#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 4.82 0.11 8.89 1.01 -1.00 -3.66 121.20 131.37 1up6 s ILE 3 Ca 0.00 -0.32 -0.15 0.00 0.00 0.00 0.00 60.65 60.19 1up6 s ILE 3 Cb 0.00 -3.44 -0.07 0.00 0.01 0.00 0.00 42.46 38.96 1up6 s ILE 3 CO 0.00 0.07 0.52 0.00 0.00 0.00 0.00 174.94 175.53 1up6 s ALA 4 N 1.65 3.61 -0.20 9.38 0.00 -0.06 -1.96 121.76 134.19 1up6 s ALA 4 Ca 0.05 -0.14 0.01 0.00 0.00 0.00 0.00 51.96 51.88 1up6 s ALA 4 Cb -0.17 -2.49 0.04 0.00 0.00 0.00 0.00 23.12 20.49 1up6 s ALA 4 CO 0.08 0.46 -0.13 0.08 0.00 0.00 0.00 175.76 176.25 1up6 s VAL 5 N -1.35 1.78 -0.41 0.00 1.01 -0.28 -0.05 120.40 121.10 1up6 s VAL 5 Ca 0.34 -1.04 -0.12 0.00 0.00 0.00 0.00 61.98 61.15 1up6 s VAL 5 Cb -0.16 -1.79 0.05 0.00 0.00 0.00 0.00 36.38 34.47 1up6 s VAL 5 CO 0.18 0.24 0.28 -0.63 0.00 0.00 0.00 175.10 175.17 1up6 s ILE 6 N 1.35 4.79 0.00 2.22 -1.09 0.53 -1.11 121.20 127.88 1up6 s ILE 6 Ca -0.00 -0.98 0.00 0.00 -2.23 0.00 0.00 60.65 57.43 1up6 s ILE 6 Cb -0.16 -3.77 0.00 0.00 -1.58 0.00 0.00 42.46 36.95 1up6 s ILE 6 CO -0.09 -0.39 0.00 0.61 -1.23 0.00 0.00 174.94 173.84 1up6 n GLY 7 N 5.06 0.94 0.29 6.18 0.00 0.22 -1.21 105.19 116.67 1up6 n GLY 7 Ca -0.11 0.00 0.04 0.00 0.00 0.00 0.00 46.02 45.95 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 0.72 1.91 -0.02 0.00 -0.45 0.41 103.07 105.65 1up6 h GLY 8 Ca 0.00 0.19 0.00 0.00 0.00 0.00 0.00 47.33 47.52 1up6 h GLY 8 CO 0.00 -0.31 0.00 0.61 0.00 0.00 0.00 176.54 176.84 1up6 n GLY 9 N -1.47 -0.47 3.46 4.60 0.00 -1.26 -4.74 105.19 105.31 1up6 n GLY 9 Ca 0.13 -0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.78 1up6 n GLY 9 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 1up6 n SER 10 N -1.45 -1.20 0.09 1.61 2.88 0.13 -4.76 113.62 110.91 1up6 n SER 10 Ca 0.00 0.63 0.13 0.00 -1.33 0.00 0.00 58.87 58.30 1up6 n SER 10 Cb 0.00 -1.20 0.44 0.00 -0.75 0.00 0.00 64.21 62.71 1up6 n SER 10 CO 0.00 0.00 0.00 -1.54 -1.23 0.00 0.00 175.04 172.27 1up6 n SER 11 N 0.00 0.67 0.05 -3.46 3.41 -1.26 -3.12 113.62 109.91 1up6 n SER 11 Ca 0.10 0.57 0.12 0.00 -0.26 0.00 0.00 58.87 59.41 1up6 n SER 11 Cb 0.49 -0.75 0.30 0.00 -0.26 0.00 0.00 64.21 63.99 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 -2.13 0.44 -0.29 7.33 4.01 -1.26 -4.47 117.16 120.79 1up6 n TYR 12 Ca 0.06 0.13 0.08 0.00 -0.16 0.00 0.00 57.90 58.01 1up6 n TYR 12 Cb 0.40 -0.61 0.20 0.00 -0.31 0.00 0.00 39.34 39.03 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 0.23 -0.49 -0.72 2.02 -1.83 -0.07 112.91 112.04 1up6 h THR 13 Ca 0.00 -0.03 0.09 0.00 0.77 0.00 0.00 66.41 67.24 1up6 h THR 13 Cb 0.66 0.14 -0.07 0.00 -1.74 0.00 0.00 68.15 67.14 1up6 h THR 13 CO 0.00 0.01 0.06 -0.65 0.37 0.00 0.00 175.52 175.31 1up6 h PRO 14 N 0.08 0.18 -0.95 6.66 0.11 -1.85 0.03 132.00 136.25 1up6 h PRO 14 Ca 0.48 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 66.58 1up6 h PRO 14 Cb 0.89 -0.04 -0.05 0.00 0.11 0.00 0.00 31.00 31.91 1up6 h PRO 14 CO -0.76 0.12 0.60 0.93 -0.21 0.00 0.00 178.00 178.67 1up6 h GLU 15 N 0.18 1.27 0.54 1.05 5.08 -1.33 0.22 114.58 121.59 1up6 h GLU 15 Ca 0.25 -0.10 -0.02 0.00 -1.00 0.00 0.00 59.36 58.49 1up6 h GLU 15 Cb 0.35 -0.28 -0.01 0.00 0.50 0.00 0.00 28.75 29.31 1up6 h GLU 15 CO -0.36 0.86 -0.41 1.25 -1.00 0.00 0.00 179.01 179.36 1up6 h LEU 16 N 1.30 -1.07 -0.67 1.33 5.85 -0.84 -1.79 115.31 119.41 1up6 h LEU 16 Ca 0.34 0.07 0.14 0.00 0.84 0.00 0.00 57.88 59.28 1up6 h LEU 16 Cb -0.10 0.33 -0.12 0.00 0.37 0.00 0.00 40.66 41.14 1up6 h LEU 16 CO -0.07 -0.58 -0.04 0.58 -0.34 0.00 0.00 178.44 177.99 1up6 h VAL 17 N -0.91 0.40 -0.16 1.05 2.07 -0.66 0.41 116.25 118.45 1up6 h VAL 17 Ca -0.07 -0.03 0.05 0.00 0.82 0.00 0.00 66.70 67.47 1up6 h VAL 17 Cb 0.75 0.31 -0.07 0.00 -1.52 0.00 0.00 31.29 30.77 1up6 h VAL 17 CO 0.02 0.01 -0.38 0.50 0.02 0.00 0.00 177.57 177.75 1up6 h LYS 18 N 0.08 -0.42 -0.43 1.57 3.64 -0.24 0.24 116.57 121.01 1up6 h LYS 18 Ca 0.35 0.03 0.08 0.00 -1.27 0.00 0.00 60.65 59.84 1up6 h LYS 18 Cb 0.58 0.09 -0.08 0.00 -0.41 0.00 0.00 32.23 32.42 1up6 h LYS 18 CO -0.61 -0.28 -0.04 0.78 -2.27 0.00 0.00 179.45 177.03 1up6 h GLY 19 N -0.43 0.39 0.74 5.01 0.00 0.53 0.40 103.07 109.71 1up6 h GLY 19 Ca 0.09 0.09 0.12 0.00 0.00 0.00 0.00 47.33 47.63 1up6 h GLY 19 CO -0.40 -0.13 0.53 1.41 0.00 0.00 0.00 176.54 177.94 1up6 h LEU 20 N 0.07 0.61 -0.34 3.11 3.38 0.41 -0.82 115.31 121.72 1up6 h LEU 20 Ca 0.21 0.02 -0.06 0.00 0.09 0.00 0.00 57.88 58.14 1up6 h LEU 20 Cb 0.32 -0.10 -0.01 0.00 0.09 0.00 0.00 40.66 40.96 1up6 h LEU 20 CO -0.39 0.35 -0.03 -0.07 0.09 0.00 0.00 178.44 178.38 1up6 h LEU 21 N 0.67 0.62 -1.72 1.67 3.38 0.31 -3.09 115.31 117.15 1up6 h LEU 21 Ca 0.39 -0.33 -0.03 0.00 0.09 0.00 0.00 57.88 58.00 1up6 h LEU 21 Cb 0.58 -0.17 -0.00 0.00 0.09 0.00 0.00 40.66 41.15 1up6 h LEU 21 CO -0.15 0.81 -0.14 0.44 0.09 0.00 0.00 178.44 179.49 1up6 h ASP 22 N 0.43 0.00 -0.06 -0.43 3.32 0.35 -0.51 116.42 119.52 1up6 h ASP 22 Ca 0.09 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.14 1up6 h ASP 22 Cb 0.51 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.06 1up6 h ASP 22 CO 0.02 0.14 0.00 2.30 -1.72 0.00 0.00 179.24 179.98 1up6 n ILE 23 N -3.52 0.07 0.25 0.35 -5.35 -0.89 -4.29 119.36 105.98 1up6 n ILE 23 Ca -0.01 -0.25 0.12 0.00 -0.27 0.00 0.00 62.75 62.34 1up6 n ILE 23 Cb 0.29 0.33 0.61 0.00 -1.74 0.00 0.00 39.64 39.13 1up6 n ILE 23 CO 0.00 0.00 0.00 0.28 -1.76 0.00 0.00 176.55 175.07 1up6 h SER 24 N 1.98 0.00 0.35 7.28 0.02 -1.00 -2.31 113.55 119.87 1up6 h SER 24 Ca 0.00 0.00 -0.21 0.00 -0.84 0.00 0.00 61.79 60.74 1up6 h SER 24 Cb 0.42 0.00 -0.00 0.00 0.14 0.00 0.00 62.40 62.96 1up6 h SER 24 CO 0.00 0.16 -0.87 -0.08 -1.14 0.00 0.00 176.83 174.91 1up6 h GLU 25 N 0.00 0.37 0.00 3.45 4.57 -1.76 -3.37 114.58 117.85 1up6 h GLU 25 Ca -0.00 -0.37 -0.25 0.00 -1.18 0.00 0.00 59.36 57.55 1up6 h GLU 25 Cb 0.53 0.10 -0.04 0.00 -0.16 0.00 0.00 28.75 29.17 1up6 h GLU 25 CO 0.02 1.04 -1.67 -0.25 -1.18 0.00 0.00 179.01 176.97 1up6 n ASP 26 N -3.76 0.79 -4.06 1.04 8.00 -1.10 -4.93 116.55 112.54 1up6 n ASP 26 Ca -0.05 0.37 -0.13 0.00 0.71 0.00 0.00 54.79 55.68 1up6 n ASP 26 Cb 0.79 0.12 -0.12 0.00 -0.02 0.00 0.00 41.12 41.90 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 -2.71 0.54 -0.17 2.53 -7.23 -0.89 -5.04 120.40 107.43 1up6 s VAL 27 Ca -0.05 -1.05 -0.29 0.00 -1.81 0.00 0.00 61.98 58.79 1up6 s VAL 27 Cb 0.08 -0.60 -0.00 0.00 0.56 0.00 0.00 36.38 36.42 1up6 s VAL 27 CO 0.82 -0.36 0.99 -0.60 -0.31 0.00 0.00 175.10 175.64 1up6 s ARG 28 N -1.52 4.33 -0.18 4.82 3.52 -1.26 -4.34 118.95 124.32 1up6 s ARG 28 Ca -0.09 1.32 -0.00 0.00 -0.13 0.00 0.00 55.73 56.82 1up6 s ARG 28 Cb -0.10 -3.59 0.01 0.00 -1.56 0.00 0.00 34.95 29.71 1up6 s ARG 28 CO 0.00 -0.45 -0.15 0.42 -0.81 0.00 0.00 175.30 174.31 1up6 s ILE 29 N 2.55 2.57 -0.18 4.11 1.01 -1.26 -4.98 121.20 125.02 1up6 s ILE 29 Ca 0.45 -0.78 -0.20 0.00 0.00 0.00 0.00 60.65 60.12 1up6 s ILE 29 Cb -0.17 -2.10 -0.21 0.00 0.01 0.00 0.00 42.46 39.99 1up6 s ILE 29 CO 0.12 0.50 0.32 0.44 0.00 0.00 0.00 174.94 176.32 1up6 h ASP 30 N 7.74 0.10 -4.99 3.58 3.32 -1.95 -3.45 116.42 120.76 1up6 h ASP 30 Ca -0.40 -0.64 -0.13 0.00 0.02 0.00 0.00 57.03 55.88 1up6 h ASP 30 Cb 1.16 -0.03 -0.20 0.00 0.22 0.00 0.00 39.33 40.48 1up6 h ASP 30 CO 0.60 1.52 -0.35 -1.83 -1.72 0.00 0.00 179.24 177.46 1up6 s GLU 31 N -2.39 0.61 -0.13 3.56 -1.05 -1.26 -1.61 118.70 116.43 1up6 s GLU 31 Ca -0.26 -0.29 0.03 0.00 -0.15 0.00 0.00 54.97 54.29 1up6 s GLU 31 Cb 0.05 0.27 0.01 0.00 -0.44 0.00 0.00 34.13 34.02 1up6 s GLU 31 CO 0.64 -0.16 -0.21 0.08 0.95 0.00 0.00 175.26 176.56 1up6 s VAL 32 N -1.43 1.95 -0.02 1.83 1.01 0.36 -2.37 120.40 121.73 1up6 s VAL 32 Ca -0.13 -0.92 0.07 0.00 0.00 0.00 0.00 61.98 60.99 1up6 s VAL 32 Cb -0.06 -1.73 -0.02 0.00 0.00 0.00 0.00 36.38 34.57 1up6 s VAL 32 CO 0.03 0.53 -0.22 -0.51 0.00 0.00 0.00 175.10 174.93 1up6 s ILE 33 N 0.78 2.40 -0.06 2.22 2.07 -0.83 -1.21 121.20 126.58 1up6 s ILE 33 Ca -0.09 -1.03 0.04 0.00 -1.41 0.00 0.00 60.65 58.16 1up6 s ILE 33 Cb -0.16 -1.89 -0.02 0.00 0.13 0.00 0.00 42.46 40.52 1up6 s ILE 33 CO -0.00 0.55 -0.16 -0.36 -1.91 0.00 0.00 174.94 173.05 1up6 s PHE 34 N -0.69 2.66 0.01 3.50 0.08 0.20 -1.13 117.98 122.62 1up6 s PHE 34 Ca 0.11 -0.26 0.06 0.00 0.12 0.00 0.00 56.93 56.96 1up6 s PHE 34 Cb -0.10 -1.64 -0.02 0.00 -0.57 0.00 0.00 43.02 40.69 1up6 s PHE 34 CO 0.00 0.11 -0.17 -0.47 -0.10 0.00 0.00 175.22 174.59 1up6 s TYR 35 N -0.58 1.53 0.01 0.36 5.04 -0.27 -1.42 117.35 122.01 1up6 s TYR 35 Ca 0.08 -0.32 -0.17 0.00 -2.44 0.00 0.00 57.07 54.23 1up6 s TYR 35 Cb -0.11 -0.95 0.03 0.00 0.35 0.00 0.00 41.96 41.27 1up6 s TYR 35 CO 0.01 0.02 0.36 0.34 -1.34 0.00 0.00 175.55 174.93 1up6 s ASP 36 N -0.73 -0.23 0.46 4.32 -1.08 -1.26 0.71 116.67 118.85 1up6 s ASP 36 Ca 0.06 0.06 0.25 0.00 -0.52 0.00 0.00 52.55 52.40 1up6 s ASP 36 Cb -0.07 0.36 0.59 0.00 -1.46 0.00 0.00 42.92 42.34 1up6 s ASP 36 CO 0.00 -0.54 1.70 0.16 0.52 0.00 0.00 175.17 177.02 1up6 h ILE 37 N 3.49 0.05 -3.59 4.11 3.07 -1.98 -3.39 117.51 119.28 1up6 h ILE 37 Ca -0.30 -0.94 -0.72 0.00 1.55 0.00 0.00 64.86 64.45 1up6 h ILE 37 Cb 1.18 1.89 -0.32 0.00 -0.27 0.00 0.00 36.82 39.30 1up6 h ILE 37 CO 0.42 0.03 -0.25 -0.62 -1.05 0.00 0.00 178.15 176.67 1up6 s ASP 38 N -6.09 5.69 0.35 2.16 -1.08 -1.26 -4.94 116.67 111.50 1up6 s ASP 38 Ca 0.05 -2.68 0.09 0.00 -0.52 0.00 0.00 52.55 49.48 1up6 s ASP 38 Cb 0.06 -1.96 0.66 0.00 -1.46 0.00 0.00 42.92 40.22 1up6 s ASP 38 CO 0.64 -0.46 1.84 -0.33 0.52 0.00 0.00 175.17 177.37 1up6 h GLU 39 N 7.41 0.23 -0.03 4.34 4.39 -2.00 -2.41 114.58 126.50 1up6 h GLU 39 Ca -0.01 -0.07 -0.00 0.00 0.34 0.00 0.00 59.36 59.62 1up6 h GLU 39 Cb 0.99 -0.02 -0.00 0.00 -0.10 0.00 0.00 28.75 29.62 1up6 h GLU 39 CO 0.74 0.46 0.02 1.49 -1.16 0.00 0.00 179.01 180.56 1up6 h GLU 40 N 0.21 0.05 -0.16 2.33 4.81 -1.97 -1.87 114.58 117.98 1up6 h GLU 40 Ca 0.04 -0.01 -0.01 0.00 -0.13 0.00 0.00 59.36 59.25 1up6 h GLU 40 Cb 0.54 -0.01 -0.01 0.00 0.63 0.00 0.00 28.75 29.91 1up6 h GLU 40 CO 0.04 0.12 0.08 -0.22 -0.73 0.00 0.00 179.01 178.30 1up6 h LYS 41 N -0.04 0.23 -0.65 1.92 3.64 -1.91 -3.16 116.57 116.59 1up6 h LYS 41 Ca 0.01 -0.03 0.00 0.00 -1.27 0.00 0.00 60.65 59.36 1up6 h LYS 41 Cb 0.09 -0.04 -0.03 0.00 -0.41 0.00 0.00 32.23 31.84 1up6 h LYS 41 CO -0.00 0.27 0.42 0.37 -2.27 0.00 0.00 179.45 178.24 1up6 h GLN 42 N 0.13 0.86 -0.81 1.90 4.15 -1.44 -2.98 115.11 116.92 1up6 h GLN 42 Ca 0.06 -0.06 0.19 0.00 0.77 0.00 0.00 58.65 59.61 1up6 h GLN 42 Cb 0.12 -0.19 -0.14 0.00 0.21 0.00 0.00 27.48 27.47 1up6 h GLN 42 CO -0.01 0.58 0.00 -0.22 -1.93 0.00 0.00 178.83 177.25 1up6 h LYS 43 N 0.88 0.08 -0.24 1.69 3.64 -1.30 0.24 116.57 121.56 1up6 h LYS 43 Ca 0.24 -0.01 -0.09 0.00 -1.27 0.00 0.00 60.65 59.52 1up6 h LYS 43 Cb -0.08 -0.02 -0.00 0.00 -0.41 0.00 0.00 32.23 31.71 1up6 h LYS 43 CO -0.05 0.06 -0.21 0.82 -2.27 0.00 0.00 179.45 177.80 1up6 h ILE 44 N 0.09 1.32 0.12 2.00 5.03 -1.60 -1.91 117.51 122.55 1up6 h ILE 44 Ca 0.45 -1.36 -0.01 0.00 -0.12 0.00 0.00 64.86 63.83 1up6 h ILE 44 Cb 0.81 1.66 0.00 0.00 -3.03 0.00 0.00 36.82 36.27 1up6 h ILE 44 CO -0.72 0.42 -0.06 0.58 -0.68 0.00 0.00 178.15 177.69 1up6 h VAL 45 N 0.26 0.95 -0.78 1.67 2.07 -1.17 -2.33 116.25 116.93 1up6 h VAL 45 Ca 0.04 -0.27 -0.04 0.00 0.82 0.00 0.00 66.70 67.25 1up6 h VAL 45 Cb 0.75 1.12 -0.04 0.00 -1.52 0.00 0.00 31.29 31.61 1up6 h VAL 45 CO 0.05 0.07 0.34 0.58 0.02 0.00 0.00 177.57 178.63 1up6 h VAL 46 N -0.29 1.25 0.00 2.57 2.07 -0.63 0.64 116.25 121.86 1up6 h VAL 46 Ca -0.02 -0.75 -0.03 0.00 0.82 0.00 0.00 66.70 66.73 1up6 h VAL 46 Cb 0.23 0.29 -0.00 0.00 -1.52 0.00 0.00 31.29 30.29 1up6 h VAL 46 CO 0.03 0.31 -0.14 0.44 0.02 0.00 0.00 177.57 178.23 1up6 h ASP 47 N 1.12 0.00 -0.07 0.57 5.19 -1.27 0.16 116.42 122.12 1up6 h ASP 47 Ca 0.26 0.00 -0.24 0.00 -0.62 0.00 0.00 57.03 56.43 1up6 h ASP 47 Cb 0.16 0.00 0.01 0.00 0.18 0.00 0.00 39.33 39.69 1up6 h ASP 47 CO -0.03 0.14 -0.89 0.15 -3.12 0.00 0.00 179.24 175.49 1up6 h PHE 48 N 0.00 1.05 -0.45 4.55 3.57 -0.60 -3.17 116.94 121.90 1up6 h PHE 48 Ca -0.00 -0.51 0.05 0.00 3.53 0.00 0.00 57.97 61.04 1up6 h PHE 48 Cb 0.28 -0.14 -0.05 0.00 2.79 0.00 0.00 35.95 38.83 1up6 h PHE 48 CO 0.00 1.35 0.18 0.28 -2.23 0.00 0.00 178.31 177.89 1up6 h VAL 49 N 0.48 0.90 -0.83 1.41 2.07 0.19 -2.42 116.25 118.04 1up6 h VAL 49 Ca -0.09 -0.13 0.12 0.00 0.82 0.00 0.00 66.70 67.42 1up6 h VAL 49 Cb 1.53 0.49 -0.06 0.00 -1.52 0.00 0.00 31.29 31.74 1up6 h VAL 49 CO 0.18 0.07 0.54 0.11 0.02 0.00 0.00 177.57 178.49 1up6 h LYS 50 N 0.37 0.68 -0.06 1.57 6.56 -0.77 0.29 116.57 125.21 1up6 h LYS 50 Ca 0.20 -0.04 -0.12 0.00 -1.06 0.00 0.00 60.65 59.63 1up6 h LYS 50 Cb 0.17 -0.15 -0.01 0.00 -0.57 0.00 0.00 32.23 31.66 1up6 h LYS 50 CO -0.18 0.45 -0.51 0.00 -2.06 0.00 0.00 179.45 177.14 1up6 h ARG 51 N 0.70 0.17 0.10 3.15 3.08 -1.41 -2.60 114.38 117.57 1up6 h ARG 51 Ca 0.40 -0.10 -0.29 0.00 0.07 0.00 0.00 59.98 60.05 1up6 h ARG 51 Cb 0.56 0.01 0.03 0.00 0.08 