#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1up6 n ARG 2 N 0.00 0.00 -4.34 1.57 0.63 -1.26 -5.03 116.66 108.23 1up6 n ARG 2 Ca 0.00 0.00 -0.34 0.00 -0.92 0.00 0.00 57.85 56.59 1up6 n ARG 2 Cb 0.00 0.00 -0.14 0.00 0.45 0.00 0.00 32.46 32.77 1up6 n ARG 2 CO 0.00 0.00 0.00 0.42 -2.51 0.00 0.00 177.63 175.54 1up6 s ILE 3 N -0.81 3.27 -0.07 5.15 1.01 -0.69 -0.97 121.20 128.08 1up6 s ILE 3 Ca 0.00 -0.56 -0.15 0.00 0.00 0.00 0.00 60.65 59.94 1up6 s ILE 3 Cb 0.00 -2.43 -0.05 0.00 0.01 0.00 0.00 42.46 39.99 1up6 s ILE 3 CO 0.00 0.48 0.39 0.00 0.00 0.00 0.00 174.94 175.81 1up6 s ALA 4 N 0.84 3.61 -0.28 9.38 0.00 0.58 -1.19 121.76 134.71 1up6 s ALA 4 Ca -0.03 -0.27 -0.03 0.00 0.00 0.00 0.00 51.96 51.63 1up6 s ALA 4 Cb -0.15 -2.45 0.03 0.00 0.00 0.00 0.00 23.12 20.55 1up6 s ALA 4 CO 0.01 0.26 0.00 0.08 0.00 0.00 0.00 175.76 176.11 1up6 s VAL 5 N -0.23 3.22 -0.31 0.00 1.01 0.27 -0.61 120.40 123.75 1up6 s VAL 5 Ca 0.22 -1.06 -0.13 0.00 0.00 0.00 0.00 61.98 61.02 1up6 s VAL 5 Cb -0.15 -2.72 -0.03 0.00 0.00 0.00 0.00 36.38 33.48 1up6 s VAL 5 CO 0.10 0.05 0.25 -0.63 0.00 0.00 0.00 175.10 174.87 1up6 s ILE 6 N 1.35 5.27 0.00 2.22 -1.09 -0.03 -1.61 121.20 127.31 1up6 s ILE 6 Ca -0.01 0.03 0.00 0.00 -2.23 0.00 0.00 60.65 58.44 1up6 s ILE 6 Cb -0.18 -3.65 0.00 0.00 -1.58 0.00 0.00 42.46 37.05 1up6 s ILE 6 CO -0.01 0.10 0.00 0.61 -1.23 0.00 0.00 174.94 174.40 1up6 n GLY 7 N 5.04 0.74 0.30 6.18 0.00 0.69 -0.89 105.19 117.25 1up6 n GLY 7 Ca -0.12 -0.17 0.20 0.00 0.00 0.00 0.00 46.02 45.93 1up6 n GLY 7 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 1up6 h GLY 8 N 0.00 0.00 1.65 -0.02 0.00 -1.35 -2.40 103.07 100.94 1up6 h GLY 8 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 1up6 h GLY 8 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 176.54 177.15 1up6 n GLY 9 N -1.01 -1.22 3.75 4.60 0.00 -1.26 -4.78 105.19 105.27 1up6 n GLY 9 Ca -0.02 -0.12 -0.42 0.00 0.00 0.00 0.00 46.02 45.46 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 -1.32 3.58 0.16 1.61 2.88 -0.91 -4.70 113.62 114.92 1up6 n SER 10 Ca 0.12 1.20 0.11 0.00 -1.33 0.00 0.00 58.87 58.97 1up6 n SER 10 Cb 0.23 -1.58 0.59 0.00 -0.75 0.00 0.00 64.21 62.70 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 1.07 0.57 0.07 -3.46 3.41 -1.26 -1.04 113.62 112.98 1up6 n SER 11 Ca 0.04 0.76 0.13 0.00 -0.26 0.00 0.00 58.87 59.54 1up6 n SER 11 Cb 0.37 -0.84 0.31 0.00 -0.26 0.00 0.00 64.21 63.79 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 -2.26 0.62 -0.27 7.33 4.01 -1.26 -4.42 117.16 120.90 1up6 n TYR 12 Ca -0.01 0.18 0.08 0.00 -0.16 0.00 0.00 57.90 57.98 1up6 n TYR 12 Cb 0.04 -0.72 0.22 0.00 -0.31 0.00 0.00 39.34 38.57 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 0.56 -1.00 -0.72 2.02 -1.39 -1.88 112.91 110.50 1up6 h THR 13 Ca 0.00 -0.13 0.11 0.00 0.77 0.00 0.00 66.41 67.16 1up6 h THR 13 Cb 0.70 0.15 -0.08 0.00 -1.74 0.00 0.00 68.15 67.18 1up6 h THR 13 CO 0.00 0.07 0.63 -0.65 0.37 0.00 0.00 175.52 175.94 1up6 h PRO 14 N 0.38 0.99 -0.45 6.66 0.11 -1.81 0.42 132.00 138.30 1up6 h PRO 14 Ca 0.46 -0.06 -0.08 0.00 0.11 0.00 0.00 66.00 66.42 1up6 h PRO 14 Cb 0.77 -0.22 -0.02 0.00 0.11 0.00 0.00 31.00 31.64 1up6 h PRO 14 CO -0.47 0.65 -0.05 0.93 -0.21 0.00 0.00 178.00 178.86 1up6 h GLU 15 N 1.02 0.82 -0.57 1.05 4.39 -1.66 -2.26 114.58 117.37 1up6 h GLU 15 Ca 0.48 -0.28 0.08 0.00 0.34 0.00 0.00 59.36 59.98 1up6 h GLU 15 Cb 0.43 -0.06 -0.06 0.00 -0.10 0.00 0.00 28.75 28.96 1up6 h GLU 15 CO -0.25 0.90 0.22 1.25 -1.16 0.00 0.00 179.01 179.97 1up6 h LEU 16 N 0.66 0.24 -0.65 1.33 5.85 -0.97 -1.39 115.31 120.38 1up6 h LEU 16 Ca 0.12 0.07 -0.08 0.00 0.84 0.00 0.00 57.88 58.82 1up6 h LEU 16 Cb 0.56 0.04 -0.02 0.00 0.37 0.00 0.00 40.66 41.61 1up6 h LEU 16 CO 0.03 0.15 0.08 0.58 -0.34 0.00 0.00 178.44 178.95 1up6 h VAL 17 N 0.41 1.26 -0.51 1.05 2.07 -0.79 0.38 116.25 120.14 1up6 h VAL 17 Ca 0.28 -1.06 0.05 0.00 0.82 0.00 0.00 66.70 66.79 1up6 h VAL 17 Cb 0.31 0.69 -0.05 0.00 -1.52 0.00 0.00 31.29 30.72 1up6 h VAL 17 CO -0.27 0.39 0.23 0.50 0.02 0.00 0.00 177.57 178.45 1up6 h LYS 18 N 1.00 0.44 -0.15 1.57 3.64 -1.18 0.48 116.57 122.37 1up6 h LYS 18 Ca 0.19 -0.03 0.03 0.00 -1.27 0.00 0.00 60.65 59.58 1up6 h LYS 18 Cb 0.47 -0.10 -0.03 0.00 -0.41 0.00 0.00 32.23 32.16 1up6 h LYS 18 CO 0.02 0.29 -0.04 0.78 -2.27 0.00 0.00 179.45 178.22 1up6 h GLY 19 N 0.45 0.10 0.74 5.01 0.00 -0.46 -0.91 103.07 108.00 1up6 h GLY 19 Ca 0.23 0.06 0.08 0.00 0.00 0.00 0.00 47.33 47.70 1up6 h GLY 19 CO -0.19 -0.06 0.60 1.41 0.00 0.00 0.00 176.54 178.30 1up6 h LEU 20 N -0.01 0.89 -0.32 3.11 3.38 -0.27 -2.01 115.31 120.07 1up6 h LEU 20 Ca 0.07 0.02 -0.03 0.00 0.09 0.00 0.00 57.88 58.04 1up6 h LEU 20 Cb 0.12 -0.17 -0.01 0.00 0.09 0.00 0.00 40.66 40.69 1up6 h LEU 20 CO -0.16 0.54 0.10 -0.07 0.09 0.00 0.00 178.44 178.94 1up6 h LEU 21 N 0.99 0.47 -0.87 1.67 3.38 0.29 -2.04 115.31 119.20 1up6 h LEU 21 Ca 0.42 -0.21 0.11 0.00 0.09 0.00 0.00 57.88 58.29 1up6 h LEU 21 Cb 0.31 -0.12 -0.08 0.00 0.09 0.00 0.00 40.66 40.86 1up6 h LEU 21 CO -0.17 0.55 0.51 0.44 0.09 0.00 0.00 178.44 179.86 1up6 h ASP 22 N 0.37 0.72 1.37 -0.43 3.32 -0.67 -2.53 116.42 118.56 1up6 h ASP 22 Ca 0.10 0.05 0.00 0.00 0.02 0.00 0.00 57.03 57.21 1up6 h ASP 22 Cb 0.25 -0.09 0.00 0.00 0.22 0.00 0.00 39.33 39.71 1up6 h ASP 22 CO -0.00 0.39 -0.08 2.30 -1.72 0.00 0.00 179.24 180.13 1up6 n ILE 23 N -4.73 0.53 0.79 0.35 -5.35 -0.80 -3.87 119.36 106.28 1up6 n ILE 23 Ca 0.15 -0.27 0.09 0.00 -0.27 0.00 0.00 62.75 62.45 1up6 n ILE 23 Cb 0.32 -0.52 0.43 0.00 -1.74 0.00 0.00 39.64 38.13 1up6 n ILE 23 CO 0.00 0.00 0.00 -1.54 -1.76 0.00 0.00 176.55 173.25 1up6 n SER 24 N -2.19 0.00 0.07 7.28 3.41 -0.79 -0.51 113.62 120.88 1up6 n SER 24 Ca 0.05 0.10 -0.03 0.00 -0.26 0.00 0.00 58.87 58.74 1up6 n SER 24 Cb 0.43 -0.32 -0.07 0.00 -0.26 0.00 0.00 64.21 63.99 1up6 n SER 24 CO 0.00 0.00 0.00 -0.33 -0.16 0.00 0.00 175.04 174.55 1up6 h GLU 25 N 0.00 0.00 0.01 4.33 5.08 -1.72 -3.38 114.58 118.90 1up6 h GLU 25 Ca 0.00 0.00 -0.34 0.00 -1.00 0.00 0.00 59.36 58.02 1up6 h GLU 25 Cb 0.18 0.00 -0.06 0.00 0.50 0.00 0.00 28.75 29.37 1up6 h GLU 25 CO 0.00 0.63 -2.11 -0.25 -1.00 0.00 0.00 179.01 176.28 1up6 n ASP 26 N -3.18 0.72 -4.16 1.42 8.00 0.33 -4.97 116.55 114.72 1up6 n ASP 26 Ca -0.04 0.16 -0.18 0.00 0.71 0.00 0.00 54.79 55.44 1up6 n ASP 26 Cb 0.87 0.29 -0.12 0.00 -0.02 0.00 0.00 41.12 42.14 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 -2.54 1.10 -0.14 2.53 -7.23 -0.65 -5.05 120.40 108.41 1up6 s VAL 27 Ca -0.12 -1.25 -0.27 0.00 -1.81 0.00 0.00 61.98 58.54 1up6 s VAL 27 Cb 0.07 -1.05 -0.01 0.00 0.56 0.00 0.00 36.38 35.95 1up6 s VAL 27 CO 0.80 -0.19 0.88 -0.60 -0.31 0.00 0.00 175.10 175.68 1up6 s ARG 28 N -1.64 4.34 -0.19 4.82 3.52 -1.26 -4.23 118.95 124.31 1up6 s ARG 28 Ca -0.02 1.13 0.01 0.00 -0.13 0.00 0.00 55.73 56.73 1up6 s ARG 28 Cb -0.10 -3.56 0.03 0.00 -1.56 0.00 0.00 34.95 29.77 1up6 s ARG 28 CO 0.02 -0.31 -0.14 0.42 -0.81 0.00 0.00 175.30 174.49 1up6 s ILE 29 N 2.04 1.81 -0.12 4.11 1.01 -1.26 -4.95 121.20 123.85 1up6 s ILE 29 Ca 0.41 -1.00 -0.16 0.00 0.00 0.00 0.00 60.65 59.90 1up6 s ILE 29 Cb -0.17 -1.78 -0.26 0.00 0.01 0.00 0.00 42.46 40.25 1up6 s ILE 29 CO 0.14 0.30 0.51 0.44 0.00 0.00 0.00 174.94 176.33 1up6 h ASP 30 N 7.95 0.33 -4.59 3.58 3.32 -1.95 -3.43 116.42 121.63 1up6 h ASP 30 Ca -0.34 -0.83 -0.13 0.00 0.02 0.00 0.00 57.03 55.76 1up6 h ASP 30 Cb 1.11 -0.11 -0.22 0.00 0.22 0.00 0.00 39.33 40.33 1up6 h ASP 30 CO 0.53 1.60 -0.32 -1.83 -1.72 0.00 0.00 179.24 177.50 1up6 s GLU 31 N -2.46 0.55 -0.15 3.56 -1.05 -1.26 -1.08 118.70 116.81 1up6 s GLU 31 Ca -0.21 0.01 0.01 0.00 -0.15 0.00 0.00 54.97 54.64 1up6 s GLU 31 Cb 0.04 0.25 0.00 0.00 -0.44 0.00 0.00 34.13 33.99 1up6 s GLU 31 CO 0.74 -0.13 -0.18 0.08 0.95 0.00 0.00 175.26 176.72 1up6 s VAL 32 N -0.81 2.38 -0.07 1.83 1.01 -0.34 -1.71 120.40 122.69 1up6 s VAL 32 Ca -0.09 -0.87 0.02 0.00 0.00 0.00 0.00 61.98 61.04 1up6 s VAL 32 Cb -0.04 -1.98 -0.02 0.00 0.00 0.00 0.00 36.38 34.33 1up6 s VAL 32 CO 0.03 0.53 -0.13 -0.51 0.00 0.00 0.00 175.10 175.02 1up6 s ILE 33 N 0.82 3.17 -0.10 2.22 2.07 -0.33 -1.52 121.20 127.54 1up6 s ILE 33 Ca -0.06 -0.66 0.01 0.00 -1.41 0.00 0.00 60.65 58.53 1up6 s ILE 33 Cb -0.15 -2.28 -0.02 0.00 0.13 0.00 0.00 42.46 40.14 1up6 s ILE 33 CO -0.01 0.57 -0.11 -0.36 -1.91 0.00 0.00 174.94 173.12 1up6 s PHE 34 N -0.44 2.82 -0.02 3.50 0.40 0.66 -0.57 117.98 124.33 1up6 s PHE 34 Ca 0.06 -0.34 0.07 0.00 -0.60 0.00 0.00 56.93 56.12 1up6 s PHE 34 Cb -0.12 -1.76 -0.02 0.00 0.51 0.00 0.00 43.02 41.63 1up6 s PHE 34 CO 0.02 0.03 -0.22 -0.47 0.70 0.00 0.00 175.22 175.28 1up6 s TYR 35 N -0.20 1.98 -0.11 0.36 5.04 -0.64 -0.93 117.35 122.86 1up6 s TYR 35 Ca 0.01 -0.37 -0.16 0.00 -2.44 0.00 0.00 57.07 54.11 1up6 s TYR 35 Cb -0.13 -1.27 0.04 0.00 0.35 0.00 0.00 41.96 40.95 1up6 s TYR 35 CO 0.03 -0.03 0.41 0.34 -1.34 0.00 0.00 175.55 174.96 1up6 s ASP 36 N -0.54 -0.38 0.40 4.32 -1.08 -1.26 -0.22 116.67 117.91 1up6 s ASP 36 Ca 0.08 0.61 0.10 0.00 -0.52 0.00 0.00 52.55 52.82 1up6 s ASP 36 Cb -0.09 0.67 0.83 0.00 -1.46 0.00 0.00 42.92 42.87 1up6 s ASP 36 CO -0.01 -0.27 1.94 0.16 0.52 0.00 0.00 175.17 177.51 1up6 h ILE 37 N 4.18 1.16 -2.85 4.11 3.07 -1.98 -3.37 117.51 121.83 1up6 h ILE 37 Ca -0.28 -0.69 -0.71 0.00 1.55 0.00 0.00 64.86 64.73 1up6 h ILE 37 Cb 1.18 1.16 -0.20 0.00 -0.27 0.00 0.00 36.82 38.68 1up6 h ILE 37 CO 0.30 0.22 0.53 -0.62 -1.05 0.00 0.00 178.15 177.53 1up6 s ASP 38 N -6.88 6.58 0.32 2.16 -1.08 -1.26 -4.94 116.67 111.57 1up6 s ASP 38 Ca -0.06 -2.07 0.09 0.00 -0.52 0.00 0.00 52.55 49.99 1up6 s ASP 38 Cb 0.16 -2.34 0.55 0.00 -1.46 0.00 0.00 42.92 39.83 1up6 s ASP 38 CO 0.73 -0.96 1.75 -0.08 0.52 0.00 0.00 175.17 177.12 1up6 h GLU 39 N 8.65 0.15 -0.11 4.34 4.81 -2.01 -2.59 114.58 127.83 1up6 h GLU 39 Ca 0.06 -0.07 -0.23 0.00 -0.13 0.00 0.00 59.36 58.99 1up6 h GLU 39 Cb 1.04 -0.00 0.01 0.00 0.63 0.00 0.00 28.75 30.43 1up6 h GLU 39 CO 1.02 0.53 -0.84 0.93 -0.73 0.00 0.00 179.01 179.91 1up6 h GLU 40 N 0.13 0.73 -0.45 1.92 3.07 -1.95 -1.86 114.58 116.17 1up6 h GLU 40 Ca 0.01 -0.64 -0.12 0.00 -0.50 0.00 0.00 59.36 58.12 1up6 h GLU 40 Cb 0.76 0.15 -0.01 0.00 -0.84 0.00 0.00 28.75 28.80 1up6 h GLU 40 CO 0.06 1.24 -0.18 -0.22 -1.40 0.00 0.00 179.01 178.51 1up6 h LYS 41 N 0.47 0.92 -0.47 2.33 3.64 -1.94 -3.04 116.57 118.48 1up6 h LYS 41 Ca -0.07 -0.38 -0.06 0.00 -1.27 0.00 0.00 60.65 58.87 1up6 h LYS 41 Cb 1.47 -0.03 -0.02 0.00 -0.41 0.00 0.00 32.23 33.24 1up6 h LYS 41 CO 0.17 1.04 0.04 0.37 -2.27 0.00 0.00 179.45 178.80 1up6 h GLN 42 N 0.75 0.76 -0.55 1.90 4.15 -1.41 -2.99 115.11 117.72 1up6 h GLN 42 Ca 0.11 -0.18 0.03 0.00 0.77 0.00 0.00 58.65 59.37 1up6 h GLN 42 Cb 0.74 -0.10 -0.04 0.00 0.21 0.00 0.00 27.48 28.30 1up6 h GLN 42 CO 0.06 0.74 0.32 -0.22 -1.93 0.00 0.00 178.83 177.80 1up6 h LYS 43 N 0.72 0.62 0.14 1.69 1.63 -1.22 0.93 116.57 121.07 1up6 h LYS 43 Ca 0.15 -0.04 0.01 0.00 -0.85 0.00 0.00 60.65 59.92 1up6 h LYS 43 Cb 0.38 -0.14 -0.01 0.00 -0.60 0.00 0.00 32.23 31.86 1up6 h LYS 43 CO 0.01 0.41 -0.15 0.82 -3.45 0.00 0.00 179.45 177.08 1up6 h ILE 44 N 0.63 0.66 -0.93 2.00 2.04 -1.49 -0.98 117.51 119.43 1up6 h ILE 44 Ca 0.22 0.00 -0.00 0.00 1.00 0.00 0.00 64.86 66.08 1up6 h ILE 44 Cb 0.05 0.66 -0.05 0.00 -0.74 0.00 0.00 36.82 36.74 1up6 h ILE 44 CO -0.11 0.00 0.58 0.58 0.00 0.00 0.00 178.15 179.20 1up6 h VAL 45 N -0.33 1.25 0.00 1.67 2.07 -1.33 -2.32 116.25 117.27 1up6 h VAL 45 Ca 0.01 -0.52 -0.13 0.00 0.82 0.00 0.00 66.70 66.88 1up6 h VAL 45 Cb 0.32 -0.08 -0.02 0.00 -1.52 0.00 0.00 31.29 29.99 1up6 h VAL 45 CO -0.05 0.26 -0.61 0.58 0.02 0.00 0.00 177.57 177.77 1up6 h VAL 46 N 1.28 1.27 -0.44 2.57 2.07 -0.67 -0.51 116.25 121.83 1up6 h VAL 46 Ca 0.34 -2.22 -0.13 0.00 0.82 0.00 0.00 66.70 65.51 1up6 h VAL 46 Cb -0.08 2.25 -0.01 0.00 -1.52 0.00 0.00 31.29 31.93 1up6 h VAL 46 CO -0.07 0.60 -0.24 0.44 0.02 0.00 0.00 177.57 178.32 1up6 h ASP 47 N 0.00 0.94 -0.08 0.57 3.32 -0.79 -1.11 116.42 119.27 1up6 h ASP 47 Ca -0.01 -0.36 -0.00 0.00 0.02 0.00 0.00 57.03 56.68 1up6 h ASP 47 Cb 1.21 -0.26 -0.00 0.00 0.22 0.00 0.00 39.33 40.49 1up6 h ASP 47 CO 0.08 1.13 0.04 0.15 -1.72 0.00 0.00 179.24 178.91 1up6 h PHE 48 N 0.78 0.12 -0.68 4.55 3.57 -1.06 -2.94 116.94 121.29 1up6 h PHE 48 Ca 0.10 -0.01 0.14 0.00 3.53 0.00 0.00 57.97 61.73 1up6 h PHE 48 Cb 0.80 -0.04 -0.10 0.00 2.79 0.00 0.00 35.95 39.41 1up6 h PHE 48 CO 0.05 0.21 0.17 0.28 -2.23 0.00 0.00 178.31 176.80 1up6 h VAL 49 N -0.01 0.59 -0.95 1.41 2.07 -0.97 -1.99 116.25 116.40 1up6 h VAL 49 Ca 0.03 -0.10 0.02 0.00 0.82 0.00 0.00 66.70 67.47 1up6 h VAL 49 Cb 0.14 0.27 -0.05 0.00 -1.52 0.00 0.00 31.29 30.13 1up6 h VAL 49 CO -0.00 0.05 0.63 0.11 0.02 0.00 0.00 177.57 178.38 1up6 h LYS 50 N 0.29 1.21 -0.23 1.57 1.57 -1.12 0.11 116.57 119.98 1up6 h LYS 50 Ca 0.37 -0.07 -0.08 0.00 -1.87 0.00 0.00 60.65 58.99 1up6 h LYS 50 Cb 0.59 -0.27 -0.01 0.00 0.08 0.00 0.00 32.23 32.61 1up6 h LYS 50 CO -0.45 0.80 -0.22 0.00 -0.57 0.00 0.00 179.45 179.01 1up6 h ARG 51 N 1.25 0.42 0.04 3.15 3.08 -1.20 -2.91 114.38 118.21 1up6 h ARG 51 Ca 0.36 -0.14 -0.23 0.00 0.07 0.00 0.00 59.98 60.04 1up6 h ARG 51 Cb -0.08 -0.03 -0.01 0.00 0.08 0.00 0.00 29.97 29.93 1up6 h ARG 51 CO -0.09 0.62 -1.01 -0.07 -1.07 0.00 0.00 179.97 178.35 1up6 h LEU 52 N 0.38 0.34 -0.44 3.04 3.38 -0.76 -3.35 115.31 117.89 1up6 h LEU 52 Ca 0.06 -0.30 -0.18 0.00 0.09 0.00 0.00 57.88 57.55 1up6 h LEU 52 Cb 0.60 -0.11 -0.01 0.00 0.09 0.00 0.00 40.66 41.24 1up6 h LEU 52 CO 0.04 1.15 -0.69 0.58 0.09 0.00 0.00 178.44 179.61 1up6 h