#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2j6b s LEU 2 N 0.00 4.11 -0.02 -0.89 2.96 -1.26 -1.36 118.68 122.23 2j6b s LEU 2 Ca 0.00 0.52 0.02 0.00 -0.22 0.00 0.00 54.13 54.45 2j6b s LEU 2 Cb 0.00 -2.58 -0.03 0.00 0.50 0.00 0.00 46.19 44.08 2j6b s LEU 2 CO 0.00 -0.16 -0.06 -0.31 -1.32 0.00 0.00 176.35 174.50 2j6b s TYR 3 N 1.72 2.93 -0.26 5.38 2.02 -0.09 -0.96 117.35 128.09 2j6b s TYR 3 Ca 0.20 -0.00 -0.07 0.00 -0.37 0.00 0.00 57.07 56.83 2j6b s TYR 3 Cb -0.15 -1.65 -0.02 0.00 -0.40 0.00 0.00 41.96 39.75 2j6b s TYR 3 CO 0.09 0.38 0.06 0.42 -1.57 0.00 0.00 175.55 174.93 2j6b s ILE 4 N -0.96 4.09 0.15 2.71 1.01 -0.44 -0.59 121.20 127.16 2j6b s ILE 4 Ca 0.16 -0.36 0.10 0.00 0.00 0.00 0.00 60.65 60.55 2j6b s ILE 4 Cb -0.11 -2.96 -0.04 0.00 0.01 0.00 0.00 42.46 39.35 2j6b s ILE 4 CO 0.06 0.28 -0.19 -0.76 0.00 0.00 0.00 174.94 174.33 2j6b s LEU 5 N 1.57 2.63 0.00 2.97 1.43 -0.32 -0.98 118.68 125.97 2j6b s LEU 5 Ca 0.05 -0.67 0.20 0.00 -1.03 0.00 0.00 54.13 52.69 2j6b s LEU 5 Cb -0.16 -1.43 0.61 0.00 0.03 0.00 0.00 46.19 45.25 2j6b s LEU 5 CO 0.02 0.15 1.47 -0.46 0.23 0.00 0.00 176.35 177.77 2j6b n ASN 6 N 0.55 2.16 -3.98 2.29 0.23 -1.26 -1.30 115.26 113.94 2j6b n ASN 6 Ca -0.14 -1.82 -0.09 0.00 -0.53 0.00 0.00 54.58 51.99 2j6b n ASN 6 Cb 0.54 -0.17 -0.05 0.00 -2.08 0.00 0.00 39.78 38.02 2j6b n ASN 6 CO 0.00 0.00 0.00 -0.94 -0.93 0.00 0.00 177.26 175.39 2j6b s SER 7 N -1.46 -0.09 -0.06 0.53 1.04 -1.02 -4.69 113.70 107.95 2j6b s SER 7 Ca 0.33 -0.90 -0.03 0.00 0.48 0.00 0.00 55.95 55.82 2j6b s SER 7 Cb 0.18 0.57 -0.11 0.00 0.10 0.00 0.00 66.02 66.76 2j6b s SER 7 CO 0.26 -1.10 2.86 0.00 0.98 0.00 0.00 173.24 176.23 2j6b n ALA 8 N -0.36 5.44 -1.81 5.32 0.00 -1.26 -4.46 120.51 123.38 2j6b n ALA 8 Ca -0.03 -1.26 -0.34 0.00 0.00 0.00 0.00 53.44 51.82 2j6b n ALA 8 Cb 0.62 -1.76 -0.05 0.00 0.00 0.00 0.00 19.45 18.26 2j6b n ALA 8 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.50 177.92 2j6b s ILE 9 N 0.13 4.04 -0.60 0.00 -1.09 -1.26 -5.03 121.20 117.39 2j6b s ILE 9 Ca 0.40 1.28 0.04 0.00 -2.23 0.00 0.00 60.65 60.14 2j6b s ILE 9 Cb 0.20 -3.52 0.17 0.00 -1.58 0.00 0.00 42.46 37.73 2j6b s ILE 9 CO -0.02 -0.27 0.43 -0.22 -1.23 0.00 0.00 174.94 173.63 2j6b s LEU 10 N -3.33 3.78 -1.35 2.97 2.96 -1.26 -5.03 118.68 117.41 2j6b s LEU 10 Ca 0.65 -3.53 -0.13 0.00 -0.22 0.00 0.00 54.13 50.90 2j6b s LEU 10 Cb -0.13 -1.29 0.10 0.00 0.50 0.00 0.00 46.19 45.37 2j6b s LEU 10 CO 0.17 -0.13 1.96 -0.81 -1.32 0.00 0.00 176.35 176.23 2j6b n PRO 11 N 2.36 3.20 -2.45 0.98 -0.04 -1.26 -4.97 135.00 132.82 2j6b n PRO 11 Ca 0.21 -3.13 -0.40 0.00 -0.04 0.00 0.00 63.50 60.14 2j6b n PRO 11 Cb 0.38 -3.18 -0.04 0.00 -0.04 0.00 0.00 33.50 30.62 2j6b n PRO 11 CO 0.00 0.00 0.00 -0.51 -0.04 0.00 0.00 175.50 174.95 2j6b s LEU 12 N 1.70 4.52 0.12 1.53 1.43 -1.26 -0.89 118.68 125.83 2j6b s LEU 12 Ca 0.45 2.29 -0.31 0.00 -1.03 0.00 0.00 54.13 55.53 2j6b s LEU 12 Cb 0.09 -3.66 -0.08 0.00 0.03 0.00 0.00 46.19 42.57 2j6b s LEU 12 CO -0.02 -0.20 1.41 -0.75 0.23 0.00 0.00 176.35 177.02 2j6b s LYS 13 N -1.54 4.31 0.88 1.70 2.20 -0.19 -4.80 119.74 122.30 2j6b s LYS 13 Ca 0.46 2.10 -0.11 0.00 -0.36 0.00 0.00 55.97 58.06 2j6b s LYS 13 Cb -0.32 -3.25 0.12 0.00 -1.51 0.00 0.00 37.83 32.87 2j6b s LYS 13 CO 0.41 -0.46 1.10 -1.25 -0.36 0.00 0.00 175.35 174.79 2j6b s PRO 14 N 1.16 1.39 0.00 4.03 0.04 -1.26 -4.33 135.00 136.03 2j6b s PRO 14 Ca 0.65 1.06 0.00 0.00 0.04 0.00 0.00 61.00 62.75 2j6b s PRO 14 Cb -0.37 -1.81 0.00 0.00 0.04 0.00 0.00 34.50 32.36 2j6b s PRO 14 CO 0.30 -2.22 0.00 0.41 0.04 0.00 0.00 177.00 175.53 2j6b n GLY 15 N -0.79 0.72 