0.00 0.00 29.97 30.65 1up6 h ARG 51 CO -0.16 0.65 -1.21 -0.07 -1.07 0.00 0.00 179.97 178.11 1up6 h LEU 52 N 0.14 0.88 0.03 3.04 3.38 -0.66 -3.37 115.31 118.75 1up6 h LEU 52 Ca 0.00 -0.79 -0.18 0.00 0.09 0.00 0.00 57.88 57.00 1up6 h LEU 52 Cb 0.96 -0.28 0.02 0.00 0.09 0.00 0.00 40.66 41.44 1up6 h LEU 52 CO 0.08 1.60 -0.71 -0.37 0.09 0.00 0.00 178.44 179.12 1up6 h VAL 53 N 0.30 1.42 -5.97 1.22 -1.51 -1.10 -3.48 116.25 107.12 1up6 h VAL 53 Ca -0.18 -2.18 -0.39 0.00 -1.23 0.00 0.00 66.70 62.72 1up6 h VAL 53 Cb 1.88 2.67 0.09 0.00 -2.13 0.00 0.00 31.29 33.80 1up6 h VAL 53 CO 0.23 0.64 -0.85 0.29 -1.23 0.00 0.00 177.57 176.65 1up6 n LYS 54 N -4.14 -4.05 -1.12 5.19 5.02 -0.98 -2.60 118.16 115.48 1up6 n LYS 54 Ca -0.11 0.65 -0.04 0.00 -2.02 0.00 0.00 58.31 56.79 1up6 n LYS 54 Cb 0.73 -5.17 -0.02 0.00 -0.02 0.00 0.00 35.03 30.56 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 -3.03 -4.69 0.16 4.39 8.00 -1.26 -4.86 116.55 115.25 1up6 n ASP 55 Ca -0.23 0.10 0.01 0.00 0.71 0.00 0.00 54.79 55.38 1up6 n ASP 55 Cb 0.65 -2.56 0.32 0.00 -0.02 0.00 0.00 41.12 39.52 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 0.27 0.08 -3.73 -1.24 3.08 -1.90 -3.44 114.38 107.51 1up6 h ARG 56 Ca -0.08 -0.03 -0.08 0.00 0.07 0.00 0.00 59.98 59.85 1up6 h ARG 56 Cb 0.67 -0.00 -0.13 0.00 0.08 0.00 0.00 29.97 30.58 1up6 h ARG 56 CO 0.12 0.44 -0.29 -0.59 -1.07 0.00 0.00 179.97 178.58 1up6 s PHE 57 N -4.22 0.12 0.19 3.04 -0.12 -1.26 -4.98 117.98 110.75 1up6 s PHE 57 Ca -0.03 -0.52 -0.30 0.00 -0.05 0.00 0.00 56.93 56.03 1up6 s PHE 57 Cb 0.14 0.02 -0.09 0.00 -0.63 0.00 0.00 43.02 42.46 1up6 s PHE 57 CO 0.74 -0.62 1.36 0.21 -0.05 0.00 0.00 175.22 176.86 1up6 s LYS 58 N -3.87 4.35 -0.20 1.99 2.47 -0.63 -4.88 119.74 118.96 1up6 s LYS 58 Ca 0.07 2.12 -0.03 0.00 -1.56 0.00 0.00 55.97 56.57 1up6 s LYS 58 Cb 0.04 -3.18 -0.01 0.00 -1.46 0.00 0.00 37.83 33.21 1up6 s LYS 58 CO -0.09 -0.33 -0.06 0.08 0.16 0.00 0.00 175.35 175.11 1up6 s VAL 59 N 0.29 3.29 0.19 4.02 1.01 -1.26 -0.49 120.40 127.45 1up6 s VAL 59 Ca 0.59 -0.53 0.09 0.00 0.00 0.00 0.00 61.98 62.13 1up6 s VAL 59 Cb -0.38 -2.47 -0.04 0.00 0.00 0.00 0.00 36.38 33.49 1up6 s VAL 59 CO 0.38 0.45 -0.18 -0.76 0.00 0.00 0.00 175.10 174.99 1up6 s LEU 60 N 1.21 2.48 -0.10 3.92 2.01 -0.35 -5.00 118.68 122.86 1up6 s LEU 60 Ca 0.02 -0.92 0.04 0.00 0.01 0.00 0.00 54.13 53.28 1up6 s LEU 60 Cb -0.14 -0.83 0.00 0.00 0.01 0.00 0.00 46.19 45.23 1up6 s LEU 60 CO -0.02 -0.06 -0.23 -0.63 1.01 0.00 0.00 176.35 176.43 1up6 s ILE 61 N -2.32 1.95 -0.12 -0.59 1.01 -1.26 -0.63 121.20 119.25 1up6 s ILE 61 Ca 0.19 -0.96 -0.05 0.00 0.00 0.00 0.00 60.65 59.83 1up6 s ILE 61 Cb -0.04 -1.70 -0.04 0.00 0.01 0.00 0.00 42.46 40.69 1up6 s ILE 61 CO 0.08 0.54 0.08 -0.55 0.00 0.00 0.00 174.94 175.08 1up6 s SER 62 N 0.39 5.85 0.42 3.58 0.15 -0.51 -4.92 113.70 118.66 1up6 s SER 62 Ca -0.18 0.29 0.23 0.00 0.70 0.00 0.00 55.95 56.98 1up6 s SER 62 Cb -0.18 -1.84 0.57 0.00 -1.71 0.00 0.00 66.02 62.87 1up6 s SER 62 CO 0.08 0.36 1.68 0.44 1.20 0.00 0.00 173.24 177.00 1up6 h ASP 63 N 5.35 0.00 -2.31 5.45 3.32 -1.96 -3.43 116.42 122.85 1up6 h ASP 63 Ca -0.50 0.00 -0.56 0.00 0.02 0.00 0.00 57.03 55.98 1up6 h ASP 63 Cb 1.20 0.00 -0.13 0.00 0.22 0.00 0.00 39.33 40.62 1up6 h ASP 63 CO 0.59 0.17 -0.59 0.42 -1.72 0.00 0.00 179.24 178.12 1up6 s THR 64 N -3.32 1.46 0.02 0.35 -4.23 -1.26 -5.02 115.64 103.64 1up6 s THR 64 Ca 0.04 -2.00 -0.22 0.00 -1.18 0.00 0.00 61.69 58.33 1up6 s THR 64 Cb 0.07 -2.78 -0.16 0.00 1.34 0.00 0.00 72.50 70.98 1up6 s THR 64 CO 0.66 0.00 1.34 0.15 -0.54 0.00 0.00 174.62 176.23 1up6 h PHE 65 N 1.87 0.29 -1.00 3.99 3.57 -1.98 -3.26 116.94 120.42 1up6 h PHE 65 Ca -0.42 -0.08 0.11 0.00 3.53 0.00 0.00 57.97 61.11 1up6 h PHE 65 Cb 1.25 -0.06 -0.08 0.00 2.79 0.00 0.00 35.95 39.85 1up6 h PHE 65 CO 0.81 0.64 0.63 1.49 -2.23 0.00 0.00 178.31 179.65 1up6 h GLU 66 N -0.14 0.98 -0.00 1.11 4.81 -1.97 -1.76 114.58 117.60 1up6 h GLU 66 Ca 0.02 -0.06 -0.08 0.00 -0.13 0.00 0.00 59.36 59.11 1up6 h GLU 66 Cb 0.58 -0.22 -0.01 0.00 0.63 0.00 0.00 28.75 29.73 1up6 h GLU 66 CO 0.02 0.65 -0.37 0.78 -0.73 0.00 0.00 179.01 179.35 1up6 h GLY 67 N 1.01 0.01 1.68 1.92 0.00 -1.97 -2.54 103.07 103.18 1up6 h GLY 67 Ca 0.49 -0.01 -0.26 0.00 0.00 0.00 0.00 47.33 47.54 1up6 h GLY 67 CO -0.25 0.01 -1.20 0.00 0.00 0.00 0.00 176.54 175.10 1up6 h ALA 68 N 1.62 0.14 0.11 3.60 0.00 -1.37 -3.38 119.26 119.98 1up6 h ALA 68 Ca -0.00 -0.88 -0.32 0.00 0.00 0.00 0.00 54.91 53.71 1up6 h ALA 68 Cb 0.66 -0.02 -0.01 0.00 0.00 0.00 0.00 17.79 18.43 1up6 h ALA 68 CO 0.05 1.00 -1.66 -0.39 0.00 0.00 0.00 179.25 178.25 1up6 h VAL 69 N 0.07 0.99 0.00 0.00 -1.51 -1.39 -3.41 116.25 110.99 1up6 h VAL 69 Ca -0.11 -2.67 0.00 0.00 -1.23 0.00 0.00 66.70 62.68 1up6 h VAL 69 Cb 1.93 2.66 0.00 0.00 -2.13 0.00 0.00 31.29 33.75 1up6 h VAL 69 CO 0.19 0.79 0.59 0.55 -1.23 0.00 0.00 177.57 178.47 1up6 n VAL 70 N -3.41 0.00 0.00 7.19 3.14 -0.97 -4.68 118.33 119.60 1up6 n VAL 70 Ca -0.20 0.00 0.00 0.00 -2.96 0.00 0.00 64.34 61.18 1up6 n VAL 70 Cb 1.05 -1.30 0.00 0.00 -1.06 0.00 0.00 33.84 32.53 1up6 n VAL 70 CO 0.00 0.00 0.00 -1.22 -6.46 0.00 0.00 176.83 169.15 1up6 n TYR 74 N 3.49 0.00 -3.80 1.45 4.02 -1.24 -5.01 117.16 116.08 1up6 n TYR 74 Ca 0.00 0.00 -0.26 0.00 -0.01 0.00 0.00 57.90 57.63 1up6 n TYR 74 Cb 0.00 0.00 -0.17 0.00 -0.02 0.00 0.00 39.34 39.15 1up6 n TYR 74 CO 0.00 0.00 0.00 0.08 -1.01 0.00 0.00 176.86 175.93 1up6 s VAL 75 N 0.00 0.62 -0.33 -0.72 1.01 -0.06 -0.88 120.40 120.03 1up6 s VAL 75 Ca 0.00 -0.24 -0.13 0.00 0.00 0.00 0.00 61.98 61.62 1up6 s VAL 75 Cb 0.00 -0.85 -0.02 0.00 0.00 0.00 0.00 36.38 35.50 1up6 s VAL 75 CO 0.00 0.12 0.25 -0.63 0.00 0.00 0.00 175.10 174.84 1up6 s ILE 76 N 1.85 5.27 -0.36 2.22 1.01 0.93 -0.90 121.20 131.24 1up6 s ILE 76 Ca 0.03 -0.07 -0.25 0.00 0.00 0.00 0.00 60.65 60.35 1up6 s ILE 76 Cb -0.14 -3.69 0.01 0.00 0.01 0.00 0.00 42.46 38.65 1up6 s ILE 76 CO -0.07 0.04 0.88 -0.36 0.00 0.00 0.00 174.94 175.44 1up6 s PHE 77 N 1.78 3.10 0.00 3.97 0.40 -0.31 -0.35 117.98 126.58 1up6 s PHE 77 Ca 0.07 0.74 0.11 0.00 -0.60 0.00 0.00 56.93 57.26 1up6 s PHE 77 Cb -0.17 -3.54 0.19 0.00 0.51 0.00 0.00 43.02 40.01 1up6 s PHE 77 CO 0.11 -0.77 1.06 0.00 0.70 0.00 0.00 175.22 176.31 1up6 n GLN 78 N 6.62 0.00 -1.84 0.44 10.64 -0.35 -0.21 117.38 132.68 1up6 n GLN 78 Ca 0.06 -1.40 -0.30 0.00 -1.83 0.00 0.00 57.00 53.53 1up6 n GLN 78 Cb 0.48 -0.23 0.05 0.00 -0.86 0.00 0.00 30.24 29.68 1up6 n GLN 78 CO 0.00 0.00 0.00 -0.59 -1.83 0.00 0.00 177.06 174.64 1up6 s PHE 79 N 0.00 3.27 -0.34 2.61 -0.12 -0.77 -4.72 117.98 117.91 1up6 s PHE 79 Ca 0.15 1.07 0.01 0.00 -0.05 0.00 0.00 56.93 58.11 1up6 s PHE 79 Cb 0.17 -3.07 0.10 0.00 -0.63 0.00 0.00 43.02 39.59 1up6 s PHE 79 CO -0.07 -1.24 0.09 0.50 -0.05 0.00 0.00 175.22 174.45 1up6 s ARG 80 N -5.33 1.08 -0.15 1.99 3.52 -1.26 -4.51 118.95 114.29 1up6 s ARG 80 Ca 0.58 -1.49 -0.29 0.00 -0.13 0.00 0.00 55.73 54.40 1up6 s ARG 80 Cb -0.11 -2.52 -0.05 0.00 -1.56 0.00 0.00 34.95 30.70 1up6 s ARG 80 CO 0.52 -0.98 1.83 -2.14 -0.81 0.00 0.00 175.30 173.72 1up6 s PRO 81 N 1.20 3.75 0.00 5.12 0.02 -1.26 -1.56 135.00 142.27 1up6 s PRO 81 Ca 0.11 1.98 0.00 0.00 0.02 0.00 0.00 61.00 63.11 1up6 s PRO 81 Cb -0.19 -4.14 0.00 0.00 0.02 0.00 0.00 34.50 30.20 1up6 s PRO 81 CO -0.16 -1.37 0.00 0.41 -0.33 0.00 0.00 177.00 175.55 1up6 n GLY 82 N 4.84 0.51 7.00 0.52 0.00 -1.26 -4.86 105.19 111.94 1up6 n GLY 82 Ca 0.21 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.23 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 0.21 0.26 -0.02 0.00 -0.60 -1.81 105.19 101.22 1up6 n GLY 83 Ca 0.00 -0.91 0.16 0.00 0.00 0.00 0.00 46.02 45.27 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 0.00 -0.68 0.99 3.38 -1.94 -2.17 115.31 114.88 1up6 h LEU 84 Ca 0.00 0.00 0.03 0.00 0.09 0.00 0.00 57.88 58.00 1up6 h LEU 84 Cb 0.00 0.00 -0.04 0.00 0.09 0.00 0.00 40.66 40.71 1up6 h LEU 84 CO 0.00 0.00 0.42 0.50 0.09 0.00 0.00 178.44 179.45 1up6 h LYS 85 N 0.00 0.80 -0.31 1.13 3.64 -1.98 -0.79 116.57 119.07 1up6 h LYS 85 Ca 0.00 -0.05 -0.05 0.00 -1.27 0.00 0.00 60.65 59.28 1up6 h LYS 85 Cb 0.65 -0.18 -0.01 0.00 -0.41 0.00 0.00 32.23 32.28 1up6 h LYS 85 CO 0.00 0.53 -0.01 0.78 -2.27 0.00 0.00 179.45 178.47 1up6 h GLY 86 N 0.82 0.59 1.13 5.01 0.00 -0.71 -2.82 103.07 107.09 1up6 h GLY 86 Ca 0.28 -0.45 0.04 0.00 0.00 0.00 0.00 47.33 47.20 1up6 h GLY 86 CO -0.12 0.41 0.48 -0.09 0.00 0.00 0.00 176.54 177.23 1up6 h ARG 87 N 0.34 0.83 -0.16 4.80 2.43 -1.29 -1.21 114.38 120.12 1up6 h ARG 87 Ca 0.09 -0.05 -0.01 0.00 -0.81 0.00 0.00 59.98 59.20 1up6 h ARG 87 Cb 0.46 -0.19 -0.01 0.00 -0.42 0.00 0.00 29.97 29.82 1up6 h ARG 87 CO 0.02 0.55 0.06 0.93 -1.51 0.00 0.00 179.97 180.02 1up6 h GLU 88 N 0.85 0.25 -0.81 0.20 5.08 -0.91 -1.42 114.58 117.82 1up6 h GLU 88 Ca 0.30 -0.05 -0.01 0.00 -1.00 0.00 0.00 59.36 58.60 1up6 h GLU 88 Cb 0.12 -0.04 -0.04 0.00 0.50 0.00 0.00 28.75 29.29 1up6 h GLU 88 CO -0.09 0.33 0.45 -0.91 -1.00 0.00 0.00 179.01 177.80 1up6 h ASN 89 N 0.11 1.01 -0.60 1.42 2.35 -1.25 0.38 115.58 118.99 1up6 h ASN 89 Ca 0.05 -0.08 0.03 0.00 -0.55 0.00 0.00 56.30 55.76 1up6 h ASN 89 Cb 0.18 -0.26 -0.04 0.00 0.05 0.00 0.00 38.32 38.25 1up6 h ASN 89 CO -0.00 0.80 0.36 0.44 -1.65 0.00 0.00 177.43 177.37 1up6 h ASP 90 N 1.14 0.57 0.42 5.81 3.32 -0.87 -1.80 116.42 125.00 1up6 h ASP 90 Ca 0.29 0.01 -0.29 0.00 0.02 0.00 0.00 57.03 57.06 1up6 h ASP 90 Cb 0.01 -0.11 0.02 0.00 0.22 0.00 0.00 39.33 39.47 1up6 h ASP 90 CO -0.05 0.39 -1.25 -0.33 -1.72 0.00 0.00 179.24 176.28 1up6 h GLU 91 N 0.69 0.42 0.02 3.56 5.08 -1.08 -3.36 114.58 119.92 1up6 h GLU 91 Ca 0.24 -0.63 -0.00 0.00 -1.00 0.00 0.00 59.36 57.97 1up6 h GLU 91 Cb 0.05 0.22 0.00 0.00 0.50 0.00 0.00 28.75 29.52 1up6 h GLU 91 CO -0.11 1.28 -0.01 0.78 -1.00 0.00 0.00 179.01 179.95 1up6 h GLY 92 N 0.98 -0.03 0.82 -3.84 0.00 -0.84 -3.38 103.07 96.78 1up6 h GLY 92 Ca -0.16 0.01 0.01 0.00 0.00 0.00 0.00 47.33 47.19 1up6 h GLY 92 CO 0.22 -0.01 -0.11 -2.22 0.00 0.00 0.00 176.54 174.42 1up6 h ILE 93 N -0.82 0.74 -0.86 2.60 2.04 -1.54 -2.71 117.51 116.96 1up6 h ILE 93 Ca -0.00 0.00 0.18 0.00 1.00 0.00 0.00 64.86 66.04 1up6 h ILE 93 Cb 0.73 0.74 -0.06 0.00 -0.74 0.00 0.00 36.82 37.48 1up6 h ILE 93 CO 0.01 0.00 0.57 -0.65 0.00 0.00 0.00 178.15 178.07 1up6 h PRO 94 N -0.23 0.43 -1.00 2.37 0.11 -1.77 -2.07 132.00 129.83 1up6 h PRO 94 Ca 0.01 -0.03 0.21 0.00 0.11 0.00 0.00 66.00 66.31 1up6 h PRO 94 Cb 0.24 -0.10 -0.11 0.00 0.11 0.00 0.00 31.00 31.15 1up6 h PRO 94 CO -0.05 0.29 0.62 -0.07 -0.21 0.00 0.00 178.00 178.57 1up6 h LEU 95 N 0.45 0.69 -0.30 2.35 4.07 -1.45 -0.60 115.31 120.51 1up6 h LEU 95 Ca 0.44 0.10 0.00 0.00 0.08 0.00 0.00 57.88 58.50 1up6 h LEU 95 Cb 1.01 -0.02 0.00 0.00 1.08 0.00 0.00 40.66 42.73 1up6 h LEU 95 CO -0.16 0.21 0.00 0.29 -1.08 0.00 0.00 178.44 177.69 1up6 n LYS 96 N -4.75 0.07 -0.18 1.13 5.02 -0.78 -2.03 118.16 116.64 1up6 n LYS 96 Ca 0.24 0.35 0.05 0.00 -2.02 0.00 0.00 58.31 56.93 1up6 n LYS 96 Cb 0.66 -1.65 0.14 0.00 -0.02 0.00 0.00 35.03 34.16 1up6 n LYS 96 CO 0.00 0.00 0.00 0.66 -0.52 0.00 0.00 177.40 177.54 1up6 n TYR 97 N -1.78 0.42 -1.65 2.13 4.02 -0.29 -4.96 117.16 115.05 1up6 n TYR 97 Ca 0.02 -0.61 -0.03 0.00 -0.01 0.00 0.00 57.90 57.27 1up6 n TYR 97 Cb 0.17 -0.10 -0.01 0.00 -0.02 0.00 0.00 39.34 39.38 1up6 n TYR 97 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 1up6 n GLY 98 N -0.06 0.41 3.57 2.72 0.00 -0.86 -5.02 105.19 105.95 1up6 n GLY 98 Ca 0.11 -0.82 -0.28 0.00 0.00 0.00 0.00 46.02 45.03 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 -0.88 3.00 0.09 0.99 1.02 -0.85 -5.02 118.68 117.04 1up6 s LEU 99 Ca 0.00 -0.49 -0.31 0.00 0.02 0.00 0.00 54.13 53.36 1up6 s LEU 99 Cb 0.00 -1.74 -0.10 0.00 0.02 0.00 0.00 46.19 44.37 1up6 s LEU 99 CO 0.00 0.14 1.89 -0.63 0.02 0.00 0.00 176.35 177.76 1up6 s ILE 100 N -1.47 2.71 -0.36 -0.59 -1.09 -1.26 -3.22 121.20 115.91 1up6 s ILE 100 Ca 0.23 0.03 -0.07 0.00 -2.23 0.00 0.00 60.65 58.61 1up6 s ILE 100 Cb -0.10 -3.02 0.05 0.00 -1.58 0.00 0.00 42.46 37.81 1up6 s ILE 100 CO 0.14 -0.00 0.16 -0.83 -1.23 0.00 0.00 174.94 173.18 1up6 s GLY 101 N 3.38 1.89 0.02 6.18 0.00 -1.26 -4.38 107.32 113.15 1up6 s GLY 101 Ca 0.84 -1.88 -0.11 0.00 0.00 0.00 0.00 44.72 43.57 1up6 s GLY 101 CO 0.38 0.84 0.23 1.62 0.00 0.00 0.00 173.10 176.17 1up6 s GLN 102 N 1.41 0.65 0.27 2.90 -0.44 -1.26 -4.70 119.66 118.50 1up6 s GLN 102 Ca 0.00 -0.43 0.00 0.00 -2.50 0.00 0.00 55.36 52.43 1up6 s GLN 102 Cb -0.20 0.28 0.56 0.00 -1.64 0.00 0.00 33.01 32.00 1up6 s GLN 102 CO 0.03 -0.18 1.79 1.49 0.50 0.00 0.00 175.29 178.91 1up6 h GLU 103 N 3.73 0.73 0.00 1.67 4.81 -1.89 -3.30 114.58 120.34 1up6 h GLU 103 Ca -0.31 -0.04 0.00 0.00 -0.13 0.00 0.00 59.36 58.88 1up6 h GLU 103 Cb 1.19 -0.16 0.00 0.00 0.63 0.00 0.00 28.75 30.40 1up6 h GLU 103 CO 0.44 0.48 -0.78 2.41 -0.73 0.00 0.00 179.01 180.83 1up6 n THR 104 N -4.78 0.00 -3.91 0.32 -1.04 -1.26 -3.79 114.28 99.83 1up6 n THR 