#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3h7t s ILE 2 N 0.00 5.09 0.00 1.39 1.01 0.04 -4.18 121.20 124.55 3h7t s ILE 2 Ca 0.00 0.98 0.00 0.00 0.00 0.00 0.00 60.65 61.63 3h7t s ILE 2 Cb 0.00 -3.85 0.00 0.00 0.01 0.00 0.00 42.46 38.62 3h7t s ILE 2 CO 0.00 0.16 0.00 0.61 0.00 0.00 0.00 174.94 175.71 3h7t n GLY 3 N 3.90 0.69 0.00 6.18 0.00 -1.26 -1.23 105.19 113.47 3h7t n GLY 3 Ca -0.04 -0.68 0.00 0.00 0.00 0.00 0.00 46.02 45.30 3h7t n GLY 3 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3h7t n GLY 4 N -2.20 3.74 3.23 -0.02 0.00 -1.26 -4.81 105.19 103.88 3h7t n GLY 4 Ca 0.00 -1.97 -0.09 0.00 0.00 0.00 0.00 46.02 43.96 3h7t n GLY 4 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3h7t s LYS 5 N 2.62 0.94 0.26 1.61 -2.85 0.00 -4.94 119.74 117.38 3h7t s LYS 5 Ca 0.00 -1.13 -0.31 0.00 -1.00 0.00 0.00 55.97 53.54 3h7t s LYS 5 Cb 0.00 0.33 -0.11 0.00 -2.06 0.00 0.00 37.83 35.98 3h7t s LYS 5 CO 0.00 -0.30 1.63 0.21 0.10 0.00 0.00 175.35 176.98 3h7t s LYS 6 N -3.93 4.13 0.00 1.78 2.20 -1.26 -0.35 119.74 122.31 3h7t s LYS 6 Ca 0.12 2.56 0.00 0.00 -0.36 0.00 0.00 55.97 58.29 3h7t s LYS 6 Cb 0.05 -3.05 0.00 0.00 -1.51 0.00 0.00 37.83 33.32 3h7t s LYS 6 CO -0.05 -0.66 0.00 0.45 -0.36 0.00 0.00 175.35 174.73 3h7t n SER 7 N 2.87 1.45 -3.81 1.43 2.88 0.69 -4.76 113.62 114.36 3h7t n SER 7 Ca 0.11 -0.31 -0.12 0.00 -1.33 0.00 0.00 58.87 57.21 3h7t n SER 7 Cb 0.37 0.00 -0.10 0.00 -0.75 0.00 0.00 64.21 63.72 3h7t n SER 7 CO 0.00 0.00 0.00 -0.62 -1.23 0.00 0.00 175.04 173.19 3h7t s ASP 8 N -0.01 -0.15 0.62 -3.46 -1.08 -1.26 -4.75 116.67 106.58 3h7t s ASP 8 Ca 0.00 0.17 0.39 0.00 -0.52 0.00 0.00 52.55 52.59 3h7t s ASP 8 Cb 0.00 0.36 2.01 0.00 -1.46 0.00 0.00 42.92 43.83 3h7t s ASP 8 CO 0.00 -0.26 2.24 -0.29 0.52 0.00 0.00 175.17 177.38 3h7t h ILE 9 N 4.41 0.13 0.00 4.11 6.09 -1.89 0.46 117.51 130.82 3h7t h ILE 9 Ca -0.28 -0.19 -0.03 0.00 -1.37 0.00 0.00 64.86 62.99 3h7t h ILE 9 Cb 1.19 1.16 -0.00 0.00 0.47 0.00 0.00 36.82 39.64 3h7t h ILE 9 CO 0.38 0.02 -0.14 0.71 -3.07 0.00 0.00 178.15 176.05 3h7t h THR 10 N 0.00 0.32 0.00 2.19 1.35 -1.87 -0.50 112.91 114.40 3h7t h THR 10 Ca -0.00 -0.99 -0.13 0.00 -0.55 0.00 0.00 66.41 64.73 3h7t h THR 10 Cb 0.16 1.77 -0.02 0.00 -1.73 0.00 0.00 68.15 68.33 3h7t h THR 10 CO 0.00 0.14 -0.66 0.11 -0.25 0.00 0.00 175.52 174.86 3h7t h LYS 11 N 0.00 0.00 -2.03 4.72 1.79 -1.22 -3.38 116.57 116.46 3h7t h LYS 11 Ca -0.00 0.00 -0.52 0.00 -2.18 0.00 0.00 60.65 57.94 3h7t h LYS 11 Cb 0.76 0.00 -0.40 0.00 -1.58 0.00 0.00 32.23 31.01 3h7t h LYS 11 CO 0.02 0.62 -1.10 0.39 -1.08 0.00 0.00 179.45 178.29 3h7t n GLU 12 N -3.24 1.07 0.00 3.15 4.71 -1.09 -4.97 120.64 120.26 3h7t n GLU 12 Ca 0.01 -3.46 0.03 0.00 -0.01 0.00 0.00 57.16 53.73 3h7t n GLU 12 Cb 0.79 -1.57 0.17 0.00 -1.01 0.00 0.00 31.44 29.82 3h7t n GLU 12 CO 0.00 0.00 0.00 -0.35 0.09 0.00 0.00 177.13 176.87 3h7t n PRO 13 N 0.72 0.07 0.16 3.49 -0.04 -0.22 -1.14 135.00 138.05 3h7t n PRO 13 Ca 0.24 0.28 0.12 0.00 -0.04 0.00 0.00 63.50 64.10 3h7t n PRO 13 Cb 0.58 -1.50 0.14 0.00 -0.04 0.00 0.00 33.50 32.68 3h7t n PRO 13 CO 0.00 0.00 0.00 0.11 -0.04 0.00 0.00 175.50 175.57 3h7t h TRP 14 N 0.00 0.00 -3.43 0.54 0.09 -1.83 -0.89 115.95 110.44 3h7t h TRP 14 Ca 0.00 0.00 -0.52 0.00 0.09 0.00 0.00 58.89 58.46 3h7t h TRP 14 Cb 0.09 0.00 0.02 0.00 0.08 0.00 0.00 29.16 29.35 3h7t h TRP 14 CO 0.00 0.00 0.58 0.00 0.09 0.00 0.00 178.44 179.11 3h7t s ALA 15 N -3.24 3.45 0.17 0.11 0.00 -0.29 -0.49 121.76 121.47 3h7t s ALA 15 Ca 0.05 0.97 0.04 0.00 0.00 0.00 0.00 51.96 53.02 3h7t s ALA 15 Cb 0.08 -3.43 -0.05 0.00 0.00 0.00 0.00 23.12 19.72 3h7t s ALA 15 CO 0.70 -0.41 -0.07 0.14 0.00 0.00 0.00 175.76 176.12 3h7t s VAL 16 N 0.11 1.14 -0.06 0.00 -7.23 -0.67 -4.60 120.40 109.09 3h7t s VAL 16 Ca 0.54 -2.06 -0.09 0.00 -1.81 0.00 0.00 61.98 58.56 3h7t s VAL 16 Cb -0.33 -2.01 -0.05 0.00 0.56 0.00 0.00 36.38 34.55 3h7t s VAL 16 CO 0.36 -0.61 0.25 -0.83 -0.31 0.00 0.00 175.10 173.96 3h7t s GLY 17 N -3.22 2.28 -0.37 2.32 0.00 0.45 -0.54 107.32 108.24 3h7t s GLY 17 Ca 0.21 -0.50 -0.00 0.00 0.00 0.00 0.00 44.72 44.43 3h7t s GLY 17 CO 0.03 -0.22 0.13 0.14 0.00 0.00 0.00 173.10 173.18 3h7t s VAL 18 N -1.10 2.89 -0.21 1.40 1.01 0.11 -0.73 120.40 123.77 3h7t s VAL 18 Ca 0.20 -2.10 -0.20 0.00 0.00 0.00 0.00 61.98 59.89 3h7t s VAL 18 Cb -0.14 -3.00 -0.03 0.00 0.00 0.00 0.00 36.38 33.22 3h7t s VAL 18 CO 0.09 -0.60 0.58 -0.76 0.00 0.00 0.00 175.10 174.42 3h7t s LEU 19 N 1.06 4.13 -0.14 3.92 1.02 0.28 -2.57 118.68 126.38 3h7t s LEU 19 Ca 0.08 0.75 0.02 0.00 0.02 0.00 0.00 54.13 55.00 3h7t s LEU 19 Cb -0.21 -2.81 0.01 0.00 0.02 0.00 0.00 46.19 43.20 3h7t s LEU 19 CO -0.05 -0.25 -0.21 -0.69 0.02 0.00 0.00 176.35 175.17 3h7t s VAL 20 N 1.90 1.97 -0.04 -1.59 1.01 -1.26 -0.10 120.40 122.28 3h7t s VAL 20 Ca 0.26 -0.92 -0.33 0.00 0.00 0.00 0.00 61.98 60.99 3h7t s VAL 20 Cb -0.16 -1.75 -0.11 0.00 0.00 0.00 0.00 36.38 34.36 3h7t s VAL 20 CO 0.10 0.53 1.89 -0.67 0.00 0.00 0.00 175.10 176.95 3h7t n ASP 21 N 4.12 3.61 -1.54 3.32 -0.08 0.73 -1.63 116.55 125.08 3h7t n ASP 21 Ca -0.20 0.96 -0.19 0.00 -1.51 0.00 0.00 54.79 53.86 3h7t n ASP 21 Cb 0.51 -1.41 -0.08 0.00 2.34 0.00 0.00 41.12 42.48 3h7t n ASP 21 CO 0.00 0.00 0.00 -0.62 0.12 0.00 0.00 177.20 176.70 3h7t n GLU 22 N 6.64 -1.41 -4.41 -0.67 -0.58 -1.26 -4.96 120.64 113.99 3h7t n GLU 22 Ca 0.22 1.09 -0.20 0.00 -0.42 0.00 0.00 57.16 57.85 3h7t n GLU 22 Cb 0.32 -5.44 -0.10 0.00 -0.57 0.00 0.00 31.44 25.65 3h7t n GLU 22 CO 0.00 0.00 0.00 0.15 -0.48 0.00 0.00 177.13 176.80 3h7t s LYS 23 N -3.57 1.54 0.41 3.49 -0.14 -0.65 -5.13 119.74 115.70 3h7t s LYS 23 Ca 0.00 -1.81 -0.25 0.00 -1.36 0.00 0.00 55.97 52.54 3h7t s LYS 23 Cb 0.00 -0.91 -0.10 0.00 -1.68 0.00 0.00 37.83 35.13 3h7t s LYS 23 CO 0.00 -0.08 1.23 -2.30 -0.76 0.00 0.00 175.35 173.43 3h7t n PRO 24 N -0.59 1.84 -2.13 -1.68 -0.02 -1.26 -4.56 135.00 126.60 3h7t n PRO 24 Ca -0.04 0.65 -0.36 0.00 -2.02 0.00 0.00 63.50 61.73 3h7t n PRO 24 Cb 0.65 -2.31 0.01 0.00 -0.02 0.00 0.00 33.50 31.82 3h7t n PRO 24 CO 0.00 0.00 0.00 0.12 1.98 0.00 0.00 175.50 177.60 3h7t s PHE 25 N -1.20 