#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 1.51 -3.11 12.58 5.41 -1.26 -4.93 119.36 129.55 2j58 n ILE 23 Ca 0.00 -0.05 -0.40 0.00 1.00 0.00 0.00 62.75 63.30 2j58 n ILE 23 Cb 0.00 -2.10 -0.05 0.00 -0.71 0.00 0.00 39.64 36.77 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 -2.43 5.04 0.87 1.39 1.01 -1.26 -5.05 121.20 120.77 2j58 s ILE 24 Ca -0.29 1.25 -0.11 0.00 0.00 0.00 0.00 60.65 61.50 2j58 s ILE 24 Cb 0.07 -3.97 0.12 0.00 0.01 0.00 0.00 42.46 38.69 2j58 s ILE 24 CO 0.48 0.16 1.09 -2.84 0.00 0.00 0.00 174.94 173.83 2j58 s PRO 25 N 1.53 1.45 2.65 2.79 0.02 -1.26 -4.89 135.00 137.29 2j58 s PRO 25 Ca 0.31 0.83 0.00 0.00 0.02 0.00 0.00 61.00 62.16 2j58 s PRO 25 Cb -0.16 -1.83 0.00 0.00 0.02 0.00 0.00 34.50 32.53 2j58 s PRO 25 CO 0.12 -2.11 0.00 0.41 -0.33 0.00 0.00 177.00 175.09 2j58 n GLY 26 N -1.26 -0.27 3.48 0.52 0.00 -1.26 -4.96 105.19 101.44 2j58 n GLY 26 Ca 0.07 -1.05 -0.24 0.00 0.00 0.00 0.00 46.02 44.80 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 1.68 0.34 1.61 -0.21 -1.26 -5.15 119.66 116.67 2j58 s GLN 27 Ca 0.00 -1.85 -0.02 0.00 0.02 0.00 0.00 55.36 53.51 2j58 s GLN 27 Cb 0.00 -1.46 -0.00 0.00 1.00 0.00 0.00 33.01 32.55 2j58 s GLN 27 CO 0.00 0.11 0.46 0.20 -2.12 0.00 0.00 175.29 173.94 2j58 s GLY 28 N -3.52 1.55 -0.30 3.09 0.00 -1.26 -5.15 107.32 101.73 2j58 s GLY 28 Ca 0.31 -1.56 0.01 0.00 0.00 0.00 0.00 44.72 43.48 2j58 s GLY 28 CO 0.14 -1.04 0.59 -2.27 0.00 0.00 0.00 173.10 170.53 2j58 s LEU 29 N -3.25 -1.44 0.27 0.66 0.20 -1.26 -5.16 118.68 108.71 2j58 s LEU 29 Ca 0.31 0.65 0.11 0.00 0.69 0.00 0.00 54.13 55.89 2j58 s LEU 29 Cb -0.00 2.10 -0.05 0.00 -0.43 0.00 0.00 46.19 47.80 2j58 s LEU 29 CO 0.21 -0.27 -0.19 0.54 -0.29 0.00 0.00 176.35 176.35 2j58 s ASN 30 N 2.84 3.42 -0.27 3.68 6.03 -1.26 -5.04 114.94 124.35 2j58 s ASN 30 Ca 0.17 -1.03 0.12 0.00 -1.03 0.00 0.00 52.86 51.09 2j58 s ASN 30 Cb -0.14 -0.27 0.77 0.00 -3.03 0.00 0.00 41.25 38.58 2j58 s ASN 30 CO -0.22 -0.00 1.74 -1.54 -2.03 0.00 0.00 177.10 175.04 2j58 n SER 31 N -0.58 5.25 0.03 3.54 3.41 -1.26 -4.71 113.62 119.30 2j58 n SER 31 Ca -0.05 -3.02 -0.11 0.00 -0.26 0.00 0.00 58.87 55.43 2j58 n SER 31 Cb 0.60 -0.71 -0.04 0.00 -0.26 0.00 0.00 64.21 63.80 2j58 n SER 31 CO 0.00 0.00 0.00 0.25 -0.16 0.00 0.00 175.04 175.13 2j58 h LEU 32 N 3.34 -0.80 -3.14 1.04 5.85 -2.02 -1.87 115.31 117.71 2j58 h LEU 32 Ca 0.11 0.12 0.00 0.00 0.84 0.00 0.00 57.88 58.95 2j58 h LEU 32 Cb 2.10 0.34 0.00 0.00 0.37 0.00 0.00 40.66 43.46 2j58 h LEU 32 CO 0.59 -0.32 0.00 0.54 -0.34 0.00 0.00 178.44 178.90 2j58 n ARG 33 N -5.38 3.66 -3.54 1.25 1.74 -1.26 -4.96 116.66 108.16 2j58 n ARG 33 Ca -0.04 -2.84 -0.31 0.00 -0.77 0.00 0.00 57.85 53.89 2j58 n ARG 33 Cb 0.29 -1.86 -0.05 0.00 -1.02 0.00 0.00 32.46 29.83 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 -1.87 3.67 -0.36 5.56 1.02 -0.71 -5.03 119.74 122.02 2j58 s LYS 34 Ca 0.49 0.02 -0.28 0.00 0.02 0.00 0.00 55.97 56.22 2j58 s LYS 34 Cb 0.32 -2.75 -0.02 0.00 -0.52 0.00 0.00 37.83 34.86 2j58 s LYS 34 CO 0.23 0.37 1.85 1.21 -0.92 0.00 0.00 175.35 178.09 2j58 s ASN 35 N -2.59 5.75 -0.30 2.83 2.47 -1.26 -4.97 114.94 116.87 2j58 s ASN 35 Ca 0.43 1.21 -0.15 0.00 0.42 0.00 0.00 52.86 54.77 2j58 s ASN 35 Cb -0.11 -2.52 -0.02 0.00 -1.45 0.00 0.00 41.25 37.14 2j58 s ASN 35 CO 0.25 -1.84 0.39 -0.69 -3.72 0.00 0.00 177.10 171.49 2j58 s VAL 36 N 7.39 5.15 0.02 -5.21 1.01 -1.26 -5.05 120.40 122.45 2j58 s VAL 36 Ca 0.80 0.38 -0.30 0.00 0.00 0.00 0.00 61.98 62.86 2j58 s VAL 36 Cb -0.22 -3.78 -0.05 0.00 0.00 0.00 0.00 36.38 32.34 2j58 s VAL 36 CO 0.32 0.03 1.26 -0.69 0.00 0.00 0.00 175.10 176.02 2j58 s VAL 37 N 2.11 3.94 -0.20 2.92 1.01 -1.26 -5.00 120.40 123.92 2j58 s VAL 37 Ca 0.15 1.35 -0.25 0.00 0.00 0.00 0.00 61.98 63.23 2j58 s VAL 37 Cb -0.16 -3.87 -0.01 0.00 0.00 0.00 0.00 36.38 32.34 2j58 s VAL 37 CO 0.11 0.06 0.82 -1.61 0.00 0.00 0.00 175.10 174.48 2j58 s GLU 38 N 1.64 4.25 0.17 2.72 0.41 -1.26 -5.00 118.70 121.63 2j58 s GLU 38 Ca 0.60 0.97 0.05 0.00 -0.41 0.00 0.00 54.97 56.18 2j58 s GLU 38 Cb -0.29 -3.60 -0.04 0.00 -1.78 0.00 0.00 34.13 28.42 2j58 s GLU 38 CO 0.27 -0.39 0.14 -0.51 -0.49 0.00 0.00 175.26 174.28 2j58 s LEU 39 N 2.39 3.82 0.36 1.80 1.43 -1.26 -4.99 118.68 122.23 2j58 s LEU 39 Ca 0.37 -0.13 0.14 0.00 -1.03 0.00 0.00 54.13 53.47 2j58 s LEU 39 Cb -0.16 -2.42 0.98 0.00 0.03 0.00 0.00 46.19 44.62 2j58 s LEU 39 CO 0.10 0.06 1.76 -0.65 0.23 0.00 0.00 176.35 177.85 2j58 h PRO 40 N 2.35 0.49 -0.57 1.29 0.11 -2.06 -1.13 132.00 132.49 2j58 h PRO 40 Ca -0.48 -0.03 -0.19 0.00 0.11 0.00 0.00 66.00 65.42 2j58 h PRO 40 Cb 1.20 -0.11 -0.11 0.00 0.11 0.00 0.00 31.00 32.09 2j58 h PRO 40 CO 0.63 0.32 0.16 -0.40 -0.21 0.00 0.00 178.00 178.51 2j58 n ASP 41 N -4.74 4.00 -0.34 -2.05 5.75 -1.26 -4.60 116.55 113.31 2j58 n ASP 41 Ca 0.26 -3.34 0.33 0.00 -0.01 0.00 0.00 54.79 52.03 2j58 n ASP 41 Cb 0.79 -0.68 0.69 0.00 -1.03 0.00 0.00 41.12 40.89 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 1.95 0.13 -0.52 -1.12 0.02 -1.58 -1.38 113.55 111.04 2j58 h SER 42 Ca 0.23 0.03 -0.24 0.00 -0.84 0.00 0.00 61.79 60.96 2j58 h SER 42 Cb 2.03 0.01 -0.15 0.00 0.14 0.00 0.00 62.40 64.44 2j58 h SER 42 CO 0.58 0.01 0.12 0.47 -1.14 0.00 0.00 176.83 176.86 2j58 n ASP 43 N -4.32 3.05 -4.63 3.07 8.00 -1.26 -5.02 116.55 115.45 2j58 n ASP 43 Ca 0.27 -3.63 -0.44 0.00 0.71 0.00 0.00 54.79 51.69 2j58 n ASP 43 Cb 1.19 -0.68 -0.01 0.00 -0.02 0.00 0.00 41.12 41.60 2j58 n ASP 43 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 2j58 n TYR 44 N -1.01 1.62 -3.39 1.24 0.18 -0.52 -4.90 117.16 110.38 2j58 n TYR 44 Ca 0.39 0.65 -0.45 0.00 1.88 0.00 0.00 57.90 60.37 2j58 n TYR 44 Cb 1.19 -2.31 -0.05 0.00 -0.38 0.00 0.00 39.34 37.80 2j58 n TYR 44 CO 0.00 0.00 0.00 0.34 -2.08 0.00 0.00 176.86 175.12 2j58 s ASP 45 N -0.44 6.27 0.28 9.48 -1.08 -1.26 -4.96 116.67 124.97 2j58 s ASP 45 Ca 0.58 -2.28 0.01 0.00 -0.52 0.00 0.00 52.55 50.35 2j58 s ASP 45 Cb -0.66 -2.15 0.63 0.00 -1.46 0.00 0.00 42.92 39.28 2j58 s ASP 45 CO 0.60 -0.67 1.72 0.25 0.52 0.00 0.00 175.17 177.59 2j58 h LEU 46 N 8.20 0.41 -1.92 -1.34 5.85 -1.98 -1.38 115.31 123.14 2j58 h LEU 46 Ca -0.09 0.13 0.04 0.00 0.84 0.00 0.00 57.88 58.79 2j58 h LEU 46 Cb 1.06 0.08 -0.01 0.00 0.37 0.00 0.00 40.66 42.16 2j58 h LEU 46 CO 0.87 0.10 0.14 0.44 -0.34 0.00 0.00 178.44 179.64 2j58 h ASP 47 N 0.49 0.09 0.01 1.25 3.32 -1.96 -0.81 116.42 118.81 2j58 h ASP 47 Ca 0.51 -0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.56 2j58 h ASP 47 Cb 0.87 -0.02 0.00 0.00 0.22 0.00 0.00 39.33 40.40 2j58 h ASP 47 CO -0.45 0.06 -0.03 0.29 -1.72 0.00 0.00 179.24 177.39 2j58 n LYS 48 N -4.50 1.65 -0.20 3.56 4.76 -0.52 -4.07 118.16 118.84 2j58 n LYS 48 Ca 0.01 -1.01 0.06 0.00 -2.87 0.00 0.00 58.31 54.50 2j58 n LYS 48 Cb 0.21 -1.48 0.15 0.00 -1.84 0.00 0.00 35.03 32.06 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 0.21 2.93 -4.21 -0.35 4.77 -0.31 -4.91 117.00 115.12 2j58 n LEU 49 Ca 0.18 -2.33 -0.17 0.00 -0.03 0.00 0.00 56.01 53.66 2j58 n LEU 49 Cb 0.38 -0.28 -0.11 0.00 -2.33 0.00 0.00 43.42 41.08 2j58 n LEU 49 CO 0.17 0.67 -0.44 0.68 -1.33 0.00 0.00 177.39 177.15 2j58 s VAL 50 N -1.59 1.18 -0.09 4.08 -7.23 -1.23 -0.67 120.40 114.85 2j58 s VAL 50 Ca 0.24 -1.66 -0.00 0.00 -1.81 0.00 0.00 61.98 58.74 2j58 s VAL 50 Cb 0.16 -1.44 -0.03 0.00 0.56 0.00 0.00 36.38 35.64 2j58 s VAL 50 CO 0.10 -0.46 -0.06 0.20 -0.31 0.00 0.00 175.10 174.57 2j58 s ASN 51 N -2.41 4.65 -0.20 4.85 0.01 -0.70 -5.02 114.94 116.12 2j58 s ASN 51 Ca 0.07 -0.07 -0.06 0.00 -0.71 0.00 0.00 52.86 52.09 2j58 s ASN 51 Cb -0.04 -1.36 -0.03 0.00 0.41 0.00 0.00 41.25 40.22 2j58 s ASN 51 CO 0.02 0.30 0.04 -0.69 -1.51 0.00 0.00 177.10 175.26 2j58 s VAL 52 N -0.43 4.35 -0.14 1.60 1.01 -1.26 0.34 120.40 125.86 2j58 s VAL 52 Ca 0.06 -0.18 -0.01 0.00 0.00 0.00 0.00 61.98 61.86 2j58 s VAL 52 Cb -0.12 -2.98 -0.02 0.00 0.00 0.00 0.00 36.38 33.26 2j58 s VAL 52 CO 0.02 0.42 -0.11 -0.31 0.00 0.00 0.00 175.10 175.12 2j58 s TYR 53 N 0.89 2.87 0.00 5.22 2.02 0.16 -4.95 117.35 123.56 2j58 s TYR 53 Ca 0.03 -0.62 0.00 0.00 -0.37 0.00 0.00 57.07 56.11 2j58 s TYR 53 Cb -0.14 -1.89 0.00 0.00 -0.40 0.00 0.00 41.96 39.53 2j58 s TYR 53 CO 0.02 -0.22 0.00 -0.35 -1.57 0.00 0.00 175.55 173.44 2j58 n PRO 54 N 3.66 0.19 0.00 -1.71 -0.04 -1.26 -0.56 135.00 135.27 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 0.52 0.00 0.00 0.00 -0.04 0.00 0.00 33.50 33.98 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 -0.31 0.52 -2.24 -1.26 -4.76 114.28 106.23 2j58 n THR 56 Ca 0.00 0.00 -0.00 0.00 -2.27 0.00 0.00 64.05 61.78 2j58 n THR 56 Cb 0.00 0.00 0.12 0.00 -2.10 0.00 0.00 70.33 68.35 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 0.99 -0.95 -0.78 0.11 -2.00 -1.14 132.00 128.23 2j58 h PRO 57 Ca 0.00 -0.06 0.04 0.00 0.11 0.00 0.00 66.00 66.09 2j58 h PRO 57 Cb 0.00 -0.22 -0.06 0.00 0.11 0.00 0.00 31.00 30.83 2j58 h PRO 57 CO 0.00 0.65 0.62 0.78 -0.21 0.00 0.00 178.00 179.85 2j58 h GLY 58 N 1.02 1.39 0.79 -0.55 0.00 -1.99 -1.26 103.07 102.46 2j58 h GLY 58 Ca 0.36 -0.47 -0.02 0.00 0.00 0.00 0.00 47.33 47.20 2j58 h GLY 58 CO -0.14 0.38 -0.00 -2.00 0.00 0.00 0.00 176.54 174.78 2j58 h LEU 59 N 1.17 0.27 -0.55 3.11 5.85 -1.69 -1.68 115.31 121.79 2j58 h LEU 59 Ca 0.39 -0.31 0.11 0.00 0.84 0.00 0.00 57.88 58.90 2j58 h LEU 59 Cb 0.05 -0.07 -0.11 0.00 0.37 0.00 0.00 40.66 40.90 2j58 h LEU 59 CO -0.13 0.51 -0.23 0.40 -0.34 0.00 0.00 178.44 178.65 2j58 h ILE 60 N 0.01 0.30 -0.83 4.05 1.08 -0.94 -1.24 117.51 119.93 2j58 h ILE 60 Ca 0.04 0.00 0.02 0.00 -0.39 0.00 0.00 64.86 64.53 2j58 h ILE 60 Cb 0.37 0.30 -0.04 0.00 -3.07 0.00 0.00 36.82 34.38 2j58 h ILE 60 CO 0.01 0.00 0.55 0.44 -0.69 0.00 0.00 178.15 178.46 2j58 h ASP 61 N -0.10 0.93 -0.62 1.72 3.32 -1.07 -1.29 116.42 119.32 2j58 h ASP 61 Ca 0.25 -0.02 -0.09 0.00 0.02 0.00 0.00 57.03 57.20 2j58 h ASP 61 Cb 0.50 -0.23 -0.02 0.00 0.22 0.00 0.00 39.33 39.80 2j58 h ASP 61 CO -0.62 0.66 0.05 -0.61 -1.72 0.00 0.00 179.24 177.00 2j58 h GLN 62 N 1.09 1.06 0.00 3.56 4.15 -0.53 -3.20 115.11 121.25 2j58 h GLN 62 Ca 0.32 -0.32 0.00 0.00 0.77 0.00 0.00 58.65 59.42 2j58 h GLN 62 Cb -0.07 -0.11 0.00 0.00 0.21 0.00 0.00 27.48 27.51 2j58 h GLN 62 CO -0.08 1.02 -0.43 1.28 -1.93 0.00 0.00 178.83 178.69 2j58 n LEU 63 N -4.22 0.59 -4.62 -2.39 4.77 -0.54 -4.91 117.00 105.68 2j58 n LEU 63 Ca 0.03 0.26 -0.50 0.00 -0.03 0.00 0.00 56.01 55.77 2j58 n LEU 63 Cb 0.32 -0.26 -0.05 0.00 -2.33 0.00 0.00 43.42 41.10 2j58 n LEU 63 CO 0.44 -0.03 1.04 -1.14 -1.33 0.00 0.00 177.39 176.36 2j58 n ARG 64 N -1.93 1.49 -2.14 3.23 0.63 -0.52 -4.91 116.66 112.50 2j58 n ARG 64 Ca 0.05 0.54 -0.36 0.00 -0.92 0.00 0.00 57.85 57.15 2j58 n ARG 64 Cb 0.40 -2.23 0.01 0.00 0.45 0.00 0.00 32.46 31.10 2j58 n ARG 64 CO 0.00 0.00 0.00 -1.25 -2.51 0.00 0.00 177.63 173.87 2j58 s PRO 65 N 0.94 3.31 0.24 -0.14 0.04 -1.26 -4.96 135.00 133.17 2j58 s PRO 65 Ca 0.84 1.77 -0.30 0.00 0.04 0.00 0.00 61.00 63.35 2j58 s PRO 65 Cb -0.87 -2.09 -0.09 0.00 0.04 0.00 0.00 34.50 31.49 2j58 s PRO 65 CO 0.45 -0.92 1.19 -2.00 0.04 0.00 0.00 177.00 175.76 2j58 s GLU 66 N -3.13 4.52 0.31 4.56 2.56 -1.26 -4.95 118.70 121.30 2j58 s GLU 66 Ca 0.72 1.92 -0.29 0.00 0.00 0.00 0.00 54.97 57.32 2j58 s GLU 66 Cb -0.28 -3.19 -0.13 0.00 2.00 0.00 0.00 34.13 