#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2q42 s GLN 2 N 0.00 2.73 -0.44 2.12 -0.21 0.12 -4.92 119.66 119.05 2q42 s GLN 2 Ca 0.00 -1.72 -0.26 0.00 0.02 0.00 0.00 55.36 53.40 2q42 s GLN 2 Cb 0.00 -4.09 0.02 0.00 1.00 0.00 0.00 33.01 29.94 2q42 s GLN 2 CO 0.00 -1.24 0.96 0.42 -2.12 0.00 0.00 175.29 173.30 2q42 s ILE 3 N 1.48 4.47 -0.44 1.08 1.01 -1.26 -1.39 121.20 126.14 2q42 s ILE 3 Ca 0.04 0.95 -0.16 0.00 0.00 0.00 0.00 60.65 61.48 2q42 s ILE 3 Cb -0.28 -4.43 0.04 0.00 0.01 0.00 0.00 42.46 37.81 2q42 s ILE 3 CO 0.01 -0.77 0.40 -0.70 0.00 0.00 0.00 174.94 173.88 2q42 s GLU 4 N 3.77 3.02 -0.02 2.79 2.12 0.69 -4.95 118.70 126.12 2q42 s GLU 4 Ca 0.39 -1.06 -0.30 0.00 0.36 0.00 0.00 54.97 54.36 2q42 s GLU 4 Cb -0.10 -4.04 -0.04 0.00 0.26 0.00 0.00 34.13 30.20 2q42 s GLU 4 CO 0.25 -0.92 1.27 -1.17 -0.54 0.00 0.00 175.26 174.15 2q42 s LEU 5 N 1.87 4.30 -0.18 2.70 0.20 -1.26 -0.98 118.68 125.33 2q42 s LEU 5 Ca 0.07 1.94 0.01 0.00 0.69 0.00 0.00 54.13 56.84 2q42 s LEU 5 Cb -0.20 -3.56 0.02 0.00 -0.43 0.00 0.00 46.19 42.02 2q42 s LEU 5 CO 0.10 -0.62 -0.19 -0.69 -0.29 0.00 0.00 176.35 174.66 2q42 s VAL 6 N 2.14 2.11 0.31 1.68 1.01 -0.26 -4.96 120.40 122.42 2q42 s VAL 6 Ca 0.59 -0.95 -0.25 0.00 0.00 0.00 0.00 61.98 61.37 2q42 s VAL 6 Cb -0.28 -1.90 -0.10 0.00 0.00 0.00 0.00 36.38 34.11 2q42 s VAL 6 CO 0.24 0.52 0.91 -2.84 0.00 0.00 0.00 175.10 173.92 2q42 s PRO 7 N 1.29 4.52 0.03 2.72 0.02 -1.26 -1.37 135.00 140.94 2q42 s PRO 7 Ca 0.05 1.25 0.00 0.00 0.02 0.00 0.00 61.00 62.31 2q42 s PRO 7 Cb -0.13 -2.80 -0.02 0.00 0.02 0.00 0.00 34.50 31.56 2q42 s PRO 7 CO -0.12 0.29 -0.04 0.00 -0.33 0.00 0.00 177.00 176.80 2q42 n LEU 9 N 1.44 0.00 0.03 0.00 4.77 -1.26 -1.29 117.00 120.69 2q42 n LEU 9 Ca -0.23 0.00 -0.18 0.00 -0.03 0.00 0.00 56.01 55.57 2q42 n LEU 9 Cb 0.55 0.00 -0.14 0.00 -2.33 0.00 0.00 43.42 41.50 2q42 n LEU 9 CO 0.21 0.00 -0.61 0.50 -1.33 0.00 0.00 177.39 176.16 2q42 h LYS 10 N 0.00 0.24 0.00 3.23 3.64 -2.02 -3.44 116.57 118.22 2q42 h LYS 10 Ca 0.00 -0.41 0.00 0.00 -1.27 0.00 0.00 60.65 58.97 2q42 h LYS 10 Cb 0.00 0.15 0.00 0.00 -0.41 0.00 0.00 32.23 31.97 2q42 h LYS 10 CO 0.00 1.09 0.00 -0.40 -2.27 0.00 0.00 179.45 177.87 2q42 n ASP 11 N -3.42 0.00 -4.75 4.20 5.68 -1.16 -5.00 116.55 112.10 2q42 n ASP 11 Ca -0.25 -1.00 -0.36 0.00 -0.50 0.00 0.00 54.79 52.69 2q42 n ASP 11 Cb 1.05 0.00 0.05 0.00 -1.14 0.00 0.00 41.12 41.08 2q42 n ASP 11 CO 0.00 0.00 0.00 0.20 -1.33 0.00 0.00 177.20 176.07 2q42 s ASN 12 N 0.00 4.93 -0.17 -1.12 -0.87 -0.41 -2.13 114.94 115.17 2q42 s ASN 12 Ca 0.00 2.42 0.00 0.00 -1.57 0.00 0.00 52.86 53.71 2q42 s ASN 12 Cb 0.00 -2.60 0.01 0.00 -0.02 0.00 0.00 41.25 38.64 2q42 s ASN 12 CO 0.00 -1.77 -0.16 -0.31 -2.57 0.00 0.00 177.10 172.29 2q42 s TYR 13 N -1.63 2.80 0.19 2.20 2.02 -1.26 -0.69 117.35 120.97 2q42 s TYR 13 Ca 0.78 -1.30 0.05 0.00 -0.37 0.00 0.00 57.07 56.23 2q42 s TYR 13 Cb -0.31 -1.93 -0.04 0.00 -0.40 0.00 0.00 41.96 39.28 2q42 s TYR 13 CO 0.36 -0.64 0.22 0.00 -1.57 0.00 0.00 175.55 173.93 2q42 s ALA 14 N 1.12 3.73 -0.08 3.71 0.00 -0.47 -4.63 121.76 125.13 2q42 s ALA 14 Ca 0.01 -1.21 0.02 0.00 0.00 0.00 0.00 51.96 50.77 2q42 s ALA 14 Cb -0.14 -1.51 0.02 0.00 0.00 0.00 0.00 23.12 21.48 2q42 s ALA 14 CO -0.06 0.42 -0.11 0.71 0.00 0.00 0.00 175.76 176.72 2q42 s TYR 15 N -1.86 1.52 -0.22 0.00 2.02 -0.08 -1.10 117.35 117.63 2q42 s TYR 15 Ca 0.33 -0.63 -0.16 0.00 -0.37 0.00 0.00 57.07 56.24 2q42 s TYR 15 Cb -0.10 -1.15 -0.04 0.00 -0.40 0.00 0.00 41.96 40.28 2q42 s TYR 15 CO 0.26 -0.36 0.41 0.42 -1.57 0.00 0.00 175.55 174.71 2q42 s ILE 16 N 0.95 5.18 -0.31 2.71 1.01 -0.15 0.00 121.20 130.59 2q42 s ILE 16 Ca -0.09 0.70 -0.09 0.00 0.00 0.00 0.00 60.65 61.17 2q42 s ILE 16 Cb -0.15 -3.73 -0.00 0.00 0.01 0.00 0.00 42.46 38.58 2q42 s ILE 16 CO 0.00 0.21 0.13 -0.76 0.00 0.00 0.00 174.94 174.53 2q42 s LEU 17 N 1.59 4.05 -0.35 2.97 1.43 0.09 -0.22 118.68 128.25 2q42 s LEU 17 Ca 0.18 -0.57 -0.12 0.00 -1.03 0.00 0.00 54.13 52.59 2q42 s LEU 17 Cb -0.15 -1.97 -0.01 0.00 0.03 0.00 0.00 46.19 44.09 2q42 s LEU 17 CO 0.08 -0.19 0.23 -1.00 0.23 0.00 0.00 176.35 175.70 2q42 s HIS 18 N 1.59 3.22 1.08 0.29 3.76 -0.49 -0.49 115.29 124.25 2q42 s HIS 18 Ca 0.04 -0.35 -0.12 0.00 -0.15 0.00 0.00 55.06 54.48 2q42 s HIS 18 Cb -0.17 -2.47 0.24 0.00 1.11 0.00 0.00 32.58 31.29 2q42 s HIS 18 CO 0.05 -0.42 1.07 0.34 -0.85 0.00 0.00 174.74 174.93 2q42 s ASP 19 N 1.69 1.64 -0.23 1.40 2.15 0.10 -0.71 116.67 122.72 2q42 s ASP 19 Ca 0.05 1.75 0.07 0.00 0.43 0.00 0.00 52.55 54.85 2q42 s ASP 19 Cb -0.18 -2.40 -0.20 0.00 -0.30 0.00 0.00 42.92 39.85 2q42 s ASP 19 CO 0.10 -3.83 -0.09 -0.62 -0.17 0.00 0.00 175.17 170.56 2q42 n GLU 20 N -4.69 0.67 -0.03 4.34 -0.58 -1.26 -3.84 120.64 115.25 2q42 n GLU 20 Ca 0.06 0.11 -0.20 0.00 -0.42 0.00 0.00 57.16 56.71 2q42 n GLU 20 Cb 0.53 -1.54 -0.13 0.00 -0.57 0.00 0.00 31.44 29.74 2q42 n GLU 20 CO 0.00 0.00 0.00 -0.44 -0.48 0.00 0.00 177.13 176.21 2q42 h ASP 21 N 0.00 0.23 -0.02 1.62 5.19 -1.97 -3.39 116.42 118.08 2q42 h ASP 21 Ca -0.56 -0.81 0.00 0.00 -0.62 0.00 0.00 57.03 55.05 2q42 h ASP 21 Cb 2.01 -0.08 0.00 0.00 0.18 0.00 0.00 39.33 41.45 2q42 h ASP 21 CO -0.04 1.47 -0.15 0.35 -3.12 0.00 0.00 179.24 177.75 2q42 n THR 22 N -4.17 0.00 -0.69 0.35 -2.24 -1.26 -4.93 114.28 101.34 2q42 n THR 22 Ca -0.23 -0.43 0.00 0.00 -2.27 0.00 0.00 64.05 61.12 2q42 n THR 22 Cb 0.77 1.34 0.00 0.00 -2.10 0.00 0.00 70.33 70.35 2q42 n THR 22 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2q42 n GLY 23 N 1.18 0.74 3.62 3.38 0.00 -1.25 -4.91 105.19 107.94 2q42 n GLY 23 Ca 0.10 0.00 -0.45 0.00 0.00 0.00 0.00 46.02 45.67 2q42 n GLY 23 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 2q42 n THR 24 N -2.00 1.45 -5.18 2.61 -1.04 -1.26 -4.59 114.28 104.27 2q42 n THR 24 Ca 0.00 -0.36 -0.30 0.00 -2.04 0.00 0.00 64.05 61.34 2q42 n THR 24 Cb 0.00 -1.13 -0.16 0.00 -1.82 0.00 0.00 70.33 67.21 2q42 n THR 24 CO 0.00 0.00 0.00 -0.69 -0.64 0.00 0.00 175.07 173.74 2q42 s VAL 25 N -0.59 1.93 -0.14 12.58 1.01 -1.26 0.02 120.40 133.95 2q42 s VAL 25 Ca 0.64 -1.00 -0.00 0.00 0.00 0.00 0.00 61.98 61.62 2q42 s VAL 25 Cb -0.71 -1.63 0.03 0.00 0.00 0.00 0.00 36.38 34.06 2q42 s VAL 25 CO 0.56 0.54 -0.10 -0.83 0.00 0.00 0.00 175.10 175.26 2q42 s GLY 26 N -0.15 1.00 -0.09 4.51 0.00 0.36 -2.24 107.32 110.71 2q42 s GLY 26 Ca -0.03 -0.78 -0.13 0.00 0.00 0.00 0.00 44.72 43.78 2q42 s GLY 26 CO 0.03 0.70 0.31 0.54 0.00 0.00 0.00 173.10 174.68 2q42 s VAL 27 N 1.58 5.24 -0.23 1.40 0.11 0.05 -0.73 120.40 127.82 2q42 s VAL 27 Ca 0.04 0.61 -0.07 0.00 -2.93 0.00 0.00 61.98 59.62 2q42 s VAL 27 Cb -0.13 -3.62 -0.03 0.00 -1.53 0.00 0.00 36.38 31.07 2q42 s VAL 27 CO -0.09 0.51 0.06 -0.69 -3.33 0.00 0.00 175.10 171.56 2q42 s VAL 28 N -0.43 4.39 -0.91 2.04 1.01 0.10 -0.41 120.40 126.19 2q42 s VAL 28 Ca 0.19 -0.15 -0.03 0.00 0.00 0.00 0.00 61.98 61.99 2q42 s VAL 28 Cb -0.14 -3.03 -0.04 0.00 0.00 0.00 0.00 36.38 33.17 2q42 s VAL 28 CO 0.08 0.37 0.78 0.47 0.00 0.00 0.00 175.10 176.80 2q42 n ASP 29 N 4.55 -4.50 -4.56 3.32 9.92 0.26 -0.90 116.55 124.65 2q42 n ASP 29 Ca -0.16 -0.56 -0.39 0.00 -0.53 0.00 0.00 54.79 53.15 2q42 n ASP 29 Cb 0.52 -4.38 -0.03 0.00 -0.64 0.00 0.00 41.12 36.59 2q42 n ASP 29 CO 0.00 0.00 0.00 -2.16 0.13 0.00 0.00 177.20 175.17 2q42 s PRO 30 N -4.50 2.62 0.33 -0.24 0.04 -1.05 -4.18 135.00 128.04 2q42 s PRO 30 Ca 0.25 0.81 0.03 0.00 0.04 0.00 0.00 61.00 62.12 2q42 s PRO 30 Cb -0.03 -4.40 0.58 0.00 0.04 0.00 0.00 34.50 30.70 2q42 s PRO 30 CO 0.61 -2.72 1.89 0.77 0.04 0.00 0.00 177.00 177.59 2q42 h SER 31 N 15.40 0.57 -4.51 6.66 0.02 -1.70 0.09 113.55 130.08 2q42 h SER 31 Ca -0.26 -0.09 -0.12 0.00 -0.84 0.00 0.00 61.79 60.48 2q42 h SER 31 Cb 1.18 -0.15 -0.22 0.00 0.14 0.00 0.00 62.40 63.35 2q42 h SER 31 CO 1.19 0.58 -0.25 -1.83 -1.14 0.00 0.00 176.83 175.39 2q42 s GLU 32 N -5.13 0.60 0.05 3.45 -1.05 -1.26 -3.00 118.70 112.36 2q42 s GLU 32 Ca -0.08 0.14 -0.32 0.00 -0.15 0.00 0.00 54.97 54.56 2q42 s GLU 32 Cb 0.16 0.27 -0.18 0.00 -0.44 0.00 0.00 34.13 33.94 2q42 s GLU 32 CO 0.77 -0.14 1.46 0.00 0.95 0.00 0.00 175.26 178.30 2q42 h ALA 33 N 4.53 -0.93 -0.93 -0.84 0.00 -1.83 -3.36 119.26 115.90 2q42 h ALA 33 Ca -0.28 -0.22 0.19 0.00 0.00 0.00 0.00 54.91 54.60 2q42 h ALA 33 Cb 1.18 0.36 -0.18 0.00 0.00 0.00 0.00 17.79 19.15 2q42 h ALA 33 CO 0.34 -0.97 -0.23 0.93 0.00 0.00 0.00 179.25 179.32 2q42 h GLU 34 N -1.04 -0.00 -0.39 0.00 5.08 -1.99 0.39 