#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2aco s LEU 11 N 0.00 3.87 0.57 0.27 1.43 -1.26 -2.01 118.68 121.55 2aco s LEU 11 Ca 0.00 0.07 -0.20 0.00 -1.03 0.00 0.00 54.13 52.97 2aco s LEU 11 Cb 0.00 -2.43 -0.04 0.00 0.03 0.00 0.00 46.19 43.75 2aco s LEU 11 CO 0.00 0.21 1.24 -0.62 0.23 0.00 0.00 176.35 177.42 2aco n GLU 12 N 0.74 1.37 -2.04 1.70 -0.58 0.91 -4.80 120.64 117.94 2aco n GLU 12 Ca -0.10 0.52 -0.39 0.00 -0.42 0.00 0.00 57.16 56.76 2aco n GLU 12 Cb 0.52 -2.45 -0.00 0.00 -0.57 0.00 0.00 31.44 28.94 2aco n GLU 12 CO 0.00 0.00 0.00 -1.54 -0.48 0.00 0.00 177.13 175.11 2aco s SER 13 N -1.08 6.25 0.19 1.62 1.04 -1.26 -4.76 113.70 115.70 2aco s SER 13 Ca 0.75 2.66 0.03 0.00 0.48 0.00 0.00 55.95 59.87 2aco s SER 13 Cb -0.42 -2.64 -0.05 0.00 0.10 0.00 0.00 66.02 63.02 2aco s SER 13 CO 0.47 -0.89 -0.03 0.42 0.98 0.00 0.00 173.24 174.19 2aco s THR 14 N -1.27 0.99 0.06 2.02 -4.23 -1.26 -2.36 115.64 109.58 2aco s THR 14 Ca 0.58 -2.03 -0.12 0.00 -1.18 0.00 0.00 61.69 58.94 2aco s THR 14 Cb -0.38 -2.14 0.01 0.00 1.34 0.00 0.00 72.50 71.33 2aco s THR 14 CO 0.49 -0.49 0.25 -0.94 -0.54 0.00 0.00 174.62 173.39 2aco s SER 15 N -3.23 -0.04 0.11 3.99 1.04 -0.94 -4.88 113.70 109.74 2aco s SER 15 Ca 0.24 -0.34 -0.34 0.00 0.48 0.00 0.00 55.95 55.99 2aco s SER 15 Cb 0.05 0.34 -0.13 0.00 0.10 0.00 0.00 66.02 66.38 2aco s SER 15 CO 0.05 -0.63 1.66 -0.11 0.98 0.00 0.00 173.24 175.19 2aco n LEU 16 N 0.44 3.24 -3.83 2.42 7.94 -1.26 -1.40 117.00 124.55 2aco n LEU 16 Ca -0.18 1.05 -0.14 0.00 -1.11 0.00 0.00 56.01 55.64 2aco n LEU 16 Cb 0.60 -1.43 -0.15 0.00 0.53 0.00 0.00 43.42 42.98 2aco n LEU 16 CO 0.21 -0.20 -0.36 -0.47 -1.11 0.00 0.00 177.39 175.46 2aco s TYR 17 N 1.68 0.06 -0.03 1.96 6.14 -0.15 -4.90 117.35 122.11 2aco s TYR 17 Ca 0.82 0.05 0.01 0.00 0.64 0.00 0.00 57.07 58.59 2aco s TYR 17 Cb -0.67 -0.14 0.02 0.00 0.42 0.00 0.00 41.96 41.59 2aco s TYR 17 CO 0.41 -0.05 -0.03 0.15 0.64 0.00 0.00 175.55 176.67 2aco s LYS 18 N 0.50 0.53 -0.04 4.97 1.02 -1.26 -2.23 119.74 123.22 2aco s LYS 18 Ca -0.04 -0.07 -0.02 0.00 0.02 0.00 0.00 55.97 55.85 2aco s LYS 18 Cb -0.06 -0.58 0.03 0.00 -0.52 0.00 0.00 37.83 36.70 2aco s LYS 18 CO -0.01 -0.03 0.07 0.21 -0.92 0.00 0.00 175.35 174.66 2aco s LYS 19 N 0.61 -0.07 -0.18 1.68 2.20 -1.26 -5.04 119.74 117.68 2aco s LYS 19 Ca -0.07 0.40 -0.41 0.00 -0.36 0.00 0.00 55.97 55.53 2aco s LYS 19 Cb -0.10 -0.49 -0.18 0.00 -1.51 0.00 0.00 37.83 35.55 2aco s LYS 19 CO -0.00 -0.33 1.50 0.00 -0.36 0.00 0.00 175.35 176.15 2aco n ALA 20 N 5.30 -1.20 0.00 3.13 0.00 -1.26 -1.19 120.51 125.29 2aco n ALA 20 Ca -0.03 0.48 0.00 0.00 0.00 0.00 0.00 53.44 53.89 2aco n ALA 20 Cb 0.50 -2.05 0.00 0.00 0.00 0.00 0.00 19.45 17.90 2aco n ALA 20 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2aco n GLY 21 N 3.27 2.14 0.01 0.00 0.00 -1.26 -4.79 105.19 104.55 2aco n GLY 21 Ca 0.24 0.00 0.02 0.00 0.00 0.00 0.00 46.02 46.28 2aco n GLY 21 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 2aco n SER 22 N 0.00 3.70 -4.37 1.61 7.64 -0.34 -4.64 113.62 117.22 2aco n SER 22 Ca 0.00 0.00 -0.27 0.00 1.01 0.00 0.00 58.87 59.61 2aco n SER 22 Cb 0.00 1.17 -0.12 0.00 -1.01 0.00 0.00 64.21 64.24 2aco n SER 22 CO 0.00 0.00 0.00 0.42 -3.01 0.00 0.00 175.04 172.45 2aco s THR 23 N -2.36 2.11 0.84 0.44 -4.23 -0.95 -3.90 115.64 107.60 2aco s THR 23 Ca -0.02 -1.79 -0.12 0.00 -1.18 0.00 0.00 61.69 58.58 2aco s THR 23 Cb 0.03 -1.91 0.10 0.00 1.34 0.00 0.00 72.50 72.06 2aco s THR 23 CO 0.23 -0.03 1.19 -2.84 -0.54 0.00 0.00 174.62 172.63 2aco s PRO 24 N -2.24 1.47 0.21 3.99 0.02 -0.97 -4.69 135.00 132.80 2aco s PRO 24 Ca 0.14 1.69 -0.31 0.00 0.02 0.00 0.00 61.00 62.55 2aco s PRO 24 Cb -0.09 -1.76 -0.16 0.00 0.02 0.00 0.00 34.50 32.51 2aco s PRO 24 CO 0.07 -2.33 0.99 -2.30 -0.33 0.00 0.00 177.00 173.10 2aco n PRO 25 N -3.56 0.97 -0.54 5.54 -0.02 -1.26 -1.61 135.00 134.52 2aco n PRO 25 Ca 0.13 0.34 0.00 0.00 -2.02 0.00 0.00 63.50 61.95 2aco n PRO 25 Cb 0.51 -1.71 0.00 0.00 -0.02 0.00 0.00 33.50 32.28 2aco n PRO 25 CO 0.00 0.00 0.00 0.54 1.98 0.00 0.00 175.50 178.02 2aco n ARG 26 N 1.25 0.00 0.00 -0.52 1.74 -1.26 -4.82 116.66 113.04 2aco n ARG 26 Ca 0.14 0.00 0.00 0.00 -0.77 0.00 0.00 57.85 57.22 2aco n ARG 26 Cb 0.26 -2.38 0.00 0.00 -1.02 0.00 0.00 32.46 29.33 2aco n ARG 26 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 2aco n GLY 27 N -2.00 -1.87 3.10 -0.13 0.00 -0.63 -4.93 105.19 98.72 2aco n GLY 27 Ca 0.00 -1.52 -0.08 0.00 0.00 0.00 0.00 46.02 44.42 2aco n GLY 27 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 2aco s VAL 28 N -2.31 0.35 -0.56 1.61 -7.23 -0.95 -4.87 120.40 106.44 2aco s VAL 28 Ca 0.00 -1.76 -0.28 0.00 -1.81 0.00 0.00 61.98 58.13 2aco s VAL 28 Cb 0.00 -1.45 0.02 0.00 0.56 0.00 0.00 36.38 35.51 2aco s VAL 28 CO 0.00 -0.92 1.30 0.42 -0.31 0.00 0.00 175.10 175.59 2aco s THR 29 N -3.61 3.92 -0.09 5.32 -4.23 -1.26 -0.98 115.64 114.71 2aco s THR 29 Ca 0.06 0.81 -0.02 0.00 -1.18 0.00 0.00 61.69 61.37 2aco s THR 29 Cb 0.06 -4.58 -0.03 0.00 1.34 0.00 0.00 72.50 69.28 2aco s THR 29 CO -0.08 -1.24 -0.01 -0.69 -0.54 0.00 0.00 174.62 172.07 2aco s VAL 30 N 5.43 4.25 0.08 2.29 1.01 -0.49 -4.22 120.40 128.74 2aco s VAL 30 Ca 0.48 -0.27 -0.36 0.00 0.00 0.00 0.00 61.98 61.83 2aco s VAL 30 Cb -0.09 -2.78 -0.16 0.00 0.00 0.00 0.00 36.38 33.35 2aco s VAL 30 CO 0.26 0.60 1.47 0.52 0.00 0.00 0.00 175.10 177.94 2aco n VAL 31 N 2.23 0.05 0.01 2.92 0.31 -0.39 -2.22 118.33 121.23 2aco n VAL 31 Ca -0.18 -0.01 0.00 0.00 -0.01 0.00 0.00 64.34 64.14 2aco n VAL 31 Cb 0.53 -1.12 