#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1rbo s GLN 2 N 0.00 3.25 -0.21 2.12 -0.21 -1.26 -5.09 119.66 118.27 1rbo s GLN 2 Ca 0.00 -0.37 -0.14 0.00 0.02 0.00 0.00 55.36 54.87 1rbo s GLN 2 Cb 0.00 -2.99 -0.04 0.00 1.00 0.00 0.00 33.01 30.98 1rbo s GLN 2 CO 0.00 0.68 0.33 0.08 -2.12 0.00 0.00 175.29 174.26 1rbo s VAL 3 N -1.20 5.24 0.04 1.09 1.01 -1.26 -5.04 120.40 120.28 1rbo s VAL 3 Ca 0.23 0.57 -0.30 0.00 0.00 0.00 0.00 61.98 62.47 1rbo s VAL 3 Cb -0.12 -3.67 -0.07 0.00 0.00 0.00 0.00 36.38 32.52 1rbo s VAL 3 CO 0.14 0.28 1.59 0.86 0.00 0.00 0.00 175.10 177.96 1rbo s TRP 4 N 1.23 2.48 0.78 5.22 -0.11 -1.26 -4.94 118.94 122.34 1rbo s TRP 4 Ca 0.16 0.43 -0.15 0.00 1.22 0.00 0.00 56.10 57.76 1rbo s TRP 4 Cb -0.14 -3.88 0.01 0.00 -1.50 0.00 0.00 33.47 27.96 1rbo s TRP 4 CO 0.07 -3.51 0.77 -2.30 -4.62 0.00 0.00 176.95 167.36 1rbo n PRO 5 N 5.71 0.21 -0.05 5.86 -0.02 -1.26 -4.98 135.00 140.47 1rbo n PRO 5 Ca 0.15 0.13 -0.05 0.00 -2.02 0.00 0.00 63.50 61.71 1rbo n PRO 5 Cb 0.42 -2.07 -0.07 0.00 -0.02 0.00 0.00 33.50 31.76 1rbo n PRO 5 CO 0.00 0.00 0.00 1.51 1.98 0.00 0.00 175.50 178.99 1rbo n ILE 6 N -2.85 0.63 -3.77 4.25 0.13 -1.26 -4.91 119.36 111.58 1rbo n ILE 6 Ca 0.11 -0.36 -0.37 0.00 -1.10 0.00 0.00 62.75 61.03 1rbo n ILE 6 Cb 0.51 -0.79 -0.06 0.00 -0.84 0.00 0.00 39.64 38.46 1rbo n ILE 6 CO 0.00 0.00 0.00 -0.76 2.80 0.00 0.00 176.55 178.59 1rbo s LEU 7 N -4.87 4.41 -1.51 9.51 1.43 -1.26 -4.41 118.68 121.97 1rbo s LEU 7 Ca -0.07 0.60 -0.10 0.00 -1.03 0.00 0.00 54.13 53.53 1rbo s LEU 7 Cb 0.03 -2.33 0.07 0.00 0.03 0.00 0.00 46.19 44.00 1rbo s LEU 7 CO 0.35 0.35 0.81 0.59 0.23 0.00 0.00 176.35 178.69 1rbo n ASN 8 N 1.73 -3.19 -1.55 2.29 3.02 -1.26 -4.89 115.26 111.41 1rbo n ASN 8 Ca -0.17 -0.87 -0.14 0.00 -0.03 0.00 0.00 54.58 53.37 1rbo n ASN 8 Cb 0.54 -3.55 0.09 0.00 -0.61 0.00 0.00 39.78 36.25 1rbo n ASN 8 CO 0.00 0.00 0.00 0.18 -2.62 0.00 0.00 177.26 174.82 1rbo n LEU 9 N -4.51 4.29 -4.76 3.41 7.99 -1.26 -5.05 117.00 117.10 1rbo n LEU 9 Ca -0.06 -4.43 -0.39 0.00 -0.01 0.00 0.00 56.01 51.12 1rbo n LEU 9 Cb 0.57 -0.43 0.02 0.00 -0.11 0.00 0.00 43.42 43.46 1rbo n LEU 9 CO 0.77 1.83 0.99 -0.54 -1.51 0.00 0.00 177.39 178.92 1rbo s LYS 10 N -3.48 3.60 0.41 3.23 -0.14 -1.26 -5.02 119.74 117.08 1rbo s LYS 10 Ca 0.47 2.22 0.07 0.00 -1.36 0.00 0.00 55.97 57.37 1rbo s LYS 10 Cb 0.40 -2.53 -0.07 0.00 -1.68 0.00 0.00 37.83 33.95 1rbo s LYS 10 CO 0.00 -0.81 0.05 0.15 -0.76 0.00 0.00 175.35 173.98 1rbo s LYS 11 N -2.56 2.03 -0.24 1.68 -0.14 -1.26 -5.08 119.74 114.16 1rbo s LYS 11 Ca 0.63 -2.04 0.16 0.00 -1.36 0.00 0.00 55.97 53.37 1rbo s LYS 11 Cb -0.39 -1.73 0.48 0.00 -1.68 0.00 0.00 37.83 34.51 1rbo s LYS 11 CO 0.49 -0.07 1.15 0.66 -0.76 0.00 0.00 175.35 176.83 1rbo n TYR 12 N -1.04 1.61 -4.76 3.18 4.01 -1.26 -5.09 117.16 113.81 1rbo n TYR 12 Ca -0.04 -1.97 0.00 0.00 -0.16 0.00 0.00 57.90 55.73 1rbo n TYR 12 Cb 0.66 -0.27 0.00 0.00 -0.31 0.00 0.00 39.34 39.43 1rbo n TYR 12 CO 0.00 0.00 0.00 0.39 -0.46 0.00 0.00 176.86 176.79 1rbo n GLU 13 N -0.58 0.00 -1.70 -0.72 -0.58 -1.26 -4.50 120.64 111.30 1rbo n GLU 13 Ca 0.22 0.00 -0.57 0.00 -0.42 0.00 0.00 57.16 56.38 1rbo n GLU 13 Cb 0.89 0.00 -0.07 0.00 -0.57 0.00 0.00 31.44 31.69 1rbo n GLU 13 CO 0.00 0.00 0.00 2.41 -0.48 0.00 0.00 177.13 179.06 1rbo n THR 14 N 0.00 0.25 -0.22 2.62 -1.04 -1.26 -1.58 114.28 113.04 1rbo n THR 14 Ca 0.00 -0.04 0.00 0.00 -2.04 0.00 0.00 64.05 61.97 1rbo n THR 14 Cb 0.00 -1.12 0.00 0.00 -1.82 0.00 0.00 70.33 67.39 1rbo n THR 14 CO 0.00 0.00 0.00 0.18 -0.64 0.00 0.00 175.07 174.61 1rbo n LEU 15 N 4.91 0.00 0.00 -4.42 4.77 -1.26 -4.56 117.00 116.44 1rbo n LEU 15 Ca 0.26 0.00 0.09 0.00 -0.03 0.00 0.00 56.01 56.33 1rbo n LEU 15 Cb 0.13 0.00 0.46 0.00 -2.33 0.00 0.00 43.42 41.68 1rbo n LEU 15 CO 0.79 0.00 0.80 -1.54 -1.33 0.00 0.00 177.39 176.10 1rbo n SER 16 N 0.00 0.00 -1.02 -1.43 3.41 -0.62 -2.33 113.62 111.64 1rbo n SER 16 Ca 0.00 0.15 0.12 0.00 -0.26 0.00 0.00 