2.63 0.07 6.00 5.36 -1.26 -4.53 117.98 125.04 3h7t s PHE 25 Ca 0.61 1.51 -0.00 0.00 -0.96 0.00 0.00 56.93 58.09 3h7t s PHE 25 Cb -0.52 -3.44 -0.04 0.00 -0.34 0.00 0.00 43.02 38.67 3h7t s PHE 25 CO 0.58 -1.89 -0.04 0.00 -1.46 0.00 0.00 175.22 172.42 3h7t s GLY 27 N -2.96 1.80 0.38 0.00 0.00 -0.13 0.08 107.32 106.48 3h7t s GLY 27 Ca 0.09 -1.47 -0.13 0.00 0.00 0.00 0.00 44.72 43.21 3h7t s GLY 27 CO -0.08 -1.08 0.73 -0.32 0.00 0.00 0.00 173.10 172.35 3h7t s GLY 28 N -4.54 0.64 -0.03 0.20 0.00 0.30 -4.16 107.32 99.72 3h7t s GLY 28 Ca 0.61 -0.94 -0.04 0.00 0.00 0.00 0.00 44.72 44.35 3h7t s GLY 28 CO 0.41 -0.47 0.11 -0.45 0.00 0.00 0.00 173.10 172.69 3h7t s SER 29 N -3.11 -0.06 -0.25 1.64 0.15 -0.46 -1.67 113.70 109.93 3h7t s SER 29 Ca 0.19 0.09 -0.29 0.00 0.70 0.00 0.00 55.95 56.64 3h7t s SER 29 Cb -0.04 0.22 -0.01 0.00 -1.71 0.00 0.00 66.02 64.48 3h7t s SER 29 CO 0.14 -0.12 1.34 -0.63 1.20 0.00 0.00 173.24 175.17 3h7t s ILE 30 N -0.31 4.10 -0.20 6.45 -1.09 0.35 -1.41 121.20 129.09 3h7t s ILE 30 Ca -0.04 1.27 -0.16 0.00 -2.23 0.00 0.00 60.65 59.50 3h7t s ILE 30 Cb -0.03 -4.03 -0.20 0.00 -1.58 0.00 0.00 42.46 36.62 3h7t s ILE 30 CO 0.00 -0.35 0.13 0.18 -1.23 0.00 0.00 174.94 173.68 3h7t n LEU 31 N 7.46 2.12 -4.18 2.97 4.77 -0.47 -0.26 117.00 129.41 3h7t n LEU 31 Ca 0.15 0.33 -0.16 0.00 -0.03 0.00 0.00 56.01 56.30 3h7t n LEU 31 Cb 0.46 -0.98 -0.07 0.00 -2.33 0.00 0.00 43.42 40.51 3h7t n LEU 31 CO 0.61 0.50 -0.01 0.42 -1.33 0.00 0.00 177.39 177.58 3h7t s THR 32 N -2.44 0.00 0.24 -5.08 -4.23 -1.04 -4.53 115.64 98.57 3h7t s THR 32 Ca -0.29 -1.81 0.33 0.00 -1.18 0.00 0.00 61.69 58.74 3h7t s THR 32 Cb 0.08 -2.55 0.33 0.00 1.34 0.00 0.00 72.50 71.70 3h7t s THR 32 CO 0.62 0.00 2.02 0.00 -0.54 0.00 0.00 174.62 176.72 3h7t h ALA 33 N 2.19 1.00 0.00 3.99 0.00 -1.97 -2.63 119.26 121.85 3h7t h ALA 33 Ca -0.28 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.63 3h7t h ALA 33 Cb 1.24 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.03 3h7t h ALA 33 CO 0.39 -0.00 -0.53 0.09 0.00 0.00 0.00 179.25 179.20 3h7t n ASN 34 N -2.67 1.22 -4.10 0.00 3.02 -1.26 0.66 115.26 112.13 3h7t n ASN 34 Ca -0.02 -0.45 -0.25 0.00 -0.03 0.00 0.00 54.58 53.82 3h7t n ASN 34 Cb 0.05 1.07 -0.16 0.00 -0.61 0.00 0.00 39.78 40.13 3h7t n ASN 34 CO 0.00 0.00 0.00 -0.36 -2.62 0.00 0.00 177.26 174.28 3h7t s PHE 35 N -1.75 1.59 0.02 3.10 0.08 -0.99 -1.22 117.98 118.81 3h7t s PHE 35 Ca 0.01 -0.48 0.07 0.00 0.12 0.00 0.00 56.93 56.65 3h7t s PHE 35 Cb 0.04 -1.09 -0.02 0.00 -0.57 0.00 0.00 43.02 41.38 3h7t s PHE 35 CO 0.22 -0.18 -0.20 0.08 -0.10 0.00 0.00 175.22 175.04 3h7t s VAL 36 N 0.15 1.60 -0.10 -0.44 1.01 0.27 -1.36 120.40 121.52 3h7t s VAL 36 Ca -0.06 -1.03 0.00 0.00 0.00 0.00 0.00 61.98 60.90 3h7t s VAL 36 Cb -0.12 -1.36 -0.02 0.00 0.00 0.00 0.00 36.38 34.88 3h7t s VAL 36 CO 0.02 0.31 -0.10 -0.51 0.00 0.00 0.00 175.10 174.82 3h7t s ILE 37 N -0.65 3.40 0.09 2.22 2.07 -0.50 0.22 121.20 128.05 3h7t s ILE 37 Ca 0.07 -0.57 0.02 0.00 -1.41 0.00 0.00 60.65 58.77 3h7t s ILE 37 Cb -0.08 -2.41 -0.01 