#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 3.54 0.34 0.00 -7.23 -1.26 -4.98 120.40 110.81 1tvn s VAL 2 Ca 0.00 -1.83 -0.26 0.00 -1.81 0.00 0.00 61.98 58.08 1tvn s VAL 2 Cb 0.00 -2.88 -0.09 0.00 0.56 0.00 0.00 36.38 33.96 1tvn s VAL 2 CO 0.00 -0.35 1.01 -1.61 -0.31 0.00 0.00 175.10 173.84 1tvn s GLU 3 N -3.62 4.46 0.23 4.82 0.41 -1.26 -4.89 118.70 118.85 1tvn s GLU 3 Ca 0.31 1.50 -0.30 0.00 -0.41 0.00 0.00 54.97 56.07 1tvn s GLU 3 Cb -0.07 -2.82 -0.09 0.00 -1.78 0.00 0.00 34.13 29.38 1tvn s GLU 3 CO 0.20 0.13 1.32 0.21 -0.49 0.00 0.00 175.26 176.63 1tvn s LYS 4 N -2.03 4.38 -0.12 1.61 2.20 -1.26 -4.59 119.74 119.92 1tvn s LYS 4 Ca 0.51 2.10 -0.14 0.00 -0.36 0.00 0.00 55.97 58.08 1tvn s LYS 4 Cb -0.23 -3.17 -0.05 0.00 -1.51 0.00 0.00 37.83 32.88 1tvn s LYS 4 CO 0.29 -0.25 0.32 -0.51 -0.36 0.00 0.00 175.35 174.84 1tvn s LEU 5 N -0.42 4.30 0.16 5.43 1.43 -1.26 -0.81 118.68 127.50 1tvn s LEU 5 Ca 0.55 0.61 -0.00 0.00 -1.03 0.00 0.00 54.13 54.26 1tvn s LEU 5 Cb -0.37 -2.41 -0.04 0.00 0.03 0.00 0.00 46.19 43.39 1tvn s LEU 5 CO 0.41 0.16 0.06 0.42 0.23 0.00 0.00 176.35 177.63 1tvn s THR 6 N 0.08 0.20 -0.09 5.49 -4.23 -0.54 -4.43 115.64 112.12 1tvn s THR 6 Ca 0.18 -1.94 0.04 0.00 -1.18 0.00 0.00 61.69 58.79 1tvn s THR 6 Cb -0.14 -2.16 -0.01 0.00 1.34 0.00 0.00 72.50 71.53 1tvn s THR 6 CO 0.06 -0.37 -0.21 -0.69 -0.54 0.00 0.00 174.62 172.88 1tvn s VAL 7 N -3.99 2.41 -0.19 2.29 1.01 -1.26 -0.19 120.40 120.48 1tvn s VAL 7 Ca 0.27 -0.91 -0.02 0.00 0.00 0.00 0.00 61.98 61.31 1tvn s VAL 7 Cb 0.07 -1.93 0.06 0.00 0.00 0.00 0.00 36.38 34.57 1tvn s VAL 7 CO 0.04 0.56 0.02 -0.55 0.00 0.00 0.00 175.10 175.17 1tvn s SER 8 N 0.10 2.88 1.58 3.32 0.15 -0.03 -4.66 113.70 117.03 1tvn s SER 8 Ca -0.10 -0.78 0.00 0.00 0.70 0.00 0.00 55.95 55.77 1tvn s SER 8 Cb -0.16 -0.65 0.00 0.00 -1.71 0.00 0.00 66.02 63.51 1tvn s SER 8 CO 0.06 -0.28 0.00 0.61 1.20 0.00 0.00 173.24 174.82 1tvn n GLY 9 N 5.02 3.13 1.54 9.45 0.00 -1.26 -1.72 105.19 121.35 1tvn n GLY 9 Ca -0.09 -0.24 0.05 0.00 0.00 0.00 0.00 46.02 45.74 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 3.92 4.52 -4.31 1.61 0.23 -1.23 -3.99 115.26 116.00 1tvn n ASN 10 Ca 0.00 -2.69 -0.30 0.00 -0.53 0.00 0.00 54.58 51.06 1tvn n ASN 10 Cb 0.00 -0.64 -0.15 0.00 -2.08 0.00 0.00 39.78 36.91 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 -2.31 1.91 -0.26 -3.83 -1.52 -0.70 -4.13 119.66 108.81 1tvn s GLN 11 Ca 0.40 -0.97 -0.10 0.00 -1.95 0.00 0.00 55.36 52.74 1tvn s GLN 11 Cb 0.31 -1.93 -0.05 0.00 -0.22 0.00 0.00 33.01 31.12 1tvn s GLN 11 CO 0.12 0.52 0.16 0.42 -0.25 0.00 0.00 175.29 176.26 1tvn s ILE 12 N -0.67 5.15 0.03 1.08 1.01 -1.26 -0.85 121.20 125.68 1tvn s ILE 12 Ca 0.10 0.11 -0.00 0.00 0.00 0.00 0.00 60.65 60.86 1tvn s ILE 12 Cb -0.10 -3.43 -0.04 0.00 0.01 0.00 0.00 42.46 38.90 1tvn s ILE 12 CO 0.00 0.29 0.13 -0.76 0.00 0.00 0.00 174.94 174.61 1tvn s LEU 13 N 1.55 4.10 -0.25 2.97 1.43 0.73 -4.44 118.68 124.77 1tvn s LEU 13 Ca 0.07 0.19 0.01 0.00 -1.03 0.00 0.00 54.13 53.38 1tvn s LEU 13 Cb -0.15 -2.55 0.05 0.00 0.03 0.00 0.00 46.19 43.56 1tvn s LEU 13 CO 0.08 0.23 -0.11 0.00 0.23 0.00 0.00 176.35 176.78 1tvn s ALA 14 N -1.34 2.56 -1.51 4.21 0.00 -0.43 -1.46 121.76 123.80 1tvn s ALA 14 Ca 0.28 -1.61 -0.00 0.00 0.00 0.00 0.00 51.96 50.62 1tvn s ALA 14 Cb -0.12 -1.55 0.00 0.00 0.00 0.00 0.00 23.12 21.44 1tvn s ALA 14 CO 0.20 -0.98 0.03 0.41 0.00 0.00 0.00 175.76 175.42 1tvn n GLY 15 N 4.52 -0.36 2.92 0.00 0.00 0.01 -1.81 105.19 110.47 1tvn n GLY 15 Ca -0.16 -0.13 0.00 0.00 0.00 0.00 0.00 46.02 45.73 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 -1.04 0.88 3.58 -0.02 0.00 -1.26 -5.02 105.19 102.30 1tvn n GLY 16 Ca -0.20 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.57 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 2.07 -0.17 1.61 0.41 -0.75 -5.01 118.70 116.80 1tvn s GLU 17 Ca 0.00 -1.43 -0.29 0.00 -0.41 0.00 0.00 54.97 52.84 1tvn s GLU 17 Cb 0.00 -2.08 -0.00 0.00 -1.78 0.00 0.00 34.13 30.27 1tvn s GLU 17 CO 0.00 0.39 1.00 -0.80 -0.49 0.00 0.00 175.26 175.35 1tvn s ASN 18 N -3.30 7.14 0.18 -0.19 -0.87 -1.26 -1.31 114.94 115.33 1tvn s ASN 18 Ca 0.28 1.42 -0.22 0.00 -1.57 0.00 0.00 52.86 52.77 1tvn s ASN 18 Cb -0.07 -2.54 0.08 0.00 -0.02 0.00 0.00 41.25 38.70 1tvn s ASN 18 CO 0.17 -0.54 1.05 0.28 -2.57 0.00 0.00 177.10 175.49 1tvn s THR 19 N 2.55 0.00 0.18 1.60 -1.32 -1.26 -4.99 115.64 112.40 1tvn s THR 19 Ca 0.45 -0.56 -0.15 0.00 -1.21 0.00 0.00 61.69 60.22 1tvn s THR 19 Cb -0.17 -2.90 0.02 0.00 -1.51 0.00 0.00 72.50 67.94 1tvn s THR 19 CO 0.12 0.00 0.45 -0.94 -2.21 0.00 0.00 174.62 172.04 1tvn s SER 20 N -3.43 -0.18 0.11 8.08 1.04 -1.26 -4.77 113.70 113.29 1tvn s SER 20 Ca 0.22 -0.55 0.05 0.00 0.48 0.00 0.00 55.95 56.15 1tvn s SER 20 Cb -0.03 0.53 -0.04 0.00 0.10 0.00 0.00 66.02 66.59 1tvn s SER 20 CO 0.05 -0.99 -0.12 -0.36 0.98 0.00 0.00 173.24 172.80 1tvn s PHE 21 N -3.89 1.26 0.02 5.02 0.08 -1.26 -4.99 117.98 114.22 1tvn s PHE 21 Ca 0.10 -0.61 0.01 0.00 0.12 0.00 0.00 56.93 56.56 1tvn s PHE 21 Cb 0.00 -0.67 -0.01 0.00 -0.57 0.00 0.00 43.02 41.77 1tvn s PHE 21 CO -0.03 0.09 -0.05 0.00 -0.10 0.00 0.00 175.22 175.13 1tvn s ALA 22 N -2.34 0.37 0.12 5.36 0.00 -1.26 -1.40 121.76 122.61 1tvn s ALA 22 Ca 0.08 -0.44 -0.24 0.00 0.00 0.00 0.00 51.96 51.36 1tvn s ALA 22 Cb -0.04 0.00 0.08 0.00 0.00 0.00 0.00 23.12 23.17 1tvn s ALA 22 CO 0.02 0.00 1.12 0.20 0.00 0.00 0.00 175.76 177.10 1tvn s GLY 23 N -0.83 0.07 0.16 0.00 0.00 -0.94 -1.83 107.32 103.94 1tvn s GLY 23 Ca -0.05 -0.27 -0.04 0.00 0.00 0.00 0.00 44.72 44.35 1tvn s GLY 23 CO -0.00 3.74 0.39 2.56 0.00 0.00 0.00 173.10 179.80 1tvn s PRO 24 N -2.05 3.61 -0.17 2.90 0.04 -1.25 -1.89 135.00 136.20 1tvn s PRO 24 Ca 0.25 -0.10 -0.08 0.00 0.04 0.00 0.00 61.00 61.12 1tvn s PRO 24 Cb -0.02 -2.83 -0.04 0.00 0.04 0.00 0.00 34.50 31.65 1tvn s PRO 24 CO 0.04 0.44 0.09 0.45 0.04 0.00 0.00 177.00 178.06 1tvn s SER 25 N -2.55 5.93 0.64 6.66 0.15 0.93 -1.97 113.70 123.48 1tvn s SER 25 Ca 0.41 0.21 -0.13 0.00 0.70 0.00 0.00 55.95 57.13 1tvn s SER 25 Cb -0.12 -1.99 -0.01 0.00 -1.71 0.00 0.00 66.02 62.19 1tvn s SER 25 CO 0.25 0.24 1.06 -0.76 1.20 0.00 0.00 173.24 175.23 1tvn s LEU 26 N 0.01 3.33 0.93 3.45 1.43 -0.00 -0.62 118.68 127.20 1tvn s LEU 26 Ca 0.08 1.72 -0.14 0.00 -1.03 0.00 0.00 54.13 54.76 1tvn s LEU 26 Cb -0.12 -4.52 0.15 0.00 0.03 0.00 0.00 46.19 41.74 1tvn s LEU 26 CO 0.00 -1.30 1.18 0.12 0.23 0.00 0.00 176.35 176.58 1tvn s PHE 27 N -2.73 2.19 0.16 0.29 5.36 -1.19 -4.34 117.98 117.71 1tvn s PHE 27 Ca 0.61 0.67 -0.31 0.00 -0.96 0.00 0.00 56.93 56.94 1tvn s PHE 27 Cb -0.15 -3.58 -0.17 0.00 -0.34 0.00 0.00 43.02 38.77 1tvn s PHE 27 CO 0.45 -2.46 0.73 0.91 -1.46 0.00 0.00 175.22 173.38 1tvn n TRP 28 N -3.78 0.01 1.27 10.12 7.02 -1.26 -4.44 117.44 126.38 1tvn n TRP 28 Ca 0.09 0.95 0.14 0.00 -1.02 0.00 0.00 57.50 57.67 1tvn n TRP 28 Cb 0.60 -2.03 0.60 0.00 -2.42 0.00 0.00 31.31 28.06 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 1.83 0.26 -4.51 -0.99 3.41 -0.14 -4.48 113.62 108.99 1tvn n SER 29 Ca 0.18 -0.19 -0.50 0.00 -0.26 0.00 0.00 58.87 58.10 1tvn n SER 29 Cb 0.21 -0.18 -0.04 0.00 -0.26 0.00 0.00 64.21 63.94 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 -1.22 0.34 -4.69 4.04 4.13 -1.26 -4.65 115.26 111.94 1tvn n ASN 30 Ca 0.12 1.15 -0.42 0.00 1.68 0.00 0.00 54.58 57.10 1tvn n ASN 30 Cb 0.29 -1.09 -0.03 0.00 -1.54 0.00 0.00 39.78 37.41 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 -0.49 3.08 0.00 3.41 2.01 -0.56 -1.91 115.64 121.18 1tvn s THR 31 Ca 0.72 0.59 0.00 0.00 0.31 0.00 0.00 61.69 63.31 1tvn s THR 31 Cb -0.94 -3.38 0.00 0.00 0.01 0.00 0.00 72.50 68.20 1tvn s THR 31 CO 0.55 0.01 0.00 0.61 -0.69 0.00 0.00 174.62 175.10 1tvn n GLY 32 N 3.88 0.64 0.76 4.40 0.00 -1.26 -4.16 105.19 109.45 1tvn n GLY 32 Ca 0.15 0.00 0.12 0.00 0.00 0.00 0.00 46.02 46.29 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 0.14 -0.37 1.61 7.02 -0.80 -4.98 117.44 118.07 1tvn n TRP 33 Ca 0.00 -0.07 0.00 0.00 -1.02 0.00 0.00 57.50 56.41 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 1.28 1.88 0.99 6.99 0.00 -1.26 -4.88 105.19 110.19 1tvn n GLY 34 Ca 0.17 0.00 0.11 0.00 0.00 0.00 0.00 46.02 46.30 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 0.09 2.43 -0.24 4.61 0.00 -1.26 -4.41 120.51 121.74 1tvn n ALA 35 Ca 0.00 -0.84 0.10 0.00 0.00 0.00 0.00 53.44 52.70 1tvn n ALA 35 Cb 0.00 -0.78 0.37 0.00 0.00 0.00 0.00 19.45 19.04 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 4.25 0.69 0.00 0.00 3.07 -1.83 -0.57 114.58 120.19 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 0.93 -0.16 0.00 0.00 -0.84 0.00 0.00 28.75 28.69 1tvn h GLU 36 CO 0.00 0.46 0.00 0.36 -1.40 0.00 0.00 179.01 178.43 1tvn n LYS 37 N -4.52 0.03 0.00 2.33 2.85 -1.26 -1.97 118.16 115.62 1tvn n LYS 37 Ca 0.15 0.44 0.10 0.00 -1.05 0.00 0.00 58.31 57.95 1tvn n LYS 37 Cb 0.38 -1.58 -0.08 0.00 -0.65 0.00 0.00 35.03 33.09 1tvn n LYS 37 CO 0.00 0.00 0.00 1.19 -0.05 0.00 0.00 177.40 178.54 1tvn n PHE 38 N -1.64 0.00 -2.13 5.58 3.01 -0.22 -4.61 117.46 117.44 1tvn n PHE 38 Ca 0.01 0.00 -0.42 0.00 1.01 0.00 0.00 57.45 58.05 1tvn n PHE 38 Cb 0.07 0.00 0.00 0.00 -0.01 0.00 0.00 39.48 39.54 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 -1.07 3.04 -4.15 1.38 4.02 -0.83 -4.64 117.16 114.91 1tvn n TYR 39 Ca 0.05 -2.84 -0.10 0.00 -0.01 0.00 0.00 57.90 55.01 1tvn n TYR 39 Cb 0.36 -2.11 -0.10 0.00 -0.02 0.00 0.00 39.34 37.47 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 1.04 0.41 