#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2dkt n SER 2 N 0.00 -3.10 -0.07 1.61 2.88 -1.26 -5.00 113.62 108.68 2dkt n SER 2 Ca 0.00 -0.45 -0.15 0.00 -1.33 0.00 0.00 58.87 56.95 2dkt n SER 2 Cb 0.00 -0.89 -0.05 0.00 -0.75 0.00 0.00 64.21 62.52 2dkt n SER 2 CO 0.00 0.00 0.00 -1.54 -1.23 0.00 0.00 175.04 172.27 2dkt n SER 3 N -2.73 1.28 -0.48 -3.46 3.41 -1.26 -5.07 113.62 105.31 2dkt n SER 3 Ca 0.06 0.22 0.00 0.00 -0.26 0.00 0.00 58.87 58.89 2dkt n SER 3 Cb 0.48 -0.51 0.00 0.00 -0.26 0.00 0.00 64.21 63.92 2dkt n SER 3 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2dkt n GLY 4 N 2.04 0.59 3.41 5.00 0.00 -1.26 -5.11 105.19 109.86 2dkt n GLY 4 Ca -0.27 -0.29 -0.25 0.00 0.00 0.00 0.00 46.02 45.21 2dkt n GLY 4 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2dkt s SER 5 N -2.20 3.29 0.23 1.61 0.01 -1.26 -5.15 113.70 110.23 2dkt s SER 5 Ca 0.00 -0.89 0.02 0.00 1.31 0.00 0.00 55.95 56.39 2dkt s SER 5 Cb 0.00 -0.24 -0.05 0.00 0.21 0.00 0.00 66.02 65.94 2dkt s SER 5 CO 0.00 0.07 0.04 -0.55 0.41 0.00 0.00 173.24 173.21 2dkt s SER 6 N -2.80 1.49 0.00 2.44 0.15 -1.26 -5.16 113.70 108.55 2dkt s SER 6 Ca 0.21 -1.28 0.00 0.00 0.70 0.00 0.00 55.95 55.58 2dkt s SER 6 Cb -0.07 0.08 0.00 0.00 -1.71 0.00 0.00 66.02 64.32 2dkt s SER 6 CO 0.10 -0.61 0.00 0.61 1.20 0.00 0.00 173.24 174.54 2dkt n GLY 7 N -0.41 1.43 3.64 9.45 0.00 -1.26 -5.18 105.19 112.87 2dkt n GLY 7 Ca -0.03 -0.11 -0.04 0.00 0.00 0.00 0.00 46.02 45.84 2dkt n GLY 7 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2dkt s GLY 8 N 0.00 0.09 0.48 -0.02 0.00 -1.26 -5.16 107.32 101.45 2dkt s GLY 8 Ca 0.00 3.16 -0.18 0.00 0.00 0.00 0.00 44.72 47.70 2dkt s GLY 8 CO 0.00 2.35 0.97 -1.34 0.00 0.00 0.00 173.10 175.08 2dkt s VAL 9 N 0.87 4.46 -0.07 1.40 -7.23 -1.26 -5.00 120.40 113.57 2dkt s VAL 9 Ca -0.04 1.32 -0.27 0.00 -1.81 0.00 0.00 61.98 61.18 2dkt s VAL 9 Cb -0.04 -3.67 -0.23 0.00 0.56 0.00 0.00 36.38 33.01 2dkt s VAL 9 CO -0.12 -0.54 1.07 0.03 -0.31 0.00 0.00 175.10 175.23 2dkt h ARG 10 N 1.31 0.02 -1.49 4.82 -0.00 -2.07 -3.47 114.38 113.50 2dkt h ARG 10 Ca -0.48 -0.01 0.10 0.00 -0.50 0.00 0.00 59.98 59.09 2dkt h ARG 10 Cb 1.18 0.00 -0.28 0.00 0.00 0.00 0.00 29.97 30.88 2dkt h ARG 10 CO 0.61 0.70 0.50 0.54 0.00 0.00 0.00 179.97 182.33 2dkt s ASN 11 N -5.93 -0.40 0.16 7.04 4.22 -1.26 -5.14 114.94 113.63 2dkt s ASN 11 Ca -0.17 0.72 -0.34 0.00 -2.14 0.00 0.00 52.86 50.93 2dkt s ASN 11 Cb -0.00 0.88 -0.15 0.00 1.28 0.00 0.00 41.25 43.26 2dkt s ASN 11 CO 0.69 -0.12 1.40 -0.11 -2.04 0.00 0.00 177.10 176.91 2dkt n LEU 12 N 2.62 2.40 0.00 3.54 7.94 -1.26 -4.98 117.00 127.25 2dkt n LEU 12 Ca -0.14 1.12 -0.27 0.00 -1.11 0.00 0.00 56.01 55.60 2dkt n LEU 12 Cb 0.57 -1.32 -0.01 0.00 0.53 0.00 0.00 43.42 43.19 2dkt n LEU 12 CO 0.02 -0.73 0.04 0.00 -1.11 0.00 0.00 177.39 175.61 2dkt n ALA 13 N 2.48 0.82 -2.88 1.96 0.00 -1.26 -5.16 120.51 116.48 2dkt n ALA 13 Ca 0.16 -2.27 -0.10 0.00 0.00 0.00 0.00 53.44 51.23 2dkt n ALA 13 Cb 0.26 0.97 -0.06 0.00 0.00 0.00 0.00 19.45 20.62 2dkt n ALA 13 CO 0.00 0.00 0.00 -0.65 0.00 0.00 0.00 177.50 176.85 2dkt s GLN 14 N -4.27 1.08 -0.37 0.00 -0.21 -1.26 -5.09 119.66 109.55 2dkt s GLN 14 Ca 0.29 -0.90 0.06 0.00 0.02 0.00 0.00 55.36 54.83 2dkt s GLN 14 Cb -0.02 0.43 0.27 0.00 1.00 0.00 0.00 33.01 34.68 2dkt s GLN 14 CO 0.18 -0.41 1.24 0.41 -2.12 0.00 0.00 175.29 174.60 2dkt n GLY 15 N -0.20 0.56 0.00 3.09 0.00 -1.26 -5.15 105.19 102.22 2dkt n GLY 15 Ca -0.13 -0.08 0.00 0.00 0.00 0.00 0.00 46.02 45.81 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 -0.57 0.51 -2.17 1.61 -0.04 -1.26 -4.34 135.00 128.74 2dkt n PRO 16 Ca -0.12 0.00 -0.17 0.00 -0.04 0.00 0.00 63.50 63.16 2dkt n PRO 16 Cb 0.77 0.00 -0.02 0.00 -0.04 0.00 0.00 33.50 34.21 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 -0.37 -1.35 -0.26 0.54 3.00 -1.26 -4.58 116.66 112.39 2dkt n ARG 17 Ca 0.00 0.89 0.00 0.00 -0.01 0.00 0.00 57.85 58.73 2dkt n ARG 17 Cb 0.00 -5.31 0.00 0.00 0.00 0.00 0.00 32.46 27.15 