32.53 2j58 s GLU 66 CO 0.32 -0.01 1.26 -2.30 -0.56 0.00 0.00 175.26 173.98 2j58 n PRO 67 N 1.77 1.96 -3.27 4.30 -0.02 -1.26 -4.96 135.00 133.52 2j58 n PRO 67 Ca 0.02 0.69 -0.40 0.00 -2.02 0.00 0.00 63.50 61.78 2j58 n PRO 67 Cb 0.44 -2.25 -0.08 0.00 -0.02 0.00 0.00 33.50 31.59 2j58 n PRO 67 CO 0.00 0.00 0.00 0.08 1.98 0.00 0.00 175.50 177.56 2j58 s VAL 68 N -0.88 5.07 0.37 -1.45 1.01 -1.26 -5.07 120.40 118.19 2j58 s VAL 68 Ca 0.59 0.59 0.07 0.00 0.00 0.00 0.00 61.98 63.23 2j58 s VAL 68 Cb -0.61 -3.86 -0.02 0.00 0.00 0.00 0.00 36.38 31.89 2j58 s VAL 68 CO 0.59 -0.03 0.40 0.27 0.00 0.00 0.00 175.10 176.33 2j58 s ILE 69 N 2.30 3.35 0.27 2.22 -4.36 -1.26 -4.93 121.20 118.79 2j58 s ILE 69 Ca 0.19 -1.22 -0.29 0.00 -0.26 0.00 0.00 60.65 59.06 2j58 s ILE 69 Cb -0.16 -3.16 -0.09 0.00 1.25 0.00 0.00 42.46 40.30 2j58 s ILE 69 CO 0.11 -0.10 1.23 0.00 0.24 0.00 0.00 174.94 176.42 2j58 s ALA 70 N -2.33 3.47 -0.03 2.27 0.00 -1.18 -4.22 121.76 119.74 2j58 s ALA 70 Ca 0.46 1.08 -0.01 0.00 0.00 0.00 0.00 51.96 53.49 2j58 s ALA 70 Cb -0.07 -3.43 0.02 0.00 0.00 0.00 0.00 23.12 19.65 2j58 s ALA 70 CO 0.29 -0.44 0.05 1.03 0.00 0.00 0.00 175.76 176.69 2j58 s ARG 71 N -1.15 0.01 0.85 0.00 0.52 -0.47 -4.90 118.95 113.81 2j58 s ARG 71 Ca 0.50 0.18 -0.11 0.00 -0.52 0.00 0.00 55.73 55.77 2j58 s ARG 71 Cb -0.36 -0.14 0.10 0.00 0.52 0.00 0.00 34.95 35.07 2j58 s ARG 71 CO 0.44 -0.11 1.09 -1.12 0.02 0.00 0.00 175.30 175.62 2j58 s SER 72 N 0.72 3.90 -0.54 0.23 0.01 -1.26 -0.59 113.70 116.17 2j58 s SER 72 Ca -0.06 1.53 0.05 0.00 1.31 0.00 0.00 55.95 58.78 2j58 s SER 72 Cb -0.08 -2.23 0.18 0.00 0.21 0.00 0.00 66.02 64.10 2j58 s SER 72 CO -0.02 -2.37 0.44 -3.20 0.41 0.00 0.00 173.24 168.49 2j58 n ASN 73 N -3.72 1.18 0.22 2.44 2.85 -1.26 -4.43 115.26 112.53 2j58 n ASN 73 Ca 0.07 -2.79 0.09 0.00 -0.11 0.00 0.00 54.58 51.85 2j58 n ASN 73 Cb 0.55 -0.65 0.45 0.00 1.24 0.00 0.00 39.78 41.37 2j58 n ASN 73 CO 0.00 0.00 0.00 1.55 -2.11 0.00 0.00 177.26 176.70 2j58 h PRO 74 N 5.34 0.00 0.46 1.20 0.13 -1.97 -0.70 132.00 136.46 2j58 h PRO 74 Ca 0.21 0.00 -0.02 0.00 -0.87 0.00 0.00 66.00 65.32 2j58 h PRO 74 Cb 0.83 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.96 2j58 h PRO 74 CO 0.54 0.25 -0.24 1.96 -0.23 0.00 0.00 178.00 180.28 2j58 h GLN 75 N 0.00 -0.62 -0.17 0.86 7.50 -2.00 -0.97 115.11 119.71 2j58 h GLN 75 Ca -0.00 0.04 0.03 0.00 0.50 0.00 0.00 58.65 59.22 2j58 h GLN 75 Cb 0.75 0.14 -0.03 0.00 0.05 0.00 0.00 27.48 28.39 2j58 h GLN 75 CO 0.03 -0.41 -0.01 1.25 -1.50 0.00 0.00 178.83 178.19 2j58 h LEU 76 N -0.64 -0.08 -1.45 1.46 5.85 -1.88 -2.23 115.31 116.34 2j58 h LEU 76 Ca -0.06 0.04 0.21 0.00 0.84 0.00 0.00 57.88 58.91 2j58 h LEU 76 Cb 0.51 0.08 -0.07 0.00 0.37 0.00 0.00 40.66 41.54 2j58 h LEU 76 CO 0.09 -0.02 0.61 0.44 -0.34 0.00 0.00 178.44 179.21 2j58 h ASP 77 N 0.05 0.45 -0.09 1.25 3.32 -0.97 -1.33 116.42 119.09 2j58 h ASP 77 Ca 0.08 0.05 -0.23 0.00 0.02 0.00 0.00 57.03 56.95 2j58 h ASP 77 Cb 0.11 -0.03 0.01 0.00 0.22 0.00 0.00 39.33 39.64 2j58 h ASP 77 CO -0.15 0.17 -0.85 0.78 -1.72 0.00 0.00 179.24 177.48 2j58 h ASN 78 N 0.45 0.91 -0.66 6.45 2.35 -0.71 -2.76 115.58 121.60 2j58 h ASN 78 Ca 0.49 -0.67 0.17 0.00 -0.55 0.00 0.00 56.30 55.74 2j58 h ASN 78 Cb 1.17 -0.27 -0.03 0.00 0.05 0.00 0.00 38.32 39.23 2j58 h ASN 78 CO -0.21 1.44 0.46 -0.07 -1.65 0.00 0.00 177.43 177.41 2j58 h LEU 79 N 0.45 0.13 0.00 1.61 4.07 -0.69 -2.25 115.31 118.62 2j58 h LEU 79 Ca -0.08 0.01 -0.13 0.00 0.08 0.00 0.00 57.88 57.76 2j58 h LEU 79 Cb 1.49 -0.02 -0.02 0.00 1.08 0.00 0.00 40.66 43.20 2j58 h LEU 79 CO 0.17 0.06 -0.94 -0.07 -1.08 0.00 0.00 178.44 176.59 2j58 h LEU 80 N 0.14 0.00 -0.99 1.67 3.38 -1.19 -2.91 115.31 115.40 2j58 h LEU 80 Ca 0.32 0.00 -0.09 0.00 0.09 0.00 0.00 57.88 58.21 2j58 h LEU 80 Cb 1.07 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.81 2j58 h LEU 80 CO -0.04 0.52 -0.19 0.11 0.09 0.00 0.00 178.44 178.93 2j58 h LYS 81 N 0.00 0.51 -0.36 1.13 1.57 -1.12 -2.99 116.57 115.32 2j58 h LYS 81 Ca -0.08 -0.17 -0.21 0.00 -1.87 0.00 0.00 60.65 58.32 2j58 h LYS 81 Cb 1.46 -0.04 -0.13 0.00 0.08 0.00 0.00 32.23 33.60 2j58 h LYS 81 CO 0.05 0.68 -0.22 -1.13 -0.57 0.00 0.00 179.45 178.26 2j58 n SER 82 N -4.16 2.82 -4.76 0.86 3.41 -1.18 -5.01 113.62 105.59 2j58 n SER 82 Ca 0.00 -3.82 -0.39 0.00 -0.26 0.00 0.00 58.87 54.41 2j58 n SER 82 Cb 0.37 -0.60 0.01 0.00 -0.26 0.00 0.00 64.21 63.73 2j58 n SER 82 CO 0.00 0.00 0.00 -0.47 -0.16 0.00 0.00 175.04 174.41 2j58 s TYR 83 N -3.32 2.67 -0.21 7.33 5.04 -1.10 -5.04 117.35 122.71 2j58 s TYR 83 Ca 0.45 1.42 -0.21 0.00 -2.44 0.00 0.00 57.07 56.30 2j58 s TYR 83 Cb 0.41 -3.65 0.06 0.00 0.35 0.00 0.00 41.96 39.12 2j58 s TYR 83 CO -0.01 -2.21 0.59 -1.21 -1.34 0.00 0.00 175.55 171.36 2j58 s GLU 84 N -2.54 0.70 -0.05 4.97 2.02 -1.26 -5.08 118.70 117.45 2j58 s GLU 84 Ca 0.63 0.79 -0.14 0.00 0.02 0.00 0.00 54.97 56.27 2j58 s GLU 84 Cb -0.37 0.34 -0.05 0.00 0.10 0.00 0.00 34.13 34.15 2j58 s GLU 84 CO 0.46 -0.09 0.36 -0.47 0.02 0.00 0.00 175.26 175.53 2j58 s TYR 85 N 0.25 3.66 -0.10 1.61 5.04 -1.26 -5.02 117.35 121.52 2j58 s TYR 85 Ca -0.00 0.86 0.02 0.00 -2.44 0.00 0.00 57.07 55.51 2j58 s TYR 85 Cb -0.04 -2.26 -0.01 0.00 0.35 0.00 0.00 41.96 40.00 2j58 s TYR 85 CO 0.01 0.57 -0.18 1.03 -1.34 0.00 0.00 175.55 175.64 2j58 s ARG 86 N -0.73 3.08 0.47 4.97 0.52 -1.26 -4.40 118.95 121.60 2j58 s ARG 86 Ca 0.22 -0.78 -0.24 0.00 -0.52 0.00 0.00 55.73 54.41 2j58 s ARG 86 Cb -0.15 -2.44 -0.07 0.00 0.52 0.00 0.00 34.95 32.80 2j58 s ARG 86 CO 0.10 0.27 1.36 0.42 0.02 0.00 0.00 175.30 177.47 2j58 s ILE 87 N 0.17 2.29 0.24 1.52 1.01 0.14 -4.71 121.20 121.86 2j58 s ILE 87 Ca -0.10 0.24 0.04 0.00 0.00 0.00 0.00 60.65 60.82 2j58 s ILE 87 Cb -0.16 -3.13 -0.05 0.00 0.01 0.00 0.00 42.46 39.13 2j58 s ILE 87 CO 0.06 0.02 -0.00 -0.83 0.00 0.00 0.00 174.94 174.19 2j58 s GLY 88 N -0.76 1.61 0.11 6.18 0.00 -1.26 -0.38 107.32 112.82 2j58 s GLY 88 Ca 0.63 -1.80 -0.35 0.00 0.00 0.00 0.00 44.72 43.21 2j58 s GLY 88 CO 0.50 -1.69 1.53 -0.62 0.00 0.00 0.00 173.10 172.83 2j58 n VAL 89 N -0.45 0.05 0.00 1.40 0.31 -1.26 -1.83 118.33 116.55 2j58 n VAL 89 Ca -0.05 -0.01 0.00 0.00 -0.01 0.00 0.00 64.34 64.27 2j58 n VAL 89 Cb 0.64 -1.33 0.00 0.00 -0.91 0.00 0.00 33.84 32.24 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 3.22 3.15 3.66 2.92 0.00 -0.39 -3.99 105.19 113.75 2j58 n GLY 90 Ca 0.18 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.82 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 1.29 -4.47 1.61 8.00 -0.76 -4.51 116.55 117.70 2j58 n ASP 91 Ca 0.00 0.83 -0.35 0.00 0.71 0.00 0.00 54.79 55.99 2j58 n ASP 91 Cb 0.00 -1.45 -0.12 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 -1.45 4.02 0.00 2.53 1.01 -0.49 -1.06 120.40 124.95 2j58 s VAL 92 Ca 0.77 -0.30 0.00 0.00 0.00 0.00 0.00 61.98 62.45 2j58 s VAL 92 Cb -0.41 -2.81 0.00 0.00 0.00 0.00 0.00 36.38 33.16 2j58 s VAL 92 CO 0.46 0.44 0.00 0.18 0.00 0.00 0.00 175.10 176.18 2j58 n LEU 93 N 4.06 0.00 0.00 3.92 4.32 0.36 0.39 117.00 130.04 2j58 n LEU 93 Ca -0.17 0.00 0.00 0.00 -0.02 0.00 0.00 56.01 55.82 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 0.32 0.00 0.00 0.52 -1.22 0.00 0.00 177.39 177.01 2j58 n VAL 95 N 0.00 0.00 -3.96 4.08 0.31 -1.26 -1.18 118.33 116.32 2j58 n VAL 95 Ca 0.00 0.00 -0.35 0.00 -0.01 0.00 0.00 64.34 63.98 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 4.62 -0.29 2.52 2.01 0.17 -4.51 115.64 120.16 2j58 s THR 96 Ca 0.00 -0.09 0.03 0.00 0.31 0.00 0.00 61.69 61.94 2j58 s THR 96 Cb 0.00 -3.10 0.07 0.00 0.01 0.00 0.00 72.50 69.48 2j58 s THR 96 CO 0.00 0.42 -0.06 -0.69 -0.69 0.00 0.00 174.62 173.60 2j58 s VAL 97 N 0.77 2.29 0.37 3.82 1.01 -1.26 -0.33 120.40 127.08 2j58 s VAL 97 Ca 0.03 -1.80 -0.28 0.00 0.00 0.00 0.00 61.98 59.94 2j58 s VAL 97 Cb -0.13 -2.43 -0.11 0.00 0.00 0.00 0.00 36.38 33.70 2j58 s VAL 97 CO 0.02 -0.18 1.46 0.26 0.00 0.00 0.00 175.10 176.66 2j58 s TRP 98 N 1.07 2.64 0.00 5.22 0.51 -0.32 -1.52 118.94 126.53 2j58 s TRP 98 Ca -0.04 1.20 0.00 0.00 -2.12 0.00 0.00 56.10 55.14 2j58 s TRP 98 Cb -0.20 -3.98 0.00 0.00 -0.81 0.00 0.00 33.47 28.48 2j58 s TRP 98 CO -0.05 -2.85 0.00 -0.25 -0.51 0.00 0.00 176.95 173.28 2j58 n ASP 99 N 0.48 -4.75 -3.32 2.95 8.00 -1.26 -4.65 116.55 114.00 2j58 n ASP 99 Ca 0.01 0.00 -0.25 0.00 0.71 0.00 0.00 54.79 55.25 2j58 n ASP 99 Cb 0.40 -2.29 -0.08 0.00 -0.02 0.00 0.00 41.12 39.13 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 0.93 0.28 1.24 8.25 -0.57 -4.92 115.22 118.03 2j58 n HIS 100 Ca 0.00 -3.75 0.14 0.00 -0.26 0.00 0.00 57.72 53.86 2j58 n HIS 100 Cb 0.30 -0.36 0.81 0.00 1.12 0.00 0.00 29.99 31.86 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 4.31 0.00 0.00 -0.41 0.11 -1.92 0.10 132.00 134.20 2j58 h PRO 101 Ca 0.13 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.24 2j58 h PRO 101 Cb 0.81 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.92 2j58 h PRO 101 CO 0.57 0.08 0.00 1.05 -0.21 0.00 0.00 178.00 179.49 2j58 h GLU 102 N 0.00 0.00 0.01 1.05 9.09 -1.91 0.19 114.58 123.00 2j58 h GLU 102 Ca -0.00 0.00 -0.40 0.00 0.05 0.00 0.00 59.36 59.01 2j58 h GLU 102 Cb 0.23 0.00 -0.07 0.00 -1.65 0.00 0.00 28.75 27.27 2j58 h GLU 102 CO 0.01 0.00 -2.44 1.28 0.05 0.00 0.00 179.01 177.91 2j58 n LEU 103 N -3.05 2.75 -0.11 3.06 4.77 0.24 -4.03 117.00 120.64 2j58 n LEU 103 Ca 0.00 -0.02 -0.12 0.00 -0.03 0.00 0.00 56.01 55.84 2j58 n LEU 103 Cb 0.28 -0.91 -0.03 0.00 -2.33 0.00 0.00 43.42 40.43 2j58 n LEU 103 CO 0.26 0.86 0.63 0.74 -1.33 0.00 0.00 177.39 178.55 2j58 h THR 104 N -0.19 1.29 -2.20 -5.08 2.02 -1.12 -3.38 112.91 104.24 2j58 h THR 104 Ca -0.59 -1.35 -0.58 0.00 0.77 0.00 0.00 66.41 64.66 2j58 h THR 104 Cb 1.85 1.44 -0.40 0.00 -1.74 0.00 0.00 68.15 69.30 2j58 h THR 104 CO -0.14 0.44 -0.89 0.35 0.37 0.00 0.00 175.52 175.65 2j58 n THR 105 N -4.29 0.35 0.22 3.16 -2.24 0.65 -4.93 114.28 107.19 2j58 n THR 105 Ca -0.03 -4.36 0.05 0.00 -2.27 0.00 0.00 64.05 57.44 2j58 n THR 105 Cb 0.43 -1.98 0.48 0.00 -2.10 0.00 0.00 70.33 67.16 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 4.41 0.01 -0.61 -0.78 0.13 -1.70 -2.45 132.00 131.00 2j58 h PRO 106 Ca 0.14 -0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.27 2j58 h PRO 106 Cb 0.81 -0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.94 2j58 h PRO 106 CO 0.58 0.21 0.00 0.00 -0.23 0.00 0.00 178.00 178.56 2j58 n ALA 107 N -2.50 3.47 0.00 -0.56 0.00 -1.26 -5.07 120.51 114.59 2j58 n ALA 107 Ca -0.02 -1.77 0.00 0.00 0.00 0.00 0.00 53.44 51.65 2j58 n ALA 107 Cb 0.26 -1.06 0.00 0.00 0.00 0.00 0.00 19.45 18.65 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 0.87 -3.52 0.28 0.00 0.00 -0.92 -4.76 105.19 97.14 2j58 n GLY 108 Ca 0.27 -1.92 0.10 0.00 0.00 0.00 0.00 46.02 44.47 2j58 n GLY 108 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 2j58 n GLN 109 N -0.29 0.84 -0.00 1.61 3.00 -1.26 -4.55 117.38 116.72 2j58 n GLN 109 Ca 0.00 -0.57 -0.22 0.00 -0.01 0.00 0.00 57.00 56.21 2j58 n GLN 109 Cb 0.00 -1.46 -0.14 0.00 0.00 0.00 0.00 30.24 28.65 2j58 n GLN 109 CO 0.00 0.00 0.00 -0.92 0.00 0.00 0.00 177.06 176.14 2j58 h TYR 110 N 1.37 0.43 -4.07 1.08 3.20 -2.00 -3.47 116.97 113.52 2j58 h TYR 110 Ca 0.00 -0.32 -0.50 0.00 3.14 0.00 0.00 58.73 61.06 2j58 h TYR 110 Cb 0.63 -0.02 0.06 0.00 1.54 0.00 0.00 36.73 