#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3hys s ASN -12 N 0.00 3.28 0.05 1.62 0.02 -1.26 -5.11 114.94 113.54 3hys s ASN -12 Ca 0.00 -2.01 -0.00 0.00 -1.02 0.00 0.00 52.86 49.83 3hys s ASN -12 Cb 0.00 -0.52 -0.04 0.00 0.02 0.00 0.00 41.25 40.71 3hys s ASN -12 CO 0.00 -0.34 0.20 -0.76 0.02 0.00 0.00 177.10 176.22 3hys s LEU -11 N 1.24 4.36 0.03 0.60 1.43 -1.25 -5.02 118.68 120.06 3hys s LEU -11 Ca 0.15 0.28 -0.00 0.00 -1.03 0.00 0.00 54.13 53.53 3hys s LEU -11 Cb -0.21 -2.90 -0.02 0.00 0.03 0.00 0.00 46.19 43.09 3hys s LEU -11 CO -0.10 0.19 -0.03 -0.31 0.23 0.00 0.00 176.35 176.33 3hys s TYR -10 N -1.48 0.32 0.14 0.29 1.51 -1.26 -1.28 117.35 115.59 3hys s TYR -10 Ca 0.34 -0.65 0.05 0.00 -1.01 0.00 0.00 57.07 55.80 3hys s TYR -10 Cb -0.13 -0.23 -0.04 0.00 -0.11 0.00 0.00 41.96 41.45 3hys s TYR -10 CO 0.26 -0.23 -0.12 -0.59 -1.11 0.00 0.00 175.55 173.76 3hys s PHE -9 N -2.02 1.34 -0.23 2.71 -0.71 -0.64 -4.92 117.98 113.52 3hys s PHE -9 Ca -0.11 -0.65 -0.29 0.00 -1.04 0.00 0.00 56.93 54.84 3hys s PHE -9 Cb -0.06 -0.68 -0.00 0.00 -1.21 0.00 0.00 43.02 41.07 3hys s PHE -9 CO -0.03 0.13 1.20 -1.14 -1.34 0.00 0.00 175.22 174.04 3hys s GLN -8 N -3.25 4.14 0.97 1.99 0.74 -1.26 -1.25 119.66 121.75 3hys s GLN -8 Ca 0.13 1.43 -0.15 0.00 0.05 0.00 0.00 55.36 56.83 3hys s GLN -8 Cb -0.01 -3.76 0.18 0.00 1.10 0.00 0.00 33.01 30.51 3hys s GLN -8 CO 0.02 -0.81 1.18 0.20 -0.55 0.00 0.00 175.29 175.33 3hys s GLY -7 N 1.97 1.63 0.77 2.59 0.00 0.69 -4.83 107.32 110.14 3hys s GLY -7 Ca 0.52 -0.79 -0.13 0.00 0.00 0.00 0.00 44.72 44.32 3hys s GLY -7 CO 0.15 -0.12 1.15 0.00 0.00 0.00 0.00 173.10 174.28 3hys s ALA -6 N -3.41 2.07 0.18 3.20 0.00 -1.26 -4.55 121.76 117.99 3hys s ALA -6 Ca 0.68 0.62 -0.31 0.00 0.00 0.00 0.00 51.96 52.95 3hys s ALA -6 Cb -0.11 -3.39 -0.09 0.00 0.00 0.00 0.00 23.12 19.53 3hys s ALA -6 CO 0.53 -1.93 1.39 1.41 0.00 0.00 0.00 175.76 177.17 3hys s MET -5 N -4.31 4.32 0.74 0.00 1.75 -1.26 -4.47 119.30 116.06 3hys s MET -5 Ca 0.68 2.15 -0.02 0.00 -1.25 0.00 0.00 55.69 57.25 3hys s MET -5 Cb -0.23 -3.19 0.13 0.00 2.84 0.00 0.00 34.83 34.38 3hys s MET -5 CO 0.49 -0.39 1.02 0.16 -0.65 0.00 0.00 175.02 175.66 3hys s ASP -4 N 0.66 4.25 0.00 1.11 1.47 0.25 -4.91 116.67 119.49 3hys s ASP -4 Ca 0.61 -0.28 0.19 0.00 1.18 0.00 0.00 52.55 54.25 3hys s ASP -4 Cb -0.39 -0.08 0.91 0.00 -0.34 0.00 0.00 42.92 43.02 3hys s ASP -4 CO 0.36 -1.93 1.58 -2.65 0.68 0.00 0.00 175.17 173.21 3hys n PRO -3 N -2.92 0.21 -0.66 2.11 -0.02 -1.26 -1.07 135.00 131.39 3hys n PRO -3 Ca 0.15 0.12 0.08 0.00 -2.02 0.00 0.00 63.50 61.83 3hys n PRO -3 Cb 0.60 -1.50 0.34 0.00 -0.02 0.00 0.00 33.50 32.92 3hys n PRO -3 CO 0.00 0.00 0.00 0.39 1.98 0.00 0.00 175.50 177.87 3hys n GLU -2 N -1.33 3.93 -1.60 -0.52 4.71 -1.26 -4.95 120.64 119.62 3hys n GLU -2 Ca 0.08 -2.95 -0.13 0.00 -0.01 0.00 0.00 57.16 54.16 3hys n GLU -2 Cb 0.16 -2.00 -0.04 0.00 -1.01 0.00 0.00 31.44 28.55 3hys n GLU -2 CO 0.00 0.00 0.00 1.19 0.09 0.00 0.00 177.13 178.41 3hys n PHE -1 N 0.35 -0.16 -3.97 -0.32 3.72 -0.24 -5.01 117.46 111.84 3hys n PHE -1 Ca 0.24 0.00 -0.34 0.00 -0.05 0.00 0.00 57.45 57.30 3hys n PHE -1 Cb 1.00 -2.43 -0.06 0.00 -0.94 0.00 0.00 39.48 37.05 3hys n PHE -1 CO 0.00 0.00 0.00 1.03 -0.05 0.00 0.00 176.76 177.74 3hys s ARG 0 N -3.48 3.33 -0.21 -1.08 0.52 -1.26 -4.85 118.95 111.92 3hys s ARG 0 Ca 0.00 -0.32 -0.03 0.00 -0.52 0.00 0.00 55.73 54.86 3hys s ARG 0 Cb 0.00 -3.05 -0.00 0.00 0.52 0.00 0.00 34.95 32.42 3hys s ARG 0 CO 0.00 0.69 -0.08 0.08 0.02 0.00 0.00 175.30 176.02 3hys s VAL 1 N -1.21 3.09 0.34 3.52 1.01 -1.26 -0.59 120.40 125.31 3hys s VAL 1 Ca 0.23 -0.59 0.09 0.00 0.00 0.00 0.00 61.98 61.71 3hys s VAL 1 Cb -0.12 -2.39 -0.05 0.00 0.00 0.00 0.00 36.38 33.81 3hys s VAL 1 CO 0.13 0.45 0.02 0.27 0.00 0.00 0.00 175.10 175.97 3hys s ILE 2 N 1.44 2.63 0.09 2.22 -4.36 -1.26 -5.00 121.20 116.96 3hys s ILE 2 Ca 0.06 -1.95 -0.04 0.00 -0.26 0.00 0.00 60.65 58.45 3hys s ILE 2 Cb -0.14 -2.81 -0.05 0.00 1.25 0.00 0.00 42.46 40.71 3hys s ILE 2 CO -0.05 -0.19 0.31 0.20 0.24 0.00 0.00 174.94 175.45 3hys s ASN 3 N -3.73 6.46 -0.05 4.36 0.01 -1.26 -0.22 114.94 120.50 3hys s ASN 3 Ca 0.35 0.50 0.04 0.00 -0.71 0.00 0.00 52.86 53.04 3hys s ASN 3 Cb 0.00 -2.06 0.00 0.00 0.41 0.00 0.00 41.25 39.60 3hys s ASN 3 CO 0.20 0.12 -0.17 -0.76 -1.51 0.00 0.00 177.10 174.98 3hys s LEU 4 N -2.44 1.88 0.30 0.60 1.43 -0.38 -4.85 118.68 115.22 3hys s LEU 4 Ca 0.37 -0.37 -0.28 0.00 -1.03 0.00 0.00 54.13 52.82 3hys s LEU 4 Cb -0.13 -0.99 -0.09 0.00 0.03 0.00 0.00 46.19 45.01 3hys s LEU 4 CO 0.24 0.13 1.02 0.00 0.23 0.00 0.00 176.35 177.96 3hys s ALA 5 N 0.21 3.29 0.20 4.21 0.00 -1.26 -1.61 121.76 126.80 3hys s ALA 5 Ca -0.08 0.71 0.00 0.00 0.00 0.00 0.00 51.96 52.59 3hys s ALA 5 Cb -0.13 -3.26 -0.04 0.00 0.00 0.00 0.00 23.12 19.69 3hys s ALA 5 CO 0.03 -0.00 0.09 1.52 0.00 0.00 0.00 175.76 177.40 3hys s TYR 6 N -1.34 1.21 0.04 0.00 1.13 -0.40 -1.38 117.35 116.61 3hys s TYR 6 Ca 0.47 -1.24 0.06 0.00 -1.41 0.00 0.00 57.07 54.95 3hys s TYR 6 Cb -0.26 -0.66 -0.02 0.00 -1.10 0.00 0.00 41.96 39.92 3hys s TYR 6 CO 0.33 -0.47 -0.17 0.34 -2.51 0.00 0.00 175.55 173.07 3hys s ASP 7 N -3.18 2.03 -0.13 -0.18 -1.08 0.13 -3.75 116.67 110.51 3hys s ASP 7 Ca 0.33 -0.48 -0.04 0.00 -0.52 0.00 0.00 52.55 51.84 3hys s ASP 7 Cb 0.07 -0.15 0.06 0.00 -1.46 0.00 0.00 42.92 41.44 3hys s ASP 7 CO 0.09 0.10 0.12 -0.62 0.52 0.00 0.00 175.17 175.38 3hys s ASP 8 N -1.13 1.59 0.02 -0.34 -1.08 -1.26 -2.07 116.67 112.40 3hys s ASP 8 Ca 0.04 -0.20 0.04 0.00 -0.52 0.00 0.00 52.55 51.91 3hys s ASP 8 Cb -0.08 0.00 -0.02 0.00 -1.46 0.00 0.00 42.92 41.36 3hys s ASP 8 CO 0.01 -0.30 -0.13 0.20 0.52 0.00 0.00 175.17 175.47 3hys s ASN 9 N 2.21 1.51 0.00 -0.34 0.01 -0.56 -4.99 114.94 112.79 3hys s ASN 9 Ca 0.04 -0.38 0.00 0.00 -0.71 0.00 0.00 52.86 51.81 3hys s ASN 9 Cb -0.14 -0.11 0.00 0.00 0.41 0.00 0.00 41.25 41.40 3hys s ASN 9 CO -0.08 0.06 0.00 0.61 -1.51 0.00 0.00 177.10 176.18 3hys n GLY 10 N 2.18 -0.21 0.00 0.66 0.00 -1.26 -0.23 105.19 106.33 3hys n GLY 10 Ca -0.17 -1.80 0.00 0.00 0.00 0.00 0.00 46.02 44.05 3hys n GLY 10 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 3hys n THR 11 N -0.17 0.00 -0.00 2.61 -2.24 -1.26 -4.79 114.28 108.43 3hys n THR 11 Ca 0.00 -0.29 0.00 0.00 -2.27 0.00 0.00 64.05 61.49 3hys n THR 11 Cb 0.00 1.08 0.00 0.00 -2.10 0.00 0.00 70.33 69.31 3hys n THR 11 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3hys n GLY 12 N 0.46 0.91 3.70 3.38 0.00 -1.26 -4.88 105.19 107.50 3hys n GLY 12 Ca 0.00 -1.49 -0.42 0.00 0.00 0.00 0.00 46.02 44.11 3hys n GLY 12 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 3hys s ASP 13 N -1.00 6.78 0.10 1.61 1.11 -0.99 -3.96 116.67 120.32 3hys s ASP 13 Ca 0.00 2.30 -0.31 0.00 0.18 0.00 0.00 52.55 54.72 3hys s ASP 13 Cb 0.00 -2.57 -0.07 0.00 1.07 0.00 0.00 42.92 41.35 3hys s ASP 13 CO 0.00 -0.73 1.23 -2.84 1.18 0.00 0.00 175.17 174.01 3hys s PRO 14 N 1.85 4.43 -0.11 8.23 0.02 -1.26 -0.93 135.00 147.23 3hys s PRO 14 Ca 0.66 1.85 0.04 0.00 0.02 0.00 0.00 61.00 63.57 3hys s PRO 14 Cb -0.36 -3.30 0.00 0.00 0.02 0.00 0.00 34.50 30.86 3hys s PRO 14 CO 0.29 -0.25 -0.23 0.08 -0.33 0.00 0.00 177.00 176.56 3hys s VAL 15 N 0.79 2.05 -0.25 3.83 1.01 0.12 -3.25 120.40 124.71 3hys s VAL 15 Ca 0.58 -1.01 -0.12 0.00 0.00 0.00 0.00 61.98 61.44 3hys s VAL 15 Cb -0.32 -1.78 -0.05 0.00 0.00 0.00 0.00 36.38 34.23 3hys s VAL 15 CO 0.31 0.56 0.22 -0.69 0.00 0.00 0.00 175.10 175.50 3hys s VAL 16 N 0.44 5.30 -0.18 2.92 1.01 0.17 -0.56 120.40 129.50 3hys s VAL 16 Ca -0.16 0.29 -0.09 0.00 0.00 0.00 0.00 61.98 62.01 3hys s VAL 16 Cb -0.17 -3.56 -0.05 0.00 0.00 0.00 0.00 36.38 32.60 3hys s VAL 16 CO 0.07 0.28 0.13 -0.36 0.00 0.00 0.00 175.10 175.21 3hys s PHE 17 N 1.45 3.43 -0.24 5.22 0.08 -0.42 -0.73 117.98 126.78 3hys s PHE 17 Ca 0.10 0.35 0.02 0.00 0.12 0.00 0.00 56.93 57.52 3hys s PHE 17 Cb -0.15 -2.11 0.05 0.00 -0.57 0.00 0.00 43.02 40.24 3hys s PHE 17 CO 0.08 0.36 -0.13 0.42 -0.10 0.00 0.00 175.22 175.85 3hys s ILE 18 N 0.10 2.10 0.85 0.64 1.01 0.72 -4.41 121.20 122.21 3hys s ILE 18 Ca 0.09 -1.44 -0.12 0.00 0.00 0.00 0.00 60.65 59.17 3hys s ILE 18 Cb -0.11 -2.15 0.10 0.00 0.01 0.00 0.00 42.46 40.32 3hys s ILE 18 CO -0.01 0.10 1.15 0.00 0.00 0.00 0.00 174.94 176.18 3hys s ALA 19 N 1.17 2.21 0.88 9.38 0.00 -1.26 -2.26 121.76 131.87 3hys s ALA 19 Ca -0.05 -0.55 -0.11 0.00 0.00 0.00 0.00 51.96 51.25 3hys s ALA 19 Cb -0.18 -3.01 0.17 0.00 0.00 0.00 0.00 23.12 20.10 3hys s ALA 19 CO -0.07 -1.95 1.21 0.20 0.00 0.00 0.00 175.76 175.15 3hys s GLY 20 N -4.26 1.77 0.11 0.00 0.00 -1.16 -2.84 107.32 100.93 3hys s GLY 20 Ca 0.63 -1.38 -0.36 0.00 0.00 0.00 0.00 44.72 43.61 3hys s GLY 20 CO 0.52 -0.68 1.35 -2.13 0.00 0.00 0.00 173.10 172.15 3hys n ARG 21 N -3.44 1.26 -0.54 2.90 0.63 -1.26 -0.81 116.66 115.40 3hys n ARG 21 Ca 0.15 0.46 0.00 0.00 -0.92 0.00 0.00 57.85 57.54 3hys n ARG 21 Cb 0.60 -2.10 0.00 0.00 0.45 0.00 0.00 32.46 31.41 3hys n ARG 21 CO 0.00 0.00 0.00 0.41 -2.51 0.00 0.00 177.63 175.53 3hys n GLY 22 N 2.55 1.74 3.71 5.14 0.00 -1.26 -5.02 105.19 112.06 3hys n GLY 22 Ca 0.18 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.81 