114.58 116.64 2q42 h GLU 34 Ca -0.10 0.00 0.08 0.00 -1.00 0.00 0.00 59.36 58.34 2q42 h GLU 34 Cb 0.74 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 29.97 2q42 h GLU 34 CO 0.16 -0.00 0.27 -1.35 -1.00 0.00 0.00 179.01 177.09 2q42 h PRO 35 N -0.00 0.18 0.17 2.33 0.11 -1.96 -0.78 132.00 132.05 2q42 h PRO 35 Ca 0.45 -0.01 -0.25 0.00 0.11 0.00 0.00 66.00 66.29 2q42 h PRO 35 Cb 0.68 -0.04 0.02 0.00 0.11 0.00 0.00 31.00 31.77 2q42 h PRO 35 CO -0.96 0.12 -1.14 0.82 -0.21 0.00 0.00 178.00 176.63 2q42 h ILE 36 N 0.19 1.35 -0.73 4.15 1.08 -0.41 -3.27 117.51 119.87 2q42 h ILE 36 Ca 0.18 -2.56 0.06 0.00 -0.39 0.00 0.00 64.86 62.15 2q42 h ILE 36 Cb 0.47 3.07 -0.06 0.00 -3.07 0.00 0.00 36.82 37.23 2q42 h ILE 36 CO -0.03 0.75 0.42 0.40 -0.69 0.00 0.00 178.15 179.00 2q42 h ILE 37 N -0.19 0.99 -0.52 -0.67 2.04 -0.89 -1.54 117.51 116.72 2q42 h ILE 37 Ca -0.21 -0.27 0.09 0.00 1.00 0.00 0.00 64.86 65.48 2q42 h ILE 37 Cb 1.83 0.15 -0.08 0.00 -0.74 0.00 0.00 36.82 37.98 2q42 h ILE 37 CO 0.17 0.14 0.09 -0.78 0.00 0.00 0.00 178.15 177.77 2q42 h ASP 38 N 0.77 -0.04 -0.18 1.72 -0.00 -1.25 -1.29 116.42 116.16 2q42 h ASP 38 Ca 0.33 0.10 -0.02 0.00 -0.00 0.00 0.00 57.03 57.44 2q42 h ASP 38 Cb 0.19 0.15 -0.01 0.00 -0.00 0.00 0.00 39.33 39.66 2q42 h ASP 38 CO -0.18 0.00 0.03 -1.28 -0.00 0.00 0.00 179.24 177.81 2q42 h SER 39 N 0.22 0.28 -0.63 2.28 0.87 -1.44 -2.96 113.55 112.17 2q42 h SER 39 Ca 0.27 -0.26 0.10 0.00 -1.23 0.00 0.00 61.79 60.67 2q42 h SER 39 Cb 0.38 -0.07 -0.04 0.00 -0.44 0.00 0.00 62.40 62.22 2q42 h SER 39 CO -0.36 0.46 0.42 -0.07 -0.53 0.00 0.00 176.83 176.75 2q42 h LEU 40 N 0.08 0.39 -1.25 2.23 3.38 -0.98 0.59 115.31 119.75 2q42 h LEU 40 Ca 0.05 0.01 -0.07 0.00 0.09 0.00 0.00 57.88 57.96 2q42 h LEU 40 Cb 0.30 -0.07 -0.01 0.00 0.09 0.00 0.00 40.66 40.97 2q42 h LEU 40 CO 0.00 0.23 -0.26 0.11 0.09 0.00 0.00 178.44 178.62 2q42 h LYS 41 N 0.43 0.19 0.01 1.13 1.79 -1.08 -1.16 116.57 117.88 2q42 h LYS 41 Ca 0.29 -0.06 -0.24 0.00 -2.18 0.00 0.00 60.65 58.46 2q42 h LYS 41 Cb 0.56 -0.02 0.01 0.00 -1.58 0.00 0.00 32.23 31.20 2q42 h LYS 41 CO -0.08 0.44 -0.99 -0.09 -1.08 0.00 0.00 179.45 177.65 2q42 h ARG 42 N 0.17 0.48 0.00 3.15 1.12 -0.83 -3.17 114.38 115.29 2q42 h ARG 42 Ca 0.03 -0.53 -0.06 0.00 -1.11 0.00 0.00 59.98 58.31 2q42 h ARG 42 Cb 0.55 0.15 -0.01 0.00 -0.01 0.00 0.00 29.97 30.66 2q42 h ARG 42 CO 0.04 1.17 -0.30 0.77 -3.11 0.00 0.00 179.97 178.53 2q42 h SER 43 N 0.26 0.00 -0.19 -3.80 0.02 -1.24 -3.47 113.55 105.13 2q42 h SER 43 Ca -0.10 0.00 -0.08 0.00 -0.84 0.00 0.00 61.79 60.77 2q42 h SER 43 Cb 1.63 0.00 -0.03 0.00 0.14 0.00 0.00 62.40 64.14 2q42 h SER 43 CO 0.18 0.30 -0.08 0.61 -1.14 0.00 0.00 176.83 176.71 2q42 n GLY 44 N 0.59 0.69 3.75 -3.77 0.00 -0.47 -5.04 105.19 100.94 2q42 n GLY 44 Ca 0.01 -0.75 -0.23 0.00 0.00 0.00 0.00 46.02 45.05 2q42 n GLY 44 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2q42 s ARG 45 N -2.15 2.41 0.36 1.61 0.52 -1.02 -5.04 118.95 115.64 2q42 s ARG 45 Ca 0.00 -1.53 0.08 0.00 -0.52 0.00 0.00 55.73 53.75 2q42 s ARG 45 Cb 0.00 -2.20 -0.02 0.00 0.52 0.00 0.00 34.95 33.24 2q42 s ARG 45 CO 0.00 0.09 0.33 -0.80 0.02 0.00 0.00 175.30 174.94 2q42 s ASN 46 N -3.87 5.22 -0.19 0.23 0.02 -1.26 -4.65 114.94 110.44 2q42 s ASN 46 Ca 0.38 -0.57 -0.14 0.00 -1.02 0.00 0.00 52.86 51.51 2q42 s ASN 46 Cb -0.03 -0.84 -0.04 0.00 0.02 0.00 0.00 41.25 40.36 2q42 s ASN 46 CO 0.23 -0.46 0.33 -0.22 0.02 0.00 0.00 177.10 177.00 2q42 s LEU 47 N -4.05 4.19 -0.20 0.60 2.96 -1.26 -4.56 118.68 116.36 2q42 s LEU 47 Ca 0.44 0.48 0.04 0.00 -0.22 0.00 0.00 54.13 54.86 2q42 s LEU 47 Cb -0.05 -2.41 -0.21 0.00 0.50 0.00 0.00 46.19 44.01 2q42 s LEU 47 CO 0.27 0.02 0.05 0.41 -1.32 0.00 0.00 176.35 175.78 2q42 n THR 48 N 3.98 1.55 -4.08 3.68 -1.04 -0.95 -4.05 114.28 113.37 2q42 n THR 48 Ca -0.11 -0.67 -0.14 0.00 -2.04 0.00 0.00 64.05 61.10 2q42 n THR 48 Cb 0.52 -1.27 -0.13 0.00 -1.82 0.00 0.00 70.33 67.62 2q42 n THR 48 CO 0.00 0.00 0.00 -0.31 -0.64 0.00 0.00 175.07 174.12 2q42 s TYR 49 N -2.53 0.44 -0.10 -1.42 2.02 -1.08 -1.91 117.35 112.76 2q42 s TYR 49 Ca -0.24 -0.20 0.02 0.00 -0.37 0.00 0.00 57.07 56.27 2q42 s TYR 49 Cb 0.08 -0.28 -0.01 0.00 -0.40 0.00 0.00 41.96 41.35 2q42 s TYR 49 CO 0.71 -0.04 -0.18 0.42 -1.57 0.00 0.00 175.55 174.89 2q42 s ILE 50 N -0.50 2.63 -0.05 2.71 1.01 -0.54 -0.77 121.20 125.68 2q42 s ILE 50 Ca -0.02 -0.83 0.04 0.00 0.00 0.00 0.00 60.65 59.84 2q42 s ILE 50 Cb -0.04 -2.05 -0.00 0.00 0.01 0.00 0.00 42.46 40.37 2q42 s ILE 50 CO -0.00 0.55 -0.18 -0.76 0.00 0.00 0.00 174.94 174.54 2q42 s LEU 51 N 0.18 1.93 -0.10 2.97 1.02 0.45 0.09 118.68 125.21 2q42 s LEU 51 Ca -0.10 -0.38 0.04 0.00 0.02 0.00 0.00 54.13 53.70 2q42 s LEU 51 Cb -0.16 -1.05 -0.00 0.00 0.02 0.00 0.00 46.19 45.00 2q42 s LEU 51 CO 0.06 0.16 -0.22 0.20 0.02 0.00 0.00 176.35 176.57 2q42 s ASN 52 N 0.07 3.25 0.16 2.29 -0.87 -1.09 -0.57 114.94 118.18 2q42 s ASN 52 Ca -0.05 -0.51 0.08 0.00 -1.57 0.00 0.00 52.86 50.80 2q42 s ASN 52 Cb -0.12 -1.36 -0.06 0.00 -0.02 0.00 0.00 41.25 39.69 2q42 s ASN 52 CO 0.03 0.18 1.37 0.71 -2.57 0.00 0.00 177.10 176.81 2q42 h THR 53 N 5.55 1.64 -2.64 1.60 1.35 -1.92 -3.42 112.91 115.08 2q42 h THR 53 Ca -0.22 -3.08 0.09 0.00 -0.55 0.00 0.00 66.41 62.65 2q42 h THR 53 Cb 1.23 2.66 -0.01 0.00 -1.73 0.00 0.00 68.15 70.29 2q42 h THR 53 CO 0.48 0.88 0.45 0.00 -0.25 0.00 0.00 175.52 177.08 2q42 n HIS 54 N -3.47 -1.64 0.33 4.73 1.44 -1.26 -0.49 115.22 114.86 2q42 n HIS 54 Ca -0.00 -1.37 0.12 0.00 -2.01 0.00 0.00 57.72 54.45 2q42 n HIS 54 Cb 0.85 0.68 0.13 0.00 0.12 0.00 0.00 29.99 31.77 2q42 n HIS 54 CO 0.00 0.00 0.00 1.12 -2.81 0.00 0.00 176.34 174.65 2q42 h HIS 55 N 1.92 0.00 -3.02 -1.40 -0.00 -1.93 -3.43 115.15 107.28 2q42 h HIS 55 Ca -0.27 0.00 -0.57 0.00 -0.00 0.00 0.00 60.37 59.52 2q42 h HIS 55 Cb 1.12 0.00 0.18 0.00 -0.00 0.00 0.00 27.41 28.71 2q42 h HIS 55 CO 0.00 0.00 -0.44 0.72 -0.00 0.00 0.00 177.93 178.21 2q42 n HIS 56 N -2.52 -0.87 0.15 6.12 8.25 -1.26 -4.63 115.22 120.45 2q42 n HIS 56 Ca 0.02 0.40 0.05 0.00 -0.26 0.00 0.00 57.72 57.93 2q42 n HIS 56 Cb 0.50 -1.92 0.48 0.00 1.12 0.00 0.00 29.99 30.17 2q42 n HIS 56 CO 0.00 0.00 0.00 -0.92 0.64 0.00 0.00 176.34 176.06 2q42 h TYR 57 N -0.03 0.19 0.00 4.41 3.20 -1.96 -1.81 116.97 120.97 2q42 h TYR 57 Ca -0.45 -0.01 0.00 0.00 3.14 0.00 0.00 58.73 61.41 2q42 h TYR 57 Cb 1.38 -0.06 0.00 0.00 1.54 0.00 0.00 36.73 39.59 2q42 h TYR 57 CO 0.32 0.23 0.00 -0.40 -1.64 0.00 0.00 178.16 176.67 2q42 n ASP 58 N -4.39 0.00 -0.02 -2.11 5.75 -1.26 -0.42 116.55 114.10 2q42 n ASP 58 Ca -0.01 -0.13 0.02 0.00 -0.01 0.00 0.00 54.79 54.66 2q42 n ASP 58 Cb 0.18 -0.23 -0.08 0.00 -1.03 0.00 0.00 41.12 39.96 2q42 n ASP 58 CO 0.00 0.00 0.00 1.41 -0.11 0.00 0.00 177.20 178.50 2q42 n HIS 59 N -1.23 0.00 0.32 2.11 8.25 -0.71 -3.93 115.22 120.02 2q42 n HIS 59 Ca 0.11 0.00 0.04 0.00 -0.26 0.00 0.00 57.72 57.61 2q42 n HIS 59 Cb 0.15 -0.29 0.02 0.00 1.12 0.00 0.00 29.99 30.99 2q42 n HIS 59 CO 0.00 0.00 0.00 0.25 0.64 0.00 0.00 176.34 177.23 2q42 n THR 60 N -1.99 0.00 -0.32 1.59 -2.24 -1.03 -2.51 114.28 107.77 2q42 n THR 60 Ca -0.06 -0.48 0.20 0.00 -2.27 0.00 0.00 64.05 61.45 2q42 n THR 60 Cb 0.42 1.13 0.41 0.00 -2.10 0.00 0.00 70.33 70.20 2q42 n THR 60 CO 0.00 0.00 0.00 1.23 -0.57 0.00 0.00 175.07 175.73 2q42 h GLY 61 N 1.50 1.85 -0.14 3.38 0.00 -0.62 0.44 103.07 109.48 2q42 h GLY 61 Ca 0.00 -0.18 0.00 0.00 0.00 0.00 0.00 47.33 47.15 2q42 h GLY 61 CO 0.00 -0.44 0.00 0.61 0.00 0.00 0.00 176.54 176.71 2q42 n GLY 62 N -1.32 -0.24 0.32 4.60 0.00 0.01 -4.57 105.19 103.99 2q42 n GLY 62 Ca 0.28 -0.36 -0.10 0.00 0.00 0.00 0.00 46.02 45.84 2q42 n GLY 62 CO 0.00 0.00 0.00 3.43 0.00 0.00 0.00 173.32 176.75 2q42 h ASN 63 N 1.63 -0.92 0.43 1.61 4.21 -0.29 -1.90 115.58 120.35 2q42 h ASN 63 Ca 0.00 0.14 -0.17 0.00 1.21 0.00 0.00 56.30 57.47 2q42 h ASN 63 Cb 0.35 0.39 -0.01 0.00 -1.12 0.00 0.00 38.32 37.93 2q42 h ASN 63 CO 0.00 -0.34 -0.73 -0.07 -1.29 0.00 0.00 177.43 175.00 2q42 h LEU 64 N -0.37 0.30 -0.26 1.61 3.38 -1.80 -1.05 115.31 117.11 2q42 h LEU 64 Ca 0.10 -0.20 -0.16 0.00 0.09 0.00 0.00 57.88 57.71 2q42 h LEU 64 Cb 0.52 -0.09 -0.00 0.00 0.09 0.00 0.00 40.66 41.18 2q42 h LEU 64 CO -0.33 0.93 -0.44 -0.08 0.09 0.00 0.00 178.44 178.60 2q42 h GLU 65 N 0.17 0.76 -0.30 1.13 4.81 -1.83 -1.92 114.58 117.40 2q42 h GLU 65 Ca -0.03 -0.47 -0.14 0.00 -0.13 0.00 0.00 59.36 58.60 2q42 h GLU 65 Cb 1.30 0.05 -0.01 0.00 0.63 0.00 