0.29 -0.72 -4.23 -1.26 -4.66 115.64 106.51 1tvn s THR 40 Ca 0.43 -1.89 0.02 0.00 -1.18 0.00 0.00 61.69 59.07 1tvn s THR 40 Cb 0.12 -1.75 0.11 0.00 1.34 0.00 0.00 72.50 72.31 1tvn s THR 40 CO -0.03 -0.79 1.78 0.00 -0.54 0.00 0.00 174.62 175.04 1tvn h ALA 41 N 2.98 1.18 -0.40 3.99 0.00 -1.90 -2.20 119.26 122.91 1tvn h ALA 41 Ca -0.35 -0.28 0.01 0.00 0.00 0.00 0.00 54.91 54.29 1tvn h ALA 41 Cb 1.17 -0.15 -0.02 0.00 0.00 0.00 0.00 17.79 18.79 1tvn h ALA 41 CO 0.64 0.52 0.26 1.49 0.00 0.00 0.00 179.25 182.16 1tvn h GLU 42 N 0.52 0.52 -0.61 0.00 4.57 -1.96 -1.30 114.58 116.32 1tvn h GLU 42 Ca 0.09 -0.03 -0.08 0.00 -1.18 0.00 0.00 59.36 58.16 1tvn h GLU 42 Cb 0.51 -0.12 -0.02 0.00 -0.16 0.00 0.00 28.75 28.96 1tvn h GLU 42 CO 0.03 0.34 0.07 1.15 -1.18 0.00 0.00 179.01 179.42 1tvn h THR 43 N 0.53 1.26 -0.54 0.32 2.02 -1.74 -0.95 112.91 113.81 1tvn h THR 43 Ca 0.15 -1.05 -0.04 0.00 0.77 0.00 0.00 66.41 66.24 1tvn h THR 43 Cb -0.05 0.74 -0.02 0.00 -1.74 0.00 0.00 68.15 67.08 1tvn h THR 43 CO -0.04 0.39 0.18 0.58 0.37 0.00 0.00 175.52 176.99 1tvn h VAL 44 N 0.94 1.23 -0.73 3.16 2.07 -1.13 -1.13 116.25 120.65 1tvn h VAL 44 Ca 0.18 -0.77 -0.01 0.00 0.82 0.00 0.00 66.70 66.92 1tvn h VAL 44 Cb 0.47 0.72 -0.03 0.00 -1.52 0.00 0.00 31.29 30.92 1tvn h VAL 44 CO 0.02 0.29 0.40 0.00 0.02 0.00 0.00 177.57 178.29 1tvn h ALA 45 N 1.04 0.94 -0.31 1.67 0.00 -1.03 -2.56 119.26 119.00 1tvn h ALA 45 Ca 0.17 -0.12 -0.09 0.00 0.00 0.00 0.00 54.91 54.88 1tvn h ALA 45 Cb 0.26 -0.29 -0.02 0.00 0.00 0.00 0.00 17.79 17.75 1tvn h ALA 45 CO -0.01 0.45 -0.16 0.87 0.00 0.00 0.00 179.25 180.40 1tvn h LYS 46 N 1.01 0.56 -0.63 0.00 1.79 -0.79 -0.40 116.57 118.11 1tvn h LYS 46 Ca 0.26 -0.18 0.00 0.00 -2.18 0.00 0.00 60.65 58.55 1tvn h LYS 46 Cb 0.04 -0.05 -0.03 0.00 -1.58 0.00 0.00 32.23 30.61 1tvn h LYS 46 CO -0.04 0.70 0.41 0.00 -1.08 0.00 0.00 179.45 179.44 1tvn h ALA 47 N 1.32 1.53 0.05 3.86 0.00 -0.80 0.28 119.26 125.49 1tvn h ALA 47 Ca 0.09 -0.05 -0.00 0.00 0.00 0.00 0.00 54.91 54.94 1tvn h ALA 47 Cb 0.58 -0.26 0.00 0.00 0.00 0.00 0.00 17.79 18.11 1tvn h ALA 47 CO 0.04 0.43 -0.02 -0.22 0.00 0.00 0.00 179.25 179.47 1tvn h LYS 48 N 0.86 -0.06 -0.23 0.00 3.64 -1.23 -2.34 116.57 117.21 1tvn h LYS 48 Ca 0.23 0.00 -0.10 0.00 -1.27 0.00 0.00 60.65 59.52 1tvn h LYS 48 Cb -0.09 0.01 -0.01 0.00 -0.41 0.00 0.00 32.23 31.73 1tvn h LYS 48 CO -0.05 0.57 -0.28 1.79 -2.27 0.00 0.00 179.45 179.22 1tvn h THR 49 N -0.81 1.27 0.03 1.00 1.35 -0.91 0.14 112.91 114.98 1tvn h THR 49 Ca -0.01 -1.31 -0.12 0.00 -0.55 0.00 0.00 66.41 64.42 1tvn h THR 49 Cb 0.66 1.40 -0.01 0.00 -1.73 0.00 0.00 68.15 68.47 1tvn h THR 49 CO 0.01 0.41 -0.62 -0.33 -0.25 0.00 0.00 175.52 174.74 1tvn h GLU 50 N 0.40 0.07 -0.01 4.72 4.39 -0.59 -3.41 114.58 120.15 1tvn h GLU 50 Ca 0.06 -0.12 0.00 0.00 0.34 0.00 0.00 59.36 59.63 1tvn h GLU 50 Cb 0.70 0.05 0.00 0.00 -0.10 0.00 0.00 28.75 29.39 1tvn h GLU 50 CO 0.05 1.06 -0.46 1.19 -1.16 0.00 0.00 179.01 179.69 1tvn n PHE 51 N -4.41 0.00 -2.78 4.33 3.01 -0.96 -4.98 117.46 111.67 1tvn n PHE 51 Ca -0.18 0.00 -0.17 0.00 1.01 0.00 0.00 57.45 58.11 1tvn n PHE 51 Cb 0.63 0.00 0.02 0.00 -0.01 0.00 0.00 39.48 40.13 1tvn n PHE 51 CO 0.00 0.00 0.00 -1.71 1.01 0.00 0.00 176.76 176.06 1tvn n ASN 52 N -0.49 -4.95 -4.77 4.37 2.85 0.50 -2.81 115.26 109.97 1tvn n ASN 52 Ca 0.06 -0.20 -0.39 0.00 -0.11 0.00 0.00 54.58 53.94 1tvn n ASN 52 Cb 0.31 -3.83 -0.01 0.00 1.24 0.00 0.00 39.78 37.49 1tvn n ASN 52 CO 0.00 0.00 0.00 0.00 -2.11 0.00 0.00 177.26 175.15 1tvn s ALA 53 N -2.99 3.26 -1.62 5.20 0.00 -0.92 -4.83 121.76 119.84 1tvn s ALA 53 Ca 0.21 1.15 0.14 0.00 0.00 0.00 0.00 51.96 53.46 1tvn s ALA 53 Cb -0.09 -3.45 0.07 0.00 0.00 0.00 0.00 23.12 19.65 1tvn s ALA 53 CO 0.25 -0.70 0.89 0.25 0.00 0.00 0.00 175.76 176.45 1tvn n THR 54 N 0.21 0.00 -3.74 0.00 -2.24 -0.76 -4.50 114.28 103.25 1tvn n THR 54 Ca 0.03 -0.44 -0.10 0.00 -2.27 0.00 0.00 64.05 61.27 1tvn n THR 54 Cb 0.44 1.25 -0.05 0.00 -2.10 0.00 0.00 70.33 69.88 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 -1.48 0.38 -0.09 3.22 0.05 -1.25 -1.41 118.68 118.11 1tvn s LEU 55 Ca 0.15 -0.49 -0.08 0.00 0.05 0.00 0.00 54.13 53.76 1tvn s LEU 55 Cb 0.12 1.84 0.02 0.00 -2.05 0.00 0.00 46.19 46.12 1tvn s LEU 55 CO 0.25 -0.95 0.23 -0.51 -0.55 0.00 0.00 176.35 174.83 1tvn s ILE 56 N -3.86 -0.00 -0.18 1.48 2.07 -0.57 -3.75 121.20 116.38 1tvn s ILE 56 Ca 0.08 0.00 -0.05 0.00 -1.41 0.00 0.00 60.65 59.27 1tvn s ILE 56 Cb 0.01 -0.33 -0.03 0.00 0.13 0.00 0.00 42.46 42.24 1tvn s ILE 56 CO -0.06 0.00 0.00 -0.60 -1.91 0.00 0.00 174.94 172.38 1tvn s ARG 57 N 0.13 3.70 -0.46 3.50 3.52 -0.83 -1.04 118.95 127.48 1tvn s ARG 57 Ca -0.00 -0.48 -0.14 0.00 -0.13 0.00 0.00 55.73 54.97 1tvn s ARG 57 Cb -0.02 -3.06 0.07 0.00 -1.56 0.00 0.00 34.95 30.38 1tvn s ARG 57 CO 0.00 0.12 0.36 0.00 -0.81 0.00 0.00 175.30 174.98 1tvn s ALA 58 N 0.71 3.50 -1.05 6.12 0.00 -0.14 -0.82 121.76 130.07 1tvn s ALA 58 Ca 0.00 -2.11 -0.18 0.00 0.00 0.00 0.00 51.96 49.67 1tvn s ALA 58 Cb -0.14 -2.97 0.12 0.00 0.00 0.00 0.00 23.12 20.13 1tvn s ALA 58 CO 0.02 -1.70 1.32 0.00 0.00 0.00 0.00 175.76 175.40 1tvn s ALA 59 N 1.59 3.39 -0.57 0.00 0.00 -1.26 -1.56 121.76 123.36 1tvn s ALA 59 Ca 0.04 -2.83 -0.27 0.00 0.00 0.00 0.00 51.96 48.89 1tvn s ALA 59 Cb -0.24 -4.22 0.03 0.00 0.00 0.00 0.00 23.12 18.69 1tvn s ALA 59 CO 0.06 -3.08 1.13 0.42 0.00 0.00 0.00 175.76 174.28 1tvn s ILE 60 N 3.00 4.12 0.24 0.00 -1.09 -0.33 -0.97 121.20 126.17 1tvn s ILE 60 Ca 0.40 0.78 -0.31 0.00 -2.23 0.00 0.00 60.65 59.29 1tvn s ILE 60 Cb -0.03 -4.67 -0.13 0.00 -1.58 0.00 0.00 42.46 36.05 1tvn s ILE 60 CO -0.06 -1.26 1.53 0.61 -1.23 0.00 0.00 174.94 174.53 1tvn n GLY 61 N 5.06 1.10 2.96 6.18 0.00 -1.26 -0.68 105.19 118.55 1tvn n GLY 61 Ca 0.07 0.52 -0.15 0.00 0.00 0.00 0.00 46.02 46.46 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 0.22 0.45 0.00 1.61 2.46 -0.81 -0.71 115.29 118.51 1tvn s HIS 62 Ca 0.69 -0.13 0.00 0.00 0.47 0.00 0.00 55.06 56.09 1tvn s HIS 62 Cb -0.58 -0.29 0.00 0.00 -0.13 0.00 0.00 32.58 31.58 1tvn s HIS 62 CO 0.46 -0.02 0.00 0.41 -2.47 0.00 0.00 174.74 173.12 1tvn n GLY 63 N 2.78 2.53 0.20 1.59 0.00 -1.26 -4.44 105.19 106.59 1tvn n GLY 63 Ca -0.14 0.21 0.14 0.00 0.00 0.00 0.00 46.02 46.23 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 0.00 0.00 2.61 1.35 -1.97 -2.20 112.91 112.71 1tvn h THR 64 Ca 0.00 -0.14 0.00 0.00 -0.55 0.00 0.00 66.41 65.72 1tvn h THR 64 Cb 0.00 0.86 0.00 0.00 -1.73 0.00 0.00 68.15 67.28 1tvn h THR 64 CO 0.00 0.00 -0.08 -1.20 -0.25 0.00 0.00 175.52 173.99 1tvn n SER 65 N -2.50 1.38 -4.37 5.36 7.64 -1.26 -4.99 113.62 114.87 1tvn n SER 65 Ca -0.00 -2.08 -0.42 0.00 1.01 0.00 0.00 58.87 57.37 1tvn n SER 65 Cb 0.14 -0.15 -0.09 0.00 -1.01 0.00 0.00 64.21 63.10 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 -1.14 4.84 0.25 0.44 2.01 -0.83 -5.05 115.64 116.16 1tvn s THR 66 Ca 0.09 -1.04 -0.30 0.00 0.31 0.00 0.00 61.69 60.75 1tvn s THR 66 Cb 0.08 -3.84 -0.14 0.00 0.01 0.00 0.00 72.50 68.61 1tvn s THR 66 CO 0.01 -0.44 1.12 0.61 -0.69 0.00 0.00 174.62 175.22 1tvn n GLY 67 N 5.08 -0.00 2.63 4.40 0.00 -1.26 -2.56 105.19 113.47 1tvn n GLY 67 Ca -0.11 0.40 0.00 0.00 0.00 0.00 0.00 46.02 46.31 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 1.53 0.24 1.69 -0.02 0.00 -1.26 -4.72 105.19 102.66 1tvn n GLY 68 Ca 0.11 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 46.00 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 -0.51 0.09 0.24 1.61 3.41 -1.06 -1.50 113.62 115.90 1tvn n SER 69 Ca 0.00 -1.23 0.16 0.00 -0.26 0.00 0.00 58.87 57.54 1tvn n SER 69 Cb 0.26 -0.43 0.86 0.00 -0.26 0.00 0.00 64.21 64.63 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 0.00 1.04 3.38 -1.16 0.12 115.31 118.69 1tvn h LEU 70 Ca -0.19 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.78 1tvn h LEU 70 Cb 0.52 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.27 1tvn h LEU 70 CO 0.13 0.00 0.00 0.59 0.09 0.00 0.00 178.44 179.25 1tvn n ASN 71 N -3.86 0.00 0.00 -0.43 4.13 -1.26 -3.45 115.26 110.39 1tvn n ASN 71 Ca -0.00 0.35 0.00 0.00 1.68 0.00 0.00 54.58 56.61 1tvn n ASN 71 Cb 0.22 -0.44 0.00 0.00 -1.54 0.00 0.00 39.78 38.02 1tvn n ASN 71 CO 0.00 0.00 0.00 0.49 0.28 0.00 0.00 177.26 178.03 1tvn n PHE 72 N -1.44 0.00 -3.32 3.10 3.72 -0.02 -4.93 117.46 114.57 1tvn n PHE 72 Ca 0.07 0.00 -0.26 0.00 -0.05 0.00 0.00 57.45 57.21 1tvn n PHE 72 Cb 0.25 0.00 -0.09 0.00 -0.94 0.00 0.00 39.48 38.70 1tvn n PHE 72 CO 0.00 0.00 0.00 -3.47 -0.05 0.00 0.00 176.76 173.24 1tvn n ASP 73 N -2.03 -0.09 0.11 4.37 2.03 0.20 -4.97 116.55 116.17 1tvn n ASP 73 Ca 0.00 -2.53 -0.13 0.00 0.52 0.00 0.00 54.79 52.65 1tvn n ASP 73 Cb 0.42 -0.59 -0.07 0.00 -0.72 0.00 0.00 41.12 40.16 1tvn n ASP 73 CO 0.00 0.00 0.00 -0.25 -1.92 0.00 0.00 177.20 175.03 1tvn h TRP 74 N 4.95 -0.29 -0.20 -0.67 2.91 -1.75 -2.59 115.95 118.32 1tvn h TRP 74 Ca 0.19 0.00 0.03 0.00 1.13 0.00 0.00 58.89 60.24 1tvn h TRP 74 Cb 0.89 0.11 -0.03 0.00 -0.51 0.00 0.00 29.16 29.62 1tvn h TRP 74 CO 0.32 -0.17 0.02 1.49 -1.03 0.00 0.00 178.44 179.07 1tvn h GLU 75 N -0.26 0.09 -0.35 2.65 4.81 -1.94 -0.59 114.58 119.01 1tvn h GLU 75 Ca 0.00 -0.01 0.01 0.00 -0.13 0.00 0.00 59.36 59.23 1tvn h GLU 75 Cb 0.24 -0.02 -0.02 0.00 0.63 0.00 0.00 28.75 29.58 1tvn h GLU 75 CO -0.02 0.06 0.22 0.78 -0.73 0.00 0.00 179.01 179.32 1tvn h GLY 76 N 0.10 0.48 0.97 1.92 0.00 -1.97 0.46 103.07 105.03 1tvn h GLY 76 Ca 0.09 -0.17 -0.08 0.00 0.00 0.00 0.00 47.33 47.17 1tvn h GLY 76 CO -0.13 0.16 -0.04 