#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2ba0 h LEU 11 N 0.00 -1.18 -8.95 3.14 3.38 -1.98 -3.40 115.31 106.32 2ba0 h LEU 11 Ca 0.00 0.18 -0.63 0.00 0.09 0.00 0.00 57.88 57.51 2ba0 h LEU 11 Cb 0.00 0.51 -0.17 0.00 0.09 0.00 0.00 40.66 41.09 2ba0 h LEU 11 CO 0.00 -0.37 -0.53 -0.63 0.09 0.00 0.00 178.44 176.99 2ba0 s ILE 12 N -5.94 5.14 -0.22 1.22 -1.09 -1.26 -3.00 121.20 116.04 2ba0 s ILE 12 Ca -0.15 0.11 -0.01 0.00 -2.23 0.00 0.00 60.65 58.37 2ba0 s ILE 12 Cb 0.11 -3.41 0.06 0.00 -1.58 0.00 0.00 42.46 37.64 2ba0 s ILE 12 CO 0.66 0.32 -0.00 0.68 -1.23 0.00 0.00 174.94 175.36 2ba0 s VAL 13 N 1.34 1.03 -1.10 2.92 -7.23 0.91 -4.82 120.40 113.45 2ba0 s VAL 13 Ca 0.07 -0.93 -0.01 0.00 -1.81 0.00 0.00 61.98 59.29 2ba0 s VAL 13 Cb -0.15 -1.44 0.00 0.00 0.56 0.00 0.00 36.38 35.36 2ba0 s VAL 13 CO 0.06 -0.18 0.92 0.47 -0.31 0.00 0.00 175.10 176.06 2ba0 n ASP 14 N 4.85 -2.75 0.00 4.85 8.00 -1.26 -2.45 116.55 127.79 2ba0 n ASP 14 Ca -0.10 -0.54 0.00 0.00 0.71 0.00 0.00 54.79 54.86 2ba0 n ASP 14 Cb 0.45 -4.62 0.00 0.00 -0.02 0.00 0.00 41.12 36.94 2ba0 n ASP 14 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2ba0 n GLY 15 N -1.25 0.31 3.33 0.44 0.00 -1.26 -5.01 105.19 101.75 2ba0 n GLY 15 Ca -0.21 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.54 2ba0 n GLY 15 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2ba0 s LEU 16 N 0.00 2.28 0.26 0.99 1.43 -1.03 -4.53 118.68 118.09 2ba0 s LEU 16 Ca 0.00 -0.68 0.03 0.00 -1.03 0.00 0.00 54.13 52.45 2ba0 s LEU 16 Cb 0.00 -1.05 -0.03 0.00 0.03 0.00 0.00 46.19 45.13 2ba0 s LEU 16 CO 0.00 0.13 0.41 -0.13 0.23 0.00 0.00 176.35 176.99 2ba0 s ARG 17 N -1.82 3.46 0.10 1.70 0.52 -0.75 -0.06 118.95 122.10 2ba0 s ARG 17 Ca 0.10 -0.62 -0.19 0.00 -0.52 0.00 0.00 55.73 54.50 2ba0 s ARG 17 Cb -0.10 -2.83 -0.04 0.00 0.52 0.00 0.00 34.95 32.50 2ba0 s ARG 17 CO 0.04 0.36 1.28 1.28 0.02 0.00 0.00 175.30 178.28 2ba0 n LEU 18 N -1.42 -0.65 0.27 2.53 4.32 -1.16 0.16 117.00 121.05 2ba0 n LEU 18 Ca -0.08 1.43 0.12 0.00 -0.02 0.00 0.00 56.01 57.46 2ba0 n LEU 18 Cb 0.56 -0.31 0.66 0.00 -1.62 0.00 0.00 43.42 42.71 2ba0 n LEU 18 CO 0.46 -1.06 1.00 -2.24 -1.22 0.00 0.00 177.39 174.34 2ba0 h ASP 19 N 0.00 0.00 0.00 -1.43 2.03 -1.95 -3.44 116.42 111.63 2ba0 h ASP 19 Ca 0.10 0.00 0.00 0.00 -0.73 0.00 0.00 57.03 56.40 2ba0 h ASP 19 Cb 0.25 0.00 0.00 0.00 -0.83 0.00 0.00 39.33 38.75 2ba0 h ASP 19 CO -0.57 0.00 0.00 0.61 -1.03 0.00 0.00 179.24 178.25 2ba0 n GLY 20 N -1.24 0.61 3.97 7.15 0.00 0.43 -5.11 105.19 111.00 2ba0 n GLY 20 Ca -0.02 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 45.79 2ba0 n GLY 20 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 2ba0 s ARG 21 N -0.64 2.45 0.56 1.61 1.70 -1.25 -4.58 118.95 118.80 2ba0 s ARG 21 Ca 0.00 -0.71 -0.10 0.00 -0.47 0.00 0.00 55.73 54.45 2ba0 s ARG 21 Cb 0.00 -2.43 -0.04 0.00 -0.57 0.00 0.00 34.95 31.91 2ba0 s ARG 21 CO 0.00 -0.83 0.94 0.15 -1.08 0.00 0.00 175.30 174.48 2ba0 s LYS 22 N -4.86 3.62 0.44 3.89 1.02 -1.26 -1.81 119.74 120.79 2ba0 s LYS 22 Ca 0.58 0.59 0.23 0.00 0.02 0.00 0.00 55.97 57.39 2ba0 s LYS 22 Cb -0.10 -2.19 1.22 0.00 -0.52 0.00 0.00 37.83 36.24 2ba0 s LYS 22 CO 0.40 -0.41 1.81 0.27 -0.92 0.00 0.00 175.35 176.50 2ba0 h PHE 23 N 0.04 0.45 -0.86 3.18 -0.00 -1.89 -2.18 116.94 115.68 2ba0 h PHE 23 Ca -0.45 0.01 -0.52 0.00 -0.00 0.00 0.00 57.97 57.01 2ba0 h PHE 23 Cb 1.19 -0.13 -0.28 0.00 -0.00 0.00 0.00 35.95 36.73 2ba0 h PHE 23 CO 0.63 0.06 0.45 -0.40 -0.00 0.00 0.00 178.31 179.06 2ba0 n ASP 24 N -4.49 5.10 -4.29 -0.68 5.75 -1.26 -0.61 116.55 116.07 2ba0 n ASP 24 Ca 0.23 -3.73 -0.31 0.00 -0.01 0.00 0.00 54.79 50.97 2ba0 n ASP 24 Cb 0.91 -0.80 -0.16 0.00 -1.03 0.00 0.00 41.12 40.03 2ba0 n ASP 24 CO 0.00 0.00 0.00 -1.61 -0.11 0.00 0.00 177.20 175.48 2ba0 s GLU 25 N -3.52 2.50 0.50 0.11 2.02 -0.82 -4.95 118.70 114.54 2ba0 s GLU 25 Ca 0.57 -0.90 -0.11 0.00 0.02 0.00 0.00 54.97 54.56 2ba0 s GLU 25 Cb 0.47 -2.16 -0.06 0.00 0.10 0.00 0.00 34.13 32.48 2ba0 s GLU 25 CO 0.04 0.42 0.89 -0.51 0.02 0.00 0.00 175.26 176.12 2ba0 s LEU 26 N -0.25 3.58 0.84 1.80 1.43 -1.26 -4.69 118.68 120.13 2ba0 s LEU 26 Ca -0.01 1.27 -0.12 0.00 -1.03 0.00 0.00 54.13 54.24 2ba0 s LEU 26 Cb -0.13 -4.22 0.09 0.00 0.03 0.00 0.00 46.19 41.96 2ba0 s LEU 26 CO 0.03 -0.61 1.16 -0.13 0.23 0.00 0.00 176.35 177.03 2ba0 s ARG 27 N -4.44 1.75 0.17 1.70 0.52 -1.26 -4.96 118.95 112.43 2ba0 s ARG 27 Ca 0.53 0.22 -0.32 0.00 -0.52 0.00 0.00 55.73 55.65 2ba0 s ARG 27 Cb -0.10 -1.92 -0.10 0.00 0.52 0.00 0.00 34.95 33.35 2ba0 s ARG 27 CO 0.40 -1.77 1.57 -1.25 0.02 0.00 0.00 175.30 174.28 2ba0 s PRO 28 N -5.44 4.21 0.01 3.54 0.04 -1.26 -4.76 135.00 131.34 2ba0 s PRO 28 Ca 0.62 2.38 0.07 0.00 0.04 0.00 0.00 61.00 64.11 2ba0 s PRO 28 Cb -0.12 -3.15 -0.03 0.00 0.04 0.00 0.00 34.50 31.24 2ba0 s PRO 28 CO 0.51 -0.61 -0.20 0.42 0.04 0.00 0.00 177.00 177.16 2ba0 s ILE 29 N 1.08 2.60 -0.02 0.56 1.01 -1.26 -1.87 121.20 123.29 2ba0 s ILE 29 Ca 0.70 -1.12 0.01 0.00 0.00 0.00 0.00 60.65 60.23 2ba0 s ILE 29 Cb -0.44 -2.03 0.02 0.00 0.01 0.00 0.00 42.46 40.02 2ba0 s ILE 29 CO 0.32 0.43 -0.01 -0.75 0.00 0.00 0.00 174.94 174.93 2ba0 s LYS 30 N -1.13 0.31 -0.01 2.79 2.20 -0.17 -4.99 119.74 118.74 2ba0 s LYS 30 Ca 0.13 0.03 0.03 0.00 -0.36 0.00 0.00 55.97 55.79 2ba0 s LYS 30 Cb -0.10 -0.44 -0.01 0.00 -1.51 0.00 0.00 37.83 35.77 2ba0 s LYS 30 CO 0.03 -0.09 -0.09 0.42 -0.36 0.00 0.00 175.35 175.26 2ba0 s ILE 31 N 0.78 0.69 -0.07 5.43 1.01 -1.26 -0.51 121.20 127.27 2ba0 s ILE 31 Ca -0.08 -0.37 -0.03 0.00 0.00 0.00 0.00 60.65 60.18 2ba0 s ILE 31 Cb -0.11 -0.58 0.04 0.00 0.01 0.00 0.00 42.46 41.82 2ba0 s ILE 31 CO -0.01 0.20 0.13 -1.61 0.00 0.00 0.00 174.94 173.64 2ba0 s GLU 32 N -0.15 0.02 0.23 2.79 2.02 -0.22 -4.84 118.70 118.55 2ba0 s GLU 32 Ca 0.03 0.45 -0.01 0.00 0.02 0.00 0.00 54.97 55.46 2ba0 s GLU 32 Cb -0.04 -0.29 -0.04 0.00 0.10 0.00 0.00 34.13 33.86 2ba0 s GLU 32 CO -0.00 -0.26 0.43 0.00 0.02 0.00 0.00 175.26 175.44 2ba0 s ALA 33 N 1.87 3.80 -0.98 5.21 0.00 -1.26 -0.58 121.76 129.81 2ba0 s ALA 33 Ca -0.01 -0.84 -0.08 0.00 0.00 0.00 0.00 51.96 51.03 2ba0 s ALA 33 Cb -0.12 -2.03 -0.03 0.00 0.00 0.00 0.00 23.12 20.95 2ba0 s ALA 33 CO -0.05 0.34 0.80 0.43 0.00 0.00 0.00 175.76 177.28 2ba0 n SER 34 N -0.90 -6.43 -0.00 0.00 7.64 -0.65 -4.94 113.62 108.34 2ba0 n SER 34 Ca -0.05 -0.66 0.06 0.00 1.01 0.00 0.00 58.87 59.24 2ba0 n SER 34 Cb 0.54 -4.42 -0.08 0.00 -1.01 0.00 0.00 64.21 59.24 2ba0 n SER 34 CO 0.00 0.00 0.00 1.33 -3.01 0.00 0.00 175.04 173.36 2ba0 n VAL 35 N -3.09 0.00 -4.66 0.44 0.24 -1.26 -4.96 118.33 105.04 2ba0 n VAL 35 Ca -0.08 -0.20 -0.33 0.00 -2.04 0.00 0.00 64.34 61.69 2ba0 n VAL 35 Cb 0.59 0.93 -0.13 0.00 -1.47 0.00 0.00 33.84 33.76 2ba0 n VAL 35 CO 0.00 0.00 0.00 -0.76 -2.14 0.00 0.00 176.83 173.93 2ba0 s LEU 36 N -2.73 2.95 0.07 1.34 1.43 -1.26 -5.03 118.68 115.45 2ba0 s LEU 36 Ca 0.04 -0.19 -0.07 0.00 -1.03 0.00 0.00 54.13 52.87 2ba0 s LEU 36 Cb 0.10 -1.66 -0.30 0.00 0.03 0.00 0.00 46.19 44.35 2ba0 s LEU 36 CO 0.53 0.23 1.11 0.50 0.23 0.00 0.00 176.35 178.96 2ba0 h LYS 37 N 6.21 0.35 -0.01 1.70 3.64 -2.00 -3.34 116.57 123.12 2ba0 h LYS 37 Ca -0.35 -0.58 0.00 0.00 -1.27 0.00 0.00 60.65 58.45 2ba0 h LYS 37 Cb 1.19 0.22 0.00 0.00 -0.41 0.00 0.00 32.23 33.23 2ba0 h LYS 37 CO 0.56 1.28 -0.08 0.54 -2.27 0.00 0.00 179.45 179.47 2ba0 n ARG 38 N -3.59 1.28 -3.86 1.90 3.00 -1.26 -4.88 116.66 109.25 2ba0 n ARG 38 Ca -0.10 -0.68 -0.32 0.00 -0.01 0.00 0.00 57.85 56.73 2ba0 n ARG 38 Cb 1.04 -1.49 -0.04 0.00 0.00 0.00 0.00 32.46 31.97 2ba0 n ARG 38 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.63 177.63 2ba0 s ALA 39 N -2.19 3.95 0.38 7.54 0.00 -1.26 -5.00 121.76 125.17 2ba0 s ALA 39 Ca 0.34 -0.75 0.09 0.00 0.00 0.00 0.00 51.96 51.64 2ba0 s ALA 39 Cb 0.20 -1.91 0.76 0.00 0.00 0.00 0.00 23.12 22.17 2ba0 s ALA 39 CO 0.40 0.76 1.90 -0.44 0.00 0.00 0.00 175.76 178.38 2ba0 h ASP 40 N 3.35 0.22 -4.98 0.00 3.32 -1.39 -3.45 116.42 113.49 2ba0 h ASP 40 Ca -0.47 -0.05 -0.11 0.00 0.02 0.00 0.00 57.03 56.42 2ba0 h ASP 40 Cb 1.17 -0.06 -0.20 0.00 0.22 0.00 0.00 39.33 40.46 2ba0 h ASP 40 CO 0.72 0.40 -0.25 -0.83 -1.72 0.00 0.00 179.24 177.57 2ba0 s GLY 41 N -4.07 -0.18 0.22 2.75 0.00 -1.00 -4.04 107.32 100.99 2ba0 s GLY 41 Ca -0.05 0.39 -0.20 0.00 0.00 0.00 0.00 44.72 44.86 2ba0 s GLY 41 CO 0.73 0.17 0.61 -1.35 0.00 0.00 0.00 173.10 173.27 2ba0 s SER 42 N -1.31 -0.34 -0.28 1.64 1.04 -1.25 -0.71 113.70 112.47 2ba0 s SER 42 Ca -0.13 -0.40 -0.19 0.00 0.48 0.00 0.00 55.95 55.71 2ba0 s SER 42 Cb -0.05 0.64 0.12 0.00 0.10 0.00 0.00 66.02 66.83 2ba0 s SER 42 CO 0.05 -1.13 0.90 0.00 0.98 0.00 0.00 173.24 174.04 2ba0 s TYR 44 N 1.07 3.42 -0.09 0.00 5.04 0.25 -1.23 117.35 125.81 2ba0 s TYR 44 Ca -0.06 0.38 -0.06 0.00 -2.44 0.00 0.00 57.07 54.89 2ba0 s TYR 44 Cb -0.04 -1.91 0.03 0.00 0.35 0.00 0.00 41.96 40.39 2ba0 s TYR 44 CO -0.13 0.59 0.22 -1.17 -1.34 0.00 0.00 175.55 173.72 2ba0 s LEU 45 N -0.83 0.86 -0.14 6.97 1.98 -0.35 -1.05 118.68 126.11 2ba0 s LEU 45 Ca 0.13 0.44 0.02 0.00 -2.89 0.00 0.00 54.13 51.84 2ba0 s LEU 45 Cb -0.12 0.68 0.01 0.00 0.66 0.00 0.00 46.19 47.43 2ba0 s LEU 45 CO 0.03 -0.12 -0.20 -1.61 -1.89 0.00 0.00 176.35 172.56 2ba0 s GLU 46 N 0.65 2.89 -0.45 1.98 2.02 0.33 -1.09 118.70 125.02 2ba0 s GLU 46 Ca -0.04 -0.80 0.02 0.00 0.02 0.00 0.00 54.97 54.17 2ba0 s GLU 46 Cb -0.06 -2.38 0.14 0.00 0.10 0.00 0.00 34.13 31.93 2ba0 s GLU 46 CO -0.04 -0.07 0.26 1.41 0.02 0.00 0.00 175.26 176.85 2ba0 s MET 47 N 0.96 1.30 5.43 1.61 1.75 -0.85 -1.00 119.30 128.49 2ba0 s MET 47 Ca -0.04 -2.06 0.00 0.00 -1.25 0.00 0.00 55.69 52.34 2ba0 s MET 47 Cb -0.15 -2.29 0.00 0.00 2.84 0.00 0.00 34.83 35.24 2ba0 s MET 47 CO -0.04 -1.19 0.00 0.41 -0.65 0.00 0.00 175.02 173.55 2ba0 n GLY 48 N 3.42 0.52 0.02 2.11 0.00 -0.78 -2.55 105.19 107.93 2ba0 n GLY 48 Ca 0.11 -0.74 0.14 0.00 0.00 0.00 0.00 46.02 45.53 2ba0 n GLY 48 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2ba0 n LYS 49 N 12.14 1.03 -2.57 1.61 4.01 -1.26 -4.83 118.16 128.30 2ba0 n LYS 49 Ca 0.00 -0.05 -0.41 0.00 -0.51 0.00 0.00 58.31 57.34 2ba0 n LYS 49 Cb 0.00 -1.45 -0.04 0.00 -0.51 0.00 0.00 35.03 33.04 2ba0 n LYS 49 CO 0.00 0.00 0.00 -0.80 -1.11 0.00 0.00 177.40 175.49 2ba0 s ASN 50 N -1.89 7.30 -0.18 4.39 0.02 -1.06 -4.47 114.94 119.05 2ba0 s ASN 50 Ca 0.43 1.95 -0.01 0.00 -1.02 0.00 0.00 52.86 54.21 2ba0 s ASN 50 Cb 0.20 -2.59 0.05 0.00 0.02 0.00 0.00 41.25 38.93 2ba0 s ASN 50 CO 0.33 -0.24 -0.01 -0.54 0.02 0.00 0.00 177.10 176.66 2ba0 s LYS 51 N 0.16 1.04 0.13 -0.60 1.02 -0.33 -2.00 119.74 119.16 2ba0 s LYS 51 Ca 0.51 -0.50 0.06 0.00 0.02 0.00 0.00 55.97 56.06 2ba0 s LYS 51 Cb -0.27 -2.06 -0.04 0.00 -0.52 0.00 0.00 37.83 34.94 2ba0 s LYS 51 CO 0.32 -0.54 -0.13 0.14 -0.92 0.00 0.00 175.35 174.21 2ba0 s VAL 52 N 1.72 1.29 -0.03 3.17 -7.23 -0.25 0.12 120.40 119.19 2ba0 s VAL 52 Ca -0.01 -1.78 -0.01 0.00 -1.81 0.00 0.00 61.98 58.37 2ba0 s VAL 52 Cb -0.16 -1.58 0.03 0.00 0.56 0.00 0.00 36.38 35.22 2ba0 s VAL 52 CO -0.07 -0.49 0.04 -0.51 -0.31 0.00 0.00 175.10 173.76 2ba0 s ILE 53 N -2.38 -0.04 -0.04 -0.62 2.07 -0.02 -1.21 121.20 118.95 2ba0 s ILE 53 Ca 0.10 0.28 0.04 0.00 -1.41 0.00 0.00 60.65 59.66 2ba0 s ILE 53 Cb -0.03 -0.14 -0.03 0.00 0.13 0.00 0.00 42.46 42.39 2ba0 s ILE 53 CO 0.03 0.13 -0.13 0.00 -1.91 0.00 0.00 174.94 173.06 2ba0 s ALA 54 N 1.50 2.71 0.10 1.50 0.00 -0.37 -1.25 121.76 125.96 2ba0 s ALA 54 Ca -0.04 -0.99 0.05 0.00 0.00 0.00 0.00 51.96 50.99 2ba0 s ALA 54 Cb -0.13 -0.99 -0.03 0.00 0.00 0.00 0.00 23.12 21.97 2ba0 s ALA 54 CO -0.03 0.56 -0.13 0.00 0.00 0.00 0.00 175.76 176.16 2ba0 s ALA 55 N -0.77 1.28 -0.01 0.00 0.00 0.71 -1.44 121.76 121.53 2ba0 s ALA 55 Ca 0.12 -1.16 0.02 0.00 0.00 0.00 0.00 51.96 50.94 2ba0 s ALA 55 Cb -0.11 -0.06 -0.00 0.00 0.00 0.00 0.00 23.12 22.95 2ba0 s ALA 55 CO 0.01 0.09 -0.06 0.08 0.00 0.00 0.00 175.76 175.89 2ba0 s VAL 56 N -1.89 0.46 -0.60 0.00 1.01 0.11 -1.23 120.40 118.26 2ba0 s VAL 56 Ca 0.04 -0.24 0.02 0.00 0.00 0.00 0.00 61.98 61.80 2ba0 s VAL 56 Cb -0.06 -0.40 0.15 0.00 0.00 0.00 0.00 36.38 36.07 2ba0 s VAL 56 CO 0.02 0.14 0.37 -0.36 0.00 0.00 0.00 175.10 175.27 2ba0 s PHE 57 N -0.07 3.33 0.50 5.22 0.40 -0.74 -0.96 117.98 125.66 2ba0 s PHE 57 Ca 0.01 -3.08 -0.13 0.00 -0.60 0.00 0.00 56.93 53.13 2ba0 s PHE 57 Cb -0.03 -2.93 -0.10 0.00 0.51 0.00 0.00 43.02 40.48 2ba0 s PHE 57 CO -0.00 -0.74 -0.72 0.41 0.70 0.00 0.00 175.22 174.87 2ba0 n GLY 58 N 2.98 -1.65 3.00 4.36 0.00 -1.26 -3.47 105.19 109.16 2ba0 n GLY 58 Ca 0.09 -0.11 -0.48 0.00 0.00 0.00 0.00 46.02 45.52 2ba0 n GLY 58 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 2ba0 n PRO 59 N 1.25 0.00 -4.55 1.61 -0.04 -1.24 -4.72 135.00 127.30 2ba0 n PRO 59 Ca -0.01 0.00 -0.26 0.00 -0.04 0.00 0.00 63.50 63.19 2ba0 n PRO 59 Cb 0.36 -1.35 -0.10 0.00 -0.04 0.00 0.00 33.50 32.38 2ba0 n PRO 59 CO 0.00 0.00 0.00 -0.98 -0.04 0.00 0.00 175.50 174.48 2ba0 s ARG 60 N 6.34 1.86 -0.21 0.54 1.70 -0.30 -4.87 118.95 124.01 2ba0 s ARG 60 Ca 1.13 -2.08 -0.29 0.00 -0.47 0.00 0.00 55.73 54.02 2ba0 s ARG 60 Cb -1.27 -1.15 -0.01 0.00 -0.57 0.00 0.00 34.95 31.95 2ba0 s ARG 60 CO 0.54 -0.21 1.27 -1.21 -1.08 0.00 0.00 175.30 174.61 2ba0 s GLU 61 N -3.81 4.13 -0.69 3.89 2.02 -1.26 -0.59 118.70 122.38 2ba0 s GLU 61 Ca 0.30 1.53 -0.27 0.00 0.02 0.00 0.00 54.97 56.55 2ba0 s GLU 61 Cb 0.07 -3.80 0.03 0.00 0.10 0.00 0.00 34.13 30.53 2ba0 s GLU 61 CO 0.14 -0.84 1.24 0.54 0.02 0.00 0.00 175.26 176.36 2ba0 s VAL 62 N 3.79 3.83 0.23 2.63 0.11 -1.25 -4.86 120.40 124.88 2ba0 s VAL 62 Ca 0.55 0.49 -0.02 0.00 -2.93 0.00 0.00 61.98 60.07 2ba0 s VAL 62 Cb -0.20 -4.85 0.02 0.00 -1.53 0.00 0.00 36.38 29.81 2ba0 s VAL 62 CO 0.17 -1.70 1.62 0.45 -3.33 0.00 0.00 175.10 172.31 2ba0 h HIS 63 N 9.87 0.73 -0.19 1.54 3.86 -1.93 -3.33 115.15 125.70 2ba0 h HIS 63 Ca -0.27 -0.19 -0.52 0.00 -1.16 0.00 0.00 60.37 58.23 2ba0 h HIS 63 Cb 1.05 -0.16 0.02 0.00 1.06 0.00 0.00 27.41 29.37 2ba0 h HIS 63 CO 1.10 0.87 1.79 -0.35 0.86 0.00 0.00 177.93 182.19 2ba0 n PRO 64 N -4.07 1.51 -0.28 2.45 -0.04 -1.26 -4.73 135.00 128.58 2ba0 n PRO 64 Ca -0.01 -2.08 0.21 0.00 -0.04 0.00 0.00 63.50 61.58 2ba0 n PRO 64 Cb 0.47 -3.23 0.34 0.00 -0.04 0.00 0.00 33.50 31.03 2ba0 n PRO 64 CO 0.00 0.00 0.00 0.54 -0.04 0.00 0.00 175.50 176.00 2ba0 n ARG 65 N 7.55 -0.00 0.23 0.54 1.74 -1.25 -0.72 116.66 124.74 2ba0 n ARG 65 Ca 0.48 0.48 0.11 0.00 -0.77 0.00 0.00 57.85 58.14 2ba0 n ARG 65 Cb 0.43 -1.06 0.50 0.00 -1.02 0.00 0.00 32.46 31.31 2ba0 n ARG 65 CO 0.00 0.00 0.00 1.12 -1.52 0.00 0.00 177.63 177.23 2ba0 h HIS 66 N 0.00 0.00 -0.45 -1.55 2.07 -1.92 -2.67 115.15 110.63 2ba0 h HIS 66 Ca 0.40 0.00 -0.06 0.00 -2.85 0.00 0.00 60.37 57.86 2ba0 h HIS 66 Cb 1.52 0.00 -0.03 0.00 2.57 0.00 0.00 27.41 31.46 2ba0 h HIS 66 CO -0.00 0.21 0.07 1.28 -3.07 0.00 0.00 177.93 176.42 2ba0 n LEU 67 N -3.41 4.52 -4.50 6.12 4.77 0.10 -4.87 117.00 119.72 2ba0 n LEU 67 Ca -0.00 -2.31 -0.43 0.00 -0.03 0.00 0.00 56.01 53.24 2ba0 n LEU 67 Cb 0.40 -0.65 -0.09 0.00 -2.33 0.00 0.00 43.42 40.75 2ba0 n LEU 67 CO 0.33 0.57 0.11 -1.58 -1.33 0.00 0.00 177.39 175.49 2ba0 s GLN 68 N -2.24 3.19 0.12 3.23 0.74 -1.01 -4.96 119.66 118.73 2ba0 s GLN 68 Ca 0.38 -0.68 -0.30 0.00 0.05 0.00 0.00 55.36 54.82 2ba0 s GLN 68 Cb 0.30 -3.94 -0.06 0.00 1.10 0.00 0.00 33.01 30.41 2ba0 s GLN 68 CO 0.11 -0.80 1.05 0.34 -0.55 0.00 0.00 175.29 175.43 2ba0 s ASP 69 N 1.80 7.34 0.14 6.67 -1.08 -1.26 -4.93 116.67 125.35 2ba0 s ASP 69 Ca 0.13 1.93 0.27 0.00 -0.52 0.00 0.00 52.55 54.36 2ba0 s ASP 69 Cb -0.17 -2.59 0.88 0.00 -1.46 0.00 0.00 42.92 39.58 2ba0 s ASP 69 CO 0.13 -0.20 1.77 -0.81 0.52 0.00 0.00 175.17 176.59 2ba0 n PRO 70 N 2.85 0.19 0.00 4.34 -0.04 -1.26 -0.54 135.00 140.54 2ba0 n PRO 70 Ca 0.04 0.14 0.01 0.00 -0.04 0.00 0.00 63.50 63.65 2ba0 n PRO 70 Cb 0.48 -1.71 -0.01 0.00 -0.04 0.00 0.00 33.50 32.22 2ba0 n PRO 70 CO 0.00 0.00 0.00 -1.13 -0.04 0.00 0.00 175.50 174.33 2ba0 n SER 71 N -2.02 0.15 -3.58 3.54 3.41 -1.26 -4.58 113.62 109.27 2ba0 n SER 71 Ca 0.06 -0.58 -0.07 0.00 -0.26 0.00 0.00 58.87 58.02 2ba0 n SER 71 Cb 0.40 0.94 -0.01 0.00 -0.26 0.00 0.00 64.21 65.29 2ba0 n SER 71 CO 0.00 0.00 0.00 -1.59 -0.16 0.00 0.00 175.04 173.29 2ba0 s LYS 72 N -1.12 1.88 0.40 4.33 -2.85 -1.26 -4.56 119.74 116.56 2ba0 s LYS 72 Ca 0.01 -1.10 -0.12 0.00 -1.00 0.00 0.00 55.97 53.76 2ba0 s LYS 72 Cb 0.01 0.60 -0.07 0.00 -2.06 0.00 0.00 37.83 36.31 2ba0 s LYS 72 CO 0.07 -0.87 0.79 0.00 0.10 0.00 0.00 175.35 175.44 2ba0 s ALA 73 N -3.40 3.31 0.05 0.59 0.00 -0.21 -3.48 121.76 118.63 2ba0 s ALA 73 Ca 0.13 -0.11 0.02 0.00 0.00 0.00 0.00 51.96 52.00 2ba0 s ALA 73 Cb -0.05 -2.76 -0.04 0.00 0.00 0.00 0.00 23.12 20.26 2ba0 s ALA 73 CO 0.08 0.04 0.09 0.96 0.00 0.00 0.00 175.76 176.93 2ba0 s ILE 74 N -2.31 4.69 -0.16 0.00 -4.36 -1.02 -4.88 121.20 113.15 2ba0 s ILE 74 Ca 0.53 -0.62 -0.02 0.00 -0.26 0.00 0.00 60.65 60.27 2ba0 s ILE 74 Cb -0.10 -3.23 -0.02 0.00 1.25 0.00 0.00 42.46 40.36 2ba0 s ILE 74 CO 0.28 0.19 -0.08 -0.63 0.24 0.00 0.00 174.94 174.94 2ba0 s ILE 75 N -1.35 3.42 -0.09 8.37 -1.09 -1.26 -2.14 121.20 127.07 2ba0 s ILE 75 Ca 0.28 -0.51 0.04 0.00 -2.23 0.00 0.00 60.65 58.23 2ba0 s ILE 75 Cb -0.12 -2.49 -0.00 0.00 -1.58 0.00 0.00 42.46 38.27 2ba0 s ILE 75 CO 0.20 0.49 -0.23 -0.13 -1.23 0.00 0.00 174.94 174.04 2ba0 s ARG 76 N 0.62 2.81 -0.06 2.79 0.52 -0.98 -5.01 118.95 119.64 2ba0 s ARG 76 Ca -0.05 -0.85 0.02 0.00 -0.52 0.00 0.00 55.73 54.34 2ba0 s ARG 76 Cb -0.15 -2.18 0.02 0.00 0.52 0.00 0.00 34.95 33.15 2ba0 s ARG 76 CO 0.03 0.22 -0.09 -0.47 0.02 0.00 0.00 175.30 175.00 2ba0 s TYR 77 N 0.24 1.22 -0.14 -0.53 5.04 -1.26 0.62 117.35 122.55 2ba0 s TYR 77 Ca -0.15 -0.44 0.01 0.00 -2.44 0.00 0.00 57.07 54.05 2ba0 s TYR 77 Cb -0.17 -0.95 0.02 0.00 0.35 0.00 0.00 41.96 41.21 2ba0 s TYR 77 CO 0.07 -0.27 -0.16 0.50 -1.34 0.00 0.00 175.55 174.35 2ba0 s ARG 78 N 0.83 2.45 -0.18 4.97 3.52 0.51 -4.70 118.95 126.35 2ba0 s ARG 78 Ca -0.12 -0.63 -0.09 0.00 -0.13 0.00 0.00 55.73 54.76 2ba0 s ARG 78 Cb -0.15 -2.12 -0.05 0.00 -1.56 0.00 0.00 34.95 31.07 2ba0 s ARG 78 CO 0.02 -0.14 0.12 -0.47 -0.81 0.00 0.00 175.30 174.02 2ba0 s TYR 79 N 1.18 3.43 -0.16 5.12 5.04 -1.26 -1.04 117.35 129.66 2ba0 s TYR 79 Ca -0.01 0.34 -0.13 0.00 -2.44 0.00 0.00 57.07 54.84 2ba0 s TYR 79 Cb -0.14 -2.10 0.05 0.00 0.35 0.00 0.00 41.96 40.12 2ba0 s TYR 79 CO -0.06 0.38 0.42 1.21 -1.34 0.00 0.00 175.55 176.15 2ba0 s ASN 80 N 0.04 -0.46 -0.16 4.32 3.04 -0.83 -4.87 114.94 116.01 2ba0 s ASN 80 Ca 0.09 0.86 -0.07 0.00 0.04 0.00 0.00 52.86 53.78 2ba0 s ASN 80 Cb -0.11 0.83 -0.04 0.00 -1.54 0.00 0.00 41.25 40.38 2ba0 s ASN 80 CO -0.00 -0.16 0.07 -0.04 -3.04 0.00 0.00 177.10 173.92 2ba0 s MET 81 N 0.62 3.82 0.40 0.43 -1.94 -1.26 -1.55 119.30 119.81 2ba0 s MET 81 Ca -0.03 -0.32 -0.26 0.00 -1.71 0.00 0.00 55.69 53.37 2ba0 s MET 81 Cb -0.05 -3.18 -0.09 0.00 2.01 0.00 0.00 34.83 33.53 2ba0 s MET 81 CO -0.04 0.38 1.20 0.00 -0.01 0.00 0.00 175.02 176.56 2ba0 s ALA 82 N 0.06 3.20 0.64 3.03 0.00 -1.11 -4.86 121.76 122.72 2ba0 s ALA 82 Ca 0.06 1.04 0.34 0.00 0.00 0.00 0.00 51.96 53.40 2ba0 s ALA 82 Cb -0.12 -3.41 1.84 0.00 0.00 0.00 0.00 23.12 21.43 2ba0 s ALA 82 CO 0.01 -0.59 2.03 -1.00 0.00 0.00 0.00 175.76 176.21 2ba0 h PRO 83 N 2.71 0.00 -0.61 0.00 0.13 -1.93 -1.80 132.00 130.49 2ba0 h PRO 83 Ca -0.49 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.64 2ba0 h PRO 83 Cb 1.24 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.37 2ba0 h PRO 83 CO 0.63 0.00 0.00 1.97 -0.23 0.00 0.00 178.00 180.37 2ba0 n PHE 84 N -2.92 1.30 1.32 1.56 -1.74 -1.26 -1.52 117.46 114.20 2ba0 n PHE 84 Ca -0.02 -0.60 0.13 0.00 -0.56 0.00 0.00 57.45 56.40 2ba0 n PHE 84 Cb 0.29 -0.20 0.42 0.00 1.52 0.00 0.00 39.48 41.51 2ba0 n PHE 84 CO 0.00 0.00 0.00 -1.13 -0.56 0.00 0.00 176.76 175.07 2ba0 n SER 85 N 1.05 1.24 -4.55 5.98 3.41 -0.68 -4.89 113.62 115.17 2ba0 n SER 85 Ca 0.24 -1.13 -0.25 0.00 -0.26 0.00 0.00 58.87 57.47 2ba0 n SER 85 Cb 0.81 0.09 -0.10 0.00 -0.26 0.00 0.00 64.21 64.76 2ba0 n SER 85 CO 0.00 0.00 0.00 -0.69 -0.16 0.00 0.00 175.04 174.19 2ba0 s VAL 86 N -2.32 2.38 0.42 -3.33 1.01 -1.26 -1.32 120.40 115.98 2ba0 s VAL 86 Ca 0.29 -2.19 0.09 0.00 0.00 0.00 0.00 61.98 60.17 2ba0 s VAL 86 Cb 0.20 -2.62 0.28 0.00 0.00 0.00 0.00 36.38 34.24 2ba0 s VAL 86 CO 0.45 -0.24 2.04 -0.08 0.00 0.00 0.00 175.10 177.28 2ba0 h GLU 87 N 2.02 0.50 -4.93 2.72 4.81 -1.94 -3.38 114.58 114.39 2ba0 h GLU 87 Ca -0.42 -0.03 -0.66 0.00 -0.13 0.00 0.00 59.36 58.12 2ba0 h GLU 87 Cb 1.25 -0.11 -0.36 0.00 0.63 0.00 0.00 28.75 30.16 2ba0 h GLU 87 CO 0.68 0.33 -0.83 -2.00 -0.73 0.00 0.00 179.01 176.45 2ba0 s GLU 88 N -5.47 2.62 -0.09 1.92 2.12 -1.26 -5.08 118.70 113.47 2ba0 s GLU 88 Ca -0.08 -0.98 -0.32 0.00 0.36 0.00 0.00 54.97 53.95 2ba0 s GLU 88 Cb 0.18 -2.63 -0.15 0.00 0.26 0.00 0.00 34.13 31.78 2ba0 s GLU 88 CO 0.73 -0.35 0.91 -2.13 -0.54 0.00 0.00 175.26 173.89 2ba0 n ARG 89 N 4.57 0.00 -4.12 4.30 0.00 -1.26 -4.93 116.66 115.22 2ba0 n ARG 89 Ca -0.18 0.00 -0.36 0.00 -0.00 0.00 0.00 57.85 57.31 2ba0 n ARG 89 Cb 0.47 -1.15 -0.08 0.00 0.00 0.00 0.00 32.46 31.70 2ba0 n ARG 89 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 177.63 177.84 2ba0 s LYS 90 N 0.53 3.32 0.07 -0.14 2.20 -0.57 -5.06 119.74 120.08 2ba0 s LYS 90 Ca 0.72 -0.29 -0.31 0.00 -0.36 0.00 0.00 55.97 55.74 2ba0 s LYS 90 Cb -1.01 -3.01 -0.08 0.00 -1.51 0.00 0.00 37.83 32.22 2ba0 s LYS 90 CO 0.48 0.67 1.50 0.50 -0.36 0.00 0.00 175.35 178.14 2ba0 s ARG 91 N -0.75 4.26 0.74 4.03 3.52 -1.26 -4.32 118.95 125.17 2ba0 s ARG 91 Ca 0.12 2.16 -0.15 0.00 -0.13 0.00 0.00 55.73 57.73 2ba0 s ARG 91 Cb -0.12 -3.45 0.05 0.00 -1.56 0.00 0.00 34.95 29.87 2ba0 s ARG 91 CO 0.03 -0.60 1.23 -1.25 -0.81 0.00 0.00 175.30 173.90 2ba0 s PRO 92 N 2.01 2.01 0.00 5.12 0.04 -1.26 -4.90 135.00 138.01 2ba0 s PRO 92 Ca 0.68 1.85 0.00 0.00 0.04 0.00 0.00 61.00 63.57 2ba0 s PRO 92 Cb -0.37 -1.81 0.00 0.00 0.04 0.00 0.00 34.50 32.36 2ba0 s PRO 92 CO 0.30 -1.96 0.00 0.41 0.04 0.00 0.00 177.00 175.79 2ba0 n GLY 93 N 0.60 3.06 3.80 0.56 0.00 -1.26 -5.07 105.19 106.88 2ba0 n GLY 93 Ca 0.14 -1.91 -0.32 0.00 0.00 0.00 0.00 46.02 43.93 2ba0 n GLY 93 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2ba0 s PRO 94 N -3.23 3.02 0.37 1.61 0.04 -1.26 -4.97 135.00 130.58 2ba0 s PRO 94 Ca 0.00 1.11 0.04 0.00 0.04 0.00 0.00 61.00 62.19 2ba0 s PRO 94 Cb 0.00 -2.00 -0.03 0.00 0.04 0.00 0.00 34.50 32.51 2ba0 s PRO 94 CO 0.00 -1.04 0.12 0.16 0.04 0.00 0.00 177.00 176.28 2ba0 s ASP 95 N -3.23 2.44 0.38 6.66 -4.77 -1.26 -5.00 116.67 111.88 2ba0 s ASP 95 Ca 0.61 -1.59 0.06 0.00 -3.30 0.00 0.00 52.55 48.33 2ba0 s ASP 95 Cb -0.16 0.36 0.75 0.00 -1.09 0.00 0.00 42.92 42.79 2ba0 s ASP 95 CO 0.46 -0.86 1.98 0.03 0.70 0.00 0.00 175.17 177.48 2ba0 h ARG 96 N 1.94 0.52 -0.05 2.11 3.08 -1.99 -1.75 114.38 118.24 2ba0 h ARG 96 Ca -0.36 -0.07 -0.01 0.00 0.07 0.00 0.00 59.98 59.61 2ba0 h ARG 96 Cb 1.26 -0.10 -0.00 0.00 0.08 0.00 0.00 29.97 31.21 2ba0 h ARG 96 CO 0.58 0.44 -0.01 -0.09 -1.07 0.00 0.00 179.97 179.82 2ba0 h ARG 97 N 0.52 0.10 -0.68 0.04 2.43 -1.99 -1.82 114.38 112.98 2ba0 h ARG 97 Ca 0.13 -0.04 0.08 0.00 -0.81 0.00 0.00 59.98 59.34 2ba0 h ARG 97 Cb 0.12 -0.01 -0.06 0.00 -0.42 0.00 0.00 29.97 29.60 2ba0 h ARG 97 CO -0.01 0.43 0.35 0.77 -1.51 0.00 0.00 179.97 180.00 2ba0 h SER 98 N -0.24 0.48 -0.51 -3.80 0.02 -1.83 -0.48 113.55 107.19 2ba0 h SER 98 Ca 0.01 0.05 -0.05 0.00 -0.84 0.00 0.00 61.79 60.96 2ba0 h SER 98 Cb 0.40 -0.04 -0.03 0.00 0.14 0.00 0.00 62.40 62.87 2ba0 h SER 98 CO 0.00 0.30 0.14 0.40 -1.14 0.00 0.00 176.83 176.53 2ba0 h ILE 99 N 0.62 1.23 -0.18 3.27 2.04 -1.24 -0.74 117.51 122.51 2ba0 h ILE 99 Ca 0.32 -0.84 -0.21 0.00 1.00 0.00 0.00 64.86 65.14 2ba0 h ILE 99 Cb 0.28 0.65 0.01 0.00 -0.74 0.00 0.00 36.82 37.02 2ba0 h ILE 99 CO -0.23 0.31 -0.71 -0.08 0.00 0.00 0.00 178.15 177.45 2ba0 h GLU 100 N 0.84 0.78 -0.31 2.37 4.81 -0.44 -2.26 114.58 120.36 2ba0 h GLU 100 Ca 0.18 -0.59 -0.02 0.00 -0.13 0.00 0.00 59.36 58.80 2ba0 h GLU 100 Cb 0.30 0.11 -0.01 0.00 0.63 0.00 0.00 28.75 29.78 2ba0 h GLU 100 CO -0.00 1.21 0.11 0.82 -0.73 0.00 0.00 179.01 180.42 2ba0 h ILE 101 N 0.55 1.19 -0.77 2.32 2.04 -0.92 -2.11 117.51 119.82 2ba0 h ILE 101 Ca -0.03 -0.60 0.09 0.00 1.00 0.00 0.00 64.86 65.33 2ba0 h ILE 101 Cb 1.33 1.01 -0.07 0.00 -0.74 0.00 0.00 36.82 38.34 2ba0 h ILE 101 CO 0.15 0.20 0.41 0.28 0.00 0.00 0.00 178.15 179.19 2ba0 h SER 102 N 0.35 0.57 0.15 1.72 