3.32 0.56 0.00 -1.26 -5.07 105.19 102.67 2j6b n GLY 15 Ca 0.08 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 45.97 2j6b n GLY 15 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 2j6b s GLU 16 N -0.55 0.88 0.18 1.61 2.12 -1.26 -5.16 118.70 116.52 2j6b s GLU 16 Ca 0.00 -0.29 -0.03 0.00 0.36 0.00 0.00 54.97 55.01 2j6b s GLU 16 Cb 0.00 0.40 -0.05 0.00 0.26 0.00 0.00 34.13 34.74 2j6b s GLU 16 CO 0.00 -0.29 0.39 -1.21 -0.54 0.00 0.00 175.26 173.61 2j6b s GLU 17 N -2.19 3.57 0.10 4.30 2.02 -1.26 -5.03 118.70 120.21 2j6b s GLU 17 Ca -0.07 -0.19 0.04 0.00 0.02 0.00 0.00 54.97 54.77 2j6b s GLU 17 Cb -0.01 -2.83 -0.04 0.00 0.10 0.00 0.00 34.13 31.35 2j6b s GLU 17 CO -0.00 0.42 -0.11 0.71 0.02 0.00 0.00 175.26 176.30 2j6b s TYR 18 N -1.78 1.11 -0.13 1.61 2.02 -1.26 -5.04 117.35 113.87 2j6b s TYR 18 Ca 0.40 -0.62 0.02 0.00 -0.37 0.00 0.00 57.07 56.49 2j6b s TYR 18 Cb -0.12 -0.60 0.00 0.00 -0.40 0.00 0.00 41.96 40.84 2j6b s TYR 18 CO 0.27 0.02 -0.19 0.99 -1.57 0.00 0.00 175.55 175.07 2j6b s THR 19 N -2.30 2.36 -0.13 -0.71 2.01 -0.47 -5.00 115.64 111.41 2j6b s THR 19 Ca 0.05 -0.89 0.03 0.00 0.31 0.00 0.00 61.69 61.19 2j6b s THR 19 Cb -0.04 -1.96 0.01 0.00 0.01 0.00 0.00 72.50 70.52 2j6b s THR 19 CO 0.01 0.54 -0.22 -0.69 -0.69 0.00 0.00 174.62 173.56 2j6b s VAL 20 N 0.63 2.03 0.04 3.82 1.01 -1.26 -0.72 120.40 125.95 2j6b s VAL 20 Ca -0.10 -0.97 -0.17 0.00 0.00 0.00 0.00 61.98 60.74 2j6b s VAL 20 Cb -0.16 -1.79 -0.06 0.00 0.00 0.00 0.00 36.38 34.37 2j6b s VAL 20 CO 0.02 0.55 0.50 -0.54 0.00 0.00 0.00 175.10 175.63 2j6b s LYS 21 N 0.72 4.07 -0.02 2.72 -0.14 -0.42 -4.91 119.74 121.76 2j6b s LYS 21 Ca -0.10 0.59 0.00 0.00 -1.36 0.00 0.00 55.97 55.10 2j6b s LYS 21 Cb -0.16 -3.23 0.02 0.00 -1.68 0.00 0.00 37.83 32.78 2j6b s LYS 21 CO 0.00 0.66 0.02 0.00 -0.76 0.00 0.00 175.35 175.27 2j6b s ALA 22 N -1.08 0.10 -0.01 5.17 0.00 -1.26 -0.64 121.76 124.04 2j6b s ALA 22 Ca 0.27 0.21 -0.18 0.00 0.00 0.00 0.00 51.96 52.25 2j6b s ALA 22 Cb -0.18 -0.20 0.03 0.00 0.00 0.00 0.00 23.12 22.77 2j6b s ALA 22 CO 0.16 -0.07 0.39 -1.59 0.00 0.00 0.00 175.76 174.65 2j6b s LYS 23 N 0.79 0.79 0.28 0.00 -2.85 -0.90 -5.01 119.74 112.84 2j6b s LYS 23 Ca -0.07 -0.16 -0.25 0.00 -1.00 0.00 0.00 55.97 54.49 2j6b s LYS 23 Cb -0.10 0.36 -0.09 0.00 -2.06 0.00 0.00 37.83 35.94 2j6b s LYS 23 CO -0.02 -0.24 0.88 -2.00 0.10 0.00 0.00 175.35 174.07 2j6b s GLU 24 N -1.58 4.51 0.17 1.78 2.12 -1.26 -0.61 118.70 123.83 2j6b s GLU 24 Ca -0.11 1.21 0.05 0.00 0.36 0.00 0.00 54.97 56.47 2j6b s GLU 24 Cb -0.03 -2.88 -0.05 0.00 0.26 0.00 0.00 34.13 31.43 2j6b s GLU 24 CO 0.04 0.34 -0.09 0.96 -0.54 0.00 0.00 175.26 175.97 2j6b s ILE 25 N -1.54 1.21 0.73 -3.70 -4.36 0.25 -4.91 121.20 108.88 2j6b s ILE 25 Ca 0.47 -2.07 -0.12 0.00 -0.26 0.00 0.00 60.65 58.67 2j6b s ILE 25 Cb -0.19 -1.96 0.03 0.00 1.25 0.00 0.00 42.46 41.59 2j6b s ILE 25 CO 0.24 -0.65 1.11 0.42 0.24 0.00 0.00 174.94 176.29 2j6b s THR 26 N -3.30 3.28 0.23 8.37 -4.23 -1.26 -4.30 115.64 114.43 2j6b s THR 26 Ca 0.20 0.42 -0.05 0.00 -1.18 0.00 0.00 61.69 61.07 2j6b s THR 26 Cb 0.03 -3.39 0.19 0.00 1.34 0.00 0.00 72.50 70.67 2j6b s THR 26 CO 0.03 -0.54 1.77 0.40 -0.54 0.00 0.00 174.62 175.73 2j6b h ILE 27 N -0.74 0.81 -0.55 2.99 2.04 -1.96 -1.16 117.51 118.93 2j6b h ILE 27 Ca -0.45 -0.20 -0.05 0.00 1.00 0.00 0.00 64.86 65.16 2j6b h ILE 27 Cb 1.26 0.16 -0.02 0.00 -0.74 0.00 0.00 36.82 37.48 2j6b h ILE 27 CO 0.64 0.11 0.17 -0.61 0.00 0.00 0.00 178.15 178.46 2j6b h GLN 28 N 0.60 0.86 -0.83 2.37 5.75 -1.93 0.12 115.11 122.05 2j6b h GLN 28 Ca 0.38 -0.19 -0.03 0.00 -0.15 0.00 0.00 58.65 58.66 2j6b h