#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1mio n GLU 3 N 0.00 0.23 -0.52 1.43 2.13 -1.26 -5.00 120.64 117.65 1mio n GLU 3 Ca 0.00 -1.12 -0.04 0.00 0.66 0.00 0.00 57.16 56.66 1mio n GLU 3 Cb 0.00 -0.34 0.14 0.00 0.27 0.00 0.00 31.44 31.51 1mio n GLU 3 CO 0.00 0.00 0.00 0.09 -0.41 0.00 0.00 177.13 176.81 1mio n ASN 4 N 2.56 3.33 -0.03 4.31 4.13 -1.26 -3.74 115.26 124.57 1mio n ASN 4 Ca 0.12 -2.62 -0.13 0.00 1.68 0.00 0.00 54.58 53.63 1mio n ASN 4 Cb 0.63 -0.63 -0.09 0.00 -1.54 0.00 0.00 39.78 38.15 1mio n ASN 4 CO 0.00 0.00 0.00 0.25 0.28 0.00 0.00 177.26 177.79 1mio h LEU 5 N 1.46 0.14 -0.26 3.41 5.85 -1.97 0.23 115.31 124.17 1mio h LEU 5 Ca 0.16 -0.49 0.06 0.00 0.84 0.00 0.00 57.88 58.44 1mio h LEU 5 Cb 1.57 -0.04 -0.06 0.00 0.37 0.00 0.00 40.66 42.50 1mio h LEU 5 CO 0.39 0.60 -0.12 0.50 -0.34 0.00 0.00 178.44 179.48 1mio h LYS 6 N -0.33 -0.08 -0.70 1.25 3.11 -1.98 0.12 116.57 117.97 1mio h LYS 6 Ca 0.01 0.01 -0.01 0.00 -2.81 0.00 0.00 60.65 57.84 1mio h LYS 6 Cb 0.57 0.02 -0.03 0.00 -1.00 0.00 0.00 32.23 31.78 1mio h LYS 6 CO 0.01 -0.05 0.38 -0.44 -2.81 0.00 0.00 179.45 176.54 1mio h ASP 7 N -0.08 0.86 -0.56 4.20 5.19 -1.77 -2.04 116.42 122.22 1mio h ASP 7 Ca 0.14 -0.07 -0.09 0.00 -0.62 0.00 0.00 57.03 56.39 1mio h ASP 7 Cb 0.28 -0.22 -0.02 0.00 0.18 0.00 0.00 39.33 39.55 1mio h ASP 7 CO -0.31 0.70 0.01 -0.08 -3.12 0.00 0.00 179.24 176.44 1mio h GLU 8 N 0.97 0.99 0.23 3.56 4.22 0.10 -1.55 114.58 123.11 1mio h GLU 8 Ca 0.25 -0.31 -0.01 0.00 0.08 0.00 0.00 59.36 59.36 1mio h GLU 8 Cb 0.03 -0.09 0.00 0.00 0.50 0.00 0.00 28.75 29.19 1mio h GLU 8 CO -0.04 0.98 -0.11 0.82 -2.18 0.00 0.00 179.01 178.48 1mio h ILE 9 N 0.88 0.80 -0.90 2.32 2.04 -0.50 -3.26 117.51 118.89 1mio h ILE 9 Ca 0.16 -0.18 0.02 0.00 1.00 0.00 0.00 64.86 65.86 1mio h ILE 9 Cb 0.53 0.91 -0.05 0.00 -0.74 0.00 0.00 36.82 37.47 1mio h ILE 9 CO 0.03 0.04 0.59 -0.07 0.00 0.00 0.00 178.15 178.74 1mio h LEU 10 N -0.40 1.01 -2.06 1.44 3.38 -1.27 -3.35 115.31 114.06 1mio h LEU 10 Ca -0.03 -0.02 0.09 0.00 0.09 0.00 0.00 57.88 58.01 1mio h LEU 10 Cb 0.31 -0.25 -0.01 0.00 0.09 0.00 0.00 40.66 40.80 1mio h LEU 10 CO 0.05 0.72 0.24 -0.33 0.09 0.00 0.00 178.44 179.22 1mio h GLU 11 N 1.19 0.00 -4.72 1.13 4.39 -1.32 -3.13 114.58 112.12 1mio h GLU 11 Ca 0.34 0.00 -0.70 0.00 0.34 0.00 0.00 59.36 59.33 1mio h GLU 11 Cb -0.10 0.00 -0.20 0.00 -0.10 0.00 0.00 28.75 28.35 1mio h GLU 11 CO -0.08 0.00 0.29 0.21 -1.16 0.00 0.00 179.01 178.27 1mio s LYS 12 N -4.93 3.22 -0.29 2.33 2.20 -1.26 -4.93 119.74 116.09 1mio s LYS 12 Ca -0.05 -1.50 -0.16 0.00 -0.36 0.00 0.00 55.97 53.90 1mio s LYS 12 Cb 0.18 -4.41 0.15 0.00 -1.51 0.00 0.00 37.83 32.24 1mio s LYS 12 CO 0.67 -1.58 0.99 0.71 -0.36 0.00 0.00 175.35 175.77 1mio s TYR 13 N 2.51 -0.56 0.24 4.03 2.02 -1.19 -5.05 117.35 119.36 1mio s TYR 13 Ca 0.17 1.10 -0.31 0.00 -0.37 0.00 0.00 57.07 57.66 1mio s TYR 13 Cb -0.18 0.33 -0.12 0.00 -0.40 0.00 0.00 41.96 41.60 1mio s TYR 13 CO 0.02 -0.28 1.67 -1.50 -1.57 0.00 0.00 175.55 173.89 1mio s ILE 14 N 1.42 2.04 0.25 2.71 1.10 -1.26 -4.46 121.20 123.00 1mio s ILE 14 Ca -0.08 0.03 0.17 0.00 -0.51 0.00 0.00 60.65 60.25 1mio s ILE 14 Cb -0.04 -3.02 0.11 0.00 0.15 0.00 0.00 42.46 39.66 1mio s ILE 14 CO -0.15 0.00 1.76 1.55 -2.11 0.00 0.00 174.94 176.00 1mio h PRO 15 N 5.98 0.00 -0.47 3.50 0.13 -1.98 0.71 132.00 139.87 1mio h PRO 15 Ca -0.45 0.00 0.05 0.00 -0.87 0.00 0.00 66.00 64.74 1mio h PRO 15 Cb 1.21 0.00 -0.03 0.00 0.13 0.00 0.00 31.00 32.31 1mio h PRO 15 CO 0.89 0.40 0.31 1.57 -0.23 0.00 0.00 178.00 180.94 1mio h LYS 16 N 0.00 0.41 0.03 0.86 -0.00 -2.00 -1.24 116.57 114.62 1mio h LYS 16 Ca -0.00 -0.02 -0.25 0.00 -0.00 0.00 0.00 60.65 60.37 1mio h LYS 16 Cb 0.83 -0.09 0.01 0.00 -0.00 0.00 0.00 32.23 32.98 1mio h LYS 16 CO 0.05 0.27 -1.04 1.15 -0.00 0.00 0.00 179.45 179.88 1mio h THR 17 N 0.42 1.35 -0.02 0.07 2.02 0.09 -3.30 112.91 113.53 1mio h THR 17 Ca 0.20 -2.43 -0.07 0.00 0.77 0.00 0.00 66.41 64.88 1mio h THR 17 Cb 0.26 2.49 -0.01 0.00 -1.74 0.00 0.00 68.15 69.14 1mio h THR 17 CO -0.05 0.73 -0.31 0.50 0.37 0.00 0.00 175.52 176.76 1mio h LYS 18 N 0.28 0.04 0.00 6.66 3.64 -0.55 -1.20 116.57 125.44 1mio h LYS 18 Ca -0.11 -0.01 -0.02 0.00 -1.27 0.00 0.00 60.65 59.24 1mio h LYS 18 Cb 1.69 -0.00 -0.00 0.00 -0.41 0.00 0.00 32.23 33.51 1mio h LYS 18 CO 0.19 0.35 -0.08 0.87 -2.27 0.00 0.00 179.45 178.52 1mio h LYS 19 N 0.04 0.00 0.00 1.90 6.56 -1.43 -2.37 116.57 121.27 1mio h LYS 19 Ca 0.00 0.00 -0.29 0.00 -1.06 0.00 0.00 60.65 59.30 1mio h LYS 19 Cb 0.57 0.00 -0.05 0.00 -0.57 0.00 0.00 32.23 32.18 1mio h LYS 19 CO 0.04 0.08 -1.69 1.79 -2.06 0.00 0.00 179.45 177.61 1mio h THR 20 N 0.00 0.87 -0.01 -0.16 1.35 -1.35 -3.39 112.91 110.22 1mio h THR 20 Ca -0.00 -2.72 -0.20 0.00 -0.55 0.00 0.00 66.41 62.94 1mio h THR 20 Cb 0.80 2.44 -0.01 0.00 -1.73 0.00 0.00 68.15 69.65 1mio h THR 20 CO 0.01 0.52 -0.87 0.03 -0.25 0.00 0.00 175.52 174.96 1mio h ARG 21 N 0.00 0.30 0.00 4.72 2.47 -1.24 -3.28 114.38 117.36 1mio h ARG 21 Ca -0.28 -0.31 0.03 0.00 -1.26 0.00 0.00 59.98 58.16 1mio h ARG 21 Cb 2.01 0.09 -0.04 0.00 -1.65 0.00 0.00 29.97 30.37 1mio h ARG 21 CO 0.08 1.00 -0.22 0.66 0.56 0.00 0.00 179.97 182.06 1mio h SER 22 N 0.18 -0.64 0.00 7.04 4.64 -1.62 -2.40 113.55 120.75 1mio h SER 22 Ca -0.05 0.09 0.00 0.00 -0.47 0.00 0.00 61.79 61.35 1mio h SER 22 Cb 1.49 0.26 0.00 0.00 -0.31 0.00 0.00 62.40 63.84 1mio h SER 22 CO 0.14 -0.29 0.38 1.23 -0.87 0.00 0.00 176.83 177.42 1mio h GLY 23 N -0.35 0.00 1.46 -0.77 0.00 -1.80 -0.70 103.07 100.93 1mio h GLY 23 Ca 0.06 0.00 -0.18 0.00 0.00 0.00 0.00 47.33 47.21 1mio h GLY 23 CO -0.20 0.00 -1.13 0.45 0.00 0.00 0.00 176.54 175.67 1mio h HIS 24 N 0.00 0.00 -3.30 5.60 -0.00 -1.60 0.18 115.15 116.03 1mio h HIS 24 Ca 0.00 0.00 -0.66 0.00 -0.00 0.00 0.00 60.37 59.71 1mio h HIS 24 Cb 0.75 0.00 -0.16 0.00 -0.00 0.00 0.00 27.41 28.00 1mio h HIS 24 CO 0.00 0.71 -0.62 0.42 -0.00 0.00 0.00 177.93 178.44 1mio s ILE 25 N -2.84 4.32 0.17 2.45 1.01 -0.27 -1.15 121.20 124.89 1mio s ILE 25 Ca -0.00 -0.23 -0.02 0.00 0.00 0.00 0.00 60.65 60.40 1mio s ILE 25 Cb 0.08 -2.85 -0.04 0.00 0.01 0.00 0.00 42.46 39.66 1mio s ILE 25 CO 0.80 0.56 0.12 0.68 0.00 0.00 0.00 174.94 177.10 1mio s VAL 26 N -0.44 0.05 -0.06 2.92 -7.23 -0.26 -4.92 120.40 110.44 1mio s VAL 26 Ca 0.08 -1.90 0.02 0.00 -1.81 0.00 0.00 61.98 58.38 1mio s VAL 26 Cb -0.12 -2.25 0.01 0.00 0.56 0.00 0.00 36.38 34.58 1mio s VAL 26 CO 0.02 -0.21 -0.11 -0.63 -0.31 0.00 0.00 175.10 173.85 1mio s ILE 27 N -4.09 1.07 -0.16 -0.62 1.01 -1.26 -1.25 121.20 115.90 1mio s ILE 27 Ca 0.31 -0.44 -0.13 0.00 0.00 0.00 0.00 60.65 60.39 1mio s ILE 27 Cb 0.07 -0.98 -0.05 0.00 0.01 0.00 0.00 42.46 41.50 1mio s ILE 27 CO 0.07 0.34 0.25 -0.75 0.00 0.00 0.00 174.94 174.85 1mio s LYS 28 N 0.70 4.18 -0.32 2.79 2.36 -1.07 -4.69 119.74 123.69 1mio s LYS 28 Ca -0.14 0.02 0.03 0.00 -2.55 0.00 0.00 55.97 53.33 1mio s LYS 28 Cb -0.16 -3.40 0.19 0.00 -1.05 0.00 0.00 37.83 33.42 1mio s LYS 28 CO 0.03 0.30 0.68 0.99 1.55 0.00 0.00 175.35 178.91 1mio s THR 29 N 0.29 -0.86 0.00 3.43 2.01 0.52 0.85 115.64 121.87 1mio s THR 29 Ca 0.15 0.00 0.00 0.00 0.31 0.00 0.00 61.69 62.15 1mio s THR 29 Cb -0.13 -0.65 0.00 0.00 0.01 0.00 0.00 72.50 71.74 1mio s THR 29 CO 0.03 0.00 0.00 -0.62 -0.69 0.00 0.00 174.62 173.34 1mio n GLU 30 N 5.10 0.00 -0.16 4.92 -0.58 -1.26 0.01 120.64 128.67 1mio n GLU 30 Ca 0.07 0.00 -0.09 0.00 -0.42 0.00 0.00 57.16 56.72 1mio n GLU 30 Cb 0.56 0.00 0.00 0.00 -0.57 0.00 0.00 31.44 31.43 1mio n GLU 30 CO 0.00 0.00 0.00 0.93 -0.48 0.00 0.00 177.13 177.58 1mio h GLU 31 N 0.00 0.69 -2.91 3.49 3.07 -2.02 -3.29 114.58 113.61 1mio h GLU 31 Ca 0.00 -0.12 -0.70 0.00 -0.50 0.00 0.00 59.36 58.04 1mio h GLU 31 Cb 0.00 -0.11 -0.36 0.00 -0.84 0.00 0.00 28.75 27.44 1mio h GLU 31 CO 0.00 0.62 -0.04 0.25 -1.40 0.00 0.00 179.01 178.44 1mio n THR 32 N -4.59 3.33 -2.06 1.13 -2.24 0.10 -5.05 114.28 104.89 1mio n THR 32 Ca 0.01 -5.33 -0.41 0.00 -2.27 0.00 0.00 64.05 56.06 1mio n THR 32 Cb 0.15 -2.23 -0.02 0.00 -2.10 0.00 0.00 70.33 66.13 1mio n THR 32 CO 0.00 0.00 0.00 -2.84 -0.57 0.00 0.00 175.07 171.66 1mio s PRO 33 N -2.01 4.31 -0.97 -0.78 0.02 -1.24 -0.36 135.00 133.97 1mio s PRO 33 Ca 0.32 2.28 -0.12 0.00 0.02 0.00 0.00 61.00 63.49 1mio s PRO 33 Cb 0.02 -3.06 -0.00 0.00 0.02 0.00 0.00 34.50 31.48 1mio s PRO 33 CO -0.04 -0.25 0.71 0.09 -0.33 0.00 0.00 177.00 177.18 1mio n ASN 34 N 0.84 -5.62 -4.74 2.53 4.13 -1.26 -4.92 115.26 106.22 1mio n ASN 34 Ca 0.01 -0.83 -0.31 0.00 1.68 0.00 0.00 54.58 55.12 1mio n ASN 34 Cb 0.41 -3.16 0.11 0.00 -1.54 0.00 0.00 39.78 35.60 1mio n ASN 34 CO 0.00 0.00 0.00 -2.16 0.28 0.00 0.00 177.26 175.38 1mio s PRO 35 N -5.19 1.96 0.53 3.52 0.04 -1.26 -5.03 135.00 129.57 1mio s PRO 35 Ca 0.25 1.34 -0.19 0.00 0.04 0.00 0.00 61.00 62.44 1mio s PRO 35 Cb -0.10 -1.85 -0.06 0.00 0.04 0.00 0.00 34.50 32.53 1mio s PRO 35 CO 0.86 -1.90 1.10 -1.21 0.04 0.00 0.00 177.00 175.89 1mio s GLU 36 N -4.68 3.46 -0.00 4.56 2.02 -1.26 -4.96 118.70 117.83 1mio s GLU 36 Ca 0.64 1.50 0.03 0.00 0.02 0.00 0.00 54.97 57.16 1mio s GLU 36 Cb -0.20 -2.03 -0.01 0.00 0.10 0.00 0.00 34.13 31.99 1mio s GLU 36 CO 0.54 -0.74 -0.09 -1.50 0.02 0.00 0.00 175.26 173.50 1mio s ILE 37 N -1.90 0.67 -0.16 -1.63 2.07 -1.26 -4.91 121.20 114.08 1mio s ILE 37 Ca 0.70 -0.39 -0.17 0.00 -1.41 0.00 0.00 60.65 59.39 1mio s ILE 37 Cb -0.21 -0.57 -0.04 0.00 0.13 0.00 0.00 42.46 41.77 1mio s ILE 37 CO 0.26 0.17 0.42 0.68 -1.91 0.00 0.00 174.94 174.57 1mio s VAL 38 N -0.23 5.21 0.25 4.00 -7.23 0.62 -4.88 120.40 118.14 1mio s VAL 38 Ca 0.03 0.81 0.05 0.00 -1.81 0.00 0.00 61.98 61.06 1mio s VAL 38 Cb -0.03 -3.76 -0.05 0.00 0.56 0.00 0.00 36.38 33.09 1mio s VAL 38 CO -0.00 0.30 -0.04 0.00 -0.31 0.00 0.00 175.10 175.06 1mio s ALA 39 N 0.87 2.05 -1.56 1.32 0.00 -1.26 -4.39 121.76 118.79 1mio s ALA 39 Ca 0.22 -1.82 -0.10 0.00 0.00 0.00 0.00 51.96 50.26 1mio s ALA 39 Cb -0.15 0.32 0.08 0.00 0.00 0.00 0.00 23.12 23.37 1mio s ALA 39 CO 0.08 -0.15 0.64 -1.71 0.00 0.00 0.00 175.76 174.62 1mio n ASN 40 N -0.49 -2.15 -4.92 0.00 4.05 -1.15 -4.78 115.26 105.83 1mio n ASN 40 Ca -0.06 -0.99 -0.26 0.00 0.45 0.00 0.00 54.58 53.72 1mio n ASN 40 Cb 0.63 -3.00 0.00 0.00 1.23 0.00 0.00 39.78 38.65 1mio n ASN 40 CO 0.00 0.00 0.00 0.42 -3.05 0.00 0.00 177.26 174.63 1mio s THR 41 N -3.59 4.66 0.64 -0.44 -4.23 -1.26 -4.42 115.64 107.00 1mio s THR 41 Ca 0.41 0.02 -0.12 0.00 -1.18 0.00 0.00 61.69 60.82 1mio s THR 41 Cb -0.22 -3.77 -0.02 0.00 1.34 0.00 0.00 72.50 69.83 1mio s THR 41 CO 0.90 -0.71 1.04 0.00 -0.54 0.00 0.00 174.62 175.32 1mio s ARG 42 N -4.71 3.30 -0.05 3.99 1.70 -1.25 -4.90 118.95 117.03 1mio s ARG 42 Ca 0.47 0.91 -0.22 0.00 -0.47 0.00 0.00 55.73 56.43 1mio s ARG 42 Cb -0.10 -2.04 -0.04 0.00 -0.57 0.00 0.00 34.95 32.20 1mio s ARG 42 CO 0.43 -0.81 0.63 0.99 -1.08 0.00 0.00 175.30 175.47 1mio s THR 43 N -2.98 5.01 0.14 4.99 2.01 -1.26 -5.01 115.64 118.52 1mio s THR 43 Ca 0.58 1.31 -0.31 0.00 0.31 0.00 0.00 61.69 63.58 1mio s THR 43 Cb -0.13 -3.97 -0.09 0.00 0.01 0.00 0.00 72.50 68.32 1mio s THR 43 CO 0.50 0.32 1.55 -0.69 -0.69 0.00 0.00 174.62 175.62 1mio s VAL 44 N 0.41 2.83 0.16 3.82 1.01 -1.26 -5.00 120.40 122.38 1mio s VAL 44 Ca 0.34 0.55 -0.30 0.00 0.00 0.00 0.00 61.98 62.56 1mio s VAL 44 Cb -0.18 -3.35 -0.08 0.00 0.00 0.00 0.00 36.38 32.77 1mio s VAL 44 CO 0.17 0.03 1.26 -2.84 0.00 0.00 0.00 175.10 173.72 1mio s PRO 45 N 1.43 4.43 -0.50 2.72 0.02 -1.26 -4.01 135.00 137.84 1mio s PRO 45 Ca 0.70 1.94 -0.01 0.00 0.02 0.00 0.00 61.00 63.64 1mio s PRO 45 Cb -0.42 -3.24 0.00 0.00 0.02 0.00 0.00 34.50 30.86 1mio s PRO 45 CO 0.31 -0.21 0.42 0.41 -0.33 0.00 0.00 177.00 177.61 1mio n GLY 46 N 2.55 0.21 2.94 0.52 0.00 -1.26 -5.05 105.19 105.10 1mio n GLY 46 Ca 0.06 -0.27 -0.16 0.00 0.00 0.00 0.00 46.02 45.65 1mio n GLY 46 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1mio s ILE 47 N -3.14 0.39 -0.72 -0.61 1.01 -1.26 -5.07 121.20 111.80 1mio s ILE 47 Ca 0.08 -0.18 -0.26 0.00 0.00 0.00 0.00 60.65 60.29 1mio s ILE 47 Cb -0.04 -0.34 -0.01 0.00 0.01 0.00 0.00 42.46 42.08 1mio s ILE 47 CO 0.29 0.12 1.72 -0.63 0.00 0.00 0.00 174.94 176.44 1mio s ILE 48 N 0.04 3.49 0.06 2.92 -1.09 -1.26 -4.93 121.20 120.42 1mio s ILE 48 Ca 0.00 0.07 0.04 0.00 -2.23 0.00 0.00 60.65 58.54 1mio s ILE 48 Cb -0.04 -4.24 -0.04 0.00 -1.58 0.00 0.00 42.46 36.57 1mio s ILE 48 CO -0.00 -1.19 -0.02 0.28 -1.23 0.00 0.00 174.94 172.78 1mio s THR 49 N 8.27 3.92 -2.11 2.92 -1.32 -1.26 -2.47 115.64 123.57 1mio s THR 49 Ca 0.59 -0.91 0.31 0.00 -1.21 0.00 0.00 61.69 60.47 1mio s THR 49 Cb -0.10 -2.82 0.76 0.00 -1.51 0.00 0.00 72.50 68.84 1mio s THR 49 CO 0.13 0.21 2.05 0.00 -2.21 0.00 0.00 174.62 174.81 1mio n ALA 50 N 0.89 2.66 -1.78 11.08 0.00 -1.26 -4.97 120.51 127.12 1mio n ALA 50 Ca -0.12 -0.28 -0.34 0.00 0.00 0.00 0.00 53.44 52.70 1mio n ALA 50 Cb 0.52 -1.40 -0.02 0.00 0.00 0.00 0.00 19.45 18.55 1mio n ALA 50 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.50 178.53 1mio s ARG 51 N -2.05 3.68 0.00 0.00 0.52 -1.26 -5.06 118.95 114.78 1mio s ARG 51 Ca 0.43 1.40 0.00 0.00 -0.52 0.00 0.00 55.73 57.05 1mio s ARG 51 Cb 0.22 -2.07 0.00 0.00 0.52 0.00 0.00 34.95 33.61 1mio s ARG 51 CO 0.37 -0.54 0.00 0.41 0.02 0.00 0.00 175.30 175.56 1mio n GLY 52 N -0.21 2.26 3.47 -3.53 0.00 -1.26 -5.03 105.19 100.89 1mio n GLY 52 Ca 0.10 -1.90 -0.22 0.00 0.00 0.00 0.00 46.02 43.99 1mio n GLY 52 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1mio h ALA 54 N 2.04 0.68 -0.90 0.00 0.00 -1.67 -2.02 119.26 117.39 1mio h ALA 54 Ca -0.40 0.11 0.03 0.00 0.00 0.00 0.00 54.91 54.66 1mio h ALA 54 Cb 1.25 0.14 -0.05 0.00 0.00 0.00 0.00 17.79 19.13 1mio h ALA 54 CO 0.67 -0.28 0.59 -0.92 0.00 0.00 0.00 179.25 179.31 1mio h TYR 55 N 0.28 1.09 -0.93 0.00 5.03 -1.59 0.15 116.97 121.01 1mio h TYR 55 Ca 0.29 0.03 0.02 0.00 2.58 0.00 0.00 58.73 61.65 1mio h TYR 55 Cb 0.41 -0.37 -0.05 0.00 1.55 0.00 0.00 36.73 38.27 1mio h TYR 55 CO -0.22 0.64 0.61 0.00 -1.32 0.00 0.00 178.16 177.87 1mio h ALA 56 N 1.47 1.20 0.12 1.82 0.00 -1.69 -0.29 119.26 121.89 1mio h ALA 56 Ca 0.35 -0.06 -0.27 0.00 0.00 0.00 0.00 54.91 54.94 1mio h ALA 56 Cb 0.00 -0.36 0.01 0.00 0.00 0.00 0.00 17.79 17.44 1mio h ALA 56 CO -0.10 0.54 -1.22 0.78 0.00 0.00 0.00 179.25 179.25 1mio h GLY 57 N 1.23 0.36 0.00 0.00 0.00 -1.26 0.22 103.07 103.62 1mio h GLY 57 Ca 0.35 -0.88 0.00 0.00 0.00 0.00 0.00 47.33 46.80 1mio h GLY 57 CO -0.09 0.77 -0.20 0.00 0.00 0.00 0.00 176.54 177.02 1mio h LYS 59 N -0.74 -0.24 -0.16 0.00 3.11 -1.26 -2.52 116.57 114.76 1mio h LYS 59 Ca 0.00 0.02 -0.20 0.00 -2.81 0.00 0.00 60.65 57.66 1mio h LYS 59 Cb 0.20 0.05 0.01 0.00 -1.00 0.00 0.00 32.23 31.49 1mio h LYS 59 CO 0.00 0.16 -0.68 0.78 -2.81 0.00 0.00 179.45 176.91 1mio h GLY 60 N -0.78 0.81 0.00 5.01 0.00 -1.00 -2.21 103.07 104.90 1mio h GLY 60 Ca -0.03 -1.12 0.00 0.00 0.00 0.00 0.00 47.33 46.19 1mio h GLY 60 CO 0.04 1.00 -0.09 -2.08 0.00 0.00 0.00 176.54 175.41 1mio h VAL 61 N 0.45 0.00 0.00 4.60 2.07 -0.72 -3.40 116.25 119.25 1mio h VAL 61 Ca -0.04 -0.48 -0.01 0.00 0.82 0.00 0.00 66.70 66.99 1mio h VAL 61 Cb 1.31 0.00 -0.00 0.00 -1.52 0.00 0.00 31.29 31.08 1mio h VAL 61 CO 0.14 0.00 -0.06 0.58 0.02 0.00 0.00 177.57 178.25 1mio h VAL 62 N -0.48 0.54 -0.24 2.57 2.07 -1.55 -3.39 116.25 115.76 1mio h VAL 62 Ca 0.00 -1.42 -0.20 0.00 0.82 0.00 0.00 66.70 65.91 1mio h VAL 62 Cb 0.09 1.03 0.00 0.00 -1.52 0.00 0.00 31.29 30.89 1mio h VAL 62 CO 0.00 0.18 -0.62 0.24 0.02 0.00 0.00 177.57 177.39 1mio h MET 63 N -1.00 0.83 -0.69 1.57 2.07 -1.60 -3.36 114.93 112.74 1mio h MET 63 Ca -0.01 -0.57 0.08 0.00 -2.07 0.00 0.00 59.70 57.13 1mio h MET 63 Cb 0.35 0.08 -0.10 0.00 -1.87 0.00 0.00 31.60 30.07 1mio h MET 63 CO -0.01 1.20 -0.35 0.41 1.07 0.00 0.00 176.91 179.24 1mio n GLY 64 N 0.46 -1.63 0.33 8.32 0.00 -0.83 -1.58 105.19 110.26 1mio n GLY 64 Ca -0.05 0.80 0.18 0.00 0.00 0.00 0.00 46.02 46.95 1mio n GLY 64 CO 0.00 0.00 0.00 -2.55 0.00 0.00 0.00 173.32 170.77 1mio h PRO 65 N 0.00 0.00 -5.96 1.61 0.11 -1.75 -3.41 132.00 122.60 1mio h PRO 65 Ca 0.17 0.00 -0.50 0.00 0.11 0.00 0.00 66.00 65.78 1mio h PRO 65 Cb 0.34 0.00 -0.03 0.00 0.11 0.00 0.00 31.00 31.43 1mio h PRO 65 CO -0.67 0.00 1.39 0.42 -0.21 0.00 0.00 178.00 178.93 1mio s ILE 66 N -4.39 3.32 -1.41 4.15 1.01 -0.61 -4.09 121.20 119.17 1mio s ILE 66 Ca -0.05 0.21 0.14 0.00 0.00 0.00 0.00 60.65 60.95 1mio s ILE 66 Cb 0.13 -3.76 0.24 0.00 0.01 0.00 0.00 42.46 39.09 1mio s ILE 66 CO 0.45 -0.70 1.38 2.29 0.00 0.00 0.00 174.94 178.36 1mio n LYS 67 N 9.06 0.19 -1.30 2.79 2.85 -1.02 -3.62 118.16 127.11 1mio n LYS 67 Ca 0.23 0.16 -0.04 0.00 -1.05 0.00 0.00 58.31 57.61 1mio n LYS 67 Cb 0.52 -1.50 0.12 0.00 -0.65 0.00 0.00 35.03 33.52 1mio n LYS 67 CO 0.00 0.00 0.00 -0.40 -0.05 0.00 0.00 177.40 176.95 1mio n ASP 68 N -1.29 2.68 -4.53 -5.58 5.68 -1.26 -1.31 116.55 110.93 1mio n ASP 68 Ca 0.06 -3.54 -0.27 0.00 -0.50 0.00 0.00 54.79 50.55 1mio n ASP 68 Cb 0.11 -0.44 -0.10 0.00 -1.14 0.00 0.00 41.12 39.55 1mio n ASP 68 CO 0.00 0.00 0.00 -0.04 -1.33 0.00 0.00 177.20 175.83 1mio s MET 69 N -3.06 1.92 -0.23 0.11 -1.94 -1.24 -1.02 119.30 113.83 1mio s MET 69 Ca 0.41 -1.35 -0.16 0.00 -1.71 0.00 0.00 55.69 52.89 1mio s MET 69 Cb 0.38 -2.07 -0.04 0.00 2.01 0.00 0.00 34.83 35.11 1mio s MET 69 CO -0.04 0.42 0.40 0.08 -0.01 0.00 0.00 175.02 175.87 