VAL 53 N 0.11 1.37 -6.13 1.22 2.07 -0.92 -3.48 116.25 110.50 1up6 h VAL 53 Ca -0.07 -2.08 -0.44 0.00 0.82 0.00 0.00 66.70 64.93 1up6 h VAL 53 Cb 1.68 2.05 0.03 0.00 -1.52 0.00 0.00 31.29 33.54 1up6 h VAL 53 CO 0.16 0.63 -0.78 0.29 0.02 0.00 0.00 177.57 177.89 1up6 n LYS 54 N -3.86 -5.67 -2.54 1.57 5.02 -1.11 -2.31 118.16 109.27 1up6 n LYS 54 Ca -0.04 0.65 -0.21 0.00 -2.02 0.00 0.00 58.31 56.70 1up6 n LYS 54 Cb 0.68 -5.44 -0.00 0.00 -0.02 0.00 0.00 35.03 30.25 1up6 n LYS 54 CO 0.00 0.00 0.00 -3.47 -0.52 0.00 0.00 177.40 173.41 1up6 n ASP 55 N -2.96 -5.77 0.08 4.39 2.03 -1.26 -4.89 116.55 108.17 1up6 n ASP 55 Ca -0.11 -0.06 -0.09 0.00 0.52 0.00 0.00 54.79 55.05 1up6 n ASP 55 Cb 0.60 -4.78 -0.07 0.00 -0.72 0.00 0.00 41.12 36.15 1up6 n ASP 55 CO 0.00 0.00 0.00 0.03 -1.92 0.00 0.00 177.20 175.31 1up6 h ARG 56 N -0.29 0.13 -4.50 -0.67 3.08 -1.86 -3.46 114.38 106.80 1up6 h ARG 56 Ca -0.49 -0.17 -0.29 0.00 0.07 0.00 0.00 59.98 59.10 1up6 h ARG 56 Cb 1.35 0.06 -0.13 0.00 0.08 0.00 0.00 29.97 31.33 1up6 h ARG 56 CO 0.56 1.01 -0.47 -0.59 -1.07 0.00 0.00 179.97 179.41 1up6 s PHE 57 N -2.93 1.22 0.29 3.04 -0.12 -1.26 -4.96 117.98 113.25 1up6 s PHE 57 Ca -0.02 -1.37 -0.27 0.00 -0.05 0.00 0.00 56.93 55.23 1up6 s PHE 57 Cb 0.10 -0.45 -0.09 0.00 -0.63 0.00 0.00 43.02 41.94 1up6 s PHE 57 CO 0.83 -0.81 0.92 0.15 -0.05 0.00 0.00 175.22 176.27 1up6 s LYS 58 N -3.81 4.64 -0.20 1.99 1.02 -0.24 -4.93 119.74 118.21 1up6 s LYS 58 Ca 0.36 1.34 -0.01 0.00 0.02 0.00 0.00 55.97 57.68 1up6 s LYS 58 Cb 0.04 -2.95 0.00 0.00 -0.52 0.00 0.00 37.83 34.40 1up6 s LYS 58 CO 0.17 0.36 -0.12 0.08 -0.92 0.00 0.00 175.35 174.92 1up6 s VAL 59 N -1.47 2.75 0.15 3.17 1.01 -1.26 -1.20 120.40 123.54 1up6 s VAL 59 Ca 0.47 -0.71 0.08 0.00 0.00 0.00 0.00 61.98 61.82 1up6 s VAL 59 Cb -0.21 -2.21 -0.04 0.00 0.00 0.00 0.00 36.38 33.92 1up6 s VAL 59 CO 0.26 0.48 -0.18 -0.76 0.00 0.00 0.00 175.10 174.90 1up6 s LEU 60 N 1.35 2.40 -0.10 3.92 1.43 -0.58 -5.01 118.68 122.11 1up6 s LEU 60 Ca 0.05 -0.82 0.01 0.00 -1.03 0.00 0.00 54.13 52.34 1up6 s LEU 60 Cb -0.14 -0.81 -0.02 0.00 0.03 0.00 0.00 46.19 45.25 1up6 s LEU 60 CO -0.07 -0.03 -0.13 -0.63 0.23 0.00 0.00 176.35 175.72 1up6 s ILE 61 N -1.87 3.09 -0.15 -0.59 1.01 -1.26 -0.25 121.20 121.18 1up6 s ILE 61 Ca 0.13 -0.68 -0.05 0.00 0.00 0.00 0.00 60.65 60.06 1up6 s ILE 61 Cb -0.07 -2.26 -0.03 0.00 0.01 0.00 0.00 42.46 40.11 1up6 s ILE 61 CO 0.06 0.55 0.01 -0.55 0.00 0.00 0.00 174.94 175.01 1up6 s SER 62 N -0.11 5.25 0.13 3.58 0.15 -0.11 -4.88 113.70 117.70 1up6 s SER 62 Ca -0.01 0.03 0.19 0.00 0.70 0.00 0.00 55.95 56.85 1up6 s SER 62 Cb -0.14 -1.79 0.79 0.00 -1.71 0.00 0.00 66.02 63.18 1up6 s SER 62 CO 0.03 0.23 1.58 0.47 1.20 0.00 0.00 173.24 176.75 1up6 n ASP 63 N 3.17 0.33 -4.21 5.45 8.00 -1.26 -4.45 116.55 123.58 1up6 n ASP 63 Ca -0.17 0.58 -0.17 0.00 0.71 0.00 0.00 54.79 55.73 1up6 n ASP 63 Cb 0.53 -0.65 -0.11 0.00 -0.02 0.00 0.00 41.12 40.86 1up6 n ASP 63 CO 0.00 0.00 0.00 0.42 -0.39 0.00 0.00 177.20 177.23 1up6 s THR 64 N -3.16 1.19 0.11 -3.53 -4.23 -1.26 -4.98 115.64 99.79 1up6 s THR 64 Ca 0.05 -1.57 -0.21 0.00 -1.18 0.00 0.00 61.69 58.79 1up6 s THR 64 Cb 0.09 -1.35 -0.09 0.00 1.34 0.00 0.00 72.50 72.50 1up6 s THR 64 CO 0.32 -0.38 1.74 0.15 -0.54 0.00 0.00 174.62 175.92 1up6 h PHE 65 N 3.78 0.07 -1.00 3.99 3.04 -1.98 -2.89 116.94 121.95 1up6 h PHE 65 Ca -0.40 0.01 0.01 0.00 3.98 0.00 0.00 57.97 61.57 1up6 h PHE 65 Cb 1.19 -0.01 -0.05 0.00 2.56 0.00 0.00 35.95 39.64 1up6 h PHE 65 CO 0.64 0.04 0.66 1.49 -2.02 0.00 0.00 178.31 179.11 1up6 h GLU 66 N 0.10 1.32 -0.02 1.11 4.81 -1.98 -1.79 114.58 118.13 1up6 h GLU 66 Ca 0.06 -0.08 -0.05 0.00 -0.13 0.00 0.00 59.36 59.15 1up6 h GLU 66 Cb 0.04 -0.30 -0.01 0.00 0.63 0.00 0.00 28.75 29.11 1up6 h GLU 66 CO -0.06 0.88 -0.23 0.78 -0.73 0.00 0.00 179.01 179.65 1up6 h GLY 67 N 1.36 0.04 1.48 1.92 0.00 -1.96 -1.43 103.07 104.48 1up6 h GLY 67 Ca 0.37 -0.02 -0.22 0.00 0.00 0.00 0.00 47.33 47.45 1up6 h GLY 67 CO -0.08 0.02 -0.87 0.00 0.00 0.00 0.00 176.54 175.61 1up6 h ALA 68 N 1.74 0.40 0.00 3.60 0.00 -1.13 -3.38 119.26 120.49 1up6 h ALA 68 Ca 0.00 -0.67 0.00 0.00 0.00 0.00 0.00 54.91 54.25 1up6 h ALA 68 Cb 0.42 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.19 1up6 h ALA 68 CO 0.03 0.77 -1.03 1.33 0.00 0.00 0.00 179.25 180.36 1up6 n VAL 69 N -3.80 0.08 -0.27 0.00 0.24 -0.92 -4.53 118.33 109.12 1up6 n VAL 69 Ca -0.06 -0.16 -0.01 0.00 -2.04 0.00 0.00 64.34 62.07 1up6 n VAL 69 Cb 0.79 0.44 0.12 0.00 -1.47 0.00 0.00 33.84 33.72 1up6 n VAL 69 CO 0.00 0.00 0.00 1.62 -2.14 0.00 0.00 176.83 176.31 1up6 h VAL 70 N 0.00 1.01 -0.23 3.34 3.04 -1.45 -2.28 116.25 119.68 1up6 h VAL 70 Ca 0.00 -0.29 -0.02 0.00 -1.01 0.00 0.00 66.70 65.38 1up6 h VAL 70 Cb 0.65 0.10 -0.01 0.00 -2.01 0.00 0.00 31.29 30.02 1up6 h VAL 70 CO 0.00 0.15 -0.01 0.47 -1.01 0.00 0.00 177.57 177.18 1up6 n ASP 71 N -4.69 3.50 -4.81 3.17 8.00 -1.26 -3.80 116.55 116.65 1up6 n ASP 71 Ca 0.10 -3.12 -0.38 0.00 0.71 0.00 0.00 54.79 52.11 1up6 n ASP 71 Cb 0.17 -0.54 -0.06 0.00 -0.02 0.00 0.00 41.12 40.67 1up6 n ASP 71 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1up6 s ALA 72 N -2.89 3.53 -0.07 2.24 0.00 -0.86 -4.50 121.76 119.21 1up6 s ALA 72 Ca 0.41 0.09 0.07 0.00 0.00 0.00 0.00 51.96 52.53 1up6 s ALA 72 Cb 0.34 -2.71 -0.24 0.00 0.00 0.00 0.00 23.12 20.51 1up6 s ALA 72 CO 0.07 0.38 0.56 1.17 0.00 0.00 0.00 175.76 177.94 1up6 n LYS 73 N 1.31 0.67 -4.75 0.00 4.81 -0.14 -4.18 118.16 115.88 1up6 n LYS 73 Ca -0.07 0.28 -0.25 0.00 -0.87 0.00 0.00 58.31 57.41 1up6 n LYS 73 Cb 0.51 -1.76 -0.16 0.00 0.02 0.00 0.00 35.03 33.64 1up6 n LYS 73 CO 0.00 0.00 0.00 0.71 1.17 0.00 0.00 177.40 179.28 1up6 s TYR 74 N -2.58 1.52 -0.15 5.64 2.02 -1.20 -1.90 117.35 120.71 1up6 s TYR 74 Ca -0.10 -0.39 0.01 0.00 -0.37 0.00 0.00 57.07 56.22 1up6 s TYR 74 Cb 0.08 -1.02 0.02 0.00 -0.40 0.00 0.00 41.96 40.64 1up6 s TYR 74 CO 0.81 -0.12 -0.16 0.08 -1.57 0.00 0.00 175.55 174.60 1up6 s VAL 75 N -0.05 1.66 -0.25 0.71 1.01 -0.33 -0.31 120.40 122.85 1up6 s VAL 75 Ca -0.01 -0.70 -0.09 0.00 0.00 0.00 0.00 61.98 61.18 1up6 s VAL 75 Cb -0.10 -1.54 -0.04 0.00 0.00 0.00 0.00 36.38 34.71 1up6 s VAL 75 CO 0.01 0.47 0.12 -0.63 0.00 0.00 0.00 175.10 175.07 1up6 s ILE 76 N 1.34 4.80 -0.32 2.22 1.01 0.22 -0.11 121.20 130.36 1up6 s ILE 76 Ca 0.02 -0.01 -0.19 0.00 0.00 0.00 0.00 60.65 60.48 1up6 s ILE 76 Cb -0.13 -3.25 -0.01 0.00 0.01 0.00 0.00 42.46 39.08 1up6 s ILE 76 CO -0.09 0.33 0.56 -0.36 0.00 0.00 0.00 174.94 175.38 1up6 s PHE 77 N 1.41 3.20 -0.01 3.97 0.40 0.09 -0.85 117.98 126.19 1up6 s PHE 77 Ca 0.06 0.42 0.02 0.00 -0.60 0.00 0.00 56.93 56.83 1up6 s PHE 77 Cb -0.15 -2.93 0.02 0.00 0.51 0.00 0.00 43.02 40.48 1up6 s PHE 77 CO 0.06 -0.47 0.79 0.94 0.70 0.00 0.00 175.22 177.23 1up6 n GLN 78 N 5.78 0.44 -3.18 0.44 7.27 -0.07 -0.52 117.38 127.55 1up6 n GLN 78 Ca -0.03 -0.96 -0.25 0.00 0.07 0.00 0.00 57.00 55.83 1up6 n GLN 78 Cb 0.49 -0.64 -0.01 0.00 2.41 0.00 0.00 30.24 32.49 1up6 n GLN 78 CO 0.00 0.00 0.00 -0.59 0.07 0.00 0.00 177.06 176.54 1up6 s PHE 79 N -0.36 3.52 -0.36 3.69 -0.71 -1.11 -4.69 117.98 117.95 1up6 s PHE 79 Ca 0.03 0.48 0.04 0.00 -1.04 0.00 0.00 56.93 56.43 1up6 s PHE 79 Cb 0.02 -2.01 0.10 0.00 -1.21 0.00 0.00 43.02 39.93 1up6 s PHE 79 CO 0.00 0.01 0.08 0.50 -1.34 0.00 0.00 175.22 174.48 1up6 s ARG 80 N -4.42 1.48 0.04 1.99 3.52 -1.26 -4.52 118.95 115.79 1up6 s ARG 80 Ca 0.42 -1.92 -0.34 0.00 -0.13 0.00 0.00 55.73 53.76 1up6 s ARG 80 Cb -0.10 -3.11 -0.13 0.00 -1.56 0.00 0.00 34.95 30.05 1up6 s ARG 80 CO 0.38 -0.97 1.71 -2.30 -0.81 0.00 0.00 175.30 173.32 1up6 n PRO 81 N 4.14 2.14 -0.33 5.12 -0.02 -1.26 -1.02 135.00 143.75 1up6 n PRO 81 Ca 0.04 0.78 0.00 0.00 -2.02 0.00 0.00 63.50 62.29 1up6 n PRO 81 Cb 0.41 -2.58 0.00 0.00 -0.02 0.00 0.00 33.50 31.31 1up6 n PRO 81 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1up6 n GLY 82 N 3.86 2.16 7.00 -1.23 0.00 -1.26 -4.84 105.19 110.87 1up6 n GLY 82 Ca 0.20 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.22 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 -0.73 0.14 -0.02 0.00 -0.19 -1.88 105.19 100.51 1up6 n GLY 83 Ca 0.00 -1.08 -0.01 0.00 0.00 0.00 0.00 46.02 44.93 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 0.01 -0.71 0.99 3.38 -1.92 -2.26 115.31 114.80 1up6 h LEU 84 Ca 0.00 -0.00 0.10 0.00 0.09 0.00 0.00 57.88 58.07 1up6 h LEU 84 Cb 0.00 -0.00 -0.07 0.00 0.09 0.00 0.00 40.66 40.67 1up6 h LEU 84 CO 0.00 0.60 0.34 0.50 0.09 0.00 0.00 178.44 179.98 1up6 h LYS 85 N 0.00 0.56 -0.48 1.13 3.64 -1.96 0.18 116.57 119.64 1up6 h LYS 85 Ca -0.01 -0.03 -0.03 0.00 -1.27 0.00 0.00 60.65 59.31 1up6 h LYS 85 Cb 1.06 -0.13 -0.02 0.00 -0.41 0.00 0.00 32.23 32.73 1up6 h LYS 85 CO 0.08 0.37 0.20 0.78 -2.27 0.00 0.00 179.45 178.61 1up6 h GLY 86 N 0.58 0.77 1.00 5.01 0.00 -0.81 -2.04 103.07 107.58 1up6 h GLY 86 Ca 0.36 -0.42 0.01 0.00 0.00 0.00 0.00 47.33 47.28 1up6 h GLY 86 CO -0.29 0.39 0.39 -0.09 0.00 0.00 0.00 176.54 176.95 1up6 h ARG 87 N 0.64 0.77 -0.75 4.80 2.43 -1.07 -0.33 114.38 120.87 1up6 h ARG 87 Ca 0.16 -0.05 0.07 0.00 -0.81 0.00 0.00 59.98 59.36 1up6 h ARG 87 Cb 0.19 -0.17 -0.06 0.00 -0.42 0.00 0.00 29.97 29.50 1up6 h ARG 87 CO -0.01 0.51 0.43 1.49 -1.51 0.00 0.00 179.97 180.87 1up6 h GLU 88 N 0.80 0.73 -0.59 0.20 4.81 -0.49 -0.65 114.58 119.38 1up6 h GLU 88 Ca 0.22 -0.04 -0.05 0.00 -0.13 0.00 0.00 59.36 59.35 1up6 h GLU 88 Cb -0.09 -0.16 -0.02 0.00 0.63 0.00 0.00 28.75 29.10 1up6 h GLU 88 CO -0.05 0.48 0.18 -0.91 -0.73 0.00 0.00 179.01 177.98 1up6 h ASN 89 N 0.75 0.87 -0.77 1.04 2.35 -0.78 -1.75 115.58 117.31 1up6 h ASN 89 Ca 0.35 -0.21 0.03 0.00 -0.55 0.00 0.00 56.30 55.92 1up6 h ASN 89 Cb 0.26 -0.23 -0.05 0.00 0.05 0.00 0.00 38.32 38.36 1up6 h ASN 89 CO -0.21 0.85 0.48 0.44 -1.65 0.00 0.00 177.43 177.34 1up6 h ASP 90 N 0.84 0.79 0.05 5.81 3.32 -0.56 -2.02 116.42 124.65 1up6 h ASP 90 Ca 0.19 -0.00 -0.22 0.00 0.02 0.00 0.00 57.03 57.02 1up6 h ASP 90 Cb 0.30 -0.17 0.01 0.00 0.22 0.00 0.00 39.33 39.68 1up6 h ASP 90 CO -0.00 0.55 -0.81 -0.33 -1.72 0.00 0.00 179.24 176.92 1up6 h GLU 91 N 0.94 0.62 0.02 3.56 5.08 -1.09 -3.35 114.58 120.36 1up6 h GLU 91 Ca 0.31 -0.54 -0.32 0.00 -1.00 0.00 0.00 59.36 57.80 1up6 h GLU 91 Cb 0.03 0.12 -0.05 0.00 0.50 0.00 0.00 28.75 29.35 1up6 h GLU 91 CO -0.12 1.16 -1.93 0.41 -1.00 0.00 0.00 179.01 177.53 1up6 n GLY 92 N 0.73 -0.90 0.23 -3.84 0.00 -0.66 -4.18 105.19 96.57 1up6 n GLY 92 Ca -0.07 -0.14 -0.07 0.00 0.00 0.00 0.00 46.02 45.74 1up6 n GLY 92 CO 0.00 0.00 0.00 -2.22 0.00 0.00 0.00 173.32 171.10 1up6 h ILE 93 N 0.01 1.16 0.00 -0.61 2.04 -1.57 -2.83 117.51 115.71 1up6 h ILE 93 Ca -0.38 -0.35 -0.01 0.00 1.00 0.00 0.00 64.86 65.12 1up6 h ILE 93 Cb 2.06 0.38 -0.00 0.00 -0.74 0.00 0.00 36.82 38.52 1up6 h ILE 93 CO 0.06 0.16 -0.07 -0.65 0.00 0.00 0.00 178.15 177.66 1up6 h PRO 94 N 0.76 0.00 -0.69 2.37 0.11 -1.79 -3.29 132.00 129.46 1up6 h PRO 94 Ca 0.20 0.00 0.08 0.00 0.11 0.00 0.00 66.00 66.39 1up6 h PRO 94 Cb -0.03 0.00 -0.06 0.00 0.11 0.00 0.00 31.00 31.01 1up6 h PRO 94 CO -0.04 0.07 0.37 -0.07 -0.21 0.00 0.00 178.00 178.12 1up6 h LEU 95 N 0.00 0.51 -2.16 2.35 4.07 -1.60 -2.05 115.31 116.42 1up6 h LEU 95 Ca -0.00 0.04 -0.01 0.00 0.08 0.00 0.00 57.88 57.99 1up6 h LEU 95 Cb 0.35 -0.05 -0.00 0.00 1.08 0.00 0.00 40.66 42.04 1up6 h LEU 95 CO 0.01 0.32 -0.06 0.07 -1.08 0.00 0.00 178.44 177.69 1up6 h LYS 96 N 0.65 0.00 -0.02 1.13 2.10 -1.76 -0.54 116.57 118.14 1up6 h LYS 96 Ca 0.32 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.97 1up6 h LYS 96 Cb 0.27 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 31.60 1up6 h LYS 96 CO -0.22 0.06 0.00 0.66 -2.00 0.00 0.00 179.45 177.95 1up6 n TYR 97 N -3.47 0.01 -1.50 0.07 4.02 -0.81 -4.90 117.16 110.58 1up6 n TYR 97 Ca -0.02 -0.00 -0.02 0.00 -0.01 0.00 0.00 57.90 57.85 1up6 n TYR 97 Cb 0.19 0.00 -0.00 0.00 -0.02 0.00 0.00 39.34 39.51 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 1.12 0.41 3.69 2.72 0.00 -0.21 -5.03 105.19 107.90 1up6 n GLY 98 Ca 0.20 -0.93 -0.30 0.00 0.00 0.00 0.00 46.02 44.99 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 -0.41 3.48 0.08 0.99 1.02 -0.98 -5.03 118.68 117.83 1up6 s LEU 99 Ca 0.00 -0.17 -0.33 0.00 0.02 0.00 0.00 54.13 53.66 1up6 s LEU 99 Cb 0.00 -2.21 -0.12 0.00 0.02 0.00 0.00 46.19 43.89 1up6 s LEU 99 CO 0.00 0.18 1.77 -0.38 0.02 0.00 0.00 176.35 177.94 1up6 n ILE 100 N 0.57 0.30 -3.88 -0.59 2.08 -1.26 -3.85 119.36 112.73 1up6 n ILE 100 Ca -0.11 -0.05 -0.35 0.00 0.56 0.00 0.00 62.75 62.79 1up6 n ILE 100 Cb 0.52 -1.88 -0.14 0.00 -0.75 0.00 0.00 39.64 37.39 1up6 n ILE 100 CO 0.00 0.00 0.00 -0.83 0.56 0.00 0.00 176.55 176.28 1up6 s GLY 101 N 2.49 1.68 -0.07 7.39 0.00 -1.26 -4.29 107.32 113.26 1up6 s GLY 101 Ca 0.84 -1.43 -0.21 0.00 0.00 0.00 0.00 44.72 43.91 1up6 s GLY 101 CO 0.41 0.55 0.50 1.62 0.00 0.00 0.00 173.10 176.18 1up6 s GLN 102 N 1.40 0.79 0.24 2.90 -0.44 -1.26 -4.73 119.66 118.57 1up6 s GLN 102 Ca 0.02 0.20 -0.06 0.00 -2.50 0.00 0.00 55.36 53.02 1up6 s GLN 102 Cb -0.17 0.37 0.43 0.00 -1.64 0.00 0.00 33.01 32.00 1up6 s GLN 102 CO -0.02 -0.21 1.69 1.49 0.50 0.00 0.00 175.29 178.74 1up6 h GLU 103 N 3.93 0.27 0.00 1.67 4.81 -1.89 -3.26 114.58 120.11 1up6 h GLU 103 Ca -0.28 -0.02 0.00 0.00 -0.13 0.00 0.00 59.36 58.93 1up6 h GLU 103 Cb 1.16 -0.06 0.00 0.00 0.63 0.00 0.00 28.75 30.48 1up6 h GLU 103 CO 0.34 0.18 -0.02 0.25 -0.73 0.00 0.00 179.01 179.03 1up6 n THR 104 N -5.15 0.00 -4.59 0.32 -2.24 -1.26 -3.71 114.28 97.65 1up6 n THR 104 Ca 0.13 -0.45 -0.33 0.00 -2.27 0.00 0.00 64.05 61.13 1up6 n THR 