#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 6.39 0.05 1.61 1.04 -1.26 -5.11 113.70 116.42 2dkt s SER 2 Ca 0.00 0.73 -0.05 0.00 0.48 0.00 0.00 55.95 57.12 2dkt s SER 2 Cb 0.00 -2.15 -0.02 0.00 0.10 0.00 0.00 66.02 63.95 2dkt s SER 2 CO 0.00 -0.30 0.07 -0.44 0.98 0.00 0.00 173.24 173.56 2dkt s SER 3 N -3.50 0.24 0.00 7.02 0.01 -1.26 -5.15 113.70 111.06 2dkt s SER 3 Ca 0.44 -0.65 0.00 0.00 1.31 0.00 0.00 55.95 57.06 2dkt s SER 3 Cb -0.10 0.23 0.00 0.00 0.21 0.00 0.00 66.02 66.36 2dkt s SER 3 CO 0.34 -0.55 0.00 0.61 0.41 0.00 0.00 173.24 174.05 2dkt n GLY 4 N 0.57 0.51 3.09 3.44 0.00 -1.26 -5.15 105.19 106.39 2dkt n GLY 4 Ca -0.18 -1.71 -0.09 0.00 0.00 0.00 0.00 46.02 44.05 2dkt n GLY 4 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2dkt s SER 5 N 0.00 0.23 -0.20 1.61 1.04 -1.26 -5.11 113.70 110.01 2dkt s SER 5 Ca 0.00 -0.60 -0.40 0.00 0.48 0.00 0.00 55.95 55.44 2dkt s SER 5 Cb 0.00 0.21 -0.16 0.00 0.10 0.00 0.00 66.02 66.16 2dkt s SER 5 CO 0.00 -0.49 1.64 -1.20 0.98 0.00 0.00 173.24 174.16 2dkt n SER 6 N 0.79 2.13 0.00 7.02 7.64 -1.26 -4.79 113.62 125.15 2dkt n SER 6 Ca -0.19 1.09 0.00 0.00 1.01 0.00 0.00 58.87 60.78 2dkt n SER 6 Cb 0.58 -1.14 0.00 0.00 -1.01 0.00 0.00 64.21 62.65 2dkt n SER 6 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2dkt n GLY 7 N 3.77 4.79 0.00 0.23 0.00 -1.26 -5.17 105.19 107.55 2dkt n GLY 7 Ca 0.25 -1.03 0.00 0.00 0.00 0.00 0.00 46.02 45.24 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 -1.70 2.32 3.16 -0.02 0.00 -1.26 -5.10 105.19 102.58 2dkt n GLY 8 Ca 0.00 -1.80 -0.33 0.00 0.00 0.00 0.00 46.02 43.89 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 4.06 2.27 0.39 1.61 1.01 -1.26 -5.10 120.40 123.39 2dkt s VAL 9 Ca 0.00 -0.87 -0.25 0.00 0.00 0.00 0.00 61.98 60.86 2dkt s VAL 9 Cb 0.00 -1.96 -0.11 0.00 0.00 0.00 0.00 36.38 34.30 2dkt s VAL 9 CO 0.00 0.52 0.97 -2.11 0.00 0.00 0.00 175.10 174.48 2dkt n ARG 10 N 4.58 1.28 -3.68 2.72 -4.01 -1.26 -5.00 116.66 111.29 2dkt n ARG 10 Ca -0.20 0.46 -0.11 0.00 -1.04 0.00 0.00 57.85 56.96 2dkt n ARG 10 Cb 0.50 -1.95 -0.06 0.00 -3.04 0.00 0.00 32.46 27.91 2dkt n ARG 10 CO 0.00 0.00 0.00 -0.80 -3.04 0.00 0.00 177.63 173.79 2dkt s ASN 11 N -0.72 -0.18 -0.58 2.89 0.02 -1.26 -5.09 114.94 110.02 2dkt s ASN 11 Ca 0.62 -0.29 -0.26 0.00 -1.02 0.00 0.00 52.86 51.91 2dkt s ASN 11 Cb -0.59 0.43 -0.05 0.00 0.02 0.00 0.00 41.25 41.06 2dkt s ASN 11 CO 0.58 -0.77 2.13 -0.22 0.02 0.00 0.00 177.10 178.84 2dkt s LEU 12 N -2.58 3.32 -0.20 0.60 0.20 -1.26 -4.94 118.68 113.83 2dkt s LEU 12 Ca 0.01 0.61 -0.02 0.00 0.69 0.00 0.00 54.13 55.42 2dkt s LEU 12 Cb 0.02 -2.52 0.00 0.00 -0.43 0.00 0.00 46.19 43.26 2dkt s LEU 12 CO -0.09 -2.69 -0.11 0.00 -0.29 0.00 0.00 176.35 173.17 2dkt s ALA 13 N 10.79 2.61 0.13 5.97 0.00 -1.26 -5.08 121.76 134.93 2dkt s ALA 13 Ca 0.82 -1.16 -0.35 0.00 0.00 0.00 0.00 51.96 51.27 2dkt s ALA 13 Cb -0.14 -1.46 -0.15 0.00 0.00 0.00 0.00 23.12 21.36 2dkt s ALA 13 CO 0.22 -0.34 1.42 0.00 0.00 0.00 0.00 175.76 177.06 2dkt n GLN 14 N 4.62 1.61 0.00 0.00 0.00 -1.26 -4.94 117.38 117.40 2dkt n GLN 14 Ca -0.19 0.58 0.00 0.00 0.00 0.00 0.00 57.00 57.39 2dkt n GLN 14 Cb 0.51 -2.26 0.00 0.00 0.00 0.00 0.00 30.24 28.49 2dkt n GLN 14 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.06 177.47 2dkt n GLY 15 N 2.79 -0.18 0.00 2.61 0.00 -1.26 -4.25 105.19 104.91 2dkt n GLY 15 Ca 0.17 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.19 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 -1.85 0.09 -3.23 1.61 -0.04 -1.26 -3.22 135.00 127.10 2dkt n PRO 16 Ca 0.00 0.00 -0.15 0.00 -0.04 0.00 0.00 63.50 63.31 2dkt n PRO 16 Cb 0.00 0.00 -0.04 0.00 -0.04 0.00 0.00 33.50 33.42 2dkt n PRO 16 CO 0.00 0.00 0.00 2.89 -0.04 0.00 0.00 175.50 178.35 2dkt n ARG 17 N -0.68 -0.95 -0.01 0.54 0.00 -1.24 -4.11 116.66 110.21 2dkt n ARG 17 Ca 0.00 0.05 0.00 0.00 -0.00 0.00 0.00 57.85 57.90 2dkt n ARG 17 Cb 0.00 -1.75 0.00 0.00 -0.00 0.00 0.00 32.46 30.71 