#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2j58 n ILE 23 N 0.00 1.38 -3.10 12.58 5.41 -1.26 -4.95 119.36 129.41 2j58 n ILE 23 Ca 0.00 -0.07 -0.40 0.00 1.00 0.00 0.00 62.75 63.28 2j58 n ILE 23 Cb 0.00 -2.03 -0.05 0.00 -0.71 0.00 0.00 39.64 36.85 2j58 n ILE 23 CO 0.00 0.00 0.00 -0.63 0.00 0.00 0.00 176.55 175.92 2j58 s ILE 24 N -2.60 5.04 0.65 1.39 1.01 -1.26 -5.04 121.20 120.39 2j58 s ILE 24 Ca -0.29 1.28 -0.14 0.00 0.00 0.00 0.00 60.65 61.50 2j58 s ILE 24 Cb 0.08 -3.98 -0.00 0.00 0.01 0.00 0.00 42.46 38.57 2j58 s ILE 24 CO 0.39 0.17 1.09 -2.84 0.00 0.00 0.00 174.94 173.75 2j58 s PRO 25 N 1.44 2.89 2.35 2.79 0.02 -1.26 -4.88 135.00 138.35 2j58 s PRO 25 Ca 0.32 1.29 0.00 0.00 0.02 0.00 0.00 61.00 62.63 2j58 s PRO 25 Cb -0.16 -1.97 0.00 0.00 0.02 0.00 0.00 34.50 32.39 2j58 s PRO 25 CO 0.13 -1.16 0.00 0.41 -0.33 0.00 0.00 177.00 176.05 2j58 n GLY 26 N -0.82 -1.07 3.23 0.52 0.00 -1.26 -4.98 105.19 100.81 2j58 n GLY 26 Ca 0.10 -1.25 -0.15 0.00 0.00 0.00 0.00 46.02 44.71 2j58 n GLY 26 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 2j58 s GLN 27 N 0.00 1.01 0.33 1.61 -0.21 -1.26 -5.15 119.66 115.99 2j58 s GLN 27 Ca 0.00 -1.33 0.07 0.00 0.02 0.00 0.00 55.36 54.12 2j58 s GLN 27 Cb 0.00 -0.70 -0.03 0.00 1.00 0.00 0.00 33.01 33.28 2j58 s GLN 27 CO 0.00 0.11 0.29 0.20 -2.12 0.00 0.00 175.29 173.76 2j58 s GLY 28 N -2.81 2.29 -0.30 3.09 0.00 -1.26 -5.15 107.32 103.18 2j58 s GLY 28 Ca 0.12 -2.05 -0.04 0.00 0.00 0.00 0.00 44.72 42.75 2j58 s GLY 28 CO 0.01 -1.45 0.67 -2.27 0.00 0.00 0.00 173.10 170.06 2j58 s LEU 29 N -3.37 -1.22 0.17 0.66 0.20 -1.26 -5.17 118.68 108.69 2j58 s LEU 29 Ca 0.40 0.96 0.04 0.00 0.69 0.00 0.00 54.13 56.23 2j58 s LEU 29 Cb 0.02 2.11 -0.05 0.00 -0.43 0.00 0.00 46.19 47.84 2j58 s LEU 29 CO 0.27 -0.23 -0.08 0.54 -0.29 0.00 0.00 176.35 176.56 2j58 s ASN 30 N 2.86 1.82 -0.11 3.68 2.20 -1.26 -5.05 114.94 119.09 2j58 s ASN 30 Ca 0.13 -1.06 0.17 0.00 -0.94 0.00 0.00 52.86 51.16 2j58 s ASN 30 Cb -0.14 -0.01 0.66 0.00 -2.00 0.00 0.00 41.25 39.76 2j58 s ASN 30 CO -0.20 -0.37 1.57 -1.54 -2.94 0.00 0.00 177.10 173.63 2j58 n SER 31 N -0.25 4.50 -0.30 3.54 3.41 -1.26 -4.67 113.62 118.58 2j58 n SER 31 Ca -0.09 -2.47 0.13 0.00 -0.26 0.00 0.00 58.87 56.18 2j58 n SER 31 Cb 0.61 -0.54 0.30 0.00 -0.26 0.00 0.00 64.21 64.33 2j58 n SER 31 CO 0.00 0.00 0.00 -0.07 -0.16 0.00 0.00 175.04 174.81 2j58 h LEU 32 N 3.62 0.31 -2.97 1.04 4.07 -2.02 -0.62 115.31 118.74 2j58 h LEU 32 Ca 0.00 0.16 0.00 0.00 0.08 0.00 0.00 57.88 58.12 2j58 h LEU 32 Cb 1.38 0.14 0.00 0.00 1.08 0.00 0.00 40.66 43.26 2j58 h LEU 32 CO 0.21 -0.01 0.00 0.54 -1.08 0.00 0.00 178.44 178.10 2j58 n ARG 33 N -5.05 2.90 -3.32 1.13 1.74 -1.26 -5.01 116.66 107.78 2j58 n ARG 33 Ca 0.22 -2.23 -0.26 0.00 -0.77 0.00 0.00 57.85 54.80 2j58 n ARG 33 Cb 0.65 -1.40 -0.02 0.00 -1.02 0.00 0.00 32.46 30.67 2j58 n ARG 33 CO 0.00 0.00 0.00 0.15 -1.52 0.00 0.00 177.63 176.26 2j58 s LYS 34 N -1.43 3.56 -0.45 5.56 1.02 -0.24 -5.03 119.74 122.72 2j58 s LYS 34 Ca 0.27 -0.14 -0.29 0.00 0.02 0.00 0.00 55.97 55.84 2j58 s LYS 34 Cb 0.17 -2.65 0.01 0.00 -0.52 0.00 0.00 37.83 34.85 2j58 s LYS 34 CO 0.14 0.17 1.39 1.21 -0.92 0.00 0.00 175.35 177.34 2j58 s ASN 35 N -3.59 6.31 -0.44 2.83 2.47 -1.26 -4.98 114.94 116.28 2j58 s ASN 35 Ca 0.42 0.67 -0.20 0.00 0.42 0.00 0.00 52.86 54.16 2j58 s ASN 35 Cb -0.10 -2.54 0.02 0.00 -1.45 0.00 0.00 41.25 37.18 2j58 s ASN 35 CO 0.34 -1.49 0.62 -0.69 -3.72 0.00 0.00 177.10 172.16 2j58 s VAL 36 N 5.52 4.85 -0.03 -5.21 1.01 -1.26 -5.04 120.40 120.24 2j58 s VAL 36 Ca 0.58 0.05 -0.30 0.00 0.00 0.00 0.00 61.98 62.31 2j58 s VAL 36 Cb -0.12 -4.19 -0.05 0.00 0.00 0.00 0.00 36.38 32.02 2j58 s VAL 36 CO 0.31 -0.59 1.36 -0.69 0.00 0.00 0.00 175.10 175.49 2j58 s VAL 37 N 2.75 3.88 -0.01 2.92 1.01 -1.26 -5.00 120.40 124.69 2j58 s VAL 37 Ca 0.21 1.23 -0.30 0.00 0.00 0.00 0.00 61.98 63.12 2j58 s VAL 37 Cb -0.14 -3.79 -0.03 0.00 0.00 0.00 0.00 36.38 32.42 2j58 s VAL 37 CO 0.18 -0.02 1.03 -1.61 0.00 0.00 0.00 175.10 174.69 2j58 s GLU 38 N 2.54 4.51 0.25 2.72 0.41 -1.26 -5.02 118.70 122.84 2j58 s GLU 38 Ca 0.62 1.49 0.08 0.00 -0.41 0.00 0.00 54.97 56.75 2j58 s GLU 38 Cb -0.29 -3.46 -0.04 0.00 -1.78 0.00 0.00 34.13 28.56 2j58 s GLU 38 CO 0.25 -0.15 0.07 -0.51 -0.49 0.00 0.00 175.26 174.43 2j58 s LEU 39 N 1.24 3.46 0.33 1.80 1.43 -1.26 -4.99 118.68 120.69 2j58 s LEU 39 Ca 0.53 -0.45 0.10 0.00 -1.03 0.00 0.00 54.13 53.27 2j58 s LEU 39 Cb -0.22 -2.00 0.85 0.00 0.03 0.00 0.00 46.19 44.85 2j58 s LEU 39 CO 0.26 0.00 1.78 -0.65 0.23 0.00 0.00 176.35 177.98 2j58 h PRO 40 N 1.87 0.63 -0.69 1.29 0.11 -2.06 -1.42 132.00 131.73 2j58 h PRO 40 Ca -0.46 -0.04 -0.41 0.00 0.11 0.00 0.00 66.00 65.20 2j58 h PRO 40 Cb 1.24 -0.14 -0.23 0.00 0.11 0.00 0.00 31.00 31.97 2j58 h PRO 40 CO 0.60 0.42 0.20 -0.40 -0.21 0.00 0.00 178.00 178.61 2j58 n ASP 41 N -4.72 4.03 -0.37 -2.05 5.75 -1.26 -4.60 116.55 113.34 2j58 n ASP 41 Ca 0.23 -3.74 0.28 0.00 -0.01 0.00 0.00 54.79 51.55 2j58 n ASP 41 Cb 0.65 -0.72 0.55 0.00 -1.03 0.00 0.00 41.12 40.57 2j58 n ASP 41 CO 0.00 0.00 0.00 0.28 -0.11 0.00 0.00 177.20 177.37 2j58 h SER 42 N 1.32 0.39 -0.43 -1.12 0.02 -1.64 -0.58 113.55 111.51 2j58 h SER 42 Ca 0.43 0.12 -0.07 0.00 -0.84 0.00 0.00 61.79 61.42 2j58 h SER 42 Cb 1.83 0.07 -0.04 0.00 0.14 0.00 0.00 62.40 64.40 2j58 h SER 42 CO 0.85 -0.04 0.09 -0.90 -1.14 0.00 0.00 176.83 175.69 2j58 n ASP 43 N -4.71 3.96 -4.76 3.07 5.68 -1.26 -5.00 116.55 113.53 2j58 n ASP 43 Ca 0.30 -2.69 -0.39 0.00 -0.50 0.00 0.00 54.79 51.50 2j58 n ASP 43 Cb 1.08 -0.64 0.02 0.00 -1.14 0.00 0.00 41.12 40.44 2j58 n ASP 43 CO 0.00 0.00 0.00 -0.72 -1.33 0.00 0.00 177.20 175.15 2j58 s TYR 44 N -2.14 2.50 -0.45 2.11 -0.85 -0.23 -4.95 117.35 113.35 2j58 s TYR 44 Ca 0.36 1.32 -0.07 0.00 -0.52 0.00 0.00 57.07 58.15 2j58 s TYR 44 Cb 0.28 -3.84 0.11 0.00 0.38 0.00 0.00 41.96 38.89 2j58 s TYR 44 CO 0.10 -2.74 0.29 0.34 -1.52 0.00 0.00 175.55 172.02 2j58 s ASP 45 N -0.65 5.55 0.24 -0.18 -1.08 -1.26 -4.97 116.67 114.32 2j58 s ASP 45 Ca 0.62 -1.94 -0.05 0.00 -0.52 0.00 0.00 52.55 50.66 2j58 s ASP 45 Cb -0.42 -1.95 0.37 0.00 -1.46 0.00 0.00 42.92 39.47 2j58 s ASP 45 CO 0.53 -0.64 1.82 0.25 0.52 0.00 0.00 175.17 177.65 2j58 h LEU 46 N 8.31 0.71 -1.83 -1.34 5.85 -1.98 -1.09 115.31 123.94 2j58 h LEU 46 Ca -0.18 0.04 0.06 0.00 0.84 0.00 0.00 57.88 58.63 2j58 h LEU 46 Cb 1.06 -0.10 -0.02 0.00 0.37 0.00 0.00 40.66 41.97 2j58 h LEU 46 CO 0.80 0.43 0.24 0.44 -0.34 0.00 0.00 178.44 180.00 2j58 h ASP 47 N 0.83 0.19 0.81 1.25 3.32 -1.95 -0.27 116.42 120.61 2j58 h ASP 47 Ca 0.39 -0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.44 2j58 h ASP 47 Cb 0.30 -0.04 0.00 0.00 0.22 0.00 0.00 39.33 39.81 2j58 h ASP 47 CO -0.22 0.12 -0.01 0.29 -1.72 0.00 0.00 179.24 177.71 2j58 n LYS 48 N -4.48 0.18 -0.14 3.56 4.76 -0.42 -3.84 118.16 117.79 2j58 n LYS 48 Ca 0.04 -0.00 0.04 0.00 -2.87 0.00 0.00 58.31 55.52 2j58 n LYS 48 Cb 0.26 -1.50 0.12 0.00 -1.84 0.00 0.00 35.03 32.07 2j58 n LYS 48 CO 0.00 0.00 0.00 1.28 -1.37 0.00 0.00 177.40 177.31 2j58 n LEU 49 N -1.41 2.71 -4.16 -0.35 4.77 -0.12 -4.85 117.00 113.60 2j58 n LEU 49 Ca 0.10 -2.04 -0.19 0.00 -0.03 0.00 0.00 56.01 53.86 2j58 n LEU 49 Cb 0.30 -0.18 -0.12 0.00 -2.33 0.00 0.00 43.42 41.08 2j58 n LEU 49 CO 0.25 0.67 -0.46 0.68 -1.33 0.00 0.00 177.39 177.21 2j58 s VAL 50 N -1.07 1.09 -0.10 4.08 -7.23 -1.21 0.33 120.40 116.28 2j58 s VAL 50 Ca 0.18 -1.20 -0.04 0.00 -1.81 0.00 0.00 61.98 59.11 2j58 s VAL 50 Cb 0.10 -1.03 -0.04 0.00 0.56 0.00 0.00 36.38 35.97 2j58 s VAL 50 CO 0.11 -0.16 0.05 0.20 -0.31 0.00 0.00 175.10 174.99 2j58 s ASN 51 N -1.55 5.60 -0.22 4.85 0.01 -0.79 -5.01 114.94 117.84 2j58 s ASN 51 Ca -0.01 0.24 -0.07 0.00 -0.71 0.00 0.00 52.86 52.30 2j58 s ASN 51 Cb -0.09 -1.69 -0.03 0.00 0.41 0.00 0.00 41.25 39.85 2j58 s ASN 51 CO 0.02 0.37 0.06 -0.69 -1.51 0.00 0.00 177.10 175.35 2j58 s VAL 52 N -0.84 4.43 -0.11 1.60 1.01 -1.26 -0.43 120.40 124.80 2j58 s VAL 52 Ca 0.13 -0.14 -0.01 0.00 0.00 0.00 0.00 61.98 61.96 2j58 s VAL 52 Cb -0.12 -3.04 -0.03 0.00 0.00 0.00 0.00 36.38 33.20 2j58 s VAL 52 CO 0.03 0.39 -0.07 -0.31 0.00 0.00 0.00 175.10 175.13 2j58 s TYR 53 N 1.14 2.93 0.00 5.22 2.02 0.11 -4.96 117.35 123.82 2j58 s TYR 53 Ca 0.04 -0.24 0.00 0.00 -0.37 0.00 0.00 57.07 56.50 2j58 s TYR 53 Cb -0.14 -1.83 0.00 0.00 -0.40 0.00 0.00 41.96 39.59 2j58 s TYR 53 CO 0.03 0.08 0.00 -0.35 -1.57 0.00 0.00 175.55 173.74 2j58 n PRO 54 N 2.98 0.00 0.00 -1.71 -0.04 -1.26 -0.66 135.00 134.31 2j58 n PRO 54 Ca -0.18 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.28 2j58 n PRO 54 Cb 0.53 0.00 0.00 0.00 -0.04 0.00 0.00 33.50 33.99 2j58 n PRO 54 CO 0.00 0.00 0.00 0.25 -0.04 0.00 0.00 175.50 175.71 2j58 n THR 56 N 0.00 0.00 -0.37 0.52 -2.24 -1.26 -4.79 114.28 106.14 2j58 n THR 56 Ca 0.00 0.00 0.06 0.00 -2.27 0.00 0.00 64.05 61.84 2j58 n THR 56 Cb 0.00 0.00 0.22 0.00 -2.10 0.00 0.00 70.33 68.45 2j58 n THR 56 CO 0.00 0.00 0.00 -0.65 -0.57 0.00 0.00 175.07 173.85 2j58 h PRO 57 N 0.00 1.02 -0.58 -0.78 0.11 -2.00 -1.77 132.00 128.00 2j58 h PRO 57 Ca 0.00 -0.06 -0.07 0.00 0.11 0.00 0.00 66.00 65.98 2j58 h PRO 57 Cb 0.00 -0.23 -0.02 0.00 0.11 0.00 0.00 31.00 30.85 2j58 h PRO 57 CO 0.00 0.68 0.09 0.78 -0.21 0.00 0.00 178.00 179.34 2j58 h GLY 58 N 1.05 1.01 0.89 -0.55 0.00 -1.99 -1.89 103.07 101.58 2j58 h GLY 58 Ca 0.48 -0.64 -0.02 0.00 0.00 0.00 0.00 47.33 47.15 2j58 h GLY 58 CO -0.24 0.59 0.08 -2.00 0.00 0.00 0.00 176.54 174.97 2j58 h LEU 59 N 0.88 0.38 -0.42 3.11 5.85 -1.72 -1.75 115.31 121.64 2j58 h LEU 59 Ca 0.18 -0.21 0.09 0.00 0.84 0.00 0.00 57.88 58.78 2j58 h LEU 59 Cb 0.39 -0.10 -0.09 0.00 0.37 0.00 0.00 40.66 41.24 2j58 h LEU 59 CO 0.01 0.48 -0.18 0.40 -0.34 0.00 0.00 178.44 178.82 2j58 h ILE 60 N 0.25 0.45 -0.64 4.05 1.08 -1.17 0.21 117.51 121.73 2j58 h ILE 60 Ca 0.08 0.00 0.04 0.00 -0.39 0.00 0.00 64.86 64.60 2j58 h ILE 60 Cb 0.24 0.45 -0.05 0.00 -3.07 0.00 0.00 36.82 34.39 2j58 h ILE 60 CO -0.00 0.00 0.37 0.44 -0.69 0.00 0.00 178.15 178.27 2j58 h ASP 61 N -0.09 0.57 -0.48 1.72 3.32 -1.15 -1.35 116.42 118.95 2j58 h ASP 61 Ca 0.20 0.02 -0.01 0.00 0.02 0.00 0.00 57.03 57.26 2j58 h ASP 61 Cb 0.41 -0.10 -0.02 0.00 0.22 0.00 0.00 39.33 39.83 2j58 h ASP 61 CO -0.48 0.39 0.27 -0.61 -1.72 0.00 0.00 179.24 177.08 2j58 h GLN 62 N 0.71 0.67 0.00 3.56 4.15 -0.67 -2.88 115.11 120.64 2j58 h GLN 62 Ca 0.27 -0.08 0.00 0.00 0.77 0.00 0.00 58.65 59.62 2j58 h GLN 62 Cb 0.11 -0.13 0.00 0.00 0.21 0.00 0.00 27.48 27.67 2j58 h GLN 62 CO -0.15 0.52 0.00 1.28 -1.93 0.00 0.00 178.83 178.56 2j58 n LEU 63 N -4.67 0.80 -4.68 -2.39 4.77 0.00 -4.86 117.00 105.97 2j58 n LEU 63 Ca 0.02 0.61 -0.45 0.00 -0.03 0.00 0.00 56.01 56.16 2j58 n LEU 63 Cb 0.08 -0.40 -0.03 0.00 -2.33 0.00 0.00 43.42 40.73 2j58 n LEU 63 CO 0.36 -0.32 1.17 -1.14 -1.33 0.00 0.00 177.39 176.13 2j58 n ARG 64 N -2.29 2.23 -1.76 3.23 0.63 -0.55 -4.91 116.66 113.24 2j58 n ARG 64 Ca 0.04 0.80 -0.41 0.00 -0.92 0.00 0.00 57.85 57.36 2j58 n ARG 64 Cb 0.37 -2.55 -0.01 0.00 0.45 0.00 0.00 32.46 30.72 2j58 n ARG 64 CO 0.00 0.00 0.00 -2.30 -2.51 0.00 0.00 177.63 172.82 2j58 n PRO 65 N 2.97 2.64 -1.66 -0.14 -0.02 -1.26 -4.96 135.00 132.56 2j58 n PRO 65 Ca 0.15 0.93 -0.44 0.00 -2.02 0.00 0.00 63.50 62.11 2j58 n PRO 65 Cb 0.31 -2.67 -0.02 0.00 -0.02 0.00 0.00 33.50 31.10 2j58 n PRO 65 CO 0.00 0.00 0.00 0.39 1.98 0.00 0.00 175.50 177.87 2j58 n GLU 66 N 1.11 1.94 -1.89 -0.52 -0.58 -1.26 -4.91 120.64 114.53 2j58 n GLU 66 Ca 0.04 0.69 -0.38 0.00 -0.42 0.00 0.00 57.16 57.09 2j58 n GLU 66 Cb 0.38 -2.28 0.03 0.00 -0.57 0.00 0.00 31.44 28.99 2j58 n GLU 66 CO 0.00 0.00 0.00 -2.14 -0.48 0.00 0.00 177.13 174.51 2j58 s PRO 67 N -0.95 3.31 -0.35 3.49 