#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1up6 s ILE 3 N 0.00 3.60 -0.13 5.15 1.01 -0.43 -0.03 121.20 130.37 1up6 s ILE 3 Ca 0.00 -0.47 -0.07 0.00 0.00 0.00 0.00 60.65 60.11 1up6 s ILE 3 Cb 0.00 -2.55 -0.04 0.00 0.01 0.00 0.00 42.46 39.88 1up6 s ILE 3 CO 0.00 0.51 0.13 0.00 0.00 0.00 0.00 174.94 175.58 1up6 s ALA 4 N 0.30 3.81 -0.16 9.38 0.00 0.02 -1.36 121.76 133.75 1up6 s ALA 4 Ca -0.06 -0.66 0.01 0.00 0.00 0.00 0.00 51.96 51.25 1up6 s ALA 4 Cb -0.15 -1.96 0.02 0.00 0.00 0.00 0.00 23.12 21.03 1up6 s ALA 4 CO 0.04 0.56 -0.16 0.08 0.00 0.00 0.00 175.76 176.28 1up6 s VAL 5 N -0.84 1.73 -0.32 0.00 1.01 -0.30 -0.67 120.40 121.01 1up6 s VAL 5 Ca 0.14 -0.73 -0.07 0.00 0.00 0.00 0.00 61.98 61.32 1up6 s VAL 5 Cb -0.12 -1.59 0.02 0.00 0.00 0.00 0.00 36.38 34.69 1up6 s VAL 5 CO 0.03 0.48 0.10 -0.63 0.00 0.00 0.00 175.10 175.08 1up6 s ILE 6 N 1.38 3.91 0.00 2.22 -1.09 -0.27 -1.25 121.20 126.09 1up6 s ILE 6 Ca 0.04 -0.92 0.00 0.00 -2.23 0.00 0.00 60.65 57.54 1up6 s ILE 6 Cb -0.13 -3.12 0.00 0.00 -1.58 0.00 0.00 42.46 37.63 1up6 s ILE 6 CO -0.11 -0.06 0.00 0.61 -1.23 0.00 0.00 174.94 174.15 1up6 n GLY 7 N 4.85 1.04 0.37 6.18 0.00 0.61 -0.79 105.19 117.45 1up6 n GLY 7 Ca -0.13 -0.02 0.19 0.00 0.00 0.00 0.00 46.02 46.06 1up6 n GLY 7 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 1up6 h GLY 8 N 0.00 0.00 -0.94 -0.02 0.00 -1.42 -1.33 103.07 99.36 1up6 h GLY 8 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 1up6 h GLY 8 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 176.54 177.15 1up6 n GLY 9 N -1.44 0.36 3.76 4.60 0.00 -1.26 -4.72 105.19 106.49 1up6 n GLY 9 Ca 0.05 -0.22 -0.40 0.00 0.00 0.00 0.00 46.02 45.45 1up6 n GLY 9 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1up6 s SER 10 N -0.82 7.12 0.30 1.61 0.15 -0.50 -4.74 113.70 116.81 1up6 s SER 10 Ca 0.13 2.39 0.20 0.00 0.70 0.00 0.00 55.95 59.38 1up6 s SER 10 Cb 0.08 -2.63 1.09 0.00 -1.71 0.00 0.00 66.02 62.85 1up6 s SER 10 CO 0.08 -0.26 1.62 -1.54 1.20 0.00 0.00 173.24 174.33 1up6 n SER 11 N 1.11 0.53 0.05 5.45 3.41 -1.26 -0.89 113.62 122.00 1up6 n SER 11 Ca -0.01 0.74 0.12 0.00 -0.26 0.00 0.00 58.87 59.47 1up6 n SER 11 Cb 0.44 -0.81 0.24 0.00 -0.26 0.00 0.00 64.21 63.81 1up6 n SER 11 CO 0.00 0.00 0.00 -1.22 -0.16 0.00 0.00 175.04 173.66 1up6 n TYR 12 N -2.21 0.42 -0.24 7.33 4.01 -1.26 -4.48 117.16 120.73 1up6 n TYR 12 Ca -0.01 0.12 0.05 0.00 -0.16 0.00 0.00 57.90 57.90 1up6 n TYR 12 Cb 0.04 -0.57 0.16 0.00 -0.31 0.00 0.00 39.34 38.66 1up6 n TYR 12 CO 0.00 0.00 0.00 1.15 -0.46 0.00 0.00 176.86 177.55 1up6 h THR 13 N 0.00 0.45 -0.48 -0.72 2.02 -1.31 -2.00 112.91 110.87 1up6 h THR 13 Ca 0.00 -0.06 0.08 0.00 0.77 0.00 0.00 66.41 67.20 1up6 h THR 13 Cb 0.67 0.25 -0.07 0.00 -1.74 0.00 0.00 68.15 67.26 1up6 h THR 13 CO 0.00 0.03 0.07 -0.65 0.37 0.00 0.00 175.52 175.34 1up6 h PRO 14 N 0.19 0.19 -0.62 6.66 0.11 -1.81 0.66 132.00 137.38 1up6 h PRO 14 Ca 0.40 -0.01 0.05 0.00 0.11 0.00 0.00 66.00 66.55 1up6 h PRO 14 Cb 0.70 -0.04 -0.05 0.00 0.11 0.00 0.00 31.00 31.71 1up6 h PRO 14 CO -0.56 0.12 0.34 0.93 -0.21 0.00 0.00 178.00 178.62 1up6 h GLU 15 N 0.19 0.63 -0.61 1.05 4.39 -1.69 0.41 114.58 118.95 1up6 h GLU 15 Ca 0.24 -0.04 0.05 0.00 0.34 0.00 0.00 59.36 59.96 1up6 h GLU 15 Cb 0.33 -0.14 -0.05 0.00 -0.10 0.00 0.00 28.75 28.79 1up6 h GLU 15 CO -0.34 0.41 0.33 1.25 -1.16 0.00 0.00 179.01 179.50 1up6 h LEU 16 N 0.64 0.48 -0.54 1.33 5.85 -0.85 0.15 115.31 122.36 1up6 h LEU 16 Ca 0.27 0.03 -0.12 0.00 0.84 0.00 0.00 57.88 58.91 1up6 h LEU 16 Cb 0.15 -0.06 -0.02 0.00 0.37 0.00 0.00 40.66 41.11 1up6 h LEU 16 CO -0.17 0.31 -0.12 0.58 -0.34 0.00 0.00 178.44 178.71 1up6 h VAL 17 N 0.61 1.27 -0.01 1.05 2.07 0.18 0.10 116.25 121.52 1up6 h VAL 17 Ca 0.27 -1.28 0.03 0.00 0.82 0.00 0.00 66.70 66.54 1up6 h VAL 17 Cb 0.17 0.97 -0.04 0.00 -1.52 0.00 0.00 31.29 30.88 1up6 h VAL 17 CO -0.18 0.45 -0.18 0.50 0.02 0.00 0.00 177.57 178.19 1up6 h LYS 18 N 0.92 -0.27 -0.55 1.57 3.64 -0.53 0.33 116.57 121.69 1up6 h LYS 18 Ca 0.14 0.02 0.11 0.00 -1.27 0.00 0.00 60.65 59.65 1up6 h LYS 18 Cb 0.70 0.06 -0.09 0.00 -0.41 0.00 0.00 32.23 32.48 1up6 h LYS 18 CO 0.05 -0.18 -0.04 0.78 -2.27 0.00 0.00 179.45 177.79 1up6 h GLY 19 N -0.28 0.52 1.54 5.01 0.00 -0.24 0.22 103.07 109.84 1up6 h GLY 19 Ca 0.06 0.10 -0.05 0.00 0.00 0.00 0.00 47.33 47.44 1up6 h GLY 19 CO -0.18 -0.18 0.04 1.41 0.00 0.00 0.00 176.54 177.64 1up6 h LEU 20 N 0.08 0.54 -0.46 3.11 3.38 -0.22 -2.24 115.31 119.49 1up6 h LEU 20 Ca 0.28 -0.09 -0.07 0.00 0.09 0.00 0.00 57.88 58.08 1up6 h LEU 20 Cb 0.43 -0.14 -0.02 0.00 0.09 0.00 0.00 40.66 41.02 1up6 h LEU 20 CO -0.49 0.58 0.00 -0.07 0.09 0.00 0.00 178.44 178.56 1up6 h LEU 21 N 0.56 0.80 -0.93 1.67 3.38 0.17 -2.38 115.31 118.59 1up6 h LEU 21 Ca 0.12 -0.30 0.06 0.00 0.09 0.00 0.00 57.88 57.85 1up6 h LEU 21 Cb 0.29 -0.22 -0.06 0.00 0.09 0.00 0.00 40.66 40.76 1up6 h LEU 21 CO 0.01 0.91 0.59 0.44 0.09 0.00 0.00 178.44 180.48 1up6 h ASP 22 N 0.67 0.94 1.54 -0.43 3.32 -0.11 -2.29 116.42 120.05 1up6 h ASP 22 Ca 0.13 0.01 0.00 0.00 0.02 0.00 0.00 57.03 57.19 1up6 h ASP 22 Cb 0.50 -0.19 0.00 0.00 0.22 0.00 0.00 39.33 39.86 1up6 h ASP 22 CO 0.02 0.60 0.00 0.16 -1.72 0.00 0.00 179.24 178.31 1up6 h ILE 23 N 1.08 0.00 0.00 0.35 3.07 -1.39 -3.33 117.51 117.29 1up6 h ILE 23 Ca 0.40 -0.54 0.00 0.00 1.55 0.00 0.00 64.86 66.27 1up6 h ILE 23 Cb 0.16 1.54 0.00 0.00 -0.27 0.00 0.00 36.82 38.25 1up6 h ILE 23 CO -0.17 0.00 0.00 -1.54 -1.05 0.00 0.00 178.15 175.39 1up6 n SER 24 N -2.37 0.01 0.07 2.16 3.41 -0.86 -0.74 113.62 115.31 1up6 n SER 24 Ca 0.05 0.50 -0.21 0.00 -0.26 0.00 0.00 58.87 58.96 1up6 n SER 24 Cb 0.44 -0.51 -0.12 0.00 -0.26 0.00 0.00 64.21 63.77 1up6 n SER 24 CO 0.00 0.00 0.00 -0.33 -0.16 0.00 0.00 175.04 174.55 1up6 h GLU 25 N 0.00 0.65 0.00 4.33 3.07 -1.71 -3.38 114.58 117.54 1up6 h GLU 25 Ca 0.00 -0.78 -0.06 0.00 -0.50 0.00 0.00 59.36 58.02 1up6 h GLU 25 Cb 0.11 0.24 -0.01 0.00 -0.84 0.00 0.00 28.75 28.25 1up6 h GLU 25 CO 0.00 1.35 -1.36 -0.25 -1.40 0.00 0.00 179.01 177.35 1up6 n ASP 26 N -3.81 0.66 -4.01 1.42 8.00 0.08 -4.94 116.55 113.96 1up6 n ASP 26 Ca -0.12 0.27 -0.12 0.00 0.71 0.00 0.00 54.79 55.52 1up6 n ASP 26 Cb 0.94 0.68 -0.12 0.00 -0.02 0.00 0.00 41.12 42.60 1up6 n ASP 26 CO 0.00 0.00 0.00 0.68 -0.39 0.00 0.00 177.20 177.49 1up6 s VAL 27 N -3.24 0.38 -0.10 2.53 -7.23 -0.60 -5.03 120.40 107.11 1up6 s VAL 27 Ca -0.03 -0.81 -0.30 0.00 -1.81 0.00 0.00 61.98 59.03 1up6 s VAL 27 Cb 0.10 -0.44 -0.03 0.00 0.56 0.00 0.00 36.38 36.57 1up6 s VAL 27 CO 0.82 -0.30 1.30 -0.60 -0.31 0.00 0.00 175.10 176.02 1up6 s ARG 28 N -1.19 4.27 -0.17 4.82 3.52 -1.26 -4.28 118.95 124.66 1up6 s ARG 28 Ca -0.09 1.76 0.00 0.00 -0.13 0.00 0.00 55.73 57.28 1up6 s ARG 28 Cb -0.08 -3.69 0.04 0.00 -1.56 0.00 0.00 34.95 29.65 1up6 s ARG 28 CO -0.00 -0.62 -0.10 0.42 -0.81 0.00 0.00 175.30 174.19 1up6 s ILE 29 N 3.00 1.46 -0.10 4.11 1.01 -1.26 -4.97 121.20 124.45 1up6 s ILE 29 Ca 0.58 -0.78 0.05 0.00 0.00 0.00 0.00 60.65 60.51 1up6 s ILE 29 Cb -0.25 -1.51 -0.24 0.00 0.01 0.00 0.00 42.46 40.47 1up6 s ILE 29 CO 0.20 0.24 0.43 0.47 0.00 0.00 0.00 174.94 176.29 1up6 n ASP 30 N 4.77 1.32 -3.71 3.58 8.00 -1.26 -4.73 116.55 124.51 1up6 n ASP 30 Ca -0.14 0.26 -0.13 0.00 0.71 0.00 0.00 54.79 55.48 1up6 n ASP 30 Cb 0.48 -0.27 -0.09 0.00 -0.02 0.00 0.00 41.12 41.22 1up6 n ASP 30 CO 0.00 0.00 0.00 -1.83 -0.39 0.00 0.00 177.20 174.98 1up6 s GLU 31 N -2.57 0.57 -0.17 -1.24 -1.05 -1.26 -1.31 118.70 111.67 1up6 s GLU 31 Ca -0.14 0.54 -0.02 0.00 -0.15 0.00 0.00 54.97 55.20 1up6 s GLU 31 Cb 0.07 0.27 -0.01 0.00 -0.44 0.00 0.00 34.13 34.03 1up6 s GLU 31 CO 0.79 -0.09 -0.09 0.08 0.95 0.00 0.00 175.26 176.90 1up6 s VAL 32 N 0.02 3.15 -0.08 1.83 1.01 -0.17 -1.31 120.40 124.85 1up6 s VAL 32 Ca -0.02 -0.60 0.04 0.00 0.00 0.00 0.00 61.98 61.40 1up6 s VAL 32 Cb -0.03 -2.38 -0.01 0.00 0.00 0.00 0.00 36.38 33.96 1up6 s VAL 32 CO 0.01 0.48 -0.19 -0.51 0.00 0.00 0.00 175.10 174.89 1up6 s ILE 33 N 0.92 2.53 -0.09 2.22 2.07 -0.46 -0.77 121.20 127.62 1up6 s ILE 33 Ca -0.02 -0.88 0.01 0.00 -1.41 0.00 0.00 60.65 58.36 1up6 s ILE 33 Cb -0.15 -1.99 -0.02 0.00 0.13 0.00 0.00 42.46 40.43 1up6 s ILE 33 CO -0.00 0.56 -0.12 -0.36 -1.91 0.00 0.00 174.94 173.11 1up6 s PHE 34 N -0.05 2.79 0.04 3.50 0.08 0.17 -1.14 117.98 123.37 1up6 s PHE 34 Ca -0.05 -0.33 0.05 0.00 0.12 0.00 0.00 56.93 56.73 1up6 s PHE 34 Cb -0.14 -1.74 -0.02 0.00 -0.57 0.00 0.00 43.02 40.54 1up6 s PHE 34 CO 0.04 0.04 -0.16 -0.47 -0.10 0.00 0.00 175.22 174.58 1up6 s TYR 35 N -0.26 1.37 -0.18 0.36 5.04 -0.38 -0.80 117.35 122.49 1up6 s TYR 35 Ca 0.02 -0.36 -0.26 0.00 -2.44 0.00 0.00 57.07 54.03 1up6 s TYR 35 Cb -0.13 -0.82 0.07 0.00 0.35 0.00 0.00 41.96 41.43 1up6 s TYR 35 CO 0.03 0.05 0.67 0.34 -1.34 0.00 0.00 175.55 175.30 1up6 s ASP 36 N -1.15 -0.68 0.29 4.32 -1.08 -1.26 -0.29 116.67 116.83 1up6 s ASP 36 Ca 0.03 1.11 0.25 0.00 -0.52 0.00 0.00 52.55 53.42 1up6 s ASP 36 Cb -0.08 1.07 1.03 0.00 -1.46 0.00 0.00 42.92 43.48 1up6 s ASP 36 CO 0.01 -0.37 1.74 0.16 0.52 0.00 0.00 175.17 177.24 1up6 h ILE 37 N 3.69 0.00 -3.57 4.11 3.07 -1.98 -3.38 117.51 119.46 1up6 h ILE 37 Ca -0.28 -0.26 -0.71 0.00 1.55 0.00 0.00 64.86 65.16 1up6 h ILE 37 Cb 1.16 1.02 -0.34 0.00 -0.27 0.00 0.00 36.82 38.39 1up6 h ILE 37 CO 0.19 0.00 -0.31 -0.62 -1.05 0.00 0.00 178.15 176.36 1up6 s ASP 38 N -4.41 5.46 0.24 2.16 -1.08 -1.26 -4.97 116.67 112.81 1up6 s ASP 38 Ca 0.04 -2.78 -0.06 0.00 -0.52 0.00 0.00 52.55 49.23 1up6 s ASP 38 Cb 0.09 -1.91 0.35 0.00 -1.46 0.00 0.00 42.92 39.99 1up6 s ASP 38 CO 0.41 -0.41 1.82 -0.08 0.52 0.00 0.00 175.17 177.43 1up6 h GLU 39 N 7.20 0.80 -0.16 4.34 4.81 -2.00 -2.72 114.58 126.85 1up6 h GLU 39 Ca -0.01 -0.05 -0.18 0.00 -0.13 0.00 0.00 59.36 58.99 1up6 h GLU 39 Cb 0.97 -0.18 0.01 0.00 0.63 0.00 0.00 28.75 30.18 1up6 h GLU 39 CO 0.72 0.53 -0.61 0.93 -0.73 0.00 0.00 179.01 179.86 1up6 h GLU 40 N 0.83 0.70 -0.14 1.92 5.08 -1.96 -1.36 114.58 119.64 1up6 h GLU 40 Ca 0.37 -0.53 -0.01 0.00 -1.00 0.00 0.00 59.36 58.18 1up6 h GLU 40 Cb 0.27 0.10 -0.01 0.00 0.50 0.00 0.00 28.75 29.61 1up6 h GLU 40 CO -0.21 1.15 0.04 -0.22 -1.00 0.00 0.00 179.01 178.77 1up6 h LYS 41 N 0.39 0.23 -0.84 2.33 3.64 -1.95 -2.91 116.57 117.47 1up6 h LYS 41 Ca -0.03 -0.05 0.02 0.00 -1.27 0.00 0.00 60.65 59.32 1up6 h LYS 41 Cb 1.24 -0.03 -0.04 0.00 -0.41 0.00 0.00 32.23 32.98 1up6 h LYS 41 CO 0.13 0.38 0.55 0.37 -2.27 0.00 0.00 179.45 178.61 1up6 h GLN 42 N 0.03 1.06 -0.88 1.90 4.15 -1.46 -2.43 115.11 117.49 1up6 h GLN 42 Ca 0.04 -0.06 0.07 0.00 0.77 0.00 0.00 58.65 59.47 1up6 h GLN 42 Cb 0.25 -0.24 -0.06 0.00 0.21 0.00 0.00 27.48 27.64 1up6 h GLN 42 CO 0.00 0.70 0.54 -0.22 -1.93 0.00 0.00 178.83 177.93 1up6 h LYS 43 N 1.10 0.95 0.66 1.69 1.63 -1.06 0.12 116.57 121.65 1up6 h LYS 43 Ca 0.32 -0.06 -0.03 0.00 -0.85 0.00 0.00 60.65 60.03 1up6 h LYS 43 Cb -0.06 -0.21 0.01 0.00 -0.60 0.00 0.00 32.23 31.36 1up6 h LYS 43 CO -0.08 0.63 -0.32 0.82 -3.45 0.00 0.00 179.45 177.05 1up6 h ILE 44 N 0.97 0.23 -0.65 2.00 2.04 -1.27 -2.28 117.51 118.55 1up6 h ILE 44 Ca 0.39 -0.25 0.12 0.00 1.00 0.00 0.00 64.86 66.12 1up6 h ILE 44 Cb 0.20 0.30 -0.09 0.00 -0.74 0.00 0.00 36.82 36.49 1up6 h ILE 44 CO -0.18 0.02 0.21 0.58 0.00 0.00 0.00 178.15 178.78 1up6 h VAL 45 N -1.07 0.67 -0.00 1.67 2.07 -1.21 -2.25 116.25 116.13 1up6 h VAL 45 Ca -0.09 -0.12 -0.14 0.00 0.82 0.00 0.00 66.70 67.17 1up6 h VAL 45 Cb 0.71 0.29 -0.02 0.00 -1.52 0.00 0.00 31.29 30.75 1up6 h VAL 45 CO 0.15 0.06 -0.67 0.58 0.02 0.00 0.00 177.57 177.71 1up6 h VAL 46 N 0.35 1.48 -0.66 2.57 2.07 -0.80 -1.02 116.25 120.25 1up6 h VAL 46 Ca 0.35 -2.30 -0.06 0.00 0.82 0.00 0.00 66.70 65.50 1up6 h VAL 46 Cb 0.50 2.24 -0.03 0.00 -1.52 0.00 0.00 31.29 32.49 1up6 h VAL 46 CO -0.38 0.66 0.15 0.44 0.02 0.00 0.00 177.57 178.46 1up6 h ASP 47 N 0.00 0.99 -0.69 0.57 5.19 -0.94 -0.73 116.42 120.81 1up6 h ASP 47 Ca -0.01 -0.20 -0.06 0.00 -0.62 0.00 0.00 57.03 56.14 1up6 h ASP 47 Cb 1.19 -0.26 -0.03 0.00 0.18 0.00 0.00 39.33 40.41 1up6 h ASP 47 CO 0.09 0.95 0.20 0.15 -3.12 0.00 0.00 179.24 177.51 1up6 h PHE 48 N 0.99 1.13 -0.15 4.55 3.57 -0.96 -3.08 116.94 123.00 1up6 h PHE 48 Ca 0.21 -0.12 -0.01 0.00 3.53 0.00 0.00 57.97 61.58 1up6 h PHE 48 Cb 0.36 -0.33 -0.01 0.00 2.79 0.00 0.00 35.95 38.76 1up6 h PHE 48 CO 0.03 0.90 0.05 0.28 -2.23 0.00 0.00 178.31 177.34 1up6 h VAL 49 N 1.05 1.18 -0.86 1.41 2.07 -0.70 -2.44 116.25 117.97 1up6 h VAL 49 Ca 0.23 -0.57 0.18 0.00 0.82 0.00 0.00 66.70 67.36 1up6 h VAL 49 Cb 0.32 1.28 -0.06 0.00 -1.52 0.00 0.00 31.29 31.31 1up6 h VAL 49 CO -0.00 0.17 0.57 0.11 0.02 0.00 0.00 177.57 178.44 1up6 h LYS 50 N 0.06 0.45 -0.10 1.57 1.57 -1.16 0.18 116.57 119.13 1up6 h LYS 50 Ca 0.05 -0.03 -0.15 0.00 -1.87 0.00 0.00 60.65 58.65 1up6 h LYS 50 Cb 0.23 -0.10 -0.01 0.00 0.08 0.00 0.00 32.23 32.43 1up6 h LYS 50 CO -0.00 0.29 -0.59 0.00 -0.57 0.00 0.00 179.45 178.59 1up6 h ARG 51 N 0.46 0.31 -0.03 3.15 3.08 -1.37 -2.06 114.38 117.93 1up6 h ARG 51 Ca 0.44 -0.21 -0.25 0.00 0.07 0.00 0.00 59.98 60.03 1up6 h ARG 51 Cb 1.01 0.03 0.02 0.00 0.08 0.00 0.00 29.97 31.10 1up6 h ARG 51 CO -0.17 0.81 -0.98 -0.07 -1.07 0.00 0.00 179.97 178.50 1up6 h LEU 52 N 0.24 0.86 -0.19 3.04 3.38 -0.62 -3.36 115.31 118.65 1up6 h LEU 52 Ca -0.00 -0.66 -0.15 0.00 0.09 0.00 0.00 57.88 57.15 1up6 h LEU 52 Cb 1.10 -0.26 0.00 0.00 0.09 0.00 0.00 40.66 41.59 1up6 h LEU 52 CO 0.10 1.46 -0.47 0.58 0.09 