#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 0.00 1.61 7.64 -1.26 -4.99 113.62 117.11 2dcq n SER 2 Ca 0.00 0.50 0.00 0.00 1.01 0.00 0.00 58.87 60.38 2dcq n SER 2 Cb 0.00 -1.47 0.00 0.00 -1.01 0.00 0.00 64.21 61.73 2dcq n SER 2 CO 0.00 0.00 0.00 -1.54 -3.01 0.00 0.00 175.04 170.49 2dcq n SER 3 N -3.55 0.80 -0.43 6.43 3.41 -1.26 -5.14 113.62 113.88 2dcq n SER 3 Ca 0.12 -1.11 0.00 0.00 -0.26 0.00 0.00 58.87 57.62 2dcq n SER 3 Cb 0.51 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 64.46 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 -0.06 -1.28 1.04 5.00 0.00 -1.26 -4.85 105.19 103.78 2dcq n GLY 4 Ca 0.00 -1.18 0.00 0.00 0.00 0.00 0.00 46.02 44.84 2dcq n GLY 4 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 2dcq n SER 5 N -1.16 0.60 0.00 1.61 2.88 -1.26 -4.94 113.62 111.35 2dcq n SER 5 Ca 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.54 2dcq n SER 5 Cb 0.00 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 63.46 2dcq n SER 5 CO 0.00 0.00 0.00 -1.54 -1.23 0.00 0.00 175.04 172.27 2dcq n SER 6 N -2.48 0.00 0.00 -3.46 3.41 -1.26 -4.84 113.62 104.99 2dcq n SER 6 Ca 0.00 0.42 0.00 0.00 -0.26 0.00 0.00 58.87 59.03 2dcq n SER 6 Cb 0.23 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 64.18 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 -0.34 2.64 3.50 5.00 0.00 -1.25 -4.35 105.19 110.39 2dcq n GLY 7 Ca 0.00 -1.89 -0.29 0.00 0.00 0.00 0.00 46.02 43.84 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 0.00 -1.40 0.41 1.61 2.88 -1.26 -1.38 113.62 114.49 2dcq n SER 8 Ca 0.00 -0.05 -0.19 0.00 -1.33 0.00 0.00 58.87 57.30 2dcq n SER 8 Cb 0.00 -1.29 -0.09 0.00 -0.75 0.00 0.00 64.21 62.08 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 -2.51 -1.12 -0.60 -1.46 0.00 -1.79 -3.19 119.26 108.59 2dcq h ALA 9 Ca -0.58 -0.23 -0.07 0.00 0.00 0.00 0.00 54.91 54.03 2dcq h ALA 9 Cb 1.32 0.50 -0.03 0.00 0.00 0.00 0.00 17.79 19.59 2dcq h ALA 9 CO 0.47 -1.14 0.09 -0.22 0.00 0.00 0.00 179.25 178.45 2dcq h LYS 10 N -1.09 0.98 -0.81 0.00 3.64 -1.90 -3.23 116.57 114.15 2dcq h LYS 10 Ca -0.10 -0.25 0.16 0.00 -1.27 0.00 0.00 60.65 59.19 2dcq h LYS 10 Cb 0.87 -0.12 -0.15 0.00 -0.41 0.00 0.00 32.23 32.41 2dcq h LYS 10 CO 0.13 0.91 -0.21 -0.97 -2.27 0.00 0.00 179.45 177.04 2dcq h ASN 11 N 0.92 -0.77 0.50 4.20 -1.24 -1.91 0.31 115.58 117.58 2dcq h ASN 11 Ca 0.18 0.24 -0.02 0.00 0.71 0.00 0.00 56.30 57.41 2dcq h ASN 11 Cb 0.42 0.51 0.00 0.00 0.73 0.00 0.00 38.32 39.98 2dcq h ASN 11 CO 0.01 -0.27 -0.24 0.00 -1.29 0.00 0.00 177.43 175.64 2dcq h ALA 12 N 1.80 -0.67 -0.89 1.57 0.00 -1.61 -3.03 119.26 116.43 2dcq h ALA 12 Ca 0.39 -0.19 0.11 0.00 0.00 0.00 0.00 54.91 55.22 2dcq h ALA 12 Cb 0.59 0.26 -0.07 0.00 0.00 0.00 0.00 17.79 18.58 2dcq h ALA 12 CO -0.84 -0.74 0.57 -0.92 0.00 0.00 0.00 179.25 177.33 2dcq h TYR 13 N -0.94 0.91 -0.07 0.00 3.20 -1.40 -1.56 116.97 117.11 2dcq h TYR 13 Ca -0.07 0.03 0.04 0.00 3.14 0.00 0.00 58.73 61.87 2dcq h TYR 13 Cb 0.60 -0.29 -0.06 0.00 1.54 0.00 0.00 36.73 38.52 2dcq h TYR 13 CO 0.01 0.40 -0.32 1.15 -1.64 0.00 0.00 178.16 177.75 2dcq h THR 14 N 0.83 0.29 -0.77 1.81 2.02 -0.41 -1.95 112.91 114.72 2dcq h THR 14 Ca 0.42 0.00 -0.01 0.00 0.77 0.00 0.00 66.41 67.60 2dcq h THR 14 Cb 0.50 0.29 -0.04 0.00 -1.74 0.00 0.00 68.15 67.16 2dcq h THR 14 CO -0.19 0.00 0.46 0.11 0.37 0.00 0.00 175.52 176.27 2dcq h LYS 15 N -0.43 1.05 -0.42 6.66 1.79 -1.18 -1.81 116.57 122.23 2dcq h LYS 15 Ca 0.08 -0.09 0.12 0.00 -2.18 0.00 0.00 60.65 58.58 2dcq h LYS 15 Cb 0.55 -0.22 -0.02 0.00 -1.58 0.00 0.00 32.23 30.97 2dcq h LYS 15 CO -0.32 0.74 0.35 -0.07 -1.08 0.00 0.00 179.45 179.07 2dcq h LEU 16 N 1.07 0.00 -1.97 2.94 4.07 -0.80 -1.05 115.31 119.57 2dcq h LEU 16 Ca 0.28 0.00 0.00 0.00 0.08 0.00 0.00 57.88 58.24 2dcq h LEU 16 Cb -0.04 0.00 0.00 0.00 1.08 0.00 0.00 40.66 41.70 2dcq h LEU 16 CO -0.05 0.00 0.00 0.61 -1.08 0.00 0.00 178.44 177.92 2dcq n GLY 17 N -1.56 1.37 0.00 0.83 0.00 -0.68 -3.94 105.19 101.21 2dcq n GLY 17 Ca 0.07 -0.63 0.05 0.00 0.00 0.00 0.00 46.02 45.51 2dcq n GLY 17 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 2dcq n THR 18 N 1.12 0.00 -3.50 2.61 -2.24 -0.43 -5.00 114.28 106.85 2dcq n THR 18 Ca 0.19 -0.25 -0.25 0.00 -2.27 0.00 0.00 64.05 61.47 2dcq n THR 18 Cb 0.50 0.53 -0.13 0.00 -2.10 0.00 0.00 