38.94 2j58 h TYR 110 CO 0.00 1.74 0.43 1.03 -1.64 0.00 0.00 178.16 179.72 2j58 s ARG 111 N -2.53 3.51 0.64 1.82 0.52 -1.26 -4.98 118.95 116.67 2j58 s ARG 111 Ca -0.23 1.60 -0.15 0.00 -0.52 0.00 0.00 55.73 56.43 2j58 s ARG 111 Cb 0.06 -2.10 -0.01 0.00 0.52 0.00 0.00 34.95 33.42 2j58 s ARG 111 CO 0.75 -0.72 1.10 -1.54 0.02 0.00 0.00 175.30 174.92 2j58 s SER 112 N -1.73 5.24 0.41 0.23 1.04 -1.26 -4.85 113.70 112.78 2j58 s SER 112 Ca 0.70 1.99 0.11 0.00 0.48 0.00 0.00 55.95 59.24 2j58 s SER 112 Cb -0.23 -2.55 0.94 0.00 0.10 0.00 0.00 66.02 64.28 2j58 s SER 112 CO 0.27 -1.54 1.97 0.00 0.98 0.00 0.00 173.24 174.92 2j58 h ALA 113 N 0.17 1.93 0.00 5.32 0.00 -1.95 -1.31 119.26 123.43 2j58 h ALA 113 Ca -0.47 -0.01 -0.06 0.00 0.00 0.00 0.00 54.91 54.37 2j58 h ALA 113 Cb 1.24 -0.11 -0.01 0.00 0.00 0.00 0.00 17.79 18.91 2j58 h ALA 113 CO 0.55 -0.06 -0.30 0.66 0.00 0.00 0.00 179.25 180.09 2j58 h SER 114 N 0.51 0.00 1.24 0.00 4.64 -1.92 0.11 113.55 118.13 2j58 h SER 114 Ca 0.30 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.62 2j58 h SER 114 Cb 0.49 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.58 2j58 h SER 114 CO -0.09 0.30 -0.54 0.44 -0.87 0.00 0.00 176.83 176.07 2j58 h ASP 115 N 0.00 0.00 0.00 4.97 3.32 -1.63 -3.37 116.42 119.71 2j58 h ASP 115 Ca -0.00 -0.07 0.00 0.00 0.02 0.00 0.00 57.03 56.98 2j58 h ASP 115 Cb 0.82 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.37 2j58 h ASP 115 CO 0.04 0.03 0.00 0.35 -1.72 0.00 0.00 179.24 177.94 2j58 n THR 116 N -2.54 0.67 -2.15 0.35 -2.24 -0.71 -4.98 114.28 102.69 2j58 n THR 116 Ca 0.03 -0.77 -0.09 0.00 -2.27 0.00 0.00 64.05 60.95 2j58 n THR 116 Cb 0.50 0.70 0.05 0.00 -2.10 0.00 0.00 70.33 69.47 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 -0.33 0.29 3.57 3.38 0.00 0.35 -4.95 105.19 107.49 2j58 n GLY 117 Ca 0.00 -1.92 -0.40 0.00 0.00 0.00 0.00 46.02 43.70 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 -2.54 6.23 0.19 1.61 0.01 -0.33 -4.82 114.94 115.29 2j58 s ASN 118 Ca 0.25 0.02 -0.30 0.00 -0.71 0.00 0.00 52.86 52.12 2j58 s ASN 118 Cb -0.01 -2.21 -0.08 0.00 0.41 0.00 0.00 41.25 39.36 2j58 s ASN 118 CO 0.17 -0.29 1.14 0.26 -1.51 0.00 0.00 177.10 176.87 2j58 s TRP 119 N 2.09 3.52 -0.35 2.20 0.52 -1.26 -0.49 118.94 125.17 2j58 s TRP 119 Ca 0.14 1.53 -0.28 0.00 0.02 0.00 0.00 56.10 57.51 2j58 s TRP 119 Cb -0.16 -3.34 0.02 0.00 -1.15 0.00 0.00 33.47 28.84 2j58 s TRP 119 CO 0.11 -0.86 1.05 0.08 0.02 0.00 0.00 176.95 177.35 2j58 s VAL 120 N -0.21 4.48 0.78 4.03 1.01 -0.22 -4.39 120.40 125.88 2j58 s VAL 120 Ca 0.51 1.55 -0.09 0.00 0.00 0.00 0.00 61.98 63.94 2j58 s VAL 120 Cb -0.31 -4.42 0.09 0.00 0.00 0.00 0.00 36.38 31.74 2j58 s VAL 120 CO 0.36 -0.57 1.11 0.20 0.00 0.00 0.00 175.10 176.20 2j58 s ASN 121 N 1.82 4.44 0.60 3.32 0.02 0.25 -1.27 114.94 124.13 2j58 s ASN 121 Ca 0.44 0.49 0.31 0.00 -1.02 0.00 0.00 52.86 53.09 2j58 s ASN 121 Cb -0.11 -0.99 1.83 0.00 0.02 0.00 0.00 41.25 42.00 2j58 s ASN 121 CO 0.18 -1.88 2.19 0.77 0.02 0.00 0.00 177.10 178.39 2j58 h SER 122 N -0.90 0.00 -0.18 -1.22 4.64 -1.96 0.49 113.55 114.42 2j58 h SER 122 Ca -0.44 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.88 2j58 h SER 122 Cb 1.31 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.40 2j58 h SER 122 CO 0.58 0.00 0.00 -0.90 -0.87 0.00 0.00 176.83 175.64 2j58 n ASP 123 N -3.68 1.32 0.00 4.97 5.75 -1.26 -4.90 116.55 118.75 2j58 n ASP 123 Ca -0.01 -1.78 0.00 0.00 -0.01 0.00 0.00 54.79 52.99 2j58 n ASP 123 Cb 0.19 -0.12 0.00 0.00 -1.03 0.00 0.00 41.12 40.17 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 1.00 0.55 3.70 6.12 0.00 0.16 -4.96 105.19 111.77 2j58 n GLY 124 Ca 0.13 -0.02 -0.23 0.00 0.00 0.00 0.00 46.02 45.90 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 -2.00 3.80 0.31 2.61 -4.23 -1.26 -0.66 115.64 114.21 2j58 s THR 125 Ca 0.00 -1.70 0.08 0.00 -1.18 0.00 0.00 61.69 58.89 2j58 s THR 125 Cb 0.00 -3.03 -0.03 0.00 1.34 0.00 0.00 72.50 70.78 2j58 s THR 125 CO 0.00 -0.34 0.20 0.27 -0.54 0.00 0.00 174.62 174.21 2j58 s ILE 126 N -2.20 3.66 -0.14 2.99 -4.36 -0.36 -0.58 121.20 120.21 2j58 s ILE 126 Ca 0.31 -1.51 -0.14 0.00 -0.26 0.00 0.00 60.65 59.05 2j58 s ILE 126 Cb -0.07 -3.16 -0.05 0.00 1.25 0.00 0.00 42.46 40.43 2j58 s ILE 126 CO 0.21 -0.25 0.31 0.12 0.24 0.00 0.00 174.94 175.58 2j58 s PHE 127 N -2.29 3.50 -0.03 1.37 5.36 -1.26 -0.88 117.98 123.75 2j58 s PHE 127 Ca 0.37 0.66 0.05 0.00 -0.96 0.00 0.00 56.93 57.05 2j58 s PHE 127 Cb -0.06 -2.33 -0.01 0.00 -0.34 0.00 0.00 43.02 40.29 2j58 s PHE 127 CO 0.24 0.31 -0.18 -0.47 -1.46 0.00 0.00 175.22 173.67 2j58 s TYR 128 N 0.21 1.71 0.31 10.12 5.04 0.05 -4.95 117.35 129.83 2j58 s TYR 128 Ca 0.18 -0.43 -0.27 0.00 -2.44 0.00 0.00 57.07 54.11 2j58 s TYR 128 Cb -0.13 -1.13 -0.14 0.00 0.35 0.00 0.00 41.96 40.90 2j58 s TYR 128 CO 0.05 -0.12 0.83 -0.35 -1.34 0.00 0.00 175.55 174.63 2j58 n PRO 129 N 2.95 0.95 0.00 4.97 -0.04 -1.26 -0.25 135.00 142.32 2j58 n PRO 129 Ca -0.17 0.34 0.00 0.00 -0.04 0.00 0.00 63.50 63.63 2j58 n PRO 129 Cb 0.53 -1.64 0.00 0.00 -0.04 0.00 0.00 33.50 32.36 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 -0.07 0.00 0.11 0.54 4.01 -1.26 -4.31 117.16 116.19 2j58 n TYR 130 Ca 0.11 0.00 0.11 0.00 -0.16 0.00 0.00 57.90 57.97 2j58 n TYR 130 Cb 0.33 0.00 -0.03 0.00 -0.31 0.00 0.00 39.34 39.33 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 0.48 -2.94 -0.72 -5.35 -1.17 -5.05 119.36 104.62 2j58 n ILE 131 Ca 0.00 -0.52 0.00 0.00 -0.27 0.00 0.00 62.75 61.96 2j58 n ILE 131 Cb 0.00 -0.25 0.00 0.00 -1.74 0.00 0.00 39.64 37.65 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 1.21 0.53 3.69 3.28 0.00 0.66 -4.87 105.19 109.68 2j58 n GLY 132 Ca -0.01 -1.11 -0.42 0.00 0.00 0.00 0.00 46.02 44.48 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 4.39 -0.19 1.61 1.02 -1.26 -0.77 119.74 124.53 2j58 s LYS 133 Ca 0.00 1.62 0.00 0.00 0.02 0.00 0.00 55.97 57.61 2j58 s LYS 133 Cb 0.00 -3.52 0.02 0.00 -0.52 0.00 0.00 37.83 33.81 2j58 s LYS 133 CO 0.00 -0.37 -0.16 0.08 -0.92 0.00 0.00 175.35 173.98 2j58 s VAL 134 N 1.94 2.33 -0.04 3.17 1.01 -0.06 -4.96 120.40 123.78 2j58 s VAL 134 Ca 0.55 -0.90 -0.30 0.00 0.00 0.00 0.00 61.98 61.33 2j58 s VAL 134 Cb -0.24 -2.02 -0.06 0.00 0.00 0.00 0.00 36.38 34.06 2j58 s VAL 134 CO 0.23 0.48 1.72 -1.58 0.00 0.00 0.00 175.10 175.95 2j58 s GLN 135 N 1.31 4.15 0.00 2.72 2.00 -1.26 -1.22 119.66 127.36 2j58 s GLN 135 Ca 0.04 2.25 0.00 0.00 -2.00 0.00 0.00 55.36 55.66 2j58 s GLN 135 Cb -0.14 -4.03 0.00 0.00 0.80 0.00 0.00 33.01 29.64 2j58 s GLN 135 CO -0.11 -0.90 0.00 1.33 -0.50 0.00 0.00 175.29 175.11 2j58 n VAL 136 N 5.56 0.00 -1.89 1.34 0.24 0.17 -4.96 118.33 118.79 2j58 n VAL 136 Ca 0.18 0.00 -0.42 0.00 -2.04 0.00 0.00 64.34 62.06 2j58 n VAL 136 Cb 0.43 -0.61 -0.02 0.00 -1.47 0.00 0.00 33.84 32.16 2j58 n VAL 136 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 2j58 s ALA 137 N -1.73 3.71 0.00 2.33 0.00 -0.32 -1.34 121.76 124.42 2j58 s ALA 137 Ca 0.00 1.45 0.00 0.00 0.00 0.00 0.00 51.96 53.41 2j58 s ALA 137 Cb 0.00 -3.61 0.00 0.00 0.00 0.00 0.00 23.12 19.51 2j58 s ALA 137 CO 0.00 -0.85 0.00 0.41 0.00 0.00 0.00 175.76 175.32 2j58 n GLY 138 N 2.51 0.83 3.68 0.00 0.00 0.48 -4.93 105.19 107.76 2j58 n GLY 138 Ca 0.09 0.00 -0.25 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 -0.28 2.44 0.67 1.61 1.02 -0.45 -4.76 119.74 119.99 2j58 s LYS 139 Ca 0.00 -1.16 -0.10 0.00 0.02 0.00 0.00 55.97 54.73 2j58 s LYS 139 Cb 0.00 -2.34 0.01 0.00 -0.52 0.00 0.00 37.83 34.97 2j58 s LYS 139 CO 0.00 0.43 1.05 0.95 -0.92 0.00 0.00 175.35 176.87 2j58 s THR 140 N -1.88 3.66 0.39 2.17 -4.23 -1.26 -0.69 115.64 113.80 2j58 s THR 140 Ca 0.29 0.43 0.13 0.00 -1.18 0.00 0.00 61.69 61.35 2j58 s THR 140 Cb -0.09 -3.52 0.12 0.00 1.34 0.00 0.00 72.50 70.36 2j58 s THR 140 CO 0.19 -0.65 1.88 -0.37 -0.54 0.00 0.00 174.62 175.13 2j58 h VAL 141 N -0.52 1.22 -0.36 2.29 -1.51 -1.89 -1.98 116.25 113.49 2j58 h VAL 141 Ca -0.45 -1.05 -0.06 0.00 -1.23 0.00 0.00 66.70 63.91 2j58 h VAL 141 Cb 1.25 1.54 -0.01 0.00 -2.13 0.00 0.00 31.29 31.93 2j58 h VAL 141 CO 0.63 0.30 -0.02 0.28 -1.23 0.00 0.00 177.57 177.53 2j58 h SER 142 N 0.03 0.65 -0.46 4.19 0.02 -1.94 0.16 113.55 116.19 2j58 h SER 142 Ca 0.00 -0.32 0.01 0.00 -0.84 0.00 0.00 61.79 60.64 2j58 h SER 142 Cb 0.54 -0.17 -0.02 0.00 0.14 0.00 0.00 62.40 62.88 2j58 h SER 142 CO 0.04 0.81 0.30 1.56 -1.14 0.00 0.00 176.83 178.40 2j58 h GLN 143 N 0.47 0.60 -0.70 3.45 4.20 -1.86 -1.79 115.11 119.48 2j58 h GLN 143 Ca 0.10 -0.04 -0.05 0.00 0.06 0.00 0.00 58.65 58.73 2j58 h GLN 143 Cb 0.49 -0.14 -0.03 0.00 0.30 0.00 0.00 27.48 28.10 2j58 h GLN 143 CO 0.02 0.40 0.24 0.28 -0.67 0.00 0.00 178.83 179.10 2j58 h VAL 144 N 0.62 1.25 -0.11 -0.54 2.07 -1.16 -1.89 116.25 116.49 2j58 h VAL 144 Ca 0.17 -0.82 0.03 0.00 0.82 0.00 0.00 66.70 66.90 2j58 h VAL 144 Cb -0.06 0.45 -0.03 0.00 -1.52 0.00 0.00 31.29 30.13 2j58 h VAL 144 CO -0.04 0.33 -0.08 -0.09 0.02 0.00 0.00 177.57 177.70 2j58 h ARG 145 N 1.02 -0.09 -0.44 1.57 2.43 -0.28 -0.57 114.38 118.02 2j58 h ARG 145 Ca 0.23 0.01 0.04 0.00 -0.81 0.00 0.00 59.98 59.45 2j58 h ARG 145 Cb 0.25 0.02 -0.04 0.00 -0.42 0.00 0.00 29.97 29.78 2j58 h ARG 145 CO -0.01 -0.06 0.21 1.96 -1.51 0.00 0.00 179.97 180.56 2j58 h GLN 146 N -0.09 0.41 0.10 0.20 1.08 -1.11 -1.31 115.11 114.39 2j58 h GLN 146 Ca 0.07 -0.02 0.00 0.00 -1.45 0.00 0.00 58.65 57.25 2j58 h GLN 146 Cb 0.19 -0.09 -0.01 0.00 -0.05 0.00 0.00 27.48 27.52 2j58 h GLN 146 CO -0.16 0.27 -0.11 0.22 -0.95 0.00 0.00 178.83 178.10 2j58 h ASP 147 N 0.42 -0.29 -0.60 1.46 3.58 -1.00 -1.36 116.42 118.63 2j58 h ASP 147 Ca 0.20 0.03 -0.07 0.00 0.42 0.00 0.00 57.03 57.60 2j58 h ASP 147 Cb 0.12 0.10 -0.02 0.00 1.72 0.00 0.00 39.33 41.25 2j58 h ASP 147 CO -0.15 -0.17 0.09 0.40 -2.88 0.00 0.00 179.24 176.53 2j58 h ILE 148 N -0.24 1.26 -0.06 2.25 2.04 -1.01 -1.84 117.51 119.91 2j58 h ILE 148 Ca 0.01 -1.01 0.01 0.00 1.00 0.00 0.00 64.86 64.86 2j58 h ILE 148 Cb 0.23 0.74 -0.01 0.00 -0.74 0.00 0.00 36.82 37.05 2j58 h ILE 148 CO -0.03 0.37 0.00 0.74 0.00 0.00 0.00 178.15 179.23 2j58 h THR 149 N 0.91 0.96 -0.30 -0.27 2.02 -1.10 0.37 112.91 115.50 2j58 h THR 149 Ca 0.18 -0.01 -0.01 0.00 0.77 0.00 0.00 66.41 67.34 2j58 h THR 149 Cb 0.44 0.94 -0.01 0.00 -1.74 0.00 0.00 68.15 67.77 2j58 h THR 149 CO 0.01 0.00 0.15 0.28 0.37 0.00 0.00 175.52 176.34 2j58 h SER 150 N 0.02 0.40 0.10 4.18 0.02 -1.11 -2.65 113.55 114.51 2j58 h SER 150 Ca 0.03 -0.12 -0.10 0.00 -0.84 0.00 0.00 61.79 60.76 2j58 h SER 150 Cb 0.03 -0.10 -0.01 0.00 0.14 0.00 0.00 62.40 62.45 2j58 h SER 150 CO -0.04 0.41 -0.32 0.03 -1.14 0.00 0.00 176.83 175.76 2j58 h ARG 151 N 0.36 0.33 0.00 3.45 3.08 -1.17 -2.86 114.38 117.56 2j58 h ARG 151 Ca 0.10 -0.13 0.00 0.00 0.07 0.00 0.00 59.98 60.02 2j58 h ARG 151 Cb 0.11 -0.01 0.00 0.00 0.08 0.00 0.00 29.97 30.15 2j58 h ARG 151 CO -0.01 0.62 0.00 -0.11 -1.07 0.00 0.00 179.97 179.39 2j58 n LEU 152 N -4.09 0.75 0.30 3.04 7.94 0.11 -3.14 117.00 121.90 2j58 n LEU 152 Ca -0.01 0.62 0.18 0.00 -1.11 0.00 0.00 56.01 55.69 2j58 n LEU 152 Cb 0.43 -0.44 0.92 0.00 0.53 0.00 0.00 43.42 44.86 2j58 n LEU 152 CO 0.41 -0.36 1.07 0.74 -1.11 0.00 0.00 177.39 178.14 2j58 h THR 153 N 0.00 0.21 0.00 1.96 2.02 -1.23 0.53 112.91 116.40 2j58 h THR 153 Ca 0.00 -0.29 0.00 