#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2erm n LYS 23 N 0.00 0.04 -3.32 -3.48 3.00 -1.26 -4.72 118.16 108.41 2erm n LYS 23 Ca 0.00 -0.81 -0.22 0.00 -0.00 0.00 0.00 58.31 57.27 2erm n LYS 23 Cb 0.00 -2.40 -0.09 0.00 0.00 0.00 0.00 35.03 32.54 2erm n LYS 23 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 177.40 175.81 2erm s LYS 24 N 6.62 0.79 0.82 1.64 -2.85 -1.26 -5.15 119.74 120.35 2erm s LYS 24 Ca 0.40 -1.56 -0.08 0.00 -1.00 0.00 0.00 55.97 53.73 2erm s LYS 24 Cb -0.02 -1.08 0.15 0.00 -2.06 0.00 0.00 37.83 34.82 2erm s LYS 24 CO 0.10 -1.30 1.13 -1.25 0.10 0.00 0.00 175.35 174.13 2erm s PRO 25 N 0.66 1.35 -0.04 1.78 0.04 -1.26 -4.44 135.00 133.09 2erm s PRO 25 Ca 0.26 -0.68 0.03 0.00 0.04 0.00 0.00 61.00 60.65 2erm s PRO 25 Cb -0.06 -2.11 0.00 0.00 0.04 0.00 0.00 34.50 32.37 2erm s PRO 25 CO -0.10 -1.80 -0.12 0.15 0.04 0.00 0.00 177.00 175.16 2erm s LYS 26 N -5.46 1.33 -0.15 4.56 1.02 0.18 -0.33 119.74 120.88 2erm s LYS 26 Ca 0.68 -0.42 -0.06 0.00 0.02 0.00 0.00 55.97 56.19 2erm s LYS 26 Cb -0.06 -1.18 -0.04 0.00 -0.52 0.00 0.00 37.83 36.03 2erm s LYS 26 CO 0.48 0.15 0.07 -0.51 -0.92 0.00 0.00 175.35 174.61 2erm s LEU 27 N 0.20 3.90 -0.40 3.17 2.01 -0.17 -3.79 118.68 123.60 2erm s LEU 27 Ca -0.05 0.19 -0.10 0.00 0.01 0.00 0.00 54.13 54.18 2erm s LEU 27 Cb -0.10 -1.96 0.06 0.00 0.01 0.00 0.00 46.19 44.19 2erm s LEU 27 CO 0.01 0.28 0.24 -0.76 1.01 0.00 0.00 176.35 177.13 2erm s LEU 28 N -0.24 4.97 -0.59 1.79 1.43 -1.26 -0.42 118.68 124.35 2erm s LEU 28 Ca 0.08 -1.26 -0.17 0.00 -1.03 0.00 0.00 54.13 51.75 2erm s LEU 28 Cb -0.12 -2.01 0.13 0.00 0.03 0.00 0.00 46.19 44.22 2erm s LEU 28 CO 0.01 -0.47 0.60 -0.47 0.23 0.00 0.00 176.35 176.25 2erm s TYR 29 N 1.49 3.23 -0.27 0.29 5.04 0.06 -0.81 117.35 126.38 2erm s TYR 29 Ca 0.02 -1.27 -0.28 0.00 -2.44 0.00 0.00 57.07 53.10 2erm s TYR 29 Cb -0.21 -3.87 -0.04 0.00 0.35 0.00 0.00 41.96 38.18 2erm s TYR 29 CO 0.04 -1.10 2.09 0.00 -1.34 0.00 0.00 175.55 175.24 2erm h SER 31 N 14.54 0.11 -0.76 0.00 4.64 -1.31 0.18 113.55 130.95 2erm h SER 31 Ca -0.38 0.16 0.14 0.00 -0.47 0.00 0.00 61.79 61.24 2erm h SER 31 Cb 1.22 0.20 -0.13 0.00 -0.31 0.00 0.00 62.40 63.37 2erm h SER 31 CO 0.99 -0.06 -0.24 -3.20 -0.87 0.00 0.00 176.83 173.45 2erm n ASN 32 N -5.14 -0.37 -2.68 4.97 5.15 -1.26 -0.83 115.26 115.09 2erm n ASN 32 Ca 0.19 1.32 -0.06 0.00 -0.60 0.00 0.00 54.58 55.43 2erm n ASN 32 Cb 0.59 -0.35 0.04 0.00 -0.53 0.00 0.00 39.78 39.52 2erm n ASN 32 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 2erm n GLY 33 N -1.43 2.53 4.29 8.20 0.00 -1.24 -4.88 105.19 112.67 2erm n GLY 33 Ca 0.10 -1.39 -0.37 0.00 0.00 0.00 0.00 46.02 44.37 2erm n GLY 33 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2erm n GLY 34 N -0.52 -0.40 3.61 -0.02 0.00 -0.01 -4.52 105.19 103.33 2erm n GLY 34 Ca 0.14 0.12 -0.42 0.00 0.00 0.00 0.00 46.02 45.86 2erm n GLY 34 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 2erm s HIS 35 N -3.39 3.17 -0.09 1.61 3.76 0.55 -4.25 115.29 116.64 2erm s HIS 35 Ca 0.67 0.83 -0.31 0.00 -0.15 0.00 0.00 55.06 56.10 2erm s HIS 35 Cb -0.37 -3.35 -0.08 0.00 1.11 0.00 0.00 32.58 29.88 2erm s HIS 35 CO 0.95 -0.64 2.05 1.19 -0.85 0.00 0.00 174.74 177.44 2erm n PHE 36 N 6.38 2.25 -1.85 1.40 3.01 0.11 -0.02 117.46 128.75 2erm n PHE 36 Ca 0.05 -0.19 -0.42 0.00 1.01 0.00 0.00 57.45 57.89 2erm n PHE 36 Cb 0.48 -2.74 -0.03 0.00 -0.01 0.00 0.00 39.48 37.18 2erm n PHE 36 CO 0.00 0.00 0.00 -1.17 1.01 0.00 0.00 176.76 176.60 2erm s LEU 37 N 5.79 4.37 -0.16 4.37 2.96 0.01 -1.75 118.68 134.27 2erm s LEU 37 Ca 0.95 2.44 0.01 0.00 -0.22 0.00 0.00 54.13 57.31 2erm s LEU 37 Cb -0.48 -3.53 0.02 0.00 0.50 0.00 0.00 46.19 42.70 2erm s LEU 37 CO 0.42 -0.99 -0.18 -0.60 -1.32 0.00 0.00 176.35 173.68 2erm s ARG 38 N 4.25 2.71 -0.16 1.98 3.52 0.43 -4.39 118.95 127.29 2erm s ARG 38 Ca 0.81 -0.72 -0.01 0.00 -0.13 0.00 0.00 55.73 55.68 2erm s ARG 38 Cb -0.38 -2.37 -0.01 0.00 -1.56 0.00 0.00 34.95 30.64 2erm s ARG 38 CO 0.35 -0.20 -0.12 -1.50 -0.81 0.00 0.00 175.30 173.02 2erm s ILE 39 N 1.32 2.95 -0.06 4.11 2.07 0.02 -0.74 121.20 130.87 2erm s ILE 39 Ca 0.04 -0.67 -0.04 0.00 -1.41 0.00 0.00 60.65 58.57 2erm s ILE 39 Cb -0.13 -2.27 -0.04 0.00 0.13 0.00 0.00 42.46 40.15 2erm s ILE 39 CO -0.11 0.50 0.13 -0.76 -1.91 0.00 0.00 