104 Cb 0.43 0.99 -0.15 0.00 -2.10 0.00 0.00 70.33 69.50 1up6 n THR 104 CO 0.00 0.00 0.00 -0.89 -0.57 0.00 0.00 175.07 173.61 1up6 s THR 105 N -0.93 2.72 0.00 4.28 2.01 -1.24 -4.13 115.64 118.34 1up6 s THR 105 Ca 0.00 -0.76 0.00 0.00 0.31 0.00 0.00 61.69 61.24 1up6 s THR 105 Cb 0.00 -2.14 0.00 0.00 0.01 0.00 0.00 72.50 70.37 1up6 s THR 105 CO 0.00 0.52 0.00 0.61 -0.69 0.00 0.00 174.62 175.06 1up6 n GLY 106 N 3.96 0.14 0.34 4.40 0.00 -1.26 -4.17 105.19 108.59 1up6 n GLY 106 Ca -0.19 -1.05 -0.03 0.00 0.00 0.00 0.00 46.02 44.75 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 1.24 -0.68 1.61 2.07 -1.82 -1.91 116.25 116.76 1up6 h VAL 107 Ca 0.00 -0.63 0.07 0.00 0.82 0.00 0.00 66.70 66.96 1up6 h VAL 107 Cb 0.00 0.22 -0.06 0.00 -1.52 0.00 0.00 31.29 29.93 1up6 h VAL 107 CO 0.00 0.27 0.36 1.23 0.02 0.00 0.00 177.57 179.45 1up6 h GLY 108 N 1.13 1.00 1.60 2.17 0.00 -1.69 -1.81 103.07 105.46 1up6 h GLY 108 Ca 0.27 -0.24 -0.06 0.00 0.00 0.00 0.00 47.33 47.30 1up6 h GLY 108 CO -0.04 0.12 -0.06 -1.33 0.00 0.00 0.00 176.54 175.23 1up6 h GLY 109 N 0.64 0.53 0.97 4.60 0.00 -1.42 -1.53 103.07 106.87 1up6 h GLY 109 Ca 0.31 -0.34 -0.02 0.00 0.00 0.00 0.00 47.33 47.29 1up6 h GLY 109 CO -0.21 0.31 -0.23 -2.75 0.00 0.00 0.00 176.54 173.66 1up6 h PHE 110 N 0.47 -0.59 -0.44 5.60 3.57 -0.76 -0.65 116.94 124.15 1up6 h PHE 110 Ca 0.10 -0.01 -0.10 0.00 3.53 0.00 0.00 57.97 61.49 1up6 h PHE 110 Cb 0.40 0.19 -0.02 0.00 2.79 0.00 0.00 35.95 39.31 1up6 h PHE 110 CO 0.01 -0.35 -0.11 0.66 -2.23 0.00 0.00 178.31 176.29 1up6 h SER 111 N -0.67 0.78 -0.95 0.41 4.64 -1.38 -1.66 113.55 114.73 1up6 h SER 111 Ca -0.06 -0.24 0.07 0.00 -0.47 0.00 0.00 61.79 61.09 1up6 h SER 111 Cb 0.50 -0.21 -0.07 0.00 -0.31 0.00 0.00 62.40 62.32 1up6 h SER 111 CO 0.11 0.92 0.60 0.00 -0.87 0.00 0.00 176.83 177.59 1up6 h ALA 112 N 1.15 1.32 -0.05 5.18 0.00 -1.22 -2.40 119.26 123.24 1up6 h ALA 112 Ca 0.12 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.02 1up6 h ALA 112 Cb 0.60 -0.27 -0.00 0.00 0.00 0.00 0.00 17.79 18.12 1up6 h ALA 112 CO 0.04 0.36 0.03 0.00 0.00 0.00 0.00 179.25 179.69 1up6 h ALA 113 N 1.44 0.07 -0.92 0.00 0.00 -0.67 -1.80 119.26 117.37 1up6 h ALA 113 Ca 0.42 -0.01 0.10 0.00 0.00 0.00 0.00 54.91 55.42 1up6 h ALA 113 Cb 0.19 -0.02 -0.07 0.00 0.00 0.00 0.00 17.79 17.89 1up6 h ALA 113 CO -0.18 -0.43 0.59 -0.07 0.00 0.00 0.00 179.25 179.15 1up6 h LEU 114 N 0.07 0.82 -0.52 0.00 3.38 -1.05 -0.24 115.31 117.77 1up6 h LEU 114 Ca 0.02 0.03 -0.16 0.00 0.09 0.00 0.00 57.88 57.85 1up6 h LEU 114 Cb -0.00 -0.14 -0.01 0.00 0.09 0.00 0.00 40.66 40.60 1up6 h LEU 114 CO -0.00 0.47 -0.70 0.03 0.09 0.00 0.00 178.44 178.32 1up6 h ARG 115 N 0.90 0.21 0.24 1.13 3.08 -1.33 -3.36 114.38 115.26 1up6 h ARG 115 Ca 0.43 -0.17 -0.33 0.00 0.07 0.00 0.00 59.98 59.98 1up6 h ARG 115 Cb 0.44 0.04 0.03 0.00 0.08 0.00 0.00 29.97 30.56 1up6 h ARG 115 CO -0.20 0.83 -1.44 0.00 -1.07 0.00 0.00 179.97 178.09 1up6 h ALA 116 N 1.12 -0.12 -0.58 0.04 0.00 -0.37 -3.39 119.26 115.96 1up6 h ALA 116 Ca -0.02 -0.86 0.12 0.00 0.00 0.00 0.00 54.91 54.14 1up6 h ALA 116 Cb 1.25 0.15 -0.11 0.00 0.00 0.00 0.00 17.79 19.09 1up6 h ALA 116 CO 0.11 0.74 -0.11 0.74 0.00 0.00 0.00 179.25 180.72 1up6 h PHE 117 N 0.14 -0.25 -0.59 0.00 0.04 -1.23 -0.90 116.94 114.15 1up6 h PHE 117 Ca -0.24 0.05 -0.07 0.00 2.80 0.00 0.00 57.97 60.52 1up6 h PHE 117 Cb 2.14 0.20 -0.03 0.00 2.20 0.00 0.00 35.95 40.46 1up6 h PHE 117 CO 0.12 -0.23 0.11 -1.35 -0.60 0.00 0.00 178.31 176.36 1up6 h PRO 118 N 0.02 0.95 -0.22 1.51 0.11 -1.77 0.34 132.00 132.94 1up6 h PRO 118 Ca 0.28 -0.23 -0.09 0.00 0.11 0.00 0.00 66.00 66.08 1up6 h PRO 118 Cb 0.44 -0.12 -0.00 0.00 0.11 0.00 0.00 31.00 31.42 1up6 h PRO 118 CO -0.57 0.87 -0.21 0.82 -0.21 0.00 0.00 178.00 178.70 1up6 h ILE 119 N 0.90 1.32 -0.34 4.15 2.04 -1.61 -2.04 117.51 121.93 1up6 h ILE 119 Ca 0.19 -1.37 -0.10 0.00 1.00 0.00 0.00 64.86 64.57 1up6 h ILE 119 Cb 0.38 1.71 -0.01 0.00 -0.74 0.00 0.00 36.82 38.16 1up6 h ILE 119 CO 0.01 0.42 -0.21 -0.37 0.00 0.00 0.00 178.15 178.00 1up6 h VAL 120 N 0.22 1.27 -0.20 1.67 -1.51 -1.03 0.27 116.25 116.94 1up6 h VAL 120 Ca 0.04 -1.27 0.04 0.00 -1.23 0.00 0.00 66.70 64.28 1up6 h VAL 120 Cb 0.76 1.24 -0.04 0.00 -2.13 0.00 0.00 31.29 31.11 1up6 h VAL 120 CO 0.05 0.42 -0.07 -0.33 -1.23 0.00 0.00 177.57 176.41 1up6 h GLU 121 N 0.57 -0.04 -0.56 5.19 5.08 -0.83 0.80 114.58 124.80 1up6 h GLU 121 Ca 0.09 0.00 -0.01 0.00 -1.00 0.00 0.00 59.36 58.44 1up6 h GLU 121 Cb 0.67 0.01 -0.03 0.00 0.50 0.00 0.00 28.75 29.91 1up6 h GLU 121 CO 0.05 -0.02 0.32 1.49 -1.00 0.00 0.00 179.01 179.85 1up6 h GLU 122 N -0.04 0.77 -0.30 2.33 4.81 -1.02 -2.26 114.58 118.87 1up6 h GLU 122 Ca 0.10 -0.08 -0.14 0.00 -0.13 0.00 0.00 59.36 59.12 1up6 h GLU 122 Cb 0.20 -0.16 -0.00 0.00 0.63 0.00 0.00 28.75 29.42 1up6 h GLU 122 CO -0.23 0.57 -0.35 1.88 -0.73 0.00 0.00 179.01 180.15 1up6 h TYR 123 N 0.75 0.94 -0.46 0.92 0.05 -0.44 -2.49 116.97 116.23 1up6 h TYR 123 Ca 0.20 -0.30 -0.05 0.00 0.05 0.00 0.00 58.73 58.63 1up6 h TYR 123 Cb 0.02 -0.19 -0.02 0.00 1.01 0.00 0.00 36.73 37.54 1up6 h TYR 123 CO -0.02 1.07 0.10 0.28 -1.05 0.00 0.00 178.16 178.55 1up6 h VAL 124 N 0.53 1.24 -0.41 -2.88 2.07 -0.81 -1.92 116.25 114.07 1up6 h VAL 124 Ca 0.04 -0.86 0.08 0.00 0.82 0.00 0.00 66.70 66.78 1up6 h VAL 124 Cb 0.94 0.91 -0.07 0.00 -1.52 0.00 0.00 31.29 31.55 1up6 h VAL 124 CO 0.09 0.30 -0.03 -0.78 0.02 0.00 0.00 177.57 177.17 1up6 h ASP 125 N 0.63 -0.23 -0.50 0.57 3.58 -1.39 0.13 116.42 119.21 1up6 h ASP 125 Ca 0.14 0.10 -0.01 0.00 0.42 0.00 0.00 57.03 57.68 1up6 h ASP 125 Cb 0.35 0.19 -0.02 0.00 1.72 0.00 0.00 39.33 41.57 1up6 h ASP 125 CO 0.00 -0.07 0.26 0.74 -2.88 0.00 0.00 179.24 177.29 1up6 h THR 126 N 0.08 1.18 -0.27 2.25 2.02 -1.25 -0.84 112.91 116.08 1up6 h THR 126 Ca 0.20 -0.48 -0.00 0.00 0.77 0.00 0.00 66.41 66.90 1up6 h THR 126 Cb 0.30 0.59 -0.01 0.00 -1.74 0.00 0.00 68.15 67.29 1up6 h THR 126 CO -0.36 0.20 0.16 0.58 0.37 0.00 0.00 175.52 176.46 1up6 h VAL 127 N 0.66 1.11 -0.55 3.16 2.07 -1.03 -2.61 116.25 119.06 1up6 h VAL 127 Ca 0.17 -0.28 0.09 0.00 0.82 0.00 0.00 66.70 67.50 1up6 h VAL 127 Cb 0.08 0.80 -0.07 0.00 -1.52 0.00 0.00 31.29 30.58 1up6 h VAL 127 CO -0.03 0.11 0.18 -0.09 0.02 0.00 0.00 177.57 177.76 1up6 h ARG 128 N 0.34 0.33 0.00 1.57 2.43 -0.59 0.54 114.38 118.99 1up6 h ARG 128 Ca 0.10 -0.02 0.00 0.00 -0.81 0.00 0.00 59.98 59.25 1up6 h ARG 128 Cb 0.04 -0.07 0.00 0.00 -0.42 0.00 0.00 29.97 29.51 1up6 h ARG 128 CO -0.02 0.22 0.00 1.63 -1.51 0.00 0.00 179.97 180.29 1up6 n LYS 129 N -5.04 0.23 0.00 0.20 5.02 -0.34 -4.40 118.16 113.83 1up6 n LYS 129 Ca 0.07 0.06 0.00 0.00 -2.02 0.00 0.00 58.31 56.42 1up6 n LYS 129 Cb 0.25 -1.50 0.00 0.00 -0.02 0.00 0.00 35.03 33.76 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 -1.36 0.00 0.18 -0.18 -2.24 -0.99 -4.98 114.28 104.71 1up6 n THR 130 Ca 0.10 0.00 0.11 0.00 -2.27 0.00 0.00 64.05 61.99 1up6 n THR 130 Cb 0.23 0.00 0.11 0.00 -2.10 0.00 0.00 70.33 68.57 1up6 n THR 130 CO 0.00 0.00 0.00 0.77 -0.57 0.00 0.00 175.07 175.27 1up6 h SER 131 N 0.00 0.00 -5.49 3.42 4.64 -1.58 -3.48 113.55 111.06 1up6 h SER 131 Ca 0.00 0.00 -0.41 0.00 -0.47 0.00 0.00 61.79 60.91 1up6 h SER 131 Cb 0.00 0.00 -0.05 0.00 -0.31 0.00 0.00 62.40 62.04 1up6 h SER 131 CO 0.00 0.04 -0.62 0.59 -0.87 0.00 0.00 176.83 175.97 1up6 n ASN 132 N -2.99 -4.46 -4.62 4.97 3.02 0.14 -4.95 115.26 106.37 1up6 n ASN 132 Ca 0.02 -0.48 -0.31 0.00 -0.03 0.00 0.00 54.58 53.79 1up6 n ASN 132 Cb 0.55 -3.63 0.16 0.00 -0.61 0.00 0.00 39.78 36.25 1up6 n ASN 132 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1up6 n ALA 133 N -3.82 -1.14 -2.52 5.41 0.00 -1.26 -4.98 120.51 112.19 1up6 n ALA 133 Ca -0.02 -0.56 -0.42 0.00 0.00 0.00 0.00 53.44 52.43 1up6 n ALA 133 Cb 0.55 -2.12 -0.03 0.00 0.00 0.00 0.00 19.45 17.85 1up6 n ALA 133 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 177.50 178.49 1up6 s THR 134 N -2.58 4.39 -0.16 0.00 2.01 -0.80 -4.86 115.64 113.64 1up6 s THR 134 Ca 0.65 1.70 -0.14 0.00 0.31 0.00 0.00 61.69 64.21 1up6 s THR 134 Cb -0.23 -4.09 -0.05 0.00 0.01 0.00 0.00 72.50 68.14 1up6 s THR 134 CO 0.60 0.02 0.31 -0.63 -0.69 0.00 0.00 174.62 174.23 1up6 s ILE 135 N 1.95 5.29 -0.26 1.82 1.01 0.16 -1.19 121.20 129.98 1up6 s ILE 135 Ca 0.54 0.59 -0.05 0.00 0.00 0.00 0.00 60.65 61.73 1up6 s ILE 135 Cb -0.24 -3.65 0.01 0.00 0.01 0.00 0.00 42.46 38.59 1up6 s ILE 135 CO 0.22 0.37 0.01 -0.69 0.00 0.00 0.00 174.94 174.85 1up6 s VAL 136 N 0.57 3.56 -0.22 2.92 1.01 0.84 -0.60 120.40 128.48 1up6 s VAL 136 Ca 0.17 -0.68 -0.06 0.00 0.00 0.00 0.00 61.98 61.41 1up6 s VAL 136 Cb -0.13 -2.76 -0.03 0.00 0.00 0.00 0.00 36.38 33.46 1up6 s VAL 136 CO 0.05 0.22 0.04 0.21 0.00 0.00 0.00 175.10 175.61 1up6 s ASN 137 N 1.46 5.02 -0.07 3.32 2.47 0.08 -0.73 114.94 126.49 1up6 s ASN 137 Ca 0.03 -0.18 0.13 0.00 0.42 0.00 0.00 52.86 53.26 1up6 s ASN 137 Cb -0.16 -1.88 -0.20 0.00 -1.45 0.00 0.00 41.25 37.56 1up6 s ASN 137 CO -0.01 0.03 0.19 0.49 -3.72 0.00 0.00 177.10 174.08 1up6 n PHE 138 N 4.49 0.00 -1.62 0.43 3.72 0.32 -0.29 117.46 124.52 1up6 n PHE 138 Ca -0.17 0.00 -0.56 0.00 -0.05 0.00 0.00 57.45 56.68 1up6 n PHE 138 Cb 0.52 -0.49 -0.07 0.00 -0.94 0.00 0.00 39.48 38.50 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 -2.24 0.08 -3.43 4.37 -1.04 -1.05 -4.66 114.28 106.31 1up6 n THR 139 Ca -0.12 -0.01 -0.32 0.00 -2.04 0.00 0.00 64.05 61.56 1up6 n THR 139 Cb 0.65 -0.78 -0.05 0.00 -1.82 0.00 0.00 70.33 68.32 1up6 n THR 139 CO 0.00 0.00 0.00 0.20 -0.64 0.00 0.00 175.07 174.63 1up6 s ASN 140 N 1.38 6.61 -0.33 8.00 0.01 -1.26 -2.99 114.94 126.36 1up6 s ASN 140 Ca 0.90 0.89 -0.28 0.00 -0.71 0.00 0.00 52.86 53.67 1up6 s ASN 140 Cb -1.07 -2.21 0.02 0.00 0.41 0.00 0.00 41.25 38.39 1up6 s ASN 140 CO 0.56 -0.07 1.01 -2.16 -1.51 0.00 0.00 177.10 174.93 1up6 s PRO 141 N -2.82 4.00 0.14 -0.60 0.04 -1.26 -4.76 135.00 129.75 1up6 s PRO 141 Ca 0.47 0.90 -0.15 0.00 0.04 0.00 0.00 61.00 62.26 1up6 s PRO 141 Cb -0.11 -3.75 0.02 0.00 0.04 0.00 0.00 34.50 30.69 1up6 s PRO 141 CO 0.22 -0.90 1.70 1.03 0.04 0.00 0.00 177.00 179.08 1up6 h SER 142 N 8.21 0.61 -0.35 6.66 0.87 -1.80 -1.03 113.55 126.72 1up6 h SER 142 Ca -0.22 -0.16 -0.03 0.00 -1.23 0.00 0.00 61.79 60.15 1up6 h SER 142 Cb 1.07 -0.16 -0.01 0.00 -0.44 0.00 0.00 62.40 62.86 1up6 h SER 142 CO 1.01 0.60 0.09 1.23 -0.53 0.00 0.00 176.83 179.24 1up6 h GLY 143 N 0.58 0.60 1.00 5.77 0.00 -1.88 -1.45 103.07 107.69 1up6 h GLY 143 Ca 0.15 -0.37 -0.02 0.00 0.00 0.00 0.00 47.33 47.10 1up6 h GLY 143 CO -0.01 0.34 0.37 0.84 0.00 0.00 0.00 176.54 178.07 1up6 h HIS 144 N 0.41 0.96 -0.60 5.60 6.17 -1.88 -1.20 115.15 124.61 1up6 h HIS 144 Ca 0.11 -0.03 -0.09 0.00 0.71 0.00 0.00 60.37 61.07 1up6 h HIS 144 Cb 0.28 -0.30 -0.02 0.00 2.52 0.00 0.00 27.41 29.89 1up6 h HIS 144 CO 0.01 0.69 0.03 0.82 0.71 0.00 0.00 177.93 180.19 1up6 h ILE 145 N 0.95 1.26 -0.48 6.26 2.04 -1.16 -1.94 117.51 124.44 1up6 h ILE 145 Ca 0.24 -1.11 0.03 0.00 1.00 0.00 0.00 64.86 65.02 1up6 h ILE 145 Cb 0.06 0.80 -0.03 0.00 -0.74 0.00 0.00 36.82 36.91 1up6 h ILE 145 CO -0.04 0.40 0.27 0.74 0.00 0.00 0.00 178.15 179.53 1up6 h THR 146 N 0.93 1.02 -0.79 -0.27 2.02 -0.97 0.79 112.91 115.64 1up6 h THR 146 Ca 0.17 -0.19 0.11 0.00 0.77 0.00 0.00 66.41 67.27 1up6 h THR 146 Cb 0.52 0.43 -0.08 0.00 -1.74 0.00 0.00 68.15 67.29 1up6 h THR 146 CO 0.03 0.10 0.42 -0.08 0.37 0.00 0.00 175.52 176.35 1up6 h GLU 147 N 0.55 0.66 -0.04 6.66 4.57 -1.02 0.98 114.58 126.92 1up6 h GLU 147 Ca 0.20 -0.04 -0.01 0.00 -1.18 0.00 0.00 59.36 58.33 1up6 h GLU 147 Cb 0.05 -0.15 -0.00 0.00 -0.16 0.00 0.00 28.75 28.49 1up6 h GLU 147 CO -0.10 0.43 0.00 0.35 -1.18 0.00 0.00 179.01 178.51 1up6 h PHE 148 N 0.68 0.09 -0.17 0.92 3.57 -0.57 -2.17 116.94 119.29 1up6 h PHE 148 Ca 0.40 -0.01 -0.12 0.00 3.53 0.00 0.00 57.97 61.76 1up6 h PHE 148 Cb 0.44 -0.02 0.00 0.00 2.79 0.00 0.00 35.95 39.16 1up6 h PHE 148 CO -0.09 0.36 -0.37 0.28 -2.23 0.00 0.00 178.31 176.26 1up6 h VAL 149 N -0.21 1.35 -0.53 1.41 2.07 -0.48 -0.96 116.25 118.89 1up6 h VAL 149 Ca 0.01 -1.62 -0.10 0.00 0.82 0.00 0.00 66.70 65.81 1up6 h VAL 149 Cb 0.32 1.96 -0.02 0.00 -1.52 0.00 0.00 31.29 32.03 1up6 h VAL 149 CO 0.00 0.49 -0.06 0.03 0.02 0.00 0.00 177.57 178.06 1up6 h ARG 150 N 0.19 0.97 -0.00 1.57 2.47 -0.89 0.19 114.38 118.88 1up6 h ARG 150 Ca 0.00 -0.34 0.00 0.00 -1.26 0.00 0.00 59.98 58.38 1up6 h ARG 150 Cb 0.97 -0.07 0.00 0.00 -1.65 0.00 0.00 29.97 29.22 1up6 h ARG 150 CO 0.08 1.01 -0.45 0.09 0.56 0.00 0.00 179.97 181.26 1up6 n ASN 151 N -4.22 0.73 -0.00 7.04 3.02 -0.82 -3.92 115.26 117.09 1up6 n ASN 151 Ca 0.01 -0.86 -0.02 0.00 -0.03 0.00 0.00 54.58 53.68 1up6 n ASN 151 Cb 0.37 0.86 -0.01 0.00 -0.61 0.00 0.00 39.78 40.39 1up6 n ASN 151 CO 0.00 0.00 0.00 -1.22 -2.62 0.00 0.00 177.26 173.42 1up6 n TYR 152 N -0.99 0.00 0.18 3.10 4.02 -0.41 -4.69 117.16 118.37 1up6 n TYR 152 Ca 0.03 0.00 0.06 0.00 -0.01 0.00 0.00 57.90 57.97 1up6 n TYR 152 Cb 0.19 -0.07 0.25 0.00 -0.02 0.00 0.00 39.34 39.69 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 -0.08 0.00 -1.74 7.72 3.38 -1.44 -3.48 115.31 119.67 1up6 h LEU 153 Ca -0.05 0.00 -0.35 0.00 0.09 0.00 0.00 57.88 57.57 1up6 h LEU 153 Cb 0.93 0.00 0.14 0.00 0.09 0.00 0.00 40.66 41.82 1up6 h LEU 153 CO -0.03 0.38 -0.79 -0.62 0.09 0.00 0.00 178.44 177.47 1up6 n GLU 154 N -3.38 -5.92 -3.74 1.13 1.02 0.59 -4.99 120.64 105.36 1up6 n GLU 154 Ca 0.01 0.79 -0.37 0.00 -0.02 0.00 0.00 57.16 57.56 1up6 n GLU 154 Cb 0.57 -5.67 -0.12 0.00 -0.02 0.00 0.00 31.44 26.20 1up6 n GLU 154 CO 0.00 0.00 0.00 -0.47 1.18 0.00 0.00 177.13 177.84 1up6 s TYR 155 N -3.44 3.14 0.08 -0.32 5.04 -0.73 -5.01 117.35 116.11 1up6 s TYR 155 Ca 0.03 -0.81 -0.14 0.00 -2.44 0.00 0.00 57.07 53.70 1up6 s TYR 155 Cb -0.00 -2.27 -0.16 0.00 0.35 0.00 0.00 41.96 39.87 1up6 s TYR 155 CO 0.75 -0.52 1.28 1.49 -1.34 0.00 0.00 175.55 177.21 1up6 h GLU 156 N 8.26 0.71 -2.29 4.97 4.81 -1.90 -3.34 114.58 125.80 1up6 h GLU 156 Ca -0.33 -0.58 -0.49 0.00 -0.13 0.00 0.00 59.36 57.83 1up6 h GLU 156 Cb 1.14 0.12 -0.10 0.00 0.63 0.00 0.00 28.75 30.53 1up6 h GLU 156 CO 0.60 1.19 1.17 1.63 -0.73 0.00 0.00 179.01 182.87 1up6 n LYS 157 N -4.04 2.98 -3.97 1.92 5.02 -1.26 -4.77 118.16 114.05 1up6 n LYS 157 Ca -0.08 -2.20 -0.31 0.00 -2.02 0.00 0.00 58.31 53.71 1up6 n LYS 157 Cb 0.70 -2.31 -0.15 0.00 -0.02 0.00 0.00 35.03 33.24 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 -0.24 2.73 -0.25 2.13 2.19 -1.25 0.35 117.98 123.64 1up6 s PHE 158 Ca 0.62 -2.05 -0.04 0.00 0.33 0.00 0.00 56.93 55.78 1up6 s PHE 158 Cb 0.29 -1.85 0.00 0.00 -1.31 0.00 0.00 43.02 40.15 1up6 s PHE 158 CO -0.11 -0.83 -0.01 0.42 1.83 0.00 0.00 175.22 176.52 1up6 s ILE 159 N 1.28 3.47 0.01 3.12 1.01 0.24 -4.91 121.20 125.42 1up6 s ILE 159 Ca -0.03 -0.65 -0.28 0.00 0.00 0.00 0.00 60.65 59.70 1up6 s ILE 159 Cb -0.19 -2.68 -0.04 0.00 0.01 0.00 0.00 42.46 39.56 1up6 s ILE 159 CO -0.07 0.28 0.88 -0.83 0.00 0.00 0.00 174.94 175.19 1up6 s GLY 160 N 1.46 2.84 0.32 6.18 0.00 -1.13 -0.74 107.32 116.26 1up6 s GLY 160 Ca 0.04 0.41 0.10 0.00 0.00 0.00 0.00 44.72 45.27 1up6 s GLY 160 CO -0.02 1.44 -0.11 1.08 0.00 0.00 0.00 173.10 175.49 1up6 s LEU 161 N 0.61 2.75 0.13 0.66 1.02 0.60 -0.75 118.68 123.70 1up6 s LEU 161 Ca 0.46 -1.10 -0.12 0.00 0.02 0.00 0.00 54.13 53.39 1up6 s LEU 161 Cb -0.21 -1.11 0.01 0.00 0.02 0.00 0.00 46.19 44.91 1up6 s LEU 161 CO 0.25 -0.13 0.33 0.00 0.02 0.00 0.00 176.35 176.82 1up6 n ASN 163 N -0.19 1.43 0.07 0.00 2.04 -1.26 -4.49 115.26 112.86 1up6 n ASN 163 Ca -0.13 -1.16 -0.11 0.00 -0.44 0.00 0.00 54.58 52.75 1up6 n ASN 163 Cb 0.63 0.25 -0.01 0.00 -2.53 0.00 0.00 39.78 38.12 1up6 n ASN 163 CO 0.00 0.00 0.00 -0.37 -0.44 0.00 0.00 177.26 176.45 1up6 h VAL 164 N 1.75 1.43 0.17 3.53 -1.51 -1.98 -1.67 116.25 117.95 1up6 h VAL 164 Ca 0.00 -2.43 0.01 0.00 -1.23 0.00 0.00 66.70 63.05 1up6 h VAL 164 Cb 0.60 2.36 -0.04 0.00 -2.13 0.00 0.00 31.29 32.08 1up6 h VAL 164 CO 0.00 0.72 -0.44 -0.65 -1.23 0.00 0.00 177.57 175.97 1up6 h PRO 165 N 0.20 -0.68 -0.33 5.19 0.11 -1.94 -1.14 132.00 133.40 1up6 h PRO 165 Ca -0.06 0.05 -0.07 0.00 0.11 0.00 0.00 66.00 66.03 1up6 h PRO 165 Cb 1.49 0.15 -0.02 0.00 0.11 0.00 0.00 31.00 32.73 1up6 h PRO 165 CO 0.14 -0.45 -0.09 0.97 -0.21 0.00 0.00 178.00 178.36 1up6 h ILE 166 N -0.70 1.23 -0.94 4.15 2.10 -1.81 -0.89 117.51 120.65 1up6 h ILE 166 Ca 0.01 -0.99 -0.01 0.00 1.08 0.00 0.00 64.86 64.95 1up6 h ILE 166 Cb 0.71 1.07 -0.04 0.00 -1.09 0.00 0.00 36.82 37.47 1up6 h ILE 166 CO -0.22 0.33 0.55 0.78 -1.08 0.00 0.00 178.15 178.51 1up6 h ASN 167 N 0.52 1.14 0.01 2.19 2.35 -1.26 -0.74 115.58 119.78 1up6 h ASN 167 Ca 0.10 -0.08 -0.00 0.00 -0.55 0.00 0.00 56.30 55.77 1up6 h ASN 167 Cb 0.47 -0.29 0.00 0.00 0.05 0.00 0.00 38.32 38.55 1up6 h ASN 167 CO 0.03 0.88 -0.00 0.15 -1.65 0.00 0.00 177.43 176.83 1up6 h PHE 168 N 1.30 -0.01 -0.68 1.19 3.04 -0.12 -2.11 116.94 119.54 1up6 h PHE 168 Ca 0.33 -0.00 0.13 0.00 3.98 0.00 0.00 57.97 62.41 1up6 h PHE 168 Cb -0.03 0.00 -0.09 0.00 2.56 0.00 0.00 35.95 38.39 1up6 h PHE 168 CO 0.01 0.32 0.22 0.82 -2.02 0.00 0.00 178.31 177.66 1up6 h ILE 169 N -0.34 0.65 -0.30 1.41 2.04 -1.16 -1.73 117.51 118.09 1up6 h ILE 169 Ca -0.00 -0.12 0.04 0.00 1.00 0.00 0.00 64.86 65.77 1up6 h ILE 169 Cb 0.33 0.26 -0.03 0.00 -0.74 0.00 0.00 36.82 36.64 1up6 h ILE 169 CO 0.00 0.07 0.09 -0.09 0.00 0.00 0.00 178.15 178.21 1up6 h ARG 170 N 0.36 0.20 -0.34 2.37 2.43 -1.03 -1.00 114.38 117.37 1up6 h ARG 170 Ca 0.37 -0.01 0.07 0.00 -0.81 0.00 0.00 59.98 59.60 1up6 h ARG 170 Cb 0.55 -0.05 -0.08 0.00 -0.42 0.00 0.00 29.97 29.97 1up6 h ARG 170 CO -0.40 0.13 -0.18 0.93 -1.51 0.00 0.00 179.97 178.95 1up6 h GLU 171 N 0.21 -0.12 -0.56 0.20 5.08 -0.75 -2.01 114.58 116.63 1up6 h GLU 171 Ca 0.14 0.01 -0.02 0.00 -1.00 0.00 0.00 59.36 58.48 1up6 h GLU 171 Cb 0.12 0.03 -0.03 0.00 0.50 0.00 0.00 28.75 29.37 1up6 h GLU 171 CO -0.15 -0.08 0.27 0.82 -1.00 0.00 0.00 179.01 178.86 1up6 h ILE 172 N -0.12 1.21 0.11 3.13 1.08 -0.96 -2.91 117.51 119.03 1up6 h ILE 172 Ca 0.17 -0.59 0.02 0.00 -0.39 0.00 0.00 64.86 64.07 1up6 h ILE 172 Cb 0.39 0.56 -0.03 0.00 -3.07 0.00 0.00 36.82 34.66 1up6 h ILE 172 CO -0.42 0.24 -0.26 0.00 -0.69 0.00 0.00 178.15 177.01 1up6 h ALA 173 N 1.10 -0.44 0.00 1.87 0.00 -1.02 -1.96 119.26 118.81 1up6 h ALA 173 Ca 0.19 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 55.06 1up6 h ALA 173 Cb 0.13 0.43 0.00 0.00 0.00 0.00 0.00 17.79 18.35 1up6 h ALA 173 CO -0.02 -0.80 0.00 0.39 0.00 0.00 0.00 179.25 178.82 1up6 n GLU 174 N -5.38 0.00 0.00 0.00 4.71 -0.77 0.52 120.64 119.72 1up6 n GLU 174 Ca -0.06 0.00 0.00 0.00 -0.01 0.00 0.00 57.16 57.09 1up6 n GLU 174 Cb 0.29 -1.31 0.00 0.00 -1.01 0.00 0.00 31.44 29.41 1up6 n GLU 174 CO 0.00 0.00 0.00 1.19 0.09 0.00 0.00 177.13 178.41 1up6 n PHE 176 N 0.91 0.00 -3.39 -0.32 3.72 -0.74 -4.79 117.46 112.85 1up6 n PHE 176 Ca 0.00 0.00 -0.17 0.00 -0.05 0.00 0.00 57.45 57.23 1up6 n PHE 176 Cb 0.00 0.00 0.08 0.00 -0.94 0.00 0.00 39.48 38.62 1up6 n PHE 176 CO 0.00 0.00 0.00 0.43 -0.05 0.00 0.00 176.76 177.14 1up6 n SER 177 N 0.00 -3.60 -4.28 4.37 7.64 0.19 -5.02 113.62 112.92 1up6 n SER 177 Ca 0.00 -0.67 -0.15 0.00 1.01 0.00 0.00 58.87 59.06 1up6 n SER 177 Cb 0.00 -5.05 -0.10 0.00 -1.01 0.00 0.00 64.21 58.05 1up6 n SER 177 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1up6 s ALA 178 N -3.39 1.53 0.77 -0.43 0.00 -0.54 -5.12 121.76 114.57 1up6 s ALA 178 Ca 0.16 -1.73 -0.11 0.00 0.00 0.00 0.00 51.96 50.28 1up6 s ALA 178 Cb -0.02 0.81 0.05 0.00 0.00 0.00 0.00 23.12 23.96 1up6 s ALA 178 CO 0.74 -0.39 1.10 1.03 0.00 0.00 0.00 175.76 178.24 1up6 s ARG 179 N -3.98 2.32 0.15 0.00 0.52 -1.26 -4.49 118.95 112.21 1up6 s ARG 179 Ca 0.31 0.58 -0.17 0.00 -0.52 0.00 0.00 55.73 55.94 1up6 s ARG 179 Cb 0.07 -1.95 0.06 0.00 0.52 0.00 0.00 34.95 33.65 1up6 s ARG 179 CO 0.09 -1.44 1.73 -0.07 0.02 0.00 0.00 175.30 175.63 1up6 h LEU 180 N -0.96 0.01 0.00 2.53 3.38 -1.97 -2.35 115.31 115.96 1up6 h LEU 180 Ca -0.46 0.06 0.00 0.00 0.09 0.00 0.00 57.88 57.56 1up6 h LEU 180 Cb 1.26 0.07 0.00 0.00 0.09 0.00 0.00 40.66 42.09 1up6 h LEU 180 CO 0.61 0.04 0.00 -1.84 0.09 0.00 0.00 178.44 177.34 1up6 n GLU 181 N -5.09 0.26 0.00 1.13 0.28 -1.26 -1.90 120.64 114.07 1up6 n GLU 181 Ca 0.01 0.08 0.14 0.00 -0.16 0.00 0.00 57.16 57.24 1up6 n GLU 181 Cb 0.15 -1.50 0.70 0.00 1.43 0.00 0.00 31.44 32.22 1up6 n GLU 181 CO 0.00 0.00 0.00 -0.25 -0.16 0.00 0.00 177.13 176.72 1up6 n ASP 182 N -1.32 0.01 -4.69 -1.84 8.00 -0.88 -4.74 116.55 111.08 1up6 n ASP 182 Ca 0.10 0.12 -0.36 0.00 0.71 0.00 0.00 54.79 55.36 1up6 n ASP 182 Cb 0.19 -0.37 -0.09 0.00 -0.02 0.00 0.00 41.12 40.84 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 -2.75 5.37 -0.05 2.53 1.01 -0.80 -0.57 120.40 125.14 1up6 s VAL 183 Ca 0.22 0.25 0.01 0.00 0.00 0.00 0.00 61.98 62.46 1up6 s VAL 183 Cb 0.20 -3.51 0.02 0.00 0.00 0.00 0.00 36.38 33.08 1up6 s VAL 183 CO 0.49 0.38 -0.06 0.12 0.00 0.00 0.00 175.10 176.03 1up6 s PHE 184 N 0.76 0.89 0.08 5.22 2.19 -0.54 -5.01 117.98 121.56 1up6 s PHE 184 Ca 0.09 -0.27 0.09 0.00 0.33 0.00 0.00 56.93 57.17 1up6 s PHE 184 Cb -0.13 -0.73 -0.04 0.00 -1.31 0.00 0.00 43.02 40.82 1up6 s PHE 184 CO 0.02 -0.19 -0.21 -0.51 1.83 0.00 0.00 175.22 176.16 1up6 s LEU 185 N 0.78 2.53 -0.39 6.12 1.02 -1.26 -0.64 118.68 126.84 1up6 s LEU 185 Ca -0.12 -0.54 -0.22 0.00 0.02 0.00 0.00 54.13 53.28 1up6 s LEU 185 Cb -0.14 -1.45 0.01 0.00 0.02 0.00 0.00 46.19 44.63 1up6 s LEU 185 CO 0.01 0.22 0.70 -0.75 0.02 0.00 0.00 176.35 176.56 1up6 s LYS 186 N -1.72 3.59 -0.09 1.70 2.20 -0.50 -4.93 119.74 120.00 1up6 s LYS 186 Ca 0.15 0.03 -0.05 0.00 -0.36 0.00 0.00 55.97 55.74 1up6 s LYS 186 Cb -0.10 -3.85 0.04 0.00 -1.51 0.00 0.00 37.83 32.40 1up6 s LYS 186 CO 0.06 -0.88 0.21 -0.47 -0.36 0.00 0.00 175.35 173.91 1up6 s TYR 187 N 2.94 -0.25 0.04 4.03 6.14 -1.26 -1.01 117.35 127.98 1up6 s TYR 187 Ca 0.27 0.63 -0.27 0.00 0.64 0.00 0.00 57.07 58.34 1up6 s TYR 187 Cb -0.14 0.03 0.09 0.00 0.42 0.00 0.00 41.96 42.36 1up6 s TYR 187 CO 0.17 -0.18 0.87 1.52 0.64 0.00 0.00 175.55 178.58 1up6 s TYR 188 N 0.85 -0.33 -5.00 4.97 1.13 -0.42 -4.34 117.35 114.22 1up6 s TYR 188 Ca -0.06 0.15 0.00 0.00 -1.41 0.00 0.00 57.07 55.75 1up6 s TYR 188 Cb -0.08 0.56 0.00 0.00 -1.10 0.00 0.00 41.96 41.34 1up6 s TYR 188 CO -0.05 -0.63 0.00 0.41 -2.51 0.00 0.00 175.55 172.77 1up6 n GLY 189 N -0.30 0.77 3.81 5.49 0.00 -1.22 -0.47 105.19 113.27 1up6 n GLY 189 Ca -0.09 -1.73 -0.22 0.00 0.00 0.00 0.00 46.02 43.98 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 3.73 0.08 0.99 1.02 -0.29 0.14 118.68 124.35 1up6 s LEU 190 Ca 0.00 -0.32 -0.34 0.00 0.02 0.00 0.00 54.13 53.50 1up6 s LEU 190 Cb 0.00 -2.26 -0.13 0.00 0.02 0.00 0.00 46.19 43.82 1up6 s LEU 190 CO 0.00 -0.06 1.71 -3.20 0.02 0.00 0.00 176.35 174.82 1up6 n ASN 191 N -1.16 3.34 -1.10 2.29 4.05 -1.26 -0.86 115.26 120.56 1up6 n ASN 191 Ca -0.07 1.04 -0.11 0.00 0.45 0.00 0.00 54.58 55.88 1up6 n ASN 191 Cb 0.58 -1.43 -0.02 0.00 1.23 0.00 0.00 39.78 40.14 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 4.71 -0.30 -2.69 1.20 8.25 -1.26 -4.85 115.22 120.27 1up6 n HIS 192 Ca 0.19 0.00 -0.06 0.00 -0.26 0.00 0.00 57.72 57.58 1up6 n HIS 192 Cb 0.30 -2.39 0.09 0.00 1.12 0.00 0.00 29.99 29.11 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 -1.47 -1.78 -4.45 2.41 -0.00 -0.03 -4.56 117.00 107.12 1up6 n LEU 193 Ca -0.12 -3.13 -0.22 0.00 -0.00 0.00 0.00 56.01 52.54 1up6 n LEU 193 Cb 0.50 0.26 -0.10 0.00 -0.00 0.00 0.00 43.42 44.08 1up6 n LEU 193 CO 0.16 1.76 -0.41 -0.94 -0.00 0.00 0.00 177.39 177.96 1up6 s SER 194 N -0.99 3.15 -0.01 1.96 1.04 -1.19 -1.14 113.70 116.52 1up6 s SER 194 Ca 0.18 -1.12 -0.00 0.00 0.48 0.00 0.00 55.95 55.49 1up6 s SER 194 Cb 0.32 -0.24 0.01 0.00 0.10 0.00 0.00 66.02 66.22 1up6 s SER 194 CO -0.07 -0.19 0.02 -0.36 0.98 0.00 0.00 173.24 173.62 1up6 s PHE 195 N -2.79 -0.00 -0.19 5.02 0.40 0.38 -1.38 117.98 119.41 1up6 s PHE 195 Ca 0.29 0.08 -0.03 0.00 -0.60 0.00 0.00 56.93 56.67 1up6 s PHE 195 Cb 0.01 -0.09 -0.01 0.00 0.51 0.00 0.00 43.02 43.44 1up6 s PHE 195 CO 0.13 -0.04 -0.06 0.42 0.70 0.00 0.00 175.22 176.36 1up6 s ILE 196 N 0.44 3.35 -0.18 0.64 1.01 0.10 -1.30 121.20 125.26 1up6 s ILE 196 Ca -0.04 -0.52 0.11 0.00 0.00 0.00 0.00 60.65 60.21 1up6 s ILE 196 Cb -0.05 -2.49 -0.19 0.00 0.01 0.00 0.00 42.46 39.73 1up6 s ILE 196 CO -0.01 0.46 -0.02 1.21 0.00 0.00 0.00 174.94 176.58 1up6 n GLU 197 N 4.35 1.01 -3.88 2.79 2.13 -0.18 -1.73 120.64 125.14 1up6 n GLU 197 Ca -0.18 0.03 -0.11 0.00 0.66 0.00 0.00 57.16 57.56 1up6 n GLU 197 Cb 0.51 -1.44 -0.12 0.00 0.27 0.00 0.00 31.44 30.66 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 -2.42 0.18 -0.10 5.31 1.02 -1.22 -4.96 119.74 117.54 1up6 s LYS 198 Ca -0.15 -0.11 0.01 0.00 0.02 0.00 0.00 55.97 55.74 1up6 s LYS 198 Cb 0.06 0.07 0.02 0.00 -0.52 0.00 0.00 37.83 37.46 1up6 s LYS 198 CO 0.64 -0.03 -0.13 0.08 -0.92 0.00 0.00 175.35 175.00 1up6 s VAL 199 N -0.45 1.30 -0.02 3.17 1.01 -1.26 -1.41 120.40 122.75 1up6 s VAL 199 Ca -0.05 -0.52 0.07 0.00 0.00 0.00 0.00 61.98 61.47 1up6 s VAL 199 Cb -0.03 -1.21 -0.02 0.00 0.00 0.00 0.00 36.38 35.11 1up6 s VAL 199 CO 0.00 0.40 -0.22 -0.36 0.00 0.00 0.00 175.10 174.92 1up6 s PHE 200 N 1.06 2.45 -0.12 5.22 0.40 0.19 -0.70 117.98 126.47 1up6 s PHE 200 Ca -0.06 -0.34 -0.01 0.00 -0.60 0.00 0.00 56.93 55.92 1up6 s PHE 200 Cb -0.15 -1.52 0.03 0.00 0.51 0.00 0.00 43.02 41.89 1up6 s PHE 200 CO -0.02 0.07 -0.06 0.08 0.70 0.00 0.00 175.22 175.99 1up6 s VAL 201 N -0.69 0.97 -1.39 -0.44 1.01 -0.06 -1.46 120.40 118.34 1up6 s VAL 201 Ca 0.11 -0.32 -0.10 0.00 0.00 0.00 0.00 61.98 61.66 1up6 s VAL 201 Cb -0.10 -1.05 0.07 0.00 0.00 0.00 0.00 36.38 35.31 1up6 s VAL 201 CO 0.00 0.30 0.60 0.29 0.00 0.00 0.00 175.10 176.29 1up6 n LYS 202 N 4.95 -3.91 0.00 2.72 5.02 0.26 -1.75 118.16 125.46 1up6 n LYS 202 Ca -0.12 0.54 0.00 0.00 -2.02 0.00 0.00 58.31 56.71 1up6 n LYS 202 Cb 0.49 -5.30 0.00 0.00 -0.02 0.00 0.00 35.03 30.20 1up6 n LYS 202 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1up6 n GLY 203 N -1.31 2.45 3.72 0.72 0.00 -1.26 -5.02 105.19 104.49 1up6 n GLY 203 Ca -0.01 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.61 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 -0.48 4.45 -0.43 1.61 2.12 -0.72 -5.02 118.70 120.23 1up6 s GLU 204 Ca 0.00 0.95 -0.28 0.00 0.36 0.00 0.00 54.97 55.99 1up6 s GLU 204 Cb 0.00 -3.43 -0.00 0.00 0.26 0.00 0.00 34.13 30.96 1up6 s GLU 204 CO 0.00 0.11 1.57 0.34 -0.54 0.00 0.00 175.26 176.75 1up6 s ASP 205 N 0.61 6.07 -0.13 -1.70 -1.08 -1.26 -0.88 116.67 118.30 1up6 s ASP 205 Ca 0.38 0.85 0.16 0.00 -0.52 0.00 0.00 52.55 53.42 1up6 s ASP 205 Cb -0.18 -2.54 0.34 0.00 -1.46 0.00 0.00 42.92 39.08 1up6 s ASP 205 CO 0.20 -1.65 1.23 1.33 0.52 0.00 0.00 175.17 176.80 1up6 n VAL 206 N 7.17 1.89 -0.12 1.11 0.24 0.12 -4.79 118.33 123.94 1up6 n VAL 206 Ca 0.18 -1.94 -0.05 0.00 -2.04 0.00 0.00 64.34 60.49 1up6 n VAL 206 Cb 0.48 -0.13 0.02 0.00 -1.47 0.00 0.00 33.84 32.74 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 0.73 0.49 -0.51 3.34 2.02 -1.87 -1.66 112.91 115.45 1up6 h THR 207 Ca 0.00 