#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2a3y s THR 2 N 0.00 1.19 -0.44 0.61 2.01 -0.48 -4.84 115.64 113.69 2a3y s THR 2 Ca 0.00 -0.56 -0.26 0.00 0.31 0.00 0.00 61.69 61.18 2a3y s THR 2 Cb 0.00 -1.05 0.02 0.00 0.01 0.00 0.00 72.50 71.49 2a3y s THR 2 CO 0.00 0.36 0.96 -0.62 -0.69 0.00 0.00 174.62 174.63 2a3y s ASP 3 N 0.29 6.56 -0.21 3.53 -1.08 -1.24 -1.32 116.67 123.20 2a3y s ASP 3 Ca -0.08 0.28 0.15 0.00 -0.52 0.00 0.00 52.55 52.39 2a3y s ASP 3 Cb -0.12 -2.47 0.77 0.00 -1.46 0.00 0.00 42.92 39.64 2a3y s ASP 3 CO 0.02 -1.04 1.70 0.18 0.52 0.00 0.00 175.17 176.55 2a3y n LEU 4 N 7.18 5.39 -4.66 -1.34 4.32 -0.44 -5.00 117.00 122.46 2a3y n LEU 4 Ca 0.07 -2.87 -0.51 0.00 -0.02 0.00 0.00 56.01 52.67 2a3y n LEU 4 Cb 0.48 -0.65 -0.06 0.00 -1.62 0.00 0.00 43.42 41.58 2a3y n LEU 4 CO 0.64 0.66 1.23 -1.20 -1.22 0.00 0.00 177.39 177.51 2a3y n SER 5 N 0.56 2.61 -0.65 -1.43 7.64 -1.26 -1.04 113.62 120.05 2a3y n SER 5 Ca 0.27 1.06 -0.08 0.00 1.01 0.00 0.00 58.87 61.13 2a3y n SER 5 Cb 1.12 -1.27 -0.04 0.00 -1.01 0.00 0.00 64.21 63.02 2a3y n SER 5 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2a3y n GLY 6 N 3.66 1.00 3.22 0.23 0.00 -1.26 -5.01 105.19 107.04 2a3y n GLY 6 Ca 0.21 -0.66 -0.17 0.00 0.00 0.00 0.00 46.02 45.41 2a3y n GLY 6 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2a3y s LYS 7 N -2.75 0.97 0.11 1.61 1.02 -0.21 -0.56 119.74 119.93 2a3y s LYS 7 Ca 0.00 -1.23 0.06 0.00 0.02 0.00 0.00 55.97 54.82 2a3y s LYS 7 Cb 0.00 -0.77 -0.04 0.00 -0.52 0.00 0.00 37.83 36.50 2a3y s LYS 7 CO 0.00 0.14 -0.15 0.14 -0.92 0.00 0.00 175.35 174.56 2a3y s VAL 8 N -2.32 1.34 -0.10 3.17 -7.23 0.16 -4.44 120.40 110.97 2a3y s VAL 8 Ca 0.08 -1.64 -0.26 0.00 -1.81 0.00 0.00 61.98 58.36 2a3y s VAL 8 Cb -0.04 -1.46 -0.02 0.00 0.56 0.00 0.00 36.38 35.42 2a3y s VAL 8 CO 0.02 -0.35 0.84 -0.36 -0.31 0.00 0.00 175.10 174.94 2a3y s PHE 9 N -1.91 3.51 -0.26 2.82 0.08 0.03 -1.66 117.98 120.60 2a3y s PHE 9 Ca 0.07 1.37 -0.07 0.00 0.12 0.00 0.00 56.93 58.42 2a3y s PHE 9 Cb -0.06 -3.00 -0.02 0.00 -0.57 0.00 0.00 43.02 39.37 2a3y s PHE 9 CO 0.03 -0.11 0.07 0.08 -0.10 0.00 0.00 175.22 175.20 2a3y s VAL 10 N 1.57 4.22 -0.80 -0.44 1.01 0.14 -1.50 120.40 124.61 2a3y s VAL 10 Ca 0.42 -0.31 -0.15 0.00 0.00 0.00 0.00 61.98 61.93 2a3y s VAL 10 Cb -0.18 -3.03 0.20 0.00 0.00 0.00 0.00 36.38 33.37 2a3y s VAL 10 CO 0.17 0.27 0.76 -0.36 0.00 0.00 0.00 175.10 175.94 2a3y s PHE 11 N 1.59 3.65 -1.37 5.22 0.40 0.91 -1.45 117.98 126.93 2a3y s PHE 11 Ca 0.05 -1.86 0.29 0.00 -0.60 0.00 0.00 56.93 54.82 2a3y s PHE 11 Cb -0.16 -3.86 1.43 0.00 0.51 0.00 0.00 43.02 40.95 2a3y s PHE 11 CO 0.03 -1.04 1.99 -2.30 0.70 0.00 0.00 175.22 174.61 2a3y n PRO 12 N 4.34 0.35 -3.59 0.24 -0.02 -1.26 -0.98 135.00 134.07 2a3y n PRO 12 Ca 0.11 0.01 -0.13 0.00 -2.02 0.00 0.00 63.50 61.47 2a3y n PRO 12 Cb 0.46 -1.50 -0.05 0.00 -0.02 0.00 0.00 33.50 32.39 2a3y n PRO 12 CO 0.00 0.00 0.00 -0.98 1.98 0.00 0.00 175.50 176.50 2a3y s ARG 13 N -2.63 1.02 0.08 -0.52 1.70 -1.26 -4.94 118.95 112.40 2a3y s ARG 13 Ca 0.25 -0.30 -0.31 0.00 -0.47 0.00 0.00 55.73 54.90 2a3y s ARG 13 Cb 0.19 0.46 -0.07 0.00 -0.57 0.00 0.00 34.95 34.96 2a3y s ARG 13 CO 0.45 -0.37 1.37 -2.00 -1.08 0.00 0.00 175.30 173.68 2a3y s GLU 14 N -2.59 4.32 0.33 3.89 2.12 -1.26 -4.83 118.70 120.68 2a3y s GLU 14 Ca -0.04 2.02 -0.18 0.00 0.36 0.00 0.00 54.97 57.13 2a3y s GLU 14 Cb -0.01 -3.33 0.05 0.00 0.26 0.00 0.00 34.13 31.11 2a3y s GLU 14 CO -0.03 -0.45 0.83 -1.54 -0.54 0.00 0.00 175.26 173.53 2a3y s SER 15 N 1.28 -0.03 0.00 -1.70 1.04 -1.26 -5.04 113.70 107.98 2a3y s SER 15 Ca 0.64 -0.97 0.11 0.00 0.48 0.00 0.00 55.95 56.20 2a3y s SER 15 Cb -0.35 0.77 0.17 0.00 0.10 0.00 0.00 66.02 66.71 2a3y s SER 15 CO 0.29 -1.51 1.01 0.55 0.98 0.00 0.00 173.24 174.57 2a3y n VAL 16 N -0.55 0.38 0.00 5.02 3.14 -1.26 -4.28 118.33 120.79 2a3y n VAL 16 Ca -0.07 -0.69 0.00 0.00 -2.96 0.00 0.00 64.34 60.62 2a3y n VAL 16 Cb 0.60 0.95 0.00 0.00 -1.06 0.00 0.00 33.84 34.33 2a3y n VAL 16 CO 0.00 0.00 0.00 0.41 -6.46 0.00 0.00 176.83 170.78 2a3y n THR 17 N 0.59 0.00 -1.67 1.55 -1.04 -1.26 -4.67 114.28 107.78 2a3y n THR 17 Ca 0.09 0.00 -0.42 0.00 -2.04 0.00 0.00 64.05 61.67 2a3y n THR 17 Cb 0.34 -0.54 -0.03 0.00 -1.82 0.00 0.00 70.33 68.28 2a3y n THR 17 CO 0.00 0.00 0.00 -1.81 -0.64 0.00 0.00 175.07 172.62 2a3y s ASP 18 N -3.79 6.06 0.24 8.00 1.01 -1.26 -4.60 116.67 122.32 2a3y s ASP 18 Ca 0.00 2.31 -0.19 0.00 0.71 0.00 0.00 52.55 55.38 2a3y s ASP 18 Cb 0.00 -2.52 0.02 0.00 1.01 0.00 0.00 42.92 41.43 2a3y s ASP 18 CO 0.00 -1.41 0.61 -1.38 0.21 0.00 0.00 175.17 173.20 2a3y s HIS 19 N 5.98 -0.12 -0.10 4.23 -3.43 -0.73 -4.35 115.29 116.76 2a3y s HIS 19 Ca 0.92 -0.26 0.03 0.00 -0.80 0.00 0.00 55.06 54.95 2a3y s HIS 19 Cb -0.38 0.52 0.00 0.00 -1.43 0.00 0.00 32.58 31.29 2a3y s HIS 19 CO 0.38 -1.07 -0.21 0.08 -2.00 0.00 0.00 174.74 171.92 2a3y s VAL 20 N -3.90 1.90 -0.01 -5.38 1.01 0.28 -1.78 120.40 112.51 2a3y s VAL 20 Ca 0.11 -0.91 -0.26 0.00 0.00 0.00 0.00 61.98 60.92 2a3y s VAL 20 Cb -0.03 -1.66 -0.04 0.00 0.00 0.00 0.00 36.38 34.65 2a3y s VAL 20 CO 0.02 0.52 0.82 0.20 0.00 0.00 0.00 175.10 176.67 2a3y s ASN 21 N 0.53 7.20 -0.17 3.32 0.01 0.14 -0.88 114.94 125.09 2a3y s ASN 21 Ca -0.15 1.44 -0.04 0.00 -0.71 0.00 0.00 52.86 53.40 2a3y s ASN 21 Cb -0.17 -2.49 -0.03 0.00 0.41 0.00 0.00 41.25 38.98 2a3y s ASN 21 CO 0.05 -0.13 -0.02 -0.76 -1.51 0.00 0.00 177.10 174.73 2a3y s LEU 22 N 0.63 3.24 -0.19 0.60 1.02 -0.10 -1.29 118.68 122.59 2a3y s LEU 22 Ca 0.43 -0.16 -0.03 0.00 0.02 0.00 0.00 54.13 54.39 2a3y s LEU 22 Cb -0.20 -1.80 -0.01 0.00 0.02 0.00 0.00 46.19 44.21 2a3y s LEU 22 CO 0.23 0.13 -0.07 -0.63 0.02 0.00 0.00 176.35 176.02 2a3y s ILE 23 N 0.62 3.27 -0.08 -0.59 1.01 -0.60 -3.97 121.20 120.86 2a3y s ILE 23 Ca -0.02 -0.55 0.02 0.00 0.00 0.00 0.00 60.65 60.11 2a3y s ILE 23 Cb -0.14 -2.45 -0.02 0.00 0.01 0.00 0.00 42.46 39.86 2a3y s ILE 23 CO 0.02 0.46 -0.15 0.28 0.00 0.00 0.00 174.94 175.56 2a3y s THR 24 N 1.06 2.96 -2.17 2.92 -1.32 -1.26 -4.45 115.64 113.39 2a3y s THR 24 Ca 0.00 -0.73 0.22 0.00 -1.21 0.00 0.00 61.69 59.97 2a3y s THR 24 Cb -0.15 -2.19 0.53 0.00 -1.51 0.00 0.00 72.50 69.18 2a3y s THR 24 CO -0.01 0.56 1.68 -0.81 -2.21 0.00 0.00 174.62 173.83 2a3y n PRO 25 N 2.87 1.39 0.16 7.08 -0.04 -1.26 -4.43 135.00 140.76 2a3y n PRO 25 Ca -0.18 -0.58 -0.14 0.00 -0.04 0.00 0.00 63.50 62.56 2a3y n PRO 25 Cb 0.52 -1.37 -0.07 0.00 -0.04 0.00 0.00 33.50 32.55 2a3y n PRO 25 CO 0.00 0.00 0.00 1.25 -0.04 0.00 0.00 175.50 176.71 2a3y h LEU 26 N 1.22 -0.77 1.14 1.53 5.85 -1.88 -3.47 115.31 118.93 2a3y h LEU 26 Ca 0.00 0.08 -0.41 0.00 0.84 0.00 0.00 57.88 58.39 2a3y h LEU 26 Cb 0.27 0.27 0.05 0.00 0.37 0.00 0.00 40.66 41.62 2a3y h LEU 26 CO 0.00 -0.39 -0.60 -0.62 -0.34 0.00 0.00 178.44 176.48 