#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2ba1 n LYS 10 N 0.00 0.00 0.09 3.49 3.00 -1.26 -5.10 118.16 118.38 2ba1 n LYS 10 Ca 0.00 0.00 -0.22 0.00 -0.00 0.00 0.00 58.31 58.09 2ba1 n LYS 10 Cb 0.00 0.00 -0.15 0.00 0.00 0.00 0.00 35.03 34.88 2ba1 n LYS 10 CO 0.00 0.00 0.00 -0.07 0.00 0.00 0.00 177.40 177.33 2ba1 h LEU 11 N 0.00 0.60 -7.89 3.14 3.38 -1.97 -3.45 115.31 109.13 2ba1 h LEU 11 Ca 0.00 -0.82 -0.64 0.00 0.09 0.00 0.00 57.88 56.51 2ba1 h LEU 11 Cb 0.00 -0.20 -0.36 0.00 0.09 0.00 0.00 40.66 40.19 2ba1 h LEU 11 CO 0.00 1.68 -0.82 -0.63 0.09 0.00 0.00 178.44 178.75 2ba1 s ILE 12 N -2.59 1.84 -0.27 1.22 -1.09 -1.26 -3.45 121.20 115.59 2ba1 s ILE 12 Ca -0.13 -1.05 0.02 0.00 -2.23 0.00 0.00 60.65 57.26 2ba1 s ILE 12 Cb 0.06 -1.82 0.08 0.00 -1.58 0.00 0.00 42.46 39.19 2ba1 s ILE 12 CO 0.87 0.27 -0.02 0.68 -1.23 0.00 0.00 174.94 175.51 2ba1 s VAL 13 N 1.33 1.73 -0.82 2.92 -7.23 -1.06 -4.78 120.40 112.49 2ba1 s VAL 13 Ca -0.00 -1.59 -0.00 0.00 -1.81 0.00 0.00 61.98 58.58 2ba1 s VAL 13 Cb -0.16 -2.08 0.00 0.00 0.56 0.00 0.00 36.38 34.71 2ba1 s VAL 13 CO -0.09 -0.29 0.69 0.47 -0.31 0.00 0.00 175.10 175.57 2ba1 n ASP 14 N 4.55 -2.05 0.00 4.85 10.43 -1.26 -3.10 116.55 129.96 2ba1 n ASP 14 Ca -0.07 -0.42 0.00 0.00 2.57 0.00 0.00 54.79 56.87 2ba1 n ASP 14 Cb 0.43 -3.67 0.00 0.00 1.84 0.00 0.00 41.12 39.72 2ba1 n ASP 14 CO 0.00 0.00 0.00 0.61 -1.07 0.00 0.00 177.20 176.74 2ba1 n GLY 15 N -1.09 0.43 3.23 0.44 0.00 -1.26 -4.96 105.19 101.98 2ba1 n GLY 15 Ca -0.20 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.50 2ba1 n GLY 15 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2ba1 s LEU 16 N 0.00 2.32 1.12 0.99 1.43 -1.18 -4.51 118.68 118.85 2ba1 s LEU 16 Ca 0.00 -0.52 -0.15 0.00 -1.03 0.00 0.00 54.13 52.44 2ba1 s LEU 16 Cb 0.00 -1.51 0.25 0.00 0.03 0.00 0.00 46.19 44.96 2ba1 s LEU 16 CO 0.00 0.10 1.06 -0.13 0.23 0.00 0.00 176.35 177.61 2ba1 s ARG 17 N 0.74 -0.58 0.00 1.70 0.52 -0.91 -2.56 118.95 117.85 2ba1 s ARG 17 Ca -0.08 0.45 0.00 0.00 -0.52 0.00 0.00 55.73 55.58 2ba1 s ARG 17 Cb -0.16 -1.62 0.00 0.00 0.52 0.00 0.00 34.95 33.69 2ba1 s ARG 17 CO 0.01 -3.40 0.08 1.28 0.02 0.00 0.00 175.30 173.29 2ba1 n LEU 18 N -4.63 0.12 0.00 2.53 4.32 -1.22 -1.63 117.00 116.48 2ba1 n LEU 18 Ca 0.06 -0.06 0.00 0.00 -0.02 0.00 0.00 56.01 55.99 2ba1 n LEU 18 Cb 0.57 -0.06 0.00 0.00 -1.62 0.00 0.00 43.42 42.31 2ba1 n LEU 18 CO 0.54 0.03 0.00 -0.90 -1.22 0.00 0.00 177.39 175.84 2ba1 n ASP 19 N 0.29 0.00 0.00 -1.43 5.75 -1.26 -5.02 116.55 114.89 2ba1 n ASP 19 Ca 0.00 -0.81 0.00 0.00 -0.01 0.00 0.00 54.79 53.97 2ba1 n ASP 19 Cb 0.03 0.00 0.00 0.00 -1.03 0.00 0.00 41.12 40.12 2ba1 n ASP 19 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 2ba1 n GLY 20 N 0.00 0.55 3.80 6.12 0.00 -0.64 -5.08 105.19 109.94 2ba1 n GLY 20 Ca 0.00 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.70 2ba1 n GLY 20 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2ba1 s ARG 21 N -0.88 3.20 0.45 1.61 0.52 -1.26 -4.72 118.95 117.86 2ba1 s ARG 21 Ca 0.00 1.17 -0.01 0.00 -0.52 0.00 0.00 55.73 56.37 2ba1 s ARG 21 Cb 0.00 -2.02 -0.01 0.00 0.52 0.00 0.00 34.95 33.44 2ba1 s ARG 21 CO 0.00 -0.90 0.68 0.15 0.02 0.00 0.00 175.30 175.25 2ba1 s LYS 22 N -4.27 3.16 0.42 3.54 3.01 -1.26 -2.15 119.74 122.19 2ba1 s LYS 22 Ca 0.63 -0.37 0.22 0.00 -1.01 0.00 0.00 55.97 55.44 2ba1 s LYS 22 Cb -0.16 -2.54 1.20 0.00 -1.01 0.00 0.00 37.83 35.32 2ba1 s LYS 22 CO 0.41 -0.23 1.76 0.27 0.51 0.00 0.00 175.35 178.07 2ba1 h PHE 23 N 0.39 0.55 -0.48 3.18 -0.00 -1.87 -1.21 116.94 117.50 2ba1 h PHE 23 Ca -0.47 0.02 -0.19 0.00 -0.00 0.00 0.00 57.97 57.33 2ba1 h PHE 23 Cb 1.24 -0.16 -0.12 0.00 -0.00 0.00 0.00 35.95 36.92 2ba1 h PHE 23 CO 0.47 0.02 0.10 -0.40 -0.00 0.00 0.00 178.31 178.51 2ba1 n ASP 24 N -4.57 3.31 -4.40 -0.68 5.75 -1.26 0.80 116.55 115.50 2ba1 n ASP 24 Ca 0.26 -3.50 -0.35 0.00 -0.01 0.00 0.00 54.79 51.19 2ba1 n ASP 24 Cb 0.98 -0.66 -0.13 0.00 -1.03 0.00 0.00 41.12 40.28 2ba1 n ASP 24 CO 0.00 0.00 0.00 -0.70 -0.11 0.00 0.00 177.20 176.39 2ba1 s GLU 25 N -3.13 3.53 0.92 0.11 2.12 -0.46 -4.91 118.70 116.88 2ba1 s GLU 25 Ca 0.47 -0.56 -0.11 0.00 0.36 0.00 0.00 54.97 55.14 2ba1 s GLU 25 Cb 0.41 -3.05 0.14 0.00 0.26 0.00 0.00 34.13 31.89 2ba1 s GLU 25 CO 0.05 -0.05 1.10 -0.51 -0.54 0.00 0.00 175.26 175.31 2ba1 s LEU 26 N 1.15 2.44 0.43 2.70 1.43 -1.26 -4.68 118.68 120.89 2ba1 s LEU 26 Ca 0.02 1.84 -0.08 0.00 -1.03 0.00 0.00 54.13 54.89 2ba1 s LEU 26 Cb -0.14 -4.23 -0.05 0.00 0.03 0.00 0.00 46.19 41.79 2ba1 s LEU 26 CO 0.01 -2.93 0.77 -0.13 0.23 0.00 0.00 176.35 174.29 2ba1 s ARG 27 N -4.74 3.67 -0.11 1.70 0.52 -1.26 -4.96 118.95 113.76 2ba1 s ARG 27 Ca 0.65 0.33 -0.34 0.00 -0.52 0.00 0.00 55.73 55.85 2ba1 s ARG 27 Cb -0.21 -2.40 -0.11 0.00 0.52 0.00 0.00 34.95 32.75 2ba1 s ARG 27 CO 0.58 -0.10 1.91 -0.35 0.02 0.00 0.00 175.30 177.37 2ba1 n PRO 28 N -1.70 2.10 -4.06 3.54 -0.04 -1.26 -4.54 135.00 129.05 2ba1 n PRO 28 Ca 0.01 0.76 -0.24 0.00 -0.04 0.00 0.00 63.50 63.99 2ba1 n PRO 28 Cb 0.54 -2.65 -0.04 0.00 -0.04 0.00 0.00 33.50 31.31 2ba1 n PRO 28 CO 0.00 0.00 0.00 0.42 -0.04 0.00 0.00 175.50 175.88 2ba1 s ILE 29 N 4.44 4.70 -0.13 0.52 1.01 -1.26 -2.07 121.20 128.41 2ba1 s ILE 29 Ca 0.94 -1.11 -0.14 0.00 0.00 0.00 0.00 60.65 60.35 2ba1 s ILE 29 Cb -0.69 -3.46 0.04 0.00 0.01 0.00 0.00 42.46 38.35 2ba1 s ILE 29 CO 0.51 -0.21 0.38 -0.75 0.00 0.00 0.00 174.94 174.87 2ba1 s LYS 30 N -3.45 0.47 -0.07 2.79 2.20 -0.98 -4.97 119.74 115.72 2ba1 s LYS 30 Ca 0.32 0.47 -0.05 0.00 -0.36 0.00 0.00 55.97 56.36 2ba1 s LYS 30 Cb -0.09 0.23 0.03 0.00 -1.51 0.00 0.00 37.83 36.48 2ba1 s LYS 30 CO 0.25 -0.07 0.17 0.42 -0.36 0.00 0.00 175.35 175.77 2ba1 s ILE 31 N 0.07 -0.02 -0.03 5.43 1.01 -1.26 -0.84 121.20 125.56 2ba1 s ILE 31 Ca -0.01 0.07 -0.01 0.00 0.00 0.00 0.00 60.65 60.70 2ba1 s ILE 31 Cb -0.03 -0.26 0.03 0.00 0.01 0.00 0.00 42.46 42.21 2ba1 s ILE 31 CO 0.01 0.03 0.04 -0.70 0.00 0.00 0.00 174.94 174.32 2ba1 s GLU 32 N 0.58 -0.03 0.41 2.79 2.12 -0.03 -4.77 118.70 119.77 2ba1 s GLU 32 Ca -0.04 0.26 0.03 0.00 0.36 0.00 0.00 54.97 55.58 2ba1 s GLU 32 Cb -0.06 -0.38 -0.00 0.00 0.26 0.00 0.00 34.13 33.95 2ba1 s GLU 32 CO -0.03 -0.23 0.59 0.00 -0.54 0.00 0.00 175.26 175.05 2ba1 s ALA 33 N 1.53 3.95 -0.74 6.30 0.00 -1.26 -0.61 121.76 130.93 2ba1 s ALA 33 Ca -0.03 -1.22 -0.06 0.00 0.00 0.00 0.00 51.96 50.65 2ba1 s ALA 33 Cb -0.13 -1.96 0.01 0.00 0.00 0.00 0.00 23.12 21.05 2ba1 s ALA 33 CO -0.03 -0.25 0.63 0.43 0.00 0.00 0.00 175.76 176.54 2ba1 n SER 34 N -1.91 -5.82 -0.00 0.00 7.64 -1.17 -4.90 113.62 107.45 2ba1 n SER 34 Ca 0.01 -0.56 0.05 0.00 1.01 0.00 0.00 58.87 59.37 2ba1 n SER 34 Cb 0.58 -2.76 -0.07 0.00 -1.01 0.00 0.00 64.21 60.95 2ba1 n SER 34 CO 0.00 0.00 0.00 0.52 -3.01 0.00 0.00 175.04 172.55 2ba1 n VAL 35 N -1.98 0.00 -4.40 0.44 0.31 -1.26 -4.94 118.33 106.50 2ba1 n VAL 35 Ca -0.19 -0.25 -0.34 0.00 -0.01 0.00 0.00 64.34 63.55 2ba1 n VAL 35 Cb 0.63 0.67 -0.15 0.00 -0.91 0.00 0.00 33.84 34.09 2ba1 n VAL 35 CO 0.00 0.00 0.00 -0.76 -1.32 0.00 0.00 176.83 174.75 2ba1 s LEU 36 N -3.03 2.64 0.09 7.52 1.43 -1.26 -5.01 118.68 121.05 2ba1 s LEU 36 Ca 0.00 -0.42 -0.16 0.00 -1.03 0.00 0.00 54.13 52.53 2ba1 s LEU 36 Cb 0.07 -1.62 -0.09 0.00 0.03 0.00 0.00 46.19 44.58 2ba1 s LEU 36 CO 0.42 0.07 1.42 0.50 0.23 0.00 0.00 176.35 178.99 2ba1 h LYS 37 N 7.38 0.65 -4.04 1.70 3.64 -2.01 -3.35 116.57 120.54 2ba1 h LYS 37 Ca -0.34 -0.33 -0.76 0.00 -1.27 0.00 0.00 60.65 57.95 2ba1 h LYS 37 Cb 1.18 0.01 -0.20 0.00 -0.41 0.00 0.00 32.23 32.81 2ba1 h LYS 37 CO 0.58 0.93 1.32 0.54 -2.27 0.00 0.00 179.45 180.55 2ba1 n ARG 38 N -4.33 3.58 0.00 1.90 5.12 -1.26 -4.87 116.66 116.80 2ba1 n ARG 38 Ca -0.04 -3.95 0.00 0.00 -1.93 0.00 0.00 57.85 51.93 2ba1 n ARG 38 Cb 0.44 -2.87 0.00 0.00 -1.16 0.00 0.00 32.46 28.87 2ba1 n ARG 38 CO 0.00 0.00 0.00 0.00 -1.93 0.00 0.00 177.63 175.70 2ba1 n ALA 39 N 4.23 0.00 0.12 7.54 0.00 -1.26 -5.03 120.51 126.11 2ba1 n ALA 39 Ca 0.34 0.00 0.01 0.00 0.00 0.00 0.00 53.44 53.79 2ba1 n ALA 39 Cb 0.39 0.00 0.32 0.00 0.00 0.00 0.00 19.45 20.16 2ba1 n ALA 39 CO 0.00 0.00 0.00 -0.44 0.00 0.00 0.00 177.50 177.06 2ba1 h ASP 40 N 0.00 0.20 -4.47 0.00 3.32 -1.76 -3.44 