#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 -0.82 0.07 1.61 0.15 -1.26 -5.18 113.70 108.28 2dkt s SER 2 Ca 0.00 1.44 -0.20 0.00 0.70 0.00 0.00 55.95 57.90 2dkt s SER 2 Cb 0.00 1.41 0.04 0.00 -1.71 0.00 0.00 66.02 65.76 2dkt s SER 2 CO 0.00 -0.24 0.46 -0.44 1.20 0.00 0.00 173.24 174.23 2dkt s SER 3 N 0.96 -0.35 0.00 5.45 0.01 -1.26 -5.16 113.70 113.34 2dkt s SER 3 Ca -0.05 -0.01 0.00 0.00 1.31 0.00 0.00 55.95 57.20 2dkt s SER 3 Cb -0.05 0.48 0.00 0.00 0.21 0.00 0.00 66.02 66.66 2dkt s SER 3 CO -0.09 -0.75 0.00 0.61 0.41 0.00 0.00 173.24 173.42 2dkt n GLY 4 N 0.22 1.05 3.71 3.44 0.00 -1.26 -5.18 105.19 107.18 2dkt n GLY 4 Ca -0.18 0.55 -0.25 0.00 0.00 0.00 0.00 46.02 46.15 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 0.00 4.96 -0.23 1.61 0.15 -1.26 -5.13 113.70 113.80 2dkt s SER 5 Ca 0.00 -0.40 -0.11 0.00 0.70 0.00 0.00 55.95 56.14 2dkt s SER 5 Cb 0.00 -1.10 0.08 0.00 -1.71 0.00 0.00 66.02 63.29 2dkt s SER 5 CO 0.00 0.04 0.53 -0.44 1.20 0.00 0.00 173.24 174.56 2dkt s SER 6 N -3.36 -0.67 0.00 5.45 0.01 -1.26 -5.15 113.70 108.72 2dkt s SER 6 Ca 0.30 1.20 0.00 0.00 1.31 0.00 0.00 55.95 58.76 2dkt s SER 6 Cb -0.08 1.33 0.00 0.00 0.21 0.00 0.00 66.02 67.48 2dkt s SER 6 CO 0.21 -0.22 0.00 0.61 0.41 0.00 0.00 173.24 174.25 2dkt n GLY 7 N 4.75 1.87 0.00 3.44 0.00 -1.26 -5.18 105.19 108.81 2dkt n GLY 7 Ca -0.17 0.14 0.00 0.00 0.00 0.00 0.00 46.02 45.99 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 -0.15 1.51 3.90 -0.02 0.00 -1.26 -5.17 105.19 104.00 2dkt n GLY 8 Ca 0.00 -0.01 -0.29 0.00 0.00 0.00 0.00 46.02 45.72 2dkt n GLY 8 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 2dkt s VAL 9 N -1.18 2.96 0.03 1.61 -7.23 -1.26 -5.04 120.40 110.30 2dkt s VAL 9 Ca 0.00 0.20 0.00 0.00 -1.81 0.00 0.00 61.98 60.37 2dkt s VAL 9 Cb 0.00 -3.29 0.00 0.00 0.56 0.00 0.00 36.38 33.65 2dkt s VAL 9 CO 0.00 -0.36 0.00 0.54 -0.31 0.00 0.00 175.10 174.97 2dkt n ARG 10 N -3.03 0.00 -3.82 4.82 5.12 -1.26 -5.10 116.66 113.39 2dkt n ARG 10 Ca 0.07 0.00 -0.12 0.00 -1.93 0.00 0.00 57.85 55.87 2dkt n ARG 10 Cb 0.59 -0.42 -0.12 0.00 -1.16 0.00 0.00 32.46 31.35 2dkt n ARG 10 CO 0.00 0.00 0.00 -0.80 -1.93 0.00 0.00 177.63 174.90 2dkt s ASN 11 N -5.22 -0.16 1.02 0.55 0.01 -1.26 -5.15 114.94 104.73 2dkt s ASN 11 Ca 0.00 0.27 -0.14 0.00 -0.71 0.00 0.00 52.86 52.28 2dkt s ASN 11 Cb 0.00 0.36 0.11 0.00 0.41 0.00 0.00 41.25 42.13 2dkt s ASN 11 CO 0.00 -0.14 0.49 0.18 -1.51 0.00 0.00 177.10 176.12 2dkt n LEU 12 N 2.62 -0.41 -3.70 0.60 4.32 -1.26 -5.04 117.00 114.13 2dkt n LEU 12 Ca -0.15 0.15 -0.11 0.00 -0.02 0.00 0.00 56.01 55.88 2dkt n LEU 12 Cb 0.58 -1.19 -0.10 0.00 -1.62 0.00 0.00 43.42 41.09 2dkt n LEU 12 CO 0.20 -3.21 0.10 0.00 -1.22 0.00 0.00 177.39 173.27 2dkt s ALA 13 N -2.39 -1.15 -0.19 -1.18 0.00 -1.26 -5.03 121.76 110.56 2dkt s ALA 13 Ca 0.60 1.55 0.00 0.00 0.00 0.00 0.00 51.96 54.11 2dkt s ALA 13 Cb -0.19 -0.92 0.19 0.00 0.00 0.00 0.00 23.12 22.19 2dkt s ALA 13 CO 0.65 -0.26 1.69 1.04 0.00 0.00 0.00 175.76 178.88 2dkt n GLN 14 N 3.87 1.50 0.00 0.00 6.02 -1.26 -4.94 117.38 122.58 2dkt n GLN 14 Ca -0.20 -1.07 0.00 0.00 -0.01 0.00 0.00 57.00 55.72 2dkt n GLN 14 Cb 0.56 -1.42 0.00 0.00 1.02 0.00 0.00 30.24 30.40 2dkt n GLN 14 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 2dkt n GLY 15 N 0.34 2.46 3.77 1.08 0.00 -1.26 -4.47 105.19 107.11 2dkt n GLY 15 Ca 0.21 -1.89 -0.34 0.00 0.00 0.00 0.00 46.02 44.00 2dkt n GLY 15 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2dkt s PRO 16 N -3.16 3.00 -0.31 1.61 0.04 -1.26 -4.96 135.00 129.96 2dkt s PRO 16 Ca 0.00 1.47 0.16 0.00 0.04 0.00 0.00 61.00 62.67 2dkt s PRO 16 Cb 0.00 -1.97 0.47 0.00 0.04 0.00 0.00 34.50 33.04 2dkt s PRO 16 CO 0.00 -1.10 1.06 2.89 0.04 0.00 0.00 177.00 179.89 2dkt n ARG 17 N -2.01 2.04 0.00 4.56 0.00 -1.26 -4.69 116.66 115.30 2dkt n ARG 17 Ca 0.11 -3.66 0.00 0.00 -0.00 0.00 0.00 57.85 54.30 2dkt n ARG 17 Cb 0.52 -1.67 0.00 0.00 -0.00 0.00 0.00 32.46 31.31 