0.00 0.13 0.00 0.00 42.46 40.09 3h7t s ILE 37 CO 0.01 0.55 0.08 1.07 -1.91 0.00 0.00 174.94 174.74 3h7t n THR 38 N 2.90 0.00 -2.95 4.00 5.66 -0.17 -1.36 114.28 122.36 3h7t n THR 38 Ca -0.18 -0.65 -0.36 0.00 -3.05 0.00 0.00 64.05 59.82 3h7t n THR 38 Cb 0.53 0.33 -0.06 0.00 -1.55 0.00 0.00 70.33 69.57 3h7t n THR 38 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 3h7t s ALA 39 N -2.34 3.28 0.22 1.79 0.00 -1.26 -0.52 121.76 122.93 3h7t s ALA 39 Ca 0.11 0.31 -0.09 0.00 0.00 0.00 0.00 51.96 52.29 3h7t s ALA 39 Cb 0.00 -2.99 0.18 0.00 0.00 0.00 0.00 23.12 20.32 3h7t s ALA 39 CO 0.08 0.25 1.86 0.00 0.00 0.00 0.00 175.76 177.94 3h7t h ALA 40 N 3.02 1.05 0.00 0.00 0.00 -1.67 -2.68 119.26 118.98 3h7t h ALA 40 Ca -0.48 -0.10 0.00 0.00 0.00 0.00 0.00 54.91 54.33 3h7t h ALA 40 Cb 1.19 -0.33 0.00 0.00 0.00 0.00 0.00 17.79 18.65 3h7t h ALA 40 CO 0.65 0.52 0.36 -0.56 0.00 0.00 0.00 179.25 180.22 3h7t h GLN 41 N 1.13 0.00 0.13 0.00 3.07 -1.92 -0.74 115.11 116.78 3h7t h GLN 41 Ca 0.29 0.00 -0.28 0.00 0.09 0.00 0.00 58.65 58.75 3h7t h GLN 41 Cb -0.03 0.00 0.00 0.00 0.08 0.00 0.00 27.48 27.54 3h7t h GLN 41 CO -0.05 0.00 -1.30 0.00 0.09 0.00 0.00 178.83 177.56 3h7t n VAL 43 N -3.52 0.02 -1.66 0.00 0.24 -0.56 -4.92 118.33 107.93 3h7t n VAL 43 Ca -0.10 -0.15 -0.48 0.00 -2.04 0.00 0.00 64.34 61.57 3h7t n VAL 43 Cb 1.03 1.66 -0.05 0.00 -1.47 0.00 0.00 33.84 35.01 3h7t n VAL 43 CO 0.00 0.00 0.00 -0.67 -2.14 0.00 0.00 176.83 174.02 3h7t n ASP 44 N -0.01 3.37 -0.11 -1.34 2.03 -0.39 -1.44 116.55 118.65 3h7t n ASP 44 Ca 0.00 0.89 -0.01 0.00 0.52 0.00 0.00 54.79 56.18 3h7t n ASP 44 Cb 0.20 -1.38 -0.01 0.00 -0.72 0.00 0.00 41.12 39.22 3h7t n ASP 44 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 3h7t n GLY 45 N 4.65 0.52 3.56 0.27 0.00 -1.26 -5.03 105.19 107.90 3h7t n GLY 45 Ca 0.24 -0.57 -0.34 0.00 0.00 0.00 0.00 46.02 45.35 3h7t n GLY 45 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3h7t s THR 46 N -2.01 4.30 0.35 2.61 2.01 -0.52 -5.09 115.64 117.29 3h7t s THR 46 Ca 0.00 -0.21 -0.29 0.00 0.31 0.00 0.00 61.69 61.50 3h7t s THR 46 Cb 0.00 -2.91 -0.11 0.00 0.01 0.00 0.00 72.50 69.49 3h7t s THR 46 CO 0.00 0.48 1.46 -0.54 -0.69 0.00 0.00 174.62 175.33 3h7t s LYS 47 N 0.34 4.18 0.46 4.92 1.02 -1.26 -4.92 119.74 124.48 3h7t s LYS 47 Ca -0.01 2.47 0.14 0.00 0.02 0.00 0.00 55.97 58.60 3h7t s LYS 47 Cb -0.13 -3.01 1.10 0.00 -0.52 0.00 0.00 37.83 35.27 3h7t s LYS 47 CO 0.02 -0.46 2.05 -1.35 -0.92 0.00 0.00 175.35 174.68 3h7t h PRO 48 N 3.49 0.28 0.00 -1.68 0.11 -1.87 -1.52 132.00 130.80 3h7t h PRO 48 Ca -0.50 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 65.60 3h7t h PRO 48 Cb 1.23 -0.06 0.00 0.00 0.11 0.00 0.00 31.00 32.28 3h7t h PRO 48 CO 0.67 0.18 0.00 0.66 -0.21 0.00 0.00 178.00 179.31 3h7t h SER 49 N 0.28 0.00 -0.16 -2.05 4.64 -1.90 -1.48 113.55 112.89 3h7t h SER 49 Ca 0.17 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.49 3h7t h SER 49 Cb 0.32 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.41 3h7t h SER 49 CO -0.04 0.00 0.00 0.47 -0.87 0.00 