#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2dkt h SER 2 N 0.00 -0.02 -1.33 1.61 0.87 -2.14 -3.40 113.55 109.13 2dkt h SER 2 Ca 0.00 0.24 -0.53 0.00 -1.23 0.00 0.00 61.79 60.27 2dkt h SER 2 Cb 0.00 0.32 -0.04 0.00 -0.44 0.00 0.00 62.40 62.24 2dkt h SER 2 CO 0.00 -0.29 -0.38 -0.94 -0.53 0.00 0.00 176.83 174.69 2dkt s SER 3 N -4.90 4.84 0.00 6.23 1.04 -1.26 -5.13 113.70 114.52 2dkt s SER 3 Ca -0.11 -0.92 0.00 0.00 0.48 0.00 0.00 55.95 55.40 2dkt s SER 3 Cb 0.29 -0.34 0.00 0.00 0.10 0.00 0.00 66.02 66.07 2dkt s SER 3 CO 0.78 -0.73 0.00 0.61 0.98 0.00 0.00 173.24 174.88 2dkt n GLY 4 N -1.54 4.33 3.91 7.32 0.00 -1.26 -5.16 105.19 112.79 2dkt n GLY 4 Ca 0.02 -0.56 -0.29 0.00 0.00 0.00 0.00 46.02 45.19 2dkt n GLY 4 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2dkt s SER 5 N 1.00 4.45 -0.07 1.61 0.15 -1.26 -5.05 113.70 114.54 2dkt s SER 5 Ca 0.00 0.69 -0.09 0.00 0.70 0.00 0.00 55.95 57.25 2dkt s SER 5 Cb 0.00 -1.17 -0.04 0.00 -1.71 0.00 0.00 66.02 63.10 2dkt s SER 5 CO 0.00 -1.92 -0.18 -1.54 1.20 0.00 0.00 173.24 170.80 2dkt n SER 6 N -3.29 1.44 -4.71 5.45 3.41 -1.26 -5.05 113.62 109.61 2dkt n SER 6 Ca 0.09 0.23 -0.29 0.00 -0.26 0.00 0.00 58.87 58.63 2dkt n SER 6 Cb 0.61 -0.52 0.11 0.00 -0.26 0.00 0.00 64.21 64.15 2dkt n SER 6 CO 0.00 0.00 0.00 -0.83 -0.16 0.00 0.00 175.04 174.05 2dkt s GLY 7 N -4.64 1.64 0.00 5.00 0.00 -1.26 -5.08 107.32 102.98 2dkt s GLY 7 Ca -0.16 -0.79 0.00 0.00 0.00 0.00 0.00 44.72 43.77 2dkt s GLY 7 CO 0.23 -0.23 0.00 0.61 0.00 0.00 0.00 173.10 173.71 2dkt n GLY 8 N -3.43 2.08 2.99 0.20 0.00 -1.26 -5.14 105.19 100.63 2dkt n GLY 8 Ca 0.10 -0.23 -0.05 0.00 0.00 0.00 0.00 46.02 45.84 2dkt n GLY 8 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2dkt s VAL 9 N 1.54 -0.74 1.02 1.61 1.01 -1.26 -5.16 120.40 118.41 2dkt s VAL 9 Ca 0.00 -0.13 -0.12 0.00 0.00 0.00 0.00 61.98 61.73 2dkt s VAL 9 Cb 0.00 -0.93 0.20 0.00 0.00 0.00 0.00 36.38 35.64 2dkt s VAL 9 CO 0.00 -0.14 1.08 0.00 0.00 0.00 0.00 175.10 176.03 2dkt s ARG 10 N 2.64 0.27 0.19 2.72 3.03 -1.26 -5.06 118.95 121.49 2dkt s ARG 10 Ca 0.13 0.88 0.10 0.00 2.03 0.00 0.00 55.73 58.86 2dkt s ARG 10 Cb -0.14 -1.69 -0.04 0.00 -1.03 0.00 0.00 34.95 32.05 2dkt s ARG 10 CO -0.23 -2.93 -0.19 -0.80 -1.13 0.00 0.00 175.30 170.01 2dkt s ASN 11 N -2.99 2.97 0.79 -2.89 -0.87 -1.26 -5.13 114.94 105.54 2dkt s ASN 11 Ca 0.66 -0.91 -0.12 0.00 -1.57 0.00 0.00 52.86 50.92 2dkt s ASN 11 Cb -0.21 -0.20 0.07 0.00 -0.02 0.00 0.00 41.25 40.89 2dkt s ASN 11 CO 0.60 -0.01 1.12 -1.48 -2.57 0.00 0.00 177.10 174.77 2dkt s LEU 12 N -2.88 3.08 -0.00 0.60 2.34 -1.26 -5.04 118.68 115.51 2dkt s LEU 12 Ca 0.20 2.02 0.06 0.00 0.06 0.00 0.00 54.13 56.46 2dkt s LEU 12 Cb -0.05 -4.55 -0.03 0.00 -0.56 0.00 0.00 46.19 41.00 2dkt s LEU 12 CO 0.09 -2.28 -0.17 0.00 -1.06 0.00 0.00 176.35 172.92 2dkt s ALA 13 N -2.62 2.57 -0.24 1.48 0.00 -1.26 -5.11 121.76 116.58 2dkt s ALA 13 Ca 0.65 -1.09 -0.03 0.00 0.00 0.00 0.00 51.96 51.49 2dkt s ALA 13 Cb -0.21 -0.81 0.13 0.00 0.00 0.00 0.00 23.12 22.23 2dkt s ALA 13 CO 0.53 0.56 0.41 1.14 0.00 0.00 0.00 175.76 178.40 2dkt s GLN 14 N -1.04 0.37 0.00 0.00 -2.07 -1.26 -5.08 119.66 110.58 2dkt s GLN 14 Ca 0.13 0.67 0.00 0.00 -1.82 0.00 0.00 55.36 54.33 2dkt s GLN 14 Cb -0.10 -0.24 0.00 0.00 -1.09 0.00 0.00 33.01 31.57 2dkt s GLN 14 CO 0.03 -0.58 0.00 0.41 -1.32 0.00 0.00 175.29 173.83 2dkt n GLY 15 N 5.38 -0.12 0.00 2.60 0.00 -1.26 -4.91 105.19 106.88 2dkt n GLY 15 Ca -0.04 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.98 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 -1.63 -0.87 -2.30 1.61 -0.04 -1.26 -3.74 135.00 126.77 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 -0.02 0.00 -0.04 0.00 0.00 33.50 33.44 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 -1.40 -1.56 -0.37 0.54 3.00 -1.26 -4.48 116.66 111.13 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 -5.56 0.00 0.00 0.00 0.00 0.00 32.46 26.90 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 -0.98 -0.50 3.99 -0.13 0.00 -0.81 -4.72 105.19 102.04 2dkt n GLY 18 Ca -0.23 -0.83 -0.20 0.00 0.00 0.00 0.00 46.02 44.77 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 0.37 0.00 0.11 0.00 4.11 -1.90 -1.39 114.58 115.87 2dkt h GLU 20 Ca -0.42 0.00 -0.01 0.00 0.07 0.00 0.00 59.36 59.01 2dkt h GLU 20 Cb 1.28 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.53 2dkt h GLU 20 CO 0.50 0.00 -0.05 0.45 0.07 0.00 0.00 179.01 179.98 2dkt h HIS 21 N 0.00 -0.13 -4.28 2.06 3.86 -1.98 -3.49 115.15 111.19 2dkt h HIS 21 Ca 0.00 -0.00 -0.17 0.00 -1.16 0.00 0.00 60.37 59.04 2dkt h HIS 21 Cb 1.18 0.04 -0.14 0.00 1.06 0.00 0.00 27.41 29.55 2dkt h HIS 21 CO 0.00 -0.08 -0.52 0.71 0.86 0.00 0.00 177.93 178.90 2dkt s TYR 22 N -1.93 0.78 -0.62 2.45 2.02 -0.52 -5.12 117.35 114.41 2dkt s TYR 22 Ca -0.02 -1.12 -0.07 0.00 -0.37 0.00 0.00 57.07 55.49 2dkt s TYR 22 Cb 0.00 -0.35 0.16 0.00 -0.40 0.00 0.00 41.96 41.38 2dkt s TYR 22 CO 0.06 -0.63 0.48 -0.51 -1.57 0.00 0.00 175.55 173.38 2dkt s ASP 23 N -3.05 5.69 0.12 2.29 1.01 -1.26 -0.46 116.67 121.01 2dkt s ASP 23 Ca 0.26 -2.55 0.05 0.00 0.71 0.00 0.00 52.55 51.01 2dkt s ASP 23 Cb 0.06 -1.97 -0.04 0.00 1.01 0.00 0.00 42.92 41.98 2dkt s ASP 23 CO 0.04 -0.50 -0.12 0.00 0.21 0.00 0.00 175.17 174.81 2dkt s ARG 24 N 0.38 0.98 -0.33 8.23 1.70 -1.26 -2.68 118.95 125.97 2dkt s ARG 24 Ca 0.14 -1.27 0.07 0.00 -0.47 0.00 0.00 55.73 54.20 2dkt s ARG 24 Cb -0.19 -0.72 0.47 0.00 -0.57 0.00 0.00 34.95 33.94 2dkt s ARG 24 CO -0.04 0.12 1.40 0.00 -1.08 0.00 0.00 175.30 175.70 2dkt n ALA 25 N 0.35 4.82 -3.66 7.88 0.00 -1.23 -1.92 120.51 126.76 2dkt n ALA 25 Ca -0.14 -3.49 -0.06 0.00 0.00 0.00 0.00 53.44 49.74 2dkt n ALA 25 Cb 0.58 -0.66 -0.07 0.00 0.00 0.00 0.00 19.45 19.30 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 2.01 4.60 -0.23 0.00 1.02 0.11 -4.78 118.68 121.41 2dkt s LEU 27 Ca -0.08 1.72 -0.20 0.00 0.02 0.00 0.00 54.13 55.59 2dkt s LEU 27 Cb -0.08 -3.39 -0.02 0.00 0.02 0.00 0.00 46.19 42.72 2dkt s LEU 27 CO -0.18 0.17 0.59 -1.48 0.02 0.00 0.00 176.35 175.48 2dkt s LEU 28 N -1.04 4.10 0.61 1.79 0.05 -1.18 -0.28 118.68 122.72 2dkt s LEU 28 Ca 0.38 0.72 -0.19 0.00 0.05 0.00 0.00 54.13 55.09 2dkt s LEU 28 Cb -0.24 -2.81 -0.04 0.00 -2.05 0.00 0.00 46.19 41.05 2dkt s LEU 28 CO 0.28 -0.29 1.15 1.17 -0.55 0.00 0.00 176.35 178.11 2dkt n LYS 29 N 5.28 1.11 -3.69 1.48 3.00 -1.24 -3.73 118.16 120.37 2dkt n LYS 29 Ca -0.02 0.43 -0.38 0.00 -0.00 0.00 0.00 58.31 58.33 2dkt n LYS 29 Cb 0.50 -2.37 -0.11 0.00 0.00 0.00 0.00 35.03 33.05 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 -1.42 3.18 -2.00 3.14 0.00 0.25 -4.87 121.76 120.04 2dkt s ALA 30 Ca 0.78 -2.16 0.09 0.00 0.00 0.00 0.00 51.96 50.67 2dkt s ALA 30 Cb -0.41 -2.48 0.53 0.00 0.00 0.00 0.00 23.12 20.77 2dkt s ALA 30 CO 0.45 -1.61 0.97 -0.35 0.00 0.00 0.00 175.76 175.22 2dkt n PRO 31 N 4.80 0.49 -0.12 0.00 -0.04 -1.26 0.18 135.00 139.04 2dkt n PRO 31 Ca -0.09 0.00 -0.26 0.00 -0.04 0.00 0.00 63.50 63.11 2dkt n PRO 31 Cb 0.43 -1.28 -0.11 0.00 -0.04 0.00 0.00 33.50 32.50 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 -0.38 -5.30 -4.97 0.00 2.03 0.46 -4.97 116.55 103.42 2dkt n ASP 34 Ca 0.00 0.05 -0.23 0.00 0.52 0.00 0.00 54.79 55.14 2dkt n ASP 34 Cb 0.24 -4.44 0.03 0.00 -0.72 0.00 0.00 41.12 36.24 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 -5.04 2.29 -0.03 -0.67 1.02 -1.18 -4.77 119.74 111.37 2dkt s LYS 35 Ca 0.00 -1.80 0.02 0.00 0.02 0.00 0.00 55.97 54.20 2dkt s LYS 35 Cb 0.00 -2.40 0.01 0.00 -0.52 0.00 0.00 37.83 34.92 2dkt s LYS 35 CO 0.00 -0.73 -0.06 -0.51 -0.92 0.00 0.00 175.35 173.13 2dkt s LEU 36 N -4.48 1.57 0.00 3.17 1.43 -1.26 0.87 118.68 119.98 2dkt s LEU 36 Ca 0.49 -0.14 -0.03 0.00 -1.03 0.00 0.00 54.13 53.42 2dkt s LEU 36 Cb -0.04 -0.45 -0.01 0.00 0.03 0.00 0.00 46.19 45.72 2dkt s LEU 36 CO 0.31 -0.00 0.05 -0.31 0.23 0.00 0.00 176.35 176.62 2dkt s TYR 37 N 0.54 0.10 0.02 0.29 1.51 -1.24 -5.00 117.35 113.57 2dkt s TYR 37 