#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1nni s LEU 4 N 0.00 -0.29 -0.07 1.20 2.96 -0.53 0.82 118.68 122.77 1nni s LEU 4 Ca 0.00 0.45 0.03 0.00 -0.22 0.00 0.00 54.13 54.39 1nni s LEU 4 Cb 0.00 1.63 0.00 0.00 0.50 0.00 0.00 46.19 48.32 1nni s LEU 4 CO 0.00 -0.18 -0.17 -0.69 -1.32 0.00 0.00 176.35 173.99 1nni s VAL 5 N -0.47 1.45 -0.24 1.68 1.01 -0.92 -0.95 120.40 121.96 1nni s VAL 5 Ca 0.03 -0.68 0.02 0.00 0.00 0.00 0.00 61.98 61.35 1nni s VAL 5 Cb -0.03 -1.28 0.05 0.00 0.00 0.00 0.00 36.38 35.12 1nni s VAL 5 CO -0.05 0.42 -0.14 -0.63 0.00 0.00 0.00 175.10 174.71 1nni s ILE 6 N 0.39 2.15 -0.73 2.22 1.01 -0.71 -0.56 121.20 124.97 1nni s ILE 6 Ca -0.12 -1.43 -0.24 0.00 0.00 0.00 0.00 60.65 58.85 1nni s ILE 6 Cb -0.15 -2.16 0.05 0.00 0.01 0.00 0.00 42.46 40.21 1nni s ILE 6 CO 0.04 0.13 1.14 0.21 0.00 0.00 0.00 174.94 176.47 1nni s ASN 7 N 1.16 6.21 0.11 3.58 2.47 0.15 -1.84 114.94 126.78 1nni s ASN 7 Ca -0.05 -0.84 0.11 0.00 0.42 0.00 0.00 52.86 52.50 1nni s ASN 7 Cb -0.18 -2.49 0.52 0.00 -1.45 0.00 0.00 41.25 37.65 1nni s ASN 7 CO -0.07 -1.60 1.33 0.61 -3.72 0.00 0.00 177.10 173.64 1nni n GLY 8 N 5.45 -0.76 3.69 1.21 0.00 0.53 -1.93 105.19 113.39 1nni n GLY 8 Ca 0.03 0.05 -0.42 0.00 0.00 0.00 0.00 46.02 45.68 1nni n GLY 8 CO 0.00 0.00 0.00 -1.08 0.00 0.00 0.00 173.32 172.24 1nni s THR 9 N -3.18 4.68 0.21 2.61 -1.32 -1.26 -4.21 115.64 113.18 1nni s THR 9 Ca 0.01 1.96 -0.02 0.00 -1.21 0.00 0.00 61.69 62.43 1nni s THR 9 Cb 0.04 -4.26 -0.02 0.00 -1.51 0.00 0.00 72.50 66.75 1nni s THR 9 CO 0.14 0.00 1.56 1.55 -2.21 0.00 0.00 174.62 175.66 1nni h PRO 10 N 7.16 0.55 -6.37 7.08 0.13 -1.85 -3.30 132.00 135.41 1nni h PRO 10 Ca -0.32 -0.30 -0.53 0.00 -0.87 0.00 0.00 66.00 63.98 1nni h PRO 10 Cb 1.15 0.02 0.02 0.00 0.13 0.00 0.00 31.00 32.32 1nni h PRO 10 CO 0.86 0.90 1.21 1.03 -0.23 0.00 0.00 178.00 181.77 1nni s ARG 11 N -4.14 4.14 0.42 0.86 0.52 -1.26 -3.83 118.95 115.66 1nni s ARG 11 Ca -0.07 2.59 0.20 0.00 -0.52 0.00 0.00 55.73 57.93 1nni s ARG 11 Cb 0.12 -4.09 0.95 0.00 0.52 0.00 0.00 34.95 32.45 1nni s ARG 11 CO 0.83 -0.94 1.88 0.87 0.02 0.00 0.00 175.30 177.96 1nni h LYS 12 N 10.32 0.00 -0.63 3.54 1.57 -1.89 -2.17 116.57 127.32 1nni h LYS 12 Ca -0.49 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.29 1nni h LYS 12 Cb 1.23 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.54 1nni h LYS 12 CO 0.94 0.28 0.00 -2.39 -0.57 0.00 0.00 179.45 177.71 1nni n HIS 13 N -3.75 1.18 -3.16 -1.35 1.44 -1.26 -4.93 115.22 103.39 1nni n HIS 13 Ca -0.01 -0.46 -0.35 0.00 -2.01 0.00 0.00 57.72 54.88 1nni n HIS 13 Cb 0.38 -0.22 -0.06 0.00 0.12 0.00 0.00 29.99 30.22 1nni n HIS 13 CO 0.00 0.00 0.00 0.20 -2.81 0.00 0.00 176.34 173.73 1nni s GLY 14 N -0.78 2.54 0.32 -1.39 0.00 -0.82 -4.98 107.32 102.21 1nni s GLY 14 Ca 0.39 0.09 0.05 0.00 0.00 0.00 0.00 44.72 45.25 1nni s GLY 14 CO 0.18 0.40 1.87 3.21 0.00 0.00 0.00 173.10 178.77 1nni h ARG 15 N 3.24 0.83 -0.32 2.90 3.08 -1.93 -0.88 114.38 121.31 1nni h ARG 15 Ca -0.48 -0.05 0.09 0.00 0.07 0.00 0.00 59.98 59.61 1nni h ARG 15 Cb 1.19 -0.19 -0.01 0.00 0.08 0.00 0.00 29.97 31.04 1nni h ARG 15 CO 0.65 0.55 0.23 1.15 -1.07 0.00 0.00 179.97 181.49 1nni h THR 16 N 0.86 0.85 0.04 2.04 2.02 -1.93 -0.24 112.91 116.54 1nni h THR 16 Ca 0.44 -0.01 -0.00 0.00 0.77 0.00 0.00 66.41 67.61 1nni h THR 16 Cb 0.51 0.83 0.00 0.00 -1.74 0.00 0.00 68.15 67.75 1nni h THR 16 CO -0.21 0.00 -0.02 -0.09 0.37 0.00 0.00 175.52 175.58 1nni h ARG 17 N 0.02 -0.05 -0.33 6.66 2.43 -1.46 -0.32 114.38 121.33 1nni h ARG 17 Ca 0.15 0.00 0.06 0.00 -0.81 0.00 0.00 59.98 59.39 1nni h ARG 17 Cb 0.59 0.01 -0.06 0.00 -0.42 0.00 0.00 29.97 30.09 1nni h ARG 17 CO -0.00 0.05 -0.07 0.82 -1.51 0.00 0.00 179.97 179.25 1nni h ILE 18 N -0.13 0.68 0.15 1.20 2.04 -1.11 0.47 117.51 120.81 1nni h ILE 18 Ca -0.00 -0.00 -0.01 0.00 1.00 0.00 0.00 64.86 65.85 1nni h ILE 18 Cb 0.11 0.67 -0.00 0.00 -0.74 0.00 0.00 36.82 36.86 1nni h ILE 18 CO 0.01 0.00 -0.08 0.00 0.00 0.00 0.00 178.15 178.08 1nni h ALA 19 N 1.32 -0.20 -0.89 1.87 0.00 -1.20 -0.27 119.26 119.88 1nni h ALA 19 Ca 0.16 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 55.03 1nni h ALA 19 Cb 0.24 0.09 -0.04 0.00 0.00 0.00 0.00 17.79 18.07 1nni h ALA 19 CO -0.33 -0.62 0.56 0.00 0.00 0.00 0.00 179.25 178.86 1nni h ALA 20 N 0.65 1.13 -0.08 0.00 0.00 -0.68 -1.48 119.26 118.80 1nni h ALA 20 Ca -0.02 -0.08 -0.06 0.00 0.00 0.00 0.00 54.91 54.74 1nni h ALA 20 Cb 0.17 -0.36 -0.01 0.00 0.00 0.00 0.00 17.79 17.59 1nni h ALA 20 CO 0.02 0.57 -0.25 1.03 0.00 0.00 0.00 179.25 180.62 1nni h SER 21 N 1.22 0.13 0.05 0.00 0.87 0.23 -1.60 113.55 114.45 1nni h SER 21 Ca 0.32 -0.03 -0.00 0.00 -1.23 0.00 0.00 61.79 60.85 1nni h SER 21 Cb -0.09 -0.03 0.00 0.00 -0.44 0.00 0.00 62.40 61.84 1nni h SER 21 CO -0.06 0.39 -0.02 0.22 -0.53 0.00 0.00 176.83 176.82 1nni h TYR 22 N 0.12 -0.06 -0.25 2.24 3.20 -0.28 -3.00 116.97 118.95 1nni h TYR 22 Ca 0.02 -0.00 0.02 0.00 3.14 0.00 0.00 58.73 61.91 1nni h TYR 22 Cb 0.52 0.02 -0.03 0.00 1.54 0.00 0.00 36.73 38.78 1nni h TYR 22 CO 0.00 0.52 0.10 0.82 -1.64 0.00 0.00 178.16 177.96 1nni h ILE 23 N -0.70 0.95 -0.54 1.81 2.04 -1.21 -1.13 117.51 118.72 1nni h ILE 23 Ca -0.01 -0.07 0.04 0.00 1.00 0.00 0.00 64.86 65.82 1nni h ILE 23 Cb 0.61 0.71 -0.04 0.00 -0.74 0.00 0.00 36.82 37.36 1nni h ILE 23 CO 0.01 0.04 0.29 0.00 0.00 0.00 0.00 178.15 178.49 1nni h ALA 24 N 1.15 0.70 -0.22 1.87 0.00 -1.40 -1.79 119.26 119.57 1nni h ALA 24 Ca 0.11 0.01 -0.02 0.00 0.00 0.00 0.00 54.91 55.02 