#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2dcq n SER 2 N 0.00 0.00 -4.60 1.61 2.88 -1.26 -5.15 113.62 107.10 2dcq n SER 2 Ca 0.00 -0.71 -0.29 0.00 -1.33 0.00 0.00 58.87 56.55 2dcq n SER 2 Cb 0.00 0.00 0.19 0.00 -0.75 0.00 0.00 64.21 63.65 2dcq n SER 2 CO 0.00 0.00 0.00 -0.55 -1.23 0.00 0.00 175.04 173.26 2dcq s SER 3 N -0.30 2.32 -1.12 -3.46 0.15 -1.26 -4.67 113.70 105.35 2dcq s SER 3 Ca 0.00 1.12 -0.06 0.00 0.70 0.00 0.00 55.95 57.71 2dcq s SER 3 Cb 0.00 -1.76 -0.04 0.00 -1.71 0.00 0.00 66.02 62.51 2dcq s SER 3 CO 0.00 -3.31 0.89 0.61 1.20 0.00 0.00 173.24 172.63 2dcq n GLY 4 N -1.01 -0.87 3.41 9.45 0.00 -1.26 -5.04 105.19 109.87 2dcq n GLY 4 Ca 0.05 0.41 -0.11 0.00 0.00 0.00 0.00 46.02 46.38 2dcq n GLY 4 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2dcq s SER 5 N -3.72 0.12 0.26 1.61 1.04 -1.26 -5.13 113.70 106.63 2dcq s SER 5 Ca 0.31 -1.19 -0.31 0.00 0.48 0.00 0.00 55.95 55.25 2dcq s SER 5 Cb -0.06 0.50 -0.12 0.00 0.10 0.00 0.00 66.02 66.45 2dcq s SER 5 CO 0.76 -1.02 1.66 -0.94 0.98 0.00 0.00 173.24 174.68 2dcq s SER 6 N -3.10 6.35 0.75 7.02 1.04 -1.26 -4.61 113.70 119.89 2dcq s SER 6 Ca 0.31 2.94 -0.03 0.00 0.48 0.00 0.00 55.95 59.65 2dcq s SER 6 Cb 0.03 -2.62 0.13 0.00 0.10 0.00 0.00 66.02 63.66 2dcq s SER 6 CO 0.12 -0.96 1.04 -0.83 0.98 0.00 0.00 173.24 173.59 2dcq s GLY 7 N 0.79 1.76 0.39 7.32 0.00 -0.68 -4.84 107.32 112.06 2dcq s GLY 7 Ca 0.68 -1.63 -0.07 0.00 0.00 0.00 0.00 44.72 43.70 2dcq s GLY 7 CO 0.42 -1.05 0.43 1.44 0.00 0.00 0.00 173.10 174.34 2dcq n SER 8 N -2.96 -0.71 0.00 1.64 7.64 -1.26 -0.67 113.62 117.30 2dcq n SER 8 Ca 0.15 -0.94 0.00 0.00 1.01 0.00 0.00 58.87 59.09 2dcq n SER 8 Cb 0.60 -0.36 0.00 0.00 -1.01 0.00 0.00 64.21 63.45 2dcq n SER 8 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 2dcq n ALA 9 N -3.49 -0.05 -0.31 -0.43 0.00 -1.26 -3.50 120.51 111.47 2dcq n ALA 9 Ca -0.07 0.00 0.29 0.00 0.00 0.00 0.00 53.44 53.65 2dcq n ALA 9 Cb 0.21 0.00 0.63 0.00 0.00 0.00 0.00 19.45 20.29 2dcq n ALA 9 CO 0.00 0.00 0.00 0.87 0.00 0.00 0.00 177.50 178.37 2dcq h LYS 10 N 0.00 0.18 -0.67 0.00 1.79 -1.87 -0.66 116.57 115.33 2dcq h LYS 10 Ca 0.00 -0.01 0.14 0.00 -2.18 0.00 0.00 60.65 58.59 2dcq h LYS 10 Cb 0.00 -0.04 -0.13 0.00 -1.58 0.00 0.00 32.23 30.48 2dcq h LYS 10 CO 0.00 0.12 -0.16 -0.97 -1.08 0.00 0.00 179.45 177.36 2dcq h ASN 11 N 0.19 -0.61 0.42 0.86 -0.00 -1.96 0.10 115.58 114.59 2dcq h ASN 11 Ca 0.57 0.20 -0.02 0.00 -0.00 0.00 0.00 56.30 57.05 2dcq h ASN 11 Cb 1.85 0.41 0.00 0.00 -0.00 0.00 0.00 38.32 40.58 2dcq h ASN 11 CO -0.15 -0.22 -0.20 0.00 -0.00 0.00 0.00 177.43 176.86 2dcq h ALA 12 N 1.67 -0.56 -0.93 1.57 0.00 -1.15 -3.21 119.26 116.65 2dcq h ALA 12 Ca 0.33 -0.19 0.14 0.00 0.00 0.00 0.00 54.91 55.18 2dcq h ALA 12 Cb 0.50 0.22 -0.08 0.00 0.00 0.00 0.00 17.79 18.43 2dcq h ALA 12 CO -0.69 -0.63 0.59 -0.92 0.00 0.00 0.00 179.25 177.60 2dcq h TYR 13 N -0.93 0.94 -0.53 0.00 3.20 -1.55 -1.31 116.97 116.79 2dcq h TYR 13 Ca -0.06 0.03 0.10 0.00 3.14 0.00 0.00 58.73 61.94 2dcq h TYR 13 Cb 0.56 -0.29 -0.08 0.00 1.54 0.00 0.00 36.73 38.45 2dcq h TYR 13 CO 0.02 0.35 0.03 1.15 -1.64 0.00 0.00 178.16 178.07 2dcq h THR 14 N 0.80 0.61 0.01 1.81 2.02 -0.80 -2.64 112.91 114.71 2dcq h THR 14 Ca 0.47 -0.05 -0.00 0.00 0.77 0.00 0.00 66.41 67.60 2dcq h THR 14 Cb 0.65 0.45 0.00 0.00 -1.74 0.00 0.00 68.15 67.50 2dcq h THR 14 CO -0.23 0.03 -0.01 0.11 0.37 0.00 0.00 175.52 175.79 2dcq h LYS 15 N 0.15 -0.01 -1.09 6.66 1.79 -1.24 -2.45 116.57 120.37 2dcq h LYS 15 Ca 0.27 0.00 0.30 0.00 -2.18 0.00 0.00 60.65 59.04 2dcq h LYS 15 Cb 0.41 0.00 -0.08 0.00 -1.58 0.00 0.00 32.23 30.99 2dcq h LYS 15 CO -0.42 0.17 0.74 -0.07 -1.08 0.00 0.00 179.45 178.78 2dcq h LEU 16 N -0.19 0.26 -1.13 2.94 4.07 -1.34 0.73 115.31 120.65 2dcq h LEU 16 Ca -0.00 0.05 0.00 0.00 0.08 0.00 0.00 57.88 58.01 2dcq h LEU 16 Cb 0.19 0.01 0.00 0.00 1.08 0.00 0.00 40.66 41.94 2dcq h LEU 16 CO 0.00 0.04 0.00 0.61 -1.08 0.00 0.00 178.44 178.01 2dcq n GLY 17 N -1.59 0.35 0.00 0.83 0.00 -0.93 -3.79 105.19 100.06 2dcq n GLY 17 Ca 0.25 -0.40 0.00 0.00 0.00 0.00 0.00 46.02 45.87 2dcq n GLY 17 CO 0.00 0.00 0.00 -0.37 0.00 0.00 0.00 173.32 172.95 2dcq n THR 18 N 0.35 0.00 -3.79 2.61 5.66 0.01 -4.97 114.28 114.16 2dcq n THR 18 Ca 0.15 -0.11 -0.35 0.00 -3.05 0.00 0.00 64.05 60.70 2dcq n THR 18 Cb 0.32 0.55 -0.11 0.00 -1.55 0.00 0.00 70.33 69.54 2dcq n THR 18 CO 0.00 0.00 0.00 -1.81 -3.05 0.00 