58.87 58.88 1rbo n SER 16 Cb 0.00 -0.35 0.19 0.00 -0.26 0.00 0.00 64.21 63.79 1rbo n SER 16 CO 0.00 0.00 0.00 -1.22 -0.16 0.00 0.00 175.04 173.66 1rbo n TYR 17 N -1.35 0.26 -3.35 7.33 4.02 -1.26 -4.79 117.16 118.02 1rbo n TYR 17 Ca 0.08 -0.13 -0.20 0.00 -0.01 0.00 0.00 57.90 57.64 1rbo n TYR 17 Cb 0.17 0.00 -0.00 0.00 -0.02 0.00 0.00 39.34 39.49 1rbo n TYR 17 CO 0.00 0.00 0.00 -0.51 -1.01 0.00 0.00 176.86 175.34 1rbo s LEU 18 N -1.73 3.89 0.68 7.72 1.43 -0.98 -5.07 118.68 124.62 1rbo s LEU 18 Ca 0.34 -0.07 -0.17 0.00 -1.03 0.00 0.00 54.13 53.21 1rbo s LEU 18 Cb 0.21 -2.85 0.01 0.00 0.03 0.00 0.00 46.19 43.59 1rbo s LEU 18 CO 0.31 -0.50 1.24 -2.84 0.23 0.00 0.00 176.35 174.78 1rbo s PRO 19 N -4.27 2.40 0.29 1.29 0.02 -1.26 -4.87 135.00 128.60 1rbo s PRO 19 Ca 0.46 1.87 -0.28 0.00 0.02 0.00 0.00 61.00 63.07 1rbo s PRO 19 Cb -0.10 -1.85 -0.14 0.00 0.02 0.00 0.00 34.50 32.43 1rbo s PRO 19 CO 0.33 -1.66 1.08 -0.35 -0.33 0.00 0.00 177.00 176.07 1rbo n PRO 20 N -2.27 1.50 -2.12 5.54 -0.04 -1.26 -4.89 135.00 131.46 1rbo n PRO 20 Ca 0.14 0.53 -0.41 0.00 -0.04 0.00 0.00 63.50 63.72 1rbo n PRO 20 Cb 0.49 -1.95 -0.03 0.00 -0.04 0.00 0.00 33.50 31.98 1rbo n PRO 20 CO 0.00 0.00 0.00 -0.51 -0.04 0.00 0.00 175.50 174.95 1rbo s LEU 21 N 0.20 4.40 0.80 1.53 1.43 -1.26 -5.03 118.68 120.76 1rbo s LEU 21 Ca 0.59 2.54 -0.10 0.00 -1.03 0.00 0.00 54.13 56.13 1rbo s LEU 21 Cb -0.69 -3.62 0.10 0.00 0.03 0.00 0.00 46.19 42.02 1rbo s LEU 21 CO 0.59 -0.60 1.14 0.42 0.23 0.00 0.00 176.35 178.13 1rbo s THR 22 N -0.03 2.10 0.21 5.49 -4.23 -1.26 -4.80 115.64 113.12 1rbo s THR 22 Ca 0.57 -0.13 -0.09 0.00 -1.18 0.00 0.00 61.69 60.86 1rbo s THR 22 Cb -0.39 -2.97 0.15 0.00 1.34 0.00 0.00 72.50 70.62 1rbo s THR 22 CO 0.41 0.00 1.74 0.74 -0.54 0.00 0.00 174.62 176.98 1rbo h THR 23 N -0.99 0.77 -0.44 3.99 2.02 -1.99 0.48 112.91 116.74 1rbo h THR 23 Ca -0.45 -0.14 -0.10 0.00 0.77 0.00 0.00 66.41 66.49 1rbo h THR 23 Cb 1.30 0.32 -0.02 0.00 -1.74 0.00 0.00 68.15 68.01 1rbo h THR 23 CO 0.57 0.08 -0.13 0.44 0.37 0.00 0.00 175.52 176.84 1rbo h ASP 24 N 0.41 0.82 -0.34 4.18 3.32 -1.99 -1.40 116.42 121.42 1rbo h ASP 24 Ca 0.31 -0.26 -0.10 0.00 0.02 0.00 0.00 57.03 57.00 1rbo h ASP 24 Cb 0.39 -0.22 -0.02 0.00 0.22 0.00 0.00 39.33 39.70 1rbo h ASP 24 CO -0.31 0.96 -0.15 1.56 -1.72 0.00 0.00 179.24 179.58 1rbo h GLN 25 N 0.74 0.79 -0.05 3.56 4.20 -1.58 -1.26 115.11 121.50 1rbo h GLN 25 Ca 0.12 -0.28 -0.01 0.00 0.06 0.00 0.00 58.65 58.54 1rbo h GLN 25 Cb 0.63 -0.06 -0.00 0.00 0.30 0.00 0.00 27.48 28.36 1rbo h GLN 25 CO 0.04 0.90 0.01 1.25 -0.67 0.00 0.00 178.83 180.36 1rbo h LEU 26 N 0.71 0.07 -1.25 1.46 5.85 -0.75 -2.49 115.31 118.91 1rbo h LEU 26 Ca 0.11 -0.26 0.09 0.00 0.84 0.00 0.00 57.88 58.66 1rbo h LEU 26 Cb 0.64 -0.02 -0.06 0.00 0.37 0.00 0.00 40.66 41.60 1rbo h LEU 26 CO 0.05 0.31 0.55 0.00 -0.34 0.00 0.00 178.44 179.01 1rbo h ALA 27 N 0.76 1.65 -0.77 1.25 0.00 -1.07 -1.16 119.26 119.92 1rbo h ALA 27 Ca 0.01 -0.01 -0.04 0.00 0.00 0.00 0.00 54.91 54.87 1rbo h ALA 27 Cb 0.27 -0.21 -0.03 0.00 0.00 0.00 0.00 17.79 17.82 1rbo h ALA 27 CO 0.00 0.19 0.31 0.00 0.00 0.00 0.00 179.25 179.76 1rbo h ARG 28 N 0.86 1.15 -0.66 0.00 2.47 -0.99 -0.25 114.38 116.95 1rbo h ARG 28 Ca 0.38 -0.20 -0.07 0.00 -1.26 0.00 0.00 59.98 58.83 1rbo h ARG 28 Cb 0.35 -0.19 -0.03 0.00 -1.65 0.00 0.00 29.97 28.46 1rbo h ARG 28 CO -0.15 0.92 0.12 1.96 0.56 0.00 0.00 179.97 183.39 1rbo h GLN 29 N 1.12 1.08 -0.57 0.04 1.08 -0.78 -1.34 115.11 115.74 1rbo h GLN 29 Ca 0.26 -0.28 -0.10 0.00 -1.45 0.00 0.00 58.65 57.08 1rbo h GLN 29 Cb 0.20 -0.13 -0.02 0.00 -0.05 0.00 0.00 27.48 27.48 1rbo h GLN 29 CO -0.02 0.99 -0.02 0.28 -0.95 0.00 0.00 178.83 179.10 1rbo h VAL 30 N 1.01 1.26 -0.66 -0.54 2.07 -1.01 -2.13 116.25 116.25 1rbo h VAL 30 Ca 0.20 -1.15 -0.00 0.00 0.82 0.00 0.00 66.70 66.57 1rbo h VAL 30 Cb 0.42 0.85 -0.03 0.00 -1.52 0.00 0.00 31.29 31.00 1rbo h VAL 30 CO 0.01 0.41 0.40 0.44 0.02 0.00 0.00 177.57 178.85 1rbo