3.43 0.00 0.00 0.00 176.54 179.96 1tvn h ASN 77 N 0.45 0.77 0.25 0.19 2.35 -1.36 -2.16 115.58 116.08 1tvn h ASN 77 Ca 0.13 -0.33 -0.08 0.00 -0.55 0.00 0.00 56.30 55.47 1tvn h ASN 77 Cb -0.04 -0.21 -0.01 0.00 0.05 0.00 0.00 38.32 38.12 1tvn h ASN 77 CO -0.04 0.92 -0.34 0.24 -1.65 0.00 0.00 177.43 176.56 1tvn h MET 78 N 0.60 0.13 -0.33 0.81 2.86 -0.91 -1.34 114.93 116.75 1tvn h MET 78 Ca 0.11 -0.05 -0.17 0.00 -2.06 0.00 0.00 59.70 57.53 1tvn h MET 78 Cb 0.55 -0.01 -0.00 0.00 0.06 0.00 0.00 31.60 32.20 1tvn h MET 78 CO 0.03 0.45 -0.47 1.03 1.06 0.00 0.00 176.91 179.01 1tvn h SER 79 N 0.11 0.99 -0.69 1.22 0.87 -0.76 -0.94 113.55 114.35 1tvn h SER 79 Ca 0.01 -0.49 -0.07 0.00 -1.23 0.00 0.00 61.79 60.01 1tvn h SER 79 Cb 0.65 -0.28 -0.03 0.00 -0.44 0.00 0.00 62.40 62.30 1tvn h SER 79 CO 0.05 1.29 0.17 0.03 -0.53 0.00 0.00 176.83 177.84 1tvn h ARG 80 N 0.71 1.12 -0.38 2.24 3.08 -1.12 -1.54 114.38 118.49 1tvn h ARG 80 Ca 0.04 -0.27 -0.02 0.00 0.07 0.00 0.00 59.98 59.80 1tvn h ARG 80 Cb 1.08 -0.15 -0.02 0.00 0.08 0.00 0.00 29.97 30.96 1tvn h ARG 80 CO 0.11 0.99 0.16 1.25 -1.07 0.00 0.00 179.97 181.41 1tvn h LEU 81 N 1.06 0.52 -0.76 3.04 5.85 -1.05 -2.38 115.31 121.59 1tvn h LEU 81 Ca 0.22 -0.15 0.03 0.00 0.84 0.00 0.00 57.88 58.81 1tvn h LEU 81 Cb 0.37 -0.13 -0.05 0.00 0.37 0.00 0.00 40.66 41.22 1tvn h LEU 81 CO 0.00 0.53 0.48 -0.78 -0.34 0.00 0.00 178.44 178.34 1tvn h ASP 82 N 0.47 0.80 -0.41 1.25 1.82 -0.72 0.42 116.42 120.06 1tvn h ASP 82 Ca 0.13 -0.00 -0.01 0.00 -0.39 0.00 0.00 57.03 56.75 1tvn h ASP 82 Cb 0.17 -0.18 -0.02 0.00 0.68 0.00 0.00 39.33 39.98 1tvn h ASP 82 CO -0.01 0.55 0.22 0.74 -1.61 0.00 0.00 179.24 179.13 1tvn h THR 83 N 0.94 1.16 -0.42 2.25 2.02 -1.08 -1.62 112.91 116.16 1tvn h THR 83 Ca 0.30 -0.43 -0.14 0.00 0.77 0.00 0.00 66.41 66.91 1tvn h THR 83 Cb 0.00 0.69 -0.01 0.00 -1.74 0.00 0.00 68.15 67.10 1tvn h THR 83 CO -0.11 0.17 -0.30 0.58 0.37 0.00 0.00 175.52 176.23 1tvn h VAL 84 N 0.53 1.27 -0.21 3.16 2.07 -0.92 -1.86 116.25 120.29 1tvn h VAL 84 Ca 0.14 -1.47 -0.02 0.00 0.82 0.00 0.00 66.70 66.17 1tvn h VAL 84 Cb 0.08 1.29 -0.01 0.00 -1.52 0.00 0.00 31.29 31.13 1tvn h VAL 84 CO -0.02 0.50 0.07 0.58 0.02 0.00 0.00 177.57 178.72 1tvn h VAL 85 N 0.77 1.18 -0.70 2.57 2.07 -0.83 -0.37 116.25 120.94 1tvn h VAL 85 Ca 0.08 -0.57 -0.03 0.00 0.82 0.00 0.00 66.70 67.00 1tvn h VAL 85 Cb 0.89 1.17 -0.03 0.00 -1.52 0.00 0.00 31.29 31.80 1tvn h VAL 85 CO 0.08 0.18 0.31 0.78 0.02 0.00 0.00 177.57 178.94 1tvn h ASN 86 N 0.17 0.93 -0.51 0.57 2.35 -1.29 -1.59 115.58 116.20 1tvn h ASN 86 Ca 0.07 -0.12 -0.12 0.00 -0.55 0.00 0.00 56.30 55.59 1tvn h ASN 86 Cb 0.22 -0.24 -0.02 0.00 0.05 0.00 0.00 38.32 38.33 1tvn h ASN 86 CO -0.00 0.80 -0.13 0.00 -1.65 0.00 0.00 177.43 176.45 1tvn h ALA 87 N 1.34 0.71 -0.77 -0.83 0.00 -1.05 -1.41 119.26 117.24 1tvn h ALA 87 Ca 0.24 -0.36 -0.00 0.00 0.00 0.00 0.00 54.91 54.79 1tvn h ALA 87 Cb 0.14 -0.18 -0.04 0.00 0.00 0.00 0.00 17.79 17.71 1tvn h ALA 87 CO -0.03 0.64 0.47 0.00 0.00 0.00 0.00 179.25 180.33 1tvn h ALA 88 N 0.90 0.98 -0.46 0.00 0.00 -0.62 0.66 119.26 120.73 1tvn h ALA 88 Ca 0.13 -0.09 -0.01 0.00 0.00 0.00 0.00 54.91 54.94 1tvn h ALA 88 Cb 0.70 -0.31 -0.02 0.00 0.00 0.00 0.00 17.79 18.16 1tvn h ALA 88 CO 0.05 0.45 0.26 0.82 0.00 0.00 0.00 179.25 180.83 1tvn h ILE 89 N 1.06 1.16 -0.13 0.00 2.04 -1.06 -0.42 117.51 120.17 1tvn h ILE 89 Ca 0.28 -0.41 -0.04 0.00 1.00 0.00 0.00 64.86 65.68 1tvn h ILE 89 Cb -0.04 0.60 -0.01 0.00 -0.74 0.00 0.00 36.82 36.62 1tvn h ILE 89 CO -0.05 0.17 -0.11 0.00 0.00 0.00 0.00 178.15 178.16 1tvn h ALA 90 N 1.10 1.58 -0.27 1.87 0.00 -0.45 -2.45 119.26 120.64 1tvn h ALA 90 Ca 0.16 -0.18 0.00 0.00 0.00 0.00 0.00 54.91 54.89 1tvn h ALA 90 Cb 0.05 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 17.76 1tvn h ALA 90 CO -0.03 0.31 0.00 0.39 0.00 0.00 0.00 179.25 179.92 1tvn n GLU 91 N -4.31 1.98 -3.57 0.00 -0.58 0.15 -4.95 120.64 109.36 1tvn n GLU 91 Ca -0.01 -1.48 -0.21 0.00 -0.42 0.00 0.00 57.16 55.04 1tvn n GLU 91 Cb 0.24 -1.41 0.07 0.00 -0.57 0.00 0.00 31.44 29.77 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 0.70 -3.20 -4.37 1.62 8.00 -0.62 -5.01 116.55 113.68 1tvn n ASP 92 Ca 0.17 -0.65 -0.25 0.00 0.71 0.00 0.00 54.79 54.76 1tvn n ASP 92 Cb 0.41 -4.80 -0.12 0.00 -0.02 0.00 0.00 41.12 36.59 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 -5.83 1.37 0.42 -1.24 -1.94 -0.26 -4.81 119.30 107.01 1tvn s MET 93 Ca 0.20 -1.41 -0.17 0.00 -1.71 0.00 0.00 55.69 52.60 1tvn s MET 93 Cb -0.09 -1.62 -0.09 0.00 2.01 0.00 0.00 34.83 35.04 1tvn s MET 93 CO 0.75 0.35 0.88 0.71 -0.01 0.00 0.00 175.02 177.71 1tvn s TYR 94 N -1.65 3.37 -0.10 -0.03 2.02 -0.50 -4.31 117.35 116.15 1tvn s TYR 94 Ca 0.16 1.42 0.00 0.00 -0.37 0.00 0.00 57.07 58.28 1tvn s TYR 94 Cb -0.08 -2.71 0.02 0.00 -0.40 0.00 0.00 41.96 38.79 1tvn s TYR 94 CO 0.08 -0.11 -0.09 0.54 -1.57 0.00 0.00 175.55 174.39 1tvn s VAL 95 N -2.24 1.09 -0.38 0.71 0.11 0.32 -1.51 120.40 118.50 1tvn s VAL 95 Ca 0.58 -0.37 -0.19 0.00 -2.93 0.00 0.00 61.98 59.08 1tvn s VAL 95 Cb -0.10 -1.07 0.01 0.00 -1.53 0.00 0.00 36.38 33.69 1tvn s VAL 95 CO 0.20 0.37 0.56 -0.63 -3.33 0.00 0.00 175.10 172.27 1tvn s ILE 96 N 1.39 4.96 -0.62 7.04 1.01 -0.20 -1.38 121.20 133.40 1tvn s ILE 96 Ca -0.01 0.25 -0.22 0.00 0.00 0.00 0.00 60.65 60.67 1tvn s ILE 96 Cb -0.13 -4.05 0.07 0.00 0.01 0.00 0.00 42.46 38.35 1tvn s ILE 96 CO -0.05 -0.35 0.91 -0.63 0.00 0.00 0.00 174.94 174.82 1tvn s ILE 97 N 2.52 4.42 -0.34 2.92 1.01 0.27 -0.97 121.20 131.04 1tvn s ILE 97 Ca 0.20 -0.30 -0.13 0.00 0.00 0.00 0.00 60.65 60.42 1tvn s ILE 97 Cb -0.15 -4.61 -0.02 0.00 0.01 0.00 0.00 42.46 37.69 1tvn s ILE 97 CO 0.15 -1.31 0.25 -0.62 0.00 0.00 0.00 174.94 173.41 1tvn s ASP 98 N 3.43 6.07 -0.80 3.58 2.15 -0.60 -0.95 116.67 129.55 1tvn s ASP 98 Ca 0.22 -0.41 -0.25 0.00 0.43 0.00 0.00 52.55 52.55 1tvn s ASP 98 Cb -0.17 -2.14 0.04 0.00 -0.30 0.00 0.00 42.92 40.35 1tvn s ASP 98 CO 0.12 -0.24 1.27 0.12 -0.17 0.00 0.00 175.17 176.27 1tvn s PHE 99 N 1.74 2.43 -1.32 -5.34 2.19 -0.50 -1.19 117.98 115.98 1tvn s PHE 99 Ca 0.06 -0.36 -0.17 0.00 0.33 0.00 0.00 56.93 56.80 1tvn s PHE 99 Cb -0.17 -4.59 0.05 0.00 -1.31 0.00 0.00 43.02 37.00 1tvn s PHE 99 CO 0.11 -1.96 1.90 1.58 1.83 0.00 0.00 175.22 178.67 1tvn n HIS 100 N 8.92 4.16 -4.33 10.12 -0.00 0.14 -2.01 115.22 132.23 1tvn n HIS 100 Ca 0.10 -2.77 -0.20 0.00 0.46 0.00 0.00 57.72 55.31 1tvn n HIS 100 Cb 0.49 -2.59 -0.11 0.00 -0.12 0.00 0.00 29.99 27.66 1tvn n HIS 100 CO 0.00 0.00 0.00 0.45 0.46 0.00 0.00 176.34 177.25 1tvn s SER 101 N 4.08 2.58 -0.03 0.26 0.15 -1.26 -1.93 113.70 117.55 1tvn s SER 101 Ca 0.53 -0.92 0.04 0.00 0.70 0.00 0.00 55.95 56.29 1tvn s SER 101 Cb 0.07 -0.14 0.06 0.00 -1.71 0.00 0.00 66.02 64.30 1tvn s SER 101 CO 0.04 -0.10 1.00 1.41 1.20 0.00 0.00 173.24 176.78 1tvn n HIS 102 N 0.03 0.00 -2.31 3.44 8.25 -1.26 -1.53 115.22 121.84 1tvn n HIS 102 Ca -0.11 -0.56 -0.03 0.00 -0.26 0.00 0.00 57.72 56.76 1tvn n HIS 102 Cb 0.58 -0.07 -0.00 0.00 1.12 0.00 0.00 29.99 31.63 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 -0.65 0.41 -0.15 -0.41 0.28 -1.26 -4.42 120.64 114.43 1tvn n GLU 103 Ca 0.03 -1.46 0.05 0.00 -0.16 0.00 0.00 57.16 55.62 1tvn n GLU 103 Cb 0.35 0.21 0.34 0.00 1.43 0.00 0.00 31.44 33.78 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 0.62 1.65 0.00 -1.84 0.00 -1.92 -1.75 119.26 116.03 1tvn h ALA 104 Ca -0.44 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.44 1tvn h ALA 104 Cb 1.48 -0.21 0.00 0.00 0.00 0.00 0.00 17.79 19.06 1tvn h ALA 104 CO -0.15 0.27 0.00 1.12 0.00 0.00 0.00 179.25 180.49 1tvn h HIS 105 N 0.77 0.00 -0.15 0.00 2.07 -1.92 -2.50 115.15 113.41 1tvn h HIS 105 Ca 0.27 0.00 0.00 0.00 -2.85 0.00 0.00 60.37 57.79 1tvn h HIS 105 Cb 0.11 0.00 0.00 0.00 2.57 0.00 0.00 27.41 30.09 1tvn h HIS 105 CO -0.00 0.00 0.00 0.25 -3.07 0.00 0.00 177.93 175.11 1tvn n THR 106 N -2.79 0.21 -2.69 6.12 -2.24 -0.67 -4.35 114.28 107.87 1tvn n THR 106 Ca 0.01 -0.61 -0.11 0.00 -2.27 0.00 0.00 64.05 61.07 1tvn n THR 106 Cb 0.25 1.23 0.02 0.00 -2.10 0.00 0.00 70.33 69.73 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 1.18 1.61 -0.37 3.42 4.64 -0.96 -4.97 116.55 121.10 1tvn n ASP 107 Ca 0.14 -2.80 -0.00 0.00 -1.38 0.00 0.00 54.79 50.74 1tvn n ASP 107 Cb 0.52 -0.53 0.13 0.00 -1.04 0.00 0.00 41.12 40.20 1tvn n ASP 107 CO 0.00 0.00 0.00 -0.61 -0.82 0.00 0.00 177.20 175.77 1tvn h GLN 108 N 2.97 1.25 -0.99 -0.67 4.15 -1.71 -2.47 115.11 117.64 1tvn h GLN 108 Ca -0.06 -0.08 0.03 0.00 0.77 0.00 0.00 58.65 59.32 1tvn h GLN 108 Cb 1.14 -0.28 -0.06 0.00 0.21 0.00 0.00 27.48 28.50 1tvn h GLN 108 CO 0.52 0.83 0.65 0.00 -1.93 0.00 0.00 178.83 178.90 1tvn h ALA 109 N 1.40 1.34 -0.40 3.38 0.00 -1.93 0.21 119.26 123.26 1tvn h ALA 109 Ca 0.39 -0.05 -0.06 0.00 0.00 0.00 0.00 54.91 55.19 1tvn h ALA 109 Cb -0.04 -0.37 -0.01 0.00 0.00 0.00 0.00 17.79 17.37 1tvn h ALA 109 CO -0.11 0.58 0.01 1.15 0.00 0.00 0.00 179.25 180.87 1tvn h THR 110 N 1.28 1.26 -0.74 0.00 2.02 -1.85 -0.75 112.91 114.12 1tvn h THR 110 Ca 0.39 -0.99 0.02 0.00 0.77 0.00 0.00 66.41 66.59 1tvn h THR 110 Cb -0.04 1.11 -0.04 0.00 -1.74 0.00 0.00 68.15 67.44 1tvn h THR 110 CO -0.11 0.34 0.48 0.00 0.37 0.00 0.00 175.52 176.60 1tvn h ALA 111 N 0.89 0.95 -0.57 6.16 0.00 -0.95 0.14 119.26 125.87 1tvn h ALA 111 Ca 0.11 -0.04 -0.09 0.00 0.00 0.00 0.00 54.91 54.90 1tvn h ALA 111 Cb 0.46 -0.28 -0.02 0.00 0.00 0.00 0.00 17.79 17.95 1tvn h ALA 111 CO 0.02 0.32 0.02 0.28 0.00 0.00 0.00 179.25 179.89 1tvn