#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1m8u s LYS 2 N 0.00 0.36 0.01 1.61 2.20 -0.60 -4.39 119.74 118.94 1m8u s LYS 2 Ca 0.00 0.92 0.01 0.00 -0.36 0.00 0.00 55.97 56.54 1m8u s LYS 2 Cb 0.00 0.15 -0.01 0.00 -1.51 0.00 0.00 37.83 36.46 1m8u s LYS 2 CO 0.00 -0.21 -0.03 -1.50 -0.36 0.00 0.00 175.35 173.25 1m8u s ILE 3 N 2.02 0.22 -0.09 5.43 2.07 0.55 -0.82 121.20 130.57 1m8u s ILE 3 Ca -0.06 -0.56 0.01 0.00 -1.41 0.00 0.00 60.65 58.63 1m8u s ILE 3 Cb -0.10 -0.27 0.02 0.00 0.13 0.00 0.00 42.46 42.24 1m8u s ILE 3 CO -0.13 -0.23 -0.09 -0.89 -1.91 0.00 0.00 174.94 171.69 1m8u s THR 4 N -0.79 1.03 -0.11 4.00 2.01 -0.52 0.81 115.64 122.06 1m8u s THR 4 Ca -0.07 -0.35 -0.08 0.00 0.31 0.00 0.00 61.69 61.50 1m8u s THR 4 Cb -0.06 -1.00 -0.04 0.00 0.01 0.00 0.00 72.50 71.41 1m8u s THR 4 CO -0.00 0.35 0.18 -0.36 -0.69 0.00 0.00 174.62 174.10 1m8u s PHE 5 N 1.25 3.60 -0.02 4.92 0.40 -0.46 -1.79 117.98 125.88 1m8u s PHE 5 Ca -0.04 0.57 0.07 0.00 -0.60 0.00 0.00 56.93 56.94 1m8u s PHE 5 Cb -0.14 -2.01 -0.02 0.00 0.51 0.00 0.00 43.02 41.36 1m8u s PHE 5 CO -0.03 0.68 -0.24 0.71 0.70 0.00 0.00 175.22 177.04 1m8u s TYR 6 N -0.88 2.11 0.30 0.36 1.51 -0.23 -0.94 117.35 119.58 1m8u s TYR 6 Ca 0.16 -0.40 0.12 0.00 -1.01 0.00 0.00 57.07 55.94 1m8u s TYR 6 Cb -0.13 -1.36 0.53 0.00 -0.11 0.00 0.00 41.96 40.90 1m8u s TYR 6 CO 0.05 -0.03 1.71 0.93 -1.11 0.00 0.00 175.55 177.09 1m8u h GLU 7 N 5.54 0.00 -6.18 -0.62 5.08 -1.26 0.46 114.58 117.59 1m8u h GLU 7 Ca -0.41 0.00 -0.57 0.00 -1.00 0.00 0.00 59.36 57.38 1m8u h GLU 7 Cb 1.13 0.00 -0.10 0.00 0.50 0.00 0.00 28.75 30.28 1m8u h GLU 7 CO 0.47 0.50 -0.65 -0.51 -1.00 0.00 0.00 179.01 177.82 1m8u s ASP 8 N -6.83 4.39 0.85 1.42 1.01 -0.84 -3.40 116.67 113.27 1m8u s ASP 8 Ca -0.02 -0.74 -0.11 0.00 0.71 0.00 0.00 52.55 52.40 1m8u s ASP 8 Cb 0.13 -0.73 0.10 0.00 1.01 0.00 0.00 42.92 43.43 1m8u s ASP 8 CO 0.74 -0.03 1.10 0.00 0.21 0.00 0.00 175.17 177.19 1m8u s ARG 9 N -3.66 1.60 -1.25 8.23 1.70 -1.26 -3.35 118.95 120.95 1m8u s ARG 9 Ca 0.32 1.11 0.00 0.00 -0.47 0.00 0.00 55.73 56.69 1m8u s ARG 9 Cb -0.05 -1.83 0.00 0.00 -0.57 0.00 0.00 34.95 32.50 1m8u s ARG 9 CO 0.19 -2.09 0.00 0.41 -1.08 0.00 0.00 175.30 172.74 1m8u n GLY 10 N -0.85 0.38 3.40 3.88 0.00 -0.74 -3.23 105.19 108.03 1m8u n GLY 10 Ca 0.09 -0.35 -0.20 0.00 0.00 0.00 0.00 46.02 45.55 1m8u n GLY 10 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 1m8u n PHE 11 N -3.51 -2.51 -4.26 1.61 3.72 -1.24 -5.02 117.46 106.25 1m8u n PHE 11 Ca -0.15 0.93 -0.23 0.00 -0.05 0.00 0.00 57.45 57.94 1m8u n PHE 11 Cb 0.56 -4.81 -0.07 0.00 -0.94 0.00 0.00 39.48 34.21 1m8u n PHE 11 CO 0.00 0.00 0.00 -0.65 -0.05 0.00 0.00 176.76 176.06 1m8u s GLN 12 N -5.94 2.23 1.16 -1.08 -1.52 -1.20 -5.04 119.66 108.27 1m8u s GLN 12 Ca 0.39 -1.56 0.00 0.00 -1.95 0.00 0.00 55.36 52.23 1m8u s GLN 12 Cb -0.17 -2.08 0.00 0.00 -0.22 0.00 0.00 33.01 30.54 1m8u s GLN 12 CO 0.68 0.23 0.00 0.41 -0.25 0.00 0.00 175.29 176.36 1m8u n GLY 13 N -0.97 -1.94 3.69 3.09 0.00 -1.26 -1.99 105.19 105.81 1m8u n GLY 13 Ca -0.05 -1.37 -0.43 0.00 0.00 0.00 0.00 46.02 44.17 1m8u n GLY 13 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 173.32 171.19 1m8u n ARG 14 N -0.22 2.15 -4.07 1.61 0.63 -1.26 -4.69 116.66 110.81 1m8u n ARG 14 Ca 0.00 0.76 -0.10 0.00 -0.92 0.00 0.00 57.85 57.59 1m8u n ARG 14 Cb 0.00 -2.39 -0.11 0.00 0.45 0.00 0.00 32.46 30.42 1m8u n ARG 14 CO 0.00 0.00 0.00 -3.38 -2.51 0.00 0.00 177.63 171.74 1m8u s HIS 15 N -0.63 0.57 -0.10 -0.14 -3.43 -1.26 -1.26 115.29 109.05 1m8u s HIS 15 Ca 0.61 -0.73 -0.01 0.00 -0.80 0.00 0.00 55.06 54.13 1m8u s HIS 15 Cb -0.59 -0.37 0.03 0.00 -1.43 0.00 0.00 32.58 30.22 1m8u s HIS 15 CO 0.57 -0.20 -0.04 -0.47 -2.00 0.00 0.00 174.74 172.60 1m8u s TYR 16 N -2.47 1.17 0.01 0.38 5.04 -0.11 -4.96 117.35 116.40 1m8u s TYR 16 Ca -0.03 -0.53 -0.22 0.00 -2.44 0.00 0.00 57.07 53.85 1m8u s TYR 16 Cb -0.03 -1.07 -0.05 0.00 0.35 0.00 0.00 41.96 41.17 1m8u s TYR 16 CO -0.03 -0.45 0.65 -2.00 -1.34 0.00 0.00 175.55 172.38 1m8u s GLU 17 N 1.81 4.38 -0.01 4.97 2.12 -1.26 -1.35 118.70 129.36 1m8u s GLU 17 Ca 0.05 0.84 0.03 0.00 0.36 0.00 0.00 54.97 56.25 1m8u s GLU 17 Cb -0.13 -3.35 -0.01 0.00 0.26 0.00 0.00 34.13 30.90 1m8u s GLU 17 CO -0.07 0.34 -0.10 0.00 -0.54 0.00 0.00 175.26 174.88 1m8u n SER 19 N 2.83 0.97 -3.70 0.00 3.41 -1.26 -0.33 113.62 115.54 1m8u n SER 19 Ca -0.14 -1.57 -0.08 0.00 -0.26 0.00 0.00 58.87 56.83 1m8u n SER 19 Cb 0.56 -0.03 -0.02 0.00 -0.26 0.00 0.00 64.21 64.47 1m8u n SER 19 CO 0.00 0.00 0.00 -0.94 -0.16 0.00 0.00 175.04 173.94 1m8u s SER 20 N -0.60 -0.18 0.42 4.04 1.04 -1.26 -4.55 113.70 112.60 1m8u s SER 20 Ca 0.01 -0.74 -0.27 0.00 0.48 0.00 0.00 55.95 55.43 1m8u s SER 20 Cb 0.01 0.74 -0.10 0.00 0.10 0.00 0.00 66.02 66.78 1m8u s SER 20 CO 0.00 -1.39 1.47 -1.81 0.98 0.00 0.00 173.24 172.49 1m8u s ASP 21 N -2.96 6.06 -0.08 7.02 1.11 -1.26 -4.82 116.67 121.74 1m8u s ASP 21 Ca 0.13 3.01 -0.02 0.00 0.18 0.00 0.00 52.55 55.85 1m8u s ASP 21 Cb -0.05 -2.66 0.03 0.00 1.07 0.00 0.00 42.92 41.31 1m8u s ASP 21 CO 0.08 -1.06 0.02 -1.00 1.18 0.00 0.00 175.17 174.39 1m8u s HIS 22 N -1.16 0.60 -0.49 4.23 3.76 -0.78 -5.01 115.29 116.44 1m8u s HIS 22 Ca 0.57 -0.17 0.25 0.00 -0.15 0.00 0.00 55.06 55.57 1m8u s HIS 22 Cb -0.46 -0.77 0.70 0.00 1.11 0.00 0.00 32.58 33.16 1m8u s HIS 22 CO 0.60 -0.34 1.73 0.66 -0.85 0.00 0.00 174.74 176.54 1m8u h SER 23 N 8.34 0.00 -2.23 1.40 4.64 -1.88 -1.86 113.55 121.97 1m8u h SER 23 Ca -0.18 0.00 -0.27 0.00 -0.47 0.00 0.00 61.79 60.87 1m8u h SER 23 Cb 1.12 0.00 -0.33 0.00 -0.31 0.00 0.00 62.40 62.88 1m8u h SER 23 CO 0.25 0.00 -0.58 0.21 -0.87 0.00 0.00 176.83 175.84 1m8u s ASN 24 N -5.34 1.10 0.00 4.97 2.47 -1.25 -0.57 114.94 116.32 1m8u s ASN 24 Ca 0.07 -0.23 0.25 0.00 0.42 0.00 0.00 52.86 53.38 1m8u s ASN 24 Cb 0.09 0.64 0.51 0.00 -1.45 0.00 0.00 41.25 41.03 1m8u s ASN 24 CO 0.60 -0.33 1.41 0.18 -3.72 0.00 0.00 177.10 175.24 1m8u n LEU 25 N 5.33 1.44 -0.30 3.21 4.77 0.16 -4.45 117.00 127.17 1m8u n LEU 25 Ca -0.04 -0.46 0.19 0.00 -0.03 0.00 0.00 56.01 55.67 1m8u n LEU 25 Cb 0.49 -0.07 0.47 0.00 -2.33 0.00 0.00 43.42 41.98 1m8u n LEU 25 CO 0.05 0.27 1.22 1.56 -1.33 0.00 0.00 177.39 179.16 1m8u h GLN 26 N 1.78 0.47 0.00 3.23 4.20 -1.77 -0.15 115.11 122.87 1m8u h GLN 26 Ca 0.00 -0.03 0.00 0.00 0.06 0.00 0.00 58.65 58.68 1m8u h GLN 26 Cb 0.60 -0.11 0.00 0.00 0.30 0.00 0.00 27.48 28.28 1m8u h GLN 26 CO 0.00 0.31 0.00 -2.30 -0.67 0.00 0.00 178.83 176.17 1m8u n PRO 27 N -4.60 0.06 -0.05 1.46 -0.02 -1.26 -3.53 135.00 127.06 1m8u n PRO 27 Ca 0.22 0.27 0.01 0.00 -2.02 0.00 0.00 63.50 61.98 1m8u n PRO 27 Cb 0.73 -1.60 -0.15 0.00 -0.02 0.00 0.00 33.50 32.46 1m8u n PRO 27 CO 0.00 0.00 0.00 0.66 1.98 0.00 0.00 175.50 178.14 1m8u n TYR 28 N -1.71 0.00 -3.58 6.00 4.01 -0.08 -5.03 117.16 116.76 1m8u n TYR 28 Ca 0.04 0.00 -0.10 0.00 -0.16 0.00 0.00 57.90 57.68 1m8u n TYR 28 Cb 0.21 -0.65 -0.05 0.00 -0.31 0.00 0.00 39.34 38.54 1m8u n TYR 28 CO 0.00 0.00 0.00 -0.59 -0.46 0.00 0.00 176.86 175.81 1m8u s PHE 29 N -2.95 -0.35 -0.77 -0.72 -0.12 -1.15 -4.80 117.98 107.12 1m8u s PHE 29 Ca -0.08 0.60 0.22 0.00 -0.05 0.00 0.00 56.93 57.61 1m8u s PHE 29 Cb 0.09 0.45 -0.20 0.00 -0.63 0.00 0.00 43.02 42.73 1m8u s PHE 29 CO 0.79 -0.32 0.84 -1.13 -0.05 0.00 0.00 175.22 175.36 1m8u n SER 30 N 0.75 0.74 -3.72 1.98 3.41 -1.26 -4.42 113.62 111.10 1m8u n SER 30 Ca -0.10 -0.70 -0.13 0.00 -0.26 0.00 0.00 58.87 57.68 1m8u n SER 30 Cb 0.58 1.16 -0.08 0.00 -0.26 0.00 0.00 64.21 65.61 1m8u n SER 30 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1m8u s ARG 31 N -3.12 0.76 -0.20 4.33 1.70 -1.26 -4.90 118.95 116.25 1m8u s ARG 31 Ca 0.04 -0.22 -0.03 0.00 -0.47 0.00 0.00 55.73 55.06 1m8u s ARG 31 Cb 0.16 0.34 0.06 0.00 -0.57 0.00 0.00 34.95 34.94 1m8u s ARG 31 CO 0.87 -0.23 0.04 0.00 -1.08 0.00 0.00 175.30 174.90 1m8u n ASN 33 N 5.05 1.87 -3.56 0.00 3.02 0.15 -4.41 115.26 117.37 1m8u n ASN 33 Ca -0.09 -1.45 -0.13 0.00 -0.03 0.00 0.00 54.58 52.89 1m8u n ASN 33 Cb 0.47 -0.02 -0.05 0.00 -0.61 0.00 0.00 39.78 39.56 1m8u n ASN 33 CO 0.00 0.00 0.00 -0.94 -2.62 0.00 0.00 177.26 173.70 1m8u s SER 34 N -0.80 -0.47 -0.05 6.41 1.04 -1.17 -3.58 113.70 115.08 1m8u s SER 34 Ca 0.12 0.52 -0.05 0.00 0.48 0.00 0.00 55.95 57.02 1m8u s SER 34 Cb 0.08 0.39 0.01 0.00 0.10 0.00 0.00 66.02 66.61 1m8u s SER 34 CO 0.12 -0.42 0.13 -0.63 0.98 0.00 0.00 173.24 173.42 1m8u s ILE 35 N -1.11 -0.00 -0.15 -1.02 1.01 0.08 -1.07 121.20 118.94 1m8u s ILE 35 Ca -0.05 0.01 0.01 0.00 0.00 0.00 0.00 60.65 60.63 1m8u s ILE 35 Cb -0.00 -0.20 0.02 0.00 0.01 0.00 0.00 42.46 42.29 1m8u s ILE 35 CO 0.04 0.00 -0.19 -0.60 0.00 0.00 0.00 174.94 174.20 1m8u s ARG 36 N 0.12 2.75 -0.27 2.79 3.52 -0.74 -1.05 118.95 126.08 1m8u s ARG 36 Ca -0.00 -0.74 -0.10 0.00 -0.13 0.00 0.00 55.73 54.75 1m8u s ARG 36 Cb -0.01 -2.35 -0.04 0.00 -1.56 0.00 0.00 34.95 30.98 1m8u s ARG 36 CO -0.00 -0.14 0.15 0.08 -0.81 0.00 0.00 175.30 174.58 1m8u s VAL 37 N 1.16 5.02 -0.06 7.11 1.01 -0.52 -1.43 120.40 132.69 1m8u s VAL 37 Ca 0.00 0.07 0.07 0.00 0.00 0.00 0.00 61.98 62.12 1m8u s VAL 37 Cb -0.14 -3.38 -0.24 0.00 0.00 0.00 0.00 36.38 32.62 1m8u s VAL 37 CO -0.08 0.29 0.60 0.44 0.00 0.00 0.00 175.10 176.34 1m8u h ASP 38 N 8.24 0.12 -4.77 3.32 3.45 -1.30 0.14 116.42 125.62 1m8u h ASP 38 Ca -0.36 -0.27 0.00 0.00 0.43 0.00 0.00 57.03 56.83 1m8u h ASP 38 Cb 1.18 -0.04 -0.18 0.00 -0.56 0.00 0.00 39.33 39.74 1m8u h ASP 38 CO 0.57 1.24 0.31 -0.94 -1.57 0.00 0.00 179.24 178.85 1m8u s SER 39 N -6.37 -0.54 0.00 6.45 1.04 -1.06 -4.90 113.70 108.32 1m8u s SER 39 Ca -0.09 0.40 0.00 0.00 0.48 0.00 0.00 55.95 56.74 1m8u s SER 39 Cb 0.08 0.48 0.00 0.00 0.10 0.00 0.00 66.02 66.68 1m8u s SER 39 CO 0.81 -0.64 0.00 0.61 0.98 0.00 0.00 173.24 175.01 1m8u n GLY 40 N 0.43 -1.20 3.64 7.32 0.00 -1.26 -1.55 105.19 112.56 1m8u n GLY 40 Ca -0.15 -1.60 -0.35 0.00 0.00 0.00 0.00 46.02 43.92 1m8u n GLY 40 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1m8u s TRP 42 N -0.18 1.62 -0.14 0.00 0.52 -0.49 -1.12 118.94 119.14 1m8u s TRP 42 Ca 0.06 -0.51 0.01 0.00 0.02 0.00 0.00 56.10 55.67 1m8u s TRP 42 Cb -0.12 -0.83 0.02 0.00 -1.15 0.00 0.00 33.47 31.39 1m8u s TRP 42 CO 0.02 0.24 -0.14 1.41 0.02 0.00 0.00 176.95 178.50 1m8u s MET 43 N -2.74 2.23 0.10 4.98 1.75 -0.25 -0.60 119.30 124.76 1m8u s MET 43 Ca 0.12 -0.54 0.05 0.00 -1.25 0.00 0.00 55.69 54.08 1m8u s MET 43 Cb -0.05 -2.03 -0.04 0.00 2.84 0.00 0.00 34.83 35.55 1m8u s MET 43 CO 0.05 -0.21 -0.01 0.96 -0.65 0.00 0.00 175.02 175.16 1m8u s ILE 44 N 1.41 3.93 0.14 10.11 -4.36 0.23 -0.64 121.20 132.02 1m8u s ILE 44 Ca 0.03 -1.06 0.07 0.00 -0.26 0.00 0.00 60.65 59.42 1m8u s ILE 44 Cb -0.13 -2.88 -0.04 0.00 1.25 0.00 0.00 42.46 40.66 1m8u s ILE 44 CO -0.09 0.09 -0.15 -0.31 0.24 0.00 0.00 174.94 174.72 1m8u s TYR 45 N -1.35 1.52 0.19 1.37 1.51 -0.30 -0.81 117.35 119.48 1m8u s TYR 45 Ca 0.26 -0.54 0.03 0.00 -1.01 0.00 0.00 57.07 55.81 1m8u s TYR 45 Cb -0.11 -0.78 0.07 0.00 -0.11 0.00 0.00 41.96 41.03 1m8u s TYR 45 CO 0.18 0.20 1.44 1.49 -1.11 0.00 0.00 175.55 177.75 1m8u h GLU 46 N 3.35 0.19 -6.00 -0.62 4.81 -1.50 -0.95 114.58 113.86 1m8u h GLU 46 Ca -0.40 -0.19 -0.55 0.00 -0.13 0.00 0.00 59.36 58.09 1m8u h GLU 46 Cb 1.20 0.05 -0.08 0.00 0.63 