1mio s VAL 70 N -1.72 5.18 -0.41 -6.03 1.01 -1.19 -4.81 120.40 112.43 1mio s VAL 70 Ca 0.24 0.66 -0.11 0.00 0.00 0.00 0.00 61.98 62.78 1mio s VAL 70 Cb -0.08 -3.72 0.06 0.00 0.00 0.00 0.00 36.38 32.63 1mio s VAL 70 CO 0.14 0.20 0.26 -1.00 0.00 0.00 0.00 175.10 174.70 1mio s HIS 71 N 1.66 3.28 -0.22 5.22 3.76 -1.26 -0.03 115.29 127.70 1mio s HIS 71 Ca 0.18 -1.19 -0.06 0.00 -0.15 0.00 0.00 55.06 53.84 1mio s HIS 71 Cb -0.15 -2.76 -0.02 0.00 1.11 0.00 0.00 32.58 30.76 1mio s HIS 71 CO 0.09 -0.75 0.02 -1.50 -0.85 0.00 0.00 174.74 171.75 1mio s ILE 72 N 1.51 4.05 -0.23 0.60 2.07 0.32 -4.20 121.20 125.32 1mio s ILE 72 Ca 0.03 -0.27 -0.29 0.00 -1.41 0.00 0.00 60.65 58.71 1mio s ILE 72 Cb -0.22 -2.86 -0.03 0.00 0.13 0.00 0.00 42.46 39.49 1mio s ILE 72 CO 0.05 0.39 1.64 -0.89 -1.91 0.00 0.00 174.94 174.23 1mio s THR 73 N 1.28 3.66 -0.61 4.00 2.01 -1.15 -0.46 115.64 124.36 1mio s THR 73 Ca 0.04 0.73 -0.21 0.00 0.31 0.00 0.00 61.69 62.57 1mio s THR 73 Cb -0.15 -3.68 0.08 0.00 0.01 0.00 0.00 72.50 68.76 1mio s THR 73 CO 0.02 -0.30 0.81 -2.28 -0.69 0.00 0.00 174.62 172.19 1mio s HIS 74 N 5.36 2.86 -4.69 4.92 2.46 -1.26 -2.47 115.29 122.47 1mio s HIS 74 Ca 0.73 -0.68 0.00 0.00 0.47 0.00 0.00 55.06 55.58 1mio s HIS 74 Cb -0.25 -4.07 0.00 0.00 -0.13 0.00 0.00 32.58 28.13 1mio s HIS 74 CO 0.30 -1.41 0.00 0.41 -2.47 0.00 0.00 174.74 171.57 1mio n GLY 75 N 5.28 -1.53 3.71 1.59 0.00 -1.24 -2.27 105.19 110.73 1mio n GLY 75 Ca -0.06 -1.21 -0.31 0.00 0.00 0.00 0.00 46.02 44.44 1mio n GLY 75 CO 0.00 0.00 0.00 -4.14 0.00 0.00 0.00 173.32 169.18 1mio s PRO 76 N -1.89 1.46 0.37 1.61 0.02 -1.26 -1.49 135.00 133.82 1mio s PRO 76 Ca 0.00 1.17 0.05 0.00 0.02 0.00 0.00 61.00 62.24 1mio s PRO 76 Cb 0.00 -1.81 0.72 0.00 0.02 0.00 0.00 34.50 33.44 1mio s PRO 76 CO 0.00 -2.20 2.00 0.97 -0.33 0.00 0.00 177.00 177.44 1mio h ILE 77 N -1.54 1.15 -0.96 2.83 6.09 -1.91 -2.43 117.51 120.74 1mio h ILE 77 Ca -0.46 -0.37 0.03 0.00 -1.37 0.00 0.00 64.86 62.69 1mio h ILE 77 Cb 1.26 0.52 -0.05 0.00 0.47 0.00 0.00 36.82 39.02 1mio h ILE 77 CO 0.49 0.16 0.63 1.23 -3.07 0.00 0.00 178.15 177.59 1mio h GLY 78 N 0.72 1.40 1.99 8.18 0.00 -1.98 -0.87 103.07 112.51 1mio h GLY 78 Ca 0.17 -0.48 0.00 0.00 0.00 0.00 0.00 47.33 47.01 1mio h GLY 78 CO -0.03 0.43 0.00 0.00 0.00 0.00 0.00 176.54 176.94 1mio h SER 80 N 0.00 0.48 -0.37 0.00 0.87 -1.53 -3.37 113.55 109.63 1mio h SER 80 Ca 0.00 -0.89 -0.02 0.00 -1.23 0.00 0.00 61.79 59.65 1mio h SER 80 Cb 0.01 -0.15 -0.02 0.00 -0.44 0.00 0.00 62.40 61.79 1mio h SER 80 CO -0.00 1.70 0.16 0.15 -0.53 0.00 0.00 176.83 178.31 1mio h PHE 81 N -0.13 0.59 -0.01 2.24 3.57 -0.73 -2.80 116.94 119.68 1mio h PHE 81 Ca -0.33 -0.02 0.00 0.00 3.53 0.00 0.00 57.97 61.15 1mio h PHE 81 Cb 1.91 -0.19 0.00 0.00 2.79 0.00 0.00 35.95 40.46 1mio h PHE 81 CO 0.11 0.47 -0.01 0.66 -2.23 0.00 0.00 178.31 177.31 1mio n TYR 82 N -4.37 0.00 -1.42 0.41 4.01 -0.64 -2.24 117.16 112.90 1mio n TYR 82 Ca 0.03 0.00 -0.14 0.00 -0.16 0.00 0.00 57.90 57.63 1mio n TYR 82 Cb 0.15 -0.02 0.17 0.00 -0.31 0.00 0.00 39.34 39.33 1mio n TYR 82 CO 0.00 0.00 0.00 0.25 -0.46 0.00 0.00 176.86 176.65 1mio n THR 83 N -0.55 2.84 -3.40 -0.72 -2.24 -1.06 -4.71 114.28 104.43 1mio n THR 83 Ca 0.21 -2.64 -0.45 0.00 -2.27 0.00 0.00 64.05 58.90 1mio n THR 83 Cb 0.22 -0.49 -0.03 0.00 -2.10 0.00 0.00 70.33 67.93 1mio n THR 83 CO 0.00 0.00 0.00 0.86 -0.57 0.00 0.00 175.07 175.36 1mio s TRP 84 N -3.34 3.79 0.00 4.78 -0.00 -0.95 -4.73 118.94 118.48 1mio s TRP 84 Ca 0.50 -2.26 0.00 0.00 -0.00 0.00 0.00 56.10 54.35 1mio s TRP 84 Cb 0.44 -3.70 0.00 0.00 -0.00 0.00 0.00 33.47 30.21 1mio s TRP 84 CO 0.03 -0.95 0.00 0.41 -0.00 0.00 0.00 176.95 176.44 1mio n GLY 85 N 3.62 0.59 0.14 5.86 0.00 -1.26 -4.91 105.19 109.22 1mio n GLY 85 Ca 0.15 0.00 -0.09 0.00 0.00 0.00 0.00 46.02 46.08 1mio n GLY 85 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 1mio h GLY 86 N 0.00 0.27 -6.05 -0.02 0.00 -1.85 -3.43 103.07 91.99 1mio h GLY 86 Ca 0.00 -0.43 -0.60 0.00 0.00 0.00 0.00 47.33 46.30 1mio h GLY 86 CO 0.00 0.38 0.36 -1.60 0.00 0.00 0.00 176.54 175.69 1mio s ARG 87 N -3.34 4.13 -0.35 4.80 3.00 -1.26 -4.97 118.95 120.96 1mio s ARG 87 Ca -0.04 0.77 -0.03 0.00 -1.00 0.00 0.00 55.73 55.44 1mio s ARG 87 Cb 0.10 -3.66 0.08 0.00 0.00 0.00 0.00 34.95 31.48 1mio s ARG 87 CO 0.83 -0.50 2.56 0.54 0.00 0.00 0.00 175.30 178.73 1mio n ARG 88 N 5.93 2.11 -2.36 5.12 1.74 -1.26 -4.91 116.66 123.04 1mio n ARG 88 Ca 0.03 -1.88 -0.43 0.00 -0.77 0.00 0.00 57.85 54.80 1mio n ARG 88 Cb 0.48 -1.91 -0.02 0.00 -1.02 0.00 0.00 32.46 29.99 1mio n ARG 88 CO 0.00 0.00 0.00 -0.59 -1.52 0.00 0.00 177.63 175.52 1mio s PHE 89 N -1.46 2.43 0.11 -1.55 -0.12 -1.26 -1.58 117.98 114.55 1mio s PHE 89 Ca 0.48 0.68 -0.29 0.00 -0.05 0.00 0.00 56.93 57.75 1mio s PHE 89 Cb 0.32 -4.30 -0.06 0.00 -0.63 0.00 0.00 43.02 38.35 1mio s PHE 89 CO -0.12 -1.94 0.93 0.15 -0.05 0.00 0.00 175.22 174.19 1mio s LYS 90 N 4.89 4.68 0.29 1.99 -0.14 -0.63 -4.96 119.74 125.85 1mio s LYS 90 Ca 0.60 1.39 0.05 0.00 -1.36 0.00 0.00 55.97 56.65 1mio s LYS 90 Cb -0.13 -3.37 -0.06 0.00 -1.68 0.00 0.00 37.83 32.59 1mio s LYS 90 CO 0.32 0.25 -0.00 -1.12 -0.76 0.00 0.00 175.35 174.04 1mio s SER 91 N -0.11 2.40 -0.27 2.83 0.01 -1.26 -4.53 113.70 112.77 1mio s SER 91 Ca 0.45 -1.27 -0.22 0.00 1.31 0.00 0.00 55.95 56.23 1mio s SER 91 Cb -0.23 -0.10 0.07 0.00 0.21 0.00 0.00 66.02 65.98 1mio s SER 91 CO 0.29 -0.49 0.70 -1.59 0.41 0.00 0.00 173.24 172.56 1mio s LYS 92 N -3.82 0.79 0.23 12.44 0.00 -1.26 -5.12 119.74 122.99 1mio s LYS 92 Ca 0.32 1.07 -0.31 0.00 0.00 0.00 0.00 55.97 57.05 1mio s LYS 92 Cb 0.06 0.31 -0.14 0.00 0.00 0.00 0.00 37.83 38.06 1mio s LYS 92 CO 0.12 -0.12 1.29 -0.35 0.00 0.00 0.00 175.35 176.30 1mio n PRO 93 N 3.27 1.71 -1.77 1.78 -0.04 -1.26 -4.83 135.00 133.86 1mio n PRO 93 Ca -0.16 0.61 -0.43 0.00 -0.04 0.00 0.00 63.50 63.48 1mio n PRO 93 Cb 0.56 -2.19 -0.03 0.00 -0.04 0.00 0.00 33.50 31.81 1mio n PRO 93 CO 0.00 0.00 0.00 -2.00 -0.04 0.00 0.00 175.50 173.46 1mio s GLU 94 N -0.56 3.37 -1.52 0.54 2.56 -1.26 -3.13 118.70 118.71 1mio s GLU 94 Ca 0.68 1.91 -0.13 0.00 0.00 0.00 0.00 54.97 57.44 1mio s GLU 94 Cb -0.71 -4.27 0.08 0.00 2.00 0.00 0.00 34.13 31.23 1mio s GLU 94 CO 0.52 -1.82 0.96 0.09 -0.56 0.00 0.00 175.26 174.45 1mio n ASN 95 N 10.49 -4.55 0.00 -1.70 4.13 -1.26 -2.66 115.26 119.72 1mio n ASN 95 Ca 0.26 -0.78 0.00 0.00 1.68 0.00 0.00 54.58 55.73 1mio n ASN 95 Cb 0.45 -3.89 0.00 0.00 -1.54 0.00 0.00 39.78 34.80 1mio n ASN 95 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 1mio n GLY 96 N -1.69 2.18 3.48 7.41 0.00 -1.18 -4.73 105.19 110.65 1mio n GLY 96 Ca 0.02 -0.21 -0.43 0.00 0.00 0.00 0.00 46.02 45.40 1mio n GLY 96 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1mio s THR 97 N 0.00 4.24 -0.14 2.61 2.01 -1.24 -4.83 115.64 118.28 1mio s THR 97 Ca 0.00 -0.13 -0.10 0.00 0.31 0.00 0.00 61.69 61.78 1mio s THR 97 Cb 0.00 -4.70 0.05 0.00 0.01 0.00 0.00 72.50 67.86 1mio s THR 97 CO 0.00 -1.46 0.36 -0.83 -0.69 0.00 0.00 174.62 172.00 1mio s GLY 98 N 3.54 -0.27 0.45 4.40 0.00 -1.09 -4.69 107.32 109.66 1mio s GLY 98 Ca 0.26 1.24 -0.24 0.00 0.00 0.00 0.00 44.72 45.98 1mio s GLY 98 CO 0.13 1.31 1.23 1.08 0.00 0.00 0.00 173.10 176.85 1mio s LEU 99 N 0.94 4.08 -0.10 0.66 1.43 -1.26 -4.39 118.68 120.04 1mio s LEU 99 Ca -0.06 2.47 -0.04 0.00 -1.03 0.00 0.00 54.13 55.47 1mio s LEU 99 Cb -0.07 -4.11 0.05 0.00 0.03 0.00 0.00 46.19 42.09 1mio s LEU 99 CO -0.07 -0.95 0.20 0.21 0.23 0.00 0.00 176.35 175.97 1mio s ASN 100 N -1.09 0.41 -0.18 2.29 2.47 -1.25 -4.41 114.94 113.17 1mio s ASN 100 Ca 0.62 0.44 0.17 0.00 0.42 0.00 0.00 52.86 54.50 1mio s ASN 100 Cb -0.33 0.42 0.48 0.00 -1.45 0.00 0.00 41.25 40.36 1mio s ASN 100 CO 0.41 -0.22 1.37 0.49 -3.72 0.00 0.00 177.10 175.42 1mio n PHE 101 N 5.08 0.75 0.19 0.43 3.72 -0.43 -4.86 117.46 122.35 1mio n PHE 101 Ca -0.10 -0.97 0.18 0.00 -0.05 0.00 0.00 57.45 56.51 1mio n PHE 101 Cb 0.50 -0.29 0.82 0.00 -0.94 0.00 0.00 39.48 39.57 1mio n PHE 101 CO 0.00 0.00 0.00 -2.95 -0.05 0.00 0.00 176.76 173.76 1mio h ASN 102 N 1.34 0.00 -0.45 4.37 -1.07 -1.96 -2.97 115.58 114.84 1mio h ASN 102 Ca 0.02 0.00 0.00 0.00 0.07 0.00 0.00 56.30 56.39 1mio h ASN 102 Cb 1.37 0.00 0.00 0.00 -2.07 0.00 0.00 38.32 37.62 1mio h ASN 102 CO 0.19 0.00 0.00 -1.84 0.07 0.00 0.00 177.43 175.85 1mio n GLU 103 N -3.74 3.98 -4.33 4.14 0.28 -1.26 -4.79 120.64 114.92 1mio n GLU 103 Ca 0.02 -2.99 -0.24 0.00 -0.16 0.00 0.00 57.16 53.79 1mio n GLU 103 Cb 0.38 -2.04 -0.12 0.00 1.43 0.00 0.00 31.44 31.08 1mio n GLU 103 CO 0.00 0.00 0.00 0.71 -0.16 0.00 0.00 177.13 177.68 1mio s TYR 104 N -2.67 1.94 -0.16 -1.84 2.02 -1.12 -5.03 117.35 110.48 1mio s TYR 104 Ca 0.49 -0.42 -0.04 0.00 -0.37 0.00 0.00 57.07 56.73 1mio s TYR 104 Cb 0.37 -1.01 0.07 0.00 -0.40 0.00 0.00 41.96 40.99 1mio s TYR 104 CO 0.14 0.30 0.18 0.08 -1.57 0.00 0.00 175.55 174.68 1mio s VAL 105 N -1.51 -0.27 0.16 0.71 1.01 -1.26 -4.98 120.40 114.27 1mio s VAL 105 Ca 0.12 0.02 0.01 0.00 0.00 0.00 0.00 61.98 62.14 1mio s VAL 105 Cb -0.08 -0.55 -0.04 0.00 0.00 0.00 0.00 36.38 35.71 1mio s VAL 105 CO 0.06 -0.11 0.32 -0.36 0.00 0.00 0.00 175.10 175.00 1mio s PHE 106 N 2.29 3.49 -0.05 5.22 0.08 -1.26 -5.01 117.98 122.73 1mio s PHE 106 Ca 0.05 0.20 -0.29 0.00 0.12 0.00 0.00 56.93 57.00 1mio s PHE 106 Cb -0.15 -1.73 0.10 0.00 -0.57 0.00 0.00 43.02 40.67 1mio s PHE 106 CO -0.10 0.47 0.84 0.45 -0.10 0.00 0.00 175.22 176.78 1mio s SER 107 N -3.18 -0.46 -0.41 1.36 0.15 -1.26 -2.95 113.70 106.94 1mio s SER 107 Ca 0.36 0.31 -0.13 0.00 0.70 0.00 0.00 55.95 57.19 1mio s SER 107 Cb -0.11 0.42 0.04 0.00 -1.71 0.00 0.00 66.02 64.66 1mio s SER 107 CO 0.29 -0.57 0.28 0.42 1.20 0.00 0.00 173.24 174.85 1mio s THR 108 N -2.06 4.84 -0.31 6.45 -4.23 -1.03 -4.92 115.64 114.37 1mio s THR 108 Ca -0.02 -0.92 -0.26 0.00 -1.18 0.00 0.00 61.69 59.31 1mio s THR 108 Cb -0.01 -3.77 0.01 0.00 1.34 0.00 0.00 72.50 70.07 1mio s THR 108 CO -0.01 -0.36 0.90 1.51 -0.54 0.00 0.00 174.62 176.12 1mio s ASP 109 N 1.87 6.78 0.51 3.99 1.47 -1.26 -3.64 116.67 126.39 1mio s ASP 109 Ca 0.03 0.84 -0.20 0.00 1.18 0.00 0.00 52.55 54.41 1mio s ASP 109 Cb -0.21 -2.46 -0.07 0.00 -0.34 0.00 0.00 42.92 39.84 1mio s ASP 109 CO 0.07 -0.71 1.08 -0.32 0.68 0.00 0.00 175.17 175.97 1mio s MET 110 N 3.21 3.59 0.43 2.11 -2.45 -0.56 -4.94 119.30 120.70 1mio s MET 110 Ca 0.38 1.49 0.03 0.00 -1.25 0.00 0.00 55.69 56.34 1mio s MET 110 Cb -0.14 -2.06 -0.02 0.00 1.25 0.00 0.00 34.83 33.87 1mio s MET 110 CO 0.13 -0.63 0.11 -0.65 1.05 0.00 0.00 175.02 175.03 1mio s GLN 111 N -3.25 1.99 0.10 4.11 -1.52 -1.26 -4.53 119.66 115.30 1mio s GLN 111 Ca 0.70 -2.23 -0.17 0.00 -1.95 0.00 0.00 55.36 51.72 1mio s GLN 111 Cb -0.20 -0.75 -0.05 0.00 -0.22 0.00 0.00 33.01 31.79 1mio s GLN 111 CO 0.23 -0.47 1.55 1.49 -0.25 0.00 0.00 175.29 177.85 1mio h GLU 112 N 1.70 0.56 -0.01 2.91 4.57 -2.00 -2.55 114.58 119.76 1mio h GLU 112 Ca -0.36 -0.17 -0.12 0.00 -1.18 0.00 0.00 59.36 57.53 1mio h GLU 112 Cb 1.28 -0.05 -0.02 0.00 -0.16 0.00 0.00 28.75 29.80 1mio h GLU 112 CO 0.59 0.68 -0.55 0.66 -1.18 0.00 0.00 179.01 179.21 1mio h SER 113 N 0.37 0.02 -0.70 1.04 4.64 -1.98 -2.15 113.55 114.78 1mio h SER 113 Ca 0.09 -0.01 -0.07 0.00 -0.47 0.00 0.00 61.79 61.34 1mio h SER 113 Cb 0.42 -0.01 -0.03 0.00 -0.31 0.00 0.00 62.40 62.47 1mio h SER 113 CO 0.01 0.57 0.18 0.44 -0.87 0.00 0.00 176.83 177.16 1mio h ASP 114 N 0.01 1.06 -0.11 4.97 3.32 -1.84 0.40 116.42 124.23 1mio h ASP 114 Ca -0.01 -0.22 -0.03 0.00 0.02 0.00 0.00 57.03 56.79 1mio h ASP 114 Cb 0.98 -0.28 -0.00 0.00 0.22 0.00 0.00 39.33 40.25 1mio h ASP 114 CO 0.07 1.02 -0.06 0.40 -1.72 0.00 0.00 179.24 178.95 1mio h ILE 115 N 1.07 1.32 0.00 0.35 1.08 -0.98 1.40 117.51 121.75 1mio h ILE 115 Ca 0.22 -1.10 0.00 0.00 -0.39 0.00 0.00 64.86 63.59 1mio h ILE 115 Cb 0.36 1.82 0.00 0.00 -3.07 0.00 0.00 36.82 35.93 1mio h ILE 115 CO 0.00 0.31 0.00 1.33 -0.69 0.00 0.00 178.15 179.11 1mio n VAL 116 N -4.70 0.63 -0.48 1.67 0.24 -0.91 -3.58 118.33 111.20 1mio n VAL 116 Ca -0.06 -0.29 0.00 0.00 -2.04 0.00 0.00 64.34 61.95 1mio n VAL 116 Cb 0.28 -0.60 0.00 0.00 -1.47 0.00 0.00 33.84 32.05 1mio n VAL 116 CO 0.00 0.00 0.00 0.49 -2.14 0.00 0.00 176.83 175.18 1mio n PHE 117 N -2.30 0.00 -0.60 6.34 3.72 0.14 -5.08 117.46 119.67 1mio n PHE 117 Ca 0.05 -0.03 0.00 0.00 -0.05 0.00 0.00 57.45 57.42 1mio n PHE 117 Cb 0.43 -0.00 0.00 0.00 -0.94 0.00 0.00 39.48 38.97 1mio n PHE 117 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 1mio n GLY 118 N -0.03 -2.51 1.59 1.37 0.00 0.47 -4.77 105.19 101.31 1mio n GLY 118 Ca 0.00 -0.76 -0.04 0.00 0.00 0.00 0.00 46.02 45.21 1mio n GLY 118 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1mio n GLY 119 N 0.52 2.91 0.16 -0.02 0.00 -0.90 -4.11 105.19 103.75 1mio n GLY 119 Ca 0.00 -0.29 -0.04 0.00 0.00 0.00 0.00 46.02 45.69 1mio n GLY 119 CO 0.00 0.00 0.00 -0.24 0.00 0.00 0.00 173.32 173.08 1mio h VAL 120 N 0.97 1.40 0.00 1.61 3.04 -1.89 -2.59 116.25 118.79 1mio h VAL 120 Ca 0.08 -2.00 -0.11 0.00 -1.01 0.00 0.00 66.70 63.65 1mio h VAL 120 Cb 0.99 2.03 -0.02 0.00 -2.01 0.00 0.00 31.29 32.28 1mio h VAL 120 CO 0.20 0.59 -0.55 -1.13 -1.01 0.00 0.00 177.57 175.67 1mio h ASN 121 N 0.14 0.00 0.31 3.17 -0.00 -1.94 -2.53 115.58 114.73 1mio h ASN 121 Ca -0.01 0.00 -0.13 0.00 -0.00 0.00 0.00 56.30 56.17 1mio h ASN 121 Cb 1.10 0.00 -0.01 0.00 -0.00 0.00 0.00 38.32 39.41 1mio h ASN 121 CO 0.09 0.55 -0.52 0.11 -0.00 0.00 0.00 177.43 177.66 1mio h LYS 122 N 0.00 0.23 -0.29 6.67 1.57 -1.80 -2.45 116.57 120.51 1mio h LYS 122 Ca -0.01 -0.14 -0.10 0.00 -1.87 0.00 0.00 60.65 58.54 1mio h LYS 122 Cb 1.35 0.01 -0.01 0.00 0.08 0.00 0.00 32.23 33.66 1mio h LYS 122 CO 0.07 0.70 -0.20 1.25 -0.57 0.00 0.00 179.45 180.70 1mio h LEU 123 N 0.18 0.67 -0.29 2.94 5.85 -1.31 0.13 115.31 123.49 1mio h LEU 123 Ca 0.00 -0.44 0.06 0.00 0.84 0.00 0.00 57.88 58.35 1mio h LEU 123 Cb 0.98 -0.19 -0.07 0.00 0.37 0.00 0.00 40.66 41.76 1mio h LEU 123 CO 0.08 0.96 -0.15 0.50 -0.34 0.00 0.00 178.44 179.50 1mio h LYS 124 N 0.38 -0.11 -0.16 1.25 1.63 -1.31 -1.67 116.57 116.59 1mio h LYS 124 Ca 0.06 0.01 -0.14 0.00 -0.85 0.00 0.00 60.65 59.72 1mio h LYS 124 Cb 0.74 0.02 0.00 0.00 -0.60 0.00 0.00 32.23 32.40 1mio h LYS 124 CO 0.05 -0.07 -0.45 -0.44 -3.45 0.00 0.00 179.45 175.10 1mio h ASP 125 N -0.11 0.66 -0.74 4.20 3.32 -1.28 -3.19 116.42 119.28 1mio h ASP 125 Ca 0.15 -0.59 0.08 0.00 0.02 0.00 0.00 57.03 56.69 1mio h ASP 125 Cb 0.34 -0.19 -0.05 0.00 0.22 0.00 0.00 39.33 39.65 1mio h ASP 125 CO -0.36 1.14 0.49 0.00 -1.72 0.00 0.00 179.24 178.79 1mio h ALA 126 N 0.55 1.74 -0.89 3.45 0.00 -0.58 -2.61 119.26 120.91 1mio h ALA 126 Ca -0.01 -0.02 0.07 0.00 0.00 0.00 0.00 54.91 54.95 1mio h ALA 126 Cb 1.07 -0.18 -0.06 0.00 0.00 0.00 0.00 17.79 18.62 1mio h ALA 126 CO 0.10 0.13 0.58 0.82 0.00 0.00 0.00 179.25 180.87 1mio h ILE 127 N 0.73 1.05 -3.31 0.00 5.03 -1.29 -2.37 117.51 117.35 1mio h ILE 127 Ca 0.33 -0.34 -0.64 0.00 -0.12 0.00 0.00 64.86 64.09 1mio h ILE 127 Cb 0.34 -0.03 -0.41 0.00 -3.03 0.00 0.00 36.82 33.70 1mio h ILE 127 CO -0.12 0.18 -0.57 -1.38 -0.68 0.00 0.00 178.15 175.59 1mio s HIS 128 N -5.88 3.34 0.25 1.37 -3.43 -0.99 -1.99 115.29 107.97 1mio s HIS 128 Ca -0.11 -3.18 0.00 0.00 -0.80 0.00 0.00 55.06 50.97 1mio s HIS 128 Cb 0.20 -2.84 0.00 0.00 -1.43 0.00 0.00 32.58 28.51 1mio s HIS 128 CO 0.80 -0.69 0.00 -1.91 -2.00 0.00 0.00 174.74 170.93 1mio n GLU 129 N 2.78 0.00 -0.05 -0.38 2.13 -1.19 -4.78 120.64 119.15 1mio n GLU 129 Ca 0.10 0.00 -0.08 0.00 0.66 0.00 0.00 57.16 57.85 1mio n GLU 129 Cb 0.34 0.00 -0.01 0.00 0.27 0.00 0.00 31.44 32.03 1mio n GLU 129 CO 0.00 0.00 0.00 0.00 -0.41 0.00 0.00 177.13 176.72 1mio h ALA 130 N 0.00 0.01 -0.92 4.31 0.00 -1.40 0.17 119.26 121.42 1mio h ALA 130 Ca 0.00 0.09 0.01 0.00 0.00 0.00 0.00 54.91 55.01 1mio h ALA 130 Cb 0.00 0.38 -0.05 0.00 0.00 0.00 0.00 17.79 18.13 1mio h ALA 130 CO 0.00 -0.58 0.61 -0.92 0.00 0.00 0.00 179.25 178.35 1mio h TYR 131 N -0.16 1.17 0.01 0.00 3.20 -1.68 0.35 116.97 119.86 1mio h TYR 131 Ca 0.14 0.02 -0.00 0.00 3.14 0.00 0.00 58.73 62.03 1mio h TYR 131 Cb 0.37 -0.39 0.00 0.00 1.54 0.00 0.00 36.73 38.25 1mio h TYR 131 CO -0.34 0.74 -0.01 1.49 -1.64 0.00 0.00 178.16 178.40 1mio h GLU 132 N 1.25 -0.01 -0.09 1.82 4.81 -1.67 0.18 114.58 120.88 1mio h GLU 132 Ca 0.34 0.00 -0.03 0.00 -0.13 0.00 0.00 59.36 59.54 1mio h GLU 132 Cb -0.14 0.00 -0.00 0.00 0.63 0.00 0.00 28.75 29.24 1mio h GLU 132 CO -0.07 0.64 -0.06 0.52 -0.73 0.00 0.00 179.01 179.30 1mio h MET 133 N -0.68 0.20 0.00 1.92 2.86 -0.75 -3.40 114.93 115.08 1mio h MET 133 Ca -0.00 -0.10 -0.30 0.00 -2.06 0.00 0.00 59.70 57.24 1mio h MET 133 Cb 0.66 -0.00 -0.06 0.00 0.06 0.00 0.00 31.60 32.26 1mio h MET 133 CO 0.00 0.59 -2.15 1.19 1.06 0.00 0.00 176.91 177.61 1mio n PHE 134 N -4.71 0.00 -2.97 -0.22 3.72 0.12 -5.05 117.46 108.35 1mio n PHE 134 Ca -0.07 0.00 -0.11 0.00 -0.05 0.00 0.00 57.45 57.22 1mio n PHE 134 Cb 0.29 -0.80 0.01 0.00 -0.94 0.00 0.00 39.48 38.04 1mio n PHE 134 CO 0.00 0.00 0.00 0.72 -0.05 0.00 0.00 176.76 177.43 1mio n HIS 135 N -2.88 -3.17 -0.49 1.38 8.25 0.65 -5.01 115.22 113.95 1mio n HIS 135 Ca -0.32 1.32 -0.29 0.00 -0.26 0.00 0.00 57.72 58.17 1mio n HIS 135 Cb 0.95 -3.38 0.27 0.00 1.12 0.00 0.00 29.99 28.95 1mio n HIS 135 CO 0.00 0.00 0.00 -2.30 0.64 0.00 0.00 176.34 174.68 1mio n