3hys n GLY 22 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 3hys s GLY 23 N -2.00 2.36 0.63 -0.02 0.00 0.01 -4.98 107.32 103.32 3hys s GLY 23 Ca 0.00 -0.19 -0.09 0.00 0.00 0.00 0.00 44.72 44.44 3hys s GLY 23 CO 0.00 0.87 0.98 0.00 0.00 0.00 0.00 173.10 174.96 3hys s ALA 24 N 0.84 3.12 0.43 3.20 0.00 -1.26 -4.59 121.76 123.50 3hys s ALA 24 Ca 0.27 -0.45 0.18 0.00 0.00 0.00 0.00 51.96 51.96 3hys s ALA 24 Cb -0.15 -2.84 1.10 0.00 0.00 0.00 0.00 23.12 21.23 3hys s ALA 24 CO 0.11 -0.86 1.87 0.78 0.00 0.00 0.00 175.76 177.65 3hys h GLY 25 N -0.34 0.80 1.79 0.00 0.00 -1.81 -1.48 103.07 102.03 3hys h GLY 25 Ca -0.45 -0.17 0.01 0.00 0.00 0.00 0.00 47.33 46.72 3hys h GLY 25 CO 0.62 0.00 0.09 -0.09 0.00 0.00 0.00 176.54 177.17 3hys h ARG 26 N 0.38 0.00 -0.00 4.80 2.43 -1.93 -2.06 114.38 117.99 3hys h ARG 26 Ca 0.45 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.62 3hys h ARG 26 Cb 1.15 0.00 -0.00 0.00 -0.42 0.00 0.00 29.97 30.70 3hys h ARG 26 CO -0.16 0.00 0.07 1.79 -1.51 0.00 0.00 179.97 180.16 3hys h THR 27 N 0.00 0.03 0.00 0.20 1.35 -1.64 -2.25 112.91 110.60 3hys h THR 27 Ca 0.02 0.00 0.00 0.00 -0.55 0.00 0.00 66.41 65.88 3hys h THR 27 Cb 0.21 0.93 0.00 0.00 -1.73 0.00 0.00 68.15 67.56 3hys h THR 27 CO -0.00 0.00 -0.81 -0.50 -0.25 0.00 0.00 175.52 173.96 3hys h TRP 28 N 0.00 0.00 -0.26 4.73 4.06 -1.59 -3.39 115.95 119.49 3hys h TRP 28 Ca 0.00 0.00 -0.12 0.00 2.06 0.00 0.00 58.89 60.83 3hys h TRP 28 Cb 0.13 0.00 -0.01 0.00 -1.00 0.00 0.00 29.16 28.28 3hys h TRP 28 CO 0.00 0.00 -0.35 0.45 -3.56 0.00 0.00 178.44 174.98 3hys h HIS 29 N 0.00 0.68 -0.00 0.49 3.86 -1.57 -0.32 115.15 118.29 3hys h HIS 29 Ca 0.00 -0.18 -0.08 0.00 -1.16 0.00 0.00 60.37 58.95 3hys h HIS 29 Cb 0.90 -0.15 -0.01 0.00 1.06 0.00 0.00 27.41 29.21 3hys h HIS 29 CO 0.00 0.86 -0.37 -1.35 0.86 0.00 0.00 177.93 177.93 3hys h PRO 30 N 0.49 0.00 0.00 2.45 0.11 -1.76 -3.38 132.00 129.91 3hys h PRO 30 Ca 0.05 -0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.16 3hys h PRO 30 Cb 0.84 -0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.95 3hys h PRO 30 CO 0.07 0.37 -0.58 0.72 -0.21 0.00 0.00 178.00 178.37 3hys n HIS 31 N -4.10 0.00 -0.09 0.65 8.25 -1.24 -4.83 115.22 113.86 3hys n HIS 31 Ca -0.02 0.00 -0.16 0.00 -0.26 0.00 0.00 57.72 57.29 3hys n HIS 31 Cb 0.41 0.00 -0.08 0.00 1.12 0.00 0.00 29.99 31.44 3hys n HIS 31 CO 0.00 0.00 0.00 1.96 0.64 0.00 0.00 176.34 178.94 3hys h GLN 32 N 0.00 0.00 -0.56 -0.41 7.50 -1.44 -3.40 115.11 116.80 3hys h GLN 32 Ca 0.00 0.00 0.09 0.00 0.50 0.00 0.00 58.65 59.24 3hys h GLN 32 Cb 0.58 0.00 -0.07 0.00 0.05 0.00 0.00 27.48 28.04 3hys h GLN 32 CO 0.00 0.64 0.16 0.28 -1.50 0.00 0.00 178.83 178.42 3hys h VAL 33 N -1.00 0.73 -0.93 -0.54 2.07 -1.31 -2.07 116.25 113.21 3hys h VAL 33 Ca -0.22 -0.11 0.03 0.00 0.82 0.00 0.00 66.70 67.22 3hys h VAL 33 Cb 1.01 0.39 -0.05 0.00 -1.52 0.00 0.00 31.29 31.11 3hys h VAL 33 CO -0.13 0.06 0.61 -0.65 0.02 0.00 0.00 177.57 177.48 3hys h PRO 34 N 0.32 1.15 -0.19 1.57 0.11 -1.81 -1.66 132.00 131.50 3hys h PRO 34 Ca 0.29 -0.07 -0.19 0.00 0.11 0.00 0.00 66.00 66.14 3hys h PRO 34 Cb 0.37 -0.26 -0.00 0.00 0.11 0.00 0.00 31.00 31.22 3hys h PRO 34 CO -0.33 0.76 -0.63 0.00 -0.21 0.00 0.00 178.00 177.59 3hys h ALA 35 N 1.45 0.52 -0.30 -0.75 0.00 -1.67 -1.47 119.26 117.05 3hys h ALA 35 Ca 0.36 -0.55 -0.08 0.00 0.00 0.00 0.00 54.91 54.65 3hys h ALA 35 Cb -0.02 -0.06 -0.01 0.00 0.00 0.00 0.00 17.79 17.70 3hys h ALA 35 CO -0.11 0.70 -0.13 0.74 0.00 0.00 0.00 179.25 180.45 3hys h PHE 36 N 0.50 0.70 -0.84 0.00 0.04 -1.15 -2.14 116.94 114.05 3hys h PHE 36 Ca -0.01 -0.17 0.06 0.00 2.80 0.00 0.00 57.97 60.65 3hys h PHE 36 Cb 1.22 -0.16 -0.06 0.00 2.20 0.00 0.00 35.95 39.14 3hys h PHE 36 CO 0.06 0.83 0.52 -0.07 -0.60 0.00 0.00 178.31 179.05 3hys h LEU 37 N 0.36 0.81 -1.50 1.54 3.38 -1.29 -0.63 115.31 117.99 3hys h LEU 37 Ca 0.07 0.02 -0.05 0.00 0.09 0.00 0.00 57.88 58.00 3hys h LEU 37 Cb 0.64 -0.15 -0.01 0.00 0.09 0.00 0.00 40.66 41.23 3hys h LEU 37 CO 0.04 0.52 -0.25 0.00 0.09 0.00 0.00 178.44 178.84 3hys h ALA 38 N 1.40 1.52 -0.16 1.53 0.00 -1.20 -1.55 119.26 120.80 3hys h ALA 38 Ca 0.37 -0.23 0.00 0.00 0.00 0.00 0.00 54.91 55.04 3hys h ALA 38 Cb 0.16 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 17.91 3hys h ALA 38 CO -0.17 0.32 0.00 0.00 0.00 0.00 0.00 179.25 179.40 3hys n ALA 39 N -2.46 2.48 -1.60 0.00 0.00 -0.81 -4.93 120.51 113.18 3hys n ALA 39 Ca -0.02 -0.29 -0.06 0.00 0.00 0.00 0.00 53.44 53.06 3hys n ALA 39 Cb 0.31 -1.01 -0.02 0.00 0.00 0.00 0.00 19.45 18.74 3hys n ALA 39 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3hys n GLY 40 N 0.78 0.53 3.93 0.00 0.00 -0.58 -5.01 105.19 104.84 3hys n GLY 40 Ca 0.06 -0.70 -0.26 0.00 0.00 0.00 0.00 46.02 45.13 3hys n GLY 40 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 3hys s TYR 41 N -2.28 3.48 -0.14 1.61 2.02 -0.30 -2.35 117.35 119.40 3hys s TYR 41 Ca 0.00 0.35 -0.06 0.00 -0.37 0.00 0.00 57.07 56.99 3hys s TYR 41 Cb 0.00 -1.87 -0.04 0.00 -0.40 0.00 0.00 41.96 39.65 3hys s TYR 41 CO 0.00 0.28 0.07 0.50 -1.57 0.00 0.00 175.55 174.83 3hys s ARG 42 N -3.71 3.57 -0.17 -0.62 3.52 -0.10 -3.97 118.95 117.47 3hys s ARG 42 Ca 0.39 -0.30 -0.01 0.00 -0.13 0.00 0.00 55.73 55.68 3hys s ARG 42 Cb -0.10 -3.10 -0.01 0.00 -1.56 0.00 0.00 34.95 30.18 3hys s ARG 42 CO 0.31 0.53 -0.12 0.00 -0.81 0.00 0.00 175.30 175.22 3hys s ILE 44 N 0.93 4.01 0.27 0.00 -1.09 0.28 -1.49 121.20 124.11 3hys s ILE 44 Ca -0.02 -0.28 0.12 0.00 -2.23 0.00 0.00 60.65 58.23 3hys s ILE 44 Cb -0.15 -2.87 -0.05 0.00 -1.58 0.00 0.00 42.46 37.81 3hys s ILE 44 CO -0.01 0.36 -0.20 0.42 -1.23 0.00 0.00 174.94 174.28 3hys s THR 45 N 1.57 2.45 0.16 2.92 -4.23 -0.88 -1.29 115.64 116.33 3hys s THR 45 Ca 0.06 -2.38 -0.24 0.00 -1.18 0.00 0.00 61.69 57.95 3hys s THR 45 Cb -0.15 -2.28 0.07 0.00 1.34 0.00 0.00 72.50 71.48 3hys s THR 45 CO 0.01 -0.39 0.69 0.72 -0.54 0.00 0.00 174.62 175.11 3hys s PHE 46 N -2.48 -0.42 -0.58 3.99 -0.71 -1.26 0.22 117.98 116.74 3hys s PHE 46 Ca 0.29 0.17 -0.21 0.00 -1.04 0.00 0.00 56.93 56.15 3hys s PHE 46 Cb -0.05 0.59 0.07 0.00 -1.21 0.00 0.00 43.02 42.42 3hys s PHE 46 CO 0.14 -0.87 0.79 -0.51 -1.34 0.00 0.00 175.22 173.43 3hys s ASP 47 N -2.75 6.22 0.47 1.98 1.01 -0.48 -2.14 116.67 120.99 3hys s ASP 47 Ca 0.04 -0.99 -0.20 0.00 0.71 0.00 0.00 52.55 52.11 3hys s ASP 47 Cb -0.02 -2.35 -0.13 0.00 1.01 0.00 0.00 42.92 41.43 3hys s ASP 47 CO -0.08 -1.15 0.29 0.59 0.21 0.00 0.00 175.17 175.03 3hys n ASN 48 N 6.82 -1.96 -4.65 0.27 3.02 -1.26 -4.47 115.26 113.02 3hys n ASN 48 Ca -0.05 0.79 -0.47 0.00 -0.03 0.00 0.00 54.58 54.81 3hys n ASN 48 Cb 0.45 -1.02 -0.04 0.00 -0.61 0.00 0.00 39.78 38.56 3hys n ASN 48 CO 0.00 0.00 0.00 -1.14 -2.62 0.00 0.00 177.26 173.50 3hys n ARG 49 N 0.79 1.88 -0.11 3.52 0.63 -1.26 -1.73 116.66 120.38 3hys n ARG 49 Ca 0.11 0.68 0.00 0.00 -0.92 0.00 0.00 57.85 57.71 3hys n ARG 49 Cb 0.43 -2.38 0.00 0.00 0.45 0.00 0.00 32.46 30.96 3hys n ARG 49 CO 0.00 0.00 0.00 0.41 -2.51 0.00 0.00 177.63 175.53 3hys n GLY 50 N 2.91 0.54 3.29 5.14 0.00 -1.19 -4.92 105.19 110.95 3hys n GLY 50 Ca 0.16 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.89 3hys n GLY 50 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3hys s ILE 51 N -2.22 1.90 0.00 -0.61 -1.09 -0.71 -3.72 121.20 114.75 3hys s ILE 51 Ca 0.00 -1.16 0.00 0.00 -2.23 0.00 0.00 60.65 57.26 3hys s ILE 51 Cb 0.00 -1.61 0.00 0.00 -1.58 0.00 0.00 42.46 39.27 3hys s ILE 51 CO 0.00 0.41 0.00 0.61 -1.23 0.00 0.00 174.94 174.73 3hys n GLY 52 N 2.14 3.26 0.18 6.18 0.00 -1.26 -1.72 105.19 113.97 3hys n GLY 52 Ca -0.16 -0.07 0.14 0.00 0.00 0.00 0.00 46.02 45.93 3hys n GLY 52 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3hys h ALA 53 N -0.59 1.00 -0.44 4.61 0.00 -1.96 -1.92 119.26 119.96 3hys h ALA 53 Ca 0.00 0.00 -0.14 0.00 0.00 0.00 0.00 54.91 54.77 3hys h ALA 53 Cb 0.00 0.00 -0.09 0.00 0.00 0.00 0.00 17.79 17.70 3hys h ALA 53 CO 0.00 0.00 0.07 0.25 0.00 0.00 0.00 179.25 179.57 3hys n THR 54 N -2.57 2.58 0.32 0.00 -2.24 -0.70 -4.71 114.28 106.97 3hys n THR 54 Ca 0.02 -2.14 0.20 0.00 -2.27 0.00 0.00 64.05 59.86 3hys n THR 54 Cb 0.31 -0.31 1.09 0.00 -2.10 0.00 0.00 70.33 69.31 3hys n THR 54 CO 0.00 0.00 0.00 1.05 -0.57 0.00 0.00 175.07 175.55 3hys h GLU 55 N 1.65 0.00 -0.01 -0.78 4.11 -1.45 0.18 114.58 118.28 3hys h GLU 55 Ca 0.18 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.61 3hys h GLU 55 Cb 1.81 0.00 0.00 0.00 0.50 0.00 0.00 28.75 31.06 3hys h GLU 55 CO 0.45 0.00 -0.02 0.09 0.07 0.00 0.00 179.01 179.60 3hys n ASN 56 N -3.40 1.34 -4.78 3.06 3.02 -1.26 -0.17 115.26 113.07 3hys n ASN 56 Ca -0.03 -1.40 -0.41 0.00 -0.03 0.00 0.00 54.58 52.71 3hys n ASN 56 Cb 0.08 0.01 -0.00 0.00 -0.61 0.00 0.00 39.78 39.25 3hys n ASN 56 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 3hys s ALA 57 N -2.05 3.53 0.34 5.41 0.00 0.63 -4.67 121.76 124.95 3hys s ALA 57 Ca 0.37 1.52 -0.01 0.00 0.00 0.00 0.00 51.96 53.84 3hys s ALA 57 Cb 0.21 -3.59 -0.00 0.00 0.00 0.00 0.00 23.12 19.74 3hys s ALA 57 CO 0.35 -1.01 0.44 -1.83 0.00 0.00 0.00 175.76 173.72 3hys s GLU 58 N -2.09 1.87 -1.21 0.00 -1.05 -1.26 -2.99 118.70 111.97 3hys s GLU 58 Ca 0.53 -1.79 0.00 0.00 -0.15 0.00 0.00 54.97 53.56 3hys s GLU 58 Cb -0.45 0.42 0.00 0.00 -0.44 0.00 0.00 34.13 33.66 3hys s GLU 58 CO 0.61 -0.76 0.00 0.41 0.95 0.00 0.00 175.26 176.47 3hys n GLY 59 N -0.57 0.72 3.80 -3.83 0.00 -1.26 -5.00 105.19 99.05 3hys n GLY 59 Ca 0.02 -0.41 -0.24 0.00 0.00 0.00 0.00 46.02 45.39 3hys n GLY 59 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 3hys s PHE 60 N -2.53 2.55 0.35 1.61 -0.71 -1.26 -4.27 117.98 113.72 3hys s PHE 60 Ca 0.00 -0.58 0.06 0.00 -1.04 0.00 0.00 56.93 55.36 3hys s PHE 60 Cb 0.00 -2.02 -0.03 0.00 -1.21 0.00 0.00 43.02 39.76 3hys s PHE 60 CO 0.00 0.02 0.22 0.95 -1.34 0.00 0.00 175.22 175.07 3hys s THR 61 N -2.58 0.20 0.21 -4.49 -4.23 -1.26 -4.95 115.64 98.53 3hys s THR 61 Ca 0.42 -2.00 -0.09 0.00 -1.18 0.00 0.00 61.69 58.84 3hys s THR 61 Cb 0.01 -2.44 0.15 0.00 1.34 0.00 0.00 72.50 71.55 3hys s THR 61 CO 0.24 0.00 1.75 0.74 -0.54 0.00 0.00 174.62 176.80 3hys h THR 62 N 2.04 0.77 -0.85 3.99 2.02 -1.92 -2.32 112.91 116.64 3hys h THR 62 Ca -0.29 -0.14 0.05 0.00 0.77 0.00 0.00 66.41 66.80 3hys h THR 62 Cb 1.25 0.32 -0.05 0.00 -1.74 0.00 0.00 68.15 67.93 3hys h THR 62 CO 0.44 0.08 0.56 1.56 0.37 0.00 0.00 175.52 178.52 3hys h GLN 63 N 0.42 0.97 -0.80 6.66 7.50 -1.99 0.92 115.11 128.79 3hys h GLN 63 Ca 0.31 -0.06 0.04 0.00 0.50 0.00 0.00 58.65 59.44 3hys h GLN 63 Cb 0.38 -0.22 -0.05 0.00 0.05 0.00 0.00 27.48 27.64 3hys h GLN 63 CO -0.30 0.64 0.51 1.15 -1.50 0.00 0.00 178.83 179.32 3hys h THR 64 N 1.00 1.09 0.03 -0.54 2.02 -1.81 -1.70 112.91 113.00 3hys h THR 64 Ca 0.35 -0.33 -0.22 0.00 0.77 0.00 0.00 66.41 66.98 3hys h THR 64 Cb 0.13 0.04 -0.01 0.00 -1.74 0.00 0.00 68.15 66.58 3hys h THR 64 CO -0.12 0.18 -0.97 0.24 0.37 0.00 0.00 175.52 175.22 3hys h MET 65 N 0.97 0.24 -0.44 6.66 2.86 -0.76 -0.29 114.93 124.16 3hys h MET 65 Ca 0.33 -0.29 0.02 0.00 -2.06 0.00 0.00 59.70 57.70 3hys h MET 65 Cb 0.06 0.09 -0.03 0.00 0.06 0.00 0.00 31.60 31.78 3hys h MET 65 CO -0.13 1.04 0.25 0.28 1.06 0.00 0.00 176.91 179.41 3hys h VAL 66 N 0.12 1.03 -0.27 -2.22 2.07 -0.80 -1.79 116.25 114.39 3hys h VAL 66 Ca -0.07 -0.17 -0.11 0.00 0.82 0.00 0.00 66.70 67.17 3hys h VAL 66 Cb 1.63 0.48 -0.01 0.00 -1.52 0.00 0.00 31.29 31.87 3hys h VAL 66 CO 0.15 0.09 -0.30 0.00 0.02 0.00 0.00 177.57 177.54 3hys h ALA 67 N 1.20 0.98 -0.94 1.67 0.00 -1.03 -0.85 119.26 120.29 3hys h ALA 67 Ca 0.18 -0.38 0.04 0.00 0.00 0.00 0.00 54.91 54.75 3hys h ALA 67 Cb 0.03 -0.12 -0.06 0.00 0.00 0.00 0.00 17.79 17.64 3hys h ALA 67 CO -0.09 0.60 0.62 -0.44 0.00 0.00 0.00 179.25 179.94 3hys h ASP 68 N 0.48 1.01 0.08 0.00 3.32 -0.76 0.21 116.42 120.76 3hys h ASP 68 Ca 0.06 -0.01 -0.24 0.00 0.02 0.00 0.00 57.03 56.86 3hys h ASP 68 Cb 0.76 -0.23 0.02 0.00 0.22 0.00 0.00 39.33 40.11 3hys h ASP 68 CO 0.06 0.69 -1.00 0.74 -1.72 0.00 0.00 179.24 178.01 3hys h THR 69 N 1.17 1.36 -0.51 0.35 2.02 -0.42 -0.71 112.91 116.16 3hys h THR 69 Ca 0.38 -2.35 0.10 0.00 0.77 0.00 0.00 66.41 65.31 3hys h THR 69 Cb 0.04 2.72 -0.09 0.00 -1.74 0.00 0.00 68.15 69.09 3hys h THR 69 CO -0.12 0.70 -0.07 0.00 0.37 0.00 0.00 175.52 176.40 3hys h ALA 70 N 0.27 0.40 -0.49 6.16 0.00 -1.03 -1.62 119.26 122.95 3hys h ALA 70 Ca -0.15 0.18 -0.03 0.00 0.00 0.00 0.00 54.91 54.91 3hys h ALA 70 Cb 1.70 0.33 -0.02 0.00 0.00 0.00 0.00 17.79 19.80 3hys h ALA 70 CO 0.19 -0.42 0.17 0.00 0.00 0.00 0.00 179.25 179.19 3hys h ALA 71 N 1.49 1.38 0.15 0.00 0.00 -0.12 0.14 119.26 122.29 3hys h ALA 71 Ca 0.25 -0.15 -0.01 0.00 0.00 0.00 0.00 54.91 55.00 3hys h ALA 71 Cb 0.39 -0.20 0.00 0.00 0.00 0.00 0.00 17.79 17.98 3hys h ALA 71 CO -0.48 0.46 -0.07 1.25 0.00 0.00 0.00 179.25 180.41 3hys h LEU 72 N 0.71 -0.17 -0.25 0.00 5.85 -0.69 0.62 115.31 121.37 3hys h LEU 72 Ca 0.17 -0.14 0.05 0.00 0.84 0.00 0.00 57.88 58.80 3hys h LEU 72 Cb 0.18 0.04 -0.05 0.00 0.37 0.00 0.00 40.66 41.21 3hys h LEU 72 CO -0.01 0.04 -0.04 0.40 -0.34 0.00 0.00 178.44 178.48 3hys h ILE 73 N -0.38 0.77 -0.45 4.05 2.04 -0.70 -2.28 117.51 120.57 3hys h ILE 73 Ca -0.02 -0.01 -0.09 0.00 1.00 0.00 0.00 64.86 65.74 3hys h ILE 73 Cb 0.30 0.74 -0.02 0.00 -0.74 0.00 0.00 36.82 37.10 3hys h ILE 73 CO 0.03 0.00 -0.09 -0.33 0.00 0.00 0.00 178.15 177.77 3hys h GLU 74 N 0.03 0.79 -0.37 2.37 5.08 -0.65 -1.47 114.58 120.36 3hys h GLU 74 Ca 0.12 -0.26 -0.04 0.00 -1.00 0.00 0.00 59.36 58.18 3hys h GLU 74 Cb 0.18 -0.07 -0.02 0.00 0.50 0.00 0.00 28.75 29.34 3hys h GLU 74 CO -0.24 0.86 0.05 1.15 -1.00 0.00 0.00 179.01 179.83 3hys h THR 75 N 0.72 1.19 0.00 1.13 2.02 -0.62 -2.59 112.91 114.76 3hys h THR 75 Ca 0.12 -0.72 0.00 0.00 0.77 0.00 0.00 66.41 66.59 3hys h THR 75 Cb 0.57 0.86 0.00 0.00 -1.74 0.00 0.00 68.15 67.84 3hys h THR 75 CO 0.04 0.25 -0.43 0.18 0.37 0.00 0.00 175.52 175.93 3hys n LEU 76 N -4.30 0.49 -3.47 2.58 4.77 -0.88 -4.95 117.00 111.23 3hys n LEU 76 Ca 0.02 0.19 -0.18 0.00 -0.03 0.00 0.00 56.01 56.00 3hys n LEU 76 Cb 0.22 -0.28 0.09 0.00 -2.33 0.00 0.00 43.42 41.12 3hys n LEU 76 CO 0.39 0.03 0.12 -0.67 -1.33 0.00 0.00 177.39 175.93 3hys n ASP 77 N -1.72 -2.67 -0.32 -1.43 2.03 -0.58 -4.94 116.55 106.91 3hys n ASP 77 Ca 0.05 -0.62 0.06 0.00 0.52 0.00 0.00 54.79 54.80 3hys n ASP 77 Cb 0.37 -5.05 0.12 0.00 -0.72 0.00 0.00 41.12 35.84 3hys n ASP 77 CO 0.00 0.00 0.00 2.30 -1.92 0.00 0.00 177.20 177.58 3hys n ILE 78 N -4.27 1.50 -2.20 5.18 -5.35 -1.09 -5.03 119.36 108.09 3hys n ILE 78 Ca -0.24 -1.52 -0.41 0.00 -0.27 0.00 0.00 62.75 60.30 3hys n ILE 78 Cb 0.65 0.15 -0.03 0.00 -1.74 0.00 0.00 39.64 38.67 3hys n ILE 78 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 3hys s ALA 79 N -1.88 3.52 -0.01 -1.28 0.00 -1.26 -2.80 121.76 118.06 3hys s ALA 79 Ca 0.22 1.13 -0.21 0.00 0.00 0.00 0.00 51.96 53.10 3hys s ALA 79 Cb 0.17 -3.48 -0.05 0.00 0.00 0.00 0.00 23.12 19.76 3hys s ALA 79 CO 0.06 -0.55 0.61 -1.25 0.00 0.00 0.00 175.76 174.64 3hys s PRO 80 N -0.42 4.34 0.12 0.00 0.04 -1.25 -5.04 135.00 132.78 3hys s PRO 80 Ca 0.55 0.77 0.03 0.00 0.04 0.00 0.00 61.00 62.38 3hys s PRO 80 Cb -0.37 -3.35 -0.04 0.00 0.04 0.00 0.00 34.50 30.78 3hys s PRO 80 CO 0.41 0.34 0.20 0.00 0.04 0.00 0.00 177.00 177.98 3hys s ALA 81 N -0.10 3.82 0.29 8.56 0.00 0.80 -4.25 121.76 130.88 3hys s ALA 81 Ca 0.32 -1.02 -0.29 0.00 0.00 0.00 0.00 51.96 50.97 3hys s ALA 81 Cb -0.18 -1.64 -0.09 0.00 0.00 0.00 0.00 23.12 21.21 3hys s ALA 81 CO 0.18 0.64 1.02 1.03 0.00 0.00 0.00 175.76 178.63 3hys s ARG 82 N -2.88 4.65 0.02 0.00 0.52 -1.20 -0.87 118.95 119.20 3hys s ARG 82 Ca 0.33 1.61 0.06 0.00 -0.52 0.00 0.00 55.73 57.21 3hys s ARG 82 Cb -0.11 -3.10 -0.02 0.00 0.52 0.00 0.00 34.95 32.24 3hys s ARG 82 CO 0.26 0.28 -0.17 0.08 0.02 0.00 0.00 175.30 175.77 3hys s VAL 83 N -1.28 1.37 -0.17 3.52 1.01 -0.29 -0.66 120.40 123.91 3hys s VAL 83 Ca 0.45 -0.97 0.00 0.00 0.00 0.00 0.00 61.98 61.47 3hys s VAL 83 Cb -0.27 -1.19 0.04 0.00 0.00 0.00 0.00 36.38 34.95 3hys s VAL 83 CO 0.34 0.20 -0.10 -0.69 0.00 0.00 0.00 175.10 174.86 3hys s VAL 84 N -0.67 1.44 0.13 2.92 1.01 0.09 -1.06 120.40 124.25 3hys s VAL 84 Ca 0.05 -0.75 0.09 0.00 0.00 0.00 0.00 61.98 61.37 3hys s VAL 84 Cb -0.08 -1.49 -0.04 0.00 0.00 0.00 0.00 36.38 34.78 3hys s VAL 84 CO 0.01 0.26 -0.21 -0.83 0.00 0.00 0.00 175.10 174.32 3hys s GLY 85 N 1.51 1.35 -0.06 4.51 0.00 -0.46 -0.20 107.32 113.95 3hys s GLY 85 Ca 0.01 -1.36 0.03 0.00 0.00 0.00 0.00 44.72 43.41 3hys s GLY 85 CO -0.09 -1.37 -0.16 0.54 0.00 0.00 0.00 173.10 172.02 3hys s VAL 86 N -1.40 1.42 0.00 1.40 0.11 -0.96 -0.69 120.40 120.29 3hys s VAL 86 Ca 0.10 -0.67 0.00 0.00 -2.93 0.00 0.00 61.98 58.48 3hys s VAL 86 Cb -0.09 -1.25 0.00 0.00 -1.53 0.00 0.00 36.38 33.51 3hys s VAL 86 CO 0.05 0.42 0.00 -1.20 -3.33 0.00 0.00 175.10 171.04 3hys n SER 87 N 3.51 0.00 -0.35 3.54 7.64 0.28 -1.28 113.62 126.96 3hys n SER 87 Ca -0.20 0.00 0.12 0.00 1.01 0.00 0.00 58.87 59.80 3hys n SER 87 Cb 0.52 0.00 0.31 0.00 -1.01 0.00 0.00 64.21 64.04 3hys n SER 87 CO 0.00 0.00 0.00 -0.03 -3.01 0.00 0.00 175.04 172.00 3hys h MET 88 N 0.00 0.76 -0.80 1.43 1.85 -1.85 -0.01 114.93 116.31 3hys h MET 88 Ca 0.00 -0.05 -0.03 0.00 -0.61 0.00 0.00 59.70 59.01 3hys h MET 88 Cb 0.00 -0.17 -0.04 0.00 0.43 0.00 0.00 31.60 31.82 3hys h MET 88 CO 0.00 0.51 0.37 0.78 -0.40 0.00 0.00 176.91 178.16 3hys h GLY 89 N 0.79 1.24 1.44 1.39 0.00 -1.03 -0.06 103.07 106.83 3hys h GLY 89 Ca 0.57 -0.63 -0.03 0.00 0.00 0.00 0.00 47.33 47.24 3hys h GLY 89 CO -0.37 0.59 0.16 0.00 0.00 0.00 0.00 176.54 176.93 3hys h ALA 90 N 1.25 1.36 -0.19 3.60 0.00 -1.05 -1.37 119.26 122.87 3hys h ALA 90 Ca 0.27 -0.16 -0.09 0.00 0.00 0.00 0.00 54.91 54.93 3hys h ALA 90 Cb 0.14 -0.20 -0.00 0.00 0.00 0.00 0.00 17.79 17.73 3hys h ALA 90 CO -0.03 0.47 -0.24 0.35 0.00 0.00 0.00 179.25 179.80 3hys h PHE 91 N 0.71 0.60 -0.06 0.00 3.57 -0.55 -1.19 116.94 120.01 3hys h PHE 91 Ca 0.17 -0.19 0.03 0.00 3.53 0.00 0.00 57.97 61.50 3hys h PHE 91 Cb 0.20 -0.12 -0.03 0.00 2.79 0.00 0.00 35.95 38.78 3hys h PHE 91 CO 0.01 0.88 -0.10 0.82 -2.23 0.00 0.00 178.31 177.69 3hys h ILE 92 N 0.15 0.72 -0.79 1.41 2.04 -0.99 -1.27 117.51 118.78 3hys h ILE 92 Ca 0.02 0.00 0.14 0.00 1.00 0.00 0.00 64.86 66.03 3hys h ILE 92 