70.33 69.13 2dcq n THR 18 CO 0.00 0.00 0.00 -1.81 -0.57 0.00 0.00 175.07 172.69 2dcq s ASP 19 N -2.74 2.87 0.64 3.42 1.11 -0.98 -4.99 116.67 115.99 2dcq s ASP 19 Ca -0.01 -1.08 0.34 0.00 0.18 0.00 0.00 52.55 51.98 2dcq s ASP 19 Cb 0.07 -0.06 1.92 0.00 1.07 0.00 0.00 42.92 45.92 2dcq s ASP 19 CO 0.42 -0.42 2.15 -0.78 1.18 0.00 0.00 175.17 177.72 2dcq h ASP 20 N 8.36 0.00 0.77 0.27 3.58 -1.88 -0.66 116.42 126.87 2dcq h ASP 20 Ca -0.18 0.00 0.00 0.00 0.42 0.00 0.00 57.03 57.27 2dcq h ASP 20 Cb 1.04 0.00 0.00 0.00 1.72 0.00 0.00 39.33 42.09 2dcq h ASP 20 CO 0.40 0.00 -0.33 -0.46 -2.88 0.00 0.00 179.24 175.97 2dcq n ASN 21 N -3.32 0.39 -4.80 2.28 0.23 -1.26 -4.86 115.26 103.93 2dcq n ASN 21 Ca -0.01 0.09 -0.34 0.00 -0.53 0.00 0.00 54.58 53.80 2dcq n ASN 21 Cb 0.25 -0.06 -0.02 0.00 -2.08 0.00 0.00 39.78 37.87 2dcq n ASN 21 CO 0.00 0.00 0.00 0.00 -0.93 0.00 0.00 177.26 176.33 2dcq s ALA 22 N -3.03 2.82 0.26 -2.53 0.00 -0.25 -1.03 121.76 118.00 2dcq s ALA 22 Ca 0.11 0.54 0.02 0.00 0.00 0.00 0.00 51.96 52.63 2dcq s ALA 22 Cb 0.17 -3.25 -0.03 0.00 0.00 0.00 0.00 23.12 20.01 2dcq s ALA 22 CO 0.64 -0.51 0.22 -0.65 0.00 0.00 0.00 175.76 175.46 2dcq s GLN 23 N -3.54 1.48 -0.05 0.00 -1.52 0.04 -4.86 119.66 111.21 2dcq s GLN 23 Ca 0.66 -1.79 -0.02 0.00 -1.95 0.00 0.00 55.36 52.26 2dcq s GLN 23 Cb -0.16 0.31 0.03 0.00 -0.22 0.00 0.00 33.01 32.96 2dcq s GLN 23 CO 0.26 -0.53 0.05 -1.17 -0.25 0.00 0.00 175.29 173.65 2dcq s LEU 24 N -3.25 0.25 -0.40 2.90 1.98 -1.26 -1.27 118.68 117.64 2dcq s LEU 24 Ca 0.39 0.04 -0.03 0.00 -2.89 0.00 0.00 54.13 51.64 2dcq s LEU 24 Cb 0.04 -0.22 0.10 0.00 0.66 0.00 0.00 46.19 46.78 2dcq s LEU 24 CO 0.19 -0.24 0.19 -0.22 -1.89 0.00 0.00 176.35 174.38 2dcq s LEU 25 N 2.12 5.11 -0.87 -0.68 1.98 -1.06 -1.80 118.68 123.47 2dcq s LEU 25 Ca 0.05 -1.93 -0.22 0.00 -2.89 0.00 0.00 54.13 49.14 2dcq s LEU 25 Cb -0.12 -1.82 0.08 0.00 0.66 0.00 0.00 46.19 44.98 2dcq s LEU 25 CO -0.04 -0.52 1.22 -0.62 -1.89 0.00 0.00 176.35 174.51 2dcq s ASP 26 N 1.78 6.42 0.00 3.68 -1.08 0.15 -1.04 116.67 126.58 2dcq s ASP 26 Ca 0.07 -1.40 0.27 0.00 -0.52 0.00 0.00 52.55 50.97 2dcq s ASP 26 Cb -0.22 -2.48 1.14 0.00 -1.46 0.00 0.00 42.92 39.89 2dcq s ASP 26 CO -0.04 -1.40 1.79 2.30 0.52 0.00 0.00 175.17 178.34 2dcq n ILE 27 N 6.16 0.04 -1.57 4.11 -5.35 -0.66 -1.89 119.36 120.20 2dcq n ILE 27 Ca 0.18 -0.21 -0.35 0.00 -0.27 0.00 0.00 62.75 62.10 2dcq n ILE 27 Cb 0.49 0.27 0.08 0.00 -1.74 0.00 0.00 39.64 38.74 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 -1.96 2.33 0.79 6.28 0.52 -1.23 -3.53 118.95 122.16 2dcq s ARG 28 Ca 0.38 1.82 -0.11 0.00 -0.52 0.00 0.00 55.73 57.30 2dcq s ARG 28 Cb 0.20 -1.85 0.07 0.00 0.52 0.00 0.00 34.95 33.89 2dcq s ARG 28 CO 0.32 -1.70 1.10 0.00 0.02 0.00 0.00 175.30 175.04 2dcq s ALA 29 N -1.83 2.14 0.48 2.13 0.00 -1.26 -4.41 121.76 119.01 2dcq s ALA 29 Ca 0.76 0.32 0.14 0.00 0.00 0.00 0.00 51.96 53.19 2dcq s ALA 29 Cb -0.31 -3.30 1.14 0.00 0.00 0.00 0.00 23.12 20.65 2dcq s ALA 29 CO 0.43 -1.90 2.09 1.15 0.00 0.00 0.00 175.76 177.52 2dcq h THR 30 N -1.21 0.99 0.00 0.00 2.02 -1.99 -0.64 112.91 112.08 2dcq h THR 30 Ca -0.44 -0.07 -0.02 0.00 0.77 0.00 0.00 66.41 66.65 2dcq h THR 30 Cb 1.24 0.77 -0.00 0.00 -1.74 0.00 0.00 68.15 68.42 2dcq h THR 30 CO 0.50 0.04 -0.12 0.00 0.37 0.00 0.00 175.52 176.31 2dcq h ALA 31 N 1.87 1.01 0.00 6.16 0.00 -2.02 -3.22 119.26 123.06 2dcq h ALA 31 Ca 0.10 -0.11 -0.10 0.00 0.00 0.00 0.00 54.91 54.81 2dcq h ALA 31 Cb 0.14 -0.02 -0.01 0.00 0.00 0.00 0.00 17.79 17.90 2dcq h ALA 31 CO -0.02 0.15 -0.46 -0.44 0.00 0.00 0.00 179.25 178.48 2dcq h ASP 32 N 0.00 0.00 0.58 0.00 3.32 -1.45 -2.30 116.42 116.57 2dcq h ASP 32 Ca -0.00 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.05 2dcq h ASP 32 Cb 0.67 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.22 2dcq h ASP 32 CO 0.02 0.46 0.00 -0.26 -1.72 0.00 0.00 179.24 177.73 2dcq h PHE 33 N 0.00 0.00 0.03 4.55 0.04 -1.60 0.42 116.94 120.37 2dcq h PHE 33 Ca -0.00 0.00 -0.31 0.00 2.80 0.00 0.00 57.97 60.45 2dcq h PHE 33 Cb 1.30 0.00 -0.04 0.00 2.20 0.00 0.00 35.95 39.40 2dcq h PHE 33 CO 0.00 0.00 -1.81 0.54 -0.60 0.00 0.00 178.31 176.44 2dcq n ARG 34 N -3.06 0.66 0.00 1.51 1.74 -0.89 -3.18 116.66 113.44 2dcq n ARG 34 Ca -0.01 0.27 0.00 0.00 -0.77 0.00 0.00 57.85 