h ASP 31 N 0.92 0.80 -0.53 0.57 3.32 -0.76 -1.64 116.42 119.09 1rbo h ASP 31 Ca 0.16 -0.06 0.03 0.00 0.02 0.00 0.00 57.03 57.18 1rbo h ASP 31 Cb 0.56 -0.20 -0.04 0.00 0.22 0.00 0.00 39.33 39.87 1rbo h ASP 31 CO 0.03 0.62 0.30 0.22 -1.72 0.00 0.00 179.24 178.70 1rbo h TYR 32 N 0.90 0.55 -0.41 4.55 3.20 -0.86 0.21 116.97 125.11 1rbo h TYR 32 Ca 0.24 0.02 -0.02 0.00 3.14 0.00 0.00 58.73 62.11 1rbo h TYR 32 Cb -0.02 -0.17 -0.02 0.00 1.54 0.00 0.00 36.73 38.06 1rbo h TYR 32 CO -0.02 0.30 0.19 1.25 -1.64 0.00 0.00 178.16 178.24 1rbo h LEU 33 N 0.58 0.54 -0.59 2.82 5.85 -0.95 -2.54 115.31 121.03 1rbo h LEU 33 Ca 0.22 -0.13 -0.14 0.00 0.84 0.00 0.00 57.88 58.67 1rbo h LEU 33 Cb 0.08 -0.14 -0.01 0.00 0.37 0.00 0.00 40.66 40.96 1rbo h LEU 33 CO -0.13 0.53 -0.44 -0.07 -0.34 0.00 0.00 178.44 177.99 1rbo h LEU 34 N 0.52 0.67 -1.79 2.25 3.38 -0.97 -2.28 115.31 117.09 1rbo h LEU 34 Ca 0.14 -0.31 -0.03 0.00 0.09 0.00 0.00 57.88 57.76 1rbo h LEU 34 Cb 0.13 -0.19 -0.00 0.00 0.09 0.00 0.00 40.66 40.69 1rbo h LEU 34 CO -0.02 1.02 -0.15 0.78 0.09 0.00 0.00 178.44 180.15 1rbo h ASN 35 N 0.51 0.00 -0.18 -0.43 2.35 -0.42 0.06 115.58 117.47 1rbo h ASN 35 Ca 0.04 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.79 1rbo h ASN 35 Cb 0.96 0.00 0.00 0.00 0.05 0.00 0.00 38.32 39.33 1rbo h ASN 35 CO 0.09 0.15 0.00 0.59 -1.65 0.00 0.00 177.43 176.61 1rbo n ASN 36 N -3.96 1.43 -1.59 5.81 3.02 -0.97 -4.91 115.26 114.10 1rbo n ASN 36 Ca -0.02 -1.74 -0.15 0.00 -0.03 0.00 0.00 54.58 52.64 1rbo n ASN 36 Cb 0.24 -0.11 -0.02 0.00 -0.61 0.00 0.00 39.78 39.28 1rbo n ASN 36 CO 0.00 0.00 0.00 0.29 -2.62 0.00 0.00 177.26 174.93 1rbo n LYS 37 N 0.19 -1.15 -3.13 3.52 4.76 0.01 -5.01 118.16 117.35 1rbo n LYS 37 Ca 0.14 0.76 -0.30 0.00 -2.87 0.00 0.00 58.31 56.05 1rbo n LYS 37 Cb 0.28 -5.05 -0.04 0.00 -1.84 0.00 0.00 35.03 28.38 1rbo n LYS 37 CO 0.00 0.00 0.00 -1.58 -1.37 0.00 0.00 177.40 174.45 1rbo s TRP 38 N -2.70 3.46 -0.28 2.13 0.51 -0.89 -4.91 118.94 116.26 1rbo s TRP 38 Ca 0.00 0.88 -0.20 0.00 -2.12 0.00 0.00 56.10 54.66 1rbo s TRP 38 Cb 0.00 -2.29 -0.02 0.00 -0.81 0.00 0.00 33.47 30.35 1rbo s TRP 38 CO 0.00 0.06 0.61 0.08 -0.51 0.00 0.00 176.95 177.19 1rbo s VAL 39 N -2.16 4.98 0.48 4.03 1.01 -0.39 -4.54 120.40 123.81 1rbo s VAL 39 Ca 0.48 0.96 -0.20 0.00 0.00 0.00 0.00 61.98 63.22 1rbo s VAL 39 Cb -0.11 -3.95 -0.09 0.00 0.00 0.00 0.00 36.38 32.24 1rbo s VAL 39 CO 0.28 -0.04 1.02 -2.16 0.00 0.00 0.00 175.10 174.20 1rbo s PRO 40 N 2.52 3.89 -0.15 2.72 0.04 -1.26 -0.65 135.00 142.11 1rbo s PRO 40 Ca 0.25 1.28 -0.25 0.00 0.04 0.00 0.00 61.00 62.32 1rbo s PRO 40 Cb -0.15 -2.11 0.06 0.00 0.04 0.00 0.00 34.50 32.33 1rbo s PRO 40 CO 0.10 -0.34 0.63 0.00 0.04 0.00 0.00 177.00 177.42 1rbo s LEU 42 N -0.35 3.38 0.02 0.00 1.02 -1.26 -0.89 118.68 120.61 1rbo s LEU 42 Ca -0.05 -0.11 0.02 0.00 0.02 0.00 0.00 54.13 54.01 1rbo s LEU 42 Cb -0.03 -2.00 -0.02 0.00 0.02 0.00 0.00 46.19 44.16 1rbo s LEU 42 CO 0.04 0.25 -0.07 -1.61 0.02 0.00 0.00 176.35 174.99 1rbo s GLU 43 N -1.76 0.47 0.05 1.70 2.02 -0.75 -1.05 118.70 119.39 1rbo s GLU 43 Ca 0.21 -0.52 0.00 0.00 0.02 0.00 0.00 54.97 54.68 1rbo s GLU 43 Cb -0.11 -0.32 -0.03 0.00 0.10 0.00 0.00 34.13 33.76 1rbo s GLU 43 CO 0.12 0.07 -0.05 -0.59 0.02 0.00 0.00 175.26 174.83 1rbo s PHE 44 N -0.87 0.58 -0.13 1.61 -0.71 0.13 -1.07 117.98 117.53 1rbo s PHE 44 Ca -0.05 -0.80 -0.09 0.00 -1.04 0.00 0.00 56.93 54.95 1rbo s PHE 44 Cb -0.07 -0.38 0.05 0.00 -1.21 0.00 0.00 43.02 41.41 1rbo s PHE 44 CO 0.00 -0.23 0.33 -2.00 -1.34 0.00 0.00 175.22 171.99 1rbo s GLU 45 N -2.90 0.33 -0.13 1.99 2.56 -0.57 -1.07 118.70 118.92 1rbo s GLU 45 Ca -0.00 0.60 0.08 0.00 0.00 0.00 0.00 54.97 55.65 1rbo s GLU 45 Cb -0.00 0.01 -0.13 0.00 2.00 0.00 0.00 34.13 36.00 1rbo s GLU 45 CO -0.05 -0.13 -0.01 0.25 -0.56 0.00 0.00 175.26 174.77 1rbo n THR 46 N 3.85 0.82 -0.04 -1.70 -2.24 -1.26 -0.70 114.28 113.01 1rbo n THR 46 Ca -0.21 -0.45 -0.22 0.00 -2.27 0.00 0.00 64.05 60.90 