GLN 28 Cb 0.44 -0.12 -0.04 0.00 1.07 0.00 0.00 27.48 28.83 2j6b h GLN 28 CO -0.30 0.79 0.38 0.93 -2.65 0.00 0.00 178.83 177.98 2j6b h GLU 29 N 0.77 1.20 -0.62 1.69 5.08 -1.86 -1.35 114.58 119.50 2j6b h GLU 29 Ca 0.18 -0.19 -0.08 0.00 -1.00 0.00 0.00 59.36 58.27 2j6b h GLU 29 Cb 0.29 -0.21 -0.02 0.00 0.50 0.00 0.00 28.75 29.30 2j6b h GLU 29 CO -0.01 0.93 0.06 0.00 -1.00 0.00 0.00 179.01 179.00 2j6b h ALA 30 N 1.21 0.83 -0.38 3.43 0.00 -0.67 -1.60 119.26 122.07 2j6b h ALA 30 Ca 0.28 -0.28 0.02 0.00 0.00 0.00 0.00 54.91 54.93 2j6b h ALA 30 Cb 0.14 -0.23 -0.03 0.00 0.00 0.00 0.00 17.79 17.67 2j6b h ALA 30 CO -0.03 0.62 0.20 -0.22 0.00 0.00 0.00 179.25 179.82 2j6b h LYS 31 N 0.96 0.40 -0.61 0.00 3.64 -0.47 -1.85 116.57 118.65 2j6b h LYS 31 Ca 0.18 -0.02 -0.03 0.00 -1.27 0.00 0.00 60.65 59.51 2j6b h LYS 31 Cb 0.49 -0.09 -0.03 0.00 -0.41 0.00 0.00 32.23 32.19 2j6b h LYS 31 CO 0.02 0.27 0.26 0.93 -2.27 0.00 0.00 179.45 178.65 2j6b h GLU 32 N 0.41 0.90 0.05 1.90 5.08 -1.02 -1.16 114.58 120.74 2j6b h GLU 32 Ca 0.16 -0.15 0.02 0.00 -1.00 0.00 0.00 59.36 58.39 2j6b h GLU 32 Cb 0.04 -0.15 -0.04 0.00 0.50 0.00 0.00 28.75 29.11 2j6b h GLU 32 CO -0.09 0.75 -0.23 1.25 -1.00 0.00 0.00 179.01 179.69 2j6b h LEU 33 N 0.84 -0.67 -0.24 1.33 5.85 -1.01 -2.11 115.31 119.30 2j6b h LEU 33 Ca 0.20 0.09 0.00 0.00 0.84 0.00 0.00 57.88 59.01 2j6b h LEU 33 Cb 0.18 0.26 0.00 0.00 0.37 0.00 0.00 40.66 41.47 2j6b h LEU 33 CO -0.02 -0.31 0.00 -0.37 -0.34 0.00 0.00 178.44 177.40 2j6b h VAL 34 N -0.39 0.00 0.12 1.05 -1.51 -1.18 -3.08 116.25 111.26 2j6b h VAL 34 Ca 0.05 -0.69 -0.29 0.00 -1.23 0.00 0.00 66.70 64.54 2j6b h VAL 34 Cb 0.45 1.66 0.02 0.00 -2.13 0.00 0.00 31.29 31.29 2j6b h VAL 34 CO -0.17 0.00 -1.23 0.74 -1.23 0.00 0.00 177.57 175.68 2j6b h THR 35 N 0.00 1.35 -0.01 7.19 2.02 -1.06 -3.38 112.91 119.02 2j6b h THR 35 Ca 0.00 -2.62 0.00 0.00 0.77 0.00 0.00 66.41 64.56 2j6b h THR 35 Cb 0.79 2.75 0.00 0.00 -1.74 0.00 0.00 68.15 69.95 2j6b h THR 35 CO 0.00 0.79 -0.25 0.29 0.37 0.00 0.00 175.52 176.71 2j6b n LYS 36 N -3.72 1.10 -3.94 6.66 4.76 -0.81 -4.89 118.16 117.32 2j6b n LYS 36 Ca -0.12 -0.73 -0.09 0.00 -2.87 0.00 0.00 58.31 54.50 2j6b n LYS 36 Cb 0.99 -1.48 -0.08 0.00 -1.84 0.00 0.00 35.03 32.62 2j6b n LYS 36 CO 0.00 0.00 0.00 -1.83 -1.37 0.00 0.00 177.40 174.20 2j6b s GLU 37 N -2.40 0.93 0.34 1.97 -1.05 -1.18 -5.10 118.70 112.20 2j6b s GLU 37 Ca 0.25 -1.10 -0.29 0.00 -0.15 0.00 0.00 54.97 53.68 2j6b s GLU 37 Cb 0.19 0.33 -0.11 0.00 -0.44 0.00 0.00 34.13 34.10 2j6b s GLU 37 CO 0.49 -0.30 1.53 -1.14 0.95 0.00 0.00 175.26 176.79 2j6b s GLN 38 N -3.92 4.13 0.24 -4.83 0.74 -1.26 -4.72 119.66 110.03 2j6b s GLN 38 Ca 0.11 2.56 0.08 0.00 0.05 0.00 0.00 55.36 58.16 2j6b s GLN 38 Cb 0.05 -3.00 -0.05 0.00 1.10 0.00 0.00 33.01 31.11 2j6b s GLN 38 CO -0.06 -0.56 -0.13 -0.59 -0.55 0.00 0.00 175.29 173.40 2j6b s PHE 39 N -0.61 1.88 -0.21 1.67 -0.12 -1.26 -4.07 117.98 115.26 2j6b s PHE 39 Ca 0.57 -0.57 0.01 0.00 -0.05 0.00 0.00 56.93 56.90 2j6b s PHE 39 Cb -0.47 -0.92 0.04 0.00 -0.63 0.00 0.00 43.02 41.04 2j6b s PHE 39 CO 0.56 0.40 -0.12 0.99 -0.05 0.00 0.00 175.22 176.99 2j6b s THR 40 N -2.91 1.81 0.13 -4.49 2.01 -0.14 -5.01 115.64 107.05 2j6b s THR 40 Ca 0.26 -1.10 -0.30 0.00 0.31 0.00 0.00 61.69 60.85 2j6b s THR 40 Cb -0.00 -1.84 -0.07 0.00 0.01 0.00 0.00 72.50 70.60 2j6b s THR 40 CO 0.10 0.20 1.07 -0.55 -0.69 0.00 0.00 174.62 174.75 2j6b s SER 41 N 1.32 7.30 -0.22 3.53 0.15 -1.26 -1.33 113.70 123.19 2j6b s SER 41 Ca -0.01 1.98 0.11 0.00 0.70 0.00 0.00 55.95 58.72 2j6b s SER 41 Cb -0.16 -2.59 0.43 0.00 -1.71 0.00 0.00 66.02 61.98 2j6b