57.35 2dcq n ARG 34 Cb 0.20 -1.76 -0.00 0.00 -1.02 0.00 0.00 32.46 29.88 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 -3.12 5.28 0.00 5.56 10.64 -1.05 -4.64 117.38 130.04 2dcq n GLN 35 Ca -0.21 -0.11 0.00 0.00 -1.83 0.00 0.00 57.00 54.85 2dcq n GLN 35 Cb 1.06 -0.62 0.00 0.00 -0.86 0.00 0.00 30.24 29.81 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 -0.80 0.00 0.00 -0.39 0.31 0.02 -4.83 118.33 112.63 2dcq n VAL 36 Ca 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.33 2dcq n VAL 36 Cb 0.01 -0.42 0.00 0.00 -0.91 0.00 0.00 33.84 32.52 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 2.94 -1.17 3.14 2.92 0.00 -0.49 -4.41 105.19 108.12 2dcq n GLY 37 Ca 0.00 -2.10 -0.14 0.00 0.00 0.00 0.00 46.02 43.79 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 1.25 0.32 1.61 0.01 -1.26 -3.97 113.70 107.66 2dcq s SER 38 Ca 0.00 -0.74 -0.28 0.00 1.31 0.00 0.00 55.95 56.24 2dcq s SER 38 Cb 0.00 0.02 -0.09 0.00 0.21 0.00 0.00 66.02 66.16 2dcq s SER 38 CO 0.00 -0.25 1.13 -2.16 0.41 0.00 0.00 173.24 172.37 2dcq s PRO 39 N -2.45 4.46 -1.12 12.44 0.04 -1.26 -0.16 135.00 146.94 2dcq s PRO 39 Ca 0.01 1.83 -0.09 0.00 0.04 0.00 0.00 61.00 62.79 2dcq s PRO 39 Cb -0.05 -3.02 0.27 0.00 0.04 0.00 0.00 34.50 31.74 2dcq s PRO 39 CO -0.00 0.04 1.15 -1.71 0.04 0.00 0.00 177.00 176.52 2dcq n ASN 40 N 0.83 5.54 -0.34 6.66 5.15 -0.44 -4.41 115.26 128.24 2dcq n ASN 40 Ca 0.01 -3.05 0.14 0.00 -0.60 0.00 0.00 54.58 51.08 2dcq n ASN 40 Cb 0.45 -1.39 0.63 0.00 -0.53 0.00 0.00 39.78 38.94 2dcq n ASN 40 CO 0.00 0.00 0.00 2.30 1.40 0.00 0.00 177.26 180.96 2dcq n ILE 41 N 2.75 0.00 -0.15 -1.44 -5.35 -1.26 -4.55 119.36 109.36 2dcq n ILE 41 Ca 0.25 -0.18 -0.02 0.00 -0.27 0.00 0.00 62.75 62.53 2dcq n ILE 41 Cb 0.39 0.22 0.19 0.00 -1.74 0.00 0.00 39.64 38.71 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 1.65 0.87 0.00 6.28 3.11 -1.84 -0.19 116.57 126.45 2dcq h LYS 42 Ca 0.00 -0.16 0.00 0.00 -2.81 0.00 0.00 60.65 57.68 2dcq h LYS 42 Cb 0.37 -0.14 0.00 0.00 -1.00 0.00 0.00 32.23 31.46 2dcq h LYS 42 CO 0.00 0.74 0.00 0.41 -2.81 0.00 0.00 179.45 177.79 2dcq n GLY 43 N -0.95 -0.68 0.04 5.01 0.00 -1.26 -1.07 105.19 106.28 2dcq n GLY 43 Ca 0.05 -0.02 0.12 0.00 0.00 0.00 0.00 46.02 46.17 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 -1.47 0.57 0.00 0.99 4.77 -0.08 -4.95 117.00 116.83 2dcq n LEU 44 Ca 0.02 0.22 0.00 0.00 -0.03 0.00 0.00 56.01 56.21 2dcq n LEU 44 Cb 0.07 -0.25 0.00 0.00 -2.33 0.00 0.00 43.42 40.91 2dcq n LEU 44 CO 0.06 -0.00 0.00 0.61 -1.33 0.00 0.00 177.39 176.72 2dcq n GLY 45 N 1.40 1.73 3.61 -0.72 0.00 -0.24 -4.87 105.19 106.11 2dcq n GLY 45 Ca 0.05 -0.12 -0.03 0.00 0.00 0.00 0.00 46.02 45.91 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 0.57 0.72 1.61 0.00 -1.09 -5.02 119.74 116.53 2dcq s LYS 46 Ca 0.00 -0.27 -0.11 0.00 0.00 0.00 0.00 55.97 55.60 2dcq s LYS 46 Cb 0.00 0.22 0.04 0.00 0.00 0.00 0.00 37.83 38.09 2dcq s LYS 46 CO 0.00 -0.26 1.09 0.21 0.00 0.00 0.00 175.35 176.39 2dcq s LYS 47 N -2.68 2.55 0.60 1.78 2.47 -1.26 -3.27 119.74 119.92 2dcq s LYS 47 Ca 0.11 0.24 -0.19 0.00 -1.56 0.00 0.00 55.97 54.57 2dcq s LYS 47 Cb 0.01 -2.04 -0.03 0.00 -1.46 0.00 0.00 37.83 34.30 2dcq s LYS 47 CO -0.04 -1.17 1.23 0.00 0.16 0.00 0.00 175.35 175.52 2dcq s ALA 48 N -3.37 2.53 0.05 3.13 0.00 -1.26 -4.84 121.76 118.00 2dcq s ALA 48 Ca 0.59 1.05 -0.30 0.00 0.00 0.00 0.00 51.96 53.30 2dcq s ALA 48 Cb -0.11 -3.47 -0.04 0.00 0.00 0.00 0.00 23.12 19.50 2dcq s ALA 48 CO 0.50 -1.23 0.99 0.08 0.00 0.00 0.00 175.76 176.09 2dcq s VAL 49 N -1.55 4.63 -0.18 0.00 1.01 -0.75 -4.95 120.40 118.62 2dcq s VAL 49 Ca 0.78 2.01 -0.08 0.00 0.00 0.00 0.00 61.98 64.68 2dcq s VAL 49 Cb -0.32 -4.28 -0.04 0.00 0.00 0.00 0.00 36.38 31.73 2dcq s VAL 49 CO 0.34 0.22 0.10 -0.94 0.00 0.00 0.00 175.10 174.83 2dcq s SER 50 N 0.59 6.02 -0.29 3.32 1.04 -1.26 -0.67 113.70 122.44 2dcq s SER 50 Ca 0.50 0.21 -0.04 0.00 0.48 0.00 0.00 55.95 57.11 2dcq s SER 50 Cb -0.23 -2.02 0.17 0.00 0.10 0.00 0.00 66.02 64.03 2dcq s SER 50 CO 0.29 0.22 0.59 -0.89 0.98 0.00 0.00 173.24 174.43 2dcq s THR 51 N 0.11 -0.95 0.05 2.02 2.01 -0.79 -4.95 115.64 113.14 2dcq s THR 51 Ca 0.08 0.00 -0.30 0.00 0.31 0.00 0.00 61.69 61.77 2dcq s THR 51 Cb -0.12 -0.97 -0.09 0.00 0.01 0.00 0.00 72.50 71.34 2dcq s THR 51 CO -0.00 -0.01 1.86 -0.69 -0.69 0.00 0.00 174.62 175.09 2dcq s VAL 52 N 2.83 3.00 0.47 3.82 1.01 -1.26 -4.11 120.40 126.16 2dcq s VAL 52 Ca 0.13 0.17 -0.23 0.00 0.00 0.00 0.00 61.98 62.05 2dcq s VAL 52 Cb -0.14 -3.11 -0.07 0.00 0.00 0.00 0.00 36.38 33.06 2dcq s VAL 52 CO -0.20 -0.01 1.24 -0.47 0.00 0.00 0.00 175.10 175.66 2dcq s TYR 53 N 3.85 2.72 -0.12 5.22 5.04 -1.23 -5.01 117.35 127.82 2dcq s TYR 53 Ca 0.83 1.47 -0.02 0.00 -2.44 0.00 0.00 57.07 56.92 2dcq s TYR 53 Cb -0.42 -3.54 0.04 0.00 0.35 0.00 0.00 41.96 38.39 2dcq s TYR 53 CO 0.38 -1.96 0.01 -0.80 -1.34 0.00 0.00 175.55 171.84 2dcq s ASN 54 N -1.14 2.09 0.20 4.32 0.01 -1.26 -5.01 114.94 114.15 2dcq s ASN 54 Ca 0.64 -0.35 0.24 0.00 -0.71 0.00 0.00 52.86 52.68 2dcq s ASN 54 Cb -0.33 -0.53 0.91 0.00 0.41 0.00 0.00 41.25 41.71 2dcq s ASN 54 CO 0.41 -0.23 1.74 0.61 -1.51 0.00 0.00 177.10 178.12 2dcq n GLY 55 N 5.10 -1.44 0.33 0.66 0.00 -1.26 -2.99 105.19 105.58 2dcq n GLY 55 Ca -0.08 0.02 -0.03 0.00 0.00 0.00 0.00 46.02 45.93 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 1.09 -2.21 1.61 4.81 -2.03 -3.38 114.58 114.47 2dcq h GLU 56 Ca 0.00 -0.07 -0.58 0.00 -0.13 0.00 0.00 59.36 58.59 2dcq h GLU 56 Cb 0.51 -0.25 -0.39 0.00 0.63 0.00 0.00 28.75 29.25 2dcq h GLU 56 CO 0.00 0.72 -0.95 -0.40 -0.73 0.00 0.00 179.01 177.66 2dcq n ASP 57 N -4.51 0.84 -0.08 1.04 5.75 -1.16 -5.00 116.55 113.43 2dcq n ASP 57 Ca 0.10 -2.78 -0.10 0.00 -0.01 0.00 0.00 54.79 51.99 2dcq n ASP 57 Cb 0.04 -0.63 -0.07 0.00 -1.03 0.00 0.00 41.12 39.42 2dcq n ASP 57 CO 0.00 0.00 0.00 0.11 -0.11 0.00 0.00 177.20 177.20 2dcq h LYS 58 N 4.56 -0.30 -0.17 0.11 1.79 -1.75 0.29 116.57 121.09 2dcq h LYS 58 Ca 0.15 0.02 -0.06 0.00 -2.18 0.00 0.00 60.65 58.58 2dcq h LYS 58 Cb 0.84 0.07 -0.01 0.00 -1.58 0.00 0.00 32.23 31.55 2dcq h LYS 58 CO 0.52 -0.20 -0.16 -1.00 -1.08 0.00 0.00 179.45 177.53 2dcq h PRO 59 N -0.32 0.28 0.00 3.15 0.13 -1.94 -2.59 132.00 130.71 2dcq h PRO 59 Ca 0.05 -0.07 0.00 0.00 -0.87 0.00 0.00 66.00 65.10 2dcq h PRO 59 Cb 0.44 -0.03 0.00 0.00 0.13 0.00 0.00 31.00 31.54 2dcq h PRO 59 CO -0.41 0.44 0.00 0.41 -0.23 0.00 0.00 178.00 178.22 2dcq n GLY 60 N -0.76 -0.67 0.24 1.56 0.00 -0.44 -2.49 105.19 102.63 2dcq n GLY 60 Ca -0.01 -0.05 -0.22 0.00 0.00 0.00 0.00 46.02 45.75 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 -1.31 0.00 0.25 1.61 7.35 -0.04 -4.48 117.46 120.84 2dcq n PHE 61 Ca 0.05 0.00 0.15 0.00 -0.76 0.00 0.00 57.45 56.89 2dcq n PHE 61 Cb 0.09 -0.82 0.81 0.00 0.35 0.00 0.00 39.48 39.91 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 -0.59 0.00 -1.07 -2.13 3.38 -1.26 -1.90 115.31 111.74 2dcq h LEU 62 Ca -0.55 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.42 2dcq h LEU 62 Cb 1.57 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.32 2dcq h LEU 62 CO -0.28 0.00 0.00 2.29 0.09 0.00 0.00 178.44 180.54 2dcq n LYS 63 N -2.62 0.15 -0.08 1.13 -0.00 -1.04 -2.04 118.16 113.66 2dcq n LYS 63 Ca -0.02 0.54 -0.17 0.00 -0.00 0.00 0.00 58.31 58.67 2dcq n LYS 63 Cb 0.15 -1.90 -0.11 0.00 -0.00 0.00 0.00 35.03 33.17 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 0.00 -0.83 -1.58 1.79 -1.65 -3.40 116.57 110.89 2dcq h LYS 64 Ca 0.00 0.00 -0.02 0.00 -2.18 0.00 0.00 60.65 58.45 2dcq h LYS 64 Cb 0.15 0.00 -0.04 0.00 -1.58 0.00 0.00 32.23 30.76 2dcq h LYS 64 CO 0.00 0.91 0.45 -0.07 -1.08 0.00 0.00 179.45 179.66 2dcq h LEU 65 N -1.00 1.04 0.00 2.94 4.07 -1.57 -2.86 115.31 117.93 2dcq h LEU 65 Ca -0.16 -0.09 0.00 0.00 0.08 0.00 0.00 57.88 57.71 2dcq h LEU 65 Cb 1.07 -0.27 0.00 0.00 1.08 0.00 0.00 40.66 42.55 2dcq h LEU 65 CO -0.10 0.84 0.00 -1.20 -1.08 0.00 0.00 178.44 176.91 2dcq n SER 66 N -4.34 0.00 -0.03 -0.43 7.64 -1.07 -0.90 113.62 114.49 2dcq n SER 66 Ca 0.09 -0.13 0.01 0.00 1.01 0.00 0.00 58.87 59.85 2dcq n SER 66 Cb 0.10 -0.02 0.01 0.00 -1.01 0.00 0.00 64.21 63.29 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 -1.02 1.31 -0.03 -3.43 -0.00 -1.08 -4.86 117.00 107.87 2dcq n LEU 67 Ca 0.04 -1.42 0.01 0.00 -0.00 0.00 0.00 56.01 54.64 2dcq n LEU 67 Cb 0.02 -0.04 -0.01 0.00 -0.00 0.00 0.00 43.42 43.39 2dcq n LEU 67 CO 0.03 0.35 0.08 0.29 -0.00 0.00 0.00 177.39 178.14 2dcq n LYS 68 N -0.40 4.18 -4.44 1.47 4.01 -0.08 -5.03 118.16 117.86 2dcq n LYS 68 Ca 0.01 -0.20 -0.22 0.00 -0.51 0.00 0.00 58.31 57.39 