#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2bsx n ASP 2 N 0.00 -0.61 -3.14 7.83 8.00 -1.26 -4.98 116.55 122.39 2bsx n ASP 2 Ca 0.00 0.16 -0.19 0.00 0.71 0.00 0.00 54.79 55.47 2bsx n ASP 2 Cb 0.00 0.86 -0.04 0.00 -0.02 0.00 0.00 41.12 41.92 2bsx n ASP 2 CO 0.00 0.00 0.00 -0.46 -0.39 0.00 0.00 177.20 176.35 2bsx n ASN 3 N -2.40 0.21 0.00 -2.24 6.94 -1.26 -4.92 115.26 111.58 2bsx n ASN 3 Ca 0.00 -2.93 0.00 0.00 -0.02 0.00 0.00 54.58 51.63 2bsx n ASN 3 Cb 0.00 -0.37 0.00 0.00 -2.36 0.00 0.00 39.78 37.05 2bsx n ASN 3 CO 0.00 0.00 0.00 0.18 -1.03 0.00 0.00 177.26 176.41 2bsx n LEU 4 N 0.80 0.00 0.00 -4.53 7.99 -1.26 -4.79 117.00 115.22 2bsx n LEU 4 Ca 0.22 0.00 0.00 0.00 -0.01 0.00 0.00 56.01 56.22 2bsx n LEU 4 Cb 0.61 0.00 0.00 0.00 -0.11 0.00 0.00 43.42 43.92 2bsx n LEU 4 CO 0.18 0.00 0.00 0.18 -1.51 0.00 0.00 177.39 176.24 2bsx n LEU 5 N 0.00 0.00 -0.27 2.23 4.77 -1.11 -4.46 117.00 118.16 2bsx n LEU 5 Ca 0.00 0.00 -0.05 0.00 -0.03 0.00 0.00 56.01 55.93 2bsx n LEU 5 Cb 0.00 0.00 0.06 0.00 -2.33 0.00 0.00 43.42 41.15 2bsx n LEU 5 CO 0.00 0.00 1.12 -0.09 -1.33 0.00 0.00 177.39 177.09 2bsx h ARG 6 N 1.36 1.03 0.00 3.23 2.43 -1.93 0.55 114.38 121.04 2bsx h ARG 6 Ca 0.00 -0.11 -0.33 0.00 -0.81 0.00 0.00 59.98 58.73 2bsx h ARG 6 Cb 0.00 -0.21 -0.06 0.00 -0.42 0.00 0.00 29.97 29.28 2bsx h ARG 6 CO 0.00 0.76 -2.26 0.72 -1.51 0.00 0.00 179.97 177.68 2bsx n HIS 7 N -4.47 0.00 0.18 2.20 8.25 -1.26 -4.42 115.22 115.70 2bsx n HIS 7 Ca 0.07 0.00 0.04 0.00 -0.26 0.00 0.00 57.72 57.57 2bsx n HIS 7 Cb 0.08 -0.85 0.31 0.00 1.12 0.00 0.00 29.99 30.65 2bsx n HIS 7 CO 0.00 0.00 0.00 -0.07 0.64 0.00 0.00 176.34 176.91 2bsx h LEU 8 N 0.00 0.00 0.61 2.41 3.38 -1.89 -3.43 115.31 116.39 2bsx h LEU 8 Ca -0.49 0.00 -0.40 0.00 0.09 0.00 0.00 57.88 57.08 2bsx h LEU 8 Cb 1.79 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 42.54 2bsx h LEU 8 CO -0.07 0.42 -0.60 0.29 0.09 0.00 0.00 178.44 178.58 2bsx n LYS 9 N -3.63 -4.44 -4.16 1.13 5.02 0.18 -4.70 118.16 107.57 2bsx n LYS 9 Ca -0.01 0.70 -0.26 0.00 -2.02 0.00 0.00 58.31 56.73 2bsx n LYS 9 Cb 0.52 -5.51 -0.06 0.00 -0.02 0.00 0.00 35.03 29.96 2bsx n LYS 9 CO 0.00 0.00 0.00 0.96 -0.52 0.00 0.00 177.40 177.84 2bsx s ILE 10 N -3.09 2.02 0.42 -0.18 -4.36 -1.26 -4.76 121.20 110.00 2bsx s ILE 10 Ca 0.38 -1.69 -0.04 0.00 -0.26 0.00 0.00 60.65 59.04 2bsx s ILE 10 Cb -0.18 -2.72 -0.04 0.00 1.25 0.00 0.00 42.46 40.77 2bsx s ILE 10 CO 0.47 0.00 0.70 -0.55 0.24 0.00 0.00 174.94 175.80 2bsx s SER 11 N -3.98 6.30 0.22 4.36 0.15 -1.26 -2.76 113.70 116.72 2bsx s SER 11 Ca 0.35 0.78 0.24 0.00 0.70 0.00 0.00 55.95 58.02 2bsx s SER 11 Cb 0.02 -2.18 0.92 0.00 -1.71 0.00 0.00 66.02 63.07 2bsx s SER 11 CO 0.20 -0.46 1.73 1.17 1.20 0.00 0.00 173.24 177.08 2bsx n LYS 12 N -1.98 0.20 -0.17 5.44 4.81 -1.26 -1.88 118.16 123.31 2bsx n LYS 12 Ca -0.01 0.33 0.10 0.00 -0.87 0.00 0.00 58.31 57.86 2bsx n LYS 12 Cb 0.55 -1.82 0.27 0.00 0.02 0.00 0.00 35.03 34.06 2bsx n LYS 12 CO 0.00 0.00 0.00 0.39 1.17 0.00 0.00 177.40 178.96 2bsx n GLU 13 N -2.18 2.16 0.00 1.64 4.71 -1.26 -3.80 120.64 121.91 2bsx n GLU 13 Ca 0.04 -1.77 0.08 0.00 -0.01 0.00 0.00 57.16 55.49 2bsx n GLU 13 Cb 0.30 -1.44 -0.03 0.00 -1.01 0.00 0.00 31.44 29.25 2bsx n GLU 13 CO 0.00 0.00 0.00 1.04 0.09 0.00 0.00 177.13 178.26 2bsx n GLN 14 N 0.97 1.83 -2.64 3.49 6.02 -0.79 -4.91 117.38 121.35 2bsx n GLN 14 Ca 0.18 -0.49 -0.42 0.00 -0.01 0.00 0.00 57.00 56.25 2bsx n GLN 14 Cb 0.47 -1.24 -0.03 0.00 1.02 0.00 0.00 30.24 30.46 2bsx n GLN 14 CO 0.00 0.00 0.00 0.42 -1.01 0.00 0.00 177.06 176.47 2bsx s ILE 15 N -2.09 4.68 0.58 5.09 -1.09 -1.23 -4.88 121.20 122.26 2bsx s ILE 15 Ca 0.10 1.95 0.02 0.00 -2.23 0.00 0.00 60.65 60.49 2bsx s ILE 15 Cb 0.12 -4.25 0.06 0.00 -1.58 0.00 0.00 42.46 36.80 2bsx s ILE 15 CO 0.48 0.00 0.81 0.42 -1.23 0.00 0.00 174.94 175.43 2bsx s THR 16 N 2.05 2.53 0.22 2.92 -4.23 -1.26 -4.92 115.64 112.95 2bsx s THR 16 Ca 0.50 -0.69 -0.08 0.00 -1.18 0.00 0.00 61.69 60.24 2bsx s THR 16 Cb -0.20 -2.85 0.16 0.00 1.34 0.00 0.00 72.50 70.96 2bsx s THR 16 CO 0.19 0.00 1.80 -0.65 -0.54 0.00 0.00 174.62 175.41 2bsx h PRO 17 N -0.03 0.64 -6.11 3.99 0.11 -1.91 -3.34 132.00 125.36 2bsx h PRO 17 Ca -0.40 -0.04 -0.67 0.00 0.11 0.00 0.00 66.00 65.00 2bsx h PRO 17 Cb 1.29 -0.15 -0.15 0.00 0.11 0.00 0.00 31.00 32.10 2bsx h PRO 17 CO 0.48 0.43 -0.65 0.08 -0.21 0.00 0.00 178.00 178.13 2bsx s VAL 18 N -6.08 4.12 -0.02 3.15 1.01 -1.26 0.65 120.40 121.97 2bsx s VAL 18 Ca -0.13 -0.49 0.03 0.00 0.00 0.00 0.00 61.98 61.39 2bsx s VAL 18 Cb 0.17 -2.78 -0.00 0.00 0.00 0.00 0.00 36.38 33.77 2bsx s VAL 18 CO 0.76 0.47 -0.10 -0.69 0.00 0.00 0.00 175.10 175.54 2bsx s VAL 19 N -0.99 0.84 -0.27 2.92 1.01 0.20 -2.83 120.40 121.27 2bsx s VAL 19 Ca 0.17 -0.41 -0.06 0.00 0.00 0.00 0.00 61.98 61.68 2bsx s VAL 19 Cb -0.11 -0.74 0.00 0.00 0.00 0.00 0.00 36.38 35.53 2bsx s VAL 19 CO 0.07 0.25 0.05 -0.22 0.00 0.00 0.00 175.10 175.25 2bsx s LEU 20 N 0.06 3.56 -0.17 3.92 2.96 -0.04 -2.50 118.68 126.47 2bsx s LEU 20 Ca -0.01 -0.58 -0.05 0.00 -0.22 0.00 0.00 54.13 53.27 2bsx s LEU 20 Cb -0.08 -1.85 -0.03 0.00 0.50 0.00 0.00 46.19 44.74 2bsx s LEU 20 CO 0.00 -0.13 0.00 0.68 -1.32 0.00 0.00 176.35 175.59 2bsx s VAL 21 N 1.50 4.24 0.46 1.68 -7.23 -0.75 -0.37 120.40 119.92 2bsx s VAL 21 Ca 0.04 -0.23 0.03 0.00 -1.81 0.00 0.00 61.98 60.00 2bsx s VAL 21 Cb -0.16 -2.89 -0.03 0.00 0.56 0.00 0.00 36.38 33.86 2bsx s VAL 21 CO 0.01 0.47 0.03 0.68 -0.31 0.00 0.00 175.10 175.99 2bsx s VAL 22 N 0.44 1.20 -0.09 1.32 -7.23 -0.76 -2.85 120.40 112.43 2bsx s VAL 22 Ca -0.01 -2.00 -0.01 0.00 -1.81 0.00 0.00 61.98 58.15 2bsx s VAL 22 Cb -0.14 -2.41 -0.26 0.00 0.56 0.00 0.00 36.38 34.14 2bsx s VAL 22 CO 0.02 0.00 0.47 1.23 -0.31 0.00 0.00 175.10 176.51 2bsx h GLY 23 N 1.58 0.22 -6.41 2.32 0.00 -1.86 0.63 103.07 99.57 2bsx h GLY 23 Ca -0.42 -0.57 -0.64 0.00 0.00 0.00 0.00 47.33 45.70 2bsx h GLY 23 CO 0.72 0.50 -0.64 -0.35 0.00 0.00 0.00 176.54 176.76 2bsx s ASP 24 N -6.78 4.97 0.00 0.19 -1.08 -1.26 -1.13 116.67 111.58 2bsx s ASP 24 Ca -0.17 -0.15 0.23 0.00 -0.52 0.00 0.00 52.55 51.94 2bsx s ASP 24 Cb 0.07 -1.84 1.03 0.00 -1.46 0.00 0.00 42.92 40.72 2bsx s ASP 24 CO 0.79 0.09 1.73 -2.65 0.52 0.00 0.00 175.17 175.66 2bsx n PRO 25 N 4.05 0.12 0.04 4.34 -0.02 -1.26 -1.40 135.00 140.86 2bsx n PRO 25 Ca -0.17 0.10 0.13 0.00 -2.02 0.00 0.00 63.50 61.54 2bsx n PRO 25 Cb 0.52 -1.50 0.53 0.00 -0.02 0.00 0.00 33.50 33.03 2bsx n PRO 25 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2bsx n GLY 26 N 0.77 -1.55 0.00 -1.23 0.00 -1.26 -3.00 105.19 98.91 2bsx n GLY 26 Ca 0.07 -0.07 0.10 0.00 0.00 0.00 0.00 46.02 46.12 2bsx n GLY 26 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2bsx n ARG 27 N -1.78 0.40 0.11 1.61 5.12 -0.49 -3.02 116.66 118.61 2bsx n ARG 27 Ca 0.06 -0.06 0.03 0.00 -1.93 0.00 0.00 57.85 55.95 2bsx n ARG 27 Cb 0.36 -1.47 0.40 0.00 -1.16 0.00 0.00 32.46 30.60 2bsx n ARG 27 CO 0.00 0.00 0.00 0.28 -1.93 0.00 0.00 177.63 175.98 2bsx h VAL 28 N 0.00 1.16 0.09 1.55 2.07 -1.55 -2.75 116.25 116.82 2bsx h VAL 28 Ca 0.00 -0.69 -0.27 0.00 0.82 0.00 0.00 66.70 66.56 2bsx h VAL 28 Cb 0.64 1.14 0.01 0.00 -1.52 0.00 0.00 31.29 31.56 2bsx h VAL 28 CO 0.00 0.22 -1.16 0.44 0.02 0.00 0.00 177.57 177.09 2bsx h ASP 29 N 0.25 0.57 0.79 0.57 3.32 -1.62 -0.86 116.42 119.44 2bsx h ASP 29 Ca 0.05 -0.54 0.00 0.00 0.02 0.00 0.00 57.03 56.57 2bsx h ASP 29 Cb 0.32 -0.18 0.00 0.00 0.22 0.00 0.00 39.33 39.69 2bsx h ASP 29 CO 0.02 1.38 0.00 0.29 -1.72 0.00 0.00 179.24 179.20 2bsx n LYS 30 N -3.66 0.03 -0.14 3.56 5.02 -1.16 -2.50 118.16 119.31 2bsx n LYS 30 Ca -0.09 0.16 -0.25 0.00 -2.02 0.00 0.00 58.31 56.11 2bsx n LYS 30 Cb 0.96 -1.55 -0.11 0.00 -0.02 0.00 0.00 35.03 34.31 2bsx n LYS 30 CO 0.00 0.00 0.00 -0.89 -0.52 0.00 0.00 177.40 175.99 2bsx n ILE 31 N -1.61 1.51 -0.24 -0.18 5.41 -1.05 -3.88 119.36 119.33 2bsx n ILE 31 Ca 0.05 -0.47 0.22 0.00 1.00 0.00 0.00 62.75 63.55 2bsx n ILE 31 Cb 0.26 -1.67 0.38 0.00 -0.71 0.00 0.00 39.64 37.90 2bsx n ILE 31 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 176.55 177.72 2bsx n LYS 32 N -3.80 -0.03 0.03 0.38 4.81 -0.33 -2.13 118.16 117.09 2bsx n LYS 32 Ca -0.51 0.79 -0.18 0.00 -0.87 0.00 0.00 58.31 57.54 2bsx n LYS 32 Cb 0.93 -1.48 -0.08 0.00 0.02 0.00 0.00 35.03 34.43 2bsx n LYS 32 CO 0.00 0.00 0.00 0.28 1.17 0.00 0.00 177.40 178.85 2bsx h VAL 33 N 0.00 1.30 0.00 3.15 2.07 -1.60 -3.30 116.25 117.88 2bsx h VAL 33 Ca 0.52 -2.18 0.00 0.00 0.82 0.00 0.00 66.70 65.86 2bsx h VAL 33 Cb 1.52 2.24 0.00 0.00 -1.52 0.00 0.00 31.29 33.53 2bsx h VAL 33 CO -0.37 0.68 -0.37 1.33 0.02 0.00 0.00 177.57 178.85 2bsx n VAL 34 N -3.86 0.03 -1.01 2.57 0.24 -0.90 -4.88 118.33 110.51 2bsx n VAL 34 Ca -0.09 -0.02 -0.30 0.00 -2.04 0.00 0.00 64.34 61.90 2bsx n VAL 34 Cb 0.82 0.03 0.24 0.00 -1.47 0.00 0.00 33.84 33.46 2bsx n VAL 34 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 2bsx h ASP 36 N -2.59 0.36 -5.17 0.00 5.19 -1.34 -3.49 116.42 109.38 2bsx h ASP 36 Ca -0.47 -0.84 -0.06 0.00 -0.62 0.00 0.00 57.03 55.04 2bsx h ASP 36 Cb 1.30 -0.12 -0.12 0.00 0.18 0.00 0.00 39.33 40.58 2bsx h ASP 36 CO 0.37 1.62 -0.16 -0.94 -3.12 0.00 0.00 179.24 177.02 2bsx s SER 37 N -7.02 -0.10 0.21 6.45 1.04 -1.14 -5.04 113.70 108.11 2bsx s SER 37 Ca -0.20 -0.65 -0.07 0.00 0.48 0.00 0.00 55.95 55.50 2bsx s SER 37 Cb 0.05 0.49 -0.02 0.00 0.10 0.00 0.00 66.02 66.64 2bsx s SER 37 CO 0.76 -0.95 0.30 -0.72 0.98 0.00 0.00 173.24 173.61 2bsx s TYR 38 N -3.91 0.68 -0.18 5.02 -0.85 -1.26 -0.98 117.35 115.86 2bsx s TYR 38 Ca 0.12 -0.99 -0.03 0.00 -0.52 0.00 0.00 57.07 55.65 2bsx s TYR 38 Cb 0.01 -0.15 0.06 0.00 0.38 0.00 0.00 41.96 42.26 2bsx s TYR 38 CO -0.03 -0.80 0.04 0.08 -1.52 0.00 0.00 175.55 173.33 2bsx s VAL 39 N -4.06 0.42 0.23 -3.49 1.01 -0.37 -4.97 120.40 109.16 2bsx s VAL 39 Ca 0.28 -0.46 -0.30 0.00 0.00 0.00 0.00 61.98 61.49 2bsx s VAL 39 Cb 0.03 -0.93 -0.10 0.00 0.00 0.00 0.00 36.38 35.38 2bsx s VAL 39 CO 0.08 -0.20 1.39 -1.81 0.00 0.00 0.00 175.10 174.56 2bsx s ASP 40 N 1.91 6.75 -0.06 3.32 1.01 -1.26 0.47 116.67 128.80 2bsx s ASP 40 Ca -0.00 2.57 0.01 0.00 0.71 0.00 0.00 52.55 55.84 2bsx s ASP 40 Cb -0.17 -2.62 -0.04 0.00 1.01 0.00 0.00 42.92 41.10 2bsx s ASP 40 CO -0.08 -0.63 -0.05 0.18 0.21 0.00 0.00 175.17 174.80 2bsx n LEU 41 N 2.41 2.63 -3.62 1.23 4.77 -0.47 -4.92 117.00 119.03 2bsx n LEU 41 Ca 0.06 -0.03 -0.04 0.00 -0.03 0.00 0.00 56.01 55.97 2bsx n LEU 41 Cb 0.41 -0.18 -0.04 0.00 -2.33 0.00 0.00 43.42 41.28 2bsx n LEU 41 CO 0.59 0.55 1.07 0.00 -1.33 0.00 0.00 177.39 178.27 2bsx s ALA 42 N -2.13 -2.09 -0.30 -1.18 0.00 -1.19 -4.88 121.76 109.99 2bsx s ALA 42 Ca -0.08 1.80 -0.03 0.00 0.00 0.00 0.00 51.96 53.65 2bsx s ALA 42 Cb 0.02 -1.07 0.11 0.00 0.00 0.00 0.00 23.12 22.18 2bsx s ALA 42 CO 0.16 -0.33 0.14 -0.47 0.00 0.00 0.00 175.76 175.26 2bsx s TYR 43 N -1.33 0.47 -0.04 0.00 6.04 -1.26 0.16 117.35 121.38 2bsx s TYR 43 Ca 0.07 -1.07 0.06 0.00 0.04 0.00 0.00 57.07 56.18 2bsx s TYR 43 Cb -0.01 -0.95 -0.01 0.00 -1.04 0.00 0.00 41.96 39.95 2bsx s TYR 43 CO -0.05 -0.83 -0.24 1.21 -1.54 0.00 0.00 175.55 174.10 2bsx s ASN 44 N 1.88 2.85 0.00 4.32 2.47 -1.17 -4.97 114.94 120.32 2bsx s ASN 44 Ca 0.11 -0.46 0.00 0.00 0.42 0.00 0.00 52.86 52.93 2bsx s ASN 44 Cb -0.17 -0.61 0.00 0.00 -1.45 0.00 0.00 41.25 39.02 2bsx s ASN 44 CO -0.29 0.25 0.00 0.54 -3.72 0.00 0.00 177.10 173.88 2bsx n ARG 45 N 2.80 0.00 0.00 0.43 1.74 -1.26 0.43 116.66 120.81 2bsx n ARG 45 Ca -0.17 0.00 0.00 0.00 -0.77 0.00 0.00 57.85 56.91 2bsx n ARG 45 Cb 0.52 0.00 0.00 0.00 -1.02 0.00 0.00 32.46 31.96 2bsx n ARG 45 CO 0.00 0.00 0.00 0.39 -1.52 0.00 0.00 177.63 176.50 2bsx n GLU 46 N 4.83 0.00 -3.48 5.56 1.02 -1.26 -4.60 120.64 122.71 2bsx n GLU 46 Ca 0.00 0.00 -0.36 0.00 -0.02 0.00 0.00 57.16 56.78 2bsx n GLU 46 Cb 0.00 -1.34 -0.05 0.00 -0.02 0.00 0.00 31.44 30.03 2bsx n GLU 46 CO 0.00 0.00 0.00 0.66 1.18 0.00 0.00 177.13 178.97 2bsx n TYR 47 N -0.80 3.87 -2.64 -0.32 4.01 0.17 -3.96 117.16 117.50 2bsx n TYR 47 Ca 0.00 -3.87 -0.43 0.00 -0.16 0.00 0.00 57.90 53.44 2bsx n TYR 47 Cb 0.00 -1.10 -0.02 0.00 -0.31 0.00 0.00 39.34 37.91 2bsx n TYR 47 CO 0.00 0.00 0.00 0.21 -0.46 0.00 0.00 176.86 176.61 2bsx s LYS 48 N -1.79 4.32 0.20 -0.72 2.20 -1.26 -3.04 119.74 119.64 2bsx s LYS 48 Ca 0.30 1.42 0.08 0.00 -0.36 0.00 0.00 55.97 57.41 2bsx s LYS 48 Cb -0.02 -3.61 -0.04 0.00 -1.51 0.00 0.00 37.83 32.65 2bsx s LYS 48 CO -0.07 -0.52 -0.03 -1.12 -0.36 0.00 0.00 175.35 173.25 2bsx s SER 49 N 1.25 4.55 -0.28 1.43 0.01 0.12 -2.62 113.70 118.16 2bsx s SER 49 Ca 0.47 -0.52 -0.24 0.00 1.31 0.00 0.00 55.95 56.97 2bsx s SER 49 Cb -0.17 -0.88 0.13 0.00 0.21 0.00 0.00 66.02 65.31 2bsx s SER 49 CO 0.12 0.07 1.07 -0.69 0.41 0.00 0.00 173.24 174.21 2bsx s VAL 50 N -1.88 0.00 -0.38 3.43 1.01 -1.23 -1.37 120.40 119.97 2bsx s VAL 50 Ca 0.28 0.00 -0.15 0.00 0.00 0.00 0.00 61.98 62.10 2bsx s VAL 50 Cb -0.08 -1.00 0.00 0.00 0.00 0.00 0.00 36.38 35.30 2bsx s VAL 50 CO 0.18 0.00 0.36 -0.70 0.00 0.00 0.00 175.10 174.93 2bsx s GLU 51 N 0.29 3.28 0.09 2.72 2.12 0.18 -1.46 118.70 125.92 2bsx s GLU 51 Ca 0.03 -0.69 -0.16 0.00 0.36 0.00 0.00 54.97 54.51 2bsx s GLU 51 Cb -0.05 -3.89 -0.07 0.00 0.26 0.00 0.00 34.13 30.38 2bsx s GLU 51 CO -0.08 -0.67 0.53 0.00 -0.54 0.00 0.00 175.26 174.51 2bsx s HIS 53 N -1.25 2.68 -0.12 0.00 3.76 -0.15 -1.22 115.29 118.97 2bsx s HIS 53 Ca 0.32 -1.59 -0.10 0.00 -0.15 0.00 0.00 55.06 53.54 2bsx s HIS 53 Cb -0.17 -1.86 0.04 0.00 1.11 0.00 0.00 32.58 31.70 2bsx s HIS 53 CO 0.18 -0.79 0.32 -0.47 -0.85 0.00 0.00 174.74 173.13 2bsx s TYR 54 N 1.32 -0.39 -1.75 1.40 5.04 -0.15 -0.89 117.35 121.95 2bsx s TYR 54 Ca 0.05 0.91 -0.16 0.00 -2.44 0.00 0.00 57.07 55.42 2bsx s TYR 54 Cb -0.13 0.13 0.16 0.00 0.35 0.00 0.00 41.96 42.46 2bsx s TYR 54 CO -0.12 -0.21 0.48 1.63 -1.34 0.00 0.00 175.55 175.99 2bsx n LYS 55 N 3.38 -1.34 -0.27 4.97 5.02 -1.26 -1.47 118.16 127.19 2bsx n LYS 55 Ca -0.17 0.18 0.00 0.00 -2.02 0.00 0.00 58.31 56.30 2bsx n LYS 55 Cb 0.56 -4.50 0.00 0.00 -0.02 0.00 0.00 35.03 31.07 2bsx n LYS 55 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 2bsx n GLY 56 N -1.54 0.77 3.36 0.72 0.00 -1.26 -5.03 105.19 102.21 2bsx n GLY 56 Ca -0.02 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 45.76 2bsx n GLY 56 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 2bsx s GLN 57 N -0.65 1.35 0.01 1.61 1.11 -0.54 -5.11 119.66 117.45 2bsx s GLN 57 Ca 0.00 -1.43 0.05 0.00 0.01 0.00 0.00 55.36 53.99 2bsx s GLN 57 Cb 0.00 -1.52 -0.03 0.00 -1.01 0.00 0.00 33.01 30.45 2bsx s GLN 57 CO 0.00 0.32 -0.13 -1.59 0.01 0.00 0.00 175.29 173.90 2bsx s LYS 58 N -2.68 2.33 -0.13 2.91 -2.85 -1.26 -0.97 119.74 117.08 2bsx s LYS 58 Ca 0.17 -0.84 -0.29 0.00 -1.00 0.00 0.00 55.97 54.01 2bsx s LYS 58 Cb -0.07 -2.34 0.09 0.00 -2.06 0.00 0.00 37.83 33.45 2bsx s LYS 58 CO 0.08 0.58 0.79 -0.59 0.10 0.00 0.00 175.35 176.30 2bsx s PHE 59 N -0.93 -0.60 0.72 1.78 -0.12 -0.36 -4.78 117.98 113.69 2bsx s PHE 59 Ca 0.15 1.15 -0.13 0.00 -0.05 0.00 0.00 56.93 58.05 2bsx s PHE 59 Cb -0.11 0.39 0.03 0.00 -0.63 0.00 0.00 43.02 42.71 2bsx s PHE 59 CO 0.06 -0.48 1.12 -0.51 -0.05 0.00 0.00 175.22 175.36 2bsx s LEU 60 N -0.79 3.24 -0.21 -1.99 1.02 -1.13 -0.32 118.68 118.51 2bsx s LEU 60 Ca -0.06 2.00 -0.01 0.00 0.02 0.00 0.00 54.13 56.09 2bsx s LEU 60 Cb -0.01 -4.55 0.06 0.00 0.02 0.00 0.00 46.19 41.71 2bsx s LEU 60 CO 0.05 -1.93 -0.01 