174.94 172.78 2erm s LEU 40 N 0.85 4.21 0.19 8.50 1.43 0.16 -4.76 118.68 129.27 2erm s LEU 40 Ca -0.04 0.34 -0.11 0.00 -1.03 0.00 0.00 54.13 53.30 2erm s LEU 40 Cb -0.15 -2.23 0.25 0.00 0.03 0.00 0.00 46.19 44.09 2erm s LEU 40 CO 0.00 0.34 1.21 -2.65 0.23 0.00 0.00 176.35 175.49 2erm n PRO 41 N 1.56 -0.14 -0.23 1.29 -0.02 -1.26 -0.58 135.00 135.61 2erm n PRO 41 Ca -0.16 1.21 0.27 0.00 -2.02 0.00 0.00 63.50 62.80 2erm n PRO 41 Cb 0.54 -1.80 0.67 0.00 -0.02 0.00 0.00 33.50 32.89 2erm n PRO 41 CO 0.00 0.00 0.00 0.38 1.98 0.00 0.00 175.50 177.86 2erm h ASP 42 N 0.00 0.12 0.00 2.55 2.03 -1.99 -3.46 116.42 115.68 2erm h ASP 42 Ca 0.31 0.02 0.00 0.00 -0.73 0.00 0.00 57.03 56.63 2erm h ASP 42 Cb 0.51 -0.00 0.00 0.00 -0.83 0.00 0.00 39.33 39.00 2erm h ASP 42 CO -0.79 0.04 0.00 0.61 -1.03 0.00 0.00 179.24 178.07 2erm n GLY 43 N -1.66 1.19 3.68 7.15 0.00 0.25 -5.01 105.19 110.80 2erm n GLY 43 Ca 0.21 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.93 2erm n GLY 43 CO 0.00 0.00 0.00 -1.08 0.00 0.00 0.00 173.32 172.24 2erm s THR 44 N -0.57 1.79 0.05 2.61 -1.32 -1.24 0.06 115.64 117.02 2erm s THR 44 Ca 0.00 0.00 -0.13 0.00 -1.21 0.00 0.00 61.69 60.35 2erm s THR 44 Cb 0.00 -2.60 0.02 0.00 -1.51 0.00 0.00 72.50 68.41 2erm s THR 44 CO 0.00 0.00 0.29 0.54 -2.21 0.00 0.00 174.62 173.24 2erm s VAL 45 N -3.16 0.09 0.00 5.08 0.11 -1.26 -0.66 120.40 120.60 2erm s VAL 45 Ca 0.69 -0.74 0.00 0.00 -2.93 0.00 0.00 61.98 59.00 2erm s VAL 45 Cb -0.11 -0.99 0.00 0.00 -1.53 0.00 0.00 36.38 33.74 2erm s VAL 45 CO 0.56 -0.41 0.00 -0.90 -3.33 0.00 0.00 175.10 171.02 2erm n ASP 46 N 0.46 0.00 -4.20 3.54 5.68 0.08 -4.46 116.55 117.65 2erm n ASP 46 Ca -0.18 -1.00 -0.33 0.00 -0.50 0.00 0.00 54.79 52.79 2erm n ASP 46 Cb 0.60 0.00 -0.16 0.00 -1.14 0.00 0.00 41.12 40.42 2erm n ASP 46 CO 0.00 0.00 0.00 -0.83 -1.33 0.00 0.00 177.20 175.04 2erm s GLY 47 N -1.50 1.40 -0.18 6.12 0.00 0.99 -0.43 107.32 113.72 2erm s GLY 47 Ca 0.00 -1.08 -0.03 0.00 0.00 0.00 0.00 44.72 43.61 2erm s GLY 47 CO 0.00 -0.01 -0.07 -1.08 0.00 0.00 0.00 173.10 171.94 2erm s THR 48 N 0.82 3.34 0.55 0.90 -1.32 -0.72 -4.55 115.64 114.66 2erm s THR 48 Ca -0.06 -0.53 0.26 0.00 -1.21 0.00 0.00 61.69 60.15 2erm s THR 48 Cb -0.15 -2.47 0.38 0.00 -1.51 0.00 0.00 72.50 68.75 2erm s THR 48 CO -0.01 0.47 2.00 -0.09 -2.21 0.00 0.00 174.62 174.78 2erm h ARG 49 N 7.41 0.00 -4.59 7.08 1.12 -1.79 0.31 114.38 123.91 2erm h ARG 49 Ca -0.35 0.00 -0.34 0.00 -1.11 0.00 0.00 59.98 58.18 2erm h ARG 49 Cb 1.18 0.00 -0.26 0.00 -0.01 0.00 0.00 29.97 30.88 2erm h ARG 49 CO 0.59 0.00 -0.76 0.34 -3.11 0.00 0.00 179.97 177.03 2erm s ASP 50 N -5.96 0.90 0.00 -3.80 -1.08 -1.26 -4.56 116.67 100.90 2erm s ASP 50 Ca -0.05 -0.26 -0.03 0.00 -0.52 0.00 0.00 52.55 51.69 2erm s ASP 50 Cb 0.18 -0.06 -0.13 0.00 -1.46 0.00 0.00 42.92 41.45 2erm s ASP 50 CO 0.66 0.01 2.57 -2.11 0.52 0.00 0.00 175.17 176.82 2erm n ARG 51 N 2.46 1.36 0.11 4.34 -4.01 -1.26 -4.40 116.66 115.26 2erm n ARG 51 Ca -0.16 -0.49 -0.18 0.00 -1.04 0.00 0.00 57.85 55.99 2erm n ARG 51 Cb 0.57 -1.55 -0.14 0.00 -3.04 0.00 0.00 32.46 28.29 2erm n ARG 51 CO 0.00 0.00 0.00 0.77 -3.04 0.00 0.00 177.63 175.36 2erm h SER 52 N 2.50 0.51 -4.23 2.89 0.02 -1.97 -3.46 113.55 109.81 2erm h SER 52 Ca 0.09 -0.55 -0.49 0.00 -0.84 0.00 0.00 61.79 60.00 2erm h SER 52 Cb 1.12 -0.16 0.05 0.00 0.14 0.00 0.00 62.40 63.55 2erm h SER 52 CO 0.15 1.43 0.38 -0.62 -1.14 0.00 0.00 176.83 177.03 2erm s ASP 53 N -7.22 6.16 0.25 3.07 -1.08 -1.26 -4.98 116.67 111.61 2erm s ASP 53 Ca -0.05 1.63 0.09 0.00 -0.52 0.00 0.00 52.55 53.69 2erm s ASP 53 Cb 0.06 -2.51 0.29 0.00 -1.46 0.00 0.00 42.92 39.30 2erm s ASP 53 CO 0.89 -0.91 1.57 0.06 0.52 0.00 0.00 175.17 177.31 2erm h GLN 54 N 0.41 0.06 0.00 4.34 3.07 -2.00 -3.36 115.11 117.63 2erm h GLN 54 Ca -0.46 -0.05 0.00 0.00 0.09 0.00 0.00 58.65 58.23 2erm h GLN 54 Cb 1.20 0.01 0.00 0.00 0.08 0.00 0.00 27.48 28.77 2erm h GLN 54 CO 0.60 0.68 0.00 0.72 0.09 0.00 0.00 178.83 180.92 2erm n HIS 55 N -3.79 0.00 0.21 0.06 8.25 -1.26 -0.61 115.22 118.08 2erm n HIS 55 Ca -0.02 0.00 0.12 0.00 -0.26 0.00 0.00 57.72 57.57 2erm n HIS 55 Cb 0.64 -0.10 0.62 0.00 1.12 0.00 0.00 29.99 32.27 2erm n HIS 55 CO 0.00 0.00 0.00 -0.84 0.64 0.00 0.00 176.34 176.14 2erm h ILE 56 N 0.00 0.00 0.00 1.59 3.07 -1.77 0.11 