#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2dxt h LEU 2 N 0.00 0.00 -0.97 3.17 3.38 -2.05 -3.47 115.31 115.37 2dxt h LEU 2 Ca 0.00 0.00 -0.43 0.00 0.09 0.00 0.00 57.88 57.54 2dxt h LEU 2 Cb 0.00 0.00 0.07 0.00 0.09 0.00 0.00 40.66 40.82 2dxt h LEU 2 CO 0.00 0.28 -0.72 0.61 0.09 0.00 0.00 178.44 178.70 2dxt n GLY 3 N 1.05 -0.51 3.77 0.83 0.00 -1.26 -4.94 105.19 104.13 2dxt n GLY 3 Ca 0.03 0.22 -0.41 0.00 0.00 0.00 0.00 46.02 45.86 2dxt n GLY 3 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2dxt s LEU 4 N -7.24 4.43 -0.01 0.99 1.43 -1.26 -4.92 118.68 112.09 2dxt s LEU 4 Ca 0.57 2.66 0.14 0.00 -1.03 0.00 0.00 54.13 56.48 2dxt s LEU 4 Cb -0.27 -3.64 0.43 0.00 0.03 0.00 0.00 46.19 42.73 2dxt s LEU 4 CO 0.77 -0.54 1.35 0.29 0.23 0.00 0.00 176.35 178.46 2dxt n LYS 5 N 1.06 2.87 -1.23 1.70 4.76 -1.26 -5.02 118.16 121.04 2dxt n LYS 5 Ca 0.01 -2.28 -0.31 0.00 -2.87 0.00 0.00 58.31 52.85 2dxt n LYS 5 Cb 0.42 -1.40 0.10 0.00 -1.84 0.00 0.00 35.03 32.31 2dxt n LYS 5 CO 0.00 0.00 0.00 0.95 -1.37 0.00 0.00 177.40 176.98 2dxt s THR 6 N -1.10 3.24 -0.14 -0.18 -4.23 -1.26 -5.01 115.64 106.95 2dxt s THR 6 Ca 0.32 0.41 -0.19 0.00 -1.18 0.00 0.00 61.69 61.05 2dxt s THR 6 Cb 0.17 -2.86 -0.24 0.00 1.34 0.00 0.00 72.50 70.91 2dxt s THR 6 CO 0.21 -0.52 0.46 0.28 -0.54 0.00 0.00 174.62 174.50 2dxt h SER 7 N -1.16 0.21 0.00 3.99 0.02 -1.95 -3.45 113.55 111.20 2dxt h SER 7 Ca -0.44 -0.76 0.00 0.00 -0.84 0.00 0.00 61.79 59.75 2dxt h SER 7 Cb 1.23 -0.07 0.00 0.00 0.14 0.00 0.00 62.40 63.71 2dxt h SER 7 CO 0.51 1.52 -0.16 -0.38 -1.14 0.00 0.00 176.83 177.17 2dxt n ILE 8 N -4.15 0.98 -2.25 3.27 5.41 -1.26 -4.82 119.36 116.55 2dxt n ILE 8 Ca -0.26 0.33 -0.43 0.00 1.00 0.00 0.00 62.75 63.39 2dxt n ILE 8 Cb 0.78 -1.52 -0.02 0.00 -0.71 0.00 0.00 39.64 38.17 2dxt n ILE 8 CO 0.00 0.00 0.00 -0.63 0.00 0.00 0.00 176.55 175.92 2dxt s ILE 9 N -2.00 3.80 0.00 1.39 1.01 -1.26 -2.40 121.20 121.74 2dxt s ILE 9 Ca 0.00 0.83 0.00 0.00 0.00 0.00 0.00 60.65 61.48 2dxt s ILE 9 Cb 0.00 -4.01 0.00 0.00 0.01 0.00 0.00 42.46 38.46 2dxt s ILE 9 CO 0.00 -0.60 0.00 0.61 0.00 0.00 0.00 174.94 174.95 2dxt n GLY 10 N 5.05 0.91 0.33 6.18 0.00 0.27 -4.73 105.19 113.20 2dxt n GLY 10 Ca 0.18 0.00 0.12 0.00 0.00 0.00 0.00 46.02 46.32 2dxt n GLY 10 CO 0.00 0.00 0.00 3.21 0.00 0.00 0.00 173.32 176.53 2dxt h ARG 11 N 1.98 0.21 -3.94 1.61 3.08 -1.59 -3.41 114.38 112.32 2dxt h ARG 11 Ca 0.00 -0.01 -0.21 0.00 0.07 0.00 0.00 59.98 59.83 2dxt h ARG 11 Cb 0.00 -0.05 -0.24 0.00 0.08 0.00 0.00 29.97 29.76 2dxt h ARG 11 CO 0.00 0.14 -0.71 1.03 -1.07 0.00 0.00 179.97 179.35 2dxt s ARG 12 N -5.22 0.21 -0.04 0.04 0.52 -1.26 -5.06 118.95 108.13 2dxt s ARG 12 Ca -0.06 -0.35 0.00 0.00 -0.52 0.00 0.00 55.73 54.80 2dxt s ARG 12 Cb 0.19 0.01 0.02 0.00 0.52 0.00 0.00 34.95 35.69 2dxt s ARG 12 CO 0.72 -0.01 -0.02 0.08 0.02 0.00 0.00 175.30 176.09 2dxt s VAL 13 N -0.78 0.36 -0.28 3.52 1.01 -1.26 -1.16 120.40 121.81 2dxt s VAL 13 Ca -0.08 0.02 -0.05 0.00 0.00 0.00 0.00 61.98 61.87 2dxt s VAL 13 Cb -0.05 -0.45 0.02 0.00 0.00 0.00 0.00 36.38 35.90 2dxt s VAL 13 CO -0.00 0.20 0.03 -0.63 0.00 0.00 0.00 175.10 174.70 2dxt s ILE 14 N 1.21 3.57 -0.12 2.22 1.01 0.83 -4.96 121.20 124.96 2dxt s ILE 14 Ca -0.07 -0.83 -0.05 0.00 0.00 0.00 0.00 60.65 59.69 2dxt s ILE 14 Cb -0.14 -2.84 -0.04 0.00 0.01 0.00 0.00 42.46 39.45 2dxt s ILE 14 CO -0.02 0.11 0.09 -0.47 0.00 0.00 0.00 174.94 174.65 2dxt s TYR 15 N 1.43 3.42 -0.05 3.97 5.04 -1.26 -0.93 117.35 128.97 2dxt s TYR 15 Ca 0.01 0.38 0.05 0.00 -2.44 0.00 0.00 57.07 55.07 2dxt s TYR 15 Cb -0.17 -1.91 -0.00 0.00 0.35 0.00 0.00 41.96 40.23 2dxt s TYR 15 CO 0.00 0.59 -0.19 -0.06 -1.34 0.00 0.00 175.55 174.55 2dxt s PHE 16 N -0.83 1.95 0.24 4.97 0.40 0.16 -4.97 117.98 119.90 2dxt s PHE 16 Ca 0.13 -0.60 -0.06 0.00 -0.60 0.00 0.00 56.93 55.81 2dxt s PHE 16 Cb -0.12 -1.31 0.23 0.00 0.51 0.00 0.00 43.02 42.34 2dxt s PHE 16 CO 0.03 -0.20 1.81 1.96 0.70 0.00 0.00 175.22 179.52 2dxt h GLN 17 N 6.28 1.13 -2.92 0.44 4.20 -1.94 -1.65 115.11 120.65 2dxt h GLN 17 Ca -0.31 -0.19 -0.14 0.00 0.06 0.00 0.00 58.65 58.07 2dxt h GLN 17 Cb 1.18 -0.19 -0.24 0.00 0.30 0.00 0.00 27.48 28.53 2dxt h GLN 17 CO 0.47 0.90 -0.31 -2.00 -0.67 0.00 0.00 178.83 177.23 2dxt s GLU 18 N -5.55 0.43 0.11 1.46 2.12 -1.26 -3.23 118.70 112.78 2dxt s GLU 18 Ca -0.12 0.40 -0.12 0.00 0.36 0.00 0.00 54.97 55.49 2dxt s GLU 18 Cb 0.16 0.21 0.02 0.00 0.26 0.00 0.00 34.13 34.77 2dxt s GLU 18 CO 0.83 -0.06 0.29 -1.50 -0.54 0.00 0.00 175.26 174.28 2dxt s ILE 19 N 0.02 0.11 -0.00 -3.70 2.07 -0.88 -5.01 121.20 113.80 2dxt s ILE 19 Ca -0.01 -0.89 -0.23 0.00 -1.41 0.00 0.00 60.65 58.11 2dxt s ILE 19 Cb -0.03 -1.27 -0.13 0.00 0.13 0.00 0.00 42.46 41.17 2dxt s ILE 19 CO 0.01 -0.48 0.95 0.71 -1.91 0.00 0.00 174.94 174.22 2dxt h THR 20 N 2.56 0.05 -2.11 4.00 1.35 -1.94 0.14 112.91 116.96 2dxt h THR 20 Ca -0.34 -0.43 -0.01 0.00 -0.55 0.00 0.00 66.41 65.09 2dxt h THR 20 Cb 1.23 0.08 -0.22 0.00 -1.73 0.00 0.00 68.15 67.50 2dxt h THR 20 CO 0.51 0.01 -0.03 -0.55 -0.25 0.00 0.00 175.52 175.22 2dxt s SER 21 N -4.66 -0.86 0.36 5.36 0.15 -1.26 -0.32 113.70 112.46 2dxt s SER 21 Ca -0.12 1.41 0.08 0.00 0.70 0.00 0.00 55.95 58.02 2dxt s SER 21 Cb 0.01 1.29 0.67 0.00 -1.71 0.00 0.00 66.02 66.28 2dxt s SER 21 CO 0.37 -0.23 1.85 0.71 1.20 0.00 0.00 173.24 177.13 2dxt h THR 22 N 5.03 1.22 -0.23 6.45 1.35 -1.92 -1.49 112.91 123.33 2dxt h THR 22 Ca -0.31 -1.00 -0.05 0.00 -0.55 0.00 0.00 66.41 64.50 2dxt h THR 22 Cb 1.22 1.33 -0.01 0.00 -1.73 0.00 0.00 68.15 68.96 2dxt h THR 22 CO 0.18 0.31 -0.05 0.78 -0.25 0.00 0.00 175.52 176.48 2dxt h ASN 23 N 0.24 0.44 -0.58 5.36 4.21 -1.93 -0.89 115.58 122.42 2dxt h ASN 23 Ca 0.04 -0.36 -0.00 0.00 1.21 0.00 0.00 56.30 57.19 2dxt h ASN 23 Cb 0.50 -0.12 -0.03 0.00 -1.12 0.00 0.00 38.32 37.55 2dxt h ASN 23 CO 0.03 0.70 0.35 -0.33 -1.29 0.00 0.00 177.43 176.90 2dxt h GLU 24 N 0.18 0.79 -0.45 0.81 4.39 -1.90 -1.19 114.58 117.21 2dxt h GLU 24 Ca 0.06 -0.07 -0.02 0.00 0.34 0.00 0.00 59.36 59.67 2dxt h GLU 24 Cb 0.51 -0.17 -0.02 0.00 -0.10 0.00 0.00 28.75 28.97 2dxt h GLU 24 CO 0.02 0.57 0.20 0.35 -1.16 0.00 0.00 179.01 178.99 2dxt h PHE 25 N 0.79 0.66 -0.27 4.33 3.57 -1.20 -2.22 116.94 122.61 2dxt h PHE 25 Ca 0.21 -0.04 -0.03 0.00 3.53 0.00 0.00 57.97 61.64 2dxt h PHE 25 Cb -0.02 -0.20 -0.01 0.00 2.79 0.00 0.00 35.95 38.50 2dxt h PHE 25 CO -0.02 0.55 0.02 0.00 -2.23 0.00 0.00 178.31 176.63 2dxt h ALA 26 N 1.05 1.54 -0.10 2.41 0.00 -0.84 -2.29 119.26 121.03 2dxt h ALA 26 Ca 0.15 -0.15 -0.13 0.00 0.00 0.00 0.00 54.91 54.78 2dxt h ALA 26 Cb 0.15 -0.12 0.01 0.00 0.00 0.00 0.00 17.79 17.82 2dxt h ALA 26 CO -0.02 0.34 -0.46 0.87 0.00 0.00 0.00 179.25 179.98 2dxt h LYS 27 N 0.39 0.48 -0.12 0.00 1.57 -0.92 -3.31 116.57 114.67 2dxt h LYS 27 Ca 0.09 -0.39 0.00 0.00 -1.87 0.00 0.00 60.65 58.48 2dxt h LYS 27 Cb 0.22 0.08 0.00 0.00 0.08 0.00 0.00 32.23 32.61 2dxt h LYS 27 CO 0.00 1.02 0.00 0.25 -0.57 0.00 0.00 179.45 180.15 2dxt n THR 28 N -4.28 0.15 -5.15 -0.16 -2.24 -0.86 -4.85 114.28 96.89 2dxt n THR 28 Ca -0.08 -0.27 -0.30 0.00 -2.27 0.00 0.00 64.05 61.13 2dxt n THR 28 Cb 0.58 0.24 -0.16 0.00 -2.10 0.00 0.00 70.33 68.89 2dxt n THR 28 CO 0.00 0.00 0.00 -0.44 -0.57 0.00 0.00 175.07 174.06 2dxt s SER 29 N -1.62 2.94 -0.14 3.42 0.01 -0.87 -5.07 113.70 112.36 2dxt s SER 29 Ca 0.32 -0.48 -0.29 0.00 1.31 0.00 0.00 55.95 56.81 2dxt s SER 29 Cb 0.17 -0.31 -0.02 0.00 0.21 0.00 0.00 66.02 66.07 2dxt s SER 29 CO 0.26 0.29 1.22 -0.47 0.41 0.00 0.00 173.24 174.95 2dxt s TYR 30 N -0.63 2.99 -0.02 2.43 5.04 -1.26 -4.88 117.35 121.02 2dxt s TYR 30 Ca 0.10 1.11 -0.02 0.00 -2.44 0.00 0.00 57.07 55.82 2dxt s TYR 30 Cb -0.10 -3.46 0.00 0.00 0.35 0.00 0.00 41.96 38.76 2dxt s TYR 30 CO -0.00 -1.48 0.06 -0.51 -1.34 0.00 0.00 175.55 172.28 2dxt s LEU 31 N 3.10 1.80 0.67 