0.00 0.05 0.00 0.77 0.00 0.00 66.41 67.23 1up6 h THR 207 Cb 1.09 0.49 -0.05 0.00 -1.74 0.00 0.00 68.15 67.93 1up6 h THR 207 CO 0.08 0.00 0.23 -0.33 0.37 0.00 0.00 175.52 175.87 1up6 h GLU 208 N -0.07 0.44 -0.76 6.66 4.39 -1.93 -1.22 114.58 122.10 1up6 h GLU 208 Ca 0.20 -0.03 0.06 0.00 0.34 0.00 0.00 59.36 59.93 1up6 h GLU 208 Cb 0.38 -0.10 -0.05 0.00 -0.10 0.00 0.00 28.75 28.88 1up6 h GLU 208 CO -0.46 0.29 0.50 -0.22 -1.16 0.00 0.00 179.01 177.96 1up6 h LYS 209 N 0.45 0.81 -0.26 2.33 1.63 -1.81 -1.13 116.57 118.59 1up6 h LYS 209 Ca 0.23 -0.05 -0.06 0.00 -0.85 0.00 0.00 60.65 59.92 1up6 h LYS 209 Cb 0.18 -0.18 -0.01 0.00 -0.60 0.00 0.00 32.23 31.62 1up6 h LYS 209 CO -0.19 0.53 -0.08 0.28 -3.45 0.00 0.00 179.45 176.54 1up6 h VAL 210 N 0.83 1.29 -0.07 2.00 2.07 -0.32 -2.03 116.25 120.02 1up6 h VAL 210 Ca 0.32 -1.12 0.01 0.00 0.82 0.00 0.00 66.70 66.73 1up6 h VAL 210 Cb 0.21 1.49 -0.01 0.00 -1.52 0.00 0.00 31.29 31.46 1up6 h VAL 210 CO -0.11 0.35 0.00 -0.26 0.02 0.00 0.00 177.57 177.58 1up6 h PHE 211 N 0.25 0.01 -0.83 1.57 0.04 -1.00 -0.45 116.94 116.52 1up6 h PHE 211 Ca 0.06 0.00 0.04 0.00 2.80 0.00 0.00 57.97 60.87 1up6 h PHE 211 Cb 0.57 0.01 -0.05 0.00 2.20 0.00 0.00 35.95 38.68 1up6 h PHE 211 CO 0.05 -0.00 0.55 0.93 -0.60 0.00 0.00 178.31 179.24 1up6 h GLU 212 N 0.03 1.00 -0.11 1.51 4.39 -1.22 -2.26 114.58 117.91 1up6 h GLU 212 Ca 0.03 -0.06 -0.13 0.00 0.34 0.00 0.00 59.36 59.54 1up6 h GLU 212 Cb 0.03 -0.22 -0.01 0.00 -0.10 0.00 0.00 28.75 28.44 1up6 h GLU 212 CO -0.05 0.66 -0.50 -0.97 -1.16 0.00 0.00 179.01 176.99 1up6 h ASN 213 N 1.03 0.33 0.12 1.42 -0.73 -0.84 -3.02 115.58 113.89 1up6 h ASN 213 Ca 0.33 -0.16 0.00 0.00 1.87 0.00 0.00 56.30 58.34 1up6 h ASN 213 Cb 0.04 -0.09 0.00 0.00 0.27 0.00 0.00 38.32 38.54 1up6 h ASN 213 CO -0.10 0.78 0.00 -0.07 -0.37 0.00 0.00 177.43 177.67 1up6 h LEU 214 N 0.24 0.00 0.00 0.34 4.07 -0.47 -3.23 115.31 116.27 1up6 h LEU 214 Ca 0.01 0.00 -0.08 0.00 0.08 0.00 0.00 57.88 57.89 1up6 h LEU 214 Cb 0.97 0.00 -0.01 0.00 1.08 0.00 0.00 40.66 42.70 1up6 h LEU 214 CO 0.08 0.00 -0.64 0.11 -1.08 0.00 0.00 178.44 176.91 1up6 h LYS 215 N 0.00 0.00 -1.16 1.13 1.57 -1.55 -3.24 116.57 113.33 1up6 h LYS 215 Ca 0.00 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 1up6 h LYS 215 Cb 0.06 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.37 1up6 h LYS 215 CO 0.00 0.45 0.00 1.28 -0.57 0.00 0.00 179.45 180.61 1up6 n LEU 216 N -4.58 0.36 -3.98 2.94 4.77 -1.22 -4.08 117.00 111.21 1up6 n LEU 216 Ca -0.15 -0.18 -0.38 0.00 -0.03 0.00 0.00 56.01 55.27 1up6 n LEU 216 Cb 0.39 -0.08 -0.03 0.00 -2.33 0.00 0.00 43.42 41.37 1up6 n LEU 216 CO 0.14 0.07 0.62 1.17 -1.33 0.00 0.00 177.39 178.06 1up6 n LYS 217 N 0.72 3.36 -1.74 3.23 4.81 -1.22 -5.08 118.16 122.23 1up6 n LYS 217 Ca 0.00 -4.54 -0.41 0.00 -0.87 0.00 0.00 58.31 52.49 1up6 n LYS 217 Cb 0.07 -2.44 0.01 0.00 0.02 0.00 0.00 35.03 32.69 1up6 n LYS 217 CO 0.00 0.00 0.00 1.28 1.17 0.00 0.00 177.40 179.85 1up6 n LEU 218 N 1.75 4.63 0.10 3.14 4.32 -1.26 -5.07 117.00 124.61 1up6 n LEU 218 Ca 0.25 1.13 0.00 0.00 -0.02 0.00 0.00 56.01 57.37 1up6 n LEU 218 Cb 0.37 -1.56 0.00 0.00 -1.62 0.00 0.00 43.42 40.60 1up6 n LEU 218 CO 0.51 -0.31 0.00 -0.81 -1.22 0.00 0.00 177.39 175.55 1up6 n PRO 222 N -0.01 0.00 0.00 3.23 -0.04 -1.26 -5.12 135.00 131.80 1up6 n PRO 222 Ca 0.05 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.51 1up6 n PRO 222 Cb 0.40 0.00 0.00 0.00 -0.04 0.00 0.00 33.50 33.86 1up6 n PRO 222 CO 0.00 0.00 0.00 -3.47 -0.04 0.00 0.00 175.50 171.99 1up6 n ASP 223 N -2.91 0.00 -0.88 3.54 2.03 -1.26 -2.04 116.55 115.04 1up6 n ASP 223 Ca 0.00 0.21 0.10 0.00 0.52 0.00 0.00 54.79 55.62 1up6 n ASP 223 Cb 0.00 -0.21 0.13 0.00 -0.72 0.00 0.00 41.12 40.32 1up6 n ASP 223 CO 0.00 0.00 0.00 1.21 -1.92 0.00 0.00 177.20 176.49 1up6 n GLU 224 N -1.20 1.99 -4.30 -0.67 2.13 -1.26 -4.99 120.64 112.35 1up6 n GLU 224 Ca 0.00 -1.87 -0.16 0.00 0.66 0.00 0.00 57.16 55.79 1up6 n GLU 224 Cb 0.01 -1.40 -0.10 0.00 0.27 0.00 0.00 31.44 30.21 1up6 n GLU 224 CO 0.00 0.00 0.00 0.34 -0.41 0.00 0.00 177.13 177.06 1up6 s ASP 225 N -1.52 1.51 0.25 4.31 2.15 -0.87 -5.05 116.67 117.45 1up6 s ASP 225 Ca 0.27 -1.24 -0.31 0.00 0.43 0.00 0.00 52.55 51.70 1up6 s ASP 225 Cb 0.18 0.07 -0.12 0.00 -0.30 0.00 0.00 42.92 42.75 1up6 s ASP 225 CO 0.26 -0.58 1.60 0.49 -0.17 0.00 0.00 175.17 176.77 1up6 n PHE 226 N -0.38 2.66 -1.17 -5.34 3.72 -1.26 -4.95 117.46 110.75 1up6 n PHE 226 Ca -0.04 0.23 -0.30 0.00 -0.05 0.00 0.00 57.45 57.28 1up6 n PHE 226 Cb 0.64 -2.59 0.23 0.00 -0.94 0.00 0.00 39.48 36.82 1up6 n PHE 226 CO 0.00 0.00 0.00 -1.25 -0.05 0.00 0.00 176.76 175.46 1up6 s PRO 227 N 0.10 -0.94 0.12 -1.08 0.04 -1.26 -4.96 135.00 127.02 1up6 s PRO 227 Ca 0.69 -0.06 -0.12 0.00 0.04 0.00 0.00 61.00 61.55 1up6 s PRO 227 Cb -0.54 -1.63 -0.10 0.00 0.04 0.00 0.00 34.50 32.27 1up6 s PRO 227 CO 0.43 -3.52 1.39 1.15 0.04 0.00 0.00 177.00 176.48 1up6 h THR 228 N -2.45 1.28 0.00 1.26 2.02 -1.98 -2.90 112.91 110.14 1up6 h THR 228 Ca -0.46 -1.74 -0.01 0.00 0.77 0.00 0.00 66.41 64.98 1up6 h THR 228 Cb 1.29 1.69 -0.00 0.00 -1.74 0.00 0.00 68.15 69.39 1up6 h THR 228 CO 0.36 0.56 -0.04 4.11 0.37 0.00 0.00 175.52 180.89 1up6 h TRP 229 N 0.62 0.00 -0.21 3.16 5.08 -1.99 -2.93 115.95 119.68 1up6 h TRP 229 Ca 0.01 0.00 0.01 0.00 1.08 0.00 0.00 58.89 59.98 1up6 h TRP 229 Cb 1.16 0.00 -0.01 0.00 -3.00 0.00 0.00 29.16 27.31 1up6 h TRP 229 CO 0.08 0.04 0.12 0.35 -1.28 0.00 0.00 178.44 177.75 1up6 h PHE 230 N 0.00 0.23 -0.08 0.12 3.57 -1.88 -0.16 116.94 118.74 1up6 h PHE 230 Ca -0.00 0.01 -0.13 0.00 3.53 0.00 0.00 57.97 61.38 1up6 h PHE 230 Cb 0.08 -0.07 -0.01 0.00 2.79 0.00 0.00 35.95 38.74 1up6 h PHE 230 CO 0.00 0.14 -0.53 1.88 -2.23 0.00 0.00 178.31 177.57 1up6 h TYR 231 N 0.26 0.28 0.00 0.41 0.05 -1.63 0.52 116.97 116.86 1up6 h TYR 231 Ca 0.08 -0.09 -0.07 0.00 0.05 0.00 0.00 58.73 58.70 1up6 h TYR 231 Cb -0.01 -0.05 -0.01 0.00 1.01 0.00 0.00 36.73 37.67 1up6 h TYR 231 CO -0.08 0.71 -0.34 -0.44 -1.05 0.00 0.00 178.16 176.96 1up6 h ASP 232 N 0.18 0.00 0.01 3.88 3.32 -1.39 -1.25 116.42 121.17 1up6 h ASP 232 Ca 0.00 0.00 -0.16 0.00 0.02 0.00 0.00 57.03 56.89 1up6 h ASP 232 Cb 0.99 0.00 -0.02 0.00 0.22 0.00 0.00 39.33 40.52 1up6 h ASP 232 CO 0.08 0.34 -0.88 0.28 -1.72 0.00 0.00 179.24 177.34 1up6 h SER 233 N 0.00 0.04 0.48 6.45 0.02 -0.39 -3.40 113.55 116.75 1up6 h SER 233 Ca -0.00 -0.70 -0.30 0.00 -0.84 0.00 0.00 61.79 59.94 1up6 h SER 233 Cb 0.66 -0.01 -0.02 0.00 0.14 0.00 0.00 62.40 63.17 1up6 h SER 233 CO 0.04 1.35 -1.55 0.58 -1.14 0.00 0.00 176.83 176.12 1up6 h VAL 234 N -0.92 1.12 -5.32 2.27 2.07 -1.02 -3.48 116.25 110.97 1up6 h VAL 234 Ca -0.23 -2.80 -0.41 0.00 0.82 0.00 0.00 66.70 64.07 1up6 h VAL 234 Cb 1.26 2.70 0.02 0.00 -1.52 0.00 0.00 31.29 33.75 1up6 h VAL 234 CO -0.11 0.79 -0.64 0.54 0.02 0.00 0.00 177.57 178.16 1up6 n ARG 235 N -3.39 -5.27 -4.27 1.57 1.74 -0.47 -5.01 116.66 101.57 1up6 n ARG 235 Ca -0.16 0.74 -0.17 0.00 -0.77 0.00 0.00 57.85 57.48 1up6 n ARG 235 Cb 1.04 -5.61 -0.14 0.00 -1.02 0.00 0.00 32.46 26.72 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 -6.89 2.02 -0.20 0.55 1.43 -1.26 -4.87 118.68 109.46 1up6 s LEU 236 Ca 0.45 -0.14 -0.29 0.00 -1.03 0.00 0.00 54.13 53.12 1up6 s LEU 236 Cb -0.22 -0.37 0.00 0.00 0.03 0.00 0.00 46.19 45.64 1up6 s LEU 236 CO 0.56 0.08 1.05 -0.63 0.23 0.00 0.00 176.35 177.65 1up6 s ILE 237 N -0.20 4.66 -0.02 -0.59 1.01 -0.70 -4.86 121.20 120.49 1up6 s ILE 237 Ca 0.03 1.99 -0.01 0.00 0.00 0.00 0.00 60.65 62.66 1up6 s ILE 237 Cb -0.03 -4.28 -0.04 0.00 0.01 0.00 0.00 42.46 38.12 1up6 s ILE 237 CO -0.00 -0.14 0.06 0.54 0.00 0.00 0.00 174.94 175.40 1up6 s VAL 238 N 3.00 4.63 0.39 2.92 0.11 -1.26 -0.72 120.40 129.47 1up6 s VAL 238 Ca 0.46 -0.38 -0.28 0.00 -2.93 0.00 0.00 61.98 58.85 1up6 s VAL 238 Cb -0.16 -3.08 -0.11 0.00 -1.53 0.00 0.00 36.38 31.50 1up6 s VAL 238 CO 0.09 0.41 1.47 -3.20 -3.33 0.00 0.00 175.10 170.53 1up6 n ASN 239 N 1.40 3.65 0.29 3.54 2.85 -0.48 -4.88 115.26 121.63 1up6 n ASN 239 Ca -0.14 1.21 0.17 0.00 -0.11 0.00 0.00 54.58 55.70 1up6 n ASN 239 Cb 0.53 -1.61 0.91 0.00 1.24 0.00 0.00 39.78 40.85 1up6 n ASN 239 CO 0.00 0.00 0.00 1.55 -2.11 0.00 0.00 177.26 176.70 1up6 h PRO 240 N 2.82 0.00 0.00 1.20 0.13 -1.94 -1.10 132.00 133.10 1up6 h PRO 240 Ca -0.50 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.63 1up6 h PRO 240 Cb 1.25 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.38 1up6 h PRO 240 CO 0.63 0.04 0.00 1.88 -0.23 0.00 0.00 178.00 180.33 1up6 h TYR 241 N 0.00 0.00 0.00 1.56 -1.99 -1.90 -2.25 116.97 112.39 1up6 h TYR 241 Ca -0.00 0.00 -0.00 0.00 2.00 0.00 0.00 58.73 60.72 1up6 h TYR 241 Cb 0.16 0.00 -0.00 0.00 2.00 0.00 0.00 36.73 38.89 1up6 h TYR 241 CO 0.00 0.00 -0.02 -0.07 -0.00 0.00 0.00 178.16 178.07 1up6 h LEU 242 N 0.00 0.00 -1.35 3.88 -0.00 -1.44 -2.48 115.31 113.93 1up6 h LEU 242 Ca 0.00 0.00 0.21 0.00 -0.00 0.00 0.00 57.88 58.09 1up6 h LEU 242 Cb 0.24 0.00 -0.08 0.00 -0.00 0.00 0.00 40.66 40.82 1up6 h LEU 242 CO 0.00 0.02 0.62 0.03 -0.00 0.00 0.00 178.44 179.11 1up6 h ARG 243 N 0.00 0.50 0.00 1.13 3.08 -1.60 -0.16 114.38 117.33 1up6 h ARG 243 Ca -0.00 -0.03 -0.06 0.00 0.07 0.00 0.00 59.98 59.96 1up6 h ARG 243 Cb 0.16 -0.11 -0.01 0.00 0.08 0.00 0.00 29.97 30.09 1up6 h ARG 243 CO 0.00 0.33 -0.29 1.88 -1.07 0.00 0.00 179.97 180.82 1up6 h TYR 244 N 0.51 0.00 0.00 3.04 0.05 -1.69 -3.19 116.97 115.69 1up6 h TYR 244 Ca 0.52 0.00 -0.01 0.00 0.05 0.00 0.00 58.73 59.29 1up6 h TYR 244 Cb 1.14 0.00 -0.00 0.00 1.01 0.00 0.00 36.73 38.88 1up6 h TYR 244 CO -0.00 0.29 -0.09 1.88 -1.05 0.00 0.00 178.16 179.19 1up6 h TYR 245 N 0.00 0.00 -0.31 4.88 -1.99 -1.28 -3.29 116.97 114.99 1up6 h TYR 245 Ca -0.00 0.00 -0.17 0.00 2.00 0.00 0.00 58.73 60.56 1up6 h TYR 245 Cb 0.59 0.00 -0.09 0.00 2.00 0.00 0.00 36.73 39.22 1up6 h TYR 245 CO 0.00 0.24 0.22 1.28 -0.00 0.00 0.00 178.16 179.90 1up6 n LEU 246 N -4.72 4.58 0.00 3.88 7.99 -0.24 -4.94 117.00 123.54 1up6 n LEU 246 Ca -0.04 -2.34 0.00 0.00 -0.01 0.00 0.00 56.01 53.63 1up6 n LEU 246 Cb 0.14 -0.71 0.00 0.00 -0.11 0.00 0.00 43.42 42.74 1up6 n LEU 246 CO 0.08 0.77 0.00 1.21 -1.51 0.00 0.00 177.39 177.95 1up6 n GLU 248 N 0.15 0.00 -0.20 3.23 2.13 -1.24 -5.05 120.64 119.66 1up6 n GLU 248 Ca 0.19 0.00 -0.07 0.00 0.66 0.00 0.00 57.16 57.94 1up6 n GLU 248 Cb 0.80 0.00 0.03 0.00 0.27 0.00 0.00 31.44 32.54 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 0.79 -1.16 5.31 1.57 -1.92 0.44 116.57 121.61 1up6 h LYS 249 Ca 0.00 -0.08 0.00 0.00 -1.87 0.00 0.00 60.65 58.70 1up6 h LYS 249 Cb 0.00 -0.16 0.00 0.00 0.08 0.00 0.00 32.23 32.15 1up6 h LYS 249 CO 0.00 0.58 0.00 1.63 -0.57 0.00 0.00 179.45 181.09 1up6 n LYS 250 N -4.62 0.39 0.00 3.15 5.02 -1.26 -2.53 118.16 118.32 1up6 n LYS 250 Ca 0.04 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.33 1up6 n LYS 250 Cb 0.07 -1.26 0.00 0.00 -0.02 0.00 0.00 35.03 33.81 1up6 n LYS 250 CO 0.00 0.00 0.00 0.34 -0.52 0.00 0.00 177.40 177.22 1up6 n PHE 252 N 0.62 0.00 -0.06 2.13 7.35 0.14 -1.87 117.46 125.77 1up6 n PHE 252 Ca 0.00 0.00 -0.10 0.00 -0.76 0.00 0.00 57.45 56.59 1up6 n PHE 252 Cb 0.16 0.00 0.05 0.00 0.35 0.00 0.00 39.48 40.04 1up6 n PHE 252 CO 0.00 0.00 0.00 -0.22 -0.76 0.00 0.00 176.76 175.78 1up6 h LYS 253 N 0.00 0.73 -0.08 -4.13 3.64 -1.74 -1.47 116.57 113.52 1up6 h LYS 253 Ca 0.00 -0.38 0.00 0.00 -1.27 0.00 0.00 60.65 59.00 1up6 h LYS 253 Cb 0.00 0.01 -0.00 0.00 -0.41 0.00 0.00 32.23 31.83 1up6 h LYS 253 CO 0.00 0.99 0.05 -0.22 -2.27 0.00 0.00 179.45 178.01 1up6 h LYS 254 N 0.60 0.10 -0.72 1.90 3.64 -1.66 -2.35 116.57 118.08 1up6 h LYS 254 Ca 0.05 -0.01 -0.04 0.00 -1.27 0.00 0.00 60.65 59.39 1up6 h LYS 254 Cb 0.94 -0.02 -0.03 0.00 -0.41 0.00 0.00 32.23 32.70 1up6 h LYS 254 CO 0.09 0.08 0.31 0.82 -2.27 0.00 0.00 179.45 178.48 1up6 h ILE 255 N 0.10 1.24 0.00 2.00 2.04 -1.81 -3.06 117.51 118.02 1up6 h ILE 255 Ca 0.03 -0.73 0.00 0.00 1.00 0.00 0.00 64.86 65.16 1up6 h ILE 255 Cb -0.00 0.38 0.00 0.00 -0.74 0.00 0.00 36.82 36.46 1up6 h ILE 255 CO -0.01 0.30 0.00 0.77 0.00 0.00 0.00 178.15 179.21 1up6 h SER 256 N 1.02 0.00 -0.41 1.72 4.64 -1.24 -3.22 113.55 116.06 1up6 h SER 256 Ca 0.24 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.56 1up6 h SER 256 Cb 0.17 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.26 1up6 h SER 256 CO -0.02 0.00 0.00 0.35 -0.87 0.00 0.00 176.83 176.29 1up6 n THR 257 N -2.80 1.76 -4.24 2.95 -2.24 -0.89 -4.96 114.28 103.86 1up6 n THR 257 Ca 0.03 -1.39 -0.13 0.00 -2.27 0.00 0.00 64.05 60.29 1up6 n THR 257 Cb 0.43 0.10 -0.10 0.00 -2.10 0.00 0.00 70.33 68.66 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 -1.96 1.22 0.43 4.78 3.76 -1.20 -5.06 115.29 117.26 1up6 s HIS 258 Ca 0.39 -1.10 -0.24 0.00 -0.15 0.00 0.00 55.06 53.96 1up6 s HIS 258 Cb 0.27 -0.69 -0.10 0.00 1.11 0.00 0.00 32.58 33.17 1up6 s HIS 258 CO 0.16 -0.30 1.11 -1.91 -0.85 0.00 0.00 174.74 172.95 1up6 n GLU 259 N -0.26 1.53 -1.83 1.40 2.13 -1.26 -4.91 120.64 117.44 1up6 n GLU 259 Ca -0.05 0.55 -0.41 0.00 0.66 0.00 0.00 57.16 57.91 1up6 n GLU 259 Cb 0.64 -2.18 -0.00 0.00 0.27 0.00 0.00 31.44 30.17 1up6 n GLU 259 CO 0.00 0.00 0.00 -0.51 -0.41 0.00 0.00 177.13 176.21 1up6 s LEU 260 N -1.06 4.33 0.21 4.31 1.43 -1.26 -4.90 118.68 121.74 1up6 s LEU 260 Ca 0.63 3.02 -0.09 0.00 -1.03 0.00 0.00 54.13 56.66 1up6 s LEU 260 Cb -0.53 -3.67 0.15 0.00 0.03 0.00 0.00 46.19 42.18 1up6 s LEU 260 CO 0.57 -0.84 1.80 -0.09 0.23 0.00 0.00 176.35 178.01 1up6 h ARG 261 N 3.07 1.13 -0.85 1.70 9.65 -1.94 -2.28 114.38 124.86 1up6 h