2a3y n GLU 27 N -5.40 -4.68 -4.07 1.25 -0.58 -1.26 -5.00 120.64 100.90 2a3y n GLU 27 Ca -0.08 0.92 -0.13 0.00 -0.42 0.00 0.00 57.16 57.44 2a3y n GLU 27 Cb 0.30 -5.77 -0.11 0.00 -0.57 0.00 0.00 31.44 25.29 2a3y n GLU 27 CO 0.00 0.00 0.00 0.15 -0.48 0.00 0.00 177.13 176.80 2a3y s LYS 28 N -5.67 0.56 0.59 3.49 1.02 -1.26 -4.76 119.74 113.70 2a3y s LYS 28 Ca 0.29 -0.80 -0.19 0.00 0.02 0.00 0.00 55.97 55.28 2a3y s LYS 28 Cb -0.13 -0.32 -0.04 0.00 -0.52 0.00 0.00 37.83 36.83 2a3y s LYS 28 CO 0.35 0.05 1.24 -1.25 -0.92 0.00 0.00 175.35 174.83 2a3y s PRO 29 N -1.70 2.98 -0.24 -1.68 0.04 -1.26 -4.32 135.00 128.82 2a3y s PRO 29 Ca -0.08 1.93 -0.08 0.00 0.04 0.00 0.00 61.00 62.81 2a3y s PRO 29 Cb -0.09 -2.00 -0.03 0.00 0.04 0.00 0.00 34.50 32.41 2a3y s PRO 29 CO 0.00 -1.23 0.08 -0.51 0.04 0.00 0.00 177.00 175.38 2a3y s LEU 30 N -3.96 3.54 -0.20 -3.56 1.43 0.14 -4.93 118.68 111.13 2a3y s LEU 30 Ca 0.76 -0.15 -0.05 0.00 -1.03 0.00 0.00 54.13 53.67 2a3y s LEU 30 Cb -0.33 -1.94 -0.20 0.00 0.03 0.00 0.00 46.19 43.74 2a3y s LEU 30 CO 0.37 -0.00 0.03 0.00 0.23 0.00 0.00 176.35 176.97 2a3y n GLN 31 N 4.71 0.68 -4.39 1.70 6.02 -1.26 -1.48 117.38 123.36 2a3y n GLN 31 Ca -0.16 0.24 -0.22 0.00 -0.01 0.00 0.00 57.00 56.85 2a3y n GLN 31 Cb 0.52 -1.61 -0.13 0.00 1.02 0.00 0.00 30.24 30.03 2a3y n GLN 31 CO 0.00 0.00 0.00 -0.80 -1.01 0.00 0.00 177.06 175.25 2a3y s ASN 32 N -6.85 1.95 0.04 1.08 0.01 -1.26 -0.45 114.94 109.47 2a3y s ASN 32 Ca -0.30 -0.52 -0.24 0.00 -0.71 0.00 0.00 52.86 51.09 2a3y s ASN 32 Cb 0.08 -0.12 0.06 0.00 0.41 0.00 0.00 41.25 41.68 2a3y s ASN 32 CO 0.66 0.05 0.57 0.72 -1.51 0.00 0.00 177.10 177.59 2a3y s PHE 33 N -0.93 -0.50 -0.04 2.20 -0.12 -0.85 -3.89 117.98 113.85 2a3y s PHE 33 Ca 0.03 0.60 0.02 0.00 -0.05 0.00 0.00 56.93 57.53 2a3y s PHE 33 Cb -0.09 0.39 0.01 0.00 -0.63 0.00 0.00 43.02 42.71 2a3y s PHE 33 CO 0.02 -0.67 -0.08 0.99 -0.05 0.00 0.00 175.22 175.43 2a3y s THR 34 N -2.36 0.74 -0.14 -4.49 2.01 -0.56 -1.60 115.64 109.24 2a3y s THR 34 Ca -0.06 -0.28 0.01 0.00 0.31 0.00 0.00 61.69 61.68 2a3y s THR 34 Cb -0.01 -0.70 0.02 0.00 0.01 0.00 0.00 72.50 71.82 2a3y s THR 34 CO -0.01 0.25 -0.16 -0.22 -0.69 0.00 0.00 174.62 173.80 2a3y s LEU 35 N 0.60 1.79 -0.02 4.42 2.96 0.69 -0.79 118.68 128.34 2a3y s LEU 35 Ca -0.09 -0.50 0.06 0.00 -0.22 0.00 0.00 54.13 53.38 2a3y s LEU 35 Cb -0.13 -1.22 -0.02 0.00 0.50 0.00 0.00 46.19 45.33 2a3y s LEU 35 CO 0.01 -0.01 -0.21 0.00 -1.32 0.00 0.00 176.35 174.82 2a3y s PHE 37 N -0.49 -0.35 -0.10 0.00 -0.12 -0.15 -0.17 117.98 116.60 2a3y s PHE 37 Ca 0.08 0.04 -0.01 0.00 -0.05 0.00 0.00 56.93 56.99 2a3y s PHE 37 Cb -0.08 0.63 -0.03 0.00 -0.63 0.00 0.00 43.02 42.91 2a3y s PHE 37 CO -0.01 -0.99 -0.04 1.03 -0.05 0.00 0.00 175.22 175.16 2a3y s ARG 38 N -3.74 3.08 0.02 1.99 0.52 0.32 -0.72 118.95 120.42 2a3y s ARG 38 Ca 0.06 -0.50 0.02 0.00 -0.52 0.00 0.00 55.73 54.80 2a3y s ARG 38 Cb -0.03 -2.74 -0.01 0.00 0.52 0.00 0.00 34.95 32.68 2a3y s ARG 38 CO -0.03 0.56 -0.07 0.00 0.02 0.00 0.00 175.30 175.77 2a3y s ALA 39 N -0.50 0.56 -0.15 2.13 0.00 -0.02 -1.26 121.76 122.51 2a3y s ALA 39 Ca 0.08 -0.50 -0.04 0.00 0.00 0.00 0.00 51.96 51.50 2a3y s ALA 39 Cb -0.12 -0.06 0.07 0.00 0.00 0.00 0.00 23.12 23.01 2a3y s ALA 39 CO 0.02 0.07 0.14 -0.47 0.00 0.00 0.00 175.76 175.52 2a3y s TYR 40 N -0.70 -0.02 -0.06 0.00 5.04 -0.05 -0.64 117.35 120.93 2a3y s TYR 40 Ca -0.03 0.05 -0.14 0.00 -2.44 0.00 0.00 57.07 54.51 2a3y s TYR 40 Cb -0.06 -0.50 0.03 0.00 0.35 0.00 0.00 41.96 41.78 2a3y s TYR 40 CO 0.00 -0.47 0.32 0.45 -1.34 0.00 0.00 175.55 174.51 2a3y s SER 41 N 2.22 -0.25 -0.24 4.32 0.15 -1.26 -0.64 113.70 118.01 2a3y s SER 41 Ca 0.04 0.30 0.13 0.00 0.70 0.00 0.00 55.95 57.13 2a3y s SER 41 Cb -0.15 0.45 0.53 0.00 -1.71 0.00 0.00 66.02 65.14 2a3y s SER 41 CO -0.09 -0.32 1.47 -0.90 1.20 0.00 0.00 173.24 174.60 2a3y n ASP 42 N 1.88 3.37 -4.75 5.45 5.68 -1.26 -4.57 116.55 122.35 2a3y n ASP 42 Ca -0.18 -3.33 -0.41 0.00 -0.50 0.00 0.00 54.79 50.37 2a3y n ASP 42 Cb 0.57 -0.60 -0.03 0.00 -1.14 0.00 0.00 41.12 39.92 2a3y n ASP 42 CO 0.00 0.00 0.00 -0.76 -1.33 0.00 0.00 177.20 175.11 2a3y s LEU 43 N -3.01 4.47 -0.15 -2.12 1.43 -1.26 -4.95 118.68 113.09 2a3y s LEU 43 Ca 0.44 2.38 0.17 0.00 -1.03 0.00 0.00 54.13 56.08 2a3y s LEU 43 Cb 0.37 -3.62 -0.24 0.00 0.03 0.00 0.00 46.19 42.73 2a3y s LEU 43 CO 0.06 -0.37 0.26 -1.20 0.23 0.00 0.00 176.35 175.32 2a3y n SER 44 N 1.79 0.25 -4.73 2.29 7.64 -1.26 -4.92 113.62 114.68 2a3y n SER 44 Ca 0.02 0.12 -0.29 0.00 1.01 0.00 0.00 58.87 59.73 2a3y n SER 44 Cb 0.44 0.73 0.16 0.00 -1.01 0.00 0.00 64.21 64.53 2a3y n SER 44 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 2a3y s ARG 45 N -2.56 0.80 0.51 1.43 1.70 -1.26 -4.58 118.95 114.99 2a3y s ARG 45 Ca -0.08 0.44 -0.21 0.00 -0.47 0.00 0.00 55.73 55.40 2a3y s ARG 45 Cb 0.07 -1.79 -0.06 0.00 -0.57 0.00 0.00 34.95 32.60 2a3y s ARG 45 CO 0.83 -2.46 1.19 0.00 -1.08 0.00 0.00 175.30 173.78 2a3y s ALA 46 N -3.10 2.82 0.08 7.88 0.00 -1.23 -4.79 121.76 123.43 2a3y s ALA 46 Ca 0.64 0.98 -0.16 0.00 0.00 0.00 0.00 51.96 53.42 2a3y s ALA 46 Cb -0.17 -3.42 0.03 0.00 0.00 0.00 0.00 23.12 19.57 2a3y s ALA 46 CO 0.56 -0.87 0.39 1.52 0.00 0.00 0.00 175.76 177.36 2a3y s TYR 47 N -1.56 -0.21 -0.02 0.00 -0.85 -0.56 -4.43 117.35 109.72 2a3y s TYR 47 Ca 0.69 0.01 -0.22 0.00 -0.52 0.00 0.00 57.07 57.04 2a3y s TYR 47 Cb -0.30 0.22 -0.05 0.00 0.38 0.00 0.00 41.96 42.21 2a3y s TYR 47 CO 0.35 -0.63 0.63 0.45 -1.52 0.00 0.00 175.55 174.83 2a3y s SER 48 N -2.43 6.98 -0.21 -0.18 0.15 -0.55 -1.04 113.70 116.42 2a3y s SER 48 Ca -0.01 1.17 0.03 0.00 0.70 0.00 0.00 55.95 57.84 2a3y s SER 48 Cb 0.01 -2.38 -0.20 0.00 -1.71 0.00 0.00 66.02 61.73 2a3y s SER 48 CO -0.07 0.03 -0.03 0.18 1.20 0.00 0.00 173.24 174.54 2a3y n LEU 49 N 3.08 2.45 -3.47 3.45 4.77 -0.21 -4.29 117.00 122.78 2a3y n LEU 49 Ca -0.05 -0.03 -0.11 0.00 -0.03 0.00 0.00 56.01 55.80 2a3y n LEU 49 Cb 0.51 -0.74 -0.10 0.00 -2.33 0.00 0.00 43.42 40.77 2a3y n LEU 49 CO 0.45 0.85 -0.07 0.12 -1.33 0.00 0.00 177.39 177.40 2a3y s PHE 50 N -2.53 -0.69 -0.19 -1.77 5.36 -1.12 -4.60 117.98 112.44 2a3y s PHE 50 Ca -0.28 0.91 -0.01 0.00 -0.96 0.00 0.00 56.93 56.59 2a3y s PHE 50 Cb 0.08 0.02 0.00 0.00 -0.34 0.00 0.00 43.02 42.78 2a3y s PHE 50 CO 0.67 -0.61 -0.13 0.45 -1.46 0.00 0.00 175.22 174.15 2a3y s SER 51 N 2.51 3.71 -0.25 6.13 0.15 -0.80 -1.04 113.70 124.11 2a3y s SER 51 Ca 0.07 -0.51 -0.01 0.00 0.70 0.00 0.00 55.95 56.21 2a3y s SER 51 Cb -0.14 -1.60 0.07 0.00 -1.71 0.00 0.00 66.02 62.64 2a3y s SER 51 CO -0.14 0.01 0.03 -0.47 1.20 0.00 0.00 173.24 173.87 2a3y s TYR 52 N 1.25 1.77 0.12 3.44 6.14 0.06 -0.02 117.35 130.12 2a3y s TYR 52 Ca 0.03 -1.49 0.10 0.00 0.64 0.00 0.00 57.07 56.35 2a3y s TYR 52 Cb -0.14 -1.48 -0.04 0.00 0.42 0.00 0.00 41.96 