#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2dcq s SER 2 N 0.00 -0.05 0.00 1.61 0.01 -1.26 -5.05 113.70 108.96 2dcq s SER 2 Ca 0.00 0.09 0.00 0.00 1.31 0.00 0.00 55.95 57.35 2dcq s SER 2 Cb 0.00 0.15 0.00 0.00 0.21 0.00 0.00 66.02 66.38 2dcq s SER 2 CO 0.00 -0.05 0.00 -1.54 0.41 0.00 0.00 173.24 172.06 2dcq n SER 3 N 2.90 0.00 0.00 2.44 3.41 -1.26 -5.16 113.62 115.95 2dcq n SER 3 Ca -0.13 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.48 2dcq n SER 3 Cb 0.59 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 64.54 2dcq n SER 3 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2dcq n GLY 4 N 0.00 1.43 0.75 5.00 0.00 -1.26 -3.57 105.19 107.54 2dcq n GLY 4 Ca 0.00 -0.48 0.07 0.00 0.00 0.00 0.00 46.02 45.61 2dcq n GLY 4 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 2dcq n SER 5 N -2.25 2.88 -2.76 1.61 7.64 -1.26 -4.98 113.62 114.51 2dcq n SER 5 Ca 0.00 -1.87 -0.09 0.00 1.01 0.00 0.00 58.87 57.92 2dcq n SER 5 Cb 0.00 -0.20 0.07 0.00 -1.01 0.00 0.00 64.21 63.07 2dcq n SER 5 CO 0.00 0.00 0.00 -1.54 -3.01 0.00 0.00 175.04 170.49 2dcq n SER 6 N 0.82 -1.01 -3.29 6.43 3.41 -1.23 -3.39 113.62 115.36 2dcq n SER 6 Ca 0.13 -0.80 -0.02 0.00 -0.26 0.00 0.00 58.87 57.92 2dcq n SER 6 Cb 0.44 -0.30 0.02 0.00 -0.26 0.00 0.00 64.21 64.11 2dcq n SER 6 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2dcq n GLY 7 N 0.83 0.56 3.47 5.00 0.00 -0.93 -4.80 105.19 109.32 2dcq n GLY 7 Ca 0.05 -1.13 -0.31 0.00 0.00 0.00 0.00 46.02 44.63 2dcq n GLY 7 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 2dcq n SER 8 N -1.24 -1.38 -0.12 1.61 2.88 -1.26 -0.56 113.62 113.56 2dcq n SER 8 Ca -0.01 0.16 -0.07 0.00 -1.33 0.00 0.00 58.87 57.62 2dcq n SER 8 Cb 0.56 -1.25 0.01 0.00 -0.75 0.00 0.00 64.21 62.78 2dcq n SER 8 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 2dcq h ALA 9 N -2.00 0.47 0.00 -1.46 0.00 -1.76 -0.64 119.26 113.87 2dcq h ALA 9 Ca -0.49 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.42 2dcq h ALA 9 Cb 1.30 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 19.02 2dcq h ALA 9 CO 0.40 -0.15 0.00 0.87 0.00 0.00 0.00 179.25 180.37 2dcq h LYS 10 N 0.41 0.00 0.00 0.00 1.57 -1.91 -2.62 116.57 114.02 2dcq h LYS 10 Ca 0.16 0.00 -0.02 0.00 -1.87 0.00 0.00 60.65 58.92 2dcq h LYS 10 Cb 0.04 0.00 -0.00 0.00 0.08 0.00 0.00 32.23 32.35 2dcq h LYS 10 CO -0.09 0.00 -0.09 -0.97 -0.57 0.00 0.00 179.45 177.73 2dcq h ASN 11 N 0.00 0.00 0.00 0.86 -0.73 -1.44 -0.10 115.58 114.17 2dcq h ASN 11 Ca 0.00 0.00 -0.00 0.00 1.87 0.00 0.00 56.30 58.17 2dcq h ASN 11 Cb 0.61 0.00 -0.00 0.00 0.27 0.00 0.00 38.32 39.20 2dcq h ASN 11 CO 0.00 0.09 -0.12 0.00 -0.37 0.00 0.00 177.43 177.02 2dcq h ALA 12 N 1.91 0.00 -0.43 1.57 0.00 -1.34 -3.37 119.26 117.60 2dcq h ALA 12 Ca -0.00 -0.13 0.02 0.00 0.00 0.00 0.00 54.91 54.80 2dcq h ALA 12 Cb 0.21 0.12 -0.03 0.00 0.00 0.00 0.00 17.79 18.08 2dcq h ALA 12 CO 0.01 0.12 0.24 -0.92 0.00 0.00 0.00 179.25 178.70 2dcq h TYR 13 N -1.00 0.45 0.00 0.00 3.20 -1.38 0.07 116.97 118.31 2dcq h TYR 13 Ca -0.00 0.02 0.00 0.00 3.14 0.00 0.00 58.73 61.88 2dcq h TYR 13 Cb 0.15 -0.14 0.00 0.00 1.54 0.00 0.00 36.73 38.28 2dcq h TYR 13 CO -0.04 0.25 0.03 2.41 -1.64 0.00 0.00 178.16 179.17 2dcq n THR 14 N -4.87 1.07 -0.00 1.81 -1.04 -0.06 -2.01 114.28 109.19 2dcq n THR 14 Ca 0.02 0.72 0.03 0.00 -2.04 0.00 0.00 64.05 62.78 2dcq n THR 14 Cb 0.08 -1.72 0.07 0.00 -1.82 0.00 0.00 70.33 66.94 2dcq n THR 14 CO 0.00 0.00 0.00 0.29 -0.64 0.00 0.00 175.07 174.72 2dcq n LYS 15 N -2.17 2.08 0.01 -2.82 4.76 -0.04 -4.57 118.16 115.40 2dcq n LYS 15 Ca -0.01 -1.54 0.06 0.00 -2.87 0.00 0.00 58.31 53.95 2dcq n LYS 15 Cb 0.06 -1.14 -0.12 0.00 -1.84 0.00 0.00 35.03 32.00 2dcq n LYS 15 CO 0.00 0.00 0.00 -0.11 -1.37 0.00 0.00 177.40 175.92 2dcq n LEU 16 N 0.12 0.32 -1.78 -0.35 7.94 -0.85 -4.53 117.00 117.87 2dcq n LEU 16 Ca 0.05 0.13 0.00 0.00 -1.11 0.00 0.00 56.01 55.09 2dcq n LEU 16 Cb 0.29 0.07 0.06 0.00 0.53 0.00 0.00 43.42 44.37 2dcq n LEU 16 CO 0.04 0.05 0.11 0.61 -1.11 0.00 0.00 177.39 177.09 2dcq n GLY 17 N 1.34 2.54 0.10 -3.96 0.00 -1.26 -4.57 105.19 99.38 2dcq n GLY 17 Ca -0.08 -1.19 -0.12 0.00 0.00 0.00 0.00 46.02 44.63 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 -0.23 1.36 -4.96 2.61 5.66 -1.26 -4.96 114.28 112.51 2dcq n THR 18 