0.00 176.83 176.39 3h7t n ASP 50 N -3.06 1.33 -4.23 4.97 8.00 -0.57 -4.86 116.55 118.13 3h7t n ASP 50 Ca -0.01 -1.71 -0.31 0.00 0.71 0.00 0.00 54.79 53.47 3h7t n ASP 50 Cb 0.21 -0.10 -0.17 0.00 -0.02 0.00 0.00 41.12 41.04 3h7t n ASP 50 CO 0.00 0.00 0.00 -0.63 -0.39 0.00 0.00 177.20 176.18 3h7t s ILE 51 N -1.80 2.00 0.04 0.53 1.01 -0.56 -0.19 121.20 122.23 3h7t s ILE 51 Ca 0.29 -1.01 0.08 0.00 0.00 0.00 0.00 60.65 60.02 3h7t s ILE 51 Cb 0.15 -1.71 -0.03 0.00 0.01 0.00 0.00 42.46 40.88 3h7t s ILE 51 CO 0.23 0.55 -0.24 -0.55 0.00 0.00 0.00 174.94 174.93 3h7t s SER 52 N 0.13 2.89 -0.23 3.58 0.15 0.85 -1.65 113.70 119.43 3h7t s SER 52 Ca -0.12 -0.55 -0.05 0.00 0.70 0.00 0.00 55.95 55.94 3h7t s SER 52 Cb -0.16 -0.26 -0.01 0.00 -1.71 0.00 0.00 66.02 63.87 3h7t s SER 52 CO 0.06 0.23 -0.01 -0.63 1.20 0.00 0.00 173.24 174.10 3h7t s ILE 53 N -0.77 3.64 -0.27 6.45 1.09 0.01 -0.56 121.20 130.79 3h7t s ILE 53 Ca 0.10 -0.41 -0.07 0.00 -1.10 0.00 0.00 60.65 59.17 3h7t s ILE 53 Cb -0.09 -2.67 -0.01 0.00 -1.06 0.00 0.00 42.46 38.62 3h7t s ILE 53 CO 0.02 0.39 0.07 -2.28 -0.10 0.00 0.00 174.94 173.04 3h7t s HIS 54 N 1.52 3.10 0.15 3.97 2.46 0.10 -1.70 115.29 124.89 3h7t s HIS 54 Ca 0.06 -0.72 0.05 0.00 0.47 0.00 0.00 55.06 54.92 3h7t s HIS 54 Cb -0.15 -2.24 -0.04 0.00 -0.13 0.00 0.00 32.58 30.02 3h7t s HIS 54 CO -0.01 -0.48 -0.10 1.52 -2.47 0.00 0.00 174.74 173.20 3h7t s TYR 55 N 1.55 1.30 -0.58 3.88 -0.85 -0.50 -0.41 117.35 121.74 3h7t s TYR 55 Ca 0.05 -0.76 0.00 0.00 -0.52 0.00 0.00 57.07 55.84 3h7t s TYR 55 Cb -0.16 -0.66 0.00 0.00 0.38 0.00 0.00 41.96 41.52 3h7t s TYR 55 CO 0.03 0.09 0.00 0.41 -1.52 0.00 0.00 175.55 174.55 3h7t n GLY 56 N -0.22 0.78 2.96 5.49 0.00 -1.26 -1.76 105.19 111.19 3h7t n GLY 56 Ca -0.10 -0.81 -0.13 0.00 0.00 0.00 0.00 46.02 44.98 3h7t n GLY 56 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 3h7t s SER 57 N -2.94 0.45 0.40 1.61 0.15 -1.26 -4.71 113.70 107.41 3h7t s SER 57 Ca 0.00 -0.23 0.28 0.00 0.70 0.00 0.00 55.95 56.70 3h7t s SER 57 Cb 0.00 -0.00 1.09 0.00 -1.71 0.00 0.00 66.02 65.40 3h7t s SER 57 CO 0.00 -0.07 1.83 0.28 1.20 0.00 0.00 173.24 176.49 3h7t h SER 58 N 5.51 0.00 -3.35 5.45 0.02 -1.89 -3.44 113.55 115.85 3h7t h SER 58 Ca -0.29 0.00 -0.55 0.00 -0.84 0.00 0.00 61.79 60.11 3h7t h SER 58 Cb 1.20 0.00 -0.03 0.00 0.14 0.00 0.00 62.40 63.71 3h7t h SER 58 CO 0.47 0.00 -0.14 -0.31 -1.14 0.00 0.00 176.83 175.71 3h7t s TYR 59 N -3.45 3.49 0.19 3.45 2.02 -1.26 -0.35 117.35 121.44 3h7t s TYR 59 Ca 0.04 0.88 -0.09 0.00 -0.37 0.00 0.00 57.07 57.53 3h7t s TYR 59 Cb 0.09 -2.25 0.09 0.00 -0.40 0.00 0.00 41.96 39.49 3h7t s TYR 59 CO 0.50 0.35 1.69 -0.09 -1.57 0.00 0.00 175.55 176.44 3h7t h ARG 60 N 2.97 1.09 0.00 -0.62 2.43 -1.55 -3.37 114.38 115.33 3h7t h ARG 60 Ca -0.47 -0.28 0.00 0.00 -0.81 0.00 0.00 59.98 58.42 3h7t h ARG 60 Cb 1.18 -0.13 0.00 0.00 -0.42 0.00 0.00 29.97 30.60 3h7t h ARG 60 CO 0.68 0.99 0.00 0.25 -1.51 0.00 0.00 179.97 180.38 3h7t n THR 61 N -4.25 0.00 -4.30 0.20 -2.24 -1.26 -4.82 114.28 97.61 3h7t n THR 61 Ca 0.04 -0.25 -0.16 0.00 -2.27 0.00 0.00 64.05 61.42 3h7t n THR 61 Cb 0.28 1.17 -0.10 0.00 -2.10 0.00 0.00 70.33 69.58 3h7t n THR 61 CO 0.00 0.00 0.00 0.42 -0.57 0.00 0.00 175.07 174.92 3h7t s THR 62 N -0.33 1.18 -1.14 4.28 -4.23 -1.26 -4.91 115.64 109.24 3h7t s THR 62 Ca 0.00 -2.07 0.00 0.00 -1.18 0.00 0.00 61.69 58.44 3h7t s THR 62 Cb 0.00 -2.09 0.00 0.00 1.34 0.00 0.00 72.50 71.75 3h7t s THR 62 CO 0.00 -0.54 0.00 0.29 -0.54 0.00 0.00 174.62 173.83 3h7t n LYS 63 N -0.32 -1.03 0.00 3.99 5.02 -1.26 -4.39 118.16 120.17 3h7t n LYS 63 Ca -0.08 0.66 0.00 0.00 -2.02 0.00 0.00 58.31 56.87 3h7t n LYS 63 Cb 0.62 -4.87 0.00 0.00 -0.02 0.00 0.00 35.03 30.76 3h7t n LYS 63 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 3h7t n GLY 64 N -1.05 4.69 3.08 0.72 0.00 -1.26 -4.55 105.19 106.82 3h7t n GLY 64 Ca -0.15 -0.73 -0.21 0.00 0.00 0.00 0.00 46.02 44.93 3h7t n GLY 64 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3h7t s THR 65 N 3.46 0.94 -0.03 2.61 2.01 -0.72 -4.99 115.64 118.92 3h7t s THR 65 Ca 0.00 -0.55 0.06 0.00 0.31 0.00 0.00 61.69 61.51 3h7t s THR 65 Cb 0.00 -0.80 -0.02 0.00 0.01 0.00 0.00 72.50 71.69 3h7t s THR 65 CO 0.00 0.23 -0.21 -0.44 -0.69 0.00 0.00 174.62 173.52 3h7t s SER 66 N -0.36 3.49 -0.01 3.53 0.01 -1.26 -1.42 113.70 117.68 3h7t s SER 66 Ca 0.04 -0.35 0.00 0.00 1.31 0.00 0.00 55.95 56.96 3h7t s SER 66 Cb -0.05 -0.57 0.01 0.00 0.21 0.00 0.00 66.02 65.62 3h7t s SER 66 CO -0.00 0.33 -0.00 0.54 0.41 0.00 0.00 173.24 174.52 3h7t s VAL 67 N -0.67 0.09 0.53 3.43 0.11 -0.69 -4.96 120.40 118.25 3h7t s VAL 67 Ca 0.11 0.02 -0.19 0.00 -2.93 0.00 0.00 61.98 58.99 3h7t s VAL 67 Cb -0.10 -0.13 -0.06 0.00 -1.53 0.00 0.00 36.38 34.55 3h7t s VAL 67 CO -0.00 0.07 1.07 -0.32 -3.33 0.00 0.00 175.10 172.58 3h7t s MET 68 N 0.38 3.52 0.39 1.54 1.75 -1.26 -0.81 119.30 124.81 3h7t s MET 68 Ca -0.03 1.39 -0.24 0.00 -1.25 0.00 0.00 55.69 55.55 3h7t s MET 68 Cb -0.05 -2.05 -0.10 0.00 2.84 0.00 0.00 34.83 35.47 3h7t s MET 68 CO -0.01 -0.67 0.99 0.00 -0.65 0.00 0.00 175.02 174.69 3h7t s ALA 69 N -2.06 3.10 -0.19 4.11 0.00 -0.66 -0.65 121.76 125.40 3h7t s ALA 69 Ca 0.68 0.57 -0.12 0.00 0.00 0.00 0.00 51.96 53.09 3h7t s ALA 69 Cb -0.18 -3.21 -0.08 0.00 0.00 0.00 0.00 23.12 19.64 3h7t s ALA 69 CO 0.27 -0.02 -0.28 1.17 0.00 0.00 0.00 175.76 176.90 3h7t n LYS 70 N -0.06 0.45 -4.14 0.00 4.81 0.12 -4.23 118.16 115.11 3h7t n LYS 70 Ca 0.05 0.19 -0.16 0.00 -0.87 0.00 0.00 58.31 57.52 3h7t n LYS 70 Cb 0.51 -1.26 -0.12 0.00 0.02 0.00 0.00 35.03 34.18 3h7t n LYS 70 CO 0.00 0.00 0.00 0.15 1.17 0.00 0.00 177.40 178.72 3h7t s LYS 71 N -2.49 0.65 -0.13 1.64 1.02 -1.13 -4.75 119.74 114.55 3h7t s LYS 71 Ca -0.28 -0.76 0.02 0.00 0.02 0.00 0.00 55.97 54.97 3h7t s LYS 71 Cb 0.09 -0.53 0.00 0.00 -0.52 0.00 0.00 37.83 36.87 3h7t s LYS 71 CO 0.37 0.12 -0.21 0.42 -0.92 0.00 0.00 175.35 175.13 3h7t s ILE 72 N -1.17 2.27 -0.24 2.17 -1.09 -1.26 -0.92 121.20 120.96 3h7t s ILE 72 Ca -0.05 -0.92 -0.04 0.00 -2.23 0.00 0.00 60.65 57.41 3h7t s ILE 72 Cb -0.09 -1.91 0.00 0.00 -1.58 0.00 0.00 42.46 38.89 