0.02 -1.26 -4.97 135.00 134.29 2j58 s PRO 67 Ca 0.64 2.15 -0.17 0.00 0.02 0.00 0.00 61.00 63.64 2j58 s PRO 67 Cb -0.64 -2.32 -0.00 0.00 0.02 0.00 0.00 34.50 31.55 2j58 s PRO 67 CO 0.54 -1.03 0.43 0.08 -0.33 0.00 0.00 177.00 176.70 2j58 s VAL 68 N -1.35 5.10 0.25 3.83 1.01 -1.26 -5.07 120.40 122.91 2j58 s VAL 68 Ca 0.69 0.11 0.06 0.00 0.00 0.00 0.00 61.98 62.84 2j58 s VAL 68 Cb -0.38 -3.90 -0.03 0.00 0.00 0.00 0.00 36.38 32.07 2j58 s VAL 68 CO 0.45 -0.18 0.31 0.27 0.00 0.00 0.00 175.10 175.96 2j58 s ILE 69 N 2.18 4.90 0.15 2.22 -4.36 -1.26 -4.93 121.20 120.10 2j58 s ILE 69 Ca 0.14 -1.13 -0.31 0.00 -0.26 0.00 0.00 60.65 59.10 2j58 s ILE 69 Cb -0.16 -3.68 -0.08 0.00 1.25 0.00 0.00 42.46 39.79 2j58 s ILE 69 CO 0.13 -0.32 1.36 0.00 0.24 0.00 0.00 174.94 176.34 2j58 s ALA 70 N -2.05 3.57 0.08 2.27 0.00 -1.10 -4.18 121.76 120.36 2j58 s ALA 70 Ca 0.34 1.13 0.04 0.00 0.00 0.00 0.00 51.96 53.47 2j58 s ALA 70 Cb -0.09 -3.52 -0.03 0.00 0.00 0.00 0.00 23.12 19.48 2j58 s ALA 70 CO 0.28 -0.59 -0.10 1.03 0.00 0.00 0.00 175.76 176.37 2j58 s ARG 71 N 0.57 0.80 0.32 0.00 0.52 -0.65 -4.89 118.95 115.61 2j58 s ARG 71 Ca 0.61 -1.07 0.03 0.00 -0.52 0.00 0.00 55.73 54.78 2j58 s ARG 71 Cb -0.37 -0.55 -0.03 0.00 0.52 0.00 0.00 34.95 34.53 2j58 s ARG 71 CO 0.34 0.09 0.49 -1.12 0.02 0.00 0.00 175.30 175.13 2j58 s SER 72 N -2.21 6.21 -0.60 0.23 0.01 -1.26 -1.45 113.70 114.63 2j58 s SER 72 Ca 0.02 0.24 0.04 0.00 1.31 0.00 0.00 55.95 57.56 2j58 s SER 72 Cb -0.05 -1.83 0.16 0.00 0.21 0.00 0.00 66.02 64.51 2j58 s SER 72 CO 0.00 -0.29 0.41 0.21 0.41 0.00 0.00 173.24 173.99 2j58 s ASN 73 N -4.05 4.01 0.36 2.44 3.84 -1.26 -4.45 114.94 115.83 2j58 s ASN 73 Ca 0.40 -3.47 0.09 0.00 0.21 0.00 0.00 52.86 50.09 2j58 s ASN 73 Cb -0.09 -1.35 0.69 0.00 -0.55 0.00 0.00 41.25 39.95 2j58 s ASN 73 CO 0.33 -0.14 1.85 -0.65 -2.79 0.00 0.00 177.10 175.71 2j58 h PRO 74 N 5.73 0.23 -0.72 0.43 0.11 -1.98 -1.45 132.00 134.35 2j58 h PRO 74 Ca 0.12 -0.07 -0.02 0.00 0.11 0.00 0.00 66.00 66.15 2j58 h PRO 74 Cb 0.82 -0.02 -0.03 0.00 0.11 0.00 0.00 31.00 31.87 2j58 h PRO 74 CO 0.62 0.44 0.38 1.96 -0.21 0.00 0.00 178.00 181.20 2j58 h GLN 75 N 0.21 1.01 -0.16 1.05 7.50 -2.00 -2.20 115.11 120.52 2j58 h GLN 75 Ca 0.04 -0.13 -0.22 0.00 0.50 0.00 0.00 58.65 58.84 2j58 h GLN 75 Cb 0.51 -0.19 0.01 0.00 0.05 0.00 0.00 27.48 27.86 2j58 h GLN 75 CO 0.03 0.77 -0.77 1.25 -1.50 0.00 0.00 178.83 178.62 2j58 h LEU 76 N 0.99 0.93 -1.69 1.46 5.85 -1.73 -2.67 115.31 118.46 2j58 h LEU 76 Ca 0.25 -0.61 -0.01 0.00 0.84 0.00 0.00 57.88 58.35 2j58 h LEU 76 Cb 0.06 -0.28 -0.01 0.00 0.37 0.00 0.00 40.66 40.80 2j58 h LEU 76 CO -0.04 1.41 0.07 0.44 -0.34 0.00 0.00 178.44 179.98 2j58 h ASP 77 N 0.54 0.24 0.32 1.25 3.32 -1.17 0.72 116.42 121.63 2j58 h ASP 77 Ca -0.05 -0.02 -0.20 0.00 0.02 0.00 0.00 57.03 56.79 2j58 h ASP 77 Cb 1.39 -0.06 -0.00 0.00 0.22 0.00 0.00 39.33 40.88 2j58 h ASP 77 CO 0.16 0.23 -0.81 0.78 -1.72 0.00 0.00 179.24 177.88 2j58 h ASN 78 N 0.27 0.47 0.06 6.45 2.35 -1.31 -2.31 115.58 121.57 2j58 h ASN 78 Ca 0.07 -0.34 -0.08 0.00 -0.55 0.00 0.00 56.30 55.40 2j58 h ASN 78 Cb 0.07 -0.14 -0.01 0.00 0.05 0.00 0.00 38.32 38.29 2j58 h ASN 78 CO -0.01 1.10 -0.26 -0.07 -1.65 0.00 0.00 177.43 176.54 2j58 h LEU 79 N 0.24 0.32 -0.55 1.61 4.07 -0.86 -2.54 115.31 117.60 2j58 h LEU 79 Ca -0.05 -0.10 -0.15 0.00 0.08 0.00 0.00 57.88 57.66 2j58 h LEU 79 Cb 1.40 -0.09 -0.02 0.00 1.08 0.00 0.00 40.66 43.04 2j58 h LEU 79 CO 0.14 0.58 -0.72 -0.07 -1.08 0.00 0.00 178.44 177.29 2j58 h LEU 80 N 0.29 0.00 -0.51 1.67 3.38 -0.79 -2.26 115.31 117.09 2j58 h LEU 80 Ca 0.04 0.00 -0.14 0.00 0.09 0.00 0.00 57.88 57.88 2j58 h LEU 80 Cb 0.61 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 41.34 2j58 h LEU 80 CO 0.04 0.72 -0.65 0.50 0.09 0.00 0.00 178.44 179.14 2j58 h LYS 81 N 0.00 0.00 -0.37 1.13 3.64 -1.09 -3.03 116.57 116.85 2j58 h LYS 81 Ca -0.01 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.37 2j58 h LYS 81 Cb 1.28 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 33.10 2j58 h LYS 81 CO 0.09 0.65 0.00 -1.13 -2.27 0.00 0.00 179.45 176.79 2j58 n SER 82 N -3.55 3.15 -4.66 4.20 3.41 -0.99 -5.04 113.62 110.15 2j58 n SER 82 Ca -0.00 -2.12 -0.45 0.00 -0.26 0.00 0.00 58.87 56.04 2j58 n SER 82 Cb 0.69 -0.29 -0.02 0.00 -0.26 0.00 0.00 64.21 64.33 2j58 n SER 82 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2j58 n TYR 83 N 0.51 2.06 -3.84 7.33 9.36 -0.85 -5.01 117.16 126.71 2j58 n TYR 83 Ca 0.14 0.49 -0.12 0.00 3.32 0.00 0.00 57.90 61.73 2j58 n TYR 83 Cb 0.50 -2.42 -0.10 0.00 -0.63 0.00 0.00 39.34 36.68 2j58 n TYR 83 CO 0.00 0.00 0.00 -1.21 0.22 0.00 0.00 176.86 175.87 2j58 s GLU 84 N -0.77 0.44 -0.13 2.98 2.02 -1.26 -5.08 118.70 116.90 2j58 s GLU 84 Ca 0.65 -0.21 -0.12 0.00 0.02 0.00 0.00 54.97 55.31 2j58 s GLU 84 Cb -0.65 0.19 -0.05 0.00 0.10 0.00 0.00 34.13 33.72 2j58 s GLU 84 CO 0.53 -0.10 0.25 -0.47 0.02 0.00 0.00 175.26 175.49 2j58 s TYR 85 N -1.01 3.52 -0.11 1.61 5.04 -1.26 -5.03 117.35 120.11 2j58 s TYR 85 Ca -0.11 0.60 -0.00 0.00 -2.44 0.00 0.00 57.07 55.12 2j58 s TYR 85 Cb -0.06 -2.22 -0.02 0.00 0.35 0.00 0.00 41.96 40.01 2j58 s TYR 85 CO 0.02 0.41 -0.10 1.03 -1.34 0.00 0.00 175.55 175.57 2j58 s ARG 86 N -0.09 3.18 0.59 4.97 0.52 -1.26 -4.41 118.95 122.45 2j58 s ARG 86 Ca 0.16 -0.63 -0.20 0.00 -0.52 0.00 0.00 55.73 54.54 2j58 s ARG 86 Cb -0.13 -2.64 -0.03 0.00 0.52 0.00 0.00 34.95 32.67 2j58 s ARG 86 CO 0.04 0.37 1.33 -0.89 0.02 0.00 0.00 175.30 176.17 2j58 n ILE 87 N 3.08 4.31 -4.28 1.52 5.41 -0.12 -4.72 119.36 124.56 2j58 n ILE 87 Ca -0.18 -0.50 -0.15 0.00 1.00 0.00 0.00 62.75 62.92 2j58 n ILE 87 Cb 0.53 -1.59 -0.10 0.00 -0.71 0.00 0.00 39.64 37.77 2j58 n ILE 87 CO 0.00 0.00 0.00 -0.83 0.00 0.00 0.00 176.55 175.72 2j58 s GLY 88 N -1.11 1.52 0.10 7.39 0.00 -1.26 -0.61 107.32 113.34 2j58 s GLY 88 Ca 0.76 -1.75 -0.35 0.00 0.00 0.00 0.00 44.72 43.38 2j58 s GLY 88 CO 0.45 -1.56 1.54 -0.62 0.00 0.00 0.00 173.10 172.92 2j58 n VAL 89 N -0.37 0.06 0.00 1.40 0.31 -1.26 -1.96 118.33 116.51 2j58 n VAL 89 Ca -0.03 -0.01 0.00 0.00 -0.01 0.00 0.00 64.34 64.29 2j58 n VAL 89 Cb 0.65 -1.35 0.00 0.00 -0.91 0.00 0.00 33.84 32.23 2j58 n VAL 89 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 2j58 n GLY 90 N 3.28 3.06 3.63 2.92 0.00 -0.39 -4.01 105.19 113.68 2j58 n GLY 90 Ca 0.18 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.85 2j58 n GLY 90 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 2j58 n ASP 91 N 0.00 0.58 -4.36 1.61 8.00 -0.83 -4.53 116.55 117.01 2j58 n ASP 91 Ca 0.00 0.64 -0.34 0.00 0.71 0.00 0.00 54.79 55.79 2j58 n ASP 91 Cb 0.00 -1.43 -0.14 0.00 -0.02 0.00 0.00 41.12 39.53 2j58 n ASP 91 CO 0.00 0.00 0.00 -0.69 -0.39 0.00 0.00 177.20 176.12 2j58 s VAL 92 N -1.91 3.39 0.00 2.53 1.01 -0.47 -0.95 120.40 124.00 2j58 s VAL 92 Ca 0.73 -0.51 0.00 0.00 0.00 0.00 0.00 61.98 62.20 2j58 s VAL 92 Cb -0.33 -2.50 0.00 0.00 0.00 0.00 0.00 36.38 33.55 2j58 s VAL 92 CO 0.51 0.46 0.00 0.18 0.00 0.00 0.00 175.10 176.25 2j58 n LEU 93 N 4.23 0.00 0.00 3.92 4.32 0.09 0.46 117.00 130.02 2j58 n LEU 93 Ca -0.18 0.00 0.00 0.00 -0.02 0.00 0.00 56.01 55.81 2j58 n LEU 93 Cb 0.52 0.00 0.00 0.00 -1.62 0.00 0.00 43.42 42.32 2j58 n LEU 93 CO 0.30 0.00 0.00 0.52 -1.22 0.00 0.00 177.39 176.99 2j58 n VAL 95 N 0.00 0.00 -3.86 4.08 0.31 -1.26 -1.14 118.33 116.46 2j58 n VAL 95 Ca 0.00 0.00 -0.36 0.00 -0.01 0.00 0.00 64.34 63.97 2j58 n VAL 95 Cb 0.00 0.00 -0.11 0.00 -0.91 0.00 0.00 33.84 32.82 2j58 n VAL 95 CO 0.00 0.00 0.00 -0.89 -1.32 0.00 0.00 176.83 174.62 2j58 s THR 96 N 0.00 4.64 -0.30 2.52 2.01 0.17 -4.52 115.64 120.16 2j58 s THR 96 Ca 0.00 -0.07 0.01 0.00 0.31 0.00 0.00 61.69 61.93 2j58 s THR 96 Cb 0.00 -3.14 0.07 0.00 0.01 0.00 0.00 72.50 69.44 2j58 s THR 96 CO 0.00 0.38 -0.02 -0.69 -0.69 0.00 0.00 174.62 173.61 2j58 s VAL 97 N 1.08 2.61 0.34 3.82 1.01 -1.26 -0.48 120.40 127.52 2j58 s VAL 97 Ca 0.05 -1.68 -0.29 0.00 0.00 0.00 0.00 61.98 60.06 2j58 s VAL 97 Cb -0.14 -2.60 -0.11 0.00 0.00 0.00 0.00 36.38 33.53 2j58 s VAL 97 CO 0.03 -0.20 1.47 0.26 0.00 0.00 0.00 175.10 176.66 2j58 s TRP 98 N 1.14 2.73 0.00 5.22 0.51 -0.25 -1.42 118.94 126.88 2j58 s TRP 98 Ca -0.03 1.12 0.00 0.00 -2.12 0.00 0.00 56.10 55.07 2j58 s TRP 98 Cb -0.20 -3.96 0.00 0.00 -0.81 0.00 0.00 33.47 28.50 2j58 s TRP 98 CO -0.04 -2.89 0.00 -0.25 -0.51 0.00 0.00 176.95 173.27 2j58 n ASP 99 N 1.01 -2.82 -3.41 2.95 8.00 -1.26 -4.66 116.55 116.36 2j58 n ASP 99 Ca 0.03 0.00 -0.26 0.00 0.71 0.00 0.00 54.79 55.27 2j58 n ASP 99 Cb 0.39 -1.48 -0.09 0.00 -0.02 0.00 0.00 41.12 39.93 2j58 n ASP 99 CO 0.00 0.00 0.00 1.41 -0.39 0.00 0.00 177.20 178.22 2j58 n HIS 100 N -2.40 0.68 0.25 1.24 8.25 -0.50 -4.93 115.22 117.80 2j58 n HIS 100 Ca 0.00 -3.69 0.11 0.00 -0.26 0.00 0.00 57.72 53.88 2j58 n HIS 100 Cb 0.14 -0.22 0.65 0.00 1.12 0.00 0.00 29.99 31.68 2j58 n HIS 100 CO 0.00 0.00 0.00 -1.35 0.64 0.00 0.00 176.34 175.63 2j58 h PRO 101 N 4.80 0.00 0.00 -0.41 0.11 -1.92 -0.02 132.00 134.56 2j58 h PRO 101 Ca 0.17 0.00 -0.03 0.00 0.11 0.00 0.00 66.00 66.25 2j58 h PRO 101 Cb 0.83 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 31.94 2j58 h PRO 101 CO 0.53 0.16 -0.13 1.05 -0.21 0.00 0.00 178.00 179.40 2j58 h GLU 102 N 0.00 0.00 0.05 1.05 9.09 -1.92 0.28 114.58 123.13 2j58 h GLU 102 Ca -0.00 0.00 -0.37 0.00 0.05 0.00 0.00 59.36 59.04 2j58 h GLU 102 Cb 0.40 0.00 -0.04 0.00 -1.65 0.00 0.00 28.75 27.45 2j58 h GLU 102 CO 0.02 0.13 -2.11 1.28 0.05 0.00 0.00 179.01 178.38 2j58 n LEU 103 N -3.52 2.52 -0.10 3.06 4.77 -0.18 -3.94 117.00 119.61 2j58 n LEU 103 Ca -0.01 0.16 -0.11 0.00 -0.03 0.00 0.00 56.01 56.01 2j58 n LEU 103 Cb 0.27 -0.99 -0.03 0.00 -2.33 0.00 0.00 43.42 40.34 2j58 n LEU 103 CO 0.30 0.75 0.78 0.74 -1.33 0.00 0.00 177.39 178.62 2j58 h THR 104 N -0.29 1.25 -2.09 -5.08 2.02 -1.00 -3.38 112.91 104.34 2j58 h THR 104 Ca -0.50 -0.92 -0.57 0.00 0.77 0.00 0.00 66.41 65.19 2j58 h THR 104 Cb 1.81 1.27 -0.40 0.00 -1.74 0.00 0.00 68.15 69.09 2j58 h THR 104 CO -0.09 0.30 -0.88 0.35 0.37 0.00 0.00 175.52 175.56 2j58 n THR 105 N -4.58 0.78 0.25 3.16 -2.24 0.99 -4.93 114.28 107.71 2j58 n THR 105 Ca -0.03 -4.63 0.09 0.00 -2.27 0.00 0.00 64.05 57.21 2j58 n THR 105 Cb 0.25 -1.87 0.65 0.00 -2.10 0.00 0.00 70.33 67.25 2j58 n THR 105 CO 0.00 0.00 0.00 1.55 -0.57 0.00 0.00 175.07 176.05 2j58 h PRO 106 N 3.95 0.00 -0.52 -0.78 0.13 -1.70 -2.17 132.00 130.90 2j58 h PRO 106 Ca 0.13 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.26 2j58 h PRO 106 Cb 0.78 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.91 2j58 h PRO 106 CO 0.64 0.09 0.00 0.00 -0.23 0.00 0.00 178.00 178.50 2j58 n ALA 107 N -2.45 3.57 0.00 -0.56 0.00 -1.26 -5.07 120.51 114.74 2j58 n ALA 107 Ca -0.03 -1.94 0.00 0.00 0.00 0.00 0.00 53.44 51.47 2j58 n ALA 107 Cb 0.17 -1.02 0.00 0.00 0.00 0.00 0.00 19.45 18.60 2j58 n ALA 107 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2j58 n GLY 108 N 0.48 -2.97 0.34 0.00 0.00 -0.82 -4.75 105.19 97.47 2j58 n GLY 108 Ca 0.26 -1.80 0.09 0.00 0.00 0.00 0.00 46.02 44.57 2j58 n GLY 108 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2j58 n GLN 109 N -0.40 1.47 0.01 1.61 10.64 -1.26 -4.55 117.38 124.89 2j58 n GLN 109 Ca 0.00 -0.72 -0.22 0.00 -1.83 0.00 0.00 57.00 54.24 2j58 n GLN 109 Cb 0.00 -1.34 -0.14 0.00 -0.86 0.00 0.00 30.24 27.90 2j58 n GLN 109 CO 0.00 0.00 0.00 -0.92 -1.83 0.00 0.00 177.06 174.31 2j58 h TYR 110 N 1.66 0.50 -4.08 2.61 3.20 -2.00 -3.47 116.97 115.39 2j58 h TYR 110 Ca 0.00 -0.36 -0.51 0.00 3.14 0.00 0.00 58.73 61.00 2j58 h TYR 110 Cb 0.59 -0.02 0.08 0.00 1.54 0.00 0.00 36.73 38.92 2j58 h TYR 110 CO 0.00 1.78 0.45 1.03 -1.64 0.00 0.00 178.16 179.78 2j58 s ARG 111 N -2.56 3.33 0.67 1.82 0.52 -1.26 -4.99 118.95 116.48 2j58 s ARG 111 Ca -0.22 1.69 -0.15 0.00 -0.52 0.00 0.00 55.73 56.53 2j58 s ARG 111 Cb 0.06 -2.05 0.01 0.00 0.52 0.00 0.00 34.95 33.49 2j58 s ARG 111 CO 0.77 -0.89 1.12 -1.54 0.02 0.00 0.00 175.30 174.78 2j58 s SER 112 N -1.66 4.97 0.46 0.23 1.04 -1.26 -4.85 113.70 112.62 2j58 s SER 112 Ca 0.73 2.04 0.12 0.00 0.48 0.00 0.00 55.95 59.31 2j58 s SER 112 Cb -0.26 -2.55 1.03 0.00 0.10 0.00 0.00 66.02 64.33 2j58 s SER 112 CO 0.30 -1.72 2.06 0.00 0.98 0.00 0.00 173.24 174.85 2j58 h ALA 113 N -0.05 1.79 0.00 5.32 0.00 -1.94 -1.36 119.26 123.02 2j58 h ALA 113 Ca -0.47 -0.07 -0.07 0.00 0.00 0.00 0.00 54.91 54.30 2j58 h ALA 113 Cb 1.25 -0.06 -0.01 0.00 0.00 0.00 0.00 17.79 18.97 2j58 h ALA 113 CO 0.53 0.17 -0.35 0.66 0.00 0.00 0.00 179.25 180.26 2j58 h SER 114 N 0.19 0.00 1.60 0.00 4.64 -1.92 0.35 113.55 118.41 2j58 h SER 114 Ca 0.05 0.00 -0.07 0.00 -0.47 0.00 0.00 61.79 61.30 2j58 h SER 114 Cb 0.10 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.18 2j58 h SER 114 CO -0.00 0.35 -0.41 0.44 -0.87 0.00 0.00 176.83 176.34 2j58 h ASP 115 N 0.00 0.00 0.00 4.97 3.32 -1.64 -3.36 116.42 119.71 2j58 h ASP 115 Ca -0.00 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.05 2j58 h ASP 115 Cb 0.77 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.32 2j58 h ASP 115 CO 0.05 0.32 0.00 0.35 -1.72 0.00 0.00 179.24 178.24 2j58 n THR 116 N -3.14 0.83 -1.99 0.35 -2.24 -0.72 -4.98 114.28 102.38 2j58 n THR 116 Ca 0.02 -0.85 -0.12 0.00 -2.27 0.00 0.00 64.05 60.82 2j58 n THR 116 Cb 0.67 0.59 0.08 0.00 -2.10 0.00 0.00 70.33 69.56 2j58 n THR 116 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2j58 n GLY 117 N -0.42 -0.17 3.54 3.38 0.00 0.12 -4.95 105.19 106.69 2j58 n GLY 117 Ca 0.00 -1.86 -0.41 0.00 0.00 0.00 0.00 46.02 43.75 2j58 n GLY 117 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 2j58 s ASN 118 N -3.12 6.18 0.25 1.61 0.01 -0.29 -4.83 114.94 114.74 2j58 s ASN 118 Ca 0.34 -0.29 -0.30 0.00 -0.71 0.00 0.00 52.86 51.90 2j58 s ASN 118 Cb -0.01 -2.20 -0.09 0.00 0.41 0.00 0.00 41.25 39.36 2j58 s ASN 118 CO 0.23 -0.36 1.23 0.26 -1.51 0.00 0.00 177.10 176.94 2j58 s TRP 119 N 2.02 3.34 -0.42 2.20 0.52 -1.26 -0.73 118.94 124.61 2j58 s TRP 119 Ca 0.12 1.44 -0.27 0.00 0.02 0.00 0.00 56.10 57.41 2j58 s TRP 119 Cb -0.17 -3.49 0.02 0.00 -1.15 0.00 0.00 33.47 28.68 2j58 s TRP 119 CO 0.12 -1.36 0.99 0.08 0.02 0.00 0.00 176.95 176.79 2j58 s VAL 120 N -0.54 4.46 0.88 4.03 1.01 -0.13 -4.37 120.40 125.75 2j58 s VAL 120 Ca 0.51 1.11 -0.12 0.00 0.00 0.00 0.00 61.98 63.48 2j58 s VAL 120 Cb -0.35 -4.43 0.12 0.00 0.00 0.00 0.00 36.38 31.72 2j58 s VAL 120 CO 0.42 -0.73 1.16 0.20 0.00 0.00 0.00 175.10 176.15 2j58 s ASN 121 N 2.10 3.83 0.58 3.32 0.02 0.61 -1.26 114.94 124.15 2j58 s ASN 121 Ca 0.41 0.86 0.28 0.00 -1.02 0.00 0.00 52.86 53.39 2j58 s ASN 121 Cb -0.10 -1.38 1.71 0.00 0.02 0.00 0.00 41.25 41.50 2j58 s ASN 121 CO 0.24 -2.34 2.17 0.77 0.02 0.00 0.00 177.10 177.96 2j58 h SER 122 N -1.35 0.00 -0.08 -1.22 4.64 -1.95 0.24 113.55 113.83 2j58 h SER 122 Ca -0.48 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.84 2j58 h SER 122 Cb 1.33 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.42 2j58 h SER 122 CO 0.62 0.00 0.00 -0.90 -0.87 0.00 0.00 176.83 175.68 2j58 n ASP 123 N -3.87 0.68 0.00 4.97 5.75 -1.26 -4.88 116.55 117.94 2j58 n ASP 123 Ca -0.01 -1.59 0.00 0.00 -0.01 0.00 0.00 54.79 53.18 2j58 n ASP 123 Cb 0.21 -0.05 0.00 0.00 -1.03 0.00 0.00 41.12 40.25 2j58 n ASP 123 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 2j58 n GLY 124 N 0.90 0.67 3.65 6.12 0.00 0.07 -4.96 105.19 111.64 2j58 n GLY 124 Ca 0.14 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 45.92 2j58 n GLY 124 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2j58 s THR 125 N -2.14 3.50 0.29 2.61 -4.23 -1.25 -0.75 115.64 113.67 2j58 s THR 125 Ca 0.00 -1.80 0.08 0.00 -1.18 0.00 0.00 61.69 58.79 2j58 s THR 125 Cb 0.00 -2.84 -0.03 0.00 1.34 0.00 0.00 72.50 70.96 2j58 s THR 125 CO 0.00 -0.31 0.19 0.27 -0.54 0.00 0.00 174.62 174.23 2j58 s ILE 126 N -2.17 3.81 -0.10 2.99 -4.36 -0.46 -0.28 121.20 120.62 2j58 s ILE 126 Ca 0.30 -1.51 -0.16 0.00 -0.26 0.00 0.00 60.65 59.03 2j58 s ILE 126 Cb -0.07 -3.19 -0.05 0.00 1.25 0.00 0.00 42.46 40.40 2j58 s ILE 126 CO 0.19 -0.27 0.39 0.12 0.24 0.00 0.00 174.94 175.61 2j58 s PHE 127 N -2.26 3.55 -0.04 1.37 5.36 -1.26 -1.10 117.98 123.60 2j58 s PHE 127 Ca 0.36 0.81 0.04 0.00 -0.96 0.00 0.00 56.93 57.17 2j58 s PHE 127 Cb -0.06 -2.40 0.00 0.00 -0.34 0.00 0.00 43.02 40.22 2j58 s PHE 127 CO 0.24 0.33 -0.15 -0.47 -1.46 0.00 0.00 175.22 173.71 2j58 s TYR 128 N 0.10 1.51 0.42 10.12 5.04 0.41 -4.96 117.35 129.98 2j58 s TYR 128 Ca 0.22 -0.45 -0.24 0.00 -2.44 0.00 0.00 57.07 54.16 2j58 s TYR 128 Cb -0.15 -1.04 -0.11 0.00 0.35 0.00 0.00 41.96 41.02 2j58 s TYR 128 CO 0.09 -0.17 1.02 -0.35 -1.34 0.00 0.00 175.55 174.79 2j58 n PRO 129 N 3.29 1.36 0.00 4.97 -0.04 -1.26 -0.58 135.00 142.74 2j58 n PRO 129 Ca -0.19 0.49 0.00 0.00 -0.04 0.00 0.00 63.50 63.76 2j58 n PRO 129 Cb 0.53 -2.05 0.00 0.00 -0.04 0.00 0.00 33.50 31.94 2j58 n PRO 129 CO 0.00 0.00 0.00 0.66 -0.04 0.00 0.00 175.50 176.12 2j58 n TYR 130 N -0.47 0.00 0.41 0.54 4.01 -1.26 -4.38 117.16 116.01 2j58 n TYR 130 Ca 0.09 0.00 0.12 0.00 -0.16 0.00 0.00 57.90 57.95 2j58 n TYR 130 Cb 0.39 0.00 0.07 0.00 -0.31 0.00 0.00 39.34 39.49 2j58 n TYR 130 CO 0.00 0.00 0.00 0.44 -0.46 0.00 0.00 176.86 176.84 2j58 n ILE 131 N 0.00 0.38 -3.17 -0.72 -5.35 -1.16 -5.05 119.36 104.30 2j58 n ILE 131 Ca 0.00 -0.36 0.00 0.00 -0.27 0.00 0.00 62.75 62.12 2j58 n ILE 131 Cb 0.00 -0.11 0.00 0.00 -1.74 0.00 0.00 39.64 37.79 2j58 n ILE 131 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 2j58 n GLY 132 N 1.29 0.45 3.68 3.28 0.00 0.25 -4.86 105.19 109.29 2j58 n GLY 132 Ca 0.02 -1.03 -0.42 0.00 0.00 0.00 0.00 46.02 44.58 2j58 n GLY 132 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2j58 s LYS 133 N 0.00 4.35 -0.19 1.61 1.02 -1.26 -0.44 119.74 124.81 2j58 s LYS 133 Ca 0.00 1.62 -0.01 0.00 0.02 0.00 0.00 55.97 57.60 2j58 s LYS 133 Cb 0.00 -3.58 0.01 0.00 -0.52 0.00 0.00 37.83 33.74 2j58 s LYS 133 CO 0.00 -0.46 -0.13 0.08 -0.92 0.00 0.00 175.35 173.92 2j58 s VAL 134 N 2.36 2.69 -0.03 3.17 1.01 -0.26 -4.97 120.40 124.38 2j58 s VAL 134 Ca 0.54 -0.73 -0.30 0.00 0.00 0.00 0.00 61.98 61.49 2j58 s VAL 134 Cb -0.23 -2.18 -0.05 0.00 0.00 0.00 0.00 36.38 33.91 2j58 s VAL 134 CO 0.20 0.49 1.52 -1.58 0.00 0.00 0.00 175.10 175.72 2j58 s GLN 135 N 1.32 4.23 0.00 2.72 2.00 -1.26 -1.36 119.66 127.31 2j58 s GLN 135 Ca 0.04 2.07 0.00 0.00 -2.00 0.00 0.00 55.36 55.47 2j58 s GLN 135 Cb -0.14 -3.75 0.00 0.00 0.80 0.00 0.00 33.01 29.93 2j58 s GLN 135 CO -0.08 -0.71 0.00 1.33 -0.50 0.00 0.00 175.29 175.33 2j58 n VAL 136 N 5.05 0.00 -1.74 1.34 0.24 0.07 -4.96 118.33 118.33 2j58 n VAL 136 Ca 0.15 0.00 -0.42 0.00 -2.04 0.00 0.00 64.34 62.03 2j58 n VAL 136 Cb 0.43 -0.63 -0.02 0.00 -1.47 0.00 0.00 33.84 32.15 2j58 n VAL 136 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 2j58 n ALA 137 N -1.47 2.63 -0.67 2.33 0.00 -0.22 -1.36 120.51 121.75 2j58 n ALA 137 Ca 0.00 0.38 0.00 0.00 0.00 0.00 0.00 53.44 53.82 2j58 n ALA 137 Cb 0.32 -2.48 0.00 0.00 0.00 0.00 0.00 19.45 17.29 2j58 n ALA 137 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2j58 n GLY 138 N 2.61 0.84 3.69 0.00 0.00 0.22 -4.94 105.19 107.60 2j58 n GLY 138 Ca 0.10 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.85 2j58 n GLY 138 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2j58 s LYS 139 N -0.33 2.51 0.72 1.61 1.02 -0.46 -4.76 119.74 120.05 2j58 s LYS 139 Ca 0.00 -0.99 -0.11 0.00 0.02 0.00 0.00 55.97 54.89 2j58 s LYS 139 Cb 0.00 -2.45 0.02 0.00 -0.52 0.00 0.00 37.83 34.88 2j58 s LYS 139 CO 0.00 0.49 1.07 0.95 -0.92 0.00 0.00 175.35 176.94 2j58 s THR 140 N -1.58 3.72 0.48 2.17 -4.23 -1.26 -0.94 115.64 113.99 2j58 s THR 140 Ca 0.27 0.56 0.15 0.00 -1.18 0.00 0.00 61.69 61.49 2j58 s THR 140 Cb -0.10 -3.37 0.22 0.00 1.34 0.00 0.00 72.50 70.59 2j58 s THR 140 CO 0.19 -0.73 2.06 -0.37 -0.54 0.00 0.00 174.62 175.24 2j58 h VAL 141 N -0.78 1.07 -0.23 2.29 -1.51 -1.90 -1.71 116.25 113.48 2j58 h VAL 141 Ca -0.45 -0.34 -0.19 0.00 -1.23 0.00 0.00 66.70 64.50 2j58 h VAL 141 Cb 1.23 1.18 0.00 0.00 -2.13 0.00 0.00 31.29 31.57 2j58 h VAL 141 CO 0.59 0.10 -0.58 0.28 -1.23 0.00 0.00 177.57 176.73 2j58 h SER 142 N 0.01 0.92 -0.22 4.19 0.02 -1.93 0.17 113.55 116.71 2j58 h SER 142 Ca 0.00 -0.57 0.02 0.00 -0.84 0.00 0.00 61.79 60.41 2j58 h SER 142 Cb 0.17 -0.27 -0.02 0.00 0.14 0.00 0.00 62.40 62.42 2j58 h SER 142 CO 0.01 1.32 0.07 1.56 -1.14 0.00 0.00 176.83 178.65 2j58 h GLN 143 N 0.56 0.17 -0.66 3.45 4.20 -1.86 -1.30 115.11 119.67 2j58 h GLN 143 Ca -0.01 -0.01 -0.01 0.00 0.06 0.00 0.00 58.65 58.69 2j58 h GLN 143 Cb 1.20 -0.04 -0.03 0.00 0.30 0.00 0.00 27.48 28.91 2j58 h GLN 143 CO 0.13 0.11 0.38 0.28 -0.67 0.00 0.00 178.83 179.06 2j58 h VAL 144 N 0.17 1.20 -0.38 -0.54 2.07 -1.19 -1.67 116.25 115.91 2j58 h VAL 144 Ca 0.10 -0.47 0.07 0.00 0.82 0.00 0.00 66.70 67.21 2j58 h VAL 144 Cb 0.07 0.32 -0.06 0.00 -1.52 0.00 0.00 31.29 30.10 2j58 h VAL 144 CO -0.10 0.21 0.03 -0.09 0.02 0.00 0.00 177.57 177.64 2j58 h ARG 145 N 0.90 0.14 -0.60 1.57 2.43 -0.37 -0.58 114.38 117.87 2j58 h ARG 145 Ca 0.23 -0.01 -0.00 0.00 -0.81 0.00 0.00 59.98 59.39 2j58 h ARG 145 Cb 0.00 -0.03 -0.03 0.00 -0.42 0.00 0.00 29.97 29.50 2j58 h ARG 145 CO -0.04 0.09 0.36 0.37 -1.51 0.00 0.00 179.97 179.24 2j58 h GLN 146 N 0.14 0.81 -0.38 0.20 4.15 -0.90 -1.08 115.11 118.05 2j58 h GLN 146 Ca 0.19 -0.07 -0.04 0.00 0.77 0.00 0.00 58.65 59.49 2j58 h GLN 146 Cb 0.25 -0.17 -0.02 0.00 0.21 0.00 0.00 27.48 27.75 2j58 h GLN 146 CO -0.28 0.58 0.08 0.22 -1.93 0.00 0.00 178.83 177.50 2j58 h ASP 147 N 0.80 0.59 -0.42 -0.69 3.58 -0.83 -1.55 116.42 117.90 2j58 h ASP 147 Ca 0.21 -0.24 -0.11 0.00 0.42 0.00 0.00 57.03 57.31 2j58 h ASP 147 Cb -0.02 -0.15 -0.01 0.00 1.72 0.00 0.00 39.33 40.86 2j58 h ASP 147 CO -0.04 0.68 -0.15 0.40 -2.88 0.00 0.00 179.24 177.25 2j58 h ILE 148 N 0.47 1.28 -0.28 2.25 2.04 -1.02 -1.76 117.51 120.48 2j58 h ILE 148 Ca 0.12 -1.28 0.05 0.00 1.00 0.00 0.00 64.86 64.75 2j58 h ILE 148 Cb 0.33 1.22 -0.04 0.00 -0.74 0.00 0.00 36.82 37.58 2j58 h ILE 148 CO 0.00 0.43 0.00 0.74 0.00 0.00 0.00 178.15 179.33 2j58 h THR 149 N 0.67 0.80 -0.16 -0.27 2.02 -1.12 0.73 112.91 115.58 2j58 h THR 149 Ca 0.10 -0.03 -0.01 0.00 0.77 0.00 0.00 66.41 67.24 2j58 h THR 149 Cb 0.70 0.70 -0.01 0.00 -1.74 0.00 0.00 68.15 67.80 2j58 h THR 149 CO 0.05 0.02 0.05 0.28 0.37 0.00 0.00 175.52 176.29 2j58 h SER 150 N 0.09 0.23 0.11 4.18 0.02 -1.09 -2.83 113.55 114.26 2j58 h SER 150 Ca 0.13 -0.20 -0.10 0.00 -0.84 0.00 0.00 61.79 60.78 2j58 h SER 150 Cb 0.18 -0.06 -0.01 0.00 0.14 0.00 0.00 62.40 62.64 2j58 h SER 150 CO -0.23 0.38 -0.32 0.03 -1.14 0.00 0.00 176.83 175.55 2j58 h ARG 151 N 0.08 0.32 0.00 3.45 3.08 -1.17 -2.56 114.38 117.57 2j58 h ARG 151 Ca 0.05 -0.13 0.00 0.00 0.07 0.00 0.00 59.98 59.97 2j58 h ARG 151 Cb 0.23 -0.01 0.00 0.00 0.08 0.00 0.00 29.97 30.26 2j58 h ARG 151 CO -0.00 0.61 0.00 1.25 -1.07 0.00 0.00 179.97 180.76 2j58 h LEU 152 N 0.28 0.00 -2.51 3.04 5.85 -0.78 -3.12 115.31 118.07 2j58 h LEU 152 Ca 0.04 0.00 -0.00 0.00 0.84 0.00 0.00 57.88 58.75 2j58 h LEU 152 Cb 0.71 0.00 -0.00 0.00 0.37 0.00 0.00 40.66 41.74 2j58 h LEU 152 CO 0.05 0.00 -0.02 0.74 -0.34 0.00 0.00 178.44 178.87 2j58 h THR 153 N 0.00 0.35 0.00 1.05 2.02 -1.20 0.63 112.91 115.76 2j58 h THR 153 Ca 0.00 -0.11 0.00 0.00 0.77 0.00 0.00 66.41 67.07 2j58 h THR 153 Cb 0.49 1.07 0.00 0.00 -1.74 0.00 0.00 68.15 67.98 2j58 h THR 153 CO 0.00 0.02 0.00 0.35 0.37 0.00 0.00 175.52 176.26 2j58 n