1rbo n THR 46 Cb 0.55 -0.79 -0.13 0.00 -2.10 0.00 0.00 70.33 67.87 1rbo n THR 46 CO 0.00 0.00 0.00 0.47 -0.57 0.00 0.00 175.07 174.97 1rbo n ASP 47 N -2.58 2.01 -3.74 3.42 9.92 -1.26 -4.78 116.55 119.54 1rbo n ASP 47 Ca -0.21 0.30 -0.30 0.00 -0.53 0.00 0.00 54.79 54.05 1rbo n ASP 47 Cb 0.85 -0.91 -0.13 0.00 -0.64 0.00 0.00 41.12 40.29 1rbo n ASP 47 CO 0.00 0.00 0.00 -1.00 0.13 0.00 0.00 177.20 176.33 1rbo s HIS 48 N -2.48 2.15 -0.81 1.24 3.76 -1.26 -4.95 115.29 112.93 1rbo s HIS 48 Ca -0.25 -2.53 0.21 0.00 -0.15 0.00 0.00 55.06 52.34 1rbo s HIS 48 Cb 0.06 -2.02 0.85 0.00 1.11 0.00 0.00 32.58 32.58 1rbo s HIS 48 CO 0.69 -0.78 1.65 0.41 -0.85 0.00 0.00 174.74 175.86 1rbo n GLY 49 N 3.48 -1.24 3.19 -2.22 0.00 -1.26 -4.79 105.19 102.36 1rbo n GLY 49 Ca 0.08 -0.01 -0.15 0.00 0.00 0.00 0.00 46.02 45.94 1rbo n GLY 49 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1rbo s PHE 50 N -3.11 1.14 0.50 1.61 0.08 -1.26 -5.11 117.98 111.83 1rbo s PHE 50 Ca 0.08 -0.65 -0.23 0.00 0.12 0.00 0.00 56.93 56.25 1rbo s PHE 50 Cb 0.11 -0.61 -0.06 0.00 -0.57 0.00 0.00 43.02 41.89 1rbo s PHE 50 CO 0.38 0.03 1.31 0.08 -0.10 0.00 0.00 175.22 176.92 1rbo s VAL 51 N -2.46 2.39 0.38 -0.44 1.01 -1.26 -4.78 120.40 115.24 1rbo s VAL 51 Ca 0.07 0.30 -0.07 0.00 0.00 0.00 0.00 61.98 62.28 1rbo s VAL 51 Cb -0.03 -3.16 0.03 0.00 0.00 0.00 0.00 36.38 33.22 1rbo s VAL 51 CO 0.01 0.01 0.62 -0.72 0.00 0.00 0.00 175.10 175.01 1rbo s TYR 52 N -1.35 0.73 -0.33 5.22 1.13 -0.67 -5.00 117.35 117.08 1rbo s TYR 52 Ca 0.67 -1.15 -0.01 0.00 -1.41 0.00 0.00 57.07 55.17 1rbo s TYR 52 Cb -0.37 0.30 0.12 0.00 -1.10 0.00 0.00 41.96 40.91 1rbo s TYR 52 CO 0.45 -1.36 0.16 1.03 -2.51 0.00 0.00 175.55 173.32 1rbo s ARG 53 N -2.56 0.52 -0.19 -3.49 0.52 -1.26 -0.04 118.95 112.45 1rbo s ARG 53 Ca 0.25 -1.06 -0.04 0.00 -0.52 0.00 0.00 55.73 54.36 1rbo s ARG 53 Cb -0.03 -1.48 -0.10 0.00 0.52 0.00 0.00 34.95 33.86 1rbo s ARG 53 CO 0.18 -1.09 -0.20 -1.91 0.02 0.00 0.00 175.30 172.29 1rbo n GLU 54 N 4.59 0.44 0.05 3.54 2.13 -1.26 -4.74 120.64 125.38 1rbo n GLU 54 Ca 0.02 0.14 0.12 0.00 0.66 0.00 0.00 57.16 58.10 1rbo n GLU 54 Cb 0.39 -1.28 0.15 0.00 0.27 0.00 0.00 31.44 30.97 1rbo n GLU 54 CO 0.00 0.00 0.00 0.72 -0.41 0.00 0.00 177.13 177.44 1rbo n HIS 55 N -3.43 0.44 -3.54 4.31 8.25 -1.26 -4.96 115.22 115.03 1rbo n HIS 55 Ca -0.35 0.13 -0.10 0.00 -0.26 0.00 0.00 57.72 57.14 1rbo n HIS 55 Cb 0.81 -0.57 -0.04 0.00 1.12 0.00 0.00 29.99 31.32 1rbo n HIS 55 CO 0.00 0.00 0.00 -1.58 0.64 0.00 0.00 176.34 175.40 1rbo s HIS 56 N -3.15 -0.37 -0.03 4.41 2.46 -1.26 -5.05 115.29 112.29 1rbo s HIS 56 Ca 0.06 0.44 0.05 0.00 0.47 0.00 0.00 55.06 56.08 1rbo s HIS 56 Cb 0.14 0.49 0.07 0.00 -0.13 0.00 0.00 32.58 33.16 1rbo s HIS 56 CO 0.73 -0.46 0.94 0.09 -2.47 0.00 0.00 174.74 173.57 1rbo n ASN 57 N 0.23 1.44 -4.78 9.88 3.02 -1.26 -4.80 115.26 118.99 1rbo n ASN 57 Ca -0.10 -2.08 -0.30 0.00 -0.03 0.00 0.00 54.58 52.07 1rbo n ASN 57 Cb 0.60 -0.14 0.09 0.00 -0.61 0.00 0.00 39.78 39.72 1rbo n ASN 57 CO 0.00 0.00 0.00 -0.94 -2.62 0.00 0.00 177.26 173.70 1rbo s SER 58 N -1.28 4.56 0.17 6.41 1.04 -1.26 -4.92 113.70 118.41 1rbo s SER 58 Ca 0.08 1.56 -0.34 0.00 0.48 0.00 0.00 55.95 57.73 1rbo s SER 58 Cb 0.07 -2.32 -0.14 0.00 0.10 0.00 0.00 66.02 63.73 1rbo s SER 58 CO 0.01 -1.96 1.45 -2.65 0.98 0.00 0.00 173.24 171.07 1rbo n PRO 59 N -3.45 1.84 -0.80 4.02 -0.02 -1.26 -1.75 135.00 133.58 1rbo n PRO 59 Ca 0.08 0.66 0.00 0.00 -2.02 0.00 0.00 63.50 62.22 1rbo n PRO 59 Cb 0.54 -2.35 0.00 0.00 -0.02 0.00 0.00 33.50 31.67 1rbo n PRO 59 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1rbo n GLY 60 N 2.78 1.15 3.70 -1.23 0.00 -1.26 -5.01 105.19 105.33 1rbo n GLY 60 Ca 0.16 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.81 1rbo n GLY 60 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 173.32 172.85 1rbo s TYR 61 N -3.51 3.40 -0.03 1.61 6.14 -0.72 -5.07 117.35 119.16 1rbo s TYR 61 Ca 0.00 0.44 -0.09 0.00 0.64 0.00 0.00 