#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2bcj h GLU 3 N 0.00 0.76 0.00 -1.46 4.81 -2.05 0.14 114.58 116.78 2bcj h GLU 3 Ca 0.00 -0.10 -0.22 0.00 -0.13 0.00 0.00 59.36 58.91 2bcj h GLU 3 Cb 0.00 -0.14 -0.04 0.00 0.63 0.00 0.00 28.75 29.20 2bcj h GLU 3 CO 0.00 0.60 -1.33 1.25 -0.73 0.00 0.00 179.01 178.80 2bcj h LEU 4 N 0.76 0.00 0.13 1.64 5.85 -2.05 -3.12 115.31 118.51 2bcj h LEU 4 Ca 0.19 0.00 -0.28 0.00 0.84 0.00 0.00 57.88 58.63 2bcj h LEU 4 Cb 0.10 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.14 2bcj h LEU 4 CO -0.02 0.83 -1.26 -0.78 -0.34 0.00 0.00 178.44 176.86 2bcj h ASP 5 N 0.00 0.42 0.06 1.25 1.82 -1.92 -1.64 116.42 116.40 2bcj h ASP 5 Ca -0.16 -0.46 -0.10 0.00 -0.39 0.00 0.00 57.03 55.93 2bcj h ASP 5 Cb 1.77 -0.14 -0.01 0.00 0.68 0.00 0.00 39.33 41.63 2bcj h ASP 5 CO 0.08 1.36 -0.30 0.06 -1.61 0.00 0.00 179.24 178.83 2bcj h GLN 6 N 0.07 0.37 0.00 0.28 3.07 -0.87 -1.58 115.11 116.45 2bcj h GLN 6 Ca -0.14 -0.15 -0.14 0.00 0.09 0.00 0.00 58.65 58.32 2bcj h GLN 6 Cb 1.98 -0.02 -0.02 0.00 0.08 0.00 0.00 27.48 29.50 2bcj h GLN 6 CO 0.20 0.64 -0.65 1.25 0.09 0.00 0.00 178.83 180.36 2bcj h LEU 7 N 0.32 0.00 -0.07 0.06 5.85 -1.56 -1.71 115.31 118.20 2bcj h LEU 7 Ca 0.04 0.00 -0.25 0.00 0.84 0.00 0.00 57.88 58.51 2bcj h LEU 7 Cb 0.70 0.00 0.02 0.00 0.37 0.00 0.00 40.66 41.74 2bcj h LEU 7 CO 0.05 0.65 -0.95 -0.09 -0.34 0.00 0.00 178.44 177.77 2bcj h ARG 8 N 0.00 0.72 0.00 1.25 2.43 -1.10 -2.18 114.38 115.50 2bcj h ARG 8 Ca -0.01 -0.70 -0.10 0.00 -0.81 0.00 0.00 59.98 58.36 2bcj h ARG 8 Cb 1.36 0.18 -0.01 0.00 -0.42 0.00 0.00 29.97 31.08 2bcj h ARG 8 CO 0.08 1.29 -0.48 1.96 -1.51 0.00 0.00 179.97 181.31 2bcj h GLN 9 N 0.44 0.00 -0.35 0.20 1.08 -1.31 -2.80 115.11 112.36 2bcj h GLN 9 Ca -0.10 0.00 -0.16 0.00 -1.45 0.00 0.00 58.65 56.94 2bcj h GLN 9 Cb 1.59 0.00 -0.00 0.00 -0.05 0.00 0.00 27.48 29.01 2bcj h GLN 9 CO 0.19 0.48 -0.41 1.49 -0.95 0.00 0.00 178.83 179.64 2bcj h GLU 10 N 0.00 0.89 -0.28 1.46 4.81 -1.34 -2.75 114.58 117.38 2bcj h GLU 10 Ca -0.00 -0.49 0.06 0.00 -0.13 0.00 0.00 59.36 58.79 2bcj h GLU 10 Cb 1.19 0.03 -0.05 0.00 0.63 0.00 0.00 28.75 30.55 2bcj h GLU 10 CO 0.06 1.14 -0.08 0.00 -0.73 0.00 0.00 179.01 179.40 2bcj h ALA 11 N 0.74 0.17 0.00 2.92 0.00 -1.30 -0.98 119.26 120.82 2bcj h ALA 11 Ca 0.05 0.11 0.00 0.00 0.00 0.00 0.00 54.91 55.07 2bcj h ALA 11 Cb 1.00 0.23 0.00 0.00 0.00 0.00 0.00 17.79 19.02 2bcj h ALA 11 CO 0.10 -0.48 0.00 0.39 0.00 0.00 0.00 179.25 179.26 2bcj n GLU 12 N -5.25 0.39 -0.08 0.00 1.02 -1.07 -0.63 120.64 115.02 2bcj n GLU 12 Ca -0.00 0.01 -0.22 0.00 -0.02 0.00 0.00 57.16 56.92 2bcj n GLU 12 Cb 0.17 -1.50 -0.12 0.00 -0.02 0.00 0.00 31.44 29.97 2bcj n GLU 12 CO 0.00 0.00 0.00 1.04 1.18 0.00 0.00 177.13 179.35 2bcj n GLN 13 N -1.30 0.62 0.04 3.49 6.02 -1.04 -3.62 117.38 121.58 2bcj n GLN 13 Ca 0.13 0.46 0.14 0.00 -0.01 0.00 0.00 57.00 57.72 2bcj n GLN 13 Cb 0.23 -1.71 0.60 0.00 1.02 0.00 0.00 30.24 30.39 2bcj n GLN 13 CO 0.00 0.00 0.00 1.25 -1.01 0.00 0.00 177.06 177.30 2bcj h LEU 14 N -0.72 0.15 -0.25 1.08 6.46 -0.98 0.01 115.31 121.06 2bcj h LEU 14 Ca -0.41 0.00 -0.05 0.00 -0.12 0.00 0.00 57.88 57.31 2bcj h LEU 14 Cb 1.53 -0.03 -0.01 0.00 -0.73 0.00 0.00 40.66 41.42 2bcj h LEU 14 CO -0.16 0.09 -0.03 0.50 -0.62 0.00 0.00 178.44 178.22 2bcj h LYS 15 N 0.17 0.46 0.00 1.25 3.64 -1.04 -2.93 116.57 118.11 2bcj h LYS 15 Ca 0.19 -0.16 0.00 0.00 -1.27 0.00 0.00 60.65 59.41 2bcj h LYS 15 Cb 0.55 -0.03 0.00 0.00 -0.41 0.00 0.00 32.23 32.34 2bcj h LYS 15 CO -0.03 0.66 0.00 -0.91 -2.27 0.00 0.00 179.45 176.90 2bcj h ASN 16 N 0.21 0.00 0.26 4.20 4.21 -1.35 -2.26 115.58 120.86 2bcj h ASN 16 Ca 0.07 0.00 -0.11 0.00 1.21 0.00 0.00 56.30 57.47 2bcj h ASN 16 Cb 0.47 0.00 -0.01 0.00 -1.12 0.00 0.00 38.32 37.66 2bcj h ASN 16 CO 0.02 0.00 -0.44 -0.61 -1.29 0.00 0.00 177.43 175.11 2bcj h GLN 17 N 0.00 0.22 -0.05 0.81 4.15 -0.95 -2.89 115.11 116.41 2bcj h GLN 17 Ca 0.00 -0.11 -0.24 0.00 0.77 0.00 0.00 58.65 59.06 2bcj h GLN 17 Cb 0.63 0.00 0.01 0.00 0.21 0.00 0.00 27.48 28.34 2bcj h GLN 17 CO 0.00 0.63 -0.94 0.82 -1.93 0.00 0.00 178.83 177.41 2bcj h ILE 18 N 0.19 1.30 -0.39 2.39 2.04 -1.23 -2.44 117.51 119.37 2bcj h ILE 18 Ca 0.01 -2.20 -0.07 0.00 1.00 0.00 0.00 64.86 63.60 2bcj h ILE 18 Cb 0.85 2.26 -0.02 0.00 -0.74 0.00 0.00 36.82 39.18 2bcj h ILE 18 CO 0.07 0.68 -0.06 0.03 0.00 0.00 0.00 178.15 178.87 2bcj h ARG 19 N 0.40 0.65 0.01 2.37 3.08 -1.50 -2.35 114.38 117.04 2bcj h ARG 19 Ca -0.09 -0.18 -0.22 0.00 0.07 0.00 0.00 59.98 59.56 2bcj h ARG 19 Cb 1.58 -0.07 -0.00 0.00 0.08 0.00 0.00 29.97 31.55 2bcj h ARG 19 CO 0.18 0.71 -0.93 -0.44 -1.07 0.00 0.00 179.97 178.42 2bcj h ASP 20 N 0.60 0.38 0.35 7.04 5.19 -1.55 -0.20 116.42 128.23 2bcj h ASP 20 Ca 0.12 -0.31 -0.04 0.00 -0.62 0.00 0.00 57.03 56.17 2bcj h ASP 20 Cb 0.47 -0.12 -0.01 0.00 0.18 0.00 0.00 39.33 39.86 2bcj h ASP 20 CO 0.02 1.13 -0.20 0.00 -3.12 0.00 0.00 179.24 177.07 2bcj h ALA 21 N 0.85 1.40 0.07 3.45 0.00 -1.29 -1.56 119.26 122.18 2bcj h ALA 21 Ca -0.06 -0.18 -0.23 0.00 0.00 0.00 0.00 54.91 54.43 2bcj h ALA 21 Cb 1.57 -0.03 -0.01 0.00 0.00 0.00 0.00 17.79 19.32 2bcj h ALA 21 CO 0.15 0.25 -1.20 0.00 0.00 0.00 0.00 179.25 178.45 2bcj h ARG 22 N 0.00 0.15 -0.22 0.00 3.08 -1.30 -3.33 114.38 112.76 2bcj h ARG 22 Ca -0.00 -0.25 0.06 0.00 0.07 0.00 0.00 59.98 59.86 2bcj h ARG 22 Cb 0.43 0.09 -0.01 0.00 0.08 0.00 0.00 29.97 30.57 2bcj h ARG 22 CO 0.03 1.12 0.16 0.87 -1.07 0.00 0.00 179.97 181.08 2bcj h LYS 23 N -0.57 0.00 -0.87 0.04 1.57 -1.01 -1.18 116.57 114.55 2bcj h LYS 23 Ca -0.28 0.00 -0.01 0.00 -1.87 0.00 0.00 60.65 58.49 2bcj h LYS 23 Cb 1.55 0.00 -0.04 0.00 0.08 0.00 0.00 32.23 33.82 2bcj h LYS 23 CO -0.02 0.00 0.52 0.00 -0.57 0.00 0.00 179.45 179.38 2bcj h ALA 24 N 1.88 1.27 0.00 3.86 0.00 -1.40 -2.59 119.26 122.28 2bcj h ALA 24 Ca 0.11 -0.10 -0.13 0.00 0.00 0.00 0.00 54.91 54.78 2bcj h ALA 24 Cb 0.43 -0.35 -0.02 0.00 0.00 0.00 0.00 17.79 17.85 2bcj h ALA 24 CO -0.00 0.62 -0.63 0.00 0.00 0.00 0.00 179.25 179.24 2bcj n ALA 26 N -2.39 3.74 0.06 0.00 0.00 -0.95 -4.54 120.51 116.43 2bcj n ALA 26 Ca -0.01 -3.42 -0.22 0.00 0.00 0.00 0.00 53.44 49.79 2bcj n ALA 26 Cb 0.65 -3.62 -0.15 0.00 0.00 0.00 0.00 19.45 16.33 2bcj n ALA 26 CO 0.00 0.00 0.00 0.38 0.00 0.00 0.00 177.50 177.88 2bcj h ASP 27 N 7.54 0.57 -4.82 0.00 -0.00 -1.82 -3.48 116.42 114.40 2bcj h ASP 27 Ca 0.45 -0.93 -0.19 0.00 -0.00 0.00 0.00 57.03 56.37 2bcj h ASP 27 Cb 0.66 -0.18 -0.15 0.00 -0.00 0.00 0.00 39.33 39.66 2bcj h ASP 27 CO 1.95 1.80 -0.69 0.00 -0.00 0.00 0.00 179.24 182.29 2bcj s ALA 28 N -2.57 0.81 0.43 4.15 0.00 -1.26 -5.17 121.76 118.15 2bcj s ALA 28 Ca -0.17 -1.29 0.02 0.00 0.00 0.00 0.00 51.96 50.52 2bcj s ALA 28 Cb 0.06 0.19 -0.00 0.00 0.00 0.00 0.00 23.12 23.37 2bcj s ALA 28 CO 0.83 -0.28 0.62 0.95 0.00 0.00 0.00 175.76 177.89 2bcj s THR 29 N -3.69 3.85 0.23 0.00 -4.23 -1.26 -5.01 115.64 105.52 2bcj s THR 29 Ca 0.10 -0.67 0.14 0.00 -1.18 0.00 0.00 61.69 60.09 2bcj s THR 29 Cb 0.06 -3.40 0.05 0.00 1.34 0.00 0.00 72.50 70.56 2bcj s THR 29 CO -0.06 -0.24 1.68 0.25 -0.54 0.00 0.00 174.62 175.71 2bcj h LEU 30 N 0.51 0.00 -0.94 4.79 5.85 -1.96 -2.44 115.31 121.11 2bcj h LEU 30 Ca -0.45 0.00 -0.09 0.00 0.84 0.00 0.00 57.88 58.17 2bcj h LEU 30 Cb 1.26 0.00 -0.01 0.00 0.37 0.00 0.00 40.66 42.28 2bcj h LEU 30 CO 0.55 0.49 -0.24 0.28 -0.34 0.00 0.00 178.44 179.18 2bcj h SER 31 N 0.00 0.49 0.32 1.25 0.02 -1.85 -0.19 113.55 113.59 2bcj h SER 31 Ca -0.00 -0.16 -0.02 0.00 -0.84 0.00 0.00 61.79 60.77 2bcj h SER 31 Cb 0.98 -0.13 0.00 0.00 0.14 0.00 0.00 62.40 63.39 2bcj h SER 31 CO 0.06 0.73 -0.15 1.56 -1.14 0.00 0.00 176.83 177.89 2bcj h GLN 32 N 0.43 -0.42 -0.74 3.45 4.20 -1.94 -3.02 115.11 117.08 2bcj h GLN 32 Ca 0.06 0.03 0.07 0.00 0.06 0.00 0.00 58.65 58.87 2bcj h GLN 32 Cb 0.66 0.09 -0.05 0.00 0.30 0.00 0.00 27.48 28.48 2bcj h GLN 32 CO 0.05 -0.09 0.48 0.82 -0.67 0.00 0.00 178.83 179.42 2bcj h ILE 33 N -0.79 1.01 -0.01 2.54 2.04 -1.28 -2.45 117.51 118.57 2bcj h ILE 33 Ca -0.04 -0.26 0.00 0.00 1.00 0.00 0.00 64.86 65.56 2bcj h ILE 33 Cb 0.51 0.19 0.00 0.00 -0.74 0.00 0.00 36.82 36.79 2bcj h ILE 33 CO 0.07 0.14 -0.21 0.35 0.00 0.00 0.00 178.15 178.50 2bcj n THR 34 N -4.48 0.00 -0.30 -0.27 -2.24 -0.10 -4.24 114.28 102.65 2bcj n THR 34 Ca 0.11 -0.15 0.13 0.00 -2.27 0.00 0.00 64.05 61.87 2bcj n THR 34 Cb 0.25 0.42 0.30 0.00 -2.10 0.00 0.00 70.33 69.20 2bcj n THR 34 CO 0.00 0.00 0.00 0.78 -0.57 0.00 0.00 175.07 175.28 2bcj h ASN 35 N 1.43 0.16 -0.06 3.42 2.35 -1.30 -2.92 115.58 118.67 2bcj h ASN 35 Ca 0.00 0.18 -0.19 0.00 -0.55 0.00 0.00 56.30 55.74 2bcj h ASN 35 Cb 0.51 0.20 0.01 0.00 0.05 0.00 0.00 38.32 39.09 2bcj h ASN 35 CO 0.00 -0.09 -0.70 -1.13 -1.65 0.00 0.00 177.43 173.86 2bcj h ASN 36 N 0.29 0.72 -3.53 5.81 -0.73 -1.80 -3.46 115.58 112.88 2bcj h ASN 36 Ca 0.56 -0.69 -0.57 0.00 1.87 0.00 0.00 56.30 57.47 2bcj h ASN 36 Cb 1.11 -0.22 0.14 0.00 0.27 0.00 0.00 38.32 39.62 2bcj h ASN 36 CO -0.59 1.31 0.32 2.30 -0.37 0.00 0.00 177.43 180.40 2bcj n ILE 37 N -4.09 3.14 -1.98 2.57 -5.35 -1.10 -4.86 119.36 107.68 2bcj n ILE 37 Ca -0.09 -0.50 -0.42 0.00 -0.27 0.00 0.00 62.75 61.47 2bcj n ILE 37 Cb 0.71 -1.36 -0.03 0.00 -1.74 0.00 0.00 39.64 37.23 2bcj n ILE 37 CO 0.00 0.00 0.00 -1.81 -1.76 0.00 0.00 176.55 172.98 2bcj s ASP 38 N -0.88 6.63 0.74 7.28 -0.00 -1.26 -4.96 116.67 124.21 2bcj s ASP 38 Ca 0.68 2.58 -0.16 0.00 -0.00 0.00 0.00 52.55 55.65 2bcj s ASP 38 Cb -0.47 -2.60 -0.06 0.00 -0.00 0.00 0.00 42.92 39.79 2bcj s ASP 38 CO 0.52 -0.78 0.27 -2.65 -0.00 0.00 0.00 175.17 172.53 2bcj n PRO 39 N 3.74 0.18 0.23 8.23 -0.02 -1.26 -4.91 135.00 141.20 2bcj n PRO 39 Ca 0.13 0.09 0.14 0.00 -2.02 0.00 0.00 63.50 61.84 2bcj n PRO 39 Cb 0.39 -1.61 0.41 0.00 -0.02 0.00 0.00 33.50 32.67 2bcj n PRO 39 CO 0.00 0.00 0.00 -0.24 1.98 0.00 0.00 175.50 177.24 2bcj h VAL 40 N -0.47 0.00 0.00 -1.45 3.04 -1.98 -3.49 116.25 111.90 2bcj h VAL 40 Ca -0.44 -0.72 0.00 0.00 -1.01 0.00 0.00 66.70 64.53 2bcj h VAL 40 Cb 1.35 1.70 0.00 0.00 -2.01 0.00 0.00 31.29 32.33 2bcj h VAL 40 CO 0.40 0.00 0.00 0.61 -1.01 0.00 0.00 177.57 177.57 2bcj n GLY 41 N 0.63 0.29 3.14 3.17 0.00 -1.26 -4.80 105.19 106.38 2bcj n GLY 41 Ca 0.03 -1.44 -0.33 0.00 0.00 0.00 0.00 46.02 44.27 2bcj n GLY 41 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2bcj s ARG 42 N 0.00 2.77 -1.15 1.61 0.52 -1.26 -4.68 118.95 116.76 2bcj s ARG 42 Ca 0.00 -1.00 -0.17 0.00 -0.52 0.00 0.00 55.73 54.04 2bcj s ARG 42 Cb 0.00 -2.82 0.12 0.00 0.52 0.00 0.00 34.95 32.77 2bcj s ARG 42 CO 0.00 -0.37 1.45 0.42 0.02 0.00 0.00 175.30 176.82 2bcj s ILE 43 N 1.26 4.59 -0.43 1.52 -1.09 -1.16 -4.96 121.20 120.94 2bcj s ILE 43 Ca -0.00 -1.98 -0.28 0.00 -2.23 0.00 0.00 60.65 56.16 2bcj s ILE 43 Cb -0.16 -4.98 -0.00 0.00 -1.58 0.00 0.00 42.46 35.74 2bcj s ILE 43 CO -0.08 -1.75 1.57 -1.10 -1.23 0.00 0.00 174.94 172.36 2bcj s GLN 44 N 2.95 3.37 0.02 2.79 -1.52 -1.26 -4.40 119.66 121.60 