0.00 0.00 178.44 180.20 1up6 h VAL 53 N 0.40 1.32 -6.20 1.22 2.07 -0.67 -3.49 116.25 110.90 1up6 h VAL 53 Ca -0.11 -1.71 -0.43 0.00 0.82 0.00 0.00 66.70 65.28 1up6 h VAL 53 Cb 1.62 1.90 0.07 0.00 -1.52 0.00 0.00 31.29 33.36 1up6 h VAL 53 CO 0.19 0.53 -0.92 0.29 0.02 0.00 0.00 177.57 177.69 1up6 n LYS 54 N -4.18 -1.99 -0.25 1.57 5.02 -0.78 -2.46 118.16 115.09 1up6 n LYS 54 Ca -0.06 0.49 0.00 0.00 -2.02 0.00 0.00 58.31 56.72 1up6 n LYS 54 Cb 0.58 -4.40 0.00 0.00 -0.02 0.00 0.00 35.03 31.19 1up6 n LYS 54 CO 0.00 0.00 0.00 -0.25 -0.52 0.00 0.00 177.40 176.63 1up6 n ASP 55 N -2.79 0.00 -0.21 4.39 8.00 -1.26 -4.83 116.55 119.85 1up6 n ASP 55 Ca -0.15 0.00 0.19 0.00 0.71 0.00 0.00 54.79 55.54 1up6 n ASP 55 Cb 0.62 -1.54 0.53 0.00 -0.02 0.00 0.00 41.12 40.71 1up6 n ASP 55 CO 0.00 0.00 0.00 0.03 -0.39 0.00 0.00 177.20 176.84 1up6 h ARG 56 N 0.48 0.35 -3.97 -1.24 3.08 -1.89 -3.42 114.38 107.77 1up6 h ARG 56 Ca 0.00 -0.02 -0.12 0.00 0.07 0.00 0.00 59.98 59.91 1up6 h ARG 56 Cb 0.00 -0.08 -0.13 0.00 0.08 0.00 0.00 29.97 29.84 1up6 h ARG 56 CO 0.00 0.23 -0.36 -0.59 -1.07 0.00 0.00 179.97 178.18 1up6 s PHE 57 N -5.37 0.49 0.19 3.04 -0.12 -1.26 -4.97 117.98 109.98 1up6 s PHE 57 Ca -0.08 -0.85 -0.30 0.00 -0.05 0.00 0.00 56.93 55.66 1up6 s PHE 57 Cb 0.22 -0.12 -0.08 0.00 -0.63 0.00 0.00 43.02 42.41 1up6 s PHE 57 CO 0.78 -0.71 1.15 0.15 -0.05 0.00 0.00 175.22 176.54 1up6 s LYS 58 N -3.99 4.54 -0.20 1.99 1.02 -0.42 -4.91 119.74 117.76 1up6 s LYS 58 Ca 0.19 1.80 -0.04 0.00 0.02 0.00 0.00 55.97 57.95 1up6 s LYS 58 Cb 0.04 -3.25 -0.02 0.00 -0.52 0.00 0.00 37.83 34.08 1up6 s LYS 58 CO 0.01 -0.00 -0.03 0.08 -0.92 0.00 0.00 175.35 174.49 1up6 s VAL 59 N -0.21 3.63 0.11 3.17 1.01 -1.26 -1.00 120.40 125.85 1up6 s VAL 59 Ca 0.51 -0.42 0.07 0.00 0.00 0.00 0.00 61.98 62.14 1up6 s VAL 59 Cb -0.31 -2.64 -0.04 0.00 0.00 0.00 0.00 36.38 33.40 1up6 s VAL 59 CO 0.36 0.43 -0.17 -0.76 0.00 0.00 0.00 175.10 174.96 1up6 s LEU 60 N 1.16 2.34 -0.10 3.92 1.43 0.05 -5.00 118.68 122.48 1up6 s LEU 60 Ca 0.02 -0.73 0.01 0.00 -1.03 0.00 0.00 54.13 52.40 1up6 s LEU 60 Cb -0.15 -0.71 -0.02 0.00 0.03 0.00 0.00 46.19 45.34 1up6 s LEU 60 CO 0.00 -0.03 -0.11 -0.63 0.23 0.00 0.00 176.35 175.81 1up6 s ILE 61 N -1.55 3.33 -0.12 -0.59 1.01 -1.26 0.44 121.20 122.46 1up6 s ILE 61 Ca 0.07 -0.59 -0.03 0.00 0.00 0.00 0.00 60.65 60.10 1up6 s ILE 61 Cb -0.08 -2.38 -0.03 0.00 0.01 0.00 0.00 42.46 39.98 1up6 s ILE 61 CO 0.04 0.55 -0.01 -0.55 0.00 0.00 0.00 174.94 174.97 1up6 s SER 62 N -0.19 5.06 0.54 3.58 0.15 0.02 -4.87 113.70 117.99 1up6 s SER 62 Ca 0.01 0.03 0.32 0.00 0.70 0.00 0.00 55.95 57.01 1up6 s SER 62 Cb -0.13 -1.58 1.41 0.00 -1.71 0.00 0.00 66.02 64.00 1up6 s SER 62 CO 0.03 0.29 2.01 0.44 1.20 0.00 0.00 173.24 177.21 1up6 h ASP 63 N 5.83 0.00 -4.04 5.45 3.32 -1.97 -3.41 116.42 121.59 1up6 h ASP 63 Ca -0.43 0.00 -0.35 0.00 0.02 0.00 0.00 57.03 56.27 1up6 h ASP 63 Cb 1.19 0.00 -0.16 0.00 0.22 0.00 0.00 39.33 40.58 1up6 h ASP 63 CO 0.58 0.06 -0.73 0.42 -1.72 0.00 0.00 179.24 177.86 1up6 s THR 64 N -3.78 1.18 0.13 0.35 -4.23 -1.26 -4.96 115.64 103.07 1up6 s THR 64 Ca -0.00 -1.90 -0.18 0.00 -1.18 0.00 0.00 61.69 58.43 1up6 s THR 64 Cb 0.10 -1.68 -0.04 0.00 1.34 0.00 0.00 72.50 72.23 1up6 s THR 64 CO 0.55 -0.63 1.78 0.15 -0.54 0.00 0.00 174.62 175.93 1up6 h PHE 65 N 3.10 0.29 -0.35 3.99 3.04 -1.98 -2.88 116.94 122.14 1up6 h PHE 65 Ca -0.37 0.01 0.04 0.00 3.98 0.00 0.00 57.97 61.63 1up6 h PHE 65 Cb 1.19 -0.09 -0.04 0.00 2.56 0.00 0.00 35.95 39.57 1up6 h PHE 65 CO 0.65 0.17 0.11 1.49 -2.02 0.00 0.00 178.31 178.71 1up6 h GLU 66 N 0.32 0.25 -0.75 1.11 4.81 -1.97 -1.79 114.58 116.55 1up6 h GLU 66 Ca 0.10 -0.01 0.18 0.00 -0.13 0.00 0.00 59.36 59.50 1up6 h GLU 66 Cb -0.00 -0.06 -0.04 0.00 0.63 0.00 0.00 28.75 29.28 1up6 h GLU 66 CO -0.05 0.16 0.51 0.78 -0.73 0.00 0.00 179.01 179.69 1up6 h GLY 67 N 0.25 0.43 1.49 1.92 0.00 -1.96 0.32 103.07 105.52 1up6 h GLY 67 Ca 0.16 -0.10 -0.30 0.00 0.00 0.00 0.00 47.33 47.09 1up6 h GLY 67 CO -0.18 0.02 -1.34 0.00 0.00 0.00 0.00 176.54 175.05 1up6 h ALA 68 N 1.65 -0.01 0.00 3.60 0.00 -1.13 -3.36 119.26 120.01 1up6 h ALA 68 Ca 0.37 -0.87 0.00 0.00 0.00 0.00 0.00 54.91 54.40 1up6 h ALA 68 Cb 1.11 0.07 0.00 0.00 0.00 0.00 0.00 17.79 18.97 1up6 h ALA 68 CO -0.08 0.86 -1.17 1.33 0.00 0.00 0.00 179.25 180.19 1up6 n VAL 69 N -3.61 0.12 -0.19 0.00 0.24 -0.86 -4.46 118.33 109.58 1up6 n VAL 69 Ca -0.12 -0.25 -0.02 0.00 -2.04 0.00 0.00 64.34 61.91 1up6 n VAL 69 Cb 1.06 0.29 0.04 0.00 -1.47 0.00 0.00 33.84 33.76 1up6 n VAL 69 CO 0.00 0.00 0.00 1.62 -2.14 0.00 0.00 176.83 176.31 1up6 h VAL 70 N 0.00 0.36 -0.35 3.34 3.04 -1.09 -2.26 116.25 119.29 1up6 h VAL 70 Ca 0.00 0.00 -0.08 0.00 -1.01 0.00 0.00 66.70 65.61 1up6 h VAL 70 Cb 0.74 0.36 -0.05 0.00 -2.01 0.00 0.00 31.29 30.33 1up6 h VAL 70 CO 0.00 0.00 0.02 0.47 -1.01 0.00 0.00 177.57 177.05 1up6 n ASP 71 N -5.42 3.61 -4.81 3.17 8.00 -1.26 -3.71 116.55 116.13 1up6 n ASP 71 Ca 0.06 -3.25 -0.39 0.00 0.71 0.00 0.00 54.79 51.93 1up6 n ASP 71 Cb 0.32 -0.60 -0.06 0.00 -0.02 0.00 0.00 41.12 40.77 1up6 n ASP 71 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1up6 s ALA 72 N -2.97 3.57 -0.04 2.24 0.00 -0.85 -4.38 121.76 119.34 1up6 s ALA 72 Ca 0.44 0.07 0.06 0.00 0.00 0.00 0.00 51.96 52.53 1up6 s ALA 72 Cb 0.37 -2.67 -0.24 0.00 0.00 0.00 0.00 23.12 20.58 1up6 s ALA 72 CO 0.07 0.39 0.69 -0.22 0.00 0.00 0.00 175.76 176.69 1up6 h LYS 73 N 4.45 0.10 -5.66 0.00 3.64 -0.78 -3.39 116.57 114.94 1up6 h LYS 73 Ca -0.49 -0.16 -0.50 0.00 -1.27 0.00 0.00 60.65 58.22 1up6 h LYS 73 Cb 1.21 0.06 -0.25 0.00 -0.41 0.00 0.00 32.23 32.84 1up6 h LYS 73 CO 0.64 0.79 -0.81 0.71 -2.27 0.00 0.00 179.45 178.50 1up6 s TYR 74 N -2.60 1.48 -0.09 1.91 2.02 -1.21 -2.35 117.35 116.51 1up6 s TYR 74 Ca -0.08 -0.36 -0.00 0.00 -0.37 0.00 0.00 57.07 56.25 1up6 s TYR 74 Cb 0.08 -0.88 0.02 0.00 -0.40 0.00 0.00 41.96 40.78 1up6 s TYR 74 CO 0.82 0.06 -0.07 0.08 -1.57 0.00 0.00 175.55 174.87 1up6 s VAL 75 N -0.83 0.90 -0.28 0.71 1.01 -0.25 -0.80 120.40 120.86 1up6 s VAL 75 Ca 0.04 -0.23 -0.09 0.00 0.00 0.00 0.00 61.98 61.70 1up6 s VAL 75 Cb -0.08 -0.92 -0.02 0.00 0.00 0.00 0.00 36.38 35.35 1up6 s VAL 75 CO 0.02 0.34 0.12 -0.63 0.00 0.00 0.00 175.10 174.94 1up6 s ILE 76 N 1.56 4.58 -0.33 2.22 1.01 0.15 -0.50 121.20 129.89 1up6 s ILE 76 Ca 0.01 -0.20 -0.29 0.00 0.00 0.00 0.00 60.65 60.17 1up6 s ILE 76 Cb -0.13 -3.22 0.02 0.00 0.01 0.00 0.00 42.46 39.13 1up6 s ILE 76 CO -0.06 0.23 1.07 -0.36 0.00 0.00 0.00 174.94 175.82 1up6 s PHE 77 N 1.64 3.12 0.00 3.97 0.40 -0.51 -1.11 117.98 125.49 1up6 s PHE 77 Ca 0.06 1.15 0.00 0.00 -0.60 0.00 0.00 56.93 57.53 1up6 s PHE 77 Cb -0.16 -3.74 0.00 0.00 0.51 0.00 0.00 43.02 39.63 1up6 s PHE 77 CO 0.06 -0.80 0.56 0.94 0.70 0.00 0.00 175.22 176.67 1up6 n GLN 78 N 6.94 0.71 -2.62 0.44 7.27 0.03 -0.77 117.38 129.37 1up6 n GLN 78 Ca 0.12 -0.69 -0.25 0.00 0.07 0.00 0.00 57.00 56.25 1up6 n GLN 78 Cb 0.47 -0.67 0.02 0.00 2.41 0.00 0.00 30.24 32.48 1up6 n GLN 78 CO 0.00 0.00 0.00 -0.59 0.07 0.00 0.00 177.06 176.54 1up6 s PHE 79 N -0.26 3.25 -0.33 3.69 -0.12 -1.01 -4.74 117.98 118.46 1up6 s PHE 79 Ca 0.00 0.49 -0.00 0.00 -0.05 0.00 0.00 56.93 57.37 1up6 s PHE 79 Cb 0.00 -2.56 0.10 0.00 -0.63 0.00 0.00 43.02 39.93 1up6 s PHE 79 CO 0.00 -0.63 0.11 0.50 -0.05 0.00 0.00 175.22 175.16 1up6 s ARG 80 N -4.82 0.82 0.22 1.99 3.52 -1.26 -4.47 118.95 114.95 1up6 s ARG 80 Ca 0.52 -1.23 -0.32 0.00 -0.13 0.00 0.00 55.73 54.56 1up6 s ARG 80 Cb -0.10 -2.08 -0.12 0.00 -1.56 0.00 0.00 34.95 31.08 1up6 s ARG 80 CO 0.42 -1.01 1.67 -2.30 -0.81 0.00 0.00 175.30 173.27 1up6 n PRO 81 N 4.65 2.63 0.00 5.12 -0.02 -1.26 -1.28 135.00 144.84 1up6 n PRO 81 Ca -0.00 0.95 0.00 0.00 -2.02 0.00 0.00 63.50 62.43 1up6 n PRO 81 Cb 0.41 -2.76 0.00 0.00 -0.02 0.00 0.00 33.50 31.13 1up6 n PRO 81 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1up6 n GLY 82 N 3.51 2.93 7.00 -1.23 0.00 -1.26 -4.84 105.19 111.29 1up6 n GLY 82 Ca 0.15 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.17 1up6 n GLY 82 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1up6 n GLY 83 N -2.00 -1.55 0.24 -0.02 0.00 -0.41 -2.78 105.19 98.67 1up6 n GLY 83 Ca 0.00 -1.25 0.05 0.00 0.00 0.00 0.00 46.02 44.82 1up6 n GLY 83 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 1up6 h LEU 84 N 0.00 0.12 -1.23 0.99 3.38 -1.91 -1.38 115.31 115.29 1up6 h LEU 84 Ca 0.00 -0.02 -0.00 0.00 0.09 0.00 0.00 57.88 57.95 1up6 h LEU 84 Cb 0.00 -0.03 -0.04 0.00 0.09 0.00 0.00 40.66 40.68 1up6 h LEU 84 CO 0.00 0.24 0.45 0.50 0.09 0.00 0.00 178.44 179.71 1up6 h LYS 85 N 0.13 0.97 -0.55 1.13 3.64 -1.96 -0.06 116.57 119.87 1up6 h LYS 85 Ca 0.03 -0.08 0.00 0.00 -1.27 0.00 0.00 60.65 59.33 1up6 h LYS 85 Cb 0.25 -0.21 -0.03 0.00 -0.41 0.00 0.00 32.23 31.83 1up6 h LYS 85 CO 0.01 0.67 0.35 0.78 -2.27 0.00 0.00 179.45 178.99 1up6 h GLY 86 N 1.01 0.79 1.05 5.01 0.00 -1.08 -1.90 103.07 107.95 1up6 h GLY 86 Ca 0.26 -0.31 -0.08 0.00 0.00 0.00 0.00 47.33 47.20 1up6 h GLY 86 CO -0.05 0.31 0.07 -0.09 0.00 0.00 0.00 176.54 176.77 1up6 h ARG 87 N 0.74 1.03 -0.53 4.80 2.43 -1.16 -0.86 114.38 120.84 1up6 h ARG 87 Ca 0.20 -0.30 0.05 0.00 -0.81 0.00 0.00 59.98 59.13 1up6 h ARG 87 Cb -0.05 -0.11 -0.05 0.00 -0.42 0.00 0.00 29.97 29.34 1up6 h ARG 87 CO -0.04 0.98 0.26 1.49 -1.51 0.00 0.00 179.97 181.15 1up6 h GLU 88 N 0.94 0.49 -0.65 0.20 4.81 -0.83 -0.68 114.58 118.85 1up6 h GLU 88 Ca 0.18 -0.03 -0.06 0.00 -0.13 0.00 0.00 59.36 59.33 1up6 h GLU 88 Cb 0.47 -0.11 -0.03 0.00 0.63 0.00 0.00 28.75 29.71 1up6 h GLU 88 CO 0.02 0.32 0.19 -0.91 -0.73 0.00 0.00 179.01 177.90 1up6 h ASN 89 N 0.50 0.94 -0.38 1.04 2.35 -1.08 0.11 115.58 119.06 1up6 h ASN 89 Ca 0.24 -0.17 0.02 0.00 -0.55 0.00 0.00 56.30 55.84 1up6 h ASN 89 Cb 0.17 -0.25 -0.03 0.00 0.05 0.00 0.00 38.32 38.26 1up6 h ASN 89 CO -0.18 0.89 0.20 0.44 -1.65 0.00 0.00 177.43 177.14 1up6 h ASP 90 N 0.97 0.31 0.25 5.81 3.32 -0.56 -2.05 116.42 124.48 1up6 h ASP 90 Ca 0.21 0.01 -0.26 0.00 0.02 0.00 0.00 57.03 57.01 1up6 h ASP 90 Cb 0.30 -0.05 0.01 0.00 0.22 0.00 0.00 39.33 39.82 1up6 h ASP 90 CO -0.00 0.22 -1.09 -0.33 -1.72 0.00 0.00 179.24 176.31 1up6 h GLU 91 N 0.41 0.51 0.09 3.56 5.08 -0.85 -3.36 114.58 120.03 1up6 h GLU 91 Ca 0.16 -0.62 -0.25 0.00 -1.00 0.00 0.00 59.36 57.64 1up6 h GLU 91 Cb 0.05 0.19 -0.01 0.00 0.50 0.00 0.00 28.75 29.48 1up6 h GLU 91 CO -0.10 1.25 -1.31 0.78 -1.00 0.00 0.00 179.01 178.63 1up6 h GLY 92 N 0.85 0.23 0.57 -3.84 0.00 -0.78 -3.38 103.07 96.72 1up6 h GLY 92 Ca -0.13 -0.58 0.07 0.00 0.00 0.00 0.00 47.33 46.69 1up6 h GLY 92 CO 0.20 0.50 0.24 -2.22 0.00 0.00 0.00 176.54 175.27 1up6 h ILE 93 N -0.43 0.87 0.00 2.60 2.04 -1.57 -2.33 117.51 118.69 1up6 h ILE 93 Ca -0.29 -0.16 -0.01 0.00 1.00 0.00 0.00 64.86 65.41 1up6 h ILE 93 Cb 1.66 0.37 -0.00 0.00 -0.74 0.00 0.00 36.82 38.11 1up6 h ILE 93 CO 0.02 0.08 -0.03 -0.65 0.00 0.00 0.00 178.15 177.58 1up6 h PRO 94 N 0.46 0.00 -0.68 2.37 0.11 -1.77 -3.29 132.00 129.19 1up6 h PRO 94 Ca 0.26 0.00 -0.05 0.00 0.11 0.00 0.00 66.00 66.32 1up6 h PRO 94 Cb 0.24 0.00 -0.03 0.00 0.11 0.00 0.00 31.00 31.33 1up6 h PRO 94 CO -0.23 0.03 0.23 -0.07 -0.21 0.00 0.00 178.00 177.76 1up6 h LEU 95 N 0.00 0.97 -1.76 2.35 4.07 -1.52 -2.13 115.31 117.29 1up6 h LEU 95 Ca -0.00 -0.20 0.00 0.00 0.08 0.00 0.00 57.88 57.76 1up6 h LEU 95 Cb 0.16 -0.25 0.00 0.00 1.08 0.00 0.00 40.66 41.64 1up6 h LEU 95 CO 0.00 0.91 0.00 0.07 -1.08 0.00 0.00 178.44 178.34 1up6 h LYS 96 N 0.99 0.00 -0.09 1.13 2.10 -1.73 -1.03 116.57 117.93 1up6 h LYS 96 Ca 0.22 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.87 1up6 h LYS 96 Cb 0.27 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 31.60 1up6 h LYS 96 CO -0.01 0.00 0.00 0.66 -2.00 0.00 0.00 179.45 178.10 1up6 n TYR 97 N -2.69 0.10 -0.99 0.07 4.01 -0.85 -4.93 117.16 111.89 1up6 n TYR 97 Ca -0.01 -0.05 0.00 0.00 -0.16 0.00 0.00 57.90 57.68 1up6 n TYR 97 Cb 0.15 0.00 0.00 0.00 -0.31 0.00 0.00 39.34 39.18 1up6 n TYR 97 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 1up6 n GLY 98 N 1.23 0.39 3.76 2.72 0.00 -0.39 -5.03 105.19 107.87 1up6 n GLY 98 Ca 0.17 -1.07 -0.28 0.00 0.00 0.00 0.00 46.02 44.85 1up6 n GLY 98 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1up6 s LEU 99 N 0.00 3.70 0.10 0.99 1.02 -0.94 -5.03 118.68 118.51 1up6 s LEU 99 Ca 0.00 -0.13 -0.31 0.00 0.02 0.00 0.00 54.13 53.70 1up6 s LEU 99 Cb 0.00 -2.35 -0.11 0.00 0.02 0.00 0.00 46.19 43.75 1up6 s LEU 99 CO 0.00 0.11 1.84 -0.38 0.02 0.00 0.00 176.35 177.95 1up6 n ILE 100 N 0.02 0.41 -3.84 -0.59 2.08 -1.26 -3.85 119.36 112.34 1up6 n ILE 100 Ca -0.09 -0.07 -0.36 0.00 0.56 0.00 0.00 62.75 62.79 1up6 n ILE 100 Cb 0.53 -2.09 -0.13 0.00 -0.75 0.00 0.00 39.64 37.20 1up6 n ILE 100 CO 0.00 0.00 0.00 -0.83 0.56 0.00 0.00 176.55 176.28 1up6 s GLY 101 N 2.94 1.69 -0.10 7.39 0.00 -1.26 -4.38 107.32 113.59 1up6 s GLY 101 Ca 0.83 -1.21 -0.25 0.00 0.00 0.00 0.00 44.72 44.10 1up6 s GLY 101 CO 0.39 0.50 0.58 1.62 0.00 0.00 0.00 173.10 176.19 1up6 s GLN 102 N 1.52 0.87 0.25 2.90 -0.44 -1.26 -4.75 119.66 118.75 1up6 s GLN 102 Ca 0.05 0.34 -0.03 0.00 -2.50 0.00 0.00 55.36 53.22 1up6 s GLN 102 Cb -0.15 0.41 0.46 0.00 -1.64 0.00 0.00 33.01 32.09 1up6 s GLN 102 CO -0.00 -0.22 1.76 1.49 0.50 0.00 0.00 175.29 178.81 1up6 h GLU 103 N 3.84 0.56 0.00 1.67 4.81 -1.89 -3.25 114.58 120.33 1up6 h GLU 103 Ca -0.28 -0.03 0.00 0.00 -0.13 0.00 0.00 59.36 58.92 