h VAL 112 N 0.97 1.26 -0.46 0.00 2.07 -0.85 -0.21 116.25 119.04 1tvn h VAL 112 Ca 0.28 -1.10 -0.01 0.00 0.82 0.00 0.00 66.70 66.69 1tvn h VAL 112 Cb -0.07 0.84 -0.02 0.00 -1.52 0.00 0.00 31.29 30.52 1tvn h VAL 112 CO -0.08 0.40 0.25 -0.09 0.02 0.00 0.00 177.57 178.07 1tvn h ARG 113 N 0.89 0.64 -0.08 1.57 2.43 -0.73 -0.08 114.38 119.02 1tvn h ARG 113 Ca 0.17 -0.08 -0.00 0.00 -0.81 0.00 0.00 59.98 59.26 1tvn h ARG 113 Cb 0.52 -0.12 -0.00 0.00 -0.42 0.00 0.00 29.97 29.94 1tvn h ARG 113 CO 0.03 0.51 0.04 0.35 -1.51 0.00 0.00 179.97 179.38 1tvn h PHE 114 N 0.60 0.11 -0.10 2.20 3.57 -0.68 -1.96 116.94 120.69 1tvn h PHE 114 Ca 0.16 -0.00 -0.11 0.00 3.53 0.00 0.00 57.97 61.55 1tvn h PHE 114 Cb 0.05 -0.04 -0.01 0.00 2.79 0.00 0.00 35.95 38.75 1tvn h PHE 114 CO -0.02 0.18 -0.41 0.74 -2.23 0.00 0.00 178.31 176.56 1tvn h PHE 115 N 0.02 0.27 -0.15 0.41 0.04 -0.84 -0.33 116.94 116.37 1tvn h PHE 115 Ca 0.03 -0.07 -0.15 0.00 2.80 0.00 0.00 57.97 60.57 1tvn h PHE 115 Cb 0.10 -0.06 -0.01 0.00 2.20 0.00 0.00 35.95 38.18 1tvn h PHE 115 CO -0.04 0.62 -0.55 0.93 -0.60 0.00 0.00 178.31 178.67 1tvn h GLU 116 N 0.20 0.45 -0.08 1.51 5.08 -0.98 -1.14 114.58 119.62 1tvn h GLU 116 Ca 0.02 -0.28 -0.02 0.00 -1.00 0.00 0.00 59.36 58.07 1tvn h GLU 116 Cb 0.82 0.03 -0.00 0.00 0.50 0.00 0.00 28.75 30.10 1tvn h GLU 116 CO 0.06 0.88 -0.03 0.22 -1.00 0.00 0.00 179.01 179.15 1tvn h ASP 117 N 0.35 0.17 -0.19 1.42 -0.00 -0.97 -1.49 116.42 115.70 1tvn h ASP 117 Ca 0.01 -0.39 -0.09 0.00 -0.00 0.00 0.00 57.03 56.55 1tvn h ASP 117 Cb 1.07 -0.05 -0.02 0.00 -0.00 0.00 0.00 39.33 40.34 1tvn h ASP 117 CO 0.10 0.52 -0.17 -0.37 -0.00 0.00 0.00 179.24 179.32 1tvn h VAL 118 N -0.19 1.25 -0.68 2.25 -1.51 -1.01 -1.00 116.25 115.37 1tvn h VAL 118 Ca 0.02 -1.18 -0.08 0.00 -1.23 0.00 0.00 66.70 64.24 1tvn h VAL 118 Cb 0.46 1.18 -0.03 0.00 -2.13 0.00 0.00 31.29 30.77 1tvn h VAL 118 CO 0.01 0.39 0.12 0.00 -1.23 0.00 0.00 177.57 176.86 1tvn h ALA 119 N 1.27 0.92 -0.27 5.19 0.00 -1.15 0.44 119.26 125.66 1tvn h ALA 119 Ca 0.09 -0.27 -0.05 0.00 0.00 0.00 0.00 54.91 54.68 1tvn h ALA 119 Cb 0.60 -0.26 -0.01 0.00 0.00 0.00 0.00 17.79 18.13 1tvn h ALA 119 CO 0.04 0.67 -0.04 1.15 0.00 0.00 0.00 179.25 181.07 1tvn h THR 120 N 1.05 1.27 0.03 0.00 2.02 -0.88 -0.99 112.91 115.41 1tvn h THR 120 Ca 0.21 -1.03 -0.22 0.00 0.77 0.00 0.00 66.41 66.14 1tvn h THR 120 Cb 0.43 1.40 -0.01 0.00 -1.74 0.00 0.00 68.15 68.23 1tvn h THR 120 CO 0.01 0.33 -0.97 0.11 0.37 0.00 0.00 175.52 175.36 1tvn h LYS 121 N 0.27 0.24 0.00 6.66 1.57 -1.09 -3.40 116.57 120.82 1tvn h LYS 121 Ca 0.07 -0.29 0.00 0.00 -1.87 0.00 0.00 60.65 58.56 1tvn h LYS 121 Cb 0.50 0.09 0.00 0.00 0.08 0.00 0.00 32.23 32.90 1tvn h LYS 121 CO 0.02 1.04 0.00 0.66 -0.57 0.00 0.00 179.45 180.60 1tvn n TYR 122 N -3.62 0.00 0.03 -1.35 4.01 0.14 -4.80 117.16 111.57 1tvn n TYR 122 Ca -0.05 0.00 0.20 0.00 -0.16 0.00 0.00 57.90 57.89 1tvn n TYR 122 Cb 0.87 0.00 0.71 0.00 -0.31 0.00 0.00 39.34 40.61 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 -1.17 -2.24 103.07 104.38 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 0.61 0.00 0.00 0.00 176.54 177.15 1tvn n GLN 124 N -4.22 0.10 -3.45 4.80 10.64 -1.26 -4.66 117.38 119.34 1tvn n GLN 124 Ca 0.09 0.42 -0.37 0.00 -1.83 0.00 0.00 57.00 55.30 1tvn n GLN 124 Cb 0.58 -1.73 -0.06 0.00 -0.86 0.00 0.00 30.24 28.17 1tvn n GLN 124 CO 0.00 0.00 0.00 0.71 -1.83 0.00 0.00 177.06 175.94 1tvn s TYR 125 N -3.22 3.54 -0.49 2.61 1.51 -0.85 -4.96 117.35 115.48 1tvn s TYR 125 Ca 0.03 0.79 0.22 0.00 -1.01 0.00 0.00 57.07 57.10 1tvn s TYR 125 Cb 0.08 -2.40 0.96 0.00 -0.11 0.00 0.00 41.96 40.48 1tvn s TYR 125 CO 0.27 0.30 1.67 -0.25 -1.11 0.00 0.00 175.55 176.43 1tvn n ASP 126 N 3.24 0.59 0.25 2.29 10.43 -1.26 -2.40 116.55 129.69 1tvn n ASP 126 Ca -0.11 0.66 0.13 0.00 2.57 0.00 0.00 54.79 58.04 1tvn n ASP 126 Cb 0.52 -0.78 0.56 0.00 1.84 0.00 0.00 41.12 43.26 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 -3.13 -2.24 4.21 -1.90 -3.43 115.58 109.09 1tvn h ASN 127 Ca 0.00 0.00 -0.57 0.00 1.21 0.00 0.00 56.30 56.94 1tvn h ASN 127 Cb 0.30 0.00 -0.05 0.00 -1.12 0.00 0.00 38.32 37.45 1tvn h ASN 127 CO 0.00 0.14 0.72 -0.69 -1.29 0.00 0.00 177.43 176.31 1tvn s VAL 128 N -3.71 4.68 -0.09 2.81 1.01 -1.01 -0.52 120.40 123.56 1tvn s VAL 128 Ca 0.00 1.99 0.04 0.00 0.00 0.00 0.00 61.98 64.01 1tvn s VAL 128 Cb 0.10 -4.28 -0.01 0.00 0.00 0.00 0.00 36.38 32.19 1tvn s VAL 128 CO 0.60 -0.11 -0.21 -0.63 0.00 0.00 0.00 175.10 174.75 1tvn s ILE 129 N 2.77 2.39 -0.23 2.22 1.01 -0.48 -4.56 121.20 124.33 1tvn s ILE 129 Ca 0.46 -0.92 -0.10 0.00 0.00 0.00 0.00 60.65 60.09 1tvn s ILE 129 Cb -0.17 -1.92 -0.05 0.00 0.01 0.00 0.00 42.46 40.33 1tvn s ILE 129 CO 0.11 0.56 0.15 -0.31 0.00 0.00 0.00 174.94 175.45 1tvn s TYR 130 N 0.09 3.32 -0.36 3.97 2.02 -0.98 -0.57 117.35 124.85 1tvn s TYR 130 Ca -0.09 0.22 0.00 0.00 -0.37 0.00 0.00 57.07 56.82 1tvn s TYR 130 Cb -0.15 -2.25 0.09 0.00 -0.40 0.00 0.00 41.96 39.25 1tvn s TYR 130 CO 0.06 0.09 0.10 -2.00 -1.57 0.00 0.00 175.55 172.22 1tvn s GLU 131 N 0.95 1.87 0.17 -0.62 2.12 -0.12 -0.38 118.70 122.68 1tvn s GLU 131 Ca 0.07 -1.74 0.26 0.00 0.36 0.00 0.00 54.97 53.92 1tvn s GLU 131 Cb -0.13 -3.34 0.91 0.00 0.26 0.00 0.00 34.13 31.83 1tvn s GLU 131 CO 0.03 -0.93 1.78 0.44 -0.54 0.00 0.00 175.26 176.05 1tvn n ILE 132 N 4.45 0.54 -3.16 -3.70 -5.35 -1.07 -1.41 119.36 109.67 1tvn n ILE 132 Ca -0.02 -0.11 0.01 0.00 -0.27 0.00 0.00 62.75 62.36 1tvn n ILE 132 Cb 0.42 -0.69 -0.01 0.00 -1.74 0.00 0.00 39.64 37.62 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 -3.11 -1.58 0.00 4.28 6.14 -1.26 -4.74 117.35 117.07 1tvn s TYR 133 Ca 0.10 0.28 -0.00 0.00 0.64 0.00 0.00 57.07 58.08 1tvn s TYR 133 Cb 0.13 0.29 -0.00 0.00 0.42 0.00 0.00 41.96 42.80 1tvn s TYR 133 CO 0.53 -1.06 0.89 -1.71 0.64 0.00 0.00 175.55 174.83 1tvn n ASN 134 N 4.39 -0.01 -3.45 4.32 5.15 -0.85 -3.29 115.26 121.52 1tvn n ASN 134 Ca 0.10 0.89 -0.27 0.00 -0.60 0.00 0.00 54.58 54.70 1tvn n ASN 134 Cb 0.58 -0.44 -0.12 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 -3.04 0.53 0.80 1.20 2.02 -0.58 -4.69 118.70 114.94 1tvn s GLU 135 Ca -0.00 -1.19 -0.13 0.00 0.02 0.00 0.00 54.97 53.67 1tvn s GLU 135 Cb 0.00 -1.20 0.08 0.00 0.10 0.00 0.00 34.13 33.12 1tvn s GLU 135 CO 0.01 -1.19 1.19 -2.14 0.02 0.00 0.00 175.26 173.15 1tvn s PRO 136 N 1.21 1.69 0.00 0.39 0.02 -1.26 -4.18 135.00 132.88 1tvn s PRO 136 Ca 0.17 1.71 0.00 0.00 0.02 0.00 0.00 61.00 62.90 1tvn s PRO 136 Cb -0.21 -1.79 0.00 0.00 0.02 0.00 0.00 34.50 32.52 1tvn s PRO 136 CO -0.03 -2.16 0.00 1.28 -0.33 0.00 0.00 177.00 175.76 1tvn n LEU 137 N -3.30 0.00 -3.71 -5.54 4.77 -1.26 -0.63 117.00 107.33 1tvn n LEU 137 Ca 0.13 0.00 -0.42 0.00 -0.03 0.00 0.00 56.01 55.69 1tvn n LEU 137 Cb 0.51 0.00 -0.00 0.00 -2.33 0.00 0.00 43.42 41.60 1tvn n LEU 137 CO 0.48 0.00 2.26 0.00 -1.33 0.00 0.00 177.39 178.81 1tvn n GLN 138 N 0.00 3.76 -4.12 3.23 6.02 -1.26 -0.73 117.38 124.28 1tvn n GLN 138 Ca 0.00 -3.29 -0.27 0.00 -0.01 0.00 0.00 57.00 53.43 1tvn n GLN 138 Cb 0.00 -2.89 -0.04 0.00 1.02 0.00 0.00 30.24 28.33 1tvn n GLN 138 CO 0.00 0.00 0.00 0.96 -1.01 0.00 0.00 177.06 177.01 1tvn s ILE 139 N 0.52 1.73 -0.10 5.09 -4.36 -1.26 -4.98 121.20 117.83 1tvn s ILE 139 Ca 0.46 -1.64 -0.28 0.00 -0.26 0.00 0.00 60.65 58.92 1tvn s ILE 139 Cb 0.13 -2.37 -0.02 0.00 1.25 0.00 0.00 42.46 41.45 1tvn s ILE 139 CO -0.04 0.00 0.95 -0.55 0.24 0.00 0.00 174.94 175.55 1tvn s SER 140 N -4.10 7.19 0.02 4.36 0.15 -1.26 -4.80 113.70 115.27 1tvn s SER 140 Ca 0.30 1.46 -0.26 0.00 0.70 0.00 0.00 55.95 58.15 1tvn s SER 140 Cb -0.00 -2.53 -0.17 0.00 -1.71 0.00 0.00 66.02 61.61 1tvn s SER 140 CO 0.18 -0.40 1.33 -0.25 1.20 0.00 0.00 173.24 175.30 1tvn h TRP 141 N 7.08 -0.36 -0.61 3.44 2.91 -1.97 0.97 115.95 127.41 1tvn h TRP 141 Ca -0.32 -0.01 -0.08 0.00 1.13 0.00 0.00 58.89 59.61 1tvn h TRP 141 Cb 1.16 0.12 -0.02 0.00 -0.51 0.00 0.00 29.16 29.90 1tvn h TRP 141 CO 0.71 -0.05 0.07 -0.39 -1.03 0.00 0.00 178.44 177.74 1tvn h VAL 142 N -0.67 1.26 0.00 2.65 -1.51 -1.94 0.70 116.25 116.74 1tvn h VAL 142 Ca -0.04 -1.04 -0.05 0.00 -1.23 0.00 0.00 66.70 64.33 1tvn h VAL 142 Cb 0.47 0.71 -0.01 0.00 -2.13 0.00 0.00 31.29 30.33 1tvn h VAL 142 CO 0.07 0.38 -1.74 0.59 -1.23 0.00 0.00 177.57 175.64 1tvn n ASN 143 N -4.21 0.30 -0.03 4.19 3.02 -1.24 -4.31 115.26 112.97 1tvn n ASN 143 Ca 0.04 0.12 -0.08 0.00 -0.03 0.00 0.00 54.58 54.62 1tvn n ASN 143 Cb 0.30 1.33 -0.03 0.00 -0.61 0.00 0.00 39.78 40.77 1tvn n ASN 143 CO 0.00 0.00 0.00 0.47 -2.62 0.00 0.00 177.26 175.11 1tvn n ASP 144 N -2.48 1.18 -0.02 6.41 10.43 0.22 -4.69 116.55 127.61 1tvn n ASP 144 Ca -0.07 0.19 -0.13 0.00 2.57 0.00 0.00 54.79 57.35 1tvn n ASP 144 Cb 0.65 -0.44 -0.10 0.00 1.84 0.00 0.00 41.12 43.07 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 -0.43 1.43 -0.42 0.53 2.04 -1.18 -3.22 117.51 116.25 1tvn h ILE 145 Ca -0.14 -1.38 0.05 0.00 1.00 0.00 0.00 64.86 64.39 1tvn h ILE 145 Cb 0.82 2.35 -0.05 0.00 -0.74 0.00 0.00 36.82 39.21 1tvn h ILE 145 CO -0.09 0.35 0.15 0.50 0.00 0.00 0.00 178.15 179.07 1tvn h LYS 146 N -0.62 0.31 -0.71 2.37 3.64 -1.08 0.86 116.57 121.36 1tvn h LYS 146 Ca -0.00 -0.02 -0.05 0.00 -1.27 0.00 0.00 60.65 59.31 1tvn h LYS 146 Cb 0.59 -0.07 -0.03 0.00 -0.41 0.00 0.00 32.23 32.31 1tvn h LYS 146 CO 0.00 0.21 0.25 -1.35 -2.27 0.00 0.00 179.45 176.29 1tvn h PRO 147 N 0.32 1.08 -0.55 1.90 0.11 -1.75 0.34 132.00 133.45 1tvn h PRO 147 Ca 0.20 -0.22 -0.02 0.00 0.11 0.00 0.00 66.00 66.07 1tvn h PRO 147 Cb 0.18 -0.16 -0.03 0.00 0.11 0.00 0.00 31.00 31.10 1tvn h PRO 147 CO -0.19 0.91 0.27 -0.92 -0.21 0.00 0.00 178.00 177.85 1tvn h TYR 148 N 1.03 0.79 -0.38 0.65 3.20 -1.48 -2.00 116.97 118.77 1tvn h TYR 148 Ca 0.23 -0.04 -0.01 0.00 3.14 0.00 0.00 58.73 62.05 1tvn h TYR 148 Cb 0.26 -0.25 -0.02 0.00 1.54 0.00 0.00 36.73 38.27 1tvn h TYR 148 CO 0.02 0.61 0.18 0.00 -1.64 0.00 0.00 178.16 177.34 1tvn h ALA 149 N 1.10 0.49 -0.63 1.82 0.00 -0.39 -0.72 119.26 120.94 1tvn h ALA 149 Ca 0.19 -0.11 0.00 0.00 0.00 0.00 0.00 54.91 55.00 1tvn h ALA 149 Cb 0.12 -0.15 -0.03 0.00 0.00 0.00 0.00 17.79 17.72 1tvn h ALA 149 CO -0.02 0.06 0.40 0.93 0.00 0.00 0.00 179.25 180.61 1tvn h GLU 150 N 0.48 0.84 -0.15 0.00 5.08 -0.83 0.27 114.58 120.26 1tvn h GLU 150 Ca 0.13 -0.06 -0.00 0.00 -1.00 0.00 0.00 59.36 58.43 1tvn h GLU 150 Cb 0.12 -0.18 -0.01 0.00 0.50 0.00 0.00 28.75 29.18 1tvn h GLU 150 CO -0.02 0.57 0.09 1.15 -1.00 0.00 0.00 179.01 179.81 1tvn h THR 151 N 0.85 1.07 -0.42 1.13 2.02 -1.07 -1.56 112.91 114.94 1tvn h THR 151 Ca 0.23 -0.17 -0.12 0.00 0.77 0.00 0.00 66.41 67.12 1tvn h THR 151 Cb -0.07 0.91 -0.01 0.00 -1.74 0.00 0.00 68.15 67.24 1tvn h THR 151 CO -0.05 0.06 -0.20 0.58 0.37 0.00 0.00 175.52 176.29 1tvn h VAL 152 N 0.17 1.28 -0.55 3.16 2.07 -0.85 -1.58 116.25 119.95 1tvn h VAL 152 Ca 0.05 -1.34 0.03 0.00 0.82 0.00 0.00 66.70 66.27 1tvn h VAL 152 Cb 0.02 1.25 -0.04 0.00 -1.52 0.00 0.00 31.29 31.00 1tvn h VAL 152 CO -0.01 0.45 0.32 0.40 0.02 0.00 0.00 177.57 178.75 1tvn h ILE 153 N 0.69 1.03 -0.30 4.57 2.04 -0.40 0.25 117.51 125.38 1tvn h ILE 153 Ca 0.09 -0.21 -0.09 0.00 1.00 0.00 0.00 64.86 65.65 1tvn h ILE 153 Cb 0.76 0.35 -0.01 0.00 -0.74 0.00 0.00 36.82 37.17 1tvn h ILE 153 CO 0.06 0.11 -0.21 0.44 0.00 0.00 0.00 178.15 178.56 1tvn h ASP 154 N 0.62 0.55 -0.41 1.72 3.32 -1.09 0.33 116.42 121.48 1tvn h ASP 154 Ca 0.23 -0.18 -0.11 0.00 0.02 0.00 0.00 57.03 56.99 1tvn h ASP 154 Cb 0.06 -0.15 -0.01 0.00 0.22 0.00 0.00 39.33 39.45 1tvn h ASP 154 CO -0.12 0.77 -0.16 0.11 -1.72 0.00 0.00 179.24 178.11 1tvn h LYS 155 N 0.50 0.83 -0.39 3.56 1.79 -0.68 -2.48 116.57 119.69 1tvn h LYS 155 Ca 0.08 -0.35 -0.04 0.00 -2.18 0.00 0.00 60.65 58.16 1tvn h LYS 155 Cb 0.64 -0.03 -0.02 0.00 -1.58 0.00 0.00 32.23 31.24 1tvn h LYS 155 CO 0.05 0.98 0.10 0.82 -1.08 0.00 0.00 179.45 180.31 1tvn h ILE 156 N 0.64 1.23 0.00 1.86 2.04 -0.65 -3.16 117.51 119.47 1tvn h ILE 156 Ca 0.09 -0.77 0.00 0.00 1.00 0.00 0.00 64.86 65.18 1tvn h ILE 156 Cb 0.71 0.99 0.00 0.00 -0.74 0.00 0.00 36.82 37.78 1tvn h ILE 156 CO 0.05 0.27 0.00 0.03 0.00 0.00 0.00 178.15 178.50 1tvn h ARG 157 N 0.49 0.00 0.00 2.37 3.08 -0.83 0.17 114.38 119.66 1tvn h ARG 157 Ca 0.12 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.17 1tvn h ARG 157 Cb 0.30 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.35 1tvn h ARG 157 CO 0.00 0.00 0.00 0.00 -1.07 0.00 0.00 179.97 178.90 1tvn h ALA 158 N 2.18 1.00 0.00 0.04 0.00 -1.40 -3.19 119.26 117.89 1tvn h ALA 158 Ca 0.00 0.00 -0.31 0.00 0.00 0.00 0.00 54.91 54.60 1tvn h ALA 158 Cb 0.33 0.00 -0.05 0.00 0.00 0.00 0.00 17.79 18.07 1tvn h ALA 158 CO 0.00 0.00 -2.08 -0.89 0.00 0.00 0.00 179.25 176.28 1tvn n ILE 159 N -2.90 1.07 -3.76 0.00 5.41 -0.45 -4.90 119.36 113.84 1tvn n ILE 159 Ca 0.02 -0.31 -0.30 0.00 1.00 0.00 0.00 62.75 63.16 1tvn n ILE 159 Cb 0.35 -1.58 -0.14 0.00 -0.71 0.00 0.00 39.64 37.57 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 -6.46 3.91 0.49 4.38 3.68 0.49 -4.95 116.67 118.21 1tvn s ASP 160 Ca -0.27 -2.27 0.28 0.00 2.13 0.00 0.00 52.55 52.43 1tvn s ASP 160 Cb 0.09 -1.06 1.08 0.00 -1.45 0.00 0.00 42.92 41.58 1tvn s ASP 160 CO 0.37 -0.33 1.88 1.55 0.13 0.00 0.00 175.17 178.78 1tvn h PRO 161 N 7.26 0.00 -4.81 4.34 0.13 -1.78 -3.34 132.00 133.81 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 0.96 0.00 -0.24 0.00 0.13 0.00 0.00 31.00 31.86 1tvn h PRO 161 CO 0.49 0.12 -0.59 -0.51 -0.23 0.00 0.00 178.00 177.29 1tvn s ASP 162 N -5.99 5.36 0.00 1.44 1.01 -1.26 -4.95 116.67 112.28 1tvn s ASP 162 Ca 0.01 -0.54 0.00 0.00 0.71 0.00 0.00 52.55 52.73 1tvn s ASP 162 Cb 0.10 -1.95 0.00 0.00 1.01 0.00 0.00 42.92 42.07 1tvn s ASP 162 CO 0.60 -0.17 0.00 -0.46 0.21 0.00 0.00 175.17 175.35 1tvn n ASN 163 N 4.94 0.00 -4.69 0.27 0.23 -1.26 -5.01 115.26 109.73 1tvn n ASN 163 Ca -0.14 0.00 -0.35 0.00 -0.53 0.00 0.00 54.58 53.56 1tvn n ASN 163 Cb 0.49 0.00 -0.09 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 4.03 -0.10 -4.53 2.96 -1.26 -4.73 118.68 115.05 1tvn s LEU 164 Ca 0.00 0.17 0.03 0.00 -0.22 0.00 0.00 54.13 54.11 1tvn s LEU 164 Cb 0.00 -2.03 0.01 0.00 0.50 0.00 0.00 46.19 44.67 1tvn s LEU 164 CO 0.00 0.19 -0.21 -0.63 -1.32 0.00 0.00 176.35 174.38 1tvn s ILE 165 N 0.29 1.86 -0.20 6.68 1.01 -0.90 -2.31 121.20 127.64 1tvn s ILE 165 Ca 0.06 -0.89 -0.06 0.00 0.00 0.00 0.00 60.65 59.76 1tvn s ILE 165 Cb -0.12 -1.63 -0.03 0.00 0.01 0.00 0.00 42.46 40.69 1tvn s ILE 165 CO -0.01 0.51 0.03 -0.69 0.00 0.00 0.00 174.94 174.78 1tvn s VAL 166 N 0.56 4.23 -0.15 2.92 1.01 0.48 -1.30 120.40 128.14 1tvn s VAL 166 Ca -0.14 -0.22 -0.03 0.00 0.00 0.00 0.00 61.98 61.58 1tvn s VAL 166 Cb -0.17 -2.92 -0.03 0.00 0.00 0.00 0.00 36.38 33.27 1tvn s VAL 166 CO 0.05 0.42 -0.05 -0.69 0.00 0.00 0.00 175.10 174.83 1tvn s VAL 167 N 0.89 3.77 0.67 2.92 1.01 0.02 -2.61 120.40 127.07 1tvn s VAL 167 Ca 0.02 -0.40 -0.17 0.00 0.00 0.00 0.00 61.98 61.43 1tvn s VAL 167 Cb -0.14 -2.65 0.01 0.00 0.00 0.00 0.00 36.38 33.60 1tvn s VAL 167 CO 0.02 0.49 1.26 -0.83 0.00 0.00 0.00 175.10 176.04 1tvn s GLY 168 N 0.40 2.67 0.34 4.51 0.00 -1.21 -1.24 107.32 112.79 1tvn s GLY 168 Ca -0.05 1.09 0.10 0.00 0.00 0.00 0.00 44.72 45.85 1tvn s GLY 168 CO 0.03 1.50 -0.07 -0.51 0.00 0.00 0.00 173.10 174.06 1tvn s THR 169 N -1.61 2.39 0.88 0.90 -4.23 -1.26 -4.82 115.64 107.88 1tvn s THR 169 Ca 0.79 -2.15 -0.11 0.00 -1.18 0.00 0.00 61.69 59.05 1tvn s THR 169 Cb -0.34 -2.67 0.13 0.00 1.34 0.00 0.00 72.50 70.96 1tvn s THR 169 CO 0.41 -0.22 1.16 -2.84 -0.54 0.00 0.00 174.62 172.59 1tvn s PRO 170 N -3.64 1.23 -0.97 3.99 0.02 -1.26 -1.49 135.00 132.88 1tvn s PRO 170 Ca 0.33 1.57 -0.07 0.00 0.02 0.00 0.00 61.00 62.85 1tvn s PRO 170 Cb 0.01 -1.75 -0.04 0.00 0.02 0.00 0.00 34.50 32.75 1tvn s PRO 170 CO 0.17 -2.48 0.82 2.41 -0.33 0.00 0.00 177.00 177.59 1tvn n THR 171 N -3.99 -8.60 -3.76 0.99 -1.04 0.09 -1.15 114.28 96.83 1tvn n THR 171 Ca 0.12 -0.90 -0.26 0.00 -2.04 0.00 0.00 64.05 60.97 1tvn n THR 171 Cb 0.52 -6.08 0.04 0.00 -1.82 0.00 0.00 70.33 62.99 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 -2.96 -2.30 -3.66 -1.42 8.01 0.20 -2.27 117.44 113.04 1tvn n TRP 172 Ca -0.07 0.91 -0.26 0.00 -1.31 0.00 0.00 57.50 56.78 1tvn n TRP 172 Cb 0.58 -4.39 0.06 0.00 -2.01 0.00 0.00 31.31 25.55 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 -2.96 -5.81 -0.07 -0.99 7.64 -0.56 -4.49 113.62 106.39 1tvn n SER 173 Ca -0.09 -0.60 -0.06 0.00 1.01 0.00 0.00 58.87 59.13 1tvn n SER 173 Cb 0.59 -4.60 -0.11 0.00 -1.01 0.00 0.00 64.21 59.07 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 -4.81 1.62 -1.17 1.43 6.02 -0.82 -1.01 117.38 118.63 1tvn n GLN 174 Ca 0.01 -0.01 -0.21 0.00 -0.01 0.00 0.00 57.00 56.78 1tvn n GLN 174 Cb 0.55 -1.36 -0.12 0.00 1.02 0.00 0.00 30.24 30.33 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 -2.50 6.25 0.22 1.08 10.43 -0.30 -4.50 116.55 127.23 1tvn n ASP 175 Ca -0.22 -2.62 0.06 0.00 2.57 0.00 0.00 54.79 54.59 1tvn n ASP 175 Cb 0.93 -1.42 0.52 0.00 1.84 0.00 0.00 41.12 42.98 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 2.23 1.03 -0.46 2.53 -1.51 -1.84 -2.24 116.25 115.99 1tvn h VAL 176 Ca 0.38 -0.79 -0.03 0.00 -1.23 0.00 0.00 66.70 65.03 1tvn h VAL 176 Cb 1.11 1.44 -0.02 0.00 -2.13 0.00 0.00 31.29 31.69 1tvn h VAL 176 CO 0.69 0.22 0.17 -2.24 -1.23 0.00 0.00 177.57 175.17 1tvn h ASP 177 N 0.00 0.64 -0.19 4.19 2.03 -1.79 -0.51 116.42 120.79 1tvn h ASP 177 Ca -0.00 -0.18 -0.01 0.00 -0.73 0.00 0.00 57.03 56.11 1tvn h ASP 177 Cb 0.42 -0.17 -0.01 0.00 -0.83 0.00 0.00 39.33 38.75 1tvn h ASP 177 CO 0.03 0.65 0.07 0.58 -1.03 0.00 0.00 179.24 179.54 1tvn h VAL 178 N 0.60 1.17 -0.66 4.15 2.07 -1.79 -2.42 116.25 119.37 1tvn h VAL 178 Ca 0.15 -0.51 0.03 0.00 0.82 0.00 0.00 66.70 67.19 1tvn h VAL 178 Cb 0.21 1.15 -0.04 0.00 -1.52 0.00 0.00 31.29 31.10 1tvn h VAL 178 CO -0.01 0.16 0.43 0.00 0.02 0.00 0.00 177.57 178.18 1tvn h ALA 179 N 0.91 1.62 0.00 1.67 0.00 -1.31 -1.65 119.26 120.50 1tvn h ALA 179 Ca 0.06 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.94 1tvn h ALA 179 Cb 0.19 -0.23 0.00 0.00 0.00 0.00 0.00 17.79 17.75 1tvn h ALA 179 CO -0.00 0.32 0.00 0.66 0.00 0.00 0.00 179.25 180.23 1tvn h SER 180 N 0.80 0.00 1.48 0.00 4.64 -0.59 -1.56 113.55 118.32 1tvn h SER 180 Ca 0.26 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.58 1tvn h SER 180 Cb 0.04 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.13 1tvn h SER 180 CO -0.07 0.00 0.00 1.56 -0.87 0.00 0.00 176.83 177.45 1tvn h GLN 181 N 0.00 0.00 -1.38 4.77 4.20 -1.10 -3.37 115.11 118.23 1tvn h GLN 181 Ca 0.00 0.00 -0.43 0.00 0.06 0.00 0.00 58.65 58.28 1tvn h GLN 181 Cb 0.28 0.00 -0.30 0.00 0.30 0.00 0.00 27.48 27.77 1tvn h GLN 181 CO 0.00 0.00 -0.86 0.09 -0.67 0.00 0.00 178.83 177.39 1tvn n ASN 182 N -2.85 -1.10 -4.69 1.46 4.13 -0.60 -5.15 115.26 106.47 1tvn n ASN 182 Ca 0.03 -2.85 -0.31 0.00 1.68 0.00 0.00 54.58 53.13 1tvn n ASN 182 Cb 0.41 0.29 0.15 0.00 -1.54 0.00 0.00 39.78 39.09 1tvn n ASN 182 CO 0.00 0.00 0.00 -2.84 0.28 0.00 0.00 177.26 174.70 1tvn s PRO 