0.00 0.00 -0.91 0.00 0.00 33.84 32.35 2aco n VAL 31 CO 0.00 0.00 0.00 -0.46 -1.32 0.00 0.00 176.83 175.05 2aco n ASN 32 N 3.20 1.37 -2.57 4.52 2.04 -0.99 -1.41 115.26 121.42 2aco n ASN 32 Ca 0.19 -1.34 -0.13 0.00 -0.44 0.00 0.00 54.58 52.86 2aco n ASN 32 Cb 0.22 -0.00 0.03 0.00 -2.53 0.00 0.00 39.78 37.50 2aco n ASN 32 CO 0.00 0.00 0.00 -3.20 -0.44 0.00 0.00 177.26 173.62 2aco n ASN 33 N -0.13 2.73 -4.76 0.53 4.05 -0.88 -4.44 115.26 112.35 2aco n ASN 33 Ca 0.00 -2.89 -0.38 0.00 0.45 0.00 0.00 54.58 51.76 2aco n ASN 33 Cb 0.09 -0.47 0.02 0.00 1.23 0.00 0.00 39.78 40.66 2aco n ASN 33 CO 0.00 0.00 0.00 0.12 -3.05 0.00 0.00 177.26 174.33 2aco s PHE 34 N -3.49 2.51 -0.39 1.20 5.36 0.03 -5.01 117.98 118.19 2aco s PHE 34 Ca 0.35 1.41 0.01 0.00 -0.96 0.00 0.00 56.93 57.74 2aco s PHE 34 Cb 0.40 -3.70 0.12 0.00 -0.34 0.00 0.00 43.02 39.50 2aco s PHE 34 CO -0.03 -2.48 0.17 0.34 -1.46 0.00 0.00 175.22 171.76 2aco s ASP 35 N -0.98 3.93 0.49 6.13 2.15 -1.26 -4.27 116.67 122.85 2aco s ASP 35 Ca 0.67 -2.25 0.17 0.00 0.43 0.00 0.00 52.55 51.57 2aco s ASP 35 Cb -0.38 -1.06 1.21 0.00 -0.30 0.00 0.00 42.92 42.39 2aco s ASP 35 CO 0.46 -0.33 2.06 0.00 -0.17 0.00 0.00 175.17 177.19 2aco h ALA 36 N 7.29 2.10 -0.36 3.66 0.00 -1.95 -1.48 119.26 128.52 2aco h ALA 36 Ca -0.06 -0.01 0.02 0.00 0.00 0.00 0.00 54.91 54.86 2aco h ALA 36 Cb 0.97 -0.03 -0.02 0.00 0.00 0.00 0.00 17.79 18.71 2aco h ALA 36 CO 0.49 -0.17 0.24 1.57 0.00 0.00 0.00 179.25 181.38 2aco h LYS 37 N 0.15 0.40 0.00 0.00 2.10 -1.98 -1.51 116.57 115.73 2aco h LYS 37 Ca 0.14 -0.02 0.00 0.00 -2.00 0.00 0.00 60.65 58.77 2aco h LYS 37 Cb 0.37 -0.09 0.00 0.00 -0.90 0.00 0.00 32.23 31.61 2aco h LYS 37 CO -0.02 0.27 0.00 0.54 -2.00 0.00 0.00 179.45 178.24 2aco n ARG 38 N -4.49 0.08 0.00 0.07 1.74 -0.56 -2.91 116.66 110.60 2aco n ARG 38 Ca 0.03 0.10 0.13 0.00 -0.77 0.00 0.00 57.85 57.34 2aco n ARG 38 Cb 0.12 -1.60 0.41 0.00 -1.02 0.00 0.00 32.46 30.37 2aco n ARG 38 CO 0.00 0.00 0.00 0.98 -1.52 0.00 0.00 177.63 177.09 2aco n TYR 39 N -1.74 0.00 -1.37 -1.55 9.36 -0.57 -4.88 117.16 116.40 2aco n TYR 39 Ca 0.06 0.00 -0.32 0.00 3.32 0.00 0.00 57.90 60.96 2aco n TYR 39 Cb 0.34 -0.23 0.08 0.00 -0.63 0.00 0.00 39.34 38.91 2aco n TYR 39 CO 0.00 0.00 0.00 -0.51 0.22 0.00 0.00 176.86 176.57 2aco s LEU 40 N -2.74 3.14 0.00 2.98 1.43 -1.15 -4.78 118.68 117.57 2aco s LEU 40 Ca 0.19 1.95 0.00 0.00 -1.03 0.00 0.00 54.13 55.24 2aco s LEU 40 Cb 0.19 -4.54 0.00 0.00 0.03 0.00 0.00 46.19 41.87 2aco s LEU 40 CO 0.58 -2.02 0.00 0.61 0.23 0.00 0.00 176.35 175.74 2aco n GLY 41 N -0.76 -0.89 3.79 -3.19 0.00 -0.06 -4.90 105.19 99.17 2aco n GLY 41 Ca 0.10 -1.82 -0.36 0.00 0.00 0.00 0.00 46.02 43.94 2aco n GLY 41 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2aco s THR 42 N 0.00 5.38 -0.01 2.61 2.01 -1.26 -0.96 115.64 123.41 2aco s THR 42 Ca 0.00 0.17 0.06 0.00 0.31 0.00 0.00 61.69 62.23 2aco s THR 42 Cb 0.00 -3.40 -0.02 0.00 0.01 0.00 0.00 72.50 69.10 2aco s THR 42 CO 0.00 0.52 -0.18 0.26 -0.69 0.00 0.00 174.62 174.53 2aco s TRP 43 N -0.27 1.64 -0.01 4.92 0.52 0.22 -4.64 118.94 121.34 2aco s TRP 43 Ca 0.11 -0.32 -0.17 0.00 0.02 0.00 0.00 56.10 55.74 2aco s TRP 43 Cb -0.12 -1.04 -0.06 0.00 -1.15 0.00 0.00 33.47 31.10 2aco s TRP 43 CO 0.01 -0.01 0.47 0.71 0.02 0.00 0.00 176.95 178.14 2aco s TYR 44 N -0.49 3.71 -0.72 -1.98 1.51 0.18 -1.24 117.35 118.32 2aco s TYR 44 Ca 0.07 1.05 -0.26 0.00 -1.01 0.00 0.00 57.07 56.92 2aco s TYR 44 Cb -0.07 -2.40 0.04 0.00 -0.11 0.00 0.00 41.96 39.42 2aco s TYR 44 CO -0.00 0.53 1.19 -2.00 -1.11 0.00 0.00 175.55 174.15 2aco s GLU 45 N -0.73 3.17 0.11 -0.62 2.12 -0.23 -0.97 118.70 121.55 2aco s GLU 45 Ca 0.26 -0.42 -0.13 0.00 0.36 0.00 0.00 54.97 55.04 2aco s GLU 45 Cb -0.17 -4.19 -0.12 0.00 0.26 0.00 0.00 34.13 29.90 2aco s GLU 45 CO 0.14 -2.05 1.35 0.82 -0.54 0.00 0.00 175.26 174.98 2aco h ILE 46 N 6.01 1.28 -2.85 -3.70 1.08 -1.23 -3.42 117.51 114.69 2aco h ILE 46 Ca -0.28 -1.81 -0.11 0.00 -0.39 0.00 0.00 64.86 62.27 2aco h ILE 46 Cb 1.06 1.81 -0.20 0.00 -3.07 0.00 0.00 36.82 36.41 2aco h ILE 46 CO 1.25 0.58 -0.20 0.00 -0.69 0.00 0.00 178.15 179.09 2aco s ALA 47 N -3.96 -0.95 0.03 1.87 0.00 -1.14 -1.32 121.76 116.29 2aco s ALA 47 Ca -0.11 0.58 -0.07 0.00 0.00 0.00 0.00 51.96 52.36 2aco s ALA 47 Cb 0.09 -0.04 -0.00 0.00 0.00 0.00 0.00 23.12 23.17 2aco s ALA 47 CO 0.89 -0.27 0.14 -0.98 0.00 0.00 0.00 175.76 175.54 2aco s ARG 48 N -1.09 0.62 1.05 0.00 1.70 -0.66 -1.44 118.95 119.14 2aco s ARG 48 Ca -0.11 -0.66 -0.15 0.00 -0.47 0.00 0.00 55.73 54.33 2aco s ARG 48 Cb -0.04 0.25 0.21 0.00 -0.57 0.00 0.00 34.95 34.80 2aco s ARG 48 CO 0.05 -0.17 1.14 -0.06 -1.08 0.00 0.00 175.30 175.18 2aco s PHE 49 N -2.46 1.56 -1.50 5.89 0.40 -0.64 0.03 117.98 121.25 2aco s PHE 49 Ca -0.06 0.67 -0.10 0.00 -0.60 0.00 0.00 56.93 56.84 2aco s PHE 49 Cb -0.02 -3.49 0.01 0.00 0.51 0.00 0.00 43.02 40.03 2aco s PHE 49 CO -0.04 -3.09 2.58 -3.47 0.70 0.00 0.00 175.22 171.91 2aco n ASP 50 N -4.23 7.18 -4.71 1.36 2.03 -1.26 -4.79 116.55 112.13 2aco n ASP 50 Ca 0.10 -2.79 -0.42 0.00 0.52 0.00 0.00 54.79 52.19 2aco n ASP 50 Cb 0.59 -1.54 -0.03 0.00 -0.72 0.00 0.00 41.12 39.42 2aco n ASP 50 CO 0.00 0.00 0.00 -1.00 -1.92 0.00 0.00 177.20 174.28 2aco s HIS 51 N 1.58 2.92 0.34 -0.67 3.76 -1.26 -4.89 115.29 117.07 2aco s HIS 51 Ca 0.59 0.66 0.06 0.00 -0.15 0.00 0.00 55.06 56.22 2aco s HIS 51 Cb 0.16 -3.83 0.73 0.00 1.11 0.00 0.00 32.58 30.75 2aco s HIS 51 CO -0.07 -3.12 1.88 -0.09 -0.85 0.00 0.00 174.74 172.49 2aco h ARG 52 N 7.33 0.77 0.00 1.40 2.43 -1.96 -1.57 114.38 122.78 2aco h ARG 52 Ca -0.42 -0.05 0.00 0.00 -0.81 0.00 0.00 59.98 58.70 2aco h ARG 52 Cb 1.20 -0.17 0.00 0.00 -0.42 0.00 0.00 29.97 30.58 2aco h ARG 52 CO 0.90 0.51 0.00 1.97 -1.51 0.00 0.00 179.97 181.84 2aco n PHE 53 N -4.55 0.00 -0.10 2.20 1.16 -1.26 -2.54 117.46 112.37 2aco n PHE 53 Ca 0.16 0.00 0.00 0.00 -1.87 0.00 0.00 57.45 55.74 2aco n PHE 53 Cb 0.38 0.00 0.00 0.00 -1.61 0.00 0.00 39.48 38.25 2aco n PHE 53 CO 0.00 0.00 0.00 0.39 -1.87 0.00 0.00 176.76 175.28 2aco n GLU 54 N -0.96 1.75 -1.84 3.97 1.02 -0.61 -5.04 120.64 118.94 2aco n GLU 54 Ca 0.22 -1.15 -0.41 0.00 -0.02 0.00 0.00 57.16 55.79 2aco n GLU 54 Cb 0.10 -0.95 -0.02 0.00 -0.02 0.00 0.00 31.44 30.55 2aco n GLU 54 CO 0.00 0.00 0.00 0.50 1.18 0.00 0.00 177.13 178.81 2aco s ARG 55 N -0.66 4.16 0.00 3.49 3.52 -1.05 -1.99 118.95 126.41 2aco s ARG 55 Ca 0.00 2.51 0.00 0.00 -0.13 0.00 0.00 55.73 58.11 2aco s ARG 55 Cb 0.00 -3.04 0.00 0.00 -1.56 0.00 0.00 34.95 30.35 2aco s ARG 55 CO 0.00 -0.57 0.00 0.41 -0.81 0.00 0.00 175.30 174.33 2aco n GLY 56 N 1.99 3.22 3.74 8.12 0.00 -1.26 -5.04 105.19 115.97 2aco n GLY 56 Ca 0.07 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.69 2aco n GLY 56 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2aco s LEU 57 N 0.00 4.58 0.41 0.99 1.43 -0.84 -4.34 118.68 120.90 2aco s LEU 57 Ca 0.00 1.98 0.07 0.00 -1.03 0.00 0.00 54.13 55.16 2aco s LEU 57 Cb 0.00 -3.61 -0.06 0.00 0.03 0.00 0.00 46.19 42.56 2aco s LEU 57 CO 0.00 0.01 0.15 -1.61 0.23 0.00 0.00 176.35 175.13 2aco s GLU 58 N -0.83 2.18 -1.49 1.70 2.02 0.27 -4.83 118.70 117.73 2aco s GLU 58 Ca 0.44 -1.89 -0.13 0.00 0.02 0.00 0.00 54.97 53.41 2aco s GLU 58 Cb -0.27 -1.92 0.09 0.00 0.10 0.00 0.00 34.13 32.13 2aco s GLU 58 CO 0.33 -0.10 0.76 1.63 0.02 0.00 0.00 175.26 177.90 2aco n LYS 59 N -1.19 -4.30 -2.50 1.61 5.02 0.95 -0.56 118.16 117.19 2aco n LYS 59 Ca -0.02 0.53 -0.41 0.00 -2.02 0.00 0.00 58.31 56.39 2aco n LYS 59 Cb 0.65 -5.33 -0.04 0.00 -0.02 0.00 0.00 35.03 30.29 2aco n LYS 59 CO 0.00 0.00 0.00 0.08 -0.52 0.00 0.00 177.40 176.96 2aco s VAL 60 N -3.16 3.88 0.16 -0.18 1.01 -1.26 -4.43 120.40 116.42 2aco s VAL 60 Ca 0.57 1.59 0.06 0.00 0.00 0.00 0.00 61.98 64.21 2aco s VAL 60 Cb -0.30 -4.02 -0.04 0.00 0.00 0.00 0.00 36.38 32.02 2aco s VAL 60 CO 0.71 0.26 -0.13 0.42 0.00 0.00 0.00 175.10 176.36 2aco s THR 61 N -0.11 1.39 -0.06 3.92 -4.23 -0.40 -1.06 115.64 115.09 2aco s THR 61 Ca 0.50 -2.00 0.03 0.00 -1.18 0.00 0.00 61.69 59.05 2aco s THR 61 Cb -0.29 -1.81 0.00 0.00 1.34 0.00 0.00 72.50 71.74 2aco s THR 61 CO 0.34 -0.60 -0.16 0.00 -0.54 0.00 0.00 174.62 173.66 2aco s ALA 62 N -2.85 1.53 -0.15 3.99 0.00 -0.37 -1.36 121.76 122.55 2aco s ALA 62 Ca 0.16 -0.63 0.01 0.00 0.00 0.00 0.00 51.96 51.51 2aco s ALA 62 Cb -0.01 -0.58 0.02 0.00 0.00 0.00 0.00 23.12 22.55 2aco s ALA 62 CO 0.03 0.21 -0.18 0.99 0.00 0.00 0.00 175.76 176.81 2aco s THR 63 N 0.34 1.84 -0.09 0.00 2.01 -0.10 -0.61 115.64 119.03 2aco s THR 63 Ca -0.11 -0.83 -0.02 0.00 0.31 0.00 0.00 61.69 61.05 2aco s THR 63 Cb -0.14 -1.66 -0.03 0.00 0.01 0.00 0.00 72.50 70.67 2aco s THR 63 CO 0.04 0.51 -0.02 -0.31 -0.69 0.00 0.00 174.62 174.15 2aco s TYR 64 N 1.12 3.10 0.04 4.92 2.02 -0.13 -0.93 117.35 127.49 2aco s TYR 64 Ca -0.01 0.09 0.00 0.00 -0.37 0.00 0.00 57.07 56.78 2aco s TYR 64 Cb -0.14 -1.80 -0.03 0.00 -0.40 0.00 0.00 41.96 39.59 2aco s TYR 64 CO -0.07 0.37 -0.04 -1.54 -1.57 0.00 0.00 175.55 172.70 2aco s SER 65 N -0.67 0.47 0.17 2.29 1.04 -0.78 -0.88 113.70 115.34 2aco s SER 65 Ca 0.11 -0.69 -0.30 0.00 0.48 0.00 0.00 55.95 55.55 2aco s SER 65 Cb -0.12 0.12 -0.07 0.00 0.10 0.00 0.00 66.02 66.05 2aco s SER 65 CO 0.02 -0.38 0.96 -0.22 0.98 0.00 0.00 173.24 174.59 2aco s LEU 66 N -2.01 4.57 0.15 2.42 0.20 -1.26 -0.71 118.68 122.04 2aco s LEU 66 Ca -0.07 1.88 0.04 0.00 0.69 0.00 0.00 54.13 56.67 2aco s LEU 66 Cb -0.04 -3.60 -0.04 0.00 -0.43 0.00 0.00 46.19 42.09 2aco s LEU 66 CO -0.04 0.03 0.18 -0.13 -0.29 0.00 0.00 176.35 176.11 2aco s ARG 67 N -0.56 3.09 0.45 1.98 0.52 -0.32 -4.81 118.95 119.30 2aco s ARG 67 Ca 0.44 -0.75 0.13 0.00 -0.52 0.00 0.00 55.73 55.04 2aco s ARG 67 Cb -0.25 -2.77 1.06 0.00 0.52 0.00 0.00 34.95 33.51 2aco s ARG 67 CO 0.31 0.51 2.04 -0.44 0.02 0.00 0.00 175.30 177.75 2aco h ASP 68 N 2.45 0.29 -0.06 0.23 3.32 -1.97 -2.22 116.42 118.45 2aco h ASP 68 Ca -0.48 -0.00 0.00 0.00 0.02 0.00 0.00 57.03 56.57 2aco h ASP 68 Cb 1.19 -0.06 0.00 0.00 0.22 0.00 0.00 39.33 40.68 2aco h ASP 68 CO 0.66 0.19 0.00 -0.90 -1.72 0.00 0.00 179.24 177.47 2aco n ASP 69 N -4.48 0.66 0.00 6.45 5.68 -1.26 -4.89 116.55 118.71 2aco n ASP 69 Ca 0.05 -1.51 0.00 0.00 -0.50 0.00 0.00 54.79 52.83 2aco n ASP 69 Cb 0.23 -0.04 0.00 0.00 -1.14 0.00 0.00 41.12 40.17 2aco n ASP 69 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 2aco n GLY 70 N 0.94 0.83 0.44 6.12 0.00 -0.83 -5.06 105.19 107.63 2aco n GLY 70 Ca 0.15 0.00 -0.03 0.00 0.00 0.00 0.00 46.02 46.15 2aco n GLY 70 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2aco n GLY 71 N -2.00 0.16 3.32 -0.02 0.00 -1.26 -4.78 105.19 100.61 2aco n GLY 71 Ca 0.00 -1.87 -0.30 0.00 0.00 0.00 0.00 46.02 43.84 2aco n GLY 71 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2aco s LEU 72 N 0.00 2.11 0.34 0.99 1.43 0.33 -1.17 118.68 122.71 2aco s LEU 72 Ca 0.08 -0.53 -0.26 0.00 -1.03 0.00 0.00 54.13 52.39 2aco s LEU 72 Cb -0.00 -1.28 -0.09 0.00 0.03 0.00 0.00 46.19 44.84 2aco s LEU 72 CO 0.05 0.28 1.04 0.20 0.23 0.00 0.00 176.35 178.15 2aco s ASN 73 N -0.93 7.05 -0.14 2.29 0.02 0.12 -0.49 114.94 