57.07 58.06 1rbo s TYR 61 Cb 0.00 -2.31 0.01 0.00 0.42 0.00 0.00 41.96 40.08 1rbo s TYR 61 CO 0.00 0.17 0.20 0.71 0.64 0.00 0.00 175.55 177.26 1rbo s TYR 62 N 0.73 -0.10 0.27 4.97 2.02 -1.26 -4.71 117.35 119.27 1rbo s TYR 62 Ca 0.12 0.20 0.00 0.00 -0.37 0.00 0.00 57.07 57.03 1rbo s TYR 62 Cb -0.13 0.03 -0.04 0.00 -0.40 0.00 0.00 41.96 41.42 1rbo s TYR 62 CO 0.03 -0.24 0.46 -0.51 -1.57 0.00 0.00 175.55 173.72 1rbo s ASP 63 N -0.82 6.35 0.00 2.29 1.01 0.94 -4.48 116.67 121.95 1rbo s ASP 63 Ca -0.09 0.40 0.00 0.00 0.71 0.00 0.00 52.55 53.57 1rbo s ASP 63 Cb -0.05 -2.01 0.00 0.00 1.01 0.00 0.00 42.92 41.87 1rbo s ASP 63 CO 0.02 -0.16 0.00 0.61 0.21 0.00 0.00 175.17 175.85 1rbo n GLY 64 N -1.24 0.75 0.15 0.21 0.00 -1.26 -1.67 105.19 102.13 1rbo n GLY 64 Ca -0.05 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.74 1rbo n GLY 64 CO 0.00 0.00 0.00 3.21 0.00 0.00 0.00 173.32 176.53 1rbo h ARG 65 N 3.14 0.53 -6.44 1.61 3.08 -1.93 -3.41 114.38 110.97 1rbo h ARG 65 Ca 0.00 -0.81 -0.54 0.00 0.07 0.00 0.00 59.98 58.70 1rbo h ARG 65 Cb 0.00 0.29 -0.01 0.00 0.08 0.00 0.00 29.97 30.32 1rbo h ARG 65 CO 0.00 1.38 0.41 0.71 -1.07 0.00 0.00 179.97 181.40 1rbo s TYR 66 N -2.74 3.63 0.46 3.04 2.02 -1.26 -5.06 117.35 117.44 1rbo s TYR 66 Ca -0.10 1.63 0.02 0.00 -0.37 0.00 0.00 57.07 58.25 1rbo s TYR 66 Cb 0.04 -3.18 0.02 0.00 -0.40 0.00 0.00 41.96 38.45 1rbo s TYR 66 CO 0.92 -0.25 0.19 0.91 -1.57 0.00 0.00 175.55 175.75 1rbo n TRP 67 N 3.77 0.09 -3.83 2.71 7.02 -1.26 -5.08 117.44 120.86 1rbo n TRP 67 Ca 0.06 -2.08 -0.37 0.00 -1.02 0.00 0.00 57.50 54.09 1rbo n TRP 67 Cb 0.50 -0.34 -0.06 0.00 -2.42 0.00 0.00 31.31 28.98 1rbo n TRP 67 CO 0.00 0.00 0.00 -0.08 -2.02 0.00 0.00 177.69 175.59 1rbo s THR 68 N -2.46 5.47 0.09 -0.99 -1.32 -0.23 -4.88 115.64 111.33 1rbo s THR 68 Ca 0.14 0.22 -0.31 0.00 -1.21 0.00 0.00 61.69 60.54 1rbo s THR 68 Cb -0.01 -3.43 -0.07 0.00 -1.51 0.00 0.00 72.50 67.48 1rbo s THR 68 CO 0.09 0.57 1.34 -0.32 -2.21 0.00 0.00 174.62 174.09 1rbo s MET 69 N -0.69 4.35 -0.41 7.08 1.75 -1.26 -0.69 119.30 129.43 1rbo s MET 69 Ca 0.14 1.98 -0.23 0.00 -1.25 0.00 0.00 55.69 56.32 1rbo s MET 69 Cb -0.12 -3.30 0.02 0.00 2.84 0.00 0.00 34.83 34.27 1rbo s MET 69 CO 0.03 -0.40 0.81 -0.46 -0.65 0.00 0.00 175.02 174.35 1rbo s TRP 70 N 1.18 3.04 0.00 4.11 -0.11 -0.21 -4.89 118.94 122.06 1rbo s TRP 70 Ca 0.63 0.38 0.00 0.00 1.22 0.00 0.00 56.10 58.33 1rbo s TRP 70 Cb -0.34 -3.59 0.00 0.00 -1.50 0.00 0.00 33.47 28.04 1rbo s TRP 70 CO 0.30 -0.89 0.00 1.63 -4.62 0.00 0.00 176.95 173.37 1rbo n LYS 71 N 6.65 0.00 -4.16 5.86 5.02 -1.26 -4.54 118.16 125.73 1rbo n LYS 71 Ca 0.03 0.00 -0.10 0.00 -2.02 0.00 0.00 58.31 56.22 1rbo n LYS 71 Cb 0.48 0.00 -0.10 0.00 -0.02 0.00 0.00 35.03 35.39 1rbo n LYS 71 CO 0.00 0.00 0.00 -0.51 -0.52 0.00 0.00 177.40 176.37 1rbo s LEU 72 N 0.00 2.13 0.62 -0.35 1.43 -1.26 -5.10 118.68 116.15 1rbo s LEU 72 Ca 0.00 -1.12 -0.19 0.00 -1.03 0.00 0.00 54.13 51.79 1rbo s LEU 72 Cb 0.00 0.14 -0.02 0.00 0.03 0.00 0.00 46.19 46.34 1rbo s LEU 72 CO 0.00 -0.62 1.29 -2.65 0.23 0.00 0.00 176.35 174.60 1rbo n PRO 73 N -0.07 1.28 -2.37 1.29 -0.02 -1.26 -4.83 135.00 129.02 1rbo n PRO 73 Ca -0.09 0.49 -0.43 0.00 -2.02 0.00 0.00 63.50 61.45 1rbo n PRO 73 Cb 0.62 -2.52 0.00 0.00 -0.02 0.00 0.00 33.50 31.59 1rbo n PRO 73 CO 0.00 0.00 0.00 -1.33 1.98 0.00 0.00 175.50 176.15 1rbo n MET 74 N -1.58 3.63 -1.73 -0.52 2.81 0.11 -4.99 117.12 114.86 1rbo n MET 74 Ca 0.14 -3.55 -0.42 0.00 -1.81 0.00 0.00 57.70 52.05 1rbo n MET 74 Cb 0.47 -2.92 -0.02 0.00 -0.71 0.00 0.00 33.22 30.03 1rbo n MET 74 CO 0.00 0.00 0.00 1.19 1.51 0.00 0.00 175.97 178.67 1rbo n PHE 75 N 3.88 2.75 -0.58 2.03 3.72 -1.26 -1.86 117.46 126.13 1rbo n PHE 75 Ca 0.39 0.18 0.00 0.00 -0.05 0.00 0.00 57.45 57.97 1rbo n PHE 75 Cb 0.36 -2.62 0.00 0.00 -0.94 0.00 0.00 39.48 36.29 1rbo n PHE 75 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 1rbo n GLY 76 N 2.94 1.67 3.74 1.37 0.00 -1.26 -5.00 105.19 