104 Ca 0.18 -0.10 -0.35 0.00 -2.04 0.00 0.00 64.05 61.74 1up6 n THR 104 Cb 0.42 0.60 -0.14 0.00 -1.82 0.00 0.00 70.33 69.40 1up6 n THR 104 CO 0.00 0.00 0.00 -0.89 -0.64 0.00 0.00 175.07 173.54 1up6 s THR 105 N -1.77 3.22 0.00 12.58 2.01 -1.25 -4.26 115.64 126.17 1up6 s THR 105 Ca 0.00 -0.81 0.00 0.00 0.31 0.00 0.00 61.69 61.19 1up6 s THR 105 Cb 0.00 -2.59 0.00 0.00 0.01 0.00 0.00 72.50 69.92 1up6 s THR 105 CO 0.00 0.24 0.00 0.61 -0.69 0.00 0.00 174.62 174.78 1up6 n GLY 106 N 4.74 -0.08 0.30 4.40 0.00 -1.26 -4.26 105.19 109.04 1up6 n GLY 106 Ca -0.17 -1.32 0.08 0.00 0.00 0.00 0.00 46.02 44.60 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 0.69 -0.55 1.61 2.07 -1.81 0.48 116.25 118.74 1up6 h VAL 107 Ca 0.00 -0.19 0.04 0.00 0.82 0.00 0.00 66.70 67.37 1up6 h VAL 107 Cb 0.00 0.07 -0.03 0.00 -1.52 0.00 0.00 31.29 29.81 1up6 h VAL 107 CO 0.00 0.10 0.36 1.23 0.02 0.00 0.00 177.57 179.29 1up6 h GLY 108 N 0.56 0.68 1.98 2.17 0.00 -1.70 -1.61 103.07 105.15 1up6 h GLY 108 Ca 0.47 -0.23 -0.18 0.00 0.00 0.00 0.00 47.33 47.38 1up6 h GLY 108 CO -0.39 0.19 -0.86 -1.33 0.00 0.00 0.00 176.54 174.15 1up6 h GLY 109 N 0.58 0.02 0.65 4.60 0.00 -1.01 -2.42 103.07 105.51 1up6 h GLY 109 Ca 0.23 -0.05 0.01 0.00 0.00 0.00 0.00 47.33 47.52 1up6 h GLY 109 CO -0.06 0.04 -0.20 -2.75 0.00 0.00 0.00 176.54 173.57 1up6 h PHE 110 N 0.01 -0.53 -0.17 5.60 3.57 -0.52 -0.19 116.94 124.70 1up6 h PHE 110 Ca -0.01 0.01 -0.11 0.00 3.53 0.00 0.00 57.97 61.39 1up6 h PHE 110 Cb 1.51 0.22 -0.01 0.00 2.79 0.00 0.00 35.95 40.46 1up6 h PHE 110 CO 0.00 -0.29 -0.36 0.66 -2.23 0.00 0.00 178.31 176.09 1up6 h SER 111 N -0.39 0.38 -0.76 0.41 4.64 -1.40 -2.12 113.55 114.31 1up6 h SER 111 Ca 0.03 -0.15 -0.04 0.00 -0.47 0.00 0.00 61.79 61.15 1up6 h SER 111 Cb 0.41 -0.10 -0.03 0.00 -0.31 0.00 0.00 62.40 62.36 1up6 h SER 111 CO -0.11 0.71 0.30 0.00 -0.87 0.00 0.00 176.83 176.86 1up6 h ALA 112 N 1.31 0.99 0.02 5.18 0.00 -1.19 -2.11 119.26 123.46 1up6 h ALA 112 Ca 0.04 -0.19 -0.00 0.00 0.00 0.00 0.00 54.91 54.75 1up6 h ALA 112 Cb 0.78 -0.30 0.00 0.00 0.00 0.00 0.00 17.79 18.27 1up6 h ALA 112 CO 0.06 0.61 -0.01 0.00 0.00 0.00 0.00 179.25 179.92 1up6 h ALA 113 N 1.15 -0.03 -0.80 0.00 0.00 -0.74 -1.35 119.26 117.49 1up6 h ALA 113 Ca 0.25 -0.04 0.08 0.00 0.00 0.00 0.00 54.91 55.20 1up6 h ALA 113 Cb 0.22 0.01 -0.05 0.00 0.00 0.00 0.00 17.79 17.97 1up6 h ALA 113 CO -0.02 -0.49 0.52 -0.07 0.00 0.00 0.00 179.25 179.20 1up6 h LEU 114 N -0.09 0.73 -0.44 0.00 3.38 -1.27 -0.90 115.31 116.72 1up6 h LEU 114 Ca -0.00 0.01 -0.09 0.00 0.09 0.00 0.00 57.88 57.88 1up6 h LEU 114 Cb 0.08 -0.15 -0.01 0.00 0.09 0.00 0.00 40.66 40.67 1up6 h LEU 114 CO 0.00 0.46 -0.09 0.03 0.09 0.00 0.00 178.44 178.93 1up6 h ARG 115 N 0.82 0.83 -0.12 1.13 3.08 -1.13 -3.33 114.38 115.65 1up6 h ARG 115 Ca 0.35 -0.31 -0.17 0.00 0.07 0.00 0.00 59.98 59.92 1up6 h ARG 115 Cb 0.31 -0.05 0.01 0.00 0.08 0.00 0.00 29.97 30.31 1up6 h ARG 115 CO -0.13 0.94 -0.58 0.00 -1.07 0.00 0.00 179.97 179.13 1up6 h ALA 116 N 0.87 0.24 -0.71 0.04 0.00 -0.34 -3.38 119.26 115.98 1up6 h ALA 116 Ca 0.11 -0.53 0.14 0.00 0.00 0.00 0.00 54.91 54.63 1up6 h ALA 116 Cb 0.62 -0.01 -0.13 0.00 0.00 0.00 0.00 17.79 18.26 1up6 h ALA 116 CO 0.04 0.47 -0.23 0.74 0.00 0.00 0.00 179.25 180.27 1up6 h PHE 117 N 0.25 -0.55 -0.83 0.00 0.04 -1.31 -0.62 116.94 113.92 1up6 h PHE 117 Ca -0.04 0.07 -0.01 0.00 2.80 0.00 0.00 57.97 60.79 1up6 h PHE 117 Cb 1.22 0.35 -0.04 0.00 2.20 0.00 0.00 35.95 39.68 1up6 h PHE 117 CO 0.10 -0.34 0.48 -1.35 -0.60 0.00 0.00 178.31 176.60 1up6 h PRO 118 N -0.04 1.14 -0.20 1.51 0.11 -1.76 -0.17 132.00 132.58 1up6 h PRO 118 Ca 0.32 -0.12 -0.05 0.00 0.11 0.00 0.00 66.00 66.27 1up6 h PRO 118 Cb 0.55 -0.23 -0.01 0.00 0.11 0.00 0.00 31.00 31.42 1up6 h PRO 118 CO -0.75 0.82 -0.06 0.82 -0.21 0.00 0.00 178.00 178.62 1up6 h ILE 119 N 1.14 1.29 -0.53 4.15 2.04 -1.52 -2.65 117.51 121.43 1up6 h ILE 119 Ca 0.29 -1.05 0.01 0.00 1.00 0.00 0.00 64.86 65.12 1up6 h ILE 119 Cb -0.01 1.56 -0.03 0.00 -0.74 0.00 0.00 36.82 37.60 1up6 h ILE 119 CO -0.05 0.32 0.34 0.58 0.00 0.00 0.00 178.15 179.34 1up6 h VAL 120 N 0.12 1.11 0.10 1.67 2.07 -0.96 -1.31 116.25 119.04 1up6 h VAL 120 Ca 0.05 -0.23 0.02 0.00 0.82 0.00 0.00 66.70 67.36 1up6 h VAL 120 Cb 0.51 0.36 -0.04 0.00 -1.52 0.00 0.00 31.29 30.60 1up6 h VAL 120 CO 0.02 0.12 -0.35 -0.08 0.02 0.00 0.00 177.57 177.30 1up6 h GLU 121 N 0.68 -0.55 -0.86 1.57 4.81 -1.01 0.25 114.58 119.47 1up6 h GLU 121 Ca 0.20 0.04 0.08 0.00 -0.13 0.00 0.00 59.36 59.55 1up6 h GLU 121 Cb -0.05 0.12 -0.06 0.00 0.63 0.00 0.00 28.75 29.40 1up6 h GLU 121 CO -0.06 -0.37 0.56 1.49 -0.73 0.00 0.00 179.01 179.90 1up6 h GLU 122 N -0.57 0.88 0.08 1.92 4.81 -1.32 -1.10 114.58 119.27 1up6 h GLU 122 Ca 0.03 -0.05 -0.19 0.00 -0.13 0.00 0.00 59.36 59.02 1up6 h GLU 122 Cb 0.61 -0.20 0.02 0.00 0.63 0.00 0.00 28.75 29.81 1up6 h GLU 122 CO -0.22 0.58 -0.78 1.88 -0.73 0.00 0.00 179.01 179.74 1up6 h TYR 123 N 0.90 0.64 -0.57 0.92 0.05 -0.56 -2.56 116.97 115.78 1up6 h TYR 123 Ca 0.38 -0.40 -0.01 0.00 0.05 0.00 0.00 58.73 58.75 1up6 h TYR 123 Cb 0.31 -0.05 -0.03 0.00 1.01 0.00 0.00 36.73 37.97 1up6 h TYR 123 CO -0.00 1.26 0.30 0.28 -1.05 0.00 0.00 178.16 178.95 1up6 h VAL 124 N -0.17 1.19 -0.98 -2.88 2.07 -0.40 -1.48 116.25 113.60 1up6 h VAL 124 Ca -0.12 -0.51 0.06 0.00 0.82 0.00 0.00 66.70 66.96 1up6 h VAL 124 Cb 1.53 0.48 -0.07 0.00 -1.52 0.00 0.00 31.29 31.72 1up6 h VAL 124 CO 0.15 0.21 0.63 -0.78 0.02 0.00 0.00 177.57 177.80 1up6 h ASP 125 N 0.77 1.01 -0.38 0.57 3.58 -1.26 0.37 116.42 121.08 1up6 h ASP 125 Ca 0.20 0.01 -0.16 0.00 0.42 0.00 0.00 57.03 57.50 1up6 h ASP 125 Cb 0.07 -0.21 -0.01 0.00 1.72 0.00 0.00 39.33 40.91 1up6 h ASP 125 CO -0.03 0.65 -0.39 0.74 -2.88 0.00 0.00 179.24 177.32 1up6 h THR 126 N 1.15 1.27 -0.09 2.25 2.02 -1.01 -2.51 112.91 115.98 1up6 h THR 126 Ca 0.42 -1.57 -0.03 0.00 0.77 0.00 0.00 66.41 66.01 1up6 h THR 126 Cb 0.16 1.38 -0.00 0.00 -1.74 0.00 0.00 68.15 67.95 1up6 h THR 126 CO -0.17 0.53 -0.04 0.58 0.37 0.00 0.00 175.52 176.78 1up6 h VAL 127 N 0.77 1.32 -1.00 3.16 2.07 -0.88 -2.68 116.25 119.00 1up6 h VAL 127 Ca 0.06 -1.06 0.22 0.00 0.82 0.00 0.00 66.70 66.74 1up6 h VAL 127 Cb 0.99 1.83 -0.11 0.00 -1.52 0.00 0.00 31.29 32.48 1up6 h VAL 127 CO 0.10 0.30 0.61 -0.09 0.02 0.00 0.00 177.57 178.51 1up6 h ARG 128 N -0.17 0.63 -0.00 1.57 2.43 -0.98 -1.13 114.38 116.73 1up6 h ARG 128 Ca 0.02 -0.04 0.00 0.00 -0.81 0.00 0.00 59.98 59.15 1up6 h ARG 128 Cb 0.49 -0.14 0.00 0.00 -0.42 0.00 0.00 29.97 29.90 1up6 h ARG 128 CO 0.01 0.42 -0.17 1.63 -1.51 0.00 0.00 179.97 180.35 1up6 n LYS 129 N -4.78 0.53 0.00 0.20 5.02 -0.95 -4.52 118.16 113.66 1up6 n LYS 129 Ca 0.25 -0.21 0.00 0.00 -2.02 0.00 0.00 58.31 56.32 1up6 n LYS 129 Cb 0.67 -1.50 0.00 0.00 -0.02 0.00 0.00 35.03 34.18 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 -1.05 0.00 0.04 -0.18 -2.24 -0.51 -5.00 114.28 105.34 1up6 n THR 130 Ca 0.12 0.00 0.05 0.00 -2.27 0.00 0.00 64.05 61.95 1up6 n THR 130 Cb 0.30 -0.24 -0.08 0.00 -2.10 0.00 0.00 70.33 68.22 1up6 n THR 130 CO 0.00 0.00 0.00 -0.24 -0.57 0.00 0.00 175.07 174.26 1up6 n SER 131 N -0.54 0.63 -3.65 3.42 2.88 -0.79 -4.97 113.62 110.59 1up6 n SER 131 Ca 0.00 0.26 -0.28 0.00 -1.33 0.00 0.00 58.87 57.52 1up6 n SER 131 Cb 0.00 0.68 0.01 0.00 -0.75 0.00 0.00 64.21 64.14 1up6 n SER 131 CO 0.00 0.00 0.00 0.59 -1.23 0.00 0.00 175.04 174.40 1up6 n ASN 132 N -2.68 -4.30 -4.77 -3.46 3.02 -0.68 -4.97 115.26 97.42 1up6 n ASN 132 Ca -0.07 -0.61 -0.31 0.00 -0.03 0.00 0.00 54.58 53.56 1up6 n ASN 132 Cb 0.71 -3.49 0.09 0.00 -0.61 0.00 0.00 39.78 36.49 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 -3.13 2.18 0.02 5.41 0.00 -1.26 -5.02 121.76 119.96 1up6 s ALA 133 Ca 0.54 0.13 -0.30 0.00 0.00 0.00 0.00 51.96 52.32 1up6 s ALA 133 Cb -0.28 -3.23 -0.04 0.00 0.00 0.00 0.00 23.12 19.58 1up6 s ALA 133 CO 0.66 -1.79 1.11 0.99 0.00 0.00 0.00 175.76 176.73 1up6 s THR 134 N -2.96 4.41 -0.24 0.00 2.01 -1.26 -4.87 115.64 112.73 1up6 s THR 134 Ca 0.61 1.73 -0.11 0.00 0.31 0.00 0.00 61.69 64.22 1up6 s THR 134 Cb -0.17 -4.11 -0.05 0.00 0.01 0.00 0.00 72.50 68.19 1up6 s THR 134 CO 0.56 0.12 0.19 -0.63 -0.69 0.00 0.00 174.62 174.17 1up6 s ILE 135 N 1.18 5.34 -0.35 1.82 1.01 -0.31 -0.89 121.20 129.01 1up6 s ILE 135 Ca 0.55 0.24 -0.11 0.00 0.00 0.00 0.00 60.65 61.34 1up6 s ILE 135 Cb -0.25 -3.53 0.01 0.00 0.01 0.00 0.00 42.46 38.70 1up6 s ILE 135 CO 0.28 0.33 0.19 -0.69 0.00 0.00 0.00 174.94 175.05 1up6 s VAL 136 N 1.12 4.67 -0.18 2.92 1.01 -0.07 -0.30 120.40 129.56 1up6 s VAL 136 Ca 0.09 -0.61 -0.09 0.00 0.00 0.00 0.00 61.98 61.37 1up6 s VAL 136 Cb -0.14 -3.50 -0.05 0.00 0.00 0.00 0.00 36.38 32.70 1up6 s VAL 136 CO 0.05 -0.09 0.12 0.21 0.00 0.00 0.00 175.10 175.39 1up6 s ASN 137 N 1.60 6.15 -0.07 3.32 2.47 0.46 -1.16 114.94 127.71 1up6 s ASN 137 Ca 0.04 0.24 0.06 0.00 0.42 0.00 0.00 52.86 53.62 1up6 s ASN 137 Cb -0.18 -2.06 -0.09 0.00 -1.45 0.00 0.00 41.25 37.47 1up6 s ASN 137 CO 0.07 0.22 0.02 0.49 -3.72 0.00 0.00 177.10 174.17 1up6 n PHE 138 N 3.28 0.00 -1.54 0.43 3.72 0.70 -1.03 117.46 123.02 1up6 n PHE 138 Ca -0.17 0.00 -0.54 0.00 -0.05 0.00 0.00 57.45 56.69 1up6 n PHE 138 Cb 0.52 -0.35 -0.06 0.00 -0.94 0.00 0.00 39.48 38.65 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 -2.29 0.28 -3.60 4.37 -1.04 -1.15 -4.63 114.28 106.23 1up6 n THR 139 Ca -0.12 -0.07 -0.30 0.00 -2.04 0.00 0.00 64.05 61.52 1up6 n THR 139 Cb 0.73 -0.45 -0.04 0.00 -1.82 0.00 0.00 70.33 68.75 1up6 n THR 139 CO 0.00 0.00 0.00 0.21 -0.64 0.00 0.00 175.07 174.64 1up6 s ASN 140 N 0.12 6.47 -0.24 8.00 2.47 -1.26 -2.62 114.94 127.87 1up6 s ASN 140 Ca 0.84 0.60 -0.29 0.00 0.42 0.00 0.00 52.86 54.43 1up6 s ASN 140 Cb -1.06 -2.10 0.01 0.00 -1.45 0.00 0.00 41.25 36.66 1up6 s ASN 140 CO 0.52 -0.02 1.05 -2.84 -3.72 0.00 0.00 177.10 172.09 1up6 s PRO 141 N -2.97 4.23 0.15 0.43 0.02 -1.26 -4.74 135.00 130.86 1up6 s PRO 141 Ca 0.42 1.32 -0.13 0.00 0.02 0.00 0.00 61.00 62.62 1up6 s PRO 141 Cb -0.12 -3.66 0.03 0.00 0.02 0.00 0.00 34.50 30.77 1up6 s PRO 141 CO 0.26 -0.68 1.64 1.03 -0.33 0.00 0.00 177.00 178.92 1up6 h SER 142 N 7.57 0.79 -0.40 2.53 0.87 -1.76 -0.01 113.55 123.15 1up6 h SER 142 Ca -0.19 -0.26 -0.06 0.00 -1.23 0.00 0.00 61.79 60.05 1up6 h SER 142 Cb 1.06 -0.21 -0.01 0.00 -0.44 0.00 0.00 62.40 62.80 1up6 h SER 142 CO 0.99 0.85 0.02 1.23 -0.53 0.00 0.00 176.83 179.38 1up6 h GLY 143 N 0.70 0.74 0.99 5.77 0.00 -1.89 -2.09 103.07 107.30 1up6 h GLY 143 Ca 0.15 -0.53 -0.04 0.00 0.00 0.00 0.00 47.33 46.91 1up6 h GLY 143 CO 0.01 0.49 0.22 0.84 0.00 0.00 0.00 176.54 178.10 1up6 h HIS 144 N 0.52 0.90 -0.65 5.60 6.17 -1.87 0.64 115.15 126.45 1up6 h HIS 144 Ca 0.11 -0.07 -0.05 0.00 0.71 0.00 0.00 60.37 61.07 1up6 h HIS 144 Cb 0.45 -0.27 -0.03 0.00 2.52 0.00 0.00 27.41 30.08 1up6 h HIS 144 CO 0.03 0.73 0.21 0.82 0.71 0.00 0.00 177.93 180.43 1up6 h ILE 145 N 0.80 1.24 -0.57 6.26 2.04 -0.99 -1.84 117.51 124.45 1up6 h ILE 145 Ca 0.19 -0.81 -0.11 0.00 1.00 0.00 0.00 64.86 65.13 1up6 h ILE 145 Cb 0.22 0.51 -0.02 0.00 -0.74 0.00 0.00 36.82 36.80 1up6 h ILE 145 CO -0.01 0.32 -0.08 0.74 0.00 0.00 0.00 178.15 179.12 1up6 h THR 146 N 0.96 1.27 -0.37 -0.27 2.02 -0.60 0.11 112.91 116.03 1up6 h THR 146 Ca 0.21 -1.24 0.03 0.00 0.77 0.00 0.00 66.41 66.19 1up6 h THR 146 Cb 0.26 0.90 -0.03 0.00 -1.74 0.00 0.00 68.15 67.54 1up6 h THR 146 CO -0.01 0.44 0.17 -0.08 0.37 0.00 0.00 175.52 176.41 1up6 h GLU 147 N 0.95 0.34 -0.32 6.66 4.57 -0.67 -0.79 114.58 125.33 1up6 h GLU 147 Ca 0.15 -0.02 -0.01 0.00 -1.18 0.00 0.00 59.36 58.30 1up6 h GLU 147 Cb 0.65 -0.08 -0.01 0.00 -0.16 0.00 0.00 28.75 29.15 1up6 h GLU 147 CO 0.04 0.23 0.17 0.35 -1.18 0.00 0.00 179.01 178.62 1up6 h PHE 148 N 0.35 0.44 -0.20 0.92 3.57 -0.74 -1.46 116.94 119.82 1up6 h PHE 148 Ca 0.16 -0.01 -0.11 0.00 3.53 0.00 0.00 57.97 61.53 1up6 h PHE 148 Cb 0.08 -0.14 -0.00 0.00 2.79 0.00 0.00 35.95 38.68 1up6 h PHE 148 CO -0.11 0.36 -0.31 0.28 -2.23 0.00 0.00 178.31 176.30 1up6 h VAL 149 N 0.39 1.33 -0.09 1.41 2.07 -0.63 -1.57 116.25 119.16 1up6 h VAL 149 Ca 0.11 -1.52 -0.17 0.00 0.82 0.00 0.00 66.70 65.93 1up6 h VAL 149 Cb 0.07 1.83 0.01 0.00 -1.52 0.00 0.00 31.29 31.68 1up6 h VAL 149 CO -0.02 0.47 -0.63 0.03 0.02 0.00 0.00 177.57 177.45 1up6 h ARG 150 N 0.23 0.59 0.00 1.57 2.47 -1.15 0.11 114.38 118.20 1up6 h ARG 150 Ca 0.02 -0.51 0.00 0.00 -1.26 0.00 0.00 59.98 58.23 1up6 h ARG 150 Cb 0.89 0.11 0.00 0.00 -1.65 0.00 0.00 29.97 29.33 1up6 h ARG 150 CO 0.07 1.13 -1.29 0.09 0.56 0.00 0.00 179.97 180.53 1up6 n ASN 151 N -4.13 0.58 -0.01 7.04 3.02 -0.55 -3.63 115.26 117.59 1up6 n ASN 151 Ca -0.08 -0.46 -0.02 0.00 -0.03 0.00 0.00 54.58 53.99 1up6 n ASN 151 Cb 0.67 1.22 -0.01 0.00 -0.61 0.00 0.00 39.78 41.05 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 -1.86 0.00 0.16 3.10 4.02 -0.78 -4.63 117.16 117.16 1up6 n TYR 152 Ca 0.01 0.00 0.03 0.00 -0.01 0.00 0.00 57.90 57.93 1up6 n TYR 152 Cb 0.43 -0.06 0.20 0.00 -0.02 0.00 0.00 39.34 39.90 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 -0.06 0.00 -1.47 7.72 3.38 -1.31 -3.48 115.31 120.09 1up6 h LEU 153 Ca -0.04 0.00 -0.34 0.00 0.09 0.00 0.00 57.88 57.59 1up6 h LEU 153 Cb 0.99 0.00 0.16 0.00 0.09 0.00 0.00 40.66 41.90 1up6 h LEU 153 CO -0.02 0.48 -0.75 1.21 0.09 0.00 0.00 178.44 179.45 1up6 n GLU 154 N -3.45 -6.90 -3.73 1.13 2.13 0.33 -5.00 120.64 105.15 1up6 n GLU 154 Ca 0.00 0.84 -0.38 0.00 0.66 0.00 0.00 57.16 58.29 1up6 n GLU 154 Cb 0.61 -5.86 -0.12 0.00 0.27 0.00 0.00 31.44 26.34 1up6 n GLU 154 CO 0.00 0.00 0.00 -0.47 -0.41 0.00 0.00 177.13 176.25 1up6 s TYR 155 N -3.35 3.18 0.19 4.31 5.04 -0.94 -5.01 117.35 120.77 1up6 s TYR 155 Ca 0.13 -0.99 -0.09 0.00 -2.44 0.00 0.00 57.07 53.68 1up6 s TYR 155 Cb -0.06 -2.29 0.10 0.00 0.35 0.00 0.00 41.96 40.06 1up6 s TYR 155 CO 0.73 -0.59 1.70 1.49 -1.34 0.00 0.00 175.55 177.54 1up6 h GLU 156 N 8.27 1.08 -3.01 4.97 4.81 -1.90 -3.36 114.58 125.44 1up6 h GLU 156 Ca -0.30 -0.26 -0.76 0.00 -0.13 0.00 0.00 59.36 57.91 1up6 h GLU 156 Cb 1.12 -0.14 -0.17 0.00 0.63 0.00 0.00 28.75 30.20 1up6 h GLU 156 CO 0.61 0.97 1.96 1.63 -0.73 0.00 0.00 179.01 183.45 1up6 n LYS 157 N -4.27 4.22 -3.59 1.92 5.02 -1.26 -4.80 118.16 115.41 1up6 n LYS 157 Ca 0.04 -3.70 -0.22 0.00 -2.02 0.00 0.00 58.31 52.41 1up6 n LYS 157 Cb 0.26 -2.73 -0.16 0.00 -0.02 0.00 0.00 35.03 32.38 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 -0.91 -0.01 -0.23 2.13 2.19 -1.26 -1.16 117.98 118.74 1up6 s PHE 158 Ca 0.44 0.02 -0.00 0.00 0.33 0.00 0.00 56.93 57.72 1up6 s PHE 158 Cb 0.13 -0.52 0.03 0.00 -1.31 0.00 0.00 43.02 41.35 1up6 s PHE 158 CO -0.03 -0.47 -0.11 0.42 1.83 0.00 0.00 175.22 176.86 1up6 s ILE 159 N 2.22 2.57 0.09 3.12 1.01 0.58 -4.94 121.20 125.86 1up6 s ILE 159 Ca 0.04 -1.04 -0.24 0.00 0.00 0.00 0.00 60.65 59.40 1up6 s ILE 159 Cb -0.15 -2.26 -0.07 0.00 0.01 0.00 0.00 42.46 39.99 1up6 s ILE 159 CO -0.09 0.29 0.75 -0.83 0.00 0.00 0.00 174.94 175.05 1up6 s GLY 160 N 1.29 2.83 0.16 6.18 0.00 -1.19 -0.40 107.32 116.19 1up6 s GLY 160 Ca 0.01 0.28 0.08 0.00 0.00 0.00 0.00 44.72 45.09 1up6 s GLY 160 CO -0.07 0.94 -0.16 -2.27 0.00 0.00 0.00 173.10 171.53 1up6 s LEU 161 N -0.58 2.45 0.28 0.66 2.96 -0.20 -0.82 118.68 123.44 1up6 s LEU 161 Ca 0.36 -0.88 -0.01 0.00 -0.22 0.00 0.00 54.13 53.38 1up6 s LEU 161 Cb -0.21 -0.73 -0.02 0.00 0.50 0.00 0.00 46.19 45.73 1up6 s LEU 161 CO 0.24 -0.09 0.32 0.00 -1.32 0.00 0.00 176.35 175.49 1up6 h ASN 163 N 2.31 0.81 -0.33 0.00 -1.24 -2.00 -3.41 115.58 111.71 1up6 h ASN 163 Ca -0.30 -0.82 -0.17 0.00 0.71 0.00 0.00 56.30 55.72 1up6 h ASN 163 Cb 1.24 -0.25 -0.00 0.00 0.73 0.00 0.00 38.32 40.04 1up6 h ASN 163 CO 0.42 1.54 -0.46 -0.37 -1.29 0.00 0.00 177.43 177.27 1up6 h VAL 164 N 0.18 1.27 0.11 2.57 -1.51 -1.99 -2.98 116.25 113.91 1up6 h VAL 164 Ca -0.16 -1.64 0.02 0.00 -1.23 0.00 0.00 66.70 63.68 1up6 h VAL 164 Cb 1.79 1.51 -0.05 0.00 -2.13 0.00 0.00 31.29 32.42 1up6 h VAL 164 CO 0.21 0.54 -0.41 -0.65 -1.23 0.00 0.00 177.57 176.04 1up6 h PRO 165 N 0.71 -0.61 -0.53 5.19 0.11 -1.95 0.21 132.00 135.12 1up6 h PRO 165 Ca 0.04 0.04 0.01 0.00 0.11 0.00 0.00 66.00 66.20 1up6 h PRO 165 Cb 1.07 0.14 -0.03 0.00 0.11 0.00 0.00 31.00 32.29 1up6 h PRO 165 CO 0.11 -0.41 0.35 0.97 -0.21 0.00 0.00 178.00 178.81 1up6 h ILE 166 N -0.64 1.11 -0.38 4.15 6.09 -1.82 -2.08 117.51 123.95 1up6 h ILE 166 Ca 0.02 -0.23 -0.06 0.00 -1.37 0.00 0.00 64.86 63.23 1up6 h ILE 166 Cb 0.67 0.37 -0.01 0.00 0.47 0.00 0.00 36.82 38.32 1up6 h ILE 166 CO -0.24 0.12 0.02 0.78 -3.07 0.00 0.00 178.15 175.76 1up6 h ASN 167 N 0.68 0.63 0.10 2.19 -0.26 -1.14 -1.72 115.58 116.06 1up6 h ASN 167 Ca 0.20 -0.29 -0.00 0.00 -0.56 0.00 0.00 56.30 55.64 1up6 h ASN 167 Cb -0.02 -0.17 0.00 0.00 -1.06 0.00 0.00 38.32 37.07 1up6 h ASN 167 CO -0.05 0.77 -0.05 0.15 -1.06 0.00 0.00 177.43 177.20 1up6 h PHE 168 N 0.48 -0.12 -0.75 1.19 3.57 -0.57 -1.29 116.94 119.44 1up6 h PHE 168 Ca 0.11 -0.00 0.11 0.00 3.53 0.00 0.00 57.97 61.72 1up6 h PHE 168 Cb 0.43 0.04 -0.08 0.00 2.79 0.00 0.00 35.95 39.13 1up6 h PHE 168 CO 0.03 -0.05 0.37 0.82 -2.23 0.00 0.00 178.31 177.26 1up6 h ILE 169 N -0.16 0.80 -0.76 1.41 2.04 -1.33 -0.66 117.51 118.84 1up6 h ILE 169 Ca -0.01 -0.20 0.00 0.00 1.00 0.00 0.00 64.86 65.65 1up6 h ILE 169 Cb 0.13 0.15 -0.04 0.00 -0.74 0.00 0.00 36.82 36.32 1up6 h ILE 169 CO 0.02 0.11 0.49 -0.09 0.00 0.00 0.00 178.15 178.68 1up6 h ARG 170 N 0.60 1.01 0.01 2.37 2.43 -1.06 0.20 114.38 119.93 1up6 h ARG 170 Ca 0.39 -0.07 0.00 0.00 -0.81 0.00 0.00 59.98 59.49 1up6 h ARG 170 Cb 0.46 -0.22 -0.00 0.00 -0.42 0.00 0.00 29.97 29.79 1up6 h ARG 170 CO -0.31 0.68 -0.01 0.93 -1.51 0.00 0.00 179.97 179.75 1up6 h GLU 171 N 1.03 -0.02 -0.47 0.20 5.08 0.01 -2.18 114.58 118.23 1up6 h GLU 171 Ca 0.28 0.00 -0.07 0.00 -1.00 0.00 0.00 59.36 58.57 1up6 h GLU 171 Cb -0.10 0.01 -0.02 0.00 0.50 0.00 0.00 28.75 29.14 1up6 h GLU 171 CO -0.06 -0.02 0.02 0.82 -1.00 0.00 0.00 179.01 178.78 1up6 h ILE 172 N -0.02 1.26 -0.65 3.13 1.08 -0.93 -2.77 117.51 118.61 1up6 h ILE 172 Ca 0.00 -1.02 0.10 0.00 -0.39 0.00 0.00 64.86 63.55 1up6 h ILE 172 Cb 0.03 1.00 -0.08 0.00 -3.07 0.00 0.00 36.82 34.70 1up6 h ILE 172 CO -0.01 0.36 0.25 0.00 -0.69 0.00 0.00 178.15 178.06 1up6 h ALA 173 N 0.93 0.85 0.00 1.87 0.00 -0.55 -1.85 119.26 120.51 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 0.47 0.05 0.00 0.00 0.00 0.00 0.00 17.79 18.31 1up6 h ALA 173 CO 0.02 -0.18 0.00 0.39 0.00 0.00 0.00 179.25 179.48 1up6 n GLU 174 N -4.98 0.49 0.00 0.00 1.02 -0.83 -0.80 120.64 115.54 1up6 n GLU 174 Ca 0.10 0.00 0.00 0.00 -0.02 0.00 0.00 57.16 57.24 1up6 n GLU 174 Cb 0.30 -1.25 0.00 0.00 -0.02 0.00 0.00 31.44 30.46 1up6 n GLU 174 CO 0.00 0.00 0.00 1.19 1.18 0.00 0.00 177.13 179.50 1up6 n PHE 176 N 0.84 0.00 -3.36 -0.32 3.72 -0.70 -4.77 117.46 112.87 1up6 n PHE 176 Ca 0.00 0.00 -0.16 0.00 -0.05 0.00 0.00 57.45 57.24 1up6 n PHE 176 Cb 0.25 0.00 0.08 0.00 -0.94 0.00 0.00 39.48 38.87 1up6 n PHE 176 CO 0.00 0.00 0.00 0.45 -0.05 0.00 0.00 176.76 177.16 1up6 n SER 177 N 0.00 -2.48 -4.22 4.37 2.88 0.02 -5.03 113.62 109.17 1up6 n SER 177 Ca 0.00 -0.61 -0.19 0.00 -1.33 0.00 0.00 58.87 56.74 1up6 n SER 177 Cb 0.00 -4.97 -0.10 0.00 -0.75 0.00 0.00 64.21 58.39 1up6 n SER 177 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 1up6 s ALA 178 N -3.35 2.05 0.71 -1.46 0.00 -0.21 -5.14 121.76 114.36 1up6 s ALA 178 Ca 0.04 -1.79 -0.11 0.00 0.00 0.00 0.00 51.96 50.10 1up6 s ALA 178 Cb -0.01 0.98 0.02 0.00 0.00 0.00 0.00 23.12 24.11 1up6 s ALA 178 CO 0.70 -0.43 1.07 1.03 0.00 0.00 0.00 175.76 178.13 1up6 s ARG 179 N -3.91 2.78 0.26 0.00 0.52 -1.26 -4.57 118.95 112.77 1up6 s ARG 179 Ca 0.35 0.85 -0.03 0.00 -0.52 0.00 0.00 55.73 56.38 1up6 s ARG 179 Cb 0.07 -1.98 0.39 0.00 0.52 0.00 0.00 34.95 33.95 1up6 s ARG 179 CO 0.15 -1.18 1.87 -0.07 0.02 0.00 0.00 175.30 176.09 1up6 h LEU 180 N -0.78 0.99 -0.96 2.53 4.07 -1.94 -2.03 115.31 117.19 1up6 h LEU 180 Ca -0.45 0.01 0.00 0.00 0.08 0.00 0.00 57.88 57.53 1up6 h LEU 180 Cb 1.22 -0.20 0.00 0.00 1.08 0.00 0.00 40.66 42.76 1up6 h LEU 180 CO 0.58 0.63 0.00 -0.33 -1.08 0.00 0.00 178.44 178.24 1up6 h GLU 181 N 1.13 0.00 0.00 1.13 5.08 -1.97 -2.67 114.58 117.28 1up6 h GLU 181 Ca 0.42 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.78 1up6 h GLU 181 Cb 0.17 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.42 1up6 h GLU 181 CO -0.17 0.00 0.00 -0.25 -1.00 0.00 0.00 179.01 177.59 1up6 n ASP 182 N -2.65 0.02 -4.72 1.42 8.00 -0.76 -4.76 116.55 113.10 1up6 n ASP 182 Ca 0.02 0.50 -0.36 0.00 0.71 0.00 0.00 54.79 55.66 1up6 n ASP 182 Cb 0.29 -0.51 -0.07 0.00 -0.02 0.00 0.00 41.12 40.81 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 -3.01 5.33 -0.07 2.53 1.01 -1.01 -0.77 120.40 124.41 1up6 s VAL 183 Ca 0.10 0.46 -0.00 0.00 0.00 0.00 0.00 61.98 62.54 1up6 s VAL 183 Cb 0.14 -3.60 0.02 0.00 0.00 0.00 0.00 36.38 32.94 1up6 s VAL 183 CO 0.38 0.39 -0.04 0.12 0.00 0.00 0.00 175.10 175.95 1up6 s PHE 184 N 0.52 0.91 0.04 5.22 5.36 0.41 -5.00 117.98 125.44 1up6 s PHE 184 Ca 0.14 -0.32 0.07 0.00 -0.96 0.00 0.00 56.93 55.86 1up6 s PHE 184 Cb -0.13 -0.85 -0.03 0.00 -0.34 0.00 0.00 43.02 41.67 1up6 s PHE 184 CO 0.03 -0.31 -0.17 -0.51 -1.46 0.00 0.00 175.22 172.80 1up6 s LEU 185 N 1.43 2.67 -0.55 6.12 1.02 -1.26 -0.46 118.68 127.64 1up6 s LEU 185 Ca -0.02 -0.41 -0.22 0.00 0.02 0.00 0.00 54.13 53.50 1up6 s LEU 185 Cb -0.13 -1.55 0.05 0.00 0.02 0.00 0.00 46.19 44.58 1up6 s LEU 185 CO -0.03 0.25 0.82 -0.75 0.02 0.00 0.00 176.35 176.66 1up6 s LYS 186 N -1.48 3.21 -0.04 1.70 2.20 -0.18 -4.92 119.74 120.23 1up6 s LYS 186 Ca 0.15 -0.62 0.01 0.00 -0.36 0.00 0.00 55.97 55.15 1up6 s LYS 186 Cb -0.11 -4.10 0.02 0.00 -1.51 0.00 0.00 37.83 32.13 1up6 s LYS 186 CO 0.06 -1.43 -0.06 -0.47 -0.36 0.00 0.00 175.35 173.09 1up6 s TYR 187 N 3.42 0.80 -0.01 4.03 6.14 -1.26 -1.43 117.35 129.04 1up6 s TYR 187 Ca 0.23 -0.22 -0.28 0.00 0.64 0.00 0.00 57.07 57.43 1up6 s TYR 187 Cb -0.16 -0.66 0.09 0.00 0.42 0.00 0.00 41.96 41.64 1up6 s TYR 187 CO 0.15 -0.17 0.75 1.52 0.64 0.00 0.00 175.55 178.44 1up6 s TYR 188 N 0.71 -0.53 -5.00 4.97 1.13 -0.82 -4.27 117.35 113.54 1up6 s TYR 188 Ca -0.10 0.69 0.00 0.00 -1.41 0.00 0.00 57.07 56.25 1up6 s TYR 188 Cb -0.13 0.48 0.00 0.00 -1.10 0.00 0.00 41.96 41.20 1up6 s TYR 188 CO 0.01 -0.61 0.00 0.41 -2.51 0.00 0.00 175.55 172.85 1up6 n GLY 189 N 0.37 0.27 3.99 5.49 0.00 -1.24 -0.96 105.19 113.11 1up6 n GLY 189 Ca -0.15 -1.57 -0.19 0.00 0.00 0.00 0.00 46.02 44.11 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 3.86 0.20 0.99 1.02 -0.36 -0.57 118.68 123.82 1up6 s LEU 190 Ca 0.00 -0.14 -0.32 0.00 0.02 0.00 0.00 54.13 53.69 1up6 s LEU 190 Cb 0.00 -2.80 -0.12 0.00 0.02 0.00 0.00 46.19 43.29 1up6 s LEU 190 CO 0.00 -0.54 1.73 -3.20 0.02 0.00 0.00 176.35 174.37 1up6 n ASN 191 N -1.75 3.97 -1.88 2.29 4.05 -1.26 -0.40 115.26 120.27 1up6 n ASN 191 Ca 0.01 1.05 -0.19 0.00 0.45 0.00 0.00 54.58 55.91 1up6 n ASN 191 Cb 0.58 -1.56 -0.03 0.00 1.23 0.00 0.00 39.78 39.99 1up6 n ASN 191 CO 0.00 0.00 0.00 1.41 -3.05 0.00 0.00 177.26 175.62 1up6 n HIS 192 N 4.17 -0.58 -2.71 1.20 8.25 -1.26 -4.86 115.22 119.42 1up6 n HIS 192 Ca 0.16 0.00 -0.08 0.00 -0.26 0.00 0.00 57.72 57.55 1up6 n HIS 192 Cb 0.35 -3.48 0.10 0.00 1.12 0.00 0.00 29.99 28.08 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 -2.48 -2.08 -4.68 2.41 7.94 0.47 -4.62 117.00 113.97 1up6 n LEU 193 Ca -0.21 -3.51 -0.25 0.00 -1.11 0.00 0.00 56.01 50.93 1up6 n LEU 193 Cb 0.65 0.46 -0.08 0.00 0.53 0.00 0.00 43.42 44.98 1up6 n LEU 193 CO 0.27 1.96 -0.24 -0.94 -1.11 0.00 0.00 177.39 177.33 1up6 s SER 194 N -1.19 4.23 -0.07 1.96 1.04 -1.18 -1.22 113.70 117.27 1up6 s SER 194 Ca 0.22 -1.10 -0.06 0.00 0.48 0.00 0.00 55.95 55.48 1up6 s SER 194 Cb 0.34 -0.49 0.02 0.00 0.10 0.00 0.00 66.02 66.00 1up6 s SER 194 CO -0.07 -0.41 0.19 -0.36 0.98 0.00 0.00 173.24 173.57 1up6 s PHE 195 N -2.59 -0.22 -0.16 5.02 0.40 -0.13 -2.11 117.98 118.19 1up6 s PHE 195 Ca 0.38 0.53 -0.03 0.00 -0.60 0.00 0.00 56.93 57.21 1up6 s PHE 195 Cb 0.04 0.06 -0.02 0.00 0.51 0.00 0.00 43.02 43.61 1up6 s PHE 195 CO 0.20 -0.11 -0.07 0.42 0.70 0.00 0.00 175.22 176.37 1up6 s ILE 196 N 0.24 3.58 -0.17 0.64 1.01 0.15 -1.95 121.20 124.70 1up6 s ILE 196 Ca -0.01 -0.46 0.08 0.00 0.00 0.00 0.00 60.65 60.25 1up6 s ILE 196 Cb -0.02 -2.56 -0.16 0.00 0.01 0.00 0.00 42.46 39.73 1up6 s ILE 196 CO -0.01 0.49 -0.06 1.21 0.00 0.00 0.00 174.94 176.58 1up6 n GLU 197 N 3.68 1.03 -4.02 2.79 2.13 -0.51 -0.68 120.64 125.06 1up6 n GLU 197 Ca -0.18 0.05 -0.14 0.00 0.66 0.00 0.00 57.16 57.55 1up6 n GLU 197 Cb 0.52 -1.38 -0.14 0.00 0.27 0.00 0.00 31.44 30.71 1up6 n GLU 197 CO 0.00 0.00 0.00 0.15 -0.41 0.00 0.00 177.13 176.87 1up6 s LYS 198 N -2.37 0.23 -0.09 5.31 3.01 -1.24 -4.94 119.74 119.64 1up6 s LYS 198 Ca -0.16 -0.10 0.04 0.00 -1.01 0.00 0.00 55.97 54.73 1up6 s LYS 198 Cb 0.06 -0.22 0.00 0.00 -1.01 0.00 0.00 37.83 36.66 1up6 s LYS 198 CO 0.53 0.06 -0.23 0.08 0.51 0.00 0.00 175.35 176.30 1up6 s VAL 199 N -0.07 1.95 -0.05 3.17 1.01 -1.26 -1.01 120.40 124.14 1up6 s VAL 199 Ca 0.01 -0.96 0.05 0.00 0.00 0.00 0.00 61.98 61.08 1up6 s VAL 199 Cb -0.01 -1.69 -0.00 0.00 0.00 0.00 0.00 36.38 34.68 1up6 s VAL 199 CO -0.00 0.54 -0.19 -0.36 0.00 0.00 0.00 175.10 175.08 1up6 s PHE 200 N 0.35 1.91 -0.09 5.22 0.40 0.39 -1.55 117.98 124.60 1up6 s PHE 200 Ca -0.18 -0.57 0.02 0.00 -0.60 0.00 0.00 56.93 55.60 1up6 s PHE 200 Cb -0.17 -1.28 0.01 0.00 0.51 0.00 0.00 43.02 42.09 1up6 s PHE 200 CO 0.08 -0.19 -0.15 0.14 0.70 0.00 0.00 175.22 175.80 1up6 s VAL 201 N 0.03 1.41 -1.06 -0.44 -7.23 -0.36 -0.45 120.40 112.31 1up6 s VAL 201 Ca -0.05 -0.61 0.00 0.00 -1.81 0.00 0.00 61.98 59.51 1up6 s VAL 201 Cb -0.12 -1.28 0.00 0.00 0.56 0.00 0.00 36.38 35.53 1up6 s VAL 201 CO 0.03 0.42 0.00 0.29 -0.31 0.00 0.00 175.10 175.53 1up6 n LYS 202 N 3.99 -2.17 -0.00 4.82 5.02 0.05 -1.19 118.16 128.69 1up6 n LYS 202 Ca -0.20 0.60 0.00 0.00 -2.02 0.00 0.00 