1nni h ALA 24 Cb 0.07 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 17.75 1nni h ALA 24 CO -0.11 -0.04 0.07 0.00 0.00 0.00 0.00 179.25 179.18 1nni h ALA 25 N 1.28 0.28 0.00 0.00 0.00 -1.35 0.22 119.26 119.69 1nni h ALA 25 Ca 0.23 -0.13 0.00 0.00 0.00 0.00 0.00 54.91 55.02 1nni h ALA 25 Cb 0.12 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 17.82 1nni h ALA 25 CO -0.15 -0.10 0.00 1.25 0.00 0.00 0.00 179.25 180.25 1nni h LEU 26 N 0.18 0.00 -2.25 0.00 5.85 -0.85 -3.08 115.31 115.17 1nni h LEU 26 Ca 0.07 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.79 1nni h LEU 26 Cb 0.21 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.24 1nni h LEU 26 CO -0.00 0.00 0.00 -1.22 -0.34 0.00 0.00 178.44 176.88 1nni n TYR 27 N -2.55 0.00 -3.60 1.25 4.02 -0.71 -5.04 117.16 110.54 1nni n TYR 27 Ca 0.00 -0.32 -0.27 0.00 -0.01 0.00 0.00 57.90 57.30 1nni n TYR 27 Cb 0.18 -0.03 0.04 0.00 -0.02 0.00 0.00 39.34 39.51 1nni n TYR 27 CO 0.00 0.00 0.00 0.72 -1.01 0.00 0.00 176.86 176.57 1nni n HIS 28 N -0.32 -2.06 -3.99 -0.72 8.25 0.70 -4.98 115.22 112.10 1nni n HIS 28 Ca 0.00 0.57 -0.24 0.00 -0.26 0.00 0.00 57.72 57.79 1nni n HIS 28 Cb 0.28 -3.49 -0.06 0.00 1.12 0.00 0.00 29.99 27.84 1nni n HIS 28 CO 0.00 0.00 0.00 0.95 0.64 0.00 0.00 176.34 177.93 1nni s THR 29 N -3.38 2.29 0.79 1.59 -4.23 -0.70 -5.05 115.64 106.95 1nni s THR 29 Ca 0.40 -1.60 -0.11 0.00 -1.18 0.00 0.00 61.69 59.19 1nni s THR 29 Cb -0.13 -2.89 0.06 0.00 1.34 0.00 0.00 72.50 70.87 1nni s THR 29 CO 0.85 0.00 1.09 -0.62 -0.54 0.00 0.00 174.62 175.40 1nni s ASP 30 N -3.99 4.55 -0.20 3.99 -1.08 -1.26 -4.89 116.67 113.79 1nni s ASP 30 Ca 0.41 1.39 -0.08 0.00 -0.52 0.00 0.00 52.55 53.75 1nni s ASP 30 Cb 0.02 -2.14 0.08 0.00 -1.46 0.00 0.00 42.92 39.42 1nni s ASP 30 CO 0.23 -1.94 0.44 -0.22 0.52 0.00 0.00 175.17 174.19 1nni s LEU 31 N -5.78 -0.51 -0.35 -1.34 2.96 -1.26 -2.16 118.68 110.24 1nni s LEU 31 Ca 0.61 1.00 -0.03 0.00 -0.22 0.00 0.00 54.13 55.48 1nni s LEU 31 Cb -0.15 1.42 0.07 0.00 0.50 0.00 0.00 46.19 48.04 1nni s LEU 31 CO 0.55 -0.22 0.11 -0.63 -1.32 0.00 0.00 176.35 174.83 1nni s ILE 32 N 2.22 3.32 -0.40 6.68 1.01 0.28 -4.98 121.20 129.32 1nni s ILE 32 Ca -0.05 -1.57 -0.17 0.00 0.00 0.00 0.00 60.65 58.87 1nni s ILE 32 Cb -0.11 -3.04 0.01 0.00 0.01 0.00 0.00 42.46 39.34 1nni s ILE 32 CO -0.13 -0.35 0.41 -0.62 0.00 0.00 0.00 174.94 174.25 1nni s ASP 33 N 1.53 6.18 0.00 3.58 -1.08 -1.26 -0.68 116.67 124.94 1nni s ASP 33 Ca 0.01 -0.61 0.00 0.00 -0.52 0.00 0.00 52.55 51.43 1nni s ASP 33 Cb -0.21 -2.21 0.02 0.00 -1.46 0.00 0.00 42.92 39.06 1nni s ASP 33 CO -0.01 -0.52 0.36 0.18 0.52 0.00 0.00 175.17 175.70 1nni n LEU 34 N 5.51 0.00 -0.01 -1.34 4.32 -0.81 -1.19 117.00 123.48 1nni n LEU 34 Ca -0.08 0.00 -0.10 0.00 -0.02 0.00 0.00 56.01 55.81 1nni n LEU 34 Cb 0.48 0.00 -0.14 0.00 -1.62 0.00 0.00 43.42 42.14 1nni n LEU 34 CO 0.44 0.00 -0.50 0.28 -1.22 0.00 0.00 177.39 176.39 1nni h SER 35 N 0.00 0.06 0.00 -1.43 0.02 -1.66 -3.40 113.55 107.15 1nni h SER 35 Ca 0.00 -0.13 -0.29 0.00 -0.84 0.00 0.00 61.79 60.53 1nni h SER 35 Cb 0.00 -0.02 -0.05 0.00 0.14 0.00 0.00 62.40 62.47 1nni h SER 35 CO 0.00 1.12 -2.07 -1.84 -1.14 0.00 0.00 176.83 172.90 1nni n GLU 36 N -3.13 0.46 -1.51 3.45 -0.00 -0.43 -4.72 120.64 114.77 1nni n GLU 36 Ca -0.17 0.12 -0.41 0.00 -0.00 0.00 0.00 57.16 56.69 1nni n GLU 36 Cb 1.04 -1.35 -0.02 0.00 -0.00 0.00 0.00 31.44 31.11 1nni n GLU 36 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.13 177.47 1nni n PHE 37 N -3.15 2.93 -2.80 -1.84 7.35 -0.33 -4.94 117.46 114.67 1nni n PHE 37 Ca -0.34 -2.64 -0.42 0.00 -0.76 0.00 0.00 57.45 53.30 1nni n PHE 37 Cb 0.84 -2.29 -0.03 0.00 0.35 0.00 0.00 39.48 38.35 1nni n PHE 37 CO 0.00 0.00 0.00 0.08 -0.76 0.00 0.00 176.76 176.08 1nni s VAL 38 N 3.61 4.85 0.37 -2.13 1.01 -1.26 -4.69 120.40 122.16 1nni s VAL 38 Ca 0.51 1.83 0.08 0.00 0.00 0.00 0.00 61.98 64.40 1nni s VAL 38 Cb 0.14 -4.22 -0.04 0.00 0.00 0.00 0.00 36.38 32.26 1nni s VAL 38 CO -0.03 0.05 0.23 -0.76 0.00 0.00 0.00 175.10 174.59 1nni s LEU 39 N 1.86 3.32 0.32 3.92 1.43 -1.26 -4.99 118.68 123.28 1nni s LEU 39 Ca 0.44 -0.78 -0.01 0.00 -1.03 0.00 0.00 54.13 52.74 1nni s LEU 39 Cb -0.18 -1.83 -0.04 0.00 0.03 0.00 0.00 46.19 44.17 1nni s LEU 39 CO 0.17 -0.44 0.54 -2.16 0.23 0.00 0.00 176.35 174.69 1nni s PRO 40 N -3.95 3.53 0.14 1.29 0.04 -1.26 -5.00 135.00 129.79 1nni s PRO 40 Ca 0.41 -0.23 -0.31 0.00 0.04 0.00 0.00 61.00 60.91 1nni s PRO 40 Cb -0.02 -2.67 -0.11 0.00 0.04 0.00 0.00 34.50 31.75 1nni s PRO 40 CO 0.24 0.18 1.79 0.08 0.04 0.00 0.00 177.00 179.33 1nni s VAL 41 N -2.22 2.46 0.59 -0.36 1.01 -1.26 -4.89 120.40 115.73 1nni s VAL 41 Ca 0.41 0.09 -0.18 0.00 0.00 0.00 0.00 61.98 62.30 1nni s VAL 41 Cb -0.10 -3.06 -0.10 0.00 0.00 0.00 0.00 36.38 33.12 1nni s VAL 41 CO 0.34 0.00 0.28 0.33 0.00 0.00 0.00 175.10 176.05 1nni n PHE 42 N 5.25 -1.54 -1.59 5.22 7.35 -1.26 -4.94 117.46 125.95 1nni n PHE 42 Ca 0.17 0.41 0.00 0.00 -0.76 0.00 0.00 57.45 57.27 1nni n PHE 42 Cb 0.38 -1.85 0.00 0.00 0.35 0.00 0.00 39.48 38.36 1nni n PHE 42 CO 0.00 0.00 0.00 0.27 -0.76 0.00 0.00 176.76 176.27 1nni n ASN 43 N 1.09 0.00 0.00 -2.13 2.04 -1.26 -5.04 115.26 109.96 1nni n ASN 43 Ca 0.10 -1.03 0.00 0.00 -0.44 0.00 0.00 54.58 53.21 1nni n ASN 43 Cb 0.48 -0.01 0.00 0.00 -2.53 0.00 0.00 39.78 37.73 1nni n ASN 43 CO 0.00 0.00 0.00 0.61 -0.44 0.00 0.00 177.26 177.43 1nni n GLY 44 N 0.00 2.18 3.68 4.83 0.00 -1.26 -4.97 105.19 109.66 1nni n GLY 44 Ca 0.00 0.00 -0.45 0.00 0.00 0.00 