108.65 1rbo n GLY 76 Ca 0.12 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.72 1rbo n GLY 76 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1rbo n THR 78 N 2.96 0.07 -4.08 0.00 -2.24 -1.26 -5.00 114.28 104.73 1rbo n THR 78 Ca 0.10 -0.29 -0.31 0.00 -2.27 0.00 0.00 64.05 61.27 1rbo n THR 78 Cb 0.39 1.38 -0.16 0.00 -2.10 0.00 0.00 70.33 69.84 1rbo n THR 78 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 1rbo s ASP 79 N -0.07 2.90 0.51 3.42 2.15 -1.26 -4.99 116.67 119.33 1rbo s ASP 79 Ca 0.00 -0.56 0.21 0.00 0.43 0.00 0.00 52.55 52.63 1rbo s ASP 79 Cb 0.00 -1.32 1.31 0.00 -0.30 0.00 0.00 42.92 42.61 1rbo s ASP 79 CO 0.00 -0.03 2.03 -0.65 -0.17 0.00 0.00 175.17 176.36 1rbo h PRO 80 N 7.98 0.06 -0.40 4.34 0.11 -1.95 -1.03 132.00 141.11 1rbo h PRO 80 Ca -0.42 -0.00 -0.01 0.00 0.11 0.00 0.00 66.00 65.68 1rbo h PRO 80 Cb 1.14 -0.01 -0.02 0.00 0.11 0.00 0.00 31.00 32.22 1rbo h PRO 80 CO 0.58 0.04 0.20 0.00 -0.21 0.00 0.00 178.00 178.61 1rbo h ALA 81 N 1.80 1.60 -0.67 -0.75 0.00 -1.99 -1.33 119.26 117.93 1rbo h ALA 81 Ca 0.19 -0.08 -0.04 0.00 0.00 0.00 0.00 54.91 54.99 1rbo h ALA 81 Cb 0.69 -0.17 -0.03 0.00 0.00 0.00 0.00 17.79 18.28 1rbo h ALA 81 CO -0.01 0.33 0.28 1.96 0.00 0.00 0.00 179.25 181.80 1rbo h GLN 82 N 0.56 0.99 -0.05 0.00 4.20 -1.61 0.27 115.11 119.46 1rbo h GLN 82 Ca 0.14 -0.17 -0.01 0.00 0.06 0.00 0.00 58.65 58.67 1rbo h GLN 82 Cb 0.04 -0.16 -0.00 0.00 0.30 0.00 0.00 27.48 27.66 1rbo h GLN 82 CO -0.02 0.81 0.00 0.28 -0.67 0.00 0.00 178.83 179.24 1rbo h VAL 83 N 0.94 1.24 0.00 -0.54 2.07 -1.45 -1.67 116.25 116.84 1rbo h VAL 83 Ca 0.22 -0.74 -0.03 0.00 0.82 0.00 0.00 66.70 66.97 1rbo h VAL 83 Cb 0.19 1.64 -0.00 0.00 -1.52 0.00 0.00 31.29 31.59 1rbo h VAL 83 CO -0.02 0.20 -0.14 -0.07 0.02 0.00 0.00 177.57 177.56 1rbo h LEU 84 N -0.19 0.00 -0.14 2.57 3.38 -1.15 -0.51 115.31 119.27 1rbo h LEU 84 Ca 0.02 0.00 -0.04 0.00 0.09 0.00 0.00 57.88 57.95 1rbo h LEU 84 Cb 0.32 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.07 1rbo h LEU 84 CO 0.00 0.14 -0.06 -1.13 0.09 0.00 0.00 178.44 177.48 1rbo h ASN 85 N 0.00 0.30 -0.50 -0.43 -0.73 -0.76 -1.94 115.58 111.52 1rbo h ASN 85 Ca -0.00 -0.41 -0.03 0.00 1.87 0.00 0.00 56.30 57.73 1rbo h ASN 85 Cb 0.26 -0.08 -0.03 0.00 0.27 0.00 0.00 38.32 38.74 1rbo h ASN 85 CO 0.02 0.64 0.22 -0.33 -0.37 0.00 0.00 177.43 177.61 1rbo h GLU 86 N -0.05 0.78 -0.34 6.67 4.39 -0.58 -1.63 114.58 123.83 1rbo h GLU 86 Ca 0.03 -0.11 0.01 0.00 0.34 0.00 0.00 59.36 59.63 1rbo h GLU 86 Cb 0.53 -0.14 -0.02 0.00 -0.10 0.00 0.00 28.75 29.01 1rbo h GLU 86 CO 0.02 0.64 0.20 1.25 -1.16 0.00 0.00 179.01 179.95 1rbo h LEU 87 N 0.77 0.32 -0.75 1.33 5.85 -0.89 0.26 115.31 122.20 1rbo h LEU 87 Ca 0.19 0.00 -0.04 0.00 0.84 0.00 0.00 57.88 58.87 1rbo h LEU 87 Cb 0.14 -0.06 -0.03 0.00 0.37 0.00 0.00 40.66 41.07 1rbo h LEU 87 CO -0.02 0.23 0.30 -0.33 -0.34 0.00 0.00 178.44 178.29 1rbo h GLU 88 N 0.40 1.13 -0.59 1.25 4.39 -0.95 0.01 114.58 120.23 1rbo h GLU 88 Ca 0.13 -0.20 -0.06 0.00 0.34 0.00 0.00 59.36 59.57 1rbo h GLU 88 Cb 0.00 -0.18 -0.02 0.00 -0.10 0.00 0.00 28.75 28.45 1rbo h GLU 88 CO -0.06 0.92 0.12 1.49 -1.16 0.00 0.00 179.01 180.31 1rbo h GLU 89 N 1.09 0.96 -0.54 2.33 4.81 -0.84 -0.89 114.58 121.50 1rbo h GLU 89 Ca 0.25 -0.25 -0.06 0.00 -0.13 0.00 0.00 59.36 59.18 1rbo h GLU 89 Cb 0.21 -0.12 -0.02 0.00 0.63 0.00 0.00 28.75 29.45 1rbo h GLU 89 CO -0.02 0.90 0.11 0.00 -0.73 0.00 0.00 179.01 179.27 1rbo h LYS 91 N 0.76 1.26 -0.34 0.00 1.57 -0.70 0.28 116.57 119.41 1rbo h LYS 91 Ca 0.17 -0.08 -0.11 0.00 -1.87 0.00 0.00 60.65 58.75 1rbo h LYS 91 Cb 0.37 -0.28 -0.01 0.00 0.08 0.00 0.00 32.23 32.38 1rbo h LYS 91 CO 0.01 0.84 -0.26 1.57 -0.57 0.00 0.00 179.45 181.04 1rbo h LYS 92 N 1.30 0.68 0.04 3.15 5.09 -0.86 -1.96 116.57 124.00 1rbo h LYS 92 Ca 0.35 -0.28 -0.23 0.00 0.09 0.00 0.00 60.65 60.58 1rbo h LYS 92 Cb -0.13 -0.03 -0.01 0.00 0.10 0.00 0.00 32.23 32.16 1rbo h LYS 92 CO -0.07 0.87 -1.02 1.49 -2.09 0.00 