3h7t s ILE 72 CO 0.01 0.54 -0.03 -0.31 -1.23 0.00 0.00 174.94 173.92 3h7t s TYR 73 N 0.62 3.01 -0.08 3.97 2.02 0.68 -0.27 117.35 127.29 3h7t s TYR 73 Ca -0.11 -1.11 0.04 0.00 -0.37 0.00 0.00 57.07 55.52 3h7t s TYR 73 Cb -0.16 -2.11 -0.01 0.00 -0.40 0.00 0.00 41.96 39.27 3h7t s TYR 73 CO 0.03 -0.60 -0.22 0.42 -1.57 0.00 0.00 175.55 173.61 3h7t s ILE 74 N 1.44 2.29 -0.63 2.71 -1.09 -1.26 -1.17 121.20 123.49 3h7t s ILE 74 Ca 0.04 -0.96 0.03 0.00 -2.23 0.00 0.00 60.65 57.53 3h7t s ILE 74 Cb -0.15 -1.87 0.16 0.00 -1.58 0.00 0.00 42.46 39.01 3h7t s ILE 74 CO -0.03 0.56 0.41 -0.69 -1.23 0.00 0.00 174.94 173.96 3h7t s VAL 75 N 0.03 2.96 -1.10 2.92 1.01 -1.26 -4.85 120.40 120.12 3h7t s VAL 75 Ca -0.09 -3.72 -0.07 0.00 0.00 0.00 0.00 61.98 58.11 3h7t s VAL 75 Cb -0.15 -2.97 0.01 0.00 0.00 0.00 0.00 36.38 33.26 3h7t s VAL 75 CO 0.05 -0.91 0.89 0.54 0.00 0.00 0.00 175.10 175.67 3h7t n ARG 76 N 2.62 -6.06 -1.70 2.72 5.12 -1.26 -4.91 116.66 113.20 3h7t n ARG 76 Ca 0.12 0.67 -0.43 0.00 -1.93 0.00 0.00 57.85 56.28 3h7t n ARG 76 Cb 0.34 -5.19 -0.03 0.00 -1.16 0.00 0.00 32.46 26.42 3h7t n ARG 76 CO 0.00 0.00 0.00 0.98 -1.93 0.00 0.00 177.63 176.68 3h7t n TYR 77 N -4.47 2.60 -3.78 -1.55 9.36 -1.26 -4.69 117.16 113.36 3h7t n TYR 77 Ca -0.00 0.05 -0.36 0.00 3.32 0.00 0.00 57.90 60.91 3h7t n TYR 77 Cb 0.55 -2.66 -0.12 0.00 -0.63 0.00 0.00 39.34 36.49 3h7t n TYR 77 CO 0.00 0.00 0.00 -1.01 0.22 0.00 0.00 176.86 176.07 3h7t s HIS 78 N 1.55 3.58 0.45 2.98 3.76 -0.67 -4.99 115.29 121.94 3h7t s HIS 78 Ca 0.78 -2.46 0.28 0.00 -0.15 0.00 0.00 55.06 53.51 3h7t s HIS 78 Cb -0.55 -3.21 1.54 0.00 1.11 0.00 0.00 32.58 31.47 3h7t s HIS 78 CO 0.35 -0.96 2.11 -1.00 -0.85 0.00 0.00 174.74 174.39 3h7t h PRO 79 N 7.95 0.00 -0.40 8.40 0.13 -1.93 0.75 132.00 146.91 3h7t h PRO 79 Ca -0.12 0.00 -0.06 0.00 -0.87 0.00 0.00 66.00 64.95 3h7t h PRO 79 Cb 1.04 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.15 3h7t h PRO 79 CO 0.69 0.09 0.03 -0.07 -0.23 0.00 0.00 178.00 178.51 3h7t h LEU 80 N 0.00 0.67 -0.17 1.56 3.38 -1.97 -3.14 115.31 115.64 3h7t h LEU 80 Ca -0.00 -0.29 0.00 0.00 0.09 0.00 0.00 57.88 57.68 3h7t h LEU 80 Cb 0.27 -0.18 0.00 0.00 0.09 0.00 0.00 40.66 40.84 3h7t h LEU 80 CO 0.01 0.79 -0.81 0.35 0.09 0.00 0.00 178.44 178.88 3h7t n THR 81 N -4.48 0.00 -2.05 0.22 -2.24 -1.07 -4.97 114.28 99.69 3h7t n THR 81 Ca -0.01 -0.10 -0.19 0.00 -2.27 0.00 0.00 64.05 61.49 3h7t n THR 81 Cb 0.27 1.04 -0.04 0.00 -2.10 0.00 0.00 70.33 69.50 3h7t n THR 81 CO 0.00 0.00 0.00 0.23 -0.57 0.00 0.00 175.07 174.73 3h7t n MET 82 N -1.20 -1.42 -2.09 -0.78 2.81 0.26 -4.38 117.12 110.31 3h7t n MET 82 Ca 0.04 1.00 -0.39 0.00 -1.81 0.00 0.00 57.70 56.54 3h7t n MET 82 Cb 0.32 -5.45 -0.01 0.00 -0.71 0.00 0.00 33.22 27.37 3h7t n MET 82 CO 0.00 0.00 0.00 -0.65 1.51 0.00 0.00 175.97 176.83 3h7t s GLN 83 N -4.43 3.98 -1.36 0.03 -0.21 -1.01 -3.36 119.66 113.30 3h7t s GLN 83 Ca 0.00 2.10 -0.07 0.00 0.02 0.00 0.00 55.36 57.41 3h7t s GLN 83 Cb 0.00 -2.74 0.02 0.00 1.00 0.00 0.00 33.01 31.29 3h7t s GLN 83 CO 0.00 -0.46 1.07 