0.02 -1.10 -1.50 113.55 113.75 2ba0 h SER 102 Ca 0.10 0.05 -0.01 0.00 -0.84 0.00 0.00 61.79 61.10 2ba0 h SER 102 Cb 0.21 -0.05 0.00 0.00 0.14 0.00 0.00 62.40 62.70 2ba0 h SER 102 CO -0.01 0.32 -0.07 0.50 -1.14 0.00 0.00 176.83 176.44 2ba0 h LYS 103 N 0.70 -0.19 -0.17 3.45 3.64 -1.10 0.54 116.57 123.43 2ba0 h LYS 103 Ca 0.37 0.01 -0.06 0.00 -1.27 0.00 0.00 60.65 59.71 2ba0 h LYS 103 Cb 0.37 0.04 -0.01 0.00 -0.41 0.00 0.00 32.23 32.22 2ba0 h LYS 103 CO -0.26 0.00 -0.15 -0.24 -2.27 0.00 0.00 179.45 176.53 2ba0 h VAL 104 N -0.37 1.20 -0.14 2.00 3.04 -1.26 -1.45 116.25 119.27 2ba0 h VAL 104 Ca -0.02 -0.90 -0.21 0.00 -1.01 0.00 0.00 66.70 64.56 2ba0 h VAL 104 Cb 0.29 1.24 0.01 0.00 -2.01 0.00 0.00 31.29 30.82 2ba0 h VAL 104 CO 0.03 0.28 -0.74 0.28 -1.01 0.00 0.00 177.57 176.41 2ba0 h SER 105 N 0.26 0.89 -0.98 3.17 0.02 -1.20 -2.40 113.55 113.31 2ba0 h SER 105 Ca 0.05 -0.64 0.03 0.00 -0.84 0.00 0.00 61.79 60.40 2ba0 h SER 105 Cb 0.44 -0.26 -0.06 0.00 0.14 0.00 0.00 62.40 62.66 2ba0 h SER 105 CO 0.03 1.38 0.64 0.50 -1.14 0.00 0.00 176.83 178.24 2ba0 h LYS 106 N 0.46 1.21 -0.06 3.45 3.64 -0.49 -2.07 116.57 122.70 2ba0 h LYS 106 Ca -0.05 -0.07 -0.12 0.00 -1.27 0.00 0.00 60.65 59.14 2ba0 h LYS 106 Cb 1.38 -0.27 -0.01 0.00 -0.41 0.00 0.00 32.23 32.91 2ba0 h LYS 106 CO 0.15 0.80 -0.50 0.93 -2.27 0.00 0.00 179.45 178.56 2ba0 h GLU 107 N 1.24 0.16 -0.31 1.90 5.08 -1.19 -2.34 114.58 119.12 2ba0 h GLU 107 Ca 0.39 -0.09 -0.03 0.00 -1.00 0.00 0.00 59.36 58.62 2ba0 h GLU 107 Cb -0.01 0.01 -0.02 0.00 0.50 0.00 0.00 28.75 29.22 2ba0 h GLU 107 CO -0.12 0.62 0.04 0.00 -1.00 0.00 0.00 179.01 178.56 2ba0 h ALA 108 N 1.36 1.51 0.00 3.43 0.00 -0.85 -2.65 119.26 122.06 2ba0 h ALA 108 Ca 0.00 -0.15 0.00 0.00 0.00 0.00 0.00 54.91 54.76 2ba0 h ALA 108 Cb 0.93 -0.14 0.00 0.00 0.00 0.00 0.00 17.79 18.58 2ba0 h ALA 108 CO 0.07 0.36 -1.08 1.19 0.00 0.00 0.00 179.25 179.79 2ba0 n PHE 109 N -4.34 0.59 -0.03 0.00 3.01 -1.10 -3.72 117.46 111.87 2ba0 n PHE 109 Ca 0.01 0.17 -0.03 0.00 1.01 0.00 0.00 57.45 58.62 2ba0 n PHE 109 Cb 0.20 -0.71 0.21 0.00 -0.01 0.00 0.00 39.48 39.17 2ba0 n PHE 109 CO 0.00 0.00 0.00 0.93 1.01 0.00 0.00 176.76 178.70 2ba0 h GLU 110 N 0.00 0.61 0.00 -1.08 5.08 -1.09 0.50 114.58 118.60 2ba0 h GLU 110 Ca 0.00 -0.17 0.00 0.00 -1.00 0.00 0.00 59.36 58.19 2ba0 h GLU 110 Cb 0.89 -0.07 0.00 0.00 0.50 0.00 0.00 28.75 30.07 2ba0 h GLU 110 CO 0.00 0.69 0.00 0.00 -1.00 0.00 0.00 179.01 178.70 2ba0 n ALA 111 N -2.48 2.04 -0.01 3.43 0.00 -1.04 -3.94 120.51 118.51 2ba0 n ALA 111 Ca 0.01 -0.02 -0.00 0.00 0.00 0.00 0.00 53.44 53.43 2ba0 n ALA 111 Cb 0.32 -1.41 -0.01 0.00 0.00 0.00 0.00 19.45 18.34 2ba0 n ALA 111 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.50 177.78 2ba0 n VAL 112 N -1.98 0.09 -2.57 0.00 0.31 -0.77 -4.96 118.33 108.45 2ba0 n VAL 112 Ca 0.05 -0.06 -0.38 0.00 -0.01 0.00 0.00 64.34 63.93 2ba0 n VAL 112 Cb 0.32 -0.68 -0.05 0.00 -0.91 0.00 0.00 33.84 32.52 2ba0 n VAL 112 CO 0.00 0.00 0.00 -0.63 -1.32 0.00 0.00 176.83 174.88 2ba0 s ILE 113 N -2.05 3.75 -1.26 2.52 1.01 0.17 -0.92 121.20 124.41 2ba0 s ILE 113 Ca -0.01 1.50 -0.09 0.00 0.00 0.00 0.00 60.65 62.06 2ba0 s ILE 113 Cb 0.01 -3.85 0.18 0.00 0.01 0.00 0.00 42.46 38.80 2ba0 s ILE 113 CO 0.07 0.16 1.84 0.23 0.00 0.00 0.00 174.94 177.24 2ba0 n MET 114 N 0.50 3.72 0.17 2.79 2.81 -0.56 -4.80 117.12 121.74 2ba0 n MET 114 Ca 0.02 -3.63 0.18 0.00 -1.81 0.00 0.00 57.70 52.46 2ba0 n MET 114 Cb 0.48 -2.88 0.80 0.00 -0.71 0.00 0.00 33.22 30.92 2ba0 n MET 114 CO 0.00 0.00 0.00 0.87 1.51 0.00 0.00 175.97 178.35 2ba0 h LYS 115 N 5.70 0.00 0.00 0.03 1.57 -1.90 -2.22 116.57 119.75 2ba0 h LYS 115 Ca 0.37 0.00 -0.00 0.00 -1.87 0.00 0.00 60.65 59.15 2ba0 h LYS 115 Cb 0.62 0.00 -0.00 0.00 0.08 0.00 0.00 32.23 32.93 2ba0 h LYS 115 CO 1.60 0.00 -0.01 0.93 -0.57 0.00 0.00 179.45 181.40 2ba0 h GLU 116 N 0.00 0.00 0.00 3.15 3.07 -1.87 -0.40 114.58 118.53 2ba0 h GLU 116 Ca 0.12 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 58.98 2ba0 h GLU 116 Cb 0.70 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.61 2ba0 h GLU 116 CO -0.00 0.01 0.00 1.28 -1.40 0.00 0.00 179.01 178.90 2ba0 n LEU 117 N -3.17 0.30 -3.28 1.33 4.77 -0.83 -4.38 117.00 111.73 2ba0 n LEU 117 Ca -0.02 0.55 -0.25 0.00 -0.03 0.00 0.00 56.01 56.26 2ba0 n LEU 117 Cb 0.13 -0.48 -0.08 0.00 -2.33 0.00 0.00 43.42 40.66 2ba0 n LEU 117 CO 0.23 -0.24 -0.25 0.49 -1.33 0.00 0.00 177.39 176.28 2ba0 n PHE 118 N -1.81 0.06 -1.87 -1.77 3.01 -0.87 -5.04 117.46 109.17 2ba0 n PHE 118 Ca 0.04 -3.59 -0.37 0.00 1.01 0.00 0.00 57.45 54.55 2ba0 n PHE 118 Cb 0.28 -0.25 0.05 0.00 -0.01 0.00 0.00 39.48 39.55 2ba0 n PHE 118 CO 0.00 0.00 0.00 -2.14 1.01 0.00 0.00 176.76 175.63 2ba0 s PRO 119 N -1.06 2.79 0.00 -1.08 0.02 -1.26 -2.21 135.00 132.20 2ba0 s PRO 119 Ca 0.35 1.97 0.00 0.00 0.02 0.00 0.00 61.00 63.33 2ba0 s PRO 119 Cb 0.13 -1.91 0.00 0.00 0.02 0.00 0.00 34.50 32.74 2ba0 s PRO 119 CO -0.12 -1.38 0.00 0.54 -0.33 0.00 0.00 177.00 175.70 2ba0 n ARG 120 N -1.69 -0.17 -3.84 5.54 3.00 0.30 -4.87 116.66 114.93 2ba0 n ARG 120 Ca 0.14 0.04 -0.23 0.00 -0.01 0.00 0.00 57.85 57.79 2ba0 n ARG 120 Cb 0.49 -3.99 -0.04 0.00 0.00 0.00 0.00 32.46 28.92 2ba0 n ARG 120 CO 0.00 0.00 0.00 -1.12 0.00 0.00 0.00 177.63 176.51 2ba0 s SER 121 N -2.25 4.73 0.07 0.55 0.01 -1.13 -3.77 113.70 111.91 2ba0 s SER 121 Ca 0.00 -0.98 0.05 0.00 1.31 0.00 0.00 55.95 56.33 2ba0 s SER 121 Cb 0.00 -0.31 -0.03 0.00 0.21 0.00 0.00 66.02 65.89 2ba0 s SER 121 CO 0.00 -0.72 -0.14 0.00 0.41 0.00 0.00 173.24 172.79 2ba0 s ALA 122 N -2.59 1.14 -0.32 1.44 0.00 0.24 -2.43 121.76 119.24 2ba0 s ALA 122 Ca 0.42 -0.98 0.03 0.00 0.00 0.00 0.00 51.96 51.43 2ba0 s ALA 122 Cb -0.00 -0.09 0.09 0.00 0.00 0.00 0.00 23.12 23.11 2ba0 s ALA 122 CO 0.24 0.16 0.04 0.42 0.00 0.00 0.00 175.76 176.62 2ba0 s ILE 123 N -1.25 1.88 -0.16 0.00 1.01 -0.91 -1.14 121.20 120.63 2ba0 s ILE 123 Ca -0.02 -1.98 -0.16 0.00 0.00 0.00 0.00 60.65 58.49 2ba0 s ILE 123 Cb -0.10 -2.34 -0.04 0.00 0.01 0.00 0.00 42.46 39.98 2ba0 s ILE 123 CO 0.02 -0.53 0.39 -1.81 0.00 0.00 0.00 174.94 173.01 2ba0 s ASP 124 N 1.12 6.53 -0.26 3.58 -0.00 -1.23 -2.32 116.67 124.09 2ba0 s ASP 124 Ca 0.08 0.62 -0.02 0.00 -0.00 0.00 0.00 52.55 53.23 2ba0 s ASP 124 Cb -0.19 -2.23 0.03 0.00 -0.00 0.00 0.00 42.92 40.53 2ba0 s ASP 124 CO -0.11 0.02 -0.04 -0.63 -0.00 0.00 0.00 175.17 174.40 2ba0 s ILE 125 N 0.75 3.01 -0.19 0.77 1.01 0.20 -1.79 121.20 124.96 2ba0 s ILE 125 Ca 0.21 -1.05 -0.05 0.00 0.00 0.00 0.00 60.65 59.76 2ba0 s ILE 125 Cb -0.14 -2.56 -0.03 0.00 0.01 0.00 0.00 42.46 39.74 2ba0 s ILE 125 CO 0.07 0.14 0.00 -0.36 0.00 0.00 0.00 174.94 174.79 2ba0 s PHE 126 N 1.33 3.06 -0.08 3.97 0.40 -0.37 -0.36 117.98 125.92 2ba0 s PHE 126 Ca -0.01 -0.36 0.02 0.00 -0.60 0.00 0.00 56.93 55.98 2ba0 s PHE 126 Cb -0.17 -2.06 0.02 0.00 0.51 0.00 0.00 43.02 41.31 2ba0 s PHE 126 CO -0.03 -0.16 -0.12 0.08 0.70 0.00 0.00 175.22 175.69 2ba0 s VAL 127 N 0.82 1.19 -0.06 -0.44 1.01 -0.21 -0.21 120.40 122.51 2ba0 s VAL 127 Ca 0.01 -0.48 0.06 0.00 0.00 0.00 0.00 61.98 61.56 2ba0 s VAL 127 Cb -0.14 -1.11 -0.01 0.00 0.00 0.00 0.00 36.38 35.12 2ba0 s VAL 127 CO 0.02 0.38 -0.24 -0.70 0.00 0.00 0.00 175.10 174.56 2ba0 s GLU 128 N 0.93 2.46 -0.31 2.72 2.56 -0.38 -1.97 118.70 124.71 2ba0 s GLU 128 Ca -0.09 -0.85 -0.10 0.00 0.00 0.00 0.00 54.97 53.93 2ba0 s GLU 128 Cb -0.15 -2.07 -0.01 0.00 2.00 0.00 0.00 34.13 33.90 2ba0 s GLU 128 CO 0.00 0.34 0.16 0.14 -0.56 0.00 0.00 175.26 175.34 2ba0 s VAL 129 N -0.09 4.67 0.13 3.70 -7.23 -0.60 -0.84 120.40 120.14 2ba0 s VAL 129 Ca -0.05 -0.36 0.02 0.00 -1.81 0.00 0.00 61.98 59.78 2ba0 s VAL 129 Cb -0.14 -3.36 -0.21 0.00 0.56 0.00 0.00 36.38 33.23 2ba0 s VAL 129 CO 0.04 0.09 1.28 -0.07 -0.31 0.00 0.00 175.10 176.12 2ba0 h LEU 130 N 8.36 0.22 -7.29 1.32 3.38 -0.65 -2.94 115.31 117.71 2ba0 h LEU 130 Ca -0.33 -0.21 -0.19 0.00 0.09 0.00 0.00 57.88 57.24 2ba0 h LEU 130 Cb 1.15 -0.07 -0.30 0.00 0.09 0.00 0.00 40.66 41.53 2ba0 h LEU 130 CO 0.61 1.10 -0.47 -1.58 0.09 0.00 0.00 178.44 178.19 2ba0 s GLN 131 N -2.89 0.22 0.14 1.13 0.74 -1.03 -3.87 119.66 114.09 2ba0 s GLN 131 Ca -0.02 0.64 0.04 0.00 0.05 0.00 0.00 55.36 56.07 2ba0 s GLN 131 Cb 0.09 -0.07 -0.04 0.00 1.10 0.00 0.00 33.01 34.09 2ba0 s GLN 131 CO 0.84 -0.20 0.15 0.00 -0.55 0.00 0.00 175.29 175.53 2ba0 s ALA 132 N 1.63 3.66 0.00 1.58 0.00 -0.43 -1.18 121.76 127.02 2ba0 s ALA 132 Ca -0.06 -1.12 -0.00 0.00 0.00 0.00 0.00 51.96 50.78 2ba0 s ALA 132 Cb -0.11 -1.47 0.00 0.00 0.00 0.00 0.00 23.12 21.54 2ba0 s ALA 132 CO -0.09 0.58 0.01 -3.47 0.00 0.00 0.00 175.76 172.79 2ba0 n ASP 133 N -0.16 -0.02 -4.76 0.00 -0.08 -1.26 -4.78 116.55 105.48 2ba0 n ASP 133 Ca -0.08 -1.02 -0.41 0.00 -1.51 0.00 0.00 54.79 51.77 2ba0 n ASP 133 Cb 0.54 0.04 -0.02 0.00 2.34 0.00 0.00 41.12 44.02 2ba0 n ASP 133 CO 0.00 0.00 0.00 0.00 0.12 0.00 0.00 177.20 177.32 2ba0 s ALA 134 N -1.30 3.56 0.00 -1.67 0.00 -1.26 -3.50 121.76 117.58 2ba0 s ALA 134 Ca 0.00 1.36 0.00 0.00 0.00 0.00 0.00 51.96 53.32 2ba0 s ALA 134 Cb -0.00 -3.54 0.00 0.00 0.00 0.00 0.00 23.12 19.58 2ba0 s ALA 134 CO 0.00 -0.77 0.00 0.41 0.00 0.00 0.00 175.76 175.40 2ba0 n GLY 135 N 1.18 0.62 0.35 0.00 0.00 -1.26 -4.91 105.19 101.17 2ba0 n GLY 135 Ca 0.02 -0.05 0.15 0.00 0.00 0.00 0.00 46.02 46.14 2ba0 n GLY 135 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 2ba0 h SER 136 N 0.00 0.73 -0.55 1.61 4.64 -1.94 0.49 113.55 118.53 2ba0 h SER 136 Ca 0.00 0.11 0.11 0.00 -0.47 0.00 0.00 61.79 61.55 2ba0 h SER 136 Cb 0.00 -0.01 -0.10 0.00 -0.31 0.00 0.00 62.40 61.99 2ba0 h SER 136 CO 0.00 0.19 -0.05 -0.09 -0.87 0.00 0.00 176.83 176.01 2ba0 h ARG 137 N 0.67 0.07 -0.39 4.77 2.43 -1.92 0.30 114.38 120.31 2ba0 h ARG 137 Ca 0.61 -0.00 -0.11 0.00 -0.81 0.00 0.00 59.98 59.67 2ba0 h ARG 137 Cb 1.06 -0.02 -0.01 0.00 -0.42 0.00 0.00 29.97 30.59 2ba0 h ARG 137 CO -0.42 0.04 -0.17 1.15 -1.51 0.00 0.00 179.97 179.06 2ba0 h THR 138 N 0.07 1.28 -0.30 0.20 2.02 -0.53 -2.54 112.91 113.11 2ba0 h THR 138 Ca 0.28 -1.30 0.03 0.00 0.77 0.00 0.00 66.41 66.18 2ba0 h THR 138 Cb 0.43 1.29 -0.03 0.00 -1.74 0.00 0.00 68.15 68.11 2ba0 h THR 138 CO -0.51 0.43 0.12 0.00 0.37 0.00 0.00 175.52 175.94 2ba0 h ALA 139 N 0.81 0.35 -0.60 6.16 0.00 0.47 -2.87 119.26 123.59 2ba0 h ALA 139 Ca 0.09 0.02 0.03 0.00 0.00 0.00 0.00 54.91 55.05 2ba0 h ALA 139 Cb 0.72 -0.01 -0.04 0.00 0.00 0.00 0.00 17.79 18.46 2ba0 h ALA 139 CO 0.05 -0.27 0.36 0.00 0.00 0.00 0.00 179.25 179.39 2ba0 h LEU 141 N 0.72 0.18 -1.31 0.00 3.38 -1.31 0.78 115.31 117.73 2ba0 h LEU 141 Ca 0.24 0.00 0.03 0.00 0.09 0.00 0.00 57.88 58.24 2ba0 h LEU 141 Cb 0.04 -0.04 -0.04 0.00 0.09 0.00 0.00 40.66 40.71 2ba0 h LEU 141 CO -0.11 0.13 0.48 0.78 0.09 0.00 0.00 178.44 179.81 2ba0 h ASN 142 N 0.23 0.78 -0.02 -0.43 2.35 -1.29 -0.80 115.58 116.41 2ba0 h ASN 142 Ca 0.08 -0.01 -0.19 0.00 -0.55 0.00 0.00 56.30 55.62 2ba0 h ASN 142 Cb -0.00 -0.19 -0.00 0.00 0.05 0.00 0.00 38.32 38.18 2ba0 h ASN 142 CO -0.04 0.55 -0.65 0.00 -1.65 0.00 0.00 177.43 175.64 2ba0 h ALA 143 N 1.57 0.53 -0.64 -0.83 0.00 -0.90 -2.83 119.26 116.16 2ba0 h ALA 143 Ca 0.28 -0.56 -0.05 0.00 0.00 0.00 0.00 54.91 54.58 2ba0 h ALA 143 Cb 0.00 -0.06 -0.03 0.00 0.00 0.00 0.00 17.79 17.71 2ba0 h ALA 143 CO -0.07 0.70 0.19 0.00 0.00 0.00 0.00 179.25 180.07 2ba0 h ALA 144 N 0.80 0.84 0.10 0.00 0.00 -0.13 -0.27 119.26 120.60 2ba0 h ALA 144 Ca -0.02 -0.21 0.00 0.00 0.00 0.00 0.00 54.91 54.68 2ba0 h ALA 144 Cb 1.24 -0.25 -0.01 0.00 0.00 0.00 0.00 17.79 18.78 2ba0 h ALA 144 CO 0.13 0.52 -0.08 1.03 0.00 0.00 0.00 179.25 180.84 2ba0 h SER 145 N 0.93 -0.21 -0.90 0.00 0.87 -1.15 0.19 113.55 113.28 2ba0 h SER 145 Ca 0.21 0.02 0.04 0.00 -1.23 0.00 0.00 61.79 60.82 2ba0 h SER 145 Cb 0.30 0.07 -0.05 0.00 -0.44 0.00 0.00 62.40 62.28 2ba0 h SER 145 CO -0.01 -0.13 0.59 0.58 -0.53 0.00 0.00 176.83 177.33 2ba0 h VAL 146 N -0.19 1.14 -0.39 2.23 2.07 -1.31 -1.74 116.25 118.05 2ba0 h VAL 146 Ca -0.00 -0.38 -0.10 0.00 0.82 0.00 0.00 66.70 67.04 2ba0 h VAL 146 Cb 0.18 -0.06 -0.02 0.00 -1.52 0.00 0.00 31.29 29.87 2ba0 h VAL 146 CO -0.01 0.20 -0.18 0.00 0.02 0.00 0.00 177.57 177.60 2ba0 h ALA 147 N 1.48 0.95 -0.42 1.67 0.00 -0.31 0.21 119.26 122.85 2ba0 h ALA 147 Ca 0.36 -0.35 -0.10 0.00 0.00 0.00 0.00 54.91 54.82 2ba0 h ALA 147 Cb 0.05 -0.16 -0.01 0.00 0.00 0.00 0.00 17.79 17.67 2ba0 h ALA 147 CO -0.11 0.61 -0.14 -0.07 0.00 0.00 0.00 179.25 179.54 2ba0 h LEU 148 N 0.65 0.85 -0.11 0.00 3.38 -0.14 -1.88 115.31 118.07 2ba0 h LEU 148 Ca 0.10 -0.38 -0.01 0.00 0.09 0.00 0.00 57.88 57.69 2ba0 h LEU 148 Cb 0.67 -0.23 -0.00 0.00 0.09 0.00 0.00 40.66 41.18 2ba0 h LEU 148 CO 0.05 1.03 0.04 0.58 0.09 0.00 0.00 178.44 180.24 2ba0 h VAL 149 N 0.66 1.14 -0.08 1.22 2.07 -1.18 -2.18 116.25 117.90 2ba0 h VAL 149 Ca 0.10 -0.41 0.02 0.00 0.82 0.00 0.00 66.70 67.24 2ba0 h VAL 149 Cb 0.68 1.21 -0.00 0.00 -1.52 0.00 0.00 31.29 31.66 2ba0 h VAL 149 CO 0.05 0.12 0.31 -0.78 0.02 0.00 0.00 177.57 177.29 2ba0 h ASP 150 N 0.02 0.00 0.06 0.57 -0.00 -0.74 0.12 116.42 116.46 2ba0 h ASP 150 Ca 0.04 0.00 0.00 0.00 -0.00 0.00 0.00 57.03 57.07 2ba0 h ASP 150 Cb 0.15 0.00 0.00 0.00 -0.00 0.00 0.00 39.33 39.48 2ba0 h ASP 150 CO -0.00 0.00 -0.83 0.00 -0.00 0.00 0.00 179.24 178.41 2ba0 n ALA 151 N -2.01 4.37 -2.34 -0.78 0.00 -0.72 -4.60 120.51 114.42 2ba0 n ALA 151 Ca -0.00 -0.57 -0.03 0.00 0.00 0.00 0.00 53.44 52.83 2ba0 n ALA 151 Cb 0.38 -0.83 0.00 0.00 0.00 0.00 0.00 19.45 19.01 2ba0 n ALA 151 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2ba0 n GLY 152 N 1.48 0.48 3.78 0.00 0.00 0.43 -4.89 105.19 106.47 2ba0 n GLY 152 Ca 0.05 -0.66 -0.37 0.00 0.00 0.00 0.00 46.02 45.04 2ba0 n GLY 152 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 2ba0 s VAL 153 N -2.57 5.22 0.05 1.61 -7.23 -1.13 -5.02 120.40 111.33 2ba0 s VAL 153 Ca 0.04 0.68 -0.33 0.00 -1.81 0.00 0.00 61.98 60.56 2ba0 s VAL 153 Cb -0.02 -3.67 -0.12 0.00 0.56 0.00 0.00 36.38 33.14 2ba0 s VAL 153 CO 0.05 0.46 1.79 -2.65 -0.31 0.00 0.00 175.10 174.44 2ba0 n PRO 154 N 2.86 2.39 -4.21 4.82 -0.02 -1.26 -4.76 135.00 134.82 2ba0 n PRO 154 Ca -0.13 0.87 -0.13 0.00 -2.02 0.00 0.00 63.50 62.10 2ba0 n PRO 154 Cb 0.52 -2.72 -0.10 0.00 -0.02 0.00 0.00 33.50 31.19 2ba0 n PRO 154 CO 0.00 0.00 0.00 -1.64 1.98 0.00 0.00 175.50 175.84 2ba0 s MET 155 N 2.82 0.94 0.41 -0.52 -1.94 -1.26 -1.50 119.30 118.25 2ba0 s MET 155 Ca 0.85 -1.36 0.27 0.00 -1.71 0.00 0.00 55.69 53.75 2ba0 s MET 155 Cb -0.61 -0.45 0.81 0.00 2.01 0.00 0.00 34.83 36.58 2ba0 s MET 155 CO 0.43 0.04 1.76 0.87 -0.01 0.00 0.00 175.02 178.12 2ba0 h LYS 156 N 2.99 0.00 0.00 2.03 1.57 -1.39 -3.47 116.57 118.29 2ba0 h LYS 156 Ca -0.36 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.42 2ba0 h LYS 156 Cb 1.18 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.49 2ba0 h LYS 156 CO 0.62 0.00 0.00 0.41 -0.57 0.00 0.00 179.45 179.91 2ba0 n GLY 157 N 0.69 -0.76 3.91 3.86 0.00 -1.26 -4.93 105.19 106.70 2ba0 n GLY 157 Ca 0.03 -0.92 -0.24 0.00 0.00 0.00 0.00 46.02 44.89 2ba0 n GLY 157 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 2ba0 s MET 158 N -1.06 3.29 -0.17 1.61 -1.94 -1.09 -4.91 119.30 115.04 2ba0 s MET 158 Ca 0.00 -0.73 -0.02 0.00 -1.71 0.00 0.00 55.69 53.23 2ba0 s MET 158 Cb 0.00 -2.85 -0.01 0.00 2.01 0.00 0.00 34.83 33.98 2ba0 s MET 158 CO 0.00 0.48 -0.10 0.42 -0.01 0.00 0.00 175.02 175.81 2ba0 s ILE 159 N -1.84 3.15 -0.01 2.53 1.01 -1.26 -0.54 121.20 124.23 2ba0 s ILE 159 Ca 0.34 -0.60 0.07 0.00 0.00 0.00 0.00 60.65 60.45 2ba0 s ILE 159 Cb -0.10 -2.37 -0.02 0.00 0.01 0.00 0.00 42.46 39.98 2ba0 s ILE 159 CO 0.27 0.49 -0.21 -0.89 0.00 0.00 0.00 174.94 174.60 2ba0 s THR 160 N 0.82 1.67 0.01 2.92 2.01 -0.72 -4.60 115.64 117.75 2ba0 s THR 160 Ca -0.03 -0.92 0.00 0.00 0.31 0.00 0.00 61.69 61.04 2ba0 s THR 160 Cb -0.15 -1.39 -0.01 0.00 0.01 0.00 0.00 72.50 70.96 2ba0 s THR 160 CO 0.01 0.45 -0.02 -0.55 -0.69 0.00 0.00 174.62 173.83 2ba0 s SER 161 N -0.54 0.16 0.23 3.53 0.15 -1.26 -0.55 113.70 115.42 2ba0 s SER 161 Ca 0.08 -0.18 -0.19 0.00 0.70 0.00 0.00 55.95 56.37 2ba0 s SER 161 Cb -0.08 0.02 0.02 0.00 -1.71 0.00 0.00 66.02 64.28 2ba0 s SER 161 CO -0.01 -0.09 0.59 0.54 1.20 0.00 0.00 173.24 175.48 2ba0 s VAL 162 N -0.50 0.01 0.19 4.45 0.11 -0.97 -4.79 120.40 118.90 2ba0 s VAL 162 Ca -0.05 -0.89 