.00 0.00 0.00 60.65 60.07 2fdr s ILE 184 Cb -0.12 -2.85 -0.09 0.00 0.01 0.00 0.00 42.46 39.42 2fdr s ILE 184 CO 0.02 0.38 0.82 -0.83 0.00 0.00 0.00 174.94 175.33 2fdr s GLY 185 N 1.45 2.83 -0.15 6.18 0.00 0.68 -1.85 107.32 116.46 2fdr s GLY 185 Ca 0.05 0.37 0.00 0.00 0.00 0.00 0.00 44.72 45.15 2fdr s GLY 185 CO 0.01 0.82 -0.14 -0.12 0.00 0.00 0.00 173.10 173.67 2fdr s PHE 186 N -1.37 2.22 -0.25 1.90 5.36 0.40 -0.75 117.98 125.49 2fdr s PHE 186 Ca 0.42 -1.26 0.11 0.00 -0.96 0.00 0.00 56.93 55.23 2fdr s PHE 186 Cb -0.21 -1.62 0.46 0.00 -0.34 0.00 0.00 43.02 41.31 2fdr s PHE 186 CO 0.25 -0.68 1.19 0.25 -1.46 0.00 0.00 175.22 174.76 2fdr n THR 187 N 4.76 2.16 1.01 0.12 -2.24 0.03 -4.29 114.28 115.82 2fdr n THR 187 Ca -0.17 -3.66 0.10 0.00 -2.27 0.00 0.00 64.05 58.06 2fdr n THR 187 Cb 0.50 -0.50 -0.06 0.00 -2.10 0.00 0.00 70.33 68.17 2fdr n THR 187 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2fdr n GLY 188 N -0.73 -0.66 3.78 3.38 0.00 -1.25 -4.74 105.19 104.96 2fdr n GLY 188 Ca 0.31 -0.60 -0.30 0.00 0.00 0.00 0.00 46.02 45.43 2fdr n GLY 188 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2fdr s ALA 189 N -2.82 2.07 -0.44 4.61 0.00 -1.26 -4.92 121.76 119.00 2fdr s ALA 189 Ca 0.12 -0.09 0.26 0.00 0.00 0.00 0.00 51.96 52.24 2fdr s ALA 189 Cb 0.17 -3.15 0.99 0.00 0.00 0.00 0.00 23.12 21.12 2fdr s ALA 189 CO 0.76 -1.88 1.76 0.77 0.00 0.00 0.00 175.76 177.17 2fdr h SER 190 N -1.20 0.00 -0.08 0.00 0.02 -1.93 -2.79 113.55 107.57 2fdr h SER 190 Ca -0.47 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.48 2fdr h SER 190 Cb 1.26 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.80 2fdr h SER 190 CO 0.57 0.00 0.00 0.00 -1.14 0.00 0.00 176.83 176.26 2fdr n HIS 191 N -2.40 0.10 -0.60 3.45 1.44 -1.26 -4.92 115.22 111.02 2fdr n HIS 191 Ca 0.03 -0.05 -0.30 0.00 -2.01 0.00 0.00 57.72 55.39 2fdr n HIS 191 Cb 0.29 0.00 0.21 0.00 0.12 0.00 0.00 29.99 30.61 2fdr n HIS 191 CO 0.00 0.00 0.00 -0.08 -2.81 0.00 0.00 176.34 173.45 2fdr s THR 192 N -1.90 2.02 0.16 0.61 -1.32 -1.06 -4.76 115.64 109.40 2fdr s THR 192 Ca 0.35 0.01 -0.16 0.00 -1.21 0.00 0.00 61.69 60.67 2fdr s THR 192 Cb 0.18 -2.02 0.03 0.00 -1.51 0.00 0.00 72.50 69.18 2fdr s THR 192 CO 0.29 -0.01 0.45 -0.72 -2.21 0.00 0.00 174.62 172.41 2fdr s TYR 193 N -2.54 -0.12 0.29 9.09 -0.85 -1.26 -4.96 117.35 116.99 2fdr s TYR 193 Ca 0.68 -0.21 0.01 0.00 -0.52 0.00 0.00 57.07 57.03 2fdr s TYR 193 Cb -0.24 0.29 0.56 0.00 0.38 0.00 0.00 41.96 42.95 2fdr s TYR 193 CO 0.61 -0.80 1.84 -1.35 -1.52 0.00 0.00 175.55 174.34 2fdr h PRO 194 N 2.30 0.97 -0.04 -3.49 0.11 -1.96 -1.84 132.00 128.05 2fdr h PRO 194 Ca -0.32 -0.06 0.00 0.00 0.11 0.00 0.00 66.00 65.74 2fdr h PRO 194 Cb 1.26 -0.22 0.00 0.00 0.11 0.00 0.00 31.00 32.15 2fdr h PRO 194 CO 0.43 0.64 0.00 -1.13 -0.21 0.00 0.00 178.00 177.73 2fdr n SER 195 N -4.60 0.91 0.18 -2.05 3.41 -1.26 -4.47 113.62 105.73 2fdr n SER 195 Ca 0.18 -1.39 -0.14 0.00 -0.26 0.00 0.00 58.87 57.26 2fdr n SER 195 Cb 0.34 -0.02 -0.07 0.00 -0.26 0.00 0.00 64.21 64.20 2fdr n SER 195 CO 0.00 0.00 0.00 -0.74 -0.16 0.00 0.00 175.04 174.14 2fdr h HIS 196 N 1.34 -0.42 -0.60 7.33 6.17 -1.73 -1.03 115.15 126.21 2fdr h HIS 196 Ca 0.00 -0.01 -0.02 0.00 0.71 0.00 0.00 60.37 61.06 2fdr h HIS 196 Cb 0.29 0.15 -0.03 0.00 2.52 0.00 0.00 27.41 30.34 2fdr h HIS 196 CO 0.02 -0.25 0.30 0.00 0.71 0.00 0.00 177.93 178.71 2fdr h ALA 197 N 0.31 0.77 -0.67 5.26 0.00 -1.79 -1.62 119.26 121.51 2fdr h ALA 197 Ca -0.03 -0.12 -0.00 0.00 0.00 0.00 0.00 54.91 54.76 2fdr h ALA 197 Cb 0.34 -0.24 -0.03 0.00 0.00 0.00 0.00 17.79 17.86 2fdr h ALA 197 CO 0.03 0.32 0.42 -0.44 0.00 0.00 0.00 179.25 179.58 2fdr h ASP 198 N 0.82 0.80 -0.54 0.00 3.32 -1.82 -0.67 116.42 118.33 2fdr h ASP 198 Ca 0.21 -0.05 0.03 0.00 0.02 0.00 0.00 57.03 57.24 2fdr h ASP 198 Cb 0.09 -0.20 -0.04 0.00 0.22 0.00 0.00 39.33 39.40 2fdr h ASP 198 CO -0.03 0.61 0.32 0.03 -1.72 0.00 0.00 179.24 178.45 2fdr h ARG 199 N 0.92 0.61 -0.49 3.56 3.08 -0.75 0.92 114.38 122.23 2fdr h ARG 199 Ca 0.24 -0.04 -0.02 0.00 0.07 0.00 0.00 59.98 60.23 2fdr h ARG 199 Cb -0.05 -0.14 -0.02 0.00 0.08 0.00 0.00 29.97 29.84 2fdr h ARG 199 CO -0.05 0.40 0.21 -0.07 -1.07 0.00 0.00 179.97 179.39 2fdr h LEU 200 N 0.63 0.66 -0.27 3.04 3.38 -1.09 -1.82 115.31 119.84 2fdr h LEU 200 Ca 0.22 -0.15 0.02 0.00 0.09 0.00 0.00 57.88 58.06 2fdr h LEU 200 Cb 0.05 -0.17 -0.03 0.00 0.09 0.00 0.00 40.66 40.61 2fdr h LEU 200 CO -0.11 0.63 0.11 0.74 0.09 0.00 0.00 178.44 179.90 2fdr h THR 201 N 0.64 0.96 -0.07 0.22 2.02 -0.79 -0.69 112.91 115.20 2fdr h THR 201 Ca 0.16 -0.08 -0.02 0.00 0.77 0.00 0.00 66.41 67.24 2fdr h THR 201 Cb 0.17 0.70 -0.01 0.00 -1.74 0.00 0.00 68.15 67.27 2fdr h THR 201 CO -0.02 0.04 -0.04 0.44 0.37 0.00 0.00 175.52 176.32 2fdr h ASP 202 N 0.24 0.08 1.62 4.18 3.32 -0.63 -1.72 116.42 123.52 2fdr h ASP 202 Ca 0.11 -0.01 0.00 0.00 0.02 0.00 0.00 57.03 57.16 2fdr h ASP 202 Cb 0.06 -0.02 0.00 0.00 0.22 0.00 0.00 39.33 39.59 2fdr h ASP 202 CO -0.10 0.14 0.00 0.00 -1.72 0.00 0.00 179.24 177.56 2fdr h ALA 203 N 1.87 1.00 0.00 3.45 0.00 -0.98 -3.46 119.26 121.13 2fdr h ALA 203 Ca 0.02 