58.31 56.69 1up6 n LYS 202 Cb 0.52 -5.17 0.00 0.00 -0.02 0.00 0.00 35.03 30.36 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 -0.76 1.78 3.71 0.72 0.00 -1.26 -5.03 105.19 104.35 1up6 n GLY 203 Ca -0.14 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.46 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 -0.40 4.50 -0.39 1.61 2.12 -0.33 -5.01 118.70 120.80 1up6 s GLU 204 Ca 0.00 1.29 -0.28 0.00 0.36 0.00 0.00 54.97 56.33 1up6 s GLU 204 Cb 0.00 -3.48 -0.00 0.00 0.26 0.00 0.00 34.13 30.91 1up6 s GLU 204 CO 0.00 -0.08 1.58 0.34 -0.54 0.00 0.00 175.26 176.55 1up6 s ASP 205 N 0.99 6.12 -0.15 -1.70 -1.08 -1.26 -1.23 116.67 118.37 1up6 s ASP 205 Ca 0.48 0.98 0.17 0.00 -0.52 0.00 0.00 52.55 53.66 1up6 s ASP 205 Cb -0.20 -2.53 0.39 0.00 -1.46 0.00 0.00 42.92 39.12 1up6 s ASP 205 CO 0.24 -1.58 1.27 1.33 0.52 0.00 0.00 175.17 176.94 1up6 n VAL 206 N 7.21 2.03 -0.01 1.11 0.24 -0.60 -4.78 118.33 123.54 1up6 n VAL 206 Ca 0.19 -2.05 -0.09 0.00 -2.04 0.00 0.00 64.34 60.35 1up6 n VAL 206 Cb 0.48 -0.22 -0.03 0.00 -1.47 0.00 0.00 33.84 32.60 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 0.82 0.59 -0.83 3.34 2.02 -1.88 -0.86 112.91 116.12 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 1.18 0.59 -0.04 0.00 -1.74 0.00 0.00 68.15 68.14 1up6 h THR 207 CO 0.10 0.00 0.53 -0.08 0.37 0.00 0.00 175.52 176.44 1up6 h GLU 208 N -0.18 1.11 -0.80 6.66 4.57 -1.93 -1.52 114.58 122.50 1up6 h GLU 208 Ca 0.10 -0.08 0.00 0.00 -1.18 0.00 0.00 59.36 58.20 1up6 h GLU 208 Cb 0.32 -0.24 -0.04 0.00 -0.16 0.00 0.00 28.75 28.63 1up6 h GLU 208 CO -0.25 0.76 0.51 -0.22 -1.18 0.00 0.00 179.01 178.63 1up6 h LYS 209 N 1.14 1.07 -0.24 1.92 3.11 -1.76 -0.98 116.57 120.82 1up6 h LYS 209 Ca 0.30 -0.08 -0.00 0.00 -2.81 0.00 0.00 60.65 58.06 1up6 h LYS 209 Cb -0.09 -0.23 -0.01 0.00 -1.00 0.00 0.00 32.23 30.89 1up6 h LYS 209 CO -0.06 0.73 0.13 0.28 -2.81 0.00 0.00 179.45 177.72 1up6 h VAL 210 N 1.09 1.11 -0.82 2.00 2.07 -0.36 -1.50 116.25 119.84 1up6 h VAL 210 Ca 0.29 -0.28 0.06 0.00 0.82 0.00 0.00 66.70 67.60 1up6 h VAL 210 Cb -0.09 0.86 -0.06 0.00 -1.52 0.00 0.00 31.29 30.48 1up6 h VAL 210 CO -0.06 0.10 0.50 -0.26 0.02 0.00 0.00 177.57 177.88 1up6 h PHE 211 N 0.28 0.93 -0.81 1.57 0.04 -1.11 -1.81 116.94 116.03 1up6 h PHE 211 Ca 0.08 0.03 -0.02 0.00 2.80 0.00 0.00 57.97 60.86 1up6 h PHE 211 Cb 0.05 -0.30 -0.04 0.00 2.20 0.00 0.00 35.95 37.87 1up6 h PHE 211 CO -0.04 0.46 0.41 1.49 -0.60 0.00 0.00 178.31 180.03 1up6 h GLU 212 N 0.91 1.15 0.00 1.51 4.81 -0.71 -2.67 114.58 119.58 1up6 h GLU 212 Ca 0.36 -0.15 -0.10 0.00 -0.13 0.00 0.00 59.36 59.35 1up6 h GLU 212 Cb 0.19 -0.22 -0.01 0.00 0.63 0.00 0.00 28.75 29.34 1up6 h GLU 212 CO -0.18 0.87 -0.46 -0.97 -0.73 0.00 0.00 179.01 177.54 1up6 h ASN 213 N 1.15 0.00 -0.57 1.04 -0.00 -0.79 -3.18 115.58 113.23 1up6 h ASN 213 Ca 0.28 0.00 -0.09 0.00 -0.00 0.00 0.00 56.30 56.49 1up6 h ASN 213 Cb 0.08 0.00 -0.02 0.00 -0.00 0.00 0.00 38.32 38.37 1up6 h ASN 213 CO -0.04 0.46 0.01 -0.07 -0.00 0.00 0.00 177.43 177.79 1up6 h LEU 214 N 0.00 0.99 -2.28 0.34 4.07 -0.99 -2.63 115.31 114.82 1up6 h LEU 214 Ca -0.00 -0.27 -0.00 0.00 0.08 0.00 0.00 57.88 57.68 1up6 h LEU 214 Cb 0.98 -0.27 -0.00 0.00 1.08 0.00 0.00 40.66 42.45 1up6 h LEU 214 CO 0.06 1.04 -0.02 0.11 -1.08 0.00 0.00 178.44 178.55 1up6 h LYS 215 N 0.94 0.00 -2.07 1.13 1.57 -1.51 -3.51 116.57 113.12 1up6 h LYS 215 Ca 0.17 0.00 -0.52 0.00 -1.87 0.00 0.00 60.65 58.43 1up6 h LYS 215 Cb 0.53 0.00 -0.17 0.00 0.08 0.00 0.00 32.23 32.67 1up6 h LYS 215 CO 0.03 0.02 0.60 -0.11 -0.57 0.00 0.00 179.45 179.41 1up6 n LEU 216 N -3.18 6.62 -0.16 2.94 7.94 -1.00 -5.02 117.00 125.15 1up6 n LEU 216 Ca -0.02 -4.14 0.00 0.00 -1.11 0.00 0.00 56.01 50.75 1up6 n LEU 216 Cb 0.18 -1.25 0.00 0.00 0.53 0.00 0.00 43.42 42.88 1up6 n LEU 216 CO 0.24 1.77 0.00 -0.62 -1.11 0.00 0.00 177.39 177.67 1up6 n GLU 224 N 1.01 -0.31 -4.50 1.96 1.02 -1.26 -5.13 120.64 113.43 1up6 n GLU 224 Ca 0.50 0.00 -0.24 0.00 -0.02 0.00 0.00 57.16 57.40 1up6 n GLU 224 Cb 0.53 0.00 -0.10 0.00 -0.02 0.00 0.00 31.44 31.85 1up6 n GLU 224 CO 0.00 0.00 0.00 -0.51 1.18 0.00 0.00 177.13 177.80 1up6 s ASP 225 N 0.00 2.73 0.09 1.62 1.11 -1.26 -5.12 116.67 115.84 1up6 s ASP 225 Ca 0.00 -1.47 -0.31 0.00 0.18 0.00 0.00 52.55 50.95 1up6 s ASP 225 Cb 0.00 0.08 -0.08 0.00 1.07 0.00 0.00 42.92 43.98 1up6 s ASP 225 CO 0.00 -0.69 1.54 -0.36 1.18 0.00 0.00 175.17 176.84 1up6 s PHE 226 N -3.20 2.81 0.97 4.23 0.08 -1.26 -5.00 117.98 116.61 1up6 s PHE 226 Ca 0.31 0.60 -0.13 0.00 0.12 0.00 0.00 56.93 57.83 1up6 s PHE 226 Cb 0.07 -3.85 0.17 0.00 -0.57 0.00 0.00 43.02 38.84 1up6 s PHE 226 CO 0.14 -3.22 1.13 -1.25 -0.10 0.00 0.00 175.22 171.93 1up6 s PRO 227 N 1.95 0.69 0.13 0.24 0.04 -1.26 -4.95 135.00 131.84 1up6 s PRO 227 Ca 0.69 0.30 -0.22 0.00 0.04 0.00 0.00 61.00 61.81 1up6 s PRO 227 Cb -0.39 -1.79 -0.03 0.00 0.04 0.00 0.00 34.50 32.34 1up6 s PRO 227 CO 0.31 -2.51 1.67 1.15 0.04 0.00 0.00 177.00 177.66 1up6 h THR 228 N -1.72 0.62 -0.29 1.26 2.02 -1.95 -2.73 112.91 110.12 1up6 h THR 228 Ca -0.51 0.00 0.08 0.00 0.77 0.00 0.00 66.41 66.75 1up6 h THR 228 Cb 1.33 0.62 -0.01 0.00 -1.74 0.00 0.00 68.15 68.35 1up6 h THR 228 CO 0.58 0.00 0.27 4.11 0.37 0.00 0.00 175.52 180.85 1up6 h TRP 229 N -0.18 0.00 -0.48 3.16 5.08 -2.00 -1.66 115.95 119.87 1up6 h TRP 229 Ca 0.08 0.00 -0.01 0.00 1.08 0.00 0.00 58.89 60.05 1up6 h TRP 229 Cb 0.30 0.00 -0.02 0.00 -3.00 0.00 0.00 29.16 26.44 1up6 h TRP 229 CO -0.25 0.00 0.27 0.35 -1.28 0.00 0.00 178.44 177.53 1up6 h PHE 230 N 0.00 0.65 -0.02 0.12 3.57 -1.85 -0.22 116.94 119.19 1up6 h PHE 230 Ca 0.14 -0.01 -0.17 0.00 3.53 0.00 0.00 57.97 61.46 1up6 h PHE 230 Cb 0.68 -0.21 -0.01 0.00 2.79 0.00 0.00 35.95 39.19 1up6 h PHE 230 CO 0.00 0.48 -0.74 1.88 -2.23 0.00 0.00 178.31 177.70 1up6 h TYR 231 N 0.64 0.20 -0.42 0.41 0.05 -1.41 0.97 116.97 117.41 1up6 h TYR 231 Ca 0.17 -0.09 -0.04 0.00 0.05 0.00 0.00 58.73 58.82 1up6 h TYR 231 Cb 0.03 -0.03 -0.02 0.00 1.01 0.00 0.00 36.73 37.73 1up6 h TYR 231 CO -0.02 0.83 0.11 -0.44 -1.05 0.00 0.00 178.16 177.59 1up6 h ASP 232 N 0.09 0.63 0.25 3.88 3.32 -1.38 -1.58 116.42 121.63 1up6 h ASP 232 Ca -0.02 -0.22 -0.01 0.00 0.02 0.00 0.00 57.03 56.79 1up6 h ASP 232 Cb 1.30 -0.17 0.00 0.00 0.22 0.00 0.00 39.33 40.68 1up6 h ASP 232 CO 0.11 0.69 -0.12 0.28 -1.72 0.00 0.00 179.24 178.48 1up6 h SER 233 N 0.54 -0.28 0.83 6.45 0.02 -0.88 -3.36 113.55 116.87 1up6 h SER 233 Ca 0.13 -0.22 -0.20 0.00 -0.84 0.00 0.00 61.79 60.67 1up6 h SER 233 Cb 0.30 0.07 -0.02 0.00 0.14 0.00 0.00 62.40 62.89 1up6 h SER 233 CO -0.00 0.22 -0.92 0.58 -1.14 0.00 0.00 176.83 175.57 1up6 h VAL 234 N -0.95 1.61 -3.70 2.27 2.07 -0.94 -3.48 116.25 113.14 1up6 h VAL 234 Ca -0.03 -3.01 -0.39 0.00 0.82 0.00 0.00 66.70 64.08 1up6 h VAL 234 Cb 0.48 2.65 0.00 0.00 -1.52 0.00 0.00 31.29 32.91 1up6 h VAL 234 CO 0.06 0.86 -0.53 0.54 0.02 0.00 0.00 177.57 178.52 1up6 n ARG 235 N -3.50 -2.87 -4.26 1.57 1.74 -0.60 -4.99 116.66 103.75 1up6 n ARG 235 Ca -0.01 0.90 -0.18 0.00 -0.77 0.00 0.00 57.85 57.79 1up6 n ARG 235 Cb 0.86 -5.63 -0.13 0.00 -1.02 0.00 0.00 32.46 26.54 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 -6.22 2.19 -0.19 0.55 1.43 -1.26 -4.88 118.68 110.29 1up6 s LEU 236 Ca 0.12 -0.46 -0.19 0.00 -1.03 0.00 0.00 54.13 52.56 1up6 s LEU 236 Cb -0.05 -0.48 -0.03 0.00 0.03 0.00 0.00 46.19 45.65 1up6 s LEU 236 CO 0.15 -0.02 0.55 -0.63 0.23 0.00 0.00 176.35 176.62 1up6 s ILE 237 N -0.94 5.09 -0.01 -0.59 1.01 0.15 -4.87 121.20 121.04 1up6 s ILE 237 Ca -0.01 1.02 0.05 0.00 0.00 0.00 0.00 60.65 61.71 1up6 s ILE 237 Cb -0.08 -3.87 -0.03 0.00 0.01 0.00 0.00 42.46 38.49 1up6 s ILE 237 CO 0.01 0.17 -0.14 -0.69 0.00 0.00 0.00 174.94 174.29 1up6 s VAL 238 N 1.61 3.06 0.23 2.92 1.01 -1.26 0.32 120.40 128.28 1up6 s VAL 238 Ca 0.26 -0.87 -0.32 0.00 0.00 0.00 0.00 61.98 61.05 1up6 s VAL 238 Cb -0.16 -2.24 -0.13 0.00 0.00 0.00 0.00 36.38 33.85 1up6 s VAL 238 CO 0.10 0.49 1.43 -3.20 0.00 0.00 0.00 175.10 173.91 1up6 n ASN 239 N 1.97 2.80 -0.27 3.32 2.85 -0.90 -4.90 115.26 120.13 1up6 n ASN 239 Ca -0.17 1.14 0.29 0.00 -0.11 0.00 0.00 54.58 55.73 1up6 n ASN 239 Cb 0.52 -1.43 0.67 0.00 1.24 0.00 0.00 39.78 40.79 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 4.41 0.11 0.00 1.20 0.11 -1.95 -1.27 132.00 134.61 1up6 h PRO 240 Ca -0.45 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.65 1up6 h PRO 240 Cb 1.27 -0.02 0.00 0.00 0.11 0.00 0.00 31.00 32.36 1up6 h PRO 240 CO 0.77 0.07 0.00 1.88 -0.21 0.00 0.00 178.00 180.51 1up6 h TYR 241 N 0.11 0.00 0.00 0.65 0.05 -1.90 -2.41 116.97 113.46 1up6 h TYR 241 Ca 0.51 0.00 -0.00 0.00 0.05 0.00 0.00 58.73 59.29 1up6 h TYR 241 Cb 1.83 0.00 -0.00 0.00 1.01 0.00 0.00 36.73 39.57 1up6 h TYR 241 CO -0.00 0.00 -0.02 -0.07 -1.05 0.00 0.00 178.16 177.02 1up6 h LEU 242 N 0.00 0.00 -1.22 3.88 -0.00 -1.48 -2.84 115.31 113.65 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 0.25 0.00 -0.06 0.00 -0.00 0.00 0.00 40.66 40.85 1up6 h LEU 242 CO 0.00 0.02 0.57 0.03 -0.00 0.00 0.00 178.44 179.06 1up6 h ARG 243 N 0.00 0.83 -0.29 1.13 3.08 -1.63 0.14 114.38 117.63 1up6 h ARG 243 Ca -0.00 -0.05 0.06 0.00 0.07 0.00 0.00 59.98 60.06 1up6 h ARG 243 Cb 0.22 -0.19 -0.01 0.00 0.08 0.00 0.00 29.97 30.07 1up6 h ARG 243 CO 0.00 0.55 0.20 1.88 -1.07 0.00 0.00 179.97 181.54 1up6 h TYR 244 N 0.86 0.13 0.00 3.04 0.05 -1.73 -3.11 116.97 116.21 1up6 h TYR 244 Ca 0.41 0.00 -0.00 0.00 0.05 0.00 0.00 58.73 59.19 1up6 h TYR 244 Cb 0.44 -0.04 -0.00 0.00 1.01 0.00 0.00 36.73 38.13 1up6 h TYR 244 CO -0.00 0.07 -0.24 1.88 -1.05 0.00 0.00 178.16 178.82 1up6 h TYR 245 N 0.13 0.00 0.00 4.88 -1.99 -1.26 -3.31 116.97 115.42 1up6 h TYR 245 Ca 0.13 0.00 0.00 0.00 2.00 0.00 0.00 58.73 60.86 1up6 h TYR 245 Cb 0.37 0.00 0.00 0.00 2.00 0.00 0.00 36.73 39.10 1up6 h TYR 245 CO -0.00 0.05 0.00 1.28 -0.00 0.00 0.00 178.16 179.49 1up6 n LEU 246 N -4.70 2.04 0.00 3.88 7.99 0.31 -4.94 117.00 121.57 1up6 n LEU 246 Ca -0.04 -1.02 0.00 0.00 -0.01 0.00 0.00 56.01 54.94 1up6 n LEU 246 Cb 0.14 -0.44 0.00 0.00 -0.11 0.00 0.00 43.42 43.00 1up6 n LEU 246 CO 0.06 0.37 0.00 1.21 -1.51 0.00 0.00 177.39 177.51 1up6 n GLU 248 N 0.39 0.00 0.03 3.23 2.13 -1.20 -5.03 120.64 120.18 1up6 n GLU 248 Ca 0.00 0.00 -0.11 0.00 0.66 0.00 0.00 57.16 57.71 1up6 n GLU 248 Cb 0.37 0.00 -0.05 0.00 0.27 0.00 0.00 31.44 32.02 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 -0.06 -0.98 5.31 1.57 -1.91 -1.04 116.57 119.46 1up6 h LYS 249 Ca 0.00 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 1up6 h LYS 249 Cb 0.00 0.01 0.00 0.00 0.08 0.00 0.00 32.23 32.32 1up6 h LYS 249 CO 0.00 -0.04 0.00 1.17 -0.57 0.00 0.00 179.45 180.01 1up6 n LYS 250 N -5.17 0.42 0.00 3.15 3.00 -1.26 -2.10 118.16 116.20 1up6 n LYS 250 Ca -0.05 0.00 0.00 0.00 -0.00 0.00 0.00 58.31 58.26 1up6 n LYS 250 Cb 0.10 -1.25 0.00 0.00 0.00 0.00 0.00 35.03 33.88 1up6 n LYS 250 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.40 177.74 1up6 n PHE 252 N 0.53 0.00 0.15 5.64 7.35 -0.39 -2.13 117.46 128.62 1up6 n PHE 252 Ca 0.00 0.00 0.02 0.00 -0.76 0.00 0.00 57.45 56.71 1up6 n PHE 252 Cb 0.15 0.00 0.35 0.00 0.35 0.00 0.00 39.48 40.33 1up6 n PHE 252 CO 0.00 0.00 0.00 1.57 -0.76 0.00 0.00 176.76 177.57 1up6 h LYS 253 N 0.00 0.10 -0.14 -4.13 2.10 -1.67 -1.65 116.57 111.19 1up6 h LYS 253 Ca 0.00 -0.04 -0.04 0.00 -2.00 0.00 0.00 60.65 58.57 1up6 h LYS 253 Cb 0.00 -0.01 -0.00 0.00 -0.90 0.00 0.00 32.23 31.32 1up6 h LYS 253 CO 0.00 0.41 -0.09 -0.22 -2.00 0.00 0.00 179.45 177.55 1up6 h LYS 254 N 0.09 0.30 -0.17 0.07 3.64 -1.71 -3.14 116.57 115.66 1up6 h LYS 254 Ca 0.01 -0.14 -0.09 0.00 -1.27 0.00 0.00 60.65 59.16 1up6 h LYS 254 Cb 0.61 -0.00 -0.01 0.00 -0.41 0.00 0.00 32.23 32.41 1up6 h LYS 254 CO 0.04 0.65 -0.29 0.82 -2.27 0.00 0.00 179.45 178.41 1up6 h ILE 255 N -0.05 1.26 -0.01 2.00 2.04 -1.82 -3.22 117.51 117.72 1up6 h ILE 255 Ca 0.03 -1.25 0.00 0.00 1.00 0.00 0.00 64.86 64.64 1up6 h ILE 255 Cb 0.57 1.46 0.00 0.00 -0.74 0.00 0.00 36.82 38.11 1up6 h ILE 255 CO 0.02 0.38 -0.27 -1.54 0.00 0.00 0.00 178.15 176.75 1up6 n SER 256 N -4.12 0.79 -0.36 1.72 3.41 -0.63 -3.69 113.62 110.74 1up6 n SER 256 Ca -0.01 -0.66 0.03 0.00 -0.26 0.00 0.00 58.87 57.97 1up6 n SER 256 Cb 0.40 0.10 0.08 0.00 -0.26 0.00 0.00 64.21 64.53 1up6 n SER 256 CO 0.00 0.00 0.00 0.35 -0.16 0.00 0.00 175.04 175.23 1up6 n THR 257 N -0.90 0.79 -4.22 6.66 -2.24 -1.19 -5.01 114.28 108.18 1up6 n THR 257 Ca 0.11 -0.90 -0.13 0.00 -2.27 0.00 0.00 64.05 60.87 1up6 n THR 257 Cb 0.33 0.63 -0.10 0.00 -2.10 0.00 0.00 70.33 69.09 1up6 n THR 257 CO 0.00 0.00 0.00 -1.00 -0.57 0.00 0.00 175.07 173.50 1up6 s HIS 258 N -0.91 1.13 0.40 4.78 3.76 -1.24 -5.08 115.29 118.13 1up6 s HIS 258 Ca 0.13 -1.07 -0.27 0.00 -0.15 0.00 0.00 55.06 53.70 1up6 s HIS 258 Cb 0.07 -0.65 -0.10 0.00 1.11 0.00 0.00 32.58 33.01 1up6 s HIS 258 CO 0.09 -0.28 1.36 -0.85 -0.85 0.00 0.00 174.74 174.22 1up6 n GLU 259 N -0.21 2.23 -1.72 1.40 0.28 -1.26 -4.93 120.64 