2bcj s GLN 44 Ca 0.44 0.97 0.01 0.00 -1.95 0.00 0.00 55.36 54.83 2bcj s GLN 44 Cb -0.01 -4.13 -0.04 0.00 -0.22 0.00 0.00 33.01 28.61 2bcj s GLN 44 CO -0.01 -1.83 0.08 1.41 -0.25 0.00 0.00 175.29 174.69 2bcj s MET 45 N 5.45 3.01 -0.01 2.91 1.75 -1.26 -5.02 119.30 126.13 2bcj s MET 45 Ca 0.66 -0.54 0.07 0.00 -1.25 0.00 0.00 55.69 54.62 2bcj s MET 45 Cb -0.16 -2.82 -0.02 0.00 2.84 0.00 0.00 34.83 34.68 2bcj s MET 45 CO 0.31 0.62 -0.21 1.03 -0.65 0.00 0.00 175.02 176.12 2bcj s ARG 46 N -1.92 1.64 -0.48 4.11 0.52 0.46 -4.94 118.95 118.33 2bcj s ARG 46 Ca 0.25 -0.78 -0.27 0.00 -0.52 0.00 0.00 55.73 54.40 2bcj s ARG 46 Cb -0.12 -1.61 -0.02 0.00 0.52 0.00 0.00 34.95 33.72 2bcj s ARG 46 CO 0.16 0.44 1.80 0.99 0.02 0.00 0.00 175.30 178.71 2bcj s THR 47 N -0.54 3.45 -0.14 0.02 2.01 -1.26 -1.37 115.64 117.80 2bcj s THR 47 Ca 0.08 0.37 -0.27 0.00 0.31 0.00 0.00 61.69 62.19 2bcj s THR 47 Cb -0.08 -3.84 -0.24 0.00 0.01 0.00 0.00 72.50 68.35 2bcj s THR 47 CO -0.00 -0.69 0.70 0.03 -0.69 0.00 0.00 174.62 173.96 2bcj h ARG 48 N 13.84 0.00 -6.04 4.92 2.47 -1.31 -3.48 114.38 124.78 2bcj h ARG 48 Ca -0.29 0.00 -0.61 0.00 -1.26 0.00 0.00 59.98 57.82 2bcj h ARG 48 Cb 1.16 0.00 -0.13 0.00 -1.65 0.00 0.00 29.97 29.35 2bcj h ARG 48 CO 1.13 0.93 -0.69 1.03 0.56 0.00 0.00 179.97 182.93 2bcj s ARG 49 N -2.18 1.83 -0.02 0.04 1.81 -1.11 -4.97 118.95 114.34 2bcj s ARG 49 Ca -0.18 -1.84 0.03 0.00 -1.72 0.00 0.00 55.73 52.01 2bcj s ARG 49 Cb -0.02 -1.77 -0.00 0.00 -0.45 0.00 0.00 34.95 32.70 2bcj s ARG 49 CO 0.64 0.20 -0.10 0.99 -0.68 0.00 0.00 175.30 176.35 2bcj s THR 50 N -2.56 0.86 -0.65 0.02 2.01 -1.26 -2.76 115.64 111.30 2bcj s THR 50 Ca 0.32 -0.42 -0.05 0.00 0.31 0.00 0.00 61.69 61.85 2bcj s THR 50 Cb -0.00 -0.75 0.17 0.00 0.01 0.00 0.00 72.50 71.92 2bcj s THR 50 CO 0.17 0.26 0.49 -0.76 -0.69 0.00 0.00 174.62 174.08 2bcj s LEU 51 N 0.05 5.54 -0.03 4.42 1.43 0.27 -4.99 118.68 125.37 2bcj s LEU 51 Ca -0.01 -2.75 -0.21 0.00 -1.03 0.00 0.00 54.13 50.12 2bcj s LEU 51 Cb -0.08 -1.93 -0.05 0.00 0.03 0.00 0.00 46.19 44.17 2bcj s LEU 51 CO 0.00 -0.43 0.61 -0.13 0.23 0.00 0.00 176.35 176.64 2bcj s ARG 52 N 0.08 4.36 0.00 1.70 0.52 -1.26 -3.32 118.95 121.03 2bcj s ARG 52 Ca 0.16 0.75 0.00 0.00 -0.52 0.00 0.00 55.73 56.13 2bcj s ARG 52 Cb -0.19 -3.38 0.00 0.00 0.52 0.00 0.00 34.95 31.91 2bcj s ARG 52 CO -0.04 0.27 0.00 0.41 0.02 0.00 0.00 175.30 175.96 2bcj n GLY 53 N 2.68 0.30 3.78 -3.53 0.00 -1.26 -5.10 105.19 102.05 2bcj n GLY 53 Ca -0.05 0.05 -0.41 0.00 0.00 0.00 0.00 46.02 45.61 2bcj n GLY 53 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 2bcj s HIS 54 N 0.00 2.54 -0.64 1.61 3.76 -1.26 -4.91 115.29 116.40 2bcj s HIS 54 Ca 0.00 1.19 0.23 0.00 -0.15 0.00 0.00 55.06 56.33 2bcj s HIS 54 Cb 0.00 -4.00 0.19 0.00 1.11 0.00 0.00 32.58 29.87 2bcj s HIS 54 CO 0.00 -3.00 1.16 1.28 -0.85 0.00 0.00 174.74 173.33 2bcj n LEU 55 N 0.28 0.64 0.00 0.89 4.77 -1.26 -4.84 117.00 117.49 2bcj n LEU 55 Ca 0.02 0.08 0.00 0.00 -0.03 0.00 0.00 56.01 56.08 2bcj n LEU 55 Cb 0.40 -0.14 0.00 0.00 -2.33 0.00 0.00 43.42 41.35 2bcj n LEU 55 CO 0.63 0.01 0.00 0.00 -1.33 0.00 0.00 177.39 176.69 2bcj n ALA 56 N -1.81 0.00 -1.51 -1.18 0.00 -1.26 -4.93 120.51 109.81 2bcj n ALA 56 Ca 0.03 0.00 -0.47 0.00 0.00 0.00 0.00 53.44 52.99 2bcj n ALA 56 Cb 0.43 0.00 -0.03 0.00 0.00 0.00 0.00 19.45 19.86 2bcj n ALA 56 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 2bcj n LYS 57 N 0.00 0.74 -3.64 0.00 5.02 -1.25 -4.06 118.16 114.96 2bcj n LYS 57 Ca 0.00 0.26 -0.36 0.00 -2.02 0.00 0.00 58.31 56.19 2bcj n LYS 57 Cb 0.00 -1.52 -0.09 0.00 -0.02 0.00 0.00 35.03 33.40 2bcj n LYS 57 CO 0.00 0.00 0.00 0.42 -0.52 0.00 0.00 177.40 177.30 2bcj s ILE 58 N -0.84 5.36 -0.20 -0.18 1.01 -0.24 0.45 121.20 126.56 2bcj s ILE 58 Ca 0.65 0.27 0.18 0.00 0.00 0.00 0.00 60.65 61.75 2bcj s ILE 58 Cb -0.84 -3.53 -0.25 0.00 0.01 0.00 0.00 42.46 37.85 2bcj s ILE 58 CO 0.57 0.37 0.08 -1.22 0.00 0.00 0.00 174.94 174.75 2bcj n TYR 59 N 3.97 0.03 -3.79 3.97 0.53 -0.65 -4.29 117.16 116.93 2bcj n TYR 59 Ca -0.14 0.01 -0.10 0.00 -1.02 0.00 0.00 57.90 56.65 2bcj n TYR 59 Cb 0.52 -1.01 -0.05 0.00 -1.03 0.00 0.00 39.34 37.78 2bcj n TYR 59 CO 0.00 0.00 0.00 0.00 -1.02 0.00 0.00 176.86 175.84 2bcj s ALA 60 N -2.49 -0.65 0.17 -0.72 0.00 -1.15 -4.51 121.76 112.40 2bcj s ALA 60 Ca -0.10 -0.40 -0.22 0.00 0.00 0.00 0.00 51.96 51.23 2bcj s ALA 60 Cb 0.06 0.83 0.06 0.00 0.00 0.00 0.00 23.12 24.07 2bcj s ALA 60 CO 0.83 -0.74 0.59 0.00 0.00 0.00 0.00 175.76 176.44 2bcj s MET 61 N -3.89 1.30 -0.26 0.00 0.23 -1.26 -1.93 119.30 113.49 2bcj s MET 61 Ca 0.11 -0.53 -0.13 0.00 -1.03 0.00 0.00 55.69 54.11 2bcj s MET 61 Cb 0.01 0.58 0.09 0.00 -1.53 0.00 0.00 34.83 33.97 2bcj s MET 61 CO -0.03 -0.57 0.60 -1.58 -2.03 0.00 0.00 175.02 171.42 2bcj s HIS 62 N -3.77 -1.02 0.58 3.16 5.04 -0.79 -4.84 115.29 113.66 2bcj s HIS 62 Ca 0.02 1.96 -0.19 0.00 -1.54 0.00 0.00 55.06 55.32 2bcj s HIS 62 Cb -0.01 0.57 -0.04 0.00 0.04 0.00 0.00 32.58 33.14 2bcj s HIS 62 CO -0.11 -0.52 1.15 -1.58 -2.34 0.00 0.00 174.74 171.34 2bcj s TRP 63 N 1.97 2.56 0.66 3.88 0.52 -1.26 -2.09 118.94 125.18 2bcj s TRP 63 Ca -0.08 1.54 -0.11 0.00 0.02 0.00 0.00 56.10 57.47 2bcj s TRP 63 Cb -0.08 -3.34 -0.01 0.00 -1.15 0.00 0.00 33.47 28.89 2bcj s TRP 63 CO -0.18 -1.81 1.05 0.20 0.02 0.00 0.00 176.95 176.24 2bcj s GLY 64 N -1.83 1.66 0.30 0.98 0.00 0.10 -4.60 107.32 103.93 2bcj s GLY 64 Ca 0.73 -0.07 0.25 0.00 0.00 0.00 0.00 44.72 45.64 2bcj s GLY 64 CO 0.31 0.23 1.75 -0.91 0.00 0.00 0.00 173.10 174.49 2bcj h THR 65 N -0.53 0.00 0.00 0.90 1.35 -1.83 -2.81 112.91 110.00 2bcj h THR 65 Ca -0.44 -0.26 0.00 0.00 -0.55 0.00 0.00 66.41 65.16 2bcj h THR 65 Cb 1.21 1.02 0.00 0.00 -1.73 0.00 0.00 68.15 68.65 2bcj h THR 65 CO 0.60 0.00 0.00 -0.90 -0.25 0.00 0.00 175.52 174.97 2bcj n ASP 66 N -2.36 0.00 -2.60 5.36 3.85 -1.26 -4.75 116.55 114.79 2bcj n ASP 66 Ca 0.02 0.30 -0.17 0.00 -0.71 0.00 0.00 54.79 54.22 2bcj n ASP 66 Cb 0.23 -0.42 0.05 0.00 -1.35 0.00 0.00 41.12 39.63 2bcj n ASP 66 CO 0.00 0.00 0.00 -1.20 -1.01 0.00 0.00 177.20 174.99 2bcj n SER 67 N -1.42 -5.17 0.00 -1.12 7.64 -1.06 -4.82 113.62 107.66 2bcj n SER 67 Ca 0.07 -0.32 0.00 0.00 1.01 0.00 0.00 58.87 59.63 2bcj n SER 67 Cb 0.23 -3.89 0.00 0.00 -1.01 0.00 0.00 64.21 59.54 2bcj n SER 67 CO 0.00 0.00 0.00 -1.14 -3.01 0.00 0.00 175.04 170.89 2bcj n ARG 68 N -3.59 0.00 -3.31 1.43 0.63 -1.26 -4.99 116.66 105.58 2bcj n ARG 68 Ca -0.03 0.00 -0.32 0.00 -0.92 0.00 0.00 57.85 56.57 2bcj n ARG 68 Cb 0.57 -0.03 -0.06 0.00 0.45 0.00 0.00 32.46 33.39 2bcj n ARG 68 CO 0.00 0.00 0.00 -0.51 -2.51 0.00 0.00 177.63 174.61 2bcj s LEU 69 N -4.71 4.14 -0.22 6.15 1.43 -1.26 -1.39 118.68 122.82 2bcj s LEU 69 Ca 0.00 1.06 -0.18 0.00 -1.03 0.00 0.00 54.13 53.98 2bcj s LEU 69 Cb 0.00 -3.82 0.06 0.00 0.03 0.00 0.00 46.19 42.46 2bcj s LEU 69 CO 0.00 -0.12 0.56 -1.48 0.23 0.00 0.00 176.35 175.55 2bcj s LEU 70 N -2.84 -0.25 0.42 1.79 2.34 -1.06 0.00 118.68 119.08 2bcj s LEU 70 Ca 0.50 1.16 -0.06 0.00 0.06 0.00 0.00 54.13 55.79 2bcj s LEU 70 Cb -0.11 1.93 -0.04 0.00 -0.56 0.00 0.00 46.19 47.40 2bcj s LEU 70 CO 0.20 -0.20 0.72 0.68 -1.06 0.00 0.00 176.35 176.69 2bcj s VAL 71 N 0.58 4.92 -0.16 1.48 -7.23 -0.89 -1.11 120.40 118.00 2bcj s VAL 71 Ca -0.02 0.18 -0.09 0.00 -1.81 0.00 0.00 61.98 60.24 2bcj s VAL 71 Cb -0.05 -3.82 0.06 0.00 0.56 0.00 0.00 36.38 33.13 2bcj s VAL 71 CO -0.03 -0.67 0.39 -0.94 -0.31 0.00 0.00 175.10 173.53 2bcj s SER 72 N -3.77 -0.48 -0.05 4.85 1.04 -0.26 -1.88 113.70 113.16 2bcj s SER 72 Ca 0.47 0.84 -0.04 0.00 0.48 0.00 0.00 55.95 57.69 2bcj s SER 72 Cb -0.10 0.73 -0.04 0.00 0.10 0.00 0.00 66.02 66.71 2bcj s SER 72 CO 0.39 -0.18 0.16 0.00 0.98 0.00 0.00 173.24 174.58 2bcj s ALA 73 N 1.28 3.90 0.05 5.32 0.00 -0.81 -1.73 121.76 129.76 2bcj s ALA 73 Ca -0.09 -0.72 -0.05 0.00 0.00 0.00 0.00 51.96 51.10 2bcj s ALA 73 Cb -0.08 -1.89 -0.01 0.00 0.00 0.00 0.00 23.12 21.13 2bcj s ALA 73 CO -0.11 0.69 0.08 0.45 0.00 0.00 0.00 175.76 176.88 2bcj s SER 74 N -1.56 0.22 0.55 0.00 0.15 -0.98 -1.63 113.70 110.45 2bcj s SER 74 Ca 0.22 -0.62 0.30 0.00 0.70 0.00 0.00 55.95 56.55 2bcj s SER 74 Cb -0.12 0.23 1.46 0.00 -1.71 0.00 0.00 66.02 65.88 2bcj s SER 74 CO 0.12 -0.54 1.91 -0.61 1.20 0.00 0.00 173.24 175.32 2bcj h GLN 75 N 3.50 0.00 0.00 5.44 4.15 -0.26 -0.43 115.11 127.51 2bcj h GLN 75 Ca -0.33 0.00 0.00 0.00 0.77 0.00 0.00 58.65 59.09 2bcj h GLN 75 Cb 1.18 0.00 0.00 0.00 0.21 0.00 0.00 27.48 28.87 2bcj h GLN 75 CO 0.53 0.00 0.00 -0.40 -1.93 0.00 0.00 178.83 177.03 2bcj n ASP 76 N -4.13 0.00 0.00 -0.69 3.85 -1.26 -4.81 116.55 109.51 2bcj n ASP 76 Ca 0.14 -0.72 0.00 0.00 -0.71 0.00 0.00 54.79 53.50 2bcj n ASP 76 Cb 0.82 0.00 0.00 0.00 -1.35 0.00 0.00 41.12 40.59 2bcj n ASP 76 CO 0.00 0.00 0.00 0.61 -1.01 0.00 0.00 177.20 176.80 2bcj n GLY 77 N -0.13 0.52 3.67 6.12 0.00 -0.17 -4.96 105.19 110.24 2bcj n GLY 77 Ca 0.02 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.76 2bcj n GLY 77 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2bcj s LYS 78 N -0.39 2.43 -0.30 1.61 1.02 -1.24 -2.33 119.74 120.53 2bcj s LYS 78 Ca 0.00 -1.01 0.03 0.00 0.02 0.00 0.00 55.97 55.01 2bcj s LYS 78 Cb 0.00 -2.42 0.08 0.00 -0.52 0.00 0.00 37.83 34.98 2bcj s LYS 78 CO 0.00 0.49 -0.01 -1.17 -0.92 0.00 0.00 175.35 173.73 2bcj s LEU 79 N -2.68 3.88 -0.11 3.17 2.96 0.54 -2.33 118.68 124.11 2bcj s LEU 79 Ca 0.26 -1.74 -0.06 0.00 -0.22 0.00 0.00 54.13 52.37 2bcj s LEU 79 Cb -0.10 -1.50 -0.04 0.00 0.50 0.00 0.00 46.19 45.05 2bcj s LEU 79 CO 0.18 -0.30 0.11 -0.63 -1.32 0.00 0.00 176.35 174.39 2bcj s ILE 80 N 1.08 5.25 -0.23 6.68 1.01 -0.71 -0.75 121.20 133.54 2bcj s ILE 80 Ca 0.02 0.11 -0.06 0.00 0.00 0.00 0.00 60.65 60.71 2bcj s ILE 80 Cb -0.19 -3.28 -0.03 0.00 0.01 0.00 0.00 42.46 38.97 2bcj s ILE 80 CO -0.08 0.61 0.04 -0.63 0.00 0.00 0.00 174.94 174.88 2bcj s ILE 81 N -1.00 4.16 0.07 2.92 1.01 0.12 -1.10 121.20 127.38 2bcj s ILE 81 Ca 0.15 -0.23 0.03 0.00 0.00 0.00 0.00 60.65 60.60 2bcj s ILE 81 Cb -0.12 -2.92 -0.04 0.00 0.01 0.00 0.00 42.46 39.40 2bcj s ILE 81 CO 0.04 0.38 0.07 0.26 0.00 0.00 0.00 174.94 175.70 2bcj s TRP 82 N 1.33 3.18 -0.60 3.97 0.52 -0.27 -0.78 118.94 126.29 2bcj s TRP 82 Ca 0.05 0.08 -0.17 0.00 0.02 0.00 0.00 56.10 56.08 2bcj s TRP 82 Cb -0.15 -1.62 0.14 0.00 -1.15 0.00 0.00 33.47 30.69 2bcj s TRP 82 CO 0.02 0.52 0.61 0.34 0.02 0.00 0.00 176.95 178.46 2bcj s ASP 83 N -2.34 6.28 0.34 2.95 -1.08 0.77 -2.58 116.67 121.01 2bcj s ASP 83 Ca 0.29 -1.83 0.07 0.00 -0.52 0.00 0.00 52.55 50.56 2bcj s ASP 83 Cb -0.12 -2.24 0.75 0.00 -1.46 0.00 0.00 42.92 39.85 2bcj s ASP 83 CO 0.21 -0.89 1.87 0.77 0.52 0.00 0.00 175.17 177.65 2bcj h SER 84 N 8.82 0.72 -0.70 -0.34 4.64 -1.53 1.30 113.55 126.45 2bcj h SER 84 Ca -0.23 0.04 -0.07 0.00 -0.47 0.00 0.00 61.79 61.05 2bcj h SER 84 Cb 1.09 -0.10 -0.03 0.00 -0.31 0.00 0.00 62.40 63.04 2bcj h SER 84 CO 1.02 0.38 0.15 1.88 -0.87 0.00 0.00 176.83 179.39 2bcj h TYR 85 