PRO 136 N 0.09 -4.20 -0.08 -0.41 -0.02 -1.26 -5.05 135.00 124.07 1mio n PRO 136 Ca 0.04 -1.49 -0.21 0.00 -2.02 0.00 0.00 63.50 59.82 1mio n PRO 136 Cb 0.40 -1.73 -0.12 0.00 -0.02 0.00 0.00 33.50 32.03 1mio n PRO 136 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1mio h ALA 137 N -3.29 0.25 -2.27 3.55 0.00 -1.46 -3.49 119.26 112.56 1mio h ALA 137 Ca -0.38 -1.15 -0.28 0.00 0.00 0.00 0.00 54.91 53.10 1mio h ALA 137 Cb 1.25 0.65 -0.15 0.00 0.00 0.00 0.00 17.79 19.54 1mio h ALA 137 CO 0.24 0.70 -0.68 0.00 0.00 0.00 0.00 179.25 179.51 1mio s ALA 138 N -2.38 1.27 0.04 0.00 0.00 -1.25 -4.19 121.76 115.25 1mio s ALA 138 Ca -0.27 -1.52 0.05 0.00 0.00 0.00 0.00 51.96 50.22 1mio s ALA 138 Cb 0.05 0.41 -0.03 0.00 0.00 0.00 0.00 23.12 23.54 1mio s ALA 138 CO 0.63 -0.28 -0.12 0.42 0.00 0.00 0.00 175.76 176.42 1mio s ILE 139 N -3.62 3.26 -0.03 0.00 1.01 -0.73 -3.17 121.20 117.93 1mio s ILE 139 Ca 0.20 -1.03 0.07 0.00 0.00 0.00 0.00 60.65 59.90 1mio s ILE 139 Cb 0.06 -2.43 -0.02 0.00 0.01 0.00 0.00 42.46 40.08 1mio s ILE 139 CO 0.02 0.32 -0.25 -0.83 0.00 0.00 0.00 174.94 174.19 1mio s GLY 140 N -1.58 1.29 -0.20 6.18 0.00 0.96 -0.32 107.32 113.64 1mio s GLY 140 Ca 0.17 -1.10 -0.04 0.00 0.00 0.00 0.00 44.72 43.75 1mio s GLY 140 CO 0.08 -0.88 -0.04 0.14 0.00 0.00 0.00 173.10 172.41 1mio s VAL 141 N -0.54 3.58 -0.72 1.40 1.01 -0.49 -0.52 120.40 124.11 1mio s VAL 141 Ca 0.08 -0.44 0.08 0.00 0.00 0.00 0.00 61.98 61.70 1mio s VAL 141 Cb -0.11 -2.61 0.23 0.00 0.00 0.00 0.00 36.38 33.90 1mio s VAL 141 CO -0.00 0.44 1.19 -1.22 0.00 0.00 0.00 175.10 175.50 1mio n TYR 142 N 4.38 0.35 -2.21 5.22 4.01 0.39 -0.90 117.16 128.39 1mio n TYR 142 Ca -0.18 -0.49 0.00 0.00 -0.16 0.00 0.00 57.90 57.07 1mio n TYR 142 Cb 0.51 -0.03 0.00 0.00 -0.31 0.00 0.00 39.34 39.51 1mio n TYR 142 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 1mio n ALA 143 N 0.28 -1.00 -2.55 -0.72 0.00 -1.24 -3.99 120.51 111.29 1mio n ALA 143 Ca 0.09 0.00 -0.18 0.00 0.00 0.00 0.00 53.44 53.35 1mio n ALA 143 Cb 0.38 -0.42 0.09 0.00 0.00 0.00 0.00 19.45 19.50 1mio n ALA 143 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.50 177.75 1mio n THR 144 N 2.14 0.00 -0.31 0.00 -2.24 -0.96 -2.11 114.28 110.79 1mio n THR 144 Ca 0.00 -1.21 -0.07 0.00 -2.27 0.00 0.00 64.05 60.50 1mio n THR 144 Cb 0.00 -0.99 -0.06 0.00 -2.10 0.00 0.00 70.33 67.17 1mio n THR 144 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1mio h PRO 146 N 0.00 0.00 -0.88 0.00 0.13 -1.95 -3.27 132.00 126.03 1mio h PRO 146 Ca 0.14 0.00 -0.02 0.00 -0.87 0.00 0.00 66.00 65.25 1mio h PRO 146 Cb 0.33 0.00 -0.04 0.00 0.13 0.00 0.00 31.00 31.41 1mio h PRO 146 CO -0.72 0.07 0.49 0.28 -0.23 0.00 0.00 178.00 177.89 1mio h VAL 147 N 0.00 1.25 0.24 1.56 2.07 -1.82 0.43 116.25 119.99 1mio h VAL 147 Ca -0.00 -0.62 -0.01 0.00 0.82 0.00 0.00 66.70 66.89 1mio h VAL 147 Cb 0.61 0.06 0.00 0.00 -1.52 0.00 0.00 31.29 30.44 1mio h VAL 147 CO 0.01 0.28 -0.12 1.23 0.02 0.00 0.00 177.57 179.00 1mio h GLY 148 N 1.24 -0.34 0.14 2.17 0.00 -1.72 -3.07 103.07 101.49 1mio h GLY 148 Ca 0.31 0.13 0.13 0.00 0.00 0.00 0.00 47.33 47.89 1mio h GLY 148 CO -0.05 -0.12 0.18 1.41 0.00 0.00 0.00 176.54 177.96 1mio h LEU 149 N -0.48 0.08 -0.03 3.11 4.07 -1.49 -3.12 115.31 117.44 1mio h LEU 149 Ca -0.03 0.12 0.00 0.00 0.08 0.00 0.00 57.88 58.04 1mio h LEU 149 Cb 0.36 0.14 0.00 0.00 1.08 0.00 0.00 40.66 42.24 1mio h LEU 149 CO 0.05 0.03 0.00 0.00 -1.08 0.00 0.00 178.44 177.44 1mio n ILE 150 N -5.10 0.37 -0.13 1.22 0.13 0.15 -4.94 119.36 111.05 1mio n ILE 150 Ca 0.11 -0.13 0.00 0.00 -1.10 0.00 0.00 62.75 61.63 1mio n ILE 150 Cb 0.36 -0.58 0.00 0.00 -0.84 0.00 0.00 39.64 38.58 1mio n ILE 150 CO 0.00 0.00 0.00 0.61 2.80 0.00 0.00 176.55 179.96 1mio n GLY 151 N 1.30 1.15 3.64 4.50 0.00 -1.16 -4.77 105.19 109.84 1mio n GLY 151 Ca 0.06 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.65 1mio n GLY 151 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1mio s ASP 152 N -2.92 6.52 -0.74 1.61 1.01 -1.23 -4.89 116.67 116.03 1mio s ASP 152 Ca 0.00 1.67 -0.18 0.00 0.71 0.00 0.00 52.55 54.74 1mio s ASP 152 Cb 0.00 -2.53 0.13 0.00 1.01 0.00 0.00 42.92 41.52 1mio s ASP 152 CO 0.00 -1.13 0.87 -0.62 0.21 0.00 0.00 175.17 174.49 1mio s ASP 153 N 3.67 6.41 0.52 0.27 2.15 -1.26 -4.80 116.67 123.64 1mio s ASP 153 Ca 0.68 -1.79 0.18 0.00 0.43 0.00 0.00 52.55 52.05 1mio s ASP 153 Cb -0.25 -2.33 1.33 0.00 -0.30 0.00 0.00 42.92 41.37 1mio s ASP 153 CO 0.27 -1.04 2.15 0.16 -0.17 0.00 0.00 175.17 176.54 1mio h ILE 154 N 5.70 0.94 -0.31 4.11 3.07 -1.95 -1.61 117.51 127.46 1mio h ILE 154 Ca -0.09 -0.08 -0.04 0.00 1.55 0.00 0.00 64.86 66.20 1mio h ILE 154 Cb 1.06 1.04 -0.01 0.00 -0.27 0.00 0.00 36.82 38.64 1mio h ILE 154 CO 1.05 0.02 0.05 0.25 -1.05 0.00 0.00 178.15 178.47 1mio h LEU 155 N 0.00 0.49 -0.05 0.16 5.85 -1.90 -0.49 115.31 119.37 1mio h LEU 155 Ca -0.00 -0.26 -0.14 0.00 0.84 0.00 0.00 57.88 58.31 1mio h LEU 155 Cb 0.04 -0.13 0.01 0.00 0.37 0.00 0.00 40.66 40.95 1mio h LEU 155 CO 0.00 0.63 -0.53 0.00 -0.34 0.00 0.00 178.44 178.20 1mio h ALA 156 N 0.88 0.13 -0.54 1.25 0.00 -1.87 -2.34 119.26 116.78 1mio h ALA 156 Ca 0.09 -0.53 0.06 0.00 0.00 0.00 0.00 54.91 54.54 1mio h ALA 156 Cb 0.35 0.01 -0.05 0.00 0.00 0.00 0.00 17.79 18.09 1mio h ALA 156 CO 0.01 0.35 0.24 0.28 0.00 0.00 0.00 179.25 180.12 1mio h VAL 157 N -0.01 0.88 0.40 0.00 2.07 -1.19 -2.71 116.25 115.70 1mio h VAL 157 Ca -0.05 -0.15 -0.01 0.00 0.82 0.00 0.00 66.70 67.31 1mio h VAL 157 Cb 1.21 0.39 -0.03 0.00 -1.52 0.00 0.00 31.29 31.34 1mio h VAL 157 CO 0.11 0.08 -0.49 0.00 0.02 0.00 0.00 177.57 177.29 1mio h ALA 158 N 1.33 -1.06 -0.83 1.67 0.00 -1.14 -0.96 119.26 118.27 1mio h ALA 158 Ca 0.25 -0.16 0.14 0.00 0.00 0.00 0.00 54.91 55.14 1mio h ALA 158 Cb 0.22 0.74 -0.09 0.00 0.00 0.00 0.00 17.79 18.66 1mio h ALA 158 CO -0.21 -1.14 0.42 0.00 0.00 0.00 0.00 179.25 178.31 1mio h ALA 159 N -0.71 1.24 0.55 0.00 0.00 -1.31 0.07 119.26 119.10 1mio h ALA 159 Ca -0.04 0.09 -0.03 0.00 0.00 0.00 0.00 54.91 54.93 1mio h ALA 159 Cb 0.83 -0.01 0.01 0.00 0.00 0.00 0.00 17.79 18.62 1mio h ALA 159 CO -0.11 -0.10 -0.27 1.15 0.00 0.00 0.00 179.25 179.92 1mio h THR 160 N 0.60 0.35 -0.87 0.00 2.02 -1.18 -2.94 112.91 110.90 1mio h THR 160 Ca 0.45 -0.32 0.08 0.00 0.77 0.00 0.00 66.41 67.39 1mio h THR 160 Cb 0.63 0.46 -0.06 0.00 -1.74 0.00 0.00 68.15 67.44 1mio h THR 160 CO -0.36 0.04 0.56 0.00 0.37 0.00 0.00 175.52 176.13 1mio h ALA 161 N -0.68 1.60 -0.38 6.16 0.00 -0.77 -1.21 119.26 123.97 1mio h ALA 161 Ca -0.08 -0.01 0.07 0.00 0.00 0.00 0.00 54.91 54.89 1mio h ALA 161 Cb 0.64 -0.23 -0.07 0.00 0.00 0.00 0.00 17.79 18.13 1mio h ALA 161 CO 0.12 0.25 -0.05 1.03 0.00 0.00 0.00 179.25 180.60 1mio h SER 162 N 0.92 -0.26 -0.72 0.00 0.87 -0.99 0.17 113.55 113.53 1mio h SER 162 Ca 0.39 0.10 0.03 0.00 -1.23 0.00 0.00 61.79 61.07 1mio h SER 162 Cb 0.30 0.20 -0.04 0.00 -0.44 0.00 0.00 62.40 62.42 1mio h SER 162 CO -0.15 -0.09 0.46 0.50 -0.53 0.00 0.00 176.83 177.02 1mio h LYS 163 N 0.05 0.88 0.46 2.24 3.64 -1.05 0.20 116.57 122.99 1mio h LYS 163 Ca 0.19 -0.05 -0.02 0.00 -1.27 0.00 0.00 60.65 59.49 1mio h LYS 163 Cb 0.28 -0.20 0.00 0.00 -0.41 0.00 0.00 32.23 31.90 1mio h LYS 163 CO -0.36 0.59 -0.23 0.93 -2.27 0.00 0.00 179.45 178.11 1mio h GLU 164 N 0.91 -0.61 0.00 1.90 3.07 -0.82 -3.23 114.58 115.80 1mio h GLU 164 Ca 0.28 0.04 -0.10 0.00 -0.50 0.00 0.00 59.36 59.08 1mio h GLU 164 Cb -0.01 0.14 -0.01 0.00 -0.84 0.00 0.00 28.75 28.02 1mio h GLU 164 CO -0.10 -0.41 -0.50 0.82 -1.40 0.00 0.00 179.01 177.43 1mio h ILE 165 N -0.64 1.24 0.00 3.13 2.04 -0.61 -3.48 117.51 119.19 1mio h ILE 165 Ca -0.06 -1.78 0.00 0.00 1.00 0.00 0.00 64.86 64.02 1mio h ILE 165 Cb 0.49 1.99 0.00 0.00 -0.74 0.00 0.00 36.82 38.57 1mio h ILE 165 CO 0.09 0.49 0.00 0.61 0.00 0.00 0.00 178.15 179.34 1mio n GLY 166 N 0.11 2.00 3.33 5.37 0.00 0.68 -5.05 105.19 111.63 1mio n GLY 166 Ca -0.01 -0.51 -0.41 0.00 0.00 0.00 0.00 46.02 45.09 1mio n GLY 166 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 1mio n ILE 167 N 0.00 0.84 -1.26 -0.61 5.41 -1.25 -4.68 119.36 117.81 1mio n ILE 167 Ca 0.00 -0.50 -0.08 0.00 1.00 0.00 0.00 62.75 63.17 1mio n ILE 167 Cb 0.00 -0.11 -0.06 0.00 -0.71 0.00 0.00 39.64 38.76 1mio n ILE 167 CO 0.00 0.00 0.00 -2.65 0.00 0.00 0.00 176.55 173.90 1mio n PRO 168 N 1.17 0.04 -2.53 0.38 -0.02 -1.26 -4.55 135.00 128.23 1mio n PRO 168 Ca 0.11 -0.83 -0.43 0.00 -2.02 0.00 0.00 63.50 60.33 1mio n PRO 168 Cb 0.41 -2.44 -0.02 0.00 -0.02 0.00 0.00 33.50 31.43 1mio n PRO 168 CO 0.00 0.00 0.00 0.08 1.98 0.00 0.00 175.50 177.56 1mio s VAL 169 N 8.57 4.34 -0.46 -1.45 1.01 -1.26 -1.77 120.40 129.39 1mio s VAL 169 Ca 0.41 1.55 -0.10 0.00 0.00 0.00 0.00 61.98 63.84 1mio s VAL 169 Cb -0.02 -4.27 0.11 0.00 0.00 0.00 0.00 36.38 32.20 1mio s VAL 169 CO 0.10 -0.44 0.33 -1.00 0.00 0.00 0.00 175.10 174.09 1mio s HIS 170 N 3.91 3.40 -0.05 5.22 3.76 0.56 -4.44 115.29 127.66 1mio s HIS 170 Ca 0.50 -1.76 -0.27 0.00 -0.15 0.00 0.00 55.06 53.39 1mio s HIS 170 Cb -0.15 -3.39 -0.03 0.00 1.11 0.00 0.00 32.58 30.12 1mio s HIS 170 CO 0.18 -0.96 0.85 0.00 -0.85 0.00 0.00 174.74 173.96 1mio s ALA 171 N 1.39 3.28 -0.31 -1.40 0.00 -1.26 -1.40 121.76 122.05 1mio s ALA 171 Ca 0.05 0.32 -0.01 0.00 0.00 0.00 0.00 51.96 52.32 1mio s ALA 171 Cb -0.26 -3.17 0.06 0.00 0.00 0.00 0.00 23.12 19.76 1mio s ALA 171 CO 0.00 -0.23 0.02 -0.06 0.00 0.00 0.00 175.76 175.49 1mio s PHE 172 N 1.06 3.36 -0.90 0.00 0.40 -0.08 -4.88 117.98 116.93 1mio s PHE 172 Ca 0.44 -2.12 -0.24 0.00 -0.60 0.00 0.00 56.93 54.41 1mio s PHE 172 Cb -0.19 -2.33 0.02 0.00 0.51 0.00 0.00 43.02 41.03 1mio s PHE 172 CO 0.22 -0.85 1.56 -1.12 0.70 0.00 0.00 175.22 175.72 1mio s SER 173 N 1.29 6.04 -0.36 1.36 0.01 -1.26 -3.97 113.70 116.81 1mio s SER 173 Ca -0.02 -0.93 0.06 0.00 1.31 0.00 0.00 55.95 56.36 1mio s SER 173 Cb -0.20 -2.56 0.45 0.00 0.21 0.00 0.00 66.02 63.91 1mio s SER 173 CO -0.03 -1.91 1.24 0.00 0.41 0.00 0.00 173.24 172.96 1mio n GLU 175 N -0.67 1.98 0.14 0.00 0.00 -0.90 -1.55 120.64 119.64 1mio n GLU 175 Ca 0.44 0.63 0.01 0.00 0.00 0.00 0.00 57.16 58.24 1mio n GLU 175 Cb 0.87 -2.92 0.06 0.00 0.00 0.00 0.00 31.44 29.46 1mio n GLU 175 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.13 177.54 1mio n GLY 176 N 5.43 -0.29 0.00 -1.84 0.00 -1.26 -0.44 105.19 106.79 1mio n GLY 176 Ca 0.29 0.02 0.13 0.00 0.00 0.00 0.00 46.02 46.46 1mio n GLY 176 CO 0.00 0.00 0.00 1.58 0.00 0.00 0.00 173.32 174.90 1mio n TYR 177 N -1.69 0.03 -2.28 1.61 0.18 -1.26 -3.91 117.16 109.84 1mio n TYR 177 Ca -0.00 0.01 -0.36 0.00 1.88 0.00 0.00 57.90 59.43 1mio n TYR 177 Cb 0.62 -0.51 -0.01 0.00 -0.38 0.00 0.00 39.34 39.06 1mio n TYR 177 CO 0.00 0.00 0.00 0.15 -2.08 0.00 0.00 176.86 174.93 1mio s LYS 178 N -3.00 3.61 3.34 -3.48 1.02 0.41 -4.88 119.74 116.76 1mio s LYS 178 Ca 0.13 1.68 0.00 0.00 0.02 0.00 0.00 55.97 57.80 1mio s LYS 178 Cb 0.17 -2.23 0.00 0.00 -0.52 0.00 0.00 37.83 35.25 1mio s LYS 178 CO 0.49 -0.66 0.00 0.41 -0.92 0.00 0.00 175.35 174.68 1mio n GLY 179 N 0.30 0.08 0.00 -3.33 0.00 -1.24 -3.98 105.19 97.02 1mio n GLY 179 Ca 0.09 -0.94 0.00 0.00 0.00 0.00 0.00 46.02 45.17 1mio n GLY 179 CO 0.00 0.00 0.00 3.33 0.00 0.00 0.00 173.32 176.65 1mio n VAL 180 N 0.00 0.01 -4.01 1.61 0.24 -1.26 -3.77 118.33 111.16 1mio n VAL 180 Ca 0.00 -0.09 0.01 0.00 -2.04 0.00 0.00 64.34 62.22 1mio n VAL 180 Cb 0.00 1.76 0.00 0.00 -1.47 0.00 0.00 33.84 34.13 1mio n VAL 180 CO 0.00 0.00 0.00 -1.54 -2.14 0.00 0.00 176.83 173.15 1mio n SER 181 N -0.01 -0.16 0.10 -1.34 3.41 -1.26 -4.60 113.62 109.76 1mio n SER 181 Ca 0.00 -1.00 0.10 0.00 -0.26 0.00 0.00 58.87 57.71 1mio n SER 181 Cb 0.23 0.23 0.43 0.00 -0.26 0.00 0.00 64.21 64.85 1mio n SER 181 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1mio n GLN 182 N -0.15 0.13 -0.35 4.33 3.00 -1.25 -3.40 117.38 119.68 1mio n GLN 182 Ca 0.01 0.42 -0.01 0.00 -0.01 0.00 0.00 57.00 57.40 1mio n GLN 182 Cb 0.09 -1.78 0.11 0.00 0.00 0.00 0.00 30.24 28.67 1mio n GLN 182 CO 0.00 0.00 0.00 0.77 0.00 0.00 0.00 177.06 177.83 1mio h SER 183 N 0.00 1.06 -0.91 1.08 0.02 -1.88 -2.85 113.55 110.08 1mio h SER 183 Ca 0.00 -0.02 0.14 0.00 -0.84 0.00 0.00 61.79 61.07 1mio h SER 183 Cb 0.27 -0.25 -0.07 0.00 0.14 0.00 0.00 62.40 62.48 1mio h SER 183 CO 0.00 0.75 0.58 0.00 -1.14 0.00 0.00 176.83 177.02 1mio h ALA 184 N 1.37 1.78 -0.48 3.77 0.00 -1.90 0.15 119.26 123.95 1mio h ALA 184 Ca 0.36 0.02 -0.12 0.00 0.00 0.00 0.00 54.91 55.17 1mio h ALA 184 Cb -0.07 -0.14 -0.01 0.00 0.00 0.00 0.00 17.79 17.56 1mio h ALA 184 CO -0.10 -0.02 -0.17 0.78 0.00 0.00 0.00 179.25 179.74 1mio h GLY 185 N 0.74 1.05 1.90 0.00 0.00 -1.57 -2.45 103.07 102.74 1mio h GLY 185 Ca 0.45 -0.90 -0.11 0.00 0.00 0.00 0.00 47.33 46.77 1mio h GLY 185 CO -0.21 0.82 -0.47 0.45 0.00 0.00 0.00 176.54 177.13 1mio h HIS 186 N 0.82 0.13 0.04 5.60 3.86 -0.67 -2.43 115.15 122.50 1mio h HIS 186 Ca 0.12 -0.04 -0.00 0.00 -1.16 0.00 0.00 60.37 59.28 1mio h HIS 186 Cb 0.74 -0.03 0.00 0.00 1.06 0.00 0.00 27.41 29.18 1mio h HIS 186 CO 0.05 0.56 -0.02 1.25 0.86 0.00 0.00 177.93 180.64 1mio h HIS 187 N 0.09 -0.05 -0.57 2.45 6.17 -1.13 -3.12 115.15 119.00 1mio h HIS 187 Ca 0.00 -0.00 0.11 0.00 0.71 0.00 0.00 60.37 61.19 1mio h HIS 187 Cb 0.87 0.02 -0.09 0.00 2.52 0.00 0.00 27.41 30.72 1mio h HIS 187 CO 0.01 0.44 0.04 0.82 0.71 0.00 0.00 177.93 179.95 1mio h ILE 188 N -0.55 0.58 -0.39 6.26 2.04 -1.38 -2.35 117.51 121.72 1mio h ILE 188 Ca -0.01 -0.05 -0.01 0.00 1.00 0.00 0.00 64.86 65.79 1mio h ILE 188 Cb 0.51 0.41 -0.02 0.00 -0.74 0.00 0.00 36.82 36.97 1mio h ILE 188 CO 0.01 0.03 0.19 0.00 0.00 0.00 0.00 178.15 178.37 1mio h ALA 189 N 1.49 0.50 -0.81 1.87 0.00 -1.58 -3.28 119.26 117.46 1mio h ALA 189 Ca 0.30 -0.11 -0.01 0.00 0.00 0.00 0.00 54.91 55.09 1mio h ALA 189 Cb 0.46 -0.15 -0.04 0.00 0.00 0.00 0.00 17.79 18.05 1mio h ALA 189 CO -0.45 0.07 0.48 -0.91 0.00 0.00 0.00 179.25 178.43 1mio h ASN 190 N 0.49 0.98 0.38 0.00 2.35 -1.36 -2.08 115.58 116.34 1mio h ASN 190 Ca 0.13 -0.06 -0.02 0.00 -0.55 0.00 0.00 56.30 55.80 1mio h ASN 190 Cb 0.12 -0.25 0.00 0.00 0.05 0.00 0.00 38.32 38.25 1mio h ASN 190 CO -0.02 0.76 -0.18 0.78 -1.65 0.00 0.00 177.43 177.12 1mio h ASN 191 N 1.12 -0.43 -0.84 5.81 4.21 -1.56 -2.96 115.58 120.93 1mio h ASN 191 Ca 0.29 -0.14 0.11 0.00 1.21 0.00 0.00 56.30 57.77 1mio h ASN 191 Cb -0.03 0.11 -0.08 0.00 -1.12 0.00 0.00 38.32 37.21 1mio h ASN 191 CO -0.05 -0.05 0.47 0.74 -1.29 0.00 0.00 177.43 177.25 1mio h THR 192 N -0.88 0.86 -0.27 2.81 2.02 -1.62 0.22 112.91 116.05 1mio h THR 192 Ca -0.05 -0.26 -0.10 0.00 0.77 0.00 0.00 66.41 66.76 1mio h THR 192 Cb 0.54 0.04 -0.01 0.00 -1.74 0.00 0.00 68.15 66.98 1mio h THR 192 CO 0.09 0.14 -0.27 1.62 0.37 0.00 0.00 175.52 177.46 1mio h VAL 193 N 0.76 1.27 0.24 3.16 3.04 -1.48 -1.62 116.25 121.63 1mio h VAL 193 Ca 0.42 -1.32 -0.01 0.00 -1.01 0.00 0.00 66.70 64.77 1mio h VAL 193 Cb 0.45 1.36 0.00 0.00 -2.01 0.00 0.00 31.29 31.09 1mio h VAL 193 CO -0.28 0.42 -0.12 -0.03 -1.01 0.00 0.00 177.57 176.56 1mio h MET 194 N 0.46 -0.31 0.23 4.17 -1.53 -0.94 0.46 114.93 117.48 1mio h MET 194 Ca 0.06 0.02 -0.00 0.00 -3.44 0.00 0.00 59.70 56.34 1mio h MET 194 Cb 0.71 0.07 -0.01 0.00 -0.55 0.00 0.00 31.60 31.82 1mio h MET 194 CO 0.05 0.06 -0.18 1.15 0.14 0.00 0.00 176.91 178.13 1mio h THR 195 N -0.81 0.61 0.00 -0.77 2.02 -1.08 -3.33 112.91 109.55 1mio h THR 195 Ca -0.03 0.00 -0.04 0.00 0.77 0.00 0.00 66.41 67.10 1mio h THR 195 Cb 0.51 0.61 -0.10 0.00 -1.74 0.00 0.00 68.15 67.44 1mio h THR 195 CO 0.05 0.00 -0.60 -0.90 0.37 0.00 0.00 175.52 174.44 1mio n ASP 196 N -5.30 1.54 0.07 4.18 5.75 -0.61 -4.84 116.55 117.33 1mio n ASP 196 Ca -0.09 -3.36 0.00 0.00 -0.01 0.00 0.00 54.79 51.34 1mio n ASP 196 Cb 0.22 -0.46 0.00 0.00 -1.03 0.00 0.00 41.12 39.85 1mio n ASP 196 CO 0.00 0.00 0.00 -0.38 -0.11 0.00 0.00 177.20 176.71 1mio n ILE 197 N -0.72 0.25 -0.32 2.12 5.41 -0.22 -4.95 119.36 120.93 1mio n ILE 197 Ca 0.15 0.08 0.21 0.00 1.00 0.00 0.00 62.75 64.20 1mio n ILE 197 Cb 0.80 -0.66 0.42 0.00 -0.71 0.00 0.00 39.64 39.49 1mio n ILE 197 CO 0.00 0.00 0.00 0.40 0.00 0.00 0.00 176.55 176.95 1mio h ILE 198 N 0.00 0.23 -1.55 1.39 2.04 -0.27 -3.21 117.51 116.14 1mio h ILE 198 Ca 0.00 -0.07 -0.58 0.00 1.00 0.00 0.00 64.86 65.21 1mio h ILE 198 Cb 0.00 0.00 -0.42 0.00 -0.74 0.00 0.00 36.82 35.66 1mio h ILE 198 CO 0.00 0.04 -0.75 0.61 0.00 0.00 0.00 178.15 178.05 1mio n GLY 199 N -1.33 5.77 0.34 5.37 0.00 -1.24 -3.39 105.19 110.71 1mio n GLY 199 Ca 0.29 -2.70 0.05 0.00 0.00 0.00 0.00 46.02 43.66 1mio n GLY 199 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1mio n LYS 200 N -0.44 1.35 -1.29 1.61 4.01 -0.02 -5.02 118.16 118.37 1mio n LYS 200 Ca 0.37 -0.88 -0.14 0.00 -0.51 0.00 0.00 58.31 57.15 1mio n LYS 200 Cb 0.65 -1.16 0.09 0.00 -0.51 0.00 0.00 35.03 34.11 1mio n LYS 200 CO 0.00 0.00 0.00 0.41 -1.11 0.00 0.00 177.40 176.70 1mio n GLY 201 N 0.79 -0.50 2.48 0.72 0.00 0.70 -4.97 105.19 104.40 1mio n GLY 201 Ca 0.05 -1.82 0.00 0.00 0.00 0.00 0.00 46.02 44.26 1mio n GLY 201 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 1mio n ASN 202 N -3.25 0.98 -4.80 1.61 0.23 -1.26 -4.96 115.26 103.81 1mio n ASN 202 Ca 0.09 -2.04 -0.34 0.00 -0.53 0.00 0.00 54.58 51.76 1mio n ASN 202 Cb 0.31 -0.27 -0.03 0.00 -2.08 0.00 0.00 39.78 37.71 1mio n ASN 202 CO 0.00 0.00 0.00 -0.75 -0.93 0.00 0.00 177.26 175.58 