Cb 0.80 0.72 -0.09 0.00 -0.74 0.00 0.00 36.82 37.51 3hys h ILE 92 CO 0.06 0.00 0.36 0.00 0.00 0.00 0.00 178.15 178.57 3hys h ALA 93 N 0.88 1.16 0.24 1.87 0.00 -1.13 0.35 119.26 122.63 3hys h ALA 93 Ca 0.06 0.10 -0.01 0.00 0.00 0.00 0.00 54.91 55.06 3hys h ALA 93 Cb 0.23 0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.07 3hys h ALA 93 CO -0.15 -0.16 -0.12 1.96 0.00 0.00 0.00 179.25 180.79 3hys h GLN 94 N 0.52 -0.31 -0.49 0.00 4.20 -0.86 0.37 115.11 118.54 3hys h GLN 94 Ca 0.44 0.02 -0.07 0.00 0.06 0.00 0.00 58.65 59.10 3hys h GLN 94 Cb 0.64 0.07 -0.02 0.00 0.30 0.00 0.00 27.48 28.47 3hys h GLN 94 CO -0.38 -0.14 0.01 0.93 -0.67 0.00 0.00 178.83 178.58 3hys h GLU 95 N -0.42 0.80 -0.61 1.46 4.39 -0.80 -1.69 114.58 117.72 3hys h GLU 95 Ca -0.03 -0.21 0.03 0.00 0.34 0.00 0.00 59.36 59.48 3hys h GLU 95 Cb 0.32 -0.10 -0.04 0.00 -0.10 0.00 0.00 28.75 28.83 3hys h GLU 95 CO 0.05 0.80 0.38 1.25 -1.16 0.00 0.00 179.01 180.33 3hys h LEU 96 N 0.75 0.62 -1.74 1.33 5.85 -0.14 -2.36 115.31 119.62 3hys h LEU 96 Ca 0.15 0.00 -0.03 0.00 0.84 0.00 0.00 57.88 58.84 3hys h LEU 96 Cb 0.44 -0.13 -0.00 0.00 0.37 0.00 0.00 40.66 41.33 3hys h LEU 96 CO 0.02 0.43 -0.14 0.24 -0.34 0.00 0.00 178.44 178.65 3hys h MET 97 N 0.74 0.00 -0.05 1.25 2.86 -0.19 0.21 114.93 119.75 3hys h MET 97 Ca 0.24 0.00 -0.02 0.00 -2.06 0.00 0.00 59.70 57.87 3hys h MET 97 Cb 0.01 0.00 -0.00 0.00 0.06 0.00 0.00 31.60 31.67 3hys h MET 97 CO -0.10 0.14 -0.04 0.28 1.06 0.00 0.00 176.91 178.26 3hys h VAL 98 N 0.00 1.35 0.00 -2.22 2.07 -0.82 -3.18 116.25 113.45 3hys h VAL 98 Ca -0.00 -1.11 -0.05 0.00 0.82 0.00 0.00 66.70 66.36 3hys h VAL 98 Cb 0.25 1.98 -0.01 0.00 -1.52 0.00 0.00 31.29 31.99 3hys h VAL 98 CO 0.02 0.30 -1.36 1.33 0.02 0.00 0.00 177.57 177.88 3hys n VAL 99 N -4.78 0.66 -2.97 2.57 0.24 -1.01 -4.65 118.33 108.39 3hys n VAL 99 Ca -0.07 -0.58 -0.14 0.00 -2.04 0.00 0.00 64.34 61.50 3hys n VAL 99 Cb 0.27 -0.37 0.00 0.00 -1.47 0.00 0.00 33.84 32.27 3hys n VAL 99 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 3hys n ALA 100 N -2.27 2.32 0.12 2.33 0.00 0.05 -4.95 120.51 118.10 3hys n ALA 100 Ca -0.04 -3.15 0.16 0.00 0.00 0.00 0.00 53.44 50.40 3hys n ALA 100 Cb 0.64 -0.95 0.69 0.00 0.00 0.00 0.00 19.45 19.84 3hys n ALA 100 CO 0.00 0.00 0.00 -1.00 0.00 0.00 0.00 177.50 176.50 3hys h PRO 101 N 2.97 0.00 0.00 0.00 0.13 -1.68 -0.50 132.00 132.93 3hys h PRO 101 Ca 0.01 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.14 3hys h PRO 101 Cb 1.06 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.19 3hys h PRO 101 CO 0.47 0.00 0.00 -0.85 -0.23 0.00 0.00 178.00 177.39 3hys n GLU 102 N -4.36 0.11 0.03 0.86 0.00 -1.26 -2.41 120.64 113.60 3hys n GLU 102 Ca 0.04 0.40 0.13 0.00 0.00 0.00 0.00 57.16 57.73 3hys n GLU 102 Cb 0.39 -1.72 0.38 0.00 0.00 0.00 0.00 31.44 30.49 3hys n GLU 102 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.13 178.41 3hys n LEU 103 N -1.93 0.43 -3.94 -1.84 4.77 -0.19 -3.88 117.00 110.42 3hys n LEU 103 Ca 0.02 0.30 -0.28 0.00 -0.03 0.00 0.00 56.01 56.02 3hys n LEU 103 Cb 0.16 -0.33 -0.17 0.00 -2.33 0.00 0.00 43.42 40.76 3hys n LEU 103 CO 0.15 0.00 -0.45 -0.69 -1.33 0.00 0.00 177.39 175.06 3hys s VAL 104 N -3.05 1.24 0.04 4.08 1.01 -1.01 -0.14 120.40 122.57 3hys s VAL 104 Ca 0.11 -0.50 -0.05 0.00 0.00 0.00 0.00 61.98 61.54 3hys s VAL 104 Cb 0.16 -1.26 -0.29 0.00 0.00 0.00 0.00 36.38 35.00 3hys s VAL 104 CO 0.63 0.33 1.02 0.77 0.00 0.00 0.00 175.10 177.86 3hys h SER 105 N 8.12 0.46 -4.65 3.32 4.64 -1.18 -3.44 113.55 120.81 3hys h SER 105 Ca -0.31 -0.53 0.07 0.00 -0.47 0.00 0.00 61.79 60.55 3hys h SER 105 Cb 1.13 -0.15 -0.16 0.00 -0.31 0.00 0.00 62.40 62.91 3hys h SER 105 CO 0.44 1.43 0.43 -0.94 -0.87 0.00 0.00 176.83 177.33 3hys s SER 106 N -7.14 -0.42 -0.00 4.97 1.04 -1.25 -4.13 113.70 106.77 3hys s SER 106 Ca -0.06 0.11 -0.08 0.00 0.48 0.00 0.00 55.95 56.40 3hys s SER 106 Cb 0.07 0.42 0.00 0.00 0.10 0.00 0.00 66.02 66.61 3hys s SER 106 CO 0.88 -0.63 0.15 0.00 0.98 0.00 0.00 173.24 174.62 3hys s ALA 107 N -2.79 -0.36 -0.17 5.32 0.00 -0.82 -1.14 121.76 121.80 3hys s ALA 107 Ca 0.02 -0.05 -0.02 0.00 0.00 0.00 0.00 51.96 51.91 3hys s ALA 107 Cb -0.01 0.07 -0.02 0.00 0.00 0.00 0.00 23.12 23.17 3hys s ALA 107 CO -0.07 -0.20 -0.08 0.08 0.00 0.00 0.00 175.76 175.50 3hys s VAL 108 N -1.25 3.37 -0.26 0.00 1.01 -0.23 -0.80 120.40 122.25 3hys s VAL 108 Ca -0.13 -0.53 -0.02 0.00 0.00 0.00 0.00 61.98 61.30 3hys s VAL 108 Cb -0.07 -2.48 0.03 0.00 0.00 0.00 0.00 36.38 33.86 3hys s VAL 108 CO 0.02 0.48 -0.05 -0.76 0.00 0.00 0.00 175.10 174.79 3hys s LEU 109 N 0.78 3.32 -0.10 3.92 1.43 0.27 -1.36 118.68 126.94 3hys s LEU 109 Ca -0.03 -0.93 -0.03 0.00 -1.03 0.00 0.00 54.13 52.11 3hys s LEU 109 Cb -0.15 -1.68 -0.03 0.00 0.03 0.00 0.00 46.19 44.36 3hys s LEU 109 CO 0.02 -0.15 0.03 -0.04 0.23 0.00 0.00 176.35 176.44 3hys s MET 110 N 1.32 3.12 -1.19 1.70 -1.94 0.14 -0.39 119.30 122.06 3hys s MET 110 Ca -0.01 -0.35 -0.07 0.00 -1.71 0.00 0.00 55.69 53.55 3hys s MET 110 Cb -0.17 -2.89 -0.02 0.00 2.01 0.00 0.00 34.83 33.76 3hys s MET 110 CO -0.04 0.69 0.79 0.00 -0.01 0.00 0.00 175.02 176.46 3hys n ALA 111 N 2.19 -2.28 -4.63 3.03 0.00 -0.33 -0.56 120.51 117.93 3hys n ALA 111 Ca -0.19 -0.11 -0.29 0.00 0.00 0.00 0.00 53.44 52.86 3hys n ALA 111 Cb 0.54 -3.51 -0.06 0.00 0.00 0.00 0.00 19.45 16.42 3hys n ALA 111 CO 0.00 0.00 0.00 -2.37 0.00 0.00 0.00 177.50 175.13 3hys n THR 112 N -3.99 0.00 -3.61 0.00 5.66 -1.26 -2.55 114.28 108.53 3hys n THR 112 Ca -0.19 -2.16 -0.09 0.00 -3.05 0.00 0.00 64.05 58.56 3hys n THR 112 Cb 0.64 0.49 -0.02 0.00 -1.55 0.00 0.00 70.33 69.89 3hys n THR 112 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 3hys s ARG 113 N -3.61 1.31 -0.01 1.09 3.03 -1.26 -2.45 118.95 117.06 3hys s ARG 113 Ca 0.03 -0.61 0.01 0.00 2.03 0.00 0.00 55.73 57.20 3hys s ARG 113 Cb 0.00 0.52 0.02 0.00 -1.03 0.00 0.00 34.95 34.46 3hys s ARG 113 CO 0.02 -0.59 0.98 0.41 -1.13 0.00 0.00 175.30 174.99 3hys n GLY 114 N -0.39 2.75 3.77 3.88 0.00 -1.26 -4.86 105.19 109.08 3hys n GLY 114 Ca -0.10 -0.07 -0.05 0.00 0.00 0.00 0.00 46.02 45.80 3hys n GLY 114 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 3hys s ARG 115 N -1.05 1.37 -0.26 1.61 1.70 -1.26 -0.55 118.95 120.51 3hys s ARG 115 Ca 0.02 -0.74 -0.09 0.00 -0.47 0.00 0.00 55.73 54.45 3hys s ARG 115 Cb 0.02 0.47 -0.04 0.00 -0.57 0.00 0.00 34.95 34.83 3hys s ARG 115 CO 0.00 -0.62 0.11 -0.51 -1.08 0.00 0.00 175.30 173.20 3hys s LEU 116 N -2.91 3.68 0.00 -1.89 1.43 -1.26 -4.93 118.68 112.79 3hys s LEU 116 Ca 0.11 -0.12 -0.11 0.00 -1.03 0.00 0.00 54.13 52.99 3hys s LEU 116 Cb -0.03 -2.00 0.17 0.00 0.03 0.00 0.00 46.19 44.36 3hys s LEU 116 CO 0.03 -0.03 0.51 -0.90 0.23 0.00 0.00 176.35 176.19 3hys n ASP 117 N 4.88 -2.17 0.24 2.29 5.75 -1.26 -4.64 116.55 121.64 3hys n ASP 117 Ca -0.15 -0.68 -0.13 0.00 -0.01 0.00 0.00 54.79 53.81 3hys n ASP 117 Cb 0.52 -0.51 -0.07 0.00 -1.03 0.00 0.00 41.12 40.03 3hys n ASP 117 CO 0.00 0.00 0.00 -0.09 -0.11 0.00 0.00 177.20 177.00 3hys h ARG 118 N 0.00 -0.62 -0.71 0.11 9.65 -1.99 -0.99 114.38 119.83 3hys h ARG 118 Ca -0.21 0.04 0.15 0.00 -1.10 0.00 0.00 59.98 58.87 3hys h ARG 118 Cb 0.65 0.14 -0.13 0.00 -1.39 0.00 0.00 29.97 29.24 3hys h ARG 118 CO 0.13 -0.32 -0.06 0.00 2.80 0.00 0.00 179.97 182.52 3hys h ALA 119 N -0.78 0.64 -0.10 2.80 0.00 -2.00 -1.93 119.26 117.90 3hys h ALA 119 Ca -0.07 0.24 -0.15 0.00 0.00 0.00 0.00 54.91 54.94 3hys h ALA 119 Cb 0.58 0.44 -0.01 0.00 0.00 0.00 0.00 17.79 18.81 3hys h ALA 119 CO 0.11 -0.42 -0.59 0.00 0.00 0.00 0.00 179.25 178.34 3hys h ARG 120 N 0.07 0.34 -0.66 0.00 -0.00 -1.89 -1.38 114.38 110.86 3hys h ARG 120 Ca 0.37 -0.23 0.07 0.00 -0.50 0.00 0.00 59.98 59.69 3hys h ARG 120 Cb 0.62 0.03 -0.06 0.00 0.00 0.00 0.00 29.97 30.56 3hys h ARG 120 CO -0.66 0.84 0.34 0.37 0.00 0.00 0.00 179.97 180.85 3hys h GLN 121 N 0.26 0.59 -0.37 0.04 5.75 -0.74 -1.63 115.11 119.00 3hys h GLN 121 Ca -0.00 -0.04 -0.09 0.00 -0.15 0.00 0.00 58.65 58.37 3hys h GLN 121 Cb 1.11 -0.13 -0.02 0.00 1.07 0.00 0.00 27.48 29.51 3hys h GLN 121 CO 0.10 0.39 -0.13 0.35 -2.65 0.00 0.00 178.83 176.89 3hys h PHE 122 N 0.61 0.72 -0.37 3.99 3.57 -1.12 -1.17 116.94 123.17 3hys h PHE 122 Ca 0.31 -0.13 -0.15 0.00 3.53 0.00 0.00 57.97 61.54 3hys h PHE 122 Cb 0.27 -0.19 -0.01 0.00 2.79 0.00 0.00 35.95 38.81 3hys h PHE 122 CO -0.10 0.76 -0.35 0.74 -2.23 0.00 0.00 178.31 177.13 3hys h PHE 123 N 0.60 1.01 -0.54 0.41 0.04 -0.71 0.20 116.94 117.95 3hys h PHE 123 Ca 0.10 -0.28 -0.02 0.00 2.80 0.00 0.00 57.97 60.57 3hys h PHE 123 Cb 0.57 -0.22 -0.02 0.00 2.20 0.00 0.00 35.95 38.48 3hys h PHE 123 CO 0.03 1.08 0.26 -0.97 -0.60 0.00 0.00 178.31 178.10 3hys h ASN 124 N 0.71 0.71 -0.51 2.17 -0.73 -1.17 -0.35 115.58 116.42 3hys h ASN 124 Ca 0.07 -0.13 -0.11 0.00 1.87 0.00 0.00 56.30 57.99 3hys h ASN 124 Cb 0.91 -0.18 -0.02 0.00 0.27 0.00 0.00 38.32 39.30 3hys h ASN 124 CO 0.08 0.65 -0.11 0.50 -0.37 0.00 0.00 177.43 178.18 3hys h LYS 125 N 0.73 0.99 -0.63 6.67 3.64 -0.81 -1.80 116.57 125.35 3hys h LYS 125 Ca 0.19 -0.36 -0.00 0.00 -1.27 0.00 0.00 60.65 59.20 3hys h LYS 125 Cb 0.13 -0.07 -0.03 0.00 -0.41 0.00 0.00 32.23 31.85 