116.42 110.26 2ba1 h ASP 40 Ca 0.00 -0.06 -0.09 0.00 0.02 0.00 0.00 57.03 56.90 2ba1 h ASP 40 Cb 0.00 -0.05 -0.21 0.00 0.22 0.00 0.00 39.33 39.29 2ba1 h ASP 40 CO 0.00 0.49 -0.04 -0.83 -1.72 0.00 0.00 179.24 177.13 2ba1 s GLY 41 N -4.16 -0.40 0.37 2.75 0.00 -0.98 -3.82 107.32 101.07 2ba1 s GLY 41 Ca -0.05 1.21 -0.06 0.00 0.00 0.00 0.00 44.72 45.82 2ba1 s GLY 41 CO 0.75 0.96 0.59 -1.14 0.00 0.00 0.00 173.10 174.26 2ba1 n SER 42 N 1.92 -1.68 -3.65 1.64 3.41 -1.25 0.72 113.62 114.73 2ba1 n SER 42 Ca -0.17 -2.79 0.02 0.00 -0.26 0.00 0.00 58.87 55.67 2ba1 n SER 42 Cb 0.56 2.99 -0.06 0.00 -0.26 0.00 0.00 64.21 67.44 2ba1 n SER 42 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2ba1 s TYR 44 N 0.79 3.28 0.07 0.00 5.04 0.22 -1.12 117.35 125.63 2ba1 s TYR 44 Ca -0.05 0.12 0.05 0.00 -2.44 0.00 0.00 57.07 54.76 2ba1 s TYR 44 Cb -0.03 -2.09 -0.03 0.00 0.35 0.00 0.00 41.96 40.16 2ba1 s TYR 44 CO -0.11 0.18 -0.15 -1.17 -1.34 0.00 0.00 175.55 172.96 2ba1 s LEU 45 N 0.37 2.26 -0.00 6.97 1.98 -0.39 -0.85 118.68 129.02 2ba1 s LEU 45 Ca 0.04 -0.60 0.02 0.00 -2.89 0.00 0.00 54.13 50.70 2ba1 s LEU 45 Cb -0.12 -0.56 -0.01 0.00 0.66 0.00 0.00 46.19 46.16 2ba1 s LEU 45 CO -0.00 -0.05 -0.07 -1.61 -1.89 0.00 0.00 176.35 172.73 2ba1 s GLU 46 N -1.65 0.54 -0.32 1.98 2.02 -0.02 -0.76 118.70 120.49 2ba1 s GLU 46 Ca -0.01 -0.29 -0.00 0.00 0.02 0.00 0.00 54.97 54.69 2ba1 s GLU 46 Cb -0.10 -0.50 0.14 0.00 0.10 0.00 0.00 34.13 33.76 2ba1 s GLU 46 CO 0.02 0.14 0.28 -1.64 0.02 0.00 0.00 175.26 174.08 2ba1 s MET 47 N -0.29 0.41 4.91 1.61 -1.94 -0.51 -2.31 119.30 121.18 2ba1 s MET 47 Ca 0.02 -0.54 0.00 0.00 -1.71 0.00 0.00 55.69 53.45 2ba1 s MET 47 Cb -0.03 -0.84 0.00 0.00 2.01 0.00 0.00 34.83 35.97 2ba1 s MET 47 CO -0.00 -1.09 0.00 0.41 -0.01 0.00 0.00 175.02 174.32 2ba1 n GLY 48 N 4.86 1.75 0.06 -0.03 0.00 -0.88 -1.49 105.19 109.46 2ba1 n GLY 48 Ca 0.02 -0.60 0.07 0.00 0.00 0.00 0.00 46.02 45.52 2ba1 n GLY 48 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2ba1 n LYS 49 N 9.48 0.07 -2.12 1.61 4.76 -1.26 -4.73 118.16 125.97 2ba1 n LYS 49 Ca 0.00 0.39 -0.42 0.00 -2.87 0.00 0.00 58.31 55.41 2ba1 n LYS 49 Cb 0.00 -1.66 -0.03 0.00 -1.84 0.00 0.00 35.03 31.50 2ba1 n LYS 49 CO 0.00 0.00 0.00 -0.80 -1.37 0.00 0.00 177.40 175.23 2ba1 s ASN 50 N -3.47 6.77 -0.24 4.39 0.01 -0.55 -4.58 114.94 117.25 2ba1 s ASN 50 Ca 0.04 2.25 0.02 0.00 -0.71 0.00 0.00 52.86 54.46 2ba1 s ASN 50 Cb 0.07 -2.56 0.06 0.00 0.41 0.00 0.00 41.25 39.22 2ba1 s ASN 50 CO 0.24 -0.77 -0.11 -0.54 -1.51 0.00 0.00 177.10 174.41 2ba1 s LYS 51 N 2.42 2.17 0.19 -0.60 1.02 -0.62 -1.42 119.74 122.90 2ba1 s LYS 51 Ca 0.67 -1.20 0.10 0.00 0.02 0.00 0.00 55.97 55.56 2ba1 s LYS 51 Cb -0.34 -2.77 -0.04 0.00 -0.52 0.00 0.00 37.83 34.15 2ba1 s LYS 51 CO 0.29 -0.53 -0.20 0.08 -0.92 0.00 0.00 175.35 174.06 2ba1 s VAL 52 N 1.19 2.08 -0.08 3.17 1.01 0.06 -1.12 120.40 126.71 2ba1 s VAL 52 Ca -0.07 -2.03 -0.03 0.00 0.00 0.00 0.00 61.98 59.85 2ba1 s VAL 52 Cb -0.19 -2.01 0.04 0.00 0.00 0.00 0.00 36.38 34.23 2ba1 s VAL 52 CO -0.06 -0.27 0.15 -0.51 0.00 0.00 0.00 175.10 174.41 2ba1 s ILE 53 N -2.03 -0.23 0.06 2.22 2.07 -0.42 -1.26 121.20 121.62 2ba1 s ILE 53 Ca 0.20 0.34 0.04 0.00 -1.41 0.00 0.00 60.65 59.81 2ba1 s ILE 53 Cb -0.06 -0.28 -0.04 0.00 0.13 0.00 0.00 42.46 42.21 2ba1 s ILE 53 CO 0.09 0.14 0.01 0.00 -1.91 0.00 0.00 174.94 173.27 2ba1 s ALA 54 N 2.14 3.33 0.00 1.50 0.00 -0.28 -0.43 121.76 128.02 2ba1 s ALA 54 Ca 0.02 -1.06 0.00 0.00 0.00 0.00 0.00 51.96 50.93 2ba1 s ALA 54 Cb -0.12 -1.27 -0.00 0.00 0.00 0.00 0.00 23.12 21.73 2ba1 s ALA 54 CO -0.06 0.69 -0.02 0.00 0.00 0.00 0.00 175.76 176.38 2ba1 s ALA 55 N -1.26 0.13 -0.03 0.00 0.00 0.11 -1.83 121.76 118.90 2ba1 s ALA 55 Ca 0.24 -0.14 0.04 0.00 0.00 0.00 0.00 51.96 52.11 2ba1 s ALA 55 Cb -0.12 -0.01 -0.01 0.00 0.00 0.00 0.00 23.12 22.99 2ba1 s ALA 55 CO 0.17 0.01 -0.16 0.08 0.00 0.00 0.00 175.76 175.86 2ba1 s VAL 56 N -0.22 1.29 -0.44 0.00 1.01 0.22 -0.55 120.40 121.71 2ba1 s VAL 56 Ca -0.01 -0.66 0.03 0.00 0.00 0.00 0.00 61.98 61.33 2ba1 s VAL 56 Cb -0.02 -1.09 0.12 0.00 0.00 0.00 0.00 36.38 35.38 2ba1 s VAL 56 CO -0.00 0.37 0.18 -0.36 0.00 0.00 0.00 175.10 175.29 2ba1 s PHE 57 N -0.11 3.51 0.44 5.22 0.40 -0.65 -2.13 117.98 124.66 2ba1 s PHE 57 Ca 0.00 -2.97 -0.12 0.00 -0.60 0.00 0.00 56.93 53.24 2ba1 s PHE 57 Cb -0.09 -2.95 -0.09 0.00 0.51 0.00 0.00 43.02 40.40 2ba1 s PHE 57 CO 0.01 -0.87 -0.69 0.41 0.70 0.00 0.00 175.22 174.78 2ba1 n GLY 58 N 3.81 -1.34 3.52 4.36 0.00 -1.26 -2.94 105.19 111.34 2ba1 n GLY 58 Ca 0.04 -0.05 -0.18 0.00 0.00 0.00 0.00 46.02 45.83 2ba1 n GLY 58 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 2ba1 n PRO 59 N 1.10 0.24 -4.43 1.61 -0.04 -1.26 -4.58 135.00 127.65 2ba1 n PRO 59 Ca -0.01 -0.40 -0.31 0.00 -0.04 0.00 0.00 63.50 62.75 2ba1 n PRO 59 Cb 0.33 -2.22 -0.05 0.00 -0.04 0.00 0.00 33.50 31.53 2ba1 n PRO 59 CO 0.00 0.00 0.00 -0.98 -0.04 0.00 0.00 175.50 174.48 2ba1 s ARG 60 N 7.83 2.22 -0.11 0.54 1.70 -0.59 -4.82 118.95 125.72 2ba1 s ARG 60 Ca 1.12 -2.27 -0.26 0.00 -0.47 0.00 0.00 55.73 53.85 2ba1 s ARG 60 Cb -0.51 -1.74 -0.02 0.00 -0.57 0.00 0.00 34.95 32.10 2ba1 s ARG 60 CO 0.34 -0.48 0.84 -1.21 -1.08 0.00 0.00 175.30 173.71 2ba1 s GLU 61 N -4.04 4.39 -0.47 3.89 2.02 -1.26 0.14 118.70 123.36 2ba1 s GLU 61 Ca 0.15 1.08 -0.28 0.00 0.02 0.00 0.00 54.97 55.94 2ba1 s GLU 61 Cb -0.00 -3.52 0.01 0.00 0.10 0.00 0.00 34.13 30.72 2ba1 s GLU 61 CO 0.09 -0.18 1.40 0.54 0.02 0.00 0.00 175.26 177.14 2ba1 s VAL 62 N 1.61 3.87 0.10 2.63 0.11 -1.24 -4.82 120.40 122.65 2ba1 s VAL 62 Ca 0.41 0.85 -0.26 0.00 -2.93 0.00 0.00 61.98 60.05 2ba1 s VAL 62 Cb -0.18 -4.30 -0.12 0.00 -1.53 0.00 0.00 36.38 30.26 2ba1 s VAL 62 CO 0.17 -0.90 1.68 0.45 -3.33 0.00 0.00 175.10 173.16 2ba1 h HIS 63 N 10.81 -0.41 -0.73 1.54 -0.00 -1.94 -3.35 115.15 121.06 2ba1 h HIS 63 Ca -0.27 0.00 -0.29 0.00 -0.00 0.00 0.00 60.37 59.81 2ba1 h HIS 63 Cb 1.10 0.16 -0.05 0.00 -0.00 0.00 0.00 27.41 28.62 2ba1 h HIS 63 CO 0.99 -0.24 0.74 -1.25 -0.00 0.00 0.00 177.93 178.16 2ba1 s PRO 64 N -6.12 2.55 0.29 2.45 0.04 -1.26 -4.78 135.00 128.16 2ba1 s PRO 64 Ca -0.15 -0.27 0.25 0.00 0.04 0.00 0.00 61.00 60.88 2ba1 s PRO 64 Cb 0.07 -5.05 0.93 0.00 0.04 0.00 0.00 34.50 30.49 2ba1 s PRO 64 CO 0.65 -3.38 0.87 -2.13 0.04 0.00 0.00 177.00 173.05 2ba1 n ARG 65 N 8.86 -0.01 0.12 4.56 0.63 -1.26 -0.50 116.66 129.06 2ba1 n ARG 65 Ca 0.40 0.63 0.01 0.00 -0.92 0.00 0.00 57.85 57.97 2ba1 n ARG 65 Cb 0.47 -1.39 0.34 0.00 0.45 0.00 0.00 32.46 32.32 2ba1 n ARG 65 CO 0.00 0.00 0.00 0.45 -2.51 0.00 0.00 177.63 175.57 2ba1 h HIS 66 N 0.00 0.24 -0.20 -0.14 3.86 -1.91 -2.57 115.15 114.43 2ba1 h HIS 66 Ca 0.52 -0.04 0.00 0.00 -1.16 0.00 0.00 60.37 59.69 2ba1 h HIS 66 Cb 1.97 -0.06 0.00 0.00 1.06 0.00 0.00 27.41 30.38 2ba1 h HIS 66 CO -0.00 0.45 0.00 1.28 0.86 0.00 0.00 177.93 180.51 2ba1 n LEU 67 N -4.18 2.44 -4.88 2.43 4.77 0.35 -4.90 117.00 113.02 2ba1 n LEU 67 Ca -0.01 -1.23 -0.30 0.00 -0.03 0.00 0.00 56.01 54.43 2ba1 n LEU 67 Cb 0.34 -0.52 -0.04 0.00 -2.33 0.00 0.00 43.42 40.88 2ba1 n LEU 67 CO 0.39 0.37 0.35 -1.58 -1.33 0.00 0.00 177.39 175.59 2ba1 s GLN 68 N -1.59 3.77 -0.13 3.23 0.74 -0.97 -4.90 119.66 119.80 2ba1 s GLN 68 Ca 0.18 0.34 -0.00 0.00 0.05 0.00 0.00 55.36 55.93 2ba1 s GLN 68 Cb 0.13 -2.50 0.03 0.00 1.10 0.00 0.00 33.01 31.77 2ba1 s GLN 68 CO 0.06 0.10 -0.08 0.34 -0.55 0.00 0.00 175.29 175.16 2ba1 s ASP 69 N -2.96 2.42 0.00 6.67 -1.08 -1.26 -5.03 116.67 115.43 2ba1 s ASP 69 Ca 0.49 -0.42 0.09 0.00 -0.52 0.00 0.00 52.55 52.19 2ba1 s ASP 69 Cb -0.10 -0.90 0.39 0.00 -1.46 0.00 0.00 42.92 40.85 2ba1 s ASP 69 CO 0.28 -0.13 1.25 -0.81 0.52 0.00 0.00 175.17 176.28 2ba1 n PRO 70 N 4.91 0.03 -0.00 4.34 -0.04 -1.26 -0.45 135.00 142.52 2ba1 n PRO 70 Ca -0.13 0.32 -0.00 0.00 -0.04 0.00 0.00 63.50 63.65 2ba1 n PRO 70 Cb 0.49 -1.50 -0.00 0.00 -0.04 0.00 0.00 33.50 32.45 2ba1 n PRO 70 CO 0.00 0.00 0.00 -1.13 -0.04 0.00 0.00 175.50 174.33 2ba1 n SER 71 N -1.45 4.89 -3.90 3.54 3.41 -1.26 -4.69 113.62 114.16 2ba1 n SER 71 Ca 0.03 0.00 -0.09 0.00 -0.26 0.00 0.00 58.87 58.55 2ba1 n SER 71 Cb 0.10 0.70 -0.07 0.00 -0.26 0.00 0.00 64.21 64.67 2ba1 n SER 71 CO 0.00 0.00 0.00 -1.59 -0.16 0.00 0.00 175.04 173.29 2ba1 s LYS 72 N -2.02 0.92 0.54 4.33 -2.85 -1.24 -4.50 119.74 114.92 2ba1 s LYS 72 Ca -0.00 -1.03 -0.16 0.00 -1.00 0.00 0.00 55.97 53.77 2ba1 s LYS 72 Cb 0.00 0.34 -0.07 0.00 -2.06 0.00 0.00 37.83 36.05 2ba1 s LYS 72 CO 0.02 -0.30 1.00 0.00 0.10 0.00 0.00 175.35 176.17 2ba1 s ALA 73 N -3.89 3.00 0.15 0.59 0.00 0.12 -3.83 121.76 117.90 2ba1 s ALA 73 Ca 0.09 0.21 -0.04 0.00 0.00 0.00 0.00 51.96 52.22 2ba1 s ALA 73 Cb 0.05 -3.14 -0.05 0.00 0.00 0.00 0.00 23.12 19.97 2ba1 s ALA 73 CO -0.08 -0.37 0.38 0.96 0.00 0.00 0.00 175.76 176.65 2ba1 s ILE 74 N -2.62 5.18 -0.12 0.00 -4.36 -0.89 -4.87 121.20 113.53 2ba1 s ILE 74 Ca 0.60 -0.05 0.01 0.00 -0.26 0.00 0.00 60.65 60.95 2ba1 s ILE 74 Cb -0.11 -3.64 -0.01 0.00 1.25 0.00 0.00 42.46 39.94 2ba1 s ILE 74 CO 0.33 -0.00 -0.14 -0.63 0.24 0.00 0.00 174.94 174.74 2ba1 s ILE 75 N -1.70 2.94 -0.03 8.37 -1.09 -1.26 -2.10 121.20 126.32 2ba1 s ILE 75 Ca 0.40 -0.71 0.05 0.00 -2.23 0.00 0.00 60.65 58.17 2ba1 s ILE 75 Cb -0.12 -2.21 -0.01 0.00 -1.58 0.00 0.00 42.46 38.54 2ba1 s ILE 75 CO 0.26 0.54 -0.19 -0.13 -1.23 0.00 0.00 174.94 174.18 2ba1 s ARG 76 N 0.20 1.78 -0.08 2.79 0.52 -1.01 -5.01 118.95 118.15 2ba1 s ARG 76 Ca -0.09 -0.68 -0.01 0.00 -0.52 0.00 0.00 55.73 54.43 2ba1 s ARG 76 Cb -0.15 -1.61 0.03 0.00 0.52 0.00 0.00 34.95 33.73 2ba1 s ARG 76 CO 0.05 0.34 -0.03 -0.47 0.02 0.00 0.00 175.30 175.21 2ba1 s TYR 77 N -0.21 0.96 -0.30 -0.53 5.04 -1.26 0.65 117.35 121.71 2ba1 s TYR 77 Ca 0.01 -0.37 0.00 0.00 -2.44 0.00 0.00 57.07 54.28 2ba1 s TYR 77 Cb -0.10 -0.93 0.06 0.00 0.35 0.00 0.00 41.96 41.34 2ba1 s TYR 77 CO 0.01 -0.37 -0.02 0.50 -1.34 0.00 0.00 175.55 174.33 2ba1 s ARG 78 N 1.74 2.25 -0.34 4.97 3.52 -0.28 -4.68 118.95 126.12 2ba1 s ARG 78 Ca 0.03 -1.39 -0.19 0.00 -0.13 0.00 0.00 55.73 54.04 2ba1 s ARG 78 Cb -0.13 -3.12 -0.00 0.00 -1.56 0.00 0.00 34.95 30.14 2ba1 s ARG 78 CO -0.05 -0.67 0.58 -0.47 -0.81 0.00 0.00 175.30 173.88 2ba1 s TYR 79 N 1.16 3.18 -0.02 5.12 5.04 -1.26 -1.87 117.35 128.70 2ba1 s TYR 79 Ca -0.04 0.36 0.03 0.00 -2.44 0.00 0.00 57.07 54.98 2ba1 s TYR 79 Cb -0.20 -2.99 -0.00 0.00 0.35 0.00 0.00 41.96 39.11 2ba1 s TYR 79 CO -0.03 -0.53 -0.12 1.21 -1.34 0.00 0.00 175.55 174.73 2ba1 s ASN 80 N 1.73 1.51 -0.14 4.32 2.47 -0.91 -4.81 114.94 119.11 2ba1 s ASN 80 Ca 0.22 -0.24 -0.07 0.00 0.42 0.00 0.00 52.86 53.20 2ba1 s ASN 80 Cb -0.15 -0.29 -0.04 0.00 -1.45 0.00 0.00 41.25 39.31 2ba1 s ASN 80 CO 0.13 0.12 0.10 -0.04 -3.72 0.00 0.00 177.10 173.69 2ba1 s MET 81 N -0.07 3.62 0.49 0.43 -1.94 -1.26 -1.57 119.30 119.00 2ba1 s MET 81 Ca 0.01 -0.24 -0.20 0.00 -1.71 0.00 0.00 55.69 53.55 2ba1 s MET 81 Cb -0.07 -3.17 -0.08 0.00 2.01 0.00 0.00 34.83 33.52 2ba1 s MET 81 CO 0.00 0.57 1.04 0.00 -0.01 0.00 0.00 175.02 176.62 2ba1 s ALA 82 N -0.44 2.86 -0.59 3.03 0.00 -0.79 -4.74 121.76 121.07 2ba1 s ALA 82 Ca 0.11 0.60 0.12 0.00 0.00 0.00 0.00 51.96 52.79 2ba1 s ALA 82 Cb -0.12 -3.25 0.65 0.00 0.00 0.00 0.00 23.12 20.40 2ba1 s ALA 82 CO 0.02 -0.36 1.38 -0.35 0.00 0.00 0.00 175.76 176.45 2ba1 n PRO 83 N -1.05 0.08 -0.20 0.00 -0.04 -1.26 -1.55 135.00 130.99 2ba1 n PRO 83 Ca 0.09 0.55 0.08 0.00 -0.04 0.00 0.00 63.50 64.18 2ba1 n PRO 83 Cb 0.52 -1.74 0.18 0.00 -0.04 0.00 0.00 33.50 32.43 2ba1 n PRO 83 CO 0.00 0.00 0.00 1.97 -0.04 0.00 0.00 175.50 177.43 2ba1 n PHE 84 N -1.90 0.51 0.13 0.54 -1.74 -1.26 -2.26 117.46 111.48 2ba1 n PHE 84 Ca -0.00 -0.39 0.01 0.00 -0.56 0.00 0.00 57.45 56.51 2ba1 n PHE 84 Cb 0.04 -0.01 0.04 0.00 1.52 0.00 0.00 39.48 41.07 2ba1 n PHE 84 CO 0.00 0.00 0.00 0.66 -0.56 0.00 0.00 176.76 176.86 2ba1 h SER 85 N 2.95 0.00 -1.40 5.98 4.64 -1.31 -3.46 113.55 120.96 2ba1 h SER 85 Ca 0.00 0.00 -0.48 0.00 -0.47 0.00 0.00 61.79 60.84 2ba1 h SER 85 Cb 0.79 0.00 -0.02 0.00 -0.31 0.00 0.00 62.40 62.87 2ba1 h SER 85 CO 0.00 0.59 -0.33 0.68 -0.87 0.00 0.00 176.83 176.90 2ba1 s VAL 86 N -3.01 2.66 0.24 0.95 -7.23 -1.26 0.48 120.40 113.23 2ba1 s VAL 86 Ca 0.03 -1.24 -0.07 0.00 -1.81 0.00 0.00 61.98 58.89 2ba1 s VAL 86 Cb 0.09 -2.90 0.24 0.00 0.56 0.00 0.00 36.38 34.36 2ba1 s VAL 86 CO 0.75 0.00 1.91 -0.33 -0.31 0.00 0.00 175.10 177.12 2ba1 h GLU 87 N 0.86 1.29 -4.79 4.82 3.07 -1.90 -3.38 114.58 114.54 2ba1 h GLU 87 Ca -0.40 -0.10 -0.68 0.00 -0.50 0.00 0.00 59.36 57.68 2ba1 h GLU 87 Cb 1.27 -0.28 -0.32 0.00 -0.84 0.00 0.00 28.75 28.58 2ba1 h GLU 87 CO 0.53 0.88 -0.70 -2.00 -1.40 0.00 0.00 179.01 176.31 2ba1 s GLU 88 N -6.04 2.53 -0.29 2.33 2.12 -1.26 -5.04 118.70 113.05 2ba1 s GLU 88 Ca -0.13 -1.20 -0.27 0.00 0.36 0.00 0.00 54.97 53.74 2ba1 s GLU 88 Cb 0.17 -3.16 -0.11 0.00 0.26 0.00 0.00 34.13 31.29 2ba1 s GLU 88 CO 0.82 -0.58 1.01 -2.13 -0.54 0.00 0.00 175.26 173.85 2ba1 n ARG 89 N 4.65 0.00 -3.62 4.30 0.00 -1.26 -4.88 116.66 115.85 2ba1 n ARG 89 Ca -0.14 0.00 -0.36 0.00 -0.00 0.00 0.00 57.85 57.35 2ba1 n ARG 89 Cb 0.44 -0.87 -0.08 0.00 0.00 0.00 0.00 32.46 31.95 2ba1 n ARG 89 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 177.63 177.84 2ba1 s LYS 90 N 2.21 4.17 -0.04 -0.14 2.20 -0.96 -5.04 119.74 122.15 2ba1 s LYS 90 Ca 0.63 -0.10 -0.37 0.00 -0.36 0.00 0.00 55.97 55.77 2ba1 s LYS 90 Cb -0.87 -3.47 -0.16 0.00 -1.51 0.00 0.00 37.83 31.82 2ba1 s LYS 90 CO 0.45 0.17 1.53 2.89 -0.36 0.00 0.00 175.35 180.03 2ba1 n ARG 91 N 3.89 1.31 -1.63 4.03 1.85 -1.26 -4.12 116.66 120.74 2ba1 n ARG 91 Ca -0.14 0.48 -0.36 0.00 -1.00 0.00 0.00 57.85 56.83 2ba1 n ARG 91 Cb 0.52 -2.16 0.08 0.00 -1.05 0.00 0.00 32.46 29.85 2ba1 n ARG 91 CO 0.00 0.00 0.00 -0.35 -0.01 0.00 0.00 177.63 177.27 2ba1 n PRO 92 N 3.80 0.96 0.00 2.89 -0.04 -1.26 -4.92 135.00 136.43 2ba1 n PRO 92 Ca 0.21 0.39 0.00 0.00 -0.04 0.00 0.00 63.50 64.06 2ba1 n PRO 92 Cb 0.19 -2.51 0.00 0.00 -0.04 0.00 0.00 33.50 31.14 2ba1 n PRO 92 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 2ba1 n GLY 93 N 0.88 2.06 3.68 0.55 0.00 -1.26 -5.03 105.19 106.07 2ba1 n GLY 93 Ca 0.16 -2.05 -0.45 0.00 0.00 0.00 0.00 46.02 43.67 2ba1 n GLY 93 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 2ba1 n PRO 94 N 0.52 2.38 -3.66 1.61 -0.04 -1.26 -4.91 135.00 129.64 2ba1 n PRO 94 Ca 0.00 0.86 -0.21 0.00 -0.04 0.00 0.00 63.50 64.11 2ba1 n PRO 94 Cb 0.00 -2.67 -0.03 0.00 -0.04 0.00 0.00 33.50 30.75 2ba1 n PRO 94 CO 0.00 0.00 0.00 0.34 -0.04 0.00 0.00 175.50 175.80 2ba1 s ASP 95 N 1.64 5.12 0.21 3.54 -1.08 -1.26 -4.97 116.67 119.87 2ba1 s ASP 95 Ca 0.80 -0.66 0.01 0.00 -0.52 0.00 0.00 52.55 52.18 2ba1 s ASP 95 Cb -0.62 -0.71 0.17 0.00 -1.46 0.00 0.00 42.92 40.31 2ba1 s ASP 95 CO 0.38 -0.55 1.52 0.03 0.52 0.00 0.00 175.17 177.08 2ba1 h ARG 96 N 1.11 0.38 -0.24 4.34 3.08 -1.99 -0.56 114.38 120.50 2ba1 h ARG 96 Ca -0.43 -0.26 -0.02 0.00 0.07 0.00 0.00 59.98 59.35 2ba1 h ARG 96 Cb 1.26 0.04 -0.01 0.00 0.08 0.00 0.00 29.97 31.34 2ba1 h ARG 96 CO 0.58 0.87 0.08 -0.09 -1.07 0.00 0.00 179.97 180.34 2ba1 h ARG 97 N 0.28 0.38 -0.36 0.04 2.43 -1.99 -1.35 114.38 113.81 2ba1 h ARG 97 Ca -0.01 -0.08 0.00 0.00 -0.81 0.00 0.00 59.98 59.09 2ba1 h ARG 97 Cb 1.13 -0.05 -0.02 0.00 -0.42 0.00 0.00 29.97 30.61 2ba1 h ARG 97 CO 0.10 0.45 0.24 0.77 -1.51 0.00 0.00 179.97 180.02 2ba1 h SER 98 N 0.23 0.42 -0.68 -3.80 0.02 -1.84 0.12 113.55 108.02 2ba1 h SER 98 Ca 0.08 -0.02 0.04 0.00 -0.84 0.00 0.00 61.79 61.05 2ba1 h SER 98 Cb 0.23 -0.11 -0.05 0.00 0.14 0.00 0.00 62.40 62.62 2ba1 h SER 98 CO -0.00 0.32 0.40 0.40 -1.14 0.00 0.00 176.83 176.81 2ba1 h ILE 99 N 0.49 1.03 0.29 3.27 1.08 -0.97 -0.01 117.51 122.68 2ba1 h ILE 99 Ca 0.13 -0.26 -0.01 0.00 -0.39 0.00 0.00 64.86 64.33 2ba1 h ILE 99 Cb -0.04 0.20 0.00 0.00 -3.07 0.00 0.00 36.82 33.91 2ba1 h ILE 99 CO -0.03 0.14 -0.14 -0.08 -0.69 0.00 0.00 178.15 177.35 2ba1 h GLU 100 N 0.76 -0.37 -0.09 2.37 4.22 -0.59 -1.22 114.58 119.65 2ba1 h GLU 100 Ca 0.29 0.03 0.03 0.00 0.08 0.00 0.00 59.36 59.78 2ba1 h GLU 100 Cb 0.11 0.08 -0.00 0.00 0.50 0.00 0.00 28.75 29.44 2ba1 h GLU 100 CO -0.15 -0.17 0.07 0.82 -2.18 0.00 0.00 179.01 177.41 2ba1 h ILE 101 N -0.50 0.90 0.03 2.32 2.04 -0.46 -1.28 117.51 120.56 2ba1 h ILE 101 Ca -0.04 0.00 -0.21 0.00 1.00 0.00 0.00 64.86 65.61 2ba1 h ILE 101 Cb 0.38 0.95 -0.01 0.00 -0.74 0.00 0.00 36.82 37.40 2ba1 h ILE 101 CO 0.06 0.00 -0.97 0.28 0.00 0.00 0.00 