#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 2.06 0.19 1.61 0.15 -1.26 -5.19 113.70 111.25 2dcq s SER 2 Ca 0.00 -1.70 0.02 0.00 0.70 0.00 0.00 55.95 54.97 2dcq s SER 2 Cb 0.00 0.52 -0.05 0.00 -1.71 0.00 0.00 66.02 64.79 2dcq s SER 2 CO 0.00 -0.99 0.01 -0.44 1.20 0.00 0.00 173.24 173.02 2dcq s SER 3 N -3.46 1.29 0.00 5.45 0.01 -1.26 -5.01 113.70 110.72 2dcq s SER 3 Ca 0.33 -1.21 0.00 0.00 1.31 0.00 0.00 55.95 56.38 2dcq s SER 3 Cb 0.03 0.11 0.00 0.00 0.21 0.00 0.00 66.02 66.37 2dcq s SER 3 CO 0.21 -0.58 0.00 0.61 0.41 0.00 0.00 173.24 173.89 2dcq n GLY 4 N -0.30 -3.91 3.09 3.44 0.00 -1.26 -4.79 105.19 101.46 2dcq n GLY 4 Ca -0.05 -2.10 -0.42 0.00 0.00 0.00 0.00 46.02 43.44 2dcq n GLY 4 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 2dcq n SER 5 N -0.01 4.41 -4.03 1.61 3.41 -1.26 -4.88 113.62 112.86 2dcq n SER 5 Ca 0.00 -2.89 -0.11 0.00 -0.26 0.00 0.00 58.87 55.61 2dcq n SER 5 Cb 0.00 -1.68 -0.07 0.00 -0.26 0.00 0.00 64.21 62.20 2dcq n SER 5 CO 0.00 0.00 0.00 -0.44 -0.16 0.00 0.00 175.04 174.44 2dcq s SER 6 N 3.41 0.10 0.29 4.04 0.01 -1.26 -4.39 113.70 115.89 2dcq s SER 6 Ca 0.49 -1.17 -0.20 0.00 1.31 0.00 0.00 55.95 56.37 2dcq s SER 6 Cb 0.09 0.50 0.04 0.00 0.21 0.00 0.00 66.02 66.86 2dcq s SER 6 CO -0.02 -1.02 0.79 -0.83 0.41 0.00 0.00 173.24 172.57 2dcq s GLY 7 N -3.10 0.02 1.04 3.44 0.00 -1.23 -5.01 107.32 102.49 2dcq s GLY 7 Ca 0.30 -0.37 -0.16 0.00 0.00 0.00 0.00 44.72 44.49 2dcq s GLY 7 CO 0.11 -0.00 1.19 -0.56 0.00 0.00 0.00 173.10 173.84 2dcq s SER 8 N -2.99 2.38 0.01 1.64 0.01 -1.26 -0.76 113.70 112.73 2dcq s SER 8 Ca 0.13 0.61 -0.03 0.00 1.31 0.00 0.00 55.95 57.96 2dcq s SER 8 Cb -0.05 -0.88 -0.02 0.00 0.21 0.00 0.00 66.02 65.29 2dcq s SER 8 CO 0.07 -3.22 1.05 0.00 0.41 0.00 0.00 173.24 171.56 2dcq h ALA 9 N -1.96 -0.81 -0.01 1.44 0.00 -1.79 -1.33 119.26 114.79 2dcq h ALA 9 Ca -0.46 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.43 2dcq h ALA 9 Cb 1.28 0.27 -0.00 0.00 0.00 0.00 0.00 17.79 19.34 2dcq h ALA 9 CO 0.43 -0.82 0.12 0.87 0.00 0.00 0.00 179.25 179.86 2dcq h LYS 10 N -0.10 0.00 0.00 0.00 1.79 -1.91 -1.53 116.57 114.83 2dcq h LYS 10 Ca -0.01 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.46 2dcq h LYS 10 Cb 0.08 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 30.73 2dcq h LYS 10 CO -0.00 0.00 0.00 -1.71 -1.08 0.00 0.00 179.45 176.66 2dcq n ASN 11 N -3.10 0.00 -0.06 0.86 5.15 -0.52 -1.17 115.26 116.41 2dcq n ASN 11 Ca -0.02 -0.86 -0.10 0.00 -0.60 0.00 0.00 54.58 52.99 2dcq n ASN 11 Cb 0.19 0.00 -0.05 0.00 -0.53 0.00 0.00 39.78 39.39 2dcq n ASN 11 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 2dcq n ALA 12 N -0.90 1.91 -0.31 5.20 0.00 -0.59 -4.72 120.51 121.10 2dcq n ALA 12 Ca 0.14 -0.51 0.06 0.00 0.00 0.00 0.00 53.44 53.13 2dcq n ALA 12 Cb 0.06 0.27 0.27 0.00 0.00 0.00 0.00 19.45 20.05 2dcq n ALA 12 CO 0.00 0.00 0.00 -0.92 0.00 0.00 0.00 177.50 176.58 2dcq h TYR 13 N -0.17 1.03 -0.87 0.00 5.03 -1.42 -1.94 116.97 118.63 2dcq h TYR 13 Ca -0.29 0.03 -0.01 0.00 2.58 0.00 0.00 58.73 61.04 2dcq h TYR 13 Cb 1.36 -0.33 -0.04 0.00 1.55 0.00 0.00 36.73 39.27 2dcq h TYR 13 CO -0.01 0.47 0.52 1.15 -1.32 0.00 0.00 178.16 178.97 2dcq h THR 14 N 0.95 1.24 -0.00 1.81 2.02 -1.44 -1.78 112.91 115.71 2dcq h THR 14 Ca 0.43 -0.54 0.00 0.00 0.77 0.00 0.00 66.41 67.07 2dcq h THR 14 Cb 0.39 0.02 0.00 0.00 -1.74 0.00 0.00 68.15 66.82 2dcq h THR 14 CO -0.19 0.26 -0.02 0.29 0.37 0.00 0.00 175.52 176.22 2dcq n LYS 15 N -4.36 0.46 0.07 6.66 4.76 -0.76 -2.17 118.16 122.82 2dcq n LYS 15 Ca 0.10 -0.04 -0.09 0.00 -2.87 0.00 0.00 58.31 55.41 2dcq n LYS 15 Cb 0.07 -1.50 -0.06 0.00 -1.84 0.00 0.00 35.03 31.70 2dcq n LYS 15 CO 0.00 0.00 0.00 -0.07 -1.37 0.00 0.00 177.40 175.96 2dcq h LEU 16 N 0.09 -0.22 -0.94 -0.35 3.38 -1.02 -3.40 115.31 112.84 2dcq h LEU 16 Ca 0.00 -0.24 0.00 0.00 0.09 0.00 0.00 57.88 57.73 2dcq h LEU 16 Cb 0.30 0.06 0.00 0.00 0.09 0.00 0.00 40.66 41.11 2dcq h LEU 16 CO 0.00 0.32 0.00 0.61 0.09 0.00 0.00 178.44 179.46 2dcq n GLY 17 N 0.76 0.95 0.00 0.83 0.00 -0.86 -2.51 105.19 104.37 2dcq n GLY 17 Ca -0.07 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.95 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 0.11 0.00 -3.94 2.61 -2.24 -1.20 -5.06 114.28 104.56 2dcq n THR 18 Ca 0.00 -0.18 -0.09 0.00 -2.27 0.00 0.00 64.05 61.51 2dcq n THR 18 Cb 0.16 1.53 -0.08 0.00 -2.10 0.00 0.00 70.33 69.84 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 -0.06 0.18 -0.06 3.42 1.01 -1.04 -5.06 116.67 115.06 2dcq s ASP 19 Ca 0.00 -0.81 0.13 0.00 0.71 0.00 0.00 52.55 52.58 2dcq s ASP 19 Cb 0.00 0.33 -0.19 0.00 1.01 0.00 0.00 42.92 44.08 2dcq s ASP 19 CO 0.00 -0.75 0.20 -0.67 0.21 0.00 0.00 175.17 174.17 2dcq n ASP 20 N -0.07 1.92 0.11 0.27 2.03 -1.26 -4.49 116.55 115.06 2dcq n ASP 20 Ca -0.12 0.00 0.13 0.00 0.52 0.00 0.00 54.79 55.32 2dcq n ASP 20 Cb 0.62 1.32 0.43 0.00 -0.72 0.00 0.00 41.12 42.77 2dcq n ASP 20 CO 0.00 0.00 0.00 0.59 -1.92 0.00 0.00 177.20 175.87 2dcq n ASN 21 N -2.15 0.77 -4.67 1.67 3.02 -1.26 -4.88 115.26 107.76 2dcq n ASN 21 Ca -0.09 0.59 -0.30 0.00 -0.03 0.00 0.00 54.58 54.76 2dcq n ASN 21 Cb 0.56 -0.79 0.16 0.00 -0.61 0.00 0.00 39.78 39.10 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 -3.14 1.19 0.31 5.41 0.00 -1.26 -0.72 121.76 123.54 2dcq s ALA 22 Ca 0.09 0.06 -0.12 0.00 0.00 0.00 0.00 51.96 51.99 2dcq s ALA 22 Cb 0.12 -3.25 0.01 0.00 0.00 0.00 0.00 23.12 20.00 2dcq s ALA 22 CO 0.55 -2.67 0.57 -0.65 0.00 0.00 0.00 175.76 173.56 2dcq s GLN 23 N -4.80 1.82 -0.04 0.00 -1.52 0.39 -4.71 119.66 110.80 2dcq s GLN 23 Ca 0.65 -1.39 0.01 0.00 -1.95 0.00 0.00 55.36 52.67 2dcq s GLN 23 Cb -0.20 0.51 0.02 0.00 -0.22 0.00 0.00 33.01 33.13 2dcq s GLN 23 CO 0.58 -0.79 -0.04 -1.17 -0.25 0.00 0.00 175.29 173.63 2dcq s LEU 24 N -3.08 1.28 -0.52 2.90 1.98 -1.26 -1.30 118.68 118.68 2dcq s LEU 24 Ca 0.22 -0.11 0.03 0.00 -2.89 0.00 0.00 54.13 51.37 2dcq s LEU 24 Cb -0.02 -0.42 0.13 0.00 0.66 0.00 0.00 46.19 46.54 2dcq s LEU 24 CO 0.12 -0.07 0.27 -0.22 -1.89 0.00 0.00 176.35 174.57 2dcq s LEU 25 N 0.97 4.51 -0.63 -0.68 1.98 -0.47 -1.27 118.68 123.09 2dcq s LEU 25 Ca -0.10 -2.91 -0.26 0.00 -2.89 0.00 0.00 54.13 47.96 2dcq s LEU 25 Cb -0.14 -1.68 -0.03 0.00 0.66 0.00 0.00 46.19 45.00 2dcq s LEU 25 CO -0.00 -0.27 1.93 1.51 -1.89 0.00 0.00 176.35 177.63 2dcq s ASP 26 N -0.02 5.15 0.00 3.68 -4.77 -1.10 -0.67 116.67 118.94 2dcq s ASP 26 Ca 0.16 0.29 0.18 0.00 -3.30 0.00 0.00 52.55 49.89 2dcq s ASP 26 Cb -0.24 -2.53 0.54 0.00 -1.09 0.00 0.00 42.92 39.59 2dcq s ASP 26 CO -0.01 -2.49 1.42 2.30 0.70 0.00 0.00 175.17 177.09 2dcq n ILE 27 N 7.38 0.43 -0.90 2.11 -5.35 -0.08 -1.45 119.36 121.51 2dcq n ILE 27 Ca 0.24 -0.52 -0.30 0.00 -0.27 0.00 0.00 62.75 61.90 2dcq n ILE 27 Cb 0.52 0.43 0.16 0.00 -1.74 0.00 0.00 39.64 39.00 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 -1.57 0.97 0.67 6.28 0.52 -1.25 -3.02 118.95 121.56 2dcq s ARG 28 Ca 0.32 1.19 -0.17 0.00 -0.52 0.00 0.00 55.73 56.55 2dcq s ARG 28 Cb 0.17 -1.75 -0.01 0.00 0.52 0.00 0.00 34.95 33.89 2dcq s ARG 28 CO 0.24 -2.54 1.11 0.00 0.02 0.00 0.00 175.30 174.13 2dcq n ALA 29 N -4.14 0.43 -0.31 2.13 0.00 -1.26 -3.76 120.51 113.61 2dcq n ALA 29 Ca 0.09 -0.08 0.07 0.00 0.00 0.00 0.00 53.44 53.52 2dcq n ALA 29 Cb 0.53 -2.21 0.28 0.00 0.00 0.00 0.00 19.45 18.06 2dcq n ALA 29 CO 0.00 0.00 0.00 1.15 0.00 0.00 0.00 177.50 178.65 2dcq h THR 30 N 0.18 0.96 0.00 0.00 2.02 -1.97 -0.50 112.91 113.61 2dcq h THR 30 Ca -0.49 -0.32 0.00 0.00 0.77 0.00 0.00 66.41 66.37 2dcq h THR 30 Cb 1.34 -0.04 0.00 0.00 -1.74 0.00 0.00 68.15 67.71 2dcq h THR 30 CO 0.50 0.17 -0.05 0.00 0.37 0.00 0.00 175.52 176.51 2dcq h ALA 31 N 1.55 0.97 -0.16 6.16 0.00 -2.01 -3.02 119.26 122.75 2dcq h ALA 31 Ca 0.44 0.00 0.04 0.00 0.00 0.00 0.00 54.91 55.39 2dcq h ALA 31 Cb 0.42 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 18.21 2dcq h ALA 31 CO -0.20 0.00 0.11 0.22 0.00 0.00 0.00 179.25 179.39 2dcq h ASP 32 N 0.00 0.02 0.02 0.00 3.58 -1.43 0.90 116.42 119.51 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 0.90 -0.00 0.00 0.00 1.72 0.00 0.00 39.33 41.94 2dcq h ASP 32 CO 0.00 0.01 0.00 0.49 -2.88 0.00 0.00 179.24 176.86 2dcq n PHE 33 N -4.50 0.00 0.00 0.28 3.72 -1.14 -0.95 117.46 114.87 2dcq n PHE 33 Ca 0.01 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.41 2dcq n PHE 33 Cb 0.23 -0.01 0.00 0.00 -0.94 0.00 0.00 39.48 38.75 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 -1.01 0.00 0.03 -1.08 1.74 0.16 -3.96 116.66 112.55 2dcq n ARG 34 Ca 0.15 0.00 0.03 0.00 -0.77 0.00 0.00 57.85 57.27 2dcq n ARG 