1up6 h GLU 103 Cb 1.16 -0.13 0.00 0.00 0.63 0.00 0.00 28.75 30.41 1up6 h GLU 103 CO 0.31 0.37 -0.79 0.25 -0.73 0.00 0.00 179.01 178.42 1up6 n THR 104 N -4.90 0.00 -4.72 0.32 -2.24 -1.26 -3.67 114.28 97.81 1up6 n THR 104 Ca 0.15 -0.24 -0.33 0.00 -2.27 0.00 0.00 64.05 61.35 1up6 n THR 104 Cb 0.38 0.66 -0.14 0.00 -2.10 0.00 0.00 70.33 69.13 1up6 n THR 104 CO 0.00 0.00 0.00 -0.89 -0.57 0.00 0.00 175.07 173.61 1up6 s THR 105 N -1.98 3.20 0.00 4.28 2.01 -1.23 -4.11 115.64 117.80 1up6 s THR 105 Ca -0.00 -0.61 0.00 0.00 0.31 0.00 0.00 61.69 61.39 1up6 s THR 105 Cb 0.04 -2.35 0.00 0.00 0.01 0.00 0.00 72.50 70.20 1up6 s THR 105 CO 0.23 0.52 0.00 0.61 -0.69 0.00 0.00 174.62 175.29 1up6 n GLY 106 N 3.45 0.55 0.37 4.40 0.00 -1.26 -4.06 105.19 108.63 1up6 n GLY 106 Ca -0.18 -0.86 0.06 0.00 0.00 0.00 0.00 46.02 45.03 1up6 n GLY 106 CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 1up6 h VAL 107 N 0.00 0.98 -0.59 1.61 2.07 -1.80 -1.11 116.25 117.41 1up6 h VAL 107 Ca 0.00 -0.36 -0.02 0.00 0.82 0.00 0.00 66.70 67.14 1up6 h VAL 107 Cb 0.00 -0.15 -0.03 0.00 -1.52 0.00 0.00 31.29 29.59 1up6 h VAL 107 CO 0.00 0.19 0.27 1.23 0.02 0.00 0.00 177.57 179.28 1up6 h GLY 108 N 1.05 0.89 2.00 2.17 0.00 -1.70 -1.46 103.07 106.01 1up6 h GLY 108 Ca 0.47 -0.42 -0.10 0.00 0.00 0.00 0.00 47.33 47.28 1up6 h GLY 108 CO -0.22 0.40 -0.48 -1.33 0.00 0.00 0.00 176.54 174.91 1up6 h GLY 109 N 0.93 0.00 0.61 4.60 0.00 -1.26 -1.67 103.07 106.26 1up6 h GLY 109 Ca 0.20 0.00 -0.00 0.00 0.00 0.00 0.00 47.33 47.53 1up6 h GLY 109 CO -0.03 0.00 -0.01 -2.75 0.00 0.00 0.00 176.54 173.75 1up6 h PHE 110 N 0.00 -0.03 -0.25 5.60 3.57 -0.51 -0.78 116.94 124.54 1up6 h PHE 110 Ca -0.00 -0.00 -0.15 0.00 3.53 0.00 0.00 57.97 61.35 1up6 h PHE 110 Cb 0.85 0.01 -0.01 0.00 2.79 0.00 0.00 35.95 39.60 1up6 h PHE 110 CO 0.00 0.36 -0.46 0.66 -2.23 0.00 0.00 178.31 176.65 1up6 h SER 111 N -0.43 0.69 -0.86 0.41 4.64 -1.31 -2.36 113.55 114.34 1up6 h SER 111 Ca -0.00 -0.33 0.05 0.00 -0.47 0.00 0.00 61.79 61.03 1up6 h SER 111 Cb 0.40 -0.20 -0.06 0.00 -0.31 0.00 0.00 62.40 62.24 1up6 h SER 111 CO 0.01 1.05 0.55 0.00 -0.87 0.00 0.00 176.83 177.56 1up6 h ALA 112 N 0.98 1.17 -0.50 5.18 0.00 -1.31 -2.34 119.26 122.44 1up6 h ALA 112 Ca 0.03 -0.02 -0.01 0.00 0.00 0.00 0.00 54.91 54.91 1up6 h ALA 112 Cb 0.99 -0.26 -0.02 0.00 0.00 0.00 0.00 17.79 18.50 1up6 h ALA 112 CO 0.09 0.33 0.28 0.00 0.00 0.00 0.00 179.25 179.96 1up6 h ALA 113 N 1.39 0.64 -0.82 0.00 0.00 -0.89 -1.75 119.26 117.83 1up6 h ALA 113 Ca 0.36 -0.08 -0.01 0.00 0.00 0.00 0.00 54.91 55.18 1up6 h ALA 113 Cb 0.10 -0.20 -0.04 0.00 0.00 0.00 0.00 17.79 17.66 1up6 h ALA 113 CO -0.15 0.15 0.45 -0.07 0.00 0.00 0.00 179.25 179.63 1up6 h LEU 114 N 0.66 1.01 -0.73 0.00 3.38 -1.18 -1.05 115.31 117.40 1up6 h LEU 114 Ca 0.18 -0.08 -0.11 0.00 0.09 0.00 0.00 57.88 57.96 1up6 h LEU 114 Cb 0.03 -0.26 -0.02 0.00 0.09 0.00 0.00 40.66 40.51 1up6 h LEU 114 CO -0.03 0.80 -0.18 0.03 0.09 0.00 0.00 178.44 179.15 1up6 h ARG 115 N 1.14 0.77 0.06 1.13 3.08 -1.28 -3.30 114.38 115.98 1up6 h ARG 115 Ca 0.29 -0.29 -0.25 0.00 0.07 0.00 0.00 59.98 59.79 1up6 h ARG 115 Cb 0.01 -0.05 0.01 0.00 0.08 0.00 0.00 29.97 30.03 1up6 h ARG 115 CO -0.05 0.90 -1.09 0.00 -1.07 0.00 0.00 179.97 178.67 1up6 h ALA 116 N 1.11 0.22 -0.48 0.04 0.00 -0.41 -3.38 119.26 116.37 1up6 h ALA 116 Ca 0.10 -0.77 0.09 0.00 0.00 0.00 0.00 54.91 54.33 1up6 h ALA 116 Cb 0.68 0.01 -0.08 0.00 0.00 0.00 0.00 17.79 18.41 1up6 h ALA 116 CO 0.05 0.85 -0.01 0.74 0.00 0.00 0.00 179.25 180.87 1up6 h PHE 117 N 0.19 -0.05 -0.77 0.00 0.04 -1.30 -1.54 116.94 113.50 1up6 h PHE 117 Ca -0.11 0.04 -0.04 0.00 2.80 0.00 0.00 57.97 60.65 1up6 h PHE 117 Cb 1.76 0.10 -0.03 0.00 2.20 0.00 0.00 35.95 39.97 1up6 h PHE 117 CO 0.07 -0.12 0.33 -1.35 -0.60 0.00 0.00 178.31 176.65 1up6 h PRO 118 N 0.10 1.13 -0.20 1.51 0.11 -1.76 -0.97 132.00 131.92 1up6 h PRO 118 Ca 0.24 -0.19 -0.08 0.00 0.11 0.00 0.00 66.00 66.08 1up6 h PRO 118 Cb 0.36 -0.19 -0.00 0.00 0.11 0.00 0.00 31.00 31.27 1up6 h PRO 118 CO -0.41 0.90 -0.18 0.82 -0.21 0.00 0.00 178.00 178.92 1up6 h ILE 119 N 1.11 1.32 -0.02 4.15 2.04 -1.61 -2.45 117.51 122.06 1up6 h ILE 119 Ca 0.26 -1.32 -0.14 0.00 1.00 0.00 0.00 64.86 64.66 1up6 h ILE 119 Cb 0.17 1.73 -0.02 0.00 -0.74 0.00 0.00 36.82 37.97 1up6 h ILE 119 CO -0.03 0.40 -0.64 -0.37 0.00 0.00 0.00 178.15 177.51 1up6 h VAL 120 N 0.16 1.44 -0.11 1.67 -1.51 -1.20 -0.80 116.25 115.91 1up6 h VAL 120 Ca 0.04 -2.16 0.03 0.00 -1.23 0.00 0.00 66.70 63.37 1up6 h VAL 120 Cb 0.72 2.15 -0.03 0.00 -2.13 0.00 0.00 31.29 32.00 1up6 h VAL 120 CO 0.05 0.62 -0.07 -0.08 -1.23 0.00 0.00 177.57 176.86 1up6 h GLU 121 N 0.05 -0.07 -0.36 5.19 4.81 -1.14 0.52 114.58 123.57 1up6 h GLU 121 Ca -0.01 0.00 0.06 0.00 -0.13 0.00 0.00 59.36 59.28 1up6 h GLU 121 Cb 1.14 0.02 -0.05 0.00 0.63 0.00 0.00 28.75 30.49 1up6 h GLU 121 CO 0.09 -0.04 0.05 1.49 -0.73 0.00 0.00 179.01 179.87 1up6 h GLU 122 N -0.07 0.16 -0.20 1.92 4.81 -1.17 -2.07 114.58 117.95 1up6 h GLU 122 Ca 0.07 -0.01 -0.04 0.00 -0.13 0.00 0.00 59.36 59.25 1up6 h GLU 122 Cb 0.17 -0.04 -0.01 0.00 0.63 0.00 0.00 28.75 29.50 1up6 h GLU 122 CO -0.15 0.11 -0.03 1.88 -0.73 0.00 0.00 179.01 180.09 1up6 h TYR 123 N 0.17 0.42 -0.83 0.92 0.05 -0.71 -1.42 116.97 115.57 1up6 h TYR 123 Ca 0.17 -0.08 -0.02 0.00 0.05 0.00 0.00 58.73 58.85 1up6 h TYR 123 Cb 0.21 -0.11 -0.04 0.00 1.01 0.00 0.00 36.73 37.81 1up6 h TYR 123 CO -0.20 0.60 0.43 0.28 -1.05 0.00 0.00 178.16 178.22 1up6 h VAL 124 N 0.12 1.25 -0.65 -2.88 2.07 -0.94 -1.34 116.25 113.88 1up6 h VAL 124 Ca 0.05 -0.66 0.04 0.00 0.82 0.00 0.00 66.70 66.96 1up6 h VAL 124 Cb 0.45 0.15 -0.05 0.00 -1.52 0.00 0.00 31.29 30.33 1up6 h VAL 124 CO 0.02 0.29 0.39 -0.78 0.02 0.00 0.00 177.57 177.50 1up6 h ASP 125 N 1.17 0.62 -0.33 0.57 3.58 -1.00 -1.61 116.42 119.42 1up6 h ASP 125 Ca 0.29 0.01 -0.12 0.00 0.42 0.00 0.00 57.03 57.63 1up6 h ASP 125 Cb 0.07 -0.12 -0.01 0.00 1.72 0.00 0.00 39.33 40.99 1up6 h ASP 125 CO -0.04 0.42 -0.25 0.74 -2.88 0.00 0.00 179.24 177.23 1up6 h THR 126 N 0.75 1.29 -0.59 2.25 2.02 -0.96 -2.21 112.91 115.46 1up6 h THR 126 Ca 0.27 -1.40 0.01 0.00 0.77 0.00 0.00 66.41 66.06 1up6 h THR 126 Cb 0.07 1.46 -0.03 0.00 -1.74 0.00 0.00 68.15 67.91 1up6 h THR 126 CO -0.13 0.46 0.38 0.58 0.37 0.00 0.00 175.52 177.18 1up6 h VAL 127 N 0.53 1.13 0.00 3.16 2.07 -1.14 -2.63 116.25 119.37 1up6 h VAL 127 Ca 0.06 -0.27 -0.04 0.00 0.82 0.00 0.00 66.70 67.28 1up6 h VAL 127 Cb 0.81 0.29 -0.01 0.00 -1.52 0.00 0.00 31.29 30.87 1up6 h VAL 127 CO 0.07 0.14 -0.17 -0.09 0.02 0.00 0.00 177.57 177.54 1up6 h ARG 128 N 0.78 0.00 -0.01 1.57 2.43 -1.22 0.11 114.38 118.03 1up6 h ARG 128 Ca 0.22 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.39 1up6 h ARG 128 Cb -0.06 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 29.49 1up6 h ARG 128 CO -0.06 0.17 -0.05 1.63 -1.51 0.00 0.00 179.97 180.15 1up6 n LYS 129 N -3.26 1.50 0.00 0.20 5.02 -0.84 -4.65 118.16 116.14 1up6 n LYS 129 Ca 0.01 -0.87 0.00 0.00 -2.02 0.00 0.00 58.31 55.43 1up6 n LYS 129 Cb 0.45 -1.48 0.00 0.00 -0.02 0.00 0.00 35.03 33.98 1up6 n LYS 129 CO 0.00 0.00 0.00 0.25 -0.52 0.00 0.00 177.40 177.13 1up6 n THR 130 N 0.01 0.00 0.15 -0.18 -2.24 -0.87 -4.98 114.28 106.17 1up6 n THR 130 Ca 0.18 0.00 0.04 0.00 -2.27 0.00 0.00 64.05 61.99 1up6 n THR 130 Cb 0.35 0.00 0.12 0.00 -2.10 0.00 0.00 70.33 68.70 1up6 n THR 130 CO 0.00 0.00 0.00 0.77 -0.57 0.00 0.00 175.07 175.27 1up6 h SER 131 N 0.00 0.00 -5.59 3.42 4.64 -1.56 -3.47 113.55 110.98 1up6 h SER 131 Ca 0.00 0.00 -0.42 0.00 -0.47 0.00 0.00 61.79 60.90 1up6 h SER 131 Cb 0.00 0.00 0.05 0.00 -0.31 0.00 0.00 62.40 62.14 1up6 h SER 131 CO 0.00 0.46 -0.67 0.59 -0.87 0.00 0.00 176.83 176.34 1up6 n ASN 132 N -3.30 -5.67 -4.67 4.97 3.02 0.33 -4.96 115.26 104.98 1up6 n ASN 132 Ca 0.01 -0.53 -0.30 0.00 -0.03 0.00 0.00 54.58 53.74 1up6 n ASN 132 Cb 0.67 -4.52 0.16 0.00 -0.61 0.00 0.00 39.78 35.48 1up6 n ASN 132 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1up6 s ALA 133 N -3.24 1.22 -0.07 5.41 0.00 -1.26 -5.00 121.76 118.81 1up6 s ALA 133 Ca 0.52 0.09 -0.30 0.00 0.00 0.00 0.00 51.96 52.27 1up6 s ALA 133 Cb -0.24 -3.26 -0.03 0.00 0.00 0.00 0.00 23.12 19.59 1up6 s ALA 133 CO 0.65 -2.66 1.19 0.99 0.00 0.00 0.00 175.76 175.93 1up6 s THR 134 N -2.79 4.29 -0.22 0.00 2.01 -0.99 -4.87 115.64 113.08 1up6 s THR 134 Ca 0.65 1.61 -0.14 0.00 0.31 0.00 0.00 61.69 64.12 1up6 s THR 134 Cb -0.20 -4.03 -0.04 0.00 0.01 0.00 0.00 72.50 68.23 1up6 s THR 134 CO 0.58 -0.02 0.31 -0.63 -0.69 0.00 0.00 174.62 174.18 1up6 s ILE 135 N 2.35 5.25 -0.31 1.82 1.01 0.39 -1.09 121.20 130.62 1up6 s ILE 135 Ca 0.55 0.51 -0.10 0.00 0.00 0.00 0.00 60.65 61.62 1up6 s ILE 135 Cb -0.24 -3.65 -0.01 0.00 0.01 0.00 0.00 42.46 38.58 1up6 s ILE 135 CO 0.21 0.28 0.16 -0.69 0.00 0.00 0.00 174.94 174.89 1up6 s VAL 136 N 1.28 4.63 -0.19 2.92 1.01 0.34 -0.51 120.40 129.90 1up6 s VAL 136 Ca 0.15 -0.43 -0.08 0.00 0.00 0.00 0.00 61.98 61.63 1up6 s VAL 136 Cb -0.14 -3.37 -0.04 0.00 0.00 0.00 0.00 36.38 32.82 1up6 s VAL 136 CO 0.07 0.05 0.07 0.21 0.00 0.00 0.00 175.10 175.50 1up6 s ASN 137 N 1.62 5.67 -0.05 3.32 2.47 -0.03 -1.42 114.94 126.51 1up6 s ASN 137 Ca 0.05 0.09 0.06 0.00 0.42 0.00 0.00 52.86 53.48 1up6 s ASN 137 Cb -0.17 -1.98 -0.09 0.00 -1.45 0.00 0.00 41.25 37.56 1up6 s ASN 137 CO 0.06 0.17 0.06 0.49 -3.72 0.00 0.00 177.10 174.16 1up6 n PHE 138 N 3.57 0.00 -1.52 0.43 3.72 0.05 -0.00 117.46 123.71 1up6 n PHE 138 Ca -0.16 0.00 -0.55 0.00 -0.05 0.00 0.00 57.45 56.68 1up6 n PHE 138 Cb 0.52 -0.29 -0.07 0.00 -0.94 0.00 0.00 39.48 38.70 1up6 n PHE 138 CO 0.00 0.00 0.00 2.41 -0.05 0.00 0.00 176.76 179.12 1up6 n THR 139 N -2.12 0.24 -3.51 4.37 -1.04 -1.14 -4.68 114.28 106.40 1up6 n THR 139 Ca -0.08 -0.06 -0.33 0.00 -2.04 0.00 0.00 64.05 61.54 1up6 n THR 139 Cb 0.58 -0.29 -0.05 0.00 -1.82 0.00 0.00 70.33 68.75 1up6 n THR 139 CO 0.00 0.00 0.00 0.20 -0.64 0.00 0.00 175.07 174.63 1up6 s ASN 140 N 0.05 6.62 -0.19 8.00 0.01 -1.26 -2.92 114.94 125.24 1up6 s ASN 140 Ca 0.86 0.83 -0.25 0.00 -0.71 0.00 0.00 52.86 53.59 1up6 s ASN 140 Cb -1.12 -2.19 -0.01 0.00 0.41 0.00 0.00 41.25 38.33 1up6 s ASN 140 CO 0.54 0.04 0.82 -2.16 -1.51 0.00 0.00 177.10 174.82 1up6 s PRO 141 N -2.45 4.26 0.12 -0.60 0.05 -1.26 -4.74 135.00 130.37 1up6 s PRO 141 Ca 0.41 0.97 -0.15 0.00 0.05 0.00 0.00 61.00 62.29 1up6 s PRO 141 Cb -0.13 -3.59 -0.04 0.00 0.05 0.00 0.00 34.50 30.79 1up6 s PRO 141 CO 0.21 -0.37 1.52 1.03 0.05 0.00 0.00 177.00 179.45 1up6 h SER 142 N 7.43 0.71 -0.32 6.66 0.87 -1.80 -0.89 113.55 126.19 1up6 h SER 142 Ca -0.28 -0.36 -0.08 0.00 -1.23 0.00 0.00 61.79 59.84 1up6 h SER 142 Cb 1.12 -0.19 -0.01 0.00 -0.44 0.00 0.00 62.40 62.88 1up6 h SER 142 CO 0.84 0.90 -0.12 1.23 -0.53 0.00 0.00 176.83 179.15 1up6 h GLY 143 N 0.50 0.70 1.00 5.77 0.00 -1.88 -1.47 103.07 107.69 1up6 h GLY 143 Ca 0.09 -0.61 -0.00 0.00 0.00 0.00 0.00 47.33 46.82 1up6 h GLY 143 CO 0.03 0.55 0.38 0.84 0.00 0.00 0.00 176.54 178.35 1up6 h HIS 144 N 0.42 0.79 -0.38 5.60 6.17 -1.92 -1.02 115.15 124.82 1up6 h HIS 144 Ca 0.08 0.00 -0.00 0.00 0.71 0.00 0.00 60.37 61.16 1up6 h HIS 144 Cb 0.63 -0.26 -0.02 0.00 2.52 0.00 0.00 27.41 30.28 1up6 h HIS 144 CO 0.06 0.53 0.22 0.82 0.71 0.00 0.00 177.93 180.26 1up6 h ILE 145 N 0.82 1.14 -0.43 6.26 2.04 -1.08 -1.53 117.51 124.74 1up6 h ILE 145 Ca 0.22 -0.33 0.04 0.00 1.00 0.00 0.00 64.86 65.78 1up6 h ILE 145 Cb -0.04 0.67 -0.04 0.00 -0.74 0.00 0.00 36.82 36.67 1up6 h ILE 145 CO -0.04 0.14 0.21 0.74 0.00 0.00 0.00 178.15 179.19 1up6 h THR 146 N 0.49 0.96 -0.75 -0.27 2.02 -1.09 0.18 112.91 114.45 1up6 h THR 146 Ca 0.13 -0.14 0.13 0.00 0.77 0.00 0.00 66.41 67.30 1up6 h THR 146 Cb 0.03 0.51 -0.09 0.00 -1.74 0.00 0.00 68.15 66.86 1up6 h THR 146 CO -0.02 0.08 0.32 -0.08 0.37 0.00 0.00 175.52 176.19 1up6 h GLU 147 N 0.42 0.47 0.07 6.66 4.57 -1.02 -0.25 114.58 125.49 1up6 h GLU 147 Ca 0.18 -0.03 -0.00 0.00 -1.18 0.00 0.00 59.36 58.33 1up6 h GLU 147 Cb 0.10 -0.11 0.00 0.00 -0.16 0.00 0.00 28.75 28.58 1up6 h GLU 147 CO -0.13 0.31 -0.03 0.35 -1.18 0.00 0.00 179.01 178.33 1up6 h PHE 148 N 0.49 -0.08 -0.44 0.92 3.57 -0.06 -2.27 116.94 119.07 1up6 h PHE 148 Ca 0.41 -0.00 -0.09 0.00 3.53 0.00 0.00 57.97 61.81 1up6 h PHE 148 Cb 0.58 0.03 -0.01 0.00 2.79 0.00 0.00 35.95 39.34 1up6 h PHE 148 CO -0.15 0.17 -0.08 0.28 -2.23 0.00 0.00 178.31 176.31 1up6 h VAL 149 N -0.33 1.27 -0.04 1.41 2.07 -0.58 -1.20 116.25 118.85 1up6 h VAL 149 Ca -0.01 -1.17 -0.24 0.00 0.82 0.00 0.00 66.70 66.10 1up6 h VAL 149 Cb 0.29 1.13 0.01 0.00 -1.52 0.00 0.00 31.29 31.21 1up6 h VAL 149 CO 0.01 0.40 -0.94 0.03 0.02 0.00 0.00 177.57 177.10 1up6 h ARG 150 N 0.66 0.61 -0.02 1.57 2.47 -1.08 0.21 114.38 118.80 1up6 h ARG 150 Ca 0.11 -0.61 0.00 0.00 -1.26 0.00 0.00 59.98 58.23 1up6 h ARG 150 Cb 0.60 0.16 0.00 0.00 -1.65 0.00 0.00 29.97 29.09 1up6 h ARG 150 CO 0.04 1.22 -0.06 0.09 0.56 0.00 0.00 179.97 181.81 1up6 n ASN 151 N -3.84 2.01 0.00 7.04 3.02 -0.85 -3.86 115.26 118.78 1up6 n ASN 151 Ca -0.08 -1.50 0.00 0.00 -0.03 0.00 0.00 54.58 52.96 1up6 n ASN 151 Cb 0.83 0.10 0.00 0.00 -0.61 0.00 0.00 39.78 40.10 1up6 n ASN 151 CO 0.00 0.00 0.00 -1.22 -2.62 0.00 0.00 177.26 173.42 1up6 n TYR 152 N 0.57 0.00 0.12 3.10 4.02 -0.51 -4.73 117.16 119.74 1up6 n TYR 152 Ca 0.08 0.00 -0.00 0.00 -0.01 0.00 0.00 57.90 57.96 1up6 n TYR 152 Cb 0.34 0.11 0.02 0.00 -0.02 0.00 0.00 39.34 39.78 1up6 n