THR 154 N -3.55 0.56 -0.02 3.16 -2.24 -1.18 -3.84 114.28 107.17 2j58 n THR 154 Ca -0.03 0.01 -0.03 0.00 -2.27 0.00 0.00 64.05 61.74 2j58 n THR 154 Cb 0.11 -0.77 -0.03 0.00 -2.10 0.00 0.00 70.33 67.54 2j58 n THR 154 CO 0.00 0.00 0.00 -1.22 -0.57 0.00 0.00 175.07 173.28 2j58 n TYR 155 N -1.91 0.00 -4.36 4.78 4.01 0.04 -5.02 117.16 114.71 2j58 n TYR 155 Ca 0.05 0.00 -0.20 0.00 -0.16 0.00 0.00 57.90 57.59 2j58 n TYR 155 Cb 0.31 -0.21 -0.13 0.00 -0.31 0.00 0.00 39.34 39.00 2j58 n TYR 155 CO 0.00 0.00 0.00 0.96 -0.46 0.00 0.00 176.86 177.36 2j58 s ILE 156 N -2.11 1.07 0.04 -0.72 -5.25 -0.22 -5.12 121.20 108.89 2j58 s ILE 156 Ca -0.04 -0.95 -0.29 0.00 -0.99 0.00 0.00 60.65 58.39 2j58 s ILE 156 Cb 0.01 -0.97 -0.04 0.00 2.95 0.00 0.00 42.46 44.42 2j58 s ILE 156 CO 0.16 0.02 0.94 -0.70 -1.79 0.00 0.00 174.94 173.57 2j58 s GLU 157 N -1.06 4.60 -1.15 0.37 2.12 -1.26 -4.10 118.70 118.21 2j58 s GLU 157 Ca 0.01 1.37 -0.22 0.00 0.36 0.00 0.00 54.97 56.49 2j58 s GLU 157 Cb -0.08 -3.42 -0.00 0.00 0.26 0.00 0.00 34.13 30.89 2j58 s GLU 157 CO 0.01 0.08 0.77 0.45 -0.54 0.00 0.00 175.26 176.04 2j58 n SER 158 N 3.38 -5.05 -4.73 -1.70 2.88 -1.26 -4.86 113.62 102.27 2j58 n SER 158 Ca 0.03 -1.05 -0.42 0.00 -1.33 0.00 0.00 58.87 56.11 2j58 n SER 158 Cb 0.50 -3.20 -0.02 0.00 -0.75 0.00 0.00 64.21 60.74 2j58 n SER 158 CO 0.00 0.00 0.00 -2.16 -1.23 0.00 0.00 175.04 171.65 2j58 s PRO 159 N -6.15 4.22 -0.42 -1.46 0.04 -1.26 -4.99 135.00 124.99 2j58 s PRO 159 Ca 0.46 2.37 -0.08 0.00 0.04 0.00 0.00 61.00 63.79 2j58 s PRO 159 Cb -0.18 -3.12 0.09 0.00 0.04 0.00 0.00 34.50 31.34 2j58 s PRO 159 CO 0.87 -0.53 0.26 -0.65 0.04 0.00 0.00 177.00 177.00 2j58 s GLN 160 N 0.26 2.53 -0.03 4.56 -1.52 -1.26 -4.98 119.66 119.22 2j58 s GLN 160 Ca 0.65 -1.54 0.07 0.00 -1.95 0.00 0.00 55.36 52.58 2j58 s GLN 160 Cb -0.44 -3.78 -0.01 0.00 -0.22 0.00 0.00 33.01 28.56 2j58 s GLN 160 CO 0.39 -1.00 -0.23 0.08 -0.25 0.00 0.00 175.29 174.28 2j58 s VAL 161 N 1.39 1.81 0.19 1.09 1.01 -1.26 -1.09 120.40 123.54 2j58 s VAL 161 Ca 0.04 -0.96 0.10 0.00 0.00 0.00 0.00 61.98 61.15 2j58 s VAL 161 Cb -0.24 -1.52 -0.04 0.00 0.00 0.00 0.00 36.38 34.58 2j58 s VAL 161 CO 0.01 0.51 -0.20 -0.62 0.00 0.00 0.00 175.10 174.80 2j58 s ASP 162 N -0.39 3.06 -0.02 3.32 2.15 0.37 -4.97 116.67 120.19 2j58 s ASP 162 Ca 0.05 -0.90 0.01 0.00 0.43 0.00 0.00 52.55 52.14 2j58 s ASP 162 Cb -0.10 -0.21 0.01 0.00 -0.30 0.00 0.00 42.92 42.32 2j58 s ASP 162 CO 0.00 0.02 -0.03 -0.69 -0.17 0.00 0.00 175.17 174.30 2j58 s VAL 163 N -2.03 0.37 0.33 1.11 1.01 -1.26 -0.65 120.40 119.28 2j58 s VAL 163 Ca 0.20 -0.09 0.02 0.00 0.00 0.00 0.00 61.98 62.10 2j58 s VAL 163 Cb -0.06 -0.39 -0.01 0.00 0.00 0.00 0.00 36.38 35.92 2j58 s VAL 163 CO 0.09 0.16 0.38 -0.94 0.00 0.00 0.00 175.10 174.79 2j58 s SER 164 N 0.57 1.22 -0.30 3.32 1.04 -1.26 -4.78 113.70 113.51 2j58 s SER 164 Ca -0.07 -1.60 -0.14 0.00 0.48 0.00 0.00 55.95 54.63 2j58 s SER 164 Cb -0.10 0.61 -0.03 0.00 0.10 0.00 0.00 66.02 66.60 2j58 s SER 164 CO -0.00 -1.19 0.30 -0.63 0.98 0.00 0.00 173.24 172.70 2j58 s ILE 165 N -3.24 5.22 0.05 -1.02 -1.09 -1.26 -4.56 121.20 115.30 2j58 s ILE 165 Ca 0.35 0.21 0.10 0.00 -2.23 0.00 0.00 60.65 59.08 2j58 s ILE 165 Cb 0.01 -3.69 -0.10 0.00 -1.58 0.00 0.00 42.46 37.10 2j58 s ILE 165 CO 0.23 0.09 1.37 0.00 -1.23 0.00 0.00 174.94 175.40 2j58 h ALA 166 N 8.35 0.52 -2.74 9.38 0.00 -0.25 -3.45 119.26 131.07 2j58 h ALA 166 Ca -0.32 -0.73 -0.15 0.00 0.00 0.00 0.00 54.91 53.71 2j58 h ALA 166 Cb 1.16 -0.13 -0.29 0.00 0.00 0.00 0.00 17.79 18.54 2j58 h ALA 166 CO 0.63 1.00 -0.42 0.00 0.00 0.00 0.00 179.25 180.47 2j58 s ALA 167 N -2.89 -0.85 -0.72 0.00 0.00 -0.98 -4.52 121.76 111.81 2j58 s ALA 167 Ca 0.02 1.26 -0.19 0.00 0.00 0.00 0.00 51.96 53.04 2j58 s ALA 167 Cb 0.10 -1.01 0.11 0.00 0.00 0.00 0.00 23.12 22.32 2j58 s ALA 167 CO 0.79 -0.49 0.89 -0.06 0.00 0.00 0.00 175.76 176.89 2j58 s PHE 168 N 1.99 3.00 -0.08 0.00 0.08 -1.26 -1.36 117.98 120.35 2j58 s PHE 168 Ca -0.04 -1.04 0.03 0.00 0.12 0.00 0.00 56.93 55.99 2j58 s PHE 168 Cb -0.11 -4.15 -0.04 0.00 -0.57 0.00 0.00 43.02 38.15 2j58 s PHE 168 CO -0.11 -1.42 0.10 0.54 -0.10 0.00 0.00 175.22 174.23 2j58 n ARG 169 N 6.58 3.04 0.09 0.44 1.74 -1.26 -4.72 116.66 122.56 2j58 n ARG 169 Ca 0.03 -0.01 -0.13 0.00 -0.77 0.00 0.00 57.85 56.96 2j58 n ARG 169 Cb 0.45 -0.86 -0.10 0.00 -1.02 0.00 0.00 32.46 30.93 2j58 n ARG 169 CO 0.00 0.00 0.00 0.66 -1.52 0.00 0.00 177.63 176.77 2j58 h SER 170 N 0.00 0.34 -3.58 0.55 4.64 -1.83 -3.45 113.55 110.21 2j58 h SER 170 Ca 0.00 -0.34 -0.49 0.00 -0.47 0.00 0.00 61.79 60.49 2j58 h SER 170 Cb 0.11 -0.11 -0.33 0.00 -0.31 0.00 0.00 62.40 61.77 2j58 h SER 170 CO 0.00 1.22 -0.81 -1.10 -0.87 0.00 0.00 176.83 175.27 2j58 s GLN 171 N -2.83 1.48 0.12 4.77 -0.21 -1.26 -4.94 119.66 116.79 2j58 s GLN 171 Ca -0.03 -0.40 -0.19 0.00 0.02 0.00 0.00 55.36 54.76 2j58 s GLN 171 Cb 0.08 -1.27 0.05 0.00 1.00 0.00 0.00 33.01 32.86 2j58 s GLN 171 CO 0.86 0.07 0.47 -1.59 -2.12 0.00 0.00 175.29 172.98 2j58 s LYS 172 N 0.48 1.11 0.13 2.91 -2.85 -1.26 -0.43 119.74 119.82 2j58 s LYS 172 Ca -0.10 -0.57 0.09 0.00 -1.00 0.00 0.00 55.97 54.40 2j58 s LYS 172 Cb -0.13 0.50 -0.04 0.00 -2.06 0.00 0.00 37.83 36.09 2j58 s LYS 172 CO 0.03 -0.44 -0.20 0.08 0.10 0.00 0.00 175.35 174.92 2j58 s VAL 173 N -3.54 2.72 -0.28 1.79 1.01 0.83 -0.20 120.40 122.73 2j58 s VAL 173 Ca 0.01 -1.59 -0.09 0.00 0.00 0.00 0.00 61.98 60.31 2j58 s VAL 173 Cb 0.01 -2.25 -0.03 0.00 0.00 0.00 0.00 36.38 34.11 2j58 s VAL 173 CO -0.10 0.08 0.13 -0.31 0.00 0.00 0.00 175.10 174.89 2j58 s TYR 174 N -1.18 3.15 -0.37 5.22 2.02 -0.33 -0.38 117.35 125.48 2j58 s TYR 174 Ca 0.18 -0.33 -0.06 0.00 -0.37 0.00 0.00 57.07 56.48 2j58 s TYR 174 Cb -0.10 -2.32 0.07 0.00 -0.40 0.00 0.00 41.96 39.21 2j58 s TYR 174 CO 0.09 -0.34 0.15 0.08 -1.57 0.00 0.00 175.55 173.97 2j58 s VAL 175 N 1.65 3.70 0.09 0.71 1.01 -0.86 -0.03 120.40 126.67 2j58 s VAL 175 Ca 0.06 -1.42 0.02 0.00 0.00 0.00 0.00 61.98 60.64 2j58 s VAL 175 Cb -0.16 -3.23 -0.04 0.00 0.00 0.00 0.00 36.38 32.95 2j58 s VAL 175 CO 0.06 -0.36 -0.06 -0.89 0.00 0.00 0.00 175.10 173.85 2j58 s THR 176 N 1.34 0.66 0.00 3.92 2.01 0.01 -1.61 115.64 121.96 2j58 s THR 176 Ca 0.01 -1.87 0.00 0.00 0.31 0.00 0.00 61.69 60.14 2j58 s THR 176 Cb -0.21 -1.60 0.00 0.00 0.01 0.00 0.00 72.50 70.70 2j58 s THR 176 CO 0.01 -0.85 0.00 0.61 -0.69 0.00 0.00 174.62 173.70 2j58 n GLY 177 N 0.07 0.84 2.50 4.40 0.00 -1.26 -0.73 105.19 111.01 2j58 n GLY 177 Ca -0.13 -1.62 -0.38 0.00 0.00 0.00 0.00 46.02 43.89 2j58 n GLY 177 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 2j58 n GLU 178 N 0.00 4.28 -4.06 1.61 -0.58 0.52 -4.78 120.64 117.63 2j58 n GLU 178 Ca 0.00 -3.38 -0.22 0.00 -0.42 0.00 0.00 57.16 53.14 2j58 n GLU 178 Cb 0.00 -2.53 -0.05 0.00 -0.57 0.00 0.00 31.44 28.30 2j58 n GLU 178 CO 0.00 0.00 0.00 0.14 -0.48 0.00 0.00 177.13 176.79 2j58 s VAL 179 N -1.69 4.06 0.19 2.62 -7.23 -1.26 -0.71 120.40 116.37 2j58 s VAL 179 Ca 0.54 -1.47 -0.11 0.00 -1.81 0.00 0.00 61.98 59.13 2j58 s VAL 179 Cb 0.22 -3.27 0.10 0.00 0.56 0.00 0.00 36.38 34.00 2j58 s VAL 179 CO -0.13 -0.30 1.78 0.00 -0.31 0.00 0.00 175.10 176.15 2j58 h ALA 180 N 1.48 0.84 -3.19 1.32 0.00 -0.99 -3.39 119.26 115.33 2j58 h ALA 180 Ca -0.47 -0.13 -0.60 0.00 0.00 0.00 0.00 54.91 53.72 2j58 h ALA 180 Cb 1.24 -0.26 -0.40 0.00 0.00 0.00 0.00 17.79 18.37 2j58 h ALA 180 CO 0.60 0.38 -0.75 -0.80 0.00 0.00 0.00 179.25 178.69 2j58 s ASN 181 N -6.02 4.06 0.56 0.00 -0.87 0.59 -5.02 114.94 108.24 2j58 s ASN 181 Ca -0.13 -1.90 -0.19 0.00 -1.57 0.00 0.00 52.86 49.07 2j58 s ASN 181 Cb 0.14 -1.00 -0.05 0.00 -0.02 0.00 0.00 41.25 40.32 2j58 s ASN 181 CO 0.79 -0.38 1.17 -0.44 -2.57 0.00 0.00 177.10 175.66 2j58 s SER 182 N 1.28 5.51 0.00 -1.22 0.01 -1.26 -4.62 113.70 113.40 2j58 s SER 182 Ca 0.11 2.28 0.00 0.00 1.31 0.00 0.00 55.95 59.65 2j58 s SER 182 Cb -0.19 -2.59 0.00 0.00 0.21 0.00 0.00 66.02 63.45 2j58 s SER 182 CO -0.18 -1.37 0.00 0.61 0.41 0.00 0.00 173.24 172.71 2j58 n GLY 183 N 0.33 1.79 3.76 3.44 0.00 -0.63 -5.03 105.19 108.84 2j58 n GLY 183 Ca 0.12 -1.21 -0.38 0.00 0.00 0.00 0.00 46.02 44.55 2j58 n GLY 183 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2j58 s LYS 184 N -1.98 3.50 -0.07 1.61 1.02 -1.26 -2.03 119.74 120.52 2j58 s LYS 184 Ca 0.00 2.02 0.02 0.00 0.02 0.00 0.00 55.97 58.03 2j58 s LYS 184 Cb 0.00 -2.37 0.01 0.00 -0.52 0.00 0.00 37.83 34.95 2j58 s LYS 184 CO 0.00 -0.83 -0.12 -0.65 -0.92 0.00 0.00 175.35 172.83 2j58 s GLN 185 N -2.75 1.73 0.40 1.68 -0.21 0.49 -4.90 119.66 116.09 2j58 s GLN 185 Ca 0.67 -0.41 -0.26 0.00 0.02 0.00 0.00 55.36 55.38 2j58 s GLN 185 Cb -0.35 -1.46 -0.09 0.00 1.00 0.00 0.00 33.01 32.11 2j58 s GLN 185 CO 0.42 -0.01 1.28 0.00 -2.12 0.00 0.00 175.29 174.86 2j58 s ALA 186 N 0.80 3.25 -0.01 6.09 0.00 -1.26 -0.12 121.76 130.50 2j58 s ALA 186 Ca -0.12 1.19 -0.29 0.00 0.00 0.00 0.00 51.96 52.75 2j58 s ALA 186 Cb -0.15 -3.47 -0.03 0.00 0.00 0.00 0.00 23.12 19.46 2j58 s ALA 186 CO 0.02 -0.78 0.93 0.42 0.00 0.00 0.00 175.76 176.35 2j58 s ILE 187 N -1.28 4.90 0.00 0.00 -1.09 0.42 -4.83 121.20 119.33 2j58 s ILE 187 Ca 0.57 1.94 0.00 0.00 -2.23 0.00 0.00 60.65 60.93 2j58 s ILE 187 Cb -0.37 -4.27 0.00 0.00 -1.58 0.00 0.00 42.46 36.24 2j58 s ILE 187 CO 0.47 0.18 0.00 0.35 -1.23 0.00 0.00 174.94 174.71 2j58 n THR 188 N 3.87 0.00 0.57 2.92 -2.24 -1.26 -4.72 114.28 113.42 2j58 n THR 188 Ca 0.05 0.00 0.08 0.00 -2.27 0.00 0.00 64.05 61.91 2j58 n THR 188 Cb 0.51 0.00 0.36 0.00 -2.10 0.00 0.00 70.33 69.10 2j58 n THR 188 CO 0.00 0.00 0.00 -0.46 -0.57 0.00 0.00 175.07 174.04 2j58 n ASN 189 N -2.61 0.04 -4.58 3.42 6.94 -1.26 -4.55 115.26 112.66 2j58 n ASN 189 Ca 0.00 0.51 -0.36 0.00 -0.02 0.00 0.00 54.58 54.71 2j58 n ASN 189 Cb 0.00 -0.52 -0.11 0.00 -2.36 0.00 0.00 39.78 36.79 2j58 n ASN 189 CO 0.00 0.00 0.00 -0.63 -1.03 0.00 0.00 177.26 175.60 2j58 s ILE 190 N -3.02 4.82 0.30 1.53 1.09 -1.26 -4.76 121.20 119.90 2j58 s ILE 190 Ca 0.08 -0.01 -0.29 0.00 -1.10 0.00 0.00 60.65 59.33 2j58 s ILE 190 Cb 0.11 -3.22 -0.13 0.00 -1.06 0.00 0.00 42.46 38.16 2j58 s ILE 190 CO 0.31 0.38 1.24 -2.65 -0.10 0.00 0.00 174.94 174.12 2j58 n PRO 191 N 4.20 1.87 -3.90 2.79 -0.02 -1.26 -4.97 135.00 133.70 2j58 n PRO 191 Ca -0.16 0.66 -0.35 0.00 -2.02 0.00 0.00 63.50 61.63 2j58 n PRO 191 Cb 0.52 -2.20 -0.13 0.00 -0.02 0.00 0.00 33.50 31.67 2j58 n PRO 191 CO 0.00 0.00 0.00 -1.17 1.98 0.00 0.00 175.50 176.31 2j58 s LEU 192 N -0.33 4.18 0.48 2.45 2.96 -1.26 -5.00 118.68 122.15 2j58 s LEU 192 Ca 0.60 -1.47 0.06 0.00 -0.22 0.00 0.00 54.13 53.09 2j58 s LEU 192 Cb -0.63 -1.72 0.03 0.00 0.50 0.00 0.00 46.19 44.37 2j58 s LEU 192 CO 0.59 -0.32 0.66 0.42 -1.32 0.00 0.00 176.35 176.38 2j58 s THR 193 N 1.20 2.80 -0.38 3.68 -4.23 -1.26 -0.39 115.64 117.07 2j58 s THR 193 Ca -0.02 -0.90 0.00 0.00 -1.18 0.00 0.00 61.69 59.59 2j58 s THR 193 Cb -0.20 -2.90 0.00 0.00 1.34 0.00 0.00 72.50 70.74 2j58 s THR 193 CO -0.02 0.00 0.00 0.52 -0.54 0.00 0.00 174.62 174.58 2j58 n VAL 194 N -2.05 0.00 0.00 2.29 0.31 -0.11 -0.75 118.33 118.02 2j58 n VAL 194 Ca 0.09 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.42 2j58 n VAL 194 Cb 0.59 -0.05 0.00 0.00 -0.91 0.00 0.00 33.84 33.47 2j58 n VAL 194 CO 0.00 0.00 0.00 0.47 -1.32 0.00 0.00 176.83 175.98 2j58 n ASP 196 N 0.34 0.00 -0.09 4.52 8.00 -1.26 -0.86 116.55 127.21 2j58 n ASP 196 Ca 0.00 0.00 -0.12 0.00 0.71 0.00 0.00 54.79 55.38 2j58 n ASP 196 Cb 0.00 0.00 -0.04 0.00 -0.02 0.00 0.00 41.12 41.06 2j58 n ASP 196 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 2j58 h ALA 197 N 0.00 0.35 -0.33 2.24 0.00 -1.30 0.66 119.26 120.88 2j58 h ALA 197 Ca 0.00 -0.27 0.04 0.00 0.00 0.00 0.00 54.91 54.68 