2dkt n ARG 17 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.63 178.04 2dkt n GLY 18 N -1.50 1.17 3.80 2.89 0.00 0.11 -4.70 105.19 106.96 2dkt n GLY 18 Ca -0.10 -1.17 -0.28 0.00 0.00 0.00 0.00 46.02 44.47 2dkt n GLY 18 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2dkt n GLU 20 N -1.42 0.10 0.00 0.00 0.28 -1.26 -2.95 120.64 115.39 2dkt n GLU 20 Ca -0.08 0.58 0.00 0.00 -0.16 0.00 0.00 57.16 57.50 2dkt n GLU 20 Cb 0.65 -1.92 0.00 0.00 1.43 0.00 0.00 31.44 31.60 2dkt n GLU 20 CO 0.00 0.00 0.00 0.72 -0.16 0.00 0.00 177.13 177.69 2dkt n HIS 21 N -2.04 0.00 -4.39 -1.84 8.25 -1.26 -5.05 115.22 108.90 2dkt n HIS 21 Ca -0.01 0.00 -0.19 0.00 -0.26 0.00 0.00 57.72 57.26 2dkt n HIS 21 Cb 0.12 -0.29 -0.10 0.00 1.12 0.00 0.00 29.99 30.83 2dkt n HIS 21 CO 0.00 0.00 0.00 0.71 0.64 0.00 0.00 176.34 177.69 2dkt s TYR 22 N -0.90 1.76 -0.56 4.41 2.02 -1.15 -5.10 117.35 117.83 2dkt s TYR 22 Ca 0.00 -0.98 -0.09 0.00 -0.37 0.00 0.00 57.07 55.64 2dkt s TYR 22 Cb 0.00 -1.09 0.14 0.00 -0.40 0.00 0.00 41.96 40.62 2dkt s TYR 22 CO 0.00 -0.06 0.43 -0.51 -1.57 0.00 0.00 175.55 173.84 2dkt s ASP 23 N -3.40 5.77 0.02 2.29 1.11 -1.26 -0.57 116.67 120.62 2dkt s ASP 23 Ca 0.34 -2.23 0.01 0.00 0.18 0.00 0.00 52.55 50.85 2dkt s ASP 23 Cb 0.07 -2.01 -0.01 0.00 1.07 0.00 0.00 42.92 42.04 2dkt s ASP 23 CO 0.13 -0.61 -0.04 0.00 1.18 0.00 0.00 175.17 175.83 2dkt s ARG 24 N 0.88 0.34 -0.63 8.23 1.70 -1.26 -2.91 118.95 125.31 2dkt s ARG 24 Ca 0.10 -0.42 0.00 0.00 -0.47 0.00 0.00 55.73 54.94 2dkt s ARG 24 Cb -0.22 -0.17 0.43 0.00 -0.57 0.00 0.00 34.95 34.42 2dkt s ARG 24 CO -0.03 0.03 1.82 0.00 -1.08 0.00 0.00 175.30 176.05 2dkt n ALA 25 N 2.20 6.07 -3.62 7.88 0.00 -1.24 0.09 120.51 131.89 2dkt n ALA 25 Ca -0.18 -3.74 -0.12 0.00 0.00 0.00 0.00 53.44 49.40 2dkt n ALA 25 Cb 0.57 -1.49 -0.07 0.00 0.00 0.00 0.00 19.45 18.46 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 0.76 4.35 -0.03 0.00 1.02 0.16 -4.83 118.68 120.11 2dkt s LEU 27 Ca -0.03 0.58 -0.23 0.00 0.02 0.00 0.00 54.13 54.47 2dkt s LEU 27 Cb -0.05 -2.29 -0.04 0.00 0.02 0.00 0.00 46.19 43.83 2dkt s LEU 27 CO -0.05 0.28 0.70 -1.48 0.02 0.00 0.00 176.35 175.82 2dkt s LEU 28 N -0.49 4.37 0.37 1.79 0.05 -1.12 -0.25 118.68 123.40 2dkt s LEU 28 Ca 0.17 1.26 -0.27 0.00 0.05 0.00 0.00 54.13 55.34 2dkt s LEU 28 Cb -0.13 -3.10 -0.09 0.00 -2.05 0.00 0.00 46.19 40.81 2dkt s LEU 28 CO 0.06 -0.05 1.24 -0.75 -0.55 0.00 0.00 176.35 176.30 2dkt s LYS 29 N 0.41 4.20 -0.46 1.48 2.47 -1.25 -3.33 119.74 123.26 2dkt s LYS 29 Ca 0.37 2.03 -0.11 0.00 -1.56 0.00 0.00 55.97 56.70 2dkt s LYS 29 Cb -0.19 -2.88 0.10 0.00 -1.46 0.00 0.00 37.83 33.40 2dkt s LYS 29 CO 0.19 -0.26 0.34 0.00 0.16 0.00 0.00 175.35 175.79 2dkt s ALA 30 N -1.26 3.42 -2.00 3.13 0.00 0.28 -4.78 121.76 120.55 2dkt s ALA 30 Ca 0.53 -2.32 0.10 0.00 0.00 0.00 0.00 51.96 50.27 2dkt s ALA 30 Cb -0.35 -2.86 0.59 0.00 0.00 0.00 0.00 23.12 20.49 2dkt s ALA 30 CO 0.46 -1.80 1.03 -0.35 0.00 0.00 0.00 175.76 175.10 2dkt n PRO 31 N 5.01 0.49 -0.09 0.00 -0.04 -1.26 0.19 135.00 139.30 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 -1.32 -0.12 0.00 -0.04 0.00 0.00 33.50 32.44 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 -0.15 -5.04 -4.93 0.00 2.03 0.51 -5.00 116.55 103.97 2dkt n ASP 34 Ca 0.00 0.03 -0.20 0.00 0.52 0.00 0.00 54.79 55.15 2dkt n ASP 34 Cb 0.16 -4.12 -0.01 0.00 -0.72 0.00 0.00 41.12 36.43 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 -4.69 2.61 -0.07 -0.67 1.02 -1.16 -4.78 119.74 112.00 2dkt s LYS 35 Ca 0.00 -1.46 0.02 0.00 0.02 0.00 0.00 55.97 54.55 2dkt s LYS 35 Cb 0.00 -2.51 0.01 0.00 -0.52 0.00 0.00 37.83 34.81 2dkt s LYS 35 CO 0.00 -0.28 -0.12 -0.51 -0.92 0.00 0.00 175.35 173.53 2dkt s LEU 36 N -4.24 1.62 0.02 3.17 1.43 -1.26 0.98 118.68 120.39 2dkt s LEU 36 Ca 0.51 -0.29 0.01 0.00 -1.03 0.00 0.00 54.13 53.32 2dkt s LEU 36 Cb -0.06 -0.80 -0.01 0.00 0.03 0.00 0.00 46.19 45.35 2dkt s LEU 36 CO 0.30 0.02 -0.03 -0.31 0.23 0.00 