#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 -0.68 -3.69 1.61 2.88 -1.26 -5.16 113.62 107.32 2dcq n SER 2 Ca 0.00 -1.69 -0.21 0.00 -1.33 0.00 0.00 58.87 55.64 2dcq n SER 2 Cb 0.00 1.19 -0.18 0.00 -0.75 0.00 0.00 64.21 64.47 2dcq n SER 2 CO 0.00 0.00 0.00 -0.55 -1.23 0.00 0.00 175.04 173.26 2dcq s SER 3 N -1.83 1.32 0.00 -3.46 0.15 -1.26 -4.96 113.70 103.66 2dcq s SER 3 Ca 0.09 -0.00 0.00 0.00 0.70 0.00 0.00 55.95 56.74 2dcq s SER 3 Cb -0.01 -0.22 0.00 0.00 -1.71 0.00 0.00 66.02 64.08 2dcq s SER 3 CO 0.07 -0.24 0.00 0.61 1.20 0.00 0.00 173.24 174.88 2dcq n GLY 4 N 5.26 -0.68 0.23 9.45 0.00 -1.26 -4.98 105.19 113.21 2dcq n GLY 4 Ca -0.04 -0.45 0.15 0.00 0.00 0.00 0.00 46.02 45.68 2dcq n GLY 4 CO 0.00 0.00 0.00 1.76 0.00 0.00 0.00 173.32 175.08 2dcq h SER 5 N 0.00 0.00 -2.71 1.61 0.02 -1.95 -3.08 113.55 107.44 2dcq h SER 5 Ca 0.00 0.00 -0.71 0.00 -0.84 0.00 0.00 61.79 60.24 2dcq h SER 5 Cb 0.00 0.00 -0.20 0.00 0.14 0.00 0.00 62.40 62.34 2dcq h SER 5 CO 0.00 0.00 0.69 -0.44 -1.14 0.00 0.00 176.83 175.94 2dcq s SER 6 N -4.47 6.69 1.05 3.07 0.01 -1.26 -1.37 113.70 117.41 2dcq s SER 6 Ca -0.03 -2.24 -0.12 0.00 1.31 0.00 0.00 55.95 54.87 2dcq s SER 6 Cb 0.09 -2.36 0.16 0.00 0.21 0.00 0.00 66.02 64.12 2dcq s SER 6 CO 0.29 -0.94 0.82 0.61 0.41 0.00 0.00 173.24 174.43 2dcq n GLY 7 N 5.08 -1.76 3.39 3.44 0.00 -1.17 -4.62 105.19 109.55 2dcq n GLY 7 Ca 0.22 -1.63 -0.29 0.00 0.00 0.00 0.00 46.02 44.33 2dcq n GLY 7 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 2dcq n SER 8 N -3.75 -2.52 0.00 1.61 7.64 -1.26 -3.45 113.62 111.88 2dcq n SER 8 Ca 0.11 -0.39 0.00 0.00 1.01 0.00 0.00 58.87 59.60 2dcq n SER 8 Cb 0.38 -1.18 0.00 0.00 -1.01 0.00 0.00 64.21 62.40 2dcq n SER 8 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 2dcq n ALA 9 N -5.28 -0.34 0.19 -0.43 0.00 -1.26 -2.99 120.51 110.40 2dcq n ALA 9 Ca 0.05 0.00 0.18 0.00 0.00 0.00 0.00 53.44 53.67 2dcq n ALA 9 Cb 0.56 0.05 0.82 0.00 0.00 0.00 0.00 19.45 20.87 2dcq n ALA 9 CO 0.00 0.00 0.00 0.87 0.00 0.00 0.00 177.50 178.37 2dcq h LYS 10 N 0.00 0.00 -0.97 0.00 1.79 -1.89 -2.58 116.57 112.92 2dcq h LYS 10 Ca 0.00 0.00 0.23 0.00 -2.18 0.00 0.00 60.65 58.70 2dcq h LYS 10 Cb 0.00 0.00 -0.12 0.00 -1.58 0.00 0.00 32.23 30.53 2dcq h LYS 10 CO 0.00 0.00 0.54 -0.97 -1.08 0.00 0.00 179.45 177.94 2dcq h ASN 11 N 0.00 0.59 0.39 0.86 -1.24 -1.90 0.20 115.58 114.49 2dcq h ASN 11 Ca 0.10 0.14 -0.02 0.00 0.71 0.00 0.00 56.30 57.23 2dcq h ASN 11 Cb 0.59 0.05 0.00 0.00 0.73 0.00 0.00 38.32 39.69 2dcq h ASN 11 CO -0.00 0.09 -0.19 0.00 -1.29 0.00 0.00 177.43 176.05 2dcq h ALA 12 N 1.71 -0.69 -0.92 1.57 0.00 -1.54 -3.14 119.26 116.26 2dcq h ALA 12 Ca 0.61 -0.11 0.17 0.00 0.00 0.00 0.00 54.91 55.58 2dcq h ALA 12 Cb 1.14 0.20 -0.08 0.00 0.00 0.00 0.00 17.79 19.06 2dcq h ALA 12 CO -0.48 -0.66 0.59 -0.92 0.00 0.00 0.00 179.25 177.79 2dcq h TYR 13 N -0.83 0.77 0.09 0.00 3.20 -1.51 -0.17 116.97 118.53 2dcq h TYR 13 Ca -0.05 0.02 0.02 0.00 3.14 0.00 0.00 58.73 61.86 2dcq h TYR 13 Cb 0.40 -0.24 -0.03 0.00 1.54 0.00 0.00 36.73 38.40 2dcq h TYR 13 CO 0.04 0.23 -0.23 1.15 -1.64 0.00 0.00 178.16 177.71 2dcq h THR 14 N 0.60 0.47 -0.36 1.81 2.02 -0.72 -1.06 112.91 115.68 2dcq h THR 14 Ca 0.48 0.00 -0.04 0.00 0.77 0.00 0.00 66.41 67.62 2dcq h THR 14 Cb 0.92 0.47 -0.01 0.00 -1.74 0.00 0.00 68.15 67.79 2dcq h THR 14 CO -0.23 0.00 0.05 0.11 0.37 0.00 0.00 175.52 175.82 2dcq h LYS 15 N -0.42 0.59 -0.93 6.66 1.79 -1.08 -2.74 116.57 120.44 2dcq h LYS 15 Ca 0.03 -0.16 0.26 0.00 -2.18 0.00 0.00 60.65 58.60 2dcq h LYS 15 Cb 0.46 -0.07 -0.16 0.00 -1.58 0.00 0.00 32.23 30.87 2dcq h LYS 15 CO -0.15 0.67 0.13 1.25 -1.08 0.00 0.00 179.45 180.28 2dcq h LEU 16 N 0.43 -0.25 -1.43 2.94 5.85 -0.87 -0.97 115.31 121.00 2dcq h LEU 16 Ca 0.11 0.24 0.00 0.00 0.84 0.00 0.00 57.88 59.07 2dcq h LEU 16 Cb 0.37 0.38 0.00 0.00 0.37 0.00 0.00 40.66 41.79 2dcq h LEU 16 CO 0.01 -0.28 0.00 0.61 -0.34 0.00 0.00 178.44 178.44 2dcq n GLY 17 N -1.43 0.78 0.00 3.75 0.00 -0.42 -3.69 105.19 104.18 2dcq n GLY 17 Ca 0.23 -0.45 0.00 0.00 0.00 0.00 0.00 46.02 45.80 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 0.63 0.00 -3.95 2.61 5.66 -0.44 -5.00 114.28 113.78 2dcq n THR 18 Ca 0.15 -0.32 -0.31 0.00 -3.05 0.00 0.00 64.05 