Ca -0.07 -0.21 -0.04 0.00 -1.01 0.00 0.00 57.07 55.74 2dkt s TYR 37 Cb -0.11 -0.09 -0.01 0.00 -0.11 0.00 0.00 41.96 41.64 2dkt s TYR 37 CO 0.00 -0.17 0.66 2.41 -1.11 0.00 0.00 175.55 177.34 2dkt n THR 38 N 1.99 -0.09 -4.42 -0.71 -1.04 -1.26 -3.13 114.28 105.62 2dkt n THR 38 Ca -0.20 1.00 -0.21 0.00 -2.04 0.00 0.00 64.05 62.60 2dkt n THR 38 Cb 0.56 -1.30 -0.10 0.00 -1.82 0.00 0.00 70.33 67.68 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 2.15 0.82 -0.37 0.00 -0.00 -1.92 -1.24 114.38 113.81 2dkt h ARG 40 Ca -0.39 -0.05 -0.10 0.00 -0.00 0.00 0.00 59.98 59.44 2dkt h ARG 40 Cb 1.25 -0.18 -0.02 0.00 -0.00 0.00 0.00 29.97 31.02 2dkt h ARG 40 CO 0.65 0.54 -0.19 -0.07 -0.00 0.00 0.00 179.97 180.90 2dkt h LEU 41 N 0.84 0.71 -0.37 0.08 3.38 -1.96 -3.06 115.31 114.93 2dkt h LEU 41 Ca 0.35 -0.23 0.02 0.00 0.09 0.00 0.00 57.88 58.10 2dkt h LEU 41 Cb 0.27 -0.19 -0.03 0.00 0.09 0.00 0.00 40.66 40.80 2dkt h LEU 41 CO -0.12 0.89 0.22 0.00 0.09 0.00 0.00 178.44 179.52 2dkt h HIS 43 N 0.44 -1.35 -0.87 0.00 -0.00 -1.39 0.11 115.15 112.09 2dkt h HIS 43 Ca 0.15 0.06 0.15 0.00 -0.00 0.00 0.00 60.37 60.73 2dkt h HIS 43 Cb 0.01 0.62 -0.07 0.00 -0.00 0.00 0.00 27.41 27.98 2dkt h HIS 43 CO -0.08 -0.41 0.56 0.22 -0.00 0.00 0.00 177.93 178.23 2dkt h ASP 44 N -0.37 0.59 -0.86 3.26 3.58 -1.59 0.20 116.42 121.22 2dkt h ASP 44 Ca 0.05 0.04 -0.03 0.00 0.42 0.00 0.00 57.03 57.50 2dkt h ASP 44 Cb 0.50 -0.08 -0.04 0.00 1.72 0.00 0.00 39.33 41.44 2dkt h ASP 44 CO -0.44 0.29 0.42 0.74 -2.88 0.00 0.00 179.24 177.38 2dkt h THR 45 N 0.62 1.26 -0.58 2.25 2.02 -0.30 -2.50 112.91 115.67 2dkt h THR 45 Ca 0.44 -0.72 -0.19 0.00 0.77 0.00 0.00 66.41 66.70 2dkt h THR 45 Cb 0.78 0.15 -0.11 0.00 -1.74 0.00 0.00 68.15 67.22 2dkt h THR 45 CO -0.19 0.31 0.18 0.59 0.37 0.00 0.00 175.52 176.78 2dkt n ASN 46 N -4.31 4.08 -4.07 4.18 3.02 0.02 -4.97 115.26 113.22 2dkt n ASN 46 Ca 0.09 -3.32 -0.10 0.00 -0.03 0.00 0.00 54.58 51.21 2dkt n ASN 46 Cb 0.14 -0.69 -0.08 0.00 -0.61 0.00 0.00 39.78 38.54 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 -3.04 1.33 -0.05 3.52 0.41 0.51 -5.00 118.70 116.38 2dkt s GLU 47 Ca 0.51 -1.38 0.20 0.00 -0.41 0.00 0.00 54.97 53.89 2dkt s GLU 47 Cb 0.42 0.37 -0.27 0.00 -1.78 0.00 0.00 34.13 32.87 2dkt s GLU 47 CO 0.10 -0.50 0.46 -3.47 -0.49 0.00 0.00 175.26 171.36 2dkt n ASP 48 N -0.30 0.17 -4.84 -0.19 2.03 -1.26 -4.74 116.55 107.42 2dkt n ASP 48 Ca -0.01 0.07 -0.24 0.00 0.52 0.00 0.00 54.79 55.13 2dkt n ASP 48 Cb 0.64 1.40 -0.04 0.00 -0.72 0.00 0.00 41.12 42.39 2dkt n ASP 48 CO 0.00 0.00 0.00 -1.38 -1.92 0.00 0.00 177.20 173.90 2dkt s HIS 49 N -3.17 3.19 0.02 -0.67 -3.43 -1.26 -5.10 115.29 104.86 2dkt s HIS 49 Ca -0.07 -0.05 -0.22 0.00 -0.80 0.00 0.00 55.06 53.92 2dkt s HIS 49 Cb 0.11 -1.48 -0.05 0.00 -1.43 0.00 0.00 32.58 29.72 2dkt s HIS 49 CO 0.87 0.51 0.64 -1.14 -2.00 0.00 0.00 174.74 173.62 2dkt s GLN 50 N -3.51 4.36 0.09 -0.38 -0.44 -1.26 -4.41 119.66 114.11 2dkt s GLN 50 Ca 0.32 0.82 -0.01 0.00 -2.50 0.00 0.00 55.36 54.00 2dkt s GLN 50 Cb -0.09 -3.34 -0.04 0.00 -1.64 0.00 0.00 33.01 27.90 2dkt s GLN 50 CO 0.25 0.37 0.26 -1.17 0.50 0.00 0.00 175.29 175.50 2dkt s LEU 51 N -0.23 4.33 0.52 3.68 0.20 -1.26 -5.05 118.68 120.88 2dkt s LEU 51 Ca 0.33 0.32 -0.18 0.00 0.69 0.00 0.00 54.13 55.29 2dkt s LEU 51 Cb -0.19 -3.03 -0.07 0.00 -0.43 0.00 0.00 46.19 42.47 2dkt s LEU 51 CO 0.19 0.12 1.01 -1.81 -0.29 0.00 0.00 176.35 175.57 2dkt s ASP 52 N -2.62 6.35 -0.00 3.68 1.01 -1.26 -4.98 116.67 118.85 2dkt s ASP 52 Ca 0.36 1.73 0.02 0.00 0.71 0.00 0.00 52.55 55.37 2dkt s ASP 52 Cb -0.12 -2.53 -0.02 0.00 1.01 0.00 0.00 42.92 41.25 2dkt s ASP 52 CO 0.28 -0.77 0.05 -2.11 0.21 0.00 0.00 175.17 172.83 2dkt n ARG 53 N -1.46 3.40 -0.10 8.23 1.85 -1.26 -4.60 116.66 122.73 2dkt n ARG 53 Ca 0.08 -0.01 -0.13 0.00 -1.00 0.00 0.00 57.85 56.79 2dkt n ARG 53 Cb 0.53 -0.80 -0.10 0.00 -1.05 0.00 0.00 32.46 31.04 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 -1.29 0.00 0.18 2.89 