#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1tvn s VAL 2 N 0.00 2.39 0.47 0.00 -7.23 -1.26 -4.98 120.40 109.80 1tvn s VAL 2 Ca 0.00 -2.02 -0.19 0.00 -1.81 0.00 0.00 61.98 57.96 1tvn s VAL 2 Cb 0.00 -2.80 -0.09 0.00 0.56 0.00 0.00 36.38 34.05 1tvn s VAL 2 CO 0.00 -0.15 0.98 -1.61 -0.31 0.00 0.00 175.10 174.00 1tvn s GLU 3 N -3.70 4.05 0.21 4.82 0.41 -1.26 -4.89 118.70 118.34 1tvn s GLU 3 Ca 0.35 1.08 -0.30 0.00 -0.41 0.00 0.00 54.97 55.69 1tvn s GLU 3 Cb 0.03 -2.15 -0.09 0.00 -1.78 0.00 0.00 34.13 30.14 1tvn s GLU 3 CO 0.19 -0.19 1.20 0.15 -0.49 0.00 0.00 175.26 176.12 1tvn s LYS 4 N -3.56 4.49 -0.19 1.61 1.02 -1.26 -4.66 119.74 117.19 1tvn s LYS 4 Ca 0.61 1.91 -0.12 0.00 0.02 0.00 0.00 55.97 58.39 1tvn s LYS 4 Cb -0.10 -3.21 -0.05 0.00 -0.52 0.00 0.00 37.83 33.95 1tvn s LYS 4 CO 0.21 -0.07 0.24 -0.51 -0.92 0.00 0.00 175.35 174.30 1tvn s LEU 5 N -0.54 4.19 0.21 3.17 1.43 -1.26 -0.90 118.68 124.99 1tvn s LEU 5 Ca 0.52 0.35 0.00 0.00 -1.03 0.00 0.00 54.13 53.97 1tvn s LEU 5 Cb -0.34 -2.27 -0.05 0.00 0.03 0.00 0.00 46.19 43.57 1tvn s LEU 5 CO 0.39 0.08 0.09 0.42 0.23 0.00 0.00 176.35 177.56 1tvn s THR 6 N 0.70 0.37 -0.04 5.49 -4.23 -0.41 -4.34 115.64 113.17 1tvn s THR 6 Ca 0.13 -1.99 0.07 0.00 -1.18 0.00 0.00 61.69 58.72 1tvn s THR 6 Cb -0.13 -2.46 -0.01 0.00 1.34 0.00 0.00 72.50 71.24 1tvn s THR 6 CO 0.03 -0.12 -0.25 -0.69 -0.54 0.00 0.00 174.62 173.05 1tvn s VAL 7 N -3.89 2.05 -0.12 2.29 1.01 -1.26 -0.23 120.40 120.24 1tvn s VAL 7 Ca 0.35 -1.08 -0.04 0.00 0.00 0.00 0.00 61.98 61.21 1tvn s VAL 7 Cb 0.07 -1.72 0.05 0.00 0.00 0.00 0.00 36.38 34.78 1tvn s VAL 7 CO 0.10 0.57 0.08 -0.55 0.00 0.00 0.00 175.10 175.30 1tvn s SER 8 N -0.33 1.92 0.86 3.32 0.15 -0.25 -4.66 113.70 114.69 1tvn s SER 8 Ca 0.02 -0.36 0.00 0.00 0.70 0.00 0.00 55.95 56.31 1tvn s SER 8 Cb -0.12 -0.22 0.00 0.00 -1.71 0.00 0.00 66.02 63.96 1tvn s SER 8 CO 0.02 -0.31 0.00 0.61 1.20 0.00 0.00 173.24 174.76 1tvn n GLY 9 N 5.28 2.34 1.27 9.45 0.00 -1.26 -1.75 105.19 120.51 1tvn n GLY 9 Ca -0.06 -0.49 0.05 0.00 0.00 0.00 0.00 46.02 45.53 1tvn n GLY 9 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 1tvn n ASN 10 N 2.31 3.69 -4.52 1.61 0.23 -1.24 -4.14 115.26 113.20 1tvn n ASN 10 Ca 0.00 -2.45 -0.32 0.00 -0.53 0.00 0.00 54.58 51.28 1tvn n ASN 10 Cb 0.00 -0.54 -0.12 0.00 -2.08 0.00 0.00 39.78 37.04 1tvn n ASN 10 CO 0.00 0.00 0.00 -1.10 -0.93 0.00 0.00 177.26 175.23 1tvn s GLN 11 N -1.94 2.49 -0.28 -3.83 -0.21 -0.72 -4.03 119.66 111.14 1tvn s GLN 11 Ca 0.35 -0.72 -0.12 0.00 0.02 0.00 0.00 55.36 54.89 1tvn s GLN 11 Cb 0.24 -2.41 -0.04 0.00 1.00 0.00 0.00 33.01 31.80 1tvn s GLN 11 CO 0.13 0.61 0.24 0.42 -2.12 0.00 0.00 175.29 174.58 1tvn s ILE 12 N -0.83 5.27 -0.01 1.08 1.01 -1.26 -1.09 121.20 125.37 1tvn s ILE 12 Ca 0.13 0.23 -0.02 0.00 0.00 0.00 0.00 60.65 61.00 1tvn s ILE 12 Cb -0.11 -3.59 -0.04 0.00 0.01 0.00 0.00 42.46 38.74 1tvn s ILE 12 CO 0.03 0.20 0.15 -0.76 0.00 0.00 0.00 174.94 174.56 1tvn s LEU 13 N 1.84 4.21 -0.24 2.97 1.43 0.68 -4.23 118.68 125.33 1tvn s LEU 13 Ca 0.09 0.28 0.02 0.00 -1.03 0.00 0.00 54.13 53.49 1tvn s LEU 13 Cb -0.16 -2.49 0.05 0.00 0.03 0.00 0.00 46.19 43.62 1tvn s LEU 13 CO 0.11 0.27 -0.12 0.00 0.23 0.00 0.00 176.35 176.84 1tvn s ALA 14 N -1.27 2.55 -1.42 4.21 0.00 -0.03 -1.29 121.76 124.50 1tvn s ALA 14 Ca 0.26 -1.63 0.00 0.00 0.00 0.00 0.00 51.96 50.59 1tvn s ALA 14 Cb -0.12 -1.53 0.00 0.00 0.00 0.00 0.00 23.12 21.46 1tvn s ALA 14 CO 0.17 -1.00 0.00 0.41 0.00 0.00 0.00 175.76 175.34 1tvn n GLY 15 N 4.50 0.25 2.51 0.00 0.00 -0.08 -1.85 105.19 110.53 1tvn n GLY 15 Ca -0.16 -0.25 0.00 0.00 0.00 0.00 0.00 46.02 45.61 1tvn n GLY 15 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1tvn n GLY 16 N -1.03 0.84 3.51 -0.02 0.00 -1.26 -5.03 105.19 102.20 1tvn n GLY 16 Ca -0.18 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.55 1tvn n GLY 16 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1tvn s GLU 17 N -0.07 1.91 -0.01 1.61 2.02 -0.77 -5.00 118.70 118.38 1tvn s GLU 17 Ca 0.00 -1.12 -0.30 0.00 0.02 0.00 0.00 54.97 53.57 1tvn s GLU 17 Cb 0.00 -2.18 -0.04 0.00 0.10 0.00 0.00 34.13 32.01 1tvn s GLU 17 CO 0.00 0.49 1.24 -0.80 0.02 0.00 0.00 175.26 176.21 1tvn s ASN 18 N -2.10 7.02 0.10 -0.19 0.01 -1.26 -0.85 114.94 117.67 1tvn s ASN 18 Ca 0.19 1.93 -0.26 0.00 -0.71 0.00 0.00 52.86 54.01 1tvn s ASN 18 Cb -0.11 -2.56 0.09 0.00 0.41 0.00 0.00 41.25 39.08 1tvn s ASN 18 CO 0.11 -0.57 1.13 0.28 -1.51 0.00 0.00 177.10 176.54 1tvn s THR 19 N 1.89 0.00 0.17 1.60 -1.32 -1.26 -4.97 115.64 111.76 1tvn s THR 19 Ca 0.58 -0.43 -0.11 0.00 -1.21 0.00 0.00 61.69 60.52 1tvn s THR 19 Cb -0.27 -2.62 -0.00 0.00 -1.51 0.00 0.00 72.50 68.09 1tvn s THR 19 CO 0.25 0.00 0.34 -0.94 -2.21 0.00 0.00 174.62 172.06 1tvn s SER 20 N -3.37 -0.03 0.07 8.08 1.04 -1.26 -4.79 113.70 113.44 1tvn s SER 20 Ca 0.21 -0.79 0.04 0.00 0.48 0.00 0.00 55.95 55.89 1tvn s SER 20 Cb -0.01 0.47 -0.03 0.00 0.10 0.00 0.00 66.02 66.55 1tvn s SER 20 CO 0.02 -0.93 -0.11 -0.36 0.98 0.00 0.00 173.24 172.84 1tvn s PHE 21 N -3.95 0.95 0.03 5.02 0.08 -1.26 -4.95 117.98 113.90 1tvn s PHE 21 Ca 0.15 -0.53 0.03 0.00 0.12 0.00 0.00 56.93 56.70 1tvn s PHE 21 Cb 0.02 -0.54 -0.02 0.00 -0.57 0.00 0.00 43.02 41.91 1tvn s PHE 21 CO -0.01 -0.02 -0.09 0.00 -0.10 0.00 0.00 175.22 175.00 1tvn s ALA 22 N -1.64 0.76 0.13 5.36 0.00 -1.26 -1.58 121.76 123.54 1tvn s ALA 22 Ca -0.03 -0.62 -0.24 0.00 0.00 0.00 0.00 51.96 51.07 1tvn s ALA 22 Cb -0.08 -0.09 0.08 0.00 0.00 0.00 0.00 23.12 23.03 1tvn s ALA 22 CO 0.01 0.11 1.10 0.20 0.00 0.00 0.00 175.76 177.18 1tvn s GLY 23 N -0.95 0.06 0.21 0.00 0.00 -0.87 -1.82 107.32 103.94 1tvn s GLY 23 Ca -0.02 -0.24 -0.04 0.00 0.00 0.00 0.00 44.72 44.42 1tvn s GLY 23 CO 0.00 3.25 0.45 2.56 0.00 0.00 0.00 173.10 179.36 1tvn s PRO 24 N -2.12 3.61 -0.17 2.90 0.04 -1.25 -1.67 135.00 136.34 1tvn s PRO 24 Ca 0.24 -0.10 -0.07 0.00 0.04 0.00 0.00 61.00 61.11 1tvn s PRO 24 Cb -0.02 -2.77 -0.04 0.00 0.04 0.00 0.00 34.50 31.71 1tvn s PRO 24 CO 0.04 0.36 0.06 0.45 0.04 0.00 0.00 177.00 177.95 1tvn s SER 25 N -2.84 5.59 0.74 6.66 0.15 0.93 -1.74 113.70 123.20 1tvn s SER 25 Ca 0.42 0.10 -0.11 0.00 0.70 0.00 0.00 55.95 57.06 1tvn s SER 25 Cb -0.11 -1.92 0.04 0.00 -1.71 0.00 0.00 66.02 62.32 1tvn s SER 25 CO 0.27 0.21 1.08 -0.76 1.20 0.00 0.00 173.24 175.24 1tvn s LEU 26 N 0.17 3.08 0.85 3.45 1.43 -0.19 -0.63 118.68 126.85 1tvn s LEU 26 Ca 0.04 1.75 -0.13 0.00 -1.03 0.00 0.00 54.13 54.77 1tvn s LEU 26 Cb -0.12 -4.51 0.13 0.00 0.03 0.00 0.00 46.19 41.71 1tvn s LEU 26 CO 0.01 -1.81 1.21 0.12 0.23 0.00 0.00 176.35 176.11 1tvn s PHE 27 N -2.94 2.39 0.11 0.29 5.36 -1.18 -4.32 117.98 117.69 1tvn s PHE 27 Ca 0.60 0.53 -0.34 0.00 -0.96 0.00 0.00 56.93 56.76 1tvn s PHE 27 Cb -0.16 -3.69 -0.18 0.00 -0.34 0.00 0.00 43.02 38.65 1tvn s PHE 27 CO 0.55 -2.07 0.84 0.91 -1.46 0.00 0.00 175.22 173.99 1tvn n TRP 28 N -3.44 0.22 1.31 10.12 7.02 -1.26 -4.44 117.44 126.97 1tvn n TRP 28 Ca 0.11 0.98 0.14 0.00 -1.02 0.00 0.00 57.50 57.71 1tvn n TRP 28 Cb 0.60 -2.05 0.65 0.00 -2.42 0.00 0.00 31.31 28.09 1tvn n TRP 28 CO 0.00 0.00 0.00 -1.13 -2.02 0.00 0.00 177.69 174.54 1tvn n SER 29 N 1.77 0.19 -4.49 -0.99 3.41 -0.17 -4.50 113.62 108.83 1tvn n SER 29 Ca 0.19 -0.17 -0.49 0.00 -0.26 0.00 0.00 58.87 58.13 1tvn n SER 29 Cb 0.17 -0.22 -0.04 0.00 -0.26 0.00 0.00 64.21 63.87 1tvn n SER 29 CO 0.00 0.00 0.00 0.59 -0.16 0.00 0.00 175.04 175.47 1tvn n ASN 30 N -1.23 -0.02 -4.70 4.04 4.13 -1.26 -4.53 115.26 111.70 1tvn n ASN 30 Ca 0.12 1.15 -0.42 0.00 1.68 0.00 0.00 54.58 57.11 1tvn n ASN 30 Cb 0.28 -1.07 -0.03 0.00 -1.54 0.00 0.00 39.78 37.42 1tvn n ASN 30 CO 0.00 0.00 0.00 -0.89 0.28 0.00 0.00 177.26 176.65 1tvn s THR 31 N -0.67 3.12 0.00 3.41 2.01 -0.55 -2.16 115.64 120.80 1tvn s THR 31 Ca 0.69 0.62 0.00 0.00 0.31 0.00 0.00 61.69 63.32 1tvn s THR 31 Cb -0.93 -3.40 0.00 0.00 0.01 0.00 0.00 72.50 68.18 1tvn s THR 31 CO 0.56 0.01 0.00 0.61 -0.69 0.00 0.00 174.62 175.11 1tvn n GLY 32 N 3.86 0.84 0.77 4.40 0.00 -1.26 -4.25 105.19 109.55 1tvn n GLY 32 Ca 0.15 0.00 0.10 0.00 0.00 0.00 0.00 46.02 46.27 1tvn n GLY 32 CO 0.00 0.00 0.00 0.79 0.00 0.00 0.00 173.32 174.11 1tvn n TRP 33 N -2.00 0.39 -0.92 1.61 7.02 -0.92 -4.96 117.44 117.66 1tvn n TRP 33 Ca 0.00 -0.19 0.00 0.00 -1.02 0.00 0.00 57.50 56.29 1tvn n TRP 33 Cb 0.00 0.00 0.00 0.00 -2.42 0.00 0.00 31.31 28.89 1tvn n TRP 33 CO 0.00 0.00 0.00 0.41 -2.02 0.00 0.00 177.69 176.08 1tvn n GLY 34 N 1.24 0.68 0.41 6.99 0.00 -1.26 -4.85 105.19 108.40 1tvn n GLY 34 Ca 0.17 0.00 0.05 0.00 0.00 0.00 0.00 46.02 46.24 1tvn n GLY 34 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1tvn n ALA 35 N 1.00 2.51 -0.21 4.61 0.00 -1.26 -4.53 120.51 122.63 1tvn n ALA 35 Ca 0.00 -0.57 0.08 0.00 0.00 0.00 0.00 53.44 52.95 1tvn n ALA 35 Cb 0.03 -0.36 0.36 0.00 0.00 0.00 0.00 19.45 19.47 1tvn n ALA 35 CO 0.00 0.00 0.00 0.93 0.00 0.00 0.00 177.50 178.43 1tvn h GLU 36 N 2.02 0.72 0.00 0.00 3.07 -1.81 -0.79 114.58 117.79 1tvn h GLU 36 Ca 0.00 -0.04 0.00 0.00 -0.50 0.00 0.00 59.36 58.82 1tvn h GLU 36 Cb 0.44 -0.16 0.00 0.00 -0.84 0.00 0.00 28.75 28.18 1tvn h GLU 36 CO 0.00 0.48 0.05 1.57 -1.40 0.00 0.00 179.01 179.70 1tvn h LYS 37 N 0.75 0.00 0.00 2.33 2.10 -1.96 -1.47 116.57 118.32 1tvn h LYS 37 Ca 0.36 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 59.01 1tvn h LYS 37 Cb 0.40 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 31.73 1tvn h LYS 37 CO -0.13 0.00 -0.55 1.19 -2.00 0.00 0.00 179.45 177.96 1tvn n PHE 38 N -2.84 0.39 -1.71 0.07 3.01 -0.30 -4.58 117.46 111.49 1tvn n PHE 38 Ca -0.02 0.11 -0.42 0.00 1.01 0.00 0.00 57.45 58.13 1tvn n PHE 38 Cb 0.10 -0.55 -0.00 0.00 -0.01 0.00 0.00 39.48 39.02 1tvn n PHE 38 CO 0.00 0.00 0.00 0.66 1.01 0.00 0.00 176.76 178.43 1tvn n TYR 39 N -1.92 3.50 -4.24 1.38 4.02 -0.55 -4.67 117.16 114.68 1tvn n TYR 39 Ca 0.04 -2.95 -0.14 0.00 -0.01 0.00 0.00 57.90 54.84 1tvn n TYR 39 Cb 0.41 -2.54 -0.10 0.00 -0.02 0.00 0.00 39.34 37.09 1tvn n TYR 39 CO 0.00 0.00 0.00 0.95 -1.01 0.00 0.00 176.86 176.80 1tvn s THR 40 N 3.24 1.12 0.30 -0.72 -4.23 -1.26 -4.65 115.64 109.43 1tvn s THR 40 Ca 0.47 -1.98 -0.01 0.00 -1.18 0.00 0.00 61.69 59.00 1tvn s THR 40 Cb 0.14 -1.76 0.18 0.00 1.34 0.00 0.00 72.50 72.41 1tvn s THR 40 CO -0.09 -0.71 1.87 0.00 -0.54 0.00 0.00 174.62 175.16 1tvn h ALA 41 N 2.93 1.30 -0.60 3.99 0.00 -1.90 -2.42 119.26 122.56 1tvn h ALA 41 Ca -0.37 -0.16 -0.06 0.00 0.00 0.00 0.00 54.91 54.32 1tvn h ALA 41 Cb 1.19 -0.23 -0.03 0.00 0.00 0.00 0.00 17.79 18.72 1tvn h ALA 41 CO 0.61 0.52 0.13 0.93 0.00 0.00 0.00 179.25 181.44 1tvn h GLU 42 N 0.83 0.94 -0.73 0.00 4.39 -1.96 -1.42 114.58 116.63 1tvn h GLU 42 Ca 0.20 -0.21 -0.05 0.00 0.34 0.00 0.00 59.36 59.63 1tvn h GLU 42 Cb 0.18 -0.13 -0.03 0.00 -0.10 0.00 0.00 28.75 28.67 1tvn h GLU 42 CO -0.02 0.85 0.26 1.15 -1.16 0.00 0.00 179.01 180.10 1tvn h THR 43 N 0.90 1.26 -0.34 1.13 2.02 -1.72 0.38 112.91 116.54 1tvn h THR 43 Ca 0.19 -0.84 -0.04 0.00 0.77 0.00 0.00 66.41 66.49 1tvn h THR 43 Cb 0.34 0.43 -0.01 0.00 -1.74 0.00 0.00 68.15 67.17 1tvn h THR 43 CO 0.00 0.33 0.06 0.58 0.37 0.00 0.00 175.52 176.86 1tvn h VAL 44 N 1.06 1.23 -0.62 3.16 2.07 -1.08 -0.37 116.25 121.70 1tvn h VAL 44 Ca 0.24 -0.82 0.02 0.00 0.82 0.00 0.00 66.70 66.96 1tvn h VAL 44 Cb 0.26 1.12 -0.03 0.00 -1.52 0.00 0.00 31.29 31.11 1tvn h VAL 44 CO -0.01 0.27 0.39 0.00 0.02 0.00 0.00 177.57 178.24 1tvn h ALA 45 N 0.90 0.79 -0.10 1.67 0.00 -0.96 -2.51 119.26 119.04 1tvn h ALA 45 Ca 0.10 -0.03 -0.11 0.00 0.00 0.00 0.00 54.91 54.87 1tvn h ALA 45 Cb 0.35 -0.22 -0.01 0.00 0.00 0.00 0.00 17.79 17.90 1tvn h ALA 45 CO 0.01 0.17 -0.43 0.87 0.00 0.00 0.00 179.25 179.86 1tvn h LYS 46 N 0.79 0.23 -0.79 0.00 1.79 -0.76 -1.41 116.57 116.42 1tvn h LYS 46 Ca 0.24 -0.12 0.00 0.00 -2.18 0.00 0.00 60.65 58.60 1tvn h LYS 46 Cb -0.04 0.00 -0.04 0.00 -1.58 0.00 0.00 32.23 30.57 1tvn h LYS 46 CO -0.07 0.63 0.51 0.00 -1.08 0.00 0.00 179.45 179.44 1tvn h ALA 47 N 1.36 1.41 -0.07 3.86 0.00 -0.63 0.26 119.26 125.45 1tvn h ALA 47 Ca 0.02 -0.07 -0.05 0.00 0.00 0.00 0.00 54.91 54.81 1tvn h ALA 47 Cb 0.85 -0.32 0.00 0.00 0.00 0.00 0.00 17.79 18.31 1tvn h ALA 47 CO 0.07 0.54 -0.16 -0.22 0.00 0.00 0.00 179.25 179.47 1tvn h LYS 48 N 1.08 0.24 0.02 0.00 3.64 -1.22 -2.10 116.57 118.22 1tvn h LYS 48 Ca 0.29 -0.16 -0.21 0.00 -1.27 0.00 0.00 60.65 59.30 1tvn h LYS 48 Cb -0.10 0.02 -0.01 0.00 -0.41 0.00 0.00 32.23 31.73 1tvn h LYS 48 CO -0.06 0.76 -0.94 1.79 -2.27 0.00 0.00 179.45 178.73 1tvn h THR 49 N -0.25 1.52 0.18 1.00 1.35 -1.08 -0.24 112.91 115.39 1tvn h THR 49 Ca -0.00 -2.77 -0.33 0.00 -0.55 0.00 0.00 66.41 62.76 1tvn h THR 49 Cb 0.76 2.57 0.01 0.00 -1.73 0.00 0.00 68.15 69.77 1tvn h THR 49 CO 0.04 0.80 -1.60 -0.33 -0.25 0.00 0.00 175.52 174.18 1tvn h GLU 50 N 0.09 0.39 -0.01 4.72 4.39 -0.60 -3.40 114.58 120.17 1tvn h GLU 50 Ca -0.05 -0.67 0.00 0.00 0.34 0.00 0.00 59.36 58.98 1tvn h GLU 50 Cb 1.60 0.25 0.00 0.00 -0.10 0.00 0.00 28.75 30.50 1tvn h GLU 50 CO 0.14 1.29 -0.10 1.19 -1.16 0.00 0.00 179.01 180.38 1tvn n PHE 51 N -3.58 0.00 -1.93 4.33 3.01 -0.89 -4.97 117.46 113.43 1tvn n PHE 51 Ca -0.20 0.00 -0.14 0.00 1.01 0.00 0.00 57.45 58.12 1tvn n PHE 51 Cb 1.07 0.00 -0.03 0.00 -0.01 0.00 0.00 39.48 40.51 1tvn n PHE 51 CO 0.00 0.00 0.00 0.09 1.01 0.00 0.00 176.76 177.86 1tvn n ASN 52 N -0.19 -4.52 -4.77 4.37 3.02 -0.10 -2.22 115.26 110.85 1tvn n ASN 52 Ca 0.03 0.13 -0.40 0.00 -0.03 0.00 0.00 54.58 54.31 1tvn n ASN 52 Cb 0.13 -3.52 -0.01 0.00 -0.61 0.00 0.00 39.78 35.78 1tvn n ASN 52 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1tvn s ALA 53 N -2.64 3.46 -1.47 5.41 0.00 -0.84 -4.32 121.76 121.35 1tvn s ALA 53 Ca 0.00 1.41 0.12 0.00 0.00 0.00 0.00 51.96 53.49 1tvn s ALA 53 Cb 0.00 -3.55 0.08 0.00 0.00 0.00 0.00 23.12 19.66 1tvn s ALA 53 CO 0.00 -0.91 0.86 0.25 0.00 0.00 0.00 175.76 175.96 1tvn n THR 54 N 0.43 0.00 -3.77 0.00 -2.24 -0.76 -4.38 114.28 103.56 1tvn n THR 54 Ca 0.02 -0.48 -0.10 0.00 -2.27 0.00 0.00 64.05 61.22 1tvn n THR 54 Cb 0.41 1.24 -0.04 0.00 -2.10 0.00 0.00 70.33 69.84 1tvn n THR 54 CO 0.00 0.00 0.00 -1.48 -0.57 0.00 0.00 175.07 173.02 1tvn s LEU 55 N -1.13 0.27 -0.11 3.22 0.05 -1.25 -1.34 118.68 118.39 1tvn s LEU 55 Ca 0.14 -0.53 -0.09 0.00 0.05 0.00 0.00 54.13 53.69 1tvn s LEU 55 Cb 0.10 1.94 0.03 0.00 -2.05 0.00 0.00 46.19 46.21 1tvn s LEU 55 CO 0.17 -1.00 0.29 -0.51 -0.55 0.00 0.00 176.35 174.76 1tvn s ILE 56 N -3.88 -0.01 -0.17 1.48 2.07 -0.67 -3.78 121.20 116.23 1tvn s ILE 56 Ca 0.10 0.03 -0.06 0.00 -1.41 0.00 0.00 60.65 59.31 1tvn s ILE 56 Cb 0.00 -0.42 -0.04 0.00 0.13 0.00 0.00 42.46 42.13 1tvn s ILE 56 CO -0.03 0.01 0.03 -0.60 -1.91 0.00 0.00 174.94 172.44 1tvn s ARG 57 N 0.41 3.89 -0.41 3.50 3.52 -0.71 -1.18 118.95 127.97 1tvn s ARG 57 Ca -0.02 -0.40 -0.13 0.00 -0.13 0.00 0.00 55.73 55.06 1tvn s ARG 57 Cb -0.04 -3.12 0.04 0.00 -1.56 0.00 0.00 34.95 30.27 1tvn s ARG 57 CO -0.02 0.27 0.27 0.00 -0.81 0.00 0.00 175.30 175.01 1tvn s ALA 58 N 0.36 3.39 -1.05 6.12 0.00 -0.09 -1.02 121.76 129.46 1tvn s ALA 58 Ca 0.01 -1.82 -0.16 0.00 0.00 0.00 0.00 51.96 49.98 1tvn s ALA 58 Cb -0.13 -2.77 0.15 0.00 0.00 0.00 0.00 23.12 20.37 1tvn s ALA 58 CO 0.01 -1.49 1.26 0.00 0.00 0.00 0.00 175.76 175.54 1tvn s ALA 59 N 1.59 3.68 -0.55 0.00 0.00 -1.26 -1.66 121.76 123.57 1tvn s ALA 59 Ca 0.03 -3.06 -0.28 0.00 0.00 0.00 0.00 51.96 48.66 1tvn s ALA 59 Cb -0.20 -4.07 0.03 0.00 0.00 0.00 0.00 23.12 18.88 1tvn s ALA 59 CO 0.07 -2.87 1.14 0.42 0.00 0.00 0.00 175.76 174.53 1tvn s ILE 60 N 2.09 4.12 0.29 0.00 -1.09 -0.26 -1.00 121.20 125.35 1tvn s ILE 60 Ca 0.37 0.90 -0.30 0.00 -2.23 0.00 0.00 60.65 59.39 1tvn s ILE 60 Cb -0.04 -4.67 -0.12 0.00 -1.58 0.00 0.00 42.46 36.05 1tvn s ILE 60 CO -0.05 -1.22 1.53 0.61 -1.23 0.00 0.00 174.94 174.58 1tvn n GLY 61 N 5.02 1.18 3.03 6.18 0.00 -1.26 -0.67 105.19 118.67 1tvn n GLY 61 Ca 0.08 0.45 -0.16 0.00 0.00 0.00 0.00 46.02 46.40 1tvn n GLY 61 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 173.32 171.74 1tvn s HIS 62 N -0.15 0.70 0.00 1.61 2.46 -0.87 -0.56 115.29 118.48 1tvn s HIS 62 Ca 0.64 -0.29 0.00 0.00 0.47 0.00 0.00 55.06 55.87 1tvn s HIS 62 Cb -0.53 -0.43 0.00 0.00 -0.13 0.00 0.00 32.58 31.49 1tvn s HIS 62 CO 0.50 -0.03 0.00 0.41 -2.47 0.00 0.00 174.74 173.15 1tvn n GLY 63 N 2.20 2.76 0.28 1.59 0.00 -1.26 -4.52 105.19 106.24 1tvn n GLY 63 Ca -0.18 0.18 0.13 0.00 0.00 0.00 0.00 46.02 46.16 1tvn n GLY 63 CO 0.00 0.00 0.00 -0.91 0.00 0.00 0.00 173.32 172.41 1tvn h THR 64 N 0.00 0.56 0.00 2.61 1.35 -1.97 -2.39 112.91 113.07 1tvn h THR 64 Ca 0.00 -0.34 -0.07 0.00 -0.55 0.00 0.00 66.41 65.44 1tvn h THR 64 Cb 0.00 1.22 -0.16 0.00 -1.73 0.00 0.00 68.15 67.48 1tvn h THR 64 CO 0.00 0.08 -0.70 -1.20 -0.25 0.00 0.00 175.52 173.45 1tvn n SER 65 N -3.72 1.38 -4.24 5.36 7.64 -1.26 -4.99 113.62 113.79 1tvn n SER 65 Ca -0.02 -3.00 -0.37 0.00 1.01 0.00 0.00 58.87 56.49 1tvn n SER 65 Cb 0.18 -0.42 -0.13 0.00 -1.01 0.00 0.00 64.21 62.84 1tvn n SER 65 CO 0.00 0.00 0.00 -0.89 -3.01 0.00 0.00 175.04 171.14 1tvn s THR 66 N -1.76 3.49 0.29 0.44 2.01 -0.90 -5.07 115.64 114.15 1tvn s THR 66 Ca 0.34 -1.20 -0.29 0.00 0.31 0.00 0.00 61.69 60.85 1tvn s THR 66 Cb 0.36 -2.98 -0.13 0.00 0.01 0.00 0.00 72.50 69.76 1tvn s THR 66 CO -0.10 -0.13 1.29 0.61 -0.69 0.00 0.00 174.62 175.59 1tvn n GLY 67 N 4.74 0.51 2.74 4.40 0.00 -1.26 -2.52 105.19 113.80 1tvn n GLY 67 Ca -0.13 0.40 0.00 0.00 0.00 0.00 0.00 46.02 46.29 1tvn n GLY 67 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1tvn n GLY 68 N 1.43 0.41 2.85 -0.02 0.00 -1.26 -4.73 105.19 103.87 1tvn n GLY 68 Ca 0.08 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 45.88 1tvn n GLY 68 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1tvn n SER 69 N -0.26 -0.21 0.18 1.61 3.41 -1.05 -1.48 113.62 115.82 1tvn n SER 69 Ca 0.00 -1.31 0.16 0.00 -0.26 0.00 0.00 58.87 57.47 1tvn n SER 69 Cb 0.13 -0.76 0.78 0.00 -0.26 0.00 0.00 64.21 64.10 1tvn n SER 69 CO 0.00 0.00 0.00 -0.07 -0.16 0.00 0.00 175.04 174.81 1tvn h LEU 70 N 0.00 0.00 -1.27 1.04 3.38 -1.06 0.45 115.31 117.85 1tvn h LEU 70 Ca -0.32 0.00 -0.03 0.00 0.09 0.00 0.00 57.88 57.62 1tvn h LEU 70 Cb 0.90 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.64 1tvn h LEU 70 CO 0.22 0.00 -0.13 0.78 0.09 0.00 0.00 178.44 179.40 1tvn h ASN 71 N 0.00 0.00 0.00 -0.43 2.35 -1.83 -3.12 115.58 112.56 1tvn h ASN 71 Ca 0.10 0.00 -0.18 0.00 -0.55 0.00 0.00 56.30 55.67 1tvn h ASN 71 Cb 0.51 0.00 -0.03 0.00 0.05 0.00 0.00 38.32 38.84 1tvn h ASN 71 CO -0.00 0.13 -1.70 0.49 -1.65 0.00 0.00 177.43 174.70 1tvn n PHE 72 N -3.29 0.00 -3.33 1.19 3.72 -0.21 -4.86 117.46 110.69 1tvn n PHE 72 Ca 0.00 0.00 -0.24 0.00 -0.05 0.00 0.00 57.45 57.16 1tvn n PHE 72 Cb 0.37 -0.50 -0.09 0.00 -0.94 0.00 0.00 39.48 38.32 1tvn n PHE 72 CO 0.00 0.00 0.00 0.34 -0.05 0.00 0.00 176.76 177.05 1tvn s ASP 73 N -4.24 1.21 0.05 4.37 2.15 -0.02 -4.97 116.67 115.23 1tvn s ASP 73 Ca -0.05 -2.77 -0.28 0.00 0.43 0.00 0.00 52.55 49.88 1tvn s ASP 73 Cb 0.03 -0.13 -0.17 0.00 -0.30 0.00 0.00 42.92 42.35 1tvn s ASP 73 CO 0.42 -0.17 1.53 -0.25 -0.17 0.00 0.00 175.17 176.53 1tvn h TRP 74 N 5.75 -0.44 -0.64 -5.34 2.91 -1.75 -2.78 115.95 113.66 1tvn h TRP 74 Ca 0.22 -0.01 0.04 0.00 1.13 0.00 0.00 58.89 60.26 1tvn h TRP 74 Cb 0.94 0.15 -0.04 0.00 -0.51 0.00 0.00 29.16 29.70 1tvn h TRP 74 CO 0.26 -0.21 0.38 0.93 -1.03 0.00 0.00 178.44 178.78 1tvn h GLU 75 N -0.60 0.72 -0.19 2.65 3.07 -1.95 -0.38 114.58 117.90 1tvn h GLU 75 Ca -0.05 -0.04 -0.01 0.00 -0.50 0.00 0.00 59.36 58.76 1tvn h GLU 75 Cb 0.44 -0.16 -0.01 0.00 -0.84 0.00 0.00 28.75 28.18 1tvn h GLU 75 CO 0.08 0.48 0.07 0.78 -1.40 0.00 0.00 179.01 179.02 1tvn h GLY 76 N 0.74 0.31 1.21 -3.84 0.00 -1.98 -0.52 