0.00 175.07 170.21 2dcq s ASP 19 N -1.17 4.98 0.41 1.09 1.01 0.04 -4.94 116.67 118.09 2dcq s ASP 19 Ca 0.00 -2.87 0.29 0.00 0.71 0.00 0.00 52.55 50.68 2dcq s ASP 19 Cb 0.00 -1.79 1.42 0.00 1.01 0.00 0.00 42.92 43.56 2dcq s ASP 19 CO 0.00 -0.34 1.87 0.44 0.21 0.00 0.00 175.17 177.36 2dcq h ASP 20 N 6.92 0.00 0.83 0.27 3.32 -1.86 -0.82 116.42 125.08 2dcq h ASP 20 Ca -0.04 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.01 2dcq h ASP 20 Cb 0.94 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.49 2dcq h ASP 20 CO 0.70 0.00 -0.83 0.78 -1.72 0.00 0.00 179.24 178.17 2dcq h ASN 21 N 0.00 0.00 -3.89 6.45 2.35 -1.92 -3.48 115.58 115.09 2dcq h ASN 21 Ca 0.00 -0.17 -0.46 0.00 -0.55 0.00 0.00 56.30 55.12 2dcq h ASN 21 Cb 0.16 0.00 0.16 0.00 0.05 0.00 0.00 38.32 38.69 2dcq h ASN 21 CO 0.00 0.08 0.20 0.00 -1.65 0.00 0.00 177.43 176.06 2dcq s ALA 22 N -3.24 1.01 0.30 -0.83 0.00 -0.31 -4.06 121.76 114.62 2dcq s ALA 22 Ca 0.03 -0.28 -0.03 0.00 0.00 0.00 0.00 51.96 51.68 2dcq s ALA 22 Cb 0.12 -3.14 -0.01 0.00 0.00 0.00 0.00 23.12 20.09 2dcq s ALA 22 CO 0.76 -2.79 0.39 -0.65 0.00 0.00 0.00 175.76 173.47 2dcq s GLN 23 N -4.93 1.69 -0.09 0.00 -1.52 -0.16 -4.90 119.66 109.74 2dcq s GLN 23 Ca 0.65 -1.66 0.01 0.00 -1.95 0.00 0.00 55.36 52.41 2dcq s GLN 23 Cb -0.19 0.40 0.02 0.00 -0.22 0.00 0.00 33.01 33.02 2dcq s GLN 23 CO 0.58 -0.67 -0.11 -1.17 -0.25 0.00 0.00 175.29 173.67 2dcq s LEU 24 N -3.19 1.49 -0.46 2.90 1.98 -1.26 -1.72 118.68 118.41 2dcq s LEU 24 Ca 0.32 -0.32 -0.03 0.00 -2.89 0.00 0.00 54.13 51.20 2dcq s LEU 24 Cb 0.01 -0.88 0.12 0.00 0.66 0.00 0.00 46.19 46.10 2dcq s LEU 24 CO 0.17 -0.03 0.27 -0.22 -1.89 0.00 0.00 176.35 174.65 2dcq s LEU 25 N 1.12 5.27 -0.59 -0.68 1.98 -0.46 -1.49 118.68 123.84 2dcq s LEU 25 Ca -0.06 -2.22 -0.28 0.00 -2.89 0.00 0.00 54.13 48.68 2dcq s LEU 25 Cb -0.14 -1.84 0.02 0.00 0.66 0.00 0.00 46.19 44.88 2dcq s LEU 25 CO -0.02 -0.51 1.39 -0.62 -1.89 0.00 0.00 176.35 174.70 2dcq s ASP 26 N 1.60 6.14 0.00 3.68 -1.08 0.29 -0.90 116.67 126.40 2dcq s ASP 26 Ca 0.10 0.18 0.20 0.00 -0.52 0.00 0.00 52.55 52.51 2dcq s ASP 26 Cb -0.22 -2.55 0.56 0.00 -1.46 0.00 0.00 42.92 39.25 2dcq s ASP 26 CO -0.04 -1.72 1.45 2.30 0.52 0.00 0.00 175.17 177.68 2dcq n ILE 27 N 6.79 0.42 -1.48 4.11 -5.35 -0.30 -0.95 119.36 122.61 2dcq n ILE 27 Ca 0.11 -0.56 -0.33 0.00 -0.27 0.00 0.00 62.75 61.70 2dcq n ILE 27 Cb 0.49 0.55 0.08 0.00 -1.74 0.00 0.00 39.64 39.03 2dcq n ILE 27 CO 0.00 0.00 0.00 -0.13 -1.76 0.00 0.00 176.55 174.66 2dcq s ARG 28 N -1.58 2.32 0.77 6.28 0.52 -1.24 -3.20 118.95 122.84 2dcq s ARG 28 Ca 0.34 1.51 -0.15 0.00 -0.52 0.00 0.00 55.73 56.92 2dcq s ARG 28 Cb 0.19 -1.88 0.02 0.00 0.52 0.00 0.00 34.95 33.80 2dcq s ARG 28 CO 0.27 -1.64 0.90 0.00 0.02 0.00 0.00 175.30 174.85 2dcq n ALA 29 N -2.84 -0.66 -0.09 2.13 0.00 -1.26 -4.04 120.51 113.75 2dcq n ALA 29 Ca 0.11 -0.29 0.02 0.00 0.00 0.00 0.00 53.44 53.28 2dcq n ALA 29 Cb 0.51 -2.07 0.33 0.00 0.00 0.00 0.00 19.45 18.22 2dcq n ALA 29 CO 0.00 0.00 0.00 1.15 0.00 0.00 0.00 177.50 178.65 2dcq h THR 30 N -0.62 1.16 0.00 0.00 2.02 -1.98 0.11 112.91 113.60 2dcq h THR 30 Ca -0.46 -0.37 0.00 0.00 0.77 0.00 0.00 66.41 66.35 2dcq h THR 30 Cb 1.32 0.42 0.00 0.00 -1.74 0.00 0.00 68.15 68.15 2dcq h THR 30 CO 0.44 0.17 0.00 0.00 0.37 0.00 0.00 175.52 176.50 2dcq h ALA 31 N 1.61 1.00 -0.22 6.16 0.00 -2.00 -3.15 119.26 122.66 2dcq h ALA 31 Ca 0.19 0.00 -0.07 0.00 0.00 0.00 0.00 54.91 55.03 2dcq h ALA 31 Cb -0.01 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 17.77 2dcq h ALA 31 CO -0.03 0.00 -0.19 0.22 0.00 0.00 0.00 179.25 179.25 2dcq h ASP 32 N 0.00 0.38 0.00 0.00 3.58 -1.29 0.23 116.42 119.31 2dcq h ASP 32 Ca 0.00 -0.11 0.00 0.00 0.42 0.00 0.00 57.03 57.34 2dcq h ASP 32 Cb 0.51 -0.10 0.00 0.00 1.72 0.00 0.00 39.33 41.46 2dcq h ASP 32 CO 0.00 0.59 0.00 0.49 -2.88 0.00 0.00 179.24 177.44 2dcq n PHE 33 N -4.18 0.00 0.00 0.28 3.72 -1.19 -0.43 117.46 115.66 2dcq n PHE 33 Ca -0.00 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.40 2dcq n PHE 33 Cb 0.34 0.00 0.00 0.00 -0.94 0.00 0.00 39.48 38.88 2dcq n PHE 33 CO 0.00 0.00 0.00 0.54 -0.05 0.00 0.00 176.76 177.25 2dcq n ARG 34 N -0.86 1.10 -0.06 -1.08 1.74 -0.07 -4.42 116.66 113.00 2dcq n ARG 34 Ca 0.10 0.00 -0.07 0.00 -0.77 0.00 0.00 57.85 57.11 2dcq n ARG 34 Cb 0.05 -0.97 -0.08 0.00 -1.02 0.00 0.00 32.46 30.44 2dcq n ARG 34 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 