6.97 1.43 -1.26 -5.15 118.68 126.23 2dxt s LEU 31 Ca 0.54 0.05 -0.13 0.00 -1.03 0.00 0.00 54.13 53.56 2dxt s LEU 31 Cb -0.22 0.23 -0.00 0.00 0.03 0.00 0.00 46.19 46.23 2dxt s LEU 31 CO 0.16 -0.06 1.07 -1.83 0.23 0.00 0.00 176.35 175.92 2dxt s GLU 32 N -0.17 2.94 0.34 1.70 -1.05 -1.26 -4.95 118.70 116.25 2dxt s GLU 32 Ca -0.02 1.13 -0.28 0.00 -0.15 0.00 0.00 54.97 55.65 2dxt s GLU 32 Cb -0.02 -1.98 -0.12 0.00 -0.44 0.00 0.00 34.13 31.57 2dxt s GLU 32 CO 0.00 -1.11 1.34 -1.91 0.95 0.00 0.00 175.26 174.54 2dxt n GLU 33 N -2.72 2.23 0.00 -4.83 2.13 -1.26 -2.24 120.64 113.95 2dxt n GLU 33 Ca 0.09 0.78 0.00 0.00 0.66 0.00 0.00 57.16 58.69 2dxt n GLU 33 Cb 0.53 -2.40 0.00 0.00 0.27 0.00 0.00 31.44 29.84 2dxt n GLU 33 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 2dxt n GLY 34 N 0.91 1.17 3.73 8.31 0.00 0.77 -4.89 105.19 115.19 2dxt n GLY 34 Ca 0.05 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.65 2dxt n GLY 34 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2dxt s THR 35 N -2.30 2.85 -0.15 2.61 2.01 -0.95 -0.56 115.64 119.15 2dxt s THR 35 Ca 0.00 0.67 -0.04 0.00 0.31 0.00 0.00 61.69 62.63 2dxt s THR 35 Cb 0.00 -3.43 -0.03 0.00 0.01 0.00 0.00 72.50 69.05 2dxt s THR 35 CO 0.00 0.08 -0.03 -0.69 -0.69 0.00 0.00 174.62 173.29 2dxt s VAL 36 N 0.45 3.97 -0.22 3.82 1.01 -0.31 -1.49 120.40 127.63 2dxt s VAL 36 Ca 0.62 -0.33 -0.05 0.00 0.00 0.00 0.00 61.98 62.22 2dxt s VAL 36 Cb -0.40 -2.74 -0.02 0.00 0.00 0.00 0.00 36.38 33.22 2dxt s VAL 36 CO 0.38 0.50 0.00 -0.63 0.00 0.00 0.00 175.10 175.35 2dxt s ILE 37 N 0.26 3.81 0.01 2.22 -1.09 0.68 -0.12 121.20 126.97 2dxt s ILE 37 Ca -0.02 -0.35 0.02 0.00 -2.23 0.00 0.00 60.65 58.06 2dxt s ILE 37 Cb -0.14 -2.74 -0.01 0.00 -1.58 0.00 0.00 42.46 37.99 2dxt s ILE 37 CO 0.03 0.40 -0.05 0.54 -1.23 0.00 0.00 174.94 174.62 2dxt s VAL 38 N 1.36 0.39 0.02 2.92 0.11 -0.10 -0.52 120.40 124.57 2dxt s VAL 38 Ca 0.04 -0.56 0.00 0.00 -2.93 0.00 0.00 61.98 58.53 2dxt s VAL 38 Cb -0.15 -0.40 -0.02 0.00 -1.53 0.00 0.00 36.38 34.29 2dxt s VAL 38 CO 0.00 -0.13 -0.03 0.00 -3.33 0.00 0.00 175.10 171.62 2dxt s ALA 39 N -0.67 0.11 0.23 1.54 0.00 -0.92 -0.66 121.76 121.39 2dxt s ALA 39 Ca -0.04 -0.51 -0.06 0.00 0.00 0.00 0.00 51.96 51.35 2dxt s ALA 39 Cb -0.05 0.13 0.23 0.00 0.00 0.00 0.00 23.12 23.42 2dxt s ALA 39 CO -0.00 -0.13 1.78 -0.44 0.00 0.00 0.00 175.76 176.97 2dxt h ASP 40 N 4.87 0.99 -4.69 0.00 3.32 -1.34 -3.37 116.42 116.20 2dxt h ASP 40 Ca -0.31 -0.18 -0.13 0.00 0.02 0.00 0.00 57.03 56.43 2dxt h ASP 40 Cb 1.21 -0.26 -0.21 0.00 0.22 0.00 0.00 39.33 40.29 2dxt h ASP 40 CO 0.42 0.92 -0.33 -0.75 -1.72 0.00 0.00 179.24 177.79 2dxt s LYS 41 N -5.37 0.56 -0.08 3.56 2.20 -1.20 -3.87 119.74 115.54 2dxt s LYS 41 Ca -0.11 -0.06 0.03 0.00 -0.36 0.00 0.00 55.97 55.47 2dxt s LYS 41 Cb 0.15 0.25 -0.02 0.00 -1.51 0.00 0.00 37.83 36.71 2dxt s LYS 41 CO 0.83 -0.14 -0.18 -0.65 -0.36 0.00 0.00 175.35 174.85 2dxt s GLN 42 N -0.95 2.78 0.18 4.03 -0.21 -0.87 -2.08 119.66 122.53 2dxt s GLN 42 Ca -0.10 -0.77 0.22 0.00 0.02 0.00 0.00 55.36 54.73 2dxt s GLN 42 Cb -0.05 -2.37 -0.03 0.00 1.00 0.00 0.00 33.01 31.56 2dxt s GLN 42 CO 0.03 0.41 0.99 0.25 -2.12 0.00 0.00 175.29 174.85 2dxt n THR 43 N 2.90 0.59 -2.64 -0.19 -2.24 0.48 -4.34 114.28 108.84 2dxt n THR 43 Ca -0.18 -0.55 -0.08 0.00 -2.27 0.00 0.00 64.05 60.97 2dxt n THR 43 Cb 0.52 -0.32 0.04 0.00 -2.10 0.00 0.00 70.33 68.47 2dxt n THR 43 CO 0.00 0.00 0.00 0.23 -0.57 0.00 0.00 175.07 174.73 2dxt n MET 44 N -2.65 1.97 -2.07 -0.78 2.81 0.56 -5.03 117.12 111.94 2dxt n MET 44 Ca -0.01 -3.61 -0.39 0.00 -1.81 0.00 0.00 57.70 51.88 2dxt n MET 44 Cb 0.56 -1.65 -0.00 0.00 -0.71 0.00 0.00 33.22 31.42 2dxt n MET 44 CO 0.00 0.00 0.00 0.20 1.51 0.00 0.00 175.97 177.68 2dxt s GLY 45 N -3.55 2.89 0.07 3.03 0.00 -1.14 -4.52 107.32 104.10 2dxt s GLY 45 Ca 0.32 1.18 0.01 0.00 0.00 0.00 0.00 44.72 46.23 2dxt s GLY 45 CO -0.02 1.74 -0.05 -2.38 0.00 0.00 0.00 173.10 172.39 2dxt s HIS 46 N -1.32 0.69 0.00 1.90 -3.43 -1.26 -1.10 115.29 110.76 2dxt s HIS 46 Ca 0.59 -0.91 0.00 0.00 -0.80 0.00 0.00 55.06 53.94 2dxt s HIS 46 Cb -0.36 -0.43 0.00 0.00 -1.43 0.00 0.00 32.58 30.35 2dxt s HIS 46 CO 0.46 -0.24 0.00 0.41 -2.00 0.00 0.00 174.74 173.37 2dxt n GLY 47 N 0.26 3.12 3.79 -1.38 0.00 0.38 -4.65 105.19 106.71 2dxt n GLY 47 Ca -0.15 -1.82 -0.31 0.00 0.00 0.00 0.00 46.02 43.74 2dxt n GLY 47 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2dxt s ARG 48 N 3.69 2.45 4.19 1.61 0.52 -1.26 -4.65 118.95 125.51 2dxt s ARG 48 Ca 0.00 1.00 0.00 0.00 -0.52 0.00 0.00 55.73 56.21 2dxt s ARG 48 Cb 0.00 -1.93 0.00 0.00 0.52 0.00 0.00 34.95 33.54 2dxt s ARG 48 CO 0.00 -1.46 0.00 1.28 0.02 0.00 0.00 175.30 175.14 2dxt n LEU 49 N -3.38 0.00 -2.30 2.53 4.77 -1.26 -2.80 117.00 114.57 2dxt n LEU 49 Ca 0.08 0.00 -0.32 0.00 -0.03 0.00 0.00 56.01 55.74 2dxt n LEU 49 Cb 0.54 0.00 0.06 0.00 -2.33 0.00 0.00 43.42 41.68 2dxt n LEU 49 CO 0.55 0.00 1.04 -3.20 -1.33 0.00 0.00 177.39 174.45 2dxt n ASN 50 N 0.03 6.77 -4.74 -1.43 5.15 -1.26 -5.00 115.26 114.77 2dxt n ASN 50 Ca 0.00 -3.78 -0.35 0.00 -0.60 0.00 0.00 54.58 49.85 2dxt n ASN 50 Cb 0.00 -0.78 -0.08 0.00 -0.53 0.00 0.00 39.78 38.39 2dxt n ASN 50 CO 0.00 0.00 0.00 -0.13 1.40 0.00 0.00 177.26 178.53 2dxt s ARG 51 N -3.77 3.11 0.32 1.20 0.52 -1.12 -5.02 118.95 114.19 2dxt s ARG 51 Ca 0.59 -0.34 -0.27 0.00 -0.52 0.00 0.00 55.73 55.19 2dxt s ARG 51 Cb 0.47 -2.90 -0.09 0.00 0.52 0.00 0.00 34.95 32.94 2dxt s ARG 51 CO -0.04 0.72 1.08 0.15 0.02 0.00 0.00 175.30 177.23 2dxt s LYS 52 N -1.00 4.46 -0.28 3.54 1.02 -1.26 -0.47 119.74 125.75 2dxt s LYS 52 Ca 0.15 1.69 -0.00 0.00 0.02 0.00 0.00 55.97 57.82 2dxt s LYS 52 Cb -0.12 -2.95 0.05 0.00 -0.52 0.00 0.00 37.83 34.30 2dxt s LYS 52 CO 0.04 0.08 -0.04 -0.46 -0.92 0.00 0.00 175.35 174.05 2dxt s TRP 53 N -1.35 3.25 0.07 3.18 -0.11 -0.26 -4.58 118.94 119.14 2dxt s TRP 53 Ca 0.49 -1.99 -0.30 0.00 1.22 0.00 0.00 56.10 55.52 2dxt s TRP 53 Cb -0.28 -2.05 -0.09 0.00 -1.50 0.00 0.00 33.47 29.55 2dxt s TRP 53 CO 0.36 -0.82 1.83 -1.21 -4.62 0.00 0.00 176.95 172.49 2dxt s GLU 54 N 1.21 4.15 -0.46 5.86 0.41 -1.26 -4.21 118.70 124.40 2dxt s GLU 54 Ca -0.06 2.52 0.09 0.00 -0.41 0.00 0.00 54.97 57.10 2dxt s GLU 54 Cb -0.20 -3.83 0.34 0.00 -1.78 0.00 0.00 34.13 28.66 2dxt s GLU 54 CO -0.03 -0.86 0.81 0.43 -0.49 0.00 0.00 175.26 175.12 2dxt n SER 55 N 6.47 2.37 -4.71 -0.19 7.64 -1.26 -5.05 113.62 118.88 2dxt n SER 55 Ca 0.18 -3.28 -0.29 0.00 1.01 0.00 0.00 58.87 56.49 2dxt n SER 55 Cb 0.40 -0.60 0.13 0.00 -1.01 0.00 0.00 64.21 63.14 2dxt n SER 55 CO 0.00 0.00 0.00 -2.16 -3.01 0.00 0.00 175.04 169.87 2dxt s PRO 56 N -2.81 1.18 0.44 1.43 0.04 -1.26 -2.06 135.00 131.96 2dxt s PRO 56 Ca 0.43 0.17 -0.25 0.00 0.04 0.00 0.00 61.00 61.39 2dxt s PRO 56 Cb 0.31 -1.85 -0.08 0.00 0.04 0.00 0.00 34.50 32.91 2dxt s PRO 56 CO -0.10 -2.15 1.36 -1.21 0.04 0.00 0.00 177.00 174.94 2dxt s GLU 57 N -5.41 3.76 0.00 4.56 2.02 -1.25 -3.35 118.70 119.03 2dxt s GLU 57 Ca 0.65 2.27 0.00 0.00 0.02 0.00 0.00 54.97 57.91 2dxt s GLU 57 Cb -0.13 -2.66 0.00 0.00 0.10 0.00 0.00 34.13 31.45 2dxt s GLU 57 CO 0.52 -0.70 0.00 0.41 0.02 0.00 0.00 175.26 175.51 2dxt n GLY 58 N 0.62 2.25 3.96 -1.39 0.00 -1.26 -4.15 105.19 105.22 2dxt n GLY 58 Ca 0.05 0.00 -0.20 0.00 0.00 0.00 0.00 46.02 45.87 2dxt n GLY 58 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2dxt s GLY 59 N -2.24 2.01 -0.38 -0.02 0.00 -1.21 -0.38 107.32 105.09 2dxt s GLY 59 Ca 0.00 -1.81 -0.07 0.00 0.00 0.00 0.00 44.72 42.85 2dxt s GLY 59 CO 0.00 -1.68 0.18 -2.27 0.00 0.00 0.00 173.10 169.33 2dxt s LEU 60 N -4.37 4.80 -0.29 0.66 2.96 -0.08 -4.90 118.68 117.46 2dxt s LEU 60 Ca 0.52 -1.45 -0.01 0.00 -0.22 0.00 0.00 54.13 52.97 2dxt s LEU 60 Cb -0.06 -1.90 0.05 0.00 0.50 0.00 0.00 46.19 44.78 2dxt s LEU 60 CO 0.31 -0.45 -0.02 0.26 -1.32 0.00 