178.15 177.53 2ba1 h SER 102 N 0.00 0.26 -0.03 1.72 0.02 -0.73 -1.12 113.55 113.68 2ba1 h SER 102 Ca 0.04 -0.23 -0.01 0.00 -0.84 0.00 0.00 61.79 60.75 2ba1 h SER 102 Cb 0.18 -0.08 -0.00 0.00 0.14 0.00 0.00 62.40 62.64 2ba1 h SER 102 CO -0.00 1.08 -0.03 0.50 -1.14 0.00 0.00 176.83 177.24 2ba1 h LYS 103 N 0.09 0.06 -0.21 3.45 3.64 -0.13 -2.06 116.57 121.42 2ba1 h LYS 103 Ca -0.06 -0.03 -0.16 0.00 -1.27 0.00 0.00 60.65 59.13 2ba1 h LYS 103 Cb 1.64 0.00 -0.01 0.00 -0.41 0.00 0.00 32.23 33.45 2ba1 h LYS 103 CO 0.15 0.55 -0.52 -0.24 -2.27 0.00 0.00 179.45 177.11 2ba1 h VAL 104 N -0.41 1.31 -0.58 2.00 3.04 -1.41 -2.36 116.25 117.84 2ba1 h VAL 104 Ca 0.00 -1.75 -0.05 0.00 -1.01 0.00 0.00 66.70 63.89 2ba1 h VAL 104 Cb 0.53 1.72 -0.03 0.00 -2.01 0.00 0.00 31.29 31.51 2ba1 h VAL 104 CO 0.01 0.55 0.14 0.28 -1.01 0.00 0.00 177.57 177.54 2ba1 h SER 105 N 0.46 0.83 0.98 3.17 0.02 -1.24 -1.67 113.55 116.11 2ba1 h SER 105 Ca 0.02 -0.15 -0.05 0.00 -0.84 0.00 0.00 61.79 60.76 2ba1 h SER 105 Cb 1.06 -0.22 -0.01 0.00 0.14 0.00 0.00 62.40 63.38 2ba1 h SER 105 CO 0.10 0.81 -0.24 0.50 -1.14 0.00 0.00 176.83 176.87 2ba1 h LYS 106 N 0.86 0.00 0.00 3.45 3.64 -1.25 -3.04 116.57 120.23 2ba1 h LYS 106 Ca 0.19 0.00 -0.13 0.00 -1.27 0.00 0.00 60.65 59.43 2ba1 h LYS 106 Cb 0.31 0.00 -0.02 0.00 -0.41 0.00 0.00 32.23 32.11 2ba1 h LYS 106 CO -0.00 0.24 -0.63 0.93 -2.27 0.00 0.00 179.45 177.71 2ba1 h GLU 107 N 0.00 0.00 -0.04 1.90 5.08 -0.77 -2.32 114.58 118.43 2ba1 h GLU 107 Ca -0.00 0.00 -0.13 0.00 -1.00 0.00 0.00 59.36 58.23 2ba1 h GLU 107 Cb 0.79 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 30.03 2ba1 h GLU 107 CO 0.03 0.63 -0.56 0.00 -1.00 0.00 0.00 179.01 178.11 2ba1 h ALA 108 N 1.37 1.01 0.00 3.43 0.00 -1.31 -3.08 119.26 120.68 2ba1 h ALA 108 Ca -0.01 -0.51 0.00 0.00 0.00 0.00 0.00 54.91 54.40 2ba1 h ALA 108 Cb 1.44 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 19.15 2ba1 h ALA 108 CO 0.08 0.70 -1.06 1.19 0.00 0.00 0.00 179.25 180.16 2ba1 n PHE 109 N -3.89 0.71 0.23 0.00 3.01 -1.20 -3.82 117.46 112.49 2ba1 n PHE 109 Ca -0.02 0.21 0.07 0.00 1.01 0.00 0.00 57.45 58.72 2ba1 n PHE 109 Cb 0.57 -0.79 0.55 0.00 -0.01 0.00 0.00 39.48 39.80 2ba1 n PHE 109 CO 0.00 0.00 0.00 0.93 1.01 0.00 0.00 176.76 178.70 2ba1 h GLU 110 N 0.00 0.00 0.00 -1.08 5.08 -1.32 0.27 114.58 117.53 2ba1 h GLU 110 Ca 0.00 0.00 -0.15 0.00 -1.00 0.00 0.00 59.36 58.21 2ba1 h GLU 110 Cb 0.92 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 30.15 2ba1 h GLU 110 CO 0.00 0.21 -1.06 0.00 -1.00 0.00 0.00 179.01 177.16 2ba1 h ALA 111 N 1.79 0.64 0.07 3.43 0.00 -1.67 -3.38 119.26 120.14 2ba1 h ALA 111 Ca -0.00 -0.74 -0.31 0.00 0.00 0.00 0.00 54.91 53.86 2ba1 h ALA 111 Cb 0.43 0.12 -0.02 0.00 0.00 0.00 0.00 17.79 18.31 2ba1 h ALA 111 CO 0.03 0.87 -1.68 0.28 0.00 0.00 0.00 179.25 178.75 2ba1 n VAL 112 N -3.06 1.68 -2.20 0.00 0.31 -0.84 -4.90 118.33 109.33 2ba1 n VAL 112 Ca -0.05 -0.38 -0.41 0.00 -0.01 0.00 0.00 64.34 63.49 2ba1 n VAL 112 Cb 0.82 -1.87 -0.03 0.00 -0.91 0.00 0.00 33.84 31.85 2ba1 n VAL 112 CO 0.00 0.00 0.00 -0.63 -1.32 0.00 0.00 176.83 174.88 2ba1 s ILE 113 N -2.47 2.90 -0.91 2.52 1.01 0.90 -1.32 121.20 123.82 2ba1 s ILE 113 Ca -0.25 0.90 -0.05 0.00 0.00 0.00 0.00 60.65 61.25 2ba1 s ILE 113 Cb 0.06 -3.57 0.08 0.00 0.01 0.00 0.00 42.46 39.05 2ba1 s ILE 113 CO 0.69 0.21 2.59 0.23 0.00 0.00 0.00 174.94 178.66 2ba1 n MET 114 N 0.97 3.57 0.14 2.79 2.81 -0.80 -4.73 117.12 121.86 2ba1 n MET 114 Ca 0.00 -2.91 0.05 0.00 -1.81 0.00 0.00 57.70 53.03 2ba1 n MET 114 Cb 0.42 -2.40 0.28 0.00 -0.71 0.00 0.00 33.22 30.81 2ba1 n MET 114 CO 0.00 0.00 0.00 0.36 1.51 0.00 0.00 175.97 177.84 2ba1 n LYS 115 N 1.37 0.07 0.12 0.03 2.85 -1.26 -1.37 118.16 119.96 2ba1 n LYS 115 Ca 0.56 0.52 0.12 0.00 -1.05 0.00 0.00 58.31 58.46 2ba1 n LYS 115 Cb 0.40 -2.04 0.47 0.00 -0.65 0.00 0.00 35.03 33.20 2ba1 n LYS 115 CO 0.00 0.00 0.00 0.39 -0.05 0.00 0.00 177.40 177.74 2ba1 n GLU 116 N -1.91 0.20 0.19 -1.58 4.71 -1.26 0.11 120.64 121.10 2ba1 n GLU 116 Ca -0.01 0.36 0.08 0.00 -0.01 0.00 0.00 57.16 57.59 2ba1 n GLU 116 Cb 0.32 -1.84 0.20 0.00 -1.01 0.00 0.00 31.44 29.11 2ba1 n GLU 116 CO 0.00 0.00 0.00 -0.07 0.09 0.00 0.00 177.13 177.15 2ba1 h LEU 117 N 0.00 0.00 -6.61 -4.62 3.38 -1.52 -3.38 115.31 102.56 2ba1 h LEU 117 Ca 0.00 0.00 -0.61 0.00 0.09 0.00 0.00 57.88 57.36 2ba1 h LEU 117 Cb 0.45 0.00 -0.41 0.00 0.09 0.00 0.00 40.66 40.78 2ba1 h LEU 117 CO 0.00 0.23 -0.65 0.49 0.09 0.00 0.00 178.44 178.60 2ba1 n PHE 118 N -3.19 2.78 -1.51 1.13 3.01 -1.08 -5.06 117.46 113.53 2ba1 n PHE 118 Ca 0.02 -4.11 -0.34 0.00 1.01 0.00 0.00 57.45 54.03 2ba1 n PHE 118 Cb 0.58 -0.50 0.08 0.00 -0.01 0.00 0.00 39.48 39.63 2ba1 n PHE 118 CO 0.00 0.00 0.00 -2.14 1.01 0.00 0.00 176.76 175.63 2ba1 s PRO 119 N -1.70 2.29 0.00 -1.08 0.02 -1.26 -2.35 135.00 130.93 2ba1 s PRO 119 Ca 0.32 1.68 0.00 0.00 0.02 0.00 0.00 61.00 63.02 2ba1 s PRO 119 Cb 0.05 -1.86 0.00 0.00 0.02 0.00 0.00 34.50 32.71 2ba1 s PRO 119 CO -0.11 -1.70 0.00 0.54 -0.33 0.00 0.00 177.00 175.40 2ba1 n ARG 120 N -2.63 0.00 -2.00 5.54 1.74 0.40 -4.83 116.66 114.87 2ba1 n ARG 120 Ca 0.13 0.00 -0.18 0.00 -0.77 0.00 0.00 57.85 57.03 2ba1 n ARG 120 Cb 0.51 -3.41 0.10 0.00 -1.02 0.00 0.00 32.46 28.63 2ba1 n ARG 120 CO 0.00 0.00 0.00 0.43 -1.52 0.00 0.00 177.63 176.54 2ba1 n SER 121 N 0.00 0.89 -3.76 0.55 7.64 -1.11 -3.72 113.62 114.12 2ba1 n SER 121 Ca 0.00 -1.79 -0.12 0.00 1.01 0.00 0.00 58.87 57.96 2ba1 n SER 121 Cb 0.00 -0.53 -0.12 0.00 -1.01 0.00 0.00 64.21 62.55 2ba1 n SER 121 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 2ba1 s ALA 122 N -3.21 -0.68 -0.27 -0.43 0.00 0.37 -2.08 121.76 115.46 2ba1 s ALA 122 Ca 0.51 0.90 0.00 0.00 0.00 0.00 0.00 51.96 53.38 2ba1 s ALA 122 Cb -0.03 -0.54 0.05 0.00 0.00 0.00 0.00 23.12 22.60 2ba1 s ALA 122 CO 0.34 -0.16 -0.06 0.42 0.00 0.00 0.00 175.76 176.30 2ba1 s ILE 123 N 0.56 2.64 -0.19 0.00 1.01 -0.89 -1.55 121.20 122.77 2ba1 s ILE 123 Ca -0.03 -1.37 -0.08 0.00 0.00 0.00 0.00 60.65 59.17 2ba1 s ILE 123 Cb -0.05 -2.47 -0.04 0.00 0.01 0.00 0.00 42.46 39.91 2ba1 s ILE 123 CO -0.03 0.02 0.07 -1.81 0.00 0.00 0.00 174.94 173.19 2ba1 s ASP 124 N 1.22 5.62 -0.17 3.58 1.11 -1.15 -2.40 116.67 124.48 2ba1 s ASP 124 Ca -0.05 0.05 -0.05 0.00 0.18 0.00 0.00 52.55 52.68 2ba1 s ASP 124 Cb -0.19 -1.97 -0.03 0.00 1.07 0.00 0.00 42.92 41.80 2ba1 s ASP 124 CO -0.04 0.14 0.01 -0.63 1.18 0.00 0.00 175.17 175.84 2ba1 s ILE 125 N 0.56 4.31 -0.17 0.77 -1.09 0.21 -1.64 121.20 124.15 2ba1 s ILE 125 Ca 0.04 -0.21 0.00 0.00 -2.23 0.00 0.00 60.65 58.25 2ba1 s ILE 125 Cb -0.13 -2.92 0.03 0.00 -1.58 0.00 0.00 42.46 37.87 2ba1 s ILE 125 CO 0.01 0.48 -0.11 -0.36 -1.23 0.00 0.00 174.94 173.72 2ba1 s PHE 126 N 0.39 2.17 -0.03 3.97 0.40 0.29 -1.13 117.98 124.05 2ba1 s PHE 126 Ca -0.01 -1.32 0.07 0.00 -0.60 0.00 0.00 56.93 55.08 2ba1 s PHE 126 Cb -0.13 -1.56 -0.02 0.00 0.51 0.00 0.00 43.02 41.81 2ba1 s PHE 126 CO 0.02 -0.68 -0.24 0.08 0.70 0.00 0.00 175.22 175.09 2ba1 s VAL 127 N 1.48 2.17 -0.10 -0.44 1.01 -0.78 0.10 120.40 123.84 2ba1 s VAL 127 Ca 0.02 -1.06 -0.01 0.00 0.00 0.00 0.00 61.98 60.94 2ba1 s VAL 127 Cb -0.14 -1.77 0.03 0.00 0.00 0.00 0.00 36.38 34.50 2ba1 s VAL 127 CO -0.09 0.58 -0.05 -0.70 0.00 0.00 0.00 175.10 174.83 2ba1 s GLU 128 N -0.54 1.25 -0.40 2.72 2.56 0.43 -2.15 118.70 122.56 2ba1 s GLU 128 Ca 0.08 -0.14 -0.20 0.00 0.00 0.00 0.00 54.97 54.70 2ba1 s GLU 128 Cb -0.11 -1.40 0.01 0.00 2.00 0.00 0.00 34.13 34.64 2ba1 s GLU 128 CO -0.00 -0.27 0.61 0.54 -0.56 0.00 0.00 175.26 175.57 2ba1 s VAL 129 N 1.78 4.89 0.00 3.70 0.11 -0.61 -1.30 120.40 128.97 2ba1 s VAL 129 Ca 0.05 0.27 0.11 0.00 -2.93 0.00 0.00 61.98 59.47 2ba1 s VAL 129 Cb -0.12 -4.12 -0.14 0.00 -1.53 0.00 0.00 36.38 30.47 2ba1 s VAL 129 CO -0.07 -0.44 1.17 -0.07 -3.33 0.00 0.00 175.10 172.36 2ba1 h LEU 130 N 9.47 0.00 -7.47 2.54 3.38 -1.45 -2.11 115.31 119.68 2ba1 h LEU 130 Ca -0.26 0.00 -0.30 0.00 0.09 0.00 0.00 57.88 57.41 2ba1 h LEU 130 Cb 1.11 0.00 -0.35 0.00 0.09 0.00 0.00 40.66 41.51 2ba1 h LEU 130 CO 0.85 0.84 -0.71 -1.58 0.09 0.00 0.00 178.44 177.93 2ba1 s GLN 131 N -2.77 -0.03 0.03 1.13 0.74 -0.99 -3.46 119.66 114.32 2ba1 s GLN 131 Ca 0.00 0.26 