Ca 0.13 -0.74 -0.32 0.00 -3.05 0.00 0.00 64.05 60.06 2dcq n THR 18 Cb 0.95 -0.75 -0.14 0.00 -1.55 0.00 0.00 70.33 68.84 2dcq n THR 18 CO 0.00 0.00 0.00 -0.62 -3.05 0.00 0.00 175.07 171.40 2dcq s ASP 19 N -5.70 3.78 0.45 1.09 2.15 -1.26 -5.03 116.67 112.16 2dcq s ASP 19 Ca -0.17 -0.30 0.22 0.00 0.43 0.00 0.00 52.55 52.73 2dcq s ASP 19 Cb 0.07 -1.00 1.07 0.00 -0.30 0.00 0.00 42.92 42.76 2dcq s ASP 19 CO 0.73 0.28 1.92 0.44 -0.17 0.00 0.00 175.17 178.38 2dcq h ASP 20 N 5.81 0.00 0.46 -0.34 3.32 -1.93 -3.03 116.42 120.71 2dcq h ASP 20 Ca -0.38 0.00 0.00 0.00 0.02 0.00 0.00 57.03 56.67 2dcq h ASP 20 Cb 1.17 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.72 2dcq h ASP 20 CO 0.51 0.23 -0.21 0.59 -1.72 0.00 0.00 179.24 178.64 2dcq n ASN 21 N -3.70 0.52 -4.77 6.45 3.02 -1.26 -4.82 115.26 110.71 2dcq n ASN 21 Ca -0.01 -0.41 -0.39 0.00 -0.03 0.00 0.00 54.58 53.74 2dcq n ASN 21 Cb 0.35 -0.02 -0.04 0.00 -0.61 0.00 0.00 39.78 39.46 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 -2.67 3.26 0.27 5.41 0.00 -1.15 -1.57 121.76 125.31 2dcq s ALA 22 Ca 0.22 0.80 0.02 0.00 0.00 0.00 0.00 51.96 53.00 2dcq s ALA 22 Cb 0.19 -3.30 -0.03 0.00 0.00 0.00 0.00 23.12 19.98 2dcq s ALA 22 CO 0.54 -0.17 0.24 -0.65 0.00 0.00 0.00 175.76 175.72 2dcq s GLN 23 N -1.91 1.52 -0.07 0.00 -1.52 -0.17 -4.89 119.66 112.62 2dcq s GLN 23 Ca 0.50 -1.79 0.01 0.00 -1.95 0.00 0.00 55.36 52.13 2dcq s GLN 23 Cb -0.27 0.32 0.02 0.00 -0.22 0.00 0.00 33.01 32.86 2dcq s GLN 23 CO 0.35 -0.55 -0.07 -1.17 -0.25 0.00 0.00 175.29 173.60 2dcq s LEU 24 N -3.25 1.28 -0.36 2.90 1.98 -1.26 -1.04 118.68 118.93 2dcq s LEU 24 Ca 0.38 -0.21 0.03 0.00 -2.89 0.00 0.00 54.13 51.44 2dcq s LEU 24 Cb 0.04 -0.65 0.10 0.00 0.66 0.00 0.00 46.19 46.35 2dcq s LEU 24 CO 0.19 -0.06 0.09 -0.22 -1.89 0.00 0.00 176.35 174.46 2dcq s LEU 25 N 1.18 4.19 -0.66 -0.68 1.98 -0.91 -2.01 118.68 121.78 2dcq s LEU 25 Ca -0.06 -2.18 -0.28 0.00 -2.89 0.00 0.00 54.13 48.72 2dcq s LEU 25 Cb -0.14 -1.47 0.03 0.00 0.66 0.00 0.00 46.19 45.26 2dcq s LEU 25 CO -0.02 -0.37 1.28 -0.62 -1.89 0.00 0.00 176.35 174.73 2dcq s ASP 26 N 0.87 6.25 0.00 3.68 -1.08 -0.37 -1.12 116.67 124.90 2dcq s ASP 26 Ca 0.12 -0.13 0.19 0.00 -0.52 0.00 0.00 52.55 52.20 2dcq s ASP 26 Cb -0.20 -2.56 0.70 0.00 -1.46 0.00 0.00 42.92 39.41 2dcq s ASP 26 CO -0.10 -1.70 1.51 2.30 0.52 0.00 0.00 175.17 177.70 2dcq n ILE 27 N 6.57 0.23 -1.31 4.11 -5.35 0.05 -1.25 119.36 122.40 2dcq n ILE 27 Ca 0.07 -0.33 -0.32 0.00 -0.27 0.00 0.00 62.75 61.89 2dcq n ILE 27 Cb 0.49 0.29 0.09 0.00 -1.74 0.00 0.00 39.64 38.77 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 -1.77 2.17 0.70 6.28 0.52 -1.25 -3.34 118.95 122.27 2dcq s ARG 28 Ca 0.30 1.36 -0.15 0.00 -0.52 0.00 0.00 55.73 56.72 2dcq s ARG 28 Cb 0.16 -1.87 0.02 0.00 0.52 0.00 0.00 34.95 33.78 2dcq s ARG 28 CO 0.24 -1.74 1.19 0.00 0.02 0.00 0.00 175.30 175.01 2dcq s ALA 29 N -2.61 2.22 0.32 2.13 0.00 -1.26 -4.07 121.76 118.49 2dcq s ALA 29 Ca 0.65 0.83 0.35 0.00 0.00 0.00 0.00 51.96 53.79 2dcq s ALA 29 Cb -0.20 -3.44 1.63 0.00 0.00 0.00 0.00 23.12 21.11 2dcq s ALA 29 CO 0.51 -1.70 2.09 1.15 0.00 0.00 0.00 175.76 177.81 2dcq h THR 30 N -0.12 0.16 0.00 0.00 2.02 -1.99 0.13 112.91 113.11 2dcq h THR 30 Ca -0.48 -0.43 -0.07 0.00 0.77 0.00 0.00 66.41 66.20 2dcq h THR 30 Cb 1.29 1.36 -0.01 0.00 -1.74 0.00 0.00 68.15 69.05 2dcq h THR 30 CO 0.51 0.04 -0.34 0.00 0.37 0.00 0.00 175.52 176.11 2dcq h ALA 31 N 1.96 0.95 0.00 6.16 0.00 -2.01 -3.31 119.26 123.01 2dcq h ALA 31 Ca -0.00 -0.31 -0.09 0.00 0.00 0.00 0.00 54.91 54.51 2dcq h ALA 31 Cb 0.36 -0.05 -0.01 0.00 0.00 0.00 0.00 17.79 18.08 2dcq h ALA 31 CO 0.01 0.42 -0.44 0.22 0.00 0.00 0.00 179.25 179.46 2dcq h ASP 32 N 0.00 0.00 0.34 0.00 3.58 -1.08 -0.46 116.42 118.79 2dcq h ASP 32 Ca -0.00 0.00 0.00 0.00 0.42 0.00 0.00 57.03 57.45 2dcq h ASP 32 Cb 0.92 0.00 0.00 0.00 1.72 0.00 0.00 39.33 41.97 2dcq h ASP 32 CO 0.04 0.44 0.00 0.49 -2.88 0.00 0.00 179.24 177.33 2dcq n PHE 33 N -3.43 0.00 -0.07 0.28 3.72 -1.22 -0.35 117.46 116.38 2dcq n PHE 33 Ca 0.00 0.00 -0.08 0.00 -0.05 0.00 0.00 57.45 57.33 2dcq n PHE 33 Cb 0.59 -0.45 -0.11 0.00 -0.94 0.00 0.00 39.48 38.56 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 -1.45 1.52 -0.10 -1.08 5.12 -0.26 -4.06 116.66 116.34 2dcq n ARG 34 