0.00 176.35 175.13 2dxt s TRP 61 N 1.36 3.26 0.14 5.38 0.23 -1.26 -1.06 118.94 126.99 2dxt s TRP 61 Ca 0.02 -1.95 -0.09 0.00 -2.03 0.00 0.00 56.10 52.05 2dxt s TRP 61 Cb -0.22 -2.07 -0.01 0.00 0.03 0.00 0.00 33.47 31.21 2dxt s TRP 61 CO 0.01 -0.82 0.25 -0.48 0.96 0.00 0.00 176.95 176.87 2dxt s LEU 62 N 1.23 1.14 0.02 2.99 0.05 -0.78 -2.17 118.68 121.15 2dxt s LEU 62 Ca -0.06 -0.80 0.02 0.00 0.05 0.00 0.00 54.13 53.34 2dxt s LEU 62 Cb -0.20 1.11 -0.02 0.00 -2.05 0.00 0.00 46.19 45.04 2dxt s LEU 62 CO -0.02 -0.83 -0.07 -0.44 -0.55 0.00 0.00 176.35 174.43 2dxt s SER 63 N -2.93 0.85 -0.07 1.48 0.01 0.33 -0.52 113.70 112.83 2dxt s SER 63 Ca 0.13 -0.35 0.04 0.00 1.31 0.00 0.00 55.95 57.08 2dxt s SER 63 Cb 0.04 -0.02 0.00 0.00 0.21 0.00 0.00 66.02 66.25 2dxt s SER 63 CO -0.04 -0.06 -0.18 -0.63 0.41 0.00 0.00 173.24 172.73 2dxt s ILE 64 N -0.79 1.60 -0.14 1.44 1.01 0.36 -0.23 121.20 124.45 2dxt s ILE 64 Ca -0.04 -0.77 -0.21 0.00 0.00 0.00 0.00 60.65 59.63 2dxt s ILE 64 Cb -0.06 -1.40 -0.03 0.00 0.01 0.00 0.00 42.46 40.98 2dxt s ILE 64 CO 0.00 0.46 0.64 -0.69 0.00 0.00 0.00 174.94 175.35 2dxt s VAL 65 N 0.35 5.04 0.07 2.92 1.01 -0.55 -0.79 120.40 128.45 2dxt s VAL 65 Ca -0.13 1.26 0.03 0.00 0.00 0.00 0.00 61.98 63.14 2dxt s VAL 65 Cb -0.16 -3.97 -0.03 0.00 0.00 0.00 0.00 36.38 32.23 2dxt s VAL 65 CO 0.05 0.18 -0.10 -0.76 0.00 0.00 0.00 175.10 174.48 2dxt s LEU 66 N 1.39 2.31 -0.40 3.92 1.43 0.91 -0.16 118.68 128.08 2dxt s LEU 66 Ca 0.32 -0.66 0.09 0.00 -1.03 0.00 0.00 54.13 52.84 2dxt s LEU 66 Cb -0.16 -0.28 0.27 0.00 0.03 0.00 0.00 46.19 46.05 2dxt s LEU 66 CO 0.13 -0.20 0.63 -0.24 0.23 0.00 0.00 176.35 176.90 2dxt n SER 67 N 1.11 -0.14 -4.65 2.29 2.88 -1.26 0.10 113.62 113.94 2dxt n SER 67 Ca -0.20 -2.87 -0.45 0.00 -1.33 0.00 0.00 58.87 54.01 2dxt n SER 67 Cb 0.56 -0.25 -0.04 0.00 -0.75 0.00 0.00 64.21 63.73 2dxt n SER 67 CO 0.00 0.00 0.00 -2.65 -1.23 0.00 0.00 175.04 171.16 2dxt n PRO 68 N 1.15 2.40 -2.80 -1.46 -0.02 -1.26 -4.92 135.00 128.09 2dxt n PRO 68 Ca 0.20 0.85 -0.44 0.00 -2.02 0.00 0.00 63.50 62.10 2dxt n PRO 68 Cb 0.58 -2.86 0.00 0.00 -0.02 0.00 0.00 33.50 31.20 2dxt n PRO 68 CO 0.00 0.00 0.00 1.63 1.98 0.00 0.00 175.50 179.11 2dxt n LYS 69 N 7.35 3.49 -4.16 -0.52 4.76 -1.26 -4.91 118.16 122.91 2dxt n LYS 69 Ca 0.23 -3.82 -0.10 0.00 -2.87 0.00 0.00 58.31 51.75 2dxt n LYS 69 Cb 0.36 -2.96 -0.10 0.00 -1.84 0.00 0.00 35.03 30.49 2dxt n LYS 69 CO 0.00 0.00 0.00 0.14 -1.37 0.00 0.00 177.40 176.17 2dxt s VAL 70 N 0.90 0.29 0.41 -0.18 -7.23 -1.26 -5.05 120.40 108.28 2dxt s VAL 70 Ca 0.41 -1.91 -0.25 0.00 -1.81 0.00 0.00 61.98 58.42 2dxt s VAL 70 Cb 0.01 -1.97 -0.11 0.00 0.56 0.00 0.00 36.38 34.87 2dxt s VAL 70 CO 0.00 -0.57 1.04 -2.65 -0.31 0.00 0.00 175.10 172.61 2dxt n PRO 71 N -0.10 1.41 -0.34 4.82 -0.02 -1.26 -4.85 135.00 134.67 2dxt n PRO 71 Ca -0.07 0.51 0.17 0.00 -2.02 0.00 0.00 63.50 62.08 2dxt n PRO 71 Cb 0.63 -2.06 0.39 0.00 -0.02 0.00 0.00 33.50 32.44 2dxt n PRO 71 CO 0.00 0.00 0.00 0.37 1.98 0.00 0.00 175.50 177.85 2dxt h GLN 72 N 1.64 0.58 0.00 -0.52 5.75 -2.00 0.58 115.11 121.14 2dxt h GLN 72 Ca -0.44 -0.03 0.00 0.00 -0.15 0.00 0.00 58.65 58.02 2dxt h GLN 72 Cb 1.33 -0.13 0.00 0.00 1.07 0.00 0.00 27.48 29.75 2dxt h GLN 72 CO 0.57 0.38 0.00 1.57 -2.65 0.00 0.00 178.83 178.71 2dxt h LYS 73 N 0.60 0.00 0.00 1.69 5.09 -2.05 -2.68 116.57 119.23 2dxt h LYS 73 Ca 0.61 0.00 -0.10 0.00 0.09 0.00 0.00 60.65 61.26 2dxt h LYS 73 Cb 1.18 0.00 -0.02 0.00 0.10 0.00 0.00 32.23 33.49 2dxt h LYS 73 CO -0.41 0.00 -1.33 -0.25 -2.09 0.00 0.00 179.45 175.38 2dxt n ASP 74 N -2.48 0.77 -0.29 7.07 8.00 0.19 -4.36 116.55 125.44 2dxt n ASP 74 Ca -0.00 0.32 0.21 0.00 0.71 0.00 0.00 54.79 56.03 2dxt n ASP 74 Cb 0.15 0.43 0.51 0.00 -0.02 0.00 0.00 41.12 42.19 2dxt n ASP 74 CO 0.00 0.00 0.00 -0.07 -0.39 0.00 0.00 177.20 176.74 2dxt h LEU 75 N 0.00 0.43 -0.43 0.64 3.38 -1.48 -1.30 115.31 116.55 2dxt h LEU 75 Ca -0.10 0.06 0.00 0.00 0.09 0.00 0.00 57.88 57.93 2dxt h LEU 75 Cb 1.33 -0.01 0.00 0.00 0.09 0.00 0.00 40.66 42.07 2dxt h LEU 75 CO 0.02 0.12 0.00 -2.65 0.09 0.00 0.00 178.44 176.03 2dxt n PRO 76 N -4.57 0.06 0.00 1.13 -0.02 -1.26 -2.60 135.00 127.74 2dxt n PRO 76 Ca 0.23 0.46 0.14 0.00 -2.02 0.00 0.00 63.50 62.31 2dxt n PRO 76 Cb 0.81 -1.66 0.64 0.00 -0.02 0.00 0.00 33.50 33.27 2dxt n PRO 76 CO 0.00 0.00 0.00 1.63 1.98 0.00 0.00 175.50 179.11 2dxt n LYS 77 N -1.78 0.79 -0.34 -0.52 5.02 -0.49 -4.05 118.16 116.79 2dxt n LYS 77 Ca 0.01 -0.27 0.04 0.00 -2.02 0.00 0.00 58.31 56.07 2dxt n LYS 77 Cb 0.09 -1.49 0.22 0.00 -0.02 0.00 0.00 35.03 33.82 2dxt n LYS 77 CO 0.00 0.00 0.00 0.82 -0.52 0.00 0.00 177.40 177.70 2dxt h ILE 78 N 0.65 1.05 -0.83 -0.18 1.08 -1.70 -1.14 117.51 116.45 2dxt h ILE 78 Ca 0.00 -0.37 0.12 0.00 -0.39 0.00 0.00 64.86 64.22 2dxt h ILE 78 Cb 0.33 -0.13 -0.06 0.00 -3.07 0.00 0.00 36.82 33.89 2dxt h ILE 78 CO 0.00 0.20 0.54 1.62 -0.69 0.00 0.00 178.15 179.82 2dxt h VAL 79 N 1.08 0.88 -0.07 1.67 3.04 -1.85 -0.62 116.25 120.39 2dxt h VAL 79 Ca 0.43 -0.23 -0.08 0.00 -1.01 0.00 0.00 66.70 65.80 2dxt h VAL 79 Cb 0.24 0.14 -0.01 0.00 -2.01 0.00 0.00 31.29 29.65 2dxt h VAL 79 CO -0.18 0.12 -0.34 -0.26 -1.01 0.00 0.00 177.57 175.91 2dxt h PHE 80 N 0.68 0.16 -0.80 3.17 0.04 -1.46 -2.12 116.94 116.62 2dxt h PHE 80 Ca 0.40 -0.03 -0.02 0.00 2.80 0.00 0.00 57.97 61.12 2dxt h PHE 80 Cb 0.61 -0.04 -0.04 0.00 2.20 0.00 0.00 35.95 38.68 2dxt h PHE 80 CO -0.00 0.47 0.43 -0.07 -0.60 0.00 0.00 178.31 178.54 2dxt h LEU 81 N 0.13 1.00 -0.16 1.54 3.38 -1.04 0.47 115.31 120.62 2dxt h LEU 81 Ca 0.02 -0.10 -0.02 0.00 0.09 0.00 0.00 57.88 57.86 2dxt h LEU 81 Cb 0.67 -0.26 -0.01 0.00 0.09 0.00 0.00 40.66 41.16 2dxt h LEU 81 CO 0.05 0.82 0.01 1.23 0.09 0.00 0.00 178.44 180.64 2dxt h GLY 82 N 1.11 0.30 0.98 0.83 0.00 -1.29 -0.76 103.07 104.23 2dxt h GLY 82 Ca 0.28 -0.21 -0.00 0.00 0.00 0.00 0.00 47.33 47.40 2dxt h GLY 82 CO -0.04 0.19 0.23 0.00 0.00 0.00 0.00 176.54 176.92 2dxt h ALA 83 N 0.79 0.50 -0.41 3.60 0.00 -1.12 -1.76 119.26 120.85 2dxt h ALA 83 Ca 0.05 -0.06 -0.10 0.00 0.00 0.00 0.00 54.91 54.80 2dxt h ALA 83 Cb 0.34 -0.16 -0.02 0.00 0.00 0.00 0.00 17.79 17.96 2dxt h ALA 83 CO 0.01 -0.01 -0.15 0.28 0.00 0.00 0.00 179.25 179.37 2dxt h VAL 84 N 0.51 1.26 -0.48 0.00 2.07 -0.89 -1.94 116.25 116.78 2dxt h VAL 84 Ca 0.14 -1.23 0.01 0.00 0.82 0.00 0.00 66.70 66.43 2dxt h VAL 84 Cb 0.00 1.11 -0.02 0.00 -1.52 0.00 0.00 31.29 30.86 2dxt h VAL 84 CO -0.03 0.42 0.32 1.23 0.02 0.00 0.00 177.57 179.53 2dxt h GLY 85 N 0.97 0.68 0.99 2.17 0.00 -0.84 -0.37 103.07 106.67 2dxt h GLY 85 Ca 0.11 -0.25 -0.00 0.00 0.00 0.00 0.00 47.33 47.19 2dxt h GLY 85 CO 0.05 0.24 0.28 -2.08 0.00 0.00 0.00 176.54 175.02 2dxt h VAL 86 N 0.64 1.14 -0.64 4.60 2.07 -1.09 -1.17 116.25 121.80 2dxt h VAL 86 Ca 0.18 -0.31 0.04 0.00 0.82 0.00 0.00 66.70 67.43 2dxt h VAL 86 Cb -0.07 0.53 -0.04 0.00 -1.52 0.00 0.00 31.29 30.19 2dxt h VAL 86 CO -0.04 0.14 0.38 0.58 0.02 0.00 0.00 177.57 178.65 2dxt h VAL 87 N 0.60 1.04 -0.55 2.57 2.07 -0.82 0.38 116.25 121.54 2dxt h VAL 87 Ca 0.16 -0.25 -0.04 0.00 0.82 0.00 0.00 66.70 67.39 2dxt h VAL 87 Cb -0.01 0.25 -0.02 0.00 -1.52 0.00 0.00 31.29 29.98 2dxt h VAL 87 CO -0.03 0.13 0.19 -0.33 0.02 0.00 0.00 177.57 177.55 2dxt h GLU 88 N 0.73 0.85 -0.34 1.57 5.08 -0.75 -1.70 114.58 120.02 2dxt h GLU 88 Ca 0.27 -0.18 -0.03 0.00 -1.00 0.00 0.00 59.36 58.42 2dxt h GLU 88 Cb 0.07 -0.13 -0.01 0.00 0.50 0.00 0.00 28.75 29.18 2dxt h GLU 88 CO -0.13 0.76 0.11 1.15 -1.00 0.00 0.00 179.01 179.90 2dxt h THR 89 N 0.76 1.20 -0.98 1.13 2.02 -0.79 -2.52 112.91 113.73 2dxt h THR 89 Ca 0.18 -0.66 0.06 0.00 0.77 0.00 0.00 66.41 66.76 2dxt h THR 89 Cb 0.26 1.01 -0.07 0.00 -1.74 0.00 0.00 68.15 67.61 2dxt h THR 89 CO -0.01 0.23 0.63 -0.07 0.37 0.00 0.00 175.52 176.67 2dxt h LEU 90 N 0.39 1.01 -1.21 2.58 3.38 -0.74 -1.41 115.31 119.31 2dxt h LEU 90 Ca 0.11 0.01 -0.03 0.00 0.09 0.00 0.00 57.88 58.06 2dxt h LEU 90 Cb 0.24 -0.20 -0.02 0.00 0.09 0.00 0.00 40.66 40.77 2dxt h LEU 90 CO -0.00 0.64 0.19 0.50 0.09 0.00 0.00 178.44 179.86 2dxt h LYS 91 N 1.15 0.74 0.00 1.13 1.63 -0.99 0.68 116.57 120.90 2dxt h LYS 91 Ca 0.42 -0.11 -0.02 0.00 -0.85 0.00 0.00 60.65 60.09 2dxt h LYS 91 Cb 0.17 -0.13 -0.00 0.00 -0.60 0.00 0.00 32.23 31.67 2dxt h LYS 91 CO -0.17 0.62 -0.08 0.93 -3.45 0.00 0.00 179.45 177.30 2dxt h GLU 92 N 0.73 0.00 -0.64 1.90 5.08 -0.84 0.33 114.58 121.13 2dxt h GLU 92 Ca 0.17 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.53 2dxt h GLU 92 Cb 0.17 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.42 2dxt h GLU 92 CO -0.01 0.08 0.00 1.19 -1.00 0.00 0.00 179.01 179.26 2dxt n PHE 93 N -4.38 1.24 -2.64 4.33 3.01 -0.48 -4.94 117.46 113.61 2dxt n PHE 93 Ca -0.03 -0.51 -0.12 0.00 1.01 0.00 0.00 57.45 57.80 2dxt n PHE 93 Cb 0.16 -0.18 0.02 0.00 -0.01 0.00 0.00 39.48 39.46 2dxt n PHE 93 CO 0.00 0.00 0.00 0.43 1.01 0.00 0.00 176.76 178.20 2dxt n SER 94 N 1.06 -4.07 -4.30 4.37 7.64 0.11 -5.03 113.62 113.41 2dxt n SER 94 Ca 0.23 -0.15 -0.32 0.00 1.01 0.00 0.00 58.87 59.64 2dxt n SER 94 Cb 0.76 -2.99 -0.16 0.00 -1.01 0.00 0.00 64.21 60.81 2dxt n SER 94 CO 0.00 0.00 0.00 -0.63 -3.01 0.00 0.00 175.04 171.40 2dxt s ILE 95 N -2.86 2.30 -0.61 0.44 1.01 0.11 -4.98 121.20 116.60 2dxt s ILE 95 Ca 0.15 -0.97 -0.17 0.00 0.00 0.00 0.00 60.65 59.67 2dxt s ILE 95 Cb -0.07 -1.87 0.14 0.00 0.01 0.00 0.00 42.46 40.67 2dxt s ILE 95 CO 0.19 0.56 0.62 -1.81 0.00 0.00 0.00 174.94 174.51 2dxt s ASP 96 N -0.08 6.29 0.12 3.58 1.01 -1.26 -2.71 116.67 123.62 2dxt s ASP 96 Ca -0.05 -1.83 -0.09 0.00 0.71 0.00 0.00 52.55 51.29 2dxt s ASP 96 Cb -0.14 -2.24 -0.06 0.00 1.01 0.00 0.00 42.92 41.48 2dxt s ASP 96 CO 0.04 -0.90 0.43 -0.83 0.21 0.00 0.00 175.17 174.12 2dxt s GLY 97 N 3.40 2.32 -0.02 0.21 0.00 -1.26 -4.61 107.32 107.35 2dxt s GLY 97 Ca 0.09 -0.38 0.05 0.00 0.00 0.00 0.00 44.72 44.48 2dxt s GLY 97 CO 0.02 -0.19 -0.17 0.50 0.00 0.00 0.00 173.10 173.25 2dxt s ARG 98 N -2.19 1.53 -0.12 2.90 1.81 0.61 -4.93 118.95 118.56 2dxt s ARG 98 Ca 0.37 -0.60 -0.29 0.00 -1.72 0.00 0.00 55.73 53.49 2dxt s ARG 98 Cb -0.13 -1.41 -0.01 0.00 -0.45 0.00 0.00 34.95 32.94 2dxt s ARG 98 CO 0.20 0.31 0.97 0.42 -0.68 0.00 0.00 175.30 176.52 2dxt s ILE 99 N -0.21 4.80 -0.45 1.52 1.01 0.53 -0.09 121.20 128.31 2dxt s ILE 99 Ca 0.02 1.96 -0.18 0.00 0.00 0.00 0.00 60.65 62.46 2dxt s ILE 99 Cb -0.09 -4.28 0.04 0.00 0.01 0.00 0.00 42.46 38.15 2dxt s ILE 99 CO 0.00 0.01 0.50 -0.75 0.00 0.00 0.00 174.94 174.70 2dxt s LYS 100 N 2.03 3.10 0.20 2.79 2.20 0.10 -1.55 119.74 128.61 2dxt s LYS 100 Ca 0.46 -0.85 -0.32 0.00 -0.36 0.00 0.00 55.97 54.90 2dxt s LYS 100 Cb -0.18 -4.03 -0.15 0.00 -1.51 0.00 0.00 37.83 31.96 2dxt s LYS 100 CO 0.17 -0.99 1.13 1.87 -0.36 0.00 0.00 175.35 177.17 2dxt n TRP 101 N 5.75 1.29 0.34 4.03 -0.00 -1.26 -2.21 117.44 125.38 2dxt n TRP 101 Ca -0.07 0.68 0.04 0.00 -0.00 0.00 0.00 57.50 58.14 2dxt n TRP 101 Cb 0.46 -2.27 0.00 0.00 -0.00 0.00 0.00 31.31 29.50 2dxt n TRP 101 CO 0.00 0.00 0.00 -0.35 -0.00 0.00 0.00 177.69 177.34 2dxt n PRO 102 N 1.58 2.06 -0.03 5.87 -0.04 -1.26 -4.81 135.00 138.37 2dxt n PRO 102 Ca 0.14 -0.56 0.01 0.00 -0.04 0.00 0.00 63.50 63.04 2dxt n PRO 102 Cb 0.26 -1.02 0.01 0.00 -0.04 0.00 0.00 33.50 32.71 2dxt n PRO 102 CO 0.00 0.00 0.00 0.27 -0.04 0.00 0.00 175.50 175.73 2dxt n ASN 103 N -0.24 1.21 -4.29 3.54 6.94 -1.16 -4.60 115.26 116.66 2dxt n ASN 103 Ca 0.03 -1.71 -0.18 0.00 -0.02 0.00 0.00 54.58 52.71 2dxt n ASN 103 Cb 0.17 -0.04 -0.10 0.00 -2.36 0.00 0.00 39.78 37.44 2dxt n ASN 103 CO 0.00 0.00 0.00 0.00 -1.03 0.00 0.00 177.26 176.23 2dxt s ALA 104 N -0.72 1.73 -0.12 -2.53 0.00 -0.94 -0.17 121.76 119.02 2dxt s ALA 104 Ca 0.02 -1.49 0.02 0.00 0.00 0.00 0.00 51.96 50.50 2dxt s ALA 104 Cb 0.02 -0.06 0.01 0.00 0.00 0.00 0.00 23.12 23.09 2dxt s ALA 104 CO 0.00 0.06 -0.17 0.08 0.00 0.00 0.00 175.76 175.73 2dxt s VAL 105 N -2.70 1.63 0.18 0.00 1.01 -0.70 0.03 120.40 119.85 2dxt s VAL 105 Ca 0.16 -0.72 0.09 0.00 0.00 0.00 0.00 61.98 61.52 2dxt s VAL 105 Cb -0.02 -1.48 -0.04 0.00 0.00 0.00 0.00 36.38 34.84 2dxt s VAL 105 CO 0.04 0.47 -0.10 -0.76 0.00 0.00 0.00 175.10 174.75 2dxt s LEU 106 N 1.00 2.95 -0.19 3.92 1.43 0.88 -1.06 118.68 127.61 2dxt s LEU 106 Ca -0.05 -0.59 -0.00 0.00 -1.03 0.00 0.00 54.13 52.45 2dxt s LEU 106 Cb -0.15 -1.64 0.05 0.00 0.03 0.00 0.00 46.19 44.48 2dxt s LEU 106 CO -0.03 0.10 -0.05 -0.69 0.23 0.00 0.00 176.35 175.92 2dxt s VAL 107 N -1.71 1.21 -1.40 -1.59 1.01 0.10 -0.28 120.40 117.73 2dxt s VAL 107 Ca 0.25 -0.83 -0.08 0.00 0.00 0.00 0.00 61.98 61.31 2dxt s VAL 107 Cb -0.09 -1.44 0.04 0.00 0.00 0.00 0.00 36.38 34.89 2dxt s VAL 107 CO 0.15 0.02 1.01 0.59 0.00 0.00 0.00 175.10 176.87 2dxt n ASN 108 N 4.82 -4.47 -0.02 3.32 3.02 -1.26 -1.54 115.26 119.13 2dxt n ASN 108 Ca -0.12 -0.69 -0.00 0.00 -0.03 0.00 0.00 54.58 53.74 2dxt n ASN 108 Cb 0.46 -4.45 -0.00 0.00 -0.61 0.00 0.00 39.78 35.18 2dxt n ASN 108 CO 0.00 0.00 0.00 -1.22 -2.62 0.00 0.00 177.26 173.42 2dxt n TYR 109 N -4.67 0.00 -4.10 3.10 4.01 -1.26 -4.99 117.16 109.24 2dxt n TYR 109 Ca -0.06 0.00 -0.34 0.00 -0.16 0.00 0.00 57.90 57.34 2dxt n TYR 109 Cb 0.58 -1.40 -0.11 0.00 -0.31 0.00 0.00 39.34 38.10 2dxt n TYR 109 CO 0.00 0.00 0.00 0.15 -0.46 0.00 0.00 176.86 176.55 2dxt s LYS 110 N -1.41 3.86 -0.04 -0.72 1.02 -0.59 -5.01 119.74 116.85 2dxt s LYS 110 Ca 0.00 -0.41 -0.30 0.00 0.02 0.00 0.00 55.97 55.29 2dxt s LYS 110 Cb 0.00 -3.13 -0.06 0.00 -0.52 0.00 0.00 37.83 34.12 2dxt s LYS 110 CO 0.00 0.23 1.64 0.21 -0.92 0.00 0.00 175.35 176.51 2dxt s LYS 111 N 0.46 4.19 -0.01 1.68 2.20 -1.26 -0.72 119.74 126.28 2dxt s LYS 111 Ca 0.01 2.19 0.11 0.00 -0.36 0.00 0.00 55.97 57.92 2dxt s LYS 111 Cb -0.13 -3.91 -0.15 0.00 -1.51 0.00 0.00 37.83 32.12 2dxt s LYS 111 CO 0.01 -0.81 0.28 1.51 -0.36 0.00 0.00 175.35 175.97 2dxt n ILE 112 N 5.34 0.00 -3.52 5.43 3.06 -0.22 -1.66 119.36 127.78 2dxt n ILE 112 Ca 0.17 -0.25 -0.15 0.00 -2.50 0.00 0.00 62.75 60.02 2dxt n ILE 112 Cb 0.43 0.42 -0.05 0.00 0.54 0.00 0.00 39.64 40.97 2dxt n ILE 112 CO 0.00 0.00 0.00 0.00 -2.50 0.00 0.00 176.55 174.05 2dxt s ALA 113 N -2.58 -1.55 0.02 1.51 0.00 -1.10 -1.18 121.76 116.89 2dxt s ALA 113 Ca -0.02 0.85 0.01 0.00 0.00 0.00 0.00 51.96 52.79 2dxt s ALA 113 Cb 0.07 0.34 -0.02 0.00 0.00 0.00 0.00 23.12 23.52 2dxt s ALA 113 CO 0.44 -0.51 -0.04 0.20 0.00 0.00 0.00 175.76 175.85 2dxt s GLY 114 N -1.83 0.28 -0.05 0.00 0.00 -0.30 -1.72 107.32 103.70 2dxt s GLY 114 Ca -0.06 -0.49 0.06 0.00 0.00 0.00 0.00 44.72 44.23 2dxt s GLY 114 CO 0.00 -0.53 -0.24 0.14 0.00 0.00 0.00 173.10 172.48 2dxt s VAL 115 N -0.99 1.93 -0.13 1.40 1.01 0.76 -0.94 120.40 123.45 2dxt s VAL 115 Ca -0.09 -1.01 -0.02 0.00 0.00 0.00 0.00 61.98 60.86 2dxt s VAL 115 Cb -0.07 -1.63 0.04 0.00 0.00 0.00 0.00 36.38 34.72 2dxt s VAL 115 CO -0.00 0.54 0.02 -0.22 0.00 0.00 0.00 175.10 175.44 2dxt s LEU 116 N -0.23 0.82 -0.17 3.92 2.96 0.22 -4.80 118.68 121.40 2dxt s LEU 116 Ca -0.01 -0.42 -0.06 0.00 -0.22 0.00 0.00 54.13 53.42 2dxt s LEU 116 Cb -0.12 -0.49 -0.04 0.00 0.50 0.00 0.00 46.19 46.03 2dxt s LEU 116 CO 0.02 -0.25 0.04 -0.69 -1.32 0.00 0.00 176.35 174.15 2dxt s VAL 117 N 1.93 4.58 0.19 1.68 1.01 -1.26 -0.63 120.40 127.91 2dxt s VAL 117 Ca 0.02 -0.11 0.01 0.00 0.00 0.00 0.00 61.98 61.90 2dxt s VAL 117 Cb -0.14 -3.04 -0.05 0.00 0.00 0.00 0.00 36.38 33.15 2dxt s VAL 117 CO -0.07 0.48 0.04 -1.61 0.00 0.00 0.00 175.10 173.95 2dxt s GLU 118 N 0.26 1.18 -0.12 2.72 2.02 -0.50 -4.99 118.70 119.28 2dxt s GLU 118 Ca 0.02 -1.60 -0.06 0.00 0.02 0.00 0.00 54.97 53.36 2dxt s GLU 118 Cb -0.13 -0.19 0.05 0.00 0.10 0.00 0.00 34.13 33.97 2dxt s GLU 118 CO 0.01 -0.20 0.28 0.20 0.02 0.00 