116.43 1up6 n GLU 259 Ca -0.06 0.79 -0.43 0.00 -0.16 0.00 0.00 57.16 57.30 1up6 n GLU 259 Cb 0.63 -2.49 -0.02 0.00 1.43 0.00 0.00 31.44 30.99 1up6 n GLU 259 CO 0.00 0.00 0.00 1.28 -0.16 0.00 0.00 177.13 178.25 1up6 n LEU 260 N 0.32 3.98 -0.31 -1.84 4.77 -1.26 -4.91 117.00 117.75 1up6 n LEU 260 Ca 0.04 1.14 0.09 0.00 -0.03 0.00 0.00 56.01 57.25 1up6 n LEU 260 Cb 0.39 -1.55 0.25 0.00 -2.33 0.00 0.00 43.42 40.18 1up6 n LEU 260 CO 0.61 -0.03 1.12 -0.09 -1.33 0.00 0.00 177.39 177.67 1up6 h ARG 261 N 4.75 0.63 -1.00 3.23 1.12 -1.94 -1.41 114.38 119.75 1up6 h ARG 261 Ca -0.46 -0.04 0.21 0.00 -1.11 0.00 0.00 59.98 58.58 1up6 h ARG 261 Cb 1.24 -0.14 -0.11 0.00 -0.01 0.00 0.00 29.97 30.94 1up6 h ARG 261 CO 0.79 0.42 0.61 0.00 -3.11 0.00 0.00 179.97 178.68 1up6 h ALA 262 N 1.58 1.74 -0.52 2.80 0.00 -1.91 0.64 119.26 123.59 1up6 h ALA 262 Ca 0.49 0.09 -0.03 0.00 0.00 0.00 0.00 54.91 55.47 1up6 h ALA 262 Cb 0.72 -0.05 -0.02 0.00 0.00 0.00 0.00 17.79 18.44 1up6 h ALA 262 CO -0.37 -0.15 0.21 0.00 0.00 0.00 0.00 179.25 178.94 1up6 h ARG 263 N 0.69 0.78 -0.31 0.00 2.47 -1.62 -2.86 114.38 113.53 1up6 h ARG 263 Ca 0.60 -0.14 0.01 0.00 -1.26 0.00 0.00 59.98 59.19 1up6 h ARG 263 Cb 1.03 -0.13 -0.02 0.00 -1.65 0.00 0.00 29.97 29.20 1up6 h ARG 263 CO -0.41 0.68 0.18 0.93 0.56 0.00 0.00 179.97 181.91 1up6 h GLU 264 N 0.70 0.36 -1.04 0.04 5.08 -0.91 -2.48 114.58 116.34 1up6 h GLU 264 Ca 0.17 -0.02 0.00 0.00 -1.00 0.00 0.00 59.36 58.51 1up6 h GLU 264 Cb 0.19 -0.08 0.00 0.00 0.50 0.00 0.00 28.75 29.36 1up6 h GLU 264 CO -0.01 0.24 0.00 0.28 -1.00 0.00 0.00 179.01 178.51 1up6 n VAL 265 N -4.92 0.00 0.00 3.13 0.31 -0.23 -1.46 118.33 115.17 1up6 n VAL 265 Ca -0.01 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.32 1up6 n VAL 265 Cb 0.05 -0.25 0.00 0.00 -0.91 0.00 0.00 33.84 32.73 1up6 n VAL 265 CO 0.00 0.00 0.00 0.29 -1.32 0.00 0.00 176.83 175.80 1up6 n LYS 267 N 0.73 0.00 -0.23 5.55 5.02 -0.93 -0.12 118.16 128.19 1up6 n LYS 267 Ca 0.00 0.00 -0.04 0.00 -2.02 0.00 0.00 58.31 56.25 1up6 n LYS 267 Cb 0.00 0.00 0.12 0.00 -0.02 0.00 0.00 35.03 35.13 1up6 n LYS 267 CO 0.00 0.00 0.00 0.82 -0.52 0.00 0.00 177.40 177.70 1up6 h ILE 268 N 0.00 1.25 0.00 -0.18 2.04 -1.53 -2.14 117.51 116.95 1up6 h ILE 268 Ca 0.00 -0.81 -0.01 0.00 1.00 0.00 0.00 64.86 65.04 1up6 h ILE 268 Cb 0.00 0.44 -0.00 0.00 -0.74 0.00 0.00 36.82 36.52 1up6 h ILE 268 CO 0.00 0.32 -0.04 1.05 0.00 0.00 0.00 178.15 179.49 1up6 h GLU 269 N 1.02 0.00 -0.00 2.37 4.11 -0.79 -2.49 114.58 118.81 1up6 h GLU 269 Ca 0.23 0.00 -0.18 0.00 0.07 0.00 0.00 59.36 59.48 1up6 h GLU 269 Cb 0.24 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 29.47 1up6 h GLU 269 CO -0.01 0.04 -0.83 -0.22 0.07 0.00 0.00 179.01 178.06 1up6 h LYS 270 N 0.00 0.09 -0.02 1.06 3.64 -1.72 -1.87 116.57 117.75 1up6 h LYS 270 Ca -0.00 -0.10 -0.21 0.00 -1.27 0.00 0.00 60.65 59.08 1up6 h LYS 270 Cb 1.03 0.03 -0.00 0.00 -0.41 0.00 0.00 32.23 32.87 1up6 h LYS 270 CO 0.00 0.86 -0.87 1.49 -2.27 0.00 0.00 179.45 178.67 1up6 h GLU 271 N 0.05 0.34 -0.22 1.90 4.81 -1.31 -3.16 114.58 117.00 1up6 h GLU 271 Ca -0.02 -0.35 -0.14 0.00 -0.13 0.00 0.00 59.36 58.72 1up6 h GLU 271 Cb 1.44 0.09 0.00 0.00 0.63 0.00 0.00 28.75 30.92 1up6 h GLU 271 CO 0.12 1.02 -0.41 -0.07 -0.73 0.00 0.00 179.01 178.94 1up6 h LEU 272 N 0.20 0.73 -1.27 1.64 3.38 -1.42 -2.79 115.31 115.79 1up6 h LEU 272 Ca -0.06 -0.54 -0.03 0.00 0.09 0.00 0.00 57.88 57.34 1up6 h LEU 272 Cb 1.49 -0.21 -0.02 0.00 0.09 0.00 0.00 40.66 42.00 1up6 h LEU 272 CO 0.14 1.14 0.15 -0.26 0.09 0.00 0.00 178.44 179.70 1up6 h PHE 273 N 0.36 0.65 0.00 1.13 0.04 -1.42 0.53 116.94 118.23 1up6 h PHE 273 Ca 0.01 -0.04 0.00 0.00 2.80 0.00 0.00 57.97 60.74 1up6 h PHE 273 Cb 1.01 -0.20 0.00 0.00 2.20 0.00 0.00 35.95 38.96 1up6 h PHE 273 CO 0.09 0.54 0.00 0.39 -0.60 0.00 0.00 178.31 178.72 1up6 n GLU 274 N -4.34 0.25 0.06 1.51 -0.58 -1.19 -3.54 120.64 112.81 1up6 n GLU 274 Ca 0.03 0.23 -0.23 0.00 -0.42 0.00 0.00 57.16 56.77 1up6 n GLU 274 Cb 0.17 -1.80 -0.15 0.00 -0.57 0.00 0.00 31.44 29.09 1up6 n GLU 274 CO 0.00 0.00 0.00 -0.22 -0.48 0.00 0.00 177.13 176.43 1up6 h LYS 275 N 0.00 0.35 -0.06 3.49 1.63 -0.77 -3.34 116.57 117.88 1up6 h LYS 275 Ca 0.00 -0.61 0.02 0.00 -0.85 0.00 0.00 60.65 59.21 1up6 h LYS 275 Cb 0.70 0.23 -0.00 0.00 -0.60 0.00 0.00 32.23 32.55 1up6 h LYS 275 CO 0.00 1.29 0.11 1.88 -3.45 0.00 0.00 179.45 179.28 1up6 h TYR 276 N -0.04 0.00 -0.28 1.91 0.05 -1.02 -2.21 116.97 115.37 1up6 h TYR 276 Ca -0.32 0.00 0.03 0.00 0.05 0.00 0.00 58.73 58.49 1up6 h TYR 276 Cb 1.98 0.00 -0.01 0.00 1.01 0.00 0.00 36.73 39.70 1up6 h TYR 276 CO 0.12 0.00 0.19 0.00 -1.05 0.00 0.00 178.16 177.42 1up6 h ARG 277 N 0.00 0.24 0.00 4.88 3.08 -1.68 -3.30 114.38 117.60 1up6 h ARG 277 Ca 0.03 -0.01 0.00 0.00 0.07 0.00 0.00 59.98 60.06 1up6 h ARG 277 Cb 0.26 -0.05 0.00 0.00 0.08 0.00 0.00 29.97 30.25 1up6 h ARG 277 CO -0.00 0.16 0.00 -2.37 -1.07 0.00 0.00 179.97 176.69 1up6 n THR 278 N -4.49 0.00 -2.29 2.04 5.66 -0.92 -5.03 114.28 109.25 1up6 n THR 278 Ca 0.02 -0.36 -0.42 0.00 -3.05 0.00 0.00 64.05 60.25 1up6 n THR 278 Cb 0.18 1.08 -0.03 0.00 -1.55 0.00 0.00 70.33 70.00 1up6 n THR 278 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 1up6 s ALA 279 N -0.52 3.49 -0.87 1.79 0.00 -0.88 -4.91 121.76 119.86 1up6 s ALA 279 Ca 0.00 1.01 0.23 0.00 0.00 0.00 0.00 51.96 53.20 1up6 s ALA 279 Cb 0.00 -3.47 0.09 0.00 0.00 0.00 0.00 23.12 19.74 1up6 s ALA 279 CO 0.00 -0.49 1.10 1.33 0.00 0.00 0.00 175.76 177.69 1up6 n VAL 280 N 3.26 0.05 -4.02 0.00 0.24 -1.26 -4.98 118.33 111.62 1up6 n VAL 280 Ca 0.08 -0.08 -0.08 0.00 -2.04 0.00 0.00 64.34 62.22 1up6 n VAL 280 Cb 0.44 0.51 -0.10 0.00 -1.47 0.00 0.00 33.84 33.21 1up6 n VAL 280 CO 0.00 0.00 0.00 -0.70 -2.14 0.00 0.00 176.83 173.99 1up6 s GLU 281 N -3.07 0.47 0.14 7.34 2.12 -1.26 -4.81 118.70 119.62 1up6 s GLU 281 Ca 0.07 -0.88 -0.31 0.00 0.36 0.00 0.00 54.97 54.21 1up6 s GLU 281 Cb 0.16 0.17 -0.11 0.00 0.26 0.00 0.00 34.13 34.61 1up6 s GLU 281 CO 0.80 -0.09 1.82 -0.89 -0.54 0.00 0.00 175.26 176.36 1up6 n ILE 282 N 0.89 0.30 -1.23 -3.70 2.08 -1.26 -5.00 119.36 111.43 1up6 n ILE 282 Ca -0.19 -0.05 -0.03 0.00 0.56 0.00 0.00 62.75 63.04 1up6 n ILE 282 Cb 0.58 -2.10 0.02 0.00 -0.75 0.00 0.00 39.64 37.39 1up6 n ILE 282 CO 0.00 0.00 0.00 -2.65 0.56 0.00 0.00 176.55 174.46 1up6 n PRO 283 N 5.34 -0.04 -2.59 0.38 -0.02 -1.26 -5.22 135.00 131.60 1up6 n PRO 283 Ca 0.18 -0.20 -0.42 0.00 -2.02 0.00 0.00 63.50 61.04 1up6 n PRO 283 Cb 0.37 -0.12 -0.02 0.00 -0.02 0.00 0.00 33.50 33.71 1up6 n PRO 283 CO 0.00 0.00 0.00 -1.21 1.98 0.00 0.00 175.50 176.27 1up6 s GLU 284 N -3.19 3.76 0.00 -0.52 8.01 -1.26 -5.18 118.70 120.32 1up6 s GLU 284 Ca 0.07 -1.52 0.00 0.00 0.01 0.00 0.00 54.97 53.53 1up6 s GLU 284 Cb -0.00 -5.41 0.00 0.00 -4.31 0.00 0.00 34.13 24.41 1up6 s GLU 284 CO 0.05 -2.21 0.00 0.43 0.01 0.00 0.00 175.26 173.54 1up6 n SER 295 N 8.56 0.00 0.00 -0.19 7.64 -1.26 -5.18 113.62 123.19 1up6 n SER 295 Ca 0.39 0.00 0.00 0.00 1.01 0.00 0.00 58.87 60.27 1up6 n SER 295 Cb 0.49 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.69 1up6 n SER 295 CO 0.00 0.00 0.00 1.07 -3.01 0.00 0.00 175.04 173.10 1up6 n THR 296 N -1.83 0.00 -0.21 0.44 5.66 -1.26 -4.27 114.28 112.81 1up6 n THR 296 Ca 0.00 0.00 -0.08 0.00 -3.05 0.00 0.00 64.05 60.92 1up6 n THR 296 Cb 0.00 0.20 0.04 0.00 -1.55 0.00 0.00 70.33 69.02 1up6 n THR 296 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 1up6 h ALA 297 N 0.00 0.88 0.25 1.79 0.00 -1.99 -2.49 119.26 117.70 1up6 h ALA 297 Ca 0.00 -0.30 -0.01 0.00 0.00 0.00 0.00 54.91 54.60 1up6 h ALA 297 Cb 0.00 -0.23 0.00 0.00 0.00 0.00 0.00 17.79 17.56 1up6 h ALA 297 CO 0.00 0.67 -0.12 0.00 0.00 0.00 0.00 179.25 179.80 1up6 h ALA 298 N 1.03 -0.34 0.18 0.00 0.00 -1.98 -1.87 119.26 116.29 1up6 h ALA 298 Ca 0.18 -0.13 -0.00 0.00 0.00 0.00 0.00 54.91 54.96 1up6 h ALA 298 Cb 0.52 0.13 -0.01 0.00 0.00 0.00 0.00 17.79 18.43 1up6 h ALA 298 CO 0.03 -0.61 -0.14 0.00 0.00 0.00 0.00 179.25 178.53 1up6 h ALA 299 N 0.20 -0.30 -0.79 0.00 0.00 -1.82 -1.91 119.26 114.64 1up6 h ALA 299 Ca -0.03 -0.05 0.04 0.00 0.00 0.00 0.00 54.91 54.87 1up6 h ALA 299 Cb 0.38 0.19 -0.05 0.00 0.00 0.00 0.00 17.79 18.31 1up6 h ALA 299 CO 0.06 -0.69 0.52 0.45 0.00 0.00 0.00 179.25 179.59 1up6 h HIS 300 N -0.33 0.91 0.19 0.00 3.86 -1.48 -0.41 115.15 117.90 1up6 h HIS 300 Ca -0.01 0.02 -0.01 0.00 -1.16 0.00 0.00 60.37 59.22 1up6 h HIS 300 Cb 0.29 -0.30 0.00 0.00 1.06 0.00 0.00 27.41 28.46 1up6 h HIS 300 CO -0.11 0.51 -0.09 1.25 0.86 0.00 0.00 177.93 180.35 1up6 h LEU 301 N 0.93 -0.22 -0.94 2.43 5.85 -1.16 -0.75 115.31 121.45 1up6 h LEU 301 Ca 0.32 -0.21 0.07 0.00 0.84 0.00 0.00 57.88 58.90 1up6 h LEU 301 Cb 0.11 0.06 -0.07 0.00 0.37 0.00 0.00 40.66 41.13 1up6 h LEU 301 CO -0.10 0.10 0.59 0.40 -0.34 0.00 0.00 178.44 179.09 1up6 h ILE 302 N -0.55 1.05 -0.18 4.05 2.04 -1.05 0.26 117.51 123.13 1up6 h ILE 302 Ca -0.03 -0.37 -0.01 0.00 1.00 0.00 0.00 64.86 65.46 1up6 h ILE 302 Cb 0.41 -0.11 -0.01 0.00 -0.74 0.00 0.00 36.82 36.38 1up6 h ILE 302 CO 0.04 0.20 0.08 -0.09 0.00 0.00 0.00 178.15 178.38 1up6 h ARG 303 N 1.07 0.26 0.00 2.37 1.12 -1.01 -1.86 114.38 116.33 1up6 h ARG 303 Ca 0.41 -0.04 -0.00 0.00 -1.11 0.00 0.00 59.98 59.24 1up6 h ARG 303 Cb 0.19 -0.05 -0.00 0.00 -0.01 0.00 0.00 29.97 30.11 1up6 h ARG 303 CO -0.18 0.31 -0.00 -0.44 -3.11 0.00 0.00 179.97 176.55 1up6 h ASP 304 N 0.15 0.00 0.85 -3.80 3.32 -0.45 -1.94 116.42 114.55 1up6 h ASP 304 Ca 0.06 0.00 -0.09 0.00 0.02 0.00 0.00 57.03 57.02 1up6 h ASP 304 Cb 0.14 0.00 -0.01 0.00 0.22 0.00 0.00 39.33 39.68 1up6 h ASP 304 CO -0.01 0.00 -0.45 -0.07 -1.72 0.00 0.00 179.24 177.00 1up6 h LEU 305 N 0.00 0.00 0.06 1.55 4.07 -0.28 -3.30 115.31 117.40 1up6 h LEU 305 Ca -0.00 0.00 -0.31 0.00 0.08 0.00 0.00 57.88 57.65 1up6 h LEU 305 Cb 0.73 0.00 -0.03 0.00 1.08 0.00 0.00 40.66 42.44 1up6 h LEU 305 CO 0.00 0.45 -1.76 -0.33 -1.08 0.00 0.00 178.44 175.72 1up6 h GLU 306 N 0.00 0.12 0.00 1.13 4.39 -0.61 0.13 114.58 119.74 1up6 h GLU 306 Ca -0.00 -0.20 -0.45 0.00 0.34 0.00 0.00 59.36 59.05 1up6 h GLU 306 Cb 0.99 0.08 0.07 0.00 -0.10 0.00 0.00 28.75 29.79 1up6 h GLU 306 CO 0.06 0.82 0.09 0.25 -1.16 0.00 0.00 179.01 179.07 1up6 n THR 307 N -3.25 0.00 -1.07 1.13 -2.24 -0.85 -4.76 114.28 103.25 1up6 n THR 307 Ca -0.21 -1.55 0.09 0.00 -2.27 0.00 0.00 64.05 60.11 1up6 n THR 307 Cb 1.05 -0.87 0.18 0.00 -2.10 0.00 0.00 70.33 68.59 1up6 n THR 307 CO 0.00 0.00 0.00 -0.67 -0.57 0.00 0.00 175.07 173.83 1up6 n ASP 308 N -2.85 2.81 -0.03 3.42 2.03 -1.26 -1.21 116.55 119.47 1up6 n ASP 308 Ca 0.16 -3.10 -0.13 0.00 0.52 0.00 0.00 54.79 52.23 1up6 n ASP 308 Cb 0.57 -0.47 -0.09 0.00 -0.72 0.00 0.00 41.12 40.40 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 0.60 0.11 -0.90 -0.67 5.08 -1.90 -3.47 114.58 113.43 1up6 h GLU 309 Ca 0.00 -0.06 0.00 0.00 -1.00 0.00 0.00 59.36 58.31 1up6 h GLU 309 Cb 1.15 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.40 1up6 h GLU 309 CO 0.08 0.57 0.00 0.41 -1.00 0.00 0.00 179.01 179.06 1up6 n GLY 310 N 0.22 -0.77 3.06 -3.84 0.00 -1.24 -5.06 105.19 97.55 1up6 n GLY 310 Ca -0.08 -0.80 -0.10 0.00 0.00 0.00 0.00 46.02 45.04 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 -1.28 0.53 -0.16 1.61 -0.14 -0.52 -4.92 119.74 114.86 1up6 s LYS 311 Ca 0.00 -0.93 -0.18 0.00 -1.36 0.00 0.00 55.97 53.50 1up6 s LYS 311 Cb 0.00 0.00 -0.04 0.00 -1.68 0.00 0.00 37.83 36.12 1up6 s LYS 311 CO 0.00 -0.04 0.50 0.42 -0.76 0.00 0.00 175.35 175.46 1up6 s ILE 312 N -2.50 5.15 -0.03 2.17 -1.09 -1.26 -0.36 121.20 123.29 1up6 s ILE 312 Ca -0.04 0.95 0.02 0.00 -2.23 0.00 0.00 60.65 59.35 1up6 s ILE 312 Cb -0.02 -3.83 0.01 0.00 -1.58 0.00 0.00 42.46 37.04 1up6 s ILE 312 CO -0.04 0.25 -0.07 -1.00 -1.23 0.00 0.00 174.94 172.85 1up6 s HIS 313 N 1.14 0.83 -0.18 3.97 3.76 -0.13 -4.93 115.29 119.75 1up6 s HIS 313 Ca 0.25 -0.20 -0.24 0.00 -0.15 0.00 0.00 55.06 54.72 1up6 s HIS 313 Cb -0.15 -0.61 -0.02 0.00 1.11 0.00 0.00 32.58 32.91 1up6 s HIS 313 CO 0.10 -0.10 0.77 0.42 -0.85 0.00 0.00 174.74 175.07 1up6 s ILE 314 N 0.30 4.92 -0.03 0.60 1.01 -1.26 0.23 121.20 126.97 1up6 s ILE 314 Ca -0.04 1.49 -0.15 0.00 0.00 0.00 0.00 60.65 61.94 1up6 s ILE 314 Cb -0.09 -4.07 0.03 0.00 0.01 0.00 0.00 42.46 38.33 1up6 s ILE 314 CO 0.00 0.05 0.34 -0.69 0.00 0.00 0.00 174.94 174.64 1up6 s VAL 315 N 2.09 0.05 -0.31 2.92 1.01 -0.35 -4.85 120.40 120.96 1up6 s VAL 315 Ca 0.35 -0.39 -0.26 0.00 0.00 0.00 0.00 61.98 61.67 1up6 s VAL 315 Cb -0.16 -0.62 0.01 0.00 0.00 0.00 0.00 36.38 35.61 1up6 s VAL 315 CO 0.12 -0.22 0.94 0.20 0.00 0.00 0.00 175.10 176.14 1up6 s ASN 316 N -1.14 6.81 0.37 3.32 0.01 0.00 -1.20 114.94 123.11 1up6 s ASN 316 Ca -0.12 0.86 -0.15 0.00 -0.71 0.00 0.00 52.86 52.74 1up6 s ASN 316 Cb -0.05 -2.48 0.05 0.00 0.41 0.00 0.00 41.25 39.18 1up6 s ASN 316 CO 0.04 -0.76 0.76 0.28 -1.51 0.00 0.00 177.10 175.91 1up6 s THR 317 N 3.32 0.00 0.30 1.60 -1.32 -0.44 -3.18 115.64 115.93 