117.51 120.51 2erm h ILE 56 Ca 0.00 -0.05 -0.21 0.00 1.55 0.00 0.00 64.86 66.15 2erm h ILE 56 Cb 0.04 0.61 0.05 0.00 -0.27 0.00 0.00 36.82 37.25 2erm h ILE 56 CO 0.00 0.00 1.03 0.00 -1.05 0.00 0.00 178.15 178.13 2erm n GLN 57 N -2.32 0.00 -2.37 0.16 10.64 0.22 -4.75 117.38 118.96 2erm n GLN 57 Ca -0.01 -0.61 -0.25 0.00 -1.83 0.00 0.00 57.00 54.30 2erm n GLN 57 Cb 0.07 -2.04 0.05 0.00 -0.86 0.00 0.00 30.24 27.46 2erm n GLN 57 CO 0.00 0.00 0.00 -0.51 -1.83 0.00 0.00 177.06 174.72 2erm s LEU 58 N 0.00 3.06 -0.16 2.61 1.43 -1.25 -1.15 118.68 123.22 2erm s LEU 58 Ca 0.25 0.45 -0.18 0.00 -1.03 0.00 0.00 54.13 53.61 2erm s LEU 58 Cb 0.05 -3.20 0.05 0.00 0.03 0.00 0.00 46.19 43.12 2erm s LEU 58 CO 0.13 -1.32 0.50 -1.58 0.23 0.00 0.00 176.35 174.30 2erm s GLN 59 N -5.06 0.63 -0.48 1.70 0.74 0.83 -0.65 119.66 117.37 2erm s GLN 59 Ca 0.57 0.57 0.00 0.00 0.05 0.00 0.00 55.36 56.55 2erm s GLN 59 Cb -0.11 0.30 0.13 0.00 1.10 0.00 0.00 33.01 34.44 2erm s GLN 59 CO 0.43 -0.10 0.26 -1.17 -0.55 0.00 0.00 175.29 174.16 2erm s LEU 60 N -0.01 4.94 -0.52 3.68 2.96 -1.26 -0.37 118.68 128.10 2erm s LEU 60 Ca -0.02 -2.52 -0.18 0.00 -0.22 0.00 0.00 54.13 51.18 2erm s LEU 60 Cb -0.03 -1.75 0.07 0.00 0.50 0.00 0.00 46.19 44.97 2erm s LEU 60 CO 0.02 -0.39 0.59 -0.44 -1.32 0.00 0.00 176.35 174.81 2erm s SER 61 N 0.83 6.20 0.34 3.68 0.01 0.46 -4.86 113.70 120.36 2erm s SER 61 Ca 0.13 -1.12 -0.29 0.00 1.31 0.00 0.00 55.95 55.98 2erm s SER 61 Cb -0.22 -2.27 -0.11 0.00 0.21 0.00 0.00 66.02 63.63 2erm s SER 61 CO -0.04 -0.89 1.41 0.00 0.41 0.00 0.00 173.24 174.13 2erm s ALA 62 N 2.42 3.55 -0.21 1.44 0.00 -1.26 -0.53 121.76 127.18 2erm s ALA 62 Ca 0.12 1.42 -0.11 0.00 0.00 0.00 0.00 51.96 53.39 2erm s ALA 62 Cb -0.22 -3.55 -0.09 0.00 0.00 0.00 0.00 23.12 19.27 2erm s ALA 62 CO 0.09 -0.85 -0.27 -1.91 0.00 0.00 0.00 175.76 172.82 2erm n GLU 63 N 0.85 0.45 -1.01 0.00 2.13 0.24 -4.90 120.64 118.40 2erm n GLU 63 Ca 0.01 0.20 0.00 0.00 0.66 0.00 0.00 57.16 58.03 2erm n GLU 63 Cb 0.40 -1.25 0.00 0.00 0.27 0.00 0.00 31.44 30.86 2erm n GLU 63 CO 0.00 0.00 0.00 0.45 -0.41 0.00 0.00 177.13 177.17 2erm n SER 64 N -3.98 0.00 -3.91 4.31 2.88 -1.00 -5.02 113.62 106.90 2erm n SER 64 Ca -0.40 -0.86 -0.13 0.00 -1.33 0.00 0.00 58.87 56.15 2erm n SER 64 Cb 0.77 0.00 -0.04 0.00 -0.75 0.00 0.00 64.21 64.18 2erm n SER 64 CO 0.00 0.00 0.00 1.33 -1.23 0.00 0.00 175.04 175.14 2erm n VAL 65 N 0.00 0.00 -1.00 2.46 0.24 -1.26 -0.96 118.33 117.82 2erm n VAL 65 Ca 0.00 -0.32 0.00 0.00 -2.04 0.00 0.00 64.34 61.98 2erm n VAL 65 Cb 0.00 -0.72 0.00 0.00 -1.47 0.00 0.00 33.84 31.65 2erm n VAL 65 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 2erm n GLY 66 N 4.29 0.45 3.40 7.63 0.00 -1.26 -5.00 105.19 114.70 2erm n GLY 66 Ca 0.16 -0.48 -0.32 0.00 0.00 0.00 0.00 46.02 45.38 2erm n GLY 66 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 2erm s GLU 67 N -0.88 2.57 0.01 1.61 -1.05 -0.13 -0.74 118.70 120.10 2erm s GLU 67 Ca 0.00 -0.77 -0.02 0.00 -0.15 0.00 0.00 54.97 54.03 2erm s GLU 67 Cb 0.00 -2.32 -0.01 0.00 -0.44 0.00 0.00 34.13 31.36 2erm s GLU 67 CO 0.00 0.51 0.03 0.14 0.95 0.00 0.00 175.26 176.89 2erm s VAL 68 N -0.46 0.09 -0.22 1.83 -7.23 0.59 -0.59 120.40 114.42 2erm s VAL 68 Ca 0.05 -0.78 -0.04 0.00 -1.81 0.00 0.00 61.98 59.40 2erm s VAL 68 Cb -0.12 -0.30 -0.01 0.00 0.56 0.00 0.00 36.38 36.51 2erm s VAL 68 CO 0.02 -0.43 -0.03 -0.31 -0.31 0.00 0.00 175.10 174.03 2erm s TYR 69 N -1.34 2.97 -0.40 2.82 2.02 0.31 -0.40 117.35 123.33 2erm s TYR 69 Ca -0.15 -0.86 -0.24 0.00 -0.37 0.00 0.00 57.07 55.46 2erm s TYR 69 Cb -0.09 -2.11 0.02 0.00 -0.40 0.00 0.00 41.96 39.38 2erm s TYR 69 CO -0.00 -0.51 0.82 0.42 -1.57 0.00 0.00 175.55 174.71 2erm s ILE 70 N 1.44 4.66 0.04 2.71 1.01 -1.26 -0.41 121.20 129.40 2erm s ILE 70 Ca 0.05 0.80 0.05 0.00 0.00 0.00 0.00 60.65 61.56 2erm s ILE 70 Cb -0.14 -4.28 -0.03 0.00 0.01 0.00 0.00 42.46 38.01 2erm s ILE 70 CO -0.02 -0.56 -0.11 -1.59 0.00 0.00 0.00 174.94 172.66 2erm s LYS 71 N 3.27 2.30 0.33 2.79 -2.85 0.50 -0.19 119.74 125.89 2erm s LYS 71 Ca 0.33 -0.88 -0.28 0.00 -1.00 0.00 0.00 55.97 54.13 2erm s LYS 71 Cb -0.12 -2.35 -0.10 0.00 -2.06 0.00 0.00 37.83 33.20 2erm s LYS 71 CO 0.20 0.56 1.24 -1.54 0.10 0.00 0.00 175.35 175.91 2erm s SER 72 N -1.61 6.84 0.29 0.03 1.04 0.08 -0.12 