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 -0.41 1.40 4.00 2.89 0.00 0.19 -4.02 105.19 109.25 2dkt n GLY 18 Ca 0.18 -1.22 -0.22 0.00 0.00 0.00 0.00 46.02 44.76 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 -0.18 0.00 -0.03 0.00 4.11 -2.04 0.70 114.58 117.15 2dkt h GLU 20 Ca -0.36 0.00 -0.02 0.00 0.07 0.00 0.00 59.36 59.04 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 0.43 0.00 -0.08 0.45 0.07 0.00 0.00 179.01 179.89 2dkt h HIS 21 N 0.00 0.13 -2.85 2.06 3.86 -2.03 -3.47 115.15 112.85 2dkt h HIS 21 Ca 0.06 -0.05 -0.05 0.00 -1.16 0.00 0.00 60.37 59.17 2dkt h HIS 21 Cb 1.06 -0.02 -0.15 0.00 1.06 0.00 0.00 27.41 29.36 2dkt h HIS 21 CO 0.00 0.68 0.07 0.71 0.86 0.00 0.00 177.93 180.25 2dkt s TYR 22 N -3.82 -0.44 -0.74 2.45 2.02 0.24 -5.11 117.35 111.95 2dkt s TYR 22 Ca -0.16 0.41 -0.15 0.00 -0.37 0.00 0.00 57.07 56.79 2dkt s TYR 22 Cb 0.02 0.38 0.18 0.00 -0.40 0.00 0.00 41.96 42.14 2dkt s TYR 22 CO 0.70 -0.70 0.72 -0.51 -1.57 0.00 0.00 175.55 174.20 2dkt s ASP 23 N -2.20 6.56 0.06 2.29 1.11 -1.26 -0.81 116.67 122.40 2dkt s ASP 23 Ca -0.03 -2.31 0.03 0.00 0.18 0.00 0.00 52.55 50.42 2dkt s ASP 23 Cb -0.00 -2.23 -0.03 0.00 1.07 0.00 0.00 42.92 41.73 2dkt s ASP 23 CO -0.05 -0.72 -0.09 0.00 1.18 0.00 0.00 175.17 175.48 2dkt s ARG 24 N 0.91 0.63 -0.39 8.23 1.70 -1.26 -3.47 118.95 125.31 2dkt s ARG 24 Ca 0.14 -0.86 0.06 0.00 -0.47 0.00 0.00 55.73 54.60 2dkt s ARG 24 Cb -0.16 -0.42 0.49 0.00 -0.57 0.00 0.00 34.95 34.29 2dkt s ARG 24 CO -0.05 0.08 1.55 0.00 -1.08 0.00 0.00 175.30 175.80 2dkt n ALA 25 N 1.27 5.05 -3.65 7.88 0.00 -1.23 0.57 120.51 130.40 2dkt n ALA 25 Ca -0.21 -3.38 -0.06 0.00 0.00 0.00 0.00 53.44 49.79 2dkt n ALA 25 Cb 0.55 -0.90 -0.07 0.00 0.00 0.00 0.00 19.45 19.03 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 2.04 4.57 -0.32 0.00 1.02 0.56 -4.81 118.68 121.74 2dkt s LEU 27 Ca -0.08 1.58 -0.20 0.00 0.02 0.00 0.00 54.13 55.44 2dkt s LEU 27 Cb -0.08 -3.23 -0.01 0.00 0.02 0.00 0.00 46.19 42.89 2dkt s LEU 27 CO -0.18 0.20 0.64 -1.48 0.02 0.00 0.00 176.35 175.55 2dkt s LEU 28 N -1.05 4.17 0.50 1.79 0.05 -1.24 -0.39 118.68 122.51 2dkt s LEU 28 Ca 0.35 0.36 -0.22 0.00 0.05 0.00 0.00 54.13 54.67 2dkt s LEU 28 Cb -0.22 -2.82 -0.07 0.00 -2.05 0.00 0.00 46.19 41.02 2dkt s LEU 28 CO 0.25 -0.52 1.13 1.17 -0.55 0.00 0.00 176.35 177.83 2dkt n LYS 29 N 5.94 1.43 -3.55 1.48 3.00 -1.25 -4.03 118.16 121.18 2dkt n LYS 29 Ca -0.01 0.52 -0.41 0.00 -0.00 0.00 0.00 58.31 58.41 2dkt n LYS 29 Cb 0.49 -2.27 -0.09 0.00 0.00 0.00 0.00 35.03 33.15 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 -1.33 3.36 -2.00 3.14 0.00 0.27 -4.88 121.76 120.31 2dkt s ALA 30 Ca 0.68 -2.09 0.09 0.00 0.00 0.00 0.00 51.96 50.64 2dkt s ALA 30 Cb -0.47 -2.75 0.56 0.00 0.00 0.00 0.00 23.12 20.45 2dkt s ALA 30 CO 0.53 -1.64 1.00 -0.35 0.00 0.00 0.00 175.76 175.30 2dkt n PRO 31 N 5.00 0.49 -0.11 0.00 -0.04 -1.26 0.22 135.00 139.29 2dkt n PRO 31 Ca -0.11 0.00 -0.20 0.00 -0.04 0.00 0.00 63.50 63.15 2dkt n PRO 31 Cb 0.43 -1.30 -0.12 0.00 -0.04 0.00 0.00 33.50 32.48 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 -0.22 -5.34 -4.94 0.00 2.03 0.59 -4.97 116.55 103.71 2dkt n ASP 34 Ca 0.00 0.10 -0.20 0.00 0.52 0.00 0.00 54.79 55.22 2dkt n ASP 34 Cb 0.25 -4.51 -0.01 0.00 -0.72 0.00 0.00 41.12 36.13 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 -4.81 2.62 -0.07 -0.67 1.02 -1.18 -4.76 119.74 111.89 2dkt s LYS 35 Ca 0.00 -1.45 0.02 0.00 0.02 0.00 0.00 55.97 54.56 2dkt s LYS 35 Cb 0.00 -2.52 0.01 0.00 -0.52 0.00 0.00 37.83 34.80 2dkt s LYS 35 CO 0.00 -0.27 -0.12 -0.51 -0.92 0.00 0.00 175.35 173.53 2dkt s LEU 36 N -4.25 1.60 0.00 3.17 1.43 -1.26 0.95 118.68 120.33 2dkt s LEU 36 Ca 0.51 -0.29 0.01 0.00 -1.03 0.00 0.00 54.13 53.33 2dkt s LEU 36 Cb -0.06 -0.81 -0.01 0.00 0.03 0.00 0.00 46.19 45.34 2dkt s LEU 36 CO 0.30 0.02 -0.04 -0.31 0.23 0.00 0.00 176.35 176.55 2dkt s TYR 37 N 0.75 0.37 0.12 0.29 1.51 -1.26 -5.01 117.35 114.12 2dkt s TYR 37 Ca -0.13 -0.14 -0.13 0.00 -1.01 0.00 0.00 57.07 55.65 2dkt s TYR 37 Cb -0.16 -0.24 0.08 0.00 -0.11 0.00 0.00 41.96 41.54 2dkt s TYR 37 CO 0.03 -0.03 0.92 2.41 -1.11 0.00 0.00 175.55 177.77 2dkt n THR 38 N 2.72 -0.34 -4.38 -0.71 -1.04 -1.26 -3.64 114.28 105.61 2dkt n THR 38 Ca -0.15 1.41 -0.23 0.00 -2.04 0.00 0.00 64.05 63.05 2dkt n THR 38 Cb 0.58 -1.81 -0.08 0.00 -1.82 0.00 0.00 70.33 67.20 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 0.41 0.30 0.00 -0.00 -1.94 -3.17 114.38 109.98 2dkt h ARG 40 Ca -0.28 -0.11 -0.01 0.00 -0.00 0.00 0.00 59.98 59.58 2dkt h ARG 40 Cb 1.23 -0.05 0.00 0.00 -0.00 0.00 0.00 29.97 31.16 2dkt h ARG 40 CO 0.42 0.54 -0.15 -0.07 -0.00 0.00 0.00 179.97 180.71 2dkt h LEU 41 N 0.38 -0.34 -1.24 0.08 4.07 -1.95 -3.09 115.31 113.21 2dkt h LEU 41 Ca 0.07 0.01 0.41 0.00 0.08 0.00 0.00 57.88 58.45 2dkt h LEU 41 Cb 0.46 0.09 -0.10 0.00 1.08 0.00 0.00 40.66 42.19 2dkt h LEU 41 CO 0.03 -0.17 0.83 0.00 -1.08 0.00 0.00 178.44 178.04 2dkt h HIS 43 N 0.00 -0.54 -0.03 0.00 -0.00 -1.51 -0.26 115.15 112.81 2dkt h HIS 43 Ca 0.74 -0.01 0.01 0.00 -0.00 0.00 0.00 60.37 61.10 2dkt h HIS 43 Cb 2.51 0.18 -0.00 0.00 -0.00 0.00 0.00 27.41 30.09 2dkt h HIS 43 CO -0.00 -0.33 0.02 -0.44 -0.00 0.00 0.00 177.93 177.18 2dkt h ASP 44 N -0.64 0.00 0.12 3.26 3.32 -0.50 0.24 116.42 122.21 2dkt h ASP 44 Ca -0.06 0.00 -0.14 0.00 0.02 0.00 0.00 57.03 56.85 2dkt h ASP 44 Cb 0.44 0.00 -0.01 0.00 0.22 0.00 0.00 39.33 39.98 2dkt h ASP 44 CO 0.10 0.00 -0.49 0.74 -1.72 0.00 0.00 179.24 177.87 2dkt h THR 45 N 0.00 1.33 -0.40 0.35 2.02 -0.66 -3.02 112.91 112.53 2dkt h THR 45 Ca 0.01 -1.71 -0.00 0.00 0.77 0.00 0.00 66.41 65.48 2dkt h THR 45 Cb 0.06 1.74 -0.00 0.00 -1.74 0.00 0.00 68.15 68.21 2dkt h THR 45 CO -0.00 0.52 0.00 0.59 0.37 0.00 0.00 175.52 177.00 2dkt n ASN 46 N -3.97 4.72 -4.12 4.18 3.02 -0.12 -4.98 115.26 113.98 2dkt n ASN 46 Ca -0.02 -2.99 -0.10 0.00 -0.03 0.00 0.00 54.58 51.44 2dkt n ASN 46 Cb 0.55 -0.61 -0.09 0.00 -0.61 0.00 0.00 39.78 39.02 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 -2.81 1.06 0.07 3.52 0.41 -0.05 -5.01 118.70 115.89 2dkt s GLU 47 Ca 0.48 -1.43 0.15 0.00 -0.41 0.00 0.00 54.97 53.75 2dkt s GLU 47 Cb 0.38 0.28 -0.14 0.00 -1.78 0.00 0.00 34.13 32.87 2dkt s GLU 47 CO 0.12 -0.34 0.90 0.38 -0.49 0.00 0.00 175.26 175.83 2dkt h ASP 48 N 2.72 0.00 -1.39 -0.19 3.04 -1.87 -3.44 116.42 115.29 2dkt h ASP 48 Ca -0.34 0.00 -0.46 0.00 -3.24 0.00 0.00 57.03 52.99 2dkt h ASP 48 Cb 1.22 0.00 -0.00 0.00 -1.04 0.00 0.00 39.33 39.51 2dkt h ASP 48 CO 0.55 0.70 -0.29 -1.38 -2.04 0.00 0.00 179.24 176.77 2dkt s HIS 49 N -2.84 2.62 -0.03 4.15 -3.43 -1.26 -5.12 115.29 109.38 2dkt s HIS 49 Ca -0.02 -0.48 0.01 0.00 -0.80 0.00 0.00 55.06 53.77 2dkt s HIS 49 Cb 0.08 -2.27 -0.03 0.00 -1.43 0.00 0.00 32.58 28.93 2dkt s HIS 49 CO 0.81 -0.37 -0.01 -0.65 -2.00 0.00 0.00 174.74 172.51 2dkt s GLN 50 N -4.29 2.82 0.10 -0.38 1.11 -1.26 -4.35 119.66 113.41 2dkt s GLN 50 Ca 0.52 -0.55 0.03 0.00 0.01 0.00 0.00 55.36 55.37 2dkt s GLN 50 Cb -0.07 -2.68 -0.04 0.00 -1.01 0.00 0.00 33.01 29.21 2dkt s GLN 50 CO 0.31 0.65 0.12 -1.17 0.01 0.00 0.00 175.29 175.21 2dkt s LEU 51 N -1.26 3.90 0.61 2.90 0.20 -1.26 -5.03 118.68 118.73 2dkt s LEU 51 Ca 0.17 0.00 -0.08 0.00 0.69 0.00 0.00 54.13 54.91 2dkt s LEU 51 Cb -0.11 -2.55 0.00 0.00 -0.43 0.00 0.00 46.19 43.10 2dkt s LEU 51 CO 0.07 0.14 0.95 -1.81 -0.29 0.00 0.00 176.35 175.40 2dkt s ASP 52 N -2.64 5.69 -0.05 3.68 1.11 -1.26 -5.00 116.67 118.20 2dkt s ASP 52 Ca 0.31 0.91 0.07 0.00 0.18 0.00 0.00 52.55 54.01 2dkt s ASP 52 Cb -0.12 -1.89 -0.10 0.00 1.07 0.00 0.00 42.92 41.88 2dkt s ASP 52 CO 0.23 -1.06 0.06 -2.11 1.18 0.00 0.00 175.17 173.48 2dkt n ARG 53 N -2.66 2.13 -0.05 8.23 0.00 -1.26 -4.58 116.66 118.46 2dkt n ARG 53 Ca 0.05 -0.02 -0.21 0.00 -0.00 0.00 0.00 57.85 57.67 2dkt n ARG 53 Cb 0.57 -1.18 -0.13 0.00 -0.00 0.00 0.00 32.46 31.71 2dkt n ARG 53 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 177.63 178.82 2dkt n PHE 54 N -2.13 0.78 -0.00 2.89 3.72 -1.26 -4.45 117.46 117.00 2dkt n PHE 54 Ca -0.09 0.18 -0.12 0.00 -0.05 0.00 0.00 57.45 57.37 2dkt n PHE 54 Cb 0.59 -1.10 -0.05 0.00 -0.94 0.00 0.00 39.48 37.98 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 -0.05 -0.44 -6.83 -1.08 1.79 -1.94 -3.41 116.57 104.61 2dkt h LYS 55 Ca -0.48 0.03 -0.53 0.00 -2.18 0.00 0.00 60.65 57.49 2dkt h LYS 55 Cb 1.93 0.10 0.08 0.00 -1.58 0.00 0.00 32.23 32.76 2dkt h LYS 55 CO -0.01 -0.30 0.78 0.54 -1.08 0.00 0.00 179.45 179.38 2dkt s VAL 56 N -5.92 2.36 0.00 0.50 0.11 -1.26 -4.90 120.40 111.29 2dkt s VAL 56 Ca -0.15 0.33 0.00 0.00 -2.93 0.00 0.00 61.98 59.22 2dkt s VAL 56 Cb 0.10 -3.21 0.00 0.00 -1.53 0.00 0.00 36.38 31.74 2dkt s VAL 56 CO 0.65 0.06 0.00 1.17 -3.33 0.00 0.00 175.10 173.65 2dkt n LYS 57 N 1.56 1.56 -1.42 1.54 4.81 -1.26 -4.94 118.16 120.01 2dkt n LYS 57 Ca 0.04 0.00 -0.31 0.00 -0.87 0.00 0.00 58.31 57.18 2dkt n LYS 57 Cb 0.39 -0.85 0.08 0.00 0.02 0.00 0.00 35.03 34.67 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 -1.69 2.48 0.13 1.64 -6.30 -1.26 -2.22 118.70 111.48 2dkt s GLU 58 Ca 0.00 1.01 -0.16 0.00 -2.50 0.00 0.00 54.97 53.32 2dkt s GLU 58 Cb 0.00 -1.93 0.03 0.00 0.00 0.00 0.00 34.13 32.23 2dkt s GLU 58 CO 0.00 -1.44 0.40 0.14 0.02 0.00 0.00 175.26 174.38 2dkt s VAL 59 N -2.99 0.07 0.11 3.70 -7.23 -0.93 -3.81 120.40 109.32 2dkt s VAL 59 Ca 0.60 -0.60 0.08 0.00 -1.81 0.00 0.00 61.98 60.25 2dkt s VAL 59 Cb -0.16 -1.18 -0.04 0.00 0.56 0.00 0.00 36.38 35.57 2dkt s VAL 59 CO 0.55 -0.32 -0.20 -1.58 -0.31 0.00 0.00 175.10 173.24 2dkt s GLN 60 N -3.81 1.11 0.30 4.82 0.74 0.47 -2.65 119.66 120.65 2dkt s GLN 60 Ca 0.03 -1.17 -0.12 0.00 0.05 0.00 0.00 55.36 54.15 2dkt s GLN 60 Cb 0.02 -1.31 -0.08 0.00 1.10 0.00 0.00 33.01 32.74 2dkt s GLN 60 CO -0.12 0.30 0.68 0.00 -0.55 0.00 0.00 175.29 175.60 2dkt n ILE 62 N -0.45 0.00 -0.06 0.00 -6.64 -0.81 -3.12 119.36 108.29 2dkt n ILE 62 Ca 0.02 -0.24 -0.05 0.00 -1.77 0.00 0.00 62.75 60.71 2dkt n ILE 62 Cb 0.53 0.59 -0.04 0.00 -1.44 0.00 0.00 39.64 39.28 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 0.00 -0.20 7.28 4.21 -1.78 -3.38 115.58 121.70 2dkt h ASN 63 Ca 0.00 -0.31 -0.03 0.00 1.21 0.00 0.00 56.30 57.17 2dkt h ASN 63 Cb 0.56 0.00 -0.02 0.00 -1.12 0.00 0.00 38.32 37.74 2dkt h ASN 63 CO 0.00 0.69 -0.02 0.00 -1.29 0.00 0.00 177.43 176.81 2dkt n GLU 65 N -0.84 -0.87 -3.68 0.00 1.02 -1.18 -4.85 120.64 110.23 2dkt n GLU 65 Ca 0.22 0.08 -0.37 0.00 -0.02 0.00 0.00 57.16 57.07 2dkt n GLU 65 Cb 0.85 -2.89 -0.06 0.00 -0.02 0.00 0.00 31.44 29.32 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 -5.60 3.86 0.53 3.49 2.47 -1.26 -4.83 119.74 118.39 2dkt s LYS 66 Ca 0.32 0.05 -0.19 0.00 -1.56 0.00 0.00 55.97 54.59 2dkt s LYS 66 Cb -0.19 -3.29 -0.07 0.00 -1.46 0.00 0.00 37.83 32.83 2dkt s LYS 66 CO 0.70 0.56 1.09 -1.17 0.16 0.00 0.00 175.35 176.69 2dkt s LEU 67 N -0.49 3.77 0.02 5.43 2.96 -1.26 -2.10 118.68 126.99 2dkt s LEU 67 Ca 0.17 2.06 -0.28 0.00 -0.22 0.00 0.00 54.13 55.86 2dkt s LEU 67 Cb -0.13 -4.57 0.10 0.00 0.50 0.00 0.00 46.19 42.08 2dkt s LEU 67 CO 0.06 -1.05 1.25 0.00 -1.32 0.00 0.00 176.35 175.28 2dkt s GLN 68 N -3.32 0.53 0.48 1.98 -2.07 -1.08 -4.94 119.66 111.23 2dkt s GLN 68 Ca 0.70 -0.34 0.04 0.00 -1.82 0.00 0.00 55.36 53.94 2dkt s GLN 68 Cb -0.20 0.15 0.04 0.00 -1.09 0.00 0.00 33.01 31.91 2dkt s GLN 68 CO 0.25 -0.25 0.37 -2.39 -1.32 0.00 0.00 175.29 171.95 2dkt n HIS 69 N -0.82 -0.78 -1.69 9.60 1.44 -1.26 -2.19 115.22 119.52 2dkt n HIS 69 Ca 0.01 -2.02 -0.54 0.00 -2.01 0.00 0.00 57.72 53.16 2dkt n HIS 69 Cb 0.59 -0.39 -0.06 0.00 0.12 0.00 0.00 29.99 30.24 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 -2.03 0.03 -3.63 1.59 0.00 -0.94 -4.50 120.51 111.03 2dkt n ALA 70 Ca -0.15 0.38 0.01 0.00 0.00 0.00 0.00 53.44 53.68 2dkt n ALA 70 Cb 0.54 -2.28 0.02 0.00 0.00 0.00 0.00 19.45 17.74 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 5.26 0.76 -0.07 0.00 10.64 -1.26 -5.06 117.38 127.64 2dkt n GLN 71 