0.00 0.00 28.75 30.55 1m8u h GLU 46 CO 0.52 0.89 -0.50 -0.65 -0.73 0.00 0.00 179.01 178.54 1m8u s GLN 47 N -3.37 2.29 0.96 1.92 -1.52 -0.90 -3.36 119.66 115.69 1m8u s GLN 47 Ca -0.03 -1.71 -0.12 0.00 -1.95 0.00 0.00 55.36 51.55 1m8u s GLN 47 Cb 0.11 -2.08 0.17 0.00 -0.22 0.00 0.00 33.01 30.98 1m8u s GLN 47 CO 0.82 -0.04 1.09 -2.14 -0.25 0.00 0.00 175.29 174.77 1m8u s PRO 48 N -3.90 0.71 -1.70 2.91 0.02 -1.26 -3.67 135.00 128.10 1m8u s PRO 48 Ca 0.40 0.64 0.00 0.00 0.02 0.00 0.00 61.00 62.07 1m8u s PRO 48 Cb 0.01 -1.76 0.00 0.00 0.02 0.00 0.00 34.50 32.77 1m8u s PRO 48 CO 0.23 -2.57 0.00 0.09 -0.33 0.00 0.00 177.00 174.42 1m8u n ASN 49 N -4.08 -5.46 -3.20 2.53 5.03 0.27 -2.50 115.26 107.84 1m8u n ASN 49 Ca 0.06 0.09 -0.22 0.00 0.87 0.00 0.00 54.58 55.38 1m8u n ASN 49 Cb 0.56 -4.60 0.06 0.00 -1.02 0.00 0.00 39.78 34.78 1m8u n ASN 49 CO 0.00 0.00 0.00 0.49 -1.83 0.00 0.00 177.26 175.92 1m8u n PHE 50 N -3.65 -2.39 -3.97 3.10 3.72 -1.25 -5.01 117.46 108.00 1m8u n PHE 50 Ca -0.22 0.78 -0.22 0.00 -0.05 0.00 0.00 57.45 57.74 1m8u n PHE 50 Cb 0.67 -4.63 -0.05 0.00 -0.94 0.00 0.00 39.48 34.53 1m8u n PHE 50 CO 0.00 0.00 0.00 -0.65 -0.05 0.00 0.00 176.76 176.06 1m8u s GLN 51 N -6.00 2.63 1.11 -1.08 -1.52 -1.04 -5.03 119.66 108.72 1m8u s GLN 51 Ca 0.45 -1.34 0.00 0.00 -1.95 0.00 0.00 55.36 52.52 1m8u s GLN 51 Cb -0.20 -2.38 0.00 0.00 -0.22 0.00 0.00 33.01 30.21 1m8u s GLN 51 CO 0.56 0.17 0.00 0.41 -0.25 0.00 0.00 175.29 176.17 1m8u n GLY 52 N -1.25 -2.03 3.63 3.09 0.00 -1.26 -2.12 105.19 105.25 1m8u n GLY 52 Ca -0.03 -1.41 -0.46 0.00 0.00 0.00 0.00 46.02 44.12 1m8u n GLY 52 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 1m8u n PRO 53 N -0.03 1.69 -4.35 1.61 -0.02 -1.26 -4.71 135.00 127.93 1m8u n PRO 53 Ca 0.00 0.60 -0.29 0.00 -2.02 0.00 0.00 63.50 61.79 1m8u n PRO 53 Cb 0.00 -2.15 -0.12 0.00 -0.02 0.00 0.00 33.50 31.20 1m8u n PRO 53 CO 0.00 0.00 0.00 1.14 1.98 0.00 0.00 175.50 178.62 1m8u s GLN 54 N -0.76 1.58 -0.01 -0.52 -2.07 -1.26 -2.00 119.66 114.62 1m8u s GLN 54 Ca 0.66 -1.29 -0.00 0.00 -1.82 0.00 0.00 55.36 52.91 1m8u s GLN 54 Cb -0.70 -1.99 0.01 0.00 -1.09 0.00 0.00 33.01 29.24 1m8u s GLN 54 CO 0.54 0.46 0.01 0.71 -1.32 0.00 0.00 175.29 175.69 1m8u s TYR 55 N -1.16 0.01 -0.07 9.60 2.02 0.01 -4.22 117.35 123.53 1m8u s TYR 55 Ca 0.16 0.06 -0.18 0.00 -0.37 0.00 0.00 57.07 56.75 1m8u s TYR 55 Cb -0.10 -0.09 -0.05 0.00 -0.40 0.00 0.00 41.96 41.32 1m8u s TYR 55 CO 0.08 -0.04 0.48 0.12 -1.57 0.00 0.00 175.55 174.62 1m8u s PHE 56 N 0.41 3.59 0.01 2.71 5.36 -1.26 -0.60 117.98 128.20 1m8u s PHE 56 Ca -0.03 0.96 0.05 0.00 -0.96 0.00 0.00 56.93 56.95 1m8u s PHE 56 Cb -0.05 -2.50 -0.02 0.00 -0.34 0.00 0.00 43.02 40.12 1m8u s PHE 56 CO -0.01 0.32 -0.16 -0.51 -1.46 0.00 0.00 175.22 173.40 1m8u s LEU 57 N 0.07 2.08 0.43 6.12 2.01 0.23 -4.95 118.68 124.67 1m8u s LEU 57 Ca 0.26 -0.36 0.05 0.00 0.01 0.00 0.00 54.13 54.09 1m8u s LEU 57 Cb -0.16 -0.77 -0.05 0.00 0.01 0.00 0.00 46.19 45.22 1m8u s LEU 57 CO 0.12 0.15 0.02 -0.13 1.01 0.00 0.00 176.35 177.52 1m8u s ARG 58 N -0.67 2.00 0.33 1.70 0.52 -1.26 -1.40 118.95 120.17 1m8u s ARG 58 Ca 0.05 -2.18 -0.28 0.00 -0.52 0.00 0.00 55.73 52.80 1m8u s ARG 58 Cb -0.07 -1.45 -0.12 0.00 0.52 0.00 0.00 34.95 33.82 1m8u s ARG 58 CO 0.00 -0.19 1.28 0.54 0.02 0.00 0.00 175.30 176.95 1m8u n ARG 59 N -1.02 2.07 0.00 3.54 1.74 -1.26 -4.59 116.66 117.13 1m8u n ARG 59 Ca -0.09 0.73 0.00 0.00 -0.77 0.00 0.00 57.85 57.71 1m8u n ARG 59 Cb 0.67 -2.30 0.00 0.00 -1.02 0.00 0.00 32.46 29.81 1m8u n ARG 59 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1m8u n GLY 60 N 0.90 0.63 3.77 -0.13 0.00 0.04 -4.92 105.19 105.48 1m8u n GLY 60 Ca 0.05 -2.15 -0.39 0.00 0.00 0.00 0.00 46.02 43.53 1m8u n GLY 60 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1m8u s ASP 61 N -3.03 7.07 -0.49 1.61 1.11 -1.26 -1.44 116.67 120.24 1m8u s ASP 61 Ca 0.00 1.27 0.04 0.00 0.18 0.00 0.00 52.55 54.04 1m8u s ASP 61 Cb 0.00 -2.39 0.16 0.00 1.07 0.00 0.00 42.92 41.76 1m8u s ASP 61 CO 0.00 0.13 0.36 -0.31 1.18 0.00 0.00 175.17 176.53 1m8u s TYR 62 N -0.43 1.85 0.41 4.23 1.51 -0.21 -5.00 117.35 119.71 1m8u s TYR 62 Ca 0.32 -2.57 0.39 0.00 -1.01 0.00 0.00 57.07 54.21 1m8u s TYR 62 Cb -0.19 -1.53 2.03 0.00 -0.11 0.00 0.00 41.96 42.16 1m8u s TYR 62 CO 0.19 -0.75 2.19 -1.35 -1.11 0.00 0.00 175.55 174.73 1m8u h PRO 63 N 5.81 0.00 -3.92 -1.71 0.11 -1.88 0.26 132.00 130.67 1m8u h PRO 63 Ca 0.18 0.00 -0.11 0.00 0.11 0.00 0.00 66.00 66.18 1m8u h PRO 63 Cb 0.87 0.00 -0.12 0.00 0.11 0.00 0.00 31.00 31.86 1m8u h PRO 63 CO 0.47 0.00 -0.31 -0.51 -0.21 0.00 0.00 178.00 177.44 1m8u s ASP 64 N -5.09 0.02 0.48 -2.05 1.11 -1.24 -1.80 116.67 108.10 1m8u s ASP 64 Ca -0.03 -0.96 0.27 0.00 0.18 0.00 0.00 52.55 52.00 1m8u s ASP 64 Cb 0.11 0.47 1.06 0.00 1.07 0.00 0.00 42.92 45.63 1m8u s ASP 64 CO 0.41 -0.95 1.88 0.10 1.18 0.00 0.00 175.17 177.78 1m8u h TYR 65 N 2.47 0.00 0.00 4.23 -0.00 -1.86 -2.18 116.97 119.63 1m8u h TYR 65 Ca -0.31 0.00 0.00 0.00 0.00 0.00 0.00 58.73 58.42 1m8u h TYR 65 Cb 1.24 0.00 0.00 0.00 0.00 0.00 0.00 36.73 37.97 1m8u h TYR 65 CO 0.39 0.15 0.00 1.96 -0.00 0.00 0.00 178.16 180.66 1m8u h GLN 66 N 0.00 0.00 -0.15 0.10 7.50 -1.93 -0.55 115.11 120.08 1m8u h GLN 66 Ca -0.00 0.00 -0.09 0.00 0.50 0.00 0.00 58.65 59.06 1m8u h GLN 66 Cb 0.67 0.00 -0.01 0.00 0.05 0.00 0.00 27.48 28.19 1m8u h GLN 66 CO 0.02 0.00 -0.28 1.96 -1.50 0.00 0.00 178.83 179.02 1m8u h GLN 67 N 0.00 0.29 -0.66 1.46 1.08 -1.77 -1.55 115.11 113.96 1m8u h GLN 67 Ca 0.00 -0.10 0.00 0.00 -1.45 0.00 0.00 58.65 57.10 1m8u h GLN 67 Cb 0.32 -0.02 0.00 0.00 -0.05 0.00 0.00 27.48 27.73 1m8u