#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 -0.49 -3.93 1.61 2.88 -1.26 -5.12 113.62 107.31 2dcq n SER 2 Ca 0.00 -0.52 -0.16 0.00 -1.33 0.00 0.00 58.87 56.86 2dcq n SER 2 Cb 0.00 0.00 -0.15 0.00 -0.75 0.00 0.00 64.21 63.31 2dcq n SER 2 CO 0.00 0.00 0.00 -0.44 -1.23 0.00 0.00 175.04 173.37 2dcq s SER 3 N -1.32 0.57 0.00 -3.46 0.01 -1.26 -4.72 113.70 103.51 2dcq s SER 3 Ca 0.00 -0.08 0.00 0.00 1.31 0.00 0.00 55.95 57.18 2dcq s SER 3 Cb 0.00 -0.11 0.00 0.00 0.21 0.00 0.00 66.02 66.12 2dcq s SER 3 CO 0.00 0.03 0.00 0.61 0.41 0.00 0.00 173.24 174.29 2dcq n GLY 4 N 3.18 0.54 0.28 3.44 0.00 -1.26 -4.86 105.19 106.51 2dcq n GLY 4 Ca -0.15 -0.14 0.10 0.00 0.00 0.00 0.00 46.02 45.83 2dcq n GLY 4 CO 0.00 0.00 0.00 1.76 0.00 0.00 0.00 173.32 175.08 2dcq h SER 5 N 0.00 0.02 -2.69 1.61 0.02 -1.95 -3.43 113.55 107.13 2dcq h SER 5 Ca 0.00 -0.00 -0.53 0.00 -0.84 0.00 0.00 61.79 60.42 2dcq h SER 5 Cb 0.00 -0.00 -0.13 0.00 0.14 0.00 0.00 62.40 62.40 2dcq h SER 5 CO 0.00 0.01 -0.58 -0.44 -1.14 0.00 0.00 176.83 174.68 2dcq s SER 6 N -6.90 2.86 0.30 3.07 0.01 -1.26 -3.63 113.70 108.16 2dcq s SER 6 Ca -0.05 -1.46 -0.06 0.00 1.31 0.00 0.00 55.95 55.68 2dcq s SER 6 Cb 0.18 0.05 -0.00 0.00 0.21 0.00 0.00 66.02 66.45 2dcq s SER 6 CO 0.68 -0.67 0.46 -0.83 0.41 0.00 0.00 173.24 173.29 2dcq s GLY 7 N -3.58 1.13 0.91 3.44 0.00 -0.95 -4.34 107.32 103.92 2dcq s GLY 7 Ca 0.31 -1.29 -0.10 0.00 0.00 0.00 0.00 44.72 43.63 2dcq s GLY 7 CO 0.14 -0.88 1.13 -0.56 0.00 0.00 0.00 173.10 172.93 2dcq s SER 8 N -3.15 3.04 0.16 1.64 0.01 -1.26 -0.90 113.70 113.23 2dcq s SER 8 Ca 0.28 2.09 -0.21 0.00 1.31 0.00 0.00 55.95 59.41 2dcq s SER 8 Cb -0.00 -2.54 0.05 0.00 0.21 0.00 0.00 66.02 63.74 2dcq s SER 8 CO 0.16 -3.01 1.64 0.00 0.41 0.00 0.00 173.24 172.43 2dcq h ALA 9 N -1.81 -0.04 0.00 1.44 0.00 -1.79 0.06 119.26 117.13 2dcq h ALA 9 Ca -0.44 0.10 -0.01 0.00 0.00 0.00 0.00 54.91 54.55 2dcq h ALA 9 Cb 1.27 0.47 -0.00 0.00 0.00 0.00 0.00 17.79 19.53 2dcq h ALA 9 CO 0.44 -0.62 -0.07 0.87 0.00 0.00 0.00 179.25 179.87 2dcq h LYS 10 N -0.19 0.00 -0.67 0.00 1.57 -1.91 -3.11 116.57 112.26 2dcq h LYS 10 Ca 0.16 0.00 0.14 0.00 -1.87 0.00 0.00 60.65 59.07 2dcq h LYS 10 Cb 0.43 0.00 -0.10 0.00 0.08 0.00 0.00 32.23 32.64 2dcq h LYS 10 CO -0.41 0.07 0.13 -0.97 -0.57 0.00 0.00 179.45 177.70 2dcq h ASN 11 N 0.00 -0.04 0.24 0.86 -0.73 -1.31 0.87 115.58 115.46 2dcq h ASN 11 Ca -0.00 0.13 -0.01 0.00 1.87 0.00 0.00 56.30 58.29 2dcq h ASN 11 Cb 0.41 0.19 0.00 0.00 0.27 0.00 0.00 38.32 39.20 2dcq h ASN 11 CO 0.01 -0.03 -0.11 0.00 -0.37 0.00 0.00 177.43 176.92 2dcq h ALA 12 N 1.55 -0.32 -0.97 1.57 0.00 -1.66 -3.11 119.26 116.32 2dcq h ALA 12 Ca 0.36 -0.20 0.02 0.00 0.00 0.00 0.00 54.91 55.09 2dcq h ALA 12 Cb 0.58 0.12 -0.05 0.00 0.00 0.00 0.00 17.79 18.44 2dcq h ALA 12 CO -0.47 -0.41 0.64 -0.92 0.00 0.00 0.00 179.25 178.08 2dcq h TYR 13 N -0.86 1.20 -0.68 0.00 3.20 -1.51 -0.07 116.97 118.26 2dcq h TYR 13 Ca -0.03 0.03 0.11 0.00 3.14 0.00 0.00 58.73 61.98 2dcq h TYR 13 Cb 0.51 -0.40 -0.08 0.00 1.54 0.00 0.00 36.73 38.30 2dcq h TYR 13 CO 0.06 0.72 0.26 1.15 -1.64 0.00 0.00 178.16 178.71 2dcq h THR 14 N 1.27 0.72 -0.23 1.81 2.02 -0.95 -2.90 112.91 114.65 2dcq h THR 14 Ca 0.37 -0.15 -0.03 0.00 0.77 0.00 0.00 66.41 67.38 2dcq h THR 14 Cb -0.07 0.25 -0.01 0.00 -1.74 0.00 0.00 68.15 66.59 2dcq h THR 14 CO -0.10 0.08 0.03 0.11 0.37 0.00 0.00 175.52 176.01 2dcq h LYS 15 N 0.43 0.38 -0.82 6.66 1.79 -0.95 -2.67 116.57 121.39 2dcq h LYS 15 Ca 0.35 -0.10 0.19 0.00 -2.18 0.00 0.00 60.65 58.91 2dcq h LYS 15 Cb 0.48 -0.04 -0.05 0.00 -1.58 0.00 0.00 32.23 31.04 2dcq h LYS 15 CO -0.35 0.53 0.55 -0.07 -1.08 0.00 0.00 179.45 179.03 2dcq h LEU 16 N 0.17 0.29 -0.54 2.94 4.07 -1.21 0.86 115.31 121.89 2dcq h LEU 16 Ca 0.07 0.03 0.00 0.00 0.08 0.00 0.00 57.88 58.05 2dcq h LEU 16 Cb 0.34 -0.03 0.00 0.00 1.08 0.00 0.00 40.66 42.05 2dcq h LEU 16 CO 0.01 0.13 0.00 0.61 -1.08 0.00 0.00 178.44 178.10 2dcq n GLY 17 N -1.56 -0.44 0.00 0.83 0.00 -1.01 -3.66 105.19 99.34 2dcq n GLY 17 Ca 0.17 -0.33 0.00 0.00 0.00 0.00 0.00 46.02 45.85 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 -0.34 0.00 -3.54 2.61 5.66 -0.17 -4.95 114.28 113.55 2dcq n THR 18 Ca 0.21 -0.27 -0.41 0.00 -3.05 0.00 0.00 64.05 60.53 2dcq n THR 18 Cb 0.24 0.80 -0.08 0.00 -1.55 0.00 0.00 70.33 69.74 