3hys h LYS 125 CO -0.02 1.04 0.38 0.00 -2.27 0.00 0.00 179.45 178.57 3hys h ALA 126 N 0.98 0.81 -0.67 5.00 0.00 -0.30 -0.48 119.26 124.60 3hys h ALA 126 Ca 0.14 -0.08 -0.06 0.00 0.00 0.00 0.00 54.91 54.90 3hys h ALA 126 Cb 0.67 -0.25 -0.03 0.00 0.00 0.00 0.00 17.79 18.17 3hys h ALA 126 CO 0.05 0.29 0.17 0.93 0.00 0.00 0.00 179.25 180.69 3hys h GLU 127 N 0.86 1.05 -0.54 0.00 4.39 -0.87 -1.19 114.58 118.28 3hys h GLU 127 Ca 0.23 -0.24 -0.01 0.00 0.34 0.00 0.00 59.36 59.68 3hys h GLU 127 Cb -0.01 -0.15 -0.03 0.00 -0.10 0.00 0.00 28.75 28.47 3hys h GLU 127 CO -0.04 0.92 0.30 0.00 -1.16 0.00 0.00 179.01 179.03 3hys h ALA 128 N 1.18 0.69 -0.40 3.43 0.00 -1.07 -2.22 119.26 120.87 3hys h ALA 128 Ca 0.21 -0.09 -0.01 0.00 0.00 0.00 0.00 54.91 55.02 3hys h ALA 128 Cb 0.34 -0.22 -0.02 0.00 0.00 0.00 0.00 17.79 17.89 3hys h ALA 128 CO -0.00 0.21 0.20 1.49 0.00 0.00 0.00 179.25 181.15 3hys h GLU 129 N 0.72 0.56 -0.11 0.00 4.81 -0.74 0.20 114.58 120.02 3hys h GLU 129 Ca 0.19 -0.07 0.03 0.00 -0.13 0.00 0.00 59.36 59.38 3hys h GLU 129 Cb 0.05 -0.11 -0.04 0.00 0.63 0.00 0.00 28.75 29.28 3hys h GLU 129 CO -0.03 0.47 -0.10 1.25 -0.73 0.00 0.00 179.01 179.88 3hys h LEU 130 N 0.50 -0.31 -0.01 1.64 5.85 -1.07 -0.10 115.31 121.81 3hys h LEU 130 Ca 0.14 0.06 -0.00 0.00 0.84 0.00 0.00 57.88 58.92 3hys h LEU 130 Cb 0.09 0.16 -0.00 0.00 0.37 0.00 0.00 40.66 41.27 3hys h LEU 130 CO -0.02 -0.13 0.00 0.22 -0.34 0.00 0.00 178.44 178.17 3hys h TYR 131 N -0.11 0.01 0.00 1.25 3.20 -1.14 -2.98 116.97 117.20 3hys h TYR 131 Ca 0.08 0.00 0.00 0.00 3.14 0.00 0.00 58.73 61.95 3hys h TYR 131 Cb 0.23 -0.00 0.00 0.00 1.54 0.00 0.00 36.73 38.49 3hys h TYR 131 CO -0.22 0.04 0.00 -0.44 -1.64 0.00 0.00 178.16 175.90 3hys h ASP 132 N -0.02 0.00 1.59 -2.11 3.32 -0.05 -2.41 116.42 116.73 3hys h ASP 132 Ca 0.00 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.05 3hys h ASP 132 Cb 0.03 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.58 3hys h ASP 132 CO -0.00 0.00 0.00 0.77 -1.72 0.00 0.00 179.24 178.29 3hys h SER 133 N 0.00 0.00 0.00 6.45 4.64 -0.87 -3.48 113.55 120.29 3hys h SER 133 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 3hys h SER 133 Cb 0.49 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.58 3hys h SER 133 CO 0.00 0.00 0.00 0.61 -0.87 0.00 0.00 176.83 176.57 3hys n GLY 134 N 0.91 1.82 3.72 -0.77 0.00 -0.91 -5.02 105.19 104.94 3hys n GLY 134 Ca 0.04 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.64 3hys n GLY 134 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3hys s VAL 135 N -3.38 4.30 -0.21 1.61 1.01 -1.25 -5.01 120.40 117.47 3hys s VAL 135 Ca 0.00 1.76 -0.17 0.00 0.00 0.00 0.00 61.98 63.57 3hys s VAL 135 Cb 0.00 -4.13 -0.03 0.00 0.00 0.00 0.00 36.38 32.22 3hys s VAL 135 CO 0.00 0.20 0.48 -1.10 0.00 0.00 0.00 175.10 174.68 3hys s GLN 136 N 0.52 4.16 0.12 2.72 -1.52 -1.26 -4.85 119.66 119.55 3hys s GLN 136 Ca 0.53 0.32 -0.31 0.00 -1.95 0.00 0.00 55.36 53.94 3hys s GLN 136 Cb -0.26 -3.57 -0.09 0.00 -0.22 0.00 0.00 33.01 28.87 3hys s GLN 136 CO 0.30 -0.16 1.49 -0.51 -0.25 0.00 0.00 175.29 176.17 3hys s LEU 137 N 1.68 4.37 0.56 2.90 1.43 -1.26 -4.99 118.68 123.36 3hys s LEU 137 Ca 0.22 2.45 -0.20 0.00 -1.03 0.00 0.00 54.13 55.57 3hys s LEU 137 Cb -0.15 -3.59 -0.06 0.00 0.03 0.00 0.00 46.19 42.42 3hys s LEU 137 CO 0.09 -0.75 0.98 -2.65 0.23 0.00 0.00 176.35 174.25 3hys n PRO 138 N 4.23 1.04 -0.32 1.29 -0.02 -1.26 -4.77 135.00 135.19 3hys n PRO 138 Ca 0.13 0.39 -0.03 0.00 -2.02 0.00 0.00 63.50 61.97 3hys n PRO 138 Cb 0.41 -2.15 0.11 0.00 -0.02 0.00 0.00 33.50 31.84 3hys n PRO 138 CO 0.00 0.00 0.00 -1.00 1.98 0.00 0.00 175.50 176.48 3hys h PRO 139 N 0.77 1.23 -0.14 0.52 0.13 -1.99 -0.99 132.00 131.54 3hys h PRO 139 Ca -0.48 -0.14 -0.21 0.00 -0.87 0.00 0.00 66.00 64.30 3hys h PRO 139 Cb 1.36 -0.24 0.01 0.00 0.13 0.00 0.00 31.00 32.25 3hys h PRO 139 CO 0.52 0.90 -0.74 1.15 -0.23 0.00 0.00 178.00 179.59 3hys h THR 140 N 1.23 1.29 -0.85 1.56 2.02 -2.00 -1.29 112.91 114.88 3hys h THR 140 Ca 0.31 -1.96 0.01 0.00 0.77 0.00 0.00 66.41 65.54 3hys h THR 140 Cb 0.03 2.04 -0.04 0.00 -1.74 0.00 0.00 68.15 68.44 3hys h THR 140 CO -0.05 0.62 0.56 0.22 0.37 0.00 0.00 175.52 177.24 3hys h TYR 141 N 0.46 1.07 -0.27 3.16 3.20 -1.91 -0.60 116.97 122.08 3hys h TYR 141 Ca -0.05 0.03 -0.08 0.00 3.14 0.00 0.00 58.73 61.76 3hys h TYR 141 Cb 1.38 -0.36 -0.01 0.00 1.54 0.00 0.00 36.73 39.28 3hys h TYR 141 CO 0.09 0.67 -0.13 0.22 -1.64 0.00 0.00 178.16 177.38 3hys h ASP 142 N 1.15 0.59 -0.60 -2.11 3.58 -1.04 -1.05 116.42 116.94 3hys h ASP 142 Ca 0.31 -0.41 -0.03 0.00 0.42 0.00 0.00 57.03 57.32 3hys h ASP 142 Cb -0.13 -0.16 -0.03 0.00 1.72 0.00 0.00 39.33 40.73 3hys h ASP 142 CO -0.07 0.87 0.26 0.00 -2.88 0.00 0.00 179.24 177.42 3hys h ALA 143 N 0.74 0.78 -0.45 -0.78 0.00 -0.92 -1.07 119.26 117.57 3hys h ALA 143 Ca 0.06 -0.16 0.00 0.00 0.00 0.00 0.00 54.91 54.82 3hys h ALA 143 Cb 0.65 -0.24 -0.02 0.00 0.00 0.00 0.00 17.79 18.18 3hys h ALA 143 CO 0.04 0.38 0.30 -0.09 0.00 0.00 0.00 179.25 179.88 3hys h ARG 144 N 0.84 0.59 -0.56 0.00 2.43 -0.79 -0.82 114.38 116.06 3hys h ARG 144 Ca 0.20 -0.04 -0.09 0.00 -0.81 0.00 0.00 59.98 59.24 3hys h ARG 144 Cb 0.18 -0.13 -0.02 0.00 -0.42 0.00 0.00 29.97 29.57 3hys h ARG 144 CO -0.02 0.39 -0.02 0.00 -1.51 0.00 0.00 179.97 178.81 3hys h ALA 145 N 1.16 0.90 -0.62 2.80 0.00 -0.88 -1.13 119.26 121.49 3hys h ALA 145 Ca 0.16 -0.31 -0.01 0.00 0.00 0.00 0.00 54.91 54.75 3hys h ALA 145 Cb -0.07 -0.21 -0.03 0.00 0.00 0.00 0.00 17.79 17.48 3hys h ALA 145 CO -0.04 0.65 0.33 -0.09 0.00 0.00 0.00 179.25 180.10 3hys h ARG 146 N 0.90 0.86 -0.07 0.00 2.43 -0.86 -1.71 114.38 115.94 3hys h ARG 146 Ca 0.16 -0.09 -0.05 0.00 -0.81 0.00 0.00 59.98 59.19 3hys h ARG 146 Cb 0.55 -0.17 0.00 0.00 -0.42 0.00 0.00 29.97 29.93 3hys h ARG 146 CO 0.03 0.64 -0.16 1.25 -1.51 0.00 0.00 179.97 180.22 3hys h LEU 147 N 0.86 0.25 -1.04 3.80 5.85 -0.47 -2.92 115.31 121.65 3hys h LEU 147 Ca 0.22 -0.58 -0.04 0.00 0.84 0.00 0.00 57.88 58.31 3hys h LEU 147 Cb 0.04 -0.07 -0.03 0.00 0.37 0.00 0.00 40.66 40.97 3hys h LEU 147 CO -0.03 0.79 0.19 -0.07 -0.34 0.00 0.00 178.44 178.97 3hys h LEU 148 N -0.27 0.81 -0.77 2.25 4.07 -1.06 -2.78 115.31 117.55 3hys h LEU 148 Ca -0.00 -0.13 0.00 0.00 0.08 0.00 0.00 57.88 57.83 3hys h LEU 148 Cb 0.76 -0.21 0.00 0.00 1.08 0.00 0.00 40.66 42.29 3hys h LEU 148 CO 0.03 0.76 0.00 -0.33 -1.08 0.00 0.00 178.44 177.82 3hys h GLU 149 N 0.85 0.00 0.00 1.13 5.08 -1.33 -3.37 114.58 116.93 3hys h GLU 149 Ca 0.19 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.55 3hys h GLU 149 Cb 0.24 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.49 3hys h GLU 149 CO -0.01 0.00 -0.37 0.09 -1.00 0.00 0.00 179.01 177.72 3hys n ASN 150 N -3.05 1.23 -4.37 1.42 3.02 -1.07 -4.42 115.26 108.02 3hys n ASN 150 Ca 0.02 -0.41 -0.24 0.00 -0.03 0.00 0.00 54.58 53.92 3hys n ASN 150 Cb 0.40 1.03 -0.11 0.00 -0.61 0.00 0.00 39.78 40.49 3hys n ASN 150 CO 0.00 0.00 0.00 -0.36 -2.62 0.00 0.00 177.26 174.28 3hys s PHE 151 N -1.47 2.02 0.88 3.10 0.08 -1.10 -1.95 117.98 119.55 3hys s PHE 151 Ca 0.00 -0.42 -0.12 0.00 0.12 0.00 0.00 56.93 56.52 3hys s PHE 151 Cb 0.02 -0.99 0.12 0.00 -0.57 0.00 0.00 43.02 41.59 3hys s PHE 151 CO 0.10 0.42 1.09 -1.54 -0.10 0.00 0.00 175.22 175.19 3hys s SER 152 N -2.74 3.67 0.19 1.36 1.04 -1.26 -4.52 113.70 111.44 3hys s SER 152 Ca 0.19 1.42 -0.11 0.00 0.48 0.00 0.00 55.95 57.92 3hys s SER 152 Cb -0.06 -2.11 0.20 0.00 0.10 0.00 0.00 66.02 64.15 3hys s SER 152 CO 0.08 -2.50 1.77 0.03 0.98 0.00 0.00 173.24 173.60 3hys h ARG 153 N -1.46 0.46 -0.58 4.02 -0.00 -1.91 0.25 114.38 115.17 3hys h ARG 153 Ca -0.49 -0.03 -0.03 0.00 -0.50 0.00 0.00 59.98 58.93 3hys h ARG 153 Cb 1.28 -0.10 -0.03 0.00 0.00 0.00 0.00 29.97 31.12 3hys h ARG 153 CO 0.56 0.31 0.23 -0.22 0.00 0.00 0.00 179.97 180.85 3hys h LYS 154 N 0.48 0.85 -0.01 0.04 3.64 -1.92 -0.94 116.57 118.69 3hys h LYS 154 Ca 0.26 -0.13 -0.00 0.00 -1.27 0.00 0.00 60.65 59.51 3hys h LYS 154 Cb 0.24 -0.15 -0.00 0.00 -0.41 0.00 0.00 32.23 31.91 3hys h LYS 154 CO -0.22 0.69 -0.00 1.15 -2.27 0.00 0.00 179.45 178.80 3hys h THR 155 N 0.84 1.28 -0.21 1.00 2.02 -1.81 -3.09 112.91 112.93 3hys h THR 155 Ca 0.20 -0.83 0.06 0.00 0.77 0.00 0.00 66.41 66.61 3hys h THR 155 Cb 0.16 1.81 -0.01 0.00 -1.74 0.00 0.00 68.15 68.37 3hys h THR 155 CO -0.02 0.22 0.17 -0.07 0.37 0.00 0.00 175.52 176.19 3hys h LEU 156 N -0.31 0.00 -0.54 2.58 3.38 -0.35 -0.96 115.31 119.10 3hys h LEU 156 Ca 0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 3hys h LEU 156 Cb 0.35 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.10 3hys h LEU 156 CO 0.00 0.00 -0.06 0.59 0.09 0.00 0.00 178.44 179.06 3hys n ASN 157 N -4.24 0.91 -4.25 -0.43 3.02 -0.41 -4.70 115.26 105.15 3hys n ASN 157 Ca 0.02 -1.11 -0.42 0.00 -0.03 0.00 0.00 54.58 53.04 3hys n ASN 157 Cb 0.31 0.00 -0.08 0.00 -0.61 0.00 0.00 39.78 39.40 3hys n ASN 157 CO 0.00 0.00 0.00 -0.62 -2.62 0.00 0.00 177.26 174.02 3hys s ASP 158 N -2.18 5.83 0.36 6.41 -1.08 -0.36 -4.93 116.67 120.71 3hys s ASP 158 Ca 0.36 -1.77 0.06 0.00 -0.52 0.00 0.00 52.55 50.67 3hys s ASP 158 Cb 0.21 -2.06 0.74 0.00 -1.46 