#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2dkg h LEU 2 N 0.00 0.00 1.27 3.17 3.38 -2.04 -3.48 115.31 117.61 2dkg h LEU 2 Ca 0.00 0.00 -0.37 0.00 0.09 0.00 0.00 57.88 57.60 2dkg h LEU 2 Cb 0.00 0.00 0.04 0.00 0.09 0.00 0.00 40.66 40.79 2dkg h LEU 2 CO 0.00 0.32 -0.53 0.61 0.09 0.00 0.00 178.44 178.93 2dkg n GLY 3 N 1.24 -0.40 3.77 0.83 0.00 -1.26 -4.96 105.19 104.41 2dkg n GLY 3 Ca -0.02 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.61 2dkg n GLY 3 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2dkg s LEU 4 N -5.88 4.24 -0.07 0.99 1.43 -1.26 -4.93 118.68 113.20 2dkg s LEU 4 Ca 0.21 2.79 0.11 0.00 -1.03 0.00 0.00 54.13 56.21 2dkg s LEU 4 Cb -0.09 -3.83 0.25 0.00 0.03 0.00 0.00 46.19 42.55 2dkg s LEU 4 CO 0.26 -0.89 1.18 0.29 0.23 0.00 0.00 176.35 177.42 2dkg n LYS 5 N 0.21 2.53 -1.40 1.70 4.76 -1.26 -5.04 118.16 119.65 2dkg n LYS 5 Ca 0.03 -2.17 -0.32 0.00 -2.87 0.00 0.00 58.31 52.98 2dkg n LYS 5 Cb 0.42 -1.36 0.08 0.00 -1.84 0.00 0.00 35.03 32.33 2dkg n LYS 5 CO 0.00 0.00 0.00 0.95 -1.37 0.00 0.00 177.40 176.98 2dkg s THR 6 N -1.84 3.24 -0.08 -0.18 -4.23 -1.26 -5.00 115.64 106.30 2dkg s THR 6 Ca 0.22 0.46 -0.20 0.00 -1.18 0.00 0.00 61.69 60.99 2dkg s THR 6 Cb 0.17 -2.94 -0.29 0.00 1.34 0.00 0.00 72.50 70.77 2dkg s THR 6 CO 0.06 -0.47 0.75 0.28 -0.54 0.00 0.00 174.62 174.70 2dkg h SER 7 N -0.77 0.40 0.00 3.99 0.02 -1.96 -3.46 113.55 111.77 2dkg h SER 7 Ca -0.45 -0.91 0.00 0.00 -0.84 0.00 0.00 61.79 59.60 2dkg h SER 7 Cb 1.24 -0.13 0.00 0.00 0.14 0.00 0.00 62.40 63.65 2dkg h SER 7 CO 0.52 1.45 0.00 -0.38 -1.14 0.00 0.00 176.83 177.28 2dkg n ILE 8 N -4.09 0.59 -1.96 3.27 5.41 -1.26 -4.87 119.36 116.45 2dkg n ILE 8 Ca -0.18 0.20 -0.43 0.00 1.00 0.00 0.00 62.75 63.34 2dkg n ILE 8 Cb 0.83 -1.16 -0.03 0.00 -0.71 0.00 0.00 39.64 38.57 2dkg n ILE 8 CO 0.00 0.00 0.00 -0.63 0.00 0.00 0.00 176.55 175.92 2dkg s ILE 9 N -1.57 3.46 0.00 1.39 1.01 -1.26 -2.01 121.20 122.21 2dkg s ILE 9 Ca 0.00 0.50 0.00 0.00 0.00 0.00 0.00 60.65 61.15 2dkg s ILE 9 Cb 0.00 -3.51 0.00 0.00 0.01 0.00 0.00 42.46 38.96 2dkg s ILE 9 CO 0.00 -0.26 0.00 0.61 0.00 0.00 0.00 174.94 175.29 2dkg n GLY 10 N 5.05 1.14 0.25 6.18 0.00 0.96 -4.73 105.19 114.03 2dkg n GLY 10 Ca 0.22 0.00 0.05 0.00 0.00 0.00 0.00 46.02 46.29 2dkg n GLY 10 CO 0.00 0.00 0.00 3.21 0.00 0.00 0.00 173.32 176.53 2dkg h ARG 11 N 2.01 0.12 -3.71 1.61 2.47 -1.47 -3.42 114.38 111.99 2dkg h ARG 11 Ca 0.00 -0.02 -0.16 0.00 -1.26 0.00 0.00 59.98 58.54 2dkg h ARG 11 Cb 0.00 -0.02 -0.21 0.00 -1.65 0.00 0.00 29.97 28.09 2dkg h ARG 11 CO 0.00 0.20 -0.59 1.03 0.56 0.00 0.00 179.97 181.17 2dkg s ARG 12 N -4.88 0.38 -0.02 0.04 0.52 -1.26 -5.06 118.95 108.67 2dkg s ARG 12 Ca -0.05 -0.45 0.00 0.00 -0.52 0.00 0.00 55.73 54.71 2dkg s ARG 12 Cb 0.16 0.15 0.03 0.00 0.52 0.00 0.00 34.95 35.81 2dkg s ARG 12 CO 0.70 -0.08 0.01 0.08 0.02 0.00 0.00 175.30 176.03 2dkg s VAL 13 N -1.31 0.08 -0.27 3.52 1.01 -1.26 -1.38 120.40 120.79 2dkg s VAL 13 Ca -0.14 0.13 -0.03 0.00 0.00 0.00 0.00 61.98 61.94 2dkg s VAL 13 Cb -0.08 -0.19 0.03 0.00 0.00 0.00 0.00 36.38 36.14 2dkg s VAL 13 CO 0.00 0.12 -0.01 -0.63 0.00 0.00 0.00 175.10 174.58 2dkg s ILE 14 N 1.01 3.14 -0.11 2.22 1.01 0.85 -4.95 121.20 124.36 2dkg s ILE 14 Ca -0.09 -1.07 -0.06 0.00 0.00 0.00 0.00 60.65 59.43 2dkg s ILE 14 Cb -0.13 -2.66 -0.04 0.00 0.01 0.00 0.00 42.46 39.64 2dkg s ILE 14 CO -0.02 0.08 0.10 -0.47 0.00 0.00 0.00 174.94 174.63 2dkg s TYR 15 N 1.34 3.48 -0.04 3.97 6.14 -1.26 -1.36 117.35 129.63 2dkg s TYR 15 Ca -0.01 0.44 0.04 0.00 0.64 0.00 0.00 57.07 58.18 2dkg s TYR 15 Cb -0.18 -1.91 -0.00 0.00 0.42 0.00 0.00 41.96 40.30 2dkg s TYR 15 CO -0.02 0.66 -0.16 -0.06 0.64 0.00 0.00 175.55 176.61 2dkg s PHE 16 N -0.96 1.64 0.28 4.97 0.40 -0.11 -4.98 117.98 119.21 2dkg s PHE 16 Ca 0.14 -0.48 -0.01 0.00 -0.60 0.00 0.00 56.93 55.98 2dkg s PHE 16 Cb -0.12 -1.11 0.39 0.00 0.51 0.00 0.00 43.02 42.69 2dkg s PHE 16 CO 0.03 -0.17 1.82 1.96 0.70 0.00 0.00 175.22 179.57 2dkg h GLN 17 N 6.31 0.84 -2.95 0.44 4.20 -1.93 -1.40 115.11 120.62 2dkg h GLN 17 Ca -0.32 -0.17 -0.10 0.00 0.06 0.00 0.00 58.65 58.12 2dkg h GLN 17 Cb 1.17 -0.13 -0.18 0.00 0.30 0.00 0.00 27.48 28.64 2dkg h GLN 17 CO 0.48 0.76 -0.17 -2.00 -0.67 0.00 0.00 178.83 177.23 2dkg s GLU 18 N -5.23 0.81 0.20 1.46 2.12 -1.26 -3.34 118.70 113.46 2dkg s GLU 18 Ca -0.10 -0.24 -0.20 0.00 0.36 0.00 0.00 54.97 54.79 2dkg s GLU 18 Cb 0.15 0.36 0.04 0.00 0.26 0.00 0.00 34.13 34.95 2dkg s GLU 18 CO 0.80 -0.25 0.60 -1.50 -0.54 0.00 0.00 175.26 174.37 2dkg s ILE 19 N -1.83 0.01 -0.03 -3.70 2.07 -0.95 -4.99 121.20 111.78 2dkg s ILE 19 Ca -0.10 -0.57 -0.21 0.00 -1.41 0.00 0.00 60.65 58.36 2dkg s ILE 19 Cb -0.03 -1.49 -0.15 0.00 0.13 0.00 0.00 42.46 40.93 2dkg s ILE 19 CO 0.02 -0.05 0.94 0.00 -1.91 0.00 0.00 174.94 173.94 2dkg h THR 20 N 2.08 0.62 -1.72 4.00 1.03 -1.94 -0.60 112.91 116.38 2dkg h THR 20 Ca -0.28 -0.85 0.08 0.00 -0.01 0.00 0.00 66.41 65.35 2dkg h THR 20 Cb 1.27 0.99 -0.23 0.00 -1.07 0.00 0.00 68.15 69.11 2dkg h THR 20 CO 0.34 0.14 0.15 -0.55 -0.01 0.00 0.00 175.52 175.59 2dkg s SER 21 N -5.23 -0.78 0.35 0.00 0.15 -1.26 -0.29 113.70 106.65 2dkg s SER 21 Ca -0.12 1.20 0.05 0.00 0.70 0.00 0.00 55.95 57.78 2dkg s SER 21 Cb 0.01 1.48 0.67 0.00 -1.71 0.00 0.00 66.02 66.47 2dkg s SER 21 CO 0.45 -0.18 1.91 0.71 1.20 0.00 0.00 173.24 177.33 2dkg h THR 22 N 5.20 1.18 -0.61 6.45 1.35 -1.92 -1.38 112.91 123.18 2dkg h THR 22 Ca -0.26 -0.68 -0.09 0.00 -0.55 0.00 0.00 66.41 64.83 2dkg h THR 22 Cb 1.19 0.89 -0.02 0.00 -1.73 0.00 0.00 68.15 68.48 2dkg h THR 22 CO 0.16 0.24 0.02 0.78 -0.25 0.00 0.00 175.52 176.46 2dkg h ASN 23 N 0.48 1.04 -0.27 5.36 4.21 -1.93 -0.41 115.58 124.06 2dkg h ASN 23 Ca 0.11 -0.30 -0.05 0.00 1.21 0.00 0.00 56.30 57.27 2dkg h ASN 23 Cb 0.26 -0.28 -0.01 0.00 -1.12 0.00 0.00 38.32 37.18 2dkg h ASN 23 CO 0.00 1.08 -0.02 -0.33 -1.29 0.00 0.00 177.43 176.87 2dkg h GLU 24 N 0.96 0.49 -0.74 0.81 4.39 -1.86 -1.86 114.58 116.77 2dkg h GLU 24 Ca 0.17 -0.17 -0.03 0.00 0.34 0.00 0.00 59.36 59.68 2dkg h GLU 24 Cb 0.54 -0.04 -0.03 0.00 -0.10 0.00 0.00 28.75 29.12 2dkg h GLU 24 CO 0.03 0.67 0.35 0.35 -1.16 0.00 0.00 179.01 179.25 2dkg h PHE 25 N 0.26 1.08 -0.33 4.33 3.57 -1.14 -1.22 116.94 123.49 2dkg h PHE 25 Ca 0.07 -0.06 -0.11 0.00 3.53 0.00 0.00 57.97 61.41 2dkg h PHE 25 Cb 0.46 -0.33 -0.01 0.00 2.79 0.00 0.00 35.95 38.86 2dkg h PHE 25 CO 0.04 0.80 -0.25 0.00 -2.23 0.00 0.00 178.31 176.67 2dkg h ALA 26 N 1.17 0.96 -0.22 2.41 0.00 -1.03 -0.66 119.26 121.90 2dkg h ALA 26 Ca 0.25 -0.37 -0.19 0.00 0.00 0.00 0.00 54.91 54.61 2dkg h ALA 26 Cb 0.13 -0.14 0.00 0.00 0.00 0.00 0.00 17.79 17.79 2dkg h ALA 26 CO -0.03 0.61 -0.60 0.87 0.00 0.00 0.00 179.25 180.09 2dkg h LYS 27 N 0.57 0.79 -0.04 0.00 1.57 -1.09 -3.36 116.57 115.01 2dkg h LYS 27 Ca 0.08 -0.56 -0.17 0.00 -1.87 0.00 0.00 60.65 58.13 2dkg h LYS 27 Cb 0.73 0.09 0.01 0.00 0.08 0.00 0.00 32.23 33.14 2dkg h LYS 27 CO 0.06 1.18 -0.62 1.15 -0.57 0.00 0.00 179.45 180.65 2dkg h THR 28 N 0.53 1.38 -4.17 -0.16 2.02 -1.15 -3.47 112.91 107.90 2dkg h THR 28 Ca -0.01 -2.00 -0.47 0.00 0.77 0.00 0.00 66.41 64.70 2dkg h THR 28 Cb 1.22 2.40 0.02 0.00 -1.74 0.00 0.00 68.15 70.05 2dkg h THR 28 CO 0.13 0.59 0.37 -0.44 0.37 0.00 0.00 175.52 176.54 2dkg s SER 29 N -6.79 6.57 -0.47 4.18 0.01 -0.26 -5.00 113.70 111.94 2dkg s SER 29 Ca -0.13 1.64 -0.28 0.00 1.31 0.00 0.00 55.95 58.49 2dkg s SER 29 Cb 0.05 -2.52 0.03 0.00 0.21 0.00 0.00 66.02 63.79 2dkg s SER 29 CO 0.84 -0.62 1.08 -0.31 0.41 0.00 0.00 173.24 174.63 2dkg s TYR 30 N -2.50 2.84 0.04 2.43 2.02 -1.26 -4.90 117.35 116.02 2dkg s TYR 30 Ca 0.60 0.62 0.03 0.00 -0.37 0.00 0.00 57.07 57.95 2dkg s TYR 30 Cb -0.11 -4.31 -0.02 0.00 -0.40 0.00 0.00 41.96 37.12 2dkg s TYR 30 CO 0.28 -1.22 -0.09 -0.51 -1.57 0.00 0.00 175.55 172.43 2dkg s LEU 31 N 4.26 2.23 0.47 -1.29 1.43 -1.26 -5.15 118.68 119.36 2dkg s LEU 31 Ca 0.45 -0.51 -0.17 0.00 -1.03 0.00 0.00 54.13 52.87 2dkg s LEU 31 Cb -0.08 -0.29 -0.09 0.00 0.03 0.00 0.00 46.19 45.77 2dkg s LEU 31 CO 0.30 -0.13 0.93 -1.61 0.23 0.00 0.00 176.35 176.07 2dkg s GLU 32 N -1.43 4.00 0.42 1.70 0.41 -1.26 -5.00 118.70 117.54 2dkg s GLU 32 Ca -0.06 0.91 -0.25 0.00 -0.41 0.00 0.00 54.97 55.16 2dkg s GLU 32 Cb -0.09 -2.20 -0.10 0.00 -1.78 0.00 0.00 34.13 29.96 2dkg s GLU 32 CO 0.01 -0.15 1.30 -1.91 -0.49 0.00 0.00 175.26 174.01 2dkg n GLU 33 N -1.23 1.99 0.00 1.61 2.13 -1.26 -2.10 120.64 121.77 2dkg n GLU 33 Ca 0.06 0.71 0.00 0.00 0.66 0.00 0.00 57.16 58.59 2dkg n GLU 33 Cb 0.54 -2.42 0.00 0.00 0.27 0.00 0.00 31.44 29.83 2dkg n GLU 33 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 2dkg n GLY 34 N 0.77 2.32 3.72 8.31 0.00 0.13 -4.90 105.19 115.55 2dkg n GLY 34 Ca 0.06 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.67 2dkg n GLY 34 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2dkg s THR 35 N -2.29 3.15 -0.17 2.61 2.01 -0.89 -0.03 115.64 120.03 2dkg s THR 35 Ca 0.00 0.87 -0.06 0.00 0.31 0.00 0.00 61.69 62.81 2dkg s THR 35 Cb 0.00 -3.56 -0.04 0.00 0.01 0.00 0.00 72.50 68.92 2dkg s THR 35 CO 0.00 0.09 0.03 -0.69 -0.69 0.00 0.00 174.62 173.36 2dkg s VAL 36 N 0.75 4.48 -0.25 3.82 1.01 -0.48 -1.70 120.40 128.03 2dkg s VAL 36 Ca 0.63 -0.15 -0.06 0.00 0.00 0.00 0.00 61.98 62.39 2dkg s VAL 36 Cb -0.38 -2.99 -0.02 0.00 0.00 0.00 0.00 36.38 32.99 2dkg s VAL 36 CO 0.33 0.48 0.04 -0.63 0.00 0.00 0.00 175.10 175.32 2dkg s ILE 37 N 0.30 3.98 0.01 2.22 -1.09 0.14 -0.11 121.20 126.65 2dkg s ILE 37 Ca 0.01 -0.34 0.02 0.00 -2.23 0.00 0.00 60.65 58.11 2dkg s ILE 37 Cb -0.13 -2.87 -0.01 0.00 -1.58 0.00 0.00 42.46 37.87 2dkg s ILE 37 CO 0.01 0.33 -0.07 0.54 -1.23 0.00 0.00 174.94 174.52 2dkg s VAL 38 N 1.56 0.56 0.03 2.92 0.11 -0.46 0.33 120.40 125.44 2dkg s VAL 38 Ca 0.06 -0.46 0.02 0.00 -2.93 0.00 0.00 61.98 58.67 2dkg s VAL 38 Cb -0.15 -0.50 -0.02 0.00 -1.53 0.00 0.00 36.38 34.18 2dkg s VAL 38 CO 0.01 0.05 -0.06 0.00 -3.33 0.00 0.00 175.10 171.77 2dkg s ALA 39 N -0.40 0.43 0.28 1.54 0.00 -0.83 -0.93 121.76 121.86 2dkg s ALA 39 Ca 0.00 -0.56 -0.01 0.00 0.00 0.00 0.00 51.96 51.39 2dkg s ALA 39 Cb -0.04 0.02 0.41 0.00 0.00 0.00 0.00 23.12 23.52 2dkg s ALA 39 CO -0.00 -0.01 1.82 -0.44 0.00 0.00 0.00 175.76 177.13 2dkg h ASP 40 N 4.98 0.74 -5.01 0.00 3.32 -1.27 -3.37 116.42 115.82 2dkg h ASP 40 Ca -0.33 -0.14 -0.08 0.00 0.02 0.00 0.00 57.03 56.51 2dkg h ASP 40 Cb 1.20 -0.19 -0.18 0.00 0.22 0.00 0.00 39.33 40.37 2dkg h ASP 40 CO 0.44 0.75 -0.03 -1.59 -1.72 0.00 0.00 179.24 177.08 2dkg s LYS 41 N -5.16 0.91 -0.01 3.56 -2.85 -1.21 -3.90 119.74 111.08 2dkg s LYS 41 Ca -0.09 -0.09 0.06 0.00 -1.00 0.00 0.00 55.97 54.85 2dkg s LYS 41 Cb 0.15 0.42 -0.03 0.00 -2.06 0.00 0.00 37.83 36.31 2dkg s LYS 41 CO 0.80 -0.29 -0.19 -0.65 0.10 0.00 0.00 175.35 175.12 2dkg s GLN 42 N -1.72 2.25 -0.02 1.78 -0.21 -0.93 -2.25 119.66 118.57 2dkg s GLN 42 Ca -0.10 -0.86 0.18 0.00 0.02 0.00 0.00 55.36 54.61 2dkg s GLN 42 Cb -0.02 -2.23 -0.20 0.00 1.00 0.00 0.00 33.01 31.56 2dkg s GLN 42 CO 0.04 0.58 0.57 0.25 -2.12 0.00 0.00 175.29 174.61 2dkg n THR 43 N 2.06 0.96 -2.56 -0.19 -2.24 -0.23 -4.43 114.28 107.65 2dkg n THR 43 Ca -0.17 -0.69 -0.17 0.00 -2.27 0.00 0.00 64.05 60.76 2dkg n THR 43 Cb 0.52 -0.50 0.02 0.00 -2.10 0.00 0.00 70.33 68.27 2dkg n THR 43 CO 0.00 0.00 0.00 0.23 -0.57 0.00 0.00 175.07 174.73 2dkg n MET 44 N -2.71 2.26 -2.18 -0.78 2.81 0.60 -5.04 117.12 112.08 2dkg n MET 44 Ca -0.14 -3.83 -0.38 0.00 -1.81 0.00 0.00 57.70 51.54 2dkg n MET 44 Cb 0.85 -1.74 -0.01 0.00 -0.71 0.00 0.00 33.22 31.61 2dkg n MET 44 CO 0.00 0.00 0.00 0.20 1.51 0.00 0.00 175.97 177.68 2dkg s GLY 45 N -3.37 2.86 0.09 3.03 0.00 -1.18 -4.52 107.32 104.23 2dkg s GLY 45 Ca 0.37 1.05 0.01 0.00 0.00 0.00 0.00 44.72 46.15 2dkg s GLY 45 CO -0.06 1.57 -0.04 -2.38 0.00 0.00 0.00 173.10 172.19 2dkg s HIS 46 N -1.40 0.79 0.00 1.90 -3.43 -1.26 -1.21 115.29 110.67 2dkg s HIS 46 Ca 0.60 -0.99 0.00 0.00 -0.80 0.00 0.00 55.06 53.87 2dkg s HIS 46 Cb -0.33 -0.48 0.00 0.00 -1.43 0.00 0.00 32.58 30.34 2dkg s HIS 46 CO 0.41 -0.24 0.00 0.41 -2.00 0.00 0.00 174.74 173.31 2dkg n GLY 47 N -0.01 3.69 3.89 -1.38 0.00 0.65 -4.63 105.19 107.41 2dkg n GLY 47 Ca -0.12 -1.79 -0.30 0.00 0.00 0.00 0.00 46.02 43.82 2dkg n GLY 47 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2dkg s ARG 48 N 3.61 0.68 -0.56 1.61 0.52 -1.26 -4.30 118.95 119.26 2dkg s ARG 48 Ca 0.00 -0.28 -0.01 0.00 -0.52 0.00 0.00 55.73 54.92 2dkg s ARG 48 Cb 0.00 -1.84 0.01 0.00 0.52 0.00 0.00 34.95 33.64 2dkg s ARG 48 CO 0.00 -2.41 0.02 1.28 0.02 0.00 0.00 175.30 174.22 2dkg n LEU 49 N -3.79 -0.33 -2.06 2.53 7.99 -1.26 0.81 117.00 120.89 2dkg n LEU 49 Ca 0.14 -0.45 -0.18 0.00 -0.01 0.00 0.00 56.01 55.51 2dkg n LEU 49 Cb 0.60 -0.56 -0.01 0.00 -0.11 0.00 0.00 43.42 43.34 2dkg n LEU 49 CO 0.48 0.15 -0.21 0.59 -1.51 0.00 0.00 177.39 176.89 2dkg n ASN 50 N -0.77 -5.18 -4.89 -1.43 3.02 -1.26 -5.00 115.26 99.76 2dkg n ASN 50 Ca -0.10 -0.03 -0.30 0.00 -0.03 0.00 0.00 54.58 54.12 2dkg n ASN 50 Cb 0.24 -4.24 -0.04 0.00 -0.61 0.00 0.00 39.78 35.13 2dkg n ASN 50 CO 0.00 0.00 0.00 -0.13 -2.62 0.00 0.00 177.26 174.51 2dkg s ARG 51 N -4.93 3.73 0.20 3.52 0.52 0.24 -4.95 118.95 117.28 2dkg s ARG 51 Ca 0.02 0.24 -0.13 0.00 -0.52 0.00 0.00 55.73 55.35 2dkg s ARG 51 Cb -0.01 -2.54 -0.07 0.00 0.52 0.00 0.00 34.95 32.85 2dkg s ARG 51 CO 0.02 0.14 0.57 0.21 0.02 0.00 0.00 175.30 176.26 2dkg s LYS 52 N -3.52 3.92 -0.20 3.54 2.20 -1.26 -0.25 119.74 124.16 2dkg s LYS 52 Ca 0.48 0.43 0.00 0.00 -0.36 0.00 0.00 55.97 56.52 2dkg s LYS 52 Cb -0.11 -2.76 0.04 0.00 -1.51 0.00 0.00 37.83 33.50 2dkg s LYS 52 CO 0.28 0.37 -0.08 -0.46 -0.36 0.00 0.00 175.35 175.11 2dkg s TRP 53 N -1.67 2.23 0.12 4.03 -0.11 -0.35 -4.49 118.94 118.69 2dkg s TRP 53 Ca 0.44 -1.48 -0.31 0.00 1.22 0.00 0.00 56.10 55.96 2dkg s TRP 53 Cb -0.13 -1.55 -0.09 0.00 -1.50 0.00 0.00 33.47 30.20 2dkg s TRP 53 CO 0.20 -0.72 1.65 -1.21 -4.62 0.00 0.00 176.95 172.26 2dkg s GLU 54 N 1.46 4.19 -0.44 5.86 0.41 -1.26 -4.09 118.70 124.83 2dkg s GLU 54 Ca -0.01 2.39 0.10 0.00 -0.41 0.00 0.00 54.97 57.04 2dkg s GLU 54 Cb -0.16 -3.42 0.37 0.00 -1.78 0.00 0.00 34.13 29.13 2dkg s GLU 54 CO -0.08 -0.71 0.87 0.43 -0.49 0.00 0.00 175.26 175.28 2dkg n SER 55 N 4.99 2.50 -4.79 -0.19 7.64 -1.26 -5.06 113.62 117.45 2dkg n SER 55 Ca 0.15 -3.27 -0.30 0.00 1.01 0.00 0.00 58.87 56.47 2dkg n SER 55 Cb 0.39 -0.57 0.10 0.00 -1.01 0.00 0.00 64.21 63.12 2dkg n SER 55 CO 0.00 0.00 0.00 -2.16 -3.01 0.00 0.00 175.04 169.87 2dkg s PRO 56 N -2.98 1.81 0.34 1.43 0.04 -1.26 -2.19 135.00 132.20 2dkg s PRO 56 Ca 0.42 0.57 -0.29 0.00 0.04 0.00 0.00 61.00 61.75 2dkg s PRO 56 Cb 0.35 -1.89 -0.11 0.00 0.04 0.00 0.00 34.50 32.88 2dkg s PRO 56 CO -0.10 -1.80 1.51 -1.21 0.04 0.00 0.00 177.00 175.45 2dkg s GLU 57 N -5.17 4.13 0.00 4.56 2.02 -1.25 -3.27 118.70 119.72 2dkg s GLU 57 Ca 0.62 2.55 0.00 0.00 0.02 0.00 0.00 54.97 58.15 2dkg s GLU 57 Cb -0.15 -3.00 0.00 0.00 0.10 0.00 0.00 34.13 31.09 2dkg s GLU 57 CO 0.54 -0.54 0.00 0.41 0.02 0.00 0.00 175.26 175.69 2dkg n GLY 58 N 1.10 2.14 3.98 -1.39 0.00 -1.26 -4.18 105.19 105.57 2dkg n GLY 58 Ca 0.03 0.00 -0.20 0.00 0.00 0.00 0.00 46.02 45.86 2dkg n GLY 58 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2dkg s GLY 59 N -2.04 1.97 -0.37 -0.02 0.00 -1.20 -0.01 107.32 105.64 2dkg s GLY 59 Ca 0.00 -1.83 -0.06 0.00 0.00 0.00 0.00 44.72 42.83 2dkg s GLY 59 CO 0.00 -1.66 0.16 -2.27 0.00 0.00 0.00 173.10 169.33 2dkg s LEU 60 N -4.41 4.69 -0.31 0.66 2.96 0.09 -4.88 118.68 117.47 2dkg s LEU 60 Ca 0.53 -1.40 -0.00 0.00 -0.22 0.00 0.00 54.13 53.04 2dkg s LEU 60 Cb -0.06 -1.89 0.06 0.00 0.50 0.00 0.00 46.19 44.81 2dkg s LEU 60 CO 0.33 -0.42 0.00 0.26 -1.32 0.00 0.00 