103.07 98.99 1tvn h GLY 76 Ca 0.27 -0.18 -0.11 0.00 0.00 0.00 0.00 47.33 47.31 1tvn h GLY 76 CO -0.13 0.16 -0.16 3.43 0.00 0.00 0.00 176.54 179.85 1tvn h ASN 77 N 0.15 0.92 0.07 0.19 2.35 -1.35 -2.52 115.58 115.39 1tvn h ASN 77 Ca 0.06 -0.32 -0.11 0.00 -0.55 0.00 0.00 56.30 55.39 1tvn h ASN 77 Cb 0.20 -0.25 -0.01 0.00 0.05 0.00 0.00 38.32 38.30 1tvn h ASN 77 CO -0.00 1.07 -0.34 0.24 -1.65 0.00 0.00 177.43 176.74 1tvn h MET 78 N 0.81 0.39 -0.31 0.81 2.86 -0.97 -1.65 114.93 116.87 1tvn h MET 78 Ca 0.12 -0.17 -0.15 0.00 -2.06 0.00 0.00 59.70 57.44 1tvn h MET 78 Cb 0.70 -0.01 -0.01 0.00 0.06 0.00 0.00 31.60 32.34 1tvn h MET 78 CO 0.05 0.69 -0.41 0.77 1.06 0.00 0.00 176.91 179.07 1tvn h SER 79 N 0.33 0.81 -0.50 1.22 0.02 -0.94 -1.22 113.55 113.27 1tvn h SER 79 Ca 0.04 -0.37 -0.05 0.00 -0.84 0.00 0.00 61.79 60.57 1tvn h SER 79 Cb 0.77 -0.23 -0.02 0.00 0.14 0.00 0.00 62.40 63.06 1tvn h SER 79 CO 0.06 1.11 0.13 0.03 -1.14 0.00 0.00 176.83 177.02 1tvn h ARG 80 N 0.62 0.81 -0.25 3.45 3.08 -1.21 -1.20 114.38 119.68 1tvn h ARG 80 Ca 0.05 -0.19 0.01 0.00 0.07 0.00 0.00 59.98 59.91 1tvn h ARG 80 Cb 0.96 -0.11 -0.01 0.00 0.08 0.00 0.00 29.97 30.89 1tvn h ARG 80 CO 0.09 0.77 0.15 1.25 -1.07 0.00 0.00 179.97 181.17 1tvn h LEU 81 N 0.70 0.26 -0.64 3.04 5.85 -1.16 -2.59 115.31 120.77 1tvn h LEU 81 Ca 0.16 -0.00 0.09 0.00 0.84 0.00 0.00 57.88 58.96 1tvn h LEU 81 Cb 0.33 -0.06 -0.07 0.00 0.37 0.00 0.00 40.66 41.23 1tvn h LEU 81 CO 0.00 0.19 0.29 -0.78 -0.34 0.00 0.00 178.44 177.80 1tvn h ASP 82 N 0.32 0.35 -0.63 1.25 1.82 -0.90 0.61 116.42 119.23 1tvn h ASP 82 Ca 0.09 0.06 0.00 0.00 -0.39 0.00 0.00 57.03 56.80 1tvn h ASP 82 Cb -0.02 0.01 -0.03 0.00 0.68 0.00 0.00 39.33 39.97 1tvn h ASP 82 CO -0.03 0.21 0.41 0.74 -1.61 0.00 0.00 179.24 178.96 1tvn h THR 83 N 0.51 1.17 -0.29 2.25 2.02 -1.03 -1.82 112.91 115.72 1tvn h THR 83 Ca 0.32 -0.33 -0.13 0.00 0.77 0.00 0.00 66.41 67.04 1tvn h THR 83 Cb 0.34 0.26 -0.00 0.00 -1.74 0.00 0.00 68.15 67.00 1tvn h THR 83 CO -0.27 0.17 -0.32 0.58 0.37 0.00 0.00 175.52 176.05 1tvn h VAL 84 N 0.86 1.30 -0.24 3.16 2.07 -0.98 -2.57 116.25 119.84 1tvn h VAL 84 Ca 0.23 -1.50 -0.01 0.00 0.82 0.00 0.00 66.70 66.25 1tvn h VAL 84 Cb -0.08 1.59 -0.01 0.00 -1.52 0.00 0.00 31.29 31.27 1tvn h VAL 84 CO -0.05 0.48 0.12 0.58 0.02 0.00 0.00 177.57 178.72 1tvn h VAL 85 N 0.48 1.13 -0.67 2.57 2.07 -0.79 -0.45 116.25 120.58 1tvn h VAL 85 Ca 0.04 -0.38 -0.05 0.00 0.82 0.00 0.00 66.70 67.13 1tvn h VAL 85 Cb 0.90 0.95 -0.03 0.00 -1.52 0.00 0.00 31.29 31.59 1tvn h VAL 85 CO 0.08 0.13 0.22 0.78 0.02 0.00 0.00 177.57 178.80 1tvn h ASN 86 N 0.26 0.95 -0.43 0.57 2.35 -1.36 -1.89 115.58 116.04 1tvn h ASN 86 Ca 0.08 -0.16 -0.11 0.00 -0.55 0.00 0.00 56.30 55.56 1tvn h ASN 86 Cb 0.10 -0.25 -0.02 0.00 0.05 0.00 0.00 38.32 38.21 1tvn h ASN 86 CO -0.01 0.88 -0.14 0.00 -1.65 0.00 0.00 177.43 176.51 1tvn h ALA 87 N 1.24 0.85 -0.69 -0.83 0.00 -1.27 -0.85 119.26 117.71 1tvn h ALA 87 Ca 0.22 -0.35 -0.01 0.00 0.00 0.00 0.00 54.91 54.77 1tvn h ALA 87 Cb 0.27 -0.18 -0.03 0.00 0.00 0.00 0.00 17.79 17.85 1tvn h ALA 87 CO -0.01 0.65 0.39 0.00 0.00 0.00 0.00 179.25 180.28 1tvn h ALA 88 N 1.03 0.88 -0.50 0.00 0.00 -0.60 -0.08 119.26 120.00 1tvn h ALA 88 Ca 0.12 -0.10 -0.03 0.00 0.00 0.00 0.00 54.91 54.90 1tvn h ALA 88 Cb 0.67 -0.28 -0.02 0.00 0.00 0.00 0.00 17.79 18.16 1tvn h ALA 88 CO 0.05 0.38 0.19 0.82 0.00 0.00 0.00 179.25 180.69 1tvn h ILE 89 N 0.95 1.22 0.00 0.00 2.04 -0.91 -0.02 117.51 120.77 1tvn h ILE 89 Ca 0.25 -0.68 -0.02 0.00 1.00 0.00 0.00 64.86 65.40 1tvn h ILE 89 Cb 0.01 0.73 -0.00 0.00 -0.74 0.00 0.00 36.82 36.82 1tvn h ILE 89 CO -0.04 0.26 -0.11 0.00 0.00 0.00 0.00 178.15 178.25 1tvn h ALA 90 N 1.04 1.62 -0.57 1.87 0.00 -0.61 -2.47 119.26 120.14 1tvn h ALA 90 Ca 0.16 -0.10 0.00 0.00 0.00 0.00 0.00 54.91 54.97 1tvn h ALA 90 Cb 0.21 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 17.99 1tvn h ALA 90 CO -0.01 0.14 0.00 0.39 0.00 0.00 0.00 179.25 179.77 1tvn n GLU 91 N -4.13 2.57 -3.58 0.00 -0.58 -0.09 -4.97 120.64 109.86 1tvn n GLU 91 Ca -0.02 -2.41 -0.20 0.00 -0.42 0.00 0.00 57.16 54.10 1tvn n GLU 91 Cb 0.19 -1.53 0.07 0.00 -0.57 0.00 0.00 31.44 29.59 1tvn n GLU 91 CO 0.00 0.00 0.00 -0.25 -0.48 0.00 0.00 177.13 176.40 1tvn n ASP 92 N 1.52 -2.49 -4.33 1.62 8.00 -0.69 -5.01 116.55 115.16 1tvn n ASP 92 Ca 0.22 -0.69 -0.24 0.00 0.71 0.00 0.00 54.79 54.79 1tvn n ASP 92 Cb 0.60 -4.67 -0.12 0.00 -0.02 0.00 0.00 41.12 36.90 1tvn n ASP 92 CO 0.00 0.00 0.00 -0.04 -0.39 0.00 0.00 177.20 176.77 1tvn s MET 93 N -5.78 1.26 0.47 -1.24 -1.94 -0.11 -4.84 119.30 107.12 1tvn s MET 93 Ca 0.12 -1.31 -0.19 0.00 -1.71 0.00 0.00 55.69 52.60 1tvn s MET 93 Cb -0.06 -1.50 -0.09 0.00 2.01 0.00 0.00 34.83 35.19 1tvn s MET 93 CO 0.76 0.33 0.98 0.71 -0.01 0.00 0.00 175.02 177.80 1tvn s TYR 94 N -1.49 3.29 -0.10 -0.03 2.02 -0.45 -4.33 117.35 116.25 1tvn s TYR 94 Ca 0.12 1.56 -0.00 0.00 -0.37 0.00 0.00 57.07 58.38 1tvn s TYR 94 Cb -0.08 -2.87 0.02 0.00 -0.40 0.00 0.00 41.96 38.63 1tvn s TYR 94 CO 0.06 -0.34 -0.07 0.54 -1.57 0.00 0.00 175.55 174.17 1tvn s VAL 95 N -2.30 0.92 -0.40 0.71 0.11 0.04 -1.68 120.40 117.81 1tvn s VAL 95 Ca 0.62 -0.24 -0.21 0.00 -2.93 0.00 0.00 61.98 59.22 1tvn s VAL 95 Cb -0.11 -0.95 0.01 0.00 -1.53 0.00 0.00 36.38 33.81 1tvn s VAL 95 CO 0.21 0.34 0.65 -0.63 -3.33 0.00 0.00 175.10 172.34 1tvn s ILE 96 N 1.58 4.85 -0.59 7.04 1.01 -0.33 -1.15 121.20 133.60 1tvn s ILE 96 Ca 0.02 0.36 -0.21 0.00 0.00 0.00 0.00 60.65 60.82 1tvn s ILE 96 Cb -0.13 -4.15 0.07 0.00 0.01 0.00 0.00 42.46 38.26 1tvn s ILE 96 CO -0.06 -0.47 0.82 -0.63 0.00 0.00 0.00 174.94 174.61 1tvn s ILE 97 N 2.80 4.58 -0.32 2.92 1.01 0.27 -0.91 121.20 131.54 1tvn s ILE 97 Ca 0.24 -0.47 -0.12 0.00 0.00 0.00 0.00 60.65 60.30 1tvn s ILE 97 Cb -0.14 -4.53 -0.03 0.00 0.01 0.00 0.00 42.46 37.77 1tvn s ILE 97 CO 0.17 -1.19 0.23 -0.62 0.00 0.00 0.00 174.94 173.54 1tvn s ASP 98 N 3.35 6.06 -0.89 3.58 2.15 -0.67 -0.90 116.67 129.35 1tvn s ASP 98 Ca 0.19 -0.28 -0.23 0.00 0.43 0.00 0.00 52.55 52.66 1tvn s ASP 98 Cb -0.19 -2.14 0.06 0.00 -0.30 0.00 0.00 42.92 40.36 1tvn s ASP 98 CO 0.11 -0.18 1.29 0.12 -0.17 0.00 0.00 175.17 176.34 1tvn s PHE 99 N 1.75 2.58 -1.15 -5.34 2.19 -0.37 -1.11 117.98 116.55 1tvn s PHE 99 Ca 0.07 -0.70 -0.21 0.00 0.33 0.00 0.00 56.93 56.42 1tvn s PHE 99 Cb -0.17 -4.56 0.02 0.00 -1.31 0.00 0.00 43.02 37.00 1tvn s PHE 99 CO 0.11 -1.87 1.71 -1.58 1.83 0.00 0.00 175.22 175.42 1tvn s HIS 100 N 4.68 2.45 0.10 10.12 2.46 0.16 -2.20 115.29 133.05 1tvn s HIS 100 Ca 0.38 -0.76 0.03 0.00 0.47 0.00 0.00 55.06 55.18 1tvn s HIS 100 Cb -0.05 -4.53 -0.04 0.00 -0.13 0.00 0.00 32.58 27.84 1tvn s HIS 100 CO -0.01 -1.74 -0.09 0.45 -2.47 0.00 0.00 174.74 170.88 1tvn s SER 101 N 5.30 1.39 -0.02 9.88 0.15 -1.26 -2.05 113.70 127.09 1tvn s SER 101 Ca 0.56 -0.88 0.03 0.00 0.70 0.00 0.00 55.95 56.36 1tvn s SER 101 Cb 0.01 0.03 0.05 0.00 -1.71 0.00 0.00 66.02 64.40 1tvn s SER 101 CO 0.02 -0.32 1.03 1.41 1.20 0.00 0.00 173.24 176.58 1tvn n HIS 102 N 0.34 0.03 -2.45 3.44 8.25 -1.26 -1.59 115.22 121.98 1tvn n HIS 102 Ca -0.14 -0.56 -0.02 0.00 -0.26 0.00 0.00 57.72 56.73 1tvn n HIS 102 Cb 0.59 -0.06 0.03 0.00 1.12 0.00 0.00 29.99 31.67 1tvn n HIS 102 CO 0.00 0.00 0.00 -0.85 0.64 0.00 0.00 176.34 176.13 1tvn n GLU 103 N -0.56 0.76 -0.24 -0.41 0.28 -1.26 -4.52 120.64 114.69 1tvn n GLU 103 Ca 0.03 -1.62 -0.03 0.00 -0.16 0.00 0.00 57.16 55.37 1tvn n GLU 103 Cb 0.31 0.07 0.14 0.00 1.43 0.00 0.00 31.44 33.38 1tvn n GLU 103 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 177.13 176.97 1tvn h ALA 104 N 0.92 1.19 0.00 -1.84 0.00 -1.92 -2.18 119.26 115.42 1tvn h ALA 104 Ca -0.41 -0.16 -0.01 0.00 0.00 0.00 0.00 54.91 54.33 1tvn h ALA 104 Cb 1.42 -0.29 -0.00 0.00 0.00 0.00 0.00 17.79 18.92 1tvn h ALA 104 CO -0.12 0.60 -0.06 1.12 0.00 0.00 0.00 179.25 180.79 1tvn h HIS 105 N 1.05 0.00 -0.24 0.00 2.07 -1.92 -2.29 115.15 113.82 1tvn h HIS 105 Ca 0.25 0.00 0.00 0.00 -2.85 0.00 0.00 60.37 57.77 1tvn h HIS 105 Cb 0.15 0.00 0.00 0.00 2.57 0.00 0.00 27.41 30.13 1tvn h HIS 105 CO 0.01 0.06 0.00 0.25 -3.07 0.00 0.00 177.93 175.18 1tvn n THR 106 N -3.52 0.29 -3.06 6.12 -2.24 -0.83 -4.29 114.28 106.76 1tvn n THR 106 Ca -0.02 -0.55 -0.16 0.00 -2.27 0.00 0.00 64.05 61.06 1tvn n THR 106 Cb 0.18 0.83 -0.01 0.00 -2.10 0.00 0.00 70.33 69.23 1tvn n THR 106 CO 0.00 0.00 0.00 -0.67 -0.57 0.00 0.00 175.07 173.83 1tvn n ASP 107 N 1.01 0.56 0.09 3.42 4.64 -0.87 -4.98 116.55 120.42 1tvn n ASP 107 Ca 0.17 -3.03 0.03 0.00 -1.38 0.00 0.00 54.79 50.59 1tvn n ASP 107 Cb 0.50 -0.33 0.43 0.00 -1.04 0.00 0.00 41.12 40.68 1tvn n ASP 107 CO 0.00 0.00 0.00 1.56 -0.82 0.00 0.00 177.20 177.94 1tvn h GLN 108 N 2.98 0.34 -0.88 -0.67 4.20 -1.73 -2.59 115.11 116.76 1tvn h GLN 108 Ca 0.05 -0.05 -0.02 0.00 0.06 0.00 0.00 58.65 58.69 1tvn h GLN 108 Cb 1.02 -0.06 -0.04 0.00 0.30 0.00 0.00 27.48 28.69 1tvn h GLN 108 CO 0.45 0.33 0.48 0.00 -0.67 0.00 0.00 178.83 179.43 1tvn h ALA 109 N 1.72 1.13 -0.38 3.87 0.00 -1.93 0.44 119.26 124.09 1tvn h ALA 109 Ca 0.08 -0.13 -0.11 0.00 0.00 0.00 0.00 54.91 54.75 1tvn h ALA 109 Cb 0.16 -0.35 -0.01 0.00 0.00 0.00 0.00 17.79 17.59 1tvn h ALA 109 CO -0.00 0.64 -0.18 1.15 0.00 0.00 0.00 179.25 180.86 1tvn h THR 110 N 1.23 1.28 -0.55 0.00 2.02 -1.87 -1.29 112.91 113.73 1tvn h THR 110 Ca 0.31 -1.30 0.00 0.00 0.77 0.00 0.00 66.41 66.19 1tvn h THR 110 Cb 0.03 1.31 -0.03 0.00 -1.74 0.00 0.00 68.15 67.72 1tvn h THR 110 CO -0.05 0.43 0.35 0.00 0.37 0.00 0.00 175.52 176.62 1tvn h ALA 111 N 0.81 0.70 -0.49 6.16 0.00 -1.24 -0.10 119.26 125.09 1tvn h ALA 111 Ca 0.09 -0.05 -0.05 0.00 0.00 0.00 0.00 54.91 54.89 1tvn h ALA 111 Cb 0.73 -0.22 -0.02 0.00 0.00 0.00 0.00 17.79 18.27 1tvn h ALA 111 CO 0.05 0.16 0.11 0.28 0.00 0.00 0.00 179.25 179.86 1tvn h VAL 112 N 0.74 1.24 -0.30 0.00 2.07 -0.83 -0.44 116.25 