0.00 28.75 30.72 2q42 h GLU 65 CO 0.11 1.10 -0.38 -0.07 -0.73 0.00 0.00 179.01 179.04 2q42 h LEU 66 N 0.51 0.74 -0.46 1.64 3.38 -1.29 0.15 115.31 119.97 2q42 h LEU 66 Ca 0.02 -0.32 -0.05 0.00 0.09 0.00 0.00 57.88 57.62 2q42 h LEU 66 Cb 1.04 -0.21 -0.02 0.00 0.09 0.00 0.00 40.66 41.57 2q42 h LEU 66 CO 0.10 1.04 0.10 0.50 0.09 0.00 0.00 178.44 180.26 2q42 h LYS 67 N 0.58 0.74 0.48 1.13 3.64 -1.11 -1.94 116.57 120.09 2q42 h LYS 67 Ca 0.05 -0.19 -0.02 0.00 -1.27 0.00 0.00 60.65 59.22 2q42 h LYS 67 Cb 0.91 -0.09 0.00 0.00 -0.41 0.00 0.00 32.23 32.64 2q42 h LYS 67 CO 0.08 0.74 -0.23 0.22 -2.27 0.00 0.00 179.45 178.00 2q42 h ASP 68 N 0.61 -0.54 -0.33 4.20 3.58 -1.22 0.48 116.42 123.20 2q42 h ASP 68 Ca 0.14 -0.07 0.07 0.00 0.42 0.00 0.00 57.03 57.59 2q42 h ASP 68 Cb 0.35 0.14 -0.07 0.00 1.72 0.00 0.00 39.33 41.47 2q42 h ASP 68 CO 0.00 -0.23 -0.12 -0.09 -2.88 0.00 0.00 179.24 175.92 2q42 h ARG 69 N -0.87 -0.05 -0.02 0.28 2.43 -0.96 -3.07 114.38 112.12 2q42 h ARG 69 Ca -0.07 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.11 2q42 h ARG 69 Cb 0.58 0.01 0.00 0.00 -0.42 0.00 0.00 29.97 30.14 2q42 h ARG 69 CO 0.11 -0.03 -0.29 0.66 -1.51 0.00 0.00 179.97 178.90 2q42 n TYR 70 N -5.31 0.00 -2.25 2.20 4.01 -0.73 -4.93 117.16 110.15 2q42 n TYR 70 Ca 0.01 0.00 -0.15 0.00 -0.16 0.00 0.00 57.90 57.60 2q42 n TYR 70 Cb 0.22 -0.00 -0.01 0.00 -0.31 0.00 0.00 39.34 39.24 2q42 n TYR 70 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 2q42 n GLY 71 N 1.39 -0.17 3.81 2.72 0.00 0.16 -4.73 105.19 108.37 2q42 n GLY 71 Ca 0.11 -0.26 -0.33 0.00 0.00 0.00 0.00 46.02 45.55 2q42 n GLY 71 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2q42 s ALA 72 N -2.74 2.78 -0.18 4.61 0.00 -0.91 -4.96 121.76 120.35 2q42 s ALA 72 Ca 0.00 0.38 -0.05 0.00 0.00 0.00 0.00 51.96 52.29 2q42 s ALA 72 Cb 0.00 -3.22 -0.03 0.00 0.00 0.00 0.00 23.12 19.87 2q42 s ALA 72 CO 0.00 -0.74 -0.00 0.15 0.00 0.00 0.00 175.76 175.17 2q42 s LYS 73 N -4.05 3.72 -0.15 0.00 -0.14 -0.81 -4.62 119.74 113.69 2q42 s LYS 73 Ca 0.63 -0.48 -0.25 0.00 -1.36 0.00 0.00 55.97 54.51 2q42 s LYS 73 Cb -0.15 -3.03 -0.02 0.00 -1.68 0.00 0.00 37.83 32.95 2q42 s LYS 73 CO 0.36 0.17 0.81 0.08 -0.76 0.00 0.00 175.35 176.01 2q42 s VAL 74 N 0.57 4.91 -0.32 3.17 1.01 -1.26 -1.47 120.40 127.00 2q42 s VAL 74 Ca -0.01 1.60 -0.06 0.00 0.00 0.00 0.00 61.98 63.51 2q42 s VAL 74 Cb -0.14 -4.12 0.03 0.00 0.00 0.00 0.00 36.38 32.15 2q42 s VAL 74 CO 0.02 0.06 0.09 -0.63 0.00 0.00 0.00 175.10 174.64 2q42 s ILE 75 N 1.94 3.82 0.22 2.22 -1.09 0.11 -0.03 121.20 128.39 2q42 s ILE 75 Ca 0.38 -0.99 -0.07 0.00 -2.23 0.00 0.00 60.65 57.75 2q42 s ILE 75 Cb -0.17 -3.09 -0.02 0.00 -1.58 0.00 0.00 42.46 37.60 2q42 s ILE 75 CO 0.13 -0.09 0.29 -0.83 -1.23 0.00 0.00 174.94 173.22 2q42 s GLY 76 N 1.43 0.99 0.30 6.18 0.00 -0.08 -2.66 107.32 113.48 2q42 s GLY 76 Ca -0.00 -1.30 -0.30 0.00 0.00 0.00 0.00 44.72 43.12 2q42 s GLY 76 CO 0.02 -1.03 1.58 -1.14 0.00 0.00 0.00 173.10 172.53 2q42 n SER 77 N -0.31 3.80 0.20 1.64 3.41 -1.26 0.31 113.62 121.41 2q42 n SER 77 Ca -0.00 1.15 0.14 0.00 -0.26 0.00 0.00 58.87 59.90 2q42 n SER 77 Cb 0.64 -1.59 0.58 0.00 -0.26 0.00 0.00 64.21 63.58 2q42 n SER 77 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2q42 h ALA 78 N 4.65 1.00 -0.70 7.33 0.00 -1.47 -2.78 119.26 127.29 2q42 h ALA 78 Ca -0.47 0.00 -0.03 0.00 0.00 0.00 0.00 54.91 54.41 2q42 h ALA 78 Cb 1.23 0.00 -0.03 0.00 0.00 0.00 0.00 17.79 18.99 2q42 h ALA 78 CO 0.78 0.00 0.32 0.52 0.00 0.00 0.00 179.25 180.87 2q42 h MET 79 N 0.00 1.00 -1.17 0.00 2.86 -1.87 -3.21 114.93 112.54 2q42 h MET 79 Ca 0.00 -0.14 -0.65 0.00 -2.06 0.00 0.00 59.70 56.85 2q42 h MET 79 Cb 0.44 -0.18 -0.34 0.00 0.06 0.00 0.00 31.60 31.58 2q42 h MET 79 CO 0.00 0.78 0.26 -0.25 1.06 0.00 0.00 176.91 178.76 2q42 n ASP 80 N -4.33 6.57 -0.04 1.22 8.00 -1.05 -4.81 116.55 122.12 2q42 n ASP 80 Ca 0.06 -3.78 0.11 0.00 0.71 0.00 0.00 54.79 51.89 2q42 n ASP 80 Cb 0.14 -0.76 0.51 0.00 -0.02 0.00 0.00 41.12 40.99 2q42 n ASP 80 CO 0.00 0.00 0.00 0.11 -0.39 0.00 0.00 177.20 176.92 2q42 h LYS 81 N 2.30 0.37 0.00 -1.24 1.57 -1.63 -1.53 116.57 116.41 2q42 h LYS 81 Ca 0.50 -0.02 0.00 0.00 -1.87 0.00 0.00 60.65 59.26 2q42 h LYS 81 Cb 0.88 -0.08 0.00 0.00 0.08 0.00 0.00 32.23 33.11 2q42 h LYS 81 CO 1.25 0.25 -0.48 -0.25 -0.57 0.00 0.00 179.45 179.65 2q42 n ASP 82 N -4.47 0.56 -0.13 0.86 8.00 -1.26 -4.24 116.55 115.86 2q42 n ASP 82 Ca 0.08 0.06 0.06 0.00 0.71 0.00 0.00 54.79 55.70 2q42 n ASP 82 Cb 0.31 0.07 -0.04 0.00 -0.02 0.00 0.00 41.12 41.43 2q42 n ASP 82 CO 0.00 0.00 0.00 0.54 -0.39 0.00 0.00 177.20 177.35 2q42 n ARG 83 N -1.84 2.30 -3.41 -1.24 1.74 -0.62 -4.88 116.66 108.71 2q42 n ARG 83 Ca 0.05 -0.30 -0.41 0.00 -0.77 0.00 0.00 57.85 56.42 2q42 n ARG 83 Cb 0.39 -1.16 -0.09 0.00 -1.02 0.00 0.00 32.46 30.58 2q42 n ARG 83 CO 0.00 0.00 0.00 0.42 -1.52 0.00 0.00 177.63 176.53 2q42 s ILE 84 N -2.03 5.17 0.16 0.55 -1.09 -0.91 -4.81 121.20 118.24 2q42 s ILE 84 Ca 0.08 0.06 -0.34 0.00 -2.23 0.00 0.00 60.65 58.22 2q42 s ILE 84 Cb 0.11 -3.81 -0.14 0.00 -1.58 0.00 0.00 42.46 37.04 2q42 s ILE 84 CO 0.46 -0.08 1.57 -2.65 -1.23 0.00 0.00 174.94 173.02 2q42 n PRO 85 N 5.37 2.14 -2.95 2.79 -0.02 -1.26 -2.52 135.00 138.55 2q42 n PRO 85 Ca -0.09 0.77 -0.19 0.00 -2.02 0.00 0.00 63.50 61.97 2q42 n PRO 85 Cb 0.49 -2.54 0.00 0.00 -0.02 0.00 0.00 33.50 31.44 2q42 n PRO 85 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2q42 n GLY 86 N 3.40 -0.50 3.69 -1.23 0.00 -1.26 -4.82 105.19 104.47 2q42 n GLY 86 Ca 0.17 0.07 -0.44 0.00 0.00 0.00 0.00 46.02 45.81 2q42 n GLY 86 CO 0.00 0.00 0.00 4.51 0.00 0.00 0.00 173.32 177.83 2q42 n ILE 87 N -3.90 0.01 -0.12 -0.61 3.06 -1.05 -4.40 119.36 112.35 2q42 n ILE 87 Ca -0.09 -0.00 -0.17 0.00 -2.50 0.00 0.00 62.75 59.99 2q42 n ILE 87 Cb 0.59 -1.75 -0.11 0.00 0.54 0.00 0.00 39.64 38.91 2q42 n ILE 87 CO 0.00 0.00 0.00 0.47 -2.50 0.00 0.00 176.55 174.52 2q42 n ASP 88 N 3.71 2.16 -4.10 9.51 8.00 0.95 -4.97 116.55 131.81 2q42 n ASP 88 Ca 0.17 -0.10 -0.31 0.00 0.71 0.00 0.00 54.79 55.26 2q42 n ASP 88 Cb 0.32 -0.39 -0.17 0.00 -0.02 0.00 0.00 41.12 40.86 2q42 n ASP 88 CO 0.00 0.00 0.00 -0.04 -0.39 0.00 0.00 177.20 176.77 2q42 s MET 89 N -2.47 2.60 0.03 -1.24 -1.94 -0.83 -5.03 119.30 110.44 2q42 s MET 89 Ca -0.32 -0.70 -0.09 0.00 -1.71 0.00 0.00 55.69 52.88 2q42 s MET 89 Cb 0.08 -2.18 -0.05 0.00 2.01 0.00 0.00 34.83 34.69 2q42 s MET 89 CO 0.54 -0.08 0.34 0.00 -0.01 0.00 0.00 175.02 175.81 2q42 s ALA 90 N 1.01 3.77 -0.11 3.03 0.00 -1.25 -0.90 121.76 127.30 2q42 s ALA 90 Ca -0.04 -0.44 0.03 0.00 0.00 0.00 0.00 51.96 51.51 2q42 s ALA 90 Cb -0.15 -2.19 0.00 0.00 0.00 0.00 0.00 23.12 20.78 2q42 s ALA 90 CO -0.04 0.59 -0.23 -0.51 0.00 0.00 0.00 175.76 175.58 2q42 s LEU 91 N -1.72 2.07 0.14 0.00 1.43 0.15 -4.76 118.68 115.99 2q42 s LEU 91 Ca 0.29 -0.56 0.02 0.00 -1.03 0.00 0.00 54.13 52.85 2q42 s LEU 91 Cb -0.14 -1.39 -0.04 0.00 0.03 0.00 0.00 46.19 44.65 2q42 s LEU 91 CO 0.16 0.12 0.27 -0.54 0.23 0.00 0.00 176.35 176.60 2q42 s LYS 92 N 0.56 3.43 0.08 1.70 -0.14 -1.26 -1.24 119.74 122.87 2q42 s LYS 92 Ca -0.14 -0.59 -0.37 0.00 -1.36 0.00 0.00 55.97 53.52 2q42 s LYS 92 Cb -0.17 -2.97 -0.17 0.00 -1.68 0.00 0.00 37.83 32.85 2q42 s LYS 92 CO 0.04 0.53 1.34 -3.47 -0.76 0.00 0.00 175.35 173.04 2q42 n ASP 93 N -0.46 1.63 0.00 2.83 2.03 -1.26 -0.67 116.55 120.64 2q42 n ASP 93 Ca -0.07 1.12 0.00 0.00 0.52 0.00 0.00 54.79 56.36 2q42 n ASP 93 Cb 0.54 -1.18 0.00 0.00 -0.72 0.00 0.00 41.12 39.75 2q42 n ASP 93 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 2q42 n GLY 94 N 2.54 0.58 3.75 0.27 0.00 0.12 -4.97 105.19 107.49 2q42 n GLY 94 Ca 0.19 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.88 2q42 n GLY 94 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 2q42 s ASP 95 N -2.44 4.58 -0.06 1.61 1.01 0.15 -4.73 116.67 116.79 2q42 s ASP 95 Ca 0.00 2.09 -0.02 0.00 0.71 0.00 0.00 52.55 55.33 2q42 s ASP 95 Cb 0.00 -2.56 -0.04 0.00 1.01 0.00 0.00 42.92 41.33 2q42 s ASP 95 CO 0.00 -1.99 0.05 -0.75 0.21 0.00 0.00 175.17 172.69 2q42 s LYS 96 N -4.20 3.07 -0.06 8.23 2.20 -1.26 -0.91 119.74 126.81 2q42 s LYS 96 Ca 0.68 -0.40 -0.03 0.00 -0.36 0.00 0.00 55.97 55.87 2q42 s LYS 96 Cb -0.23 -2.87 0.04 0.00 -1.51 0.00 0.00 37.83 33.27 2q42 s LYS 96 CO 0.46 0.69 0.12 -0.46 -0.36 0.00 0.00 175.35 175.81 2q42 s TRP 97 N -1.02 -0.11 -0.26 4.03 -0.00 -0.14 -4.96 118.94 116.48 2q42 s TRP 97 Ca 0.17 0.45 -0.24 