122.85 2aco s ASN 73 Ca 0.11 2.06 0.01 0.00 -1.02 0.00 0.00 52.86 54.02 2aco s ASN 73 Cb -0.10 -2.60 0.02 0.00 0.02 0.00 0.00 41.25 38.59 2aco s ASN 73 CO 0.01 -0.29 -0.18 -0.69 0.02 0.00 0.00 177.10 175.97 2aco s VAL 74 N -1.49 1.81 -0.25 1.60 1.01 -0.08 -1.87 120.40 121.13 2aco s VAL 74 Ca 0.52 -0.81 -0.05 0.00 0.00 0.00 0.00 61.98 61.64 2aco s VAL 74 Cb -0.24 -1.64 -0.01 0.00 0.00 0.00 0.00 36.38 34.49 2aco s VAL 74 CO 0.31 0.50 0.02 -0.63 0.00 0.00 0.00 175.10 175.30 2aco s ILE 75 N 1.11 3.76 -0.16 2.22 -1.09 -0.10 -0.39 121.20 126.55 2aco s ILE 75 Ca -0.02 -0.52 -0.12 0.00 -2.23 0.00 0.00 60.65 57.77 2aco s ILE 75 Cb -0.14 -2.81 -0.05 0.00 -1.58 0.00 0.00 42.46 37.88 2aco s ILE 75 CO -0.06 0.28 0.24 0.20 -1.23 0.00 0.00 174.94 174.36 2aco s ASN 76 N 1.51 6.39 0.06 3.58 -0.87 0.29 -0.93 114.94 124.97 2aco s ASN 76 Ca 0.04 0.45 0.06 0.00 -1.57 0.00 0.00 52.86 51.84 2aco s ASN 76 Cb -0.16 -2.15 -0.03 0.00 -0.02 0.00 0.00 41.25 38.90 2aco s ASN 76 CO 0.00 0.16 -0.15 -0.54 -2.57 0.00 0.00 177.10 174.00 2aco s LYS 77 N 0.23 0.96 0.05 -0.60 1.02 -0.47 -0.85 119.74 120.09 2aco s LYS 77 Ca 0.14 -0.88 -0.28 0.00 0.02 0.00 0.00 55.97 54.98 2aco s LYS 77 Cb -0.13 -1.01 0.09 0.00 -0.52 0.00 0.00 37.83 36.26 2aco s LYS 77 CO 0.03 0.24 0.97 0.20 -0.92 0.00 0.00 175.35 175.86 2aco s GLY 78 N -1.40 -0.35 -0.15 -3.33 0.00 -0.71 -1.27 107.32 100.11 2aco s GLY 78 Ca 0.02 0.63 -0.01 0.00 0.00 0.00 0.00 44.72 45.36 2aco s GLY 78 CO 0.02 0.18 -0.12 -0.47 0.00 0.00 0.00 173.10 172.71 2aco s TYR 79 N -3.11 2.83 -0.56 1.90 6.14 0.28 -0.11 117.35 124.71 2aco s TYR 79 Ca 0.09 -0.77 -0.20 0.00 0.64 0.00 0.00 57.07 56.83 2aco s TYR 79 Cb -0.01 -1.89 0.08 0.00 0.42 0.00 0.00 41.96 40.56 2aco s TYR 79 CO -0.03 -0.31 0.71 1.21 0.64 0.00 0.00 175.55 177.76 2aco s ASN 80 N 0.60 6.21 0.52 4.32 3.04 -0.26 -0.57 114.94 128.80 2aco s ASN 80 Ca -0.07 -1.10 0.30 0.00 0.04 0.00 0.00 52.86 52.03 2aco s ASN 80 Cb -0.16 -2.32 1.31 0.00 -1.54 0.00 0.00 41.25 38.55 2aco s ASN 80 CO 0.03 -1.06 1.97 1.55 -3.04 0.00 0.00 177.10 176.56 2aco h PRO 81 N 9.15 0.00 0.00 0.43 0.13 -1.86 0.13 132.00 139.98 2aco h PRO 81 Ca -0.28 0.00 -0.02 0.00 -0.87 0.00 0.00 66.00 64.83 2aco h PRO 81 Cb 1.09 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 32.22 2aco h PRO 81 CO 1.05 0.09 -0.08 -0.44 -0.23 0.00 0.00 178.00 178.39 2aco h ASP 82 N 0.00 0.00 0.00 1.44 5.19 -1.92 -3.20 116.42 117.93 2aco h ASP 82 Ca -0.00 0.00 0.00 0.00 -0.62 0.00 0.00 57.03 56.41 2aco h ASP 82 Cb 0.53 0.00 0.00 0.00 0.18 0.00 0.00 39.33 40.04 2aco h ASP 82 CO 0.01 0.08 -1.26 0.54 -3.12 0.00 0.00 179.24 175.50 2aco n ARG 83 N -3.16 1.22 -2.98 3.56 5.12 -0.98 -5.02 116.66 114.43 2aco n ARG 83 Ca 0.02 -0.08 -0.20 0.00 -1.93 0.00 0.00 57.85 55.66 2aco n ARG 83 Cb 0.45 -1.25 0.04 0.00 -1.16 0.00 0.00 32.46 30.53 2aco n ARG 83 CO 0.00 0.00 0.00 0.41 -1.93 0.00 0.00 177.63 176.11 2aco n GLY 84 N 1.58 -0.37 3.02 -0.13 0.00 0.42 -5.02 105.19 104.68 2aco n GLY 84 Ca -0.01 0.03 -0.20 0.00 0.00 0.00 0.00 46.02 45.85 2aco n GLY 84 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 2aco s MET 85 N -5.62 0.89 0.29 1.61 -1.94 -1.04 -4.99 119.30 108.50 2aco s MET 85 Ca 0.29 -0.33 -0.29 0.00 -1.71 0.00 0.00 55.69 53.65 2aco s MET 85 Cb -0.13 -0.85 -0.10 0.00 2.01 0.00 0.00 34.83 35.77 2aco s MET 85 CO 0.36 0.16 1.15 -1.58 -0.01 0.00 0.00 175.02 175.11 2aco s TRP 86 N -0.02 3.44 0.15 -0.03 0.52 -1.26 -1.10 118.94 120.64 2aco s TRP 86 Ca 0.00 1.63 0.06 0.00 0.02 0.00 0.00 56.10 57.80 2aco s TRP 86 Cb -0.06 -3.39 -0.04 0.00 -1.15 0.00 0.00 33.47 28.83 2aco s TRP 86 CO 0.00 -0.89 -0.12 -0.65 0.02 0.00 0.00 176.95 175.31 2aco s GLN 87 N -1.54 1.10 0.01 4.98 -0.21 0.84 -4.95 119.66 119.89 2aco s GLN 87 Ca 0.46 -1.41 -0.01 0.00 0.02 0.00 0.00 55.36 54.42 2aco s GLN 87 Cb -0.34 -0.80 -0.01 0.00 1.00 0.00 0.00 33.01 32.86 2aco s GLN 87 CO 0.44 0.13 0.00 -1.14 -2.12 0.00 0.00 175.29 172.60 2aco s GLN 88 N -3.38 0.18 0.13 2.91 0.74 -1.26 -1.74 119.66 117.24 2aco s GLN 88 Ca 0.15 -0.29 0.01 0.00 0.05 0.00 0.00 55.36 55.28 2aco s GLN 88 Cb -0.00 0.07 -0.04 0.00 1.10 0.00 0.00 33.01 34.13 2aco s GLN 88 CO 0.03 -0.03 0.01 -1.54 -0.55 0.00 0.00 175.29 173.20 2aco s SER 89 N -0.74 0.82 -0.04 6.67 1.04 -0.03 -4.99 113.70 116.43 2aco s SER 89 Ca -0.08 -1.14 0.03 0.00 0.48 0.00 0.00 55.95 55.24 2aco s SER 89 Cb -0.05 0.18 0.00 0.00 0.10 0.00 0.00 66.02 66.25 2aco s SER 89 CO -0.00 -0.61 -0.14 -1.61 0.98 0.00 0.00 173.24 171.86 2aco s GLU 90 N -3.95 1.52 0.33 4.02 2.02 -1.26 -0.54 118.70 120.84 2aco s GLU 90 Ca 0.20 -0.49 0.05 0.00 0.02 0.00 0.00 54.97 54.76 2aco s GLU 90 Cb 0.07 -1.33 -0.02 0.00 0.10 0.00 0.00 34.13 32.94 2aco s GLU 90 CO 0.00 0.17 0.19 0.41 0.02 0.00 0.00 175.26 176.05 2aco n GLY 91 N 3.29 3.18 3.22 -1.39 0.00 0.48 -4.92 105.19 109.05 2aco n GLY 91 Ca -0.19 -1.98 -0.17 0.00 0.00 0.00 0.00 46.02 43.68 2aco n GLY 91 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2aco s LYS 92 N -3.30 0.97 -0.02 1.61 1.02 -1.26 -0.90 119.74 117.86 2aco s LYS 92 Ca 0.27 -1.19 0.02 0.00 0.02 0.00 0.00 55.97 55.09 2aco s LYS 92 Cb 0.01 -0.84 0.00 0.00 -0.52 0.00 0.00 37.83 36.49 2aco s LYS 92 CO 0.19 0.16 -0.07 0.00 -0.92 0.00 0.00 175.35 174.71 2aco s ALA 93 N -2.08 0.71 -0.01 5.17 0.00 0.36 -1.29 121.76 124.62 2aco s ALA 93 Ca 0.07 -0.27 0.03 0.00 0.00 0.00 0.00 51.96 51.79 2aco s ALA 93 Cb -0.05 -0.27 -0.00 0.00 0.00 0.00 0.00 23.12 22.80 2aco s ALA 93 CO 0.02 0.12 -0.09 0.71 0.00 0.00 0.00 175.76 176.53 2aco s TYR 94 N 0.17 0.82 0.28 0.00 2.02 -0.25 -0.51 