0.00 46.02 45.57 1nni n GLY 44 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1nni n GLU 45 N -0.44 2.39 0.20 1.61 -0.58 -1.26 -4.87 120.64 117.69 1nni n GLU 45 Ca 0.00 0.86 0.14 0.00 -0.42 0.00 0.00 57.16 57.75 1nni n GLU 45 Cb 0.00 -2.68 0.62 0.00 -0.57 0.00 0.00 31.44 28.81 1nni n GLU 45 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 1nni h ALA 46 N 6.82 1.00 0.00 0.62 0.00 -2.01 -1.49 119.26 124.20 1nni h ALA 46 Ca -0.45 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.46 1nni h ALA 46 Cb 1.24 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.03 1nni h ALA 46 CO 0.92 0.00 0.00 -0.85 0.00 0.00 0.00 179.25 179.32 1nni n GLU 47 N -2.59 0.81 -0.06 0.00 0.28 -1.26 -1.70 120.64 116.11 1nni n GLU 47 Ca 0.01 0.00 -0.08 0.00 -0.16 0.00 0.00 57.16 56.93 1nni n GLU 47 Cb 0.23 -1.50 -0.15 0.00 1.43 0.00 0.00 31.44 31.45 1nni n GLU 47 CO 0.00 0.00 0.00 0.94 -0.16 0.00 0.00 177.13 177.91 1nni n GLN 48 N -1.04 0.67 0.26 3.44 7.27 -0.56 -3.89 117.38 123.53 1nni n GLN 48 Ca 0.20 0.10 0.14 0.00 0.07 0.00 0.00 57.00 57.51 1nni n GLN 48 Cb 0.11 -1.63 0.68 0.00 2.41 0.00 0.00 30.24 31.82 1nni n GLN 48 CO 0.00 0.00 0.00 1.03 0.07 0.00 0.00 177.06 178.16 1nni h SER 49 N 0.00 0.00 -0.41 1.69 0.87 -1.38 -1.35 113.55 112.97 1nni h SER 49 Ca -0.42 0.00 -0.08 0.00 -1.23 0.00 0.00 61.79 60.06 1nni h SER 49 Cb 2.09 0.00 -0.04 0.00 -0.44 0.00 0.00 62.40 64.01 1nni h SER 49 CO 0.05 0.11 0.10 1.21 -0.53 0.00 0.00 176.83 177.76 1nni n GLU 50 N -3.35 2.96 -3.27 2.24 4.07 -1.16 -4.41 120.64 117.72 1nni n GLU 50 Ca -0.01 -1.87 -0.38 0.00 -0.06 0.00 0.00 57.16 54.85 1nni n GLU 50 Cb 0.30 -1.90 -0.06 0.00 -0.06 0.00 0.00 31.44 29.72 1nni n GLU 50 CO 0.00 0.00 0.00 -1.17 -0.06 0.00 0.00 177.13 175.90 1nni s LEU 51 N -1.73 4.30 0.00 4.31 0.20 -0.51 -4.96 118.68 120.30 1nni s LEU 51 Ca 0.33 0.91 0.00 0.00 0.69 0.00 0.00 54.13 56.06 1nni s LEU 51 Cb 0.26 -2.77 0.00 0.00 -0.43 0.00 0.00 46.19 43.25 1nni s LEU 51 CO 0.09 0.01 0.00 0.18 -0.29 0.00 0.00 176.35 176.34 1nni n LEU 52 N 3.52 0.00 0.00 -0.68 4.77 -1.26 -1.35 117.00 121.99 1nni n LEU 52 Ca -0.06 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 55.92 1nni n LEU 52 Cb 0.52 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.61 1nni n LEU 52 CO 0.43 0.00 0.35 1.17 -1.33 0.00 0.00 177.39 178.02 1nni n LYS 53 N -1.14 0.00 -0.28 3.23 3.00 -1.26 -3.82 118.16 117.90 1nni n LYS 53 Ca 0.00 0.64 0.23 0.00 -0.00 0.00 0.00 58.31 59.18 1nni n LYS 53 Cb 0.00 -1.20 0.43 0.00 0.00 0.00 0.00 35.03 34.26 1nni n LYS 53 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.40 177.68 1nni n VAL 54 N -1.71 -0.36 -0.04 3.15 0.31 -0.46 -0.51 118.33 118.72 1nni n VAL 54 Ca 0.00 1.77 -0.08 0.00 -0.01 0.00 0.00 64.34 66.02 1nni n VAL 54 Cb 0.00 -2.79 0.08 0.00 -0.91 0.00 0.00 33.84 30.22 1nni n VAL 54 CO 0.00 0.00 0.00 1.56 -1.32 0.00 0.00 176.83 177.07 1nni h GLN 55 N 0.00 0.66 -0.37 5.55 7.50 -1.65 -2.91 115.11 123.89 1nni h GLN 55 Ca 0.66 -0.33 -0.06 0.00 0.50 0.00 0.00 58.65 59.42 1nni h GLN 55 Cb 1.67 0.00 -0.01 0.00 0.05 0.00 0.00 27.48 29.19 1nni h GLN 55 CO -0.70 0.93 -0.02 1.49 -1.50 0.00 0.00 178.83 179.04 1nni h GLU 56 N 0.55 0.67 0.18 1.46 4.81 -0.93 -1.99 114.58 119.33 1nni h GLU 56 Ca 0.05 -0.22 0.01 0.00 -0.13 0.00 0.00 59.36 59.07 1nni h GLU 56 Cb 0.90 -0.06 -0.04 0.00 0.63 0.00 0.00 28.75 30.19 1nni h GLU 56 CO 0.08 0.78 -0.46 1.25 -0.73 0.00 0.00 179.01 179.94 1nni h LEU 57 N 0.48 -1.34 -0.84 1.64 5.85 -1.39 0.56 115.31 120.27 1nni h LEU 57 Ca 0.10 0.14 0.09 0.00 0.84 0.00 0.00 57.88 59.05 1nni h LEU 57 Cb 0.49 0.49 -0.07 0.00 0.37 0.00 0.00 40.66 41.94 1nni h LEU 57 CO 0.02 -0.53 0.49 0.11 -0.34 0.00 0.00 178.44 178.19 1nni h LYS 58 N -0.73 0.81 0.66 1.25 1.57 -1.54 0.88 116.57 119.48 1nni h LYS 58 Ca 0.00 -0.05 -0.03 0.00 -1.87 0.00 0.00 60.65 58.71 1nni h LYS 58 Cb 0.73 -0.18 -0.01 0.00 0.08 0.00 0.00 32.23 32.85 1nni h LYS 58 CO -0.22 0.54 -0.42 1.96 -0.57 0.00 0.00 179.45 180.73 1nni h GLN 59 N 0.83 -0.99 -0.54 3.15 4.20 -0.40 -0.72 115.11 120.64 1nni h GLN 59 Ca 0.40 0.07 -0.08 0.00 0.06 0.00 0.00 58.65 59.09 1nni h GLN 59 Cb 0.33 0.23 -0.02 0.00 0.30 0.00 0.00 27.48 28.32 1nni h GLN 59 CO -0.23 -0.66 0.02 0.00 -0.67 0.00 0.00 178.83 177.28 1nni h ARG 60 N -1.03 0.95 -0.28 1.46 3.08 0.32 -1.61 114.38 117.27 1nni h ARG 60 Ca -0.08 -0.29 -0.05 0.00 0.07 0.00 0.00 59.98 59.62 1nni h ARG 60 Cb 0.84 -0.09 -0.02 0.00 0.08 0.00 0.00 29.97 30.78 1nni h ARG 60 CO 0.07 0.95 -0.06 0.28 -1.07 0.00 0.00 179.97 180.14 1nni h VAL 61 N 0.83 1.20 0.00 2.04 2.07 -0.82 -2.38 116.25 119.19 1nni h VAL 61 Ca 0.16 -0.84 0.00 0.00 0.82 0.00 0.00 66.70 66.84 1nni h VAL 61 Cb 0.51 1.06 0.00 0.00 -1.52 0.00 0.00 31.29 31.34 1nni h VAL 61 CO 0.02 0.28 -0.36 0.00 0.02 0.00 0.00 177.57 177.53 1nni h THR 62 N 0.42 0.00 0.06 2.57 1.03 -0.97 -3.30 112.91 112.72 1nni h THR 62 Ca 0.09 -0.83 -0.00 0.00 -0.01 0.00 0.00 66.41 65.66 1nni h THR 62 Cb 0.38 1.63 0.00 0.00 -1.07 0.00 0.00 68.15 69.09 1nni h THR 62 CO 0.02 0.00 -0.03 0.50 -0.01 0.00 0.00 175.52 176.00 1nni h LYS 63 N 0.00 -0.08 -6.54 0.00 3.64 -0.80 -3.45 116.57 109.34 1nni h LYS 63 Ca 0.00 0.01 -0.58 0.00 -1.27 0.00 0.00 60.65 58.81 1nni h LYS 63 Cb 0.91 0.02 0.17 0.00 -0.41 0.00 0.00 32.23 32.92 1nni h LYS 63 CO 0.00 0.38 -0.35 0.00 -2.27 0.00 0.00 179.45 177.20 1nni n ALA 64 N -2.39 -1.07 0.47 5.00 0.00 -1.00 -4.93 120.51 116.59 1nni n ALA 64 Ca -0.08 -0.04 0.05 0.00 0.00 0.00 0.00 53.44 53.37 1nni n ALA 64 Cb 0.25 -1.85 0.00 0.00 0.00 0.00 0.00 19.45 