40.72 2a3y s TYR 52 CO -0.06 -0.75 -0.20 -0.80 0.64 0.00 0.00 175.55 174.37 2a3y s ASN 53 N 1.60 3.74 0.42 4.32 -0.87 -0.77 -1.17 114.94 122.22 2a3y s ASN 53 Ca 0.01 -0.61 0.07 0.00 -1.57 0.00 0.00 52.86 50.76 2a3y s ASN 53 Cb -0.18 -0.46 -0.06 0.00 -0.02 0.00 0.00 41.25 40.53 2a3y s ASN 53 CO -0.12 0.18 0.11 0.42 -2.57 0.00 0.00 177.10 175.11 2a3y s THR 54 N -1.14 2.11 0.04 1.60 -4.23 -0.95 -0.64 115.64 112.42 2a3y s THR 54 Ca 0.17 -1.83 -0.32 0.00 -1.18 0.00 0.00 61.69 58.52 2a3y s THR 54 Cb -0.10 -2.94 -0.11 0.00 1.34 0.00 0.00 72.50 70.68 2a3y s THR 54 CO 0.09 0.00 1.83 1.67 -0.54 0.00 0.00 174.62 177.68 2a3y n GLN 55 N -1.14 2.49 -0.85 3.99 -0.06 -1.26 -0.95 117.38 119.60 2a3y n GLN 55 Ca -0.04 0.91 0.00 0.00 -2.00 0.00 0.00 57.00 55.87 2a3y n GLN 55 Cb 0.66 -2.78 0.00 0.00 -4.06 0.00 0.00 30.24 24.06 2a3y n GLN 55 CO 0.00 0.00 0.00 0.41 -0.20 0.00 0.00 177.06 177.27 2a3y n GLY 56 N 4.21 0.51 2.85 1.69 0.00 -1.26 -4.97 105.19 108.23 2a3y n GLY 56 Ca 0.20 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.92 2a3y n GLY 56 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2a3y s ARG 57 N -0.52 1.17 0.45 1.61 3.00 -0.12 -5.12 118.95 119.42 2a3y s ARG 57 Ca 0.00 -0.99 -0.20 0.00 0.00 0.00 0.00 55.73 54.54 2a3y s ARG 57 Cb 0.00 -2.40 -0.10 0.00 0.00 0.00 0.00 34.95 32.44 2a3y s ARG 57 CO 0.00 -0.74 0.96 0.34 0.00 0.00 0.00 175.30 175.85 2a3y s ASP 58 N 1.49 6.87 -1.55 0.23 2.15 -1.26 -2.25 116.67 122.35 2a3y s ASP 58 Ca 0.01 1.66 -0.11 0.00 0.43 0.00 0.00 52.55 54.54 2a3y s ASP 58 Cb -0.18 -2.53 0.09 0.00 -0.30 0.00 0.00 42.92 39.99 2a3y s ASP 58 CO -0.12 -0.41 0.77 0.59 -0.17 0.00 0.00 175.17 175.83 2a3y n ASN 59 N -0.86 -2.99 -0.10 -0.34 3.02 -1.26 -4.31 115.26 108.41 2a3y n ASN 59 Ca 0.07 -0.91 -0.10 0.00 -0.03 0.00 0.00 54.58 53.60 2a3y n ASN 59 Cb 0.54 -3.33 -0.03 0.00 -0.61 0.00 0.00 39.78 36.35 2a3y n ASN 59 CO 0.00 0.00 0.00 -0.08 -2.62 0.00 0.00 177.26 174.56 2a3y h GLU 60 N -1.81 0.52 -2.77 3.52 4.57 -1.69 -0.77 114.58 116.15 2a3y h GLU 60 Ca -0.60 -0.14 -0.30 0.00 -1.18 0.00 0.00 59.36 57.14 2a3y h GLU 60 Cb 1.38 -0.06 -0.36 0.00 -0.16 0.00 0.00 28.75 29.55 2a3y h GLU 60 CO 0.69 0.62 -0.62 -1.17 -1.18 0.00 0.00 179.01 177.35 2a3y s LEU 61 N -9.57 -0.11 -0.03 1.64 1.98 -0.32 -0.71 118.68 111.56 2a3y s LEU 61 Ca -0.13 0.05 -0.01 0.00 -2.89 0.00 0.00 54.13 51.15 2a3y s LEU 61 Cb 0.09 0.37 0.03 0.00 0.66 0.00 0.00 46.19 47.34 2a3y s LEU 61 CO 0.75 -0.29 0.03 -0.22 -1.89 0.00 0.00 176.35 174.74 2a3y s LEU 62 N 2.32 0.82 -0.28 -0.68 2.96 -0.80 -0.76 118.68 122.26 2a3y s LEU 62 Ca 0.05 0.04 -0.10 0.00 -0.22 0.00 0.00 54.13 53.89 2a3y s LEU 62 Cb -0.14 -0.12 -0.04 0.00 0.50 0.00 0.00 46.19 46.39 2a3y s LEU 62 CO -0.09 -0.16 0.16 -0.69 -1.32 0.00 0.00 176.35 174.24 2a3y s VAL 63 N 1.39 4.94 -0.06 1.68 1.01 -0.21 -0.43 120.40 128.72 2a3y s VAL 63 Ca -0.05 -0.04 -0.00 0.00 0.00 0.00 0.00 61.98 61.89 2a3y s VAL 63 Cb -0.13 -3.38 0.02 0.00 0.00 0.00 0.00 36.38 32.90 2a3y s VAL 63 CO -0.03 0.23 -0.03 -0.47 0.00 0.00 0.00 175.10 174.80 2a3y s TYR 64 N 1.70 0.83 -0.44 5.22 5.04 -0.56 -1.04 117.35 128.10 2a3y s TYR 64 Ca 0.06 -0.27 -0.20 0.00 -2.44 0.00 0.00 57.07 54.22 2a3y s TYR 64 Cb -0.16 -0.81 0.03 0.00 0.35 0.00 0.00 41.96 41.37 2a3y s TYR 64 CO 0.08 -0.29 0.60 0.21 -1.34 0.00 0.00 175.55 174.82 2a3y s LYS 65 N 1.44 3.23 0.01 4.97 2.47 -0.20 -0.65 119.74 131.00 2a3y s LYS 65 Ca -0.03 -0.49 -0.24 0.00 -1.56 0.00 0.00 55.97 53.65 2a3y s LYS 65 Cb -0.13 -3.97 -0.18 0.00 -1.46 0.00 0.00 37.83 32.09 2a3y s LYS 65 CO -0.03 -1.00 1.34 0.93 0.16 0.00 0.00 175.35 176.74 2a3y h GLU 66 N 8.86 0.11 -2.47 4.03 4.39 -1.80 -1.49 114.58 126.22 2a3y h GLU 66 Ca -0.26 -0.05 0.16 0.00 0.34 0.00 0.00 59.36 59.55 2a3y h GLU 66 Cb 1.10 -0.00 -0.05 0.00 -0.10 0.00 0.00 28.75 29.69 2a3y h GLU 66 CO 0.88 0.52 0.51 -0.98 -1.16 0.00 0.00 179.01 178.78 2a3y s ARG 67 N -4.46 1.33 0.17 2.33 1.70 -1.26 -3.55 118.95 115.21 2a3y s ARG 67 Ca -0.15 -0.80 -0.33 0.00 -0.47 0.00 0.00 55.73 53.98 2a3y s ARG 67 Cb 0.03 0.41 -0.15 0.00 -0.57 0.00 0.00 34.95 34.67 2a3y s ARG 67 CO 0.70 -0.61 1.38 0.28 -1.08 0.00 0.00 175.30 175.96 2a3y n VAL 68 N -0.57 0.50 -1.04 4.99 0.31 -1.26 -2.11 118.33 119.15 2a3y n VAL 68 Ca -0.05 -0.13 -0.01 0.00 -0.01 0.00 0.00 64.34 64.14 2a3y n VAL 68 Cb 0.60 -1.20 -0.01 0.00 -0.91 0.00 0.00 33.84 32.32 2a3y n VAL 68 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 2a3y n GLY 69 N 2.51 0.50 2.75 2.92 0.00 -1.26 -5.00 105.19 107.61 2a3y n GLY 69 Ca 0.15 -0.31 -0.24 0.00 0.00 0.00 0.00 46.02 45.62 2a3y n GLY 69 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2a3y s GLU 70 N -1.07 0.58 -0.12 1.61 2.02 -0.90 -1.08 118.70 119.74 2a3y s GLU 70 Ca 0.00 -0.02 0.02 0.00 0.02 0.00 0.00 54.97 54.99 2a3y s GLU 70 Cb 0.00 -1.28 -0.00 0.00 0.10 0.00 0.00 34.13 32.95 2a3y s GLU 70 CO 0.00 -0.40 -0.19 0.71 0.02 0.00 0.00 175.26 175.40 2a3y s TYR 71 N 1.96 2.68 -0.00 1.61 1.51 -0.47 -2.78 117.35 121.86 2a3y s TYR 71 Ca 0.03 -0.99 0.04 0.00 -1.01 0.00 0.00 57.07 55.14 2a3y s TYR 71 Cb -0.14 -1.79 -0.03 0.00 -0.11 0.00 0.00 41.96 39.89 2a3y s TYR 71 CO -0.06 -0.41 -0.09 -1.12 -1.11 0.00 0.00 175.55 172.76 2a3y s SER 72 N 0.51 4.45 -0.10 2.29 0.01 0.18 -1.12 113.70 119.91 2a3y s SER 72 Ca -0.13 -0.18 0.04 0.00 1.31 0.00 0.00 55.95 56.99 2a3y s SER 72 Cb -0.17 -0.99 -0.00 0.00 0.21 0.00 0.00 66.02 65.07 2a3y s SER 72 CO 0.05 0.29 -0.24 -0.22 0.41 0.00 0.00 173.24 173.53 2a3y s LEU 73 N -1.30 2.10 -0.18 2.44 2.96 -0.00 -1.50 118.68 123.20 2a3y s LEU 73 Ca 0.16 -0.56 -0.07 0.00 -0.22 0.00 0.00 54.13 53.44 2a3y s LEU 73 Cb -0.11 -1.41 -0.04 0.00 0.50 0.00 0.00 46.19 45.13 2a3y s LEU 73 CO 0.06 0.16 0.05 -0.31 -1.32 0.00 0.00 176.35 174.99 2a3y s TYR 74 N 0.35 3.23 -0.17 5.38 1.51 0.43 -1.10 117.35 126.97 2a3y s TYR 74 Ca -0.19 0.03 0.01 0.00 -1.01 0.00 0.00 57.07 55.91 2a3y s TYR 74 Cb -0.18 -2.07 0.02 0.00 -0.11 0.00 0.00 41.96 39.62 2a3y s TYR 74 CO 0.09 0.13 -0.16 0.42 -1.11 0.00 0.00 175.55 174.92 2a3y s ILE 75 N 0.39 1.81 -1.45 2.71 -1.09 0.12 -1.90 121.20 121.78 2a3y s ILE 75 Ca 0.02 -0.84 -0.02 0.00 -2.23 0.00 0.00 60.65 57.58 2a3y s ILE 75 Cb -0.13 -1.70 0.02 0.00 -1.58 0.00 0.00 42.46 39.07 2a3y s ILE 75 CO 0.00 0.44 0.40 0.61 -1.23 0.00 0.00 174.94 175.17 2a3y n GLY 76 N 4.68 -0.23 3.97 6.18 0.00 0.11 -1.32 105.19 118.58 2a3y n GLY 76 Ca -0.18 0.15 0.00 0.00 0.00 0.00 0.00 46.02 45.99 2a3y n GLY 76 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2a3y n ARG 77 N -4.42 0.00 -2.81 1.61 1.74 -0.30 -4.97 116.66 107.51 2a3y n ARG 77 Ca -0.28 0.00 -0.33 0.00 -0.77 0.00 0.00 57.85 56.48 2a3y n ARG 77 Cb 0.67 -1.18 -0.06 0.00 -1.02 0.00 0.00 32.46 30.87 2a3y n ARG 77 CO 0.00 0.00 0.00 -1.01 -1.52 0.00 0.00 177.63 175.10 2a3y s HIS 78 N -1.12 3.35 -0.01 -1.55 3.76 -0.44 -5.04 115.29 114.26 2a3y s HIS 78 Ca 0.00 1.49 0.04 0.00 -0.15 0.00 0.00 55.06 56.43 2a3y s HIS 78 Cb 0.00 -2.76 -0.01 0.00 1.11 0.00 0.00 32.58 30.92 2a3y s HIS 78 CO 0.00 -0.12 -0.12 0.21 -0.85 0.00 0.00 174.74 173.87 2a3y s LYS 79 N -3.33 0.93 0.12 1.40 2.20 -1.26 -0.71 119.74 119.10 2a3y s LYS 79 Ca 0.60 -0.43 0.09 0.00 -0.36 0.00 0.00 55.97 55.86 2a3y s LYS 79 Cb -0.09 -0.90 -0.04 0.00 -1.51 0.00 0.00 37.83 35.29 2a3y s LYS 79 CO 0.18 0.25 -0.21 0.14 -0.36 0.00 0.00 175.35 175.35 2a3y s VAL 80 N -0.30 1.79 -0.02 4.02 -7.23 -0.26 -5.00 120.40 113.40 2a3y s VAL 80 Ca 0.04 -1.66 0.02 0.00 -1.81 0.00 0.00 61.98 58.57 2a3y s VAL 80 Cb -0.05 -1.67 0.00 0.00 0.56 0.00 0.00 36.38 35.23 2a3y s VAL 80 CO -0.00 -0.11 -0.06 -0.89 -0.31 0.00 0.00 175.10 173.73 2a3y s THR 81 N -1.38 0.50 0.08 5.32 2.01 -1.26 -0.82 115.64 120.09 2a3y s THR 81 Ca 0.09 -0.21 0.06 0.00 0.31 0.00 0.00 61.69 61.94 2a3y s THR 81 Cb -0.09 -0.46 -0.03 0.00 0.01 0.00 0.00 72.50 71.93 2a3y s THR 81 CO 0.05 0.17 -0.15 -0.44 -0.69 0.00 0.00 174.62 173.56 2a3y s SER 82 N 0.22 1.80 0.13 3.53 0.01 -0.28 -4.98 113.70 114.13 2a3y s SER 82 Ca -0.02 -0.64 0.05 0.00 1.31 0.00 0.00 55.95 56.64 2a3y s SER 82 Cb -0.07 -0.06 -0.04 0.00 0.21 0.00 0.00 66.02 66.06 2a3y s SER 82 CO -0.00 -0.07 0.09 -0.54 0.41 0.00 0.00 173.24 173.13 2a3y s LYS 83 N -1.86 2.79 -0.07 12.44 1.02 -1.26 -1.36 119.74 131.44 2a3y s LYS 83 Ca -0.00 -0.85 -0.18 0.00 0.02 0.00 0.00 55.97 54.97 2a3y s LYS 83 Cb -0.09 -2.62 0.04 0.00 -0.52 0.00 0.00 37.83 34.63 2a3y s LYS 83 CO 0.03 0.51 0.41 0.54 -0.92 0.00 0.00 175.35 175.92 2a3y s VAL 84 N -1.60 0.03 -0.14 3.17 0.11 -0.24 -4.69 120.40 117.04 2a3y s VAL 84 Ca 0.29 -0.25 -0.29 0.00 -2.93 0.00 0.00 61.98 58.80 2a3y s VAL 84 Cb -0.11 -0.68 -0.01 0.00 -1.53 0.00 0.00 36.38 34.05 2a3y s VAL 84 CO 0.22 -0.14 1.10 -0.63 -3.33 0.00 0.00 175.10 172.33 2a3y s ILE 85 N -0.82 4.55 -0.00 7.04 1.01 -1.26 -4.43 121.20 127.29 2a3y s ILE 85 Ca -0.09 1.85 -0.13 0.00 0.00 0.00 0.00 60.65 62.28 2a3y s ILE 85 Cb -0.04 -4.19 0.02 0.00 0.01 0.00 0.00 42.46 38.26 2a3y s ILE 85 CO 0.04 -0.07 0.28 -1.83 0.00 0.00 0.00 174.94 173.36 2a3y s GLU 86 N 2.62 0.66 0.44 2.79 -1.05 -1.26 -5.07 118.70 117.83 2a3y s GLU 86 Ca 0.50 -0.28 -0.21 0.00 -0.15 0.00 0.00 54.97 54.83 2a3y s GLU 86 Cb -0.19 0.29 -0.11 0.00 -0.44 0.00 0.00 34.13 33.68 2a3y s GLU 86 CO 0.15 -0.18 0.96 0.15 0.95 0.00 0.00 175.26 177.28 2a3y s LYS 87 N -1.55 4.18 -0.04 -4.83 1.02 -1.26 -4.87 119.74 112.39 2a3y s LYS 87 Ca -0.12 1.12 0.00 0.00 0.02 0.00 0.00 55.97 56.99 2a3y s LYS 87 Cb -0.05 -2.17 0.02 0.00 -0.52 0.00 0.00 37.83 35.12 2a3y s LYS 87 CO 0.03 -0.07 -0.02 0.12 -0.92 0.00 0.00 175.35 174.49 2a3y s PHE 88 N -2.21 0.55 0.35 3.18 5.36 -1.26 -3.38 117.98 120.57 2a3y s PHE 88 Ca 0.62 -0.11 -0.17 0.00 -0.96 0.00 0.00 56.93 56.31 2a3y s PHE 88 Cb -0.09 -0.59 -0.10 0.00 -0.34 0.00 0.00 43.02 41.90 2a3y s PHE 88 CO 0.15 -0.19 0.79 -1.25 -1.46 0.00 0.00 175.22 173.26 2a3y s PRO 89 N 1.19 4.06 -0.08 10.12 0.05 -1.26 -5.19 135.00 143.89 2a3y s PRO 89 Ca -0.07 0.79 -0.14 0.00 0.05 0.00 0.00 61.00 61.63 2a3y s PRO 89 Cb -0.14 -2.36 0.03 0.00 0.05 0.00 0.00 34.50 32.08 2a3y s PRO 89 CO -0.02 0.11 0.35 0.00 0.05 0.00 0.00 177.00 177.49 2a3y s ALA 90 N -2.04 -0.89 0.55 8.56 0.00 -1.22 -5.10 121.76 121.62 2a3y s ALA 90 Ca 0.56 0.73 -0.22 0.00 0.00 0.00 0.00 51.96 53.04 2a3y s ALA 90 Cb -0.10 -0.28 -0.05 0.00 0.00 0.00 0.00 23.12 22.69 2a3y s ALA 90 CO 0.16 -0.22 1.36 -2.14 0.00 0.00 0.00 175.76 174.92 2a3y s PRO 91 N -0.54 3.15 -0.01 0.00 0.02 -1.26 -4.62 135.00 131.74 2a3y s PRO 91 Ca -0.06 2.23 -0.02 0.00 0.02 0.00 0.00 61.00 63.17 2a3y s PRO 91 Cb -0.04 -2.26 -0.00 0.00 0.02 0.00 0.00 34.50 32.22 2a3y s PRO 91 CO 0.03 -1.18 0.04 0.54 -0.33 0.00 0.00 177.00 176.09 2a3y s VAL 92 N -1.31 0.04 -0.24 3.83 0.11 0.19 -5.01 120.40 118.01 2a3y s VAL 92 Ca 0.71 -0.29 -0.08 0.00 -2.93 0.00 0.00 61.98 59.39 2a3y s VAL 92 Cb -0.40 -0.16 -0.04 0.00 -1.53 0.00 0.00 36.38 34.25 2a3y s VAL 92 CO 0.48 -0.16 0.10 -2.28 -3.33 0.00 0.00 175.10 169.91 2a3y s HIS 93 N -0.48 3.17 -0.16 1.54 2.46 -1.26 -0.84 115.29 119.72 2a3y s HIS 93 Ca -0.05 -0.13 -0.01 0.00 0.47 0.00 0.00 55.06 55.34 2a3y s HIS 93 Cb -0.03 -2.23 -0.01 0.00 -0.13 0.00 0.00 32.58 30.18 2a3y s HIS 93 CO -0.00 -0.16 -0.13 0.42 -2.47 0.00 0.00 174.74 172.40 2a3y s ILE 94 N 1.30 2.88 -0.06 0.89 1.01 0.10 -0.69 121.20 126.64 2a3y s ILE 94 Ca 0.06 -0.70 0.06 0.00 0.00 0.00 0.00 60.65 60.07 2a3y s ILE 94 Cb -0.15 -2.23 -0.01 0.00 0.01 0.00 0.00 42.46 40.08 2a3y s ILE 94 CO 0.05 0.50 -0.25 0.00 0.00 0.00 0.00 174.94 175.24 2a3y s VAL 96 N -0.14 0.19 0.18 0.00 0.11 0.76 0.38 120.40 121.88 2a3y s VAL 96 Ca -0.04 0.12 0.11 0.00 -2.93 0.00 0.00 61.98 59.24 2a3y s VAL 96 Cb -0.14 -0.31 -0.04 0.00 -1.53 0.00 0.00 36.38 34.36 2a3y s VAL 96 CO 0.04 0.17 -0.24 -0.94 -3.33 0.00 0.00 175.10 170.80 2a3y s SER 97 N 1.28 3.44 -0.08 3.54 1.04 -0.40 -0.22 113.70 122.30 2a3y s SER 97 Ca -0.06 -0.83 -0.06 0.00 0.48 0.00 0.00 55.95 55.48 2a3y s SER 97 Cb -0.13 -0.27 0.03 0.00 0.10 0.00 0.00 66.02 65.75 2a3y s SER 97 CO -0.02 0.14 0.19 0.86 0.98 0.00 0.00 173.24 175.38 2a3y s TRP 98 N -1.52 -0.22 -0.16 5.02 -0.00 -0.63 -0.51 118.94 120.93 2a3y s TRP 98 Ca 0.19 0.54 0.00 0.00 -0.00 0.00 0.00 56.10 56.84 2a3y s TRP 98 Cb -0.08 0.05 0.03 0.00 -0.00 0.00 0.00 33.47 33.46 2a3y s TRP 98 CO 0.09 -0.13 -0.13 -2.00 -0.00 0.00 0.00 176.95 174.78 2a3y s GLU 99 N 0.42 2.26 0.18 5.86 2.12 -0.92 -2.02 118.70 126.61 2a3y s GLU 99 Ca -0.03 -0.63 -0.13 0.00 0.36 0.00 0.00 54.97 54.54 2a3y s GLU 99 Cb -0.04 -2.19 0.10 0.00 0.26 0.00 0.00 34.13 32.26 2a3y s GLU 99 CO -0.02 -0.28 1.83 1.03 -0.54 0.00 0.00 175.26 177.28 2a3y h SER 100 N 8.03 0.58 -0.67 -1.70 0.87 -1.04 0.34 113.55 119.95 2a3y h SER 100 Ca -0.36 -0.00 0.03 0.00 -1.23 0.00 0.00 61.79 60.23 2a3y h SER 100 Cb 1.13 -0.13 -0.04 0.00 -0.44 0.00 0.00 62.40 62.92 2a3y h SER 100 CO 0.52 0.41 0.44 0.77 -0.53 0.00 0.00 176.83 178.45 2a3y h SER 101 N 0.70 0.70 0.00 6.23 4.64 -1.91 0.89 113.55 124.80 2a3y h SER 101 Ca 0.22 -0.01 -0.06 0.00 -0.47 0.00 0.00 61.79 61.47 2a3y h SER 101 Cb -0.02 -0.16 -0.01 0.00 -0.31 0.00 0.00 62.40 61.90 2a3y h SER 101 CO -0.08 0.49 -1.93 -1.54 -0.87 0.00 0.00 176.83 172.90 2a3y n SER 102 N -4.46 0.67 0.00 4.97 3.41 -1.18 -4.64 113.62 112.40 2a3y n SER 102 Ca 0.08 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.69 2a3y n SER 102 Cb 0.12 1.69 0.00 0.00 -0.26 0.00 0.00 64.21 65.76 2a3y n SER 102 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2a3y n GLY 103 N 1.52 1.08 3.70 5.00 0.00 0.12 -4.80 105.19 111.80 2a3y n GLY 103 Ca -0.08 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.52 2a3y n GLY 103 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2a3y