118.73 1tvn h VAL 112 Ca 0.20 -0.86 0.00 0.00 0.82 0.00 0.00 66.70 66.86 1tvn h VAL 112 Cb -0.05 0.85 -0.01 0.00 -1.52 0.00 0.00 31.29 30.56 1tvn h VAL 112 CO -0.04 0.31 0.19 -0.09 0.02 0.00 0.00 177.57 177.96 1tvn h ARG 113 N 0.68 0.40 0.12 1.57 2.43 -0.93 -0.60 114.38 118.06 1tvn h ARG 113 Ca 0.15 -0.03 -0.00 0.00 -0.81 0.00 0.00 59.98 59.29 1tvn h ARG 113 Cb 0.34 -0.09 -0.00 0.00 -0.42 0.00 0.00 29.97 29.80 1tvn h ARG 113 CO 0.00 0.29 -0.08 0.35 -1.51 0.00 0.00 179.97 179.03 1tvn h PHE 114 N 0.39 -0.20 -0.09 2.20 3.57 -0.85 -1.93 116.94 120.03 1tvn h PHE 114 Ca 0.11 -0.00 -0.09 0.00 3.53 0.00 0.00 57.97 61.52 1tvn h PHE 114 Cb -0.01 0.07 -0.01 0.00 2.79 0.00 0.00 35.95 38.79 1tvn h PHE 114 CO -0.05 -0.12 -0.35 0.74 -2.23 0.00 0.00 178.31 176.29 1tvn h PHE 115 N -0.20 0.20 -0.14 0.41 0.04 -0.92 -1.00 116.94 115.32 1tvn h PHE 115 Ca -0.01 -0.05 -0.17 0.00 2.80 0.00 0.00 57.97 60.54 1tvn h PHE 115 Cb 0.17 -0.05 -0.00 0.00 2.20 0.00 0.00 35.95 38.27 1tvn h PHE 115 CO -0.09 0.51 -0.63 0.93 -0.60 0.00 0.00 178.31 178.44 1tvn h GLU 116 N 0.15 0.51 -0.25 1.51 5.08 -1.06 -0.25 114.58 120.27 1tvn h GLU 116 Ca 0.02 -0.36 -0.05 0.00 -1.00 0.00 0.00 59.36 57.97 1tvn h GLU 116 Cb 0.70 0.06 -0.01 0.00 0.50 0.00 0.00 28.75 30.00 1tvn h GLU 116 CO 0.05 0.97 -0.05 0.22 -1.00 0.00 0.00 179.01 179.21 1tvn h ASP 117 N 0.37 0.47 -0.07 1.42 -0.00 -0.99 -1.48 116.42 116.15 1tvn h ASP 117 Ca -0.01 -0.35 -0.15 0.00 -0.00 0.00 0.00 57.03 56.52 1tvn h ASP 117 Cb 1.19 -0.13 -0.01 0.00 -0.00 0.00 0.00 39.33 40.38 1tvn h ASP 117 CO 0.11 0.71 -0.46 -0.37 -0.00 0.00 0.00 179.24 179.24 1tvn h VAL 118 N 0.22 1.30 -0.55 2.25 -1.51 -1.11 -1.43 116.25 115.43 1tvn h VAL 118 Ca 0.07 -1.66 -0.08 0.00 -1.23 0.00 0.00 66.70 63.79 1tvn h VAL 118 Cb 0.50 1.62 -0.02 0.00 -2.13 0.00 0.00 31.29 31.26 1tvn h VAL 118 CO 0.02 0.53 0.02 0.00 -1.23 0.00 0.00 177.57 176.90 1tvn h ALA 119 N 0.99 0.99 -0.27 5.19 0.00 -0.99 0.19 119.26 125.36 1tvn h ALA 119 Ca 0.03 -0.28 -0.07 0.00 0.00 0.00 0.00 54.91 54.59 1tvn h ALA 119 Cb 1.00 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 18.57 1tvn h ALA 119 CO 0.09 0.62 -0.10 1.15 0.00 0.00 0.00 179.25 181.01 1tvn h THR 120 N 0.86 1.29 0.02 0.00 2.02 -1.08 0.38 112.91 116.40 1tvn h THR 120 Ca 0.16 -1.16 -0.22 0.00 0.77 0.00 0.00 66.41 65.97 1tvn h THR 120 Cb 0.49 1.48 -0.01 0.00 -1.74 0.00 0.00 68.15 68.37 1tvn h THR 120 CO 0.02 0.36 -0.94 0.11 0.37 0.00 0.00 175.52 175.44 1tvn h LYS 121 N 0.29 0.27 0.00 6.66 1.57 -1.09 -3.40 116.57 120.87 1tvn h LYS 121 Ca 0.06 -0.31 0.00 0.00 -1.87 0.00 0.00 60.65 58.53 1tvn h LYS 121 Cb 0.60 0.09 0.00 0.00 0.08 0.00 0.00 32.23 33.00 1tvn h LYS 121 CO 0.03 1.04 0.00 0.66 -0.57 0.00 0.00 179.45 180.61 1tvn n TYR 122 N -3.66 0.00 0.18 -1.35 4.01 0.65 -4.80 117.16 112.19 1tvn n TYR 122 Ca -0.05 0.00 0.18 0.00 -0.16 0.00 0.00 57.90 57.87 1tvn n TYR 122 Cb 0.84 0.00 0.79 0.00 -0.31 0.00 0.00 39.34 40.67 1tvn n TYR 122 CO 0.00 0.00 0.00 0.78 -0.46 0.00 0.00 176.86 177.18 1tvn h GLY 123 N 0.00 0.00 2.00 2.72 0.00 -0.93 -1.70 103.07 105.16 1tvn h GLY 123 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 1tvn h GLY 123 CO 0.00 0.00 0.00 0.06 0.00 0.00 0.00 176.54 176.60 1tvn h GLN 124 N 0.00 0.00 -5.73 4.80 3.07 -1.87 -3.44 115.11 111.94 1tvn h GLN 124 Ca 0.12 0.00 -0.58 0.00 0.09 0.00 0.00 58.65 58.28 1tvn h GLN 124 Cb 0.83 0.00 -0.08 0.00 0.08 0.00 0.00 27.48 28.31 1tvn h GLN 124 CO -0.00 0.00 -0.13 0.71 0.09 0.00 0.00 178.83 179.50 1tvn s TYR 125 N -3.50 3.51 -0.90 0.06 2.02 -0.64 -4.94 117.35 112.95 1tvn s TYR 125 Ca 0.02 0.89 0.16 0.00 -0.37 0.00 0.00 57.07 57.77 1tvn s TYR 125 Cb 0.09 -2.56 0.70 0.00 -0.40 0.00 0.00 41.96 39.79 1tvn s TYR 125 CO 0.43 0.16 1.52 -0.25 -1.57 0.00 0.00 175.55 175.84 1tvn n ASP 126 N 3.71 0.13 0.24 2.29 10.43 -1.26 -2.19 116.55 129.91 1tvn n ASP 126 Ca -0.07 0.53 0.13 0.00 2.57 0.00 0.00 54.79 57.95 1tvn n ASP 126 Cb 0.52 -0.56 0.53 0.00 1.84 0.00 0.00 41.12 43.45 1tvn n ASP 126 CO 0.00 0.00 0.00 0.78 -1.07 0.00 0.00 177.20 176.91 1tvn h ASN 127 N 0.00 0.00 -3.20 -2.24 4.21 -1.90 -3.44 115.58 109.02 1tvn h ASN 127 Ca 0.00 0.00 -0.56 0.00 1.21 0.00 0.00 56.30 56.95 1tvn h ASN 127 Cb 0.28 0.00 -0.03 0.00 -1.12 0.00 0.00 38.32 37.44 1tvn h ASN 127 CO 0.00 0.12 0.62 -0.69 -1.29 0.00 0.00 177.43 176.19 1tvn s VAL 128 N -3.63 4.61 -0.11 2.81 1.01 -0.93 -0.78 120.40 123.37 1tvn s VAL 128 Ca 0.01 1.89 0.03 0.00 0.00 0.00 0.00 61.98 63.92 1tvn s VAL 128 Cb 0.09 -4.22 0.00 0.00 0.00 0.00 0.00 36.38 32.26 1tvn s VAL 128 CO 0.60 -0.00 -0.23 -0.63 0.00 0.00 0.00 175.10 174.84 1tvn s ILE 129 N 2.11 2.00 -0.18 2.22 1.01 -0.30 -4.47 121.20 123.59 1tvn s ILE 129 Ca 0.51 -0.97 -0.13 0.00 0.00 0.00 0.00 60.65 60.06 1tvn s ILE 129 Cb -0.20 -1.75 -0.05 0.00 0.01 0.00 0.00 42.46 40.47 1tvn s ILE 129 CO 0.19 0.54 0.25 -0.31 0.00 0.00 0.00 174.94 175.62 1tvn s TYR 130 N 0.53 3.44 -0.32 3.97 2.02 -0.80 -0.56 117.35 125.63 1tvn s TYR 130 Ca -0.15 0.52 0.04 0.00 -0.37 0.00 0.00 57.07 57.11 1tvn s TYR 130 Cb -0.17 -2.31 0.09 0.00 -0.40 0.00 0.00 41.96 39.17 1tvn s TYR 130 CO 0.05 0.23 0.01 -2.00 -1.57 0.00 0.00 175.55 172.27 1tvn s GLU 131 N 0.51 1.67 0.06 -0.62 2.12 -0.08 -0.35 118.70 122.01 1tvn s GLU 131 Ca 0.14 -1.71 0.27 0.00 0.36 0.00 0.00 54.97 54.03 1tvn s GLU 131 Cb -0.13 -3.10 1.09 0.00 0.26 0.00 0.00 34.13 32.26 1tvn s GLU 131 CO 0.03 -0.84 1.86 0.44 -0.54 0.00 0.00 175.26 176.21 1tvn n ILE 132 N 4.31 0.22 -3.09 -3.70 -5.35 -1.04 -1.23 119.36 109.49 1tvn n ILE 132 Ca -0.01 -0.05 0.02 0.00 -0.27 0.00 0.00 62.75 62.43 1tvn n ILE 132 Cb 0.42 -0.56 -0.00 0.00 -1.74 0.00 0.00 39.64 37.75 1tvn n ILE 132 CO 0.00 0.00 0.00 -0.47 -1.76 0.00 0.00 176.55 174.32 1tvn s TYR 133 N -3.03 -1.34 0.00 4.28 6.14 -1.26 -4.73 117.35 117.41 1tvn s TYR 133 Ca 0.13 0.26 0.00 0.00 0.64 0.00 0.00 57.07 58.10 1tvn s TYR 133 Cb 0.17 0.24 0.00 0.00 0.42 0.00 0.00 41.96 42.79 1tvn s TYR 133 CO 0.53 -0.90 0.92 -1.71 0.64 0.00 0.00 175.55 175.03 1tvn n ASN 134 N 4.31 0.00 -3.48 4.32 5.15 -0.94 -3.23 115.26 121.40 1tvn n ASN 134 Ca 0.09 0.92 -0.28 0.00 -0.60 0.00 0.00 54.58 54.72 1tvn n ASN 134 Cb 0.59 -0.44 -0.13 0.00 -0.53 0.00 0.00 39.78 39.27 1tvn n ASN 134 CO 0.00 0.00 0.00 -1.61 1.40 0.00 0.00 177.26 177.05 1tvn s GLU 135 N -2.80 0.42 0.72 1.20 2.02 -0.62 -4.69 118.70 114.95 1tvn s GLU 135 Ca 0.00 -0.98 -0.15 0.00 0.02 0.00 0.00 54.97 53.86 1tvn s GLU 135 Cb 0.00 -1.18 0.03 0.00 0.10 0.00 0.00 34.13 33.08 1tvn s GLU 135 CO 0.00 -1.14 1.22 -2.14 0.02 0.00 0.00 175.26 173.22 1tvn s PRO 136 N 1.49 2.19 0.00 0.39 0.02 -1.26 -4.24 135.00 133.59 1tvn s PRO 136 Ca 0.15 1.79 0.00 0.00 0.02 0.00 0.00 61.00 62.96 1tvn s PRO 136 Cb -0.20 -1.83 0.00 0.00 0.02 0.00 0.00 34.50 32.49 1tvn s PRO 136 CO -0.13 -1.81 0.00 1.28 -0.33 0.00 0.00 177.00 176.01 1tvn n LEU 137 N -2.62 0.00 -3.54 -5.54 4.77 -1.26 -0.80 117.00 108.00 1tvn n LEU 137 Ca 0.14 0.00 -0.41 0.00 -0.03 0.00 0.00 56.01 55.71 1tvn n LEU 137 Cb 0.50 0.00 -0.01 0.00 -2.33 0.00 0.00 43.42 41.58 1tvn n LEU 137 CO 0.47 0.00 2.88 0.00 -1.33 0.00 0.00 177.39 179.41 1tvn n GLN 138 N 0.00 3.50 -4.58 3.23 1.13 -1.26 -0.63 117.38 118.77 1tvn n GLN 138 Ca 0.00 -2.64 -0.27 0.00 -1.94 0.00 0.00 57.00 52.16 1tvn n GLN 138 Cb 0.00 -2.97 -0.10 0.00 0.11 0.00 0.00 30.24 27.28 1tvn n GLN 138 CO 0.00 0.00 0.00 0.96 -1.44 0.00 0.00 177.06 176.58 1tvn s ILE 139 N 1.94 1.54 -0.04 5.09 -4.36 -1.26 -5.04 121.20 119.07 1tvn s ILE 139 Ca 0.57 -2.00 -0.22 0.00 -0.26 0.00 0.00 60.65 58.74 1tvn s ILE 139 Cb 0.16 -2.78 -0.04 0.00 1.25 0.00 0.00 42.46 41.05 1tvn s ILE 139 CO -0.07 0.00 0.63 -0.55 0.24 0.00 0.00 174.94 175.20 1tvn s SER 140 N -3.66 6.95 0.04 4.36 0.15 -1.26 -4.76 113.70 115.52 1tvn s SER 140 Ca 0.31 1.14 -0.26 0.00 0.70 0.00 0.00 55.95 57.84 1tvn s SER 140 Cb 0.08 -2.38 -0.17 0.00 -1.71 0.00 0.00 66.02 61.84 1tvn s SER 140 CO 0.15 -0.01 1.45 -0.25 1.20 0.00 0.00 173.24 175.78 1tvn h TRP 141 N 6.26 -0.31 -0.46 3.44 2.91 -1.96 -0.11 115.95 125.71 1tvn h TRP 141 Ca -0.43 -0.01 -0.06 0.00 1.13 0.00 0.00 58.89 59.52 1tvn h TRP 141 Cb 1.20 0.10 -0.02 0.00 -0.51 0.00 0.00 29.16 29.93 1tvn h TRP 141 CO 0.65 -0.05 0.03 0.28 -1.03 0.00 0.00 178.44 178.33 1tvn h VAL 142 N -0.54 1.26 0.00 2.65 2.07 -1.93 0.13 116.25 119.88 1tvn h VAL 142 Ca -0.03 -0.99 -0.15 0.00 0.82 0.00 0.00 66.70 66.35 1tvn h VAL 142 Cb 0.40 1.00 -0.02 0.00 -1.52 0.00 0.00 31.29 31.14 1tvn h VAL 142 CO 0.06 0.34 -1.28 0.78 0.02 0.00 0.00 177.57 177.49 1tvn h ASN 143 N 0.64 0.00 0.00 0.57 2.35 -1.98 -3.40 115.58 113.76 1tvn h ASN 143 Ca 0.13 0.00 -0.03 0.00 -0.55 0.00 0.00 56.30 55.85 1tvn h ASN 143 Cb 0.45 0.00 -0.00 0.00 0.05 0.00 0.00 38.32 38.81 1tvn h ASN 143 CO 0.02 0.52 -0.72 0.47 -1.65 0.00 0.00 177.43 176.06 1tvn n ASP 144 N -2.91 0.67 -0.03 5.81 10.43 -0.20 -4.71 116.55 125.61 1tvn n ASP 144 Ca -0.08 0.09 -0.14 0.00 2.57 0.00 0.00 54.79 57.24 1tvn n ASP 144 Cb 0.80 -0.23 -0.09 0.00 1.84 0.00 0.00 41.12 43.44 1tvn n ASP 144 CO 0.00 0.00 0.00 0.40 -1.07 0.00 0.00 177.20 176.53 1tvn h ILE 145 N -0.12 1.43 -0.29 0.53 2.04 -1.07 -3.15 117.51 116.87 1tvn h ILE 145 Ca -0.05 -1.42 0.04 0.00 1.00 0.00 0.00 64.86 64.43 1tvn h ILE 145 Cb 0.66 2.25 -0.04 0.00 -0.74 0.00 0.00 36.82 38.95 1tvn h ILE 145 CO -0.03 0.39 0.05 0.50 0.00 0.00 0.00 178.15 179.06 1tvn h LYS 146 N -0.36 0.15 -0.73 2.37 3.64 -0.96 0.10 116.57 120.77 1tvn h LYS 146 Ca 0.00 -0.01 -0.01 0.00 -1.27 0.00 0.00 60.65 59.36 1tvn h LYS 146 Cb 0.68 -0.03 -0.04 0.00 -0.41 0.00 0.00 32.23 32.43 1tvn h LYS 146 CO 0.02 0.10 0.41 -1.35 -2.27 0.00 0.00 179.45 176.36 1tvn h PRO 147 N 0.15 1.01 -0.35 1.90 0.11 -1.77 -0.65 132.00 132.41 1tvn h PRO 147 Ca 0.14 -0.11 -0.03 0.00 0.11 0.00 0.00 66.00 66.11 1tvn h PRO 147 Cb 0.15 -0.20 -0.01 0.00 0.11 0.00 0.00 31.00 31.04 1tvn h PRO 147 CO -0.19 0.73 0.11 -0.92 -0.21 0.00 0.00 178.00 