0.03 0.00 0.05 0.00 0.00 55.36 55.70 2ba1 s GLN 131 Cb 0.09 -0.28 -0.04 0.00 1.10 0.00 0.00 33.01 33.88 2ba1 s GLN 131 CO 0.80 -0.20 -0.00 0.00 -0.55 0.00 0.00 175.29 175.34 2ba1 s ALA 132 N 1.31 3.28 0.16 1.58 0.00 0.18 -1.59 121.76 126.67 2ba1 s ALA 132 Ca -0.06 -1.01 -0.03 0.00 0.00 0.00 0.00 51.96 50.86 2ba1 s ALA 132 Cb -0.13 -1.28 0.01 0.00 0.00 0.00 0.00 23.12 21.72 2ba1 s ALA 132 CO -0.04 0.67 0.25 -3.47 0.00 0.00 0.00 175.76 173.18 2ba1 n ASP 133 N 1.10 -0.72 -4.76 0.00 2.03 -1.26 -4.80 116.55 108.14 2ba1 n ASP 133 Ca -0.13 -1.78 -0.38 0.00 0.52 0.00 0.00 54.79 53.02 2ba1 n ASP 133 Cb 0.52 1.28 0.01 0.00 -0.72 0.00 0.00 41.12 42.21 2ba1 n ASP 133 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 2ba1 s ALA 134 N -1.89 3.00 0.00 -1.67 0.00 -1.26 -3.41 121.76 116.53 2ba1 s ALA 134 Ca 0.11 1.13 0.00 0.00 0.00 0.00 0.00 51.96 53.20 2ba1 s ALA 134 Cb -0.01 -3.46 0.00 0.00 0.00 0.00 0.00 23.12 19.65 2ba1 s ALA 134 CO 0.08 -0.91 0.00 0.41 0.00 0.00 0.00 175.76 175.34 2ba1 n GLY 135 N 0.59 0.94 0.50 0.00 0.00 -1.26 -4.81 105.19 101.15 2ba1 n GLY 135 Ca 0.07 0.00 0.33 0.00 0.00 0.00 0.00 46.02 46.42 2ba1 n GLY 135 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 2ba1 h SER 136 N 0.00 0.16 -0.72 1.61 4.64 -1.94 0.44 113.55 117.73 2ba1 h SER 136 Ca 0.00 0.04 0.04 0.00 -0.47 0.00 0.00 61.79 61.40 2ba1 h SER 136 Cb 0.00 0.02 -0.05 0.00 -0.31 0.00 0.00 62.40 62.06 2ba1 h SER 136 CO 0.00 0.01 0.45 -0.09 -0.87 0.00 0.00 176.83 176.32 2ba1 h ARG 137 N 0.13 0.84 0.04 4.77 2.43 -1.91 0.29 114.38 120.96 2ba1 h ARG 137 Ca 0.63 -0.05 -0.23 0.00 -0.81 0.00 0.00 59.98 59.52 2ba1 h ARG 137 Cb 2.18 -0.19 -0.00 0.00 -0.42 0.00 0.00 29.97 31.53 2ba1 h ARG 137 CO -0.14 0.56 -1.01 1.79 -1.51 0.00 0.00 179.97 179.66 2ba1 h THR 138 N 0.86 1.49 0.13 0.20 1.35 -0.50 -2.95 112.91 113.50 2ba1 h THR 138 Ca 0.29 -2.76 -0.00 0.00 -0.55 0.00 0.00 66.41 63.39 2ba1 h THR 138 Cb 0.05 2.62 -0.00 0.00 -1.73 0.00 0.00 68.15 69.09 2ba1 h THR 138 CO -0.12 0.81 -0.09 0.00 -0.25 0.00 0.00 175.52 175.87 2ba1 h ALA 139 N 0.80 -0.21 -0.95 6.62 0.00 -0.89 -1.17 119.26 123.45 2ba1 h ALA 139 Ca -0.08 -0.04 0.11 0.00 0.00 0.00 0.00 54.91 54.91 2ba1 h ALA 139 Cb 1.68 0.12 -0.07 0.00 0.00 0.00 0.00 17.79 19.51 2ba1 h ALA 139 CO 0.16 -0.63 0.61 0.00 0.00 0.00 0.00 179.25 179.39 2ba1 h LEU 141 N 0.93 0.49 0.04 0.00 3.38 -1.27 0.66 115.31 119.54 2ba1 h LEU 141 Ca 0.46 -0.35 0.00 0.00 0.09 0.00 0.00 57.88 58.09 2ba1 h LEU 141 Cb 0.48 -0.13 -0.01 0.00 0.09 0.00 0.00 40.66 41.09 2ba1 h LEU 141 CO -0.22 0.72 -0.05 0.78 0.09 0.00 0.00 178.44 179.76 2ba1 h ASN 142 N 0.25 -0.13 -0.74 -0.43 2.35 -0.29 -0.26 115.58 116.32 2ba1 h ASN 142 Ca 0.07 0.02 0.07 0.00 -0.55 0.00 0.00 56.30 55.90 2ba1 h ASN 142 Cb 0.49 0.05 -0.06 0.00 0.05 0.00 0.00 38.32 38.85 2ba1 h ASN 142 CO 0.02 -0.08 0.42 0.00 -1.65 0.00 0.00 177.43 176.15 2ba1 h ALA 143 N 0.85 1.02 -0.50 -0.83 0.00 -0.02 -2.10 119.26 117.67 2ba1 h ALA 143 Ca 0.01 0.02 -0.10 0.00 0.00 0.00 0.00 54.91 54.84 2ba1 h ALA 143 Cb 0.11 -0.14 -0.02 0.00 0.00 0.00 0.00 17.79 17.74 2ba1 h ALA 143 CO -0.02 0.10 -0.08 0.00 0.00 0.00 0.00 179.25 179.24 2ba1 h ALA 144 N 1.39 0.90 -0.55 0.00 0.00 0.78 -1.86 119.26 119.92 2ba1 h ALA 144 Ca 0.34 -0.33 -0.06 0.00 0.00 0.00 0.00 54.91 54.87 2ba1 h ALA 144 Cb 0.24 -0.19 -0.02 0.00 0.00 0.00 0.00 17.79 17.81 2ba1 h ALA 144 CO -0.20 0.64 0.11 1.03 0.00 0.00 0.00 179.25 180.83 2ba1 h SER 145 N 0.83 0.80 0.40 0.00 0.87 -0.49 0.14 113.55 116.10 2ba1 h SER 145 Ca 0.14 -0.15 -0.02 0.00 -1.23 0.00 0.00 61.79 60.53 2ba1 h SER 145 Cb 0.61 -0.21 0.00 0.00 -0.44 0.00 0.00 62.40 62.36 2ba1 h SER 145 CO 0.04 0.80 -0.19 0.58 -0.53 0.00 0.00 176.83 177.52 2ba1 h VAL 146 N 0.82 0.57 -0.92 2.23 2.07 -1.20 -2.27 116.25 117.54 2ba1 h VAL 146 Ca 0.18 -0.41 0.21 0.00 0.82 0.00 0.00 66.70 67.50 2ba1 h VAL 146 Cb 0.33 0.76 -0.07 0.00 -1.52 0.00 0.00 31.29 30.78 2ba1 h VAL 146 CO 0.00 0.07 0.61 0.00 0.02 0.00 0.00 177.57 178.27 2ba1 h ALA 147 N -0.31 2.16 -0.54 1.67 0.00 -1.02 0.13 119.26 121.34 2ba1 h ALA 147 Ca -0.06 0.03 -0.12 0.00 0.00 0.00 0.00 54.91 54.76 2ba1 h ALA 147 Cb 0.53 -0.03 -0.02 0.00 0.00 0.00 0.00 17.79 18.28 2ba1 h ALA 147 CO 0.09 -0.46 -0.12 -0.07 0.00 0.00 0.00 179.25 178.69 2ba1 h LEU 148 N 0.44 1.05 -0.26 0.00 3.38 -0.52 -0.80 115.31 118.60 2ba1 h LEU 148 Ca 0.49 -0.36 -0.10 0.00 0.09 0.00 0.00 57.88 58.00 2ba1 h LEU 148 Cb 1.17 -0.29 -0.00 0.00 0.09 0.00 0.00 40.66 41.63 2ba1 h LEU 148 CO -0.20 1.16 -0.24 0.58 0.09 0.00 0.00 178.44 179.83 2ba1 h VAL 149 N 0.92 1.31 -0.78 1.22 2.07 -0.30 -1.22 116.25 119.48 2ba1 h VAL 149 Ca 0.14 -1.39 0.10 0.00 0.82 0.00 0.00 66.70 66.36 2ba1 h VAL 149 Cb 0.70 1.63 -0.05 0.00 -1.52 0.00 0.00 31.29 32.04 2ba1 h VAL 149 CO 0.05 0.44 0.51 -0.78 0.02 0.00 0.00 177.57 177.81 2ba1 h ASP 150 N 0.34 0.63 1.19 0.57 -0.00 -0.78 0.72 116.42 119.09 2ba1 h ASP 150 Ca 0.04 0.02 0.00 0.00 -0.00 0.00 0.00 57.03 57.09 2ba1 h ASP 150 Cb 0.79 -0.12 0.00 0.00 -0.00 0.00 0.00 39.33 40.01 2ba1 h ASP 150 CO 0.06 0.38 0.00 0.00 -0.00 0.00 0.00 179.24 179.68 2ba1 n ALA 151 N -2.45 2.23 -1.69 -0.78 0.00 -0.31 -4.71 120.51 112.79 2ba1 n ALA 151 Ca 0.13 -0.05 -0.10 0.00 0.00 0.00 0.00 53.44 53.42 2ba1 n ALA 151 Cb 0.33 -1.45 -0.03 0.00 0.00 0.00 0.00 19.45 18.30 2ba1 n ALA 151 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2ba1 n GLY 152 N 1.24 0.63 3.71 0.00 0.00 0.25 -4.86 105.19 106.16 2ba1 n GLY 152 Ca 0.06 -0.51 -0.42 0.00 0.00 0.00 0.00 46.02 45.15 2ba1 n GLY 152 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 2ba1 s VAL 153 N -2.44 4.81 0.17 1.61 -7.23 -0.83 -4.97 120.40 111.53 2ba1 s VAL 153 Ca 0.00 2.04 -0.33 0.00 -1.81 0.00 0.00 61.98 61.88 2ba1 s VAL 153 Cb 0.00 -4.31 -0.15 0.00 0.56 0.00 0.00 36.38 32.48 2ba1 s VAL 153 CO 0.00 0.17 1.41 -2.65 -0.31 0.00 0.00 175.10 173.72 2ba1 n PRO 154 N 3.80 1.75 -4.05 4.82 -0.02 -1.26 -4.74 135.00 135.31 2ba1 n PRO 154 Ca 0.06 0.63 -0.07 0.00 -2.02 0.00 0.00 63.50 62.09 2ba1 n PRO 154 Cb 0.51 -2.30 -0.10 0.00 -0.02 0.00 0.00 33.50 31.59 2ba1 n PRO 154 CO 0.00 0.00 0.00 -1.64 1.98 0.00 0.00 175.50 175.84 2ba1 s MET 155 N 0.22 0.62 0.34 -0.52 -1.94 -1.26 -1.90 119.30 114.85 2ba1 s MET 155 Ca 0.76 -1.12 0.18 0.00 -1.71 0.00 0.00 55.69 53.79 2ba1 s MET 155 Cb -0.75 0.22 0.44 0.00 2.01 0.00 0.00 34.83 36.74 2ba1 s MET 155 CO 0.45 -0.13 1.61 0.87 -0.01 0.00 0.00 175.02 177.82 2ba1 h LYS 156 N 3.23 0.00 0.00 2.03 1.57 -1.55 -3.47 116.57 118.38 2ba1 h LYS 156 Ca -0.34 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.44 2ba1 h LYS 156 Cb 1.15 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.46 2ba1 h LYS 156 CO 0.62 0.42 0.00 0.41 -0.57 0.00 0.00 179.45 180.33 2ba1 n GLY 157 N 0.67 -0.71 3.97 3.86 0.00 -1.26 -4.89 105.19 106.82 2ba1 n GLY 157 Ca 0.01 -0.71 -0.21 0.00 0.00 0.00 0.00 46.02 45.11 2ba1 n GLY 157 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 2ba1 s MET 158 N -0.28 3.14 -0.20 1.61 -1.94 -0.90 -4.88 119.30 115.84 2ba1 s MET 158 Ca 0.00 -0.74 0.01 0.00 -1.71 0.00 0.00 55.69 53.25 2ba1 s MET 158 Cb 0.00 -2.71 0.03 0.00 2.01 0.00 0.00 34.83 34.16 2ba1 s MET 158 CO 0.00 -0.05 -0.16 0.42 -0.01 0.00 0.00 175.02 175.22 2ba1 s ILE 159 N -2.33 2.20 0.09 2.53 1.09 -1.26 -1.12 121.20 122.40 2ba1 s ILE 159 Ca 0.45 -1.07 0.08 0.00 -1.10 0.00 0.00 60.65 59.01 2ba1 s ILE 159 Cb -0.10 -2.02 -0.04 0.00 -1.06 0.00 0.00 42.46 39.25 2ba1 s ILE 159 CO 0.34 0.39 -0.18 -0.89 -0.10 0.00 0.00 174.94 174.50 2ba1 s THR 160 N 1.26 2.84 -0.07 2.92 2.01 -0.64 -4.49 115.64 119.47 2ba1 s THR 160 Ca 0.02 -1.39 -0.06 0.00 0.31 0.00 0.00 61.69 60.57 2ba1 s THR 160 Cb -0.15 -2.26 0.02 0.00 0.01 0.00 0.00 72.50 70.12 2ba1 s THR 160 CO -0.10 0.18 0.18 -0.55 -0.69 0.00 0.00 174.62 173.64 2ba1 s SER 161 N -1.89 -0.18 0.08 3.53 0.15 -1.26 -0.17 113.70 113.96 2ba1 s SER 161 Ca 0.17 0.36 -0.13 0.00 0.70 0.00 0.00 55.95 57.05 2ba1 s SER 161 Cb -0.11 0.35 0.02 0.00 -1.71 0.00 0.00 66.02 64.58 2ba1 s SER 161 CO 0.08 -0.07 0.31 -0.69 1.20 0.00 0.00 173.24 174.07 2ba1 s VAL 162 N 0.25 0.10 0.08 4.45 1.01 -0.42 -4.74 120.40 121.12 2ba1 s VAL 162 Ca -0.01 -0.78 0.08 0.00 0.00 0.00 0.00 61.98 61.27 2ba1 s VAL 162 Cb -0.03 -1.14 -0.04 0.00 