1up6 s THR 317 Ca 0.39 -1.05 -0.29 0.00 -1.21 0.00 0.00 61.69 59.53 1up6 s THR 317 Cb -0.13 -2.79 -0.10 0.00 -1.51 0.00 0.00 72.50 67.97 1up6 s THR 317 CO 0.14 0.00 1.36 -0.13 -2.21 0.00 0.00 174.62 173.78 1up6 s ARG 318 N -2.50 4.31 0.13 7.08 0.52 -1.26 -0.19 118.95 127.04 1up6 s ARG 318 Ca 0.16 2.26 -0.31 0.00 -0.52 0.00 0.00 55.73 57.33 1up6 s ARG 318 Cb -0.05 -3.08 -0.09 0.00 0.52 0.00 0.00 34.95 32.26 1up6 s ARG 318 CO 0.12 -0.29 1.57 -0.97 0.02 0.00 0.00 175.30 175.74 1up6 h ASN 319 N 3.95 -1.55 -6.79 0.23 -1.24 -0.21 -3.45 115.58 106.53 1up6 h ASN 319 Ca -0.48 0.20 -0.56 0.00 0.71 0.00 0.00 56.30 56.17 1up6 h ASN 319 Cb 1.22 0.62 -0.07 0.00 0.73 0.00 0.00 38.32 40.82 1up6 h ASN 319 CO 0.70 -0.45 -0.96 0.59 -1.29 0.00 0.00 177.43 176.02 1up6 n ASN 320 N -5.43 -1.70 0.00 1.15 5.03 -0.25 -1.57 115.26 112.49 1up6 n ASN 320 Ca -0.05 -1.19 0.00 0.00 0.87 0.00 0.00 54.58 54.22 1up6 n ASN 320 Cb 0.37 -2.20 0.00 0.00 -1.02 0.00 0.00 39.78 36.93 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 -2.18 0.94 0.12 7.41 0.00 -1.26 -4.88 105.19 105.34 1up6 n GLY 321 Ca -0.23 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 45.69 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 0.29 -3.72 1.61 0.87 -1.47 -3.35 113.55 107.78 1up6 h SER 322 Ca 0.00 -0.08 -0.69 0.00 -1.23 0.00 0.00 61.79 59.80 1up6 h SER 322 Cb 0.00 -0.07 -0.32 0.00 -0.44 0.00 0.00 62.40 61.56 1up6 h SER 322 CO 0.00 0.28 -0.67 -0.63 -0.53 0.00 0.00 176.83 175.29 1up6 s ILE 323 N -5.90 3.16 -0.73 2.23 -1.09 -1.26 -0.49 121.20 117.12 1up6 s ILE 323 Ca -0.13 -1.43 0.17 0.00 -2.23 0.00 0.00 60.65 57.03 1up6 s ILE 323 Cb 0.08 -2.86 0.16 0.00 -1.58 0.00 0.00 42.46 38.27 1up6 s ILE 323 CO 0.70 -0.19 1.52 -1.84 -1.23 0.00 0.00 174.94 173.90 1up6 n GLU 324 N 4.65 0.09 0.04 2.79 0.28 -0.79 -2.35 120.64 125.35 1up6 n GLU 324 Ca -0.12 0.38 0.13 0.00 -0.16 0.00 0.00 57.16 57.39 1up6 n GLU 324 Cb 0.43 -1.68 0.38 0.00 1.43 0.00 0.00 31.44 32.00 1up6 n GLU 324 CO 0.00 0.00 0.00 -1.71 -0.16 0.00 0.00 177.13 175.26 1up6 n ASN 325 N -1.85 0.47 -4.39 -1.84 5.15 -1.26 -4.89 115.26 106.65 1up6 n ASN 325 Ca 0.02 0.25 -0.26 0.00 -0.60 0.00 0.00 54.58 53.99 1up6 n ASN 325 Cb 0.16 -0.24 -0.12 0.00 -0.53 0.00 0.00 39.78 39.05 1up6 n ASN 325 CO 0.00 0.00 0.00 -0.76 1.40 0.00 0.00 177.26 177.90 1up6 s LEU 326 N -3.65 2.41 0.51 1.20 1.02 -0.99 -4.99 118.68 114.19 1up6 s LEU 326 Ca 0.11 -0.84 -0.22 0.00 0.02 0.00 0.00 54.13 53.20 1up6 s LEU 326 Cb 0.16 -1.09 -0.07 0.00 0.02 0.00 0.00 46.19 45.21 1up6 s LEU 326 CO 0.63 0.10 1.22 -2.65 0.02 0.00 0.00 176.35 175.67 1up6 n PRO 327 N 0.42 1.56 0.26 1.29 -0.02 -1.26 -4.85 135.00 132.41 1up6 n PRO 327 Ca -0.14 0.57 0.12 0.00 -2.02 0.00 0.00 63.50 62.03 1up6 n PRO 327 Cb 0.56 -2.39 0.72 0.00 -0.02 0.00 0.00 33.50 32.37 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 1.43 0.00 0.10 2.55 3.32 -1.95 -2.96 116.42 118.91 1up6 h ASP 328 Ca -0.49 0.00 0.00 0.00 0.02 0.00 0.00 57.03 56.56 1up6 h ASP 328 Cb 1.32 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.87 1up6 h ASP 328 CO 0.57 0.11 -0.24 -0.90 -1.72 0.00 0.00 179.24 177.06 1up6 n ASP 329 N -3.80 1.56 -4.69 6.45 5.75 -1.26 -1.09 116.55 119.47 1up6 n ASP 329 Ca -0.02 -1.27 -0.42 0.00 -0.01 0.00 0.00 54.79 53.06 1up6 n ASP 329 Cb 0.21 0.18 -0.03 0.00 -1.03 0.00 0.00 41.12 40.45 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 -0.14 2.62 -2.33 2.11 4.02 -1.12 -4.71 117.16 117.61 1up6 n TYR 330 Ca 0.13 -0.16 -0.43 0.00 -0.01 0.00 0.00 57.90 57.43 1up6 n TYR 330 Cb 0.40 -2.74 -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 2.84 4.10 0.20 -0.72 1.01 -1.26 -0.15 120.40 126.42 1up6 s VAL 331 Ca 0.82 1.35 0.09 0.00 0.00 0.00 0.00 61.98 64.25 1up6 s VAL 331 Cb -0.48 -3.87 -0.05 0.00 0.00 0.00 0.00 36.38 31.99 1up6 s VAL 331 CO 0.38 -0.10 -0.18 -0.76 0.00 0.00 0.00 175.10 174.43 1up6 s LEU 332 N 3.41 2.50 -0.50 3.92 1.43 0.73 -4.86 118.68 125.32 1up6 s LEU 332 Ca 0.59 -0.94 -0.19 0.00 -1.03 0.00 0.00 54.13 52.57 1up6 s LEU 332 Cb -0.25 -0.89 0.06 0.00 0.03 0.00 0.00 46.19 45.14 1up6 s LEU 332 CO 0.19 -0.03 0.59 -0.70 0.23 0.00 0.00 176.35 176.63 1up6 s GLU 333 N -3.16 3.10 0.05 1.70 2.12 0.26 -1.32 118.70 121.45 1up6 s GLU 333 Ca 0.21 -0.96 -0.07 0.00 0.36 0.00 0.00 54.97 54.51 1up6 s GLU 333 Cb -0.05 -4.10 -0.01 0.00 0.26 0.00 0.00 34.13 30.23 1up6 s GLU 333 CO 0.09 -1.19 0.13 0.96 -0.54 0.00 0.00 175.26 174.71 1up6 s ILE 334 N 2.47 0.14 0.04 -3.70 -4.36 -0.34 -3.61 121.20 111.84 1up6 s ILE 334 Ca 0.13 -1.14 -0.30 0.00 -0.26 0.00 0.00 60.65 59.08 1up6 s ILE 334 Cb -0.20 -1.08 -0.05 0.00 1.25 0.00 0.00 42.46 42.38 1up6 s ILE 334 CO 0.11 -0.63 1.25 -2.16 0.24 0.00 0.00 174.94 173.75 1up6 s PRO 335 N -3.05 4.39 0.13 0.37 0.04 -1.26 -1.21 135.00 134.41 1up6 s PRO 335 Ca -0.01 1.81 0.08 0.00 0.04 0.00 0.00 61.00 62.92 1up6 s PRO 335 Cb 0.01 -3.40 -0.04 0.00 0.04 0.00 0.00 34.50 31.12 1up6 s PRO 335 CO -0.07 -0.35 -0.18 0.00 0.04 0.00 0.00 177.00 176.44 1up6 s TYR 337 N -1.73 3.09 -0.20 0.00 5.04 0.90 -0.95 117.35 123.50 1up6 s TYR 337 Ca 0.10 0.40 -0.06 0.00 -2.44 0.00 0.00 57.07 55.08 1up6 s TYR 337 Cb -0.07 -3.42 -0.03 0.00 0.35 0.00 0.00 41.96 38.79 1up6 s TYR 337 CO 0.05 -0.78 0.02 0.08 -1.34 0.00 0.00 175.55 173.57 1up6 s VAL 338 N 3.07 4.15 -0.28 3.14 1.01 0.52 -0.75 120.40 131.26 1up6 s VAL 338 Ca 0.29 -0.25 -0.18 0.00 0.00 0.00 0.00 61.98 61.85 1up6 s VAL 338 Cb -0.13 -2.88 0.09 0.00 0.00 0.00 0.00 36.38 33.46 1up6 s VAL 338 CO 0.18 0.43 0.76 -0.60 0.00 0.00 0.00 175.10 175.87 1up6 s ARG 339 N 0.90 0.67 -1.41 2.72 3.52 -0.80 -1.43 118.95 123.13 1up6 s ARG 339 Ca 0.02 1.06 -0.00 0.00 -0.13 0.00 0.00 55.73 56.68 1up6 s ARG 339 Cb -0.14 0.18 0.00 0.00 -1.56 0.00 0.00 34.95 33.43 1up6 s ARG 339 CO 0.02 -0.13 0.00 0.43 -0.81 0.00 0.00 175.30 174.82 1up6 n SER 340 N 3.82 0.85 0.00 -2.12 7.64 -0.35 -0.12 113.62 123.33 1up6 n SER 340 Ca -0.18 -1.16 0.00 0.00 1.01 0.00 0.00 58.87 58.54 1up6 n SER 340 Cb 0.58 -1.44 0.00 0.00 -1.01 0.00 0.00 64.21 62.34 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 -2.43 0.80 3.43 0.23 0.00 0.45 -5.00 105.19 102.67 1up6 n GLY 341 Ca -0.30 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.45 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 -0.70 1.54 -0.20 1.61 0.52 0.82 -5.10 118.95 117.45 1up6 s ARG 342 Ca 0.00 -1.43 0.01 0.00 -0.52 0.00 0.00 55.73 53.79 1up6 s ARG 342 Cb 0.00 -1.91 0.04 0.00 0.52 0.00 0.00 34.95 33.61 1up6 s ARG 342 CO 0.00 0.42 -0.09 0.08 0.02 0.00 0.00 175.30 175.73 1up6 s VAL 343 N -1.45 1.57 -0.15 3.52 1.01 -1.26 -1.90 120.40 121.74 1up6 s VAL 343 Ca 0.19 -0.99 -0.04 0.00 0.00 0.00 0.00 61.98 61.14 1up6 s VAL 343 Cb -0.09 -1.68 -0.03 0.00 0.00 0.00 0.00 36.38 34.58 1up6 s VAL 343 CO 0.09 0.13 -0.02 -1.00 0.00 0.00 0.00 175.10 174.30 1up6 s HIS 344 N 1.42 3.07 0.59 5.22 3.76 0.07 -4.95 115.29 124.47 1up6 s HIS 344 Ca -0.02 -0.18 -0.17 0.00 -0.15 0.00 0.00 55.06 54.55 1up6 s HIS 344 Cb -0.16 -1.95 -0.03 0.00 1.11 0.00 0.00 32.58 31.54 1up6 s HIS 344 CO -0.08 0.06 1.09 0.95 -0.85 0.00 0.00 174.74 175.91 1up6 s THR 345 N 0.19 3.49 -0.03 1.30 -4.23 -1.26 -0.07 115.64 115.03 1up6 s THR 345 Ca -0.01 0.77 0.03 0.00 -1.18 0.00 0.00 61.69 61.30 1up6 s THR 345 Cb -0.13 -3.28 -0.03 0.00 1.34 0.00 0.00 72.50 70.40 1up6 s THR 345 CO 0.02 -0.36 -0.10 -0.76 -0.54 0.00 0.00 174.62 172.88 1up6 s LEU 346 N -4.37 2.97 0.30 4.79 1.02 -1.25 -4.81 118.68 117.33 1up6 s LEU 346 Ca 0.67 -0.16 -0.29 0.00 0.02 0.00 0.00 54.13 54.36 1up6 s LEU 346 Cb -0.19 -1.67 -0.10 0.00 0.02 0.00 0.00 46.19 44.25 1up6 s LEU 346 CO 0.34 0.32 1.40 -0.94 0.02 0.00 0.00 176.35 177.49 1up6 s SER 347 N -1.05 6.64 0.00 2.29 1.04 -1.26 -4.25 113.70 117.11 1up6 s SER 347 Ca 0.14 2.74 0.00 0.00 0.48 0.00 0.00 55.95 59.31 1up6 s SER 347 Cb -0.11 -2.64 0.00 0.00 0.10 0.00 0.00 66.02 63.37 1up6 s SER 347 CO 0.04 -0.67 0.05 0.00 0.98 0.00 0.00 173.24 173.64 1up6 n GLN 348 N 1.45 4.07 0.00 4.02 6.02 0.36 -5.03 117.38 128.27 1up6 n GLN 348 Ca 0.03 -0.05 0.00 0.00 -0.01 0.00 0.00 57.00 56.97 1up6 n GLN 348 Cb 0.41 -0.43 0.00 0.00 1.02 0.00 0.00 30.24 31.24 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 0.60 0.28 3.86 1.08 0.00 -1.24 -4.95 105.19 104.82 1up6 n GLY 349 Ca 0.00 -1.33 -0.35 0.00 0.00 0.00 0.00 46.02 44.34 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 3.86 0.35 1.61 1.02 -1.26 -1.88 119.74 123.43 1up6 s LYS 350 Ca 0.00 0.32 -0.13 0.00 0.02 0.00 0.00 55.97 56.18 1up6 s LYS 350 Cb 0.00 -2.96 -0.08 0.00 -0.52 0.00 0.00 37.83 34.27 1up6 s LYS 350 CO 0.00 0.52 0.74 0.20 -0.92 0.00 0.00 175.35 175.89 1up6 s GLY 351 N -1.76 2.20 0.24 -3.33 0.00 -1.26 -4.99 107.32 98.42 1up6 s GLY 351 Ca 0.35 -0.05 -0.30 0.00 0.00 0.00 0.00 44.72 44.72 1up6 s GLY 351 CO 0.19 0.14 1.26 -0.35 0.00 0.00 0.00 173.10 174.34 1up6 s ASP 352 N -2.57 6.96 0.35 1.64 -1.08 -1.26 -4.90 116.67 115.81 1up6 s ASP 352 Ca 0.53 2.42 0.08 0.00 -0.52 0.00 0.00 52.55 55.06 1up6 s ASP 352 Cb -0.10 -2.62 0.79 0.00 -1.46 0.00 0.00 42.92 39.53 1up6 s ASP 352 CO 0.22 -0.45 1.88 0.45 0.52 0.00 0.00 175.17 177.79 1up6 h HIS 353 N 4.71 0.83 -0.03 -5.34 3.86 -1.98 0.18 115.15 117.37 1up6 h HIS 353 Ca -0.46 0.02 -0.00 0.00 -1.16 0.00 0.00 60.37 58.77 1up6 h HIS 353 Cb 1.22 -0.26 -0.00 0.00 1.06 0.00 0.00 27.41 29.42 1up6 h HIS 353 CO 0.60 0.33 0.01 0.35 0.86 0.00 0.00 177.93 180.08 1up6 h PHE 354 N 0.72 0.05 -0.67 2.45 3.57 -1.98 -0.39 116.94 120.70 1up6 h PHE 354 Ca 0.44 -0.00 0.01 0.00 3.53 0.00 0.00 57.97 61.95 1up6 h PHE 354 Cb 0.65 -0.02 -0.04 0.00 2.79 0.00 0.00 35.95 39.34 1up6 h PHE 354 CO -0.00 0.22 0.43 0.00 -2.23 0.00 0.00 178.31 176.73 1up6 h ALA 355 N 0.83 0.86 -0.41 2.41 0.00 -1.82 -2.94 119.26 118.17 1up6 h ALA 355 Ca 0.01 -0.04 -0.03 0.00 0.00 0.00 0.00 54.91 54.85 1up6 h ALA 355 Cb 0.19 -0.25 -0.02 0.00 0.00 0.00 0.00 17.79 17.71 1up6 h ALA 355 CO -0.00 0.24 0.12 -0.07 0.00 0.00 0.00 179.25 179.54 1up6 h LEU 356 N 0.88 0.55 -0.79 0.00 4.07 -0.63 -2.08 115.31 117.31 1up6 h LEU 356 Ca 0.25 -0.07 0.07 0.00 0.08 0.00 0.00 57.88 58.21 1up6 h LEU 356 Cb -0.06 -0.14 -0.06 0.00 1.08 0.00 0.00 40.66 41.47 1up6 h LEU 356 CO -0.07 0.54 0.47 0.77 -1.08 0.00 0.00 178.44 179.07 1up6 h SER 357 N 0.59 0.71 -0.08 -0.43 4.64 -0.89 -1.55 113.55 116.56 1up6 h SER 357 Ca 0.14 0.03 -0.05 0.00 -0.47 0.00 0.00 61.79 61.43 1up6 h SER 357 Cb 0.20 -0.12 0.00 0.00 -0.31 0.00 0.00 62.40 62.17 1up6 h SER 357 CO -0.01 0.45 -0.16 -0.26 -0.87 0.00 0.00 176.83 175.98 1up6 h PHE 358 N 0.84 0.31 -0.11 4.77 0.04 -1.50 -2.77 116.94 118.51 1up6 h PHE 358 Ca 0.36 -0.11 0.03 0.00 2.80 0.00 0.00 57.97 61.04 1up6 h PHE 358 Cb 0.22 -0.06 -0.03 0.00 2.20 0.00 0.00 35.95 38.28 1up6 h PHE 358 CO -0.05 0.76 -0.07 0.82 -0.60 0.00 0.00 178.31 179.16 1up6 h ILE 359 N -0.23 0.77 -0.44 -0.55 2.04 -1.17 -2.03 117.51 115.91 1up6 h ILE 359 Ca 0.00 0.00 0.03 0.00 1.00 0.00 0.00 64.86 65.89 1up6 h ILE 359 Cb 0.74 0.77 -0.03 0.00 -0.74 0.00 0.00 36.82 37.56 1up6 h ILE 359 CO 0.03 0.00 0.25 0.45 0.00 0.00 0.00 178.15 178.88 1up6 h HIS 360 N -0.08 0.46 -0.17 1.37 3.86 -1.37 -1.57 115.15 117.66 1up6 h HIS 360 Ca 0.07 0.02 -0.01 0.00 -1.16 0.00 0.00 60.37 59.29 1up6 h HIS 360 Cb 0.18 -0.14 -0.01 0.00 1.06 0.00 0.00 27.41 28.50 1up6 h HIS 360 CO -0.20 0.25 0.08 0.00 0.86 0.00 0.00 177.93 178.93 1up6 h ALA 361 N 1.21 0.22 0.00 2.45 0.00 -1.12 -3.07 119.26 118.95 1up6 h ALA 361 Ca 0.18 -0.08 -0.06 0.00 0.00 0.00 0.00 54.91 54.95 1up6 h ALA 361 Cb 0.05 -0.07 -0.01 0.00 0.00 0.00 0.00 17.79 17.76 1up6 h ALA 361 CO -0.10 -0.22 -0.73 -0.39 0.00 0.00 0.00 179.25 177.81 1up6 h VAL 362 N 0.14 0.31 0.00 0.00 -1.51 -1.34 -2.67 116.25 111.18 1up6 h VAL 362 Ca 0.06 -1.50 0.00 0.00 -1.23 0.00 0.00 66.70 64.03 1up6 h VAL 362 Cb 0.12 1.96 0.00 0.00 -2.13 0.00 0.00 31.29 31.23 1up6 h VAL 362 CO -0.01 0.18 0.00 1.17 -1.23 0.00 0.00 177.57 177.68 1up6 n LYS 363 N -2.96 0.04 0.00 5.19 3.00 -0.60 0.16 118.16 122.99 1up6 n LYS 363 Ca -0.01 0.00 0.00 0.00 -0.00 0.00 0.00 58.31 58.30 1up6 n LYS 363 Cb 0.65 -1.29 0.00 0.00 0.00 0.00 0.00 35.03 34.39 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 0.78 0.00 -0.26 5.64 4.19 -1.01 -2.08 117.16 124.42 1up6 n TYR 365 Ca 0.00 0.00 -0.06 0.00 3.31 0.00 0.00 57.90 61.15 1up6 n TYR 365 Cb 0.01 0.00 0.05 0.00 0.49 0.00 0.00 39.34 39.90 1up6 n TYR 365 CO 0.00 0.00 0.00 0.93 0.91 0.00 0.00 176.86 178.70 1up6 h GLU 366 N 0.00 0.99 -0.38 2.98 5.08 -0.58 -0.76 114.58 121.91 1up6 h GLU 366 Ca 0.00 -0.12 -0.14 0.00 -1.00 0.00 0.00 59.36 58.10 1up6 h GLU 366 Cb 0.00 -0.19 -0.01 0.00 0.50 0.00 0.00 28.75 29.05 1up6 h GLU 366 CO 0.00 0.74 -0.33 0.00 -1.00 0.00 0.00 179.01 178.41 1up6 h ARG 367 N 0.97 0.86 -0.43 2.33 2.47 -1.68 -1.94 114.38 116.97 1up6 h ARG 367 Ca 0.25 -0.42 -0.05 0.00 -1.26 0.00 0.00 59.98 58.50 1up6 h ARG 367 Cb 0.04 -0.00 -0.02 0.00 -1.65 0.00 0.00 29.97 28.33 1up6 h ARG 367 CO -0.04 1.06 0.05 -0.07 0.56 0.00 0.00 179.97 181.53 1up6 h LEU 368 N 0.72 0.62 -0.05 3.04 