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 -1.14 5.78 0.65 1.09 1.11 0.12 -4.93 116.67 119.35 2dcq s ASP 19 Ca 0.00 -2.11 0.40 0.00 0.18 0.00 0.00 52.55 51.02 2dcq s ASP 19 Cb 0.00 -2.02 2.18 0.00 1.07 0.00 0.00 42.92 44.15 2dcq s ASP 19 CO 0.00 -0.65 2.23 0.44 1.18 0.00 0.00 175.17 178.37 2dcq h ASP 20 N 8.22 0.00 -0.10 0.27 5.19 -1.88 -1.33 116.42 126.79 2dcq h ASP 20 Ca -0.16 0.00 0.00 0.00 -0.62 0.00 0.00 57.03 56.25 2dcq h ASP 20 Cb 1.06 0.00 0.00 0.00 0.18 0.00 0.00 39.33 40.57 2dcq h ASP 20 CO 0.84 0.00 0.00 0.59 -3.12 0.00 0.00 179.24 177.55 2dcq n ASN 21 N -2.99 2.53 -4.76 6.45 3.02 -1.26 -5.00 115.26 113.26 2dcq n ASN 21 Ca -0.03 -1.73 -0.30 0.00 -0.03 0.00 0.00 54.58 52.49 2dcq n ASN 21 Cb 0.15 -0.06 0.11 0.00 -0.61 0.00 0.00 39.78 39.37 2dcq n ASN 21 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2dcq s ALA 22 N -1.30 1.93 0.29 5.41 0.00 -0.50 -2.81 121.76 124.78 2dcq s ALA 22 Ca 0.22 -0.02 0.02 0.00 0.00 0.00 0.00 51.96 52.18 2dcq s ALA 22 Cb 0.14 -3.19 -0.03 0.00 0.00 0.00 0.00 23.12 20.05 2dcq s ALA 22 CO 0.21 -2.01 0.27 -0.65 0.00 0.00 0.00 175.76 173.58 2dcq s GLN 23 N -4.99 1.60 -0.05 0.00 -1.52 -0.75 -4.87 119.66 109.08 2dcq s GLN 23 Ca 0.62 -1.82 0.01 0.00 -1.95 0.00 0.00 55.36 52.21 2dcq s GLN 23 Cb -0.17 0.33 0.02 0.00 -0.22 0.00 0.00 33.01 32.98 2dcq s GLN 23 CO 0.56 -0.59 -0.04 -1.17 -0.25 0.00 0.00 175.29 173.80 2dcq s LEU 24 N -3.27 1.18 -0.46 2.90 1.98 -1.26 -2.10 118.68 117.66 2dcq s LEU 24 Ca 0.38 -0.13 -0.00 0.00 -2.89 0.00 0.00 54.13 51.48 2dcq s LEU 24 Cb 0.03 -0.47 0.12 0.00 0.66 0.00 0.00 46.19 46.53 2dcq s LEU 24 CO 0.21 -0.08 0.23 -0.22 -1.89 0.00 0.00 176.35 174.60 2dcq s LEU 25 N 1.16 5.02 -0.84 -0.68 1.98 -0.42 -1.16 118.68 123.74 2dcq s LEU 25 Ca -0.07 -2.37 -0.25 0.00 -2.89 0.00 0.00 54.13 48.54 2dcq s LEU 25 Cb -0.14 -1.76 0.04 0.00 0.66 0.00 0.00 46.19 44.99 2dcq s LEU 25 CO -0.01 -0.43 1.32 -0.62 -1.89 0.00 0.00 176.35 174.72 2dcq s ASP 26 N 1.08 6.29 0.00 3.68 -1.08 0.19 -0.98 116.67 125.85 2dcq s ASP 26 Ca 0.12 -0.87 0.26 0.00 -0.52 0.00 0.00 52.55 51.54 2dcq s ASP 26 Cb -0.22 -2.55 1.46 0.00 -1.46 0.00 0.00 42.92 40.15 2dcq s ASP 26 CO -0.04 -1.68 1.95 2.30 0.52 0.00 0.00 175.17 178.21 2dcq n ILE 27 N 6.50 0.01 -1.26 4.11 -5.35 0.20 -1.27 119.36 122.31 2dcq n ILE 27 Ca 0.13 -0.04 -0.33 0.00 -0.27 0.00 0.00 62.75 62.25 2dcq n ILE 27 Cb 0.49 -0.29 0.11 0.00 -1.74 0.00 0.00 39.64 38.21 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 -1.99 1.95 0.71 6.28 0.52 -1.24 -3.45 118.95 121.75 2dcq s ARG 28 Ca 0.38 1.57 -0.14 0.00 -0.52 0.00 0.00 55.73 57.02 2dcq s ARG 28 Cb 0.18 -1.83 0.03 0.00 0.52 0.00 0.00 34.95 33.85 2dcq s ARG 28 CO 0.30 -1.94 1.15 0.00 0.02 0.00 0.00 175.30 174.83 2dcq s ALA 29 N -2.34 2.25 0.59 2.13 0.00 -1.26 -4.15 121.76 118.98 2dcq s ALA 29 Ca 0.69 0.64 0.32 0.00 0.00 0.00 0.00 51.96 53.62 2dcq s ALA 29 Cb -0.25 -3.38 1.89 0.00 0.00 0.00 0.00 23.12 21.39 2dcq s ALA 29 CO 0.50 -1.65 2.26 1.15 0.00 0.00 0.00 175.76 178.02 2dcq h THR 30 N -0.33 0.44 0.00 0.00 2.02 -1.98 -0.79 112.91 112.28 2dcq h THR 30 Ca -0.46 -0.05 -0.01 0.00 0.77 0.00 0.00 66.41 66.65 2dcq h THR 30 Cb 1.26 1.03 -0.00 0.00 -1.74 0.00 0.00 68.15 68.70 2dcq h THR 30 CO 0.51 0.01 -0.20 0.00 0.37 0.00 0.00 175.52 176.21 2dcq h ALA 31 N 1.99 0.90 0.00 6.16 0.00 -2.02 -3.25 119.26 123.04 2dcq h ALA 31 Ca -0.00 -0.05 -0.04 0.00 0.00 0.00 0.00 54.91 54.82 2dcq h ALA 31 Cb 0.03 -0.00 -0.01 0.00 0.00 0.00 0.00 17.79 17.81 2dcq h ALA 31 CO 0.00 0.07 -0.19 -0.44 0.00 0.00 0.00 179.25 178.69 2dcq h ASP 32 N 0.00 0.00 0.00 0.00 5.19 -1.49 -1.90 116.42 118.22 2dcq h ASP 32 Ca -0.00 0.00 0.00 0.00 -0.62 0.00 0.00 57.03 56.41 2dcq h ASP 32 Cb 1.04 0.00 0.00 0.00 0.18 0.00 0.00 39.33 40.55 2dcq h ASP 32 CO 0.01 0.19 0.00 0.49 -3.12 0.00 0.00 179.24 176.81 2dcq n PHE 33 N -3.94 0.00 0.01 4.55 3.72 -1.23 -0.76 117.46 119.81 2dcq n PHE 33 Ca -0.02 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.38 2dcq n PHE 33 Cb 0.28 0.00 0.00 0.00 -0.94 0.00 0.00 39.48 38.82 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 -0.93 0.00 -0.08 -1.08 5.12 -0.89 -3.88 116.66 114.93 2dcq n ARG 34 Ca 0.12 0.00 -0.14 0.00 -1.93 0.00 0.00 57.85 55.90 2dcq n ARG 34 Cb 0.05 -0.38 -0.05 0.00 -1.16 0.00 0.00 32.46 30.93 2dcq n ARG 34 CO 0.00 0.00 0.00 -0.56 -1.93 0.00 0.00 177.63 