60.51 2dcq n THR 18 Cb 0.35 1.06 -0.15 0.00 -1.55 0.00 0.00 70.33 70.03 2dcq n THR 18 CO 0.00 0.00 0.00 -1.81 -3.05 0.00 0.00 175.07 170.21 2dcq s ASP 19 N -0.54 4.06 0.00 1.09 1.01 -0.76 -4.99 116.67 116.53 2dcq s ASP 19 Ca 0.00 -1.35 0.00 0.00 0.71 0.00 0.00 52.55 51.91 2dcq s ASP 19 Cb 0.00 -1.26 0.01 0.00 1.01 0.00 0.00 42.92 42.67 2dcq s ASP 19 CO 0.00 -0.26 0.91 -0.67 0.21 0.00 0.00 175.17 175.36 2dcq n ASP 20 N 4.60 0.00 -0.07 0.27 2.03 -1.26 -1.71 116.55 120.41 2dcq n ASP 20 Ca -0.10 0.41 0.01 0.00 0.52 0.00 0.00 54.79 55.63 2dcq n ASP 20 Cb 0.43 -0.41 0.01 0.00 -0.72 0.00 0.00 41.12 40.43 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 -1.41 1.29 -4.88 1.67 3.02 -1.26 -5.06 115.26 108.63 2dcq n ASN 21 Ca -0.00 -1.21 -0.30 0.00 -0.03 0.00 0.00 54.58 53.04 2dcq n ASN 21 Cb 0.09 -0.01 0.02 0.00 -0.61 0.00 0.00 39.78 39.28 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 -0.27 3.05 0.26 5.41 0.00 -0.69 -2.38 121.76 127.15 2dcq s ALA 22 Ca 0.02 -0.21 -0.07 0.00 0.00 0.00 0.00 51.96 51.70 2dcq s ALA 22 Cb 0.01 -3.03 -0.01 0.00 0.00 0.00 0.00 23.12 20.10 2dcq s ALA 22 CO 0.02 -0.83 0.40 -0.65 0.00 0.00 0.00 175.76 174.71 2dcq s GLN 23 N -5.22 1.58 -0.05 0.00 -1.52 -0.44 -4.86 119.66 109.15 2dcq s GLN 23 Ca 0.56 -1.48 0.01 0.00 -1.95 0.00 0.00 55.36 52.50 2dcq s GLN 23 Cb -0.11 0.42 0.02 0.00 -0.22 0.00 0.00 33.01 33.12 2dcq s GLN 23 CO 0.53 -0.63 -0.07 -1.17 -0.25 0.00 0.00 175.29 173.69 2dcq s LEU 24 N -3.11 1.46 -0.46 2.90 1.98 -1.26 -1.55 118.68 118.63 2dcq s LEU 24 Ca 0.28 -0.18 0.00 0.00 -2.89 0.00 0.00 54.13 51.35 2dcq s LEU 24 Cb 0.01 -0.56 0.12 0.00 0.66 0.00 0.00 46.19 46.43 2dcq s LEU 24 CO 0.13 -0.02 0.23 -0.22 -1.89 0.00 0.00 176.35 174.58 2dcq s LEU 25 N 0.78 4.92 -0.89 -0.68 1.98 -1.05 -1.46 118.68 122.27 2dcq s LEU 25 Ca -0.12 -2.47 -0.25 0.00 -2.89 0.00 0.00 54.13 48.40 2dcq s LEU 25 Cb -0.15 -1.74 0.01 0.00 0.66 0.00 0.00 46.19 44.98 2dcq s LEU 25 CO 0.01 -0.39 1.60 1.51 -1.89 0.00 0.00 176.35 177.19 2dcq s ASP 26 N 0.86 5.93 0.00 3.68 1.47 -0.71 -1.04 116.67 126.85 2dcq s ASP 26 Ca 0.13 -0.86 0.22 0.00 1.18 0.00 0.00 52.55 53.22 2dcq s ASP 26 Cb -0.22 -2.56 1.32 0.00 -0.34 0.00 0.00 42.92 41.12 2dcq s ASP 26 CO -0.04 -2.01 1.77 2.30 0.68 0.00 0.00 175.17 177.87 2dcq n ILE 27 N 7.11 0.00 -1.72 2.11 -5.35 -0.70 -1.47 119.36 119.34 2dcq n ILE 27 Ca 0.28 0.00 -0.38 0.00 -0.27 0.00 0.00 62.75 62.38 2dcq n ILE 27 Cb 0.50 -0.46 0.05 0.00 -1.74 0.00 0.00 39.64 37.99 2dcq n ILE 27 CO 0.00 0.00 0.00 0.54 -1.76 0.00 0.00 176.55 175.33 2dcq n ARG 28 N -0.90 1.39 -0.88 6.28 1.74 -1.21 -3.61 116.66 119.46 2dcq n ARG 28 Ca 0.17 0.52 -0.32 0.00 -0.77 0.00 0.00 57.85 57.45 2dcq n ARG 28 Cb 0.08 -2.49 0.15 0.00 -1.02 0.00 0.00 32.46 29.17 2dcq n ARG 28 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 2dcq s ALA 29 N -1.35 1.66 0.40 7.54 0.00 -1.26 -4.22 121.76 124.53 2dcq s ALA 29 Ca 0.76 0.64 0.28 0.00 0.00 0.00 0.00 51.96 53.64 2dcq s ALA 29 Cb -0.41 -3.45 1.47 0.00 0.00 0.00 0.00 23.12 20.73 2dcq s ALA 29 CO 0.46 -2.52 2.07 1.15 0.00 0.00 0.00 175.76 176.92 2dcq h THR 30 N -1.50 0.52 0.00 0.00 2.02 -1.98 -0.19 112.91 111.79 2dcq h THR 30 Ca -0.44 -0.52 -0.06 0.00 0.77 0.00 0.00 66.41 66.16 2dcq h THR 30 Cb 1.27 1.35 -0.01 0.00 -1.74 0.00 0.00 68.15 69.02 2dcq h THR 30 CO 0.44 0.11 -0.29 0.00 0.37 0.00 0.00 175.52 176.15 2dcq h ALA 31 N 1.89 1.11 -0.20 6.16 0.00 -2.01 -3.25 119.26 122.95 2dcq h ALA 31 Ca -0.00 -0.26 0.04 0.00 0.00 0.00 0.00 54.91 54.69 2dcq h ALA 31 Cb 0.34 -0.05 -0.04 0.00 0.00 0.00 0.00 17.79 18.04 2dcq h ALA 31 CO 0.01 0.36 -0.04 0.22 0.00 0.00 0.00 179.25 179.80 2dcq h ASP 32 N 0.00 -0.17 0.14 0.00 1.82 -1.36 -1.48 116.42 115.37 2dcq h ASP 32 Ca -0.00 0.06 0.00 0.00 -0.39 0.00 0.00 57.03 56.69 2dcq h ASP 32 Cb 0.71 0.12 0.00 0.00 0.68 0.00 0.00 39.33 40.84 2dcq h ASP 32 CO 0.04 -0.06 0.00 0.49 -1.61 0.00 0.00 179.24 178.10 2dcq n PHE 33 N -5.19 0.00 -0.08 0.28 3.72 -1.23 -0.01 117.46 114.95 2dcq n PHE 33 Ca -0.02 0.00 -0.09 0.00 -0.05 0.00 0.00 57.45 57.29 2dcq n PHE 33 Cb 0.12 -0.41 -0.15 0.00 -0.94 0.00 0.00 39.48 38.09 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 -1.41 0.67 -0.00 -1.08 1.74 -0.59 -4.10 116.66 111.89 2dcq n ARG 34 Ca 0.02 0.06 0.02 0.00 -0.77 0.00 0.00 57.85 57.17 2dcq n ARG 34 Cb 0.05 -1.59 -0.03 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 -2.80 0.46 0.00 5.56 10.64 -0.23 -4.82 117.38 126.19 2dcq n GLN 35 Ca -0.28 -0.03 0.00 0.00 -1.83 0.00 0.00 57.00 54.86 2dcq n GLN 35 Cb 1.11 -1.06 0.00 0.00 -0.86 0.00 0.00 30.24 29.43 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 -1.59 0.00 -0.01 -0.39 0.31 0.98 -5.03 118.33 112.59 2dcq n VAL 36 Ca -0.01 0.11 0.00 0.00 -0.01 0.00 0.00 64.34 64.44 2dcq n VAL 36 Cb 0.09 -0.97 0.00 0.00 -0.91 0.00 0.00 33.84 32.05 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 2.90 0.80 3.06 2.92 0.00 -0.99 -4.27 105.19 109.60 2dcq n GLY 37 Ca 0.00 -1.68 -0.09 0.00 0.00 0.00 0.00 46.02 44.25 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 0.25 -0.02 1.61 0.01 -1.26 -4.01 113.70 106.28 2dcq s SER 38 Ca 0.00 -0.58 -0.30 0.00 1.31 0.00 0.00 55.95 56.38 2dcq s SER 38 Cb 0.00 0.17 -0.05 0.00 0.21 0.00 0.00 66.02 66.36 2dcq s SER 38 CO 0.00 -0.43 1.31 -2.16 0.41 0.00 0.00 173.24 172.37 2dcq s PRO 39 N -2.30 4.31 -1.15 12.44 0.04 -1.26 -0.14 135.00 146.94 2dcq s PRO 39 Ca -0.08 1.84 -0.17 0.00 0.04 0.00 0.00 61.00 62.63 2dcq s PRO 39 Cb -0.03 -3.56 0.13 0.00 0.04 0.00 0.00 34.50 31.07 2dcq s PRO 39 CO -0.04 -0.52 1.43 1.21 0.04 0.00 0.00 177.00 179.12 2dcq s ASN 40 N 1.70 6.87 0.00 6.66 3.84 -1.23 -4.66 114.94 128.12 2dcq s ASN 40 Ca 0.60 -2.53 0.27 0.00 0.21 0.00 0.00 52.86 51.42 2dcq s ASN 40 Cb -0.28 -2.45 0.91 0.00 -0.55 0.00 0.00 41.25 38.87 2dcq s ASN 40 CO 0.25 -0.97 1.67 2.30 -2.79 0.00 0.00 177.10 177.55 2dcq n ILE 41 N 5.38 0.00 -0.12 -5.21 -5.35 -1.26 -4.35 119.36 108.44 2dcq n ILE 41 Ca 0.36 -0.28 0.02 0.00 -0.27 0.00 0.00 62.75 62.58 2dcq n ILE 41 Cb 0.46 0.65 0.33 0.00 -1.74 0.00 0.00 39.64 39.33 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 2.68 0.78 0.00 6.28 3.11 -1.74 -0.27 116.57 127.41 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 0.58 -0.18 0.00 0.00 -1.00 0.00 0.00 32.23 31.63 2dcq h LYS 42 CO 0.00 0.52 0.00 0.78 -2.81 0.00 0.00 179.45 177.94 2dcq h GLY 43 N 0.81 0.00 1.90 5.01 0.00 -1.85 -0.79 103.07 108.15 2dcq h GLY 43 Ca 0.22 0.00 -0.22 0.00 0.00 0.00 0.00 47.33 47.34 2dcq h GLY 43 CO -0.05 0.00 -1.01 0.17 0.00 0.00 0.00 176.54 175.65 2dcq h LEU 44 N 0.00 0.11 0.00 3.11 8.10 -1.34 -3.48 115.31 121.81 2dcq h LEU 44 Ca 0.00 -0.11 0.00 0.00 0.11 0.00 0.00 57.88 57.88 2dcq h LEU 44 Cb 0.18 -0.04 0.00 0.00 -0.44 0.00 0.00 40.66 40.36 2dcq h LEU 44 CO 0.00 1.05 0.00 0.61 -4.11 0.00 0.00 178.44 175.99 2dcq n GLY 45 N 1.27 0.98 3.63 0.17 0.00 -0.31 -4.99 105.19 105.94 2dcq n GLY 45 Ca -0.02 -0.07 -0.08 0.00 0.00 0.00 0.00 46.02 45.85 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 1.25 0.82 1.61 0.00 -1.14 -4.92 119.74 117.36 2dcq s LYS 46 Ca 0.00 -0.59 -0.12 0.00 0.00 0.00 0.00 55.97 55.26 2dcq s LYS 46 Cb 0.00 0.49 0.08 0.00 0.00 0.00 0.00 37.83 38.41 2dcq s LYS 46 CO 0.00 -0.56 1.11 0.21 0.00 0.00 0.00 175.35 176.11 2dcq s LYS 47 N -3.50 1.88 0.68 1.78 2.47 -1.26 -2.40 119.74 119.38 2dcq s LYS 47 Ca 0.07 0.54 -0.11 0.00 -1.56 0.00 0.00 55.97 54.91 2dcq s LYS 47 Cb -0.02 -1.90 0.16 0.00 -1.46 0.00 0.00 37.83 34.61 2dcq s LYS 47 CO -0.04 -1.74 0.70 0.00 0.16 0.00 0.00 175.35 174.43 2dcq n ALA 48 N -3.50 -1.64 -3.83 3.13 0.00 -1.26 -4.77 120.51 108.64 2dcq n ALA 48 Ca 0.07 -0.99 -0.30 0.00 0.00 0.00 0.00 53.44 52.22 2dcq n ALA 48 Cb 0.57 -0.06 -0.15 0.00 0.00 0.00 0.00 19.45 19.80 2dcq n ALA 48 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.50 177.58 2dcq s VAL 49 N -2.37 1.19 -0.30 0.00 1.01 -0.54 -4.99 120.40 114.40 2dcq s VAL 49 Ca 0.43 -1.34 -0.29 0.00 0.00 0.00 0.00 61.98 60.78 2dcq s VAL 49 Cb -0.03 -1.74 0.01 0.00 0.00 0.00 0.00 36.38 34.62 2dcq s VAL 49 CO 0.32 -0.43 1.14 -0.94 0.00 0.00 0.00 175.10 175.20 2dcq s SER 50 N 1.50 6.87 -0.28 3.32 1.04 -1.26 -1.75 113.70 123.14 2dcq s SER 50 Ca 0.04 1.13 0.02 0.00 0.48 0.00 0.00 55.95 57.62 2dcq s SER 50 Cb -0.18 -2.54 0.17 0.00 0.10 0.00 0.00 66.02 63.57 2dcq s SER 50 CO -0.15 -0.92 0.46 -0.89 0.98 0.00 0.00 173.24 172.72 2dcq s THR 51 N 3.82 -0.74 0.09 2.02 2.01 -0.54 -4.96 115.64 117.33 2dcq s THR 51 Ca 0.49 -0.18 -0.32 0.00 0.31 0.00 0.00 61.69 61.99 2dcq s THR 51 Cb -0.14 -0.97 -0.11 0.00 0.01 