117.35 119.88 2aco s TYR 94 Ca -0.02 -0.17 -0.30 0.00 -0.37 0.00 0.00 57.07 56.21 2aco s TYR 94 Cb -0.07 -0.56 -0.11 0.00 -0.40 0.00 0.00 41.96 40.83 2aco s TYR 94 CO 0.00 -0.05 1.49 -0.06 -1.57 0.00 0.00 175.55 175.37 2aco s PHE 95 N -0.04 2.88 -0.55 2.71 0.08 -1.26 -0.48 117.98 121.32 2aco s PHE 95 Ca 0.01 0.98 0.24 0.00 0.12 0.00 0.00 56.93 58.28 2aco s PHE 95 Cb -0.05 -3.92 0.36 0.00 -0.57 0.00 0.00 43.02 38.83 2aco s PHE 95 CO -0.00 -2.98 1.38 1.79 -0.10 0.00 0.00 175.22 175.31 2aco h THR 96 N 3.40 0.00 0.00 0.64 1.35 -1.79 -3.46 112.91 113.04 2aco h THR 96 Ca -0.47 -0.65 0.00 0.00 -0.55 0.00 0.00 66.41 64.74 2aco h THR 96 Cb 1.22 1.34 0.00 0.00 -1.73 0.00 0.00 68.15 68.98 2aco h THR 96 CO 0.76 0.00 0.00 0.61 -0.25 0.00 0.00 175.52 176.64 2aco n GLY 97 N 1.27 4.93 3.77 5.82 0.00 -1.26 -5.11 105.19 114.61 2aco n GLY 97 Ca 0.03 -0.61 -0.41 0.00 0.00 0.00 0.00 46.02 45.03 2aco n GLY 97 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2aco s ALA 98 N -1.65 3.64 -1.31 4.61 0.00 -1.26 -4.90 121.76 120.89 2aco s ALA 98 Ca 0.00 1.57 0.17 0.00 0.00 0.00 0.00 51.96 53.70 2aco s ALA 98 Cb 0.00 -3.62 0.80 0.00 0.00 0.00 0.00 23.12 20.30 2aco s ALA 98 CO 0.00 -1.03 1.50 -0.35 0.00 0.00 0.00 175.76 175.88 2aco n PRO 99 N 1.12 0.17 0.01 0.00 -0.04 -1.26 -2.08 135.00 132.92 2aco n PRO 99 Ca 0.04 0.15 0.13 0.00 -0.04 0.00 0.00 63.50 63.78 2aco n PRO 99 Cb 0.39 -1.50 0.45 0.00 -0.04 0.00 0.00 33.50 32.79 2aco n PRO 99 CO 0.00 0.00 0.00 0.25 -0.04 0.00 0.00 175.50 175.71 2aco n THR 100 N -1.35 0.04 -3.61 0.52 -2.24 -1.26 -4.58 114.28 101.80 2aco n THR 100 Ca 0.07 -0.03 -0.38 0.00 -2.27 0.00 0.00 64.05 61.44 2aco n THR 100 Cb 0.15 -0.20 -0.11 0.00 -2.10 0.00 0.00 70.33 68.07 2aco n THR 100 CO 0.00 0.00 0.00 -0.60 -0.57 0.00 0.00 175.07 173.90 2aco s ARG 101 N -3.01 3.87 -1.13 -0.78 6.06 -0.88 -0.79 118.95 122.28 2aco s ARG 101 Ca 0.12 -0.37 -0.08 0.00 -2.50 0.00 0.00 55.73 52.90 2aco s ARG 101 Cb 0.18 -3.61 -0.13 0.00 0.06 0.00 0.00 34.95 31.45 2aco s ARG 101 CO 0.61 -0.20 2.99 0.00 -2.50 0.00 0.00 175.30 176.20 2aco n ALA 102 N 5.04 6.87 -4.00 6.12 0.00 -0.50 -4.77 120.51 129.27 2aco n ALA 102 Ca -0.14 -2.89 -0.30 0.00 0.00 0.00 0.00 53.44 50.10 2aco n ALA 102 Cb 0.52 -3.06 -0.16 0.00 0.00 0.00 0.00 19.45 16.74 2aco n ALA 102 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2aco s ALA 103 N 2.04 1.90 0.29 0.00 0.00 -1.26 -1.34 121.76 123.39 2aco s ALA 103 Ca 0.65 -1.03 0.03 0.00 0.00 0.00 0.00 51.96 51.60 2aco s ALA 103 Cb 0.20 -1.16 -0.06 0.00 0.00 0.00 0.00 23.12 22.11 2aco s ALA 103 CO -0.04 -0.59 0.06 -0.51 0.00 0.00 0.00 175.76 174.67 2aco s LEU 104 N 1.45 2.01 -0.07 0.00 1.02 -0.25 -2.42 118.68 120.43 2aco s LEU 104 Ca 0.02 -1.35 0.04 0.00 0.02 0.00 0.00 54.13 52.86 2aco s LEU 104 Cb -0.14 -0.24 -0.02 0.00 0.02 0.00 0.00 46.19 45.81 2aco s LEU 104 CO -0.09 -0.63 -0.19 -1.59 0.02 0.00 0.00 176.35 173.87 2aco s LYS 105 N -3.93 2.70 -0.04 1.70 -2.85 0.37 -1.45 119.74 116.25 2aco s LYS 105 Ca 0.35 -0.79 0.03 0.00 -1.00 0.00 0.00 55.97 54.56 2aco s LYS 105 Cb 0.08 -2.33 0.00 0.00 -2.06 0.00 0.00 37.83 33.52 2aco s LYS 105 CO 0.14 0.43 -0.11 0.08 0.10 0.00 0.00 175.35 175.99 2aco s VAL 106 N -0.26 0.97 -0.64 1.79 1.01 0.06 -1.09 120.40 122.25 2aco s VAL 106 Ca 0.00 -0.45 -0.27 0.00 0.00 0.00 0.00 61.98 61.26 2aco s VAL 106 Cb -0.13 -0.86 0.01 0.00 0.00 0.00 0.00 36.38 35.40 2aco s VAL 106 CO 0.03 0.30 1.43 -0.94 0.00 0.00 0.00 175.10 175.91 2aco s SER 107 N 0.26 6.02 0.24 3.32 1.04 -0.41 -1.10 113.70 123.06 2aco s SER 107 Ca -0.05 0.02 0.17 0.00 0.48 0.00 0.00 55.95 56.56 2aco s SER 107 Cb -0.11 -2.55 0.03 0.00 0.10 0.00 0.00 66.02 63.50 2aco s SER 107 CO 0.01 -1.85 1.28 -0.26 0.98 0.00 0.00 173.24 173.40 2aco h PHE 108 N 11.23 0.00 -2.13 5.02 -1.00 -1.62 -3.41 116.94 125.03 2aco h PHE 108 Ca -0.27 0.00 0.00 0.00 2.81 0.00 0.00 57.97 60.51 2aco h PHE 108 Cb 1.09 0.00 -0.22 0.00 3.61 0.00 0.00 35.95 40.43 2aco h PHE 108 CO 1.07 0.44 -0.08 -0.59 -1.61 0.00 0.00 178.31 177.54 2aco s PHE 109 N -3.00 -1.03 0.00 -0.55 -0.12 -1.22 -4.98 117.98 107.09 2aco s PHE 109 Ca 0.02 2.00 0.00 0.00 -0.05 0.00 0.00 56.93 58.91 2aco s PHE 109 Cb 0.08 0.59 0.00 0.00 -0.63 0.00 0.00 43.02 43.06 2aco s PHE 109 CO 0.76 -0.52 0.00 0.41 -0.05 0.00 0.00 175.22 175.82 2aco n GLY 110 N 4.57 2.81 0.75 1.99 0.00 -1.26 -1.27 105.19 112.78 2aco n GLY 110 Ca -0.18 -0.20 0.04 0.00 0.00 0.00 0.00 46.02 45.68 2aco n GLY 110 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 2aco n PRO 111 N 14.00 2.03 -3.59 1.61 -0.04 -1.26 -4.90 135.00 142.85 2aco n PRO 111 Ca 0.00 -1.19 -0.38 0.00 -0.04 0.00 0.00 63.50 61.88 2aco n PRO 111 Cb 0.00 -1.43 -0.11 0.00 -0.04 0.00 0.00 33.50 31.91 2aco n PRO 111 CO 0.00 0.00 0.00 -0.06 -0.04 0.00 0.00 175.50 175.40 2aco s PHE 112 N -1.64 3.21 -0.08 0.54 0.08 -0.40 -5.01 117.98 114.69 2aco s PHE 112 Ca 0.22 0.04 -0.03 0.00 0.12 0.00 0.00 56.93 57.28 2aco s PHE 112 Cb 0.13 -2.38 -0.04 0.00 -0.57 0.00 0.00 43.02 40.16 2aco s PHE 112 CO 0.12 -0.20 0.06 0.71 -0.10 0.00 0.00 175.22 175.81 2aco s TYR 113 N 1.75 3.33 0.17 0.36 1.51 -1.26 -1.53 117.35 121.68 2aco s TYR 113 Ca 0.07 0.30 0.00 0.00 -1.01 0.00 0.00 57.07 56.44 2aco s TYR 113 Cb -0.16 -1.82 -0.04 0.00 -0.11 0.00 0.00 41.96 39.82 2aco s TYR 113 CO 0.11 0.57 0.04 0.20 -1.11 0.00 0.00 175.55 175.36 2aco s GLY 114 N -1.13 1.20 0.40 0.71 0.00 -0.26 -4.86 107.32 103.39 2aco s GLY 114 Ca 0.16 -1.58 -0.26 0.00 0.00 0.00 0.00 44.72 43.04 2aco s GLY 114 CO 0.06 -1.46 1.28 0.61 0.00 0.00 0.00 173.10 173.59 2aco n GLY 115 