h GLN 67 CO 0.00 0.55 0.00 -2.67 -0.95 0.00 0.00 178.83 175.76 1m8u n TRP 68 N -4.13 1.33 -2.67 2.96 2.14 -0.86 -4.93 117.44 111.30 1m8u n TRP 68 Ca -0.01 -0.59 -0.19 0.00 2.07 0.00 0.00 57.50 58.78 1m8u n TRP 68 Cb 0.39 -0.18 0.01 0.00 -0.81 0.00 0.00 31.31 30.73 1m8u n TRP 68 CO 0.00 0.00 0.00 -1.33 2.07 0.00 0.00 177.69 178.43 1m8u n MET 69 N 1.22 -3.05 -1.65 -2.67 2.81 -0.58 -4.74 117.12 108.46 1m8u n MET 69 Ca 0.25 0.85 -0.29 0.00 -1.81 0.00 0.00 57.70 56.70 1m8u n MET 69 Cb 0.82 -5.43 0.11 0.00 -0.71 0.00 0.00 33.22 28.01 1m8u n MET 69 CO 0.00 0.00 0.00 0.20 1.51 0.00 0.00 175.97 177.68 1m8u s GLY 70 N -2.49 1.59 -0.05 3.03 0.00 -0.27 -4.98 107.32 104.16 1m8u s GLY 70 Ca 0.15 -0.52 0.19 0.00 0.00 0.00 0.00 44.72 44.54 1m8u s GLY 70 CO 0.18 -0.00 0.48 1.04 0.00 0.00 0.00 173.10 174.80 1m8u n LEU 71 N -3.58 0.30 0.00 0.66 4.77 -1.26 -4.62 117.00 113.27 1m8u n LEU 71 Ca 0.07 0.13 -0.00 0.00 -0.03 0.00 0.00 56.01 56.18 1m8u n LEU 71 Cb 0.59 0.18 0.00 0.00 -2.33 0.00 0.00 43.42 41.86 1m8u n LEU 71 CO 0.57 0.19 0.01 -0.46 -1.33 0.00 0.00 177.39 176.37 1m8u n ASN 72 N -2.62 -0.04 -2.01 -1.43 2.04 -1.26 -5.04 115.26 104.90 1m8u n ASN 72 Ca -0.15 -1.02 -0.12 0.00 -0.44 0.00 0.00 54.58 52.85 1m8u n ASN 72 Cb 0.84 0.06 0.24 0.00 -2.53 0.00 0.00 39.78 38.39 1m8u n ASN 72 CO 0.00 0.00 0.00 -0.90 -0.44 0.00 0.00 177.26 175.92 1m8u n ASP 73 N -0.86 4.28 -4.29 0.53 5.68 -1.26 -4.86 116.55 115.77 1m8u n ASP 73 Ca -0.00 -3.26 -0.42 0.00 -0.50 0.00 0.00 54.79 50.61 1m8u n ASP 73 Cb 0.01 -0.76 -0.08 0.00 -1.14 0.00 0.00 41.12 39.14 1m8u n ASP 73 CO 0.00 0.00 0.00 -0.44 -1.33 0.00 0.00 177.20 175.43 1m8u s SER 74 N -0.97 5.85 -0.18 -1.12 0.01 -1.26 -0.14 113.70 115.89 1m8u s SER 74 Ca 0.52 -1.57 0.01 0.00 1.31 0.00 0.00 55.95 56.21 1m8u s SER 74 Cb 0.42 -2.07 0.03 0.00 0.21 0.00 0.00 66.02 64.61 1m8u s SER 74 CO 0.12 -0.63 -0.13 -0.63 0.41 0.00 0.00 173.24 172.37 1m8u s ILE 75 N 1.49 1.71 -0.82 1.44 -1.09 -1.26 -4.32 121.20 118.35 1m8u s ILE 75 Ca 0.04 -0.88 0.07 0.00 -2.23 0.00 0.00 60.65 57.64 1m8u s ILE 75 Cb -0.25 -1.67 0.06 0.00 -1.58 0.00 0.00 42.46 39.02 1m8u s ILE 75 CO 0.03 0.33 0.72 0.54 -1.23 0.00 0.00 174.94 175.33 1m8u n ARG 76 N 4.70 0.00 -3.50 2.79 1.74 -0.37 -4.77 116.66 117.26 1m8u n ARG 76 Ca -0.17 -0.92 -0.14 0.00 -0.77 0.00 0.00 57.85 55.86 1m8u n ARG 76 Cb 0.48 -1.13 -0.04 0.00 -1.02 0.00 0.00 32.46 30.75 1m8u n ARG 76 CO 0.00 0.00 0.00 -1.54 -1.52 0.00 0.00 177.63 174.57 1m8u s SER 77 N -0.56 -0.55 -0.00 0.55 1.04 -1.21 -0.66 113.70 112.30 1m8u s SER 77 Ca 0.08 0.36 -0.05 0.00 0.48 0.00 0.00 55.95 56.82 1m8u s SER 77 Cb 0.06 0.50 -0.00 0.00 0.10 0.00 0.00 66.02 66.68 1m8u s SER 77 CO 0.08 -0.68 0.09 0.00 0.98 0.00 0.00 173.24 173.71 1m8u s ARG 79 N -1.15 1.59 -0.49 0.00 3.52 0.19 -1.86 118.95 120.74 1m8u s ARG 79 Ca -0.12 -0.36 -0.24 0.00 -0.13 0.00 0.00 55.73 54.88 1m8u s ARG 79 Cb -0.07 -1.37 0.03 0.00 -1.56 0.00 0.00 34.95 31.98 1m8u s ARG 79 CO 0.01 -0.02 0.87 -1.17 -0.81 0.00 0.00 175.30 174.17 1m8u s LEU 80 N 0.83 4.18 0.14 -0.88 2.96 -1.26 -1.10 118.68 123.55 1m8u s LEU 80 Ca -0.12 -0.19 -0.31 0.00 -0.22 0.00 0.00 54.13 53.29 1m8u s LEU 80 Cb -0.15 -2.94 -0.10 0.00 0.50 0.00 0.00 46.19 43.50 1m8u s LEU 80 CO 0.02 -1.06 1.70 -0.63 -1.32 0.00 0.00 176.35 175.06 1m8u s ILE 81 N 3.61 2.57 0.66 6.68 1.01 -0.28 -4.95 121.20 130.51 1m8u s ILE 81 Ca 0.31 0.24 -0.17 0.00 0.00 0.00 0.00 60.65 61.02 1m8u s ILE 81 Cb -0.12 -3.15 -0.01 0.00 0.01 0.00 0.00 42.46 39.18 1m8u s ILE 81 CO 0.22 0.01 1.17 -2.65 0.00 0.00 0.00 174.94 173.68 1m8u n PRO 82 N 4.92 0.92 -3.54 2.79 -0.02 -1.26 -4.63 135.00 134.17 1m8u n PRO 82 Ca 0.16 0.37 -0.38 0.00 -2.02 0.00 0.00 63.50 61.63 1m8u n PRO 82 Cb 0.38 -2.40 -0.06 0.00 -0.02 0.00 0.00 33.50 31.40 1m8u n PRO 82 CO 0.00 0.00 0.00 -1.58 1.98 0.00 0.00 175.50 175.90 1m8u s HIS 83 N -1.52 3.70 0.18 6.00 2.46 -1.26 -4.78 115.29 120.07 1m8u s HIS 83 Ca 0.80 0.92 0.06 0.00 0.47 0.00 0.00 55.06 57.31 1m8u s HIS 83 Cb -0.38 -2.26 -0.05 0.00 -0.13 0.00 0.00 32.58 29.77 1m8u s HIS 83 CO 0.44 0.62 -0.13 0.95 -2.47 0.00 0.00 174.74 174.15 1m8u s THR 84 N -0.96 1.51 -0.56 0.89 -4.23 -1.26 -5.04 115.64 106.00 1m8u s THR 84 Ca 0.22 -2.15 0.26 0.00 -1.18 0.00 0.00 61.69 58.84 1m8u s THR 84 Cb -0.16 -1.96 0.30 0.00 1.34 0.00 0.00 72.50 72.02 1m8u s THR 84 CO 0.12 -0.66 1.75 0.77 -0.54 0.00 0.00 174.62 176.06 1m8u h SER 85 N 2.65 0.00 -5.08 3.99 4.64 -2.01 -3.47 113.55 114.27 1m8u h SER 85 Ca -0.37 0.00 0.01 0.00 -0.47 0.00 0.00 61.79 60.96 1m8u h SER 85 Cb 1.21 0.00 -0.06 0.00 -0.31 0.00 0.00 62.40 63.24 1m8u h SER 85 CO 0.62 0.00 0.13 -0.94 -0.87 0.00 0.00 176.83 175.77 1m8u s SER 87 N -4.91 -0.15 -0.02 4.97 1.04 -1.26 -5.14 113.70 108.23 1m8u s SER 87 Ca 0.08 -0.78 0.01 0.00 0.48 0.00 0.00 55.95 55.74 1m8u s SER 87 Cb 0.10 0.70 0.01 0.00 0.10 0.00 0.00 66.02 66.94 1m8u s SER 87 CO 0.57 -1.33 -0.03 -1.00 0.98 0.00 0.00 173.24 172.43 1m8u s HIS 88 N -3.74 0.49 -0.24 5.02 0.09 -1.26 -2.78 115.29 112.87 1m8u s HIS 88 Ca 0.15 -0.09 -0.17 0.00 -0.00 0.00 0.00 55.06 54.95 1m8u s HIS 88 Cb -0.04 -0.43 0.07 0.00 -0.00 0.00 0.00 32.58 32.18 1m8u s HIS 88 CO 0.08 -0.10 0.61 0.50 -0.00 0.00 0.00 174.74 175.84 1m8u s ARG 89 N 0.52 0.66 -0.06 1.40 3.52 -0.38 -4.53 118.95 120.09 1m8u s ARG 89 Ca -0.06 0.97 -0.19 0.00 -0.13 0.00 0.00 55.73 56.32 1m8u s ARG 89 Cb -0.09 0.21 0.04 0.00 -1.56 0.00 0.00 34.95 33.55 1m8u s ARG 89 CO -0.01 -0.12 0.44 -1.17 -0.81 0.00 0.00 175.30 173.64 1m8u s LEU 90 N 0.96 0.31 -0.12 -0.88 0.20 -0.60 -1.53 118.68 117.03 1m8u s LEU 90 Ca -0.05 0.45 -0.02 0.00 0.69 0.00 0.00 54.13 55.20 1m8u s