175.14 2dcq h GLN 35 N 0.00 0.64 0.00 5.56 3.07 -1.41 -3.42 115.11 119.54 2dcq h GLN 35 Ca 0.00 -0.36 -0.13 0.00 0.09 0.00 0.00 58.65 58.25 2dcq h GLN 35 Cb 0.69 0.02 -0.02 0.00 0.08 0.00 0.00 27.48 28.25 2dcq h GLN 35 CO 0.00 0.96 -1.22 0.28 0.09 0.00 0.00 178.83 178.95 2dcq n VAL 36 N -4.30 1.16 0.00 1.86 0.31 0.06 -4.30 118.33 113.13 2dcq n VAL 36 Ca -0.05 0.02 0.00 0.00 -0.01 0.00 0.00 64.34 64.31 2dcq n VAL 36 Cb 0.48 -1.89 0.00 0.00 -0.91 0.00 0.00 33.84 31.51 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 2.14 0.63 3.31 2.92 0.00 -0.01 -4.14 105.19 110.05 2dcq n GLY 37 Ca -0.20 -2.21 -0.18 0.00 0.00 0.00 0.00 46.02 43.43 2dcq n GLY 37 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2dcq s SER 38 N -2.37 2.39 0.21 1.61 0.01 -1.26 -3.89 113.70 110.39 2dcq s SER 38 Ca 0.00 -0.97 -0.30 0.00 1.31 0.00 0.00 55.95 55.99 2dcq s SER 38 Cb 0.00 -0.11 -0.09 0.00 0.21 0.00 0.00 66.02 66.03 2dcq s SER 38 CO 0.00 -0.17 1.30 -2.16 0.41 0.00 0.00 173.24 172.62 2dcq s PRO 39 N -3.39 4.40 -0.51 12.44 0.04 -1.26 -0.23 135.00 146.48 2dcq s PRO 39 Ca 0.19 2.05 -0.19 0.00 0.04 0.00 0.00 61.00 63.09 2dcq s PRO 39 Cb -0.02 -3.19 0.06 0.00 0.04 0.00 0.00 34.50 31.40 2dcq s PRO 39 CO 0.05 -0.23 0.60 1.21 0.04 0.00 0.00 177.00 178.67 2dcq s ASN 40 N 0.25 6.21 0.00 6.66 2.47 -1.24 -4.60 114.94 124.69 2dcq s ASN 40 Ca 0.56 -0.99 0.10 0.00 0.42 0.00 0.00 52.86 52.95 2dcq s ASN 40 Cb -0.36 -2.28 0.24 0.00 -1.45 0.00 0.00 41.25 37.39 2dcq s ASN 40 CO 0.39 -0.87 1.14 2.30 -3.72 0.00 0.00 177.10 176.34 2dcq n ILE 41 N 5.56 0.78 0.20 -5.21 -5.35 -1.26 -4.45 119.36 109.63 2dcq n ILE 41 Ca -0.07 -0.89 0.05 0.00 -0.27 0.00 0.00 62.75 61.56 2dcq n ILE 41 Cb 0.45 0.65 0.40 0.00 -1.74 0.00 0.00 39.64 39.41 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 1.88 0.00 0.00 6.28 3.11 -1.65 0.09 116.57 126.27 2dcq h LYS 42 Ca 0.00 0.00 0.00 0.00 -2.81 0.00 0.00 60.65 57.84 2dcq h LYS 42 Cb 0.65 0.00 0.00 0.00 -1.00 0.00 0.00 32.23 31.88 2dcq h LYS 42 CO 0.00 0.34 0.00 0.41 -2.81 0.00 0.00 179.45 177.39 2dcq n GLY 43 N -0.34 -0.89 0.10 5.01 0.00 -1.26 -1.82 105.19 105.99 2dcq n GLY 43 Ca -0.02 0.15 -0.17 0.00 0.00 0.00 0.00 46.02 45.99 2dcq n GLY 43 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 2dcq n LEU 44 N -2.15 1.85 0.00 0.99 4.77 -0.07 -5.03 117.00 117.36 2dcq n LEU 44 Ca -0.01 0.49 0.00 0.00 -0.03 0.00 0.00 56.01 56.46 2dcq n LEU 44 Cb 0.06 -0.93 0.00 0.00 -2.33 0.00 0.00 43.42 40.23 2dcq n LEU 44 CO 0.10 0.04 0.00 0.61 -1.33 0.00 0.00 177.39 176.81 2dcq n GLY 45 N 1.48 0.03 3.66 -0.72 0.00 -0.66 -5.01 105.19 103.96 2dcq n GLY 45 Ca -0.25 -0.07 -0.09 0.00 0.00 0.00 0.00 46.02 45.62 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 -1.26 1.60 0.60 1.61 0.00 -1.15 -4.80 119.74 116.34 2dcq s LYS 46 Ca 0.00 -1.16 -0.09 0.00 0.00 0.00 0.00 55.97 54.72 2dcq s LYS 46 Cb 0.00 0.51 -0.02 0.00 0.00 0.00 0.00 37.83 38.32 2dcq s LYS 46 CO 0.00 -0.69 0.96 0.21 0.00 0.00 0.00 175.35 175.83 2dcq s LYS 47 N -3.98 3.34 0.96 1.78 2.47 -1.26 -1.74 119.74 121.31 2dcq s LYS 47 Ca 0.19 0.44 -0.12 0.00 -1.56 0.00 0.00 55.97 54.91 2dcq s LYS 47 Cb -0.02 -2.18 0.17 0.00 -1.46 0.00 0.00 37.83 34.34 2dcq s LYS 47 CO 0.08 -0.58 1.09 0.00 0.16 0.00 0.00 175.35 176.09 2dcq s ALA 48 N -3.07 1.10 -0.40 3.13 0.00 -1.26 -4.83 121.76 116.42 2dcq s ALA 48 Ca 0.53 -0.05 -0.14 0.00 0.00 0.00 0.00 51.96 52.30 2dcq s ALA 48 Cb -0.11 -3.22 0.02 0.00 0.00 0.00 0.00 23.12 19.82 2dcq s ALA 48 CO 0.50 -2.72 0.29 0.08 0.00 0.00 0.00 175.76 173.90 2dcq s VAL 49 N -2.83 5.17 -0.42 0.00 1.01 -0.31 -4.96 120.40 118.07 2dcq s VAL 49 Ca 0.65 -0.67 -0.29 0.00 0.00 0.00 0.00 61.98 61.67 2dcq s VAL 49 Cb -0.20 -3.88 0.01 0.00 0.00 0.00 0.00 36.38 32.32 2dcq s VAL 49 CO 0.58 -0.29 1.42 -0.44 0.00 0.00 0.00 175.10 176.37 2dcq s SER 50 N 1.66 6.32 -0.25 3.32 0.01 -1.26 -0.63 113.70 122.86 2dcq s SER 50 Ca 0.05 0.82 -0.03 0.00 1.31 0.00 0.00 55.95 58.10 2dcq s SER 50 Cb -0.19 -2.54 0.10 0.00 0.21 0.00 0.00 66.02 63.60 2dcq s SER 50 CO 0.10 -1.45 0.20 -0.89 0.41 0.00 0.00 173.24 171.60 2dcq s THR 51 N 5.49 -0.24 -0.10 1.44 2.01 -0.40 -4.96 115.64 118.89 2dcq s THR 51 Ca 0.62 -0.44 -0.33 0.00 0.31 0.00 0.00 61.69 61.85 2dcq s THR 51 Cb -0.14 -0.85 -0.10 0.00 0.01 0.00 0.00 72.50 71.42 2dcq s THR 51 CO 0.33 -0.46 1.97 0.52 -0.69 0.00 0.00 174.62 176.29 2dcq