Ca 0.03 0.00 -0.12 0.00 -1.93 0.00 0.00 57.85 55.84 2dcq n ARG 34 Cb 0.12 -1.38 -0.14 0.00 -1.16 0.00 0.00 32.46 29.91 2dcq n ARG 34 CO 0.00 0.00 0.00 0.00 -1.93 0.00 0.00 177.63 175.70 2dcq n GLN 35 N -2.58 0.84 -0.09 5.56 10.64 -0.73 -4.78 117.38 126.24 2dcq n GLN 35 Ca -0.25 0.04 -0.15 0.00 -1.83 0.00 0.00 57.00 54.82 2dcq n GLN 35 Cb 0.97 -1.48 -0.07 0.00 -0.86 0.00 0.00 30.24 28.80 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 -2.86 0.98 0.00 -0.39 0.31 0.52 -4.51 118.33 112.39 2dcq n VAL 36 Ca -0.34 -0.32 0.00 0.00 -0.01 0.00 0.00 64.34 63.66 2dcq n VAL 36 Cb 1.06 -1.35 0.00 0.00 -0.91 0.00 0.00 33.84 32.63 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 2.37 0.22 3.11 2.92 0.00 -0.40 -4.46 105.19 108.95 2dcq n GLY 37 Ca -0.32 -2.13 -0.08 0.00 0.00 0.00 0.00 46.02 43.49 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 -4.00 0.32 0.03 1.61 0.01 -1.26 -3.96 113.70 106.45 2dcq s SER 38 Ca 0.00 -0.78 -0.30 0.00 1.31 0.00 0.00 55.95 56.17 2dcq s SER 38 Cb 0.00 0.23 -0.05 0.00 0.21 0.00 0.00 66.02 66.41 2dcq s SER 38 CO 0.00 -0.59 1.24 -2.16 0.41 0.00 0.00 173.24 172.14 2dcq s PRO 39 N -3.45 4.39 -0.88 12.44 0.04 -1.26 -0.16 135.00 146.12 2dcq s PRO 39 Ca 0.02 1.80 -0.23 0.00 0.04 0.00 0.00 61.00 62.63 2dcq s PRO 39 Cb 0.04 -3.42 0.06 0.00 0.04 0.00 0.00 34.50 31.23 2dcq s PRO 39 CO -0.08 -0.36 1.27 1.21 0.04 0.00 0.00 177.00 179.08 2dcq s ASN 40 N 1.27 6.39 0.00 6.66 3.84 -1.25 -4.59 114.94 127.26 2dcq s ASN 40 Ca 0.59 -1.24 0.15 0.00 0.21 0.00 0.00 52.86 52.57 2dcq s ASN 40 Cb -0.29 -2.51 0.30 0.00 -0.55 0.00 0.00 41.25 38.19 2dcq s ASN 40 CO 0.27 -1.50 1.20 2.30 -2.79 0.00 0.00 177.10 176.58 2dcq n ILE 41 N 6.35 0.58 0.13 -5.21 -5.35 -1.26 -4.57 119.36 110.02 2dcq n ILE 41 Ca 0.18 -0.79 0.02 0.00 -0.27 0.00 0.00 62.75 61.90 2dcq n ILE 41 Cb 0.49 0.85 0.39 0.00 -1.74 0.00 0.00 39.64 39.63 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 2.89 0.21 0.00 6.28 3.11 -1.82 -0.99 116.57 126.24 2dcq h LYS 42 Ca 0.00 -0.05 0.00 0.00 -2.81 0.00 0.00 60.65 57.79 2dcq h LYS 42 Cb 0.74 -0.03 0.00 0.00 -1.00 0.00 0.00 32.23 31.95 2dcq h LYS 42 CO 0.00 0.38 0.00 0.41 -2.81 0.00 0.00 179.45 177.43 2dcq n GLY 43 N -0.82 -0.83 0.02 5.01 0.00 -1.26 -0.89 105.19 106.42 2dcq n GLY 43 Ca -0.01 0.00 0.13 0.00 0.00 0.00 0.00 46.02 46.14 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 -1.63 0.42 0.00 0.99 4.77 -0.38 -4.94 117.00 116.23 2dcq n LEU 44 Ca 0.02 0.20 0.00 0.00 -0.03 0.00 0.00 56.01 56.20 2dcq n LEU 44 Cb 0.10 -0.31 0.00 0.00 -2.33 0.00 0.00 43.42 40.88 2dcq n LEU 44 CO 0.09 0.05 0.00 0.61 -1.33 0.00 0.00 177.39 176.80 2dcq n GLY 45 N 1.46 3.99 3.50 -0.72 0.00 -0.07 -4.90 105.19 108.45 2dcq n GLY 45 Ca 0.06 -0.60 -0.11 0.00 0.00 0.00 0.00 46.02 45.37 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 1.28 0.63 1.61 0.00 -1.10 -4.98 119.74 117.18 2dcq s LYS 46 Ca 0.00 -0.52 -0.09 0.00 0.00 0.00 0.00 55.97 55.36 2dcq s LYS 46 Cb 0.00 0.56 -0.01 0.00 0.00 0.00 0.00 37.83 38.38 2dcq s LYS 46 CO 0.00 -0.56 1.00 0.21 0.00 0.00 0.00 175.35 176.00 2dcq s LYS 47 N -3.67 3.15 1.07 1.78 2.47 -1.26 -2.94 119.74 120.34 2dcq s LYS 47 Ca 0.03 0.41 -0.15 0.00 -1.56 0.00 0.00 55.97 54.70 2dcq s LYS 47 Cb -0.02 -2.13 0.22 0.00 -1.46 0.00 0.00 37.83 34.44 2dcq s LYS 47 CO -0.09 -0.74 1.11 0.00 0.16 0.00 0.00 175.35 175.79 2dcq s ALA 48 N -3.16 0.94 0.07 3.13 0.00 -1.26 -4.90 121.76 116.59 2dcq s ALA 48 Ca 0.55 -0.64 0.01 0.00 0.00 0.00 0.00 51.96 51.88 2dcq s ALA 48 Cb -0.11 -3.01 -0.04 0.00 0.00 0.00 0.00 23.12 19.97 2dcq s ALA 48 CO 0.50 -3.05 0.15 0.08 0.00 0.00 0.00 175.76 173.44 2dcq s VAL 49 N -3.06 5.00 -0.15 0.00 1.01 -0.85 -5.04 120.40 117.31 2dcq s VAL 49 Ca 0.68 -0.57 0.00 0.00 0.00 0.00 0.00 61.98 62.09 2dcq s VAL 49 Cb -0.14 -3.43 0.03 0.00 0.00 0.00 0.00 36.38 32.83 2dcq s VAL 49 CO 0.56 0.13 -0.11 -0.94 0.00 0.00 0.00 175.10 174.74 2dcq s SER 50 N -2.48 2.72 -0.26 3.32 1.04 -1.26 -1.23 113.70 115.54 2dcq s SER 50 Ca 0.32 -0.54 -0.01 0.00 0.48 0.00 0.00 55.95 56.20 2dcq s SER 50 Cb -0.13 -1.07 0.15 0.00 0.10 0.00 0.00 66.02 65.07 2dcq s SER 50 CO 0.25 -0.11 0.40 -0.89 0.98 0.00 0.00 173.24 173.88 2dcq s THR 51 N 1.54 -0.63 -0.01 2.02 2.01 -0.38 -4.97 115.64 115.22 2dcq s THR 51 Ca 0.03 -0.15 -0.32 0.00 0.31 0.00 0.00 61.69 