0.00 0.02 0.00 0.00 176.35 174.48 2bsx s VAL 62 N 1.65 0.99 -0.14 0.00 1.01 0.50 -3.57 120.40 120.85 2bsx s VAL 62 Ca -0.03 -0.47 -0.04 0.00 0.00 0.00 0.00 61.98 61.45 2bsx s VAL 62 Cb -0.18 -0.88 -0.03 0.00 0.00 0.00 0.00 36.38 35.30 2bsx s VAL 62 CO -0.07 0.30 -0.01 -0.94 0.00 0.00 0.00 175.10 174.39 2bsx s SER 63 N 0.20 5.10 -0.27 3.32 1.04 -1.08 -1.83 113.70 120.19 2bsx s SER 63 Ca -0.04 0.00 0.13 0.00 0.48 0.00 0.00 55.95 56.51 2bsx s SER 63 Cb -0.10 -1.71 0.80 0.00 0.10 0.00 0.00 66.02 65.11 2bsx s SER 63 CO 0.01 0.24 1.77 0.00 0.98 0.00 0.00 173.24 176.24 2bsx n HIS 64 N 3.08 2.22 -0.02 5.02 1.44 0.22 -4.07 115.22 123.11 2bsx n HIS 64 Ca -0.18 -0.89 0.00 0.00 -2.01 0.00 0.00 57.72 54.65 2bsx n HIS 64 Cb 0.53 -0.57 0.00 0.00 0.12 0.00 0.00 29.99 30.06 2bsx n HIS 64 CO 0.00 0.00 0.00 0.41 -2.81 0.00 0.00 176.34 173.94 2bsx n GLY 65 N 0.36 0.05 3.57 -1.39 0.00 -0.28 -3.37 105.19 104.13 2bsx n GLY 65 Ca 0.32 -0.10 -0.42 0.00 0.00 0.00 0.00 46.02 45.82 2bsx n GLY 65 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2bsx s VAL 66 N 0.00 4.73 0.00 1.61 1.01 -1.26 -4.71 120.40 121.78 2bsx s VAL 66 Ca 0.00 0.68 0.00 0.00 0.00 0.00 0.00 61.98 62.66 2bsx s VAL 66 Cb 0.00 -4.23 0.00 0.00 0.00 0.00 0.00 36.38 32.15 2bsx s VAL 66 CO 0.00 -0.51 0.00 0.61 0.00 0.00 0.00 175.10 175.20 2bsx n GLY 67 N 4.71 2.41 0.13 4.51 0.00 -1.26 -4.88 105.19 110.81 2bsx n GLY 67 Ca 0.02 -2.01 -0.17 0.00 0.00 0.00 0.00 46.02 43.86 2bsx n GLY 67 CO 0.00 0.00 0.00 1.76 0.00 0.00 0.00 173.32 175.08 2bsx h SER 68 N 0.00 0.57 0.16 1.61 0.02 -1.92 -1.18 113.55 112.80 2bsx h SER 68 Ca 0.00 -0.55 -0.18 0.00 -0.84 0.00 0.00 61.79 60.22 2bsx h SER 68 Cb 0.00 -0.18 -0.00 0.00 0.14 0.00 0.00 62.40 62.36 2bsx h SER 68 CO 0.00 1.39 -0.70 0.00 -1.14 0.00 0.00 176.83 176.39 2bsx h ALA 69 N 0.54 0.59 0.19 3.77 0.00 -1.95 0.34 119.26 122.74 2bsx h ALA 69 Ca -0.14 -0.58 -0.31 0.00 0.00 0.00 0.00 54.91 53.88 2bsx h ALA 69 Cb 1.87 -0.06 0.03 0.00 0.00 0.00 0.00 17.79 19.64 2bsx h ALA 69 CO 0.21 0.74 -1.31 0.78 0.00 0.00 0.00 179.25 179.66 2bsx h GLY 70 N 1.15 0.62 0.96 0.00 0.00 -1.89 -2.83 103.07 101.09 2bsx h GLY 70 Ca -0.02 -1.47 -0.05 0.00 0.00 0.00 0.00 47.33 45.79 2bsx h GLY 70 CO 0.12 1.29 0.11 0.00 0.00 0.00 0.00 176.54 178.06 2bsx h ALA 72 N 0.98 1.85 -0.32 0.00 0.00 -0.30 -1.20 119.26 120.26 2bsx h ALA 72 Ca 0.15 0.06 -0.13 0.00 0.00 0.00 0.00 54.91 54.99 2bsx h ALA 72 Cb 0.33 -0.07 -0.01 0.00 0.00 0.00 0.00 17.79 18.04 2bsx h ALA 72 CO 0.00 -0.20 -0.31 0.28 0.00 0.00 0.00 179.25 179.02 2bsx h VAL 73 N 0.66 1.28 0.75 0.00 2.07 -1.52 -0.34 116.25 119.15 2bsx h VAL 73 Ca 0.55 -1.45 -0.04 0.00 0.82 0.00 0.00 66.70 66.59 2bsx h VAL 73 Cb 1.00 1.37 0.01 0.00 -1.52 0.00 0.00 31.29 32.15 2bsx h VAL 73 CO -0.32 0.47 -0.36 0.00 0.02 0.00 0.00 177.57 177.38 2bsx h PHE 75 N -1.08 0.75 -0.45 0.00 0.04 -1.30 -2.28 116.94 112.61 2bsx h PHE 75 Ca -0.10 0.04 -0.08 0.00 2.80 0.00 0.00 57.97 60.62 2bsx h PHE 75 Cb 0.77 -0.20 -0.02 0.00 2.20 0.00 0.00 35.95 38.70 2bsx h PHE 75 CO 0.04 0.13 -0.05 0.93 -0.60 0.00 0.00 178.31 178.76 2bsx h GLU 76 N 0.58 0.77 0.00 1.51 4.39 -1.05 -2.48 114.58 118.29 2bsx h GLU 76 Ca 0.49 -0.22 -0.14 0.00 0.34 0.00 0.00 59.36 59.83 2bsx h GLU 76 Cb 0.77 -0.08 -0.02 0.00 -0.10 0.00 0.00 28.75 29.32 2bsx h GLU 76 CO -0.40 0.81 -0.64 0.93 -1.16 0.00 0.00 179.01 178.54 2bsx h GLU 77 N 0.71 0.00 0.36 2.33 5.08 -0.81 -2.65 114.58 119.61 2bsx h GLU 77 Ca 0.13 0.00 -0.02 0.00 -1.00 0.00 0.00 59.36 58.47 2bsx h GLU 77 Cb 0.50 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.75 2bsx h GLU 77 CO 0.03 0.64 -0.18 -0.07 -1.00 0.00 0.00 179.01 178.43 2bsx h LEU 78 N 0.00 -0.41 -1.21 1.33 3.38 -1.30 -3.17 115.31 113.93 2bsx h LEU 78 Ca -0.01 -0.15 -0.06 0.00 0.09 0.00 0.00 57.88 57.76 2bsx h LEU 78 Cb 1.22 0.11 -0.01 0.00 0.09 0.00 0.00 40.66 42.06 2bsx h LEU 78 CO 0.08 -0.03 -0.26 0.00 0.09 0.00 0.00 178.44 178.32 2bsx h GLN 80 N 0.00 0.00 0.00 0.00 4.20 -1.56 -3.29 115.11 114.46 2bsx h GLN 80 Ca -0.00 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.71 2bsx h GLN 80 Cb 0.72 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.50 2bsx h GLN 80 CO 0.03 0.23 -1.24 0.09 -0.67 0.00 0.00 178.83 177.28 2bsx n ASN 81 N -3.29 1.84 0.00 1.46 3.02 -0.77 -5.01 115.26 112.51 2bsx n ASN 81 Ca 0.01 -0.22 0.00 0.00 -0.03 0.00 0.00 54.58 54.34 2bsx n ASN 81 Cb 0.49 1.37 0.00 0.00 -0.61 0.00 0.00 39.78 41.03 2bsx n ASN 81 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2bsx n GLY 82 N 1.68 0.58 3.76 7.41 0.00 0.32 -4.93 105.19 114.01 2bsx n GLY 82 Ca -0.01 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.60 2bsx n GLY 82 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2bsx s ALA 83 N -0.58 3.46 -0.13 4.61 0.00 -0.80 -4.33 121.76 123.99 2bsx s ALA 83 Ca 0.00 1.06 0.13 0.00 0.00 0.00 0.00 51.96 53.15 2bsx s ALA 83 Cb 0.00 -3.41 -0.18 0.00 0.00 0.00 0.00 23.12 19.53 2bsx s ALA 83 CO 0.00 -0.41 0.08 1.63 0.00 0.00 0.00 175.76 177.06 2bsx n LYS 84 N 1.46 1.57 -3.82 0.00 4.76 0.21 -4.63 118.16 117.72 2bsx n LYS 84 Ca 0.01 -0.02 -0.14 0.00 -2.87 0.00 0.00 58.31 55.29 2bsx n LYS 84 Cb 0.43 -1.36 -0.15 0.00 -1.84 0.00 0.00 35.03 32.11 2bsx n LYS 84 CO 0.00 0.00 0.00 0.08 -1.37 0.00 0.00 177.40 176.11 2bsx s VAL 85 N -2.41 -0.01 -0.10 -0.18 1.01 -0.74 -1.05 120.40 116.92 2bsx s VAL 85 Ca -0.07 0.14 -0.02 0.00 0.00 0.00 0.00 61.98 62.03 2bsx s VAL 85 Cb 0.05 -0.09 0.04 0.00 0.00 0.00 0.00 36.38 36.38 2bsx s VAL 85 CO 0.58 0.07 0.04 -0.63 0.00 0.00 0.00 175.10 175.17 2bsx s ILE 86 N 0.79 0.14 -0.07 2.22 1.01 -0.20 -0.63 121.20 124.45 2bsx s ILE 86 Ca -0.07 0.08 0.03 0.00 0.00 0.00 0.00 60.65 60.69 2bsx s ILE 86 Cb -0.10 -0.48 -0.02 0.00 0.01 0.00 0.00 42.46 41.88 2bsx s ILE 86 CO -0.02 0.07 -0.15 -0.63 0.00 0.00 0.00 174.94 174.21 2bsx s ILE 87 N 2.06 3.00 -0.15 2.92 1.01 -1.04 -1.47 121.20 127.52 2bsx s ILE 87 Ca 0.04 -0.72 -0.05 0.00 0.00 0.00 0.00 60.65 59.92 2bsx s ILE 87 Cb -0.14 -2.20 -0.03 0.00 0.01 0.00 0.00 42.46 40.11 2bsx s ILE 87 CO -0.06 0.57 0.01 -0.60 0.00 0.00 0.00 174.94 174.86 2bsx s ARG 88 N -0.36 3.65 -0.08 2.79 3.52 -0.80 -1.82 118.95 125.85 2bsx s ARG 88 Ca 0.04 -0.43 0.03 0.00 -0.13 0.00 0.00 55.73 55.23 2bsx s ARG 88 Cb -0.12 -3.00 -0.02 0.00 -1.56 0.00 0.00 34.95 30.25 2bsx s ARG 88 CO 0.02 0.34 -0.17 0.00 -0.81 0.00 0.00 175.30 174.69 2bsx s ALA 89 N 0.12 2.52 0.00 6.12 0.00 -1.13 -0.76 121.76 128.62 2bsx s ALA 89 Ca 0.02 -0.96 0.00 0.00 0.00 0.00 0.00 51.96 51.02 2bsx s ALA 89 Cb -0.13 -0.99 0.00 0.00 0.00 0.00 0.00 23.12 22.00 2bsx s ALA 89 CO 0.02 0.39 0.00 0.41 0.00 0.00 0.00 175.76 176.58 2bsx n GLY 90 N 2.98 2.86 3.44 0.00 0.00 -0.49 -4.40 105.19 109.58 2bsx n GLY 90 Ca -0.18 -0.44 -0.22 0.00 0.00 0.00 0.00 46.02 45.18 2bsx n GLY 90 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2bsx s SER 91 N 2.00 3.00 0.24 1.61 1.04 -1.26 -1.37 113.70 118.96 2bsx s SER 91 Ca 0.00 -1.14 -0.20 0.00 0.48 0.00 0.00 55.95 55.10 2bsx s SER 91 Cb 0.00 -0.21 0.02 0.00 0.10 0.00 0.00 66.02 65.94 2bsx s SER 91 CO 0.00 -0.23 0.63 0.00 0.98 0.00 0.00 173.24 174.62 2bsx s GLY 93 N -2.90 1.56 0.05 0.00 0.00 -0.26 -0.00 107.32 105.77 2bsx s GLY 93 Ca 0.11 -1.35 -0.27 0.00 0.00 0.00 0.00 44.72 43.21 2bsx s GLY 93 CO 0.03 -1.38 0.83 -0.45 0.00 0.00 0.00 173.10 172.13 2bsx s SER 94 N -3.49 7.29 0.00 1.64 0.15 0.40 -0.32 113.70 119.38 2bsx s SER 94 Ca 0.32 1.54 0.24 0.00 0.70 0.00 0.00 55.95 58.75 2bsx s SER 94 Cb -0.09 -2.50 0.36 0.00 -1.71 0.00 0.00 66.02 62.08 2bsx s SER 94 CO 0.24 -0.04 1.33 0.18 1.20 0.00 0.00 173.24 176.15 2bsx n LEU 95 N 2.94 1.83 -3.08 3.45 4.77 -0.08 -4.08 117.00 122.75 2bsx n LEU 95 Ca -0.00 -0.62 -0.26 0.00 -0.03 0.00 0.00 