176.35 175.20 2dkg s TRP 61 N 1.36 3.35 0.09 5.38 0.23 -1.26 -0.91 118.94 127.18 2dkg s TRP 61 Ca 0.01 -2.13 -0.06 0.00 -2.03 0.00 0.00 56.10 51.89 2dkg s TRP 61 Cb -0.21 -2.27 -0.02 0.00 0.03 0.00 0.00 33.47 31.00 2dkg s TRP 61 CO 0.01 -0.85 0.12 -0.48 0.96 0.00 0.00 176.95 176.71 2dkg s LEU 62 N 1.18 1.72 0.01 2.99 0.05 -0.76 -1.96 118.68 121.92 2dkg s LEU 62 Ca -0.03 -0.84 0.02 0.00 0.05 0.00 0.00 54.13 53.33 2dkg s LEU 62 Cb -0.20 0.73 -0.01 0.00 -2.05 0.00 0.00 46.19 44.66 2dkg s LEU 62 CO -0.03 -0.71 -0.07 -0.44 -0.55 0.00 0.00 176.35 174.55 2dkg s SER 63 N -2.91 0.80 -0.09 1.48 0.01 0.15 -0.89 113.70 112.24 2dkg s SER 63 Ca 0.09 -0.28 0.03 0.00 1.31 0.00 0.00 55.95 57.10 2dkg s SER 63 Cb 0.06 -0.04 0.01 0.00 0.21 0.00 0.00 66.02 66.26 2dkg s SER 63 CO -0.08 -0.02 -0.19 -0.63 0.41 0.00 0.00 173.24 172.73 2dkg s ILE 64 N -0.60 1.67 -0.10 1.44 1.01 0.05 0.27 121.20 124.95 2dkg s ILE 64 Ca -0.02 -0.79 -0.23 0.00 0.00 0.00 0.00 60.65 59.62 2dkg s ILE 64 Cb -0.05 -1.47 -0.03 0.00 0.01 0.00 0.00 42.46 40.91 2dkg s ILE 64 CO 0.00 0.47 0.69 -0.69 0.00 0.00 0.00 174.94 175.42 2dkg s VAL 65 N 0.55 5.03 0.13 2.92 1.01 -0.69 -0.68 120.40 128.66 2dkg s VAL 65 Ca -0.15 1.41 0.04 0.00 0.00 0.00 0.00 61.98 63.27 2dkg s VAL 65 Cb -0.17 -4.03 -0.04 0.00 0.00 0.00 0.00 36.38 32.14 2dkg s VAL 65 CO 0.05 0.21 -0.09 -0.76 0.00 0.00 0.00 175.10 174.51 2dkg s LEU 66 N 1.11 2.50 -0.39 3.92 1.43 0.53 0.20 118.68 127.99 2dkg s LEU 66 Ca 0.36 -0.96 0.11 0.00 -1.03 0.00 0.00 54.13 52.60 2dkg s LEU 66 Cb -0.17 -0.29 0.33 0.00 0.03 0.00 0.00 46.19 46.10 2dkg s LEU 66 CO 0.16 -0.34 0.76 -0.24 0.23 0.00 0.00 176.35 176.92 2dkg n SER 67 N 0.02 0.27 -4.69 2.29 2.88 -1.26 -0.91 113.62 112.22 2dkg n SER 67 Ca -0.12 -3.08 -0.53 0.00 -1.33 0.00 0.00 58.87 53.82 2dkg n SER 67 Cb 0.60 -0.24 -0.06 0.00 -0.75 0.00 0.00 64.21 63.76 2dkg n SER 67 CO 0.00 0.00 0.00 -0.81 -1.23 0.00 0.00 175.04 173.00 2dkg n PRO 68 N 0.43 1.67 -2.53 -1.46 -0.04 -1.26 -4.88 135.00 126.93 2dkg n PRO 68 Ca 0.22 0.61 -0.42 0.00 -0.04 0.00 0.00 63.50 63.87 2dkg n PRO 68 Cb 0.65 -2.39 0.01 0.00 -0.04 0.00 0.00 33.50 31.73 2dkg n PRO 68 CO 0.00 0.00 0.00 1.63 -0.04 0.00 0.00 175.50 177.09 2dkg n LYS 69 N 6.13 4.09 -4.18 0.54 4.76 -1.26 -4.91 118.16 123.33 2dkg n LYS 69 Ca 0.25 -3.91 -0.11 0.00 -2.87 0.00 0.00 58.31 51.67 2dkg n LYS 69 Cb 0.22 -2.74 -0.10 0.00 -1.84 0.00 0.00 35.03 30.57 2dkg n LYS 69 CO 0.00 0.00 0.00 0.14 -1.37 0.00 0.00 177.40 176.17 2dkg s VAL 70 N -1.04 0.52 0.55 -0.18 -7.23 -1.26 -5.01 120.40 106.75 2dkg s VAL 70 Ca 0.38 -1.93 -0.21 0.00 -1.81 0.00 0.00 61.98 58.41 2dkg s VAL 70 Cb 0.09 -1.90 -0.05 0.00 0.56 0.00 0.00 36.38 35.08 2dkg s VAL 70 CO 0.02 -0.66 1.21 -2.65 -0.31 0.00 0.00 175.10 172.72 2dkg n PRO 71 N -0.11 1.41 0.14 4.82 -0.02 -1.26 -4.84 135.00 135.14 2dkg n PRO 71 Ca -0.09 0.52 0.19 0.00 -2.02 0.00 0.00 63.50 62.11 2dkg n PRO 71 Cb 0.62 -2.40 0.76 0.00 -0.02 0.00 0.00 33.50 32.46 2dkg n PRO 71 CO 0.00 0.00 0.00 0.37 1.98 0.00 0.00 175.50 177.85 2dkg h GLN 72 N 1.15 0.00 0.00 -0.52 4.15 -2.00 -0.88 115.11 117.01 2dkg h GLN 72 Ca -0.49 0.00 -0.06 0.00 0.77 0.00 0.00 58.65 58.87 2dkg h GLN 72 Cb 1.33 0.00 -0.01 0.00 0.21 0.00 0.00 27.48 29.01 2dkg h GLN 72 CO 0.55 0.00 -0.28 0.87 -1.93 0.00 0.00 178.83 178.04 2dkg h LYS 73 N 0.00 0.00 0.00 1.69 6.56 -2.05 -3.07 116.57 119.70 2dkg h LYS 73 Ca 0.15 0.00 0.00 0.00 -1.06 0.00 0.00 60.65 59.74 2dkg h LYS 73 Cb 0.96 0.00 0.00 0.00 -0.57 0.00 0.00 32.23 32.62 2dkg h LYS 73 CO -0.00 0.28 -0.59 -0.44 -2.06 0.00 0.00 179.45 176.64 2dkg h ASP 74 N 0.00 0.00 -1.02 0.86 3.32 -1.50 -3.38 116.42 114.70 2dkg h ASP 74 Ca -0.00 -0.10 0.25 0.00 0.02 0.00 0.00 57.03 57.20 2dkg h ASP 74 Cb 0.59 0.00 -0.11 0.00 0.22 0.00 0.00 39.33 40.03 2dkg h ASP 74 CO 0.04 0.05 0.63 -0.07 -1.72 0.00 0.00 179.24 178.17 2dkg h LEU 75 N 0.00 0.58 -2.83 1.55 -0.00 -1.61 0.08 115.31 113.07 2dkg h LEU 75 Ca 0.00 0.11 0.00 0.00 -0.00 0.00 0.00 57.88 57.99 2dkg h LEU 75 Cb 0.86 0.01 0.00 0.00 -0.00 0.00 0.00 40.66 41.53 2dkg h LEU 75 CO 0.00 0.11 0.00 -0.65 -0.00 0.00 0.00 178.44 177.90 2dkg h PRO 76 N 0.51 0.00 0.00 1.13 0.11 -1.80 -1.59 132.00 130.36 2dkg h PRO 76 Ca 0.61 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.72 2dkg h PRO 76 Cb 1.32 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.43 2dkg h PRO 76 CO -0.38 0.00 0.00 1.63 -0.21 0.00 0.00 178.00 179.04 2dkg n LYS 77 N -3.01 0.19 -0.20 1.05 5.02 0.02 -3.64 118.16 117.58 2dkg n LYS 77 Ca -0.03 0.28 0.11 0.00 -2.02 0.00 0.00 58.31 56.65 2dkg n LYS 77 Cb 0.07 -1.78 0.41 0.00 -0.02 0.00 0.00 35.03 33.71 2dkg n LYS 77 CO 0.00 0.00 0.00 0.82 -0.52 0.00 0.00 177.40 177.70 2dkg h ILE 78 N 0.00 0.90 -0.25 -0.18 1.08 -1.43 -0.23 117.51 117.41 2dkg h ILE 78 Ca 0.00 -0.22 -0.03 0.00 -0.39 0.00 0.00 64.86 64.23 2dkg h ILE 78 Cb 0.53 0.21 -0.01 0.00 -3.07 0.00 0.00 36.82 34.48 2dkg h ILE 78 CO 0.00 0.11 0.04 1.62 -0.69 0.00 0.00 178.15 179.23 2dkg h VAL 79 N 0.63 1.13 -0.18 1.67 3.04 -1.80 -2.02 116.25 118.72 2dkg h VAL 79 Ca 0.37 -0.48 -0.11 0.00 -1.01 0.00 0.00 66.70 65.47 2dkg h VAL 79 Cb 0.57 0.91 -0.01 0.00 -2.01 0.00 0.00 31.29 30.74 2dkg h VAL 79 CO -0.14 0.17 -0.36 -0.26 -1.01 0.00 0.00 177.57 175.97 2dkg h PHE 80 N 0.35 0.45 -0.39 3.17 0.04 -1.27 -2.39 116.94 116.90 2dkg h PHE 80 Ca 0.08 -0.11 0.03 0.00 2.80 0.00 0.00 57.97 60.77 2dkg h PHE 80 Cb 0.17 -0.10 -0.03 0.00 2.20 0.00 0.00 35.95 38.19 2dkg h PHE 80 CO 0.00 0.70 0.20 -0.07 -0.60 0.00 0.00 178.31 178.55 2dkg h LEU 81 N 0.33 0.30 0.08 1.54 3.38 -1.23 0.16 115.31 119.87 2dkg h LEU 81 Ca 0.04 0.02 0.00 0.00 0.09 0.00 0.00 57.88 58.03 2dkg h LEU 81 Cb 0.79 -0.04 -0.01 0.00 0.09 0.00 0.00 40.66 41.49 2dkg h LEU 81 CO 0.06 0.22 -0.07 1.23 0.09 0.00 0.00 178.44 179.97 2dkg h GLY 82 N 0.41 -0.15 0.97 0.83 0.00 -1.38 -0.29 103.07 103.46 2dkg h GLY 82 Ca 0.16 0.08 -0.00 0.00 0.00 0.00 0.00 47.33 47.57 2dkg h GLY 82 CO -0.11 -0.08 0.20 0.00 0.00 0.00 0.00 176.54 176.56 2dkg h ALA 83 N 0.75 0.45 -0.68 3.60 0.00 -1.07 -1.62 119.26 120.70 2dkg h ALA 83 Ca 0.00 -0.06 -0.06 0.00 0.00 0.00 0.00 54.91 54.79 2dkg h ALA 83 Cb 0.16 -0.14 -0.03 0.00 0.00 0.00 0.00 17.79 17.78 2dkg h ALA 83 CO -0.02 -0.05 0.18 0.28 0.00 0.00 0.00 179.25 179.65 2dkg h VAL 84 N 0.45 1.25 -0.53 0.00 2.07 -0.64 -1.38 116.25 117.47 2dkg h VAL 84 Ca 0.12 -0.91 0.00 0.00 0.82 0.00 0.00 66.70 66.74 2dkg h VAL 84 Cb 0.03 0.54 -0.03 0.00 -1.52 0.00 0.00 31.29 30.31 2dkg h VAL 84 CO -0.02 0.35 0.34 1.23 0.02 0.00 0.00 177.57 179.48 2dkg h GLY 85 N 1.07 0.76 0.91 2.17 0.00 -0.71 -1.12 103.07 106.15 2dkg h GLY 85 Ca 0.22 -0.30 -0.01 0.00 0.00 0.00 0.00 47.33 47.24 2dkg h GLY 85 CO -0.00 0.29 0.10 -2.08 0.00 0.00 0.00 176.54 174.84 2dkg h VAL 86 N 0.71 1.14 -0.64 4.60 2.07 -1.02 -2.11 116.25 121.01 2dkg h VAL 86 Ca 0.19 -0.42 0.09 0.00 0.82 0.00 0.00 66.70 67.38 2dkg h VAL 86 Cb -0.05 1.03 -0.07 0.00 -1.52 0.00 0.00 31.29 30.68 2dkg h VAL 86 CO -0.04 0.14 0.28 0.58 0.02 0.00 0.00 177.57 178.56 2dkg h VAL 87 N 0.21 0.82 -0.63 2.57 2.07 -0.90 0.53 116.25 120.92 2dkg h VAL 87 Ca 0.07 -0.17 -0.02 0.00 0.82 0.00 0.00 66.70 67.40 2dkg h VAL 87 Cb 0.13 0.28 -0.03 0.00 -1.52 0.00 0.00 31.29 30.15 2dkg h VAL 87 CO -0.01 0.09 0.30 -0.33 0.02 0.00 0.00 177.57 177.64 2dkg h GLU 88 N 0.50 0.91 -0.74 1.57 5.08 -1.04 -0.62 114.58 120.25 2dkg h GLU 88 Ca 0.32 -0.14 -0.06 0.00 -1.00 0.00 0.00 59.36 58.48 2dkg h GLU 88 Cb 0.35 -0.16 -0.03 0.00 0.50 0.00 0.00 28.75 29.41 2dkg h GLU 88 CO -0.28 0.73 0.22 1.15 -1.00 0.00 0.00 179.01 179.84 2dkg h THR 89 N 0.87 1.26 -0.58 1.13 2.02 -0.65 -1.30 112.91 115.65 2dkg h THR 89 Ca 0.22 -0.91 -0.03 0.00 0.77 0.00 0.00 66.41 66.45 2dkg h THR 89 Cb 0.13 0.45 -0.03 0.00 -1.74 0.00 0.00 68.15 66.97 2dkg h THR 89 CO -0.03 0.36 0.24 -0.07 0.37 0.00 0.00 175.52 176.39 2dkg h LEU 90 N 1.10 0.80 -1.30 