#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2a77 s VAL 2 N 0.00 4.47 -0.05 2.53 1.01 -1.26 -4.94 120.40 122.16 2a77 s VAL 2 Ca 0.00 1.54 -0.24 0.00 0.00 0.00 0.00 61.98 63.29 2a77 s VAL 2 Cb 0.00 -4.43 -0.04 0.00 0.00 0.00 0.00 36.38 31.91 2a77 s VAL 2 CO 0.00 -0.58 0.71 -0.22 0.00 0.00 0.00 175.10 175.01 2a77 s LEU 3 N 3.76 4.34 -0.28 3.92 0.20 -1.26 -4.74 118.68 124.62 2a77 s LEU 3 Ca 0.44 1.24 -0.02 0.00 0.69 0.00 0.00 54.13 56.48 2a77 s LEU 3 Cb -0.11 -3.11 0.04 0.00 -0.43 0.00 0.00 46.19 42.58 2a77 s LEU 3 CO 0.19 -0.09 -0.03 -0.04 -0.29 0.00 0.00 176.35 176.09 2a77 s MET 4 N 0.64 2.62 -0.21 1.98 -1.94 -1.26 -0.80 119.30 120.33 2a77 s MET 4 Ca 0.38 -1.13 -0.04 0.00 -1.71 0.00 0.00 55.69 53.18 2a77 s MET 4 Cb -0.18 -3.10 -0.02 0.00 2.01 0.00 0.00 34.83 33.54 2a77 s MET 4 CO 0.19 -0.52 -0.02 0.99 -0.01 0.00 0.00 175.02 175.65 2a77 s THR 5 N 1.29 3.66 -0.17 2.05 2.01 -0.11 -4.16 115.64 120.21 2a77 s THR 5 Ca -0.03 -0.41 -0.06 0.00 0.31 0.00 0.00 61.69 61.51 2a77 s THR 5 Cb -0.18 -2.66 -0.04 0.00 0.01 0.00 0.00 72.50 69.63 2a77 s THR 5 CO -0.02 0.43 0.02 -1.10 -0.69 0.00 0.00 174.62 173.25 2a77 s GLN 6 N 1.19 3.81 0.03 4.92 -0.21 -1.26 -1.22 119.66 126.91 2a77 s GLN 6 Ca 0.03 -0.41 0.01 0.00 0.02 0.00 0.00 55.36 55.01 2a77 s GLN 6 Cb -0.14 -3.08 -0.02 0.00 1.00 0.00 0.00 33.01 30.77 2a77 s GLN 6 CO 0.00 0.29 -0.05 -1.54 -2.12 0.00 0.00 175.29 171.87 2a77 s SER 7 N 0.28 0.56 1.07 5.90 1.04 -0.75 -4.51 113.70 117.29 2a77 s SER 7 Ca 0.01 -0.51 -0.18 0.00 0.48 0.00 0.00 55.95 55.75 2a77 s SER 7 Cb -0.13 0.06 0.25 0.00 0.10 0.00 0.00 66.02 66.30 2a77 s SER 7 CO 0.01 -0.24 1.26 -0.81 0.98 0.00 0.00 173.24 174.44 2a77 n PRO 8 N 1.59 -1.82 0.08 4.02 -0.04 -1.26 -1.37 135.00 136.20 2a77 n PRO 8 Ca -0.23 -1.96 -0.14 0.00 -0.04 0.00 0.00 63.50 61.14 2a77 n PRO 8 Cb 0.55 -1.44 -0.14 0.00 -0.04 0.00 0.00 33.50 32.44 2a77 n PRO 8 CO 0.00 0.00 0.00 -0.07 -0.04 0.00 0.00 175.50 175.39 2a77 h LEU 9 N 0.00 0.31 -7.99 1.53 3.38 -1.84 -3.42 115.31 107.27 2a77 h LEU 9 Ca -0.42 -0.34 -0.32 0.00 0.09 0.00 0.00 57.88 56.88 2a77 h LEU 9 Cb 1.20 -0.10 -0.27 0.00 0.09 0.00 0.00 40.66 41.58 2a77 h LEU 9 CO 0.29 1.27 -0.75 -0.44 0.09 0.00 0.00 178.44 178.90 2a77 s SER 10 N -6.99 0.75 -0.33 -0.43 0.01 -1.26 -1.14 113.70 104.31 2a77 s SER 10 Ca -0.03 -0.22 -0.01 0.00 1.31 0.00 0.00 55.95 57.00 2a77 s SER 10 Cb 0.08 -0.05 0.13 0.00 0.21 0.00 0.00 66.02 66.39 2a77 s SER 10 CO 0.86 0.01 0.21 -0.22 0.41 0.00 0.00 173.24 174.51 2a77 s LEU 11 N -0.50 0.61 0.27 2.44 2.96 0.17 -4.90 118.68 119.73 2a77 s LEU 11 Ca -0.01 -1.71 -0.29 0.00 -0.22 0.00 0.00 54.13 51.90 2a77 s LEU 11 Cb -0.04 -0.19 -0.10 0.00 0.50 0.00 0.00 46.19 46.36 2a77 s LEU 11 CO -0.00 -0.35 1.37 -2.84 -1.32 0.00 0.00 176.35 173.21 2a77 s PRO 12 N 1.56 4.31 -0.00 0.98 0.02 -1.26 -0.92 135.00 139.69 2a77 s PRO 12 Ca 0.14 2.24 -0.11 0.00 0.02 0.00 0.00 61.00 63.29 2a77 s PRO 12 Cb -0.19 -3.10 0.01 0.00 0.02 0.00 0.00 34.50 31.24 2a77 s PRO 12 CO -0.15 -0.31 0.23 0.54 -0.33 0.00 0.00 177.00 176.98 2a77 s VAL 13 N -0.43 0.07 0.06 3.83 0.11 -0.30 -4.88 120.40 118.86 2a77 s VAL 13 Ca 0.55 -0.59 -0.27 0.00 -2.93 0.00 0.00 61.98 58.74 2a77 s VAL 13 Cb -0.40 -0.54 -0.05 0.00 -1.53 0.00 0.00 36.38 33.86 2a77 s VAL 13 CO 0.47 -0.32 0.84 -0.44 -3.33 0.00 0.00 175.10 172.31 2a77 s SER 14 N -1.38 7.30 0.36 3.54 0.01 -1.26 -0.92 113.70 121.35 2a77 s SER 14 Ca -0.14 1.56 -0.28 0.00 1.31 0.00 0.00 55.95 58.40 2a77 s SER 14 Cb -0.06 -2.51 -0.12 0.00 0.21 0.00 0.00 66.02 63.54 2a77 s SER 14 CO 0.03 -0.03 1.39 0.18 0.41 0.00 0.00 173.24 175.22 2a77 n LEU 15 N 2.90 4.14 0.00 2.44 4.77 -1.26 -1.43 117.00 128.56 2a77 n LEU 15 Ca -0.00 1.22 0.00 0.00 -0.03 0.00 0.00 56.01 57.19 2a77 n LEU 15 Cb 0.50 -1.55 0.00 0.00 -2.33 0.00 0.00 43.42 40.04 2a77 n LEU 15 CO 0.49 -0.17 0.00 0.61 -1.33 0.00 0.00 177.39 176.99 2a77 n GLY 16 N 0.66 1.86 4.01 -0.72 0.00 0.12 -4.92 105.19 106.20 2a77 n GLY 16 Ca 0.03 0.00 -0.20 0.00 0.00 0.00 0.00 46.02 45.86 2a77 n GLY 16 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 2a77 s ASP 17 N -1.99 5.20 0.25 1.61 1.11 -0.51 -4.41 116.67 117.92 2a77 s ASP 17 Ca 0.00 -0.50 -0.17 0.00 0.18 0.00 0.00 52.55 52.05 2a77 s ASP 17 Cb 0.00 -0.25 -0.08 0.00 1.07 0.00 0.00 42.92 43.66 2a77 s ASP 17 CO 0.00 -1.19 0.71 0.00 1.18 0.00 0.00 175.17 175.86 2a77 s GLN 18 N -4.65 4.14 -0.01 8.23 -2.07 -1.25 -0.30 119.66 123.75 2a77 s GLN 18 Ca 0.60 0.76 0.03 0.00 -1.82 0.00 0.00 55.36 54.93 2a77 s GLN 18 Cb -0.08 -2.74 -0.01 0.00 -1.09 0.00 0.00 33.01 29.09 2a77 s GLN 18 CO 0.38 0.33 -0.11 0.00 -1.32 0.00 0.00 175.29 174.57 2a77 s ALA 19 N -1.66 0.89 -0.05 2.60 0.00 -0.05 -4.97 121.76 118.52 2a77 s ALA 19 Ca 0.46 -0.45 0.03 0.00 0.00 0.00 0.00 51.96 52.00 2a77 s ALA 19 Cb -0.14 -0.24 0.01 0.00 0.00 0.00 0.00 23.12 22.74 2a77 s ALA 19 CO 0.20 0.21 -0.13 0.45 0.00 0.00 0.00 175.76 176.49 2a77 s SER 20 N -0.21 1.76 -0.07 0.00 0.15 -1.26 -1.21 113.70 112.86 2a77 s SER 20 Ca 0.04 -0.29 0.03 0.00 0.70 0.00 0.00 55.95 56.42 2a77 s SER 20 Cb -0.05 -0.62 0.01 0.00 -1.71 0.00 0.00 66.02 63.65 2a77 s SER 20 CO -0.00 0.08 -0.15 -0.63 1.20 0.00 0.00 173.24 173.74 2a77 s ILE 21 N 0.34 1.31 0.08 6.45 1.01 0.16 -4.75 121.20 125.81 2a77 s ILE 21 Ca -0.08 -0.59 0.04 0.00 0.00 0.00 0.00 60.65 60.02 2a77 s ILE 21 Cb -0.13 -1.17 -0.04 0.00 0.01 0.00 0.00 42.46 41.14 2a77 s ILE 21 CO 0.02 0.39 0.03 -0.55 0.00 0.00 0.00 174.94 174.84 2a77 s SER 22 N 0.52 5.23 -0.04 3.58 0.15 -0.47 -0.15 113.70 122.52 2a77 s SER 22 Ca -0.14 -0.11 -0.01 0.00 0.70 0.00 0.00 55.95 56.39 2a77 s SER 22 Cb -0.15 -1.31 0.03 0.00 -1.71 0.00 0.00 66.02 62.87 2a77 s SER 22 CO 0.04 0.18 0.04 0.00 1.20 0.00 0.00 173.24 174.70 2a77 s ARG 24 N 1.85 2.41 0.17 0.00 1.70 -0.36 0.52 118.95 125.25 2a77 s ARG 24 Ca 0.01 -0.78 0.04 0.00 -0.47 0.00 0.00 55.73 54.54 2a77 s ARG 24 Cb -0.12 -2.27 -0.04 0.00 -0.57 0.00 0.00 34.95 31.95 2a77 s ARG 24 CO -0.03 0.58 0.22 0.00 -1.08 0.00 0.00 175.30 174.99 2a77 h SER 26 N 2.10 0.00 -5.12 0.00 4.64 -1.30 -3.47 113.55 110.40 2a77 h SER 26 Ca -0.48 -0.03 -0.03 0.00 -0.47 0.00 0.00 61.79 60.77 2a77 h SER 26 Cb 1.20 0.00 -0.10 0.00 -0.31 0.00 0.00 62.40 63.19 2a77 h SER 26 CO 0.65 0.01 -0.03 0.00 -0.87 0.00 0.00 176.83 176.59 2a77 s GLN 27 N -3.16 1.36 0.23 4.77 -2.07 -1.26 -4.95 119.66 114.57 2a77 s GLN 27 Ca 0.08 -0.93 -0.30 0.00 -1.82 0.00 0.00 55.36 52.39 2a77 s GLN 27 Cb 0.10 0.50 -0.15 0.00 -1.09 0.00 0.00 33.01 32.36 2a77 s GLN 27 CO 0.65 -0.57 0.96 0.45 -1.32 0.00 0.00 175.29 175.46 2a77 n SER 28 N -0.32 0.76 -0.93 12.60 2.88 -1.26 -4.94 113.62 122.41 2a77 n SER 28 Ca -0.09 1.16 0.03 0.00 -1.33 0.00 0.00 58.87 58.64 2a77 n SER 28 Cb 0.62 -1.19 0.16 0.00 -0.75 0.00 0.00 64.21 63.05 2a77 n SER 28 CO 0.00 0.00 0.00 2.30 -1.23 0.00 0.00 175.04 176.11 2a77 n ILE 29 N 0.58 1.82 -2.90 2.46 -5.35 -1.26 -5.00 119.36 109.70 2a77 n ILE 29 Ca 0.13 -2.92 -0.40 0.00 -0.27 0.00 0.00 62.75 59.29 2a77 n ILE 29 Cb 0.28 -0.06 -0.05 0.00 -1.74 0.00 0.00 39.64 38.07 2a77 n ILE 