s SER 41 CO -0.08 -0.22 1.21 0.00 1.20 0.00 0.00 173.24 175.34 2j6b n ALA 42 N 2.82 3.92 -2.06 5.45 0.00 -0.15 -4.65 120.51 125.84 2j6b n ALA 42 Ca 0.04 -3.38 -0.42 0.00 0.00 0.00 0.00 53.44 49.68 2j6b n ALA 42 Cb 0.47 -0.36 -0.03 0.00 0.00 0.00 0.00 19.45 19.53 2j6b n ALA 42 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.50 177.92 2j6b s ILE 43 N -3.45 2.97 -0.21 0.00 -1.09 -1.23 -4.57 121.20 113.63 2j6b s ILE 43 Ca 0.41 0.70 0.12 0.00 -2.23 0.00 0.00 60.65 59.65 2j6b s ILE 43 Cb 0.38 -3.45 0.26 0.00 -1.58 0.00 0.00 42.46 38.08 2j6b s ILE 43 CO -0.05 0.05 1.18 0.61 -1.23 0.00 0.00 174.94 175.51 2j6b n GLY 44 N 3.62 3.92 2.83 6.18 0.00 -1.26 0.28 105.19 120.76 2j6b n GLY 44 Ca 0.13 -0.71 -0.14 0.00 0.00 0.00 0.00 46.02 45.30 2j6b n GLY 44 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 2j6b s HIS 45 N -2.11 0.03 0.14 1.61 3.76 -1.26 -4.89 115.29 112.57 2j6b s HIS 45 Ca 0.24 0.05 -0.19 0.00 -0.15 0.00 0.00 55.06 55.02 2j6b s HIS 45 Cb 0.20 -0.12 0.01 0.00 1.11 0.00 0.00 32.58 33.77 2j6b s HIS 45 CO 0.05 -0.04 1.71 0.37 -0.85 0.00 0.00 174.74 175.98 2j6b h GLN 46 N 6.66 0.07 -0.34 1.40 4.15 -1.92 -1.94 115.11 123.19 2j6b h GLN 46 Ca -0.34 -0.00 -0.05 0.00 0.77 0.00 0.00 58.65 59.02 2j6b h GLN 46 Cb 1.17 -0.02 -0.02 0.00 0.21 0.00 0.00 27.48 28.83 2j6b h GLN 46 CO 0.50 0.05 -0.02 0.00 -1.93 0.00 0.00 178.83 177.43 2j6b h ALA 47 N 1.22 1.34 -0.49 3.38 0.00 -1.82 -0.89 119.26 122.01 2j6b h ALA 47 Ca 0.12 -0.21 -0.13 0.00 0.00 0.00 0.00 54.91 54.69 2j6b h ALA 47 Cb 0.16 -0.15 -0.01 0.00 0.00 0.00 0.00 17.79 17.79 2j6b h ALA 47 CO -0.21 0.45 -0.22 1.15 0.00 0.00 0.00 179.25 180.43 2j6b h THR 48 N 0.52 1.27 -0.72 0.00 2.02 -1.76 -0.24 112.91 113.99 2j6b h THR 48 Ca 0.11 -1.38 -0.03 0.00 0.77 0.00 0.00 66.41 65.87 2j6b h THR 48 Cb 0.36 1.12 -0.03 0.00 -1.74 0.00 0.00 68.15 67.86 2j6b h THR 48 CO 0.01 0.48 0.32 0.00 0.37 0.00 0.00 175.52 176.70 2j6b h ALA 49 N 0.87 0.94 -0.34 6.16 0.00 -0.87 -0.76 119.26 125.26 2j6b h ALA 49 Ca 0.11 -0.17 -0.04 0.00 0.00 0.00 0.00 54.91 54.81 2j6b h ALA 49 Cb 0.80 -0.28 -0.01 0.00 0.00 0.00 0.00 17.79 18.29 2j6b h ALA 49 CO 0.07 0.53 0.05 0.93 0.00 0.00 0.00 179.25 180.83 2j6b h GLU 50 N 1.02 0.56 -0.18 0.00 5.08 -0.99 -0.04 114.58 120.03 2j6b h GLU 50 Ca 0.24 -0.15 -0.01 0.00 -1.00 0.00 0.00 59.36 58.44 2j6b h GLU 50 Cb 0.17 -0.07 -0.01 0.00 0.50 0.00 0.00 28.75 29.35 2j6b h GLU 50 CO -0.02 0.64 0.06 1.25 -1.00 0.00 0.00 179.01 179.94 2j6b h LEU 51 N 0.40 0.27 -0.74 1.33 5.85 -0.89 -2.18 115.31 119.34 2j6b h LEU 51 Ca 0.10 -0.20 -0.06 0.00 0.84 0.00 0.00 57.88 58.56 2j6b h LEU 51 Cb 0.35 -0.07 -0.03 0.00 0.37 0.00 0.00 40.66 41.28 2j6b h LEU 51 CO 0.01 0.40 0.23 -0.07 -0.34 0.00 0.00 178.44 178.66 2j6b h LEU 52 N 0.12 1.08 -0.70 2.25 3.38 -1.09 -0.66 115.31 119.70 2j6b h LEU 52 Ca 0.06 -0.21 0.07 0.00 0.09 0.00 0.00 57.88 57.89 2j6b h LEU 52 Cb 0.22 -0.28 -0.06 0.00 0.09 0.00 0.00 40.66 40.63 2j6b h LEU 52 CO -0.00 1.00 0.38 0.28 0.09 0.00 0.00 178.44 180.19 2j6b h SER 53 N 1.10 0.55 0.20 -0.43 0.02 -0.90 -0.57 113.55 113.52 2j6b h SER 53 Ca 0.24 0.04 -0.01 0.00 -0.84 0.00 0.00 61.79 61.22 2j6b h SER 53 Cb 0.31 -0.07 0.00 0.00 0.14 0.00 0.00 62.40 62.78 2j6b h SER 53 CO -0.01 0.34 -0.10 -1.28 -1.14 0.00 0.00 176.83 174.65 2j6b h SER 54 N 0.68 -0.22 0.66 3.07 0.87 -0.86 -0.28 113.55 117.46 2j6b h SER 54 Ca 0.32 -0.19 -0.13 0.00 -1.23 0.00 0.00 61.79 60.56 2j6b h SER 54 Cb 0.25 0.06 -0.02 0.00 -0.44 0.00 0.00 62.40 62.25 2j6b h SER 54 CO -0.21 0.08 -0.62 0.16 -0.53 0.00 0.00 176.83 175.70 2j6b h ILE 55 N -0.54 1.42 0.00 2.23 3.07 -1.03 -3.13 117.51 119.53 