1mio s LYS 203 N -2.40 3.81 -0.76 -3.83 2.20 -1.26 -4.98 119.74 112.51 1mio s LYS 203 Ca 0.25 1.36 -0.19 0.00 -0.36 0.00 0.00 55.97 57.03 1mio s LYS 203 Cb 0.34 -2.10 0.12 0.00 -1.51 0.00 0.00 37.83 34.68 1mio s LYS 203 CO -0.08 -0.43 0.94 -1.83 -0.36 0.00 0.00 175.35 173.60 1mio s GLU 204 N -3.22 3.33 0.21 4.03 1.03 -1.26 -5.00 118.70 117.82 1mio s GLU 204 Ca 0.67 -1.48 -0.10 0.00 0.03 0.00 0.00 54.97 54.09 1mio s GLU 204 Cb -0.16 -4.53 -0.08 0.00 -0.80 0.00 0.00 34.13 28.56 1mio s GLU 204 CO 0.20 -1.68 0.03 0.94 -1.33 0.00 0.00 175.26 173.42 1mio n GLN 205 N 6.55 0.00 -3.99 -4.83 7.27 -1.26 -4.99 117.38 116.13 1mio n GLN 205 Ca 0.07 0.00 -0.23 0.00 0.07 0.00 0.00 57.00 56.92 1mio n GLN 205 Cb 0.46 -0.50 -0.06 0.00 2.41 0.00 0.00 30.24 32.56 1mio n GLN 205 CO 0.00 0.00 0.00 0.15 0.07 0.00 0.00 177.06 177.28 1mio s LYS 206 N -0.50 2.44 -0.20 3.69 1.02 -1.26 -5.07 119.74 119.85 1mio s LYS 206 Ca 0.29 -1.53 -0.34 0.00 0.02 0.00 0.00 55.97 54.41 1mio s LYS 206 Cb -0.31 -2.23 -0.11 0.00 -0.52 0.00 0.00 37.83 34.67 1mio s LYS 206 CO 0.32 0.05 2.03 1.63 -0.92 0.00 0.00 175.35 178.45 1mio n LYS 207 N -1.24 1.76 -3.68 1.68 5.02 -1.26 -2.39 118.16 118.06 1mio n LYS 207 Ca -0.02 0.58 -0.24 0.00 -2.02 0.00 0.00 58.31 56.61 1mio n LYS 207 Cb 0.61 -2.67 0.06 0.00 -0.02 0.00 0.00 35.03 33.01 1mio n LYS 207 CO 0.00 0.00 0.00 0.66 -0.52 0.00 0.00 177.40 177.54 1mio n TYR 208 N 8.46 -2.42 -1.99 2.13 4.01 -1.26 -3.79 117.16 122.30 1mio n TYR 208 Ca 0.30 0.94 -0.43 0.00 -0.16 0.00 0.00 57.90 58.55 1mio n TYR 208 Cb 0.29 -4.64 -0.03 0.00 -0.31 0.00 0.00 39.34 34.66 1mio n TYR 208 CO 0.00 0.00 0.00 -1.12 -0.46 0.00 0.00 176.86 175.28 1mio s SER 209 N -3.70 5.85 0.38 7.72 0.01 -1.00 -0.87 113.70 122.08 1mio s SER 209 Ca 0.40 1.28 0.08 0.00 1.31 0.00 0.00 55.95 59.01 1mio s SER 209 Cb -0.19 -2.53 -0.02 0.00 0.21 0.00 0.00 66.02 63.49 1mio s SER 209 CO 0.77 -1.75 0.33 -0.51 0.41 0.00 0.00 173.24 172.49 1mio s ILE 210 N 7.04 3.06 0.02 1.44 2.07 -0.02 -0.50 121.20 134.31 1mio s ILE 210 Ca 0.80 -1.38 0.01 0.00 -1.41 0.00 0.00 60.65 58.67 1mio s ILE 210 Cb -0.22 -3.08 -0.01 0.00 0.13 0.00 0.00 42.46 39.27 1mio s ILE 210 CO 0.33 -0.09 -0.05 0.20 -1.91 0.00 0.00 174.94 173.42 1mio s ASN 211 N -4.05 0.54 -0.11 4.50 0.01 -1.11 -0.59 114.94 114.13 1mio s ASN 211 Ca 0.44 -0.31 -0.04 0.00 -0.71 0.00 0.00 52.86 52.24 1mio s ASN 211 Cb -0.04 0.01 -0.03 0.00 0.41 0.00 0.00 41.25 41.59 1mio s ASN 211 CO 0.27 -0.11 0.03 -0.69 -1.51 0.00 0.00 177.10 175.10 1mio s VAL 212 N -0.79 4.58 -0.06 1.60 1.01 0.09 -2.02 120.40 124.81 1mio s VAL 212 Ca -0.06 -0.14 0.03 0.00 0.00 0.00 0.00 61.98 61.82 1mio s VAL 212 Cb -0.06 -2.96 0.01 0.00 0.00 0.00 0.00 36.38 33.37 1mio s VAL 212 CO -0.00 0.59 -0.15 -0.76 0.00 0.00 0.00 175.10 174.77 1mio s LEU 213 N -0.73 1.81 -0.33 3.92 1.43 0.66 0.59 118.68 126.03 1mio s LEU 213 Ca 0.12 -0.35 -0.01 0.00 -1.03 0.00 0.00 54.13 52.86 1mio s LEU 213 Cb -0.12 -0.95 -0.01 0.00 0.03 0.00 0.00 46.19 45.14 1mio s LEU 213 CO 0.02 0.09 0.28 0.61 0.23 0.00 0.00 176.35 177.59 1mio n GLY 214 N 3.52 0.26 2.92 -3.19 0.00 -0.72 -0.97 105.19 107.00 1mio n GLY 214 Ca -0.20 -0.13 -0.14 0.00 0.00 0.00 0.00 46.02 45.54 1mio n GLY 214 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 1mio s GLU 215 N -3.79 0.09 0.00 1.61 -6.30 -0.82 -1.38 118.70 108.11 1mio s GLU 215 Ca 0.09 0.48 0.07 0.00 -2.50 0.00 0.00 54.97 53.10 1mio s GLU 215 Cb -0.01 -0.19 0.13 0.00 0.00 0.00 0.00 34.13 34.05 1mio s GLU 215 CO 0.22 -0.22 0.95 0.66 0.02 0.00 0.00 175.26 176.89 1mio n TYR 216 N 4.66 0.15 -3.44 5.30 4.01 -1.26 0.63 117.16 127.21 1mio n TYR 216 Ca -0.18 -0.26 -0.21 0.00 -0.16 0.00 0.00 57.90 57.10 1mio n TYR 216 Cb 0.51 -0.02 0.06 0.00 -0.31 0.00 0.00 39.34 39.58 1mio n TYR 216 CO 0.00 0.00 0.00 -1.71 -0.46 0.00 0.00 176.86 174.69 1mio n ASN 217 N 0.28 -5.23 -4.60 7.72 5.15 -1.26 -4.16 115.26 113.16 1mio n ASN 217 Ca 0.06 -0.80 -0.43 0.00 -0.60 0.00 0.00 54.58 52.81 1mio n ASN 217 Cb 0.27 -4.55 -0.04 0.00 -0.53 0.00 0.00 39.78 34.94 1mio n ASN 217 CO 0.00 0.00 0.00 -0.63 1.40 0.00 0.00 177.26 178.03 1mio s ILE 218 N -3.44 4.54 -1.19 -1.44 1.01 -1.26 -1.61 121.20 117.80 1mio s ILE 218 Ca 0.37 1.12 -0.03 0.00 0.00 0.00 0.00 60.65 62.11 1mio s ILE 218 Cb -0.08 -4.37 0.00 0.00 0.01 0.00 0.00 42.46 38.02 1mio s ILE 218 CO 0.78 -0.63 1.01 0.61 0.00 0.00 0.00 174.94 176.71 1mio n GLY 219 N 4.51 -0.37 2.30 6.18 0.00 -0.61 -3.21 105.19 113.99 1mio n GLY 219 Ca 0.07 0.12 -0.07 0.00 0.00 0.00 0.00 46.02 46.14 1mio n GLY 219 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1mio n GLY 220 N -1.38 0.88 0.36 -0.02 0.00 -1.15 -2.35 105.19 101.53 1mio n GLY 220 Ca -0.19 -0.48 0.03 0.00 0.00 0.00 0.00 46.02 45.38 1mio n GLY 220 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 1mio h ASP 221 N 0.00 0.98 0.02 1.61 3.32 -1.75 -1.16 116.42 119.44 1mio h ASP 221 Ca -0.14 0.02 -0.21 0.00 0.02 0.00 0.00 57.03 56.72 1mio h ASP 221 Cb 0.55 -0.19 0.00 0.00 0.22 0.00 0.00 39.33 39.91 1mio h ASP 221 CO 0.20 0.61 -0.76 0.00 -1.72 0.00 0.00 179.24 177.57 1mio h ALA 222 N 1.47 0.42 -0.53 3.45 0.00 -1.89 -0.34 119.26 121.84 1mio h ALA 222 Ca 0.44 -0.60 -0.02 0.00 0.00 0.00 0.00 54.91 54.73 1mio h ALA 222 Cb 0.24 -0.03 -0.02 0.00 0.00 0.00 0.00 17.79 17.97 1mio h ALA 222 CO -0.19 0.72 0.27 -1.49 0.00 0.00 0.00 179.25 178.55 1mio h TRP 223 N 0.44 0.76 0.20 0.00 6.55 -1.85 0.09 115.95 122.14 1mio h TRP 223 Ca -0.04 -0.03 -0.01 0.00 0.95 0.00 0.00 58.89 59.75 1mio h TRP 223 Cb 1.37 -0.24 0.00 0.00 -0.86 0.00 0.00 29.16 29.44 1mio h TRP 223 CO 0.07 0.58 -0.10 1.49 -1.05 0.00 0.00 178.44 179.43 1mio h GLU 224 N 0.72 -0.26 -0.84 0.49 4.22 -1.14 -1.91 114.58 115.85 1mio h GLU 224 Ca 0.18 0.02 0.13 0.00 0.08 0.00 0.00 59.36 59.78 1mio h GLU 224 Cb 0.09 0.06 -0.14 0.00 0.50 0.00 0.00 28.75 29.26 1mio h GLU 224 CO -0.03 0.03 -0.37 0.52 -2.18 0.00 0.00 179.01 176.98 1mio h MET 225 N -0.54 -0.06 -0.74 1.92 2.86 -0.59 -1.60 114.93 116.17 1mio h MET 225 Ca -0.03 0.00 -0.04 0.00 -2.06 0.00 0.00 59.70 57.58 1mio h MET 225 Cb 0.41 0.01 -0.03 0.00 0.06 0.00 0.00 31.60 32.05 1mio h MET 225 CO 0.05 -0.04 0.31 -0.44 1.06 0.00 0.00 176.91 177.84 1mio h ASP 226 N -0.06 1.01 -0.27 1.22 5.19 -1.03 -2.30 116.42 120.17 1mio h ASP 226 Ca 0.30 -0.16 -0.00 0.00 -0.62 0.00 0.00 57.03 56.54 1mio h ASP 226 Cb 0.58 -0.26 -0.01 0.00 0.18 0.00 0.00 39.33 39.81 1mio h ASP 226 CO -0.87 0.90 0.17 0.08 -3.12 0.00 0.00 179.24 176.39 1mio h ARG 227 N 1.06 0.39 0.05 3.56 -0.00 -0.44 0.48 114.38 119.47 1mio h ARG 227 Ca 0.25 -0.03 -0.00 0.00 -0.00 0.00 0.00 59.98 60.20 1mio h ARG 227 Cb 0.19 -0.08 0.00 0.00 -0.00 0.00 0.00 29.97 30.08 1mio h ARG 227 CO -0.02 0.28 -0.02 0.28 -0.00 0.00 0.00 179.97 180.48 1mio h VAL 228 N 0.39 1.28 0.00 0.08 2.07 -1.43 -2.81 116.25 115.83 1mio h VAL 228 Ca 0.10 -1.13 -0.01 0.00 0.82 0.00 0.00 66.70 66.48 1mio h VAL 228 Cb -0.00 2.02 -0.00 0.00 -1.52 0.00 0.00 31.29 31.78 1mio h VAL 228 CO -0.02 0.28 -0.06 -0.07 0.02 0.00 0.00 177.57 177.73 1mio h LEU 229 N -0.57 0.00 0.14 2.57 3.38 -0.88 -2.39 115.31 117.56 1mio h LEU 229 Ca -0.01 0.00 -0.28 0.00 0.09 0.00 0.00 57.88 57.68 1mio h LEU 229 Cb 0.51 0.00 0.01 0.00 0.09 0.00 0.00 40.66 41.27 1mio h LEU 229 CO 0.01 0.06 -1.29 -0.08 0.09 0.00 0.00 178.44 177.22 1mio h GLU 230 N 0.00 0.30 0.83 1.13 4.57 -0.12 -2.47 114.58 118.82 1mio h GLU 230 Ca -0.00 -0.51 -0.04 0.00 -1.18 0.00 0.00 59.36 57.63 1mio h GLU 230 Cb 0.11 0.19 0.01 0.00 -0.16 0.00 0.00 28.75 28.90 1mio h GLU 230 CO 0.01 1.23 -0.42 -0.22 -1.18 0.00 0.00 179.01 178.43 1mio h LYS 231 N 0.08 -1.09 -0.57 1.92 3.64 -1.20 -3.18 116.57 116.18 1mio h LYS 231 Ca -0.16 0.07 0.11 0.00 -1.27 0.00 0.00 60.65 59.41 1mio h LYS 231 Cb 2.00 0.25 -0.11 0.00 -0.41 0.00 0.00 32.23 33.95 1mio h LYS 231 CO 0.21 -0.73 -0.19 0.82 -2.27 0.00 0.00 179.45 177.28 1mio h ILE 232 N -1.14 0.35 0.00 2.00 2.04 -1.52 -3.46 117.51 115.79 1mio h ILE 232 Ca -0.11 0.00 0.00 0.00 1.00 0.00 0.00 64.86 65.75 1mio h ILE 232 Cb 0.88 0.35 0.00 0.00 -0.74 0.00 0.00 36.82 37.31 1mio h ILE 232 CO 0.17 0.00 0.00 0.61 0.00 0.00 0.00 178.15 178.93 1mio n GLY 233 N -1.42 -0.90 3.88 5.37 0.00 -1.09 -4.85 105.19 106.18 1mio n GLY 233 Ca 0.06 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.77 1mio n GLY 233 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1mio s TYR 234 N 0.00 3.56 -0.28 1.61 2.02 -0.95 -4.82 117.35 118.49 1mio s TYR 234 Ca 0.00 1.20 0.02 0.00 -0.37 0.00 0.00 57.07 57.92 1mio s TYR 234 Cb 0.00 -2.75 0.07 0.00 -0.40 0.00 0.00 41.96 38.87 1mio s TYR 234 CO 0.00 -0.75 -0.07 -1.58 -1.57 0.00 0.00 175.55 171.58 1mio s HIS 235 N -3.17 3.35 0.25 2.71 5.65 -0.05 -4.43 115.29 119.59 1mio s HIS 235 Ca 0.55 -2.37 -0.30 0.00 0.25 0.00 0.00 55.06 53.19 1mio s HIS 235 Cb -0.11 -2.12 -0.09 0.00 -1.18 0.00 0.00 32.58 29.07 1mio s HIS 235 CO 0.53 -0.88 1.24 0.08 -0.65 0.00 0.00 174.74 175.05 1mio s VAL 236 N 1.09 3.21 -0.02 0.89 1.01 -1.26 -0.84 120.40 124.48 1mio s VAL 236 Ca -0.05 1.10 0.02 0.00 0.00 0.00 0.00 61.98 63.05 1mio s VAL 236 Cb -0.20 -3.70 -0.03 0.00 0.00 0.00 0.00 36.38 32.44 1mio s VAL 236 CO -0.05 0.22 0.02 -3.20 0.00 0.00 0.00 175.10 172.08 1mio n ASN 237 N 1.79 4.34 -3.79 3.32 4.05 0.25 -4.85 115.26 120.37 1mio n ASN 237 Ca 0.02 0.00 -0.13 0.00 0.45 0.00 0.00 54.58 54.93 1mio n ASN 237 Cb 0.43 0.66 -0.11 0.00 1.23 0.00 0.00 39.78 41.99 1mio n ASN 237 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 177.26 174.21 1mio s ALA 238 N -2.09 -0.60 -0.15 5.20 0.00 -1.26 -4.87 121.76 118.00 1mio s ALA 238 Ca -0.01 0.55 -0.02 0.00 0.00 0.00 0.00 51.96 52.48 1mio s ALA 238 Cb 0.01 -0.28 -0.02 0.00 0.00 0.00 0.00 23.12 22.83 1mio s ALA 238 CO 0.11 -0.15 -0.09 0.99 0.00 0.00 0.00 175.76 176.62 1mio s THR 239 N -0.25 3.37 -0.78 0.00 2.01 -1.25 -0.73 115.64 118.01 1mio s THR 239 Ca -0.04 -0.54 -0.16 0.00 0.31 0.00 0.00 61.69 61.26 1mio s THR 239 Cb -0.03 -2.45 0.18 0.00 0.01 0.00 0.00 72.50 70.21 1mio s THR 239 CO 0.01 0.51 0.79 -0.76 -0.69 0.00 0.00 174.62 174.48 1mio s LEU 240 N 0.43 6.23 0.00 4.42 2.01 0.20 -4.15 118.68 127.82 1mio s LEU 240 Ca -0.07 -2.32 0.00 0.00 0.01 0.00 0.00 54.13 51.75 1mio s LEU 240 Cb -0.15 -2.25 0.00 0.00 0.01 0.00 0.00 46.19 43.79 1mio s LEU 240 CO 0.04 -0.76 0.00 0.35 1.01 0.00 0.00 176.35 176.99 1mio n THR 241 N 4.59 0.00 0.00 5.49 -2.24 -1.22 -1.76 114.28 119.13 1mio n THR 241 Ca 0.10 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.88 1mio n THR 241 Cb 0.46 0.00 0.00 0.00 -2.10 0.00 0.00 70.33 68.69 1mio n THR 241 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1mio n GLY 242 N 0.00 2.10 2.68 3.38 0.00 0.20 -1.07 105.19 112.49 1mio n GLY 242 Ca 0.00 0.27 -0.33 0.00 0.00 0.00 0.00 46.02 45.97 1mio n GLY 242 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 1mio n ASP 243 N 1.79 5.96 -4.79 1.61 2.03 -1.26 -4.58 116.55 117.31 1mio n ASP 243 Ca 0.00 -3.77 -0.39 0.00 0.52 0.00 0.00 54.79 51.16 1mio n ASP 243 Cb 0.00 -0.74 -0.06 0.00 -0.72 0.00 0.00 41.12 39.60 1mio n ASP 243 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 1mio s ALA 244 N -3.79 3.55 0.42 -1.67 0.00 -0.23 -4.87 121.76 115.17 1mio s ALA 244 Ca 0.49 0.02 -0.14 0.00 0.00 0.00 0.00 51.96 52.34 1mio s ALA 244 Cb 0.41 -2.67 -0.08 0.00 0.00 0.00 0.00 23.12 20.78 1mio s ALA 244 CO -0.28 0.31 0.83 0.95 0.00 0.00 0.00 175.76 177.56 1mio s THR 245 N -0.73 4.67 0.35 0.00 -4.23 -1.26 -2.43 115.64 112.00 1mio s THR 245 Ca 0.29 0.91 0.05 0.00 -1.18 0.00 0.00 61.69 61.77 1mio s THR 245 Cb -0.19 -3.69 0.29 0.00 1.34 0.00 0.00 72.50 70.25 1mio s THR 245 CO 0.18 -0.47 1.94 0.22 -0.54 0.00 0.00 174.62 175.95 1mio h TYR 246 N 1.44 0.82 0.32 3.99 3.20 -1.92 -2.69 116.97 122.13 1mio h TYR 246 Ca -0.47 0.02 -0.01 0.00 3.14 0.00 0.00 58.73 61.41 1mio h TYR 246 Cb 1.18 -0.27 -0.00 0.00 1.54 0.00 0.00 36.73 39.18 1mio h TYR 246 CO 0.62 0.42 -0.19 0.93 -1.64 0.00 0.00 178.16 178.30 1mio h GLU 247 N 0.80 -0.46 0.00 1.82 3.07 -1.98 -1.15 114.58 116.68 1mio h GLU 247 Ca 0.34 0.03 0.00 0.00 -0.50 0.00 0.00 59.36 59.23 1mio h GLU 247 Cb 0.29 0.10 0.00 0.00 -0.84 0.00 0.00 28.75 28.30 1mio h GLU 247 CO -0.12 -0.31 0.00 0.36 -1.40 0.00 0.00 179.01 177.54 1mio n LYS 248 N -5.31 0.42 0.07 2.33 2.85 -1.03 -1.78 118.16 115.70 1mio n LYS 248 Ca -0.10 0.06 -0.22 0.00 -1.05 0.00 0.00 58.31 57.00 1mio n LYS 248 Cb 0.22 -1.50 -0.15 0.00 -0.65 0.00 0.00 35.03 32.96 1mio n LYS 248 CO 0.00 0.00 0.00 0.28 -0.05 0.00 0.00 177.40 177.63 1mio h VAL 249 N 0.00 1.26 0.00 0.58 2.07 -1.17 -3.09 116.25 115.90 1mio h VAL 249 Ca 0.00 -2.54 0.00 0.00 0.82 0.00 0.00 66.70 64.98 1mio h VAL 249 Cb 0.11 2.98 0.00 0.00 -1.52 0.00 0.00 31.29 32.86 1mio h VAL 249 CO 0.00 0.75 0.05 1.56 0.02 0.00 0.00 177.57 179.96 1mio h GLN 250 N -0.17 0.00 -0.04 1.57 4.20 -0.41 0.65 115.11 120.91 1mio h GLN 250 Ca -0.24 0.00 -0.02 0.00 0.06 0.00 0.00 58.65 58.45 1mio h GLN 250 Cb 1.86 0.00 -0.01 0.00 0.30 0.00 0.00 27.48 29.63 1mio h GLN 250 CO 0.16 0.00 -0.45 0.09 -0.67 0.00 0.00 178.83 177.96 1mio n ASN 251 N -2.61 1.80 0.29 1.46 3.02 -1.07 -0.22 115.26 117.93 1mio n ASN 251 Ca -0.02 -3.88 0.18 0.00 -0.03 0.00 0.00 54.58 50.83 1mio n ASN 251 Cb 0.10 -0.54 0.80 0.00 -0.61 0.00 0.00 39.78 39.54 1mio n ASN 251 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1mio h ALA 252 N 0.98 1.02 0.00 5.41 0.00 -0.77 -2.97 119.26 122.94 1mio h ALA 252 Ca 0.02 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.91 1mio h ALA 252 Cb 1.07 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.85 1mio h ALA 252 CO 0.04 0.03 0.00 -0.40 0.00 0.00 0.00 179.25 178.92 1mio n ASP 253 N -3.15 0.00 -2.62 0.00 5.75 -1.26 -4.08 116.55 111.18 1mio n ASP 253 Ca -0.00 -0.35 -0.35 0.00 -0.01 0.00 0.00 54.79 54.07 1mio n ASP 253 Cb 0.25 -0.16 0.04 0.00 -1.03 0.00 0.00 41.12 40.23 1mio n ASP 253 CO 0.00 0.00 0.00 0.29 -0.11 0.00 0.00 177.20 177.38 1mio n LYS 254 N -1.16 2.92 -4.37 0.11 5.02 -1.12 -4.91 118.16 114.64 1mio n LYS 254 Ca 0.14 -3.67 -0.19 0.00 -2.02 0.00 0.00 58.31 52.56 1mio n LYS 254 Cb 0.14 -2.27 -0.10 0.00 -0.02 0.00 0.00 35.03 32.77 1mio n LYS 254 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1mio s ALA 255 N -3.89 2.13 -0.22 7.82 0.00 -1.26 -4.39 121.76 121.95 1mio s ALA 255 Ca 0.55 -1.74 -0.04 0.00 0.00 0.00 0.00 51.96 50.72 1mio s ALA 255 Cb 0.45 0.01 -0.19 0.00 0.00 0.00 0.00 23.12 23.39 1mio s ALA 255 CO -0.24 0.02 -0.05 -0.25 0.00 0.00 0.00 175.76 175.23 1mio n ASP 256 N -0.45 2.01 -4.19 0.00 8.00 0.34 -4.91 116.55 117.35 1mio n ASP 256 Ca -0.07 0.06 -0.25 0.00 0.71 0.00 0.00 54.79 55.24 1mio n ASP 256 Cb 0.61 -0.63 -0.15 0.00 -0.02 0.00 0.00 41.12 40.93 1mio n ASP 256 CO 0.00 0.00 0.00 -0.22 -0.39 0.00 0.00 177.20 176.59 1mio s LEU 257 N -6.90 2.07 -0.20 0.64 2.96 -1.24 -4.20 118.68 111.81 1mio s LEU 257 Ca -0.32 -0.38 -0.02 0.00 -0.22 0.00 0.00 54.13 53.19 1mio s LEU 257 Cb 0.09 -0.94 0.00 0.00 0.50 0.00 0.00 46.19 45.84 1mio s LEU 257 CO 0.63 0.20 -0.10 0.20 -1.32 0.00 0.00 176.35 175.97 1mio s ASN 258 N -0.62 3.91 -0.41 3.68 0.01 -0.28 -2.76 114.94 118.46 1mio s ASN 258 Ca 0.07 -0.47 -0.17 0.00 -0.71 0.00 0.00 52.86 51.57 1mio s ASN 258 Cb -0.07 -1.65 0.02 0.00 0.41 0.00 0.00 41.25 39.95 1mio s ASN 258 CO -0.00 -0.01 0.44 -0.76 -1.51 0.00 0.00 177.10 175.26 1mio s LEU 259 N 1.37 4.78 -0.29 0.60 1.43 -0.86 -0.80 118.68 124.91 1mio s LEU 259 Ca 0.05 -0.59 -0.20 0.00 -1.03 0.00 0.00 54.13 52.36 1mio s LEU 259 Cb -0.14 -2.40 -0.01 0.00 0.03 0.00 0.00 46.19 43.66 1mio s LEU 259 CO -0.06 -0.56 0.61 0.54 0.23 0.00 0.00 176.35 177.11 1mio s VAL 260 N 2.16 4.98 -0.02 -1.59 0.11 -0.69 -0.25 120.40 125.10 1mio s VAL 260 Ca 0.13 0.91 -0.01 0.00 -2.93 0.00 0.00 61.98 60.08 1mio s VAL 260 Cb -0.17 -3.95 -0.00 0.00 -1.53 0.00 0.00 36.38 30.73 1mio s VAL 260 CO 0.14 -0.06 -0.02 1.67 -3.33 0.00 0.00 175.10 173.49 1mio n GLN 261 N 5.77 0.05 -2.78 1.54 -0.06 -0.14 -1.43 117.38 120.33 1mio n GLN 261 Ca -0.02 0.25 -0.43 0.00 -2.00 0.00 0.00 57.00 54.80 1mio n GLN 261 Cb 0.49 -0.82 -0.03 0.00 -4.06 0.00 0.00 30.24 25.81 1mio n GLN 261 CO 0.00 0.00 0.00 0.00 -0.20 0.00 0.00 177.06 176.86 1mio h HIS 263 N 8.30 0.84 -0.41 0.00 2.76 -1.86 -3.21 115.15 121.57 1mio h HIS 263 Ca -0.23 -0.34 -0.11 0.00 -2.20 0.00 0.00 60.37 57.49 1mio h HIS 263 Cb 1.08 -0.14 -0.02 0.00 1.55 0.00 0.00 27.41 29.88 1mio h HIS 263 CO 0.82 1.13 -0.20 -0.09 -1.30 0.00 0.00 177.93 178.30 1mio h ARG 264 N 0.46 0.80 0.01 5.26 9.65 -1.91 -3.21 114.38 125.43 1mio h ARG 264 Ca -0.02 -0.31 -0.00 0.00 -1.10 0.00 0.00 59.98 58.55 1mio h ARG 264 Cb 1.27 -0.04 0.00 0.00 -1.39 0.00 0.00 29.97 29.81 1mio h ARG 264 CO 0.13 0.93 -0.00 0.66 2.80 0.00 0.00 179.97 184.49 1mio h SER 265 N 0.70 -0.01 -2.16 -3.80 4.64 -1.89 -3.40 113.55 107.63 1mio h SER 265 Ca 0.10 0.00 -0.71 0.00 -0.47 0.00 0.00 61.79 60.71 1mio h SER 265 Cb 0.71 0.00 -0.34 0.00 -0.31 0.00 0.00 62.40 62.47 1mio h SER 265 CO 0.05 0.04 0.31 2.30 -0.87 0.00 0.00 176.83 178.66 1mio n ILE 266 N -2.27 4.42 0.13 0.95 -5.35 -1.21 -4.51 119.36 111.52 1mio n ILE 266 Ca -0.00 -5.54 0.06 0.00 -0.27 0.00 0.00 62.75 56.99 1mio n ILE 266 Cb 0.00 -1.43 0.03 0.00 -1.74 0.00 0.00 39.64 36.50 1mio n ILE 266 CO 0.00 0.00 0.00 -0.55 -1.76 0.00 0.00 176.55 174.24 1mio h ASN 267 N 3.49 0.00 -0.43 7.28 7.08 -1.77 -2.93 115.58 128.29 1mio h ASN 267 Ca 0.38 0.00 -0.14 0.00 -3.08 0.00 0.00 56.30 53.46 1mio h ASN 267 Cb 0.40 0.00 -0.01 