0.00 176.35 176.56 2dkt s TYR 37 N 0.70 0.29 0.03 0.29 1.51 -1.21 -4.98 117.35 113.99 2dkt s TYR 37 Ca -0.14 -0.33 -0.06 0.00 -1.01 0.00 0.00 57.07 55.53 2dkt s TYR 37 Cb -0.16 -0.19 -0.01 0.00 -0.11 0.00 0.00 41.96 41.49 2dkt s TYR 37 CO 0.03 -0.10 0.68 2.41 -1.11 0.00 0.00 175.55 177.47 2dkt n THR 38 N 2.14 -0.14 -4.21 -0.71 -1.04 -1.26 -2.78 114.28 106.28 2dkt n THR 38 Ca -0.19 1.05 -0.11 0.00 -2.04 0.00 0.00 64.05 62.76 2dkt n THR 38 Cb 0.57 -1.35 -0.03 0.00 -1.82 0.00 0.00 70.33 67.70 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 1.01 -0.02 0.00 -0.00 -1.94 -3.14 114.38 110.28 2dkt h ARG 40 Ca -0.13 -0.36 -0.00 0.00 -0.00 0.00 0.00 59.98 59.49 2dkt h ARG 40 Cb 0.51 -0.07 -0.00 0.00 -0.00 0.00 0.00 29.97 30.40 2dkt h ARG 40 CO 0.21 1.04 0.01 -0.07 -0.00 0.00 0.00 179.97 181.16 2dkt h LEU 41 N 0.90 0.03 -0.72 0.08 3.38 -1.96 -3.01 115.31 114.00 2dkt h LEU 41 Ca 0.14 -0.12 0.14 0.00 0.09 0.00 0.00 57.88 58.14 2dkt h LEU 41 Cb 0.64 -0.01 -0.14 0.00 0.09 0.00 0.00 40.66 41.25 2dkt h LEU 41 CO 0.04 0.14 -0.19 0.00 0.09 0.00 0.00 178.44 178.53 2dkt h HIS 43 N -0.01 -0.85 -0.91 0.00 -0.00 -1.49 0.20 115.15 112.08 2dkt h HIS 43 Ca 0.34 0.03 0.15 0.00 -0.00 0.00 0.00 60.37 60.90 2dkt h HIS 43 Cb 0.53 0.38 -0.07 0.00 -0.00 0.00 0.00 27.41 28.25 2dkt h HIS 43 CO -0.58 -0.29 0.59 0.22 -0.00 0.00 0.00 177.93 177.86 2dkt h ASP 44 N -0.31 0.66 -0.46 3.26 1.82 -1.35 0.30 116.42 120.34 2dkt h ASP 44 Ca 0.02 0.05 -0.04 0.00 -0.39 0.00 0.00 57.03 56.67 2dkt h ASP 44 Cb 0.36 -0.08 -0.02 0.00 0.68 0.00 0.00 39.33 40.26 2dkt h ASP 44 CO -0.23 0.31 0.16 0.74 -1.61 0.00 0.00 179.24 178.61 2dkt h THR 45 N 0.68 1.21 -0.41 2.25 2.02 0.52 -2.68 112.91 116.50 2dkt h THR 45 Ca 0.47 -0.70 -0.21 0.00 0.77 0.00 0.00 66.41 66.74 2dkt h THR 45 Cb 0.78 0.64 -0.12 0.00 -1.74 0.00 0.00 68.15 67.71 2dkt h THR 45 CO -0.23 0.27 -0.02 0.59 0.37 0.00 0.00 175.52 176.50 2dkt n ASN 46 N -4.31 2.60 -3.75 4.18 3.02 0.56 -4.98 115.26 112.57 2dkt n ASN 46 Ca 0.04 -3.76 -0.13 0.00 -0.03 0.00 0.00 54.58 50.69 2dkt n ASN 46 Cb 0.19 -0.66 -0.09 0.00 -0.61 0.00 0.00 39.78 38.62 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 -3.25 0.67 0.51 3.52 0.41 0.82 -4.97 118.70 116.41 2dkt s GLU 47 Ca 0.46 -0.17 0.30 0.00 -0.41 0.00 0.00 54.97 55.14 2dkt s GLU 47 Cb 0.41 0.30 1.02 0.00 -1.78 0.00 0.00 34.13 34.08 2dkt s GLU 47 CO 0.01 -0.18 1.86 -0.44 -0.49 0.00 0.00 175.26 176.01 2dkt h ASP 48 N 3.87 0.00 -2.05 -0.19 3.32 -1.87 -3.43 116.42 116.08 2dkt h ASP 48 Ca -0.30 0.00 -0.57 0.00 0.02 0.00 0.00 57.03 56.19 2dkt h ASP 48 Cb 1.18 0.00 -0.10 0.00 0.22 0.00 0.00 39.33 40.63 2dkt h ASP 48 CO 0.40 0.02 -0.63 -1.38 -1.72 0.00 0.00 179.24 175.93 2dkt s HIS 49 N -3.52 2.61 -0.10 4.55 -3.43 -1.26 -5.12 115.29 109.02 2dkt s HIS 49 Ca 0.03 -0.34 -0.08 0.00 -0.80 0.00 0.00 55.06 53.88 2dkt s HIS 49 Cb 0.08 -1.36 -0.04 0.00 -1.43 0.00 0.00 32.58 29.83 2dkt s HIS 49 CO 0.59 0.53 0.17 -1.14 -2.00 0.00 0.00 174.74 172.89 2dkt s GLN 50 N -3.70 3.49 0.12 -0.38 0.74 -1.26 -4.18 119.66 114.48 2dkt s GLN 50 Ca 0.34 -0.08 0.03 0.00 0.05 0.00 0.00 55.36 55.69 2dkt s GLN 50 Cb -0.03 -3.18 -0.04 0.00 1.10 0.00 0.00 33.01 30.85 2dkt s GLN 50 CO 0.20 0.76 0.16 -1.17 -0.55 0.00 0.00 175.29 174.69 2dkt s LEU 51 N -1.11 4.01 0.31 3.68 0.20 -1.26 -5.00 118.68 119.50 2dkt s LEU 51 Ca 0.17 0.04 -0.03 0.00 0.69 0.00 0.00 54.13 54.99 2dkt s LEU 51 Cb -0.13 -2.63 -0.05 0.00 -0.43 0.00 0.00 46.19 42.96 2dkt s LEU 51 CO 0.06 0.12 0.55 -1.81 -0.29 0.00 0.00 176.35 174.98 2dkt s ASP 52 N -2.80 6.39 -0.00 3.68 1.11 -1.26 -4.94 116.67 118.85 2dkt s ASP 52 Ca 0.32 0.64 0.19 0.00 0.18 0.00 0.00 52.55 53.88 2dkt s ASP 52 Cb -0.11 -2.11 -0.22 0.00 1.07 0.00 0.00 42.92 41.54 2dkt s ASP 52 CO 0.25 -0.23 0.75 -2.11 1.18 0.00 0.00 175.17 175.01 2dkt n ARG 53 N -1.21 0.66 -0.10 8.23 1.85 -1.26 -4.38 116.66 120.45 2dkt n ARG 53 Ca -0.03 -0.03 -0.19 0.00 -1.00 0.00 0.00 57.85 56.60 2dkt n ARG 53 Cb 0.55 -1.42 -0.12 