2.58 3.38 -0.40 -2.28 115.31 119.19 2dkg h LEU 90 Ca 0.24 -0.16 -0.05 0.00 0.09 0.00 0.00 57.88 57.99 2dkg h LEU 90 Cb 0.31 -0.21 -0.01 0.00 0.09 0.00 0.00 40.66 40.84 2dkg h LEU 90 CO -0.01 0.74 -0.06 0.11 0.09 0.00 0.00 178.44 179.31 2dkg h LYS 91 N 0.80 0.39 0.00 1.13 1.57 -0.83 0.18 116.57 119.81 2dkg h LYS 91 Ca 0.20 -0.09 -0.04 0.00 -1.87 0.00 0.00 60.65 58.85 2dkg h LYS 91 Cb 0.19 -0.06 -0.01 0.00 0.08 0.00 0.00 32.23 32.44 2dkg h LYS 91 CO -0.02 0.47 -0.19 0.93 -0.57 0.00 0.00 179.45 180.07 2dkg h GLU 92 N 0.38 0.00 -0.66 3.15 5.08 -0.68 -0.12 114.58 121.72 2dkg h GLU 92 Ca 0.08 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.44 2dkg h GLU 92 Cb 0.35 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.60 2dkg h GLU 92 CO 0.02 0.19 0.00 1.19 -1.00 0.00 0.00 179.01 179.41 2dkg n PHE 93 N -3.93 1.45 -3.63 4.33 3.01 -0.47 -4.96 117.46 113.26 2dkg n PHE 93 Ca -0.02 -0.60 -0.24 0.00 1.01 0.00 0.00 57.45 57.60 2dkg n PHE 93 Cb 0.28 -0.22 0.07 0.00 -0.01 0.00 0.00 39.48 39.60 2dkg n PHE 93 CO 0.00 0.00 0.00 0.43 1.01 0.00 0.00 176.76 178.20 2dkg n SER 94 N 1.18 -5.70 -4.32 4.37 7.64 -0.06 -5.01 113.62 111.73 2dkg n SER 94 Ca 0.26 -0.59 -0.33 0.00 1.01 0.00 0.00 58.87 59.22 2dkg n SER 94 Cb 0.87 -4.87 -0.15 0.00 -1.01 0.00 0.00 64.21 59.06 2dkg n SER 94 CO 0.00 0.00 0.00 -0.63 -3.01 0.00 0.00 175.04 171.40 2dkg s ILE 95 N -3.33 2.80 -1.30 0.44 1.01 0.51 -4.97 121.20 116.36 2dkg s ILE 95 Ca 0.54 -0.74 -0.17 0.00 0.00 0.00 0.00 60.65 60.27 2dkg s ILE 95 Cb -0.24 -2.16 0.02 0.00 0.01 0.00 0.00 42.46 40.08 2dkg s ILE 95 CO 0.75 0.53 1.99 -0.67 0.00 0.00 0.00 174.94 177.54 2dkg n ASP 96 N 3.66 4.04 -4.73 3.58 2.03 -1.26 -3.22 116.55 120.64 2dkg n ASP 96 Ca -0.18 -2.84 -0.41 0.00 0.52 0.00 0.00 54.79 51.88 2dkg n ASP 96 Cb 0.52 -1.64 -0.05 0.00 -0.72 0.00 0.00 41.12 39.24 2dkg n ASP 96 CO 0.00 0.00 0.00 -0.83 -1.92 0.00 0.00 177.20 174.45 2dkg s GLY 97 N 4.05 3.03 0.03 0.27 0.00 -1.26 -4.49 107.32 108.94 2dkg s GLY 97 Ca 0.52 0.59 0.04 0.00 0.00 0.00 0.00 44.72 45.87 2dkg s GLY 97 CO 0.01 1.39 -0.13 0.50 0.00 0.00 0.00 173.10 174.88 2dkg s ARG 98 N -0.30 0.87 -0.05 2.90 1.81 0.58 -4.91 118.95 119.85 2dkg s ARG 98 Ca 0.45 -0.65 -0.25 0.00 -1.72 0.00 0.00 55.73 53.56 2dkg s ARG 98 Cb -0.24 -0.85 -0.03 0.00 -0.45 0.00 0.00 34.95 33.37 2dkg s ARG 98 CO 0.30 0.21 0.79 0.42 -0.68 0.00 0.00 175.30 176.35 2dkg s ILE 99 N -0.72 4.99 -0.28 1.52 1.01 0.82 0.26 121.20 128.80 2dkg s ILE 99 Ca 0.01 1.63 -0.07 0.00 0.00 0.00 0.00 60.65 62.23 2dkg s ILE 99 Cb -0.07 -4.13 0.00 0.00 0.01 0.00 0.00 42.46 38.28 2dkg s ILE 99 CO 0.01 0.22 0.07 -0.75 0.00 0.00 0.00 174.94 174.49 2dkg s LYS 100 N 0.92 3.20 0.34 2.79 2.20 0.71 -0.03 119.74 129.87 2dkg s LYS 100 Ca 0.42 -0.78 -0.28 0.00 -0.36 0.00 0.00 55.97 54.96 2dkg s LYS 100 Cb -0.19 -3.35 -0.12 0.00 -1.51 0.00 0.00 37.83 32.66 2dkg s LYS 100 CO 0.21 -0.39 1.28 1.87 -0.36 0.00 0.00 175.35 177.96 2dkg n TRP 101 N 4.87 2.24 -0.08 4.03 -0.00 -1.26 -2.19 117.44 125.05 2dkg n TRP 101 Ca -0.15 0.56 -0.07 0.00 -0.00 0.00 0.00 57.50 57.84 2dkg n TRP 101 Cb 0.49 -2.41 -0.15 0.00 -0.00 0.00 0.00 31.31 29.23 2dkg n TRP 101 CO 0.00 0.00 0.00 -0.35 -0.00 0.00 0.00 177.69 177.34 2dkg n PRO 102 N 0.56 0.84 -0.14 5.87 -0.04 -1.26 -4.70 135.00 136.14 2dkg n PRO 102 Ca 0.05 -0.03 0.04 0.00 -0.04 0.00 0.00 63.50 63.51 2dkg n PRO 102 Cb 0.36 -1.49 0.06 0.00 -0.04 0.00 0.00 33.50 32.38 2dkg n PRO 102 CO 0.00 0.00 0.00 0.27 -0.04 0.00 0.00 175.50 175.73 2dkg n ASN 103 N -2.64 1.44 -4.62 3.54 6.94 -1.21 -4.79 115.26 113.91 2dkg n ASN 103 Ca -0.27 -2.30 -0.26 0.00 -0.02 0.00 0.00 54.58 51.73 2dkg n ASN 103 Cb 1.04 -0.21 -0.08 0.00 -2.36 0.00 0.00 39.78 38.16 2dkg n ASN 103 CO 0.00 0.00 0.00 -1.81 -1.03 0.00 0.00 177.26 174.42 2dkg s ASP 104 N -1.61 4.54 -0.13 0.53 1.01 -0.93 -1.05 116.67 119.02 2dkg s ASP 104 Ca 0.13 -0.50 0.01 0.00 0.71 0.00 0.00 52.55 52.91 2dkg s ASP 104 Cb 0.11 -0.88 0.02 0.00 1.01 0.00 0.00 42.92 43.18 2dkg s ASP 104 CO 0.01 0.08 -0.17 -0.69 0.21 0.00 0.00 175.17 174.62 2dkg s VAL 105 N -1.79 1.65 0.28 -1.27 1.01 -0.89 -0.21 120.40 119.18 2dkg s VAL 105 Ca 0.27 -0.72 0.11 0.00 0.00 0.00 0.00 61.98 61.64 2dkg s VAL 105 Cb -0.09 -1.51 -0.05 0.00 0.00 0.00 0.00 36.38 34.74 2dkg s VAL 105 CO 0.17 0.47 -0.12 -0.76 0.00 0.00 0.00 175.10 174.86 2dkg s LEU 106 N 1.09 2.83 -0.19 3.92 1.43 0.14 -1.66 118.68 126.23 2dkg s LEU 106 Ca -0.03 -0.88 -0.02 0.00 -1.03 0.00 0.00 54.13 52.17 2dkg s LEU 106 Cb -0.14 -1.34 0.05 0.00 0.03 0.00 0.00 46.19 44.79 2dkg s LEU 106 CO -0.04 0.02 -0.00 -0.69 0.23 0.00 0.00 176.35 175.87 2dkg s VAL 107 N -2.44 0.83 -1.41 -1.59 1.01 0.41 -0.31 120.40 116.91 2dkg s VAL 107 Ca 0.31 -0.66 -0.10 0.00 0.00 0.00 0.00 61.98 61.52 2dkg s VAL 107 Cb -0.05 -1.21 0.03 0.00 0.00 0.00 0.00 36.38 35.15 2dkg s VAL 107 CO 0.17 -0.09 1.12 0.59 0.00 0.00 0.00 175.10 176.89 2dkg n ASN 108 N 4.94 -5.82 -0.25 3.32 3.02 -1.26 -1.67 115.26 117.54 2dkg n ASN 108 Ca -0.10 -0.62 -0.03 0.00 -0.03 0.00 0.00 54.58 53.80 2dkg n ASN 108 Cb 0.47 -4.68 -0.01 0.00 -0.61 0.00 0.00 39.78 34.95 2dkg n ASN 108 CO 0.00 0.00 0.00 -1.22 -2.62 0.00 0.00 177.26 173.42 2dkg n TYR 109 N -4.90 0.00 -4.39 3.10 4.01 -1.26 -4.99 117.16 108.73 2dkg n TYR 109 Ca 0.01 0.00 -0.34 0.00 -0.16 0.00 0.00 57.90 57.42 2dkg n TYR 109 Cb 0.55 -1.51 -0.12 0.00 -0.31 0.00 0.00 39.34 37.95 2dkg n TYR 109 CO 0.00 0.00 0.00 0.15 -0.46 0.00 0.00 176.86 176.55 2dkg s LYS 110 N -1.70 3.65 0.03 -0.72 1.02 -0.67 -5.03 119.74 116.31 2dkg s LYS 110 Ca 0.00 -0.51 -0.30 0.00 0.02 0.00 0.00 55.97 55.18 2dkg s LYS 110 Cb 0.00 -2.92 -0.06 0.00 -0.52 0.00 0.00 37.83 34.33 2dkg s LYS 110 CO 0.00 0.27 1.43 0.21 -0.92 0.00 0.00 175.35 176.34 2dkg s LYS 111 N 0.28 4.28 -0.01 1.68 2.20 -1.26 -0.44 119.74 126.47 2dkg s LYS 111 Ca -0.03 2.02 0.08 0.00 -0.36 0.00 0.00 55.97 57.69 2dkg s LYS 111 Cb -0.14 -3.52 -0.11 0.00 -1.51 0.00 0.00 37.83 32.54 2dkg s LYS 111 CO 0.03 -0.57 0.20 1.51 -0.36 0.00 0.00 175.35 176.16 2dkg n ILE 112 N 4.55 0.00 -3.50 5.43 3.06 -0.67 -1.25 119.36 126.98 2dkg n ILE 112 Ca 0.13 -0.21 -0.16 0.00 -2.50 0.00 0.00 62.75 60.01 2dkg n ILE 112 Cb 0.43 0.46 -0.05 0.00 0.54 0.00 0.00 39.64 41.02 2dkg n ILE 112 CO 0.00 0.00 0.00 0.00 -2.50 0.00 0.00 176.55 174.05 2dkg s ALA 113 N -2.38 -1.70 0.04 1.51 0.00 -1.13 -1.07 121.76 117.03 2dkg s ALA 113 Ca -0.02 1.08 0.03 0.00 0.00 0.00 0.00 51.96 53.05 2dkg s ALA 113 Cb 0.05 0.24 -0.02 0.00 0.00 0.00 0.00 23.12 23.39 2dkg s ALA 113 CO 0.33 -0.47 -0.09 0.20 0.00 0.00 0.00 175.76 175.72 2dkg s GLY 114 N -1.61 0.56 -0.08 0.00 0.00 -0.32 -2.09 107.32 103.78 2dkg s GLY 114 Ca -0.08 -0.71 0.04 0.00 0.00 0.00 0.00 44.72 43.98 2dkg s GLY 114 CO 0.04 -0.73 -0.21 0.14 0.00 0.00 0.00 173.10 172.34 2dkg s VAL 115 N -1.04 2.36 -0.12 1.40 1.01 -0.22 -1.32 120.40 122.46 2dkg s VAL 115 Ca -0.05 -0.94 -0.02 0.00 0.00 0.00 0.00 61.98 60.98 2dkg s VAL 115 Cb -0.08 -1.90 0.04 0.00 0.00 0.00 0.00 36.38 34.43 2dkg s VAL 115 CO 0.01 0.56 0.00 -0.22 0.00 0.00 0.00 175.10 175.45 2dkg s LEU 116 N 0.02 0.91 -0.22 3.92 2.96 0.41 -4.79 118.68 121.88 2dkg s LEU 116 Ca -0.08 -0.38 -0.08 0.00 -0.22 0.00 0.00 54.13 53.37 2dkg s LEU 116 Cb -0.15 -0.56 -0.04 0.00 0.50 0.00 0.00 46.19 45.94 2dkg s LEU 116 CO 0.05 -0.22 0.09 -0.69 -1.32 0.00 0.00 176.35 174.26 2dkg s VAL 117 N 1.89 4.76 0.04 1.68 1.01 -1.26 -0.50 120.40 128.01 2dkg s VAL 117 Ca 0.03 -0.03 0.09 0.00 0.00 0.00 0.00 61.98 62.06 2dkg s VAL 117 Cb -0.14 -3.20 -0.03 0.00 0.00 0.00 0.00 36.38 33.01 2dkg s VAL 117 CO -0.07 0.38 -0.25 -1.61 0.00 0.00 0.00 175.10 173.55 2dkg s GLU 118 N 1.07 1.88 -0.28 2.72 2.02 -0.43 -4.99 118.70 120.69 2dkg s GLU 118 Ca 0.05 -1.07 -0.03 0.00 0.02 0.00 0.00 54.97 53.93 2dkg s GLU 118 Cb -0.14 -2.03 0.03 0.00 0.10 0.00 0.00 34.13 32.09 2dkg s GLU 118 CO 0.04 0.52 -0.00 0.20 0.02 0.00 