0.00 0.00 0.00 36.38 35.18 2ba1 s VAL 162 CO -0.01 -0.43 -0.20 0.00 0.00 0.00 0.00 175.10 174.46 2ba1 s ALA 163 N -3.36 2.57 -0.13 5.51 0.00 -1.26 0.93 121.76 126.03 2ba1 s ALA 163 Ca 0.01 -1.29 0.01 0.00 0.00 0.00 0.00 51.96 50.68 2ba1 s ALA 163 Cb 0.02 -0.64 -0.01 0.00 0.00 0.00 0.00 23.12 22.49 2ba1 s ALA 163 CO -0.08 0.57 -0.16 0.08 0.00 0.00 0.00 175.76 176.17 2ba1 s VAL 164 N -1.01 2.73 0.00 0.00 1.01 -0.84 -0.54 120.40 121.75 2ba1 s VAL 164 Ca 0.15 -0.77 0.00 0.00 0.00 0.00 0.00 61.98 61.36 2ba1 s VAL 164 Cb -0.10 -2.13 0.00 0.00 0.00 0.00 0.00 36.38 34.15 2ba1 s VAL 164 CO 0.07 0.53 0.00 0.61 0.00 0.00 0.00 175.10 176.31 2ba1 n GLY 165 N 3.62 2.60 3.27 4.51 0.00 0.14 -0.44 105.19 118.88 2ba1 n GLY 165 Ca -0.18 -2.09 -0.02 0.00 0.00 0.00 0.00 46.02 43.72 2ba1 n GLY 165 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 2ba1 s LYS 166 N 0.37 0.49 0.01 1.61 2.20 -1.04 -1.97 119.74 121.41 2ba1 s LYS 166 Ca 0.00 1.05 0.07 0.00 -0.36 0.00 0.00 55.97 56.73 2ba1 s LYS 166 Cb 0.00 0.41 -0.02 0.00 -1.51 0.00 0.00 37.83 36.71 2ba1 s LYS 166 CO 0.00 -0.44 -0.20 0.00 -0.36 0.00 0.00 175.35 174.35 2ba1 s ALA 167 N 2.77 1.70 -1.80 3.13 0.00 0.51 -0.50 121.76 127.56 2ba1 s ALA 167 Ca 0.08 -0.96 -0.22 0.00 0.00 0.00 0.00 51.96 50.87 2ba1 s ALA 167 Cb -0.14 -0.38 0.21 0.00 0.00 0.00 0.00 23.12 22.81 2ba1 s ALA 167 CO -0.18 0.40 0.67 -0.25 0.00 0.00 0.00 175.76 176.40 2ba1 n ASP 168 N 2.22 -2.43 0.00 0.00 10.43 -1.26 0.16 116.55 125.67 2ba1 n ASP 168 Ca -0.16 -1.14 0.00 0.00 2.57 0.00 0.00 54.79 56.06 2ba1 n ASP 168 Cb 0.53 -2.05 0.00 0.00 1.84 0.00 0.00 41.12 41.44 2ba1 n ASP 168 CO 0.00 0.00 0.00 0.61 -1.07 0.00 0.00 177.20 176.74 2ba1 n GLY 169 N -1.18 2.79 3.63 0.44 0.00 -1.26 -5.00 105.19 104.61 2ba1 n GLY 169 Ca 0.10 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.78 2ba1 n GLY 169 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 2ba1 s GLN 170 N -0.03 3.78 0.19 1.61 2.00 0.43 -5.08 119.66 122.56 2ba1 s GLN 170 Ca 0.00 -0.37 -0.31 0.00 -2.00 0.00 0.00 55.36 52.68 2ba1 s GLN 170 Cb 0.00 -3.11 -0.10 0.00 0.80 0.00 0.00 33.01 30.60 2ba1 s GLN 170 CO 0.00 0.35 1.50 -0.51 -0.50 0.00 0.00 175.29 176.13 2ba1 s LEU 171 N 0.13 4.38 0.05 3.68 1.02 -1.26 -0.36 118.68 126.31 2ba1 s LEU 171 Ca 0.04 2.61 0.05 0.00 0.02 0.00 0.00 54.13 56.84 2ba1 s LEU 171 Cb -0.12 -3.61 -0.02 0.00 0.02 0.00 0.00 46.19 42.46 2ba1 s LEU 171 CO 0.01 -0.76 -0.13 0.68 0.02 0.00 0.00 176.35 176.17 2ba1 s VAL 172 N 0.66 1.02 0.11 -1.59 -7.23 -0.83 -4.78 120.40 107.75 2ba1 s VAL 172 Ca 0.65 -1.10 -0.17 0.00 -1.81 0.00 0.00 61.98 59.54 2ba1 s VAL 172 Cb -0.42 -0.96 -0.07 0.00 0.56 0.00 0.00 36.38 35.49 2ba1 s VAL 172 CO 0.36 -0.13 0.57 -0.22 -0.31 0.00 0.00 175.10 175.37 2ba1 s LEU 173 N -1.40 4.44 -0.85 1.32 2.96 0.24 0.25 118.68 125.64 2ba1 s LEU 173 Ca -0.01 1.20 -0.04 0.00 -0.22 0.00 0.00 54.13 55.05 2ba1 s LEU 173 Cb -0.09 -3.09 -0.00 0.00 0.50 0.00 0.00 46.19 43.51 2ba1 s LEU 173 CO 0.02 0.19 0.68 -0.67 -1.32 0.00 0.00 176.35 175.24 2ba1 n ASP 174 N 1.28 -6.13 -4.75 3.68 4.64 0.30 -4.70 116.55 110.88 2ba1 n ASP 174 Ca -0.08 -0.62 -0.38 0.00 -1.38 0.00 0.00 54.79 52.33 2ba1 n ASP 174 Cb 0.51 -3.46 0.04 0.00 -1.04 0.00 0.00 41.12 37.18 2ba1 n ASP 174 CO 0.00 0.00 0.00 -2.16 -0.82 0.00 0.00 177.20 174.22 2ba1 s PRO 175 N -4.36 3.09 0.52 -0.67 0.04 -1.25 -4.76 135.00 127.60 2ba1 s PRO 175 Ca 0.09 2.11 0.05 0.00 0.04 0.00 0.00 61.00 63.29 2ba1 s PRO 175 Cb -0.03 -2.17 0.04 0.00 0.04 0.00 0.00 34.50 32.38 2ba1 s PRO 175 CO 0.83 -1.19 0.72 0.00 0.04 0.00 0.00 177.00 177.40 2ba1 s MET 176 N -3.01 2.53 0.20 4.56 0.23 -1.26 -4.46 119.30 118.09 2ba1 s MET 176 Ca 0.73 -1.10 -0.18 0.00 -1.03 0.00 0.00 55.69 54.11 2ba1 s MET 176 Cb -0.38 -2.60 0.18 0.00 -1.53 0.00 0.00 34.83 30.51 2ba1 s MET 176 CO 0.43 -0.64 1.59 -0.22 -2.03 0.00 0.00 175.02 174.15 2ba1 h LYS 177 N 0.24 -0.10 -0.14 3.16 3.64 -1.91 -1.22 116.57 120.23 2ba1 h LYS 177 Ca -0.39 0.01 -0.05 0.00 -1.27 0.00 0.00 60.65 58.95 2ba1 h LYS 177 Cb 1.29 0.02 -0.01 0.00 -0.41 0.00 0.00 32.23 33.12 2ba1 h LYS 177 CO 0.47 -0.07 -0.13 0.93 -2.27 0.00 0.00 179.45 178.39 2ba1 h GLU 178 N -0.10 0.21 0.00 1.90 5.08 -1.98 0.12 114.58 119.81 2ba1 h GLU 178 Ca 0.28 -0.05 0.00 0.00 -1.00 0.00 0.00 59.36 58.59 2ba1 h GLU 178 Cb 0.55 -0.03 0.00 0.00 0.50 0.00 0.00 28.75 29.77 2ba1 h GLU 178 CO -0.73 0.35 -0.16 0.39 -1.00 0.00 0.00 179.01 177.85 2ba1 n GLU 179 N -4.29 0.27 -0.01 2.33 1.02 -0.74 -0.93 120.64 118.29 2ba1 n GLU 179 Ca -0.01 0.18 -0.05 0.00 -0.02 0.00 0.00 57.16 57.26 2ba1 n GLU 179 Cb 0.26 -1.77 -0.12 0.00 -0.02 0.00 0.00 31.44 29.78 2ba1 n GLU 179 CO 0.00 0.00 0.00 -3.47 1.18 0.00 0.00 177.13 174.84 2ba1 n ASP 180 N -2.21 0.71 -0.02 1.62 2.03 -0.54 -1.67 116.55 116.47 2ba1 n ASP 180 Ca 0.05 0.33 -0.14 0.00 0.52 0.00 0.00 54.79 55.55 2ba1 n ASP 180 Cb 0.43 0.24 -0.14 0.00 -0.72 0.00 0.00 41.12 40.93 2ba1 n ASP 180 CO 0.00 0.00 0.00 0.59 -1.92 0.00 0.00 177.20 175.87 2ba1 n ASN 181 N -2.92 1.35 -0.37 1.67 3.02 0.33 -4.46 115.26 113.88 2ba1 n ASN 181 Ca -0.16 0.30 0.05 0.00 -0.03 0.00 0.00 54.58 54.73 2ba1 n ASN 181 Cb 0.97 -0.33 0.04 0.00 -0.61 0.00 0.00 39.78 39.85 2ba1 n ASN 181 CO 0.00 0.00 0.00 0.49 -2.62 0.00 0.00 177.26 175.13 2ba1 n PHE 182 N -3.20 0.01 -0.79 3.10 3.01 -0.11 -5.02 117.46 114.45 2ba1 n PHE 182 Ca -0.24 -0.01 -0.08 0.00 1.01 0.00 0.00 57.45 58.12 2ba1 n PHE 182 Cb 1.05 -0.00 0.07 0.00 -0.01 0.00 0.00 39.48 40.59 2ba1 n PHE 182 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 2ba1 n GLY 183 N 0.52 -2.23 0.48 1.37 0.00 -0.67 -4.90 105.19 99.76 2ba1 n GLY 183 Ca 0.05 -1.51 0.06 0.00 0.00 0.00 0.00 46.02 44.62 2ba1 n GLY 183 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 2ba1 n GLU 184 N -2.29 0.74 -3.62 1.61 4.71 0.34 -4.99 120.64 117.14 2ba1 n GLU 184 Ca 0.04 -1.20 -0.03 0.00 -0.01 0.00 0.00 57.16 55.96 2ba1 n GLU 184 Cb 0.16 -1.23 -0.03 0.00 -1.01 0.00 0.00 31.44 29.34 2ba1 n GLU 184 CO 0.00 0.00 0.00 0.00 0.09 0.00 0.00 177.13 177.22 2ba1 s ALA 185 N -1.03 -2.13 -0.11 0.62 0.00 -1.25 -0.67 121.76 117.19 2ba1 s ALA 185 Ca 0.14 1.79 -0.05 0.00 0.00 0.00 0.00 51.96 53.84 2ba1 s ALA 185 Cb 0.10 -0.59 0.05 0.00 0.00 0.00 0.00 23.12 22.68 2ba1 s ALA 185 CO 0.16 -0.48 0.25 0.34 0.00 0.00 0.00 175.76 176.03 2ba1 s ASP 186 N -1.79 -0.08 -0.40 0.00 -1.08 0.02 -2.49 116.67 110.86 2ba1 s ASP 186 Ca 0.10 0.54 0.01 0.00 -0.52 0.00 0.00 52.55 52.68 2ba1 s ASP 186 Cb -0.01 0.49 0.14 0.00 -1.46 0.00 0.00 42.92 42.07 2ba1 s ASP 186 CO -0.04 -0.19 0.23 -0.32 0.52 0.00 0.00 175.17 175.36 2ba1 s MET 187 N 1.60 0.93 0.30 4.34 -2.45 0.41 -1.61 119.30 122.81 2ba1 s MET 187 Ca -0.06 -1.68 -0.29 0.00 -1.25 0.00 0.00 55.69 52.41 2ba1 s MET 187 Cb -0.11 -1.83 -0.10 0.00 1.25 0.00 0.00 34.83 34.04 2ba1 s MET 187 CO -0.09 -1.19 1.40 -1.25 1.05 0.00 0.00 175.02 174.95 2ba1 s PRO 188 N 0.70 4.27 0.12 4.11 0.04 -0.87 -1.98 135.00 141.38 2ba1 s PRO 188 Ca 0.18 2.32 0.04 0.00 0.04 0.00 0.00 61.00 63.58 2ba1 s PRO 188 Cb -0.23 -3.07 -0.04 0.00 0.04 0.00 0.00 34.50 31.19 2ba1 s PRO 188 CO 0.01 -0.36 -0.10 -0.06 0.04 0.00 0.00 177.00 176.52 2ba1 s PHE 189 N -0.57 1.17 -0.13 0.56 0.40 0.27 -2.23 117.98 117.44 2ba1 s PHE 189 Ca 0.55 -0.69 -0.07 0.00 -0.60 0.00 0.00 56.93 56.11 2ba1 s PHE 189 Cb -0.42 -0.62 0.05 0.00 0.51 0.00 0.00 43.02 42.54 2ba1 s PHE 189 CO 0.50 0.04 0.32 0.00 0.70 0.00 0.00 175.22 176.77 2ba1 s ALA 190 N -2.77 -0.78 0.24 5.36 0.00 0.33 -1.31 121.76 122.84 2ba1 s ALA 190 Ca 0.10 1.22 0.11 0.00 0.00 0.00 0.00 51.96 53.39 2ba1 s ALA 190 Cb -0.01 -0.75 -0.05 0.00 0.00 0.00 0.00 23.12 22.31 2ba1 s ALA 190 CO 0.00 -0.22 -0.21 -0.06 0.00 0.00 0.00 175.76 175.27 2ba1 s PHE 191 N 1.27 2.21 -0.20 0.00 0.40 0.76 0.71 117.98 123.14 2ba1 s PHE 191 Ca -0.09 -0.37 -0.17 0.00 -0.60 0.00 0.00 56.93 55.70 2ba1 s PHE 191 Cb -0.09 -1.01 -0.04 0.00 0.51 0.00 0.00 43.02 42.39 2ba1 s PHE 191 CO -0.10 0.60 0.45 -1.17 0.70 0.00 0.00 175.22 175.70 2ba1 s LEU 192 N -3.18 4.15 -0.23 -0.37 2.96 -0.38 -1.62 118.68 120.00 2ba1 s LEU 192 Ca 0.26 0.58 -0.08 0.00 -0.22 0.00 0.00 54.13 54.66 2ba1 s LEU 192 Cb -0.06 -2.60 -0.04 0.00 0.50 0.00 0.00 46.19 44.00 2ba1 s LEU 192 CO 0.12 -0.13 0.10 -0.63 -1.32 