0.00 -1.05 0.00 0.00 32.46 30.42 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 -1.57 0.28 -0.12 2.89 3.72 -1.26 -4.42 117.46 116.98 2dkt n PHE 54 Ca 0.02 0.06 -0.05 0.00 -0.05 0.00 0.00 57.45 57.44 2dkt n PHE 54 Cb 0.33 -1.04 0.01 0.00 -0.94 0.00 0.00 39.48 37.85 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 -0.03 -0.05 -7.02 -1.08 1.57 -1.96 -3.41 116.57 104.59 2dkt h LYS 55 Ca -0.55 0.00 -0.47 0.00 -1.87 0.00 0.00 60.65 57.76 2dkt h LYS 55 Cb 1.91 0.01 0.02 0.00 0.08 0.00 0.00 32.23 34.25 2dkt h LYS 55 CO -0.06 -0.03 0.39 0.54 -0.57 0.00 0.00 179.45 179.72 2dkt s VAL 56 N -6.19 3.79 0.00 0.50 0.11 -1.26 -4.96 120.40 112.39 2dkt s VAL 56 Ca -0.14 1.23 0.00 0.00 -2.93 0.00 0.00 61.98 60.13 2dkt s VAL 56 Cb 0.15 -3.56 0.00 0.00 -1.53 0.00 0.00 36.38 31.44 2dkt s VAL 56 CO 0.71 -0.13 0.00 1.17 -3.33 0.00 0.00 175.10 173.51 2dkt n LYS 57 N -0.55 0.06 -1.32 1.54 3.00 -1.26 -4.95 118.16 114.68 2dkt n LYS 57 Ca 0.07 0.00 -0.29 0.00 -0.00 0.00 0.00 58.31 58.09 2dkt n LYS 57 Cb 0.51 -0.68 0.16 0.00 0.00 0.00 0.00 35.03 35.01 2dkt n LYS 57 CO 0.00 0.00 0.00 -1.21 0.00 0.00 0.00 177.40 176.19 2dkt s GLU 58 N -1.37 0.79 0.07 1.64 2.02 -1.26 -2.32 118.70 118.27 2dkt s GLU 58 Ca 0.00 0.45 -0.22 0.00 0.02 0.00 0.00 54.97 55.23 2dkt s GLU 58 Cb 0.00 -1.78 0.05 0.00 0.10 0.00 0.00 34.13 32.50 2dkt s GLU 58 CO 0.00 -2.47 0.52 0.14 0.02 0.00 0.00 175.26 173.47 2dkt s VAL 59 N -3.08 0.03 0.06 2.63 -7.23 -0.95 -3.97 120.40 107.89 2dkt s VAL 59 Ca 0.64 -0.25 0.09 0.00 -1.81 0.00 0.00 61.98 60.65 2dkt s VAL 59 Cb -0.17 -1.00 -0.03 0.00 0.56 0.00 0.00 36.38 35.74 2dkt s VAL 59 CO 0.56 -0.14 -0.24 -1.58 -0.31 0.00 0.00 175.10 173.39 2dkt s GLN 60 N -2.74 1.82 0.34 4.82 0.74 0.66 -2.81 119.66 122.49 2dkt s GLN 60 Ca -0.04 -1.11 -0.15 0.00 0.05 0.00 0.00 55.36 54.12 2dkt s GLN 60 Cb -0.00 -2.02 -0.09 0.00 1.10 0.00 0.00 33.01 31.99 2dkt s GLN 60 CO -0.04 0.51 0.75 0.00 -0.55 0.00 0.00 175.29 175.96 2dkt n ILE 62 N -0.50 0.00 -0.08 0.00 -6.64 -0.90 -3.04 119.36 108.20 2dkt n ILE 62 Ca 0.04 -0.21 -0.17 0.00 -1.77 0.00 0.00 62.75 60.64 2dkt n ILE 62 Cb 0.53 0.79 -0.13 0.00 -1.44 0.00 0.00 39.64 39.40 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 0.02 0.00 7.28 4.21 -1.95 -3.39 115.58 121.76 2dkt h ASN 63 Ca 0.00 -0.84 -0.00 0.00 1.21 0.00 0.00 56.30 56.67 2dkt h ASN 63 Cb 0.42 -0.01 -0.01 0.00 -1.12 0.00 0.00 38.32 37.61 2dkt h ASN 63 CO 0.00 1.18 -0.14 0.00 -1.29 0.00 0.00 177.43 177.18 2dkt n GLU 65 N -1.27 -0.93 -3.33 0.00 1.02 -1.17 -4.86 120.64 110.10 2dkt n GLU 65 Ca 0.16 0.10 -0.31 0.00 -0.02 0.00 0.00 57.16 57.09 2dkt n GLU 65 Cb 0.66 -3.67 -0.05 0.00 -0.02 0.00 0.00 31.44 28.36 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 -5.71 3.76 0.05 3.49 2.47 -1.26 -4.81 119.74 117.74 2dkt s LYS 66 Ca 0.60 0.24 -0.14 0.00 -1.56 0.00 0.00 55.97 55.11 2dkt s LYS 66 Cb -0.35 -2.61 -0.06 0.00 -1.46 0.00 0.00 37.83 33.35 2dkt s LYS 66 CO 0.73 0.25 0.44 -1.17 0.16 0.00 0.00 175.35 175.76 2dkt s LEU 67 N -3.13 4.42 0.23 5.43 2.96 -1.26 -1.49 118.68 125.85 2dkt s LEU 67 Ca 0.47 0.95 -0.21 0.00 -0.22 0.00 0.00 54.13 55.12 2dkt s LEU 67 Cb -0.11 -2.82 0.06 0.00 0.50 0.00 0.00 46.19 43.82 2dkt s LEU 67 CO 0.24 0.25 0.91 0.00 -1.32 0.00 0.00 176.35 176.43 2dkt s GLN 68 N -1.44 1.56 0.39 1.98 0.00 -1.12 -4.94 119.66 116.08 2dkt s GLN 68 Ca 0.29 -0.94 0.08 0.00 -0.00 0.00 0.00 55.36 54.78 2dkt s GLN 68 Cb -0.16 0.47 -0.02 0.00 0.00 0.00 0.00 33.01 33.31 2dkt s GLN 68 CO 0.16 -0.72 0.38 -3.38 0.00 0.00 0.00 175.29 171.73 2dkt s HIS 69 N -2.81 2.80 -0.43 9.60 -3.43 -1.26 -2.24 115.29 117.51 2dkt s HIS 69 Ca 0.16 -0.41 -0.40 0.00 -0.80 0.00 0.00 55.06 53.60 2dkt s HIS 69 Cb -0.03 -2.08 -0.17 0.00 -1.43 0.00 0.00 32.58 28.87 2dkt s HIS 69 CO 0.06 -0.06 1.46 0.00 -2.00 0.00 0.00 174.74 174.20 2dkt n ALA 70 N -1.54 -0.92 -3.45 -1.38 0.00 -0.98 -4.68 120.51 107.56 2dkt n ALA 70 Ca 0.02 0.38 -0.00 0.00 0.00 0.00 0.00 53.44 53.84 2dkt n ALA 70 