0.00 175.26 175.56 2dxt s GLY 119 N -3.20 -0.17 -0.06 -1.39 0.00 -1.26 0.26 107.32 101.50 2dxt s GLY 119 Ca 0.29 1.08 0.05 0.00 0.00 0.00 0.00 44.72 46.14 2dxt s GLY 119 CO 0.07 1.46 -0.22 1.25 0.00 0.00 0.00 173.10 175.66 2dxt s LYS 120 N 1.49 2.34 6.56 2.90 2.20 -1.07 -4.97 119.74 129.19 2dxt s LYS 120 Ca -0.08 -0.78 0.00 0.00 -0.36 0.00 0.00 55.97 54.76 2dxt s LYS 120 Cb -0.10 -1.95 0.00 0.00 -1.51 0.00 0.00 37.83 34.27 2dxt s LYS 120 CO -0.09 0.28 0.00 0.41 -0.36 0.00 0.00 175.35 175.59 2dxt n GLY 121 N 3.16 2.69 1.01 5.54 0.00 -1.26 -1.90 105.19 114.43 2dxt n GLY 121 Ca -0.18 -0.35 0.00 0.00 0.00 0.00 0.00 46.02 45.49 2dxt n GLY 121 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 2dxt n ASP 122 N 3.47 2.90 -4.84 1.61 8.00 -1.26 -4.96 116.55 121.47 2dxt n ASP 122 Ca 0.00 -3.50 -0.32 0.00 0.71 0.00 0.00 54.79 51.68 2dxt n ASP 122 Cb 0.00 -0.60 -0.06 0.00 -0.02 0.00 0.00 41.12 40.45 2dxt n ASP 122 CO 0.00 0.00 0.00 -1.59 -0.39 0.00 0.00 177.20 175.22 2dxt s LYS 123 N -3.10 3.17 -0.07 -1.24 -2.85 -0.80 -4.75 119.74 110.10 2dxt s LYS 123 Ca 0.43 -0.51 0.03 0.00 -1.00 0.00 0.00 55.97 54.92 2dxt s LYS 123 Cb 0.38 -2.91 -0.02 0.00 -2.06 0.00 0.00 37.83 33.23 2dxt s LYS 123 CO 0.03 0.61 -0.17 0.42 0.10 0.00 0.00 175.35 176.34 2dxt s ILE 124 N -1.37 2.79 -0.26 3.79 1.01 0.29 -2.61 121.20 124.83 2dxt s ILE 124 Ca 0.29 -0.80 -0.05 0.00 0.00 0.00 0.00 60.65 60.09 2dxt s ILE 124 Cb -0.12 -2.10 0.01 0.00 0.01 0.00 0.00 42.46 40.26 2dxt s ILE 124 CO 0.21 0.57 0.02 -0.69 0.00 0.00 0.00 174.94 175.05 2dxt s VAL 125 N -0.28 3.59 -0.46 2.92 1.01 0.14 -0.06 120.40 127.25 2dxt s VAL 125 Ca 0.01 -0.69 -0.16 0.00 0.00 0.00 0.00 61.98 61.14 2dxt s VAL 125 Cb -0.13 -2.78 0.05 0.00 0.00 0.00 0.00 36.38 33.52 2dxt s VAL 125 CO 0.03 0.21 0.43 -0.22 0.00 0.00 0.00 175.10 175.55 2dxt s LEU 126 N 1.46 5.25 -0.16 3.92 2.96 0.03 -1.41 118.68 130.74 2dxt s LEU 126 Ca 0.03 -1.04 -0.08 0.00 -0.22 0.00 0.00 54.13 52.82 2dxt s LEU 126 Cb -0.16 -2.27 -0.04 0.00 0.50 0.00 0.00 46.19 44.21 2dxt s LEU 126 CO -0.00 -0.65 0.12 -0.83 -1.32 0.00 0.00 176.35 173.66 2dxt s GLY 127 N 2.30 2.07 -0.05 7.98 0.00 0.20 -0.48 107.32 119.34 2dxt s GLY 127 Ca 0.08 -0.68 0.01 0.00 0.00 0.00 0.00 44.72 44.13 2dxt s GLY 127 CO 0.10 -0.14 -0.05 -0.42 0.00 0.00 0.00 173.10 172.58 2dxt s ILE 128 N -0.33 0.60 -0.20 0.90 1.01 0.32 -0.61 121.20 122.88 2dxt s ILE 128 Ca 0.11 -0.15 0.00 0.00 0.00 0.00 0.00 60.65 60.61 2dxt s ILE 128 Cb -0.12 -0.62 0.02 0.00 0.01 0.00 0.00 42.46 41.75 2dxt s ILE 128 CO 0.01 0.24 -0.15 -0.83 0.00 0.00 0.00 174.94 174.21 2dxt s GLY 129 N 0.95 1.47 -0.11 6.18 0.00 -0.11 -1.87 107.32 113.82 2dxt s GLY 129 Ca -0.11 -1.28 0.01 0.00 0.00 0.00 0.00 44.72 43.35 2dxt s GLY 129 CO 0.00 0.36 -0.14 -2.27 0.00 0.00 0.00 173.10 171.05 2dxt s LEU 130 N 1.31 1.66 -0.21 0.66 2.96 -0.23 -1.15 118.68 123.67 2dxt s LEU 130 Ca 0.04 -0.41 -0.29 0.00 -0.22 0.00 0.00 54.13 53.25 2dxt s LEU 130 Cb -0.14 -1.05 -0.00 0.00 0.50 0.00 0.00 46.19 45.50 2dxt s LEU 130 CO -0.10 -0.00 1.19 0.20 -1.32 0.00 0.00 176.35 176.32 2dxt s ASN 131 N 1.07 6.96 0.00 3.68 0.01 -0.32 -0.90 114.94 125.44 2dxt s ASN 131 Ca -0.05 1.49 0.00 0.00 -0.71 0.00 0.00 52.86 53.59 2dxt s ASN 131 Cb -0.15 -2.54 0.00 0.00 0.41 0.00 0.00 41.25 38.98 2dxt s ASN 131 CO -0.03 -0.78 0.00 0.52 -1.51 0.00 0.00 177.10 175.30 2dxt n VAL 132 N 5.50 0.00 0.46 1.60 0.31 -1.25 -1.79 118.33 123.15 2dxt n VAL 132 Ca 0.13 0.03 0.05 0.00 -0.01 0.00 0.00 64.34 64.54 2dxt n VAL 132 Cb 0.46 -0.77 -0.00 0.00 -0.91 0.00 0.00 33.84 32.62 2dxt n VAL 132 CO 0.00 0.00 0.00 0.59 -1.32 0.00 0.00 176.83 176.10 2dxt n ASN 133 N -1.38 1.22 -4.81 4.52 3.02 0.49 -0.90 115.26 117.43 2dxt n ASN 133 Ca 0.00 -1.11 -0.31 0.00 -0.03 0.00 0.00 54.58 53.13 2dxt n ASN 133 Cb 0.00 0.47 0.05 0.00 -0.61 0.00 0.00 39.78 39.69 2dxt n ASN 133 CO 0.00 0.00 0.00 0.54 -2.62 0.00 0.00 177.26 175.18 2dxt s ASN 134 N -1.39 5.29 0.48 6.41 4.22 -1.18 -4.88 114.94 123.91 2dxt s ASN 134 Ca 0.08 1.68 -0.21 0.00 -2.14 0.00 0.00 52.86 52.28 2dxt s ASN 134 Cb 0.08 -2.51 -0.08 0.00 1.28 0.00 0.00 41.25 40.03 2dxt s ASN 134 CO 0.26 -1.50 1.08 -0.54 -2.04 0.00 0.00 177.10 174.36 2dxt s LYS 135 N -4.87 3.73 0.16 3.55 -0.14 -1.26 -4.93 119.74 115.98 2dxt s LYS 135 Ca 0.59 1.51 0.07 0.00 -1.36 0.00 0.00 55.97 56.79 2dxt s LYS 135 Cb -0.15 -2.18 -0.04 0.00 -1.68 0.00 0.00 37.83 33.78 2dxt s LYS 135 CO 0.52 -0.52 -0.16 0.14 -0.76 0.00 0.00 175.35 174.57 2dxt s VAL 136 N -1.81 1.64 0.67 3.17 -7.23 -1.26 -4.84 120.40 110.74 2dxt s VAL 136 Ca 0.67 -1.90 -0.17 0.00 -1.81 0.00 0.00 61.98 58.77 2dxt s VAL 136 Cb -0.21 -1.77 0.00 0.00 0.56 0.00 0.00 36.38 34.96 2dxt s VAL 136 CO 0.25 -0.39 1.22 -2.16 -0.31 0.00 0.00 175.10 173.71 2dxt s PRO 137 N -2.89 2.52 0.28 4.82 0.04 -1.26 -4.86 135.00 133.65 2dxt s PRO 137 Ca 0.14 1.82 -0.29 0.00 0.04 0.00 0.00 61.00 62.71 2dxt s PRO 137 Cb -0.05 -1.87 -0.14 0.00 0.04 0.00 0.00 34.50 32.48 2dxt s PRO 137 CO 0.05 -1.56 1.12 0.09 0.04 0.00 0.00 177.00 176.75 2dxt n ASN 138 N -2.19 1.73 0.00 6.66 3.02 -1.26 -1.38 115.26 121.85 2dxt n ASN 138 Ca 0.14 1.18 0.00 0.00 -0.03 0.00 0.00 54.58 55.86 2dxt n ASN 138 Cb 0.50 -1.33 0.00 0.00 -0.61 0.00 0.00 39.78 38.34 2dxt n ASN 138 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2dxt n GLY 139 N 1.34 3.18 3.99 7.41 0.00 -1.26 -5.03 105.19 114.82 2dxt n GLY 139 Ca 0.10 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.87 2dxt n GLY 139 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2dxt s ALA 140 N -2.31 3.51 0.31 4.61 0.00 -0.48 -4.10 121.76 123.31 2dxt s ALA 140 Ca 0.00 -1.79 -0.03 0.00 0.00 0.00 0.00 51.96 50.14 2dxt s ALA 140 Cb 0.00 -2.05 -0.00 0.00 0.00 0.00 0.00 23.12 21.06 2dxt s ALA 140 CO 0.00 -1.73 0.43 -0.08 0.00 0.00 0.00 175.76 174.39 2dxt s THR 141 N -3.30 0.00 0.18 0.00 -1.32 -0.67 -4.82 115.64 105.72 2dxt s THR 141 Ca 0.69 -1.63 -0.08 0.00 -1.21 0.00 0.00 61.69 59.46 2dxt s THR 141 Cb -0.04 -2.55 -0.01 0.00 -1.51 0.00 0.00 72.50 68.39 2dxt s THR 141 CO 0.46 0.00 0.29 -0.94 -2.21 0.00 0.00 174.62 172.23 2dxt s SER 142 N -3.20 0.04 0.29 8.08 1.04 -1.26 -4.32 113.70 114.36 2dxt s SER 142 Ca 0.31 -0.94 -0.03 0.00 0.48 0.00 0.00 55.95 55.76 2dxt s SER 142 Cb 0.00 0.45 0.40 0.00 0.10 0.00 0.00 66.02 66.97 2dxt s SER 142 CO 0.18 -0.92 1.95 0.24 0.98 0.00 0.00 173.24 175.67 2dxt h MET 143 N 2.51 1.12 -0.44 4.02 2.86 -1.26 -1.00 114.93 122.74 2dxt h MET 143 Ca -0.31 -0.08 -0.04 0.00 -2.06 0.00 0.00 59.70 57.20 2dxt h MET 143 Cb 1.23 -0.24 -0.02 0.00 0.06 0.00 0.00 31.60 32.63 2dxt h MET 143 CO 0.47 0.76 0.10 -0.22 1.06 0.00 0.00 176.91 179.08 2dxt h LYS 144 N 1.14 0.70 -0.16 1.72 3.64 -1.21 -0.77 116.57 121.65 2dxt h LYS 144 Ca 0.30 -0.17 -0.09 0.00 -1.27 0.00 0.00 60.65 59.43 2dxt h LYS 144 Cb -0.10 -0.09 -0.01 0.00 -0.41 0.00 0.00 32.23 31.62 2dxt h LYS 144 CO -0.06 0.71 -0.29 -0.07 -2.27 0.00 0.00 179.45 177.47 2dxt h LEU 145 N 0.58 0.30 -0.15 5.20 3.38 -1.69 0.52 115.31 123.44 2dxt h LEU 145 Ca 0.14 -0.10 -0.21 0.00 0.09 0.00 0.00 57.88 57.80 2dxt h LEU 145 Cb 0.32 -0.08 -0.02 0.00 0.09 0.00 0.00 40.66 40.97 2dxt h LEU 145 CO 0.00 0.59 -0.95 -0.33 0.09 0.00 0.00 178.44 177.84 2dxt h GLU 146 N 0.26 0.09 0.00 1.13 4.39 -0.97 -3.31 114.58 116.17 2dxt h GLU 146 Ca 0.04 -0.12 0.00 0.00 0.34 0.00 0.00 59.36 59.62 2dxt h GLU 146 Cb 0.65 0.04 0.00 0.00 -0.10 0.00 0.00 28.75 29.34 2dxt h GLU 146 CO 0.05 0.97 -1.36 1.28 -1.16 0.00 0.00 179.01 178.78 2dxt n LEU 147 N -3.51 0.57 -0.63 1.33 4.77 -0.31 -4.98 117.00 114.23 2dxt n LEU 147 Ca -0.02 -0.23 -0.08 0.00 -0.03 0.00 0.00 56.01 55.65 2dxt n LEU 147 Cb 0.87 -0.02 -0.03 0.00 -2.33 0.00 0.00 43.42 41.91 2dxt n LEU 147 CO 0.47 0.12 -0.08 0.61 -1.33 0.00 0.00 177.39 177.19 2dxt n GLY 148 N 1.39 0.93 3.40 -0.72 0.00 0.18 -5.00 105.19 105.38 2dxt n GLY 148 Ca 0.01 -0.67 -0.12 