0.00 0.00 72.50 71.29 2dcq s THR 51 CO 0.17 -0.18 1.81 0.52 -0.69 0.00 0.00 174.62 176.26 2dcq n VAL 52 N 5.38 0.37 -2.24 3.82 0.31 -1.26 -4.02 118.33 120.69 2dcq n VAL 52 Ca 0.01 -0.07 -0.38 0.00 -0.01 0.00 0.00 64.34 63.89 2dcq n VAL 52 Cb 0.51 -2.00 -0.01 0.00 -0.91 0.00 0.00 33.84 31.42 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 2.78 2.95 -0.11 3.52 5.04 -1.24 -5.04 117.35 125.26 2dcq s TYR 53 Ca 0.84 1.52 -0.05 0.00 -2.44 0.00 0.00 57.07 56.94 2dcq s TYR 53 Cb -0.55 -3.43 0.05 0.00 0.35 0.00 0.00 41.96 38.38 2dcq s TYR 53 CO 0.40 -1.53 0.23 0.54 -1.34 0.00 0.00 175.55 173.86 2dcq s ASN 54 N -1.16 -0.04 0.00 4.32 6.03 -1.26 -5.05 114.94 117.78 2dcq s ASN 54 Ca 0.60 0.51 0.25 0.00 -1.03 0.00 0.00 52.86 53.19 2dcq s ASN 54 Cb -0.31 0.45 0.55 0.00 -3.03 0.00 0.00 41.25 38.91 2dcq s ASN 54 CO 0.39 -0.19 1.45 0.61 -2.03 0.00 0.00 177.10 177.33 2dcq n GLY 55 N 4.57 -1.26 0.20 0.45 0.00 -1.26 -3.62 105.19 104.26 2dcq n GLY 55 Ca -0.20 -0.33 -0.02 0.00 0.00 0.00 0.00 46.02 45.47 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 0.25 -2.14 1.61 4.81 -2.04 -3.30 114.58 113.77 2dcq h GLU 56 Ca 0.00 -0.01 -0.57 0.00 -0.13 0.00 0.00 59.36 58.64 2dcq h GLU 56 Cb 0.50 -0.06 -0.41 0.00 0.63 0.00 0.00 28.75 29.41 2dcq h GLU 56 CO 0.00 0.16 -0.81 -0.40 -0.73 0.00 0.00 179.01 177.24 2dcq n ASP 57 N -5.10 2.64 -0.22 1.04 5.75 -1.24 -4.94 116.55 114.48 2dcq n ASP 57 Ca 0.06 -3.25 -0.06 0.00 -0.01 0.00 0.00 54.79 51.53 2dcq n ASP 57 Cb 0.25 -0.64 -0.05 0.00 -1.03 0.00 0.00 41.12 39.65 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 0.72 -0.23 0.00 0.11 4.76 -1.24 -0.58 118.16 121.70 2dcq n LYS 58 Ca 0.27 1.16 0.10 0.00 -2.87 0.00 0.00 58.31 56.97 2dcq n LYS 58 Cb 0.47 -1.71 0.59 0.00 -1.84 0.00 0.00 35.03 32.53 2dcq n LYS 58 CO 0.00 0.00 0.00 -0.35 -1.37 0.00 0.00 177.40 175.68 2dcq n PRO 59 N -4.19 0.66 -0.29 1.97 -0.04 -1.26 -2.41 135.00 129.44 2dcq n PRO 59 Ca 0.01 0.00 0.11 0.00 -0.04 0.00 0.00 63.50 63.58 2dcq n PRO 59 Cb 0.14 -1.47 0.26 0.00 -0.04 0.00 0.00 33.50 32.39 2dcq n PRO 59 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 2dcq n GLY 60 N 0.31 2.29 0.42 0.55 0.00 0.26 -4.65 105.19 104.36 2dcq n GLY 60 Ca 0.15 -0.70 -0.07 0.00 0.00 0.00 0.00 46.02 45.41 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 1.39 0.00 0.11 1.61 7.35 -0.85 -4.63 117.46 122.44 2dcq n PHE 61 Ca 0.21 0.00 0.01 0.00 -0.76 0.00 0.00 57.45 56.91 2dcq n PHE 61 Cb 0.58 -0.28 0.06 0.00 0.35 0.00 0.00 39.48 40.19 2dcq n PHE 61 CO 0.00 0.00 0.00 1.28 -0.76 0.00 0.00 176.76 177.28 2dcq n LEU 62 N -3.04 0.00 0.00 -2.13 4.77 -1.25 -1.44 117.00 113.91 2dcq n LEU 62 Ca -0.14 0.37 0.04 0.00 -0.03 0.00 0.00 56.01 56.24 2dcq n LEU 62 Cb 0.62 -0.37 0.17 0.00 -2.33 0.00 0.00 43.42 41.51 2dcq n LEU 62 CO 0.04 -0.33 0.59 2.29 -1.33 0.00 0.00 177.39 178.64 2dcq n LYS 63 N -1.37 0.04 -0.12 3.23 -0.00 -1.26 -0.53 118.16 118.15 2dcq n LYS 63 Ca 0.01 0.32 0.06 0.00 -0.00 0.00 0.00 58.31 58.70 2dcq n LYS 63 Cb 0.02 -1.50 0.13 0.00 -0.00 0.00 0.00 35.03 33.68 2dcq n LYS 63 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.40 179.03 2dcq n LYS 64 N -1.42 2.09 0.00 -1.58 4.76 -0.52 -4.65 118.16 116.84 2dcq n LYS 64 Ca 0.02 -1.79 0.00 0.00 -2.87 0.00 0.00 58.31 53.67 2dcq n LYS 64 Cb 0.08 -1.27 0.00 0.00 -1.84 0.00 0.00 35.03 31.99 2dcq n LYS 64 CO 0.00 0.00 0.00 1.28 -1.37 0.00 0.00 177.40 177.31 2dcq n LEU 65 N 0.64 1.08 -0.16 -0.35 4.32 0.31 -4.42 117.00 118.42 2dcq n LEU 65 Ca 0.11 -1.08 0.04 0.00 -0.02 0.00 0.00 56.01 55.05 2dcq n LEU 65 Cb 0.39 0.00 -0.00 0.00 -1.62 0.00 0.00 43.42 42.19 2dcq n LEU 65 CO 0.08 0.27 0.18 -1.20 -1.22 0.00 0.00 177.39 175.51 2dcq n SER 66 N -0.20 1.01 0.00 -1.43 7.64 -0.85 -4.52 113.62 115.27 2dcq n SER 66 Ca 0.00 -1.01 0.00 0.00 1.01 0.00 0.00 58.87 58.87 2dcq n SER 66 Cb 0.23 0.50 0.00 0.00 -1.01 0.00 0.00 64.21 63.92 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 -0.35 0.51 0.01 -3.43 -0.00 -1.26 -4.83 117.00 107.65 2dcq n LEU 67 Ca 0.03 -0.51 0.11 0.00 -0.00 0.00 0.00 56.01 55.65 2dcq n LEU 67 Cb 0.16 0.00 0.11 0.00 -0.00 0.00 0.00 43.42 43.68 2dcq n LEU 67 CO 0.10 0.13 0.22 0.29 -0.00 0.00 0.00 177.39 178.12 2dcq n LYS 68 N -0.02 0.10 -4.22 1.47 4.01 -1.26 -4.96 118.16 113.28 2dcq