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 -0.99 -2.48 3.88 -0.13 0.00 0.08 -4.73 105.19 100.83 2dkt n GLY 18 Ca -0.20 -0.93 -0.20 0.00 0.00 0.00 0.00 46.02 44.68 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 1.04 0.00 0.28 0.00 5.08 -1.98 -1.67 114.58 117.33 2dkt h GLU 20 Ca -0.42 0.00 -0.01 0.00 -1.00 0.00 0.00 59.36 57.93 2dkt h GLU 20 Cb 1.26 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.52 2dkt h GLU 20 CO 0.56 0.00 -0.14 0.45 -1.00 0.00 0.00 179.01 178.89 2dkt h HIS 21 N 0.00 -0.35 -3.59 4.33 3.86 -2.01 -3.47 115.15 113.92 2dkt h HIS 21 Ca 0.29 -0.01 -0.21 0.00 -1.16 0.00 0.00 60.37 59.27 2dkt h HIS 21 Cb 1.75 0.12 -0.27 0.00 1.06 0.00 0.00 27.41 30.06 2dkt h HIS 21 CO 0.00 -0.22 -0.65 0.71 0.86 0.00 0.00 177.93 178.63 2dkt s TYR 22 N -3.04 -0.06 -0.92 2.45 2.02 -0.63 -5.09 117.35 112.08 2dkt s TYR 22 Ca -0.06 0.14 -0.21 0.00 -0.37 0.00 0.00 57.07 56.58 2dkt s TYR 22 Cb 0.01 0.02 0.09 0.00 -0.40 0.00 0.00 41.96 41.67 2dkt s TYR 22 CO 0.17 -0.04 1.25 -0.51 -1.57 0.00 0.00 175.55 174.85 2dkt s ASP 23 N -0.01 6.50 0.09 2.29 1.11 -1.26 -1.96 116.67 123.44 2dkt s ASP 23 Ca -0.00 -1.60 0.05 0.00 0.18 0.00 0.00 52.55 51.17 2dkt s ASP 23 Cb -0.01 -2.48 -0.03 0.00 1.07 0.00 0.00 42.92 41.47 2dkt s ASP 23 CO 0.00 -1.33 -0.12 0.00 1.18 0.00 0.00 175.17 174.90 2dkt s ARG 24 N 3.91 0.87 -0.40 8.23 1.70 -1.26 -2.57 118.95 129.44 2dkt s ARG 24 Ca 0.37 -1.10 0.05 0.00 -0.47 0.00 0.00 55.73 54.58 2dkt s ARG 24 Cb -0.04 -0.72 0.47 0.00 -0.57 0.00 0.00 34.95 34.08 2dkt s ARG 24 CO -0.06 0.14 1.48 0.00 -1.08 0.00 0.00 175.30 175.78 2dkt n ALA 25 N 0.83 5.28 -3.65 7.88 0.00 -1.25 -0.74 120.51 128.85 2dkt n ALA 25 Ca -0.18 -3.59 -0.07 0.00 0.00 0.00 0.00 53.44 49.60 2dkt n ALA 25 Cb 0.56 -0.81 -0.07 0.00 0.00 0.00 0.00 19.45 19.13 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 1.82 4.52 -0.26 0.00 1.02 0.10 -4.80 118.68 121.08 2dkt s LEU 27 Ca -0.09 1.47 -0.20 0.00 0.02 0.00 0.00 54.13 55.33 2dkt s LEU 27 Cb -0.07 -3.18 -0.02 0.00 0.02 0.00 0.00 46.19 42.95 2dkt s LEU 27 CO -0.19 0.14 0.63 -1.48 0.02 0.00 0.00 176.35 175.48 2dkt s LEU 28 N -0.68 4.07 0.47 1.79 0.05 -1.22 -0.22 118.68 122.94 2dkt s LEU 28 Ca 0.35 0.69 -0.23 0.00 0.05 0.00 0.00 54.13 54.98 2dkt s LEU 28 Cb -0.21 -2.85 -0.08 0.00 -2.05 0.00 0.00 46.19 41.00 2dkt s LEU 28 CO 0.23 -0.38 1.17 1.17 -0.55 0.00 0.00 176.35 177.99 2dkt n LYS 29 N 5.72 1.58 -3.51 1.48 3.00 -1.23 -3.93 118.16 121.27 2dkt n LYS 29 Ca -0.01 0.57 -0.42 0.00 -0.00 0.00 0.00 58.31 58.45 2dkt n LYS 29 Cb 0.49 -2.30 -0.08 0.00 0.00 0.00 0.00 35.03 33.14 2dkt n LYS 29 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.40 177.40 2dkt s ALA 30 N -1.29 3.42 -2.00 3.14 0.00 0.27 -4.89 121.76 120.41 2dkt s ALA 30 Ca 0.66 -2.32 0.08 0.00 0.00 0.00 0.00 51.96 50.38 2dkt s ALA 30 Cb -0.49 -2.86 0.47 0.00 0.00 0.00 0.00 23.12 20.24 2dkt s ALA 30 CO 0.54 -1.79 0.92 -0.35 0.00 0.00 0.00 175.76 175.08 2dkt n PRO 31 N 5.01 0.49 -0.11 0.00 -0.04 -1.26 0.20 135.00 139.28 2dkt n PRO 31 Ca -0.10 0.00 -0.23 0.00 -0.04 0.00 0.00 63.50 63.13 2dkt n PRO 31 Cb 0.42 -1.25 -0.12 0.00 -0.04 0.00 0.00 33.50 32.51 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 -0.05 -5.40 -4.77 0.00 2.03 0.53 -5.01 116.55 103.88 2dkt n ASP 34 Ca 0.00 -0.30 -0.26 0.00 0.52 0.00 0.00 54.79 54.75 2dkt n ASP 34 Cb 0.08 -4.17 -0.06 0.00 -0.72 0.00 0.00 41.12 36.25 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 -5.66 2.23 -0.11 -0.67 1.02 -1.17 -4.82 119.74 110.56 2dkt s LYS 35 Ca 0.32 -1.94 0.01 0.00 0.02 0.00 0.00 55.97 54.38 2dkt s LYS 35 Cb -0.14 -1.95 0.02 0.00 -0.52 0.00 0.00 37.83 35.24 2dkt s LYS 35 CO 0.39 -0.23 -0.12 -0.51 -0.92 0.00 0.00 175.35 173.97 2dkt s LEU 36 N -3.97 1.50 0.03 3.17 1.43 -1.26 0.97 118.68 120.55 2dkt s LEU 36 Ca 0.36 -0.38 0.04 0.00 -1.03 0.00 0.00 54.13 53.12 2dkt s LEU 36 Cb 0.03 -0.98 -0.02 0.00 0.03 0.00 0.00 46.19 45.25 2dkt s LEU 36 CO 0.20 -0.05 -0.12 -0.31 0.23 0.00 0.00 176.35 176.30 2dkt s TYR 37 N 1.34 1.06 0.03 0.29 1.51 -1.25 -5.00 117.35 