0.00 -0.00 0.00 0.00 56.10 56.49 2q42 s TRP 97 Cb -0.12 -0.23 -0.01 0.00 -0.00 0.00 0.00 33.47 33.12 2q42 s TRP 97 CO 0.07 -0.20 0.79 -1.64 -0.00 0.00 0.00 176.95 175.97 2q42 s MET 98 N 1.72 4.13 -0.61 5.86 -1.94 -1.26 -0.76 119.30 126.44 2q42 s MET 98 Ca -0.03 0.82 -0.17 0.00 -1.71 0.00 0.00 55.69 54.60 2q42 s MET 98 Cb -0.12 -3.66 0.13 0.00 2.01 0.00 0.00 34.83 33.18 2q42 s MET 98 CO -0.05 -0.54 0.65 0.12 -0.01 0.00 0.00 175.02 175.19 2q42 s PHE 99 N 2.83 3.17 -1.44 -0.03 5.36 0.45 -4.47 117.98 123.85 2q42 s PHE 99 Ca 0.33 -1.20 -0.00 0.00 -0.96 0.00 0.00 56.93 55.10 2q42 s PHE 99 Cb -0.15 -3.93 0.00 0.00 -0.34 0.00 0.00 43.02 38.61 2q42 s PHE 99 CO 0.09 -1.17 0.34 0.00 -1.46 0.00 0.00 175.22 173.02 2q42 n ALA 100 N 5.72 -1.99 -0.69 11.12 0.00 -1.26 -0.47 120.51 132.94 2q42 n ALA 100 Ca -0.08 -0.29 0.00 0.00 0.00 0.00 0.00 53.44 53.07 2q42 n ALA 100 Cb 0.42 -1.39 0.00 0.00 0.00 0.00 0.00 19.45 18.49 2q42 n ALA 100 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2q42 n GLY 101 N -2.09 1.38 3.53 0.00 0.00 -1.26 -5.00 105.19 101.75 2q42 n GLY 101 Ca -0.31 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.37 2q42 n GLY 101 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 2q42 s HIS 102 N -3.60 3.08 -0.06 1.61 3.76 0.38 -5.06 115.29 115.39 2q42 s HIS 102 Ca 0.00 -0.20 -0.30 0.00 -0.15 0.00 0.00 55.06 54.41 2q42 s HIS 102 Cb 0.00 -1.98 -0.04 0.00 1.11 0.00 0.00 32.58 31.67 2q42 s HIS 102 CO 0.00 0.02 1.29 -1.21 -0.85 0.00 0.00 174.74 173.99 2q42 s GLU 103 N 0.33 4.30 -0.12 1.40 2.02 -1.26 -0.41 118.70 124.96 2q42 s GLU 103 Ca -0.02 1.78 -0.05 0.00 0.02 0.00 0.00 54.97 56.69 2q42 s GLU 103 Cb -0.14 -3.63 -0.04 0.00 0.10 0.00 0.00 34.13 30.43 2q42 s GLU 103 CO 0.02 -0.56 0.07 0.08 0.02 0.00 0.00 175.26 174.89 2q42 s VAL 104 N 2.65 4.88 -0.30 2.63 1.01 0.06 -4.14 120.40 127.19 2q42 s VAL 104 Ca 0.59 -0.02 -0.03 0.00 0.00 0.00 0.00 61.98 62.51 2q42 s VAL 104 Cb -0.26 -3.11 0.04 0.00 0.00 0.00 0.00 36.38 33.04 2q42 s VAL 104 CO 0.22 0.58 0.02 -1.00 0.00 0.00 0.00 175.10 174.92 2q42 s HIS 105 N -0.66 3.21 -0.07 5.22 3.76 0.71 -0.97 115.29 126.48 2q42 s HIS 105 Ca 0.12 -1.59 -0.29 0.00 -0.15 0.00 0.00 55.06 53.14 2q42 s HIS 105 Cb -0.12 -2.15 -0.02 0.00 1.11 0.00 0.00 32.58 31.40 2q42 s HIS 105 CO 0.02 -0.74 0.96 0.08 -0.85 0.00 0.00 174.74 174.21 2q42 s VAL 106 N 1.33 4.84 -0.09 -0.90 1.01 -0.08 -1.80 120.40 124.71 2q42 s VAL 106 Ca -0.02 1.97 0.04 0.00 0.00 0.00 0.00 61.98 63.97 2q42 s VAL 106 Cb -0.19 -4.28 -0.00 0.00 0.00 0.00 0.00 36.38 31.91 2q42 s VAL 106 CO -0.00 0.08 -0.24 -0.04 0.00 0.00 0.00 175.10 174.90 2q42 s MET 107 N 1.58 2.90 0.05 2.72 -1.94 -0.52 0.15 119.30 124.25 2q42 s MET 107 Ca 0.48 -0.88 -0.31 0.00 -1.71 0.00 0.00 55.69 53.28 2q42 s MET 107 Cb -0.19 -2.25 -0.06 0.00 2.01 0.00 0.00 34.83 34.34 2q42 s MET 107 CO 0.21 0.23 1.29 0.34 -0.01 0.00 0.00 175.02 177.08 2q42 s ASP 108 N 0.22 6.96 -0.41 3.03 2.15 -1.26 -1.64 116.67 125.73 2q42 s ASP 108 Ca -0.15 2.09 0.07 0.00 0.43 0.00 0.00 52.55 54.99 2q42 s ASP 108 Cb -0.17 -2.57 0.24 0.00 -0.30 0.00 0.00 42.92 40.11 2q42 s ASP 108 CO 0.08 -0.58 0.57 0.35 -0.17 0.00 0.00 175.17 175.41 2q42 n THR 109 N 4.17 -0.63 -1.35 1.71 -2.24 -0.28 -4.90 114.28 110.76 2q42 n THR 109 Ca 0.11 -3.47 -0.31 0.00 -2.27 0.00 0.00 64.05 58.11 2q42 n THR 109 Cb 0.45 -1.30 0.08 0.00 -2.10 0.00 0.00 70.33 67.46 2q42 n THR 109 CO 0.00 0.00 0.00 -2.16 -0.57 0.00 0.00 175.07 172.34 2q42 s PRO 110 N -0.70 2.33 0.00 -0.78 0.04 -1.25 -4.49 135.00 130.16 2q42 s PRO 110 Ca 0.34 1.05 0.00 0.00 0.04 0.00 0.00 61.00 62.43 2q42 s PRO 110 Cb 0.16 -1.91 0.00 0.00 0.04 0.00 0.00 34.50 32.79 2q42 s PRO 110 CO -0.14 -1.55 0.00 0.41 0.04 0.00 0.00 177.00 175.75 2q42 n GLY 111 N -1.46 0.84 0.07 0.56 0.00 -1.26 -3.60 105.19 100.34 2q42 n GLY 111 Ca 0.08 -0.02 -0.12 0.00 0.00 0.00 0.00 46.02 45.96 2q42 n GLY 111 CO 0.00 0.00 0.00 0.84 0.00 0.00 0.00 173.32 174.16 2q42 h HIS 112 N 0.00 0.11 -3.65 1.61 -0.00 -1.85 -3.07 115.15 108.31 2q42 h HIS 112 Ca 0.00 -0.02 -0.30 0.00 -0.00 0.00 0.00 60.37 60.05 2q42 h HIS 112 Cb 0.00 -0.03 -0.16 0.00 -0.00 0.00 0.00 27.41 27.22 2q42 h HIS 112 CO 0.00 0.38 -0.72 0.95 -0.00 0.00 0.00 177.93 178.54 2q42 s THR 113 N -4.93 0.96 -0.21 6.26 -4.23 -1.26 -2.43 115.64 109.79 2q42 s THR 113 Ca -0.15 -1.82 -0.26 0.00 -1.18 0.00 0.00 61.69 58.29 2q42 s THR 113 Cb 0.04 -1.56 -0.00 0.00 1.34 0.00 0.00 72.50 72.32 2q42 s THR 113 CO 0.69 -0.67 0.89 -0.75 -0.54 0.00 0.00 174.62 174.23 2q42 s LYS 114 N -3.26 4.25 0.00 3.99 2.47 -1.26 -3.56 119.74 122.36 2q42 s LYS 114 Ca 0.10 1.09 0.00 0.00 -1.56 0.00 0.00 55.97 55.60 2q42 s LYS 114 Cb 0.00 -3.62 0.00 0.00 -1.46 0.00 0.00 37.83 32.76 2q42 s LYS 114 CO -0.01 -0.48 0.00 0.41 0.16 0.00 0.00 175.35 175.44 2q42 n GLY 115 N 3.52 1.01 3.73 5.54 0.00 -1.26 -4.85 105.19 112.88 2q42 n GLY 115 Ca 0.07 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.67 2q42 n GLY 115 CO 0.00 0.00 0.00 1.57 0.00 0.00 0.00 173.32 174.89 2q42 n HIS 116 N -0.84 2.74 -4.40 1.61 -0.00 -1.23 -4.69 115.22 108.41 2q42 n HIS 116 Ca 0.00 0.31 -0.20 0.00 -0.00 0.00 0.00 57.72 57.83 2q42 n HIS 116 Cb 0.00 -2.56 -0.10 0.00 -0.00 0.00 0.00 29.99 27.33 2q42 n HIS 116 CO 0.00 0.00 0.00 0.96 -0.00 0.00 0.00 176.34 177.30 2q42 s ILE 117 N -0.16 1.82 0.10 3.57 -4.36 0.36 -1.12 121.20 121.41 2q42 s ILE 117 Ca 0.63 -2.21 0.08 0.00 -0.26 0.00 0.00 60.65 58.90 2q42 s ILE 117 Cb -0.52 -2.25 -0.03 0.00 1.25 0.00 0.00 42.46 40.91 2q42 s ILE 117 CO 0.51 -0.45 -0.21 -0.44 0.24 0.00 0.00 174.94 174.59 2q42 s SER 118 N -3.40 2.54 -0.18 4.36 0.01 -0.65 -4.61 113.70 111.77 2q42 s SER 118 Ca 0.26 -0.67 0.00 0.00 1.31 0.00 0.00 55.95 56.85 2q42 s SER 118 Cb 0.00 -0.14 0.02 0.00 0.21 0.00 0.00 66.02 66.11 2q42 s SER 118 CO 0.10 0.07 -0.18 -0.76 0.41 0.00 0.00 173.24 172.88 2q42 s LEU 119 N -1.86 2.23 -0.20 2.44 1.43 -0.55 -1.44 118.68 120.74 2q42 s LEU 119 Ca 0.07 -0.62 -0.06 0.00 -1.03 0.00 0.00 54.13 52.49 2q42 s LEU 119 Cb -0.10 -1.51 -0.03 0.00 0.03 0.00 0.00 46.19 44.58 2q42 s LEU 119 CO 0.04 -0.00 0.01 -0.47 0.23 0.00 0.00 176.35 176.16 2q42 s TYR 120 N 1.31 3.08 -0.73 0.29 5.04 -0.75 -1.72 117.35 123.87 2q42 s TYR 120 Ca 0.05 -0.33 -0.01 0.00 -2.44 0.00 0.00 57.07 54.34 2q42 s TYR 120 Cb -0.13 -2.08 0.18 0.00 0.35 0.00 0.00 41.96 40.28 2q42 s TYR 120 CO -0.12 -0.15 0.56 -0.06 -1.34 0.00 0.00 175.55 174.45 2q42 s PHE 121 N 0.86 3.59 0.50 4.97 0.08 -0.17 -0.21 117.98 127.61 2q42 s PHE 121 Ca 0.01 -2.95 0.21 0.00 0.12 0.00 0.00 56.93 54.32 2q42 s PHE 121 Cb -0.14 -3.12 1.27 0.00 -0.57 0.00 0.00 43.02 40.46 2q42 s PHE 121 CO 0.02 -0.75 2.01 -1.00 -0.10 0.00 0.00 175.22 175.40 2q42 h PRO 122 N 6.38 0.12 -0.17 0.24 0.13 -1.79 -0.75 132.00 136.15 2q42 h PRO 122 Ca 0.07 -0.01 -0.03 0.00 -0.87 0.00 0.00 66.00 65.16 2q42 h PRO 122 Cb 0.87 -0.03 -0.01 0.00 0.13 0.00 0.00 31.00 31.96 2q42 h PRO 122 CO 0.76 0.08 -0.02 0.78 -0.23 0.00 0.00 178.00 179.37 2q42 h GLY 123 N 0.12 0.27 -1.40 1.56 0.00 -1.93 -2.54 103.07 99.15 2q42 h GLY 123 Ca 0.23 -0.13 0.00 0.00 0.00 0.00 0.00 47.33 47.42 2q42 h GLY 123 CO -0.03 0.13 0.00 1.44 0.00 0.00 0.00 176.54 178.08 2q42 n SER 124 N -4.37 3.09 -3.14 0.19 7.64 -0.36 -4.97 113.62 111.70 2q42 n SER 124 Ca -0.00 -2.10 -0.15 0.00 1.01 0.00 0.00 58.87 57.63 2q42 n SER 124 Cb 0.19 -0.28 0.02 0.00 -1.01 0.00 0.00 64.21 63.12 2q42 n SER 124 CO 0.00 0.00 0.00 0.54 -3.01 0.00 0.00 175.04 172.57 2q42 n ARG 125 N 0.49 -1.85 -3.63 1.43 1.74 -0.79 -4.90 116.66 109.15 2q42 n ARG 125 Ca 0.13 1.64 -0.03 0.00 -0.77 0.00 0.00 57.85 58.82 2q42 n ARG 125 Cb 0.48 -3.12 -0.04 0.00 -1.02 0.00 0.00 32.46 28.77 2q42 n ARG 125 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 2q42 s ALA 126 N -1.61 -2.11 -0.12 7.54 0.00 -1.18 -3.21 121.76 121.08 2q42 s ALA 126 Ca 0.18 1.84 -0.04 0.00 0.00 0.00 0.00 51.96 53.94 2q42 s ALA 126 Cb -0.03 -1.13 0.06 0.00 0.00 0.00 0.00 23.12 22.01 2q42 s ALA 126 CO 0.60 -0.33 0.16 -1.50 0.00 0.00 0.00 175.76 174.69 2q42 s ILE 127 N -1.33 -0.24 -0.24 0.00 2.07 0.01 -1.00 121.20 120.48 2q42 s ILE 127 Ca 0.08 0.20 -0.29 0.00 -1.41 0.00 0.00 60.65 59.24 2q42 s ILE 127 Cb -0.01 -0.40 0.01 0.00 0.13 0.00 0.00 42.46 42.19 2q42 s ILE 127 CO -0.06 0.03 1.12 -0.36 -1.91 0.00 0.00 174.94 173.75 2q42 s PHE 128 N 2.27 3.15 -0.64 3.50 0.08 -0.70 -1.76 117.98 123.88 2q42 s PHE 128 Ca 0.04 1.27 0.14 0.00 0.12 0.00 0.00 56.93 58.50 2q42 s PHE 128 Cb -0.13 -3.45 0.47 