n LYS 68 Ca 0.00 0.00 -0.13 0.00 -0.51 0.00 0.00 58.31 57.68 2dcq n LYS 68 Cb 0.15 -1.54 -0.10 0.00 -0.51 0.00 0.00 35.03 33.03 2dcq n LYS 68 CO 0.00 0.00 0.00 -0.06 -1.11 0.00 0.00 177.40 176.23 2dcq s PHE 69 N -3.06 1.13 -0.16 2.13 0.08 -1.26 -5.07 117.98 111.76 2dcq s PHE 69 Ca 0.08 -1.02 0.04 0.00 0.12 0.00 0.00 56.93 56.15 2dcq s PHE 69 Cb 0.16 -0.64 -0.12 0.00 -0.57 0.00 0.00 43.02 41.85 2dcq s PHE 69 CO 0.76 -0.23 -0.10 1.17 -0.10 0.00 0.00 175.22 176.73 2dcq n LYS 70 N -0.20 0.78 -3.21 0.44 0.00 -1.26 -4.79 118.16 109.92 2dcq n LYS 70 Ca -0.07 0.07 -0.23 0.00 0.00 0.00 0.00 58.31 58.07 2dcq n LYS 70 Cb 0.63 -1.33 -0.06 0.00 0.00 0.00 0.00 35.03 34.26 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 -2.86 0.71 0.02 3.14 2.03 -1.26 -4.98 116.55 113.35 2dcq n ASP 71 Ca -0.27 -2.83 0.01 0.00 0.52 0.00 0.00 54.79 52.21 2dcq n ASP 71 Cb 0.84 -0.64 0.34 0.00 -0.72 0.00 0.00 41.12 40.95 2dcq n ASP 71 CO 0.00 0.00 0.00 1.55 -1.92 0.00 0.00 177.20 176.83 2dcq h PRO 72 N 3.84 0.47 0.00 -0.67 0.13 -1.87 0.41 132.00 134.31 2dcq h PRO 72 Ca 0.09 -0.08 0.00 0.00 -0.87 0.00 0.00 66.00 65.13 2dcq h PRO 72 Cb 0.87 -0.08 0.00 0.00 0.13 0.00 0.00 31.00 31.92 2dcq h PRO 72 CO 0.51 0.48 0.00 0.39 -0.23 0.00 0.00 178.00 179.15 2dcq n GLU 73 N -4.32 0.02 0.00 0.86 1.02 -1.21 -2.30 120.64 114.71 2dcq n GLU 73 Ca 0.01 0.42 0.00 0.00 -0.02 0.00 0.00 57.16 57.57 2dcq n GLU 73 Cb 0.21 -1.54 0.00 0.00 -0.02 0.00 0.00 31.44 30.09 2dcq n GLU 73 CO 0.00 0.00 0.00 0.09 1.18 0.00 0.00 177.13 178.40 2dcq n ASN 74 N -1.57 0.05 -4.79 1.62 3.02 -0.94 -4.04 115.26 108.61 2dcq n ASN 74 Ca 0.01 -0.63 -0.34 0.00 -0.03 0.00 0.00 54.58 53.58 2dcq n ASN 74 Cb 0.07 0.03 -0.03 0.00 -0.61 0.00 0.00 39.78 39.24 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 -0.03 3.75 -0.44 3.41 2.01 0.09 -4.93 115.64 119.51 2dcq s THR 75 Ca 0.00 1.12 -0.01 0.00 0.31 0.00 0.00 61.69 63.11 2dcq s THR 75 Cb 0.00 -3.47 0.12 0.00 0.01 0.00 0.00 72.50 69.16 2dcq s THR 75 CO 0.00 -0.21 0.21 -0.89 -0.69 0.00 0.00 174.62 173.05 2dcq s THR 76 N -1.93 3.08 0.64 -0.82 2.01 -1.00 -3.95 115.64 113.66 2dcq s THR 76 Ca 0.66 -2.37 -0.15 0.00 0.31 0.00 0.00 61.69 60.15 2dcq s THR 76 Cb -0.17 -3.12 -0.01 0.00 0.01 0.00 0.00 72.50 69.20 2dcq s THR 76 CO 0.21 -0.71 1.08 -0.76 -0.69 0.00 0.00 174.62 173.75 2dcq s LEU 77 N 0.78 3.41 -0.26 4.42 1.43 -1.22 -1.33 118.68 125.91 2dcq s LEU 77 Ca 0.11 1.89 -0.04 0.00 -1.03 0.00 0.00 54.13 55.06 2dcq s LEU 77 Cb -0.22 -4.54 0.09 0.00 0.03 0.00 0.00 46.19 41.55 2dcq s LEU 77 CO -0.05 -1.42 0.11 -0.31 0.23 0.00 0.00 176.35 174.91 2dcq s TYR 78 N -2.45 0.53 0.54 0.29 1.51 -0.59 -2.14 117.35 115.04 2dcq s TYR 78 Ca 0.65 -0.88 -0.19 0.00 -1.01 0.00 0.00 57.07 55.64 2dcq s TYR 78 Cb -0.18 -0.98 -0.06 0.00 -0.11 0.00 0.00 41.96 40.63 2dcq s TYR 78 CO 0.41 -0.76 1.07 0.42 -1.11 0.00 0.00 175.55 175.58 2dcq s ILE 79 N 2.02 3.60 -0.19 2.71 1.01 -0.49 -2.53 121.20 127.32 2dcq s ILE 79 Ca 0.07 0.91 -0.04 0.00 0.00 0.00 0.00 60.65 61.59 2dcq s ILE 79 Cb -0.16 -3.37 0.07 0.00 0.01 0.00 0.00 42.46 39.01 2dcq s ILE 79 CO -0.28 -0.29 0.08 -0.22 0.00 0.00 0.00 174.94 174.23 2dcq s LEU 80 N -3.92 0.64 0.61 2.97 0.20 -0.21 -3.21 118.68 115.76 2dcq s LEU 80 Ca 0.68 -0.77 0.06 0.00 0.69 0.00 0.00 54.13 54.78 2dcq s LEU 80 Cb -0.18 -0.36 0.09 0.00 -0.43 0.00 0.00 46.19 45.31 2dcq s LEU 80 CO 0.27 -0.35 0.84 1.51 -0.29 0.00 0.00 176.35 178.34 2dcq s ASP 81 N 2.05 4.90 0.01 3.68 -4.77 -1.26 -1.73 116.67 119.54 2dcq s ASP 81 Ca 0.02 -0.64 -0.25 0.00 -3.30 0.00 0.00 52.55 48.38 2dcq s ASP 81 Cb -0.16 0.10 -0.19 0.00 -1.09 0.00 0.00 42.92 41.58 2dcq s ASP 81 CO -0.12 -1.47 1.39 0.11 0.70 0.00 0.00 175.17 175.77 2dcq h LYS 82 N -0.02 -0.01 0.00 2.11 1.57 -1.92 -1.13 116.57 117.17 2dcq h LYS 82 Ca -0.33 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.45 2dcq h LYS 82 Cb 1.28 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.59 2dcq h LYS 82 CO 0.41 0.35 0.00 0.34 -0.57 0.00 0.00 179.45 179.98 2dcq n PHE 83 N -4.92 -0.63 0.10 -1.35 -0.00 -1.26 -0.14 117.46 109.26 2dcq n PHE 83 Ca -0.08 0.00 0.00 0.00 -0.00 0.00 0.00 57.45 57.37 2dcq n PHE 83 Cb 0.19 0.30 0.00 0.00 -0.00 0.00 0.00 39.48 39.97 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 -2.09 -0.06 0.00 -2.13 8.00 -1.26 -2.78 116.55 116.23 2dcq n ASP 84 Ca 0.00 0.34 0.00 0.00 0.71 0.00 0.00 54.79 55.84 2dcq n ASP 84 Cb 0.00 0.26 0.00 0.00 -0.02 0.00 0.00 41.12 41.36 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 1.67 3.14 2.40 0.44 0.00 -1.26 -3.53 105.19 108.04 2dcq n GLY 85 Ca 0.00 0.12 0.00 0.00 0.00 0.00 0.00 46.02 46.14 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 4.24 0.76 0.01 1.61 5.03 -1.26 -4.95 115.26 120.70 2dcq n ASN 86 Ca 0.00 -2.05 -0.11 0.00 0.87 0.00 0.00 54.58 53.29 2dcq n ASN 86 Cb 0.00 -0.19 -0.06 0.00 -1.02 0.00 0.00 39.78 38.51 2dcq n ASN 86 CO 0.00 0.00 0.00 0.77 -1.83 0.00 0.00 177.26 176.20 2dcq h SER 87 N 1.82 0.08 -0.50 6.41 4.64 -1.95 -2.78 113.55 121.26 2dcq h SER 87 Ca -0.24 -0.05 0.02 0.00 -0.47 0.00 0.00 61.79 61.05 2dcq h SER 87 Cb 1.42 -0.02 -0.03 0.00 -0.31 0.00 0.00 62.40 63.46 2dcq h SER 87 CO 0.07 0.10 0.33 -0.33 -0.87 0.00 0.00 176.83 176.13 2dcq h GLU 88 N 0.05 0.61 -0.12 4.77 5.08 -1.91 -0.36 114.58 122.70 2dcq h GLU 88 Ca 0.02 -0.04 -0.00 0.00 -1.00 0.00 0.00 59.36 58.34 2dcq h GLU 88 Cb 0.04 -0.14 -0.01 0.00 0.50 0.00 0.00 28.75 29.14 2dcq h GLU 88 CO -0.00 0.40 0.06 1.25 -1.00 0.00 0.00 179.01 179.72 2dcq h LEU 89 N 0.62 0.15 -0.36 1.33 6.46 -1.91 -2.71 115.31 118.89 2dcq h LEU 89 Ca 0.19 -0.11 -0.17 0.00 -0.12 0.00 0.00 57.88 57.68 2dcq h LEU 89 Cb 0.01 -0.04 -0.02 0.00 -0.73 0.00 0.00 40.66 39.88 2dcq h LEU 89 CO -0.05 0.22 -0.80 0.58 -0.62 0.00 0.00 178.44 177.77 2dcq h VAL 90 N 0.08 1.55 -1.00 1.05 2.07 -1.12 -2.78 116.25 116.10 2dcq h VAL 90 Ca 0.04 -2.76 0.05 0.00 0.82 0.00 0.00 66.70 64.84 2dcq h VAL 90 Cb 0.10 2.50 -0.06 0.00 -1.52 0.00 0.00 31.29 32.31 2dcq h VAL 90 CO -0.01 0.78 0.65 0.00 0.02 0.00 0.00 177.57 179.02 2dcq h ALA 91 N 1.20 1.37 -0.51 1.67 0.00 -0.94 -1.26 119.26 120.79 2dcq h ALA 91 Ca -0.01 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 54.86 2dcq h ALA 91 Cb 1.44 -0.34 0.00 0.00 0.00 0.00 0.00 17.79 18.89 2dcq h ALA 91 CO 0.10 0.51 0.00 -0.85 0.00 0.00 0.00 179.25 179.02 2dcq n GLU 92 N -4.46 2.42 -0.10 0.00 0.28 -1.04 -4.07 120.64 113.67 2dcq n GLU 92 Ca 0.14 -1.92 -0.19 0.00 -0.16 0.00 0.00 57.16 55.03 2dcq n GLU 92 Cb 0.13 -1.49 -0.06 0.00 1.43 0.00 0.00 31.44 31.44 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 0.95 1.74 -0.21 -1.84 7.94 -0.54 -4.48 117.00 120.55 2dcq n LEU 93 Ca 0.18 0.30 -0.06 0.00 -1.11 0.00 0.00 56.01 55.31 2dcq n LEU 93 Cb 0.51 -0.69 0.04 0.00 0.53 0.00 0.00 43.42 43.80 2dcq n LEU 93 CO 0.13 0.17 1.13 -0.37 -1.11 0.00 0.00 177.39 177.34 2dcq h VAL 94 N -0.86 1.15 0.00 1.96 -1.51 -1.55 -1.56 116.25 113.88 2dcq h VAL 94 Ca -0.37 -0.28 0.00 0.00 -1.23 0.00 0.00 66.70 64.82 2dcq h VAL 94 Cb 1.26 0.26 0.00 0.00 -2.13 0.00 0.00 31.29 30.69 2dcq h VAL 94 CO -0.22 0.15 0.00 0.00 -1.23 0.00 0.00 177.57 176.27 2dcq n ALA 95 N -2.27 1.46 0.48 5.19 0.00 -1.26 -1.11 120.51 123.01 2dcq n ALA 95 Ca 0.04 -0.03 0.08 0.00 0.00 0.00 0.00 53.44 53.53 2dcq n ALA 95 Cb 0.02 -1.16 0.10 0.00 0.00 0.00 0.00 19.45 18.41 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 -1.50 2.59 -0.15 0.00 4.32 -0.61 -4.57 117.00 117.09 2dcq n LEU 96 Ca 0.02 -1.22 0.01 0.00 -0.02 0.00 0.00 56.01 54.81 2dcq n LEU 96 Cb 0.12 -0.07 0.02 0.00 -1.62 0.00 0.00 43.42 41.86 2dcq n LEU 96 CO 0.09 0.51 0.35 0.59 -1.22 0.00 0.00 177.39 177.71 2dcq n ASN 97 N 0.94 0.74 0.00 -1.43 3.02 -0.27 -4.99 115.26 113.28 2dcq n ASN 97 Ca 0.11 -1.79 0.00 0.00 -0.03 0.00 0.00 54.58 52.87 2dcq n ASN 97 Cb 0.43 -0.12 0.00 0.00 -0.61 0.00 0.00 39.78 39.48 2dcq n ASN 97 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2dcq n GLY 98 N -0.31 1.29 3.94 7.41 0.00 -1.12 -5.03 105.19 111.37 2dcq n GLY 98 Ca 0.02 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.80 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 -0.83 2.98 0.00 1.61 0.40 -0.83 -3.31 117.98 117.99 2dcq s PHE 99 Ca 0.00 0.35 0.00 0.00 -0.60 0.00 0.00 56.93 56.68 2dcq s PHE 99 Cb 0.00 -2.96 0.00 0.00 0.51 0.00 0.00 43.02 40.57 2dcq s PHE 99 CO 0.00 -1.12 0.18 1.17 0.70 0.00 0.00 175.22 176.16 2dcq n LYS 100 N -2.67 0.00 -3.84 0.44 3.00 -0.97 -4.42 118.16 109.69 2dcq n LYS 100 Ca 0.07 0.01 -0.11 0.00 -0.00 0.00 0.00 58.31 58.27 2dcq n LYS 100 Cb 0.60 -0.69 -0.09 