0.00 179.45 178.63 1rbo h GLU 93 N 0.59 0.24 -2.10 0.07 4.81 -0.89 -3.39 114.58 113.91 1rbo h GLU 93 Ca 0.08 -0.32 -0.58 0.00 -0.13 0.00 0.00 59.36 58.42 1rbo h GLU 93 Cb 0.75 0.10 -0.41 0.00 0.63 0.00 0.00 28.75 29.82 1rbo h GLU 93 CO 0.06 1.07 -0.85 0.66 -0.73 0.00 0.00 179.01 179.22 1rbo n TYR 94 N -3.60 1.78 0.30 0.92 4.01 0.95 -4.92 117.16 116.59 1rbo n TYR 94 Ca -0.05 -3.88 0.18 0.00 -0.16 0.00 0.00 57.90 53.99 1rbo n TYR 94 Cb 0.89 -0.46 0.85 0.00 -0.31 0.00 0.00 39.34 40.31 1rbo n TYR 94 CO 0.00 0.00 0.00 -1.00 -0.46 0.00 0.00 176.86 175.40 1rbo h PRO 95 N 3.96 0.00 -0.64 -0.72 0.13 -1.56 -2.01 132.00 131.16 1rbo h PRO 95 Ca 0.13 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.26 1rbo h PRO 95 Cb 0.76 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.89 1rbo h PRO 95 CO 0.66 0.00 0.00 0.27 -0.23 0.00 0.00 178.00 178.70 1rbo n ASN 96 N -2.90 3.61 -4.74 1.44 6.94 -1.26 -4.55 115.26 113.80 1rbo n ASN 96 Ca -0.01 -2.09 -0.24 0.00 -0.02 0.00 0.00 54.58 52.23 1rbo n ASN 96 Cb 0.18 -0.45 -0.06 0.00 -2.36 0.00 0.00 39.78 37.09 1rbo n ASN 96 CO 0.00 0.00 0.00 0.00 -1.03 0.00 0.00 177.26 176.23 1rbo s ALA 97 N -1.29 3.38 0.11 -2.53 0.00 -0.76 -4.73 121.76 115.95 1rbo s ALA 97 Ca 0.43 -1.44 -0.20 0.00 0.00 0.00 0.00 51.96 50.75 1rbo s ALA 97 Cb 0.24 -1.10 -0.07 0.00 0.00 0.00 0.00 23.12 22.19 1rbo s ALA 97 CO 0.28 0.35 0.63 -0.06 0.00 0.00 0.00 175.76 176.95 1rbo s PHE 98 N -2.04 3.80 -0.05 0.00 0.08 0.12 -3.64 117.98 116.25 1rbo s PHE 98 Ca 0.31 1.35 0.02 0.00 0.12 0.00 0.00 56.93 58.72 1rbo s PHE 98 Cb -0.08 -2.56 0.02 0.00 -0.57 0.00 0.00 43.02 39.83 1rbo s PHE 98 CO 0.22 0.54 -0.09 0.42 -0.10 0.00 0.00 175.22 176.21 1rbo s ILE 99 N -1.19 0.86 0.14 0.64 1.01 -0.37 -1.51 121.20 120.78 1rbo s ILE 99 Ca 0.33 -0.32 0.08 0.00 0.00 0.00 0.00 60.65 60.74 1rbo s ILE 99 Cb -0.20 -0.82 -0.04 0.00 0.01 0.00 0.00 42.46 41.42 1rbo s ILE 99 CO 0.21 0.29 -0.19 0.00 0.00 0.00 0.00 174.94 175.25 1rbo s ARG 100 N 0.75 1.22 -0.15 2.79 1.70 -0.23 -0.01 118.95 125.02 1rbo s ARG 100 Ca -0.13 -1.32 -0.04 0.00 -0.47 0.00 0.00 55.73 53.77 1rbo s ARG 100 Cb -0.15 -1.37 -0.03 0.00 -0.57 0.00 0.00 34.95 32.83 1rbo s ARG 100 CO 0.02 0.29 -0.03 0.42 -1.08 0.00 0.00 175.30 174.92 1rbo s ILE 101 N -1.71 3.96 0.19 4.99 1.01 -0.21 -1.80 121.20 127.63 1rbo s ILE 101 Ca 0.12 -0.34 0.08 0.00 0.00 0.00 0.00 60.65 60.52 1rbo s ILE 101 Cb -0.07 -2.74 -0.04 0.00 0.01 0.00 0.00 42.46 39.62 1rbo s ILE 101 CO 0.06 0.50 -0.16 0.27 0.00 0.00 0.00 174.94 175.60 1rbo s ILE 102 N 0.31 1.82 -0.06 2.92 -4.36 -0.07 -1.53 121.20 120.22 1rbo s ILE 102 Ca -0.03 -2.10 -0.00 0.00 -0.26 0.00 0.00 60.65 58.26 1rbo s ILE 102 Cb -0.14 -1.97 0.02 0.00 1.25 0.00 0.00 42.46 41.62 1rbo s ILE 102 CO 0.03 -0.47 -0.03 -0.83 0.24 0.00 0.00 174.94 173.89 1rbo s GLY 103 N -3.05 0.48 0.02 6.27 0.00 -0.84 -1.03 107.32 109.17 1rbo s GLY 103 Ca 0.20 -0.11 -0.15 0.00 0.00 0.00 0.00 44.72 44.66 1rbo s GLY 103 CO 0.07 0.77 0.43 -1.36 0.00 0.00 0.00 173.10 173.01 1rbo s PHE 104 N 1.42 3.72 -0.38 1.90 0.08 0.18 -0.96 117.98 123.94 1rbo s PHE 104 Ca -0.03 1.01 -0.09 0.00 0.12 0.00 0.00 56.93 57.94 1rbo s PHE 104 Cb -0.13 -2.30 0.05 0.00 -0.57 0.00 0.00 43.02 40.07 1rbo s PHE 104 CO -0.03 0.62 0.20 0.34 -0.10 0.00 0.00 175.22 176.26 1rbo s ASP 105 N -1.15 5.59 0.48 1.36 -1.08 -0.37 -1.26 116.67 120.23 1rbo s ASP 105 Ca 0.25 -1.24 0.27 0.00 -0.52 0.00 0.00 52.55 51.31 1rbo s ASP 105 Cb -0.17 -1.97 0.84 0.00 -1.46 0.00 0.00 42.92 40.17 1rbo s ASP 105 CO 0.14 -0.43 1.79 0.77 0.52 0.00 0.00 175.17 177.96 1rbo h SER 106 N 8.37 0.00 -0.19 -0.34 4.64 -1.91 0.30 113.55 124.42 1rbo h SER 106 Ca -0.24 0.00 -0.20 0.00 -0.47 0.00 0.00 61.79 60.89 1rbo h SER 106 Cb 1.09 0.00 0.01 0.00 -0.31 0.00 0.00 62.40 63.19 1rbo h SER 106 CO 0.69 0.06 -0.65 0.78 -0.87 0.00 0.00 176.83 176.83 1rbo h ASN 107 N 0.00 0.91 0.45 4.97 2.35 -1.96 -3.24 115.58 119.06 1rbo h ASN 107 Ca -0.00 -0.60 0.00 0.00 -0.55 0.00 0.00 56.30 55.15 1rbo