0.00 0.00 0.00 0.00 46.02 45.23 2dxt n GLY 148 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2dxt s SER 149 N -2.90 -0.49 0.43 1.61 1.04 -1.06 -5.03 113.70 107.31 2dxt s SER 149 Ca 0.00 -0.03 -0.26 0.00 0.48 0.00 0.00 55.95 56.14 2dxt s SER 149 Cb 0.00 0.56 -0.09 0.00 0.10 0.00 0.00 66.02 66.59 2dxt s SER 149 CO 0.00 -0.91 1.40 -0.70 0.98 0.00 0.00 173.24 174.01 2dxt s GLU 150 N -3.57 3.81 -0.10 4.02 2.56 -1.26 -4.32 118.70 119.83 2dxt s GLU 150 Ca 0.01 2.37 0.03 0.00 0.00 0.00 0.00 54.97 57.38 2dxt s GLU 150 Cb -0.00 -2.72 -0.00 0.00 2.00 0.00 0.00 34.13 33.40 2dxt s GLU 150 CO -0.11 -0.70 -0.22 0.08 -0.56 0.00 0.00 175.26 173.75 2dxt s VAL 151 N -1.21 2.29 -0.28 3.70 1.01 -1.26 -5.03 120.40 119.62 2dxt s VAL 151 Ca 0.59 -0.94 -0.29 0.00 0.00 0.00 0.00 61.98 61.34 2dxt s VAL 151 Cb -0.43 -1.89 -0.06 0.00 0.00 0.00 0.00 36.38 34.00 2dxt s VAL 151 CO 0.55 0.55 2.25 -2.65 0.00 0.00 0.00 175.10 175.81 2dxt n PRO 152 N 3.45 1.69 -0.21 2.72 -0.02 -1.26 -4.83 135.00 136.54 2dxt n PRO 152 Ca -0.19 0.42 -0.00 0.00 -2.02 0.00 0.00 63.50 61.71 2dxt n PRO 152 Cb 0.53 -3.14 0.11 0.00 -0.02 0.00 0.00 33.50 30.98 2dxt n PRO 152 CO 0.00 0.00 0.00 1.25 1.98 0.00 0.00 175.50 178.73 2dxt h LEU 153 N 15.29 0.30 -1.52 2.45 5.85 -1.97 -1.37 115.31 134.34 2dxt h LEU 153 Ca -0.36 0.07 -0.04 0.00 0.84 0.00 0.00 57.88 58.39 2dxt h LEU 153 Cb 1.26 0.03 -0.01 0.00 0.37 0.00 0.00 40.66 42.30 2dxt h LEU 153 CO 1.00 0.18 -0.07 0.25 -0.34 0.00 0.00 178.44 179.47 2dxt h LEU 154 N 0.47 0.21 -0.79 2.25 5.85 -1.99 -1.34 115.31 119.97 2dxt h LEU 154 Ca 0.31 -0.03 -0.08 0.00 0.84 0.00 0.00 57.88 58.91 2dxt h LEU 154 Cb 0.35 -0.05 -0.02 0.00 0.37 0.00 0.00 40.66 41.30 2dxt h LEU 154 CO -0.28 0.31 0.00 0.28 -0.34 0.00 0.00 178.44 178.41 2dxt h SER 155 N 0.22 0.89 -0.45 1.25 0.02 -1.64 -0.04 113.55 113.80 2dxt h SER 155 Ca 0.05 -0.23 -0.09 0.00 -0.84 0.00 0.00 61.79 60.68 2dxt h SER 155 Cb 0.26 -0.24 -0.01 0.00 0.14 0.00 0.00 62.40 62.55 2dxt h SER 155 CO 0.01 0.95 -0.06 0.58 -1.14 0.00 0.00 176.83 177.17 2dxt h VAL 156 N 0.85 1.27 0.13 2.27 2.07 -0.95 -1.95 116.25 119.94 2dxt h VAL 156 Ca 0.16 -1.15 0.00 0.00 0.82 0.00 0.00 66.70 66.53 2dxt h VAL 156 Cb 0.50 1.10 -0.01 0.00 -1.52 0.00 0.00 31.29 31.37 2dxt h VAL 156 CO 0.02 0.39 -0.11 0.15 0.02 0.00 0.00 177.57 178.04 2dxt h PHE 157 N 0.67 -0.29 -0.60 1.57 3.57 -0.90 -0.10 116.94 120.86 2dxt h PHE 157 Ca 0.12 0.00 0.06 0.00 3.53 0.00 0.00 57.97 61.68 2dxt h PHE 157 Cb 0.58 0.11 -0.05 0.00 2.79 0.00 0.00 35.95 39.38 2dxt h PHE 157 CO 0.04 -0.18 0.30 0.00 -2.23 0.00 0.00 178.31 176.25 2dxt h ARG 158 N -0.26 0.55 0.02 1.11 3.08 -0.94 -0.76 114.38 117.17 2dxt h ARG 158 Ca -0.00 -0.03 -0.00 0.00 0.07 0.00 0.00 59.98 60.02 2dxt h ARG 158 Cb 0.24 -0.12 0.00 0.00 0.08 0.00 0.00 29.97 30.17 2dxt h ARG 158 CO -0.02 0.37 -0.01 1.03 -1.07 0.00 0.00 179.97 180.27 2dxt h SER 159 N 0.57 -0.02 -0.41 7.04 0.87 -1.12 -1.85 113.55 118.63 2dxt h SER 159 Ca 0.27 -0.08 -0.01 0.00 -1.23 0.00 0.00 61.79 60.74 2dxt h SER 159 Cb 0.20 0.00 -0.02 0.00 -0.44 0.00 0.00 62.40 62.15 2dxt h SER 159 CO -0.19 0.07 0.22 0.25 -0.53 0.00 0.00 176.83 176.65 2dxt h LEU 160 N -0.11 0.51 -0.77 2.23 5.85 -0.70 -1.14 115.31 121.18 2dxt h LEU 160 Ca -0.00 -0.10 -0.02 0.00 0.84 0.00 0.00 57.88 58.59 2dxt h LEU 160 Cb 0.10 -0.13 -0.04 0.00 0.37 0.00 0.00 40.66 40.96 2dxt h LEU 160 CO 0.00 0.47 0.39 0.40 -0.34 0.00 0.00 178.44 179.36 2dxt h ILE 161 N 0.52 1.24 -0.27 4.05 1.08 -1.14 0.15 117.51 123.15 2dxt h ILE 161 Ca 0.14 -0.66 -0.01 0.00 -0.39 0.00 0.00 64.86 63.95 2dxt h ILE 161 Cb 0.07 0.25 -0.01 0.00 -3.07 0.00 0.00 36.82 34.06 2dxt h ILE 161 CO -0.02 0.28 0.14 0.74 -0.69 0.00 0.00 178.15 178.60 2dxt h THR 162 N 1.08 1.14 -0.56 -0.27 2.02 -1.03 -0.72 112.91 114.57 2dxt h THR 162 Ca 0.27 -0.37 -0.06 0.00 0.77 0.00 0.00 66.41 67.01 2dxt h THR 162 Cb 0.09 0.89 -0.02 0.00 -1.74 0.00 0.00 68.15 67.37 2dxt h THR 162 CO -0.04 0.14 0.12 0.78 0.37 0.00 0.00 175.52 176.88 2dxt h ASN 163 N 0.31 0.87 -0.68 4.18 2.35 -0.90 -2.70 115.58 119.00 2dxt h ASN 163 Ca 0.09 -0.25 -0.07 0.00 -0.55 0.00 0.00 56.30 55.53 2dxt h ASN 163 Cb 0.09 -0.23 -0.03 0.00 0.05 0.00 0.00 38.32 38.20 2dxt h ASN 163 CO -0.01 0.89 0.16 -0.07 -1.65 0.00 0.00 177.43 176.75 2dxt h LEU 164 N 0.81 1.05 -0.62 1.61 3.38 -0.80 -1.12 115.31 119.61 2dxt h LEU 164 Ca 0.17 -0.22 -0.00 0.00 0.09 0.00 0.00 57.88 57.92 2dxt h LEU 164 Cb 0.38 -0.28 -0.03 0.00 0.09 0.00 0.00 40.66 40.82 2dxt h LEU 164 CO 0.01 1.01 0.37 -0.78 0.09 0.00 0.00 178.44 179.14 2dxt h ASP 165 N 1.05 0.75 -0.07 -0.43 3.58 -1.01 0.37 116.42 120.67 2dxt h ASP 165 Ca 0.22 -0.06 -0.01 0.00 0.42 0.00 0.00 57.03 57.60 2dxt h ASP 165 Cb 0.37 -0.19 -0.00 0.00 1.72 0.00 0.00 39.33 41.23 2dxt h ASP 165 CO 0.00 0.60 0.02 -0.09 -2.88 0.00 0.00 179.24 176.89 2dxt h ARG 166 N 0.85 0.11 -0.94 0.28 2.43 -1.20 -1.42 114.38 114.49 2dxt h ARG 166 Ca 0.22 -0.02 0.02 0.00 -0.81 0.00 0.00 59.98 59.39 2dxt h ARG 166 Cb -0.02 -0.02 -0.05 0.00 -0.42 0.00 0.00 29.97 29.47 2dxt h ARG 166 CO -0.04 0.29 0.62 -0.07 -1.51 0.00 0.00 179.97 179.25 2dxt h LEU 167 N -0.09 1.06 -0.22 3.80 3.38 -1.00 -2.22 115.31 120.02 2dxt h LEU 167 Ca 0.02 -0.02 -0.06 0.00 0.09 0.00 0.00 57.88 57.91 2dxt h LEU 167 Cb 0.23 -0.26 -0.01 0.00 0.09 0.00 0.00 40.66 40.71 2dxt h LEU 167 CO -0.00 0.75 -0.11 0.22 0.09 0.00 0.00 178.44 179.40 2dxt h TYR 168 N 1.24 0.53 -0.88 1.13 3.20 -0.82 -0.64 116.97 120.74 2dxt h TYR 168 Ca 0.35 -0.13 0.01 0.00 3.14 0.00 0.00 58.73 62.10 2dxt h TYR 168 Cb -0.10 -0.12 -0.04 0.00 1.54 0.00 0.00 36.73 38.00 2dxt h TYR 168 CO -0.01 0.74 0.58 -0.07 -1.64 0.00 0.00 178.16 177.77 2dxt h LEU 169 N 0.17 1.01 -0.39 2.82 4.07 -1.10 -1.52 115.31 120.36 2dxt h LEU 169 Ca 0.05 -0.03 -0.19 0.00 0.08 0.00 0.00 57.88 57.80 2dxt h LEU 169 Cb 0.60 -0.25 -0.00 0.00 1.08 0.00 0.00 40.66 42.09 2dxt h LEU 169 CO 0.03 0.73 -0.73 -1.13 -1.08 0.00 0.00 178.44 176.27 2dxt h ASN 170 N 1.19 0.51 -0.68 -0.43 -1.24 -1.32 -3.11 115.58 110.50 2dxt h ASN 170 Ca 0.32 -0.34 0.01 0.00 0.71 0.00 0.00 56.30 57.01 2dxt h ASN 170 Cb -0.14 -0.15 -0.03 0.00 0.73 0.00 0.00 38.32 38.73 2dxt h ASN 170 CO -0.07 1.08 0.45 0.15 -1.29 0.00 0.00 177.43 177.75 2dxt h PHE 171 N 0.30 0.85 0.00 0.67 3.57 -0.32 0.56 116.94 122.57 2dxt h PHE 171 Ca -0.03 0.02 -0.03 0.00 3.53 0.00 0.00 57.97 61.46 2dxt h PHE 171 Cb 1.30 -0.29 -0.00 0.00 2.79 0.00 0.00 35.95 39.75 2dxt h PHE 171 CO 0.05 0.53 -0.15 -0.07 -2.23 0.00 0.00 178.31 176.43 2dxt h LEU 172 N 0.91 0.00 0.02 0.59 3.38 -1.24 -2.26 115.31 116.71 2dxt h LEU 172 Ca 0.25 0.00 -0.40 0.00 0.09 0.00 0.00 57.88 57.83 2dxt h LEU 172 Cb -0.08 0.00 -0.06 0.00 0.09 0.00 0.00 40.66 40.60 2dxt h LEU 172 CO -0.06 0.15 -2.38 0.29 0.09 0.00 0.00 178.44 176.53 2dxt n LYS 173 N -4.18 0.65 -3.39 1.13 5.02 -0.58 -4.75 118.16 112.05 2dxt n LYS 173 Ca -0.02 0.20 -0.26 0.00 -2.02 0.00 0.00 58.31 56.21 2dxt n LYS 173 Cb 0.23 -1.55 -0.08 0.00 -0.02 0.00 0.00 35.03 33.61 2dxt n LYS 173 CO 0.00 0.00 0.00 0.09 -0.52 0.00 0.00 177.40 176.97 2dxt n ASN 174 N -3.53 2.08 0.11 4.39 3.02 0.19 -4.97 115.26 116.54 2dxt n ASN 174 Ca -0.45 -3.07 0.06 0.00 -0.03 0.00 0.00 54.58 51.09 2dxt n ASN 174 Cb 0.97 -0.66 0.34 0.00 -0.61 0.00 0.00 39.78 39.81 2dxt n ASN 174 CO 0.00 0.00 0.00 -0.81 -2.62 0.00 0.00 177.26 173.83 2dxt n PRO 175 N 1.34 0.08 0.09 3.52 -0.04 -0.85 -1.95 135.00 137.19 2dxt n PRO 175 Ca 0.26 0.55 0.09 0.00 -0.04 0.00 0.00 63.50 64.36 2dxt n PRO 175 Cb 0.45 -1.87 -0.01 0.00 -0.04 0.00 0.00 33.50 32.03 2dxt n PRO 175 CO 0.00 0.00 0.00 0.52 -0.04 0.00 0.00 175.50 175.98 2dxt h MET 176 N 0.00 0.00 -0.92 0.54 2.86 -1.93 -3.38 114.93 112.09 2dxt h MET 176 Ca 0.00 0.00 0.14 0.00 -2.06 0.00 0.00 59.70 57.78 2dxt h MET 176 Cb 0.20 0.00 -0.08 0.00 0.06 0.00 0.00 31.60 31.78 2dxt h MET 176 CO 0.00 0.06 0.59 -0.44 