2j6b h ILE 55 Ca -0.03 -2.16 0.00 0.00 1.55 0.00 0.00 64.86 64.23 2j6b h ILE 55 Cb 0.40 2.17 0.00 0.00 -0.27 0.00 0.00 36.82 39.13 2j6b h ILE 55 CO 0.04 0.61 -0.85 0.18 -1.05 0.00 0.00 178.15 177.09 2j6b n LEU 56 N -3.75 0.68 -1.32 0.16 4.77 -0.23 -4.88 117.00 112.42 2j6b n LEU 56 Ca -0.01 0.15 -0.13 0.00 -0.03 0.00 0.00 56.01 55.99 2j6b n LEU 56 Cb 0.63 -0.13 -0.02 0.00 -2.33 0.00 0.00 43.42 41.57 2j6b n LEU 56 CO 0.42 -0.04 -0.15 0.61 -1.33 0.00 0.00 177.39 176.90 2j6b n GLY 57 N 1.32 0.30 3.26 -0.72 0.00 -0.13 -4.78 105.19 104.44 2j6b n GLY 57 Ca 0.02 -0.37 -0.14 0.00 0.00 0.00 0.00 46.02 45.53 2j6b n GLY 57 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 2j6b s VAL 58 N -2.59 0.46 -0.54 1.61 -7.23 -1.16 -5.06 120.40 105.89 2j6b s VAL 58 Ca 0.00 -1.98 -0.28 0.00 -1.81 0.00 0.00 61.98 57.90 2j6b s VAL 58 Cb 0.00 -2.39 0.03 0.00 0.56 0.00 0.00 36.38 34.58 2j6b s VAL 58 CO 0.00 -0.20 1.19 0.21 -0.31 0.00 0.00 175.10 175.99 2j6b s ASN 59 N -3.22 6.49 -0.48 4.85 2.47 -1.26 -4.30 114.94 119.48 2j6b s ASN 59 Ca 0.32 0.25 -0.10 0.00 0.42 0.00 0.00 52.86 53.75 2j6b s ASN 59 Cb 0.07 -2.55 0.12 0.00 -1.45 0.00 0.00 41.25 37.44 2j6b s ASN 59 CO 0.09 -1.42 0.37 -0.69 -3.72 0.00 0.00 177.10 171.74 2j6b s VAL 60 N 4.86 4.40 0.64 -5.21 1.01 -1.26 -5.03 120.40 119.81 2j6b s VAL 60 Ca 0.46 -1.73 -0.15 0.00 0.00 0.00 0.00 61.98 60.55 2j6b s VAL 60 Cb -0.08 -3.88 -0.01 0.00 0.00 0.00 0.00 36.38 32.42 2j6b s VAL 60 CO 0.28 -0.79 1.11 -2.84 0.00 0.00 0.00 175.10 172.86 2j6b s PRO 61 N 1.41 2.88 -0.48 2.72 0.02 -1.26 -4.64 135.00 135.64 2j6b s PRO 61 Ca 0.05 1.41 -0.27 0.00 0.02 0.00 0.00 61.00 62.21 2j6b s PRO 61 Cb -0.27 -1.96 0.03 0.00 0.02 0.00 0.00 34.50 32.32 2j6b s PRO 61 CO -0.00 -1.19 1.04 1.41 -0.33 0.00 0.00 177.00 177.93 2j6b s MET 62 N -4.01 3.62 -0.46 5.54 1.75 -1.26 -4.28 119.30 120.21 2j6b s MET 62 Ca 0.67 0.36 0.03 0.00 -1.25 0.00 0.00 55.69 55.51 2j6b s MET 62 Cb -0.21 -3.92 0.16 0.00 2.84 0.00 0.00 34.83 33.70 2j6b s MET 62 CO 0.40 -1.33 0.32 1.21 -0.65 0.00 0.00 175.02 174.97 2j6b s ASN 63 N 2.40 2.79 -1.28 1.11 2.47 0.14 -4.98 114.94 117.60 2j6b s ASN 63 Ca 0.43 -2.97 -0.16 0.00 0.42 0.00 0.00 52.86 50.58 2j6b s ASN 63 Cb -0.08 -0.78 0.11 0.00 -1.45 0.00 0.00 41.25 39.05 2j6b s ASN 63 CO 0.29 -0.20 1.66 -1.14 -3.72 0.00 0.00 177.10 173.99 2j6b n ARG 64 N 3.04 3.27 -4.32 0.43 0.63 -1.24 -3.80 116.66 114.67 2j6b n ARG 64 Ca 0.20 -3.47 -0.20 0.00 -0.92 0.00 0.00 57.85 53.46 2j6b n ARG 64 Cb 0.41 -3.27 -0.11 0.00 0.45 0.00 0.00 32.46 29.94 2j6b n ARG 64 CO 0.00 0.00 0.00 0.14 -2.51 0.00 0.00 177.63 175.26 2j6b s VAL 65 N 2.90 1.70 0.01 5.15 -7.23 -1.26 -5.05 120.40 116.62 2j6b s VAL 65 Ca 0.48 -2.01 -0.26 0.00 -1.81 0.00 0.00 61.98 58.38 2j6b s VAL 65 Cb 0.02 -1.88 -0.04 0.00 0.56 0.00 0.00 36.38 35.04 2j6b s VAL 65 CO 0.03 -0.45 0.82 -1.58 -0.31 0.00 0.00 175.10 173.61 2j6b s GLN 66 N -3.14 4.52 0.13 4.82 0.74 -1.26 -4.92 119.66 120.55 2j6b s GLN 66 Ca 0.17 1.14 0.08 0.00 0.05 0.00 0.00 55.36 56.81 2j6b s GLN 66 Cb -0.03 -3.41 -0.04 0.00 1.10 0.00 0.00 33.01 30.63 2j6b s GLN 66 CO 0.06 0.14 -0.19 0.96 -0.55 0.00 0.00 175.29 175.71 2j6b s ILE 67 N 0.43 1.68 0.03 -2.34 -5.25 -1.26 -5.15 121.20 109.34 2j6b s ILE 67 Ca 0.42 -1.70 0.08 0.00 -0.99 0.00 0.00 60.65 58.46 2j6b s ILE 67 Cb -0.20 -1.64 -0.02 0.00 2.95 0.00 0.00 42.46 43.54 2j6b s ILE 67 CO 0.24 -0.22 -0.23 -0.54 -1.79 0.00 0.00 174.94 172.40 2j6b s LYS 68 N -2.35 1.67 0.09 0.37 -0.14 -1.26 -4.81 119.74 113.30 2j6b s LYS 68 Ca 0.10 -0.97 0.06 0.00 -1.36 0.00 0.00 55.97 53.80 2j6b s LYS 68 Cb -0.08 -1.76 -0.04 0.00 -1.68 0.00 0.00 37.83 