183 N -0.31 1.19 0.00 3.52 0.02 -1.13 -4.95 135.00 133.34 1tvn s PRO 183 Ca 0.33 1.36 -0.27 0.00 0.02 0.00 0.00 61.00 62.44 1tvn s PRO 183 Cb 0.16 -1.76 -0.04 0.00 0.02 0.00 0.00 34.50 32.88 1tvn s PRO 183 CO -0.16 -2.45 0.84 0.42 -0.33 0.00 0.00 177.00 175.32 1tvn s ILE 184 N -2.72 4.85 -1.22 2.83 1.01 -1.26 -4.98 121.20 119.70 1tvn s ILE 184 Ca 0.65 1.77 -0.13 0.00 0.00 0.00 0.00 60.65 62.94 1tvn s ILE 184 Cb -0.21 -4.18 0.18 0.00 0.01 0.00 0.00 42.46 38.25 1tvn s ILE 184 CO 0.58 0.26 1.52 -0.67 0.00 0.00 0.00 174.94 176.63 1tvn n ASP 185 N 3.46 5.22 -3.79 3.58 2.03 -1.26 -4.89 116.55 120.90 1tvn n ASP 185 Ca 0.01 -3.01 -0.10 0.00 0.52 0.00 0.00 54.79 52.21 1tvn n ASP 185 Cb 0.51 -1.54 -0.07 0.00 -0.72 0.00 0.00 41.12 39.29 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 1.17 0.82 0.53 -0.67 1.81 -1.26 -5.16 118.95 116.19 1tvn s ARG 186 Ca 0.42 -0.68 -0.18 0.00 -1.72 0.00 0.00 55.73 53.57 1tvn s ARG 186 Cb -0.00 0.35 -0.07 0.00 -0.45 0.00 0.00 34.95 34.78 1tvn s ARG 186 CO 0.00 -0.27 1.02 0.00 -0.68 0.00 0.00 175.30 175.38 1tvn s ALA 187 N -3.05 2.89 -1.40 2.13 0.00 -1.26 -4.26 121.76 116.80 1tvn s ALA 187 Ca -0.01 0.40 -0.01 0.00 0.00 0.00 0.00 51.96 52.33 1tvn s ALA 187 Cb 0.01 -3.20 0.01 0.00 0.00 0.00 0.00 23.12 19.94 1tvn s ALA 187 CO -0.07 -0.42 0.49 0.09 0.00 0.00 0.00 175.76 175.85 1tvn n ASN 188 N -1.47 -0.67 -4.51 0.00 3.02 -1.26 -4.87 115.26 105.50 1tvn n ASN 188 Ca 0.08 -0.97 -0.34 0.00 -0.03 0.00 0.00 54.58 53.33 1tvn n ASN 188 Cb 0.53 -3.25 -0.12 0.00 -0.61 0.00 0.00 39.78 36.33 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 -3.87 3.61 0.32 2.41 -1.09 -1.26 -2.13 121.20 119.19 1tvn s ILE 189 Ca 0.04 -0.48 0.08 0.00 -2.23 0.00 0.00 60.65 58.06 1tvn s ILE 189 Cb -0.02 -2.52 -0.06 0.00 -1.58 0.00 0.00 42.46 38.28 1tvn s ILE 189 CO 0.87 0.55 -0.07 0.00 -1.23 0.00 0.00 174.94 175.07 1tvn s ALA 190 N -0.16 2.68 -0.01 9.38 0.00 -0.42 -4.62 121.76 128.60 1tvn s ALA 190 Ca 0.02 -2.03 0.07 0.00 0.00 0.00 0.00 51.96 50.03 1tvn s ALA 190 Cb -0.13 0.10 -0.02 0.00 0.00 0.00 0.00 23.12 23.07 1tvn s ALA 190 CO 0.03 -0.01 -0.24 0.71 0.00 0.00 0.00 175.76 176.24 1tvn s TYR 191 N -2.82 2.15 0.11 0.00 1.51 -0.04 -0.80 117.35 117.45 1tvn s TYR 191 Ca 0.32 -0.41 -0.31 0.00 -1.01 0.00 0.00 57.07 55.66 1tvn s TYR 191 Cb 0.04 -1.38 -0.07 0.00 -0.11 0.00 0.00 41.96 40.44 1tvn s TYR 191 CO 0.15 -0.03 1.24 0.99 -1.11 0.00 0.00 175.55 176.79 1tvn s THR 192 N -0.58 3.72 -0.13 -0.71 2.01 -0.37 -1.28 115.64 118.30 1tvn s THR 192 Ca 0.09 1.29 0.01 0.00 0.31 0.00 0.00 61.69 63.40 1tvn s THR 192 Cb -0.09 -3.83 0.02 0.00 0.01 0.00 0.00 72.50 68.61 1tvn s THR 192 CO -0.01 0.13 -0.14 -0.22 -0.69 0.00 0.00 174.62 173.69 1tvn s LEU 193 N 0.69 1.66 -0.01 4.42 2.96 -0.90 -4.31 118.68 123.18 1tvn s LEU 193 Ca 0.58 -0.45 0.07 0.00 -0.22 0.00 0.00 54.13 54.11 1tvn s LEU 193 Cb -0.32 -1.11 -0.02 0.00 0.50 0.00 0.00 46.19 45.24 1tvn s LEU 193 CO 0.32 -0.03 -0.21 -1.00 -1.32 0.00 0.00 176.35 174.11 1tvn s HIS 194 N 1.28 1.88 0.09 5.38 3.76 -0.18 -3.72 115.29 123.78 1tvn s HIS 194 Ca -0.00 -0.36 -0.24 0.00 -0.15 0.00 0.00 55.06 54.31 1tvn s HIS 194 Cb -0.14 -1.20 0.06 0.00 1.11 0.00 0.00 32.58 32.42 1tvn s HIS 194 CO -0.07 -0.02 0.58 -0.59 -0.85 0.00 0.00 174.74 173.80 1tvn s PHE 195 N -0.53 -0.51 -0.12 1.40 -0.12 -1.21 -4.56 117.98 112.34 1tvn s PHE 195 Ca 0.08 0.50 0.01 0.00 -0.05 0.00 0.00 56.93 57.46 1tvn s PHE 195 Cb -0.08 0.46 0.02 0.00 -0.63 0.00 0.00 43.02 42.78 1tvn s PHE 195 CO -0.01 -0.74 -0.13 0.71 -0.05 0.00 0.00 175.22 175.00 1tvn s TYR 196 N -2.93 1.86 0.56 3.49 2.02 -1.26 -1.38 117.35 119.72 1tvn s TYR 196 Ca -0.03 -0.93 0.26 0.00 -0.37 0.00 0.00 57.07 56.00 1tvn s TYR 196 Cb -0.00 -1.39 1.51 0.00 -0.40 0.00 0.00 41.96 41.67 1tvn s TYR 196 CO -0.06 -0.52 2.06 0.00 -1.57 0.00 0.00 175.55 175.46 1tvn h ALA 197 N 7.74 2.08 -0.00 3.71 0.00 -0.83 0.14 119.26 132.10 1tvn h ALA 197 Ca -0.33 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.57 1tvn h ALA 197 Cb 1.15 0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.97 1tvn h ALA 197 CO 0.48 -0.41 -0.06 0.41 0.00 0.00 0.00 179.25 179.67 1tvn n GLY 198 N -1.50 -1.26 0.00 0.00 0.00 0.15 -4.32 105.19 98.26 1tvn n GLY 198 Ca 0.04 -0.17 0.00 0.00 0.00 0.00 0.00 46.02 45.89 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 -1.28 0.00 -3.58 2.61 -1.04 -0.51 -4.81 114.28 105.67 1tvn n THR 199 Ca 0.12 0.00 -0.41 0.00 -2.04 0.00 0.00 64.05 61.72 1tvn n THR 199 Cb 0.28 -0.44 -0.11 0.00 -1.82 0.00 0.00 70.33 68.24 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 -1.64 3.26 0.00 -1.42 3.76 0.36 -5.03 115.29 114.57 1tvn s HIS 200 Ca 0.00 -1.02 0.00 0.00 -0.15 0.00 0.00 55.06 53.89 1tvn s HIS 200 Cb 0.00 -2.54 0.00 0.00 1.11 0.00 0.00 32.58 31.15 1tvn s HIS 200 CO 0.00 -0.68 0.00 0.41 -0.85 0.00 0.00 174.74 173.62 1tvn n GLY 201 N 5.01 1.91 0.37 -2.22 0.00 -1.26 -4.60 105.19 104.39 1tvn n GLY 201 Ca -0.12 -1.86 0.13 0.00 0.00 0.00 0.00 46.02 44.17 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 0.71 -0.03 1.61 5.75 -1.99 -0.89 115.11 120.28 1tvn h GLN 202 Ca 0.00 -0.04 -0.01 0.00 -0.15 0.00 0.00 58.65 58.44 1tvn h GLN 202 Cb 0.00 -0.16 -0.00 0.00 1.07 0.00 0.00 27.48 28.39 1tvn h GLN 202 CO 0.00 0.47 -0.05 0.66 -2.65 0.00 0.00 178.83 177.26 1tvn h SER 203 N 0.73 0.03 0.57 -0.69 4.64 -1.99 0.13 113.55 116.98 1tvn h SER 203 Ca 0.54 -0.00 -0.28 0.00 -0.47 0.00 0.00 61.79 61.58 1tvn h SER 203 Cb 0.88 -0.01 0.01 0.00 -0.31 0.00 0.00 62.40 62.97 1tvn h SER 203 CO -0.32 0.09 -1.25 1.88 -0.87 0.00 0.00 176.83 176.36 1tvn h TYR 204 N 0.04 0.56 -0.14 4.77 -1.99 -1.52 -3.08 116.97 115.61 1tvn h TYR 204 Ca 0.01 -0.40 -0.09 0.00 2.00 0.00 0.00 58.73 60.25 1tvn h TYR 204 Cb 0.11 -0.03 -0.01 0.00 2.00 0.00 0.00 36.73 38.81 1tvn h TYR 204 CO 0.00 1.30 -0.32 0.00 -0.00 0.00 0.00 178.16 179.14 1tvn h ARG 205 N 0.09 0.28 -0.48 4.88 3.08 -0.89 -2.61 114.38 118.73 1tvn h ARG 205 Ca -0.14 -0.11 -0.06 0.00 0.07 0.00 0.00 59.98 59.74 1tvn h ARG 205 Cb 1.97 -0.01 -0.02 0.00 0.08 0.00 0.00 29.97 31.98 1tvn h ARG 205 CO 0.21 0.58 0.05 -0.91 -1.07 0.00 0.00 179.97 178.83 1tvn h ASN 206 N 0.24 0.72 -0.66 7.04 2.35 -0.77 0.14 115.58 124.65 1tvn h ASN 206 Ca 0.03 -0.15 -0.07 0.00 -0.55 0.00 0.00 56.30 55.56 1tvn h ASN 206 Cb 0.69 -0.19 -0.03 0.00 0.05 0.00 0.00 38.32 38.85 1tvn h ASN 206 CO 0.05 0.76 0.15 0.11 -1.65 0.00 0.00 177.43 176.85 1tvn h LYS 207 N 0.73 1.07 -0.44 0.81 1.57 -1.38 -1.09 116.57 117.83 1tvn h LYS 207 Ca 0.15 -0.26 -0.11 0.00 -1.87 0.00 0.00 60.65 58.56 1tvn h LYS 207 Cb 0.37 -0.14 -0.02 0.00 0.08 0.00 0.00 32.23 32.52 1tvn h LYS 207 CO 0.01 0.96 -0.16 0.00 -0.57 0.00 0.00 179.45 179.69 1tvn h ALA 208 N 1.14 0.88 -0.80 3.86 0.00 -1.10 -2.24 119.26 121.01 1tvn h ALA 208 Ca 0.21 -0.35 -0.04 0.00 0.00 0.00 0.00 54.91 54.73 1tvn h ALA 208 Cb 0.38 -0.17 -0.04 0.00 0.00 0.00 0.00 17.79 17.96 1tvn h ALA 208 CO 0.00 0.63 0.36 0.37 0.00 0.00 0.00 179.25 180.62 1tvn h GLN 209 N 0.75 1.16 -0.69 0.00 5.75 -0.58 -1.59 115.11 119.91 1tvn h GLN 209 Ca 0.11 -0.19 0.02 0.00 -0.15 0.00 0.00 58.65 58.45 1tvn h GLN 209 Cb 0.68 -0.20 -0.04 0.00 1.07 0.00 0.00 27.48 28.98 1tvn h GLN 209 CO 0.05 0.92 0.44 1.15 -2.65 0.00 0.00 178.83 178.74 1tvn h THR 210 N 1.14 1.12 -0.28 2.39 2.02 -0.90 0.36 112.91 118.76 1tvn h THR 210 Ca 0.27 -0.30 -0.00 0.00 0.77 0.00 0.00 66.41 67.15 1tvn h THR 210 Cb 0.16 0.17 -0.01 0.00 -1.74 0.00 0.00 68.15 66.72 1tvn h THR 210 CO -0.03 0.16 0.16 0.00 0.37 0.00 0.00 175.52 176.18 1tvn h ALA 211 N 1.28 0.35 -0.82 6.16 0.00 -0.89 -0.21 119.26 125.13 1tvn h ALA 211 Ca 0.27 -0.06 -0.02 0.00 0.00 0.00 0.00 54.91 55.10 1tvn h ALA 211 Cb -0.03 -0.11 -0.04 0.00 0.00 0.00 0.00 17.79 17.61 1tvn h ALA 211 CO -0.09 -0.13 0.44 -0.07 0.00 0.00 0.00 179.25 179.40 1tvn h LEU 212 N 0.34 1.04 -1.35 0.00 3.38 -0.89 -2.08 115.31 115.75 1tvn h LEU 212 Ca 0.10 -0.11 -0.03 0.00 0.09 0.00 0.00 57.88 57.93 1tvn h LEU 212 Cb 0.04 -0.26 -0.02 0.00 0.09 0.00 0.00 40.66 40.50 1tvn h LEU 212 CO -0.02 0.85 0.10 0.44 0.09 0.00 0.00 178.44 179.90 1tvn h ASP 213 N 1.15 0.50 0.00 -0.43 3.32 -0.52 -1.46 116.42 118.97 1tvn h ASP 213 Ca 0.29 -0.06 0.00 0.00 0.02 0.00 0.00 57.03 57.27 1tvn h ASP 213 Cb 0.05 -0.13 0.00 0.00 0.22 0.00 0.00 39.33 39.47 1tvn h ASP 213 CO -0.04 0.49 0.00 0.59 -1.72 0.00 0.00 179.24 178.56 1tvn n ASN 214 N -4.35 0.00 0.00 6.45 3.02 -0.13 -4.92 115.26 115.34 1tvn n ASN 214 Ca 0.02 -1.18 0.00 0.00 -0.03 0.00 0.00 54.58 53.40 1tvn n ASN 214 Cb 0.18 0.00 0.00 0.00 -0.61 0.00 0.00 39.78 39.35 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 0.85 0.75 3.75 7.41 0.00 -0.55 -5.00 105.19 112.40 1tvn n GLY 215 Ca 0.19 -0.13 -0.30 0.00 0.00 0.00 0.00 46.02 45.77 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 4.37 0.14 -0.61 -4.36 -1.04 -3.53 121.20 114.17 1tvn s ILE 216 Ca 0.00 -0.83 -0.19 0.00 -0.26 0.00 0.00 60.65 59.38 1tvn s ILE 216 Cb 0.00 -3.09 -0.07 0.00 1.25 0.00 0.00 42.46 40.54 1tvn s ILE 216 CO 0.00 0.13 0.62 0.00 0.24 0.00 0.00 174.94 175.93 1tvn s ALA 217 N -1.35 3.53 0.11 2.27 0.00 -1.26 -4.19 121.76 120.87 1tvn s ALA 217 Ca 0.28 0.05 0.09 0.00 0.00 0.00 0.00 51.96 52.38 1tvn s ALA 217 Cb -0.12 -2.67 -0.04 0.00 0.00 0.00 0.00 23.12 20.29 1tvn s ALA 217 CO 0.20 0.39 -0.19 -0.51 0.00 0.00 0.00 175.76 175.65 1tvn s LEU 218 N -1.54 2.65 -0.11 0.00 1.43 -1.26 -0.87 118.68 118.98 1tvn s LEU 218 Ca 0.35 -0.57 -0.02 0.00 -1.03 0.00 0.00 54.13 52.86 1tvn s LEU 218 Cb -0.18 -1.51 0.04 0.00 0.03 0.00 0.00 46.19 44.57 1tvn s LEU 218 CO 