29 CO 0.00 0.00 0.00 -0.69 -1.76 0.00 0.00 176.55 174.10 2a77 s VAL 30 N -2.78 4.69 0.58 7.28 1.01 -1.26 -4.07 120.40 125.86 2a77 s VAL 30 Ca 0.38 1.76 0.04 0.00 0.00 0.00 0.00 61.98 64.16 2a77 s VAL 30 Cb 0.38 -4.18 0.07 0.00 0.00 0.00 0.00 36.38 32.65 2a77 s VAL 30 CO -0.08 0.33 0.81 -0.54 0.00 0.00 0.00 175.10 175.62 2a77 s LYS 31 N 0.07 2.29 0.51 2.72 1.02 0.39 -4.96 119.74 121.77 2a77 s LYS 31 Ca 0.42 -1.15 0.34 0.00 0.02 0.00 0.00 55.97 55.59 2a77 s LYS 31 Cb -0.21 -2.52 1.59 0.00 -0.52 0.00 0.00 37.83 36.16 2a77 s LYS 31 CO 0.25 -0.88 2.01 0.66 -0.92 0.00 0.00 175.35 176.47 2a77 h SER 32 N 0.02 0.00 -0.37 2.83 4.64 -1.98 0.20 113.55 118.89 2a77 h SER 32 Ca -0.37 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.95 2a77 h SER 32 Cb 1.28 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.37 2a77 h SER 32 CO 0.45 0.00 0.00 0.59 -0.87 0.00 0.00 176.83 177.00 2a77 n ASN 33 N -2.83 2.18 0.00 4.97 3.02 -1.26 -4.92 115.26 116.41 2a77 n ASN 33 Ca -0.00 -1.94 0.00 0.00 -0.03 0.00 0.00 54.58 52.60 2a77 n ASN 33 Cb 0.19 -0.25 0.00 0.00 -0.61 0.00 0.00 39.78 39.12 2a77 n ASN 33 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2a77 n GLY 34 N 1.17 1.12 3.91 7.41 0.00 0.71 -5.03 105.19 114.48 2a77 n GLY 34 Ca 0.15 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.89 2a77 n GLY 34 CO 0.00 0.00 0.00 -2.38 0.00 0.00 0.00 173.32 170.94 2a77 s HIS 35 N -3.10 3.49 -0.19 1.61 -3.43 -1.25 -4.79 115.29 107.63 2a77 s HIS 35 Ca 0.00 0.66 -0.00 0.00 -0.80 0.00 0.00 55.06 54.91 2a77 s HIS 35 Cb 0.00 -2.13 0.01 0.00 -1.43 0.00 0.00 32.58 29.03 2a77 s HIS 35 CO 0.00 0.09 -0.15 0.99 -2.00 0.00 0.00 174.74 173.67 2a77 s THR 36 N -2.21 2.44 -1.12 -5.38 2.01 -1.26 -0.46 115.64 109.65 2a77 s THR 36 Ca 0.44 -0.82 -0.03 0.00 0.31 0.00 0.00 61.69 61.59 2a77 s THR 36 Cb -0.10 -2.06 0.26 0.00 0.01 0.00 0.00 72.50 70.61 2a77 s THR 36 CO 0.32 0.50 1.92 -1.22 -0.69 0.00 0.00 174.62 175.45 2a77 n TYR 37 N 4.67 2.65 -3.37 4.92 4.02 -1.26 -4.00 117.16 124.80 2a77 n TYR 37 Ca -0.20 -2.64 -0.39 0.00 -0.01 0.00 0.00 57.90 54.66 2a77 n TYR 37 Cb 0.50 -1.40 -0.09 0.00 -0.02 0.00 0.00 39.34 38.33 2a77 n TYR 37 CO 0.00 0.00 0.00 -1.17 -1.01 0.00 0.00 176.86 174.68 2a77 s LEU 38 N -3.35 4.05 0.19 7.72 2.96 -1.26 -1.14 118.68 127.85 2a77 s LEU 38 Ca 0.41 0.33 0.10 0.00 -0.22 0.00 0.00 54.13 54.75 2a77 s LEU 38 Cb 0.16 -2.46 -0.04 0.00 0.50 0.00 0.00 46.19 44.35 2a77 s LEU 38 CO -0.08 -0.19 -0.14 -1.61 -1.32 0.00 0.00 176.35 173.01 2a77 s GLU 39 N 2.05 1.89 -0.03 1.98 8.01 0.26 -0.65 118.70 132.20 2a77 s GLU 39 Ca 0.16 -1.36 0.07 0.00 0.01 0.00 0.00 54.97 53.85 2a77 s GLU 39 Cb -0.16 -2.05 -0.02 0.00 -4.31 0.00 0.00 34.13 27.59 2a77 s GLU 39 CO 0.10 0.42 -0.26 -1.58 0.01 0.00 0.00 175.26 173.95 2a77 s TRP 40 N -1.71 2.37 0.07 1.61 0.52 -0.09 -1.86 118.94 119.85 2a77 s TRP 40 Ca 0.24 -0.53 0.09 0.00 0.02 0.00 0.00 56.10 55.92 2a77 s TRP 40 Cb -0.08 -1.53 -0.03 0.00 -1.15 0.00 0.00 33.47 30.67 2a77 s TRP 40 CO 0.13 -0.09 -0.24 0.71 0.02 0.00 0.00 176.95 177.48 2a77 s TYR 41 N -0.47 2.10 -0.16 -1.98 1.51 -0.02 -0.72 117.35 117.61 2a77 s TYR 41 Ca 0.06 -0.40 0.00 0.00 -1.01 0.00 0.00 57.07 55.73 2a77 s TYR 41 Cb -0.11 -1.21 0.00 0.00 -0.11 0.00 0.00 41.96 40.53 2a77 s TYR 41 CO 0.01 0.18 -0.16 -1.17 -1.11 0.00 0.00 175.55 173.29 2a77 s LEU 42 N -1.51 2.38 -0.16 -1.29 2.96 -0.09 -0.67 118.68 120.29 2a77 s LEU 42 Ca 0.10 -0.52 -0.01 0.00 -0.22 0.00 0.00 54.13 53.48 2a77 s LEU 42 Cb -0.10 -1.54 -0.00 0.00 0.50 0.00 0.00 46.19 45.05 2a77 s LEU 42 CO 0.03 0.06 -0.13 -1.58 -1.32 0.00 0.00 176.35 173.41 2a77 s GLN 43 N 0.98 3.27 0.46 1.98 0.74 0.34 -0.83 119.66 126.60 2a77 s GLN 43 Ca -0.02 -0.72 -0.07 0.00 0.05 0.00 0.00 55.36 54.60 2a77 s GLN 43 Cb -0.15 -2.70 -0.04 0.00 1.10 0.00 0.00 33.01 31.22 2a77 s GLN 43 CO -0.03 0.00 0.78 0.15 -0.55 0.00 0.00 175.29 175.64 2a77 s LYS 44 N 0.87 3.61 0.39 1.67 -0.14 -1.26 -0.16 119.74 124.72 2a77 s LYS 44 Ca -0.04 0.28 0.10 0.00 -1.36 0.00 0.00 55.97 54.95 2a77 s LYS 44 Cb -0.15 -2.38 0.80 0.00 -1.68 0.00 0.00 37.83 34.42 2a77 s LYS 44 CO -0.00 -0.16 1.91 -1.35 -0.76 0.00 0.00 175.35 174.99 2a77 h PRO 45 N 0.53 0.19 -0.55 -1.68 0.11 -1.99 0.34 132.00 128.96 2a77 h PRO 45 Ca -0.47 -0.05 0.00 0.00 0.11 0.00 0.00 66.00 65.60 2a77 h PRO 45 Cb 1.20 -0.02 0.00 0.00 0.11 0.00 0.00 31.00 32.28 2a77 h PRO 45 CO 0.62 0.36 0.00 0.41 -0.21 0.00 0.00 178.00 179.18 2a77 n GLY 46 N -0.85 1.11 3.44 -0.55 0.00 -1.26 -4.96 105.19 102.12 2a77 n GLY 46 Ca -0.01 -0.31 -0.21 0.00 0.00 0.00 0.00 46.02 45.48 2a77 n GLY 46 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2a77 s LYS 47 N -1.64 1.57 0.55 1.61 1.02 0.12 -5.15 119.74 117.82 2a77 s LYS 47 Ca 0.19 -1.81 -0.11 0.00 0.02 0.00 0.00 55.97 54.26 2a77 s LYS 47 Cb 0.12 -1.14 -0.05 0.00 -0.52 0.00 0.00 37.83 36.24 2a77 s LYS 47 CO 0.09 0.01 0.94 -1.12 -0.92 0.00 0.00 175.35 174.36 2a77 s SER 48 N -3.45 6.36 0.59 2.83 0.01 -1.26 -4.67 113.70 114.10 2a77 s SER 48 Ca 0.30 1.33 -0.20 0.00 1.31 0.00 0.00 55.95 58.69 2a77 s SER 48 Cb 0.04 -2.42 -0.04 0.00 0.21 0.00 0.00 66.02 63.82 2a77 s SER 48 CO 0.12 -0.70 1.28 -2.65 0.41 0.00 0.00 173.24 171.70 2a77 n PRO 49 N -2.23 1.37 -4.94 12.44 -0.02 -1.26 -4.62 135.00 135.74 2a77 n PRO 49 Ca 0.05 0.52 -0.26 0.00 -2.02 0.00 0.00 63.50 61.78 2a77 n PRO 49 Cb 0.54 -2.49 -0.16 0.00 -0.02 0.00 0.00 33.50 31.37 2a77 n PRO 49 CO 0.00 0.00 0.00 0.15 1.98 0.00 0.00 175.50 177.63 2a77 s LYS 50 N -3.02 1.67 -0.02 -0.52 -0.14 -0.01 -4.94 119.74 112.76 2a77 s LYS 50 Ca 0.76 -0.68 -0.30 0.00 -1.36 0.00 0.00 55.97 54.38 2a77 s LYS 50 Cb -0.41 -1.56 -0.04 0.00 -1.68 0.00 0.00 37.83 34.14 2a77 s LYS 50 CO 0.46 0.38 1.21 -1.17 -0.76 0.00 0.00 175.35 175.47 2a77 s LEU 51 N -0.33 4.31 -0.13 3.17 2.96 -1.26 -0.91 118.68 126.48 2a77 s LEU 51 Ca 0.04 1.89 -0.09 0.00 -0.22 0.00 0.00 54.13 55.75 2a77 s LEU 51 Cb -0.09 -3.56 -0.06 0.00 0.50 0.00 0.00 46.19 42.98 2a77 s LEU 51 CO 0.00 -0.56 -0.22 0.18 -1.32 0.00 0.00 176.35 174.43 2a77 n LEU 52 N 4.88 1.36 -4.27 -0.68 4.77 0.11 -4.77 117.00 118.39 2a77 n LEU 52 Ca 0.11 0.23 -0.30 0.00 -0.03 0.00 0.00 56.01 56.01 2a77 n LEU 52 Cb 0.46 -0.53 -0.16 0.00 -2.33 0.00 0.00 43.42 40.86 2a77 n LEU 52 CO 0.56 0.03 -0.56 -0.63 -1.33 0.00 0.00 177.39 175.45 2a77 s ILE 53 N -2.40 1.92 0.12 -0.08 -1.09 -0.96 -1.33 121.20 117.37 2a77 s ILE 53 Ca -0.21 -1.03 0.07 0.00 -2.23 0.00 0.00 60.65 57.25 2a77 s ILE 53 Cb 0.06 -1.60 -0.04 0.00 -1.58 0.00 0.00 42.46 39.31 2a77 s ILE 53 CO 0.28 0.54 -0.18 -0.72 -1.23 0.00 0.00 174.94 173.63 2a77 s TYR 54 N -0.49 1.65 -1.40 3.97 -0.85 -0.36 -0.91 117.35 118.96 2a77 s TYR 54 Ca 0.07 -0.46 -0.05 0.00 -0.52 0.00 0.00 57.07 56.11 2a77 s TYR 54 Cb -0.10 -0.88 0.03 0.00 0.38 0.00 0.00 41.96 41.39 2a77 s TYR 54 CO -0.00 0.21 0.76 1.63 -1.52 0.00 0.00 175.55 176.63 2a77 n LYS 55 N 0.81 -4.91 0.00 -3.49 5.02 -0.75 -1.76 118.16 113.09 2a77 n LYS 55 Ca -0.17 0.58 0.00 0.00 -2.02 0.00 0.00 58.31 56.70 2a77 n LYS 55 Cb 0.55 -5.21 0.00 0.00 -0.02 0.00 0.00 35.03 