Cb 0.61 -1.68 0.02 0.00 0.00 0.00 0.00 19.45 18.39 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 4.00 0.61 -0.06 0.00 10.64 -1.26 -5.07 117.38 126.25 2dkt n GLN 71 Ca 0.31 -1.21 -0.06 0.00 -1.83 0.00 0.00 57.00 54.20 2dkt n GLN 71 Cb -0.05 1.52 -0.11 0.00 -0.86 0.00 0.00 30.24 30.75 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 -0.31 1.69 -4.24 2.61 7.27 -1.26 -4.95 117.38 118.19 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 0.33 -1.35 -0.10 0.00 2.41 0.00 0.00 30.24 31.53 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 -2.37 1.18 0.76 1.69 2.01 -1.26 -0.40 115.64 117.25 2dkt s THR 73 Ca -0.07 -1.91 -0.11 0.00 0.31 0.00 0.00 61.69 59.91 2dkt s THR 73 Cb 0.04 -1.69 0.05 0.00 0.01 0.00 0.00 72.50 70.91 2dkt s THR 73 CO 0.56 -0.64 1.08 0.00 -0.69 0.00 0.00 174.62 174.93 2dkt n GLU 75 N -3.39 2.99 0.00 0.00 -0.58 -1.26 -3.32 120.64 115.08 2dkt n GLU 75 Ca 0.08 -2.39 0.00 0.00 -0.42 0.00 0.00 57.16 54.43 2dkt n GLU 75 Cb 0.54 -1.51 0.00 0.00 -0.57 0.00 0.00 31.44 29.90 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 0.37 1.82 -0.00 1.62 -0.08 -1.26 -4.86 116.55 114.16 2dkt n ASP 76 Ca 0.16 0.00 0.02 0.00 -1.51 0.00 0.00 54.79 53.46 2dkt n ASP 76 Cb 0.61 0.05 -0.02 0.00 2.34 0.00 0.00 41.12 44.10 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 -1.27 -6.17 -4.60 0.00 2.88 -1.21 -4.94 113.62 98.31 2dkt n SER 78 Ca 0.00 -0.49 -0.42 0.00 -1.33 0.00 0.00 58.87 56.64 2dkt n SER 78 Cb 0.07 -4.89 -0.05 0.00 -0.75 0.00 0.00 64.21 58.58 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 -3.27 4.82 -0.29 2.46 2.01 -1.26 -4.65 115.64 115.45 2dkt s THR 79 Ca 0.52 1.00 -0.32 0.00 0.31 0.00 0.00 61.69 63.19 2dkt s THR 79 Cb -0.23 -4.13 -0.09 0.00 0.01 0.00 0.00 72.50 68.06 2dkt s THR 79 CO 0.64 -0.28 2.20 -0.11 -0.69 0.00 0.00 174.62 176.38 2dkt n LEU 80 N 6.18 2.61 0.00 4.42 7.94 -1.26 -3.12 117.00 133.76 2dkt n LEU 80 Ca 0.02 0.34 0.06 0.00 -1.11 0.00 0.00 56.01 55.32 2dkt n LEU 80 Cb 0.48 -1.38 0.38 0.00 0.53 0.00 0.00 43.42 43.43 2dkt n LEU 80 CO 0.50 -0.70 0.68 0.49 -1.11 0.00 0.00 177.39 177.25 2dkt n PHE 81 N 10.54 0.00 0.00 1.96 3.72 0.47 -4.59 117.46 129.57 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 0.48 3.82 0.32 1.37 0.00 -1.26 -3.70 105.19 106.22 2dkt n GLY 82 Ca 0.10 -0.54 0.18 0.00 0.00 0.00 0.00 46.02 45.76 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 0.27 -5.01 1.61 5.08 -1.87 -3.36 114.58 111.31 2dkt h GLU 83 Ca 0.00 -0.02 -0.63 0.00 -1.00 0.00 0.00 59.36 57.71 2dkt h GLU 83 Cb 0.00 -0.06 -0.16 0.00 0.50 0.00 0.00 28.75 29.03 2dkt h GLU 83 CO 0.00 0.18 -0.47 -0.47 -1.00 0.00 0.00 179.01 177.25 2dkt s TYR 84 N -5.81 3.26 -0.15 4.33 5.04 -1.04 -4.98 117.35 118.00 2dkt s TYR 84 Ca -0.11 0.21 -0.00 0.00 -2.44 0.00 0.00 57.07 54.72 2dkt s TYR 84 Cb 0.28 -2.37 0.03 0.00 0.35 0.00 0.00 41.96 40.25 2dkt s TYR 84 CO 0.78 -0.09 -0.07 1.52 -1.34 0.00 0.00 175.55 176.35 2dkt s TYR 85 N 1.54 1.72 0.02 4.97 -0.85 -1.26 -2.10 117.35 121.40 2dkt s TYR 85 Ca 0.08 -1.01 -0.09 0.00 -0.52 0.00 0.00 57.07 55.54 2dkt s TYR 85 Cb -0.15 -1.34 -0.05 0.00 0.38 0.00 0.00 41.96 40.80 2dkt s TYR 85 CO 0.09 -0.59 0.33 0.00 -1.52 0.00 0.00 175.55 173.85 2dkt n SER 87 N 1.22 0.77 0.03 0.00 7.64 -1.26 -2.73 113.62 119.29 2dkt n SER 87 Ca -0.11 0.04 -0.10 0.00 1.01 0.00 0.00 58.87 59.71 2dkt n SER 87 Cb 0.53 0.36 -0.08 0.00 -1.01 0.00 0.00 64.21 64.01 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 0.92 0.00 0.44 2.04 -1.94 -3.31 117.51 115.65 2dkt h ILE 88 Ca -0.51 -1.25 0.00 0.00 1.00 0.00 0.00 64.86 64.10 2dkt h ILE 88 Cb 2.11 1.57 0.00 0.00 -0.74 0.00 0.00 36.82 39.77 2dkt h ILE 88 CO 0.01 0.25 -0.32 0.00 0.00 0.00 0.00 178.15 178.09 2dkt n HIS 90 N -2.80 -2.49 -4.19 0.00 8.25 -1.10 -4.46 115.22 108.42 2dkt n HIS 90 Ca 0.03 0.85 -0.28 0.00 -0.26 0.00 0.00 57.72 58.06 2dkt n HIS 90 Cb 0.52 -4.61 -0.08 0.00 1.12 0.00 0.00 29.99 26.93 2dkt n HIS 90 CO 0.00 0.00 0.00 -1.17 0.64 0.00 0.00 