s ILE 104 N -3.66 3.46 -0.15 -0.61 -1.09 -1.18 -0.52 121.20 117.44 2a3y s ILE 104 Ca 0.00 0.96 -0.05 0.00 -2.23 0.00 0.00 60.65 59.33 2a3y s ILE 104 Cb 0.00 -3.62 -0.03 0.00 -1.58 0.00 0.00 42.46 37.23 2a3y s ILE 104 CO 0.00 0.03 0.01 0.00 -1.23 0.00 0.00 174.94 173.75 2a3y s ALA 105 N 1.83 3.22 -0.28 9.38 0.00 0.19 -2.17 121.76 133.94 2a3y s ALA 105 Ca 0.65 -0.78 0.02 0.00 0.00 0.00 0.00 51.96 51.85 2a3y s ALA 105 Cb -0.35 -1.68 0.08 0.00 0.00 0.00 0.00 23.12 21.17 2a3y s ALA 105 CO 0.29 0.29 -0.02 -1.21 0.00 0.00 0.00 175.76 175.10 2a3y s GLU 106 N 0.08 1.66 -0.03 0.00 2.02 0.34 -2.46 118.70 120.30 2a3y s GLU 106 Ca 0.02 -1.37 -0.18 0.00 0.02 0.00 0.00 54.97 53.47 2a3y s GLU 106 Cb -0.13 -2.80 -0.05 0.00 0.10 0.00 0.00 34.13 31.25 2a3y s GLU 106 CO 0.02 -0.73 0.49 -0.06 0.02 0.00 0.00 175.26 174.99 2a3y s PHE 107 N 1.19 3.66 -0.13 1.61 0.08 -1.26 -1.28 117.98 121.84 2a3y s PHE 107 Ca -0.00 1.03 0.00 0.00 0.12 0.00 0.00 56.93 58.09 2a3y s PHE 107 Cb -0.19 -2.47 0.02 0.00 -0.57 0.00 0.00 43.02 39.82 2a3y s PHE 107 CO -0.08 0.42 -0.13 -1.58 -0.10 0.00 0.00 175.22 173.75 2a3y s TRP 108 N -0.34 2.00 -0.26 0.36 0.52 0.16 -0.91 118.94 120.47 2a3y s TRP 108 Ca 0.26 -1.07 -0.03 0.00 0.02 0.00 0.00 56.10 55.28 2a3y s TRP 108 Cb -0.17 -1.49 0.02 0.00 -1.15 0.00 0.00 33.47 30.68 2a3y s TRP 108 CO 0.14 -0.61 -0.03 0.42 0.02 0.00 0.00 176.95 176.89 2a3y s ILE 109 N 1.45 3.08 -1.47 2.03 -1.09 0.48 -0.69 121.20 124.98 2a3y s ILE 109 Ca 0.03 -0.97 -0.12 0.00 -2.23 0.00 0.00 60.65 57.37 2a3y s ILE 109 Cb -0.13 -2.57 0.06 0.00 -1.58 0.00 0.00 42.46 38.24 2a3y s ILE 109 CO -0.09 0.17 1.02 0.59 -1.23 0.00 0.00 174.94 175.40 2a3y n ASN 110 N 4.70 -4.95 0.00 3.58 3.02 0.13 -1.56 115.26 120.19 2a3y n ASN 110 Ca -0.16 -0.72 0.00 0.00 -0.03 0.00 0.00 54.58 53.67 2a3y n ASN 110 Cb 0.47 -4.20 0.00 0.00 -0.61 0.00 0.00 39.78 35.44 2a3y n ASN 110 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2a3y n GLY 111 N -1.76 0.46 3.49 7.41 0.00 -1.26 -5.01 105.19 108.52 2a3y n GLY 111 Ca 0.01 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.68 2a3y n GLY 111 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2a3y s THR 112 N -2.09 4.07 0.08 2.61 2.01 -0.60 -4.95 115.64 116.77 2a3y s THR 112 Ca 0.00 -0.28 -0.30 0.00 0.31 0.00 0.00 61.69 61.42 2a3y s THR 112 Cb 0.00 -2.82 -0.06 0.00 0.01 0.00 0.00 72.50 69.63 2a3y s THR 112 CO 0.00 0.45 1.13 -2.16 -0.69 0.00 0.00 174.62 173.35 2a3y s PRO 113 N 0.73 4.50 0.73 4.92 0.04 -1.26 -0.39 135.00 144.27 2a3y s PRO 113 Ca 0.00 1.69 -0.07 0.00 0.04 0.00 0.00 61.00 62.67 2a3y s PRO 113 Cb -0.14 -3.35 0.08 0.00 0.04 0.00 0.00 34.50 31.14 2a3y s PRO 113 CO 0.02 -0.13 1.04 -0.51 0.04 0.00 0.00 177.00 177.47 2a3y s LEU 114 N 0.66 2.83 0.12 -3.56 1.43 -0.09 -4.94 118.68 115.13 2a3y s LEU 114 Ca 0.55 0.34 -0.31 0.00 -1.03 0.00 0.00 54.13 53.68 2a3y s LEU 114 Cb -0.28 -2.89 -0.09 0.00 0.03 0.00 0.00 46.19 42.96 2a3y s LEU 114 CO 0.31 -1.75 1.67 -0.69 0.23 0.00 0.00 176.35 176.12 2a3y s VAL 115 N -3.30 2.73 0.35 -1.59 1.01 -1.26 -4.73 120.40 113.61 2a3y s VAL 115 Ca 0.62 0.34 -0.28 0.00 0.00 0.00 0.00 61.98 62.66 2a3y s VAL 115 Cb -0.09 -3.22 -0.11 0.00 0.00 0.00 0.00 36.38 32.96 2a3y s VAL 115 CO 0.45 0.01 1.42 -0.54 0.00 0.00 0.00 175.10 176.44 2a3y s LYS 116 N 2.14 4.21 0.36 2.72 1.02 -1.26 -4.78 119.74 124.14 2a3y s LYS 116 Ca 0.74 2.43 0.04 0.00 0.02 0.00 0.00 55.97 59.20 2a3y s LYS 116 Cb -0.43 -3.01 -0.06 0.00 -0.52 0.00 0.00 37.83 33.81 2a3y s LYS 116 CO 0.33 -0.40 0.06 0.15 -0.92 0.00 0.00 175.35 174.57 2a3y s LYS 117 N -1.91 1.75 0.00 1.68 -0.14 -1.03 -4.99 119.74 115.10 2a3y s LYS 117 Ca 0.52 -2.00 0.00 0.00 -1.36 0.00 0.00 55.97 53.13 2a3y s LYS 117 Cb -0.44 -0.92 -0.00 0.00 -1.68 0.00 0.00 37.83 34.79 2a3y s LYS 117 CO 0.59 -0.24 -0.01 0.20 -0.76 0.00 0.00 175.35 175.12 2a3y s GLY 118 N -3.55 0.08 -0.04 -3.33 0.00 -1.26 0.55 107.32 99.78 2a3y s GLY 118 Ca 0.33 -0.12 -0.31 0.00 0.00 0.00 0.00 44.72 44.63 2a3y s GLY 118 CO 0.15 -0.12 0.68 0.48 0.00 0.00 0.00 173.10 174.29 2a3y s LEU 119 N -0.21 -0.65 -1.42 0.66 2.34 0.32 -4.97 118.68 114.76 2a3y s LEU 119 Ca -0.02 0.67 -0.02 0.00 0.06 0.00 0.00 54.13 54.83 2a3y s LEU 119 Cb -0.02 2.54 0.02 0.00 -0.56 0.00 0.00 46.19 48.17 2a3y s LEU 119 CO -0.00 -0.63 0.53 0.54 -1.06 0.00 0.00 176.35 175.73 2a3y n ARG 120 N 0.83 -3.74 -1.91 1.48 1.74 -1.26 -4.50 116.66 109.29 2a3y n ARG 120 Ca -0.19 0.46 -0.42 0.00 -0.77 0.00 0.00 57.85 56.93 2a3y n ARG 120 Cb 0.57 -4.76 -0.03 0.00 -1.02 0.00 0.00 32.46 27.23 2a3y n ARG 120 CO 0.00 0.00 0.00 -1.14 -1.52 0.00 0.00 177.63 174.97 2a3y s GLN 121 N -6.47 4.19 0.00 5.56 0.74 -1.26 -1.81 119.66 120.62 2a3y s GLN 121 Ca 0.10 2.35 0.00 0.00 0.05 0.00 0.00 55.36 57.86 2a3y s GLN 121 Cb -0.05 -3.55 0.00 0.00 1.10 0.00 0.00 33.01 30.51 2a3y s GLN 121 CO 0.87 -0.73 0.00 0.41 -0.55 0.00 0.00 175.29 175.29 2a3y n GLY 122 N 3.99 0.86 3.84 2.59 0.00 0.27 -4.97 105.19 111.78 2a3y n GLY 122 Ca 0.16 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.85 2a3y n GLY 122 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 173.32 172.85 2a3y s TYR 123 N -3.07 3.37 -0.19 1.61 5.04 -0.75 -5.02 117.35 118.34 2a3y s TYR 123 Ca 0.00 1.34 -0.02 0.00 -2.44 0.00 0.00 57.07 55.95 2a3y s TYR 123 Cb 0.00 -2.64 -0.01 0.00 0.35 0.00 0.00 41.96 39.66 2a3y s TYR 123 CO 0.00 -0.03 -0.08 -0.06 -1.34 0.00 0.00 175.55 174.04 2a3y s PHE 124 N -2.14 2.90 0.18 4.97 0.40 -1.26 -4.72 117.98 118.30 2a3y s PHE 124 Ca 0.57 -0.93 -0.30 0.00 -0.60 0.00 0.00 56.93 55.66 2a3y s PHE 124 Cb -0.10 -2.01 -0.08 0.00 0.51 0.00 0.00 43.02 41.34 2a3y s PHE 124 CO 0.19 -0.48 1.28 0.14 0.70 0.00 0.00 175.22 177.05 2a3y s VAL 125 N 1.13 3.36 0.54 -0.44 -7.23 -0.55 -4.83 120.40 112.38 2a3y s VAL 125 Ca 0.01 1.10 -0.21 0.00 -1.81 0.00 0.00 61.98 61.07 2a3y s VAL 125 Cb -0.14 -3.70 -0.05 0.00 0.56 0.00 0.00 36.38 33.04 2a3y s VAL 125 CO -0.02 0.15 1.23 -1.61 -0.31 0.00 0.00 175.10 174.54 2a3y s GLU 126 N 0.06 3.26 0.96 4.82 0.41 -1.26 -0.68 118.70 126.27 2a3y s GLU 126 Ca 0.57 1.90 -0.14 0.00 -0.41 0.00 0.00 54.97 56.88 2a3y s GLU 126 Cb -0.35 -2.15 0.17 0.00 -1.78 0.00 0.00 34.13 30.02 2a3y s GLU 126 CO 0.36 -0.99 1.17 0.00 -0.49 0.00 0.00 175.26 175.32 2a3y s ALA 127 N -1.52 1.73 -1.05 5.21 0.00 -1.26 -4.63 121.76 120.23 2a3y s ALA 127 Ca 0.72 -0.74 -0.06 0.00 0.00 0.00 0.00 51.96 51.88 2a3y s ALA 127 Cb -0.32 -2.95 -0.07 0.00 0.00 0.00 0.00 23.12 19.78 2a3y s ALA 127 CO 0.37 -2.49 0.92 1.04 0.00 0.00 0.00 175.76 175.59 2a3y n GLN 128 N -3.90 -2.23 -2.29 0.00 6.02 -1.26 -4.83 117.38 108.88 2a3y n GLN 128 Ca 0.09 0.87 -0.30 0.00 -0.01 0.00 0.00 57.00 57.65 2a3y n GLN 128 Cb 0.59 -5.82 -0.01 0.00 1.02 0.00 0.00 30.24 26.02 2a3y n GLN 128 CO 0.00 0.00 0.00 -1.25 -1.01 0.00 0.00 177.06 174.80 2a3y s PRO 129 N -4.40 3.70 -0.27 -1.09 0.04 -1.26 -4.53 135.00 127.19 2a3y s PRO 129 Ca 0.46 0.65 -0.09 0.00 0.04 0.00 0.00 61.00 62.06 2a3y s PRO 129 Cb -0.06 -2.20 -0.04 0.00 0.04 0.00 0.00 34.50 32.24 2a3y s PRO 129 CO 0.74 -0.35 0.14 0.15 0.04 0.00 0.00 177.00 177.72 2a3y s LYS 130 N -4.63 3.81 -0.19 4.56 -0.14 0.18 -4.96 119.74 118.37 2a3y s LYS 130 Ca 0.54 -0.40 -0.05 0.00 -1.36 0.00 0.00 55.97 54.70 2a3y s LYS 130 Cb -0.10 -3.52 -0.03 0.00 -1.68 0.00 0.00 37.83 32.50 2a3y s LYS 130 CO 0.43 -0.19 -0.00 0.42 -0.76 0.00 0.00 175.35 175.25 2a3y s ILE 131 N 1.70 3.99 -0.00 2.17 1.01 -1.25 -1.84 121.20 126.97 2a3y s ILE 131 Ca 0.07 -0.31 0.05 0.00 0.00 0.00 0.00 60.65 60.46 2a3y s ILE 131 Cb -0.16 -2.79 -0.01 0.00 0.01 0.00 0.00 42.46 39.51 2a3y s ILE 131 CO 0.08 0.44 -0.16 0.68 0.00 0.00 0.00 174.94 175.98 2a3y s VAL 132 N 0.83 1.30 -0.09 2.92 -7.23 0.97 -0.93 120.40 118.17 2a3y s VAL 132 Ca 0.00 -0.76 -0.00 0.00 -1.81 0.00 0.00 61.98 59.41 2a3y s VAL 132 Cb -0.14 -1.09 -0.03 0.00 0.56 0.00 0.00 36.38 35.68 2a3y s VAL 132 CO 0.02 0.32 -0.05 -0.76 -0.31 0.00 0.00 175.10 174.32 2a3y s LEU 133 N -0.50 3.24 0.00 1.32 1.02 -0.05 -1.91 118.68 121.79 2a3y s LEU 133 Ca 0.06 -0.02 0.00 0.00 0.02 0.00 0.00 54.13 54.19 2a3y s LEU 133 Cb -0.07 -1.73 0.00 0.00 0.02 0.00 0.00 46.19 44.42 2a3y s LEU 133 CO -0.00 0.32 0.00 0.61 0.02 0.00 0.00 176.35 177.30 2a3y n GLY 134 N 2.50 2.78 3.13 -3.19 0.00 -1.26 -0.56 105.19 108.59 2a3y n GLY 134 Ca -0.18 0.00 -0.08 0.00 0.00 0.00 0.00 46.02 45.76 2a3y n GLY 134 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 2a3y s GLN 135 N -1.00 0.70 -0.24 1.61 -1.52 -1.26 -1.31 119.66 116.64 2a3y s GLN 135 Ca 0.00 -1.11 -0.11 0.00 -1.95 0.00 0.00 55.36 52.19 2a3y s GLN 135 Cb 0.00 0.26 -0.05 0.00 -0.22 0.00 0.00 33.01 33.00 2a3y s GLN 135 CO 0.00 -0.17 0.17 -2.00 -0.25 0.00 0.00 175.29 173.04 2a3y s GLU 136 N -3.86 4.06 0.27 2.91 -6.30 -1.26 -4.58 118.70 109.94 2a3y s GLU 136 Ca 0.06 -0.25 -0.28 0.00 -2.50 0.00 0.00 54.97 51.99 2a3y s GLU 136 Cb 0.07 -3.55 -0.09 0.00 0.00 0.00 0.00 34.13 30.55 2a3y s GLU 136 CO -0.10 0.03 0.94 -0.65 0.02 0.00 0.00 175.26 175.50 2a3y s GLN 137 N 1.14 4.74 -0.00 4.30 -0.21 -1.26 -3.94 119.66 124.42 2a3y s GLN 137 Ca 0.08 1.41 0.03 0.00 0.02 0.00 0.00 55.36 56.90 2a3y s GLN 137 Cb -0.14 -3.09 -0.03 0.00 1.00 0.00 0.00 33.01 30.75 2a3y s GLN 137 CO 0.05 0.42 0.10 -0.25 -2.12 0.00 0.00 175.29 173.50 2a3y n ASP 138 N 1.12 1.22 -4.38 5.90 8.00 -0.34 -4.66 116.55 123.42 2a3y n ASP 138 Ca -0.01 -0.42 -0.30 0.00 0.71 0.00 0.00 54.79 54.78 2a3y n ASP 138 Cb 0.48 1.03 -0.07 0.00 -0.02 0.00 0.00 41.12 42.55 2a3y n ASP 138 CO 0.00 0.00 0.00 -1.54 -0.39 0.00 0.00 177.20 175.27 2a3y n SER 139 N -1.20 2.75 -4.56 -2.24 3.41 -0.80 -4.75 113.62 106.23 2a3y n SER 139 Ca 0.00 -3.16 -0.33 0.00 -0.26 0.00 0.00 58.87 55.13 2a3y n SER 139 Cb 0.05 0.54 -0.04 0.00 -0.26 0.00 0.00 64.21 64.50 2a3y n SER 139 CO 0.00 0.00 0.00 -0.47 -0.16 0.00 0.00 175.04 174.41 2a3y s TYR 140 N -2.86 2.14 0.00 7.33 5.04 -1.26 -3.29 117.35 124.44 2a3y s TYR 140 Ca 0.06 -0.04 0.00 0.00 -2.44 0.00 0.00 57.07 54.64 2a3y s TYR 140 Cb 0.00 -4.30 0.00 0.00 0.35 0.00 0.00 41.96 38.01 2a3y s TYR 140 CO 0.04 -1.74 0.00 0.41 -1.34 0.00 0.00 175.55 172.93 2a3y n GLY 141 N 6.59 0.38 0.00 8.97 0.00 -1.26 -5.01 105.19 114.85 2a3y n GLY 141 Ca 0.39 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.41 2a3y n GLY 141 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2a3y n GLY 142 N -2.00 3.84 3.68 -0.02 0.00 -1.21 -5.00 105.19 104.48 2a3y n GLY 142 Ca 0.00 -0.43 -0.30 0.00 0.00 0.00 0.00 46.02 45.28 2a3y n GLY 142 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2a3y n LYS 143 N 0.00 -1.43 -1.75 1.61 5.02 -1.26 -1.19 118.16 119.16 2a3y n LYS 143 Ca 0.00 0.47 -0.29 0.00 -2.02 0.00 0.00 58.31 56.47 2a3y n LYS 143 Cb 0.00 -4.23 0.09 0.00 -0.02 0.00 0.00 35.03 30.87 2a3y n LYS 143 CO 0.00 0.00 0.00 -0.06 -0.52 0.00 0.00 177.40 176.82 2a3y s PHE 144 N -3.49 2.94 -0.10 2.13 0.08 -1.26 -2.49 117.98 115.80 2a3y s PHE 144 Ca 0.45 0.93 -0.02 0.00 0.12 0.00 0.00 56.93 58.41 2a3y s PHE 144 Cb -0.16 -3.28 0.04 0.00 -0.57 0.00 0.00 43.02 39.05 2a3y s PHE 144 CO 0.86 -1.73 0.04 0.34 -0.10 0.00 0.00 175.22 174.63 2a3y s ASP 145 N -4.27 1.76 0.29 1.36 -1.08 -1.25 -4.98 116.67 108.49 2a3y s ASP 145 Ca 0.61 -0.23 0.04 0.00 -0.52 0.00 0.00 52.55 52.45 2a3y s ASP 145 Cb -0.12 -0.32 0.70 0.00 -1.46 0.00 0.00 42.92 41.71 2a3y s ASP 145 CO 0.52 -0.26 1.73 -0.09 0.52 0.00 0.00 175.17 177.59 2a3y h ARG 146 N 8.37 0.54 0.00 4.34 2.43 -1.91 -0.08 114.38 128.07 2a3y h ARG 146 Ca -0.16 -0.03 0.00 0.00 -0.81 0.00 0.00 59.98 58.98 2a3y h ARG 146 Cb 1.13 -0.12 0.00 0.00 -0.42 0.00 0.00 29.97 30.55 2a3y h ARG 146 CO 0.24 0.36 0.00 -1.13 -1.51 0.00 0.00 179.97 177.93 2a3y n SER 147 N -4.92 0.00 -0.09 -3.80 3.41 -1.26 -2.56 113.62 104.40 2a3y n SER 147 Ca 0.22 -0.74 0.01 0.00 -0.26 0.00 0.00 58.87 58.10 2a3y n SER 147 Cb 0.59 -0.05 0.01 0.00 -0.26 0.00 0.00 64.21 64.50 2a3y n SER 147 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2a3y n GLN 148 N -1.05 0.14 -2.02 4.33 6.02 -0.08 -4.64 117.38 120.09 2a3y n GLN 148 Ca 0.19 -0.57 -0.40 0.00 -0.01 0.00 0.00 57.00 56.22 2a3y n GLN 148 Cb 0.11 -1.00 -0.00 0.00 1.02 0.00 0.00 30.24 30.37 2a3y n GLN 148 CO 0.00 0.00 0.00 -1.54 -1.01 0.00 0.00 177.06 174.51 2a3y s SER 149 N -0.32 6.31 -0.17 1.08 1.04 -0.98 -1.48 113.70 119.17 2a3y s SER 149 Ca 0.03 2.71 -0.23 0.00 0.48 0.00 0.00 55.95 58.93 2a3y s SER 149 Cb 0.02 -2.64 -0.02 0.00 0.10 0.00 0.00 66.02 63.48 2a3y s SER 149 CO 0.04 -0.86 0.75 0.12 0.98 0.00 0.00 173.24 174.27 2a3y s PHE 150 N -1.24 3.41 -0.18 5.02 5.36 -0.43 -4.72 117.98 125.21 2a3y s PHE 150 Ca 0.56 1.13 -0.01 0.00 -0.96 0.00 0.00 56.93 57.66 2a3y s PHE 150 Cb -0.39 -2.92 0.00 0.00 -0.34 0.00 0.00 43.02 39.37 2a3y s PHE 150 CO 0.51 -0.20 -0.13 0.08 -1.46 0.00 0.00 175.22 174.02 2a3y s VAL 151 N 1.98 2.69 -2.40 3.12 1.01 -1.26 -4.77 120.40 120.76 2a3y s VAL 151 Ca 0.35 -0.74 0.00 0.00 0.00 0.00 0.00 61.98 61.58 2a3y s VAL 151 Cb -0.16 -2.16 0.00 0.00 0.00 0.00 0.00 36.38 34.05 2a3y s VAL 151 CO 0.12 0.50 0.00 0.61 0.00 0.00 0.00 175.10 176.32 2a3y n GLY 152 N 4.46 0.46 3.07 4.51 0.00 -0.16 -4.46 105.19 113.07 2a3y n GLY 152 Ca -0.19 -1.33 -0.23 0.00 0.00 0.00 0.00 46.02 44.26 2a3y n GLY 152 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2a3y s GLU 153 N -2.00 1.38 -0.06 1.61 2.02 0.19 -0.07 118.70 121.77 2a3y s GLU 153 Ca 0.00 -0.46 0.03 0.00 0.02 0.00 0.00 54.97 54.56 2a3y s GLU 153 Cb 0.00 -1.24 0.01 0.00 0.10 0.00 0.00 34.13 33.00 2a3y s GLU 153 CO 0.00 0.18 -0.14 0.42 0.02 0.00 0.00 175.26 175.74 2a3y s ILE 154 N 0.12 1.22 0.31 -1.63 1.01 -0.56 -0.87 121.20 120.80 2a3y s ILE 154 Ca -0.04 -0.54 0.04 0.00 0.00 0.00 0.00 60.65 