2j58 h ALA 197 Cb 0.00 -0.09 -0.04 0.00 0.00 0.00 0.00 17.79 17.66 2j58 h ALA 197 CO 0.00 0.15 0.09 0.82 0.00 0.00 0.00 179.25 180.32 2j58 h ILE 198 N 0.24 0.88 -0.44 0.00 1.08 -1.26 -1.77 117.51 116.24 2j58 h ILE 198 Ca 0.07 -0.08 -0.13 0.00 -0.39 0.00 0.00 64.86 64.33 2j58 h ILE 198 Cb 0.53 0.64 -0.01 0.00 -3.07 0.00 0.00 36.82 34.90 2j58 h ILE 198 CO 0.02 0.04 -0.25 0.78 -0.69 0.00 0.00 178.15 178.06 2j58 h ASN 199 N 0.22 0.95 0.18 1.72 2.35 -1.78 -1.82 115.58 117.40 2j58 h ASN 199 Ca 0.15 -0.37 -0.02 0.00 -0.55 0.00 0.00 56.30 55.51 2j58 h ASN 199 Cb 0.14 -0.26 -0.00 0.00 0.05 0.00 0.00 38.32 38.25 2j58 h ASN 199 CO -0.18 1.14 -0.11 0.00 -1.65 0.00 0.00 177.43 176.64 2j58 h ALA 200 N 0.92 1.56 0.00 -0.83 0.00 -0.71 -0.59 119.26 119.61 2j58 h ALA 200 Ca 0.10 -0.10 0.00 0.00 0.00 0.00 0.00 54.91 54.91 2j58 h ALA 200 Cb 0.81 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.58 2j58 h ALA 200 CO 0.07 0.13 0.00 0.00 0.00 0.00 0.00 179.25 179.45 2j58 n ALA 201 N -2.40 2.57 -1.28 0.00 0.00 -0.68 -4.89 120.51 113.83 2j58 n ALA 201 Ca -0.02 -0.12 -0.03 0.00 0.00 0.00 0.00 53.44 53.26 2j58 n ALA 201 Cb 0.19 -1.32 -0.01 0.00 0.00 0.00 0.00 19.45 18.31 2j58 n ALA 201 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2j58 n GLY 202 N 0.74 0.53 5.97 0.00 0.00 -0.23 -0.30 105.19 111.90 2j58 n GLY 202 Ca 0.15 -0.91 0.00 0.00 0.00 0.00 0.00 46.02 45.25 2j58 n GLY 202 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2j58 n GLY 203 N -2.31 -1.89 3.87 -0.02 0.00 -0.73 -4.48 105.19 99.63 2j58 n GLY 203 Ca -0.03 -1.49 -0.32 0.00 0.00 0.00 0.00 46.02 44.18 2j58 n GLY 203 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2j58 s LEU 204 N 0.00 4.16 0.71 0.99 1.43 -1.26 -0.90 118.68 123.82 2j58 s LEU 204 Ca 0.00 0.94 -0.11 0.00 -1.03 0.00 0.00 54.13 53.94 2j58 s LEU 204 Cb 0.00 -3.71 0.02 0.00 0.03 0.00 0.00 46.19 42.53 2j58 s LEU 204 CO 0.00 -0.08 1.07 0.00 0.23 0.00 0.00 176.35 177.57 2j58 s ALA 205 N -1.83 2.62 0.43 4.21 0.00 0.12 -4.48 121.76 122.83 2j58 s ALA 205 Ca 0.48 0.02 0.12 0.00 0.00 0.00 0.00 51.96 52.57 2j58 s ALA 205 Cb -0.11 -3.16 0.98 0.00 0.00 0.00 0.00 23.12 20.83 2j58 s ALA 205 CO 0.21 -1.30 2.02 0.00 0.00 0.00 0.00 175.76 176.69 2j58 h ALA 206 N -0.77 1.91 -0.48 0.00 0.00 -1.97 -2.40 119.26 115.54 2j58 h ALA 206 Ca -0.44 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.45 2j58 h ALA 206 Cb 1.22 -0.11 0.00 0.00 0.00 0.00 0.00 17.79 18.90 2j58 h ALA 206 CO 0.57 0.00 0.00 -0.40 0.00 0.00 0.00 179.25 179.43 2j58 n ASP 207 N -4.47 4.44 -4.73 0.00 5.75 -1.26 -4.94 116.55 111.33 2j58 n ASP 207 Ca 0.07 -2.59 -0.42 0.00 -0.01 0.00 0.00 54.79 51.84 2j58 n ASP 207 Cb 0.25 -0.60 -0.03 0.00 -1.03 0.00 0.00 41.12 39.71 2j58 n ASP 207 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 2j58 s ALA 208 N -2.16 3.60 -1.02 2.12 0.00 -0.91 -0.57 121.76 122.82 2j58 s ALA 208 Ca 0.42 1.21 -0.17 0.00 0.00 0.00 0.00 51.96 53.42 2j58 s ALA 208 Cb 0.30 -3.53 0.14 0.00 0.00 0.00 0.00 23.12 20.03 2j58 s ALA 208 CO 0.15 -0.64 1.24 0.34 0.00 0.00 0.00 175.76 176.85 2j58 s ASP 209 N 0.59 6.77 0.00 0.00 2.15 0.21 -4.64 116.67 121.74 2j58 s ASP 209 Ca 0.61 -2.33 0.23 0.00 0.43 0.00 0.00 52.55 51.49 2j58 s ASP 209 Cb -0.39 -2.41 1.17 0.00 -0.30 0.00 0.00 42.92 40.99 2j58 s ASP 209 CO 0.37 -0.98 1.76 -2.67 -0.17 0.00 0.00 175.17 173.48 2j58 n TRP 210 N 6.37 0.00 1.15 -5.34 4.27 -1.26 -2.31 117.44 120.32 2j58 n TRP 210 Ca 0.29 0.00 0.12 0.00 -3.89 0.00 0.00 57.50 54.02 2j58 n TRP 210 Cb 0.47 -0.28 0.24 0.00 -1.36 0.00 0.00 31.31 30.38 2j58 n TRP 210 CO 0.00 0.00 0.00 0.54 -2.29 0.00 0.00 177.69 175.94 2j58 n ARG 211 N -1.28 0.81 -2.58 -2.67 1.74 -1.26 0.10 116.66 111.53 2j58 n ARG 211 Ca 0.11 -0.55 -0.13 0.00 -0.77 0.00 0.00 57.85 56.50 2j58 n ARG 211 Cb 0.18 -1.49 0.03 0.00 -1.02 0.00 0.00 32.46 30.16 2j58 n ARG 211 CO 0.00 0.00 0.00 0.09 -1.52 0.00 0.00 177.63 176.20 2j58 n ASN 212 N -0.61 2.67 -4.78 0.55 3.02 -0.98 -4.22 115.26 110.92 2j58 n ASN 212 Ca 0.10 -2.93 -0.37 0.00 -0.03 0.00 0.00 54.58 51.35 2j58 n ASN 212 Cb 0.38 -0.48 -0.04 0.00 -0.61 0.00 0.00 39.78 39.03 2j58 n ASN 212 CO 0.00 0.00 0.00 -0.69 -2.62 0.00 0.00 177.26 173.95 2j58 s VAL 213 N -4.02 3.71 -0.16 2.41 1.01 0.05 -4.52 120.40 118.87 2j58 s VAL 213 Ca 0.35 1.34 0.01 0.00 0.00 0.00 0.00 61.98 63.68 2j58 s VAL 213 Cb 0.41 -3.71 0.00 0.00 0.00 0.00 0.00 36.38 33.08 2j58 s VAL 213 CO -0.03 0.04 -0.17 -0.69 0.00 0.00 0.00 175.10 174.26 2j58 s VAL 214 N -1.61 2.50 -0.23 2.92 1.01 -0.26 -0.27 120.40 124.46 2j58 s VAL 214 Ca 0.56 -0.82 -0.07 0.00 0.00 0.00 0.00 61.98 61.66 2j58 s VAL 214 Cb -0.23 -2.05 -0.03 0.00 0.00 0.00 0.00 36.38 34.07 2j58 s VAL 214 CO 0.29 0.52 0.05 -0.22 0.00 0.00 0.00 175.10 175.74 2j58 s LEU 215 N 0.93 3.43 -0.28 3.92 2.96 0.09 -0.43 118.68 129.30 2j58 s LEU 215 Ca -0.03 -0.18 -0.10 0.00 -0.22 0.00 0.00 54.13 53.60 2j58 s LEU 215 Cb -0.15 -1.90 -0.04 0.00 0.50 0.00 0.00 46.19 44.60 2j58 s LEU 215 CO -0.02 0.01 0.16 -0.89 -1.32 0.00 0.00 176.35 174.28 2j58 s THR 216 N 1.35 4.94 -0.04 3.68 2.01 0.88 -0.28 115.64 128.19 2j58 s THR 216 Ca 0.05 -0.03 -0.00 0.00 0.31 0.00 0.00 61.69 62.02 2j58 s THR 216 Cb -0.15 -3.38 0.03 0.00 0.01 0.00 0.00 72.50 69.01 2j58 s THR 216 CO 0.03 0.23 -0.00 -2.28 -0.69 0.00 0.00 174.62 171.91 2j58 s HIS 217 N 1.70 0.45 -1.37 4.92 5.04 0.01 -1.46 115.29 124.58 2j58 s HIS 217 Ca 0.06 -0.05 -0.11 0.00 -1.54 0.00 0.00 55.06 53.42 2j58 s HIS 217 Cb -0.16 -0.55 0.02 0.00 0.04 0.00 0.00 32.58 31.93 2j58 s HIS 217 CO 0.08 -0.19 0.21 0.09 -2.34 0.00 0.00 174.74 172.59 2j58 n ASN 218 N 4.44 -0.63 0.00 9.88 5.03 -1.26 -1.38 115.26 131.34 2j58 n ASN 218 Ca -0.20 -1.23 0.00 0.00 0.87 0.00 0.00 54.58 54.03 2j58 n ASN 218 Cb 0.50 -1.50 0.00 0.00 -1.02 0.00 0.00 39.78 37.76 2j58 n ASN 218 CO 0.00 0.00 0.00 0.61 -1.83 0.00 0.00 177.26 176.04 2j58 n GLY 219 N -2.36 0.53 2.91 7.41 0.00 -1.26 -5.02 105.19 107.40 2j58 n GLY 219 Ca -0.25 -0.02 -0.20 0.00 0.00 0.00 0.00 46.02 45.56 2j58 n GLY 219 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 2j58 s LYS 220 N -0.09 0.83 -0.08 1.61 2.20 -0.48 -5.13 119.74 118.60 2j58 s LYS 220 Ca 0.00 -0.14 -0.15 0.00 -0.36 0.00 0.00 55.97 55.32 2j58 s LYS 220 Cb 0.00 -0.81 -0.05 0.00 -1.51 0.00 0.00 37.83 35.46 2j58 s LYS 220 CO 0.00 -0.04 0.39 -0.51 -0.36 0.00 0.00 175.35 174.83 2j58 s ASP 221 N 0.73 6.66 -0.07 1.43 1.11 -1.26 -0.81 116.67 124.47 2j58 s ASP 221 Ca -0.10 0.78 0.03 0.00 0.18 0.00 0.00 52.55 53.45 2j58 s ASP 221 Cb -0.13 -2.24 0.01 0.00 1.07 0.00 0.00 42.92 41.63 2j58 s ASP 221 CO 0.00 0.17 -0.16 -0.89 1.18 0.00 0.00 175.17 175.47 2j58 s THR 222 N -0.16 1.41 0.19 -1.27 2.01 0.61 -4.96 115.64 113.47 2j58 s THR 222 Ca 0.22 -0.66 -0.30 0.00 0.31 0.00 0.00 61.69 61.26 2j58 s THR 222 Cb -0.15 -1.25 -0.08 0.00 0.01 0.00 0.00 72.50 71.04 2j58 s THR 222 CO 0.10 0.41 1.01 -0.54 -0.69 0.00 0.00 174.62 174.91 2j58 s LYS 223 N 0.40 4.71 -0.06 4.92 -0.14 -1.26 -0.73 119.74 127.57 2j58 s LYS 223 Ca -0.12 1.58 0.02 0.00 -1.36 0.00 0.00 55.97 56.09 2j58 s LYS 223 Cb -0.15 -3.30 0.01 0.00 -1.68 0.00 0.00 37.83 32.72 2j58 s LYS 223 CO 0.04 0.26 -0.12 0.42 -0.76 0.00 0.00 175.35 175.20 2j58 s ILE 224 N -0.56 1.09 -0.33 2.17 1.01 0.63 -4.94 121.20 120.27 2j58 s ILE 224 Ca 0.46 -0.46 -0.09 0.00 0.00 0.00 0.00 60.65 60.56 2j58 s ILE 224 Cb -0.27 -1.00 0.01 0.00 0.01 0.00 0.00 42.46 41.21 2j58 s ILE 224 CO 0.33 0.34 0.14 -0.55 0.00 0.00 0.00 174.94 175.21 2j58 s SER 225 N 0.67 5.45 0.47 3.58 0.15 -1.26 -0.77 113.70 121.99 2j58 s SER 225 Ca -0.14 -0.79 0.27 0.00 0.70 0.00 0.00 55.95 55.98 2j58 s SER 225 Cb -0.16 -1.96 0.88 0.00 -1.71 0.00 0.00 66.02 63.07 2j58 s SER 225 CO 0.03 -0.27 1.80 -0.07 1.20 0.00 0.00 173.24 175.94 2j58 h LEU 226 N 8.33 0.00 0.33 3.45 3.38 -0.63 -1.64 115.31 128.53 2j58 h LEU 226 Ca -0.29 0.00 -0.02 0.00 0.09 0.00 0.00 57.88 57.67 2j58 h LEU 226 Cb 1.12 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.87 2j58 h LEU 226 CO 0.63 0.10 -0.16 0.22 0.09 0.00 0.00 178.44 179.32 2j58 h TYR 227 N 0.00 -0.41 -0.83 1.13 3.20 -1.92 -3.10 116.97 115.04 2j58 h TYR 227 Ca -0.00 -0.01 -0.04 0.00 3.14 0.00 0.00 58.73 61.82 2j58 h TYR 227 Cb 0.77 0.14 -0.04 0.00 1.54 0.00 0.00 36.73 39.14 2j58 h TYR 227 CO 0.00 -0.25 0.37 0.00 -1.64 0.00 0.00 178.16 176.64 2j58 h ALA 228 N 0.21 1.10 0.00 1.82 0.00 -1.86 -0.24 119.26 120.29 2j58 h ALA 228 Ca -0.05 -0.18 0.00 0.00 0.00 0.00 0.00 54.91 54.69 2j58 h ALA 228 Cb 0.35 -0.33 0.00 0.00 0.00 0.00 0.00 17.79 17.82 2j58 h ALA 228 CO 0.07 0.66 0.00 -0.11 0.00 0.00 0.00 179.25 179.88 2j58 n LEU 229 N -4.29 0.16 0.00 0.00 0.00 -0.64 -0.81 117.00 111.42 2j58 n LEU 229 Ca 0.08 0.56 0.00 0.00 0.00 0.00 0.00 56.01 56.65 2j58 n LEU 229 Cb 0.16 -0.55 0.00 0.00 0.00 0.00 0.00 43.42 43.02 2j58 n LEU 229 CO 0.40 -0.48 0.00 1.67 0.00 0.00 0.00 177.39 178.98 2j58 n GLN 231 N -1.69 0.00 0.00 1.96 7.27 -0.14 -1.67 117.38 123.11 2j58 n GLN 231 Ca 0.01 0.00 0.03 0.00 0.07 0.00 0.00 57.00 57.11 2j58 n GLN 231 Cb 0.09 0.00 0.00 0.00 2.41 0.00 0.00 30.24 32.74 2j58 n GLN 231 CO 0.00 0.00 0.00 1.63 0.07 0.00 0.00 177.06 178.76 2j58 n LYS 232 N -0.05 2.14 -1.95 3.69 4.76 -0.96 -5.02 118.16 120.78 2j58 n LYS 232 Ca 0.00 -0.50 -0.11 0.00 -2.87 0.00 0.00 58.31 54.83 2j58 n LYS 232 Cb 0.00 -0.97 -0.02 0.00 -1.84 0.00 0.00 35.03 32.20 2j58 n LYS 232 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 2j58 n GLY 233 N 0.69 0.30 3.52 0.72 0.00 -0.67 -2.71 105.19 107.04 2j58 n GLY 233 Ca 0.03 -0.45 -0.42 0.00 0.00 0.00 0.00 46.02 45.18 2j58 n GLY 233 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 2j58 s ASP 234 N -2.61 6.44 0.00 1.61 2.15 0.01 -1.64 116.67 122.63 2j58 s ASP 234 Ca 0.00 -1.39 0.22 0.00 0.43 0.00 0.00 52.55 51.81 2j58 s ASP 234 Cb 0.00 -2.51 1.08 0.00 -0.30 0.00 0.00 42.92 41.19 2j58 s ASP 234 CO 0.00 -1.45 1.70 0.18 -0.17 0.00 0.00 175.17 175.43 2j58 n LEU 235 N 8.27 0.00 0.16 -1.34 4.77 -0.53 -2.03 117.00 126.30 2j58 n LEU 235 Ca 0.22 0.30 0.13 0.00 -0.03 0.00 0.00 56.01 56.63 2j58 n LEU 235 Cb 0.50 -0.30 0.56 0.00 -2.33 0.00 0.00 43.42 41.85 2j58 n LEU 235 CO 0.63 -0.09 0.87 0.71 -1.33 0.00 0.00 177.39 178.19 2j58 h THR 236 N 0.00 0.00 0.00 -5.08 1.35 -1.78 -1.24 112.91 106.17 2j58 h THR 236 Ca 0.00 -0.19 0.00 0.00 -0.55 0.00 0.00 66.41 65.67 2j58 h THR 236 Cb 0.22 0.88 0.00 0.00 -1.73 0.00 0.00 68.15 67.52 2j58 h THR 236 CO 0.00 0.00 0.00 0.00 -0.25 0.00 0.00 175.52 175.27 2j58 n GLN 237 N -2.35 0.23 -3.26 4.72 1.13 -0.86 -4.82 117.38 112.16 2j58 n GLN 237 Ca 0.01 0.26 -0.33 0.00 -1.94 0.00 0.00 57.00 54.99 2j58 n GLN 237 Cb 0.18 -1.81 -0.06 0.00 0.11 0.00 0.00 30.24 28.66 2j58 n GLN 237 CO 0.00 0.00 0.00 1.21 -1.44 0.00 0.00 177.06 176.83 2j58 s ASN 238 N -4.37 6.79 0.00 1.08 2.47 -0.47 -4.81 114.94 115.63 2j58 s ASN 238 Ca 0.09 1.15 -0.06 0.00 0.42 0.00 0.00 52.86 54.46 2j58 s ASN 238 Cb 0.12 -2.32 -0.00 0.00 -1.45 0.00 0.00 41.25 37.60 2j58 s ASN 238 CO 0.54 -0.06 0.11 -1.00 -3.72 0.00 0.00 177.10 172.96 2j58 s HIS 239 N -1.75 0.07 0.22 0.43 3.76 -1.26 -4.98 115.29 111.78 2j58 s HIS 239 Ca 0.47 -0.18 -0.30 0.00 -0.15 0.00 0.00 55.06 54.90 2j58 s HIS 239 Cb -0.13 -0.07 -0.08 0.00 1.11 0.00 0.00 32.58 33.41 2j58 s HIS 239 CO 0.19 -0.26 1.12 -1.17 -0.85 0.00 0.00 174.74 173.78 2j58 s LEU 240 N -1.33 4.50 0.05 0.89 2.96 -1.26 -0.93 118.68 123.56 2j58 s LEU 240 Ca -0.14 2.20 -0.02 0.00 -0.22 0.00 0.00 54.13 55.95 2j58 s LEU 240 Cb -0.08 -3.61 -0.04 0.00 0.50 0.00 0.00 46.19 42.96 2j58 s LEU 240 CO 0.01 -0.23 0.23 -0.76 -1.32 0.00 0.00 176.35 174.28 2j58 s LEU 241 N -0.78 4.35 0.23 -0.68 1.43 0.48 -4.91 118.68 118.81 2j58 s LEU 241 Ca 0.48 0.35 0.05 0.00 -1.03 0.00 0.00 54.13 53.98 2j58 s LEU 