56.01 55.10 2bsx n LEU 95 Cb 0.50 -0.04 -0.05 0.00 -2.33 0.00 0.00 43.42 41.51 2bsx n LEU 95 CO 0.49 0.33 0.08 0.00 -1.33 0.00 0.00 177.39 176.95 2bsx n GLN 96 N 0.02 2.75 -0.17 3.23 1.13 -1.23 -4.75 117.38 118.36 2bsx n GLN 96 Ca 0.12 -4.60 0.05 0.00 -1.94 0.00 0.00 57.00 50.63 2bsx n GLN 96 Cb 0.44 -2.15 0.10 0.00 0.11 0.00 0.00 30.24 28.75 2bsx n GLN 96 CO 0.00 0.00 0.00 -2.30 -1.44 0.00 0.00 177.06 173.32 2bsx n PRO 97 N 0.10 -0.04 -0.72 -1.09 -0.01 -1.26 -0.38 135.00 131.59 2bsx n PRO 97 Ca 0.30 0.73 0.05 0.00 -0.01 0.00 0.00 63.50 64.56 2bsx n PRO 97 Cb 0.43 -1.12 0.31 0.00 -0.01 0.00 0.00 33.50 33.11 2bsx n PRO 97 CO 0.00 0.00 0.00 -0.25 -0.01 0.00 0.00 175.50 175.24 2bsx n ASP 98 N -4.67 4.58 0.00 2.55 10.43 -1.26 -4.32 116.55 123.86 2bsx n ASP 98 Ca 0.09 -3.08 0.00 0.00 2.57 0.00 0.00 54.79 54.37 2bsx n ASP 98 Cb 0.30 -0.63 0.00 0.00 1.84 0.00 0.00 41.12 42.62 2bsx n ASP 98 CO 0.00 0.00 0.00 -0.11 -1.07 0.00 0.00 177.20 176.02 2bsx n LEU 99 N -0.13 1.80 -4.25 0.64 7.94 0.49 -4.99 117.00 118.50 2bsx n LEU 99 Ca 0.28 0.00 -0.39 0.00 -1.11 0.00 0.00 56.01 54.79 2bsx n LEU 99 Cb 1.10 0.00 -0.11 0.00 0.53 0.00 0.00 43.42 44.93 2bsx n LEU 99 CO 0.26 0.29 -0.18 -0.63 -1.11 0.00 0.00 177.39 176.02 2bsx s ILE 100 N -1.68 3.90 0.53 1.96 1.01 -0.59 -5.09 121.20 121.24 2bsx s ILE 100 Ca 0.00 -1.40 0.05 0.00 0.00 0.00 0.00 60.65 59.30 2bsx s ILE 100 Cb 0.00 -3.35 0.03 0.00 0.01 0.00 0.00 42.46 39.14 2bsx s ILE 100 CO 0.00 -0.40 0.34 -0.54 0.00 0.00 0.00 174.94 174.33 2bsx s LYS 101 N 1.37 2.25 -0.04 2.79 1.02 -1.26 -4.42 119.74 121.45 2bsx s LYS 101 Ca 0.02 -2.07 -0.33 0.00 0.02 0.00 0.00 55.97 53.61 2bsx s LYS 101 Cb -0.22 -2.01 -0.11 0.00 -0.52 0.00 0.00 37.83 34.97 2bsx s LYS 101 CO 0.01 -0.56 1.92 -2.13 -0.92 0.00 0.00 175.35 173.67 2bsx n ARG 102 N -1.67 2.43 0.00 1.68 0.63 -1.26 -2.11 116.66 116.36 2bsx n ARG 102 Ca -0.04 0.89 0.00 0.00 -0.92 0.00 0.00 57.85 57.78 2bsx n ARG 102 Cb 0.65 -2.78 0.00 0.00 0.45 0.00 0.00 32.46 30.78 2bsx n ARG 102 CO 0.00 0.00 0.00 0.41 -2.51 0.00 0.00 177.63 175.53 2bsx n GLY 103 N 4.46 0.77 3.73 5.14 0.00 -0.25 -4.97 105.19 114.07 2bsx n GLY 103 Ca 0.22 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.94 2bsx n GLY 103 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 2bsx s ASP 104 N -1.80 3.76 -0.09 1.61 -0.00 -0.90 -4.64 116.67 114.62 2bsx s ASP 104 Ca 0.00 1.57 0.03 0.00 -0.00 0.00 0.00 52.55 54.15 2bsx s ASP 104 Cb 0.00 -2.26 0.01 0.00 -0.00 0.00 0.00 42.92 40.67 2bsx s ASP 104 CO 0.00 -2.47 -0.17 -0.63 -0.00 0.00 0.00 175.17 171.90 2bsx s ILE 105 N -2.93 1.56 -0.06 0.77 1.01 -1.26 -1.36 121.20 118.93 2bsx s ILE 105 Ca 0.63 -0.72 0.02 0.00 0.00 0.00 0.00 60.65 60.57 2bsx s ILE 105 Cb -0.18 -1.39 -0.03 0.00 0.01 0.00 0.00 42.46 40.88 2bsx s ILE 105 CO 0.57 0.45 -0.09 0.00 0.00 0.00 0.00 174.94 175.86 2bsx s ILE 107 N -0.77 3.82 -0.05 0.00 1.01 0.70 -1.89 121.20 124.02 2bsx s ILE 107 Ca 0.12 -1.03 -0.04 0.00 0.00 0.00 0.00 60.65 59.71 2bsx s ILE 107 Cb -0.11 -3.12 -0.04 0.00 0.01 0.00 0.00 42.46 39.20 2bsx s ILE 107 CO 0.01 -0.12 0.14 0.00 0.00 0.00 0.00 174.94 174.97 2bsx n ASN 109 N 1.40 3.84 -4.01 0.00 0.23 -0.57 -4.04 115.26 112.11 2bsx n ASN 109 Ca -0.15 -0.07 -0.10 0.00 -0.53 0.00 0.00 54.58 53.73 2bsx n ASN 109 Cb 0.53 1.10 -0.08 0.00 -2.08 0.00 0.00 39.78 39.26 2bsx n ASN 109 CO 0.00 0.00 0.00 0.00 -0.93 0.00 0.00 177.26 176.33 2bsx s ALA 110 N -2.05 0.21 0.14 -2.53 0.00 -1.24 0.20 121.76 116.49 2bsx s ALA 110 Ca -0.01 -1.04 -0.10 0.00 0.00 0.00 0.00 51.96 50.81 2bsx s ALA 110 Cb 0.02 0.92 0.00 0.00 0.00 0.00 0.00 23.12 24.05 2bsx s ALA 110 CO 0.11 -0.63 0.28 0.00 0.00 0.00 0.00 175.76 175.51 2bsx s ALA 111 N -4.00 -0.22 0.11 0.00 0.00 -0.74 -1.43 121.76 115.48 2bsx s ALA 111 Ca 0.20 -0.68 -0.24 0.00 0.00 0.00 0.00 51.96 51.24 2bsx s ALA 111 Cb 0.04 0.73 -0.07 0.00 0.00 0.00 0.00 23.12 23.81 2bsx s ALA 111 CO 0.02 -0.61 0.72 0.08 0.00 0.00 0.00 175.76 175.97 2bsx s VAL 112 N -3.91 4.56 -1.23 0.00 1.01 0.20 -4.38 120.40 116.64 2bsx s VAL 112 Ca 0.11 1.57 -0.07 0.00 0.00 0.00 0.00 61.98 63.59 2bsx s VAL 112 Cb 0.03 -4.08 0.20 0.00 0.00 0.00 0.00 36.38 32.54 2bsx s VAL 112 CO -0.05 0.48 1.84 0.54 0.00 0.00 0.00 175.10 177.92 2bsx n ARG 113 N 1.98 4.02 -1.38 2.72 1.74 -1.26 -2.48 116.66 122.00 2bsx n ARG 113 Ca -0.06 -3.81 -0.35 0.00 -0.77 0.00 0.00 57.85 52.87 2bsx n ARG 113 Cb 0.50 -2.77 0.08 0.00 -1.02 0.00 0.00 32.46 29.24 2bsx n ARG 113 CO 0.00 0.00 0.00 -1.91 -1.52 0.00 0.00 177.63 174.20 2bsx n GLU 114 N 2.82 2.74 0.00 5.56 2.13 -1.23 -4.85 120.64 127.81 2bsx n GLU 114 Ca 0.39 -3.34 0.00 0.00 0.66 0.00 0.00 57.16 54.87 2bsx n GLU 114 Cb 0.34 -2.29 0.00 0.00 0.27 0.00 0.00 31.44 29.76 2bsx n GLU 114 CO 0.00 0.00 0.00 -0.40 -0.41 0.00 0.00 177.13 176.32 2bsx n ASP 115 N -0.90 0.00 0.00 4.31 5.75 -1.25 -2.68 116.55 121.77 2bsx n ASP 115 Ca 0.62 0.00 0.00 0.00 -0.01 0.00 0.00 54.79 55.40 2bsx n ASP 115 Cb 0.67 0.00 0.00 0.00 -1.03 0.00 0.00 41.12 40.76 2bsx n ASP 115 CO 0.00 0.00 0.00 -1.14 -0.11 0.00 0.00 177.20 175.95 2bsx n ARG 116 N 0.00 0.00 -0.45 0.11 3.00 -1.26 -4.87 116.66 113.18 2bsx n ARG 116 Ca 0.00 0.00 0.37 0.00 -0.00 0.00 0.00 57.85 58.22 2bsx n ARG 116 Cb 0.00 -0.43 0.66 0.00 0.00 0.00 0.00 32.46 32.69 2bsx n ARG 116 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.63 177.91 2bsx h VAL 117 N 0.00 0.12 0.19 5.15 2.07 -1.99 0.23 116.25 122.02 2bsx h VAL 117 Ca 0.00 -0.03 -0.30 0.00 0.82 0.00 0.00 66.70 67.19 2bsx h VAL 117 Cb 0.18 0.03 0.02 0.00 -1.52 0.00 0.00 31.29 30.01 2bsx h VAL 117 CO 0.00 0.01 -1.35 0.77 0.02 0.00 0.00 177.57 177.02 2bsx h SER 118 N 0.08 0.63 0.25 0.57 4.64 -1.92 -3.12 113.55 114.69 2bsx h SER 118 Ca 0.82 -0.68 0.00 0.00 -0.47 0.00 0.00 61.79 61.47 2bsx h SER 118 Cb 2.61 -0.21 0.00 0.00 -0.31 0.00 0.00 62.40 64.50 2bsx h SER 118 CO -0.40 1.53 0.00 1.41 -0.87 0.00 0.00 176.83 178.50 2bsx n HIS 119 N -3.63 0.10 0.80 4.77 -0.00 0.79 0.20 115.22 118.25 2bsx n HIS 119 Ca -0.12 0.04 0.09 0.00 -0.00 0.00 0.00 57.72 57.73 2bsx n HIS 119 Cb 1.06 -0.57 -0.11 0.00 -0.00 0.00 0.00 29.99 30.37 2bsx n HIS 119 CO 0.00 0.00 0.00 1.28 -0.00 0.00 0.00 176.34 177.62 2bsx n LEU 120 N -1.59 0.80 -0.12 2.41 4.77 -1.08 -4.25 117.00 117.93 2bsx n LEU 120 Ca 0.01 -0.45 -0.26 0.00 -0.03 0.00 0.00 56.01 55.28 2bsx n LEU 120 Cb 0.09 0.00 -0.10 0.00 -2.33 0.00 0.00 43.42 41.07 2bsx n LEU 120 CO 0.07 0.20 -1.04 0.18 -1.33 0.00 0.00 177.39 175.47 2bsx n LEU 121 N -1.51 1.92 -4.11 2.23 4.77 0.13 -5.08 117.00 115.35 2bsx n LEU 121 Ca 0.03 0.38 -0.11 0.00 -0.03 0.00 0.00 56.01 56.28 2bsx n LEU 121 Cb 0.31 -0.88 -0.08 0.00 -2.33 0.00 0.00 43.42 40.44 2bsx n LEU 121 CO 0.38 0.42 -0.06 -0.51 -1.33 0.00 0.00 177.39 176.29 2bsx s ILE 122 N -2.45 0.00 0.45 -0.08 1.10 0.54 -5.09 121.20 115.67 2bsx s ILE 122 Ca -0.34 -1.73 -0.20 0.00 -0.51 0.00 0.00 60.65 57.87 2bsx s ILE 122 Cb 0.11 -2.35 -0.10 0.00 0.15 0.00 0.00 42.46 40.26 2bsx s ILE 122 CO 0.53 -0.01 0.95 -1.00 -2.11 0.00 0.00 174.94 173.29 2bsx s HIS 123 N -4.09 3.35 -2.00 3.50 3.76 -1.26 -3.96 115.29 114.59 2bsx s HIS 123 Ca 0.31 1.56 0.07 0.00 -0.15 0.00 0.00 55.06 56.85 2bsx s HIS 123 Cb 0.04 -2.82 0.42 0.00 1.11 0.00 0.00 32.58 31.33 2bsx s HIS 123 CO 0.10 -0.17 0.84 0.41 -0.85 0.00 0.00 174.74 175.07 2bsx n GLY 124 N -0.89 -0.40 0.12 -2.22 0.00 -1.26 -2.49 105.19 98.05 2bsx n GLY 124 Ca 0.07 -0.04 -0.02 0.00 0.00 0.00 0.00 46.02 46.03 2bsx n GLY 124 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 2bsx h ASP 125 N 0.00 0.00 -2.77 1.61 3.32 -2.02 -3.45 116.42 113.11 2bsx h ASP 125 Ca 0.00 0.00 -0.58 0.00 0.02 0.00 0.00 57.03 56.47 2bsx h ASP 125 Cb 0.00 0.00 0.09 0.00 0.22 0.00 0.00 39.33 39.64 2bsx h ASP 