0.00 -0.57 0.00 0.00 43.02 39.33 2q42 s PHE 128 CO -0.07 -0.90 1.39 0.25 -0.10 0.00 0.00 175.22 175.79 2q42 n THR 129 N 5.50 1.68 -0.14 0.64 -2.24 -1.12 -1.48 114.28 117.12 2q42 n THR 129 Ca 0.13 -1.40 0.00 0.00 -2.27 0.00 0.00 64.05 60.51 2q42 n THR 129 Cb 0.46 0.12 0.00 0.00 -2.10 0.00 0.00 70.33 68.81 2q42 n THR 129 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2q42 n GLY 130 N 0.18 2.68 1.81 3.38 0.00 -1.26 0.12 105.19 112.09 2q42 n GLY 130 Ca 0.18 -0.04 -0.06 0.00 0.00 0.00 0.00 46.02 46.09 2q42 n GLY 130 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 2q42 n ASP 131 N 1.57 4.32 -0.04 1.61 9.92 -1.26 -0.37 116.55 132.31 2q42 n ASP 131 Ca 0.00 -3.32 -0.01 0.00 -0.53 0.00 0.00 54.79 50.93 2q42 n ASP 131 Cb 0.00 -0.72 -0.00 0.00 -0.64 0.00 0.00 41.12 39.75 2q42 n ASP 131 CO 0.00 0.00 0.00 0.74 0.13 0.00 0.00 177.20 178.07 2q42 h THR 132 N 2.17 0.00 -3.17 -3.53 2.02 -0.68 -3.18 112.91 106.55 2q42 h THR 132 Ca 0.28 -0.73 -0.67 0.00 0.77 0.00 0.00 66.41 66.06 2q42 h THR 132 Cb 2.23 0.00 -0.34 0.00 -1.74 0.00 0.00 68.15 68.30 2q42 h THR 132 CO 0.69 0.00 -0.86 -0.32 0.37 0.00 0.00 175.52 175.40 2q42 s MET 133 N -1.51 3.03 0.58 6.66 -2.45 -1.19 -2.82 119.30 121.60 2q42 s MET 133 Ca -0.02 -0.84 0.06 0.00 -1.25 0.00 0.00 55.69 53.64 2q42 s MET 133 Cb 0.00 -2.49 0.08 0.00 1.25 0.00 0.00 34.83 33.68 2q42 s MET 133 CO 0.04 -0.07 0.80 -0.06 1.05 0.00 0.00 175.02 176.78 2q42 s PHE 134 N 0.94 1.80 -0.08 4.11 0.08 -1.14 -4.71 117.98 118.98 2q42 s PHE 134 Ca -0.04 -0.51 -0.26 0.00 0.12 0.00 0.00 56.93 56.24 2q42 s PHE 134 Cb -0.15 -2.46 -0.03 0.00 -0.57 0.00 0.00 43.02 39.81 2q42 s PHE 134 CO -0.05 -1.14 0.83 0.45 -0.10 0.00 0.00 175.22 175.21 2q42 s SER 135 N -4.61 7.09 0.00 1.36 0.15 -1.26 -3.94 113.70 112.49 2q42 s SER 135 Ca 0.61 1.33 0.00 0.00 0.70 0.00 0.00 55.95 58.59 2q42 s SER 135 Cb -0.07 -2.47 0.00 0.00 -1.71 0.00 0.00 66.02 61.77 2q42 s SER 135 CO 0.39 -0.25 0.00 0.18 1.20 0.00 0.00 173.24 174.76 2q42 n LEU 136 N 4.30 0.00 0.00 3.45 4.77 -1.26 -4.26 117.00 124.00 2q42 n LEU 136 Ca 0.03 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 56.01 2q42 n LEU 136 Cb 0.50 -0.01 0.00 0.00 -2.33 0.00 0.00 43.42 41.58 2q42 n LEU 136 CO 0.49 0.00 0.00 -0.24 -1.33 0.00 0.00 177.39 176.31 2q42 n SER 137 N 0.00 0.21 -3.55 -1.43 2.88 -1.25 -3.93 113.62 106.54 2q42 n SER 137 Ca 0.00 0.00 -0.08 0.00 -1.33 0.00 0.00 58.87 57.46 2q42 n SER 137 Cb 0.00 0.00 -0.01 0.00 -0.75 0.00 0.00 64.21 63.45 2q42 n SER 137 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 2q42 s GLY 139 N -2.97 1.72 0.65 0.00 0.00 -1.13 -4.80 107.32 100.79 2q42 s GLY 139 Ca 0.12 -0.15 -0.14 0.00 0.00 0.00 0.00 44.72 44.55 2q42 s GLY 139 CO 0.08 0.09 1.08 0.54 0.00 0.00 0.00 173.10 174.89 2q42 s LYS 140 N -4.77 2.99 -1.14 2.90 1.02 -1.26 -4.82 119.74 114.67 2q42 s LYS 140 Ca 0.54 1.21 -0.10 0.00 0.02 0.00 0.00 55.97 57.64 2q42 s LYS 140 Cb -0.11 -1.99 0.26 0.00 -0.52 0.00 0.00 37.83 35.47 2q42 s LYS 140 CO 0.46 -1.07 1.24 1.28 -0.92 0.00 0.00 175.35 176.34 2q42 n LEU 141 N -2.49 5.58 0.11 3.17 4.77 -1.26 -3.91 117.00 122.97 2q42 n LEU 141 Ca 0.09 -4.92 -0.12 0.00 -0.03 0.00 0.00 56.01 51.02 2q42 n LEU 141 Cb 0.53 -1.49 -0.08 0.00 -2.33 0.00 0.00 43.42 40.05 2q42 n LEU 141 CO 0.49 1.25 0.51 -0.26 -1.33 0.00 0.00 177.39 178.05 2q42 h PHE 142 N 6.61 -0.30 0.00 -1.77 0.04 -1.59 -3.39 116.94 116.54 2q42 h PHE 142 Ca 0.22 -0.01 -0.02 0.00 2.80 0.00 0.00 57.97 60.96 2q42 h PHE 142 Cb 0.84 0.10 -0.04 0.00 2.20 0.00 0.00 35.95 39.04 2q42 h PHE 142 CO 0.86 0.07 -0.41 0.39 -0.60 0.00 0.00 178.31 178.62 2q42 n GLU 143 N -5.05 1.20 -0.93 1.51 1.02 -1.15 -5.05 120.64 112.19 2q42 n GLU 143 Ca -0.09 -2.78 0.00 0.00 -0.02 0.00 0.00 57.16 54.27 2q42 n GLU 143 Cb 0.26 -1.32 0.00 0.00 -0.02 0.00 0.00 31.44 30.36 2q42 n GLU 143 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 2q42 n GLY 144 N -0.95 5.35 3.17 0.62 0.00 -1.16 -4.27 105.19 107.94 2q42 n GLY 144 Ca 0.15 -1.80 -0.26 0.00 0.00 0.00 0.00 46.02 44.11 2q42 n GLY 144 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2q42 s THR 145 N -0.76 1.46 0.45 2.61 -4.23 -1.26 -5.00 115.64 108.90 2q42 s THR 145 Ca 0.00 -0.77 0.30 0.00 -1.18 0.00 0.00 61.69 60.05 2q42 s THR 145 Cb 0.00 -1.23 0.50 0.00 1.34 0.00 0.00 72.50 73.11 2q42 s THR 145 CO 0.00 0.42 1.66 -0.65 -0.54 0.00 0.00 174.62 175.51 2q42 h PRO 146 N 5.91 0.13 -0.14 3.99 0.11 -1.95 1.73 132.00 141.78 2q42 h PRO 146 Ca -0.35 -0.01 -0.15 0.00 0.11 0.00 0.00 66.00 65.60 2q42 h PRO 146 Cb 1.16 -0.03 -0.01 0.00 0.11 0.00 0.00 31.00 32.23 2q42 h PRO 146 CO 0.48 0.08 -0.53 -0.22 -0.21 0.00 0.00 178.00 177.60 2q42 h LYS 147 N 0.13 0.42 -0.09 1.05 3.64 -1.96 0.16 116.57 119.92 2q42 h LYS 147 Ca 0.76 -0.26 -0.15 0.00 -1.27 0.00 0.00 60.65 59.74 2q42 h LYS 147 Cb 2.44 0.03 0.01 0.00 -0.41 0.00 0.00 32.23 34.30 2q42 h LYS 147 CO -0.32 0.85 -0.53 1.96 -2.27 0.00 0.00 179.45 179.13 2q42 h GLN 148 N 0.32 0.52 0.00 1.90 4.20 0.21 -0.18 115.11 122.08 2q42 h GLN 148 Ca 0.01 -0.44 -0.11 0.00 0.06 0.00 0.00 58.65 58.17 2q42 h GLN 148 Cb 1.04 0.10 -0.02 0.00 0.30 0.00 0.00 27.48 28.90 2q42 h GLN 148 CO 0.09 1.07 -0.51 1.98 -0.67 0.00 0.00 178.83 180.80 2q42 h MET 149 N 0.11 0.00 -0.10 1.46 4.05 -0.37 -1.44 114.93 118.63 2q42 h MET 149 Ca -0.04 0.00 -0.18 0.00 -0.28 0.00 0.00 59.70 59.20 2q42 h MET 149 Cb 1.19 0.00 -0.01 0.00 -0.80 0.00 0.00 31.60 31.98 2q42 h MET 149 CO 0.11 0.51 -0.68 1.25 0.23 0.00 0.00 176.91 178.33 2q42 h LEU 150 N 0.00 0.51 -1.25 3.39 5.85 -0.64 -2.78 115.31 120.39 2q42 h LEU 150 Ca -0.01 -0.31 -0.06 0.00 0.84 0.00 0.00 57.88 58.34 2q42 h LEU 150 Cb 1.00 -0.15 -0.01 0.00 0.37 0.00 0.00 40.66 41.88 2q42 h LEU 150 CO 0.07 1.04 -0.28 0.00 -0.34 0.00 0.00 178.44 178.92 2q42 h ALA 151 N 0.96 1.12 0.11 1.25 0.00 -0.63 -2.82 119.26 119.25 2q42 h ALA 151 Ca -0.02 -0.25 -0.27 0.00 0.00 0.00 0.00 54.91 54.36 2q42 h ALA 151 Cb 1.24 -0.04 0.01 0.00 0.00 0.00 0.00 17.79 18.99 2q42 h ALA 151 CO 0.12 0.35 -1.19 0.77 0.00 0.00 0.00 179.25 179.30 2q42 h SER 152 N 0.00 0.56 -0.37 0.00 0.02 -1.22 -2.99 113.55 109.56 2q42 h SER 152 Ca -0.00 -0.55 -0.10 0.00 -0.84 0.00 0.00 61.79 60.30 2q42 h SER 152 Cb 0.70 -0.18 -0.02 0.00 0.14 0.00 0.00 62.40 63.04 2q42 h SER 152 CO 0.04 1.39 -0.14 -0.07 -1.14 0.00 0.00 176.83 176.91 2q42 h LEU 153 N 0.15 0.83 -1.64 5.07 3.38 -1.39 -2.29 115.31 119.43 2q42 h LEU 153 Ca -0.14 -0.27 -0.02 0.00 0.09 0.00 0.00 57.88 57.54 2q42 h LEU 153 Cb 1.88 -0.22 -0.00 0.00 0.09 0.00 0.00 40.66 42.40 2q42 h LEU 153 CO 0.21 0.97 -0.10 1.56 0.09 0.00 0.00 178.44 181.17 2q42 h GLN 154 N 0.74 0.00 -0.16 1.13 4.20 -1.56 -0.57 115.11 118.89 2q42 h GLN 154 Ca 0.12 0.00 -0.11 0.00 0.06 0.00 0.00 58.65 58.71 2q42 h GLN 154 Cb 0.65 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.43 2q42 h GLN 154 CO 0.05 0.10 -0.34 0.87 -0.67 0.00 0.00 178.83 178.83 2q42 h LYS 155 N 0.00 0.52 -0.26 1.46 1.57 -1.26 -2.47 116.57 116.13 2q42 h LYS 155 Ca -0.00 -0.34 -0.14 0.00 -1.87 0.00 0.00 60.65 58.30 2q42 h LYS 155 Cb 0.48 0.04 -0.01 0.00 0.08 0.00 0.00 32.23 32.83 2q42 h LYS 155 CO 0.01 0.95 -0.41 0.82 -0.57 0.00 0.00 179.45 180.25 2q42 h ILE 156 N 0.16 1.30 0.00 1.86 2.04 -1.26 -3.10 117.51 118.51 2q42 h ILE 156 Ca 0.00 -1.59 0.00 0.00 1.00 0.00 0.00 64.86 64.28 2q42 h ILE 156 Cb 0.94 1.54 0.00 0.00 -0.74 0.00 0.00 36.82 38.56 2q42 h ILE 156 CO 0.08 0.51 0.00 0.35 0.00 0.00 0.00 178.15 179.08 2q42 n THR 157 N -4.03 0.41 0.18 -0.27 -2.24 -0.27 -2.68 114.28 105.38 2q42 n THR 157 Ca -0.02 -0.18 0.06 0.00 -2.27 0.00 0.00 64.05 61.64 2q42 n THR 157 Cb 0.53 -0.57 0.16 0.00 -2.10 0.00 0.00 70.33 68.34 2q42 n THR 157 CO 0.00 0.00 0.00 0.77 -0.57 0.00 0.00 175.07 175.27 2q42 h SER 158 N 0.00 0.00 -3.12 3.42 4.64 -1.36 -3.46 113.55 113.67 2q42 h SER 158 Ca 0.00 0.00 -0.43 0.00 -0.47 0.00 0.00 61.79 60.89 2q42 h SER 158 Cb 0.65 0.00 0.22 0.00 -0.31 0.00 0.00 62.40 62.96 2q42 h SER 158 CO 0.00 0.34 -0.03 -0.76 -0.87 0.00 0.00 176.83 175.51 2q42 s LEU 159 N -6.48 0.54 0.43 5.97 1.43 -1.09 -4.89 118.68 114.58 2q42 s LEU 159 Ca 0.04 1.49 -0.25 0.00 -1.03 0.00 0.00 54.13 54.38 2q42 s LEU 159 Cb 0.08 -3.32 -0.10 0.00 0.03 0.00 0.00 46.19 42.88 2q42 s LEU 159 CO 0.70 -4.46 1.19 -2.65 0.23 0.00 0.00 176.35 171.36 2q42 n PRO 160 N -5.09 1.72 -0.31 1.29 -0.02 -1.26 -4.89 135.00 126.44 2q42 n PRO 160 Ca 0.02 0.61 0.07 0.00 -2.02 0.00 0.00 63.50 62.19 2q42 n PRO 160 Cb 0.54 -2.28 0.28 0.00 -0.02 