241 Cb -0.31 -2.88 -0.05 0.00 0.03 0.00 0.00 46.19 42.98 2j58 s LEU 241 CO 0.38 0.19 -0.04 -0.31 0.23 0.00 0.00 176.35 176.80 2j58 s TYR 242 N -1.46 1.65 0.11 0.29 2.02 -1.26 -4.72 117.35 113.99 2j58 s TYR 242 Ca 0.33 -0.81 -0.36 0.00 -0.37 0.00 0.00 57.07 55.86 2j58 s TYR 242 Cb -0.13 -0.93 -0.16 0.00 -0.40 0.00 0.00 41.96 40.35 2j58 s TYR 242 CO 0.24 0.10 1.42 -2.39 -1.57 0.00 0.00 175.55 173.35 2j58 n HIS 243 N -0.44 1.76 -0.07 2.71 1.44 -1.26 -1.65 115.22 117.71 2j58 n HIS 243 Ca -0.06 0.52 0.00 0.00 -2.01 0.00 0.00 57.72 56.17 2j58 n HIS 243 Cb 0.63 -2.40 0.00 0.00 0.12 0.00 0.00 29.99 28.34 2j58 n HIS 243 CO 0.00 0.00 0.00 0.41 -2.81 0.00 0.00 176.34 173.94 2j58 n GLY 244 N 2.83 1.08 3.76 -1.39 0.00 0.72 -4.95 105.19 107.25 2j58 n GLY 244 Ca 0.18 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.84 2j58 n GLY 244 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 2j58 s ASP 245 N -2.82 5.42 -0.12 1.61 1.01 -0.66 -4.82 116.67 116.30 2j58 s ASP 245 Ca 0.00 2.31 0.03 0.00 0.71 0.00 0.00 52.55 55.60 2j58 s ASP 245 Cb 0.00 -2.59 0.00 0.00 1.01 0.00 0.00 42.92 41.34 2j58 s ASP 245 CO 0.00 -1.43 -0.22 -0.63 0.21 0.00 0.00 175.17 173.10 2j58 s ILE 246 N -1.65 2.20 -0.34 0.77 1.01 -0.54 -1.19 121.20 121.47 2j58 s ILE 246 Ca 0.75 -0.96 -0.04 0.00 0.00 0.00 0.00 60.65 60.41 2j58 s ILE 246 Cb -0.28 -1.86 0.06 0.00 0.01 0.00 0.00 42.46 40.39 2j58 s ILE 246 CO 0.31 0.55 0.08 -0.22 0.00 0.00 0.00 174.94 175.66 2j58 s LEU 247 N 0.48 4.31 -0.17 2.97 2.96 0.96 -0.08 118.68 130.12 2j58 s LEU 247 Ca -0.15 -1.38 -0.03 0.00 -0.22 0.00 0.00 54.13 52.36 2j58 s LEU 247 Cb -0.17 -1.79 -0.02 0.00 0.50 0.00 0.00 46.19 44.71 2j58 s LEU 247 CO 0.06 -0.34 -0.07 0.12 -1.32 0.00 0.00 176.35 174.80 2j58 s PHE 248 N 1.28 2.94 -0.37 5.38 5.36 0.43 -0.81 117.98 132.20 2j58 s PHE 248 Ca -0.01 -0.58 -0.08 0.00 -0.96 0.00 0.00 56.93 55.30 2j58 s PHE 248 Cb -0.20 -1.97 0.05 0.00 -0.34 0.00 0.00 43.02 40.56 2j58 s PHE 248 CO -0.00 -0.23 0.17 0.42 -1.46 0.00 0.00 175.22 174.11 2j58 s ILE 249 N 0.68 4.03 0.95 3.12 1.09 0.09 -1.10 121.20 130.06 2j58 s ILE 249 Ca -0.03 -1.18 -0.12 0.00 -1.10 0.00 0.00 60.65 58.21 2j58 s ILE 249 Cb -0.15 -3.34 0.16 0.00 -1.06 0.00 0.00 42.46 38.07 2j58 s ILE 249 CO 0.02 -0.29 1.11 -2.16 -0.10 0.00 0.00 174.94 173.52 2j58 s PRO 250 N 1.43 0.84 0.53 2.79 0.04 -1.26 -0.36 135.00 139.00 2j58 s PRO 250 Ca 0.01 0.43 0.03 0.00 0.04 0.00 0.00 61.00 61.51 2j58 s PRO 250 Cb -0.20 -1.79 0.04 0.00 0.04 0.00 0.00 34.50 32.58 2j58 s PRO 250 CO 0.03 -2.43 0.73 -1.54 0.04 0.00 0.00 177.00 173.83 2j58 s SER 251 N -3.73 5.31 -0.02 6.66 1.04 -1.26 -0.62 113.70 121.09 2j58 s SER 251 Ca 0.64 -0.19 0.02 0.00 0.48 0.00 0.00 55.95 56.91 2j58 s SER 251 Cb -0.17 -0.70 0.11 0.00 0.10 0.00 0.00 66.02 65.36 2j58 s SER 251 CO 0.55 -1.09 0.81 -0.46 0.98 0.00 0.00 173.24 174.03 2j58 n ASN 252 N -2.23 1.28 0.14 7.02 6.94 0.27 -3.95 115.26 124.72 2j58 n ASN 252 Ca 0.09 -2.08 0.16 0.00 -0.02 0.00 0.00 54.58 52.72 2j58 n ASN 252 Cb 0.60 -0.37 0.73 0.00 -2.36 0.00 0.00 39.78 38.37 2j58 n ASN 252 CO 0.00 0.00 0.00 0.44 -1.03 0.00 0.00 177.26 176.67 2j58 h ASP 253 N 0.56 0.00 -0.51 0.53 5.19 -1.94 -2.07 116.42 118.17 2j58 h ASP 253 Ca 0.00 0.00 0.00 0.00 -0.62 0.00 0.00 57.03 56.41 2j58 h ASP 253 Cb 0.51 0.00 0.00 0.00 0.18 0.00 0.00 39.33 40.02 2j58 h ASP 253 CO 0.04 0.00 0.00 -0.90 -3.12 0.00 0.00 179.24 175.26 2j58 n ASP 254 N -4.21 3.61 -2.98 6.45 5.68 -1.25 -4.34 116.55 119.50 2j58 n ASP 254 Ca 0.03 -1.99 -0.33 0.00 -0.50 0.00 0.00 54.79 52.01 2j58 n ASP 254 Cb 0.36 -0.34 -0.04 0.00 -1.14 0.00 0.00 41.12 39.97 2j58 n ASP 254 CO 0.00 0.00 0.00 0.18 -1.33 0.00 0.00 177.20 176.05 2j58 n LEU 255 N 1.49 7.31 -4.76 -2.12 4.77 -0.78 -4.71 117.00 118.20 2j58 n LEU 255 Ca 0.21 -4.40 -0.39 0.00 -0.03 0.00 0.00 56.01 51.40 2j58 n LEU 255 Cb 0.60 -1.34 -0.06 0.00 -2.33 0.00 0.00 43.42 40.29 2j58 n LEU 255 CO 0.16 1.92 0.62 -0.54 -1.33 0.00 0.00 177.39 178.21 2j58 s LYS 256 N -0.87 4.73 -0.01 3.23 -0.14 -1.26 -4.23 119.74 121.18 2j58 s LYS 256 Ca 0.58 1.39 0.02 0.00 -1.36 0.00 0.00 55.97 56.60 2j58 s LYS 256 Cb 0.27 -3.13 0.00 0.00 -1.68 0.00 0.00 37.83 33.28 2j58 s LYS 256 CO -0.13 0.46 -0.07 0.08 -0.76 0.00 0.00 175.35 174.93 2j58 s VAL 257 N -1.31 0.55 -0.17 3.17 1.01 -0.36 0.11 120.40 123.41 2j58 s VAL 257 Ca 0.43 -0.27 -0.01 0.00 0.00 0.00 0.00 61.98 62.13 2j58 s VAL 257 Cb -0.23 -0.49 -0.01 0.00 0.00 0.00 0.00 36.38 35.65 2j58 s VAL 257 CO 0.29 0.17 -0.11 -0.36 0.00 0.00 0.00 175.10 175.09 2j58 s PHE 258 N 0.05 2.86 -0.08 5.22 0.08 -0.57 -0.16 117.98 125.38 2j58 s PHE 258 Ca -0.00 -0.85 0.01 0.00 0.12 0.00 0.00 56.93 56.21 2j58 s PHE 258 Cb -0.05 -1.94 -0.03 0.00 -0.57 0.00 0.00 43.02 40.43 2j58 s PHE 258 CO -0.00 -0.39 -0.09 0.08 -0.10 0.00 0.00 175.22 174.72 2j58 s VAL 259 N 0.82 3.52 0.00 -0.44 1.01 0.24 0.24 120.40 125.79 2j58 s VAL 259 Ca -0.04 -0.54 0.00 0.00 0.00 0.00 0.00 61.98 61.40 2j58 s VAL 259 Cb -0.15 -2.44 0.00 0.00 0.00 0.00 0.00 36.38 33.79 2j58 s VAL 259 CO 0.01 0.58 0.00 0.61 0.00 0.00 0.00 175.10 176.30 2j58 n GLY 261 N 2.46 2.13 2.59 4.51 0.00 -1.26 -1.22 105.19 114.40 2j58 n GLY 261 Ca -0.18 -0.52 -0.41 0.00 0.00 0.00 0.00 46.02 44.92 2j58 n GLY 261 CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11 2j58 n GLU 262 N 10.61 4.18 -4.17 1.61 4.07 0.19 -4.81 120.64 132.32 2j58 n GLU 262 Ca 0.00 -3.36 -0.25 0.00 -0.06 0.00 0.00 57.16 53.49 2j58 n GLU 262 Cb 0.00 -2.75 -0.07 0.00 -0.06 0.00 0.00 31.44 28.55 2j58 n GLU 262 CO 0.00 0.00 0.00 0.14 -0.06 0.00 0.00 177.13 177.21 2j58 s VAL 263 N -0.30 2.23 0.21 6.31 -7.23 -1.26 -1.45 120.40 118.91 2j58 s VAL 263 Ca 0.51 -1.72 -0.09 0.00 -1.81 0.00 0.00 61.98 58.87 2j58 s VAL 263 Cb 0.16 -2.95 0.16 0.00 0.56 0.00 0.00 36.38 34.31 2j58 s VAL 263 CO -0.06 0.00 1.82 1.23 -0.31 0.00 0.00 175.10 177.78 2j58 h GLY 264 N 1.42 1.20 -6.59 2.32 0.00 -0.16 -3.41 103.07 97.84 2j58 h GLY 264 Ca -0.43 -0.56 -0.24 0.00 0.00 0.00 0.00 47.33 46.11 2j58 h GLY 264 CO 0.70 0.53 -0.56 1.25 0.00 0.00 0.00 176.54 178.47 2j58 s LYS 265 N -5.81 0.28 0.33 4.80 2.20 0.51 -4.96 119.74 117.10 2j58 s LYS 265 Ca -0.13 0.32 -0.29 0.00 -0.36 0.00 0.00 55.97 55.52 2j58 s LYS 265 Cb 0.15 -0.80 -0.11 0.00 -1.51 0.00 0.00 37.83 35.57 2j58 s LYS 265 CO 0.81 -0.69 1.43 -0.65 -0.36 0.00 0.00 175.35 175.89 2j58 s GLN 266 N 2.44 4.22 0.08 4.03 -0.21 -1.26 -4.61 119.66 124.35 2j58 s GLN 266 Ca 0.10 2.40 -0.19 0.00 0.02 0.00 0.00 55.36 57.70 2j58 s GLN 266 Cb -0.15 -3.03 0.04 0.00 1.00 0.00 0.00 33.01 30.86 2j58 s GLN 266 CO -0.16 -0.40 0.44 -1.12 -2.12 0.00 0.00 175.29 171.93 2j58 s SER 267 N -0.11 -0.32 -0.22 5.90 0.01 -0.36 -5.00 113.70 113.61 2j58 s SER 267 Ca 0.54 -0.07 -0.08 0.00 1.31 0.00 0.00 55.95 57.64 2j58 s SER 267 Cb -0.43 0.47 -0.04 0.00 0.21 0.00 0.00 66.02 66.22 2j58 s SER 267 CO 0.55 -0.76 0.09 -0.89 0.41 0.00 0.00 173.24 172.64 2j58 s THR 268 N -3.03 4.82 0.26 1.44 2.01 -1.26 -0.59 115.64 119.29 2j58 s THR 268 Ca -0.02 -0.01 0.09 0.00 0.31 0.00 0.00 61.69 62.06 2j58 s THR 268 Cb 0.00 -3.22 -0.04 0.00 0.01 0.00 0.00 72.50 69.25 2j58 s THR 268 CO -0.06 0.39 0.02 -0.76 -0.69 0.00 0.00 174.62 173.51 2j58 s LEU 269 N 0.95 3.28 0.00 4.42 1.43 0.77 -4.97 118.68 124.56 2j58 s LEU 269 Ca 0.05 -0.59 0.00 0.00 -1.03 0.00 0.00 54.13 52.56 2j58 s LEU 269 Cb -0.14 -1.80 0.00 0.00 0.03 0.00 0.00 46.19 44.28 2j58 s LEU 269 CO 0.03 -0.00 0.00 0.29 0.23 0.00 0.00 176.35 176.90 2j58 n LYS 270 N -0.91 3.37 -1.23 1.70 5.02 -1.26 -1.22 118.16 123.63 2j58 n LYS 270 Ca -0.07 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.22 2j58 n LYS 270 Cb 0.59 0.00 0.00 0.00 -0.02 0.00 0.00 35.03 35.60 2j58 n LYS 270 CO 0.00 0.00 0.00 -0.40 -0.52 0.00 0.00 177.40 176.48 2j58 n ASP 272 N 0.00 0.98 0.00 4.39 5.68 -1.26 -5.01 116.55 121.33 2j58 n ASP 272 Ca 0.00 -0.61 0.10 0.00 -0.50 0.00 0.00 54.79 53.78 2j58 n ASP 272 Cb 0.00 0.00 0.45 0.00 -1.14 0.00 0.00 41.12 40.43 2j58 n ASP 272 CO 0.00 0.00 0.00 0.54 -1.33 0.00 0.00 177.20 176.41 2j58 n ARG 273 N 0.00 0.04 0.00 0.11 1.74 -1.26 -2.04 116.66 115.25 2j58 n ARG 273 Ca 0.00 0.14 0.12 0.00 -0.77 0.00 0.00 57.85 57.34 2j58 n ARG 273 Cb 0.00 -1.50 0.21 0.00 -1.02 0.00 0.00 32.46 30.15 2j58 n ARG 273 CO 0.00 0.00 0.00 -1.13 -1.52 0.00 0.00 177.63 174.98 2j58 n SER 274 N -1.47 0.97 0.00 0.55 3.41 -1.26 -5.01 113.62 110.81 2j58 n SER 274 Ca 0.06 -0.77 0.00 0.00 -0.26 0.00 0.00 58.87 57.90 2j58 n SER 274 Cb 0.23 0.35 0.00 0.00 -0.26 0.00 0.00 64.21 64.52 2j58 n SER 274 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2j58 n GLY 275 N 1.43 0.89 3.25 5.00 0.00 -0.87 -5.16 105.19 109.73 2j58 n GLY 275 Ca 0.08 -1.01 -0.09 0.00 0.00 0.00 0.00 46.02 45.00 2j58 n GLY 275 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2j58 s THR 277 N 0.00 0.09 0.20 2.61 -4.23 -1.26 -4.00 115.64 109.05 2j58 s THR 277 Ca 0.00 -1.58 -0.11 0.00 -1.18 0.00 0.00 61.69 58.82 2j58 s THR 277 Cb 0.00 -1.86 0.15 0.00 1.34 0.00 0.00 72.50 72.12 2j58 s THR 277 CO 0.00 -0.42 1.71 0.25 -0.54 0.00 0.00 174.62 175.62 2j58 h LEU 278 N 2.70 0.01 -0.81 4.79 5.85 -1.03 -1.79 115.31 125.03 2j58 h LEU 278 Ca -0.33 0.10 0.02 0.00 0.84 0.00 0.00 57.88 58.51 2j58 h LEU 278 Cb 1.21 0.14 -0.04 0.00 0.37 0.00 0.00 40.66 42.34 2j58 h LEU 278 CO 0.54 0.02 0.53 0.00 -0.34 0.00 0.00 178.44 179.18 2j58 h ALA 279 N 1.45 1.04 -0.36 1.25 0.00 -1.70 -2.01 119.26 118.93 2j58 h ALA 279 Ca 0.30 -0.05 -0.05 0.00 0.00 0.00 0.00 54.91 55.11 2j58 h ALA 279 Cb 0.42 -0.31 -0.01 0.00 0.00 0.00 0.00 17.79 17.89 2j58 h ALA 279 CO -0.38 0.40 0.03 1.49 0.00 0.00 0.00 179.25 180.79 2j58 h GLU 280 N 1.06 0.61 -0.64 0.00 4.81 -1.74 -1.44 114.58 117.24 2j58 h GLU 280 Ca 0.31 -0.18 0.12 0.00 -0.13 0.00 0.00 59.36 59.48 2j58 h GLU 280 Cb -0.07 -0.06 -0.09 0.00 0.63 0.00 0.00 28.75 29.16 2j58 h GLU 280 CO -0.09 0.70 0.15 0.00 -0.73 0.00 0.00 179.01 179.04 2j58 h ALA 281 N 0.89 0.78 -0.37 2.92 0.00 -0.89 0.19 119.26 122.78 2j58 h ALA 281 Ca 0.11 0.14 -0.07 0.00 0.00 0.00 0.00 54.91 55.08 2j58 h ALA 281 Cb 0.40 0.18 -0.01 0.00 0.00 0.00 0.00 17.79 18.35 2j58 h ALA 281 CO 0.01 -0.30 -0.03 -0.07 0.00 0.00 0.00 179.25 178.86 2j58 h LEU 282 N 0.28 0.67 -0.78 0.00 3.38 -1.14 -2.12 115.31 115.59 2j58 h LEU 282 Ca 0.34 -0.33 0.01 0.00 0.09 0.00 0.00 57.88 57.99 2j58 h LEU 282 Cb 0.52 -0.18 -0.04 0.00 0.09 0.00 0.00 40.66 41.05 2j58 h LEU 282 CO -0.42 0.84 0.52 1.23 0.09 0.00 0.00 178.44 180.69 2j58 h GLY 283 N 0.48 1.10 2.00 0.83 0.00 -0.63 0.33 103.07 107.19 2j58 h GLY 283 Ca 0.10 -0.41 -0.03 0.00 0.00 0.00 0.00 47.33 46.99 2j58 h GLY 283 CO 0.02 0.41 -0.15 3.43 0.00 0.00 0.00 176.54 180.25 2j58 h ASN 284 N 1.06 0.00 -0.32 0.19 2.35 -0.49 -1.80 115.58 116.56 2j58 h ASN 284 Ca 0.29 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 56.04 2j58 h ASN 284 Cb -0.12 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.25 2j58 h ASN 284 CO -0.06 0.15 0.00 0.00 -1.65 0.00 0.00 177.43 175.86 2j58 n ALA 285 N -2.24 3.22 -2.79 -0.83 0.00 -0.80 -4.90 120.51 112.17 2j58 n ALA 285 Ca -0.01 -1.04 -0.19 0.00 0.00 0.00 0.00 53.44 52.21 2j58 n ALA 285 Cb 0.31 -1.06 0.02 0.00 0.00 0.00 0.00 19.45 18.72 2j58 n ALA 285 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.50 177.89 2j58 n GLU 286 N 0.37 -3.65 -0.25 0.00 1.02 -0.68 -0.36 120.64 117.09 2j58 n GLU 286 Ca 0.15 0.79 0.03 0.00 -0.02 0.00 0.00 57.16 58.11 2j58 n GLU 286 Cb 0.75 -5.34 -0.01 0.00 -0.02 0.00 0.00 31.44 26.81 2j58 n GLU 286 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 2j58 n GLY 287 N -1.34 -2.29 3.75 0.62 0.00 0.11 -3.64 105.19 102.40 2j58 n GLY 287 Ca -0.12 -1.41 -0.42 0.00 0.00 0.00 0.00 46.02 44.07 2j58 n GLY 287 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 