2dcq n GLN 35 N -1.52 1.43 0.00 5.56 10.64 -0.36 -4.89 117.38 128.24 2dcq n GLN 35 Ca 0.00 0.03 0.00 0.00 -1.83 0.00 0.00 57.00 55.20 2dcq n GLN 35 Cb 0.10 -1.28 0.00 0.00 -0.86 0.00 0.00 30.24 28.20 2dcq n GLN 35 CO 0.00 0.00 0.00 0.28 -1.83 0.00 0.00 177.06 175.51 2dcq n VAL 36 N -2.62 0.00 0.00 -0.39 0.31 0.43 -4.54 118.33 111.51 2dcq n VAL 36 Ca -0.21 0.25 0.00 0.00 -0.01 0.00 0.00 64.34 64.37 2dcq n VAL 36 Cb 0.82 -1.22 0.00 0.00 -0.91 0.00 0.00 33.84 32.53 2dcq n VAL 36 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 2dcq n GLY 37 N 2.17 0.62 3.26 2.92 0.00 -0.47 -4.30 105.19 109.40 2dcq n GLY 37 Ca 0.00 -1.47 -0.09 0.00 0.00 0.00 0.00 46.02 44.46 2dcq n GLY 37 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2dcq s SER 38 N -4.00 0.03 0.12 1.61 1.04 -1.26 -3.85 113.70 107.39 2dcq s SER 38 Ca 0.00 -0.63 -0.31 0.00 0.48 0.00 0.00 55.95 55.50 2dcq s SER 38 Cb 0.00 0.39 -0.07 0.00 0.10 0.00 0.00 66.02 66.44 2dcq s SER 38 CO 0.00 -0.80 1.27 -2.16 0.98 0.00 0.00 173.24 172.53 2dcq s PRO 39 N -3.87 4.41 -1.08 4.02 0.04 -1.26 0.03 135.00 137.28 2dcq s PRO 39 Ca 0.07 1.92 -0.12 0.00 0.04 0.00 0.00 61.00 62.91 2dcq s PRO 39 Cb 0.04 -3.27 0.22 0.00 0.04 0.00 0.00 34.50 31.53 2dcq s PRO 39 CO -0.09 -0.27 1.15 1.21 0.04 0.00 0.00 177.00 179.04 2dcq s ASN 40 N 0.77 7.10 0.00 6.66 2.47 -0.60 -4.60 114.94 126.74 2dcq s ASN 40 Ca 0.59 -3.13 0.18 0.00 0.42 0.00 0.00 52.86 50.92 2dcq s ASN 40 Cb -0.33 -2.28 0.57 0.00 -1.45 0.00 0.00 41.25 37.76 2dcq s ASN 40 CO 0.32 -0.54 1.44 2.30 -3.72 0.00 0.00 177.10 176.90 2dcq n ILE 41 N 3.73 0.37 -0.32 -5.21 -5.35 -1.26 -4.57 119.36 106.75 2dcq n ILE 41 Ca 0.26 -0.46 0.01 0.00 -0.27 0.00 0.00 62.75 62.29 2dcq n ILE 41 Cb 0.42 0.40 0.20 0.00 -1.74 0.00 0.00 39.64 38.92 2dcq n ILE 41 CO 0.00 0.00 0.00 0.50 -1.76 0.00 0.00 176.55 175.29 2dcq h LYS 42 N 2.53 1.11 0.00 6.28 3.11 -1.84 -0.03 116.57 127.73 2dcq h LYS 42 Ca 0.00 -0.07 0.00 0.00 -2.81 0.00 0.00 60.65 57.77 2dcq h LYS 42 Cb 0.56 -0.25 0.00 0.00 -1.00 0.00 0.00 32.23 31.54 2dcq h LYS 42 CO 0.00 0.73 0.00 0.78 -2.81 0.00 0.00 179.45 178.15 2dcq h GLY 43 N 1.14 0.00 2.00 5.01 0.00 -1.84 -0.36 103.07 109.02 2dcq h GLY 43 Ca 0.37 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.70 2dcq h GLY 43 CO -0.11 0.00 0.00 1.04 0.00 0.00 0.00 176.54 177.47 2dcq n LEU 44 N -2.70 0.52 0.00 3.11 4.77 -0.03 -4.90 117.00 117.77 2dcq n LEU 44 Ca -0.01 0.55 0.00 0.00 -0.03 0.00 0.00 56.01 56.52 2dcq n LEU 44 Cb 0.14 -0.38 0.00 0.00 -2.33 0.00 0.00 43.42 40.85 2dcq n LEU 44 CO 0.19 -0.12 0.00 0.61 -1.33 0.00 0.00 177.39 176.74 2dcq n GLY 45 N 1.38 0.96 3.61 -0.72 0.00 -0.17 -4.82 105.19 105.43 2dcq n GLY 45 Ca 0.06 0.00 -0.04 0.00 0.00 0.00 0.00 46.02 46.04 2dcq n GLY 45 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2dcq s LYS 46 N 0.00 0.69 0.63 1.61 0.00 -1.04 -5.01 119.74 116.61 2dcq s LYS 46 Ca 0.00 -0.32 -0.12 0.00 0.00 0.00 0.00 55.97 55.53 2dcq s LYS 46 Cb 0.00 0.27 -0.03 0.00 0.00 0.00 0.00 37.83 38.07 2dcq s LYS 46 CO 0.00 -0.31 1.04 0.21 0.00 0.00 0.00 175.35 176.29 2dcq s LYS 47 N -2.83 3.41 0.93 1.78 2.47 -1.26 -2.91 119.74 121.33 2dcq s LYS 47 Ca 0.10 0.88 -0.11 0.00 -1.56 0.00 0.00 55.97 55.28 2dcq s LYS 47 Cb 0.00 -2.05 0.15 0.00 -1.46 0.00 0.00 37.83 34.47 2dcq s LYS 47 CO -0.04 -0.72 1.11 0.00 0.16 0.00 0.00 175.35 175.85 2dcq s ALA 48 N -3.00 1.26 -0.16 3.13 0.00 -1.26 -4.85 121.76 116.88 2dcq s ALA 48 Ca 0.57 0.30 -0.08 0.00 0.00 0.00 0.00 51.96 52.75 2dcq s ALA 48 Cb -0.12 -3.34 -0.04 0.00 0.00 0.00 0.00 23.12 19.61 2dcq s ALA 48 CO 0.50 -2.72 0.12 0.08 0.00 0.00 0.00 175.76 173.73 2dcq s VAL 49 N -2.71 5.31 -0.23 0.00 1.01 -0.55 -4.99 120.40 118.23 2dcq s VAL 49 Ca 0.66 0.15 -0.09 0.00 0.00 0.00 0.00 61.98 62.69 2dcq s VAL 49 Cb -0.21 -3.37 -0.04 0.00 0.00 0.00 0.00 36.38 32.76 2dcq s VAL 49 CO 0.59 0.52 0.12 -0.94 0.00 0.00 0.00 175.10 175.39 2dcq s SER 50 N -0.27 5.73 -0.28 3.32 1.04 -1.26 -0.55 113.70 121.43 2dcq s SER 50 Ca 0.10 0.00 0.02 0.00 0.48 0.00 0.00 55.95 56.56 2dcq s SER 50 Cb -0.12 -2.03 0.16 0.00 0.10 0.00 0.00 66.02 64.14 2dcq s SER 50 CO 0.01 0.05 0.44 -0.89 0.98 0.00 0.00 173.24 173.83 2dcq s THR 51 N 1.14 -0.70 0.15 2.02 2.01 -0.12 -4.97 115.64 115.16 2dcq s THR 51 Ca 0.06 -0.21 -0.33 0.00 0.31 0.00 0.00 61.69 61.52 2dcq s THR 51 Cb -0.14 -0.97 -0.12 0.00 0.01 0.00 0.00 72.50 71.28 2dcq s THR 51 CO 0.04 -0.21 1.72 0.55 -0.69 0.00 0.00 