#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2dkt s SER 2 N 0.00 3.10 -0.59 1.61 0.15 -1.26 -5.08 113.70 111.63 2dkt s SER 2 Ca 0.00 -0.97 -0.02 0.00 0.70 0.00 0.00 55.95 55.66 2dkt s SER 2 Cb 0.00 -0.60 0.15 0.00 -1.71 0.00 0.00 66.02 63.87 2dkt s SER 2 CO 0.00 -0.34 0.40 -0.55 1.20 0.00 0.00 173.24 173.95 2dkt s SER 3 N 1.86 5.12 0.03 5.45 0.15 -1.26 -5.04 113.70 120.01 2dkt s SER 3 Ca 0.02 -2.80 -0.28 0.00 0.70 0.00 0.00 55.95 53.58 2dkt s SER 3 Cb -0.17 -1.82 0.09 0.00 -1.71 0.00 0.00 66.02 62.41 2dkt s SER 3 CO -0.13 -0.37 0.99 -0.83 1.20 0.00 0.00 173.24 174.10 2dkt s GLY 4 N 0.66 -0.36 -0.46 9.45 0.00 -1.26 -5.10 107.32 110.25 2dkt s GLY 4 Ca 0.16 0.73 -0.27 0.00 0.00 0.00 0.00 44.72 45.35 2dkt s GLY 4 CO -0.03 0.22 2.25 -0.56 0.00 0.00 0.00 173.10 174.98 2dkt s SER 5 N -2.66 4.81 -0.04 1.64 0.01 -1.26 -4.92 113.70 111.29 2dkt s SER 5 Ca 0.09 1.08 -0.02 0.00 1.31 0.00 0.00 55.95 58.41 2dkt s SER 5 Cb -0.01 -2.51 0.03 0.00 0.21 0.00 0.00 66.02 63.75 2dkt s SER 5 CO -0.04 -2.60 0.06 -0.94 0.41 0.00 0.00 173.24 170.13 2dkt s SER 6 N 10.56 1.07 0.61 2.44 1.04 -1.26 -5.10 113.70 123.07 2dkt s SER 6 Ca 0.92 0.07 0.00 0.00 0.48 0.00 0.00 55.95 57.42 2dkt s SER 6 Cb -0.19 -0.14 0.00 0.00 0.10 0.00 0.00 66.02 65.79 2dkt s SER 6 CO 0.27 -0.24 0.00 0.61 0.98 0.00 0.00 173.24 174.86 2dkt n GLY 7 N 5.22 -3.54 0.00 7.32 0.00 -1.26 -5.07 105.19 107.87 2dkt n GLY 7 Ca -0.05 -1.01 0.00 0.00 0.00 0.00 0.00 46.02 44.96 2dkt n GLY 7 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2dkt n GLY 8 N -3.93 2.92 0.00 -0.02 0.00 -1.26 -5.09 105.19 97.81 2dkt n GLY 8 Ca -0.07 -0.24 0.00 0.00 0.00 0.00 0.00 46.02 45.70 2dkt n GLY 8 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 2dkt n VAL 9 N 0.00 0.00 -3.92 1.61 0.31 -1.26 -5.09 118.33 109.99 2dkt n VAL 9 Ca 0.00 0.00 -0.09 0.00 -0.01 0.00 0.00 64.34 64.24 2dkt n VAL 9 Cb 0.00 -0.66 -0.09 0.00 -0.91 0.00 0.00 33.84 32.18 2dkt n VAL 9 CO 0.00 0.00 0.00 -0.13 -1.32 0.00 0.00 176.83 175.38 2dkt s ARG 10 N -1.94 0.61 0.02 5.55 0.52 -1.26 -5.17 118.95 117.28 2dkt s ARG 10 Ca 0.00 -0.75 -0.19 0.00 -0.52 0.00 0.00 55.73 54.27 2dkt s ARG 10 Cb 0.00 0.24 0.04 0.00 0.52 0.00 0.00 34.95 35.75 2dkt s ARG 10 CO 0.00 -0.16 0.44 -0.80 0.02 0.00 0.00 175.30 174.80 2dkt s ASN 11 N -2.15 -0.33 0.98 0.23 0.01 -1.26 -5.15 114.94 107.27 2dkt s ASN 11 Ca -0.05 0.12 -0.16 0.00 -0.71 0.00 0.00 52.86 52.06 2dkt s ASN 11 Cb -0.01 0.42 -0.11 0.00 0.41 0.00 0.00 41.25 41.97 2dkt s ASN 11 CO -0.05 -0.63 -0.52 0.00 -1.51 0.00 0.00 177.10 174.39 2dkt n LEU 12 N 0.68 -4.70 -3.60 0.60 -0.00 -1.26 -5.01 117.00 103.71 2dkt n LEU 12 Ca -0.19 0.22 -0.08 0.00 -0.00 0.00 0.00 56.01 55.96 2dkt n LEU 12 Cb 0.59 -0.86 -0.05 0.00 -0.00 0.00 0.00 43.42 43.10 2dkt n LEU 12 CO 0.21 -5.49 0.90 0.00 -0.00 0.00 0.00 177.39 173.01 2dkt s ALA 13 N -2.09 -1.99 -0.10 1.47 0.00 -1.26 -5.16 121.76 112.63 2dkt s ALA 13 Ca 0.44 1.68 0.02 0.00 0.00 0.00 0.00 51.96 54.09 2dkt s ALA 13 Cb -0.19 -0.93 -0.02 0.00 0.00 0.00 0.00 23.12 21.98 2dkt s ALA 13 CO 0.79 -0.30 -0.16 -0.65 0.00 0.00 0.00 175.76 175.44 2dkt s GLN 14 N -1.14 3.05 0.00 0.00 -1.52 -1.26 -5.06 119.66 113.73 2dkt s GLN 14 Ca 0.02 -0.73 0.00 0.00 -1.95 0.00 0.00 55.36 52.69 2dkt s GLN 14 Cb -0.01 -2.48 0.00 0.00 -0.22 0.00 0.00 33.01 30.30 2dkt s GLN 14 CO -0.02 0.32 0.00 0.41 -0.25 0.00 0.00 175.29 175.76 2dkt n GLY 15 N 3.18 -0.14 0.00 3.09 0.00 -1.26 -4.88 105.19 105.18 2dkt n GLY 15 Ca -0.18 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.84 2dkt n GLY 15 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 2dkt n PRO 16 N -1.59 -0.56 -2.38 1.61 -0.04 -1.26 -4.02 135.00 126.77 2dkt n PRO 16 Ca 0.00 0.00 -0.20 0.00 -0.04 0.00 0.00 63.50 63.26 2dkt n PRO 16 Cb 0.00 0.00 -0.01 0.00 -0.04 0.00 0.00 33.50 33.45 2dkt n PRO 16 CO 0.00 0.00 0.00 0.54 -0.04 0.00 0.00 175.50 176.00 2dkt n ARG 17 N -1.16 -1.61 -0.39 0.54 3.00 -1.26 -4.52 116.66 111.26 2dkt n ARG 17 Ca 0.00 0.98 0.00 0.00 -0.01 0.00 0.00 57.85 58.82 2dkt n ARG 17 Cb 0.00 -5.60 0.00 0.00 0.00 0.00 0.00 32.46 26.86 2dkt n ARG 17 