60.11 2a3y s ILE 154 Cb -0.10 -1.10 -0.03 0.00 0.01 0.00 0.00 42.46 41.24 2a3y s ILE 154 CO 0.01 0.37 0.28 -0.83 0.00 0.00 0.00 174.94 174.78 2a3y s GLY 155 N 0.54 2.03 -1.52 6.18 0.00 -0.39 -0.79 107.32 113.38 2a3y s GLY 155 Ca -0.13 -1.91 -0.10 0.00 0.00 0.00 0.00 44.72 42.58 2a3y s GLY 155 CO 0.04 -1.38 0.74 1.22 0.00 0.00 0.00 173.10 173.72 2a3y n ASP 156 N -1.29 -2.71 -4.67 1.64 8.00 -1.26 -0.52 116.55 115.73 2a3y n ASP 156 Ca 0.05 -0.91 -0.42 0.00 0.71 0.00 0.00 54.79 54.23 2a3y n ASP 156 Cb 0.63 -3.37 -0.04 0.00 -0.02 0.00 0.00 41.12 38.33 2a3y n ASP 156 CO 0.00 0.00 0.00 -0.22 -0.39 0.00 0.00 177.20 176.59 2a3y s LEU 157 N -7.12 4.19 0.02 0.64 1.98 -1.26 -3.92 118.68 113.22 2a3y s LEU 157 Ca 0.43 1.27 0.02 0.00 -2.89 0.00 0.00 54.13 52.95 2a3y s LEU 157 Cb -0.22 -3.32 -0.02 0.00 0.66 0.00 0.00 46.19 43.29 2a3y s LEU 157 CO 0.87 -0.42 -0.06 -0.31 -1.89 0.00 0.00 176.35 174.54 2a3y s TYR 158 N 2.14 0.54 -0.03 5.38 1.51 0.77 -1.84 117.35 125.82 2a3y s TYR 158 Ca 0.41 -0.34 -0.01 0.00 -1.01 0.00 0.00 57.07 56.12 2a3y s TYR 158 Cb -0.17 -0.33 0.03 0.00 -0.11 0.00 0.00 41.96 41.38 2a3y s TYR 158 CO 0.13 -0.06 0.04 1.41 -1.11 0.00 0.00 175.55 175.96 2a3y s MET 159 N -1.02 -0.05 0.16 -0.62 1.75 0.18 -0.80 119.30 118.90 2a3y s MET 159 Ca -0.06 0.26 0.08 0.00 -1.25 0.00 0.00 55.69 54.71 2a3y s MET 159 Cb -0.07 -0.34 -0.04 0.00 2.84 0.00 0.00 34.83 37.22 2a3y s MET 159 CO 0.00 -0.23 -0.05 -1.58 -0.65 0.00 0.00 175.02 172.52 2a3y s TRP 160 N 1.46 2.77 -0.51 4.11 0.51 0.03 -1.43 118.94 125.88 2a3y s TRP 160 Ca -0.04 -0.16 0.05 0.00 -2.12 0.00 0.00 56.10 53.83 2a3y s TRP 160 Cb -0.13 -1.37 0.37 0.00 -0.81 0.00 0.00 33.47 31.54 2a3y s TRP 160 CO -0.03 0.50 1.20 -0.40 -0.51 0.00 0.00 176.95 177.71 2a3y n ASP 161 N 0.09 3.28 -4.27 2.95 5.75 -1.26 -1.50 116.55 121.59 2a3y n ASP 161 Ca -0.11 -2.54 -0.15 0.00 -0.01 0.00 0.00 54.79 51.99 2a3y n ASP 161 Cb 0.55 -0.61 -0.10 0.00 -1.03 0.00 0.00 41.12 39.92 2a3y n ASP 161 CO 0.00 0.00 0.00 -0.94 -0.11 0.00 0.00 177.20 176.15 2a3y s SER 162 N -0.28 1.05 -0.32 -1.12 1.04 -1.25 -4.44 113.70 108.38 2a3y s SER 162 Ca 0.26 -1.30 -0.21 0.00 0.48 0.00 0.00 55.95 55.18 2a3y s SER 162 Cb 0.21 0.17 -0.00 0.00 0.10 0.00 0.00 66.02 66.50 2a3y s SER 162 CO 0.07 -0.68 0.68 -0.69 0.98 0.00 0.00 173.24 173.60 2a3y s VAL 163 N -3.77 4.88 0.11 5.02 1.01 -1.26 -2.10 120.40 124.29 2a3y s VAL 163 Ca 0.32 0.90 -0.30 0.00 0.00 0.00 0.00 61.98 62.90 2a3y s VAL 163 Cb 0.07 -4.07 -0.06 0.00 0.00 0.00 0.00 36.38 32.32 2a3y s VAL 163 CO 0.09 -0.22 1.11 -0.76 0.00 0.00 0.00 175.10 175.33 2a3y s LEU 164 N 2.75 4.43 0.81 3.92 1.02 -1.26 -5.05 118.68 125.31 2a3y s LEU 164 Ca 0.27 2.00 -0.11 0.00 0.02 0.00 0.00 54.13 56.31 2a3y s LEU 164 Cb -0.14 -3.59 0.08 0.00 0.02 0.00 0.00 46.19 42.55 2a3y s LEU 164 CO 0.13 -0.30 1.09 -2.16 0.02 0.00 0.00 176.35 175.12 2a3y s PRO 165 N 0.29 1.98 0.29 1.29 0.04 -1.26 -4.81 135.00 132.83 2a3y s PRO 165 Ca 0.53 0.83 0.04 0.00 0.04 0.00 0.00 61.00 62.44 2a3y s PRO 165 Cb -0.28 -1.89 0.70 0.00 0.04 0.00 0.00 34.50 33.07 2a3y s PRO 165 CO 0.32 -1.74 1.76 -1.35 0.04 0.00 0.00 177.00 176.03 2a3y h PRO 166 N -1.18 0.66 -0.91 0.56 0.11 -1.99 -1.88 132.00 127.36 2a3y h PRO 166 Ca -0.47 -0.04 -0.02 0.00 0.11 0.00 0.00 66.00 65.59 2a3y h PRO 166 Cb 1.26 -0.15 -0.04 0.00 0.11 0.00 0.00 31.00 32.18 2a3y h PRO 166 CO 0.56 0.43 0.51 0.93 -0.21 0.00 0.00 178.00 180.22 2a3y h GLU 167 N 0.68 1.26 -0.09 1.05 3.07 -1.99 -0.17 114.58 118.39 2a3y h GLU 167 Ca 0.56 -0.14 -0.16 0.00 -0.50 0.00 0.00 59.36 59.11 2a3y h GLU 167 Cb 0.89 -0.25 -0.01 0.00 -0.84 0.00 0.00 28.75 28.54 2a3y h GLU 167 CO -0.40 0.92 -0.64 -0.91 -1.40 0.00 0.00 179.01 176.57 2a3y h ASN 168 N 1.27 0.41 -0.42 1.42 2.35 -1.73 -1.38 115.58 117.50 2a3y h ASN 168 Ca 0.32 -0.25 -0.04 0.00 -0.55 0.00 0.00 56.30 55.78 2a3y h ASN 168 Cb 0.01 -0.12 -0.02 0.00 0.05 0.00 0.00 38.32 38.25 2a3y h ASN 168 CO -0.05 0.94 0.10 0.40 -1.65 0.00 0.00 177.43 177.17 2a3y h ILE 169 N 0.26 1.23 -0.76 2.81 1.08 -0.94 -2.20 117.51 118.99 2a3y h ILE 169 Ca -0.01 -0.80 -0.05 0.00 -0.39 0.00 0.00 64.86 63.61 2a3y h ILE 169 Cb 1.18 0.95 -0.03 0.00 -3.07 0.00 0.00 36.82 35.85 2a3y h ILE 169 CO 0.11 0.28 0.27 -0.07 -0.69 0.00 0.00 178.15 178.05 2a3y h LEU 170 N 0.54 1.08 -0.98 1.44 3.38 -0.95 -1.29 115.31 118.52 2a3y h LEU 170 Ca 0.13 -0.19 0.02 0.00 0.09 0.00 0.00 57.88 57.93 2a3y h LEU 170 Cb 0.32 -0.28 -0.05 0.00 0.09 0.00 0.00 40.66 40.73 2a3y h LEU 170 CO 0.00 0.98 0.65 0.28 0.09 0.00 0.00 178.44 180.44 2a3y h SER 171 N 1.11 1.11 -0.38 -0.43 0.02 -1.11 0.59 113.55 114.46 2a3y h SER 171 Ca 0.25 -0.02 -0.09 0.00 -0.84 0.00 0.00 61.79 61.09 2a3y h SER 171 Cb 0.26 -0.27 -0.01 0.00 0.14 0.00 0.00 62.40 62.52 2a3y h SER 171 CO -0.01 0.79 -0.10 0.00 -1.14 0.00 0.00 176.83 176.36 2a3y h ALA 172 N 1.38 0.52 -0.70 3.77 0.00 -1.03 0.14 119.26 123.34 2a3y h ALA 172 Ca 0.37 -0.32 -0.01 0.00 0.00 0.00 0.00 54.91 54.96 2a3y h ALA 172 Cb -0.10 -0.13 -0.03 0.00 0.00 0.00 0.00 17.79 17.53 2a3y h ALA 172 CO -0.10 0.39 0.40 -0.92 0.00 0.00 0.00 179.25 179.02 2a3y h TYR 173 N 0.54 0.95 0.00 0.00 3.20 -0.85 -2.73 116.97 118.08 2a3y h TYR 173 Ca 0.10 -0.02 0.00 0.00 3.14 0.00 0.00 58.73 61.95 2a3y h TYR 173 Cb 0.62 -0.31 0.00 0.00 1.54 0.00 0.00 36.73 38.58 2a3y h TYR 173 CO 0.05 0.67 0.00 1.96 -1.64 0.00 0.00 178.16 179.20 2a3y h GLN 174 N 0.96 0.00 0.00 1.82 4.20 -0.81 -3.46 115.11 117.82 2a3y h GLN 174 Ca 0.25 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.96 2a3y h GLN 174 Cb 0.02 0.00 0.00 0.00 0.30 0.00 0.00 27.48 27.80 2a3y h GLN 174 CO -0.04 0.00 0.00 0.41 -0.67 0.00 0.00 178.83 178.53 2a3y n GLY 175 N -0.08 1.16 2.51 3.46 0.00 -0.99 -5.04 105.19 106.21 2a3y n GLY 175 Ca 0.01 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.78 2a3y n GLY 175 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 2a3y n THR 176 N -1.54 1.54 -2.11 2.61 -2.24 0.45 -5.01 114.28 107.97 2a3y n THR 176 Ca 0.00 -5.00 -0.34 0.00 -2.27 0.00 0.00 64.05 56.44 2a3y n THR 176 Cb 0.00 -1.44 0.01 0.00 -2.10 0.00 0.00 70.33 66.80 2a3y n THR 176 CO 0.00 0.00 0.00 -2.16 -0.57 0.00 0.00 175.07 172.34 2a3y s PRO 177 N -2.58 3.24 0.46 -0.78 0.04 -1.21 -4.29 135.00 129.88 2a3y s PRO 177 Ca 0.42 1.46 -0.22 0.00 0.04 0.00 0.00 61.00 62.70 2a3y s PRO 177 Cb 0.24 -2.00 -0.08 0.00 0.04 0.00 0.00 34.50 32.70 2a3y s PRO 177 CO -0.09 -0.91 1.12 -0.51 0.04 0.00 0.00 177.00 176.65 2a3y s LEU 178 N -4.18 3.99 0.23 -3.56 1.02 -1.26 -4.95 118.68 109.96 2a3y s LEU 178 Ca 0.69 2.19 -0.30 0.00 0.02 0.00 0.00 54.13 56.73 2a3y s LEU 178 Cb -0.21 -4.31 -0.15 0.00 0.02 0.00 0.00 46.19 41.54 2a3y s LEU 178 CO 0.32 -0.85 1.11 -2.65 0.02 0.00 0.00 176.35 174.30 2a3y n PRO 179 N -0.56 1.32 -4.97 1.29 -0.02 -1.26 -4.98 135.00 125.82 2a3y n PRO 179 Ca 0.08 0.47 -0.32 0.00 -2.02 0.00 0.00 63.50 61.70 2a3y n PRO 179 Cb 0.49 -1.92 -0.14 0.00 -0.02 0.00 0.00 33.50 31.92 2a3y n PRO 179 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2a3y s ALA 180 N -0.57 2.54 -0.85 3.55 0.00 -1.26 -5.02 121.76 120.15 2a3y s ALA 180 Ca 0.66 -1.00 0.21 0.00 0.00 0.00 0.00 51.96 51.84 2a3y s ALA 180 Cb -0.76 -0.91 -0.20 0.00 0.00 0.00 0.00 23.12 21.25 2a3y s ALA 180 CO 0.55 0.51 0.87 0.27 0.00 0.00 0.00 175.76 177.96 2a3y n ASN 181 N 2.51 0.82 -0.08 0.00 6.94 -1.21 -4.46 115.26 119.78 2a3y n ASN 181 Ca -0.17 -0.79 -0.07 0.00 -0.02 0.00 0.00 54.58 53.52 2a3y n ASN 181 Cb 0.52 1.10 -0.02 0.00 -2.36 0.00 0.00 39.78 39.01 2a3y n ASN 181 CO 0.00 0.00 0.00 -0.38 -1.03 0.00 0.00 177.26 175.85 2a3y n ILE 182 N -1.63 1.46 -4.45 1.53 5.41 -0.52 -4.81 119.36 116.37 2a3y n ILE 182 Ca 0.03 0.17 -0.21 0.00 1.00 0.00 0.00 62.75 63.74 2a3y n ILE 182 Cb 0.37 -2.36 -0.15 0.00 -0.71 0.00 0.00 39.64 36.78 2a3y n ILE 182 CO 0.00 0.00 0.00 -0.76 0.00 0.00 0.00 176.55 175.79 2a3y s LEU 183 N -8.06 1.83 -0.05 1.39 1.02 -0.99 -4.62 118.68 109.20 2a3y s LEU 183 Ca -0.22 -0.21 -0.02 0.00 0.02 0.00 0.00 54.13 53.70 2a3y s LEU 183 Cb 0.03 -0.60 0.04 0.00 0.02 0.00 0.00 46.19 45.68 2a3y s LEU 183 CO 0.33 0.08 0.09 -0.62 0.02 0.00 0.00 176.35 176.25 2a3y s ASP 184 N 0.12 0.90 0.55 2.29 -1.08 -1.26 -0.65 116.67 117.54 2a3y s ASP 184 Ca -0.02 0.16 0.23 0.00 -0.52 0.00 0.00 52.55 52.40 2a3y s ASP 184 Cb -0.08 -0.00 1.45 0.00 -1.46 0.00 0.00 42.92 42.83 2a3y s ASP 184 CO 0.01 -0.24 2.09 -0.25 0.52 0.00 0.00 175.17 177.30 2a3y h TRP 185 N 8.28 0.00 0.00 -5.34 2.91 -1.74 -1.20 115.95 118.86 2a3y h TRP 185 Ca -0.16 0.00 0.00 0.00 1.13 0.00 0.00 58.89 59.86 2a3y h TRP 185 Cb 1.12 0.00 0.00 0.00 -0.51 0.00 0.00 29.16 29.77 2a3y h TRP 185 CO 0.46 0.00 -0.26 1.04 -1.03 0.00 0.00 178.44 178.66 2a3y n GLN 186 N -4.24 0.15 -3.04 2.65 6.02 -1.26 -1.32 117.38 116.34 2a3y n GLN 186 Ca 0.03 0.09 -0.18 0.00 -0.01 0.00 0.00 57.00 56.92 2a3y n GLN 186 Cb 0.33 -1.64 -0.03 0.00 1.02 0.00 0.00 30.24 29.93 2a3y n GLN 186 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 2a3y n ALA 187 N -1.67 1.14 -2.83 -1.58 0.00 -0.51 -3.64 120.51 111.42 2a3y n ALA 187 Ca 0.05 -2.73 -0.35 0.00 0.00 0.00 0.00 53.44 50.42 2a3y n ALA 187 Cb 0.39 -0.99 -0.10 0.00 0.00 0.00 0.00 19.45 18.76 2a3y n ALA 187 CO 0.00 0.00 0.00 -1.17 0.00 0.00 0.00 177.50 176.33 2a3y s LEU 188 N -1.11 3.76 -0.37 0.00 2.96 -0.44 -4.45 118.68 119.03 2a3y s LEU 188 Ca 0.34 0.08 -0.14 0.00 -0.22 0.00 0.00 54.13 54.20 2a3y s LEU 188 Cb 0.20 -1.94 0.00 0.00 0.50 0.00 0.00 46.19 44.96 2a3y s LEU 188 CO -0.15 0.20 0.26 0.20 -1.32 0.00 0.00 176.35 175.55 2a3y s ASN 189 N 0.18 6.06 0.08 3.68 -0.87 -1.26 -1.38 114.94 121.43 2a3y s ASN 189 Ca 0.04 -0.65 0.02 0.00 -1.57 0.00 0.00 52.86 50.69 2a3y s ASN 189 Cb -0.12 -2.14 -0.04 0.00 -0.02 0.00 0.00 41.25 38.93 2a3y s ASN 189 CO 0.01 -0.33 -0.06 -0.72 -2.57 0.00 0.00 177.10 173.42 2a3y s TYR 190 N 1.70 0.82 -0.11 2.20 1.13 -1.26 -1.55 117.35 120.27 2a3y s TYR 190 Ca 0.05 -0.86 -0.00 0.00 -1.41 0.00 0.00 57.07 54.85 2a3y s TYR 190 Cb -0.18 -0.48 0.02 0.00 -1.10 0.00 0.00 41.96 40.22 2a3y s TYR 190 CO 0.10 -0.16 -0.08 -1.21 -2.51 0.00 0.00 175.55 171.69 2a3y s GLU 191 N -3.49 1.56 -0.13 -3.49 2.02 -0.41 -4.97 118.70 109.78 2a3y s GLU 191 Ca 0.08 -0.28 -0.20 0.00 0.02 0.00 0.00 54.97 54.59 2a3y s GLU 191 Cb 0.03 -1.56 -0.04 0.00 0.10 0.00 0.00 34.13 32.66 2a3y s GLU 191 CO -0.04 -0.23 0.59 0.42 0.02 0.00 0.00 175.26 176.02 2a3y s ILE 192 N 1.56 5.10 -0.06 -1.63 1.01 -1.26 -0.68 121.20 125.23 2a3y s ILE 192 Ca 0.02 1.16 0.03 0.00 0.00 0.00 0.00 60.65 61.86 2a3y s ILE 192 Cb -0.13 -3.92 0.01 0.00 0.01 0.00 0.00 42.46 38.43 2a3y s ILE 192 CO -0.07 0.24 -0.15 -0.13 0.00 0.00 0.00 174.94 174.83 2a3y s ARG 193 N 1.06 1.89 3.49 2.79 1.81 -0.73 -5.02 118.95 124.24 2a3y s ARG 193 Ca 0.30 -0.52 0.00 0.00 -1.72 0.00 0.00 55.73 53.79 2a3y s ARG 193 Cb -0.16 -1.55 0.00 0.00 -0.45 0.00 0.00 34.95 32.79 2a3y s ARG 193 CO 0.13 0.11 0.00 0.41 -0.68 0.00 0.00 175.30 175.26 2a3y n GLY 194 N 3.59 0.03 3.40 -3.53 0.00 -1.26 -1.78 105.19 105.64 2a3y n GLY 194 Ca -0.21 -1.00 -0.45 0.00 0.00 0.00 0.00 46.02 44.36 2a3y n GLY 194 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 173.32 172.85 2a3y s TYR 195 N 0.00 3.50 -0.03 1.61 5.04 -1.26 -4.95 117.35 121.26 2a3y s TYR 195 Ca 0.00 -1.82 0.01 0.00 -2.44 0.00 0.00 57.07 52.82 2a3y s TYR 195 Cb 0.00 -4.10 0.01 0.00 0.35 0.00 0.00 41.96 38.23 2a3y s TYR 195 CO 0.00 -1.26 -0.05 0.08 -1.34 0.00 0.00 175.55 172.98 2a3y s VAL 196 N 1.33 0.48 -0.05 3.14 1.01 -1.26 -4.29 120.40 120.75 2a3y s VAL 196 Ca 0.29 -0.14 0.05 0.00 0.00 0.00 0.00 61.98 62.18 2a3y s VAL 196 Cb -0.07 -0.48 -0.01 0.00 0.00 0.00 0.00 36.38 35.82 2a3y s VAL 196 CO -0.08 0.19 -0.22 -0.63 0.00 0.00 0.00 175.10 174.36 2a3y s ILE 197 N 0.60 1.79 -0.14 2.22 -1.09 -0.53 -4.93 121.20 119.13 2a3y s ILE 197 Ca -0.07 -0.92 -0.23 0.00 -2.23 0.00 0.00 60.65 57.19 2a3y s ILE 197 Cb -0.11 -1.53 -0.03 0.00 -1.58 0.00 0.00 42.46 39.22 2a3y s ILE 197 CO -0.00 0.50 0.72 -0.63 -1.23 0.00 0.00 174.94 174.30 2a3y s ILE 198 N -0.07 4.99 0.04 2.92 1.01 -1.26 0.28 121.20 129.12 2a3y s ILE 198 Ca -0.04 1.42 -0.00 0.00 0.00 0.00 0.00 60.65 62.03 2a3y s ILE 198 Cb -0.13 -4.04 -0.03 0.00 0.01 0.00 0.00 42.46 38.27 2a3y s ILE 198 CO 0.03 0.14 -0.04 -0.54 0.00 0.00 0.00 174.94 174.53 2a3y s LYS 199 N 1.56 0.52 0.58 2.79 -0.14 -0.66 -4.97 119.74 119.42 2a3y s LYS 199 Ca 0.35 -0.98 -0.20 0.00 -1.36 0.00 0.00 55.97 53.78 2a3y s LYS 199 Cb -0.17 0.09 -0.04 0.00 -1.68 0.00 0.00 37.83 36.04 2a3y s LYS 199 CO 0.14 -0.07 1.26 -0.35 -0.76 0.00 0.00 175.35 175.57 2a3y n PRO 200 N 0.73 1.37 -2.65 -1.68 -0.04 -1.26 0.40 135.00 131.86 2a3y n PRO 200 Ca -0.18 0.52 -0.43 0.00 -0.04 0.00 0.00 63.50 63.37 2a3y n PRO 200 Cb 0.58 -2.48 -0.02 0.00 -0.04 0.00 0.00 33.50 31.54 2a3y n PRO 200 CO 0.00 0.00 0.00 -1.17 -0.04 0.00 0.00 175.50 174.29 2a3y s LEU 201 N -3.39 3.99 -0.00 1.53 2.96 0.27 -4.59 118.68 119.45 2a3y s LEU 201 Ca 0.76 1.14 0.03 0.00 -0.22 0.00 0.00 54.13 55.83 2a3y s LEU 201 Cb -0.41 -3.53 -0.03 0.00 0.50 0.00 0.00 46.19 42.72 2a3y s LEU 201 CO 0.46 -0.81 0.08 1.33 -1.32 0.00 0.00 176.35 176.09 2a3y n VAL 202 N 5.69 0.00 -0.90 1.68 0.24 -1.26 -4.69 118.33 119.08 2a3y n VAL 202 Ca 0.12 -0.24 -0.15 0.00 -2.04 0.00 0.00 64.34 62.02 2a3y n VAL 202 Cb 0.47 0.71 0.20 0.00 -1.47 0.00 0.00 33.84 33.75 2a3y n VAL 202 CO 0.00 0.00 0.00 -2.67 -2.14 0.00 0.00 176.83 172.02 2a3y n TRP 203 N -1.33 2.53 -0.64 6.34 4.27 -1.26 -5.27 117.44 122.07 2a3y n TRP 203 Ca -0.00 -1.46 0.00 0.00 -3.89 0.00 0.00 57.50 52.15 2a3y n TRP 203 Cb 0.05 -0.78 0.00 0.00 -1.36 0.00 0.00 31.31 29.22 2a3y n TRP 203 CO 0.00 0.00 0.00 0.28 -2.29 0.00 0.00 177.69 175.68