0.00 0.00 0.00 0.00 35.03 34.85 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 -1.38 -0.00 0.10 3.14 0.01 -1.26 -4.76 113.70 109.55 2dcq s SER 101 Ca 0.00 -0.24 -0.10 0.00 1.31 0.00 0.00 55.95 56.93 2dcq s SER 101 Cb 0.00 0.26 0.00 0.00 0.21 0.00 0.00 66.02 66.49 2dcq s SER 101 CO 0.00 -0.47 0.23 0.00 0.41 0.00 0.00 173.24 173.41 2dcq s ALA 102 N -1.91 -0.32 0.20 1.44 0.00 -1.26 -3.45 121.76 116.45 2dcq s ALA 102 Ca -0.10 -0.55 0.02 0.00 0.00 0.00 0.00 51.96 51.33 2dcq s ALA 102 Cb -0.04 0.54 -0.05 0.00 0.00 0.00 0.00 23.12 23.57 2dcq s ALA 102 CO -0.00 -0.54 0.02 0.71 0.00 0.00 0.00 175.76 175.94 2dcq s TYR 103 N -3.86 1.33 0.28 0.00 1.51 -0.91 -4.86 117.35 110.84 2dcq s TYR 103 Ca 0.05 -1.02 0.07 0.00 -1.01 0.00 0.00 57.07 55.16 2dcq s TYR 103 Cb 0.04 -0.76 -0.06 0.00 -0.11 0.00 0.00 41.96 41.07 2dcq s TYR 103 CO -0.11 -0.20 -0.07 0.00 -1.11 0.00 0.00 175.55 174.07 2dcq s ALA 104 N -3.63 2.34 -0.23 3.71 0.00 -0.47 -1.40 121.76 122.09 2dcq s ALA 104 Ca 0.27 -1.89 -0.03 0.00 0.00 0.00 0.00 51.96 50.31 2dcq s ALA 104 Cb 0.06 0.16 0.00 0.00 0.00 0.00 0.00 23.12 23.35 2dcq s ALA 104 CO 0.06 -0.06 -0.05 -1.50 0.00 0.00 0.00 175.76 174.22 2dcq s ILE 105 N -3.00 3.19 0.72 0.00 2.07 -1.20 -3.47 121.20 119.51 2dcq s ILE 105 Ca 0.29 -0.68 -0.16 0.00 -1.41 0.00 0.00 60.65 58.70 2dcq s ILE 105 Cb 0.03 -2.50 0.02 0.00 0.13 0.00 0.00 42.46 40.15 2dcq s ILE 105 CO 0.12 0.35 1.19 1.17 -1.91 0.00 0.00 174.94 175.86 2dcq n LYS 106 N 4.76 0.67 -0.91 3.50 3.00 -1.22 -3.01 118.16 124.94 2dcq n LYS 106 Ca -0.18 0.29 0.00 0.00 -0.00 0.00 0.00 58.31 58.43 2dcq n LYS 106 Cb 0.50 -2.43 0.00 0.00 0.00 0.00 0.00 35.03 33.09 2dcq n LYS 106 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.40 177.15 2dcq n ASP 107 N -2.32 -3.61 0.00 3.14 8.00 -1.12 -4.48 116.55 116.16 2dcq n ASP 107 Ca 0.15 0.00 0.00 0.00 0.71 0.00 0.00 54.79 55.65 2dcq n ASP 107 Cb 0.49 -2.24 0.00 0.00 -0.02 0.00 0.00 41.12 39.35 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 -0.82 2.77 0.11 0.44 0.00 -1.14 -1.36 105.19 105.20 2dcq n GLY 108 Ca 0.00 0.06 -0.20 0.00 0.00 0.00 0.00 46.02 45.88 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 8.78 0.85 0.80 4.61 0.00 -0.11 -0.27 120.51 135.18 2dcq n ALA 109 Ca 0.00 -0.68 0.13 0.00 0.00 0.00 0.00 53.44 52.89 2dcq n ALA 109 Cb 0.00 -0.21 0.52 0.00 0.00 0.00 0.00 19.45 19.76 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 -4.42 0.09 -1.45 0.00 1.02 0.80 -2.05 120.64 114.63 2dcq n GLU 110 Ca -0.32 0.11 -0.31 0.00 -0.02 0.00 0.00 57.16 56.62 2dcq n GLU 110 Cb 0.65 -1.61 0.08 0.00 -0.02 0.00 0.00 31.44 30.53 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 -3.21 1.66 0.11 0.62 0.00 -0.46 -4.88 107.32 101.17 2dcq s GLY 111 Ca 0.12 0.08 0.12 0.00 0.00 0.00 0.00 44.72 45.03 2dcq s GLY 111 CO 0.51 0.43 1.37 -1.55 0.00 0.00 0.00 173.10 173.86 2dcq n PRO 112 N -3.35 0.06 -0.36 2.90 -0.04 -1.26 -1.17 135.00 131.78 2dcq n PRO 112 Ca 0.08 0.46 0.01 0.00 -0.04 0.00 0.00 63.50 64.01 2dcq n PRO 112 Cb 0.54 -1.66 0.02 0.00 -0.04 0.00 0.00 33.50 32.36 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 -1.78 0.23 0.00 0.54 5.12 -1.26 -4.83 116.66 114.68 2dcq n ARG 113 Ca 0.01 -1.12 0.00 0.00 -1.93 0.00 0.00 57.85 54.81 2dcq n ARG 113 Cb 0.08 -0.63 0.00 0.00 -1.16 0.00 0.00 32.46 30.75 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 -0.18 -1.27 0.33 -0.13 0.00 -0.32 -4.22 105.19 99.40 2dcq n GLY 114 Ca 0.02 -1.64 -0.08 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 -1.00 -0.87 -0.10 1.61 2.91 -0.57 -2.63 115.95 115.29 2dcq h TRP 115 Ca 0.00 0.05 -0.05 0.00 1.13 0.00 0.00 58.89 60.02 2dcq h TRP 115 Cb 0.00 0.43 -0.01 0.00 -0.51 0.00 0.00 29.16 29.07 2dcq h TRP 115 CO 0.00 -0.38 -0.19 -0.07 -1.03 0.00 0.00 178.44 176.77 2dcq h LEU 116 N -0.28 0.16 -1.70 0.65 3.38 -1.69 -2.17 115.31 113.66 2dcq h LEU 116 Ca 0.15 -0.04 0.00 0.00 0.09 0.00 0.00 57.88 58.09 2dcq h LEU 116 Cb 0.53 -0.04 0.00 0.00 0.09 0.00 0.00 40.66 41.24 2dcq h LEU 116 CO -0.48 0.36 0.00 0.59 0.09 0.00 0.00 178.44 179.00 2dcq n ASN 117 N -4.24 2.56 -0.73 -0.43 4.13 -1.03 -4.19 115.26 111.33 2dcq n ASN 117 Ca -0.01 -1.85 0.12 0.00 1.68 0.00 0.00 54.58 54.52 2dcq n ASN 117 Cb 0.30 -0.14 0.33 0.00 -1.54 0.00 0.00 39.78 38.73 