125 CO 0.00 0.70 0.61 0.33 -1.72 0.00 0.00 179.24 179.16 2bsx n PHE 126 N -3.49 2.20 -2.24 4.55 -0.00 -1.04 -4.99 117.46 112.45 2bsx n PHE 126 Ca -0.00 0.44 -0.41 0.00 -0.00 0.00 0.00 57.45 57.48 2bsx n PHE 126 Cb 0.74 -2.46 -0.03 0.00 -0.00 0.00 0.00 39.48 37.73 2bsx n PHE 126 CO 0.00 0.00 0.00 -1.25 -0.00 0.00 0.00 176.76 175.51 2bsx s PRO 127 N -0.57 4.44 -0.42 -7.13 0.04 -1.26 -5.01 135.00 125.08 2bsx s PRO 127 Ca 0.67 2.06 -0.17 0.00 0.04 0.00 0.00 61.00 63.60 2bsx s PRO 127 Cb -0.63 -3.14 0.02 0.00 0.04 0.00 0.00 34.50 30.79 2bsx s PRO 127 CO 0.51 -0.11 0.42 0.00 0.04 0.00 0.00 177.00 177.86 2bsx s ALA 128 N -0.76 3.43 -0.01 8.56 0.00 -1.26 -4.84 121.76 126.88 2bsx s ALA 128 Ca 0.50 -1.54 0.02 0.00 0.00 0.00 0.00 51.96 50.93 2bsx s ALA 128 Cb -0.37 -3.03 -0.00 0.00 0.00 0.00 0.00 23.12 19.72 2bsx s ALA 128 CO 0.45 -1.58 -0.06 0.08 0.00 0.00 0.00 175.76 174.66 2bsx s VAL 129 N 2.08 0.47 0.88 0.00 1.01 -1.26 -1.80 120.40 121.78 2bsx s VAL 129 Ca 0.11 -0.23 -0.15 0.00 0.00 0.00 0.00 61.98 61.71 2bsx s VAL 129 Cb -0.17 -0.41 0.21 0.00 0.00 0.00 0.00 36.38 36.00 2bsx s VAL 129 CO 0.13 0.14 1.14 0.61 0.00 0.00 0.00 175.10 177.13 2bsx n GLY 130 N 3.08 -1.62 3.86 4.51 0.00 0.13 -4.84 105.19 110.31 2bsx n GLY 130 Ca -0.15 -1.68 -0.36 0.00 0.00 0.00 0.00 46.02 43.83 2bsx n GLY 130 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 2bsx s ASP 131 N -5.12 6.65 0.17 1.61 2.15 -0.66 -4.93 116.67 116.55 2bsx s ASP 131 Ca 0.66 0.78 -0.14 0.00 0.43 0.00 0.00 52.55 54.27 2bsx s ASP 131 Cb -0.02 -2.18 0.12 0.00 -0.30 0.00 0.00 42.92 40.54 2bsx s ASP 131 CO 0.46 0.27 1.77 0.15 -0.17 0.00 0.00 175.17 177.66 2bsx h PHE 132 N 4.29 0.36 0.17 -5.34 3.57 -1.96 -1.78 116.94 116.25 2bsx h PHE 132 Ca -0.51 0.02 0.00 0.00 3.53 0.00 0.00 57.97 61.01 2bsx h PHE 132 Cb 1.21 -0.10 -0.03 0.00 2.79 0.00 0.00 35.95 39.83 2bsx h PHE 132 CO 0.70 0.16 -0.35 -0.44 -2.23 0.00 0.00 178.31 176.15 2bsx h ASP 133 N 0.40 -1.01 -0.88 0.41 3.32 -1.96 1.00 116.42 117.70 2bsx h ASP 133 Ca 0.21 0.10 0.23 0.00 0.02 0.00 0.00 57.03 57.59 2bsx h ASP 133 Cb 0.15 0.36 -0.14 0.00 0.22 0.00 0.00 39.33 39.93 2bsx h ASP 133 CO -0.17 -0.39 0.29 0.58 -1.72 0.00 0.00 179.24 177.83 2bsx h VAL 134 N -0.56 0.36 -0.27 -1.35 2.07 -1.86 0.27 116.25 114.92 2bsx h VAL 134 Ca -0.02 -0.09 -0.15 0.00 0.82 0.00 0.00 66.70 67.26 2bsx h VAL 134 Cb 0.53 0.07 -0.01 0.00 -1.52 0.00 0.00 31.29 30.37 2bsx h VAL 134 CO -0.14 0.05 -0.45 0.22 0.02 0.00 0.00 177.57 177.26 2bsx h TYR 135 N 0.27 0.84 -0.07 1.57 3.20 -0.34 -1.69 116.97 120.75 2bsx h TYR 135 Ca 0.56 -0.27 -0.02 0.00 3.14 0.00 0.00 58.73 62.14 2bsx h TYR 135 Cb 1.12 -0.17 -0.00 0.00 1.54 0.00 0.00 36.73 39.21 2bsx h TYR 135 CO -0.21 1.02 -0.04 0.22 -1.64 0.00 0.00 178.16 177.50 2bsx h ASP 136 N 0.55 0.16 -0.17 -2.11 3.58 0.31 -2.18 116.42 116.56 2bsx h ASP 136 Ca 0.03 -0.42 -0.00 0.00 0.42 0.00 0.00 57.03 57.06 2bsx h ASP 136 Cb 1.00 -0.04 -0.01 0.00 1.72 0.00 0.00 39.33 42.00 2bsx h ASP 136 CO 0.09 0.55 0.09 0.71 -2.88 0.00 0.00 179.24 177.81 2bsx h THR 137 N -0.23 1.10 -0.93 2.25 1.35 -0.56 -0.34 112.91 115.55 2bsx h THR 137 Ca 0.02 -0.28 0.18 0.00 -0.55 0.00 0.00 66.41 65.78 2bsx h THR 137 Cb 0.49 0.97 -0.08 0.00 -1.73 0.00 0.00 68.15 67.80 2bsx h THR 137 CO 0.01 0.10 0.60 -0.07 -0.25 0.00 0.00 175.52 175.91 2bsx h LEU 138 N 0.18 0.60 -0.29 3.87 4.07 -1.37 -2.22 115.31 120.15 2bsx h LEU 138 Ca 0.06 0.06 -0.20 0.00 0.08 0.00 0.00 57.88 57.87 2bsx h LEU 138 Cb 0.07 -0.05 0.00 0.00 1.08 0.00 0.00 40.66 41.76 2bsx h LEU 138 CO -0.01 0.25 -0.75 0.78 -1.08 0.00 0.00 178.44 177.64 2bsx h ASN 139 N 0.60 0.72 1.44 -0.43 2.35 -0.43 -3.13 115.58 116.70 2bsx h ASN 139 Ca 0.50 -0.47 -0.11 0.00 -0.55 0.00 0.00 56.30 55.66 2bsx h ASN 139 Cb 0.96 -0.21 -0.02 0.00 0.05 0.00 0.00 38.32 39.10 2bsx h ASN 139 CO -0.24 1.24 -0.57 0.11 -1.65 0.00 0.00 177.43 176.32 2bsx h LYS 140 N 0.42 0.00 -0.66 0.81 6.56 -0.87 -3.02 116.57 119.82 2bsx h LYS 140 Ca -0.04 0.00 -0.01 0.00 -1.06 0.00 0.00 60.65 59.54 2bsx h LYS 140 Cb 1.35 0.00 -0.03 0.00 -0.57 0.00 0.00 32.23 32.98 2bsx h LYS 140 CO 0.14 0.53 0.37 0.00 -2.06 0.00 0.00 179.45 178.43 2bsx h ALA 142 N 1.18 1.50 0.00 0.00 0.00 -1.47 -0.49 119.26 119.98 2bsx h ALA 142 Ca 0.23 0.06 -0.13 0.00 0.00 0.00 0.00 54.91 55.07 2bsx h ALA 142 Cb 0.03 -0.11 -0.02 0.00 0.00 0.00 0.00 17.79 17.68 2bsx h ALA 142 CO -0.04 0.04 -0.73 0.37 0.00 0.00 0.00 179.25 178.90 2bsx h GLN 143 N 0.81 0.00 0.00 0.00 -0.00 -1.28 -0.76 115.11 113.88 2bsx h GLN 143 Ca 0.52 0.00 0.00 0.00 -0.00 0.00 0.00 58.65 59.17 2bsx h GLN 143 Cb 0.67 0.00 0.00 0.00 0.00 0.00 0.00 27.48 28.15 2bsx h GLN 143 CO -0.33 0.51 -0.23 0.93 0.00 0.00 0.00 178.83 179.71 2bsx h GLU 144 N 0.00 0.00 -0.47 1.69 5.08 -0.64 -3.20 114.58 117.04 2bsx h GLU 144 Ca -0.04 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.32 2bsx h GLU 144 Cb 1.46 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.71 2bsx h GLU 144 CO 0.07 0.00 0.00 1.28 -1.00 0.00 0.00 179.01 179.36 2bsx n LEU 145 N -2.81 3.29 -3.49 1.33 4.77 -0.23 -5.01 117.00 114.85 2bsx n LEU 145 Ca 0.03 -1.92 -0.25 0.00 -0.03 0.00 0.00 56.01 53.85 2bsx n LEU 145 Cb 0.51 -0.32 0.01 0.00 -2.33 0.00 0.00 43.42 41.30 2bsx n LEU 145 CO 0.35 0.81 -0.14 -3.20 -1.33 0.00 0.00 177.39 173.87 2bsx n ASN 146 N 0.99 -5.83 -3.41 -1.43 5.15 -0.88 -5.00 115.26 104.85 2bsx n ASN 146 Ca 0.17 -0.39 -0.10 0.00 -0.60 0.00 0.00 54.58 53.65 2bsx n ASN 146 Cb 0.50 -2.58 -0.09 0.00 -0.53 0.00 0.00 39.78 37.08 2bsx n ASN 146 CO 0.00 0.00 0.00 -0.69 1.40 0.00 0.00 177.26 177.97 2bsx s VAL 147 N -2.41 -0.56 0.21 3.44 1.01 -0.34 -5.03 120.40 116.71 2bsx s VAL 147 Ca 0.16 -0.04 -0.30 0.00 0.00 0.00 0.00 61.98 61.81 2bsx s VAL 147 Cb -0.02 -0.76 -0.16 0.00 0.00 0.00 0.00 36.38 35.44 2bsx s VAL 147 CO 0.86 -0.10 0.92 -2.65 0.00 0.00 0.00 175.10 174.12 2bsx n PRO 148 N 5.36 0.83 -3.96 2.72 -0.02 -1.26 -4.51 135.00 134.16 2bsx n PRO 148 Ca -0.04 0.29 -0.11 0.00 -2.02 0.00 0.00 63.50 61.62 2bsx n PRO 148 Cb 0.50 -1.60 -0.13 0.00 -0.02 0.00 0.00 33.50 32.25 2bsx n PRO 148 CO 0.00 0.00 0.00 0.14 1.98 0.00 0.00 175.50 177.62 2bsx s VAL 149 N -0.73 0.14 0.43 -1.45 -7.23 -1.26 -4.57 120.40 105.74 2bsx s VAL 149 Ca 0.66 -0.52 -0.04 0.00 -1.81 0.00 0.00 61.98 60.28 2bsx s VAL 149 Cb -0.84 -0.21 -0.04 0.00 0.56 0.00 0.00 36.38 35.85 2bsx s VAL 149 CO 0.56 -0.24 0.71 -0.36 -0.31 0.00 0.00 175.10 175.47 2bsx s PHE 150 N -0.77 3.54 0.27 2.82 0.08 0.26 -4.96 117.98 119.21 2bsx s PHE 150 Ca -0.08 0.70 0.12 0.00 0.12 0.00 0.00 56.93 57.79 2bsx s PHE 150 Cb -0.05 -2.19 -0.05 0.00 -0.57 0.00 0.00 43.02 40.15 2bsx s PHE 150 CO -0.00 -0.15 -0.20 -0.80 -0.10 0.00 0.00 175.22 173.97 2bsx s ASN 151 N -4.00 3.53 0.00 1.36 0.01 -1.26 -0.22 114.94 114.37 2bsx s ASN 151 Ca 0.45 -1.01 0.00 0.00 -0.71 0.00 0.00 52.86 51.60 2bsx s ASN 151 Cb -0.10 -0.29 0.00 0.00 0.41 0.00 0.00 41.25 41.27 2bsx s ASN 151 CO 0.41 0.04 0.00 0.61 -1.51 0.00 0.00 177.10 176.66 2bsx n GLY 152 N -0.49 -1.37 3.49 0.66 0.00 -1.14 -4.90 105.19 101.44 2bsx n GLY 152 Ca -0.06 -0.99 -0.34 0.00 0.00 0.00 0.00 46.02 44.64 2bsx n GLY 152 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2bsx s ILE 153 N -2.84 3.76 0.02 -0.61 1.01 -1.26 -1.51 121.20 119.76 2bsx s ILE 153 Ca 0.00 -0.41 0.01 0.00 0.00 0.00 0.00 60.65 60.25 2bsx s ILE 153 Cb 0.00 -2.63 -0.04 0.00 0.01 0.00 0.00 42.46 39.80 2bsx s ILE 153 CO 0.00 0.51 0.07 -0.55 0.00 0.00 0.00 174.94 174.97 2bsx s SER 154 N 0.25 5.57 -0.30 3.58 0.15 -0.52 0.72 113.70 123.16 2bsx s SER 154 Ca -0.04 0.09 -0.11 0.00 0.70 0.00 0.00 55.95 56.59 2bsx s SER 154 Cb -0.14 -1.56 -0.04 0.00 -1.71 0.00 0.00 66.02 62.57 2bsx s SER 154 CO 0.03 0.25 0.19 -0.69 1.20 0.00 0.00 