174.62 176.03 2dcq n VAL 52 N 5.37 0.14 -1.99 3.82 3.14 -1.26 -4.07 118.33 123.47 2dcq n VAL 52 Ca 0.01 -0.02 -0.32 0.00 -2.96 0.00 0.00 64.34 61.05 2dcq n VAL 52 Cb 0.50 -1.87 0.00 0.00 -1.06 0.00 0.00 33.84 31.41 2dcq n VAL 52 CO 0.00 0.00 0.00 -0.47 -6.46 0.00 0.00 176.83 169.90 2dcq s TYR 53 N 1.71 3.40 0.00 1.45 5.04 -1.19 -5.02 117.35 122.73 2dcq s TYR 53 Ca 0.79 1.40 0.00 0.00 -2.44 0.00 0.00 57.07 56.82 2dcq s TYR 53 Cb -0.57 -2.81 0.00 0.00 0.35 0.00 0.00 41.96 38.93 2dcq s TYR 53 CO 0.37 -0.75 0.00 0.09 -1.34 0.00 0.00 175.55 173.92 2dcq n ASN 54 N -2.38 0.00 0.00 4.32 3.02 -1.26 -5.04 115.26 113.92 2dcq n ASN 54 Ca 0.07 0.00 0.00 0.00 -0.03 0.00 0.00 54.58 54.62 2dcq n ASN 54 Cb 0.54 0.00 0.00 0.00 -0.61 0.00 0.00 39.78 39.71 2dcq n ASN 54 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2dcq n GLY 55 N 1.72 2.72 0.34 7.41 0.00 -1.26 -4.94 105.19 111.17 2dcq n GLY 55 Ca 0.00 0.00 0.18 0.00 0.00 0.00 0.00 46.02 46.20 2dcq n GLY 55 CO 0.00 0.00 0.00 -2.09 0.00 0.00 0.00 173.32 171.23 2dcq h GLU 56 N 1.41 0.50 -3.41 1.61 4.81 -2.03 -3.26 114.58 114.21 2dcq h GLU 56 Ca 0.00 -0.03 -0.59 0.00 -0.13 0.00 0.00 59.36 58.61 2dcq h GLU 56 Cb 0.00 -0.11 -0.40 0.00 0.63 0.00 0.00 28.75 28.87 2dcq h GLU 56 CO 0.00 0.33 -0.76 0.34 -0.73 0.00 0.00 179.01 178.19 2dcq s ASP 57 N -5.15 3.92 0.08 1.04 -1.08 -1.26 -5.04 116.67 109.16 2dcq s ASP 57 Ca -0.11 -1.87 -0.28 0.00 -0.52 0.00 0.00 52.55 49.77 2dcq s ASP 57 Cb 0.27 -0.89 -0.13 0.00 -1.46 0.00 0.00 42.92 40.72 2dcq s ASP 57 CO 0.79 -0.38 1.45 0.11 0.52 0.00 0.00 175.17 177.66 2dcq h LYS 58 N 7.76 -0.68 -0.07 4.34 1.79 -1.98 -2.93 116.57 124.79 2dcq h LYS 58 Ca -0.10 0.05 -0.07 0.00 -2.18 0.00 0.00 60.65 58.35 2dcq h LYS 58 Cb 0.99 0.15 -0.01 0.00 -1.58 0.00 0.00 32.23 31.79 2dcq h LYS 58 CO 0.46 -0.45 -0.26 -1.00 -1.08 0.00 0.00 179.45 177.12 2dcq h PRO 59 N -0.71 0.13 0.00 3.15 0.13 -1.96 -2.80 132.00 129.94 2dcq h PRO 59 Ca -0.03 -0.04 0.00 0.00 -0.87 0.00 0.00 66.00 65.06 2dcq h PRO 59 Cb 0.66 -0.01 0.00 0.00 0.13 0.00 0.00 31.00 31.78 2dcq h PRO 59 CO -0.14 0.38 0.00 0.41 -0.23 0.00 0.00 178.00 178.41 2dcq n GLY 60 N -0.67 -0.38 0.42 1.56 0.00 -1.12 -2.34 105.19 102.66 2dcq n GLY 60 Ca -0.01 -0.07 -0.14 0.00 0.00 0.00 0.00 46.02 45.79 2dcq n GLY 60 CO 0.00 0.00 0.00 0.33 0.00 0.00 0.00 173.32 173.65 2dcq n PHE 61 N -0.96 0.00 0.02 1.61 7.35 -1.06 -4.61 117.46 119.81 2dcq n PHE 61 Ca 0.08 0.00 0.00 0.00 -0.76 0.00 0.00 57.45 56.78 2dcq n PHE 61 Cb 0.04 -0.53 0.01 0.00 0.35 0.00 0.00 39.48 39.35 2dcq n PHE 61 CO 0.00 0.00 0.00 1.28 -0.76 0.00 0.00 176.76 177.28 2dcq n LEU 62 N -3.47 0.00 0.09 -2.13 4.77 -0.99 -2.69 117.00 112.58 2dcq n LEU 62 Ca -0.28 0.35 0.09 0.00 -0.03 0.00 0.00 56.01 56.14 2dcq n LEU 62 Cb 0.72 -0.35 0.41 0.00 -2.33 0.00 0.00 43.42 41.87 2dcq n LEU 62 CO 0.05 -0.35 0.77 2.29 -1.33 0.00 0.00 177.39 178.82 2dcq n LYS 63 N -1.35 0.11 -0.00 3.23 -0.00 -1.05 -2.10 118.16 117.00 2dcq n LYS 63 Ca 0.00 0.45 -0.20 0.00 -0.00 0.00 0.00 58.31 58.57 2dcq n LYS 63 Cb 0.00 -1.77 -0.14 0.00 -0.00 0.00 0.00 35.03 33.13 2dcq n LYS 63 CO 0.00 0.00 0.00 0.87 0.00 0.00 0.00 177.40 178.27 2dcq h LYS 64 N 0.00 0.20 -0.46 -1.58 1.79 -1.85 -3.41 116.57 111.26 2dcq h LYS 64 Ca 0.00 -0.34 -0.12 0.00 -2.18 0.00 0.00 60.65 58.01 2dcq h LYS 64 Cb 0.20 0.13 -0.01 0.00 -1.58 0.00 0.00 32.23 30.96 2dcq h LYS 64 CO 0.00 1.16 -0.20 -0.07 -1.08 0.00 0.00 179.45 179.26 2dcq h LEU 65 N -0.52 0.94 0.00 2.94 4.07 -1.65 -3.06 115.31 118.02 2dcq h LEU 65 Ca -0.20 -0.34 0.00 0.00 0.08 0.00 0.00 57.88 57.42 2dcq h LEU 65 Cb 1.54 -0.26 0.00 0.00 1.08 0.00 0.00 40.66 43.02 2dcq h LEU 65 CO 0.05 1.10 0.00 -0.24 -1.08 0.00 0.00 178.44 178.28 2dcq n SER 66 N -4.12 0.00 0.00 -0.43 2.88 -1.23 -1.59 113.62 109.13 2dcq n SER 66 Ca 0.00 0.21 0.00 0.00 -1.33 0.00 0.00 58.87 57.76 2dcq n SER 66 Cb 0.44 -0.23 0.00 0.00 -0.75 0.00 0.00 64.21 63.67 2dcq n SER 66 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 2dcq n LEU 67 N -1.23 0.37 -0.00 2.46 -0.00 -1.17 -4.85 117.00 112.58 2dcq n LEU 67 Ca 0.01 -0.37 0.09 0.00 -0.00 0.00 0.00 56.01 55.74 2dcq n LEU 67 Cb 0.01 0.00 -0.13 0.00 -0.00 0.00 0.00 43.42 43.30 2dcq n LEU 67 CO 0.01 0.09 -0.29 0.29 -0.00 0.00 0.00 177.39 177.49 2dcq n LYS 68 N -0.00 0.59 -4.49 1.47 4.01 -0.62 -5.00 118.16 114.11 2dcq n LYS 68 Ca 0.00 -0.06 -0.28 0.00 -0.51 0.00 0.00 58.31 57.46 2dcq n LYS 68 Cb 0.16 -1.44 -0.13 0.00 -0.51 0.00 0.00 35.03 33.11 2dcq n LYS 68 CO 0.00 0.00 0.00 -0.06 -1.11 0.00 0.00 177.40 176.23 2dcq s PHE 69 N -3.03 2.17 -0.02 2.13 0.40 -1.21 -5.07 117.98 113.34 2dcq s PHE 69 Ca 0.02 -0.39 -0.06 0.00 -0.60 0.00 0.00 56.93 55.89 2dcq s PHE 69 Cb 0.14 -1.21 -0.04 0.00 0.51 0.00 0.00 43.02 42.42 2dcq s PHE 69 CO 0.81 0.25 0.44 1.57 0.70 0.00 0.00 175.22 178.99 2dcq h LYS 70 N 4.17 -0.22 -2.11 0.44 5.09 -1.94 -3.43 116.57 118.58 2dcq h LYS 70 Ca -0.49 0.02 -0.57 0.00 0.09 0.00 0.00 60.65 59.70 2dcq h LYS 70 Cb 1.17 0.05 -0.41 0.00 0.10 0.00 0.00 32.23 33.14 2dcq h LYS 70 CO 0.40 -0.15 -0.87 -3.47 -2.09 0.00 0.00 179.45 173.28 2dcq n ASP 71 N -3.52 2.11 0.18 7.07 2.03 -1.26 -4.95 116.55 118.21 2dcq n ASP 71 Ca -0.03 -3.13 0.02 0.00 0.52 0.00 0.00 54.79 52.17 2dcq n ASP 71 Cb 0.09 -0.64 0.34 0.00 -0.72 0.00 0.00 41.12 40.19 2dcq n ASP 71 CO 0.00 0.00 0.00 1.55 -1.92 0.00 0.00 177.20 176.83 2dcq h PRO 72 N 3.84 0.01 -0.36 -0.67 0.13 -1.85 -2.81 132.00 130.30 2dcq h PRO 72 Ca 0.13 -0.00 0.10 0.00 -0.87 0.00 0.00 66.00 65.36 2dcq h PRO 72 Cb 0.76 -0.00 -0.01 0.00 0.13 0.00 0.00 31.00 31.88 2dcq h PRO 72 CO 0.65 0.40 0.34 1.05 -0.23 0.00 0.00 178.00 180.20 2dcq h GLU 73 N 0.00 0.00 0.00 0.86 4.11 -1.91 -1.53 114.58 116.11 2dcq h GLU 73 Ca -0.00 0.00 -0.09 0.00 0.07 0.00 0.00 59.36 59.33 2dcq h GLU 73 Cb 0.69 0.00 -0.20 0.00 0.50 0.00 0.00 28.75 29.74 2dcq h GLU 73 CO 0.05 0.00 -0.78 0.27 0.07 0.00 0.00 179.01 178.62 2dcq n ASN 74 N -3.93 0.53 -4.79 3.06 2.04 -1.24 -3.17 115.26 107.76 2dcq n ASN 74 Ca 0.06 -2.01 -0.37 0.00 -0.44 0.00 0.00 54.58 51.82 2dcq n ASN 74 Cb 0.51 -0.25 -0.06 0.00 -2.53 0.00 0.00 39.78 37.44 2dcq n ASN 74 CO 0.00 0.00 0.00 -0.89 -0.44 0.00 0.00 177.26 175.93 2dcq s THR 75 N -0.01 4.36 -0.26 5.53 2.01 -0.58 -4.95 115.64 121.74 2dcq s THR 75 Ca 0.18 1.61 -0.18 0.00 0.31 0.00 0.00 61.69 63.61 2dcq s THR 75 Cb 0.20 -3.97 -0.03 0.00 0.01 0.00 0.00 72.50 68.72 2dcq s THR 75 CO -0.09 0.21 0.52 -0.89 -0.69 0.00 0.00 174.62 173.68 2dcq s THR 76 N -1.53 5.06 0.36 -0.82 2.01 -1.26 -3.79 115.64 115.68 2dcq s THR 76 Ca 0.46 0.89 -0.08 0.00 0.31 0.00 0.00 61.69 63.27 2dcq s THR 76 Cb -0.18 -3.84 -0.06 0.00 0.01 0.00 0.00 72.50 68.43 2dcq s THR 76 CO 0.23 0.08 0.69 -0.76 -0.69 0.00 0.00 174.62 174.17 2dcq s LEU 77 N 2.33 3.91 -0.20 4.42 1.43 -0.84 -0.99 118.68 128.74 2dcq s LEU 77 Ca 0.22 0.97 -0.02 0.00 -1.03 0.00 0.00 54.13 54.27 2dcq s LEU 77 Cb -0.16 -3.83 0.06 0.00 0.03 0.00 0.00 46.19 42.29 2dcq s LEU 77 CO 0.09 -0.33 0.00 -0.31 0.23 0.00 0.00 176.35 176.03 2dcq s TYR 78 N -2.28 1.47 0.93 0.29 1.51 -0.70 -1.40 117.35 117.17 2dcq s TYR 78 Ca 0.48 -1.12 -0.11 0.00 -1.01 0.00 0.00 57.07 55.31 2dcq s TYR 78 Cb -0.10 -1.20 0.15 0.00 -0.11 0.00 0.00 41.96 40.69 2dcq s TYR 78 CO 0.31 -0.65 1.09 0.42 -1.11 0.00 0.00 175.55 175.61 2dcq s ILE 79 N 1.71 2.52 -0.05 2.71 1.09 -0.32 -1.36 121.20 127.50 2dcq s ILE 79 Ca -0.02 0.17 -0.02 0.00 -1.10 0.00 0.00 60.65 59.68 2dcq s ILE 79 Cb -0.17 -2.54 0.04 0.00 -1.06 0.00 0.00 42.46 38.72 2dcq s ILE 79 CO -0.07 -0.22 0.09 -0.22 -0.10 0.00 0.00 174.94 174.42 2dcq s LEU 80 N -6.39 0.46 0.00 2.97 0.20 -0.08 -4.29 118.68 111.54 2dcq s LEU 80 Ca 0.64 0.17 0.01 0.00 0.69 0.00 0.00 54.13 55.64 2dcq s LEU 80 Cb -0.19 0.08 0.01 0.00 -0.43 0.00 0.00 46.19 45.65 2dcq s LEU 80 CO 0.58 -0.20 0.04 -0.67 -0.29 0.00 0.00 176.35 175.82 2dcq n ASP 81 N 4.79 3.20 0.00 3.68 -0.08 -1.26 -1.14 116.55 125.74 2dcq n ASP 81 Ca -0.15 -2.99 0.00 0.00 -1.51 0.00 0.00 54.79 50.14 2dcq n ASP 81 Cb 0.50 0.28 0.00 0.00 2.34 0.00 0.00 41.12 44.24 2dcq n ASP 81 CO 0.00 0.00 0.00 0.29 0.12 0.00 0.00 177.20 177.61 2dcq n LYS 82 N -1.21 0.00 0.05 -0.67 4.01 -1.26 -2.12 118.16 116.95 2dcq n LYS 82 Ca -0.17 0.12 0.00 0.00 -0.51 0.00 0.00 58.31 57.74 2dcq n LYS 82 Cb 0.58 -1.01 0.00 0.00 -0.51 0.00 0.00 35.03 34.10 2dcq n LYS 82 CO 0.00 0.00 0.00 0.34 -1.11 0.00 0.00 177.40 176.63 2dcq n PHE 83 N -0.85 -0.26 0.00 2.13 7.35 -1.26 -0.31 117.46 124.26 2dcq n PHE 83 Ca 0.00 0.05 0.00 0.00 -0.76 0.00 0.00 57.45 56.74 2dcq n PHE 83 Cb 0.00 0.07 0.00 0.00 0.35 0.00 0.00 39.48 39.90 2dcq n PHE 83 CO 0.00 0.00 0.00 -0.25 -0.76 0.00 0.00 176.76 175.75 2dcq n ASP 84 N -3.39 0.00 0.00 -2.13 8.00 -1.26 -2.60 116.55 115.17 2dcq n ASP 84 Ca 0.00 0.00 0.00 0.00 0.71 0.00 0.00 54.79 55.50 2dcq n ASP 84 Cb 0.09 -0.04 0.00 0.00 -0.02 0.00 0.00 41.12 41.15 2dcq n ASP 84 