1.06 0.00 0.00 176.91 178.17 2dxt h ASP 177 N 0.00 0.71 -0.42 1.22 5.19 -1.77 -2.15 116.42 119.19 2dxt h ASP 177 Ca -0.03 0.05 0.06 0.00 -0.62 0.00 0.00 57.03 56.48 2dxt h ASP 177 Cb 1.11 -0.09 -0.02 0.00 0.18 0.00 0.00 39.33 40.50 2dxt h ASP 177 CO 0.01 0.36 0.28 -0.29 -3.12 0.00 0.00 179.24 176.48 2dxt h ILE 178 N 0.75 0.97 -0.52 0.35 6.09 -1.78 -2.79 117.51 120.57 2dxt h ILE 178 Ca 0.47 -0.12 0.03 0.00 -1.37 0.00 0.00 64.86 63.87 2dxt h ILE 178 Cb 0.70 0.59 -0.04 0.00 0.47 0.00 0.00 36.82 38.54 2dxt h ILE 178 CO -0.23 0.06 0.31 -0.07 -3.07 0.00 0.00 178.15 175.15 2dxt h LEU 179 N 0.34 0.49 -1.17 2.19 3.38 -1.67 -1.22 115.31 117.65 2dxt h LEU 179 Ca 0.18 0.01 -0.09 0.00 0.09 0.00 0.00 57.88 58.07 2dxt h LEU 179 Cb 0.29 -0.09 -0.01 0.00 0.09 0.00 0.00 40.66 40.94 2dxt h LEU 179 CO -0.04 0.34 -0.39 0.78 0.09 0.00 0.00 178.44 179.22 2dxt h ASN 180 N 0.61 0.04 -0.08 -0.43 2.35 -1.65 -0.93 115.58 115.48 2dxt h ASN 180 Ca 0.21 -0.01 -0.11 0.00 -0.55 0.00 0.00 56.30 55.83 2dxt h ASN 180 Cb 0.04 -0.01 -0.01 0.00 0.05 0.00 0.00 38.32 38.38 2dxt h ASN 180 CO -0.10 0.43 -0.31 -0.07 -1.65 0.00 0.00 177.43 175.72 2dxt h LEU 181 N 0.03 0.58 -0.11 1.61 3.38 -1.35 -2.14 115.31 117.31 2dxt h LEU 181 Ca 0.00 -0.22 -0.05 0.00 0.09 0.00 0.00 57.88 57.70 2dxt h LEU 181 Cb 0.71 -0.16 -0.00 0.00 0.09 0.00 0.00 40.66 41.30 2dxt h LEU 181 CO 0.05 0.86 -0.11 0.58 0.09 0.00 0.00 178.44 179.91 2dxt h VAL 182 N 0.48 1.36 -0.60 1.22 2.07 -0.82 -2.92 116.25 117.05 2dxt h VAL 182 Ca 0.06 -1.27 0.08 0.00 0.82 0.00 0.00 66.70 66.39 2dxt h VAL 182 Cb 0.78 1.95 -0.07 0.00 -1.52 0.00 0.00 31.29 32.44 2dxt h VAL 182 CO 0.06 0.36 0.25 0.03 0.02 0.00 0.00 177.57 178.30 2dxt h ARG 183 N -0.14 0.44 0.00 1.57 3.08 -1.06 0.25 114.38 118.53 2dxt h ARG 183 Ca 0.02 -0.03 0.00 0.00 0.07 0.00 0.00 59.98 60.04 2dxt h ARG 183 Cb 0.63 -0.10 0.00 0.00 0.08 0.00 0.00 29.97 30.58 2dxt h ARG 183 CO 0.03 0.29 0.00 -0.25 -1.07 0.00 0.00 179.97 178.97 2dxt n ASP 184 N -4.95 0.49 -0.02 7.04 8.00 -0.81 -3.35 116.55 122.94 2dxt n ASP 184 Ca 0.08 0.60 0.02 0.00 0.71 0.00 0.00 54.79 56.20 2dxt n ASP 184 Cb 0.24 -0.71 0.03 0.00 -0.02 0.00 0.00 41.12 40.67 2dxt n ASP 184 CO 0.00 0.00 0.00 0.59 -0.39 0.00 0.00 177.20 177.40 2dxt n ASN 185 N -2.01 1.99 -4.75 -2.24 3.02 -0.44 -5.05 115.26 105.77 2dxt n ASN 185 Ca 0.03 -2.23 -0.22 0.00 -0.03 0.00 0.00 54.58 52.13 2dxt n ASN 185 Cb 0.26 -0.10 -0.06 0.00 -0.61 0.00 0.00 39.78 39.27 2dxt n ASN 185 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2dxt s MET 186 N -1.40 2.52 -0.37 3.52 0.23 -0.05 -0.35 119.30 123.40 2dxt s MET 186 Ca 0.08 -1.39 -0.27 0.00 -1.03 0.00 0.00 55.69 53.08 2dxt s MET 186 Cb 0.07 -2.30 0.02 0.00 -1.53 0.00 0.00 34.83 31.09 2dxt s MET 186 CO 0.01 0.21 1.00 0.42 -2.03 0.00 0.00 175.02 174.62 2dxt s ILE 187 N -2.33 4.50 0.27 3.16 1.01 -0.59 -4.80 121.20 122.42 2dxt s ILE 187 Ca 0.36 1.33 0.02 0.00 0.00 0.00 0.00 60.65 62.36 2dxt s ILE 187 Cb -0.05 -4.40 -0.06 0.00 0.01 0.00 0.00 42.46 37.97 2dxt s ILE 187 CO 0.23 -0.60 0.06 -0.76 0.00 0.00 0.00 174.94 173.87 2dxt s LEU 188 N 3.68 1.93 -0.56 2.97 1.43 -1.26 -4.85 118.68 122.01 2dxt s LEU 188 Ca 0.41 -1.35 0.00 0.00 -1.03 0.00 0.00 54.13 52.17 2dxt s LEU 188 Cb -0.11 -0.17 0.00 0.00 0.03 0.00 0.00 46.19 45.94 2dxt s LEU 188 CO 0.20 -0.65 0.00 0.61 0.23 0.00 0.00 176.35 176.74 2dxt n GLY 189 N -0.52 0.79 3.31 -3.19 0.00 0.36 -5.02 105.19 100.91 2dxt n GLY 189 Ca -0.02 -0.82 -0.17 0.00 0.00 0.00 0.00 46.02 45.01 2dxt n GLY 189 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 2dxt s VAL 190 N -2.20 1.56 0.20 1.61 -7.23 -1.26 -4.92 120.40 108.17 2dxt s VAL 190 Ca 0.00 -2.12 -0.30 0.00 -1.81 0.00 0.00 61.98 57.76 2dxt s VAL 190 Cb 0.00 -1.94 -0.08 0.00 0.56 0.00 0.00 36.38 34.92 2dxt s VAL 190 CO 0.00 -0.61 0.94 -0.60 -0.31 0.00 0.00 175.10 174.52 2dxt s ARG 191 N -3.55 4.81 0.06 4.82 3.52 -1.26 -1.00 118.95 126.35 2dxt s ARG 191 Ca 0.19 1.47 -0.00 0.00 -0.13 0.00 0.00 55.73 57.26 2dxt s ARG 191 Cb -0.00 -3.31 -0.04 0.00 -1.56 0.00 0.00 34.95 30.04 2dxt s ARG 191 CO 0.05 0.44 -0.04 0.14 -0.81 0.00 0.00 175.30 175.07 2dxt s VAL 192 N -0.86 0.34 -0.07 7.11 -7.23 0.24 -1.39 120.40 118.54 2dxt s VAL 192 Ca 0.42 -1.69 0.04 0.00 -1.81 0.00 0.00 61.98 58.94 2dxt s VAL 192 Cb -0.25 -1.35 0.00 0.00 0.56 0.00 0.00 36.38 35.33 2dxt s VAL 192 CO 0.31 -0.87 -0.20 -0.75 -0.31 0.00 0.00 175.10 173.28 2dxt s LYS 193 N -3.46 2.36 -0.26 4.82 2.20 0.23 -1.64 119.74 123.99 2dxt s LYS 193 Ca 0.04 -0.71 -0.14 0.00 -0.36 0.00 0.00 55.97 54.81 2dxt s LYS 193 Cb 0.04 -1.89 -0.04 0.00 -1.51 0.00 0.00 37.83 34.43 2dxt s LYS 193 CO -0.07 0.18 0.33 0.42 -0.36 0.00 0.00 175.35 175.86 2dxt s ILE 194 N 0.28 5.21 0.46 5.43 -1.09 -0.10 -1.31 121.20 130.09 2dxt s ILE 194 Ca -0.12 0.50 -0.07 0.00 -2.23 0.00 0.00 60.65 58.73 2dxt s ILE 194 Cb -0.15 -3.66 -0.04 0.00 -1.58 0.00 0.00 42.46 37.02 2dxt s ILE 194 CO 0.05 0.20 0.79 -0.76 -1.23 0.00 0.00 174.94 173.99 2dxt s LEU 195 N 1.84 3.67 0.00 2.97 1.43 -0.33 -2.72 118.68 125.53 2dxt s LEU 195 Ca 0.14 1.01 0.00 0.00 -1.03 0.00 0.00 54.13 54.24 2dxt s LEU 195 Cb -0.15 -3.94 0.00 0.00 0.03 0.00 0.00 46.19 42.12 2dxt s LEU 195 CO 0.09 -0.54 0.00 0.61 0.23 0.00 0.00 176.35 176.75 2dxt n GLY 196 N -2.00 -0.26 3.77 -3.19 0.00 -1.26 -4.54 105.19 97.71 2dxt n GLY 196 Ca 0.01 -2.24 -0.40 0.00 0.00 0.00 0.00 46.02 43.39 2dxt n GLY 196 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 2dxt s ASP 197 N -4.00 6.84 -1.13 1.61 1.01 -1.26 -1.96 116.67 117.78 2dxt s ASP 197 Ca 0.00 2.55 0.00 0.00 0.71 0.00 0.00 52.55 55.81 2dxt s ASP 197 Cb 0.00 -2.64 0.00 0.00 1.01 0.00 0.00 42.92 41.29 2dxt s ASP 197 CO 0.00 -0.47 0.00 0.61 0.21 0.00 0.00 175.17 175.52 2dxt n GLY 198 N 0.87 0.69 3.41 0.21 0.00 -1.26 -4.95 105.19 104.15 2dxt n GLY 198 Ca 0.00 -0.45 -0.36 0.00 0.00 0.00 0.00 46.02 45.21 2dxt n GLY 198 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 2dxt n SER 199 N -0.02 -1.77 -3.60 1.61 2.88 -0.83 -5.01 113.62 106.88 2dxt n SER 199 Ca -0.13 0.56 -0.09 0.00 -1.33 0.00 0.00 58.87 57.89 2dxt n SER 199 Cb 0.48 -1.15 -0.02 0.00 -0.75 0.00 0.00 64.21 62.77 2dxt n SER 199 CO 0.00 0.00 0.00 0.72 -1.23 0.00 0.00 175.04 174.53 2dxt s PHE 200 N -1.94 -0.34 0.20 0.66 -0.71 -1.10 -5.00 117.98 109.74 2dxt s PHE 200 Ca 0.63 0.07 0.08 0.00 -1.04 0.00 0.00 56.93 56.67 2dxt s PHE 200 Cb -0.35 0.60 -0.05 0.00 -1.21 0.00 0.00 43.02 42.02 2dxt s PHE 200 CO 0.61 -0.87 -0.15 -1.21 -1.34 0.00 0.00 175.22 172.25 2dxt s GLU 201 N -3.56 1.32 0.00 1.99 2.02 -1.26 -0.93 118.70 118.28 2dxt s GLU 201 Ca 0.06 -1.55 0.00 0.00 0.02 0.00 0.00 54.97 53.51 2dxt s GLU 201 Cb -0.02 -1.19 0.00 0.00 0.10 0.00 0.00 34.13 33.02 2dxt s GLU 201 CO -0.05 0.21 0.00 0.41 0.02 0.00 0.00 175.26 175.85 2dxt n GLY 202 N -0.21 -1.65 3.69 -1.39 0.00 -0.65 -4.40 105.19 100.59 2dxt n GLY 202 Ca -0.09 -1.08 -0.39 0.00 0.00 0.00 0.00 46.02 44.46 2dxt n GLY 202 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2dxt s ILE 203 N -2.32 5.10 -0.59 -0.61 -1.09 -0.16 -0.60 121.20 120.94 2dxt s ILE 203 Ca 0.00 1.11 -0.28 0.00 -2.23 0.00 0.00 60.65 59.25 2dxt s ILE 203 Cb 0.00 -3.90 0.01 0.00 -1.58 0.00 0.00 42.46 36.99 2dxt s ILE 203 CO 0.00 0.23 1.47 0.00 -1.23 0.00 0.00 174.94 175.41 2dxt s ALA 204 N 1.16 2.71 -0.09 9.38 0.00 -0.17 -1.34 121.76 133.41 2dxt s ALA 204 Ca 0.29 -0.76 -0.17 0.00 0.00 0.00 0.00 51.96 51.32 2dxt s ALA 204 Cb -0.16 -4.16 -0.28 0.00 0.00 0.00 0.00 23.12 18.52 2dxt s ALA 204 CO 0.12 -3.12 0.63 0.93 0.00 0.00 0.00 175.76 174.31 2dxt h GLU 205 N 11.52 0.26 0.00 0.00 4.39 -1.21 0.10 114.58 129.64 2dxt h GLU 205 Ca -0.27 -0.45 0.18 0.00 0.34 0.00 0.00 59.36 59.16 2dxt h GLU 205 Cb 1.10 0.17 -0.03 0.00 -0.10 0.00 0.00 28.75 29.88 2dxt h GLU 205 CO 1.20 1.22 0.47 -3.47 -1.16 0.00 0.00 179.01 177.27 2dxt n ASP 206 N -3.95 -0.59 -4.36 