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.93 2fdr h ALA 203 Cb 0.13 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.92 2fdr h ALA 203 CO 0.01 0.00 0.00 0.41 0.00 0.00 0.00 179.25 179.67 2fdr n GLY 204 N 0.97 1.13 3.70 0.00 0.00 -0.65 -4.25 105.19 106.09 2fdr n GLY 204 Ca 0.04 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.64 2fdr n GLY 204 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2fdr s ALA 205 N -1.49 3.81 0.22 4.61 0.00 -0.29 -4.63 121.76 123.98 2fdr s ALA 205 Ca 0.00 1.45 -0.01 0.00 0.00 0.00 0.00 51.96 53.40 2fdr s ALA 205 Cb 0.00 -3.72 0.21 0.00 0.00 0.00 0.00 23.12 19.61 2fdr s ALA 205 CO 0.00 -1.07 1.57 1.49 0.00 0.00 0.00 175.76 177.75 2fdr h GLU 206 N 7.84 0.49 -3.53 0.00 4.81 -1.17 -3.41 114.58 119.61 2fdr h GLU 206 Ca -0.44 -0.28 -0.06 0.00 -0.13 0.00 0.00 59.36 58.45 2fdr h GLU 206 Cb 1.21 0.02 -0.12 0.00 0.63 0.00 0.00 28.75 30.49 2fdr h GLU 206 CO 0.94 0.86 -0.13 -0.08 -0.73 0.00 0.00 179.01 179.88 2fdr s THR 207 N -4.10 0.06 -0.05 0.32 -1.32 -1.23 -5.06 115.64 104.26 2fdr s THR 207 Ca -0.07 -0.90 0.05 0.00 -1.21 0.00 0.00 61.69 59.56 2fdr s THR 207 Cb 0.12 -1.48 -0.01 0.00 -1.51 0.00 0.00 72.50 69.62 2fdr s THR 207 CO 0.82 -0.28 -0.21 -0.69 -2.21 0.00 0.00 174.62 172.05 2fdr s VAL 208 N -3.87 1.73 0.18 5.08 1.01 -1.26 -0.23 120.40 123.04 2fdr s VAL 208 Ca 0.09 -0.88 0.10 0.00 0.00 0.00 0.00 61.98 61.29 2fdr s VAL 208 Cb 0.02 -1.48 -0.04 0.00 0.00 0.00 0.00 36.38 34.87 2fdr s VAL 208 CO -0.06 0.49 -0.21 0.27 0.00 0.00 0.00 175.10 175.59 2fdr s ILE 209 N 0.00 2.10 -0.07 2.22 -4.36 0.07 -4.95 121.20 116.22 2fdr s ILE 209 Ca -0.05 -1.99 0.02 0.00 -0.26 0.00 0.00 60.65 58.36 2fdr s ILE 209 Cb -0.13 -2.00 -0.02 0.00 1.25 0.00 0.00 42.46 41.56 2fdr s ILE 209 CO 0.03 -0.22 0.07 -1.20 0.24 0.00 0.00 174.94 173.85 2fdr n SER 210 N 0.24 0.30 -1.13 4.36 7.64 -1.26 -0.79 113.62 122.97 2fdr n SER 210 Ca -0.12 -0.51 0.00 0.00 1.01 0.00 0.00 58.87 59.24 2fdr n SER 210 Cb 0.57 1.00 0.00 0.00 -1.01 0.00 0.00 64.21 64.77 2fdr n SER 210 CO 0.00 0.00 0.00 0.54 -3.01 0.00 0.00 175.04 172.57 2fdr n ARG 211 N -1.06 2.47 0.00 1.43 1.74 -1.26 -3.95 116.66 116.03 2fdr n ARG 211 Ca 0.00 0.00 0.00 0.00 -0.77 0.00 0.00 57.85 57.08 2fdr n ARG 211 Cb 0.03 0.00 0.00 0.00 -1.02 0.00 0.00 32.46 31.47 2fdr n ARG 211 CO 0.00 0.00 0.00 1.04 -1.52 0.00 0.00 177.63 177.15 2fdr n GLN 213 N -0.23 0.00 0.06 5.56 3.00 -1.26 -4.06 117.38 120.46 2fdr n GLN 213 Ca 0.00 0.00 0.12 0.00 -0.01 0.00 0.00 57.00 57.11 2fdr n GLN 213 Cb 0.00 -0.15 0.28 0.00 0.00 0.00 0.00 30.24 30.37 2fdr n GLN 213 