0.00 0.77 0.00 0.00 66.41 66.89 2j58 h THR 153 Cb 0.56 1.23 0.00 0.00 -1.74 0.00 0.00 68.15 68.20 2j58 h THR 153 CO 0.00 0.04 0.00 0.35 0.37 0.00 0.00 175.52 176.28 2j58 n THR 154 N -3.31 0.59 -0.04 3.16 -2.24 -1.19 -3.88 114.28 107.38 2j58 n THR 154 Ca -0.02 -0.06 -0.05 0.00 -2.27 0.00 0.00 64.05 61.66 2j58 n THR 154 Cb 0.18 -0.76 -0.04 0.00 -2.10 0.00 0.00 70.33 67.61 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 -2.06 0.00 -4.60 4.78 4.01 -0.30 -5.01 117.16 113.98 2j58 n TYR 155 Ca 0.05 0.00 -0.23 0.00 -0.16 0.00 0.00 57.90 57.56 2j58 n TYR 155 Cb 0.34 -0.32 -0.14 0.00 -0.31 0.00 0.00 39.34 38.91 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 -2.16 1.30 -0.01 -0.72 -5.25 0.02 -5.12 121.20 109.26 2j58 s ILE 156 Ca -0.08 -0.90 -0.30 0.00 -0.99 0.00 0.00 60.65 58.38 2j58 s ILE 156 Cb 0.02 -1.13 -0.03 0.00 2.95 0.00 0.00 42.46 44.27 2j58 s ILE 156 CO 0.22 0.21 1.09 -0.70 -1.79 0.00 0.00 174.94 173.96 2j58 s GLU 157 N -0.81 4.46 -0.96 0.37 2.12 -1.26 -4.12 118.70 118.50 2j58 s GLU 157 Ca 0.05 1.56 -0.11 0.00 0.36 0.00 0.00 54.97 56.83 2j58 s GLU 157 Cb -0.07 -3.46 -0.00 0.00 0.26 0.00 0.00 34.13 30.85 2j58 s GLU 157 CO 0.01 -0.23 0.72 0.43 -0.54 0.00 0.00 175.26 175.65 2j58 n SER 158 N 4.35 -5.79 -4.71 -1.70 7.64 -1.26 -4.87 113.62 107.28 2j58 n SER 158 Ca 0.08 -0.78 -0.42 0.00 1.01 0.00 0.00 58.87 58.76 2j58 n SER 158 Cb 0.48 -3.36 -0.03 0.00 -1.01 0.00 0.00 64.21 60.29 2j58 n SER 158 CO 0.00 0.00 0.00 -2.84 -3.01 0.00 0.00 175.04 169.19 2j58 s PRO 159 N -5.02 4.35 -0.48 1.43 0.02 -1.26 -4.99 135.00 129.06 2j58 s PRO 159 Ca 0.24 1.97 -0.15 0.00 0.02 0.00 0.00 61.00 63.09 2j58 s PRO 159 Cb -0.09 -3.30 0.09 0.00 0.02 0.00 0.00 34.50 31.22 2j58 s PRO 159 CO 0.85 -0.39 0.40 -0.65 -0.33 0.00 0.00 177.00 176.88 2j58 s GLN 160 N 1.16 2.93 -0.04 5.54 -1.52 -1.26 -4.96 119.66 121.51 2j58 s GLN 160 Ca 0.63 -1.44 0.06 0.00 -1.95 0.00 0.00 55.36 52.66 2j58 s GLN 160 Cb -0.34 -4.12 -0.01 0.00 -0.22 0.00 0.00 33.01 28.31 2j58 s GLN 160 CO 0.30 -1.08 -0.23 0.08 -0.25 0.00 0.00 175.29 174.10 2j58 s VAL 161 N 1.60 1.89 0.16 1.09 1.01 -1.26 -1.18 120.40 123.71 2j58 s VAL 161 Ca 0.04 -1.00 0.09 0.00 0.00 0.00 0.00 61.98 61.11 2j58 s VAL 161 Cb -0.25 -1.58 -0.04 0.00 0.00 0.00 0.00 36.38 34.50 2j58 s VAL 161 CO 0.05 0.53 -0.20 -0.62 0.00 0.00 0.00 175.10 174.87 2j58 s ASP 162 N -0.32 2.78 -0.04 3.32 -1.08 0.56 -4.97 116.67 116.93 2j58 s ASP 162 Ca 0.02 -0.83 0.01 0.00 -0.52 0.00 0.00 52.55 51.23 2j58 s ASP 162 Cb -0.11 -0.17 0.02 0.00 -1.46 0.00 0.00 42.92 41.19 2j58 s ASP 162 CO 0.01 0.01 -0.05 -0.69 0.52 0.00 0.00 175.17 174.98 2j58 s VAL 163 N -1.83 0.50 0.32 1.11 1.01 -1.26 -0.65 120.40 119.60 2j58 s VAL 163 Ca 0.15 -0.14 0.05 0.00 0.00 0.00 0.00 61.98 62.04 2j58 s VAL 163 Cb -0.07 -0.51 -0.03 0.00 0.00 0.00 0.00 36.38 35.77 2j58 s VAL 163 CO 0.07 0.20 0.30 -0.94 0.00 0.00 0.00 175.10 174.73 2j58 s SER 164 N 0.72 1.37 -0.26 3.32 1.04 -1.26 -4.76 113.70 113.87 2j58 s SER 164 Ca -0.09 -1.67 -0.12 0.00 0.48 0.00 0.00 55.95 54.55 2j58 s SER 164 Cb -0.12 0.56 -0.05 0.00 0.10 0.00 0.00 66.02 66.51 2j58 s SER 164 CO 0.00 -1.08 0.22 -0.63 0.98 0.00 0.00 173.24 172.72 2j58 s ILE 165 N -3.45 5.30 0.08 -1.02 -1.09 -1.26 -4.55 121.20 115.21 2j58 s ILE 165 Ca 0.39 0.25 0.00 0.00 -2.23 0.00 0.00 60.65 59.06 2j58 s ILE 165 Cb 0.02 -3.55 -0.25 0.00 -1.58 0.00 0.00 42.46 37.09 2j58 s ILE 165 CO 0.25 0.26 1.16 0.00 -1.23 0.00 0.00 174.94 175.38 2j58 h ALA 166 N 8.08 0.22 -2.93 9.38 0.00 -0.33 -3.45 119.26 130.24 2j58 h ALA 166 Ca -0.35 -0.93 -0.22 0.00 0.00 0.00 0.00 54.91 53.41 2j58 h ALA 166 Cb 1.18 -0.02 -0.32 0.00 0.00 0.00 0.00 17.79 18.63 2j58 h ALA 166 CO 0.60 1.10 -0.53 0.00 0.00 0.00 0.00 179.25 180.42 2j58 s ALA 167 N -2.67 -0.51 -0.82 0.00 0.00 -0.93 -4.54 121.76 112.28 2j58 s ALA 167 Ca -0.02 0.91 -0.19 0.00 0.00 0.00 0.00 51.96 52.65 2j58 s ALA 167 Cb 0.08 -0.89 0.12 0.00 0.00 0.00 0.00 23.12 22.43 2j58 s ALA 167 CO 0.86 -0.52 1.02 -0.06 0.00 0.00 0.00 175.76 177.06 2j58 s PHE 168 N 2.10 3.04 -0.14 0.00 0.08 -1.26 -1.40 117.98 120.40 2j58 s PHE 168 Ca -0.01 -1.18 0.04 0.00 0.12 0.00 0.00 56.93 55.90 2j58 s PHE 168 Cb -0.12 -4.23 -0.05 0.00 -0.57 0.00 0.00 43.02 38.05 2j58 s PHE 168 CO -0.08 -1.48 0.15 0.54 -0.10 0.00 0.00 175.22 174.25 2j58 n ARG 169 N 6.65 4.00 -0.01 0.44 1.74 -1.26 -4.72 116.66 123.50 2j58 n ARG 169 Ca 0.13 -0.01 -0.18 0.00 -0.77 0.00 0.00 57.85 57.02 2j58 n ARG 169 Cb 0.47 -0.82 -0.08 0.00 -1.02 0.00 0.00 32.46 31.02 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 0.95 -3.72 0.55 4.64 -1.83 -3.46 113.55 110.68 2j58 h SER 170 Ca 0.00 -0.66 -0.58 0.00 -0.47 0.00 0.00 61.79 60.08 2j58 h SER 170 Cb 0.13 -0.28 -0.32 0.00 -0.31 0.00 0.00 62.40 61.61 2j58 h SER 170 CO 0.00 1.46 -0.84 -1.10 -0.87 0.00 0.00 176.83 175.48 2j58 s GLN 171 N -3.64 2.01 0.17 4.77 -0.21 -1.26 -4.94 119.66 116.56 2j58 s GLN 171 Ca -0.10 -0.63 -0.18 0.00 0.02 0.00 0.00 55.36 54.46 2j58 s GLN 171 Cb 0.08 -1.68 0.04 0.00 1.00 0.00 0.00 33.01 32.45 2j58 s GLN 171 CO 0.91 0.20 0.51 -1.59 -2.12 0.00 0.00 175.29 173.20 2j58 s LYS 172 N 0.20 1.28 0.11 2.91 -2.85 -1.26 -0.85 119.74 119.27 2j58 s LYS 172 Ca -0.08 -0.73 0.10 0.00 -1.00 0.00 0.00 55.97 54.26 2j58 s LYS 172 Cb -0.14 0.52 -0.04 0.00 -2.06 0.00 0.00 37.83 36.12 2j58 s LYS 172 CO 0.04 -0.54 -0.26 0.08 0.10 0.00 0.00 175.35 174.76 2j58 s VAL 173 N -3.83 2.19 -0.31 1.79 1.01 0.33 -0.06 120.40 121.52 2j58 s VAL 173 Ca 0.05 -1.65 -0.10 0.00 0.00 0.00 0.00 61.98 60.29 2j58 s VAL 173 Cb -0.00 -1.92 -0.01 0.00 0.00 0.00 0.00 36.38 34.44 2j58 s VAL 173 CO -0.08 0.15 0.16 -0.31 0.00 0.00 0.00 175.10 175.03 2j58 s TYR 174 N -1.00 3.18 -0.30 5.22 2.02 -0.16 -0.41 117.35 125.90 2j58 s TYR 174 Ca 0.13 -0.46 -0.07 0.00 -0.37 0.00 0.00 57.07 56.30 2j58 s TYR 174 Cb -0.10 -2.36 0.01 0.00 -0.40 0.00 0.00 41.96 39.11 2j58 s TYR 174 CO 0.05 -0.41 0.09 0.08 -1.57 0.00 0.00 175.55 173.79 2j58 s VAL 175 N 1.64 4.01 0.02 0.71 1.01 -0.81 -0.36 120.40 126.61 2j58 s VAL 175 Ca 0.05 -0.72 0.00 0.00 0.00 0.00 0.00 61.98 61.31 2j58 s VAL 175 Cb -0.17 -3.09 -0.02 0.00 0.00 0.00 0.00 36.38 33.10 2j58 s VAL 175 CO 0.07 0.05 -0.03 -0.89 0.00 0.00 0.00 175.10 174.30 2j58 s THR 176 N 1.50 0.11 0.00 3.92 2.01 -0.12 -1.39 115.64 121.66 2j58 s THR 176 Ca 0.02 -0.78 0.00 0.00 0.31 0.00 0.00 61.69 61.24 2j58 s THR 176 Cb -0.17 -0.23 0.00 0.00 0.01 0.00 0.00 72.50 72.10 2j58 s THR 176 CO 0.03 -0.42 0.00 0.61 -0.69 0.00 0.00 174.62 174.15 2j58 n GLY 177 N 1.81 0.82 2.37 4.40 0.00 -1.26 -0.70 105.19 112.64 2j58 n GLY 177 Ca -0.22 -1.69 -0.32 0.00 0.00 0.00 0.00 46.02 43.79 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 3.44 -3.78 1.61 -0.58 0.58 -4.77 120.64 117.15 2j58 n GLU 178 Ca 0.00 -2.52 -0.20 0.00 -0.42 0.00 0.00 57.16 54.02 2j58 n GLU 178 Cb 0.00 -2.44 -0.02 0.00 -0.57 0.00 0.00 31.44 28.40 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 -0.37 4.38 0.21 2.62 -7.23 -1.26 -0.41 120.40 118.33 2j58 s VAL 179 Ca 0.61 -1.13 -0.08 0.00 -1.81 0.00 0.00 61.98 59.57 2j58 s VAL 179 Cb 0.26 -3.50 0.14 0.00 0.56 0.00 0.00 36.38 33.84 2j58 s VAL 179 CO -0.10 -0.24 1.76 0.00 -0.31 0.00 0.00 175.10 176.20 2j58 h ALA 180 N 1.14 1.00 -3.14 1.32 0.00 -0.78 -3.39 119.26 115.40 2j58 h ALA 180 Ca -0.48 -0.21 -0.58 0.00 0.00 0.00 0.00 54.91 53.64 2j58 h ALA 180 Cb 1.25 -0.30 -0.40 0.00 0.00 0.00 0.00 17.79 18.34 2j58 h ALA 180 CO 0.57 0.65 -0.76 -0.80 0.00 0.00 0.00 179.25 178.92 2j58 s ASN 181 N -6.36 4.01 0.64 0.00 -0.87 0.31 -5.02 114.94 107.64 2j58 s ASN 181 Ca -0.12 -1.70 -0.16 0.00 -1.57 0.00 0.00 52.86 49.31 2j58 s ASN 181 Cb 0.15 -0.87 -0.01 0.00 -0.02 0.00 0.00 41.25 40.50 2j58 s ASN 181 CO 0.84 -0.41 1.12 -0.44 -2.57 0.00 0.00 177.10 175.64 2j58 s SER 182 N 1.54 5.21 0.00 -1.22 0.01 -1.26 -4.60 113.70 113.38 2j58 s SER 182 Ca 0.10 2.05 0.00 0.00 1.31 0.00 0.00 55.95 59.41 2j58 s SER 182 Cb -0.18 -2.56 0.00 0.00 0.21 0.00 0.00 66.02 63.50 2j58 s SER 182 CO -0.24 -1.56 0.00 0.61 0.41 0.00 0.00 173.24 172.46 2j58 n GLY 183 N -0.36 2.15 3.76 3.44 0.00 -0.49 -5.03 105.19 108.66 2j58 n GLY 183 Ca 0.11 -1.40 -0.37 0.00 0.00 0.00 0.00 46.02 44.36 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 -1.94 3.45 -0.07 1.61 3.01 -1.26 -1.93 119.74 122.62 2j58 s LYS 184 Ca 0.00 1.84 0.02 0.00 -1.01 0.00 0.00 55.97 56.82 2j58 s LYS 184 Cb 0.00 -2.23 0.02 0.00 -1.01 0.00 0.00 37.83 34.60 2j58 s LYS 184 CO 0.00 -0.82 -0.11 -0.65 0.51 0.00 0.00 175.35 174.28 2j58 s GLN 185 N -2.94 1.58 0.40 1.68 -0.21 0.45 -4.91 119.66 115.71 2j58 s GLN 185 Ca 0.69 -0.36 -0.26 0.00 0.02 0.00 0.00 55.36 55.45 2j58 s GLN 185 Cb -0.30 -1.36 -0.09 0.00 1.00 0.00 0.00 33.01 32.26 2j58 s GLN 185 CO 0.35 -0.02 1.27 0.00 -2.12 0.00 0.00 175.29 174.77 2j58 s ALA 186 N 0.81 3.26 0.04 6.09 0.00 -1.26 -0.52 121.76 130.17 2j58 s ALA 186 Ca -0.12 1.16 -0.29 0.00 0.00 0.00 0.00 51.96 52.72 2j58 s ALA 186 Cb -0.15 -3.46 -0.04 0.00 0.00 0.00 0.00 23.12 19.47 2j58 s ALA 186 CO 0.02 -0.72 0.92 0.42 0.00 0.00 0.00 175.76 176.40 2j58 s ILE 187 N -1.28 4.74 0.00 0.00 -1.09 -0.03 -4.83 121.20 118.71 2j58 s ILE 187 Ca 0.56 1.95 0.00 0.00 -2.23 0.00 0.00 60.65 60.93 2j58 s ILE 187 Cb -0.36 -4.27 0.00 0.00 -1.58 0.00 0.00 42.46 36.25 2j58 s ILE 187 CO 0.47 0.25 0.00 0.35 -1.23 0.00 0.00 174.94 174.77 2j58 n THR 188 N 3.37 0.00 0.88 2.92 -2.24 -1.26 -4.72 114.28 113.22 2j58 n THR 188 Ca 0.03 0.00 0.11 0.00 -2.27 0.00 0.00 64.05 61.92 2j58 n THR 188 Cb 0.50 0.00 0.51 0.00 -2.10 0.00 0.00 70.33 69.24 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 -1.72 0.00 -4.58 3.42 6.94 -1.26 -4.53 115.26 113.53 2j58 n ASN 189 Ca 0.00 0.28 -0.36 0.00 -0.02 0.00 0.00 54.58 54.49 2j58 n ASN 189 Cb 0.00 -0.41 -0.11 0.00 -2.36 0.00 0.00 39.78 36.90 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 -2.83 4.79 0.29 1.53 1.01 -1.26 -4.77 121.20 119.97 2j58 s ILE 190 Ca 0.15 -0.02 -0.29 0.00 0.00 0.00 0.00 60.65 60.48 2j58 s ILE 190 Cb 0.15 -3.21 -0.13 0.00 0.01 0.00 0.00 42.46 39.28 2j58 s ILE 190 CO 0.38 0.39 1.34 -2.65 0.00 0.00 0.00 174.94 174.39 2j58 n PRO 191 N 4.18 2.08 -3.90 2.79 -0.02 -1.26 -4.98 135.00 133.90 2j58 n PRO 191 Ca -0.16 0.73 -0.35 0.00 -2.02 0.00 0.00 63.50 61.70 2j58 n PRO 191 Cb 0.52 -2.34 -0.14 0.00 -0.02 0.00 0.00 33.50 31.52 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 -0.47 3.98 0.39 2.45 2.96 -1.26 -5.00 118.68 121.72 2j58 s LEU 192 Ca 0.61 -1.31 0.07 0.00 -0.22 0.00 0.00 54.13 53.29 2j58 s LEU 192 Cb -0.60 -1.72 0.00 0.00 0.50 0.00 0.00 46.19 44.36 2j58 s LEU 192 CO 0.56 -0.28 0.52 0.42 -1.32 0.00 0.00 176.35 176.26 2j58 s THR 193 N 1.25 3.40 -0.30 3.68 -4.23 -1.26 -0.41 115.64 117.77 2j58 s THR 193 Ca -0.04 -1.02 0.00 0.00 -1.18 0.00 0.00 61.69 59.45 2j58 s THR 193 Cb -0.20 -3.16 0.00 0.00 1.34 0.00 0.00 72.50 70.49 2j58 s THR 193 CO -0.01 -0.06 0.00 0.52 -0.54 0.00 0.00 174.62 174.53 2j58 n VAL 194 N -1.75 0.00 0.00 2.29 0.31 -0.01 -0.71 118.33 118.46 2j58 n VAL 194 Ca 0.05 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.38 2j58 n VAL 194 Cb 0.59 -0.08 0.00 0.00 -0.91 0.00 0.00 33.84 33.44 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 0.40 0.00 -0.09 4.52 8.00 -1.26 -1.10 116.55 127.02 2j58 n ASP 196 Ca 0.00 0.00 -0.10 0.00 0.71 0.00 0.00 54.79 55.40 2j58 n ASP 196 