17.85 1nni n ALA 64 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.50 177.25 1nni n ASP 65 N 0.33 1.32 -3.57 0.00 8.00 0.24 -4.97 116.55 117.90 1nni n ASP 65 Ca 0.12 -1.16 -0.15 0.00 0.71 0.00 0.00 54.79 54.31 1nni n ASP 65 Cb 0.48 0.42 -0.06 0.00 -0.02 0.00 0.00 41.12 41.93 1nni n ASP 65 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1nni s ALA 66 N -1.35 -1.83 0.01 2.24 0.00 -1.24 -4.13 121.76 115.46 1nni s ALA 66 Ca 0.09 1.61 0.02 0.00 0.00 0.00 0.00 51.96 53.69 1nni s ALA 66 Cb 0.09 -0.60 -0.01 0.00 0.00 0.00 0.00 23.12 22.59 1nni s ALA 66 CO 0.25 -0.33 -0.08 0.42 0.00 0.00 0.00 175.76 176.02 1nni s ILE 67 N -0.61 0.61 -0.34 0.00 1.01 0.31 -1.45 121.20 120.74 1nni s ILE 67 Ca -0.05 -0.54 -0.05 0.00 0.00 0.00 0.00 60.65 60.02 1nni s ILE 67 Cb -0.02 -0.55 0.05 0.00 0.01 0.00 0.00 42.46 41.95 1nni s ILE 67 CO 0.04 0.03 0.09 -0.69 0.00 0.00 0.00 174.94 174.41 1nni s VAL 68 N -0.49 3.51 -0.34 2.92 1.01 -0.13 -0.50 120.40 126.39 1nni s VAL 68 Ca -0.00 -1.31 -0.13 0.00 0.00 0.00 0.00 61.98 60.55 1nni s VAL 68 Cb -0.05 -3.04 -0.02 0.00 0.00 0.00 0.00 36.38 33.27 1nni s VAL 68 CO 0.00 -0.22 0.24 -0.22 0.00 0.00 0.00 175.10 174.91 1nni s LEU 69 N 1.33 4.50 0.15 3.92 2.96 0.40 -1.74 118.68 130.21 1nni s LEU 69 Ca -0.02 -0.40 0.08 0.00 -0.22 0.00 0.00 54.13 53.57 1nni s LEU 69 Cb -0.20 -2.14 -0.04 0.00 0.50 0.00 0.00 46.19 44.31 1nni s LEU 69 CO 0.01 -0.23 -0.07 -0.76 -1.32 0.00 0.00 176.35 173.98 1nni s LEU 70 N 1.73 3.11 -0.12 -0.68 1.02 -0.77 -1.75 118.68 121.22 1nni s LEU 70 Ca 0.06 -0.44 -0.30 0.00 0.02 0.00 0.00 54.13 53.47 1nni s LEU 70 Cb -0.17 -1.83 0.12 0.00 0.02 0.00 0.00 46.19 44.33 1nni s LEU 70 CO 0.11 0.13 0.97 -0.55 0.02 0.00 0.00 176.35 177.03 1nni s SER 71 N -2.60 -0.36 0.37 2.29 0.15 -0.96 -0.34 113.70 112.24 1nni s SER 71 Ca 0.24 0.30 -0.06 0.00 0.70 0.00 0.00 55.95 57.12 1nni s SER 71 Cb -0.10 0.32 -0.05 0.00 -1.71 0.00 0.00 66.02 64.48 1nni s SER 71 CO 0.16 -0.41 0.67 -2.16 1.20 0.00 0.00 173.24 172.69 1nni s PRO 72 N -1.65 3.65 -0.20 5.44 0.04 -1.26 -0.41 135.00 140.61 1nni s PRO 72 Ca 0.00 0.16 -0.19 0.00 0.04 0.00 0.00 61.00 61.02 1nni s PRO 72 Cb -0.01 -2.52 -0.03 0.00 0.04 0.00 0.00 34.50 31.99 1nni s PRO 72 CO -0.01 0.05 0.53 -2.00 0.04 0.00 0.00 177.00 175.61 1nni s GLU 73 N -3.92 4.19 -0.16 4.56 2.12 -1.03 -3.88 118.70 120.58 1nni s GLU 73 Ca 0.47 0.43 0.02 0.00 0.36 0.00 0.00 54.97 56.24 1nni s GLU 73 Cb -0.10 -3.56 0.02 0.00 0.26 0.00 0.00 34.13 30.74 1nni s GLU 73 CO 0.33 -0.16 -0.20 0.71 -0.54 0.00 0.00 175.26 175.40 1nni s TYR 74 N 1.66 2.70 -1.19 5.30 4.12 -0.49 -4.71 117.35 124.74 1nni s TYR 74 Ca 0.24 -1.50 -0.20 0.00 0.02 0.00 0.00 57.07 55.63 1nni s TYR 74 Cb -0.15 -1.86 0.00 0.00 -1.52 0.00 0.00 41.96 38.43 1nni s TYR 74 CO 0.10 -0.72 0.72 0.72 0.02 0.00 0.00 175.55 176.38 1nni n HIS 75 N 4.40 -1.78 -3.38 2.71 8.25 -1.26 -0.62 115.22 123.54 1nni n HIS 75 Ca -0.20 0.43 -0.22 0.00 -0.26 0.00 0.00 57.72 57.47 1nni n HIS 75 Cb 0.51 -3.37 -0.02 0.00 1.12 0.00 0.00 29.99 28.23 1nni n HIS 75 CO 0.00 0.00 0.00 0.43 0.64 0.00 0.00 176.34 177.41 1nni n SER 76 N -2.63 -2.77 0.00 0.41 7.64 -1.26 -5.06 113.62 109.94 1nni n SER 76 Ca -0.13 -0.35 0.00 0.00 1.01 0.00 0.00 58.87 59.40 1nni n SER 76 Cb 0.60 -2.35 0.00 0.00 -1.01 0.00 0.00 64.21 61.45 1nni n SER 76 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1nni n GLY 77 N -0.99 2.33 3.89 0.23 0.00 0.21 -4.24 105.19 106.61 1nni n GLY 77 Ca 0.01 -0.15 -0.35 0.00 0.00 0.00 0.00 46.02 45.53 1nni n GLY 77 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1nni s SER 79 N 1.34 6.47 0.37 1.61 1.04 -1.25 -1.40 113.70 121.89 1nni s SER 79 Ca 0.00 0.53 0.06 0.00 0.48 0.00 0.00 55.95 57.02 1nni s SER 79 Cb 0.00 -2.08 0.76 0.00 0.10 0.00 0.00 66.02 64.80 1nni s SER 79 CO 0.00 0.27 1.99 1.23 0.98 0.00 0.00 173.24 177.71 1nni h GLY 80 N 4.08 0.85 0.63 7.32 0.00 -1.94 -1.43 103.07 112.57 1nni h GLY 80 Ca -0.50 -0.29 0.06 0.00 0.00 0.00 0.00 47.33 46.60 1nni h GLY 80 CO 0.66 0.24 0.23 0.00 0.00 0.00 0.00 176.54 177.67 1nni h ALA 81 N 1.64 0.65 -0.02 3.60 0.00 -2.00 0.22 119.26 123.35 1nni h ALA 81 Ca 0.26 0.04 -0.19 0.00 0.00 0.00 0.00 54.91 55.02 1nni h ALA 81 Cb 0.14 -0.03 -0.01 0.00 0.00 0.00 0.00 17.79 17.90 1nni h ALA 81 CO -0.08 -0.14 -0.82 1.25 0.00 0.00 0.00 179.25 179.46 1nni h LEU 82 N 0.45 0.32 -0.19 0.00 5.85 -1.53 -2.67 115.31 117.53 1nni h LEU 82 Ca 0.24 -0.24 -0.04 0.00 0.84 0.00 0.00 57.88 58.68 1nni h LEU 82 Cb 0.20 -0.10 -0.01 0.00 0.37 0.00 0.00 40.66 41.12 1nni h LEU 82 CO -0.20 1.01 -0.04 0.50 -0.34 0.00 0.00 178.44 179.38 1nni h LYS 83 N 0.15 0.36 -0.31 1.25 1.63 -0.94 -1.14 116.57 117.58 1nni h LYS 83 Ca -0.04 -0.14 0.07 0.00 -0.85 0.00 0.00 60.65 59.69 1nni h LYS 83 Cb 1.43 -0.02 -0.07 0.00 -0.60 0.00 0.00 32.23 32.97 1nni h LYS 83 CO 0.13 0.61 -0.12 -0.97 -3.45 0.00 0.00 179.45 175.66 1nni h ASN 84 N 0.09 -0.40 -0.13 4.20 -0.73 -1.00 0.10 115.58 117.71 1nni h ASN 84 Ca 0.05 0.11 0.02 0.00 1.87 0.00 0.00 56.30 58.35 1nni h ASN 84 Cb 0.47 0.24 -0.05 0.00 0.27 0.00 0.00 38.32 39.25 1nni h ASN 84 CO 0.02 -0.15 -0.40 0.00 -0.37 0.00 0.00 177.43 176.53 1nni h ALA 85 N 1.22 -0.76 -0.92 1.57 0.00 -1.19 -1.38 119.26 117.80 1nni h ALA 85 Ca 0.16 -0.04 0.20 0.00 0.00 0.00 0.00 54.91 55.22 1nni h ALA 85 Cb 0.29 0.92 -0.07 0.00 0.00 0.00 0.00 17.79 18.93 1nni h ALA 85 CO -0.35 -0.91 0.60 -0.07 0.00 0.00 0.00 179.25 178.52 1nni h LEU 86 N -0.41 0.50 -2.14 0.00 3.38 -0.41 -0.03 115.31 116.20 1nni h LEU 86 Ca 0.03 0.05 0.07 0.00 0.09 0.00 