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2dcq n GLY 85 N 3.49 2.45 1.31 0.44 0.00 -1.26 -3.59 105.19 108.03 2dcq n GLY 85 Ca 0.00 -0.31 0.04 0.00 0.00 0.00 0.00 46.02 45.74 2dcq n GLY 85 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 2dcq n ASN 86 N 7.23 0.97 -0.37 1.61 5.03 -1.26 -4.96 115.26 123.51 2dcq n ASN 86 Ca 0.00 -2.16 -0.03 0.00 0.87 0.00 0.00 54.58 53.26 2dcq n ASN 86 Cb 0.00 -0.31 0.01 0.00 -1.02 0.00 0.00 39.78 38.46 2dcq n ASN 86 CO 0.00 0.00 0.00 0.77 -1.83 0.00 0.00 177.26 176.20 2dcq h SER 87 N 0.89 -1.54 -0.59 6.41 4.64 -1.96 -1.53 113.55 119.86 2dcq h SER 87 Ca -0.19 0.31 -0.06 0.00 -0.47 0.00 0.00 61.79 61.38 2dcq h SER 87 Cb 1.77 0.77 -0.02 0.00 -0.31 0.00 0.00 62.40 64.61 2dcq h SER 87 CO 0.08 -0.28 0.16 -0.33 -0.87 0.00 0.00 176.83 175.58 2dcq h GLU 88 N -0.02 0.94 -0.59 4.77 5.08 -1.92 -0.25 114.58 122.59 2dcq h GLU 88 Ca 0.30 -0.22 0.03 0.00 -1.00 0.00 0.00 59.36 58.47 2dcq h GLU 88 Cb 0.56 -0.13 -0.04 0.00 0.50 0.00 0.00 28.75 29.65 2dcq h GLU 88 CO -0.94 0.86 0.35 1.25 -1.00 0.00 0.00 179.01 179.53 2dcq h LEU 89 N 0.86 0.57 -0.70 1.33 7.12 -1.71 -0.33 115.31 122.44 2dcq h LEU 89 Ca 0.19 0.01 -0.12 0.00 0.13 0.00 0.00 57.88 58.09 2dcq h LEU 89 Cb 0.33 -0.11 -0.01 0.00 -0.53 0.00 0.00 40.66 40.34 2dcq h LEU 89 CO -0.00 0.39 -0.26 0.58 -0.13 0.00 0.00 178.44 179.02 2dcq h VAL 90 N 0.69 1.27 0.00 1.05 2.07 -1.11 -2.53 116.25 117.70 2dcq h VAL 90 Ca 0.24 -1.38 -0.01 0.00 0.82 0.00 0.00 66.70 66.38 2dcq h VAL 90 Cb 0.04 1.29 -0.00 0.00 -1.52 0.00 0.00 31.29 31.10 2dcq h VAL 90 CO -0.11 0.45 -0.03 0.00 0.02 0.00 0.00 177.57 177.90 2dcq h ALA 91 N 1.08 1.18 -0.25 1.67 0.00 0.41 -1.72 119.26 121.64 2dcq h ALA 91 Ca 0.08 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.96 2dcq h ALA 91 Cb 0.77 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.55 2dcq h ALA 91 CO 0.06 0.04 0.00 -0.85 0.00 0.00 0.00 179.25 178.50 2dcq n GLU 92 N -3.38 2.80 -0.02 0.00 0.28 -0.28 -3.93 120.64 116.11 2dcq n GLU 92 Ca -0.02 -2.72 -0.07 0.00 -0.16 0.00 0.00 57.16 54.19 2dcq n GLU 92 Cb 0.15 -1.75 -0.02 0.00 1.43 0.00 0.00 31.44 31.25 2dcq n GLU 92 CO 0.00 0.00 0.00 -0.11 -0.16 0.00 0.00 177.13 176.86 2dcq n LEU 93 N -0.47 0.90 -0.32 -1.84 7.94 -0.68 -4.65 117.00 117.87 2dcq n LEU 93 Ca 0.20 0.14 -0.01 0.00 -1.11 0.00 0.00 56.01 55.23 2dcq n LEU 93 Cb 0.81 -0.33 0.12 0.00 0.53 0.00 0.00 43.42 44.55 2dcq n LEU 93 CO 0.13 -0.13 1.23 -0.37 -1.11 0.00 0.00 177.39 177.14 2dcq h VAL 94 N -0.31 1.14 0.00 1.96 -1.51 -1.72 -1.10 116.25 114.71 2dcq h VAL 94 Ca -0.13 -0.38 0.00 0.00 -1.23 0.00 0.00 66.70 64.96 2dcq h VAL 94 Cb 0.85 -0.06 0.00 0.00 -2.13 0.00 0.00 31.29 29.94 2dcq h VAL 94 CO -0.08 0.20 0.00 0.00 -1.23 0.00 0.00 177.57 176.46 2dcq h ALA 95 N 1.37 1.00 -0.02 5.19 0.00 -1.80 -0.48 119.26 124.52 2dcq h ALA 95 Ca 0.35 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.26 2dcq h ALA 95 Cb 0.02 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.81 2dcq h ALA 95 CO -0.12 0.00 -0.07 1.28 0.00 0.00 0.00 179.25 180.34 2dcq n LEU 96 N -2.32 2.10 0.00 0.00 4.32 -0.44 -4.51 117.00 116.15 2dcq n LEU 96 Ca -0.01 -0.94 0.00 0.00 -0.02 0.00 0.00 56.01 55.04 2dcq n LEU 96 Cb 0.09 0.00 0.00 0.00 -1.62 0.00 0.00 43.42 41.89 2dcq n LEU 96 CO 0.13 0.38 0.13 0.59 -1.22 0.00 0.00 177.39 177.40 2dcq n ASN 97 N 0.63 0.51 0.00 -1.43 3.02 -0.23 -4.96 115.26 112.79 2dcq n ASN 97 Ca 0.08 -0.78 0.00 0.00 -0.03 0.00 0.00 54.58 53.85 2dcq n ASN 97 Cb 0.37 0.31 0.00 0.00 -0.61 0.00 0.00 39.78 39.85 2dcq n ASN 97 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2dcq n GLY 98 N 0.31 0.15 3.31 7.41 0.00 -1.05 -5.06 105.19 110.26 2dcq n GLY 98 Ca 0.00 0.00 -0.17 0.00 0.00 0.00 0.00 46.02 45.85 2dcq n GLY 98 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 2dcq s PHE 99 N -0.15 1.51 -0.18 1.61 0.40 -0.94 -3.93 117.98 116.29 2dcq s PHE 99 Ca 0.00 -1.27 -0.23 0.00 -0.60 0.00 0.00 56.93 54.82 2dcq s PHE 99 Cb 0.00 -0.84 -0.20 0.00 0.51 0.00 0.00 43.02 42.48 2dcq s PHE 99 CO 0.00 -0.44 0.39 -0.22 0.70 0.00 0.00 175.22 175.65 2dcq h LYS 100 N 2.35 0.00 -2.18 0.44 1.63 -1.58 -3.38 116.57 113.86 2dcq h LYS 100 Ca -0.36 0.00 -0.06 0.00 -0.85 0.00 0.00 60.65 59.37 2dcq h LYS 100 Cb 1.25 0.00 -0.21 0.00 -0.60 0.00 0.00 32.23 32.67 2dcq h LYS 100 CO 0.57 0.94 0.06 -1.12 -3.45 0.00 0.00 179.45 176.45 2dcq s SER 101 N -6.55 -0.65 0.18 4.20 0.01 -1.26 -4.80 113.70 104.83 2dcq s SER 101 Ca -0.24 1.11 -0.00 0.00 1.31 0.00 0.00 55.95 58.12 2dcq s SER 101 Cb 0.02 1.09 -0.04 0.00 0.21 0.00 0.00 66.02 67.30 2dcq s SER 101 CO 0.60 -0.32 0.08 0.00 0.41 0.00 0.00 173.24 174.00 2dcq s ALA 102 N -0.09 1.19 0.12 1.44 0.00 -1.25 -1.98 121.76 121.18 2dcq s ALA 102 Ca -0.03 -1.63 0.04 0.00 0.00 0.00 0.00 51.96 50.33 2dcq s ALA 102 Cb -0.04 1.02 -0.04 0.00 0.00 0.00 0.00 23.12 24.06 2dcq s ALA 102 CO 0.03 -0.49 -0.10 0.71 0.00 0.00 0.00 175.76 175.92 2dcq s TYR 103 N -3.97 1.13 0.28 0.00 1.51 -0.49 -4.84 117.35 110.96 2dcq s TYR 103 Ca 0.31 -0.74 0.10 0.00 -1.01 0.00 0.00 57.07 55.73 2dcq s TYR 103 Cb 0.07 -0.60 -0.05 0.00 -0.11 0.00 0.00 41.96 41.28 2dcq s TYR 103 CO 0.07 0.01 -0.07 0.00 -1.11 0.00 0.00 175.55 174.46 2dcq s ALA 104 N -3.03 3.03 -0.22 3.71 0.00 -1.26 -1.17 121.76 122.81 2dcq s ALA 104 Ca 0.12 -1.76 -0.03 0.00 0.00 0.00 0.00 51.96 50.28 2dcq s ALA 104 Cb 0.01 -0.56 -0.00 0.00 0.00 0.00 0.00 23.12 22.57 2dcq s ALA 104 CO -0.01 0.25 -0.06 -1.50 0.00 0.00 0.00 175.76 174.44 2dcq s ILE 105 N -2.41 3.18 0.62 0.00 2.07 -1.26 -1.68 121.20 121.72 2dcq s ILE 105 Ca 0.31 -0.58 -0.19 0.00 -1.41 0.00 0.00 60.65 58.78 2dcq s ILE 105 Cb -0.05 -2.45 -0.03 0.00 0.13 0.00 0.00 42.46 40.06 2dcq s ILE 105 CO 0.18 0.42 1.26 1.17 -1.91 0.00 0.00 174.94 176.06 2dcq n LYS 106 N 4.77 1.22 -0.72 3.50 0.00 0.15 -2.71 118.16 124.38 2dcq n LYS 106 Ca -0.18 0.47 0.00 0.00 0.00 0.00 0.00 58.31 58.59 2dcq n LYS 106 Cb 0.50 -2.49 0.00 0.00 0.00 0.00 0.00 35.03 33.05 2dcq n LYS 106 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.40 177.15 2dcq n ASP 107 N -1.51 -1.70 0.00 3.14 8.00 -1.22 -4.27 116.55 118.98 2dcq n ASP 107 Ca 0.14 0.00 0.00 0.00 0.71 0.00 0.00 54.79 55.64 2dcq n ASP 107 Cb 0.47 -2.34 0.00 0.00 -0.02 0.00 0.00 41.12 39.23 2dcq n ASP 107 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2dcq n GLY 108 N -1.29 3.02 0.00 0.44 0.00 -1.07 -2.63 105.19 103.67 2dcq n GLY 108 Ca 0.00 0.19 0.05 0.00 0.00 0.00 0.00 46.02 46.26 2dcq n GLY 108 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2dcq n ALA 109 N 10.67 2.42 -3.41 4.61 0.00 0.58 -0.30 120.51 135.08 2dcq n ALA 109 Ca 0.00 -0.23 -0.27 0.00 0.00 0.00 0.00 53.44 52.94 2dcq n ALA 109 Cb 0.00 -0.32 -0.08 0.00 0.00 0.00 0.00 19.45 19.05 2dcq n ALA 109 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.50 177.89 2dcq n GLU 110 N -1.77 2.54 -3.99 0.00 1.02 0.57 -3.69 120.64 115.32 2dcq n GLU 110 Ca -0.01 -4.68 -0.12 0.00 -0.02 0.00 0.00 57.16 52.33 2dcq n GLU 110 Cb 0.24 -2.25 -0.02 0.00 -0.02 0.00 0.00 31.44 29.38 2dcq n GLU 110 CO 0.00 0.00 0.00 0.20 1.18 0.00 0.00 177.13 178.51 2dcq s GLY 111 N -2.50 1.02 0.39 0.62 0.00 -1.08 -4.32 107.32 101.45 2dcq s GLY 111 Ca 0.40 -1.20 0.27 0.00 0.00 0.00 0.00 44.72 44.20 2dcq s GLY 111 CO -0.01 -0.73 1.79 -0.56 0.00 0.00 0.00 173.10 173.59 2dcq h PRO 112 N 2.08 0.00 0.00 2.90 0.13 -1.95 -3.19 132.00 131.98 2dcq h PRO 112 Ca -0.29 0.00 -0.14 0.00 -0.87 0.00 0.00 66.00 64.69 2dcq h PRO 112 Cb 1.24 0.00 -0.29 0.00 0.13 0.00 0.00 31.00 32.08 2dcq h PRO 112 CO 0.39 0.00 -0.85 0.54 -0.23 0.00 0.00 178.00 177.85 2dcq n ARG 113 N -2.73 0.00 0.00 0.86 1.74 -1.26 -4.81 116.66 110.46 2dcq n ARG 113 Ca 0.03 -1.69 0.00 0.00 -0.77 0.00 0.00 57.85 55.42 2dcq n ARG 113 Cb 0.36 -0.01 0.00 0.00 -1.02 0.00 0.00 32.46 31.80 2dcq n ARG 113 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 2dcq n GLY 114 N 0.36 -2.22 0.41 -0.13 0.00 -1.20 -4.29 105.19 98.10 2dcq n GLY 114 Ca 0.01 -1.48 -0.12 0.00 0.00 0.00 0.00 46.02 44.43 2dcq n GLY 114 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 173.32 173.07 2dcq h TRP 115 N -1.36 -1.31 -0.30 1.61 2.91 -0.84 -0.27 115.95 116.39 2dcq h TRP 115 Ca 0.00 0.06 -0.00 0.00 1.13 0.00 0.00 58.89 60.08 2dcq h TRP 115 Cb 0.00 0.61 -0.01 0.00 -0.51 0.00 0.00 29.16 29.25 2dcq h TRP 115 CO 0.00 -0.47 0.18 -0.07 -1.03 0.00 0.00 178.44 177.05 2dcq h LEU 116 N -0.42 0.37 -1.37 0.65 3.38 -1.84 -2.38 115.31 113.70 2dcq h LEU 116 Ca 0.10 -0.06 -0.01 0.00 0.09 0.00 0.00 57.88 58.00 2dcq h LEU 116 Cb 0.61 -0.09 -0.00 0.00 0.09 0.00 0.00 40.66 41.26 2dcq h LEU 116 CO -0.50 0.32 0.01 0.59 0.09 0.00 0.00 178.44 178.95 2dcq n ASN 117 N -4.83 1.69 -0.05 -0.43 4.13 -0.71 -2.63 115.26 112.42 2dcq n ASN 117 Ca -0.02 -2.04 0.01 0.00 1.68 0.00 0.00 54.58 54.22 2dcq n ASN 117 Cb 0.06 -0.51 0.02 0.00 -1.54 0.00 0.00 39.78 37.81 2dcq n ASN 117 CO 0.00 0.00 0.00 -0.24 0.28 0.00 0.00 177.26 