34.28 2j6b s LYS 68 CO 0.05 0.46 -0.07 0.14 -0.76 0.00 0.00 175.35 175.16 2j6b s VAL 69 N -0.73 3.54 0.09 3.17 -7.23 -0.07 -4.88 120.40 114.29 2j6b s VAL 69 Ca 0.09 -1.17 0.01 0.00 -1.81 0.00 0.00 61.98 59.10 2j6b s VAL 69 Cb -0.09 -2.65 -0.00 0.00 0.56 0.00 0.00 36.38 34.19 2j6b s VAL 69 CO 0.01 0.13 0.09 1.07 -0.31 0.00 0.00 175.10 176.10 2j6b n THR 70 N 0.73 0.00 -1.67 5.32 5.66 -1.26 -1.02 114.28 122.05 2j6b n THR 70 Ca -0.13 -0.56 -0.45 0.00 -3.05 0.00 0.00 64.05 59.86 2j6b n THR 70 Cb 0.52 0.30 -0.03 0.00 -1.55 0.00 0.00 70.33 69.58 2j6b n THR 70 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 2j6b n HIS 71 N -0.16 2.11 0.00 1.09 1.44 -1.26 -1.70 115.22 116.73 2j6b n HIS 71 Ca 0.01 0.46 0.00 0.00 -2.01 0.00 0.00 57.72 56.18 2j6b n HIS 71 Cb 0.15 -2.44 0.00 0.00 0.12 0.00 0.00 29.99 27.82 2j6b n HIS 71 CO 0.00 0.00 0.00 0.41 -2.81 0.00 0.00 176.34 173.94 2j6b n GLY 72 N 2.07 2.10 3.89 -1.39 0.00 0.01 -4.97 105.19 106.90 2j6b n GLY 72 Ca 0.11 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.84 2j6b n GLY 72 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 2j6b s ASP 73 N -1.89 6.16 0.08 1.61 1.01 -0.69 -4.14 116.67 118.81 2j6b s ASP 73 Ca 0.00 1.12 0.04 0.00 0.71 0.00 0.00 52.55 54.42 2j6b s ASP 73 Cb 0.00 -2.29 -0.03 0.00 1.01 0.00 0.00 42.92 41.61 2j6b s ASP 73 CO 0.00 -0.77 -0.10 -0.13 0.21 0.00 0.00 175.17 174.38 2j6b s ARG 74 N -4.97 0.75 -0.08 8.23 0.52 -0.46 -1.47 118.95 121.47 2j6b s ARG 74 Ca 0.51 -1.01 0.03 0.00 -0.52 0.00 0.00 55.73 54.74 2j6b s ARG 74 Cb -0.11 -0.53 0.01 0.00 0.52 0.00 0.00 34.95 34.85 2j6b s ARG 74 CO 0.49 0.09 -0.16 0.42 0.02 0.00 0.00 175.30 176.16 2j6b s ILE 75 N -1.92 1.47 -0.37 1.52 1.01 0.00 -0.92 121.20 122.01 2j6b s ILE 75 Ca -0.00 -0.66 -0.17 0.00 0.00 0.00 0.00 60.65 59.81 2j6b s ILE 75 Cb -0.06 -1.32 0.00 0.00 0.01 0.00 0.00 42.46 41.09 2j6b s ILE 75 CO 0.00 0.43 0.45 -0.22 0.00 0.00 0.00 174.94 175.60 2j6b s LEU 76 N 0.66 4.51 -0.16 2.97 2.96 0.24 -0.85 118.68 129.01 2j6b s LEU 76 Ca -0.14 -0.27 -0.03 0.00 -0.22 0.00 0.00 54.13 53.47 2j6b s LEU 76 Cb -0.16 -2.46 -0.02 0.00 0.50 0.00 0.00 46.19 44.05 2j6b s LEU 76 CO 0.04 -0.47 -0.06 0.00 -1.32 0.00 0.00 176.35 174.54 2j6b s ALA 77 N 2.22 2.89 -0.31 5.97 0.00 0.35 -1.18 121.76 131.71 2j6b s ALA 77 Ca 0.15 -0.88 -0.24 0.00 0.00 0.00 0.00 51.96 50.98 2j6b s ALA 77 Cb -0.16 -1.50 0.00 0.00 0.00 0.00 0.00 23.12 21.46 2j6b s ALA 77 CO 0.13 0.13 0.82 0.12 0.00 0.00 0.00 175.76 176.96 2j6b s PHE 78 N 0.52 3.19 -0.31 0.00 5.36 -0.42 -1.29 117.98 125.03 2j6b s PHE 78 Ca -0.04 0.83 0.01 0.00 -0.96 0.00 0.00 56.93 56.77 2j6b s PHE 78 Cb -0.15 -3.28 0.07 0.00 -0.34 0.00 0.00 43.02 39.32 2j6b s PHE 78 CO 0.03 -0.60 0.01 1.41 -1.46 0.00 0.00 175.22 174.61 2j6b s MET 79 N 3.04 2.10 0.47 10.12 -2.45 0.07 -2.45 119.30 130.20 2j6b s MET 79 Ca 0.34 -1.51 -0.24 0.00 -1.25 0.00 0.00 55.69 53.03 2j6b s MET 79 Cb -0.14 -3.16 -0.07 0.00 1.25 0.00 0.00 34.83 32.71 2j6b s MET 79 CO 0.13 -0.74 1.28 -1.17 1.05 0.00 0.00 175.02 175.57 2j6b s LEU 80 N 1.11 4.04 0.00 4.11 2.96 -1.26 -0.74 118.68 128.90 2j6b s LEU 80 Ca -0.01 2.60 0.30 0.00 -0.22 0.00 0.00 54.13 56.80 2j6b s LEU 80 Cb -0.20 -4.11 1.51 0.00 0.50 0.00 0.00 46.19 43.89 2j6b s LEU 80 CO -0.04 -1.10 2.03 0.29 -1.32 0.00 0.00 176.35 176.21 2j6b n LYS 81 N -0.41 0.65 -4.17 1.98 5.02 -0.01 -4.79 118.16 116.43 2j6b n LYS 81 Ca 0.07 -0.09 -0.14 0.00 -2.02 0.00 0.00 58.31 56.13 2j6b n LYS 81 Cb 0.45 -1.50 -0.11 0.00 -0.02 0.00 0.00 35.03 33.86 2j6b n LYS 81 CO 0.00 0.00 0.00 -0.65 -0.52 0.00 0.00 177.40 176.23 2j6b s GLN 82 N -2.41 0.83 0.07 1.97 -0.21 -1.26 -5.05 119.66 113.60 2j6b s GLN 82 Ca 0.33 -1.17 -0.20 0.00 0.02 0.00 0.00 55.36 54.34 2j6b s GLN 82 Cb 0.21 -0.47 -0.07 0.00 1.00 0.00 0.00 33.01 33.68 2j6b s GLN 82 CO 0.44 0.06 0.59 0.50 -2.12 0.00 0.00 175.29 174.77 2j6b s ARG 83 N -2.90 4.24 0.23 2.91 3.52 -1.26 -5.08 118.95 120.60 2j6b s ARG 83 Ca 0.06 0.77 -0.01 0.00 -0.13 0.00 0.00 55.73 56.42 2j6b s ARG 83 Cb -0.02 -3.25 -0.04 0.00 -1.56 0.00 0.00 34.95 30.08 2j6b s ARG 83 CO -0.01 0.61 0.43 -0.51 -0.81 0.00 0.00 175.30 175.01 2j6b s LEU 84 N -1.02 4.19 0.93 -0.88 1.43 -1.26 -5.08 118.68 116.99 2j6b s LEU 84 Ca 0.30 0.45 -0.10 0.00 -1.03 0.00 0.00 54.13 53.74 2j6b s LEU 84 Cb -0.20 -3.23 0.16 0.00 0.03 0.00 0.00 46.19 42.95 2j6b s LEU 84 CO 0.19 -0.09 1.14 -2.84 0.23 0.00 0.00 176.35 174.99 2j6b s PRO 85 N -3.44 0.87 0.17 1.29 0.02 -1.26 -4.88 135.00 127.77 2j6b s PRO 85 Ca 0.39 1.49 -0.34 0.00 0.02 0.00 0.00 61.00 62.57 2j6b s PRO 85 Cb -0.11 -1.72 -0.14 0.00 0.02 0.00 0.00 34.50 32.56 2j6b s PRO 85 CO 0.30 -2.71 1.53 0.39 -0.33 0.00 0.00 177.00 176.18 2j6b n GLU 86 N -4.28 2.05 -0.05 5.54 1.02 -1.26 -2.11 120.64 121.55 2j6b n GLU 86 Ca 0.11 0.74 0.00 0.00 -0.02 0.00 0.00 57.16 57.99 2j6b n GLU 86 Cb 0.52 -2.48 0.00 0.00 -0.02 0.00 0.00 31.44 29.46 2j6b n GLU 86 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 2j6b n GLY 87 N 3.14 2.62 3.73 0.62 0.00 -1.26 -4.99 105.19 109.05 2j6b n GLY 87 Ca 0.16 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.77 2j6b n GLY 87 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2j6b s VAL 88 N -2.87 4.03 -0.10 1.61 1.01 -0.90 -5.04 120.40 118.15 2j6b s VAL 88 Ca 0.00 1.68 0.04 0.00 0.00 0.00 0.00 61.98 63.70 2j6b s VAL 88 Cb 0.00 -4.07 -0.00 0.00 0.00 0.00 0.00 36.38 32.31 2j6b s VAL 88 CO 0.00 0.26 -0.24 -0.69 0.00 0.00 0.00 175.10 174.43 2j6b s VAL 89 N 0.03 2.06 -0.11 2.92 1.01 -1.26 -4.88 120.40 120.17 2j6b s VAL 89 Ca 0.50 -1.02 -0.30 0.00 0.00 0.00 0.00 61.98 61.17 2j6b s VAL 89 Cb -0.28 -1.78 -0.02 0.00 0.00 0.00 0.00 36.38 34.31 2j6b s VAL 89 CO 0.33 0.56 1.10 -0.69 0.00 0.00 0.00 175.10 176.40 2j6b s VAL 90 N 0.33 4.55 -1.46 2.92 1.01 -1.26 -4.92 120.40 121.57 2j6b s VAL 90 Ca -0.19 1.85 0.22 0.00 0.00 0.00 0.00 61.98 63.86 2j6b s VAL 90 Cb -0.18 -4.19 -0.11 0.00 0.00 0.00 0.00 36.38 31.91 2j6b s VAL 90 CO 0.09 -0.04 1.03 0.29 0.00 0.00 0.00 175.10 176.47 2j6b n LYS 91 N 5.40 0.53 -4.63 2.72 4.76 -1.26 -4.52 118.16 121.17 2j6b n LYS 91 Ca 0.10 -0.43 -0.24 0.00 -2.87 0.00 0.00 58.31 54.87 2j6b n LYS 91 Cb 0.47 -1.49 -0.14 0.00 -1.84 0.00 0.00 35.03 32.03 2j6b n LYS 91 CO 0.00 0.00 0.00 0.95 -1.37 0.00 0.00 177.40 176.98 2j6b s THR 92 N -2.77 1.44 0.45 -0.18 -4.23 -1.26 -4.62 115.64 104.48 2j6b s THR 92 Ca 0.13 -1.01 0.14 0.00 -1.18 0.00 0.00 61.69 59.77 2j6b s THR 92 Cb 0.17 -1.25 0.20 0.00 1.34 0.00 0.00 72.50 72.96 2j6b s THR 92 CO 0.72 0.21 2.01 0.71 -0.54 0.00 0.00 174.62 177.74 2j6b h THR 93 N 4.50 1.11 -0.49 3.99 1.35 -1.92 -2.58 112.91 118.87 2j6b h THR 93 Ca -0.40 -0.53 -0.01 0.00 -0.55 0.00 0.00 66.41 64.92 2j6b h THR 93 Cb 1.16 1.25 -0.02 0.00 -1.73 0.00 0.00 68.15 68.80 2j6b h THR 93 CO 0.45 0.15 0.26 -0.33 -0.25 0.00 0.00 175.52 175.81 2j6b h GLU 94 N 0.04 0.69 -0.45 4.72 3.07 -1.97 -0.30 114.58 120.38 2j6b h GLU 94 Ca 0.01 -0.08 -0.12 0.00 -0.50 0.00 0.00 59.36 58.67 2j6b h GLU 94 Cb 0.27 -0.13 -0.01 0.00 -0.84 0.00 0.00 28.75 28.03 2j6b h GLU 94 CO 0.02 0.55 -0.18 1.49 -1.40 0.00 0.00 179.01 179.49 2j6b h GLU 95 N 0.65 0.91 -0.82 2.33 4.81 -1.92 -1.93 114.58 118.61 2j6b h GLU 95 Ca 0.17 -0.38 0.09 0.00 -0.13 0.00 0.00 59.36 59.11 2j6b h GLU 95 Cb 0.06 -0.04 -0.07 0.00 