2j58 n ILE 288 N -2.68 1.20 -2.09 -0.61 5.41 -1.26 -0.62 119.36 118.70 2j58 n ILE 288 Ca -0.01 -0.30 -0.43 0.00 1.00 0.00 0.00 62.75 63.01 2j58 n ILE 288 Cb 0.12 -1.94 -0.03 0.00 -0.71 0.00 0.00 39.64 37.08 2j58 n ILE 288 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 176.55 176.00 2j58 s SER 289 N 0.37 6.16 0.33 4.38 0.15 -0.53 -4.75 113.70 119.81 2j58 s SER 289 Ca 0.62 1.38 0.07 0.00 0.70 0.00 0.00 55.95 58.73 2j58 s SER 289 Cb -0.50 -2.53 0.60 0.00 -1.71 0.00 0.00 66.02 61.88 2j58 s SER 289 CO 0.51 -1.48 1.80 1.56 1.20 0.00 0.00 173.24 176.83 2j58 h GLN 290 N 11.69 0.27 0.00 5.44 1.08 -1.92 -0.80 115.11 130.88 2j58 h GLN 290 Ca -0.33 -0.09 0.00 0.00 -1.45 0.00 0.00 58.65 56.78 2j58 h GLN 290 Cb 1.15 -0.02 0.00 0.00 -0.05 0.00 0.00 27.48 28.56 2j58 h GLN 290 CO 1.02 0.52 0.00 0.39 -0.95 0.00 0.00 178.83 179.81 2j58 n GLU 291 N -4.15 0.81 -0.56 1.46 4.71 -1.26 -5.07 120.64 116.57 2j58 n GLU 291 Ca -0.01 0.00 0.00 0.00 -0.01 0.00 0.00 57.16 57.14 2j58 n GLU 291 Cb 0.37 -1.35 0.00 0.00 -1.01 0.00 0.00 31.44 29.45 2j58 n GLU 291 CO 0.00 0.00 0.00 -1.13 0.09 0.00 0.00 177.13 176.09 2j58 n SER 293 N -0.85 0.00 -4.28 1.62 3.41 -0.31 -5.02 113.62 108.18 2j58 n SER 293 Ca 0.14 0.00 -0.43 0.00 -0.26 0.00 0.00 58.87 58.32 2j58 n SER 293 Cb 0.06 -1.27 -0.08 0.00 -0.26 0.00 0.00 64.21 62.66 2j58 n SER 293 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 2j58 s ASP 294 N -3.98 5.89 0.00 4.04 -1.08 0.12 -4.03 116.67 117.64 2j58 s ASP 294 Ca 0.00 -1.67 0.29 0.00 -0.52 0.00 0.00 52.55 50.65 2j58 s ASP 294 Cb 0.00 -2.09 1.73 0.00 -1.46 0.00 0.00 42.92 41.10 2j58 s ASP 294 CO 0.00 -0.69 2.07 0.00 0.52 0.00 0.00 175.17 177.07 2j58 n ALA 295 N 5.05 2.58 0.97 3.66 0.00 -1.26 -1.69 120.51 129.83 2j58 n ALA 295 Ca -0.11 -0.18 0.14 0.00 0.00 0.00 0.00 53.44 53.29 2j58 n ALA 295 Cb 0.42 -1.47 0.60 0.00 0.00 0.00 0.00 19.45 19.00 2j58 n ALA 295 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.50 177.75 2j58 n THR 296 N -1.00 0.04 -3.19 0.00 -2.24 -1.26 0.04 114.28 106.68 2j58 n THR 296 Ca 0.22 -0.02 -0.29 0.00 -2.27 0.00 0.00 64.05 61.69 2j58 n THR 296 Cb 0.10 -0.50 -0.06 0.00 -2.10 0.00 0.00 70.33 67.78 2j58 n THR 296 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2j58 n GLY 297 N 1.49 5.18 3.34 3.38 0.00 -0.68 -4.15 105.19 113.74 2j58 n GLY 297 Ca 0.07 -2.76 -0.36 0.00 0.00 0.00 0.00 46.02 42.96 2j58 n GLY 297 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2j58 s ILE 298 N -3.25 3.79 0.11 -0.61 1.01 -1.05 -1.63 121.20 119.57 2j58 s ILE 298 Ca 0.42 -0.62 0.10 0.00 0.00 0.00 0.00 60.65 60.55 2j58 s ILE 298 Cb 0.19 -2.89 -0.04 0.00 0.01 0.00 0.00 42.46 39.73 2j58 s ILE 298 CO -0.05 0.19 -0.25 -0.36 0.00 0.00 0.00 174.94 174.47 2j58 s PHE 299 N 1.49 2.16 -0.14 3.97 0.08 0.32 0.57 117.98 126.43 2j58 s PHE 299 Ca 0.03 -0.39 0.02 0.00 0.12 0.00 0.00 56.93 56.72 2j58 s PHE 299 Cb -0.16 -1.19 0.01 0.00 -0.57 0.00 0.00 43.02 41.11 2j58 s PHE 299 CO 0.01 0.27 -0.22 0.08 -0.10 0.00 0.00 175.22 175.26 2j58 s VAL 300 N -1.05 2.11 -0.23 -0.44 1.01 -0.44 -0.60 120.40 120.76 2j58 s VAL 300 Ca 0.12 -0.97 -0.06 0.00 0.00 0.00 0.00 61.98 61.07 2j58 s VAL 300 Cb -0.10 -1.84 -0.02 0.00 0.00 0.00 0.00 36.38 34.42 2j58 s VAL 300 CO 0.05 0.55 0.03 -0.69 0.00 0.00 0.00 175.10 175.04 2j58 s VAL 301 N 0.77 4.04 -0.08 2.92 1.01 0.41 -0.39 120.40 129.09 2j58 s VAL 301 Ca -0.08 -0.27 0.02 0.00 0.00 0.00 0.00 61.98 61.66 2j58 s VAL 301 Cb -0.16 -2.87 0.01 0.00 0.00 0.00 0.00 36.38 33.36 2j58 s VAL 301 CO -0.01 0.37 -0.15 -0.60 0.00 0.00 0.00 175.10 174.72 2j58 s ARG 302 N 1.48 2.03 0.28 2.72 3.52 -0.04 -1.75 118.95 127.20 2j58 s ARG 302 Ca 0.06 -0.52 -0.30 0.00 -0.13 0.00 0.00 55.73 54.83 2j58 s ARG 302 Cb -0.15 -1.66 -0.12 0.00 -1.56 0.00 0.00 34.95 31.47 2j58 s ARG 302 CO 0.02 0.03 1.58 0.94 -0.81 0.00 0.00 175.30 177.06 2j58 n GLN 303 N 3.86 2.62 -4.02 5.12 7.27 -1.26 -0.72 117.38 130.25 2j58 n GLN 303 Ca -0.21 0.93 -0.35 0.00 0.07 0.00 0.00 57.00 57.44 2j58 n GLN 303 Cb 0.52 -2.70 -0.12 0.00 2.41 0.00 0.00 30.24 30.34 2j58 n GLN 303 CO 0.00 0.00 0.00 -1.17 0.07 0.00 0.00 177.06 175.96 2j58 s LEU 304 N -0.32 3.33 -0.09 1.69 2.96 -0.29 -4.75 118.68 121.22 2j58 s LEU 304 Ca 0.65 -0.18 -0.04 0.00 -0.22 0.00 0.00 54.13 54.34 2j58 s LEU 304 Cb -0.52 -1.85 -0.04 0.00 0.50 0.00 0.00 46.19 44.29 2j58 s LEU 304 CO 0.48 0.06 0.07 -0.54 -1.32 0.00 0.00 176.35 175.09 2j58 s LYS 305 N 1.04 3.17 -1.93 1.98 1.02 -1.26 -4.56 119.74 119.20 2j58 s LYS 305 Ca 0.02 -0.30 0.00 0.00 0.02 0.00 0.00 55.97 55.71 2j58 s LYS 305 Cb -0.14 -2.96 0.00 0.00 -0.52 0.00 0.00 37.83 34.21 2j58 s LYS 305 CO 0.02 0.73 0.00 0.41 -0.92 0.00 0.00 175.35 175.59 2j58 n GLY 306 N 1.98 0.66 3.75 -3.33 0.00 -1.26 -4.95 105.19 102.03 2j58 n GLY 306 Ca -0.19 -0.03 -0.41 0.00 0.00 0.00 0.00 46.02 45.39 2j58 n GLY 306 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 2j58 s ASP 307 N -2.41 6.81 0.00 1.61 2.15 -1.26 -4.91 116.67 118.65 2j58 s ASP 307 Ca 0.00 2.55 0.26 0.00 0.43 0.00 0.00 52.55 55.79 2j58 s ASP 307 Cb 0.00 -2.62 0.60 0.00 -0.30 0.00 0.00 42.92 40.59 2j58 s ASP 307 CO 0.00 -0.56 1.49 0.54 -0.17 0.00 0.00 175.17 176.47 2j58 n ARG 308 N 2.01 2.01 -0.61 4.34 1.74 -1.26 -3.85 116.66 121.04 2j58 n ARG 308 Ca 0.04 -1.47 0.06 0.00 -0.77 0.00 0.00 57.85 55.71 2j58 n ARG 308 Cb 0.42 -1.47 0.29 0.00 -1.02 0.00 0.00 32.46 30.68 2j58 n ARG 308 CO 0.00 0.00 0.00 0.25 -1.52 0.00 0.00 177.63 176.36 2j58 n THR 309 N 0.79 2.46 -0.91 0.55 -2.24 -1.26 -4.96 114.28 108.71 2j58 n THR 309 Ca 0.16 -1.83 0.00 0.00 -2.27 0.00 0.00 64.05 60.11 2j58 n THR 309 Cb 0.48 -0.27 0.00 0.00 -2.10 0.00 0.00 70.33 68.44 2j58 n THR 309 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2j58 n GLY 310 N -0.31 1.06 3.77 3.38 0.00 -1.25 -5.02 105.19 106.81 2j58 n GLY 310 Ca 0.25 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.87 2j58 n GLY 310 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2j58 s LYS 311 N -0.05 4.43 -0.00 1.61 -0.14 -1.26 -4.84 119.74 119.49 2j58 s LYS 311 Ca 0.00 2.00 0.12 0.00 -1.36 0.00 0.00 55.97 56.73 2j58 s LYS 311 Cb 0.00 -3.07 -0.15 0.00 -1.68 0.00 0.00 37.83 32.94 2j58 s LYS 311 CO 0.00 -0.04 0.47 0.44 -0.76 0.00 0.00 175.35 175.45 2j58 n ILE 312 N 0.86 0.00 -3.56 2.17 -5.35 0.15 -4.54 119.36 109.09 2j58 n ILE 312 Ca 0.00 -0.23 -0.17 0.00 -0.27 0.00 0.00 62.75 62.08 2j58 n ILE 312 Cb 0.44 0.83 -0.06 0.00 -1.74 0.00 0.00 39.64 39.10 2j58 n ILE 312 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 2j58 s ALA 313 N -2.31 -1.71 -0.09 -1.28 0.00 -1.21 -1.13 121.76 114.03 2j58 s ALA 313 Ca 0.03 1.41 -0.04 0.00 0.00 0.00 0.00 51.96 53.36 2j58 s ALA 313 Cb 0.09 -0.25 -0.04 0.00 0.00 0.00 0.00 23.12 22.92 2j58 s ALA 313 CO 0.51 -0.35 0.07 -0.51 0.00 0.00 0.00 175.76 175.47 2j58 s ASP 314 N -0.84 5.78 -0.12 0.00 1.01 0.10 -1.88 116.67 120.71 2j58 s ASP 314 Ca -0.09 0.29 0.03 0.00 0.71 0.00 0.00 52.55 53.49 2j58 s ASP 314 Cb -0.01 -1.75 0.00 0.00 1.01 0.00 0.00 42.92 42.17 2j58 s ASP 314 CO 0.08 0.38 -0.22 -0.63 0.21 0.00 0.00 175.17 174.99 2j58 s ILE 315 N -0.98 2.13 -0.24 0.77 1.01 0.42 -0.86 121.20 123.46 2j58 s ILE 315 Ca 0.15 -0.98 -0.05 0.00 0.00 0.00 0.00 60.65 59.77 2j58 s ILE 315 Cb -0.12 -1.84 -0.01 0.00 0.01 0.00 0.00 42.46 40.51 2j58 s ILE 315 CO 0.04 0.55 0.00 -0.31 0.00 0.00 0.00 174.94 175.23 2j58 s TYR 316 N 0.57 3.02 -0.27 3.97 2.02 0.48 0.06 117.35 127.19 2j58 s TYR 316 Ca -0.13 -0.80 -0.09 0.00 -0.37 0.00 0.00 57.07 55.68 2j58 s TYR 316 Cb -0.17 -2.16 -0.03 0.00 -0.40 0.00 0.00 41.96 39.20 2j58 s TYR 316 CO 0.04 -0.50 0.12 -1.14 -1.57 0.00 0.00 175.55 172.50 2j58 s GLN 317 N 1.52 3.67 -0.24 -0.62 0.74 0.17 -1.32 119.66 123.57 2j58 s GLN 317 Ca 0.06 -0.48 -0.10 0.00 0.05 0.00 0.00 55.36 54.88 2j58 s GLN 317 Cb -0.15 -3.47 -0.05 0.00 1.10 0.00 0.00 33.01 30.44 2j58 s GLN 317 CO -0.01 -0.23 0.15 -1.17 -0.55 0.00 0.00 175.29 173.48 2j58 s LEU 318 N 1.66 4.04 -0.59 3.68 2.96 0.19 -4.56 118.68 126.06 2j58 s LEU 318 Ca 0.06 0.07 -0.22 0.00 -0.22 0.00 0.00 54.13 53.82 2j58 s LEU 318 Cb -0.16 -2.09 0.06 0.00 0.50 0.00 0.00 46.19 44.50 2j58 s LEU 318 CO 0.06 0.05 0.89 0.21 -1.32 0.00 0.00 176.35 176.24 2j58 s ASN 319 N 1.17 6.24 -0.32 3.68 3.84 -1.26 -2.53 114.94 125.76 2j58 s ASN 319 Ca 0.07 -0.76 0.08 0.00 0.21 0.00 0.00 52.86 52.46 2j58 s ASN 319 Cb -0.14 -2.40 0.48 0.00 -0.55 0.00 0.00 41.25 38.64 2j58 s ASN 319 CO 0.05 -1.25 1.43 0.00 -2.79 0.00 0.00 177.10 174.54 2j58 n ALA 320 N 7.29 4.59 -0.26 1.71 0.00 0.11 -4.59 120.51 129.36 2j58 n ALA 320 Ca -0.02 -3.34 0.07 0.00 0.00 0.00 0.00 53.44 50.14 2j58 n ALA 320 Cb 0.46 -0.69 0.31 0.00 0.00 0.00 0.00 19.45 19.53 2j58 n ALA 320 CO 0.00 0.00 0.00 1.96 0.00 0.00 0.00 177.50 179.46 2j58 h GLN 321 N 1.34 0.83 -5.33 0.00 4.20 -1.85 -3.32 115.11 110.97 2j58 h GLN 321 Ca 0.26 -0.05 -0.62 0.00 0.06 0.00 0.00 58.65 58.30 2j58 h GLN 321 Cb 1.48 -0.19 -0.13 0.00 0.30 0.00 0.00 27.48 28.94 2j58 h GLN 321 CO 0.53 0.55 -0.03 0.34 -0.67 0.00 0.00 178.83 179.55 2j58 s ASP 322 N -6.00 6.40 0.57 1.46 -1.08 -1.26 -4.97 116.67 111.79 2j58 s ASP 322 Ca -0.10 0.41 0.32 0.00 -0.52 0.00 0.00 52.55 52.66 2j58 s ASP 322 Cb 0.20 -2.28 1.73 0.00 -1.46 0.00 0.00 42.92 41.12 2j58 s ASP 322 CO 0.79 -0.32 2.17 0.00 0.52 0.00 0.00 175.17 178.33 2j58 h ALA 323 N 8.11 1.27 0.00 3.66 0.00 -1.95 -1.01 119.26 129.34 2j58 h ALA 323 Ca -0.29 -0.05 -0.02 0.00 0.00 0.00 0.00 54.91 54.55 2j58 h ALA 323 Cb 1.14 -0.01 -0.00 0.00 0.00 0.00 0.00 17.79 18.92 2j58 h ALA 323 CO 0.72 0.07 -0.11 0.66 0.00 0.00 0.00 179.25 180.59 2j58 h SER 324 N 0.00 0.00 0.00 0.00 4.64 -1.93 -3.39 113.55 112.87 2j58 h SER 324 Ca -0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 2j58 h SER 324 Cb 0.20 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.29 2j58 h SER 324 CO 0.01 0.11 0.73 0.00 -0.87 0.00 0.00 176.83 176.80 2j58 n ALA 325 N -2.25 0.94 0.00 5.18 0.00 -0.38 -4.54 120.51 119.45 2j58 n ALA 325 Ca -0.02 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.42 2j58 n ALA 325 Cb 0.24 -2.23 0.00 0.00 0.00 0.00 0.00 19.45 17.46 2j58 n ALA 325 CO 0.00 0.00 0.00 1.55 0.00 0.00 0.00 177.50 179.05 2j58 n VAL 327 N 3.97 0.00 -0.04 0.00 3.14 -1.26 -3.96 118.33 120.18 2j58 n VAL 327 Ca 0.00 0.00 -0.05 0.00 -2.96 0.00 0.00 64.34 61.33 2j58 n VAL 327 Cb 0.00 0.00 0.16 0.00 -1.06 0.00 0.00 33.84 32.94 2j58 n VAL 327 CO 0.00 0.00 0.00 -0.07 -6.46 0.00 0.00 176.83 170.30 2j58 h LEU 328 N 0.00 0.63 -1.69 6.55 3.38 -1.96 -2.24 115.31 119.98 2j58 h LEU 328 Ca 0.00 -0.20 -0.03 0.00 0.09 0.00 0.00 57.88 57.74 2j58 h LEU 328 Cb 0.00 -0.17 -0.00 0.00 0.09 0.00 0.00 40.66 40.57 2j58 h LEU 328 CO 0.00 0.82 -0.16 1.23 0.09 0.00 0.00 178.44 180.41 2j58 h GLY 329 N 0.98 0.00 2.00 0.83 0.00 -1.94 -1.31 103.07 103.63 2j58 h GLY 329 Ca 0.09 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.42 2j58 h GLY 329 CO 0.04 0.00 0.00 -1.30 0.00 0.00 0.00 176.54 175.28 2j58 n THR 330 N -3.65 0.58 0.56 4.70 -2.24 -0.85 -1.99 114.28 111.40 2j58 n THR 330 Ca -0.01 0.08 0.06 0.00 -2.27 0.00 0.00 64.05 61.90 2j58 n THR 330 Cb 0.29 -0.80 -0.07 0.00 -2.10 0.00 0.00 70.33 67.65 2j58 n THR 330 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 2j58 n GLU 331 N -1.75 2.98 -3.32 -0.78 1.02 -0.55 -4.92 120.64 113.31 2j58 n GLU 331 Ca 0.05 -0.00 -0.41 0.00 -0.02 0.00 0.00 57.16 56.78 2j58 n GLU 331 Cb 0.28 -1.07 -0.09 0.00 -0.02 0.00 0.00 31.44 30.54 2j58 n GLU 331 CO 0.00 0.00 0.00 0.12 1.18 0.00 0.00 177.13 178.43 2j58 s PHE 332 N -2.15 3.20 -0.05 -0.32 5.36 -0.86 -4.95 117.98 118.22 2j58 s PHE 332 Ca 0.04 0.16 -0.25 0.00 -0.96 0.00 0.00 56.93 55.92 2j58 s PHE 332 Cb 0.09 -2.77 -0.04 0.00 -0.34 0.00 0.00 43.02 39.97 