2dcq n LYS 68 Cb 0.38 -0.75 -0.13 0.00 -0.51 0.00 0.00 35.03 34.02 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 -0.95 1.49 -0.02 2.13 0.40 -1.24 -5.01 117.98 114.78 2dcq s PHE 69 Ca 0.02 -0.37 0.12 0.00 -0.60 0.00 0.00 56.93 56.10 2dcq s PHE 69 Cb 0.02 -0.88 -0.19 0.00 0.51 0.00 0.00 43.02 42.48 2dcq s PHE 69 CO 0.09 0.07 0.90 1.57 0.70 0.00 0.00 175.22 178.55 2dcq h LYS 70 N 4.79 0.00 -1.17 0.44 2.10 -1.96 -3.42 116.57 117.36 2dcq h LYS 70 Ca -0.41 0.00 -0.42 0.00 -2.00 0.00 0.00 60.65 57.83 2dcq h LYS 70 Cb 1.17 0.00 -0.29 0.00 -0.90 0.00 0.00 32.23 32.22 2dcq h LYS 70 CO 0.43 0.59 -0.86 -3.47 -2.00 0.00 0.00 179.45 174.14 2dcq n ASP 71 N -3.11 -1.07 0.12 7.07 -0.08 -1.26 -4.98 116.55 113.25 2dcq n ASP 71 Ca -0.10 -2.97 0.01 0.00 -1.51 0.00 0.00 54.79 50.22 2dcq n ASP 71 Cb 0.97 0.39 0.33 0.00 2.34 0.00 0.00 41.12 45.14 2dcq n ASP 71 CO 0.00 0.00 0.00 1.55 0.12 0.00 0.00 177.20 178.87 2dcq h PRO 72 N 3.94 0.19 0.00 -0.67 0.13 -1.91 -0.93 132.00 132.76 2dcq h PRO 72 Ca -0.02 -0.06 -0.01 0.00 -0.87 0.00 0.00 66.00 65.04 2dcq h PRO 72 Cb 0.95 -0.02 -0.00 0.00 0.13 0.00 0.00 31.00 32.06 2dcq h PRO 72 CO 0.40 0.46 -0.05 1.05 -0.23 0.00 0.00 178.00 179.63 2dcq h GLU 73 N 0.17 0.00 -0.00 0.86 4.11 -1.90 -2.72 114.58 115.10 2dcq h GLU 73 Ca 0.03 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.46 2dcq h GLU 73 Cb 0.58 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.83 2dcq h GLU 73 CO 0.04 0.05 -0.00 0.09 0.07 0.00 0.00 179.01 179.26 2dcq n ASN 74 N -4.29 0.92 -4.77 3.06 3.02 -1.19 -2.95 115.26 109.06 2dcq n ASN 74 Ca -0.03 -0.96 -0.36 0.00 -0.03 0.00 0.00 54.58 53.20 2dcq n ASN 74 Cb 0.13 0.14 0.00 0.00 -0.61 0.00 0.00 39.78 39.45 2dcq n ASN 74 CO 0.00 0.00 0.00 -0.89 -2.62 0.00 0.00 177.26 173.75 2dcq s THR 75 N -0.21 3.02 -0.50 3.41 2.01 -0.36 -4.85 115.64 118.17 2dcq s THR 75 Ca 0.01 0.68 -0.05 0.00 0.31 0.00 0.00 61.69 62.64 2dcq s THR 75 Cb 0.01 -3.31 0.13 0.00 0.01 0.00 0.00 72.50 69.34 2dcq s THR 75 CO 0.01 -0.09 0.32 -0.89 -0.69 0.00 0.00 174.62 173.29 2dcq s THR 76 N -1.64 3.71 0.50 -0.82 2.01 -0.20 -3.59 115.64 115.60 2dcq s THR 76 Ca 0.70 -2.24 -0.20 0.00 0.31 0.00 0.00 61.69 60.26 2dcq s THR 76 Cb -0.27 -3.47 -0.08 0.00 0.01 0.00 0.00 72.50 68.68 2dcq s THR 76 CO 0.31 -0.77 1.04 -0.22 -0.69 0.00 0.00 174.62 174.29 2dcq s LEU 77 N 0.85 3.81 -0.22 4.42 0.20 -1.19 -0.78 118.68 125.77 2dcq s LEU 77 Ca 0.10 1.90 -0.02 0.00 0.69 0.00 0.00 54.13 56.80 2dcq s LEU 77 Cb -0.23 -4.56 0.07 0.00 -0.43 0.00 0.00 46.19 41.05 2dcq s LEU 77 CO -0.03 -0.80 0.04 -0.31 -0.29 0.00 0.00 176.35 174.96 2dcq s TYR 78 N -2.05 1.13 0.41 5.38 1.51 -0.39 -1.15 117.35 122.19 2dcq s TYR 78 Ca 0.66 -1.01 -0.22 0.00 -1.01 0.00 0.00 57.07 55.50 2dcq s TYR 78 Cb -0.16 -1.13 -0.11 0.00 -0.11 0.00 0.00 41.96 40.46 2dcq s TYR 78 CO 0.22 -0.66 0.96 0.42 -1.11 0.00 0.00 175.55 175.37 2dcq s ILE 79 N 1.82 4.29 -0.23 2.71 1.01 -0.63 -2.56 121.20 127.62 2dcq s ILE 79 Ca 0.01 1.54 -0.01 0.00 0.00 0.00 0.00 60.65 62.18 2dcq s ILE 79 Cb -0.17 -3.68 0.07 0.00 0.01 0.00 0.00 42.46 38.68 2dcq s ILE 79 CO -0.11 -0.20 0.01 -0.22 0.00 0.00 0.00 174.94 174.41 2dcq s LEU 80 N -2.93 1.92 0.64 2.97 0.20 -0.21 -3.03 118.68 118.24 2dcq s LEU 80 Ca 0.60 -1.08 0.02 0.00 0.69 0.00 0.00 54.13 54.35 2dcq s LEU 80 Cb -0.12 -0.88 0.09 0.00 -0.43 0.00 0.00 46.19 44.86 2dcq s LEU 80 CO 0.16 -0.29 0.89 -0.62 -0.29 0.00 0.00 176.35 176.19 2dcq s ASP 81 N 1.63 4.76 0.04 3.68 2.15 -1.26 -1.65 116.67 126.02 2dcq s ASP 81 Ca -0.01 -0.39 -0.25 0.00 0.43 0.00 0.00 52.55 52.32 2dcq s ASP 81 Cb -0.18 -0.16 -0.17 0.00 -0.30 0.00 0.00 42.92 42.11 2dcq s ASP 81 CO -0.09 -1.55 1.46 0.11 -0.17 0.00 0.00 175.17 174.93 2dcq h LYS 82 N -0.20 -0.21 0.00 4.34 1.57 -1.91 0.15 116.57 120.31 2dcq h LYS 82 Ca -0.36 0.01 0.00 0.00 -1.87 0.00 0.00 60.65 58.43 2dcq h LYS 82 Cb 1.28 0.05 0.00 0.00 0.08 0.00 0.00 32.23 33.64 2dcq h LYS 82 CO 0.43 0.04 0.00 0.34 -0.57 0.00 0.00 179.45 179.69 2dcq n PHE 83 N -5.09 -1.44 0.04 -1.35 -0.00 -1.26 -1.21 117.46 107.15 2dcq n PHE 83 Ca -0.09 0.26 0.00 0.00 -0.00 0.00 0.00 57.45 57.62 2dcq n PHE 83 Cb 0.19 0.59 0.00 0.00 -0.00 0.00 0.00 39.48 40.26 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 -3.03 -0.02 0.00 -2.13 8.00 -1.26 -2.52 116.55 115.59 2dcq n ASP 84 Ca 