0.63 0.00 0.00 28.75 29.34 2j6b h GLU 95 CO -0.03 1.04 0.47 -0.07 -0.73 0.00 0.00 179.01 179.69 2j6b h LEU 96 N 0.75 0.69 -0.60 1.64 3.38 -1.07 -0.40 115.31 119.70 2j6b h LEU 96 Ca 0.11 0.04 -0.11 0.00 0.09 0.00 0.00 57.88 58.01 2j6b h LEU 96 Cb 0.74 -0.09 -0.02 0.00 0.09 0.00 0.00 40.66 41.38 2j6b h LEU 96 CO 0.06 0.41 -0.05 -0.33 0.09 0.00 0.00 178.44 178.62 2j6b h GLU 97 N 0.81 1.06 -0.48 1.13 4.39 -0.84 -0.18 114.58 120.47 2j6b h GLU 97 Ca 0.39 -0.36 -0.13 0.00 0.34 0.00 0.00 59.36 59.60 2j6b h GLU 97 Cb 0.32 -0.08 -0.01 0.00 -0.10 0.00 0.00 28.75 28.87 2j6b h GLU 97 CO -0.23 1.06 -0.21 0.87 -1.16 0.00 0.00 179.01 179.34 2j6b h LYS 98 N 0.95 0.98 -0.48 2.33 1.57 -0.82 -2.88 116.57 118.22 2j6b h LYS 98 Ca 0.16 -0.42 -0.02 0.00 -1.87 0.00 0.00 60.65 58.50 2j6b h LYS 98 Cb 0.61 -0.04 -0.02 0.00 0.08 0.00 0.00 32.23 32.86 2j6b h LYS 98 CO 0.04 1.09 0.21 0.82 -0.57 0.00 0.00 179.45 181.04 2j6b h ILE 99 N 0.85 1.20 0.00 1.86 2.04 -1.02 -3.50 117.51 118.95 2j6b h ILE 99 Ca 0.11 -0.59 0.00 0.00 1.00 0.00 0.00 64.86 65.38 2j6b h ILE 99 Cb 0.79 0.69 0.00 0.00 -0.74 0.00 0.00 36.82 37.56 2j6b h ILE 99 CO 0.07 0.23 0.00 0.61 0.00 0.00 0.00 178.15 179.05 2j6b n GLY 100 N -0.85 0.46 3.33 5.37 0.00 -0.09 -4.52 105.19 108.90 2j6b n GLY 100 Ca 0.02 -1.68 -0.10 0.00 0.00 0.00 0.00 46.02 44.26 2j6b n GLY 100 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 2j6b s TYR 101 N -2.90 -0.02 0.08 1.61 -0.85 -1.26 -0.83 117.35 113.18 2j6b s TYR 101 Ca 0.00 -0.33 0.09 0.00 -0.52 0.00 0.00 57.07 56.31 2j6b s TYR 101 Cb 0.00 0.16 -0.03 0.00 0.38 0.00 0.00 41.96 42.47 2j6b s TYR 101 CO 0.00 -0.70 -0.24 -1.21 -1.52 0.00 0.00 175.55 171.87 2j6b s GLU 102 N -3.85 1.49 -0.22 -3.49 2.02 0.08 -4.93 118.70 109.81 2j6b s GLU 102 Ca 0.07 -1.14 -0.07 0.00 0.02 0.00 0.00 54.97 53.85 2j6b s GLU 102 Cb 0.02 -1.75 -0.03 0.00 0.10 0.00 0.00 34.13 32.47 2j6b s GLU 102 CO -0.08 0.44 0.05 -0.51 0.02 0.00 0.00 175.26 175.17 2j6b s LEU 103 N -1.54 3.48 0.04 1.80 1.43 -1.26 -0.75 118.68 121.88 2j6b s LEU 103 Ca 0.10 -0.13 0.07 0.00 -1.03 0.00 0.00 54.13 53.15 2j6b s LEU 103 Cb -0.10 -1.91 -0.03 0.00 0.03 0.00 0.00 46.19 44.19 2j6b s LEU 103 CO 0.03 0.05 -0.20 0.26 0.23 0.00 0.00 176.35 176.72 2j6b s TRP 104 N 1.13 2.50 -0.23 0.29 0.52 -0.41 -0.58 118.94 122.16 2j6b s TRP 104 Ca 0.04 -0.29 -0.04 0.00 0.02 0.00 0.00 56.10 55.82 2j6b s TRP 104 Cb -0.14 -1.45 -0.00 0.00 -1.15 0.00 0.00 33.47 30.72 2j6b s TRP 104 CO 0.03 0.21 -0.03 -1.17 0.02 0.00 0.00 176.95 176.01 2j6b s LEU 105 N -1.33 3.02 -0.15 2.99 2.96 0.22 -0.49 118.68 125.91 2j6b s LEU 105 Ca 0.14 -0.48 -0.04 0.00 -0.22 0.00 0.00 54.13 53.53 2j6b s LEU 105 Cb -0.10 -1.74 -0.03 0.00 0.50 0.00 0.00 46.19 44.81 2j6b s LEU 105 CO 0.04 -0.05 -0.02 -0.36 -1.32 0.00 0.00 176.35 174.64 2j6b s PHE 106 N 1.46 3.07 -0.22 5.38 0.08 -0.03 -2.12 117.98 125.61 2j6b s PHE 106 Ca 0.05 -0.18 0.00 0.00 0.12 0.00 0.00 56.93 56.93 2j6b s PHE 106 Cb -0.15 -1.95 0.03 0.00 -0.57 0.00 0.00 43.02 40.38 2j6b s PHE 106 CO -0.03 0.06 -0.13 -1.21 -0.10 0.00 0.00 175.22 173.81 2j6b s GLU 107 N 0.19 2.80 -0.20 0.44 2.02 0.18 -0.82 118.70 123.31 2j6b s GLU 107 Ca -0.01 -0.98 -0.14 0.00 0.02 0.00 0.00 54.97 53.87 2j6b s GLU 107 Cb -0.13 -2.79 -0.04 0.00 0.10 0.00 0.00 34.13 31.26 2j6b s GLU 107 CO 0.02 -0.35 0.30 0.42 0.02 0.00 0.00 175.26 175.67 2j6b s ILE 108 N 1.27 5.28 0.00 -1.63 1.09 -0.54 -1.30 121.20 125.36 2j6b s ILE 108 Ca 0.01 0.51 0.00 0.00 -1.10 0.00 0.00 60.65 60.06 2j6b s ILE 108 Cb -0.16 -3.63 0.00 0.00 -1.06 0.00 0.00 42.46 37.61 2j6b s ILE 108 CO -0.08 0.32 0.16 1.67 -0.10 0.00 0.00 174.94 176.91