N 0.77 1.20 -0.00 4.77 -1.99 -1.93 -3.32 116.97 116.47 2bcj h TYR 85 Ca 0.45 -0.15 0.00 0.00 2.00 0.00 0.00 58.73 61.03 2bcj h TYR 85 Cb 0.64 -0.34 0.00 0.00 2.00 0.00 0.00 36.73 39.03 2bcj h TYR 85 CO -0.00 0.98 -0.34 0.25 -0.00 0.00 0.00 178.16 179.05 2bcj n THR 86 N -4.22 0.00 -0.61 -2.88 -2.24 -0.31 -4.99 114.28 99.02 2bcj n THR 86 Ca 0.05 -0.33 0.00 0.00 -2.27 0.00 0.00 64.05 61.50 2bcj n THR 86 Cb 0.27 1.08 0.00 0.00 -2.10 0.00 0.00 70.33 69.59 2bcj n THR 86 CO 0.00 0.00 0.00 0.41 -0.57 0.00 0.00 175.07 174.91 2bcj n THR 87 N -0.62 0.00 -3.16 4.28 -1.04 0.43 -4.97 114.28 109.21 2bcj n THR 87 Ca 0.04 0.00 -0.36 0.00 -2.04 0.00 0.00 64.05 61.69 2bcj n THR 87 Cb 0.21 -0.29 -0.06 0.00 -1.82 0.00 0.00 70.33 68.37 2bcj n THR 87 CO 0.00 0.00 0.00 0.20 -0.64 0.00 0.00 175.07 174.63 2bcj s ASN 88 N -2.39 7.00 -0.51 8.00 0.01 -1.23 -4.74 114.94 121.08 2bcj s ASN 88 Ca 0.00 1.34 -0.21 0.00 -0.71 0.00 0.00 52.86 53.27 2bcj s ASN 88 Cb 0.00 -2.39 0.05 0.00 0.41 0.00 0.00 41.25 39.32 2bcj s ASN 88 CO 0.00 0.04 0.76 -0.54 -1.51 0.00 0.00 177.10 175.85 2bcj s LYS 89 N -2.00 3.24 0.45 -0.60 1.02 -1.26 -0.16 119.74 120.43 2bcj s LYS 89 Ca 0.42 -0.53 0.14 0.00 0.02 0.00 0.00 55.97 56.02 2bcj s LYS 89 Cb -0.16 -4.05 1.02 0.00 -0.52 0.00 0.00 37.83 34.12 2bcj s LYS 89 CO 0.20 -1.29 2.01 0.28 -0.92 0.00 0.00 175.35 175.63 2bcj h VAL 90 N 5.93 1.12 -2.60 3.17 2.07 -1.26 -3.44 116.25 121.25 2bcj h VAL 90 Ca -0.26 -0.56 -0.10 0.00 0.82 0.00 0.00 66.70 66.60 2bcj h VAL 90 Cb 1.09 1.29 -0.21 0.00 -1.52 0.00 0.00 31.29 31.93 2bcj h VAL 90 CO 1.00 0.16 -0.12 -1.00 0.02 0.00 0.00 177.57 177.64 2bcj s HIS 91 N -4.70 -0.44 -0.53 1.57 3.76 -1.15 -4.98 115.29 108.82 2bcj s HIS 91 Ca -0.04 0.91 0.04 0.00 -0.15 0.00 0.00 55.06 55.81 2bcj s HIS 91 Cb 0.16 0.20 0.15 0.00 1.11 0.00 0.00 32.58 34.20 2bcj s HIS 91 CO 0.70 -0.38 0.35 0.00 -0.85 0.00 0.00 174.74 174.55 2bcj s ALA 92 N -0.61 2.66 -0.22 -1.40 0.00 -1.26 0.13 121.76 121.06 2bcj s ALA 92 Ca -0.07 -3.05 -0.23 0.00 0.00 0.00 0.00 51.96 48.61 2bcj s ALA 92 Cb -0.03 -1.95 -0.01 0.00 0.00 0.00 0.00 23.12 21.13 2bcj s ALA 92 CO 0.04 -2.05 0.73 0.42 0.00 0.00 0.00 175.76 174.90 2bcj s ILE 93 N -0.38 4.93 0.25 0.00 1.01 0.07 -4.92 121.20 122.15 2bcj s ILE 93 Ca 0.23 1.37 -0.22 0.00 0.00 0.00 0.00 60.65 62.03 2bcj s ILE 93 Cb -0.12 -4.03 -0.09 0.00 0.01 0.00 0.00 42.46 38.23 2bcj s ILE 93 CO -0.10 0.01 0.80 -2.16 0.00 0.00 0.00 174.94 173.49 2bcj s PRO 94 N 2.43 4.38 0.24 2.79 0.04 -1.26 -0.34 135.00 143.28 2bcj s PRO 94 Ca 0.32 1.03 0.06 0.00 0.04 0.00 0.00 61.00 62.45 2bcj s PRO 94 Cb -0.16 -2.89 -0.03 0.00 0.04 0.00 0.00 34.50 31.46 2bcj s PRO 94 CO 0.09 0.37 0.25 -0.51 0.04 0.00 0.00 177.00 177.24 2bcj s LEU 95 N -1.93 3.98 0.14 -3.56 1.43 -0.99 -4.95 118.68 112.81 2bcj s LEU 95 Ca 0.45 -0.14 -0.01 0.00 -1.03 0.00 0.00 54.13 53.39 2bcj s LEU 95 Cb -0.18 -2.52 -0.08 0.00 0.03 0.00 0.00 46.19 43.45 2bcj s LEU 95 CO 0.22 -0.04 1.32 0.03 0.23 0.00 0.00 176.35 178.11 2bcj h ARG 96 N 1.44 0.29 -5.44 1.70 3.08 -1.98 -3.43 114.38 110.05 2bcj h ARG 96 Ca -0.50 -0.33 -0.64 0.00 0.07 0.00 0.00 59.98 58.58 2bcj h ARG 96 Cb 1.23 0.10 -0.18 0.00 0.08 0.00 0.00 29.97 31.20 2bcj h ARG 96 CO 0.61 1.05 -0.62 0.45 -1.07 0.00 0.00 179.97 180.38 2bcj s SER 97 N -7.01 5.15 0.24 7.04 0.15 -1.26 -5.00 113.70 113.00 2bcj s SER 97 Ca -0.04 -0.01 0.24 0.00 0.70 0.00 0.00 55.95 56.84 2bcj s SER 97 Cb 0.09 -1.77 0.93 0.00 -1.71 0.00 0.00 66.02 63.56 2bcj s SER 97 CO 0.85 0.22 1.72 -1.20 1.20 0.00 0.00 173.24 176.03 2bcj n SER 98 N 3.23 0.67 -2.56 5.45 7.64 -1.26 -4.18 113.62 122.61 2bcj n SER 98 Ca -0.17 0.64 -0.34 0.00 1.01 0.00 0.00 58.87 60.01 2bcj n SER 98 Cb 0.53 -0.79 0.03 0.00 -1.01 0.00 0.00 64.21 62.97 2bcj n SER 98 CO 0.00 0.00 0.00 0.79 -3.01 0.00 0.00 175.04 172.82 2bcj n TRP 99 N -2.21 2.64 -2.51 1.43 7.02 -1.26 -4.28 117.44 118.27 2bcj n TRP 99 Ca 0.03 -2.42 -0.40 0.00 -1.02 0.00 0.00 57.50 53.69 2bcj n TRP 99 Cb 0.28 -1.28 -0.04 0.00 -2.42 0.00 0.00 31.31 27.85 2bcj n TRP 99 CO 0.00 0.00 0.00 0.54 -2.02 0.00 0.00 177.69 176.21 2bcj s VAL 100 N -4.18 3.61 0.00 -0.99 0.11 -1.26 -1.80 120.40 115.89 2bcj s VAL 100 Ca 0.55 1.57 0.00 0.00 -2.93 0.00 0.00 61.98 61.17 2bcj s VAL 100 Cb 0.43 -4.00 0.00 0.00 -1.53 0.00 0.00 36.38 31.28 2bcj s VAL 100 CO -0.22 0.35 0.00 0.23 -3.33 0.00 0.00 175.10 172.13 2bcj n MET 101 N 1.46 2.72 -3.85 1.54 2.81 -0.11 -4.70 117.12 116.98 2bcj n MET 101 Ca -0.00 0.00 -0.09 0.00 -1.81 0.00 0.00 57.70 55.80 2bcj n MET 101 Cb 0.45 -0.71 -0.07 0.00 -0.71 0.00 0.00 33.22 32.18 2bcj n MET 101 CO 0.00 0.00 0.00 -0.08 1.51 0.00 0.00 175.97 177.40 2bcj s THR 102 N -1.22 0.14 0.12 2.03 -1.32 -0.96 -4.28 115.64 110.15 2bcj s THR 102 Ca 0.00 -1.14 -0.16 0.00 -1.21 0.00 0.00 61.69 59.19 2bcj s THR 102 Cb 0.00 -1.28 0.03 0.00 -1.51 0.00 0.00 72.50 69.74 2bcj s THR 102 CO 0.00 -0.63 0.39 0.00 -2.21 0.00 0.00 174.62 172.17 2bcj s ALA 104 N -3.76 -2.13 0.24 0.00 0.00 0.65 -4.61 121.76 112.14 2bcj s ALA 104 Ca 0.03 1.32 -0.30 0.00 0.00 0.00 0.00 51.96 53.00 2bcj s ALA 104 Cb 0.02 -2.27 -0.10 0.00 0.00 0.00 0.00 23.12 20.77 2bcj s ALA 104 CO -0.12 -1.56 1.49 -0.47 0.00 0.00 0.00 175.76 175.10 2bcj s TYR 105 N 2.80 2.99 0.58 0.00 6.14 -1.26 -1.29 117.35 127.31 2bcj s TYR 105 Ca 0.15 0.92 -0.17 0.00 0.64 0.00 0.00 57.07 58.61 2bcj s TYR 105 Cb -0.13 -3.88 -0.04 0.00 0.42 0.00 0.00 41.96 38.34 2bcj s TYR 105 CO -0.23 -2.94 1.08 0.00 0.64 0.00 0.00 175.55 174.09 2bcj s ALA 106 N 0.22 2.69 0.28 3.97 0.00 -0.61 -4.70 121.76 123.61 2bcj s ALA 106 Ca 0.62 0.53 0.21 0.00 0.00 0.00 0.00 51.96 53.32 2bcj s ALA 106 Cb -0.43 -3.27 0.96 0.00 0.00 0.00 0.00 23.12 20.38 2bcj s ALA 106 CO 0.42 -0.84 1.87 -1.35 0.00 0.00 0.00 175.76 175.86 2bcj h PRO 107 N 0.63 0.00 0.00 0.00 0.11 -1.88 -2.78 132.00 128.09 2bcj h PRO 107 Ca -0.48 0.00 -0.05 0.00 0.11 0.00 0.00 66.00 65.58 2bcj h PRO 107 Cb 1.23 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.34 2bcj h PRO 107 CO 0.57 0.27 -0.23 0.66 -0.21 0.00 0.00 178.00 179.06 2bcj h SER 108 N 0.00 0.00 0.00 -2.05 4.64 -1.92 -3.43 113.55 110.80 2bcj h SER 108 Ca -0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 2bcj h SER 108 Cb 0.65 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.74 2bcj h SER 108 CO 0.04 0.23 0.00 0.61 -0.87 0.00 0.00 176.83 176.84 2bcj n GLY 109 N -0.47 2.42 0.13 -0.77 0.00 -1.05 -4.86 105.19 100.60 2bcj n GLY 109 Ca -0.02 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 45.78 2bcj n GLY 109 CO 0.00 0.00 0.00 3.43 0.00 0.00 0.00 173.32 176.75 2bcj h ASN 110 N 0.00 0.53 -3.26 1.61 2.35 -1.91 -3.47 115.58 111.42 2bcj h ASN 110 Ca 0.00 -0.90 -0.65 0.00 -0.55 0.00 0.00 56.30 54.20 2bcj h ASN 110 Cb 0.00 -0.17 -0.11 0.00 0.05 0.00 0.00 38.32 38.09 2bcj h ASN 110 CO 0.00 1.65 -0.63 -0.31 -1.65 0.00 0.00 177.43 176.49 2bcj s TYR 111 N -2.52 3.10 0.03 1.19 4.12 -1.26 -1.36 117.35 120.66 2bcj s TYR 111 Ca -0.16 0.04 0.04 0.00 0.02 0.00 0.00 57.07 57.00 2bcj s TYR 111 Cb 0.04 -1.59 -0.02 0.00 -1.52 0.00 0.00 41.96 38.87 2bcj s TYR 111 CO 0.83 0.50 -0.11 0.14 0.02 0.00 0.00 175.55 176.93 2bcj s VAL 112 N -1.33 0.82 0.19 0.71 -7.23 -0.75 -1.57 120.40 111.24 2bcj s VAL 112 Ca 0.27 -0.91 0.10 0.00 -1.81 0.00 0.00 61.98 59.63 2bcj s VAL 112 Cb -0.12 -0.78 -0.04 0.00 0.56 0.00 0.00 36.38 36.00 2bcj s VAL 112 CO 0.19 -0.11 -0.21 0.00 -0.31 0.00 0.00 175.10 174.66 2bcj s ALA 113 N -0.92 2.34 0.35 1.32 0.00 -0.41 0.15 121.76 124.59 2bcj s ALA 113 Ca -0.02 -1.61 -0.15 0.00 0.00 0.00 0.00 51.96 50.18 2bcj s ALA 113 Cb -0.08 -0.26 0.04 0.00 0.00 0.00 0.00 23.12 22.82 2bcj s ALA 113 CO 0.01 0.32 0.71 0.00 0.00 0.00 0.00 175.76 176.80 2bcj n GLY 115 N -0.51 -0.63 0.00 0.00 0.00 -1.03 0.16 105.19 103.18 2bcj n GLY 115 Ca -0.06 -1.00 0.00 0.00 0.00 0.00 0.00 46.02 44.96 2bcj n GLY 115 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2bcj n GLY 116 N -0.14 1.13 0.04 -0.02 0.00 -1.25 -0.93 105.19 104.02 2bcj n GLY 116 Ca 0.00 -0.05 0.03 0.00 0.00 0.00 0.00 46.02 46.00 2bcj n GLY 116 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 2bcj n LEU 117 N 0.00 0.15 0.00 0.99 4.77 -0.74 -0.24 117.00 121.92 2bcj n LEU 117 Ca 0.00 0.57 0.00 0.00 -0.03 0.00 0.00 56.01 56.55 2bcj n LEU 117 Cb 0.00 -0.58 0.01 0.00 -2.33 0.00 0.00 43.42 40.52 2bcj n LEU 117 CO 0.00 -0.60 0.51 -0.90 -1.33 0.00 0.00 177.39 175.07 2bcj n ASP 118 N -1.70 0.00 -1.89 -1.43 5.68 -1.26 -4.83 116.55 111.12 2bcj n ASP 118 Ca -0.00 0.50 -0.18 0.00 -0.50 0.00 0.00 54.79 54.60 2bcj n ASP 118 Cb 0.02 -0.50 -0.05 0.00 -1.14 0.00 0.00 41.12 39.45 2bcj n ASP 118 CO 0.00 0.00 0.00 0.59 -1.33 0.00 0.00 177.20 176.46 2bcj n ASN 119 N -1.50 -5.05 -4.14 -1.12 4.13 0.66 -4.96 115.26 103.28 2bcj n ASN 119 Ca 0.00 0.29 -0.20 0.00 1.68 0.00 0.00 54.58 56.35 2bcj n ASN 119 Cb 0.01 -4.40 -0.13 0.00 -1.54 0.00 0.00 39.78 33.72 2bcj n ASN 119 CO 0.00 0.00 0.00 -0.63 0.28 0.00 0.00 177.26 176.91 2bcj s ILE 120 N -2.71 1.10 -0.69 2.41 1.01 -1.26 -4.22 121.20 116.84 2bcj s ILE 120 Ca 0.00 -0.96 -0.15 0.00 0.00 0.00 0.00 60.65 59.53 2bcj s ILE 120 Cb 0.00 -0.99 0.17 0.00 0.01 0.00 0.00 42.46 41.65 2bcj s ILE 120 CO 0.00 0.02 0.65 0.00 0.00 0.00 0.00 174.94 175.61 2bcj s SER 122 N 2.91 7.05 -0.19 0.00 0.01 0.12 -2.42 113.70 121.19 2bcj s SER 122 Ca 0.11 1.53 -0.10 0.00 1.31 0.00 0.00 55.95 58.80 2bcj s SER 122 Cb -0.20 -2.54 -0.05 0.00 0.21 0.00 0.00 66.02 63.44 2bcj s SER 122 CO -0.03 -0.68 0.15 -0.63 0.41 0.00 0.00 173.24 172.46 2bcj s ILE 123 N 3.15 5.41 0.09 1.44 1.09 -0.78 -0.89 121.20 130.71 2bcj s ILE 123 Ca 0.49 0.24 0.07 0.00 -1.10 0.00 0.00 60.65 60.35 2bcj s ILE 123 Cb -0.18 -3.48 -0.04 0.00 -1.06 0.00 0.00 42.46 37.70 2bcj s ILE 123 CO 0.11 0.45 -0.11 -0.31 -0.10 0.00 0.00 174.94 174.98 2bcj s TYR 124 N 0.21 2.72 -0.21 3.97 1.51 0.12 -0.76 117.35 124.92 2bcj s TYR 124 Ca 0.10 -0.16 -0.04 0.00 -1.01 0.00 0.00 57.07 55.96 2bcj s TYR 124 Cb -0.11 -1.45 -0.01 0.00 -0.11 0.00 0.00 41.96 40.28 2bcj s TYR 124 CO -0.01 0.40 -0.04 1.21 -1.11 0.00 0.00 175.55 176.00 2bcj s ASN 125 N -2.02 4.33 -0.10 2.29 2.47 -0.05 -1.81 114.94 120.05 2bcj s ASN 125 Ca 0.20 -0.37 -0.19 0.00 0.42 0.00 0.00 52.86 52.92 2bcj s ASN 125 Cb -0.11 -1.74 -0.28 0.00 -1.45 0.00 0.00 41.25 37.67 2bcj s ASN 125 CO 0.12 -0.00 0.64 -0.07 -3.72 0.00 0.00 177.10 174.06 2bcj h LEU 126 N 7.99 0.36 -7.86 3.21 3.38 -1.49 -3.10 115.31 117.80 2bcj h LEU 126 Ca -0.40 -0.87 -0.71 0.00 0.09 0.00 0.00 57.88 55.99 2bcj h LEU 126 Cb 1.16 -0.12 -0.17 0.00 0.09 0.00 0.00 40.66 41.63 2bcj h LEU 126 CO 0.60 1.51 1.13 -0.54 0.09 0.00 0.00 178.44 181.24 2bcj s LYS 127 N -2.44 3.84 0.47 1.13 1.02 -1.25 -4.65 119.74 117.86 2bcj s LYS 127 Ca -0.19 -2.14 -0.01 0.00 0.02 0.00 0.00 55.97 53.66 2bcj s LYS 127 Cb 0.03 -5.02 -0.00 0.00 -0.52 0.00 0.00 37.83 32.32 2bcj s LYS 127 CO 0.77 -1.80 0.70 0.99 -0.92 0.00 0.00 175.35 175.09 2bcj s THR 128 N 2.27 4.01 0.20 2.17 2.01 -1.26 -4.97 115.64 120.07 2bcj s THR 128 Ca 0.38 -0.41 -0.19 0.00 0.31 0.00 0.00 61.69 61.79 2bcj s THR 128 Cb -0.03 -3.50 0.16 0.00 0.01 0.00 0.00 72.50 69.14 2bcj s THR 128 CO -0.05 -0.37 1.59 -0.09 -0.69 0.00 0.00 174.62 175.01 2bcj h ARG 129 N 0.33 -0.12 -0.46 4.92 9.65 -1.95 -2.66 114.38 124.09 2bcj h ARG 129 Ca -0.46 0.01 0.00 0.00 -1.10 0.00 0.00 59.98 58.43 2bcj h ARG 129 Cb 1.25 0.03 0.00 0.00 -1.39 0.00 0.00 29.97 29.86 2bcj h ARG 129 CO 0.58 -0.08 0.00 0.39 2.80 0.00 0.00 179.97 183.66 2bcj n GLU 130 N -5.45 2.32 -0.97 0.20 1.02 -1.26 -4.94 120.64 111.56 2bcj n GLU 130 Ca 0.06 -2.03 0.00 0.00 -0.02 0.00 0.00 57.16 55.17 2bcj n GLU 130 Cb 0.36 -1.47 0.00 0.00 -0.02 0.00 0.00 31.44 30.31 2bcj n GLU 130 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 2bcj n GLY 131 N 1.42 0.42 3.94 0.62 0.00 -1.00 -5.02 105.19 105.57 2bcj n GLY 131 Ca 0.19 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.93 2bcj n GLY 131 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 2bcj s ASN 132 N -2.13 3.43 -0.92 1.61 -0.87 -1.26 -4.76 114.94 110.03 2bcj s ASN 132 Ca 0.00 0.15 -0.13 0.00 -1.57 0.00 0.00 52.86 51.31 2bcj s ASN 132 Cb 0.00 -0.28 0.23 0.00 -0.02 0.00 0.00 41.25 41.18 2bcj s ASN 132 CO 0.00 -2.52 0.89 0.68 -2.57 0.00 0.00 177.10 173.58 2bcj s VAL 133 N -3.72 5.69 0.01 1.60 -7.23 -1.26 -4.17 120.40 111.32 2bcj s VAL 133 Ca 0.72 -2.72 -0.00 0.00 -1.81 0.00 0.00 61.98 58.17 2bcj s VAL 133 Cb -0.04 -4.53 -0.04 0.00 0.56 0.00 0.00 36.38 32.33 2bcj s VAL 133 CO 0.51 -1.10 0.10 -0.60 -0.31 0.00 0.00 175.10 173.70 2bcj s ARG 134 N -0.13 3.11 -0.34 4.82 3.52 -1.17 -4.93 118.95 123.84 2bcj s ARG 134 Ca 0.23 -0.49 -0.25 0.00 -0.13 0.00 0.00 55.73 55.08 2bcj s ARG 134 Cb -0.10 -2.88 0.01 0.00 -1.56 0.00 0.00 34.95 30.42 2bcj s ARG 134 CO -0.09 0.63 0.88 0.08 -0.81 0.00 0.00 175.30 176.00 2bcj s VAL 135 N -1.27 4.67 0.03 7.11 1.01 -1.26 -0.87 120.40 129.82 2bcj s VAL 135 Ca 0.25 1.24 -0.19 0.00 0.00 0.00 0.00 61.98 63.28 2bcj s VAL 135 Cb -0.12 -4.26 -0.18 0.00 0.00 0.00 0.00 36.38 31.82 2bcj s VAL 135 CO 0.17 -0.40 1.22 0.28 0.00 0.00 0.00 175.10 176.37 2bcj h SER 136 N 8.27 0.51 -5.03 3.32 0.02 -1.26 -3.48 113.55 115.92 2bcj h SER 136 Ca -0.23 -0.63 -0.10 0.00 -0.84 0.00 0.00 61.79 59.99 2bcj h SER 136 Cb 1.08 -0.15 -0.18 0.00 0.14 0.00 0.00 62.40 63.29 2bcj h SER 136 CO 0.94 1.06 -0.21 -0.13 -1.14 0.00 0.00 176.83 177.35 2bcj s ARG 137 N -3.72 0.80 -0.56 3.45 1.81 -1.14 -5.01 118.95 114.58 2bcj s ARG 137 Ca -0.13 -0.34 -0.02 0.00 -1.72 0.00 0.00 55.73 53.52 2bcj s ARG 137 Cb 0.05 0.35 0.15 0.00 -0.45 0.00 0.00 34.95 35.04 2bcj s ARG 137 CO 0.80 -0.25 0.36 -1.21 -0.68 0.00 0.00 175.30 174.32 2bcj s GLU 138 N -2.06 2.35 -1.01 3.54 0.41 -1.26 -1.86 118.70 118.80 2bcj s GLU 138 Ca -0.08 -2.37 -0.23 0.00 -0.41 0.00 0.00 54.97 51.88 2bcj s GLU 138 Cb -0.02 -3.64 0.02 0.00 -1.78 0.00 0.00 34.13 28.70 2bcj s GLU 138 CO 0.00 -1.14 1.64 -0.51 -0.49 0.00 0.00 175.26 174.76 2bcj s LEU 139 N 0.20 3.41 0.06 1.80 1.43 -1.02 -4.94 118.68 119.61 2bcj s LEU 139 Ca 0.15 -1.30 0.02 0.00 -1.03 0.00 0.00 54.13 51.96 2bcj s LEU 139 Cb -0.21 -2.57 -0.04 0.00 0.03 0.00 0.00 46.19 43.40 2bcj s LEU 139 CO -0.03 -1.92 0.11 0.00 0.23 0.00 0.00 176.35 174.74 2bcj s ALA 140 N 6.70 3.67 0.00 4.21 0.00 -1.26 -2.18 121.76 132.89 2bcj s ALA 140 Ca 0.55 -0.95 0.00 0.00 0.00 0.00 0.00 51.96 51.56 2bcj s ALA 140 Cb -0.02 -1.55 0.00 0.00 0.00 0.00 0.00 23.12 21.55 2bcj s ALA 140 CO -0.05 0.76 0.00 0.41 0.00 0.00 0.00 175.76 176.88 2bcj n GLY 141 N 0.56 2.22 3.76 0.00 0.00 -1.26 -4.92 105.19 105.53 2bcj n GLY 141 Ca -0.09 -0.21 -0.41 0.00 0.00 0.00 0.00 46.02 45.31 2bcj n GLY 141 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 2bcj n HIS 142 N 0.00 2.80 -0.28 1.61 8.25 -1.26 -4.92 115.22 121.41 2bcj n HIS 142 Ca 0.00 0.47 0.09 0.00 -0.26 0.00 0.00 57.72 58.02 2bcj n HIS 142 Cb 0.00 -2.50 0.24 0.00 1.12 0.00 0.00 29.99 28.85 2bcj n HIS 142 CO 0.00 0.00 0.00 0.25 0.64 0.00 0.00 176.34 177.23 2bcj n THR 143 N 0.32 1.01 -4.13 1.59 -2.24 -1.26 -4.87 114.28 104.69 2bcj n THR 143 Ca 0.02 -1.00 -0.13 0.00 -2.27 0.00 0.00 64.05 60.67 2bcj n THR 143 Cb 0.39 0.50 -0.07 0.00 -2.10 0.00 0.00 70.33 69.04 2bcj n THR 143 CO 0.00 0.00 0.00 -0.83 -0.57 0.00 0.00 175.07 173.67 2bcj s GLY 144 N -1.00 1.33 0.35 3.38 0.00 -1.26 -4.77 107.32 105.35 2bcj s GLY 144 Ca 0.37 -1.49 -0.28 0.00 0.00 0.00 0.00 44.72 43.32 2bcj s GLY 144 CO 0.25 -1.10 1.46 1.58 0.00 0.00 0.00 173.10 175.29 2bcj n TYR 145 N -0.42 2.78 -2.39 1.90 0.18 -1.26 -4.27 117.16 113.67 2bcj n TYR 145 Ca 0.02 0.44 -0.43 0.00 1.88 0.00 0.00 57.90 59.80 2bcj n TYR 145 Cb 0.63 -2.51 -0.02 0.00 -0.38 0.00 0.00 39.34 37.06 2bcj n TYR 145 CO 0.00 0.00 0.00 -1.17 -2.08 0.00 0.00 176.86 173.61 2bcj s LEU 146 N -1.46 3.90 -0.01 -3.48 2.96 -0.89 0.19 118.68 119.88 2bcj s LEU 146 Ca 0.56 1.27 0.21 0.00 -0.22 0.00 0.00 54.13 55.95 2bcj s LEU 146 Cb -0.51 -3.54 -0.24 0.00 0.50 0.00 0.00 46.19 42.40 2bcj s LEU 146 CO 0.60 -1.08 0.55 -1.54 -1.32 0.00 0.00 176.35 173.56 2bcj n SER 147 N 7.64 0.25 0.00 3.68 3.41 -0.88 -3.81 113.62 123.91 2bcj n SER 147 Ca 0.15 0.10 0.00 0.00 -0.26 0.00 0.00 58.87 58.86 2bcj n SER 147 Cb 0.46 1.35 0.00 0.00 -0.26 0.00 0.00 64.21 65.76 2bcj n SER 147 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2bcj s ARG 150 N -0.72 0.21 0.15 0.00 1.81 0.01 -4.56 118.95 115.83 2bcj s ARG 150 Ca -0.03 0.05 -0.31 0.00 -1.72 0.00 0.00 55.73 53.72 2bcj s ARG 150 Cb -0.02 -0.35 -0.08 0.00 -0.45 0.00 0.00 34.95 34.05 2bcj s ARG 150 CO 0.03 -0.09 1.39 -0.06 -0.68 0.00 0.00 175.30 175.88 2bcj s PHE 151 N 0.73 3.22 -0.00 -0.53 0.40 -1.26 -1.34 117.98 119.20 2bcj s PHE 151 Ca -0.07 1.00 -0.17 0.00 -0.60 0.00 0.00 56.93 57.09 2bcj s PHE 151 Cb -0.10 -3.69 -0.34 0.00 0.51 0.00 0.00 43.02 39.40 2bcj s PHE 151 CO -0.01 -2.36 0.92 -0.07 0.70 0.00 0.00 175.22 174.40 2bcj h LEU 152 N 6.35 0.72 0.00 -0.37 3.38 -1.60 -3.44 115.31 120.35 2bcj h LEU 152 Ca -0.43 -0.93 0.00 0.00 0.09 0.00 0.00 57.88 56.61 2bcj h LEU 152 Cb 1.21 -0.23 0.00 0.00 0.09 0.00 0.00 40.66 41.73 2bcj h LEU 152 CO 0.84 1.64 0.00 -0.90 0.09 0.00 0.00 178.44 180.11 2bcj n ASP 153 N -3.82 0.00 0.18 -0.43 5.68 -1.12 -4.89 116.55 112.15 2bcj n ASP 153 Ca -0.17 -0.07 0.02 0.00 -0.50 0.00 0.00 54.79 54.07 2bcj n ASP 153 Cb 1.03 0.00 0.33 0.00 -1.14 0.00 0.00 41.12 41.34 2bcj n ASP 153 CO 0.00 0.00 0.00 0.44 -1.33 0.00 0.00 177.20 176.31 2bcj h ASP 154 N 0.00 0.00 -0.01 -1.12 3.32 -1.99 -3.34 116.42 113.28 2bcj h ASP 154 Ca 0.00 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.05 2bcj h ASP 154 Cb 0.00 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.55 2bcj h ASP 154 CO 0.00 0.40 -0.07 -3.20 -1.72 0.00 0.00 179.24 174.65 2bcj n ASN 155 N -4.06 1.43 -4.18 6.45 5.15 -1.26 -4.95 115.26 113.85 2bcj n ASN 155 Ca -0.02 -1.22 -0.22 0.00 -0.60 0.00 0.00 54.58 52.53 2bcj n ASN 155 Cb 0.43 0.21 -0.14 0.00 -0.53 0.00 0.00 39.78 39.75 2bcj n ASN 155 CO 0.00 0.00 0.00 -1.10 1.40 0.00 0.00 177.26 177.56 2bcj s GLN 156 N -0.92 1.10 -0.22 1.20 -0.21 -1.25 -0.22 119.66 119.15 2bcj s GLN 156 Ca 0.08 -0.81 -0.15 0.00 0.02 0.00 0.00 55.36 54.51 2bcj s GLN 156 Cb 0.07 -1.15 0.06 0.00 1.00 0.00 0.00 33.01 32.99 2bcj s GLN 156 CO 0.15 0.29 0.55 -1.50 -2.12 0.00 0.00 175.29 172.66 2bcj s ILE 157 N -0.80 -0.01 -0.07 1.08 2.07 -1.16 -1.43 121.20 120.88 2bcj s ILE 157 Ca 0.04 0.03 -0.09 0.00 -1.41 0.00 0.00 60.65 59.22 2bcj s ILE 157 Cb -0.08 -0.79 -0.05 0.00 0.13 0.00 0.00 42.46 41.67 2bcj s ILE 157 CO 0.01 0.01 0.24 -0.69 -1.91 0.00 0.00 174.94 172.60 2bcj s VAL 158 N 1.10 5.34 0.00 4.00 1.01 -0.45 -0.97 120.40 130.43 2bcj s VAL 158 Ca -0.06 0.41 0.02 0.00 0.00 0.00 0.00 61.98 62.34 2bcj s VAL 158 Cb -0.06 -3.52 -0.01 0.00 0.00 0.00 0.00 36.38 32.80 2bcj s VAL 158 CO -0.10 0.58 -0.06 0.42 0.00 0.00 0.00 175.10 175.94 2bcj s THR 159 N -1.07 0.48 0.21 3.92 -4.23 0.70 -0.81 115.64 114.84 2bcj s THR 159 Ca 0.19 -0.37 0.07 0.00 -1.18 0.00 0.00 61.69 60.40 2bcj s THR 159 Cb -0.14 -0.43 -0.04 0.00 1.34 0.00 0.00 72.50 73.24 2bcj s THR 159 CO 0.08 0.06 0.09 -0.94 -0.54 0.00 0.00 174.62 173.38 2bcj s SER 160 N -0.35 5.16 0.30 3.99 1.04 0.33 -0.59 113.70 123.59 2bcj s SER 160 Ca 0.01 -0.33 -0.05 0.00 0.48 0.00 0.00 55.95 56.06 2bcj s SER 160 Cb -0.03 -1.22 -0.00 0.00 0.10 0.00 0.00 66.02 64.87 2bcj s SER 160 CO -0.00 0.03 0.43 -0.55 0.98 0.00 0.00 173.24 174.13 2bcj s SER 161 N -3.39 0.60 0.00 7.02 0.15 -1.10 -2.07 113.70 114.92 2bcj s SER 161 Ca 0.31 -1.35 0.23 0.00 0.70 0.00 0.00 55.95 55.84 2bcj s SER 161 Cb -0.09 0.61 0.80 0.00 -1.71 0.00 0.00 66.02 65.64 2bcj s SER 161 CO 0.22 -1.20 1.59 0.61 1.20 0.00 0.00 173.24 175.66 2bcj n GLY 162 N -0.49 0.31 0.22 9.45 0.00 0.13 -0.69 105.19 114.12 2bcj n GLY 162 Ca 0.01 -0.45 0.06 0.00 0.00 0.00 0.00 46.02 45.63 2bcj n GLY 162 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 2bcj n ASP 163 N 0.38 0.65 -1.08 1.61 5.68 -1.26 -4.54 116.55 117.99 2bcj n ASP 163 Ca 0.17 -1.76 -0.11 0.00 -0.50 0.00 0.00 54.79 52.59 2bcj n ASP 163 Cb 0.36 -0.06 -0.02 0.00 -1.14 0.00 0.00 41.12 40.26 2bcj n ASP 163 CO 0.00 0.00 0.00 0.35 -1.33 0.00 0.00 177.20 176.22 2bcj n THR 164 N -0.25 -0.29 -4.22 2.12 -2.24 -1.24 -4.98 114.28 103.17 2bcj n THR 164 Ca 0.10 0.00 -0.13 0.00 -2.27 0.00 0.00 64.05 61.75 2bcj n THR 164 Cb 0.14 -1.58 -0.10 0.00 -2.10 0.00 0.00 70.33 66.68 2bcj n THR 164 CO 0.00 0.00 0.00 0.42 -0.57 0.00 0.00 175.07 174.92 2bcj s THR 165 N -2.49 1.00 0.49 4.28 -4.23 -1.26 -3.65 115.64 109.78 2bcj s THR 165 Ca 0.00 -2.02 0.06 0.00 -1.18 0.00 0.00 61.69 58.55 2bcj s THR 165 Cb 0.00 -1.80 0.00 0.00 1.34 0.00 0.00 72.50 72.05 2bcj s THR 165 CO 0.00 -0.78 0.33 0.00 -0.54 0.00 0.00 174.62 173.62 2bcj s ALA 167 N -2.69 -1.86 -0.07 0.00 0.00 0.24 -1.47 121.76 115.92 2bcj s ALA 167 Ca 0.36 2.07 -0.15 0.00 0.00 0.00 0.00 51.96 54.24 2bcj s ALA 167 Cb -0.01 -1.30 -0.05 0.00 0.00 0.00 0.00 23.12 21.76 2bcj s ALA 167 CO 0.22 -0.33 0.40 -1.17 0.00 0.00 0.00 175.76 174.88 2bcj s LEU 168 N 0.60 4.37 0.13 0.00 2.96 -0.57 -0.21 118.68 125.95 2bcj s LEU 168 Ca -0.01 0.82 0.10 0.00 -0.22 0.00 0.00 54.13 54.81 2bcj s LEU 168 Cb -0.05 -2.56 -0.04 0.00 0.50 0.00 0.00 46.19 44.04 2bcj s LEU 168 CO -0.05 0.19 -0.20 0.26 -1.32 0.00 0.00 176.35 175.24 2bcj s TRP 169 N -0.30 2.47 -0.41 5.38 0.52 -0.14 -0.45 118.94 126.01 2bcj s TRP 169 Ca 0.23 -0.30 -0.11 0.00 0.02 0.00 0.00 56.10 55.94 2bcj s TRP 169 Cb -0.15 -1.30 0.06 0.00 -1.15 0.00 0.00 33.47 30.92 2bcj s TRP 169 CO 0.10 0.39 0.26 0.34 0.02 0.00 0.00 176.95 178.06 2bcj s ASP 170 N -2.22 5.75 0.42 2.95 3.68 -0.69 -3.01 116.67 123.55 2bcj s ASP 170 Ca 0.18 -1.28 0.14 0.00 2.13 0.00 0.00 52.55 53.71 2bcj s ASP 170 Cb -0.10 -2.03 1.00 0.00 -1.45 0.00 0.00 42.92 40.34 2bcj s ASP 170 CO 0.09 -0.49 1.93 0.40 0.13 0.00 0.00 175.17 177.23 2bcj h ILE 171 N 5.95 0.84 0.97 4.11 2.04 -0.91 0.11 117.51 130.62 2bcj h ILE 171 Ca -0.25 -0.16 -0.05 0.00 1.00 0.00 0.00 64.86 65.40 2bcj h ILE 171 Cb 1.09 0.33 0.01 0.00 -0.74 0.00 0.00 36.82 37.51 2bcj h ILE 171 CO 0.74 0.09 -0.46 -0.08 0.00 0.00 0.00 178.15 178.43 2bcj h GLU 172 N 0.47 -1.25 0.00 2.37 4.57 -1.95 -3.11 114.58 115.69 2bcj h GLU 172 Ca 0.35 0.09 0.00 0.00 -1.18 0.00 0.00 59.36 58.62 2bcj h GLU 172 Cb 0.72 0.28 0.00 0.00 -0.16 0.00 0.00 28.75 29.59 2bcj h GLU 172 CO -0.12 -0.83 0.00 1.79 -1.18 0.00 0.00 179.01 178.67 2bcj h THR 173 N -1.33 0.00 -2.82 0.32 1.35 -1.77 -3.46 112.91 105.21 2bcj h THR 173 Ca -0.13 -0.34 -0.40 0.00 -0.55 0.00 0.00 66.41 64.98 2bcj h THR 173 Cb 0.99 1.17 -0.02 0.00 -1.73 0.00 0.00 68.15 68.56 2bcj h THR 173 CO 0.22 0.00 -0.51 0.61 -0.25 0.00 0.00 175.52 175.58 2bcj n GLY 174 N 0.30 -0.38 3.16 5.82 0.00 0.32 -4.97 105.19 109.44 2bcj n GLY 174 Ca 0.03 -0.03 -0.22 0.00 0.00 0.00 0.00 46.02 45.79 2bcj n GLY 174 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 2bcj s GLN 175 N -4.96 1.11 -0.64 1.61 2.00 -1.20 -4.61 119.66 112.96 2bcj s GLN 175 Ca 0.00 -0.74 -0.27 0.00 -2.00 0.00 0.00 55.36 52.36 2bcj s GLN 175 Cb 0.00 -1.12 -0.01 0.00 0.80 0.00 0.00 33.01 32.67 2bcj s GLN 175 CO 0.00 0.29 1.77 -0.65 -0.50 0.00 0.00 175.29 176.19 2bcj s GLN 176 N -0.93 2.72 0.09 1.67 -0.21 -1.26 -1.71 119.66 120.03 2bcj s GLN 176 Ca 0.04 0.45 -0.31 0.00 0.02 0.00 0.00 55.36 55.56 2bcj s GLN 176 Cb -0.07 -4.37 -0.13 0.00 1.00 0.00 0.00 33.01 29.44 2bcj s GLN 176 CO 0.01 -2.65 1.49 1.15 -2.12 0.00 0.00 175.29 173.17 2bcj h THR 177 N 6.75 0.00 -3.43 -0.19 2.02 -1.07 -3.44 112.91 113.55 2bcj h THR 177 Ca -0.26 0.00 -0.56 0.00 0.77 0.00 0.00 66.41 66.36 2bcj h THR 177 Cb 1.14 0.00 -0.19 0.00 -1.74 0.00 0.00 68.15 67.36 2bcj h THR 177 CO 1.23 0.00 -0.80 -0.89 0.37 0.00 0.00 175.52 175.43 2bcj s THR 178 N -5.46 1.91 -0.11 3.16 2.01 -1.16 -5.00 115.64 110.99 2bcj s THR 178 Ca -0.15 -1.85 0.01 0.00 0.31 0.00 0.00 61.69 60.01 2bcj s THR 178 Cb 0.05 -1.84 0.02 0.00 0.01 0.00 0.00 72.50 70.74 2bcj s THR 178 CO 0.54 -0.21 -0.15 -0.89 -0.69 0.00 0.00 174.62 173.21 2bcj s THR 179 N -1.76 1.51 -0.98 -0.82 2.01 -1.26 -1.52 115.64 112.82 2bcj s THR 179 Ca 0.15 -0.64 -0.10 0.00 0.31 0.00 0.00 61.69 61.41 2bcj s THR 179 Cb -0.07 -1.39 0.25 0.00 0.01 0.00 0.00 72.50 71.30 2bcj s THR 179 CO 0.07 0.44 0.94 -0.36 -0.69 0.00 0.00 174.62 175.02 2bcj s PHE 180 N 1.07 4.04 0.24 4.92 0.40 -0.54 -4.95 117.98 123.15 2bcj s PHE 180 Ca -0.05 -2.49 -0.09 0.00 -0.60 0.00 0.00 56.93 53.70 2bcj s PHE 180 Cb -0.15 -3.75 -0.07 0.00 0.51 0.00 0.00 43.02 39.56 2bcj s PHE 180 CO -0.03 -0.94 0.55 0.95 0.70 0.00 0.00 175.22 176.45 2bcj s THR 181 N -0.75 4.95 0.00 0.64 -4.23 -1.26 -1.75 115.64 113.24 2bcj s THR 181 Ca 0.26 0.41 0.00 0.00 -1.18 0.00 0.00 61.69 61.17 2bcj s THR 181 Cb -0.10 -3.63 0.00 0.00 1.34 0.00 0.00 72.50 70.11 2bcj s THR 181 CO -0.09 -0.10 0.00 0.61 -0.54 0.00 0.00 174.62 174.50 2bcj n GLY 182 N -0.24 1.18 3.73 3.99 0.00 -1.26 -4.83 105.19 107.76 2bcj n GLY 182 Ca 0.00 -0.03 -0.37 0.00 0.00 0.00 0.00 46.02 45.63 2bcj n GLY 182 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 2bcj s HIS 183 N 0.00 2.06 -0.21 1.61 3.76 -1.24 -4.94 115.29 116.33 2bcj s HIS 183 Ca 0.00 1.50 0.14 0.00 -0.15 0.00 0.00 55.06 56.56 2bcj s HIS 183 Cb 0.00 -3.67 0.49 0.00 1.11 0.00 0.00 32.58 30.51 2bcj s HIS 183 CO 0.00 -2.90 1.40 0.25 -0.85 0.00 0.00 174.74 172.64 2bcj n THR 184 N -2.03 2.32 -3.83 1.30 -2.24 -1.26 -4.82 114.28 103.72 2bcj n THR 184 Ca 0.16 -2.22 -0.09 0.00 -2.27 0.00 0.00 64.05 59.62 2bcj n THR 184 Cb 0.48 -0.28 -0.04 0.00 -2.10 0.00 0.00 70.33 68.40 2bcj n THR 184 CO 0.00 0.00 0.00 -0.83 -0.57 0.00 0.00 175.07 173.67 2bcj s GLY 185 N -2.26 0.10 0.19 3.38 0.00 -1.26 -4.73 107.32 102.73 2bcj s GLY 185 Ca 0.42 -0.44 -0.33 0.00 0.00 0.00 0.00 44.72 44.37 2bcj s GLY 185 CO 0.05 -0.38 1.59 1.22 0.00 0.00 0.00 173.10 175.58 2bcj n ASP 186 N -0.35 3.31 -4.55 1.64 8.00 -1.26 -4.09 116.55 119.24 2bcj n ASP 186 Ca -0.07 1.09 -0.43 0.00 0.71 0.00 0.00 54.79 56.09 2bcj n ASP 186 Cb 0.62 -1.47 -0.05 0.00 -0.02 0.00 0.00 41.12 40.20 2bcj n ASP 186 CO 0.00 0.00 0.00 -0.69 -0.39 0.00 0.00 177.20 176.12 2bcj s VAL 187 N 0.76 4.54 -0.03 2.53 1.01 0.13 -1.25 120.40 128.10 2bcj s VAL 187 Ca 0.75 0.60 0.11 0.00 0.00 0.00 0.00 61.98 63.45 2bcj s VAL 187 Cb -0.62 -4.39 -0.08 0.00 0.00 0.00 0.00 36.38 31.28 2bcj s VAL 187 CO 0.39 -0.79 1.30 0.24 0.00 0.00 0.00 175.10 176.23 2bcj h MET 188 N 9.05 0.00 -3.09 2.72 2.86 -1.05 -3.32 114.93 122.09 2bcj h MET 188 Ca -0.24 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.40 2bcj h MET 188 Cb 1.08 0.00 -0.10 0.00 0.06 0.00 0.00 31.60 32.64 2bcj h MET 188 CO 1.00 0.71 0.16 0.45 1.06 0.00 0.00 176.91 180.29 2bcj s SER 189 N -6.51 -0.40 0.32 1.22 0.15 -1.01 -4.56 113.70 102.91 2bcj s SER 189 Ca 0.02 -0.29 -0.11 0.00 0.70 0.00 0.00 55.95 56.27 2bcj s SER 189 Cb 0.09 0.63 0.02 0.00 -1.71 0.00 0.00 66.02 65.04 2bcj s SER 189 CO 0.79 -1.09 0.58 -1.48 1.20 0.00 0.00 173.24 173.24 2bcj s LEU 190 N -2.83 0.43 -0.30 3.45 0.05 -1.26 -1.58 118.68 116.64 2bcj s LEU 190 Ca 0.06 -1.15 -0.12 0.00 0.05 0.00 0.00 54.13 52.96 2bcj s LEU 190 Cb -0.02 2.03 0.13 0.00 -2.05 0.00 0.00 46.19 46.28 2bcj s LEU 190 CO -0.05 -1.36 0.74 -0.55 -0.55 0.00 0.00 176.35 174.58 2bcj s SER 191 N -3.10 -0.96 0.17 1.48 0.15 -0.01 -4.76 113.70 106.66 2bcj s SER 191 Ca 0.22 1.37 -0.30 0.00 0.70 0.00 0.00 55.95 57.94 2bcj s SER 191 Cb -0.02 1.95 -0.07 0.00 -1.71 0.00 0.00 66.02 66.17 2bcj s SER 191 CO 0.13 -0.20 1.01 -0.76 1.20 0.00 0.00 173.24 174.63 2bcj s LEU 192 N 2.49 4.53 0.64 3.45 1.43 -1.26 -1.32 118.68 128.63 2bcj s LEU 192 Ca -0.06 1.95 -0.14 0.00 -1.03 0.00 0.00 54.13 54.85 2bcj s LEU 192 Cb -0.09 -3.60 -0.02 0.00 0.03 0.00 0.00 46.19 42.51 2bcj s LEU 192 CO -0.19 -0.07 1.06 0.00 0.23 0.00 0.00 176.35 177.38 2bcj s ALA 193 N -0.38 2.72 0.24 4.21 0.00 -0.63 -4.74 121.76 123.19 2bcj s ALA 193 Ca 0.46 0.25 -0.10 0.00 0.00 0.00 0.00 51.96 52.57 2bcj s ALA 193 Cb -0.26 -3.20 0.36 0.00 0.00 0.00 0.00 23.12 20.01 2bcj s ALA 193 CO 0.32 -0.98 1.60 -1.00 0.00 0.00 0.00 175.76 175.71 2bcj h PRO 194 N -0.05 0.01 -6.41 0.00 0.13 -1.88 -3.27 132.00 120.52 2bcj h PRO 194 Ca -0.45 -0.00 -0.57 0.00 -0.87 0.00 0.00 66.00 64.11 2bcj h PRO 194 Cb 1.21 -0.00 -0.04 0.00 0.13 0.00 0.00 31.00 32.30 2bcj h PRO 194 CO 0.57 0.00 1.09 -0.51 -0.23 0.00 0.00 178.00 178.92 2bcj s ASP 195 N -5.23 6.36 0.00 1.44 1.11 -1.26 -4.89 116.67 114.20 2bcj s ASP 195 Ca -0.14 1.13 0.02 0.00 0.18 0.00 0.00 52.55 53.73 2bcj s ASP 195 Cb 0.23 -2.54 0.12 0.00 1.07 0.00 0.00 42.92 41.81 2bcj s ASP 195 CO 0.76 -1.36 0.48 0.35 1.18 0.00 0.00 175.17 176.58 2bcj n THR 196 N 6.80 0.00 0.74 -1.27 -2.24 -1.24 -2.63 114.28 114.44 2bcj n THR 196 Ca 0.17 0.00 0.13 0.00 -2.27 0.00 0.00 64.05 62.08 2bcj n THR 196 Cb 0.47 -0.79 0.38 0.00 -2.10 0.00 0.00 70.33 68.29 2bcj n THR 196 CO 0.00 0.00 0.00 -2.11 -0.57 0.00 0.00 175.07 172.39 2bcj n ARG 197 N -0.84 0.18 -4.26 -0.78 1.85 -1.26 -4.75 116.66 106.79 2bcj n ARG 197 Ca 0.02 0.11 -0.20 0.00 -1.00 0.00 0.00 57.85 56.77 2bcj n ARG 197 Cb 0.01 -1.67 -0.12 0.00 -1.05 0.00 0.00 32.46 29.62 2bcj n ARG 197 CO 0.00 0.00 0.00 -0.51 -0.01 0.00 0.00 177.63 177.11 2bcj s LEU 198 N -3.95 2.25 -0.04 2.89 1.43 -1.08 -1.16 118.68 119.03 2bcj s LEU 198 Ca 0.10 -0.60 -0.14 0.00 -1.03 0.00 0.00 54.13 52.46 2bcj s LEU 198 Cb 0.15 -0.65 0.03 0.00 0.03 0.00 0.00 46.19 45.74 2bcj s LEU 198 CO 0.62 -0.01 0.32 0.72 0.23 0.00 0.00 176.35 178.24 2bcj s PHE 199 N -1.13 -0.23 0.28 0.29 -0.12 -1.00 -1.60 117.98 114.47 2bcj s PHE 199 Ca 0.01 0.43 0.07 0.00 -0.05 0.00 0.00 56.93 57.39 2bcj s PHE 199 Cb -0.09 0.11 -0.03 0.00 -0.63 0.00 0.00 43.02 42.37 2bcj s PHE 199 CO 0.03 -0.35 0.26 0.14 -0.05 0.00 0.00 175.22 175.25 2bcj s VAL 200 N -0.97 4.31 -0.06 -2.49 -7.23 -0.44 -0.35 120.40 113.17 2bcj s VAL 200 Ca -0.10 -1.32 -0.07 0.00 -1.81 0.00 0.00 61.98 58.68 2bcj s VAL 200 Cb -0.05 -3.41 0.02 0.00 0.56 0.00 0.00 36.38 33.50 2bcj s VAL 200 CO 0.03 -0.29 0.19 -0.94 -0.31 0.00 0.00 175.10 173.78 2bcj s SER 201 N -3.92 -0.18 -0.01 4.85 1.04 -0.93 -0.83 113.70 113.73 2bcj s SER 201 Ca 0.36 0.32 0.03 0.00 0.48 0.00 0.00 55.95 57.14 2bcj s SER 201 Cb -0.08 0.38 -0.03 0.00 0.10 0.00 0.00 66.02 66.39 2bcj s SER 201 CO 0.26 -0.11 -0.09 -0.83 0.98 0.00 0.00 173.24 173.45 2bcj s GLY 202 N -0.10 1.69 0.33 7.32 0.00 -0.61 -1.89 107.32 114.05 2bcj s GLY 202 Ca -0.02 -1.02 0.05 0.00 0.00 0.00 0.00 44.72 43.73 2bcj s GLY 202 CO 0.01 -0.86 0.21 0.00 0.00 0.00 0.00 173.10 172.45 2bcj s ALA 203 N -0.92 2.04 -0.65 3.20 0.00 -1.00 -0.55 121.76 123.88 2bcj s ALA 203 Ca 0.15 -1.80 0.25 0.00 0.00 0.00 0.00 51.96 50.56 2bcj s ALA 203 Cb -0.11 1.26 0.70 0.00 0.00 0.00 0.00 23.12 24.97 2bcj s ALA 203 CO 0.05 -0.56 1.73 0.00 0.00 0.00 0.00 175.76 176.99 2bcj n ASP 205 N -2.49 0.13 -3.75 0.00 5.68 -1.26 -4.22 116.55 110.65 2bcj n ASP 205 Ca 0.05 -0.84 -0.27 0.00 -0.50 0.00 0.00 54.79 53.24 2bcj n ASP 205 Cb 0.45 -0.07 0.05 0.00 -1.14 0.00 0.00 41.12 40.42 2bcj n ASP 205 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 2bcj n ALA 206 N -0.25 -1.36 -2.98 2.12 0.00 -1.19 -4.98 120.51 111.88 2bcj n ALA 206 Ca 0.00 0.27 -0.11 0.00 0.00 0.00 0.00 53.44 53.60 2bcj n ALA 206 Cb 0.03 -4.79 -0.07 0.00 0.00 0.00 0.00 19.45 14.63 2bcj n ALA 206 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.50 175.96 2bcj s SER 207 N -3.40 -0.12 0.25 0.00 1.04 -1.26 -4.24 113.70 105.97 2bcj s SER 207 Ca 0.58 -0.23 0.11 0.00 0.48 0.00 0.00 55.95 56.89 2bcj s SER 207 Cb -0.27 0.37 -0.05 0.00 0.10 0.00 0.00 66.02 66.17 2bcj s SER 207 CO 0.78 -0.64 -0.15 0.00 0.98 0.00 0.00 173.24 174.21 2bcj s ALA 208 N -2.74 2.82 -0.03 5.32 0.00 -0.83 -2.37 121.76 123.95 2bcj s ALA 208 Ca -0.04 -1.73 -0.01 0.00 0.00 0.00 0.00 51.96 50.18 2bcj s ALA 208 Cb -0.00 -0.45 0.02 0.00 0.00 0.00 0.00 23.12 22.70 2bcj s ALA 208 CO -0.04 0.33 0.06 0.15 0.00 0.00 0.00 175.76 176.25 2bcj s LYS 209 N -3.29 0.01 -0.17 0.00 1.02 -0.79 -1.34 119.74 115.18 2bcj s LYS 209 Ca 0.28 0.19 -0.23 0.00 0.02 0.00 0.00 55.97 56.23 2bcj s LYS 209 Cb -0.06 -0.16 -0.02 0.00 -0.52 0.00 0.00 37.83 37.07 2bcj s LYS 209 CO 0.15 -0.12 0.73 -1.17 -0.92 0.00 0.00 175.35 174.02 2bcj s LEU 210 N 0.79 4.18 0.11 3.17 2.96 -0.31 -2.18 118.68 127.40 2bcj s LEU 210 Ca -0.06 1.04 0.06 0.00 -0.22 0.00 0.00 54.13 54.94 2bcj s LEU 210 Cb -0.09 -3.08 -0.04 0.00 0.50 0.00 0.00 46.19 43.48 2bcj s LEU 210 CO -0.03 -0.31 -0.04 0.26 -1.32 0.00 0.00 176.35 174.91 2bcj s TRP 211 N 1.89 2.86 -0.48 5.38 0.52 0.53 -0.29 118.94 129.35 2bcj s TRP 211 Ca 0.34 -0.10 -0.17 0.00 0.02 0.00 0.00 56.10 56.20 2bcj s TRP 211 Cb -0.16 -1.47 0.07 0.00 -1.15 0.00 0.00 33.47 30.75 2bcj s TRP 211 CO 0.12 0.46 0.48 0.34 0.02 0.00 0.00 176.95 178.38 2bcj s ASP 212 N -2.35 6.18 0.14 2.95 3.68 -0.34 -2.36 116.67 124.56 2bcj s ASP 212 Ca 0.24 -1.16 -0.20 0.00 2.13 0.00 0.00 52.55 53.56 2bcj s ASP 212 Cb -0.11 -2.22 -0.00 0.00 -1.45 0.00 0.00 42.92 39.13 2bcj s ASP 212 CO 0.16 -0.74 1.69 0.58 0.13 0.00 0.00 175.17 176.99 