0.00 57.88 58.12 1nni h LEU 86 Cb 0.49 -0.04 -0.01 0.00 0.09 0.00 0.00 40.66 41.19 1nni h LEU 86 CO -0.34 0.20 0.22 0.44 0.09 0.00 0.00 178.44 179.05 1nni h ASP 87 N 0.50 0.00 1.06 -0.43 3.32 0.35 0.30 116.42 121.51 1nni h ASP 87 Ca 0.49 0.00 -0.05 0.00 0.02 0.00 0.00 57.03 57.48 1nni h ASP 87 Cb 1.08 0.00 -0.01 0.00 0.22 0.00 0.00 39.33 40.63 1nni h ASP 87 CO -0.21 0.00 -0.26 -0.26 -1.72 0.00 0.00 179.24 176.79 1nni h PHE 88 N 0.00 0.00 -4.47 4.55 -1.00 -0.93 -3.45 116.94 111.65 1nni h PHE 88 Ca 0.11 0.00 -0.16 0.00 2.81 0.00 0.00 57.97 60.74 1nni h PHE 88 Cb 0.55 0.00 0.02 0.00 3.61 0.00 0.00 35.95 40.12 1nni h PHE 88 CO 0.00 0.26 0.01 1.28 -1.61 0.00 0.00 178.31 178.25 1nni n LEU 89 N -3.36 0.00 0.00 1.54 4.77 0.11 -5.03 117.00 115.03 1nni n LEU 89 Ca 0.01 -0.77 -0.07 0.00 -0.03 0.00 0.00 56.01 55.14 1nni n LEU 89 Cb 0.48 -0.17 0.03 0.00 -2.33 0.00 0.00 43.42 41.42 1nni n LEU 89 CO 0.34 -0.61 0.52 -1.54 -1.33 0.00 0.00 177.39 174.77 1nni n SER 90 N -2.87 -2.02 0.00 -1.43 3.41 -1.26 -4.98 113.62 104.47 1nni n SER 90 Ca 0.05 -2.36 0.03 0.00 -0.26 0.00 0.00 58.87 56.33 1nni n SER 90 Cb 0.20 3.35 0.15 0.00 -0.26 0.00 0.00 64.21 67.65 1nni n SER 90 CO 0.00 0.00 0.00 -1.54 -0.16 0.00 0.00 175.04 173.34 1nni n SER 91 N -1.45 0.00 0.01 4.04 3.41 -1.26 -1.77 113.62 116.60 1nni n SER 91 Ca -0.07 -0.07 -0.13 0.00 -0.26 0.00 0.00 58.87 58.34 1nni n SER 91 Cb 0.54 -0.07 -0.09 0.00 -0.26 0.00 0.00 64.21 64.33 1nni n SER 91 CO 0.00 0.00 0.00 -0.08 -0.16 0.00 0.00 175.04 174.80 1nni h GLU 92 N 0.00 -0.03 0.00 4.33 4.57 -1.94 -1.83 114.58 119.68 1nni h GLU 92 Ca 0.00 0.00 0.00 0.00 -1.18 0.00 0.00 59.36 58.18 1nni h GLU 92 Cb 0.01 0.01 0.00 0.00 -0.16 0.00 0.00 28.75 28.61 1nni h GLU 92 CO 0.00 0.33 -0.65 1.96 -1.18 0.00 0.00 179.01 179.48 1nni h GLN 93 N -0.41 0.00 0.00 1.92 7.50 -1.73 -3.38 115.11 119.01 1nni h GLN 93 Ca -0.00 0.00 0.00 0.00 0.50 0.00 0.00 58.65 59.15 1nni h GLN 93 Cb 0.38 0.00 0.00 0.00 0.05 0.00 0.00 27.48 27.91 1nni h GLN 93 CO 0.01 0.00 -1.53 1.19 -1.50 0.00 0.00 178.83 176.99 1nni n PHE 94 N -2.49 0.00 -1.70 2.96 3.01 -1.15 -4.50 117.46 113.60 1nni n PHE 94 Ca 0.02 0.00 -0.62 0.00 1.01 0.00 0.00 57.45 57.86 1nni n PHE 94 Cb 0.50 -0.29 -0.08 0.00 -0.01 0.00 0.00 39.48 39.59 1nni n PHE 94 CO 0.00 0.00 0.00 1.17 1.01 0.00 0.00 176.76 178.94 1nni n LYS 95 N -1.92 0.50 -0.88 -1.08 4.81 -0.69 -0.36 118.16 118.54 1nni n LYS 95 Ca -0.02 0.18 0.00 0.00 -0.87 0.00 0.00 58.31 57.60 1nni n LYS 95 Cb 0.36 -1.76 0.00 0.00 0.02 0.00 0.00 35.03 33.65 1nni n LYS 95 CO 0.00 0.00 0.00 0.66 1.17 0.00 0.00 177.40 179.23 1nni n TYR 96 N 4.10 0.00 -2.78 5.64 4.01 0.01 -4.92 117.16 123.23 1nni n TYR 96 Ca 0.27 0.00 -0.41 0.00 -0.16 0.00 0.00 57.90 57.60 1nni n TYR 96 Cb 0.04 -1.57 -0.04 0.00 -0.31 0.00 0.00 39.34 37.46 1nni n TYR 96 CO 0.00 0.00 0.00 0.21 -0.46 0.00 0.00 176.86 176.61 1nni s LYS 97 N -1.45 4.63 0.17 -0.72 2.20 0.51 -4.51 119.74 120.58 1nni s LYS 97 Ca 0.00 1.36 -0.31 0.00 -0.36 0.00 0.00 55.97 56.67 1nni s LYS 97 Cb 0.00 -3.39 -0.09 0.00 -1.51 0.00 0.00 37.83 32.84 1nni s LYS 97 CO 0.00 0.17 1.42 -2.14 -0.36 0.00 0.00 175.35 174.44 1nni s PRO 98 N 0.20 4.30 -0.01 4.03 0.02 -1.26 -0.90 135.00 141.38 1nni s PRO 98 Ca 0.46 2.18 0.02 0.00 0.02 0.00 0.00 61.00 63.69 1nni s PRO 98 Cb -0.22 -3.19 -0.00 0.00 0.02 0.00 0.00 34.50 31.11 1nni s PRO 98 CO 0.28 -0.43 -0.08 0.08 -0.33 0.00 0.00 177.00 176.52 1nni s VAL 99 N 0.66 0.64 -0.16 3.83 1.01 -1.14 -0.53 120.40 124.72 1nni s VAL 99 Ca 0.63 -0.34 -0.00 0.00 0.00 0.00 0.00 61.98 62.27 1nni s VAL 99 Cb -0.39 -0.54 -0.00 0.00 0.00 0.00 0.00 36.38 35.44 1nni s VAL 99 CO 0.35 0.19 -0.14 0.00 0.00 0.00 0.00 175.10 175.49 1nni s ALA 100 N -0.14 2.53 0.10 5.51 0.00 0.35 -1.65 121.76 128.46 1nni s ALA 100 Ca 0.02 -1.07 -0.14 0.00 0.00 0.00 0.00 51.96 50.78 1nni s ALA 100 Cb -0.04 -1.28 -0.06 0.00 0.00 0.00 0.00 23.12 21.74 1nni s ALA 100 CO -0.00 -0.10 0.50 -0.51 0.00 0.00 0.00 175.76 175.64 1nni s LEU 101 N 0.92 4.38 -0.22 0.00 1.43 -1.26 -0.45 118.68 123.48 1nni s LEU 101 Ca -0.03 1.01 -0.09 0.00 -1.03 0.00 0.00 54.13 53.99 1nni s LEU 101 Cb -0.15 -3.07 0.09 0.00 0.03 0.00 0.00 46.19 43.09 1nni s LEU 101 CO -0.02 0.17 0.50 -0.22 0.23 0.00 0.00 176.35 177.01 1nni s LEU 102 N -1.74 -0.67 0.13 1.79 0.20 -0.72 -3.19 118.68 114.49 1nni s LEU 102 Ca 0.34 1.16 0.10 0.00 0.69 0.00 0.00 54.13 56.41 1nni s LEU 102 Cb -0.15 1.68 -0.04 0.00 -0.43 0.00 0.00 46.19 47.24 1nni s LEU 102 CO 0.18 -0.22 -0.20 0.00 -0.29 0.00 0.00 176.35 175.82 1nni s ALA 103 N 2.30 2.61 -0.30 5.97 0.00 -0.56 -2.26 121.76 129.51 1nni s ALA 103 Ca -0.05 -1.42 0.03 0.00 0.00 0.00 0.00 51.96 50.52 1nni s ALA 103 Cb -0.10 -0.55 0.08 0.00 0.00 0.00 0.00 23.12 22.55 1nni s ALA 103 CO -0.15 0.55 -0.02 0.08 0.00 0.00 0.00 175.76 176.22 1nni s VAL 104 N -1.22 2.20 0.11 0.00 1.01 0.45 -0.87 120.40 122.08 1nni s VAL 104 Ca 0.18 -2.02 0.01 0.00 0.00 0.00 0.00 61.98 60.14 1nni s VAL 104 Cb -0.10 -2.49 0.02 0.00 0.00 0.00 0.00 36.38 33.81 1nni s VAL 104 CO 0.09 -0.35 0.15 0.00 0.00 0.00 0.00 175.10 174.99 1nni n ALA 105 N 4.34 0.12 -0.17 5.51 0.00 -0.94 -2.48 120.51 126.89 1nni n ALA 105 Ca -0.04 -0.33 0.05 0.00 0.00 0.00 0.00 53.44 53.12 1nni n ALA 105 Cb 0.42 0.07 0.15 0.00 0.00 0.00 0.00 19.45 20.09 1nni n ALA 105 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1nni n GLY 106 N 3.80 2.77 0.00 0.00 0.00 -1.26 -4.34 105.19 106.17 1nni n GLY 106 Ca 0.03 -0.36 0.00 0.00 0.00 0.00 0.00 46.02 45.68 1nni n GLY 106 