0.00 -2.08 0.00 0.00 38.32 36.63 1mio h ASN 267 CO 1.06 0.32 -0.29 1.88 -2.08 0.00 0.00 177.43 178.32 1mio h TYR 268 N 0.00 1.13 -0.06 4.14 0.05 -1.89 -2.33 116.97 118.01 1mio h TYR 268 Ca -0.04 -0.30 -0.01 0.00 0.05 0.00 0.00 58.73 58.43 1mio h TYR 268 Cb 1.27 -0.25 -0.00 0.00 1.01 0.00 0.00 36.73 38.76 1mio h TYR 268 CO 0.00 1.13 0.00 0.82 -1.05 0.00 0.00 178.16 179.07 1mio h ILE 269 N 0.80 1.23 -0.57 -2.88 1.08 -1.86 -2.08 117.51 113.23 1mio h ILE 269 Ca 0.09 -0.71 0.10 0.00 -0.39 0.00 0.00 64.86 63.94 1mio h ILE 269 Cb 0.88 1.61 -0.08 0.00 -3.07 0.00 0.00 36.82 36.16 1mio h ILE 269 CO 0.08 0.20 0.14 0.00 -0.69 0.00 0.00 178.15 177.88 1mio h ALA 270 N 0.74 0.68 -1.14 1.87 0.00 -1.33 0.74 119.26 120.82 1mio h ALA 270 Ca 0.02 0.11 0.00 0.00 0.00 0.00 0.00 54.91 55.04 1mio h ALA 270 Cb 0.31 0.14 0.00 0.00 0.00 0.00 0.00 17.79 18.23 1mio h ALA 270 CO 0.00 -0.28 0.00 -1.91 0.00 0.00 0.00 179.25 177.06 1mio n GLU 271 N -5.09 0.00 0.24 0.00 2.13 -0.89 -2.15 120.64 114.87 1mio n GLU 271 Ca 0.08 0.33 0.17 0.00 0.66 0.00 0.00 57.16 58.40 1mio n GLU 271 Cb 0.29 -1.31 0.87 0.00 0.27 0.00 0.00 31.44 31.56 1mio n GLU 271 CO 0.00 0.00 0.00 0.52 -0.41 0.00 0.00 177.13 177.24 1mio h MET 272 N 0.00 0.00 -0.15 5.31 2.86 -1.04 -2.06 114.93 119.85 1mio h MET 272 Ca 0.00 0.00 -0.11 0.00 -2.06 0.00 0.00 59.70 57.53 1mio h MET 272 Cb 0.00 0.00 0.00 0.00 0.06 0.00 0.00 31.60 31.66 1mio h MET 272 CO 0.00 0.00 -0.33 0.52 1.06 0.00 0.00 176.91 178.16 1mio h MET 273 N 0.00 0.48 0.81 1.72 2.86 -0.88 -1.32 114.93 118.60 1mio h MET 273 Ca 0.06 -0.32 -0.04 0.00 -2.06 0.00 0.00 59.70 57.34 1mio h MET 273 Cb 0.34 0.04 0.00 0.00 0.06 0.00 0.00 31.60 32.05 1mio h MET 273 CO -0.00 0.93 -0.46 1.49 1.06 0.00 0.00 176.91 179.93 1mio h GLU 274 N 0.10 -1.13 0.00 1.72 4.81 -0.86 -1.96 114.58 117.25 1mio h GLU 274 Ca 0.00 0.08 0.00 0.00 -0.13 0.00 0.00 59.36 59.31 1mio h GLU 274 Cb 0.93 0.26 0.00 0.00 0.63 0.00 0.00 28.75 30.57 1mio h GLU 274 CO 0.07 -0.76 0.09 1.15 -0.73 0.00 0.00 179.01 178.84 1mio h THR 275 N -1.18 0.00 0.00 0.32 2.02 -1.45 0.66 112.91 113.28 1mio h THR 275 Ca -0.11 0.00 -0.33 0.00 0.77 0.00 0.00 66.41 66.74 1mio h THR 275 Cb 0.93 0.88 -0.06 0.00 -1.74 0.00 0.00 68.15 68.15 1mio h THR 275 CO 0.14 0.00 -2.25 1.17 0.37 0.00 0.00 175.52 174.95 1mio n LYS 276 N -2.97 0.99 0.00 6.66 3.00 -0.50 -3.32 118.16 122.02 1mio n LYS 276 Ca -0.03 0.01 0.00 0.00 -0.00 0.00 0.00 58.31 58.29 1mio n LYS 276 Cb 0.15 -1.46 0.00 0.00 0.00 0.00 0.00 35.03 33.72 1mio n LYS 276 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.40 178.06 1mio n TYR 277 N -2.73 0.00 -0.72 5.64 4.01 -0.74 -0.61 117.16 122.01 1mio n TYR 277 Ca -0.31 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.43 1mio n TYR 277 Cb 1.07 0.00 0.00 0.00 -0.31 0.00 0.00 39.34 40.10 1mio n TYR 277 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 1mio n GLY 278 N 1.27 0.59 3.51 2.72 0.00 0.23 -0.82 105.19 112.70 1mio n GLY 278 Ca 0.00 -0.42 -0.43 0.00 0.00 0.00 0.00 46.02 45.18 1mio n GLY 278 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1mio s ILE 279 N -2.00 4.36 0.39 -0.61 1.01 -1.24 -4.01 121.20 119.10 1mio s ILE 279 Ca 0.00 0.17 -0.27 0.00 0.00 0.00 0.00 60.65 60.55 1mio s ILE 279 Cb 0.00 -4.58 -0.10 0.00 0.01 0.00 0.00 42.46 37.80 1mio s ILE 279 CO 0.00 -1.20 1.42 -2.16 0.00 0.00 0.00 174.94 173.00 1mio s PRO 280 N 4.02 4.01 -0.02 2.79 0.04 -1.26 -3.52 135.00 141.05 1mio s PRO 280 Ca 0.29 2.42 -0.03 0.00 0.04 0.00 0.00 61.00 63.72 1mio s PRO 280 Cb -0.13 -2.87 -0.04 0.00 0.04 0.00 0.00 34.50 31.50 1mio s PRO 280 CO 0.17 -0.56 0.16 1.67 0.04 0.00 0.00 177.00 178.49 1mio s TRP 281 N -1.17 3.50 0.23 0.56 1.48 -1.26 -1.13 118.94 121.15 1mio s TRP 281 Ca 0.55 0.34 0.10 0.00 -1.06 0.00 0.00 56.10 56.03 1mio s TRP 281 Cb -0.44 -1.82 -0.04 0.00 -1.16 0.00 0.00 33.47 30.01 1mio s TRP 281 CO 0.58 0.64 -0.10 0.96 -4.06 0.00 0.00 176.95 174.96 1mio s ILE 282 N -1.27 3.03 -0.50 0.66 -4.36 0.02 0.64 121.20 119.42 1mio s ILE 282 Ca 0.25 -1.93 -0.25 0.00 -0.26 0.00 0.00 60.65 58.46 1mio s ILE 282 Cb -0.12 -2.55 0.03 0.00 1.25 0.00 0.00 42.46 41.06 1mio s ILE 282 CO 0.16 -0.25 0.96 -0.75 0.24 0.00 0.00 174.94 175.30 1mio s LYS 283 N -3.21 3.47 0.32 0.37 2.47 0.29 -1.71 119.74 121.74 1mio s LYS 283 Ca 0.27 0.04 0.07 0.00 -1.56 0.00 0.00 55.97 54.79 1mio s LYS 283 Cb -0.07 -3.98 -0.02 0.00 -1.46 0.00 0.00 37.83 32.30 1mio s LYS 283 CO 0.16 -1.36 0.39 0.00 0.16 0.00 0.00 175.35 174.70 1mio s ASN 285 N -4.07 -0.33 -0.33 0.00 2.47 -1.26 -4.46 114.94 106.96 1mio s ASN 285 Ca 0.41 0.34 0.09 0.00 0.42 0.00 0.00 52.86 54.13 1mio s ASN 285 Cb -0.08 1.48 0.70 0.00 -1.45 0.00 0.00 41.25 41.90 1mio s ASN 285 CO 0.29 -0.29 1.77 0.49 -3.72 0.00 0.00 177.10 175.63 1mio n PHE 286 N 5.39 2.31 -3.82 0.43 3.01 -1.26 -2.32 117.46 121.20 1mio n PHE 286 Ca -0.02 -1.32 -0.36 0.00 1.01 0.00 0.00 57.45 56.77 1mio n PHE 286 Cb 0.50 -0.68 -0.13 0.00 -0.01 0.00 0.00 39.48 39.16 1mio n PHE 286 CO 0.00 0.00 0.00 0.42 1.01 0.00 0.00 176.76 178.19 1mio s ILE 287 N -3.06 3.88 0.00 4.37 1.09 -1.26 -1.57 121.20 124.65 1mio s ILE 287 Ca 0.54 -0.36 0.00 0.00 -1.10 0.00 0.00 60.65 59.72 1mio s ILE 287 Cb 0.44 -2.82 0.00 0.00 -1.06 0.00 0.00 42.46 39.02 1mio s ILE 287 CO 0.11 0.35 0.00 0.61 -0.10 0.00 0.00 174.94 175.91 1mio n GLY 288 N 4.86 0.97 0.25 6.18 0.00 -1.26 -4.15 105.19 112.03 1mio n GLY 288 Ca -0.17 -1.45 0.10 0.00 0.00 0.00 0.00 46.02 44.51 1mio n GLY 288 CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 1mio h VAL 289 N 0.00 0.72 0.05 1.61 2.07 -1.93 -0.91 116.25 117.86 1mio h VAL 289 Ca 0.00 -0.67 -0.00 0.00 0.82 0.00 0.00 66.70 66.85 1mio h VAL 289 Cb 0.00 1.41 0.00 0.00 -1.52 0.00 0.00 31.29 31.18 1mio h VAL 289 CO 0.00 0.16 -0.02 0.44 0.02 0.00 0.00 177.57 178.17 1mio h ASP 290 N 0.00 -0.05 -0.57 0.57 3.32 -1.95 -1.80 116.42 115.93 1mio h ASP 290 Ca -0.00 -0.58 0.12 0.00 0.02 0.00 0.00 57.03 56.59 1mio h ASP 290 Cb 0.40 0.01 -0.10 0.00 0.22 0.00 0.00 39.33 39.86 1mio h ASP 290 CO 0.02 0.59 -0.09 1.23 -1.72 0.00 0.00 179.24 179.28 1mio h GLY 291 N -0.74 0.48 1.05 2.75 0.00 -1.58 -2.36 103.07 102.68 1mio h GLY 291 Ca -0.01 0.15 -0.20 0.00 0.00 0.00 0.00 47.33 47.27 1mio h GLY 291 CO 0.01 -0.20 -0.71 1.19 0.00 0.00 0.00 176.54 176.83 1mio h ILE 292 N 0.04 1.32 -0.56 2.60 2.10 -0.77 -2.95 117.51 119.29 1mio h ILE 292 Ca 0.28 -1.96 -0.04 0.00 1.08 0.00 0.00 64.86 64.22 1mio h ILE 292 Cb 0.44 2.14 -0.03 0.00 -1.09 0.00 0.00 36.82 38.29 1mio h ILE 292 CO -0.55 0.61 0.19 -0.37 -1.08 0.00 0.00 178.15 176.95 1mio h VAL 293 N 0.34 1.21 0.00 2.19 -1.51 -0.81 -2.65 116.25 115.02 1mio h VAL 293 Ca -0.06 -0.71 -0.19 0.00 -1.23 0.00 0.00 66.70 64.52 1mio h VAL 293 Cb 1.35 0.58 0.02 0.00 -2.13 0.00 0.00 31.29 31.11 1mio h VAL 293 CO 0.15 0.27 -0.73 1.05 -1.23 0.00 0.00 177.57 177.07 1mio h GLU 294 N 0.81 0.49 -0.91 5.19 4.11 -1.54 -2.06 114.58 120.67 1mio h GLU 294 Ca 0.19 -0.53 0.15 0.00 0.07 0.00 0.00 59.36 59.24 1mio h GLU 294 Cb 0.21 0.15 -0.16 0.00 0.50 0.00 0.00 28.75 29.46 1mio h GLU 294 CO -0.01 1.17 -0.31 2.41 0.07 0.00 0.00 179.01 182.34 1mio n THR 295 N -4.11 -0.45 -0.17 -1.06 -1.04 -1.11 -0.84 114.28 105.50 1mio n THR 295 Ca -0.11 2.12 -0.08 0.00 -2.04 0.00 0.00 64.05 63.94 1mio n THR 295 Cb 0.74 -2.84 0.01 0.00 -1.82 0.00 0.00 70.33 66.42 1mio n THR 295 CO 0.00 0.00 0.00 -0.07 -0.64 0.00 0.00 175.07 174.36 1mio h LEU 296 N 0.00 0.65 -0.12 -4.42 4.07 -1.37 0.90 115.31 115.01 1mio h LEU 296 Ca 0.36 -0.14 -0.01 0.00 0.08 0.00 0.00 57.88 58.17 1mio h LEU 296 Cb 0.58 -0.17 -0.00 0.00 1.08 0.00 0.00 40.66 42.15 1mio h LEU 296 CO -0.91 0.60 0.03 0.03 -1.08 0.00 0.00 178.44 177.11 1mio h ARG 297 N 0.65 0.19 -0.08 1.13 3.08 -0.40 -2.23 114.38 116.72 1mio h ARG 297 Ca 0.17 -0.05 -0.06 0.00 0.07 0.00 0.00 59.98 60.11 1mio h ARG 297 Cb 0.13 -0.03 -0.01 0.00 0.08 0.00 0.00 29.97 30.15 1mio h ARG 297 CO -0.02 0.36 -0.21 -0.44 -1.07 0.00 0.00 179.97 178.58 1mio h ASP 298 N -0.01 0.13 -0.71 7.04 5.19 -0.79 -0.33 116.42 126.95 1mio h ASP 298 Ca 0.04 -0.03 -0.05 0.00 -0.62 0.00 0.00 57.03 56.37 1mio h ASP 298 Cb 0.25 -0.04 -0.03 0.00 0.18 0.00 0.00 39.33 39.69 1mio h ASP 298 CO 0.00 0.36 0.26 0.24 -3.12 0.00 0.00 179.24 176.98 1mio h MET 299 N 0.13 1.10 -0.26 3.56 2.86 -0.68 -2.21 114.93 119.44 1mio h MET 299 Ca 0.02 -0.21 -0.16 0.00 -2.06 0.00 0.00 59.70 57.29 1mio h MET 299 Cb 0.46 -0.17 -0.00 0.00 0.06 0.00 0.00 31.60 31.94 1mio h MET 299 CO 0.03 0.92 -0.50 0.00 1.06 0.00 0.00 176.91 178.42 1mio h ALA 300 N 1.21 0.63 -1.00 6.32 0.00 -0.67 -1.91 119.26 123.84 1mio h ALA 300 Ca 0.24 -0.49 0.11 0.00 0.00 0.00 0.00 54.91 54.76 1mio h ALA 300 Cb 0.25 -0.09 -0.08 0.00 0.00 0.00 0.00 17.79 17.87 1mio h ALA 300 CO -0.01 0.68 0.63 0.87 0.00 0.00 0.00 179.25 181.42 1mio h LYS 301 N 0.56 1.01 0.05 0.00 1.57 -0.69 -2.98 116.57 116.09 1mio h LYS 301 Ca 0.02 -0.06 -0.24 0.00 -1.87 0.00 0.00 60.65 58.51 1mio h LYS 301 Cb 1.07 -0.23 -0.00 0.00 0.08 0.00 0.00 32.23 33.15 1mio h LYS 301 CO 0.10 0.67 -1.04 0.00 -0.57 0.00 0.00 179.45 178.61 1mio n PHE 303 N -3.62 2.48 -1.82 0.00 3.01 -0.75 -4.98 117.46 111.78 1mio n PHE 303 Ca -0.06 -2.58 -0.38 0.00 1.01 0.00 0.00 57.45 55.44 1mio n PHE 303 Cb 0.90 -1.28 -0.03 0.00 -0.01 0.00 0.00 39.48 39.07 1mio n PHE 303 CO 0.00 0.00 0.00 0.34 1.01 0.00 0.00 176.76 178.11 1mio s ASP 304 N -1.44 5.01 -0.32 4.37 -1.08 -1.14 -4.74 116.67 117.33 1mio s ASP 304 Ca 0.35 0.83 0.02 0.00 -0.52 0.00 0.00 52.55 53.23 1mio s ASP 304 Cb 0.11 -2.52 0.16 0.00 -1.46 0.00 0.00 42.92 39.22 1mio s ASP 304 CO -0.00 -2.49 0.40 -0.62 0.52 0.00 0.00 175.17 172.98 1mio s ASP 305 N 9.54 0.66 0.04 -0.34 -1.08 -1.26 -5.07 116.67 119.15 1mio s ASP 305 Ca 0.82 -0.79 -0.08 0.00 -0.52 0.00 0.00 52.55 51.98 1mio s ASP 305 Cb -0.17 0.93 -0.02 0.00 -1.46 0.00 0.00 42.92 42.21 1mio s ASP 305 CO 0.25 -0.32 0.41 -0.81 0.52 0.00 0.00 175.17 175.21 1mio n PRO 306 N 4.99 -0.12 -0.11 4.34 -0.04 -1.26 -0.05 135.00 142.75 1mio n PRO 306 Ca 0.04 0.40 -0.08 0.00 -0.04 0.00 0.00 63.50 63.82 1mio n PRO 306 Cb 0.48 -0.59 -0.00 0.00 -0.04 0.00 0.00 33.50 33.36 1mio n PRO 306 CO 0.00 0.00 0.00 0.93 -0.04 0.00 0.00 175.50 176.39 1mio h GLU 307 N 0.00 0.41 -0.47 0.54 3.07 -1.98 -0.60 114.58 115.55 1mio h GLU 307 Ca 0.04 -0.02 -0.05 0.00 -0.50 0.00 0.00 59.36 58.83 1mio h GLU 307 Cb 0.11 -0.09 -0.02 0.00 -0.84 0.00 0.00 28.75 27.90 1mio h GLU 307 CO -0.25 0.27 0.09 1.25 -1.40 0.00 0.00 179.01 178.97 1mio h LEU 308 N 0.42 0.68 -0.69 1.33 7.12 -0.81 0.30 115.31 123.65 1mio h LEU 308 Ca 0.14 -0.12 -0.01 0.00 0.13 0.00 0.00 57.88 58.02 1mio h LEU 308 Cb -0.00 -0.18 -0.00 0.00 -0.53 0.00 0.00 40.66 39.95 1mio h LEU 308 CO -0.06 0.69 -0.03 0.74 -0.13 0.00 0.00 178.44 179.65 1mio h THR 309 N 0.70 0.06 0.00 1.05 2.02 -0.08 -2.53 112.91 114.13 1mio h THR 309 Ca 0.15 -0.84 -0.37 0.00 0.77 0.00 0.00 66.41 66.12 1mio h THR 309 Cb 0.30 1.79 -0.07 0.00 -1.74 0.00 0.00 68.15 68.43 1mio h THR 309 CO 0.00 0.03 -2.39 2.29 0.37 0.00 0.00 175.52 175.82 1mio n LYS 310 N -3.12 0.68 -0.29 6.66 -0.00 -0.28 -3.91 118.16 117.90 1mio n LYS 310 Ca 0.02 0.04 0.06 0.00 -0.00 0.00 0.00 58.31 58.43 1mio n LYS 310 Cb 0.44 -1.53 0.21 0.00 -0.00 0.00 0.00 35.03 34.15 1mio n LYS 310 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.40 177.40 1mio h ARG 311 N 0.00 0.57 -0.14 -1.58 3.08 -0.43 0.21 114.38 116.10 1mio h ARG 311 Ca -0.55 -0.03 0.02 0.00 0.07 0.00 0.00 59.98 59.49 1mio h ARG 311 Cb 2.16 -0.13 -0.02 0.00 0.08 0.00 0.00 29.97 32.06 1mio h ARG 311 CO 0.00 0.38 0.01 1.79 -1.07 0.00 0.00 179.97 181.08 1mio h THR 312 N 0.59 0.91 -0.35 2.04 1.35 -1.62 -1.40 112.91 114.44 1mio h THR 312 Ca 0.45 -0.02 -0.02 0.00 -0.55 0.00 0.00 66.41 66.27 1mio h THR 312 Cb 0.63 0.85 -0.02 0.00 -1.73 0.00 0.00 68.15 67.88 1mio h THR 312 CO -0.36 0.01 0.14 -0.33 -0.25 0.00 0.00 175.52 174.72 1mio h GLU 313 N 0.06 0.49 0.59 4.72 3.07 -1.26 -0.47 114.58 121.77 1mio h GLU 313 Ca 0.06 -0.06 -0.03 0.00 -0.50 0.00 0.00 59.36 58.84 1mio h GLU 313 Cb 0.07 -0.09 0.01 0.00 -0.84 0.00 0.00 28.75 27.89 1mio h GLU 313 CO -0.10 0.41 -0.28 0.93 -1.40 0.00 0.00 179.01 178.56 1mio h GLU 314 N 0.49 -0.76 -0.55 2.33 4.39 -0.26 -3.14 114.58 117.06 1mio h GLU 314 Ca 0.12 0.05 -0.04 0.00 0.34 0.00 0.00 59.36 59.83 1mio h GLU 314 Cb 0.11 0.17 -0.02 0.00 -0.10 0.00 0.00 28.75 28.91 1mio h GLU 314 CO -0.01 -0.50 0.19 0.28 -1.16 0.00 0.00 179.01 177.82 1mio h VAL 315 N -1.19 1.23 -0.39 3.13 2.07 -1.23 -2.44 116.25 117.44 1mio h VAL 315 Ca -0.08 -0.75 0.07 0.00 0.82 0.00 0.00 66.70 66.76 1mio h VAL 315 Cb 0.62 0.68 -0.09 0.00 -1.52 0.00 0.00 31.29 30.98 1mio h VAL 315 CO 0.13 0.28 -0.39 0.40 0.02 0.00 0.00 177.57 178.02 1mio h ILE 316 N 0.77 0.16 -0.49 4.57 2.04 -1.20 -1.56 117.51 121.79 1mio h ILE 316 Ca 0.18 0.00 -0.07 0.00 1.00 0.00 0.00 64.86 65.97 1mio h ILE 316 Cb 0.25 0.16 -0.02 0.00 -0.74 0.00 0.00 36.82 36.46 1mio h ILE 316 CO -0.01 0.00 0.03 0.00 0.00 0.00 0.00 178.15 178.17 1mio h ALA 317 N 0.53 0.66 -0.65 1.87 0.00 -1.49 -0.86 119.26 119.32 1mio h ALA 317 Ca 0.15 -0.27 -0.06 0.00 0.00 0.00 0.00 54.91 54.73 1mio h ALA 317 Cb 0.57 -0.18 -0.03 0.00 0.00 0.00 0.00 17.79 18.15 1mio h ALA 317 CO -0.55 0.44 0.17 1.05 0.00 0.00 0.00 179.25 180.36 1mio h GLU 318 N 0.71 1.02 -0.07 0.00 4.11 -1.34 -1.84 114.58 117.18 1mio h GLU 318 Ca 0.14 -0.24 -0.11 0.00 0.07 0.00 0.00 59.36 59.23 1mio h GLU 318 Cb 0.47 -0.14 -0.01 0.00 0.50 0.00 0.00 28.75 29.57 1mio h GLU 318 CO 0.02 0.91 -0.46 1.49 0.07 0.00 0.00 179.01 181.04 1mio h GLU 319 N 0.95 0.16 0.04 1.06 4.81 -1.04 -2.34 114.58 118.21 1mio h GLU 319 Ca 0.20 -0.08 -0.22 0.00 -0.13 0.00 0.00 59.36 59.13 1mio h GLU 319 Cb 0.34 0.00 -0.01 0.00 0.63 0.00 0.00 28.75 29.71 1mio h GLU 319 CO -0.00 0.59 -1.00 0.82 -0.73 0.00 0.00 179.01 178.69 1mio h ILE 320 N 0.13 1.52 -0.10 2.32 2.04 -1.03 -2.71 117.51 119.68 1mio h ILE 320 Ca 0.01 -2.83 0.04 0.00 1.00 0.00 0.00 64.86 63.08 1mio h ILE 320 Cb 0.87 2.64 -0.05 0.00 -0.74 0.00 0.00 36.82 39.54 1mio h ILE 320 CO 0.07 0.82 -0.17 0.00 0.00 0.00 0.00 178.15 178.87 1mio h ALA 321 N 0.85 -0.13 -0.84 1.87 0.00 -1.19 -0.88 119.26 118.94 1mio h ALA 321 Ca -0.07 0.04 0.20 0.00 0.00 0.00 0.00 54.91 55.08 1mio h ALA 321 Cb 1.67 0.34 -0.15 0.00 0.00 0.00 0.00 17.79 19.64 1mio h ALA 321 CO 0.15 -0.64 -0.03 0.00 0.00 0.00 0.00 179.25 178.74 1mio h ALA 322 N 0.77 0.86 -0.61 0.00 0.00 -1.37 -1.69 119.26 117.22 1mio h ALA 322 Ca 0.09 0.29 0.00 0.00 0.00 0.00 0.00 54.91 55.28 1mio h ALA 322 Cb 0.36 0.51 0.00 0.00 0.00 0.00 0.00 17.79 18.66 1mio h ALA 322 CO -0.23 -0.46 0.00 0.44 0.00 0.00 0.00 179.25 179.00 1mio n ILE 323 N -5.42 1.74 0.16 0.00 -6.64 -1.03 -4.79 119.36 103.38 1mio n ILE 323 Ca 0.16 -1.22 -0.14 0.00 -1.77 0.00 0.00 62.75 59.79 1mio n ILE 323 Cb 0.55 0.16 -0.08 0.00 -1.44 0.00 0.00 39.64 38.83 1mio n ILE 323 CO 0.00 0.00 0.00 -0.61 -1.77 0.00 0.00 176.55 174.17 1mio h GLN 324 N 3.80 -0.38 -0.07 6.28 5.75 -0.18 -3.02 115.11 127.30 1mio h GLN 324 Ca 0.00 0.03 0.02 0.00 -0.15 0.00 0.00 58.65 58.55 1mio h GLN 324 Cb 1.37 0.09 -0.00 0.00 1.07 0.00 0.00 27.48 30.00 1mio h GLN 324 CO 0.20 -0.09 0.17 -0.44 -2.65 0.00 0.00 178.83 176.02 1mio h ASP 325 N -0.67 0.00 0.00 -0.69 5.19 -1.87 -2.22 116.42 116.16 1mio h ASP 325 Ca -0.04 0.00 -0.11 0.00 -0.62 0.00 0.00 57.03 56.26 1mio h ASP 325 Cb 0.47 0.00 -0.02 0.00 0.18 0.00 0.00 39.33 39.96 1mio h ASP 325 CO 0.07 0.00 -1.68 -0.90 -3.12 0.00 0.00 179.24 173.61 1mio n ASP 326 N -3.31 2.21 -0.18 6.45 5.75 -1.23 -3.74 116.55 122.49 1mio n ASP 326 Ca -0.01 0.00 -0.03 0.00 -0.01 0.00 0.00 54.79 54.74 1mio n ASP 326 Cb 0.25 1.13 0.07 0.00 -1.03 0.00 0.00 41.12 41.54 1mio n ASP 326 CO 0.00 0.00 0.00 0.25 -0.11 0.00 0.00 177.20 177.34 1mio h LEU 327 N 0.00 0.27 -2.26 -2.12 5.85 -1.34 0.48 115.31 116.20 1mio h LEU 327 Ca -0.17 0.05 -0.04 0.00 0.84 0.00 0.00 57.88 58.57 1mio h LEU 327 Cb 1.18 0.01 -0.02 0.00 0.37 0.00 0.00 40.66 42.21 1mio h LEU 327 CO 0.01 0.18 0.04 -0.90 -0.34 0.00 0.00 178.44 177.44 1mio n ASP 328 N -4.95 3.16 -0.07 1.25 5.75 -0.87 -2.43 116.55 118.39 1mio n ASP 328 Ca 0.06 -2.46 -0.14 0.00 -0.01 0.00 0.00 54.79 52.23 1mio n ASP 328 Cb 0.20 -0.59 -0.05 0.00 -1.03 0.00 0.00 41.12 39.64 1mio n ASP 328 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 1mio n TYR 329 N 0.20 0.00 -0.32 2.11 9.36 -0.24 -4.17 117.16 124.09 1mio n TYR 329 Ca 0.15 0.00 0.17 0.00 3.32 0.00 0.00 57.90 61.54 1mio n TYR 329 Cb 0.73 -0.51 0.35 0.00 -0.63 0.00 0.00 39.34 39.28 1mio n TYR 329 CO 0.00 0.00 0.00 0.74 0.22 0.00 0.00 176.86 177.82 1mio h PHE 330 N -0.56 0.29 -0.35 2.98 0.04 -0.10 0.62 116.94 119.86 1mio h PHE 330 Ca -0.32 0.06 -0.03 0.00 2.80 0.00 0.00 57.97 60.48 1mio h PHE 330 Cb 1.19 0.03 -0.02 0.00 2.20 0.00 0.00 35.95 39.35 1mio h PHE 330 CO -0.09 -0.35 0.12 -0.22 -0.60 0.00 0.00 178.31 177.17 1mio h LYS 331 N 0.09 0.54 -1.08 1.51 3.64 -1.68 0.14 116.57 119.73 1mio h LYS 331 Ca 0.63 -0.11 0.29 0.00 -1.27 0.00 0.00 60.65 60.19 1mio h LYS 331 Cb 1.39 -0.08 -0.09 0.00 -0.41 0.00 0.00 32.23 33.04 1mio h LYS 331 CO -0.78 0.56 0.71 1.49 -2.27 0.00 0.00 179.45 179.16 1mio h GLU 332 N 0.42 0.29 0.00 1.90 4.81 -1.04 -1.21 114.58 119.75 1mio h GLU 332 Ca 0.11 -0.02 -0.37 0.00 -0.13 0.00 0.00 59.36 58.96 1mio h GLU 332 Cb 0.24 -0.06 -0.07 0.00 0.63 0.00 0.00 28.75 29.48 1mio h GLU 332 CO -0.01 0.19 -2.37 1.63 -0.73 0.00 0.00 179.01 177.72 1mio n