113.70 120.25 2erm s SER 72 Ca 0.17 2.55 0.02 0.00 0.48 0.00 0.00 55.95 59.18 2erm s SER 72 Cb -0.11 -2.64 0.45 0.00 0.10 0.00 0.00 66.02 63.83 2erm s SER 72 CO 0.08 -0.47 1.78 0.71 0.98 0.00 0.00 173.24 176.32 2erm h THR 73 N 2.94 1.24 0.00 2.02 1.35 -1.39 -2.39 112.91 116.68 2erm h THR 73 Ca -0.48 -1.06 0.00 0.00 -0.55 0.00 0.00 66.41 64.32 2erm h THR 73 Cb 1.22 1.12 0.00 0.00 -1.73 0.00 0.00 68.15 68.77 2erm h THR 73 CO 0.65 0.35 -0.26 -0.62 -0.25 0.00 0.00 175.52 175.39 2erm n GLU 74 N -4.19 0.19 0.09 4.72 4.71 -1.26 0.54 120.64 125.43 2erm n GLU 74 Ca 0.01 0.27 0.12 0.00 -0.01 0.00 0.00 57.16 57.55 2erm n GLU 74 Cb 0.33 -1.04 0.45 0.00 -1.01 0.00 0.00 31.44 30.18 2erm n GLU 74 CO 0.00 0.00 0.00 0.25 0.09 0.00 0.00 177.13 177.47 2erm n THR 75 N -3.21 0.65 -1.67 2.62 -2.24 -1.26 -4.39 114.28 104.77 2erm n THR 75 Ca -0.04 -0.02 -0.12 0.00 -2.27 0.00 0.00 64.05 61.60 2erm n THR 75 Cb 0.14 -0.82 -0.03 0.00 -2.10 0.00 0.00 70.33 67.51 2erm n THR 75 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2erm n GLY 76 N 0.74 0.78 3.69 3.38 0.00 -0.90 -4.97 105.19 107.92 2erm n GLY 76 Ca 0.04 -0.44 -0.42 0.00 0.00 0.00 0.00 46.02 45.20 2erm n GLY 76 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 2erm s GLN 77 N -3.59 4.42 -0.62 1.61 -0.21 -1.26 -4.62 119.66 115.39 2erm s GLN 77 Ca 0.00 1.57 -0.23 0.00 0.02 0.00 0.00 55.36 56.72 2erm s GLN 77 Cb 0.00 -3.50 0.06 0.00 1.00 0.00 0.00 33.01 30.56 2erm s GLN 77 CO 0.00 -0.32 0.95 0.71 -2.12 0.00 0.00 175.29 174.51 2erm s TYR 78 N 1.79 2.72 0.09 0.91 2.02 0.37 -0.74 117.35 124.51 2erm s TYR 78 Ca 0.54 -0.35 -0.36 0.00 -0.37 0.00 0.00 57.07 56.52 2erm s TYR 78 Cb -0.23 -4.19 -0.16 0.00 -0.40 0.00 0.00 41.96 36.98 2erm s TYR 78 CO 0.23 -1.53 1.44 -0.11 -1.57 0.00 0.00 175.55 174.00 2erm n LEU 79 N 7.60 2.14 -3.69 -1.29 0.00 0.74 -0.05 117.00 122.44 2erm n LEU 79 Ca -0.02 1.10 -0.12 0.00 0.00 0.00 0.00 56.01 56.98 2erm n LEU 79 Cb 0.46 -1.26 -0.06 0.00 0.00 0.00 0.00 43.42 42.56 2erm n LEU 79 CO 0.64 -0.78 0.11 0.00 0.00 0.00 0.00 177.39 177.36 2erm s ALA 80 N 0.79 -0.87 -0.15 1.96 0.00 0.15 -4.51 121.76 119.13 2erm s ALA 80 Ca 0.83 0.09 0.01 0.00 0.00 0.00 0.00 51.96 52.90 2erm s ALA 80 Cb -0.87 0.44 0.00 0.00 0.00 0.00 0.00 23.12 22.69 2erm s ALA 80 CO 0.45 -0.50 -0.18 1.41 0.00 0.00 0.00 175.76 176.94 2erm s MET 81 N -2.93 3.13 0.00 0.00 1.75 -0.21 -0.59 119.30 120.45 2erm s MET 81 Ca -0.02 -0.79 0.00 0.00 -1.25 0.00 0.00 55.69 53.63 2erm s MET 81 Cb 0.00 -2.57 0.00 0.00 2.84 0.00 0.00 34.83 35.11 2erm s MET 81 CO -0.06 -0.02 0.00 -3.47 -0.65 0.00 0.00 175.02 170.82 2erm n ASP 82 N 4.14 0.00 0.08 1.11 -0.08 0.05 -4.74 116.55 117.12 2erm n ASP 82 Ca -0.20 0.00 -0.20 0.00 -1.51 0.00 0.00 54.79 52.89 2erm n ASP 82 Cb 0.51 0.00 -0.15 0.00 2.34 0.00 0.00 41.12 43.83 2erm n ASP 82 CO 0.00 0.00 0.00 0.74 0.12 0.00 0.00 177.20 178.06 2erm h THR 83 N 0.00 1.13 0.04 5.18 2.02 -2.01 -3.32 112.91 115.95 2erm h THR 83 Ca 0.00 -2.72 -0.30 0.00 0.77 0.00 0.00 66.41 64.17 2erm h THR 83 Cb 0.00 2.82 -0.04 0.00 -1.74 0.00 0.00 68.15 69.19 2erm h THR 83 CO 0.00 0.83 -1.67 -2.24 0.37 0.00 0.00 175.52 172.81 2erm h ASP 84 N 0.09 0.12 0.00 4.18 2.03 -2.04 -3.48 116.42 117.32 2erm h ASP 84 Ca -0.27 -0.23 0.00 0.00 -0.73 0.00 0.00 57.03 55.80 2erm h ASP 84 Cb 2.06 -0.04 0.00 0.00 -0.83 0.00 0.00 39.33 40.53 2erm h ASP 84 CO 0.19 1.20 0.00 0.61 -1.03 0.00 0.00 179.24 180.21 2erm n GLY 85 N 1.63 0.96 3.63 7.15 0.00 -1.25 -4.30 105.19 113.00 2erm n GLY 85 Ca -0.18 0.00 -0.47 0.00 0.00 0.00 0.00 46.02 45.37 2erm n GLY 85 CO 0.00 0.00 0.00 -0.10 0.00 0.00 0.00 173.32 173.22 2erm n LEU 86 N 0.00 2.45 -4.77 0.99 7.94 -1.26 -3.71 117.00 118.64 2erm n LEU 86 Ca 0.00 1.13 -0.38 0.00 -1.11 0.00 0.00 56.01 55.65 2erm n LEU 86 Cb 0.00 -1.34 -0.06 0.00 0.53 0.00 0.00 43.42 42.56 2erm n LEU 86 CO 0.00 -0.78 0.23 -0.76 -1.11 0.00 0.00 177.39 174.96 2erm s LEU 87 N 0.42 4.40 0.15 -1.96 1.43 -1.26 -0.77 118.68 121.08 2erm s LEU 87 Ca 0.73 1.04 -0.16 0.00 -1.03 0.00 0.00 54.13 54.71 2erm s LEU 87 Cb -0.75 -2.80 0.03 0.00 0.03 0.00 0.00 46.19 42.70 2erm s LEU 87 CO 0.49 0.12 0.42 -0.72 0.23 0.00 0.00 176.35 176.89 2erm s TYR 88 N -0.17 -0.13 -0.69 0.29 1.13 0.25 -4.38 117.35 113.64 2erm s TYR 88 Ca 0.28 -0.20 -0.16 0.00 -1.41 0.00 0.00 57.07 55.58 2erm