0.00 175.26 176.03 2dkg s GLY 119 N -1.25 1.70 0.00 -1.39 0.00 -1.26 -2.34 107.32 102.79 2dkg s GLY 119 Ca 0.12 -1.54 0.00 0.00 0.00 0.00 0.00 44.72 43.30 2dkg s GLY 119 CO 0.03 0.60 0.00 1.17 0.00 0.00 0.00 173.10 174.90 2dkg n LYS 120 N 4.72 3.74 0.00 2.90 4.81 -0.62 -5.07 118.16 128.63 2dkg n LYS 120 Ca -0.15 0.00 0.00 0.00 -0.87 0.00 0.00 58.31 57.29 2dkg n LYS 120 Cb 0.46 0.00 0.00 0.00 0.02 0.00 0.00 35.03 35.51 2dkg n LYS 120 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 2dkg n GLY 121 N 5.00 0.93 0.56 3.14 0.00 -1.26 -4.58 105.19 108.98 2dkg n GLY 121 Ca 0.00 0.00 0.08 0.00 0.00 0.00 0.00 46.02 46.10 2dkg n GLY 121 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 2dkg n ASP 122 N -0.88 2.12 -4.40 1.61 2.03 -1.26 -4.94 116.55 110.83 2dkg n ASP 122 Ca 0.00 -1.56 -0.33 0.00 0.52 0.00 0.00 54.79 53.42 2dkg n ASP 122 Cb 0.00 0.19 -0.14 0.00 -0.72 0.00 0.00 41.12 40.45 2dkg n ASP 122 CO 0.00 0.00 0.00 -0.75 -1.92 0.00 0.00 177.20 174.53 2dkg s LYS 123 N -1.64 3.46 -0.06 -0.67 2.20 -1.26 -4.35 119.74 117.43 2dkg s LYS 123 Ca 0.18 -0.64 0.05 0.00 -0.36 0.00 0.00 55.97 55.20 2dkg s LYS 123 Cb 0.14 -2.72 -0.01 0.00 -1.51 0.00 0.00 37.83 33.74 2dkg s LYS 123 CO 0.30 0.21 -0.21 0.42 -0.36 0.00 0.00 175.35 175.71 2dkg s ILE 124 N 0.38 1.74 -0.24 5.43 -1.09 -0.08 -1.60 121.20 125.75 2dkg s ILE 124 Ca -0.09 -0.89 -0.06 0.00 -2.23 0.00 0.00 60.65 57.39 2dkg s ILE 124 Cb -0.15 -1.49 -0.02 0.00 -1.58 0.00 0.00 42.46 39.22 2dkg s ILE 124 CO 0.05 0.49 0.03 -0.69 -1.23 0.00 0.00 174.94 173.59 2dkg s VAL 125 N 0.00 3.94 -0.46 2.92 1.01 -0.99 -0.34 120.40 126.48 2dkg s VAL 125 Ca -0.05 -0.33 -0.14 0.00 0.00 0.00 0.00 61.98 61.46 2dkg s VAL 125 Cb -0.13 -2.84 0.08 0.00 0.00 0.00 0.00 36.38 33.48 2dkg s VAL 125 CO 0.03 0.35 0.36 -0.22 0.00 0.00 0.00 175.10 175.63 2dkg s LEU 126 N 1.56 5.53 -0.11 3.92 2.96 0.14 -1.31 118.68 131.36 2dkg s LEU 126 Ca 0.06 -1.40 -0.09 0.00 -0.22 0.00 0.00 54.13 52.48 2dkg s LEU 126 Cb -0.15 -2.13 -0.04 0.00 0.50 0.00 0.00 46.19 44.37 2dkg s LEU 126 CO 0.01 -0.63 0.18 -0.83 -1.32 0.00 0.00 176.35 173.77 2dkg s GLY 127 N 2.52 2.20 -0.03 7.98 0.00 0.34 -0.77 107.32 119.56 2dkg s GLY 127 Ca 0.04 -0.58 0.00 0.00 0.00 0.00 0.00 44.72 44.18 2dkg s GLY 127 CO 0.05 -0.22 0.00 -0.42 0.00 0.00 0.00 173.10 172.51 2dkg s ILE 128 N -0.85 0.17 -0.20 0.90 1.01 -0.07 -0.44 121.20 121.72 2dkg s ILE 128 Ca 0.16 0.11 0.01 0.00 0.00 0.00 0.00 60.65 60.93 2dkg s ILE 128 Cb -0.13 -0.28 0.03 0.00 0.01 0.00 0.00 42.46 42.10 2dkg s ILE 128 CO 0.05 0.15 -0.17 -0.83 0.00 0.00 0.00 174.94 174.15 2dkg s GLY 129 N 1.16 1.41 -0.14 6.18 0.00 -0.43 -1.82 107.32 113.68 2dkg s GLY 129 Ca -0.08 -1.31 0.01 0.00 0.00 0.00 0.00 44.72 43.34 2dkg s GLY 129 CO -0.02 0.42 -0.14 -2.27 0.00 0.00 0.00 173.10 171.09 2dkg s LEU 130 N 1.28 1.64 -0.24 0.66 2.96 -0.09 -1.17 118.68 123.72 2dkg s LEU 130 Ca 0.01 -0.46 -0.29 0.00 -0.22 0.00 0.00 54.13 53.18 2dkg s LEU 130 Cb -0.15 -1.13 -0.01 0.00 0.50 0.00 0.00 46.19 45.40 2dkg s LEU 130 CO -0.11 -0.05 1.33 0.20 -1.32 0.00 0.00 176.35 176.41 2dkg s ASN 131 N 1.41 6.74 0.00 3.68 0.01 -0.24 -0.73 114.94 125.81 2dkg s ASN 131 Ca 0.03 1.46 0.00 0.00 -0.71 0.00 0.00 52.86 53.63 2dkg s ASN 131 Cb -0.13 -2.54 0.00 0.00 0.41 0.00 0.00 41.25 38.99 2dkg s ASN 131 CO -0.09 -0.98 0.00 0.52 -1.51 0.00 0.00 177.10 175.04 2dkg n VAL 132 N 5.91 0.00 0.41 1.60 0.31 -1.25 -1.84 118.33 123.48 2dkg n VAL 132 Ca 0.15 0.07 0.05 0.00 -0.01 0.00 0.00 64.34 64.59 2dkg n VAL 132 Cb 0.46 -0.91 0.01 0.00 -0.91 0.00 0.00 33.84 32.49 2dkg n VAL 132 CO 0.00 0.00 0.00 0.59 -1.32 0.00 0.00 176.83 176.10 2dkg n ASN 133 N -1.57 1.40 -4.81 4.52 3.02 0.98 -0.69 115.26 118.11 2dkg n ASN 133 Ca 0.00 -1.20 -0.31 0.00 -0.03 0.00 0.00 54.58 53.04 2dkg n ASN 133 Cb 0.00 0.30 0.05 0.00 -0.61 0.00 0.00 39.78 39.52 2dkg n ASN 133 CO 0.00 0.00 0.00 0.54 -2.62 0.00 0.00 177.26 175.18 2dkg s ASN 134 N -1.13 5.36 0.48 6.41 4.22 -1.16 -4.85 114.94 124.27 2dkg s ASN 134 Ca 0.09 1.69 -0.21 0.00 -2.14 0.00 0.00 52.86 52.29 2dkg s ASN 134 Cb 0.08 -2.51 -0.08 0.00 1.28 0.00 0.00 41.25 40.02 2dkg s ASN 134 CO 0.20 -1.45 1.09 -0.54 -2.04 0.00 0.00 177.10 174.35 2dkg s LYS 135 N -4.80 3.76 0.20 3.55 1.02 -1.26 -4.91 119.74 117.30 2dkg s LYS 135 Ca 0.60 1.55 0.07 0.00 0.02 0.00 0.00 55.97 58.21 2dkg s LYS 135 Cb -0.15 -2.24 -0.05 0.00 -0.52 0.00 0.00 37.83 34.87 2dkg s LYS 135 CO 0.51 -0.50 -0.13 0.14 -0.92 0.00 0.00 175.35 174.44 2dkg s VAL 136 N -1.76 1.67 0.61 3.17 -7.23 -1.26 -4.80 120.40 110.80 2dkg s VAL 136 Ca 0.66 -2.19 -0.17 0.00 -1.81 0.00 0.00 61.98 58.46 2dkg s VAL 136 Cb -0.22 -2.05 -0.03 0.00 0.56 0.00 0.00 36.38 34.64 2dkg s VAL 136 CO 0.27 -0.59 1.12 -2.16 -0.31 0.00 0.00 175.10 173.43 2dkg s PRO 137 N -3.66 3.04 0.18 4.82 0.04 -1.26 -4.89 135.00 133.26 2dkg s PRO 137 Ca 0.22 1.50 -0.32 0.00 0.04 0.00 0.00 61.00 62.43 2dkg s PRO 137 Cb -0.00 -1.97 -0.16 0.00 0.04 0.00 0.00 34.50 32.41 2dkg s PRO 137 CO 0.07 -1.08 1.13 0.09 0.04 0.00 0.00 177.00 177.25 2dkg n ASN 138 N -1.92 1.25 0.00 6.66 3.02 -1.26 -1.38 115.26 121.63 2dkg n ASN 138 Ca 0.11 1.14 0.00 0.00 -0.03 0.00 0.00 54.58 55.80 2dkg n ASN 138 Cb 0.51 -1.21 0.00 0.00 -0.61 0.00 0.00 39.78 38.48 2dkg n ASN 138 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2dkg n GLY 139 N 1.95 3.21 4.00 7.41 0.00 -1.26 -5.04 105.19 115.45 2dkg n GLY 139 Ca 0.15 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 45.93 2dkg n GLY 139 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2dkg s ALA 140 N -2.55 3.73 0.19 4.61 0.00 -0.48 -4.07 121.76 123.20 2dkg s ALA 140 Ca 0.00 -1.81 -0.08 0.00 0.00 0.00 0.00 51.96 50.07 2dkg s ALA 140 Cb 0.00 -1.96 -0.01 0.00 0.00 0.00 0.00 23.12 21.14 2dkg s ALA 140 CO 0.00 -1.52 0.30 -0.08 0.00 0.00 0.00 175.76 174.46 2dkg s THR 141 N -3.16 0.04 0.12 0.00 -1.32 -0.38 -4.82 115.64 106.10 2dkg s THR 141 Ca 0.67 -1.52 0.00 0.00 -1.21 0.00 0.00 61.69 59.64 2dkg s THR 141 Cb -0.05 -2.07 -0.04 0.00 -1.51 0.00 0.00 72.50 68.84 2dkg s THR 141 CO 0.45 -0.17 0.00 -0.94 -2.21 0.00 0.00 174.62 171.75 2dkg s SER 142 N -3.02 0.72 0.29 8.08 1.04 -1.26 -4.22 113.70 115.33 2dkg s SER 142 Ca 0.23 -1.12 -0.03 0.00 0.48 0.00 0.00 55.95 55.51 2dkg s SER 142 Cb 0.03 0.19 0.41 0.00 0.10 0.00 0.00 66.02 66.75 2dkg s SER 142 CO 0.05 -0.61 1.96 0.24 0.98 0.00 0.00 173.24 175.86 2dkg h MET 143 N 2.91 1.13 -0.46 4.02 2.86 -1.23 -0.25 114.93 123.92 2dkg h MET 143 Ca -0.35 -0.07 -0.02 0.00 -2.06 0.00 0.00 59.70 57.20 2dkg h MET 143 Cb 1.18 -0.26 -0.02 0.00 0.06 0.00 0.00 31.60 32.56 2dkg h MET 143 CO 0.63 0.75 0.21 -0.22 1.06 0.00 0.00 176.91 179.33 2dkg h LYS 144 N 1.17 0.67 -0.34 1.72 3.64 -1.07 0.87 116.57 123.22 2dkg h LYS 144 Ca 0.32 -0.11 -0.11 0.00 -1.27 0.00 0.00 60.65 59.48 2dkg h LYS 144 Cb -0.14 -0.12 -0.01 0.00 -0.41 0.00 0.00 32.23 31.55 2dkg h LYS 144 CO -0.07 0.58 -0.25 -0.07 -2.27 0.00 0.00 179.45 177.38 2dkg h LEU 145 N 0.59 0.69 -0.26 5.20 3.38 -1.67 0.16 115.31 123.41 2dkg h LEU 145 Ca 0.16 -0.25 -0.12 0.00 0.09 0.00 0.00 57.88 57.75 2dkg h LEU 145 Cb 0.15 -0.19 -0.00 0.00 0.09 0.00 0.00 40.66 40.70 2dkg h LEU 145 CO -0.02 0.91 -0.32 -0.33 0.09 0.00 0.00 178.44 178.77 2dkg h GLU 146 N 0.59 0.67 0.00 1.13 4.39 -0.74 -3.23 114.58 117.38 2dkg h GLU 146 Ca 0.08 -0.38 0.00 0.00 0.34 0.00 0.00 59.36 59.40 2dkg h GLU 146 Cb 0.73 0.03 0.00 0.00 -0.10 0.00 0.00 28.75 29.41 2dkg h GLU 146 CO 0.06 0.99 -0.40 -0.07 -1.16 0.00 0.00 179.01 178.43 2dkg h LEU 147 N 0.39 0.00 0.00 1.33 3.38 -0.79 -3.47 115.31 116.15 2dkg h LEU 147 Ca 0.03 -0.10 0.00 0.00 0.09 0.00 0.00 57.88 57.90 2dkg h LEU 147 Cb 0.90 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.65 2dkg h LEU 147 CO 0.08 0.05 0.00 0.61 0.09 0.00 0.00 178.44 179.27 2dkg n GLY 148 N 1.29 0.39 3.23 0.83 0.00 0.54 -4.98 105.19 106.49 2dkg n GLY 148 Ca 0.04 