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.06 176.81 2fdr n ASP 214 N 0.00 0.65 -0.17 1.08 8.00 -1.26 -4.37 116.55 120.49 2fdr n ASP 214 Ca 0.00 0.23 -0.04 0.00 0.71 0.00 0.00 54.79 55.69 2fdr n ASP 214 Cb 0.00 -0.13 0.03 0.00 -0.02 0.00 0.00 41.12 41.00 2fdr n ASP 214 CO 0.00 0.00 0.00 -0.07 -0.39 0.00 0.00 177.20 176.74 2fdr h LEU 215 N 0.00 -0.72 -0.71 0.64 3.38 -1.98 -0.12 115.31 115.81 2fdr h LEU 215 Ca 0.00 0.18 0.08 0.00 0.09 0.00 0.00 57.88 58.23 2fdr h LEU 215 Cb 0.70 0.41 -0.06 0.00 0.09 0.00 0.00 40.66 41.79 2fdr h LEU 215 CO 0.00 -0.23 0.38 -0.65 0.09 0.00 0.00 178.44 178.03 2fdr h PRO 216 N -0.08 0.65 -0.37 1.13 0.11 -1.90 -0.40 132.00 131.14 2fdr h PRO 216 Ca 0.24 -0.04 -0.06 0.00 0.11 0.00 0.00 66.00 66.25 2fdr h PRO 216 Cb 0.46 -0.15 -0.01 0.00 0.11 0.00 0.00 31.00 31.41 2fdr h PRO 216 CO -0.58 0.43 -0.01 0.00 -0.21 0.00 0.00 178.00 177.63 2fdr h ALA 217 N 1.40 0.50 -0.51 -0.75 0.00 -1.66 -2.10 119.26 116.13 2fdr h ALA 217 Ca 0.34 -0.26 -0.10 0.00 0.00 0.00 0.00 54.91 54.88 2fdr h ALA 217 Cb 0.29 -0.13 -0.02 0.00 0.00 0.00 0.00 17.79 17.93 2fdr h ALA 217 CO -0.23 0.28 -0.10 0.28 0.00 0.00 0.00 179.25 179.48 2fdr h VAL 218 N 0.47 1.26 -0.18 0.00 2.07 -0.78 -1.54 116.25 117.55 2fdr h VAL 218 Ca 0.10 -1.22 -0.03 0.00 0.82 0.00 0.00 66.70 66.37 2fdr h VAL 218 Cb 0.49 0.98 -0.01 0.00 -1.52 0.00 0.00 31.29 31.23 2fdr h VAL 218 CO 0.02 0.43 -0.02 0.40 0.02 0.00 0.00 177.57 178.42 2fdr h ILE 219 N 0.84 1.27 -0.59 4.57 2.04 -1.03 -3.01 117.51 121.61 2fdr h ILE 219 Ca 0.14 -0.92 0.07 0.00 1.00 0.00 0.00 64.86 65.15 2fdr h ILE 219 Cb 0.63 1.51 -0.06 0.00 -0.74 0.00 0.00 36.82 38.16 2fdr h ILE 219 CO 0.04 0.28 0.26 0.00 0.00 0.00 0.00 178.15 178.73 2fdr h ALA 220 N 0.76 0.76 0.00 1.87 0.00 -1.30 -1.42 119.26 119.93 2fdr h ALA 220 Ca 0.05 0.06 0.00 0.00 0.00 0.00 0.00 54.91 55.02 2fdr h ALA 220 Cb 0.42 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.21 2fdr h ALA 220 CO 0.01 -0.13 0.00 0.00 0.00 0.00 0.00 179.25 179.13 2fdr n ALA 221 N -2.41 1.73 0.00 0.00 0.00 -0.59 -2.76 120.51 116.48 2fdr n ALA 221 Ca 0.07 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.51 2fdr n ALA 221 Cb 0.22 -1.00 0.00 0.00 0.00 0.00 0.00 19.45 18.67 2fdr n ALA 221 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2fdr n ALA 223 N 0.79 0.00 -0.84 0.00 0.00 -0.53 -5.10 120.51 114.82 2fdr n ALA 223 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.44 2fdr n ALA 223 Cb 0.13 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.58 2fdr n ALA 223 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.50 177.89