s TYR 88 Cb -0.17 0.26 0.17 0.00 -1.10 0.00 0.00 41.96 41.11 2erm s TYR 88 CO 0.15 -0.75 0.67 0.20 -2.51 0.00 0.00 175.55 173.31 2erm s GLY 89 N -2.84 2.29 0.64 5.49 0.00 0.11 0.34 107.32 113.35 2erm s GLY 89 Ca 0.06 -2.85 -0.16 0.00 0.00 0.00 0.00 44.72 41.76 2erm s GLY 89 CO -0.09 1.31 1.12 -0.45 0.00 0.00 0.00 173.10 175.00 2erm s SER 90 N 2.99 5.16 0.19 1.64 0.15 0.92 -4.54 113.70 120.21 2erm s SER 90 Ca 0.12 2.07 -0.10 0.00 0.70 0.00 0.00 55.95 58.74 2erm s SER 90 Cb -0.19 -2.56 0.11 0.00 -1.71 0.00 0.00 66.02 61.66 2erm s SER 90 CO -0.02 -1.60 1.74 1.56 1.20 0.00 0.00 173.24 176.12 2erm h GLN 91 N 0.26 1.02 -6.11 5.44 4.20 -1.91 0.11 115.11 118.11 2erm h GLN 91 Ca -0.48 -0.19 -0.56 0.00 0.06 0.00 0.00 58.65 57.48 2erm h GLN 91 Cb 1.25 -0.16 -0.17 0.00 0.30 0.00 0.00 27.48 28.70 2erm h GLN 91 CO 0.54 0.85 -0.79 0.95 -0.67 0.00 0.00 178.83 179.72 2erm s THR 92 N -5.52 2.02 0.17 -0.54 -4.23 -1.26 -4.74 115.64 101.53 2erm s THR 92 Ca -0.13 -2.02 -0.30 0.00 -1.18 0.00 0.00 61.69 58.06 2erm s THR 92 Cb 0.14 -1.98 -0.07 0.00 1.34 0.00 0.00 72.50 71.93 2erm s THR 92 CO 0.82 -0.29 1.13 -2.16 -0.54 0.00 0.00 174.62 173.57 2erm s PRO 93 N -2.90 4.55 0.29 3.99 0.04 -1.26 -4.82 135.00 134.90 2erm s PRO 93 Ca 0.19 1.76 -0.19 0.00 0.04 0.00 0.00 61.00 62.79 2erm s PRO 93 Cb -0.06 -3.28 0.05 0.00 0.04 0.00 0.00 34.50 31.26 2erm s PRO 93 CO 0.08 0.00 0.84 1.21 0.04 0.00 0.00 177.00 179.18 2erm s ASN 94 N 0.07 -0.08 0.36 6.66 2.47 -1.26 -5.03 114.94 118.13 2erm s ASN 94 Ca 0.51 -0.83 0.12 0.00 0.42 0.00 0.00 52.86 53.08 2erm s ASN 94 Cb -0.30 0.71 0.92 0.00 -1.45 0.00 0.00 41.25 41.13 2erm s ASN 94 CO 0.35 -1.38 1.81 -0.08 -3.72 0.00 0.00 177.10 174.08 2erm h GLU 95 N 2.00 0.56 -0.83 0.43 4.57 -1.96 0.27 114.58 119.62 2erm h GLU 95 Ca -0.27 -0.03 0.15 0.00 -1.18 0.00 0.00 59.36 58.02 2erm h GLU 95 Cb 1.24 -0.13 -0.06 0.00 -0.16 0.00 0.00 28.75 29.65 2erm h GLU 95 CO 0.33 0.37 0.54 0.93 -1.18 0.00 0.00 179.01 180.01 2erm h GLU 96 N 0.58 0.53 0.00 1.92 3.07 -1.95 -0.04 114.58 118.69 2erm h GLU 96 Ca 0.54 -0.03 0.00 0.00 -0.50 0.00 0.00 59.36 59.37 2erm h GLU 96 Cb 1.10 -0.12 0.00 0.00 -0.84 0.00 0.00 28.75 28.89 2erm h GLU 96 CO -0.29 0.35 -0.65 0.00 -1.40 0.00 0.00 179.01 177.02 2erm s LEU 98 N -3.32 5.89 0.10 0.00 2.96 -0.03 -4.42 118.68 119.87 2erm s LEU 98 Ca 0.09 -1.69 -0.24 0.00 -0.22 0.00 0.00 54.13 52.07 2erm s LEU 98 Cb 0.16 -2.25 -0.07 0.00 0.50 0.00 0.00 46.19 44.54 2erm s LEU 98 CO 0.74 -0.95 0.74 -0.36 -1.32 0.00 0.00 176.35 175.19 2erm s PHE 99 N 1.98 3.83 -0.30 5.38 0.08 0.46 -3.20 117.98 126.21 2erm s PHE 99 Ca 0.07 1.51 -0.28 0.00 0.12 0.00 0.00 56.93 58.36 2erm s PHE 99 Cb -0.27 -2.74 0.01 0.00 -0.57 0.00 0.00 43.02 39.45 2erm s PHE 99 CO 0.04 0.44 1.00 -1.17 -0.10 0.00 0.00 175.22 175.43 2erm s LEU 100 N -0.73 4.00 0.57 -0.37 2.96 0.75 -0.30 118.68 125.57 2erm s LEU 100 Ca 0.36 1.02 -0.16 0.00 -0.22 0.00 0.00 54.13 55.13 2erm s LEU 100 Cb -0.22 -3.44 -0.05 0.00 0.50 0.00 0.00 46.19 42.99 2erm s LEU 100 CO 0.24 -0.78 1.04 -0.70 -1.32 0.00 0.00 176.35 174.83 2erm s GLU 101 N 3.41 3.46 -0.14 1.98 2.56 0.08 -0.86 118.70 129.20 2erm s GLU 101 Ca 0.42 1.16 -0.04 0.00 0.00 0.00 0.00 54.97 56.51 2erm s GLU 101 Cb -0.13 -2.06 0.07 0.00 2.00 0.00 0.00 34.13 34.01 2erm s GLU 101 CO 0.13 -0.69 0.23 0.50 -0.56 0.00 0.00 175.26 174.87 2erm s ARG 102 N -4.04 0.14 -0.15 4.30 3.00 -0.57 -4.93 118.95 116.70 2erm s ARG 102 Ca 0.63 0.57 -0.29 0.00 -1.00 0.00 0.00 55.73 55.64 2erm s ARG 102 Cb -0.15 -0.38 -0.03 0.00 0.00 0.00 0.00 34.95 34.39 2erm s ARG 102 CO 0.35 -0.39 1.49 -1.17 0.00 0.00 0.00 175.30 175.58 2erm s LEU 103 N 2.37 4.14 -0.21 -0.88 2.96 -1.26 -1.51 118.68 124.30 2erm s LEU 103 Ca 0.03 1.84 -0.29 0.00 -0.22 0.00 0.00 54.13 55.49 2erm s LEU 103 Cb -0.13 -3.53 0.00 0.00 0.50 0.00 0.00 46.19 43.03 2erm s LEU 103 CO -0.09 -0.96 1.02 -0.70 -1.32 0.00 0.00 176.35 174.30 2erm s GLU 104 N 4.02 4.29 0.45 1.98 2.56 0.11 -4.96 118.70 127.15 2erm s GLU 104 Ca 0.66 1.34 0.19 0.00 0.00 0.00 0.00 54.97 57.15 2erm s GLU 104 Cb -0.26 -3.62 1.16 0.00 2.00 0.00 0.00 34.13 33.40 2erm s GLU 104 CO 0.24 -0.56 1.93 0.93 -0.56 0.00 0.00 175.26 177.24 2erm h GLU 105 N 7.39 0.29 -2.27 4.30 3.07 -1.95 -0.65 114.58 124.77 2erm h GLU 105 Ca -0.22 -0.02 -0.11 0.00 -0.50 0.00 0.00 59.36 