TYR 152 CO 0.00 0.00 0.00 -0.07 -1.01 0.00 0.00 176.86 175.78 1up6 h LEU 153 N 0.00 0.00 -1.63 7.72 3.38 -1.35 -3.49 115.31 119.95 1up6 h LEU 153 Ca 0.00 0.00 -0.35 0.00 0.09 0.00 0.00 57.88 57.62 1up6 h LEU 153 Cb 0.46 0.00 0.14 0.00 0.09 0.00 0.00 40.66 41.35 1up6 h LEU 153 CO 0.00 0.64 -0.78 -0.62 0.09 0.00 0.00 178.44 177.78 1up6 n GLU 154 N -3.31 -6.33 -3.75 1.13 1.02 0.69 -5.00 120.64 105.09 1up6 n GLU 154 Ca 0.01 0.80 -0.38 0.00 -0.02 0.00 0.00 57.16 57.57 1up6 n GLU 154 Cb 0.77 -5.73 -0.12 0.00 -0.02 0.00 0.00 31.44 26.34 1up6 n GLU 154 CO 0.00 0.00 0.00 -0.47 1.18 0.00 0.00 177.13 177.84 1up6 s TYR 155 N -3.42 3.17 0.06 -0.32 5.04 -0.83 -5.01 117.35 116.03 1up6 s TYR 155 Ca 0.04 -1.02 -0.22 0.00 -2.44 0.00 0.00 57.07 53.42 1up6 s TYR 155 Cb -0.02 -2.27 -0.14 0.00 0.35 0.00 0.00 41.96 39.88 1up6 s TYR 155 CO 0.75 -0.60 1.55 1.49 -1.34 0.00 0.00 175.55 177.41 1up6 h GLU 156 N 8.25 0.14 -2.58 4.97 4.81 -1.90 -3.32 114.58 124.95 1up6 h GLU 156 Ca -0.30 -0.03 -0.53 0.00 -0.13 0.00 0.00 59.36 58.36 1up6 h GLU 156 Cb 1.12 -0.02 -0.04 0.00 0.63 0.00 0.00 28.75 30.44 1up6 h GLU 156 CO 0.61 0.31 2.17 1.63 -0.73 0.00 0.00 179.01 182.99 1up6 n LYS 157 N -4.90 3.27 -3.99 1.92 5.02 -1.26 -4.73 118.16 113.49 1up6 n LYS 157 Ca -0.06 -2.08 -0.31 0.00 -2.02 0.00 0.00 58.31 53.84 1up6 n LYS 157 Cb 0.14 -2.50 -0.15 0.00 -0.02 0.00 0.00 35.03 32.50 1up6 n LYS 157 CO 0.00 0.00 0.00 0.12 -0.52 0.00 0.00 177.40 177.00 1up6 s PHE 158 N 0.98 2.94 -0.24 2.13 2.19 -1.25 -0.46 117.98 124.27 1up6 s PHE 158 Ca 0.66 -2.20 -0.05 0.00 0.33 0.00 0.00 56.93 55.67 1up6 s PHE 158 Cb 0.24 -1.96 -0.01 0.00 -1.31 0.00 0.00 43.02 39.98 1up6 s PHE 158 CO -0.06 -0.85 0.00 0.42 1.83 0.00 0.00 175.22 176.55 1up6 s ILE 159 N 1.20 3.62 -0.00 3.12 1.01 0.33 -4.92 121.20 125.56 1up6 s ILE 159 Ca -0.03 -0.52 -0.25 0.00 0.00 0.00 0.00 60.65 59.84 1up6 s ILE 159 Cb -0.19 -2.72 -0.04 0.00 0.01 0.00 0.00 42.46 39.51 1up6 s ILE 159 CO -0.07 0.32 0.77 -0.83 0.00 0.00 0.00 174.94 175.13 1up6 s GLY 160 N 1.49 2.74 0.29 6.18 0.00 -1.09 -0.85 107.32 116.10 1up6 s GLY 160 Ca 0.05 0.26 0.10 0.00 0.00 0.00 0.00 44.72 45.13 1up6 s GLY 160 CO -0.01 1.22 -0.01 1.08 0.00 0.00 0.00 173.10 175.37 1up6 s LEU 161 N 0.43 3.06 0.04 0.66 1.02 1.00 -0.79 118.68 124.11 1up6 s LEU 161 Ca 0.40 -0.80 -0.11 0.00 0.02 0.00 0.00 54.13 53.65 1up6 s LEU 161 Cb -0.19 -1.54 0.01 0.00 0.02 0.00 0.00 46.19 44.48 1up6 s LEU 161 CO 0.22 -0.08 0.22 0.00 0.02 0.00 0.00 176.35 176.73 1up6 n ASN 163 N 0.64 0.89 0.11 0.00 2.04 -1.26 -4.37 115.26 113.30 1up6 n ASN 163 Ca -0.19 -1.02 -0.19 0.00 -0.44 0.00 0.00 54.58 52.75 1up6 n ASN 163 Cb 0.59 0.01 -0.15 0.00 -2.53 0.00 0.00 39.78 37.70 1up6 n ASN 163 CO 0.00 0.00 0.00 -0.37 -0.44 0.00 0.00 177.26 176.45 1up6 h VAL 164 N 1.25 1.33 0.16 3.53 -1.51 -1.98 -1.83 116.25 117.20 1up6 h VAL 164 Ca 0.00 -2.87 0.00 0.00 -1.23 0.00 0.00 66.70 62.60 1up6 h VAL 164 Cb 0.39 2.92 -0.01 0.00 -2.13 0.00 0.00 31.29 32.47 1up6 h VAL 164 CO 0.00 0.85 -0.14 -0.65 -1.23 0.00 0.00 177.57 176.40 1up6 h PRO 165 N 0.10 -0.31 -0.26 5.19 0.11 -1.94 -0.31 132.00 134.57 1up6 h PRO 165 Ca -0.20 0.02 -0.01 0.00 0.11 0.00 0.00 66.00 65.91 1up6 h PRO 165 Cb 2.05 0.07 -0.01 0.00 0.11 0.00 0.00 31.00 33.21 1up6 h PRO 165 CO 0.21 -0.21 0.11 0.97 -0.21 0.00 0.00 178.00 178.88 1up6 h ILE 166 N -0.32 1.10 -0.45 4.15 2.10 -1.79 -0.79 117.51 121.51 1up6 h ILE 166 Ca -0.00 -0.31 -0.09 0.00 1.08 0.00 0.00 64.86 65.53 1up6 h ILE 166 Cb 0.30 0.78 -0.01 0.00 -1.09 0.00 0.00 36.82 36.79 1up6 h ILE 166 CO -0.02 0.12 -0.07 0.78 -1.08 0.00 0.00 178.15 177.88 1up6 h ASN 167 N 0.37 0.85 -0.05 2.19 2.35 -1.17 -2.28 115.58 117.84 1up6 h ASN 167 Ca 0.09 -0.35 -0.06 0.00 -0.55 0.00 0.00 56.30 55.44 1up6 h ASN 167 Cb 0.07 -0.23 0.00 0.00 0.05 0.00 0.00 38.32 38.21 1up6 h ASN 167 CO -0.01 0.99 -0.20 0.15 -1.65 0.00 0.00 177.43 176.71 1up6 h PHE 168 N 0.69 0.30 -0.65 1.19 3.57 -0.34 -2.26 116.94 119.44 1up6 h PHE 168 Ca 0.12 -0.13 0.11 0.00 3.53 0.00 0.00 57.97 61.60 1up6 h PHE 168 Cb 0.60 -0.05 -0.08 0.00 2.79 0.00 0.00 35.95 39.21 1up6 h PHE 168 CO 0.05 0.83 0.22 0.82 -2.23 0.00 0.00 178.31 178.00 1up6 h ILE 169 N -0.33 0.70 -0.74 1.41 2.04 -1.25 -1.47 117.51 117.87 1up6 h ILE 169 Ca -0.01 -0.13 0.03 0.00 1.00 0.00 0.00 64.86 65.75 1up6 h ILE 169 Cb 0.85 0.29 -0.04 0.00 -0.74 0.00 0.00 36.82 37.19 1up6 h ILE 169 CO 0.04 0.07 0.49 -0.09 0.00 0.00 0.00 178.15 178.66 1up6 h ARG 170 N 0.37 0.89 -0.03 2.37 2.43 -1.39 0.12 114.38 119.15 1up6 h ARG 170 Ca 0.34 -0.05 -0.00 0.00 -0.81 0.00 0.00 59.98 59.45 1up6 h ARG 170 Cb 0.47 -0.20 -0.00 0.00 -0.42 0.00 0.00 29.97 29.82 1up6 h ARG 170 CO -0.36 0.59 0.01 1.49 -1.51 0.00 0.00 179.97 180.19 1up6 h GLU 171 N 0.92 0.04 -0.49 0.20 4.81 -0.72 -2.68 114.58 116.67 1up6 h GLU 171 Ca 0.29 -0.01 -0.10 0.00 -0.13 0.00 0.00 59.36 59.41 1up6 h GLU 171 Cb 0.02 -0.01 -0.02 0.00 0.63 0.00 0.00 28.75 29.38 1up6 h GLU 171 CO -0.08 0.21 -0.10 0.82 -0.73 0.00 0.00 179.01 179.13 1up6 h ILE 172 N -0.13 1.27 -0.26 2.32 1.08 -0.51 -2.97 117.51 118.30 1up6 h ILE 172 Ca 0.01 -1.23 0.06 0.00 -0.39 0.00 0.00 64.86 63.31 1up6 h ILE 172 Cb 0.18 1.06 -0.06 0.00 -3.07 0.00 0.00 36.82 34.93 1up6 h ILE 172 CO -0.00 0.43 -0.16 0.00 -0.69 0.00 0.00 178.15 177.72 1up6 h ALA 173 N 0.89 0.03 0.00 1.87 0.00 -0.84 -1.49 119.26 119.72 1up6 h ALA 173 Ca 0.13 0.09 0.00 0.00 0.00 0.00 0.00 54.91 55.13 1up6 h ALA 173 Cb 0.65 0.37 0.00 0.00 0.00 0.00 0.00 17.79 18.81 1up6 h ALA 173 CO 0.04 -0.57 0.00 -1.91 0.00 0.00 0.00 179.25 176.81 1up6 n GLU 174 N -5.32 0.48 0.00 0.00 4.07 -1.01 -0.43 120.64 118.42 1up6 n GLU 174 Ca -0.01 0.00 0.00 0.00 -0.06 0.00 0.00 57.16 57.09 1up6 n GLU 174 Cb 0.24 -1.26 0.00 0.00 -0.06 0.00 0.00 31.44 30.36 1up6 n GLU 174 CO 0.00 0.00 0.00 1.19 -0.06 0.00 0.00 177.13 178.26 1up6 n PHE 176 N 1.61 0.00 -3.36 4.31 3.72 -0.56 -4.86 117.46 118.32 1up6 n PHE 176 Ca 0.00 0.00 -0.18 0.00 -0.05 0.00 0.00 57.45 57.22 1up6 n PHE 176 Cb 0.24 0.00 0.08 0.00 -0.94 0.00 0.00 39.48 38.85 1up6 n PHE 176 CO 0.00 0.00 0.00 0.43 -0.05 0.00 0.00 176.76 177.14 1up6 n SER 177 N 0.00 -3.80 -4.32 4.37 7.64 0.43 -5.03 113.62 112.91 1up6 n SER 177 Ca 0.00 -0.52 -0.17 0.00 1.01 0.00 0.00 58.87 59.20 1up6 n SER 177 Cb 0.00 -4.57 -0.10 0.00 -1.01 0.00 0.00 64.21 58.53 1up6 n SER 177 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1up6 s ALA 178 N -3.30 1.75 0.70 -0.43 0.00 -0.36 -5.14 121.76 114.98 1up6 s ALA 178 Ca 0.24 -1.78 -0.11 0.00 0.00 0.00 0.00 51.96 50.31 1up6 s ALA 178 Cb -0.11 0.63 0.01 0.00 0.00 0.00 0.00 23.12 23.65 1up6 s ALA 178 CO 0.65 -0.31 1.07 1.03 0.00 0.00 0.00 175.76 178.20 1up6 s ARG 179 N -3.91 2.94 0.20 0.00 0.52 -1.26 -4.39 118.95 113.05 1up6 s ARG 179 Ca 0.30 0.63 -0.12 0.00 -0.52 0.00 0.00 55.73 56.02 1up6 s ARG 179 Cb 0.06 -2.02 0.25 0.00 0.52 0.00 0.00 34.95 33.77 1up6 s ARG 179 CO 0.09 -1.01 1.67 -0.07 0.02 0.00 0.00 175.30 176.00 1up6 h LEU 180 N -0.64 -0.26 -1.82 2.53 3.38 -1.95 -1.53 115.31 115.02 1up6 h LEU 180 Ca -0.45 0.14 0.00 0.00 0.09 0.00 0.00 57.88 57.66 1up6 h LEU 180 Cb 1.23 0.25 0.00 0.00 0.09 0.00 0.00 40.66 42.23 1up6 h LEU 180 CO 0.62 -0.10 0.00 -0.33 0.09 0.00 0.00 178.44 178.72 1up6 h GLU 181 N 0.11 0.00 0.00 1.13 3.07 -1.98 -2.06 114.58 114.85 1up6 h GLU 181 Ca 0.29 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 59.15 1up6 h GLU 181 Cb 0.46 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.37 1up6 h GLU 181 CO -0.49 0.00 0.00 -0.25 -1.40 0.00 0.00 179.01 176.87 1up6 n ASP 182 N -2.61 0.66 -4.67 1.42 8.00 -0.57 -4.76 116.55 114.02 1up6 n ASP 182 Ca -0.01 0.58 -0.37 0.00 0.71 0.00 0.00 54.79 55.70 1up6 n ASP 182 Cb 0.11 -0.75 -0.09 0.00 -0.02 0.00 0.00 41.12 40.36 1up6 n ASP 182 CO 0.00 0.00 0.00 -0.69 -0.39 0.00 0.00 177.20 176.12 1up6 s VAL 183 N -3.12 5.35 -0.03 2.53 1.01 -0.78 -0.79 120.40 124.56 1up6 s VAL 183 Ca 0.10 0.24 0.04 0.00 0.00 0.00 0.00 61.98 62.36 1up6 s VAL 183 Cb 0.13 -3.52 -0.00 0.00 0.00 0.00 0.00 36.38 32.98 1up6 s VAL 183 CO 0.54 0.34 -0.15 0.12 0.00 0.00 0.00 175.10 175.95 1up6 s PHE 184 N 1.02 1.50 0.08 5.22 2.19 0.38 -5.01 117.98 123.35 1up6 s PHE 184 Ca 0.09 -0.39 0.08 0.00 0.33 0.00 0.00 56.93 57.04 1up6 s PHE 184 Cb -0.13 -1.01 -0.03 0.00 -1.31 0.00 0.00 43.02 40.53 1up6 s PHE 184 CO 0.04 -0.12 -0.22 -0.51 1.83 0.00 0.00 175.22 176.24 1up6 s LEU 185 N -0.01 2.24 -0.56 6.12 1.02 -1.26 -0.89 118.68 125.34 1up6 s LEU 185 Ca -0.02 -0.62 -0.21 0.00 0.02 0.00 0.00 54.13 53.30 1up6 s LEU 185 Cb -0.10 -1.01 0.06 0.00 0.02 0.00 0.00 46.19 45.17 1up6 s LEU 185 CO 0.01 0.14 0.78 -0.75 0.02 0.00 0.00 176.35 176.54 1up6 s LYS 186 N -1.58 3.16 -0.06 1.70 2.20 -0.51 -4.93 119.74 119.71 1up6 s LYS 186 Ca 0.08 -0.81 0.02 0.00 -0.36 0.00 0.00 55.97 54.90 1up6 s LYS 186 Cb -0.10 -4.14 0.02 0.00 -1.51 0.00 0.00 37.83 32.10 1up6 s LYS 186 CO 0.03 -1.45 -0.09 -0.47 -0.36 0.00 0.00 175.35 173.01 1up6 s TYR 187 N 3.22 1.22 0.10 4.03 6.14 -1.26 -1.57 117.35 129.23 1up6 s TYR 187 Ca 0.19 -0.45 -0.24 0.00 0.64 0.00 0.00 57.07 57.22 1up6 s TYR 187 Cb -0.18 -0.95 0.06 0.00 0.42 0.00 0.00 41.96 41.31 1up6 s TYR 187 CO 0.12 -0.27 0.58 1.52 0.64 0.00 0.00 175.55 178.14 1up6 s TYR 188 N 0.86 -0.51 -5.00 4.97 1.13 -0.79 -4.21 117.35 113.81 1up6 s TYR 188 Ca -0.11 0.44 0.00 0.00 -1.41 0.00 0.00 57.07 55.99 1up6 s TYR 188 Cb -0.15 0.47 0.00 0.00 -1.10 0.00 0.00 41.96 41.18 1up6 s TYR 188 CO 0.01 -0.76 0.00 0.41 -2.51 0.00 0.00 175.55 172.70 1up6 n GLY 189 N -0.02 0.40 3.86 5.49 0.00 -1.22 -0.98 105.19 112.71 1up6 n GLY 189 Ca -0.17 -1.48 -0.22 0.00 0.00 0.00 0.00 46.02 44.15 1up6 n GLY 189 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1up6 s LEU 190 N 0.00 3.91 0.16 0.99 1.02 -0.06 -0.85 118.68 123.85 1up6 s LEU 190 Ca 0.00 -0.19 -0.34 0.00 0.02 0.00 0.00 54.13 53.62 1up6 s LEU 190 Cb 0.00 -2.45 -0.15 0.00 0.02 0.00 0.00 46.19 43.61 1up6 s LEU 190 CO 0.00 -0.06 1.41 -3.20 0.02 0.00 0.00 176.35 174.51 1up6 n ASN 191 N -1.24 2.34 -2.08 2.29 2.85 -1.26 -0.48 115.26 117.68 1up6 n ASN 191 Ca -0.08 1.12 -0.19 0.00 -0.11 0.00 0.00 54.58 55.32 1up6 n ASN 191 Cb 0.58 -1.33 -0.04 0.00 1.24 0.00 0.00 39.78 40.23 1up6 n ASN 191 CO 0.00 0.00 0.00 1.41 -2.11 0.00 0.00 177.26 176.56 1up6 n HIS 192 N 2.51 -0.69 -2.70 1.20 8.25 -1.26 -4.82 115.22 117.70 1up6 n HIS 192 Ca 0.16 0.00 -0.07 0.00 -0.26 0.00 0.00 57.72 57.55 1up6 n HIS 192 Cb 0.26 -3.57 0.10 0.00 1.12 0.00 0.00 29.99 27.89 1up6 n HIS 192 CO 0.00 0.00 0.00 -0.11 0.64 0.00 0.00 176.34 176.87 1up6 n LEU 193 N -2.70 -1.94 -4.67 2.41 -0.00 0.37 -4.62 117.00 105.85 1up6 n LEU 193 Ca -0.22 -3.26 -0.24 0.00 -0.00 0.00 0.00 56.01 52.29 1up6 n LEU 193 Cb 0.66 0.51 -0.08 0.00 -0.00 0.00 0.00 43.42 44.51 1up6 n LEU 193 CO 0.28 1.87 -0.27 -0.94 -0.00 0.00 0.00 177.39 178.33 1up6 s SER 194 N -1.05 4.35 -0.03 1.96 1.04 -1.15 -0.89 113.70 117.94 1up6 s SER 194 Ca 0.20 -0.92 -0.02 0.00 0.48 0.00 0.00 55.95 55.69 1up6 s SER 194 Cb 0.32 -0.60 0.01 0.00 0.10 0.00 0.00 66.02 65.85 1up6 s SER 194 CO -0.08 -0.26 0.08 -0.36 0.98 0.00 0.00 173.24 173.60 1up6 s PHE 195 N -2.49 -0.08 -0.14 5.02 0.08 -0.16 -1.97 117.98 118.24 1up6 s PHE 195 Ca 0.36 0.21 0.00 0.00 0.12 0.00 0.00 56.93 57.62 1up6 s PHE 195 Cb -0.01 0.01 -0.01 0.00 -0.57 0.00 0.00 43.02 42.44 1up6 s PHE 195 CO 0.20 -0.05 -0.15 0.42 -0.10 0.00 0.00 175.22 175.54 1up6 s ILE 196 N 0.16 2.72 -0.04 0.64 1.01 0.63 -1.88 121.20 124.44 1up6 s ILE 196 Ca -0.01 -0.76 0.12 0.00 0.00 0.00 0.00 60.65 59.99 1up6 s ILE 196 Cb -0.02 -2.14 -0.18 0.00 0.01 0.00 0.00 42.46 40.14 1up6 s ILE 196 CO -0.00 0.52 0.27 1.21 0.00 0.00 0.00 174.94 176.93 1up6 n GLU 197 N 3.86 0.49 -3.70 2.79 2.13 -0.61 -0.54 120.64 125.06 1up6 n GLU 197 Ca -0.19 -0.10 -0.12 0.00 0.66 0.00 0.00 57.16 57.42 1up6 n GLU 197 Cb 0.52 -1.27 -0.10 0.00 0.27 0.00 0.00 31.44 30.87 1up6 n GLU 197 CO 0.00 0.00 0.00 0.21 -0.41 0.00 0.00 177.13 176.93 1up6 s LYS 198 N -2.78 0.50 -0.13 5.31 2.47 -1.25 -4.97 119.74 118.89 1up6 s LYS 198 Ca -0.04 0.76 0.01 0.00 -1.56 0.00 0.00 55.97 55.14 1up6 s LYS 198 Cb 0.08 0.14 0.02 0.00 -1.46 0.00 0.00 37.83 36.60 1up6 s LYS 198 CO 0.49 -0.11 -0.16 0.08 0.16 0.00 0.00 175.35 175.81 1up6 s VAL 199 N 0.84 1.62 -0.07 4.02 1.01 -1.26 -1.43 120.40 125.14 1up6 s VAL 199 Ca -0.05 -0.70 0.05 0.00 0.00 0.00 0.00 61.98 61.29 1up6 s VAL 199 Cb -0.05 -1.49 -0.01 0.00 0.00 0.00 0.00 36.38 34.83 1up6 s VAL 199 CO -0.07 0.47 -0.24 -0.36 0.00 0.00 0.00 175.10 174.90 1up6 s PHE 200 N 1.16 2.37 -0.12 5.22 0.08 -0.06 -0.87 117.98 125.76 1up6 s PHE 200 Ca -0.02 -0.78 0.01 0.00 0.12 0.00 0.00 56.93 56.26 1up6 s PHE 200 Cb -0.14 -1.57 0.02 0.00 -0.57 0.00 0.00 43.02 40.76 1up6 s PHE 200 CO -0.06 -0.27 -0.16 0.08 -0.10 0.00 0.00 175.22 174.72 1up6 s VAL 201 N 0.02 1.59 -1.45 -0.44 1.01 -0.70 -0.47 120.40 119.95 1up6 s VAL 201 Ca -0.08 -0.68 -0.14 0.00 0.00 0.00 0.00 61.98 61.07 1up6 s VAL 201 Cb -0.15 -1.46 0.12 0.00 0.00 0.00 0.00 36.38 34.90 1up6 s VAL 201 CO 0.05 0.46 0.62 0.29 0.00 0.00 0.00 175.10 176.51 1up6 n LYS 202 N 4.34 -3.11 0.00 2.72 5.02 0.03 -1.04 118.16 126.12 1up6 n LYS 202 Ca -0.19 0.38 0.00 0.00 -2.02 0.00 0.00 58.31 56.48 1up6 n LYS 202 Cb 0.51 -5.08 0.00 0.00 -0.02 0.00 0.00 35.03 30.44 1up6 n LYS 202 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1up6 n GLY 203 N -1.23 2.94 3.72 0.72 0.00 -1.26 -5.02 105.19 105.06 1up6 n GLY 203 Ca 0.04 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.65 