176.34 175.81 2dkt s LEU 91 N -6.66 3.31 -0.18 2.41 0.20 -1.23 -4.92 118.68 111.62 2dkt s LEU 91 Ca 0.49 -0.34 -0.02 0.00 0.69 0.00 0.00 54.13 54.95 2dkt s LEU 91 Cb -0.22 -2.01 0.06 0.00 -0.43 0.00 0.00 46.19 43.59 2dkt s LEU 91 CO 0.61 0.12 0.02 -0.36 -0.29 0.00 0.00 176.35 176.45 2dkt s PHE 92 N -1.54 1.11 -0.05 5.38 0.08 -1.26 -1.02 117.98 120.68 2dkt s PHE 92 Ca 0.26 -0.85 0.03 0.00 0.12 0.00 0.00 56.93 56.49 2dkt s PHE 92 Cb -0.10 -1.05 0.01 0.00 -0.57 0.00 0.00 43.02 41.30 2dkt s PHE 92 CO 0.18 -0.59 -0.14 0.34 -0.10 0.00 0.00 175.22 174.91 2dkt s ASP 93 N 1.83 1.88 1.10 1.36 2.15 -0.89 -4.13 116.67 119.97 2dkt s ASP 93 Ca -0.01 -0.31 -0.17 0.00 0.43 0.00 0.00 52.55 52.49 2dkt s ASP 93 Cb -0.17 -0.70 0.15 0.00 -0.30 0.00 0.00 42.92 41.91 2dkt s ASP 93 CO -0.08 0.09 0.19 2.29 -0.17 0.00 0.00 175.17 177.49 2dkt n LYS 94 N 3.49 -2.17 -1.73 4.34 2.85 -1.14 -2.50 118.16 121.30 2dkt n LYS 94 Ca -0.20 -0.63 -0.20 0.00 -1.05 0.00 0.00 58.31 56.22 2dkt n LYS 94 Cb 0.53 -1.61 -0.06 0.00 -0.65 0.00 0.00 35.03 33.23 2dkt n LYS 94 CO 0.00 0.00 0.00 0.16 -0.05 0.00 0.00 177.40 177.51 2dkt s ASP 95 N -1.99 4.36 -0.30 -5.58 1.47 -1.26 -4.61 116.67 108.76 2dkt s ASP 95 Ca 0.48 -0.07 0.16 0.00 1.18 0.00 0.00 52.55 54.31 2dkt s ASP 95 Cb -0.09 -2.55 0.48 0.00 -0.34 0.00 0.00 42.92 40.42 2dkt s ASP 95 CO 0.52 -3.40 1.11 1.17 0.68 0.00 0.00 175.17 175.24 2dkt n LYS 96 N 8.86 2.34 -3.91 2.11 4.81 -1.26 -4.98 118.16 126.13 2dkt n LYS 96 Ca 0.43 -3.75 -0.29 0.00 -0.87 0.00 0.00 58.31 53.83 2dkt n LYS 96 Cb 0.46 -1.80 -0.00 0.00 0.02 0.00 0.00 35.03 33.70 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 -0.53 -2.41 -3.84 1.64 3.00 -1.26 -4.76 116.66 108.50 2dkt n ARG 97 Ca 0.21 0.38 -0.36 0.00 -0.00 0.00 0.00 57.85 58.08 2dkt n ARG 97 Cb 0.84 -4.22 -0.13 0.00 0.00 0.00 0.00 32.46 28.94 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 -6.51 2.95 0.09 -0.14 0.74 -1.26 -0.37 119.66 115.16 2dkt s GLN 98 Ca 0.16 -0.93 0.06 0.00 0.05 0.00 0.00 55.36 54.70 2dkt s GLN 98 Cb -0.07 -3.22 -0.04 0.00 1.10 0.00 0.00 33.01 30.78 2dkt s GLN 98 CO 0.89 -0.44 -0.04 1.52 -0.55 0.00 0.00 175.29 176.67 2dkt s TYR 99 N 1.42 2.89 -0.11 1.67 -0.85 0.20 -4.93 117.35 117.64 2dkt s TYR 99 Ca 0.01 -0.07 -0.04 0.00 -0.52 0.00 0.00 57.07 56.45 2dkt s TYR 99 Cb -0.17 -1.50 -0.03 0.00 0.38 0.00 0.00 41.96 40.63 2dkt s TYR 99 CO -0.00 0.46 0.03 -1.58 -1.52 0.00 0.00 175.55 172.93 2dkt s HIS 100 N -1.26 3.22 -0.12 -3.49 5.65 -1.26 -0.32 115.29 117.71 2dkt s HIS 100 Ca 0.24 0.18 -0.11 0.00 0.25 0.00 0.00 55.06 55.61 2dkt s HIS 100 Cb -0.11 -1.87 -0.05 0.00 -1.18 0.00 0.00 32.58 29.37 2dkt s HIS 100 CO 0.16 0.41 0.25 0.00 -0.65 0.00 0.00 174.74 174.91 2dkt h GLU 102 N 5.74 0.44 -0.42 0.00 5.08 -1.95 0.15 114.58 123.61 2dkt h GLU 102 Ca -0.48 -0.74 0.00 0.00 -1.00 0.00 0.00 59.36 57.14 2dkt h GLU 102 Cb 1.19 0.28 -0.02 0.00 0.50 0.00 0.00 28.75 30.70 2dkt h GLU 102 CO 0.67 1.35 0.27 1.03 -1.00 0.00 0.00 179.01 181.33 2dkt h SER 103 N 0.12 0.48 0.08 1.42 0.87 -1.97 -2.76 113.55 111.80 2dkt h SER 103 Ca -0.30 -0.01 -0.24 0.00 -1.23 0.00 0.00 61.79 60.00 2dkt h SER 103 Cb 2.12 -0.12 -0.04 0.00 -0.44 0.00 0.00 62.40 63.91 2dkt h SER 103 CO 0.21 0.35 -2.16 0.00 -0.53 0.00 0.00 176.83 174.71 2dkt n GLY 105 N 1.56 0.71 3.22 0.00 0.00 0.49 -5.02 105.19 106.15 2dkt n GLY 105 Ca -0.22 -0.69 -0.13 0.00 0.00 0.00 0.00 46.02 44.98 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 -2.29 1.03 0.32 -0.61 -4.36 -1.08 -4.66 121.20 109.55 2dkt s ILE 106 Ca 0.00 -1.96 -0.16 0.00 -0.26 0.00 0.00 60.65 58.27 2dkt s ILE 106 Cb 0.00 -1.72 -0.09 0.00 1.25 0.00 0.00 42.46 41.90 2dkt s ILE 106 CO 0.00 -0.74 0.76 0.00 0.24 0.00 0.00 174.94 175.20 2dkt s ARG 108 N -2.87 0.75 0.16 0.00 0.52 0.56 -4.91 118.95 113.15 2dkt s ARG 108 Ca 0.54 0.01 -0.29 0.00 -0.52 0.00 0.00 55.73 55.46 2dkt s ARG 108 Cb -0.11 0.34 -0.07 0.00 0.52 0.00 0.00 34.95 35.63 2dkt s ARG 108 CO 0.17 -0.21 0.93 0.42 0.02 0.00 