Cb 0.00 0.00 -0.03 0.00 -0.02 0.00 0.00 41.12 41.07 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 0.38 -0.81 2.24 0.00 -1.28 0.60 119.26 120.39 2j58 h ALA 197 Ca 0.00 -0.15 0.00 0.00 0.00 0.00 0.00 54.91 54.76 2j58 h ALA 197 Cb 0.00 -0.11 -0.04 0.00 0.00 0.00 0.00 17.79 17.64 2j58 h ALA 197 CO 0.00 0.01 0.52 0.82 0.00 0.00 0.00 179.25 180.60 2j58 h ILE 198 N 0.30 1.21 -0.17 0.00 1.08 -1.37 -1.30 117.51 117.26 2j58 h ILE 198 Ca 0.09 -0.42 -0.15 0.00 -0.39 0.00 0.00 64.86 64.00 2j58 h ILE 198 Cb 0.25 0.05 -0.01 0.00 -3.07 0.00 0.00 36.82 34.04 2j58 h ILE 198 CO -0.00 0.21 -0.51 0.78 -0.69 0.00 0.00 178.15 177.94 2j58 h ASN 199 N 1.10 0.52 0.59 1.72 2.35 -1.76 -0.96 115.58 119.14 2j58 h ASN 199 Ca 0.29 -0.26 -0.06 0.00 -0.55 0.00 0.00 56.30 55.72 2j58 h ASN 199 Cb -0.10 -0.15 -0.01 0.00 0.05 0.00 0.00 38.32 38.12 2j58 h ASN 199 CO -0.06 0.94 -0.28 0.00 -1.65 0.00 0.00 177.43 176.38 2j58 h ALA 200 N 1.08 1.18 -0.03 -0.83 0.00 -0.51 -1.46 119.26 118.69 2j58 h ALA 200 Ca 0.01 -0.25 0.00 0.00 0.00 0.00 0.00 54.91 54.67 2j58 h ALA 200 Cb 1.02 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.76 2j58 h ALA 200 CO 0.09 0.35 0.00 0.00 0.00 0.00 0.00 179.25 179.69 2j58 n ALA 201 N -2.32 2.60 -0.96 0.00 0.00 -0.52 -4.89 120.51 114.42 2j58 n ALA 201 Ca -0.01 -0.20 0.00 0.00 0.00 0.00 0.00 53.44 53.23 2j58 n ALA 201 Cb 0.39 -1.27 0.00 0.00 0.00 0.00 0.00 19.45 18.57 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 0.87 0.43 5.86 0.00 0.00 -0.55 -0.53 105.19 111.27 2j58 n GLY 202 Ca 0.15 -0.82 0.00 0.00 0.00 0.00 0.00 46.02 45.34 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 -2.96 -1.94 3.87 -0.02 0.00 -0.38 -4.51 105.19 99.24 2j58 n GLY 203 Ca 0.00 -1.51 -0.32 0.00 0.00 0.00 0.00 46.02 44.19 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 4.17 0.76 0.99 1.43 -1.26 -0.62 118.68 124.15 2j58 s LEU 204 Ca 0.00 1.01 -0.11 0.00 -1.03 0.00 0.00 54.13 54.00 2j58 s LEU 204 Cb 0.00 -3.72 0.05 0.00 0.03 0.00 0.00 46.19 42.55 2j58 s LEU 204 CO 0.00 -0.08 1.08 0.00 0.23 0.00 0.00 176.35 177.58 2j58 s ALA 205 N -1.81 2.35 0.44 4.21 0.00 0.45 -4.47 121.76 122.93 2j58 s ALA 205 Ca 0.48 -0.02 0.10 0.00 0.00 0.00 0.00 51.96 52.52 2j58 s ALA 205 Cb -0.11 -3.16 0.98 0.00 0.00 0.00 0.00 23.12 20.82 2j58 s ALA 205 CO 0.20 -1.60 2.07 0.00 0.00 0.00 0.00 175.76 176.43 2j58 h ALA 206 N -1.00 1.82 -0.44 0.00 0.00 -1.97 -2.44 119.26 115.24 2j58 h ALA 206 Ca -0.46 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.43 2j58 h ALA 206 Cb 1.24 -0.12 0.00 0.00 0.00 0.00 0.00 17.79 18.92 2j58 h ALA 206 CO 0.57 0.14 0.00 -0.40 0.00 0.00 0.00 179.25 179.56 2j58 n ASP 207 N -4.49 4.04 -4.72 0.00 5.75 -1.26 -4.96 116.55 110.92 2j58 n ASP 207 Ca 0.03 -2.51 -0.42 0.00 -0.01 0.00 0.00 54.79 51.88 2j58 n ASP 207 Cb 0.12 -0.57 -0.03 0.00 -1.03 0.00 0.00 41.12 39.61 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 -2.03 3.54 -1.14 2.12 0.00 -0.92 -0.95 121.76 122.37 2j58 s ALA 208 Ca 0.38 1.06 -0.17 0.00 0.00 0.00 0.00 51.96 53.23 2j58 s ALA 208 Cb 0.27 -3.50 0.12 0.00 0.00 0.00 0.00 23.12 20.01 2j58 s ALA 208 CO 0.14 -0.56 1.43 0.34 0.00 0.00 0.00 175.76 177.12 2j58 s ASP 209 N 0.90 6.84 0.00 0.00 2.15 0.60 -4.70 116.67 122.46 2j58 s ASP 209 Ca 0.61 -2.44 0.16 0.00 0.43 0.00 0.00 52.55 51.31 2j58 s ASP 209 Cb -0.35 -2.46 0.77 0.00 -0.30 0.00 0.00 42.92 40.58 2j58 s ASP 209 CO 0.32 -1.02 1.45 -2.67 -0.17 0.00 0.00 175.17 173.09 2j58 n TRP 210 N 6.89 0.00 1.08 -5.34 4.27 -1.26 -2.30 117.44 120.78 2j58 n TRP 210 Ca 0.36 0.00 0.12 0.00 -3.89 0.00 0.00 57.50 54.09 2j58 n TRP 210 Cb 0.46 -0.32 0.29 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 -1.32 0.28 -2.66 -2.67 1.74 -1.26 0.07 116.66 110.83 2j58 n ARG 211 Ca 0.07 -0.16 -0.07 0.00 -0.77 0.00 0.00 57.85 56.91 2j58 n ARG 211 Cb 0.13 -1.50 0.04 0.00 -1.02 0.00 0.00 32.46 30.11 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 -1.22 2.14 -4.77 0.55 3.02 -0.97 -4.21 115.26 109.80 2j58 n ASN 212 Ca 0.08 -2.56 -0.36 0.00 -0.03 0.00 0.00 54.58 51.71 2j58 n ASN 212 Cb 0.34 -0.48 0.00 0.00 -0.61 0.00 0.00 39.78 39.04 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 -3.81 3.03 -0.14 2.41 1.01 0.13 -4.57 120.40 118.45 2j58 s VAL 213 Ca 0.31 0.68 0.02 0.00 0.00 0.00 0.00 61.98 62.99 2j58 s VAL 213 Cb 0.38 -3.30 0.01 0.00 0.00 0.00 0.00 36.38 33.47 2j58 s VAL 213 CO -0.02 -0.10 -0.19 -0.69 0.00 0.00 0.00 175.10 174.10 2j58 s VAL 214 N -1.66 1.87 -0.24 2.92 1.01 -0.11 -0.22 120.40 123.97 2j58 s VAL 214 Ca 0.71 -0.86 -0.07 0.00 0.00 0.00 0.00 61.98 61.76 2j58 s VAL 214 Cb -0.27 -1.68 -0.03 0.00 0.00 0.00 0.00 36.38 34.40 2j58 s VAL 214 CO 0.31 0.51 0.08 -0.22 0.00 0.00 0.00 175.10 175.78 2j58 s LEU 215 N 0.98 3.51 -0.28 3.92 2.96 -0.06 -0.27 118.68 129.44 2j58 s LEU 215 Ca -0.04 -0.16 -0.10 0.00 -0.22 0.00 0.00 54.13 53.60 2j58 s LEU 215 Cb -0.15 -1.94 -0.04 0.00 0.50 0.00 0.00 46.19 44.57 2j58 s LEU 215 CO -0.04 -0.01 0.16 -0.89 -1.32 0.00 0.00 176.35 174.25 2j58 s THR 216 N 1.47 4.99 -0.05 3.68 2.01 0.46 -0.03 115.64 128.17 2j58 s THR 216 Ca 0.06 -0.01 -0.01 0.00 0.31 0.00 0.00 61.69 62.04 2j58 s THR 216 Cb -0.15 -3.40 0.03 0.00 0.01 0.00 0.00 72.50 68.99 2j58 s THR 216 CO 0.04 0.23 0.01 -2.28 -0.69 0.00 0.00 174.62 171.93 2j58 s HIS 217 N 1.71 0.40 -1.42 4.92 5.04 -0.14 -1.48 115.29 124.32 2j58 s HIS 217 Ca 0.07 -0.01 -0.11 0.00 -1.54 0.00 0.00 55.06 53.47 2j58 s HIS 217 Cb -0.16 -0.57 0.01 0.00 0.04 0.00 0.00 32.58 31.90 2j58 s HIS 217 CO 0.09 -0.21 0.20 0.09 -2.34 0.00 0.00 174.74 172.56 2j58 n ASN 218 N 4.73 -0.55 -0.05 9.88 5.03 -1.26 -1.46 115.26 131.59 2j58 n ASN 218 Ca -0.15 -1.27 -0.01 0.00 0.87 0.00 0.00 54.58 54.03 2j58 n ASN 218 Cb 0.50 -1.56 -0.00 0.00 -1.02 0.00 0.00 39.78 37.70 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 -2.42 0.48 3.00 7.41 0.00 -1.26 -5.02 105.19 107.39 2j58 n GLY 219 Ca -0.26 -0.35 -0.23 0.00 0.00 0.00 0.00 46.02 45.18 2j58 n GLY 219 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2j58 s LYS 220 N -0.86 1.40 -0.04 1.61 1.02 -0.53 -5.13 119.74 117.20 2j58 s LYS 220 Ca 0.00 -0.35 -0.18 0.00 0.02 0.00 0.00 55.97 55.46 2j58 s LYS 220 Cb 0.00 -1.21 -0.05 0.00 -0.52 0.00 0.00 37.83 36.05 2j58 s LYS 220 CO 0.00 0.04 0.51 -0.51 -0.92 0.00 0.00 175.35 174.47 2j58 s ASP 221 N 0.56 6.83 -0.06 2.83 1.01 -1.26 -0.96 116.67 125.61 2j58 s ASP 221 Ca -0.11 0.99 0.04 0.00 0.71 0.00 0.00 52.55 54.18 2j58 s ASP 221 Cb -0.14 -2.31 0.00 0.00 1.01 0.00 0.00 42.92 41.49 2j58 s ASP 221 CO 0.02 0.12 -0.18 -0.89 0.21 0.00 0.00 175.17 174.46 2j58 s THR 222 N -0.12 1.55 0.11 -1.27 2.01 0.96 -4.97 115.64 113.90 2j58 s THR 222 Ca 0.27 -0.75 -0.26 0.00 0.31 0.00 0.00 61.69 61.27 2j58 s THR 222 Cb -0.17 -1.35 -0.07 0.00 0.01 0.00 0.00 72.50 70.93 2j58 s THR 222 CO 0.14 0.44 0.79 -0.54 -0.69 0.00 0.00 174.62 174.76 2j58 s LYS 223 N 0.27 4.55 -0.08 4.92 1.02 -1.26 -0.88 119.74 128.28 2j58 s LYS 223 Ca -0.10 1.15 0.02 0.00 0.02 0.00 0.00 55.97 57.05 2j58 s LYS 223 Cb -0.14 -3.31 0.01 0.00 -0.52 0.00 0.00 37.83 33.87 2j58 s LYS 223 CO 0.04 0.43 -0.14 0.42 -0.92 0.00 0.00 175.35 175.18 2j58 s ILE 224 N -0.61 1.29 -0.38 2.17 1.01 0.69 -4.95 121.20 120.41 2j58 s ILE 224 Ca 0.38 -0.56 -0.11 0.00 0.00 0.00 0.00 60.65 60.36 2j58 s ILE 224 Cb -0.22 -1.17 0.03 0.00 0.01 0.00 0.00 42.46 41.11 2j58 s ILE 224 CO 0.25 0.39 0.21 -0.55 0.00 0.00 0.00 174.94 175.24 2j58 s SER 225 N 0.71 5.72 0.51 3.58 0.15 -1.26 -0.69 113.70 122.42 2j58 s SER 225 Ca -0.13 -1.06 0.30 0.00 0.70 0.00 0.00 55.95 55.76 2j58 s SER 225 Cb -0.16 -2.02 1.04 0.00 -1.71 0.00 0.00 66.02 63.18 2j58 s SER 225 CO 0.03 -0.40 1.87 -0.07 1.20 0.00 0.00 173.24 175.86 2j58 h LEU 226 N 8.43 0.00 0.52 3.45 3.38 -0.66 -1.14 115.31 129.29 2j58 h LEU 226 Ca -0.25 0.00 -0.03 0.00 0.09 0.00 0.00 57.88 57.69 2j58 h LEU 226 Cb 1.10 0.00 0.01 0.00 0.09 0.00 0.00 40.66 41.86 2j58 h LEU 226 CO 0.68 0.01 -0.25 0.22 0.09 0.00 0.00 178.44 179.19 2j58 h TYR 227 N 0.00 -0.64 -0.60 1.13 3.20 -1.92 -3.18 116.97 114.96 2j58 h TYR 227 Ca -0.00 -0.02 -0.01 0.00 3.14 0.00 0.00 58.73 61.85 2j58 h TYR 227 Cb 0.67 0.21 -0.03 0.00 1.54 0.00 0.00 36.73 39.12 2j58 h TYR 227 CO 0.00 -0.39 0.36 0.00 -1.64 0.00 0.00 178.16 176.48 2j58 h ALA 228 N -0.21 0.77 0.00 1.82 0.00 -1.85 -0.35 119.26 119.43 2j58 h ALA 228 Ca -0.07 -0.08 0.00 0.00 0.00 0.00 0.00 54.91 54.76 2j58 h ALA 228 Cb 0.54 -0.24 0.00 0.00 0.00 0.00 0.00 17.79 18.08 2j58 h ALA 228 CO 0.12 0.25 0.00 -0.11 0.00 0.00 0.00 179.25 179.51 2j58 n LEU 229 N -4.61 0.09 0.00 0.00 0.00 -0.45 -1.01 117.00 111.01 2j58 n LEU 229 Ca 0.04 0.54 0.00 0.00 0.00 0.00 0.00 56.01 56.59 2j58 n LEU 229 Cb 0.06 -0.54 0.00 0.00 0.00 0.00 0.00 43.42 42.94 2j58 n LEU 229 CO 0.36 -0.53 0.00 1.67 0.00 0.00 0.00 177.39 178.89 2j58 n GLN 231 N -1.61 0.00 0.00 1.96 7.27 -0.17 -1.67 117.38 123.16 2j58 n GLN 231 Ca 0.00 0.00 0.05 0.00 0.07 0.00 0.00 57.00 57.12 2j58 n GLN 231 Cb 0.03 0.00 -0.04 0.00 2.41 0.00 0.00 30.24 32.64 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 0.00 3.34 -2.09 3.69 4.76 -1.02 -5.01 118.16 121.83 2j58 n LYS 232 Ca 0.00 -0.18 -0.09 0.00 -2.87 0.00 0.00 58.31 55.18 2j58 n LYS 232 Cb 0.00 -0.99 -0.01 0.00 -1.84 0.00 0.00 35.03 32.19 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 1.13 0.10 3.48 0.72 0.00 -0.67 -3.11 105.19 106.84 2j58 n GLY 233 Ca 0.02 -0.53 -0.43 0.00 0.00 0.00 0.00 46.02 45.08 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 -2.63 6.43 0.00 1.61 2.15 -0.18 -1.37 116.67 122.67 2j58 s ASP 234 Ca 0.00 -1.48 0.21 0.00 0.43 0.00 0.00 52.55 51.71 2j58 s ASP 234 Cb 0.00 -2.45 0.97 0.00 -0.30 0.00 0.00 42.92 41.14 2j58 s ASP 234 CO 0.00 -1.32 1.68 0.18 -0.17 0.00 0.00 175.17 175.54 2j58 n LEU 235 N 7.56 0.00 0.27 -1.34 4.77 0.24 -2.12 117.00 126.37 2j58 n LEU 235 Ca 0.15 0.42 0.18 0.00 -0.03 0.00 0.00 56.01 56.73 2j58 n LEU 235 Cb 0.48 -0.42 0.94 0.00 -2.33 0.00 0.00 43.42 42.09 2j58 n LEU 235 CO 0.59 -0.12 1.15 0.74 -1.33 0.00 0.00 177.39 178.42 2j58 h THR 236 N 0.00 0.30 0.00 -5.08 2.02 -1.78 -0.20 112.91 108.17 2j58 h THR 236 Ca 0.00 0.00 0.00 0.00 0.77 0.00 0.00 66.41 67.18 2j58 h THR 236 Cb 0.30 0.88 0.00 0.00 -1.74 0.00 0.00 68.15 67.59 2j58 h THR 236 CO 0.00 0.00 -0.17 0.00 0.37 0.00 0.00 175.52 175.72 2j58 n GLN 237 N -3.51 0.05 -3.38 6.66 1.13 -0.90 -4.82 117.38 112.62 2j58 n GLN 237 Ca -0.01 0.03 -0.34 0.00 -1.94 0.00 0.00 57.00 54.75 2j58 n GLN 237 Cb 0.24 -1.55 -0.06 0.00 0.11 0.00 0.00 30.24 28.98 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 -3.26 6.73 0.01 1.08 2.47 -0.09 -4.82 114.94 117.06 2j58 s ASN 238 Ca 0.12 1.01 -0.07 0.00 0.42 0.00 0.00 52.86 54.34 2j58 s ASN 238 Cb 0.17 -2.26 0.00 0.00 -1.45 0.00 0.00 41.25 37.71 2j58 s ASN 238 CO 0.59 0.01 0.14 -1.00 -3.72 0.00 0.00 177.10 173.12 2j58 s HIS 239 N -1.65 0.07 0.17 0.43 3.76 -1.26 -4.98 115.29 111.83 2j58 s HIS 239 Ca 0.43 -0.21 -0.30 0.00 -0.15 0.00 0.00 55.06 54.83 2j58 s HIS 239 Cb -0.13 -0.06 -0.07 0.00 1.11 0.00 0.00 32.58 33.43 2j58 s HIS 239 CO 0.20 -0.32 1.01 -1.17 -0.85 0.00 0.00 174.74 173.60 2j58 s LEU 240 N -1.61 4.53 0.11 0.89 2.96 -1.26 -0.83 118.68 123.47 2j58 s LEU 240 Ca -0.12 1.95 -0.08 0.00 -0.22 0.00 0.00 54.13 55.67 2j58 s LEU 240 Cb -0.06 -3.60 -0.06 0.00 0.50 0.00 0.00 46.19 42.98 2j58 s LEU 240 CO -0.00 -0.07 0.39 -0.76 -1.32 0.00 0.00 176.35 174.59 2j58 s LEU 241 N -0.47 4.31 0.29 -0.68 1.43 0.45 -4.90 118.68 119.10 2j58 s LEU 241 Ca 0.46 0.70 0.05 0.00 -1.03 0.00 0.00 54.13 54.31 2j58 s LEU 241 Cb -0.26 -3.13 -0.06 0.00 0.03 0.00 0.00 46.19 42.76 2j58 s LEU 241 CO 0.33 0.12 0.00 -0.31 0.23 0.00 0.00 176.35 176.71 2j58 s TYR 242 N -1.52 1.90 0.09 0.29 2.02 -1.26 -4.72 117.35 114.15 2j58 s TYR 242 Ca 0.37 -0.85 -0.36 0.00 -0.37 0.00 0.00 57.07 55.86 2j58 s TYR 242 Cb -0.13 -1.16 -0.15 0.00 -0.40 0.00 0.00 41.96 40.11 2j58 s TYR 242 CO 0.21 0.11 1.48 -2.39 -1.57 0.00 0.00 175.55 173.39 2j58 n HIS 243 N -0.61 1.89 -0.02 2.71 1.44 -1.26 -1.68 115.22 117.70 2j58 n HIS 243 Ca -0.04 0.45 0.00 0.00 -2.01 0.00 0.00 57.72 56.12 2j58 n HIS 243 Cb 0.65 -2.44 0.00 0.00 0.12 0.00 0.00 29.99 28.32 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 3.05 0.76 3.76 -1.39 0.00 0.91 -4.94 105.19 107.35 2j58 n GLY 244 Ca 0.18 0.00 -0.37 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 -2.56 5.52 -0.15 1.61 1.01 -0.67 -4.82 116.67 116.61 2j58 s ASP 245 Ca 0.00 2.42 0.01 0.00 0.71 0.00 0.00 52.55 55.69 2j58 s ASP 245 Cb 0.00 -2.61 0.00 0.00 1.01 0.00 0.00 42.92 41.33 2j58 s ASP 245 CO 0.00 -1.37 -0.18 -0.63 0.21 0.00 0.00 175.17 173.21 2j58 s ILE 246 N -1.54 2.48 -0.37 0.77 1.01 -0.55 -0.99 121.20 122.00 2j58 s ILE 246 Ca 0.72 -0.84 -0.07 0.00 0.00 0.00 0.00 60.65 60.46 2j58 s ILE 246 Cb -0.31 -2.03 0.06 0.00 0.01 0.00 0.00 42.46 40.19 2j58 s ILE 246 CO 0.36 0.53 0.16 -0.22 0.00 0.00 0.00 174.94 175.77 2j58 s LEU 247 N 0.78 4.67 -0.17 2.97 2.96 0.51 -0.40 118.68 129.99 2j58 s LEU 247 Ca -0.07 -1.32 -0.03 0.00 -0.22 0.00 0.00 54.13 52.49 2j58 s LEU 247 Cb -0.16 -1.91 -0.02 0.00 0.50 0.00 0.00 46.19 44.61 2j58 s LEU 247 CO 0.00 -0.41 -0.05 0.12 -1.32 0.00 0.00 176.35 174.69 2j58 s PHE 248 N 1.40 2.97 -0.34 5.38 5.36 0.62 -0.95 117.98 132.42 2j58 s PHE 248 Ca 0.01 -0.52 -0.08 0.00 -0.96 0.00 0.00 56.93 55.38 2j58 s PHE 248 Cb -0.21 -1.99 0.03 0.00 -0.34 0.00 0.00 43.02 40.52 2j58 s PHE 248 CO 0.02 -0.21 0.13 0.42 -1.46 0.00 0.00 175.22 174.12 2j58 s ILE 249 N 0.69 4.03 0.88 3.12 1.09 0.13 -0.93 121.20 130.20 2j58 s ILE 249 Ca -0.03 -0.98 -0.12 0.00 -1.10 0.00 0.00 60.65 58.43 2j58 s ILE 249 Cb -0.15 -3.23 0.12 0.00 -1.06 0.00 0.00 42.46 38.14 2j58 s ILE 249 CO 0.02 -0.14 1.12 -2.16 -0.10 0.00 0.00 174.94 173.68 2j58 s PRO 250 N 1.46 1.40 0.52 2.79 0.04 -1.26 -0.31 135.00 139.65 2j58 s PRO 250 Ca 0.00 0.40 0.07 0.00 0.04 0.00 0.00 61.00 61.50 2j58 s PRO 250 Cb -0.19 -1.86 0.05 0.00 0.04 0.00 0.00 34.50 32.54 2j58 s PRO 250 CO 0.04 -2.04 0.72 -1.54 0.04 0.00 0.00 177.00 174.22 2j58 s SER 251 N -3.98 5.27 -0.13 6.66 1.04 -1.26 -0.29 113.70 121.02 2j58 s SER 251 Ca 0.63 -0.52 0.08 0.00 0.48 0.00 0.00 55.95 56.62 2j58 s SER 251 Cb -0.15 -0.28 0.45 0.00 0.10 0.00 0.00 66.02 66.15 2j58 s SER 251 CO 0.54 -1.13 1.19 -0.46 0.98 0.00 0.00 173.24 174.35 2j58 n ASN 252 N -2.16 3.55 -0.12 7.02 6.94 -0.13 -4.17 115.26 126.20 2j58 n ASN 252 Ca 0.11 -2.49 0.12 0.00 -0.02 0.00 0.00 54.58 52.30 2j58 n ASN 252 Cb 0.60 -0.59 0.48 0.00 -2.36 0.00 0.00 39.78 37.91 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 2.19 0.42 -0.39 0.53 5.19 -1.95 -2.10 116.42 120.32 2j58 h ASP 253 Ca 0.00 0.01 0.00 0.00 -0.62 0.00 0.00 57.03 56.42 2j58 h ASP 253 Cb 1.29 -0.08 0.00 0.00 0.18 0.00 0.00 39.33 40.72 2j58 h ASP 253 CO 0.26 0.25 0.00 -0.90 -3.12 0.00 0.00 179.24 175.73 2j58 n ASP 254 N -4.48 2.54 -3.52 6.45 5.68 -1.26 -4.38 116.55 117.59 2j58 n ASP 254 Ca 0.11 -1.92 -0.40 0.00 -0.50 0.00 0.00 54.79 52.08 2j58 n ASP 254 Cb 0.38 -0.25 -0.00 0.00 -1.14 0.00 0.00 41.12 40.10 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 0.89 7.90 -4.79 -2.12 4.77 -0.79 -4.72 117.00 118.13 2j58 n LEU 255 Ca 0.17 -4.89 -0.38 0.00 -0.03 0.00 0.00 56.01 50.87 2j58 n LEU 255 Cb 0.43 -1.36 -0.06 0.00 -2.33 0.00 0.00 43.42 40.10 2j58 n LEU 255 CO 0.13 2.00 0.43 -0.54 -1.33 0.00 0.00 177.39 178.07 2j58 s LYS 256 N -1.16 4.42 -0.02 3.23 -0.14 -1.26 -4.27 119.74 120.54 2j58 s LYS 256 Ca 0.52 1.01 0.01 0.00 -1.36 0.00 0.00 55.97 56.15 2j58 s LYS 256 Cb 0.18 -3.17 0.01 0.00 -1.68 0.00 0.00 37.83 33.17 2j58 s LYS 256 CO -0.09 0.54 -0.05 0.08 -0.76 0.00 0.00 175.35 175.08 2j58 s VAL 257 N -1.23 0.46 -0.19 3.17 1.01 -0.54 0.14 120.40 123.22 2j58 s VAL 257 Ca 0.36 -0.17 -0.03 0.00 0.00 0.00 0.00 61.98 62.14 2j58 s VAL 257 Cb -0.21 -0.45 -0.01 0.00 0.00 0.00 0.00 36.38 35.71 2j58 s VAL 257 CO 0.24 0.17 -0.06 -0.36 0.00 0.00 0.00 175.10 175.09 2j58 s PHE 258 N 0.39 2.94 -0.07 5.22 0.08 -0.44 -0.33 117.98 125.77 2j58 s PHE 258 Ca -0.05 -0.76 -0.00 0.00 0.12 0.00 0.00 56.93 56.24 2j58 s PHE 258 Cb -0.08 -2.03 -0.03 0.00 -0.57 0.00 0.00 43.02 40.31 2j58 s PHE 258 CO -0.00 -0.39 -0.03 0.08 -0.10 0.00 0.00 175.22 174.78 2j58 s VAL 259 N 1.06 4.06 0.00 -0.44 1.01 0.04 0.35 120.40 126.48 2j58 s VAL 259 Ca 0.01 -0.37 0.00 0.00 0.00 0.00 0.00 61.98 61.62 2j58 s VAL 259 Cb -0.15 -2.70 0.00 0.00 0.00 0.00 0.00 36.38 33.54 2j58 s VAL 259 CO -0.00 0.58 0.00 0.61 0.00 0.00 0.00 175.10 176.29 2j58 n GLY 261 N 2.10 2.07 2.61 4.51 0.00 -1.26 -1.33 105.19 113.89 2j58 n GLY 261 Ca -0.18 -0.51 -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 9.11 4.31 -3.96 1.61 4.07 0.10 -4.83 120.64 131.05 2j58 n GLU 262 Ca 0.00 -3.51 -0.23 0.00 -0.06 0.00 0.00 57.16 53.36 2j58 n GLU 262 Cb 0.00 -2.72 -0.06 0.00 -0.06 0.00 0.00 31.44 28.60 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 -0.74 2.50 0.25 6.31 -7.23 -1.26 -1.21 120.40 119.02 2j58 s VAL 263 Ca 0.49 -1.59 -0.05 0.00 -1.81 0.00 0.00 61.98 59.02 2j58 s VAL 263 Cb 0.16 -3.00 0.26 0.00 0.56 0.00 0.00 36.38 34.36 2j58 s VAL 263 CO -0.06 -0.02 1.92 1.23 -0.31 0.00 0.00 175.10 177.86 2j58 h GLY 264 N 1.32 1.43 -6.43 2.32 0.00 -0.43 -3.42 103.07 97.87 2j58 h GLY 264 Ca -0.42 -0.52 -0.15 0.00 0.00 0.00 0.00 47.33 46.24 2j58 h GLY 264 CO 0.65 0.48 -0.48 1.25 0.00 0.00 0.00 176.54 178.45 2j58 s LYS 265 N -6.10 0.34 0.28 4.80 2.20 0.73 -4.96 119.74 117.03 2j58 s LYS 265 Ca -0.13 0.56 -0.29 0.00 -0.36 0.00 0.00 55.97 55.75 2j58 s LYS 265 Cb 0.18 -0.44 -0.10 0.00 -1.51 0.00 0.00 37.83 35.96 2j58 s LYS 265 CO 0.82 -0.61 1.40 -0.65 -0.36 0.00 0.00 175.35 175.95 2j58 s GLN 266 N 2.54 4.28 0.07 4.03 -0.21 -1.26 -4.59 119.66 124.52 2j58 s GLN 266 Ca 0.11 2.30 -0.17 0.00 0.02 0.00 0.00 55.36 57.62 2j58 s GLN 266 Cb -0.15 -3.09 0.03 0.00 1.00 0.00 0.00 33.01 30.80 2j58 s GLN 266 CO -0.15 -0.36 0.39 -1.12 -2.12 0.00 0.00 175.29 171.92 2j58 s SER 267 N 0.08 -0.24 -0.19 5.90 0.01 -0.44 -5.00 113.70 113.81 2j58 s SER 267 Ca 0.56 -0.13 -0.09 0.00 1.31 0.00 0.00 55.95 57.60 2j58 s SER 267 Cb -0.42 0.43 -0.05 0.00 0.21 0.00 0.00 66.02 66.20 2j58 s SER 267 CO 0.48 -0.71 0.10 -0.89 0.41 0.00 0.00 173.24 172.62 2j58 s THR 268 N -2.88 5.09 0.23 1.44 2.01 -1.26 -0.78 115.64 119.48 2j58 s THR 268 Ca -0.03 0.07 0.11 0.00 0.31 0.00 0.00 61.69 62.16 2j58 s THR 268 Cb 0.00 -3.31 -0.05 0.00 0.01 0.00 0.00 72.50 69.15 2j58 s THR 268 CO -0.05 0.44 -0.17 -0.76 -0.69 0.00 0.00 174.62 173.39 2j58 s LEU 269 N 0.42 2.68 0.00 4.42 1.43 0.56 -4.97 118.68 123.21 2j58 s LEU 269 Ca 0.06 -0.83 0.00 0.00 -1.03 0.00 0.00 54.13 52.32 2j58 s LEU 269 Cb -0.12 -1.31 0.00 0.00 0.03 0.00 0.00 46.19 44.79 2j58 s LEU 269 CO -0.01 0.08 0.00 0.29 0.23 0.00 0.00 176.35 176.94 2j58 n LYS 270 N -0.19 2.99 -0.82 1.70 5.02 -1.26 -1.47 118.16 124.13 2j58 n LYS 270 Ca -0.09 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.20 2j58 n LYS 270 Cb 0.57 0.00 0.00 0.00 -0.02 0.00 0.00 35.03 35.58 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 0.93 0.13 4.39 5.68 -1.26 -5.00 116.55 121.43 2j58 n ASP 272 Ca 0.00 -0.41 0.12 0.00 -0.50 0.00 0.00 54.79 54.00 2j58 n ASP 272 Cb 0.00 0.00 0.48 0.00 -1.14 0.00 0.00 41.12 40.46 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 0.22 0.00 0.11 1.74 -1.26 -2.17 116.66 115.30 2j58 n ARG 273 Ca 0.00 0.38 0.12 0.00 -0.77 0.00 0.00 57.85 57.59 2j58 n ARG 273 Cb 0.00 -1.87 0.30 0.00 -1.02 0.00 0.00 32.46 29.86 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 -2.28 0.65 0.00 0.55 3.41 -1.26 -5.01 113.62 109.68 2j58 n SER 274 Ca 0.03 -0.44 0.00 0.00 -0.26 0.00 0.00 58.87 58.20 2j58 n SER 274 Cb 0.28 0.21 0.00 0.00 -0.26 0.00 0.00 64.21 64.44 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 1.45 0.90 3.20 5.00 0.00 -0.92 -5.17 105.19 109.65 2j58 n GLY 275 Ca 0.08 -0.96 -0.10 0.00 0.00 0.00 0.00 46.02 45.03 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 0.07 0.19 2.61 -4.23 -1.26 -4.04 115.64 108.98 2j58 s THR 277 Ca 0.00 -1.85 -0.12 0.00 -1.18 0.00 0.00 61.69 58.54 2j58 s THR 277 Cb 0.00 -2.13 0.11 0.00 1.34 0.00 0.00 72.50 71.81 2j58 s THR 277 CO 0.00 -0.32 1.76 0.25 -0.54 0.00 0.00 174.62 175.77 2j58 h LEU 278 N 2.75 0.24 -0.55 4.79 5.85 -0.98 -1.93 115.31 125.48 2j58 h LEU 278 Ca -0.35 0.06 0.05 0.00 0.84 0.00 0.00 57.88 58.49 2j58 h LEU 278 Cb 1.22 0.03 -0.05 0.00 0.37 0.00 0.00 40.66 42.23 2j58 h LEU 278 CO 0.55 0.16 0.27 0.00 -0.34 0.00 0.00 178.44 179.08 2j58 h ALA 279 N 1.35 0.70 -0.47 1.25 0.00 -1.60 -2.15 119.26 118.34 2j58 h ALA 279 Ca 0.26 0.03 -0.04 0.00 0.00 0.00 0.00 54.91 55.16 2j58 h ALA 279 Cb 0.27 -0.06 -0.02 0.00 0.00 0.00 0.00 17.79 17.98 2j58 h ALA 279 CO -0.24 -0.09 0.15 1.49 0.00 0.00 0.00 179.25 180.56 2j58 h GLU 280 N 0.51 0.72 -0.47 0.00 4.81 -1.74 -1.54 114.58 116.87 2j58 h GLU 280 Ca 0.25 -0.15 0.08 0.00 -0.13 0.00 0.00 59.36 59.41 2j58 h GLU 280 Cb 0.18 -0.11 -0.07 0.00 0.63 0.00 0.00 28.75 29.38 2j58 h GLU 280 CO -0.18 0.69 0.05 0.00 -0.73 0.00 0.00 179.01 178.83 2j58 h ALA 281 N 1.01 0.49 -0.04 2.92 0.00 -0.96 0.23 119.26 122.91 2j58 h ALA 281 Ca 0.15 0.12 0.00 0.00 0.00 0.00 0.00 54.91 55.18 2j58 h ALA 281 Cb 0.26 0.18 -0.00 0.00 0.00 0.00 0.00 17.79 18.22 2j58 h ALA 281 CO -0.01 -0.35 0.03 -0.07 0.00 0.00 0.00 179.25 178.85 2j58 h LEU 282 N 0.18 0.05 -0.82 0.00 3.38 -1.29 -1.72 115.31 115.08 2j58 h LEU 282 Ca 0.24 -0.01 0.07 0.00 0.09 0.00 0.00 57.88 58.26 2j58 h LEU 282 Cb 0.33 -0.01 -0.06 0.00 0.09 0.00 0.00 40.66 41.01 2j58 h LEU 282 CO -0.35 0.04 0.49 1.23 0.09 0.00 0.00 178.44 179.95 2j58 h GLY 283 N 0.05 1.24 2.00 0.83 0.00 -0.90 0.30 103.07 106.58 2j58 h GLY 283 Ca 0.01 -0.35 -0.04 0.00 0.00 0.00 0.00 47.33 46.95 2j58 h GLY 283 CO -0.00 0.22 -0.19 3.43 0.00 0.00 0.00 176.54 180.00 2j58 h ASN 284 N 0.89 0.00 -0.22 0.19 2.35 -0.31 -1.74 115.58 116.74 2j58 h ASN 284 Ca 0.37 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 56.12 2j58 h ASN 284 Cb 0.21 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.58 2j58 h ASN 284 CO -0.19 0.19 0.00 0.00 -1.65 0.00 0.00 177.43 175.78 2j58 n ALA 285 N -2.24 2.70 -2.37 -0.83 0.00 -0.67 -4.89 120.51 112.20 2j58 n ALA 285 Ca -0.01 -0.53 -0.14 0.00 0.00 0.00 0.00 53.44 52.76 2j58 n ALA 285 Cb 0.36 -1.01 0.00 0.00 0.00 0.00 0.00 19.45 18.80 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 0.22 -1.57 0.00 0.00 1.02 -0.66 -0.19 120.64 119.46 2j58 n GLU 286 Ca 0.09 0.66 0.00 0.00 -0.02 0.00 0.00 57.16 57.88 2j58 n GLU 286 Cb 0.38 -4.91 0.00 0.00 -0.02 0.00 0.00 31.44 26.88 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 -1.07 -2.11 3.74 0.62 0.00 0.99 -3.70 105.19 103.66 2j58 n GLY 287 Ca -0.14 -1.49 -0.42 0.00 0.00 