30.35 2a77 n LYS 55 CO 0.00 0.00 0.00 0.28 -0.52 0.00 0.00 177.40 177.16 2a77 n VAL 56 N -4.43 0.00 -0.82 -0.18 0.31 0.17 -4.19 118.33 109.20 2a77 n VAL 56 Ca -0.18 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.15 2a77 n VAL 56 Cb 0.63 0.00 0.00 0.00 -0.91 0.00 0.00 33.84 33.56 2a77 n VAL 56 CO 0.00 0.00 0.00 -1.54 -1.32 0.00 0.00 176.83 173.97 2a77 n SER 57 N 2.58 0.36 -4.53 4.52 3.41 -1.18 -3.66 113.62 115.12 2a77 n SER 57 Ca 0.00 -1.18 -0.35 0.00 -0.26 0.00 0.00 58.87 57.08 2a77 n SER 57 Cb 0.00 -0.00 -0.11 0.00 -0.26 0.00 0.00 64.21 63.83 2a77 n SER 57 CO 0.00 0.00 0.00 0.20 -0.16 0.00 0.00 175.04 175.08 2a77 s ASN 58 N -0.19 5.16 0.10 4.04 -0.87 -0.72 -4.45 114.94 118.02 2a77 s ASN 58 Ca 0.00 -0.08 -0.31 0.00 -1.57 0.00 0.00 52.86 50.90 2a77 s ASN 58 Cb 0.00 -1.88 -0.07 0.00 -0.02 0.00 0.00 41.25 39.28 2a77 s ASN 58 CO 0.00 0.11 1.23 -0.13 -2.57 0.00 0.00 177.10 175.74 2a77 s ARG 59 N 0.73 4.43 0.84 -0.60 0.52 -1.26 -1.22 118.95 122.38 2a77 s ARG 59 Ca 0.01 1.85 -0.11 0.00 -0.52 0.00 0.00 55.73 56.96 2a77 s ARG 59 Cb -0.14 -3.30 0.09 0.00 0.52 0.00 0.00 34.95 32.12 2a77 s ARG 59 CO 0.02 -0.25 1.09 0.12 0.02 0.00 0.00 175.30 176.30 2a77 s PHE 60 N 0.80 2.57 -0.09 -0.53 5.36 -0.44 -4.90 117.98 120.75 2a77 s PHE 60 Ca 0.58 1.26 -0.39 0.00 -0.96 0.00 0.00 56.93 57.43 2a77 s PHE 60 Cb -0.32 -3.12 -0.17 0.00 -0.34 0.00 0.00 43.02 39.08 2a77 s PHE 60 CO 0.31 -2.04 1.49 0.43 -1.46 0.00 0.00 175.22 173.95 2a77 n SER 61 N -3.64 1.80 0.00 6.13 7.64 -1.26 -1.35 113.62 122.93 2a77 n SER 61 Ca 0.07 1.11 0.00 0.00 1.01 0.00 0.00 58.87 61.06 2a77 n SER 61 Cb 0.55 -1.14 0.00 0.00 -1.01 0.00 0.00 64.21 62.61 2a77 n SER 61 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2a77 n GLY 62 N 3.17 1.32 3.69 0.23 0.00 -1.26 -5.02 105.19 107.32 2a77 n GLY 62 Ca 0.22 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.82 2a77 n GLY 62 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2a77 s VAL 63 N -3.71 4.54 0.82 1.61 1.01 -0.46 -5.01 120.40 119.20 2a77 s VAL 63 Ca 0.00 1.83 -0.12 0.00 0.00 0.00 0.00 61.98 63.69 2a77 s VAL 63 Cb 0.00 -4.17 0.09 0.00 0.00 0.00 0.00 36.38 32.29 2a77 s VAL 63 CO 0.00 0.03 1.13 -2.16 0.00 0.00 0.00 175.10 174.10 2a77 s PRO 64 N 1.87 1.87 0.53 2.72 0.04 -1.26 -4.86 135.00 135.91 2a77 s PRO 64 Ca 0.52 0.36 0.25 0.00 0.04 0.00 0.00 61.00 62.17 2a77 s PRO 64 Cb -0.22 -1.92 1.48 0.00 0.04 0.00 0.00 34.50 33.88 2a77 s PRO 64 CO 0.22 -1.71 2.12 -0.44 0.04 0.00 0.00 177.00 177.23 2a77 h ASP 65 N -1.14 0.00 0.14 6.66 3.32 -2.01 -2.54 116.42 120.85 2a77 h ASP 65 Ca -0.48 0.00 0.00 0.00 0.02 0.00 0.00 57.03 56.57 2a77 h ASP 65 Cb 1.30 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.85 2a77 h ASP 65 CO 0.63 0.09 0.00 0.08 -1.72 0.00 0.00 179.24 178.32 2a77 h ARG 66 N 0.00 0.00 -6.04 3.56 0.11 -1.95 -3.41 114.38 106.65 2a77 h ARG 66 Ca -0.00 0.00 -0.57 0.00 0.10 0.00 0.00 59.98 59.51 2a77 h ARG 66 Cb 0.22 0.00 -0.06 0.00 1.11 0.00 0.00 29.97 31.24 2a77 h ARG 66 CO 0.01 0.00 0.00 -0.06 0.10 0.00 0.00 179.97 180.02 2a77 s PHE 67 N -3.86 3.65 -0.02 4.08 0.40 -0.96 -1.54 117.98 119.73 2a77 s PHE 67 Ca -0.03 1.19 -0.05 0.00 -0.60 0.00 0.00 56.93 57.44 2a77 s PHE 67 Cb 0.10 -2.65 0.00 0.00 0.51 0.00 0.00 43.02 40.98 2a77 s PHE 67 CO 0.35 0.28 0.11 -1.54 0.70 0.00 0.00 175.22 175.12 2a77 s SER 68 N 0.10 -0.02 -0.01 1.36 1.04 0.45 -4.90 113.70 111.72 2a77 s SER 68 Ca 0.32 -0.03 0.07 0.00 0.48 0.00 0.00 55.95 56.79 2a77 s SER 68 Cb -0.18 0.22 -0.02 0.00 0.10 0.00 0.00 66.02 66.14 2a77 s SER 68 CO 0.17 -0.21 -0.22 -0.83 0.98 0.00 0.00 173.24 173.12 2a77 s GLY 69 N -0.73 1.39 0.26 7.32 0.00 -1.26 -0.07 107.32 114.24 2a77 s GLY 69 Ca -0.08 -1.12 0.01 0.00 0.00 0.00 0.00 44.72 43.53 2a77 s GLY 69 CO 0.01 -0.95 0.25 -1.35 0.00 0.00 0.00 173.10 171.06 2a77 s SER 70 N -0.84 0.73 0.00 1.64 1.04 0.23 -4.24 113.70 112.26 2a77 s SER 70 Ca 0.11 -1.49 0.00 0.00 0.48 0.00 0.00 55.95 55.06 2a77 s SER 70 Cb -0.10 0.49 0.00 0.00 0.10 0.00 0.00 66.02 66.51 2a77 s SER 70 CO 0.01 -0.99 0.00 0.61 0.98 0.00 0.00 173.24 173.84 2a77 n GLY 71 N -0.43 2.81 3.51 7.32 0.00 -1.26 -0.64 105.19 116.49 2a77 n GLY 71 Ca 0.03 -1.37 -0.16 0.00 0.00 0.00 0.00 46.02 44.52 2a77 n GLY 71 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2a77 s SER 72 N 0.00 -0.62 1.06 1.61 1.04 -1.01 -5.00 113.70 110.78 2a77 s SER 72 Ca 0.00 0.84 0.00 0.00 0.48 0.00 0.00 55.95 57.27 2a77 s SER 72 Cb 0.00 0.76 0.00 0.00 0.10 0.00 0.00 66.02 66.88 2a77 s SER 72 CO 0.00 -0.48 0.00 0.61 0.98 0.00 0.00 173.24 174.35 2a77 n GLY 73 N 1.49 0.36 0.00 7.32 0.00 -1.26 -1.63 105.19 111.48 2a77 n GLY 73 Ca -0.18 0.63 0.00 0.00 0.00 0.00 0.00 46.02 46.48 2a77 n GLY 73 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 2a77 n THR 74 N 0.00 0.35 -4.47 2.61 -2.24 -1.26 -4.50 114.28 104.78 2a77 n THR 74 Ca 0.00 -0.57 -0.29 0.00 -2.27 0.00 0.00 64.05 60.91 2a77 n THR 74 Cb 0.00 0.94 -0.17 0.00 -2.10 0.00 0.00 70.33 69.00 2a77 n THR 74 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 2a77 s ASP 75 N -0.35 2.61 0.06 3.42 2.15 -0.64 -0.50 116.67 123.40 2a77 s ASP 75 Ca 0.00 -0.47 0.05 0.00 0.43 0.00 0.00 52.55 52.56 2a77 s ASP 75 Cb 0.00 -1.17 -0.03 0.00 -0.30 0.00 0.00 42.92 41.42 2a77 s ASP 75 CO 0.00 0.02 -0.15 -0.36 -0.17 0.00 0.00 175.17 174.51 2a77 s PHE 76 N 0.99 1.31 -0.04 -5.34 0.08 0.18 -2.40 117.98 112.76 2a77 s PHE 76 Ca -0.06 -0.41 0.00 0.00 0.12 0.00 0.00 56.93 56.59 2a77 s PHE 76 Cb -0.15 -0.76 0.02 0.00 -0.57 0.00 0.00 43.02 41.57 2a77 s PHE 76 CO -0.02 0.07 -0.02 0.99 -0.10 0.00 0.00 175.22 176.14 2a77 s THR 77 N -1.06 0.34 -0.19 0.64 2.01 0.19 0.23 115.64 117.81 2a77 s THR 77 Ca 0.01 0.02 -0.07 0.00 0.31 0.00 0.00 61.69 61.96 2a77 s THR 77 Cb -0.09 -0.42 -0.04 0.00 0.01 0.00 0.00 72.50 71.96 2a77 s THR 77 CO 0.02 0.19 0.04 -0.22 -0.69 0.00 0.00 174.62 173.96 2a77 s LEU 78 N 1.15 3.63 -0.05 4.42 2.96 0.79 -0.60 118.68 130.97 2a77 s LEU 78 Ca -0.08 -0.01 0.05 0.00 -0.22 0.00 0.00 54.13 53.87 2a77 s LEU 78 Cb -0.14 -1.92 -0.01 0.00 0.50 0.00 0.00 46.19 44.63 2a77 s LEU 78 CO -0.02 0.14 -0.20 -0.13 -1.32 0.00 0.00 176.35 174.82 2a77 s ARG 79 N 0.55 2.08 -0.23 1.98 3.00 0.90 -0.66 118.95 126.57 2a77 s ARG 79 Ca 0.02 -0.73 0.02 0.00 0.00 0.00 0.00 55.73 55.03 2a77 s ARG 79 Cb -0.13 -1.80 0.05 0.00 0.00 0.00 0.00 34.95 33.07 2a77 s ARG 79 CO 0.01 0.31 -0.12 0.42 0.00 0.00 0.00 175.30 175.93 2a77 s ILE 80 N -0.07 1.99 -0.55 1.52 1.01 -0.35 -0.41 121.20 124.34 2a77 s ILE 80 Ca -0.03 -1.37 0.25 0.00 0.00 0.00 0.00 60.65 59.50 2a77 s ILE 80 Cb -0.12 -2.06 0.31 0.00 0.01 0.00 0.00 42.46 40.59 2a77 s ILE 80 CO 0.03 0.09 1.74 0.77 0.00 0.00 0.00 174.94 177.56 2a77 h SER 81 N 7.85 0.00 -0.44 3.58 4.64 -1.56 -0.10 113.55 127.52 2a77 h SER 81 Ca -0.25 0.00 -0.19 0.00 -0.47 0.00 0.00 61.79 60.89 2a77 h SER 81 Cb 1.07 0.00 -0.15 0.00 -0.31 0.00 0.00 62.40 63.01 2a77 h SER 81 CO 0.49 0.00 -0.48 0.54 -0.87 0.00 0.00 176.83 176.51 2a77 n ARG 82 N -2.57 0.66 -1.66 4.77 1.74 -1.22 -3.91 116.66 114.47 2a77 n ARG 82 Ca 0.04 -1.85 -0.47 0.00 -0.77 0.00 0.00 57.85 54.80 2a77 n ARG 82 Cb 0.43 -1.44 -0.05 0.00 -1.02 0.00 0.00 32.46 30.38 2a77 n ARG 82 CO 0.00 0.00 0.00 0.28 -1.52 0.00 0.00 177.63 176.39 2a77 n VAL 83 N 2.23 0.11 -4.16 1.55 0.31 0.59 -4.48 118.33 114.48 2a77 n VAL 83 Ca 0.13 -0.02 -0.22 0.00 -0.01 0.00 0.00 64.34 64.22 2a77 n VAL 83 Cb 0.60 -1.50 -0.05 0.00 -0.91 0.00 0.00 33.84 31.98 2a77 n VAL 83 CO 0.00 0.00 0.00 -1.61 -1.32 0.00 0.00 176.83 173.90 2a77 s GLU 84 N 1.47 2.72 0.34 5.55 2.02 -1.26 0.14 118.70 129.68 2a77 s GLU 84 Ca 0.82 -1.18 0.08 0.00 0.02 0.00 0.00 54.97 54.72 2a77 s GLU 84 Cb -0.73 -2.44 0.79 0.00 0.10 0.00 0.00 34.13 31.86 2a77 s GLU 84 CO 0.42 0.38 1.85 0.00 0.02 0.00 0.00 175.26 177.93 2a77 h ALA 85 N 1.60 1.80 0.00 5.21 0.00 -2.00 0.40 119.26 126.27 2a77 h ALA 85 Ca -0.47 0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.46 2a77 h ALA 85 Cb 1.24 -0.13 0.00 0.00 0.00 0.00 0.00 17.79 18.91 2a77 h ALA 85 CO 0.61 -0.06 0.00 -0.85 0.00 0.00 0.00 179.25 178.95 2a77 n GLU 86 N -4.59 0.16 0.00 0.00 0.00 -1.26 -2.33 120.64 112.62 2a77 n GLU 86 Ca 0.18 0.17 0.12 0.00 0.00 0.00 0.00 57.16 57.63 2a77 n GLU 86 Cb 0.48 -1.50 0.17 0.00 0.00 0.00 0.00 31.44 30.59 2a77 n GLU 86 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.13 176.88 2a77 n ASP 87 N -1.34 1.22 -4.79 -1.84 8.00 0.13 -4.92 116.55 113.01 2a77 n ASP 87 Ca 0.06 -0.98 -0.36 0.00 0.71 0.00 0.00 54.79 54.22 2a77 n ASP 87 Cb 0.13 0.38 -0.06 0.00 -0.02 0.00 0.00 41.12 41.55 2a77 n ASP 87 CO 0.00 0.00 0.00 -0.76 -0.39 0.00 0.00 177.20 176.05 2a77 s LEU 88 N -2.66 4.20 0.00 0.64 1.43 -0.99 -4.89 118.68 116.42 2a77 s LEU 88 Ca 0.18 1.86 0.00 0.00 -1.03 0.00 0.00 54.13 55.14 2a77 s LEU 88 Cb 0.18 -4.17 0.00 0.00 0.03 0.00 0.00 46.19 42.23 2a77 s LEU 88 CO 0.62 -0.25 0.00 0.61 0.23 0.00 0.00 176.35 177.56 2a77 n GLY 89 N 0.25 0.27 3.43 -3.19 0.00 -0.97 -4.75 105.19 100.22 2a77 n GLY 89 Ca 0.04 -1.48 -0.35 0.00 0.00 0.00 0.00 46.02 44.23 2a77 n GLY 89 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2a77 s VAL 90 N -3.13 3.80 -0.16 1.61 1.01 0.78 -0.05 120.40 124.26 2a77 s VAL 90 Ca 0.00 -0.37 -0.10 0.00 0.00 0.00 0.00 61.98 61.52 2a77 s VAL 90 Cb 0.00 -2.71 -0.05 0.00 0.00 0.00 0.00 36.38 33.63 2a77 s VAL 90 CO 0.00 0.44 0.16 -0.31 0.00 0.00 0.00 175.10 175.39 2a77 s TYR 91 N 0.94 3.49 -0.07 5.22 1.51 0.43 -0.50 117.35 128.37 2a77 s TYR 91 Ca 0.01 0.45 0.05 0.00 -1.01 0.00 0.00 57.07 56.56 2a77 s TYR 91 Cb -0.14 -2.12 -0.00 0.00 -0.11 0.00 0.00 41.96 39.59 2a77 s TYR 91 CO 0.01 0.44 -0.21 0.71 -1.11 0.00 0.00 175.55 175.39 2a77 s TYR 92 N -0.12 2.16 0.67 2.71 2.02 0.15 -0.57 117.35 124.36 2a77 s TYR 92 Ca 0.12 -0.73 -0.09 0.00 -0.37 0.00 0.00 57.07 56.00 2a77 s TYR 92 Cb -0.12 -1.44 0.02 0.00 -0.40 0.00 0.00 41.96 40.02 2a77 s TYR 92 CO 0.01 -0.27 1.02 0.00 -1.57 0.00 0.00 175.55 174.75 2a77 s PHE 94 N -3.23 -0.73 -0.09 0.00 5.36 -0.78 -0.61 117.98 117.91 2a77 s PHE 94 Ca 0.57 1.74 0.04 0.00 -0.96 0.00 0.00 56.93 58.32 2a77 s PHE 94 Cb -0.11 0.26 -0.01 0.00 -0.34 0.00 0.00 43.02 42.83 2a77 s PHE 94 CO 0.48 -0.38 -0.23 1.14 -1.46 0.00 0.00 175.22 174.78 2a77 s GLN 95 N 0.22 2.93 -0.20 10.12 1.03 -0.25 -0.58 119.66 132.94 2a77 s GLN 95 Ca -0.01 -0.86 0.14 0.00 0.04 0.00 0.00 55.36 54.67 2a77 s GLN 95 Cb -0.04 -2.30 0.42 0.00 0.03 0.00 0.00 33.01 31.11 2a77 s GLN 95 CO 0.02 0.25 1.29 0.41 -2.54 0.00 0.00 175.29 174.71 2a77 n GLY 96 N 3.33 4.82 0.11 2.60 0.00 -0.29 -2.61 105.19 113.16 2a77 n GLY 96 Ca -0.18 -1.19 -0.16 0.00 0.00 0.00 0.00 46.02 44.49 2a77 n GLY 96 CO 0.00 0.00 0.00 1.76 0.00 0.00 0.00 173.32 175.08 2a77 h SER 97 N 0.81 0.32 -3.50 1.61 0.02 -1.87 -3.47 113.55 107.47 2a77 h SER 97 Ca 0.05 -0.50 -0.32 0.00 -0.84 0.00 0.00 61.79 60.18 2a77 h SER 97 Cb 1.22 -0.11 -0.34 0.00 0.14 0.00 0.00 62.40 63.31 2a77 h SER 97 CO 0.12 1.42 -0.74 -1.00 -1.14 0.00 0.00 176.83 175.50 2a77 s HIS 98 N -2.61 0.13 0.18 3.45 3.76 -1.26 -4.93 115.29 114.01 2a77 s HIS 98 Ca -0.10 0.09 -0.31 0.00 -0.15 0.00 0.00 55.06 54.59 2a77 s HIS 98 Cb 0.07 -0.31 -0.09 0.00 1.11 0.00 0.00 32.58 33.36 2a77 s HIS 98 CO 0.84 -0.11 1.41 0.42 -0.85 0.00 0.00 174.74 176.45 2a77 s ILE 99 N 1.10 2.99 0.17 0.60 -1.09 -1.26 -2.99 121.20 120.71 2a77 s ILE 99 Ca -0.09 0.77 -0.30 0.00 -2.23 0.00 0.00 60.65 58.80 2a77 s ILE 99 Cb -0.13 -3.49 -0.07 0.00 -1.58 0.00 0.00 42.46 37.19 2a77 s ILE 99 CO -0.03 0.09 1.01 -2.16 -1.23 0.00 0.00 174.94 172.63 2a77 s PRO 100 N 0.36 4.70 0.33 2.79 0.04 -1.26 -4.97 135.00 136.99 2a77 s PRO 100 Ca 0.62 1.57 -0.29 0.00 0.04 0.00 0.00 61.00 62.94 2a77 s PRO 100 Cb -0.39 -3.31 -0.10 0.00 0.04 0.00 0.00 34.50 30.73 2a77 s PRO 100 CO 0.36 0.23 1.29 -1.58 0.04 0.00 0.00 177.00 177.34 2a77 s TRP 101 N -0.39 3.09 0.08 0.56 0.51 -1.16 -4.63 118.94 117.00 2a77 s TRP 101 Ca 0.46 1.44 0.02 0.00 -2.12 0.00 0.00 56.10 55.91 2a77 s TRP 101 Cb -0.26 -3.64 -0.04 0.00 -0.81 0.00 0.00 33.47 28.72 2a77 s TRP 101 CO 0.33 -1.74 -0.07 0.95 -0.51 0.00 0.00 176.95 175.90 2a77 s THR 102 N -1.15 0.68 0.11 2.01 -4.23 -1.07 -4.99 115.64 107.00 2a77 s THR 102 Ca 0.49 -1.67 0.06 0.00 -1.18 0.00 0.00 61.69 59.39 2a77 s THR 102 Cb -0.39 -1.35 -0.04 0.00 1.34 0.00 0.00 72.50 72.06 2a77 s THR 102 CO 0.52 -0.71 -0.05 -0.36 -0.54 0.00 0.00 174.62 173.49 2a77 s PHE 103 N -2.88 2.85 1.03 3.99 0.40 -1.26 -1.09 117.98 121.02 2a77 s PHE 103 Ca 0.05 -0.10 -0.14 0.00 -0.60 0.00 0.00 56.93 56.14 2a77 s PHE 103 Cb 0.00 -1.46 0.20 0.00 0.51 0.00 0.00 43.02 42.27 2a77 s PHE 103 CO -0.03 0.46 1.11 0.20 0.70 0.00 0.00 175.22 177.67 2a77 s GLY 104 N -2.37 1.57 0.00 4.36 0.00 0.22 -4.51 107.32 106.59 2a77 s GLY 104 Ca 0.24 -0.54 0.30 0.00 0.00 0.00 0.00 44.72 44.72 2a77 s GLY 104 CO 0.16 0.12 1.97 0.61 0.00 0.00 0.00 173.10 175.97 2a77 n GLY 105 N -1.34 -0.75 0.00 0.20 0.00 -1.26 -4.71 105.19 97.33 2a77 n GLY 105 Ca 0.07 -0.28 0.00 0.00 0.00 0.00 0.00 46.02 45.81 2a77 n GLY 105 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2a77 n GLY 106 N 1.16 1.84 2.84 -0.02 0.00 -1.26 -5.05 105.19 104.70 2a77 n GLY 106 Ca 0.19 -1.64 -0.22 0.00 0.00 0.00 0.00 46.02 44.35 2a77 n GLY 106 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2a77 s THR 107 N -1.66 0.50 -0.38 2.61 2.01 0.26 -4.71 115.64 114.26 2a77 s THR 107 Ca 0.00 -0.03 -0.24 0.00 0.31 0.00 0.00 61.69 61.73 2a77 s THR 107 Cb 0.00 -0.58 0.01 0.00 0.01 0.00 0.00 72.50 71.95 2a77 s THR 107 CO 0.00 0.25 0.81 -0.75 -0.69 0.00 0.00 174.62 174.24 2a77 s LYS 108 N 1.39 3.70 -0.30 4.92 2.20 -0.29 -0.43 119.74 130.93 2a77 s LYS 108 Ca -0.04 0.28 -0.20 0.00 -0.36 0.00 0.00 55.97 55.65 2a77 s LYS 108 Cb -0.13 -3.83 -0.01 0.00 -1.51 0.00 0.00 37.83 32.34 2a77 s LYS 108 CO -0.03 -0.92 0.61 -1.17 -0.36 0.00 0.00 175.35 173.48 2a77 s LEU 109 N 3.21 4.14 0.24 5.43 2.96 0.93 -0.65 118.68 134.94 2a77 s LEU 109 Ca 0.32 0.42 0.10 0.00 -0.22 0.00 0.00 54.13 54.75 2a77 s LEU 109 Cb -0.13 -2.78 -0.05 0.00 0.50 0.00 0.00 46.19 43.73 2a77 s LEU 109 CO 0.18 -0.45 -0.18 -1.61 -1.32 0.00 0.00 176.35 172.97 2a77 s GLU 110 N 2.55 