2j58 s PHE 332 CO 0.49 -0.44 0.77 -0.65 -1.46 0.00 0.00 175.22 173.93 2j58 s GLN 333 N 2.20 4.47 0.39 10.12 -1.52 -1.26 -1.86 119.66 132.20 2j58 s GLN 333 Ca 0.16 1.02 -0.19 0.00 -1.95 0.00 0.00 55.36 54.40 2j58 s GLN 333 Cb -0.16 -3.45 -0.10 0.00 -0.22 0.00 0.00 33.01 29.08 2j58 s GLN 333 CO 0.12 0.04 0.87 -0.51 -0.25 0.00 0.00 175.29 175.57 2j58 s LEU 334 N 0.82 4.00 0.19 2.90 1.43 -1.26 -4.93 118.68 121.82 2j58 s LEU 334 Ca 0.41 1.55 0.09 0.00 -1.03 0.00 0.00 54.13 55.15 2j58 s LEU 334 Cb -0.19 -4.35 -0.04 0.00 0.03 0.00 0.00 46.19 41.64 2j58 s LEU 334 CO 0.21 -0.29 -0.09 -1.10 0.23 0.00 0.00 176.35 175.31 2j58 s GLN 335 N -3.05 2.08 0.29 1.70 -0.21 -1.26 -4.94 119.66 114.27 2j58 s GLN 335 Ca 0.59 -1.28 -0.29 0.00 0.02 0.00 0.00 55.36 54.39 2j58 s GLN 335 Cb -0.10 -2.16 -0.13 0.00 1.00 0.00 0.00 33.01 31.62 2j58 s GLN 335 CO 0.15 0.43 1.18 -2.30 -2.12 0.00 0.00 175.29 172.63 2j58 n PRO 336 N -0.05 1.73 -0.97 2.91 -0.02 -1.26 -1.58 135.00 135.76 2j58 n PRO 336 Ca -0.10 0.61 0.00 0.00 -2.02 0.00 0.00 63.50 61.99 2j58 n PRO 336 Cb 0.56 -2.11 0.00 0.00 -0.02 0.00 0.00 33.50 31.93 2j58 n PRO 336 CO 0.00 0.00 0.00 0.66 1.98 0.00 0.00 175.50 178.14 2j58 n TYR 337 N 0.60 0.00 -1.68 6.00 4.01 0.29 -4.91 117.16 121.47 2j58 n TYR 337 Ca 0.08 0.00 -0.40 0.00 -0.16 0.00 0.00 57.90 57.43 2j58 n TYR 337 Cb 0.33 -0.54 0.03 0.00 -0.31 0.00 0.00 39.34 38.85 2j58 n TYR 337 CO 0.00 0.00 0.00 -0.25 -0.46 0.00 0.00 176.86 176.15 2j58 n ASP 338 N -0.22 2.05 -4.59 7.72 8.00 -0.62 -4.82 116.55 124.08 2j58 n ASP 338 Ca 0.00 1.01 -0.34 0.00 0.71 0.00 0.00 54.79 56.17 2j58 n ASP 338 Cb 0.11 -1.47 -0.11 0.00 -0.02 0.00 0.00 41.12 39.63 2j58 n ASP 338 CO 0.00 0.00 0.00 -0.63 -0.39 0.00 0.00 177.20 176.18 2j58 s ILE 339 N -1.29 4.33 -0.22 0.53 1.01 -0.72 -1.51 121.20 123.34 2j58 s ILE 339 Ca 0.66 -0.21 -0.07 0.00 0.00 0.00 0.00 60.65 61.04 2j58 s ILE 339 Cb -0.48 -2.91 -0.03 0.00 0.01 0.00 0.00 42.46 39.05 2j58 s ILE 339 CO 0.54 0.50 0.06 -0.69 0.00 0.00 0.00 174.94 175.35 2j58 s VAL 340 N 0.13 4.41 -0.06 2.92 1.01 0.14 -0.44 120.40 128.50 2j58 s VAL 340 Ca 0.02 -0.15 0.03 0.00 0.00 0.00 0.00 61.98 61.87 2j58 s VAL 340 Cb -0.13 -3.03 0.01 0.00 0.00 0.00 0.00 36.38 33.23 2j58 s VAL 340 CO 0.02 0.39 -0.14 -0.47 0.00 0.00 0.00 175.10 174.89 2j58 s TYR 341 N 1.15 1.58 -0.18 5.22 5.04 0.23 -4.25 117.35 126.14 2j58 s TYR 341 Ca 0.04 -0.56 -0.00 0.00 -2.44 0.00 0.00 57.07 54.11 2j58 s TYR 341 Cb -0.14 -1.12 0.01 0.00 0.35 0.00 0.00 41.96 41.05 2j58 s TYR 341 CO 0.03 -0.26 -0.15 0.08 -1.34 0.00 0.00 175.55 173.91 2j58 s VAL 342 N 0.49 2.53 0.62 3.14 1.01 -1.26 -0.52 120.40 126.41 2j58 s VAL 342 Ca -0.12 -0.79 -0.16 0.00 0.00 0.00 0.00 61.98 60.90 2j58 s VAL 342 Cb -0.15 -2.08 -0.02 0.00 0.00 0.00 0.00 36.38 34.13 2j58 s VAL 342 CO 0.04 0.51 1.10 0.42 0.00 0.00 0.00 175.10 177.16 2j58 s THR 343 N 1.13 3.39 0.15 3.92 -4.23 -0.65 0.55 115.64 119.90 2j58 s THR 343 Ca 0.01 0.69 -0.15 0.00 -1.18 0.00 0.00 61.69 61.06 2j58 s THR 343 Cb -0.14 -3.21 -0.07 0.00 1.34 0.00 0.00 72.50 70.42 2j58 s THR 343 CO -0.06 -0.36 0.57 -0.89 -0.54 0.00 0.00 174.62 173.34 2j58 s THR 344 N -2.27 4.83 0.30 3.99 2.01 -1.26 -0.70 115.64 122.53 2j58 s THR 344 Ca 0.67 0.88 -0.30 0.00 0.31 0.00 0.00 61.69 63.25 2j58 s THR 344 Cb -0.20 -3.75 -0.12 0.00 0.01 0.00 0.00 72.50 68.44 2j58 s THR 344 CO 0.37 0.24 1.53 0.00 -0.69 0.00 0.00 174.62 176.07 2j58 n ALA 345 N 0.80 2.16 -0.29 7.40 0.00 -1.26 -4.25 120.51 125.08 2j58 n ALA 345 Ca -0.05 0.38 0.07 0.00 0.00 0.00 0.00 53.44 53.83 2j58 n ALA 345 Cb 0.52 -2.41 0.17 0.00 0.00 0.00 0.00 19.45 17.73 2j58 n ALA 345 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 177.50 176.15 2j58 h PRO 346 N 4.31 0.06 0.00 0.00 0.11 -1.96 -0.56 132.00 133.95 2j58 h PRO 346 Ca -0.47 -0.00 -0.07 0.00 0.11 0.00 0.00 66.00 65.57 2j58 h PRO 346 Cb 1.24 -0.01 -0.01 0.00 0.11 0.00 0.00 31.00 32.33 2j58 h PRO 346 CO 0.76 0.04 -0.31 -0.07 -0.21 0.00 0.00 178.00 178.20 2j58 h LEU 347 N 0.06 0.00 -0.17 2.35 3.38 -1.99 -0.66 115.31 118.28 2j58 h LEU 347 Ca 0.45 0.00 -0.09 0.00 0.09 0.00 0.00 57.88 58.33 2j58 h LEU 347 Cb 0.80 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.55 2j58 h LEU 347 CO -0.77 0.31 -0.26 0.58 0.09 0.00 0.00 178.44 178.40 2j58 h VAL 348 N 0.00 1.35 -0.80 1.22 2.07 -1.50 -1.58 116.25 117.01 2j58 h VAL 348 Ca -0.00 -1.47 -0.01 0.00 0.82 0.00 0.00 66.70 66.04 2j58 h VAL 348 Cb 0.62 1.89 -0.04 0.00 -1.52 0.00 0.00 31.29 32.24 2j58 h VAL 348 CO 0.04 0.44 0.48 0.03 0.02 0.00 0.00 177.57 178.58 2j58 h ARG 349 N 0.12 1.08 -0.14 1.57 3.08 -0.85 0.89 114.38 120.13 2j58 h ARG 349 Ca 0.02 -0.10 0.04 0.00 0.07 0.00 0.00 59.98 60.01 2j58 h ARG 349 Cb 0.83 -0.23 -0.05 0.00 0.08 0.00 0.00 29.97 30.61 2j58 h ARG 349 CO 0.06 0.77 -0.15 2.35 -1.07 0.00 0.00 179.97 181.93 2j58 h TRP 350 N 1.09 -0.39 0.00 3.04 2.91 -1.10 -2.22 115.95 119.29 2j58 h TRP 350 Ca 0.28 0.02 -0.04 0.00 1.13 0.00 0.00 58.89 60.29 2j58 h TRP 350 Cb -0.03 0.19 -0.01 0.00 -0.51 0.00 0.00 29.16 28.80 2j58 h TRP 350 CO -0.00 -0.22 -0.20 -0.97 -1.03 0.00 0.00 178.44 176.02 2j58 h ASN 351 N -0.18 0.00 0.54 2.65 -1.24 -0.88 -0.62 115.58 115.84 2j58 h ASN 351 Ca 0.10 0.00 -0.03 0.00 0.71 0.00 0.00 56.30 57.07 2j58 h ASN 351 Cb 0.33 0.00 -0.00 0.00 0.73 0.00 0.00 38.32 39.37 2j58 h ASN 351 CO -0.25 0.20 -0.16 0.03 -1.29 0.00 0.00 177.43 175.95 2j58 h ARG 352 N 0.00 0.00 0.00 6.67 3.08 -0.22 -0.54 114.38 123.38 2j58 h ARG 352 Ca -0.00 0.00 -0.02 0.00 0.07 0.00 0.00 59.98 60.03 2j58 h ARG 352 Cb 0.58 0.00 -0.00 0.00 0.08 0.00 0.00 29.97 30.63 2j58 h ARG 352 CO 0.03 0.16 -0.13 0.28 -1.07 0.00 0.00 179.97 179.24 2j58 h VAL 353 N 0.00 0.84 -0.93 2.04 2.07 -0.89 -3.38 116.25 116.00 2j58 h VAL 353 Ca -0.00 -1.67 0.06 0.00 0.82 0.00 0.00 66.70 65.91 2j58 h VAL 353 Cb 0.47 1.62 -0.06 0.00 -1.52 0.00 0.00 31.29 31.81 2j58 h VAL 353 CO 0.02 0.28 0.59 0.40 0.02 0.00 0.00 177.57 178.89 2j58 h ILE 354 N -1.00 1.09 0.00 4.57 1.08 -1.18 -0.63 117.51 121.44 2j58 h ILE 354 Ca -0.03 -0.38 0.00 0.00 -0.39 0.00 0.00 64.86 64.07 2j58 h ILE 354 Cb 0.56 -0.11 0.00 0.00 -3.07 0.00 0.00 36.82 34.21 2j58 h ILE 354 CO -0.02 0.20 0.00 0.77 -0.69 0.00 0.00 178.15 178.41 2j58 h SER 355 N 1.10 0.00 0.34 1.72 4.64 -1.29 0.14 113.55 120.20 2j58 h SER 355 Ca 0.39 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.71 2j58 h SER 355 Cb 0.12 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.21 2j58 h SER 355 CO -0.16 0.00 -0.28 0.00 -0.87 0.00 0.00 176.83 175.52 2j58 n GLN 356 N -2.80 0.60 -0.06 4.77 1.13 -0.25 -4.10 117.38 116.67 2j58 n GLN 356 Ca -0.02 -0.33 -0.06 0.00 -1.94 0.00 0.00 57.00 54.65 2j58 n GLN 356 Cb 0.10 -1.49 -0.10 0.00 0.11 0.00 0.00 30.24 28.85 2j58 n GLN 356 CO 0.00 0.00 0.00 1.28 -1.44 0.00 0.00 177.06 176.90 2j58 n LEU 357 N -0.91 0.00 -0.19 1.08 4.77 0.44 -4.72 117.00 117.47 2j58 n LEU 357 Ca 0.11 0.00 -0.05 0.00 -0.03 0.00 0.00 56.01 56.04 2j58 n LEU 357 Cb 0.33 0.32 0.12 0.00 -2.33 0.00 0.00 43.42 41.86 2j58 n LEU 357 CO 0.28 0.32 0.95 -0.37 -1.33 0.00 0.00 177.39 177.24 2j58 h VAL 358 N 0.00 1.25 -0.29 4.08 -1.51 -1.56 -1.45 116.25 116.77 2j58 h VAL 358 Ca -0.35 -0.92 0.03 0.00 -1.23 0.00 0.00 66.70 64.23 2j58 h VAL 358 Cb 1.80 0.62 -0.01 0.00 -2.13 0.00 0.00 31.29 31.56 2j58 h VAL 358 CO 0.02 0.35 0.19 -0.65 -1.23 0.00 0.00 177.57 176.25 2j58 h PRO 359 N 0.94 0.24 -0.13 5.19 0.11 -1.84 0.37 132.00 136.87 2j58 h PRO 359 Ca 0.20 -0.01 -0.03 0.00 0.11 0.00 0.00 66.00 66.26 2j58 h PRO 359 Cb 0.35 -0.05 -0.00 0.00 0.11 0.00 0.00 31.00 31.40 2j58 h PRO 359 CO 0.00 0.16 -0.03 1.15 -0.21 0.00 0.00 178.00 179.07 2j58 h THR 360 N 0.25 1.29 -0.44 -1.15 2.02 -1.58 0.14 112.91 113.43 2j58 h THR 360 Ca 0.12 -0.98 0.06 0.00 0.77 0.00 0.00 66.41 66.38 2j58 h THR 360 Cb 0.17 1.68 -0.06 0.00 -1.74 0.00 0.00 68.15 68.21 2j58 h THR 360 CO -0.02 0.28 0.12 0.40 0.37 0.00 0.00 175.52 176.67 2j58 h ILE 361 N -0.06 0.81 -0.56 3.11 1.08 -0.74 0.26 117.51 121.41 2j58 h ILE 361 Ca 0.03 -0.09 -0.07 0.00 -0.39 0.00 0.00 64.86 64.34 2j58 h ILE 361 Cb 0.46 0.51 -0.02 0.00 -3.07 0.00 0.00 36.82 34.70 2j58 h ILE 361 CO 0.01 0.05 0.06 -1.28 -0.69 0.00 0.00 178.15 176.31 2j58 h SER 362 N 0.27 0.87 -0.29 1.72 0.87 -0.20 -0.79 113.55 116.01 2j58 h SER 362 Ca 0.21 -0.20 -0.09 0.00 -1.23 0.00 0.00 61.79 60.49 2j58 h SER 362 Cb 0.24 -0.23 -0.01 0.00 -0.44 0.00 0.00 62.40 61.96 2j58 h SER 362 CO -0.25 0.90 -0.16 1.23 -0.53 0.00 0.00 176.83 178.02 2j58 h GLY 363 N 1.00 0.67 1.04 5.77 0.00 -0.49 -1.79 103.07 109.27 2j58 h GLY 363 Ca 0.17 -0.62 -0.04 0.00 0.00 0.00 0.00 47.33 46.84 2j58 h GLY 363 CO 0.01 0.56 0.29 -2.08 0.00 0.00 0.00 176.54 175.32 2j58 h VAL 364 N 0.37 1.25 -0.24 4.60 2.07 -0.84 -2.93 116.25 120.53 2j58 h VAL 364 Ca 0.06 -0.80 0.03 0.00 0.82 0.00 0.00 66.70 66.81 2j58 h VAL 364 Cb 0.69 0.39 -0.03 0.00 -1.52 0.00 0.00 31.29 30.82 2j58 h VAL 364 CO 0.05 0.32 0.05 -0.74 0.02 0.00 0.00 177.57 177.27 2j58 h HIS 365 N 1.07 0.08 0.00 1.57 6.17 -1.05 -1.11 115.15 121.87 2j58 h HIS 365 Ca 0.25 0.01 0.00 0.00 0.71 0.00 0.00 60.37 61.34 2j58 h HIS 365 Cb 0.22 0.00 0.00 0.00 2.52 0.00 0.00 27.41 30.15 2j58 h HIS 365 CO 0.02 0.02 0.00 -0.25 0.71 0.00 0.00 177.93 178.43 2j58 n ASP 366 N -5.09 0.80 0.00 3.26 9.92 -0.68 -2.07 116.55 122.69 2j58 n ASP 366 Ca -0.01 -0.63 0.00 0.00 -0.53 0.00 0.00 54.79 53.61 2j58 n ASP 366 Cb 0.11 -0.16 0.00 0.00 -0.64 0.00 0.00 41.12 40.43 2j58 n ASP 366 CO 0.00 0.00 0.00 0.41 0.13 0.00 0.00 177.20 177.74 2j58 n THR 368 N 0.72 0.00 -0.04 -3.53 -1.04 -0.42 -1.67 114.28 108.29 2j58 n THR 368 Ca 0.00 0.00 -0.00 0.00 -2.04 0.00 0.00 64.05 62.01 2j58 n THR 368 Cb 0.14 0.00 0.28 0.00 -1.82 0.00 0.00 70.33 68.93 2j58 n THR 368 CO 0.00 0.00 0.00 -0.33 -0.64 0.00 0.00 175.07 174.10 2j58 h GLU 369 N 0.00 0.62 0.08 -2.82 5.08 -1.69 -0.60 114.58 115.26 2j58 h GLU 369 Ca 0.00 -0.12 -0.00 0.00 -1.00 0.00 0.00 59.36 58.24 2j58 h GLU 369 Cb 0.00 -0.10 0.00 0.00 0.50 0.00 0.00 28.75 29.15 2j58 h GLU 369 CO 0.00 0.59 -0.04 1.15 -1.00 0.00 0.00 179.01 179.71 2j58 h THR 370 N 0.61 1.16 -0.80 1.13 2.02 -1.60 -1.34 112.91 114.08 2j58 h THR 370 Ca 0.14 -0.94 0.08 0.00 0.77 0.00 0.00 66.41 66.46 2j58 h THR 370 Cb 0.26 1.75 -0.05 0.00 -1.74 0.00 0.00 68.15 68.37 2j58 h THR 370 CO -0.00 0.23 0.52 0.58 0.37 0.00 0.00 175.52 177.22 2j58 h VAL 371 N -0.54 0.99 -0.57 3.16 2.07 -1.82 -1.66 116.25 117.88 2j58 h VAL 371 Ca -0.01 -0.28 -0.08 0.00 0.82 0.00 0.00 66.70 67.16 2j58 h VAL 371 Cb 0.46 0.12 -0.02 0.00 -1.52 0.00 0.00 31.29 30.33 2j58 h VAL 371 CO 0.02 0.15 0.06 -0.09 0.02 0.00 0.00 177.57 177.72 2j58 h ARG 372 N 0.80 0.98 -0.33 1.57 2.43 -0.99 -0.63 114.38 118.21 2j58 h ARG 372 Ca 0.36 -0.28 0.03 0.00 -0.81 0.00 0.00 59.98 59.27 2j58 h ARG 372 Cb 0.34 -0.10 -0.03 0.00 -0.42 0.00 0.00 29.97 29.76 2j58 h ARG 372 CO -0.13 0.95 0.16 1.88 -1.51 0.00 0.00 179.97 181.31 2j58 h TYR 373 N 0.87 0.29 0.19 2.20 0.05 -0.34 1.42 116.97 121.64 2j58 h TYR 373 Ca 0.17 0.01 -0.01 0.00 0.05 0.00 0.00 58.73 58.95 2j58 h TYR 373 Cb 0.47 -0.08 0.00 0.00 1.01 0.00 0.00 36.73 38.13 2j58 h TYR 373 CO 0.03 0.15 -0.09 0.82 -1.05 0.00 0.00 178.16 178.02 2j58 h ILE 374 N 0.33 0.86 -0.34 -2.88 2.04 -1.20 -2.71 117.51 113.61 2j58 h ILE 374 Ca 0.14 -0.20 0.07 0.00 1.00 0.00 0.00 64.86 65.88 2j58 h ILE 374 Cb 0.06 0.98 -0.08 0.00 -0.74 0.00 0.00 36.82 37.04 2j58 h ILE 374 CO -0.11 0.05 -0.20 0.11 0.00 0.00 0.00 178.15 178.00 2j58 h LYS 375 N -0.35 -0.15 0.00 2.37 1.79 -0.96 -3.52 116.57 115.76 2j58 h LYS 375 Ca -0.03 0.01 0.00 0.00 -2.18 0.00 0.00 60.65 58.45 2j58 h LYS 375 Cb 0.27 0.03 0.00 0.00 -1.58 0.00 0.00 32.23 30.95 2j58 h LYS 375 CO 0.04 -0.10 0.00 0.54 -1.08 0.00 0.00 179.45 178.85