0.00 0.15 0.00 0.00 0.71 0.00 0.00 54.79 55.65 2dcq n ASP 84 Cb 0.00 0.11 0.00 0.00 -0.02 0.00 0.00 41.12 41.21 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 1.68 1.62 1.29 0.44 0.00 -1.26 -1.99 105.19 106.97 2dcq n GLY 85 Ca 0.00 0.34 0.01 0.00 0.00 0.00 0.00 46.02 46.36 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 11.57 0.40 -0.16 1.61 4.13 -1.26 -4.99 115.26 126.55 2dcq n ASN 86 Ca 0.00 -1.98 -0.04 0.00 1.68 0.00 0.00 54.58 54.24 2dcq n ASN 86 Cb 0.00 -0.13 0.02 0.00 -1.54 0.00 0.00 39.78 38.13 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 0.66 -0.86 0.69 6.41 4.64 -1.80 0.19 113.55 123.48 2dcq h SER 87 Ca -0.30 0.19 0.00 0.00 -0.47 0.00 0.00 61.79 61.21 2dcq h SER 87 Cb 1.72 0.45 0.00 0.00 -0.31 0.00 0.00 62.40 64.27 2dcq h SER 87 CO -0.01 -0.26 0.00 -0.33 -0.87 0.00 0.00 176.83 175.36 2dcq h GLU 88 N -0.13 0.00 0.02 4.77 5.08 -1.92 -1.62 114.58 120.78 2dcq h GLU 88 Ca 0.23 0.00 -0.00 0.00 -1.00 0.00 0.00 59.36 58.59 2dcq h GLU 88 Cb 0.50 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.75 2dcq h GLU 88 CO -0.59 0.00 -0.01 1.25 -1.00 0.00 0.00 179.01 178.66 2dcq h LEU 89 N 0.00 -0.02 -1.39 1.33 7.12 -1.41 -3.30 115.31 117.64 2dcq h LEU 89 Ca 0.00 -0.74 -0.06 0.00 0.13 0.00 0.00 57.88 57.20 2dcq h LEU 89 Cb 0.34 0.01 -0.01 0.00 -0.53 0.00 0.00 40.66 40.47 2dcq h LEU 89 CO 0.00 0.77 -0.30 0.58 -0.13 0.00 0.00 178.44 179.35 2dcq h VAL 90 N -0.85 1.15 -0.90 1.05 2.07 -0.82 -1.00 116.25 116.95 2dcq h VAL 90 Ca -0.00 -1.06 0.04 0.00 0.82 0.00 0.00 66.70 66.49 2dcq h VAL 90 Cb 0.76 1.58 -0.05 0.00 -1.52 0.00 0.00 31.29 32.06 2dcq h VAL 90 CO 0.00 0.30 0.58 0.00 0.02 0.00 0.00 177.57 178.47 2dcq h ALA 91 N 1.70 1.19 -0.44 1.67 0.00 -1.44 -1.53 119.26 120.41 2dcq h ALA 91 Ca -0.00 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 54.87 2dcq h ALA 91 Cb 0.56 -0.31 0.00 0.00 0.00 0.00 0.00 17.79 18.04 2dcq h ALA 91 CO 0.04 0.44 0.00 -0.85 0.00 0.00 0.00 179.25 178.88 2dcq n GLU 92 N -4.52 3.59 -0.08 0.00 0.28 -0.44 -3.96 120.64 115.51 2dcq n GLU 92 Ca 0.12 -2.24 -0.16 0.00 -0.16 0.00 0.00 57.16 54.71 2dcq n GLU 92 Cb 0.09 -1.95 -0.05 0.00 1.43 0.00 0.00 31.44 30.95 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 0.56 1.45 -0.07 -1.84 7.94 -0.63 -4.41 117.00 120.01 2dcq n LEU 93 Ca 0.20 0.24 -0.10 0.00 -1.11 0.00 0.00 56.01 55.25 2dcq n LEU 93 Cb 0.86 -0.58 -0.03 0.00 0.53 0.00 0.00 43.42 44.20 2dcq n LEU 93 CO 0.22 0.16 0.94 -0.37 -1.11 0.00 0.00 177.39 177.23 2dcq h VAL 94 N -0.69 1.10 -0.27 1.96 -1.51 -1.57 -1.41 116.25 113.87 2dcq h VAL 94 Ca -0.35 -0.26 0.02 0.00 -1.23 0.00 0.00 66.70 64.88 2dcq h VAL 94 Cb 1.21 0.83 -0.02 0.00 -2.13 0.00 0.00 31.29 31.18 2dcq h VAL 94 CO -0.21 0.10 0.14 0.00 -1.23 0.00 0.00 177.57 176.38 2dcq h ALA 95 N 1.04 0.34 0.00 5.19 0.00 -1.79 -1.03 119.26 123.01 2dcq h ALA 95 Ca 0.09 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.00 2dcq h ALA 95 Cb 0.04 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 17.77 2dcq h ALA 95 CO -0.02 -0.24 0.00 1.28 0.00 0.00 0.00 179.25 180.27 2dcq n LEU 96 N -4.96 0.00 -0.22 0.00 4.32 -0.98 -1.90 117.00 113.27 2dcq n LEU 96 Ca -0.01 0.00 0.05 0.00 -0.02 0.00 0.00 56.01 56.03 2dcq n LEU 96 Cb 0.06 0.00 0.07 0.00 -1.62 0.00 0.00 43.42 41.93 2dcq n LEU 96 CO 0.32 0.00 0.44 0.59 -1.22 0.00 0.00 177.39 177.51 2dcq n ASN 97 N -0.89 1.37 0.00 -1.43 3.02 -0.45 -5.01 115.26 111.87 2dcq n ASN 97 Ca 0.07 -2.52 0.00 0.00 -0.03 0.00 0.00 54.58 52.10 2dcq n ASN 97 Cb 0.03 -0.30 0.00 0.00 -0.61 0.00 0.00 39.78 38.91 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 -0.79 1.36 4.00 7.41 0.00 -0.80 -5.01 105.19 111.36 2dcq n GLY 98 Ca 0.08 -0.16 -0.22 0.00 0.00 0.00 0.00 46.02 45.72 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 2.00 0.00 1.61 0.40 -0.84 -4.17 117.98 114.98 2dcq s PHE 99 Ca 0.00 -0.29 0.00 0.00 -0.60 0.00 0.00 56.93 56.04 2dcq s PHE 99 Cb 0.00 -2.74 0.00 0.00 0.51 0.00 0.00 43.02 40.79 2dcq s PHE 99 CO 0.00 -1.28 0.25 1.17 0.70 0.00 0.00 175.22 176.06 2dcq n LYS 100 N -2.52 0.00 -3.83 0.44 3.00 -1.09 -4.48 118.16 109.69 2dcq n LYS 100 Ca 0.13 0.00 -0.11 0.00 -0.00 0.00 0.00 58.31 58.33 2dcq n LYS 100 Cb 0.60 -0.72 -0.08 0.00 0.00 0.00 0.00 35.03 34.83 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 -1.62 0.01 0.06 3.14 0.01 -1.26 -4.76 113.70 109.29 2dcq s SER 101 Ca 0.00 -0.34 -0.14 0.00 1.31 0.00 0.00 55.95 56.78 2dcq s SER 101 Cb 0.00 0.30 0.02 0.00 0.21 0.00 0.00 66.02 66.55 2dcq s SER 101 CO 0.00 -0.57 0.31 0.00 0.41 0.00 0.00 173.24 173.39 2dcq s ALA 102 N -2.59 -0.70 0.30 1.44 0.00 -1.26 -3.19 121.76 115.76 2dcq s ALA 102 Ca -0.05 -0.05 0.02 0.00 0.00 0.00 0.00 51.96 51.89 2dcq s ALA 102 Cb -0.01 0.40 -0.05 0.00 0.00 0.00 0.00 23.12 23.46 2dcq s ALA 102 CO -0.04 -0.46 0.11 0.71 0.00 0.00 0.00 175.76 176.08 2dcq s TYR 103 N -2.89 1.64 0.34 0.00 1.51 -0.30 -4.79 117.35 112.87 2dcq s TYR 103 Ca -0.03 -1.22 0.05 0.00 -1.01 0.00 0.00 57.07 54.86 2dcq s TYR 103 Cb 0.00 -0.97 -0.03 0.00 -0.11 0.00 0.00 41.96 40.85 2dcq s TYR 103 CO -0.05 -0.34 0.19 0.00 -1.11 0.00 0.00 175.55 174.23 2dcq s ALA 104 N -3.59 2.23 -0.12 3.71 0.00 -1.26 -1.60 121.76 121.13 2dcq s ALA 104 Ca 0.36 -1.68 0.02 0.00 0.00 0.00 0.00 51.96 50.66 2dcq s ALA 104 Cb 0.07 1.13 0.01 0.00 0.00 0.00 0.00 23.12 24.33 2dcq s ALA 104 CO 0.15 -0.50 -0.20 -1.50 0.00 0.00 0.00 175.76 173.71 2dcq s ILE 105 N -3.44 1.85 0.78 0.00 2.07 -1.17 -3.86 121.20 117.44 2dcq s ILE 105 Ca 0.33 -0.86 -0.13 0.00 -1.41 0.00 0.00 60.65 58.58 2dcq s ILE 105 Cb 0.03 -1.65 0.07 0.00 0.13 0.00 0.00 42.46 41.04 2dcq s ILE 105 CO 0.20 0.51 1.17 -0.75 -1.91 0.00 0.00 174.94 174.15 2dcq s LYS 106 N 0.82 1.89 0.00 3.50 2.47 -0.48 -3.14 119.74 124.80 2dcq s LYS 106 Ca -0.08 1.60 0.00 0.00 -1.56 0.00 0.00 55.97 55.92 2dcq s LYS 106 Cb -0.16 -1.82 0.00 0.00 -1.46 0.00 0.00 37.83 34.39 2dcq s LYS 106 CO -0.00 -1.99 0.00 -0.25 0.16 0.00 0.00 175.35 173.27 2dcq n ASP 107 N -3.22 0.00 0.00 1.43 9.92 -1.16 -4.40 116.55 119.12 2dcq n ASP 107 Ca 0.12 0.00 0.00 0.00 -0.53 0.00 0.00 54.79 54.38 2dcq n ASP 107 Cb 0.51 -2.16 0.00 0.00 -0.64 0.00 0.00 41.12 38.83 2dcq n ASP 107 CO 0.00 0.00 0.00 0.61 0.13 0.00 0.00 177.20 177.94 2dcq n GLY 108 N -2.00 2.86 0.09 0.44 0.00 -1.05 -1.02 105.19 104.52 2dcq n GLY 108 Ca 0.00 -0.20 -0.16 0.00 0.00 0.00 0.00 46.02 45.66 2dcq n GLY 108 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2dcq h ALA 109 N -0.69 0.17 -0.01 4.61 0.00 -0.42 0.67 119.26 123.59 2dcq h ALA 109 Ca 0.00 -0.95 0.00 0.00 0.00 0.00 0.00 54.91 53.96 2dcq h ALA 109 Cb 0.00 0.64 0.00 0.00 0.00 0.00 0.00 17.79 18.43 2dcq h ALA 109 CO 0.00 0.62 -0.43 0.39 0.00 0.00 0.00 179.25 179.82 2dcq n GLU 110 N -4.50 0.91 -0.80 0.00 -0.58 -0.35 -1.40 120.64 113.91 2dcq n GLU 110 Ca -0.23 -0.68 -0.28 0.00 -0.42 0.00 0.00 57.16 55.55 2dcq n GLU 110 Cb 0.53 -1.49 0.23 0.00 -0.57 0.00 0.00 31.44 30.14 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 -2.55 1.54 0.50 0.62 0.00 -0.18 -4.86 107.32 102.38 2dcq s GLY 111 Ca 0.20 -0.34 0.27 0.00 0.00 0.00 0.00 44.72 44.84 2dcq s GLY 111 CO 0.58 0.38 2.00 -0.56 0.00 0.00 0.00 173.10 175.50 2dcq h PRO 112 N -2.44 0.00 -0.39 2.90 0.13 -1.93 -1.93 132.00 128.35 2dcq h PRO 112 Ca -0.58 0.00 -0.25 0.00 -0.87 0.00 0.00 66.00 64.30 2dcq h PRO 112 Cb 1.34 0.00 -0.39 0.00 0.13 0.00 0.00 31.00 32.07 2dcq h PRO 112 CO 0.51 0.15 -1.07 0.54 -0.23 0.00 0.00 178.00 177.90 2dcq n ARG 113 N -3.55 1.63 0.00 0.86 1.74 -1.26 -4.78 116.66 111.30 2dcq n ARG 113 Ca -0.01 -3.34 0.00 0.00 -0.77 0.00 0.00 57.85 53.72 2dcq n ARG 113 Cb 0.29 -1.43 0.00 0.00 -1.02 0.00 0.00 32.46 30.30 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 -0.46 -1.82 0.41 -0.13 0.00 -0.73 -4.50 105.19 97.96 2dcq n GLY 114 Ca 0.10 -1.52 -0.09 0.00 0.00 0.00 0.00 46.02 44.51 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 -1.01 -1.47 0.00 1.61 2.91 -0.65 -0.46 115.95 116.88 2dcq h TRP 115 Ca 0.00 0.10 0.00 0.00 1.13 0.00 0.00 58.89 60.12 2dcq h TRP 115 Cb 0.00 0.74 0.00 0.00 -0.51 0.00 0.00 29.16 29.39 2dcq h TRP 115 CO 0.00 -0.42 0.00 -0.07 -1.03 0.00 0.00 178.44 176.92 2dcq h LEU 116 N -0.17 0.00 -3.14 0.65 3.38 -1.50 -2.30 115.31 112.22 2dcq h LEU 116 Ca 0.18 0.00 -0.10 0.00 0.09 0.00 0.00 57.88 58.05 2dcq h LEU 116 Cb 0.54 0.00 -0.10 0.00 0.09 0.00 0.00 40.66 41.18 2dcq h LEU 116 CO -0.77 0.00 -0.61 0.59 0.09 0.00 0.00 178.44 177.74 2dcq n ASN 117 N -2.52 2.06 -0.31 -0.43 3.02 -0.27 -4.55 115.26 112.26 2dcq n ASN 117 Ca 0.00 -3.65 0.02 0.00 -0.03 0.00 0.00 54.58 50.92 2dcq n ASN 117 Cb 0.16 -0.48 0.03 0.00 -0.61 0.00 0.00 39.78 38.88 2dcq n ASN 117 