1.52 0.05 1.98 2.02 -0.10 -2.30 118.70 124.42 2a77 s GLU 110 Ca 0.24 -1.68 0.00 0.00 0.02 0.00 0.00 54.97 53.56 2a77 s GLU 110 Cb -0.15 -1.50 -0.04 0.00 0.10 0.00 0.00 34.13 32.54 2a77 s GLU 110 CO 0.11 0.27 0.15 -1.54 0.02 0.00 0.00 175.26 174.28 2a77 s SER 111 N -3.37 6.03 0.36 -0.19 1.04 -1.26 -1.15 113.70 115.15 2a77 s SER 111 Ca 0.26 0.18 -0.20 0.00 0.48 0.00 0.00 55.95 56.68 2a77 s SER 111 Cb -0.03 -1.78 -0.10 0.00 0.10 0.00 0.00 66.02 64.20 2a77 s SER 111 CO 0.11 0.20 0.86 -0.54 0.98 0.00 0.00 173.24 174.85 2a77 s LYS 112 N -2.28 4.23 0.35 4.02 1.02 -0.10 -4.72 119.74 122.27 2a77 s LYS 112 Ca 0.30 1.00 0.02 0.00 0.02 0.00 0.00 55.97 57.31 2a77 s LYS 112 Cb -0.13 -2.45 -0.01 0.00 -0.52 0.00 0.00 37.83 34.73 2a77 s LYS 112 CO 0.23 0.13 0.42 -0.98 -0.92 0.00 0.00 175.35 174.22 2a77 s ARG 113 N -2.78 1.92 0.56 1.68 1.70 -1.26 -4.82 118.95 115.94 2a77 s ARG 113 Ca 0.55 -1.91 -0.21 0.00 -0.47 0.00 0.00 55.73 53.70 2a77 s ARG 113 Cb -0.12 0.40 -0.04 0.00 -0.57 0.00 0.00 34.95 34.62 2a77 s ARG 113 CO 0.17 -0.77 1.31 0.00 -1.08 0.00 0.00 175.30 174.93 2a77 s ALA 114 N -3.08 2.73 0.61 7.88 0.00 -1.26 -4.99 121.76 123.65 2a77 s ALA 114 Ca 0.35 1.23 -0.20 0.00 0.00 0.00 0.00 51.96 53.34 2a77 s ALA 114 Cb 0.00 -3.53 -0.03 0.00 0.00 0.00 0.00 23.12 19.57 2a77 s ALA 114 CO 0.25 -1.30 1.32 -0.51 0.00 0.00 0.00 175.76 175.52 2a77 s ASP 115 N -1.16 4.87 -0.06 0.00 1.01 -1.26 -4.76 116.67 115.31 2a77 s ASP 115 Ca 0.73 2.68 -0.03 0.00 0.71 0.00 0.00 52.55 56.64 2a77 s ASP 115 Cb -0.37 -2.63 0.03 0.00 1.01 0.00 0.00 42.92 40.96 2a77 s ASP 115 CO 0.43 -1.83 0.14 0.00 0.21 0.00 0.00 175.17 174.12 2a77 s ALA 116 N -1.36 -0.28 0.49 5.23 0.00 -0.07 -4.90 121.76 120.87 2a77 s ALA 116 Ca 0.78 0.60 -0.18 0.00 0.00 0.00 0.00 51.96 53.16 2a77 s ALA 116 Cb -0.39 -0.39 -0.09 0.00 0.00 0.00 0.00 23.12 22.25 2a77 s ALA 116 CO 0.43 -0.13 0.98 0.00 0.00 0.00 0.00 175.76 177.04 2a77 s ALA 117 N 0.89 3.02 0.52 0.00 0.00 -1.26 -1.19 121.76 123.75 2a77 s ALA 117 Ca -0.07 0.30 -0.20 0.00 0.00 0.00 0.00 51.96 51.99 2a77 s ALA 117 Cb -0.09 -3.15 -0.07 0.00 0.00 0.00 0.00 23.12 19.82 2a77 s ALA 117 CO -0.04 -0.16 1.11 -1.25 0.00 0.00 0.00 175.76 175.41 2a77 s PRO 118 N -3.72 3.50 -0.29 0.00 0.04 -1.26 -4.49 135.00 128.77 2a77 s PRO 118 Ca 0.61 1.55 -0.18 0.00 0.04 0.00 0.00 61.00 63.02 2a77 s PRO 118 Cb -0.11 -2.05 -0.02 0.00 0.04 0.00 0.00 34.50 32.37 2a77 s PRO 118 CO 0.25 -0.72 0.52 0.99 0.04 0.00 0.00 177.00 178.08 2a77 s THR 119 N -1.82 5.05 -0.16 1.26 2.01 -0.49 -4.85 115.64 116.64 2a77 s THR 119 Ca 0.71 0.71 -0.05 0.00 0.31 0.00 0.00 61.69 63.36 2a77 s THR 119 Cb -0.22 -3.88 -0.04 0.00 0.01 0.00 0.00 72.50 68.38 2a77 s THR 119 CO 0.25 -0.02 0.02 -0.69 -0.69 0.00 0.00 174.62 173.50 2a77 s VAL 120 N 2.35 4.45 -0.04 3.82 1.01 -1.26 -0.68 120.40 130.05 2a77 s VAL 120 Ca 0.21 -0.16 0.01 0.00 0.00 0.00 0.00 61.98 62.04 2a77 s VAL 120 Cb -0.15 -2.97 0.02 0.00 0.00 0.00 0.00 36.38 33.28 2a77 s VAL 120 CO 0.11 0.49 -0.05 -0.44 0.00 0.00 0.00 175.10 175.21 2a77 s SER 121 N 0.16 0.97 0.01 3.32 0.01 -0.47 -4.96 113.70 112.75 2a77 s SER 121 Ca 0.02 -0.14 0.05 0.00 1.31 0.00 0.00 55.95 57.19 2a77 s SER 121 Cb -0.13 -0.46 -0.03 0.00 0.21 0.00 0.00 66.02 65.61 2a77 s SER 121 CO 0.01 -0.04 -0.11 -0.51 0.41 0.00 0.00 173.24 173.00 2a77 s ILE 122 N 0.84 3.28 -0.04 1.44 2.07 -1.26 -1.18 121.20 126.35 2a77 s ILE 122 Ca -0.12 -0.91 0.01 0.00 -1.41 0.00 0.00 60.65 58.22 2a77 s ILE 122 Cb -0.14 -2.40 0.02 0.00 0.13 0.00 0.00 42.46 40.07 2a77 s ILE 122 CO 0.01 0.40 -0.05 -0.36 -1.91 0.00 0.00 174.94 173.02 2a77 s PHE 123 N -0.94 0.77 0.98 3.50 0.40 0.15 -5.01 117.98 117.82 2a77 s PHE 123 Ca 0.16 -0.21 -0.12 0.00 -0.60 0.00 0.00 56.93 56.15 2a77 s PHE 123 Cb -0.11 -0.66 0.18 0.00 0.51 0.00 0.00 43.02 42.94 2a77 s PHE 123 CO 0.06 -0.18 1.10 -1.25 0.70 0.00 0.00 175.22 175.65 2a77 s PRO 124 N 0.81 0.61 0.43 0.24 0.04 -1.26 -2.08 135.00 133.78 2a77 s PRO 124 Ca -0.11 0.55 -0.25 0.00 0.04 0.00 0.00 61.00 61.23 2a77 s PRO 124 Cb -0.14 -1.76 -0.10 0.00 0.04 0.00 0.00 34.50 32.55 2a77 s PRO 124 CO 0.00 -2.62 1.19 -2.30 0.04 0.00 0.00 177.00 173.32 2a77 n PRO 125 N -4.10 1.72 -1.95 0.56 -0.02 -1.19 -4.78 135.00 125.23 2a77 n PRO 125 Ca 0.06 0.61 -0.32 0.00 -2.02 0.00 0.00 63.50 61.83 2a77 n PRO 125 Cb 0.57 -2.28 0.01 0.00 -0.02 0.00 0.00 33.50 31.78 2a77 n PRO 125 CO 0.00 0.00 0.00 -1.54 1.98 0.00 0.00 175.50 175.94 2a77 s SER 126 N -0.62 6.02 0.24 2.55 1.04 -1.26 -4.95 113.70 116.72 2a77 s SER 126 Ca 0.62 1.59 -0.06 0.00 0.48 0.00 0.00 55.95 58.58 2a77 s SER 126 Cb -0.52 -2.50 0.31 0.00 0.10 0.00 0.00 66.02 63.41 2a77 s SER 126 CO 0.57 -1.01 1.87 0.28 0.98 0.00 0.00 173.24 175.94 2a77 h SER 127 N 0.03 0.93 -0.05 7.02 0.02 -2.00 -1.93 113.55 117.56 2a77 h SER 127 Ca -0.45 0.00 0.03 0.00 -0.84 0.00 0.00 61.79 60.53 2a77 h SER 127 Cb 1.20 -0.20 -0.04 0.00 0.14 0.00 0.00 62.40 63.51 2a77 h SER 127 CO 0.60 0.62 -0.15 -0.33 -1.14 0.00 0.00 176.83 176.42 2a77 h GLU 128 N 1.08 -0.22 -0.68 3.45 3.07 -2.00 -2.72 114.58 116.56 2a77 h GLU 128 Ca 0.37 0.01 -0.06 0.00 -0.50 0.00 0.00 59.36 59.19 2a77 h GLU 128 Cb 0.08 0.05 -0.03 0.00 -0.84 0.00 0.00 28.75 28.01 2a77 h GLU 128 CO -0.14 -0.15 0.19 0.37 -1.40 0.00 0.00 179.01 177.89 2a77 h GLN 129 N -0.23 1.07 -0.14 2.33 4.15 -1.77 -1.37 115.11 119.17 2a77 h GLN 129 Ca 0.07 -0.24 0.04 0.00 0.77 0.00 0.00 58.65 59.29 2a77 h GLN 129 Cb 0.32 -0.15 -0.01 0.00 0.21 0.00 0.00 27.48 27.86 2a77 h GLN 129 CO -0.19 0.94 0.13 -0.07 -1.93 0.00 0.00 178.83 177.72 2a77 h LEU 130 N 1.01 0.00 -1.30 -2.39 3.38 -1.18 -0.93 115.31 113.90 2a77 h LEU 130 Ca 0.22 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.19 2a77 h LEU 130 Cb 0.33 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.08 2a77 h LEU 130 CO -0.00 0.00 0.00 0.71 0.09 0.00 0.00 178.44 179.24 2a77 h THR 131 N 0.00 0.00 -0.01 0.22 1.35 -0.93 -1.93 112.91 111.61 2a77 h THR 131 Ca 0.07 -0.54 0.00 0.00 -0.55 0.00 0.00 66.41 65.39 2a77 h THR 131 Cb 0.33 1.53 0.00 0.00 -1.73 0.00 0.00 68.15 68.28 2a77 h THR 131 CO -0.00 0.00 -0.38 -1.54 -0.25 0.00 0.00 175.52 173.35 2a77 n SER 132 N -3.05 1.05 0.00 5.36 3.41 -0.36 -4.96 113.62 115.06 2a77 n SER 132 Ca 0.01 -0.85 0.00 0.00 -0.26 0.00 0.00 58.87 57.77 2a77 n SER 132 Cb 0.32 0.25 0.00 0.00 -0.26 0.00 0.00 64.21 64.52 2a77 n SER 132 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2a77 n GLY 133 N 1.39 0.68 3.56 5.00 0.00 -0.72 -5.07 105.19 110.03 2a77 n GLY 133 Ca 0.10 -0.35 -0.26 0.00 0.00 0.00 0.00 46.02 45.51 2a77 n GLY 133 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2a77 s GLY 134 N -2.32 2.23 -0.24 -0.02 0.00 -1.15 -2.40 107.32 103.42 2a77 s GLY 134 Ca 0.00 -2.11 -0.03 0.00 0.00 0.00 0.00 44.72 42.58 2a77 s GLY 134 CO 0.00 -2.03 0.34 0.00 0.00 0.00 0.00 173.10 171.41 2a77 s ALA 135 N -2.62 -0.90 -0.16 3.20 0.00 -0.63 -3.35 121.76 117.31 2a77 s ALA 135 Ca 0.33 0.66 -0.04 0.00 0.00 0.00 0.00 51.96 52.91 2a77 s ALA 135 Cb 0.03 -1.64 -0.03 0.00 0.00 0.00 0.00 23.12 21.48 2a77 s ALA 135 