34 Cb 0.07 -0.88 -0.08 0.00 -1.02 0.00 0.00 32.46 30.55 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 -2.61 0.63 -0.06 5.56 10.64 -0.33 -4.48 117.38 126.72 2dcq n GLN 35 Ca 0.00 0.13 -0.09 0.00 -1.83 0.00 0.00 57.00 55.20 2dcq n GLN 35 Cb 0.50 -1.76 -0.06 0.00 -0.86 0.00 0.00 30.24 28.07 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 -2.75 0.71 0.00 -0.39 0.31 -0.14 -4.77 118.33 111.30 2dcq n VAL 36 Ca -0.08 -0.25 0.00 0.00 -0.01 0.00 0.00 64.34 63.99 2dcq n VAL 36 Cb 0.76 -1.06 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 2.79 -1.21 3.13 2.92 0.00 -0.13 -4.62 105.19 108.08 2dcq n GLY 37 Ca -0.22 -2.11 -0.13 0.00 0.00 0.00 0.00 46.02 43.55 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 1.19 0.01 1.61 0.01 -1.26 -3.92 113.70 107.33 2dcq s SER 38 Ca 0.00 -0.75 -0.30 0.00 1.31 0.00 0.00 55.95 56.21 2dcq s SER 38 Cb 0.00 0.03 -0.06 0.00 0.21 0.00 0.00 66.02 66.21 2dcq s SER 38 CO 0.00 -0.27 1.45 -2.16 0.41 0.00 0.00 173.24 172.66 2dcq s PRO 39 N -2.53 4.26 -0.33 12.44 0.04 -1.26 0.10 135.00 147.73 2dcq s PRO 39 Ca 0.01 2.02 -0.22 0.00 0.04 0.00 0.00 61.00 62.85 2dcq s PRO 39 Cb -0.04 -3.60 0.00 0.00 0.04 0.00 0.00 34.50 30.91 2dcq s PRO 39 CO -0.01 -0.61 0.73 1.21 0.04 0.00 0.00 177.00 178.36 2dcq s ASN 40 N 2.02 6.55 0.00 6.66 3.84 -1.00 -4.63 114.94 128.37 2dcq s ASN 40 Ca 0.65 0.42 0.00 0.00 0.21 0.00 0.00 52.86 54.15 2dcq s ASN 40 Cb -0.33 -2.37 0.00 0.00 -0.55 0.00 0.00 41.25 38.00 2dcq s ASN 40 CO 0.27 -0.62 0.18 2.30 -2.79 0.00 0.00 177.10 176.44 2dcq n ILE 41 N 5.60 0.00 0.19 -5.21 -5.35 -1.26 -4.63 119.36 108.69 2dcq n ILE 41 Ca 0.02 0.00 0.04 0.00 -0.27 0.00 0.00 62.75 62.54 2dcq n ILE 41 Cb 0.48 1.34 0.44 0.00 -1.74 0.00 0.00 39.64 40.17 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 0.00 0.07 0.00 6.28 3.11 -1.84 -0.87 116.57 123.31 2dcq h LYS 42 Ca 0.00 -0.02 0.00 0.00 -2.81 0.00 0.00 60.65 57.82 2dcq h LYS 42 Cb 0.71 -0.01 0.00 0.00 -1.00 0.00 0.00 32.23 31.93 2dcq h LYS 42 CO 0.00 0.27 -0.26 0.41 -2.81 0.00 0.00 179.45 177.06 2dcq n GLY 43 N -0.88 -1.38 0.22 5.01 0.00 -1.26 -2.46 105.19 104.45 2dcq n GLY 43 Ca -0.02 -0.23 0.11 0.00 0.00 0.00 0.00 46.02 45.88 2dcq n GLY 43 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 2dcq h LEU 44 N 0.00 0.00 0.00 0.99 3.38 -1.54 -3.47 115.31 114.68 2dcq h LEU 44 Ca 0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 2dcq h LEU 44 Cb 0.51 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.26 2dcq h LEU 44 CO 0.00 0.13 0.00 0.61 0.09 0.00 0.00 178.44 179.27 2dcq n GLY 45 N 0.81 -0.24 3.61 0.83 0.00 -1.13 -4.79 105.19 104.26 2dcq n GLY 45 Ca 0.02 0.21 -0.03 0.00 0.00 0.00 0.00 46.02 46.22 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 0.54 0.29 1.61 0.00 -1.03 -4.95 119.74 116.19 2dcq s LYS 46 Ca 0.00 -0.25 -0.15 0.00 0.00 0.00 0.00 55.97 55.58 2dcq s LYS 46 Cb 0.00 0.22 -0.08 0.00 0.00 0.00 0.00 37.83 37.96 2dcq s LYS 46 CO 0.00 -0.24 0.69 0.21 0.00 0.00 0.00 175.35 176.01 2dcq s LYS 47 N -2.66 4.00 1.11 1.78 2.36 -1.26 -2.80 119.74 122.26 2dcq s LYS 47 Ca 0.10 0.62 -0.12 0.00 -2.55 0.00 0.00 55.97 54.02 2dcq s LYS 47 Cb 0.01 -2.54 0.25 0.00 -1.05 0.00 0.00 37.83 34.49 2dcq s LYS 47 CO -0.04 0.23 1.05 0.00 1.55 0.00 0.00 175.35 178.14 2dcq s ALA 48 N -1.88 -0.02 -0.35 3.13 0.00 -1.26 -4.81 121.76 116.56 2dcq s ALA 48 Ca 0.51 -0.05 0.01 0.00 0.00 0.00 0.00 51.96 52.43 2dcq s ALA 48 Cb -0.11 -3.26 0.10 0.00 0.00 0.00 0.00 23.12 19.84 2dcq s ALA 48 CO 0.19 -3.57 0.08 0.08 0.00 0.00 0.00 175.76 172.54 2dcq s VAL 49 N -2.55 2.66 -0.25 0.00 1.01 -0.40 -4.98 120.40 115.89 2dcq s VAL 49 Ca 0.68 -2.10 -0.29 0.00 0.00 0.00 0.00 61.98 60.26 2dcq s VAL 49 Cb -0.24 -2.84 -0.03 0.00 0.00 0.00 0.00 36.38 33.27 2dcq s VAL 49 CO 0.63 -0.54 1.74 -0.94 0.00 0.00 0.00 175.10 175.99 2dcq s SER 50 N 1.25 6.14 -0.30 3.32 1.04 -1.26 -2.71 113.70 121.17 2dcq s SER 50 Ca 0.07 1.57 0.01 0.00 0.48 0.00 0.00 55.95 58.07 2dcq s SER 50 Cb -0.20 -2.53 0.14 0.00 0.10 0.00 0.00 66.02 63.53 2dcq s SER 50 CO -0.06 -1.47 0.33 -0.89 0.98 0.00 0.00 173.24 172.14 2dcq s THR 51 N 6.01 -0.46 0.02 2.02 2.01 -0.53 -4.99 115.64 119.72 2dcq s THR 51 Ca 0.77 -0.49 -0.34 0.00 0.31 0.00 0.00 61.69 61.94 2dcq s THR 51 Cb -0.25 -0.95 -0.13 0.00 0.01 0.00 0.00 72.50 71.18 2dcq s THR 