0.00 0.00 46.02 43.96 2j58 n GLY 287 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2j58 s ILE 288 N -2.49 2.18 -0.25 -0.61 1.01 -1.26 -0.73 121.20 119.04 2j58 s ILE 288 Ca 0.00 0.14 -0.29 0.00 0.00 0.00 0.00 60.65 60.51 2j58 s ILE 288 Cb 0.00 -3.09 -0.03 0.00 0.01 0.00 0.00 42.46 39.35 2j58 s ILE 288 CO 0.00 0.02 1.84 -0.55 0.00 0.00 0.00 174.94 176.25 2j58 s SER 289 N 0.65 5.99 0.32 3.58 0.15 -0.35 -4.77 113.70 119.27 2j58 s SER 289 Ca 0.65 1.62 0.10 0.00 0.70 0.00 0.00 55.95 59.02 2j58 s SER 289 Cb -0.47 -2.52 0.55 0.00 -1.71 0.00 0.00 66.02 61.86 2j58 s SER 289 CO 0.43 -1.58 1.74 1.56 1.20 0.00 0.00 173.24 176.59 2j58 h GLN 290 N 12.51 0.09 0.00 5.44 1.08 -1.92 -0.38 115.11 131.93 2j58 h GLN 290 Ca -0.36 -0.04 0.00 0.00 -1.45 0.00 0.00 58.65 56.79 2j58 h GLN 290 Cb 1.18 -0.00 0.00 0.00 -0.05 0.00 0.00 27.48 28.61 2j58 h GLN 290 CO 1.00 0.52 0.00 0.39 -0.95 0.00 0.00 178.83 179.79 2j58 n GLU 291 N -4.01 0.85 -0.42 1.46 4.71 -1.26 -5.07 120.64 116.89 2j58 n GLU 291 Ca -0.02 0.00 0.00 0.00 -0.01 0.00 0.00 57.16 57.13 2j58 n GLU 291 Cb 0.48 -1.47 0.00 0.00 -1.01 0.00 0.00 31.44 29.44 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 -0.97 0.00 -4.38 1.62 3.41 -0.16 -5.03 113.62 108.12 2j58 n SER 293 Ca 0.19 0.00 -0.45 0.00 -0.26 0.00 0.00 58.87 58.35 2j58 n SER 293 Cb 0.09 -0.89 -0.07 0.00 -0.26 0.00 0.00 64.21 63.07 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 -2.72 6.16 0.00 4.04 -1.08 -0.13 -4.08 116.67 118.86 2j58 s ASP 294 Ca 0.00 -1.40 0.29 0.00 -0.52 0.00 0.00 52.55 50.91 2j58 s ASP 294 Cb 0.00 -2.19 1.54 0.00 -1.46 0.00 0.00 42.92 40.81 2j58 s ASP 294 CO 0.00 -0.70 2.02 0.00 0.52 0.00 0.00 175.17 177.01 2j58 n ALA 295 N 5.25 2.47 0.53 3.66 0.00 -1.26 -1.54 120.51 129.61 2j58 n ALA 295 Ca -0.13 -0.15 0.12 0.00 0.00 0.00 0.00 53.44 53.28 2j58 n ALA 295 Cb 0.43 -1.47 0.46 0.00 0.00 0.00 0.00 19.45 18.87 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 -1.19 0.71 -3.18 0.00 -2.24 -1.26 0.03 114.28 107.15 2j58 n THR 296 Ca 0.16 0.04 -0.28 0.00 -2.27 0.00 0.00 64.05 61.71 2j58 n THR 296 Cb 0.18 -0.91 -0.06 0.00 -2.10 0.00 0.00 70.33 67.45 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 0.55 5.21 3.39 3.38 0.00 -0.59 -4.18 105.19 112.95 2j58 n GLY 297 Ca 0.04 -2.78 -0.37 0.00 0.00 0.00 0.00 46.02 42.91 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 -3.41 4.07 0.06 -0.61 1.01 -1.09 -1.60 121.20 119.63 2j58 s ILE 298 Ca 0.44 -0.42 0.08 0.00 0.00 0.00 0.00 60.65 60.74 2j58 s ILE 298 Cb 0.21 -2.98 -0.03 0.00 0.01 0.00 0.00 42.46 39.67 2j58 s ILE 298 CO -0.07 0.24 -0.21 -0.36 0.00 0.00 0.00 174.94 174.54 2j58 s PHE 299 N 1.55 1.83 -0.15 3.97 0.08 0.22 0.31 117.98 125.80 2j58 s PHE 299 Ca 0.05 -0.39 0.01 0.00 0.12 0.00 0.00 56.93 56.72 2j58 s PHE 299 Cb -0.16 -1.06 -0.00 0.00 -0.57 0.00 0.00 43.02 41.23 2j58 s PHE 299 CO 0.02 0.13 -0.17 0.08 -0.10 0.00 0.00 175.22 175.19 2j58 s VAL 300 N -0.92 2.57 -0.20 -0.44 1.01 -0.28 -0.69 120.40 121.46 2j58 s VAL 300 Ca 0.07 -0.81 -0.05 0.00 0.00 0.00 0.00 61.98 61.20 2j58 s VAL 300 Cb -0.09 -2.07 -0.02 0.00 0.00 0.00 0.00 36.38 34.19 2j58 s VAL 300 CO 0.03 0.52 -0.00 -0.69 0.00 0.00 0.00 175.10 174.96 2j58 s VAL 301 N 0.76 3.92 -0.06 2.92 1.01 0.43 -0.52 120.40 128.86 2j58 s VAL 301 Ca -0.07 -0.33 0.01 0.00 0.00 0.00 0.00 61.98 61.60 2j58 s VAL 301 Cb -0.16 -2.77 0.02 0.00 0.00 0.00 0.00 36.38 33.47 2j58 s VAL 301 CO 0.01 0.43 -0.07 -0.60 0.00 0.00 0.00 175.10 174.87 2j58 s ARG 302 N 1.01 1.11 0.30 2.72 3.52 -0.08 -1.90 118.95 125.63 2j58 s ARG 302 Ca 0.02 -0.19 -0.30 0.00 -0.13 0.00 0.00 55.73 55.13 2j58 s ARG 302 Cb -0.14 -1.05 -0.12 0.00 -1.56 0.00 0.00 34.95 32.07 2j58 s ARG 302 CO 0.02 -0.07 1.45 0.94 -0.81 0.00 0.00 175.30 176.82 2j58 n GLN 303 N 4.09 2.36 -4.08 5.12 7.27 -1.26 -0.65 117.38 130.23 2j58 n GLN 303 Ca -0.23 0.84 -0.35 0.00 0.07 0.00 0.00 57.00 57.33 2j58 n GLN 303 Cb 0.51 -2.52 -0.12 0.00 2.41 0.00 0.00 30.24 30.51 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 -0.70 3.28 -0.05 1.69 2.96 -0.26 -4.73 118.68 120.87 2j58 s LEU 304 Ca 0.61 -0.19 -0.02 0.00 -0.22 0.00 0.00 54.13 54.31 2j58 s LEU 304 Cb -0.55 -1.83 -0.04 0.00 0.50 0.00 0.00 46.19 44.27 2j58 s LEU 304 CO 0.55 0.07 0.06 -0.54 -1.32 0.00 0.00 176.35 175.17 2j58 s LYS 305 N 0.97 3.08 -1.57 1.98 1.02 -1.26 -4.58 119.74 119.38 2j58 s LYS 305 Ca 0.02 -0.42 0.00 0.00 0.02 0.00 0.00 55.97 55.59 2j58 s LYS 305 Cb -0.14 -2.88 0.00 0.00 -0.52 0.00 0.00 37.83 34.29 2j58 s LYS 305 CO 0.02 0.68 0.00 0.41 -0.92 0.00 0.00 175.35 175.54 2j58 n GLY 306 N 1.61 0.80 3.76 -3.33 0.00 -1.26 -4.97 105.19 101.80 2j58 n GLY 306 Ca -0.16 -0.24 -0.41 0.00 0.00 0.00 0.00 46.02 45.22 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 -2.59 6.85 0.00 1.61 2.15 -1.26 -4.92 116.67 118.50 2j58 s ASP 307 Ca 0.00 2.57 0.25 0.00 0.43 0.00 0.00 52.55 55.79 2j58 s ASP 307 Cb 0.00 -2.63 0.41 0.00 -0.30 0.00 0.00 42.92 40.40 2j58 s ASP 307 CO 0.00 -0.51 1.35 0.54 -0.17 0.00 0.00 175.17 176.38 2j58 n ARG 308 N 1.49 1.08 -0.66 4.34 5.12 -1.26 -4.01 116.66 122.75 2j58 n ARG 308 Ca 0.02 -0.78 0.01 0.00 -1.93 0.00 0.00 57.85 55.17 2j58 n ARG 308 Cb 0.42 -1.48 0.23 0.00 -1.16 0.00 0.00 32.46 30.47 2j58 n ARG 308 CO 0.00 0.00 0.00 0.25 -1.93 0.00 0.00 177.63 175.95 2j58 n THR 309 N -0.29 2.47 -0.65 0.55 -2.24 -1.26 -4.96 114.28 107.90 2j58 n THR 309 Ca 0.11 -2.26 0.00 0.00 -2.27 0.00 0.00 64.05 59.64 2j58 n THR 309 Cb 0.41 -0.30 0.00 0.00 -2.10 0.00 0.00 70.33 68.34 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 -0.81 1.43 3.75 3.38 0.00 -1.26 -5.02 105.19 106.66 2j58 n GLY 310 Ca 0.29 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.90 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 -0.10 4.48 -0.01 1.61 -0.14 -1.26 -4.87 119.74 119.45 2j58 s LYS 311 Ca 0.00 1.96 0.13 0.00 -1.36 0.00 0.00 55.97 56.70 2j58 s LYS 311 Cb 0.00 -3.18 -0.17 0.00 -1.68 0.00 0.00 37.83 32.80 2j58 s LYS 311 CO 0.00 -0.06 0.46 0.44 -0.76 0.00 0.00 175.35 175.43 2j58 n ILE 312 N 1.87 0.00 -3.61 2.17 -5.35 0.15 -4.54 119.36 110.05 2j58 n ILE 312 Ca 0.02 -0.23 -0.16 0.00 -0.27 0.00 0.00 62.75 62.11 2j58 n ILE 312 Cb 0.44 0.71 -0.07 0.00 -1.74 0.00 0.00 39.64 38.97 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 -2.49 -1.36 -0.09 -1.28 0.00 -1.24 -1.10 121.76 114.20 2j58 s ALA 313 Ca 0.01 0.86 -0.02 0.00 0.00 0.00 0.00 51.96 52.81 2j58 s ALA 313 Cb 0.09 0.09 -0.03 0.00 0.00 0.00 0.00 23.12 23.27 2j58 s ALA 313 CO 0.55 -0.36 -0.01 -0.51 0.00 0.00 0.00 175.76 175.43 2j58 s ASP 314 N -1.37 5.09 -0.12 0.00 1.01 0.18 -1.72 116.67 119.74 2j58 s ASP 314 Ca -0.11 0.08 0.03 0.00 0.71 0.00 0.00 52.55 53.26 2j58 s ASP 314 Cb -0.02 -1.47 0.01 0.00 1.01 0.00 0.00 42.92 42.45 2j58 s ASP 314 CO 0.06 0.34 -0.22 -0.63 0.21 0.00 0.00 175.17 174.93 2j58 s ILE 315 N -0.68 2.00 -0.20 0.77 1.01 0.15 -0.91 121.20 123.35 2j58 s ILE 315 Ca 0.11 -0.97 -0.03 0.00 0.00 0.00 0.00 60.65 59.76 2j58 s ILE 315 Cb -0.12 -1.75 -0.01 0.00 0.01 0.00 0.00 42.46 40.59 2j58 s ILE 315 CO 0.02 0.54 -0.05 -0.31 0.00 0.00 0.00 174.94 175.15 2j58 s TYR 316 N 0.59 2.96 -0.24 3.97 2.02 0.33 0.40 117.35 127.37 2j58 s TYR 316 Ca -0.13 -0.73 -0.05 0.00 -0.37 0.00 0.00 57.07 55.79 2j58 s TYR 316 Cb -0.17 -2.05 -0.01 0.00 -0.40 0.00 0.00 41.96 39.34 2j58 s TYR 316 CO 0.03 -0.39 -0.00 -1.14 -1.57 0.00 0.00 175.55 172.48 2j58 s GLN 317 N 1.10 3.32 -0.26 -0.62 0.74 0.27 -1.13 119.66 123.08 2j58 s GLN 317 Ca 0.01 -0.68 -0.15 0.00 0.05 0.00 0.00 55.36 54.60 2j58 s GLN 317 Cb -0.15 -3.12 -0.04 0.00 1.10 0.00 0.00 33.01 30.80 2j58 s GLN 317 CO -0.00 -0.26 0.37 -1.17 -0.55 0.00 0.00 175.29 173.68 2j58 s LEU 318 N 1.49 4.06 -0.60 3.68 2.96 0.15 -4.49 118.68 125.92 2j58 s LEU 318 Ca 0.05 0.32 -0.24 0.00 -0.22 0.00 0.00 54.13 54.04 2j58 s LEU 318 Cb -0.15 -2.43 0.05 0.00 0.50 0.00 0.00 46.19 44.16 2j58 s LEU 318 CO -0.01 -0.16 0.97 0.21 -1.32 0.00 0.00 176.35 176.03 2j58 s ASN 319 N 1.54 6.27 -0.30 3.68 3.84 -1.26 -2.66 114.94 126.04 2j58 s ASN 319 Ca 0.15 -0.59 0.08 0.00 0.21 0.00 0.00 52.86 52.72 2j58 s ASN 319 Cb -0.16 -2.44 0.51 0.00 -0.55 0.00 0.00 41.25 38.61 2j58 s ASN 319 CO 0.09 -1.34 1.47 0.00 -2.79 0.00 0.00 177.10 174.52 2j58 n ALA 320 N 7.68 4.37 -0.34 1.71 0.00 0.10 -4.61 120.51 129.42 2j58 n ALA 320 Ca -0.00 -3.18 0.05 0.00 0.00 0.00 0.00 53.44 50.31 2j58 n ALA 320 Cb 0.47 -0.74 0.23 0.00 0.00 0.00 0.00 19.45 19.41 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 1.02 1.01 -5.58 0.00 4.20 -1.88 -3.29 115.11 110.59 2j58 h GLN 321 Ca 0.23 -0.06 -0.61 0.00 0.06 0.00 0.00 58.65 58.27 2j58 h GLN 321 Cb 1.65 -0.23 -0.11 0.00 0.30 0.00 0.00 27.48 29.09 2j58 h GLN 321 CO 0.40 0.67 0.23 0.34 -0.67 0.00 0.00 178.83 179.80 2j58 s ASP 322 N -5.85 6.60 0.57 1.46 -1.08 -1.26 -4.97 116.67 112.15 2j58 s ASP 322 Ca -0.12 0.68 0.32 0.00 -0.52 0.00 0.00 52.55 52.90 2j58 s ASP 322 Cb 0.21 -2.36 1.74 0.00 -1.46 0.00 0.00 42.92 41.05 2j58 s ASP 322 CO 0.81 -0.45 2.18 0.00 0.52 0.00 0.00 175.17 178.23 2j58 h ALA 323 N 7.97 1.29 0.00 3.66 0.00 -1.95 -1.49 119.26 128.73 2j58 h ALA 323 Ca -0.26 -0.05 -0.01 0.00 0.00 0.00 0.00 54.91 54.59 2j58 h ALA 323 Cb 1.11 -0.01 -0.00 0.00 0.00 0.00 0.00 17.79 18.89 2j58 h ALA 323 CO 0.81 0.07 -0.06 0.66 0.00 0.00 0.00 179.25 180.72 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 0.18 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.27 2j58 h SER 324 CO 0.01 0.06 0.69 0.00 -0.87 0.00 0.00 176.83 176.72 2j58 n ALA 325 N -2.21 0.99 0.00 5.18 0.00 -0.57 -4.55 120.51 119.35 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 0.20 -2.32 0.00 0.00 0.00 0.00 0.00 19.45 17.33 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 3.75 0.00 0.05 0.00 3.14 -1.26 -3.91 118.33 120.11 2j58 n VAL 327 Ca 0.00 0.00 -0.03 0.00 -2.96 0.00 0.00 64.34 61.35 2j58 n VAL 327 Cb 0.00 0.00 0.22 0.00 -1.06 0.00 0.00 33.84 33.00 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 0.38 -1.74 6.55 3.38 -1.96 -2.06 115.31 119.86 2j58 h LEU 328 Ca 0.00 -0.14 -0.03 0.00 0.09 0.00 0.00 57.88 57.80 2j58 h LEU 328 Cb 0.00 -0.10 -0.00 0.00 0.09 0.00 0.00 40.66 40.64 2j58 h LEU 328 CO 0.00 0.68 -0.16 1.23 0.09 0.00 0.00 178.44 180.28 2j58 h GLY 329 N 1.07 0.00 1.87 0.83 0.00 -1.94 -1.71 103.07 103.20 2j58 h GLY 329 Ca 0.04 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.37 2j58 h GLY 329 CO 0.06 0.00 0.00 -1.30 0.00 0.00 0.00 176.54 175.30 2j58 n THR 330 N -3.68 0.22 0.34 4.70 -2.24 -0.78 -1.61 114.28 111.24 2j58 n THR 330 Ca -0.02 0.05 0.04 0.00 -2.27 0.00 0.00 64.05 61.86 2j58 n THR 330 Cb 0.28 -0.62 -0.02 0.00 -2.10 0.00 0.00 70.33 67.87 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 -1.44 3.19 -3.31 -0.78 1.02 -0.71 -4.92 120.64 113.69 2j58 n GLU 331 Ca 0.08 -0.31 -0.41 0.00 -0.02 0.00 0.00 57.16 56.50 2j58 n GLU 331 Cb 0.27 -0.94 -0.08 0.00 -0.02 0.00 0.00 31.44 30.67 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 -1.37 3.21 -0.06 -0.32 5.36 -0.83 -4.89 117.98 119.08 2j58 s PHE 332 Ca 0.05 0.19 -0.25 0.00 -0.96 0.00 0.00 56.93 55.96 2j58 s PHE 332 Cb 0.06 -2.78 -0.03 0.00 -0.34 0.00 0.00 43.02 39.93 2j58 s PHE 332 CO 0.24 -0.44 0.79 -0.65 -1.46 0.00 0.00 175.22 173.70 2j58 s GLN 333 N 2.22 4.46 0.47 10.12 -1.52 -1.26 -1.91 119.66 132.24 2j58 s GLN 333 Ca 0.16 1.04 -0.15 