177.30 2dcq n SER 118 N 0.14 1.16 -3.34 6.41 2.88 -0.19 -4.38 113.62 116.30 2dcq n SER 118 Ca 0.01 -1.78 -0.16 0.00 -1.33 0.00 0.00 58.87 55.61 2dcq n SER 118 Cb 0.36 -0.07 0.08 0.00 -0.75 0.00 0.00 64.21 63.83 2dcq n SER 118 CO 0.00 0.00 0.00 -0.24 -1.23 0.00 0.00 175.04 173.57 2dcq n SER 119 N -0.39 -4.50 -4.49 -3.46 2.88 -1.08 -4.82 113.62 97.75 2dcq n SER 119 Ca 0.02 -0.67 -0.26 0.00 -1.33 0.00 0.00 58.87 56.63 2dcq n SER 119 Cb 0.42 -5.17 -0.10 0.00 -0.75 0.00 0.00 64.21 58.61 2dcq n SER 119 CO 0.00 0.00 0.00 -0.76 -1.23 0.00 0.00 175.04 173.05 2dcq s LEU 120 N -5.85 2.69 0.57 2.46 1.43 -1.20 -5.09 118.68 113.69 2dcq s LEU 120 Ca 0.25 -0.79 -0.17 0.00 -1.03 0.00 0.00 54.13 52.39 2dcq s LEU 120 Cb -0.03 -1.35 -0.04 0.00 0.03 0.00 0.00 46.19 44.79 2dcq s LEU 120 CO 0.74 0.09 1.07 -2.16 0.23 0.00 0.00 176.35 176.31 2dcq s PRO 121 N -2.96 3.36 0.01 1.29 0.04 -1.26 -4.80 135.00 130.68 2dcq s PRO 121 Ca 0.25 1.30 0.00 0.00 0.04 0.00 0.00 61.00 62.58 2dcq s PRO 121 Cb -0.07 -2.03 -0.01 0.00 0.04 0.00 0.00 34.50 32.42 2dcq s PRO 121 CO 0.13 -0.79 -0.02 -0.46 0.04 0.00 0.00 177.00 175.90 2dcq s TRP 122 N -2.28 0.20 0.06 0.56 -0.11 -1.26 -1.55 118.94 114.55 2dcq s TRP 122 Ca 0.66 -0.36 0.04 0.00 1.22 0.00 0.00 56.10 57.65 2dcq s TRP 122 Cb -0.17 -0.14 -0.24 0.00 -1.50 0.00 0.00 33.47 31.41 2dcq s TRP 122 CO 0.33 -0.13 1.06 0.82 -4.62 0.00 0.00 176.95 174.41 2dcq h ILE 123 N 4.80 1.41 -3.44 5.86 2.04 -0.66 -3.40 117.51 124.12 2dcq h ILE 123 Ca -0.30 -3.10 0.34 0.00 1.00 0.00 0.00 64.86 62.81 2dcq h ILE 123 Cb 1.21 2.77 -0.19 0.00 -0.74 0.00 0.00 36.82 39.88 2dcq h ILE 123 CO 0.44 0.85 -1.23 -0.62 0.00 0.00 0.00 178.15 177.59 2dcq n GLU 124 N -3.35 -3.27 -1.79 2.37 1.02 -1.26 -4.92 120.64 109.43 2dcq n GLU 124 Ca -0.08 2.67 -0.30 0.00 -0.02 0.00 0.00 57.16 59.43 2dcq n GLU 124 Cb 1.00 -3.83 0.19 0.00 -0.02 0.00 0.00 31.44 28.78 2dcq n GLU 124 CO 0.00 0.00 0.00 -1.25 1.18 0.00 0.00 177.13 177.06 2dcq s PRO 125 N -4.21 0.36 0.00 3.49 0.04 -1.26 -4.65 135.00 128.78 2dcq s PRO 125 Ca 0.00 -0.34 0.00 0.00 0.04 0.00 0.00 61.00 60.70 2dcq s PRO 125 Cb 0.00 -1.81 0.00 0.00 0.04 0.00 0.00 34.50 32.73 2dcq s PRO 125 CO 0.00 -2.61 0.56 1.63 0.04 0.00 0.00 177.00 176.62 2dcq n LYS 126 N -3.92 0.99 0.01 4.56 4.01 -1.26 -3.24 118.16 119.30 2dcq n LYS 126 Ca 0.15 0.00 0.03 0.00 -0.51 0.00 0.00 58.31 57.98 2dcq n LYS 126 Cb 0.59 -1.43 -0.11 0.00 -0.51 0.00 0.00 35.03 33.57 2dcq n LYS 126 CO 0.00 0.00 0.00 1.63 -1.11 0.00 0.00 177.40 177.92 2dcq n LYS 127 N -0.06 0.64 -4.02 1.97 4.01 -1.26 -5.01 118.16 114.42 2dcq n LYS 127 Ca 0.00 0.03 -0.29 0.00 -0.51 0.00 0.00 58.31 57.54 2dcq n LYS 127 Cb 0.22 -1.67 -0.08 0.00 -0.51 0.00 0.00 35.03 32.99 2dcq n LYS 127 CO 0.00 0.00 0.00 -2.37 -1.11 0.00 0.00 177.40 173.92 2dcq n THR 128 N -2.64 -0.53 0.77 -0.18 5.66 -1.20 -4.79 114.28 111.38 2dcq n THR 128 Ca -0.11 -0.26 0.08 0.00 -3.05 0.00 0.00 64.05 60.71 2dcq n THR 128 Cb 0.77 -0.68 0.41 0.00 -1.55 0.00 0.00 70.33 69.27 2dcq n THR 128 CO 0.00 0.00 0.00 -1.20 -3.05 0.00 0.00 175.07 170.82 2dcq n SER 129 N -2.19 0.00 0.00 1.09 7.64 -1.26 -4.90 113.62 113.99 2dcq n SER 129 Ca -0.14 0.01 0.00 0.00 1.01 0.00 0.00 58.87 59.75 2dcq n SER 129 Cb 0.51 -0.26 0.00 0.00 -1.01 0.00 0.00 64.21 63.45 2dcq n SER 129 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2dcq n GLY 130 N 0.05 1.32 0.00 0.23 0.00 -1.26 -4.85 105.19 100.68 2dcq n GLY 130 Ca 0.08 -1.71 0.14 0.00 0.00 0.00 0.00 46.02 44.53 2dcq n GLY 130 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 2dcq n PRO 131 N -1.73 0.14 0.00 1.61 -0.04 -1.26 -4.14 135.00 129.58 2dcq n PRO 131 Ca 0.00 0.02 0.00 0.00 -0.04 0.00 0.00 63.50 63.48 2dcq n PRO 131 Cb 0.00 -1.50 0.00 0.00 -0.04 0.00 0.00 33.50 31.96 2dcq n PRO 131 CO 0.00 0.00 0.00 0.45 -0.04 0.00 0.00 175.50 175.91 2dcq n SER 132 N -1.43 0.13 0.00 3.54 2.88 -1.26 -5.04 113.62 112.44 2dcq n SER 132 Ca 0.09 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.63 2dcq n SER 132 Cb 0.29 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 63.75 2dcq n SER 132 CO 0.00 0.00 0.00 -1.54 -1.23 0.00 0.00 175.04 172.27 2dcq n SER 133 N -2.82 0.00 0.00 -3.46 3.41 -1.26 -5.03 113.62 104.46 2dcq n SER 133 Ca 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.61 2dcq n SER 133 Cb 0.35 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 64.30 2dcq n SER 133 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49