51 CO 0.32 -0.43 1.72 0.55 -0.69 0.00 0.00 174.62 176.08 2dcq n VAL 52 N 5.20 0.29 -2.58 3.82 3.14 -1.25 -4.06 118.33 122.89 2dcq n VAL 52 Ca 0.00 -0.05 -0.34 0.00 -2.96 0.00 0.00 64.34 60.99 2dcq n VAL 52 Cb 0.47 -1.65 -0.04 0.00 -1.06 0.00 0.00 33.84 31.56 2dcq n VAL 52 CO 0.00 0.00 0.00 -0.47 -6.46 0.00 0.00 176.83 169.90 2dcq s TYR 53 N 2.51 3.08 -0.06 1.45 5.04 -1.17 -4.99 117.35 123.20 2dcq s TYR 53 Ca 0.87 1.59 -0.03 0.00 -2.44 0.00 0.00 57.07 57.05 2dcq s TYR 53 Cb -0.71 -3.05 0.03 0.00 0.35 0.00 0.00 41.96 38.58 2dcq s TYR 53 CO 0.46 -0.71 0.14 -0.80 -1.34 0.00 0.00 175.55 173.30 2dcq s ASN 54 N -1.94 -0.11 0.00 4.32 0.01 -1.26 -5.05 114.94 110.91 2dcq s ASN 54 Ca 0.65 0.28 0.27 0.00 -0.71 0.00 0.00 52.86 53.36 2dcq s ASN 54 Cb -0.16 0.20 0.92 0.00 0.41 0.00 0.00 41.25 42.62 2dcq s ASN 54 CO 0.20 -0.12 1.70 0.61 -1.51 0.00 0.00 177.10 177.98 2dcq n GLY 55 N 3.87 -1.36 0.24 0.66 0.00 -1.26 -3.94 105.19 103.39 2dcq n GLY 55 Ca -0.22 -0.22 -0.09 0.00 0.00 0.00 0.00 46.02 45.49 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 0.03 0.80 -2.14 1.61 4.81 -2.04 -3.35 114.58 114.30 2dcq h GLU 56 Ca 0.00 -0.19 -0.58 0.00 -0.13 0.00 0.00 59.36 58.46 2dcq h GLU 56 Cb 0.49 -0.10 -0.40 0.00 0.63 0.00 0.00 28.75 29.37 2dcq h GLU 56 CO 0.00 0.77 -0.87 -0.40 -0.73 0.00 0.00 179.01 177.78 2dcq n ASP 57 N -4.46 1.70 -0.36 1.04 5.75 -1.25 -4.97 116.55 114.00 2dcq n ASP 57 Ca 0.01 -3.00 -0.06 0.00 -0.01 0.00 0.00 54.79 51.73 2dcq n ASP 57 Cb 0.22 -0.65 -0.04 0.00 -1.03 0.00 0.00 41.12 39.63 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 1.27 -0.31 0.02 0.11 4.76 -1.26 -1.25 118.16 121.51 2dcq n LYS 58 Ca 0.25 1.36 -0.12 0.00 -2.87 0.00 0.00 58.31 56.93 2dcq n LYS 58 Cb 0.47 -2.01 -0.07 0.00 -1.84 0.00 0.00 35.03 31.58 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 0.03 0.00 1.97 0.13 -1.93 -1.97 132.00 130.24 2dcq h PRO 59 Ca 0.22 -0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.34 2dcq h PRO 59 Cb 0.44 -0.01 0.00 0.00 0.13 0.00 0.00 31.00 31.56 2dcq h PRO 59 CO -0.86 0.09 0.00 0.41 -0.23 0.00 0.00 178.00 177.41 2dcq n GLY 60 N -0.91 -0.22 0.45 1.56 0.00 -0.38 -1.84 105.19 103.85 2dcq n GLY 60 Ca -0.07 -0.03 -0.19 0.00 0.00 0.00 0.00 46.02 45.74 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 -1.09 0.00 0.20 1.61 7.35 -0.45 -4.65 117.46 120.43 2dcq n PHE 61 Ca 0.03 0.00 0.18 0.00 -0.76 0.00 0.00 57.45 56.90 2dcq n PHE 61 Cb 0.02 -0.64 0.81 0.00 0.35 0.00 0.00 39.48 40.02 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 -0.64 0.00 -1.79 -2.13 3.38 -0.59 -1.90 115.31 111.64 2dcq h LEU 62 Ca -0.45 0.00 0.09 0.00 0.09 0.00 0.00 57.88 57.61 2dcq h LEU 62 Cb 1.39 0.00 -0.03 0.00 0.09 0.00 0.00 40.66 42.11 2dcq h LEU 62 CO -0.27 0.00 0.32 0.07 0.09 0.00 0.00 178.44 178.65 2dcq h LYS 63 N 0.00 0.24 -0.04 1.13 5.09 -1.66 -1.86 116.57 119.47 2dcq h LYS 63 Ca 0.10 -0.01 -0.13 0.00 0.09 0.00 0.00 60.65 60.70 2dcq h LYS 63 Cb 0.76 -0.05 -0.01 0.00 0.10 0.00 0.00 32.23 33.02 2dcq h LYS 63 CO -0.00 0.16 -0.59 0.87 -2.09 0.00 0.00 179.45 177.80 2dcq h LYS 64 N 0.25 0.12 0.00 0.07 1.57 -1.66 -1.40 116.57 115.52 2dcq h LYS 64 Ca 0.22 -0.08 0.00 0.00 -1.87 0.00 0.00 60.65 58.91 2dcq h LYS 64 Cb 0.53 0.01 0.00 0.00 0.08 0.00 0.00 32.23 32.85 2dcq h LYS 64 CO -0.04 0.68 0.00 1.28 -0.57 0.00 0.00 179.45 180.79 2dcq n LEU 65 N -3.86 0.00 -0.90 2.94 4.32 -0.70 -1.90 117.00 116.89 2dcq n LEU 65 Ca -0.02 0.27 0.10 0.00 -0.02 0.00 0.00 56.01 56.34 2dcq n LEU 65 Cb 0.60 -0.27 0.27 0.00 -1.62 0.00 0.00 43.42 42.40 2dcq n LEU 65 CO 0.43 -0.11 0.72 -0.24 -1.22 0.00 0.00 177.39 176.97 2dcq n SER 66 N -1.27 2.65 -0.02 -1.43 2.88 -0.53 -4.25 113.62 111.66 2dcq n SER 66 Ca 0.09 -1.92 0.00 0.00 -1.33 0.00 0.00 58.87 55.71 2dcq n SER 66 Cb 0.14 -0.25 0.00 0.00 -0.75 0.00 0.00 64.21 63.34 2dcq n SER 66 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 2dcq n LEU 67 N 0.95 0.27 0.00 2.46 -0.00 -0.80 -4.91 117.00 114.97 2dcq n LEU 67 Ca 0.18 -0.31 0.00 0.00 -0.00 0.00 0.00 56.01 55.88 2dcq n LEU 67 Cb 0.45 -0.00 0.00 0.00 -0.00 0.00 0.00 43.42 43.87 2dcq n LEU 67 CO 0.13 0.08 0.07 0.29 -0.00 0.00 0.00 177.39 177.96 2dcq n LYS 68 N -0.07 2.01 -4.53 1.47 4.01 -1.20 -5.08 118.16 114.77 2dcq n LYS 68 Ca 0.00 -0.14 -0.25 0.00 -0.51 0.00 0.00 58.31 