0.20 0.18 0.03 0.12 0.23 0.00 0.00 176.35 177.11 1tvn s PHE 219 N -1.12 0.62 -1.30 0.29 2.19 -0.41 -4.52 117.98 113.73 1tvn s PHE 219 Ca 0.17 -0.29 -0.13 0.00 0.33 0.00 0.00 56.93 57.01 1tvn s PHE 219 Cb -0.10 -0.80 0.12 0.00 -1.31 0.00 0.00 43.02 40.93 1tvn s PHE 219 CO 0.09 -0.40 1.80 0.00 1.83 0.00 0.00 175.22 178.55 1tvn n ALA 220 N 5.16 4.62 0.19 11.12 0.00 -0.37 -2.13 120.51 139.11 1tvn n ALA 220 Ca -0.07 -4.11 0.09 0.00 0.00 0.00 0.00 53.44 49.35 1tvn n ALA 220 Cb 0.49 -3.25 0.45 0.00 0.00 0.00 0.00 19.45 17.14 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 4.70 1.18 -3.66 0.00 -2.24 -1.24 -1.57 114.28 111.44 1tvn n THR 221 Ca 0.44 0.58 -0.08 0.00 -2.27 0.00 0.00 64.05 62.71 1tvn n THR 221 Cb 0.41 -1.56 -0.09 0.00 -2.10 0.00 0.00 70.33 66.99 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 -3.38 0.56 -0.02 -0.78 2.12 -1.22 -4.25 118.70 111.72 1tvn s GLU 222 Ca -0.00 1.05 -0.28 0.00 0.36 0.00 0.00 54.97 56.09 1tvn s GLU 222 Cb 0.06 0.11 0.06 0.00 0.26 0.00 0.00 34.13 34.62 1tvn s GLU 222 CO 0.20 -0.16 0.62 1.67 -0.54 0.00 0.00 175.26 177.05 1tvn s TRP 223 N 1.63 -0.57 0.14 5.30 1.48 -0.91 -3.28 118.94 122.73 1tvn s TRP 223 Ca -0.09 0.92 0.07 0.00 -1.06 0.00 0.00 56.10 55.93 1tvn s TRP 223 Cb -0.07 0.37 -0.04 0.00 -1.16 0.00 0.00 33.47 32.58 1tvn s TRP 223 CO -0.17 -0.60 -0.15 0.20 -4.06 0.00 0.00 176.95 172.17 1tvn s GLY 224 N -1.37 1.21 0.08 3.67 0.00 -0.48 -0.41 107.32 110.01 1tvn s GLY 224 Ca -0.10 -1.40 0.25 0.00 0.00 0.00 0.00 44.72 43.47 1tvn s GLY 224 CO 0.07 -1.46 1.42 -1.30 0.00 0.00 0.00 173.10 171.82 1tvn n THR 225 N 0.32 0.22 -2.18 0.90 -2.24 -1.26 -0.68 114.28 109.36 1tvn n THR 225 Ca -0.14 -0.17 0.00 0.00 -2.27 0.00 0.00 64.05 61.48 1tvn n THR 225 Cb 0.58 -0.06 0.00 0.00 -2.10 0.00 0.00 70.33 68.75 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 -1.87 0.00 -1.55 2.28 0.24 -1.26 -1.28 118.33 114.89 1tvn n VAL 226 Ca 0.04 0.00 -0.31 0.00 -2.04 0.00 0.00 64.34 62.04 1tvn n VAL 226 Cb 0.40 -0.74 0.07 0.00 -1.47 0.00 0.00 33.84 32.10 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 -0.55 5.03 0.65 -1.34 0.01 0.20 -0.67 114.94 118.27 1tvn s ASN 227 Ca 0.00 1.52 0.35 0.00 -0.71 0.00 0.00 52.86 54.02 1tvn s ASN 227 Cb 0.00 -2.34 1.92 0.00 0.41 0.00 0.00 41.25 41.24 1tvn s ASN 227 CO 0.00 -1.66 2.08 0.00 -1.51 0.00 0.00 177.10 176.01 1tvn h ALA 228 N -0.87 1.19 -0.18 0.60 0.00 -1.84 0.10 119.26 118.25 1tvn h ALA 228 Ca -0.45 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.46 1tvn h ALA 228 Cb 1.23 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.02 1tvn h ALA 228 CO 0.57 -0.19 0.00 -0.40 0.00 0.00 0.00 179.25 179.24 1tvn n ASP 229 N -2.92 1.69 0.00 0.00 5.75 -1.26 -4.91 116.55 114.90 1tvn n ASP 229 Ca -0.02 -1.73 0.00 0.00 -0.01 0.00 0.00 54.79 53.03 1tvn n ASP 229 Cb 0.24 -0.12 0.00 0.00 -1.03 0.00 0.00 41.12 40.22 1tvn n ASP 229 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 1tvn n GLY 230 N 1.13 0.60 2.65 6.12 0.00 0.02 -5.04 105.19 110.66 1tvn n GLY 230 Ca 0.16 -0.17 -0.20 0.00 0.00 0.00 0.00 46.02 45.81 1tvn n GLY 230 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 1tvn n ASN 231 N 0.31 1.16 0.00 1.61 2.85 -1.24 -0.67 115.26 119.28 1tvn n ASN 231 Ca 0.00 -2.72 0.00 0.00 -0.11 0.00 0.00 54.58 51.75 1tvn n ASN 231 Cb 0.00 0.82 0.00 0.00 1.24 0.00 0.00 39.78 41.84 1tvn n ASN 231 CO 0.00 0.00 0.00 0.61 -2.11 0.00 0.00 177.26 175.76 1tvn n GLY 232 N -0.14 -0.18 3.82 8.20 0.00 -1.26 -0.63 105.19 115.00 1tvn n GLY 232 Ca -0.05 -1.87 -0.31 0.00 0.00 0.00 0.00 46.02 43.79 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 -1.03 1.66 -0.16 -0.02 0.00 -1.26 -4.59 107.32 101.92 1tvn s GLY 233 Ca 0.00 0.05 -0.29 0.00 0.00 0.00 0.00 44.72 44.48 1tvn s GLY 233 CO 0.00 0.37 1.13 0.14 0.00 0.00 0.00 173.10 174.74 1tvn s VAL 234 N -3.06 4.50 -0.75 1.40 1.01 -1.26 -4.32 120.40 117.92 1tvn s VAL 234 Ca 0.58 1.81 -0.19 0.00 0.00 0.00 0.00 61.98 64.18 1tvn s VAL 234 Cb -0.14 -4.17 0.12 0.00 0.00 0.00 0.00 36.38 32.20 1tvn s VAL 234 CO 0.55 -0.11 0.90 0.21 0.00 0.00 0.00 175.10 176.65 1tvn s ASN 235 N 1.47 6.42 0.20 3.32 3.84 -0.40 -4.90 114.94 124.88 1tvn s ASN 235 Ca 0.50 -1.76 -0.08 0.00 0.21 0.00 0.00 52.86 51.73 1tvn s ASN 235 Cb -0.19 -2.34 0.12 0.00 -0.55 0.00 0.00 41.25 38.28 1tvn s ASN 235 CO 0.13 -1.07 1.70 0.40 -2.79 0.00 0.00 177.10 175.47 1tvn h ILE 236 N 5.73 1.26 0.20 -5.21 1.08 -1.94 -0.84 117.51 117.80 1tvn h ILE 236 Ca -0.08 -1.02 0.00 0.00 -0.39 0.00 0.00 64.86 63.37 1tvn h ILE 236 Cb 1.06 0.60 -0.02 0.00 -3.07 0.00 0.00 36.82 35.39 1tvn h ILE 236 CO 1.07 0.39 -0.22 0.78 -0.69 0.00 0.00 178.15 179.48 1tvn h ASN 237 N 1.05 -0.58 -0.37 1.72 2.35 -1.97 0.14 115.58 117.92 1tvn h ASN 237 Ca 0.21 0.06 -0.12 0.00 -0.55 0.00 0.00 56.30 55.89 1tvn h ASN 237 Cb 0.42 0.20 -0.01 0.00 0.05 0.00 0.00 38.32 38.98 1tvn h ASN 237 CO 0.01 -0.32 -0.23 -0.33 -1.65 0.00 0.00 177.43 174.91 1tvn h GLU 238 N -0.46 0.87 -0.27 0.81 4.39 -1.84 -2.19 114.58 115.90 1tvn h GLU 238 Ca 0.00 -0.36 0.00 0.00 0.34 0.00 0.00 59.36 59.34 1tvn h GLU 238 Cb 0.43 -0.03 -0.01 0.00 -0.10 0.00 0.00 28.75 29.04 1tvn h GLU 238 CO -0.06 1.01 0.17 1.15 -1.16 0.00 0.00 179.01 180.12 1tvn h THR 239 N 0.75 1.09 -0.72 1.13 2.02 -0.89 -0.69 112.91 115.59 1tvn h THR 239 Ca 0.10 -0.19 -0.04 0.00 0.77 0.00 0.00 66.41 67.05 1tvn h THR 239 Cb 0.77 0.73 -0.03 0.00 -1.74 0.00 0.00 68.15 67.88 1tvn h THR 239 CO 0.06 0.09 0.31 0.44 0.37 0.00 0.00 175.52 176.79 1tvn h ASP 240 N 0.35 0.96 -0.40 4.18 3.32 -0.93 0.38 116.42 124.28 1tvn h ASP 240 Ca 0.10 -0.13 -0.06 0.00 0.02 0.00 0.00 57.03 56.96 1tvn h ASP 240 Cb -0.01 -0.25 -0.01 0.00 0.22 0.00 0.00 39.33 39.28 1tvn h ASP 240 CO -0.02 0.84 0.02 0.00 -1.72 0.00 0.00 179.24 178.36 1tvn h ALA 241 N 1.30 0.53 -0.50 3.45 0.00 -0.95 -0.72 119.26 122.37 1tvn h ALA 241 Ca 0.24 -0.24 -0.06 0.00 0.00 0.00 0.00 54.91 54.85 1tvn h ALA 241 Cb 0.16 -0.15 -0.02 0.00 0.00 0.00 0.00 17.79 17.79 1tvn h ALA 241 CO -0.02 0.29 0.07 -1.49 0.00 0.00 0.00 179.25 178.09 1tvn h TRP 242 N 0.52 0.90 -0.28 0.00 4.06 -0.80 -1.69 115.95 118.65 1tvn h TRP 242 Ca 0.12 -0.13 -0.06 0.00 2.06 0.00 0.00 58.89 60.88 1tvn h TRP 242 Cb 0.44 -0.24 -0.02 0.00 -1.00 0.00 0.00 29.16 28.34 1tvn h TRP 242 CO 0.03 0.82 -0.08 0.52 -3.56 0.00 0.00 178.44 176.18 1tvn h MET 243 N 0.71 0.45 -0.32 0.49 2.86 -0.74 -0.12 114.93 118.26 1tvn h MET 243 Ca 0.15 -0.11 -0.18 0.00 -2.06 0.00 0.00 59.70 57.50 1tvn h MET 243 Cb 0.42 -0.06 -0.00 0.00 0.06 0.00 0.00 31.60 32.02 1tvn h MET 243 CO 0.01 0.54 -0.49 0.00 1.06 0.00 0.00 176.91 178.04 1tvn h ALA 244 N 1.50 0.52 -0.75 6.32 0.00 -0.97 0.51 119.26 126.39 1tvn h ALA 244 Ca 0.09 -0.49 -0.02 0.00 0.00 0.00 0.00 54.91 54.48 1tvn h ALA 244 Cb 0.41 -0.09 -0.03 0.00 0.00 0.00 0.00 17.79 18.07 1tvn h ALA 244 CO 0.02 0.68 0.38 0.35 0.00 0.00 0.00 179.25 180.68 1tvn h PHE 245 N 0.69 1.05 -0.33 0.00 3.57 -0.85 -0.94 116.94 120.14 1tvn h PHE 245 Ca 0.03 -0.04 -0.12 0.00 3.53 0.00 0.00 57.97 61.37 1tvn h PHE 245 Cb 1.09 -0.33 -0.01 0.00 2.79 0.00 0.00 35.95 39.49 1tvn h PHE 245 CO 0.07 0.76 -0.26 0.74 -2.23 0.00 0.00 178.31 177.38 1tvn h PHE 246 N 1.04 0.89 -0.79 0.41 0.05 -0.68 -3.04 116.94 114.82 1tvn h PHE 246 Ca 0.26 -0.25 -0.01 0.00 3.82 0.00 0.00 57.97 61.79 1tvn h PHE 246 Cb 0.08 -0.19 -0.04 0.00 2.00 0.00 0.00 35.95 37.80 1tvn h PHE 246 CO 0.00 1.01 0.45 -0.22 -0.18 0.00 0.00 178.31 179.37 1tvn h LYS 247 N 0.52 1.09 -0.04 1.51 3.64 -0.63 -0.55 116.57 122.12 1tvn h LYS 247 Ca 0.06 -0.12 0.00 0.00 -1.27 0.00 0.00 60.65 59.32 1tvn h LYS 247 Cb 0.83 -0.22 0.00 0.00 -0.41 0.00 0.00 32.23 32.43 1tvn h LYS 247 CO 0.07 0.79 0.00 0.25 -2.27 0.00 0.00 179.45 178.29 1tvn n THR 248 N -4.44 0.05 -0.72 1.00 -2.24 -0.38 -3.27 114.28 104.28 1tvn n THR 248 Ca 0.08 -0.06 0.00 0.00 -2.27 0.00 0.00 64.05 61.80 1tvn n THR 248 Cb 0.08 -0.11 0.00 0.00 -2.10 0.00 0.00 70.33 68.20 1tvn n THR 248 CO 0.00 0.00 0.00 0.59 -0.57 0.00 0.00 175.07 175.09 1tvn n ASN 249 N -0.53 0.56 -3.83 3.42 3.02 -0.88 -5.02 115.26 112.00 1tvn n ASN 249 Ca 0.10 -1.27 -0.27 0.00 -0.03 0.00 0.00 54.58 53.11 1tvn n ASN 249 Cb 0.09 0.00 0.03 0.00 -0.61 0.00 0.00 39.78 39.28 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 -0.14 -3.34 -4.60 6.41 3.02 -0.35 -4.93 115.26 111.33 1tvn n ASN 250 Ca 0.00 -0.80 -0.39 0.00 -0.03 0.00 0.00 54.58 53.36 1tvn n ASN 250 Cb 0.42 -3.94 -0.09 0.00 -0.61 0.00 0.00 39.78 35.56 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 -3.46 5.18 0.63 2.41 1.01 -0.39 -4.67 121.20 121.92 1tvn s ILE 251 Ca 0.40 0.52 -0.12 0.00 0.00 0.00 0.00 60.65 61.45 1tvn s ILE 251 Cb -0.20 -3.69 -0.03 0.00 0.01 0.00 0.00 42.46 38.55 1tvn s ILE 251 CO 0.82 0.15 1.04 -0.44 0.00 0.00 0.00 174.94 176.52 1tvn s SER 252 N 1.65 5.94 0.10 3.58 0.01 -1.26 -4.66 113.70 119.06 1tvn s SER 252 Ca 0.14 1.56 -0.22 0.00 1.31 0.00 0.00 55.95 58.74 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 0.10 -1.06 0.53 -1.38 0.41 0.00 0.00 173.24 171.84 1tvn s HIS 253 N -2.97 -0.43 -0.07 2.43 -3.43 -0.49 -1.23 115.29 109.10 1tvn s HIS 253 Ca 0.58 0.32 0.00 0.00 -0.80 0.00 0.00 55.06 55.15 1tvn s HIS 253 Cb -0.12 0.40 0.02 0.00 -1.43 0.00 0.00 32.58 31.45 1tvn s HIS 253 CO 0.49 -0.73 -0.05 0.00 -2.00 0.00 0.00 174.74 172.45 1tvn s ALA 254 N -3.17 0.95 0.13 -1.38 0.00 -0.61 -2.21 121.76 115.48 1tvn s ALA 254 Ca -0.01 -0.27 -0.26 0.00 0.00 0.00 0.00 51.96 51.42 1tvn s ALA 254 Cb -0.00 -0.66 -0.07 0.00 0.00 0.00 0.00 23.12 22.39 1tvn s ALA 254 CO -0.08 -0.22 0.79 1.21 0.00 0.00 0.00 