Ca 0.24 -1.53 -0.06 0.00 -1.83 0.00 0.00 57.00 53.82 2dkt n GLN 71 Cb 0.18 1.95 -0.11 0.00 -0.86 0.00 0.00 30.24 31.40 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 -0.45 1.74 -4.22 2.61 7.27 -1.26 -4.96 117.38 118.10 2dkt n GLN 72 Ca -0.05 -0.01 -0.15 0.00 0.07 0.00 0.00 57.00 56.86 2dkt n GLN 72 Cb 0.45 -1.35 -0.11 0.00 2.41 0.00 0.00 30.24 31.64 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 -2.35 1.11 0.62 1.69 2.01 -1.26 -0.99 115.64 116.48 2dkt s THR 73 Ca -0.07 -1.78 -0.15 0.00 0.31 0.00 0.00 61.69 60.00 2dkt s THR 73 Cb 0.04 -1.55 -0.02 0.00 0.01 0.00 0.00 72.50 70.98 2dkt s THR 73 CO 0.56 -0.58 1.07 0.00 -0.69 0.00 0.00 174.62 174.98 2dkt n GLU 75 N -2.29 3.09 0.00 0.00 1.02 -1.26 -2.85 120.64 118.36 2dkt n GLU 75 Ca 0.09 -2.60 0.00 0.00 -0.02 0.00 0.00 57.16 54.63 2dkt n GLU 75 Cb 0.53 -1.61 0.00 0.00 -0.02 0.00 0.00 31.44 30.33 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 1.08 2.32 -0.00 1.62 2.03 -1.26 -4.85 116.55 117.49 2dkt n ASP 76 Ca 0.22 0.00 0.02 0.00 0.52 0.00 0.00 54.79 55.55 2dkt n ASP 76 Cb 0.68 0.00 -0.03 0.00 -0.72 0.00 0.00 41.12 41.05 2dkt n ASP 76 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 2dkt n SER 78 N -1.22 -5.45 -4.60 0.00 2.88 -1.13 -4.94 113.62 99.15 2dkt n SER 78 Ca 0.00 -0.64 -0.41 0.00 -1.33 0.00 0.00 58.87 56.49 2dkt n SER 78 Cb 0.08 -4.61 -0.06 0.00 -0.75 0.00 0.00 64.21 58.87 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 -3.33 4.87 -0.37 2.46 2.01 -1.26 -4.65 115.64 115.36 2dkt s THR 79 Ca 0.57 0.98 -0.31 0.00 0.31 0.00 0.00 61.69 63.23 2dkt s THR 79 Cb -0.26 -4.07 -0.09 0.00 0.01 0.00 0.00 72.50 68.08 2dkt s THR 79 CO 0.77 -0.20 2.27 -0.11 -0.69 0.00 0.00 174.62 176.66 2dkt n LEU 80 N 6.04 2.37 0.00 4.42 7.94 -1.26 -3.27 117.00 133.23 2dkt n LEU 80 Ca 0.01 0.18 0.11 0.00 -1.11 0.00 0.00 56.01 55.20 2dkt n LEU 80 Cb 0.48 -1.38 0.66 0.00 0.53 0.00 0.00 43.42 43.71 2dkt n LEU 80 CO 0.48 -0.86 0.85 0.49 -1.11 0.00 0.00 177.39 177.24 2dkt n PHE 81 N 11.46 0.00 0.00 1.96 3.72 -0.16 -4.66 117.46 129.78 2dkt n PHE 81 Ca 0.39 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.79 2dkt n PHE 81 Cb 0.33 -0.01 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 0.40 3.33 0.45 1.37 0.00 -1.26 -3.57 105.19 105.91 2dkt n GLY 82 Ca 0.16 -0.21 0.34 0.00 0.00 0.00 0.00 46.02 46.32 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 0.14 -5.01 1.61 5.08 -1.81 -3.34 114.58 111.24 2dkt h GLU 83 Ca 0.00 -0.01 -0.66 0.00 -1.00 0.00 0.00 59.36 57.69 2dkt h GLU 83 Cb 0.00 -0.03 -0.30 0.00 0.50 0.00 0.00 28.75 28.92 2dkt h GLU 83 CO 0.00 0.09 -0.77 -0.47 -1.00 0.00 0.00 179.01 176.86 2dkt s TYR 84 N -5.34 2.90 -0.23 4.33 6.14 -0.75 -5.00 117.35 119.41 2dkt s TYR 84 Ca -0.08 -1.18 0.02 0.00 0.64 0.00 0.00 57.07 56.48 2dkt s TYR 84 Cb 0.29 -2.05 0.04 0.00 0.42 0.00 0.00 41.96 40.67 2dkt s TYR 84 CO 0.82 -0.64 -0.14 1.52 0.64 0.00 0.00 175.55 177.75 2dkt s TYR 85 N 1.42 3.04 0.12 4.97 1.13 -1.25 -1.54 117.35 125.23 2dkt s TYR 85 Ca 0.05 -2.04 -0.25 0.00 -1.41 0.00 0.00 57.07 53.42 2dkt s TYR 85 Cb -0.14 -1.91 -0.07 0.00 -1.10 0.00 0.00 41.96 38.74 2dkt s TYR 85 CO -0.06 -0.85 0.76 0.00 -2.51 0.00 0.00 175.55 172.88 2dkt n SER 87 N 1.97 1.46 0.05 0.00 7.64 -1.26 -2.16 113.62 121.32 2dkt n SER 87 Ca -0.05 0.24 -0.11 0.00 1.01 0.00 0.00 58.87 59.96 2dkt n SER 87 Cb 0.49 -0.37 -0.08 0.00 -1.01 0.00 0.00 64.21 63.24 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 0.03 0.94 -0.00 0.44 2.04 -1.94 -3.26 117.51 115.76 2dkt h ILE 88 Ca -0.39 -1.14 0.00 0.00 1.00 0.00 0.00 64.86 64.33 2dkt h ILE 88 Cb 2.03 1.57 0.00 0.00 -0.74 0.00 0.00 36.82 39.68 2dkt h ILE 88 CO 0.07 0.24 -0.23 0.00 0.00 0.00 0.00 178.15 178.22 2dkt n HIS 90 N -1.33 -1.01 -3.75 0.00 8.25 -0.92 -4.67 115.22 111.80 2dkt n HIS 90 Ca 0.09 0.00 -0.31 0.00 -0.26 0.00 0.00 57.72 57.24 2dkt n HIS 90 Cb 0.32 -2.81 -0.04 0.00 1.12 0.00 0.00 29.99 28.58 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 -5.01 4.29 -0.17 2.41 