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 45.95 2dkg n GLY 148 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2dkg s SER 149 N -2.02 -0.03 0.41 1.61 0.15 -1.03 -5.01 113.70 107.78 2dkg s SER 149 Ca 0.00 -0.36 -0.24 0.00 0.70 0.00 0.00 55.95 56.05 2dkg s SER 149 Cb 0.00 0.35 -0.09 0.00 -1.71 0.00 0.00 66.02 64.57 2dkg s SER 149 CO 0.00 -0.65 1.07 -0.70 1.20 0.00 0.00 173.24 174.16 2dkg s GLU 150 N -2.99 4.07 -0.08 5.44 2.12 -1.26 -4.18 118.70 121.82 2dkg s GLU 150 Ca -0.02 1.56 0.04 0.00 0.36 0.00 0.00 54.97 56.91 2dkg s GLU 150 Cb 0.01 -2.50 -0.01 0.00 0.26 0.00 0.00 34.13 31.89 2dkg s GLU 150 CO -0.06 -0.23 -0.21 0.08 -0.54 0.00 0.00 175.26 174.29 2dkg s VAL 151 N -1.65 2.34 -0.15 3.70 1.01 -1.26 -5.03 120.40 119.35 2dkg s VAL 151 Ca 0.59 -0.94 -0.31 0.00 0.00 0.00 0.00 61.98 61.32 2dkg s VAL 151 Cb -0.23 -1.90 -0.08 0.00 0.00 0.00 0.00 36.38 34.17 2dkg s VAL 151 CO 0.29 0.56 2.10 -2.65 0.00 0.00 0.00 175.10 175.39 2dkg n PRO 152 N 3.16 2.09 -0.32 2.72 -0.02 -1.26 -4.82 135.00 136.55 2dkg n PRO 152 Ca -0.18 0.67 0.03 0.00 -2.02 0.00 0.00 63.50 62.01 2dkg n PRO 152 Cb 0.52 -2.95 0.18 0.00 -0.02 0.00 0.00 33.50 31.23 2dkg n PRO 152 CO 0.00 0.00 0.00 1.25 1.98 0.00 0.00 175.50 178.73 2dkg h LEU 153 N 12.49 0.82 -1.39 2.45 5.85 -1.97 -2.04 115.31 131.51 2dkg h LEU 153 Ca -0.43 0.04 -0.04 0.00 0.84 0.00 0.00 57.88 58.29 2dkg h LEU 153 Cb 1.26 -0.13 -0.01 0.00 0.37 0.00 0.00 40.66 42.15 2dkg h LEU 153 CO 0.96 0.48 -0.04 0.25 -0.34 0.00 0.00 178.44 179.75 2dkg h LEU 154 N 0.93 0.33 -0.61 2.25 5.85 -2.00 -1.70 115.31 120.36 2dkg h LEU 154 Ca 0.42 -0.06 -0.13 0.00 0.84 0.00 0.00 57.88 58.95 2dkg h LEU 154 Cb 0.33 -0.09 -0.01 0.00 0.37 0.00 0.00 40.66 41.26 2dkg h LEU 154 CO -0.23 0.42 -0.34 0.28 -0.34 0.00 0.00 178.44 178.24 2dkg h SER 155 N 0.34 0.76 -0.57 1.25 0.02 -1.76 -1.39 113.55 112.20 2dkg h SER 155 Ca 0.08 -0.32 -0.11 0.00 -0.84 0.00 0.00 61.79 60.60 2dkg h SER 155 Cb 0.30 -0.21 -0.02 0.00 0.14 0.00 0.00 62.40 62.61 2dkg h SER 155 CO 0.01 1.03 -0.06 0.58 -1.14 0.00 0.00 176.83 177.25 2dkg h VAL 156 N 0.61 1.27 0.20 2.27 2.07 -1.18 -1.59 116.25 119.89 2dkg h VAL 156 Ca 0.06 -1.21 -0.01 0.00 0.82 0.00 0.00 66.70 66.36 2dkg h VAL 156 Cb 0.87 0.90 -0.00 0.00 -1.52 0.00 0.00 31.29 31.53 2dkg h VAL 156 CO 0.08 0.43 -0.12 0.15 0.02 0.00 0.00 177.57 178.13 2dkg h PHE 157 N 0.93 -0.30 -0.50 1.57 3.57 -1.12 -0.85 116.94 120.24 2dkg h PHE 157 Ca 0.15 -0.00 0.05 0.00 3.53 0.00 0.00 57.97 61.70 2dkg h PHE 157 Cb 0.62 0.11 -0.05 0.00 2.79 0.00 0.00 35.95 39.42 2dkg h PHE 157 CO 0.04 -0.18 0.23 0.00 -2.23 0.00 0.00 178.31 176.17 2dkg h ARG 158 N -0.30 0.44 0.25 1.11 3.08 -1.15 -0.46 114.38 117.36 2dkg h ARG 158 Ca -0.02 -0.03 -0.01 0.00 0.07 0.00 0.00 59.98 60.00 2dkg h ARG 158 Cb 0.25 -0.10 -0.00 0.00 0.08 0.00 0.00 29.97 30.19 2dkg h ARG 158 CO 0.02 0.29 -0.15 1.03 -1.07 0.00 0.00 179.97 180.09 2dkg h SER 159 N 0.45 -0.38 0.02 7.04 0.87 -1.06 -1.51 113.55 118.97 2dkg h SER 159 Ca 0.23 0.02 0.01 0.00 -1.23 0.00 0.00 61.79 60.82 2dkg h SER 159 Cb 0.17 0.11 -0.01 0.00 -0.44 0.00 0.00 62.40 62.23 2dkg h SER 159 CO -0.18 -0.25 -0.05 0.25 -0.53 0.00 0.00 176.83 176.07 2dkg h LEU 160 N -0.39 -0.13 -0.85 2.23 5.85 -0.91 -1.30 115.31 119.80 2dkg h LEU 160 Ca -0.03 0.02 0.05 0.00 0.84 0.00 0.00 57.88 58.76 2dkg h LEU 160 Cb 0.33 0.06 -0.06 0.00 0.37 0.00 0.00 40.66 41.35 2dkg h LEU 160 CO 0.03 -0.07 0.53 0.40 -0.34 0.00 0.00 178.44 178.99 2dkg h ILE 161 N -0.09 1.08 -0.41 4.05 1.08 -1.05 0.11 117.51 122.26 2dkg h ILE 161 Ca 0.02 -0.34 -0.02 0.00 -0.39 0.00 0.00 64.86 64.13 2dkg h ILE 161 Cb 0.11 -0.01 -0.02 0.00 -3.07 0.00 0.00 36.82 33.83 2dkg h ILE 161 CO -0.04 0.18 0.19 0.74 -0.69 0.00 0.00 178.15 178.54 2dkg h THR 162 N 1.00 1.18 -0.21 -0.27 2.02 -0.98 -1.29 112.91 114.36 2dkg h THR 162 Ca 0.36 -0.52 -0.02 0.00 0.77 0.00 0.00 66.41 67.00 2dkg h THR 162 Cb 0.11 0.76 -0.01 0.00 -1.74 0.00 0.00 68.15 67.27 2dkg h THR 162 CO -0.15 0.19 0.06 0.78 0.37 0.00 0.00 175.52 176.78 2dkg h ASN 163 N 0.53 0.31 -0.92 4.18 2.35 -0.53 -2.58 115.58 118.92 2dkg h ASN 163 Ca 0.14 -0.21 0.01 0.00 -0.55 0.00 0.00 56.30 55.69 2dkg h ASN 163 Cb 0.13 -0.08 -0.05 0.00 0.05 0.00 0.00 38.32 38.37 2dkg h ASN 163 CO -0.02 0.44 0.61 -0.07 -1.65 0.00 0.00 177.43 176.74 2dkg h LEU 164 N 0.16 1.05 0.06 1.61 3.38 -0.71 -0.01 115.31 120.85 2dkg h LEU 164 Ca 0.07 -0.03 -0.00 0.00 0.09 0.00 0.00 57.88 58.01 2dkg h LEU 164 Cb 0.25 -0.26 -0.00 0.00 0.09 0.00 0.00 40.66 40.74 2dkg h LEU 164 CO -0.00 0.75 -0.03 -0.78 0.09 0.00 0.00 178.44 178.47 2dkg h ASP 165 N 1.24 -0.08 -0.18 -0.43 3.58 -1.12 0.35 116.42 119.79 2dkg h ASP 165 Ca 0.34 0.00 0.01 0.00 0.42 0.00 0.00 57.03 57.80 2dkg h ASP 165 Cb -0.13 0.02 -0.01 0.00 1.72 0.00 0.00 39.33 40.93 2dkg h ASP 165 CO -0.08 -0.05 0.09 -0.09 -2.88 0.00 0.00 179.24 176.23 2dkg h ARG 166 N -0.08 0.19 -0.95 0.28 2.43 -1.13 0.05 114.38 115.17 2dkg h ARG 166 Ca -0.01 -0.01 0.01 0.00 -0.81 0.00 0.00 59.98 59.17 2dkg h ARG 166 Cb 0.07 -0.04 -0.05 0.00 -0.42 0.00 0.00 29.97 29.53 2dkg h ARG 166 CO 0.01 0.12 0.63 -0.07 -1.51 0.00 0.00 179.97 179.15 2dkg h LEU 167 N 0.19 1.09 -0.09 3.80 3.38 -0.76 -1.80 115.31 121.12 2dkg h LEU 167 Ca 0.07 -0.03 -0.02 0.00 0.09 0.00 0.00 57.88 57.99 2dkg h LEU 167 Cb 0.01 -0.27 -0.00 0.00 0.09 0.00 0.00 40.66 40.49 2dkg h LEU 167 CO -0.04 0.78 -0.02 0.22 0.09 0.00 0.00 178.44 179.47 2dkg h TYR 168 N 1.28 0.20 -0.88 1.13 3.20 0.08 -0.81 116.97 121.17 2dkg h TYR 168 Ca 0.35 -0.04 0.10 0.00 3.14 0.00 0.00 58.73 62.28 2dkg h TYR 168 Cb -0.13 -0.05 -0.08 0.00 1.54 0.00 0.00 36.73 38.01 2dkg h TYR 168 CO -0.01 0.48 0.53 -0.07 -1.64 0.00 0.00 178.16 177.46 2dkg h LEU 169 N -0.14 0.77 -0.56 2.82 -0.00 -0.80 -1.33 115.31 116.07 2dkg h LEU 169 Ca 0.02 0.04 -0.16 0.00 -0.00 0.00 0.00 57.88 57.79 2dkg h LEU 169 Cb 0.42 -0.11 -0.01 0.00 -0.00 0.00 0.00 40.66 40.96 2dkg h LEU 169 CO 0.01 0.44 -0.61 -1.13 -0.00 0.00 0.00 178.44 177.14 2dkg h ASN 170 N 0.88 0.43 -0.64 -0.43 -1.24 -1.23 -3.12 115.58 110.22 2dkg h ASN 170 Ca 0.43 -0.25 -0.00 0.00 0.71 0.00 0.00 56.30 57.19 2dkg h ASN 170 Cb 0.38 -0.12 -0.03 0.00 0.73 0.00 0.00 38.32 39.27 2dkg h ASN 170 CO -0.25 0.94 0.40 0.15 -1.29 0.00 0.00 177.43 177.38 2dkg h PHE 171 N 0.28 0.84 -0.66 0.67 3.04 -0.10 0.62 116.94 121.64 2dkg h PHE 171 Ca -0.01 0.00 0.03 0.00 3.98 0.00 0.00 57.97 61.98 2dkg h PHE 171 Cb 1.14 -0.28 -0.04 0.00 2.56 0.00 0.00 35.95 39.34 2dkg h PHE 171 CO 0.03 0.56 0.43 -0.07 -2.02 0.00 0.00 178.31 177.25 2dkg h LEU 172 N 0.87 0.68 0.15 0.59 3.38 -1.23 -1.84 115.31 117.90 2dkg h LEU 172 Ca 0.23 -0.01 -0.34 0.00 0.09 0.00 0.00 57.88 57.85 2dkg h LEU 172 Cb -0.04 -0.16 -0.00 0.00 0.09 0.00 0.00 40.66 40.55 2dkg h LEU 172 CO -0.05 0.47 -1.74 0.11 0.09 0.00 0.00 178.44 177.33 2dkg h LYS 173 N 0.79 0.32 -2.48 1.13 1.57 -1.39 -3.43 116.57 113.08 2dkg h LYS 173 Ca 0.26 -0.54 -0.59 0.00 -1.87 0.00 0.00 60.65 57.91 2dkg h LYS 173 Cb 0.06 0.20 -0.39 0.00 0.08 0.00 0.00 32.23 32.19 2dkg h LYS 173 CO -0.07 1.21 -0.91 -0.80 -0.57 0.00 0.00 179.45 178.30 2dkg s ASN 174 N -7.11 2.03 0.65 0.86 0.01 0.21 -4.99 114.94 106.60 2dkg s ASN 174 Ca -0.15 -2.98 0.34 0.00 -0.71 0.00 0.00 52.86 49.36 2dkg s ASN 174 Cb 0.06 -0.55 1.84 0.00 0.41 0.00 0.00 41.25 43.01 2dkg s ASN 174 CO 0.84 -0.19 2.07 -0.65 -1.51 0.00 0.00 177.10 177.66 2dkg h PRO 175 N 5.88 0.00 0.00 -0.60 0.11 -1.54 -1.86 132.00 134.00 2dkg h PRO 175 Ca 0.21 0.00 -0.10 0.00 0.11 0.00 0.00 66.00 66.22 2dkg h PRO 175 Cb 0.91 0.00 -0.02 0.00 0.11 0.00 0.00 31.00 32.00 2dkg h PRO 175 CO 0.39 0.00 -0.66 0.52 -0.21 0.00 0.00 178.00 178.03 2dkg h MET 176 N 0.00 0.00 -0.99 1.05 2.86 -1.94 -3.37 114.93 112.55 2dkg h MET 176 Ca 0.03 0.00 0.20 0.00 -2.06 0.00 0.00 59.70 57.87 2dkg h MET 176 Cb 0.49 0.00 -0.11 0.00 0.06 0.00 0.00 31.60 32.04 2dkg h MET 176 CO -0.00 0.37 0.58 -0.44 1.06 0.00 0.00 176.91 178.48 2dkg h ASP 177 N 0.00 0.71 0.22 1.22 5.19 -1.70 -2.23 116.42 119.83 2dkg h ASP 177 Ca -0.04 0.11 -0.03 0.00 -0.62 0.00 0.00 57.03 56.45 2dkg h ASP 177 Cb 1.36 -0.01 -0.00 0.00 0.18 0.00 0.00 39.33 40.86 2dkg h ASP 177 CO 0.05 0.21 -0.16 -0.29 -3.12 0.00 0.00 179.24 175.94 2dkg h ILE 178 N 0.69 0.94 -0.23 0.35 6.09 -1.77 -2.48 117.51 121.10 2dkg h ILE 178 Ca 0.59 -0.57 -0.02 0.00 -1.37 0.00 0.00 64.86 63.49 2dkg h ILE 178 Cb 0.98 1.32 -0.01 0.00 0.47 0.00 0.00 36.82 39.57 2dkg h ILE 178 CO -0.41 0.15 0.04 -0.07 -3.07 0.00 0.00 178.15 174.78 2dkg h LEU 179 N 0.00 0.29 -0.40 2.19 3.38 -1.67 0.47 115.31 119.58 2dkg h LEU 179 Ca -0.00 -0.03 -0.11 0.00 0.09 0.00 0.00 57.88 57.83 2dkg h LEU 179 Cb 0.31 -0.08 -0.01 0.00 0.09 0.00 0.00 40.66 40.97 2dkg h LEU 179 CO 0.02 0.32 -0.18 0.78 0.09 0.00 0.00 178.44 179.47 2dkg h ASN 180 N 0.32 0.84 -0.13 -0.43 2.35 -1.58 -1.55 115.58 115.41 2dkg h ASN 180 Ca 0.08 -0.40 -0.11 0.00 -0.55 0.00 0.00 56.30 55.32 2dkg h ASN 180 Cb 0.16 -0.23 -0.01 0.00 0.05 0.00 0.00 38.32 38.29 2dkg h ASN 180 CO -0.00 1.05 -0.26 -0.07 -1.65 0.00 0.00 177.43 176.50 2dkg h LEU 181 N 0.63 0.60 -0.12 1.61 3.38 -1.39 -2.17 115.31 117.85 2dkg h LEU 181 Ca 0.09 -0.21 -0.01 0.00 0.09 0.00 0.00 57.88 57.83 2dkg h LEU 181 Cb 0.73 -0.16 -0.00 0.00 0.09 0.00 0.00 40.66 41.31 2dkg h LEU 181 CO 0.06 0.84 0.03 0.58 0.09 0.00 0.00 178.44 180.04 2dkg h VAL 182 N 0.51 1.19 -0.64 1.22 2.07 -0.80 -2.87 116.25 116.94 2dkg h VAL 182 Ca 0.07 -0.60 0.06 0.00 0.82 0.00 0.00 66.70 67.05 2dkg h VAL 182 Cb 0.72 1.38 -0.06 0.00 -1.52 0.00 0.00 31.29 31.81 2dkg h VAL 182 CO 0.06 0.18 0.35 0.03 0.02 0.00 0.00 177.57 178.20 2dkg h ARG 183 N -0.02 0.62 0.00 1.57 3.08 -1.08 0.39 114.38 118.95 2dkg h ARG 183 Ca 0.04 -0.04 0.00 0.00 0.07 0.00 0.00 59.98 60.05 2dkg h ARG 183 Cb 0.25 -0.14 0.00 0.00 0.08 0.00 0.00 29.97 30.16 2dkg h ARG 183 CO 0.00 0.41 0.00 -0.25 -1.07 0.00 0.00 179.97 179.06 2dkg n ASP 184 N -4.82 0.41 0.00 7.04 8.00 -0.83 -3.30 116.55 123.06 2dkg n ASP 184 Ca 0.08 0.60 0.00 0.00 0.71 0.00 0.00 54.79 56.18 2dkg n ASP 184 Cb 0.18 -0.69 0.00 0.00 -0.02 0.00 0.00 41.12 40.59 2dkg n ASP 184 CO 0.00 0.00 0.00 0.59 -0.39 0.00 0.00 177.20 177.40 2dkg n ASN 185 N -1.95 1.18 -4.90 -2.24 3.02 -0.64 -5.06 115.26 104.67 2dkg n ASN 185 Ca 0.03 -1.25 -0.32 0.00 -0.03 0.00 0.00 54.58 53.00 2dkg n ASN 185 Cb 0.21 0.00 -0.05 0.00 -0.61 0.00 0.00 39.78 39.34 2dkg n ASN 185 CO 0.00 0.00 0.00 -0.32 -2.62 0.00 0.00 177.26 174.32 2dkg s MET 186 N -0.25 3.59 -0.32 3.52 1.75 0.04 -0.12 119.30 127.50 2dkg s MET 186 Ca 0.00 -0.12 -0.29 0.00 -1.25 0.00 0.00 55.69 54.03 2dkg s MET 186 Cb 0.00 -2.94 -0.00 0.00 2.84 0.00 0.00 34.83 34.73 2dkg s MET 186 CO 0.00 0.54 1.39 0.42 -0.65 0.00 0.00 175.02 176.72 2dkg s ILE 187 N -1.53 3.99 0.29 10.11 1.01 0.96 -4.84 121.20 131.19 2dkg s ILE 187 Ca 0.36 1.09 0.02 0.00 0.00 0.00 0.00 60.65 62.13 2dkg s ILE 187 Cb -0.13 -4.09 -0.04 0.00 0.01 0.00 0.00 42.46 38.21 2dkg s ILE 187 CO 0.23 -0.52 0.12 -0.76 0.00 0.00 0.00 174.94 174.01 2dkg s LEU 188 N 4.83 1.69 -0.52 2.97 1.43 -1.26 -4.82 118.68 123.00 2dkg s LEU 188 Ca 0.60 -1.47 0.00 0.00 -1.03 0.00 0.00 54.13 52.24 2dkg s LEU 188 Cb -0.17 0.06 0.00 0.00 0.03 0.00 0.00 46.19 46.11 2dkg s LEU 188 CO 0.27 -0.80 0.00 0.61 0.23 0.00 0.00 176.35 176.66 2dkg n GLY 189 N -0.54 0.73 3.48 -3.19 0.00 0.14 -5.00 105.19 100.80 2dkg n GLY 189 Ca -0.00 -0.39 -0.23 0.00 0.00 0.00 0.00 46.02 45.40 2dkg n GLY 189 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 2dkg s VAL 190 N -2.02 1.96 -0.03 1.61 -7.23 -1.26 -4.90 120.40 108.54 2dkg s VAL 190 Ca 0.00 -2.18 -0.30 0.00 -1.81 0.00 0.00 61.98 57.69 2dkg s VAL 190 Cb 0.00 -2.51 -0.03 0.00 0.56 0.00 0.00 36.38 34.40 2dkg s VAL 190 CO 0.00 -0.27 1.06 -0.60 -0.31 0.00 0.00 175.10 174.97 2dkg s ARG 191 N -3.66 4.47 0.16 4.82 3.52 -1.26 -1.44 118.95 125.56 2dkg s ARG 191 Ca 0.31 1.51 0.05 0.00 -0.13 0.00 0.00 55.73 57.46 2dkg s ARG 191 Cb 0.02 -3.48 -0.04 0.00 -1.56 0.00 0.00 34.95 29.89 2dkg s ARG 191 CO 0.14 -0.21 -0.10 0.14 -0.81 0.00 0.00 175.30 174.45 2dkg s VAL 192 N 1.46 1.22 -0.13 7.11 -7.23 0.58 -2.43 120.40 120.98 2dkg s VAL 192 Ca 0.53 -2.07 0.03 0.00 -1.81 0.00 0.00 61.98 58.65 2dkg s VAL 192 Cb -0.22 -1.88 0.01 0.00 0.56 0.00 0.00 36.38 34.84 2dkg s VAL 192 CO 0.25 -0.72 -0.21 -0.75 -0.31 0.00 0.00 175.10 173.35 2dkg s LYS 193 N -3.74 2.91 -0.20 4.82 2.20 0.13 -1.50 119.74 124.36 2dkg s LYS 193 Ca 0.18 -0.82 -0.11 0.00 -0.36 0.00 0.00 55.97 54.86 2dkg s LYS 193 Cb 0.02 -2.34 -0.05 0.00 -1.51 0.00 0.00 37.83 33.95 2dkg s LYS 193 CO 0.01 0.00 0.15 0.42 -0.36 0.00 0.00 175.35 175.58 2dkg s ILE 194 N 0.78 5.39 -0.20 5.43 -1.09 -0.04 -1.33 121.20 130.14 2dkg s ILE 194 Ca -0.08 0.23 -0.02 0.00 -2.23 0.00 0.00 60.65 58.55 2dkg s ILE 194 Cb -0.16 -3.49 0.00 0.00 -1.58 0.00 0.00 42.46 37.23 2dkg s ILE 194 CO -0.01 0.42 -0.10 -0.76 -1.23 0.00 0.00 174.94 173.27 2dkg s LEU 195 N 0.45 2.62 0.00 2.97 1.02 0.67 -2.24 118.68 124.18 2dkg s LEU 195 Ca 0.09 -0.48 0.00 0.00 0.02 0.00 0.00 54.13 53.76 2dkg s LEU 195 Cb -0.11 -1.64 0.00 0.00 0.02 0.00 0.00 46.19 44.45 2dkg s LEU 195 CO -0.01 -0.01 0.00 0.61 0.02 0.00 0.00 176.35 176.97 2dkg n GLY 196 N 4.69 2.74 3.52 -3.19 0.00 -1.26 -0.77 105.19 110.92 2dkg n GLY 196 Ca -0.19 0.02 -0.43 0.00 0.00 0.00 0.00 46.02 45.41 2dkg n GLY 196 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 2dkg s ASP 197 N 1.70 6.88 0.00 1.61 -1.08 -1.26 -4.70 116.67 119.82 2dkg s ASP 197 Ca 0.00 -2.53 0.00 0.00 -0.52 0.00 0.00 52.55 49.50 2dkg s ASP 197 Cb 0.00 -2.49 0.00 0.00 -1.46 0.00 0.00 42.92 38.97 2dkg s ASP 197 CO 0.00 -1.02 0.00 0.61 0.52 0.00 0.00 175.17 175.28 2dkg n GLY 198 N 5.04 0.76 0.00 2.66 0.00 -1.26 -5.04 105.19 107.35 2dkg n GLY 198 Ca 0.40 -1.24 0.00 0.00 0.00 0.00 0.00 46.02 45.18 2dkg n GLY 198 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 2dkg n SER 199 N 0.00 0.00 -3.50 1.61 3.41 -1.26 -4.68 113.62 109.20 2dkg n SER 199 Ca 0.00 0.00 -0.11 0.00 -0.26 0.00 0.00 58.87 58.50 2dkg n SER 199 Cb 0.00 0.00 -0.03 0.00 -0.26 0.00 0.00 64.21 63.92 2dkg n SER 199 CO 0.00 0.00 0.00 0.72 -0.16 0.00 0.00 175.04 175.60 2dkg s PHE 200 N -2.00 -0.44 0.21 7.33 -0.12 -0.95 -4.99 117.98 117.01 2dkg s PHE 200 Ca 0.00 0.46 0.08 0.00 -0.05 0.00 0.00 56.93 57.42 2dkg s PHE 200 Cb 0.00 0.51 -0.04 0.00 -0.63 0.00 0.00 43.02 42.85 2dkg s PHE 200 CO 0.00 -0.58 -0.03 -1.21 -0.05 0.00 0.00 175.22 173.35 2dkg s GLU 201 N -2.58 2.28 0.00 1.99 2.02 -1.26 -0.86 118.70 120.30 2dkg s GLU 201 Ca 0.00 -1.25 0.00 0.00 0.02 0.00 0.00 54.97 53.74 2dkg s GLU 201 Cb -0.01 -2.24 0.00 0.00 0.10 0.00 0.00 34.13 31.98 2dkg s GLU 201 CO -0.05 0.42 0.00 0.41 0.02 0.00 0.00 175.26 176.06 2dkg n GLY 202 N -0.34 -0.35 3.70 -1.39 0.00 -0.56 -4.48 105.19 101.77 2dkg n GLY 202 Ca -0.09 -1.04 -0.40 0.00 0.00 0.00 0.00 46.02 44.49 2dkg n GLY 202 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2dkg s ILE 203 N -2.00 5.04 -0.69 -0.61 -1.09 -0.54 -0.31 121.20 121.00 2dkg s ILE 203 Ca 0.00 1.35 -0.26 0.00 -2.23 0.00 0.00 60.65 59.52 2dkg s ILE 203 Cb 0.00 -4.00 0.04 0.00 -1.58 0.00 0.00 42.46 36.92 2dkg s ILE 203 CO 0.00 0.20 1.15 0.00 -1.23 0.00 0.00 174.94 175.07 2dkg s ALA 204 N 1.19 2.91 -0.00 9.38 0.00 -0.52 -1.42 121.76 133.30 2dkg s ALA 204 Ca 0.34 -1.44 0.11 0.00 0.00 0.00 0.00 51.96 50.97 2dkg s ALA 204 Cb -0.17 -4.08 -0.23 0.00 0.00 0.00 0.00 23.12 18.64 2dkg s ALA 204 CO 0.15 -3.01 0.82 0.93 0.00 0.00 0.00 175.76 174.65 2dkg h GLU 205 N 9.79 0.00 0.00 0.00 5.08 -1.69 0.41 114.58 128.17 2dkg h GLU 205 Ca -0.28 -0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.08 2dkg h GLU 205 Cb 1.06 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.31 2dkg h GLU 205 CO 1.23 0.62 0.00 -3.47 -1.00 0.00 0.00 179.01 176.39 2dkg n ASP 206 N -3.12 0.00 -4.68 1.42 2.03 -1.25 -4.61 116.55 106.34 2dkg n ASP 206 Ca -0.12 0.00 -0.32 0.00 0.52 0.00 0.00 54.79 54.87 2dkg n ASP 206 Cb 1.02 0.00 -0.09 0.00 -0.72 0.00 0.00 41.12 41.34 2dkg n ASP 206 CO 0.00 0.00 0.00 0.27 -1.92 0.00 0.00 177.20 175.55 2dkg s ILE 207 N -2.00 4.09 0.23 5.18 -4.36 -1.26 -0.02 121.20 123.06 2dkg s ILE 207 Ca 0.00 -0.70 -0.01 0.00 -0.26 0.00 0.00 60.65 59.68 2dkg s ILE 207 Cb 0.00 -2.85 0.05 0.00 1.25 0.00 0.00 42.46 40.91 2dkg s ILE 207 CO 0.00 0.32 0.32 -0.90 0.24 0.00 0.00 174.94 174.92 2dkg n ASP 208 N 1.23 0.29 0.00 4.36 5.68 0.41 -4.86 116.55 123.65 2dkg n ASP 208 Ca -0.14 -1.28 0.04 0.00 -0.50 0.00 0.00 54.79 52.91 2dkg n ASP 208 Cb 0.52 -0.22 0.21 0.00 -1.14 0.00 0.00 41.12 40.50 2dkg n ASP 208 CO 0.00 0.00 0.00 -0.90 -1.33 0.00 0.00 177.20 174.97 2dkg n ASP 209 N -3.05 0.00 -0.07 -1.12 5.75 -1.26 -0.91 116.55 115.89 2dkg n ASP 209 Ca 0.05 -0.21 0.01 0.00 -0.01 0.00 0.00 54.79 54.62 2dkg n ASP 209 Cb 0.17 -0.01 0.01 0.00 -1.03 0.00 0.00 41.12 40.26 2dkg n ASP 209 CO 0.00 0.00 0.00 0.49 -0.11 0.00 0.00 177.20 177.58 2dkg n PHE 210 N -1.01 0.02 -0.70 2.11 3.01 -1.26 -4.97 117.46 114.66 2dkg n PHE 210 Ca 0.05 -0.11 0.00 0.00 1.01 0.00 0.00 57.45 58.40 2dkg n PHE 210 Cb 0.03 -0.01 0.00 0.00 -0.01 0.00 0.00 39.48 39.48 2dkg n PHE 210 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 2dkg n GLY 211 N -0.01 0.75 3.76 1.37 0.00 -0.08 -4.89 105.19 106.09 2dkg n GLY 211 Ca 0.01 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.63 2dkg n GLY 211 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2dkg s ARG 212 N -0.30 4.57 -0.10 1.61 0.52 -1.26 -4.69 118.95 119.30 2dkg s ARG 212 Ca 0.00 1.89 -0.27 0.00 -0.52 0.00 0.00 55.73 56.82 2dkg s ARG 212 Cb 0.00 -3.17 -0.02 0.00 0.52 0.00 0.00 34.95 32.28 2dkg s ARG 212 CO 0.00 0.11 0.90 -1.17 0.02 0.00 0.00 175.30 175.16 2dkg s LEU 213 N -1.38 4.26 -0.27 2.53 2.96 -0.43 -0.45 118.68 125.90 2dkg s LEU 213 Ca 0.46 1.40 -0.18 0.00 -0.22 0.00 0.00 54.13 55.60 2dkg s LEU 213 Cb -0.33 -3.40 -0.02 0.00 0.50 0.00 0.00 46.19 42.94 2dkg s LEU 213 CO 0.43 -0.34 0.51 -0.63 -1.32 0.00 0.00 176.35 174.99 2dkg s ILE 214 N 1.65 5.07 -0.10 6.68 -1.09 0.98 -0.30 121.20 134.09 2dkg s ILE 214 Ca 0.45 0.80 0.01 0.00 -2.23 0.00 0.00 60.65 59.68 2dkg s ILE 214 Cb -0.18 -3.84 -0.02 0.00 -1.58 0.00 0.00 42.46 36.84 2dkg s ILE 214 CO 0.18 0.05 -0.13 -0.63 -1.23 0.00 0.00 174.94 173.18 2dkg s ILE 215 N 2.31 3.06 -0.36 2.92 -1.09 -0.13 -1.82 121.20 126.10 2dkg s ILE 215 Ca 0.21 -0.68 -0.06 0.00 -2.23 0.00 0.00 60.65 57.88 2dkg s ILE 215 Cb -0.16 -2.25 0.06 0.00 -1.58 0.00 0.00 42.46 38.53 2dkg s ILE 215 CO 0.10 0.55 0.13 -0.60 -1.23 0.00 0.00 174.94 173.89 2dkg s ARG 216 N -0.10 2.51 0.68 2.79 3.00 -0.50 -0.86 118.95 126.47 2dkg s ARG 216 Ca -0.02 -1.32 -0.11 0.00 -1.00 0.00 0.00 55.73 53.28 2dkg s ARG 216 Cb -0.14 -3.50 0.00 0.00 0.00 0.00 0.00 34.95 31.32 2dkg s ARG 216 CO 0.04 -0.76 1.06 -0.51 0.00 0.00 0.00 175.30 175.12 2dkg s LEU 217 N 1.35 3.14 0.50 -0.88 1.02 0.14 -1.47 118.68 122.48 2dkg s LEU 217 Ca -0.00 1.58 0.25 0.00 0.02 0.00 0.00 54.13 55.98 2dkg s LEU 217 Cb -0.21 -4.48 1.33 0.00 0.02 0.00 0.00 46.19 42.85 2dkg s LEU 217 CO 0.01 -1.36 1.92 0.44 0.02 0.00 0.00 176.35 177.38 2dkg h ASP 218 N -0.66 0.13 0.57 2.29 3.32 -1.88 0.34 116.42 120.52 2dkg h ASP 218 Ca -0.44 0.01 0.00 0.00 0.02 0.00 0.00 57.03 56.62 2dkg h ASP 218 Cb 1.21 -0.01 0.00 0.00 0.22 0.00 0.00 39.33 40.75 2dkg h ASP 218 CO 0.58 0.06 0.00 -1.54 -1.72 0.00 0.00 179.24 176.61 2dkg n SER 219 N -4.38 0.00 0.00 6.45 3.41 -1.26 -4.83 113.62 113.02 2dkg n SER 219 Ca 0.15 0.46 0.00 0.00 -0.26 0.00 0.00 58.87 59.22 2dkg n SER 219 Cb 0.75 -0.48 0.00 0.00 -0.26 0.00 0.00 64.21 64.22 2dkg n SER 219 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2dkg n GLY 220 N 0.27 0.70 3.76 5.00 0.00 0.12 -5.04 105.19 110.00 2dkg n GLY 220 Ca 0.05 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.65 2dkg n GLY 220 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 2dkg s GLU 221 N -0.92 4.12 -0.19 1.61 2.12 -1.24 -4.71 118.70 119.50 2dkg s GLU 221 Ca 0.00 2.56 -0.05 0.00 0.36 0.00 0.00 54.97 57.85 2dkg s GLU 221 Cb 0.00 -3.00 -0.02 0.00 0.26 0.00 0.00 34.13 31.37 2dkg s GLU 221 CO 0.00 -0.57 -0.01 0.08 -0.54 0.00 0.00 175.26 174.21 2dkg s VAL 222 N -0.58 3.91 0.11 3.70 1.01 -1.26 -0.68 120.40 126.61 2dkg s VAL 222 Ca 0.58 -0.33 0.10 0.00 0.00 0.00 0.00 61.98 62.32 2dkg s VAL 222 Cb -0.47 -2.75 -0.04 0.00 0.00 0.00 0.00 36.38 33.12 2dkg s VAL 222 CO 0.56 0.45 -0.21 -0.54 0.00 0.00 0.00 175.10 175.35 2dkg s LYS 223 N 0.80 1.67 -0.25 2.72 1.02 -0.04 -4.98 119.74 120.68 2dkg s LYS 223 Ca -0.00 -1.22 -0.00 0.00 0.02 0.00 0.00 55.97 54.76 2dkg s LYS 223 Cb -0.14 -2.04 0.04 0.00 -0.52 0.00 0.00 37.83 35.17 2dkg s LYS 223 CO 0.02 0.47 -0.08 0.15 -0.92 0.00 0.00 175.35 175.00 2dkg s LYS 224 N -2.04 2.60 -0.18 1.68 1.02 -1.26 -0.96 119.74 120.61 2dkg s LYS 224 Ca 0.16 -1.12 -0.19 0.00 0.02 0.00 0.00 55.97 54.84 2dkg s LYS 224 Cb -0.10 -2.95 -0.03 0.00 -0.52 0.00 0.00 37.83 34.22 2dkg s LYS 224 CO 0.08 -0.47 0.53 0.08 -0.92 0.00 0.00 175.35 174.65 2dkg s VAL 225 N 1.24 5.11 -0.19 3.17 1.01 0.59 -4.90 120.40 126.44 2dkg s VAL 225 Ca -0.03 1.00 -0.09 0.00 0.00 0.00 0.00 61.98 62.86 2dkg s VAL 225 Cb -0.18 -3.85 -0.05 0.00 0.00 0.00 0.00 36.38 32.30 2dkg s VAL 225 CO -0.05 0.20 0.10 -0.63 0.00 0.00 0.00 175.10 174.72 2dkg s ILE 226 N 1.45 5.11 -0.14 2.22 1.01 -1.26 -1.32 121.20 128.27 2dkg s ILE 226 Ca 0.25 0.08 -0.29 0.00 0.00 0.00 0.00 60.65 60.69 2dkg s ILE 226 Cb -0.15 -3.32 -0.02 0.00 0.01 0.00 0.00 42.46 38.98 2dkg s ILE 226 CO 0.10 0.45 1.18 -0.72 0.00 0.00 0.00 174.94 175.95 2dkg s TYR 227 N 0.34 3.10 0.00 3.97 -0.85 -1.26 -4.77 117.35 117.88 2dkg s TYR 227 Ca 0.06 1.21 0.00 0.00 -0.52 0.00 0.00 57.07 57.82 2dkg s TYR 227 Cb -0.12 -3.41 0.00 0.00 0.38 0.00 0.00 41.96 38.82 2dkg s TYR 227 CO -0.01 -1.22 0.00 0.41 -1.52 0.00 0.00 175.55 173.21 2dkg n GLY 228 N 3.43 1.05 2.63 5.49 0.00 -1.26 -4.97 105.19 111.57 2dkg n GLY 228 Ca 0.12 0.32 -0.36 0.00 0.00 0.00 0.00 46.02 46.10 2dkg n GLY 228 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 2dkg n ASP 229 N 0.00 7.24 -4.36 1.61 8.00 -1.26 -4.91 116.55 122.86 2dkg n ASP 229 Ca 0.00 -3.45 -0.19 0.00 0.71 0.00 0.00 54.79 51.86 2dkg n ASP 229 Cb 0.00 -1.20 -0.10 0.00 -0.02 0.00 0.00 41.12 39.80 2dkg n ASP 229 CO 0.00 0.00 0.00 0.54 -0.39 0.00 0.00 177.20 177.35 2dkg s VAL 230 N -3.17 1.58 0.00 2.53 0.11 -1.26 -4.63 120.40 115.56 2dkg s VAL 230 Ca 0.53 -2.15 -0.01 0.00 -2.93 0.00 0.00 61.98 57.42 2dkg s VAL 230 Cb 0.33 -2.17 -0.00 0.00 -1.53 0.00 0.00 36.38 33.00 2dkg s VAL 230 CO -0.24 -0.50 0.01 -0.55 -3.33 0.00 0.00 175.10 170.49 2dkg s SER 231 N -3.34 0.05 -0.05 3.54 0.15 0.05 -4.97 113.70 109.13 2dkg s SER 231 Ca 0.25 -0.10 0.04 0.00 0.70 0.00 0.00 55.95 56.83 2dkg s SER 231 Cb 0.02 0.05 -0.02 0.00 -1.71 0.00 0.00 66.02 64.35 2dkg s SER 231 CO 0.08 -0.09 -0.16 -0.22 1.20 0.00 0.00 173.24 174.05 2dkg s LEU 232 N -0.38 2.62 -0.01 3.45 0.20 -1.26 -0.24 118.68 123.06 2dkg s LEU 232 Ca -0.04 -0.25 0.01 0.00 0.69 0.00 0.00 54.13 54.53 2dkg s LEU 232 Cb -0.03 -1.53 0.01 0.00 -0.43 0.00 0.00 46.19 44.21 2dkg s LEU 232 CO -0.00 0.32 -0.02 -0.13 -0.29 0.00 0.00 176.35 176.23 2dkg s ARG 233 N -0.59 0.23 0.29 1.98 0.52 -0.44 -4.98 118.95 115.96 2dkg s ARG 233 Ca 0.08 -0.04 -0.20 0.00 -0.52 0.00 0.00 55.73 55.06 2dkg s ARG 233 Cb -0.11 -0.28 -0.09 0.00 0.52 0.00 0.00 34.95 34.99 2dkg s ARG 233 CO 0.01 -0.00 0.79 -0.06 0.02 0.00 0.00 175.30 176.06 2dkg s PHE 234 N 0.26 3.55 -2.57 -0.53 0.08 -1.26 0.21 117.98 117.72 2dkg s PHE 234 Ca -0.02 1.44 0.27 0.00 0.12 0.00 0.00 56.93 58.75 2dkg s PHE 234 Cb -0.05 -2.68 0.92 0.00 -0.57 0.00 0.00 43.02 40.64 2dkg s PHE 234 CO -0.01 0.20 1.67 1.28 -0.10 0.00 0.00 175.22 178.27