115.33 2dkt s TYR 37 Ca -0.00 -0.32 -0.06 0.00 -1.01 0.00 0.00 57.07 55.67 2dkt s TYR 37 Cb -0.14 -0.64 -0.01 0.00 -0.11 0.00 0.00 41.96 41.06 2dkt s TYR 37 CO -0.06 0.01 0.69 2.41 -1.11 0.00 0.00 175.55 177.49 2dkt n THR 38 N 2.08 -0.14 -4.42 -0.71 -1.04 -1.26 -3.45 114.28 105.34 2dkt n THR 38 Ca -0.17 1.05 -0.23 0.00 -2.04 0.00 0.00 64.05 62.66 2dkt n THR 38 Cb 0.55 -1.36 -0.08 0.00 -1.82 0.00 0.00 70.33 67.62 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 1.96 0.84 -0.37 0.00 -0.00 -1.93 -2.54 114.38 112.35 2dkt h ARG 40 Ca -0.33 -0.20 -0.06 0.00 -0.00 0.00 0.00 59.98 59.40 2dkt h ARG 40 Cb 1.26 -0.11 -0.02 0.00 -0.00 0.00 0.00 29.97 31.10 2dkt h ARG 40 CO 0.51 0.79 -0.03 -0.07 -0.00 0.00 0.00 179.97 181.18 2dkt h LEU 41 N 0.80 0.56 -0.29 0.08 3.38 -1.96 -2.92 115.31 114.97 2dkt h LEU 41 Ca 0.17 -0.12 -0.03 0.00 0.09 0.00 0.00 57.88 57.98 2dkt h LEU 41 Cb 0.37 -0.15 -0.01 0.00 0.09 0.00 0.00 40.66 40.96 2dkt h LEU 41 CO 0.01 0.65 0.06 0.00 0.09 0.00 0.00 178.44 179.25 2dkt h HIS 43 N 0.30 -1.17 -0.94 0.00 -0.00 -1.30 0.32 115.15 112.35 2dkt h HIS 43 Ca 0.09 0.06 0.11 0.00 -0.00 0.00 0.00 60.37 60.63 2dkt h HIS 43 Cb 0.32 0.55 -0.07 0.00 -0.00 0.00 0.00 27.41 28.21 2dkt h HIS 43 CO 0.02 -0.33 0.60 0.22 -0.00 0.00 0.00 177.93 178.44 2dkt h ASP 44 N -0.25 0.85 -0.56 3.26 3.58 -1.59 0.13 116.42 121.85 2dkt h ASP 44 Ca 0.05 0.03 -0.02 0.00 0.42 0.00 0.00 57.03 57.52 2dkt h ASP 44 Cb 0.39 -0.14 -0.03 0.00 1.72 0.00 0.00 39.33 41.27 2dkt h ASP 44 CO -0.43 0.48 0.29 0.74 -2.88 0.00 0.00 179.24 177.44 2dkt h THR 45 N 0.93 1.19 -0.54 2.25 2.02 -0.48 -2.22 112.91 116.06 2dkt h THR 45 Ca 0.45 -0.53 -0.19 0.00 0.77 0.00 0.00 66.41 66.91 2dkt h THR 45 Cb 0.45 0.43 -0.11 0.00 -1.74 0.00 0.00 68.15 67.18 2dkt h THR 45 CO -0.21 0.22 0.15 0.59 0.37 0.00 0.00 175.52 176.64 2dkt n ASN 46 N -4.36 3.78 -3.59 4.18 3.02 0.90 -4.98 115.26 114.20 2dkt n ASN 46 Ca 0.05 -3.38 -0.12 0.00 -0.03 0.00 0.00 54.58 51.10 2dkt n ASN 46 Cb 0.12 -0.67 -0.04 0.00 -0.61 0.00 0.00 39.78 38.57 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 -3.07 1.74 -0.03 3.52 0.41 0.30 -4.99 118.70 116.58 2dkt s GLU 47 Ca 0.49 -1.52 0.19 0.00 -0.41 0.00 0.00 54.97 53.72 2dkt s GLU 47 Cb 0.41 0.46 -0.29 0.00 -1.78 0.00 0.00 34.13 32.93 2dkt s GLU 47 CO 0.08 -0.72 0.40 -3.47 -0.49 0.00 0.00 175.26 171.06 2dkt n ASP 48 N -0.91 0.72 -4.78 -0.19 -0.08 -1.26 -4.76 116.55 105.29 2dkt n ASP 48 Ca -0.01 0.00 -0.22 0.00 -1.51 0.00 0.00 54.79 53.05 2dkt n ASP 48 Cb 0.62 1.84 -0.05 0.00 2.34 0.00 0.00 41.12 45.87 2dkt n ASP 48 CO 0.00 0.00 0.00 -1.38 0.12 0.00 0.00 177.20 175.94 2dkt s HIS 49 N -3.28 3.01 0.03 -0.67 -3.43 -1.26 -5.11 115.29 104.58 2dkt s HIS 49 Ca -0.07 -0.13 -0.17 0.00 -0.80 0.00 0.00 55.06 53.89 2dkt s HIS 49 Cb 0.12 -1.36 -0.06 0.00 -1.43 0.00 0.00 32.58 29.85 2dkt s HIS 49 CO 0.78 0.54 0.50 -0.65 -2.00 0.00 0.00 174.74 173.91 2dkt s GLN 50 N -3.74 4.09 0.10 -0.38 -0.21 -1.26 -4.36 119.66 113.90 2dkt s GLN 50 Ca 0.32 0.59 0.02 0.00 0.02 0.00 0.00 55.36 56.32 2dkt s GLN 50 Cb -0.08 -3.24 -0.04 0.00 1.00 0.00 0.00 33.01 30.65 2dkt s GLN 50 CO 0.24 0.64 0.15 -1.17 -2.12 0.00 0.00 175.29 173.02 2dkt s LEU 51 N -1.00 4.03 0.53 2.90 0.20 -1.26 -5.04 118.68 119.03 2dkt s LEU 51 Ca 0.27 0.07 -0.17 0.00 0.69 0.00 0.00 54.13 54.99 2dkt s LEU 51 Cb -0.18 -2.66 -0.07 0.00 -0.43 0.00 0.00 46.19 42.85 2dkt s LEU 51 CO 0.16 0.14 1.01 -1.81 -0.29 0.00 0.00 176.35 175.56 2dkt s ASP 52 N -2.64 6.35 -0.00 3.68 1.11 -1.26 -4.98 116.67 118.93 2dkt s ASP 52 Ca 0.32 1.71 0.01 0.00 0.18 0.00 0.00 52.55 54.76 2dkt s ASP 52 Cb -0.12 -2.53 -0.01 0.00 1.07 0.00 0.00 42.92 41.34 2dkt s ASP 52 CO 0.25 -0.78 0.02 -2.11 1.18 0.00 0.00 175.17 173.73 2dkt n ARG 53 N -1.55 1.65 -0.11 8.23 1.85 -1.26 -4.60 116.66 120.86 2dkt n ARG 53 Ca 0.08 -0.00 -0.14 0.00 -1.00 0.00 0.00 57.85 56.79 2dkt n ARG 53 Cb 0.53 -0.90 -0.11 0.00 -1.05 0.00 0.00 32.46 30.93 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 -1.40 0.00 0.37 2.89 3.72 -1.26 -4.41 117.46 