61.56 2dcq s THR 51 Cb -0.14 -0.88 -0.11 0.00 0.01 0.00 0.00 72.50 71.38 2dcq s THR 51 CO -0.09 -0.17 1.89 0.52 -0.69 0.00 0.00 174.62 176.07 2dcq n VAL 52 N 5.36 0.58 -1.91 3.82 0.31 -1.26 -4.11 118.33 121.13 2dcq n VAL 52 Ca -0.02 -0.10 -0.40 0.00 -0.01 0.00 0.00 64.34 63.81 2dcq n VAL 52 Cb 0.50 -2.03 0.01 0.00 -0.91 0.00 0.00 33.84 31.41 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 3.83 2.60 -0.31 3.52 5.04 -1.21 -5.01 117.35 125.81 2dcq s TYR 53 Ca 0.89 1.33 -0.02 0.00 -2.44 0.00 0.00 57.07 56.83 2dcq s TYR 53 Cb -0.58 -3.81 0.11 0.00 0.35 0.00 0.00 41.96 38.03 2dcq s TYR 53 CO 0.46 -2.58 0.15 0.54 -1.34 0.00 0.00 175.55 172.78 2dcq s ASN 54 N -0.63 3.50 0.19 4.32 4.22 -1.26 -5.01 114.94 120.27 2dcq s ASN 54 Ca 0.60 -1.62 0.16 0.00 -2.14 0.00 0.00 52.86 49.86 2dcq s ASN 54 Cb -0.41 -0.48 0.78 0.00 1.28 0.00 0.00 41.25 42.42 2dcq s ASN 54 CO 0.53 -0.40 1.48 0.61 -2.04 0.00 0.00 177.10 177.28 2dcq n GLY 55 N 4.82 -0.87 0.37 0.45 0.00 -1.26 -1.48 105.19 107.22 2dcq n GLY 55 Ca -0.01 0.10 0.10 0.00 0.00 0.00 0.00 46.02 46.22 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 0.00 0.81 -2.25 1.61 4.81 -2.03 -3.35 114.58 114.18 2dcq h GLU 56 Ca 0.00 -0.05 -0.58 0.00 -0.13 0.00 0.00 59.36 58.60 2dcq h GLU 56 Cb 0.10 -0.18 -0.40 0.00 0.63 0.00 0.00 28.75 28.90 2dcq h GLU 56 CO 0.00 0.54 -0.93 -3.47 -0.73 0.00 0.00 179.01 174.42 2dcq n ASP 57 N -4.62 0.89 -0.23 1.04 2.03 -0.55 -5.01 116.55 110.10 2dcq n ASP 57 Ca 0.19 -2.78 -0.10 0.00 0.52 0.00 0.00 54.79 52.62 2dcq n ASP 57 Cb 0.44 -0.63 -0.08 0.00 -0.72 0.00 0.00 41.12 40.13 2dcq n ASP 57 CO 0.00 0.00 0.00 0.11 -1.92 0.00 0.00 177.20 175.39 2dcq h LYS 58 N 4.64 -0.14 -0.11 -0.67 1.79 -1.71 -1.98 116.57 118.39 2dcq h LYS 58 Ca 0.16 0.01 -0.07 0.00 -2.18 0.00 0.00 60.65 58.57 2dcq h LYS 58 Cb 0.84 0.03 0.00 0.00 -1.58 0.00 0.00 32.23 31.52 2dcq h LYS 58 CO 0.53 -0.09 -0.20 -1.00 -1.08 0.00 0.00 179.45 177.60 2dcq h PRO 59 N -0.14 0.33 -0.15 3.15 0.13 -1.95 -3.29 132.00 130.08 2dcq h PRO 59 Ca 0.10 -0.21 0.00 0.00 -0.87 0.00 0.00 66.00 65.02 2dcq h PRO 59 Cb 0.39 0.02 0.00 0.00 0.13 0.00 0.00 31.00 31.55 2dcq h PRO 59 CO -0.62 0.80 0.00 0.41 -0.23 0.00 0.00 178.00 178.35 2dcq n GLY 60 N 0.40 -0.33 0.10 1.56 0.00 -1.08 -1.53 105.19 104.32 2dcq n GLY 60 Ca -0.07 0.00 -0.12 0.00 0.00 0.00 0.00 46.02 45.83 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 -0.36 0.42 0.44 1.61 7.35 -0.77 -4.49 117.46 121.66 2dcq n PHE 61 Ca 0.00 0.13 0.05 0.00 -0.76 0.00 0.00 57.45 56.87 2dcq n PHE 61 Cb 0.04 -1.07 0.25 0.00 0.35 0.00 0.00 39.48 39.04 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 -2.98 0.00 0.27 -2.13 4.77 -0.58 -3.26 117.00 113.09 2dcq n LEU 62 Ca -0.30 0.37 0.17 0.00 -0.03 0.00 0.00 56.01 56.22 2dcq n LEU 62 Cb 1.09 -0.37 0.92 0.00 -2.33 0.00 0.00 43.42 42.73 2dcq n LEU 62 CO 0.41 -0.24 1.14 0.07 -1.33 0.00 0.00 177.39 177.45 2dcq h LYS 63 N 0.00 0.00 0.00 3.23 5.09 -1.79 -0.98 116.57 122.12 2dcq h LYS 63 Ca 0.00 0.00 0.00 0.00 0.09 0.00 0.00 60.65 60.74 2dcq h LYS 63 Cb 0.13 0.00 0.00 0.00 0.10 0.00 0.00 32.23 32.46 2dcq h LYS 63 CO 0.00 0.00 -0.78 0.87 -2.09 0.00 0.00 179.45 177.45 2dcq h LYS 64 N 0.00 0.00 0.13 0.07 1.79 -1.92 -3.38 116.57 113.26 2dcq h LYS 64 Ca 0.03 0.00 -0.25 0.00 -2.18 0.00 0.00 60.65 58.26 2dcq h LYS 64 Cb 0.22 0.00 0.01 0.00 -1.58 0.00 0.00 32.23 30.88 2dcq h LYS 64 CO -0.00 0.00 -1.21 -0.07 -1.08 0.00 0.00 179.45 177.09 2dcq h LEU 65 N 0.00 0.42 -0.72 2.94 4.07 -1.43 -3.35 115.31 117.26 2dcq h LEU 65 Ca 0.00 -0.89 0.00 0.00 0.08 0.00 0.00 57.88 57.07 2dcq h LEU 65 Cb 0.89 -0.14 0.00 0.00 1.08 0.00 0.00 40.66 42.49 2dcq h LEU 65 CO 0.00 1.54 0.00 -1.20 -1.08 0.00 0.00 178.44 177.70 2dcq n SER 66 N -3.99 0.28 -0.03 -0.43 7.64 -1.19 -0.58 113.62 115.32 2dcq n SER 66 Ca -0.21 0.63 0.00 0.00 1.01 0.00 0.00 58.87 60.31 2dcq n SER 66 Cb 0.88 -0.67 0.01 0.00 -1.01 0.00 0.00 64.21 63.42 2dcq n SER 66 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 2dcq n LEU 67 N -1.88 1.70 -0.00 -3.43 -0.00 -1.26 -4.70 117.00 107.42 2dcq n LEU 67 Ca -0.01 -1.64 0.05 0.00 -0.00 0.00 0.00 56.01 54.41 2dcq n LEU 67 Cb 0.02 -0.01 -0.06 0.00 -0.00 0.00 0.00 43.42 43.37 2dcq n LEU 67 CO 0.05 0.42 -0.02 0.29 -0.00 0.00 0.00 177.39 178.13 2dcq n LYS 68 N -0.27 3.41 -4.08 