0.00 0.00 33.50 32.02 2q42 n PRO 160 CO 0.00 0.00 0.00 -0.44 1.98 0.00 0.00 175.50 177.04 2q42 h ASP 161 N 1.86 0.84 0.64 2.55 5.19 -1.90 -1.06 116.42 124.54 2q42 h ASP 161 Ca -0.47 0.03 0.00 0.00 -0.62 0.00 0.00 57.03 55.97 2q42 h ASP 161 Cb 1.31 -0.14 0.00 0.00 0.18 0.00 0.00 39.33 40.68 2q42 h ASP 161 CO 0.59 0.48 0.00 -0.90 -3.12 0.00 0.00 179.24 176.29 2q42 n ASP 162 N -4.55 0.00 -4.60 6.45 5.68 -1.26 -1.35 116.55 116.92 2q42 n ASP 162 Ca 0.16 0.43 -0.52 0.00 -0.50 0.00 0.00 54.79 54.37 2q42 n ASP 162 Cb 0.32 -0.47 -0.06 0.00 -1.14 0.00 0.00 41.12 39.77 2q42 n ASP 162 CO 0.00 0.00 0.00 0.41 -1.33 0.00 0.00 177.20 176.28 2q42 n THR 163 N -1.47 0.00 -2.78 2.12 -1.04 -0.40 -4.75 114.28 105.96 2q42 n THR 163 Ca 0.05 -0.00 -0.42 0.00 -2.04 0.00 0.00 64.05 61.64 2q42 n THR 163 Cb 0.22 -0.89 -0.03 0.00 -1.82 0.00 0.00 70.33 67.81 2q42 n THR 163 CO 0.00 0.00 0.00 -0.44 -0.64 0.00 0.00 175.07 173.99 2q42 s SER 164 N 0.55 7.12 -0.41 8.00 0.01 -1.20 -0.72 113.70 127.06 2q42 s SER 164 Ca 0.84 1.37 -0.17 0.00 1.31 0.00 0.00 55.95 59.30 2q42 s SER 164 Cb -0.93 -2.51 0.02 0.00 0.21 0.00 0.00 66.02 62.80 2q42 s SER 164 CO 0.46 -0.43 0.44 -0.63 0.41 0.00 0.00 173.24 173.49 2q42 s ILE 165 N 2.11 5.08 0.48 1.44 1.01 -0.18 -0.81 121.20 130.32 2q42 s ILE 165 Ca 0.44 -0.23 0.02 0.00 0.00 0.00 0.00 60.65 60.88 2q42 s ILE 165 Cb -0.17 -4.01 0.01 0.00 0.01 0.00 0.00 42.46 38.30 2q42 s ILE 165 CO 0.15 -0.37 0.68 -0.31 0.00 0.00 0.00 174.94 175.09 2q42 s TYR 166 N 2.17 3.01 0.06 3.97 2.02 -0.72 -1.76 117.35 126.10 2q42 s TYR 166 Ca 0.13 0.01 -0.27 0.00 -0.37 0.00 0.00 57.07 56.57 2q42 s TYR 166 Cb -0.17 -2.47 0.09 0.00 -0.40 0.00 0.00 41.96 39.02 2q42 s TYR 166 CO 0.14 -0.54 1.17 0.00 -1.57 0.00 0.00 175.55 174.74 2q42 s GLY 168 N -3.27 1.61 0.00 0.00 0.00 0.50 -4.61 107.32 101.55 2q42 s GLY 168 Ca 0.19 -0.49 0.00 0.00 0.00 0.00 0.00 44.72 44.42 2q42 s GLY 168 CO 0.00 -0.05 0.00 1.42 0.00 0.00 0.00 173.10 174.47 2q42 n HIS 169 N -3.23 -1.81 -3.07 1.90 8.25 -1.19 -4.73 115.22 111.34 2q42 n HIS 169 Ca 0.07 0.00 -0.15 0.00 -0.26 0.00 0.00 57.72 57.38 2q42 n HIS 169 Cb 0.59 0.26 -0.04 0.00 1.12 0.00 0.00 29.99 31.92 2q42 n HIS 169 CO 0.00 0.00 0.00 -2.00 0.64 0.00 0.00 176.34 174.98 2q42 s GLU 170 N 0.00 0.99 0.00 -0.41 2.56 -0.90 -4.46 118.70 116.47 2q42 s GLU 170 Ca 0.00 -1.57 0.05 0.00 0.00 0.00 0.00 54.97 53.46 2q42 s GLU 170 Cb 0.00 -0.71 0.09 0.00 2.00 0.00 0.00 34.13 35.51 2q42 s GLU 170 CO 0.00 -1.36 0.86 0.66 -0.56 0.00 0.00 175.26 174.86 2q42 n TYR 171 N 2.91 0.09 0.05 5.30 4.01 -1.26 -4.80 117.16 123.46 2q42 n TYR 171 Ca 0.24 -0.21 0.09 0.00 -0.16 0.00 0.00 57.90 57.85 2q42 n TYR 171 Cb 0.52 -0.02 0.53 0.00 -0.31 0.00 0.00 39.34 40.07 2q42 n TYR 171 CO 0.00 0.00 0.00 1.15 -0.46 0.00 0.00 176.86 177.55 2q42 h THR 172 N 1.01 0.98 0.11 -0.72 2.02 -1.94 0.43 112.91 114.81 2q42 h THR 172 Ca 0.00 -0.10 -0.01 0.00 0.77 0.00 0.00 66.41 67.07 2q42 h THR 172 Cb 0.39 0.66 0.00 0.00 -1.74 0.00 0.00 68.15 67.45 2q42 h THR 172 CO 0.00 0.05 -0.05 0.25 0.37 0.00 0.00 175.52 176.14 2q42 h LEU 173 N 0.30 -0.13 -1.32 2.58 5.85 -1.90 -0.36 115.31 120.33 2q42 h LEU 173 Ca 0.15 -0.42 0.02 0.00 0.84 0.00 0.00 57.88 58.47 2q42 h LEU 173 Cb 0.23 0.03 -0.04 0.00 0.37 0.00 0.00 40.66 41.25 2q42 h LEU 173 CO -0.03 0.41 0.47 0.77 -0.34 0.00 0.00 178.44 179.72 2q42 h SER 174 N -0.74 0.77 -0.35 1.25 4.64 -1.78 -2.10 113.55 115.24 2q42 h SER 174 Ca -0.02 -0.01 -0.00 0.00 -0.47 0.00 0.00 61.79 61.29 2q42 h SER 174 Cb 0.55 -0.18 -0.02 0.00 -0.31 0.00 0.00 62.40 62.43 2q42 h SER 174 CO 0.03 0.54 0.21 0.78 -0.87 0.00 0.00 176.83 177.52 2q42 h ASN 175 N 0.90 0.42 -0.56 4.97 2.35 -0.13 -2.73 115.58 120.80 2q42 h ASN 175 Ca 0.28 -0.06 0.10 0.00 -0.55 0.00 0.00 56.30 56.07 2q42 h ASN 175 Cb -0.01 -0.11 -0.03 0.00 0.05 0.00 0.00 38.32 38.22 2q42 h ASN 175 CO -0.07 0.36 0.38 0.77 -1.65 0.00 0.00 177.43 177.22 2q42 h SER 176 N 0.45 0.30 0.01 5.81 4.64 -0.36 0.67 113.55 125.07 2q42 h SER 176 Ca 0.13 0.01 -0.21 0.00 -0.47 0.00 0.00 61.79 61.24 2q42 h SER 176 Cb 0.02 -0.06 0.00 0.00 -0.31 0.00 0.00 62.40 62.06 2q42 h SER 176 CO -0.02 0.18 -0.76 0.11 -0.87 0.00 0.00 176.83 175.47 2q42 h LYS 177 N 0.33 0.64 -0.04 4.77 1.57 -1.26 1.35 116.57 123.94 2q42 h LYS 177 Ca 0.26 -0.53 -0.01 0.00 -1.87 0.00 0.00 60.65 58.51 2q42 h LYS 177 Cb 0.59 0.11 -0.00 0.00 0.08 0.00 0.00 32.23 33.00 2q42 h LYS 177 CO -0.06 1.14 0.00 0.35 -0.57 0.00 0.00 179.45 180.31 2q42 h PHE 178 N 0.44 0.08 0.00 -1.35 3.57 -0.99 -1.94 116.94 116.74 2q42 h PHE 178 Ca -0.04 -0.01 -0.05 0.00 3.53 0.00 0.00 57.97 61.39 2q42 h PHE 178 Cb 1.37 -0.02 -0.01 0.00 2.79 0.00 0.00 35.95 40.08 2q42 h PHE 178 CO 0.07 0.35 -0.24 0.00 -2.23 0.00 0.00 178.31 176.26 2q42 h ALA 179 N 0.72 1.49 -0.24 2.41 0.00 -0.74 -1.17 119.26 121.73 2q42 h ALA 179 Ca 0.01 -0.21 -0.03 0.00 0.00 0.00 0.00 54.91 54.68 2q42 h ALA 179 Cb 0.32 -0.04 -0.01 0.00 0.00 0.00 0.00 17.79 18.06 2q42 h ALA 179 CO 0.00 0.29 0.04 -0.07 0.00 0.00 0.00 179.25 179.52 2q42 h LEU 180 N 0.00 0.38 -0.68 0.00 3.38 0.22 -0.76 115.31 117.84 2q42 h LEU 180 Ca -0.00 -0.26 0.00 0.00 0.09 0.00 0.00 57.88 57.71 2q42 h LEU 180 Cb 0.45 -0.10 0.00 0.00 0.09 0.00 0.00 40.66 41.10 2q42 h LEU 180 CO 0.03 0.54 0.00 0.77 0.09 0.00 0.00 178.44 179.87 2q42 h SER 181 N 0.20 0.00 0.39 -0.43 4.64 -1.20 -2.41 113.55 114.75 2q42 h SER 181 Ca 0.07 0.00 -0.32 0.00 -0.47 0.00 0.00 61.79 61.08 2q42 h SER 181 Cb 0.32 0.00 0.01 0.00 -0.31 0.00 0.00 62.40 62.41 2q42 h SER 181 CO 0.00 0.00 -1.53 0.25 -0.87 0.00 0.00 176.83 174.68 2q42 h LEU 182 N 0.00 0.52 -5.71 5.97 6.46 -0.69 -3.40 115.31 118.45 2q42 h LEU 182 Ca 0.00 -0.67 -0.43 0.00 -0.12 0.00 0.00 57.88 56.67 2q42 h LEU 182 Cb 0.74 -0.17 -0.36 0.00 -0.73 0.00 0.00 40.66 40.14 2q42 h LEU 182 CO 0.00 1.55 -1.08 1.21 -0.62 0.00 0.00 178.44 179.50 2q42 n GLU 183 N -3.53 1.01 -0.33 1.25 2.13 -0.34 -4.50 120.64 116.32 2q42 n GLU 183 Ca -0.17 -3.14 0.27 0.00 0.66 0.00 0.00 57.16 54.78 2q42 n GLU 183 Cb 1.06 -1.51 0.57 0.00 0.27 0.00 0.00 31.44 31.82 2q42 n GLU 183 CO 0.00 0.00 0.00 -1.00 -0.41 0.00 0.00 177.13 175.72 2q42 h PRO 184 N 2.97 0.28 -0.17 5.31 0.13 -1.61 -1.47 132.00 137.44 2q42 h PRO 184 Ca 0.04 -0.02 0.00 0.00 -0.87 0.00 0.00 66.00 65.15 2q42 h PRO 184 Cb 1.02 -0.06 0.00 0.00 0.13 0.00 0.00 31.00 32.09 2q42 h PRO 184 CO 0.44 0.18 0.00 0.09 -0.23 0.00 0.00 178.00 178.48 2q42 n ASN 185 N -4.54 0.61 -4.55 1.44 3.02 -1.26 -4.72 115.26 105.25 2q42 n ASN 185 Ca 0.26 -2.01 -0.43 0.00 -0.03 0.00 0.00 54.58 52.37 2q42 n ASN 185 Cb 1.00 -0.10 -0.04 0.00 -0.61 0.00 0.00 39.78 40.03 2q42 n ASN 185 CO 0.00 0.00 0.00 0.21 -2.62 0.00 0.00 177.26 174.85 2q42 s ASN 186 N -0.92 6.43 0.08 6.41 3.84 -0.56 -4.93 114.94 125.29 2q42 s ASN 186 Ca 0.06 -0.08 -0.22 0.00 0.21 0.00 0.00 52.86 52.84 2q42 s ASN 186 Cb 0.04 -2.44 -0.12 0.00 -0.55 0.00 0.00 41.25 38.17 2q42 s ASN 186 CO 0.04 -1.12 1.65 -0.33 -2.79 0.00 0.00 177.10 174.56 2q42 h GLU 187 N 9.17 0.15 -0.62 0.43 5.08 -1.90 -1.09 114.58 125.80 2q42 h GLU 187 Ca -0.25 -0.02 -0.01 0.00 -1.00 0.00 0.00 59.36 58.08 2q42 h GLU 187 Cb 1.08 -0.03 -0.03 0.00 0.50 0.00 0.00 28.75 30.27 2q42 h GLU 187 CO 1.05 0.22 0.34 0.28 -1.00 0.00 0.00 179.01 179.89 2q42 h VAL 188 N 0.04 1.19 0.00 3.13 2.07 -1.91 -0.26 116.25 120.51 2q42 h VAL 188 Ca 0.03 -0.48 -0.00 0.00 0.82 0.00 0.00 66.70 67.07 2q42 h VAL 188 Cb 0.12 0.35 -0.00 0.00 -1.52 0.00 0.00 31.29 30.24 2q42 h VAL 188 CO -0.00 0.21 -0.02 0.25 0.02 0.00 0.00 177.57 178.03 2q42 h LEU 189 N 0.87 0.00 0.00 2.57 5.85 -1.78 0.08 115.31 122.90 2q42 h LEU 189 Ca 0.22 0.00 -0.00 0.00 0.84 0.00 0.00 57.88 58.94 2q42 h LEU 189 Cb 0.03 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.06 2q42 h LEU 189 CO -0.04 0.02 -0.00 1.56 -0.34 0.00 0.00 178.44 179.64 2q42 h GLN 190 N 0.00 -0.00 0.00 1.25 1.08 0.25 -1.49 115.11 116.20 2q42 h GLN 190 Ca -0.00 0.00 -0.04 0.00 -1.45 0.00 0.00 58.65 57.16 2q42 h GLN 190 Cb 0.65 0.00 -0.01 0.00 -0.05 0.00 0.00 27.48 28.08 2q42 h GLN 190 CO 0.00 0.86 -0.19 1.03 -0.95 0.00 0.00 178.83 179.59 2q42 h SER 191 N -0.89 0.00 0.01 1.46 0.87 -1.09 -2.88 113.55 111.03 2q42 h SER 191 Ca -0.00 0.00 -0.02 0.00 -1.23 0.00 0.00 61.79 60.54 2q42 h SER 191 Cb 0.87 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 62.83 2q42 h SER 191 CO 0.00 0.19 -0.08 0.22 -0.53 0.00 0.00 176.83 176.62 2q42 h TYR 192 N 0.00 0.06 -0.01 2.24 3.20 -1.05 -2.94 116.97 118.47 2q42 