177.53 1tvn h TYR 148 N 1.02 0.56 -0.47 0.65 3.20 -1.40 -2.26 116.97 118.27 1tvn h TYR 148 Ca 0.26 -0.06 -0.00 0.00 3.14 0.00 0.00 58.73 62.07 1tvn h TYR 148 Cb 0.01 -0.16 -0.02 0.00 1.54 0.00 0.00 36.73 38.10 1tvn h TYR 148 CO 0.01 0.55 0.29 0.00 -1.64 0.00 0.00 178.16 177.36 1tvn h ALA 149 N 0.95 0.60 -0.76 1.82 0.00 -0.36 -0.89 119.26 120.62 1tvn h ALA 149 Ca 0.11 -0.05 -0.01 0.00 0.00 0.00 0.00 54.91 54.96 1tvn h ALA 149 Cb 0.25 -0.19 -0.04 0.00 0.00 0.00 0.00 17.79 17.82 1tvn h ALA 149 CO -0.00 0.07 0.43 0.93 0.00 0.00 0.00 179.25 180.68 1tvn h GLU 150 N 0.63 1.05 -0.03 0.00 5.08 -1.03 0.22 114.58 120.49 1tvn h GLU 150 Ca 0.17 -0.11 -0.00 0.00 -1.00 0.00 0.00 59.36 58.41 1tvn h GLU 150 Cb -0.03 -0.21 -0.00 0.00 0.50 0.00 0.00 28.75 29.01 1tvn h GLU 150 CO -0.03 0.77 0.02 1.15 -1.00 0.00 0.00 179.01 179.92 1tvn h THR 151 N 1.05 1.05 -0.46 1.13 2.02 -0.90 -1.37 112.91 115.42 1tvn h THR 151 Ca 0.27 -0.13 -0.11 0.00 0.77 0.00 0.00 66.41 67.20 1tvn h THR 151 Cb 0.01 1.08 -0.01 0.00 -1.74 0.00 0.00 68.15 67.48 1tvn h THR 151 CO -0.05 0.04 -0.16 0.58 0.37 0.00 0.00 175.52 176.30 1tvn h VAL 152 N -0.00 1.27 -0.82 3.16 2.07 -0.89 -1.81 116.25 119.23 1tvn h VAL 152 Ca 0.01 -1.30 0.03 0.00 0.82 0.00 0.00 66.70 66.26 1tvn h VAL 152 Cb 0.05 1.14 -0.05 0.00 -1.52 0.00 0.00 31.29 30.91 1tvn h VAL 152 CO -0.00 0.45 0.53 0.40 0.02 0.00 0.00 177.57 178.97 1tvn h ILE 153 N 0.77 1.15 -0.25 4.57 2.04 -0.51 -0.46 117.51 124.81 1tvn h ILE 153 Ca 0.11 -0.36 -0.10 0.00 1.00 0.00 0.00 64.86 65.51 1tvn h ILE 153 Cb 0.72 0.01 -0.01 0.00 -0.74 0.00 0.00 36.82 36.79 1tvn h ILE 153 CO 0.06 0.19 -0.26 0.44 0.00 0.00 0.00 178.15 178.58 1tvn h ASP 154 N 1.05 0.49 -0.41 1.72 3.32 -0.99 0.88 116.42 122.48 1tvn h ASP 154 Ca 0.32 -0.17 -0.10 0.00 0.02 0.00 0.00 57.03 57.10 1tvn h ASP 154 Cb -0.03 -0.13 -0.01 0.00 0.22 0.00 0.00 39.33 39.38 1tvn h ASP 154 CO -0.10 0.74 -0.15 0.11 -1.72 0.00 0.00 179.24 178.12 1tvn h LYS 155 N 0.43 0.82 -0.13 3.56 1.79 -0.68 -2.62 116.57 119.74 1tvn h LYS 155 Ca 0.06 -0.34 -0.01 0.00 -2.18 0.00 0.00 60.65 58.18 1tvn h LYS 155 Cb 0.68 -0.03 -0.01 0.00 -1.58 0.00 0.00 32.23 31.29 1tvn h LYS 155 CO 0.05 0.97 0.03 0.82 -1.08 0.00 0.00 179.45 180.23 1tvn h ILE 156 N 0.63 1.21 0.00 1.86 2.04 -0.69 -3.20 117.51 119.37 1tvn h ILE 156 Ca 0.10 -0.65 0.00 0.00 1.00 0.00 0.00 64.86 65.31 1tvn h ILE 156 Cb 0.69 1.40 0.00 0.00 -0.74 0.00 0.00 36.82 38.17 1tvn h ILE 156 CO 0.05 0.19 0.00 0.03 0.00 0.00 0.00 178.15 178.42 1tvn h ARG 157 N -0.00 0.00 0.00 2.37 2.47 -0.81 0.11 114.38 118.52 1tvn h ARG 157 Ca 0.04 0.00 0.00 0.00 -1.26 0.00 0.00 59.98 58.76 1tvn h ARG 157 Cb 0.27 0.00 0.00 0.00 -1.65 0.00 0.00 29.97 28.59 1tvn h ARG 157 CO 0.00 0.00 0.00 0.00 0.56 0.00 0.00 179.97 180.53 1tvn n ALA 158 N -2.08 2.17 -0.07 0.04 0.00 -0.99 -3.56 120.51 116.02 1tvn n ALA 158 Ca -0.02 -0.01 -0.15 0.00 0.00 0.00 0.00 53.44 53.26 1tvn n ALA 158 Cb 0.14 -1.45 -0.05 0.00 0.00 0.00 0.00 19.45 18.09 1tvn n ALA 158 CO 0.00 0.00 0.00 -0.89 0.00 0.00 0.00 177.50 176.61 1tvn n ILE 159 N -2.20 0.84 -4.01 0.00 5.41 -0.44 -4.91 119.36 114.04 1tvn n ILE 159 Ca 0.05 -0.17 -0.31 0.00 1.00 0.00 0.00 62.75 63.32 1tvn n ILE 159 Cb 0.39 -1.72 -0.15 0.00 -0.71 0.00 0.00 39.64 37.45 1tvn n ILE 159 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 176.55 175.93 1tvn s ASP 160 N -6.29 4.69 0.42 4.38 3.68 0.27 -4.95 116.67 118.87 1tvn s ASP 160 Ca -0.20 -2.04 0.27 0.00 2.13 0.00 0.00 52.55 52.71 1tvn s ASP 160 Cb 0.07 -1.58 0.77 0.00 -1.45 0.00 0.00 42.92 40.73 1tvn s ASP 160 CO 0.25 -0.36 1.75 1.55 0.13 0.00 0.00 175.17 178.50 1tvn h PRO 161 N 7.65 0.00 -4.94 4.34 0.13 -1.80 -3.32 132.00 134.06 1tvn h PRO 161 Ca -0.06 0.00 -0.67 0.00 -0.87 0.00 0.00 66.00 64.40 1tvn h PRO 161 Cb 1.02 0.00 -0.34 0.00 0.13 0.00 0.00 31.00 31.82 1tvn h PRO 161 CO 0.51 0.00 -0.78 -0.51 -0.23 0.00 0.00 178.00 176.99 1tvn s ASP 162 N -5.62 4.07 0.00 1.44 1.01 -1.26 -4.99 116.67 111.32 1tvn s ASP 162 Ca 0.06 -0.92 0.00 0.00 0.71 0.00 0.00 52.55 52.40 1tvn s ASP 162 Cb 0.08 -1.60 0.00 0.00 1.01 0.00 0.00 42.92 42.41 1tvn s ASP 162 CO 0.60 -0.11 0.00 -0.46 0.21 0.00 0.00 175.17 175.41 1tvn n ASN 163 N 4.61 0.00 -4.75 0.27 0.23 -1.26 -4.95 115.26 109.41 1tvn n ASN 163 Ca -0.17 0.00 -0.36 0.00 -0.53 0.00 0.00 54.58 53.52 1tvn n ASN 163 Cb 0.47 0.00 -0.07 0.00 -2.08 0.00 0.00 39.78 38.10 1tvn n ASN 163 CO 0.00 0.00 0.00 -0.22 -0.93 0.00 0.00 177.26 176.11 1tvn s LEU 164 N 0.00 4.27 -0.12 -4.53 2.96 -1.26 -4.75 118.68 115.24 1tvn s LEU 164 Ca 0.00 0.50 0.03 0.00 -0.22 0.00 0.00 54.13 54.44 1tvn s LEU 164 Cb 0.00 -2.32 0.00 0.00 0.50 0.00 0.00 46.19 44.37 1tvn s LEU 164 CO 0.00 0.15 -0.23 -0.63 -1.32 0.00 0.00 176.35 174.32 1tvn s ILE 165 N 0.23 2.11 -0.18 6.68 1.01 -0.88 -1.91 121.20 128.26 1tvn s ILE 165 Ca 0.16 -0.99 -0.05 0.00 0.00 0.00 0.00 60.65 59.77 1tvn s ILE 165 Cb -0.13 -1.82 -0.03 0.00 0.01 0.00 0.00 42.46 40.49 1tvn s ILE 165 CO 0.04 0.55 0.01 -0.69 0.00 0.00 0.00 174.94 174.85 1tvn s VAL 166 N 0.53 4.24 -0.18 2.92 1.01 0.52 -1.02 120.40 128.43 1tvn s VAL 166 Ca -0.14 -0.23 -0.03 0.00 0.00 0.00 0.00 61.98 61.59 1tvn s VAL 166 Cb -0.17 -2.90 -0.02 0.00 0.00 0.00 0.00 36.38 33.30 1tvn s VAL 166 CO 0.05 0.46 -0.07 -0.69 0.00 0.00 0.00 175.10 174.84 1tvn s VAL 167 N 0.60 3.43 0.78 2.92 1.01 -0.00 -2.50 120.40 126.64 1tvn s VAL 167 Ca 0.00 -0.50 -0.14 0.00 0.00 0.00 0.00 61.98 61.34 1tvn s VAL 167 Cb -0.14 -2.51 0.05 0.00 0.00 0.00 0.00 36.38 33.78 1tvn s VAL 167 CO 0.02 0.47 1.07 0.61 0.00 0.00 0.00 175.10 177.27 1tvn n GLY 168 N 4.06 -0.28 3.45 4.51 0.00 -1.20 -1.08 105.19 114.66 1tvn n GLY 168 Ca -0.18 -0.44 -0.22 0.00 0.00 0.00 0.00 46.02 45.18 1tvn n GLY 168 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1tvn s THR 169 N -2.01 1.58 0.82 2.61 -4.23 -1.26 -4.79 115.64 108.35 1tvn s THR 169 Ca 0.73 -2.09 -0.12 0.00 -1.18 0.00 0.00 61.69 59.03 1tvn s THR 169 Cb -0.31 -2.58 0.09 0.00 1.34 0.00 0.00 72.50 71.04 1tvn s THR 169 CO 0.51 -0.20 1.15 -2.84 -0.54 0.00 0.00 174.62 172.70 1tvn s PRO 170 N -3.76 1.65 -0.84 3.99 0.02 -1.26 -1.40 135.00 133.40 1tvn s PRO 170 Ca 0.32 1.52 -0.02 0.00 0.02 0.00 0.00 61.00 62.84 1tvn s PRO 170 Cb 0.05 -1.80 -0.02 0.00 0.02 0.00 0.00 34.50 32.75 1tvn s PRO 170 CO 0.13 -2.16 0.77 2.41 -0.33 0.00 0.00 177.00 177.83 1tvn n THR 171 N -3.60 -9.85 -3.88 0.99 -1.04 0.19 -1.40 114.28 95.69 1tvn n THR 171 Ca 0.12 -0.60 -0.29 0.00 -2.04 0.00 0.00 64.05 61.24 1tvn n THR 171 Cb 0.52 -6.80 0.03 0.00 -1.82 0.00 0.00 70.33 62.26 1tvn n THR 171 CO 0.00 0.00 0.00 0.79 -0.64 0.00 0.00 175.07 175.22 1tvn n TRP 172 N -2.24 -2.23 -3.66 -1.42 8.01 0.02 -2.36 117.44 113.56 1tvn n TRP 172 Ca -0.02 0.89 -0.23 0.00 -1.31 0.00 0.00 57.50 56.83 1tvn n TRP 172 Cb 0.54 -4.05 0.06 0.00 -2.01 0.00 0.00 31.31 25.85 1tvn n TRP 172 CO 0.00 0.00 0.00 0.43 -1.01 0.00 0.00 177.69 177.11 1tvn n SER 173 N -2.88 -3.83 -0.07 -0.99 7.64 -0.49 -4.41 113.62 108.60 1tvn n SER 173 Ca -0.02 -0.68 -0.07 0.00 1.01 0.00 0.00 58.87 59.11 1tvn n SER 173 Cb 0.55 -4.57 -0.09 0.00 -1.01 0.00 0.00 64.21 59.09 1tvn n SER 173 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1tvn n GLN 174 N -4.56 1.61 -1.04 1.43 6.02 -0.74 -0.98 117.38 119.11 1tvn n GLN 174 Ca -0.12 0.02 -0.15 0.00 -0.01 0.00 0.00 57.00 56.73 1tvn n GLN 174 Cb 0.60 -1.32 -0.15 0.00 1.02 0.00 0.00 30.24 30.39 1tvn n GLN 174 CO 0.00 0.00 0.00 -0.25 -1.01 0.00 0.00 177.06 175.80 1tvn n ASP 175 N -2.58 5.68 0.21 1.08 10.43 -0.49 -4.47 116.55 126.41 1tvn n ASP 175 Ca -0.22 -2.49 0.05 0.00 2.57 0.00 0.00 54.79 54.70 1tvn n ASP 175 Cb 0.89 -1.44 0.47 0.00 1.84 0.00 0.00 41.12 42.88 1tvn n ASP 175 CO 0.00 0.00 0.00 -0.37 -1.07 0.00 0.00 177.20 175.76 1tvn h VAL 176 N 2.12 1.07 -0.61 2.53 -1.51 -1.85 -2.00 116.25 116.01 1tvn h VAL 176 Ca 0.28 -0.95 -0.03 0.00 -1.23 0.00 0.00 66.70 64.77 1tvn h VAL 176 Cb 1.36 1.53 -0.03 0.00 -2.13 0.00 0.00 31.29 32.02 1tvn h VAL 176 CO 0.42 0.26 0.27 -2.24 -1.23 0.00 0.00 177.57 175.05 1tvn h ASP 177 N 0.00 0.81 -0.25 4.19 2.03 -1.78 0.03 116.42 121.45 1tvn h ASP 177 Ca -0.00 -0.15 -0.04 0.00 -0.73 0.00 0.00 57.03 56.11 1tvn h ASP 177 Cb 0.51 -0.21 -0.01 0.00 -0.83 0.00 0.00 39.33 38.79 1tvn h ASP 177 CO 0.03 0.74 0.00 0.58 -1.03 0.00 0.00 179.24 179.57 1tvn h VAL 178 N 0.83 1.25 -0.57 4.15 2.07 -1.74 -2.81 116.25 119.44 1tvn h VAL 178 Ca 0.21 -0.89 -0.00 0.00 0.82 0.00 0.00 66.70 66.83 1tvn h VAL 178 Cb 0.16 1.35 -0.03 0.00 -1.52 0.00 0.00 31.29 31.25 1tvn h VAL 178 CO -0.02 0.28 0.34 0.00 0.02 0.00 0.00 177.57 178.19 1tvn h ALA 179 N 0.81 1.52 0.00 1.67 0.00 -1.24 -2.08 119.26 119.95 1tvn h ALA 179 Ca 0.07 -0.07 0.00 0.00 0.00 0.00 0.00 54.91 54.91 1tvn h ALA 179 Cb 0.40 -0.23 0.00 0.00 0.00 0.00 0.00 17.79 17.96 1tvn h ALA 179 CO 0.01 0.41 0.00 0.66 0.00 0.00 0.00 179.25 180.34 1tvn h SER 180 N 0.79 0.00 1.71 0.00 4.64 -0.71 -1.92 113.55 118.05 1tvn h SER 180 Ca 0.21 0.00 -0.01 0.00 -0.47 0.00 0.00 61.79 61.52 1tvn h SER 180 Cb -0.03 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 62.06 1tvn h SER 180 CO -0.04 0.00 -0.05 1.56 -0.87 0.00 0.00 176.83 177.43 1tvn h GLN 181 N 0.00 0.00 -1.73 4.77 4.20 -1.35 -3.37 115.11 117.63 1tvn h GLN 181 Ca 0.00 0.00 -0.51 0.00 0.06 0.00 0.00 58.65 58.20 1tvn h GLN 181 Cb 0.13 0.00 -0.36 0.00 0.30 0.00 0.00 27.48 27.55 1tvn h GLN 181 CO 0.00 0.05 -1.03 0.09 -0.67 0.00 0.00 178.83 177.27 1tvn n ASN 182 N -3.12 -0.21 -4.68 1.46 3.02 -0.73 -5.13 115.26 105.86 1tvn n ASN 182 Ca 0.03 -2.79 -0.30 0.00 -0.03 0.00 0.00 54.58 51.49 1tvn n ASN 182 Cb 0.49 -0.30 0.16 0.00 -0.61 0.00 0.00 39.78 39.52 1tvn n ASN 182 CO 0.00 0.00 0.00 -2.16 -2.62 0.00 0.00 177.26 172.48 1tvn s PRO 183 N -0.99 0.98 -0.07 3.52 0.04 -1.16 -4.96 135.00 132.36 1tvn s PRO 183 Ca 0.35 0.98 -0.22 0.00 0.04 0.00 0.00 61.00 62.16 1tvn s PRO 183 Cb 0.19 -1.76 -0.04 0.00 0.04 