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.63 178.04 2dkt n GLY 18 N -1.02 -1.81 3.72 -0.13 0.00 -0.77 -4.84 105.19 100.35 2dkt n GLY 18 Ca -0.24 -0.89 -0.23 0.00 0.00 0.00 0.00 46.02 44.66 2dkt n GLY 18 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2dkt h GLU 20 N 1.65 0.01 0.35 0.00 4.39 -1.91 -0.95 114.58 118.11 2dkt h GLU 20 Ca -0.45 -0.00 -0.02 0.00 0.34 0.00 0.00 59.36 59.23 2dkt h GLU 20 Cb 1.25 -0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.90 2dkt h GLU 20 CO 0.61 0.00 -0.17 0.45 -1.16 0.00 0.00 179.01 178.75 2dkt h HIS 21 N 0.01 -0.44 -3.99 4.33 3.86 -1.99 -3.46 115.15 113.47 2dkt h HIS 21 Ca 0.77 -0.01 -0.20 0.00 -1.16 0.00 0.00 60.37 59.76 2dkt h HIS 21 Cb 3.05 0.14 -0.20 0.00 1.06 0.00 0.00 27.41 31.46 2dkt h HIS 21 CO -0.00 -0.27 -0.71 0.71 0.86 0.00 0.00 177.93 178.52 2dkt s TYR 22 N -3.70 0.46 -0.71 2.45 1.51 -0.36 -5.11 117.35 111.89 2dkt s TYR 22 Ca -0.07 -0.59 -0.16 0.00 -1.01 0.00 0.00 57.07 55.24 2dkt s TYR 22 Cb 0.01 -0.30 0.16 0.00 -0.11 0.00 0.00 41.96 41.72 2dkt s TYR 22 CO 0.21 -0.17 0.72 -0.51 -1.11 0.00 0.00 175.55 174.68 2dkt s ASP 23 N -1.73 6.46 0.15 2.29 1.11 -1.26 -1.60 116.67 122.10 2dkt s ASP 23 Ca -0.10 -2.10 -0.00 0.00 0.18 0.00 0.00 52.55 50.52 2dkt s ASP 23 Cb -0.07 -2.25 -0.04 0.00 1.07 0.00 0.00 42.92 41.62 2dkt s ASP 23 CO -0.02 -0.82 0.04 0.00 1.18 0.00 0.00 175.17 175.55 2dkt s ARG 24 N 1.37 0.99 -0.22 8.23 1.70 -1.26 -0.68 118.95 129.09 2dkt s ARG 24 Ca 0.14 -1.48 0.11 0.00 -0.47 0.00 0.00 55.73 54.04 2dkt s ARG 24 Cb -0.18 0.06 0.43 0.00 -0.57 0.00 0.00 34.95 34.69 2dkt s ARG 24 CO -0.02 -0.22 1.21 0.00 -1.08 0.00 0.00 175.30 175.19 2dkt n ALA 25 N -0.15 3.88 -3.66 7.88 0.00 -1.25 -1.84 120.51 125.37 2dkt n ALA 25 Ca -0.06 -3.34 -0.08 0.00 0.00 0.00 0.00 53.44 49.96 2dkt n ALA 25 Cb 0.64 -0.39 -0.08 0.00 0.00 0.00 0.00 19.45 19.61 2dkt n ALA 25 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2dkt s LEU 27 N 1.75 4.60 -0.13 0.00 1.02 0.18 -4.78 118.68 121.32 2dkt s LEU 27 Ca -0.09 1.83 -0.19 0.00 0.02 0.00 0.00 54.13 55.71 2dkt s LEU 27 Cb -0.08 -3.54 -0.04 0.00 0.02 0.00 0.00 46.19 42.56 2dkt s LEU 27 CO -0.16 0.16 0.51 -1.48 0.02 0.00 0.00 176.35 175.39 2dkt s LEU 28 N -1.25 4.26 0.45 1.79 0.05 -1.16 -0.02 118.68 122.80 2dkt s LEU 28 Ca 0.40 0.83 -0.24 0.00 0.05 0.00 0.00 54.13 55.17 2dkt s LEU 28 Cb -0.24 -2.74 -0.07 0.00 -2.05 0.00 0.00 46.19 41.09 2dkt s LEU 28 CO 0.29 -0.04 1.26 -0.75 -0.55 0.00 0.00 176.35 176.57 2dkt s LYS 29 N 0.80 3.72 -0.41 1.48 2.47 -1.20 -3.48 119.74 123.13 2dkt s LYS 29 Ca 0.27 2.04 -0.09 0.00 -1.56 0.00 0.00 55.97 56.63 2dkt s LYS 29 Cb -0.15 -2.53 0.07 0.00 -1.46 0.00 0.00 37.83 33.76 2dkt s LYS 29 CO 0.11 -0.66 0.23 0.00 0.16 0.00 0.00 175.35 175.19 2dkt s ALA 30 N -1.37 3.25 -2.00 3.13 0.00 0.22 -4.74 121.76 120.25 2dkt s ALA 30 Ca 0.62 -2.10 0.11 0.00 0.00 0.00 0.00 51.96 50.59 2dkt s ALA 30 Cb -0.35 -2.59 0.65 0.00 0.00 0.00 0.00 23.12 20.83 2dkt s ALA 30 CO 0.44 -1.61 1.08 -0.35 0.00 0.00 0.00 175.76 175.32 2dkt n PRO 31 N 4.89 0.49 -0.10 0.00 -0.04 -1.26 0.21 135.00 139.20 2dkt n PRO 31 Ca -0.10 0.00 -0.22 0.00 -0.04 0.00 0.00 63.50 63.14 2dkt n PRO 31 Cb 0.43 -1.34 -0.12 0.00 -0.04 0.00 0.00 33.50 32.43 2dkt n PRO 31 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2dkt n ASP 34 N -0.16 -6.14 -4.83 0.00 2.03 0.57 -4.99 116.55 103.03 2dkt n ASP 34 Ca 0.00 -0.51 -0.28 0.00 0.52 0.00 0.00 54.79 54.52 2dkt n ASP 34 Cb 0.15 -4.86 -0.04 0.00 -0.72 0.00 0.00 41.12 35.64 2dkt n ASP 34 CO 0.00 0.00 0.00 -0.54 -1.92 0.00 0.00 177.20 174.74 2dkt s LYS 35 N -6.22 2.24 -0.09 -0.67 1.02 -1.17 -4.82 119.74 110.04 2dkt s LYS 35 Ca 0.54 -2.07 -0.01 0.00 0.02 0.00 0.00 55.97 54.44 2dkt s LYS 35 Cb -0.24 -1.92 0.03 0.00 -0.52 0.00 0.00 37.83 35.17 2dkt s LYS 35 CO 0.66 -0.42 -0.03 -0.51 -0.92 0.00 0.00 175.35 174.13 2dkt s LEU 36 N -4.08 0.85 0.06 3.17 1.43 -1.26 0.70 118.68 119.55 2dkt s LEU 36 Ca 0.28 -0.18 0.05 0.00 -1.03 0.00 0.00 54.13 53.26 2dkt s LEU 36 Cb 0.00 -0.61 -0.03 0.00 0.03 0.00 0.00 46.19 45.59 2dkt s LEU 36 CO 0.17 -0.16 -0.15 -0.31 0.23 0.00 0.00 176.35 176.13 2dkt s TYR 