58.51 2erm h GLU 105 Cb 1.08 -0.07 -0.04 0.00 -0.84 0.00 0.00 28.75 28.88 2erm h GLU 105 CO 0.95 0.19 -0.10 0.09 -1.40 0.00 0.00 179.01 178.74 2erm n ASN 106 N -4.45 3.62 -3.89 1.42 3.02 -1.26 -4.78 115.26 108.95 2erm n ASN 106 Ca 0.14 -2.15 -0.30 0.00 -0.03 0.00 0.00 54.58 52.24 2erm n ASN 106 Cb 0.60 -0.95 0.00 0.00 -0.61 0.00 0.00 39.78 38.82 2erm n ASN 106 CO 0.00 0.00 0.00 1.41 -2.62 0.00 0.00 177.26 176.05 2erm n HIS 107 N 2.52 -1.69 -4.10 3.10 8.25 -0.30 -5.01 115.22 117.99 2erm n HIS 107 Ca 0.26 0.56 -0.13 0.00 -0.26 0.00 0.00 57.72 58.15 2erm n HIS 107 Cb 0.59 -3.49 -0.06 0.00 1.12 0.00 0.00 29.99 28.15 2erm n HIS 107 CO 0.00 0.00 0.00 0.71 0.64 0.00 0.00 176.34 177.69 2erm s TYR 108 N -3.76 0.95 0.24 4.41 2.02 -0.94 -4.80 117.35 115.48 2erm s TYR 108 Ca 0.22 -1.19 0.06 0.00 -0.37 0.00 0.00 57.07 55.80 2erm s TYR 108 Cb -0.09 -0.15 -0.05 0.00 -0.40 0.00 0.00 41.96 41.26 2erm s TYR 108 CO 0.89 -0.98 -0.07 -0.80 -1.57 0.00 0.00 175.55 173.02 2erm s ASN 109 N -3.17 2.50 -0.23 2.29 -0.87 0.88 0.08 114.94 116.42 2erm s ASN 109 Ca 0.31 -1.14 -0.04 0.00 -1.57 0.00 0.00 52.86 50.42 2erm s ASN 109 Cb 0.01 -0.12 0.12 0.00 -0.02 0.00 0.00 41.25 41.24 2erm s ASN 109 CO 0.16 -0.33 0.39 0.42 -2.57 0.00 0.00 177.10 175.17 2erm s THR 110 N -3.09 -0.61 -0.61 1.60 -4.23 -0.57 -0.99 115.64 107.13 2erm s THR 110 Ca 0.27 0.00 -0.18 0.00 -1.18 0.00 0.00 61.69 60.60 2erm s THR 110 Cb 0.03 -0.76 0.12 0.00 1.34 0.00 0.00 72.50 73.22 2erm s THR 110 CO 0.09 -0.06 0.70 -0.31 -0.54 0.00 0.00 174.62 174.50 2erm s TYR 111 N 2.56 3.08 -0.12 3.99 2.02 -1.26 -1.51 117.35 126.10 2erm s TYR 111 Ca 0.09 -1.09 -0.23 0.00 -0.37 0.00 0.00 57.07 55.47 2erm s TYR 111 Cb -0.14 -3.99 -0.03 0.00 -0.40 0.00 0.00 41.96 37.40 2erm s TYR 111 CO -0.15 -1.25 0.70 0.42 -1.57 0.00 0.00 175.55 173.70 2erm s ILE 112 N 2.39 5.01 -0.67 2.71 1.01 -0.04 -2.78 121.20 128.84 2erm s ILE 112 Ca 0.12 1.40 -0.26 0.00 0.00 0.00 0.00 60.65 61.91 2erm s ILE 112 Cb -0.23 -4.03 -0.03 0.00 0.01 0.00 0.00 42.46 38.17 2erm s ILE 112 CO 0.04 0.17 1.94 -0.55 0.00 0.00 0.00 174.94 176.55 2erm s SER 113 N 0.97 5.13 0.00 3.58 0.15 0.31 -0.18 113.70 123.66 2erm s SER 113 Ca 0.35 0.18 0.00 0.00 0.70 0.00 0.00 55.95 57.18 2erm s SER 113 Cb -0.17 -2.53 0.00 0.00 -1.71 0.00 0.00 66.02 61.61 2erm s SER 113 CO 0.15 -2.54 0.78 2.29 1.20 0.00 0.00 173.24 175.12 2erm n LYS 114 N 9.10 0.96 0.37 5.44 2.85 -1.19 -1.10 118.16 134.58 2erm n LYS 114 Ca 0.27 0.00 -0.17 0.00 -1.05 0.00 0.00 58.31 57.35 2erm n LYS 114 Cb 0.51 -1.17 -0.09 0.00 -0.65 0.00 0.00 35.03 33.63 2erm n LYS 114 CO 0.00 0.00 0.00 -0.22 -0.05 0.00 0.00 177.40 177.13 2erm h LYS 115 N 0.02 -0.88 -2.73 -1.58 3.11 -1.76 -3.17 116.57 109.57 2erm h LYS 115 Ca 0.00 0.06 -0.38 0.00 -2.81 0.00 0.00 60.65 57.52 2erm h LYS 115 Cb 0.17 0.20 -0.01 0.00 -1.00 0.00 0.00 32.23 31.59 2erm h LYS 115 CO 0.00 -0.56 1.77 0.72 -2.81 0.00 0.00 179.45 178.57 2erm n HIS 116 N -5.45 1.12 0.33 1.91 8.25 -0.25 -4.67 115.22 116.45 2erm n HIS 116 Ca -0.13 -2.03 0.21 0.00 -0.26 0.00 0.00 57.72 55.51 2erm n HIS 116 Cb 0.38 -1.83 1.14 0.00 1.12 0.00 0.00 29.99 30.80 2erm n HIS 116 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 2erm h ALA 117 N 4.63 1.13 0.00 -1.41 0.00 -1.65 0.30 119.26 122.26 2erm h ALA 117 Ca 0.48 -0.00 -0.02 0.00 0.00 0.00 0.00 54.91 55.37 2erm h ALA 117 Cb 0.69 0.00 -0.00 0.00 0.00 0.00 0.00 17.79 18.48 2erm h ALA 117 CO 1.04 -0.04 -0.55 1.05 0.00 0.00 0.00 179.25 180.75 2erm h GLU 118 N 0.00 0.00 0.00 0.00 -0.00 -1.91 -3.40 114.58 109.26 2erm h GLU 118 Ca 0.00 0.00 -0.06 0.00 -0.00 0.00 0.00 59.36 59.31 2erm h GLU 118 Cb 0.08 0.00 -0.01 0.00 -0.00 0.00 0.00 28.75 28.82 2erm h GLU 118 CO -0.00 0.08 -0.26 0.87 -0.00 0.00 0.00 179.01 179.69 2erm h LYS 119 N -1.00 0.00 -5.74 1.06 1.57 -1.93 -3.48 116.57 107.05 2erm h LYS 119 Ca -0.03 0.00 -0.23 0.00 -1.87 0.00 0.00 60.65 58.52 2erm h LYS 119 Cb 0.56 0.00 0.09 0.00 0.08 0.00 0.00 32.23 32.95 2erm h LYS 119 CO -0.02 0.26 -0.61 0.09 -0.57 0.00 0.00 179.45 178.61 2erm n ASN 120 N -3.25 -6.56 -4.79 0.86 3.02 0.11 -4.99 115.26 99.66 2erm n ASN 120 Ca 0.02 -0.59 -0.37 0.00 -0.03 0.00 0.00 54.58 53.60 2erm n ASN 120 Cb 0.55 -4.46 -0.06 0.00 -0.61 0.00 0.00 39.78 35.20 2erm n ASN 120 CO 0.00 0.00 0.00 0.26 -2.62 0.00 0.00 177.26 