1.47 4.01 0.25 -4.95 118.16 118.01 2dcq n LYS 68 Ca 0.01 -0.00 -0.24 0.00 -0.51 0.00 0.00 58.31 57.56 2dcq n LYS 68 Cb 0.17 -1.01 -0.17 0.00 -0.51 0.00 0.00 35.03 33.51 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 -2.02 1.18 0.26 2.13 0.40 -1.18 -5.02 117.98 113.74 2dcq s PHE 69 Ca 0.04 -0.48 -0.04 0.00 -0.60 0.00 0.00 56.93 55.85 2dcq s PHE 69 Cb 0.08 -1.00 0.33 0.00 0.51 0.00 0.00 43.02 42.94 2dcq s PHE 69 CO 0.44 -0.36 1.85 1.57 0.70 0.00 0.00 175.22 179.42 2dcq h LYS 70 N 7.74 1.03 -2.01 0.44 2.10 -1.92 -3.39 116.57 120.56 2dcq h LYS 70 Ca -0.30 -0.15 -0.52 0.00 -2.00 0.00 0.00 60.65 57.68 2dcq h LYS 70 Cb 1.15 -0.18 -0.40 0.00 -0.90 0.00 0.00 32.23 31.90 2dcq h LYS 70 CO 0.41 0.81 -1.14 -3.47 -2.00 0.00 0.00 179.45 174.06 2dcq n ASP 71 N -4.32 0.69 -0.23 7.07 2.03 -1.26 -4.91 116.55 115.62 2dcq n ASP 71 Ca 0.07 -2.90 -0.05 0.00 0.52 0.00 0.00 54.79 52.43 2dcq n ASP 71 Cb 0.15 -0.63 0.12 0.00 -0.72 0.00 0.00 41.12 40.04 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 3.43 1.06 -0.13 -0.67 0.13 -1.88 -1.47 132.00 132.47 2dcq h PRO 72 Ca 0.09 -0.20 0.04 0.00 -0.87 0.00 0.00 66.00 65.06 2dcq h PRO 72 Cb 0.92 -0.17 -0.01 0.00 0.13 0.00 0.00 31.00 31.87 2dcq h PRO 72 CO 0.50 0.88 0.19 1.05 -0.23 0.00 0.00 178.00 180.39 2dcq h GLU 73 N 1.03 0.00 0.00 0.86 4.11 -1.88 -1.69 114.58 117.01 2dcq h GLU 73 Ca 0.23 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.66 2dcq h GLU 73 Cb 0.24 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.49 2dcq h GLU 73 CO -0.01 0.00 0.00 0.09 0.07 0.00 0.00 179.01 179.16 2dcq n ASN 74 N -3.53 0.87 -4.78 3.06 5.03 -1.20 -3.77 115.26 110.93 2dcq n ASN 74 Ca 0.00 -1.14 -0.35 0.00 0.87 0.00 0.00 54.58 53.96 2dcq n ASN 74 Cb 0.30 0.00 -0.01 0.00 -1.02 0.00 0.00 39.78 39.05 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 -0.14 3.29 -0.53 3.41 2.01 -0.56 -4.86 115.64 118.26 2dcq s THR 75 Ca 0.00 0.85 -0.05 0.00 0.31 0.00 0.00 61.69 62.80 2dcq s THR 75 Cb 0.00 -3.37 0.14 0.00 0.01 0.00 0.00 72.50 69.28 2dcq s THR 75 CO 0.00 -0.13 0.36 -0.89 -0.69 0.00 0.00 174.62 173.27 2dcq s THR 76 N -1.75 3.79 0.46 -0.82 2.01 -0.61 -3.33 115.64 115.40 2dcq s THR 76 Ca 0.69 -2.36 -0.21 0.00 0.31 0.00 0.00 61.69 60.12 2dcq s THR 76 Cb -0.24 -3.51 -0.09 0.00 0.01 0.00 0.00 72.50 68.68 2dcq s THR 76 CO 0.27 -0.80 1.02 -0.22 -0.69 0.00 0.00 174.62 174.20 2dcq s LEU 77 N 0.68 3.91 -0.27 4.42 0.20 -1.11 -1.00 118.68 125.51 2dcq s LEU 77 Ca 0.11 1.88 -0.00 0.00 0.69 0.00 0.00 54.13 56.82 2dcq s LEU 77 Cb -0.22 -4.51 0.08 0.00 -0.43 0.00 0.00 46.19 41.11 2dcq s LEU 77 CO -0.03 -0.64 0.03 -0.31 -0.29 0.00 0.00 176.35 175.10 2dcq s TYR 78 N -1.98 2.08 0.65 5.38 1.51 -0.21 -0.88 117.35 123.90 2dcq s TYR 78 Ca 0.65 -1.75 -0.16 0.00 -1.01 0.00 0.00 57.07 54.80 2dcq s TYR 78 Cb -0.15 -1.70 -0.01 0.00 -0.11 0.00 0.00 41.96 39.99 2dcq s TYR 78 CO 0.19 -0.80 1.14 0.42 -1.11 0.00 0.00 175.55 175.39 2dcq s ILE 79 N 1.49 2.97 -0.05 2.71 1.09 -0.42 -2.13 121.20 126.86 2dcq s ILE 79 Ca 0.03 0.50 -0.01 0.00 -1.10 0.00 0.00 60.65 60.06 2dcq s ILE 79 Cb -0.18 -3.06 0.03 0.00 -1.06 0.00 0.00 42.46 38.19 2dcq s ILE 79 CO -0.13 -0.24 0.03 -0.22 -0.10 0.00 0.00 174.94 174.28 2dcq s LEU 80 N -4.67 0.51 0.00 2.97 0.20 -0.27 -3.90 118.68 113.52 2dcq s LEU 80 Ca 0.70 0.01 0.02 0.00 0.69 0.00 0.00 54.13 55.56 2dcq s LEU 80 Cb -0.24 -0.24 0.02 0.00 -0.43 0.00 0.00 46.19 45.30 2dcq s LEU 80 CO 0.39 -0.20 0.17 -0.90 -0.29 0.00 0.00 176.35 175.52 2dcq n ASP 81 N 4.98 2.84 0.08 3.68 5.75 -1.26 -0.77 116.55 131.84 2dcq n ASP 81 Ca -0.10 -2.74 -0.13 0.00 -0.01 0.00 0.00 54.79 51.81 2dcq n ASP 81 Cb 0.50 0.14 -0.08 0.00 -1.03 0.00 0.00 41.12 40.64 2dcq n ASP 81 CO 0.00 0.00 0.00 0.11 -0.11 0.00 0.00 177.20 177.20 2dcq h LYS 82 N 0.00 -0.21 0.00 0.11 1.57 -1.91 -0.26 116.57 115.87 2dcq h LYS 82 Ca -0.33 0.01 0.00 0.00 -1.87 0.00 0.00 60.65 58.47 2dcq h LYS 82 Cb 1.07 0.05 0.00 0.00 0.08 0.00 0.00 32.23 33.43 2dcq h LYS 82 CO 0.53 0.14 0.00 0.34 -0.57 0.00 0.00 179.45 179.88 2dcq n PHE 83 N -5.02 0.00 0.00 -1.35 -0.00 -1.26 -0.12 117.46 109.71 2dcq n PHE 83 Ca -0.09 0.00 0.00 0.00 -0.00 0.00 0.00 57.45 57.36 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 -1.37 0.00 0.00 -2.13 8.00 -1.26 -3.52 116.55 116.27 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 