37 N 1.84 1.28 0.06 0.29 1.51 -1.23 -4.96 117.35 116.13 2dkt s TYR 37 Ca 0.05 -0.41 -0.11 0.00 -1.01 0.00 0.00 57.07 55.58 2dkt s TYR 37 Cb -0.12 -0.73 -0.02 0.00 -0.11 0.00 0.00 41.96 40.97 2dkt s TYR 37 CO -0.06 0.06 0.86 2.41 -1.11 0.00 0.00 175.55 177.71 2dkt n THR 38 N 1.51 -0.24 -4.26 -0.71 -1.04 -1.26 -3.01 114.28 105.27 2dkt n THR 38 Ca -0.20 1.32 -0.14 0.00 -2.04 0.00 0.00 64.05 63.00 2dkt n THR 38 Cb 0.54 -1.68 -0.04 0.00 -1.82 0.00 0.00 70.33 67.33 2dkt n THR 38 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 2dkt h ARG 40 N 0.00 0.10 -0.21 0.00 -0.00 -1.93 -3.01 114.38 109.34 2dkt h ARG 40 Ca -0.17 -0.06 -0.16 0.00 -0.00 0.00 0.00 59.98 59.59 2dkt h ARG 40 Cb 0.69 0.00 -0.01 0.00 -0.00 0.00 0.00 29.97 30.66 2dkt h ARG 40 CO 0.27 0.58 -0.54 -0.07 -0.00 0.00 0.00 179.97 180.22 2dkt h LEU 41 N 0.08 0.68 -0.52 0.08 3.38 -1.96 -3.18 115.31 113.88 2dkt h LEU 41 Ca 0.00 -0.36 -0.00 0.00 0.09 0.00 0.00 57.88 57.61 2dkt h LEU 41 Cb 0.92 -0.20 -0.03 0.00 0.09 0.00 0.00 40.66 41.45 2dkt h LEU 41 CO 0.07 1.09 0.32 0.00 0.09 0.00 0.00 178.44 180.01 2dkt h HIS 43 N 0.69 -1.19 -0.88 0.00 -0.00 -1.52 0.11 115.15 112.36 2dkt h HIS 43 Ca 0.19 0.03 0.14 0.00 -0.00 0.00 0.00 60.37 60.72 2dkt h HIS 43 Cb -0.03 0.50 -0.07 0.00 -0.00 0.00 0.00 27.41 27.81 2dkt h HIS 43 CO -0.03 -0.48 0.57 0.22 -0.00 0.00 0.00 177.93 178.21 2dkt h ASP 44 N -0.63 0.65 -0.27 3.26 3.58 -1.56 0.21 116.42 121.66 2dkt h ASP 44 Ca -0.01 0.04 -0.04 0.00 0.42 0.00 0.00 57.03 57.44 2dkt h ASP 44 Cb 0.62 -0.09 -0.02 0.00 1.72 0.00 0.00 39.33 41.56 2dkt h ASP 44 CO -0.20 0.33 0.06 0.74 -2.88 0.00 0.00 179.24 177.30 2dkt h THR 45 N 0.69 1.18 -0.39 2.25 2.02 -0.36 -2.40 112.91 115.89 2dkt h THR 45 Ca 0.44 -0.65 -0.10 0.00 0.77 0.00 0.00 66.41 66.87 2dkt h THR 45 Cb 0.70 0.84 -0.06 0.00 -1.74 0.00 0.00 68.15 67.89 2dkt h THR 45 CO -0.20 0.23 0.04 0.59 0.37 0.00 0.00 175.52 176.56 2dkt n ASN 46 N -4.32 3.69 -3.86 4.18 3.02 0.11 -4.98 115.26 113.09 2dkt n ASN 46 Ca 0.02 -3.28 -0.09 0.00 -0.03 0.00 0.00 54.58 51.20 2dkt n ASN 46 Cb 0.20 -0.62 -0.07 0.00 -0.61 0.00 0.00 39.78 38.68 2dkt n ASN 46 CO 0.00 0.00 0.00 -1.61 -2.62 0.00 0.00 177.26 173.03 2dkt s GLU 47 N -2.99 0.84 0.12 3.52 0.41 0.50 -5.00 118.70 116.10 2dkt s GLU 47 Ca 0.46 -0.97 0.24 0.00 -0.41 0.00 0.00 54.97 54.29 2dkt s GLU 47 Cb 0.38 0.34 0.36 0.00 -1.78 0.00 0.00 34.13 33.44 2dkt s GLU 47 CO 0.07 -0.26 1.34 -0.25 -0.49 0.00 0.00 175.26 175.67 2dkt n ASP 48 N -0.06 0.70 -4.62 -0.19 9.92 -1.26 -4.70 116.55 116.33 2dkt n ASP 48 Ca -0.15 0.13 -0.24 0.00 -0.53 0.00 0.00 54.79 54.00 2dkt n ASP 48 Cb 0.62 0.13 -0.08 0.00 -0.64 0.00 0.00 41.12 41.15 2dkt n ASP 48 CO 0.00 0.00 0.00 -1.38 0.13 0.00 0.00 177.20 175.95 2dkt s HIS 49 N -3.16 2.67 -0.04 1.24 -3.43 -1.26 -5.12 115.29 106.19 2dkt s HIS 49 Ca 0.06 -0.22 -0.14 0.00 -0.80 0.00 0.00 55.06 53.97 2dkt s HIS 49 Cb 0.13 -1.21 -0.05 0.00 -1.43 0.00 0.00 32.58 30.02 2dkt s HIS 49 CO 0.72 0.60 0.36 -1.14 -2.00 0.00 0.00 174.74 173.27 2dkt s GLN 50 N -3.45 3.88 0.13 -0.38 0.74 -1.26 -4.33 119.66 114.99 2dkt s GLN 50 Ca 0.30 0.30 0.04 0.00 0.05 0.00 0.00 55.36 56.05 2dkt s GLN 50 Cb -0.07 -3.24 -0.04 0.00 1.10 0.00 0.00 33.01 30.76 2dkt s GLN 50 CO 0.19 0.65 0.15 -1.17 -0.55 0.00 0.00 175.29 174.56 2dkt s LEU 51 N -0.89 3.94 0.57 3.68 0.20 -1.26 -5.04 118.68 119.89 2dkt s LEU 51 Ca 0.22 -0.01 -0.03 0.00 0.69 0.00 0.00 54.13 54.99 2dkt s LEU 51 Cb -0.16 -2.56 0.02 0.00 -0.43 0.00 0.00 46.19 43.06 2dkt s LEU 51 CO 0.11 0.10 0.85 -0.62 -0.29 0.00 0.00 176.35 176.50 2dkt s ASP 52 N -2.88 5.44 0.00 3.68 -1.08 -1.26 -5.00 116.67 115.58 2dkt s ASP 52 Ca 0.31 0.44 0.02 0.00 -0.52 0.00 0.00 52.55 52.81 2dkt s ASP 52 Cb -0.11 -1.41 -0.00 0.00 -1.46 0.00 0.00 42.92 39.94 2dkt s ASP 52 CO 0.24 -1.10 0.31 -2.11 0.52 0.00 0.00 175.17 173.03 2dkt n ARG 53 N -2.49 3.01 -0.10 4.34 1.85 -1.26 -4.65 116.66 117.35 2dkt n ARG 53 Ca 0.05 -0.30 -0.14 0.00 -1.00 0.00 0.00 57.85 56.46 2dkt n ARG 53 Cb 0.58 -0.80 -0.10 0.00 -1.05 0.00 0.00 32.46 31.10 2dkt n ARG 53 CO 0.00 0.00 0.00 1.19 -0.01 0.00 0.00 177.63 178.81 2dkt n PHE 54 