2bcj h VAL 213 N 5.79 0.70 -0.32 1.11 2.07 -1.43 0.42 116.25 124.59 2bcj h VAL 213 Ca -0.28 0.00 0.04 0.00 0.82 0.00 0.00 66.70 67.28 2bcj h VAL 213 Cb 1.10 0.70 -0.06 0.00 -1.52 0.00 0.00 31.29 31.52 2bcj h VAL 213 CO 0.91 0.00 -0.37 0.03 0.02 0.00 0.00 177.57 178.15 2bcj h ARG 214 N -0.06 -0.22 0.00 1.57 2.47 -1.89 -3.34 114.38 112.91 2bcj h ARG 214 Ca 0.11 0.02 -0.15 0.00 -1.26 0.00 0.00 59.98 58.70 2bcj h ARG 214 Cb 0.23 0.05 -0.02 0.00 -1.65 0.00 0.00 29.97 28.58 2bcj h ARG 214 CO -0.25 -0.15 -0.98 0.93 0.56 0.00 0.00 179.97 180.08 2bcj h GLU 215 N -0.23 0.00 0.00 0.04 4.39 -1.88 -3.50 114.58 113.41 2bcj h GLU 215 Ca 0.06 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.76 2bcj h GLU 215 Cb 0.38 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.03 2bcj h GLU 215 CO -0.43 0.69 0.00 0.41 -1.16 0.00 0.00 179.01 178.52 2bcj n GLY 216 N 1.50 1.98 3.55 -3.84 0.00 0.15 -5.01 105.19 103.50 2bcj n GLY 216 Ca -0.24 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.51 2bcj n GLY 216 CO 0.00 0.00 0.00 -3.16 0.00 0.00 0.00 173.32 170.16 2bcj s MET 217 N -0.29 1.97 -0.26 1.61 0.23 -1.24 -4.73 119.30 116.58 2bcj s MET 217 Ca 0.00 -1.26 -0.26 0.00 -1.03 0.00 0.00 55.69 53.14 2bcj s MET 217 Cb 0.00 -2.14 0.00 0.00 -1.53 0.00 0.00 34.83 31.17 2bcj s MET 217 CO 0.00 0.44 0.91 0.00 -2.03 0.00 0.00 175.02 174.35 2bcj h ARG 219 N 7.76 0.20 -3.85 0.00 3.08 -1.00 -3.49 114.38 117.10 2bcj h ARG 219 Ca -0.22 -0.35 -0.14 0.00 0.07 0.00 0.00 59.98 59.34 2bcj h ARG 219 Cb 1.08 0.13 -0.19 0.00 0.08 0.00 0.00 29.97 31.07 2bcj h ARG 219 CO 0.93 1.17 -0.59 -0.65 -1.07 0.00 0.00 179.97 179.76 2bcj s GLN 220 N -2.45 0.49 -0.07 0.04 -0.21 -1.22 -5.00 119.66 111.23 2bcj s GLN 220 Ca -0.21 -0.69 0.01 0.00 0.02 0.00 0.00 55.36 54.49 2bcj s GLN 220 Cb 0.04 0.19 0.02 0.00 1.00 0.00 0.00 33.01 34.26 2bcj s GLN 220 CO 0.74 -0.11 -0.08 0.99 -2.12 0.00 0.00 175.29 174.71 2bcj s THR 221 N -2.18 0.91 -0.07 -0.19 2.01 -1.26 -1.16 115.64 113.69 2bcj s THR 221 Ca -0.09 -0.30 0.01 0.00 0.31 0.00 0.00 61.69 61.62 2bcj s THR 221 Cb -0.04 -0.89 -0.03 0.00 0.01 0.00 0.00 72.50 71.55 2bcj s THR 221 CO -0.03 0.32 -0.08 -0.36 -0.69 0.00 0.00 174.62 173.78 2bcj s PHE 222 N 1.11 2.91 0.42 4.92 0.40 -0.45 -4.99 117.98 122.30 2bcj s PHE 222 Ca -0.07 -0.05 0.04 0.00 -0.60 0.00 0.00 56.93 56.25 2bcj s PHE 222 Cb -0.14 -1.72 -0.01 0.00 0.51 0.00 0.00 43.02 41.65 2bcj s PHE 222 CO -0.01 0.26 0.14 0.25 0.70 0.00 0.00 175.22 176.56 2bcj n THR 223 N 2.39 0.00 0.00 0.64 -2.24 -1.26 -1.96 114.28 111.85 2bcj n THR 223 Ca -0.18 -2.42 0.00 0.00 -2.27 0.00 0.00 64.05 59.18 2bcj n THR 223 Cb 0.53 0.84 0.00 0.00 -2.10 0.00 0.00 70.33 69.60 2bcj n THR 223 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2bcj n GLY 224 N -0.87 1.29 3.75 3.38 0.00 -1.26 -4.86 105.19 106.62 2bcj n GLY 224 Ca -0.07 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.54 2bcj n GLY 224 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 2bcj s HIS 225 N -0.19 3.42 -2.21 1.61 3.76 -1.26 -4.94 115.29 115.48 2bcj s HIS 225 Ca 0.00 1.51 0.25 0.00 -0.15 0.00 0.00 55.06 56.67 2bcj s HIS 225 Cb 0.00 -3.42 1.21 0.00 1.11 0.00 0.00 32.58 31.48 2bcj s HIS 225 CO 0.00 -1.10 1.82 0.39 -0.85 0.00 0.00 174.74 175.00 2bcj n GLU 226 N 1.86 1.37 -3.28 1.40 1.02 -1.26 -4.84 120.64 116.90 2bcj n GLU 226 Ca 0.02 -0.54 -0.09 0.00 -0.02 0.00 0.00 57.16 56.53 2bcj n GLU 226 Cb 0.44 -1.42 0.01 0.00 -0.02 0.00 0.00 31.44 30.44 2bcj n GLU 226 CO 0.00 0.00 0.00 0.45 1.18 0.00 0.00 177.13 178.76 2bcj n SER 227 N -0.30 -1.56 -4.53 1.62 2.88 -1.26 -4.92 113.62 105.55 2bcj n SER 227 Ca 0.19 -2.34 -0.47 0.00 -1.33 0.00 0.00 58.87 54.91 2bcj n SER 227 Cb 0.22 2.67 -0.03 0.00 -0.75 0.00 0.00 64.21 66.32 2bcj n SER 227 CO 0.00 0.00 0.00 0.47 -1.23 0.00 0.00 175.04 174.28 2bcj n ASP 228 N -1.52 0.58 -4.60 -3.46 8.00 -1.26 -4.22 116.55 110.07 2bcj n ASP 228 Ca -0.04 1.16 -0.41 0.00 0.71 0.00 0.00 54.79 56.20 2bcj n ASP 228 Cb 0.47 -1.16 -0.07 0.00 -0.02 0.00 0.00 41.12 40.34 2bcj n ASP 228 CO 0.00 0.00 0.00 -0.63 -0.39 0.00 0.00 177.20 176.18 2bcj s ILE 229 N -0.75 4.95 -0.12 0.53 1.01 0.25 -1.11 121.20 125.97 2bcj s ILE 229 Ca 0.66 0.81 0.17 0.00 0.00 0.00 0.00 60.65 62.29 2bcj s ILE 229 Cb -0.83 -3.99 -0.20 0.00 0.01 0.00 0.00 42.46 37.45 2bcj s ILE 229 CO 0.57 -0.13 0.57 0.59 0.00 0.00 0.00 174.94 176.54 2bcj n ASN 230 N 5.85 0.53 -3.62 3.58 3.02 0.40 -3.76 115.26 121.26 2bcj n ASN 230 Ca -0.02 0.24 -0.15 0.00 -0.03 0.00 0.00 54.58 54.63 2bcj n ASN 230 Cb 0.49 0.59 -0.06 0.00 -0.61 0.00 0.00 39.78 40.18 2bcj n ASN 230 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2bcj s ALA 231 N -2.86 -1.27 -0.20 5.41 0.00 -1.10 -4.46 121.76 117.29 2bcj s ALA 231 Ca -0.06 0.69 -0.22 0.00 0.00 0.00 0.00 51.96 52.37 2bcj s ALA 231 Cb 0.09 0.19 0.06 0.00 0.00 0.00 0.00 23.12 23.46 2bcj s ALA 231 CO 0.83 -0.40 0.61 -1.50 0.00 0.00 0.00 175.76 175.30 2bcj s ILE 232 N -1.82 0.00 0.14 0.00 2.07 -1.26 0.98 121.20 121.32 2bcj s ILE 232 Ca -0.09 -0.02 -0.24 0.00 -1.41 0.00 0.00 60.65 58.89 2bcj s ILE 232 Cb -0.02 -0.87 0.07 0.00 0.13 0.00 0.00 42.46 41.78 2bcj s ILE 232 CO 0.03 -0.01 0.65 0.00 -1.91 0.00 0.00 174.94 173.70 2bcj s PHE 234 N -3.67 3.79 0.30 0.00 0.08 -1.26 -1.08 117.98 116.14 2bcj s PHE 234 Ca 0.02 1.83 -0.29 0.00 0.12 0.00 0.00 56.93 58.61 2bcj s PHE 234 Cb -0.01 -2.94 -0.10 0.00 -0.57 0.00 0.00 43.02 39.40 2bcj s PHE 234 CO -0.11 0.29 1.24 0.12 -0.10 0.00 0.00 175.22 176.66 2bcj s PHE 235 N -1.47 3.26 0.22 0.36 5.36 -0.15 -4.78 117.98 120.78 2bcj s PHE 235 Ca 0.47 1.49 -0.00 0.00 -0.96 0.00 0.00 56.93 57.92 2bcj s PHE 235 Cb -0.21 -3.53 0.49 0.00 -0.34 0.00 0.00 43.02 39.43 2bcj s PHE 235 CO 0.26 -1.41 1.11 -2.30 -1.46 0.00 0.00 175.22 171.42 2bcj n PRO 236 N 1.19 -0.06 -0.00 10.12 -0.02 -1.26 -0.89 135.00 144.07 2bcj n PRO 236 Ca 0.00 1.07 -0.09 0.00 -2.02 0.00 0.00 63.50 62.47 2bcj n PRO 236 Cb 0.43 -1.68 0.08 0.00 -0.02 0.00 0.00 33.50 32.31 2bcj n PRO 236 CO 0.00 0.00 0.00 -2.95 1.98 0.00 0.00 175.50 174.53 2bcj h ASN 237 N 0.00 0.62 0.00 2.55 7.08 -1.93 -3.45 115.58 120.45 2bcj h ASN 237 Ca 0.41 -0.30 0.00 0.00 -3.08 0.00 0.00 56.30 53.33 2bcj h ASN 237 Cb 0.80 -0.18 0.00 0.00 -2.08 0.00 0.00 38.32 36.87 2bcj h ASN 237 CO -0.68 1.00 0.00 0.61 -2.08 0.00 0.00 177.43 176.28 2bcj n GLY 238 N 0.13 1.26 0.38 9.14 0.00 -0.07 -4.85 105.19 111.18 2bcj n GLY 238 Ca -0.02 0.00 0.07 0.00 0.00 0.00 0.00 46.02 46.07 2bcj n GLY 238 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 2bcj n ASN 239 N 0.00 1.66 -4.06 1.61 4.13 -1.26 -4.99 115.26 112.36 2bcj n ASN 239 Ca 0.00 -1.33 -0.10 0.00 1.68 0.00 0.00 54.58 54.83 2bcj n ASN 239 Cb 0.00 0.38 -0.07 0.00 -1.54 0.00 0.00 39.78 38.55 2bcj n ASN 239 CO 0.00 0.00 0.00 0.00 0.28 0.00 0.00 177.26 177.54 2bcj s ALA 240 N -1.67 0.27 0.01 5.41 0.00 -1.26 -1.27 121.76 123.25 2bcj s ALA 240 Ca 0.13 -1.15 -0.26 0.00 0.00 0.00 0.00 51.96 50.68 2bcj s ALA 240 Cb 0.12 1.14 0.06 0.00 0.00 0.00 0.00 23.12 24.44 2bcj s ALA 240 CO 0.33 -0.73 0.60 -0.59 0.00 0.00 0.00 175.76 175.37 2bcj s PHE 241 N -4.06 -0.55 0.09 0.00 -0.12 -0.56 -0.98 117.98 111.80 2bcj s PHE 241 Ca 0.27 0.78 0.06 0.00 -0.05 0.00 0.00 56.93 57.99 2bcj s PHE 241 Cb 0.03 0.39 -0.04 0.00 -0.63 0.00 0.00 43.02 42.77 2bcj s PHE 241 CO 0.08 -0.64 -0.08 0.00 -0.05 0.00 0.00 175.22 174.53 2bcj s ALA 242 N -1.92 3.00 -0.02 1.99 0.00 -0.24 -0.88 121.76 123.68 2bcj s ALA 242 Ca -0.08 -1.19 0.04 0.00 0.00 0.00 0.00 51.96 50.73 2bcj s ALA 242 Cb -0.01 -0.96 -0.01 0.00 0.00 0.00 0.00 23.12 22.14 2bcj s ALA 242 CO 0.03 0.64 -0.16 0.95 0.00 0.00 0.00 175.76 177.23 2bcj s THR 243 N -1.19 1.28 -0.07 0.00 -4.23 -0.13 -1.72 115.64 109.58 2bcj s THR 243 Ca 0.21 -0.67 -0.02 0.00 -1.18 0.00 0.00 61.69 60.03 2bcj s THR 243 Cb -0.11 -1.08 -0.04 0.00 1.34 0.00 0.00 72.50 72.61 2bcj s THR 243 CO 0.13 0.37 0.04 -0.83 -0.54 0.00 0.00 174.62 173.79 2bcj s GLY 244 N -0.17 1.94 0.07 3.99 0.00 0.28 -1.78 107.32 111.65 2bcj s GLY 244 Ca 0.02 -0.80 0.01 0.00 0.00 0.00 0.00 44.72 43.95 2bcj s GLY 244 CO 0.00 -0.59 -0.05 -0.45 0.00 0.00 0.00 173.10 172.02 2bcj s SER 245 N -1.11 0.82 0.00 1.64 0.15 -1.06 -0.45 113.70 113.69 2bcj s SER 245 Ca 0.16 -0.94 0.16 0.00 0.70 0.00 0.00 55.95 56.02 2bcj s SER 245 Cb -0.12 0.13 0.93 0.00 -1.71 0.00 0.00 66.02 65.26 2bcj s SER 245 CO 0.05 -0.49 1.36 0.47 1.20 0.00 0.00 173.24 175.83 2bcj n ASP 246 N 0.21 0.00 -0.83 5.45 10.43 -0.27 -1.29 116.55 130.25 2bcj n ASP 246 Ca -0.14 -0.71 0.04 0.00 2.57 0.00 0.00 54.79 56.55 2bcj n ASP 246 Cb 0.60 0.00 0.16 0.00 1.84 0.00 0.00 41.12 43.72 2bcj n ASP 246 CO 0.00 0.00 0.00 -0.90 -1.07 0.00 0.00 177.20 175.23 2bcj n ASP 247 N -0.91 2.34 -1.53 -2.24 5.68 -1.26 -4.53 116.55 114.11 2bcj n ASP 247 Ca 0.12 -2.18 -0.18 0.00 -0.50 0.00 0.00 54.79 52.04 2bcj n ASP 247 Cb 0.05 -0.38 -0.06 0.00 -1.14 0.00 0.00 41.12 39.59 2bcj n ASP 247 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 2bcj n ALA 248 N 0.38 -0.33 -2.74 2.12 0.00 -1.09 -4.99 120.51 113.87 2bcj n ALA 248 Ca 0.12 0.27 -0.17 0.00 0.00 0.00 0.00 53.44 53.65 2bcj n ALA 248 Cb 0.45 -1.89 -0.12 0.00 0.00 0.00 0.00 19.45 17.89 2bcj n ALA 248 CO 0.00 0.00 0.00 0.95 0.00 0.00 0.00 177.50 178.45 2bcj s THR 249 N -2.72 0.94 0.28 0.00 -4.23 -1.26 -4.62 115.64 104.03 2bcj s THR 249 Ca 0.00 -1.17 0.05 0.00 -1.18 0.00 0.00 61.69 59.38 2bcj s THR 249 Cb 0.00 -0.92 -0.03 0.00 1.34 0.00 0.00 72.50 72.89 2bcj s THR 249 CO 0.00 -0.22 0.41 0.00 -0.54 0.00 0.00 174.62 174.27 2bcj s ARG 251 N -4.07 0.49 -0.09 0.00 0.52 -0.73 -0.75 118.95 114.30 2bcj s ARG 251 Ca 0.37 -0.28 -0.02 0.00 -0.52 0.00 0.00 55.73 55.28 2bcj s ARG 251 Cb -0.09 0.21 -0.03 0.00 0.52 0.00 0.00 34.95 35.55 2bcj s ARG 251 CO 0.30 -0.12 -0.00 -1.17 0.02 0.00 0.00 175.30 174.34 2bcj s LEU 252 N -1.19 3.54 -0.07 2.53 2.96 -0.53 -0.96 118.68 124.97 2bcj s LEU 252 Ca -0.13 0.11 0.03 0.00 -0.22 0.00 0.00 54.13 53.92 2bcj s LEU 252 Cb -0.06 -1.81 0.01 0.00 0.50 0.00 0.00 46.19 44.82 2bcj s LEU 252 CO 0.02 0.35 -0.15 -0.36 -1.32 0.00 0.00 176.35 174.89 2bcj s PHE 253 N -0.72 1.67 -0.12 5.38 0.40 -0.06 -1.05 117.98 123.49 2bcj s PHE 253 Ca 0.11 -0.60 -0.13 0.00 -0.60 0.00 0.00 56.93 55.71 2bcj s PHE 253 Cb -0.12 -1.18 -0.05 0.00 0.51 0.00 0.00 43.02 42.19 2bcj s PHE 253 CO 0.02 -0.27 0.29 0.34 0.70 0.00 0.00 175.22 176.30 2bcj s ASP 254 N 0.47 6.51 -0.05 1.36 -1.08 -0.99 -1.50 116.67 121.39 2bcj s ASP 254 Ca -0.13 0.60 -0.26 0.00 -0.52 0.00 0.00 52.55 52.24 2bcj s ASP 254 Cb -0.15 -2.18 -0.21 0.00 -1.46 0.00 0.00 42.92 38.93 2bcj s ASP 254 CO 0.04 0.21 1.12 -0.07 0.52 0.00 0.00 175.17 176.99 2bcj h LEU 255 N 5.91 -0.03 -1.21 -1.34 3.38 -1.50 0.23 115.31 120.76 2bcj h LEU 255 Ca -0.46 -0.57 -0.07 0.00 0.09 0.00 0.00 57.88 56.87 2bcj h LEU 255 Cb 1.19 0.01 -0.01 0.00 0.09 0.00 0.00 40.66 41.93 2bcj h LEU 255 CO 0.69 0.57 -0.23 0.03 0.09 0.00 0.00 178.44 179.59 2bcj h ARG 256 N -0.64 0.27 -0.00 1.13 3.08 -1.96 -0.77 114.38 115.49 