n VAL 52 N 5.29 0.56 -2.42 3.82 0.31 -1.26 -4.01 118.33 120.62 2dcq n VAL 52 Ca -0.05 -0.17 -0.35 0.00 -0.01 0.00 0.00 64.34 63.76 2dcq n VAL 52 Cb 0.46 -2.04 -0.02 0.00 -0.91 0.00 0.00 33.84 31.33 2dcq n VAL 52 CO 0.00 0.00 0.00 -0.47 -1.32 0.00 0.00 176.83 175.04 2dcq s TYR 53 N 5.00 2.92 0.15 3.52 5.04 -1.22 -5.02 117.35 127.73 2dcq s TYR 53 Ca 0.95 1.57 -0.05 0.00 -2.44 0.00 0.00 57.07 57.10 2dcq s TYR 53 Cb -0.61 -3.18 -0.02 0.00 0.35 0.00 0.00 41.96 38.49 2dcq s TYR 53 CO 0.48 -1.12 0.17 0.54 -1.34 0.00 0.00 175.55 174.27 2dcq s ASN 54 N -1.78 0.18 -0.11 4.32 2.20 -1.26 -5.05 114.94 113.44 2dcq s ASN 54 Ca 0.67 -1.04 0.16 0.00 -0.94 0.00 0.00 52.86 51.70 2dcq s ASN 54 Cb -0.21 0.36 0.56 0.00 -2.00 0.00 0.00 41.25 39.97 2dcq s ASN 54 CO 0.25 -0.81 1.48 0.61 -2.94 0.00 0.00 177.10 175.69 2dcq n GLY 55 N -0.15 3.18 0.09 0.45 0.00 -1.26 -4.58 105.19 102.93 2dcq n GLY 55 Ca -0.06 -0.80 -0.17 0.00 0.00 0.00 0.00 46.02 44.99 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 2.84 0.10 -2.06 1.61 4.81 -2.03 -3.42 114.58 116.43 2dcq h GLU 56 Ca 0.00 -0.17 -0.57 0.00 -0.13 0.00 0.00 59.36 58.50 2dcq h GLU 56 Cb 1.30 0.06 -0.39 0.00 0.63 0.00 0.00 28.75 30.35 2dcq h GLU 56 CO 0.19 1.08 -1.03 -0.40 -0.73 0.00 0.00 179.01 178.11 2dcq n ASP 57 N -4.39 0.61 -0.10 1.04 5.75 -1.26 -5.04 116.55 113.16 2dcq n ASP 57 Ca -0.16 -2.77 -0.03 0.00 -0.01 0.00 0.00 54.79 51.82 2dcq n ASP 57 Cb 0.64 -0.64 -0.02 0.00 -1.03 0.00 0.00 41.12 40.06 2dcq n ASP 57 CO 0.00 0.00 0.00 0.29 -0.11 0.00 0.00 177.20 177.38 2dcq n LYS 58 N 1.43 -0.11 0.23 0.11 4.76 -1.26 -0.79 118.16 122.53 2dcq n LYS 58 Ca 0.23 1.07 0.06 0.00 -2.87 0.00 0.00 58.31 56.80 2dcq n LYS 58 Cb 0.51 -1.59 0.54 0.00 -1.84 0.00 0.00 35.03 32.65 2dcq n LYS 58 CO 0.00 0.00 0.00 -1.00 -1.37 0.00 0.00 177.40 175.03 2dcq h PRO 59 N 0.00 0.00 0.00 1.97 0.13 -1.97 -2.34 132.00 129.79 2dcq h PRO 59 Ca 0.04 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.17 2dcq h PRO 59 Cb 0.10 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.23 2dcq h PRO 59 CO -0.23 0.14 0.00 0.41 -0.23 0.00 0.00 178.00 178.09 2dcq n GLY 60 N -1.13 -0.79 0.18 1.56 0.00 0.03 -2.97 105.19 102.07 2dcq n GLY 60 Ca -0.03 -0.10 -0.20 0.00 0.00 0.00 0.00 46.02 45.69 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 -0.81 0.00 0.31 1.61 7.35 -0.48 -4.53 117.46 120.91 2dcq n PHE 61 Ca 0.12 0.00 0.20 0.00 -0.76 0.00 0.00 57.45 57.00 2dcq n PHE 61 Cb 0.05 -0.86 1.05 0.00 0.35 0.00 0.00 39.48 40.07 2dcq n PHE 61 CO 0.00 0.00 0.00 -0.07 -0.76 0.00 0.00 176.76 175.93 2dcq h LEU 62 N -0.40 0.00 -2.03 -2.13 3.38 -1.54 -2.75 115.31 109.84 2dcq h LEU 62 Ca -0.55 0.00 0.12 0.00 0.09 0.00 0.00 57.88 57.54 2dcq h LEU 62 Cb 1.66 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 42.39 2dcq h LEU 62 CO -0.21 0.00 0.33 0.07 0.09 0.00 0.00 178.44 178.72 2dcq h LYS 63 N 0.00 0.00 -0.11 1.13 5.09 -1.79 -0.86 116.57 120.04 2dcq h LYS 63 Ca 0.00 0.00 -0.22 0.00 0.09 0.00 0.00 60.65 60.52 2dcq h LYS 63 Cb 0.11 0.00 0.01 0.00 0.10 0.00 0.00 32.23 32.46 2dcq h LYS 63 CO 0.00 0.00 -0.81 0.87 -2.09 0.00 0.00 179.45 177.42 2dcq h LYS 64 N 0.00 0.74 0.00 0.07 1.57 -1.82 -3.23 116.57 113.90 2dcq h LYS 64 Ca 0.20 -0.65 -0.02 0.00 -1.87 0.00 0.00 60.65 58.31 2dcq h LYS 64 Cb 0.87 0.15 -0.00 0.00 0.08 0.00 0.00 32.23 33.33 2dcq h LYS 64 CO -0.00 1.25 -0.11 -0.07 -0.57 0.00 0.00 179.45 179.95 2dcq h LEU 65 N 0.44 0.00 -0.98 2.94 4.07 -1.37 -2.59 115.31 117.83 2dcq h LEU 65 Ca -0.07 0.00 0.26 0.00 0.08 0.00 0.00 57.88 58.15 2dcq h LEU 65 Cb 1.45 0.00 -0.13 0.00 1.08 0.00 0.00 40.66 43.06 2dcq h LEU 65 CO 0.17 0.11 0.53 -1.28 -1.08 0.00 0.00 178.44 176.88 2dcq h SER 66 N 0.00 0.54 0.00 -0.43 0.87 -1.54 -2.49 113.55 110.49 2dcq h SER 66 Ca -0.00 0.16 -0.03 0.00 -1.23 0.00 0.00 61.79 60.68 2dcq h SER 66 Cb 0.21 0.09 -0.01 0.00 -0.44 0.00 0.00 62.40 62.25 2dcq h SER 66 CO 0.01 0.01 -1.22 0.18 -0.53 0.00 0.00 176.83 175.29 2dcq n LEU 67 N -4.97 0.00 0.19 2.23 4.32 -1.15 -4.49 117.00 113.13 2dcq n LEU 67 Ca 0.27 0.00 0.14 0.00 -0.02 0.00 0.00 56.01 56.40 2dcq n LEU 67 Cb 0.78 0.04 0.62 0.00 -1.62 0.00 0.00 43.42 43.24 2dcq n LEU 67 CO 0.14 0.04 0.92 0.11 -1.22 0.00 0.00 177.39 177.38 2dcq h LYS 68 N 0.00 0.00 -6.58 3.23 6.56 -1.37 -3.42 116.57 115.00 2dcq h LYS 68 Ca -0.05 0.00 -0.68 0.00 -1.06 0.00 0.00 60.65 