N -0.49 0.00 0.13 2.89 3.72 -1.26 -4.40 117.46 118.05 2dkt n PHE 54 Ca 0.01 0.00 -0.08 0.00 -0.05 0.00 0.00 57.45 57.33 2dkt n PHE 54 Cb 0.04 -0.80 -0.04 0.00 -0.94 0.00 0.00 39.48 37.73 2dkt n PHE 54 CO 0.00 0.00 0.00 0.87 -0.05 0.00 0.00 176.76 177.58 2dkt h LYS 55 N 0.00 -0.43 -6.29 -1.08 1.57 -1.94 -3.43 116.57 104.97 2dkt h LYS 55 Ca -0.46 0.03 -0.64 0.00 -1.87 0.00 0.00 60.65 57.70 2dkt h LYS 55 Cb 1.73 0.10 0.10 0.00 0.08 0.00 0.00 32.23 34.23 2dkt h LYS 55 CO -0.07 -0.29 -0.02 1.55 -0.57 0.00 0.00 179.45 180.05 2dkt n VAL 56 N -3.70 1.64 0.00 0.50 3.14 -1.26 -4.89 118.33 113.76 2dkt n VAL 56 Ca -0.05 -0.41 0.00 0.00 -2.96 0.00 0.00 64.34 60.92 2dkt n VAL 56 Cb 0.21 -0.65 0.00 0.00 -1.06 0.00 0.00 33.84 32.33 2dkt n VAL 56 CO 0.00 0.00 0.00 1.17 -6.46 0.00 0.00 176.83 171.54 2dkt n LYS 57 N 1.08 2.10 -2.31 1.45 4.81 -1.26 -4.97 118.16 119.06 2dkt n LYS 57 Ca 0.14 0.00 -0.29 0.00 -0.87 0.00 0.00 58.31 57.28 2dkt n LYS 57 Cb 0.27 -0.80 -0.00 0.00 0.02 0.00 0.00 35.03 34.52 2dkt n LYS 57 CO 0.00 0.00 0.00 -1.21 1.17 0.00 0.00 177.40 177.36 2dkt s GLU 58 N -1.60 3.61 0.11 1.64 8.01 -1.26 -1.80 118.70 127.41 2dkt s GLU 58 Ca 0.00 0.51 -0.09 0.00 0.01 0.00 0.00 54.97 55.40 2dkt s GLU 58 Cb 0.00 -2.23 -0.00 0.00 -4.31 0.00 0.00 34.13 27.58 2dkt s GLU 58 CO 0.00 -0.35 0.23 0.14 0.01 0.00 0.00 175.26 175.28 2dkt s VAL 59 N -2.89 0.12 0.03 2.63 -7.23 -0.92 -3.24 120.40 108.90 2dkt s VAL 59 Ca 0.52 -1.19 0.07 0.00 -1.81 0.00 0.00 61.98 59.56 2dkt s VAL 59 Cb -0.11 -1.45 -0.02 0.00 0.56 0.00 0.00 36.38 35.36 2dkt s VAL 59 CO 0.47 -0.54 -0.20 -1.58 -0.31 0.00 0.00 175.10 172.93 2dkt s GLN 60 N -3.88 1.39 0.33 4.82 0.74 0.98 -2.91 119.66 121.13 2dkt s GLN 60 Ca 0.08 -0.88 -0.15 0.00 0.05 0.00 0.00 55.36 54.45 2dkt s GLN 60 Cb 0.04 -1.47 -0.09 0.00 1.10 0.00 0.00 33.01 32.59 2dkt s GLN 60 CO -0.08 0.38 0.75 0.00 -0.55 0.00 0.00 175.29 175.79 2dkt n ILE 62 N -0.38 0.00 0.03 0.00 -6.64 -0.91 -2.91 119.36 108.56 2dkt n ILE 62 Ca 0.04 -0.19 -0.22 0.00 -1.77 0.00 0.00 62.75 60.61 2dkt n ILE 62 Cb 0.53 1.00 -0.14 0.00 -1.44 0.00 0.00 39.64 39.59 2dkt n ILE 62 CO 0.00 0.00 0.00 0.78 -1.77 0.00 0.00 176.55 175.56 2dkt h ASN 63 N 0.00 0.46 0.00 7.28 4.21 -1.94 -3.39 115.58 122.19 2dkt h ASN 63 Ca 0.00 -0.89 -0.01 0.00 1.21 0.00 0.00 56.30 56.61 2dkt h ASN 63 Cb 0.32 -0.15 -0.03 0.00 -1.12 0.00 0.00 38.32 37.34 2dkt h ASN 63 CO 0.00 1.66 -0.31 0.00 -1.29 0.00 0.00 177.43 177.49 2dkt n GLU 65 N -0.74 -0.80 -3.60 0.00 1.02 -1.14 -4.86 120.64 110.51 2dkt n GLU 65 Ca 0.10 0.10 -0.32 0.00 -0.02 0.00 0.00 57.16 57.02 2dkt n GLU 65 Cb 0.70 -3.49 -0.05 0.00 -0.02 0.00 0.00 31.44 28.58 2dkt n GLU 65 CO 0.00 0.00 0.00 0.21 1.18 0.00 0.00 177.13 178.52 2dkt s LYS 66 N -5.86 3.67 0.18 3.49 2.47 -1.25 -4.83 119.74 117.61 2dkt s LYS 66 Ca 0.55 0.01 -0.15 0.00 -1.56 0.00 0.00 55.97 54.83 2dkt s LYS 66 Cb -0.32 -2.80 -0.07 0.00 -1.46 0.00 0.00 37.83 33.17 2dkt s LYS 66 CO 0.79 0.43 0.60 -1.17 0.16 0.00 0.00 175.35 176.16 2dkt s LEU 67 N -2.68 4.30 0.12 5.43 2.96 -1.26 -1.65 118.68 125.91 2dkt s LEU 67 Ca 0.42 1.15 -0.26 0.00 -0.22 0.00 0.00 54.13 55.23 2dkt s LEU 67 Cb -0.12 -3.43 0.08 0.00 0.50 0.00 0.00 46.19 43.22 2dkt s LEU 67 CO 0.23 0.05 1.06 0.00 -1.32 0.00 0.00 176.35 176.37 2dkt s GLN 68 N -2.11 1.03 0.57 1.98 0.00 -1.14 -4.92 119.66 115.06 2dkt s GLN 68 Ca 0.41 -0.60 0.09 0.00 -0.00 0.00 0.00 55.36 55.26 2dkt s GLN 68 Cb -0.15 0.33 0.08 0.00 0.00 0.00 0.00 33.01 33.28 2dkt s GLN 68 CO 0.20 -0.48 0.77 -1.01 0.00 0.00 0.00 175.29 174.77 2dkt s HIS 69 N -2.80 1.45 -0.29 9.60 3.76 -1.26 -2.17 115.29 123.57 2dkt s HIS 69 Ca 0.15 -0.72 -0.38 0.00 -0.15 0.00 0.00 55.06 53.97 2dkt s HIS 69 Cb -0.00 -2.20 -0.14 0.00 1.11 0.00 0.00 32.58 31.35 2dkt s HIS 69 CO 0.02 -1.10 1.96 0.00 -0.85 0.00 0.00 174.74 174.77 2dkt n ALA 70 N -2.21 0.49 -3.44 -1.40 0.00 -0.75 -4.58 120.51 108.62 2dkt n ALA 70 Ca 0.15 0.18 -0.02 0.00 0.00 0.00 0.00 53.44 53.75 2dkt n ALA 70 Cb 0.62 -2.38 0.01 0.00 0.00 0.00 0.00 19.45 17.69 2dkt n ALA 70 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2dkt n GLN 71 N 6.80 0.53 -0.06 