LEU 90 Cb -0.05 1.68 -0.03 0.00 -0.43 0.00 0.00 46.19 47.36 1m8u s LEU 90 CO -0.09 -0.42 -0.05 -0.13 -0.29 0.00 0.00 176.35 175.37 1m8u s ARG 91 N -0.92 3.25 -0.14 1.98 0.52 0.17 -0.65 118.95 123.16 1m8u s ARG 91 Ca -0.10 -0.54 -0.02 0.00 -0.52 0.00 0.00 55.73 54.55 1m8u s ARG 91 Cb -0.03 -2.76 -0.02 0.00 0.52 0.00 0.00 34.95 32.65 1m8u s ARG 91 CO 0.05 0.43 -0.06 0.42 0.02 0.00 0.00 175.30 176.16 1m8u s ILE 92 N -0.17 3.67 0.07 1.52 1.01 0.11 -0.89 121.20 126.52 1m8u s ILE 92 Ca 0.03 -0.44 0.09 0.00 0.00 0.00 0.00 60.65 60.32 1m8u s ILE 92 Cb -0.13 -2.58 -0.03 0.00 0.01 0.00 0.00 42.46 39.73 1m8u s ILE 92 CO 0.03 0.51 -0.24 -0.31 0.00 0.00 0.00 174.94 174.93 1m8u s TYR 93 N 0.23 2.40 0.29 3.97 1.51 -0.15 -2.00 117.35 123.60 1m8u s TYR 93 Ca -0.04 -0.35 0.08 0.00 -1.01 0.00 0.00 57.07 55.75 1m8u s TYR 93 Cb -0.14 -1.38 0.43 0.00 -0.11 0.00 0.00 41.96 40.76 1m8u s TYR 93 CO 0.03 0.23 1.67 1.49 -1.11 0.00 0.00 175.55 177.86 1m8u h GLU 94 N 4.45 0.12 -5.34 -0.62 4.81 -1.24 -1.00 114.58 115.76 1m8u h GLU 94 Ca -0.48 -0.07 -0.50 0.00 -0.13 0.00 0.00 59.36 58.18 1m8u h GLU 94 Cb 1.15 0.00 -0.14 0.00 0.63 0.00 0.00 28.75 30.40 1m8u h GLU 94 CO 0.44 0.60 -0.62 1.03 -0.73 0.00 0.00 179.01 179.73 1m8u s ARG 95 N -3.92 1.68 0.90 1.92 0.52 -0.63 -3.75 118.95 115.66 1m8u s ARG 95 Ca -0.03 -1.92 -0.11 0.00 -0.52 0.00 0.00 55.73 53.15 1m8u s ARG 95 Cb 0.13 -1.03 0.13 0.00 0.52 0.00 0.00 34.95 34.70 1m8u s ARG 95 CO 0.77 -0.12 1.09 -1.21 0.02 0.00 0.00 175.30 175.84 1m8u s GLU 96 N -3.83 1.21 -1.55 3.54 2.02 -1.26 -3.46 118.70 115.37 1m8u s GLU 96 Ca 0.35 0.90 -0.04 0.00 0.02 0.00 0.00 54.97 56.20 1m8u s GLU 96 Cb 0.08 -1.80 0.01 0.00 0.10 0.00 0.00 34.13 32.52 1m8u s GLU 96 CO 0.15 -2.29 0.41 -0.25 0.02 0.00 0.00 175.26 173.30 1m8u n ASP 97 N -3.93 -5.66 -3.23 -0.19 9.92 -0.27 -2.50 116.55 110.69 1m8u n ASP 97 Ca 0.07 -0.20 -0.23 0.00 -0.53 0.00 0.00 54.79 53.90 1m8u n ASP 97 Cb 0.55 -4.63 0.05 0.00 -0.64 0.00 0.00 41.12 36.45 1m8u n ASP 97 CO 0.00 0.00 0.00 -1.22 0.13 0.00 0.00 177.20 176.11 1m8u n TYR 98 N -4.26 -2.33 -3.65 1.24 4.01 -1.25 -5.01 117.16 105.90 1m8u n TYR 98 Ca -0.14 0.72 -0.21 0.00 -0.16 0.00 0.00 57.90 58.12 1m8u n TYR 98 Cb 0.63 -4.72 -0.03 0.00 -0.31 0.00 0.00 39.34 34.91 1m8u n TYR 98 CO 0.00 0.00 0.00 1.03 -0.46 0.00 0.00 176.86 177.43 1m8u s ARG 99 N -5.94 2.65 1.57 -0.72 1.81 -1.04 -5.01 118.95 112.26 1m8u s ARG 99 Ca 0.42 -1.40 0.00 0.00 -1.72 0.00 0.00 55.73 53.03 1m8u s ARG 99 Cb -0.18 -2.45 0.00 0.00 -0.45 0.00 0.00 34.95 31.87 1m8u s ARG 99 CO 0.51 -0.06 0.00 0.41 -0.68 0.00 0.00 175.30 175.49 1m8u n GLY 100 N -1.48 -1.71 3.75 -3.53 0.00 -1.26 -1.61 105.19 99.35 1m8u n GLY 100 Ca 0.01 -1.35 -0.34 0.00 0.00 0.00 0.00 46.02 44.35 1m8u n GLY 100 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1m8u s GLN 101 N 0.00 2.54 0.03 1.61 -0.21 -1.26 -4.71 119.66 117.66 1m8u s GLN 101 Ca 0.00 1.57 -0.06 0.00 0.02 0.00 0.00 55.36 56.89 1m8u s GLN 101 Cb 0.00 -1.90 -0.01 0.00 1.00 0.00 0.00 33.01 32.10 1m8u s GLN 101 CO 0.00 -1.49 0.11 1.41 -2.12 0.00 0.00 175.29 173.20 1m8u s MET 102 N -3.95 0.58 -0.01 2.91 -2.45 -1.26 -1.29 119.30 113.83 1m8u s MET 102 Ca 0.71 -0.69 -0.01 0.00 -1.25 0.00 0.00 55.69 54.44 1m8u s MET 102 Cb -0.25 0.23 0.00 0.00 1.25 0.00 0.00 34.83 36.06 1m8u s MET 102 CO 0.42 -0.15 0.02 0.14 1.05 0.00 0.00 175.02 176.51 1m8u s VAL 103 N -2.42 0.00 -0.23 10.11 -7.23 -0.85 -4.99 120.40 114.79 1m8u s VAL 103 Ca -0.06 -0.04 -0.05 0.00 -1.81 0.00 0.00 61.98 60.02 1m8u s VAL 103 Cb -0.02 -0.06 -0.01 0.00 0.56 0.00 0.00 36.38 36.85 1m8u s VAL 103 CO -0.04 -0.02 -0.00 -0.70 -0.31 0.00 0.00 175.10 174.03 1m8u s GLU 104 N -0.05 3.41 0.29 4.82 2.12 -1.26 -0.71 118.70 127.33 1m8u s GLU 104 Ca -0.01 -0.61 0.11 0.00 0.36 0.00 0.00 54.97 54.82 1m8u s GLU 104 Cb -0.01 -3.12 -0.05 0.00 0.26 0.00 0.00 34.13 31.21 1m8u s GLU 104 CO 0.00 -0.22 -0.14 0.96 -0.54 0.00 0.00 175.26 175.32 1m8u s ILE 105 N 1.51 2.60 -0.01 -3.70 -4.36 0.18 -4.97 121.20 112.46 1m8u s ILE 105 Ca 0.06 -2.26 0.01 0.00 -0.26 0.00 0.00 60.65 58.19 1m8u s ILE 105 Cb -0.15 -2.48 0.01 0.00 1.25 0.00 0.00 42.46 41.10 1m8u s ILE 105 CO -0.01 -0.35 0.79 0.35 0.24 0.00 0.00 174.94 175.96 1m8u n THR 106 N -0.72 0.14 -4.14 8.37 -2.24 -1.26 -1.55 114.28 112.88 1m8u n THR 106 Ca -0.05 -0.16 -0.10 0.00 -2.27 0.00 0.00 64.05 61.47 1m8u n THR 106 Cb 0.61 0.68 -0.09 0.00 -2.10 0.00 0.00 70.33 69.43 1m8u n THR 106 CO 0.00 0.00 0.00 -1.61 -0.57 0.00 0.00 175.07 172.89 1m8u s GLU 107 N -0.19 1.09 0.61 -0.78 0.41 -1.26 -4.83 118.70 113.75 1m8u s GLU 107 Ca 0.02 -1.47 -0.19 0.00 -0.41 0.00 0.00 54.97 52.92 1m8u s GLU 107 Cb 0.01 0.28 -0.03 0.00 -1.78 0.00 0.00 34.13 32.62 1m8u s GLU 107 CO 0.00 -0.35 1.25 -0.51 -0.49 0.00 0.00 175.26 175.17 1m8u s ASP 108 N -3.08 4.93 -0.16 -0.19 1.01 -1.26 -4.90 116.67 113.02 1m8u s ASP 108 Ca 0.29 2.51 -0.00 0.00 0.71 0.00 0.00 52.55 56.05 1m8u s ASP 108 Cb 0.06 -2.61 0.04 0.00 1.01 0.00 0.00 42.92 41.42 1m8u s ASP 108 CO 0.06 -1.78 -0.06 0.00 0.21 0.00 0.00 175.17 173.60 1m8u n SER 110 N 4.87 0.19 -3.27 0.00 3.41 -1.26 -0.65 113.62 116.91 1m8u n SER 110 Ca -0.12 0.21 -0.06 0.00 -0.26 0.00 0.00 58.87 58.64 1m8u n SER 110 Cb 0.48 -0.22 -0.04 0.00 -0.26 0.00 0.00 64.21 64.17 1m8u n SER 110 CO 0.00 0.00 0.00 -0.55 -0.16 0.00 0.00 175.04 174.33 1m8u s SER 111 N -2.99 -0.44 0.44 4.04 0.15 -1.24 -0.61 113.70 113.06 1m8u s SER 111 Ca 0.13 -1.04 0.15 0.00 0.70 0.00 0.00 55.95 55.89 1m8u s SER 111 Cb 0.18 1.40 1.07 0.00 -1.71 0.00 0.00 66.02 66.96 1m8u s SER 111 CO 0.59 -0.22 1.98 -0.07 1.20 0.00 0.00 173.24 176.73 1m8u h LEU 112 N 7.10 0.33 -0.35 3.45 3.38 -1.04 -2.39 115.31 125.79 1m8u h LEU 112 Ca 0.04 0.01 0.00 0.00 0.09 0.00 0.00 57.88 58.02 1m8u h LEU 112 Cb 1.13 -0.06 0.00 0.00 0.09 0.00 0.00 40.66 41.82 1m8u h LEU 112 CO 0.15 0.19 -0.21 1.41 0.09 0.00 0.00 178.44 180.08 1m8u n HIS 113 N -4.46 0.00 -0.00 1.13 8.25 -1.26 -4.29 115.22 114.58 1m8u n HIS 113 Ca 0.10 0.00 0.01 0.00 -0.26 0.00 0.00 57.72 57.56 1m8u n HIS 113 Cb 0.40 -0.16 -0.02 0.00 1.12 0.00 0.00 29.99 31.32 1m8u n HIS 113 CO 0.00 0.00 0.00 0.39 0.64 0.00 0.00 176.34 177.37 1m8u n GLU 114 N -0.85 0.91 0.22 -0.41 1.02 -0.96 -4.63 120.64 115.95 1m8u n GLU 114 Ca 0.13 -0.02 0.12 0.00 -0.02 0.00 0.00 57.16 57.37 1m8u n GLU 114 Cb 0.32 -1.06 0.25 0.00 -0.02 0.00 0.00 31.44 30.93 1m8u n GLU 114 CO 0.00 0.00 0.00 -0.09 1.18 0.00 0.00 177.13 178.22 1m8u h ARG 115 N 0.00 0.00 -5.64 3.49 9.65 -1.63 -3.47 114.38 116.78 1m8u h ARG 115 Ca -0.01 0.00 -0.62 0.00 -1.10 0.00 0.00 59.98 58.24 1m8u h ARG 115 Cb 0.35 0.00 -0.08 0.00 -1.39 0.00 0.00 29.97 28.85 1m8u h ARG 115 CO 0.00 0.05 -0.40 -0.06 2.80 0.00 0.00 179.97 182.37 1m8u s PHE 116 N -3.28 1.78 -1.61 2.20 0.08 -1.26 -5.03 117.98 110.86 1m8u s PHE 116 Ca 0.06 -0.87 0.30 0.00 0.12 0.00 0.00 56.93 56.54 1m8u s PHE 116 Cb 0.06 -1.80 1.63 0.00 -0.57 0.00 0.00 43.02 42.34 1m8u s PHE 116 CO 0.65 -0.16 2.10 0.72 -0.10 0.00 0.00 175.22 178.43 1m8u n HIS 117 N -1.54 0.00 -4.47 0.36 8.25 -1.26 -4.71 115.22 111.85 1m8u n HIS 117 Ca -0.09 0.00 -0.23 0.00 -0.26 0.00 0.00 57.72 57.15 1m8u n HIS 117 Cb 0.65 -0.19 -0.14 0.00 1.12 0.00 0.00 29.99 31.43 1m8u n HIS 117 CO 0.00 0.00 0.00 -0.59 0.64 0.00 0.00 176.34 176.39 1m8u s PHE 118 N -2.39 1.52 -0.13 4.41 -0.71 -1.26 -5.06 117.98 114.36 1m8u s PHE 118 Ca 0.34 -0.37 0.18 0.00 -1.04 0.00 0.00 56.93 56.04 1m8u s PHE 118 Cb 0.21 -0.90 -0.26 0.00 -1.21 0.00 0.00 43.02 40.86 1m8u s PHE 118 CO 0.43 0.07 0.43 -1.13 -1.34 0.00 0.00 175.22 173.68 1m8u n SER 119 N 1.82 0.94 -4.75 1.98 3.41 -1.26 -4.86 113.62 110.90 1m8u n SER 119 Ca -0.18 -0.12 -0.40 0.00 -0.26 0.00 0.00 58.87 57.91 1m8u n SER 119 Cb 0.54 1.70 -0.05 0.00 -0.26 0.00 0.00 64.21 66.14 1m8u n SER 119 CO 0.00 0.00 0.00 -1.61 -0.16 0.00 0.00 175.04 173.27 1m8u s GLU 120 N -3.15 4.52 -0.12 4.33 0.41 -1.26 -4.65 118.70 118.79 1m8u s GLU 120 Ca -0.05 1.11 -0.01 0.00 -0.41 0.00 0.00 54.97 55.61 1m8u s GLU 120 Cb 0.12 -3.35 0.04 0.00 -1.78 0.00 0.00 34.13 29.15 1m8u s GLU 120 CO 0.73 0.31 -0.02 0.42 -0.49 0.00 0.00 175.26 176.22 1m8u s ILE 121 N -0.19 0.69 0.00 -1.63 1.09 -1.26 -4.11 121.20 115.79 1m8u s ILE 121 Ca 0.39 -0.25 0.00 0.00 -1.10 0.00 0.00 60.65 59.69 1m8u s ILE 121 Cb -0.21 -0.89 0.00 0.00 -1.06 0.00 0.00 42.46 40.30 1m8u s ILE 121 CO 0.24 0.17 0.15 1.41 -0.10 0.00 0.00 174.94 176.80 1m8u n HIS 122 N 5.03 0.00 -3.57 3.97 8.25 -0.39 -4.95 115.22 123.57 1m8u n HIS 122 Ca -0.10 0.00 -0.17 0.00 -0.26 0.00 0.00 57.72 57.20 1m8u n HIS 122 Cb 0.49 0.00 -0.06 0.00 1.12 0.00 0.00 29.99 31.53 1m8u n HIS 122 CO 0.00 0.00 0.00 -1.54 0.64 0.00 0.00 176.34 175.44 1m8u s SER 123 N -0.04 -0.55 0.04 0.41 1.04 -1.20 -4.30 113.70 109.09 1m8u s SER 123 Ca 0.00 0.56 0.03 0.00 0.48 0.00 0.00 55.95 57.02 1m8u s SER 123 Cb 0.00 0.49 -0.02 0.00 0.10 0.00 0.00 66.02 66.59 1m8u s SER 123 CO 0.00 -0.58 -0.09 -0.36 0.98 0.00 0.00 173.24 173.19 1m8u s PHE 124 N -1.28 0.80 -0.29 5.02 0.08 -0.37 -0.98 117.98 120.96 1m8u s PHE 124 Ca -0.11 -0.39 0.02 0.00 0.12 0.00 0.00 56.93 56.56 1m8u s PHE 124 Cb -0.01 -0.48 0.08 0.00 -0.57 0.00 0.00 43.02 42.04 1m8u s PHE 124 CO 0.08 -0.03 0.01 -1.58 -0.10 0.00 0.00 175.22 173.60 1m8u s HIS 125 N -1.04 2.81 -0.65 0.36 5.65 -0.07 -1.68 115.29 120.67 1m8u s HIS 125 Ca -0.05 -2.25 -0.23 0.00 0.25 0.00 0.00 55.06 52.78 1m8u s HIS 125 Cb -0.08 -2.12 0.06 0.00 -1.18 0.00 0.00 32.58 29.26 1m8u s HIS 125 CO 0.01 -0.87 0.98 0.08 -0.65 0.00 0.00 174.74 174.29 1m8u s VAL 126 N 1.24 4.30 -0.01 0.89 1.01 -0.94 -0.66 120.40 126.23 1m8u s VAL 126 Ca 0.03 -0.22 -0.18 0.00 0.00 0.00 0.00 61.98 61.61 1m8u s VAL 126 Cb -0.19 -4.68 -0.34 0.00 0.00 0.00 0.00 36.38 31.18 1m8u s VAL 126 CO -0.11 -1.43 0.92 -0.07 0.00 0.00 0.00 175.10 174.41 1m8u h LEU 127 N 11.40 0.67 -7.77 3.92 3.38 -1.60 -1.02 115.31 124.30 1m8u h LEU 127 Ca -0.28 -0.93 -0.23 0.00 0.09 0.00 0.00 57.88 56.53 1m8u h LEU 127 Cb 1.07 -0.22 -0.27 0.00 0.09 0.00 0.00 40.66 41.33 1m8u h LEU 127 CO 1.17 1.59 -0.72 -1.61 0.09 0.00 0.00 178.44 178.96 1m8u s GLU 128 N -2.52 0.06 0.17 1.13 2.02 -0.58 -4.86 118.70 114.11 1m8u s GLU 128 Ca -0.12 -0.09 0.00 0.00 0.02 0.00 0.00 54.97 54.78 1m8u s GLU 128 Cb 0.03 -0.01 0.00 0.00 0.10 0.00 0.00 34.13 34.25 1m8u s GLU 128 CO 0.89 -0.00 0.00 0.41 0.02 0.00 0.00 175.26 176.58 1m8u n GLY 129 N 2.87 -2.59 3.82 -1.39 0.00 -1.12 -1.25 105.19 105.53 1m8u n GLY 129 Ca -0.14 -1.35 -0.37 0.00 0.00 0.00 0.00 46.02 44.16 1m8u n GLY 129 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 1m8u s TRP 130 N -3.01 3.59 0.21 1.61 0.52 -1.26 -3.84 118.94 116.76 1m8u s TRP 130 Ca 0.00 0.65 0.05 0.00 0.02 0.00 0.00 56.10 56.82 1m8u s TRP 130 Cb 0.00 -2.15 -0.05 0.00 -1.15 0.00 0.00 33.47 30.12 1m8u s TRP 130 CO 0.00 0.56 -0.06 -1.58 0.02 0.00 0.00 176.95 175.89 1m8u s TRP 131 N -0.57 1.56 -0.17 -1.98 0.52 -0.10 -1.33 118.94 116.87 1m8u s TRP 131 Ca 0.17 -0.79 0.01 0.00 0.02 0.00 0.00 56.10 55.51 1m8u s TRP 131 Cb -0.13 -0.85 0.01 0.00 -1.15 0.00 0.00 33.47 31.35 1m8u s TRP 131 CO 0.06 0.10 -0.19 0.08 0.02 0.00 0.00 176.95 177.02 1m8u s VAL 132 N -3.27 2.25 -0.19 4.03 1.01 0.42 0.24 120.40 124.91 1m8u s VAL 132 Ca 0.24 -0.89 -0.14 0.00 0.00 0.00 0.00 61.98 61.19 1m8u s VAL 132 Cb 0.04 -1.94 -0.04 