0.00 0.15 0.00 0.00 -0.02 0.00 0.00 41.12 41.25 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 -0.22 2.87 1.76 0.44 0.00 -1.26 -3.16 105.19 105.62 2dcq n GLY 85 Ca 0.00 0.31 -0.02 0.00 0.00 0.00 0.00 46.02 46.31 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 7.26 -0.14 -0.30 1.61 4.13 -1.26 -4.99 115.26 121.57 2dcq n ASN 86 Ca 0.00 -2.05 0.10 0.00 1.68 0.00 0.00 54.58 54.32 2dcq n ASN 86 Cb 0.00 0.09 0.27 0.00 -1.54 0.00 0.00 39.78 38.60 2dcq n ASN 86 CO 0.00 0.00 0.00 0.77 0.28 0.00 0.00 177.26 178.31 2dcq h SER 87 N 0.88 0.39 1.27 6.41 4.64 -1.91 -1.05 113.55 124.18 2dcq h SER 87 Ca -0.38 0.13 -0.01 0.00 -0.47 0.00 0.00 61.79 61.05 2dcq h SER 87 Cb 1.50 0.09 -0.00 0.00 -0.31 0.00 0.00 62.40 63.68 2dcq h SER 87 CO -0.09 0.09 -0.06 -0.33 -0.87 0.00 0.00 176.83 175.57 2dcq h GLU 88 N 0.48 0.00 0.41 4.77 3.07 -1.92 -1.67 114.58 119.72 2dcq h GLU 88 Ca 0.51 0.00 -0.02 0.00 -0.50 0.00 0.00 59.36 59.35 2dcq h GLU 88 Cb 0.88 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.80 2dcq h GLU 88 CO -0.46 0.06 -0.20 1.25 -1.40 0.00 0.00 179.01 178.26 2dcq h LEU 89 N 0.00 -0.47 -1.81 1.33 7.12 -1.61 -3.29 115.31 116.58 2dcq h LEU 89 Ca -0.00 -0.09 -0.03 0.00 0.13 0.00 0.00 57.88 57.90 2dcq h LEU 89 Cb 0.71 0.12 -0.00 0.00 -0.53 0.00 0.00 40.66 40.96 2dcq h LEU 89 CO 0.01 -0.04 -0.12 0.58 -0.13 0.00 0.00 178.44 178.74 2dcq h VAL 90 N -1.04 1.00 0.00 1.05 2.07 -1.20 -1.35 116.25 116.77 2dcq h VAL 90 Ca -0.06 -0.43 -0.03 0.00 0.82 0.00 0.00 66.70 67.00 2dcq h VAL 90 Cb 0.53 1.24 -0.00 0.00 -1.52 0.00 0.00 31.29 31.53 2dcq h VAL 90 CO 0.09 0.12 -0.15 0.00 0.02 0.00 0.00 177.57 177.65 2dcq h ALA 91 N 1.88 1.51 0.09 1.67 0.00 -1.40 -2.05 119.26 120.97 2dcq h ALA 91 Ca -0.00 -0.14 -0.35 0.00 0.00 0.00 0.00 54.91 54.43 2dcq h ALA 91 Cb 0.23 -0.02 -0.03 0.00 0.00 0.00 0.00 17.79 17.97 2dcq h ALA 91 CO 0.02 0.19 -1.93 -0.85 0.00 0.00 0.00 179.25 176.67 2dcq n GLU 92 N -4.01 0.73 0.00 0.00 0.28 -0.76 -3.26 120.64 113.63 2dcq n GLU 92 Ca -0.02 0.27 -0.13 0.00 -0.16 0.00 0.00 57.16 57.12 2dcq n GLU 92 Cb 0.23 -1.73 -0.09 0.00 1.43 0.00 0.00 31.44 31.29 2dcq n GLU 92 CO 0.00 0.00 0.00 1.25 -0.16 0.00 0.00 177.13 178.22 2dcq h LEU 93 N 0.05 0.02 -0.88 -1.84 5.85 -0.67 -2.12 115.31 115.72 2dcq h LEU 93 Ca -0.39 -0.29 0.06 0.00 0.84 0.00 0.00 57.88 58.10 2dcq h LEU 93 Cb 2.03 -0.00 -0.06 0.00 0.37 0.00 0.00 40.66 42.99 2dcq h LEU 93 CO 0.08 0.31 0.55 -0.37 -0.34 0.00 0.00 178.44 178.67 2dcq h VAL 94 N -0.27 1.05 0.26 1.05 -1.51 -1.67 -0.92 116.25 114.24 2dcq h VAL 94 Ca 0.00 -0.34 -0.01 0.00 -1.23 0.00 0.00 66.70 65.13 2dcq h VAL 94 Cb 0.30 -0.04 -0.01 0.00 -2.13 0.00 0.00 31.29 29.41 2dcq h VAL 94 CO 0.00 0.18 -0.18 0.00 -1.23 0.00 0.00 177.57 176.34 2dcq h ALA 95 N 1.41 -0.41 0.00 5.19 0.00 -1.70 -0.62 119.26 123.13 2dcq h ALA 95 Ca 0.38 -0.07 0.00 0.00 0.00 0.00 0.00 54.91 55.22 2dcq h ALA 95 Cb 0.17 0.23 0.00 0.00 0.00 0.00 0.00 17.79 18.19 2dcq h ALA 95 CO -0.17 -0.75 0.03 -0.07 0.00 0.00 0.00 179.25 178.29 2dcq h LEU 96 N -0.43 0.00 -3.13 0.00 4.07 -0.74 -1.43 115.31 113.65 2dcq h LEU 96 Ca -0.02 0.00 0.00 0.00 0.08 0.00 0.00 57.88 57.94 2dcq h LEU 96 Cb 0.37 0.00 0.00 0.00 1.08 0.00 0.00 40.66 42.11 2dcq h LEU 96 CO 0.01 0.00 0.00 0.59 -1.08 0.00 0.00 178.44 177.96 2dcq n ASN 97 N -2.31 3.29 0.00 -0.43 3.02 -0.41 -4.95 115.26 113.47 2dcq n ASN 97 Ca -0.02 -2.81 0.00 0.00 -0.03 0.00 0.00 54.58 51.72 2dcq n ASN 97 Cb 0.07 -0.44 0.00 0.00 -0.61 0.00 0.00 39.78 38.80 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 -0.55 0.98 3.93 7.41 0.00 -0.55 -5.00 105.19 111.41 2dcq n GLY 98 Ca 0.17 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.92 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 2.52 -0.01 1.61 0.40 -0.35 -3.41 117.98 116.74 2dcq s PHE 99 Ca 0.00 0.39 -0.01 0.00 -0.60 0.00 0.00 56.93 56.71 2dcq s PHE 99 Cb 0.00 -3.40 -0.01 0.00 0.51 0.00 0.00 43.02 40.12 2dcq s PHE 99 CO 0.00 -1.74 0.29 -0.22 0.70 0.00 0.00 175.22 174.25 2dcq h LYS 100 N -0.87 -0.05 -2.89 0.44 1.63 -1.44 -3.39 116.57 110.01 2dcq h LYS 100 Ca -0.44 0.00 -0.09 0.00 -0.85 0.00 0.00 60.65 59.28 2dcq h LYS 100 Cb 1.30 0.01 -0.18 0.00 -0.60 0.00 0.00 32.23 32.76 2dcq h LYS 100 CO 0.55 -0.03 -0.13 -1.12 -3.45 0.00 0.00 179.45 175.27 2dcq s SER 101 