57.41 2dcq n LYS 68 Cb 0.47 -0.54 -0.11 0.00 -0.51 0.00 0.00 35.03 34.35 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 -0.33 2.21 -0.09 2.13 0.40 -1.26 -5.05 117.98 115.99 2dcq s PHE 69 Ca 0.00 -0.84 0.00 0.00 -0.60 0.00 0.00 56.93 55.49 2dcq s PHE 69 Cb 0.00 -1.51 -0.06 0.00 0.51 0.00 0.00 43.02 41.96 2dcq s PHE 69 CO 0.00 0.20 -0.08 1.17 0.70 0.00 0.00 175.22 177.21 2dcq n LYS 70 N -0.83 0.22 -3.16 0.44 0.00 -1.26 -4.91 118.16 108.66 2dcq n LYS 70 Ca -0.04 0.06 -0.22 0.00 0.00 0.00 0.00 58.31 58.10 2dcq n LYS 70 Cb 0.67 -1.15 -0.05 0.00 0.00 0.00 0.00 35.03 34.50 2dcq n LYS 70 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.40 173.93 2dcq n ASP 71 N -2.83 1.85 0.03 3.14 2.03 -1.26 -4.95 116.55 114.56 2dcq n ASP 71 Ca -0.16 -3.14 -0.02 0.00 0.52 0.00 0.00 54.79 51.99 2dcq n ASP 71 Cb 0.67 -0.62 0.25 0.00 -0.72 0.00 0.00 41.12 40.70 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 3.37 0.44 0.00 -0.67 0.13 -1.91 -1.04 132.00 132.31 2dcq h PRO 72 Ca 0.11 -0.14 0.00 0.00 -0.87 0.00 0.00 66.00 65.10 2dcq h PRO 72 Cb 0.81 -0.04 0.00 0.00 0.13 0.00 0.00 31.00 31.90 2dcq h PRO 72 CO 0.60 0.61 0.00 -0.85 -0.23 0.00 0.00 178.00 178.14 2dcq n GLU 73 N -4.17 0.26 0.00 0.86 0.28 -1.23 -2.37 120.64 114.26 2dcq n GLU 73 Ca -0.00 0.04 0.00 0.00 -0.16 0.00 0.00 57.16 57.04 2dcq n GLU 73 Cb 0.36 -1.50 0.00 0.00 1.43 0.00 0.00 31.44 31.73 2dcq n GLU 73 CO 0.00 0.00 0.00 0.09 -0.16 0.00 0.00 177.13 177.06 2dcq n ASN 74 N -1.06 0.03 -4.63 -1.84 3.02 -0.89 -4.38 115.26 105.51 2dcq n ASN 74 Ca 0.06 -0.22 -0.43 0.00 -0.03 0.00 0.00 54.58 53.96 2dcq n ASN 74 Cb 0.04 0.19 -0.02 0.00 -0.61 0.00 0.00 39.78 39.37 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 -0.19 4.24 -0.72 3.41 2.01 -0.44 -4.88 115.64 119.08 2dcq s THR 75 Ca 0.00 1.41 -0.27 0.00 0.31 0.00 0.00 61.69 63.14 2dcq s THR 75 Cb 0.00 -4.24 0.02 0.00 0.01 0.00 0.00 72.50 68.30 2dcq s THR 75 CO 0.00 -0.49 1.36 -0.89 -0.69 0.00 0.00 174.62 173.91 2dcq s THR 76 N 4.16 3.68 0.54 -0.82 2.01 0.10 -4.59 115.64 120.72 2dcq s THR 76 Ca 0.53 0.40 -0.15 0.00 0.31 0.00 0.00 61.69 62.78 2dcq s THR 76 Cb -0.15 -4.78 -0.07 0.00 0.01 0.00 0.00 72.50 67.51 2dcq s THR 76 CO 0.21 -1.71 0.99 -0.22 -0.69 0.00 0.00 174.62 173.21 2dcq s LEU 77 N 6.17 3.51 -0.30 4.42 0.20 -1.09 -0.46 118.68 131.12 2dcq s LEU 77 Ca 0.40 1.52 -0.01 0.00 0.69 0.00 0.00 54.13 56.72 2dcq s LEU 77 Cb -0.09 -4.49 0.10 0.00 -0.43 0.00 0.00 46.19 41.28 2dcq s LEU 77 CO 0.16 -0.67 0.10 -0.31 -0.29 0.00 0.00 176.35 175.34 2dcq s TYR 78 N -2.79 1.46 0.46 5.38 1.51 -0.42 -0.41 117.35 122.54 2dcq s TYR 78 Ca 0.58 -1.55 -0.24 0.00 -1.01 0.00 0.00 57.07 54.84 2dcq s TYR 78 Cb -0.10 -1.55 -0.07 0.00 -0.11 0.00 0.00 41.96 40.13 2dcq s TYR 78 CO 0.38 -0.85 1.29 0.42 -1.11 0.00 0.00 175.55 175.68 2dcq s ILE 79 N 1.70 2.56 -0.12 2.71 1.09 0.10 -1.37 121.20 127.86 2dcq s ILE 79 Ca 0.09 0.46 -0.02 0.00 -1.10 0.00 0.00 60.65 60.07 2dcq s ILE 79 Cb -0.17 -3.25 0.04 0.00 -1.06 0.00 0.00 42.46 38.02 2dcq s ILE 79 CO -0.26 0.03 0.03 -0.22 -0.10 0.00 0.00 174.94 174.42 2dcq s LEU 80 N -2.87 0.75 0.00 2.97 0.20 0.15 -3.46 118.68 116.43 2dcq s LEU 80 Ca 0.62 -0.40 0.00 0.00 0.69 0.00 0.00 54.13 55.04 2dcq s LEU 80 Cb -0.37 -0.46 0.00 0.00 -0.43 0.00 0.00 46.19 44.93 2dcq s LEU 80 CO 0.46 -0.25 0.00 -0.90 -0.29 0.00 0.00 176.35 175.36 2dcq n ASP 81 N 5.13 0.63 -0.12 3.68 5.75 -1.26 -0.90 116.55 129.47 2dcq n ASP 81 Ca -0.08 -0.28 -0.20 0.00 -0.01 0.00 0.00 54.79 54.22 2dcq n ASP 81 Cb 0.49 0.00 -0.07 0.00 -1.03 0.00 0.00 41.12 40.51 2dcq n ASP 81 CO 0.00 0.00 0.00 2.29 -0.11 0.00 0.00 177.20 179.38 2dcq n LYS 82 N -0.19 0.56 0.02 0.11 2.85 -1.26 -1.37 118.16 118.88 2dcq n LYS 82 Ca 0.00 0.26 0.00 0.00 -1.05 0.00 0.00 58.31 57.52 2dcq n LYS 82 Cb 0.00 -1.48 0.00 0.00 -0.65 0.00 0.00 35.03 32.90 2dcq n LYS 82 CO 0.00 0.00 0.00 0.34 -0.05 0.00 0.00 177.40 177.69 2dcq n PHE 83 N -4.35 -0.24 0.00 5.58 7.35 -1.26 -0.29 117.46 124.24 2dcq n PHE 83 Ca -0.36 0.04 0.00 0.00 -0.76 0.00 0.00 57.45 56.37 2dcq n PHE 83 Cb 0.72 0.19 0.00 0.00 0.35 0.00 0.00 39.48 40.73 2dcq n PHE 83 CO 0.00 0.00 0.00 -0.25 -0.76 0.00 0.00 176.76 175.75 2dcq n ASP 84 N -2.99 0.00 0.00 -2.13 8.00 -1.26 -3.91 116.55 114.25 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 0.24 