1.42 2.03 -1.23 -4.62 116.55 105.25 2dxt n ASP 206 Ca -0.23 -1.10 -0.30 0.00 0.52 0.00 0.00 54.79 53.68 2dxt n ASP 206 Cb 0.90 0.92 -0.14 0.00 -0.72 0.00 0.00 41.12 42.07 2dxt n ASP 206 CO 0.00 0.00 0.00 0.27 -1.92 0.00 0.00 177.20 175.55 2dxt s ILE 207 N -2.07 2.21 0.00 5.18 -4.36 -1.26 -0.04 121.20 120.86 2dxt s ILE 207 Ca 0.16 -1.47 0.00 0.00 -0.26 0.00 0.00 60.65 59.07 2dxt s ILE 207 Cb -0.00 -1.89 0.00 0.00 1.25 0.00 0.00 42.46 41.81 2dxt s ILE 207 CO -0.01 0.30 0.00 -0.90 0.24 0.00 0.00 174.94 174.57 2dxt n ASP 208 N 1.55 0.00 0.04 4.36 5.68 -0.17 -4.86 116.55 123.14 2dxt n ASP 208 Ca -0.17 -0.77 0.06 0.00 -0.50 0.00 0.00 54.79 53.41 2dxt n ASP 208 Cb 0.52 0.00 0.28 0.00 -1.14 0.00 0.00 41.12 40.78 2dxt n ASP 208 CO 0.00 0.00 0.00 -0.90 -1.33 0.00 0.00 177.20 174.97 2dxt n ASP 209 N -2.30 0.17 -0.68 -1.12 5.75 -1.26 -1.30 116.55 115.80 2dxt n ASP 209 Ca 0.00 0.55 0.09 0.00 -0.01 0.00 0.00 54.79 55.42 2dxt n ASP 209 Cb 0.00 -0.58 0.07 0.00 -1.03 0.00 0.00 41.12 39.57 2dxt n ASP 209 CO 0.00 0.00 0.00 0.49 -0.11 0.00 0.00 177.20 177.58 2dxt n PHE 210 N -1.70 0.00 -0.70 2.11 3.01 -1.26 -4.96 117.46 113.96 2dxt n PHE 210 Ca 0.02 0.00 0.00 0.00 1.01 0.00 0.00 57.45 58.48 2dxt n PHE 210 Cb 0.12 0.00 0.00 0.00 -0.01 0.00 0.00 39.48 39.59 2dxt n PHE 210 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 2dxt n GLY 211 N 1.03 0.67 3.76 1.37 0.00 -0.42 -4.92 105.19 106.68 2dxt n GLY 211 Ca 0.10 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.73 2dxt n GLY 211 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2dxt s ARG 212 N -0.30 4.58 -0.03 1.61 0.52 -1.26 -4.70 118.95 119.37 2dxt s ARG 212 Ca 0.00 1.70 -0.30 0.00 -0.52 0.00 0.00 55.73 56.61 2dxt s ARG 212 Cb 0.00 -3.07 -0.03 0.00 0.52 0.00 0.00 34.95 32.37 2dxt s ARG 212 CO 0.00 0.19 1.02 -1.17 0.02 0.00 0.00 175.30 175.36 2dxt s LEU 213 N -1.66 4.33 -0.29 2.53 2.96 -0.43 -1.00 118.68 125.12 2dxt s LEU 213 Ca 0.47 1.67 -0.15 0.00 -0.22 0.00 0.00 54.13 55.90 2dxt s LEU 213 Cb -0.29 -3.57 -0.03 0.00 0.50 0.00 0.00 46.19 42.80 2dxt s LEU 213 CO 0.37 -0.35 0.35 -0.63 -1.32 0.00 0.00 176.35 174.76 2dxt s ILE 214 N 1.37 5.19 -0.10 6.68 -1.09 0.94 -0.73 121.20 133.46 2dxt s ILE 214 Ca 0.52 0.35 0.02 0.00 -2.23 0.00 0.00 60.65 59.32 2dxt s ILE 214 Cb -0.21 -3.72 -0.01 0.00 -1.58 0.00 0.00 42.46 36.94 2dxt s ILE 214 CO 0.25 0.09 -0.18 -0.63 -1.23 0.00 0.00 174.94 173.23 2dxt s ILE 215 N 2.02 2.59 -0.35 2.92 1.01 -0.47 -0.66 121.20 128.25 2dxt s ILE 215 Ca 0.13 -0.84 -0.12 0.00 0.00 0.00 0.00 60.65 59.82 2dxt s ILE 215 Cb -0.16 -2.03 0.00 0.00 0.01 0.00 0.00 42.46 40.28 2dxt s ILE 215 CO 0.11 0.55 0.21 -0.60 0.00 0.00 0.00 174.94 175.21 2dxt s ARG 216 N 0.17 3.23 0.63 2.79 3.52 -0.45 -1.33 118.95 127.50 2dxt s ARG 216 Ca -0.10 -0.82 -0.12 0.00 -0.13 0.00 0.00 55.73 54.56 2dxt s ARG 216 Cb -0.16 -3.74 -0.03 0.00 -1.56 0.00 0.00 34.95 29.46 2dxt s ARG 216 CO 0.06 -0.54 1.04 -0.51 -0.81 0.00 0.00 175.30 174.54 2dxt s LEU 217 N 1.65 3.27 0.57 -0.88 1.02 0.09 -0.99 118.68 123.40 2dxt s LEU 217 Ca 0.05 1.54 0.27 0.00 0.02 0.00 0.00 54.13 56.01 2dxt s LEU 217 Cb -0.18 -4.49 1.54 0.00 0.02 0.00 0.00 46.19 43.08 2dxt s LEU 217 CO 0.08 -1.06 2.02 0.44 0.02 0.00 0.00 176.35 177.85 2dxt h ASP 218 N -0.24 0.00 1.08 2.29 3.32 -1.88 0.22 116.42 121.21 2dxt h ASP 218 Ca -0.45 0.00 0.00 0.00 0.02 0.00 0.00 57.03 56.60 2dxt h ASP 218 Cb 1.20 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.75 2dxt h ASP 218 CO 0.60 0.00 0.00 -1.54 -1.72 0.00 0.00 179.24 176.58 2dxt n SER 219 N -3.94 0.56 0.00 6.45 3.41 -1.26 -4.88 113.62 113.97 2dxt n SER 219 Ca 0.05 0.58 0.00 0.00 -0.26 0.00 0.00 58.87 59.24 2dxt n SER 219 Cb 0.47 -0.72 0.00 0.00 -0.26 0.00 0.00 64.21 63.70 2dxt n SER 219 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2dxt n GLY 220 N 0.82 1.99 3.77 5.00 0.00 0.78 -5.06 105.19 112.49 2dxt n GLY 220 Ca 0.05 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.66 2dxt n GLY 220 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 2dxt s GLU 221 N -0.82 3.82 -0.17 1.61 2.12 -1.26 -4.71 118.70 119.29 2dxt s GLU 221 Ca 0.00 2.43 -0.02 0.00 0.36 0.00 0.00 54.97 57.75 2dxt s GLU 221 Cb 0.00 -2.74 -0.01 0.00 0.26 0.00 0.00 34.13 31.64 2dxt s GLU 221 CO 0.00 -0.72 -0.09 0.08 -0.54 0.00 0.00 175.26 173.99 2dxt s VAL 222 N -1.19 3.18 0.12 3.70 1.01 -1.26 -0.73 120.40 125.22 2dxt s VAL 222 Ca 0.59 -0.59 0.09 0.00 0.00 0.00 0.00 61.98 62.06 2dxt s VAL 222 Cb -0.44 -2.38 -0.04 0.00 0.00 0.00 0.00 36.38 33.52 2dxt s VAL 222 CO 0.57 0.48 -0.17 -0.54 0.00 0.00 0.00 175.10 175.45 2dxt s LYS 223 N 0.85 1.82 -0.24 2.72 1.02 -0.44 -4.97 119.74 120.50 2dxt s LYS 223 Ca -0.03 -1.17 -0.01 0.00 0.02 0.00 0.00 55.97 54.78 2dxt s LYS 223 Cb -0.15 -2.13 0.03 0.00 -0.52 0.00 0.00 37.83 35.06 2dxt s LYS 223 CO 0.01 0.48 -0.09 0.15 -0.92 0.00 0.00 175.35 174.98 2dxt s LYS 224 N -2.19 2.81 -0.24 1.68 1.02 -1.26 -1.37 119.74 120.19 2dxt s LYS 224 Ca 0.19 -0.98 -0.14 0.00 0.02 0.00 0.00 55.97 55.05 2dxt s LYS 224 Cb -0.11 -2.91 -0.04 0.00 -0.52 0.00 0.00 37.83 34.25 2dxt s LYS 224 CO 0.11 -0.38 0.33 0.08 -0.92 0.00 0.00 175.35 174.56 2dxt s VAL 225 N 1.30 5.23 0.18 3.17 1.01 0.09 -4.90 120.40 126.48 2dxt s VAL 225 Ca 0.00 0.51 -0.18 0.00 0.00 0.00 0.00 61.98 62.31 2dxt s VAL 225 Cb -0.16 -3.66 -0.08 0.00 0.00 0.00 0.00 36.38 32.48 2dxt s VAL 225 CO -0.06 0.24 0.66 -0.63 0.00 0.00 0.00 175.10 175.31 2dxt s ILE 226 N 1.54 4.66 -0.75 2.22 1.01 -1.26 -1.31 121.20 127.31 2dxt s ILE 226 Ca 0.14 1.16 -0.22 0.00 0.00 0.00 0.00 60.65 61.74 2dxt s ILE 226 Cb -0.15 -3.84 0.08 0.00 0.01 0.00 0.00 42.46 38.56 2dxt s ILE 226 CO 0.08 0.27 1.05 -0.72 0.00 0.00 0.00 174.94 175.61 2dxt s TYR 227 N -1.45 2.75 0.00 3.97 1.13 -1.26 -4.72 117.35 117.77 2dxt s TYR 227 Ca 0.40 -0.75 0.00 0.00 -1.41 0.00 0.00 57.07 55.31 2dxt s TYR 227 Cb -0.17 -4.33 0.00 0.00 -1.10 0.00 0.00 41.96 36.36 2dxt s TYR 227 CO 0.20 -1.65 0.00 0.41 -2.51 0.00 0.00 175.55 172.00 2dxt n GLY 228 N 5.47 2.45 0.93 5.49 0.00 -1.26 -4.90 105.19 113.38 2dxt n GLY 228 Ca 0.05 -0.24 -0.01 0.00 0.00 0.00 0.00 46.02 45.82 2dxt n GLY 228 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 2dxt n ASP 229 N 0.00 2.55 -4.68 1.61 8.00 -1.26 -4.92 116.55 117.85 2dxt n ASP 229 Ca 0.00 -2.08 -0.42 0.00 0.71 0.00 0.00 54.79 53.00 2dxt n ASP 229 Cb 0.00 -0.52 -0.03 0.00 -0.02 0.00 0.00 41.12 40.56 2dxt n ASP 229 CO 0.00 0.00 0.00 -0.69 -0.39 0.00 0.00 177.20 176.12 2dxt s VAL 230 N -0.44 4.06 -0.22 2.53 1.01 -1.26 -5.00 120.40 121.08 2dxt s VAL 230 Ca 0.03 1.36 -0.06 0.00 0.00 0.00 0.00 61.98 63.31 2dxt s VAL 230 Cb 0.03 -3.88 -0.03 0.00 0.00 0.00 0.00 36.38 32.50 2dxt s VAL 230 CO 0.01 -0.05 0.04 -0.44 0.00 0.00 0.00 175.10 174.65 2dxt s SER 231 N 1.94 5.11 -0.02 3.32 0.01 -1.26 -5.03 113.70 117.78 2dxt s SER 231 Ca 0.59 -0.15 0.06 0.00 1.31 0.00 0.00 55.95 57.76 2dxt s SER 231 Cb -0.26 -1.89 -0.01 0.00 0.21 0.00 0.00 66.02 64.06 2dxt s SER 231 CO 0.21 0.05 -0.19 -0.22 0.41 0.00 0.00 173.24 173.50 2dxt s LEU 232 N 1.12 2.03 -0.01 2.44 0.20 -1.26 -1.19 118.68 122.01 2dxt s LEU 232 Ca 0.04 -0.35 0.05 0.00 0.69 0.00 0.00 54.13 54.55 2dxt s LEU 232 Cb -0.14 -1.00 -0.01 0.00 -0.43 0.00 0.00 46.19 44.60 2dxt s LEU 232 CO 0.03 0.23 -0.17 -0.60 -0.29 0.00 0.00 176.35 175.55 2dxt s ARG 233 N -0.42 1.33 0.03 1.98 3.52 -0.43 -4.97 118.95 119.99 2dxt s ARG 233 Ca 0.07 -0.60 -0.26 0.00 -0.13 0.00 0.00 55.73 54.81 2dxt s ARG 233 Cb -0.08 -1.29 -0.05 0.00 -1.56 0.00 0.00 34.95 31.97 2dxt s ARG 233 CO -0.01 0.35 0.79 -0.06 -0.81 0.00 0.00 175.30 175.57 2dxt s PHE 234 N -0.40 3.71 -2.94 5.12 0.08 -1.26 -0.60 117.98 121.69 2dxt s PHE 234 Ca 0.06 1.48 0.23 0.00 0.12 0.00 0.00 56.93 58.83 2dxt s PHE 234 Cb -0.06 -2.87 0.19 0.00 -0.57 0.00 0.00 43.02 39.70 2dxt s PHE 234 CO -0.01 0.21 1.24 1.28 -0.10 0.00 0.00 175.22 177.85