3.38 -1.78 0.12 115.31 121.36 1up6 h LEU 368 Ca 0.07 -0.12 -0.00 0.00 0.09 0.00 0.00 57.88 57.92 1up6 h LEU 368 Cb 0.90 -0.16 -0.00 0.00 0.09 0.00 0.00 40.66 41.48 1up6 h LEU 368 CO 0.08 0.66 0.01 0.74 0.09 0.00 0.00 178.44 180.02 1up6 h THR 369 N 0.63 1.19 -0.09 0.22 2.02 -1.03 -0.90 112.91 114.95 1up6 h THR 369 Ca 0.14 -0.58 0.03 0.00 0.77 0.00 0.00 66.41 66.77 1up6 h THR 369 Cb 0.33 1.49 -0.03 0.00 -1.74 0.00 0.00 68.15 68.20 1up6 h THR 369 CO 0.01 0.16 -0.08 0.40 0.37 0.00 0.00 175.52 176.38 1up6 h ILE 370 N -0.15 0.78 -0.84 3.11 2.04 -0.99 -1.00 117.51 120.46 1up6 h ILE 370 Ca 0.01 0.00 0.05 0.00 1.00 0.00 0.00 64.86 65.93 1up6 h ILE 370 Cb 0.24 0.78 -0.06 0.00 -0.74 0.00 0.00 36.82 37.04 1up6 h ILE 370 CO 0.00 0.00 0.53 -0.33 0.00 0.00 0.00 178.15 178.35 1up6 h GLU 371 N -0.09 0.95 -0.75 2.37 5.08 -0.74 -0.37 114.58 121.02 1up6 h GLU 371 Ca 0.06 -0.06 0.04 0.00 -1.00 0.00 0.00 59.36 58.40 1up6 h GLU 371 Cb 0.18 -0.21 -0.05 0.00 0.50 0.00 0.00 28.75 29.17 1up6 h GLU 371 CO -0.15 0.63 0.47 0.00 -1.00 0.00 0.00 179.01 178.96 1up6 h ALA 372 N 1.39 1.00 -0.14 3.43 0.00 -0.75 -2.54 119.26 121.64 1up6 h ALA 372 Ca 0.36 -0.02 -0.02 0.00 0.00 0.00 0.00 54.91 55.23 1up6 h ALA 372 Cb 0.13 -0.23 -0.01 0.00 0.00 0.00 0.00 17.79 17.69 1up6 h ALA 372 CO -0.16 0.25 0.02 -0.92 0.00 0.00 0.00 179.25 178.44 1up6 h TYR 373 N 0.91 0.25 -0.11 0.00 3.20 0.09 -1.08 116.97 120.23 1up6 h TYR 373 Ca 0.31 -0.04 -0.03 0.00 3.14 0.00 0.00 58.73 62.12 1up6 h TYR 373 Cb 0.05 -0.07 -0.01 0.00 1.54 0.00 0.00 36.73 38.25 1up6 h TYR 373 CO -0.04 0.42 -0.05 -0.07 -1.64 0.00 0.00 178.16 176.77 1up6 h LEU 374 N 0.01 0.14 -1.59 2.82 3.38 -0.85 -0.91 115.31 118.31 1up6 h LEU 374 Ca 0.04 -0.02 0.00 0.00 0.09 0.00 0.00 57.88 58.00 1up6 h LEU 374 Cb 0.30 -0.04 0.00 0.00 0.09 0.00 0.00 40.66 41.02 1up6 h LEU 374 CO 0.00 0.23 -0.08 0.29 0.09 0.00 0.00 178.44 178.97 1up6 n LYS 375 N -4.38 2.01 -3.96 1.13 5.02 -0.98 -4.98 118.16 112.02 1up6 n LYS 375 Ca -0.01 -1.59 -0.29 0.00 -2.02 0.00 0.00 58.31 54.39 1up6 n LYS 375 Cb 0.19 -1.47 -0.02 0.00 -0.02 0.00 0.00 35.03 33.72 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 0.90 -2.31 -3.93 1.97 1.74 -0.35 -4.90 116.66 109.78 1up6 n ARG 376 Ca 0.14 0.34 -0.35 0.00 -0.77 0.00 0.00 57.85 57.21 1up6 n ARG 376 Cb 0.53 -4.14 -0.14 0.00 -1.02 0.00 0.00 32.46 27.69 1up6 n ARG 376 CO 0.00 0.00 0.00 0.45 -1.52 0.00 0.00 177.63 176.56 1up6 s SER 377 N -4.13 4.32 0.15 0.55 0.15 -0.49 -0.82 113.70 113.43 1up6 s SER 377 Ca 0.14 -0.69 -0.19 0.00 0.70 0.00 0.00 55.95 55.90 1up6 s SER 377 Cb -0.06 -1.70 0.03 0.00 -1.71 0.00 0.00 66.02 62.58 1up6 s SER 377 CO 0.91 -0.09 1.68 0.50 1.20 0.00 0.00 173.24 177.43 1up6 h LYS 378 N 8.06 -0.05 -0.57 5.44 3.64 -1.53 -1.23 116.57 130.34 1up6 h LYS 378 Ca -0.36 0.00 0.11 0.00 -1.27 0.00 0.00 60.65 59.14 1up6 h LYS 378 Cb 1.13 0.01 -0.11 0.00 -0.41 0.00 0.00 32.23 32.85 1up6 h LYS 378 CO 0.59 -0.03 -0.19 0.87 -2.27 0.00 0.00 179.45 178.42 1up6 h LYS 379 N -0.05 -0.05 0.00 1.90 1.57 -1.94 -1.57 116.57 116.43 1up6 h LYS 379 Ca 0.14 0.00 -0.01 0.00 -1.87 0.00 0.00 60.65 58.91 1up6 h LYS 379 Cb 0.26 0.01 -0.00 0.00 0.08 0.00 0.00 32.23 32.58 1up6 h LYS 379 CO -0.31 -0.03 -0.07 -0.07 -0.57 0.00 0.00 179.45 178.40 1up6 h LEU 380 N -0.05 0.00 -0.49 2.94 3.38 -1.86 -2.63 115.31 116.59 1up6 h LEU 380 Ca 0.27 0.00 -0.12 0.00 0.09 0.00 0.00 57.88 58.12 1up6 h LEU 380 Cb 0.46 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.20 1up6 h LEU 380 CO -0.61 0.07 -0.17 0.00 0.09 0.00 0.00 178.44 177.82 1up6 h ALA 381 N 1.93 0.69 -0.60 1.53 0.00 -0.39 -1.03 119.26 121.39 1up6 h ALA 381 Ca -0.00 -0.37 -0.01 0.00 0.00 0.00 0.00 54.91 54.52 1up6 h ALA 381 Cb 0.86 -0.17 -0.03 0.00 0.00 0.00 0.00 17.79 18.44 1up6 h ALA 381 CO 0.01 0.64 0.33 -0.07 0.00 0.00 0.00 179.25 180.16 1up6 h LEU 382 N 0.85 0.76 -0.06 0.00 4.07 -1.05 -0.70 115.31 119.17 1up6 h LEU 382 Ca 0.12 -0.10 0.02 0.00 0.08 0.00 0.00 57.88 58.00 1up6 h LEU 382 Cb 0.74 -0.19 -0.02 0.00 1.08 0.00 0.00 40.66 42.27 1up6 h LEU 382 CO 0.06 0.64 -0.06 0.50 -1.08 0.00 0.00 178.44 178.50 1up6 h LYS 383 N 0.82 -0.07 -0.45 1.13 3.64 -1.33 -1.24 116.57 119.06 1up6 h LYS 383 Ca 0.21 0.00 0.05 0.00 -1.27 0.00 0.00 60.65 59.65 1up6 h LYS 383 Cb 0.05 0.02 -0.05 0.00 -0.41 0.00 0.00 32.23 31.84 1up6 h LYS 383 CO -0.03 -0.05 0.18 0.00 -2.27 0.00 0.00 179.45 177.28 1up6 h ALA 384 N 0.98 0.55 -0.82 5.00 0.00 -0.94 -2.47 119.26 121.56 1up6 h ALA 384 Ca 0.04 0.04 -0.01 0.00 0.00 0.00 0.00 54.91 54.99 1up6 h ALA 384 Cb 0.14 -0.00 -0.04 0.00 0.00 0.00 0.00 17.79 17.88 1up6 h ALA 384 CO -0.10 -0.19 0.47 1.25 0.00 0.00 0.00 179.25 180.67 1up6 h LEU 385 N 0.37 1.01 -1.37 0.00 5.85 -0.91 -2.39 115.31 117.87 1up6 h LEU 385 Ca 0.20 -0.09 -0.03 0.00 0.84 0.00 0.00 57.88 58.80 1up6 h LEU 385 Cb 0.17 -0.26 -0.00 0.00 0.37 0.00 0.00 40.66 40.94 1up6 h LEU 385 CO -0.19 0.80 -0.17 -0.07 -0.34 0.00 0.00 178.44 178.48 1up6 h LEU 386 N 1.13 0.00 -0.13 2.25 3.38 -1.02 -3.12 115.31 117.81 1up6 h LEU 386 Ca 0.29 0.00 -0.01 0.00 0.09 0.00 0.00 57.88 58.25 1up6 h LEU 386 Cb 0.00 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 40.75 1up6 h LEU 386 CO -0.05 0.17 -0.04 0.77 0.09 0.00 0.00 178.44 179.38 1up6 h SER 387 N 0.00 0.00 -3.04 -0.43 4.64 -0.96 -3.46 113.55 110.30 1up6 h SER 387 Ca -0.00 0.00 -0.54 0.00 -0.47 0.00 0.00 61.79 60.78 1up6 h SER 387 Cb 0.61 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 62.70 1up6 h SER 387 CO 0.02 0.04 0.71 -2.28 -0.87 0.00 0.00 176.83 174.45 1up6 s HIS 388 N -3.23 3.15 0.57 4.77 5.04 -1.18 -4.81 115.29 119.60 1up6 s HIS 388 Ca 0.06 1.06 0.32 0.00 -1.54 0.00 0.00 55.06 54.96 1up6 s HIS 388 Cb 0.06 -3.55 1.41 0.00 0.04 0.00 0.00 32.58 30.54 1up6 s HIS 388 CO 0.66 -1.87 1.73 -1.35 -2.34 0.00 0.00 174.74 171.57 1up6 h PRO 389 N 7.30 0.00 -0.51 2.88 0.11 -1.90 0.36 132.00 140.24 1up6 h PRO 389 Ca -0.39 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.72 1up6 h PRO 389 Cb 1.19 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.30 1up6 h PRO 389 CO 0.87 0.00 0.00 1.28 -0.21 0.00 0.00 178.00 179.94 1up6 n LEU 390 N -3.80 3.81 0.00 2.35 4.77 -1.26 -5.02 117.00 117.84 1up6 n LEU 390 Ca 0.19 -2.25 -0.18 0.00 -0.03 0.00 0.00 56.01 53.74 1up6 n LEU 390 Cb 1.11 -0.43 0.12 0.00 -2.33 0.00 0.00 43.42 41.89 1up6 n LEU 390 CO 0.32 0.81 0.51 0.61 -1.33 0.00 0.00 177.39 178.31 1up6 n GLY 391 N 0.82 -0.76 3.80 -0.72 0.00 0.13 -4.59 105.19 103.86 1up6 n GLY 391 Ca 0.20 -1.79 -0.34 0.00 0.00 0.00 0.00 46.02 44.09 1up6 n GLY 391 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1up6 s PRO 392 N -4.66 3.56 0.92 1.61 0.04 -1.26 -5.01 135.00 130.21 1up6 s PRO 392 Ca 0.47 1.32 -0.11 0.00 0.04 0.00 0.00 61.00 62.72 1up6 s PRO 392 Cb -0.02 -2.06 0.15 0.00 0.04 0.00 0.00 34.50 32.61 1up6 s PRO 392 CO 0.32 -0.63 1.11 -0.51 0.04 0.00 0.00 177.00 177.33 1up6 s ASP 393 N -2.30 3.04 0.38 6.66 1.11 -1.26 -4.70 116.67 119.60 1up6 s ASP 393 Ca 0.66 1.88 0.10 0.00 0.18 0.00 0.00 52.55 55.37 1up6 s ASP 393 Cb -0.17 -2.44 0.88 0.00 1.07 0.00 0.00 42.92 42.26 1up6 s ASP 393 CO 0.28 -2.97 1.91 0.58 1.18 0.00 0.00 175.17 176.14 1up6 h VAL 394 N -1.78 0.86 0.00 -1.27 2.07 -1.98 -2.19 116.25 111.96 1up6 h VAL 394 Ca -0.47 -0.21 -0.05 0.00 0.82 0.00 0.00 66.70 66.79 1up6 h VAL 394 Cb 1.27 0.20 -0.01 0.00 -1.52 0.00 0.00 31.29 31.23 1up6 h VAL 394 CO 0.47 0.11 -0.24 1.05 0.02 0.00 0.00 177.57 178.98 1up6 h GLU 395 N 0.61 0.00 0.00 1.57 4.11 -2.04 -3.22 114.58 115.61 1up6 h GLU 395 Ca 0.39 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.82 1up6 h GLU 395 Cb 0.65 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.90 1up6 h GLU 395 CO -0.15 0.24 -1.79 -0.25 0.07 0.00 0.00 179.01 177.13 1up6 n ASP 396 N -3.92 0.26 -0.25 3.06 8.00 -0.86 -4.70 116.55 118.14 1up6 n ASP 396 Ca -0.02 -0.19 -0.05 0.00 0.71 0.00 0.00 54.79 55.24 1up6 n ASP 396 Cb 0.33 1.79 0.05 0.00 -0.02 0.00 0.00 41.12 43.27 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 2.15 0.89 -0.30 2.24 0.00 -1.48 -1.41 119.26 121.34 1up6 h ALA 397 Ca 0.00 -0.08 -0.07 0.00 0.00 0.00 0.00 54.91 54.76 1up6 h ALA 397 Cb 0.89 -0.28 -0.01 0.00 0.00 0.00 0.00 17.79 18.39 1up6 h ALA 397 CO 0.00 0.36 -0.10 0.87 0.00 0.00 0.00 179.25 180.38 1up6 h LYS 398 N 0.95 0.60 -0.46 0.00 1.57 -1.84 -1.92 116.57 115.48 1up6 h LYS 398 Ca 0.25 -0.24 -0.07 0.00 -1.87 0.00 0.00 60.65 58.72 1up6 h LYS 398 Cb -0.04 -0.03 -0.02 0.00 0.08 0.00 0.00 32.23 32.23 1up6 h LYS 398 CO -0.05 0.80 0.01 -0.44 -0.57 0.00 0.00 179.45 179.20 1up6 h ASP 399 N 0.36 0.79 -0.02 0.86 5.19 -1.85 -2.52 116.42 119.24 1up6 h ASP 399 Ca 0.07 -0.30 -0.00 0.00 -0.62 0.00 0.00 57.03 56.18 1up6 h ASP 399 Cb 0.60 -0.21 -0.00 0.00 0.18 0.00 0.00 39.33 39.90 1up6 h ASP 399 CO 0.03 0.90 0.01 0.25 -3.12 0.00 0.00 179.24 177.31 1up6 h LEU 400 N 0.65 0.02 -0.82 1.55 5.85 -1.13 -1.36 115.31 120.07 1up6 h LEU 400 Ca 0.13 -0.10 0.01 0.00 0.84 0.00 0.00 57.88 58.76 1up6 h LEU 400 Cb 0.49 -0.01 -0.04 0.00 0.37 0.00 0.00 40.66 41.47 1up6 h LEU 400 CO 0.02 0.12 0.54 0.25 -0.34 0.00 0.00 178.44 179.03 1up6 h LEU 401 N -0.07 0.94 -0.44 2.25 5.85 -1.40 -1.11 115.31 121.32 1up6 h LEU 401 Ca 0.01 -0.03 0.07 0.00 0.84 0.00 0.00 57.88 58.77 1up6 h LEU 401 Cb 0.10 -0.23 -0.06 0.00 0.37 0.00 0.00 40.66 40.83 1up6 h LEU 401 CO -0.00 0.68 0.07 -0.08 -0.34 0.00 0.00 178.44 178.77 1up6 h GLU 402 N 1.11 0.19 -0.45 1.25 4.57 -1.10 0.11 114.58 120.26 1up6 h GLU 402 Ca 0.30 -0.01 -0.10 0.00 -1.18 0.00 0.00 59.36 58.37 1up6 h GLU 402 Cb -0.13 -0.04 -0.02 0.00 -0.16 0.00 0.00 28.75 28.40 1up6 h GLU 402 CO -0.06 0.13 -0.12 1.49 -1.18 0.00 0.00 179.01 179.26 1up6 h GLU 403 N 0.20 0.83 -0.30 1.92 4.81 -0.82 -0.53 114.58 120.69 1up6 h GLU 403 Ca 0.22 -0.29 -0.01 0.00 -0.13 0.00 0.00 59.36 59.15 1up6 h GLU 403 Cb 0.29 -0.06 -0.01 0.00 0.63 0.00 0.00 28.75 29.59 1up6 h GLU 403 CO -0.30 0.91 0.14 0.82 -0.73 0.00 0.00 179.01 179.85 1up6 h ILE 404 N 0.75 1.16 -0.05 2.32 2.04 -0.51 -2.01 117.51 121.21 1up6 h ILE 404 Ca 0.12 -0.47 -0.12 0.00 1.00 0.00 0.00 64.86 65.39 1up6 h ILE 404 Cb 0.62 0.91 -0.01 0.00 -0.74 0.00 0.00 36.82 37.60 1up6 h ILE 404 CO 0.04 0.17 -0.54 -0.07 0.00 0.00 0.00 178.15 177.75 1up6 h LEU 405 N 0.35 0.14 -0.19 1.44 3.38 -0.68 -2.13 115.31 117.63 1up6 h LEU 405 Ca 0.10 -0.07 -0.00 0.00 0.09 0.00 0.00 57.88 58.00 1up6 h LEU 405 Cb 0.14 -0.04 -0.01 0.00 0.09 0.00 0.00 40.66 40.84 1up6 h LEU 405 CO -0.01 0.66 0.11 -0.33 0.09 0.00 0.00 178.44 178.96 1up6 h GLU 406 N 0.10 0.25 0.00 1.13 5.08 -0.91 -2.92 114.58 117.32 1up6 h GLU 406 Ca -0.00 -0.02 -0.02 0.00 -1.00 0.00 0.00 59.36 58.32 1up6 h GLU 406 Cb 0.99 -0.05 -0.00 0.00 0.50 0.00 0.00 28.75 30.18 1up6 h GLU 406 CO 0.08 0.22 -0.08 0.00 -1.00 0.00 0.00 179.01 178.22 1up6 h ALA 407 N 1.02 0.99 -0.35 3.43 0.00 -1.06 -3.15 119.26 120.14 1up6 h ALA 407 Ca 0.07 -0.08 -0.05 0.00 0.00 0.00 0.00 54.91 54.85 1up6 h ALA 407 Cb 0.03 -0.01 -0.03 0.00 0.00 0.00 0.00 17.79 17.77 1up6 h ALA 407 CO -0.01 0.10 0.02 0.09 0.00 0.00 0.00 179.25 179.45 1up6 n ASN 408 N -3.17 3.89 -0.34 0.00 3.02 -0.83 -4.74 115.26 113.09 1up6 n ASN 408 Ca 0.01 -3.15 0.18 0.00 -0.03 0.00 0.00 54.58 51.60 1up6 n ASN 408 Cb 0.42 -0.59 0.41 0.00 -0.61 0.00 0.00 39.78 39.41 1up6 n ASN 408 CO 0.00 0.00 0.00 0.03 -2.62 0.00 0.00 177.26 174.67 1up6 h ARG 409 N 1.90 0.53 0.00 3.52 3.08 -1.47 0.44 114.38 122.39 1up6 h ARG 409 Ca 0.06 -0.03 0.00 0.00 0.07 0.00 0.00 59.98 60.08 1up6 h ARG 409 Cb 1.61 -0.12 0.00 0.00 0.08 0.00 0.00 29.97 31.54 1up6 h ARG 409 CO 0.32 0.35 0.00 0.39 -1.07 0.00 0.00 179.97 179.97 1up6 n GLU 410 N -4.79 0.14 0.00 0.04 -0.58 -1.26 -4.18 120.64 110.02 1up6 n GLU 410 Ca 0.26 0.43 0.00 0.00 -0.42 0.00 0.00 57.16 57.43 1up6 n GLU 410 Cb 0.76 -1.81 0.00 0.00 -0.57 0.00 0.00 31.44 29.82 1up6 n GLU 410 CO 0.00 0.00 0.00 0.66 -0.48 0.00 0.00 177.13 177.31 1up6 n TYR 411 N -2.08 0.00 -3.85 -0.32 4.01 0.07 -5.07 117.16 109.92 1up6 n TYR 411 Ca 0.02 0.00 -0.12 0.00 -0.16 0.00 0.00 57.90 57.63 1up6 n TYR 411 Cb 0.18 0.00 -0.14 0.00 -0.31 0.00 0.00 39.34 39.07 1up6 n TYR 411 CO 0.00 0.00 0.00 0.54 -0.46 0.00 0.00 176.86 176.94 1up6 s VAL 412 N -1.75 -0.00 -0.20 -0.72 0.11 -0.76 -4.84 120.40 112.24 1up6 s VAL 412 Ca 0.00 0.01 -0.02 0.00 -2.93 0.00 0.00 61.98 59.04 1up6 s VAL 412 Cb 0.00 -0.08 0.06 0.00 -1.53 0.00 0.00 36.38 34.82 1up6 s VAL 412 CO 0.00 0.00 0.01 -0.75 -3.33 0.00 0.00 175.10 171.03 1up6 s LYS 413 N 0.08 0.91 -0.09 1.54 2.36 -1.26 -4.48 119.74 118.81 1up6 s LYS 413 Ca -0.00 -0.55 0.00 0.00 -2.55 0.00 0.00 55.97 52.86 1up6 s LYS 413 Cb -0.01 -2.20 -0.03 0.00 -1.05 0.00 0.00 37.83 34.54 1up6 s LYS 413 CO -0.00 -0.62 -0.07 -0.51 1.55 0.00 0.00 175.35 175.70 1up6 s LEU 414 N 1.74 3.13 0.00 5.43 1.02 -1.26 -4.89 118.68 123.86 1up6 s LEU 414 Ca -0.02 -0.07 0.14 0.00 0.02 0.00 0.00 54.13 54.20 1up6 s LEU 414 Cb -0.17 -1.70 0.11 0.00 0.02 0.00 0.00 46.19 44.45 1up6 s LEU 414 CO -0.07 0.31 0.95 0.61 0.02 0.00 0.00 176.35 178.17