174.90 2erm s TRP 121 N -3.23 3.75 -0.02 3.10 0.51 -1.26 -4.79 118.94 117.00 2erm s TRP 121 Ca 0.26 1.67 0.03 0.00 -2.12 0.00 0.00 56.10 55.94 2erm s TRP 121 Cb -0.06 -2.82 -0.03 0.00 -0.81 0.00 0.00 33.47 29.75 2erm s TRP 121 CO 0.79 0.33 -0.09 -0.06 -0.51 0.00 0.00 176.95 177.40 2erm s PHE 122 N -1.46 2.83 0.00 -1.98 0.40 -1.26 -0.53 117.98 115.98 2erm s PHE 122 Ca 0.45 -0.07 -0.03 0.00 -0.60 0.00 0.00 56.93 56.68 2erm s PHE 122 Cb -0.20 -1.62 -0.14 0.00 0.51 0.00 0.00 43.02 41.57 2erm s PHE 122 CO 0.24 0.32 2.32 1.33 0.70 0.00 0.00 175.22 180.13 2erm n VAL 123 N 1.86 1.88 -1.17 -0.44 0.24 -1.12 -4.41 118.33 115.16 2erm n VAL 123 Ca -0.16 -0.85 -0.31 0.00 -2.04 0.00 0.00 64.34 60.98 2erm n VAL 123 Cb 0.53 -1.72 0.11 0.00 -1.47 0.00 0.00 33.84 31.29 2erm n VAL 123 CO 0.00 0.00 0.00 -0.83 -2.14 0.00 0.00 176.83 173.86 2erm s GLY 124 N 2.24 1.66 -0.11 7.63 0.00 -1.14 -4.86 107.32 112.75 2erm s GLY 124 Ca 0.34 0.20 0.03 0.00 0.00 0.00 0.00 44.72 45.29 2erm s GLY 124 CO 0.00 0.60 -0.20 1.08 0.00 0.00 0.00 173.10 174.58 2erm s LEU 125 N -6.10 2.31 0.64 0.66 1.43 -0.81 -0.07 118.68 116.75 2erm s LEU 125 Ca 0.62 -0.47 -0.16 0.00 -1.03 0.00 0.00 54.13 53.09 2erm s LEU 125 Cb -0.18 -1.48 -0.01 0.00 0.03 0.00 0.00 46.19 44.55 2erm s LEU 125 CO 0.57 0.17 1.12 -0.75 0.23 0.00 0.00 176.35 177.68 2erm s LYS 126 N 0.30 2.87 0.25 1.70 2.20 0.36 -4.20 119.74 123.23 2erm s LYS 126 Ca -0.15 1.45 -0.05 0.00 -0.36 0.00 0.00 55.97 56.86 2erm s LYS 126 Cb -0.17 -1.96 0.48 0.00 -1.51 0.00 0.00 37.83 34.67 2erm s LYS 126 CO 0.07 -1.20 1.66 0.87 -0.36 0.00 0.00 175.35 176.39 2erm h LYS 127 N 0.23 0.18 -0.05 4.03 1.79 -1.90 0.95 116.57 121.80 2erm h LYS 127 Ca -0.47 -0.01 0.02 0.00 -2.18 0.00 0.00 60.65 58.00 2erm h LYS 127 Cb 1.25 -0.04 -0.00 0.00 -1.58 0.00 0.00 32.23 31.86 2erm h LYS 127 CO 0.54 0.12 0.09 -0.91 -1.08 0.00 0.00 179.45 178.21 2erm h ASN 128 N 0.18 0.00 0.00 0.86 4.21 -1.98 -3.44 115.58 115.41 2erm h ASN 128 Ca 0.43 0.00 0.00 0.00 1.21 0.00 0.00 56.30 57.94 2erm h ASN 128 Cb 0.77 0.00 0.00 0.00 -1.12 0.00 0.00 38.32 37.97 2erm h ASN 128 CO -0.60 0.00 0.00 0.61 -1.29 0.00 0.00 177.43 176.15 2erm n GLY 129 N -1.26 0.44 3.65 2.83 0.00 0.33 -5.01 105.19 106.17 2erm n GLY 129 Ca -0.02 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.71 2erm n GLY 129 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2erm s SER 130 N -2.08 2.52 0.77 1.61 1.04 -1.26 -0.00 113.70 116.30 2erm s SER 130 Ca 0.00 1.39 -0.15 0.00 0.48 0.00 0.00 55.95 57.67 2erm s SER 130 Cb 0.00 -2.08 0.01 0.00 0.10 0.00 0.00 66.02 64.05 2erm s SER 130 CO 0.00 -3.22 0.81 0.00 0.98 0.00 0.00 173.24 171.80 2erm n LYS 132 N -1.76 0.81 -2.60 0.00 3.00 0.90 -4.02 118.16 114.50 2erm n LYS 132 Ca 0.11 -3.67 -0.26 0.00 -0.00 0.00 0.00 58.31 54.50 2erm n LYS 132 Cb 0.50 -1.90 0.02 0.00 0.00 0.00 0.00 35.03 33.65 2erm n LYS 132 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 177.40 176.42 2erm s ARG 133 N -0.53 3.07 2.91 1.64 1.70 -1.26 -2.87 118.95 123.60 2erm s ARG 133 Ca 0.30 -0.10 0.00 0.00 -0.47 0.00 0.00 55.73 55.46 2erm s ARG 133 Cb 0.01 -2.37 0.00 0.00 -0.57 0.00 0.00 34.95 32.02 2erm s ARG 133 CO -0.19 -0.49 0.00 0.41 -1.08 0.00 0.00 175.30 173.95 2erm n GLY 134 N -2.39 0.40 0.56 3.88 0.00 -1.24 -4.31 105.19 102.08 2erm n GLY 134 Ca 0.03 -0.91 0.06 0.00 0.00 0.00 0.00 46.02 45.19 2erm n GLY 134 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 2erm n PRO 135 N 0.00 1.70 0.01 1.61 -0.04 -1.26 -1.45 135.00 135.57 2erm n PRO 135 Ca 0.00 -1.09 0.11 0.00 -0.04 0.00 0.00 63.50 62.48 2erm n PRO 135 Cb 0.00 -1.26 -0.05 0.00 -0.04 0.00 0.00 33.50 32.14 2erm n PRO 135 CO 0.00 0.00 0.00 -2.13 -0.04 0.00 0.00 175.50 173.33 2erm n ARG 136 N 0.37 0.18 -2.23 0.54 0.00 -1.26 -4.93 116.66 109.32 2erm n ARG 136 Ca 0.11 -0.03 -0.34 0.00 -0.00 0.00 0.00 57.85 57.59 2erm n ARG 136 Cb 0.27 -1.53 -0.00 0.00 0.00 0.00 0.00 32.46 31.20 2erm n ARG 136 CO 0.00 0.00 0.00 0.95 0.00 0.00 0.00 177.63 178.58 2erm s THR 137 N -3.13 3.63 0.14 5.15 -4.23 -0.53 -4.98 115.64 111.69 2erm s THR 137 Ca 0.05 0.90 -0.20 0.00 -1.18 0.00 0.00 61.69 61.26 2erm s THR 137 Cb 0.15 -3.36 0.07 0.00 1.34 0.00 0.00 72.50 70.70 2erm s THR 137 CO 0.84 -0.33 0.93 0.00 -0.54 0.00 0.00 174.62 175.52 2erm n HIS 138 N -1.56 -1.13 -1.26 3.99 1.44 -1.26 -4.79 115.22 110.66 2erm n HIS 138 Ca 0.10 -1.04 -0.38 0.00 -2.01 0.00 0.00 57.72 54.38 2erm n HIS 138 Cb 0.52 0.50 -0.03 0.00 0.12 0.00 0.00 29.99 31.11 2erm n HIS 138 CO 0.00 0.00 0.00 0.98 -2.81 0.00 0.00 176.34 174.51 2erm n TYR 139 N -0.66 2.33 0.02 -1.40 9.36 -1.26 -3.61 117.16 121.95 2erm n TYR 139 Ca -0.01 -2.37 0.00 0.00 3.32 0.00 0.00 57.90 58.84 2erm n TYR 139 Cb 0.51 -2.06 0.00 0.00 -0.63 0.00 0.00 39.34 37.16 2erm n TYR 139 CO 0.00 0.00 0.00 0.41 0.22 0.00 0.00 176.86 177.49 2erm n GLY 140 N 4.11 -0.56 3.60 2.98 0.00 -1.26 -5.10 105.19 108.96 2erm n GLY 140 Ca 0.53 0.10 -0.43 0.00 0.00 0.00 0.00 46.02 46.22 2erm n GLY 140 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 2erm s GLN 141 N -2.00 3.19 0.64 1.61 0.74 -1.24 -4.83 119.66 117.78 2erm s GLN 141 Ca 0.00 1.65 0.43 0.00 0.05 0.00 0.00 55.36 57.49 2erm s GLN 141 Cb 0.00 -4.29 2.27 0.00 1.10 0.00 0.00 33.01 32.09 2erm s GLN 141 CO 0.00 -2.03 2.31 0.87 -0.55 0.00 0.00 175.29 175.89 2erm h LYS 142 N 14.03 0.00 -0.09 1.67 1.79 -1.95 -0.61 116.57 131.42 2erm h LYS 142 Ca -0.36 0.00 0.03 0.00 -2.18 0.00 0.00 60.65 58.13 2erm h LYS 142 Cb 1.20 0.00 -0.02 0.00 -1.58 0.00 0.00 32.23 31.83 2erm h LYS 142 CO 1.01 0.00 0.01 0.00 -1.08 0.00 0.00 179.45 179.39 2erm n ALA 143 N -2.07 0.05 0.23 3.86 0.00 -1.26 -0.59 120.51 120.73 2erm n ALA 143 Ca -0.02 0.09 0.12 0.00 0.00 0.00 0.00 53.44 53.63 2erm n ALA 143 Cb 0.10 -0.07 0.41 0.00 0.00 0.00 0.00 19.45 19.89 2erm n ALA 143 CO 0.00 0.00 0.00 -0.84 0.00 0.00 0.00 177.50 176.66 2erm h ILE 144 N 0.00 0.29 -2.77 0.00 3.07 -1.41 -2.14 117.51 114.55 2erm h ILE 144 Ca 0.05 -1.03 -0.62 0.00 1.55 0.00 0.00 64.86 64.81 2erm h ILE 144 Cb 0.12 1.82 -0.14 0.00 -0.27 0.00 0.00 36.82 38.35 2erm h ILE 144 CO -0.08 0.13 0.55 -0.76 -1.05 0.00 0.00 178.15 176.94 2erm s LEU 145 N -6.42 4.30 -0.29 0.16 1.43 0.24 -4.51 118.68 113.59 2erm s LEU 145 Ca 0.03 -0.84 -0.11 0.00 -1.03 0.00 0.00 54.13 52.17 2erm s LEU 145 Cb 0.08 -2.50 -0.04 0.00 0.03 0.00 0.00 46.19 43.75 2erm s LEU 145 CO 0.63 -1.40 0.19 -0.36 0.23 0.00 0.00 176.35 175.63 2erm s PHE 146 N 4.07 3.21 -0.14 0.29 0.08 -0.17 -0.94 117.98 124.38 2erm s PHE 146 Ca 0.24 0.04 -0.29 0.00 0.12 0.00 0.00 56.93 57.03 2erm s PHE 146 Cb -0.16 -2.38 -0.01 0.00 -0.57 0.00 0.00 43.02 39.90 2erm s PHE 146 CO 0.12 -0.20 1.10 -1.17 -0.10 0.00 0.00 175.22 174.97 2erm s LEU 147 N 1.74 4.20 -0.01 -0.37 2.96 0.55 -0.08 118.68 127.66 2erm s LEU 147 Ca 0.07 1.57 -0.27 0.00 -0.22 0.00 0.00 54.13 55.28 2erm s LEU 147 Cb -0.16 -3.55 -0.04 0.00 0.50 0.00 0.00 46.19 42.94 2erm s LEU 147 CO 0.10 -0.59 0.83 -2.16 -1.32 0.00 0.00 176.35 173.21 2erm s PRO 148 N 2.66 4.51 -0.77 0.98 0.04 -1.26 -0.76 135.00 140.39 2erm s PRO 148 Ca 0.50 1.15 -0.02 0.00 0.04 0.00 0.00 61.00 62.66 2erm s PRO 148 Cb -0.19 -3.44 0.19 0.00 0.04 0.00 0.00 34.50 31.11 2erm s PRO 148 CO 0.14 0.06 0.63 -0.51 0.04 0.00 0.00 177.00 177.36 2erm s LEU 149 N 0.71 5.41 -1.32 -3.56 1.43 0.44 -5.00 118.68 116.79 2erm s LEU 149 Ca 0.44 -3.37 -0.15 0.00 -1.03 0.00 0.00 54.13 50.02 2erm s LEU 149 Cb -0.20 -1.88 -0.01 0.00 0.03 0.00 0.00 46.19 44.14 2erm s LEU 149 CO 0.23 -0.26 2.21 -0.81 0.23 0.00 0.00 176.35 177.95 2erm n PRO 150 N 2.80 2.61 -0.25 1.29 -0.04 -1.26 -0.99 135.00 139.16 2erm n PRO 150 Ca 0.16 -2.41 0.04 0.00 -0.04 0.00 0.00 63.50 61.25 2erm n PRO 150 Cb 0.37 -3.17 0.17 0.00 -0.04 0.00 0.00 33.50 30.83 2erm n PRO 150 CO 0.00 0.00 0.00 0.28 -0.04 0.00 0.00 175.50 175.74 2erm h VAL 151 N 4.03 0.70 -3.69 0.52 2.07 -1.91 -3.46 116.25 114.51 2erm h VAL 151 Ca 0.56 -0.16 -0.23 0.00 0.82 0.00 0.00 66.70 67.68 2erm h VAL 151 Cb 0.62 0.20 -0.06 0.00 -1.52 0.00 0.00 31.29 30.53 2erm h VAL 151 CO 1.89 0.08 -0.12 -0.24 0.02 0.00 0.00 177.57 179.21 2erm n SER 152 N -4.98 -1.18 -4.78 0.57 2.88 0.55 -4.95 113.62 101.73 2erm n SER 152 Ca 0.13 -2.61 -0.32 0.00 -1.33 0.00 0.00 58.87 54.74 2erm n SER 152 Cb 0.37 2.20 0.06 0.00 -0.75 0.00 0.00 64.21 66.09 2erm n SER 152 CO 0.00 0.00 0.00 -0.94 -1.23 0.00 0.00 175.04 172.87 2erm s SER 153 N -2.85 4.99 0.00 -3.46 1.04 -1.26 -4.58 113.70 107.59 2erm s SER 153 Ca 0.24 1.82 0.31 0.00 0.48 0.00 0.00 55.95 58.80 2erm s SER 153 Cb -0.01 -2.52 1.59 0.00 0.10 0.00 0.00 66.02 65.18 2erm s SER 153 CO 0.18 -1.71 2.05 0.47 0.98 0.00 0.00 173.24 175.21