CO 0.17 -1.31 -0.02 -1.12 0.00 0.00 0.00 175.76 173.47 2a77 s SER 136 N 2.49 4.92 -0.14 0.00 0.01 -1.26 -0.60 113.70 119.11 2a77 s SER 136 Ca 0.11 -0.09 -0.04 0.00 1.31 0.00 0.00 55.95 57.23 2a77 s SER 136 Cb -0.15 -1.79 -0.03 0.00 0.21 0.00 0.00 66.02 64.25 2a77 s SER 136 CO -0.17 0.18 0.01 -0.69 0.41 0.00 0.00 173.24 172.98 2a77 s VAL 137 N 0.31 4.34 -0.05 3.43 1.01 0.12 -3.19 120.40 126.38 2a77 s VAL 137 Ca -0.03 -0.21 0.06 0.00 0.00 0.00 0.00 61.98 61.81 2a77 s VAL 137 Cb -0.14 -2.90 -0.01 0.00 0.00 0.00 0.00 36.38 33.33 2a77 s VAL 137 CO 0.03 0.52 -0.25 -0.69 0.00 0.00 0.00 175.10 174.71 2a77 s VAL 138 N -0.03 2.02 -0.11 2.92 1.01 -0.88 -0.42 120.40 124.91 2a77 s VAL 138 Ca 0.04 -1.06 0.00 0.00 0.00 0.00 0.00 61.98 60.96 2a77 s VAL 138 Cb -0.13 -1.70 0.02 0.00 0.00 0.00 0.00 36.38 34.57 2a77 s VAL 138 CO 0.02 0.56 -0.10 0.00 0.00 0.00 0.00 175.10 175.59 2a77 s PHE 140 N 1.40 3.58 -0.40 0.00 0.08 -0.33 0.04 117.98 122.35 2a77 s PHE 140 Ca -0.00 0.61 0.03 0.00 0.12 0.00 0.00 56.93 57.69 2a77 s PHE 140 Cb -0.13 -2.11 0.12 0.00 -0.57 0.00 0.00 43.02 40.32 2a77 s PHE 140 CO -0.05 0.57 0.15 -0.51 -0.10 0.00 0.00 175.22 175.28 2a77 s LEU 141 N -0.60 3.69 -0.09 -0.37 1.02 -0.21 -1.36 118.68 120.76 2a77 s LEU 141 Ca 0.16 -2.38 -0.00 0.00 0.02 0.00 0.00 54.13 51.93 2a77 s LEU 141 Cb -0.13 -1.35 -0.03 0.00 0.02 0.00 0.00 46.19 44.70 2a77 s LEU 141 CO 0.05 -0.32 -0.06 0.20 0.02 0.00 0.00 176.35 176.24 2a77 s ASN 142 N 0.62 4.74 -0.80 2.29 0.01 0.14 -0.94 114.94 120.99 2a77 s ASN 142 Ca 0.14 -0.03 -0.01 0.00 -0.71 0.00 0.00 52.86 52.25 2a77 s ASN 142 Cb -0.22 -1.33 -0.02 0.00 0.41 0.00 0.00 41.25 40.09 2a77 s ASN 142 CO -0.08 0.32 0.68 0.59 -1.51 0.00 0.00 177.10 177.11 2a77 n ASN 143 N 2.48 -3.04 -4.81 -1.22 4.13 -0.35 -1.39 115.26 111.05 2a77 n ASN 143 Ca -0.18 -0.45 -0.22 0.00 1.68 0.00 0.00 54.58 55.40 2a77 n ASN 143 Cb 0.53 -3.75 -0.05 0.00 -1.54 0.00 0.00 39.78 34.97 2a77 n ASN 143 CO 0.00 0.00 0.00 0.72 0.28 0.00 0.00 177.26 178.26 2a77 s PHE 144 N -3.26 2.68 -0.27 3.10 -0.12 0.32 -4.58 117.98 115.85 2a77 s PHE 144 Ca 0.10 -0.51 -0.24 0.00 -0.05 0.00 0.00 56.93 56.24 2a77 s PHE 144 Cb -0.01 -2.03 0.08 0.00 -0.63 0.00 0.00 43.02 40.43 2a77 s PHE 144 CO 0.51 0.05 0.78 -0.47 -0.05 0.00 0.00 175.22 176.04 2a77 s TYR 145 N -2.51 -0.76 0.74 3.49 5.04 -0.33 -0.87 117.35 122.16 2a77 s TYR 145 Ca 0.44 1.78 -0.13 0.00 -2.44 0.00 0.00 57.07 56.73 2a77 s TYR 145 Cb -0.01 0.33 0.18 0.00 0.35 0.00 0.00 41.96 42.81 2a77 s TYR 145 CO 0.25 -0.37 0.84 -0.35 -1.34 0.00 0.00 175.55 174.59 2a77 n PRO 146 N 2.81 -1.56 0.16 4.97 -0.04 -1.26 -0.89 135.00 139.19 2a77 n PRO 146 Ca -0.15 -1.32 0.01 0.00 -0.04 0.00 0.00 63.50 62.00 2a77 n PRO 146 Cb 0.56 -1.01 0.26 0.00 -0.04 0.00 0.00 33.50 33.26 2a77 n PRO 146 CO 0.00 0.00 0.00 -0.22 -0.04 0.00 0.00 175.50 175.24 2a77 h LYS 147 N 0.00 0.00 -5.84 0.54 1.63 -1.98 -3.43 116.57 107.49 2a77 h LYS 147 Ca -0.29 0.00 -0.52 0.00 -0.85 0.00 0.00 60.65 58.99 2a77 h LYS 147 Cb 0.83 0.00 -0.00 0.00 -0.60 0.00 0.00 32.23 32.46 2a77 h LYS 147 CO 0.20 0.51 1.52 -0.51 -3.45 0.00 0.00 179.45 177.72 2a77 s ASP 148 N -6.81 4.99 -0.01 4.20 1.01 -1.26 -4.98 116.67 113.81 2a77 s ASP 148 Ca -0.02 1.29 -0.04 0.00 0.71 0.00 0.00 52.55 54.50 2a77 s ASP 148 Cb 0.13 -2.51 0.00 0.00 1.01 0.00 0.00 42.92 41.55 2a77 s ASP 148 CO 0.74 -2.42 0.08 -0.51 0.21 0.00 0.00 175.17 173.28 2a77 s ILE 149 N 10.10 0.04 -0.07 0.77 2.07 -1.26 -4.40 121.20 128.45 2a77 s ILE 149 Ca 0.94 -0.37 0.01 0.00 -1.41 0.00 0.00 60.65 59.82 2a77 s ILE 149 Cb -0.22 -0.25 -0.03 0.00 0.13 0.00 0.00 42.46 42.09 2a77 s ILE 149 CO 0.29 -0.20 -0.09 0.20 -1.91 0.00 0.00 174.94 173.23 2a77 s ASN 150 N -0.64 4.48 -0.08 4.50 0.01 -0.22 -4.98 114.94 118.01 2a77 s ASN 150 Ca -0.07 -0.09 -0.01 0.00 -0.71 0.00 0.00 52.86 51.98 2a77 s ASN 150 Cb -0.04 -1.17 -0.03 0.00 0.41 0.00 0.00 41.25 40.41 2a77 s ASN 150 CO 0.00 0.33 -0.03 -0.69 -1.51 0.00 0.00 177.10 175.21 2a77 s VAL 151 N -0.63 4.05 -0.04 1.60 1.01 -1.26 -1.17 120.40 123.96 2a77 s VAL 151 Ca 0.09 -0.35 0.03 0.00 0.00 0.00 0.00 61.98 61.75 2a77 s VAL 151 Cb -0.11 -2.68 0.00 0.00 0.00 0.00 0.00 36.38 33.58 2a77 s VAL 151 CO 0.02 0.60 -0.13 -0.75 0.00 0.00 0.00 175.10 174.84 2a77 s LYS 152 N -0.87 1.37 -0.09 2.72 2.47 -0.30 -4.97 119.74 120.08 2a77 s LYS 152 Ca 0.13 -0.44 -0.02 0.00 -1.56 0.00 0.00 55.97 54.08 2a77 s LYS 152 Cb -0.11 -1.21 -0.03 0.00 -1.46 0.00 0.00 37.83 35.01 2a77 s LYS 152 CO 0.02 0.15 0.02 -1.58 0.16 0.00 0.00 175.35 174.12 2a77 s TRP 153 N 0.19 3.20 0.01 4.03 0.52 -1.26 -0.44 118.94 125.20 2a77 s TRP 153 Ca -0.05 0.22 0.05 0.00 0.02 0.00 0.00 56.10 56.35 2a77 s TRP 153 Cb -0.11 -1.80 -0.02 0.00 -1.15 0.00 0.00 33.47 30.40 2a77 s TRP 153 CO 0.01 0.50 -0.16 0.15 0.02 0.00 0.00 176.95 177.47 2a77 s LYS 154 N -0.92 1.21 -0.18 4.98 1.02 -0.26 -0.93 119.74 124.65 2a77 s LYS 154 Ca 0.14 -0.68 -0.01 0.00 0.02 0.00 0.00 55.97 55.44 2a77 s LYS 154 Cb -0.11 -1.21 0.01 0.00 -0.52 0.00 0.00 37.83 35.99 2a77 s LYS 154 CO 0.03 0.32 -0.14 0.42 -0.92 0.00 0.00 175.35 175.05 2a77 s ILE 155 N -0.58 2.60 -1.45 2.17 1.01 0.30 -0.98 121.20 124.27 2a77 s ILE 155 Ca 0.05 -0.77 -0.14 0.00 0.00 0.00 0.00 60.65 59.79 2a77 s ILE 155 Cb -0.07 -2.12 0.12 0.00 0.01 0.00 0.00 42.46 40.40 2a77 s ILE 155 CO 0.00 0.50 0.63 0.47 0.00 0.00 0.00 174.94 176.54 2a77 n ASP 156 N 4.49 -3.37 0.00 3.58 8.00 0.10 -1.99 116.55 127.37 2a77 n ASP 156 Ca -0.20 -0.68 0.00 0.00 0.71 0.00 0.00 54.79 54.62 2a77 n ASP 156 Cb 0.51 -2.78 0.00 0.00 -0.02 0.00 0.00 41.12 38.83 2a77 n ASP 156 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2a77 n GLY 157 N -1.25 0.53 3.19 0.44 0.00 -1.26 -5.01 105.19 101.83 2a77 n GLY 157 Ca 0.04 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 45.82 2a77 n GLY 157 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2a77 s SER 158 N -2.96 2.13 0.38 1.61 0.01 -0.84 -5.05 113.70 108.98 2a77 s SER 158 Ca 0.00 -0.40 -0.28 0.00 1.31 0.00 0.00 55.95 56.58 2a77 s SER 158 Cb 0.00 -0.20 -0.11 0.00 0.21 0.00 0.00 66.02 65.92 2a77 s SER 158 CO 0.00 0.17 1.46 -0.70 0.41 0.00 0.00 173.24 174.58 2a77 s GLU 159 N -0.75 4.10 -0.13 12.44 2.12 -1.26 -0.53 118.70 134.68 2a77 s GLU 159 Ca 0.06 2.52 0.02 0.00 0.36 0.00 0.00 54.97 57.93 2a77 s GLU 159 Cb -0.08 -2.95 0.02 0.00 0.26 0.00 0.00 34.13 31.38 2a77 s GLU 159 CO 0.00 -0.52 -0.18 0.50 -0.54 0.00 0.00 175.26 174.53 2a77 s ARG 160 N -2.09 2.58 -0.27 4.30 6.06 -0.11 -4.78 118.95 124.63 2a77 s ARG 160 Ca 0.53 -0.68 -0.07 0.00 -2.50 0.00 0.00 55.73 53.00 2a77 s ARG 160 Cb -0.45 -2.18 -0.14 0.00 0.06 0.00 0.00 34.95 32.24 2a77 s ARG 160 CO 0.61 -0.10 -0.31 1.04 -2.50 0.00 0.00 175.30 174.05 2a77 n GLN 161 N 4.31 0.61 -2.06 5.12 1.13 -1.26 -4.18 117.38 121.05 2a77 n GLN 161 Ca -0.19 0.21 -0.41 0.00 -1.94 0.00 0.00 57.00 54.67 2a77 n GLN 161 Cb 0.51 -1.50 -0.02 0.00 0.11 0.00 0.00 30.24 29.34 2a77 n GLN 161 CO 0.00 0.00 0.00 -0.80 -1.44 0.00 0.00 177.06 174.82 2a77 s ASN 162 N -7.09 6.71 0.00 1.08 0.01 -1.26 -3.16 114.94 