h TYR 192 Ca -0.00 -0.04 0.00 0.00 3.14 0.00 0.00 58.73 61.83 2q42 h TYR 192 Cb 0.33 -0.00 -0.00 0.00 1.54 0.00 0.00 36.73 38.60 2q42 h TYR 192 CO 0.00 0.96 0.36 0.00 -1.64 0.00 0.00 178.16 177.84 2q42 h ALA 193 N 0.08 1.38 0.11 1.82 0.00 -1.17 0.75 119.26 122.23 2q42 h ALA 193 Ca -0.01 -0.00 -0.27 0.00 0.00 0.00 0.00 54.91 54.63 2q42 h ALA 193 Cb 1.00 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.79 2q42 h ALA 193 CO 0.02 -0.36 -1.21 0.00 0.00 0.00 0.00 179.25 177.69 2q42 h ALA 194 N 1.30 0.13 -0.15 0.00 0.00 -1.49 -2.55 119.26 116.49 2q42 h ALA 194 Ca 0.01 -0.86 -0.15 0.00 0.00 0.00 0.00 54.91 53.90 2q42 h ALA 194 Cb 0.72 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 18.51 2q42 h ALA 194 CO -0.00 0.95 -0.54 1.25 0.00 0.00 0.00 179.25 180.91 2q42 h HIS 195 N 0.09 0.55 -0.02 0.00 6.17 0.61 -1.68 115.15 120.87 2q42 h HIS 195 Ca -0.13 -0.19 -0.00 0.00 0.71 0.00 0.00 60.37 60.76 2q42 h HIS 195 Cb 1.93 -0.11 -0.00 0.00 2.52 0.00 0.00 27.41 31.75 2q42 h HIS 195 CO 0.06 0.89 -0.00 0.28 0.71 0.00 0.00 177.93 179.87 2q42 h VAL 196 N 0.34 1.28 -0.11 5.26 2.07 -1.10 -1.95 116.25 122.04 2q42 h VAL 196 Ca 0.01 -0.82 0.00 0.00 0.82 0.00 0.00 66.70 66.71 2q42 h VAL 196 Cb 1.06 1.79 -0.01 0.00 -1.52 0.00 0.00 31.29 32.61 2q42 h VAL 196 CO 0.10 0.22 0.06 0.00 0.02 0.00 0.00 177.57 177.96 2q42 h ALA 197 N 0.67 0.13 -0.88 1.67 0.00 -1.47 0.38 119.26 119.76 2q42 h ALA 197 Ca 0.01 -0.00 0.14 0.00 0.00 0.00 0.00 54.91 55.05 2q42 h ALA 197 Cb 0.35 -0.03 -0.07 0.00 0.00 0.00 0.00 17.79 18.05 2q42 h ALA 197 CO 0.00 -0.39 0.57 0.93 0.00 0.00 0.00 179.25 180.36 2q42 h GLU 198 N 0.12 0.66 0.05 0.00 5.08 -1.21 -1.78 114.58 117.50 2q42 h GLU 198 Ca 0.04 -0.04 -0.00 0.00 -1.00 0.00 0.00 59.36 58.36 2q42 h GLU 198 Cb -0.00 -0.15 0.00 0.00 0.50 0.00 0.00 28.75 29.10 2q42 h GLU 198 CO -0.02 0.44 -0.02 -0.07 -1.00 0.00 0.00 179.01 178.33 2q42 h LEU 199 N 0.68 -0.06 -1.00 1.33 3.38 -0.96 -3.29 115.31 115.40 2q42 h LEU 199 Ca 0.44 -0.44 0.00 0.00 0.09 0.00 0.00 57.88 57.97 2q42 h LEU 199 Cb 0.70 0.01 0.00 0.00 0.09 0.00 0.00 40.66 41.46 2q42 h LEU 199 CO -0.19 0.63 0.17 0.54 0.09 0.00 0.00 178.44 179.67 2q42 n ARG 200 N -4.76 0.10 0.35 1.13 5.12 0.09 -0.71 116.66 117.97 2q42 n ARG 200 Ca -0.06 0.58 -0.16 0.00 -1.93 0.00 0.00 57.85 56.28 2q42 n ARG 200 Cb 0.24 -1.99 -0.08 0.00 -1.16 0.00 0.00 32.46 29.47 2q42 n ARG 200 CO 0.00 0.00 0.00 0.66 -1.93 0.00 0.00 177.63 176.36 2q42 h SER 201 N 0.00 -0.76 0.00 0.55 4.64 -1.39 -2.35 113.55 114.24 2q42 h SER 201 Ca 0.00 -0.01 0.00 0.00 -0.47 0.00 0.00 61.79 61.31 2q42 h SER 201 Cb 0.33 0.20 0.00 0.00 -0.31 0.00 0.00 62.40 62.62 2q42 h SER 201 CO 0.00 -0.43 0.00 0.29 -0.87 0.00 0.00 176.83 175.82 2q42 n LYS 202 N -5.41 0.51 -1.32 4.77 5.02 0.11 -4.79 118.16 117.04 2q42 n LYS 202 Ca -0.13 0.00 -0.11 0.00 -2.02 0.00 0.00 58.31 56.05 2q42 n LYS 202 Cb 0.37 -1.15 -0.05 0.00 -0.02 0.00 0.00 35.03 34.19 2q42 n LYS 202 CO 0.00 0.00 0.00 1.63 -0.52 0.00 0.00 177.40 178.51 2q42 n LYS 203 N -0.65 -0.89 -2.26 1.97 4.76 -0.88 -4.99 118.16 115.21 2q42 n LYS 203 Ca 0.04 0.87 -0.32 0.00 -2.87 0.00 0.00 58.31 56.03 2q42 n LYS 203 Cb 0.02 -4.88 -0.02 0.00 -1.84 0.00 0.00 35.03 28.30 2q42 n LYS 203 CO 0.00 0.00 0.00 -0.51 -1.37 0.00 0.00 177.40 175.52 2q42 s LEU 204 N -2.54 3.51 0.64 -0.35 1.43 -0.99 -4.95 118.68 115.43 2q42 s LEU 204 Ca 0.00 1.49 -0.15 0.00 -1.03 0.00 0.00 54.13 54.44 2q42 s LEU 204 Cb 0.00 -4.46 -0.01 0.00 0.03 0.00 0.00 46.19 41.75 2q42 s LEU 204 CO 0.00 -0.67 1.09 -2.84 0.23 0.00 0.00 176.35 174.16 2q42 s PRO 205 N -4.42 2.95 -0.07 1.29 0.02 -1.26 -4.05 135.00 129.46 2q42 s PRO 205 Ca 0.57 1.30 0.13 0.00 0.02 0.00 0.00 61.00 63.02 2q42 s PRO 205 Cb -0.10 -1.98 0.42 0.00 0.02 0.00 0.00 34.50 32.86 2q42 s PRO 205 CO 0.39 -1.12 1.34 0.25 -0.33 0.00 0.00 177.00 177.54 2q42 n THR 206 N -2.37 1.50 -5.04 0.99 -2.24 -1.26 -4.90 114.28 100.96 2q42 n THR 206 Ca 0.10 -1.31 -0.32 0.00 -2.27 0.00 0.00 64.05 60.25 2q42 n THR 206 Cb 0.52 0.22 -0.14 0.00 -2.10 0.00 0.00 70.33 68.83 2q42 n THR 206 CO 0.00 0.00 0.00 -0.63 -0.57 0.00 0.00 175.07 173.87 2q42 s ILE 207 N -1.68 2.66 0.50 2.28 1.09 -1.26 -4.15 121.20 120.65 2q42 s ILE 207 Ca 0.32 -0.86 -0.20 0.00 -1.10 0.00 0.00 60.65 58.81 2q42 s ILE 207 Cb 0.21 -2.01 -0.08 0.00 -1.06 0.00 0.00 42.46 39.52 2q42 s ILE 207 CO 0.14 0.58 1.05 -2.16 -0.10 0.00 0.00 174.94 174.45 2q42 s PRO 208 N -0.52 3.73 0.00 2.79 0.04 -1.26 -5.05 135.00 134.73 2q42 s PRO 208 Ca 0.07 1.37 0.00 0.00 0.04 0.00 0.00 61.00 62.48 2q42 s PRO 208 Cb -0.11 -2.08 0.00 0.00 0.04 0.00 0.00 34.50 32.34 2q42 s PRO 208 CO 0.01 -0.49 0.00 -2.37 0.04 0.00 0.00 177.00 174.19 2q42 n THR 209 N -1.06 0.00 -4.05 1.26 5.66 -0.72 -4.90 114.28 110.47 2q42 n THR 209 Ca 0.09 0.00 -0.09 0.00 -3.05 0.00 0.00 64.05 61.00 2q42 n THR 209 Cb 0.52 -1.00 -0.09 0.00 -1.55 0.00 0.00 70.33 68.22 2q42 n THR 209 CO 0.00 0.00 0.00 0.42 -3.05 0.00 0.00 175.07 172.44 2q42 s THR 210 N 1.55 0.12 0.23 1.09 -4.23 -1.26 -1.01 115.64 112.12 2q42 s THR 210 Ca 0.00 -1.65 -0.07 0.00 -1.18 0.00 0.00 61.69 58.79 2q42 s THR 210 Cb 0.00 -1.80 0.20 0.00 1.34 0.00 0.00 72.50 72.24 2q42 s THR 210 CO 0.00 -0.54 1.87 0.58 -0.54 0.00 0.00 174.62 175.99 2q42 h VAL 211 N 2.81 1.12 -0.28 2.29 2.07 -0.90 -1.14 116.25 122.22 2q42 h VAL 211 Ca -0.34 -0.35 -0.01 0.00 0.82 0.00 0.00 66.70 66.82 2q42 h VAL 211 Cb 1.20 -0.01 -0.01 0.00 -1.52 0.00 0.00 31.29 30.95 2q42 h VAL 211 CO 0.57 0.19 0.13 0.50 0.02 0.00 0.00 177.57 178.98 2q42 h LYS 212 N 1.03 0.41 -0.51 1.57 3.64 -1.48 0.22 116.57 121.45 2q42 h LYS 212 Ca 0.34 -0.06 -0.03 0.00 -1.27 0.00 0.00 60.65 59.63 2q42 h LYS 212 Cb 0.04 -0.07 -0.02 0.00 -0.41 0.00 0.00 32.23 31.76 2q42 h LYS 212 CO -0.12 0.40 0.20 1.98 -2.27 0.00 0.00 179.45 179.63 2q42 h MET 213 N 0.32 0.73 0.00 1.90 4.05 -1.81 -2.04 114.93 118.07 2q42 h MET 213 Ca 0.10 -0.11 -0.10 0.00 -0.28 0.00 0.00 59.70 59.31 2q42 h MET 213 Cb 0.13 -0.13 -0.01 0.00 -0.80 0.00 0.00 31.60 30.78 2q42 h MET 213 CO -0.01 0.61 -0.48 0.93 0.23 0.00 0.00 176.91 178.19 2q42 h GLU 214 N 0.73 0.00 -0.27 0.39 4.39 -0.54 -2.64 114.58 116.64 2q42 h GLU 214 Ca 0.17 0.00 -0.16 0.00 0.34 0.00 0.00 59.36 59.72 2q42 h GLU 214 Cb 0.15 0.00 -0.00 0.00 -0.10 0.00 0.00 28.75 28.80 2q42 h GLU 214 CO -0.02 0.48 -0.45 0.87 -1.16 0.00 0.00 179.01 178.73 2q42 h LYS 215 N 0.00 0.78 -0.56 2.33 1.57 -0.62 -2.86 116.57 117.21 2q42 h LYS 215 Ca -0.00 -0.48 0.08 0.00 -1.87 0.00 0.00 60.65 58.38 2q42 h LYS 215 Cb 1.07 0.05 -0.03 0.00 0.08 0.00 0.00 32.23 33.40 2q42 h LYS 215 CO 0.06 1.10 0.37 0.00 -0.57 0.00 0.00 179.45 180.42 2q42 h ALA 216 N 0.66 1.95 -3.00 3.86 0.00 -1.04 -3.46 119.26 118.23 2q42 h ALA 216 Ca 0.02 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.92 2q42 h ALA 216 Cb 1.05 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 18.74 2q42 h ALA 216 CO 0.10 -0.06 0.00 0.00 0.00 0.00 0.00 179.25 179.29 2q42 n ASN 218 N 0.00 -5.27 0.04 0.00 2.85 -1.26 -4.54 115.26 107.08 2q42 n ASN 218 Ca 0.00 1.25 0.01 0.00 -0.11 0.00 0.00 54.58 55.73 2q42 n ASN 218 Cb 0.00 -4.84 0.05 0.00 1.24 0.00 0.00 39.78 36.23 2q42 n ASN 218 CO 0.00 0.00 0.00 -0.81 -2.11 0.00 0.00 177.26 174.34 2q42 n PRO 219 N 0.89 0.01 -0.63 1.20 -0.04 -1.25 -1.00 135.00 134.18 2q42 n PRO 219 Ca -0.12 0.26 -0.02 0.00 -0.04 0.00 0.00 63.50 63.59 2q42 n PRO 219 Cb 0.18 -1.90 0.21 0.00 -0.04 0.00 0.00 33.50 31.95 2q42 n PRO 219 CO 0.00 0.00 0.00 1.19 -0.04 0.00 0.00 175.50 176.65 2q42 n PHE 220 N -1.36 1.51 -0.23 0.54 3.72 -1.26 -3.53 117.46 116.84 2q42 n PHE 220 Ca -0.00 -0.74 0.00 0.00 -0.05 0.00 0.00 57.45 56.66 2q42 n PHE 220 Cb 0.36 -0.47 0.00 0.00 -0.94 0.00 0.00 39.48 38.43 2q42 n PHE 220 CO 0.00 0.00 0.00 1.28 -0.05 0.00 0.00 176.76 177.99 2q42 n LEU 221 N 0.09 0.08 -2.58 4.37 4.77 -0.17 -4.84 117.00 118.72 2q42 n LEU 221 Ca 0.24 -0.16 -0.19 0.00 -0.03 0.00 0.00 56.01 55.86 2q42 n LEU 221 Cb 0.97 0.00 0.01 0.00 -2.33 0.00 0.00 43.42 42.07 2q42 n LEU 221 CO 0.26 0.02 0.05 0.54 -1.33 0.00 0.00 177.39 176.93 2q42 n ARG 222 N -0.17 2.44 0.00 3.23 1.74 -1.23 -4.90 116.66 117.77 2q42 n ARG 222 Ca 0.00 -3.98 0.05 0.00 -0.77 0.00 0.00 57.85 53.15 2q42 n ARG 222 Cb 0.06 -1.82 0.24 0.00 -1.02 0.00 0.00 32.46 29.91 2q42 n ARG 222 CO 0.00 0.00 0.00 -1.13 -1.52 0.00 0.00 177.63 174.98 2q42 n SER 223 N -0.29 0.00 -0.55 0.55 3.41 -1.25 -1.71 113.62 113.78 2q42 n SER 223 Ca 0.26 0.21 0.09 0.00 -0.26 0.00 0.00 58.87 59.17 