CO 0.00 0.00 0.00 -0.24 -2.62 0.00 0.00 177.26 174.40 2dcq n SER 118 N -0.89 0.60 -2.53 6.41 2.88 -0.66 -4.45 113.62 114.98 2dcq n SER 118 Ca 0.21 -2.07 -0.19 0.00 -1.33 0.00 0.00 58.87 55.48 2dcq n SER 118 Cb 0.78 -0.21 -0.00 0.00 -0.75 0.00 0.00 64.21 64.03 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 -0.33 -5.38 -4.85 -3.46 2.88 -1.25 -4.82 113.62 96.41 2dcq n SER 119 Ca 0.03 -0.02 -0.35 0.00 -1.33 0.00 0.00 58.87 57.21 2dcq n SER 119 Cb 0.63 -4.47 -0.06 0.00 -0.75 0.00 0.00 64.21 59.56 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 -6.05 4.31 0.46 2.46 1.43 -1.07 -5.05 118.68 115.18 2dcq s LEU 120 Ca 0.06 0.99 -0.20 0.00 -1.03 0.00 0.00 54.13 53.95 2dcq s LEU 120 Cb -0.03 -3.28 -0.10 0.00 0.03 0.00 0.00 46.19 42.82 2dcq s LEU 120 CO 0.07 0.09 0.98 -2.16 0.23 0.00 0.00 176.35 175.56 2dcq s PRO 121 N -2.10 4.03 0.05 1.29 0.04 -1.26 -4.65 135.00 132.39 2dcq s PRO 121 Ca 0.38 1.17 0.06 0.00 0.04 0.00 0.00 61.00 62.65 2dcq s PRO 121 Cb -0.14 -2.14 -0.02 0.00 0.04 0.00 0.00 34.50 32.23 2dcq s PRO 121 CO 0.19 -0.21 -0.17 -0.46 0.04 0.00 0.00 177.00 176.39 2dcq s TRP 122 N -2.20 1.52 -0.08 0.56 -0.00 -1.26 -1.33 118.94 116.14 2dcq s TRP 122 Ca 0.63 -0.37 -0.23 0.00 -0.00 0.00 0.00 56.10 56.13 2dcq s TRP 122 Cb -0.11 -0.89 -0.19 0.00 -0.00 0.00 0.00 33.47 32.27 2dcq s TRP 122 CO 0.19 0.07 0.84 0.82 -0.00 0.00 0.00 176.95 178.87 2dcq h ILE 123 N 4.40 1.24 -0.07 5.86 2.04 -0.76 -3.39 117.51 126.83 2dcq h ILE 123 Ca -0.41 -1.58 0.01 0.00 1.00 0.00 0.00 64.86 63.88 2dcq h ILE 123 Cb 1.17 2.19 -0.00 0.00 -0.74 0.00 0.00 36.82 39.44 2dcq h ILE 123 CO 0.43 0.36 -0.02 -1.84 0.00 0.00 0.00 178.15 177.08 2dcq n GLU 124 N -4.78 -0.06 -0.24 2.37 0.28 -1.18 -4.95 120.64 112.08 2dcq n GLU 124 Ca -0.08 0.05 -0.07 0.00 -0.16 0.00 0.00 57.16 56.90 2dcq n GLU 124 Cb 0.32 -0.07 0.06 0.00 1.43 0.00 0.00 31.44 33.18 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 -2.14 -1.67 -0.05 3.44 -0.04 -1.26 -4.58 135.00 128.69 2dcq n PRO 125 Ca -0.00 -0.43 0.06 0.00 -0.04 0.00 0.00 63.50 63.09 2dcq n PRO 125 Cb 0.01 -0.41 0.08 0.00 -0.04 0.00 0.00 33.50 33.14 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 -2.40 1.93 -3.78 0.54 4.01 -1.26 -5.01 118.16 112.19 2dcq n LYS 126 Ca 0.04 -2.07 -0.10 0.00 -0.51 0.00 0.00 58.31 55.67 2dcq n LYS 126 Cb 0.15 -1.26 -0.07 0.00 -0.51 0.00 0.00 35.03 33.34 2dcq n LYS 126 CO 0.00 0.00 0.00 0.15 -1.11 0.00 0.00 177.40 176.44 2dcq s LYS 127 N -2.00 0.88 0.13 1.97 1.02 -1.26 -5.09 119.74 115.40 2dcq s LYS 127 Ca 0.18 -0.79 -0.13 0.00 0.02 0.00 0.00 55.97 55.25 2dcq s LYS 127 Cb 0.15 0.37 -0.02 0.00 -0.52 0.00 0.00 37.83 37.82 2dcq s LYS 127 CO 0.02 -0.30 1.54 1.79 -0.92 0.00 0.00 175.35 177.48 2dcq h THR 128 N 2.79 1.27 0.00 2.17 1.35 -1.95 -3.47 112.91 115.07 2dcq h THR 128 Ca -0.33 -1.19 0.00 0.00 -0.55 0.00 0.00 66.41 64.34 2dcq h THR 128 Cb 1.21 1.19 0.00 0.00 -1.73 0.00 0.00 68.15 68.83 2dcq h THR 128 CO 0.51 0.40 0.00 -1.20 -0.25 0.00 0.00 175.52 174.98 2dcq n SER 129 N -4.32 0.00 -4.21 5.36 7.64 -1.26 -4.92 113.62 111.91 2dcq n SER 129 Ca -0.01 0.00 -0.41 0.00 1.01 0.00 0.00 58.87 59.46 2dcq n SER 129 Cb 0.36 -2.08 -0.06 0.00 -1.01 0.00 0.00 64.21 61.42 2dcq n SER 129 CO 0.00 0.00 0.00 -0.83 -3.01 0.00 0.00 175.04 171.20 2dcq s GLY 130 N -2.00 2.63 0.05 0.23 0.00 -1.26 -4.94 107.32 102.03 2dcq s GLY 130 Ca 0.00 -3.35 0.12 0.00 0.00 0.00 0.00 44.72 41.49 2dcq s GLY 130 CO 0.00 1.18 1.37 -1.55 0.00 0.00 0.00 173.10 174.10 2dcq n PRO 131 N 3.60 0.03 0.00 2.90 -0.04 -1.26 -3.31 135.00 136.92 2dcq n PRO 131 Ca 0.12 0.36 0.00 0.00 -0.04 0.00 0.00 63.50 63.94 2dcq n PRO 131 Cb 0.42 -1.56 0.00 0.00 -0.04 0.00 0.00 33.50 32.31 2dcq n PRO 131 CO 0.00 0.00 0.00 -1.13 -0.04 0.00 0.00 175.50 174.33 2dcq n SER 132 N -1.62 0.00 -4.70 3.54 3.41 -1.26 -5.08 113.62 107.91 2dcq n SER 132 Ca 0.02 -1.00 -0.42 0.00 -0.26 0.00 0.00 58.87 57.21 2dcq n SER 132 Cb 0.12 0.00 -0.03 0.00 -0.26 0.00 0.00 64.21 64.04 2dcq n SER 132 CO 0.00 0.00 0.00 -0.44 -0.16 0.00 0.00 175.04 174.44 2dcq s SER 133 N 0.00 6.56 0.00 4.04 0.01 -1.21 -5.30 113.70 117.79 2dcq s SER 133 Ca 0.00 2.60 0.00 0.00 1.31 0.00 0.00 55.95 59.86 2dcq s SER 133 Cb 0.00 -2.58 0.00 0.00 0.21 0.00 0.00 66.02 63.65 2dcq s SER 133 CO 0.00 -0.88 0.00 0.61 0.41 0.00 0.00 173.24 173.38