N -0.21 0.58 2.63 0.20 0.00 -1.26 -0.76 105.19 106.38 2aco n GLY 115 Ca -0.05 0.23 -0.25 0.00 0.00 0.00 0.00 46.02 45.95 2aco n GLY 115 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 173.32 172.85 2aco s TYR 116 N -1.17 0.24 -0.16 1.61 6.14 -0.52 -3.37 117.35 120.12 2aco s TYR 116 Ca 0.59 -0.26 -0.01 0.00 0.64 0.00 0.00 57.07 58.04 2aco s TYR 116 Cb -0.52 -0.68 0.04 0.00 0.42 0.00 0.00 41.96 41.22 2aco s TYR 116 CO 0.59 -0.46 -0.05 -0.80 0.64 0.00 0.00 175.55 175.47 2aco s ASN 117 N 2.12 2.71 -0.46 4.32 -0.87 0.31 -1.09 114.94 121.98 2aco s ASN 117 Ca 0.02 -0.60 -0.26 0.00 -1.57 0.00 0.00 52.86 50.45 2aco s ASN 117 Cb -0.15 -0.88 0.03 0.00 -0.02 0.00 0.00 41.25 40.22 2aco s ASN 117 CO -0.08 -0.18 0.96 -0.69 -2.57 0.00 0.00 177.10 174.54 2aco s VAL 118 N 1.66 4.43 -0.71 1.60 1.01 -0.45 -0.57 120.40 127.37 2aco s VAL 118 Ca 0.01 0.82 0.16 0.00 0.00 0.00 0.00 61.98 62.97 2aco s VAL 118 Cb -0.15 -4.46 -0.18 0.00 0.00 0.00 0.00 36.38 31.60 2aco s VAL 118 CO -0.08 -0.86 0.65 2.30 0.00 0.00 0.00 175.10 177.12 2aco n ILE 119 N 6.48 0.00 -3.76 2.22 -5.35 0.08 -1.27 119.36 117.77 2aco n ILE 119 Ca 0.07 -0.14 -0.13 0.00 -0.27 0.00 0.00 62.75 62.28 2aco n ILE 119 Cb 0.49 0.95 -0.10 0.00 -1.74 0.00 0.00 39.64 39.24 2aco n ILE 119 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 2aco s ALA 120 N -2.53 -0.83 -0.27 -1.28 0.00 -0.95 -4.77 121.76 111.14 2aco s ALA 120 Ca 0.05 0.69 -0.12 0.00 0.00 0.00 0.00 51.96 52.59 2aco s ALA 120 Cb 0.12 -0.29 0.10 0.00 0.00 0.00 0.00 23.12 23.05 2aco s ALA 120 CO 0.65 -0.21 0.61 -1.17 0.00 0.00 0.00 175.76 175.65 2aco s LEU 121 N -0.47 -0.93 0.64 0.00 2.96 -1.26 -0.61 118.68 119.00 2aco s LEU 121 Ca -0.06 1.43 -0.14 0.00 -0.22 0.00 0.00 54.13 55.14 2aco s LEU 121 Cb -0.04 2.13 -0.02 0.00 0.50 0.00 0.00 46.19 48.77 2aco s LEU 121 CO 0.02 -0.23 1.06 1.51 -1.32 0.00 0.00 176.35 177.39 2aco s ASP 122 N 2.31 5.62 0.26 3.68 -4.77 -1.06 -0.06 116.67 122.64 2aco s ASP 122 Ca -0.07 1.73 0.24 0.00 -3.30 0.00 0.00 52.55 51.15 2aco s ASP 122 Cb -0.09 -2.52 0.98 0.00 -1.09 0.00 0.00 42.92 40.20 2aco s ASP 122 CO -0.18 -1.28 1.72 0.54 0.70 0.00 0.00 175.17 176.67 2aco n ARG 123 N -2.49 0.20 -0.27 2.11 1.74 -0.85 -1.71 116.66 115.39 2aco n ARG 123 Ca 0.08 0.42 0.12 0.00 -0.77 0.00 0.00 57.85 57.70 2aco n ARG 123 Cb 0.53 -1.88 0.27 0.00 -1.02 0.00 0.00 32.46 30.36 2aco n ARG 123 CO 0.00 0.00 0.00 0.39 -1.52 0.00 0.00 177.63 176.50 2aco n GLU 124 N -2.25 2.57 -3.57 5.56 1.02 -1.26 -4.98 120.64 117.73 2aco n GLU 124 Ca 0.02 -2.41 -0.22 0.00 -0.02 0.00 0.00 57.16 54.53 2aco n GLU 124 Cb 0.23 -1.54 0.07 0.00 -0.02 0.00 0.00 31.44 30.19 2aco n GLU 124 CO 0.00 0.00 0.00 0.66 1.18 0.00 0.00 177.13 178.97 2aco n TYR 125 N 1.53 -2.50 -0.09 -0.32 4.02 -0.70 -4.92 117.16 114.18 2aco n TYR 125 Ca 0.22 0.97 -0.08 0.00 -0.01 0.00 0.00 57.90 58.99 2aco n TYR 125 Cb 0.60 -4.91 -0.16 0.00 -0.02 0.00 0.00 39.34 34.85 2aco n TYR 125 CO 0.00 0.00 0.00 0.54 -1.01 0.00 0.00 176.86 176.39 2aco n ARG 126 N -4.60 0.69 -3.83 -0.72 5.12 -1.26 -4.81 116.66 107.26 2aco n ARG 126 Ca -0.12 -0.03 -0.12 0.00 -1.93 0.00 0.00 57.85 55.65 2aco n ARG 126 Cb 0.61 -1.52 -0.12 0.00 -1.16 0.00 0.00 32.46 30.27 2aco n ARG 126 CO 0.00 0.00 0.00 -1.01 -1.93 0.00 0.00 177.63 174.69 2aco s HIS 127 N -2.59 -0.11 -0.02 -1.55 3.76 -1.26 -0.64 115.29 112.87 2aco s HIS 127 Ca -0.10 0.27 -0.13 0.00 -0.15 0.00 0.00 55.06 54.95 2aco s HIS 127 Cb 0.07 0.03 0.02 0.00 1.11 0.00 0.00 32.58 33.81 2aco s HIS 127 CO 0.84 -0.14 0.29 0.00 -0.85 0.00 0.00 174.74 174.87 2aco s ALA 128 N -0.32 -0.72 -0.19 -1.40 0.00 -0.08 -2.56 121.76 116.49 2aco s ALA 128 Ca -0.04 0.33 -0.01 0.00 0.00 0.00 0.00 51.96 52.24 2aco s ALA 128 Cb -0.03 0.00 0.00 0.00 0.00 0.00 0.00 23.12 23.10 2aco s ALA 128 CO 0.01 -0.24 -0.11 -1.17 0.00 0.00 0.00 175.76 174.24 2aco s LEU 129 N -1.14 2.58 -0.08 0.00 2.96 0.22 -0.62 118.68 122.59 2aco s LEU 129 Ca -0.12 -0.48 0.03 0.00 -0.22 0.00 0.00 54.13 53.34 2aco s LEU 129 Cb -0.05 -1.62 0.01 0.00 0.50 0.00 0.00 46.19 45.02 2aco s LEU 129 CO 0.03 0.02 -0.18 -0.69 -1.32 0.00 0.00 176.35 174.21 2aco s VAL 130 N 1.24 1.58 0.26 1.68 1.01 -0.47 -0.74 120.40 124.96 2aco s VAL 130 Ca 0.03 -0.75 0.09 0.00 0.00 0.00 0.00 61.98 61.35 2aco s VAL 130 Cb -0.14 -1.39 -0.04 0.00 0.00 0.00 0.00 36.38 34.80 2aco s VAL 130 CO -0.05 0.45 0.01 0.00 0.00 0.00 0.00 175.10 175.51 2aco n GLY 132 N -0.87 1.22 0.00 0.00 0.00 -0.41 -0.53 105.19 104.60 2aco n GLY 132 Ca -0.07 -1.79 0.13 0.00 0.00 0.00 0.00 46.02 44.29 2aco n GLY 132 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 2aco n PRO 133 N 0.00 0.06 -3.02 1.61 -0.04 -1.22 -4.29 135.00 128.11 2aco n PRO 133 Ca 0.00 0.05 -0.08 0.00 -0.04 0.00 0.00 63.50 63.43 2aco n PRO 133 Cb 0.00 -1.50 -0.00 0.00 -0.04 0.00 0.00 33.50 31.96 2aco n PRO 133 CO 0.00 0.00 0.00 -0.40 -0.04 0.00 0.00 175.50 175.06 2aco n ASP 134 N -1.46 -1.17 -0.59 3.54 5.68 -1.26 -2.29 116.55 118.99 2aco n ASP 134 Ca 0.07 -2.17 0.02 0.00 -0.50 0.00 0.00 54.79 52.22 2aco n ASP 134 Cb 0.29 2.05 0.09 0.00 -1.14 0.00 0.00 41.12 42.41 2aco n ASP 134 CO 0.00 0.00 0.00 0.54 -1.33 0.00 0.00 177.20 176.41 2aco n ARG 135 N -0.37 1.70 0.00 0.11 1.74 -1.26 -2.54 116.66 116.04 2aco n ARG 135 Ca -0.02 -0.74 0.13 0.00 -0.77 0.00 0.00 57.85 56.45 2aco n ARG 135 Cb 0.39 -1.41 0.43 0.00 -1.02 0.00 0.00 32.46 30.86 2aco n ARG 135 CO 0.00 0.00 0.00 -0.25 -1.52 0.00 0.00 177.63 175.86 2aco n ASP 136 N 0.10 1.20 -3.87 0.55 8.00 -1.26 -4.81 116.55 116.46 2aco n ASP 136 Ca 0.07 -1.12 -0.29 0.00 0.71 0.00 0.00 