1up6 n GLY 203 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 1up6 s GLU 204 N -0.34 4.54 -0.62 1.61 2.12 -0.20 -4.99 118.70 120.81 1up6 s GLU 204 Ca 0.00 1.24 -0.27 0.00 0.36 0.00 0.00 54.97 56.30 1up6 s GLU 204 Cb 0.00 -3.43 -0.01 0.00 0.26 0.00 0.00 34.13 30.95 1up6 s GLU 204 CO 0.00 0.06 1.72 0.34 -0.54 0.00 0.00 175.26 176.84 1up6 s ASP 205 N 0.66 5.52 -0.16 -1.70 -1.08 -1.26 -1.73 116.67 116.92 1up6 s ASP 205 Ca 0.46 0.21 0.16 0.00 -0.52 0.00 0.00 52.55 52.86 1up6 s ASP 205 Cb -0.20 -2.54 0.61 0.00 -1.46 0.00 0.00 42.92 39.33 1up6 s ASP 205 CO 0.25 -2.20 1.52 1.33 0.52 0.00 0.00 175.17 176.59 1up6 n VAL 206 N 7.03 2.18 -0.04 1.11 0.24 -0.05 -4.74 118.33 124.06 1up6 n VAL 206 Ca 0.17 -1.55 -0.09 0.00 -2.04 0.00 0.00 64.34 60.83 1up6 n VAL 206 Cb 0.51 -0.10 -0.02 0.00 -1.47 0.00 0.00 33.84 32.75 1up6 n VAL 206 CO 0.00 0.00 0.00 0.74 -2.14 0.00 0.00 176.83 175.43 1up6 h THR 207 N 2.76 0.37 -0.64 3.34 2.02 -1.86 -1.94 112.91 116.96 1up6 h THR 207 Ca 0.00 0.00 0.00 0.00 0.77 0.00 0.00 66.41 67.18 1up6 h THR 207 Cb 1.50 0.37 -0.03 0.00 -1.74 0.00 0.00 68.15 68.24 1up6 h THR 207 CO 0.26 0.00 0.40 -0.33 0.37 0.00 0.00 175.52 176.22 1up6 h GLU 208 N -0.27 0.85 -0.65 6.66 3.07 -1.93 -2.23 114.58 120.08 1up6 h GLU 208 Ca 0.13 -0.06 -0.06 0.00 -0.50 0.00 0.00 59.36 58.87 1up6 h GLU 208 Cb 0.48 -0.19 -0.03 0.00 -0.84 0.00 0.00 28.75 28.17 1up6 h GLU 208 CO -0.38 0.59 0.18 0.87 -1.40 0.00 0.00 179.01 178.86 1up6 h LYS 209 N 0.87 1.03 -0.03 2.33 1.57 -1.73 -0.87 116.57 119.74 1up6 h LYS 209 Ca 0.23 -0.24 -0.00 0.00 -1.87 0.00 0.00 60.65 58.78 1up6 h LYS 209 Cb -0.06 -0.14 -0.00 0.00 0.08 0.00 0.00 32.23 32.11 1up6 h LYS 209 CO -0.05 0.91 0.02 0.28 -0.57 0.00 0.00 179.45 180.05 1up6 h VAL 210 N 0.96 1.05 -0.39 0.50 2.07 -0.82 0.21 116.25 119.83 1up6 h VAL 210 Ca 0.21 -0.14 0.08 0.00 0.82 0.00 0.00 66.70 67.67 1up6 h VAL 210 Cb 0.33 1.09 -0.08 0.00 -1.52 0.00 0.00 31.29 31.11 1up6 h VAL 210 CO -0.00 0.04 -0.17 -0.26 0.02 0.00 0.00 177.57 177.20 1up6 h PHE 211 N -0.01 -0.42 -0.25 1.57 0.04 -1.27 -0.00 116.94 116.60 1up6 h PHE 211 Ca 0.01 0.04 0.03 0.00 2.80 0.00 0.00 57.97 60.85 1up6 h PHE 211 Cb 0.05 0.24 -0.03 0.00 2.20 0.00 0.00 35.95 38.42 1up6 h PHE 211 CO -0.06 -0.25 0.08 0.93 -0.60 0.00 0.00 178.31 178.41 1up6 h GLU 212 N -0.10 0.18 0.00 1.51 5.08 -0.87 -2.51 114.58 117.88 1up6 h GLU 212 Ca 0.19 -0.01 -0.03 0.00 -1.00 0.00 0.00 59.36 58.51 1up6 h GLU 212 Cb 0.39 -0.04 -0.00 0.00 0.50 0.00 0.00 28.75 29.60 1up6 h GLU 212 CO -0.45 0.12 -0.15 -0.91 -1.00 0.00 0.00 179.01 176.62 1up6 h ASN 213 N 0.19 0.00 1.17 1.42 -0.26 -0.09 -2.32 115.58 115.69 1up6 h ASN 213 Ca 0.11 0.00 0.00 0.00 -0.56 0.00 0.00 56.30 55.85 1up6 h ASN 213 Cb 0.09 0.00 0.00 0.00 -1.06 0.00 0.00 38.32 37.35 1up6 h ASN 213 CO -0.12 0.15 0.00 0.25 -1.06 0.00 0.00 177.43 176.64 1up6 h LEU 214 N 0.00 0.00 0.13 1.61 5.85 -0.54 -3.22 115.31 119.13 1up6 h LEU 214 Ca -0.00 0.00 -0.01 0.00 0.84 0.00 0.00 57.88 58.71 1up6 h LEU 214 Cb 0.47 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.50 1up6 h LEU 214 CO 0.02 0.00 -0.06 0.11 -0.34 0.00 0.00 178.44 178.17 1up6 h LYS 215 N 0.00 -0.17 -0.25 1.25 1.57 -1.38 -3.20 116.57 114.39 1up6 h LYS 215 Ca 0.00 0.01 0.00 0.00 -1.87 0.00 0.00 60.65 58.79 1up6 h LYS 215 Cb 0.59 0.04 0.00 0.00 0.08 0.00 0.00 32.23 32.93 1up6 h LYS 215 CO 0.00 -0.11 0.00 1.47 -0.57 0.00 0.00 179.45 180.24 1up6 n LEU 216 N -4.27 0.25 -4.46 2.94 -0.00 -1.25 -4.43 117.00 105.79 1up6 n LEU 216 Ca -0.02 -0.12 -0.44 0.00 -0.00 0.00 0.00 56.01 55.43 1up6 n LEU 216 Cb 0.07 -0.12 -0.06 0.00 -0.00 0.00 0.00 43.42 43.30 1up6 n LEU 216 CO 0.05 0.06 0.32 -0.54 -0.00 0.00 0.00 177.39 177.29 1up6 s LYS 217 N -1.08 3.14 0.00 1.47 1.02 -1.21 -5.05 119.74 118.02 1up6 s LYS 217 Ca 0.00 -0.82 0.00 0.00 0.02 0.00 0.00 55.97 55.17 1up6 s LYS 217 Cb 0.00 -4.07 0.00 0.00 -0.52 0.00 0.00 37.83 33.24 1up6 s LYS 217 CO 0.00 -1.17 0.00 1.28 -0.92 0.00 0.00 175.35 174.54 1up6 n LEU 218 N 6.14 0.00 0.00 3.17 4.32 -1.26 -5.03 117.00 124.34 1up6 n LEU 218 Ca -0.06 0.00 0.00 0.00 -0.02 0.00 0.00 56.01 55.93 1up6 n LEU 218 Cb 0.46 0.00 0.00 0.00 -1.62 0.00 0.00 43.42 42.26 1up6 n LEU 218 CO 0.53 0.00 0.00 -1.54 -1.22 0.00 0.00 177.39 175.16 1up6 n SER 219 N 0.00 0.00 0.00 -1.43 3.41 -1.26 -5.20 113.62 109.14 1up6 n SER 219 Ca 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.61 1up6 n SER 219 Cb 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 63.95 1up6 n SER 219 CO 0.00 0.00 0.00 -0.90 -0.16 0.00 0.00 175.04 173.98 1up6 n ASP 225 N 2.38 0.00 -4.75 4.04 5.68 -1.26 -5.29 116.55 117.34 1up6 n ASP 225 Ca 0.00 0.00 -0.41 0.00 -0.50 0.00 0.00 54.79 53.88 1up6 n ASP 225 Cb 0.00 0.00 -0.02 0.00 -1.14 0.00 0.00 41.12 39.96 1up6 n ASP 225 CO 0.00 0.00 0.00 -0.36 -1.33 0.00 0.00 177.20 175.51 1up6 s PHE 226 N -1.75 2.85 0.82 2.11 0.08 -1.26 -5.00 117.98 115.84 1up6 s PHE 226 Ca 0.00 0.97 -0.12 0.00 0.12 0.00 0.00 56.93 57.90 1up6 s PHE 226 Cb 0.00 -3.94 0.08 0.00 -0.57 0.00 0.00 43.02 38.59 1up6 s PHE 226 CO 0.00 -3.03 1.16 -1.25 -0.10 0.00 0.00 175.22 172.00 1up6 s PRO 227 N -0.77 1.91 0.20 0.24 0.04 -1.26 -4.96 135.00 130.40 1up6 s PRO 227 Ca 0.59 0.21 -0.11 0.00 0.04 0.00 0.00 61.00 61.73 1up6 s PRO 227 Cb -0.45 -1.94 0.25 0.00 0.04 0.00 0.00 34.50 32.41 1up6 s PRO 227 CO 0.49 -1.65 1.72 1.15 0.04 0.00 0.00 177.00 178.74 1up6 h THR 228 N -1.10 0.71 -0.12 1.26 2.02 -1.98 -2.49 112.91 111.22 1up6 h THR 228 Ca -0.47 -0.10 -0.05 0.00 0.77 0.00 0.00 66.41 66.56 1up6 h THR 228 Cb 1.32 0.39 -0.01 0.00 -1.74 0.00 0.00 68.15 68.11 1up6 h THR 228 CO 0.65 0.05 -0.15 4.11 0.37 0.00 0.00 175.52 180.55 1up6 h TRP 229 N 0.30 0.20 -0.22 3.16 5.08 -1.98 -2.41 115.95 120.09 1up6 h TRP 229 Ca 0.29 -0.02 0.04 0.00 1.08 0.00 0.00 58.89 60.28 1up6 h TRP 229 Cb 0.39 -0.06 -0.04 0.00 -3.00 0.00 0.00 29.16 26.45 1up6 h TRP 229 CO -0.21 0.35 -0.05 0.35 -1.28 0.00 0.00 178.44 177.59 1up6 h PHE 230 N 0.19 -0.11 -0.16 0.12 3.57 -1.82 -1.53 116.94 117.19 1up6 h PHE 230 Ca 0.04 0.02 -0.08 0.00 3.53 0.00 0.00 57.97 61.48 1up6 h PHE 230 Cb 0.39 0.08 -0.01 0.00 2.79 0.00 0.00 35.95 39.20 1up6 h PHE 230 CO 0.00 -0.09 -0.26 1.88 -2.23 0.00 0.00 178.31 177.61 1up6 h TYR 231 N 0.00 0.33 0.00 0.41 0.05 -1.48 -1.67 116.97 114.62 1up6 h TYR 231 Ca 0.10 -0.06 0.00 0.00 0.05 0.00 0.00 58.73 58.82 1up6 h TYR 231 Cb 0.16 -0.08 0.00 0.00 1.01 0.00 0.00 36.73 37.81 1up6 h TYR 231 CO -0.23 0.54 0.00 -0.44 -1.05 0.00 0.00 178.16 176.98 1up6 h ASP 232 N 0.27 0.00 0.00 3.88 3.32 -1.15 -2.40 116.42 120.34 1up6 h ASP 232 Ca 0.04 0.00 -0.33 0.00 0.02 0.00 0.00 57.03 56.77 1up6 h ASP 232 Cb 0.61 0.00 -0.05 0.00 0.22 0.00 0.00 39.33 40.11 1up6 h ASP 232 CO 0.04 0.00 -2.06 -1.20 -1.72 0.00 0.00 179.24 174.30 1up6 n SER 233 N -3.04 1.95 0.08 6.45 7.64 -0.61 -4.66 113.62 121.42 1up6 n SER 233 Ca 0.01 0.34 -0.11 0.00 1.01 0.00 0.00 58.87 60.12 1up6 n SER 233 Cb 0.31 -0.80 -0.04 0.00 -1.01 0.00 0.00 64.21 62.67 1up6 n SER 233 CO 0.00 0.00 0.00 0.58 -3.01 0.00 0.00 175.04 172.61 1up6 h VAL 234 N -1.00 1.45 -3.01 0.44 2.07 -1.47 -3.47 116.25 111.26 1up6 h VAL 234 Ca -0.49 -2.59 -0.36 0.00 0.82 0.00 0.00 66.70 64.08 1up6 h VAL 234 Cb 1.42 2.49 0.01 0.00 -1.52 0.00 0.00 31.29 33.69 1up6 h VAL 234 CO -0.30 0.76 -0.48 0.54 0.02 0.00 0.00 177.57 178.11 1up6 n ARG 235 N -3.68 -2.35 -4.36 1.57 1.74 -0.90 -5.00 116.66 103.67 1up6 n ARG 235 Ca -0.05 0.85 -0.23 0.00 -0.77 0.00 0.00 57.85 57.65 1up6 n ARG 235 Cb 0.84 -5.39 -0.13 0.00 -1.02 0.00 0.00 32.46 26.76 1up6 n ARG 235 CO 0.00 0.00 0.00 -0.51 -1.52 0.00 0.00 177.63 175.60 1up6 s LEU 236 N -5.41 2.24 -0.20 0.55 1.43 -1.26 -4.85 118.68 111.18 1up6 s LEU 236 Ca 0.08 -0.60 -0.22 0.00 -1.03 0.00 0.00 54.13 52.37 1up6 s LEU 236 Cb -0.04 -0.79 -0.02 0.00 0.03 0.00 0.00 46.19 45.37 1up6 s LEU 236 CO 0.10 0.05 0.68 -0.63 0.23 0.00 0.00 176.35 176.79 1up6 s ILE 237 N -1.04 4.97 -0.03 -0.59 1.01 0.30 -4.89 121.20 120.94 1up6 s ILE 237 Ca 0.04 1.29 -0.02 0.00 0.00 0.00 0.00 60.65 61.97 1up6 s ILE 237 Cb -0.09 -3.99 -0.04 0.00 0.01 0.00 0.00 42.46 38.35 1up6 s ILE 237 CO 0.03 0.07 0.08 -0.69 0.00 0.00 0.00 174.94 174.43 1up6 s VAL 238 N 2.12 4.82 0.26 2.92 1.01 -1.26 -0.27 120.40 129.99 1up6 s VAL 238 Ca 0.31 -0.29 -0.31 0.00 0.00 0.00 0.00 61.98 61.69 1up6 s VAL 238 Cb -0.16 -3.17 -0.13 0.00 0.00 0.00 0.00 36.38 32.93 1up6 s VAL 238 CO 0.10 0.42 1.52 -3.20 0.00 0.00 0.00 175.10 173.94 1up6 n ASN 239 N 1.40 3.34 0.29 3.32 2.85 -0.83 -4.89 115.26 120.74 1up6 n ASN 239 Ca -0.14 1.14 0.15 0.00 -0.11 0.00 0.00 54.58 55.61 1up6 n ASN 239 Cb 0.53 -1.51 0.90 0.00 1.24 0.00 0.00 39.78 40.94 1up6 n ASN 239 CO 0.00 0.00 0.00 -0.65 -2.11 0.00 0.00 177.26 174.50 1up6 h PRO 240 N 4.71 0.00 -0.00 1.20 0.11 -1.94 -0.94 132.00 135.14 1up6 h PRO 240 Ca -0.46 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.65 1up6 h PRO 240 Cb 1.25 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 32.36 1up6 h PRO 240 CO 0.79 0.02 0.01 1.88 -0.21 0.00 0.00 178.00 180.49 1up6 h TYR 241 N 0.00 0.00 0.00 0.65 0.05 -1.90 -2.15 116.97 113.62 1up6 h TYR 241 Ca -0.00 0.00 0.00 0.00 0.05 0.00 0.00 58.73 58.78 1up6 h TYR 241 Cb 0.07 0.00 0.00 0.00 1.01 0.00 0.00 36.73 37.81 1up6 h TYR 241 CO 0.00 0.00 0.00 -0.07 -1.05 0.00 0.00 178.16 177.04 1up6 h LEU 242 N 0.00 0.00 -1.54 3.88 -0.00 -1.42 -2.13 115.31 114.10 1up6 h LEU 242 Ca 0.00 0.00 0.10 0.00 -0.00 0.00 0.00 57.88 57.98 1up6 h LEU 242 Cb 0.02 0.00 -0.04 0.00 -0.00 0.00 0.00 40.66 40.63 1up6 h LEU 242 CO -0.00 0.00 0.45 0.03 -0.00 0.00 0.00 178.44 178.92 1up6 h ARG 243 N 0.00 0.50 0.00 1.13 3.08 -1.60 0.28 114.38 117.78 1up6 h ARG 243 Ca 0.00 -0.03 -0.07 0.00 0.07 0.00 0.00 59.98 59.95 1up6 h ARG 243 Cb 0.20 -0.11 -0.01 0.00 0.08 0.00 0.00 29.97 30.12 1up6 h ARG 243 CO 0.00 0.33 -0.31 1.88 -1.07 0.00 0.00 179.97 180.80 1up6 h TYR 244 N 0.52 0.00 0.04 3.04 0.05 -1.62 -3.09 116.97 115.90 1up6 h TYR 244 Ca 0.31 0.00 -0.19 0.00 0.05 0.00 0.00 58.73 58.90 1up6 h TYR 244 Cb 0.54 0.00 -0.02 0.00 1.01 0.00 0.00 36.73 38.26 1up6 h TYR 244 CO -0.00 0.31 -1.01 1.88 -1.05 0.00 0.00 178.16 178.29 1up6 h TYR 245 N 0.00 0.16 -0.45 4.88 -1.99 -1.19 -3.28 116.97 115.10 1up6 h TYR 245 Ca -0.00 -0.11 -0.20 0.00 2.00 0.00 0.00 58.73 60.42 1up6 h TYR 245 Cb 0.58 -0.01 -0.12 0.00 2.00 0.00 0.00 36.73 39.19 1up6 h TYR 245 CO 0.00 1.40 0.25 1.28 -0.00 0.00 0.00 178.16 181.09 1up6 n LEU 246 N -4.29 4.52 0.00 3.88 4.32 0.81 -4.99 117.00 121.25 1up6 n LEU 246 Ca -0.24 -2.35 0.00 0.00 -0.02 0.00 0.00 56.01 53.39 1up6 n LEU 246 Cb 0.71 -0.65 0.00 0.00 -1.62 0.00 0.00 43.42 41.86 1up6 n LEU 246 CO 0.30 0.69 0.00 1.21 -1.22 0.00 0.00 177.39 178.38 1up6 n GLU 248 N -0.17 0.00 -0.12 3.23 2.13 -1.21 -5.03 120.64 119.46 1up6 n GLU 248 Ca 0.26 0.00 -0.06 0.00 0.66 0.00 0.00 57.16 58.02 1up6 n GLU 248 Cb 1.00 0.00 0.02 0.00 0.27 0.00 0.00 31.44 32.73 1up6 n GLU 248 CO 0.00 0.00 0.00 0.87 -0.41 0.00 0.00 177.13 177.59 1up6 h LYS 249 N 0.00 0.40 -0.43 5.31 1.57 -1.91 -0.26 116.57 121.24 1up6 h LYS 249 Ca 0.00 -0.02 0.00 0.00 -1.87 0.00 0.00 60.65 58.76 1up6 h LYS 249 Cb 0.00 -0.09 0.00 0.00 0.08 0.00 0.00 32.23 32.22 1up6 h LYS 249 CO 0.00 0.26 0.00 1.17 -0.57 0.00 0.00 179.45 180.31 1up6 n LYS 250 N -4.92 0.15 0.00 3.15 4.81 -1.26 -2.30 118.16 117.79 1up6 n LYS 250 Ca 0.02 0.00 0.00 0.00 -0.87 0.00 0.00 58.31 57.46 1up6 n LYS 250 Cb 0.10 -1.13 0.00 0.00 0.02 0.00 0.00 35.03 34.02 1up6 n LYS 250 CO 0.00 0.00 0.00 0.34 1.17 0.00 0.00 177.40 178.91 1up6 n PHE 252 N 0.51 0.00 -0.31 5.64 7.35 -0.11 -2.21 117.46 128.32 1up6 n PHE 252 Ca 0.00 0.00 0.05 0.00 -0.76 0.00 0.00 57.45 56.74 1up6 n PHE 252 Cb 0.04 0.00 0.25 0.00 0.35 0.00 0.00 39.48 40.12 1up6 n PHE 252 CO 0.00 0.00 0.00 -0.22 -0.76 0.00 0.00 176.76 175.78 1up6 h LYS 253 N 0.00 0.98 -0.02 -4.13 3.64 -1.71 -0.40 116.57 114.93 1up6 h LYS 253 Ca 0.00 -0.06 -0.00 0.00 -1.27 0.00 0.00 60.65 59.32 1up6 h LYS 253 Cb 0.00 -0.22 -0.00 0.00 -0.41 0.00 0.00 32.23 31.60 1up6 h LYS 253 CO 0.00 0.65 -0.01 -0.22 -2.27 0.00 0.00 179.45 177.60 1up6 h LYS 254 N 1.01 0.04 -0.61 1.90 3.64 -1.72 -2.48 116.57 118.34 1up6 h LYS 254 Ca 0.41 -0.02 -0.07 0.00 -1.27 0.00 0.00 60.65 59.70 1up6 h LYS 254 Cb 0.27 -0.00 -0.03 0.00 -0.41 0.00 0.00 32.23 32.06 1up6 h LYS 254 CO -0.17 0.44 0.09 0.82 -2.27 0.00 0.00 179.45 178.37 1up6 h ILE 255 N -0.37 1.25 -0.00 2.00 2.04 -1.80 -3.05 117.51 117.57 1up6 h ILE 255 Ca 0.00 -0.99 0.00 0.00 1.00 0.00 0.00 64.86 64.88 1up6 h ILE 255 Cb 0.43 0.68 0.00 0.00 -0.74 0.00 0.00 36.82 37.20 1up6 h ILE 255 CO 0.00 0.37 -0.25 -1.54 0.00 0.00 0.00 178.15 176.73 1up6 n SER 256 N -4.22 0.38 -0.97 1.72 3.41 -0.18 -3.44 113.62 110.32 1up6 n SER 256 Ca 0.04 -0.15 0.09 0.00 -0.26 0.00 0.00 58.87 58.58 1up6 n SER 256 Cb 0.28 -0.05 0.22 0.00 -0.26 0.00 0.00 64.21 64.40 1up6 n SER 256 CO 0.00 0.00 0.00 0.41 -0.16 0.00 0.00 175.04 175.29 1up6 n THR 257 N -1.31 0.86 -4.22 6.66 -1.04 -0.93 -5.00 114.28 109.29 1up6 n THR 257 Ca 0.09 -0.93 -0.13 0.00 -2.04 0.00 0.00 64.05 61.04 1up6 n THR 257 Cb 0.32 0.62 -0.10 0.00 -1.82 0.00 0.00 70.33 69.36 1up6 n THR 257 CO 0.00 0.00 0.00 -1.00 -0.64 0.00 0.00 175.07 173.43 1up6 s HIS 258 N -1.07 1.15 0.34 -1.42 3.76 -1.19 -5.06 115.29 111.81 1up6 s HIS 258 Ca 0.34 -1.08 -0.28 0.00 -0.15 0.00 0.00 55.06 53.89 1up6 s HIS 258 Cb 0.19 -0.65 -0.12 0.00 1.11 0.00 0.00 32.58 33.10 1up6 s HIS 258 CO 0.25 -0.30 1.23 -1.91 -0.85 0.00 0.00 174.74 173.16 1up6 n GLU 259 N -0.22 1.95 -1.76 1.40 2.13 -1.26 -4.93 120.64 117.95 1up6 n GLU 259 Ca -0.06 0.68 -0.42 0.00 0.66 0.00 0.00 57.16 58.03 1up6 n GLU 259 Cb 0.64 -2.23 -0.02 0.00 0.27 0.00 0.00 31.44 30.09 1up6 n GLU 259 CO 0.00 0.00 0.00 -0.51 -0.41 0.00 0.00 177.13 176.21 1up6 s LEU 260 N -0.79 4.35 0.20 4.31 1.02 -1.26 -4.89 118.68 121.62 1up6 s LEU 260 Ca 0.57 2.91 -0.13 0.00 0.02 0.00 0.00 54.13 57.50 1up6 s LEU 260 Cb -0.59 -3.62 0.24 0.00 0.02 0.00 0.00 46.19 42.24 1up6 s LEU 260 CO 0.61 -0.94 1.66 0.03 0.02 0.00 0.00 176.35 177.73 1up6 h ARG 261 N 5.65 0.06 -1.05 1.70 2.47 -1.95 -2.03 114.38 119.23 1up6 h ARG 261 Ca -0.45 -0.00 0.28 0.00 -1.26 0.00 0.00 59.98 58.54 1up6 h ARG 261 Cb 1.21 -0.01 -0.09 0.00 -1.65 0.00 0.00 29.97 29.43 1up6 h ARG 261 CO 0.86 0.04 0.69 0.00 0.56 0.00 0.00 179.97 182.12 1up6 h ALA 262 N 1.54 2.34 0.00 0.04 0.00 -1.90 0.35 119.26 121.64 1up6 h ALA 262 Ca 0.29 0.05 -0.05 0.00 0.00 0.00 0.00 54.91 55.20 1up6 h ALA 262 Cb 0.46 0.04 -0.01 0.00 0.00 0.00 0.00 17.79 18.28 1up6 h ALA 262 CO -0.53 -0.74 -0.24 -0.09 0.00 0.00 0.00 179.25 177.65 1up6 h ARG 263 N 0.34 0.00 0.01 0.00 2.43 -1.72 -3.18 114.38 112.25 1up6 h ARG 263 Ca 0.59 0.00 -0.05 0.00 -0.81 0.00 0.00 59.98 59.71 1up6 h ARG 263 Cb 1.60 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 31.16 1up6 h ARG 263 CO -0.26 0.24 -0.21 0.93 -1.51 0.00 0.00 179.97 179.15 1up6 h GLU 264 N 0.00 0.13 -2.18 0.20 5.08 -0.32 -3.10 114.58 114.39 1up6 h GLU 264 Ca -0.00 -0.15 -0.01 0.00 -1.00 0.00 0.00 59.36 58.19 1up6 h GLU 264 Cb 0.99 0.05 -0.01 0.00 0.50 0.00 0.00 28.75 30.28 1up6 h GLU 264 CO 0.03 0.93 0.06 1.55 -1.00 0.00 0.00 179.01 180.58 1up6 n VAL 265 N -4.53 0.65 0.00 3.13 3.14 -0.83 -1.39 118.33 118.50 1up6 n VAL 265 Ca -0.10 -0.22 0.00 0.00 -2.96 0.00 0.00 64.34 61.06 1up6 n VAL 265 Cb 0.50 -1.27 0.00 0.00 -1.06 0.00 0.00 33.84 32.01 1up6 n VAL 265 CO 0.00 0.00 0.00 1.17 -6.46 0.00 0.00 176.83 171.54 1up6 n LYS 267 N 2.11 0.00 -0.16 1.45 4.81 -1.17 -0.24 118.16 124.96 1up6 n LYS 267 Ca 0.03 0.00 -0.05 0.00 -0.87 0.00 0.00 58.31 57.42 1up6 n LYS 267 Cb 0.17 0.00 0.05 0.00 0.02 0.00 0.00 35.03 35.27 1up6 n LYS 267 CO 0.00 0.00 0.00 0.82 1.17 0.00 0.00 177.40 179.39 1up6 h ILE 268 N 0.00 0.96 -0.27 3.15 2.04 -1.54 -1.65 117.51 120.20 1up6 h ILE 268 Ca 0.00 -0.17 -0.11 0.00 1.00 0.00 0.00 64.86 65.58 1up6 h ILE 268 Cb 0.00 0.43 -0.01 0.00 -0.74 0.00 0.00 36.82 36.49 1up6 h ILE 268 CO 0.00 0.09 -0.28 -0.33 0.00 0.00 0.00 178.15 177.63 1up6 h GLU 269 N 0.49 0.55 0.00 2.37 5.08 -0.88 -0.52 114.58 121.67 1up6 h GLU 269 Ca 0.22 -0.23 -0.03 0.00 -1.00 0.00 0.00 59.36 58.32 1up6 h GLU 269 Cb 0.12 -0.02 -0.00 0.00 0.50 0.00 0.00 28.75 29.34 1up6 h GLU 269 CO -0.15 0.78 -0.16 -0.22 -1.00 0.00 0.00 179.01 178.26 1up6 h LYS 270 N 0.48 0.00 0.21 2.33 3.64 -1.73 -1.54 116.57 119.95 1up6 h LYS 270 Ca 0.06 0.00 -0.33 0.00 -1.27 0.00 0.00 60.65 59.11 1up6 h LYS 270 Cb 0.73 0.00 0.02 0.00 -0.41 0.00 0.00 32.23 32.58 1up6 h LYS 270 CO 0.06 0.16 -1.52 0.93 -2.27 0.00 0.00 179.45 176.81 1up6 h GLU 271 N 0.00 0.44 -0.06 1.90 5.08 -0.62 -3.30 114.58 118.02 1up6 h GLU 271 Ca -0.00 -0.75 -0.04 0.00 -1.00 0.00 0.00 59.36 57.57 1up6 h GLU 271 Cb 0.64 0.28 -0.00 0.00 0.50 0.00 0.00 28.75 30.17 1up6 h GLU 271 CO 0.02 1.35 -0.10 -0.07 -1.00 0.00 0.00 179.01 179.21 1up6 h LEU 272 N 0.12 0.20 -0.77 1.33 3.38 -0.92 -3.02 115.31 115.62 1up6 h LEU 272 Ca -0.26 -0.54 0.15 0.00 0.09 0.00 0.00 57.88 57.32 1up6 h LEU 272 Cb 2.11 -0.06 -0.10 0.00 0.09 0.00 0.00 40.66 42.71 1up6 h LEU 272 CO 0.23 0.70 0.32 -0.26 0.09 0.00 0.00 178.44 179.52 1up6 h PHE 273 N -0.30 0.54 -0.82 1.13 0.04 -1.45 0.34 116.94 116.43 1up6 h PHE 273 Ca 0.01 0.04 0.01 0.00 2.80 0.00 0.00 57.97 60.82 1up6 h PHE 273 Cb 0.66 -0.12 -0.04 0.00 2.20 0.00 0.00 35.95 38.64 1up6 h PHE 273 CO 0.11 0.07 0.54 1.49 -0.60 0.00 0.00 178.31 179.91 1up6 h GLU 274 N 0.46 1.07 -0.08 1.51 4.57 -1.62 -2.69 114.58 117.80 1up6 h GLU 274 Ca 0.43 -0.06 -0.20 0.00 -1.18 0.00 0.00 59.36 58.35 1up6 h GLU 274 Cb 0.66 -0.24 -0.00 0.00 -0.16 0.00 0.00 28.75 29.01 1up6 h GLU 274 CO -0.41 0.71 -0.78 0.87 -1.18 0.00 0.00 179.01 178.22 1up6 h LYS 275 N 1.10 0.47 -0.02 1.92 1.57 -0.94 -3.11 116.57 117.56 1up6 h LYS 275 Ca 0.30 -0.40 0.01 0.00 -1.87 0.00 0.00 60.65 58.69 1up6 h LYS 275 Cb -0.12 0.09 -0.00 0.00 0.08 0.00 0.00 32.23 32.28 1up6 h LYS 275 CO -0.07 1.04 0.03 1.88 -0.57 0.00 0.00 179.45 181.76 1up6 h TYR 276 N 0.31 0.00 -0.91 -1.35 0.05 -0.69 -0.24 116.97 114.15 1up6 h TYR 276 Ca -0.04 0.00 0.12 0.00 0.05 0.00 0.00 58.73 58.86 1up6 h TYR 276 Cb 1.37 0.00 -0.08 0.00 1.01 0.00 0.00 36.73 39.03 1up6 h TYR 276 CO 0.05 0.00 0.53 -0.09 -1.05 0.00 0.00 178.16 177.61 1up6 h ARG 277 N 0.00 0.81 0.00 4.88 2.43 -1.43 -3.36 114.38 117.71 1up6 h ARG 277 Ca 0.01 -0.05 0.00 0.00 -0.81 0.00 0.00 59.98 59.13 1up6 h ARG 277 Cb 0.07 -0.18 0.00 0.00 -0.42 0.00 0.00 29.97 29.43 1up6 h ARG 277 CO -0.00 0.54 -0.92 0.25 -1.51 0.00 0.00 179.97 178.33 1up6 n THR 278 N -4.72 0.00 -1.72 0.20 -2.24 -0.84 -4.97 114.28 99.99 1up6 n THR 278 Ca 0.17 0.00 -0.39 0.00 -2.27 0.00 0.00 64.05 61.55 1up6 n THR 278 Cb 0.35 0.25 0.03 0.00 -2.10 0.00 0.00 70.33 68.86 1up6 n THR 278 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1up6 n ALA 279 N -1.46 1.37 0.48 6.98 0.00 -0.16 -4.93 120.51 122.79 1up6 n ALA 279 Ca 0.00 0.18 0.05 0.00 0.00 0.00 0.00 53.44 53.67 1up6 n ALA 279 Cb 0.07 -2.30 -0.07 0.00 0.00 0.00 0.00 19.45 17.15 1up6 n ALA 279 CO 0.00 0.00 0.00 1.55 0.00 0.00 0.00 177.50 179.05 1up6 n VAL 280 N -0.71 0.00 -4.05 0.00 3.14 -1.26 -4.98 118.33 110.47 1up6 n VAL 280 Ca 0.09 -0.23 -0.10 0.00 -2.96 0.00 0.00 64.34 61.14 1up6 n VAL 280 Cb 0.43 0.91 -0.11 0.00 -1.06 0.00 0.00 33.84 34.01 1up6 n VAL 280 CO 0.00 0.00 0.00 -0.70 -6.46 0.00 0.00 176.83 169.67 1up6 s GLU 281 N -2.17 0.50 0.26 1.45 2.12 -1.26 -4.80 118.70 114.81 1up6 s GLU 281 Ca 0.03 -0.90 -0.31 0.00 0.36 0.00 0.00 54.97 54.16 1up6 s GLU 281 Cb 0.09 0.01 -0.12 0.00 0.26 0.00 0.00 34.13 34.36 1up6 s GLU 281 CO 0.47 -0.04 1.57 -0.89 -0.54 0.00 0.00 175.26 175.84 1up6 n ILE 282 N 0.96 0.79 -2.34 -3.70 2.08 -1.26 -4.98 119.36 110.92 1up6 n ILE 282 Ca -0.20 -0.20 -0.33 0.00 0.56 0.00 0.00 62.75 62.59 1up6 n ILE 282 Cb 0.57 -1.84 -0.02 0.00 -0.75 0.00 0.00 39.64 37.60 1up6 n ILE 282 CO 0.00 0.00 0.00 -2.84 0.56 0.00 0.00 176.55 174.27 1up6 s PRO 283 N -0.15 3.76 0.03 0.38 0.02 -1.26 -5.01 135.00 132.78 1up6 s PRO 283 Ca 0.67 1.09 -0.19 0.00 0.02 0.00 0.00 61.00 62.59 1up6 s PRO 283 Cb -0.54 -2.10 -0.17 0.00 0.02 0.00 0.00 34.50 31.70 1up6 s PRO 283 CO 0.46 -0.43 1.24 0.93 -0.33 0.00 0.00 177.00 178.87 1up6 h GLU 284 N 0.93 0.43 -5.52 5.54 5.08 -2.06 -3.53 114.58 115.45 1up6 h GLU 284 Ca -0.47 -0.32 -0.22 0.00 -1.00 0.00 0.00 59.36 57.35 1up6 h GLU 284 Cb 1.20 0.05 -0.01 0.00 0.50 0.00 0.00 28.75 30.50 1up6 h GLU 284 CO 0.60 0.94 0.70 -1.83 -1.00 0.00 0.00 179.01 178.42 1up6 s GLU 285 N -3.81 1.93 0.00 2.33 -1.05 -1.26 -5.29 118.70 111.56 1up6 s GLU 285 Ca -0.14 0.69 0.00 0.00 -0.15 0.00 0.00 54.97 55.38 1up6 s GLU 285 Cb 0.05 -4.73 0.00 0.00 -0.44 0.00 0.00 34.13 29.01 1up6 s GLU 285 CO 0.79 -3.85 0.00 0.43 0.95 0.00 0.00 175.26 173.58 1up6 n SER 292 N 16.88 0.00 0.00 0.83 7.64 -1.26 -5.08 113.62 132.63 1up6 n SER 292 Ca 0.41 0.00 0.00 0.00 1.01 0.00 0.00 58.87 60.29 1up6 n SER 292 Cb 0.48 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.68 1up6 n SER 292 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1up6 n TYR 294 N 0.00 0.00 0.10 1.43 4.11 -1.26 -4.95 117.16 116.58 1up6 n TYR 294 Ca 0.00 0.00 -0.13 0.00 -0.00 0.00 0.00 57.90 57.77 1up6 n TYR 294 Cb 0.00 0.00 -0.07 0.00 -0.00 0.00 0.00 39.34 39.27 1up6 n TYR 294 CO 0.00 0.00 0.00 0.66 -0.00 0.00 0.00 176.86 177.52 1up6 h SER 295 N 1.45 -0.14 -0.85 9.48 4.64 -1.95 -0.18 113.55 126.00 1up6 h SER 295 Ca 0.00 -0.02 0.16 0.00 -0.47 0.00 0.00 61.79 61.47 1up6 h SER 295 Cb 0.00 0.03 -0.10 0.00 -0.31 0.00 0.00 62.40 62.02 1up6 h SER 295 CO 0.00 -0.07 0.42 0.74 -0.87 0.00 0.00 176.83 177.05 1up6 h THR 296 N -0.18 0.67 -0.81 2.95 2.02 -1.92 -1.18 112.91 114.45 1up6 h THR 296 Ca -0.02 -0.19 -0.01 0.00 0.77 0.00 0.00 66.41 66.96 1up6 h THR 296 Cb 0.14 0.06 -0.04 0.00 -1.74 0.00 0.00 68.15 66.57 1up6 h THR 296 CO 0.03 0.10 0.46 0.00 0.37 0.00 0.00 175.52 176.48 1up6 h ALA 297 N 1.59 1.03 -0.01 6.16 0.00 -1.48 -1.59 119.26 124.97 1up6 h ALA 297 Ca 0.48 -0.11 -0.00 0.00 0.00 0.00 0.00 54.91 55.28 1up6 h ALA 297 Cb 0.74 -0.32 -0.00 0.00 0.00 0.00 0.00 17.79 18.20 1up6 h ALA 297 CO -0.40 0.53 -0.00 0.00 0.00 0.00 0.00 179.25 179.38 1up6 h ALA 298 N 1.24 0.01 -0.80 0.00 0.00 -0.20 -2.34 119.26 117.16 1up6 h ALA 298 Ca 0.29 -0.23 -0.04 0.00 0.00 0.00 0.00 54.91 54.93 1up6 h ALA 298 Cb 0.01 -0.00 -0.04 0.00 0.00 0.00 0.00 17.79 17.76 1up6 h ALA 298 CO -0.05 -0.26 0.36 0.00 0.00 0.00 0.00 179.25 179.30 1up6 h ALA 299 N 0.55 1.04 -0.19 0.00 0.00 -1.28 -1.78 119.26 117.61 1up6 h ALA 299 Ca 0.00 -0.18 -0.13 0.00 0.00 0.00 0.00 54.91 54.61 1up6 h ALA 299 Cb 0.46 -0.32 -0.01 0.00 0.00 0.00 0.00 17.79 17.92 1up6 h ALA 299 CO 0.00 0.64 -0.42 0.45 0.00 0.00 0.00 179.25 179.91 1up6 h HIS 300 N 1.15 0.54 -0.41 0.00 3.86 -1.33 -1.17 115.15 117.80 1up6 h HIS 300 Ca 0.27 -0.16 -0.09 0.00 -1.16 0.00 0.00 60.37 59.24 1up6 h HIS 300 Cb 0.16 -0.12 -0.01 0.00 1.06 0.00 0.00 27.41 28.51 1up6 h HIS 300 CO 0.02 0.81 -0.09 1.25 0.86 0.00 0.00 177.93 180.78 1up6 h LEU 301 N 0.37 0.79 -0.29 2.43 5.85 -1.18 -1.53 115.31 121.75 1up6 h LEU 301 Ca 0.03 -0.36 -0.03 0.00 0.84 0.00 0.00 57.88 58.36 1up6 h LEU 301 Cb 0.90 -0.21 -0.01 0.00 0.37 0.00 0.00 40.66 41.70 1up6 h LEU 301 CO 0.08 0.96 0.06 0.40 -0.34 0.00 0.00 178.44 179.59 1up6 h ILE 302 N 0.60 1.22 -0.69 4.05 2.04 -1.25 0.00 117.51 123.49 1up6 h ILE 302 Ca 0.10 -0.75 0.09 0.00 1.00 0.00 0.00 64.86 65.30 1up6 h ILE 302 Cb 0.61 1.17 -0.07 0.00 -0.74 0.00 0.00 36.82 37.79 1up6 h ILE 302 CO 0.04 0.25 0.35 -0.09 0.00 0.00 0.00 178.15 178.69 1up6 h ARG 303 N 0.29 0.58 0.00 2.37 1.12 -1.16 -0.54 114.38 117.04 1up6 h ARG 303 Ca 0.09 -0.04 0.00 0.00 -1.11 0.00 0.00 59.98 58.92 1up6 h ARG 303 Cb 0.31 -0.13 0.00 0.00 -0.01 0.00 0.00 29.97 30.14 1up6 h ARG 303 CO 0.00 0.39 -0.24 -0.44 -3.11 0.00 0.00 179.97 176.57 1up6 h ASP 304 N 0.60 0.00 0.79 -3.80 3.32 -0.93 -2.00 116.42 114.40 1up6 h ASP 304 Ca 0.34 -0.03 -0.11 0.00 0.02 0.00 0.00 57.03 57.25 1up6 h ASP 304 Cb 0.33 0.00 -0.02 0.00 0.22 0.00 0.00 39.33 39.87 1up6 h ASP 304 CO -0.25 0.01 -0.51 -0.07 -1.72 0.00 0.00 179.24 176.70 1up6 h LEU 305 N 0.00 0.00 0.17 1.55 -0.00 -0.50 -3.31 115.31 113.22 1up6 h LEU 305 Ca 0.00 0.00 -0.31 0.00 -0.00 0.00 0.00 57.88 57.57 1up6 h LEU 305 Cb 0.90 0.00 0.01 0.00 -0.00 0.00 0.00 40.66 41.57 1up6 h LEU 305 CO 0.00 0.51 -1.47 -0.33 -0.00 0.00 0.00 178.44 177.15 1up6 h GLU 306 N 0.00 0.36 -6.90 1.13 4.39 -0.46 0.26 114.58 113.36 1up6 h GLU 306 Ca -0.01 -0.61 -0.45 0.00 0.34 0.00 0.00 59.36 58.63 1up6 h GLU 306 Cb 1.04 0.23 0.06 0.00 -0.10 0.00 0.00 28.75 29.98 1up6 h GLU 306 CO 0.07 1.27 -0.00 0.95 -1.16 0.00 0.00 179.01 180.13 1up6 s THR 307 N -2.62 2.45 -1.00 1.13 -4.23 -0.81 -4.78 115.64 105.78 1up6 s THR 307 Ca -0.08 -0.68 0.17 0.00 -1.18 0.00 0.00 61.69 59.91 1up6 s THR 307 Cb 0.06 -2.76 0.64 0.00 1.34 0.00 0.00 72.50 71.77 1up6 s THR 307 CO 0.89 0.00 1.55 -0.67 -0.54 0.00 0.00 174.62 175.85 1up6 n ASP 308 N -2.48 4.38 0.28 3.99 2.03 -1.26 -1.36 116.55 122.13 1up6 n ASP 308 Ca 0.11 -2.44 -0.16 0.00 0.52 0.00 0.00 54.79 52.81 1up6 n ASP 308 Cb 0.60 -0.52 -0.08 0.00 -0.72 0.00 0.00 41.12 40.39 1up6 n ASP 308 CO 0.00 0.00 0.00 -0.33 -1.92 0.00 0.00 177.20 174.95 1up6 h GLU 309 N 3.50 -0.66 -0.56 -0.67 5.08 -1.90 -3.47 114.58 115.91 1up6 h GLU 309 Ca 0.00 0.04 0.00 0.00 -1.00 0.00 0.00 59.36 58.40 1up6 h GLU 309 Cb 1.34 0.15 0.00 0.00 0.50 0.00 0.00 28.75 30.74 1up6 h GLU 309 CO 0.19 -0.41 0.00 0.41 -1.00 0.00 0.00 179.01 178.20 1up6 n GLY 310 N -1.21 -0.25 3.12 -3.84 0.00 -1.25 -5.07 105.19 96.69 1up6 n GLY 310 Ca -0.12 -0.82 -0.10 0.00 0.00 0.00 0.00 46.02 44.98 1up6 n GLY 310 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1up6 s LYS 311 N -0.74 0.70 -0.17 1.61 -0.14 -0.68 -4.93 119.74 115.39 1up6 s LYS 311 Ca 0.00 -1.17 -0.17 0.00 -1.36 0.00 0.00 55.97 53.27 1up6 s LYS 311 Cb 0.00 -0.09 -0.04 0.00 -1.68 0.00 0.00 37.83 36.02 1up6 s LYS 311 CO 0.00 -0.03 0.42 0.42 -0.76 0.00 0.00 175.35 175.40 1up6 s ILE 312 N -3.23 5.20 -0.04 2.17 -1.09 -1.26 -0.32 121.20 122.64 1up6 s ILE 312 Ca 0.06 0.79 0.02 0.00 -2.23 0.00 0.00 60.65 59.29 1up6 s ILE 312 Cb 0.03 -3.76 0.01 0.00 -1.58 0.00 0.00 42.46 37.16 1up6 s ILE 312 CO -0.05 0.29 -0.07 -1.00 -1.23 0.00 0.00 174.94 172.88 1up6 s HIS 313 N 0.96 0.90 -0.22 3.97 3.76 0.31 -4.93 115.29 120.05 1up6 s HIS 313 Ca 0.22 -0.25 -0.25 0.00 -0.15 0.00 0.00 55.06 54.62 1up6 s HIS 313 Cb -0.15 -0.69 -0.01 0.00 1.11 0.00 0.00 32.58 32.84 1up6 s HIS 313 CO 0.08 -0.15 0.85 0.42 -0.85 0.00 0.00 174.74 175.09 1up6 s ILE 314 N 0.50 4.84 0.18 0.60 1.01 -1.26 -0.70 121.20 126.36 1up6 s ILE 314 Ca -0.08 1.62 -0.06 0.00 0.00 0.00 0.00 60.65 62.14 1up6 s ILE 314 Cb -0.11 -4.14 -0.02 0.00 0.01 0.00 0.00 42.46 38.20 1up6 s ILE 314 CO 0.01 -0.05 0.23 0.68 0.00 0.00 0.00 174.94 175.81 1up6 s VAL 315 N 2.66 0.05 -0.30 2.92 -7.23 -0.53 -4.86 120.40 113.11 1up6 s VAL 315 Ca 0.37 -1.63 -0.17 0.00 -1.81 0.00 0.00 61.98 58.74 1up6 s VAL 315 Cb -0.16 -2.07 -0.02 0.00 0.56 0.00 0.00 36.38 34.69 1up6 s VAL 315 CO 0.09 -0.23 0.47 0.20 -0.31 0.00 0.00 175.10 175.32 1up6 s ASN 316 N -3.03 6.33 0.29 4.85 0.01 0.03 -1.52 114.94 121.90 1up6 s ASN 316 Ca 0.24 0.22 -0.20 0.00 -0.71 0.00 0.00 52.86 52.41 1up6 s ASN 316 Cb 0.04 -2.25 0.03 0.00 0.41 0.00 0.00 41.25 39.48 1up6 s ASN 316 CO 0.04 -0.33 0.74 0.28 -1.51 0.00 0.00 177.10 176.32 1up6 s THR 317 N 2.26 0.00 0.22 1.60 -1.32 -0.50 -2.66 115.64 115.25 1up6 s THR 317 Ca 0.18 -0.99 -0.32 0.00 -1.21 0.00 0.00 61.69 59.35 1up6 s THR 317 Cb -0.16 -2.13 -0.12 0.00 -1.51 0.00 0.00 72.50 68.58 1up6 s THR 317 CO 0.11 0.00 1.70 0.54 -2.21 0.00 0.00 174.62 174.76 1up6 n ARG 318 N -0.47 2.75 -0.26 7.08 1.74 -1.26 -0.20 116.66 126.04 1up6 n ARG 318 Ca -0.05 0.99 -0.00 0.00 -0.77 0.00 0.00 57.85 58.02 1up6 n ARG 318 Cb 0.59 -2.83 0.07 0.00 -1.02 0.00 0.00 32.46 29.27 1up6 n ARG 318 CO 0.00 0.00 0.00 -0.97 -1.52 0.00 0.00 177.63 175.14 1up6 h ASN 319 N 6.43 -0.88 -6.83 0.55 -1.24 -0.35 -3.46 115.58 109.81 1up6 h ASN 319 Ca -0.44 0.24 -0.55 0.00 0.71 0.00 0.00 56.30 56.26 1up6 h ASN 319 Cb 1.21 0.52 -0.22 0.00 0.73 0.00 0.00 38.32 40.56 1up6 h ASN 319 CO 0.93 -0.27 -0.85 0.59 -1.29 0.00 0.00 177.43 176.54 1up6 n ASN 320 N -5.49 0.34 0.00 1.15 5.03 -0.17 -0.94 115.26 115.18 1up6 n ASN 320 Ca 0.09 -1.13 0.00 0.00 0.87 0.00 0.00 54.58 54.41 1up6 n ASN 320 Cb 0.38 -1.41 0.00 0.00 -1.02 0.00 0.00 39.78 37.73 1up6 n ASN 320 CO 0.00 0.00 0.00 0.61 -1.83 0.00 0.00 177.26 176.04 1up6 n GLY 321 N -2.12 1.33 0.18 7.41 0.00 -1.26 -4.93 105.19 105.80 1up6 n GLY 321 Ca -0.21 0.00 -0.04 0.00 0.00 0.00 0.00 46.02 45.77 1up6 n GLY 321 CO 0.00 0.00 0.00 0.23 0.00 0.00 0.00 173.32 173.55 1up6 h SER 322 N 0.00 -0.40 -3.68 1.61 0.87 -1.22 -3.35 113.55 107.37 1up6 h SER 322 Ca 0.00 0.13 -0.69 0.00 -1.23 0.00 0.00 61.79 60.00 1up6 h SER 322 Cb 0.00 0.27 -0.31 0.00 -0.44 0.00 0.00 62.40 61.92 1up6 h SER 322 CO 0.00 -0.14 -0.63 -0.63 -0.53 0.00 0.00 176.83 174.90 1up6 s ILE 323 N -6.22 3.44 0.16 2.23 -1.09 -1.26 -1.43 121.20 117.03 1up6 s ILE 323 Ca -0.14 -1.35 0.28 0.00 -2.23 0.00 0.00 60.65 57.22 1up6 s ILE 323 Cb 0.15 -3.01 0.30 0.00 -1.58 0.00 0.00 42.46 38.32 1up6 s ILE 323 CO 0.71 -0.22 1.92 1.05 -1.23 0.00 0.00 174.94 177.16 1up6 h GLU 324 N 8.12 0.00 -0.78 2.79 4.11 -1.48 -2.54 114.58 124.81 1up6 h GLU 324 Ca -0.21 0.00 -0.30 0.00 0.07 0.00 0.00 59.36 58.92 1up6 h GLU 324 Cb 1.07 0.00 -0.18 0.00 0.50 0.00 0.00 28.75 30.14 1up6 h GLU 324 CO 0.59 0.13 0.36 0.27 0.07 0.00 0.00 179.01 180.43 1up6 n ASN 325 N -3.31 4.28 -4.23 3.06 6.94 -1.26 -4.88 115.26 115.85 1up6 n ASN 325 Ca 0.00 -3.39 -0.24 0.00 -0.02 0.00 0.00 54.58 50.94 1up6 n ASN 325 Cb 0.36 -0.76 -0.13 0.00 -2.36 0.00 0.00 39.78 36.89 1up6 n ASN 325 CO 0.00 0.00 0.00 -0.76 -1.03 0.00 0.00 177.26 175.47 1up6 s LEU 326 N -3.11 2.21 0.51 -4.53 1.02 -0.96 -4.93 118.68 108.88 1up6 s LEU 326 Ca 0.55 -0.56 -0.22 0.00 0.02 0.00 0.00 54.13 53.92 1up6 s LEU 326 Cb 0.45 -0.85 -0.07 0.00 0.02 0.00 0.00 46.19 45.74 1up6 s LEU 326 CO 0.11 0.10 1.20 -2.65 0.02 0.00 0.00 176.35 175.13 1up6 n PRO 327 N 1.64 1.52 -0.21 1.29 -0.02 -1.26 -4.84 135.00 133.12 1up6 n PRO 327 Ca -0.18 0.56 0.14 0.00 -2.02 0.00 0.00 63.50 62.00 1up6 n PRO 327 Cb 0.54 -2.36 0.46 0.00 -0.02 0.00 0.00 33.50 32.12 1up6 n PRO 327 CO 0.00 0.00 0.00 -0.44 1.98 0.00 0.00 175.50 177.04 1up6 h ASP 328 N 1.39 0.49 0.10 2.55 5.19 -1.94 -2.89 116.42 121.31 1up6 h ASP 328 Ca -0.49 0.03 0.00 0.00 -0.62 0.00 0.00 57.03 55.95 1up6 h ASP 328 Cb 1.32 -0.07 0.00 0.00 0.18 0.00 0.00 39.33 40.76 1up6 h ASP 328 CO 0.56 0.25 -0.19 -0.90 -3.12 0.00 0.00 179.24 175.84 1up6 n ASP 329 N -4.51 1.50 -4.69 6.45 5.75 -1.26 -1.00 116.55 118.79 1up6 n ASP 329 Ca 0.16 -1.27 -0.43 0.00 -0.01 0.00 0.00 54.79 53.24 1up6 n ASP 329 Cb 0.52 0.14 -0.03 0.00 -1.03 0.00 0.00 41.12 40.71 1up6 n ASP 329 CO 0.00 0.00 0.00 -1.22 -0.11 0.00 0.00 177.20 175.87 1up6 n TYR 330 N -0.13 2.60 -2.23 2.11 4.02 -1.09 -4.74 117.16 117.70 1up6 n TYR 330 Ca 0.14 -0.14 -0.43 0.00 -0.01 0.00 0.00 57.90 57.46 1up6 n TYR 330 Cb 0.39 -2.73 -0.02 0.00 -0.02 0.00 0.00 39.34 36.96 1up6 n TYR 330 CO 0.00 0.00 0.00 0.08 -1.01 0.00 0.00 176.86 175.93 1up6 s VAL 331 N 2.80 3.92 0.26 -0.72 1.01 -1.26 -0.29 120.40 126.11 1up6 s VAL 331 Ca 0.83 1.14 0.10 0.00 0.00 0.00 0.00 61.98 64.05 1up6 s VAL 331 Cb -0.50 -3.74 -0.05 0.00 0.00 0.00 0.00 36.38 32.10 1up6 s VAL 331 CO 0.38 -0.09 -0.16 -0.76 0.00 0.00 0.00 175.10 174.47 1up6 s LEU 332 N 3.53 2.58 -0.42 3.92 1.43 0.72 -4.85 118.68 125.60 1up6 s LEU 332 Ca 0.64 -1.05 -0.19 0.00 -1.03 0.00 0.00 54.13 52.50 1up6 s LEU 332 Cb -0.28 -0.92 0.02 0.00 0.03 0.00 0.00 46.19 45.04 1up6 s LEU 332 CO 0.22 -0.08 0.52 -0.70 0.23 0.00 0.00 176.35 176.54 1up6 s GLU 333 N -3.58 3.23 0.14 1.70 2.12 -0.03 -1.41 118.70 120.88 1up6 s GLU 333 Ca 0.28 -0.55 -0.11 0.00 0.36 0.00 0.00 54.97 54.95 1up6 s GLU 333 Cb -0.02 -3.94 0.01 0.00 0.26 0.00 0.00 34.13 30.43 1up6 s GLU 333 CO 0.12 -0.88 0.31 0.96 -0.54 0.00 0.00 175.26 175.24 1up6 s ILE 334 N 2.41 0.08 -0.05 -3.70 -4.36 -0.57 -3.41 121.20 111.60 1up6 s ILE 334 Ca 0.17 -1.10 -0.30 0.00 -0.26 0.00 0.00 60.65 59.16 1up6 s ILE 334 Cb -0.16 -1.55 -0.02 0.00 1.25 0.00 0.00 42.46 41.98 1up6 s ILE 334 CO 0.15 -0.37 1.04 -2.16 0.24 0.00 0.00 174.94 173.84 1up6 s PRO 335 N -3.90 4.46 0.09 0.37 0.05 -1.26 -1.45 135.00 133.37 1up6 s PRO 335 Ca 0.10 1.47 0.07 0.00 0.05 0.00 0.00 61.00 62.69 1up6 s PRO 335 Cb 0.03 -3.50 -0.03 0.00 0.05 0.00 0.00 34.50 31.05 1up6 s PRO 335 CO -0.06 -0.24 -0.17 0.00 0.05 0.00 0.00 177.00 176.58 1up6 s TYR 337 N -1.30 3.20 -0.15 0.00 5.04 0.09 -0.53 117.35 123.70 1up6 s TYR 337 Ca 0.03 0.60 -0.03 0.00 -2.44 0.00 0.00 57.07 55.23 1up6 s TYR 337 Cb -0.10 -3.05 -0.02 0.00 0.35 0.00 0.00 41.96 39.15 1up6 s TYR 337 CO 0.03 -0.51 -0.06 0.08 -1.34 0.00 0.00 175.55 173.76 1up6 s VAL 338 N 2.68 3.68 -0.29 3.14 1.01 0.56 -0.10 120.40 131.07 1up6 s VAL 338 Ca 0.26 -0.43 -0.16 0.00 0.00 0.00 0.00 61.98 61.65 1up6 s VAL 338 Cb -0.15 -2.60 0.14 0.00 0.00 0.00 0.00 36.38 33.78 1up6 s VAL 338 CO 0.12 0.50 0.94 -0.60 0.00 0.00 0.00 175.10 176.06 1up6 s ARG 339 N 0.39 0.40 -1.14 2.72 3.52 -0.56 -1.69 118.95 122.60 1up6 s ARG 339 Ca -0.06 0.74 -0.26 0.00 -0.13 0.00 0.00 55.73 56.03 1up6 s ARG 339 Cb -0.15 0.15 0.02 0.00 -1.56 0.00 0.00 34.95 33.42 1up6 s ARG 339 CO 0.03 -0.09 0.71 0.43 -0.81 0.00 0.00 175.30 175.58 1up6 n SER 340 N 3.97 -4.71 0.00 -2.12 7.64 -0.46 -1.43 113.62 116.52 1up6 n SER 340 Ca -0.17 -1.15 0.00 0.00 1.01 0.00 0.00 58.87 58.56 1up6 n SER 340 Cb 0.57 -2.31 0.00 0.00 -1.01 0.00 0.00 64.21 61.46 1up6 n SER 340 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1up6 n GLY 341 N -1.91 0.65 3.47 0.23 0.00 0.90 -5.00 105.19 103.54 1up6 n GLY 341 Ca -0.12 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.62 1up6 n GLY 341 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1up6 s ARG 342 N -0.35 1.71 -0.22 1.61 0.52 -0.51 -5.09 118.95 116.62 1up6 s ARG 342 Ca 0.00 -1.34 0.02 0.00 -0.52 0.00 0.00 55.73 53.89 1up6 s ARG 342 Cb 0.00 -2.01 0.04 0.00 0.52 0.00 0.00 34.95 33.50 1up6 s ARG 342 CO 0.00 0.44 -0.16 0.08 0.02 0.00 0.00 175.30 175.68 1up6 s VAL 343 N -1.44 2.11 -0.15 3.52 1.01 -1.26 -1.49 120.40 122.69 1up6 s VAL 343 Ca 0.20 -1.28 -0.04 0.00 0.00 0.00 0.00 61.98 60.86 1up6 s VAL 343 Cb -0.09 -2.06 -0.03 0.00 0.00 0.00 0.00 36.38 34.19 1up6 s VAL 343 CO 0.11 0.26 -0.00 -1.00 0.00 0.00 0.00 175.10 174.47 1up6 s HIS 344 N 1.20 3.11 0.33 5.22 3.76 0.86 -4.97 115.29 124.80 1up6 s HIS 344 Ca -0.02 -0.11 -0.26 0.00 -0.15 0.00 0.00 55.06 54.53 1up6 s HIS 344 Cb -0.16 -1.96 -0.10 0.00 1.11 0.00 0.00 32.58 31.47 1up6 s HIS 344 CO -0.09 0.11 0.97 -0.08 -0.85 0.00 0.00 174.74 174.80 1up6 s THR 345 N 0.15 4.07 -0.07 1.30 -1.32 -1.26 -0.73 115.64 117.77 1up6 s THR 345 Ca 0.01 1.71 0.03 0.00 -1.21 0.00 0.00 61.69 62.23 1up6 s THR 345 Cb -0.13 -3.95 -0.02 0.00 -1.51 0.00 0.00 72.50 66.89 1up6 s THR 345 CO 0.02 0.13 -0.16 -0.22 -2.21 0.00 0.00 174.62 172.18 1up6 s LEU 346 N -2.12 2.60 0.26 9.08 2.96 -1.25 -4.87 118.68 125.34 1up6 s LEU 346 Ca 0.51 -0.29 -0.30 0.00 -0.22 0.00 0.00 54.13 53.84 1up6 s LEU 346 Cb -0.20 -1.53 -0.10 0.00 0.50 0.00 0.00 46.19 44.86 1up6 s LEU 346 CO 0.26 0.28 1.35 -0.94 -1.32 0.00 0.00 176.35 175.98 1up6 s SER 347 N -0.35 6.78 0.00 3.68 1.04 -1.26 -4.28 113.70 119.30 1up6 s SER 347 Ca 0.03 2.58 0.00 0.00 0.48 0.00 0.00 55.95 59.04 1up6 s SER 347 Cb -0.12 -2.63 0.00 0.00 0.10 0.00 0.00 66.02 63.37 1up6 s SER 347 CO 0.02 -0.59 0.00 0.00 0.98 0.00 0.00 173.24 173.66 1up6 n GLN 348 N 1.98 3.14 0.00 4.02 6.02 -0.52 -5.03 117.38 126.99 1up6 n GLN 348 Ca 0.05 0.00 0.00 0.00 -0.01 0.00 0.00 57.00 57.04 1up6 n GLN 348 Cb 0.42 -0.60 0.00 0.00 1.02 0.00 0.00 30.24 31.08 1up6 n GLN 348 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 1up6 n GLY 349 N 1.15 -0.15 3.85 1.08 0.00 -1.22 -4.99 105.19 104.90 1up6 n GLY 349 Ca 0.00 -1.60 -0.35 0.00 0.00 0.00 0.00 46.02 44.07 1up6 n GLY 349 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1up6 s LYS 350 N 0.00 3.97 0.33 1.61 1.02 -1.26 -1.73 119.74 123.68 1up6 s LYS 350 Ca 0.00 0.47 -0.08 0.00 0.02 0.00 0.00 55.97 56.39 1up6 s LYS 350 Cb 0.00 -2.93 -0.06 0.00 -0.52 0.00 0.00 37.83 34.32 1up6 s LYS 350 CO 0.00 0.48 0.64 0.20 -0.92 0.00 0.00 175.35 175.75 1up6 s GLY 351 N -1.73 1.94 0.28 -3.33 0.00 -1.26 -4.96 107.32 98.25 1up6 s GLY 351 Ca 0.38 -0.38 -0.29 0.00 0.00 0.00 0.00 44.72 44.43 1up6 s GLY 351 CO 0.19 -0.23 0.98 -0.35 0.00 0.00 0.00 173.10 173.69 1up6 s ASP 352 N -3.07 7.45 0.22 1.64 -1.08 -1.26 -4.92 116.67 115.64 1up6 s ASP 352 Ca 0.47 2.00 -0.09 0.00 -0.52 0.00 0.00 52.55 54.42 1up6 s ASP 352 Cb -0.11 -2.61 0.31 0.00 -1.46 0.00 0.00 42.92 39.06 1up6 s ASP 352 CO 0.29 0.01 1.74 0.45 0.52 0.00 0.00 175.17 178.18 1up6 h HIS 353 N 3.77 0.40 -0.48 -5.34 3.86 -1.98 -0.71 115.15 114.66 1up6 h HIS 353 Ca -0.46 0.03 0.07 0.00 -1.16 0.00 0.00 60.37 58.85 1up6 h HIS 353 Cb 1.20 -0.08 -0.06 0.00 1.06 0.00 0.00 27.41 29.53 1up6 h HIS 353 CO 0.60 0.08 0.14 0.35 0.86 0.00 0.00 177.93 179.97 1up6 h PHE 354 N 0.40 0.25 -0.64 2.45 3.04 -1.98 -1.88 116.94 118.57 1up6 h PHE 354 Ca 0.33 0.03 -0.09 0.00 3.98 0.00 0.00 57.97 62.22 1up6 h PHE 354 Cb 0.43 -0.04 -0.02 0.00 2.56 0.00 0.00 35.95 38.88 1up6 h PHE 354 CO -0.18 0.06 0.06 0.00 -2.02 0.00 0.00 178.31 176.24 1up6 h ALA 355 N 1.34 0.86 -0.11 2.41 0.00 -1.71 -3.12 119.26 118.92 1up6 h ALA 355 Ca 0.23 -0.29 -0.05 0.00 0.00 0.00 0.00 54.91 54.80 1up6 h ALA 355 Cb 0.27 -0.24 -0.01 0.00 0.00 0.00 0.00 17.79 17.81 1up6 h ALA 355 CO -0.26 0.66 -0.17 -0.07 0.00 0.00 0.00 179.25 179.40 1up6 h LEU 356 N 1.01 0.17 -0.63 0.00 4.07 -0.70 -2.36 115.31 116.86 1up6 h LEU 356 Ca 0.19 -0.04 -0.07 0.00 0.08 0.00 0.00 57.88 58.04 1up6 h LEU 356 Cb 0.49 -0.05 -0.03 0.00 1.08 0.00 0.00 40.66 42.16 1up6 h LEU 356 CO 0.02 0.36 0.13 0.77 -1.08 0.00 0.00 178.44 178.64 1up6 h SER 357 N 0.17 0.98 0.02 -0.43 4.64 -1.29 -0.61 113.55 117.03 1up6 h SER 357 Ca 0.03 -0.25 -0.00 0.00 -0.47 0.00 0.00 61.79 61.11 1up6 h SER 357 Cb 0.41 -0.26 0.00 0.00 -0.31 0.00 0.00 62.40 62.24 1up6 h SER 357 CO 0.03 0.98 -0.01 -0.26 -0.87 0.00 0.00 176.83 176.69 1up6 h PHE 358 N 0.94 -0.02 -0.51 4.77 0.04 -1.59 -2.71 116.94 117.86 1up6 h PHE 358 Ca 0.20 -0.00 -0.00 0.00 2.80 0.00 0.00 57.97 60.96 1up6 h PHE 358 Cb 0.40 0.01 -0.02 0.00 2.20 0.00 0.00 35.95 38.53 1up6 h PHE 358 CO 0.03 0.17 0.31 0.82 -0.60 0.00 0.00 178.31 179.04 1up6 h ILE 359 N -0.21 1.15 -0.02 -0.55 2.04 -1.24 -1.87 117.51 116.81 1up6 h ILE 359 Ca -0.00 -0.34 -0.00 0.00 1.00 0.00 0.00 64.86 65.52 1up6 h ILE 359 Cb 0.20 0.46 -0.00 0.00 -0.74 0.00 0.00 36.82 36.74 1up6 h ILE 359 CO 0.00 0.15 0.01 0.45 0.00 0.00 0.00 178.15 178.77 1up6 h HIS 360 N 0.68 0.03 -0.03 1.37 3.86 -1.16 -1.30 115.15 118.59 1up6 h HIS 360 Ca 0.18 -0.00 0.02 0.00 -1.16 0.00 0.00 60.37 59.41 1up6 h HIS 360 Cb -0.02 -0.01 -0.02 0.00 1.06 0.00 0.00 27.41 28.42 1up6 h HIS 360 CO -0.03 0.14 -0.08 0.00 0.86 0.00 0.00 177.93 178.82 1up6 h ALA 361 N 0.89 -0.06 0.00 2.45 0.00 -1.26 -2.97 119.26 118.31 1up6 h ALA 361 Ca 0.01 0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.93 1up6 h ALA 361 Cb 0.12 0.15 0.00 0.00 0.00 0.00 0.00 17.79 18.06 1up6 h ALA 361 CO -0.00 -0.56 -0.04 -0.24 0.00 0.00 0.00 179.25 178.41 1up6 h VAL 362 N -0.12 0.00 0.00 0.00 3.04 -1.36 -1.53 116.25 116.27 1up6 h VAL 362 Ca 0.04 -0.92 0.00 0.00 -1.01 0.00 0.00 66.70 64.82 1up6 h VAL 362 Cb 0.18 1.90 0.00 0.00 -2.01 0.00 0.00 31.29 31.36 1up6 h VAL 362 CO -0.11 0.00 0.00 1.17 -1.01 0.00 0.00 177.57 177.62 1up6 n LYS 363 N -2.95 0.31 0.00 4.17 3.00 -0.49 -0.44 118.16 121.76 1up6 n LYS 363 Ca 0.04 0.00 0.00 0.00 -0.00 0.00 0.00 58.31 58.35 1up6 n LYS 363 Cb 0.51 -1.19 0.00 0.00 0.00 0.00 0.00 35.03 34.35 1up6 n LYS 363 CO 0.00 0.00 0.00 0.98 0.00 0.00 0.00 177.40 178.38 1up6 n TYR 365 N 0.44 0.00 0.07 5.64 9.36 -0.58 -1.80 117.16 130.30 1up6 n TYR 365 Ca 0.00 0.00 -0.05 0.00 3.32 0.00 0.00 57.90 61.17 1up6 n TYR 365 Cb 0.09 0.00 0.14 0.00 -0.63 0.00 0.00 39.34 38.95 1up6 n TYR 365 CO 0.00 0.00 0.00 1.05 0.22 0.00 0.00 176.86 178.13 1up6 h GLU 366 N 0.00 0.31 -0.27 2.98 4.11 -1.03 -1.13 114.58 119.55 1up6 h GLU 366 Ca 0.00 -0.18 -0.13 0.00 0.07 0.00 0.00 59.36 59.11 1up6 h GLU 366 