0.10 0.00 -2.93 0.00 0.00 61.98 58.21 2ba0 s VAL 162 Cb -0.04 -1.78 -0.04 0.00 -1.53 0.00 0.00 36.38 32.99 2ba0 s VAL 162 CO -0.00 -0.04 -0.20 0.00 -3.33 0.00 0.00 175.10 171.52 2ba0 s ALA 163 N -3.90 2.24 0.01 1.54 0.00 -1.26 -0.80 121.76 119.59 2ba0 s ALA 163 Ca 0.11 -1.58 0.07 0.00 0.00 0.00 0.00 51.96 50.57 2ba0 s ALA 163 Cb -0.03 -0.23 -0.03 0.00 0.00 0.00 0.00 23.12 22.84 2ba0 s ALA 163 CO 0.02 0.29 -0.22 0.08 0.00 0.00 0.00 175.76 175.92 2ba0 s VAL 164 N -2.02 2.42 0.03 0.00 1.01 -0.82 -0.06 120.40 120.95 2ba0 s VAL 164 Ca 0.19 -1.15 0.00 0.00 0.00 0.00 0.00 61.98 61.02 2ba0 s VAL 164 Cb -0.06 -1.94 -0.00 0.00 0.00 0.00 0.00 36.38 34.38 2ba0 s VAL 164 CO 0.08 0.46 0.00 0.61 0.00 0.00 0.00 175.10 176.25 2ba0 n GLY 165 N 2.00 4.14 3.09 4.51 0.00 0.11 -0.46 105.19 118.57 2ba0 n GLY 165 Ca -0.16 -2.14 -0.09 0.00 0.00 0.00 0.00 46.02 43.63 2ba0 n GLY 165 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 2ba0 s LYS 166 N -2.09 0.33 -0.01 1.61 2.20 -0.90 -1.75 119.74 119.14 2ba0 s LYS 166 Ca 0.00 0.79 0.04 0.00 -0.36 0.00 0.00 55.97 56.44 2ba0 s LYS 166 Cb 0.00 -0.06 -0.01 0.00 -1.51 0.00 0.00 37.83 36.25 2ba0 s LYS 166 CO 0.00 -0.45 -0.12 0.00 -0.36 0.00 0.00 175.35 174.42 2ba0 s ALA 167 N 2.58 1.02 -1.50 3.13 0.00 -0.64 0.47 121.76 126.82 2ba0 s ALA 167 Ca 0.06 -0.54 -0.15 0.00 0.00 0.00 0.00 51.96 51.33 2ba0 s ALA 167 Cb -0.14 -0.25 0.12 0.00 0.00 0.00 0.00 23.12 22.85 2ba0 s ALA 167 CO -0.14 0.25 0.68 -0.25 0.00 0.00 0.00 175.76 176.29 2ba0 n ASP 168 N 2.74 -3.52 -1.16 0.00 10.43 -1.26 -0.21 116.55 123.57 2ba0 n ASP 168 Ca -0.14 -0.73 -0.13 0.00 2.57 0.00 0.00 54.79 56.35 2ba0 n ASP 168 Cb 0.56 -2.89 -0.04 0.00 1.84 0.00 0.00 41.12 40.59 2ba0 n ASP 168 CO 0.00 0.00 0.00 0.61 -1.07 0.00 0.00 177.20 176.74 2ba0 n GLY 169 N -1.30 0.88 2.96 0.44 0.00 -1.26 -5.01 105.19 101.90 2ba0 n GLY 169 Ca 0.04 -0.39 -0.21 0.00 0.00 0.00 0.00 46.02 45.46 2ba0 n GLY 169 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 2ba0 s GLN 170 N -3.61 1.11 0.22 1.61 2.00 0.71 -5.12 119.66 116.58 2ba0 s GLN 170 Ca 0.00 -0.25 -0.30 0.00 -2.00 0.00 0.00 55.36 52.81 2ba0 s GLN 170 Cb 0.00 -1.01 -0.09 0.00 0.80 0.00 0.00 33.01 32.71 2ba0 s GLN 170 CO 0.00 0.01 1.38 -0.51 -0.50 0.00 0.00 175.29 175.67 2ba0 s LEU 171 N 0.61 4.40 0.04 3.68 1.43 -1.26 -1.63 118.68 125.95 2ba0 s LEU 171 Ca -0.10 2.54 0.04 0.00 -1.03 0.00 0.00 54.13 55.58 2ba0 s LEU 171 Cb -0.13 -3.62 -0.02 0.00 0.03 0.00 0.00 46.19 42.45 2ba0 s LEU 171 CO 0.01 -0.62 -0.12 0.68 0.23 0.00 0.00 176.35 176.54 2ba0 s VAL 172 N 0.07 0.93 0.05 -1.59 -7.23 -0.71 -4.82 120.40 107.10 2ba0 s VAL 172 Ca 0.58 -0.94 -0.21 0.00 -1.81 0.00 0.00 61.98 59.60 2ba0 s VAL 172 Cb -0.39 -0.87 -0.06 0.00 0.56 0.00 0.00 36.38 35.62 2ba0 s VAL 172 CO 0.41 -0.06 0.62 -0.22 -0.31 0.00 0.00 175.10 175.54 2ba0 s LEU 173 N -1.13 4.48 -1.03 1.32 2.96 0.21 0.07 118.68 125.58 2ba0 s LEU 173 Ca -0.01 1.28 -0.15 0.00 -0.22 0.00 0.00 54.13 55.03 2ba0 s LEU 173 Cb -0.08 -2.98 -0.00 0.00 0.50 0.00 0.00 46.19 43.63 2ba0 s LEU 173 CO 0.01 0.17 0.74 -0.67 -1.32 0.00 0.00 176.35 175.28 2ba0 n ASP 174 N 2.22 -5.50 -4.67 3.68 4.64 0.91 -4.68 116.55 113.15 2ba0 n ASP 174 Ca -0.08 -0.90 -0.42 0.00 -1.38 0.00 0.00 54.79 52.01 2ba0 n ASP 174 Cb 0.51 -3.17 0.00 0.00 -1.04 0.00 0.00 41.12 37.42 2ba0 n ASP 174 CO 0.00 0.00 0.00 -0.81 -0.82 0.00 0.00 177.20 175.57 2ba0 n PRO 175 N -3.63 1.84 -2.34 -0.67 -0.04 -1.26 -4.75 135.00 124.15 2ba0 n PRO 175 Ca -0.12 0.65 -0.26 0.00 -0.04 0.00 0.00 63.50 63.72 2ba0 n PRO 175 Cb 0.60 -2.24 0.15 0.00 -0.04 0.00 0.00 33.50 31.97 2ba0 n PRO 175 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2ba0 s MET 176 N -1.97 1.15 0.08 0.54 0.23 -1.26 -4.65 119.30 113.42 2ba0 s MET 176 Ca 0.59 -0.91 -0.36 0.00 -1.03 0.00 0.00 55.69 53.98 2ba0 s MET 176 Cb -0.56 -2.13 -0.18 0.00 -1.53 0.00 0.00 34.83 30.42 2ba0 s MET 176 CO 0.60 -1.91 1.57 -0.22 -2.03 0.00 0.00 175.02 173.02 2ba0 h LYS 177 N -1.03 -1.07 -1.04 3.16 3.64 -1.95 -1.18 116.57 117.11 2ba0 h LYS 177 Ca -0.39 0.07 0.27 0.00 -1.27 0.00 0.00 60.65 59.33 2ba0 h LYS 177 Cb 1.25 0.24 -0.11 0.00 -0.41 0.00 0.00 32.23 33.20 2ba0 h LYS 177 CO 0.37 -0.71 0.65 0.93 -2.27 0.00 0.00 179.45 178.41 2ba0 h GLU 178 N -1.11 0.44 -0.21 1.90 3.07 -1.98 0.15 114.58 116.84 2ba0 h GLU 178 Ca -0.09 -0.03 -0.16 0.00 -0.50 0.00 0.00 59.36 58.59 2ba0 h GLU 178 Cb 0.92 -0.10 -0.01 0.00 -0.84 0.00 0.00 28.75 28.73 2ba0 h GLU 178 CO 0.04 0.29 -0.52 0.93 -1.40 0.00 0.00 179.01 178.35 2ba0 h GLU 179 N 0.45 0.60 0.00 2.33 5.08 -1.82 -1.75 114.58 119.47 2ba0 h GLU 179 Ca 0.63 -0.36 -0.15 0.00 -1.00 0.00 0.00 59.36 58.48 2ba0 h GLU 179 Cb 1.46 0.04 -0.02 0.00 0.50 0.00 0.00 28.75 30.72 2ba0 h GLU 179 CO -0.38 0.97 -0.72 0.22 -1.00 0.00 0.00 179.01 178.10 2ba0 h ASP 180 N 0.47 0.00 1.56 1.42 1.82 0.43 0.26 116.42 122.38 2ba0 h ASP 180 Ca 0.02 0.00 0.00 0.00 -0.39 0.00 0.00 57.03 56.66 2ba0 h ASP 180 Cb 1.06 0.00 0.00 0.00 0.68 0.00 0.00 39.33 41.07 2ba0 h ASP 180 CO 0.10 0.72 -0.28 0.78 -1.61 0.00 0.00 179.24 178.95 2ba0 h ASN 181 N 0.00 0.00 0.00 2.28 -0.26 -0.83 -3.37 115.58 113.40 2ba0 h ASN 181 Ca -0.01 -0.02 0.00 0.00 -0.56 0.00 0.00 56.30 55.71 2ba0 h ASN 181 Cb 1.30 0.00 0.00 0.00 -1.06 0.00 0.00 38.32 38.56 2ba0 h ASN 181 CO 0.09 0.01 0.00 0.49 -1.06 0.00 0.00 177.43 176.97 2ba0 n PHE 182 N -2.74 0.00 -0.62 1.19 3.01 -0.67 -5.08 117.46 112.56 2ba0 n PHE 182 Ca 0.03 0.00 -0.13 0.00 1.01 0.00 0.00 57.45 58.37 2ba0 n PHE 182 Cb 0.50 0.00 0.11 0.00 -0.01 0.00 0.00 39.48 40.08 2ba0 n PHE 182 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 2ba0 n GLY 183 N 0.19 -2.79 0.18 1.37 0.00 0.93 -4.94 105.19 100.13 2ba0 n GLY 183 Ca 0.00 -1.43 0.08 0.00 0.00 0.00 0.00 46.02 44.67 2ba0 n GLY 183 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 2ba0 n GLU 184 N -3.02 1.68 -3.59 1.61 4.71 0.18 -4.99 120.64 117.22 2ba0 n GLU 184 Ca 0.06 -0.39 -0.09 0.00 -0.01 0.00 0.00 57.16 56.73 2ba0 n GLU 184 Cb 0.25 -1.27 -0.05 0.00 -1.01 0.00 0.00 31.44 29.35 2ba0 n GLU 184 CO 0.00 0.00 0.00 0.00 0.09 0.00 0.00 177.13 177.22 2ba0 s ALA 185 N -2.25 -1.96 -0.05 0.62 0.00 -1.24 -2.01 121.76 114.87 2ba0 s ALA 185 Ca 0.10 1.63 0.00 0.00 0.00 0.00 0.00 51.96 53.69 2ba0 s ALA 185 Cb 0.13 -0.82 0.02 0.00 0.00 0.00 0.00 23.12 22.45 2ba0 s ALA 185 CO 0.55 -0.30 -0.03 0.34 0.00 0.00 0.00 175.76 176.31 2ba0 s ASP 186 N -1.11 1.07 -0.36 0.00 2.15 -0.54 -2.11 116.67 115.77 2ba0 s ASP 186 Ca -0.00 -0.12 0.00 0.00 0.43 0.00 0.00 52.55 52.86 2ba0 s ASP 186 Cb -0.01 -0.44 0.14 0.00 -0.30 0.00 0.00 42.92 42.31 2ba0 s ASP 186 CO 0.00 -0.09 0.21 -0.32 -0.17 0.00 0.00 175.17 174.81 2ba0 s MET 187 N 1.15 0.65 0.21 4.34 -2.45 0.39 -2.21 119.30 121.38 2ba0 s MET 187 Ca -0.07 -1.41 -0.30 0.00 -1.25 0.00 0.00 55.69 52.66 2ba0 s MET 187 Cb -0.14 -1.46 -0.08 0.00 1.25 0.00 0.00 34.83 34.40 2ba0 s MET 187 CO -0.01 -1.20 1.13 -1.25 1.05 0.00 0.00 175.02 174.74 2ba0 s PRO 188 N 0.99 4.58 0.22 4.11 0.04 -1.19 -1.95 135.00 141.80 2ba0 s PRO 188 Ca 0.18 1.79 0.09 0.00 0.04 0.00 0.00 61.00 63.09 2ba0 s PRO 188 Cb -0.23 -3.24 -0.05 0.00 0.04 0.00 0.00 34.50 31.02 2ba0 s PRO 188 CO 0.00 0.07 -0.15 -0.06 0.04 0.00 0.00 177.00 176.89 2ba0 s PHE 189 N -0.44 1.85 -0.10 0.56 0.40 0.02 -2.73 117.98 117.54 2ba0 s PHE 189 Ca 0.49 -0.52 -0.05 0.00 -0.60 0.00 0.00 56.93 56.25 2ba0 s PHE 189 Cb -0.31 -0.85 0.05 0.00 0.51 0.00 0.00 43.02 42.42 2ba0 s PHE 189 CO 0.37 0.44 0.22 0.00 0.70 0.00 0.00 175.22 176.95 2ba0 s ALA 190 N -2.87 -0.47 0.12 5.36 0.00 -0.21 -2.28 121.76 121.41 2ba0 s ALA 190 Ca 0.24 0.90 0.10 0.00 0.00 0.00 0.00 51.96 53.20 2ba0 s ALA 190 Cb -0.02 -0.68 -0.04 0.00 0.00 0.00 0.00 23.12 22.38 2ba0 s ALA 190 CO 0.09 -0.30 -0.24 -0.06 0.00 0.00 0.00 175.76 175.25 2ba0 s PHE 191 N 1.53 2.38 -0.17 0.00 0.40 0.28 -0.05 117.98 122.35 2ba0 s PHE 191 Ca -0.07 -0.34 -0.20 0.00 -0.60 0.00 0.00 56.93 55.72 2ba0 s PHE 191 Cb -0.11 -1.28 -0.03 0.00 0.51 0.00 0.00 43.02 42.11 2ba0 s PHE 191 CO -0.08 0.35 0.56 -1.17 0.70 0.00 0.00 175.22 175.58 2ba0 s LEU 192 N -2.07 4.19 -0.15 -0.37 2.96 0.06 -1.76 118.68 121.53 2ba0 s LEU 192 Ca 0.15 0.80 0.01 0.00 -0.22 0.00 0.00 54.13 54.87 2ba0 s LEU 192 Cb -0.10 -2.80 0.00 0.00 0.50 0.00 0.00 46.19 43.79 2ba0 s LEU 192 CO 0.07 -0.16 -0.17 -0.63 -1.32 0.00 0.00 176.35 174.14 2ba0 s ILE 193 N 1.43 2.48 -0.14 6.68 1.01 0.29 -1.03 121.20 131.93 2ba0 s ILE 193 Ca 0.27 -0.83 0.02 0.00 0.00 0.00 0.00 60.65 60.11 2ba0 s ILE 193 Cb -0.16 -2.03 0.00 0.00 0.01 0.00 0.00 42.46 40.28 2ba0 s ILE 193 CO 0.11 0.52 -0.20 -0.13 0.00 0.00 0.00 174.94 175.25 2ba0 s ARG 194 N 0.85 3.12 -1.45 2.79 0.52 -0.41 -2.65 118.95 121.72 2ba0 s ARG 194 Ca -0.05 -0.81 -0.01 0.00 -0.52 0.00 0.00 55.73 54.33 2ba0 s ARG 194 Cb -0.15 -2.49 0.00 0.00 0.52 0.00 0.00 34.95 32.83 2ba0 s ARG 194 CO -0.01 0.05 0.27 -1.71 0.02 0.00 0.00 175.30 173.91 2ba0 n ASN 195 N 3.93 -0.02 -0.34 0.23 5.15 -1.26 -1.06 115.26 121.89 2ba0 n ASN 195 Ca -0.19 -1.12 -0.04 0.00 -0.60 0.00 0.00 54.58 52.62 2ba0 n ASN 195 Cb 0.52 -2.46 -0.02 0.00 -0.53 0.00 0.00 39.78 37.29 2ba0 n ASN 195 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 2ba0 n GLY 196 N -2.21 0.66 3.17 8.20 0.00 -1.26 -5.01 105.19 108.73 2ba0 n GLY 196 Ca -0.31 -0.26 -0.24 0.00 0.00 0.00 0.00 46.02 45.22 2ba0 n GLY 196 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 2ba0 s LYS 197 N -1.79 1.26 -0.23 1.61 2.20 -0.22 -5.07 119.74 117.50 2ba0 s LYS 197 Ca 0.00 -0.72 -0.29 0.00 -0.36 0.00 0.00 55.97 54.60 2ba0 s LYS 197 Cb 0.00 -1.27 -0.01 0.00 -1.51 0.00 0.00 37.83 35.04 2ba0 s LYS 197 CO 0.00 0.34 1.29 0.42 -0.36 0.00 0.00 175.35 177.03 2ba0 s ILE 198 N -0.59 4.21 -0.14 5.43 1.09 -1.26 -1.28 121.20 128.65 2ba0 s ILE 198 Ca 0.06 1.41 -0.12 0.00 -1.10 0.00 0.00 60.65 60.90 2ba0 s ILE 198 Cb -0.07 -4.07 -0.09 0.00 -1.06 0.00 0.00 42.46 37.16 2ba0 s ILE 198 CO 0.00 -0.31 0.10 -0.33 -0.10 0.00 0.00 174.94 174.31 2ba0 h GLU 199 N 8.78 0.00 -3.05 2.79 4.39 -1.43 -3.48 114.58 122.59 2ba0 h GLU 199 Ca -0.26 0.00 0.02 0.00 0.34 0.00 0.00 59.36 59.45 2ba0 h GLU 199 Cb 1.10 0.00 -0.03 0.00 -0.10 0.00 0.00 28.75 29.72 2ba0 h GLU 199 CO 1.00 0.36 0.23 -1.54 -1.16 0.00 0.00 179.01 177.90 2ba0 s SER 200 N -5.99 -0.10 -0.08 1.42 1.04 -1.23 -5.02 113.70 103.75 2ba0 s SER 200 Ca -0.14 -0.90 -0.10 0.00 0.48 0.00 0.00 55.95 55.29 2ba0 s SER 200 Cb 0.01 0.78 -0.05 0.00 0.10 0.00 0.00 66.02 66.87 2ba0 s SER 200 CO 0.31 -1.51 0.23 0.27 0.98 0.00 0.00 173.24 173.52 2ba0 s ILE 201 N -3.12 5.34 -0.03 -1.02 -4.36 -1.26 -0.76 121.20 116.00 2ba0 s ILE 201 Ca 0.14 0.42 0.13 0.00 -0.26 0.00 0.00 60.65 61.08 2ba0 s ILE 201 Cb -0.05 -3.51 -0.19 0.00 1.25 0.00 0.00 42.46 39.95 2ba0 s ILE 201 CO 0.10 0.60 0.25 0.00 0.24 0.00 0.00 174.94 176.12 2ba0 n ALA 202 N 1.90 2.36 -3.67 2.27 0.00 0.93 -4.86 120.51 119.44 2ba0 n ALA 202 Ca -0.18 -0.39 -0.12 0.00 0.00 0.00 0.00 53.44 52.76 2ba0 n ALA 202 Cb 0.54 -0.38 -0.12 0.00 0.00 0.00 0.00 19.45 19.49 2ba0 n ALA 202 CO 0.00 0.00 0.00 -1.17 0.00 0.00 0.00 177.50 176.33 2ba0 s LEU 203 N -4.06 0.35 -0.14 0.00 0.20 -0.99 -4.36 118.68 109.68 2ba0 s LEU 203 Ca -0.05 0.61 -0.04 0.00 0.69 0.00 0.00 54.13 55.33 2ba0 s LEU 203 Cb 0.08 0.89 0.07 0.00 -0.43 0.00 0.00 46.19 46.79 2ba0 s LEU 203 CO 0.54 -0.17 0.25 -0.22 -0.29 0.00 0.00 176.35 176.46 2ba0 s LEU 204 N 1.19 -0.26 0.03 -0.68 0.20 -1.26 -1.04 118.68 116.85 2ba0 s LEU 204 Ca -0.09 0.42 0.00 0.00 0.69 0.00 0.00 54.13 55.16 2ba0 s LEU 204 Cb -0.09 0.63 -0.03 0.00 -0.43 0.00 0.00 46.19 46.27 2ba0 s LEU 204 CO -0.09 -0.26 -0.04 -1.10 -0.29 0.00 0.00 176.35 174.58 2ba0 s GLN 205 N 2.40 0.42 -0.28 1.98 -0.21 -1.10 -5.07 119.66 117.80 2ba0 s GLN 205 Ca 0.03 -0.78 -0.20 0.00 0.02 0.00 0.00 55.36 54.42 2ba0 s GLN 205 Cb -0.13 0.05 0.08 0.00 1.00 0.00 0.00 33.01 34.02 2ba0 s GLN 205 CO -0.09 -0.04 0.72 1.41 -2.12 0.00 0.00 175.29 175.17 2ba0 s MET 206 N -2.06 0.75 -0.04 2.91 1.75 -1.26 -3.17 119.30 118.18 2ba0 s MET 206 Ca -0.09 1.09 0.02 0.00 -1.25 0.00 0.00 55.69 55.46 2ba0 s MET 206 Cb -0.06 0.25 0.01 0.00 2.84 0.00 0.00 34.83 37.88 2ba0 s MET 206 CO -0.03 -0.12 -0.07 -0.51 -0.65 0.00 0.00 175.02 173.64 2ba0 s ASP 207 N 1.05 1.15 0.00 1.11 1.11 -0.94 -5.04 116.67 115.11 2ba0 s ASP 207 Ca -0.05 -0.17 0.00 0.00 0.18 0.00 0.00 52.55 52.50 2ba0 s ASP 207 Cb -0.05 -0.46 0.00 0.00 1.07 0.00 0.00 42.92 43.48 2ba0 s ASP 207 CO -0.11 0.00 0.00 0.61 1.18 0.00 0.00 175.17 176.86 2ba0 n GLY 208 N 3.72 0.17 3.03 0.21 0.00 -1.26 -1.47 105.19 109.58 2ba0 n GLY 208 Ca -0.22 -1.07 -0.11 0.00 0.00 0.00 0.00 46.02 44.61 2ba0 n GLY 208 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 2ba0 s ARG 209 N -2.00 0.26 0.05 1.61 3.52 -0.85 -4.99 118.95 116.55 2ba0 s ARG 209 Ca 0.00 0.71 -0.04 0.00 -0.13 0.00 0.00 55.73 56.27 2ba0 s ARG 209 Cb 0.00 -0.18 -0.02 0.00 -1.56 0.00 0.00 34.95 33.19 2ba0 s ARG 209 CO 0.00 -0.42 0.07 -1.64 -0.81 0.00 0.00 175.30 172.50 2ba0 s MET 210 N 2.51 0.64 0.34 5.12 -1.94 -1.26 -4.72 119.30 119.98 2ba0 s MET 210 Ca 0.04 -0.95 -0.01 0.00 -1.71 0.00 0.00 55.69 53.07 2ba0 s MET 210 Cb -0.13 0.24 -0.04 0.00 2.01 0.00 0.00 34.83 36.91 2ba0 s MET 210 CO -0.12 -0.15 0.56 0.95 -0.01 0.00 0.00 175.02 176.24 2ba0 s THR 211 N -3.26 5.08 0.29 2.05 -4.23 -1.26 -4.93 115.64 109.37 2ba0 s THR 211 Ca 0.01 -0.31 0.04 0.00 -1.18 0.00 0.00 61.69 60.24 2ba0 s THR 211 Cb 0.03 -3.83 0.28 0.00 1.34 0.00 0.00 72.50 70.32 2ba0 s THR 211 CO -0.08 -0.52 1.73 -0.09 -0.54 0.00 0.00 174.62 175.12 2ba0 h ARG 212 N 0.94 0.53 -0.21 3.99 1.12 -2.01 0.28 114.38 119.02 2ba0 h ARG 212 Ca -0.49 -0.03 -0.11 0.00 -1.11 0.00 0.00 59.98 58.24 2ba0 h ARG 212 Cb 1.21 -0.12 -0.01 0.00 -0.01 0.00 0.00 29.97 31.04 2ba0 h ARG 212 CO 0.63 0.35 -0.32 -0.44 -3.11 0.00 0.00 179.97 177.07 2ba0 h ASP 213 N 0.55 0.44 0.87 -3.80 5.19 -2.01 -2.91 116.42 114.74 2ba0 h ASP 213 Ca 0.55 -0.17 -0.12 0.00 -0.62 0.00 0.00 57.03 56.67 2ba0 h ASP 213 Cb 0.95 -0.12 -0.02 0.00 0.18 0.00 0.00 39.33 40.33 2ba0 h ASP 213 CO -0.45 0.74 -0.57 -0.33 -3.12 0.00 0.00 179.24 175.50 2ba0 h GLU 214 N 0.37 0.00 -0.25 3.56 5.08 -1.36 -2.77 114.58 119.21 2ba0 h GLU 214 Ca 0.05 0.00 -0.07 0.00 -1.00 0.00 0.00 59.36 58.34 2ba0 h GLU 214 Cb 0.75 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.99 2ba0 h GLU 214 CO 0.06 0.57 -0.11 0.28 -1.00 0.00 0.00 179.01 178.81 2ba0 h VAL 215 N 0.00 1.30 -0.39 3.13 2.07 -1.07 -0.97 116.25 120.31 2ba0 h VAL 215 Ca -0.01 -1.19 -0.02 0.00 0.82 0.00 0.00 66.70 66.31 2ba0 h VAL 215 Cb 1.17 1.53 -0.02 0.00 -1.52 0.00 0.00 31.29 32.45 2ba0 h VAL 215 CO 0.07 0.37 0.16 0.11 0.02 0.00 0.00 177.57 178.31 2ba0 h LYS 216 N 0.25 0.58 -0.77 1.57 1.57 -1.53 -1.81 116.57 116.43 2ba0 h LYS 216 Ca 0.06 -0.10 0.04 0.00 -1.87 0.00 0.00 60.65 58.77 2ba0 h LYS 216 Cb 0.61 -0.10 -0.05 0.00 0.08 0.00 0.00 32.23 32.78 2ba0 h LYS 216 CO 0.04 0.54 0.48 1.96 -0.57 0.00 0.00 179.45 181.90 2ba0 h GLN 217 N 0.49 0.91 -1.00 3.15 4.20 -1.46 -1.93 115.11 119.46 2ba0 h GLN 217 Ca 0.13 -0.05 0.08 0.00 0.06 0.00 0.00 58.65 58.86 2ba0 h GLN 217 Cb 0.17 -0.20 -0.07 0.00 0.30 0.00 0.00 27.48 27.68 2ba0 h GLN 217 CO -0.01 0.60 0.64 0.00 -0.67 0.00 0.00 178.83 179.39 2ba0 h ALA 218 N 1.33 1.41 -0.69 3.87 0.00 -0.64 0.26 119.26 124.80 2ba0 h ALA 218 Ca 0.31 -0.01 -0.06 0.00 0.00 0.00 0.00 54.91 55.15 2ba0 h ALA 218 Cb 0.04 -0.28 -0.03 0.00 0.00 0.00 0.00 17.79 17.52 2ba0 h ALA 218 CO -0.12 0.38 0.21 0.82 0.00 0.00 0.00 179.25 180.54 2ba0 h ILE 219 N 1.12 1.25 -0.22 0.00 2.04 -0.59 0.25 117.51 121.36 2ba0 h ILE 219 Ca 0.45 -0.88 -0.07 0.00 1.00 0.00 0.00 64.86 65.35 2ba0 h ILE 219 Cb 0.24 0.50 -0.00 0.00 -0.74 0.00 0.00 36.82 36.82 2ba0 h ILE 219 CO -0.20 0.34 -0.15 -0.33 0.00 0.00 0.00 178.15 177.82 2ba0 h GLU 220 N 1.02 0.48 -0.69 2.37 4.39 -0.54 0.56 114.58 122.18 2ba0 h GLU 220 Ca 0.22 -0.23 -0.03 0.00 0.34 0.00 0.00 59.36 59.67 2ba0 h GLU 220 Cb 0.30 -0.00 -0.03 0.00 -0.10 0.00 0.00 28.75 28.91 2ba0 h GLU 220 CO -0.01 0.79 0.32 1.25 -1.16 0.00 0.00 179.01 180.20 2ba0 h LEU 221 N 0.18 0.91 -0.18 1.33 6.46 -0.33 -2.13 115.31 121.56 2ba0 h LEU 221 Ca 0.04 -0.14 -0.00 0.00 -0.12 0.00 0.00 57.88 57.66 2ba0 h LEU 221 Cb 0.66 -0.24 -0.01 0.00 -0.73 0.00 0.00 40.66 40.35 2ba0 h LEU 221 CO 0.04 0.80 0.10 0.00 -0.62 0.00 0.00 178.44 178.76 2ba0 h ALA 222 N 1.15 0.23 -0.97 