0.00 0.00 34.50 32.92 1tvn s PRO 183 CO -0.13 -2.48 0.62 0.42 0.04 0.00 0.00 177.00 175.48 1tvn s ILE 184 N -2.81 5.07 -1.30 0.56 1.01 -1.26 -4.99 121.20 117.47 1tvn s ILE 184 Ca 0.64 1.28 -0.12 0.00 0.00 0.00 0.00 60.65 62.45 1tvn s ILE 184 Cb -0.20 -3.96 0.14 0.00 0.01 0.00 0.00 42.46 38.45 1tvn s ILE 184 CO 0.58 0.30 1.83 -0.67 0.00 0.00 0.00 174.94 176.98 1tvn n ASP 185 N 3.60 4.88 -3.94 3.58 2.03 -1.26 -4.87 116.55 120.57 1tvn n ASP 185 Ca -0.04 -3.01 -0.10 0.00 0.52 0.00 0.00 54.79 52.16 1tvn n ASP 185 Cb 0.51 -1.56 -0.10 0.00 -0.72 0.00 0.00 41.12 39.26 1tvn n ASP 185 CO 0.00 0.00 0.00 -0.13 -1.92 0.00 0.00 177.20 175.15 1tvn s ARG 186 N 1.51 0.50 0.59 -0.67 1.81 -1.26 -5.15 118.95 116.28 1tvn s ARG 186 Ca 0.43 -0.67 -0.15 0.00 -1.72 0.00 0.00 55.73 53.62 1tvn s ARG 186 Cb 0.07 0.20 -0.04 0.00 -0.45 0.00 0.00 34.95 34.73 1tvn s ARG 186 CO -0.01 -0.12 1.04 0.00 -0.68 0.00 0.00 175.30 175.54 1tvn s ALA 187 N -2.16 2.83 -1.31 2.13 0.00 -1.26 -4.31 121.76 117.68 1tvn s ALA 187 Ca -0.09 0.27 -0.12 0.00 0.00 0.00 0.00 51.96 52.02 1tvn s ALA 187 Cb -0.04 -3.19 0.00 0.00 0.00 0.00 0.00 23.12 19.90 1tvn s ALA 187 CO -0.03 -0.72 0.53 0.09 0.00 0.00 0.00 175.76 175.64 1tvn n ASN 188 N -2.10 -2.33 -4.36 0.00 3.02 -1.26 -4.86 115.26 103.37 1tvn n ASN 188 Ca 0.08 -1.08 -0.33 0.00 -0.03 0.00 0.00 54.58 53.22 1tvn n ASN 188 Cb 0.53 -2.79 -0.15 0.00 -0.61 0.00 0.00 39.78 36.77 1tvn n ASN 188 CO 0.00 0.00 0.00 -0.63 -2.62 0.00 0.00 177.26 174.01 1tvn s ILE 189 N -3.78 2.90 0.35 2.41 -1.09 -1.26 -2.08 121.20 118.65 1tvn s ILE 189 Ca 0.23 -0.73 0.09 0.00 -2.23 0.00 0.00 60.65 58.01 1tvn s ILE 189 Cb -0.10 -2.19 -0.07 0.00 -1.58 0.00 0.00 42.46 38.53 1tvn s ILE 189 CO 0.90 0.54 -0.07 0.00 -1.23 0.00 0.00 174.94 175.08 1tvn s ALA 190 N 0.22 2.92 0.02 9.38 0.00 -0.19 -4.61 121.76 129.50 1tvn s ALA 190 Ca -0.09 -2.11 0.08 0.00 0.00 0.00 0.00 51.96 49.83 1tvn s ALA 190 Cb -0.16 0.03 -0.02 0.00 0.00 0.00 0.00 23.12 22.97 1tvn s ALA 190 CO 0.06 0.02 -0.25 0.71 0.00 0.00 0.00 175.76 176.30 1tvn s TYR 191 N -2.68 2.17 0.10 0.00 1.51 -0.07 -0.82 117.35 117.56 1tvn s TYR 191 Ca 0.33 -0.41 -0.30 0.00 -1.01 0.00 0.00 57.07 55.68 1tvn s TYR 191 Cb 0.04 -1.34 -0.06 0.00 -0.11 0.00 0.00 41.96 40.49 1tvn s TYR 191 CO 0.16 0.05 1.12 0.99 -1.11 0.00 0.00 175.55 176.76 1tvn s THR 192 N -0.70 4.10 -0.13 -0.71 2.01 -0.24 -1.53 115.64 118.44 1tvn s THR 192 Ca 0.10 1.62 0.01 0.00 0.31 0.00 0.00 61.69 63.72 1tvn s THR 192 Cb -0.09 -4.04 0.02 0.00 0.01 0.00 0.00 72.50 68.40 1tvn s THR 192 CO 0.01 0.19 -0.13 -0.22 -0.69 0.00 0.00 174.62 173.77 1tvn s LEU 193 N 0.47 1.60 -0.00 4.42 2.96 -0.95 -4.32 118.68 122.86 1tvn s LEU 193 Ca 0.54 -0.44 0.07 0.00 -0.22 0.00 0.00 54.13 54.08 1tvn s LEU 193 Cb -0.28 -1.09 -0.02 0.00 0.50 0.00 0.00 46.19 45.30 1tvn s LEU 193 CO 0.31 -0.05 -0.21 -1.00 -1.32 0.00 0.00 176.35 174.08 1tvn s HIS 194 N 1.39 1.88 0.15 5.38 3.76 -0.15 -3.72 115.29 123.98 1tvn s HIS 194 Ca 0.02 -0.36 -0.19 0.00 -0.15 0.00 0.00 55.06 54.38 1tvn s HIS 194 Cb -0.13 -1.19 0.05 0.00 1.11 0.00 0.00 32.58 32.41 1tvn s HIS 194 CO -0.08 -0.01 0.51 -0.59 -0.85 0.00 0.00 174.74 173.73 1tvn s PHE 195 N -0.55 -0.33 -0.11 1.40 -0.12 -1.20 -4.61 117.98 112.46 1tvn s PHE 195 Ca 0.08 0.05 0.01 0.00 -0.05 0.00 0.00 56.93 57.02 1tvn s PHE 195 Cb -0.08 0.42 0.02 0.00 -0.63 0.00 0.00 43.02 42.74 1tvn s PHE 195 CO -0.00 -0.81 -0.12 0.71 -0.05 0.00 0.00 175.22 174.94 1tvn s TYR 196 N -3.80 1.74 0.57 3.49 1.51 -1.26 -1.34 117.35 118.26 1tvn s TYR 196 Ca 0.03 -0.82 0.26 0.00 -1.01 0.00 0.00 57.07 55.53 1tvn s TYR 196 Cb 0.00 -1.31 1.56 0.00 -0.11 0.00 0.00 41.96 42.10 1tvn s TYR 196 CO -0.10 -0.47 2.11 0.00 -1.11 0.00 0.00 175.55 175.98 1tvn h ALA 197 N 7.62 1.93 -0.00 3.71 0.00 -0.74 0.78 119.26 132.56 1tvn h ALA 197 Ca -0.32 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.59 1tvn h ALA 197 Cb 1.16 0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.96 1tvn h ALA 197 CO 0.47 -0.27 -0.08 0.41 0.00 0.00 0.00 179.25 179.78 1tvn n GLY 198 N -1.46 -0.91 0.00 0.00 0.00 0.18 -4.31 105.19 98.68 1tvn n GLY 198 Ca 0.02 -0.26 0.00 0.00 0.00 0.00 0.00 46.02 45.78 1tvn n GLY 198 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 1tvn n THR 199 N -0.91 0.00 -4.14 2.61 -1.04 -0.32 -4.75 114.28 105.72 1tvn n THR 199 Ca 0.16 0.00 -0.34 0.00 -2.04 0.00 0.00 64.05 61.83 1tvn n THR 199 Cb 0.26 -0.43 -0.11 0.00 -1.82 0.00 0.00 70.33 68.22 1tvn n THR 199 CO 0.00 0.00 0.00 -1.00 -0.64 0.00 0.00 175.07 173.43 1tvn s HIS 200 N -1.71 3.12 0.00 -1.42 3.76 0.12 -5.03 115.29 114.13 1tvn s HIS 200 Ca 0.00 -0.19 0.00 0.00 -0.15 0.00 0.00 55.06 54.72 1tvn s HIS 200 Cb 0.00 -2.05 0.00 0.00 1.11 0.00 0.00 32.58 31.64 1tvn s HIS 200 CO 0.00 -0.02 0.00 0.41 -0.85 0.00 0.00 174.74 174.28 1tvn n GLY 201 N 3.76 5.26 0.34 -2.22 0.00 -1.26 -4.54 105.19 106.53 1tvn n GLY 201 Ca -0.17 -1.53 0.09 0.00 0.00 0.00 0.00 46.02 44.41 1tvn n GLY 201 CO 0.00 0.00 0.00 -1.61 0.00 0.00 0.00 173.32 171.71 1tvn h GLN 202 N 0.00 0.52 -0.30 1.61 5.75 -1.99 -1.16 115.11 119.54 1tvn h GLN 202 Ca 0.00 -0.03 -0.03 0.00 -0.15 0.00 0.00 58.65 58.44 1tvn h GLN 202 Cb 0.00 -0.12 -0.02 0.00 1.07 0.00 0.00 27.48 28.42 1tvn h GLN 202 CO 0.00 0.35 0.08 0.66 -2.65 0.00 0.00 178.83 177.26 1tvn h SER 203 N 0.54 0.39 0.51 -0.69 4.64 -1.99 0.11 113.55 117.06 1tvn h SER 203 Ca 0.26 -0.04 -0.22 0.00 -0.47 0.00 0.00 61.79 61.31 1tvn h SER 203 Cb 0.33 -0.10 -0.00 0.00 -0.31 0.00 0.00 62.40 62.32 1tvn h SER 203 CO -0.08 0.40 -0.98 1.88 -0.87 0.00 0.00 176.83 177.18 1tvn h TYR 204 N 0.43 0.45 -0.12 4.77 -1.99 -1.59 -2.49 116.97 116.42 1tvn h TYR 204 Ca 0.10 -0.26 -0.10 0.00 2.00 0.00 0.00 58.73 60.47 1tvn h TYR 204 Cb 0.16 -0.04 -0.01 0.00 2.00 0.00 0.00 36.73 38.84 1tvn h TYR 204 CO 0.01 1.11 -0.37 0.00 -0.00 0.00 0.00 178.16 178.90 1tvn h ARG 205 N 0.15 0.26 -0.28 4.88 3.08 -0.95 -2.37 114.38 119.15 1tvn h ARG 205 Ca -0.07 -0.11 -0.08 0.00 0.07 0.00 0.00 59.98 59.78 1tvn h ARG 205 Cb 1.63 -0.01 -0.02 0.00 0.08 0.00 0.00 29.97 31.66 1tvn h ARG 205 CO 0.16 0.60 -0.17 -0.91 -1.07 0.00 0.00 179.97 178.58 1tvn h ASN 206 N 0.22 0.49 -0.45 7.04 2.35 -0.60 0.38 115.58 125.00 1tvn h ASN 206 Ca 0.02 -0.14 -0.07 0.00 -0.55 0.00 0.00 56.30 55.57 1tvn h ASN 206 Cb 0.76 -0.13 -0.02 0.00 0.05 0.00 0.00 38.32 38.98 1tvn h ASN 206 CO 0.06 0.68 0.02 0.11 -1.65 0.00 0.00 177.43 176.64 1tvn h LYS 207 N 0.45 0.79 -0.70 0.81 1.57 -1.08 -0.48 116.57 117.92 1tvn h LYS 207 Ca 0.08 -0.24 -0.06 0.00 -1.87 0.00 0.00 60.65 58.56 1tvn h LYS 207 Cb 0.56 -0.08 -0.03 0.00 0.08 0.00 0.00 32.23 32.77 1tvn h LYS 207 CO 0.04 0.84 0.22 0.00 -0.57 0.00 0.00 179.45 179.98 1tvn h ALA 208 N 0.92 0.92 -0.90 3.86 0.00 -0.90 -2.17 119.26 120.99 1tvn h ALA 208 Ca 0.13 -0.22 0.01 0.00 0.00 0.00 0.00 54.91 54.83 1tvn h ALA 208 Cb 0.47 -0.27 -0.05 0.00 0.00 0.00 0.00 17.79 17.95 1tvn h ALA 208 CO 0.02 0.60 0.59 0.37 0.00 0.00 0.00 179.25 180.84 1tvn h GLN 209 N 1.04 1.17 -0.71 0.00 5.75 0.14 -0.43 115.11 122.06 1tvn h GLN 209 Ca 0.23 -0.07 0.00 0.00 -0.15 0.00 0.00 58.65 58.66 1tvn h GLN 209 Cb 0.30 -0.26 -0.03 0.00 1.07 0.00 0.00 27.48 28.56 1tvn h GLN 209 CO -0.01 0.77 0.45 1.15 -2.65 0.00 0.00 178.83 178.55 1tvn h THR 210 N 1.20 1.20 0.02 2.39 2.02 -0.80 0.21 112.91 119.15 1tvn h THR 210 Ca 0.33 -0.40 -0.00 0.00 0.77 0.00 0.00 66.41 67.11 1tvn h THR 210 Cb -0.12 0.18 0.00 0.00 -1.74 0.00 0.00 68.15 66.47 1tvn h THR 210 CO -0.08 0.20 -0.01 0.00 0.37 0.00 0.00 175.52 176.00 1tvn h ALA 211 N 1.24 -0.03 -0.72 6.16 0.00 -0.87 -0.61 119.26 124.43 1tvn h ALA 211 Ca 0.26 -0.10 0.03 0.00 0.00 0.00 0.00 54.91 55.10 1tvn h ALA 211 Cb -0.07 0.01 -0.04 0.00 0.00 0.00 0.00 17.79 17.69 1tvn h ALA 211 CO -0.05 -0.42 0.45 -0.07 0.00 0.00 0.00 179.25 179.16 1tvn h LEU 212 N -0.22 0.74 -1.54 0.00 3.38 -0.85 -2.04 115.31 114.79 1tvn h LEU 212 Ca -0.00 -0.00 -0.05 0.00 0.09 0.00 0.00 57.88 57.92 1tvn h LEU 212 Cb 0.21 -0.16 -0.01 0.00 0.09 0.00 0.00 40.66 40.79 1tvn h LEU 212 CO 0.00 0.51 -0.24 0.44 0.09 0.00 0.00 178.44 179.25 1tvn h ASP 213 N 0.88 0.00 0.70 -0.43 3.32 -0.77 -1.31 116.42 118.81 1tvn h ASP 213 Ca 0.29 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.34 1tvn h ASP 213 Cb 0.02 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.57 1tvn h ASP 213 CO -0.11 0.24 0.00 0.59 -1.72 0.00 0.00 179.24 178.24 1tvn n ASN 214 N -3.91 0.00 0.00 6.45 3.02 -0.25 -4.93 115.26 115.64 1tvn n ASN 214 Ca -0.02 0.12 0.00 0.00 -0.03 0.00 0.00 54.58 54.66 1tvn n ASN 214 Cb 0.32 -0.37 0.00 0.00 -0.61 0.00 0.00 39.78 39.12 1tvn n ASN 214 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1tvn n GLY 215 N 1.21 0.92 3.72 7.41 0.00 -0.49 -4.99 105.19 112.97 1tvn n GLY 215 Ca 0.11 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.81 1tvn n GLY 215 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 1tvn s ILE 216 N -2.00 4.29 0.19 -0.61 -4.36 -1.02 -3.59 121.20 114.10 1tvn s ILE 216 Ca 0.00 -0.72 -0.17 0.00 -0.26 0.00 0.00 60.65 59.50 1tvn s ILE 216 Cb 0.00 -3.00 -0.08 0.00 1.25 0.00 0.00 42.46 40.64 1tvn s ILE 216 CO 0.00 0.24 0.64 0.00 0.24 0.00 0.00 174.94 176.06 1tvn s ALA 217 N -1.24 3.49 0.17 2.27 0.00 -1.26 -4.07 121.76 121.12 1tvn s ALA 217 Ca 0.24 0.03 0.10 0.00 0.00 0.00 0.00 51.96 52.33 1tvn s ALA 217 Cb -0.12 -2.68 -0.04 0.00 0.00 0.00 0.00 23.12 20.28 1tvn s ALA 217 CO 0.16 0.39 -0.21 -0.51 0.00 0.00 0.00 175.76 175.59 1tvn s LEU 218 N -1.96 2.56 -0.05 0.00 1.43 -1.26 -0.89 118.68 118.50 1tvn s LEU 218 Ca 0.40 -0.75 -0.01 0.00 -1.03 0.00 0.00 54.13 52.74 1tvn s LEU 218 Cb -0.16 -1.33 0.03 0.00 0.03 0.00 0.00 46.19 44.76 1tvn s LEU 218 CO 0.20 0.14 0.03 0.12 0.23 0.00 0.00 176.35 177.06 1tvn s PHE 219 N -1.50 0.37 -1.22 0.29 2.19 -0.58 -4.57 117.98 112.96 1tvn s PHE 219 Ca 0.20 0.04 -0.13 0.00 0.33 0.00 0.00 56.93 57.37 1tvn s PHE 219 Cb -0.09 -0.62 0.18 0.00 -1.31 0.00 0.00 43.02 41.17 1tvn s PHE 219 CO 0.10 -0.25 1.51 0.00 1.83 0.00 0.00 175.22 178.41 1tvn n ALA 220 N 5.13 4.16 0.35 11.12 0.00 -0.31 -2.23 120.51 138.72 1tvn n ALA 220 Ca -0.07 -4.28 0.06 0.00 0.00 0.00 0.00 53.44 49.15 1tvn n ALA 220 Cb 0.50 -3.02 0.26 0.00 0.00 0.00 0.00 19.45 17.19 1tvn n ALA 220 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.50 177.75 1tvn n THR 221 N 4.30 1.24 -3.66 0.00 -2.24 -1.24 -1.66 114.28 111.01 1tvn n THR 221 Ca 0.37 0.33 -0.06 0.00 -2.27 0.00 0.00 64.05 62.42 1tvn n THR 221 Cb 0.41 -1.18 -0.07 0.00 -2.10 0.00 0.00 70.33 67.39 1tvn n THR 221 CO 0.00 0.00 0.00 -0.70 -0.57 0.00 0.00 175.07 173.80 1tvn s GLU 222 N -3.06 0.54 0.03 -0.78 2.12 -1.21 -4.26 118.70 112.08 1tvn s GLU 222 Ca 0.05 1.18 -0.20 0.00 0.36 0.00 0.00 54.97 56.35 1tvn s GLU 222 Cb 0.07 0.36 0.04 0.00 0.26 0.00 0.00 34.13 34.86 1tvn s GLU 222 CO 0.21 -0.19 0.45 1.67 -0.54 0.00 0.00 175.26 176.87 1tvn s TRP 223 N 2.14 -0.33 0.19 5.30 1.48 -0.95 -3.24 118.94 123.53 1tvn s TRP 223 Ca -0.07 0.37 0.08 0.00 -1.06 0.00 0.00 56.10 55.41 1tvn s TRP 223 Cb -0.09 0.26 -0.04 0.00 -1.16 0.00 0.00 33.47 32.43 1tvn s TRP 223 CO -0.17 -0.58 -0.15 0.20 -4.06 0.00 0.00 176.95 172.19 1tvn s GLY 224 N -1.88 1.38 0.05 3.67 0.00 -0.45 -0.48 107.32 109.61 1tvn s GLY 224 Ca -0.06 -1.59 0.24 0.00 0.00 0.00 0.00 44.72 43.31 1tvn s GLY 224 CO -0.01 -1.67 1.23 -1.30 0.00 0.00 0.00 173.10 171.36 1tvn n THR 225 N -0.15 0.16 -2.41 0.90 -2.24 -1.26 -0.45 114.28 108.82 1tvn n THR 225 Ca -0.10 -0.16 0.00 0.00 -2.27 0.00 0.00 64.05 61.52 1tvn n THR 225 Cb 0.59 0.16 0.00 0.00 -2.10 0.00 0.00 70.33 68.98 1tvn n THR 225 CO 0.00 0.00 0.00 1.33 -0.57 0.00 0.00 175.07 175.83 1tvn n VAL 226 N -1.83 0.00 -1.79 2.28 0.24 -1.26 -1.31 118.33 114.66 1tvn n VAL 226 Ca 0.04 0.00 -0.33 0.00 -2.04 0.00 0.00 64.34 62.01 1tvn n VAL 226 Cb 0.40 -0.40 0.04 0.00 -1.47 0.00 0.00 33.84 32.41 1tvn n VAL 226 CO 0.00 0.00 0.00 0.20 -2.14 0.00 0.00 176.83 174.89 1tvn s ASN 227 N 0.08 5.19 0.47 -1.34 0.01 -0.55 -0.65 114.94 118.15 1tvn s ASN 227 Ca 0.00 1.98 0.28 0.00 -0.71 0.00 0.00 52.86 54.41 1tvn s ASN 227 Cb 0.00 -2.55 1.34 0.00 0.41 0.00 0.00 41.25 40.46 1tvn s ASN 227 CO 0.00 -1.57 1.77 0.00 -1.51 0.00 0.00 177.10 175.79 1tvn h ALA 228 N 0.07 2.70 0.00 0.60 0.00 -1.84 -0.91 119.26 119.88 1tvn h ALA 228 Ca -0.47 0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.46 1tvn h ALA 228 Cb 1.24 0.07 0.00 0.00 0.00 0.00 0.00 17.79 19.11 1tvn h ALA 228 CO 0.54 -1.10 0.00 -0.40 0.00 0.00 0.00 179.25 178.30 1tvn n ASP 229 N -4.42 0.00 0.00 0.00 3.85 -1.26 -4.88 116.55 109.83 1tvn n ASP 229 Ca 0.27 -0.01 0.00 0.00 -0.71 0.00 0.00 54.79 54.33 1tvn n ASP 229 Cb 1.11 -0.30 0.00 0.00 -1.35 0.00 0.00 41.12 40.58 1tvn n ASP 229 CO 0.00 0.00 0.00 0.61 -1.01 0.00 0.00 177.20 176.80 1tvn n GLY 230 N 0.71 0.39 3.74 6.12 0.00 -0.35 -5.07 105.19 110.73 1tvn n GLY 230 Ca 0.11 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.80 1tvn n GLY 230 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 1tvn s ASN 231 N -2.62 3.94 0.00 1.61 2.47 -1.24 -0.59 114.94 118.50 1tvn s ASN 231 Ca 0.00 -1.69 0.00 0.00 0.42 0.00 0.00 52.86 51.59 1tvn s ASN 231 Cb 0.00 0.62 0.00 0.00 -1.45 0.00 0.00 41.25 40.42 1tvn s ASN 231 CO 0.00 -0.91 0.00 0.61 -3.72 0.00 0.00 177.10 173.08 1tvn n GLY 232 N -1.24 -2.38 3.91 1.21 0.00 -1.26 -1.48 105.19 103.95 1tvn n GLY 232 Ca -0.18 -2.15 -0.28 0.00 0.00 0.00 0.00 46.02 43.41 1tvn n GLY 232 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1tvn s GLY 233 N 0.00 1.61 0.09 -0.02 0.00 -1.26 -4.45 107.32 103.30 1tvn s GLY 233 Ca 0.00 -0.51 -0.30 0.00 0.00 0.00 0.00 44.72 43.90 1tvn s GLY 233 CO 0.00 -0.36 1.21 0.14 0.00 0.00 0.00 173.10 174.08 1tvn s VAL 234 N -2.52 3.88 -0.64 1.40 1.01 -1.26 -4.36 120.40 117.91 1tvn s VAL 234 Ca 0.47 1.41 -0.15 0.00 0.00 0.00 0.00 61.98 63.70 1tvn s VAL 234 Cb -0.10 -3.90 0.16 0.00 0.00 0.00 0.00 36.38 32.54 1tvn s VAL 234 CO 0.39 0.14 0.59 0.21 0.00 0.00 0.00 175.10 176.43 1tvn s ASN 235 N 0.82 6.38 0.08 3.32 3.84 -0.43 -4.94 114.94 124.02 1tvn s ASN 235 Ca 0.57 -2.13 -0.28 0.00 0.21 0.00 0.00 52.86 51.23 1tvn s ASN 235 Cb -0.31 -2.20 -0.17 0.00 -0.55 0.00 0.00 41.25 38.02 1tvn s ASN 235 CO 0.31 -0.75 1.67 0.40 -2.79 0.00 0.00 177.10 175.94 1tvn h ILE 236 N 5.48 0.64 -0.84 -5.21 1.08 -1.93 -1.10 117.51 115.63 1tvn h ILE 236 Ca -0.15 -0.01 -0.01 0.00 -0.39 0.00 0.00 64.86 64.30 1tvn h ILE 236 Cb 1.08 0.65 -0.04 0.00 -3.07 0.00 0.00 36.82 35.44 1tvn h ILE 236 CO 0.93 0.00 0.49 0.78 -0.69 0.00 0.00 178.15 179.66 1tvn h ASN 237 N -0.50 1.02 -0.38 1.72 2.35 -1.99 -0.14 115.58 117.66 1tvn h ASN 237 Ca -0.05 -0.08 -0.15 0.00 -0.55 0.00 0.00 56.30 55.47 1tvn h ASN 237 Cb 0.38 -0.26 -0.01 0.00 0.05 0.00 0.00 38.32 38.48 1tvn h ASN 237 CO 0.08 0.80 -0.35 -0.08 -1.65 0.00 0.00 177.43 176.24 1tvn h GLU 238 N 1.16 0.93 -0.46 0.81 4.57 -1.86 -1.07 114.58 118.66 1tvn h GLU 238 Ca 0.30 -0.46 0.01 0.00 -1.18 0.00 0.00 59.36 58.02 1tvn h GLU 238 Cb -0.02 0.00 -0.02 0.00 -0.16 0.00 0.00 28.75 28.55 1tvn h GLU 238 CO -0.05 1.12 0.29 1.15 -1.18 0.00 0.00 179.01 180.34 1tvn h THR 239 N 0.77 1.10 -0.85 0.32 2.02 -0.81 -1.39 112.91 114.07 1tvn h THR 239 Ca 0.07 -0.21 -0.02 0.00 0.77 0.00 0.00 66.41 67.03 1tvn h THR 239 Cb 0.93 0.45 -0.04 0.00 -1.74 0.00 0.00 68.15 67.75 1tvn h THR 239 CO 0.09 0.11 0.45 0.44 0.37 0.00 0.00 175.52 176.98 1tvn h ASP 240 N 0.60 1.08 -0.71 4.18 3.32 -0.80 0.14 116.42 124.22 1tvn h ASP 240 Ca 0.17 -0.10 -0.01 0.00 0.02 0.00 0.00 57.03 57.10 1tvn h ASP 240 Cb -0.05 -0.27 -0.03 0.00 0.22 0.00 0.00 39.33 39.19 1tvn h ASP 240 CO -0.05 0.88 0.39 0.00 -1.72 0.00 0.00 179.24 178.74 1tvn h ALA 241 N 1.29 0.91 -0.36 3.45 0.00 -0.65 -0.20 119.26 123.70 1tvn h ALA 241 Ca 0.30 -0.11 -0.12 0.00 0.00 0.00 0.00 54.91 54.98 1tvn h ALA 241 Cb 0.05 -0.28 -0.01 0.00 0.00 0.00 0.00 17.79 17.55 1tvn h ALA 241 CO -0.04 0.42 -0.25 -1.49 0.00 0.00 0.00 179.25 177.89 1tvn h TRP 242 N 0.98 0.95 -0.37 0.00 4.06 -0.88 -1.78 115.95 118.90 1tvn h TRP 242 Ca 0.25 -0.26 -0.05 0.00 2.06 0.00 0.00 58.89 60.89 1tvn h TRP 242 Cb 0.03 -0.21 -0.02 0.00 -1.00 0.00 0.00 29.16 27.96 1tvn h TRP 242 CO -0.00 1.02 0.01 0.52 -3.56 0.00 0.00 178.44 176.43 1tvn h MET 243 N 0.60 0.58 -0.45 0.49 2.86 -0.63 -0.57 114.93 117.81 1tvn h MET 243 Ca 0.07 -0.13 -0.10 0.00 -2.06 0.00 0.00 59.70 57.49 1tvn h MET 243 Cb 0.81 -0.08 -0.01 0.00 0.06 0.00 0.00 31.60 32.37 1tvn h MET 243 CO 0.07 0.60 -0.10 0.00 1.06 0.00 0.00 176.91 178.54 1tvn h ALA 244 N 1.46 0.62 -0.93 6.32 0.00 -0.90 0.15 119.26 125.99 1tvn h ALA 244 Ca 0.12 -0.33 0.01 0.00 0.00 0.00 0.00 54.91 54.71 1tvn h ALA 244 Cb 0.34 -0.16 -0.05 0.00 0.00 0.00 0.00 17.79 17.92 1tvn h ALA 244 CO 0.01 0.51 0.61 0.35 0.00 0.00 0.00 179.25 180.73 1tvn h PHE 245 N 0.70 1.17 -0.18 0.00 3.57 -0.76 -1.15 116.94 120.31 1tvn h PHE 245 Ca 0.12 0.03 -0.16 0.00 3.53 0.00 0.00 57.97 61.49 1tvn h PHE 245 Cb 0.64 -0.40 0.00 0.00 2.79 0.00 0.00 35.95 38.99 1tvn h PHE 245 CO 0.05 0.74 -0.50 0.74 -2.23 0.00 0.00 178.31 177.11 1tvn h PHE 246 N 1.26 0.84 -0.54 0.41 0.05 -0.86 -2.64 116.94 115.46 1tvn h PHE 246 Ca 0.34 -0.33 -0.03 0.00 3.82 0.00 0.00 57.97 61.77 1tvn h PHE 246 Cb -0.14 -0.14 -0.02 0.00 2.00 0.00 0.00 35.95 37.64 1tvn h PHE 246 CO -0.01 1.11 0.24 -0.22 -0.18 0.00 0.00 178.31 179.26 1tvn h LYS 247 N 0.32 0.80 0.00 1.51 1.63 -0.47 0.80 116.57 121.16 1tvn h LYS 247 Ca -0.01 -0.13 -0.08 0.00 -0.85 0.00 0.00 60.65 59.57 1tvn h LYS 247 Cb 1.11 -0.14 -0.01 0.00 -0.60 0.00 0.00 32.23 32.60 1tvn h LYS 247 CO 0.11 0.68 -0.40 1.79 -3.45 0.00 0.00 179.45 178.17 1tvn h THR 248 N 0.73 1.18 -0.53 1.00 1.35 -1.27 -2.82 112.91 112.55 1tvn h THR 248 Ca 0.18 -1.41 0.00 0.00 -0.55 0.00 0.00 66.41 64.63 1tvn h THR 248 Cb 0.16 1.78 0.00 0.00 -1.73 0.00 0.00 68.15 68.36 1tvn h THR 248 CO -0.02 0.39 0.00 0.59 -0.25 0.00 0.00 175.52 176.23 1tvn n ASN 249 N -3.91 3.54 -3.59 5.36 3.02 -1.00 -4.98 115.26 113.70 1tvn n ASN 249 Ca -0.01 -1.97 -0.22 0.00 -0.03 0.00 0.00 54.58 52.34 1tvn n ASN 249 Cb 0.45 -0.35 0.07 0.00 -0.61 0.00 0.00 39.78 39.34 1tvn n ASN 249 CO 0.00 0.00 0.00 0.59 -2.62 0.00 0.00 177.26 175.23 1tvn n ASN 250 N 1.35 -4.29 -4.59 6.41 3.02 -0.12 -4.93 115.26 112.11 1tvn n ASN 250 Ca 0.20 -0.62 -0.38 0.00 -0.03 0.00 0.00 54.58 53.74 1tvn n ASN 250 Cb 0.57 -4.83 -0.11 0.00 -0.61 0.00 0.00 39.78 34.80 1tvn n ASN 250 CO 0.00 0.00 0.00 -0.63 -2.62 0.00 0.00 177.26 174.01 1tvn s ILE 251 N -3.36 5.28 0.70 2.41 1.01 0.09 -4.66 121.20 122.67 1tvn s ILE 251 Ca 0.35 0.22 -0.11 0.00 0.00 0.00 0.00 60.65 61.11 1tvn s ILE 251 Cb -0.16 -3.58 0.01 0.00 0.01 0.00 0.00 42.46 38.75 1tvn s ILE 251 CO 0.75 0.21 1.06 -0.44 0.00 0.00 0.00 174.94 176.53 1tvn s SER 252 N 1.74 5.30 0.09 3.58 0.01 -1.26 -4.65 113.70 118.51 1tvn s SER 252 Ca 0.08 1.63 -0.24 0.00 1.31 0.00 0.00 55.95 58.73 1tvn s SER 252 Cb -0.16 -2.49 0.06 0.00 0.21 0.00 0.00 66.02 63.64 1tvn s SER 252 CO 0.11 -1.50 0.59 -1.38 0.41 0.00 0.00 173.24 171.47 1tvn s HIS 253 N -3.04 -0.52 -0.07 2.43 -3.43 -0.61 -1.16 115.29 108.89 1tvn s HIS 253 Ca 0.58 0.51 0.00 0.00 -0.80 0.00 0.00 55.06 55.35 1tvn s HIS 253 Cb -0.14 0.46 0.02 0.00 -1.43 0.00 0.00 32.58 31.50 1tvn s HIS 253 CO 0.55 -0.75 -0.05 0.00 -2.00 0.00 0.00 174.74 172.50 1tvn s ALA 254 N -2.93 0.89 0.12 -1.38 0.00 -0.67 -2.04 121.76 115.76 1tvn s ALA 254 Ca -0.03 -0.23 -0.26 0.00 0.00 0.00 0.00 51.96 51.45 1tvn s ALA 254 Cb -0.01 -0.65 -0.07 0.00 0.00 0.00 0.00 23.12 22.40 1tvn s ALA 254 CO -0.06 -0.22 0.79 1.21 0.00 0.00 0.00 175.76 177.48 1tvn s ASN 255 N 1.38 7.34 -0.24 0.00 3.84 -0.67 -2.25 114.94 124.35 1tvn s ASN 255 Ca -0.03 1.60 -0.13 0.00 0.21 0.00 0.00 52.86 54.51 1tvn s ASN 255 Cb -0.13 -2.50 -0.04 0.00 -0.55 0.00 0.00 41.25 38.02 1tvn s ASN 255 CO -0.03 0.12 0.27 0.86 -2.79 0.00 0.00 177.10 175.53 1tvn s