0.00 0.00 176.35 174.50 2ba1 s ILE 193 N 1.49 4.79 -0.16 6.68 1.09 -0.27 -1.64 121.20 133.17 2ba1 s ILE 193 Ca 0.21 -0.02 -0.03 0.00 -1.10 0.00 0.00 60.65 59.72 2ba1 s ILE 193 Cb -0.15 -3.22 0.05 0.00 -1.06 0.00 0.00 42.46 38.08 2ba1 s ILE 193 CO 0.09 0.36 0.04 -0.60 -0.10 0.00 0.00 174.94 174.73 2ba1 s ARG 194 N 1.16 0.55 -0.34 2.79 3.52 -1.04 -2.13 118.95 123.46 2ba1 s ARG 194 Ca 0.05 -0.25 -0.01 0.00 -0.13 0.00 0.00 55.73 55.40 2ba1 s ARG 194 Cb -0.14 -1.80 0.00 0.00 -1.56 0.00 0.00 34.95 31.45 2ba1 s ARG 194 CO 0.04 -0.57 0.29 -1.71 -0.81 0.00 0.00 175.30 172.55 2ba1 n ASN 195 N 5.11 -2.61 -2.16 -2.12 5.15 -1.26 -3.44 115.26 113.93 2ba1 n ASN 195 Ca -0.08 -0.15 -0.17 0.00 -0.60 0.00 0.00 54.58 53.57 2ba1 n ASN 195 Cb 0.48 -1.72 -0.03 0.00 -0.53 0.00 0.00 39.78 37.98 2ba1 n ASN 195 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 2ba1 n GLY 196 N -0.97 0.09 3.17 8.20 0.00 -1.26 -4.96 105.19 109.45 2ba1 n GLY 196 Ca -0.04 0.00 -0.12 0.00 0.00 0.00 0.00 46.02 45.86 2ba1 n GLY 196 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2ba1 s LYS 197 N -4.60 0.32 0.08 1.61 -2.85 -1.22 -5.09 119.74 107.99 2ba1 s LYS 197 Ca 0.00 0.56 -0.36 0.00 -1.00 0.00 0.00 55.97 55.17 2ba1 s LYS 197 Cb 0.00 0.02 -0.15 0.00 -2.06 0.00 0.00 37.83 35.64 2ba1 s LYS 197 CO 0.00 -0.11 1.49 -0.89 0.10 0.00 0.00 175.35 175.93 2ba1 n ILE 198 N 3.71 0.05 -0.03 3.79 2.08 -1.26 -2.50 119.36 125.19 2ba1 n ILE 198 Ca -0.20 -0.01 -0.08 0.00 0.56 0.00 0.00 62.75 63.03 2ba1 n ILE 198 Cb 0.55 -1.18 -0.03 0.00 -0.75 0.00 0.00 39.64 38.24 2ba1 n ILE 198 CO 0.00 0.00 0.00 1.21 0.56 0.00 0.00 176.55 178.32 2ba1 n GLU 199 N 3.26 0.16 -4.05 0.38 2.13 -0.65 -4.92 120.64 116.93 2ba1 n GLU 199 Ca 0.19 0.07 -0.11 0.00 0.66 0.00 0.00 57.16 57.96 2ba1 n GLU 199 Cb 0.23 -0.76 -0.05 0.00 0.27 0.00 0.00 31.44 31.12 2ba1 n GLU 199 CO 0.00 0.00 0.00 -1.54 -0.41 0.00 0.00 177.13 175.18 2ba1 s SER 200 N -5.70 0.28 -0.14 4.31 1.04 -1.25 -5.01 113.70 107.24 2ba1 s SER 200 Ca -0.10 -1.19 -0.10 0.00 0.48 0.00 0.00 55.95 55.04 2ba1 s SER 200 Cb 0.04 0.59 -0.05 0.00 0.10 0.00 0.00 66.02 66.70 2ba1 s SER 200 CO 0.13 -1.16 0.19 0.27 0.98 0.00 0.00 173.24 173.64 2ba1 s ILE 201 N -3.67 5.40 -0.23 -1.02 -4.36 -1.26 -1.25 121.20 114.80 2ba1 s ILE 201 Ca 0.27 0.32 0.07 0.00 -0.26 0.00 0.00 60.65 61.05 2ba1 s ILE 201 Cb 0.00 -3.49 -0.19 0.00 1.25 0.00 0.00 42.46 40.04 2ba1 s ILE 201 CO 0.13 0.53 -0.13 0.00 0.24 0.00 0.00 174.94 175.71 2ba1 n ALA 202 N 2.68 1.49 -3.71 2.27 0.00 0.22 -4.87 120.51 118.58 2ba1 n ALA 202 Ca -0.17 -1.13 -0.21 0.00 0.00 0.00 0.00 53.44 51.94 2ba1 n ALA 202 Cb 0.53 -0.10 -0.17 0.00 0.00 0.00 0.00 19.45 19.71 2ba1 n ALA 202 CO 0.00 0.00 0.00 -1.17 0.00 0.00 0.00 177.50 176.33 2ba1 s LEU 203 N -6.12 0.87 -0.05 0.00 0.20 -0.80 -4.38 118.68 108.40 2ba1 s LEU 203 Ca -0.26 -0.07 -0.01 0.00 0.69 0.00 0.00 54.13 54.49 2ba1 s LEU 203 Cb 0.08 -0.37 0.03 0.00 -0.43 0.00 0.00 46.19 45.49 2ba1 s LEU 203 CO 0.64 -0.14 0.01 -0.22 -0.29 0.00 0.00 176.35 176.34 2ba1 s LEU 204 N 1.51 0.75 -0.10 -0.68 0.20 -1.26 -0.51 118.68 118.59 2ba1 s LEU 204 Ca -0.02 -0.05 -0.11 0.00 0.69 0.00 0.00 54.13 54.64 2ba1 s LEU 204 Cb -0.13 -0.33 0.03 0.00 -0.43 0.00 0.00 46.19 45.33 2ba1 s LEU 204 CO -0.03 -0.16 0.31 -1.10 -0.29 0.00 0.00 176.35 175.08 2ba1 s GLN 205 N 1.63 0.41 -0.07 1.98 -0.21 -0.95 -5.04 119.66 117.41 2ba1 s GLN 205 Ca -0.01 0.34 -0.11 0.00 0.02 0.00 0.00 55.36 55.60 2ba1 s GLN 205 Cb -0.13 0.19 0.02 0.00 1.00 0.00 0.00 33.01 34.10 2ba1 s GLN 205 CO -0.03 -0.06 0.27 0.00 -2.12 0.00 0.00 175.29 173.35 2ba1 s MET 206 N -0.06 0.44 -0.03 2.91 0.23 -1.26 -2.06 119.30 119.47 2ba1 s MET 206 Ca -0.02 0.15 -0.01 0.00 -1.03 0.00 0.00 55.69 54.78 2ba1 s MET 206 Cb -0.03 0.20 0.03 0.00 -1.53 0.00 0.00 34.83 33.51 2ba1 s MET 206 CO 0.01 -0.09 0.05 -0.51 -2.03 0.00 0.00 175.02 172.46 2ba1 s ASP 207 N -0.41 0.09 0.00 -1.18 1.11 -0.63 -5.00 116.67 110.65 2ba1 s ASP 207 Ca -0.05 0.09 0.00 0.00 0.18 0.00 0.00 52.55 52.76 2ba1 s ASP 207 Cb -0.03 -0.03 0.00 0.00 1.07 0.00 0.00 42.92 43.93 2ba1 s ASP 207 CO 0.02 -0.14 0.00 0.61 1.18 0.00 0.00 175.17 176.84 2ba1 n GLY 208 N 4.25 0.54 2.71 0.21 0.00 -1.26 -0.80 105.19 110.84 2ba1 n GLY 208 Ca -0.26 -1.44 -0.20 0.00 0.00 0.00 0.00 46.02 44.11 2ba1 n GLY 208 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 2ba1 s ARG 209 N -1.86 -0.01 0.01 1.61 3.52 0.15 -4.97 118.95 117.40 2ba1 s ARG 209 Ca 0.00 0.34 -0.04 0.00 -0.13 0.00 0.00 55.73 55.91 2ba1 s ARG 209 Cb 0.00 -0.71 -0.01 0.00 -1.56 0.00 0.00 34.95 32.67 2ba1 s ARG 209 CO 0.00 -0.40 0.05 -1.64 -0.81 0.00 0.00 175.30 172.50 2ba1 s MET 210 N 2.21 0.41 0.57 5.12 -1.94 -1.26 -4.70 119.30 119.69 2ba1 s MET 210 Ca 0.04 -0.54 -0.07 0.00 -1.71 0.00 0.00 55.69 53.41 2ba1 s MET 210 Cb -0.13 0.16 -0.02 0.00 2.01 0.00 0.00 34.83 36.85 2ba1 s MET 210 CO -0.05 -0.08 0.91 0.95 -0.01 0.00 0.00 175.02 176.73 2ba1 s THR 211 N -1.53 4.42 0.28 2.05 -4.23 -1.26 -4.89 115.64 110.48 2ba1 s THR 211 Ca -0.15 0.35 0.01 0.00 -1.18 0.00 0.00 61.69 60.73 2ba1 s THR 211 Cb -0.08 -3.73 0.26 0.00 1.34 0.00 0.00 72.50 70.29 2ba1 s THR 211 CO -0.00 -0.81 1.77 -0.09 -0.54 0.00 0.00 174.62 174.94 2ba1 h ARG 212 N -0.10 0.66 -0.08 3.99 1.12 -2.01 -1.43 114.38 116.52 2ba1 h ARG 212 Ca -0.46 -0.04 -0.01 0.00 -1.11 0.00 0.00 59.98 58.37 2ba1 h ARG 212 Cb 1.22 -0.15 -0.00 0.00 -0.01 0.00 0.00 29.97 31.03 2ba1 h ARG 212 CO 0.62 0.44 0.03 -0.44 -3.11 0.00 0.00 179.97 177.50 2ba1 h ASP 213 N 0.68 0.12 -0.41 -3.80 3.32 -2.00 -2.98 116.42 111.34 2ba1 h ASP 213 Ca 0.50 -0.20 0.06 0.00 0.02 0.00 0.00 57.03 57.41 2ba1 h ASP 213 Cb 0.73 -0.03 -0.02 0.00 0.22 0.00 0.00 39.33 40.23 2ba1 h ASP 213 CO -0.37 0.29 0.28 -0.33 -1.72 0.00 0.00 179.24 177.39 2ba1 h GLU 214 N -0.05 0.32 -0.23 3.56 5.08 -1.67 -1.03 114.58 120.56 2ba1 h GLU 214 Ca 0.03 -0.02 -0.03 0.00 -1.00 0.00 0.00 59.36 58.34 2ba1 h GLU 214 Cb 0.21 -0.07 -0.01 0.00 0.50 0.00 0.00 28.75 29.38 2ba1 h GLU 214 CO -0.00 0.21 0.04 0.28 -1.00 0.00 0.00 179.01 178.54 2ba1 h VAL 215 N 0.33 1.23 -0.62 3.13 2.07 -1.17 0.56 116.25 121.78 2ba1 h VAL 215 Ca 0.18 -0.76 -0.08 0.00 0.82 0.00 0.00 66.70 66.86 2ba1 h VAL 215 Cb 0.30 1.29 -0.03 0.00 -1.52 0.00 0.00 31.29 31.33 2ba1 h VAL 215 CO -0.04 0.24 0.08 0.11 0.02 0.00 0.00 177.57 177.98 2ba1 h LYS 216 N 0.19 1.02 -0.27 1.57 1.57 -1.25 -1.26 116.57 118.14 2ba1 h LYS 216 Ca 0.07 -0.27 -0.12 0.00 -1.87 0.00 0.00 60.65 58.46 2ba1 h LYS 216 Cb 0.33 -0.12 -0.01 0.00 0.08 0.00 0.00 32.23 32.50 2ba1 h LYS 216 CO 0.00 0.95 -0.35 1.96 -0.57 0.00 0.00 179.45 181.45 2ba1 h GLN 217 N 0.96 0.59 -0.19 3.15 4.20 -1.10 -2.86 115.11 119.86 2ba1 h GLN 217 Ca 0.19 -0.28 -0.09 0.00 0.06 0.00 0.00 58.65 58.53 2ba1 h GLN 217 Cb 0.44 -0.01 -0.01 0.00 0.30 0.00 0.00 27.48 28.20 2ba1 h GLN 217 CO 0.01 0.85 -0.28 0.00 -0.67 0.00 0.00 178.83 178.75 2ba1 h ALA 218 N 1.12 1.18 0.25 3.87 0.00 -0.36 -0.64 119.26 124.68 2ba1 h ALA 218 Ca 0.05 -0.34 -0.01 0.00 0.00 0.00 0.00 54.91 54.61 2ba1 h ALA 218 Cb 0.84 -0.11 0.00 0.00 0.00 0.00 0.00 17.79 18.52 2ba1 h ALA 218 CO 0.07 0.53 -0.13 0.82 0.00 0.00 0.00 179.25 180.54 2ba1 h ILE 219 N 0.32 0.73 -0.19 0.00 1.08 -1.03 -1.52 117.51 116.90 2ba1 h ILE 219 Ca 0.05 0.00 0.05 0.00 -0.39 0.00 0.00 64.86 64.57 2ba1 h ILE 219 Cb 0.66 0.73 -0.06 0.00 -3.07 0.00 0.00 36.82 35.08 2ba1 h ILE 219 CO 0.05 0.00 -0.18 -0.33 -0.69 0.00 0.00 178.15 177.00 2ba1 h GLU 220 N -0.35 -0.19 -0.91 2.37 4.39 -1.28 -0.50 114.58 118.11 2ba1 h GLU 220 Ca -0.03 0.01 0.12 0.00 0.34 0.00 0.00 59.36 59.80 2ba1 h GLU 220 Cb 0.27 0.04 -0.07 0.00 -0.10 0.00 0.00 28.75 28.90 2ba1 h GLU 220 CO 0.05 -0.12 0.59 1.25 -1.16 0.00 0.00 179.01 179.61 2ba1 h LEU 221 N -0.19 0.76 -0.27 1.33 6.46 -0.93 -2.34 115.31 120.13 2ba1 h LEU 221 Ca 0.12 0.04 -0.18 0.00 -0.12 0.00 0.00 57.88 57.73 2ba1 h LEU 221 Cb 0.37 -0.12 0.00 0.00 -0.73 0.00 0.00 40.66 40.18 2ba1 h LEU 221 CO -0.31 0.41 -0.55 0.00 -0.62 0.00 0.00 178.44 177.37 2ba1 h ALA 222 N 1.57 0.43 -0.41 1.25 0.00 -0.12 -2.99 119.26 119.00 2ba1 h ALA 222 Ca 0.44 -0.52 -0.02 0.00 0.00 0.00 0.00 54.91 54.82 2ba1 h ALA 222 Cb 0.56 -0.07 -0.02 0.00 0.00 0.00 0.00 17.79 18.26 2ba1 h ALA 222 CO -0.21 0.65 0.16 