0.00 0.00 42.92 40.34 3hys s ASP 158 CO 0.40 -0.70 1.96 0.44 0.52 0.00 0.00 175.17 177.80 3hys h ASP 159 N 8.56 0.66 0.02 -0.34 3.32 -1.84 -0.69 116.42 126.12 3hys h ASP 159 Ca -0.24 0.00 -0.00 0.00 0.02 0.00 0.00 57.03 56.81 3hys h ASP 159 Cb 1.08 -0.14 0.00 0.00 0.22 0.00 0.00 39.33 40.49 3hys h ASP 159 CO 0.88 0.43 -0.01 0.58 -1.72 0.00 0.00 179.24 179.41 3hys h VAL 160 N 0.76 1.21 -0.96 -1.35 2.07 -1.93 -2.21 116.25 113.83 3hys h VAL 160 Ca 0.30 -0.71 0.02 0.00 0.82 0.00 0.00 66.70 67.13 3hys h VAL 160 Cb 0.23 1.69 -0.05 0.00 -1.52 0.00 0.00 31.29 31.63 3hys h VAL 160 CO -0.10 0.18 0.63 0.00 0.02 0.00 0.00 177.57 178.30 3hys h ALA 161 N 0.63 1.25 -0.16 1.67 0.00 -1.73 -2.15 119.26 118.76 3hys h ALA 161 Ca -0.00 -0.05 0.03 0.00 0.00 0.00 0.00 54.91 54.89 3hys h ALA 161 Cb 0.32 -0.36 -0.03 0.00 0.00 0.00 0.00 17.79 17.72 3hys h ALA 161 CO 0.00 0.55 -0.06 0.28 0.00 0.00 0.00 179.25 180.03 3hys h VAL 162 N 1.25 0.79 -0.82 0.00 2.07 -1.08 -0.59 116.25 117.87 3hys h VAL 162 Ca 0.37 0.00 0.10 0.00 0.82 0.00 0.00 66.70 67.99 3hys h VAL 162 Cb -0.06 0.79 -0.07 0.00 -1.52 0.00 0.00 31.29 30.42 3hys h VAL 162 CO -0.10 0.00 0.47 1.23 0.02 0.00 0.00 177.57 179.18 3hys h GLY 163 N -0.03 1.28 0.95 2.17 0.00 -0.92 -1.34 103.07 105.17 3hys h GLY 163 Ca 0.08 -0.31 0.00 0.00 0.00 0.00 0.00 47.33 47.11 3hys h GLY 163 CO -0.18 0.12 -0.01 -0.55 0.00 0.00 0.00 176.54 175.91 3hys h ASP 164 N 0.78 -0.04 -0.75 0.19 3.32 -0.69 -1.90 116.42 117.33 3hys h ASP 164 Ca 0.40 0.01 -0.06 0.00 0.02 0.00 0.00 57.03 57.40 3hys h ASP 164 Cb 0.38 0.02 -0.03 0.00 0.22 0.00 0.00 39.33 39.91 3hys h ASP 164 CO -0.25 -0.02 0.24 -0.50 -1.72 0.00 0.00 179.24 176.99 3hys h TRP 165 N -0.02 1.20 -0.66 4.55 4.06 -0.84 -1.21 115.95 123.03 3hys h TRP 165 Ca 0.01 -0.12 -0.08 0.00 2.06 0.00 0.00 58.89 60.76 3hys h TRP 165 Cb 0.03 -0.35 -0.03 0.00 -1.00 0.00 0.00 29.16 27.82 3hys h TRP 165 CO -0.09 0.94 0.11 0.82 -3.56 0.00 0.00 178.44 176.66 3hys h ILE 166 N 1.11 1.26 -0.51 1.49 5.03 -1.16 -0.16 117.51 124.57 3hys h ILE 166 Ca 0.24 -1.02 -0.11 0.00 -0.12 0.00 0.00 64.86 63.86 3hys h ILE 166 Cb 0.30 0.65 -0.02 0.00 -3.03 0.00 0.00 36.82 34.72 3hys h ILE 166 CO -0.01 0.38 -0.10 0.00 -0.68 0.00 0.00 178.15 177.74 3hys h ALA 167 N 1.04 0.86 0.00 1.87 0.00 -1.18 -2.45 119.26 119.40 3hys h ALA 167 Ca 0.20 -0.34 -0.05 0.00 0.00 0.00 0.00 54.91 54.72 3hys h ALA 167 Cb 0.43 -0.19 -0.01 0.00 0.00 0.00 0.00 17.79 18.02 3hys h ALA 167 CO 0.01 0.65 -0.23 1.98 0.00 0.00 0.00 179.25 181.66 3hys h MET 168 N 0.84 0.00 -0.69 0.00 1.85 -0.25 -2.53 114.93 114.16 3hys h MET 168 Ca 0.14 0.00 0.07 0.00 -0.61 0.00 0.00 59.70 59.29 3hys h MET 168 Cb 0.64 0.00 -0.04 0.00 0.43 0.00 0.00 31.60 32.63 3hys h MET 168 CO 0.04 0.23 0.45 0.74 -0.40 0.00 0.00 176.91 177.98 3hys h PHE 169 N 0.00 0.69 0.00 1.39 0.04 -0.55 -0.36 116.94 118.15 3hys h PHE 169 Ca -0.00 0.02 0.00 0.00 2.80 0.00 0.00 57.97 60.79 3hys h PHE 169 Cb 0.54 -0.23 0.00 0.00 2.20 0.00 0.00 35.95 38.46 3hys h PHE 169 CO 0.00 0.36 0.00 0.66 -0.60 0.00 0.00 178.31 178.73 3hys h SER 170 N 0.68 0.00 0.32 2.17 4.64 -1.49 -1.93 113.55 117.95 3hys h SER 170 Ca 0.30 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.62 3hys h SER 170 Cb 0.29 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.38 3hys h SER 170 CO -0.10 0.00 -0.53 0.23 -0.87 0.00 0.00 176.83 175.56 3hys n MET 171 N -3.01 0.26 -3.10 4.77 2.81 -0.24 -4.30 117.12 114.31 3hys n MET 171 Ca 0.01 -0.17 -0.24 0.00 -1.81 0.00 0.00 57.70 55.49 3hys n MET 171 Cb 0.34 -1.50 -0.04 0.00 -0.71 0.00 0.00 33.22 31.31 3hys n MET 171 CO 0.00 0.00 0.00 0.91 1.51 0.00 0.00 175.97 178.39 3hys n TRP 172 N -1.22 2.51 -1.75 2.03 7.02 -0.65 -5.11 117.44 120.27 3hys n TRP 172 Ca 0.07 -3.93 -0.38 0.00 -1.02 0.00 0.00 57.50 52.23 3hys n TRP 172 Cb 0.35 -0.47 0.05 0.00 -2.42 0.00 0.00 31.31 28.81 3hys n TRP 172 CO 0.00 0.00 0.00 -1.25 -2.02 0.00 0.00 177.69 174.42 3hys s PRO 173 N -2.85 3.03 -0.40 -0.99 0.04 -1.15 -4.86 135.00 127.83 3hys s PRO 173 Ca 0.44 2.24 -0.06 0.00 0.04 0.00 0.00 61.00 63.65 3hys s PRO 173 Cb 0.27 -2.20 0.08 0.00 0.04 0.00 0.00 34.50 32.70 3hys s PRO 173 CO -0.10 -1.28 0.20 0.42 0.04 0.00 0.00 177.00 176.28 3hys s ILE 174 N -1.30 3.80 0.20 0.56 -1.09 -1.26 -5.07 121.20 117.04 3hys s ILE 174 Ca 0.73 -1.55 -0.30 0.00 -2.23 0.00 0.00 60.65 57.31 3hys s ILE 174 Cb -0.41 -3.36 -0.08 0.00 -1.58 0.00 0.00 42.46 37.03 3hys s ILE 174 CO 0.47 -0.48 1.10 -0.75 -1.23 0.00 0.00 174.94 174.06 3hys s LYS 175 N 1.33 4.60 -0.46 2.79 2.20 -1.26 -4.98 119.74 123.96 3hys s LYS 175 Ca 0.03 1.74 -0.29 0.00 -0.36 0.00 0.00 55.97 57.09 3hys s LYS 175 Cb -0.22 -3.26 0.02 0.00 -1.51 0.00 0.00 37.83 32.86 3hys s LYS 175 CO 0.00 0.10 1.30 0.45 -0.36 0.00 0.00 175.35 176.84 3hys s SER 176 N -0.28 6.43 0.21 1.43 0.15 -1.26 -4.82 113.70 115.57 3hys s SER 176 Ca 0.48 0.60 0.01 0.00 0.70 0.00 0.00 55.95 57.74 3hys s SER 176 Cb -0.30 -2.55 -0.05 0.00 -1.71 0.00 0.00 66.02 61.42 3hys s SER 176 CO 0.36 -1.40 0.06 0.42 1.20 0.00 0.00 173.24 173.88 3hys s THR 177 N 5.10 0.52 0.47 6.45 -4.23 -1.26 -5.02 115.64 117.66 3hys s THR 177 Ca 0.55 -1.99 0.13 0.00 -1.18 0.00 0.00 61.69 59.20 3hys s THR 177 Cb -0.10 -2.37 0.25 0.00 1.34 0.00 0.00 72.50 71.61 3hys s THR 177 CO 0.31 -0.23 2.08 -0.65 -0.54 0.00 0.00 174.62 175.60 3hys h PRO 178 N 2.57 0.17 -0.20 3.99 0.11 -1.85 -2.14 132.00 134.64 3hys h PRO 178 Ca -0.37 -0.02 -0.05 0.00 0.11 0.00 0.00 66.00 65.68 3hys h PRO 178 Cb 1.23 -0.04 -0.01 0.00 0.11 0.00 0.00 31.00 32.29 3hys h PRO 178 CO 0.61 0.16 -0.05 0.78 -0.21 0.00 0.00 178.00 179.28 3hys h GLY 179 N 0.30 0.43 0.78 -0.55 0.00 -0.46 0.37 103.07 103.93 3hys h GLY 179 Ca 0.04 -0.35 0.05 0.00 0.00 0.00 0.00 47.33 47.07 3hys h GLY 179 CO -0.00 0.32 0.48 -2.00 0.00 0.00 0.00 176.54 175.34 3hys h LEU 180 N 0.11 0.76 -0.42 3.11 5.85 -1.60 0.50 115.31 123.63 3hys h LEU 180 Ca 0.05 0.01 -0.02 0.00 0.84 0.00 0.00 57.88 58.77 3hys h LEU 180 Cb 0.50 -0.15 -0.02 0.00 0.37 0.00 0.00 40.66 41.37 3hys h LEU 180 CO 0.02 0.50 0.20 -0.09 -0.34 0.00 0.00 178.44 178.73 3hys h ARG 181 N 0.89 0.60 -0.12 1.25 9.65 -1.08 -2.89 114.38 122.68 3hys h ARG 181 Ca 0.33 -0.09 -0.08 0.00 -1.10 0.00 0.00 59.98 59.04 3hys h ARG 181 Cb 0.11 -0.11 -0.01 0.00 -1.39 0.00 0.00 29.97 28.57 3hys h ARG 181 CO -0.15 0.53 -0.27 0.00 2.80 0.00 0.00 179.97 182.87 3hys h GLN 183 N 0.20 0.00 0.00 0.00 4.20 -0.70 -1.55 115.11 117.25 3hys h GLN 183 Ca 0.03 0.00 -0.01 0.00 0.06 0.00 0.00 58.65 58.73 3hys h GLN 183 Cb 0.60 0.00 -0.00 0.00 0.30 0.00 0.00 27.48 28.38 3hys h GLN 183 CO 0.04 0.11 -0.03 1.25 -0.67 0.00 0.00 178.83 179.53 3hys h LEU 184 N 0.00 0.00 -1.23 1.46 5.85 -1.26 -1.71 115.31 118.43 3hys h LEU 184 Ca -0.00 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.72 3hys h LEU 184 Cb 0.26 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.29 3hys h LEU 184 CO 0.01 0.03 0.00 0.47 -0.34 0.00 0.00 178.44 178.61 3hys n ASP 185 N -3.99 1.87 -3.83 1.25 8.00 -0.58 -4.45 116.55 114.81 3hys n ASP 185 Ca -0.03 -1.67 -0.42 0.00 0.71 0.00 0.00 54.79 53.37 3hys n ASP 185 Cb 0.12 -0.06 0.00 0.00 -0.02 0.00 0.00 41.12 41.16 3hys n ASP 185 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 3hys s ALA 187 N 0.85 -0.96 0.12 0.00 0.00 -1.26 -4.89 121.76 115.62 3hys s ALA 187 Ca 0.41 -0.07 -0.34 0.00 0.00 0.00 0.00 51.96 51.96 3hys s ALA 187 Cb 0.11 0.76 -0.13 0.00 0.00 0.00 0.00 23.12 23.85 3hys s ALA 187 CO -0.01 -0.69 1.65 -2.30 0.00 0.00 0.00 175.76 174.41 3hys n PRO 188 N -0.27 2.23 0.00 0.00 -0.02 -1.26 -4.84 135.00 130.84 3hys n PRO 188 Ca -0.14 0.81 0.09 0.00 -2.02 0.00 0.00 63.50 62.23 3hys n PRO 188 Cb 0.64 -2.60 -0.08 0.00 -0.02 0.00 0.00 33.50 31.44 3hys n PRO 188 CO 0.00 0.00 0.00 1.04 1.98 0.00 0.00 175.50 178.52 3hys n GLN 189 N 4.14 0.93 -4.08 -0.52 1.13 -1.26 -4.47 117.38 113.24 3hys n GLN 189 Ca 0.18 -0.26 -0.11 0.00 -1.94 0.00 0.00 57.00 54.87 3hys n GLN 189 Cb 0.30 -1.40 -0.06 0.00 0.11 0.00 0.00 30.24 29.19 3hys n GLN 189 CO 0.00 0.00 0.00 0.95 -1.44 0.00 0.00 177.06 176.57 3hys s THR 190 N -2.64 0.00 -0.31 5.09 -4.23 -1.26 -5.05 115.64 107.24 3hys s THR 190 Ca 0.10 -1.63 -0.29 0.00 -1.18 0.00 0.00 61.69 58.69 3hys s THR 190 Cb 0.15 -2.38 0.01 0.00 1.34 0.00 0.00 72.50 71.61 3hys s THR 190 CO 0.70 0.00 1.16 0.21 -0.54 0.00 0.00 174.62 176.16 3hys s ASN 191 N -3.11 6.83 0.00 3.99 2.47 -1.26 -4.58 114.94 119.27 3hys s ASN 191 Ca 0.29 1.11 0.22 0.00 0.42 0.00 0.00 52.86 54.89 3hys s ASN 191 Cb 0.02 -2.54 -0.12 0.00 -1.45 0.00 0.00 41.25 37.16 3hys s ASN 191 CO 0.13 -0.96 0.95 0.54 -3.72 0.00 0.00 177.10 174.04 3hys n ARG 192 N 7.06 0.06 -0.33 0.43 5.12 0.28 -4.39 116.66 124.89 3hys n ARG 192 Ca 0.13 -0.01 0.14 0.00 -1.93 0.00 0.00 57.85 56.17 3hys n ARG 192 Cb 0.47 -1.51 0.36 0.00 -1.16 0.00 0.00 32.46 30.62 3hys n ARG 192 CO 0.00 0.00 0.00 -0.07 -1.93 0.00 0.00 177.63 175.63 3hys h LEU 193 N 0.00 0.71 -1.10 0.55 3.38 -1.89 -1.65 115.31 115.31 3hys h LEU 193 Ca 0.00 0.08 -0.04 0.00 0.09 0.00 0.00 57.88 58.01 3hys h LEU 193 Cb 0.55 -0.05 -0.03 0.00 0.09 0.00 0.00 40.66 41.22 3hys h LEU 193 CO 0.00 0.28 0.19 -0.65 0.09 0.00 0.00 178.44 178.35 3hys h PRO 194 N 