ARG 261 Ca -0.51 -0.17 0.10 0.00 -1.10 0.00 0.00 59.98 58.31 1up6 h ARG 261 Cb 1.24 -0.20 -0.06 0.00 -1.39 0.00 0.00 29.97 29.55 1up6 h ARG 261 CO 0.64 0.88 0.55 0.00 2.80 0.00 0.00 179.97 184.85 1up6 h ALA 262 N 1.19 1.72 -0.12 2.80 0.00 -1.90 -1.52 119.26 121.44 1up6 h ALA 262 Ca 0.27 -0.00 -0.11 0.00 0.00 0.00 0.00 54.91 55.06 1up6 h ALA 262 Cb 0.13 -0.17 -0.01 0.00 0.00 0.00 0.00 17.79 17.73 1up6 h ALA 262 CO -0.03 0.09 -0.43 0.00 0.00 0.00 0.00 179.25 178.88 1up6 h ARG 263 N 0.78 0.27 0.00 0.00 3.08 -1.76 -2.78 114.38 113.98 1up6 h ARG 263 Ca 0.40 -0.14 0.00 0.00 0.07 0.00 0.00 59.98 60.31 1up6 h ARG 263 Cb 0.48 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.53 1up6 h ARG 263 CO -0.17 0.66 -0.43 1.05 -1.07 0.00 0.00 179.97 180.02 1up6 h GLU 264 N 0.23 0.00 -2.06 0.04 4.11 -1.25 -3.19 114.58 112.45 1up6 h GLU 264 Ca 0.02 0.00 -0.04 0.00 0.07 0.00 0.00 59.36 59.41 1up6 h GLU 264 Cb 0.86 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 30.10 1up6 h GLU 264 CO 0.07 0.00 -0.05 0.28 0.07 0.00 0.00 179.01 179.37 1up6 n VAL 265 N -2.81 1.79 0.00 -1.06 0.31 -0.64 -2.23 118.33 113.68 1up6 n VAL 265 Ca 0.03 -0.61 0.00 0.00 -0.01 0.00 0.00 64.34 63.75 1up6 n VAL 265 Cb 0.52 -1.53 0.00 0.00 -0.91 0.00 0.00 33.84 31.92 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 1.88 0.00 -0.08 5.55 5.02 -1.21 -0.84 118.16 128.48 1up6 n LYS 267 Ca 0.09 0.00 -0.09 0.00 -2.02 0.00 0.00 58.31 56.29 1up6 n LYS 267 Cb 0.48 0.00 -0.02 0.00 -0.02 0.00 0.00 35.03 35.47 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 1.09 -0.58 -0.18 2.04 -1.78 -2.80 117.51 115.30 1up6 h ILE 268 Ca 0.00 -0.20 -0.03 0.00 1.00 0.00 0.00 64.86 65.63 1up6 h ILE 268 Cb 0.00 0.71 -0.03 0.00 -0.74 0.00 0.00 36.82 36.77 1up6 h ILE 268 CO 0.00 0.09 0.25 -0.33 0.00 0.00 0.00 178.15 178.16 1up6 h GLU 269 N 0.37 0.86 0.00 2.37 5.08 -1.29 -1.80 114.58 120.17 1up6 h GLU 269 Ca 0.10 -0.15 -0.03 0.00 -1.00 0.00 0.00 59.36 58.29 1up6 h GLU 269 Cb -0.01 -0.14 -0.00 0.00 0.50 0.00 0.00 28.75 29.09 1up6 h GLU 269 CO -0.02 0.72 -0.14 -0.22 -1.00 0.00 0.00 179.01 178.36 1up6 h LYS 270 N 0.80 0.00 0.11 2.33 3.64 -1.79 -1.30 116.57 120.36 1up6 h LYS 270 Ca 0.20 0.00 -0.28 0.00 -1.27 0.00 0.00 60.65 59.29 1up6 h LYS 270 Cb 0.17 0.00 -0.00 0.00 -0.41 0.00 0.00 32.23 31.99 1up6 h LYS 270 CO -0.02 0.14 -1.37 0.93 -2.27 0.00 0.00 179.45 176.86 1up6 h GLU 271 N 0.00 0.23 -0.45 1.90 5.08 -1.15 -3.16 114.58 117.04 1up6 h GLU 271 Ca -0.00 -0.40 -0.14 0.00 -1.00 0.00 0.00 59.36 57.82 1up6 h GLU 271 Cb 0.36 0.15 -0.01 0.00 0.50 0.00 0.00 28.75 29.75 1up6 h GLU 271 CO 0.02 1.13 -0.28 -0.07 -1.00 0.00 0.00 179.01 178.81 1up6 h LEU 272 N 0.06 1.01 -1.14 1.33 3.38 -0.81 -2.86 115.31 116.27 1up6 h LEU 272 Ca -0.18 -0.41 -0.07 0.00 0.09 0.00 0.00 57.88 57.31 1up6 h LEU 272 Cb 1.98 -0.28 -0.02 0.00 0.09 0.00 0.00 40.66 42.43 1up6 h LEU 272 CO 0.18 1.21 -0.11 -0.26 0.09 0.00 0.00 178.44 179.54 1up6 h PHE 273 N 0.82 0.50 -0.56 1.13 0.04 -1.34 0.98 116.94 118.51 1up6 h PHE 273 Ca 0.09 -0.07 -0.11 0.00 2.80 0.00 0.00 57.97 60.68 1up6 h PHE 273 Cb 0.86 -0.14 -0.02 0.00 2.20 0.00 0.00 35.95 38.85 1up6 h PHE 273 CO 0.06 0.57 -0.07 0.93 -0.60 0.00 0.00 178.31 179.20 1up6 h GLU 274 N 0.44 1.03 -0.58 1.51 4.39 -1.53 -2.87 114.58 116.98 1up6 h GLU 274 Ca 0.08 -0.36 -0.09 0.00 0.34 0.00 0.00 59.36 59.34 1up6 h GLU 274 Cb 0.46 -0.08 -0.02 0.00 -0.10 0.00 0.00 28.75 29.01 1up6 h GLU 274 CO 0.03 1.05 0.02 0.87 -1.16 0.00 0.00 179.01 179.81 1up6 h LYS 275 N 0.93 0.99 -0.01 2.33 1.57 -1.16 -2.98 116.57 118.23 1up6 h LYS 275 Ca 0.15 -0.29 0.00 0.00 -1.87 0.00 0.00 60.65 58.65 1up6 h LYS 275 Cb 0.63 -0.10 -0.00 0.00 0.08 0.00 0.00 32.23 32.83 1up6 h LYS 275 CO 0.04 0.96 0.05 1.88 -0.57 0.00 0.00 179.45 181.81 1up6 h TYR 276 N 0.91 0.00 -0.90 -1.35 0.05 -0.61 -1.72 116.97 113.36 1up6 h TYR 276 Ca 0.17 0.00 0.02 0.00 0.05 0.00 0.00 58.73 58.97 1up6 h TYR 276 Cb 0.51 0.00 -0.05 0.00 1.01 0.00 0.00 36.73 38.20 1up6 h TYR 276 CO 0.03 0.00 0.59 0.00 -1.05 0.00 0.00 178.16 177.74 1up6 h ARG 277 N 0.00 1.14 0.00 4.88 3.08 -1.42 -3.35 114.38 118.71 1up6 h ARG 277 Ca 0.01 -0.07 0.00 0.00 0.07 0.00 0.00 59.98 59.99 1up6 h ARG 277 Cb 0.11 -0.26 0.00 0.00 0.08 0.00 0.00 29.97 29.90 1up6 h ARG 277 CO -0.00 0.75 -0.03 0.25 -1.07 0.00 0.00 179.97 179.88 1up6 n THR 278 N -4.42 0.00 -1.78 2.04 -2.24 -1.13 -4.98 114.28 101.77 1up6 n THR 278 Ca 0.11 -0.39 -0.40 0.00 -2.27 0.00 0.00 64.05 61.10 1up6 n THR 278 Cb 0.06 0.98 0.01 0.00 -2.10 0.00 0.00 70.33 69.29 1up6 n THR 278 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1up6 s ALA 279 N -0.83 3.37 -0.20 6.98 0.00 -0.66 -4.92 121.76 125.50 1up6 s ALA 279 Ca 0.00 1.52 0.17 0.00 0.00 0.00 0.00 51.96 53.65 1up6 s ALA 279 Cb 0.00 -3.60 -0.24 0.00 0.00 0.00 0.00 23.12 19.27 1up6 s ALA 279 CO 0.00 -1.16 0.45 1.33 0.00 0.00 0.00 175.76 176.38 1up6 n VAL 280 N 0.04 0.00 -4.19 0.00 0.24 -1.26 -4.96 118.33 108.20 1up6 n VAL 280 Ca 0.04 -0.32 -0.11 0.00 -2.04 0.00 0.00 64.34 61.90 1up6 n VAL 280 Cb 0.41 0.32 -0.10 0.00 -1.47 0.00 0.00 33.84 33.00 1up6 n VAL 280 CO 0.00 0.00 0.00 -1.61 -2.14 0.00 0.00 176.83 173.08 1up6 s GLU 281 N -3.03 0.89 0.10 7.34 0.41 -1.26 -4.77 118.70 118.37 1up6 s GLU 281 Ca -0.03 -1.36 -0.34 0.00 -0.41 0.00 0.00 54.97 52.83 1up6 s GLU 281 Cb 0.11 -0.30 -0.13 0.00 -1.78 0.00 0.00 34.13 32.03 1up6 s GLU 281 CO 0.70 0.00 1.68 -0.89 -0.49 0.00 0.00 175.26 176.27 1up6 n ILE 282 N -0.07 0.17 -2.56 -1.63 2.08 -1.26 -4.94 119.36 111.15 1up6 n ILE 282 Ca -0.12 -0.03 -0.40 0.00 0.56 0.00 0.00 62.75 62.77 1up6 n ILE 282 Cb 0.61 -1.70 -0.05 0.00 -0.75 0.00 0.00 39.64 37.75 1up6 n ILE 282 CO 0.00 0.00 0.00 -2.84 0.56 0.00 0.00 176.55 174.27 1up6 s PRO 283 N 1.81 4.63 0.22 0.38 0.02 -1.26 -4.95 135.00 135.85 1up6 s PRO 283 Ca 0.82 1.68 -0.07 0.00 0.02 0.00 0.00 61.00 63.44 1up6 s PRO 283 Cb -0.65 -3.12 0.33 0.00 0.02 0.00 0.00 34.50 31.08 1up6 s PRO 283 CO 0.40 0.24 1.75 1.49 -0.33 0.00 0.00 177.00 180.56 1up6 h GLU 284 N 3.71 0.48 -1.42 5.54 4.57 -2.01 -1.36 114.58 124.09 1up6 h GLU 284 Ca -0.46 -0.03 0.42 0.00 -1.18 0.00 0.00 59.36 58.11 1up6 h GLU 284 Cb 1.21 -0.11 -0.08 0.00 -0.16 0.00 0.00 28.75 29.61 1up6 h GLU 284 CO 0.66 0.32 0.99 1.49 -1.18 0.00 0.00 179.01 181.29 1up6 h GLU 285 N 0.49 0.07 0.21 1.92 4.81 -1.94 0.49 114.58 120.62 1up6 h GLU 285 Ca 0.34 -0.00 -0.31 0.00 -0.13 0.00 0.00 59.36 59.26 1up6 h GLU 285 Cb 0.42 -0.01 0.03 0.00 0.63 0.00 0.00 28.75 29.82 1up6 h GLU 285 CO -0.31 0.04 -1.32 1.25 -0.73 0.00 0.00 179.01 177.94 1up6 h LEU 286 N 0.07 0.80 0.13 1.64 5.85 -1.64 -3.40 115.31 118.77 1up6 h LEU 286 Ca 0.73 -0.90 0.00 0.00 0.84 0.00 0.00 57.88 58.55 1up6 h LEU 286 Cb 2.67 -0.26 -0.01 0.00 0.37 0.00 0.00 40.66 43.43 1up6 h LEU 286 CO -0.13 1.64 -0.12 0.74 -0.34 0.00 0.00 178.44 180.23 1up6 h THR 287 N 0.10 0.73 -1.96 1.05 2.02 0.06 -3.21 112.91 111.70 1up6 h THR 287 Ca -0.22 0.00 -0.78 0.00 0.77 0.00 0.00 66.41 66.18 1up6 h THR 287 Cb 2.03 0.73 -0.21 0.00 -1.74 0.00 0.00 68.15 68.97 1up6 h THR 287 CO 0.25 0.00 1.55 0.29 0.37 0.00 0.00 175.52 177.98 1up6 n LYS 288 N -5.24 4.37 -3.90 6.66 5.02 -1.00 -4.74 118.16 119.33 1up6 n LYS 288 Ca -0.08 -4.02 -0.08 0.00 -2.02 0.00 0.00 58.31 52.11 1up6 n LYS 288 Cb 0.16 -2.67 -0.03 0.00 -0.02 0.00 0.00 35.03 32.48 1up6 n LYS 288 CO 0.00 0.00 0.00 0.50 -0.52 0.00 0.00 177.40 177.38 1up6 s ARG 289 N -1.67 1.74 0.13 1.97 3.52 -1.21 -5.00 118.95 118.42 1up6 s ARG 289 Ca 0.39 -1.11 0.00 0.00 -0.13 0.00 0.00 55.73 54.89 1up6 s ARG 289 Cb 0.11 0.57 0.00 0.00 -1.56 0.00 0.00 34.95 34.07 1up6 s ARG 289 CO -0.00 -0.78 0.00 0.41 -0.81 0.00 0.00 175.30 174.12 1up6 n GLY 290 N -0.44 0.48 2.73 8.12 0.00 -1.26 -1.81 105.19 113.00 1up6 n GLY 290 Ca -0.03 0.05 -0.01 0.00 0.00 0.00 0.00 46.02 46.02 1up6 n GLY 290 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1up6 n GLY 291 N 0.00 1.94 1.81 -0.02 0.00 -1.26 -5.13 105.19 102.53 1up6 n GLY 291 Ca 0.00 -0.50 0.00 0.00 0.00 0.00 0.00 46.02 45.52 1up6 n GLY 291 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 1up6 n SER 292 N -1.18 0.00 0.00 1.61 2.88 -0.75 -4.68 113.62 111.50 1up6 n SER 292 Ca -0.08 -0.57 0.00 0.00 -1.33 0.00 0.00 58.87 56.89 1up6 n SER 292 Cb 0.85 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 64.31 1up6 n SER 292 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 1up6 n TYR 294 N 1.54 0.00 -0.04 0.66 4.11 -1.26 -4.75 117.16 117.41 1up6 n TYR 294 Ca 0.00 0.00 -0.08 0.00 -0.00 0.00 0.00 57.90 57.82 1up6 n TYR 294 Cb 0.00 0.00 -0.02 0.00 -0.00 0.00 0.00 39.34 39.32 1up6 n TYR 294 CO 0.00 0.00 0.00 0.66 -0.00 0.00 0.00 176.86 177.52 1up6 h SER 295 N 0.00 -0.36 -0.67 9.48 4.64 -1.89 -0.52 113.55 124.24 1up6 h SER 295 Ca 0.00 0.09 -0.03 0.00 -0.47 0.00 0.00 61.79 61.38 1up6 h SER 295 Cb 0.00 0.20 -0.03 0.00 -0.31 0.00 0.00 62.40 62.26 1up6 h SER 295 CO 0.00 -0.14 0.30 0.74 -0.87 0.00 0.00 176.83 176.86 1up6 h THR 296 N -0.08 1.23 -0.32 2.95 2.02 -1.86 -1.94 112.91 114.91 1up6 h THR 296 Ca 0.12 -0.68 0.04 0.00 0.77 0.00 0.00 66.41 66.65 1up6 h THR 296 Cb 0.26 0.38 -0.03 0.00 -1.74 0.00 0.00 68.15 67.01 1up6 h THR 296 CO -0.27 0.28 0.11 0.00 0.37 0.00 0.00 175.52 176.00 1up6 h ALA 297 N 1.34 0.36 -0.42 6.16 0.00 -1.53 -1.87 119.26 123.30 1up6 h ALA 297 Ca 0.24 0.04 -0.01 0.00 0.00 0.00 0.00 54.91 55.18 1up6 h ALA 297 Cb 0.15 0.02 -0.02 0.00 0.00 0.00 0.00 17.79 17.94 1up6 h ALA 297 CO -0.03 -0.29 0.23 0.00 0.00 0.00 0.00 179.25 179.16 1up6 h ALA 298 N 1.20 0.54 -0.29 0.00 0.00 -0.84 -2.35 119.26 117.52 1up6 h ALA 298 Ca 0.14 -0.08 -0.13 0.00 0.00 0.00 0.00 54.91 54.84 1up6 h ALA 298 Cb 0.12 -0.17 -0.00 0.00 0.00 0.00 0.00 17.79 17.73 1up6 h ALA 298 CO -0.15 0.06 -0.32 0.00 0.00 0.00 0.00 179.25 178.84 1up6 h ALA 299 N 1.09 0.43 -0.39 0.00 0.00 -1.28 -1.32 119.26 117.79 1up6 h ALA 299 Ca 0.15 -0.42 -0.13 0.00 0.00 0.00 0.00 54.91 54.51 1up6 h ALA 299 Cb 0.05 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 17.73 1up6 h ALA 299 CO -0.02 0.48 -0.28 0.45 0.00 0.00 0.00 179.25 179.87 1up6 h HIS 300 N 0.49 0.97 -0.08 0.00 3.86 -1.40 -1.21 115.15 117.79 1up6 h HIS 300 Ca 0.04 -0.25 0.02 0.00 -1.16 0.00 0.00 60.37 59.02 1up6 h HIS 300 Cb 0.90 -0.22 -0.02 0.00 1.06 0.00 0.00 27.41 29.13 1up6 h HIS 300 CO 0.07 1.02 -0.03 1.25 0.86 0.00 0.00 177.93 181.10 1up6 h LEU 301 N 0.71 -0.10 -0.80 2.43 5.85 -1.26 -1.29 115.31 120.85 1up6 h LEU 301 Ca 0.08 0.03 -0.05 0.00 0.84 0.00 0.00 57.88 58.78 1up6 h LEU 301 Cb 0.83 0.06 -0.03 0.00 0.37 0.00 0.00 40.66 41.89 1up6 h LEU 301 CO 0.07 -0.04 0.26 0.40 -0.34 0.00 0.00 178.44 178.79 1up6 h ILE 302 N -0.02 1.26 -0.27 4.05 2.04 -1.14 0.62 117.51 124.06 1up6 h ILE 302 Ca 0.04 -0.87 0.03 0.00 1.00 0.00 0.00 64.86 65.06 1up6 h ILE 302 Cb 0.08 0.40 -0.03 0.00 -0.74 0.00 0.00 36.82 36.53 1up6 h ILE 302 CO -0.09 0.35 0.09 -0.09 0.00 0.00 0.00 178.15 178.41 1up6 h ARG 303 N 1.11 0.21 0.00 2.37 1.12 -1.01 -1.13 114.38 117.06 1up6 h ARG 303 Ca 0.25 -0.01 0.00 0.00 -1.11 0.00 0.00 59.98 59.10 1up6 h ARG 303 Cb 0.27 -0.05 0.00 0.00 -0.01 0.00 0.00 29.97 30.19 1up6 h ARG 303 CO -0.01 0.14 -0.33 -0.44 -3.11 0.00 0.00 179.97 176.22 1up6 h ASP 304 N 0.22 0.00 0.37 -3.80 3.32 -0.71 -2.09 116.42 113.73 1up6 h ASP 304 Ca 0.12 -0.05 -0.14 0.00 0.02 0.00 0.00 57.03 56.98 1up6 h ASP 304 Cb 0.08 0.00 -0.01 0.00 0.22 0.00 0.00 39.33 39.62 1up6 h ASP 304 CO -0.12 0.03 -0.57 -0.07 -1.72 0.00 0.00 179.24 176.79 1up6 h LEU 305 N 0.00 0.24 0.16 1.55 4.07 -0.58 -3.30 115.31 117.46 1up6 h LEU 305 Ca 0.00 -0.13 -0.31 0.00 0.08 0.00 0.00 57.88 57.52 1up6 h LEU 305 Cb 0.86 -0.07 0.03 0.00 1.08 0.00 0.00 40.66 42.56 1up6 h LEU 305 CO 0.00 0.75 -1.33 -0.33 -1.08 0.00 0.00 178.44 176.45 1up6 h GLU 306 N 0.16 0.52 -7.15 1.13 4.39 -0.60 0.39 114.58 113.42 1up6 h GLU 306 Ca -0.00 -0.79 -0.46 0.00 0.34 0.00 0.00 59.36 58.45 1up6 h GLU 306 Cb 1.05 0.28 0.08 0.00 -0.10 0.00 0.00 28.75 30.06 1up6 h GLU 306 CO 0.09 1.37 0.12 0.95 -1.16 0.00 0.00 179.01 180.38 1up6 s THR 307 N -2.78 2.25 -0.20 1.13 -4.23 -0.84 -4.76 115.64 106.21 1up6 s THR 307 Ca -0.08 -0.51 0.16 0.00 -1.18 0.00 0.00 61.69 60.08 1up6 s THR 307 Cb 0.05 -2.74 0.51 0.00 1.34 0.00 0.00 72.50 71.67 1up6 s THR 307 CO 0.93 0.00 1.42 -0.67 -0.54 0.00 0.00 174.62 175.76 1up6 n ASP 308 N -2.83 3.59 0.21 3.99 2.03 -1.26 -1.23 116.55 121.05 1up6 n ASP 308 Ca 0.13 -3.14 -0.14 0.00 0.52 0.00 0.00 54.79 52.15 1up6 n ASP 308 Cb 0.60 -0.56 -0.08 0.00 -0.72 0.00 0.00 41.12 40.37 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 1.57 -0.50 -0.70 -0.67 5.08 -1.90 -3.48 114.58 113.98 1up6 h GLU 309 Ca 0.04 0.03 0.00 0.00 -1.00 0.00 0.00 59.36 58.43 1up6 h GLU 309 Cb 1.47 0.11 0.00 0.00 0.50 0.00 0.00 28.75 30.83 1up6 h GLU 309 CO 0.24 -0.22 0.00 0.41 -1.00 0.00 0.00 179.01 178.44 1up6 n GLY 310 N -0.70 -0.43 3.16 -3.84 0.00 -1.25 -5.06 105.19 97.06 1up6 n GLY 310 Ca -0.10 -0.82 -0.10 0.00 0.00 0.00 0.00 46.02 44.99 1up6 n GLY 310 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1up6 s LYS 311 N -0.98 0.80 -0.10 1.61 1.02 -0.69 -4.92 119.74 116.47 1up6 s LYS 311 Ca 0.00 -1.31 -0.21 0.00 0.02 0.00 0.00 55.97 54.47 1up6 s LYS 311 Cb 0.00 -0.15 -0.04 0.00 -0.52 0.00 0.00 37.83 37.12 1up6 s LYS 311 CO 0.00 -0.03 0.61 0.42 -0.92 0.00 0.00 175.35 175.43 1up6 s ILE 312 N -3.62 5.10 -0.02 2.17 -1.09 -1.26 -0.24 121.20 122.24 1up6 s ILE 312 Ca 0.11 1.22 0.00 0.00 -2.23 0.00 0.00 60.65 59.75 1up6 s ILE 312 Cb 0.05 -3.94 0.02 0.00 -1.58 0.00 0.00 42.46 37.01 1up6 s ILE 312 CO -0.05 0.26 0.01 -1.00 -1.23 0.00 0.00 174.94 172.92 1up6 s HIS 313 N 0.89 