0.87 0.00 0.00 0.00 179.25 180.72 2ba1 h LYS 223 N 0.63 0.58 -0.56 0.00 1.57 -0.62 0.10 116.57 118.26 2ba1 h LYS 223 Ca 0.01 -0.08 -0.03 0.00 -1.87 0.00 0.00 60.65 58.68 2ba1 h LYS 223 Cb 1.16 -0.11 -0.03 0.00 0.08 0.00 0.00 32.23 33.34 2ba1 h LYS 223 CO 0.12 0.48 0.24 -0.22 -0.57 0.00 0.00 179.45 179.50 2ba1 h LYS 224 N 0.58 0.83 -0.20 3.15 3.64 -1.42 -2.13 116.57 121.02 2ba1 h LYS 224 Ca 0.14 -0.14 -0.14 0.00 -1.27 0.00 0.00 60.65 59.24 2ba1 h LYS 224 Cb 0.12 -0.14 -0.01 0.00 -0.41 0.00 0.00 32.23 31.79 2ba1 h LYS 224 CO -0.01 0.71 -0.45 0.78 -2.27 0.00 0.00 179.45 178.21 2ba1 h GLY 225 N 0.77 0.53 0.84 5.01 0.00 -1.18 -2.84 103.07 106.19 2ba1 h GLY 225 Ca 0.19 -0.55 -0.00 0.00 0.00 0.00 0.00 47.33 46.97 2ba1 h GLY 225 CO -0.02 0.50 -0.00 0.00 0.00 0.00 0.00 176.54 177.02 2ba1 h ALA 226 N 1.12 -0.01 -0.94 3.60 0.00 -0.52 0.16 119.26 122.67 2ba1 h ALA 226 Ca 0.03 -0.08 0.09 0.00 0.00 0.00 0.00 54.91 54.95 2ba1 h ALA 226 Cb 0.94 0.00 -0.07 0.00 0.00 0.00 0.00 17.79 18.67 2ba1 h ALA 226 CO 0.08 -0.42 0.60 -0.07 0.00 0.00 0.00 179.25 179.44 2ba1 h LEU 227 N -0.17 0.88 -0.42 0.00 3.38 -1.42 1.05 115.31 118.60 2ba1 h LEU 227 Ca -0.00 0.02 -0.04 0.00 0.09 0.00 0.00 57.88 57.96 2ba1 h LEU 227 Cb 0.17 -0.16 -0.02 0.00 0.09 0.00 0.00 40.66 40.74 2ba1 h LEU 227 CO 0.00 0.52 0.12 1.56 0.09 0.00 0.00 178.44 180.73 2ba1 h GLN 228 N 0.97 0.67 -0.24 1.13 4.20 -1.18 -2.16 115.11 118.50 2ba1 h GLN 228 Ca 0.43 -0.15 -0.08 0.00 0.06 0.00 0.00 58.65 58.92 2ba1 h GLN 228 Cb 0.37 -0.09 -0.01 0.00 0.30 0.00 0.00 27.48 28.05 2ba1 h GLN 228 CO -0.19 0.67 -0.14 0.82 -0.67 0.00 0.00 178.83 179.31 2ba1 h ILE 229 N 0.55 1.31 -0.94 2.54 2.04 0.57 -2.92 117.51 120.65 2ba1 h ILE 229 Ca 0.14 -1.25 0.15 0.00 1.00 0.00 0.00 64.86 64.90 2ba1 h ILE 229 Cb 0.29 1.59 -0.08 0.00 -0.74 0.00 0.00 36.82 37.88 2ba1 h ILE 229 CO -0.00 0.39 0.60 0.22 0.00 0.00 0.00 178.15 179.35 2ba1 h TYR 230 N 0.24 0.92 -0.66 1.37 3.20 0.12 0.12 116.97 122.28 2ba1 h TYR 230 Ca 0.05 0.03 -0.01 0.00 3.14 0.00 0.00 58.73 61.94 2ba1 h TYR 230 Cb 0.66 -0.29 -0.03 0.00 1.54 0.00 0.00 36.73 38.61 2ba1 h TYR 230 CO 0.07 0.31 0.37 0.93 -1.64 0.00 0.00 178.16 178.20 2ba1 h GLU 231 N 0.75 0.92 -0.05 1.82 4.39 -1.20 0.48 114.58 121.69 2ba1 h GLU 231 Ca 0.49 -0.10 -0.04 0.00 0.34 0.00 0.00 59.36 60.04 2ba1 h GLU 231 Cb 0.75 -0.18 -0.01 0.00 -0.10 0.00 0.00 28.75 29.21 2ba1 h GLU 231 CO -0.25 0.69 -0.16 0.52 -1.16 0.00 0.00 179.01 178.64 2ba1 h MET 232 N 0.91 0.07 -0.34 2.33 2.86 -0.74 -1.65 114.93 118.36 2ba1 h MET 232 Ca 0.23 -0.01 -0.16 0.00 -2.06 0.00 0.00 59.70 57.70 2ba1 h MET 232 Cb 0.03 -0.01 -0.01 0.00 0.06 0.00 0.00 31.60 31.67 2ba1 h MET 232 CO -0.04 0.23 -0.43 1.96 1.06 0.00 0.00 176.91 179.70 2ba1 h GLN 233 N 0.07 0.88 -0.30 1.72 4.20 0.76 -2.17 115.11 120.27 2ba1 h GLN 233 Ca 0.01 -0.48 -0.16 0.00 0.06 0.00 0.00 58.65 58.08 2ba1 h GLN 233 Cb 0.33 0.03 -0.01 0.00 0.30 0.00 0.00 27.48 28.13 2ba1 h GLN 233 CO 0.02 1.13 -0.45 -0.09 -0.67 0.00 0.00 178.83 178.77 2ba1 h ARG 234 N 0.71 0.77 0.11 1.46 2.43 -0.60 -2.84 114.38 116.42 2ba1 h ARG 234 Ca 0.05 -0.43 0.01 0.00 -0.81 0.00 0.00 59.98 58.80 2ba1 h ARG 234 Cb 1.02 0.03 -0.02 0.00 -0.42 0.00 0.00 29.97 30.57 2ba1 h ARG 234 CO 0.10 1.06 -0.17 1.49 -1.51 0.00 0.00 179.97 180.94 2ba1 h GLU 235 N 0.61 -0.32 -0.51 0.20 4.57 -1.24 0.62 114.58 118.50 2ba1 h GLU 235 Ca 0.04 0.02 0.03 0.00 -1.18 0.00 0.00 59.36 58.27 2ba1 h GLU 235 Cb 1.02 0.07 -0.03 0.00 -0.16 0.00 0.00 28.75 29.65 2ba1 h GLU 235 CO 0.10 -0.22 0.34 0.00 -1.18 0.00 0.00 179.01 178.05 2ba1 h ALA 236 N 0.50 1.77 0.00 2.92 0.00 -1.36 -0.31 119.26 122.77 2ba1 h ALA 236 Ca 0.02 -0.02 -0.11 0.00 0.00 0.00 0.00 54.91 54.80 2ba1 h ALA 236 Cb 0.35 -0.16 -0.02 0.00 0.00 0.00 0.00 17.79 17.97 2ba1 h ALA 236 CO -0.08 0.17 -0.53 0.82 0.00 0.00 0.00 179.25 179.63 2ba1 h ILE 237 N 0.57 0.84 -0.17 0.00 1.08 -1.21 -3.00 117.51 115.62 2ba1 h ILE 237 Ca 0.21 -2.19 -0.03 0.00 -0.39 0.00 0.00 64.86 62.46 2ba1 h ILE 237 Cb 0.12 2.40 -0.01 0.00 -3.07 0.00 0.00 36.82 36.27 2ba1 h ILE 237 CO -0.05 0.48 -0.00 0.25 -0.69 0.00 0.00 178.15 178.13 2ba1 h LEU 238 N 0.00 0.29 -1.24 1.44 6.46 0.80 0.12 115.31 123.18 2ba1 h LEU 238 Ca -0.01 -0.31 0.07 0.00 -0.12 0.00 0.00 57.88 57.50 2ba1 h LEU 238 Cb 1.39 -0.08 -0.05 0.00 -0.73 0.00 0.00 40.66 41.18 2ba1 h LEU 238 CO 0.06 0.53 0.54 0.03 -0.62 0.00 0.00 178.44 178.99 2ba1 h ARG 239 N 0.04 0.89 -0.31 1.25 3.08 -1.34 -0.88 114.38 117.11 2ba1 h ARG 239 Ca 0.05 -0.05 -0.03 0.00 0.07 0.00 0.00 59.98 60.01 2ba1 h ARG 239 Cb 0.39 -0.20 -0.01 0.00 0.08 0.00 0.00 29.97 30.22 2ba1 h ARG 239 CO 0.01 0.59 0.08 -0.09 -1.07 0.00 0.00 179.97 179.48 2ba1 h ARG 240 N 0.91 0.49 -0.99 0.04 9.65 -1.28 -1.11 114.38 122.09 2ba1 h ARG 240 Ca 0.36 -0.12 0.13 0.00 -1.10 0.00 0.00 59.98 59.25 2ba1 h ARG 240 Cb 0.23 -0.06 -0.09 0.00 -1.39 0.00 0.00 29.97 28.66 2ba1 h ARG 240 CO -0.13 0.56 0.62 -0.92 2.80 0.00 0.00 179.97 182.91 2ba1 h TYR 241 N 0.34 1.10 -0.26 2.20 3.20 0.50 -0.81 116.97 123.24 2ba1 h TYR 241 Ca 0.10 0.03 -0.07 0.00 3.14 0.00 0.00 58.73 61.93 2ba1 h TYR 241 Cb 0.29 -0.35 -0.01 0.00 1.54 0.00 0.00 36.73 38.21 2ba1 h TYR 241 CO 0.01 0.41 -0.12 0.82 -1.64 0.00 0.00 178.16 177.65 2ba1 h ILE 242 N 0.93 1.30 -0.23 1.81 1.08 -0.77 -1.98 117.51 119.65 2ba1 h ILE 242 Ca 0.50 -1.19 0.01 0.00 -0.39 0.00 0.00 64.86 63.79 2ba1 h ILE 242 Cb 0.56 1.53 -0.01 0.00 -3.07 0.00 0.00 36.82 35.83 2ba1 h ILE 242 CO -0.27 0.37 0.14 -0.33 -0.69 0.00 0.00 178.15 177.37 2ba1 h GLU 243 N 0.27 0.28 0.00 2.37 5.08 -0.05 0.44 114.58 122.97 2ba1 h GLU 243 Ca 0.06 -0.02 0.00 0.00 -1.00 0.00 0.00 59.36 58.40 2ba1 h GLU 243 Cb 0.62 -0.06 0.00 0.00 0.50 0.00 0.00 28.75 29.81 2ba1 h GLU 243 CO 0.04 0.18 0.00 -0.39 -1.00 0.00 0.00 179.01 177.84 2ba1 h VAL 244 N 0.29 0.00 0.00 3.13 -1.51 -1.23 -1.61 116.25 115.31 2ba1 h VAL 244 Ca 0.09 -0.52 0.00 0.00 -1.23 0.00 0.00 66.70 65.04 2ba1 h VAL 244 Cb -0.01 1.44 0.00 0.00 -2.13 0.00 0.00 31.29 30.59 2ba1 h VAL 244 CO -0.04 0.00 -0.01 1.23 -1.23 0.00 0.00 177.57 177.52 2ba1 h GLY 245 N 2.85 0.00 0.83 5.19 0.00 -0.52 -3.14 103.07 108.28 2ba1 h GLY 245 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 2ba1 h GLY 245 CO 0.00 0.00 0.00 -1.84 0.00 0.00 0.00 176.54 174.70 2ba1 n GLU 246 N -3.50 0.23 -0.03 4.80 0.28 0.15 -0.80 120.64 121.77 2ba1 n GLU 246 Ca -0.00 0.00 -0.13 0.00 -0.16 0.00 0.00 57.16 56.87 2ba1 n GLU 246 Cb 0.01 -1.42 -0.14 0.00 1.43 0.00 0.00 31.44 31.32 2ba1 n GLU 246 CO 0.00 0.00 0.00 -1.91 -0.16 0.00 0.00 177.13 175.06 2ba1 n GLU 247 N -0.92 0.68 -0.05 3.44 2.13 -0.61 -3.38 120.64 121.93 2ba1 n GLU 247 Ca 0.05 0.24 -0.14 0.00 0.66 0.00 0.00 57.16 57.97 2ba1 n GLU 247 Cb 0.02 -1.72 -0.08 0.00 0.27 0.00 0.00 31.44 29.94 2ba1 n GLU 247 CO 0.00 0.00 0.00 0.52 -0.41 0.00 0.00 177.13 177.24 2ba1 h MET 248 N 0.02 0.36 0.00 5.31 2.86 -0.91 -2.03 114.93 120.55 2ba1 h MET 248 Ca -0.38 -0.22 0.00 0.00 -2.06 0.00 0.00 59.70 57.05 2ba1 h MET 248 Cb 2.04 0.02 0.00 0.00 0.06 0.00 0.00 31.60 33.72 2ba1 h MET 248 CO 0.07 0.80 0.00 -3.47 1.06 0.00 0.00 176.91 175.36 2ba1 n ASP 249 N -4.51 0.00 -0.00 1.22 2.03 -1.13 -2.41 116.55 111.75 2ba1 n ASP 249 Ca -0.07 -0.17 -0.17 0.00 0.52 0.00 0.00 54.79 54.90 2ba1 n ASP 249 Cb 0.40 -0.12 -0.13 0.00 -0.72 0.00 0.00 41.12 40.55 2ba1 n ASP 249 CO 0.00 0.00 0.00 -0.08 -1.92 0.00 0.00 177.20 175.20 2ba1 h GLU 250 N 0.00 0.19 -0.13 -0.67 4.57 -1.37 -1.40 114.58 115.76 2ba1 h GLU 250 Ca 0.00 -0.29 -0.12 0.00 -1.18 0.00 0.00 59.36 57.76 2ba1 h GLU 250 Cb 0.05 0.11 -0.01 0.00 -0.16 0.00 0.00 28.75 28.73 2ba1 h GLU 250 CO 0.00 1.11 -0.46 0.82 -1.18 0.00 0.00 179.01 179.30 2ba1 h ILE 251 N -0.58 1.33 0.00 2.32 1.08 -1.46 -2.47 117.51 117.72 2ba1 h ILE 251 Ca -0.08 -1.66 -0.06 0.00 -0.39 0.00 0.00 64.86 62.68 2ba1 h ILE 251 Cb 1.32 1.74 -0.01 0.00 -3.07 0.00 0.00 36.82 36.80 2ba1 h ILE 251 CO 0.09 0.50 -0.29 0.74 -0.69 0.00 0.00 178.15 178.49 2ba1 h THR 252 N 0.26 0.66 -0.01 -0.27 2.02 -1.61 -3.53 112.91 110.44 2ba1 h THR 252 Ca 0.02 -1.37 0.00 0.00 0.77 0.00 0.00 66.41 65.83 2ba1 h THR 252 Cb 0.92 1.90 0.00 0.00 -1.74 0.00 0.00 68.15 69.23 2ba1 h THR 252 CO 0.08 0.29 0.00 1.21 0.37 0.00 0.00 175.52 177.46