2q42 n SER 223 Cb 0.72 -0.32 0.21 0.00 -0.26 0.00 0.00 64.21 64.55 2q42 n SER 223 CO 0.00 0.00 0.00 -1.54 -0.16 0.00 0.00 175.04 173.34 2q42 n SER 224 N -1.32 3.24 -4.66 4.04 3.41 -1.26 -4.71 113.62 112.36 2q42 n SER 224 Ca 0.04 -3.03 -0.42 0.00 -0.26 0.00 0.00 58.87 55.20 2q42 n SER 224 Cb 0.08 -0.49 -0.03 0.00 -0.26 0.00 0.00 64.21 63.52 2q42 n SER 224 CO 0.00 0.00 0.00 0.21 -0.16 0.00 0.00 175.04 175.09 2q42 s ASN 225 N -2.30 6.71 0.33 4.04 3.84 -0.70 -4.90 114.94 121.97 2q42 s ASN 225 Ca 0.38 2.09 0.08 0.00 0.21 0.00 0.00 52.86 55.61 2q42 s ASN 225 Cb 0.31 -2.53 0.79 0.00 -0.55 0.00 0.00 41.25 39.26 2q42 s ASN 225 CO 0.06 -0.91 1.81 0.74 -2.79 0.00 0.00 177.10 176.02 2q42 h THR 226 N 5.59 0.75 -0.25 -5.21 2.02 -1.95 0.41 112.91 114.27 2q42 h THR 226 Ca -0.36 -0.25 -0.02 0.00 0.77 0.00 0.00 66.41 66.55 2q42 h THR 226 Cb 1.16 -0.04 -0.01 0.00 -1.74 0.00 0.00 68.15 67.52 2q42 h THR 226 CO 0.96 0.13 0.08 0.44 0.37 0.00 0.00 175.52 177.50 2q42 h ASP 227 N 0.73 0.35 -0.52 4.18 5.19 -1.95 0.23 116.42 124.63 2q42 h ASP 227 Ca 0.53 -0.19 -0.05 0.00 -0.62 0.00 0.00 57.03 56.69 2q42 h ASP 227 Cb 0.86 -0.09 -0.02 0.00 0.18 0.00 0.00 39.33 40.26 2q42 h ASP 227 CO -0.30 0.45 0.13 0.40 -3.12 0.00 0.00 179.24 176.80 2q42 h ILE 228 N 0.23 1.24 -0.33 0.35 2.04 -1.17 -2.50 117.51 117.37 2q42 h ILE 228 Ca 0.08 -0.85 -0.05 0.00 1.00 0.00 0.00 64.86 65.04 2q42 h ILE 228 Cb 0.22 0.80 -0.02 0.00 -0.74 0.00 0.00 36.82 37.09 2q42 h ILE 228 CO -0.00 0.31 -0.02 0.03 0.00 0.00 0.00 178.15 178.47 2q42 h ARG 229 N 0.72 0.51 0.13 2.37 3.08 -0.14 -2.38 114.38 118.68 2q42 h ARG 229 Ca 0.16 -0.11 -0.01 0.00 0.07 0.00 0.00 59.98 60.10 2q42 h ARG 229 Cb 0.33 -0.07 0.00 0.00 0.08 0.00 0.00 29.97 30.31 2q42 h ARG 229 CO 0.00 0.55 -0.06 -0.09 -1.07 0.00 0.00 179.97 179.30 2q42 h ARG 230 N 0.49 -0.17 0.00 0.04 2.43 -0.27 -0.40 114.38 116.51 2q42 h ARG 230 Ca 0.10 0.01 -0.01 0.00 -0.81 0.00 0.00 59.98 59.28 2q42 h ARG 230 Cb 0.34 0.04 -0.00 0.00 -0.42 0.00 0.00 29.97 29.93 2q42 h ARG 230 CO 0.01 0.03 -0.05 0.00 -1.51 0.00 0.00 179.97 178.45 2q42 h ALA 231 N 0.51 1.73 -0.35 2.80 0.00 -1.26 -2.82 119.26 119.87 2q42 h ALA 231 Ca -0.02 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 54.85 2q42 h ALA 231 Cb 0.28 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.06 2q42 h ALA 231 CO 0.03 0.06 0.00 1.28 0.00 0.00 0.00 179.25 180.62 2q42 n LEU 232 N -4.21 3.31 -3.93 0.00 4.77 -0.91 -4.97 117.00 111.06 2q42 n LEU 232 Ca -0.03 -2.29 -0.29 0.00 -0.03 0.00 0.00 56.01 53.38 2q42 n LEU 232 Cb 0.13 -0.34 0.01 0.00 -2.33 0.00 0.00 43.42 40.89 2q42 n LEU 232 CO 0.32 0.73 -0.01 0.54 -1.33 0.00 0.00 177.39 177.64 2q42 n ARG 233 N 0.31 -4.66 -3.11 3.23 1.74 -0.61 -4.94 116.66 108.63 2q42 n ARG 233 Ca 0.15 0.53 -0.41 0.00 -0.77 0.00 0.00 57.85 57.36 2q42 n ARG 233 Cb 0.58 -5.21 -0.06 0.00 -1.02 0.00 0.00 32.46 26.75 2q42 n ARG 233 CO 0.00 0.00 0.00 0.42 -1.52 0.00 0.00 177.63 176.53 2q42 s ILE 234 N -3.48 4.93 0.60 0.55 1.01 -0.26 -5.03 121.20 119.52 2q42 s ILE 234 Ca 0.43 0.86 -0.18 0.00 0.00 0.00 0.00 60.65 61.77 2q42 s ILE 234 Cb -0.22 -4.01 -0.07 0.00 0.01 0.00 0.00 42.46 38.17 2q42 s ILE 234 CO 0.85 -0.15 0.65 -2.65 0.00 0.00 0.00 174.94 173.64 2q42 n PRO 235 N 5.90 0.57 0.22 2.79 -0.02 -1.26 -4.69 135.00 138.51 2q42 n PRO 235 Ca -0.01 0.23 0.06 0.00 -2.02 0.00 0.00 63.50 61.76 2q42 n PRO 235 Cb 0.49 -1.85 0.49 0.00 -0.02 0.00 0.00 33.50 32.61 2q42 n PRO 235 CO 0.00 0.00 0.00 1.49 1.98 0.00 0.00 175.50 178.97 2q42 h GLU 236 N 0.19 0.00 -0.29 -0.52 4.81 -1.96 -2.74 114.58 114.08 2q42 h GLU 236 Ca -0.46 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 58.77 2q42 h GLU 236 Cb 1.38 0.00 0.00 0.00 0.63 0.00 0.00 28.75 30.76 2q42 h GLU 236 CO 0.47 0.24 0.00 0.00 -0.73 0.00 0.00 179.01 178.99 2q42 n ALA 237 N -2.45 2.46 -1.81 2.92 0.00 -1.26 -4.92 120.51 115.45 2q42 n ALA 237 Ca -0.02 -0.52 -0.41 0.00 0.00 0.00 0.00 53.44 52.49 2q42 n ALA 237 Cb 0.30 -0.98 -0.02 0.00 0.00 0.00 0.00 19.45 18.75 2q42 n ALA 237 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2q42 s ALA 238 N -1.62 3.57 0.86 0.00 0.00 -1.03 -4.98 121.76 118.56 2q42 s ALA 238 Ca 0.21 1.35 -0.12 0.00 0.00 0.00 0.00 51.96 53.40 2q42 s ALA 238 Cb 0.11 -3.54 0.10 0.00 0.00 0.00 0.00 23.12 19.80 2q42 s ALA 238 CO 0.14 -0.76 1.10 0.16 0.00 0.00 0.00 175.76 176.40 2q42 s ASP 239 N -0.07 3.91 0.23 0.00 1.47 -1.26 -4.78 116.67 116.17 2q42 s ASP 239 Ca 0.54 1.35 -0.08 0.00 1.18 0.00 0.00 52.55 55.54 2q42 s ASP 239 Cb -0.42 -2.04 0.21 0.00 -0.34 0.00 0.00 42.92 40.33 2q42 s ASP 239 CO 0.51 -2.35 1.89 -0.33 0.68 0.00 0.00 175.17 175.57 2q42 h GLU 240 N -1.35 1.20 -0.31 2.11 4.39 -1.93 0.39 114.58 119.08 2q42 h GLU 240 Ca -0.49 -0.09 -0.09 0.00 0.34 0.00 0.00 59.36 59.03 2q42 h GLU 240 Cb 1.28 -0.26 -0.01 0.00 -0.10 0.00 0.00 28.75 29.66 2q42 h GLU 240 CO 0.57 0.83 -0.15 0.00 -1.16 0.00 0.00 179.01 179.10 2q42 h ALA 241 N 1.31 0.44 -0.34 3.43 0.00 -1.92 0.06 119.26 122.24 2q42 h ALA 241 Ca 0.32 -0.33 -0.00 0.00 0.00 0.00 0.00 54.91 54.90 2q42 h ALA 241 Cb -0.09 -0.11 -0.02 0.00 0.00 0.00 0.00 17.79 17.58 2q42 h ALA 241 CO -0.06 0.34 0.20 1.49 0.00 0.00 0.00 179.25 181.22 2q42 h GLU 242 N 0.41 0.45 0.17 0.00 4.81 -1.81 -1.34 114.58 117.27 2q42 h GLU 242 Ca 0.07 -0.03 -0.01 0.00 -0.13 0.00 0.00 59.36 59.26 2q42 h GLU 242 Cb 0.68 -0.10 0.00 0.00 0.63 0.00 0.00 28.75 29.96 2q42 h GLU 242 CO 0.05 0.32 -0.08 0.00 -0.73 0.00 0.00 179.01 178.57 2q42 h ALA 243 N 1.76 -0.22 -1.03 2.92 0.00 -0.71 -3.11 119.26 118.87 2q42 h ALA 243 Ca 0.12 -0.22 0.26 0.00 0.00 0.00 0.00 54.91 55.07 2q42 h ALA 243 Cb -0.02 0.09 -0.09 0.00 0.00 0.00 0.00 17.79 17.77 2q42 h ALA 243 CO -0.02 -0.31 0.66 1.25 0.00 0.00 0.00 179.25 180.83 2q42 h LEU 244 N -0.86 0.45 -0.74 0.00 6.46 -0.61 0.24 115.31 120.25 2q42 h LEU 244 Ca -0.02 0.08 -0.01 0.00 -0.12 0.00 0.00 57.88 57.81 2q42 h LEU 244 Cb 0.52 0.01 -0.04 0.00 -0.73 0.00 0.00 40.66 40.42 2q42 h LEU 244 CO 0.04 0.10 0.44 1.23 -0.62 0.00 0.00 178.44 179.62 2q42 h GLY 245 N 0.40 1.08 1.21 3.75 0.00 -1.26 -0.40 103.07 107.85 2q42 h GLY 245 Ca 0.59 -0.46 -0.18 0.00 0.00 0.00 0.00 47.33 47.28 2q42 h GLY 245 CO -0.29 0.44 -0.52 -2.22 0.00 0.00 0.00 176.54 173.96 2q42 h ILE 246 N 1.01 1.28 -0.74 2.60 2.04 -0.48 -1.77 117.51 121.45 2q42 h ILE 246 Ca 0.26 -1.71 -0.04 0.00 1.00 0.00 0.00 64.86 64.38 2q42 h ILE 246 Cb -0.02 1.60 -0.03 0.00 -0.74 0.00 0.00 36.82 37.62 2q42 h ILE 246 CO -0.05 0.56 0.32 0.40 0.00 0.00 0.00 178.15 179.38 2q42 h ILE 247 N 0.65 1.25 -0.02 -0.67 2.04 -1.16 -1.04 117.51 118.56 2q42 h ILE 247 Ca 0.02 -0.74 -0.09 0.00 1.00 0.00 0.00 64.86 65.05 2q42 h ILE 247 Cb 1.11 0.36 -0.01 0.00 -0.74 0.00 0.00 36.82 37.54 2q42 h ILE 247 CO 0.11 0.30 -0.42 -0.09 0.00 0.00 0.00 178.15 178.06 2q42 h ARG 248 N 1.05 0.04 -0.04 2.37 9.65 -0.94 0.48 114.38 126.99 2q42 h ARG 248 Ca 0.25 -0.02 -0.08 0.00 -1.10 0.00 0.00 59.98 59.03 2q42 h ARG 248 Cb 0.17 -0.00 0.00 0.00 -1.39 0.00 0.00 29.97 28.75 2q42 h ARG 248 CO -0.03 0.45 -0.29 -0.22 2.80 0.00 0.00 179.97 182.68 2q42 h LYS 249 N 0.03 0.28 -0.05 0.20 3.64 -0.95 -1.00 116.57 118.73 2q42 h LYS 249 Ca 0.00 -0.24 0.02 0.00 -1.27 0.00 0.00 60.65 59.16 2q42 h LYS 249 Cb 0.75 0.05 -0.02 0.00 -0.41 0.00 0.00 32.23 32.60 2q42 h LYS 249 CO 0.06 0.90 -0.08 0.00 -2.27 0.00 0.00 179.45 178.05 2q42 h ALA 250 N 0.38 -0.05 -0.16 5.00 0.00 -0.91 -0.95 119.26 122.57 2q42 h ALA 250 Ca -0.02 0.02 -0.02 0.00 0.00 0.00 0.00 54.91 54.89 2q42 h ALA 250 Cb 0.97 0.16 -0.01 0.00 0.00 0.00 0.00 17.79 18.91 2q42 h ALA 250 CO 0.06 -0.56 0.00 -0.22 0.00 0.00 0.00 179.25 178.53 2q42 h LYS 251 N -0.12 0.22 0.00 0.00 3.64 -0.94 -0.23 116.57 119.14 2q42 h LYS 251 Ca 0.05 -0.03 0.00 0.00 -1.27 0.00 0.00 60.65 59.40 2q42 h LYS 251 Cb 0.19 -0.04 0.00 0.00 -0.41 0.00 0.00 32.23 31.97 2q42 h LYS 251 CO -0.12 0.24 0.00 -0.44 -2.27 0.00 0.00 179.45 176.86 2q42 h ASP 252 N 0.22 0.00 0.00 4.20 5.19 0.13 -2.96 116.42 123.20 2q42 h ASP 252 Ca 0.05 0.00 -0.00 0.00 -0.62 0.00 0.00 57.03 56.46 2q42 h ASP 252 Cb 0.15 0.00 -0.00 0.00 0.18 0.00 0.00 39.33 39.66 2q42 h ASP 252 CO 0.00 0.00 -0.16 -0.67 -3.12 0.00 0.00 179.24 175.29 2q42 n ASP 253 N -2.76 1.60 -0.16 6.45 2.03 -0.26 -5.06 116.55 118.38 2q42 n ASP 253 Ca -0.00 -2.74 0.15 0.00 0.52 0.00 0.00 54.79 52.72 2q42 n ASP 253 Cb 0.18 -0.36 0.81 0.00 -0.72 0.00 0.00 41.12 41.03 2q42 n ASP 253 CO 0.00 0.00 0.00 0.33 -1.92 0.00 0.00 177.20 175.61