0.00 10.64 -1.26 -5.07 117.38 128.97 2dkt n GLN 71 Ca 0.33 -1.21 -0.04 0.00 -1.83 0.00 0.00 57.00 54.25 2dkt n GLN 71 Cb 0.18 1.41 -0.11 0.00 -0.86 0.00 0.00 30.24 30.86 2dkt n GLN 71 CO 0.00 0.00 0.00 0.94 -1.83 0.00 0.00 177.06 176.17 2dkt n GLN 72 N -0.28 1.54 -4.20 2.61 7.27 -1.26 -4.93 117.38 118.14 2dkt n GLN 72 Ca -0.03 -0.03 -0.15 0.00 0.07 0.00 0.00 57.00 56.85 2dkt n GLN 72 Cb 0.30 -1.35 -0.11 0.00 2.41 0.00 0.00 30.24 31.50 2dkt n GLN 72 CO 0.00 0.00 0.00 0.99 0.07 0.00 0.00 177.06 178.12 2dkt s THR 73 N -2.45 1.08 0.84 1.69 2.01 -1.26 0.01 115.64 117.55 2dkt s THR 73 Ca -0.06 -1.69 -0.11 0.00 0.31 0.00 0.00 61.69 60.13 2dkt s THR 73 Cb 0.05 -1.44 0.09 0.00 0.01 0.00 0.00 72.50 71.21 2dkt s THR 73 CO 0.56 -0.53 1.09 0.00 -0.69 0.00 0.00 174.62 175.06 2dkt n GLU 75 N -3.67 1.52 0.00 0.00 1.02 -1.26 -3.17 120.64 115.07 2dkt n GLU 75 Ca 0.08 -1.58 0.00 0.00 -0.02 0.00 0.00 57.16 55.64 2dkt n GLU 75 Cb 0.55 -1.27 0.00 0.00 -0.02 0.00 0.00 31.44 30.69 2dkt n GLU 75 CO 0.00 0.00 0.00 -3.47 1.18 0.00 0.00 177.13 174.84 2dkt n ASP 76 N 0.73 4.13 -0.00 1.62 -0.08 -1.26 -4.81 116.55 116.88 2dkt n ASP 76 Ca 0.10 0.00 0.00 0.00 -1.51 0.00 0.00 54.79 53.38 2dkt n ASP 76 Cb 0.37 0.23 -0.01 0.00 2.34 0.00 0.00 41.12 44.06 2dkt n ASP 76 CO 0.00 0.00 0.00 0.00 0.12 0.00 0.00 177.20 177.32 2dkt n SER 78 N -1.20 -6.29 -4.69 0.00 2.88 -1.19 -4.93 113.62 98.20 2dkt n SER 78 Ca 0.00 -0.49 -0.40 0.00 -1.33 0.00 0.00 58.87 56.65 2dkt n SER 78 Cb 0.02 -4.98 -0.05 0.00 -0.75 0.00 0.00 64.21 58.45 2dkt n SER 78 CO 0.00 0.00 0.00 -0.89 -1.23 0.00 0.00 175.04 172.92 2dkt s THR 79 N -3.29 5.00 -0.19 2.46 2.01 -1.26 -4.59 115.64 115.78 2dkt s THR 79 Ca 0.53 1.41 -0.29 0.00 0.31 0.00 0.00 61.69 63.65 2dkt s THR 79 Cb -0.23 -4.03 -0.05 0.00 0.01 0.00 0.00 72.50 68.20 2dkt s THR 79 CO 0.65 0.16 1.97 -0.22 -0.69 0.00 0.00 174.62 176.49 2dkt s LEU 80 N 1.42 3.73 0.00 4.42 2.96 -1.26 -2.40 118.68 127.55 2dkt s LEU 80 Ca 0.35 1.87 0.02 0.00 -0.22 0.00 0.00 54.13 56.16 2dkt s LEU 80 Cb -0.17 -3.52 0.14 0.00 0.50 0.00 0.00 46.19 43.14 2dkt s LEU 80 CO 0.14 -1.60 1.09 0.49 -1.32 0.00 0.00 176.35 175.15 2dkt n PHE 81 N 9.99 0.01 0.00 5.38 3.72 0.10 -4.55 117.46 132.11 2dkt n PHE 81 Ca 0.24 -0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.64 2dkt n PHE 81 Cb 0.45 0.00 0.00 0.00 -0.94 0.00 0.00 39.48 38.99 2dkt n PHE 81 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 2dkt n GLY 82 N 0.55 3.36 0.29 1.37 0.00 -1.26 -3.80 105.19 105.71 2dkt n GLY 82 Ca 0.02 -0.43 0.26 0.00 0.00 0.00 0.00 46.02 45.87 2dkt n GLY 82 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 2dkt n GLU 83 N 0.00 -0.06 -3.73 1.61 -0.58 -1.25 -3.88 120.64 112.76 2dkt n GLU 83 Ca 0.00 1.27 -0.37 0.00 -0.42 0.00 0.00 57.16 57.65 2dkt n GLU 83 Cb 0.00 -2.23 -0.11 0.00 -0.57 0.00 0.00 31.44 28.53 2dkt n GLU 83 CO 0.00 0.00 0.00 0.71 -0.48 0.00 0.00 177.13 177.36 2dkt s TYR 84 N -5.48 3.21 -0.18 -0.32 1.51 -1.05 -4.99 117.35 110.05 2dkt s TYR 84 Ca -0.09 -0.01 -0.00 0.00 -1.01 0.00 0.00 57.07 55.96 2dkt s TYR 84 Cb 0.30 -2.26 0.04 0.00 -0.11 0.00 0.00 41.96 39.94 2dkt s TYR 84 CO 0.71 -0.10 -0.06 1.52 -1.11 0.00 0.00 175.55 176.50 2dkt s TYR 85 N 1.28 1.95 0.19 2.71 1.13 -1.25 -1.92 117.35 121.44 2dkt s TYR 85 Ca 0.06 -1.29 -0.19 0.00 -1.41 0.00 0.00 57.07 54.24 2dkt s TYR 85 Cb -0.14 -1.42 -0.08 0.00 -1.10 0.00 0.00 41.96 39.21 2dkt s TYR 85 CO 0.05 -0.67 0.68 0.00 -2.51 0.00 0.00 175.55 173.10 2dkt n SER 87 N 0.90 0.81 -0.01 0.00 7.64 -1.26 -2.60 113.62 119.09 2dkt n SER 87 Ca -0.04 0.07 -0.12 0.00 1.01 0.00 0.00 58.87 59.79 2dkt n SER 87 Cb 0.51 0.30 -0.10 0.00 -1.01 0.00 0.00 64.21 63.92 2dkt n SER 87 CO 0.00 0.00 0.00 0.40 -3.01 0.00 0.00 175.04 172.43 2dkt h ILE 88 N 0.01 1.26 0.00 0.44 2.04 -1.95 -3.32 117.51 115.99 2dkt h ILE 88 Ca -0.49 -1.53 0.00 0.00 1.00 0.00 0.00 64.86 63.84 2dkt h ILE 88 Cb 2.11 2.19 0.00 0.00 -0.74 0.00 0.00 36.82 40.38 2dkt h ILE 88 CO 0.02 0.36 -0.45 0.00 0.00 0.00 0.00 178.15 178.07 2dkt n HIS 90 N -2.78 -2.30 -4.22 0.00 8.25 -1.07 -4.38 115.22 108.72 2dkt n HIS 90 Ca 0.02 0.75 -0.26 0.00 -0.26 0.00 0.00 57.72 57.97 2dkt n HIS 90 Cb 0.52 -4.49 -0.08 0.00 1.12 0.00 0.00 29.99 27.07 2dkt n HIS 90 CO 0.00 0.00 0.00 -1.17 0.64 0.00 0.00 176.34 175.81 2dkt s LEU 91 N -6.49 3.30 -0.09 2.41 0.20 -1.23 -4.91 118.68 111.87 2dkt s LEU 91 Ca 0.43 -0.43 -0.01 0.00 0.69 0.00 0.00 54.13 54.81 2dkt s LEU 91 Cb -0.19 -1.94 0.03 0.00 -0.43 0.00 0.00 46.19 43.66 2dkt s LEU 91 CO 0.53 0.08 -0.02 -0.36 -0.29 0.00 0.00 176.35 176.29 2dkt s PHE 92 N -1.81 0.93 -0.06 5.38 0.08 -1.26 -0.75 117.98 120.49 2dkt s PHE 92 Ca 0.28 -0.38 0.03 0.00 0.12 0.00 0.00 56.93 56.98 2dkt s PHE 92 Cb -0.09 -0.94 0.00 0.00 -0.57 0.00 0.00 43.02 41.42 2dkt s PHE 92 CO 0.19 -0.40 -0.17 -0.51 -0.10 0.00 0.00 175.22 174.23 2dkt s ASP 93 N 1.89 2.19 1.02 1.36 1.01 -0.81 -4.22 116.67 119.11 2dkt s ASP 93 Ca 0.05 -0.37 -0.13 0.00 0.71 0.00 0.00 52.55 52.80 2dkt s ASP 93 Cb -0.13 -0.84 0.14 0.00 1.01 0.00 0.00 42.92 43.11 2dkt s ASP 93 CO -0.06 0.11 0.70 2.29 0.21 0.00 0.00 175.17 178.41 2dkt n LYS 94 N 3.47 -1.08 -1.51 8.23 -0.00 0.15 -2.52 118.16 124.90 2dkt n LYS 94 Ca -0.20 -0.27 -0.39 0.00 -0.00 0.00 0.00 58.31 57.44 2dkt n LYS 94 Cb 0.52 -2.06 -0.13 0.00 -0.00 0.00 0.00 35.03 33.37 2dkt n LYS 94 CO 0.00 0.00 0.00 -0.40 0.00 0.00 0.00 177.40 177.00 2dkt n ASP 95 N -3.10 0.61 -0.73 -5.58 5.75 -1.26 -4.67 116.55 107.58 2dkt n ASP 95 Ca 0.06 0.03 0.03 0.00 -0.01 0.00 0.00 54.79 54.90 2dkt n ASP 95 Cb 0.55 -1.03 0.05 0.00 -1.03 0.00 0.00 41.12 39.65 2dkt n ASP 95 CO 0.00 0.00 0.00 0.29 -0.11 0.00 0.00 177.20 177.38 2dkt n LYS 96 N 8.51 0.37 -4.18 0.11 5.02 -1.26 -5.01 118.16 121.72 2dkt n LYS 96 Ca 0.61 -1.79 -0.39 0.00 -2.02 0.00 0.00 58.31 54.72 2dkt n LYS 96 Cb 0.13 -0.63 -0.04 0.00 -0.02 0.00 0.00 35.03 34.47 2dkt n LYS 96 CO 0.00 0.00 0.00 -2.13 -0.52 0.00 0.00 177.40 174.75 2dkt n ARG 97 N -0.21 -0.68 -3.98 1.97 0.00 -1.26 -4.49 116.66 108.01 2dkt n ARG 97 Ca 0.06 0.09 -0.23 0.00 -0.00 0.00 0.00 57.85 57.78 2dkt n ARG 97 Cb 0.82 -3.09 -0.06 0.00 0.00 0.00 0.00 32.46 30.13 2dkt n ARG 97 CO 0.00 0.00 0.00 1.14 0.00 0.00 0.00 177.63 178.77 2dkt s GLN 98 N -7.38 2.39 0.33 -0.14 0.00 -1.26 -2.85 119.66 110.74 2dkt s GLN 98 Ca 0.25 -1.60 0.05 0.00 -0.00 0.00 0.00 55.36 54.06 2dkt s GLN 98 Cb -0.14 -2.19 -0.02 0.00 0.00 0.00 0.00 33.01 30.66 2dkt s GLN 98 CO 0.98 -0.00 0.18 2.48 0.00 0.00 0.00 175.29 178.93 2dkt n TYR 99 N -1.26 -0.24 -3.90 9.60 0.18 0.19 -4.84 117.16 116.88 2dkt n TYR 99 Ca -0.01 -2.35 -0.27 0.00 1.88 0.00 0.00 57.90 57.14 2dkt n TYR 99 Cb 0.62 0.11 -0.17 0.00 -0.38 0.00 0.00 39.34 39.52 2dkt n TYR 99 CO 0.00 0.00 0.00 -1.58 -2.08 0.00 0.00 176.86 173.20 2dkt s HIS 100 N -3.02 1.60 0.13 -3.48 5.65 -1.26 -0.24 115.29 114.68 2dkt s HIS 100 Ca 0.25 -0.90 -0.30 0.00 0.25 0.00 0.00 55.06 54.37 2dkt s HIS 100 Cb 0.01 -1.28 -0.06 0.00 -1.18 0.00 0.00 32.58 30.07 2dkt s HIS 100 CO 0.18 -0.56 1.03 0.00 -0.65 0.00 0.00 174.74 174.74 2dkt h GLU 102 N 5.52 0.36 -0.58 0.00 5.08 -1.95 0.31 114.58 123.33 2dkt h GLU 102 Ca -0.43 -0.62 0.10 0.00 -1.00 0.00 0.00 59.36 57.41 2dkt h GLU 102 Cb 1.21 0.23 -0.03 0.00 0.50 0.00 0.00 28.75 30.66 2dkt h GLU 102 CO 0.73 1.30 0.39 0.77 -1.00 0.00 0.00 179.01 181.20 2dkt h SER 103 N -0.05 0.32 0.00 1.42 0.02 -1.96 -2.21 113.55 111.09 2dkt h SER 103 Ca -0.31 0.01 -0.22 0.00 -0.84 0.00 0.00 61.79 60.43 2dkt h SER 103 Cb 1.97 -0.06 -0.04 0.00 0.14 0.00 0.00 62.40 64.41 2dkt h SER 103 CO 0.15 0.19 -2.21 0.00 -1.14 0.00 0.00 176.83 173.82 2dkt n GLY 105 N 1.57 0.81 3.35 0.00 0.00 0.08 -5.02 105.19 105.98 2dkt n GLY 105 Ca -0.21 -0.72 -0.18 0.00 0.00 0.00 0.00 46.02 44.90 2dkt n GLY 105 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 2dkt s ILE 106 N -2.19 1.48 0.34 -0.61 -4.36 -1.06 -4.69 121.20 110.11 2dkt s ILE 106 Ca 0.00 -2.13 -0.20 0.00 -0.26 0.00 0.00 60.65 58.07 2dkt s ILE 106 Cb 0.00 -2.18 -0.10 0.00 1.25 0.00 0.00 42.46 41.43 2dkt s ILE 106 CO 0.00 -0.49 0.83 0.00 0.24 0.00 0.00 174.94 175.53 2dkt s ARG 108 N -2.68 0.22 0.10 0.00 1.81 0.67 -4.88 118.95 114.19 2dkt s ARG 108 Ca 0.54 -0.08 -0.28 0.00 -1.72 0.00 0.00 55.73 54.19 2dkt s ARG 108 Cb -0.13 0.09 -0.06 0.00 -0.45 0.00 0.00 34.95 34.41 2dkt s ARG 108 CO 0.18 -0.04 0.90 0.42 -0.68 0.00 0.00 175.30 176.08 2dkt s ILE 109 N -0.45 4.54 0.00 1.52 -1.09 -1.26 -0.64 121.20 123.83 2dkt s ILE 109 Ca -0.05 1.94 0.00 0.00 -2.23 0.00 0.00 60.65 60.30 2dkt s ILE 109 Cb -0.03 -4.26 0.00 0.00 -1.58 0.00 0.00 42.46 36.59 2dkt s ILE 109 CO 0.00 0.35 0.00 0.61 -1.23 0.00 0.00 174.94 174.67 2dkt n GLY 110 N 2.23 1.06 3.67 6.18 0.00 -1.13 -4.76 105.19 112.45 2dkt n GLY 110 Ca 0.01 -1.51 -0.42 0.00 0.00 0.00 0.00 46.02 44.09 2dkt n GLY 110 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2dkt s PRO 111 N 0.69 4.22 0.48 1.61 0.04 -1.26 -4.99 135.00 135.79 2dkt s PRO 111 Ca 0.00 2.01 0.41 0.00 0.04 0.00 0.00 61.00 63.46 2dkt s PRO 111 Cb 0.00 -3.82 1.39 0.00 0.04 0.00 0.00 34.50 32.11 2dkt s PRO 111 CO 0.00 -0.75 1.31 1.17 0.04 0.00 0.00 177.00 178.77 2dkt n LYS 112 N 6.54 0.00 -0.00 4.56 3.00 -1.26 0.14 118.16 131.14 2dkt n LYS 112 Ca 0.15 0.92 -0.11 0.00 -0.00 0.00 0.00 58.31 59.28 2dkt n LYS 112 Cb 0.43 -2.15 -0.05 0.00 0.00 0.00 0.00 35.03 33.26 2dkt n LYS 112 CO 0.00 0.00 0.00 0.93 0.00 0.00 0.00 177.40 178.33 2dkt h GLU 113 N 0.00 0.10 -1.23 1.64 5.08 -1.97 -2.21 114.58 115.99 2dkt h GLU 113 Ca 0.76 -0.01 -0.30 0.00 -1.00 0.00 0.00 59.36 58.81 2dkt h GLU 113 Cb 3.15 -0.02 -0.15 0.00 0.50 0.00 0.00 28.75 32.23 2dkt h GLU 113 CO -0.01 0.07 0.38 -3.47 -1.00 0.00 0.00 179.01 174.98 2dkt n ASP 114 N -5.05 4.82 -4.02 1.42 2.03 0.37 -4.87 116.55 111.25 2dkt n ASP 114 Ca -0.05 -2.94 -0.09 0.00 0.52 0.00 0.00 54.79 52.23 2dkt n ASP 114 Cb 0.04 -0.85 -0.06 0.00 -0.72 0.00 0.00 41.12 39.54 2dkt n ASP 114 CO 0.00 0.00 0.00 -0.36 -1.92 0.00 0.00 177.20 174.92 2dkt s PHE 115 N -1.77 0.45 0.26 -0.67 0.40 -0.83 -2.91 117.98 112.90 2dkt s PHE 115 Ca 0.30 -0.79 -0.21 0.00 -0.60 0.00 0.00 56.93 55.64 2dkt s PHE 115 Cb 0.25 0.11 0.05 0.00 0.51 0.00 0.00 43.02 43.94 2dkt s PHE 115 CO 0.03 -0.95 0.86 -0.59 0.70 0.00 0.00 175.22 175.26 2dkt s PHE 116 N -4.03 -0.04 -0.07 0.36 -0.12 0.80 -4.67 117.98 110.20 2dkt s PHE 116 Ca 0.24 -0.44 0.02 0.00 -0.05 0.00 0.00 56.93 56.71 2dkt s PHE 116 Cb 0.00 0.73 0.01 0.00 -0.63 0.00 0.00 43.02 43.13 2dkt s PHE 116 CO 0.09 -1.18 -0.13 -1.58 -0.05 0.00 0.00 175.22 172.38 2dkt s HIS 117 N -2.98 1.52 0.00 3.49 5.65 -1.26 -0.16 115.29 121.55 2dkt s HIS 117 Ca 0.15 -0.57 -0.15 0.00 0.25 0.00 0.00 55.06 54.73 2dkt s HIS 117 Cb -0.04 -1.11 -0.06 0.00 -1.18 0.00 0.00 32.58 30.19 2dkt s HIS 117 CO 0.07 -0.29 0.43 0.00 -0.65 0.00 0.00 174.74 174.29 2dkt h LEU 119 N 4.79 0.00 -0.95 0.00 3.38 -1.97 -2.19 115.31 118.37 2dkt h LEU 119 Ca -0.51 0.00 0.28 0.00 0.09 0.00 0.00 57.88 57.74 2dkt h LEU 119 Cb 1.22 0.00 -0.17 0.00 0.09 0.00 0.00 40.66 41.80 2dkt h LEU 119 CO 0.62 0.13 0.16 0.50 0.09 0.00 0.00 178.44 179.94 2dkt h LYS 120 N -0.25 0.07 0.00 1.13 3.11 -1.97 1.73 116.57 120.38 2dkt h LYS 120 Ca 0.00 -0.00 -0.09 0.00 -2.81 0.00 0.00 60.65 57.75 2dkt h LYS 120 Cb 0.00 -0.02 -0.01 0.00 -1.00 0.00 0.00 32.23 31.20 2dkt h LYS 120 CO 0.00 0.04 -0.41 0.00 -2.81 0.00 0.00 179.45 176.27 2dkt n ASN 122 N -3.50 -3.30 -3.36 0.00 3.02 0.59 -4.99 115.26 103.72 2dkt n ASN 122 Ca 0.00 -0.56 -0.07 0.00 -0.03 0.00 0.00 54.58 53.92 2dkt n ASN 122 Cb 0.55 -4.85 0.01 0.00 -0.61 0.00 0.00 39.78 34.88 2dkt n ASN 122 CO 0.00 0.00 0.00 -1.48 -2.62 0.00 0.00 177.26 173.16 2dkt s LEU 123 N -6.38 -0.10 0.13 3.41 0.05 -1.01 -4.90 118.68 109.88 2dkt s LEU 123 Ca 0.17 -0.85 -0.05 0.00 0.05 0.00 0.00 54.13 53.45 2dkt s LEU 123 Cb -0.07 2.67 -0.05 0.00 -2.05 0.00 0.00 46.19 46.69 2dkt s LEU 123 CO 0.69 -1.44 0.36 0.00 -0.55 0.00 0.00 176.35 175.42 2dkt s LEU 125 N -2.60 0.38 0.38 0.00 1.43 0.78 -4.89 118.68 114.16 2dkt s LEU 125 Ca 0.40 0.11 -0.18 0.00 -1.03 0.00 0.00 54.13 53.43 2dkt s LEU 125 Cb -0.12 1.72 -0.10 0.00 0.03 0.00 0.00 46.19 47.72 2dkt s LEU 125 CO 0.24 -0.60 0.85 0.28 0.23 0.00 0.00 176.35 177.35 2dkt s THR 126 N -2.03 4.52 0.32 5.49 -1.32 -1.26 -0.14 115.64 121.21 2dkt s THR 126 Ca -0.08 1.24 0.09 0.00 -1.21 0.00 0.00 61.69 61.73 2dkt s THR 126 Cb -0.02 -3.61 0.31 0.00 -1.51 0.00 0.00 