58.86 2dcq h LYS 68 Cb 0.70 0.00 -0.28 0.00 -0.57 0.00 0.00 32.23 32.08 2dcq h LYS 68 CO 0.00 0.00 -0.88 -0.06 -2.06 0.00 0.00 179.45 176.45 2dcq s PHE 69 N -3.52 2.24 -0.08 -1.35 0.40 -0.95 -5.03 117.98 109.70 2dcq s PHE 69 Ca 0.02 -0.41 0.16 0.00 -0.60 0.00 0.00 56.93 56.09 2dcq s PHE 69 Cb 0.09 -1.39 -0.24 0.00 0.51 0.00 0.00 43.02 41.99 2dcq s PHE 69 CO 0.41 0.05 0.25 0.36 0.70 0.00 0.00 175.22 176.99 2dcq n LYS 70 N 2.08 0.87 -3.17 0.44 2.85 -1.26 -4.79 118.16 115.18 2dcq n LYS 70 Ca -0.16 -0.10 -0.18 0.00 -1.05 0.00 0.00 58.31 56.81 2dcq n LYS 70 Cb 0.52 -1.41 -0.03 0.00 -0.65 0.00 0.00 35.03 33.45 2dcq n LYS 70 CO 0.00 0.00 0.00 -3.47 -0.05 0.00 0.00 177.40 173.88 2dcq n ASP 71 N -2.31 0.56 0.02 -5.58 2.03 -1.26 -4.98 116.55 105.04 2dcq n ASP 71 Ca -0.13 -2.99 -0.02 0.00 0.52 0.00 0.00 54.79 52.17 2dcq n ASP 71 Cb 0.69 -0.49 0.26 0.00 -0.72 0.00 0.00 41.12 40.86 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 3.16 0.47 0.00 -0.67 0.13 -1.87 -1.49 132.00 131.73 2dcq h PRO 72 Ca 0.08 -0.14 0.00 0.00 -0.87 0.00 0.00 66.00 65.08 2dcq h PRO 72 Cb 0.96 -0.05 0.00 0.00 0.13 0.00 0.00 31.00 32.05 2dcq h PRO 72 CO 0.48 0.61 0.00 1.05 -0.23 0.00 0.00 178.00 179.90 2dcq h GLU 73 N 0.43 0.00 0.00 0.86 4.11 -1.90 -2.47 114.58 115.62 2dcq h GLU 73 Ca 0.08 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.51 2dcq h GLU 73 Cb 0.51 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.76 2dcq h GLU 73 CO 0.03 0.00 -0.83 0.09 0.07 0.00 0.00 179.01 178.38 2dcq n ASN 74 N -3.06 1.43 -4.67 3.06 5.03 -1.13 -3.94 115.26 111.98 2dcq n ASN 74 Ca -0.00 -0.42 -0.42 0.00 0.87 0.00 0.00 54.58 54.60 2dcq n ASN 74 Cb 0.26 1.17 -0.03 0.00 -1.02 0.00 0.00 39.78 40.16 2dcq n ASN 74 CO 0.00 0.00 0.00 -0.89 -1.83 0.00 0.00 177.26 174.54 2dcq s THR 75 N -2.16 3.59 -0.49 3.41 2.01 -0.57 -4.86 115.64 116.56 2dcq s THR 75 Ca 0.01 0.82 -0.20 0.00 0.31 0.00 0.00 61.69 62.63 2dcq s THR 75 Cb 0.06 -3.53 0.04 0.00 0.01 0.00 0.00 72.50 69.09 2dcq s THR 75 CO 0.37 -0.05 0.66 -0.89 -0.69 0.00 0.00 174.62 174.02 2dcq s THR 76 N 3.45 4.81 0.39 -0.82 2.01 -1.12 -3.83 115.64 120.53 2dcq s THR 76 Ca 0.70 -0.20 -0.12 0.00 0.31 0.00 0.00 61.69 62.38 2dcq s THR 76 Cb -0.33 -4.28 -0.07 0.00 0.01 0.00 0.00 72.50 67.82 2dcq s THR 76 CO 0.28 -0.75 0.78 -0.22 -0.69 0.00 0.00 174.62 174.01 2dcq s LEU 77 N 2.82 3.88 -0.16 4.42 0.20 -1.15 -1.81 118.68 126.89 2dcq s LEU 77 Ca 0.19 1.22 -0.01 0.00 0.69 0.00 0.00 54.13 56.22 2dcq s LEU 77 Cb -0.17 -4.08 0.04 0.00 -0.43 0.00 0.00 46.19 41.55 2dcq s LEU 77 CO 0.15 -0.36 -0.03 -0.31 -0.29 0.00 0.00 176.35 175.52 2dcq s TYR 78 N -2.27 1.46 0.84 5.38 1.51 -0.89 -1.21 117.35 122.16 2dcq s TYR 78 Ca 0.53 -0.95 -0.11 0.00 -1.01 0.00 0.00 57.07 55.53 2dcq s TYR 78 Cb -0.10 -1.20 0.10 0.00 -0.11 0.00 0.00 41.96 40.65 2dcq s TYR 78 CO 0.27 -0.58 1.09 0.42 -1.11 0.00 0.00 175.55 175.64 2dcq s ILE 79 N 1.71 2.92 -0.07 2.71 1.09 -0.50 -1.30 121.20 127.76 2dcq s ILE 79 Ca 0.01 0.30 -0.03 0.00 -1.10 0.00 0.00 60.65 59.82 2dcq s ILE 79 Cb -0.15 -2.73 0.04 0.00 -1.06 0.00 0.00 42.46 38.55 2dcq s ILE 79 CO -0.07 -0.39 0.16 -0.22 -0.10 0.00 0.00 174.94 174.32 2dcq s LEU 80 N -6.13 0.53 0.42 2.97 0.20 -0.16 -4.26 118.68 112.24 2dcq s LEU 80 Ca 0.63 0.33 0.07 0.00 0.69 0.00 0.00 54.13 55.85 2dcq s LEU 80 Cb -0.18 0.38 -0.06 0.00 -0.43 0.00 0.00 46.19 45.90 2dcq s LEU 80 CO 0.57 -0.17 0.12 -0.62 -0.29 0.00 0.00 176.35 175.96 2dcq s ASP 81 N 1.41 4.22 0.08 3.68 2.15 -1.26 -0.63 116.67 126.32 2dcq s ASP 81 Ca -0.07 -1.21 -0.29 0.00 0.43 0.00 0.00 52.55 51.42 2dcq s ASP 81 Cb -0.12 -0.40 -0.17 0.00 -0.30 0.00 0.00 42.92 41.93 2dcq s ASP 81 CO -0.06 -0.53 1.67 0.11 -0.17 0.00 0.00 175.17 176.19 2dcq h LYS 82 N 1.53 -0.51 0.00 4.34 1.57 -1.92 -0.15 116.57 121.44 2dcq h LYS 82 Ca -0.43 0.03 0.00 0.00 -1.87 0.00 0.00 60.65 58.38 2dcq h LYS 82 Cb 1.25 0.12 0.00 0.00 0.08 0.00 0.00 32.23 33.68 2dcq h LYS 82 CO 0.74 -0.34 0.00 0.34 -0.57 0.00 0.00 179.45 179.62 2dcq n PHE 83 N -5.32 0.00 0.20 -1.35 -0.00 -1.26 0.10 117.46 109.84 2dcq n PHE 83 Ca -0.11 0.00 0.00 0.00 -0.00 0.00 0.00 57.45 57.34 2dcq n PHE 83 Cb 0.23 0.00 0.00 0.00 -0.00 0.00 0.00 39.48 39.71 2dcq n PHE 83 CO 0.00 0.00 0.00 -0.25 -0.00 0.00 0.00 176.76 176.51 2dcq n ASP 84 N -1.34 -2.86 0.00 -2.13 8.00 -1.26 -3.37 116.55 113.59 2dcq n ASP 84 Ca 0.00 0.76 