117.37 2dkt n PHE 54 Ca -0.00 0.00 -0.15 0.00 -0.05 0.00 0.00 57.45 57.25 2dkt n PHE 54 Cb 0.01 -0.86 -0.07 0.00 -0.94 0.00 0.00 39.48 37.62 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 -0.91 -6.37 -1.08 1.79 -1.91 -3.43 116.57 104.65 2dkt h LYS 55 Ca -0.49 0.06 -0.64 0.00 -2.18 0.00 0.00 60.65 57.40 2dkt h LYS 55 Cb 1.86 0.21 0.06 0.00 -1.58 0.00 0.00 32.23 32.78 2dkt h LYS 55 CO -0.05 -0.61 0.53 1.55 -1.08 0.00 0.00 179.45 179.79 2dkt n VAL 56 N -4.63 0.22 0.00 0.50 3.14 -1.26 -4.87 118.33 111.42 2dkt n VAL 56 Ca -0.12 -0.05 0.00 0.00 -2.96 0.00 0.00 64.34 61.21 2dkt n VAL 56 Cb 0.37 -1.08 0.00 0.00 -1.06 0.00 0.00 33.84 32.08 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 2.61 2.23 -2.13 1.45 4.81 -1.26 -4.92 118.16 120.95 2dkt n LYS 57 Ca 0.17 0.00 -0.34 0.00 -0.87 0.00 0.00 58.31 57.26 2dkt n LYS 57 Cb 0.24 -0.93 0.01 0.00 0.02 0.00 0.00 35.03 34.36 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 -1.87 3.22 0.03 1.64 2.02 -1.26 -2.02 118.70 120.45 2dkt s GLU 58 Ca 0.00 1.54 -0.11 0.00 0.02 0.00 0.00 54.97 56.42 2dkt s GLU 58 Cb 0.00 -1.99 0.01 0.00 0.10 0.00 0.00 34.13 32.25 2dkt s GLU 58 CO 0.00 -0.94 0.23 0.14 0.02 0.00 0.00 175.26 174.71 2dkt s VAL 59 N -1.94 0.09 0.13 2.63 -7.23 -1.13 -3.52 120.40 109.42 2dkt s VAL 59 Ca 0.71 -0.77 0.11 0.00 -1.81 0.00 0.00 61.98 60.22 2dkt s VAL 59 Cb -0.23 -0.83 -0.04 0.00 0.56 0.00 0.00 36.38 35.84 2dkt s VAL 59 CO 0.31 -0.42 -0.27 -1.58 -0.31 0.00 0.00 175.10 172.83 2dkt s GLN 60 N -2.28 1.41 0.36 4.82 0.74 0.69 -2.94 119.66 122.46 2dkt s GLN 60 Ca -0.07 -1.34 -0.16 0.00 0.05 0.00 0.00 55.36 53.84 2dkt s GLN 60 Cb -0.02 -1.89 -0.09 0.00 1.10 0.00 0.00 33.01 32.11 2dkt s GLN 60 CO -0.02 0.45 0.80 0.00 -0.55 0.00 0.00 175.29 175.96 2dkt n ILE 62 N -0.56 0.00 -0.07 0.00 -6.64 -0.81 -2.85 119.36 108.43 2dkt n ILE 62 Ca 0.04 -0.16 -0.22 0.00 -1.77 0.00 0.00 62.75 60.64 2dkt n ILE 62 Cb 0.53 1.05 -0.12 0.00 -1.44 0.00 0.00 39.64 39.66 2dkt n ILE 62 CO 0.00 0.00 0.00 0.59 -1.77 0.00 0.00 176.55 175.37 2dkt n ASN 63 N -1.09 1.96 -0.34 7.28 3.02 -1.26 -4.51 115.26 120.32 2dkt n ASN 63 Ca 0.04 0.33 0.08 0.00 -0.03 0.00 0.00 54.58 55.00 2dkt n ASN 63 Cb 0.28 -0.91 0.14 0.00 -0.61 0.00 0.00 39.78 38.68 2dkt n ASN 63 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2dkt n GLU 65 N -1.11 -0.84 -3.29 0.00 0.28 -1.13 -4.82 120.64 109.73 2dkt n GLU 65 Ca 0.15 0.08 -0.37 0.00 -0.16 0.00 0.00 57.16 56.86 2dkt n GLU 65 Cb 0.69 -2.66 -0.06 0.00 1.43 0.00 0.00 31.44 30.84 2dkt n GLU 65 CO 0.00 0.00 0.00 0.21 -0.16 0.00 0.00 177.13 177.18 2dkt s LYS 66 N -4.53 4.12 0.38 3.44 2.47 -1.26 -4.79 119.74 119.58 2dkt s LYS 66 Ca 0.47 0.66 -0.17 0.00 -1.56 0.00 0.00 55.97 55.37 2dkt s LYS 66 Cb -0.27 -3.10 -0.10 0.00 -1.46 0.00 0.00 37.83 32.91 2dkt s LYS 66 CO 0.58 0.56 0.84 -1.17 0.16 0.00 0.00 175.35 176.32 2dkt s LEU 67 N -1.49 3.97 0.00 5.43 2.96 -1.26 -1.77 118.68 126.51 2dkt s LEU 67 Ca 0.33 1.45 -0.14 0.00 -0.22 0.00 0.00 54.13 55.55 2dkt s LEU 67 Cb -0.18 -4.29 0.05 0.00 0.50 0.00 0.00 46.19 42.27 2dkt s LEU 67 CO 0.19 -0.31 0.66 0.00 -1.32 0.00 0.00 176.35 175.57 2dkt n GLN 68 N -0.63 0.18 -2.75 1.98 10.64 -1.15 -4.96 117.38 120.69 2dkt n GLN 68 Ca 0.05 -0.55 -0.14 0.00 -1.83 0.00 0.00 57.00 54.54 2dkt n GLN 68 Cb 0.54 0.83 -0.00 0.00 -0.86 0.00 0.00 30.24 30.74 2dkt n GLN 68 CO 0.00 0.00 0.00 -2.39 -1.83 0.00 0.00 177.06 172.84 2dkt n HIS 69 N -0.47 -0.98 -1.61 2.61 1.44 -1.26 -2.85 115.22 112.10 2dkt n HIS 69 Ca 0.01 -1.23 -0.48 0.00 -2.01 0.00 0.00 57.72 54.01 2dkt n HIS 69 Cb 0.32 -0.24 -0.05 0.00 0.12 0.00 0.00 29.99 30.14 2dkt n HIS 69 CO 0.00 0.00 0.00 0.00 -2.81 0.00 0.00 176.34 173.53 2dkt n ALA 70 N -2.39 1.04 -3.66 1.59 0.00 -0.86 -4.40 120.51 111.84 2dkt n ALA 70 Ca -0.09 0.12 -0.10 0.00 0.00 0.00 0.00 53.44 53.36 2dkt n ALA 70 Cb 0.33 -2.57 0.02 0.00 0.00 0.00 0.00 19.45 17.23 2dkt n ALA 70 CO 0.00 0.00 0.00 1.14 0.00 0.00 0.00 177.50 178.64 2dkt s GLN 71 N 4.97 2.24 -0.17 0.00 -2.07 -1.26 -5.07 119.66 118.30 