72.50 67.67 2dkt s THR 126 CO 0.01 -0.25 1.72 0.71 -2.21 0.00 0.00 174.62 174.60 2dkt h THR 127 N 1.95 0.50 -1.12 5.08 1.35 -1.80 0.10 112.91 118.97 2dkt h THR 127 Ca -0.48 -0.18 0.39 0.00 -0.55 0.00 0.00 66.41 65.59 2dkt h THR 127 Cb 1.18 -0.07 -0.15 0.00 -1.73 0.00 0.00 68.15 67.38 2dkt h THR 127 CO 0.63 0.10 0.67 -1.13 -0.25 0.00 0.00 175.52 175.53 2dkt h ASN 128 N 0.52 0.36 -1.49 5.36 -1.24 -1.93 0.64 115.58 117.81 2dkt h ASN 128 Ca 0.64 0.19 -0.69 0.00 0.71 0.00 0.00 56.30 57.15 2dkt h ASN 128 Cb 1.25 0.17 -0.32 0.00 0.73 0.00 0.00 38.32 40.15 2dkt h ASN 128 CO -0.50 -0.24 0.48 0.18 -1.29 0.00 0.00 177.43 176.06 2dkt n LEU 129 N -4.97 6.79 -1.70 0.34 4.77 0.35 -4.78 117.00 117.80 2dkt n LEU 129 Ca 0.35 -4.74 -0.07 0.00 -0.03 0.00 0.00 56.01 51.53 2dkt n LEU 129 Cb 1.24 -0.85 -0.01 0.00 -2.33 0.00 0.00 43.42 41.46 2dkt n LEU 129 CO 0.11 1.80 1.16 -2.11 -1.33 0.00 0.00 177.39 177.02 2dkt n ARG 130 N -0.66 1.38 0.00 3.23 1.85 0.22 -4.30 116.66 118.39 2dkt n ARG 130 Ca 0.53 -0.61 0.00 0.00 -1.00 0.00 0.00 57.85 56.76 2dkt n ARG 130 Cb 0.51 -1.33 0.00 0.00 -1.05 0.00 0.00 32.46 30.60 2dkt n ARG 130 CO 0.00 0.00 0.00 0.41 -0.01 0.00 0.00 177.63 178.03 2dkt n GLY 131 N 1.31 -0.42 0.26 2.89 0.00 -1.26 -4.99 105.19 102.99 2dkt n GLY 131 Ca 0.15 0.32 0.09 0.00 0.00 0.00 0.00 46.02 46.58 2dkt n GLY 131 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 173.32 174.49 2dkt n LYS 132 N 0.00 -0.06 -1.84 1.61 4.81 -1.26 -4.33 118.16 117.09 2dkt n LYS 132 Ca 0.00 1.14 -0.40 0.00 -0.87 0.00 0.00 58.31 58.18 2dkt n LYS 132 Cb 0.00 -1.77 0.01 0.00 0.02 0.00 0.00 35.03 33.29 2dkt n LYS 132 CO 0.00 0.00 0.00 -3.38 1.17 0.00 0.00 177.40 175.19 2dkt s HIS 133 N -5.78 2.51 -0.13 5.64 -3.43 -1.26 -5.00 115.29 107.84 2dkt s HIS 133 Ca -0.10 1.28 -0.04 0.00 -0.80 0.00 0.00 55.06 55.40 2dkt s HIS 133 Cb 0.21 -3.89 -0.03 0.00 -1.43 0.00 0.00 32.58 27.44 2dkt s HIS 133 CO 0.58 -2.82 0.01 0.21 -2.00 0.00 0.00 174.74 170.72 2dkt s LYS 134 N -2.41 3.43 -0.54 -0.38 2.47 -1.26 -5.05 119.74 116.00 2dkt s LYS 134 Ca 0.60 -0.41 -0.17 0.00 -1.56 0.00 0.00 55.97 54.44 2dkt s LYS 134 Cb -0.43 -2.94 0.11 0.00 -1.46 0.00 0.00 37.83 33.11 2dkt s LYS 134 CO 0.56 0.48 0.53 0.00 0.16 0.00 0.00 175.35 177.08 2dkt s ILE 136 N 1.86 0.00 0.36 0.00 2.07 -1.26 -4.90 121.20 119.33 2dkt s ILE 136 Ca 0.05 0.00 0.08 0.00 -1.41 0.00 0.00 60.65 59.37 2dkt s ILE 136 Cb -0.28 -1.00 -0.05 0.00 0.13 0.00 0.00 42.46 41.26 2dkt s ILE 136 CO 0.04 0.00 0.12 -1.61 -1.91 0.00 0.00 174.94 171.58 2dkt s GLU 137 N -0.88 2.24 0.25 3.50 8.01 -1.26 -5.08 118.70 125.49 2dkt s GLU 137 Ca -0.07 -1.71 0.06 0.00 0.01 0.00 0.00 54.97 53.26 2dkt s GLU 137 Cb -0.01 -2.04 -0.05 0.00 -4.31 0.00 0.00 34.13 27.71 2dkt s GLU 137 CO 0.07 0.04 -0.05 -1.54 0.01 0.00 0.00 175.26 173.79 2dkt s SER 138 N -3.83 2.42 0.00 -0.19 1.04 -1.26 -5.16 113.70 106.73 2dkt s SER 138 Ca 0.38 -1.18 0.00 0.00 0.48 0.00 0.00 55.95 55.63 2dkt s SER 138 Cb 0.00 -0.10 0.00 0.00 0.10 0.00 0.00 66.02 66.02 2dkt s SER 138 CO 0.22 -0.39 0.00 0.61 0.98 0.00 0.00 173.24 174.66 2dkt n GLY 139 N -0.50 -3.07 0.00 7.32 0.00 -1.26 -4.70 105.19 102.97 2dkt n GLY 139 Ca -0.06 -1.01 0.06 0.00 0.00 0.00 0.00 46.02 45.01 2dkt n GLY 139 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 2dkt n PRO 140 N 0.00 0.49 -1.18 1.61 -0.04 -1.26 -4.87 135.00 129.76 2dkt n PRO 140 Ca 0.00 0.00 -0.49 0.00 -0.04 0.00 0.00 63.50 62.97 2dkt n PRO 140 Cb 0.00 -1.37 -0.08 0.00 -0.04 0.00 0.00 33.50 32.01 2dkt n PRO 140 CO 0.00 0.00 0.00 0.45 -0.04 0.00 0.00 175.50 175.91 2dkt n SER 141 N -0.87 0.78 0.05 3.54 2.88 -1.26 -4.80 113.62 113.93 2dkt n SER 141 Ca 0.09 0.75 -0.12 0.00 -1.33 0.00 0.00 58.87 58.26 2dkt n SER 141 Cb 0.04 -0.68 -0.06 0.00 -0.75 0.00 0.00 64.21 62.76 2dkt n SER 141 CO 0.00 0.00 0.00 -1.28 -1.23 0.00 0.00 175.04 172.53 2dkt h SER 142 N 5.06 -0.14 0.00 -3.46 0.87 -2.01 -3.51 113.55 110.37 2dkt h SER 142 Ca -0.23 0.02 0.00 0.00 -1.23 0.00 0.00 61.79 60.35 2dkt h SER 142 Cb 1.06 0.06 0.00 0.00 -0.44 0.00 0.00 62.40 63.08 2dkt h SER 142 CO 0.78 -0.07 0.00 0.61 -0.53 0.00 0.00 176.83 177.62