h ASN 107 Cb 0.78 -0.27 0.00 0.00 0.05 0.00 0.00 38.32 38.88 1rbo h ASN 107 CO 0.01 1.35 -1.12 0.54 -1.65 0.00 0.00 177.43 176.55 1rbo n ARG 108 N -4.02 0.36 -3.54 0.81 1.74 -1.21 -4.99 116.66 105.81 1rbo n ARG 108 Ca -0.06 -0.01 -0.20 0.00 -0.77 0.00 0.00 57.85 56.81 1rbo n ARG 108 Cb 0.68 -1.61 0.06 0.00 -1.02 0.00 0.00 32.46 30.57 1rbo n ARG 108 CO 0.00 0.00 0.00 -1.91 -1.52 0.00 0.00 177.63 174.20 1rbo n GLU 109 N -2.07 -4.92 -4.05 5.56 2.13 0.10 -5.02 120.64 112.37 1rbo n GLU 109 Ca 0.01 0.73 -0.13 0.00 0.66 0.00 0.00 57.16 58.43 1rbo n GLU 109 Cb 0.46 -5.45 -0.13 0.00 0.27 0.00 0.00 31.44 26.59 1rbo n GLU 109 CO 0.00 0.00 0.00 0.14 -0.41 0.00 0.00 177.13 176.86 1rbo s VAL 110 N -3.51 0.35 -0.29 6.31 -7.23 -1.04 -4.99 120.40 110.01 1rbo s VAL 110 Ca 0.10 -0.64 -0.29 0.00 -1.81 0.00 0.00 61.98 59.33 1rbo s VAL 110 Cb -0.02 -0.38 0.01 0.00 0.56 0.00 0.00 36.38 36.55 1rbo s VAL 110 CO 0.78 -0.20 1.11 -1.10 -0.31 0.00 0.00 175.10 175.38 1rbo s GLN 111 N -0.90 4.09 0.00 4.82 -0.21 -1.26 -1.24 119.66 124.95 1rbo s GLN 111 Ca -0.06 1.19 0.24 0.00 0.02 0.00 0.00 55.36 56.75 1rbo s GLN 111 Cb -0.06 -3.74 0.33 0.00 1.00 0.00 0.00 33.01 30.54 1rbo s GLN 111 CO -0.00 -0.87 1.29 0.00 -2.12 0.00 0.00 175.29 173.59 1rbo s ILE 113 N -2.88 0.05 -0.30 0.00 -1.09 -1.19 -4.97 121.20 110.82 1rbo s ILE 113 Ca 0.13 -0.33 -0.11 0.00 -2.23 0.00 0.00 60.65 58.11 1rbo s ILE 113 Cb 0.17 -0.11 0.17 0.00 -1.58 0.00 0.00 42.46 41.12 1rbo s ILE 113 CO 0.70 -0.17 0.89 -0.55 -1.23 0.00 0.00 174.94 174.58 1rbo s SER 114 N -0.53 -0.77 -0.03 3.58 0.15 -1.25 -1.98 113.70 112.87 1rbo s SER 114 Ca -0.06 0.70 -0.17 0.00 0.70 0.00 0.00 55.95 57.13 1rbo s SER 114 Cb -0.04 1.74 0.03 0.00 -1.71 0.00 0.00 66.02 66.04 1rbo s SER 114 CO -0.00 -0.15 0.37 0.72 1.20 0.00 0.00 173.24 175.38 1rbo s PHE 115 N 2.76 -0.27 -0.01 3.44 -0.71 -0.58 -4.41 117.98 118.20 1rbo s PHE 115 Ca 0.03 0.46 -0.30 0.00 -1.04 0.00 0.00 56.93 56.08 1rbo s PHE 115 Cb -0.10 0.14 -0.05 0.00 -1.21 0.00 0.00 43.02 41.80 1rbo s PHE 115 CO -0.16 -0.40 1.31 -1.50 -1.34 0.00 0.00 175.22 173.13 1rbo s ILE 116 N -1.15 3.91 -0.43 -4.49 1.10 -1.26 -1.05 121.20 117.83 1rbo s ILE 116 Ca -0.12 1.29 0.15 0.00 -0.51 0.00 0.00 60.65 61.46 1rbo s ILE 116 Cb -0.04 -3.83 -0.18 0.00 0.15 0.00 0.00 42.46 38.55 1rbo s ILE 116 CO 0.05 0.01 0.50 0.00 -2.11 0.00 0.00 174.94 173.39 1rbo n ALA 117 N 5.09 3.38 -3.62 1.50 0.00 0.98 -4.90 120.51 122.94 1rbo n ALA 117 Ca 0.12 -0.39 -0.13 0.00 0.00 0.00 0.00 53.44 53.04 1rbo n ALA 117 Cb 0.45 -0.52 -0.07 0.00 0.00 0.00 0.00 19.45 19.31 1rbo n ALA 117 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 177.50 177.03 1rbo s TYR 118 N -2.62 -0.82 -0.02 0.00 5.04 -0.94 -4.99 117.35 113.02 1rbo s TYR 118 Ca 0.01 1.91 0.05 0.00 -2.44 0.00 0.00 57.07 56.60 1rbo s TYR 118 Cb 0.10 0.32 -0.01 0.00 0.35 0.00 0.00 41.96 42.73 1rbo s TYR 118 CO 0.60 -0.40 -0.15 0.15 -1.34 0.00 0.00 175.55 174.41 1rbo s LYS 119 N 0.59 1.29 1.02 4.97 1.02 -1.26 -1.23 119.74 126.13 1rbo s LYS 119 Ca -0.02 -0.54 -0.12 0.00 0.02 0.00 0.00 55.97 55.31 1rbo s LYS 119 Cb -0.05 -1.22 0.20 0.00 -0.52 0.00 0.00 37.83 36.24 1rbo s LYS 119 CO -0.03 0.31 1.08 -1.25 -0.92 0.00 0.00 175.35 174.54 1rbo s PRO 120 N -0.29 0.27 0.15 -1.68 0.04 -1.24 -4.89 135.00 127.36 1rbo s PRO 120 Ca 0.04 0.68 -0.34 0.00 0.04 0.00 0.00 61.00 61.42 1rbo s PRO 120 Cb -0.07 -1.71 -0.15 0.00 0.04 0.00 0.00 34.50 32.62 1rbo s PRO 120 CO -0.00 -2.88 1.45 0.00 0.04 0.00 0.00 177.00 175.60 1rbo n ALA 121 N -4.30 0.43 -1.43 8.56 0.00 -1.26 -2.81 120.51 119.69 1rbo n ALA 121 Ca 0.05 0.47 0.00 0.00 0.00 0.00 0.00 53.44 53.96 1rbo n ALA 121 Cb 0.56 -2.23 0.00 0.00 0.00 0.00 0.00 19.45 17.78 1rbo n ALA 121 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1rbo n GLY 122 N 2.84 0.69 0.00 0.00 0.00 -1.26 -5.18 105.19 102.29 1rbo n GLY 122 Ca 0.16 -0.72 0.00 0.00 0.00 0.00 0.00 46.02 45.46 1rbo n GLY 122 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60