N -3.05 -0.30 0.20 4.20 0.01 -1.24 -4.76 113.70 108.76 2dcq s SER 101 Ca -0.01 0.13 -0.01 0.00 1.31 0.00 0.00 55.95 57.38 2dcq s SER 101 Cb 0.00 0.40 -0.04 0.00 0.21 0.00 0.00 66.02 66.59 2dcq s SER 101 CO 0.02 -0.58 0.12 0.00 0.41 0.00 0.00 173.24 173.22 2dcq s ALA 102 N -1.87 1.23 0.14 1.44 0.00 -1.20 -2.75 121.76 118.74 2dcq s ALA 102 Ca -0.09 -1.71 0.04 0.00 0.00 0.00 0.00 51.96 50.20 2dcq s ALA 102 Cb -0.02 1.31 -0.04 0.00 0.00 0.00 0.00 23.12 24.37 2dcq s ALA 102 CO 0.02 -0.57 -0.10 0.71 0.00 0.00 0.00 175.76 175.83 2dcq s TYR 103 N -4.10 1.20 0.31 0.00 1.51 -0.06 -4.70 117.35 111.52 2dcq s TYR 103 Ca 0.38 -0.78 0.10 0.00 -1.01 0.00 0.00 57.07 55.76 2dcq s TYR 103 Cb 0.07 -0.62 -0.06 0.00 -0.11 0.00 0.00 41.96 41.24 2dcq s TYR 103 CO 0.12 0.04 -0.13 0.00 -1.11 0.00 0.00 175.55 174.47 2dcq s ALA 104 N -3.32 2.76 -0.10 3.71 0.00 -1.22 -1.30 121.76 122.28 2dcq s ALA 104 Ca 0.15 -1.98 0.02 0.00 0.00 0.00 0.00 51.96 50.16 2dcq s ALA 104 Cb 0.03 -0.09 -0.01 0.00 0.00 0.00 0.00 23.12 23.04 2dcq s ALA 104 CO -0.00 0.13 -0.17 -1.50 0.00 0.00 0.00 175.76 174.22 2dcq s ILE 105 N -2.65 2.73 0.54 0.00 2.07 -1.25 -2.20 121.20 120.44 2dcq s ILE 105 Ca 0.31 -0.79 -0.19 0.00 -1.41 0.00 0.00 60.65 58.56 2dcq s ILE 105 Cb -0.00 -2.10 -0.06 0.00 0.13 0.00 0.00 42.46 40.43 2dcq s ILE 105 CO 0.15 0.55 1.10 -0.75 -1.91 0.00 0.00 174.94 174.07 2dcq s LYS 106 N 0.12 3.42 0.00 3.50 2.20 0.28 -3.41 119.74 125.85 2dcq s LYS 106 Ca -0.08 1.50 0.00 0.00 -0.36 0.00 0.00 55.97 57.02 2dcq s LYS 106 Cb -0.15 -2.03 0.00 0.00 -1.51 0.00 0.00 37.83 34.14 2dcq s LYS 106 CO 0.05 -0.77 0.00 -0.25 -0.36 0.00 0.00 175.35 174.02 2dcq n ASP 107 N -1.36 -4.50 0.00 1.43 8.00 -1.23 -4.35 116.55 114.54 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 -2.93 0.00 0.00 -0.02 0.00 0.00 41.12 38.68 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 -0.00 2.70 0.13 0.44 0.00 -1.22 -0.51 105.19 106.72 2dcq n GLY 108 Ca 0.00 0.08 -0.21 0.00 0.00 0.00 0.00 46.02 45.89 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 8.72 1.06 0.63 4.61 0.00 -0.11 -0.32 120.51 135.09 2dcq n ALA 109 Ca 0.00 -0.77 0.11 0.00 0.00 0.00 0.00 53.44 52.78 2dcq n ALA 109 Cb 0.00 -0.44 -0.05 0.00 0.00 0.00 0.00 19.45 18.96 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 -3.56 0.25 -1.17 0.00 -0.58 0.83 -1.72 120.64 114.69 2dcq n GLU 110 Ca -0.38 -0.04 -0.29 0.00 -0.42 0.00 0.00 57.16 56.03 2dcq n GLU 110 Cb 0.98 -1.54 0.16 0.00 -0.57 0.00 0.00 31.44 30.47 2dcq n GLU 110 CO 0.00 0.00 0.00 0.20 -0.48 0.00 0.00 177.13 176.85 2dcq s GLY 111 N -3.56 1.60 0.40 0.62 0.00 0.33 -4.83 107.32 101.87 2dcq s GLY 111 Ca 0.03 -0.17 0.28 0.00 0.00 0.00 0.00 44.72 44.86 2dcq s GLY 111 CO 0.84 0.37 1.84 -0.56 0.00 0.00 0.00 173.10 175.59 2dcq h PRO 112 N -1.71 0.00 -0.43 2.90 0.13 -1.94 -0.30 132.00 130.64 2dcq h PRO 112 Ca -0.52 0.00 -0.26 0.00 -0.87 0.00 0.00 66.00 64.35 2dcq h PRO 112 Cb 1.30 0.00 -0.40 0.00 0.13 0.00 0.00 31.00 32.03 2dcq h PRO 112 CO 0.55 0.00 -1.09 0.54 -0.23 0.00 0.00 178.00 177.78 2dcq n ARG 113 N -2.49 1.78 0.00 0.86 5.12 -1.26 -4.97 116.66 115.70 2dcq n ARG 113 Ca -0.01 -3.48 0.00 0.00 -1.93 0.00 0.00 57.85 52.43 2dcq n ARG 113 Cb 0.10 -1.57 0.00 0.00 -1.16 0.00 0.00 32.46 29.82 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 -0.55 -1.49 0.19 -0.13 0.00 -0.13 -4.24 105.19 98.84 2dcq n GLY 114 Ca 0.10 -1.46 -0.10 0.00 0.00 0.00 0.00 46.02 44.56 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 -0.29 0.60 -3.27 1.61 2.91 -0.65 -3.41 115.95 113.45 2dcq h TRP 115 Ca 0.00 -0.07 -0.41 0.00 1.13 0.00 0.00 58.89 59.54 2dcq h TRP 115 Cb 0.00 -0.17 0.20 0.00 -0.51 0.00 0.00 29.16 28.68 2dcq h TRP 115 CO 0.00 0.60 -0.00 -0.51 -1.03 0.00 0.00 178.44 177.49 2dcq s LEU 116 N -9.65 -0.00 -0.71 0.65 1.43 -0.70 -3.88 118.68 105.81 2dcq s LEU 116 Ca -0.13 0.99 0.00 0.00 -1.03 0.00 0.00 54.13 53.95 2dcq s LEU 116 Cb 0.09 -2.66 0.00 0.00 0.03 0.00 0.00 46.19 43.65 2dcq s LEU 116 CO 0.76 -4.62 0.00 -0.46 0.23 0.00 0.00 176.35 172.26 2dcq n ASN 117 N -5.14 -1.96 -0.17 2.29 0.23 -1.26 -4.66 115.26 104.58 2dcq n ASN 117 Ca 0.09 0.17 0.02 0.00 -0.53 0.00 0.00 54.58 54.33 2dcq n ASN 117 Cb 0.58 -2.00 0.02 0.00 -2.08 0.00 0.00 39.78 36.31 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 0.29 0.74 -3.13 0.53 7.64 -1.25 -5.00 113.62 113.44 2dcq n SER 118 Ca -0.07 -1.84 -0.22 0.00 1.01 0.00 0.00 58.87 57.75 2dcq n SER 118 Cb 0.24 -0.14 0.02 0.00 -1.01 0.00 0.00 64.21 63.32 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 -0.33 -4.95 -4.88 6.43 2.88 -1.26 -4.97 113.62 106.54 2dcq n SER 119 Ca 0.03 -0.30 -0.31 0.00 -1.33 0.00 0.00 58.87 56.95 2dcq n SER 119 Cb 0.54 -4.04 -0.05 0.00 -0.75 0.00 0.00 64.21 59.91 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 -6.54 4.04 0.75 2.46 1.43 -1.25 -5.09 118.68 114.48 2dcq s LEU 120 Ca 0.33 1.00 -0.11 0.00 -1.03 0.00 0.00 54.13 54.32 2dcq s LEU 120 Cb -0.16 -3.81 0.04 0.00 0.03 0.00 0.00 46.19 42.29 2dcq s LEU 120 CO 0.40 -0.20 1.08 -2.16 0.23 0.00 0.00 176.35 175.70 2dcq s PRO 121 N -3.25 2.49 -0.06 1.29 0.04 -1.26 -4.89 135.00 129.36 2dcq s PRO 121 Ca 0.49 0.95 -0.15 0.00 0.04 0.00 0.00 61.00 62.33 2dcq s PRO 121 Cb -0.11 -1.94 0.03 0.00 0.04 0.00 0.00 34.50 32.52 2dcq s PRO 121 CO 0.25 -1.42 0.35 -0.46 0.04 0.00 0.00 177.00 175.76 2dcq s TRP 122 N -3.02 -0.28 0.02 0.56 -0.11 -1.26 -3.85 118.94 110.99 2dcq s TRP 122 Ca 0.60 0.56 -0.10 0.00 1.22 0.00 0.00 56.10 58.38 2dcq s TRP 122 Cb -0.15 0.13 -0.32 0.00 -1.50 0.00 0.00 33.47 31.63 2dcq s TRP 122 CO 0.55 -0.33 0.93 0.82 -4.62 0.00 0.00 176.95 174.30 2dcq h ILE 123 N 4.07 1.22 -3.18 5.86 2.04 -0.80 -3.40 117.51 123.31 2dcq h ILE 123 Ca -0.28 -2.75 0.35 0.00 1.00 0.00 0.00 64.86 63.17 2dcq h ILE 123 Cb 1.18 2.90 -0.14 0.00 -0.74 0.00 0.00 36.82 40.02 2dcq h ILE 123 CO 0.36 0.84 -0.89 -1.84 0.00 0.00 0.00 178.15 176.61 2dcq n GLU 124 N -3.60 -2.97 0.00 2.37 0.28 -1.19 -4.88 120.64 110.65 2dcq n GLU 124 Ca -0.17 2.25 0.00 0.00 -0.16 0.00 0.00 57.16 59.08 2dcq n GLU 124 Cb 1.07 -3.53 0.00 0.00 1.43 0.00 0.00 31.44 30.41 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 -4.21 0.76 -0.42 3.44 -0.04 -1.26 -4.50 135.00 128.77 2dcq n PRO 125 Ca -0.04 0.00 0.07 0.00 -0.04 0.00 0.00 63.50 63.49 2dcq n PRO 125 Cb 0.63 0.00 0.19 0.00 -0.04 0.00 0.00 33.50 34.28 2dcq n PRO 125 CO 0.00 0.00 0.00 1.63 -0.04 0.00 0.00 175.50 177.09 2dcq n LYS 126 N -0.18 1.49 -4.09 0.54 5.02 -1.26 -5.06 118.16 114.62 2dcq n LYS 126 Ca 0.00 -3.06 -0.14 0.00 -2.02 0.00 0.00 58.31 53.09 2dcq n LYS 126 Cb 0.00 -1.58 -0.12 0.00 -0.02 0.00 0.00 35.03 33.31 2dcq n LYS 126 CO 0.00 0.00 0.00 -1.59 -0.52 0.00 0.00 177.40 175.29 2dcq s LYS 127 N -3.12 0.47 -0.49 1.97 -2.85 -1.26 -5.11 119.74 109.35 2dcq s LYS 127 Ca 0.36 -0.53 0.07 0.00 -1.00 0.00 0.00 55.97 54.87 2dcq s LYS 127 Cb 0.34 -0.30 0.24 0.00 -2.06 0.00 0.00 37.83 36.04 2dcq s LYS 127 CO -0.04 0.07 0.57 2.41 0.10 0.00 0.00 175.35 178.45 2dcq n THR 128 N 2.03 0.29 -3.24 3.79 -1.04 -1.26 -5.02 114.28 109.83 2dcq n THR 128 Ca -0.19 -4.35 -0.03 0.00 -2.04 0.00 0.00 64.05 57.43 2dcq n THR 128 Cb 0.56 -1.98 -0.03 0.00 -1.82 0.00 0.00 70.33 67.06 2dcq n THR 128 CO 0.00 0.00 0.00 -0.94 -0.64 0.00 0.00 175.07 173.49 2dcq s SER 129 N -1.44 -0.50 0.00 8.00 1.04 -1.26 -4.94 113.70 114.60 2dcq s SER 129 Ca 0.36 -0.12 0.00 0.00 0.48 0.00 0.00 55.95 56.67 2dcq s SER 129 Cb 0.14 1.52 0.00 0.00 0.10 0.00 0.00 66.02 67.77 2dcq s SER 129 CO -0.09 -0.33 0.00 0.61 0.98 0.00 0.00 173.24 174.41 2dcq n GLY 130 N 5.38 -0.28 0.25 7.32 0.00 -1.26 -4.83 105.19 111.78 2dcq n GLY 130 Ca 0.02 -0.22 -0.13 0.00 0.00 0.00 0.00 46.02 45.69 2dcq n GLY 130 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2dcq h PRO 131 N 0.00 0.88 0.00 1.61 0.13 -1.96 -3.07 132.00 129.59 2dcq h PRO 131 Ca 0.00 -0.43 -0.00 0.00 -0.87 0.00 0.00 66.00 64.70 2dcq h PRO 131 Cb 0.80 -0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.93 2dcq h PRO 131 CO 0.00 1.08 -0.00 0.77 -0.23 0.00 0.00 178.00 179.62 2dcq h SER 132 N 0.69 -0.00 0.03 1.44 0.02 -1.97 -3.43 113.55 110.32 2dcq h SER 132 Ca 0.07 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.02 2dcq h SER 132 Cb 0.87 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.41 2dcq h SER 132 CO 0.08 0.14 -0.03 -1.20 -1.14 0.00 0.00 176.83 174.68 2dcq n SER 133 N -2.78 1.18 0.00 3.07 7.64 -1.25 -5.06 113.62 116.42 2dcq n SER 133 Ca -0.00 -1.33 0.00 0.00 1.01 0.00 0.00 58.87 58.55 2dcq n SER 133 Cb 0.00 0.01 0.00 0.00 -1.01 0.00 0.00 64.21 63.21 2dcq n SER 133 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64