173.24 174.22 2bsx s VAL 155 N -1.22 5.17 -1.22 4.45 1.01 -0.04 0.58 120.40 129.13 2bsx s VAL 155 Ca 0.24 -0.01 -0.11 0.00 0.00 0.00 0.00 61.98 62.10 2bsx s VAL 155 Cb -0.12 -3.53 0.19 0.00 0.00 0.00 0.00 36.38 32.92 2bsx s VAL 155 CO 0.15 0.17 1.58 -1.20 0.00 0.00 0.00 175.10 175.80 2bsx n SER 156 N 5.06 5.28 -4.73 3.32 7.64 -1.04 -0.97 113.62 128.18 2bsx n SER 156 Ca -0.14 -3.06 -0.41 0.00 1.01 0.00 0.00 58.87 56.27 2bsx n SER 156 Cb 0.51 -1.50 -0.04 0.00 -1.01 0.00 0.00 64.21 62.16 2bsx n SER 156 CO 0.00 0.00 0.00 -0.55 -3.01 0.00 0.00 175.04 171.48 2bsx s SER 157 N 1.68 7.43 0.37 6.43 0.15 -0.62 -3.56 113.70 125.58 2bsx s SER 157 Ca 0.40 1.71 0.26 0.00 0.70 0.00 0.00 55.95 59.02 2bsx s SER 157 Cb 0.02 -2.56 0.76 0.00 -1.71 0.00 0.00 66.02 62.52 2bsx s SER 157 CO 0.00 -0.08 1.74 0.44 1.20 0.00 0.00 173.24 176.55 2bsx h ASP 158 N 5.75 0.00 -3.62 5.45 5.19 -1.78 -3.40 116.42 124.01 2bsx h ASP 158 Ca -0.43 0.00 -0.66 0.00 -0.62 0.00 0.00 57.03 55.32 2bsx h ASP 158 Cb 1.21 0.00 -0.16 0.00 0.18 0.00 0.00 39.33 40.56 2bsx h ASP 158 CO 0.72 0.00 -0.16 -0.32 -3.12 0.00 0.00 179.24 176.36 2bsx s MET 159 N -3.28 3.51 -0.14 3.56 1.75 -1.26 -4.89 119.30 118.55 2bsx s MET 159 Ca 0.07 -0.35 -0.13 0.00 -1.25 0.00 0.00 55.69 54.02 2bsx s MET 159 Cb 0.08 -3.83 -0.24 0.00 2.84 0.00 0.00 34.83 33.68 2bsx s MET 159 CO 0.59 -0.64 0.37 -0.92 -0.65 0.00 0.00 175.02 173.76 2bsx h TYR 160 N 8.51 0.34 -3.26 4.11 5.03 -2.00 -3.42 116.97 126.29 2bsx h TYR 160 Ca -0.28 -0.25 -0.76 0.00 2.58 0.00 0.00 58.73 60.02 2bsx h TYR 160 Cb 1.13 -0.01 -0.26 0.00 1.55 0.00 0.00 36.73 39.14 2bsx h TYR 160 CO 0.69 1.66 -0.20 0.71 -1.32 0.00 0.00 178.16 179.70 2bsx s TYR 161 N -2.49 3.37 1.26 -3.82 1.51 -1.26 -5.08 117.35 110.84 2bsx s TYR 161 Ca -0.24 -1.54 -0.16 0.00 -1.01 0.00 0.00 57.07 54.12 2bsx s TYR 161 Cb 0.06 -3.74 0.31 0.00 -0.11 0.00 0.00 41.96 38.48 2bsx s TYR 161 CO 0.72 -1.01 1.00 -2.14 -1.11 0.00 0.00 175.55 173.01 2bsx s PRO 162 N 1.28 -1.64 0.30 -1.71 0.02 -1.26 -5.06 135.00 126.92 2bsx s PRO 162 Ca 0.06 0.55 0.06 0.00 0.02 0.00 0.00 61.00 61.70 2bsx s PRO 162 Cb -0.26 -1.49 -0.06 0.00 0.02 0.00 0.00 34.50 32.71 2bsx s PRO 162 CO 0.00 -4.13 -0.04 0.54 -0.33 0.00 0.00 177.00 173.05 2bsx s ASN 163 N -2.78 2.81 0.14 2.53 2.20 -1.26 -5.06 114.94 113.51 2bsx s ASN 163 Ca 0.69 -1.23 0.27 0.00 -0.94 0.00 0.00 52.86 51.64 2bsx s ASN 163 Cb -0.21 -0.18 0.96 0.00 -2.00 0.00 0.00 41.25 39.82 2bsx s ASN 163 CO 0.62 -0.39 1.83 2.29 -2.94 0.00 0.00 177.10 178.51 2bsx n LYS 164 N -0.63 0.17 -0.08 3.55 2.85 -1.26 -4.61 118.16 118.15 2bsx n LYS 164 Ca -0.05 0.14 -0.06 0.00 -1.05 0.00 0.00 58.31 57.29 2bsx n LYS 164 Cb 0.64 -1.70 -0.02 0.00 -0.65 0.00 0.00 35.03 33.30 2bsx n LYS 164 CO 0.00 0.00 0.00 -0.89 -0.05 0.00 0.00 177.40 176.46 2bsx n ILE 165 N -1.99 1.39 -3.42 0.58 5.41 -1.26 -4.95 119.36 115.12 2bsx n ILE 165 Ca 0.06 0.20 -0.38 0.00 1.00 0.00 0.00 62.75 63.63 2bsx n ILE 165 Cb 0.40 -2.34 -0.06 0.00 -0.71 0.00 0.00 39.64 36.93 2bsx n ILE 165 CO 0.00 0.00 0.00 -0.63 0.00 0.00 0.00 176.55 175.92 2bsx s ILE 166 N -2.46 4.92 -0.43 1.39 -1.09 -1.26 -5.02 121.20 117.25 2bsx s ILE 166 Ca -0.20 0.94 -0.40 0.00 -2.23 0.00 0.00 60.65 58.75 2bsx s ILE 166 Cb 0.03 -3.77 -0.16 0.00 -1.58 0.00 0.00 42.46 36.98 2bsx s ILE 166 CO 0.30 0.51 2.16 -2.65 -1.23 0.00 0.00 174.94 174.03 2bsx n PRO 167 N 1.61 0.47 -2.22 2.79 -0.02 -1.26 -4.66 135.00 131.70 2bsx n PRO 167 Ca -0.11 0.13 -0.42 0.00 -2.02 0.00 0.00 63.50 61.07 2bsx n PRO 167 Cb 0.52 -1.91 -0.03 0.00 -0.02 0.00 0.00 33.50 32.05 2bsx n PRO 167 CO 0.00 0.00 0.00 0.45 1.98 0.00 0.00 175.50 177.93 2bsx s SER 168 N 6.54 6.88 0.10 2.55 0.15 -1.26 -4.94 113.70 123.72 2bsx s SER 168 Ca 1.15 2.27 0.27 0.00 0.70 0.00 0.00 55.95 60.34 2bsx s SER 168 Cb -1.22 -2.59 1.01 0.00 -1.71 0.00 0.00 66.02 61.51 2bsx s SER 168 CO 0.59 -0.61 1.83 0.54 1.20 0.00 0.00 173.24 176.79 2bsx n ARG 169 N 3.91 0.13 -0.42 5.44 1.74 -1.26 -4.30 116.66 121.89 2bsx n ARG 169 Ca 0.11 0.13 0.34 0.00 -0.77 0.00 0.00 57.85 57.65 2bsx n ARG 169 Cb 0.43 -1.65 0.62 0.00 -1.02 0.00 0.00 32.46 30.84 2bsx n ARG 169 CO 0.00 0.00 0.00 -0.07 -1.52 0.00 0.00 177.63 176.04 2bsx h LEU 170 N 0.00 0.28 -0.18 0.55 3.38 -1.99 1.37 115.31 118.72 2bsx h LEU 170 Ca 0.00 0.13 -0.02 0.00 0.09 0.00 0.00 57.88 58.08 2bsx h LEU 170 Cb 0.59 0.10 -0.01 0.00 0.09 0.00 0.00 40.66 41.44 2bsx h LEU 170 CO 0.00 -0.13 0.03 -0.08 0.09 0.00 0.00 178.44 178.35 2bsx h GLU 171 N 0.15 0.30 -0.97 1.13 4.81 -1.99 -0.72 114.58 117.29 2bsx h GLU 171 Ca 0.77 -0.08 0.15 0.00 -0.13 0.00 0.00 59.36 60.08 2bsx h GLU 171 Cb 2.34 -0.04 -0.16 0.00 0.63 0.00 0.00 28.75 31.53 2bsx h GLU 171 CO -0.40 0.46 -0.38 -0.44 -0.73 0.00 0.00 179.01 177.52 2bsx h ASP 172 N 0.09 -1.38 0.98 1.04 5.19 0.15 0.44 116.42 122.93 2bsx h ASP 172 Ca 0.06 0.30 -0.13 0.00 -0.62 0.00 0.00 57.03 56.64 2bsx h ASP 172 Cb 0.30 0.74 -0.02 0.00 0.18 0.00 0.00 39.33 40.53 2bsx h ASP 172 CO 0.00 -0.29 -0.63 1.88 -3.12 0.00 0.00 179.24 177.08 2bsx h TYR 173 N -0.01 0.00 0.60 4.55 0.05 -1.20 -2.64 116.97 118.32 2bsx h TYR 173 Ca 0.35 0.00 -0.02 0.00 0.05 0.00 0.00 58.73 59.10 2bsx h TYR 173 Cb 0.60 0.00 -0.01 0.00 1.01 0.00 0.00 36.73 38.34 2bsx h TYR 173 CO -0.85 0.63 -0.42 1.03 -1.05 0.00 0.00 178.16 177.50 2bsx h SER 174 N 0.00 -1.09 -0.33 3.88 0.87 -0.25 -1.24 113.55 115.39 2bsx h SER 174 Ca -0.01 0.07 0.10 0.00 -1.23 0.00 0.00 61.79 60.72 2bsx h SER 174 Cb 1.28 0.33 -0.01 0.00 -0.44 0.00 0.00 62.40 63.56 2bsx h SER 174 CO 0.08 -0.62 0.59 0.11 -0.53 0.00 0.00 176.83 176.46 2bsx h LYS 175 N -0.97 0.00 -0.09 2.24 1.57 -0.92 0.46 116.57 118.86 2bsx h LYS 175 Ca -0.08 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.70 2bsx h LYS 175 Cb 0.80 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.11 2bsx h LYS 175 CO 0.05 0.00 0.00 0.00 -0.57 0.00 0.00 179.45 178.93 2bsx n ALA 176 N -2.09 2.52 -0.27 3.86 0.00 -0.90 -4.95 120.51 118.67 2bsx n ALA 176 Ca 0.06 -0.58 0.00 0.00 0.00 0.00 0.00 53.44 52.92 2bsx n ALA 176 Cb 0.73 -1.03 0.00 0.00 0.00 0.00 0.00 19.45 19.15 2bsx n ALA 176 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.50 177.59 2bsx n ASN 177 N 0.65 -0.45 -4.76 0.00 3.02 0.16 -5.03 115.26 108.85 2bsx n ASN 177 Ca 0.17 0.00 -0.37 0.00 -0.03 0.00 0.00 54.58 54.35 2bsx n ASN 177 Cb 0.44 -0.07 0.02 0.00 -0.61 0.00 0.00 39.78 39.56 2bsx n ASN 177 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2bsx s ALA 178 N -2.25 2.79 -0.23 5.41 0.00 -0.56 -4.77 121.76 122.16 2bsx s ALA 178 Ca 0.00 1.13 -0.03 0.00 0.00 0.00 0.00 51.96 53.06 2bsx s ALA 178 Cb 0.00 -3.48 -0.18 0.00 0.00 0.00 0.00 23.12 19.45 2bsx s ALA 178 CO 0.00 -1.11 -0.10 0.00 0.00 0.00 0.00 175.76 174.55 2bsx n ALA 179 N -1.01 1.26 -2.33 0.00 0.00 0.22 -4.60 120.51 114.06 2bsx n ALA 179 Ca 0.10 -0.97 -0.08 0.00 0.00 0.00 0.00 53.44 52.49 2bsx n ALA 179 Cb 0.47 -0.21 -0.09 0.00 0.00 0.00 0.00 19.45 19.62 2bsx n ALA 179 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 177.50 177.64 2bsx s VAL 180 N -2.52 0.17 -0.12 0.00 -7.23 -1.14 -0.91 120.40 108.65 2bsx s VAL 180 Ca -0.33 -1.54 0.03 0.00 -1.81 0.00 0.00 61.98 58.34 2bsx s VAL 180 Cb 0.09 -1.53 0.00 0.00 0.56 0.00 0.00 36.38 35.51 2bsx s VAL 180 CO 0.62 -0.75 -0.22 0.54 -0.31 0.00 0.00 175.10 174.97 2bsx s VAL 181 N -3.91 2.13 0.00 1.32 0.11 0.57 -0.86 120.40 119.76 2bsx s VAL 181 Ca 0.09 -0.98 0.00 0.00 -2.93 0.00 0.00 61.98 58.16 2bsx s VAL 181 Cb 0.06 -1.83 0.00 0.00 -1.53 0.00 0.00 36.38 33.08 2bsx s VAL 181 CO -0.08 0.55 0.00 -1.84 -3.33 0.00 0.00 175.10 170.40 2bsx n GLU 182 N 3.76 0.00 0.00 1.54 -0.00 -0.14 -1.10 120.64 124.69 2bsx n GLU 182 Ca -0.19 0.00 0.00 0.00 -0.00 0.00 0.00 57.16 56.97 2bsx n