LYS 333 N -4.55 0.68 -0.00 1.92 4.76 -1.15 -4.77 118.16 115.05 1mio n LYS 333 Ca 0.26 0.07 0.10 0.00 -2.87 0.00 0.00 58.31 55.87 1mio n LYS 333 Cb 0.98 -1.54 -0.14 0.00 -1.84 0.00 0.00 35.03 32.49 1mio n LYS 333 CO 0.00 0.00 0.00 1.28 -1.37 0.00 0.00 177.40 177.31 1mio n LEU 334 N -2.95 0.55 -4.78 -0.35 4.77 0.48 -4.97 117.00 109.74 1mio n LEU 334 Ca -0.36 -0.28 -0.35 0.00 -0.03 0.00 0.00 56.01 54.99 1mio n LEU 334 Cb 1.10 0.00 -0.01 0.00 -2.33 0.00 0.00 43.42 42.17 1mio n LEU 334 CO 0.38 0.14 0.76 0.00 -1.33 0.00 0.00 177.39 177.34 1mio s GLN 335 N -3.22 3.61 0.00 3.23 -2.07 -0.76 -2.99 119.66 117.46 1mio s GLN 335 Ca 0.01 1.55 0.00 0.00 -1.82 0.00 0.00 55.36 55.09 1mio s GLN 335 Cb 0.15 -2.12 0.00 0.00 -1.09 0.00 0.00 33.01 29.95 1mio s GLN 335 CO 0.88 -0.62 0.00 0.41 -1.32 0.00 0.00 175.29 174.64 1mio n GLY 336 N 0.08 0.76 3.89 2.60 0.00 -0.67 -4.92 105.19 106.94 1mio n GLY 336 Ca 0.10 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.80 1mio n GLY 336 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1mio s LYS 337 N -0.72 3.63 -0.07 1.61 1.02 -1.16 -4.95 119.74 119.11 1mio s LYS 337 Ca 0.00 -0.06 -0.13 0.00 0.02 0.00 0.00 55.97 55.80 1mio s LYS 337 Cb 0.00 -2.84 -0.05 0.00 -0.52 0.00 0.00 37.83 34.42 1mio s LYS 337 CO 0.00 0.46 0.33 0.99 -0.92 0.00 0.00 175.35 176.21 1mio s THR 338 N -1.65 5.20 0.05 2.17 2.01 -1.26 0.11 115.64 122.27 1mio s THR 338 Ca 0.41 0.65 0.02 0.00 0.31 0.00 0.00 61.69 63.08 1mio s THR 338 Cb -0.12 -3.63 -0.03 0.00 0.01 0.00 0.00 72.50 68.73 1mio s THR 338 CO 0.24 0.54 -0.08 0.00 -0.69 0.00 0.00 174.62 174.63 1mio s ALA 339 N -0.66 0.67 0.01 7.40 0.00 0.93 -1.96 121.76 128.14 1mio s ALA 339 Ca 0.20 -0.88 0.04 0.00 0.00 0.00 0.00 51.96 51.33 1mio s ALA 339 Cb -0.15 0.06 -0.01 0.00 0.00 0.00 0.00 23.12 23.02 1mio s ALA 339 CO 0.09 -0.05 -0.14 0.00 0.00 0.00 0.00 175.76 175.67 1mio s LEU 341 N -0.64 1.83 -0.10 0.00 2.01 -0.77 -0.84 118.68 120.17 1mio s LEU 341 Ca 0.04 -0.39 -0.01 0.00 0.01 0.00 0.00 54.13 53.77 1mio s LEU 341 Cb -0.06 -1.04 0.03 0.00 0.01 0.00 0.00 46.19 45.13 1mio s LEU 341 CO 0.00 0.09 -0.02 -0.47 1.01 0.00 0.00 176.35 176.97 1mio s TYR 342 N 0.47 0.96 0.00 0.29 5.04 -0.80 -1.48 117.35 121.83 1mio s TYR 342 Ca -0.15 -0.43 0.00 0.00 -2.44 0.00 0.00 57.07 54.05 1mio s TYR 342 Cb -0.16 -0.96 0.00 0.00 0.35 0.00 0.00 41.96 41.19 1mio s TYR 342 CO 0.05 -0.42 0.00 0.28 -1.34 0.00 0.00 175.55 174.12 1mio n VAL 343 N 5.07 0.00 0.00 3.14 0.31 -1.16 -3.93 118.33 121.76 1mio n VAL 343 Ca -0.09 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.24 1mio n VAL 343 Cb 0.50 0.00 0.00 0.00 -0.91 0.00 0.00 33.84 33.43 1mio n VAL 343 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 1mio n GLY 344 N 0.92 0.90 2.60 2.92 0.00 -1.26 -1.21 105.19 110.05 1mio n GLY 344 Ca 0.00 0.00 -0.01 0.00 0.00 0.00 0.00 46.02 46.01 1mio n GLY 344 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1mio n GLY 345 N 2.32 1.79 0.67 -0.02 0.00 -1.26 -1.77 105.19 106.92 1mio n GLY 345 Ca 0.00 -0.61 0.00 0.00 0.00 0.00 0.00 46.02 45.41 1mio n GLY 345 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 1mio n SER 346 N -0.92 -0.81 -0.27 1.61 2.88 -1.26 -4.07 113.62 110.77 1mio n SER 346 Ca -0.06 0.37 0.11 0.00 -1.33 0.00 0.00 58.87 57.96 1mio n SER 346 Cb 0.85 1.02 0.35 0.00 -0.75 0.00 0.00 64.21 65.68 1mio n SER 346 CO 0.00 0.00 0.00 0.03 -1.23 0.00 0.00 175.04 173.84 1mio h ARG 347 N 0.00 0.72 -0.17 -1.46 3.08 -1.95 -0.68 114.38 113.93 1mio h ARG 347 Ca 0.00 -0.04 0.05 0.00 0.07 0.00 0.00 59.98 60.06 1mio h ARG 347 Cb 0.00 -0.16 -0.01 0.00 0.08 0.00 0.00 29.97 29.88 1mio h ARG 347 CO 0.00 0.48 0.23 0.77 -1.07 0.00 0.00 179.97 180.38 1mio h SER 348 N 0.74 0.00 0.14 7.04 0.02 -1.91 -1.20 113.55 118.38 1mio h SER 348 Ca 0.44 0.00 -0.36 0.00 -0.84 0.00 0.00 61.79 61.03 1mio h SER 348 Cb 0.64 0.00 -0.03 0.00 0.14 0.00 0.00 62.40 63.15 1mio h SER 348 CO -0.20 0.00 -2.07 1.57 -1.14 0.00 0.00 176.83 174.99 1mio n HIS 349 N -3.61 0.94 0.04 3.45 -0.00 -0.29 -4.16 115.22 111.60 1mio n HIS 349 Ca 0.01 0.22 -0.15 0.00 -0.00 0.00 0.00 57.72 57.80 1mio n HIS 349 Cb 0.34 -1.13 -0.05 0.00 -0.00 0.00 0.00 29.99 29.15 1mio n HIS 349 CO 0.00 0.00 0.00 1.79 -0.00 0.00 0.00 176.34 178.13 1mio h THR 350 N 0.05 1.34 0.00 3.57 1.35 -0.92 -2.98 112.91 115.32 1mio h THR 350 Ca -0.44 -2.25 -0.04 0.00 -0.55 0.00 0.00 66.41 63.12 1mio h THR 350 Cb 2.02 2.26 -0.01 0.00 -1.73 0.00 0.00 68.15 70.69 1mio h THR 350 CO 0.05 0.69 -0.21 1.88 -0.25 0.00 0.00 175.52 177.68 1mio h TYR 351 N 0.34 0.00 -0.93 4.73 0.05 -1.68 -3.28 116.97 116.19 1mio h TYR 351 Ca -0.08 0.00 0.18 0.00 0.05 0.00 0.00 58.73 58.88 1mio h TYR 351 Cb 1.52 0.00 -0.08 0.00 1.01 0.00 0.00 36.73 39.18 1mio h TYR 351 CO 0.07 0.21 0.60 1.98 -1.05 0.00 0.00 178.16 179.97 1mio h MET 352 N 0.00 0.59 -0.16 4.88 4.05 -1.68 0.08 114.93 122.68 1mio h MET 352 Ca -0.00 -0.04 -0.11 0.00 -0.28 0.00 0.00 59.70 59.28 1mio h MET 352 Cb 0.60 -0.13 0.00 0.00 -0.80 0.00 0.00 31.60 31.27 1mio h MET 352 CO 0.03 0.39 -0.32 -2.95 0.23 0.00 0.00 176.91 174.29 1mio h ASN 353 N 0.60 0.56 -0.81 1.39 7.08 -1.75 -3.13 115.58 119.52 1mio h ASN 353 Ca 0.49 -0.55 0.05 0.00 -3.08 0.00 0.00 56.30 53.21 1mio h ASN 353 Cb 0.95 -0.16 -0.05 0.00 -2.08 0.00 0.00 38.32 36.98 1mio h ASN 353 CO -0.24 1.01 0.53 -0.03 -2.08 0.00 0.00 177.43 176.62 1mio h MET 354 N 0.13 0.91 -0.68 4.14 4.05 -1.22 0.14 114.93 122.40 1mio h MET 354 Ca 0.01 -0.05 -0.02 0.00 -0.28 0.00 0.00 59.70 59.35 1mio h MET 354 Cb 0.91 -0.20 -0.03 0.00 -0.80 0.00 0.00 31.60 31.48 1mio h MET 354 CO 0.07 0.60 0.35 -0.07 0.23 0.00 0.00 176.91 178.09 1mio h LEU 355 N 0.93 0.87 -0.32 3.39 -0.00 -1.29 -3.12 115.31 115.77 1mio h LEU 355 Ca 0.34 -0.12 -0.09 0.00 -0.00 0.00 0.00 57.88 58.01 1mio h LEU 355 Cb 0.15 -0.22 -0.01 0.00 -0.00 0.00 0.00 40.66 40.58 1mio h LEU 355 CO -0.11 0.74 -0.15 0.11 -0.00 0.00 0.00 178.44 179.03 1mio h LYS 356 N 0.94 0.67 -1.17 1.13 1.57 -0.76 -0.42 116.57 118.54 1mio h LYS 356 Ca 0.24 -0.29 0.35 0.00 -1.87 0.00 0.00 60.65 59.08 1mio h LYS 356 Cb 0.08 -0.02 -0.12 0.00 0.08 0.00 0.00 32.23 32.26 1mio h LYS 356 CO -0.03 0.88 0.75 0.77 -0.57 0.00 0.00 179.45 181.24 1mio h SER 357 N 0.44 0.35 0.91 0.86 0.02 -1.07 0.46 113.55 115.51 1mio h SER 357 Ca 0.07 0.12 -0.23 0.00 -0.84 0.00 0.00 61.79 60.92 1mio h SER 357 Cb 0.68 0.08 -0.03 0.00 0.14 0.00 0.00 62.40 63.27 1mio h SER 357 CO 0.05 -0.07 -1.10 -0.26 -1.14 0.00 0.00 176.83 174.30 1mio h PHE 358 N 0.23 0.05 0.00 3.45 0.04 -1.05 -3.47 116.94 116.19 1mio h PHE 358 Ca 0.72 -0.04 0.00 0.00 2.80 0.00 0.00 57.97 61.45 1mio h PHE 358 Cb 2.05 -0.00 0.00 0.00 2.20 0.00 0.00 35.95 40.20 1mio h PHE 358 CO -0.00 1.03 0.00 0.41 -0.60 0.00 0.00 178.31 179.15 1mio n GLY 359 N 1.39 1.04 3.68 -1.45 0.00 0.15 -2.93 105.19 107.08 1mio n GLY 359 Ca -0.03 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.59 1mio n GLY 359 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1mio s VAL 360 N -2.00 4.97 -0.01 1.61 1.01 -0.80 -1.67 120.40 123.52 1mio s VAL 360 Ca 0.00 1.43 -0.14 0.00 0.00 0.00 0.00 61.98 63.28 1mio s VAL 360 Cb 0.00 -4.05 -0.05 0.00 0.00 0.00 0.00 36.38 32.28 1mio s VAL 360 CO 0.00 0.12 0.38 -1.81 0.00 0.00 0.00 175.10 173.78 1mio s ASP 361 N 1.07 6.76 0.10 3.32 1.01 0.12 -3.48 116.67 125.57 1mio s ASP 361 Ca 0.35 0.90 -0.22 0.00 0.71 0.00 0.00 52.55 54.29 1mio s ASP 361 Cb -0.17 -2.23 -0.07 0.00 1.01 0.00 0.00 42.92 41.47 1mio s ASP 361 CO 0.13 0.33 0.66 -0.44 0.21 0.00 0.00 175.17 176.06 1mio s SER 362 N -1.10 7.20 -0.06 0.27 0.01 -1.26 -0.05 113.70 118.70 1mio s SER 362 Ca 0.23 1.42 -0.00 0.00 1.31 0.00 0.00 55.95 58.91 1mio s SER 362 Cb -0.16 -2.42 -0.04 0.00 0.21 0.00 0.00 66.02 63.61 1mio s SER 362 CO 0.13 0.23 -0.06 0.18 0.41 0.00 0.00 173.24 174.12 1mio n LEU 363 N 1.77 2.63 -4.00 2.44 7.99 0.15 -4.86 117.00 123.11 1mio n LEU 363 Ca -0.08 -0.02 -0.16 0.00 -0.01 0.00 0.00 56.01 55.75 1mio n LEU 363 Cb 0.50 -0.22 -0.14 0.00 -0.11 0.00 0.00 43.42 43.45 1mio n LEU 363 CO 0.43 0.54 -0.41 -0.69 -1.51 0.00 0.00 177.39 175.76 1mio s VAL 364 N -2.13 0.53 -0.28 4.08 1.01 -1.25 -2.44 120.40 119.92 1mio s VAL 364 Ca -0.09 -0.51 -0.21 0.00 0.00 0.00 0.00 61.98 61.18 1mio s VAL 364 Cb 0.02 -0.49 0.10 0.00 0.00 0.00 0.00 36.38 36.02 1mio s VAL 364 CO 0.14 -0.00 0.84 0.00 0.00 0.00 0.00 175.10 176.08 1mio s ALA 365 N -0.49 -1.95 0.11 5.51 0.00 -0.49 -1.84 121.76 122.62 1mio s ALA 365 Ca -0.01 2.13 0.03 0.00 0.00 0.00 0.00 51.96 54.11 1mio s ALA 365 Cb -0.05 -1.41 -0.01 0.00 0.00 0.00 0.00 23.12 21.65 1mio s ALA 365 CO 0.00 -0.33 0.09 0.41 0.00 0.00 0.00 175.76 175.93 1mio n GLY 366 N 3.21 3.67 3.13 0.00 0.00 -0.55 -2.94 105.19 111.70 1mio n GLY 366 Ca -0.16 -1.75 -0.12 0.00 0.00 0.00 0.00 46.02 43.99 1mio n GLY 366 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1mio s PHE 367 N -2.43 -0.09 0.00 1.61 0.08 -1.20 -3.01 117.98 112.95 1mio s PHE 367 Ca 0.13 0.16 -0.06 0.00 0.12 0.00 0.00 56.93 57.27 1mio s PHE 367 Cb 0.01 0.02 -0.03 0.00 -0.57 0.00 0.00 43.02 42.44 1mio s PHE 367 CO 0.09 -0.26 0.86 1.49 -0.10 0.00 0.00 175.22 177.31 1mio h GLU 368 N 4.64 -0.21 0.00 0.44 4.81 -0.33 -0.83 114.58 123.10 1mio h GLU 368 Ca -0.29 0.01 0.00 0.00 -0.13 0.00 0.00 59.36 58.95 1mio h GLU 368 Cb 1.19 0.05 0.00 0.00 0.63 0.00 0.00 28.75 30.62 1mio h GLU 368 CO 0.39 -0.14 0.00 1.97 -0.73 0.00 0.00 179.01 180.50 1mio n PHE 369 N -2.73 0.00 -0.76 0.92 1.16 -1.22 -4.03 117.46 110.80 1mio n PHE 369 Ca -0.03 -0.42 -0.29 0.00 -1.87 0.00 0.00 57.45 54.85 1mio n PHE 369 Cb 0.09 -0.04 0.24 0.00 -1.61 0.00 0.00 39.48 38.15 1mio n PHE 369 CO 0.00 0.00 0.00 0.00 -1.87 0.00 0.00 176.76 174.89 1mio s ALA 370 N -0.84 -0.06 0.40 1.98 0.00 -1.25 -4.67 121.76 117.31 1mio s ALA 370 Ca 0.00 -0.37 0.02 0.00 0.00 0.00 0.00 51.96 51.60 1mio s ALA 370 Cb 0.00 -3.14 0.02 0.00 0.00 0.00 0.00 23.12 20.00 1mio s ALA 370 CO 0.00 -3.65 0.16 0.72 0.00 0.00 0.00 175.76 172.99 1mio n HIS 371 N -4.79 0.02 -0.28 0.00 8.25 -1.26 -2.95 115.22 114.20 1mio n HIS 371 Ca 0.05 -1.83 -0.04 0.00 -0.26 0.00 0.00 57.72 55.65 1mio n HIS 371 Cb 0.56 -0.30 0.08 0.00 1.12 0.00 0.00 29.99 31.45 1mio n HIS 371 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 1mio h ARG 372 N 0.00 1.00 0.00 -0.41 3.08 -1.90 -1.80 114.38 114.36 1mio h ARG 372 Ca -0.29 -0.06 0.00 0.00 0.07 0.00 0.00 59.98 59.70 1mio h ARG 372 Cb 0.96 -0.23 0.00 0.00 0.08 0.00 0.00 29.97 30.79 1mio h ARG 372 CO 0.47 0.66 0.00 -0.40 -1.07 0.00 0.00 179.97 179.63 1mio n ASP 373 N -4.56 0.49 -0.08 7.04 5.75 -1.26 0.03 116.55 123.96 1mio n ASP 373 Ca 0.08 0.72 -0.19 0.00 -0.01 0.00 0.00 54.79 55.39 1mio n ASP 373 Cb 0.04 -0.79 -0.13 0.00 -1.03 0.00 0.00 41.12 39.21 1mio n ASP 373 CO 0.00 0.00 0.00 0.47 -0.11 0.00 0.00 177.20 177.56 1mio n ASP 374 N -2.15 2.03 0.04 -1.12 8.00 -0.70 -1.67 116.55 120.98 1mio n ASP 374 Ca -0.01 -0.01 -0.12 0.00 0.71 0.00 0.00 54.79 55.36 1mio n ASP 374 Cb 0.03 -0.58 -0.09 0.00 -0.02 0.00 0.00 41.12 40.47 1mio n ASP 374 CO 0.00 0.00 0.00 1.88 -0.39 0.00 0.00 177.20 178.69 1mio h TYR 375 N 0.02 -0.16 0.00 1.24 0.05 -1.45 -0.81 116.97 115.86 1mio h TYR 375 Ca -0.52 -0.00 0.00 0.00 0.05 0.00 0.00 58.73 58.25 1mio h TYR 375 Cb 1.95 0.05 0.00 0.00 1.01 0.00 0.00 36.73 39.74 1mio h TYR 375 CO 0.05 0.32 -1.03 0.39 -1.05 0.00 0.00 178.16 176.84 1mio n GLU 376 N -4.91 0.29 0.00 4.88 1.02 0.10 -1.00 120.64 121.02 1mio n GLU 376 Ca -0.08 -0.00 0.00 0.00 -0.02 0.00 0.00 57.16 57.05 1mio n GLU 376 Cb 0.27 -1.59 0.00 0.00 -0.02 0.00 0.00 31.44 30.10 1mio n GLU 376 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1mio n GLY 377 N 1.37 2.98 0.34 0.62 0.00 -0.67 -4.39 105.19 105.44 1mio n GLY 377 Ca 0.02 -1.50 0.18 0.00 0.00 0.00 0.00 46.02 44.72 1mio n GLY 377 CO 0.00 0.00 0.00 3.21 0.00 0.00 0.00 173.32 176.53 1mio h ARG 378 N 0.00 0.00 -0.94 1.61 3.08 -0.54 -2.78 114.38 114.82 1mio h ARG 378 Ca 0.00 0.00 0.14 0.00 0.07 0.00 0.00 59.98 60.19 1mio h ARG 378 Cb 0.00 0.00 -0.08 0.00 0.08 0.00 0.00 29.97 29.97 1mio h ARG 378 CO 0.00 0.00 0.60 1.05 -1.07 0.00 0.00 179.97 180.55 1mio h GLU 379 N 0.00 0.76 0.00 0.04 4.11 -1.91 -2.58 114.58 115.01 1mio h GLU 379 Ca 0.05 -0.05 0.00 0.00 0.07 0.00 0.00 59.36 59.43 1mio h GLU 379 Cb 0.45 -0.17 0.00 0.00 0.50 0.00 0.00 28.75 29.52 1mio h GLU 379 CO -0.00 0.50 0.00 1.33 0.07 0.00 0.00 179.01 180.91 1mio n VAL 380 N -4.60 0.08 -0.25 -1.06 0.24 -1.05 -3.83 118.33 107.87 1mio n VAL 380 Ca 0.18 0.02 0.11 0.00 -2.04 0.00 0.00 64.34 62.62 1mio n VAL 380 Cb 0.45 -0.67 0.38 0.00 -1.47 0.00 0.00 33.84 32.54 1mio n VAL 380 CO 0.00 0.00 0.00 0.40 -2.14 0.00 0.00 176.83 175.09 1mio h ILE 381 N 0.00 0.86 -0.93 1.34 2.04 -1.68 0.72 117.51 119.86 1mio h ILE 381 Ca 0.00 -0.24 0.08 0.00 1.00 0.00 0.00 64.86 65.70 1mio h ILE 381 Cb 0.05 0.12 -0.06 0.00 -0.74 0.00 0.00 36.82 36.18 1mio h ILE 381 CO 0.00 0.13 0.60 1.55 0.00 0.00 0.00 178.15 180.43 1mio h PRO 382 N 0.69 1.00 0.00 2.37 0.13 -1.83 -3.17 132.00 131.18 1mio h PRO 382 Ca 0.42 -0.06 -0.04 0.00 -0.87 0.00 0.00 66.00 65.45 1mio h PRO 382 Cb 0.66 -0.23 -0.01 0.00 0.13 0.00 0.00 31.00 31.56 1mio h PRO 382 CO -0.18 0.66 -0.21 1.15 -0.23 0.00 0.00 178.00 179.19 1mio h THR 383 N 1.03 0.46 -3.80 1.56 2.02 0.09 -3.45 112.91 110.81 1mio h THR 383 Ca 0.41 -1.18 -0.49 0.00 0.77 0.00 0.00 66.41 65.92 1mio h THR 383 Cb 0.26 1.85 0.00 0.00 -1.74 0.00 0.00 68.15 68.52 1mio h THR 383 CO -0.17 0.20 0.41 0.27 0.37 0.00 0.00 175.52 176.61 1mio s ILE 384 N -3.50 3.78 0.11 3.11 -0.00 -0.05 -5.07 121.20 119.57 1mio s ILE 384 Ca 0.02 1.74 0.05 0.00 -0.00 0.00 0.00 60.65 62.46 1mio s ILE 384 Cb 0.09 -4.09 -0.04 0.00 -0.00 0.00 0.00 42.46 38.43 1mio s ILE 384 CO 0.64 0.38 -0.13 -0.54 -0.00 0.00 0.00 174.94 175.29 1mio s LYS 385 N -1.45 0.95 0.08 0.37 -0.14 -1.26 -5.00 119.74 113.28 1mio s LYS 385 Ca 0.44 -1.18 0.09 0.00 -1.36 0.00 0.00 55.97 53.96 1mio s LYS 385 Cb -0.28 -0.79 -0.03 0.00 -1.68 0.00 0.00 37.83 35.05 1mio s LYS 385 CO 0.35 0.15 -0.23 -1.50 -0.76 0.00 0.00 175.35 173.36 1mio s ILE 386 N -2.10 1.88 0.00 2.17 1.10 -1.26 -5.02 121.20 117.97 1mio s ILE 386 Ca 0.06 -1.43 0.00 0.00 -0.51 0.00 0.00 60.65 58.77 1mio s ILE 386 Cb -0.05 -1.65 0.00 0.00 0.15 0.00 0.00 42.46 40.91 1mio s ILE 386 CO 0.02 0.15 0.00 -0.67 -2.11 0.00 0.00 174.94 172.33 1mio n ASP 387 N 1.46 0.00 -0.03 4.50 2.03 -1.26 -4.93 116.55 118.32 1mio n ASP 387 Ca -0.18 0.00 -0.06 0.00 0.52 0.00 0.00 54.79 55.07 1mio n ASP 387 Cb 0.53 0.00 -0.02 0.00 -0.72 0.00 0.00 41.12 40.91 1mio n ASP 387 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 1mio n ALA 388 N -0.87 2.57 0.00 -1.67 0.00 -1.26 -4.92 120.51 114.36 1mio n ALA 388 Ca 0.00 -0.24 0.00 0.00 0.00 0.00 0.00 53.44 53.20 1mio n ALA 388 Cb 0.00 0.42 0.00 0.00 0.00 0.00 0.00 19.45 19.87 1mio n ALA 388 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.50 174.03 1mio n ASP 389 N -3.24 0.00 0.00 0.00 2.03 -1.26 -3.90 116.55 110.18 1mio n ASP 389 Ca -0.12 0.00 0.00 0.00 0.52 0.00 0.00 54.79 55.19 1mio n ASP 389 Cb 0.59 0.20 0.00 0.00 -0.72 0.00 0.00 41.12 41.19 1mio n ASP 389 CO 0.00 0.00 0.00 -0.24 -1.92 0.00 0.00 177.20 175.04 1mio n SER 390 N -2.41 0.00 -4.41 1.67 2.88 -1.25 -4.93 113.62 105.18 1mio n SER 390 Ca 0.00 0.00 -0.45 0.00 -1.33 0.00 0.00 58.87 57.09 1mio n SER 390 Cb 0.00 0.00 -0.03 0.00 -0.75 0.00 0.00 64.21 63.43 1mio n SER 390 CO 0.00 0.00 0.00 -0.75 -1.23 0.00 0.00 175.04 173.06 1mio s LYS 391 N 0.00 3.36 -0.40 -1.46 2.36 -1.26 -3.66 119.74 118.68 1mio s LYS 391 Ca 0.00 -1.62 0.11 0.00 -2.55 0.00 0.00 55.97 51.91 1mio s LYS 391 Cb 0.00 -4.53 0.41 0.00 -1.05 0.00 0.00 37.83 32.66 1mio s LYS 391 CO 0.00 -1.62 0.96 0.09 1.55 0.00 0.00 175.35 176.33 1mio n ASN 392 N 6.19 2.70 -4.31 1.43 4.13 -1.26 -4.92 115.26 119.21 1mio n ASN 392 Ca 0.08 -3.19 -0.37 0.00 1.68 0.00 0.00 54.58 52.78 1mio n ASN 392 Cb 0.46 -0.53 -0.13 0.00 -1.54 0.00 0.00 39.78 38.04 1mio n ASN 392 CO 0.00 0.00 0.00 -0.63 0.28 0.00 0.00 177.26 176.91 1mio s ILE 393 N -3.89 3.75 -0.05 2.41 1.01 -1.26 -5.06 121.20 118.11 1mio s ILE 393 Ca 0.38 -0.79 -0.04 0.00 0.00 0.00 0.00 60.65 60.21 1mio s ILE 393 Cb 0.40 -2.94 -0.02 0.00 0.01 0.00 0.00 42.46 39.91 1mio s ILE 393 CO -0.07 0.08 0.18 -2.65 0.00 0.00 0.00 174.94 172.48 1mio n PRO 394 N 4.82 0.00 -3.33 2.79 -0.02 -1.26 -4.91 135.00 133.10 1mio n PRO 394 Ca -0.15 0.00 -0.46 0.00 -2.02 0.00 0.00 63.50 60.87 1mio n PRO 394 Cb 0.48 -0.14 -0.05 0.00 -0.02 0.00 0.00 33.50 33.77 1mio n PRO 394 CO 0.00 0.00 0.00 -2.00 1.98 0.00 0.00 175.50 175.48 1mio s GLU 395 N 0.47 3.06 0.65 -0.52 2.56 -1.26 -4.90 118.70 118.76 1mio s GLU 395 Ca 0.11 -1.84 -0.11 0.00 0.00 0.00 0.00 54.97 53.13 1mio s GLU 395 Cb -0.14 -4.30 -0.02 0.00 2.00 0.00 0.00 34.13 31.67 1mio s GLU 395 CO 0.07 -1.32 1.05 -1.50 -0.56 0.00 0.00 175.26 173.00 1mio s ILE 396 N 1.34 4.35 -0.04 -3.70 1.10 -1.26 -5.08 121.20 117.92 1mio s ILE 396 Ca 0.06 0.76 -0.05 0.00 -0.51 0.00 0.00 60.65 60.91 1mio s ILE 396 Cb -0.27 -3.68 0.01 0.00 0.15 0.00 0.00 42.46 38.67 1mio s ILE 396 CO 0.01 -1.00 0.13 0.28 -2.11 0.00 0.00 174.94 172.25 1mio s THR 397 N -3.16 0.02 0.15 4.00 -1.32 -1.26 -5.12 115.64 108.95 1mio s THR 397 Ca 0.56 -0.17 0.05 0.00 -1.21 0.00 0.00 61.69 60.92 1mio s THR 397 Cb -0.12 -0.25 -0.04 0.00 -1.51 0.00 0.00 72.50 70.58 1mio s THR 397 CO 0.54 -0.10 -0.11 0.68 -2.21 0.00 0.00 174.62 173.43 1mio s VAL 398 N -0.28 1.24 -0.02 