111.23 2a77 s ASN 162 Ca -0.37 2.60 0.00 0.00 -0.71 0.00 0.00 52.86 54.37 2a77 s ASN 162 Cb 0.12 -2.62 0.00 0.00 0.41 0.00 0.00 41.25 39.17 2a77 s ASN 162 CO 0.53 -0.66 0.00 0.61 -1.51 0.00 0.00 177.10 176.07 2a77 n GLY 163 N 2.29 0.78 3.66 0.66 0.00 -1.26 -4.83 105.19 106.50 2a77 n GLY 163 Ca 0.07 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.71 2a77 n GLY 163 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2a77 s VAL 164 N -2.16 5.20 -0.07 1.61 1.01 -1.19 -0.79 120.40 124.01 2a77 s VAL 164 Ca 0.00 0.67 0.04 0.00 0.00 0.00 0.00 61.98 62.70 2a77 s VAL 164 Cb 0.00 -3.72 -0.00 0.00 0.00 0.00 0.00 36.38 32.66 2a77 s VAL 164 CO 0.00 0.24 -0.21 -0.76 0.00 0.00 0.00 175.10 174.37 2a77 s LEU 165 N 1.41 1.97 0.08 3.92 1.43 0.22 -4.95 118.68 122.75 2a77 s LEU 165 Ca 0.18 -0.45 0.05 0.00 -1.03 0.00 0.00 54.13 52.88 2a77 s LEU 165 Cb -0.15 -1.19 -0.04 0.00 0.03 0.00 0.00 46.19 44.84 2a77 s LEU 165 CO 0.08 0.16 -0.05 0.20 0.23 0.00 0.00 176.35 176.97 2a77 s ASN 166 N 0.16 4.71 -0.06 2.29 0.02 -1.26 -0.75 114.94 120.05 2a77 s ASN 166 Ca -0.10 -0.25 -0.09 0.00 -1.02 0.00 0.00 52.86 51.41 2a77 s ASN 166 Cb -0.15 -1.04 0.02 0.00 0.02 0.00 0.00 41.25 40.10 2a77 s ASN 166 CO 0.05 0.20 0.23 -0.55 0.02 0.00 0.00 177.10 177.04 2a77 s SER 167 N -2.08 -0.18 0.02 -1.22 0.15 -0.43 -4.99 113.70 104.96 2a77 s SER 167 Ca 0.22 0.27 0.08 0.00 0.70 0.00 0.00 55.95 57.23 2a77 s SER 167 Cb -0.11 0.40 -0.02 0.00 -1.71 0.00 0.00 66.02 64.57 2a77 s SER 167 CO 0.14 -0.20 -0.24 0.26 1.20 0.00 0.00 173.24 174.40 2a77 s TRP 168 N -0.40 2.16 0.69 3.44 0.51 -1.26 -0.53 118.94 123.55 2a77 s TRP 168 Ca -0.05 -0.40 -0.11 0.00 -2.12 0.00 0.00 56.10 53.42 2a77 s TRP 168 Cb -0.03 -1.33 0.01 0.00 -0.81 0.00 0.00 33.47 31.30 2a77 s TRP 168 CO 0.01 0.05 1.06 0.95 -0.51 0.00 0.00 176.95 178.51 2a77 s THR 169 N -0.70 3.96 0.92 2.01 -4.23 -0.46 -5.01 115.64 112.13 2a77 s THR 169 Ca 0.10 0.65 -0.11 0.00 -1.18 0.00 0.00 61.69 61.16 2a77 s THR 169 Cb -0.09 -3.36 0.14 0.00 1.34 0.00 0.00 72.50 70.53 2a77 s THR 169 CO 0.01 -0.81 1.11 -1.81 -0.54 0.00 0.00 174.62 172.57 2a77 s ASP 170 N -3.70 3.07 0.21 3.99 -0.00 -1.26 -4.61 116.67 114.37 2a77 s ASP 170 Ca 0.59 1.92 -0.32 0.00 -0.00 0.00 0.00 52.55 54.74 2a77 s ASP 170 Cb -0.14 -2.47 -0.12 0.00 -0.00 0.00 0.00 42.92 40.18 2a77 s ASP 170 CO 0.54 -2.96 1.68 1.67 -0.00 0.00 0.00 175.17 176.09 2a77 n GLN 171 N -4.13 2.66 -1.86 8.23 7.27 -1.26 -4.78 117.38 123.51 2a77 n GLN 171 Ca 0.09 0.96 -0.42 0.00 0.07 0.00 0.00 57.00 57.70 2a77 n GLN 171 Cb 0.53 -2.78 -0.03 0.00 2.41 0.00 0.00 30.24 30.37 2a77 n GLN 171 CO 0.00 0.00 0.00 0.34 0.07 0.00 0.00 177.06 177.47 2a77 s ASP 172 N 1.01 6.50 0.35 1.69 -1.08 0.76 -4.90 116.67 121.01 2a77 s ASP 172 Ca 0.74 2.36 0.08 0.00 -0.52 0.00 0.00 52.55 55.21 2a77 s ASP 172 Cb -0.53 -2.53 0.79 0.00 -1.46 0.00 0.00 42.92 39.19 2a77 s ASP 172 CO 0.36 -1.05 1.88 -1.28 0.52 0.00 0.00 175.17 175.60 2a77 h SER 173 N 10.30 0.67 0.14 -0.34 0.87 -1.89 0.17 113.55 123.46 2a77 h SER 173 Ca -0.43 0.03 -0.26 0.00 -1.23 0.00 0.00 61.79 59.90 2a77 h SER 173 Cb 1.20 -0.10 0.01 0.00 -0.44 0.00 0.00 62.40 63.07 2a77 h SER 173 CO 0.95 0.36 -1.27 0.11 -0.53 0.00 0.00 176.83 176.45 2a77 h LYS 174 N 0.72 0.29 0.00 2.24 1.57 -1.97 -3.40 116.57 116.01 2a77 h LYS 174 Ca 0.43 -0.50 0.00 0.00 -1.87 0.00 0.00 60.65 58.71 2a77 h LYS 174 Cb 0.63 0.18 0.00 0.00 0.08 0.00 0.00 32.23 33.13 2a77 h LYS 174 CO -0.19 1.24 0.00 -0.40 -0.57 0.00 0.00 179.45 179.53 2a77 n ASP 175 N -3.95 1.41 -0.27 0.86 5.75 -1.21 -5.00 116.55 114.15 2a77 n ASP 175 Ca -0.21 -1.41 -0.03 0.00 -0.01 0.00 0.00 54.79 53.13 2a77 n ASP 175 Cb 0.90 0.00 -0.01 0.00 -1.03 0.00 0.00 41.12 40.98 2a77 n ASP 175 CO 0.00 0.00 0.00 -1.20 -0.11 0.00 0.00 177.20 175.89 2a77 n SER 176 N -0.20 -4.89 -4.84 -1.12 7.64 0.04 -4.99 113.62 105.26 2a77 n SER 176 Ca 0.00 0.09 -0.24 0.00 1.01 0.00 0.00 58.87 59.73 2a77 n SER 176 Cb 0.10 -2.69 0.07 0.00 -1.01 0.00 0.00 64.21 60.68 2a77 n SER 176 CO 0.00 0.00 0.00 0.42 -3.01 0.00 0.00 175.04 172.45 2a77 s THR 177 N -1.64 2.37 0.23 0.44 -4.23 -1.26 -4.68 115.64 106.87 2a77 s THR 177 Ca 0.00 -0.49 0.10 0.00 -1.18 0.00 0.00 61.69 60.12 2a77 s THR 177 Cb 0.00 -2.89 -0.04 0.00 1.34 0.00 0.00 72.50 70.91 2a77 s THR 177 CO 0.00 0.00 -0.10 -0.31 -0.54 0.00 0.00 174.62 173.67 2a77 s TYR 178 N -3.07 2.55 0.07 3.99 2.02 -0.05 -0.17 117.35 122.69 2a77 s TYR 178 Ca 0.61 -0.26 0.01 0.00 -0.37 0.00 0.00 57.07 57.07 2a77 s TYR 178 Cb -0.09 -1.19 -0.04 0.00 -0.40 0.00 0.00 41.96 40.25 2a77 s TYR 178 CO 0.43 0.58 -0.06 -1.12 -1.57 0.00 0.00 175.55 173.81 2a77 s SER 179 N -3.20 0.88 -0.01 2.29 0.01 -1.26 -0.52 113.70 111.89 2a77 s SER 179 Ca 0.27 -0.88 -0.01 0.00 1.31 0.00 0.00 55.95 56.64 2a77 s SER 179 Cb -0.07 0.11 0.01 0.00 0.21 0.00 0.00 66.02 66.27 2a77 s SER 179 CO 0.16 -0.43 0.03 -0.32 0.41 0.00 0.00 173.24 173.09 2a77 s MET 180 N -3.25 0.02 -0.03 12.44 1.75 -0.12 -1.35 119.30 128.77 2a77 s MET 180 Ca 0.05 0.05 0.04 0.00 -1.25 0.00 0.00 55.69 54.58 2a77 s MET 180 Cb 0.02 -0.01 -0.03 0.00 2.84 0.00 0.00 34.83 37.65 2a77 s MET 180 CO -0.05 -0.02 -0.14 0.45 -0.65 0.00 0.00 175.02 174.62 2a77 s SER 181 N 0.12 4.09 -0.07 1.11 0.15 0.31 -1.05 113.70 118.37 2a77 s SER 181 Ca -0.01 -0.22 0.01 0.00 0.70 0.00 0.00 55.95 56.44 2a77 s SER 181 Cb -0.01 -0.85 0.02 0.00 -1.71 0.00 0.00 66.02 63.46 2a77 s SER 181 CO -0.00 0.32 -0.10 -0.55 1.20 0.00 0.00 173.24 174.11 2a77 s SER 182 N -0.94 1.68 -0.14 5.45 0.15 0.11 -1.32 113.70 118.68 2a77 s SER 182 Ca 0.13 -0.26 0.02 0.00 0.70 0.00 0.00 55.95 56.53 2a77 s SER 182 Cb -0.11 -0.75 0.02 0.00 -1.71 0.00 0.00 66.02 63.47 2a77 s SER 182 CO 0.02 -0.02 -0.18 -0.89 1.20 0.00 0.00 173.24 173.37 2a77 s THR 183 N 0.92 1.80 -0.37 6.45 2.01 0.07 -0.60 115.64 125.93 2a77 s THR 183 Ca -0.10 -0.81 -0.12 0.00 0.31 0.00 0.00 61.69 60.97 2a77 s THR 183 Cb -0.15 -1.63 0.02 0.00 0.01 0.00 0.00 72.50 70.75 2a77 s THR 183 CO 0.01 0.50 0.22 -0.22 -0.69 0.00 0.00 174.62 174.43 2a77 s LEU 184 N 1.07 4.69 -0.23 4.42 2.96 0.44 -0.61 118.68 131.42 2a77 s LEU 184 Ca -0.03 -0.87 -0.09 0.00 -0.22 0.00 0.00 54.13 52.93 2a77 s LEU 184 Cb -0.14 -2.05 -0.04 0.00 0.50 0.00 0.00 46.19 44.45 2a77 s LEU 184 CO -0.05 -0.36 0.11 -0.89 -1.32 0.00 0.00 176.35 173.84 2a77 s THR 185 N 1.60 4.95 0.32 3.68 2.01 0.03 0.14 115.64 128.36 2a77 s THR 185 Ca 0.03 0.04 0.08 0.00 0.31 0.00 0.00 61.69 62.15 2a77 s THR 185 Cb -0.19 -3.29 -0.06 0.00 0.01 0.00 0.00 72.50 68.97 2a77 s THR 185 CO 0.07 0.38 -0.07 -0.76 -0.69 0.00 0.00 174.62 173.55 2a77 s LEU 186 N 0.99 2.61 0.70 4.42 1.43 0.23 -4.63 118.68 124.43 2a77 s LEU 186 Ca 0.06 -1.20 -0.12 0.00 -1.03 0.00 0.00 54.13 51.83 2a77 s LEU 186 Cb -0.14 -0.81 0.02 0.00 0.03 0.00 0.00 46.19 45.29 2a77 s LEU 186 CO 0.03 -0.28 1.09 0.42 0.23 0.00 0.00 176.35 177.84 2a77 s THR 187 N -2.82 3.50 0.35 5.49 -4.23 -1.26 -1.61 115.64 115.06 2a77 s THR 187 Ca 0.31 0.57 0.07 0.00 -1.18 0.00 0.00 61.69 61.47 2a77 s THR 187 Cb 0.03 -3.12 0.31 0.00 1.34 0.00 0.00 72.50 71.07 