2dkt s GLN 71 Ca 0.98 -1.53 0.12 0.00 -1.82 0.00 0.00 55.36 53.11 2dkt s GLN 71 Cb -0.68 0.60 -0.19 0.00 -1.09 0.00 0.00 33.01 31.65 2dkt s GLN 71 CO 0.49 -1.03 0.01 0.94 -1.32 0.00 0.00 175.29 174.38 2dkt n GLN 72 N -0.55 1.21 -4.34 9.60 7.27 -1.26 -4.95 117.38 124.36 2dkt n GLN 72 Ca -0.07 0.01 -0.20 0.00 0.07 0.00 0.00 57.00 56.82 2dkt n GLN 72 Cb 0.60 -1.42 -0.10 0.00 2.41 0.00 0.00 30.24 31.73 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 -2.40 1.76 0.73 1.69 2.01 -1.26 0.18 115.64 118.35 2dkt s THR 73 Ca -0.11 -2.09 -0.11 0.00 0.31 0.00 0.00 61.69 59.68 2dkt s THR 73 Cb 0.05 -1.95 0.03 0.00 0.01 0.00 0.00 72.50 70.64 2dkt s THR 73 CO 0.63 -0.49 1.07 0.00 -0.69 0.00 0.00 174.62 175.14 2dkt n GLU 75 N -3.23 2.23 0.00 0.00 -0.58 -1.26 -3.13 120.64 114.67 2dkt n GLU 75 Ca 0.07 -1.88 0.00 0.00 -0.42 0.00 0.00 57.16 54.93 2dkt n GLU 75 Cb 0.55 -1.29 0.00 0.00 -0.57 0.00 0.00 31.44 30.12 2dkt n GLU 75 CO 0.00 0.00 0.00 -3.47 -0.48 0.00 0.00 177.13 173.18 2dkt n ASP 76 N 0.70 3.58 0.00 1.62 -0.08 -1.26 -4.83 116.55 116.28 2dkt n ASP 76 Ca 0.12 0.00 0.00 0.00 -1.51 0.00 0.00 54.79 53.40 2dkt n ASP 76 Cb 0.42 0.26 0.00 0.00 2.34 0.00 0.00 41.12 44.14 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 -0.86 -4.24 -4.59 0.00 2.88 -1.18 -4.93 113.62 100.69 2dkt n SER 78 Ca 0.00 -0.73 -0.41 0.00 -1.33 0.00 0.00 58.87 56.39 2dkt n SER 78 Cb 0.00 -4.21 -0.06 0.00 -0.75 0.00 0.00 64.21 59.19 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 -3.38 4.91 -0.27 2.46 2.01 -1.26 -4.64 115.64 115.47 2dkt s THR 79 Ca 0.48 0.83 -0.33 0.00 0.31 0.00 0.00 61.69 62.98 2dkt s THR 79 Cb -0.23 -4.03 -0.10 0.00 0.01 0.00 0.00 72.50 68.15 2dkt s THR 79 CO 0.80 -0.19 2.14 -0.11 -0.69 0.00 0.00 174.62 176.58 2dkt n LEU 80 N 5.95 2.66 -0.05 4.42 7.94 -1.26 -3.15 117.00 133.50 2dkt n LEU 80 Ca -0.01 0.45 0.00 0.00 -1.11 0.00 0.00 56.01 55.35 2dkt n LEU 80 Cb 0.49 -1.36 0.00 0.00 0.53 0.00 0.00 43.42 43.08 2dkt n LEU 80 CO 0.47 -0.61 0.47 0.49 -1.11 0.00 0.00 177.39 177.10 2dkt n PHE 81 N 9.78 0.00 0.00 1.96 3.72 0.13 -4.58 117.46 128.47 2dkt n PHE 81 Ca 0.35 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.75 2dkt n PHE 81 Cb 0.30 -0.01 0.00 0.00 -0.94 0.00 0.00 39.48 38.83 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 0.44 3.73 0.32 1.37 0.00 -1.26 -3.87 105.19 105.92 2dkt n GLY 82 Ca 0.00 -0.70 0.17 0.00 0.00 0.00 0.00 46.02 45.48 2dkt n GLY 82 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 2dkt h GLU 83 N 0.00 0.20 -5.12 1.61 4.39 -1.87 -3.35 114.58 110.44 2dkt h GLU 83 Ca 0.00 -0.01 -0.63 0.00 0.34 0.00 0.00 59.36 59.06 2dkt h GLU 83 Cb 0.00 -0.05 -0.15 0.00 -0.10 0.00 0.00 28.75 28.46 2dkt h GLU 83 CO 0.00 0.13 -0.31 0.71 -1.16 0.00 0.00 179.01 178.38 2dkt s TYR 84 N -5.86 3.26 -0.26 4.33 1.51 -1.15 -4.99 117.35 114.19 2dkt s TYR 84 Ca -0.12 0.35 0.01 0.00 -1.01 0.00 0.00 57.07 56.31 2dkt s TYR 84 Cb 0.28 -2.51 0.07 0.00 -0.11 0.00 0.00 41.96 39.69 2dkt s TYR 84 CO 0.78 -0.18 -0.02 -0.47 -1.11 0.00 0.00 175.55 174.55 2dkt s TYR 85 N 1.87 2.57 0.33 2.71 5.04 -1.26 -2.54 117.35 126.07 2dkt s TYR 85 Ca 0.13 -1.98 -0.17 0.00 -2.44 0.00 0.00 57.07 52.61 2dkt s TYR 85 Cb -0.16 -1.83 -0.09 0.00 0.35 0.00 0.00 41.96 40.23 2dkt s TYR 85 CO 0.10 -0.82 0.78 0.00 -1.34 0.00 0.00 175.55 174.27 2dkt n SER 87 N -0.22 1.47 0.07 0.00 3.41 -1.26 -3.23 113.62 113.85 2dkt n SER 87 Ca 0.03 -0.05 -0.10 0.00 -0.26 0.00 0.00 58.87 58.49 2dkt n SER 87 Cb 0.53 0.34 -0.07 0.00 -0.26 0.00 0.00 64.21 64.75 2dkt n SER 87 CO 0.00 0.00 0.00 0.40 -0.16 0.00 0.00 175.04 175.28 2dkt h ILE 88 N 0.00 0.72 0.00 -1.33 2.04 -1.94 -3.30 117.51 113.70 2dkt h ILE 88 Ca -0.48 -1.06 0.00 0.00 1.00 0.00 0.00 64.86 64.32 2dkt h ILE 88 Cb 1.92 1.22 0.00 0.00 -0.74 0.00 0.00 36.82 39.22 2dkt h ILE 88 CO -0.02 0.19 -0.30 0.00 0.00 0.00 0.00 178.15 178.02 2dkt n HIS 90 N -2.32 -2.58 -4.21 0.00 8.25 -1.20 -4.42 115.22 108.74 2dkt n HIS 90 Ca 0.04 0.96 -0.27 0.00 -0.26 0.00 0.00 57.72 58.20 2dkt n HIS 90 Cb 0.45 -4.63 -0.08 