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 0.93 2.23 -3.10 6.41 2.88 -0.82 -4.86 113.62 117.30 2dcq n SER 118 Ca 0.17 -1.76 -0.14 0.00 -1.33 0.00 0.00 58.87 55.82 2dcq n SER 118 Cb 0.48 -0.07 0.01 0.00 -0.75 0.00 0.00 64.21 63.89 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 0.72 -6.93 -4.16 -3.46 2.88 -1.26 -4.85 113.62 96.56 2dcq n SER 119 Ca 0.17 0.49 -0.15 0.00 -1.33 0.00 0.00 58.87 58.05 2dcq n SER 119 Cb 0.45 -3.41 -0.11 0.00 -0.75 0.00 0.00 64.21 60.39 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 -1.99 2.34 0.73 2.46 1.43 -1.25 -5.04 118.68 117.36 2dcq s LEU 120 Ca 0.18 -0.71 -0.13 0.00 -1.03 0.00 0.00 54.13 52.44 2dcq s LEU 120 Cb -0.03 -0.35 0.04 0.00 0.03 0.00 0.00 46.19 45.88 2dcq s LEU 120 CO 0.63 -0.20 1.12 -2.16 0.23 0.00 0.00 176.35 175.98 2dcq s PRO 121 N -2.28 2.32 0.08 1.29 0.04 -1.26 -4.91 135.00 130.28 2dcq s PRO 121 Ca 0.01 1.40 -0.07 0.00 0.04 0.00 0.00 61.00 62.37 2dcq s PRO 121 Cb -0.06 -1.89 -0.01 0.00 0.04 0.00 0.00 34.50 32.58 2dcq s PRO 121 CO 0.01 -1.62 0.15 -0.46 0.04 0.00 0.00 177.00 175.11 2dcq s TRP 122 N -2.49 0.23 -0.14 0.56 -0.11 -1.26 -3.58 118.94 112.15 2dcq s TRP 122 Ca 0.66 -0.68 0.12 0.00 1.22 0.00 0.00 56.10 57.42 2dcq s TRP 122 Cb -0.21 -0.12 -0.24 0.00 -1.50 0.00 0.00 33.47 31.40 2dcq s TRP 122 CO 0.48 -0.51 0.31 -0.89 -4.62 0.00 0.00 176.95 171.72 2dcq n ILE 123 N -0.03 1.53 -1.38 5.86 5.41 0.80 -4.46 119.36 127.10 2dcq n ILE 123 Ca -0.15 -0.78 0.17 0.00 1.00 0.00 0.00 62.75 62.99 2dcq n ILE 123 Cb 0.62 -0.92 -0.09 0.00 -0.71 0.00 0.00 39.64 38.54 2dcq n ILE 123 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 176.55 175.93 2dcq n GLU 124 N -3.00 -3.15 -0.29 0.38 1.02 -1.25 -4.90 120.64 109.45 2dcq n GLU 124 Ca -0.28 2.53 -0.09 0.00 -0.02 0.00 0.00 57.16 59.31 2dcq n GLU 124 Cb 1.09 -3.70 0.07 0.00 -0.02 0.00 0.00 31.44 28.88 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 -4.24 -1.70 -0.51 3.49 -0.04 -1.26 -4.54 135.00 126.20 2dcq n PRO 125 Ca -0.08 -0.50 0.08 0.00 -0.04 0.00 0.00 63.50 62.97 2dcq n PRO 125 Cb 0.65 -0.47 0.28 0.00 -0.04 0.00 0.00 33.50 33.92 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 -2.50 3.33 -1.80 0.54 4.01 -1.26 -5.00 118.16 115.48 2dcq n LYS 126 Ca 0.04 -2.83 0.00 0.00 -0.51 0.00 0.00 58.31 55.01 2dcq n LYS 126 Cb 0.17 -1.87 0.00 0.00 -0.51 0.00 0.00 35.03 32.82 2dcq n LYS 126 CO 0.00 0.00 0.00 0.36 -1.11 0.00 0.00 177.40 176.65 2dcq n LYS 127 N -0.11 2.16 -4.43 1.97 -0.00 -1.26 -5.17 118.16 111.32 2dcq n LYS 127 Ca 0.22 0.00 -0.21 0.00 -0.00 0.00 0.00 58.31 58.32 2dcq n LYS 127 Cb 0.91 0.00 -0.15 0.00 -0.00 0.00 0.00 35.03 35.78 2dcq n LYS 127 CO 0.00 0.00 0.00 0.95 0.00 0.00 0.00 177.40 178.35 2dcq s THR 128 N -0.82 0.84 0.00 0.58 -4.23 -1.26 -5.14 115.64 105.61 2dcq s THR 128 Ca 0.00 -0.40 0.00 0.00 -1.18 0.00 0.00 61.69 60.11 2dcq s THR 128 Cb 0.00 -0.73 0.00 0.00 1.34 0.00 0.00 72.50 73.11 2dcq s THR 128 CO 0.00 0.26 0.00 -1.54 -0.54 0.00 0.00 174.62 172.80 2dcq n SER 129 N 3.20 0.00 -2.40 3.99 3.41 -1.26 -5.09 113.62 115.47 2dcq n SER 129 Ca -0.17 -0.95 -0.11 0.00 -0.26 0.00 0.00 58.87 57.38 2dcq n SER 129 Cb 0.55 0.00 0.05 0.00 -0.26 0.00 0.00 64.21 64.55 2dcq n SER 129 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2dcq n GLY 130 N 0.00 -0.01 0.00 5.00 0.00 -1.26 -4.93 105.19 103.99 2dcq n GLY 130 Ca 0.00 -0.14 0.07 0.00 0.00 0.00 0.00 46.02 45.95 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 -2.88 0.32 0.03 1.61 -0.04 -1.26 -4.14 135.00 128.64 2dcq n PRO 131 Ca -0.14 0.08 0.00 0.00 -0.04 0.00 0.00 63.50 63.40 2dcq n PRO 131 Cb 0.59 -1.50 0.00 0.00 -0.04 0.00 0.00 33.50 32.55 2dcq n PRO 131 CO 0.00 0.00 0.00 0.45 -0.04 0.00 0.00 175.50 175.91 2dcq n SER 132 N -1.16 0.02 -4.63 3.54 2.88 -1.26 -5.05 113.62 107.97 2dcq n SER 132 Ca 0.09 0.11 -0.43 0.00 -1.33 0.00 0.00 58.87 57.31 2dcq n SER 132 Cb 0.08 0.07 -0.02 0.00 -0.75 0.00 0.00 64.21 63.59 2dcq n SER 132 CO 0.00 0.00 0.00 -0.44 -1.23 0.00 0.00 175.04 173.37 2dcq s SER 133 N -4.47 6.62 0.00 -3.46 0.01 -1.26 -5.28 113.70 105.86 2dcq s SER 133 Ca 0.00 1.16 0.00 0.00 1.31 0.00 0.00 55.95 58.42 2dcq s SER 133 Cb 0.00 -2.54 0.00 0.00 0.21 0.00 0.00 66.02 63.69 2dcq s SER 133 CO 0.00 -1.13 0.00 0.61 0.41 0.00 0.00 173.24 173.13