0.00 0.00 0.00 0.00 36.38 34.43 1m8u s VAL 132 CO 0.07 0.53 0.32 -0.22 0.00 0.00 0.00 175.10 175.79 1m8u s LEU 133 N 1.09 4.19 0.01 3.92 2.96 0.00 -1.75 118.68 129.10 1m8u s LEU 133 Ca -0.00 0.46 0.03 0.00 -0.22 0.00 0.00 54.13 54.40 1m8u s LEU 133 Cb -0.14 -2.40 -0.04 0.00 0.50 0.00 0.00 46.19 44.12 1m8u s LEU 133 CO -0.07 0.02 -0.05 -0.31 -1.32 0.00 0.00 176.35 174.62 1m8u s TYR 134 N 0.90 2.93 0.27 5.38 2.02 0.16 -0.85 117.35 128.16 1m8u s TYR 134 Ca 0.16 -0.02 -0.01 0.00 -0.37 0.00 0.00 57.07 56.83 1m8u s TYR 134 Cb -0.14 -1.61 0.36 0.00 -0.40 0.00 0.00 41.96 40.17 1m8u s TYR 134 CO 0.06 0.40 1.76 1.49 -1.57 0.00 0.00 175.55 177.69 1m8u h GLU 135 N 4.35 0.74 -6.09 -0.62 4.81 -1.01 0.32 114.58 117.08 1m8u h GLU 135 Ca -0.48 -0.21 -0.61 0.00 -0.13 0.00 0.00 59.36 57.93 1m8u h GLU 135 Cb 1.17 -0.08 -0.14 0.00 0.63 0.00 0.00 28.75 30.33 1m8u h GLU 135 CO 0.55 0.78 -0.73 -1.64 -0.73 0.00 0.00 179.01 177.23 1m8u s MET 136 N -4.92 1.72 0.88 1.92 -1.94 -0.41 -1.61 119.30 114.94 1m8u s MET 136 Ca -0.09 -1.83 -0.10 0.00 -1.71 0.00 0.00 55.69 51.96 1m8u s MET 136 Cb 0.15 -1.73 0.12 0.00 2.01 0.00 0.00 34.83 35.38 1m8u s MET 136 CO 0.81 0.25 1.12 -1.25 -0.01 0.00 0.00 175.02 175.94 1m8u s PRO 137 N -3.55 1.34 -1.27 2.03 0.04 -1.26 -3.22 135.00 129.11 1m8u s PRO 137 Ca 0.31 1.33 -0.03 0.00 0.04 0.00 0.00 61.00 62.65 1m8u s PRO 137 Cb -0.02 -1.78 0.00 0.00 0.04 0.00 0.00 34.50 32.74 1m8u s PRO 137 CO 0.15 -2.34 0.40 0.09 0.04 0.00 0.00 177.00 175.35 1m8u n ASN 138 N -4.01 -5.14 -3.54 6.66 4.13 0.22 -3.77 115.26 109.80 1m8u n ASN 138 Ca 0.10 -0.19 -0.24 0.00 1.68 0.00 0.00 54.58 55.93 1m8u n ASN 138 Cb 0.53 -4.03 0.05 0.00 -1.54 0.00 0.00 39.78 34.79 1m8u n ASN 138 CO 0.00 0.00 0.00 -1.22 0.28 0.00 0.00 177.26 176.32 1m8u n TYR 139 N -4.21 -2.09 -4.28 3.10 4.01 -1.24 -5.02 117.16 107.42 1m8u n TYR 139 Ca -0.11 0.66 -0.15 0.00 -0.16 0.00 0.00 57.90 58.14 1m8u n TYR 139 Cb 0.61 -3.86 -0.10 0.00 -0.31 0.00 0.00 39.34 35.68 1m8u n TYR 139 CO 0.00 0.00 0.00 1.03 -0.46 0.00 0.00 176.86 177.43 1m8u s ARG 140 N -5.45 1.37 1.08 -0.72 0.52 -1.20 -5.04 118.95 109.51 1m8u s ARG 140 Ca 0.38 -1.74 0.00 0.00 -0.52 0.00 0.00 55.73 53.84 1m8u s ARG 140 Cb -0.10 -0.06 0.00 0.00 0.52 0.00 0.00 34.95 35.31 1m8u s ARG 140 CO 0.81 -0.35 0.00 0.41 0.02 0.00 0.00 175.30 176.19 1m8u n GLY 141 N -0.42 -1.88 3.76 -3.53 0.00 -1.26 -1.29 105.19 100.58 1m8u n GLY 141 Ca 0.01 -1.52 -0.39 0.00 0.00 0.00 0.00 46.02 44.12 1m8u n GLY 141 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1m8u s ARG 142 N 0.00 3.72 0.10 1.61 0.52 -1.26 -4.62 118.95 119.03 1m8u s ARG 142 Ca 0.00 2.25 0.08 0.00 -0.52 0.00 0.00 55.73 57.54 1m8u s ARG 142 Cb 0.00 -2.62 -0.04 0.00 0.52 0.00 0.00 34.95 32.81 1m8u s ARG 142 CO 0.00 -0.73 -0.13 -0.65 0.02 0.00 0.00 175.30 173.81 1m8u s GLN 143 N -2.45 2.03 -0.11 3.54 -0.21 -1.26 -1.01 119.66 120.18 1m8u s GLN 143 Ca 0.61 -1.06 -0.04 0.00 0.02 0.00 0.00 55.36 54.89 1m8u s GLN 143 Cb -0.40 -2.25 0.05 0.00 1.00 0.00 0.00 33.01 31.41 1m8u s GLN 143 CO 0.51 0.50 0.10 0.71 -2.12 0.00 0.00 175.29 174.99 1m8u s TYR 144 N -1.18 0.06 0.14 0.91 2.02 -0.03 -4.43 117.35 114.85 1m8u s TYR 144 Ca 0.20 0.06 -0.30 0.00 -0.37 0.00 0.00 57.07 56.66 1m8u s TYR 144 Cb -0.11 -0.53 -0.07 0.00 -0.40 0.00 0.00 41.96 40.85 1m8u s TYR 144 CO 0.12 -0.37 1.14 -1.17 -1.57 0.00 0.00 175.55 173.70 1m8u s LEU 145 N 2.19 4.45 -0.24 -1.29 2.96 -1.26 -0.82 118.68 124.67 1m8u s LEU 145 Ca 0.04 2.09 0.02 0.00 -0.22 0.00 0.00 54.13 56.06 1m8u s LEU 145 Cb -0.14 -3.60 0.05 0.00 0.50 0.00 0.00 46.19 43.00 1m8u s LEU 145 CO -0.07 -0.32 -0.13 -0.76 -1.32 0.00 0.00 176.35 173.75 1m8u s LEU 146 N 0.06 3.04 0.50 -0.68 1.43 0.14 -4.95 118.68 118.23 1m8u s LEU 146 Ca 0.53 -1.19 -0.01 0.00 -1.03 0.00 0.00 54.13 52.43 1m8u s LEU 146 Cb -0.30 -1.50 0.01 0.00 0.03 0.00 0.00 46.19 44.43 1m8u s LEU 146 CO 0.34 -0.14 0.73 0.00 0.23 0.00 0.00 176.35 177.51 1m8u s ARG 147 N 1.17 2.91 0.16 1.70 1.70 -1.26 -0.92 118.95 124.41 1m8u s ARG 147 Ca -0.05 -0.48 -0.34 0.00 -0.47 0.00 0.00 55.73 54.39 1m8u s ARG 147 Cb -0.18 -2.49 -0.14 0.00 -0.57 0.00 0.00 34.95 31.57 1m8u s ARG 147 CO -0.07 -0.45 1.55 -2.30 -1.08 0.00 0.00 175.30 172.95 1m8u n PRO 148 N -2.23 2.08 -3.99 3.89 -0.02 -1.25 -4.82 135.00 128.66 1m8u n PRO 148 Ca 0.03 0.75 0.00 0.00 -2.02 0.00 0.00 63.50 62.26 1m8u n PRO 148 Cb 0.58 -2.50 0.00 0.00 -0.02 0.00 0.00 33.50 31.56 1m8u n PRO 148 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1m8u n GLY 149 N 3.25 -1.80 3.85 -1.23 0.00 -0.39 -5.02 105.19 103.86 1m8u n GLY 149 Ca 0.17 -1.26 -0.37 0.00 0.00 0.00 0.00 46.02 44.55 1m8u n GLY 149 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1m8u s ASP 150 N -2.94 6.70 -0.43 1.61 1.01 -1.26 -2.22 116.67 119.13 1m8u s ASP 150 Ca 0.00 0.83 0.07 0.00 0.71 0.00 0.00 52.55 54.16 1m8u s ASP 150 Cb 0.00 -2.20 0.24 0.00 1.01 0.00 0.00 42.92 41.97 1m8u s ASP 150 CO 0.00 0.32 0.52 -1.22 0.21 0.00 0.00 175.17 175.00 1m8u n TYR 151 N 1.72 0.10 0.44 4.23 4.02 -0.68 -4.96 117.16 122.04 1m8u n TYR 151 Ca -0.14 -3.61 0.09 0.00 -0.01 0.00 0.00 57.90 54.23 1m8u n TYR 151 Cb 0.53 -0.29 0.39 0.00 -0.02 0.00 0.00 39.34 39.94 1m8u n TYR 151 CO 0.00 0.00 0.00 0.54 -1.01 0.00 0.00 176.86 176.39 1m8u n ARG 152 N 1.56 0.09 -3.47 -0.72 1.74 -1.26 -1.23 116.66 113.36 1m8u n ARG 152 Ca 0.23 0.33 -0.10 0.00 -0.77 0.00 0.00 57.85 57.54 1m8u n ARG 152 Cb 0.50 -1.67 -0.02 0.00 -1.02 0.00 0.00 32.46 30.26 1m8u n ARG 152 CO 0.00 0.00 0.00 -0.98 -1.52 0.00 0.00 177.63 175.13 1m8u s ARG 153 N -3.14 1.03 0.45 5.56 1.70 -1.26 -1.11 118.95 122.17 1m8u s ARG 153 Ca 0.06 -0.35 0.19 