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1nni n GLY 107 N 0.48 0.51 6.21 -0.02 0.00 -1.26 -4.71 105.19 106.40 1nni n GLY 107 Ca 0.11 -2.00 0.00 0.00 0.00 0.00 0.00 46.02 44.13 1nni n GLY 107 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1nni n GLY 108 N 0.00 1.97 1.62 -0.02 0.00 -1.26 -1.48 105.19 106.03 1nni n GLY 108 Ca 0.00 -0.05 0.08 0.00 0.00 0.00 0.00 46.02 46.05 1nni n GLY 108 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1nni n LYS 109 N 12.41 4.24 -2.55 1.61 4.76 -1.26 -4.99 118.16 132.37 1nni n LYS 109 Ca 0.00 -3.02 -0.33 0.00 -2.87 0.00 0.00 58.31 52.09 1nni n LYS 109 Cb 0.00 -2.08 -0.04 0.00 -1.84 0.00 0.00 35.03 31.07 1nni n LYS 109 CO 0.00 0.00 0.00 0.20 -1.37 0.00 0.00 177.40 176.23 1nni s GLY 110 N -1.02 2.41 0.00 0.72 0.00 -0.55 -4.27 107.32 104.62 1nni s GLY 110 Ca 0.51 0.51 0.00 0.00 0.00 0.00 0.00 44.72 45.74 1nni s GLY 110 CO 0.17 0.81 0.00 0.61 0.00 0.00 0.00 173.10 174.69 1nni n GLY 111 N -0.51 1.05 0.16 0.20 0.00 -1.26 -4.68 105.19 100.15 1nni n GLY 111 Ca 0.08 0.00 -0.16 0.00 0.00 0.00 0.00 46.02 45.95 1nni n GLY 111 CO 0.00 0.00 0.00 -2.22 0.00 0.00 0.00 173.32 171.10 1nni h ILE 112 N 0.00 1.37 -0.11 -0.61 1.08 -1.99 -2.74 117.51 114.51 1nni h ILE 112 Ca 0.00 -2.47 -0.07 0.00 -0.39 0.00 0.00 64.86 61.93 1nni h ILE 112 Cb 0.00 2.50 -0.01 0.00 -3.07 0.00 0.00 36.82 36.23 1nni h ILE 112 CO 0.00 0.74 -0.26 0.78 -0.69 0.00 0.00 178.15 178.72 1nni h ASN 113 N 0.25 0.19 -0.55 1.72 2.35 -1.89 0.24 115.58 117.88 1nni h ASN 113 Ca -0.11 -0.05 -0.08 0.00 -0.55 0.00 0.00 56.30 55.51 1nni h ASN 113 Cb 1.68 -0.05 -0.02 0.00 0.05 0.00 0.00 38.32 39.97 1nni h ASN 113 CO 0.18 0.46 0.06 0.00 -1.65 0.00 0.00 177.43 176.48 1nni h ALA 114 N 1.56 1.00 -0.15 -0.83 0.00 -1.72 -1.34 119.26 117.79 1nni h ALA 114 Ca 0.03 -0.27 -0.07 0.00 0.00 0.00 0.00 54.91 54.60 1nni h ALA 114 Cb 0.56 -0.23 -0.00 0.00 0.00 0.00 0.00 17.79 18.12 1nni h ALA 114 CO 0.04 0.63 -0.17 -0.07 0.00 0.00 0.00 179.25 179.67 1nni h LEU 115 N 0.91 0.41 -1.10 0.00 3.38 -0.90 -3.11 115.31 114.90 1nni h LEU 115 Ca 0.18 -0.50 -0.03 0.00 0.09 0.00 0.00 57.88 57.62 1nni h LEU 115 Cb 0.44 -0.11 -0.03 0.00 0.09 0.00 0.00 40.66 41.05 1nni h LEU 115 CO 0.02 0.82 0.30 0.78 0.09 0.00 0.00 178.44 180.45 1nni h ASN 116 N -0.00 0.85 0.00 -0.43 2.35 -0.50 0.18 115.58 118.03 1nni h ASN 116 Ca 0.02 -0.10 0.00 0.00 -0.55 0.00 0.00 56.30 55.67 1nni h ASN 116 Cb 0.72 -0.22 0.00 0.00 0.05 0.00 0.00 38.32 38.87 1nni h ASN 116 CO 0.04 0.73 0.00 -3.20 -1.65 0.00 0.00 177.43 173.35 1nni n ASN 117 N -4.33 0.00 0.00 5.81 4.05 -0.51 -0.61 115.26 119.66 1nni n ASN 117 Ca 0.06 0.00 0.00 0.00 0.45 0.00 0.00 54.58 55.09 1nni n ASN 117 Cb 0.14 0.00 0.00 0.00 1.23 0.00 0.00 39.78 41.15 1nni n ASN 117 CO 0.00 0.00 0.00 -1.14 -3.05 0.00 0.00 177.26 173.07 1nni n ARG 119 N -0.13 0.00 -0.09 1.20 0.63 0.63 -1.25 116.66 117.65 1nni n ARG 119 Ca 0.00 0.00 -0.11 0.00 -0.92 0.00 0.00 57.85 56.82 1nni n ARG 119 Cb 0.00 0.00 -0.04 0.00 0.45 0.00 0.00 32.46 32.87 1nni n ARG 119 CO 0.00 0.00 0.00 1.15 -2.51 0.00 0.00 177.63 176.27 1nni h THR 120 N 0.00 1.25 0.00 5.15 2.02 -1.10 -1.98 112.91 118.25 1nni h THR 120 Ca 0.00 -0.87 0.00 0.00 0.77 0.00 0.00 66.41 66.31 1nni h THR 120 Cb 0.00 1.30 0.00 0.00 -1.74 0.00 0.00 68.15 67.71 1nni h THR 120 CO 0.00 0.27 0.00 0.52 0.37 0.00 0.00 175.52 176.68 1nni n VAL 121 N -4.64 0.11 0.00 3.16 0.31 -0.38 -1.30 118.33 115.59 1nni n VAL 121 Ca -0.03 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.30 1nni n VAL 121 Cb 0.23 -0.43 0.00 0.00 -0.91 0.00 0.00 33.84 32.73 1nni n VAL 121 CO 0.00 0.00 0.00 -1.14 -1.32 0.00 0.00 176.83 174.37 1nni n ARG 123 N 0.79 0.00 0.03 5.55 0.63 -0.74 -2.18 116.66 120.72 1nni n ARG 123 Ca 0.00 0.00 -0.05 0.00 -0.92 0.00 0.00 57.85 56.88 1nni n ARG 123 Cb 0.06 0.00 0.15 0.00 0.45 0.00 0.00 32.46 33.12 1nni n ARG 123 CO 0.00 0.00 0.00 0.78 -2.51 0.00 0.00 177.63 175.90 1nni h GLY 124 N 0.00 0.49 -3.31 5.14 0.00 -1.46 -2.65 103.07 101.28 1nni h GLY 124 Ca 0.00 -0.48 0.00 0.00 0.00 0.00 0.00 47.33 46.85 1nni h GLY 124 CO 0.00 0.44 0.00 3.33 0.00 0.00 0.00 176.54 180.31 1nni n VAL 125 N -4.03 2.40 -2.00 4.60 0.24 -0.93 -4.86 118.33 113.76 1nni n VAL 125 Ca -0.02 -1.27 -0.17 0.00 -2.04 0.00 0.00 64.34 60.85 1nni n VAL 125 Cb 0.50 -0.20 -0.03 0.00 -1.47 0.00 0.00 33.84 32.64 1nni n VAL 125 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 1nni n TYR 126 N 0.71 -0.49 -1.51 6.34 9.36 -1.00 -3.48 117.16 127.08 1nni n TYR 126 Ca 0.26 0.00 -0.30 0.00 3.32 0.00 0.00 57.90 61.18 1nni n TYR 126 Cb 1.08 -3.20 0.20 0.00 -0.63 0.00 0.00 39.34 36.79 1nni n TYR 126 CO 0.00 0.00 0.00 0.00 0.22 0.00 0.00 176.86 177.08 1nni s ALA 127 N -2.75 1.47 -0.73 2.98 0.00 -1.26 -0.81 121.76 120.66 1nni s ALA 127 Ca 0.00 -1.02 0.04 0.00 0.00 0.00 0.00 51.96 50.99 1nni s ALA 127 Cb 0.00 -2.85 0.18 0.00 0.00 0.00 0.00 23.12 20.45 1nni s ALA 127 CO 0.00 -2.93 0.56 -1.71 0.00 0.00 0.00 175.76 171.68 1nni n ASN 128 N -4.20 3.25 -4.68 0.00 5.15 -0.08 -4.66 115.26 110.04 1nni n ASN 128 Ca 0.13 -3.23 -0.42 0.00 -0.60 0.00 0.00 54.58 50.46 1nni n ASN 128 Cb 0.59 -0.79 -0.03 0.00 -0.53 0.00 0.00 39.78 39.03 1nni n ASN 128 CO 0.00 0.00 0.00 -0.69 1.40 0.00 0.00 177.26 177.97 1nni s VAL 129 N -1.57 3.33 0.78 3.44 1.01 -1.26 -2.86 120.40 123.26 1nni s VAL 129 Ca 0.27 0.62 -0.11 0.00 0.00 0.00 0.00 61.98 62.75 1nni s VAL 129 Cb -0.03 -3.40 0.06 0.00 0.00 0.00 0.00 36.38 33.02 1nni s VAL 129 CO -0.15 -0.03 1.11 0.27 0.00 0.00 0.00 175.10 176.30 1nni s ILE 130 N 3.28 