0.00 175.30 176.64 2dkt s ILE 109 N -1.13 4.35 0.00 1.52 -1.09 -1.26 -0.63 121.20 122.96 2dkt s ILE 109 Ca -0.12 2.04 0.00 0.00 -2.23 0.00 0.00 60.65 60.34 2dkt s ILE 109 Cb -0.04 -4.31 0.00 0.00 -1.58 0.00 0.00 42.46 36.54 2dkt s ILE 109 CO 0.05 0.40 0.00 0.61 -1.23 0.00 0.00 174.94 174.77 2dkt n GLY 110 N 1.95 1.30 3.71 6.18 0.00 0.51 -4.81 105.19 114.02 2dkt n GLY 110 Ca 0.00 -1.14 -0.42 0.00 0.00 0.00 0.00 46.02 44.46 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 3.14 4.32 0.36 1.61 0.04 -1.26 -5.00 135.00 138.20 2dkt s PRO 111 Ca 0.00 2.03 0.23 0.00 0.04 0.00 0.00 61.00 63.31 2dkt s PRO 111 Cb 0.00 -3.34 1.25 0.00 0.04 0.00 0.00 34.50 32.45 2dkt s PRO 111 CO 0.00 -0.47 1.40 1.17 0.04 0.00 0.00 177.00 179.14 2dkt n LYS 112 N 4.34 -0.04 -0.13 4.56 3.00 -1.26 0.25 118.16 128.87 2dkt n LYS 112 Ca 0.12 1.18 -0.08 0.00 -0.00 0.00 0.00 58.31 59.52 2dkt n LYS 112 Cb 0.43 -2.20 -0.03 0.00 0.00 0.00 0.00 35.03 33.23 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 -0.26 -1.35 1.64 5.08 -2.00 0.28 114.58 117.96 2dkt h GLU 113 Ca 0.77 0.02 -0.11 0.00 -1.00 0.00 0.00 59.36 59.03 2dkt h GLU 113 Cb 2.23 0.06 -0.06 0.00 0.50 0.00 0.00 28.75 31.48 2dkt h GLU 113 CO -0.57 -0.18 0.14 -0.25 -1.00 0.00 0.00 179.01 177.16 2dkt n ASP 114 N -5.42 4.30 -3.91 1.42 8.00 0.14 -4.82 116.55 116.26 2dkt n ASP 114 Ca 0.01 -2.46 -0.09 0.00 0.71 0.00 0.00 54.79 52.95 2dkt n ASP 114 Cb 0.35 -0.80 -0.04 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 -0.67 0.14 0.33 1.24 0.40 0.97 -2.81 117.98 117.59 2dkt s PHE 115 Ca 0.11 -0.52 -0.18 0.00 -0.60 0.00 0.00 56.93 55.74 2dkt s PHE 115 Cb 0.09 0.32 0.05 0.00 0.51 0.00 0.00 43.02 43.99 2dkt s PHE 115 CO 0.01 -1.01 0.79 -0.59 0.70 0.00 0.00 175.22 175.12 2dkt s PHE 116 N -3.96 0.00 -0.08 0.36 -0.12 0.09 -4.67 117.98 109.61 2dkt s PHE 116 Ca 0.17 -0.58 0.01 0.00 -0.05 0.00 0.00 56.93 56.48 2dkt s PHE 116 Cb -0.02 0.78 0.02 0.00 -0.63 0.00 0.00 43.02 43.18 2dkt s PHE 116 CO 0.05 -1.39 -0.09 -1.58 -0.05 0.00 0.00 175.22 172.16 2dkt s HIS 117 N -2.88 1.30 -0.11 3.49 5.65 -1.26 -0.15 115.29 121.32 2dkt s HIS 117 Ca 0.14 -0.53 -0.22 0.00 0.25 0.00 0.00 55.06 54.71 2dkt s HIS 117 Cb -0.05 -1.04 -0.03 0.00 -1.18 0.00 0.00 32.58 30.28 2dkt s HIS 117 CO 0.09 -0.34 0.65 0.00 -0.65 0.00 0.00 174.74 174.48 2dkt h LEU 119 N 7.19 -0.77 -0.08 0.00 3.38 -1.97 -1.18 115.31 121.87 2dkt h LEU 119 Ca -0.38 0.03 0.01 0.00 0.09 0.00 0.00 57.88 57.63 2dkt h LEU 119 Cb 1.18 0.20 -0.02 0.00 0.09 0.00 0.00 40.66 42.11 2dkt h LEU 119 CO 0.76 -0.44 -0.13 0.50 0.09 0.00 0.00 178.44 179.22 2dkt h LYS 120 N -1.12 -0.10 -1.05 1.13 3.11 -1.97 -0.18 116.57 116.39 2dkt h LYS 120 Ca -0.09 0.01 0.27 0.00 -2.81 0.00 0.00 60.65 58.03 2dkt h LYS 120 Cb 0.70 0.02 -0.11 0.00 -1.00 0.00 0.00 32.23 31.84 2dkt h LYS 120 CO 0.15 -0.07 0.66 0.00 -2.81 0.00 0.00 179.45 177.38 2dkt n ASN 122 N -4.72 -3.10 -3.75 0.00 2.85 -0.08 -5.02 115.26 101.44 2dkt n ASN 122 Ca 0.27 -0.17 -0.08 0.00 -0.11 0.00 0.00 54.58 54.49 2dkt n ASN 122 Cb 0.88 -1.92 -0.02 0.00 1.24 0.00 0.00 39.78 39.96 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 -3.05 -0.10 0.06 1.20 0.05 -1.13 -4.92 118.68 110.79 2dkt s LEU 123 Ca 0.15 -0.75 -0.15 0.00 0.05 0.00 0.00 54.13 53.43 2dkt s LEU 123 Cb -0.06 2.55 -0.06 0.00 -2.05 0.00 0.00 46.19 46.57 2dkt s LEU 123 CO 0.23 -1.36 0.47 0.00 -0.55 0.00 0.00 176.35 175.14 2dkt s LEU 125 N -1.42 1.42 0.42 0.00 1.43 0.78 -4.93 118.68 116.38 2dkt s LEU 125 Ca 0.29 0.16 -0.24 0.00 -1.03 0.00 0.00 54.13 53.31 2dkt s LEU 125 Cb -0.16 0.61 -0.08 0.00 0.03 0.00 0.00 46.19 46.58 2dkt s LEU 125 CO 0.17 -0.16 1.17 0.28 0.23 0.00 0.00 176.35 178.03 2dkt s THR 126 N -0.39 3.14 0.33 5.49 -1.32 -1.26 -0.73 115.64 120.90 2dkt s THR 126 Ca -0.05 0.91 0.11 0.00 -1.21 0.00 0.00 61.69 61.46 2dkt s THR 126 Cb -0.03 -3.49 0.33 0.00 -1.51 0.00 0.00 72.50 67.80 2dkt s THR 126 CO 0.01 0.04 1.65 0.71 -2.21 0.00 0.00 174.62 174.82 2dkt h THR 127 N 2.14 