3.72 -1.26 -4.42 117.46 117.29 2dkt n PHE 54 Ca 0.00 0.00 -0.07 0.00 -0.05 0.00 0.00 57.45 57.33 2dkt n PHE 54 Cb 0.03 -0.79 -0.03 0.00 -0.94 0.00 0.00 39.48 37.75 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 -0.45 -6.30 -1.08 1.79 -1.91 -3.43 116.57 105.18 2dkt h LYS 55 Ca -0.45 0.03 -0.67 0.00 -2.18 0.00 0.00 60.65 57.38 2dkt h LYS 55 Cb 1.77 0.10 0.06 0.00 -1.58 0.00 0.00 32.23 32.58 2dkt h LYS 55 CO -0.05 -0.30 0.49 1.55 -1.08 0.00 0.00 179.45 180.06 2dkt n VAL 56 N -3.29 0.04 0.00 0.50 3.14 -1.26 -4.86 118.33 112.59 2dkt n VAL 56 Ca -0.06 -0.01 0.00 0.00 -2.96 0.00 0.00 64.34 61.31 2dkt n VAL 56 Cb 0.18 -0.91 0.00 0.00 -1.06 0.00 0.00 33.84 32.06 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 2.60 1.16 -0.86 1.45 4.81 -1.26 -4.93 118.16 121.13 2dkt n LYS 57 Ca 0.18 0.00 -0.31 0.00 -0.87 0.00 0.00 58.31 57.31 2dkt n LYS 57 Cb 0.20 -0.94 0.15 0.00 0.02 0.00 0.00 35.03 34.46 2dkt n LYS 57 CO 0.00 0.00 0.00 -2.00 1.17 0.00 0.00 177.40 176.57 2dkt s GLU 58 N -1.88 1.24 0.01 1.64 2.56 -1.26 -2.46 118.70 118.54 2dkt s GLU 58 Ca 0.00 1.37 -0.22 0.00 0.00 0.00 0.00 54.97 56.12 2dkt s GLU 58 Cb 0.00 -1.77 0.05 0.00 2.00 0.00 0.00 34.13 34.41 2dkt s GLU 58 CO 0.00 -2.42 0.50 0.14 -0.56 0.00 0.00 175.26 172.92 2dkt s VAL 59 N -2.72 0.03 0.05 3.70 -7.23 -1.03 -3.71 120.40 109.49 2dkt s VAL 59 Ca 0.65 -0.26 0.09 0.00 -1.81 0.00 0.00 61.98 60.65 2dkt s VAL 59 Cb -0.21 -0.91 -0.03 0.00 0.56 0.00 0.00 36.38 35.79 2dkt s VAL 59 CO 0.58 -0.14 -0.24 -1.58 -0.31 0.00 0.00 175.10 173.40 2dkt s GLN 60 N -1.95 1.85 0.38 4.82 0.74 0.62 -2.98 119.66 123.15 2dkt s GLN 60 Ca -0.08 -1.09 -0.18 0.00 0.05 0.00 0.00 55.36 54.06 2dkt s GLN 60 Cb -0.01 -2.03 -0.10 0.00 1.10 0.00 0.00 33.01 31.97 2dkt s GLN 60 CO 0.02 0.52 0.86 0.00 -0.55 0.00 0.00 175.29 176.13 2dkt n ILE 62 N -0.54 0.00 -0.02 0.00 -6.64 -0.80 -2.91 119.36 108.45 2dkt n ILE 62 Ca 0.05 -0.18 -0.20 0.00 -1.77 0.00 0.00 62.75 60.66 2dkt n ILE 62 Cb 0.54 0.89 -0.13 0.00 -1.44 0.00 0.00 39.64 39.50 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 0.27 0.00 7.28 4.21 -1.94 -3.39 115.58 122.00 2dkt h ASN 63 Ca 0.00 -0.83 -0.02 0.00 1.21 0.00 0.00 56.30 56.66 2dkt h ASN 63 Cb 0.39 -0.09 -0.05 0.00 -1.12 0.00 0.00 38.32 37.45 2dkt h ASN 63 CO 0.00 1.47 -0.37 0.00 -1.29 0.00 0.00 177.43 177.24 2dkt n GLU 65 N -0.83 -1.11 -3.18 0.00 -0.58 -1.15 -4.84 120.64 108.96 2dkt n GLU 65 Ca 0.13 0.08 -0.32 0.00 -0.42 0.00 0.00 57.16 56.63 2dkt n GLU 65 Cb 0.73 -3.24 -0.05 0.00 -0.57 0.00 0.00 31.44 28.31 2dkt n GLU 65 CO 0.00 0.00 0.00 0.21 -0.48 0.00 0.00 177.13 176.86 2dkt s LYS 66 N -4.97 3.91 0.12 3.49 2.47 -1.26 -4.80 119.74 118.71 2dkt s LYS 66 Ca 0.47 0.52 -0.14 0.00 -1.56 0.00 0.00 55.97 55.25 2dkt s LYS 66 Cb -0.27 -2.49 -0.07 0.00 -1.46 0.00 0.00 37.83 33.54 2dkt s LYS 66 CO 0.57 0.17 0.52 -1.17 0.16 0.00 0.00 175.35 175.61 2dkt s LEU 67 N -3.08 4.37 0.13 5.43 2.96 -1.26 -1.59 118.68 125.64 2dkt s LEU 67 Ca 0.52 1.05 -0.25 0.00 -0.22 0.00 0.00 54.13 55.23 2dkt s LEU 67 Cb -0.10 -3.13 0.08 0.00 0.50 0.00 0.00 46.19 43.54 2dkt s LEU 67 CO 0.21 0.15 1.08 0.00 -1.32 0.00 0.00 176.35 176.46 2dkt s GLN 68 N -1.78 1.06 0.52 1.98 0.00 -1.16 -4.92 119.66 115.37 2dkt s GLN 68 Ca 0.35 -0.65 0.07 0.00 -0.00 0.00 0.00 55.36 55.13 2dkt s GLN 68 Cb -0.16 0.32 0.04 0.00 0.00 0.00 0.00 33.01 33.22 2dkt s GLN 68 CO 0.18 -0.49 0.54 -1.01 0.00 0.00 0.00 175.29 174.51 2dkt s HIS 69 N -2.49 1.82 -0.39 9.60 3.76 -1.26 -2.47 115.29 123.85 2dkt s HIS 69 Ca 0.19 -0.71 -0.42 0.00 -0.15 0.00 0.00 55.06 53.96 2dkt s HIS 69 Cb -0.01 -2.09 -0.17 0.00 1.11 0.00 0.00 32.58 31.42 2dkt s HIS 69 CO 0.03 -0.63 1.80 0.00 -0.85 0.00 0.00 174.74 175.08 2dkt n ALA 70 N -1.89 -0.38 -3.71 -1.40 0.00 -1.03 -4.63 120.51 107.47 2dkt n ALA 70 Ca 0.06 0.35 -0.01 0.00 0.00 0.00 0.00 53.44 53.84 2dkt n ALA 70 Cb 0.63 -2.14 0.03 0.00 0.00 0.00 0.00 19.45 17.96 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 5.51 1.02 -0.06 0.00 10.64 -1.26 -5.06 117.38 128.16 2dkt n GLN 71 Ca 0.33 -2.00 -0.04 0.00 -1.83 0.00 0.00 57.00 53.47 2dkt n GLN 71 Cb 0.05 2.49 -0.13 0.00 -0.86 0.00 0.00 30.24 31.80 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 -0.48 1.21 -4.17 2.61 7.27 -1.26 -4.92 117.38 117.64 2dkt n GLN 72 Ca -0.08 -0.04 -0.16 0.00 0.07 0.00 0.00 57.00 56.79 2dkt n GLN 72 Cb 0.53 -1.40 -0.11 0.00 2.41 0.00 0.00 30.24 31.67 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 -2.58 0.99 0.78 1.69 2.01 -1.26 0.08 115.64 117.35 2dkt s THR 73 Ca -0.07 -1.53 -0.11 0.00 0.31 0.00 0.00 61.69 60.29 2dkt s THR 73 Cb 0.06 -1.25 0.06 0.00 0.01 0.00 0.00 72.50 71.38 2dkt s THR 73 CO 0.66 -0.45 1.10 0.00 -0.69 0.00 0.00 174.62 175.23 2dkt n GLU 75 N -3.51 2.86 0.00 0.00 1.02 -1.26 -3.07 120.64 116.69 2dkt n GLU 75 Ca 0.09 -2.35 0.00 0.00 -0.02 0.00 0.00 57.16 54.88 2dkt n GLU 75 Cb 0.53 -1.43 0.00 0.00 -0.02 0.00 0.00 31.44 30.52 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 0.96 2.24 -0.00 1.62 -0.08 -1.26 -4.85 116.55 115.18 2dkt n ASP 76 Ca 0.18 0.00 0.01 0.00 -1.51 0.00 0.00 54.79 53.47 2dkt n ASP 76 Cb 0.54 0.07 -0.02 0.00 2.34 0.00 0.00 41.12 44.05 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 -1.06 -3.57 -4.60 0.00 2.88 -1.17 -4.93 113.62 101.17 2dkt n SER 78 Ca 0.00 -0.75 -0.40 0.00 -1.33 0.00 0.00 58.87 56.39 2dkt n SER 78 Cb 0.04 -4.18 -0.08 0.00 -0.75 0.00 0.00 64.21 59.25 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 -3.44 5.05 -0.28 2.46 2.01 -1.26 -4.64 115.64 115.54 2dkt s THR 79 Ca 0.38 0.75 -0.32 0.00 0.31 0.00 0.00 61.69 62.80 2dkt s THR 79 Cb -0.19 -3.86 -0.09 0.00 0.01 0.00 0.00 72.50 68.38 2dkt s THR 79 CO 0.80 0.01 2.19 -0.11 -0.69 0.00 0.00 174.62 176.82 2dkt n LEU 80 N 5.60 2.65 0.00 4.42 7.94 -1.26 -2.95 117.00 133.39 2dkt n LEU 80 Ca -0.04 0.36 0.10 0.00 -1.11 0.00 0.00 56.01 55.31 2dkt n LEU 80 Cb 0.50 -1.38 0.58 0.00 0.53 0.00 0.00 43.42 43.65 2dkt n LEU 80 CO 0.41 -0.68 0.83 0.49 -1.11 0.00 0.00 177.39 177.34 2dkt n PHE 81 N 10.42 0.00 0.00 1.96 3.72 0.11 -4.56 117.46 129.12 2dkt n PHE 81 Ca 0.36 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.76 2dkt n PHE 81 Cb 0.32 0.00 0.00 0.00 -0.94 0.00 0.00 39.48 38.86 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 0.63 3.10 0.27 1.37 0.00 -1.26 -3.49 105.19 105.82 2dkt n GLY 82 Ca 0.15 -0.18 0.06 0.00 0.00 0.00 0.00 46.02 46.04 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 -0.07 -3.79 1.61 4.71 -1.19 -3.86 120.64 118.04 2dkt n GLU 83 Ca 0.00 1.18 -0.36 0.00 -0.01 0.00 0.00 57.16 57.97 2dkt n GLU 83 Cb 0.00 -1.78 -0.11 0.00 -1.01 0.00 0.00 31.44 28.54 2dkt n GLU 83 CO 0.00 0.00 0.00 0.71 0.09 0.00 0.00 177.13 177.93 2dkt s TYR 84 N -5.92 3.21 -0.17 -0.32 1.51 -0.99 -5.02 117.35 109.65 2dkt s TYR 84 Ca -0.11 -0.02 0.01 0.00 -1.01 0.00 0.00 57.07 55.93 2dkt s TYR 84 Cb 0.21 -2.21 0.03 0.00 -0.11 0.00 0.00 41.96 39.87 2dkt s TYR 84 CO 0.59 -0.06 -0.15 1.52 -1.11 0.00 0.00 175.55 176.34 2dkt s TYR 85 N 1.10 2.48 0.07 2.71 1.13 -1.25 -2.31 117.35 121.28 2dkt s TYR 85 Ca 0.06 -1.50 -0.12 0.00 -1.41 0.00 0.00 57.07 54.09 2dkt s TYR 85 Cb -0.14 -1.73 -0.06 0.00 -1.10 0.00 0.00 41.96 38.93 2dkt s TYR 85 CO 0.04 -0.74 0.44 0.00 -2.51 0.00 0.00 175.55 172.77 2dkt n SER 87 N 1.17 1.00 0.10 0.00 7.64 -1.26 -2.56 113.62 119.70 2dkt n SER 87 Ca -0.09 0.06 -0.11 0.00 1.01 0.00 0.00 58.87 59.74 2dkt n SER 87 Cb 0.52 0.17 -0.07 0.00 -1.01 0.00 0.00 64.21 63.81 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 0.71 0.00 0.44 2.04 -1.95 -3.29 117.51 115.47 2dkt h ILE 88 Ca -0.49 -0.93 0.00 0.00 1.00 0.00 0.00 64.86 64.44 2dkt h ILE 88 Cb 2.08 1.15 0.00 0.00 -0.74 0.00 0.00 36.82 39.31 2dkt h ILE 88 CO 0.01 0.17 -0.43 0.00 0.00 0.00 0.00 178.15 177.90 2dkt n HIS 90 N -2.03 -2.44 -4.28 0.00 8.25 -1.06 -4.58 115.22 109.07 2dkt n HIS 90 Ca 0.04 0.94 -0.26 0.00 -0.26 0.00 0.00 57.72 58.18 2dkt n HIS 90 Cb 0.42 -4.54 -0.09 0.00 1.12 0.00 0.00 29.99 26.90 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 -7.11 3.05 -0.05 2.41 0.20 -1.22 -4.91 118.68 111.05 2dkt s LEU 91 Ca 0.47 -0.57 0.00 0.00 0.69 0.00 0.00 54.13 54.72 2dkt s LEU 91 Cb -0.22 -1.70 0.02 0.00 -0.43 0.00 0.00 46.19 43.86 2dkt s LEU 91 CO 0.78 0.08 -0.02 -0.36 -0.29 0.00 0.00 176.35 176.54 2dkt s PHE 92 N -1.82 0.65 0.01 5.38 0.08 -1.26 -0.91 117.98 120.11 2dkt s PHE 92 Ca 0.26 -0.16 0.03 0.00 0.12 0.00 0.00 56.93 57.18 2dkt s PHE 92 Cb -0.08 -0.67 -0.01 0.00 -0.57 0.00 0.00 43.02 41.69 2dkt s PHE 92 CO 0.16 -0.23 -0.09 0.16 -0.10 0.00 0.00 175.22 175.13 2dkt s ASP 93 N 1.27 1.06 1.34 1.36 -4.77 -0.98 -4.11 116.67 111.86 2dkt s ASP 93 Ca -0.06 -0.28 -0.21 0.00 -3.30 0.00 0.00 52.55 48.70 2dkt s ASP 93 Cb -0.14 -0.08 0.32 0.00 -1.09 0.00 0.00 42.92 41.94 2dkt s ASP 93 CO -0.02 0.03 0.73 0.29 0.70 0.00 0.00 175.17 176.90 2dkt n LYS 94 N 2.42 -3.93 -1.63 2.11 4.76 -1.09 -2.36 118.16 118.43 2dkt n LYS 94 Ca -0.16 -1.23 -0.25 0.00 -2.87 0.00 0.00 58.31 53.80 2dkt n LYS 94 Cb 0.56 -1.74 -0.09 0.00 -1.84 0.00 0.00 35.03 31.92 2dkt n LYS 94 CO 0.00 0.00 0.00 -0.40 -1.37 0.00 0.00 177.40 175.63 2dkt n ASP 95 N -4.60 2.10 -0.89 4.39 5.75 -1.26 -4.55 116.55 117.48 2dkt n ASP 95 Ca 0.12 -2.59 -0.00 0.00 -0.01 0.00 0.00 54.79 52.30 2dkt n ASP 95 Cb 0.51 -1.57 0.17 0.00 -1.03 0.00 0.00 41.12 39.20 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 8.08 1.98 -4.19 0.11 5.02 -1.26 -4.97 118.16 122.92 2dkt n LYS 96 Ca 0.44 -3.47 -0.33 0.00 -2.02 0.00 0.00 58.31 52.94 2dkt n LYS 96 Cb 0.46 -1.75 -0.06 0.00 -0.02 0.00 0.00 35.03 33.65 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 -1.04 -1.27 -3.14 1.97 0.00 -1.26 -4.74 116.66 107.17 2dkt n ARG 97 Ca 0.24 0.16 -0.39 0.00 -0.00 0.00 0.00 57.85 57.86 2dkt n ARG 97 Cb 0.76 -3.60 -0.05 0.00 0.00 0.00 0.00 32.46 29.56 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 -7.20 4.37 -0.05 -0.14 0.74 -1.26 -3.64 119.66 112.47 2dkt s GLN 98 Ca 0.09 0.83 0.06 0.00 0.05 0.00 0.00 55.36 56.39 2dkt s GLN 98 Cb -0.05 -3.34 -0.01 0.00 1.10 0.00 0.00 33.01 30.71 2dkt s GLN 98 CO 0.97 0.36 -0.23 1.52 -0.55 0.00 0.00 175.29 177.36 2dkt s TYR 99 N -0.20 2.24 -0.15 1.67 -0.85 -0.58 -4.95 117.35 114.54 2dkt s TYR 99 Ca 0.33 -0.64 -0.14 0.00 -0.52 0.00 0.00 57.07 56.10 2dkt s TYR 99 Cb -0.19 -1.47 -0.05 0.00 0.38 0.00 0.00 41.96 40.63 2dkt s TYR 99 CO 0.19 -0.19 0.32 -1.58 -1.52 0.00 0.00 175.55 172.77 2dkt s HIS 100 N -0.16 3.47 0.06 -3.49 5.65 -1.26 -1.43 115.29 118.13 2dkt s HIS 100 Ca -0.02 0.64 -0.20 0.00 0.25 0.00 0.00 55.06 55.72 2dkt s HIS 100 Cb -0.13 -2.36 -0.06 0.00 -1.18 0.00 0.00 32.58 28.85 2dkt s HIS 100 CO 0.03 0.25 0.60 0.00 -0.65 0.00 0.00 174.74 174.97 2dkt h GLU 102 N 4.92 0.32 -0.48 0.00 5.08 -1.95 0.31 114.58 122.79 2dkt h GLU 102 Ca -0.48 -0.55 0.05 0.00 -1.00 0.00 0.00 59.36 57.38 2dkt h GLU 102 Cb 1.21 0.21 -0.03 0.00 0.50 0.00 0.00 28.75 30.64 2dkt h GLU 102 CO 0.66 1.27 0.32 0.77 -1.00 0.00 0.00 179.01 181.02 2dkt h SER 103 N 0.01 0.40 0.00 1.42 0.02 -1.97 -2.70 113.55 110.73 2dkt h SER 103 Ca -0.37 -0.00 -0.28 0.00 -0.84 0.00 0.00 61.79 60.30 2dkt h SER 103 Cb 2.01 -0.09 -0.05 0.00 0.14 0.00 0.00 62.40 64.41 2dkt h SER 103 CO 0.12 0.27 -2.26 0.00 -1.14 0.00 0.00 176.83 173.83 2dkt n GLY 105 N 1.69 0.55 3.20 0.00 0.00 0.08 -5.03 105.19 105.68 2dkt n GLY 105 Ca -0.26 -0.74 -0.15 0.00 0.00 0.00 0.00 46.02 44.87 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 -2.24 1.04 0.28 -0.61 -4.36 -1.08 -4.72 121.20 109.52 2dkt s ILE 106 Ca 0.00 -1.78 -0.21 0.00 -0.26 0.00 0.00 60.65 58.40 2dkt s ILE 106 Cb 0.00 -1.53 -0.09 0.00 1.25 0.00 0.00 42.46 42.09 2dkt s ILE 106 CO 0.00 -0.60 0.81 0.00 0.24 0.00 0.00 174.94 175.39 2dkt s ARG 108 N -2.21 0.56 -0.29 0.00 0.52 -0.51 -4.92 118.95 112.10 2dkt s ARG 108 Ca 0.48 0.22 -0.27 0.00 -0.52 0.00 0.00 55.73 55.64 2dkt s ARG 108 Cb -0.16 0.26 0.01 0.00 0.52 0.00 0.00 34.95 35.58 2dkt s ARG 108 CO 0.21 -0.12 0.98 0.42 0.02 0.00 0.00 175.30 176.81 2dkt s ILE 109 N -0.47 4.65 