GLU 182 Cb 0.52 0.00 0.00 0.00 -0.00 0.00 0.00 31.44 31.96 2bsx n GLU 182 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 177.13 175.80 2bsx n MET 183 N 0.00 0.72 -0.00 3.44 2.81 -1.26 -1.60 117.12 121.23 2bsx n MET 183 Ca 0.00 0.00 0.02 0.00 -1.81 0.00 0.00 57.70 55.91 2bsx n MET 183 Cb 0.00 -0.96 -0.02 0.00 -0.71 0.00 0.00 33.22 31.52 2bsx n MET 183 CO 0.00 0.00 0.00 0.39 1.51 0.00 0.00 175.97 177.87 2bsx n GLU 184 N -1.43 5.38 0.04 0.03 4.71 -1.26 -4.24 120.64 123.86 2bsx n GLU 184 Ca 0.00 -0.00 -0.20 0.00 -0.01 0.00 0.00 57.16 56.95 2bsx n GLU 184 Cb 0.04 -0.71 -0.11 0.00 -1.01 0.00 0.00 31.44 29.65 2bsx n GLU 184 CO 0.00 0.00 0.00 1.25 0.09 0.00 0.00 177.13 178.47 2bsx h LEU 185 N 0.00 0.79 -1.09 -4.62 5.85 -1.93 -3.08 115.31 111.23 2bsx h LEU 185 Ca 0.00 -0.76 0.23 0.00 0.84 0.00 0.00 57.88 58.18 2bsx h LEU 185 Cb 0.09 -0.24 -0.11 0.00 0.37 0.00 0.00 40.66 40.77 2bsx h LEU 185 CO 0.00 1.46 0.62 0.00 -0.34 0.00 0.00 178.44 180.17 2bsx h ALA 186 N 0.35 1.84 -0.07 1.25 0.00 -1.90 -1.75 119.26 118.99 2bsx h ALA 186 Ca -0.12 0.09 -0.01 0.00 0.00 0.00 0.00 54.91 54.86 2bsx h ALA 186 Cb 1.62 -0.02 -0.00 0.00 0.00 0.00 0.00 17.79 19.38 2bsx h ALA 186 CO 0.18 -0.26 -0.01 1.15 0.00 0.00 0.00 179.25 180.31 2bsx h THR 187 N 0.61 1.28 -0.28 0.00 2.02 -1.90 -1.41 112.91 113.24 2bsx h THR 187 Ca 0.60 -0.88 0.06 0.00 0.77 0.00 0.00 66.41 66.96 2bsx h THR 187 Cb 1.15 1.72 -0.08 0.00 -1.74 0.00 0.00 68.15 69.20 2bsx h THR 187 CO -0.39 0.24 -0.44 0.25 0.37 0.00 0.00 175.52 175.55 2bsx h LEU 188 N -0.19 -1.42 -1.48 2.58 5.85 -1.48 -0.79 115.31 118.38 2bsx h LEU 188 Ca 0.02 0.20 0.02 0.00 0.84 0.00 0.00 57.88 58.96 2bsx h LEU 188 Cb 0.39 0.60 -0.03 0.00 0.37 0.00 0.00 40.66 41.99 2bsx h LEU 188 CO 0.01 -0.40 0.37 0.24 -0.34 0.00 0.00 178.44 178.32 2bsx h MET 189 N -0.41 0.67 0.03 1.25 2.86 -1.18 0.51 114.93 118.65 2bsx h MET 189 Ca 0.10 -0.04 -0.00 0.00 -2.06 0.00 0.00 59.70 57.70 2bsx h MET 189 Cb 0.61 -0.15 0.00 0.00 0.06 0.00 0.00 31.60 32.12 2bsx h MET 189 CO -0.49 0.44 -0.02 0.28 1.06 0.00 0.00 176.91 178.18 2bsx h VAL 190 N 0.69 1.25 -0.25 -2.22 2.07 -0.95 -2.50 116.25 114.33 2bsx h VAL 190 Ca 0.22 -1.76 0.06 0.00 0.82 0.00 0.00 66.70 66.04 2bsx h VAL 190 Cb 0.03 2.29 -0.07 0.00 -1.52 0.00 0.00 31.29 32.02 2bsx h VAL 190 CO -0.06 0.40 -0.27 0.40 0.02 0.00 0.00 177.57 178.06 2bsx h ILE 191 N -0.93 0.35 -0.49 4.57 2.04 -1.01 -0.31 117.51 121.73 2bsx h ILE 191 Ca -0.00 0.00 0.10 0.00 1.00 0.00 0.00 64.86 65.96 2bsx h ILE 191 Cb 0.68 0.35 -0.10 0.00 -0.74 0.00 0.00 36.82 37.01 2bsx h ILE 191 CO 0.01 0.00 -0.21 1.23 0.00 0.00 0.00 178.15 179.18 2bsx h GLY 192 N -0.27 0.16 0.77 5.37 0.00 -1.02 0.40 103.07 108.48 2bsx h GLY 192 Ca 0.14 0.27 0.05 0.00 0.00 0.00 0.00 47.33 47.79 2bsx h GLY 192 CO -0.41 -0.21 0.42 -0.84 0.00 0.00 0.00 176.54 175.50 2bsx h THR 193 N -0.10 1.03 -0.47 4.70 2.02 -0.91 0.39 112.91 119.57 2bsx h THR 193 Ca 0.23 -0.27 -0.12 0.00 0.77 0.00 0.00 66.41 67.03 2bsx h THR 193 Cb 0.46 0.17 -0.02 0.00 -1.74 0.00 0.00 68.15 67.03 2bsx h THR 193 CO -0.56 0.14 -0.16 -0.07 0.37 0.00 0.00 175.52 175.24 2bsx h LEU 194 N 0.79 0.93 -2.23 2.58 3.38 0.72 -3.14 115.31 118.34 2bsx h LEU 194 Ca 0.30 -0.32 0.00 0.00 0.09 0.00 0.00 57.88 57.95 2bsx h LEU 194 Cb 0.11 -0.25 0.00 0.00 0.09 0.00 0.00 40.66 40.61 2bsx h LEU 194 CO -0.15 1.08 0.00 0.54 0.09 0.00 0.00 178.44 180.00 2bsx n ARG 195 N -4.13 2.45 -2.39 1.13 1.74 0.12 -4.99 116.66 110.59 2bsx n ARG 195 Ca 0.01 -2.19 -0.04 0.00 -0.77 0.00 0.00 57.85 54.85 2bsx n ARG 195 Cb 0.42 -1.50 0.02 0.00 -1.02 0.00 0.00 32.46 30.38 2bsx n ARG 195 CO 0.00 0.00 0.00 1.63 -1.52 0.00 0.00 177.63 177.74 2bsx n LYS 196 N 1.45 -1.64 -4.83 5.56 5.02 0.11 -5.02 118.16 118.81 2bsx n LYS 196 Ca 0.18 0.20 -0.27 0.00 -2.02 0.00 0.00 58.31 56.41 2bsx n LYS 196 Cb 0.60 -3.31 -0.16 0.00 -0.02 0.00 0.00 35.03 32.14 2bsx n LYS 196 CO 0.00 0.00 0.00 0.08 -0.52 0.00 0.00 177.40 176.96 2bsx s VAL 197 N -3.09 1.46 -0.06 -0.18 1.01 0.41 -4.96 120.40 114.99 2bsx s VAL 197 Ca 0.02 -0.70 -0.24 0.00 0.00 0.00 0.00 61.98 61.06 2bsx s VAL 197 Cb -0.01 -1.27 -0.04 0.00 0.00 0.00 0.00 36.38 35.06 2bsx s VAL 197 CO 0.18 0.42 0.73 -0.54 0.00 0.00 0.00 175.10 175.89 2bsx s LYS 198 N 0.29 4.45 0.31 2.72 1.02 -0.21 -4.10 119.74 124.21 2bsx s LYS 198 Ca -0.10 0.94 0.06 0.00 0.02 0.00 0.00 55.97 56.89 2bsx s LYS 198 Cb -0.14 -3.45 -0.06 0.00 -0.52 0.00 0.00 37.83 33.66 2bsx s LYS 198 CO 0.04 0.05 -0.04 0.95 -0.92 0.00 0.00 175.35 175.43 2bsx s THR 199 N 0.83 1.66 0.32 2.17 -4.23 -1.26 -1.03 115.64 114.10 2bsx s THR 199 Ca 0.39 -2.10 -0.18 0.00 -1.18 0.00 0.00 61.69 58.62 2bsx s THR 199 Cb -0.18 -2.58 0.06 0.00 1.34 0.00 0.00 72.50 71.14 2bsx s THR 199 CO 0.19 -0.21 0.88 -0.83 -0.54 0.00 0.00 174.62 174.11 2bsx s GLY 200 N -3.49 0.28 -0.18 3.99 0.00 -0.54 -1.65 107.32 105.73 2bsx s GLY 200 Ca 0.32 -0.61 -0.29 0.00 0.00 0.00 0.00 44.72 44.13 2bsx s GLY 200 CO 0.14 0.65 1.03 -0.32 0.00 0.00 0.00 173.10 174.60 2bsx s GLY 201 N -3.19 -0.22 0.02 0.20 0.00 -1.26 -1.90 107.32 100.97 2bsx s GLY 201 Ca 0.18 2.17 -0.02 0.00 0.00 0.00 0.00 44.72 47.05 2bsx s GLY 201 CO 0.09 1.14 0.02 -1.50 0.00 0.00 0.00 173.10 172.85 2bsx s ILE 202 N -0.94 0.11 -0.15 0.90 2.07 0.06 -2.00 121.20 121.25 2bsx s ILE 202 Ca -0.00 -0.93 -0.15 0.00 -1.41 0.00 0.00 60.65 58.15 2bsx s ILE 202 Cb -0.01 -0.43 0.04 0.00 0.13 0.00 0.00 42.46 42.19 2bsx s ILE 202 CO -0.00 -0.51 0.42 -0.76 -1.91 0.00 0.00 174.94 172.18 2bsx s LEU 203 N -1.59 0.38 -0.14 8.50 1.43 -0.79 -1.39 118.68 125.08 2bsx s LEU 203 Ca -0.13 0.82 -0.06 0.00 -1.03 0.00 0.00 54.13 53.73 2bsx s LEU 203 Cb -0.08 1.47 -0.04 0.00 0.03 0.00 0.00 46.19 47.57 2bsx s LEU 203 CO -0.01 -0.17 0.05 -0.51 0.23 0.00 0.00 176.35 175.94 2bsx s ILE 204 N 0.14 4.69 -0.25 -0.59 2.07 -0.47 -1.63 121.20 125.16 2bsx s ILE 204 Ca -0.01 -0.08 -0.28 0.00 -1.41 0.00 0.00 60.65 58.86 2bsx s ILE 204 Cb -0.03 -3.06 -0.04 0.00 0.13 0.00 0.00 42.46 39.46 2bsx s ILE 204 CO 0.01 0.53 1.96 -0.69 -1.91 0.00 0.00 174.94 174.84 2bsx s VAL 205 N -0.18 3.28 -0.10 4.00 1.01 -0.46 -1.55 120.40 126.39 2bsx s VAL 205 Ca 0.07 0.30 -0.21 0.00 0.00 0.00 0.00 61.98 62.13 2bsx s VAL 205 Cb -0.12 -3.36 -0.18 0.00 0.00 0.00 0.00 36.38 32.72 2bsx s VAL 205 CO 0.01 -0.21 0.68 0.44 0.00 0.00 0.00 175.10 176.03 2bsx h ASP 206 N 13.39 -0.04 0.00 3.32 3.32 -0.78 -0.66 116.42 134.98 2bsx h ASP 206 Ca -0.38 -0.63 0.00 0.00 0.02 0.00 0.00 57.03 56.05 2bsx h ASP 206 Cb 1.20 0.01 0.00 0.00 0.22 0.00 0.00 39.33 40.76 2bsx h ASP 206 CO 0.99 0.73 0.00 0.61 -1.72 0.00 0.00 179.24 179.85 2bsx n GLY 207 N 1.31 3.21 2.71 2.75 0.00 -1.25 -4.80 105.19 109.12 2bsx n GLY 207 Ca -0.07 -0.56 -0.24 0.00 0.00 0.00 0.00 46.02 45.15 2bsx n GLY 207 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2bsx h PRO 209 N 8.36 0.00 0.00 0.00 0.13 -1.91 -2.25 132.00 136.33 2bsx h PRO 209 Ca -0.16 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.97 2bsx h PRO 209 Cb 1.13 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.26 2bsx h PRO 209 CO 0.25 0.00 0.00 0.74 -0.23 0.00 0.00 178.00 178.76 2bsx h PHE 210 N 0.00 0.00 0.00 1.56 0.04 -1.96 -3.33 116.94 113.25 2bsx h PHE 210 Ca 0.00 0.00 -0.02 0.00 2.80 0.00 0.00 57.97 60.75 2bsx h PHE 210 Cb 0.32 0.00 -0.04 0.00 2.20 0.00 0.00 35.95 38.44 2bsx h PHE 210 CO 0.00 0.00 -0.35 0.36 -0.60 0.00 0.00 178.31 177.72 2bsx n LYS 211 N -2.72 1.16 -0.18 1.51 2.85 -0.85 -4.75 118.16 115.18 2bsx n LYS 211 Ca 0.05 -2.67 0.09 0.00 -1.05 0.00 0.00 58.31 54.73 2bsx n LYS 211 Cb 0.48 -1.31 0.39 0.00 -0.65 0.00 0.00 35.03 33.95 2bsx n LYS 211 CO 0.00 0.00 0.00 -1.49 -0.05 0.00 0.00 177.40 175.86 2bsx h TRP 212 N 0.49 0.70 0.00 5.58 4.06 -1.67 -1.90 