2a77 s THR 187 CO 0.14 -0.55 1.89 0.50 -0.54 0.00 0.00 174.62 176.06 2a77 h LYS 188 N -0.54 0.72 -0.37 3.99 3.64 -1.69 -1.79 116.57 120.53 2a77 h LYS 188 Ca -0.45 -0.04 -0.15 0.00 -1.27 0.00 0.00 60.65 58.74 2a77 h LYS 188 Cb 1.23 -0.16 -0.01 0.00 -0.41 0.00 0.00 32.23 32.88 2a77 h LYS 188 CO 0.54 0.48 -0.35 -0.44 -2.27 0.00 0.00 179.45 177.41 2a77 h ASP 189 N 0.74 0.94 -0.41 4.20 3.45 -1.92 0.11 116.42 123.53 2a77 h ASP 189 Ca 0.42 -0.46 -0.14 0.00 0.43 0.00 0.00 57.03 57.28 2a77 h ASP 189 Cb 0.59 -0.27 -0.01 0.00 -0.56 0.00 0.00 39.33 39.08 2a77 h ASP 189 CO -0.18 1.21 -0.27 -0.08 -1.57 0.00 0.00 179.24 178.34 2a77 h GLU 190 N 0.69 0.91 -0.49 3.56 4.57 -1.88 -2.54 114.58 119.41 2a77 h GLU 190 Ca 0.06 -0.43 -0.02 0.00 -1.18 0.00 0.00 59.36 57.79 2a77 h GLU 190 Cb 0.94 -0.01 -0.02 0.00 -0.16 0.00 0.00 28.75 29.49 2a77 h GLU 190 CO 0.09 1.09 0.22 -0.92 -1.18 0.00 0.00 179.01 178.30 2a77 h TYR 191 N 0.73 0.72 0.00 0.92 3.20 -1.14 -2.86 116.97 118.54 2a77 h TYR 191 Ca 0.08 -0.04 0.00 0.00 3.14 0.00 0.00 58.73 61.91 2a77 h TYR 191 Cb 0.85 -0.22 0.00 0.00 1.54 0.00 0.00 36.73 38.91 2a77 h TYR 191 CO 0.06 0.58 0.00 0.39 -1.64 0.00 0.00 178.16 177.55 2a77 n GLU 192 N -4.60 0.20 0.00 1.82 -0.58 0.36 -2.68 120.64 115.16 2a77 n GLU 192 Ca 0.02 0.44 0.13 0.00 -0.42 0.00 0.00 57.16 57.34 2a77 n GLU 192 Cb 0.13 -1.89 0.50 0.00 -0.57 0.00 0.00 31.44 29.61 2a77 n GLU 192 CO 0.00 0.00 0.00 0.54 -0.48 0.00 0.00 177.13 177.19 2a77 n ARG 193 N -2.27 0.24 -4.21 3.49 1.74 -0.97 -4.92 116.66 109.76 2a77 n ARG 193 Ca 0.02 -0.08 -0.14 0.00 -0.77 0.00 0.00 57.85 56.88 2a77 n ARG 193 Cb 0.22 -1.50 -0.10 0.00 -1.02 0.00 0.00 32.46 30.06 2a77 n ARG 193 CO 0.00 0.00 0.00 -1.01 -1.52 0.00 0.00 177.63 175.10 2a77 s HIS 194 N -2.82 1.14 -0.15 -1.55 3.76 -1.09 -5.10 115.29 109.48 2a77 s HIS 194 Ca 0.18 -0.73 -0.07 0.00 -0.15 0.00 0.00 55.06 54.28 2a77 s HIS 194 Cb 0.19 -0.60 -0.06 0.00 1.11 0.00 0.00 32.58 33.21 2a77 s HIS 194 CO 0.56 0.02 -0.19 -1.71 -0.85 0.00 0.00 174.74 172.57 2a77 n ASN 195 N 0.15 1.05 -4.67 1.40 5.15 -1.26 -4.75 115.26 112.33 2a77 n ASN 195 Ca -0.13 0.18 -0.37 0.00 -0.60 0.00 0.00 54.58 53.66 2a77 n ASN 195 Cb 0.59 -0.44 -0.08 0.00 -0.53 0.00 0.00 39.78 39.32 2a77 n ASN 195 CO 0.00 0.00 0.00 -0.55 1.40 0.00 0.00 177.26 178.11 2a77 s SER 196 N -6.33 6.27 -0.12 1.20 0.15 -1.26 -0.05 113.70 113.55 2a77 s SER 196 Ca -0.21 0.30 0.02 0.00 0.70 0.00 0.00 55.95 56.76 2a77 s SER 196 Cb 0.08 -2.16 0.01 0.00 -1.71 0.00 0.00 66.02 62.24 2a77 s SER 196 CO 0.26 0.02 -0.18 -0.31 1.20 0.00 0.00 173.24 174.23 2a77 s TYR 197 N 1.06 2.27 -0.01 3.44 2.02 -0.29 0.02 117.35 125.87 2a77 s TYR 197 Ca 0.13 -1.12 0.01 0.00 -0.37 0.00 0.00 57.07 55.72 2a77 s TYR 197 Cb -0.14 -1.60 0.00 0.00 -0.40 0.00 0.00 41.96 39.83 2a77 s TYR 197 CO 0.05 -0.55 -0.04 0.95 -1.57 0.00 0.00 175.55 174.39 2a77 s THR 198 N 0.96 0.35 -0.02 -0.71 -4.23 -0.16 -1.55 115.64 110.28 2a77 s THR 198 Ca -0.06 -0.17 0.08 0.00 -1.18 0.00 0.00 61.69 60.36 2a77 s THR 198 Cb -0.15 -0.32 -0.02 0.00 1.34 0.00 0.00 72.50 73.35 2a77 s THR 198 CO -0.03 0.11 -0.24 0.00 -0.54 0.00 0.00 174.62 173.92 2a77 s GLU 200 N -0.58 0.87 -0.31 0.00 2.12 0.42 -1.59 118.70 119.63 2a77 s GLU 200 Ca 0.09 -0.12 -0.11 0.00 0.36 0.00 0.00 54.97 55.19 2a77 s GLU 200 Cb -0.09 -0.86 -0.02 0.00 0.26 0.00 0.00 34.13 33.41 2a77 s GLU 200 CO -0.01 -0.07 0.20 0.00 -0.54 0.00 0.00 175.26 174.84 2a77 s ALA 201 N 0.88 3.45 0.36 6.30 0.00 -0.25 -1.14 121.76 131.36 2a77 s ALA 201 Ca -0.12 -1.30 0.06 0.00 0.00 0.00 0.00 51.96 50.61 2a77 s ALA 201 Cb -0.14 -2.54 -0.07 0.00 0.00 0.00 0.00 23.12 20.37 2a77 s ALA 201 CO 0.00 -0.83 0.01 0.95 0.00 0.00 0.00 175.76 175.90 2a77 s THR 202 N 1.71 1.69 -0.19 0.00 -4.23 -0.32 -1.69 115.64 112.61 2a77 s THR 202 Ca 0.06 -2.03 -0.09 0.00 -1.18 0.00 0.00 61.69 58.45 2a77 s THR 202 Cb -0.17 -2.84 0.01 0.00 1.34 0.00 0.00 72.50 70.84 2a77 s THR 202 CO 0.09 -0.05 0.18 1.41 -0.54 0.00 0.00 174.62 175.71 2a77 n HIS 203 N -0.81 -1.65 0.00 3.99 8.25 -1.26 -1.06 115.22 122.67 2a77 n HIS 203 Ca -0.04 0.71 0.00 0.00 -0.26 0.00 0.00 57.72 58.13 2a77 n HIS 203 Cb 0.66 -2.03 0.00 0.00 1.12 0.00 0.00 29.99 29.74 2a77 n HIS 203 CO 0.00 0.00 0.00 1.17 0.64 0.00 0.00 176.34 178.15 2a77 n LYS 204 N 0.76 0.00 0.00 -0.41 4.81 -1.26 -4.04 118.16 118.02 2a77 n LYS 204 Ca -0.01 0.00 0.00 0.00 -0.87 0.00 0.00 58.31 57.43 2a77 n LYS 204 Cb 0.43 0.00 0.00 0.00 0.02 0.00 0.00 35.03 35.48 2a77 n LYS 204 CO 0.00 0.00 0.00 2.41 1.17 0.00 0.00 177.40 180.98 2a77 n THR 207 N 0.00 0.00 -4.55 3.15 -1.04 -1.26 -5.12 114.28 105.47 2a77 n THR 207 Ca 0.00 0.00 -0.25 0.00 -2.04 0.00 0.00 64.05 61.76 2a77 n THR 207 Cb 0.00 0.00 -0.10 0.00 -1.82 0.00 0.00 70.33 68.41 2a77 n THR 207 CO 0.00 0.00 0.00 -0.44 -0.64 0.00 0.00 175.07 173.99 2a77 s SER 208 N -0.33 3.11 0.82 8.00 0.01 -1.26 -5.16 113.70 118.90 2a77 s SER 208 Ca 0.00 -1.43 -0.10 0.00 1.31 0.00 0.00 55.95 55.72 2a77 s SER 208 Cb 0.00 -0.08 0.09 0.00 0.21 0.00 0.00 66.02 66.24 2a77 s SER 208 CO 0.00 -0.61 1.11 -2.16 0.41 0.00 0.00 173.24 171.99 2a77 s PRO 209 N -3.81 1.80 -0.30 12.44 0.04 -1.26 -4.99 135.00 138.92 2a77 s PRO 209 Ca 0.32 1.28 -0.16 0.00 0.04 0.00 0.00 61.00 62.47 2a77 s PRO 209 Cb 0.08 -1.84 -0.02 0.00 0.04 0.00 0.00 34.50 32.76 2a77 s PRO 209 CO 0.15 -2.00 0.43 0.42 0.04 0.00 0.00 177.00 176.05 2a77 s ILE 210 N -2.82 5.11 -0.10 0.56 1.01 -0.68 -4.93 121.20 119.34 2a77 s ILE 210 Ca 0.63 0.47 0.02 0.00 0.00 0.00 0.00 60.65 61.77 2a77 s ILE 210 Cb -0.19 -3.82 -0.01 0.00 0.01 0.00 0.00 42.46 38.45 2a77 s ILE 210 CO 0.57 -0.00 -0.18 -0.69 0.00 0.00 0.00 174.94 174.63 2a77 s VAL 211 N 2.19 2.63 0.01 2.92 1.01 -1.26 -1.09 120.40 126.81 2a77 s VAL 211 Ca 0.17 -0.83 0.04 0.00 0.00 0.00 0.00 61.98 61.35 2a77 s VAL 211 Cb -0.16 -2.05 -0.01 0.00 0.00 0.00 0.00 36.38 34.16 2a77 s VAL 211 CO 0.11 0.55 -0.11 -0.54 0.00 0.00 0.00 175.10 175.10 2a77 s LYS 212 N 0.16 0.85 0.08 2.72 -0.14 -0.62 -5.01 119.74 117.78 2a77 s LYS 212 Ca -0.10 -0.52 -0.06 0.00 -1.36 0.00 0.00 55.97 53.93 2a77 s LYS 212 Cb -0.16 -0.82 -0.01 0.00 -1.68 0.00 0.00 37.83 35.16 2a77 s LYS 212 CO 0.06 0.21 0.12 -1.12 -0.76 0.00 0.00 175.35 173.86 2a77 s SER 213 N -0.63 0.24 0.08 2.83 0.01 -1.26 -0.88 113.70 114.09 2a77 s SER 213 Ca 0.02 -0.78 -0.12 0.00 1.31 0.00 0.00 55.95 56.38 2a77 s SER 213 Cb -0.06 0.30 0.02 0.00 0.21 0.00 0.00 66.02 66.49 2a77 s SER 213 CO 0.00 -0.69 0.28 0.72 0.41 0.00 0.00 173.24 173.96 2a77 s PHE 214 N -3.89 -0.03 -0.21 2.43 -0.12 -0.60 -5.00 117.98 110.56 2a77 s PHE 214 Ca 0.06 -0.25 -0.05 0.00 -0.05 0.00 0.00 56.93 56.64 2a77 s PHE 214 Cb 0.06 0.08 -0.02 0.00 -0.63 0.00 0.00 43.02 42.50 2a77 s PHE 214 CO -0.10 -0.56 0.01 -0.80 -0.05 0.00 0.00 175.22 173.71 2a77 s ASN 215 N -2.52 4.83 0.00 1.98 0.01 -1.26 -1.14 114.94 116.85 2a77 s ASN 215 Ca 0.00 -0.22 0.00 0.00 -0.71 0.00 0.00 52.86 51.94 2a77 s ASN 215 Cb 0.02 -1.83 0.00 0.00 0.41 0.00 0.00 41.25 39.85 2a77 s ASN 215 CO -0.08 0.04 0.45 -1.14 -1.51 0.00 0.00 177.10 174.87