0.00 1.52 -1.09 -1.26 -1.52 121.20 123.02 2dkt s ILE 109 Ca -0.06 1.66 0.00 0.00 -2.23 0.00 0.00 60.65 60.02 2dkt s ILE 109 Cb -0.04 -4.30 0.00 0.00 -1.58 0.00 0.00 42.46 36.54 2dkt s ILE 109 CO 0.02 -0.32 0.00 0.61 -1.23 0.00 0.00 174.94 174.03 2dkt n GLY 110 N 3.81 0.78 3.72 6.18 0.00 -1.24 -4.89 105.19 113.54 2dkt n GLY 110 Ca 0.09 -0.01 -0.42 0.00 0.00 0.00 0.00 46.02 45.69 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 0.00 4.35 0.25 1.61 0.04 -1.26 -4.98 135.00 135.01 2dkt s PRO 111 Ca 0.00 2.04 0.09 0.00 0.04 0.00 0.00 61.00 63.17 2dkt s PRO 111 Cb 0.00 -3.24 0.80 0.00 0.04 0.00 0.00 34.50 32.10 2dkt s PRO 111 CO 0.00 -0.37 1.13 1.17 0.04 0.00 0.00 177.00 178.98 2dkt n LYS 112 N 3.56 -0.05 -0.29 4.56 3.00 -1.26 0.48 118.16 128.16 2dkt n LYS 112 Ca 0.10 1.03 -0.06 0.00 -0.00 0.00 0.00 58.31 59.37 2dkt n LYS 112 Cb 0.43 -1.76 -0.02 0.00 0.00 0.00 0.00 35.03 33.69 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 -0.11 -1.30 1.64 5.08 -1.99 0.69 114.58 118.60 2dkt h GLU 113 Ca 0.54 0.01 -0.27 0.00 -1.00 0.00 0.00 59.36 58.64 2dkt h GLU 113 Cb 1.32 0.03 -0.13 0.00 0.50 0.00 0.00 28.75 30.46 2dkt h GLU 113 CO -0.60 -0.07 0.34 -0.25 -1.00 0.00 0.00 179.01 177.42 2dkt n ASP 114 N -5.41 4.97 -3.92 1.42 8.00 0.18 -4.86 116.55 116.93 2dkt n ASP 114 Ca 0.05 -2.87 -0.09 0.00 0.71 0.00 0.00 54.79 52.59 2dkt n ASP 114 Cb 0.35 -0.87 -0.04 0.00 -0.02 0.00 0.00 41.12 40.54 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 -1.58 0.13 0.34 1.24 0.40 0.24 -3.32 117.98 115.44 2dkt s PHE 115 Ca 0.27 -0.52 -0.15 0.00 -0.60 0.00 0.00 56.93 55.93 2dkt s PHE 115 Cb 0.22 0.36 0.03 0.00 0.51 0.00 0.00 43.02 44.15 2dkt s PHE 115 CO 0.02 -1.05 0.70 -0.59 0.70 0.00 0.00 175.22 175.01 2dkt s PHE 116 N -3.97 0.20 -0.09 0.36 -0.12 0.20 -4.73 117.98 109.83 2dkt s PHE 116 Ca 0.17 -0.74 -0.01 0.00 -0.05 0.00 0.00 56.93 56.30 2dkt s PHE 116 Cb -0.02 0.63 0.03 0.00 -0.63 0.00 0.00 43.02 43.02 2dkt s PHE 116 CO 0.06 -1.39 -0.04 -1.58 -0.05 0.00 0.00 175.22 172.23 2dkt s HIS 117 N -2.92 1.05 0.14 3.49 5.65 -1.26 -0.22 115.29 121.21 2dkt s HIS 117 Ca 0.17 -0.43 -0.22 0.00 0.25 0.00 0.00 55.06 54.83 2dkt s HIS 117 Cb -0.04 -1.00 -0.07 0.00 -1.18 0.00 0.00 32.58 30.29 2dkt s HIS 117 CO 0.11 -0.41 0.67 0.00 -0.65 0.00 0.00 174.74 174.47 2dkt h LEU 119 N 4.25 -0.14 -0.70 0.00 3.38 -1.97 -2.55 115.31 117.58 2dkt h LEU 119 Ca -0.48 0.00 0.10 0.00 0.09 0.00 0.00 57.88 57.59 2dkt h LEU 119 Cb 1.21 0.04 -0.12 0.00 0.09 0.00 0.00 40.66 41.88 2dkt h LEU 119 CO 0.65 0.29 -0.44 0.50 0.09 0.00 0.00 178.44 179.53 2dkt h LYS 120 N -0.94 -0.15 0.00 1.13 3.11 -1.96 0.86 116.57 118.61 2dkt h LYS 120 Ca -0.02 0.01 -0.02 0.00 -2.81 0.00 0.00 60.65 57.82 2dkt h LYS 120 Cb 0.12 0.04 -0.00 0.00 -1.00 0.00 0.00 32.23 31.39 2dkt h LYS 120 CO 0.03 -0.10 -0.08 0.00 -2.81 0.00 0.00 179.45 176.48 2dkt n ASN 122 N -3.82 -5.59 -3.32 0.00 3.02 0.30 -4.99 115.26 100.85 2dkt n ASN 122 Ca -0.02 -0.47 -0.09 0.00 -0.03 0.00 0.00 54.58 53.96 2dkt n ASN 122 Cb 0.18 -4.46 -0.00 0.00 -0.61 0.00 0.00 39.78 34.89 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 -6.46 0.03 0.17 3.41 0.05 -1.09 -4.87 118.68 109.91 2dkt s LEU 123 Ca 0.48 -0.99 -0.09 0.00 0.05 0.00 0.00 54.13 53.58 2dkt s LEU 123 Cb -0.21 2.62 -0.06 0.00 -2.05 0.00 0.00 46.19 46.48 2dkt s LEU 123 CO 0.64 -1.51 0.47 0.00 -0.55 0.00 0.00 176.35 175.40 2dkt s LEU 125 N -2.47 0.75 0.48 0.00 1.43 0.69 -4.90 118.68 114.66 2dkt s LEU 125 Ca 0.41 0.34 -0.21 0.00 -1.03 0.00 0.00 54.13 53.64 2dkt s LEU 125 Cb -0.12 1.26 -0.08 0.00 0.03 0.00 0.00 46.19 47.28 2dkt s LEU 125 CO 0.21 -0.32 1.06 0.28 0.23 0.00 0.00 176.35 177.81 2dkt s THR 126 N -0.74 3.65 0.58 5.49 -1.32 -1.26 -0.63 115.64 121.41 2dkt s THR 126 Ca -0.08 1.08 0.30 0.00 -1.21 0.00 0.00 61.69 61.78 2dkt s THR 126 Cb -0.04 -3.46 0.43 0.00 -1.51 0.00 0.00 72.50 67.91 2dkt s THR 126 CO 0.03 -0.17 1.79 0.71 -2.21 0.00 0.00 174.62 174.77 2dkt h THR 127 N 1.63 0.34 -0.86 5.08 1.35 -1.84 0.24 