3.09 0.03 2.22 -4.36 -0.66 -4.94 121.20 119.86 1nni s ILE 130 Ca 0.73 0.38 -0.30 0.00 -0.26 0.00 0.00 60.65 61.21 1nni s ILE 130 Cb -0.36 -2.81 -0.17 0.00 1.25 0.00 0.00 42.46 40.37 1nni s ILE 130 CO 0.31 -0.43 1.27 -0.65 0.24 0.00 0.00 174.94 175.67 1nni h PRO 131 N -1.04 -0.95 -6.59 0.37 0.11 -1.94 -3.44 132.00 118.53 1nni h PRO 131 Ca -0.44 0.06 -0.58 0.00 0.11 0.00 0.00 66.00 65.16 1nni h PRO 131 Cb 1.24 0.22 0.07 0.00 0.11 0.00 0.00 31.00 32.64 1nni h PRO 131 CO 0.50 -0.61 0.71 1.17 -0.21 0.00 0.00 178.00 179.56 1nni n LYS 132 N -5.44 2.16 -4.23 1.05 4.81 -1.26 -4.97 118.16 110.28 1nni n LYS 132 Ca -0.13 0.77 -0.13 0.00 -0.87 0.00 0.00 58.31 57.95 1nni n LYS 132 Cb 0.40 -2.48 -0.10 0.00 0.02 0.00 0.00 35.03 32.87 1nni n LYS 132 CO 0.00 0.00 0.00 1.14 1.17 0.00 0.00 177.40 179.71 1nni s GLN 133 N 0.01 1.27 -0.12 1.64 -2.07 -1.26 -4.60 119.66 114.53 1nni s GLN 133 Ca 0.71 -1.68 -0.22 0.00 -1.82 0.00 0.00 55.36 52.36 1nni s GLN 133 Cb -0.64 0.17 0.05 0.00 -1.09 0.00 0.00 33.01 31.50 1nni s GLN 133 CO 0.46 -0.39 0.54 -1.17 -1.32 0.00 0.00 175.29 173.41 1nni s LEU 134 N -3.20 -0.06 -0.09 2.60 2.96 -1.19 -5.05 118.68 114.65 1nni s LEU 134 Ca 0.39 0.77 0.04 0.00 -0.22 0.00 0.00 54.13 55.11 1nni s LEU 134 Cb 0.07 1.95 0.00 0.00 0.50 0.00 0.00 46.19 48.71 1nni s LEU 134 CO 0.13 -0.37 -0.21 -0.69 -1.32 0.00 0.00 176.35 173.89 1nni s VAL 135 N -0.50 1.79 -0.18 1.68 1.01 -1.26 -1.50 120.40 121.45 1nni s VAL 135 Ca -0.06 -0.87 -0.03 0.00 0.00 0.00 0.00 61.98 61.02 1nni s VAL 135 Cb -0.03 -1.56 -0.02 0.00 0.00 0.00 0.00 36.38 34.77 1nni s VAL 135 CO 0.04 0.50 -0.05 -0.76 0.00 0.00 0.00 175.10 174.83 1nni s LEU 136 N 0.38 3.03 0.63 3.92 1.43 -0.05 -4.97 118.68 123.06 1nni s LEU 136 Ca -0.16 -0.26 0.06 0.00 -1.03 0.00 0.00 54.13 52.73 1nni s LEU 136 Cb -0.17 -1.74 0.11 0.00 0.03 0.00 0.00 46.19 44.42 1nni s LEU 136 CO 0.07 0.10 0.87 -1.81 0.23 0.00 0.00 176.35 175.81 1nni s ASP 137 N 0.78 4.79 0.51 2.29 1.01 -1.26 -2.21 116.67 122.58 1nni s ASP 137 Ca -0.02 -0.69 0.19 0.00 0.71 0.00 0.00 52.55 52.75 1nni s ASP 137 Cb -0.15 0.22 1.31 0.00 1.01 0.00 0.00 42.92 45.31 1nni s ASP 137 CO 0.02 -1.56 2.12 -0.65 0.21 0.00 0.00 175.17 175.30 1nni h PRO 138 N -0.10 0.00 0.00 8.23 0.11 -1.84 -1.28 132.00 137.12 1nni h PRO 138 Ca -0.32 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.79 1nni h PRO 138 Cb 1.28 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.39 1nni h PRO 138 CO 0.40 0.06 0.00 1.55 -0.21 0.00 0.00 178.00 179.80 1nni n VAL 139 N -4.27 0.95 0.84 3.15 3.14 -1.26 -1.99 118.33 118.90 1nni n VAL 139 Ca -0.03 0.24 0.10 0.00 -2.96 0.00 0.00 64.34 61.69 1nni n VAL 139 Cb 0.15 -1.00 0.08 0.00 -1.06 0.00 0.00 33.84 32.00 1nni n VAL 139 CO 0.00 0.00 0.00 1.41 -6.46 0.00 0.00 176.83 171.78 1nni n HIS 140 N -1.45 0.00 -4.70 1.45 8.25 -0.48 -4.79 115.22 113.49 1nni n HIS 140 Ca 0.04 0.00 -0.30 0.00 -0.26 0.00 0.00 57.72 57.20 1nni n HIS 140 Cb 0.15 0.00 -0.17 0.00 1.12 0.00 0.00 29.99 31.09 1nni n HIS 140 CO 0.00 0.00 0.00 0.42 0.64 0.00 0.00 176.34 177.40 1nni s ILE 141 N -1.71 1.75 -1.02 1.59 -1.09 -0.84 -1.06 121.20 118.82 1nni s ILE 141 Ca 0.23 -0.81 -0.12 0.00 -2.23 0.00 0.00 60.65 57.73 1nni s ILE 141 Cb 0.17 -1.56 0.24 0.00 -1.58 0.00 0.00 42.46 39.73 1nni s ILE 141 CO 0.27 0.49 1.02 -0.62 -1.23 0.00 0.00 174.94 174.87 1nni s ASP 142 N 0.76 7.09 0.13 3.58 -1.08 -0.03 -4.79 116.67 122.33 1nni s ASP 142 Ca -0.10 -3.18 -0.26 0.00 -0.52 0.00 0.00 52.55 48.49 1nni s ASP 142 Cb -0.16 -2.23 -0.04 0.00 -1.46 0.00 0.00 42.92 39.03 1nni s ASP 142 CO 0.01 -0.45 1.62 0.58 0.52 0.00 0.00 175.17 177.45 1nni h VAL 143 N 4.22 0.36 -1.24 1.11 2.07 -1.92 -1.40 116.25 119.44 1nni h VAL 143 Ca 0.16 0.00 0.36 0.00 0.82 0.00 0.00 66.70 68.04 1nni h VAL 143 Cb 0.94 0.36 -0.05 0.00 -1.52 0.00 0.00 31.29 31.01 1nni h VAL 143 CO 0.95 0.00 0.89 -0.33 0.02 0.00 0.00 177.57 179.09 1nni h GLU 144 N -0.41 0.02 -0.35 1.57 5.08 -1.94 0.37 114.58 118.93 1nni h GLU 144 Ca 0.07 -0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.43 1nni h GLU 144 Cb 0.52 -0.01 0.00 0.00 0.50 0.00 0.00 28.75 29.76 1nni h GLU 144 CO -0.27 0.02 0.00 0.09 -1.00 0.00 0.00 179.01 177.85 1nni n ASN 145 N -4.19 3.89 -4.07 1.42 3.02 -0.66 -4.99 115.26 109.67 1nni n ASN 145 Ca 0.27 -2.69 -0.33 0.00 -0.03 0.00 0.00 54.58 51.80 1nni n ASN 145 Cb 1.29 -0.48 -0.05 0.00 -0.61 0.00 0.00 39.78 39.93 1nni n ASN 145 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1nni n ALA 146 N 0.02 -2.09 -3.62 5.41 0.00 0.13 -4.88 120.51 115.48 1nni n ALA 146 Ca 0.20 -0.43 0.03 0.00 0.00 0.00 0.00 53.44 53.24 1nni n ALA 146 Cb 0.80 -1.29 0.02 0.00 0.00 0.00 0.00 19.45 18.98 1nni n ALA 146 CO 0.00 0.00 0.00 -2.37 0.00 0.00 0.00 177.50 175.13 1nni n THR 147 N -4.30 0.00 -3.70 0.00 5.66 -1.12 -4.98 114.28 105.83 1nni n THR 147 Ca -0.21 -0.53 -0.24 0.00 -3.05 0.00 0.00 64.05 60.01 1nni n THR 147 Cb 0.56 0.63 -0.02 0.00 -1.55 0.00 0.00 70.33 69.95 1nni n THR 147 CO 0.00 0.00 0.00 0.68 -3.05 0.00 0.00 175.07 172.70 1nni s VAL 148 N -2.25 5.20 0.83 1.08 -7.23 -1.26 -0.85 120.40 115.92 1nni s VAL 148 Ca 0.15 -0.61 -0.11 0.00 -1.81 0.00 0.00 61.98 59.59 1nni s VAL 148 Cb -0.03 -3.81 0.09 0.00 0.56 0.00 0.00 36.38 33.19 1nni s VAL 148 CO 0.06 -0.33 1.09 0.00 -0.31 0.00 0.00 175.10 175.60 1nni s ALA 149 N -2.03 1.94 0.20 1.32 0.00 -0.22 -4.66 121.76 118.30 1nni s ALA 149 Ca 0.37 0.04 -0.04 0.00 0.00 0.00 0.00 51.96 52.34 1nni s ALA 149 Cb -0.10 -3.21 0.14 0.00 0.00 0.00 0.00 23.12 19.95 1nni s ALA 149 CO 0.31 -2.02 