0.00 1.12 0.00 0.00 29.99 26.85 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 -7.21 3.30 -0.13 2.41 0.20 -1.25 -4.92 118.68 111.08 2dkt s LEU 91 Ca 0.54 -0.40 -0.02 0.00 0.69 0.00 0.00 54.13 54.95 2dkt s LEU 91 Cb -0.25 -1.95 0.04 0.00 -0.43 0.00 0.00 46.19 43.59 2dkt s LEU 91 CO 0.77 0.09 -0.01 -0.36 -0.29 0.00 0.00 176.35 176.55 2dkt s PHE 92 N -1.73 1.08 -0.06 5.38 0.08 -1.26 -1.41 117.98 120.06 2dkt s PHE 92 Ca 0.27 -0.64 0.01 0.00 0.12 0.00 0.00 56.93 56.69 2dkt s PHE 92 Cb -0.09 -1.02 0.02 0.00 -0.57 0.00 0.00 43.02 41.35 2dkt s PHE 92 CO 0.18 -0.50 -0.05 0.34 -0.10 0.00 0.00 175.22 175.09 2dkt s ASP 93 N 1.84 1.26 1.08 1.36 -1.08 -1.05 -4.13 116.67 115.95 2dkt s ASP 93 Ca 0.02 -0.16 -0.21 0.00 -0.52 0.00 0.00 52.55 51.68 2dkt s ASP 93 Cb -0.14 -0.54 0.01 0.00 -1.46 0.00 0.00 42.92 40.79 2dkt s ASP 93 CO -0.07 -0.06 -0.43 2.29 0.52 0.00 0.00 175.17 177.42 2dkt n LYS 94 N 4.23 -1.08 -1.54 4.34 2.85 -1.06 -2.95 118.16 122.95 2dkt n LYS 94 Ca -0.21 -0.30 -0.29 0.00 -1.05 0.00 0.00 58.31 56.45 2dkt n LYS 94 Cb 0.51 -1.50 -0.08 0.00 -0.65 0.00 0.00 35.03 33.31 2dkt n LYS 94 CO 0.00 0.00 0.00 -0.40 -0.05 0.00 0.00 177.40 176.95 2dkt n ASP 95 N -0.13 1.49 -2.61 -5.58 5.75 -1.26 -4.69 116.55 109.52 2dkt n ASP 95 Ca 0.00 -0.67 -0.13 0.00 -0.01 0.00 0.00 54.79 53.98 2dkt n ASP 95 Cb 0.66 -1.40 0.02 0.00 -1.03 0.00 0.00 41.12 39.37 2dkt n ASP 95 CO 0.00 0.00 0.00 1.17 -0.11 0.00 0.00 177.20 178.26 2dkt n LYS 96 N 8.54 1.83 -3.86 0.11 4.81 -1.26 -4.98 118.16 123.35 2dkt n LYS 96 Ca 0.47 -3.61 -0.26 0.00 -0.87 0.00 0.00 58.31 54.04 2dkt n LYS 96 Cb 0.39 -1.55 -0.04 0.00 0.02 0.00 0.00 35.03 33.85 2dkt n LYS 96 CO 0.00 0.00 0.00 -2.13 1.17 0.00 0.00 177.40 176.44 2dkt n ARG 97 N -0.24 -0.78 -4.48 1.64 3.00 -1.26 -4.77 116.66 109.78 2dkt n ARG 97 Ca 0.17 0.00 -0.30 0.00 -0.00 0.00 0.00 57.85 57.73 2dkt n ARG 97 Cb 0.79 -2.19 -0.17 0.00 0.00 0.00 0.00 32.46 30.89 2dkt n ARG 97 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 177.63 176.49 2dkt s GLN 98 N -6.36 2.46 0.26 -0.14 -0.44 -1.26 -0.50 119.66 113.68 2dkt s GLN 98 Ca 0.12 -0.65 0.02 0.00 -2.50 0.00 0.00 55.36 52.35 2dkt s GLN 98 Cb -0.07 -2.07 0.02 0.00 -1.64 0.00 0.00 33.01 29.25 2dkt s GLN 98 CO 0.71 -0.07 0.13 2.48 0.50 0.00 0.00 175.29 179.04 2dkt n TYR 99 N 4.22 -0.52 -4.34 1.67 0.18 0.20 -4.89 117.16 113.68 2dkt n TYR 99 Ca -0.19 -1.14 -0.20 0.00 1.88 0.00 0.00 57.90 58.25 2dkt n TYR 99 Cb 0.51 -0.20 -0.13 0.00 -0.38 0.00 0.00 39.34 39.14 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 -1.49 1.18 -0.17 -3.48 5.65 -1.26 -0.50 115.29 115.22 2dkt s HIS 100 Ca 0.10 -0.35 -0.01 0.00 0.25 0.00 0.00 55.06 55.04 2dkt s HIS 100 Cb -0.01 -0.70 -0.01 0.00 -1.18 0.00 0.00 32.58 30.68 2dkt s HIS 100 CO 0.06 0.03 -0.11 0.00 -0.65 0.00 0.00 174.74 174.07 2dkt h GLU 102 N 7.37 0.61 -0.91 0.00 5.08 -1.95 0.15 114.58 124.94 2dkt h GLU 102 Ca -0.34 -0.32 0.21 0.00 -1.00 0.00 0.00 59.36 57.91 2dkt h GLU 102 Cb 1.18 0.01 -0.07 0.00 0.50 0.00 0.00 28.75 30.38 2dkt h GLU 102 CO 0.58 0.91 0.60 0.77 -1.00 0.00 0.00 179.01 180.88 2dkt h SER 103 N 0.33 0.40 -0.24 1.42 0.02 -1.95 0.35 113.55 113.89 2dkt h SER 103 Ca 0.04 0.04 0.00 0.00 -0.84 0.00 0.00 61.79 61.04 2dkt h SER 103 Cb 0.79 -0.03 0.00 0.00 0.14 0.00 0.00 62.40 63.30 2dkt h SER 103 CO 0.06 0.16 0.00 0.00 -1.14 0.00 0.00 176.83 175.91 2dkt n GLY 105 N 1.17 -0.22 3.28 0.00 0.00 0.12 -4.85 105.19 104.70 2dkt n GLY 105 Ca 0.15 0.00 -0.15 0.00 0.00 0.00 0.00 46.02 46.02 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 -1.77 0.40 0.22 -0.61 -5.25 -0.97 -4.69 121.20 108.53 2dkt s ILE 106 Ca 0.00 -2.00 -0.04 0.00 -0.99 0.00 0.00 60.65 57.62 2dkt s ILE 106 Cb 0.00 -2.59 -0.05 0.00 2.95 0.00 0.00 42.46 42.77 2dkt s ILE 106 CO 0.00 -0.01 0.47 0.00 -1.79 0.00 0.00 174.94 173.60 2dkt s ARG 108 N -3.19 0.89 0.23 0.00 0.52 0.35 -4.89 118.95 112.86 2dkt s ARG 108 Ca 0.42 -0.43 -0.24 0.00 -0.52 0.00 0.00 55.73 54.95 2dkt s ARG 108 Cb -0.11 0.39 -0.09 0.00 0.52 0.00 0.00 34.95 35.66 