0.00 0.00 0.71 0.00 0.00 54.79 56.26 2dcq n ASP 84 Cb 0.00 2.74 0.00 0.00 -0.02 0.00 0.00 41.12 43.84 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 -0.47 1.09 1.44 0.44 0.00 -1.26 -2.66 105.19 103.77 2dcq n GLY 85 Ca 0.00 0.55 -0.03 0.00 0.00 0.00 0.00 46.02 46.54 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 8.55 -0.39 -0.18 1.61 4.13 -1.26 -5.04 115.26 122.67 2dcq n ASN 86 Ca 0.00 -2.03 -0.05 0.00 1.68 0.00 0.00 54.58 54.18 2dcq n ASN 86 Cb 0.00 0.15 0.01 0.00 -1.54 0.00 0.00 39.78 38.40 2dcq n ASN 86 CO 0.00 0.00 0.00 0.28 0.28 0.00 0.00 177.26 177.82 2dcq h SER 87 N 0.53 -1.04 0.88 6.41 0.02 -1.89 -0.52 113.55 117.95 2dcq h SER 87 Ca -0.44 0.21 0.00 0.00 -0.84 0.00 0.00 61.79 60.72 2dcq h SER 87 Cb 1.51 0.52 0.00 0.00 0.14 0.00 0.00 62.40 64.58 2dcq h SER 87 CO -0.15 -0.29 0.00 -0.33 -1.14 0.00 0.00 176.83 174.92 2dcq h GLU 88 N -0.16 0.00 0.21 3.45 5.08 -1.87 -1.26 114.58 120.03 2dcq h GLU 88 Ca 0.23 0.00 -0.01 0.00 -1.00 0.00 0.00 59.36 58.58 2dcq h GLU 88 Cb 0.53 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.78 2dcq h GLU 88 CO -0.63 0.00 -0.10 1.25 -1.00 0.00 0.00 179.01 178.53 2dcq h LEU 89 N 0.00 -0.24 -1.56 1.33 7.12 -1.50 -3.30 115.31 117.16 2dcq h LEU 89 Ca 0.00 -0.25 -0.04 0.00 0.13 0.00 0.00 57.88 57.72 2dcq h LEU 89 Cb 0.44 0.06 -0.01 0.00 -0.53 0.00 0.00 40.66 40.62 2dcq h LEU 89 CO 0.00 0.29 -0.13 0.58 -0.13 0.00 0.00 178.44 179.05 2dcq h VAL 90 N -0.94 1.14 -0.11 1.05 2.07 -1.09 -1.30 116.25 117.08 2dcq h VAL 90 Ca -0.03 -0.63 0.03 0.00 0.82 0.00 0.00 66.70 66.89 2dcq h VAL 90 Cb 0.48 1.23 -0.00 0.00 -1.52 0.00 0.00 31.29 31.47 2dcq h VAL 90 CO 0.05 0.19 0.13 0.00 0.02 0.00 0.00 177.57 177.95 2dcq h ALA 91 N 1.76 1.66 -0.08 1.67 0.00 -1.34 -2.81 119.26 120.12 2dcq h ALA 91 Ca 0.02 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.93 2dcq h ALA 91 Cb 0.31 0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.10 2dcq h ALA 91 CO 0.02 -0.18 0.00 -0.85 0.00 0.00 0.00 179.25 178.24 2dcq n GLU 92 N -3.77 2.36 -0.08 0.00 0.28 -0.51 -3.41 120.64 115.52 2dcq n GLU 92 Ca -0.00 -2.12 -0.16 0.00 -0.16 0.00 0.00 57.16 54.72 2dcq n GLU 92 Cb 0.23 -1.32 -0.05 0.00 1.43 0.00 0.00 31.44 31.73 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 -0.71 1.30 -0.27 -1.84 7.94 -1.07 -4.56 117.00 117.80 2dcq n LEU 93 Ca 0.10 0.22 -0.00 0.00 -1.11 0.00 0.00 56.01 55.21 2dcq n LEU 93 Cb 0.49 -0.52 0.20 0.00 0.53 0.00 0.00 43.42 44.11 2dcq n LEU 93 CO 0.03 0.18 1.26 -0.37 -1.11 0.00 0.00 177.39 177.38 2dcq h VAL 94 N -0.62 1.22 -0.25 1.96 -1.51 -1.82 -2.32 116.25 112.91 2dcq h VAL 94 Ca -0.34 -0.40 0.05 0.00 -1.23 0.00 0.00 66.70 64.77 2dcq h VAL 94 Cb 1.22 -0.01 -0.04 0.00 -2.13 0.00 0.00 31.29 30.32 2dcq h VAL 94 CO -0.21 0.21 -0.04 0.00 -1.23 0.00 0.00 177.57 176.31 2dcq h ALA 95 N 1.47 0.19 0.00 5.19 0.00 -1.83 -0.68 119.26 123.61 2dcq h ALA 95 Ca 0.31 0.09 0.00 0.00 0.00 0.00 0.00 54.91 55.30 2dcq h ALA 95 Cb -0.13 0.16 0.00 0.00 0.00 0.00 0.00 17.79 17.82 2dcq h ALA 95 CO -0.07 -0.45 0.00 1.28 0.00 0.00 0.00 179.25 180.01 2dcq n LEU 96 N -5.19 0.00 -1.80 0.00 4.32 -0.91 -2.16 117.00 111.26 2dcq n LEU 96 Ca -0.01 0.00 -0.05 0.00 -0.02 0.00 0.00 56.01 55.93 2dcq n LEU 96 Cb 0.14 0.00 0.07 0.00 -1.62 0.00 0.00 43.42 42.01 2dcq n LEU 96 CO 0.23 0.00 0.15 0.59 -1.22 0.00 0.00 177.39 177.14 2dcq n ASN 97 N -0.95 2.45 0.00 -1.43 3.02 -0.30 -4.98 115.26 113.07 2dcq n ASN 97 Ca 0.13 -2.95 0.00 0.00 -0.03 0.00 0.00 54.58 51.72 2dcq n ASN 97 Cb 0.06 -0.41 0.00 0.00 -0.61 0.00 0.00 39.78 38.82 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 -0.52 0.98 3.83 7.41 0.00 -0.92 -4.94 105.19 111.04 2dcq n GLY 98 Ca 0.20 -0.02 -0.26 0.00 0.00 0.00 0.00 46.02 45.94 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 -2.00 2.08 0.00 1.61 0.40 -0.97 -3.59 117.98 115.50 2dcq s PHE 99 Ca 0.00 -0.74 0.00 0.00 -0.60 0.00 0.00 56.93 55.59 2dcq s PHE 99 Cb 0.00 -1.92 0.00 0.00 0.51 0.00 0.00 43.02 41.61 2dcq s PHE 99 CO 0.00 -0.14 0.15 1.17 0.70 0.00 0.00 175.22 177.11 2dcq n LYS 100 N -1.51 0.00 -3.65 0.44 3.00 -1.19 -4.42 118.16 110.83 2dcq n LYS 100 Ca -0.03 0.39 -0.12 0.00 -0.00 0.00 0.00 58.31 58.55 2dcq n LYS 100 Cb 0.64 -0.98 -0.07 0.00 0.00 0.00 0.00 35.03 34.62 2dcq n LYS 100 CO 0.00 0.00 0.00 -1.12 0.00 0.00 0.00 177.40 176.28 2dcq s SER 101 N -2.47 -0.77 0.32 3.14 0.01 -1.26 -4.75 113.70 107.92 2dcq s SER 101 Ca 0.00 1.38 0.04 0.00 1.31 0.00 0.00 55.95 58.68 2dcq s SER 101 Cb 0.00 1.35 -0.06 0.00 0.21 0.00 0.00 66.02 67.51 2dcq s SER 101 CO 0.00 -0.23 0.06 0.00 0.41 0.00 0.00 173.24 173.47 2dcq s ALA 102 N 0.80 2.31 0.10 1.44 0.00 -1.22 -2.92 121.76 122.28 2dcq s ALA 102 Ca -0.04 -2.04 0.00 0.00 0.00 0.00 0.00 51.96 49.88 2dcq s ALA 102 Cb -0.05 0.68 -0.04 0.00 0.00 0.00 0.00 23.12 23.70 2dcq s ALA 102 CO -0.06 -0.31 -0.02 0.71 0.00 0.00 0.00 175.76 176.08 2dcq s TYR 103 N -3.32 0.80 0.01 0.00 1.51 -0.35 -4.72 117.35 111.27 2dcq s TYR 103 Ca 0.36 -1.05 0.04 0.00 -1.01 0.00 0.00 57.07 55.41 2dcq s TYR 103 Cb 0.09 -0.49 -0.01 0.00 -0.11 0.00 0.00 41.96 41.43 2dcq s TYR 103 CO 0.15 -0.32 -0.13 0.00 -1.11 0.00 0.00 175.55 174.15 2dcq s ALA 104 N -3.82 1.07 -0.11 3.71 0.00 -1.24 -1.42 121.76 119.96 2dcq s ALA 104 Ca 0.14 -0.62 -0.18 0.00 0.00 0.00 0.00 51.96 51.30 2dcq s ALA 104 Cb 0.07 -0.24 -0.04 0.00 0.00 0.00 0.00 23.12 22.91 2dcq s ALA 104 CO -0.04 0.24 0.49 -1.50 0.00 0.00 0.00 175.76 174.95 2dcq s ILE 105 N -0.47 5.16 0.63 0.00 2.07 -1.26 -2.24 121.20 125.09 2dcq s ILE 105 Ca 0.04 0.99 -0.16 0.00 -1.41 0.00 0.00 60.65 60.11 2dcq s ILE 105 Cb -0.06 -3.83 -0.02 0.00 0.13 0.00 0.00 42.46 38.69 2dcq s ILE 105 CO 0.00 0.33 1.12 -0.75 -1.91 0.00 0.00 174.94 173.73 2dcq s LYS 106 N 0.54 2.93 0.00 3.50 2.36 -0.08 -3.77 119.74 125.22 2dcq s LYS 106 Ca 0.27 1.46 0.00 0.00 -2.55 0.00 0.00 55.97 55.15 2dcq s LYS 106 Cb -0.15 -1.96 0.00 0.00 -1.05 0.00 0.00 37.83 34.66 2dcq s LYS 106 CO 0.11 -1.16 0.00 -0.25 1.55 0.00 0.00 175.35 175.61 2dcq n ASP 107 N -2.12 0.00 0.00 1.43 8.00 -1.25 -4.51 116.55 118.10 2dcq n ASP 107 Ca 0.11 0.00 0.00 0.00 0.71 0.00 0.00 54.79 55.61 2dcq n ASP 107 Cb 0.52 -1.54 0.00 0.00 -0.02 0.00 0.00 41.12 40.07 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 -2.00 2.29 0.09 0.44 0.00 -1.22 -1.62 105.19 103.18 2dcq n GLY 108 Ca 0.00 -0.28 -0.15 0.00 0.00 0.00 0.00 46.02 45.58 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 7.45 0.69 0.40 4.61 0.00 -0.07 -0.48 120.51 133.11 2dcq n ALA 109 Ca 0.00 -0.52 0.13 0.00 0.00 0.00 0.00 53.44 53.06 2dcq n ALA 109 Cb 0.00 -0.26 0.47 0.00 0.00 0.00 0.00 19.45 19.66 2dcq n ALA 109 CO 0.00 0.00 0.00 0.93 0.00 0.00 0.00 177.50 178.43 2dcq h GLU 110 N -1.00 0.00 -7.19 0.00 4.39 -0.47 -2.80 114.58 107.51 2dcq h GLU 110 Ca -0.22 0.00 -0.54 0.00 0.34 0.00 0.00 59.36 58.94 2dcq h GLU 110 Cb 1.00 0.00 0.17 0.00 -0.10 0.00 0.00 28.75 29.82 2dcq h GLU 110 CO -0.14 0.00 0.38 0.20 -1.16 0.00 0.00 179.01 178.29 2dcq s GLY 111 N -3.79 2.29 0.00 -3.84 0.00 -0.64 -4.86 107.32 96.48 2dcq s GLY 111 Ca 0.05 0.88 0.07 0.00 0.00 0.00 0.00 44.72 45.73 2dcq s GLY 111 CO 0.52 1.30 1.21 -1.55 0.00 0.00 0.00 173.10 174.58 2dcq n PRO 112 N -2.94 0.01 -0.59 2.90 -0.04 -1.26 -2.00 135.00 131.07 2dcq n PRO 112 Ca 0.14 0.37 0.00 0.00 -0.04 0.00 0.00 63.50 63.97 2dcq n PRO 112 Cb 0.50 -1.50 0.00 0.00 -0.04 0.00 0.00 33.50 32.46 2dcq n PRO 112 CO 0.00 0.00 0.00 0.54 -0.04 0.00 0.00 175.50 176.00 2dcq n ARG 113 N -1.49 0.00 0.00 0.54 5.12 -1.26 -4.99 116.66 114.58 2dcq n ARG 113 Ca 0.02 -1.04 0.00 0.00 -1.93 0.00 0.00 57.85 54.89 2dcq n ARG 113 Cb 0.08 -0.42 0.00 0.00 -1.16 0.00 0.00 32.46 30.96 2dcq n ARG 113 CO 0.00 0.00 0.00 0.41 -1.93 0.00 0.00 177.63 176.11 2dcq n GLY 114 N 0.05 1.01 0.05 -0.13 0.00 -0.85 -4.51 105.19 100.81 2dcq n GLY 114 Ca 0.00 -1.48 -0.13 0.00 0.00 0.00 0.00 46.02 44.42 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 0.00 -0.01 -3.63 1.61 2.91 -0.82 -3.39 115.95 112.62 2dcq h TRP 115 Ca 0.00 -0.00 -0.46 0.00 1.13 0.00 0.00 58.89 59.56 2dcq h TRP 115 Cb 0.00 0.00 0.19 0.00 -0.51 0.00 0.00 29.16 28.84 2dcq h TRP 115 CO 0.00 0.35 0.11 -0.51 -1.03 0.00 0.00 178.44 177.36 2dcq s LEU 116 N -9.48 1.42 -0.86 0.65 1.43 -1.06 -3.58 118.68 107.20 2dcq s LEU 116 Ca -0.15 1.51 0.00 0.00 -1.03 0.00 0.00 54.13 54.45 2dcq s LEU 116 Cb 0.03 -3.60 0.00 0.00 0.03 0.00 0.00 46.19 42.65 2dcq s LEU 116 CO 0.67 -3.63 0.00 -0.46 0.23 0.00 0.00 176.35 173.16 2dcq n ASN 117 N -4.54 -2.28 -0.02 2.29 0.23 -1.26 -4.77 115.26 104.92 2dcq n ASN 117 Ca 0.05 0.22 0.02 0.00 -0.53 0.00 0.00 54.58 54.34 2dcq n ASN 117 Cb 0.55 -2.27 0.03 0.00 -2.08 0.00 0.00 39.78 36.00 2dcq n ASN 117 CO 0.00 0.00 0.00 -1.20 -0.93 0.00 0.00 177.26 