1.25 0.00 -0.38 -2.39 119.26 118.15 2ba0 h ALA 222 Ca 0.24 -0.06 0.08 0.00 0.00 0.00 0.00 54.91 55.17 2ba0 h ALA 222 Cb 0.14 -0.07 -0.07 0.00 0.00 0.00 0.00 17.79 17.79 2ba0 h ALA 222 CO -0.03 -0.23 0.63 0.87 0.00 0.00 0.00 179.25 180.49 2ba0 h LYS 223 N 0.18 1.04 -0.66 0.00 1.57 -0.64 0.10 116.57 118.17 2ba0 h LYS 223 Ca 0.06 -0.06 -0.08 0.00 -1.87 0.00 0.00 60.65 58.70 2ba0 h LYS 223 Cb 0.08 -0.23 -0.03 0.00 0.08 0.00 0.00 32.23 32.13 2ba0 h LYS 223 CO -0.01 0.69 0.11 -0.22 -0.57 0.00 0.00 179.45 179.44 2ba0 h LYS 224 N 1.07 1.09 -0.11 3.15 3.64 -1.06 -2.20 116.57 122.15 2ba0 h LYS 224 Ca 0.44 -0.29 -0.21 0.00 -1.27 0.00 0.00 60.65 59.33 2ba0 h LYS 224 Cb 0.28 -0.13 0.00 0.00 -0.41 0.00 0.00 32.23 31.98 2ba0 h LYS 224 CO -0.19 1.00 -0.77 0.78 -2.27 0.00 0.00 179.45 178.00 2ba0 h GLY 225 N 1.05 0.65 0.84 5.01 0.00 -0.87 -3.17 103.07 106.58 2ba0 h GLY 225 Ca 0.20 -0.93 0.02 0.00 0.00 0.00 0.00 47.33 46.61 2ba0 h GLY 225 CO 0.01 0.83 0.01 0.00 0.00 0.00 0.00 176.54 177.39 2ba0 h ALA 226 N 0.75 0.11 -0.96 3.60 0.00 -0.62 -1.64 119.26 120.49 2ba0 h ALA 226 Ca -0.04 0.03 0.06 0.00 0.00 0.00 0.00 54.91 54.95 2ba0 h ALA 226 Cb 1.37 0.04 -0.06 0.00 0.00 0.00 0.00 17.79 19.14 2ba0 h ALA 226 CO 0.14 -0.45 0.63 -0.07 0.00 0.00 0.00 179.25 179.50 2ba0 h LEU 227 N 0.05 1.01 -0.36 0.00 3.38 -1.46 0.23 115.31 118.15 2ba0 h LEU 227 Ca 0.05 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.03 2ba0 h LEU 227 Cb 0.06 -0.22 -0.02 0.00 0.09 0.00 0.00 40.66 40.57 2ba0 h LEU 227 CO -0.08 0.66 0.24 1.56 0.09 0.00 0.00 178.44 180.90 2ba0 h GLN 228 N 1.15 0.48 -0.16 1.13 4.20 -1.39 -1.63 115.11 118.89 2ba0 h GLN 228 Ca 0.40 -0.03 -0.08 0.00 0.06 0.00 0.00 58.65 59.00 2ba0 h GLN 228 Cb 0.12 -0.11 -0.01 0.00 0.30 0.00 0.00 27.48 27.78 2ba0 h GLN 228 CO -0.15 0.33 -0.27 0.82 -0.67 0.00 0.00 178.83 178.89 2ba0 h ILE 229 N 0.49 1.25 -0.86 2.54 2.04 -0.63 -2.66 117.51 119.69 2ba0 h ILE 229 Ca 0.13 -1.21 0.01 0.00 1.00 0.00 0.00 64.86 64.80 2ba0 h ILE 229 Cb -0.04 1.44 -0.04 0.00 -0.74 0.00 0.00 36.82 37.44 2ba0 h ILE 229 CO -0.03 0.37 0.57 0.22 0.00 0.00 0.00 178.15 179.28 2ba0 h TYR 230 N 0.26 1.08 0.00 1.37 3.20 0.33 -0.78 116.97 122.43 2ba0 h TYR 230 Ca 0.04 0.03 -0.09 0.00 3.14 0.00 0.00 58.73 61.84 2ba0 h TYR 230 Cb 0.62 -0.36 -0.01 0.00 1.54 0.00 0.00 36.73 38.52 2ba0 h TYR 230 CO 0.01 0.68 -0.45 0.93 -1.64 0.00 0.00 178.16 177.69 2ba0 h GLU 231 N 1.16 0.00 0.00 1.82 4.39 -1.01 -2.23 114.58 118.71 2ba0 h GLU 231 Ca 0.32 0.00 -0.16 0.00 0.34 0.00 0.00 59.36 59.85 2ba0 h GLU 231 Cb -0.13 0.00 -0.02 0.00 -0.10 0.00 0.00 28.75 28.50 2ba0 h GLU 231 CO -0.07 0.45 -0.77 0.52 -1.16 0.00 0.00 179.01 177.98 2ba0 h MET 232 N 0.00 0.00 -0.41 2.33 2.86 -1.15 -1.95 114.93 116.61 2ba0 h MET 232 Ca -0.00 0.00 -0.16 0.00 -2.06 0.00 0.00 59.70 57.48 2ba0 h MET 232 Cb 0.93 0.00 -0.01 0.00 0.06 0.00 0.00 31.60 32.58 2ba0 h MET 232 CO 0.06 0.77 -0.35 1.96 1.06 0.00 0.00 176.91 180.41 2ba0 h GLN 233 N 0.00 0.96 -0.03 1.72 4.20 -0.90 -2.00 115.11 119.06 2ba0 h GLN 233 Ca -0.01 -0.49 -0.00 0.00 0.06 0.00 0.00 58.65 58.21 2ba0 h GLN 233 Cb 1.41 0.01 -0.00 0.00 0.30 0.00 0.00 27.48 29.20 2ba0 h GLN 233 CO 0.10 1.15 0.01 0.00 -0.67 0.00 0.00 178.83 179.42 2ba0 h ARG 234 N 0.79 0.05 -0.77 1.46 3.08 -1.36 -2.26 114.38 115.37 2ba0 h ARG 234 Ca 0.07 -0.01 0.05 0.00 0.07 0.00 0.00 59.98 60.15 2ba0 h ARG 234 Cb 0.95 -0.01 -0.05 0.00 0.08 0.00 0.00 29.97 30.94 2ba0 h ARG 234 CO 0.09 0.27 0.48 1.49 -1.07 0.00 0.00 179.97 181.22 2ba0 h GLU 235 N -0.17 0.87 -0.40 0.04 4.22 -1.34 0.12 114.58 117.92 2ba0 h GLU 235 Ca 0.01 -0.05 -0.00 0.00 0.08 0.00 0.00 59.36 59.39 2ba0 h GLU 235 Cb 0.24 -0.20 -0.02 0.00 0.50 0.00 0.00 28.75 29.27 2ba0 h GLU 235 CO 0.00 0.58 0.24 0.00 -2.18 0.00 0.00 179.01 177.65 2ba0 h ALA 236 N 1.35 0.51 0.26 2.92 0.00 -1.28 -0.97 119.26 122.05 2ba0 h ALA 236 Ca 0.32 -0.06 -0.01 0.00 0.00 0.00 0.00 54.91 55.16 2ba0 h ALA 236 Cb 0.09 -0.16 0.00 0.00 0.00 0.00 0.00 17.79 17.72 2ba0 h ALA 236 CO -0.14 0.01 -0.12 0.82 0.00 0.00 0.00 179.25 179.81 2ba0 h ILE 237 N 0.53 0.77 -0.14 0.00 2.04 -0.90 -2.71 117.51 117.11 2ba0 h ILE 237 Ca 0.14 -0.68 0.02 0.00 1.00 0.00 0.00 64.86 65.35 2ba0 h ILE 237 Cb 0.01 1.13 -0.02 0.00 -0.74 0.00 0.00 36.82 37.20 2ba0 h ILE 237 CO -0.03 0.14 -0.01 -0.07 0.00 0.00 0.00 178.15 178.18 2ba0 h LEU 238 N -0.72 -0.07 -0.58 1.44 3.38 -1.01 -0.01 115.31 117.74 2ba0 h LEU 238 Ca -0.04 0.03 0.12 0.00 0.09 0.00 0.00 57.88 58.08 2ba0 h LEU 238 Cb 0.49 0.06 -0.11 0.00 0.09 0.00 0.00 40.66 41.18 2ba0 h LEU 238 CO 0.06 -0.01 -0.19 -0.09 0.09 0.00 0.00 178.44 178.29 2ba0 h ARG 239 N 0.04 -0.05 0.00 1.13 2.43 -1.24 0.20 114.38 116.89 2ba0 h ARG 239 Ca 0.06 0.00 -0.03 0.00 -0.81 0.00 0.00 59.98 59.21 2ba0 h ARG 239 Cb 0.08 0.01 -0.00 0.00 -0.42 0.00 0.00 29.97 29.64 2ba0 h ARG 239 CO -0.11 -0.03 -0.14 -0.09 -1.51 0.00 0.00 179.97 178.08 2ba0 h ARG 240 N -0.05 0.00 -0.01 0.20 9.65 -1.06 -3.27 114.38 119.83 2ba0 h ARG 240 Ca 0.27 0.00 0.00 0.00 -1.10 0.00 0.00 59.98 59.15 2ba0 h ARG 240 Cb 0.47 0.00 0.00 0.00 -1.39 0.00 0.00 29.97 29.05 2ba0 h ARG 240 CO -0.63 0.14 -0.25 0.66 2.80 0.00 0.00 179.97 182.69 2ba0 n TYR 241 N -3.40 0.00 -0.25 2.20 4.02 0.39 -4.63 117.16 115.48 2ba0 n TYR 241 Ca -0.01 0.00 0.05 0.00 -0.01 0.00 0.00 57.90 57.93 2ba0 n TYR 241 Cb 0.33 0.00 0.18 0.00 -0.02 0.00 0.00 39.34 39.83 2ba0 n TYR 241 CO 0.00 0.00 0.00 0.82 -1.01 0.00 0.00 176.86 176.67 2ba0 h ILE 242 N 1.79 0.65 0.42 -0.72 2.04 -0.80 -1.53 117.51 119.35 2ba0 h ILE 242 Ca 0.00 -0.14 -0.02 0.00 1.00 0.00 0.00 64.86 65.70 2ba0 h ILE 242 Cb 0.51 0.19 0.00 0.00 -0.74 0.00 0.00 36.82 36.78 2ba0 h ILE 242 CO 0.00 0.08 -0.20 -0.08 0.00 0.00 0.00 178.15 177.95 2ba0 h GLU 243 N 0.42 -0.54 -0.26 2.37 4.81 -1.83 -2.14 114.58 117.40 2ba0 h GLU 243 Ca 0.41 0.04 -0.05 0.00 -0.13 0.00 0.00 59.36 59.63 2ba0 h GLU 243 Cb 0.62 0.12 -0.01 0.00 0.63 0.00 0.00 28.75 30.10 2ba0 h GLU 243 CO -0.41 -0.28 -0.04 -0.39 -0.73 0.00 0.00 179.01 177.17 2ba0 h VAL 244 N -0.72 1.18 -0.47 0.32 -1.51 -1.83 -1.28 116.25 111.94 2ba0 h VAL 244 Ca -0.06 -0.73 0.03 0.00 -1.23 0.00 0.00 66.70 64.72 2ba0 h VAL 244 Cb 0.51 1.03 -0.04 0.00 -2.13 0.00 0.00 31.29 30.66 2ba0 h VAL 244 CO 0.09 0.24 0.25 1.23 -1.23 0.00 0.00 177.57 178.16 2ba0 h GLY 245 N 0.76 0.65 0.95 5.19 0.00 -1.19 0.18 103.07 109.60 2ba0 h GLY 245 Ca 0.08 -0.18 -0.03 0.00 0.00 0.00 0.00 47.33 47.20 2ba0 h GLY 245 CO 0.01 0.13 0.15 0.83 0.00 0.00 0.00 176.54 177.66 2ba0 h GLU 246 N 0.50 0.66 -0.30 4.80 5.08 -0.83 0.85 114.58 125.34 2ba0 h GLU 246 Ca 0.20 -0.13 0.02 0.00 -1.00 0.00 0.00 59.36 58.44 2ba0 h GLU 246 Cb 0.07 -0.10 -0.03 0.00 0.50 0.00 0.00 28.75 29.20 2ba0 h GLU 246 CO -0.12 0.63 0.14 1.49 -1.00 0.00 0.00 179.01 180.15 2ba0 h GLU 247 N 0.55 0.29 -0.57 2.33 4.81 -0.70 0.27 114.58 121.57 2ba0 h GLU 247 Ca 0.14 -0.02 -0.02 0.00 -0.13 0.00 0.00 59.36 59.33 2ba0 h GLU 247 Cb 0.24 -0.07 -0.03 0.00 0.63 0.00 0.00 28.75 29.53 2ba0 h GLU 247 CO -0.01 0.19 0.27 1.98 -0.73 0.00 0.00 179.01 180.72 2ba0 h MET 248 N 0.30 0.81 -0.85 1.92 4.05 -0.39 -0.32 114.93 120.45 2ba0 h MET 248 Ca 0.13 -0.12 0.02 0.00 -0.28 0.00 0.00 59.70 59.45 2ba0 h MET 248 Cb 0.06 -0.15 -0.05 0.00 -0.80 0.00 0.00 31.60 30.66 2ba0 h MET 248 CO -0.10 0.66 0.55 0.22 0.23 0.00 0.00 176.91 178.48 2ba0 h ASP 249 N 0.77 0.93 0.21 1.39 3.58 -0.16 0.32 116.42 123.46 2ba0 h ASP 249 Ca 0.19 -0.01 -0.01 0.00 0.42 0.00 0.00 57.03 57.62 2ba0 h ASP 249 Cb 0.11 -0.22 0.00 0.00 1.72 0.00 0.00 39.33 40.95 2ba0 h ASP 249 CO -0.02 0.65 -0.10 -0.08 -2.88 0.00 0.00 179.24 176.81 2ba0 h GLU 250 N 1.09 -0.27 -0.46 0.28 4.57 0.08 -3.23 114.58 116.64 2ba0 h GLU 250 Ca 0.33 0.02 0.00 0.00 -1.18 0.00 0.00 59.36 58.53 2ba0 h GLU 250 Cb -0.04 0.06 -0.02 0.00 -0.16 0.00 0.00 28.75 28.59 2ba0 h GLU 250 CO -0.10 -0.04 0.30 0.82 -1.18 0.00 0.00 179.01 178.81 2ba0 h ILE 251 N -0.47 1.13 -0.01 2.32 2.04 -0.71 -3.51 117.51 118.31 2ba0 h ILE 251 Ca -0.03 -0.27 0.00 0.00 1.00 0.00 0.00 64.86 65.56 2ba0 h ILE 251 Cb 0.36 0.48 0.00 0.00 -0.74 0.00 0.00 36.82 36.91 2ba0 h ILE 251 CO 0.05 0.13 0.00 0.41 0.00 0.00 0.00 178.15 178.74