0.00 -0.47 0.00 0.00 55.73 55.16 1m8u s ARG 153 Cb 0.09 0.47 1.15 0.00 -0.57 0.00 0.00 34.95 36.10 1m8u s ARG 153 CO 0.32 -0.44 1.90 0.10 -1.08 0.00 0.00 175.30 176.09 1m8u h TYR 154 N 2.04 0.40 -0.39 5.89 -0.00 -1.87 -0.68 116.97 122.35 1m8u h TYR 154 Ca -0.27 0.01 0.05 0.00 0.00 0.00 0.00 58.73 58.52 1m8u h TYR 154 Cb 1.27 -0.12 -0.02 0.00 0.00 0.00 0.00 36.73 37.85 1m8u h TYR 154 CO 0.25 0.13 0.26 1.25 -0.00 0.00 0.00 178.16 180.05 1m8u h HIS 155 N 0.32 0.30 0.00 0.10 2.76 -1.92 -1.60 115.15 115.11 1m8u h HIS 155 Ca 0.40 0.01 -0.02 0.00 -2.20 0.00 0.00 60.37 58.56 1m8u h HIS 155 Cb 1.09 -0.10 -0.00 0.00 1.55 0.00 0.00 27.41 29.95 1m8u h HIS 155 CO -0.00 0.17 -0.09 0.93 -1.30 0.00 0.00 177.93 177.63 1m8u h GLU 156 N 0.30 0.00 -0.52 5.26 4.39 -1.46 -2.22 114.58 120.34 1m8u h GLU 156 Ca 0.17 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.87 1m8u h GLU 156 Cb 0.29 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 28.94 1m8u h GLU 156 CO -0.04 0.09 0.00 -2.67 -1.16 0.00 0.00 179.01 175.24 1m8u n TRP 157 N -3.61 1.45 -1.00 4.33 2.14 -0.61 -4.95 117.44 115.19 1m8u n TRP 157 Ca -0.02 -0.69 -0.00 0.00 2.07 0.00 0.00 57.50 58.86 1m8u n TRP 157 Cb 0.21 -0.32 -0.00 0.00 -0.81 0.00 0.00 31.31 30.39 1m8u n TRP 157 CO 0.00 0.00 0.00 0.41 2.07 0.00 0.00 177.69 180.17 1m8u n GLY 158 N 0.57 0.48 3.88 -1.67 0.00 -0.83 -4.81 105.19 102.81 1m8u n GLY 158 Ca 0.24 -0.18 -0.32 0.00 0.00 0.00 0.00 46.02 45.77 1m8u n GLY 158 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1m8u s ALA 159 N -1.98 3.64 -1.40 4.61 0.00 -1.17 -4.96 121.76 120.50 1m8u s ALA 159 Ca 0.00 -0.38 0.15 0.00 0.00 0.00 0.00 51.96 51.73 1m8u s ALA 159 Cb 0.00 -2.33 -0.00 0.00 0.00 0.00 0.00 23.12 20.79 1m8u s ALA 159 CO 0.00 0.55 0.83 1.33 0.00 0.00 0.00 175.76 178.46 1m8u n VAL 160 N -0.11 0.00 -4.41 0.00 0.24 -1.26 -4.23 118.33 108.56 1m8u n VAL 160 Ca -0.01 -0.34 -0.25 0.00 -2.04 0.00 0.00 64.34 61.70 1m8u n VAL 160 Cb 0.52 1.18 -0.11 0.00 -1.47 0.00 0.00 33.84 33.96 1m8u n VAL 160 CO 0.00 0.00 0.00 -0.62 -2.14 0.00 0.00 176.83 174.07 1m8u s ASP 161 N -1.82 3.31 0.00 -1.34 -1.08 -1.26 -5.05 116.67 109.43 1m8u s ASP 161 Ca 0.13 -0.90 0.20 0.00 -0.52 0.00 0.00 52.55 51.46 1m8u s ASP 161 Cb 0.12 -0.24 0.22 0.00 -1.46 0.00 0.00 42.92 41.56 1m8u s ASP 161 CO 0.38 0.07 1.20 0.00 0.52 0.00 0.00 175.17 177.34 1m8u n ALA 162 N 0.09 2.45 -2.06 3.66 0.00 -1.26 -4.93 120.51 118.45 1m8u n ALA 162 Ca -0.11 -0.75 -0.42 0.00 0.00 0.00 0.00 53.44 52.16 1m8u n ALA 162 Cb 0.57 -0.71 -0.03 0.00 0.00 0.00 0.00 19.45 19.28 1m8u n ALA 162 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 177.50 178.00 1m8u s ARG 163 N -1.61 4.26 0.09 0.00 3.52 -1.26 -5.02 118.95 118.93 1m8u s ARG 163 Ca 0.27 2.19 0.02 0.00 -0.13 0.00 0.00 55.73 58.08 1m8u s ARG 163 Cb 0.18 -3.35 -0.04 0.00 -1.56 0.00 0.00 34.95 30.18 1m8u s ARG 163 CO 0.26 -0.57 -0.08 0.14 -0.81 0.00 0.00 175.30 174.24 1m8u s VAL 164 N 1.67 0.75 0.00 7.11 -7.23 -1.22 -4.50 120.40 116.97 1m8u s VAL 164 Ca 0.68 -1.70 0.00 0.00 -1.81 0.00 0.00 61.98 59.15 1m8u s VAL 164 Cb -0.38 -1.40 0.00 0.00 0.56 0.00 0.00 36.38 35.15 1m8u s VAL 164 CO 0.30 -0.69 0.00 0.61 -0.31 0.00 0.00 175.10 175.01 1m8u n GLY 165 N 0.39 0.06 3.39 2.32 0.00 0.11 -4.65 105.19 106.80 1m8u n GLY 165 Ca -0.15 -0.03 -0.10 0.00 0.00 0.00 0.00 46.02 45.74 1m8u n GLY 165 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1m8u s SER 166 N -1.52 -0.08 -0.08 1.61 1.04 -0.91 -0.49 113.70 113.28 1m8u s SER 166 Ca 0.00 -0.68 -0.03 0.00 0.48 0.00 0.00 55.95 55.72 1m8u s SER 166 Cb 0.00 0.48 0.04 0.00 0.10 0.00 0.00 66.02 66.64 1m8u s SER 166 CO 0.00 -0.93 0.16 -0.22 0.98 0.00 0.00 173.24 173.23 1m8u s LEU 167 N -2.91 0.40 0.02 2.42 2.96 0.17 -0.66 118.68 121.08 1m8u s LEU 167 Ca 0.12 0.34 0.04 0.00 -0.22 0.00 0.00 54.13 54.41 1m8u s LEU 167 Cb 0.02 0.37 -0.02 0.00 0.50 0.00 0.00 46.19 47.06 1m8u s LEU 167 CO -0.03 -0.18 -0.12 0.00 -1.32 0.00 0.00 176.35 174.69 1m8u s ARG 168 N 1.60 0.88 0.24 1.98 1.70 -0.72 -0.31 118.95 124.32 1m8u s ARG 168 Ca -0.05 -0.63 -0.30 0.00 -0.47 0.00 0.00 55.73 54.29 1m8u s ARG 168 Cb -0.12 -0.85 -0.09 0.00 -0.57 0.00 0.00 34.95 33.32 1m8u s ARG 168 CO -0.06 0.22 0.98 1.03 -1.08 0.00 0.00 175.30 176.38 1m8u s ARG 169 N -0.87 4.81 -0.63 3.89 0.52 -1.26 -0.43 118.95 124.98 1m8u s ARG 169 Ca 0.02 1.56 -0.24 0.00 -0.52 0.00 0.00 55.73 56.55 1m8u s ARG 169 Cb -0.07 -3.26 0.05 0.00 0.52 0.00 0.00 34.95 32.19 1m8u s ARG 169 CO 0.01 0.44 0.99 0.00 0.02 0.00 0.00 175.30 176.76 1m8u s ALA 170 N -1.13 3.09 -0.00 2.13 0.00 -0.44 -4.89 121.76 120.52 1m8u s ALA 170 Ca 0.42 -1.56 0.02 0.00 0.00 0.00 0.00 51.96 50.84 1m8u s ALA 170 Cb -0.27 -3.85 -0.01 0.00 0.00 0.00 0.00 23.12 18.99 1m8u s ALA 170 CO 0.34 -2.68 -0.06 0.14 0.00 0.00 0.00 175.76 173.50 1m8u s VAL 171 N 4.19 0.48 0.14 0.00 -7.23 -1.26 -4.76 120.40 111.96 1m8u s VAL 171 Ca 0.27 -0.32 0.06 0.00 -1.81 0.00 0.00 61.98 60.17 1m8u s VAL 171 Cb -0.14 -0.42 -0.04 0.00 0.56 0.00 0.00 36.38 36.34 1m8u s VAL 171 CO 0.14 0.09 -0.13 -0.62 -0.31 0.00 0.00 175.10 174.28 1m8u s ASP 172 N -0.26 2.01 0.97 4.85 2.15 -1.26 -4.93 116.67 120.21 1m8u s ASP 172 Ca 0.01 -0.91 -0.12 0.00 0.43 0.00 0.00 52.55 51.97 1m8u s ASP 172 Cb -0.03 -0.06 0.17 0.00 -0.30 0.00 0.00 42.92 42.71 1m8u s ASP 172 CO -0.00 -0.21 1.08 -0.36 -0.17 0.00 0.00 175.17 175.51 1m8u s PHE 173 N -2.66 2.01 -2.00 -5.34 0.08 -1.26 -5.09 117.98 103.72 1m8u s PHE 173 Ca 0.13 1.24 0.20 0.00 0.12 0.00 0.00 56.93 58.63 1m8u s PHE 173 Cb -0.02 -3.19 1.22 0.00 -0.57 0.00 0.00 43.02 40.46 1m8u s PHE 173 CO 0.03 -2.83 1.60 0.66 -0.10 0.00 0.00 175.22 174.58