175.13 2dcq n SER 118 N -0.17 1.97 0.00 0.53 7.64 -1.23 -4.96 113.62 117.40 2dcq n SER 118 Ca -0.08 -2.17 0.00 0.00 1.01 0.00 0.00 58.87 57.63 2dcq n SER 118 Cb 0.31 -0.08 0.00 0.00 -1.01 0.00 0.00 64.21 63.43 2dcq n SER 118 CO 0.00 0.00 0.00 -0.24 -3.01 0.00 0.00 175.04 171.79 2dcq n SER 119 N -0.65 -0.80 -4.85 6.43 2.88 -1.26 -4.96 113.62 110.40 2dcq n SER 119 Ca 0.03 0.00 -0.32 0.00 -1.33 0.00 0.00 58.87 57.25 2dcq n SER 119 Cb 0.34 -0.13 -0.06 0.00 -0.75 0.00 0.00 64.21 63.60 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 0.00 4.08 0.86 2.46 1.43 -1.26 -5.06 118.68 121.19 2dcq s LEU 120 Ca 0.00 1.25 -0.11 0.00 -1.03 0.00 0.00 54.13 54.24 2dcq s LEU 120 Cb 0.00 -4.04 0.11 0.00 0.03 0.00 0.00 46.19 42.29 2dcq s LEU 120 CO 0.00 -0.19 1.10 -2.16 0.23 0.00 0.00 176.35 175.33 2dcq s PRO 121 N -2.94 1.51 0.18 1.29 0.04 -1.26 -4.91 135.00 128.91 2dcq s PRO 121 Ca 0.53 1.08 -0.11 0.00 0.04 0.00 0.00 61.00 62.54 2dcq s PRO 121 Cb -0.10 -1.82 0.00 0.00 0.04 0.00 0.00 34.50 32.62 2dcq s PRO 121 CO 0.18 -2.14 0.35 -0.46 0.04 0.00 0.00 177.00 174.97 2dcq s TRP 122 N -2.85 0.27 -0.14 0.56 -0.11 -1.26 -3.73 118.94 111.67 2dcq s TRP 122 Ca 0.63 -0.62 0.08 0.00 1.22 0.00 0.00 56.10 57.41 2dcq s TRP 122 Cb -0.19 0.07 -0.14 0.00 -1.50 0.00 0.00 33.47 31.71 2dcq s TRP 122 CO 0.57 -0.78 -0.01 -0.89 -4.62 0.00 0.00 176.95 171.22 2dcq n ILE 123 N -0.26 0.90 -1.31 5.86 5.41 0.68 -4.37 119.36 126.27 2dcq n ILE 123 Ca -0.08 -0.49 0.16 0.00 1.00 0.00 0.00 62.75 63.35 2dcq n ILE 123 Cb 0.63 -0.78 -0.07 0.00 -0.71 0.00 0.00 39.64 38.70 2dcq n ILE 123 CO 0.00 0.00 0.00 -1.84 0.00 0.00 0.00 176.55 174.71 2dcq n GLU 124 N -2.63 -2.92 -0.24 0.38 0.28 -1.25 -4.85 120.64 109.42 2dcq n GLU 124 Ca -0.23 2.28 -0.07 0.00 -0.16 0.00 0.00 57.16 58.97 2dcq n GLU 124 Cb 0.89 -3.45 0.06 0.00 1.43 0.00 0.00 31.44 30.36 2dcq n GLU 124 CO 0.00 0.00 0.00 -0.35 -0.16 0.00 0.00 177.13 176.62 2dcq n PRO 125 N -4.14 -1.56 -1.31 3.44 -0.04 -1.26 -4.52 135.00 125.62 2dcq n PRO 125 Ca -0.06 -0.42 -0.31 0.00 -0.04 0.00 0.00 63.50 62.68 2dcq n PRO 125 Cb 0.62 -0.39 0.09 0.00 -0.04 0.00 0.00 33.50 33.77 2dcq n PRO 125 CO 0.00 0.00 0.00 0.15 -0.04 0.00 0.00 175.50 175.61 2dcq s LYS 126 N -3.59 2.32 -0.29 0.54 3.01 -1.26 -4.95 119.74 115.52 2dcq s LYS 126 Ca 0.17 1.19 -0.28 0.00 -1.01 0.00 0.00 55.97 56.03 2dcq s LYS 126 Cb -0.02 -1.90 -0.03 0.00 -1.01 0.00 0.00 37.83 34.87 2dcq s LYS 126 CO 0.13 -1.60 2.01 0.15 0.51 0.00 0.00 175.35 176.55 2dcq s LYS 127 N -4.83 3.20 0.39 1.68 1.02 -1.26 -4.96 119.74 114.98 2dcq s LYS 127 Ca 0.62 1.69 0.05 0.00 0.02 0.00 0.00 55.97 58.34 2dcq s LYS 127 Cb -0.17 -4.29 -0.07 0.00 -0.52 0.00 0.00 37.83 32.78 2dcq s LYS 127 CO 0.55 -2.02 0.03 0.95 -0.92 0.00 0.00 175.35 173.93 2dcq s THR 128 N 7.72 1.59 -1.21 2.17 -4.23 -1.26 -5.06 115.64 115.36 2dcq s THR 128 Ca 0.89 -2.00 -0.19 0.00 -1.18 0.00 0.00 61.69 59.22 2dcq s THR 128 Cb -0.27 -2.82 -0.02 0.00 1.34 0.00 0.00 72.50 70.73 2dcq s THR 128 CO 0.34 0.00 1.96 -1.54 -0.54 0.00 0.00 174.62 174.84 2dcq n SER 129 N -0.92 3.76 0.00 3.99 3.41 -1.26 -4.18 113.62 118.41 2dcq n SER 129 Ca -0.06 -2.80 0.00 0.00 -0.26 0.00 0.00 58.87 55.75 2dcq n SER 129 Cb 0.67 -1.59 0.00 0.00 -0.26 0.00 0.00 64.21 63.03 2dcq n SER 129 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2dcq n GLY 130 N 4.90 -1.82 0.00 5.00 0.00 -1.26 -5.02 105.19 106.99 2dcq n GLY 130 Ca 0.49 0.79 0.06 0.00 0.00 0.00 0.00 46.02 47.37 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 0.00 0.15 0.18 1.61 -0.04 -1.26 -1.19 135.00 134.46 2dcq n PRO 131 Ca 0.00 0.19 0.14 0.00 -0.04 0.00 0.00 63.50 63.78 2dcq n PRO 131 Cb 0.00 -1.50 0.58 0.00 -0.04 0.00 0.00 33.50 32.54 2dcq n PRO 131 CO 0.00 0.00 0.00 0.77 -0.04 0.00 0.00 175.50 176.23 2dcq h SER 132 N 0.00 0.00 0.29 3.54 0.02 -1.96 -3.34 113.55 112.10 2dcq h SER 132 Ca 0.00 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.95 2dcq h SER 132 Cb 0.12 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.66 2dcq h SER 132 CO 0.00 0.00 -1.51 -0.24 -1.14 0.00 0.00 176.83 173.94 2dcq n SER 133 N -2.50 0.39 0.00 3.07 2.88 -0.33 -5.19 113.62 111.93 2dcq n SER 133 Ca 0.01 -0.07 0.00 0.00 -1.33 0.00 0.00 58.87 57.48 2dcq n SER 133 Cb 0.23 1.35 0.00 0.00 -0.75 0.00 0.00 64.21 65.03 2dcq n SER 133 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42