5.08 -7.23 -1.26 -5.15 120.40 112.79 1mio s VAL 398 Ca -0.04 -2.08 0.08 0.00 -1.81 0.00 0.00 61.98 58.13 1mio s VAL 398 Cb -0.03 -1.87 -0.02 0.00 0.56 0.00 0.00 36.38 35.02 1mio s VAL 398 CO 0.00 -0.73 -0.25 0.42 -0.31 0.00 0.00 175.10 174.23 1mio s THR 399 N -3.28 2.01 0.58 5.32 -4.23 -1.26 -4.97 115.64 109.81 1mio s THR 399 Ca 0.17 -1.08 -0.20 0.00 -1.18 0.00 0.00 61.69 59.40 1mio s THR 399 Cb 0.02 -1.67 -0.04 0.00 1.34 0.00 0.00 72.50 72.16 1mio s THR 399 CO 0.01 0.57 1.31 -2.16 -0.54 0.00 0.00 174.62 173.81 1mio s PRO 400 N -0.54 2.96 0.22 3.99 0.04 -1.21 -4.68 135.00 135.78 1mio s PRO 400 Ca 0.08 2.12 0.19 0.00 0.04 0.00 0.00 61.00 63.43 1mio s PRO 400 Cb -0.10 -2.10 0.89 0.00 0.04 0.00 0.00 34.50 33.24 1mio s PRO 400 CO -0.00 -1.30 1.58 -3.47 0.04 0.00 0.00 177.00 173.85 1mio n ASP 401 N -1.35 0.47 0.00 6.66 2.03 0.22 -4.88 116.55 119.72 1mio n ASP 401 Ca 0.12 0.66 0.00 0.00 0.52 0.00 0.00 54.79 56.10 1mio n ASP 401 Cb 0.47 -0.75 0.00 0.00 -0.72 0.00 0.00 41.12 40.12 1mio n ASP 401 CO 0.00 0.00 0.00 -0.62 -1.92 0.00 0.00 177.20 174.66 1mio n GLU 402 N -2.07 0.00 0.00 -0.67 -0.58 -1.26 -3.68 120.64 112.38 1mio n GLU 402 Ca 0.01 0.00 0.13 0.00 -0.42 0.00 0.00 57.16 56.88 1mio n GLU 402 Cb 0.12 0.00 0.51 0.00 -0.57 0.00 0.00 31.44 31.50 1mio n GLU 402 CO 0.00 0.00 0.00 1.04 -0.48 0.00 0.00 177.13 177.69 1mio n GLN 403 N 0.00 0.01 0.00 3.49 1.13 -1.26 -4.08 117.38 116.67 1mio n GLN 403 Ca 0.00 0.01 0.00 0.00 -1.94 0.00 0.00 57.00 55.07 1mio n GLN 403 Cb 0.00 -1.51 0.00 0.00 0.11 0.00 0.00 30.24 28.84 1mio n GLN 403 CO 0.00 0.00 0.00 1.17 -1.44 0.00 0.00 177.06 176.79 1mio n LYS 404 N -1.53 0.81 -2.70 -1.09 4.81 -1.24 -5.04 118.16 112.18 1mio n LYS 404 Ca 0.07 -0.75 -0.35 0.00 -0.87 0.00 0.00 58.31 56.40 1mio n LYS 404 Cb 0.34 -0.76 -0.06 0.00 0.02 0.00 0.00 35.03 34.57 1mio n LYS 404 CO 0.00 0.00 0.00 -0.47 1.17 0.00 0.00 177.40 178.10 1mio s TYR 405 N -0.33 3.40 -0.01 5.64 6.14 -1.26 -4.73 117.35 126.20 1mio s TYR 405 Ca 0.00 1.67 -0.09 0.00 0.64 0.00 0.00 57.07 59.30 1mio s TYR 405 Cb 0.00 -2.98 0.01 0.00 0.42 0.00 0.00 41.96 39.41 1mio s TYR 405 CO 0.00 -0.22 0.18 -0.98 0.64 0.00 0.00 175.55 175.17 1mio s ARG 406 N -2.60 0.51 -0.55 4.97 1.04 0.00 -4.90 118.95 117.42 1mio s ARG 406 Ca 0.57 -0.31 -0.25 0.00 -1.04 0.00 0.00 55.73 54.70 1mio s ARG 406 Cb -0.17 0.21 0.04 0.00 -2.04 0.00 0.00 34.95 33.00 1mio s ARG 406 CO 0.22 -0.12 1.00 0.08 -0.04 0.00 0.00 175.30 176.43 1mio s VAL 407 N -1.27 4.30 -0.08 4.99 1.01 -1.26 -4.11 120.40 123.98 1mio s VAL 407 Ca -0.14 0.46 -0.00 0.00 0.00 0.00 0.00 61.98 62.30 1mio s VAL 407 Cb -0.07 -4.58 -0.00 0.00 0.00 0.00 0.00 36.38 31.73 1mio s VAL 407 CO 0.02 -1.15 -0.01 0.58 0.00 0.00 0.00 175.10 174.54 1mio h VAL 408 N 6.06 0.00 -3.20 2.92 2.07 -1.92 -3.43 116.25 118.75 1mio h VAL 408 Ca -0.26 -0.75 -0.59 0.00 0.82 0.00 0.00 66.70 65.92 1mio h VAL 408 Cb 1.07 0.00 -0.08 0.00 -1.52 0.00 0.00 31.29 30.76 1mio h VAL 408 CO 1.11 0.00 -0.23 -0.63 0.02 0.00 0.00 177.57 177.84 1mio s ILE 409 N -1.45 5.19 1.23 4.57 1.01 -1.26 -5.07 121.20 125.42 1mio s ILE 409 Ca -0.01 0.76 -0.18 0.00 0.00 0.00 0.00 60.65 61.22 1mio s ILE 409 Cb 0.00 -3.71 0.26 0.00 0.01 0.00 0.00 42.46 39.02 1mio s ILE 409 CO 0.01 0.43 0.60 -0.81 0.00 0.00 0.00 174.94 175.17 1mio n PRO 410 N 3.06 -3.05 0.00 2.79 -0.04 -1.26 -4.81 135.00 131.68 1mio n PRO 410 Ca -0.11 -0.89 0.00 0.00 -0.04 0.00 0.00 63.50 62.46 1mio n PRO 410 Cb 0.52 -1.84 0.00 0.00 -0.04 0.00 0.00 33.50 32.14 1mio n PRO 410 CO 0.00 0.00 0.00 -1.91 -0.04 0.00 0.00 175.50 173.55 1mio n GLU 411 N -3.96 0.00 -0.39 0.54 4.07 -1.26 -1.64 120.64 118.00 1mio n GLU 411 Ca 0.06 0.00 0.33 0.00 -0.06 0.00 0.00 57.16 57.49 1mio n GLU 411 Cb 0.54 -1.34 0.64 0.00 -0.06 0.00 0.00 31.44 31.22 1mio n GLU 411 CO 0.00 0.00 0.00 0.22 -0.06 0.00 0.00 177.13 177.29 1mio h ASP 412 N 0.00 0.23 -0.81 4.31 1.82 -2.01 0.33 116.42 120.29 1mio h ASP 412 Ca 0.00 0.07 0.16 0.00 -0.39 0.00 0.00 57.03 56.86 1mio h ASP 412 Cb 0.00 0.04 -0.15 0.00 0.68 0.00 0.00 39.33 39.90 1mio h ASP 412 CO 0.00 -0.02 -0.25 0.07 -1.61 0.00 0.00 179.24 177.44 1mio h LYS 413 N 0.17 -0.02 0.00 0.28 2.10 -1.63 0.26 116.57 117.73 1mio h LYS 413 Ca 0.68 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 59.33 1mio h LYS 413 Cb 2.20 0.01 0.00 0.00 -0.90 0.00 0.00 32.23 33.54 1mio h LYS 413 CO -0.22 -0.02 0.00 -0.24 -2.00 0.00 0.00 179.45 176.97 1mio h VAL 414 N -0.02 0.00 -0.00 0.07 3.04 -1.22 0.84 116.25 118.95 1mio h VAL 414 Ca 0.37 -0.52 0.01 0.00 -1.01 0.00 0.00 66.70 65.55 1mio h VAL 414 Cb 0.60 1.45 -0.01 0.00 -2.01 0.00 0.00 31.29 31.32 1mio h VAL 414 CO -0.84 0.00 -0.06 -0.08 -1.01 0.00 0.00 177.57 175.58 1mio h GLU 415 N 0.00 -0.10 -0.04 4.17 4.57 -0.60 -3.01 114.58 119.57 1mio h GLU 415 Ca 0.00 0.01 -0.16 0.00 -1.18 0.00 0.00 59.36 58.02 1mio h GLU 415 Cb 0.59 0.02 -0.01 0.00 -0.16 0.00 0.00 28.75 29.19 1mio h GLU 415 CO 0.00 -0.07 -0.70 0.93 -1.18 0.00 0.00 179.01 177.99 1mio h GLU 416 N -0.10 0.19 0.00 1.92 5.08 -0.05 0.58 114.58 122.21 1mio h GLU 416 Ca 0.03 -0.16 0.00 0.00 -1.00 0.00 0.00 59.36 58.23 1mio h GLU 416 Cb 0.13 0.03 0.00 0.00 0.50 0.00 0.00 28.75 29.42 1mio h GLU 416 CO -0.06 0.82 0.00 1.28 -1.00 0.00 0.00 179.01 180.04 1mio n LEU 417 N -3.78 0.36 -0.13 1.33 4.32 -0.22 -1.81 117.00 117.06 1mio n LEU 417 Ca -0.03 0.59 -0.26 0.00 -0.02 0.00 0.00 56.01 56.29 1mio n LEU 417 Cb 0.69 -0.54 -0.09 0.00 -1.62 0.00 0.00 43.42 41.85 1mio n LEU 417 CO 0.45 -0.42 -1.37 1.17 -1.22 0.00 0.00 177.39 176.01 1mio n LYS 418 N -1.90 0.55 -1.78 3.23 0.00 -1.02 -4.05 118.16 113.20 1mio n LYS 418 Ca 0.03 0.22 -0.19 0.00 0.00 0.00 0.00 58.31 58.37 1mio n LYS 418 Cb 0.20 -1.42 -0.07 0.00 0.00 0.00 0.00 35.03 33.74 1mio n LYS 418 CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 177.40 177.55 1mio s LYS 419 N -2.47 1.90 -1.47 1.64 -0.14 0.20 -1.84 119.74 117.56 1mio s LYS 419 Ca -0.35 -0.11 -0.03 0.00 -1.36 0.00 0.00 55.97 54.12 1mio s LYS 419 Cb 0.13 -4.96 0.01 0.00 -1.68 0.00 0.00 37.83 31.33 1mio s LYS 419 CO 0.47 -4.29 0.26 0.00 -0.76 0.00 0.00 175.35 171.03 1mio n ALA 420 N 17.00 -0.83 -3.82 5.17 0.00 -1.26 -3.70 120.51 133.07 1mio n ALA 420 Ca 0.44 0.18 -0.15 0.00 0.00 0.00 0.00 53.44 53.90 1mio n ALA 420 Cb 0.45 -2.63 0.01 0.00 0.00 0.00 0.00 19.45 17.28 1mio n ALA 420 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1mio n GLY 421 N -1.14 -0.26 3.68 0.00 0.00 -0.77 -4.86 105.19 101.84 1mio n GLY 421 Ca -0.15 0.10 -0.46 0.00 0.00 0.00 0.00 46.02 45.52 1mio n GLY 421 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 1mio n VAL 422 N -2.28 0.26 -1.81 1.61 0.31 -0.75 -4.71 118.33 110.97 1mio n VAL 422 Ca -0.04 -0.05 -0.41 0.00 -0.01 0.00 0.00 64.34 63.84 1mio n VAL 422 Cb 0.18 -1.76 -0.01 0.00 -0.91 0.00 0.00 33.84 31.34 1mio n VAL 422 CO 0.00 0.00 0.00 -0.81 -1.32 0.00 0.00 176.83 174.70 1mio n PRO 423 N 4.91 3.83 -3.03 5.55 -0.05 -1.26 -4.45 135.00 140.51 1mio n PRO 423 Ca 0.19 -2.95 -0.42 0.00 -0.05 0.00 0.00 63.50 60.27 1mio n PRO 423 Cb 0.31 -2.85 -0.06 0.00 -0.05 0.00 0.00 33.50 30.84 1mio n PRO 423 CO 0.00 0.00 0.00 -1.17 -0.05 0.00 0.00 175.50 174.28 1mio s LEU 424 N -0.29 4.15 -1.45 1.53 1.98 -1.26 -0.55 118.68 122.79 1mio s LEU 424 Ca 0.55 0.42 -0.03 0.00 -2.89 0.00 0.00 54.13 52.17 1mio s LEU 424 Cb 0.16 -2.93 0.02 0.00 0.66 0.00 0.00 46.19 44.09 1mio s LEU 424 CO -0.06 -0.60 0.30 -1.20 -1.89 0.00 0.00 176.35 172.89 1mio n SER 425 N 6.13 -5.11 -3.76 3.68 7.64 0.21 -4.93 113.62 117.48 1mio n SER 425 Ca 0.01 -0.13 -0.10 0.00 1.01 0.00 0.00 58.87 59.67 1mio n SER 425 Cb 0.48 -4.22 -0.06 0.00 -1.01 0.00 0.00 64.21 59.41 1mio n SER 425 CO 0.00 0.00 0.00 -0.94 -3.01 0.00 0.00 175.04 171.09 1mio s SER 426 N -2.39 -0.04 -0.18 6.43 1.04 -1.25 -5.06 113.70 112.25 1mio s SER 426 Ca 0.18 -0.48 -0.07 0.00 0.48 0.00 0.00 55.95 56.05 1mio s SER 426 Cb -0.08 0.40 0.08 0.00 0.10 0.00 0.00 66.02 66.51 1mio s SER 426 CO 0.22 -0.77 0.40 -0.47 0.98 0.00 0.00 173.24 173.59 1mio s TYR 427 N -3.75 -0.70 -0.27 5.02 5.04 -1.26 -4.25 117.35 117.17 1mio s TYR 427 Ca 0.03 1.40 -0.10 0.00 -2.44 0.00 0.00 57.07 55.96 1mio s TYR 427 Cb 0.03 0.26 -0.04 0.00 0.35 0.00 0.00 41.96 42.56 1mio s TYR 427 CO -0.11 -0.43 0.15 0.20 -1.34 0.00 0.00 175.55 174.02 1mio s GLY 428 N 2.24 1.88 0.00 8.97 0.00 -1.26 -0.08 107.32 119.07 1mio s GLY 428 Ca -0.04 -1.13 0.00 0.00 0.00 0.00 0.00 44.72 43.55 1mio s GLY 428 CO -0.12 0.62 0.00 0.61 0.00 0.00 0.00 173.10 174.21 1mio n GLY 429 N 5.01 -2.62 0.12 0.20 0.00 -1.26 -4.84 105.19 101.81 1mio n GLY 429 Ca -0.15 -1.07 -0.12 0.00 0.00 0.00 0.00 46.02 44.69 1mio n GLY 429 CO 0.00 0.00 0.00 1.98 0.00 0.00 0.00 173.32 175.30 1mio h MET 430 N 0.00 -0.18 0.00 1.61 4.05 -0.55 -3.36 114.93 116.50 1mio h MET 430 Ca 0.00 0.01 0.00 0.00 -0.28 0.00 0.00 59.70 59.43 1mio h MET 430 Cb 0.00 0.04 0.00 0.00 -0.80 0.00 0.00 31.60 30.84 1mio h MET 430 CO 0.00 0.26 0.21 -1.33 0.23 0.00 0.00 176.91 176.28 1mio n MET 431 N -4.94 0.03 -0.03 0.39 2.81 -0.17 -1.12 117.12 114.09 1mio n MET 431 Ca -0.08 0.40 0.05 0.00 -1.81 0.00 0.00 57.70 56.26 1mio n MET 431 Cb 0.27 -1.81 0.06 0.00 -0.71 0.00 0.00 33.22 31.03 1mio n MET 431 CO 0.00 0.00 0.00 0.36 1.51 0.00 0.00 175.97 177.84 1mio n LYS 432 N -1.55 0.96 -0.00 0.03 0.00 -1.26 -3.74 118.16 112.59 1mio n LYS 432 Ca -0.00 -1.31 0.06 0.00 -0.00 0.00 0.00 58.31 57.06 1mio n LYS 432 Cb 0.22 -1.21 -0.13 0.00 -0.00 0.00 0.00 35.03 33.90 1mio n LYS 432 CO 0.00 0.00 0.00 -1.91 0.00 0.00 0.00 177.40 175.49 1mio n GLU 433 N 0.56 0.65 -2.30 -1.58 2.13 -0.28 -5.00 120.64 114.82 1mio n GLU 433 Ca 0.07 -0.07 -0.36 0.00 0.66 0.00 0.00 57.16 57.46 1mio n GLU 433 Cb 0.29 -1.60 -0.01 0.00 0.27 0.00 0.00 31.44 30.39 1mio n GLU 433 CO 0.00 0.00 0.00 1.41 -0.41 0.00 0.00 177.13 178.13 1mio s MET 434 N -3.25 3.73 0.30 5.31 1.75 -1.21 -5.07 119.30 120.85 1mio s MET 434 Ca -0.07 1.70 0.04 0.00 -1.25 0.00 0.00 55.69 56.11 1mio s MET 434 Cb 0.11 -2.33 0.04 0.00 2.84 0.00 0.00 34.83 35.50 1mio s MET 434 CO 0.87 -0.56 0.37 -2.39 -0.65 0.00 0.00 175.02 172.66 1mio n HIS 435 N -0.62 -2.24 -2.83 4.11 1.44 -1.26 -4.99 115.22 108.83 1mio n HIS 435 Ca 0.08 -1.14 -0.34 0.00 -2.01 0.00 0.00 57.72 54.31 1mio n HIS 435 Cb 0.49 -0.28 -0.07 0.00 0.12 0.00 0.00 29.99 30.26 1mio n HIS 435 CO 0.00 0.00 0.00 -0.51 -2.81 0.00 0.00 176.34 173.02 1mio s ASP 436 N -2.84 7.04 -0.17 4.39 1.11 -1.26 -3.49 116.67 121.45 1mio s ASP 436 Ca 0.28 1.70 0.00 0.00 0.18 0.00 0.00 52.55 54.71 1mio s ASP 436 Cb -0.02 -2.54 0.00 0.00 1.07 0.00 0.00 42.92 41.43 1mio s ASP 436 CO 0.18 -0.27 0.00 0.61 1.18 0.00 0.00 175.17 176.87 1mio n GLY 437 N -0.28 0.48 3.91 0.21 0.00 0.25 -4.95 105.19 104.81 1mio n GLY 437 Ca 0.05 -0.21 -0.28 0.00 0.00 0.00 0.00 46.02 45.59 1mio n GLY 437 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1mio s THR 438 N -1.85 3.43 0.08 2.61 2.01 -1.22 -4.90 115.64 115.80 1mio s THR 438 Ca 0.00 0.12 0.09 0.00 0.31 0.00 0.00 61.69 62.21 1mio s THR 438 Cb 0.00 -3.41 -0.03 0.00 0.01 0.00 0.00 72.50 69.07 1mio s THR 438 CO 0.00 -0.46 -0.24 -0.63 -0.69 0.00 0.00 174.62 172.60 1mio s ILE 439 N -3.14 1.98 0.08 1.82 1.09 -1.02 -2.59 121.20 119.42 1mio s ILE 439 Ca 0.56 -1.50 0.08 0.00 -1.10 0.00 0.00 60.65 58.69 1mio s ILE 439 Cb -0.11 -1.74 -0.03 0.00 -1.06 0.00 0.00 42.46 39.52 1mio s ILE 439 CO 0.47 0.16 -0.20 -0.76 -0.10 0.00 0.00 174.94 174.51 1mio s LEU 440 N -1.62 2.25 -0.29 2.97 1.02 -0.38 -1.39 118.68 121.24 1mio s LEU 440 Ca 0.10 -0.62 0.02 0.00 0.02 0.00 0.00 54.13 53.66 1mio s LEU 440 Cb -0.10 -0.88 0.16 0.00 0.02 0.00 0.00 46.19 45.39 1mio s LEU 440 CO 0.04 0.08 0.41 -0.51 0.02 0.00 0.00 176.35 176.39 1mio s ILE 441 N -1.03 -0.64 -0.08 -0.59 2.07 -1.15 -1.10 121.20 118.67 1mio s ILE 441 Ca 0.06 -0.28 -0.28 0.00 -1.41 0.00 0.00 60.65 58.74 1mio s ILE 441 Cb -0.09 -0.98 -0.02 0.00 0.13 0.00 0.00 42.46 41.49 1mio s ILE 441 CO 0.03 -0.27 0.92 -0.62 -1.91 0.00 0.00 174.94 173.09 1mio s ASP 442 N 2.55 7.20 -0.78 4.50 2.15 -0.30 -3.26 116.67 128.73 1mio s ASP 442 Ca 0.10 1.46 -0.01 0.00 0.43 0.00 0.00 52.55 54.53 1mio s ASP 442 Cb -0.12 -2.52 -0.00 0.00 -0.30 0.00 0.00 42.92 39.97 1mio s ASP 442 CO -0.29 -0.33 0.69 -0.67 -0.17 0.00 0.00 175.17 174.40 1mio n ASP 443 N 4.51 -7.04 -4.76 -0.34 2.03 -0.32 -4.78 116.55 105.85 1mio n ASP 443 Ca 0.06 -0.32 -0.41 0.00 0.52 0.00 0.00 54.79 54.64 1mio n ASP 443 Cb 0.50 -4.45 -0.03 0.00 -0.72 0.00 0.00 41.12 36.41 1mio n ASP 443 CO 0.00 0.00 0.00 -0.32 -1.92 0.00 0.00 177.20 174.96 1mio s MET 444 N -3.57 4.52 0.58 -0.67 -2.45 -1.26 -5.05 119.30 111.41 1mio s MET 444 Ca 0.03 1.97 0.03 0.00 -1.25 0.00 0.00 55.69 56.47 1mio s MET 444 Cb -0.01 -3.15 0.07 0.00 1.25 0.00 0.00 34.83 32.99 1mio s MET 444 CO 0.79 0.03 0.81 -0.80 1.05 0.00 0.00 175.02 176.89 1mio s ASN 445 N -0.62 5.03 0.26 1.11 0.01 -1.26 -4.41 114.94 115.06 1mio s ASN 445 Ca 0.47 -0.32 0.04 0.00 -0.71 0.00 0.00 52.86 52.34 1mio s ASN 445 Cb -0.35 -0.39 0.33 0.00 0.41 0.00 0.00 41.25 41.25 1mio s ASN 445 CO 0.45 -1.33 1.62 -0.74 -1.51 0.00 0.00 177.10 175.59 1mio h HIS 446 N -0.00 0.35 -0.87 2.20 -0.00 -1.87 -3.00 115.15 111.96 1mio h HIS 446 Ca -0.38 -0.11 0.03 0.00 -0.00 0.00 0.00 60.37 59.91 1mio h HIS 446 Cb 1.28 -0.07 -0.05 0.00 -0.00 0.00 0.00 27.41 28.57 1mio h HIS 446 CO 0.22 0.73 0.57 1.25 -0.00 0.00 0.00 177.93 180.70 1mio h HIS 447 N 0.23 1.05 0.03 5.26 6.17 -1.96 -2.50 115.15 123.44 1mio h HIS 447 Ca 0.01 0.03 -0.00 0.00 0.71 0.00 0.00 60.37 61.11 1mio h HIS 447 Cb 0.96 -0.35 0.00 0.00 2.52 0.00 0.00 27.41 30.53 1mio h HIS 447 CO 0.02 0.62 -0.01 -0.44 0.71 0.00 0.00 177.93 178.82 1mio h ASP 448 N 1.10 -0.03 -0.17 3.26 3.32 -1.92 -2.71 116.42 119.26 1mio h ASP 448 Ca 0.34 -0.55 0.05 0.00 0.02 0.00 0.00 57.03 56.90 1mio h ASP 448 Cb 0.01 0.01 -0.06 0.00 0.22 0.00 0.00 39.33 39.50 1mio h ASP 448 CO -0.10 0.55 -0.28 -0.03 -1.72 0.00 0.00 179.24 177.65 1mio h MET 449 N -0.63 -0.32 0.04 3.56 4.05 -1.55 -0.83 114.93 119.24 1mio h MET 449 Ca -0.00 0.02 -0.00 0.00 -0.28 0.00 0.00 59.70 59.44 1mio h MET 449 Cb 0.58 0.07 -0.01 0.00 -0.80 0.00 0.00 31.60 31.45 1mio h MET 449 CO 0.01 -0.22 -0.07 1.49 0.23 0.00 0.00 176.91 178.35 1mio h GLU 450 N -0.34 -0.12 -0.90 0.39 4.57 -1.54 0.47 114.58 117.11 1mio h GLU 450 Ca 0.11 0.01 0.22 0.00 -1.18 0.00 0.00 59.36 58.51 1mio h GLU 450 Cb 0.51 0.03 -0.17 0.00 -0.16 0.00 0.00 28.75 28.95 1mio h GLU 450 CO -0.36 -0.08 -0.09 0.28 -1.18 0.00 0.00 179.01 177.58 1mio n VAL 451 N -2.80 -0.38 -0.09 0.32 0.31 -1.02 -0.65 118.33 114.02 1mio n VAL 451 Ca -0.01 2.02 -0.09 0.00 -0.01 0.00 0.00 64.34 66.24 1mio n VAL 451 Cb 0.06 -2.88 -0.02 0.00 -0.91 0.00 0.00 33.84 30.10 1mio n VAL 451 CO 0.00 0.00 0.00 0.58 -1.32 0.00 0.00 176.83 176.09 1mio h VAL 452 N 0.00 1.10 -0.38 2.52 2.07 -0.60 -0.46 116.25 120.50 1mio h VAL 452 Ca 0.49 -0.23 -0.07 0.00 0.82 0.00 0.00 66.70 67.72 1mio h VAL 452 Cb 0.91 0.70 -0.01 0.00 -1.52 0.00 0.00 31.29 31.36 1mio h VAL 452 CO -0.88 0.10 -0.03 0.25 0.02 0.00 0.00 177.57 177.02 1mio h LEU 453 N 0.40 0.69 0.00 2.57 5.85 0.23 -0.53 115.31 124.52 1mio h LEU 453 Ca 0.11 -0.33 0.00 0.00 0.84 0.00 0.00 57.88 58.50 1mio h LEU 453 Cb -0.00 -0.19 0.00 0.00 0.37 0.00 0.00 40.66 40.84 1mio h LEU 453 CO -0.02 0.85 -0.44 -0.33 -0.34 0.00 0.00 178.44 178.16 1mio h GLU 454 N 0.50 0.00 0.02 1.25 4.39 -0.78 -1.23 114.58 118.73 1mio h GLU 454 Ca 0.10 0.00 -0.34 0.00 0.34 0.00 0.00 59.36 59.46 1mio h GLU 454 Cb 0.52 0.00 -0.06 0.00 -0.10 0.00 0.00 28.75 29.12 1mio h GLU 454 CO 0.03 0.00 -2.11 1.17 -1.16 0.00 0.00 179.01 176.94 1mio n LYS 455 N -2.63 0.67 -0.00 2.33 3.00 -0.19 -4.54 118.16 116.80 1mio n LYS 455 Ca 0.03 0.16 0.08 0.00 -0.00 0.00 0.00 58.31 58.57 1mio n LYS 455 Cb 0.50 -1.64 -0.11 0.00 0.00 0.00 0.00 35.03 33.78 1mio n LYS 455 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.40 178.68 1mio n LEU 456 N -3.02 0.24 -2.40 3.14 4.32 -0.22 -5.06 117.00 114.00 1mio n LEU 456 Ca -0.29 -0.17 -0.21 0.00 -0.02 0.00 0.00 56.01 55.33 1mio n LEU 456 Cb 1.08 0.00 0.02 0.00 -1.62 0.00 0.00 43.42 42.90 1mio n LEU 456 CO 0.41 0.06 -0.15 0.29 -1.22 0.00 0.00 177.39 176.79 1mio n LYS 457 N -1.81 -1.01 -0.65 3.23 4.01 -0.46 -4.93 118.16 116.53 1mio n LYS 457 Ca -0.01 0.73 -0.19 0.00 -0.51 0.00 0.00 58.31 58.33 1mio n LYS 457 Cb 0.35 -1.07 0.16 0.00 -0.51 0.00 0.00 35.03 33.96 1mio n LYS 457 CO 0.00 0.00 0.00 -2.30 -1.11 0.00 0.00 177.40 173.99 1mio n PRO 458 N -0.21 -2.43 -0.06 1.97 -0.02 -1.26 -5.01 135.00 127.99 1mio n PRO 458 Ca -0.06 -1.12 -0.07 0.00 -2.02 0.00 0.00 63.50 60.24 1mio n PRO 458 Cb 0.37 -1.05 -0.07 0.00 -0.02 0.00 0.00 33.50 32.72 1mio n PRO 458 CO 0.00 0.00 0.00 -0.25 1.98 0.00 0.00 175.50 177.23 1mio n ASP 459 N -4.22 2.70 -4.21 2.55 8.00 -0.83 -4.95 116.55 115.60 1mio n ASP 459 Ca 0.10 -0.03 -0.12 0.00 0.71 0.00 0.00 54.79 55.45 1mio n ASP 459 Cb 0.38 0.36 -0.10 0.00 -0.02 0.00 0.00 41.12 41.73 1mio n ASP 459 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1mio s MET 460 N -2.25 0.96 -0.10 -1.24 0.23 -1.14 -3.13 119.30 112.62 1mio s MET 460 Ca -0.10 -1.41 -0.04 0.00 -1.03 0.00 0.00 55.69 53.11 1mio s MET 460 Cb 0.04 -0.37 0.05 0.00 -1.53 0.00 0.00 34.83 33.02 1mio s MET 460 CO 0.37 0.00 0.21 0.12 -2.03 0.00 0.00 175.02 173.69 1mio s PHE 461 N -3.52 -0.29 -0.09 3.16 2.19 -0.80 -3.41 117.98 115.21 1mio s PHE 461 Ca 0.15 0.76 -0.06 0.00 0.33 0.00 0.00 56.93 58.11 1mio s