0.18 0.00 0.00 -0.02 0.00 0.00 41.12 41.52 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 -0.70 0.41 0.72 0.44 0.00 -1.26 -2.02 105.19 102.78 2dcq n GLY 85 Ca 0.00 0.58 -0.04 0.00 0.00 0.00 0.00 46.02 46.56 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 3.88 -0.51 -0.13 1.61 4.13 -1.26 -5.04 115.26 117.95 2dcq n ASN 86 Ca 0.00 -1.34 -0.05 0.00 1.68 0.00 0.00 54.58 54.87 2dcq n ASN 86 Cb 0.00 0.15 0.04 0.00 -1.54 0.00 0.00 39.78 38.43 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 0.00 0.11 0.22 6.41 4.64 -1.78 -0.62 113.55 122.53 2dcq h SER 87 Ca -0.29 0.05 -0.04 0.00 -0.47 0.00 0.00 61.79 61.04 2dcq h SER 87 Cb 1.09 0.05 -0.01 0.00 -0.31 0.00 0.00 62.40 63.22 2dcq h SER 87 CO -0.15 0.10 -0.21 -0.33 -0.87 0.00 0.00 176.83 175.38 2dcq h GLU 88 N 0.28 0.00 0.22 4.77 5.08 -1.91 -1.65 114.58 121.38 2dcq h GLU 88 Ca 0.20 0.00 -0.01 0.00 -1.00 0.00 0.00 59.36 58.55 2dcq h GLU 88 Cb 0.20 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.45 2dcq h GLU 88 CO -0.22 0.21 -0.11 1.25 -1.00 0.00 0.00 179.01 179.14 2dcq h LEU 89 N 0.00 -0.25 -1.92 1.33 5.85 -1.70 -3.26 115.31 115.36 2dcq h LEU 89 Ca -0.00 -0.27 -0.02 0.00 0.84 0.00 0.00 57.88 58.42 2dcq h LEU 89 Cb 0.37 0.06 -0.00 0.00 0.37 0.00 0.00 40.66 41.46 2dcq h LEU 89 CO 0.03 0.20 -0.11 0.58 -0.34 0.00 0.00 178.44 178.80 2dcq h VAL 90 N -0.78 0.81 0.00 1.05 2.07 -0.94 -0.98 116.25 117.49 2dcq h VAL 90 Ca -0.03 -0.42 0.00 0.00 0.82 0.00 0.00 66.70 67.06 2dcq h VAL 90 Cb 0.51 1.25 0.00 0.00 -1.52 0.00 0.00 31.29 31.53 2dcq h VAL 90 CO 0.05 0.11 0.00 0.00 0.02 0.00 0.00 177.57 177.75 2dcq n ALA 91 N -2.39 1.34 -2.61 1.67 0.00 -0.64 -2.45 120.51 115.44 2dcq n ALA 91 Ca -0.02 -0.03 -0.11 0.00 0.00 0.00 0.00 53.44 53.28 2dcq n ALA 91 Cb 0.20 -1.11 0.03 0.00 0.00 0.00 0.00 19.45 18.56 2dcq n ALA 91 CO 0.00 0.00 0.00 -0.85 0.00 0.00 0.00 177.50 176.65 2dcq n GLU 92 N -1.48 1.99 0.04 0.00 0.28 -0.37 -4.26 120.64 116.83 2dcq n GLU 92 Ca 0.02 -3.65 0.00 0.00 -0.16 0.00 0.00 57.16 53.37 2dcq n GLU 92 Cb 0.08 -1.64 0.00 0.00 1.43 0.00 0.00 31.44 31.31 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 -0.36 0.21 -0.30 -1.84 7.94 -1.02 -4.86 117.00 116.76 2dcq n LEU 93 Ca 0.18 0.12 -0.03 0.00 -1.11 0.00 0.00 56.01 55.17 2dcq n LEU 93 Cb 0.80 0.00 0.13 0.00 0.53 0.00 0.00 43.42 44.89 2dcq n LEU 93 CO 0.24 -0.44 1.18 -0.37 -1.11 0.00 0.00 177.39 176.89 2dcq h VAL 94 N 0.00 1.25 0.00 1.96 -1.51 -1.87 -2.08 116.25 113.99 2dcq h VAL 94 Ca 0.00 -0.59 0.00 0.00 -1.23 0.00 0.00 66.70 64.88 2dcq h VAL 94 Cb 0.34 0.08 0.00 0.00 -2.13 0.00 0.00 31.29 29.58 2dcq h VAL 94 CO 0.00 0.27 0.00 0.00 -1.23 0.00 0.00 177.57 176.61 2dcq n ALA 95 N -2.41 1.60 -1.28 5.19 0.00 -1.26 -1.74 120.51 120.61 2dcq n ALA 95 Ca 0.09 -0.04 0.08 0.00 0.00 0.00 0.00 53.44 53.57 2dcq n ALA 95 Cb 0.09 -1.15 0.13 0.00 0.00 0.00 0.00 19.45 18.52 2dcq n ALA 95 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 2dcq n LEU 96 N -1.29 2.12 0.00 0.00 4.32 -0.79 -4.58 117.00 116.78 2dcq n LEU 96 Ca 0.04 -2.96 0.00 0.00 -0.02 0.00 0.00 56.01 53.07 2dcq n LEU 96 Cb 0.08 -0.39 0.00 0.00 -1.62 0.00 0.00 43.42 41.49 2dcq n LEU 96 CO 0.07 0.76 0.00 0.59 -1.22 0.00 0.00 177.39 177.59 2dcq n ASN 97 N -1.19 0.00 0.00 -1.43 3.02 -0.86 -5.03 115.26 109.77 2dcq n ASN 97 Ca 0.14 0.00 0.00 0.00 -0.03 0.00 0.00 54.58 54.69 2dcq n ASN 97 Cb 0.67 0.03 0.00 0.00 -0.61 0.00 0.00 39.78 39.87 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 1.04 0.55 3.68 7.41 0.00 -0.72 -5.11 105.19 112.05 2dcq n GLY 98 Ca 0.00 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.74 2dcq n GLY 98 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 2dcq s PHE 99 N 0.00 2.38 -0.11 1.61 0.40 -0.71 -3.57 117.98 117.99 2dcq s PHE 99 Ca 0.00 -0.71 -0.07 0.00 -0.60 0.00 0.00 56.93 55.55 2dcq s PHE 99 Cb 0.00 -1.79 -0.02 0.00 0.51 0.00 0.00 43.02 41.72 2dcq s PHE 99 CO 0.00 0.33 -0.13 -0.22 0.70 0.00 0.00 175.22 175.90 2dcq h LYS 100 N 1.59 0.00 -3.34 0.44 1.63 -1.75 -3.38 116.57 111.75 2dcq h LYS 100 Ca -0.44 0.00 -0.15 0.00 -0.85 0.00 0.00 60.65 59.21 2dcq h LYS 100 Cb 1.26 0.00 -0.23 0.00 -0.60 0.00 0.00 32.23 32.66 2dcq h LYS 100 CO 0.77 0.00 -0.46 -1.12 -3.45 0.00 0.00 179.45 175.19 2dcq s SER 101 N -5.25 -0.09 0.26 4.20 0.01 -1.26 -4.72 113.70 106.84 