0.18 -0.33 3.97 3.76 -0.21 -4.92 115.29 118.63 1up6 s HIS 313 Ca 0.32 0.04 -0.27 0.00 -0.15 0.00 0.00 55.06 55.01 1up6 s HIS 313 Cb -0.16 -0.30 0.01 0.00 1.11 0.00 0.00 32.58 33.24 1up6 s HIS 313 CO 0.14 -0.09 0.96 0.42 -0.85 0.00 0.00 174.74 175.31 1up6 s ILE 314 N 0.88 4.60 0.18 0.60 1.01 -1.26 -0.93 121.20 126.28 1up6 s ILE 314 Ca -0.08 1.42 -0.00 0.00 0.00 0.00 0.00 60.65 61.98 1up6 s ILE 314 Cb -0.11 -4.33 -0.04 0.00 0.01 0.00 0.00 42.46 37.99 1up6 s ILE 314 CO -0.02 -0.45 0.08 0.68 0.00 0.00 0.00 174.94 175.23 1up6 s VAL 315 N 3.44 0.23 -0.30 2.92 -7.23 -0.24 -4.83 120.40 114.40 1up6 s VAL 315 Ca 0.40 -1.97 -0.21 0.00 -1.81 0.00 0.00 61.98 58.39 1up6 s VAL 315 Cb -0.12 -2.31 -0.01 0.00 0.56 0.00 0.00 36.38 34.50 1up6 s VAL 315 CO 0.16 -0.23 0.66 0.20 -0.31 0.00 0.00 175.10 175.57 1up6 s ASN 316 N -3.15 6.53 0.31 4.85 0.01 0.07 -1.15 114.94 122.41 1up6 s ASN 316 Ca 0.31 0.50 -0.15 0.00 -0.71 0.00 0.00 52.86 52.81 1up6 s ASN 316 Cb 0.07 -2.34 0.02 0.00 0.41 0.00 0.00 41.25 39.41 1up6 s ASN 316 CO 0.08 -0.49 0.64 0.28 -1.51 0.00 0.00 177.10 176.10 1up6 s THR 317 N 2.65 0.00 0.26 1.60 -1.32 -0.58 -2.84 115.64 115.41 1up6 s THR 317 Ca 0.26 -1.18 -0.30 0.00 -1.21 0.00 0.00 61.69 59.26 1up6 s THR 317 Cb -0.15 -2.37 -0.11 0.00 -1.51 0.00 0.00 72.50 68.37 1up6 s THR 317 CO 0.11 0.00 1.57 -0.13 -2.21 0.00 0.00 174.62 173.97 1up6 s ARG 318 N -3.41 4.16 0.18 7.08 0.52 -1.26 -0.12 118.95 126.10 1up6 s ARG 318 Ca 0.18 2.50 -0.24 0.00 -0.52 0.00 0.00 55.73 57.64 1up6 s ARG 318 Cb -0.04 -3.06 0.07 0.00 0.52 0.00 0.00 34.95 32.44 1up6 s ARG 318 CO 0.10 -0.60 1.56 -0.97 0.02 0.00 0.00 175.30 175.42 1up6 h ASN 319 N 5.33 -1.62 -7.07 0.23 -1.24 -0.54 -3.46 115.58 107.21 1up6 h ASN 319 Ca -0.46 0.28 -0.62 0.00 0.71 0.00 0.00 56.30 56.22 1up6 h ASN 319 Cb 1.22 0.76 -0.21 0.00 0.73 0.00 0.00 38.32 40.81 1up6 h ASN 319 CO 0.82 -0.30 -0.96 0.59 -1.29 0.00 0.00 177.43 176.29 1up6 n ASN 320 N -5.39 0.77 0.00 1.15 5.03 -0.29 -1.16 115.26 115.37 1up6 n ASN 320 Ca 0.04 -1.27 0.00 0.00 0.87 0.00 0.00 54.58 54.22 1up6 n ASN 320 Cb 0.34 -1.66 0.00 0.00 -1.02 0.00 0.00 39.78 37.45 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 -2.49 0.89 0.21 7.41 0.00 -1.26 -4.90 105.19 105.05 1up6 n GLY 321 Ca -0.31 0.00 -0.07 0.00 0.00 0.00 0.00 46.02 45.65 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 0.58 -3.78 1.61 0.87 -1.33 -3.38 113.55 108.12 1up6 h SER 322 Ca 0.00 -0.01 -0.67 0.00 -1.23 0.00 0.00 61.79 59.87 1up6 h SER 322 Cb 0.00 -0.14 -0.35 0.00 -0.44 0.00 0.00 62.40 61.47 1up6 h SER 322 CO 0.00 0.42 -0.77 -0.63 -0.53 0.00 0.00 176.83 175.32 1up6 s ILE 323 N -6.15 2.45 -1.15 2.23 -1.09 -1.26 -1.17 121.20 115.07 1up6 s ILE 323 Ca -0.13 -1.49 0.17 0.00 -2.23 0.00 0.00 60.65 56.96 1up6 s ILE 323 Cb 0.12 -2.40 0.19 0.00 -1.58 0.00 0.00 42.46 38.79 1up6 s ILE 323 CO 0.74 -0.01 1.52 -1.84 -1.23 0.00 0.00 174.94 174.12 1up6 n GLU 324 N 4.51 0.08 0.00 2.79 0.28 -0.92 -2.09 120.64 125.30 1up6 n GLU 324 Ca -0.14 0.18 0.11 0.00 -0.16 0.00 0.00 57.16 57.16 1up6 n GLU 324 Cb 0.43 -1.50 0.13 0.00 1.43 0.00 0.00 31.44 31.93 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 -1.43 0.65 -4.36 -1.84 5.15 -1.26 -4.91 115.26 107.26 1up6 n ASN 325 Ca 0.05 -0.43 -0.25 0.00 -0.60 0.00 0.00 54.58 53.35 1up6 n ASN 325 Cb 0.17 0.50 -0.12 0.00 -0.53 0.00 0.00 39.78 39.81 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 -3.14 2.39 0.60 1.20 1.43 -0.89 -4.97 118.68 115.30 1up6 s LEU 326 Ca 0.09 -0.81 -0.19 0.00 -1.03 0.00 0.00 54.13 52.20 1up6 s LEU 326 Cb 0.17 -1.02 -0.04 0.00 0.03 0.00 0.00 46.19 45.33 1up6 s LEU 326 CO 0.76 0.07 1.08 -2.65 0.23 0.00 0.00 176.35 175.84 1up6 n PRO 327 N 0.56 1.04 0.24 1.29 -0.02 -1.26 -4.89 135.00 131.95 1up6 n PRO 327 Ca -0.15 0.40 0.07 0.00 -2.02 0.00 0.00 63.50 61.80 1up6 n PRO 327 Cb 0.55 -2.29 0.57 0.00 -0.02 0.00 0.00 33.50 32.31 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 0.61 0.00 0.35 2.55 3.32 -1.95 -3.08 116.42 118.22 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 1.35 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.90 1up6 h ASP 328 CO 0.52 0.12 -0.27 -0.90 -1.72 0.00 0.00 179.24 177.00 1up6 n ASP 329 N -4.32 0.75 -4.69 6.45 5.75 -1.26 -1.13 116.55 118.10 1up6 n ASP 329 Ca -0.03 -0.63 -0.42 0.00 -0.01 0.00 0.00 54.79 53.71 1up6 n ASP 329 Cb 0.20 0.09 -0.03 0.00 -1.03 0.00 0.00 41.12 40.35 1up6 n ASP 329 CO 0.00 0.00 0.00 -0.31 -0.11 0.00 0.00 177.20 176.78 1up6 s TYR 330 N -2.62 2.13 -0.02 2.11 1.51 -1.17 -4.66 117.35 114.62 1up6 s TYR 330 Ca 0.22 -0.03 -0.30 0.00 -1.01 0.00 0.00 57.07 55.95 1up6 s TYR 330 Cb 0.19 -4.17 -0.05 0.00 -0.11 0.00 0.00 41.96 37.82 1up6 s TYR 330 CO 0.55 -4.85 1.29 0.08 -1.11 0.00 0.00 175.55 171.51 1up6 s VAL 331 N 2.79 3.98 0.20 0.71 1.01 -1.26 -0.55 120.40 127.28 1up6 s VAL 331 Ca 0.81 1.35 0.07 0.00 0.00 0.00 0.00 61.98 64.20 1up6 s VAL 331 Cb -0.46 -3.87 -0.05 0.00 0.00 0.00 0.00 36.38 32.01 1up6 s VAL 331 CO 0.36 0.01 -0.12 -0.76 0.00 0.00 0.00 175.10 174.60 1up6 s LEU 332 N 2.16 2.52 -0.43 3.92 1.43 0.83 -4.87 118.68 124.24 1up6 s LEU 332 Ca 0.60 -1.05 -0.16 0.00 -1.03 0.00 0.00 54.13 52.49 1up6 s LEU 332 Cb -0.28 -0.58 0.03 0.00 0.03 0.00 0.00 46.19 45.39 1up6 s LEU 332 CO 0.25 -0.24 0.37 -0.70 0.23 0.00 0.00 176.35 176.26 1up6 s GLU 333 N -3.69 3.01 0.12 1.70 2.12 0.12 -1.53 118.70 120.56 1up6 s GLU 333 Ca 0.22 -1.00 -0.13 0.00 0.36 0.00 0.00 54.97 54.43 1up6 s GLU 333 Cb 0.01 -4.01 0.02 0.00 0.26 0.00 0.00 34.13 30.41 1up6 s GLU 333 CO 0.06 -0.85 0.33 0.96 -0.54 0.00 0.00 175.26 175.22 1up6 s ILE 334 N 1.85 0.09 0.12 -3.70 -4.36 -0.30 -3.40 121.20 111.50 1up6 s ILE 334 Ca 0.07 -0.87 -0.30 0.00 -0.26 0.00 0.00 60.65 59.29 1up6 s ILE 334 Cb -0.19 -1.33 -0.06 0.00 1.25 0.00 0.00 42.46 42.12 1up6 s ILE 334 CO 0.11 -0.40 1.08 -2.84 0.24 0.00 0.00 174.94 173.12 1up6 s PRO 335 N -3.85 4.58 0.04 0.37 0.02 -1.26 -1.07 135.00 133.83 1up6 s PRO 335 Ca 0.06 1.64 0.03 0.00 0.02 0.00 0.00 61.00 62.75 1up6 s PRO 335 Cb 0.03 -3.33 -0.02 0.00 0.02 0.00 0.00 34.50 31.19 1up6 s PRO 335 CO -0.10 0.03 -0.10 0.00 -0.33 0.00 0.00 177.00 176.50 1up6 s TYR 337 N -1.09 3.21 -0.19 0.00 5.04 0.46 -1.05 117.35 123.74 1up6 s TYR 337 Ca -0.04 0.69 -0.04 0.00 -2.44 0.00 0.00 57.07 55.24 1up6 s TYR 337 Cb -0.09 -3.08 -0.02 0.00 0.35 0.00 0.00 41.96 39.13 1up6 s TYR 337 CO 0.01 -0.50 -0.03 0.08 -1.34 0.00 0.00 175.55 173.76 1up6 s VAL 338 N 2.75 3.67 -0.25 3.14 1.01 0.67 -0.72 120.40 130.66 1up6 s VAL 338 Ca 0.28 -0.41 -0.15 0.00 0.00 0.00 0.00 61.98 61.70 1up6 s VAL 338 Cb -0.15 -2.64 0.07 0.00 0.00 0.00 0.00 36.38 33.67 1up6 s VAL 338 CO 0.12 0.45 0.62 -0.60 0.00 0.00 0.00 175.10 175.68 1up6 s ARG 339 N 0.98 0.63 -1.23 2.72 3.52 -0.75 -1.71 118.95 123.12 1up6 s ARG 339 Ca 0.01 1.10 -0.24 0.00 -0.13 0.00 0.00 55.73 56.47 1up6 s ARG 339 Cb -0.15 0.11 0.02 0.00 -1.56 0.00 0.00 34.95 33.38 1up6 s ARG 339 CO 0.01 -0.15 0.64 0.43 -0.81 0.00 0.00 175.30 175.42 1up6 n SER 340 N 4.22 -3.78 0.00 -2.12 7.64 -0.36 -0.89 113.62 118.33 1up6 n SER 340 Ca -0.21 -1.17 0.00 0.00 1.01 0.00 0.00 58.87 58.50 1up6 n SER 340 Cb 0.58 -2.39 0.00 0.00 -1.01 0.00 0.00 64.21 61.39 1up6 n SER 340 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1up6 n GLY 341 N -1.98 1.72 3.47 0.23 0.00 0.13 -5.01 105.19 103.75 1up6 n GLY 341 Ca -0.14 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.60 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 -0.06 1.70 -0.22 1.61 0.52 -0.07 -5.09 118.95 117.34 1up6 s ARG 342 Ca 0.00 -1.38 -0.01 0.00 -0.52 0.00 0.00 55.73 53.82 1up6 s ARG 342 Cb 0.00 -1.98 0.02 0.00 0.52 0.00 0.00 34.95 33.51 1up6 s ARG 342 CO 0.00 0.43 -0.12 0.08 0.02 0.00 0.00 175.30 175.71 1up6 s VAL 343 N -1.53 2.58 -0.18 3.52 1.01 -1.26 -1.80 120.40 122.73 1up6 s VAL 343 Ca 0.21 -0.96 -0.02 0.00 0.00 0.00 0.00 61.98 61.20 1up6 s VAL 343 Cb -0.09 -2.22 -0.01 0.00 0.00 0.00 0.00 36.38 34.06 1up6 s VAL 343 CO 0.11 0.34 -0.08 -1.00 0.00 0.00 0.00 175.10 174.47 1up6 s HIS 344 N 1.32 2.90 0.44 5.22 3.76 0.11 -4.96 115.29 124.07 1up6 s HIS 344 Ca 0.02 -0.86 -0.24 0.00 -0.15 0.00 0.00 55.06 53.84 1up6 s HIS 344 Cb -0.15 -2.00 -0.08 0.00 1.11 0.00 0.00 32.58 31.47 1up6 s HIS 344 CO -0.08 -0.42 1.22 0.99 -0.85 0.00 0.00 174.74 175.60 1up6 s THR 345 N 1.02 2.88 -0.06 1.30 2.01 -1.26 -0.40 115.64 121.12 1up6 s THR 345 Ca -0.00 0.71 0.03 0.00 0.31 0.00 0.00 61.69 62.73 1up6 s THR 345 Cb -0.15 -3.38 -0.02 0.00 0.01 0.00 0.00 72.50 68.96 1up6 s THR 345 CO -0.01 0.04 -0.14 -0.76 -0.69 0.00 0.00 174.62 173.06 1up6 s LEU 346 N -2.82 2.77 0.27 4.42 1.43 -1.23 -4.83 118.68 118.68 1up6 s LEU 346 Ca 0.61 -0.20 -0.30 0.00 -1.03 0.00 0.00 54.13 53.21 1up6 s LEU 346 Cb -0.33 -1.57 -0.11 0.00 0.03 0.00 0.00 46.19 44.21 1up6 s LEU 346 CO 0.40 0.33 1.61 -0.55 0.23 0.00 0.00 176.35 178.36 1up6 s SER 347 N -0.60 6.39 0.00 2.29 0.15 -1.26 -4.33 113.70 116.34 1up6 s SER 347 Ca 0.09 2.91 0.00 0.00 0.70 0.00 0.00 55.95 59.65 1up6 s SER 347 Cb -0.11 -2.63 0.00 0.00 -1.71 0.00 0.00 66.02 61.57 1up6 s SER 347 CO 0.01 -0.91 0.11 0.00 1.20 0.00 0.00 173.24 173.65 1up6 n GLN 348 N 2.53 1.54 0.00 5.44 6.02 -0.32 -5.03 117.38 127.56 1up6 n GLN 348 Ca 0.09 -0.11 0.00 0.00 -0.01 0.00 0.00 57.00 56.98 1up6 n GLN 348 Cb 0.37 -0.46 0.00 0.00 1.02 0.00 0.00 30.24 31.17 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 0.25 -1.11 3.79 1.08 0.00 -1.24 -4.95 105.19 103.01 1up6 n GLY 349 Ca 0.00 -1.51 -0.37 0.00 0.00 0.00 0.00 46.02 44.14 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 4.51 0.43 1.61 1.02 -1.26 -2.17 119.74 123.88 1up6 s LYS 350 Ca 0.00 1.21 -0.13 0.00 0.02 0.00 0.00 55.97 57.07 1up6 s LYS 350 Cb 0.00 -2.87 -0.07 0.00 -0.52 0.00 0.00 37.83 34.37 1up6 s LYS 350 CO 0.00 0.34 0.84 0.20 -0.92 0.00 0.00 175.35 175.80 1up6 s GLY 351 N -1.58 2.02 0.22 -3.33 0.00 -1.26 -4.97 107.32 98.42 1up6 s GLY 351 Ca 0.47 -0.05 -0.30 0.00 0.00 0.00 0.00 44.72 44.84 1up6 s GLY 351 CO 0.24 0.17 1.15 -0.35 0.00 0.00 0.00 173.10 174.30 1up6 s ASP 352 N -3.05 7.16 0.29 1.64 -1.08 -1.26 -4.93 116.67 115.45 1up6 s ASP 352 Ca 0.54 2.24 0.04 0.00 -0.52 0.00 0.00 52.55 54.84 1up6 s ASP 352 Cb -0.10 -2.61 0.72 0.00 -1.46 0.00 0.00 42.92 39.47 1up6 s ASP 352 CO 0.30 -0.28 1.70 0.45 0.52 0.00 0.00 175.17 177.86 1up6 h HIS 353 N 4.71 0.64 0.03 -5.34 3.86 -1.99 -0.80 115.15 116.27 1up6 h HIS 353 Ca -0.45 0.04 -0.00 0.00 -1.16 0.00 0.00 60.37 58.80 1up6 h HIS 353 Cb 1.21 -0.14 0.00 0.00 1.06 0.00 0.00 27.41 29.54 1up6 h HIS 353 CO 0.61 -0.05 -0.02 0.35 0.86 0.00 0.00 177.93 179.69 1up6 h PHE 354 N 0.40 -0.04 -0.61 2.45 3.57 -1.98 -1.72 116.94 119.00 1up6 h PHE 354 Ca 0.56 -0.00 -0.00 0.00 3.53 0.00 0.00 57.97 62.05 1up6 h PHE 354 Cb 1.05 0.01 -0.03 0.00 2.79 0.00 0.00 35.95 39.77 1up6 h PHE 354 CO -0.14 0.00 0.37 0.00 -2.23 0.00 0.00 178.31 176.31 1up6 h ALA 355 N 0.90 0.78 -0.66 2.41 0.00 -1.74 -3.02 119.26 117.92 1up6 h ALA 355 Ca -0.00 -0.07 0.01 0.00 0.00 0.00 0.00 54.91 54.84 1up6 h ALA 355 Cb 0.06 -0.25 -0.03 0.00 0.00 0.00 0.00 17.79 17.57 1up6 h ALA 355 CO 0.01 0.26 0.43 -0.07 0.00 0.00 0.00 179.25 179.88 1up6 h LEU 356 N 0.83 0.76 -0.90 0.00 4.07 -0.98 -1.91 115.31 117.18 1up6 h LEU 356 Ca 0.22 -0.02 0.01 0.00 0.08 0.00 0.00 57.88 58.17 1up6 h LEU 356 Cb -0.02 -0.19 -0.05 0.00 1.08 0.00 0.00 40.66 41.48 1up6 h LEU 356 CO -0.04 0.56 0.59 0.77 -1.08 0.00 0.00 178.44 179.24 1up6 h SER 357 N 0.90 1.02 -0.01 -0.43 4.64 -1.18 -0.33 113.55 118.15 1up6 h SER 357 Ca 0.24 -0.02 -0.00 0.00 -0.47 0.00 0.00 61.79 61.54 1up6 h SER 357 Cb -0.10 -0.25 -0.00 0.00 -0.31 0.00 0.00 62.40 61.74 1up6 h SER 357 CO -0.05 0.73 0.00 -0.26 -0.87 0.00 0.00 176.83 176.38 1up6 h PHE 358 N 1.20 0.02 -0.25 4.77 0.04 -1.51 -2.91 116.94 118.30 1up6 h PHE 358 Ca 0.33 -0.00 -0.01 0.00 2.80 0.00 0.00 57.97 61.10 1up6 h PHE 358 Cb -0.11 -0.01 -0.01 0.00 2.20 0.00 0.00 35.95 38.02 1up6 h PHE 358 CO -0.01 0.22 0.13 0.82 -0.60 0.00 0.00 178.31 178.88 1up6 h ILE 359 N -0.19 1.13 0.19 -0.55 2.04 -0.99 -2.20 117.51 116.93 1up6 h ILE 359 Ca 0.00 -0.34 0.01 0.00 1.00 0.00 0.00 64.86 65.53 1up6 h ILE 359 Cb 0.22 0.90 -0.02 0.00 -0.74 0.00 0.00 36.82 37.18 1up6 h ILE 359 CO -0.00 0.12 -0.21 0.45 0.00 0.00 0.00 178.15 178.52 1up6 h HIS 360 N 0.28 -0.55 -0.35 1.37 3.86 -1.17 -1.37 115.15 117.23 1up6 h HIS 360 Ca 0.09 0.00 0.06 0.00 -1.16 0.00 0.00 60.37 59.36 1up6 h HIS 360 Cb 0.08 0.22 -0.05 0.00 1.06 0.00 0.00 27.41 28.72 1up6 h HIS 360 CO -0.03 -0.31 0.04 0.00 0.86 0.00 0.00 177.93 178.49 1up6 h ALA 361 N 0.30 0.35 -0.04 2.45 0.00 -1.32 -2.57 119.26 118.43 1up6 h ALA 361 Ca 0.01 0.08 -0.17 0.00 0.00 0.00 0.00 54.91 54.82 1up6 h ALA 361 Cb 0.42 0.12 -0.01 0.00 0.00 0.00 0.00 17.79 18.32 1up6 h ALA 361 CO -0.06 -0.36 -0.74 0.28 0.00 0.00 0.00 179.25 178.36 1up6 h VAL 362 N 0.15 1.42 0.00 0.00 2.07 -1.35 -2.42 116.25 116.12 1up6 h VAL 362 Ca 0.17 -2.26 0.00 0.00 0.82 0.00 0.00 66.70 65.43 1up6 h VAL 362 Cb 0.21 2.20 0.00 0.00 -1.52 0.00 0.00 31.29 32.18 1up6 h VAL 362 CO -0.25 0.67 0.00 1.17 0.02 0.00 0.00 177.57 179.18 1up6 n LYS 363 N -3.78 0.19 0.00 1.57 3.00 -0.52 -0.17 118.16 118.44 1up6 n LYS 363 Ca -0.03 0.00 0.00 0.00 -0.00 0.00 0.00 58.31 58.28 1up6 n LYS 363 Cb 0.71 -1.22 0.00 0.00 0.00 0.00 0.00 35.03 34.52 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 0.60 0.00 -0.26 5.64 9.36 -0.91 -1.78 117.16 129.81 1up6 n TYR 365 Ca 0.00 0.00 -0.05 0.00 3.32 0.00 0.00 57.90 61.17 1up6 n TYR 365 Cb 0.07 0.00 0.09 0.00 -0.63 0.00 0.00 39.34 38.87 1up6 n TYR 365 CO 0.00 0.00 0.00 0.93 0.22 0.00 0.00 176.86 178.01 1up6 h GLU 366 