0.71 0.83 0.00 1.13 0.11 -1.95 -2.07 132.00 130.75 3hys h PRO 194 Ca 0.54 -0.14 -0.01 0.00 0.11 0.00 0.00 66.00 66.51 3hys h PRO 194 Cb 0.91 -0.14 -0.00 0.00 0.11 0.00 0.00 31.00 31.88 3hys h PRO 194 CO -0.31 0.70 -0.02 0.00 -0.21 0.00 0.00 178.00 178.16 3hys h ALA 195 N 1.40 1.79 0.00 -0.75 0.00 -1.62 -2.50 119.26 117.58 3hys h ALA 195 Ca 0.19 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 55.08 3hys h ALA 195 Cb 0.21 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.00 3hys h ALA 195 CO -0.01 0.03 -0.01 1.88 0.00 0.00 0.00 179.25 181.13 3hys h TYR 196 N 0.00 0.00 0.00 0.00 0.05 -1.17 -2.94 116.97 112.91 3hys h TYR 196 Ca -0.00 0.00 -0.00 0.00 0.05 0.00 0.00 58.73 58.78 3hys h TYR 196 Cb 0.05 0.00 -0.00 0.00 1.01 0.00 0.00 36.73 37.79 3hys h TYR 196 CO 0.00 0.00 -0.02 0.00 -1.05 0.00 0.00 178.16 177.09 3hys h ARG 197 N 0.00 0.00 -0.02 4.88 3.08 -1.41 -2.15 114.38 118.77 3hys h ARG 197 Ca 0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.05 3hys h ARG 197 Cb 0.77 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.82 3hys h ARG 197 CO 0.00 0.02 -0.01 0.09 -1.07 0.00 0.00 179.97 179.00 3hys n ASN 198 N -3.33 1.87 -4.63 7.04 5.03 -1.11 -4.50 115.26 115.62 3hys n ASN 198 Ca -0.02 -1.61 -0.43 0.00 0.87 0.00 0.00 54.58 53.38 3hys n ASN 198 Cb 0.13 0.00 -0.02 0.00 -1.02 0.00 0.00 39.78 38.88 3hys n ASN 198 CO 0.00 0.00 0.00 -0.63 -1.83 0.00 0.00 177.26 174.80 3hys s ILE 199 N -2.01 4.44 0.03 2.41 1.01 -0.81 -4.93 121.20 121.34 3hys s ILE 199 Ca 0.35 1.60 0.10 0.00 0.00 0.00 0.00 60.65 62.70 3hys s ILE 199 Cb 0.21 -4.46 -0.15 0.00 0.01 0.00 0.00 42.46 38.07 3hys s ILE 199 CO 0.33 -0.61 1.21 0.00 0.00 0.00 0.00 174.94 175.87 3hys h ALA 200 N 8.37 0.49 -2.97 9.38 0.00 -1.89 -3.37 119.26 129.27 3hys h ALA 200 Ca -0.21 -0.89 -0.55 0.00 0.00 0.00 0.00 54.91 53.26 3hys h ALA 200 Cb 1.06 -0.03 0.16 0.00 0.00 0.00 0.00 17.79 18.98 3hys h ALA 200 CO 1.05 1.15 0.48 0.00 0.00 0.00 0.00 179.25 181.93 3hys s ALA 201 N -2.76 2.31 0.29 0.00 0.00 -1.26 -4.59 121.76 115.74 3hys s ALA 201 Ca 0.01 1.12 -0.29 0.00 0.00 0.00 0.00 51.96 52.79 3hys s ALA 201 Cb 0.09 -3.53 -0.10 0.00 0.00 0.00 0.00 23.12 19.59 3hys s ALA 201 CO 0.80 -1.66 1.19 -1.25 0.00 0.00 0.00 175.76 174.84 3hys s PRO 202 N -3.51 4.52 -0.02 0.00 0.04 -1.26 -4.57 135.00 130.20 3hys s PRO 202 Ca 0.80 1.96 0.01 0.00 0.04 0.00 0.00 61.00 63.82 3hys s PRO 202 Cb -0.35 -3.15 0.01 0.00 0.04 0.00 0.00 34.50 31.05 3hys s PRO 202 CO 0.41 0.04 -0.04 0.08 0.04 0.00 0.00 177.00 177.53 3hys s VAL 203 N -1.04 0.39 -0.25 -0.36 1.01 -0.80 -1.95 120.40 117.41 3hys s VAL 203 Ca 0.47 -0.11 -0.10 0.00 0.00 0.00 0.00 61.98 62.24 3hys s VAL 203 Cb -0.35 -0.40 -0.05 0.00 0.00 0.00 0.00 36.38 35.58 3hys s VAL 203 CO 0.45 0.16 0.14 -0.22 0.00 0.00 0.00 175.10 175.63 3hys s LEU 204 N 0.52 3.94 -0.20 3.92 2.96 0.02 -1.81 118.68 128.02 3hys s LEU 204 Ca -0.06 0.02 -0.07 0.00 -0.22 0.00 0.00 54.13 53.80 3hys s LEU 204 Cb -0.09 -2.06 -0.04 0.00 0.50 0.00 0.00 46.19 44.50 3hys s LEU 204 CO -0.00 0.03 0.05 -0.69 -1.32 0.00 0.00 176.35 174.42 3hys s VAL 205 N 1.29 4.52 -0.18 1.68 1.01 -0.03 -0.56 120.40 128.12 3hys s VAL 205 Ca 0.07 -0.12 -0.02 0.00 0.00 0.00 0.00 61.98 61.90 3hys s VAL 205 Cb -0.14 -3.06 -0.01 0.00 0.00 0.00 0.00 36.38 33.17 3hys s VAL 205 CO 0.06 0.42 -0.08 -0.63 0.00 0.00 0.00 175.10 174.87 3hys s ILE 206 N 0.81 3.30 0.03 2.22 1.01 0.47 -0.62 121.20 128.42 3hys s ILE 206 Ca 0.03 -0.54 0.03 0.00 0.00 0.00 0.00 60.65 60.17 3hys s ILE 206 Cb -0.14 -2.45 -0.04 0.00 0.01 0.00 0.00 42.46 39.84 3hys s ILE 206 CO 0.02 0.47 -0.00 -0.83 0.00 0.00 0.00 174.94 174.60 3hys s GLY 207 N 0.96 1.88 -0.22 6.18 0.00 0.26 -1.19 107.32 115.20 3hys s GLY 207 Ca -0.01 -1.02 -0.07 0.00 0.00 0.00 0.00 44.72 43.63 3hys s GLY 207 CO -0.00 -0.93 0.05 -1.36 0.00 0.00 0.00 173.10 170.87 3hys s PHE 208 N -1.16 3.13 0.38 1.90 0.08 -1.26 -0.63 117.98 120.41 3hys s PHE 208 Ca 0.22 -0.25 0.08 0.00 0.12 0.00 0.00 56.93 57.10 3hys s PHE 208 Cb -0.12 -2.15 0.82 0.00 -0.57 0.00 0.00 43.02 41.00 3hys s PHE 208 CO 0.13 -0.16 1.95 0.00 -0.10 0.00 0.00 175.22 177.04 3hys h ALA 209 N 7.56 1.80 -0.64 5.36 0.00 -1.17 -1.51 119.26 130.66 3hys h ALA 209 Ca -0.37 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.53 3hys h ALA 209 Cb 1.18 -0.16 0.00 0.00 0.00 0.00 0.00 17.79 18.81 3hys h ALA 209 CO 0.62 0.06 0.00 -0.25 0.00 0.00 0.00 179.25 179.68 3hys n ASP 210 N -4.49 3.80 -4.64 0.00 9.92 0.15 -4.80 116.55 116.49 3hys n ASP 210 Ca 0.12 -1.99 -0.43 0.00 -0.53 0.00 0.00 54.79 51.96 3hys n ASP 210 Cb 0.30 -0.43 -0.03 0.00 -0.64 0.00 0.00 41.12 40.33 3hys n ASP 210 CO 0.00 0.00 0.00 -0.62 0.13 0.00 0.00 177.20 176.71 3hys s ASP 211 N -1.09 6.37 0.01 -2.24 -1.08 -0.57 -4.64 116.67 113.43 3hys s ASP 211 Ca 0.45 1.93 0.22 0.00 -0.52 0.00 0.00 52.55 54.64 3hys s ASP 211 Cb 0.24 -2.53 -0.16 0.00 -1.46 0.00 0.00 42.92 39.01 3hys s ASP 211 CO 0.32 -1.21 0.82 1.33 0.52 0.00 0.00 175.17 176.94 3hys n VAL 212 N 6.19 0.06 0.10 1.11 0.24 -1.26 -3.46 118.33 121.31 3hys n VAL 212 Ca 0.20 -0.24 -0.23 0.00 -2.04 0.00 0.00 64.34 62.03 3hys n VAL 212 Cb 0.44 0.42 -0.15 0.00 -1.47 0.00 0.00 33.84 33.08 3hys n VAL 212 CO 0.00 0.00 0.00 0.58 -2.14 0.00 0.00 176.83 175.27 3hys h VAL 213 N 0.00 1.34 -2.91 3.34 2.07 -1.90 -3.40 116.25 114.78 3hys h VAL 213 Ca 0.00 -2.62 -0.60 0.00 0.82 0.00 0.00 66.70 64.30 3hys h VAL 213 Cb 0.73 3.08 -0.40 0.00 -1.52 0.00 0.00 31.29 33.18 3hys h VAL 213 CO 0.00 0.77 -0.76 0.42 0.02 0.00 0.00 177.57 178.02 3hys s THR 214 N -2.53 1.09 0.46 2.57 -4.23 -1.26 -4.95 115.64 106.79 3hys s THR 214 Ca -0.12 -2.28 -0.24 0.00 -1.18 0.00 0.00 61.69 57.87 3hys s THR 214 Cb 0.03 -1.77 -0.09 0.00 1.34 0.00 0.00 72.50 72.01 3hys s THR 214 CO 0.89 -0.90 1.21 -0.81 -0.54 0.00 0.00 174.62 174.48 3hys n PRO 215 N 3.75 1.71 0.25 3.99 -0.04 -1.22 -4.72 135.00 138.72 3hys n PRO 215 Ca 0.08 0.61 0.10 0.00 -0.04 0.00 0.00 63.50 64.26 3hys n PRO 215 Cb 0.35 -2.34 0.65 0.00 -0.04 0.00 0.00 33.50 32.13 3hys n PRO 215 CO 0.00 0.00 0.00 -1.00 -0.04 0.00 0.00 175.50 174.46 3hys h PRO 216 N 1.76 0.00 0.00 0.54 0.13 -1.75 -1.81 132.00 130.87 3hys h PRO 216 Ca -0.48 0.00 -0.01 0.00 -0.87 0.00 0.00 66.00 64.64 3hys h PRO 216 Cb 1.31 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 32.44 3hys h PRO 216 CO 0.58 0.13 -0.07 0.10 -0.23 0.00 0.00 178.00 178.51 3hys h TYR 217 N 0.00 0.00 -0.08 1.56 -0.00 -1.95 -1.86 116.97 114.63 3hys h TYR 217 Ca -0.00 0.00 -0.11 0.00 -0.00 0.00 0.00 58.73 58.62 3hys h TYR 217 Cb 0.29 0.00 -0.01 0.00 -0.00 0.00 0.00 36.73 37.00 3hys h TYR 217 CO 0.00 0.07 -0.44 -0.07 -0.00 0.00 0.00 178.16 177.72 3hys h LEU 218 N 0.00 0.20 -0.25 0.10 3.38 -1.60 -1.93 115.31 115.21 3hys h LEU 218 Ca -0.00 -0.09 -0.19 0.00 0.09 0.00 0.00 57.88 57.70 3hys h LEU 218 Cb 0.14 -0.06 0.00 0.00 0.09 0.00 0.00 40.66 40.84 3hys h LEU 218 CO 0.01 0.62 -0.57 1.23 0.09 0.00 0.00 178.44 179.82 3hys h GLY 219 N 1.28 0.91 0.82 0.83 0.00 -1.02 -2.96 103.07 102.92 3hys h GLY 219 Ca 0.01 -1.11 0.04 0.00 0.00 0.00 0.00 47.33 46.28 3hys h GLY 219 CO 0.07 0.99 0.54 -0.09 0.00 0.00 0.00 176.54 178.05 3hys h ARG 220 N 0.59 1.00 -0.86 4.80 2.43 -1.27 -0.93 114.38 120.13 3hys h ARG 220 Ca 0.00 -0.06 0.05 0.00 -0.81 0.00 0.00 59.98 59.16 3hys h ARG 220 Cb 1.18 -0.23 -0.05 0.00 -0.42 0.00 0.00 29.97 30.45 3hys h ARG 220 CO 0.12 0.66 0.56 0.93 -1.51 0.00 0.00 179.97 180.74 3hys h GLU 221 N 1.03 0.99 -0.19 0.20 5.08 -1.30 -0.57 114.58 119.82 3hys h GLU 221 Ca 0.35 -0.06 -0.04 0.00 -1.00 0.00 0.00 59.36 58.62 3hys h GLU 221 Cb 0.07 -0.22 -0.01 0.00 0.50 0.00 0.00 28.75 29.09 3hys h GLU 221 CO -0.14 0.66 -0.03 0.28 -1.00 0.00 0.00 179.01 178.78 3hys h VAL 222 N 1.02 1.28 -0.99 3.13 2.07 -1.05 -1.52 116.25 120.19 3hys h VAL 222 Ca 0.36 -0.97 0.04 0.00 0.82 0.00 0.00 66.70 66.94 3hys h VAL 222 Cb 0.12 1.52 -0.06 0.00 -1.52 0.00 0.00 31.29 31.35 3hys h VAL 222 CO -0.12 0.29 0.65 0.00 0.02 0.00 0.00 177.57 178.41 3hys h ALA 223 N 0.75 1.31 -0.26 1.67 0.00 -0.99 -1.69 119.26 120.06 3hys h ALA 223 Ca 0.05 -0.05 -0.11 0.00 0.00 0.00 0.00 54.91 54.81 3hys h ALA 223 Cb 0.46 -0.35 -0.01 0.00 0.00 0.00 0.00 17.79 17.88 3hys h ALA 223 CO 0.02 0.54 -0.30 -0.44 0.00 0.00 0.00 179.25 179.07 3hys h ASP 224 N 1.26 0.53 -0.57 0.00 3.32 -0.92 -2.86 116.42 117.18 3hys h ASP 224 Ca 0.39 -0.20 -0.09 0.00 0.02 0.00 0.00 57.03 57.16 3hys h ASP 224 Cb -0.00 -0.15 -0.02 0.00 0.22 0.00 0.00 39.33 39.38 3hys h ASP 224 CO -0.12 0.81 0.02 0.00 -1.72 0.00 0.00 179.24 178.22 3hys h ALA 225 N 1.23 0.91 -2.18 3.45 0.00 -0.72 -3.43 119.26 118.51 3hys h ALA 225 Ca 0.06 -0.30 -0.57 0.00 0.00 0.00 0.00 54.91 54.11 3hys h ALA 225 Cb 0.74 -0.22 -0.04 0.00 0.00 0.00 0.00 17.79 18.27 3hys h ALA 225 CO 0.06 0.65 0.77 -0.51 0.00 0.00 0.00 179.25 180.22 3hys s LEU 226 N -9.31 4.19 0.40 0.00 1.43 -0.69 -3.68 118.68 111.02 3hys s LEU 226 Ca -0.11 1.61 0.11 0.00 -1.03 0.00 0.00 54.13 54.70 3hys s LEU 226 Cb 0.14 -3.55 0.82 0.00 0.03 0.00 0.00 46.19 43.63 3hys s LEU 226 CO 0.85 -0.64 1.92 1.55 0.23 0.00 0.00 176.35 180.25 3hys h PRO 227 N 7.64 0.17 -0.39 1.29 0.13 -1.79 -1.97 132.00 137.08 3hys h PRO 227 Ca -0.27 -0.04 -0.21 0.00 -0.87 0.00 0.00 66.00 64.61 3hys h PRO 227 Cb 1.11 -0.02 -0.12 0.00 0.13 0.00 0.00 31.00 32.09 3hys h PRO 227 CO 0.93 0.34 -0.06 0.09 -0.23 0.00 0.00 178.00 179.07 3hys n ASN 228 N -4.27 2.58 -4.92 1.44 3.02 -1.26 -5.02 115.26 106.83 3hys n ASN 228 Ca -0.01 -3.80 -0.29 0.00 -0.03 0.00 0.00 54.58 50.46 3hys n ASN 228 Cb 0.28 -0.65 -0.04 0.00 -0.61 0.00 0.00 39.78 38.76 3hys n ASN 228 CO 0.00 0.00 0.00 -0.83 -2.62 0.00 0.00 177.26 173.81 3hys s GLY 229 N -2.52 1.91 0.02 7.41 0.00 -0.74 -1.91 107.32 111.49 3hys s GLY 229 Ca 0.46 -0.74 0.01 0.00 0.00 0.00 0.00 44.72 44.44 3hys s GLY 229 CO -0.00 -0.68 -0.03 -1.60 0.00 0.00 0.00 173.10 170.78 3hys s ARG 230 N -3.17 0.29 -0.09 2.90 3.52 -0.75 -4.81 118.95 116.84 3hys s ARG 230 Ca 0.39 -0.42 -0.01 0.00 -0.13 0.00 0.00 55.73 55.57 3hys s ARG 230 Cb -0.11 -0.07 -0.03 0.00 -1.56 0.00 0.00 34.95 33.18 3hys s ARG 230 CO 0.28 0.01 -0.05 -0.47 -0.81 0.00 0.00 175.30 174.26 3hys s TYR 231 N -0.87 3.01 -0.02 5.12 5.04 -1.26 -0.85 117.35 127.52 3hys s TYR 231 Ca -0.08 0.01 0.00 0.00 -2.44 0.00 0.00 57.07 54.56 3hys s TYR 231 Cb -0.06 -1.77 0.02 0.00 0.35 0.00 0.00 41.96 40.50 3hys s TYR 231 CO -0.00 0.30 0.01 -1.17 -1.34 0.00 0.00 175.55 173.35 3hys s LEU 232 N -0.62 1.28 -0.14 6.97 2.96 0.20 -4.96 118.68 124.39 3hys s LEU 232 Ca 0.09 0.00 -0.03 0.00 -0.22 0.00 0.00 54.13 53.98 3hys s LEU 232 Cb -0.12 -0.12 -0.03 0.00 0.50 0.00 0.00 46.19 46.42 3hys s LEU 232 CO 0.02 -0.09 -0.03 -1.58 -1.32 0.00 0.00 176.35 173.35 3hys s GLN 233 N 0.84 3.52 -0.30 1.98 0.74 -1.26 -0.57 119.66 124.60 3hys s GLN 233 Ca -0.08 -0.49 -0.12 0.00 0.05 0.00 0.00 55.36 54.73 3hys s GLN 233 Cb -0.11 -2.89 -0.04 0.00 1.10 0.00 0.00 33.01 31.07 3hys s GLN 233 CO -0.02 0.35 0.21 0.42 -0.55 0.00 0.00 175.29 175.70 3hys s ILE 234 N 0.07 5.26 0.60 -2.34 -1.09 0.20 -4.94 121.20 118.96 3hys s ILE 234 Ca 0.00 0.00 -0.16 0.00 -2.23 0.00 0.00 60.65 58.26 3hys s ILE 234 Cb -0.13 -3.58 -0.03 0.00 -1.58 0.00 0.00 42.46 37.13 3hys s ILE 234 CO 0.02 0.15 1.08 -2.16 -1.23 0.00 0.00 174.94 172.81 3hys s PRO 235 N 1.74 3.20 -1.43 2.79 0.04 -1.26 -1.45 135.00 138.63 3hys s PRO 235 Ca 0.07 1.34 -0.08 0.00 0.04 0.00 0.00 61.00 62.37 3hys s PRO 235 Cb -0.17 -2.01 0.01 0.00 0.04 0.00 0.00 34.50 32.38 3hys s PRO 235 CO 0.11 -0.92 0.99 -0.25 0.04 0.00 0.00 177.00 176.96 3hys n ASP 236 N -1.95 -6.27 -4.01 6.66 8.00 -1.26 -4.85 116.55 112.87 3hys n ASP 236 Ca 0.10 -0.46 -0.26 0.00 0.71 0.00 0.00 54.79 54.87 3hys n ASP 236 Cb 0.52 -4.97 -0.17 0.00 -0.02 0.00 0.00 41.12 36.48 3hys n ASP 236 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 3hys s ALA 237 N -3.27 1.37 0.75 2.24 0.00 -1.25 -4.72 121.76 116.89 3hys s ALA 237 Ca 0.50 -0.51 0.00 0.00 0.00 0.00 0.00 51.96 51.94 3hys s ALA 237 Cb -0.22 -0.70 0.00 0.00 0.00 0.00 0.00 23.12 22.20 3hys s ALA 237 CO 0.61 -0.04 0.00 0.41 0.00 0.00 0.00 175.76 176.75 3hys n GLY 238 N 4.13 -0.28 0.36 0.00 0.00 -1.26 -0.67 105.19 107.47 3hys n GLY 238 Ca -0.20 -1.77 0.13 0.00 0.00 0.00 0.00 46.02 44.19 3hys n GLY 238 CO 0.00 0.00 0.00 0.84 0.00 0.00 0.00 173.32 174.16 3hys h HIS 239 N -0.51 0.39 -0.95 1.61 2.76 -1.67 -1.11 115.15 115.68 3hys h HIS 239 Ca 0.00 0.01 -0.50 0.00 -2.20 0.00 0.00 60.37 57.68 3hys h HIS 239 Cb 0.00 -0.13 -0.20 0.00 1.55 0.00 0.00 27.41 28.64 3hys h HIS 239 CO 0.00 0.18 0.58 1.28 -1.30 0.00 0.00 177.93 178.66 3hys n LEU 240 N -4.46 6.84 0.24 0.26 4.77 -0.82 -4.75 117.00 119.08 3hys n LEU 240 Ca 0.11 -3.93 0.07 0.00 -0.03 0.00 0.00 56.01 52.23 3hys n LEU 240 Cb 0.43 -1.10 0.58 0.00 -2.33 0.00 0.00 43.42 41.00 3hys n LEU 240 CO 0.34 1.50 1.01 1.23 -1.33 0.00 0.00 177.39 180.15 3hys h GLY 241 N 2.93 0.02 2.00 -0.72 0.00 -1.47 -0.14 103.07 105.70 3hys h GLY 241 Ca 0.42 -0.01 0.00 0.00 0.00 0.00 0.00 47.33 47.74 3hys h GLY 241 CO 1.04 0.01 0.00 0.27 0.00 0.00 0.00 176.54 177.86 3hys h PHE 242 N 0.02 0.00 0.01 5.60 -5.15 -1.85 0.28 116.94 115.86 3hys h PHE 242 Ca 0.01 0.00 -0.34 0.00 -0.20 0.00 0.00 57.97 57.44 3hys h PHE 242 Cb 0.11 0.00 -0.06 0.00 0.22 0.00 0.00 35.95 36.22 3hys h PHE 242 CO 0.00 0.00 -2.07 0.34 -2.00 0.00 0.00 178.31 174.58 3hys n PHE 243 N -2.98 0.55 0.00 6.09 -0.00 -0.55 -3.88 117.46 116.71 3hys n PHE 243 Ca 0.03 0.18 -0.16 0.00 -0.00 0.00 0.00 57.45 57.49 3hys n PHE 243 Cb 0.43 -1.10 -0.14 0.00 -0.00 0.00 0.00 39.48 38.67 3hys n PHE 243 CO 0.00 0.00 0.00 1.49 -0.00 0.00 0.00 176.76 178.25 3hys h GLU 244 N 0.01 0.17 -2.18 -4.13 4.81 -0.81 -3.38 114.58 109.07 3hys h GLU 244 Ca -0.43 -0.29 -0.57 0.00 -0.13 0.00 0.00 59.36 57.93 3hys h GLU 244 Cb 2.09 0.11 -0.41 0.00 0.63 0.00 0.00 28.75 31.17 3hys h GLU 244 CO 0.04 0.95 -0.77 0.54 -0.73 0.00 0.00 179.01 179.04 3hys n ARG 245 N -3.33 2.36 -0.26 1.92 5.12 0.97 -4.97 116.66 118.48 3hys n ARG 245 Ca -0.25 -4.37 -0.06 0.00 -1.93 0.00 0.00 57.85 51.24 3hys n ARG 245 Cb 1.05 -2.04 0.05 0.00 -1.16 0.00 0.00 32.46 30.36 3hys n ARG 245 CO 0.00 0.00 0.00 -1.00 -1.93 0.00 0.00 177.63 174.70 3hys h PRO 246 N 3.46 1.05 -0.22 5.56 0.13 -1.71 -2.47 132.00 137.80 3hys h PRO 246 Ca 0.14 -0.17 0.00 0.00 -0.87 0.00 0.00 66.00 65.10 3hys h PRO 246 Cb 0.67 -0.18 -0.01 0.00 0.13 0.00 0.00 31.00 31.61 3hys h PRO 246 CO 0.73 0.84 0.14 1.49 -0.23 0.00 0.00 178.00 180.97 3hys h GLU 247 N 1.01 0.27 -0.31 0.86 4.81 -1.93 0.55 114.58 119.84 3hys h GLU 247 Ca 0.24 -0.02 -0.04 0.00 -0.13 0.00 0.00 59.36 59.42 3hys h GLU 247 Cb 0.16 -0.06 -0.01 0.00 0.63 0.00 0.00 28.75 29.46 3hys h GLU 247 CO -0.03 0.18 0.04 0.00 -0.73 0.00 0.00 179.01 178.48 3hys h ALA 248 N 1.08 0.42 -0.13 2.92 0.00 -1.95 -0.01 119.26 121.60 3hys h ALA 248 Ca 0.08 -0.20 -0.00 0.00 0.00 0.00 0.00 54.91 54.78 3hys h ALA 248 Cb -0.02 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 17.64 3hys h ALA 248 CO -0.02 0.12 0.07 0.28 0.00 0.00 0.00 179.25 179.70 3hys h VAL 249 N 0.35 1.10 -0.24 0.00 2.07 -1.23 -2.35 116.25 115.94 3hys h VAL 249 Ca 0.09 -0.27 -0.00 0.00 0.82 0.00 0.00 66.70 67.34 3hys h VAL 249 Cb 0.36 1.05 -0.01 0.00 -1.52 0.00 0.00 31.29 31.17 3hys h VAL 249 CO 0.01 0.09 0.14 0.78 0.02 0.00 0.00 177.57 178.60 3hys h ASN 250 N 0.10 0.30 -0.57 0.57 2.35 0.23 -1.12 115.58 117.44 3hys h ASN 250 Ca 0.04 -0.07 0.08 0.00 -0.55 0.00 0.00 56.30 55.80 3hys h ASN 250 Cb 0.08 -0.08 -0.06 0.00 0.05 0.00 0.00 38.32 38.32 3hys h ASN 250 CO -0.01 0.28 0.23 0.74 -1.65 0.00 0.00 177.43 177.03 3hys h THR 251 N 0.29 0.84 -0.50 2.81 2.02 -1.00 0.58 112.91 117.95 3hys h THR 251 Ca 0.09 -0.15 -0.09 0.00 0.77 0.00 0.00 66.41 67.03 3hys h THR 251 Cb 0.05 0.36 -0.02 0.00 -1.74 0.00 0.00 68.15 66.80 3hys h THR 251 CO -0.01 0.08 -0.03 0.00 0.37 0.00 0.00 175.52 175.93 3hys h ALA 252 N 1.37 0.68 -0.36 6.16 0.00 -1.06 -1.73 119.26 124.32 3hys h ALA 252 Ca 0.28 -0.30 -0.04 0.00 0.00 0.00 0.00 54.91 54.85 3hys h ALA 252 Cb 0.29 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 17.88 3hys h ALA 252 CO -0.25 0.52 0.08 0.52 0.00 0.00 0.00 179.25 180.12 3hys h MET 253 N 0.77 0.58 -0.49 0.00 2.07 -0.20 -1.46 114.93 116.19 3hys h MET 253 Ca 0.14 -0.14 -0.08 0.00 -2.07 0.00 0.00 59.70 57.55 3hys h MET 253 Cb 0.56 -0.07 -0.02 0.00 -1.87 0.00 0.00 31.60 30.19 3hys h MET 253 CO 0.03 0.63 -0.02 -0.07 1.07 0.00 0.00 176.91 178.55 3hys h LEU 254 N 0.43 0.81 -0.18 1.22 3.38 -0.80 -0.99 115.31 119.18 3hys h LEU 254 Ca 0.11 -0.21 -0.01 0.00 0.09 0.00 0.00 57.88 57.87 3hys h LEU 254 Cb 0.31 -0.22 -0.01 0.00 0.09 0.00 0.00 40.66 40.84 3hys h LEU 254 CO 0.00 0.88 0.08 0.50 0.09 0.00 0.00 178.44 180.00 3hys h LYS 255 N 0.77 0.25 -0.16 1.13 3.64 -1.26 -1.76 116.57 119.18 3hys h LYS 255 Ca 0.15 -0.04 0.02 0.00 -1.27 0.00 0.00 60.65 59.51 3hys h LYS 255 Cb 0.49 -0.05 -0.02 0.00 -0.41 0.00 0.00 32.23 32.25 3hys h LYS 255 CO 0.02 0.29 0.04 0.35 -2.27 0.00 0.00 179.45 177.89 3hys h PHE 256 N 0.16 0.08 0.00 1.91 3.57 -0.91 -3.20 116.94 118.54 3hys h PHE 256 Ca 0.06 0.01 -0.06 0.00 3.53 0.00 0.00 57.97 61.51 3hys h PHE 256 Cb 0.12 -0.01 -0.01 0.00 2.79 0.00 0.00 35.95 38.84 3hys h PHE 256 CO -0.03 0.03 -0.27 0.74 -2.23 0.00 0.00 178.31 176.56 3hys h PHE 257 N 0.12 0.00 0.00 0.41 0.04 -1.07 -2.47 116.94 113.96 3hys h PHE 257 Ca 0.07 0.00 -0.01 0.00 2.80 0.00 0.00 57.97 60.83 3hys h PHE 257 Cb 0.05 0.00 -0.00 0.00 2.20 0.00 0.00 35.95 38.20 3hys h PHE 257 CO -0.12 0.27 -0.06 0.00 -0.60 0.00 0.00 178.31 177.80 3hys h ALA 258 N 1.73 1.03 -0.01 2.45 0.00 -1.31 -3.26 119.26 119.88 3hys h ALA 258 Ca -0.00 -0.05 0.00 0.00 0.00 0.00 0.00 54.91 54.85 3hys h ALA 258 Cb 0.69 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.47 3hys h ALA 258 CO 0.04 0.07 -0.12 0.43 0.00 0.00 0.00 179.25 179.67 3hys n SER 259 N -3.20 1.67 -4.77 0.00 7.64 -0.95 -5.07 113.62 108.94 3hys n SER 259 Ca 0.00 -1.34 -0.36 0.00 1.01 0.00 0.00 58.87 58.19 3hys n SER 259 Cb 0.32 0.23 -0.00 0.00 -1.01 0.00 0.00 64.21 63.74 3hys n SER 259 CO 0.00 0.00 0.00 0.68 -3.01 0.00 0.00 175.04 172.71 3hys s VAL 260 N -1.25 3.19 0.00 0.44 -7.23 -1.10 -5.12 120.40 109.33 3hys s VAL 260 Ca 0.12 0.79 0.00 0.00 -1.81 0.00 0.00 61.98 61.08 3hys s VAL 260 Cb 0.10 -3.34 0.00 0.00 0.56 0.00 0.00 36.38 33.69 3hys s VAL 260 CO 0.22 -0.12 0.00 1.17 -0.31 0.00 0.00 175.10 176.06