175.76 177.47 1tvn s ASN 255 N 1.36 7.36 -0.24 0.00 3.84 -0.79 -2.13 114.94 124.33 1tvn s ASN 255 Ca -0.03 1.61 -0.13 0.00 0.21 0.00 0.00 52.86 54.51 1tvn s ASN 255 Cb -0.14 -2.50 -0.04 0.00 -0.55 0.00 0.00 41.25 38.02 1tvn s ASN 255 CO -0.03 0.13 0.29 0.86 -2.79 0.00 0.00 177.10 175.56 1tvn s TRP 256 N -0.75 3.30 -0.01 0.43 -0.11 0.45 -0.05 118.94 122.20 1tvn s TRP 256 Ca 0.37 0.37 -0.19 0.00 1.22 0.00 0.00 56.10 57.87 1tvn s TRP 256 Cb -0.22 -2.44 0.04 0.00 -1.50 0.00 0.00 33.47 29.34 1tvn s TRP 256 CO 0.26 -0.07 0.42 0.00 -4.62 0.00 0.00 176.95 172.94 1tvn s ALA 257 N 1.51 -1.07 -0.64 5.86 0.00 -0.58 -4.63 121.76 122.21 1tvn s ALA 257 Ca 0.13 0.57 -0.28 0.00 0.00 0.00 0.00 51.96 52.38 1tvn s ALA 257 Cb -0.15 0.11 0.03 0.00 0.00 0.00 0.00 23.12 23.11 1tvn s ALA 257 CO 0.08 -0.33 1.23 -1.17 0.00 0.00 0.00 175.76 175.57 1tvn s LEU 258 N -1.43 3.35 0.02 0.00 0.20 0.21 -0.90 118.68 120.13 1tvn s LEU 258 Ca -0.11 -0.08 -0.28 0.00 0.69 0.00 0.00 54.13 54.34 1tvn s LEU 258 Cb -0.03 -2.95 0.10 0.00 -0.43 0.00 0.00 46.19 42.88 1tvn s LEU 258 CO 0.04 -1.62 1.23 0.21 -0.29 0.00 0.00 176.35 175.93 1tvn s ASN 259 N 3.28 -0.04 -0.07 3.68 2.47 -1.26 -3.20 114.94 119.80 1tvn s ASN 259 Ca 0.41 -0.24 0.11 0.00 0.42 0.00 0.00 52.86 53.56 1tvn s ASN 259 Cb -0.08 0.22 0.21 0.00 -1.45 0.00 0.00 41.25 40.15 1tvn s ASN 259 CO 0.22 -0.42 1.10 -0.90 -3.72 0.00 0.00 177.10 173.37 1tvn n ASP 260 N -0.75 1.10 -4.75 -4.21 5.75 -1.26 -1.99 116.55 110.43 1tvn n ASP 260 Ca -0.04 -2.57 -0.35 0.00 -0.01 0.00 0.00 54.79 51.82 1tvn n ASP 260 Cb 0.61 -0.33 0.05 0.00 -1.03 0.00 0.00 41.12 40.42 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 -1.29 2.75 -1.11 0.11 2.20 -1.26 -3.80 119.74 117.34 1tvn s LYS 261 Ca 0.20 1.79 -0.19 0.00 -0.36 0.00 0.00 55.97 57.41 1tvn s LYS 261 Cb 0.19 -1.90 -0.06 0.00 -1.51 0.00 0.00 37.83 34.55 1tvn s LYS 261 CO -0.02 -1.37 2.01 -1.71 -0.36 0.00 0.00 175.35 173.89 1tvn n ASN 262 N -1.92 3.32 -3.60 1.43 5.15 -1.26 -4.64 115.26 113.72 1tvn n ASN 262 Ca 0.13 -2.76 -0.14 0.00 -0.60 0.00 0.00 54.58 51.21 1tvn n ASN 262 Cb 0.50 -1.45 -0.06 0.00 -0.53 0.00 0.00 39.78 38.24 1tvn n ASN 262 CO 0.00 0.00 0.00 -1.83 1.40 0.00 0.00 177.26 176.83 1tvn s GLU 263 N 4.51 0.99 0.54 1.20 -1.05 -1.26 -5.07 118.70 118.55 1tvn s GLU 263 Ca 0.55 -0.24 0.21 0.00 -0.15 0.00 0.00 54.97 55.34 1tvn s GLU 263 Cb 0.11 0.45 1.42 0.00 -0.44 0.00 0.00 34.13 35.67 1tvn s GLU 263 CO 0.05 -0.35 2.13 0.78 0.95 0.00 0.00 175.26 178.82 1tvn h GLY 264 N 2.90 0.00 2.00 -3.83 0.00 -1.79 -2.51 103.07 99.84 1tvn h GLY 264 Ca -0.31 0.00 -0.01 0.00 0.00 0.00 0.00 47.33 47.01 1tvn h GLY 264 CO 0.42 0.00 -0.07 0.00 0.00 0.00 0.00 176.54 176.89 1tvn h ALA 265 N 1.93 1.04 -2.89 3.60 0.00 -1.20 -3.40 119.26 118.33 1tvn h ALA 265 Ca 0.06 -0.06 -0.53 0.00 0.00 0.00 0.00 54.91 54.37 1tvn h ALA 265 Cb 0.24 -0.01 0.09 0.00 0.00 0.00 0.00 17.79 18.11 1tvn h ALA 265 CO -0.00 0.09 0.79 -1.12 0.00 0.00 0.00 179.25 179.00 1tvn s SER 266 N -5.83 6.43 0.25 0.00 0.01 -0.95 -1.52 113.70 112.08 1tvn s SER 266 Ca 0.00 2.95 -0.00 0.00 1.31 0.00 0.00 55.95 60.21 1tvn s SER 266 Cb 0.10 -2.65 0.30 0.00 0.21 0.00 0.00 66.02 63.98 1tvn s SER 266 CO 0.56 -0.83 1.67 -0.07 0.41 0.00 0.00 173.24 174.98 1tvn h LEU 267 N 3.64 0.60 -9.56 2.44 3.38 -0.89 -3.38 115.31 111.54 1tvn h LEU 267 Ca -0.49 -0.22 -0.62 0.00 0.09 0.00 0.00 57.88 56.63 1tvn h LEU 267 Cb 1.23 -0.16 -0.10 0.00 0.09 0.00 0.00 40.66 41.71 1tvn h LEU 267 CO 0.69 0.85 -0.63 -0.36 0.09 0.00 0.00 178.44 179.08 1tvn s PHE 268 N -4.48 3.01 0.70 1.13 2.99 -0.84 -1.23 117.98 119.26 1tvn s PHE 268 Ca -0.08 -0.04 -0.12 0.00 0.00 0.00 0.00 56.93 56.70 1tvn s PHE 268 Cb 0.13 -1.51 0.02 0.00 0.00 0.00 0.00 43.02 41.66 1tvn s PHE 268 CO 0.81 0.50 1.08 0.95 -0.00 0.00 0.00 175.22 178.56 1tvn s THR 269 N -1.50 3.64 -0.00 0.64 -4.23 -0.66 -4.39 115.64 109.14 1tvn s THR 269 Ca 0.28 0.60 -0.36 0.00 -1.18 0.00 0.00 61.69 61.03 1tvn s THR 269 Cb -0.11 -3.19 -0.14 0.00 1.34 0.00 0.00 72.50 70.40 1tvn s THR 269 CO 0.20 -0.63 1.65 -2.65 -0.54 0.00 0.00 174.62 172.65 1tvn n PRO 270 N -2.97 1.79 -0.90 3.99 -0.02 -1.25 -0.06 135.00 135.58 1tvn n PRO 270 Ca 0.09 0.65 0.00 0.00 -2.02 0.00 0.00 63.50 62.22 1tvn n PRO 270 Cb 0.53 -2.40 0.00 0.00 -0.02 0.00 0.00 33.50 31.61 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 3.67 0.62 2.77 -1.23 0.00 -1.26 -4.99 105.19 104.77 1tvn n GLY 271 Ca 0.21 0.00 -0.16 0.00 0.00 0.00 0.00 46.02 46.07 1tvn n GLY 271 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1tvn n GLY 272 N -1.96 0.88 0.00 -0.02 0.00 0.91 -5.13 105.19 99.86 1tvn n GLY 272 Ca 0.00 -2.04 0.00 0.00 0.00 0.00 0.00 46.02 43.98 1tvn n GLY 272 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 1tvn n SER 273 N -2.87 0.00 0.12 1.61 2.88 -1.26 -4.74 113.62 109.36 1tvn n SER 273 Ca 0.12 0.00 0.19 0.00 -1.33 0.00 0.00 58.87 57.85 1tvn n SER 273 Cb 0.42 0.00 0.77 0.00 -0.75 0.00 0.00 64.21 64.65 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 0.00 -0.00 0.66 4.06 -2.00 -0.01 115.95 118.66 1tvn h TRP 274 Ca 0.00 0.00 0.00 0.00 2.06 0.00 0.00 58.89 60.95 1tvn h TRP 274 Cb 0.00 0.00 0.00 0.00 -1.00 0.00 0.00 29.16 28.16 1tvn h TRP 274 CO 0.00 0.00 -0.30 0.09 -3.56 0.00 0.00 178.44 174.67 1tvn n ASN 275 N -3.84 0.67 -3.42 -3.49 3.02 -1.26 -4.43 115.26 102.51 1tvn n ASN 275 Ca 0.05 -0.51 -0.26 0.00 -0.03 0.00 0.00 54.58 53.83 1tvn n ASN 275 Cb 0.50 0.09 -0.09 0.00 -0.61 0.00 0.00 39.78 39.67 1tvn n ASN 275 CO 0.00 0.00 0.00 -0.24 -2.62 0.00 0.00 177.26 174.40 1tvn n SER 276 N -1.06 1.42 -4.85 6.41 2.88 -0.02 -5.10 113.62 113.29 1tvn n SER 276 Ca 0.10 -2.90 -0.32 0.00 -1.33 0.00 0.00 58.87 54.42 1tvn n SER 276 Cb 0.33 -0.65 -0.05 0.00 -0.75 0.00 0.00 64.21 63.09 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 -1.27 3.93 0.00 2.46 1.43 -1.25 -1.65 118.68 122.33 1tvn s LEU 277 Ca 0.34 1.32 -0.13 0.00 -1.03 0.00 0.00 54.13 54.63 1tvn s LEU 277 Cb 0.10 -4.17 0.21 0.00 0.03 0.00 0.00 46.19 42.36 1tvn s LEU 277 CO -0.12 -0.33 1.28 0.35 0.23 0.00 0.00 176.35 177.77 1tvn n THR 278 N -0.82 0.00 -0.29 5.49 -2.24 -0.36 -4.72 114.28 111.35 1tvn n THR 278 Ca 0.04 -1.12 -0.04 0.00 -2.27 0.00 0.00 64.05 60.65 1tvn n THR 278 Cb 0.54 -1.37 0.07 0.00 -2.10 0.00 0.00 70.33 67.46 1tvn n THR 278 CO 0.00 0.00 0.00 -1.28 -0.57 0.00 0.00 175.07 173.22 1tvn h SER 279 N -1.53 0.93 -0.34 3.42 0.87 -1.89 0.26 113.55 115.27 1tvn h SER 279 Ca -0.42 -0.05 -0.03 0.00 -1.23 0.00 0.00 61.79 60.07 1tvn h SER 279 Cb 1.21 -0.23 -0.01 0.00 -0.44 0.00 0.00 62.40 62.92 1tvn h SER 279 CO 0.32 0.70 0.11 -1.28 -0.53 0.00 0.00 176.83 176.15 1tvn h SER 280 N 1.07 0.49 -0.91 6.23 0.87 -1.85 -2.45 113.55 117.01 1tvn h SER 280 Ca 0.28 -0.20 0.03 0.00 -1.23 0.00 0.00 61.79 60.67 1tvn h SER 280 Cb -0.07 -0.13 -0.05 0.00 -0.44 0.00 0.00 62.40 61.71 1tvn h SER 280 CO -0.06 0.57 0.60 1.23 -0.53 0.00 0.00 176.83 178.64 1tvn h GLY 281 N 0.39 1.30 1.00 5.77 0.00 -1.56 0.36 103.07 110.32 1tvn h GLY 281 Ca 0.11 -0.45 -0.05 0.00 0.00 0.00 0.00 47.33 46.94 1tvn h GLY 281 CO -0.00 0.41 0.16 1.76 0.00 0.00 0.00 176.54 178.86 1tvn h SER 282 N 1.16 0.83 -0.32 0.19 0.02 -0.73 0.23 113.55 114.93 1tvn h SER 282 Ca 0.35 -0.22 -0.13 0.00 -0.84 0.00 0.00 61.79 60.95 1tvn h SER 282 Cb -0.02 -0.22 -0.00 0.00 0.14 0.00 0.00 62.40 62.30 1tvn h SER 282 CO -0.10 0.83 -0.32 0.50 -1.14 0.00 0.00 176.83 176.60 1tvn h LYS 283 N 0.79 0.78 -0.69 3.45 1.63 -0.94 -2.95 116.57 118.63 1tvn h LYS 283 Ca 0.18 -0.41 -0.05 0.00 -0.85 0.00 0.00 60.65 59.52 1tvn h LYS 283 Cb 0.31 0.01 -0.03 0.00 -0.60 0.00 0.00 32.23 31.92 1tvn h LYS 283 CO -0.00 1.04 0.23 0.28 -3.45 0.00 0.00 179.45 177.54 1tvn h VAL 284 N 0.55 1.25 -0.40 2.00 2.07 -0.79 -1.43 116.25 119.49 1tvn h VAL 284 Ca 0.05 -0.84 0.04 0.00 0.82 0.00 0.00 66.70 66.77 1tvn h VAL 284 Cb 0.89 0.48 -0.04 0.00 -1.52 0.00 0.00 31.29 31.10 1tvn h VAL 284 CO 0.08 0.33 0.17 0.50 0.02 0.00 0.00 177.57 178.67 1tvn h LYS 285 N 1.01 0.34 -0.63 1.57 3.64 -0.90 -0.03 116.57 121.58 1tvn h LYS 285 Ca 0.23 -0.02 -0.08 0.00 -1.27 0.00 0.00 60.65 59.50 1tvn h LYS 285 Cb 0.27 -0.08 -0.02 0.00 -0.41 0.00 0.00 32.23 31.99 1tvn h LYS 285 CO -0.01 0.23 0.08 0.93 -2.27 0.00 0.00 179.45 178.41 1tvn h GLU 286 N 0.35 1.07 -0.01 1.90 5.08 -1.25 -0.81 114.58 120.91 1tvn h GLU 286 Ca 0.18 -0.30 -0.00 0.00 -1.00 0.00 0.00 59.36 58.24 1tvn h GLU 286 Cb 0.13 -0.12 -0.00 0.00 0.50 0.00 0.00 28.75 29.26 1tvn h GLU 286 CO -0.15 1.00 0.01 0.82 -1.00 0.00 0.00 179.01 179.68 1tvn h ILE 287 N 0.98 1.13 -0.64 3.13 2.04 -0.74 -1.43 117.51 121.97 1tvn h ILE 287 Ca 0.19 -0.37 -0.09 0.00 1.00 0.00 0.00 64.86 65.59 1tvn h ILE 287 Cb 0.47 1.35 -0.02 0.00 -0.74 0.00 0.00 36.82 37.87 1tvn h ILE 287 CO 0.02 0.10 0.05 0.40 0.00 0.00 0.00 178.15 178.72 1tvn h ILE 288 N -0.13 1.27 -0.34 -0.67 2.04 -0.96 -2.22 117.51 116.48 1tvn h ILE 288 Ca 0.00 -1.10 -0.08 0.00 1.00 0.00 0.00 64.86 64.68 1tvn h ILE 288 Cb 0.16 0.71 -0.02 0.00 -0.74 0.00 0.00 36.82 36.93 1tvn h ILE 288 CO -0.00 0.41 -0.11 1.56 0.00 0.00 0.00 178.15 180.01 1tvn h GLN 289 N 1.02 0.59 -0.36 2.37 4.20 -0.97 -2.48 115.11 119.47 1tvn h GLN 289 Ca 0.19 -0.17 0.00 0.00 0.06 0.00 0.00 58.65 58.73 1tvn h GLN 289 Cb 0.51 -0.06 0.00 0.00 0.30 0.00 0.00 27.48 28.23 1tvn h GLN 289 CO 0.02 0.69 0.00 0.41 -0.67 0.00 0.00 178.83 179.28 1tvn n GLY 290 N -0.59 0.82 0.00 3.46 0.00 -0.54 -5.00 105.19 103.33 1tvn n GLY 290 Ca 0.01 -0.45 0.11 0.00 0.00 0.00 0.00 46.02 45.69 1tvn n GLY 290 CO 0.00 0.00 0.00 1.87 0.00 0.00 0.00 173.32 175.19