PHE 461 Cb 0.04 -0.10 -0.04 0.00 -1.31 0.00 0.00 43.02 41.61 1mio s PHE 461 CO -0.02 -0.28 0.16 -0.06 1.83 0.00 0.00 175.22 176.85 1mio s PHE 462 N 2.02 3.59 0.00 10.12 0.40 -0.02 -3.55 117.98 130.55 1mio s PHE 462 Ca -0.01 0.50 0.00 0.00 -0.60 0.00 0.00 56.93 56.82 1mio s PHE 462 Cb -0.12 -1.92 0.00 0.00 0.51 0.00 0.00 43.02 41.49 1mio s PHE 462 CO -0.07 0.71 0.00 0.00 0.70 0.00 0.00 175.22 176.56 1mio n ALA 463 N 1.72 0.00 -3.47 5.36 0.00 -1.19 -1.91 120.51 121.01 1mio n ALA 463 Ca -0.18 0.00 -0.06 0.00 0.00 0.00 0.00 53.44 53.20 1mio n ALA 463 Cb 0.54 0.00 -0.02 0.00 0.00 0.00 0.00 19.45 19.98 1mio n ALA 463 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1mio n GLY 464 N 0.00 2.74 0.28 0.00 0.00 -1.26 -2.07 105.19 104.88 1mio n GLY 464 Ca 0.00 -1.50 0.08 0.00 0.00 0.00 0.00 46.02 44.59 1mio n GLY 464 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 173.32 174.51 1mio h ILE 465 N 1.46 0.45 0.00 -0.61 6.09 -1.99 0.13 117.51 123.04 1mio h ILE 465 Ca -0.12 -0.08 -0.14 0.00 -1.37 0.00 0.00 64.86 63.15 1mio h ILE 465 Cb 0.53 0.18 -0.02 0.00 0.47 0.00 0.00 36.82 37.98 1mio h ILE 465 CO 0.16 0.04 -0.67 0.11 -3.07 0.00 0.00 178.15 174.73 1mio h LYS 466 N 0.25 0.00 0.16 2.19 6.56 -2.01 -3.29 116.57 120.43 1mio h LYS 466 Ca 0.45 0.00 -0.28 0.00 -1.06 0.00 0.00 60.65 59.76 1mio h LYS 466 Cb 0.81 0.00 0.03 0.00 -0.57 0.00 0.00 32.23 32.51 1mio h LYS 466 CO -0.56 0.67 -1.21 0.93 -2.06 0.00 0.00 179.45 177.22 1mio h GLU 467 N 0.00 0.54 -0.73 3.15 3.07 -1.45 -3.34 114.58 115.81 1mio h GLU 467 Ca -0.01 -0.79 0.13 0.00 -0.50 0.00 0.00 59.36 58.20 1mio h GLU 467 Cb 1.35 0.28 -0.13 0.00 -0.84 0.00 0.00 28.75 29.41 1mio h GLU 467 CO 0.09 1.36 -0.22 1.17 -1.40 0.00 0.00 179.01 180.01 1mio n LYS 468 N -3.85 -0.10 0.10 2.33 3.00 0.26 -0.80 118.16 119.09 1mio n LYS 468 Ca -0.15 1.14 -0.00 0.00 -0.00 0.00 0.00 58.31 59.30 1mio n LYS 468 Cb 0.98 -1.69 -0.03 0.00 0.00 0.00 0.00 35.03 34.29 1mio n LYS 468 CO 0.00 0.00 0.00 0.74 0.00 0.00 0.00 177.40 178.14 1mio h PHE 469 N 0.00 0.00 0.56 5.64 0.04 -1.70 -2.64 116.94 118.84 1mio h PHE 469 Ca 0.32 0.00 -0.03 0.00 2.80 0.00 0.00 57.97 61.06 1mio h PHE 469 Cb 0.50 0.00 0.01 0.00 2.20 0.00 0.00 35.95 38.66 1mio h PHE 469 CO -0.59 0.62 -0.27 0.28 -0.60 0.00 0.00 178.31 177.75 1mio h VAL 470 N 0.00 0.00 -0.63 -0.55 2.07 -1.09 -2.81 116.25 113.24 1mio h VAL 470 Ca -0.05 -0.41 0.13 0.00 0.82 0.00 0.00 66.70 67.18 1mio h VAL 470 Cb 1.51 0.00 -0.12 0.00 -1.52 0.00 0.00 31.29 31.16 1mio h VAL 470 CO 0.07 0.00 -0.20 0.40 0.02 0.00 0.00 177.57 177.86 1mio h ILE 471 N -1.16 0.31 0.00 4.57 2.04 -1.36 -2.04 117.51 119.86 1mio h ILE 471 Ca -0.08 0.00 0.00 0.00 1.00 0.00 0.00 64.86 65.78 1mio h ILE 471 Cb 0.57 0.31 0.00 0.00 -0.74 0.00 0.00 36.82 36.96 1mio h ILE 471 CO 0.13 0.00 0.00 0.00 0.00 0.00 0.00 178.15 178.28 1mio n GLN 472 N -5.44 0.09 0.05 2.37 6.02 -0.99 -2.81 117.38 116.66 1mio n GLN 472 Ca 0.07 0.00 -0.07 0.00 -0.01 0.00 0.00 57.00 56.99 1mio n GLN 472 Cb 0.34 -1.50 -0.12 0.00 1.02 0.00 0.00 30.24 29.98 1mio n GLN 472 CO 0.00 0.00 0.00 -0.22 -1.01 0.00 0.00 177.06 175.83 1mio h LYS 473 N 0.00 0.01 0.00 -1.09 1.63 -1.09 -0.90 116.57 115.12 1mio h LYS 473 Ca 0.00 -0.02 0.00 0.00 -0.85 0.00 0.00 60.65 59.78 1mio h LYS 473 Cb 0.45 0.01 0.00 0.00 -0.60 0.00 0.00 32.23 32.09 1mio h LYS 473 CO 0.00 0.96 0.00 0.41 -3.45 0.00 0.00 179.45 177.37 1mio n GLY 474 N 1.38 -0.89 2.23 5.01 0.00 -1.07 -4.94 105.19 106.91 1mio n GLY 474 Ca -0.02 -0.09 -0.09 0.00 0.00 0.00 0.00 46.02 45.82 1mio n GLY 474 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1mio n GLY 475 N 0.59 0.25 3.12 -0.02 0.00 -0.34 -5.08 105.19 103.71 1mio n GLY 475 Ca 0.11 -0.27 -0.19 0.00 0.00 0.00 0.00 46.02 45.67 1mio n GLY 475 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1mio s VAL 476 N -3.14 1.02 0.22 1.61 1.01 -1.16 -4.99 120.40 114.97 1mio s VAL 476 Ca 0.15 -0.95 -0.30 0.00 0.00 0.00 0.00 61.98 60.88 1mio s VAL 476 Cb -0.07 -0.93 -0.09 0.00 0.00 0.00 0.00 36.38 35.29 1mio s VAL 476 CO 0.30 -0.02 1.30 -0.22 0.00 0.00 0.00 175.10 176.47 1mio s LEU 477 N -1.10 4.42 -0.06 3.92 2.96 -1.18 -3.49 118.68 124.16 1mio s LEU 477 Ca 0.01 2.44 0.02 0.00 -0.22 0.00 0.00 54.13 56.37 1mio s LEU 477 Cb -0.08 -3.62 0.02 0.00 0.50 0.00 0.00 46.19 43.02 1mio s LEU 477 CO 0.01 -0.51 -0.08 -0.55 -1.32 0.00 0.00 176.35 173.90 1mio s SER 478 N 0.17 1.41 0.31 3.68 0.15 -1.26 -1.91 113.70 116.25 1mio s SER 478 Ca 0.55 -0.22 0.09 0.00 0.70 0.00 0.00 55.95 57.08 1mio s SER 478 Cb -0.37 -0.65 -0.05 0.00 -1.71 0.00 0.00 66.02 63.24 1mio s SER 478 CO 0.40 -0.02 -0.01 -0.54 1.20 0.00 0.00 173.24 174.28 1mio s LYS 479 N 0.84 2.12 -0.16 5.44 -0.14 -1.23 -4.99 119.74 121.62 1mio s LYS 479 Ca -0.12 -1.63 -0.02 0.00 -1.36 0.00 0.00 55.97 52.84 1mio s LYS 479 Cb -0.15 -2.00 -0.01 0.00 -1.68 0.00 0.00 37.83 33.98 1mio s LYS 479 CO 0.01 0.23 -0.09 -0.65 -0.76 0.00 0.00 175.35 174.09 1mio s GLN 480 N -3.69 3.40 0.08 1.68 -0.21 -1.26 -3.20 119.66 116.46 1mio s GLN 480 Ca 0.33 -0.65 0.25 0.00 0.02 0.00 0.00 55.36 55.31 1mio s GLN 480 Cb -0.03 -2.78 0.41 0.00 1.00 0.00 0.00 33.01 31.61 1mio s GLN 480 CO 0.19 0.08 1.35 -0.11 -2.12 0.00 0.00 175.29 174.68 1mio n LEU 481 N 3.95 0.61 -0.02 2.90 7.94 -0.88 -0.97 117.00 130.54 1mio n LEU 481 Ca -0.18 0.16 -0.01 0.00 -1.11 0.00 0.00 56.01 54.87 1mio n LEU 481 Cb 0.52 -0.21 -0.00 0.00 0.53 0.00 0.00 43.42 44.26 1mio n LEU 481 CO 0.30 0.00 -0.06 0.45 -1.11 0.00 0.00 177.39 176.98 1mio h HIS 482 N 0.00 0.00 0.00 1.96 3.86 -1.94 -3.41 115.15 115.62 1mio h HIS 482 Ca 0.00 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 59.21 1mio h HIS 482 Cb 0.66 0.00 0.00 0.00 1.06 0.00 0.00 27.41 29.13 1mio h HIS 482 CO 0.00 0.00 0.00 -1.13 0.86 0.00 0.00 177.93 177.66 1mio n SER 483 N -2.77 0.00 0.00 2.45 3.41 -1.26 -4.92 113.62 110.53 1mio n SER 483 Ca -0.01 0.13 0.00 0.00 -0.26 0.00 0.00 58.87 58.73 1mio n SER 483 Cb 0.04 -0.37 0.00 0.00 -0.26 0.00 0.00 64.21 63.62 1mio n SER 483 CO 0.00 0.00 0.00 -1.22 -0.16 0.00 0.00 175.04 173.66 1mio n TYR 484 N -1.37 0.00 -3.57 7.33 4.01 -0.15 -1.43 117.16 121.98 1mio n TYR 484 Ca 0.11 0.00 -0.22 0.00 -0.16 0.00 0.00 57.90 57.63 1mio n TYR 484 Cb 0.27 -1.56 0.08 0.00 -0.31 0.00 0.00 39.34 37.82 1mio n TYR 484 CO 0.00 0.00 0.00 -0.25 -0.46 0.00 0.00 176.86 176.15 1mio n ASP 485 N -0.62 -5.19 -3.59 7.72 9.92 -1.22 -3.48 116.55 120.09 1mio n ASP 485 Ca 0.00 -0.57 -0.26 0.00 -0.53 0.00 0.00 54.79 53.43 1mio n ASP 485 Cb 0.31 -5.01 0.05 0.00 -0.64 0.00 0.00 41.12 35.83 1mio n ASP 485 CO 0.00 0.00 0.00 -1.22 0.13 0.00 0.00 177.20 176.11 1mio n TYR 486 N -4.77 -2.48 -4.09 1.24 4.01 -0.51 -4.98 117.16 105.57 1mio n TYR 486 Ca -0.07 0.87 -0.10 0.00 -0.16 0.00 0.00 57.90 58.43 1mio n TYR 486 Cb 0.59 -4.47 -0.08 0.00 -0.31 0.00 0.00 39.34 35.07 1mio n TYR 486 CO 0.00 0.00 0.00 -0.80 -0.46 0.00 0.00 176.86 175.60 1mio s ASN 487 N -3.17 0.04 0.00 7.72 0.01 -1.23 -5.15 114.94 113.16 1mio s ASN 487 Ca 0.56 -1.15 0.00 0.00 -0.71 0.00 0.00 52.86 51.56 1mio s ASN 487 Cb -0.26 0.47 0.00 0.00 0.41 0.00 0.00 41.25 41.87 1mio s ASN 487 CO 0.69 -0.97 0.00 0.61 -1.51 0.00 0.00 177.10 175.92 1mio n GLY 488 N -0.31 3.28 3.77 0.66 0.00 -1.26 -4.68 105.19 106.64 1mio n GLY 488 Ca -0.00 -1.47 -0.38 0.00 0.00 0.00 0.00 46.02 44.16 1mio n GLY 488 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1mio s PRO 489 N -2.24 3.90 0.00 1.61 0.04 -0.99 -4.78 135.00 132.55 1mio s PRO 489 Ca 0.00 1.90 0.22 0.00 0.04 0.00 0.00 61.00 63.16 1mio s PRO 489 Cb 0.00 -2.59 -0.03 0.00 0.04 0.00 0.00 34.50 31.92 1mio s PRO 489 CO 0.00 -0.46 1.04 0.66 0.04 0.00 0.00 177.00 178.28 1mio n TYR 490 N -0.13 0.00 -4.16 0.56 4.02 -1.26 -4.27 117.16 111.92 1mio n TYR 490 Ca 0.05 0.00 -0.33 0.00 -0.01 0.00 0.00 57.90 57.62 1mio n TYR 490 Cb 0.46 -0.06 -0.08 0.00 -0.02 0.00 0.00 39.34 39.65 1mio n TYR 490 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 176.86 175.85 1mio s ALA 491 N -2.94 3.48 0.00 -0.72 0.00 -1.26 -4.11 121.76 116.21 1mio s ALA 491 Ca 0.10 -0.91 0.00 0.00 0.00 0.00 0.00 51.96 51.15 1mio s ALA 491 Cb 0.17 -1.49 0.00 0.00 0.00 0.00 0.00 23.12 21.80 1mio s ALA 491 CO 0.80 0.68 0.00 0.41 0.00 0.00 0.00 175.76 177.65 1mio n GLY 492 N 1.23 0.57 0.06 0.00 0.00 -0.61 -3.94 105.19 102.50 1mio n GLY 492 Ca -0.13 -2.21 -0.04 0.00 0.00 0.00 0.00 46.02 43.63 1mio n GLY 492 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 1mio n PHE 493 N 1.80 0.68 -0.21 1.61 3.72 -1.26 -3.84 117.46 119.96 1mio n PHE 493 Ca 0.00 0.29 0.26 0.00 -0.05 0.00 0.00 57.45 57.96 1mio n PHE 493 Cb 0.00 -0.64 0.66 0.00 -0.94 0.00 0.00 39.48 38.56 1mio n PHE 493 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 1mio h ARG 494 N -0.79 0.13 0.00 -1.08 3.08 -1.93 -0.67 114.38 113.11 1mio h ARG 494 Ca 0.00 -0.01 0.00 0.00 0.07 0.00 0.00 59.98 60.04 1mio h ARG 494 Cb 0.44 -0.03 0.00 0.00 0.08 0.00 0.00 29.97 30.46 1mio h ARG 494 CO 0.00 0.08 0.00 0.78 -1.07 0.00 0.00 179.97 179.76 1mio h GLY 495 N 0.13 0.00 0.92 0.04 0.00 -1.74 -3.03 103.07 99.38 1mio h GLY 495 Ca 0.46 0.00 -0.06 0.00 0.00 0.00 0.00 47.33 47.73 1mio h GLY 495 CO -0.07 0.00 -0.00 -2.08 0.00 0.00 0.00 176.54 174.39 1mio h VAL 496 N 0.00 1.26 -0.12 4.60 2.07 -1.22 -3.20 116.25 119.65 1mio h VAL 496 Ca 0.00 -0.98 -0.08 0.00 0.82 0.00 0.00 66.70 66.46 1mio h VAL 496 Cb 0.28 1.20 -0.01 0.00 -1.52 0.00 0.00 31.29 31.24 1mio h VAL 496 CO 0.00 0.32 -0.28 0.58 0.02 0.00 0.00 177.57 178.22 1mio h VAL 497 N 0.43 1.25 0.25 2.57 2.07 -1.66 -0.86 116.25 120.29 1mio h VAL 497 Ca 0.10 -1.16 -0.01 0.00 0.82 0.00 0.00 66.70 66.44 1mio h VAL 497 Cb 0.46 1.47 0.00 0.00 -1.52 0.00 0.00 31.29 31.70 1mio h VAL 497 CO 0.02 0.35 -0.12 0.78 0.02 0.00 0.00 177.57 178.62 1mio h ASN 498 N 0.19 -0.28 -0.00 0.57 -0.26 -1.59 -1.74 115.58 112.47 1mio h ASN 498 Ca 0.03 -0.21 0.02 0.00 -0.56 0.00 0.00 56.30 55.58 1mio h ASN 498 Cb 0.60 0.07 -0.02 0.00 -1.06 0.00 0.00 38.32 37.91 1mio h ASN 498 CO 0.04 0.08 -0.08 0.15 -1.06 0.00 0.00 177.43 176.56 1mio h PHE 499 N -0.68 -0.20 -0.27 1.19 3.04 -1.46 -1.59 116.94 116.97 1mio h PHE 499 Ca -0.03 0.01 0.05 0.00 3.98 0.00 0.00 57.97 61.97 1mio h PHE 499 Cb 0.47 0.09 -0.05 0.00 2.56 0.00 0.00 35.95 39.03 1mio h PHE 499 CO 0.03 -0.13 -0.02 0.78 -2.02 0.00 0.00 178.31 176.95 1mio h GLY 500 N -0.14 0.25 0.54 2.40 0.00 -1.18 0.20 103.07 105.14 1mio h GLY 500 Ca 0.03 0.04 -0.00 0.00 0.00 0.00 0.00 47.33 47.40 1mio h GLY 500 CO -0.09 -0.07 -0.05 0.45 0.00 0.00 0.00 176.54 176.79 1mio h HIS 501 N 0.06 -0.12 -0.60 5.60 3.86 -1.23 0.28 115.15 123.01 1mio h HIS 501 Ca 0.13 -0.00 0.11 0.00 -1.16 0.00 0.00 60.37 59.45 1mio h HIS 501 Cb 0.18 0.04 -0.12 0.00 1.06 0.00 0.00 27.41 28.57 1mio h HIS 501 CO -0.22 0.31 -0.28 0.93 0.86 0.00 0.00 177.93 179.53 1mio h GLU 502 N -0.59 -0.11 -0.26 2.45 4.39 -1.14 -0.75 114.58 118.57 1mio h GLU 502 Ca -0.01 0.01 -0.01 0.00 0.34 0.00 0.00 59.36 59.69 1mio h GLU 502 Cb 0.48 0.03 -0.01 0.00 -0.10 0.00 0.00 28.75 29.14 1mio h GLU 502 CO 0.02 -0.07 0.14 1.25 -1.16 0.00 0.00 179.01 179.19 1mio h LEU 503 N -0.12 0.32 -0.87 1.33 5.85 -0.46 0.74 115.31 122.10 1mio h LEU 503 Ca 0.26 -0.09 -0.12 0.00 0.84 0.00 0.00 57.88 58.78 1mio h LEU 503 Cb 0.53 -0.08 -0.01 0.00 0.37 0.00 0.00 40.66 41.47 1mio h LEU 503 CO -0.67 0.31 -0.47 -0.37 -0.34 0.00 0.00 178.44 176.91 1mio h VAL 504 N 0.30 1.33 0.00 1.05 -1.51 -0.52 -1.15 116.25 115.76 1mio h VAL 504 Ca 0.09 -1.65 -0.01 0.00 -1.23 0.00 0.00 66.70 63.89 1mio h VAL 504 Cb 0.06 1.78 -0.00 0.00 -2.13 0.00 0.00 31.29 31.00 1mio h VAL 504 CO -0.01 0.49 -0.06 0.78 -1.23 0.00 0.00 177.57 177.54 1mio h ASN 505 N 0.18 0.00 0.06 4.19 2.35 -0.90 -1.67 115.58 119.79 1mio h ASN 505 Ca 0.01 0.00 -0.00 0.00 -0.55 0.00 0.00 56.30 55.76 1mio h ASN 505 Cb 0.90 0.00 0.00 0.00 0.05 0.00 0.00 38.32 39.27 1mio h ASN 505 CO 0.07 0.06 -0.03 1.23 -1.65 0.00 0.00 177.43 177.11 1mio h GLY 506 N 2.47 -0.08 1.42 2.83 0.00 0.13 -3.23 103.07 106.61 1mio h GLY 506 Ca -0.00 0.03 -0.05 0.00 0.00 0.00 0.00 47.33 47.31 1mio h GLY 506 CO 0.01 -0.03 0.11 -2.22 0.00 0.00 0.00 176.54 174.41 1mio h ILE 507 N -0.79 1.21 -0.48 2.60 1.08 -1.04 -3.16 117.51 116.94 1mio h ILE 507 Ca -0.01 -0.76 0.00 0.00 -0.39 0.00 0.00 64.86 63.70 1mio h ILE 507 Cb 0.63 0.73 0.00 0.00 -3.07 0.00 0.00 36.82 35.11 1mio h ILE 507 CO 0.01 0.28 0.00 -1.22 -0.69 0.00 0.00 178.15 176.53 1mio n TYR 508 N -4.29 1.19 -2.11 1.37 4.01 -0.65 -4.92 117.16 111.76 1mio n TYR 508 Ca 0.03 -0.46 -0.42 0.00 -0.16 0.00 0.00 57.90 56.89 1mio n TYR 508 Cb 0.22 -0.23 -0.03 0.00 -0.31 0.00 0.00 39.34 38.99 1mio n TYR 508 CO 0.00 0.00 0.00 0.99 -0.46 0.00 0.00 176.86 177.39 1mio s THR 509 N -1.85 3.26 -0.09 -0.72 2.01 -1.20 -4.94 115.64 112.10 1mio s THR 509 Ca 0.38 0.83 0.18 0.00 0.31 0.00 0.00 61.69 63.39 1mio s THR 509 Cb 0.26 -3.53 0.13 0.00 0.01 0.00 0.00 72.50 69.36 1mio s THR 509 CO 0.17 0.04 1.57 -0.65 -0.69 0.00 0.00 174.62 175.06 1mio h PRO 510 N 7.28 0.00 0.00 4.92 0.11 -1.93 -3.12 132.00 139.26 1mio h PRO 510 Ca -0.41 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.70 1mio h PRO 510 Cb 1.20 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.31 1mio h PRO 510 CO 0.89 0.39 0.00 0.00 -0.21 0.00 0.00 178.00 179.07 1mio n ALA 511 N -2.22 1.39 -0.27 -0.75 0.00 -1.26 -1.60 120.51 115.80 1mio n ALA 511 Ca 0.02 0.09 -0.04 0.00 0.00 0.00 0.00 53.44 53.51 1mio n ALA 511 Cb 0.63 -1.29 0.08 0.00 0.00 0.00 0.00 19.45 18.87 1mio n ALA 511 CO 0.00 0.00 0.00 -1.49 0.00 0.00 0.00 177.50 176.01 1mio h TRP 512 N 0.00 0.90 -0.01 0.00 -0.00 -1.95 -2.28 115.95 112.62 1mio h TRP 512 Ca 0.00 0.02 0.00 0.00 -0.00 0.00 0.00 58.89 58.91 1mio h TRP 512 Cb 0.19 -0.30 0.00 0.00 -0.00 0.00 0.00 29.16 29.05 1mio h TRP 512 CO 0.00 0.54 -0.07 1.63 -0.00 0.00 0.00 178.44 180.54 1mio n LYS 513 N -4.61 0.93 -0.28 0.49 4.01 -0.63 -3.90 118.16 114.18 1mio n LYS 513 Ca 0.08 -0.33 0.08 0.00 -0.51 0.00 0.00 58.31 57.63 1mio n LYS 513 Cb 0.06 -1.49 0.18 0.00 -0.51 0.00 0.00 35.03 33.26 1mio n LYS 513 CO 0.00 0.00 0.00 -1.33 -1.11 0.00 0.00 177.40 174.96 1mio n MET 514 N -0.74 1.64 0.09 1.97 2.81 -0.86 -4.73 117.12 117.30 1mio n MET 514 Ca 0.17 -2.80 -0.04 0.00 -1.81 0.00 0.00 57.70 53.22 1mio n MET 514 Cb 0.26 -1.60 -0.01 0.00 -0.71 0.00 0.00 33.22 31.16 1mio n MET 514 CO 0.00 0.00 0.00 0.82 1.51 0.00 0.00 175.97 178.30 1mio h ILE 515 N 0.54 1.57 -3.52 2.02 2.04 -1.66 -3.43 117.51 115.08 1mio h ILE 515 Ca 0.02 -2.92 -0.61 0.00 1.00 0.00 0.00 64.86 62.35 1mio h ILE 515 Cb 1.12 2.59 -0.12 0.00 -0.74 0.00 0.00 36.82 39.67 1mio h ILE 515 CO 0.06 0.83 -0.06 -0.89 0.00 0.00 0.00 178.15 178.09 1mio s THR 516 N -3.02 5.11 0.26 -0.27 2.01 -1.26 -5.04 115.64 113.42 1mio s THR 516 Ca 0.00 0.88 -0.29 0.00 0.31 0.00 0.00 61.69 62.58 1mio s THR 516 Cb 0.11 -3.81 -0.09 0.00 0.01 0.00 0.00 72.50 68.71 1mio s THR 516 CO 0.80 0.16 1.19 -2.16 -0.69 0.00 0.00 174.62 173.91 1mio s PRO 517 N 1.82 4.52 0.61 4.92 0.04 -1.26 -4.89 135.00 140.75 1mio s PRO 517 Ca 0.22 1.94 0.28 0.00 0.04 0.00 0.00 61.00 63.48 1mio s PRO 517 Cb -0.15 -3.18 1.46 0.00 0.04 0.00 0.00 34.50 32.67 1mio s PRO 517 CO 0.09 0.00 1.86 -1.35 0.04 0.00 0.00 177.00 177.65 1mio h PRO 518 N 4.24 0.00 0.03 0.56 0.11 -1.96 -2.33 132.00 132.65 1mio h PRO 518 Ca -0.46 0.00 -0.00 0.00 0.11 0.00 0.00 66.00 65.64 1mio h PRO 518 Cb 1.22 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.33 1mio h PRO 518 CO 0.70 0.00 -0.01 0.11 -0.21 0.00 0.00 178.00 178.58 1mio h TRP 519 N 0.00 -0.04 -1.23 0.65 0.09 -1.91 -3.34 115.95 110.17 1mio h TRP 519 Ca 0.17 -0.00 -0.72 0.00 0.09 0.00 0.00 58.89 58.43 1mio h TRP 519 Cb 1.12 0.01 -0.12 0.00 0.08 0.00 0.00 29.16 30.26 1mio h TRP 519 CO 0.00 -0.02 2.06 0.36 0.09 0.00 0.00 178.44 180.93 1mio n LYS 520 N -3.63 3.28 0.00 0.12 2.85 -0.88 -2.17 118.16 117.73 1mio n LYS 520 Ca -0.00 -3.39 0.00 0.00 -1.05 0.00 0.00 58.31 53.86 1mio n LYS 520 Cb 0.02 -3.20 0.00 0.00 -0.65 0.00 0.00 35.03 31.19 1mio n LYS 520 CO 0.00 0.00 0.00 1.63 -0.05 0.00 0.00 177.40 178.98 1mio n LYS 521 N 6.21 0.00 -3.27 -1.58 4.76 -1.24 -4.51 118.16 118.53 1mio n LYS 521 Ca 0.44 0.00 -0.46 0.00 -2.87 0.00 0.00 58.31 55.42 1mio n LYS 521 Cb 0.42 0.00 -0.03 0.00 -1.84 0.00 0.00 35.03 33.57 1mio n LYS 521 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 1mio s ALA 522 N -1.24 3.80 0.00 7.82 0.00 -1.26 -4.27 121.76 126.61 1mio s ALA 522 Ca 0.00 -2.88 0.00 0.00 0.00 0.00 0.00 51.96 49.08 1mio s ALA 522 Cb 0.00 -3.47 0.00 0.00 0.00 0.00 0.00 23.12 19.65 1mio s ALA 522 CO 0.00 -2.25 0.00 0.45 0.00 0.00 0.00 175.76 173.96 1mio n SER 523 N 4.89 0.00 -0.75 0.00 2.88 -1.19 -4.96 113.62 114.49 1mio n SER 523 Ca 0.02 0.00 -0.03 0.00 -1.33 0.00 0.00 58.87 57.53 1mio n SER 523 Cb 0.44 0.00 -0.03 0.00 -0.75 0.00 0.00 64.21 63.87 1mio n SER 523 CO 0.00 0.00 0.00 -1.20 -1.23 0.00 0.00 175.04 172.61 1mio n SER 524 N 0.00 -0.34 -1.01 -3.46 7.64 -0.92 -4.09 113.62 111.43 1mio n SER 524 Ca 0.00 -1.51 -0.01 0.00 1.01 0.00 0.00 58.87 58.36 1mio n SER 524 Cb 0.00 0.09 -0.02 0.00 -1.01 0.00 0.00 64.21 63.27 1mio n SER 524 CO 0.00 0.00 0.00 -0.62 -3.01 0.00 0.00 175.04 171.41 1mio n GLU 525 N 0.03 0.00 0.00 1.43 1.02 -1.26 -4.93 120.64 116.92 1mio n GLU 525 Ca -0.11 -1.17 0.00 0.00 -0.02 0.00 0.00 57.16 55.86 1mio n GLU 525 Cb 0.63 0.11 0.00 0.00 -0.02 0.00 0.00 31.44 32.15 1mio n GLU 525 CO 0.00 0.00 0.00 0.45 1.18 0.00 0.00 177.13 178.76