54.79 54.16 2aco n ASP 136 Cb 0.32 0.08 -0.16 0.00 -0.02 0.00 0.00 41.12 41.34 2aco n ASP 136 CO 0.00 0.00 0.00 -0.31 -0.39 0.00 0.00 177.20 176.50 2aco s TYR 137 N -2.31 1.81 -0.19 1.24 1.51 -1.05 -4.65 117.35 113.70 2aco s TYR 137 Ca 0.29 -1.29 -0.19 0.00 -1.01 0.00 0.00 57.07 54.88 2aco s TYR 137 Cb 0.20 -1.35 0.05 0.00 -0.11 0.00 0.00 41.96 40.75 2aco s TYR 137 CO 0.45 -0.68 0.53 -1.17 -1.11 0.00 0.00 175.55 173.58 2aco s LEU 138 N 1.59 -0.04 0.00 -1.29 2.96 -1.26 -1.29 118.68 119.36 2aco s LEU 138 Ca -0.02 1.05 0.02 0.00 -0.22 0.00 0.00 54.13 54.96 2aco s LEU 138 Cb -0.17 1.83 -0.01 0.00 0.50 0.00 0.00 46.19 48.35 2aco s LEU 138 CO -0.07 -0.20 -0.06 0.26 -1.32 0.00 0.00 176.35 174.96 2aco s TRP 139 N 0.23 0.52 -0.22 5.38 0.51 0.29 -1.63 118.94 124.03 2aco s TRP 139 Ca -0.00 -0.15 -0.07 0.00 -2.12 0.00 0.00 56.10 53.76 2aco s TRP 139 Cb -0.04 -0.33 -0.03 0.00 -0.81 0.00 0.00 33.47 32.26 2aco s TRP 139 CO 0.01 -0.02 0.06 0.42 -0.51 0.00 0.00 176.95 176.91 2aco s ILE 140 N -0.30 4.40 0.06 2.03 1.01 -0.52 -1.37 121.20 126.51 2aco s ILE 140 Ca 0.00 -0.15 0.06 0.00 0.00 0.00 0.00 60.65 60.56 2aco s ILE 140 Cb -0.03 -3.02 -0.04 0.00 0.01 0.00 0.00 42.46 39.38 2aco s ILE 140 CO -0.00 0.39 -0.11 -0.76 0.00 0.00 0.00 174.94 174.45 2aco s LEU 141 N 1.11 2.95 -0.02 2.97 1.43 0.20 -0.71 118.68 126.61 2aco s LEU 141 Ca 0.04 -0.34 -0.10 0.00 -1.03 0.00 0.00 54.13 52.70 2aco s LEU 141 Cb -0.14 -1.74 0.01 0.00 0.03 0.00 0.00 46.19 44.35 2aco s LEU 141 CO 0.03 0.22 0.21 -0.55 0.23 0.00 0.00 176.35 176.49 2aco s SER 142 N -1.80 -0.10 0.49 2.29 0.15 -0.15 -0.90 113.70 113.69 2aco s SER 142 Ca 0.18 0.03 0.32 0.00 0.70 0.00 0.00 55.95 57.19 2aco s SER 142 Cb -0.11 0.30 1.38 0.00 -1.71 0.00 0.00 66.02 65.88 2aco s SER 142 CO 0.10 -0.32 1.96 0.03 1.20 0.00 0.00 173.24 176.20 2aco h ARG 143 N 4.51 0.00 -6.59 5.44 2.47 -1.14 0.52 114.38 119.58 2aco h ARG 143 Ca -0.29 0.00 -0.66 0.00 -1.26 0.00 0.00 59.98 57.77 2aco h ARG 143 Cb 1.19 0.00 -0.17 0.00 -1.65 0.00 0.00 29.97 29.34 2aco h ARG 143 CO 0.39 0.00 -0.77 0.95 0.56 0.00 0.00 179.97 181.10 2aco s THR 144 N -3.63 2.96 0.45 2.04 -4.23 -1.26 -4.76 115.64 107.21 2aco s THR 144 Ca 0.01 -1.60 0.26 0.00 -1.18 0.00 0.00 61.69 59.19 2aco s THR 144 Cb 0.09 -2.41 0.29 0.00 1.34 0.00 0.00 72.50 71.81 2aco s THR 144 CO 0.49 0.00 2.10 1.55 -0.54 0.00 0.00 174.62 178.22 2aco h PRO 145 N 3.36 0.00 -6.43 3.99 0.13 -1.86 -3.43 132.00 127.77 2aco h PRO 145 Ca -0.48 0.00 -0.63 0.00 -0.87 0.00 0.00 66.00 64.02 2aco h PRO 145 Cb 1.19 0.00 -0.17 0.00 0.13 0.00 0.00 31.00 32.15 2aco h PRO 145 CO 0.50 0.10 -0.80 0.95 -0.23 0.00 0.00 178.00 178.52 2aco s THR 146 N -4.35 2.37 0.21 1.56 -4.23 -1.26 -4.78 115.64 105.16 2aco s THR 146 Ca -0.03 -2.17 0.11 0.00 -1.18 0.00 0.00 61.69 58.42 2aco s THR 146 Cb 0.14 -2.18 -0.05 0.00 1.34 0.00 0.00 72.50 71.76 2aco s THR 146 CO 0.59 -0.23 -0.22 0.27 -0.54 0.00 0.00 174.62 174.49 2aco s ILE 147 N -2.01 2.27 0.64 2.99 -4.36 -1.26 -5.00 121.20 114.47 2aco s ILE 147 Ca 0.24 -2.12 -0.17 0.00 -0.26 0.00 0.00 60.65 58.34 2aco s ILE 147 Cb -0.07 -2.12 -0.01 0.00 1.25 0.00 0.00 42.46 41.51 2aco s ILE 147 CO 0.12 -0.25 1.18 -0.94 0.24 0.00 0.00 174.94 175.28 2aco s SER 148 N -2.93 4.94 0.51 4.36 1.04 -1.26 -4.88 113.70 115.49 2aco s SER 148 Ca 0.22 2.27 0.20 0.00 0.48 0.00 0.00 55.95 59.12 2aco s SER 148 Cb -0.06 -2.58 1.29 0.00 0.10 0.00 0.00 66.02 64.76 2aco s SER 148 CO 0.11 -1.75 2.06 0.44 0.98 0.00 0.00 173.24 175.07 2aco h ASP 149 N 0.39 0.05 -0.30 7.02 3.32 -2.01 -1.34 116.42 123.55 2aco h ASP 149 Ca -0.49 0.00 -0.10 0.00 0.02 0.00 0.00 57.03 56.47 2aco h ASP 149 Cb 1.28 -0.01 -0.01 0.00 0.22 0.00 0.00 39.33 40.81 2aco h ASP 149 CO 0.53 0.03 -0.19 -0.33 -1.72 0.00 0.00 179.24 177.57 2aco h GLU 150 N 0.06 0.66 -0.46 3.56 3.07 -2.00 -0.72 114.58 118.75 2aco h GLU 150 Ca 0.15 -0.31 -0.11 0.00 -0.50 0.00 0.00 59.36 58.59 2aco h GLU 150 Cb 0.51 -0.01 -0.01 0.00 -0.84 0.00 0.00 28.75 28.40 2aco h GLU 150 CO -0.01 0.90 -0.15 0.28 -1.40 0.00 0.00 179.01 178.63 2aco h VAL 151 N 0.41 1.27 -0.35 3.13 2.07 -1.81 -2.36 116.25 118.61 2aco h VAL 151 Ca 0.06 -1.29 0.06 0.00 0.82 0.00 0.00 66.70 66.35 2aco h VAL 151 Cb 0.73 1.14 -0.05 0.00 -1.52 0.00 0.00 31.29 31.58 2aco h VAL 151 CO 0.05 0.44 0.01 0.50 0.02 0.00 0.00 177.57 178.60 2aco h LYS 152 N 0.76 0.11 -0.88 1.57 3.64 -1.13 -1.84 116.57 118.81 2aco h LYS 152 Ca 0.11 -0.01 0.01 0.00 -1.27 0.00 0.00 60.65 59.49 2aco h LYS 152 Cb 0.71 -0.02 -0.04 0.00 -0.41 0.00 0.00 32.23 32.46 2aco h LYS 152 CO 0.05 0.07 0.58 1.96 -2.27 0.00 0.00 179.45 179.85 2aco h GLN 153 N 0.11 1.16 -0.23 1.90 1.08 -0.95 -1.23 115.11 116.95 2aco h GLN 153 Ca 0.17 -0.07 -0.13 0.00 -1.45 0.00 0.00 58.65 57.17 2aco h GLN 153 Cb 0.23 -0.26 -0.00 0.00 -0.05 0.00 0.00 27.48 27.39 2aco h GLN 153 CO -0.27 0.77 -0.37 1.49 -0.95 0.00 0.00 178.83 179.50 2aco h GLU 154 N 1.19 0.66 -0.50 1.46 4.81 -0.95 -0.84 114.58 120.41 2aco h GLU 154 Ca 0.32 -0.40 -0.05 0.00 -0.13 0.00 0.00 59.36 59.10 2aco h GLU 154 Cb -0.14 0.04 -0.02 0.00 0.63 0.00 0.00 28.75 29.26 2aco h GLU 154 CO -0.07 1.01 0.12 0.52 -0.73 0.00 0.00 179.01 179.86 2aco h MET 155 N 0.36 0.81 -0.78 1.92 2.86 -1.20 -2.60 114.93 116.30 2aco h MET 155 Ca 0.02 -0.20 -0.04 0.00 -2.06 0.00 0.00 59.70 57.43 2aco h MET 155 Cb 0.96 -0.11 -0.04 0.00 0.06 0.00 0.00 31.60 32.48 2aco h MET 155 CO 0.08 0.78 0.34 -0.07 1.06 0.00 0.00 176.91 179.11 2aco h LEU 156 N 0.70 1.04 -0.69 1.22 3.38 -1.12 -1.97 115.31 117.87 2aco h LEU 156 Ca 0.16 -0.14 -0.01 0.00 0.09 0.00 0.00 