2dcq s SER 101 Ca -0.11 0.07 0.01 0.00 1.31 0.00 0.00 55.95 57.23 2dcq s SER 101 Cb 0.01 0.30 -0.04 0.00 0.21 0.00 0.00 66.02 66.50 2dcq s SER 101 CO 0.16 -0.27 0.13 0.00 0.41 0.00 0.00 173.24 173.67 2dcq s ALA 102 N -0.81 1.64 0.17 1.44 0.00 -1.26 -2.69 121.76 120.25 2dcq s ALA 102 Ca -0.09 -1.80 -0.00 0.00 0.00 0.00 0.00 51.96 50.07 2dcq s ALA 102 Cb -0.05 1.19 -0.04 0.00 0.00 0.00 0.00 23.12 24.22 2dcq s ALA 102 CO 0.01 -0.52 0.07 0.71 0.00 0.00 0.00 175.76 176.04 2dcq s TYR 103 N -3.82 1.08 0.25 0.00 1.51 0.45 -4.87 117.35 111.95 2dcq s TYR 103 Ca 0.38 -1.23 0.05 0.00 -1.01 0.00 0.00 57.07 55.26 2dcq s TYR 103 Cb 0.07 -0.59 -0.05 0.00 -0.11 0.00 0.00 41.96 41.27 2dcq s TYR 103 CO 0.15 -0.48 -0.04 0.00 -1.11 0.00 0.00 175.55 174.07 2dcq s ALA 104 N -3.98 2.10 -0.10 3.71 0.00 -1.26 -0.73 121.76 121.51 2dcq s ALA 104 Ca 0.30 -1.83 0.04 0.00 0.00 0.00 0.00 51.96 50.47 2dcq s ALA 104 Cb 0.07 0.28 0.00 0.00 0.00 0.00 0.00 23.12 23.47 2dcq s ALA 104 CO 0.06 -0.13 -0.23 -1.50 0.00 0.00 0.00 175.76 173.96 2dcq s ILE 105 N -3.17 1.97 0.66 0.00 2.07 -1.22 -3.52 121.20 117.98 2dcq s ILE 105 Ca 0.28 -0.96 -0.16 0.00 -1.41 0.00 0.00 60.65 58.40 2dcq s ILE 105 Cb 0.04 -1.71 -0.00 0.00 0.13 0.00 0.00 42.46 40.92 2dcq s ILE 105 CO 0.10 0.54 1.16 -0.75 -1.91 0.00 0.00 174.94 174.08 2dcq s LYS 106 N 0.40 2.69 0.00 3.50 2.47 0.06 -3.66 119.74 125.20 2dcq s LYS 106 Ca -0.18 1.60 0.00 0.00 -1.56 0.00 0.00 55.97 55.83 2dcq s LYS 106 Cb -0.18 -1.92 0.00 0.00 -1.46 0.00 0.00 37.83 34.28 2dcq s LYS 106 CO 0.08 -1.37 0.00 -0.25 0.16 0.00 0.00 175.35 173.96 2dcq n ASP 107 N -2.24 -3.04 0.00 1.43 8.00 -1.25 -4.48 116.55 114.97 2dcq n ASP 107 Ca 0.12 0.00 0.00 0.00 0.71 0.00 0.00 54.79 55.62 2dcq n ASP 107 Cb 0.51 -2.21 0.00 0.00 -0.02 0.00 0.00 41.12 39.40 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 -0.96 2.15 0.00 0.44 0.00 -1.24 -0.93 105.19 104.65 2dcq n GLY 108 Ca 0.00 0.26 0.00 0.00 0.00 0.00 0.00 46.02 46.28 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 9.26 1.57 0.00 4.61 0.00 -0.47 -0.33 120.51 135.15 2dcq n ALA 109 Ca 0.00 -0.76 0.00 0.00 0.00 0.00 0.00 53.44 52.68 2dcq n ALA 109 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.45 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 -0.27 3.24 -1.07 0.00 1.02 0.60 -4.06 120.64 120.10 2dcq n GLU 110 Ca 0.00 0.00 -0.32 0.00 -0.02 0.00 0.00 57.16 56.82 2dcq n GLU 110 Cb 0.34 -0.50 0.13 0.00 -0.02 0.00 0.00 31.44 31.38 2dcq n GLU 110 CO 0.00 0.00 0.00 0.20 1.18 0.00 0.00 177.13 178.51 2dcq s GLY 111 N -0.75 1.89 0.14 0.62 0.00 -0.11 -4.88 107.32 104.24 2dcq s GLY 111 Ca 0.00 0.61 0.12 0.00 0.00 0.00 0.00 44.72 45.45 2dcq s GLY 111 CO 0.00 1.00 1.38 -1.55 0.00 0.00 0.00 173.10 173.94 2dcq n PRO 112 N -3.58 0.07 -0.02 2.90 -0.04 -1.26 -1.09 135.00 131.98 2dcq n PRO 112 Ca 0.12 0.50 0.01 0.00 -0.04 0.00 0.00 63.50 64.09 2dcq n PRO 112 Cb 0.52 -1.71 0.01 0.00 -0.04 0.00 0.00 33.50 32.28 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 -1.86 1.94 0.00 0.54 5.12 -1.26 -4.82 116.66 116.32 2dcq n ARG 113 Ca 0.00 -1.27 0.00 0.00 -1.93 0.00 0.00 57.85 54.65 2dcq n ARG 113 Cb 0.07 -0.88 0.00 0.00 -1.16 0.00 0.00 32.46 30.49 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 -0.40 -1.51 0.40 -0.13 0.00 -0.25 -4.23 105.19 99.06 2dcq n GLY 114 Ca 0.01 -1.58 -0.13 0.00 0.00 0.00 0.00 46.02 44.32 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 -0.96 -1.41 -0.60 1.61 2.91 -0.93 -2.15 115.95 114.42 2dcq h TRP 115 Ca 0.00 0.06 0.03 0.00 1.13 0.00 0.00 58.89 60.10 2dcq h TRP 115 Cb 0.00 0.64 -0.04 0.00 -0.51 0.00 0.00 29.16 29.25 2dcq h TRP 115 CO 0.00 -0.46 0.37 -0.07 -1.03 0.00 0.00 178.44 177.25 2dcq h LEU 116 N -0.46 0.60 -1.52 0.65 3.38 -1.84 -1.31 115.31 114.80 2dcq h LEU 116 Ca 0.04 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.01 2dcq h LEU 116 Cb 0.57 -0.13 0.00 0.00 0.09 0.00 0.00 40.66 41.19 2dcq h LEU 116 CO -0.41 0.42 0.00 0.59 0.09 0.00 0.00 178.44 179.14 2dcq n ASN 117 N -4.73 1.66 -0.69 -0.43 4.13 -0.85 -2.71 115.26 111.64 2dcq n ASN 117 Ca 0.05 -1.62 0.03 0.00 1.68 0.00 0.00 54.58 54.72 2dcq n ASN 117 Cb 0.08 -0.41 0.04 0.00 -1.54 0.00 0.00 39.78 37.95 2dcq n ASN 117 CO 0.00 0.00 0.00 -0.24 0.28 0.00 0.00 177.26 177.30 2dcq n SER 118 N 0.36 0.67 0.00 6.41 2.88 -0.50 -4.58 113.62 118.86 2dcq n SER 118 Ca 0.00 -2.27 0.00 0.00 -1.33 0.00 0.00 58.87 55.27 2dcq n SER 118 Cb 0.31 -0.28 0.00 0.00 -0.75 0.00 0.00 64.21 63.49 2dcq n SER 118 CO 0.00 0.00 0.00 -1.54 -1.23 0.00 0.00 175.04 172.27 2dcq n SER 119 N -0.15 -3.25 -4.81 -3.46 3.41 -1.10 -4.81 113.62 99.44 2dcq n SER 119 Ca 0.05 0.00 -0.33 0.00 -0.26 0.00 0.00 58.87 58.33 2dcq n SER 119 Cb 0.80 -2.33 -0.00 0.00 -0.26 0.00 0.00 64.21 62.42 2dcq n SER 119 CO 0.00 0.00 0.00 -0.76 -0.16 0.00 0.00 175.04 174.12 2dcq s LEU 120 N 0.00 3.55 0.63 1.04 1.43 -1.19 -5.02 118.68 119.13 2dcq s LEU 120 Ca 0.00 1.77 -0.14 0.00 -1.03 0.00 0.00 54.13 54.73 2dcq s LEU 120 Cb 0.00 -4.53 -0.02 0.00 0.03 0.00 0.00 46.19 41.67 2dcq s LEU 120 CO 0.00 -1.01 1.06 -2.16 0.23 0.00 0.00 176.35 174.47 2dcq s PRO 121 N -4.01 3.15 0.01 1.29 0.04 -1.26 -4.76 135.00 129.46 2dcq s PRO 121 Ca 0.63 1.14 -0.03 0.00 0.04 0.00 0.00 61.00 62.78 2dcq s PRO 121 Cb -0.15 -2.01 -0.01 0.00 0.04 0.00 0.00 34.50 32.37 2dcq s PRO 121 CO 0.34 -0.94 0.04 -0.46 0.04 0.00 0.00 177.00 176.02 2dcq s TRP 122 N -2.63 0.15 -0.07 0.56 -0.11 -1.26 -2.39 118.94 113.19 2dcq s TRP 122 Ca 0.62 -0.31 0.00 0.00 1.22 0.00 0.00 56.10 57.63 2dcq s TRP 122 Cb -0.16 -0.12 -0.26 0.00 -1.50 0.00 0.00 33.47 31.44 2dcq s TRP 122 CO 0.43 -0.21 0.56 0.82 -4.62 0.00 0.00 176.95 173.94 2dcq h ILE 123 N 4.56 0.80 -2.92 5.86 2.04 -0.61 -3.42 117.51 123.83 2dcq h ILE 123 Ca -0.31 -2.55 0.30 0.00 1.00 0.00 0.00 64.86 63.30 2dcq h ILE 123 Cb 1.20 2.53 -0.15 0.00 -0.74 0.00 0.00 36.82 39.67 2dcq h ILE 123 CO 0.41 0.75 -0.97 -0.62 0.00 0.00 0.00 178.15 177.72 2dcq n GLU 124 N -3.33 -2.76 -0.64 2.37 1.02 -1.25 -4.87 120.64 111.18 2dcq n GLU 124 Ca -0.24 2.19 -0.17 0.00 -0.02 0.00 0.00 57.16 58.93 2dcq n GLU 124 Cb 1.05 -3.24 0.14 0.00 -0.02 0.00 0.00 31.44 29.36 2dcq n GLU 124 CO 0.00 0.00 0.00 -0.35 1.18 0.00 0.00 177.13 177.96 2dcq n PRO 125 N -3.99 -2.04 -4.24 3.49 -0.04 -1.26 -4.57 135.00 122.35 2dcq n PRO 125 Ca -0.06 -1.00 -0.19 0.00 -0.04 0.00 0.00 63.50 62.20 2dcq n PRO 125 Cb 0.57 -0.90 -0.16 0.00 -0.04 0.00 0.00 33.50 32.98 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 -4.42 0.81 -0.52 0.54 3.01 -1.26 -4.92 119.74 112.98 2dcq s LYS 126 Ca 0.40 -0.18 -0.04 0.00 -1.01 0.00 0.00 55.97 55.15 2dcq s LYS 126 Cb -0.04 -0.79 0.03 0.00 -1.01 0.00 0.00 37.83 36.03 2dcq s LYS 126 CO 0.30 0.01 0.11 1.63 0.51 0.00 0.00 175.35 177.91 2dcq n LYS 127 N 3.65 -2.64 -2.73 1.68 5.02 -1.26 -4.79 118.16 117.09 2dcq n LYS 127 Ca -0.22 0.16 -0.04 0.00 -2.02 0.00 0.00 58.31 56.20 2dcq n LYS 127 Cb 0.53 -4.71 0.06 0.00 -0.02 0.00 0.00 35.03 30.89 2dcq n LYS 127 CO 0.00 0.00 0.00 0.25 -0.52 0.00 0.00 177.40 177.13 2dcq n THR 128 N -2.97 0.82 -0.24 -0.18 -2.24 -1.26 -4.98 114.28 103.23 2dcq n THR 128 Ca -0.01 -2.49 0.04 0.00 -2.27 0.00 0.00 64.05 59.32 2dcq n THR 128 Cb 0.52 1.00 0.15 0.00 -2.10 0.00 0.00 70.33 69.90 2dcq n THR 128 CO 0.00 0.00 0.00 0.28 -0.57 0.00 0.00 175.07 174.78 2dcq h SER 129 N 2.42 -0.15 -0.98 3.42 0.02 -1.87 -3.39 113.55 113.03 2dcq h SER 129 Ca -0.19 0.16 0.00 0.00 -0.84 0.00 0.00 61.79 60.92 2dcq h SER 129 Cb 1.25 0.25 0.00 0.00 0.14 0.00 0.00 62.40 64.04 2dcq h SER 129 CO 0.20 -0.09 0.00 0.61 -1.14 0.00 0.00 176.83 176.41 2dcq n GLY 130 N -1.37 -1.83 3.37 -3.77 0.00 -1.26 -4.17 105.19 96.16 2dcq n GLY 130 Ca 0.13 -2.02 -0.35 0.00 0.00 0.00 0.00 46.02 43.77 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 1.51 -1.28 1.61 -0.04 -1.26 -3.91 135.00 131.63 2dcq n PRO 131 Ca 0.00 -2.16 -0.12 0.00 -0.04 0.00 0.00 63.50 61.19 2dcq n PRO 131 Cb 0.00 -3.34 -0.05 0.00 -0.04 0.00 0.00 33.50 30.07 2dcq n PRO 131 CO 0.00 0.00 0.00 0.43 -0.04 0.00 0.00 175.50 175.89 2dcq n SER 132 N 11.26 -3.92 0.18 3.54 7.64 -1.26 -4.83 113.62 126.22 2dcq n SER 132 Ca 0.47 0.29 0.14 0.00 1.01 0.00 0.00 58.87 60.78 2dcq n SER 132 Cb 0.44 -3.36 0.58 0.00 -1.01 0.00 0.00 64.21 60.87 2dcq n SER 132 CO 0.00 0.00 0.00 0.77 -3.01 0.00 0.00 175.04 172.80 2dcq h SER 133 N 0.00 0.00 0.00 6.43 4.64 -1.78 -3.53 113.55 119.31 2dcq h SER 133 Ca -0.24 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.08 2dcq h SER 133 Cb 0.90 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.99 2dcq h SER 133 CO 0.35 0.00 0.00 0.61 -0.87 0.00 0.00 176.83 176.92