Cb 0.00 0.02 -0.01 0.00 0.50 0.00 0.00 28.75 29.26 1up6 h GLU 366 CO 0.00 0.75 -0.38 0.00 0.07 0.00 0.00 179.01 179.45 1up6 h ARG 367 N 0.24 0.63 -0.78 1.06 2.47 -1.62 -1.99 114.38 114.39 1up6 h ARG 367 Ca 0.01 -0.31 -0.04 0.00 -1.26 0.00 0.00 59.98 58.37 1up6 h ARG 367 Cb 1.00 0.00 -0.03 0.00 -1.65 0.00 0.00 29.97 29.28 1up6 h ARG 367 CO 0.08 0.91 0.32 -0.07 0.56 0.00 0.00 179.97 181.78 1up6 h LEU 368 N 0.52 1.06 -0.34 3.04 3.38 -1.71 -0.73 115.31 120.53 1up6 h LEU 368 Ca 0.05 -0.15 -0.03 0.00 0.09 0.00 0.00 57.88 57.83 1up6 h LEU 368 Cb 0.90 -0.27 -0.01 0.00 0.09 0.00 0.00 40.66 41.36 1up6 h LEU 368 CO 0.08 0.93 0.10 0.74 0.09 0.00 0.00 178.44 180.37 1up6 h THR 369 N 1.13 1.21 -0.27 0.22 2.02 -1.07 -1.77 112.91 114.37 1up6 h THR 369 Ca 0.26 -0.71 0.02 0.00 0.77 0.00 0.00 66.41 66.76 1up6 h THR 369 Cb 0.19 1.03 -0.02 0.00 -1.74 0.00 0.00 68.15 67.61 1up6 h THR 369 CO -0.02 0.24 0.12 0.40 0.37 0.00 0.00 175.52 176.63 1up6 h ILE 370 N 0.40 0.97 -0.90 3.11 2.04 -1.16 -1.47 117.51 120.50 1up6 h ILE 370 Ca 0.11 -0.09 0.03 0.00 1.00 0.00 0.00 64.86 65.91 1up6 h ILE 370 Cb 0.27 0.68 -0.05 0.00 -0.74 0.00 0.00 36.82 36.98 1up6 h ILE 370 CO -0.00 0.05 0.59 -0.33 0.00 0.00 0.00 178.15 178.45 1up6 h GLU 371 N 0.26 1.11 -0.36 2.37 5.08 -1.02 0.39 114.58 122.41 1up6 h GLU 371 Ca 0.12 -0.07 -0.05 0.00 -1.00 0.00 0.00 59.36 58.36 1up6 h GLU 371 Cb 0.05 -0.25 -0.01 0.00 0.50 0.00 0.00 28.75 29.04 1up6 h GLU 371 CO -0.09 0.74 0.04 0.00 -1.00 0.00 0.00 179.01 178.70 1up6 h ALA 372 N 1.37 0.48 -0.35 3.43 0.00 -1.03 -1.65 119.26 121.51 1up6 h ALA 372 Ca 0.36 -0.22 0.05 0.00 0.00 0.00 0.00 54.91 55.10 1up6 h ALA 372 Cb -0.01 -0.14 -0.04 0.00 0.00 0.00 0.00 17.79 17.60 1up6 h ALA 372 CO -0.11 0.20 0.08 -0.92 0.00 0.00 0.00 179.25 178.50 1up6 h TYR 373 N 0.44 0.14 -0.54 0.00 3.20 -0.90 -0.94 116.97 118.38 1up6 h TYR 373 Ca 0.11 0.02 -0.06 0.00 3.14 0.00 0.00 58.73 61.94 1up6 h TYR 373 Cb 0.39 -0.01 -0.02 0.00 1.54 0.00 0.00 36.73 38.62 1up6 h TYR 373 CO 0.03 0.04 0.08 -0.07 -1.64 0.00 0.00 178.16 176.60 1up6 h LEU 374 N 0.21 0.80 -2.39 2.82 3.38 -0.55 -1.82 115.31 117.77 1up6 h LEU 374 Ca 0.17 -0.17 0.00 0.00 0.09 0.00 0.00 57.88 57.97 1up6 h LEU 374 Cb 0.18 -0.21 0.00 0.00 0.09 0.00 0.00 40.66 40.72 1up6 h LEU 374 CO -0.21 0.82 0.00 0.29 0.09 0.00 0.00 178.44 179.43 1up6 n LYS 375 N -4.25 2.86 -4.35 1.13 5.02 -0.65 -4.96 118.16 112.96 1up6 n LYS 375 Ca 0.03 -2.20 -0.35 0.00 -2.02 0.00 0.00 58.31 53.78 1up6 n LYS 375 Cb 0.26 -1.65 -0.08 0.00 -0.02 0.00 0.00 35.03 33.54 1up6 n LYS 375 CO 0.00 0.00 0.00 0.54 -0.52 0.00 0.00 177.40 177.42 1up6 n ARG 376 N 0.98 -1.21 -4.02 1.97 5.12 -0.48 -4.91 116.66 114.10 1up6 n ARG 376 Ca 0.20 0.15 -0.34 0.00 -1.93 0.00 0.00 57.85 55.93 1up6 n ARG 376 Cb 0.64 -4.11 -0.15 0.00 -1.16 0.00 0.00 32.46 27.68 1up6 n ARG 376 CO 0.00 0.00 0.00 0.45 -1.93 0.00 0.00 177.63 176.15 1up6 s SER 377 N -3.96 3.84 0.15 0.55 0.15 -0.49 -0.09 113.70 113.84 1up6 s SER 377 Ca 0.31 -0.49 -0.17 0.00 0.70 0.00 0.00 55.95 56.30 1up6 s SER 377 Cb -0.18 -1.63 0.04 0.00 -1.71 0.00 0.00 66.02 62.54 1up6 s SER 377 CO 1.00 -0.01 1.72 0.11 1.20 0.00 0.00 173.24 177.26 1up6 h LYS 378 N 7.99 0.13 -0.73 5.44 1.57 -1.85 0.12 116.57 129.24 1up6 h LYS 378 Ca -0.43 -0.01 0.06 0.00 -1.87 0.00 0.00 60.65 58.41 1up6 h LYS 378 Cb 1.15 -0.03 -0.06 0.00 0.08 0.00 0.00 32.23 33.38 1up6 h LYS 378 CO 0.62 0.08 0.42 0.87 -0.57 0.00 0.00 179.45 180.87 1up6 h LYS 379 N 0.13 0.76 0.00 3.15 1.57 -1.94 -0.47 116.57 119.76 1up6 h LYS 379 Ca 0.15 -0.05 -0.13 0.00 -1.87 0.00 0.00 60.65 58.75 1up6 h LYS 379 Cb 0.18 -0.17 -0.02 0.00 0.08 0.00 0.00 32.23 32.30 1up6 h LYS 379 CO -0.22 0.50 -0.64 -0.07 -0.57 0.00 0.00 179.45 178.45 1up6 h LEU 380 N 0.78 0.00 -0.65 2.94 3.38 -1.89 -2.74 115.31 117.14 1up6 h LEU 380 Ca 0.32 0.00 -0.07 0.00 0.09 0.00 0.00 57.88 58.22 1up6 h LEU 380 Cb 0.18 0.00 -0.03 0.00 0.09 0.00 0.00 40.66 40.91 1up6 h LEU 380 CO -0.18 0.64 0.13 0.00 0.09 0.00 0.00 178.44 179.12 1up6 h ALA 381 N 1.36 0.85 -0.78 1.53 0.00 0.39 -1.40 119.26 121.22 1up6 h ALA 381 Ca -0.01 -0.25 0.09 0.00 0.00 0.00 0.00 54.91 54.74 1up6 h ALA 381 Cb 1.24 -0.25 -0.07 0.00 0.00 0.00 0.00 17.79 18.72 1up6 h ALA 381 CO 0.08 0.59 0.43 1.25 0.00 0.00 0.00 179.25 181.61 1up6 h LEU 382 N 0.97 0.62 -0.07 0.00 5.85 -1.03 0.29 115.31 121.94 1up6 h LEU 382 Ca 0.20 0.05 -0.00 0.00 0.84 0.00 0.00 57.88 58.96 1up6 h LEU 382 Cb 0.40 -0.07 -0.00 0.00 0.37 0.00 0.00 40.66 41.35 1up6 h LEU 382 CO 0.01 0.36 0.03 0.50 -0.34 0.00 0.00 178.44 179.00 1up6 h LYS 383 N 0.74 0.10 -0.40 1.25 3.64 -1.15 -0.70 116.57 120.06 1up6 h LYS 383 Ca 0.37 -0.01 0.04 0.00 -1.27 0.00 0.00 60.65 59.77 1up6 h LYS 383 Cb 0.33 -0.02 -0.04 0.00 -0.41 0.00 0.00 32.23 32.09 1up6 h LYS 383 CO -0.24 0.19 0.18 0.00 -2.27 0.00 0.00 179.45 177.32 1up6 h ALA 384 N 0.90 0.49 -0.80 5.00 0.00 -0.99 -2.56 119.26 121.30 1up6 h ALA 384 Ca 0.02 0.02 0.01 0.00 0.00 0.00 0.00 54.91 54.96 1up6 h ALA 384 Cb 0.13 -0.04 -0.04 0.00 0.00 0.00 0.00 17.79 17.84 1up6 h ALA 384 CO -0.00 -0.18 0.52 1.25 0.00 0.00 0.00 179.25 180.83 1up6 h LEU 385 N 0.38 0.92 -1.51 0.00 5.85 -0.56 -1.81 115.31 118.59 1up6 h LEU 385 Ca 0.17 -0.03 0.00 0.00 0.84 0.00 0.00 57.88 58.86 1up6 h LEU 385 Cb 0.10 -0.23 0.00 0.00 0.37 0.00 0.00 40.66 40.90 1up6 h LEU 385 CO -0.14 0.68 0.00 -0.07 -0.34 0.00 0.00 178.44 178.57 1up6 h LEU 386 N 1.08 0.00 0.00 2.25 3.38 -0.84 -3.10 115.31 118.08 1up6 h LEU 386 Ca 0.29 0.00 -0.11 0.00 0.09 0.00 0.00 57.88 58.15 1up6 h LEU 386 Cb -0.11 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 40.62 1up6 h LEU 386 CO -0.06 0.00 -0.86 0.77 0.09 0.00 0.00 178.44 178.38 1up6 h SER 387 N 0.00 0.00 -2.94 -0.43 4.64 -0.93 -3.46 113.55 110.42 1up6 h SER 387 Ca 0.00 0.00 -0.53 0.00 -0.47 0.00 0.00 61.79 60.79 1up6 h SER 387 Cb 0.49 0.00 0.05 0.00 -0.31 0.00 0.00 62.40 62.62 1up6 h SER 387 CO 0.00 0.45 0.85 -2.28 -0.87 0.00 0.00 176.83 174.98 1up6 s HIS 388 N -3.00 3.06 0.29 4.77 5.65 -1.16 -4.81 115.29 120.08 1up6 s HIS 388 Ca 0.01 0.72 0.32 0.00 0.25 0.00 0.00 55.06 56.36 1up6 s HIS 388 Cb 0.08 -3.90 1.76 0.00 -1.18 0.00 0.00 32.58 29.34 1up6 s HIS 388 CO 0.77 -3.23 1.98 -1.35 -0.65 0.00 0.00 174.74 172.26 1up6 h PRO 389 N 6.45 0.00 -0.18 2.88 0.11 -1.90 0.10 132.00 139.46 1up6 h PRO 389 Ca -0.43 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.68 1up6 h PRO 389 Cb 1.21 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.32 1up6 h PRO 389 CO 0.88 0.00 0.00 1.28 -0.21 0.00 0.00 178.00 179.95 1up6 n LEU 390 N -2.67 3.13 -4.94 2.35 4.77 -1.26 -5.05 117.00 113.32 1up6 n LEU 390 Ca -0.02 -2.78 -0.29 0.00 -0.03 0.00 0.00 56.01 52.88 1up6 n LEU 390 Cb 0.10 -0.41 0.19 0.00 -2.33 0.00 0.00 43.42 40.97 1up6 n LEU 390 CO 0.14 0.68 0.85 -0.83 -1.33 0.00 0.00 177.39 176.90 1up6 s GLY 391 N -1.96 1.80 0.81 -0.72 0.00 0.02 -4.56 107.32 102.71 1up6 s GLY 391 Ca 0.32 -1.36 -0.11 0.00 0.00 0.00 0.00 44.72 43.57 1up6 s GLY 391 CO 0.07 -0.57 1.10 2.56 0.00 0.00 0.00 173.10 176.26 1up6 s PRO 392 N -5.85 1.99 0.67 2.90 0.04 -1.26 -4.99 135.00 128.50 1up6 s PRO 392 Ca 0.75 0.68 -0.11 0.00 0.04 0.00 0.00 61.00 62.36 1up6 s PRO 392 Cb -0.03 -1.90 -0.01 0.00 0.04 0.00 0.00 34.50 32.60 1up6 s PRO 392 CO 0.53 -1.69 1.05 -0.51 0.04 0.00 0.00 177.00 176.41 1up6 s ASP 393 N -3.83 5.73 0.28 6.66 1.11 -1.26 -4.78 116.67 120.58 1up6 s ASP 393 Ca 0.61 1.50 -0.01 0.00 0.18 0.00 0.00 52.55 54.83 1up6 s ASP 393 Cb -0.15 -2.45 0.63 0.00 1.07 0.00 0.00 42.92 42.02 1up6 s ASP 393 CO 0.55 -1.20 1.64 0.58 1.18 0.00 0.00 175.17 177.92 1up6 h VAL 394 N -0.55 0.32 0.00 -1.27 2.07 -1.97 -0.94 116.25 113.91 1up6 h VAL 394 Ca -0.44 -0.06 0.00 0.00 0.82 0.00 0.00 66.70 67.02 1up6 h VAL 394 Cb 1.20 0.12 0.00 0.00 -1.52 0.00 0.00 31.29 31.10 1up6 h VAL 394 CO 0.59 0.03 0.00 -1.84 0.02 0.00 0.00 177.57 176.38 1up6 n GLU 395 N -5.27 0.06 0.00 1.57 0.28 -1.26 -2.63 120.64 113.39 1up6 n GLU 395 Ca 0.19 0.50 0.00 0.00 -0.16 0.00 0.00 57.16 57.69 1up6 n GLU 395 Cb 0.62 -1.66 0.00 0.00 1.43 0.00 0.00 31.44 31.83 1up6 n GLU 395 CO 0.00 0.00 0.00 -0.25 -0.16 0.00 0.00 177.13 176.72 1up6 n ASP 396 N -1.78 0.18 0.08 -1.84 8.00 -0.38 -4.86 116.55 115.95 1up6 n ASP 396 Ca 0.00 -0.57 -0.13 0.00 0.71 0.00 0.00 54.79 54.80 1up6 n ASP 396 Cb 0.05 0.74 -0.08 0.00 -0.02 0.00 0.00 41.12 41.81 1up6 n ASP 396 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1up6 h ALA 397 N 0.00 -0.14 -0.14 2.24 0.00 -1.24 -1.67 119.26 118.31 1up6 h ALA 397 Ca 0.00 -0.08 0.01 0.00 0.00 0.00 0.00 54.91 54.84 1up6 h ALA 397 Cb 0.01 0.05 -0.01 0.00 0.00 0.00 0.00 17.79 17.84 1up6 h ALA 397 CO 0.00 -0.53 0.05 0.87 0.00 0.00 0.00 179.25 179.65 1up6 h LYS 398 N -0.24 0.12 -0.68 0.00 1.57 -1.89 -0.68 116.57 114.78 1up6 h LYS 398 Ca -0.01 -0.01 -0.01 0.00 -1.87 0.00 0.00 60.65 58.75 1up6 h LYS 398 Cb 0.20 -0.03 -0.03 0.00 0.08 0.00 0.00 32.23 32.45 1up6 h LYS 398 CO 0.02 0.08 0.39 -0.44 -0.57 0.00 0.00 179.45 178.93 1up6 h ASP 399 N 0.13 0.83 -0.17 0.86 5.19 -1.90 -2.12 116.42 119.23 1up6 h ASP 399 Ca 0.06 -0.08 -0.04 0.00 -0.62 0.00 0.00 57.03 56.35 1up6 h ASP 399 Cb 0.02 -0.21 -0.01 0.00 0.18 0.00 0.00 39.33 39.32 1up6 h ASP 399 CO -0.05 0.67 -0.04 0.25 -3.12 0.00 0.00 179.24 176.95 1up6 h LEU 400 N 0.92 0.33 -0.53 1.55 5.85 -0.92 -2.51 115.31 120.00 1up6 h LEU 400 Ca 0.24 -0.36 0.01 0.00 0.84 0.00 0.00 57.88 58.61 1up6 h LEU 400 Cb 0.01 -0.09 -0.03 0.00 0.37 0.00 0.00 40.66 40.92 1up6 h LEU 400 CO -0.04 0.62 0.34 0.25 -0.34 0.00 0.00 178.44 179.26 1up6 h LEU 401 N 0.04 0.57 -1.12 2.25 5.85 -1.11 -1.70 115.31 120.09 1up6 h LEU 401 Ca 0.04 -0.01 0.09 0.00 0.84 0.00 0.00 57.88 58.85 1up6 h LEU 401 Cb 0.47 -0.13 -0.07 0.00 0.37 0.00 0.00 40.66 41.30 1up6 h LEU 401 CO 0.02 0.41 0.60 -0.33 -0.34 0.00 0.00 178.44 178.80 1up6 h GLU 402 N 0.69 0.96 -0.18 1.25 4.39 -1.32 0.83 114.58 121.19 1up6 h GLU 402 Ca 0.20 -0.06 -0.13 0.00 0.34 0.00 0.00 59.36 59.72 1up6 h GLU 402 Cb -0.04 -0.22 0.00 0.00 -0.10 0.00 0.00 28.75 28.40 1up6 h GLU 402 CO -0.07 0.63 -0.40 1.49 -1.16 0.00 0.00 179.01 179.51 1up6 h GLU 403 N 0.99 0.59 -0.15 2.33 4.81 -1.05 -1.69 114.58 120.40 1up6 h GLU 403 Ca 0.43 -0.39 0.04 0.00 -0.13 0.00 0.00 59.36 59.31 1up6 h GLU 403 Cb 0.34 0.05 -0.04 0.00 0.63 0.00 0.00 28.75 29.72 1up6 h GLU 403 CO -0.18 1.01 -0.12 0.82 -0.73 0.00 0.00 179.01 179.80 1up6 h ILE 404 N 0.25 0.65 -0.39 2.32 2.04 -0.75 -1.91 117.51 119.72 1up6 h ILE 404 Ca 0.00 0.00 -0.07 0.00 1.00 0.00 0.00 64.86 65.79 1up6 h ILE 404 Cb 1.00 0.65 -0.02 0.00 -0.74 0.00 0.00 36.82 37.71 1up6 h ILE 404 CO 0.09 0.00 -0.07 -0.07 0.00 0.00 0.00 178.15 178.10 1up6 h LEU 405 N -0.14 0.64 -0.64 1.44 3.38 -0.83 -1.72 115.31 117.45 1up6 h LEU 405 Ca 0.10 -0.16 -0.06 0.00 0.09 0.00 0.00 57.88 57.84 1up6 h LEU 405 Cb 0.28 -0.17 -0.03 0.00 0.09 0.00 0.00 40.66 40.83 1up6 h LEU 405 CO -0.24 0.75 0.15 -0.08 0.09 0.00 0.00 178.44 179.12 1up6 h GLU 406 N 0.61 1.03 0.00 1.13 4.57 -1.16 -2.21 114.58 118.55 1up6 h GLU 406 Ca 0.12 -0.25 -0.12 0.00 -1.18 0.00 0.00 59.36 57.93 1up6 h GLU 406 Cb 0.49 -0.13 -0.02 0.00 -0.16 0.00 0.00 28.75 28.92 1up6 h GLU 406 CO 0.03 0.93 -0.55 0.00 -1.18 0.00 0.00 179.01 178.23 1up6 h ALA 407 N 1.05 1.00 -0.49 2.92 0.00 -0.74 -3.21 119.26 119.80 1up6 h ALA 407 Ca 0.20 -0.50 -0.07 0.00 0.00 0.00 0.00 54.91 54.54 1up6 h ALA 407 Cb 0.37 -0.09 -0.04 0.00 0.00 0.00 0.00 17.79 18.03 1up6 h ALA 407 CO 0.00 0.69 0.07 0.09 0.00 0.00 0.00 179.25 180.10 1up6 n ASN 408 N -3.75 4.62 -0.28 0.00 3.02 -0.70 -4.71 115.26 113.45 1up6 n ASN 408 Ca -0.01 -3.10 0.12 0.00 -0.03 0.00 0.00 54.58 51.55 1up6 n ASN 408 Cb 0.58 -0.65 0.23 0.00 -0.61 0.00 0.00 39.78 39.34 1up6 n ASN 408 CO 0.00 0.00 0.00 0.54 -2.62 0.00 0.00 177.26 175.18 1up6 n ARG 409 N -0.12 -0.06 0.25 3.52 1.74 -0.85 -0.61 116.66 120.53 1up6 n ARG 409 Ca 0.29 1.20 0.13 0.00 -0.77 0.00 0.00 57.85 58.71 1up6 n ARG 409 Cb 1.13 -1.91 0.64 0.00 -1.02 0.00 0.00 32.46 31.30 1up6 n ARG 409 CO 0.00 0.00 0.00 0.93 -1.52 0.00 0.00 177.63 177.04 1up6 h GLU 410 N 0.00 0.00 0.00 5.56 5.08 -1.90 -3.37 114.58 119.96 1up6 h GLU 410 Ca 0.48 0.00 -0.10 0.00 -1.00 0.00 0.00 59.36 58.74 1up6 h GLU 410 Cb 0.99 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 30.23 1up6 h GLU 410 CO -0.76 0.14 -1.38 0.66 -1.00 0.00 0.00 179.01 176.66 1up6 n TYR 411 N -3.41 0.00 -4.08 4.33 4.01 0.21 -5.01 117.16 113.21 1up6 n TYR 411 Ca -0.01 0.00 -0.15 0.00 -0.16 0.00 0.00 57.90 57.58 1up6 n TYR 411 Cb 0.32 -0.27 -0.15 0.00 -0.31 0.00 0.00 39.34 38.93 1up6 n TYR 411 CO 0.00 0.00 0.00 0.14 -0.46 0.00 0.00 176.86 176.54 1up6 s VAL 412 N -2.14 0.31 -0.14 -0.72 -7.23 -0.37 -4.82 120.40 105.28 1up6 s VAL 412 Ca -0.06 -0.14 0.00 0.00 -1.81 0.00 0.00 61.98 59.97 1up6 s VAL 412 Cb 0.02 -0.28 0.03 0.00 0.56 0.00 0.00 36.38 36.70 1up6 s VAL 412 CO 0.19 0.10 -0.11 -0.75 -0.31 0.00 0.00 175.10 174.22 1up6 s LYS 413 N 0.07 1.98 0.05 4.82 2.20 -1.26 -4.41 119.74 123.20 1up6 s LYS 413 Ca -0.00 -0.49 0.06 0.00 -0.36 0.00 0.00 55.97 55.17 1up6 s LYS 413 Cb -0.03 -1.98 -0.04 0.00 -1.51 0.00 0.00 37.83 34.27 1up6 s LYS 413 CO -0.00 -0.28 -0.12 -0.51 -0.36 0.00 0.00 175.35 174.08 1up6 s LEU 414 N 1.55 2.91 0.00 5.43 1.02 -1.26 -4.89 118.68 123.44 1up6 s LEU 414 Ca 0.04 -0.34 0.00 0.00 0.02 0.00 0.00 54.13 53.85 1up6 s LEU 414 Cb -0.13 -1.71 0.00 0.00 0.02 0.00 0.00 46.19 44.37 1up6 s LEU 414 CO -0.10 0.23 0.24 0.61 0.02 0.00 0.00 176.35 177.36