112.91 118.85 2dkt h THR 127 Ca -0.49 0.00 0.06 0.00 -0.55 0.00 0.00 66.41 65.43 2dkt h THR 127 Cb 1.23 0.48 -0.05 0.00 -1.73 0.00 0.00 68.15 68.07 2dkt h THR 127 CO 0.59 0.00 0.56 -1.13 -0.25 0.00 0.00 175.52 175.30 2dkt h ASN 128 N 0.00 0.86 -0.77 5.36 -1.24 -1.90 -1.08 115.58 116.81 2dkt h ASN 128 Ca 0.34 0.00 -0.46 0.00 0.71 0.00 0.00 56.30 56.90 2dkt h ASN 128 Cb 1.69 -0.18 -0.23 0.00 0.73 0.00 0.00 38.32 40.33 2dkt h ASN 128 CO -0.00 0.56 0.59 0.18 -1.29 0.00 0.00 177.43 177.46 2dkt n LEU 129 N -4.48 6.48 -2.00 0.34 4.77 0.83 -4.70 117.00 118.24 2dkt n LEU 129 Ca 0.13 -3.46 -0.09 0.00 -0.03 0.00 0.00 56.01 52.56 2dkt n LEU 129 Cb 0.19 -0.88 -0.12 0.00 -2.33 0.00 0.00 43.42 40.28 2dkt n LEU 129 CO 0.33 1.13 1.37 -1.14 -1.33 0.00 0.00 177.39 177.74 2dkt n ARG 130 N -0.59 1.58 0.00 3.23 3.00 -0.41 -3.89 116.66 119.58 2dkt n ARG 130 Ca 0.47 -0.73 0.00 0.00 -0.00 0.00 0.00 57.85 57.59 2dkt n ARG 130 Cb 1.06 -1.81 0.00 0.00 0.00 0.00 0.00 32.46 31.71 2dkt n ARG 130 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.63 178.04 2dkt n GLY 131 N 2.43 2.65 0.38 5.14 0.00 -1.26 -4.97 105.19 109.55 2dkt n GLY 131 Ca 0.31 -0.32 0.14 0.00 0.00 0.00 0.00 46.02 46.15 2dkt n GLY 131 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2dkt h LYS 132 N 0.00 0.58 -7.14 1.61 1.57 -1.84 -3.42 116.57 107.93 2dkt h LYS 132 Ca 0.00 -0.04 -0.52 0.00 -1.87 0.00 0.00 60.65 58.22 2dkt h LYS 132 Cb 0.00 -0.13 0.11 0.00 0.08 0.00 0.00 32.23 32.29 2dkt h LYS 132 CO 0.00 0.39 0.42 -3.38 -0.57 0.00 0.00 179.45 176.31 2dkt s HIS 133 N -5.60 2.41 -0.20 -1.35 -3.43 -1.25 -5.03 115.29 100.84 2dkt s HIS 133 Ca -0.09 1.55 0.00 0.00 -0.80 0.00 0.00 55.06 55.72 2dkt s HIS 133 Cb 0.22 -3.37 0.02 0.00 -1.43 0.00 0.00 32.58 28.02 2dkt s HIS 133 CO 0.78 -2.07 -0.16 -1.59 -2.00 0.00 0.00 174.74 169.70 2dkt s LYS 134 N -3.66 2.96 0.05 -0.38 -2.85 -1.26 -5.01 119.74 109.60 2dkt s LYS 134 Ca 0.73 -0.86 -0.21 0.00 -1.00 0.00 0.00 55.97 54.63 2dkt s LYS 134 Cb -0.26 -2.69 -0.12 0.00 -2.06 0.00 0.00 37.83 32.69 2dkt s LYS 134 CO 0.37 -0.26 1.46 0.00 0.10 0.00 0.00 175.35 177.02 2dkt s ILE 136 N -4.82 4.37 0.27 0.00 2.07 -1.26 -4.77 121.20 117.05 2dkt s ILE 136 Ca -0.14 1.61 0.08 0.00 -1.41 0.00 0.00 60.65 60.78 2dkt s ILE 136 Cb 0.06 -3.98 -0.04 0.00 0.13 0.00 0.00 42.46 38.63 2dkt s ILE 136 CO 0.72 0.24 0.17 -1.83 -1.91 0.00 0.00 174.94 172.33 2dkt s GLU 137 N -1.85 2.75 0.36 3.50 -1.05 -1.26 -5.14 118.70 116.01 2dkt s GLU 137 Ca 0.45 -1.18 0.08 0.00 -0.15 0.00 0.00 54.97 54.17 2dkt s GLU 137 Cb -0.19 -2.46 -0.04 0.00 -0.44 0.00 0.00 34.13 31.01 2dkt s GLU 137 CO 0.23 0.34 0.19 0.45 0.95 0.00 0.00 175.26 177.42 2dkt s SER 138 N -3.83 4.72 -0.47 0.83 0.15 -1.26 -5.09 113.70 108.75 2dkt s SER 138 Ca 0.34 -0.80 -0.20 0.00 0.70 0.00 0.00 55.95 55.98 2dkt s SER 138 Cb -0.07 -0.68 0.04 0.00 -1.71 0.00 0.00 66.02 63.59 2dkt s SER 138 CO 0.24 -0.38 0.65 -0.83 1.20 0.00 0.00 173.24 174.12 2dkt s GLY 139 N -3.90 1.72 0.19 9.45 0.00 -1.26 -5.05 107.32 108.47 2dkt s GLY 139 Ca 0.40 -1.40 -0.03 0.00 0.00 0.00 0.00 44.72 43.68 2dkt s GLY 139 CO 0.23 1.53 0.17 -1.55 0.00 0.00 0.00 173.10 173.49 2dkt n PRO 140 N 6.30 -1.36 -3.97 2.90 -0.04 -1.26 -5.09 135.00 132.48 2dkt n PRO 140 Ca -0.03 -0.28 -0.26 0.00 -0.04 0.00 0.00 63.50 62.89 2dkt n PRO 140 Cb 0.47 -0.26 -0.03 0.00 -0.04 0.00 0.00 33.50 33.64 2dkt n PRO 140 CO 0.00 0.00 0.00 -1.54 -0.04 0.00 0.00 175.50 173.92 2dkt s SER 141 N -1.98 4.60 -0.18 3.54 1.04 -1.26 -5.09 113.70 114.37 2dkt s SER 141 Ca 0.11 -1.19 -0.29 0.00 0.48 0.00 0.00 55.95 55.06 2dkt s SER 141 Cb -0.01 0.14 -0.00 0.00 0.10 0.00 0.00 66.02 66.25 2dkt s SER 141 CO 0.09 -0.93 1.06 -0.55 0.98 0.00 0.00 173.24 173.89 2dkt s SER 142 N -4.16 7.13 0.00 7.02 0.15 -1.26 -5.33 113.70 117.25 2dkt s SER 142 Ca 0.34 1.47 0.00 0.00 0.70 0.00 0.00 55.95 58.46 2dkt s SER 142 Cb -0.01 -2.55 0.00 0.00 -1.71 0.00 0.00 66.02 61.76 2dkt s SER 142 CO 0.21 -0.61 0.00 0.61 1.20 0.00 0.00 173.24 174.64