N 0.00 1.14 0.05 2.98 5.08 -0.85 -1.11 114.58 121.87 1up6 h GLU 366 Ca 0.00 -0.21 -0.23 0.00 -1.00 0.00 0.00 59.36 57.93 1up6 h GLU 366 Cb 0.00 -0.18 -0.01 0.00 0.50 0.00 0.00 28.75 29.05 1up6 h GLU 366 CO 0.00 0.93 -1.05 0.00 -1.00 0.00 0.00 179.01 177.89 1up6 h ARG 367 N 1.11 0.15 -0.69 2.33 3.08 -1.61 -2.19 114.38 116.55 1up6 h ARG 367 Ca 0.25 -0.22 -0.06 0.00 0.07 0.00 0.00 59.98 60.03 1up6 h ARG 367 Cb 0.22 0.08 -0.03 0.00 0.08 0.00 0.00 29.97 30.32 1up6 h ARG 367 CO -0.02 1.06 0.21 -0.07 -1.07 0.00 0.00 179.97 180.08 1up6 h LEU 368 N 0.05 1.01 -0.46 3.04 3.38 -1.76 -1.61 115.31 118.97 1up6 h LEU 368 Ca -0.06 -0.21 -0.02 0.00 0.09 0.00 0.00 57.88 57.67 1up6 h LEU 368 Cb 1.76 -0.27 -0.02 0.00 0.09 0.00 0.00 40.66 42.22 1up6 h LEU 368 CO 0.16 0.96 0.19 0.74 0.09 0.00 0.00 178.44 180.58 1up6 h THR 369 N 1.02 1.20 -0.32 0.22 2.02 -1.17 -0.71 112.91 115.18 1up6 h THR 369 Ca 0.22 -0.61 0.00 0.00 0.77 0.00 0.00 66.41 66.80 1up6 h THR 369 Cb 0.31 0.74 -0.02 0.00 -1.74 0.00 0.00 68.15 67.45 1up6 h THR 369 CO -0.01 0.23 0.20 0.40 0.37 0.00 0.00 175.52 176.71 1up6 h ILE 370 N 0.60 1.10 -0.75 3.11 2.04 -1.25 -0.58 117.51 121.78 1up6 h ILE 370 Ca 0.15 -0.20 -0.03 0.00 1.00 0.00 0.00 64.86 65.78 1up6 h ILE 370 Cb 0.17 0.66 -0.03 0.00 -0.74 0.00 0.00 36.82 36.88 1up6 h ILE 370 CO -0.01 0.09 0.37 -0.33 0.00 0.00 0.00 178.15 178.27 1up6 h GLU 371 N 0.42 1.07 -0.38 2.37 5.08 -1.10 0.70 114.58 122.74 1up6 h GLU 371 Ca 0.12 -0.15 -0.03 0.00 -1.00 0.00 0.00 59.36 58.29 1up6 h GLU 371 Cb -0.02 -0.20 -0.02 0.00 0.50 0.00 0.00 28.75 29.02 1up6 h GLU 371 CO -0.02 0.83 0.13 0.00 -1.00 0.00 0.00 179.01 178.95 1up6 h ALA 372 N 1.18 0.49 0.27 3.43 0.00 -0.90 -1.55 119.26 122.19 1up6 h ALA 372 Ca 0.26 -0.16 -0.00 0.00 0.00 0.00 0.00 54.91 55.01 1up6 h ALA 372 Cb 0.11 -0.15 -0.01 0.00 0.00 0.00 0.00 17.79 17.74 1up6 h ALA 372 CO -0.03 0.12 -0.23 -0.92 0.00 0.00 0.00 179.25 178.19 1up6 h TYR 373 N 0.46 -0.61 -0.42 0.00 3.20 -0.54 -0.39 116.97 118.67 1up6 h TYR 373 Ca 0.12 0.00 0.08 0.00 3.14 0.00 0.00 58.73 62.08 1up6 h TYR 373 Cb 0.23 0.23 -0.02 0.00 1.54 0.00 0.00 36.73 38.71 1up6 h TYR 373 CO 0.01 -0.35 0.29 -0.07 -1.64 0.00 0.00 178.16 176.40 1up6 h LEU 374 N -0.52 0.18 -1.45 2.82 3.38 -0.70 -0.53 115.31 118.50 1up6 h LEU 374 Ca -0.01 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.96 1up6 h LEU 374 Cb 0.47 -0.04 0.00 0.00 0.09 0.00 0.00 40.66 41.18 1up6 h LEU 374 CO -0.03 0.11 -0.14 0.29 0.09 0.00 0.00 178.44 178.76 1up6 n LYS 375 N -4.46 1.84 -3.90 1.13 4.01 -0.60 -4.96 118.16 111.22 1up6 n LYS 375 Ca 0.06 -1.45 -0.27 0.00 -0.51 0.00 0.00 58.31 56.15 1up6 n LYS 375 Cb 0.35 -1.47 0.01 0.00 -0.51 0.00 0.00 35.03 33.40 1up6 n LYS 375 CO 0.00 0.00 0.00 0.54 -1.11 0.00 0.00 177.40 176.83 1up6 n ARG 376 N 0.68 -4.42 -3.85 1.97 5.12 -0.21 -4.90 116.66 111.05 1up6 n ARG 376 Ca 0.13 0.52 -0.36 0.00 -1.93 0.00 0.00 57.85 56.22 1up6 n ARG 376 Cb 0.51 -5.08 -0.13 0.00 -1.16 0.00 0.00 32.46 26.60 1up6 n ARG 376 CO 0.00 0.00 0.00 0.45 -1.93 0.00 0.00 177.63 176.15 1up6 s SER 377 N -3.94 4.72 0.12 0.55 0.15 -0.62 -0.47 113.70 114.20 1up6 s SER 377 Ca 0.28 -0.65 -0.20 0.00 0.70 0.00 0.00 55.95 56.07 1up6 s SER 377 Cb -0.14 -1.79 -0.08 0.00 -1.71 0.00 0.00 66.02 62.29 1up6 s SER 377 CO 0.85 -0.13 1.77 0.50 1.20 0.00 0.00 173.24 177.43 1up6 h LYS 378 N 8.14 0.22 -0.47 5.44 3.64 -1.84 -1.69 116.57 130.01 1up6 h LYS 378 Ca -0.34 -0.01 0.05 0.00 -1.27 0.00 0.00 60.65 59.08 1up6 h LYS 378 Cb 1.13 -0.05 -0.05 0.00 -0.41 0.00 0.00 32.23 32.85 1up6 h LYS 378 CO 0.59 0.15 0.19 0.87 -2.27 0.00 0.00 179.45 178.98 1up6 h LYS 379 N 0.22 0.37 0.00 1.90 1.57 -1.94 -1.87 116.57 116.82 1up6 h LYS 379 Ca 0.06 -0.02 -0.07 0.00 -1.87 0.00 0.00 60.65 58.75 1up6 h LYS 379 Cb -0.02 -0.08 -0.01 0.00 0.08 0.00 0.00 32.23 32.20 1up6 h LYS 379 CO -0.01 0.25 -0.33 -0.07 -0.57 0.00 0.00 179.45 178.72 1up6 h LEU 380 N 0.38 0.00 -0.46 2.94 3.38 -1.90 -2.79 115.31 116.87 1up6 h LEU 380 Ca 0.22 0.00 -0.13 0.00 0.09 0.00 0.00 57.88 58.06 1up6 h LEU 380 Cb 0.19 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 40.93 1up6 h LEU 380 CO -0.20 0.33 -0.23 0.00 0.09 0.00 0.00 178.44 178.43 1up6 h ALA 381 N 1.67 0.64 -0.23 1.53 0.00 -0.56 -0.55 119.26 121.76 1up6 h ALA 381 Ca -0.00 -0.39 0.05 0.00 0.00 0.00 0.00 54.91 54.56 1up6 h ALA 381 Cb 0.70 -0.16 -0.05 0.00 0.00 0.00 0.00 17.79 18.29 1up6 h ALA 381 CO 0.04 0.64 -0.07 -0.07 0.00 0.00 0.00 179.25 179.79 1up6 h LEU 382 N 0.80 -0.26 -0.53 0.00 4.07 -1.16 0.56 115.31 118.80 1up6 h LEU 382 Ca 0.10 0.07 0.06 0.00 0.08 0.00 0.00 57.88 58.19 1up6 h LEU 382 Cb 0.81 0.16 -0.05 0.00 1.08 0.00 0.00 40.66 42.65 1up6 h LEU 382 CO 0.07 -0.09 0.24 0.50 -1.08 0.00 0.00 178.44 178.07 1up6 h LYS 383 N -0.02 0.44 0.14 1.13 3.64 -1.22 0.39 116.57 121.08 1up6 h LYS 383 Ca 0.11 -0.03 -0.00 0.00 -1.27 0.00 0.00 60.65 59.47 1up6 h LYS 383 Cb 0.20 -0.10 -0.01 0.00 -0.41 0.00 0.00 32.23 31.91 1up6 h LYS 383 CO -0.25 0.29 -0.10 0.00 -2.27 0.00 0.00 179.45 177.12 1up6 h ALA 384 N 1.31 -0.23 -0.61 5.00 0.00 -0.62 -2.55 119.26 121.56 1up6 h ALA 384 Ca 0.24 -0.04 0.08 0.00 0.00 0.00 0.00 54.91 55.20 1up6 h ALA 384 Cb 0.20 0.14 -0.07 0.00 0.00 0.00 0.00 17.79 18.06 1up6 h ALA 384 CO -0.20 -0.64 0.26 1.25 0.00 0.00 0.00 179.25 179.92 1up6 h LEU 385 N -0.25 0.30 -1.14 0.00 5.85 -0.44 -0.76 115.31 118.87 1up6 h LEU 385 Ca -0.01 0.06 0.00 0.00 0.84 0.00 0.00 57.88 58.78 1up6 h LEU 385 Cb 0.22 0.02 0.00 0.00 0.37 0.00 0.00 40.66 41.28 1up6 h LEU 385 CO -0.00 0.18 0.00 -0.07 -0.34 0.00 0.00 178.44 178.21 1up6 h LEU 386 N 0.46 0.00 0.00 2.25 3.38 -0.75 -3.01 115.31 117.64 1up6 h LEU 386 Ca 0.30 0.00 -0.03 0.00 0.09 0.00 0.00 57.88 58.24 1up6 h LEU 386 Cb 0.33 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.07 1up6 h LEU 386 CO -0.27 0.00 -0.91 0.77 0.09 0.00 0.00 178.44 178.12 1up6 h SER 387 N 0.00 0.00 -3.26 -0.43 4.64 -0.71 -3.46 113.55 110.32 1up6 h SER 387 Ca 0.00 0.00 -0.53 0.00 -0.47 0.00 0.00 61.79 60.79 1up6 h SER 387 Cb 0.29 0.00 0.04 0.00 -0.31 0.00 0.00 62.40 62.42 1up6 h SER 387 CO 0.00 0.11 0.73 -2.28 -0.87 0.00 0.00 176.83 174.52 1up6 s HIS 388 N -3.26 3.14 0.66 4.77 5.04 -1.14 -4.78 115.29 119.72 1up6 s HIS 388 Ca 0.00 1.04 0.34 0.00 -1.54 0.00 0.00 55.06 54.90 1up6 s HIS 388 Cb 0.09 -3.74 1.86 0.00 0.04 0.00 0.00 32.58 30.83 1up6 s HIS 388 CO 0.78 -2.45 2.07 -1.35 -2.34 0.00 0.00 174.74 171.45 1up6 h PRO 389 N 5.60 0.00 -0.27 2.88 0.11 -1.89 0.06 132.00 138.49 1up6 h PRO 389 Ca -0.45 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.66 1up6 h PRO 389 Cb 1.21 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.32 1up6 h PRO 389 CO 0.80 0.00 0.00 1.28 -0.21 0.00 0.00 178.00 179.87 1up6 n LEU 390 N -3.08 3.13 -4.71 2.35 4.77 -1.26 -5.04 117.00 113.16 1up6 n LEU 390 Ca -0.01 -2.38 -0.30 0.00 -0.03 0.00 0.00 56.01 53.29 1up6 n LEU 390 Cb 0.30 -0.32 0.23 0.00 -2.33 0.00 0.00 43.42 41.29 1up6 n LEU 390 CO 0.17 0.69 0.71 -0.83 -1.33 0.00 0.00 177.39 176.81 1up6 s GLY 391 N -1.38 1.66 0.66 -0.72 0.00 0.01 -4.63 107.32 102.91 1up6 s GLY 391 Ca 0.28 -1.07 -0.14 0.00 0.00 0.00 0.00 44.72 43.79 1up6 s GLY 391 CO 0.12 -0.21 1.08 2.56 0.00 0.00 0.00 173.10 176.65 1up6 s PRO 392 N -5.60 2.91 0.85 2.90 0.04 -1.26 -4.99 135.00 129.85 1up6 s PRO 392 Ca 0.72 1.22 -0.10 0.00 0.04 0.00 0.00 61.00 62.88 1up6 s PRO 392 Cb -0.07 -1.98 0.10 0.00 0.04 0.00 0.00 34.50 32.60 1up6 s PRO 392 CO 0.55 -1.14 1.11 -0.51 0.04 0.00 0.00 177.00 177.05 1up6 s ASP 393 N -2.99 3.71 0.25 6.66 1.11 -1.26 -4.71 116.67 119.44 1up6 s ASP 393 Ca 0.63 1.92 -0.05 0.00 0.18 0.00 0.00 52.55 55.24 1up6 s ASP 393 Cb -0.17 -2.50 0.50 0.00 1.07 0.00 0.00 42.92 41.82 1up6 s ASP 393 CO 0.45 -2.56 1.65 0.58 1.18 0.00 0.00 175.17 176.47 1up6 h VAL 394 N -1.49 0.37 0.00 -1.27 2.07 -1.97 -1.38 116.25 112.58 1up6 h VAL 394 Ca -0.44 -0.06 0.00 0.00 0.82 0.00 0.00 66.70 67.02 1up6 h VAL 394 Cb 1.25 0.20 0.00 0.00 -1.52 0.00 0.00 31.29 31.22 1up6 h VAL 394 CO 0.48 0.03 0.00 1.05 0.02 0.00 0.00 177.57 179.15 1up6 h GLU 395 N 0.16 0.00 0.00 1.57 4.11 -2.05 -2.98 114.58 115.39 1up6 h GLU 395 Ca 0.44 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.87 1up6 h GLU 395 Cb 0.81 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.06 1up6 h GLU 395 CO -0.63 0.00 -1.25 -0.25 0.07 0.00 0.00 179.01 176.95 1up6 n ASP 396 N -2.75 1.59 -0.27 3.06 8.00 -0.59 -4.80 116.55 120.79 1up6 n ASP 396 Ca -0.01 -0.26 -0.05 0.00 0.71 0.00 0.00 54.79 55.18 1up6 n ASP 396 Cb 0.13 1.39 0.06 0.00 -0.02 0.00 0.00 41.12 42.68 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 1.36 0.94 0.09 2.24 0.00 -1.21 -2.37 119.26 120.32 1up6 h ALA 397 Ca 0.00 -0.05 -0.00 0.00 0.00 0.00 0.00 54.91 54.85 1up6 h ALA 397 Cb 0.49 -0.30 0.00 0.00 0.00 0.00 0.00 17.79 17.98 1up6 h ALA 397 CO 0.00 0.36 -0.04 0.87 0.00 0.00 0.00 179.25 180.43 1up6 h LYS 398 N 1.01 -0.12 -0.87 0.00 1.57 -1.87 -0.90 116.57 115.38 1up6 h LYS 398 Ca 0.27 0.01 0.01 0.00 -1.87 0.00 0.00 60.65 59.07 1up6 h LYS 398 Cb -0.11 0.03 -0.04 0.00 0.08 0.00 0.00 32.23 32.18 1up6 h LYS 398 CO -0.06 0.19 0.57 -0.44 -0.57 0.00 0.00 179.45 179.14 1up6 h ASP 399 N -0.44 1.01 -0.36 0.86 3.32 -1.88 -0.53 116.42 118.40 1up6 h ASP 399 Ca -0.01 -0.04 -0.02 0.00 0.02 0.00 0.00 57.03 56.98 1up6 h ASP 399 Cb 0.37 -0.25 -0.02 0.00 0.22 0.00 0.00 39.33 39.65 1up6 h ASP 399 CO 0.02 0.74 0.15 0.25 -1.72 0.00 0.00 179.24 178.69 1up6 h LEU 400 N 1.19 0.48 -0.60 1.55 5.85 -1.35 -1.72 115.31 120.71 1up6 h LEU 400 Ca 0.32 -0.15 0.01 0.00 0.84 0.00 0.00 57.88 58.90 1up6 h LEU 400 Cb -0.12 -0.12 -0.03 0.00 0.37 0.00 0.00 40.66 40.76 1up6 h LEU 400 CO -0.07 0.50 0.39 0.25 -0.34 0.00 0.00 178.44 179.17 1up6 h LEU 401 N 0.43 0.66 -0.60 2.25 5.85 -0.84 -1.89 115.31 121.19 1up6 h LEU 401 Ca 0.12 -0.01 0.08 0.00 0.84 0.00 0.00 57.88 58.91 1up6 h LEU 401 Cb 0.16 -0.16 -0.06 0.00 0.37 0.00 0.00 40.66 40.96 1up6 h LEU 401 CO -0.01 0.48 0.25 -0.33 -0.34 0.00 0.00 178.44 178.49 1up6 h GLU 402 N 0.79 0.45 -0.15 1.25 3.07 -0.87 -0.73 114.58 118.38 1up6 h GLU 402 Ca 0.23 -0.03 -0.01 0.00 -0.50 0.00 0.00 59.36 59.05 1up6 h GLU 402 Cb -0.06 -0.10 -0.01 0.00 -0.84 0.00 0.00 28.75 27.74 1up6 h GLU 402 CO -0.06 0.30 0.07 0.93 -1.40 0.00 0.00 179.01 178.84 1up6 h GLU 403 N 0.46 0.22 -0.52 2.33 5.08 -1.01 -1.21 114.58 119.93 1up6 h GLU 403 Ca 0.29 -0.03 0.05 0.00 -1.00 0.00 0.00 59.36 58.66 1up6 h GLU 403 Cb 0.31 -0.04 -0.05 0.00 0.50 0.00 0.00 28.75 29.48 1up6 h GLU 403 CO -0.26 0.27 0.26 0.82 -1.00 0.00 0.00 179.01 179.09 1up6 h ILE 404 N 0.12 0.95 -0.34 3.13 2.04 -1.05 -1.77 117.51 120.59 1up6 h ILE 404 Ca 0.05 -0.17 -0.09 0.00 1.00 0.00 0.00 64.86 65.65 1up6 h ILE 404 Cb 0.12 0.40 -0.02 0.00 -0.74 0.00 0.00 36.82 36.59 1up6 h ILE 404 CO -0.01 0.09 -0.15 -0.07 0.00 0.00 0.00 178.15 178.02 1up6 h LEU 405 N 0.51 0.59 -0.38 1.44 3.38 -0.86 -1.26 115.31 118.72 1up6 h LEU 405 Ca 0.23 -0.17 -0.09 0.00 0.09 0.00 0.00 57.88 57.94 1up6 h LEU 405 Cb 0.14 -0.16 -0.01 0.00 0.09 0.00 0.00 40.66 40.72 1up6 h LEU 405 CO -0.16 0.76 -0.11 -0.08 0.09 0.00 0.00 178.44 178.94 1up6 h GLU 406 N 0.54 0.74 -0.29 1.13 4.57 -1.00 -1.68 114.58 118.59 1up6 h GLU 406 Ca 0.09 -0.29 -0.07 0.00 -1.18 0.00 0.00 59.36 57.91 1up6 h GLU 406 Cb 0.57 -0.04 -0.02 0.00 -0.16 0.00 0.00 28.75 29.11 1up6 h GLU 406 CO 0.04 0.89 -0.11 0.00 -1.18 0.00 0.00 179.01 178.64 1up6 h ALA 407 N 0.82 1.26 -0.53 2.92 0.00 -1.11 -2.90 119.26 119.73 1up6 h ALA 407 Ca 0.09 -0.26 0.00 0.00 0.00 0.00 0.00 54.91 54.74 1up6 h ALA 407 Cb 0.63 -0.13 0.00 0.00 0.00 0.00 0.00 17.79 18.28 1up6 h ALA 407 CO 0.04 0.49 0.00 0.09 0.00 0.00 0.00 179.25 179.87 1up6 n ASN 408 N -4.21 4.80 0.30 0.00 3.02 -0.50 -4.67 115.26 114.00 1up6 n ASN 408 Ca 0.01 -2.65 0.19 0.00 -0.03 0.00 0.00 54.58 52.09 1up6 n ASN 408 Cb 0.31 -0.62 1.01 0.00 -0.61 0.00 0.00 39.78 39.87 1up6 n ASN 408 CO 0.00 0.00 0.00 0.08 -2.62 0.00 0.00 177.26 174.72 1up6 h ARG 409 N 3.52 0.00 0.00 3.52 0.11 -1.09 0.10 114.38 120.55 1up6 h ARG 409 Ca 0.00 0.00 0.00 0.00 0.10 0.00 0.00 59.98 60.08 1up6 h ARG 409 Cb 1.61 0.00 0.00 0.00 1.11 0.00 0.00 29.97 32.69 1up6 h ARG 409 CO 0.35 0.00 0.00 0.39 0.10 0.00 0.00 179.97 180.81 1up6 n GLU 410 N -3.34 0.17 -0.02 0.08 1.02 -1.26 -4.27 120.64 113.02 1up6 n GLU 410 Ca -0.02 0.15 -0.02 0.00 -0.02 0.00 0.00 57.16 57.25 1up6 n GLU 410 Cb 0.19 -1.70 -0.05 0.00 -0.02 0.00 0.00 31.44 29.86 1up6 n GLU 410 CO 0.00 0.00 0.00 0.66 1.18 0.00 0.00 177.13 178.97 1up6 n TYR 411 N -2.01 0.00 -3.62 -0.32 4.02 0.30 -5.05 117.16 110.48 1up6 n TYR 411 Ca 0.06 0.00 -0.16 0.00 -0.01 0.00 0.00 57.90 57.79 1up6 n TYR 411 Cb 0.40 -0.27 -0.07 0.00 -0.02 0.00 0.00 39.34 39.38 1up6 n TYR 411 CO 0.00 0.00 0.00 0.54 -1.01 0.00 0.00 176.86 176.39 1up6 s VAL 412 N -2.20 0.02 -0.05 -0.72 0.11 -0.91 -4.82 120.40 111.83 1up6 s VAL 412 Ca -0.03 -0.20 0.02 0.00 -2.93 0.00 0.00 61.98 58.85 1up6 s VAL 412 Cb 0.02 -0.85 0.01 0.00 -1.53 0.00 0.00 36.38 34.04 1up6 s VAL 412 CO 0.25 -0.11 -0.09 -0.75 -3.33 0.00 0.00 175.10 171.07 1up6 s LYS 413 N -1.27 1.24 0.01 1.54 2.20 -1.26 -4.41 119.74 117.79 1up6 s LYS 413 Ca -0.12 -0.30 0.08 0.00 -0.36 0.00 0.00 55.97 55.26 1up6 s LYS 413 Cb -0.02 -1.10 -0.02 0.00 -1.51 0.00 0.00 37.83 35.18 1up6 s LYS 413 CO 0.07 0.03 -0.23 -0.51 -0.36 0.00 0.00 175.35 174.36 1up6 s LEU 414 N 0.56 2.10 0.00 5.43 1.02 -1.26 -4.84 118.68 121.69 1up6 s LEU 414 Ca -0.10 -0.48 0.00 0.00 0.02 0.00 0.00 54.13 53.57 1up6 s LEU 414 Cb -0.13 -1.16 0.00 0.00 0.02 0.00 0.00 46.19 44.92 1up6 s LEU 414 CO 0.02 0.25 0.30 0.61 0.02 0.00 0.00 176.35 177.54