0.00 -1.95 0.00 0.00 55.36 54.46 2j58 s GLN 333 Cb -0.16 -3.46 -0.08 0.00 -0.22 0.00 0.00 33.01 29.09 2j58 s GLN 333 CO 0.12 -0.00 0.91 -0.51 -0.25 0.00 0.00 175.29 175.56 2j58 s LEU 334 N 0.99 3.71 0.22 2.90 1.43 -1.26 -4.93 118.68 121.73 2j58 s LEU 334 Ca 0.42 1.44 0.11 0.00 -1.03 0.00 0.00 54.13 55.06 2j58 s LEU 334 Cb -0.18 -4.35 -0.04 0.00 0.03 0.00 0.00 46.19 41.64 2j58 s LEU 334 CO 0.20 -0.51 -0.16 -1.10 0.23 0.00 0.00 176.35 175.01 2j58 s GLN 335 N -3.94 1.80 0.27 1.70 -0.21 -1.26 -4.94 119.66 113.08 2j58 s GLN 335 Ca 0.57 -1.50 -0.30 0.00 0.02 0.00 0.00 55.36 54.14 2j58 s GLN 335 Cb -0.10 -1.95 -0.13 0.00 1.00 0.00 0.00 33.01 31.83 2j58 s GLN 335 CO 0.30 0.39 1.32 -2.30 -2.12 0.00 0.00 175.29 172.88 2j58 n PRO 336 N -0.15 1.95 -0.91 2.91 -0.02 -1.26 -1.77 135.00 135.74 2j58 n PRO 336 Ca -0.09 0.69 0.00 0.00 -2.02 0.00 0.00 63.50 62.07 2j58 n PRO 336 Cb 0.57 -2.29 0.00 0.00 -0.02 0.00 0.00 33.50 31.76 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 1.29 0.00 -1.70 6.00 4.01 0.38 -4.89 117.16 122.24 2j58 n TYR 337 Ca 0.10 0.00 -0.39 0.00 -0.16 0.00 0.00 57.90 57.44 2j58 n TYR 337 Cb 0.32 0.00 0.03 0.00 -0.31 0.00 0.00 39.34 39.39 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 0.00 2.21 -4.62 7.72 8.00 -0.73 -4.80 116.55 124.32 2j58 n ASP 338 Ca 0.00 0.99 -0.34 0.00 0.71 0.00 0.00 54.79 56.14 2j58 n ASP 338 Cb 0.00 -1.51 -0.10 0.00 -0.02 0.00 0.00 41.12 39.49 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 -1.30 4.46 -0.24 0.53 1.01 -0.80 -1.33 121.20 123.54 2j58 s ILE 339 Ca 0.69 -0.16 -0.07 0.00 0.00 0.00 0.00 60.65 61.10 2j58 s ILE 339 Cb -0.45 -2.96 -0.03 0.00 0.01 0.00 0.00 42.46 39.03 2j58 s ILE 339 CO 0.52 0.52 0.05 -0.69 0.00 0.00 0.00 174.94 175.34 2j58 s VAL 340 N -0.05 4.23 -0.06 2.92 1.01 0.15 -0.43 120.40 128.18 2j58 s VAL 340 Ca 0.04 -0.21 0.04 0.00 0.00 0.00 0.00 61.98 61.85 2j58 s VAL 340 Cb -0.13 -2.96 0.00 0.00 0.00 0.00 0.00 36.38 33.30 2j58 s VAL 340 CO 0.02 0.37 -0.16 -0.47 0.00 0.00 0.00 175.10 174.85 2j58 s TYR 341 N 1.44 1.73 -0.18 5.22 5.04 0.13 -4.22 117.35 126.50 2j58 s TYR 341 Ca 0.05 -0.58 -0.00 0.00 -2.44 0.00 0.00 57.07 54.10 2j58 s TYR 341 Cb -0.15 -1.19 0.01 0.00 0.35 0.00 0.00 41.96 40.98 2j58 s TYR 341 CO 0.03 -0.24 -0.16 0.08 -1.34 0.00 0.00 175.55 173.92 2j58 s VAL 342 N 0.30 2.48 0.60 3.14 1.01 -1.26 -0.61 120.40 126.06 2j58 s VAL 342 Ca -0.10 -0.81 -0.16 0.00 0.00 0.00 0.00 61.98 60.91 2j58 s VAL 342 Cb -0.14 -2.06 -0.03 0.00 0.00 0.00 0.00 36.38 34.14 2j58 s VAL 342 CO 0.04 0.51 1.08 0.42 0.00 0.00 0.00 175.10 177.14 2j58 s THR 343 N 1.21 3.58 0.22 3.92 -4.23 -0.63 0.02 115.64 119.74 2j58 s THR 343 Ca 0.02 0.78 -0.17 0.00 -1.18 0.00 0.00 61.69 61.15 2j58 s THR 343 Cb -0.14 -3.30 -0.08 0.00 1.34 0.00 0.00 72.50 70.33 2j58 s THR 343 CO -0.08 -0.40 0.67 -0.89 -0.54 0.00 0.00 174.62 173.38 2j58 s THR 344 N -2.31 4.69 0.29 3.99 2.01 -1.26 -0.96 115.64 122.10 2j58 s THR 344 Ca 0.66 1.03 -0.29 0.00 0.31 0.00 0.00 61.69 63.40 2j58 s THR 344 Cb -0.18 -3.76 -0.10 0.00 0.01 0.00 0.00 72.50 68.47 2j58 s THR 344 CO 0.36 0.11 1.44 0.00 -0.69 0.00 0.00 174.62 175.84 2j58 s ALA 345 N -1.63 3.61 0.26 7.40 0.00 -1.26 -4.19 121.76 125.95 2j58 s ALA 345 Ca 0.44 1.39 -0.03 0.00 0.00 0.00 0.00 51.96 53.77 2j58 s ALA 345 Cb -0.14 -3.56 0.54 0.00 0.00 0.00 0.00 23.12 19.96 2j58 s ALA 345 CO 0.20 -0.81 1.66 -1.35 0.00 0.00 0.00 175.76 175.46 2j58 h PRO 346 N 4.30 0.21 -0.12 0.00 0.11 -1.96 -1.45 132.00 133.10 2j58 h PRO 346 Ca -0.48 -0.01 -0.06 0.00 0.11 0.00 0.00 66.00 65.56 2j58 h PRO 346 Cb 1.22 -0.05 -0.01 0.00 0.11 0.00 0.00 31.00 32.27 2j58 h PRO 346 CO 0.73 0.14 -0.20 -0.07 -0.21 0.00 0.00 178.00 178.39 2j58 h LEU 347 N 0.22 0.20 -0.42 2.35 3.38 -1.99 -0.83 115.31 118.21 2j58 h LEU 347 Ca 0.46 -0.05 -0.07 0.00 0.09 0.00 0.00 57.88 58.31 2j58 h LEU 347 Cb 0.85 -0.05 -0.01 0.00 0.09 0.00 0.00 40.66 41.53 2j58 h LEU 347 CO -0.59 0.41 -0.02 0.58 0.09 0.00 0.00 178.44 178.91 2j58 h VAL 348 N 0.19 1.26 -0.69 1.22 2.07 -1.65 -0.85 116.25 117.80 2j58 h VAL 348 Ca 0.03 -1.05 -0.05 0.00 0.82 0.00 0.00 66.70 66.46 2j58 h VAL 348 Cb 0.47 1.12 -0.03 0.00 -1.52 0.00 0.00 31.29 31.32 2j58 h VAL 348 CO 0.03 0.36 0.24 0.03 0.02 0.00 0.00 177.57 178.25 2j58 h ARG 349 N 0.58 1.06 -0.20 1.57 3.08 -0.97 0.70 114.38 120.19 2j58 h ARG 349 Ca 0.12 -0.21 0.02 0.00 0.07 0.00 0.00 59.98 59.98 2j58 h ARG 349 Cb 0.51 -0.16 -0.02 0.00 0.08 0.00 0.00 29.97 30.37 2j58 h ARG 349 CO 0.02 0.90 0.04 2.35 -1.07 0.00 0.00 179.97 182.21 2j58 h TRP 350 N 1.00 0.08 0.00 3.04 2.91 -1.05 -2.35 115.95 119.57 2j58 h TRP 350 Ca 0.23 0.01 -0.03 0.00 1.13 0.00 0.00 58.89 60.23 2j58 h TRP 350 Cb 0.26 -0.00 -0.00 0.00 -0.51 0.00 0.00 29.16 28.90 2j58 h TRP 350 CO 0.02 0.03 -0.14 -0.97 -1.03 0.00 0.00 178.44 176.35 2j58 h ASN 351 N 0.13 0.00 0.52 2.65 -1.24 -0.80 -1.30 115.58 115.54 2j58 h ASN 351 Ca 0.09 0.00 -0.07 0.00 0.71 0.00 0.00 56.30 57.03 2j58 h ASN 351 Cb 0.08 0.00 -0.01 0.00 0.73 0.00 0.00 38.32 39.12 2j58 h ASN 351 CO -0.11 0.14 -0.34 0.03 -1.29 0.00 0.00 177.43 175.86 2j58 h ARG 352 N 0.00 0.00 0.11 6.67 3.08 -0.34 -0.37 114.38 123.53 2j58 h ARG 352 Ca -0.00 0.00 -0.01 0.00 0.07 0.00 0.00 59.98 60.04 2j58 h ARG 352 Cb 0.52 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.58 2j58 h ARG 352 CO 0.02 0.34 -0.06 0.28 -1.07 0.00 0.00 179.97 179.48 2j58 h VAL 353 N 0.00 0.65 -0.90 2.04 2.07 -1.05 -3.37 116.25 115.69 2j58 h VAL 353 Ca -0.00 -1.25 0.11 0.00 0.82 0.00 0.00 66.70 66.38 2j58 h VAL 353 Cb 0.69 1.16 -0.08 0.00 -1.52 0.00 0.00 31.29 31.54 2j58 h VAL 353 CO 0.04 0.20 0.53 0.40 0.02 0.00 0.00 177.57 178.76 2j58 h ILE 354 N -0.97 0.89 0.00 4.57 1.08 -1.16 -0.82 117.51 121.09 2j58 h ILE 354 Ca -0.02 -0.29 0.00 0.00 -0.39 0.00 0.00 64.86 64.16 2j58 h ILE 354 Cb 0.44 -0.03 0.00 0.00 -3.07 0.00 0.00 36.82 34.15 2j58 h ILE 354 CO 0.03 0.15 0.00 0.77 -0.69 0.00 0.00 178.15 178.41 2j58 h SER 355 N 0.85 0.00 0.28 1.72 4.64 -1.24 0.92 113.55 120.72 2j58 h SER 355 Ca 0.45 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.77 2j58 h SER 355 Cb 0.45 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.54 2j58 h SER 355 CO -0.27 0.00 -0.20 0.00 -0.87 0.00 0.00 176.83 175.49 2j58 n GLN 356 N -2.84 0.78 -0.08 4.77 1.13 -0.32 -4.06 117.38 116.76 2j58 n GLN 356 Ca -0.01 -0.40 -0.08 0.00 -1.94 0.00 0.00 57.00 54.57 2j58 n GLN 356 Cb 0.17 -1.49 -0.11 0.00 0.11 0.00 0.00 30.24 28.92 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 -0.76 0.57 -0.23 1.08 4.77 0.26 -4.73 117.00 117.96 2j58 n LEU 357 Ca 0.13 -0.02 -0.02 0.00 -0.03 0.00 0.00 56.01 56.07 2j58 n LEU 357 Cb 0.32 0.17 0.17 0.00 -2.33 0.00 0.00 43.42 41.75 2j58 n LEU 357 CO 0.25 0.45 1.12 -0.37 -1.33 0.00 0.00 177.39 177.52 2j58 h VAL 358 N 0.00 1.23 -0.15 4.08 -1.51 -1.54 -1.14 116.25 117.22 2j58 h VAL 358 Ca -0.41 -0.62 -0.02 0.00 -1.23 0.00 0.00 66.70 64.42 2j58 h VAL 358 Cb 1.87 0.28 -0.01 0.00 -2.13 0.00 0.00 31.29 31.30 2j58 h VAL 358 CO 0.01 0.27 0.02 -0.65 -1.23 0.00 0.00 177.57 175.98 2j58 h PRO 359 N 1.03 0.21 -0.14 5.19 0.11 -1.85 0.29 132.00 136.85 2j58 h PRO 359 Ca 0.26 -0.02 -0.03 0.00 0.11 0.00 0.00 66.00 66.31 2j58 h PRO 359 Cb 0.08 -0.04 -0.00 0.00 0.11 0.00 0.00 31.00 31.15 2j58 h PRO 359 CO -0.04 0.21 -0.04 1.15 -0.21 0.00 0.00 178.00 179.08 2j58 h THR 360 N 0.21 1.29 -0.40 -1.15 2.02 -1.54 0.08 112.91 113.43 2j58 h THR 360 Ca 0.05 -1.00 0.06 0.00 0.77 0.00 0.00 66.41 66.29 2j58 h THR 360 Cb 0.12 1.68 -0.05 0.00 -1.74 0.00 0.00 68.15 68.15 2j58 h THR 360 CO -0.00 0.29 0.09 0.40 0.37 0.00 0.00 175.52 176.67 2j58 h ILE 361 N -0.04 0.81 -0.66 3.11 2.04 -0.75 0.64 117.51 122.66 2j58 h ILE 361 Ca 0.03 -0.08 -0.06 0.00 1.00 0.00 0.00 64.86 65.75 2j58 h ILE 361 Cb 0.47 0.57 -0.03 0.00 -0.74 0.00 0.00 36.82 37.09 2j58 h ILE 361 CO 0.01 0.04 0.16 -1.28 0.00 0.00 0.00 178.15 177.08 2j58 h SER 362 N 0.22 0.98 -0.44 1.72 0.87 -0.40 -0.97 113.55 115.53 2j58 h SER 362 Ca 0.19 -0.20 -0.10 0.00 -1.23 0.00 0.00 61.79 60.45 2j58 h SER 362 Cb 0.22 -0.26 -0.01 0.00 -0.44 0.00 0.00 62.40 61.91 2j58 h SER 362 CO -0.24 0.94 -0.11 1.23 -0.53 0.00 0.00 176.83 178.12 2j58 h GLY 363 N 1.06 0.92 1.03 5.77 0.00 -0.46 -1.79 103.07 109.60 2j58 h GLY 363 Ca 0.21 -0.76 -0.04 0.00 0.00 0.00 0.00 47.33 46.73 2j58 h GLY 363 CO 0.00 0.70 0.29 -2.08 0.00 0.00 0.00 176.54 175.45 2j58 h VAL 364 N 0.68 1.25 0.06 4.60 2.07 -0.71 -3.07 116.25 121.13 2j58 h VAL 364 Ca 0.11 -0.78 0.02 0.00 0.82 0.00 0.00 66.70 66.87 2j58 h VAL 364 Cb 0.65 0.40 -0.03 0.00 -1.52 0.00 0.00 31.29 30.79 2j58 h VAL 364 CO 0.04 0.32 -0.19 -0.74 0.02 0.00 0.00 177.57 177.02 2j58 h HIS 365 N 1.04 -0.51 0.00 1.57 6.17 -1.05 -0.90 115.15 121.47 2j58 h HIS 365 Ca 0.24 0.01 0.00 0.00 0.71 0.00 0.00 60.37 61.34 2j58 h HIS 365 Cb 0.21 0.22 0.00 0.00 2.52 0.00 0.00 27.41 30.35 2j58 h HIS 365 CO 0.02 -0.28 0.00 -0.25 0.71 0.00 0.00 177.93 178.13 2j58 n ASP 366 N -5.32 0.32 0.00 3.26 9.92 -0.68 -2.16 116.55 121.89 2j58 n ASP 366 Ca -0.06 -0.31 0.00 0.00 -0.53 0.00 0.00 54.79 53.89 2j58 n ASP 366 Cb 0.24 -0.08 0.00 0.00 -0.64 0.00 0.00 41.12 40.64 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 0.69 0.00 -0.14 -3.53 -1.04 -0.34 -1.66 114.28 108.26 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 0.06 0.00 0.26 0.00 -1.82 0.00 0.00 70.33 68.83 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 0.84 0.11 -2.82 5.08 -1.70 -0.07 114.58 116.01 2j58 h GLU 369 Ca 0.00 -0.09 -0.01 0.00 -1.00 0.00 0.00 59.36 58.26 2j58 h GLU 369 Cb 0.00 -0.17 0.00 0.00 0.50 0.00 0.00 28.75 29.08 2j58 h GLU 369 CO 0.00 0.63 -0.05 1.15 -1.00 0.00 0.00 179.01 179.73 2j58 h THR 370 N 0.84 1.09 -0.93 1.13 2.02 -1.60 -1.54 112.91 113.92 2j58 h THR 370 Ca 0.21 -0.97 0.09 0.00 0.77 0.00 0.00 66.41 66.51 2j58 h THR 370 Cb 0.05 1.68 -0.07 0.00 -1.74 0.00 0.00 68.15 68.07 2j58 h THR 370 CO -0.03 0.23 0.60 0.58 0.37 0.00 0.00 175.52 177.26 2j58 h VAL 371 N -0.62 1.00 -0.50 3.16 2.07 -1.81 -1.87 116.25 117.68 2j58 h VAL 371 Ca -0.02 -0.34 -0.02 0.00 0.82 0.00 0.00 66.70 67.15 2j58 h VAL 371 Cb 0.49 -0.06 -0.02 0.00 -1.52 0.00 0.00 31.29 30.18 2j58 h VAL 371 CO 0.03 0.18 0.22 -0.09 0.02 0.00 0.00 177.57 177.92 2j58 h ARG 372 N 0.98 0.73 -0.64 1.57 2.43 -0.92 -1.95 114.38 116.58 2j58 h ARG 372 Ca 0.42 -0.12 0.02 0.00 -0.81 0.00 0.00 59.98 59.50 2j58 h ARG 372 Cb 0.33 -0.12 -0.03 0.00 -0.42 0.00 0.00 29.97 29.72 2j58 h ARG 372 CO -0.18 0.63 0.42 1.88 -1.51 0.00 0.00 179.97 181.21 2j58 h TYR 373 N 0.66 0.76 -0.28 2.20 0.05 -0.52 -0.45 116.97 119.38 2j58 h TYR 373 Ca 0.17 0.02 -0.05 0.00 0.05 0.00 0.00 58.73 58.92 2j58 h TYR 373 Cb 0.15 -0.25 -0.01 0.00 1.01 0.00 0.00 36.73 37.63 2j58 h TYR 373 CO -0.00 0.46 -0.01 0.82 -1.05 0.00 0.00 178.16 178.37 2j58 h ILE 374 N 0.80 1.26 0.00 -2.88 1.08 -0.74 -1.39 117.51 115.64 2j58 h ILE 374 Ca 0.25 -0.96 0.00 0.00 -0.39 0.00 0.00 64.86 63.75 2j58 h ILE 374 Cb 0.01 1.33 0.00 0.00 -3.07 0.00 0.00 36.82 35.09 2j58 h ILE 374 CO -0.06 0.31 0.00 0.29 -0.69 0.00 0.00 178.15 177.99 2j58 n LYS 375 N -4.57 0.33 -0.40 2.37 4.76 -0.79 -5.12 118.16 114.73 2j58 n LYS 375 Ca -0.03 0.08 0.00 0.00 -2.87 0.00 0.00 58.31 55.49 2j58 n LYS 375 Cb 0.27 -1.50 0.00 0.00 -1.84 0.00 0.00 35.03 31.96 2j58 n LYS 375 CO 0.00 0.00 0.00 0.54 -1.37 0.00 0.00 177.40 176.57