2dkt s ARG 108 CO 0.27 -0.30 0.82 0.42 0.02 0.00 0.00 175.30 176.53 2dkt s ILE 109 N -2.58 4.35 0.00 1.52 -1.09 -1.26 -0.63 121.20 121.51 2dkt s ILE 109 Ca -0.05 1.65 0.00 0.00 -2.23 0.00 0.00 60.65 60.03 2dkt s ILE 109 Cb -0.01 -4.05 0.00 0.00 -1.58 0.00 0.00 42.46 36.83 2dkt s ILE 109 CO -0.03 0.33 0.00 0.61 -1.23 0.00 0.00 174.94 174.62 2dkt n GLY 110 N 1.06 1.73 3.69 6.18 0.00 0.35 -4.76 105.19 113.44 2dkt n GLY 110 Ca -0.02 -1.71 -0.42 0.00 0.00 0.00 0.00 46.02 43.86 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 3.92 4.27 0.35 1.61 0.04 -1.26 -4.98 135.00 138.95 2dkt s PRO 111 Ca 0.00 2.03 0.23 0.00 0.04 0.00 0.00 61.00 63.30 2dkt s PRO 111 Cb 0.00 -3.54 1.23 0.00 0.04 0.00 0.00 34.50 32.23 2dkt s PRO 111 CO 0.00 -0.58 1.37 1.17 0.04 0.00 0.00 177.00 179.00 2dkt n LYS 112 N 5.26 -0.04 -0.14 4.56 3.00 -1.26 0.83 118.16 130.36 2dkt n LYS 112 Ca 0.13 1.15 -0.05 0.00 -0.00 0.00 0.00 58.31 59.55 2dkt n LYS 112 Cb 0.43 -2.16 0.02 0.00 0.00 0.00 0.00 35.03 33.32 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 -0.09 -1.23 1.64 5.08 -1.99 0.19 114.58 118.18 2dkt h GLU 113 Ca 0.75 0.01 -0.15 0.00 -1.00 0.00 0.00 59.36 58.97 2dkt h GLU 113 Cb 2.19 0.02 -0.08 0.00 0.50 0.00 0.00 28.75 31.39 2dkt h GLU 113 CO -0.55 -0.06 0.19 -0.25 -1.00 0.00 0.00 179.01 177.34 2dkt n ASP 114 N -5.38 4.06 -3.94 1.42 8.00 0.24 -4.83 116.55 116.11 2dkt n ASP 114 Ca 0.03 -2.52 -0.09 0.00 0.71 0.00 0.00 54.79 52.92 2dkt n ASP 114 Cb 0.29 -0.74 -0.05 0.00 -0.02 0.00 0.00 41.12 40.60 2dkt n ASP 114 CO 0.00 0.00 0.00 -0.36 -0.39 0.00 0.00 177.20 176.45 2dkt s PHE 115 N -0.89 0.21 0.33 1.24 0.40 0.66 -2.92 117.98 117.01 2dkt s PHE 115 Ca 0.15 -0.59 -0.18 0.00 -0.60 0.00 0.00 56.93 55.72 2dkt s PHE 115 Cb 0.13 0.30 0.05 0.00 0.51 0.00 0.00 43.02 44.01 2dkt s PHE 115 CO 0.02 -1.02 0.82 -0.59 0.70 0.00 0.00 175.22 175.15 2dkt s PHE 116 N -3.98 0.05 -0.06 0.36 -0.12 0.23 -4.66 117.98 109.80 2dkt s PHE 116 Ca 0.19 -0.64 0.01 0.00 -0.05 0.00 0.00 56.93 56.43 2dkt s PHE 116 Cb -0.02 0.79 0.02 0.00 -0.63 0.00 0.00 43.02 43.19 2dkt s PHE 116 CO 0.07 -1.39 -0.07 -1.58 -0.05 0.00 0.00 175.22 172.20 2dkt s HIS 117 N -2.57 1.05 0.06 3.49 5.65 -1.26 -0.18 115.29 121.53 2dkt s HIS 117 Ca 0.16 -0.37 -0.10 0.00 0.25 0.00 0.00 55.06 55.00 2dkt s HIS 117 Cb -0.05 -0.87 -0.06 0.00 -1.18 0.00 0.00 32.58 30.43 2dkt s HIS 117 CO 0.09 -0.27 0.38 0.00 -0.65 0.00 0.00 174.74 174.29 2dkt h LEU 119 N 3.85 0.00 -0.95 0.00 3.38 -1.97 -1.91 115.31 117.72 2dkt h LEU 119 Ca -0.49 0.00 0.28 0.00 0.09 0.00 0.00 57.88 57.76 2dkt h LEU 119 Cb 1.20 0.00 -0.17 0.00 0.09 0.00 0.00 40.66 41.78 2dkt h LEU 119 CO 0.66 0.30 0.20 0.11 0.09 0.00 0.00 178.44 179.80 2dkt h LYS 120 N -0.55 0.09 0.00 1.13 1.79 -1.97 1.39 116.57 118.44 2dkt h LYS 120 Ca 0.00 -0.01 -0.10 0.00 -2.18 0.00 0.00 60.65 58.36 2dkt h LYS 120 Cb 0.05 -0.02 -0.01 0.00 -1.58 0.00 0.00 32.23 30.66 2dkt h LYS 120 CO 0.00 0.06 -0.48 0.00 -1.08 0.00 0.00 179.45 177.94 2dkt n ASN 122 N -3.29 -3.57 -3.05 0.00 3.02 0.48 -4.99 115.26 103.86 2dkt n ASN 122 Ca 0.01 -0.73 -0.05 0.00 -0.03 0.00 0.00 54.58 53.79 2dkt n ASN 122 Cb 0.69 -4.77 0.02 0.00 -0.61 0.00 0.00 39.78 35.11 2dkt n ASN 122 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2dkt n LEU 123 N -3.89 0.00 -4.85 3.41 -0.00 -1.05 -4.96 117.00 105.67 2dkt n LEU 123 Ca -0.21 -1.85 -0.37 0.00 -0.00 0.00 0.00 56.01 53.59 2dkt n LEU 123 Cb 0.65 3.13 -0.06 0.00 -0.00 0.00 0.00 43.42 47.13 2dkt n LEU 123 CO 0.63 -0.62 -0.15 0.00 -0.00 0.00 0.00 177.39 177.25 2dkt s LEU 125 N -0.77 1.74 0.43 0.00 1.43 0.75 -4.94 118.68 117.31 2dkt s LEU 125 Ca 0.14 0.10 -0.24 0.00 -1.03 0.00 0.00 54.13 53.11 2dkt s LEU 125 Cb -0.12 0.16 -0.08 0.00 0.03 0.00 0.00 46.19 46.18 2dkt s LEU 125 CO 0.04 -0.03 1.15 0.28 0.23 0.00 0.00 176.35 178.02 2dkt s THR 126 N 0.11 3.23 0.32 5.49 -1.32 -1.26 -0.60 115.64 121.61 2dkt s THR 126 Ca -0.01 0.97 0.09 0.00 -1.21 0.00 0.00 61.69 61.54 2dkt s THR 126 Cb -0.01 -3.51 0.32 0.00 -1.51 0.00 0.00 72.50 67.79 2dkt