0.20 -1.21 -4.87 118.68 114.32 2dkt s LEU 91 Ca 0.00 0.47 0.00 0.00 0.69 0.00 0.00 54.13 55.29 2dkt s LEU 91 Cb 0.00 -3.19 0.03 0.00 -0.43 0.00 0.00 46.19 42.61 2dkt s LEU 91 CO 0.00 0.08 -0.11 -0.36 -0.29 0.00 0.00 176.35 175.66 2dkt s PHE 92 N -1.64 2.17 0.24 5.38 0.08 -1.26 -0.74 117.98 122.21 2dkt s PHE 92 Ca 0.39 -1.31 0.09 0.00 0.12 0.00 0.00 56.93 56.22 2dkt s PHE 92 Cb -0.12 -1.56 -0.05 0.00 -0.57 0.00 0.00 43.02 40.72 2dkt s PHE 92 CO 0.26 -0.68 -0.16 -0.51 -0.10 0.00 0.00 175.22 174.03 2dkt s ASP 93 N 1.48 3.03 0.87 1.36 1.11 -0.59 -4.19 116.67 119.75 2dkt s ASP 93 Ca 0.02 -1.04 -0.08 0.00 0.18 0.00 0.00 52.55 51.64 2dkt s ASP 93 Cb -0.14 -0.21 0.14 0.00 1.07 0.00 0.00 42.92 43.78 2dkt s ASP 93 CO -0.09 -0.09 0.88 2.29 1.18 0.00 0.00 175.17 179.34 2dkt n LYS 94 N -0.50 -0.58 -2.05 8.23 2.85 -1.23 -1.80 118.16 123.09 2dkt n LYS 94 Ca -0.07 -1.67 -0.30 0.00 -1.05 0.00 0.00 58.31 55.22 2dkt n LYS 94 Cb 0.60 -0.81 -0.04 0.00 -0.65 0.00 0.00 35.03 34.13 2dkt n LYS 94 CO 0.00 0.00 0.00 0.34 -0.05 0.00 0.00 177.40 177.69 2dkt s ASP 95 N -4.34 5.18 -0.08 -5.58 2.15 -1.26 -4.60 116.67 108.14 2dkt s ASP 95 Ca 0.53 -0.39 0.22 0.00 0.43 0.00 0.00 52.55 53.34 2dkt s ASP 95 Cb -0.02 -2.55 0.44 0.00 -0.30 0.00 0.00 42.92 40.49 2dkt s ASP 95 CO 0.36 -2.64 1.18 2.29 -0.17 0.00 0.00 175.17 176.19 2dkt n LYS 96 N 8.95 0.64 -4.09 4.34 2.85 -1.26 -4.99 118.16 124.60 2dkt n LYS 96 Ca 0.34 -2.51 -0.28 0.00 -1.05 0.00 0.00 58.31 54.81 2dkt n LYS 96 Cb 0.48 -0.59 -0.05 0.00 -0.65 0.00 0.00 35.03 34.22 2dkt n LYS 96 CO 0.00 0.00 0.00 -2.13 -0.05 0.00 0.00 177.40 175.22 2dkt n ARG 97 N -0.00 -2.50 -4.07 -1.58 0.00 -1.26 -4.70 116.66 102.54 2dkt n ARG 97 Ca 0.10 0.30 -0.35 0.00 -0.00 0.00 0.00 57.85 57.90 2dkt n ARG 97 Cb 1.01 -4.26 -0.09 0.00 0.00 0.00 0.00 32.46 29.12 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 -6.85 3.57 0.46 -0.14 0.74 -1.26 -2.97 119.66 113.20 2dkt s GLN 98 Ca 0.05 -0.30 0.04 0.00 0.05 0.00 0.00 55.36 55.20 2dkt s GLN 98 Cb -0.03 -3.09 0.04 0.00 1.10 0.00 0.00 33.01 31.02 2dkt s GLN 98 CO 0.93 0.53 0.30 2.48 -0.55 0.00 0.00 175.29 178.97 2dkt n TYR 99 N 2.73 -0.50 -3.98 1.67 0.18 0.05 -4.94 117.16 112.37 2dkt n TYR 99 Ca -0.18 -1.97 -0.26 0.00 1.88 0.00 0.00 57.90 57.37 2dkt n TYR 99 Cb 0.53 -0.36 -0.17 0.00 -0.38 0.00 0.00 39.34 38.96 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 -2.32 1.32 0.08 -3.48 5.65 -1.26 -0.35 115.29 114.92 2dkt s HIS 100 Ca 0.23 -0.60 -0.27 0.00 0.25 0.00 0.00 55.06 54.66 2dkt s HIS 100 Cb -0.02 -1.12 -0.06 0.00 -1.18 0.00 0.00 32.58 30.21 2dkt s HIS 100 CO 0.14 -0.44 0.86 0.00 -0.65 0.00 0.00 174.74 174.65 2dkt h GLU 102 N 5.61 0.38 -0.51 0.00 5.08 -1.94 0.13 114.58 123.33 2dkt h GLU 102 Ca -0.43 -0.65 0.10 0.00 -1.00 0.00 0.00 59.36 57.38 2dkt h GLU 102 Cb 1.21 0.24 -0.03 0.00 0.50 0.00 0.00 28.75 30.67 2dkt h GLU 102 CO 0.71 1.31 0.35 0.77 -1.00 0.00 0.00 179.01 181.15 2dkt h SER 103 N -0.10 0.21 0.00 1.42 0.02 -1.96 -1.64 113.55 111.50 2dkt h SER 103 Ca -0.26 0.01 0.00 0.00 -0.84 0.00 0.00 61.79 60.70 2dkt h SER 103 Cb 1.92 -0.04 0.00 0.00 0.14 0.00 0.00 62.40 64.42 2dkt h SER 103 CO 0.17 0.12 -1.51 0.00 -1.14 0.00 0.00 176.83 174.48 2dkt n GLY 105 N 1.47 1.07 3.41 0.00 0.00 0.41 -4.97 105.19 106.59 2dkt n GLY 105 Ca -0.01 -0.14 -0.21 0.00 0.00 0.00 0.00 46.02 45.66 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 -2.08 2.05 0.31 -0.61 -4.36 -1.05 -4.63 121.20 110.82 2dkt s ILE 106 Ca 0.00 -2.28 -0.27 0.00 -0.26 0.00 0.00 60.65 57.84 2dkt s ILE 106 Cb 0.00 -2.21 -0.10 0.00 1.25 0.00 0.00 42.46 41.40 2dkt s ILE 106 CO 0.00 -0.47 0.95 0.00 0.24 0.00 0.00 174.94 175.66 2dkt s ARG 108 N -1.91 0.23 0.07 0.00 1.81 0.52 -4.88 118.95 114.80 2dkt s ARG 108 Ca 0.49 -0.45 -0.23 0.00 -1.72 0.00 0.00 55.73 53.82 2dkt s ARG 108 Cb -0.20 0.06 -0.06 0.00 -0.45 0.00 0.00 34.95 34.30 2dkt s ARG 108 CO 0.26 -0.03 0.70 0.42 -0.68 0.00 0.00 175.30 175.96 2dkt s ILE 109 N -1.05 4.68 0.00 1.52 -1.09 -1.26 -0.77 121.20 123.23 2dkt s ILE 109 Ca -0.11 1.49 0.00 0.00 -2.23 0.00 0.00 60.65 59.80 2dkt s ILE 109 Cb -0.07 -4.04 0.00 0.00 -1.58 0.00 0.00 42.46 36.77 2dkt s ILE 109 CO -0.01 0.45 0.00 0.61 -1.23 0.00 0.00 174.94 174.76 2dkt n GLY 110 N 2.09 1.34 3.68 6.18 0.00 -1.16 -4.77 105.19 112.55 2dkt n GLY 110 Ca -0.06 -1.58 -0.42 0.00 0.00 0.00 0.00 46.02 43.96 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 2.02 4.25 0.31 1.61 0.04 -1.26 -5.01 135.00 136.96 2dkt s PRO 111 Ca 0.00 2.02 0.16 0.00 0.04 0.00 0.00 61.00 63.22 2dkt s PRO 111 Cb 0.00 -3.65 1.08 0.00 0.04 0.00 0.00 34.50 31.96 2dkt s PRO 111 CO 0.00 -0.65 1.33 1.17 0.04 0.00 0.00 177.00 178.89 2dkt n LYS 112 N 5.77 -0.05 -0.15 4.56 4.81 -1.26 0.56 118.16 132.40 2dkt n LYS 112 Ca 0.14 1.17 -0.06 0.00 -0.87 0.00 0.00 58.31 58.69 2dkt n LYS 112 Cb 0.43 -2.08 -0.00 0.00 0.02 0.00 0.00 35.03 33.40 2dkt n LYS 112 CO 0.00 0.00 0.00 0.93 1.17 0.00 0.00 177.40 179.50 2dkt h GLU 113 N 0.00 -0.20 -1.38 1.64 5.08 -2.00 0.25 114.58 117.97 2dkt h GLU 113 Ca 0.69 0.01 -0.20 0.00 -1.00 0.00 0.00 59.36 58.87 2dkt h GLU 113 Cb 1.80 0.04 -0.10 0.00 0.50 0.00 0.00 28.75 30.99 2dkt h GLU 113 CO -0.66 -0.13 0.25 -0.25 -1.00 0.00 0.00 179.01 177.22 2dkt n ASP 114 N -5.42 4.87 -3.90 1.42 8.00 0.19 -4.84 116.55 116.87 2dkt n ASP 114 Ca 0.02 -2.71 -0.08 0.00 0.71 0.00 0.00 54.79 52.73 2dkt n ASP 114 Cb 0.34 -0.88 -0.04 0.00 -0.02 0.00 0.00 41.12 40.53 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 -1.17 0.05 0.32 1.24 0.40 0.87 -3.01 117.98 116.69 2dkt s PHE 115 Ca 0.20 -0.45 -0.18 0.00 -0.60 0.00 0.00 56.93 55.90 2dkt s PHE 115 Cb 0.16 0.44 0.06 0.00 0.51 0.00 0.00 43.02 44.19 2dkt s PHE 115 CO 0.01 -1.09 0.84 -0.59 0.70 0.00 0.00 175.22 175.10 2dkt s PHE 116 N -3.95 0.06 -0.11 0.36 -0.12 0.21 -4.71 117.98 109.72 2dkt s PHE 116 Ca 0.15 -0.65 -0.01 0.00 -0.05 0.00 0.00 56.93 56.38 2dkt s PHE 116 Cb -0.03 0.79 0.03 0.00 -0.63 0.00 0.00 43.02 43.18 2dkt s PHE 116 CO 0.06 -1.37 -0.03 -1.58 -0.05 0.00 0.00 175.22 172.25 2dkt s HIS 117 N -2.51 1.10 0.32 3.49 5.65 -1.26 -0.20 115.29 121.89 2dkt s HIS 117 Ca 0.16 -0.52 -0.19 0.00 0.25 0.00 0.00 55.06 54.76 2dkt s HIS 117 Cb -0.05 -1.03 -0.09 0.00 -1.18 0.00 0.00 32.58 30.23 2dkt s HIS 117 CO 0.09 -0.45 0.81 0.00 -0.65 0.00 0.00 174.74 174.54 2dkt h LEU 119 N 2.54 0.00 -0.96 0.00 3.38 -1.97 -2.66 115.31 115.65 2dkt h LEU 119 Ca -0.48 0.00 0.35 0.00 0.09 0.00 0.00 57.88 57.84 2dkt h LEU 119 Cb 1.18 0.00 -0.17 0.00 0.09 0.00 0.00 40.66 41.76 2dkt h LEU 119 CO 0.64 0.23 0.32 0.29 0.09 0.00 0.00 178.44 180.01 2dkt n LYS 120 N -3.09 -0.06 0.07 1.13 4.76 -1.26 0.21 118.16 119.91 2dkt n LYS 120 Ca -0.01 1.36 -0.11 0.00 -2.87 0.00 0.00 58.31 56.68 2dkt n LYS 120 Cb 0.04 -2.33 -0.02 0.00 -1.84 0.00 0.00 35.03 30.88 2dkt n LYS 120 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 2dkt n ASN 122 N -3.74 -3.70 -2.98 0.00 2.85 0.56 -5.02 115.26 103.23 2dkt n ASN 122 Ca -0.05 -0.18 -0.11 0.00 -0.11 0.00 0.00 54.58 54.13 2dkt n ASN 122 Cb 0.80 -2.43 0.00 0.00 1.24 0.00 0.00 39.78 39.39 2dkt n ASN 122 CO 0.00 0.00 0.00 -1.48 -2.11 0.00 0.00 177.26 173.67 2dkt s LEU 123 N -3.43 0.41 0.04 1.20 0.05 -1.15 -4.84 118.68 110.97 2dkt s LEU 123 Ca 0.19 -1.31 -0.07 0.00 0.05 0.00 0.00 54.13 52.99 2dkt s LEU 123 Cb -0.08 2.34 -0.05 0.00 -2.05 0.00 0.00 46.19 46.34 2dkt s LEU 123 CO 0.24 -1.57 0.31 0.00 -0.55 0.00 0.00 176.35 174.78 2dkt s LEU 125 N -1.94 1.51 0.31 0.00 1.43 0.73 -4.91 118.68 115.80 2dkt s LEU 125 Ca 0.31 -0.21 -0.27 0.00 -1.03 0.00 0.00 54.13 52.93 2dkt s LEU 125 Cb -0.13 0.72 -0.10 0.00 0.03 0.00 0.00 46.19 46.72 2dkt s LEU 125 CO 0.18 -0.39 0.94 0.28 0.23 0.00 0.00 176.35 177.59 2dkt s THR 126 N -1.48 4.20 0.24 5.49 -1.32 -1.26 -0.62 115.64 120.88 2dkt s THR 126 Ca -0.14 1.86 -0.08 0.00 -1.21 0.00 0.00 61.69 62.12 2dkt s THR 126 Cb -0.07 -4.06 0.26 0.00 -1.51 0.00 0.00 72.50 67.13 2dkt s THR 126 CO 0.01 0.20 1.64 0.71 -2.21 0.00 0.00 174.62 174.97 2dkt h