2bcj h ARG 256 Ca -0.00 -0.08 0.00 0.00 0.07 0.00 0.00 59.98 59.96 2bcj h ARG 256 Cb 0.59 -0.03 0.00 0.00 0.08 0.00 0.00 29.97 30.62 2bcj h ARG 256 CO 0.01 0.49 -0.30 0.00 -1.07 0.00 0.00 179.97 179.09 2bcj n ALA 257 N -2.48 3.14 -4.22 0.04 0.00 -1.24 -4.96 120.51 110.79 2bcj n ALA 257 Ca -0.01 -0.32 -0.34 0.00 0.00 0.00 0.00 53.44 52.78 2bcj n ALA 257 Cb 0.35 -1.20 -0.04 0.00 0.00 0.00 0.00 19.45 18.55 2bcj n ALA 257 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.50 174.03 2bcj n ASP 258 N -1.18 -1.74 -3.57 0.00 2.03 0.06 -4.90 116.55 107.25 2bcj n ASP 258 Ca 0.09 -1.08 -0.06 0.00 0.52 0.00 0.00 54.79 54.26 2bcj n ASP 258 Cb 0.33 -2.51 -0.00 0.00 -0.72 0.00 0.00 41.12 38.22 2bcj n ASP 258 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 2bcj s GLN 259 N -6.95 1.73 0.20 -0.67 -2.07 -1.13 -4.94 119.66 105.84 2bcj s GLN 259 Ca 0.46 -1.02 -0.30 0.00 -1.82 0.00 0.00 55.36 52.69 2bcj s GLN 259 Cb -0.26 0.55 -0.09 0.00 -1.09 0.00 0.00 33.01 32.13 2bcj s GLN 259 CO 0.94 -0.80 1.26 -2.00 -1.32 0.00 0.00 175.29 173.37 2bcj s GLU 260 N -3.25 4.44 -0.25 9.60 2.12 -1.26 -2.35 118.70 127.75 2bcj s GLU 260 Ca 0.13 1.98 0.00 0.00 0.36 0.00 0.00 54.97 57.44 2bcj s GLU 260 Cb -0.05 -3.21 -0.18 0.00 0.26 0.00 0.00 34.13 30.96 2bcj s GLU 260 CO 0.07 -0.17 -0.17 1.28 -0.54 0.00 0.00 175.26 175.73 2bcj n LEU 261 N 2.45 2.88 -3.80 2.70 4.77 -0.22 -4.92 117.00 120.86 2bcj n LEU 261 Ca 0.05 -0.07 -0.12 0.00 -0.03 0.00 0.00 56.01 55.83 2bcj n LEU 261 Cb 0.44 -0.93 -0.09 0.00 -2.33 0.00 0.00 43.42 40.51 2bcj n LEU 261 CO 0.57 0.91 -0.04 -0.32 -1.33 0.00 0.00 177.39 177.18 2bcj s MET 262 N -2.52 0.62 -0.03 3.23 0.00 -1.21 -4.19 119.30 115.20 2bcj s MET 262 Ca -0.34 -0.30 0.07 0.00 0.00 0.00 0.00 55.69 55.13 2bcj s MET 262 Cb 0.09 0.27 -0.02 0.00 0.00 0.00 0.00 34.83 35.17 2bcj s MET 262 CO 0.61 -0.17 -0.26 0.99 0.00 0.00 0.00 175.02 176.20 2bcj s THR 263 N -1.48 2.07 -0.30 10.11 2.01 -1.26 -1.45 115.64 125.34 2bcj s THR 263 Ca -0.13 -1.09 0.03 0.00 0.31 0.00 0.00 61.69 60.81 2bcj s THR 263 Cb -0.05 -1.72 0.08 0.00 0.01 0.00 0.00 72.50 70.82 2bcj s THR 263 CO 0.03 0.58 -0.02 -0.31 -0.69 0.00 0.00 174.62 174.20 2bcj s TYR 264 N -0.50 3.54 0.11 4.92 1.51 0.07 -4.90 117.35 122.09 2bcj s TYR 264 Ca 0.07 -2.69 -0.25 0.00 -1.01 0.00 0.00 57.07 53.19 2bcj s TYR 264 Cb -0.11 -2.47 0.07 0.00 -0.11 0.00 0.00 41.96 39.35 2bcj s TYR 264 CO 0.00 -0.92 0.81 -1.54 -1.11 0.00 0.00 175.55 172.80 2bcj s SER 265 N 1.00 -0.36 -0.01 2.29 1.04 -1.26 -1.21 113.70 115.20 2bcj s SER 265 Ca 0.02 -0.18 -0.17 0.00 0.48 0.00 0.00 55.95 56.10 2bcj s SER 265 Cb -0.19 0.51 0.03 0.00 0.10 0.00 0.00 66.02 66.46 2bcj s SER 265 CO -0.07 -0.87 0.36 -2.28 0.98 0.00 0.00 173.24 171.37 2bcj s HIS 266 N -3.42 -0.24 0.44 5.02 2.46 -1.26 -5.04 115.29 113.25 2bcj s HIS 266 Ca 0.06 0.33 0.19 0.00 0.47 0.00 0.00 55.06 56.11 2bcj s HIS 266 Cb -0.02 0.15 1.13 0.00 -0.13 0.00 0.00 32.58 33.71 2bcj s HIS 266 CO -0.05 -0.45 1.89 -0.44 -2.47 0.00 0.00 174.74 173.22 2bcj h ASP 267 N 3.59 0.34 -0.27 9.88 3.32 -2.03 -0.51 116.42 130.74 2bcj h ASP 267 Ca -0.30 0.03 -0.14 0.00 0.02 0.00 0.00 57.03 56.65 2bcj h ASP 267 Cb 1.18 -0.04 -0.01 0.00 0.22 0.00 0.00 39.33 40.68 2bcj h ASP 267 CO 0.41 0.15 -0.32 0.78 -1.72 0.00 0.00 179.24 178.54 2bcj h ASN 268 N 0.35 0.83 -3.28 6.45 4.21 -2.01 -3.42 115.58 118.70 2bcj h ASN 268 Ca 0.42 -0.34 -0.57 0.00 1.21 0.00 0.00 56.30 57.01 2bcj h ASN 268 Cb 1.09 -0.23 -0.06 0.00 -1.12 0.00 0.00 38.32 38.01 2bcj h ASN 268 CO -0.13 1.08 0.93 -0.63 -1.29 0.00 0.00 177.43 177.39 2bcj s ILE 269 N -4.45 4.26 -0.01 2.81 1.01 -0.20 -4.85 121.20 119.77 2bcj s ILE 269 Ca -0.09 1.42 0.02 0.00 0.00 0.00 0.00 60.65 61.99 2bcj s ILE 269 Cb 0.12 -4.30 -0.04 0.00 0.01 0.00 0.00 42.46 38.25 2bcj s ILE 269 CO 0.85 -0.56 0.03 -0.38 0.00 0.00 0.00 174.94 174.88 2bcj n ILE 270 N 6.21 0.09 -3.31 2.92 5.41 -1.26 -4.65 119.36 124.77 2bcj n ILE 270 Ca 0.14 -0.08 -0.24 0.00 1.00 0.00 0.00 62.75 63.56 2bcj n ILE 270 Cb 0.47 -0.29 -0.01 0.00 -0.71 0.00 0.00 39.64 39.10 2bcj n ILE 270 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 2bcj s GLY 272 N -4.05 1.60 -0.08 0.00 0.00 -1.26 -4.35 107.32 99.17 2bcj s GLY 272 Ca 0.41 -0.22 -0.16 0.00 0.00 0.00 0.00 44.72 44.75 2bcj s GLY 272 CO 0.37 0.30 0.41 -0.42 0.00 0.00 0.00 173.10 173.75 2bcj s ILE 273 N -3.01 5.16 -0.14 0.90 1.09 -0.41 -2.56 121.20 122.22 2bcj s ILE 273 Ca 0.64 0.81 0.19 0.00 -1.10 0.00 0.00 60.65 61.18 2bcj s ILE 273 Cb -0.17 -3.73 -0.26 0.00 -1.06 0.00 0.00 42.46 37.24 2bcj s ILE 273 CO 0.56 0.44 0.27 0.35 -0.10 0.00 0.00 174.94 176.46 2bcj n THR 274 N 2.92 1.02 -3.44 2.92 -2.24 0.57 -4.13 114.28 111.91 2bcj n THR 274 Ca -0.11 -0.75 -0.12 0.00 -2.27 0.00 0.00 64.05 60.80 2bcj n THR 274 Cb 0.52 -0.39 -0.02 0.00 -2.10 0.00 0.00 70.33 68.34 2bcj n THR 274 CO 0.00 0.00 0.00 -0.94 -0.57 0.00 0.00 175.07 173.56 2bcj s SER 275 N -5.29 -0.55 0.04 3.42 1.04 -1.24 -4.42 113.70 106.71 2bcj s SER 275 Ca -0.09 0.05 -0.09 0.00 0.48 0.00 0.00 55.95 56.30 2bcj s SER 275 Cb 0.08 0.57 0.00 0.00 0.10 0.00 0.00 66.02 66.77 2bcj s SER 275 CO 0.85 -0.90 0.19 0.68 0.98 0.00 0.00 173.24 175.04 2bcj s VAL 276 N -3.49 0.11 -0.00 5.02 -7.23 -1.26 -0.97 120.40 112.58 2bcj s VAL 276 Ca 0.01 -0.92 -0.29 0.00 -1.81 0.00 0.00 61.98 58.97 2bcj s VAL 276 Cb -0.01 -0.93 0.07 0.00 0.56 0.00 0.00 36.38 36.08 2bcj s VAL 276 CO -0.11 -0.51 0.67 -0.55 -0.31 0.00 0.00 175.10 174.29 2bcj s SER 277 N -2.12 -0.63 0.09 4.85 0.15 -0.64 -4.78 113.70 110.63 2bcj s SER 277 Ca -0.05 0.53 -0.00 0.00 0.70 0.00 0.00 55.95 57.13 2bcj s SER 277 Cb -0.01 0.55 -0.04 0.00 -1.71 0.00 0.00 66.02 64.81 2bcj s SER 277 CO -0.04 -0.69 0.25 -0.36 1.20 0.00 0.00 173.24 173.60 2bcj s PHE 278 N -1.84 3.51 0.71 3.44 0.08 -1.26 -0.82 117.98 121.79 2bcj s PHE 278 Ca -0.08 0.26 -0.11 0.00 0.12 0.00 0.00 56.93 57.13 2bcj s PHE 278 Cb -0.00 -1.77 0.01 0.00 -0.57 0.00 0.00 43.02 40.69 2bcj s PHE 278 CO 0.04 0.55 1.06 -1.54 -0.10 0.00 0.00 175.22 175.23 2bcj s SER 279 N -2.68 5.25 0.35 1.36 1.04 -0.81 -4.76 113.70 113.45 2bcj s SER 279 Ca 0.36 1.64 0.13 0.00 0.48 0.00 0.00 55.95 58.56 2bcj s SER 279 Cb -0.12 -2.49 0.98 0.00 0.10 0.00 0.00 66.02 64.49 2bcj s SER 279 CO 0.28 -1.53 1.73 0.50 0.98 0.00 0.00 173.24 175.20 2bcj h LYS 280 N -0.78 0.48 0.00 4.02 3.64 -1.88 0.22 116.57 122.27 2bcj h LYS 280 Ca -0.44 -0.03 -0.21 0.00 -1.27 0.00 0.00 60.65 58.70 2bcj h LYS 280 Cb 1.21 -0.11 -0.03 0.00 -0.41 0.00 0.00 32.23 32.89 2bcj h LYS 280 CO 0.56 0.32 -1.05 0.66 -2.27 0.00 0.00 179.45 177.67 2bcj h SER 281 N 0.49 0.00 0.00 4.20 4.64 -1.97 -3.45 113.55 117.47 2bcj h SER 281 Ca 0.64 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.96 2bcj h SER 281 Cb 1.38 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.47 2bcj h SER 281 CO -0.43 0.96 0.00 0.61 -0.87 0.00 0.00 176.83 177.10 2bcj n GLY 282 N 1.36 0.30 0.24 -0.77 0.00 0.76 -4.86 105.19 102.22 2bcj n GLY 282 Ca -0.02 0.00 0.08 0.00 0.00 0.00 0.00 46.02 46.08 2bcj n GLY 282 CO 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 173.32 173.23 2bcj h ARG 283 N 3.90 0.00 -5.51 1.61 9.65 -1.93 -3.42 114.38 118.67 2bcj h ARG 283 Ca 0.00 0.00 -0.66 0.00 -1.10 0.00 0.00 59.98 58.22 2bcj h ARG 283 Cb 0.00 0.00 -0.24 0.00 -1.39 0.00 0.00 29.97 28.34 2bcj h ARG 283 CO 0.00 0.14 -0.73 -0.51 2.80 0.00 0.00 179.97 181.67 2bcj s LEU 284 N -8.21 2.90 -0.23 3.80 1.43 -1.26 0.24 118.68 117.35 2bcj s LEU 284 Ca -0.04 -0.23 -0.05 0.00 -1.03 0.00 0.00 54.13 52.78 2bcj s LEU 284 Cb 0.15 -1.66 -0.01 0.00 0.03 0.00 0.00 46.19 44.70 2bcj s LEU 284 CO 0.65 0.21 -0.01 -0.22 0.23 0.00 0.00 176.35 177.22 2bcj s LEU 285 N 0.11 3.08 -0.33 1.79 2.96 -0.09 -1.92 118.68 124.27 2bcj s LEU 285 Ca -0.04 -0.33 -0.10 0.00 -0.22 0.00 0.00 54.13 53.43 2bcj s LEU 285 Cb -0.14 -1.80 0.01 0.00 0.50 0.00 0.00 46.19 44.75 2bcj s LEU 285 CO 0.04 -0.03 0.17 -0.76 -1.32 0.00 0.00 176.35 174.45 2bcj s LEU 286 N 1.52 4.33 -0.17 -0.68 1.43 -0.00 -0.15 118.68 124.97 2bcj s LEU 286 Ca 0.06 -0.73 -0.04 0.00 -1.03 0.00 0.00 54.13 52.39 2bcj s LEU 286 Cb -0.15 -2.00 -0.02 0.00 0.03 0.00 0.00 46.19 44.05 2bcj s LEU 286 CO -0.01 -0.27 -0.03 0.00 0.23 0.00 0.00 176.35 176.27 2bcj s ALA 287 N 1.58 2.97 0.24 4.21 0.00 -0.79 -1.62 121.76 128.35 2bcj s ALA 287 Ca 0.03 -0.90 -0.16 0.00 0.00 0.00 0.00 51.96 50.93 2bcj s ALA 287 Cb -0.18 -1.62 -0.08 0.00 0.00 0.00 0.00 23.12 21.24 2bcj s ALA 287 CO 0.06 0.05 0.67 0.20 0.00 0.00 0.00 175.76 176.75 2bcj s GLY 288 N 0.65 2.45 0.26 0.00 0.00 -0.14 -1.98 107.32 108.55 2bcj s GLY 288 Ca -0.02 0.01 0.03 0.00 0.00 0.00 0.00 44.72 44.75 2bcj s GLY 288 CO 0.02 0.28 0.03 -0.19 0.00 0.00 0.00 173.10 173.25 2bcj s TYR 289 N -1.70 1.66 -0.69 1.90 1.51 -0.98 -0.31 117.35 118.73 2bcj s TYR 289 Ca 0.46 -0.98 -0.02 0.00 -1.01 0.00 0.00 57.07 55.52 2bcj s TYR 289 Cb -0.14 -1.00 0.40 0.00 -0.11 0.00 0.00 41.96 41.12 2bcj s TYR 289 CO 0.19 -0.09 2.05 -3.47 -1.11 0.00 0.00 175.55 173.13 2bcj n ASP 290 N -0.50 7.57 -1.15 2.29 2.03 -1.06 -1.49 116.55 124.24 2bcj n ASP 290 Ca -0.03 -3.75 0.04 0.00 0.52 0.00 0.00 54.79 51.57 2bcj n ASP 290 Cb 0.65 -1.01 0.06 0.00 -0.72 0.00 0.00 41.12 40.09 2bcj n ASP 290 CO 0.00 0.00 0.00 -0.90 -1.92 0.00 0.00 177.20 174.38 2bcj n ASP 291 N -0.71 1.05 0.00 1.67 5.75 -1.26 -4.85 116.55 118.20 2bcj n ASP 291 Ca 0.58 -2.39 0.00 0.00 -0.01 0.00 0.00 54.79 52.97 2bcj n ASP 291 Cb 0.54 -0.33 0.00 0.00 -1.03 0.00 0.00 41.12 40.30 2bcj n ASP 291 CO 0.00 0.00 0.00 0.49 -0.11 0.00 0.00 177.20 177.58 2bcj n PHE 292 N 0.06 0.00 -3.36 2.11 3.72 -1.25 -4.94 117.46 113.80 2bcj n PHE 292 Ca 0.08 0.00 -0.21 0.00 -0.05 0.00 0.00 57.45 57.27 2bcj n PHE 292 Cb 0.99 -1.31 0.02 0.00 -0.94 0.00 0.00 39.48 38.24 2bcj n PHE 292 CO 0.00 0.00 0.00 -0.80 -0.05 0.00 0.00 176.76 175.91 2bcj s ASN 293 N -2.14 5.05 -0.44 4.37 0.01 -1.26 -4.04 114.94 116.48 2bcj s ASN 293 Ca 0.00 -0.87 0.08 0.00 -0.71 0.00 0.00 52.86 51.36 2bcj s ASN 293 Cb 0.00 0.01 0.18 0.00 0.41 0.00 0.00 41.25 41.86 2bcj s ASN 293 CO 0.00 -1.06 0.66 0.00 -1.51 0.00 0.00 177.10 175.19 2bcj s ASN 295 N 1.59 7.16 -0.26 0.00 0.02 -0.84 -1.25 114.94 121.36 2bcj s ASN 295 Ca 0.20 1.84 -0.09 0.00 -1.02 0.00 0.00 52.86 53.78 2bcj s ASN 295 Cb -0.03 -2.57 -0.04 0.00 0.02 0.00 0.00 41.25 38.63 2bcj s ASN 295 CO -0.06 -0.20 0.12 -0.69 0.02 0.00 0.00 177.10 176.29 2bcj s VAL 296 N -1.75 4.78 -0.00 1.60 1.01 0.19 -1.88 120.40 124.34 2bcj s VAL 296 Ca 0.54 -0.01 0.01 0.00 0.00 0.00 0.00 61.98 62.51 2bcj s VAL 296 Cb -0.17 -3.25 -0.04 0.00 0.00 0.00 0.00 36.38 32.92 2bcj s VAL 296 CO 0.22 0.31 0.04 0.26 0.00 0.00 0.00 175.10 175.93 2bcj s TRP 297 N 1.58 3.18 -0.43 5.22 0.52 0.79 0.02 118.94 129.83 2bcj s TRP 297 Ca 0.06 0.14 -0.29 0.00 0.02 0.00 0.00 56.10 56.04 2bcj s TRP 297 Cb -0.15 -1.70 0.02 0.00 -1.15 0.00 0.00 33.47 30.48 2bcj s TRP 297 CO 0.06 0.51 1.25 0.34 0.02 0.00 0.00 176.95 179.13 2bcj s ASP 298 N -1.66 6.55 0.53 2.95 -1.08 0.23 -0.91 116.67 123.28 