57.88 57.98 2aco h LEU 156 Cb 0.34 -0.27 -0.03 0.00 0.09 0.00 0.00 40.66 40.79 2aco h LEU 156 CO 0.00 0.90 0.40 0.00 0.09 0.00 0.00 178.44 179.83 2aco h ALA 157 N 1.25 0.89 -0.46 1.53 0.00 -0.99 -0.97 119.26 120.50 2aco h ALA 157 Ca 0.26 -0.10 -0.06 0.00 0.00 0.00 0.00 54.91 55.02 2aco h ALA 157 Cb 0.16 -0.28 -0.02 0.00 0.00 0.00 0.00 17.79 17.66 2aco h ALA 157 CO -0.03 0.38 0.05 0.28 0.00 0.00 0.00 179.25 179.93 2aco h VAL 158 N 0.95 1.25 -0.52 0.00 2.07 -1.11 -1.23 116.25 117.66 2aco h VAL 158 Ca 0.25 -0.96 0.04 0.00 0.82 0.00 0.00 66.70 66.85 2aco h VAL 158 Cb 0.00 0.97 -0.04 0.00 -1.52 0.00 0.00 31.29 30.70 2aco h VAL 158 CO -0.04 0.34 0.27 0.00 0.02 0.00 0.00 177.57 178.15 2aco h ALA 159 N 0.94 0.67 -0.60 1.67 0.00 -1.00 -0.56 119.26 120.37 2aco h ALA 159 Ca 0.14 0.02 -0.06 0.00 0.00 0.00 0.00 54.91 55.00 2aco h ALA 159 Cb 0.43 -0.08 -0.02 0.00 0.00 0.00 0.00 17.79 18.11 2aco h ALA 159 CO 0.01 -0.07 0.13 1.15 0.00 0.00 0.00 179.25 180.48 2aco h THR 160 N 0.53 1.25 -0.86 0.00 2.02 -1.02 -1.61 112.91 113.22 2aco h THR 160 Ca 0.23 -0.94 0.03 0.00 0.77 0.00 0.00 66.41 66.50 2aco h THR 160 Cb 0.12 0.71 -0.05 0.00 -1.74 0.00 0.00 68.15 67.19 2aco h THR 160 CO -0.15 0.35 0.56 -0.09 0.37 0.00 0.00 175.52 176.56 2aco h ARG 161 N 0.88 1.06 -0.27 6.66 2.43 -0.70 -1.93 114.38 122.51 2aco h ARG 161 Ca 0.19 -0.06 0.00 0.00 -0.81 0.00 0.00 59.98 59.29 2aco h ARG 161 Cb 0.38 -0.24 0.00 0.00 -0.42 0.00 0.00 29.97 29.69 2aco h ARG 161 CO 0.01 0.70 0.00 0.39 -1.51 0.00 0.00 179.97 179.55 2aco n GLU 162 N -4.54 1.44 -0.36 0.20 -0.58 -0.26 -4.89 120.64 111.64 2aco n GLU 162 Ca 0.11 -0.59 0.00 0.00 -0.42 0.00 0.00 57.16 56.26 2aco n GLU 162 Cb 0.08 -1.21 0.00 0.00 -0.57 0.00 0.00 31.44 29.75 2aco n GLU 162 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 2aco n GLY 163 N 0.66 0.77 3.87 0.62 0.00 -0.72 -4.99 105.19 105.39 2aco n GLY 163 Ca 0.05 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.77 2aco n GLY 163 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 2aco s PHE 164 N -2.25 3.44 -0.69 1.61 0.40 -0.65 -5.01 117.98 114.83 2aco s PHE 164 Ca 0.00 1.00 -0.18 0.00 -0.60 0.00 0.00 56.93 57.15 2aco s PHE 164 Cb 0.00 -2.39 0.13 0.00 0.51 0.00 0.00 43.02 41.28 2aco s PHE 164 CO 0.00 0.04 0.76 0.34 0.70 0.00 0.00 175.22 177.06 2aco s ASP 165 N -2.82 6.37 0.22 1.36 2.15 -1.26 -4.19 116.67 118.51 2aco s ASP 165 Ca 0.50 -1.83 0.18 0.00 0.43 0.00 0.00 52.55 51.84 2aco s ASP 165 Cb -0.10 -2.29 0.88 0.00 -0.30 0.00 0.00 42.92 41.11 2aco s ASP 165 CO 0.26 -0.97 1.55 1.33 -0.17 0.00 0.00 175.17 177.18 2aco n VAL 166 N 5.18 1.13 0.93 1.11 0.24 -1.26 -1.52 118.33 124.13 2aco n VAL 166 Ca -0.00 0.51 0.10 0.00 -2.04 0.00 0.00 64.34 62.91 2aco n VAL 166 Cb 0.44 -1.47 0.50 0.00 -1.47 0.00 0.00 33.84 31.85 2aco n VAL 166 CO 0.00 0.00 0.00 -1.20 -2.14 0.00 0.00 176.83 173.49 2aco n SER 167 N -2.06 0.00 0.09 -1.34 7.64 -1.26 -2.31 113.62 114.37 2aco n SER 167 Ca 0.00 0.05 0.13 0.00 1.01 0.00 0.00 58.87 60.07 2aco n SER 167 Cb 0.10 -0.31 0.45 0.00 -1.01 0.00 0.00 64.21 63.43 2aco n SER 167 CO 0.00 0.00 0.00 0.29 -3.01 0.00 0.00 175.04 172.32 2aco n LYS 168 N -1.31 0.21 -1.78 1.43 5.02 -0.58 -4.89 118.16 116.26 2aco n LYS 168 Ca 0.09 0.22 -0.42 0.00 -2.02 0.00 0.00 58.31 56.18 2aco n LYS 168 Cb 0.17 -1.76 -0.02 0.00 -0.02 0.00 0.00 35.03 33.39 2aco n LYS 168 CO 0.00 0.00 0.00 -0.06 -0.52 0.00 0.00 177.40 176.82 2aco s PHE 169 N -3.12 2.85 -0.15 2.13 0.08 -0.98 -4.32 117.98 114.47 2aco s PHE 169 Ca 0.10 0.60 -0.18 0.00 0.12 0.00 0.00 56.93 57.56 2aco s PHE 169 Cb 0.13 -4.08 -0.04 0.00 -0.57 0.00 0.00 43.02 38.46 2aco s PHE 169 CO 0.55 -3.85 0.50 0.42 -0.10 0.00 0.00 175.22 172.73 2aco s ILE 170 N 0.57 5.16 -0.50 0.64 1.01 0.10 -4.95 121.20 123.24 2aco s ILE 170 Ca 0.68 0.97 -0.20 0.00 0.00 0.00 0.00 60.65 62.10 2aco s ILE 170 Cb -0.48 -3.83 0.05 0.00 0.01 0.00 0.00 42.46 38.20 2aco s ILE 170 CO 0.40 0.27 0.69 0.26 0.00 0.00 0.00 174.94 176.56 2aco s TRP 171 N 0.98 3.00 0.05 3.97 0.52 -1.26 -1.65 118.94 124.56 2aco s TRP 171 Ca 0.26 -0.32 -0.30 0.00 0.02 0.00 0.00 56.10 55.76 2aco s TRP 171 Cb -0.15 -3.59 -0.05 0.00 -1.15 0.00 0.00 33.47 28.53 2aco s TRP 171 CO 0.10 -1.05 1.08 0.08 0.02 0.00 0.00 176.95 177.18 2aco s VAL 172 N 2.93 4.41 0.13 4.03 1.01 -0.43 -4.97 120.40 127.51 2aco s VAL 172 Ca 0.20 1.78 -0.31 0.00 0.00 0.00 0.00 61.98 63.64 2aco s VAL 172 Cb -0.17 -4.14 -0.11 0.00 0.00 0.00 0.00 36.38 31.97 2aco s VAL 172 CO 0.15 0.17 1.82 -1.10 0.00 0.00 0.00 175.10 176.13 2aco s GLN 173 N 0.82 4.14 0.20 2.72 -1.52 -1.26 -4.83 119.66 119.92 2aco s GLN 173 Ca 0.54 2.60 0.02 0.00 -1.95 0.00 0.00 55.36 56.56 2aco s GLN 173 Cb -0.25 -3.53 -0.05 0.00 -0.22 0.00 0.00 33.01 28.96 2aco s GLN 173 CO 0.29 -0.83 0.03 -0.65 -0.25 0.00 0.00 175.29 173.88 2aco s GLN 174 N 2.55 1.20 0.18 2.91 -1.52 -1.26 -0.03 119.66 123.69 2aco s GLN 174 Ca 0.80 -1.60 -0.32 0.00 -1.95 0.00 0.00 55.36 52.29 2aco s GLN 174 Cb -0.46 -0.28 -0.11 0.00 -0.22 0.00 0.00 33.01 31.93 2aco s GLN 174 CO 0.36 -0.17 1.67 -2.14 -0.25 0.00 0.00 175.29 174.76 2aco s PRO 175 N -3.94 4.16 0.00 2.91 0.01 -1.26 -0.88 135.00 135.99 2aco s PRO 175 Ca 0.28 2.51 0.00 0.00 0.01 0.00 0.00 61.00 63.80 2aco s PRO 175 Cb 0.06 -3.14 0.00 0.00 0.01 0.00 0.00 34.50 31.43 2aco s PRO 175 CO 0.07 -0.71 0.00 0.41 0.01 0.00 0.00 177.00 176.78 2aco n GLY 176 N 3.91 1.73 0.00 0.52 0.00 -1.26 -4.51 105.19 105.58 2aco n GLY 176 Ca 0.15 0.00 0.08 0.00 0.00 0.00 0.00 46.02 46.25 2aco n GLY 176 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06