0.26 -1.03 5.08 1.35 -1.79 0.28 112.91 119.20 2dkt h THR 127 Ca -0.49 -0.08 0.39 0.00 -0.55 0.00 0.00 66.41 65.68 2dkt h THR 127 Cb 1.24 -0.01 -0.17 0.00 -1.73 0.00 0.00 68.15 67.49 2dkt h THR 127 CO 0.62 0.04 0.58 -1.13 -0.25 0.00 0.00 175.52 175.38 2dkt h ASN 128 N 0.25 0.37 -0.72 5.36 -1.24 -1.91 1.27 115.58 118.97 2dkt h ASN 128 Ca 0.69 0.23 -0.47 0.00 0.71 0.00 0.00 56.30 57.45 2dkt h ASN 128 Cb 1.55 0.22 -0.21 0.00 0.73 0.00 0.00 38.32 40.61 2dkt h ASN 128 CO -0.65 -0.32 0.61 0.18 -1.29 0.00 0.00 177.43 175.95 2dkt n LEU 129 N -5.14 6.88 -4.56 0.34 4.77 1.00 -4.82 117.00 115.46 2dkt n LEU 129 Ca 0.36 -3.66 -0.43 0.00 -0.03 0.00 0.00 56.01 52.25 2dkt n LEU 129 Cb 1.22 -0.99 -0.01 0.00 -2.33 0.00 0.00 43.42 41.31 2dkt n LEU 129 CO 0.05 1.28 1.81 -0.60 -1.33 0.00 0.00 177.39 178.61 2dkt s ARG 130 N -2.69 3.93 0.00 3.23 6.06 0.44 -4.02 118.95 125.90 2dkt s ARG 130 Ca 0.46 -1.93 0.00 0.00 -2.50 0.00 0.00 55.73 51.75 2dkt s ARG 130 Cb 0.36 -5.44 0.00 0.00 0.06 0.00 0.00 34.95 29.93 2dkt s ARG 130 CO 0.00 -2.18 0.00 0.41 -2.50 0.00 0.00 175.30 171.03 2dkt n GLY 131 N 5.47 3.32 0.32 8.12 0.00 -1.26 -4.91 105.19 116.25 2dkt n GLY 131 Ca 0.45 -0.94 0.20 0.00 0.00 0.00 0.00 46.02 45.73 2dkt n GLY 131 CO 0.00 0.00 0.00 1.70 0.00 0.00 0.00 173.32 175.02 2dkt h LYS 132 N 0.00 0.20 -6.89 1.61 3.64 -1.88 -3.39 116.57 109.85 2dkt h LYS 132 Ca 0.00 -0.01 -0.52 0.00 -1.27 0.00 0.00 60.65 58.84 2dkt h LYS 132 Cb 0.00 -0.04 0.07 0.00 -0.41 0.00 0.00 32.23 31.85 2dkt h LYS 132 CO 0.00 0.13 0.66 -3.38 -2.27 0.00 0.00 179.45 174.59 2dkt s HIS 133 N -5.77 2.98 -0.28 1.91 -3.43 -1.26 -5.01 115.29 104.43 2dkt s HIS 133 Ca -0.11 1.38 -0.04 0.00 -0.80 0.00 0.00 55.06 55.49 2dkt s HIS 133 Cb 0.29 -3.73 0.03 0.00 -1.43 0.00 0.00 32.58 27.74 2dkt s HIS 133 CO 0.78 -2.02 0.02 0.21 -2.00 0.00 0.00 174.74 171.73 2dkt s LYS 134 N -1.84 2.81 0.98 -0.38 2.20 -1.26 -5.06 119.74 117.18 2dkt s LYS 134 Ca 0.49 -1.02 -0.13 0.00 -0.36 0.00 0.00 55.97 54.96 2dkt s LYS 134 Cb -0.41 -3.21 0.20 0.00 -1.51 0.00 0.00 37.83 32.90 2dkt s LYS 134 CO 0.54 -0.49 0.44 0.00 -0.36 0.00 0.00 175.35 175.48 2dkt n ILE 136 N -4.43 0.00 -0.07 0.00 2.08 -1.26 -4.97 119.36 110.70 2dkt n ILE 136 Ca 0.07 -0.07 -0.07 0.00 0.56 0.00 0.00 62.75 63.24 2dkt n ILE 136 Cb 0.31 -0.35 -0.03 0.00 -0.75 0.00 0.00 39.64 38.81 2dkt n ILE 136 CO 0.00 0.00 0.00 -0.33 0.56 0.00 0.00 176.55 176.78 2dkt h GLU 137 N -2.19 0.00 -3.11 0.38 5.08 -1.85 -3.49 114.58 109.40 2dkt h GLU 137 Ca -0.28 0.00 -0.16 0.00 -1.00 0.00 0.00 59.36 57.92 2dkt h GLU 137 Cb 0.85 0.00 -0.25 0.00 0.50 0.00 0.00 28.75 29.84 2dkt h GLU 137 CO 0.18 0.20 -0.41 0.45 -1.00 0.00 0.00 179.01 178.42 2dkt s SER 138 N -5.91 -0.27 0.71 1.42 0.15 -1.26 -5.12 113.70 103.42 2dkt s SER 138 Ca -0.15 0.52 0.00 0.00 0.70 0.00 0.00 55.95 57.02 2dkt s SER 138 Cb 0.02 0.53 0.00 0.00 -1.71 0.00 0.00 66.02 64.86 2dkt s SER 138 CO 0.26 -0.09 0.00 0.61 1.20 0.00 0.00 173.24 175.22 2dkt n GLY 139 N 2.93 0.99 0.51 9.45 0.00 -1.26 -4.58 105.19 113.23 2dkt n GLY 139 Ca -0.13 -0.60 -0.04 0.00 0.00 0.00 0.00 46.02 45.25 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 0.02 -1.34 -1.44 1.61 -0.04 -1.26 -4.80 135.00 127.74 2dkt n PRO 140 Ca 0.00 -0.26 -0.49 0.00 -0.04 0.00 0.00 63.50 62.71 2dkt n PRO 140 Cb 0.00 -0.24 -0.08 0.00 -0.04 0.00 0.00 33.50 33.14 2dkt n PRO 140 CO 0.00 0.00 0.00 0.45 -0.04 0.00 0.00 175.50 175.91 2dkt n SER 141 N -3.28 1.78 -3.65 3.54 2.88 -1.26 -4.86 113.62 108.77 2dkt n SER 141 Ca 0.02 0.31 -0.06 0.00 -1.33 0.00 0.00 58.87 57.81 2dkt n SER 141 Cb 0.09 -1.22 -0.07 0.00 -0.75 0.00 0.00 64.21 62.26 2dkt n SER 141 CO 0.00 0.00 0.00 -0.44 -1.23 0.00 0.00 175.04 173.37 2dkt s SER 142 N 7.93 -0.91 0.00 -3.46 0.01 -1.26 -5.14 113.70 110.87 2dkt s SER 142 Ca 1.13 1.44 0.00 0.00 1.31 0.00 0.00 55.95 59.83 2dkt s SER 142 Cb -0.90 1.47 0.00 0.00 0.21 0.00 0.00 66.02 66.80 2dkt s SER 142 CO 0.48 -0.23 0.00 0.61 0.41 0.00 0.00 173.24 174.51