2bcj s ASP 298 Ca 0.21 0.71 0.20 0.00 -0.52 0.00 0.00 52.55 53.15 2bcj s ASP 298 Cb -0.12 -2.54 1.38 0.00 -1.46 0.00 0.00 42.92 40.18 2bcj s ASP 298 CO 0.12 -1.28 2.15 0.00 0.52 0.00 0.00 175.17 176.69 2bcj h ALA 299 N 9.68 1.80 0.04 3.66 0.00 -0.46 0.46 119.26 134.43 2bcj h ALA 299 Ca -0.25 -0.03 -0.31 0.00 0.00 0.00 0.00 54.91 54.32 2bcj h ALA 299 Cb 1.08 -0.01 -0.04 0.00 0.00 0.00 0.00 17.79 18.83 2bcj h ALA 299 CO 1.10 0.04 -1.70 1.28 0.00 0.00 0.00 179.25 179.97 2bcj n LEU 300 N -4.28 2.16 0.16 0.00 4.77 -1.26 -4.38 117.00 114.17 2bcj n LEU 300 Ca -0.03 0.32 0.04 0.00 -0.03 0.00 0.00 56.01 56.32 2bcj n LEU 300 Cb 0.12 -0.99 0.12 0.00 -2.33 0.00 0.00 43.42 40.34 2bcj n LEU 300 CO 0.32 0.52 0.56 0.11 -1.33 0.00 0.00 177.39 177.57 2bcj h LYS 301 N -0.63 0.00 -0.50 3.23 1.79 -1.88 -3.43 116.57 115.15 2bcj h LYS 301 Ca -0.43 0.00 -0.22 0.00 -2.18 0.00 0.00 60.65 57.83 2bcj h LYS 301 Cb 1.59 0.00 -0.09 0.00 -1.58 0.00 0.00 32.23 32.15 2bcj h LYS 301 CO -0.14 0.42 -0.20 0.00 -1.08 0.00 0.00 179.45 178.45 2bcj n ALA 302 N -2.22 -0.16 -2.62 3.86 0.00 0.16 -4.97 120.51 114.56 2bcj n ALA 302 Ca 0.02 0.17 -0.36 0.00 0.00 0.00 0.00 53.44 53.27 2bcj n ALA 302 Cb 0.66 -1.34 -0.06 0.00 0.00 0.00 0.00 19.45 18.72 2bcj n ALA 302 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 2bcj s ASP 303 N -2.75 6.65 -0.75 0.00 1.01 -1.24 -4.78 116.67 114.80 2bcj s ASP 303 Ca 0.00 0.78 -0.26 0.00 0.71 0.00 0.00 52.55 53.77 2bcj s ASP 303 Cb 0.00 -2.18 0.02 0.00 1.01 0.00 0.00 42.92 41.77 2bcj s ASP 303 CO 0.00 0.27 1.47 -0.60 0.21 0.00 0.00 175.17 176.52 2bcj s ARG 304 N -1.46 3.07 0.09 8.23 3.52 -1.26 -0.60 118.95 130.54 2bcj s ARG 304 Ca 0.26 -0.14 -0.15 0.00 -0.13 0.00 0.00 55.73 55.58 2bcj s ARG 304 Cb -0.15 -4.40 -0.11 0.00 -1.56 0.00 0.00 34.95 28.74 2bcj s ARG 304 CO 0.14 -2.35 1.37 0.00 -0.81 0.00 0.00 175.30 173.65 2bcj h ALA 305 N 11.24 0.38 -3.05 6.12 0.00 -0.68 -3.48 119.26 129.79 2bcj h ALA 305 Ca -0.20 -0.45 -0.10 0.00 0.00 0.00 0.00 54.91 54.16 2bcj h ALA 305 Cb 1.07 -0.07 -0.02 0.00 0.00 0.00 0.00 17.79 18.77 2bcj h ALA 305 CO 1.28 0.47 0.02 0.41 0.00 0.00 0.00 179.25 181.43 2bcj n GLY 306 N 0.32 2.06 2.94 0.00 0.00 -0.94 -2.97 105.19 106.61 2bcj n GLY 306 Ca -0.05 -1.36 -0.13 0.00 0.00 0.00 0.00 46.02 44.48 2bcj n GLY 306 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2bcj s VAL 307 N -2.58 -0.04 -0.42 1.61 1.01 -1.26 -0.64 120.40 118.08 2bcj s VAL 307 Ca 0.13 0.13 -0.13 0.00 0.00 0.00 0.00 61.98 62.11 2bcj s VAL 307 Cb -0.02 -0.22 0.04 0.00 0.00 0.00 0.00 36.38 36.19 2bcj s VAL 307 CO 0.10 0.05 0.29 -0.76 0.00 0.00 0.00 175.10 174.78 2bcj s LEU 308 N 0.86 5.13 -0.65 3.92 1.43 -0.38 -4.69 118.68 124.29 2bcj s LEU 308 Ca -0.07 -1.11 0.05 0.00 -1.03 0.00 0.00 54.13 51.98 2bcj s LEU 308 Cb -0.09 -2.11 0.27 0.00 0.03 0.00 0.00 46.19 44.30 2bcj s LEU 308 CO -0.04 -0.49 0.83 0.00 0.23 0.00 0.00 176.35 176.88 2bcj n ALA 309 N 5.09 4.27 -0.03 4.21 0.00 -1.26 -1.81 120.51 130.98 2bcj n ALA 309 Ca -0.11 -4.76 0.02 0.00 0.00 0.00 0.00 53.44 48.58 2bcj n ALA 309 Cb 0.45 -0.93 0.06 0.00 0.00 0.00 0.00 19.45 19.03 2bcj n ALA 309 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2bcj n GLY 310 N 0.61 2.32 3.32 0.00 0.00 -1.26 -5.02 105.19 105.16 2bcj n GLY 310 Ca 0.30 -0.15 -0.27 0.00 0.00 0.00 0.00 46.02 45.90 2bcj n GLY 310 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 2bcj s HIS 311 N -0.91 2.08 -0.25 1.61 3.76 -1.26 -5.03 115.29 115.29 2bcj s HIS 311 Ca 0.09 -0.40 0.22 0.00 -0.15 0.00 0.00 55.06 54.83 2bcj s HIS 311 Cb 0.05 -1.19 0.03 0.00 1.11 0.00 0.00 32.58 32.58 2bcj s HIS 311 CO 0.06 0.19 1.09 -0.44 -0.85 0.00 0.00 174.74 174.80 2bcj h ASP 312 N 4.43 0.00 -2.36 1.40 3.32 -1.95 -3.45 116.42 117.81 2bcj h ASP 312 Ca -0.47 0.00 -0.56 0.00 0.02 0.00 0.00 57.03 56.02 2bcj h ASP 312 Cb 1.16 0.00 -0.13 0.00 0.22 0.00 0.00 39.33 40.58 2bcj h ASP 312 CO 0.42 0.01 -0.61 0.21 -1.72 0.00 0.00 179.24 177.54 2bcj s ASN 313 N -5.45 3.23 0.05 6.45 3.84 -1.26 -4.88 114.94 116.91 2bcj s ASN 313 Ca 0.00 -1.36 -0.21 0.00 0.21 0.00 0.00 52.86 51.51 2bcj s ASN 313 Cb 0.09 -0.26 -0.11 0.00 -0.55 0.00 0.00 41.25 40.42 2bcj s ASN 313 CO 0.78 -0.49 0.51 -1.14 -2.79 0.00 0.00 177.10 173.96 2bcj n ARG 314 N -0.83 0.00 -2.74 0.43 0.63 -1.26 -4.23 116.66 108.65 2bcj n ARG 314 Ca -0.04 0.00 -0.42 0.00 -0.92 0.00 0.00 57.85 56.47 2bcj n ARG 314 Cb 0.66 -0.77 -0.03 0.00 0.45 0.00 0.00 32.46 32.77 2bcj n ARG 314 CO 0.00 0.00 0.00 0.08 -2.51 0.00 0.00 177.63 175.20 2bcj s VAL 315 N -0.23 4.12 -0.02 5.15 1.01 -0.56 -1.15 120.40 128.71 2bcj s VAL 315 Ca 0.48 -0.17 -0.22 0.00 0.00 0.00 0.00 61.98 62.08 2bcj s VAL 315 Cb -0.68 -4.78 -0.24 0.00 0.00 0.00 0.00 36.38 30.68 2bcj s VAL 315 CO 0.34 -1.62 1.05 0.77 0.00 0.00 0.00 175.10 175.64 2bcj h SER 316 N 9.70 0.43 -5.01 3.32 4.64 -1.71 -3.30 113.55 121.62 2bcj h SER 316 Ca -0.25 -0.79 -0.16 0.00 -0.47 0.00 0.00 61.79 60.12 2bcj h SER 316 Cb 1.06 -0.13 -0.16 0.00 -0.31 0.00 0.00 62.40 62.86 2bcj h SER 316 CO 1.22 1.17 -0.69 0.00 -0.87 0.00 0.00 176.83 177.66 2bcj s LEU 318 N -2.81 -0.52 0.26 0.00 0.05 -1.26 -0.53 118.68 113.87 2bcj s LEU 318 Ca 0.06 -0.04 -0.14 0.00 0.05 0.00 0.00 54.13 54.06 2bcj s LEU 318 Cb 0.05 2.54 0.00 0.00 -2.05 0.00 0.00 46.19 46.73 2bcj s LEU 318 CO -0.07 -0.95 0.53 -0.83 -0.55 0.00 0.00 176.35 174.47 2bcj s GLY 319 N -2.73 0.45 0.02 -3.48 0.00 -0.45 -4.77 107.32 96.35 2bcj s GLY 319 Ca 0.02 -0.79 0.05 0.00 0.00 0.00 0.00 44.72 44.00 2bcj s GLY 319 CO -0.11 -0.53 -0.14 0.14 0.00 0.00 0.00 173.10 172.46 2bcj s VAL 320 N -3.94 1.09 0.71 1.40 1.01 -1.26 -1.82 120.40 117.59 2bcj s VAL 320 Ca 0.20 -0.84 -0.12 0.00 0.00 0.00 0.00 61.98 61.22 2bcj s VAL 320 Cb -0.02 -0.96 0.02 0.00 0.00 0.00 0.00 36.38 35.43 2bcj s VAL 320 CO 0.09 0.11 1.09 0.42 0.00 0.00 0.00 175.10 176.81 2bcj s THR 321 N -0.65 3.42 0.33 3.92 -4.23 -0.93 -4.91 115.64 112.57 2bcj s THR 321 Ca 0.03 0.54 0.19 0.00 -1.18 0.00 0.00 61.69 61.27 2bcj s THR 321 Cb -0.07 -3.07 0.16 0.00 1.34 0.00 0.00 72.50 70.87 2bcj s THR 321 CO 0.01 -0.52 1.87 0.44 -0.54 0.00 0.00 174.62 175.88 2bcj h ASP 322 N -0.57 0.00 -0.31 3.99 5.19 -1.85 0.06 116.42 122.93 2bcj h ASP 322 Ca -0.45 0.00 0.00 0.00 -0.62 0.00 0.00 57.03 55.96 2bcj h ASP 322 Cb 1.23 0.00 0.00 0.00 0.18 0.00 0.00 39.33 40.74 2bcj h ASP 322 CO 0.53 0.29 0.00 -0.90 -3.12 0.00 0.00 179.24 176.05 2bcj n ASP 323 N -3.81 1.84 -0.69 6.45 5.75 -1.26 -4.94 116.55 119.90 2bcj n ASP 323 Ca -0.01 -1.93 -0.09 0.00 -0.01 0.00 0.00 54.79 52.75 2bcj n ASP 323 Cb 0.38 -0.21 -0.04 0.00 -1.03 0.00 0.00 41.12 40.23 2bcj n ASP 323 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 2bcj n GLY 324 N 1.08 0.86 0.22 6.12 0.00 0.01 -4.85 105.19 108.63 2bcj n GLY 324 Ca 0.13 -0.01 0.11 0.00 0.00 0.00 0.00 46.02 46.24 2bcj n GLY 324 CO 0.00 0.00 0.00 1.98 0.00 0.00 0.00 173.32 175.30 2bcj h MET 325 N 0.01 0.00 -2.74 1.61 -1.53 -1.92 -3.45 114.93 106.90 2bcj h MET 325 Ca -0.18 0.00 -0.02 0.00 -3.44 0.00 0.00 59.70 56.06 2bcj h MET 325 Cb 1.14 0.00 -0.14 0.00 -0.55 0.00 0.00 31.60 32.05 2bcj h MET 325 CO 0.27 0.16 0.23 0.00 0.14 0.00 0.00 176.91 177.71 2bcj s ALA 326 N -3.36 -1.65 -0.20 0.39 0.00 -1.26 -4.88 121.76 110.81 2bcj s ALA 326 Ca 0.04 0.69 -0.03 0.00 0.00 0.00 0.00 51.96 52.66 2bcj s ALA 326 Cb 0.08 0.67 -0.01 0.00 0.00 0.00 0.00 23.12 23.85 2bcj s ALA 326 CO 0.65 -0.69 -0.06 0.08 0.00 0.00 0.00 175.76 175.75 2bcj s VAL 327 N -3.21 3.39 0.04 0.00 1.01 -1.12 -2.20 120.40 118.31 2bcj s VAL 327 Ca -0.01 -0.50 -0.07 0.00 0.00 0.00 0.00 61.98 61.40 2bcj s VAL 327 Cb -0.01 -2.52 -0.05 0.00 0.00 0.00 0.00 36.38 33.81 2bcj s VAL 327 CO -0.08 0.45 0.31 0.00 0.00 0.00 0.00 175.10 175.78 2bcj s ALA 328 N 1.12 3.81 -0.17 5.51 0.00 -0.76 -0.25 121.76 131.03 2bcj s ALA 328 Ca 0.01 -0.53 -0.05 0.00 0.00 0.00 0.00 51.96 51.40 2bcj s ALA 328 Cb -0.15 -2.12 0.06 0.00 0.00 0.00 0.00 23.12 20.92 2bcj s ALA 328 CO -0.01 0.63 0.10 0.95 0.00 0.00 0.00 175.76 177.44 2bcj s THR 329 N -1.35 -0.12 0.54 0.00 -4.23 -0.36 -1.34 115.64 108.78 2bcj s THR 329 Ca 0.30 -0.15 -0.10 0.00 -1.18 0.00 0.00 61.69 60.56 2bcj s THR 329 Cb -0.13 -0.57 -0.05 0.00 1.34 0.00 0.00 72.50 73.08 2bcj s THR 329 CO 0.17 -0.26 0.93 -0.83 -0.54 0.00 0.00 174.62 174.09 2bcj s GLY 330 N 2.16 1.71 0.21 3.99 0.00 0.31 -1.82 107.32 113.89 2bcj s GLY 330 Ca 0.03 -0.17 -0.13 0.00 0.00 0.00 0.00 44.72 44.44 2bcj s GLY 330 CO -0.09 0.06 0.45 -0.45 0.00 0.00 0.00 173.10 173.07 2bcj s SER 331 N -3.86 -0.11 0.08 1.64 0.15 -1.11 -2.24 113.70 108.25 2bcj s SER 331 Ca 0.53 -0.77 0.25 0.00 0.70 0.00 0.00 55.95 56.66 2bcj s SER 331 Cb -0.11 0.55 0.99 0.00 -1.71 0.00 0.00 66.02 65.75 2bcj s SER 331 CO 0.45 -1.06 1.79 0.79 1.20 0.00 0.00 173.24 176.42 2bcj n TRP 332 N -0.33 0.34 1.77 3.44 7.02 -0.30 -1.08 117.44 128.29 2bcj n TRP 332 Ca -0.06 0.11 0.10 0.00 -1.02 0.00 0.00 57.50 56.63 2bcj n TRP 332 Cb 0.62 -0.67 0.51 0.00 -2.42 0.00 0.00 31.31 29.35 2bcj n TRP 332 CO 0.00 0.00 0.00 -0.40 -2.02 0.00 0.00 177.69 175.27 2bcj n ASP 333 N -1.78 0.51 0.00 -0.99 5.68 -1.26 -3.90 116.55 114.81 2bcj n ASP 333 Ca 0.06 -1.50 0.00 0.00 -0.50 0.00 0.00 54.79 52.85 2bcj n ASP 333 Cb 0.33 -0.03 0.00 0.00 -1.14 0.00 0.00 41.12 40.27 2bcj n ASP 333 CO 0.00 0.00 0.00 -1.20 -1.33 0.00 0.00 177.20 174.67 2bcj n SER 334 N -0.45 -0.45 -4.23 -1.12 7.64 -1.21 -4.98 113.62 108.81 2bcj n SER 334 Ca 0.15 0.00 -0.28 0.00 1.01 0.00 0.00 58.87 59.75 2bcj n SER 334 Cb 0.15 -0.08 -0.16 0.00 -1.01 0.00 0.00 64.21 63.11 2bcj n SER 334 CO 0.00 0.00 0.00 -0.36 -3.01 0.00 0.00 175.04 171.67 2bcj s PHE 335 N -2.46 1.99 0.33 1.43 0.08 -1.26 -4.04 117.98 114.04 2bcj s PHE 335 Ca 0.00 -0.43 -0.02 0.00 0.12 0.00 0.00 56.93 56.60 2bcj s PHE 335 Cb 0.00 -1.29 -0.04 0.00 -0.57 0.00 0.00 43.02 41.12 2bcj s PHE 335 CO 0.00 -0.07 0.56 -0.51 -0.10 0.00 0.00 175.22 175.10 2bcj s LEU 336 N -0.40 4.01 -0.06 -0.37 1.02 -1.21 -2.75 118.68 118.92 2bcj s LEU 336 Ca 0.05 0.60 -0.03 0.00 0.02 0.00 0.00 54.13 54.78 2bcj s LEU 336 Cb -0.09 -3.45 0.04 0.00 0.02 0.00 0.00 46.19 42.71 2bcj s LEU 336 CO 0.00 -0.27 0.14 -0.54 0.02 0.00 0.00 176.35 175.70 2bcj s LYS 337 N -3.98 0.08 0.14 1.70 1.02 -0.75 -0.57 119.74 117.38 2bcj s LYS 337 Ca 0.42 0.38 -0.13 0.00 0.02 0.00 0.00 55.97 56.66 2bcj s LYS 337 Cb -0.10 -0.20 -0.07 0.00 -0.52 0.00 0.00 37.83 36.94 2bcj s LYS 337 CO 0.34 -0.18 0.52 0.42 -0.92 0.00 0.00 175.35 175.53 2bcj s ILE 338 N 1.29 4.91 0.08 2.17 -1.09 -1.11 -1.23 121.20 126.22 2bcj s ILE 338 Ca -0.08 0.72 0.04 0.00 -2.23 0.00 0.00 60.65 59.10 2bcj s ILE 338 Cb -0.12 -3.71 -0.03 0.00 -1.58 0.00 0.00 42.46 37.03 2bcj s ILE 338 CO -0.06 0.22 -0.12 0.26 -1.23 0.00 0.00 174.94 174.01 2bcj s TRP 339 N -1.49 1.12 0.00 3.97 0.52 0.65 -0.82 118.94 122.89 2bcj s TRP 339 Ca 0.38 -0.53 0.00 0.00 0.02 0.00 0.00 56.10 55.97 2bcj s TRP 339 Cb -0.14 -0.62 0.00 0.00 -1.15 0.00 0.00 33.47 31.56 2bcj s TRP 339 CO 0.19 0.03 0.00 0.09 0.02 0.00 0.00 176.95 177.28