TRP 256 N -0.70 3.30 0.01 0.43 -0.11 0.37 -0.05 118.94 122.19 1tvn s TRP 256 Ca 0.38 0.34 -0.16 0.00 1.22 0.00 0.00 56.10 57.88 1tvn s TRP 256 Cb -0.22 -2.41 0.03 0.00 -1.50 0.00 0.00 33.47 29.36 1tvn s TRP 256 CO 0.26 -0.05 0.34 0.00 -4.62 0.00 0.00 176.95 172.87 1tvn s ALA 257 N 1.44 -0.82 -0.67 5.86 0.00 -0.47 -4.63 121.76 122.46 1tvn s ALA 257 Ca 0.12 0.27 -0.27 0.00 0.00 0.00 0.00 51.96 52.08 1tvn s ALA 257 Cb -0.15 0.18 0.03 0.00 0.00 0.00 0.00 23.12 23.19 1tvn s ALA 257 CO 0.07 -0.34 1.20 -1.17 0.00 0.00 0.00 175.76 175.53 1tvn s LEU 258 N -1.64 3.43 0.05 0.00 0.20 0.20 -0.91 118.68 120.02 1tvn s LEU 258 Ca -0.10 -0.34 -0.28 0.00 0.69 0.00 0.00 54.13 54.11 1tvn s LEU 258 Cb -0.03 -2.74 0.10 0.00 -0.43 0.00 0.00 46.19 43.09 1tvn s LEU 258 CO 0.01 -1.65 1.18 0.21 -0.29 0.00 0.00 176.35 175.81 1tvn s ASN 259 N 3.44 -0.06 -0.06 3.68 2.47 -1.26 -3.11 114.94 120.04 1tvn s ASN 259 Ca 0.36 -0.29 0.09 0.00 0.42 0.00 0.00 52.86 53.43 1tvn s ASN 259 Cb -0.09 0.28 0.13 0.00 -1.45 0.00 0.00 41.25 40.13 1tvn s ASN 259 CO 0.18 -0.54 1.02 -0.90 -3.72 0.00 0.00 177.10 173.14 1tvn n ASP 260 N -0.71 1.44 -4.75 -4.21 5.75 -1.26 -2.37 116.55 110.43 1tvn n ASP 260 Ca -0.05 -2.40 -0.38 0.00 -0.01 0.00 0.00 54.79 51.95 1tvn n ASP 260 Cb 0.61 -0.25 0.03 0.00 -1.03 0.00 0.00 41.12 40.49 1tvn n ASP 260 CO 0.00 0.00 0.00 -0.75 -0.11 0.00 0.00 177.20 176.34 1tvn s LYS 261 N -1.51 3.18 -1.27 0.11 2.20 -1.26 -3.68 119.74 117.51 1tvn s LYS 261 Ca 0.15 2.10 -0.19 0.00 -0.36 0.00 0.00 55.97 57.66 1tvn s LYS 261 Cb 0.13 -2.21 0.04 0.00 -1.51 0.00 0.00 37.83 34.28 1tvn s LYS 261 CO 0.01 -1.12 1.77 1.21 -0.36 0.00 0.00 175.35 176.86 1tvn s ASN 262 N -1.13 6.52 0.02 1.43 3.84 -1.26 -4.62 114.94 119.74 1tvn s ASN 262 Ca 0.72 -2.29 -0.17 0.00 0.21 0.00 0.00 52.86 51.33 1tvn s ASN 262 Cb -0.37 -2.58 0.03 0.00 -0.55 0.00 0.00 41.25 37.78 1tvn s ASN 262 CO 0.43 -1.51 0.37 -1.83 -2.79 0.00 0.00 177.10 171.77 1tvn s GLU 263 N 4.63 0.82 0.47 0.43 -1.05 -1.26 -5.06 118.70 117.68 1tvn s GLU 263 Ca 0.56 -0.32 0.18 0.00 -0.15 0.00 0.00 54.97 55.25 1tvn s GLU 263 Cb 0.03 0.36 1.17 0.00 -0.44 0.00 0.00 34.13 35.25 1tvn s GLU 263 CO 0.08 -0.26 1.97 0.78 0.95 0.00 0.00 175.26 178.79 1tvn h GLY 264 N 3.32 0.40 2.00 -3.83 0.00 -1.76 -2.47 103.07 100.74 1tvn h GLY 264 Ca -0.31 -0.11 0.00 0.00 0.00 0.00 0.00 47.33 46.91 1tvn h GLY 264 CO 0.43 0.05 0.00 0.00 0.00 0.00 0.00 176.54 177.02 1tvn h ALA 265 N 1.70 1.00 -2.85 3.60 0.00 -1.16 -3.40 119.26 118.15 1tvn h ALA 265 Ca 0.29 0.00 -0.52 0.00 0.00 0.00 0.00 54.91 54.67 1tvn h ALA 265 Cb 0.78 0.00 0.07 0.00 0.00 0.00 0.00 17.79 18.63 1tvn h ALA 265 CO -0.06 0.00 0.67 -1.12 0.00 0.00 0.00 179.25 178.74 1tvn s SER 266 N -5.31 6.72 0.30 0.00 0.01 -0.93 -1.37 113.70 113.11 1tvn s SER 266 Ca 0.03 2.71 0.09 0.00 1.31 0.00 0.00 55.95 60.09 1tvn s SER 266 Cb 0.09 -2.64 0.45 0.00 0.21 0.00 0.00 66.02 64.12 1tvn s SER 266 CO 0.52 -0.59 1.67 -0.07 0.41 0.00 0.00 173.24 175.18 1tvn h LEU 267 N 3.72 0.09 -9.40 2.44 3.38 -1.02 -3.38 115.31 111.14 1tvn h LEU 267 Ca -0.48 -0.04 -0.62 0.00 0.09 0.00 0.00 57.88 56.82 1tvn h LEU 267 Cb 1.23 -0.03 -0.13 0.00 0.09 0.00 0.00 40.66 41.82 1tvn h LEU 267 CO 0.68 0.59 -0.69 -0.36 0.09 0.00 0.00 178.44 178.75 1tvn s PHE 268 N -3.88 2.76 0.79 1.13 2.99 -1.00 -1.25 117.98 119.52 1tvn s PHE 268 Ca -0.03 -0.16 -0.11 0.00 0.00 0.00 0.00 56.93 56.63 1tvn s PHE 268 Cb 0.13 -1.36 0.07 0.00 0.00 0.00 0.00 43.02 41.85 1tvn s PHE 268 CO 0.76 0.50 1.09 0.95 -0.00 0.00 0.00 175.22 178.52 1tvn s THR 269 N -1.61 3.26 0.13 0.64 -4.23 -0.64 -4.41 115.64 108.78 1tvn s THR 269 Ca 0.25 0.41 -0.33 0.00 -1.18 0.00 0.00 61.69 60.85 1tvn s THR 269 Cb -0.10 -2.97 -0.12 0.00 1.34 0.00 0.00 72.50 70.66 1tvn s THR 269 CO 0.17 -0.53 1.73 -2.65 -0.54 0.00 0.00 174.62 172.79 1tvn n PRO 270 N -3.53 2.50 -1.66 3.99 -0.02 -1.24 -0.21 135.00 134.83 1tvn n PRO 270 Ca 0.08 0.91 -0.10 0.00 -2.02 0.00 0.00 63.50 62.36 1tvn n PRO 270 Cb 0.54 -2.74 -0.03 0.00 -0.02 0.00 0.00 33.50 31.25 1tvn n PRO 270 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1tvn n GLY 271 N 3.92 0.69 3.80 -1.23 0.00 -1.26 -4.99 105.19 106.12 1tvn n GLY 271 Ca 0.18 -0.51 -0.32 0.00 0.00 0.00 0.00 46.02 45.36 1tvn n GLY 271 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1tvn s GLY 272 N -2.75 2.95 0.00 -0.02 0.00 0.71 -5.13 107.32 103.08 1tvn s GLY 272 Ca 0.00 -0.36 0.00 0.00 0.00 0.00 0.00 44.72 44.36 1tvn s GLY 272 CO 0.00 -2.16 0.00 -1.26 0.00 0.00 0.00 173.10 169.68 1tvn n SER 273 N -1.39 0.00 -0.26 1.64 2.88 -1.26 -4.69 113.62 110.53 1tvn n SER 273 Ca -0.17 0.00 0.29 0.00 -1.33 0.00 0.00 58.87 57.66 1tvn n SER 273 Cb 0.66 0.00 0.68 0.00 -0.75 0.00 0.00 64.21 64.80 1tvn n SER 273 CO 0.00 0.00 0.00 -0.50 -1.23 0.00 0.00 175.04 173.31 1tvn h TRP 274 N 0.00 0.17 -0.37 0.66 4.06 -2.00 -0.07 115.95 118.39 1tvn h TRP 274 Ca 0.00 0.01 0.00 0.00 2.06 0.00 0.00 58.89 60.96 1tvn h TRP 274 Cb 0.00 -0.05 0.00 0.00 -1.00 0.00 0.00 29.16 28.11 1tvn h TRP 274 CO 0.00 0.02 0.00 0.27 -3.56 0.00 0.00 178.44 175.17 1tvn n ASN 275 N -4.32 2.53 -3.18 -3.49 6.94 -1.26 -4.47 115.26 108.00 1tvn n ASN 275 Ca 0.22 -1.91 -0.22 0.00 -0.02 0.00 0.00 54.58 52.66 1tvn n ASN 275 Cb 1.03 -0.24 -0.06 0.00 -2.36 0.00 0.00 39.78 38.14 1tvn n ASN 275 CO 0.00 0.00 0.00 -0.24 -1.03 0.00 0.00 177.26 175.99 1tvn n SER 276 N 0.88 -0.77 -4.84 0.53 2.88 -0.04 -5.13 113.62 107.14 1tvn n SER 276 Ca 0.17 -2.65 -0.34 0.00 -1.33 0.00 0.00 58.87 54.72 1tvn n SER 276 Cb 0.43 -0.11 -0.06 0.00 -0.75 0.00 0.00 64.21 63.72 1tvn n SER 276 CO 0.00 0.00 0.00 -0.76 -1.23 0.00 0.00 175.04 173.05 1tvn s LEU 277 N -0.44 4.21 0.94 2.46 1.43 -1.26 -1.61 118.68 124.42 1tvn s LEU 277 Ca 0.33 1.28 -0.14 0.00 -1.03 0.00 0.00 54.13 54.58 1tvn s LEU 277 Cb 0.11 -3.76 0.20 0.00 0.03 0.00 0.00 46.19 42.77 1tvn s LEU 277 CO -0.15 -0.06 1.28 0.42 0.23 0.00 0.00 176.35 178.07 1tvn s THR 278 N -1.73 2.01 0.27 5.49 -4.23 -0.38 -4.75 115.64 112.33 1tvn s THR 278 Ca 0.47 -0.09 -0.03 0.00 -1.18 0.00 0.00 61.69 60.86 1tvn s THR 278 Cb -0.13 -2.92 0.23 0.00 1.34 0.00 0.00 72.50 71.01 1tvn s THR 278 CO 0.19 0.00 1.91 0.28 -0.54 0.00 0.00 174.62 176.46 1tvn h SER 279 N -1.51 0.98 -0.35 3.99 0.02 -1.90 -0.63 113.55 114.16 1tvn h SER 279 Ca -0.43 -0.07 -0.05 0.00 -0.84 0.00 0.00 61.79 60.40 1tvn h SER 279 Cb 1.23 -0.25 -0.01 0.00 0.14 0.00 0.00 62.40 63.51 1tvn h SER 279 CO 0.37 0.77 0.03 -1.28 -1.14 0.00 0.00 176.83 175.58 1tvn h SER 280 N 1.12 0.57 -0.82 3.07 0.87 -1.84 -2.39 113.55 114.12 1tvn h SER 280 Ca 0.29 -0.28 0.09 0.00 -1.23 0.00 0.00 61.79 60.66 1tvn h SER 280 Cb -0.01 -0.15 -0.07 0.00 -0.44 0.00 0.00 62.40 61.73 1tvn h SER 280 CO -0.05 0.71 0.47 1.23 -0.53 0.00 0.00 176.83 178.66 1tvn h GLY 281 N 0.41 1.27 1.02 5.77 0.00 -1.51 0.10 103.07 110.14 1tvn h GLY 281 Ca 0.10 -0.32 -0.07 0.00 0.00 0.00 0.00 47.33 47.05 1tvn h GLY 281 CO 0.01 0.14 0.10 1.76 0.00 0.00 0.00 176.54 178.56 1tvn h SER 282 N 0.80 0.91 -0.34 0.19 0.02 -0.98 0.00 113.55 114.16 1tvn h SER 282 Ca 0.39 -0.26 -0.08 0.00 -0.84 0.00 0.00 61.79 61.00 1tvn h SER 282 Cb 0.34 -0.24 -0.01 0.00 0.14 0.00 0.00 62.40 62.63 1tvn h SER 282 CO -0.24 0.94 -0.11 0.50 -1.14 0.00 0.00 176.83 176.78 1tvn h LYS 283 N 0.85 0.68 -0.60 3.45 1.63 -0.85 -2.27 116.57 119.46 1tvn h LYS 283 Ca 0.18 -0.27 -0.04 0.00 -0.85 0.00 0.00 60.65 59.66 1tvn h LYS 283 Cb 0.41 -0.03 -0.03 0.00 -0.60 0.00 0.00 32.23 31.98 1tvn h LYS 283 CO 0.01 0.86 0.20 0.28 -3.45 0.00 0.00 179.45 177.35 1tvn h VAL 284 N 0.46 1.24 -0.70 2.00 2.07 -0.71 -1.68 116.25 118.94 1tvn h VAL 284 Ca 0.08 -0.80 0.03 0.00 0.82 0.00 0.00 66.70 66.83 1tvn h VAL 284 Cb 0.62 0.63 -0.04 0.00 -1.52 0.00 0.00 31.29 30.98 1tvn h VAL 284 CO 0.04 0.30 0.45 0.50 0.02 0.00 0.00 177.57 178.88 1tvn h LYS 285 N 0.84 0.85 -0.53 1.57 3.64 -0.90 -0.60 116.57 121.45 1tvn h LYS 285 Ca 0.19 -0.05 0.02 0.00 -1.27 0.00 0.00 60.65 59.54 1tvn h LYS 285 Cb 0.27 -0.19 -0.03 0.00 -0.41 0.00 0.00 32.23 31.86 1tvn h LYS 285 CO -0.01 0.57 0.33 1.49 -2.27 0.00 0.00 179.45 179.55 1tvn h GLU 286 N 0.88 0.63 0.01 1.90 4.81 -0.88 0.75 114.58 122.68 1tvn h GLU 286 Ca 0.28 -0.04 -0.00 0.00 -0.13 0.00 0.00 59.36 59.47 1tvn h GLU 286 Cb -0.01 -0.14 0.00 0.00 0.63 0.00 0.00 28.75 29.23 1tvn h GLU 286 CO -0.10 0.42 -0.00 0.82 -0.73 0.00 0.00 179.01 179.42 1tvn h ILE 287 N 0.65 1.17 -0.58 2.32 2.04 -0.84 -2.81 117.51 119.46 1tvn h ILE 287 Ca 0.21 -0.55 -0.11 0.00 1.00 0.00 0.00 64.86 65.41 1tvn h ILE 287 Cb -0.01 1.55 -0.02 0.00 -0.74 0.00 0.00 36.82 37.60 1tvn h ILE 287 CO -0.08 0.14 -0.05 0.40 0.00 0.00 0.00 178.15 178.56 1tvn h ILE 288 N -0.25 1.27 -0.24 -0.67 2.04 -1.03 -2.09 117.51 116.54 1tvn h ILE 288 Ca -0.00 -1.22 -0.02 0.00 1.00 0.00 0.00 64.86 64.63 1tvn h ILE 288 Cb 0.24 0.87 -0.01 0.00 -0.74 0.00 0.00 36.82 37.18 1tvn h ILE 288 CO 0.00 0.44 0.08 1.56 0.00 0.00 0.00 178.15 180.23 1tvn h GLN 289 N 0.96 0.33 -0.64 2.37 4.20 -0.37 -2.28 115.11 119.68 1tvn h GLN 289 Ca 0.16 -0.04 0.00 0.00 0.06 0.00 0.00 58.65 58.83 1tvn h GLN 289 Cb 0.62 -0.07 0.00 0.00 0.30 0.00 0.00 27.48 28.34 1tvn h GLN 289 CO 0.04 0.30 0.00 0.41 -0.67 0.00 0.00 178.83 178.91 1tvn n GLY 290 N -1.28 2.62 0.28 3.46 0.00 -1.06 -4.54 105.19 104.68 1tvn n GLY 290 Ca 0.01 -0.73 -0.11 0.00 0.00 0.00 0.00 46.02 45.18 1tvn n GLY 290 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 173.32 173.07 1tvn h TRP 291 N 3.81 1.11 0.00 1.61 2.91 -0.76 -3.47 115.95 121.16 1tvn h TRP 291 Ca 0.00 -0.27 0.00 0.00 1.13 0.00 0.00 58.89 59.75 1tvn h TRP 291 Cb 1.03 -0.26 0.00 0.00 -0.51 0.00 0.00 29.16 29.42 1tvn h TRP 291 CO 0.49 1.09 0.00 0.41 -1.03 0.00 0.00 178.44 179.40 1tvn n GLY 292 N -0.12 0.32 0.00 2.65 0.00 -1.26 -5.05 105.19 101.74 1tvn n GLY 292 Ca 0.00 0.00 0.14 0.00 0.00 0.00 0.00 46.02 46.16 1tvn n GLY 292 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93