115.95 123.21 2bsx h TRP 212 Ca -0.02 0.02 0.00 0.00 2.06 0.00 0.00 58.89 60.95 2bsx h TRP 212 Cb 1.12 -0.23 0.00 0.00 -1.00 0.00 0.00 29.16 29.05 2bsx h TRP 212 CO 0.33 0.34 0.00 -0.40 -3.56 0.00 0.00 178.44 175.15 2bsx n ASP 213 N -4.49 0.00 0.00 -3.49 5.75 -1.26 -5.18 116.55 107.88 2bsx n ASP 213 Ca 0.12 -0.01 0.00 0.00 -0.01 0.00 0.00 54.79 54.89 2bsx n ASP 213 Cb 0.32 -0.24 0.00 0.00 -1.03 0.00 0.00 41.12 40.16 2bsx n ASP 213 CO 0.00 0.00 0.00 -0.62 -0.11 0.00 0.00 177.20 176.47 2bsx n GLU 214 N -1.24 0.00 -4.34 0.11 1.02 -0.72 -5.28 120.64 110.19 2bsx n GLU 214 Ca 0.08 0.00 -0.17 0.00 -0.02 0.00 0.00 57.16 57.04 2bsx n GLU 214 Cb 0.11 0.00 -0.10 0.00 -0.02 0.00 0.00 31.44 31.43 2bsx n GLU 214 CO 0.00 0.00 0.00 -0.51 1.18 0.00 0.00 177.13 177.80 2bsx s LEU 221 N 0.00 2.22 0.28 -4.62 1.43 -1.26 -5.11 118.68 111.63 2bsx s LEU 221 Ca 0.00 -1.22 0.08 0.00 -1.03 0.00 0.00 54.13 51.96 2bsx s LEU 221 Cb 0.00 -0.31 0.84 0.00 0.03 0.00 0.00 46.19 46.76 2bsx s LEU 221 CO 0.00 -0.50 1.34 0.52 0.23 0.00 0.00 176.35 177.94 2bsx n VAL 222 N -0.44 -0.36 0.31 -1.59 0.31 -1.26 -0.86 118.33 114.45 2bsx n VAL 222 Ca -0.05 1.82 0.17 0.00 -0.01 0.00 0.00 64.34 66.27 2bsx n VAL 222 Cb 0.64 -2.77 0.87 0.00 -0.91 0.00 0.00 33.84 31.66 2bsx n VAL 222 CO 0.00 0.00 0.00 -0.65 -1.32 0.00 0.00 176.83 174.86 2bsx h PRO 223 N 0.00 0.00 -0.31 5.55 0.11 -1.99 0.90 132.00 136.26 2bsx h PRO 223 Ca 0.60 0.00 -0.04 0.00 0.11 0.00 0.00 66.00 66.67 2bsx h PRO 223 Cb 1.39 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.49 2bsx h PRO 223 CO -0.75 0.00 0.05 1.25 -0.21 0.00 0.00 178.00 178.34 2bsx h HIS 224 N 0.00 0.54 -0.19 0.65 -0.00 -1.43 -0.21 115.15 114.51 2bsx h HIS 224 Ca 0.02 -0.08 -0.16 0.00 -0.00 0.00 0.00 60.37 60.15 2bsx h HIS 224 Cb 0.61 -0.15 -0.01 0.00 -0.00 0.00 0.00 27.41 27.86 2bsx h HIS 224 CO 0.00 0.60 -0.55 1.96 -0.00 0.00 0.00 177.93 179.93 2bsx h GLN 225 N 0.33 0.58 -0.80 5.26 1.08 0.48 -1.71 115.11 120.33 2bsx h GLN 225 Ca 0.09 -0.36 0.00 0.00 -1.45 0.00 0.00 58.65 56.93 2bsx h GLN 225 Cb 0.35 0.04 -0.04 0.00 -0.05 0.00 0.00 27.48 27.78 2bsx h GLN 225 CO 0.01 0.97 0.51 1.25 -0.95 0.00 0.00 178.83 180.62 2bsx h LEU 226 N 0.44 0.94 -0.35 1.46 6.46 -0.27 0.13 115.31 124.12 2bsx h LEU 226 Ca 0.01 -0.04 -0.01 0.00 -0.12 0.00 0.00 57.88 57.71 2bsx h LEU 226 Cb 1.10 -0.24 -0.02 0.00 -0.73 0.00 0.00 40.66 40.78 2bsx h LEU 226 CO 0.11 0.70 0.18 -0.08 -0.62 0.00 0.00 178.44 178.72 2bsx h GLU 227 N 1.09 0.50 -0.67 1.25 4.81 -0.75 -2.65 114.58 118.17 2bsx h GLU 227 Ca 0.29 -0.07 0.03 0.00 -0.13 0.00 0.00 59.36 59.48 2bsx h GLU 227 Cb -0.08 -0.09 -0.04 0.00 0.63 0.00 0.00 28.75 29.16 2bsx h GLU 227 CO -0.06 0.44 0.41 -0.91 -0.73 0.00 0.00 179.01 178.17 2bsx h ASN 228 N 0.43 0.68 -0.50 1.04 -0.26 -0.80 -2.75 115.58 113.42 2bsx h ASN 228 Ca 0.12 0.00 -0.10 0.00 -0.56 0.00 0.00 56.30 55.76 2bsx h ASN 228 Cb 0.10 -0.14 -0.02 0.00 -1.06 0.00 0.00 38.32 37.20 2bsx h ASN 228 CO -0.02 0.47 -0.09 -0.03 -1.06 0.00 0.00 177.43 176.70 2bsx h MET 229 N 0.81 0.94 -0.68 0.81 4.05 -0.88 -1.31 114.93 118.68 2bsx h MET 229 Ca 0.27 -0.35 0.03 0.00 -0.28 0.00 0.00 59.70 59.37 2bsx h MET 229 Cb 0.02 -0.06 -0.04 0.00 -0.80 0.00 0.00 31.60 30.72 2bsx h MET 229 CO -0.11 1.01 0.42 0.82 0.23 0.00 0.00 176.91 179.28 2bsx h ILE 230 N 0.80 1.08 0.00 1.77 1.08 -1.39 -1.60 117.51 119.24 2bsx h ILE 230 Ca 0.13 -0.28 -0.11 0.00 -0.39 0.00 0.00 64.86 64.21 2bsx h ILE 230 Cb 0.64 0.19 -0.02 0.00 -3.07 0.00 0.00 36.82 34.57 2bsx h ILE 230 CO 0.04 0.15 -0.52 0.11 -0.69 0.00 0.00 178.15 177.24 2bsx h LYS 231 N 0.82 0.00 -0.34 2.37 1.57 -1.13 0.91 116.57 120.77 2bsx h LYS 231 Ca 0.27 0.00 -0.11 0.00 -1.87 0.00 0.00 60.65 58.95 2bsx h LYS 231 Cb 0.03 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 32.33 2bsx h LYS 231 CO -0.11 0.52 -0.23 0.82 -0.57 0.00 0.00 179.45 179.87 2bsx h ILE 232 N 0.00 1.27 0.07 1.86 2.04 -1.05 -0.06 117.51 121.64 2bsx h ILE 232 Ca -0.01 -1.31 -0.15 0.00 1.00 0.00 0.00 64.86 64.39 2bsx h ILE 232 Cb 1.00 1.27 0.00 0.00 -0.74 0.00 0.00 36.82 38.35 2bsx h ILE 232 CO 0.07 0.43 -0.75 0.00 0.00 0.00 0.00 178.15 177.89 2bsx h ALA 233 N 1.16 0.05 -0.32 1.87 0.00 -0.49 -2.44 119.26 119.10 2bsx h ALA 233 Ca 0.08 -0.80 0.06 0.00 0.00 0.00 0.00 54.91 54.25 2bsx h ALA 233 Cb 0.71 0.25 -0.05 0.00 0.00 0.00 0.00 17.79 18.69 2bsx h ALA 233 CO 0.05 0.41 0.00 -0.07 0.00 0.00 0.00 179.25 179.64 2bsx h LEU 234 N -0.65 -0.13 -1.44 0.00 3.38 0.72 -1.68 115.31 115.52 2bsx h LEU 234 Ca -0.16 0.07 0.00 0.00 0.09 0.00 0.00 57.88 57.88 2bsx h LEU 234 Cb 1.41 0.13 -0.03 0.00 0.09 0.00 0.00 40.66 42.27 2bsx h LEU 234 CO 0.03 -0.03 0.34 1.23 0.09 0.00 0.00 178.44 180.10 2bsx h GLY 235 N 0.09 0.77 0.86 0.83 0.00 -1.07 -1.34 103.07 103.20 2bsx h GLY 235 Ca 0.16 -0.30 -0.09 0.00 0.00 0.00 0.00 47.33 47.10 2bsx h GLY 235 CO -0.26 0.29 -0.20 0.00 0.00 0.00 0.00 176.54 176.37 2bsx h ALA 236 N 1.64 0.33 -0.15 3.60 0.00 -1.29 0.62 119.26 124.01 2bsx h ALA 236 Ca 0.20 -0.36 -0.00 0.00 0.00 0.00 0.00 54.91 54.75 2bsx h ALA 236 Cb -0.06 -0.07 -0.01 0.00 0.00 0.00 0.00 17.79 17.66 2bsx h ALA 236 CO -0.04 0.26 0.08 0.00 0.00 0.00 0.00 179.25 179.56 2bsx h ALA 238 N 0.98 -0.83 -0.78 0.00 0.00 -1.30 0.27 119.26 117.61 2bsx h ALA 238 Ca 0.05 -0.06 0.15 0.00 0.00 0.00 0.00 54.91 55.05 2bsx h ALA 238 Cb 0.06 0.83 -0.15 0.00 0.00 0.00 0.00 17.79 18.53 2bsx h ALA 238 CO -0.01 -0.94 -0.22 0.87 0.00 0.00 0.00 179.25 178.95 2bsx h LYS 239 N -0.49 -0.02 0.00 0.00 1.57 -0.65 -2.05 116.57 114.94 2bsx h LYS 239 Ca 0.01 0.00 -0.07 0.00 -1.87 0.00 0.00 60.65 58.72 2bsx h LYS 239 Cb 0.52 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 32.82 2bsx h LYS 239 CO -0.26 -0.01 -0.32 -0.07 -0.57 0.00 0.00 179.45 178.22 2bsx h LEU 240 N -0.02 0.00 -0.27 2.94 3.38 0.60 -3.22 115.31 118.72 2bsx h LEU 240 Ca 0.36 0.00 -0.12 0.00 0.09 0.00 0.00 57.88 58.21 2bsx h LEU 240 Cb 0.58 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 41.31 2bsx h LEU 240 CO -0.81 0.32 -0.59 0.00 0.09 0.00 0.00 178.44 177.45 2bsx h ALA 241 N 1.68 0.69 -0.93 1.53 0.00 0.24 -3.31 119.26 119.16 2bsx h ALA 241 Ca -0.00 -0.54 0.25 0.00 0.00 0.00 0.00 54.91 54.62 2bsx h ALA 241 Cb 1.14 -0.09 -0.13 0.00 0.00 0.00 0.00 17.79 18.70 2bsx h ALA 241 CO 0.04 0.74 0.42 1.15 0.00 0.00 0.00 179.25 181.60 2bsx h THR 242 N 0.00 0.40 -0.22 0.00 2.02 -1.48 -2.20 112.91 111.43 2bsx h THR 242 Ca -0.01 -0.12 -0.13 0.00 0.77 0.00 0.00 66.41 66.92 2bsx h THR 242 Cb 1.34 0.01 -0.01 0.00 -1.74 0.00 0.00 68.15 67.75 2bsx h THR 242 CO 0.08 0.06 -0.42 0.11 0.37 0.00 0.00 175.52 175.72 2bsx h LYS 243 N 0.35 0.53 0.03 6.66 1.79 -1.77 -3.17 116.57 120.99 2bsx h LYS 243 Ca 0.61 -0.28 -0.29 0.00 -2.18 0.00 0.00 60.65 58.51 2bsx h LYS 243 Cb 1.23 0.01 -0.04 0.00 -1.58 0.00 0.00 32.23 31.86 2bsx h LYS 243 CO -0.57 0.86 -1.58 1.88 -1.08 0.00 0.00 179.45 178.95 2bsx h TYR 244 N 0.44 0.12 -0.10 -1.35 -1.99 -1.71 -3.46 116.97 108.91 2bsx h TYR 244 Ca 0.03 -0.09 -0.41 0.00 2.00 0.00 0.00 58.73 60.27 2bsx h TYR 244 Cb 0.92 -0.00 -0.09 0.00 2.00 0.00 0.00 36.73 39.56 2bsx h TYR 244 CO 0.04 1.14 1.78 0.00 -0.00 0.00 0.00 178.16 181.12 2bsx n ALA 245 N -2.58 0.69 0.00 3.88 0.00 -0.86 -4.31 120.51 117.34 2bsx n ALA 245 Ca -0.15 -0.61 0.00 0.00 0.00 0.00 0.00 53.44 52.67 2bsx n ALA 245 Cb 1.03 -2.43 0.00 0.00 0.00 0.00 0.00 19.45 18.05 2bsx n ALA 245 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 177.50 177.39 2bsx n LEU 246 N 9.02 0.00 0.00 0.00 -0.00 -1.26 -5.05 117.00 119.71 2bsx n LEU 246 Ca 0.64 0.00 0.00 0.00 -0.00 0.00 0.00 56.01 56.65 2bsx n LEU 246 Cb 0.13 0.00 0.00 0.00 -0.00 0.00 0.00 43.42 43.55 2bsx n LEU 246 CO 0.98 0.00 0.25 1.21 -0.00 0.00 0.00 177.39 179.82