s THR 126 CO -0.00 0.03 1.66 0.71 -2.21 0.00 0.00 174.62 174.80 2dkt h THR 127 N 2.11 0.30 -1.11 5.08 1.35 -1.80 0.26 112.91 119.10 2dkt h THR 127 Ca -0.49 -0.09 0.41 0.00 -0.55 0.00 0.00 66.41 65.68 2dkt h THR 127 Cb 1.24 -0.00 -0.16 0.00 -1.73 0.00 0.00 68.15 67.50 2dkt h THR 127 CO 0.61 0.05 0.65 -1.13 -0.25 0.00 0.00 175.52 175.46 2dkt h ASN 128 N 0.28 0.33 -1.52 5.36 -1.24 -1.91 0.77 115.58 117.64 2dkt h ASN 128 Ca 0.66 0.21 -0.70 0.00 0.71 0.00 0.00 56.30 57.18 2dkt h ASN 128 Cb 1.45 0.20 -0.31 0.00 0.73 0.00 0.00 38.32 40.39 2dkt h ASN 128 CO -0.63 -0.30 0.64 0.18 -1.29 0.00 0.00 177.43 176.03 2dkt n LEU 129 N -5.03 7.04 0.33 0.34 4.77 0.93 -4.74 117.00 120.63 2dkt n LEU 129 Ca 0.37 -4.71 -0.13 0.00 -0.03 0.00 0.00 56.01 51.51 2dkt n LEU 129 Cb 1.28 -0.91 -0.06 0.00 -2.33 0.00 0.00 43.42 41.41 2dkt n LEU 129 CO 0.09 1.76 0.40 0.03 -1.33 0.00 0.00 177.39 178.33 2dkt h ARG 130 N 2.57 -0.83 -1.10 3.23 3.08 0.47 -3.36 114.38 118.44 2dkt h ARG 130 Ca 0.53 0.06 -0.60 0.00 0.07 0.00 0.00 59.98 60.04 2dkt h ARG 130 Cb 0.50 0.19 -0.40 0.00 0.08 0.00 0.00 29.97 30.34 2dkt h ARG 130 CO 1.36 -0.55 -0.42 0.41 -1.07 0.00 0.00 179.97 179.70 2dkt n GLY 131 N -0.71 6.16 1.12 0.04 0.00 -1.26 -4.67 105.19 105.86 2dkt n GLY 131 Ca -0.11 -2.64 0.00 0.00 0.00 0.00 0.00 46.02 43.28 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 -0.66 0.00 -0.59 1.61 4.81 -1.26 -5.08 118.16 117.00 2dkt n LYS 132 Ca 0.46 0.00 -0.30 0.00 -0.87 0.00 0.00 58.31 57.60 2dkt n LYS 132 Cb 0.78 -0.45 0.21 0.00 0.02 0.00 0.00 35.03 35.59 2dkt n LYS 132 CO 0.00 0.00 0.00 -2.39 1.17 0.00 0.00 177.40 176.18 2dkt n HIS 133 N -3.02 -0.56 -4.36 5.64 1.44 -1.26 -5.04 115.22 108.07 2dkt n HIS 133 Ca 0.00 0.10 -0.28 0.00 -2.01 0.00 0.00 57.72 55.53 2dkt n HIS 133 Cb 0.38 -1.80 -0.12 0.00 0.12 0.00 0.00 29.99 28.58 2dkt n HIS 133 CO 0.00 0.00 0.00 -1.59 -2.81 0.00 0.00 176.34 171.94 2dkt s LYS 134 N -4.31 1.63 -0.08 -1.40 0.00 -1.26 -5.05 119.74 109.27 2dkt s LYS 134 Ca 0.66 -1.33 -0.01 0.00 0.00 0.00 0.00 55.97 55.29 2dkt s LYS 134 Cb -0.23 -1.99 -0.05 0.00 0.00 0.00 0.00 37.83 35.57 2dkt s LYS 134 CO 0.63 0.45 -0.08 0.00 0.00 0.00 0.00 175.35 176.34 2dkt s ILE 136 N -2.16 4.51 -0.80 0.00 2.07 -1.26 -4.78 121.20 118.79 2dkt s ILE 136 Ca -0.11 1.27 -0.26 0.00 -1.41 0.00 0.00 60.65 60.14 2dkt s ILE 136 Cb 0.03 -3.65 0.01 0.00 0.13 0.00 0.00 42.46 38.98 2dkt s ILE 136 CO 0.17 -0.19 1.60 -1.61 -1.91 0.00 0.00 174.94 173.00 2dkt s GLU 137 N -2.92 3.01 -0.33 3.50 2.02 -1.26 -4.96 118.70 117.77 2dkt s GLU 137 Ca 0.56 -0.22 -0.13 0.00 0.02 0.00 0.00 54.97 55.20 2dkt s GLU 137 Cb -0.11 -4.66 -0.02 0.00 0.10 0.00 0.00 34.13 29.43 2dkt s GLU 137 CO 0.16 -2.55 0.28 -1.54 0.02 0.00 0.00 175.26 171.63 2dkt s SER 138 N 5.97 6.10 0.11 -0.19 1.04 -1.26 -4.93 113.70 120.54 2dkt s SER 138 Ca 0.52 -0.25 0.00 0.00 0.48 0.00 0.00 55.95 56.71 2dkt s SER 138 Cb -0.07 -2.16 0.00 0.00 0.10 0.00 0.00 66.02 63.89 2dkt s SER 138 CO 0.08 -0.23 0.00 0.61 0.98 0.00 0.00 173.24 174.68 2dkt n GLY 139 N 5.03 -3.08 0.00 7.32 0.00 -1.26 -4.33 105.19 108.87 2dkt n GLY 139 Ca -0.12 -1.19 0.07 0.00 0.00 0.00 0.00 46.02 44.78 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 -1.58 0.08 -0.09 1.61 -0.04 -1.26 -3.06 135.00 130.65 2dkt n PRO 140 Ca 0.00 0.22 -0.11 0.00 -0.04 0.00 0.00 63.50 63.56 2dkt n PRO 140 Cb 0.07 -1.50 -0.04 0.00 -0.04 0.00 0.00 33.50 31.99 2dkt n PRO 140 CO 0.00 0.00 0.00 1.03 -0.04 0.00 0.00 175.50 176.49 2dkt h SER 141 N 0.00 0.49 -3.45 3.54 0.87 -2.00 -3.42 113.55 109.57 2dkt h SER 141 Ca 0.00 -0.34 -0.53 0.00 -1.23 0.00 0.00 61.79 59.70 2dkt h SER 141 Cb 0.21 -0.13 -0.01 0.00 -0.44 0.00 0.00 62.40 62.03 2dkt h SER 141 CO 0.00 0.71 0.44 -0.55 -0.53 0.00 0.00 176.83 176.90 2dkt s SER 142 N -6.04 7.31 0.00 6.23 0.15 -1.17 -5.18 113.70 115.01 2dkt s SER 142 Ca -0.13 1.90 0.00 0.00 0.70 0.00 0.00 55.95 58.41 2dkt s SER 142 Cb 0.08 -2.59 0.00 0.00 -1.71 0.00 0.00 66.02 61.80 2dkt s SER 142 CO 0.76 -0.24 0.17 0.61 1.20 0.00 0.00 173.24 175.74