THR 127 N 2.70 0.36 -1.38 5.08 1.35 -1.82 0.11 112.91 119.31 2dkt h THR 127 Ca -0.47 -0.03 0.42 0.00 -0.55 0.00 0.00 66.41 65.78 2dkt h THR 127 Cb 1.19 0.26 -0.08 0.00 -1.73 0.00 0.00 68.15 67.79 2dkt h THR 127 CO 0.65 0.02 0.96 -3.20 -0.25 0.00 0.00 175.52 173.71 2dkt n ASN 128 N -5.34 0.06 -2.58 5.36 5.15 -1.26 0.24 115.26 116.88 2dkt n ASN 128 Ca 0.12 0.89 -0.37 0.00 -0.60 0.00 0.00 54.58 54.62 2dkt n ASN 128 Cb 0.44 -0.44 0.06 0.00 -0.53 0.00 0.00 39.78 39.31 2dkt n ASN 128 CO 0.00 0.00 0.00 0.18 1.40 0.00 0.00 177.26 178.84 2dkt n LEU 129 N -3.77 7.64 -4.52 1.20 4.77 0.38 -4.94 117.00 117.76 2dkt n LEU 129 Ca 0.34 -4.52 -0.42 0.00 -0.03 0.00 0.00 56.01 51.38 2dkt n LEU 129 Cb 1.46 -1.02 -0.03 0.00 -2.33 0.00 0.00 43.42 41.50 2dkt n LEU 129 CO 0.27 1.59 0.99 -0.13 -1.33 0.00 0.00 177.39 178.79 2dkt s ARG 130 N -3.93 3.23 0.00 3.23 0.52 0.65 -3.62 118.95 119.02 2dkt s ARG 130 Ca 0.59 -0.34 0.00 0.00 -0.52 0.00 0.00 55.73 55.46 2dkt s ARG 130 Cb 0.48 -4.16 0.00 0.00 0.52 0.00 0.00 34.95 31.79 2dkt s ARG 130 CO -0.18 -1.92 0.00 0.41 0.02 0.00 0.00 175.30 173.63 2dkt n GLY 131 N 5.29 0.69 0.73 -3.53 0.00 -1.26 -4.94 105.19 102.17 2dkt n GLY 131 Ca 0.02 -0.73 0.00 0.00 0.00 0.00 0.00 46.02 45.31 2dkt n GLY 131 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2dkt n LYS 132 N -0.80 0.00 -1.18 1.61 5.02 -1.24 -5.09 118.16 116.48 2dkt n LYS 132 Ca 0.00 0.00 -0.33 0.00 -2.02 0.00 0.00 58.31 55.96 2dkt n LYS 132 Cb 0.45 -0.48 0.12 0.00 -0.02 0.00 0.00 35.03 35.10 2dkt n LYS 132 CO 0.00 0.00 0.00 -3.38 -0.52 0.00 0.00 177.40 173.50 2dkt s HIS 133 N -1.68 1.91 -0.13 2.13 -3.43 -1.26 -5.01 115.29 107.83 2dkt s HIS 133 Ca 0.00 1.66 -0.06 0.00 -0.80 0.00 0.00 55.06 55.86 2dkt s HIS 133 Cb 0.00 -3.43 -0.04 0.00 -1.43 0.00 0.00 32.58 27.68 2dkt s HIS 133 CO 0.00 -2.69 0.09 0.21 -2.00 0.00 0.00 174.74 170.34 2dkt s LYS 134 N -4.17 3.45 -0.18 -0.38 2.20 -1.26 -5.00 119.74 114.39 2dkt s LYS 134 Ca 0.72 -0.25 -0.07 0.00 -0.36 0.00 0.00 55.97 56.01 2dkt s LYS 134 Cb -0.27 -3.09 -0.09 0.00 -1.51 0.00 0.00 37.83 32.87 2dkt s LYS 134 CO 0.50 0.64 -0.22 0.00 -0.36 0.00 0.00 175.35 175.91 2dkt s ILE 136 N -2.34 3.63 0.27 0.00 2.07 -1.26 -4.70 121.20 118.88 2dkt s ILE 136 Ca -0.25 0.86 -0.29 0.00 -1.41 0.00 0.00 60.65 59.56 2dkt s ILE 136 Cb 0.09 -3.34 -0.09 0.00 0.13 0.00 0.00 42.46 39.24 2dkt s ILE 136 CO 0.34 -0.37 1.00 -1.61 -1.91 0.00 0.00 174.94 172.39 2dkt s GLU 137 N -3.77 4.72 0.02 3.50 0.41 -1.26 -4.99 118.70 117.33 2dkt s GLU 137 Ca 0.66 1.58 -0.27 0.00 -0.41 0.00 0.00 54.97 56.53 2dkt s GLU 137 Cb -0.18 -3.16 -0.16 0.00 -1.78 0.00 0.00 34.13 28.85 2dkt s GLU 137 CO 0.32 0.36 1.21 1.03 -0.49 0.00 0.00 175.26 177.69 2dkt h SER 138 N 3.85 -0.70 -0.02 -0.19 0.87 -2.01 -3.46 113.55 111.89 2dkt h SER 138 Ca -0.46 -0.02 0.00 0.00 -1.23 0.00 0.00 61.79 60.08 2dkt h SER 138 Cb 1.20 0.18 0.00 0.00 -0.44 0.00 0.00 62.40 63.35 2dkt h SER 138 CO 0.67 -0.35 0.00 0.61 -0.53 0.00 0.00 176.83 177.23 2dkt n GLY 139 N -0.69 0.77 0.59 5.77 0.00 -1.26 -5.08 105.19 105.30 2dkt n GLY 139 Ca -0.12 -1.54 -0.05 0.00 0.00 0.00 0.00 46.02 44.31 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 -1.39 -4.48 1.61 -0.04 -1.26 -5.05 135.00 124.39 2dkt n PRO 140 Ca 0.00 -0.30 -0.34 0.00 -0.04 0.00 0.00 63.50 62.82 2dkt n PRO 140 Cb 0.00 -0.28 -0.11 0.00 -0.04 0.00 0.00 33.50 33.07 2dkt n PRO 140 CO 0.00 0.00 0.00 0.45 -0.04 0.00 0.00 175.50 175.91 2dkt s SER 141 N -2.01 4.83 0.34 3.54 0.15 -1.26 -4.94 113.70 114.35 2dkt s SER 141 Ca 0.12 -0.03 -0.07 0.00 0.70 0.00 0.00 55.95 56.67 2dkt s SER 141 Cb -0.01 -1.48 -0.06 0.00 -1.71 0.00 0.00 66.02 62.76 2dkt s SER 141 CO 0.09 0.29 0.65 -0.55 1.20 0.00 0.00 173.24 174.92 2dkt s SER 142 N -0.36 6.47 0.00 5.45 0.15 -1.26 -5.26 113.70 118.89 2dkt s SER 142 Ca 0.06 0.89 0.19 0.00 0.70 0.00 0.00 55.95 57.79 2dkt s SER 142 Cb -0.12 -2.22 1.13 0.00 -1.71 0.00 0.00 66.02 63.10 2dkt s SER 142 CO 0.02 -0.29 1.52 0.61 1.20 0.00 0.00 173.24 176.30