1.56 0.93 0.00 0.00 0.00 175.76 176.54 1nni h GLU 150 N -1.30 0.66 -0.12 0.00 4.39 -1.93 -3.15 114.58 113.12 1nni h GLU 150 Ca -0.47 -0.34 0.04 0.00 0.34 0.00 0.00 59.36 58.92 1nni h GLU 150 Cb 1.26 0.01 -0.00 0.00 -0.10 0.00 0.00 28.75 29.91 1nni h GLU 150 CO 0.54 0.95 0.25 -2.95 -1.16 0.00 0.00 179.01 176.64 1nni h ASN 151 N 0.54 0.00 0.00 1.42 -0.00 -1.92 -2.48 115.58 113.13 1nni h ASN 151 Ca 0.04 0.00 0.00 0.00 -0.00 0.00 0.00 56.30 56.34 1nni h ASN 151 Cb 0.94 0.00 0.00 0.00 -0.00 0.00 0.00 38.32 39.26 1nni h ASN 151 CO 0.09 0.00 -1.15 0.00 -0.00 0.00 0.00 177.43 176.36 1nni n ILE 152 N -3.37 0.00 -0.16 6.14 0.13 -1.19 -4.65 119.36 116.27 1nni n ILE 152 Ca 0.00 -0.24 -0.02 0.00 -1.10 0.00 0.00 62.75 61.40 1nni n ILE 152 Cb 0.34 0.62 0.07 0.00 -0.84 0.00 0.00 39.64 39.83 1nni n ILE 152 CO 0.00 0.00 0.00 0.11 2.80 0.00 0.00 176.55 179.46 1nni h LYS 153 N 0.00 0.21 -1.00 9.51 1.57 -1.49 -1.46 116.57 123.91 1nni h LYS 153 Ca 0.00 -0.01 0.07 0.00 -1.87 0.00 0.00 60.65 58.83 1nni h LYS 153 Cb 0.52 -0.05 -0.07 0.00 0.08 0.00 0.00 32.23 32.71 1nni h LYS 153 CO 0.00 0.14 0.64 1.49 -0.57 0.00 0.00 179.45 181.15 1nni h GLU 154 N 0.21 1.13 -0.33 3.15 4.57 -1.83 -1.25 114.58 120.24 1nni h GLU 154 Ca 0.25 -0.07 -0.01 0.00 -1.18 0.00 0.00 59.36 58.36 1nni h GLU 154 Cb 0.35 -0.25 -0.02 0.00 -0.16 0.00 0.00 28.75 28.67 1nni h GLU 154 CO -0.34 0.75 0.18 0.77 -1.18 0.00 0.00 179.01 179.18 1nni h SER 155 N 1.16 0.41 -0.24 1.04 0.02 -1.57 -1.74 113.55 112.63 1nni h SER 155 Ca 0.43 -0.09 -0.04 0.00 -0.84 0.00 0.00 61.79 61.25 1nni h SER 155 Cb 0.17 -0.10 -0.02 0.00 0.14 0.00 0.00 62.40 62.59 1nni h SER 155 CO -0.17 0.38 0.05 0.40 -1.14 0.00 0.00 176.83 176.35 1nni h ILE 156 N 0.41 1.17 0.07 3.27 2.04 -0.84 -0.76 117.51 122.88 1nni h ILE 156 Ca 0.12 -0.65 -0.00 0.00 1.00 0.00 0.00 64.86 65.32 1nni h ILE 156 Cb 0.06 0.87 0.00 0.00 -0.74 0.00 0.00 36.82 37.01 1nni h ILE 156 CO -0.02 0.23 -0.04 0.50 0.00 0.00 0.00 178.15 178.82 1nni h LYS 157 N 0.49 -0.10 -0.51 2.37 3.64 -0.79 -0.98 116.57 120.69 1nni h LYS 157 Ca 0.11 0.01 -0.01 0.00 -1.27 0.00 0.00 60.65 59.49 1nni h LYS 157 Cb 0.24 0.02 -0.03 0.00 -0.41 0.00 0.00 32.23 32.06 1nni h LYS 157 CO 0.00 0.08 0.28 0.93 -2.27 0.00 0.00 179.45 178.47 1nni h GLU 158 N -0.26 0.69 0.68 1.90 5.08 -0.98 0.74 114.58 122.44 1nni h GLU 158 Ca -0.01 -0.07 -0.03 0.00 -1.00 0.00 0.00 59.36 58.25 1nni h GLU 158 Cb 0.22 -0.14 0.01 0.00 0.50 0.00 0.00 28.75 29.34 1nni h GLU 158 CO 0.02 0.51 -0.33 1.25 -1.00 0.00 0.00 179.01 179.46 1nni h LEU 159 N 0.70 -0.77 -2.23 1.33 5.85 -0.85 -1.36 115.31 117.98 1nni h LEU 159 Ca 0.18 0.03 0.05 0.00 0.84 0.00 0.00 57.88 58.98 1nni h LEU 159 Cb 0.02 0.20 -0.01 0.00 0.37 0.00 0.00 40.66 41.24 1nni h LEU 159 CO -0.03 -0.46 0.19 0.58 -0.34 0.00 0.00 178.44 178.38 1nni h VAL 160 N -1.09 0.49 0.01 1.05 2.07 -0.98 -0.54 116.25 117.26 1nni h VAL 160 Ca -0.09 0.00 -0.20 0.00 0.82 0.00 0.00 66.70 67.23 1nni h VAL 160 Cb 0.70 0.85 -0.01 0.00 -1.52 0.00 0.00 31.29 31.30 1nni h VAL 160 CO 0.15 0.00 -0.90 -0.33 0.02 0.00 0.00 177.57 176.52 1nni h GLU 161 N 0.00 0.20 0.00 1.57 5.08 -0.65 -1.71 114.58 119.06 1nni h GLU 161 Ca 0.08 -0.22 -0.18 0.00 -1.00 0.00 0.00 59.36 58.04 1nni h GLU 161 Cb 0.47 0.07 -0.02 0.00 0.50 0.00 0.00 28.75 29.76 1nni h GLU 161 CO -0.00 0.97 -0.85 1.49 -1.00 0.00 0.00 179.01 179.62 1nni h GLU 162 N 0.10 0.05 0.80 2.33 4.81 0.02 -3.25 114.58 119.46 1nni h GLU 162 Ca -0.05 -0.06 -0.04 0.00 -0.13 0.00 0.00 59.36 59.08 1nni h GLU 162 Cb 1.54 0.02 0.01 0.00 0.63 0.00 0.00 28.75 30.94 1nni h GLU 162 CO 0.14 0.87 -0.39 1.25 -0.73 0.00 0.00 179.01 180.15 1nni h LEU 163 N 0.03 -0.91 -2.15 1.64 5.85 -1.19 -2.27 115.31 116.30 1nni h LEU 163 Ca -0.02 0.02 0.00 0.00 0.84 0.00 0.00 57.88 58.72 1nni h LEU 163 Cb 1.49 0.24 0.00 0.00 0.37 0.00 0.00 40.66 42.75 1nni h LEU 163 CO 0.12 -0.56 0.00 -1.20 -0.34 0.00 0.00 178.44 176.46 1nni n SER 164 N -5.50 0.00 0.00 1.25 7.64 -0.65 -0.29 113.62 116.07 1nni n SER 164 Ca -0.14 0.00 0.00 0.00 1.01 0.00 0.00 58.87 59.74 1nni n SER 164 Cb 0.43 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.63 1nni n SER 164 CO 0.00 0.00 0.00 0.49 -3.01 0.00 0.00 175.04 172.52 1nni n PHE 166 N 0.59 0.00 0.20 1.43 3.01 -0.86 -1.08 117.46 120.76 1nni n PHE 166 Ca 0.00 0.00 0.17 0.00 1.01 0.00 0.00 57.45 58.63 1nni n PHE 166 Cb 0.00 0.00 0.83 0.00 -0.01 0.00 0.00 39.48 40.30 1nni n PHE 166 CO 0.00 0.00 0.00 0.00 1.01 0.00 0.00 176.76 177.77 1nni h ALA 167 N 0.00 1.80 0.00 4.37 0.00 -0.91 -1.71 119.26 122.81 1nni h ALA 167 Ca 0.00 -0.01 -0.17 0.00 0.00 0.00 0.00 54.91 54.74 1nni h ALA 167 Cb 0.00 0.01 -0.03 0.00 0.00 0.00 0.00 17.79 17.78 1nni h ALA 167 CO 0.00 -0.32 -0.92 0.87 0.00 0.00 0.00 179.25 178.88 1nni h LYS 168 N 0.00 0.00 -0.28 0.00 1.57 -1.34 -3.33 116.57 113.20 1nni h LYS 168 Ca 0.09 0.00 0.08 0.00 -1.87 0.00 0.00 60.65 58.95 1nni h LYS 168 Cb 0.53 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 32.83 1nni h LYS 168 CO -0.00 1.00 0.44 0.00 -0.57 0.00 0.00 179.45 180.32 1nni h ALA 169 N -0.36 1.87 -0.80 3.86 0.00 -1.71 -1.40 119.26 120.72 1nni h ALA 169 Ca -0.25 -0.01 0.16 0.00 0.00 0.00 0.00 54.91 54.81 1nni h ALA 169 Cb 1.22 0.02 -0.15 0.00 0.00 0.00 0.00 17.79 18.88 1nni h ALA 169 CO -0.15 -0.59 -0.19 0.78 0.00 0.00 0.00 179.25 179.11 1nni h GLY 170 N 0.00 0.60 -1.60 0.00 0.00 -1.43 -3.51 103.07 97.13 1nni h GLY 170 Ca 0.13 0.25 0.00 0.00 0.00 0.00 0.00 47.33 47.72 1nni h GLY 170 CO -0.00 -0.31 0.00 1.16 0.00 0.00 0.00 176.54 177.39