0.09 -2.12 0.00 0.00 175.29 173.87 3h7t n ASN 84 N 0.12 -4.79 -3.67 5.90 3.02 -1.26 -1.67 115.26 112.91 3h7t n ASN 84 Ca 0.04 -0.62 -0.42 0.00 -0.03 0.00 0.00 54.58 53.55 3h7t n ASN 84 Cb 0.44 -4.76 -0.00 0.00 -0.61 0.00 0.00 39.78 34.85 3h7t n ASN 84 CO 0.00 0.00 0.00 -3.20 -2.62 0.00 0.00 177.26 171.44 3h7t n ASN 85 N -3.01 4.79 -3.97 6.41 5.15 -1.21 -4.25 115.26 119.17 3h7t n ASN 85 Ca -0.07 -2.82 -0.09 0.00 -0.60 0.00 0.00 54.58 51.00 3h7t n ASN 85 Cb 0.59 -1.63 -0.10 0.00 -0.53 0.00 0.00 39.78 38.11 3h7t n ASN 85 CO 0.00 0.00 0.00 -0.72 1.40 0.00 0.00 177.26 177.94 3h7t s TYR 86 N 2.77 0.26 0.02 1.20 -0.85 -1.26 -3.44 117.35 116.05 3h7t s TYR 86 Ca 0.50 -0.57 0.00 0.00 -0.52 0.00 0.00 57.07 56.49 3h7t s TYR 86 Cb 0.14 -0.19 -0.02 0.00 0.38 0.00 0.00 41.96 42.28 3h7t s TYR 86 CO -0.08 -0.28 -0.03 0.00 -1.52 0.00 0.00 175.55 173.64 3h7t s ALA 87 N -2.20 0.14 -0.14 9.51 0.00 0.33 -3.89 121.76 125.51 3h7t s ALA 87 Ca -0.09 -0.46 -0.02 0.00 0.00 0.00 0.00 51.96 51.40 3h7t s ALA 87 Cb -0.04 0.10 -0.02 0.00 0.00 0.00 0.00 23.12 23.16 3h7t s ALA 87 CO -0.03 -0.10 -0.09 0.08 0.00 0.00 0.00 175.76 175.62 3h7t s VAL 88 N -1.07 3.42 -0.18 0.00 1.01 -0.31 -1.00 120.40 122.26 3h7t s VAL 88 Ca -0.11 -0.53 -0.04 0.00 0.00 0.00 0.00 61.98 61.30 3h7t s VAL 88 Cb -0.07 -2.47 -0.02 0.00 0.00 0.00 0.00 36.38 33.81 3h7t s VAL 88 CO -0.01 0.51 -0.02 -0.63 0.00 0.00 0.00 175.10 174.95 3h7t s ILE 89 N 0.40 3.86 -0.13 2.22 1.01 0.13 -0.23 121.20 128.46 3h7t s ILE 89 Ca -0.07 -0.35 -0.14 0.00 0.00 0.00 0.00 60.65 60.08 3h7t s ILE 89 Cb -0.15 -2.72 -0.05 0.00 0.01 0.00 0.00 42.46 39.55 3h7t s ILE 89 CO 0.04 0.46 0.31 -0.70 0.00 0.00 0.00 174.94 175.05 3h7t s GLU 90 N 0.74 4.15 0.47 2.79 2.12 -0.09 -0.56 118.70 128.30 3h7t s GLU 90 Ca -0.01 0.14 -0.14 0.00 0.36 0.00 0.00 54.97 55.32 3h7t s GLU 90 Cb -0.14 -3.38 -0.07 0.00 0.26 0.00 0.00 34.13 30.79 3h7t s GLU 90 CO 0.02 0.34 0.89 0.95 -0.54 0.00 0.00 175.26 176.92 3h7t s THR 91 N 0.14 4.63 0.12 -1.70 -4.23 -0.36 0.12 115.64 114.36 3h7t s THR 91 Ca 0.18 0.98 -0.16 0.00 -1.18 0.00 0.00 61.69 61.51 3h7t s THR 91 Cb -0.14 -3.72 -0.03 0.00 1.34 0.00 0.00 72.50 69.95 3h7t s THR 91 CO 0.06 -0.61 1.56 -0.33 -0.54 0.00 0.00 174.62 174.76 3h7t h GLU 92 N 1.10 0.64 -6.19 3.99 4.39 -1.14 -3.40 114.58 113.97 3h7t h GLU 92 Ca -0.47 -0.20 -0.58 0.00 0.34 0.00 0.00 59.36 58.45 3h7t h GLU 92 Cb 1.19 -0.06 -0.17 0.00 -0.10 0.00 0.00 28.75 29.60 3h7t h GLU 92 CO 0.62 0.74 -0.79 -1.64 -1.16 0.00 0.00 179.01 176.79 3h7t s MET 93 N -5.02 1.42 0.45 2.33 -1.94 -1.26 -5.01 119.30 110.27 3h7t s MET 93 Ca -0.13 -1.51 -0.25 0.00 -1.71 0.00 0.00 55.69 52.09 3h7t s MET 93 Cb 0.09 -1.56 -0.08 0.00 2.01 0.00 0.00 34.83 35.30 3h7t s MET 93 CO 0.78 0.32 1.29 -2.14 -0.01 0.00 0.00 175.02 175.26 3h7t s PRO 94 N -2.91 3.76 0.04 2.03 0.02 -1.26 -4.91 135.00 131.76 3h7t s PRO 94 Ca 0.20 2.11 -0.30 0.00 0.02 0.00 0.00 61.00 63.02 3h7t s PRO 94 Cb -0.06 -2.59 -0.05 0.00 0.02 0.00 0.00 34.50 31.83 3h7t s PRO 94 CO 0.09 -0.65 1.12 0.42 -0.33 0.00 0.00 177.00 177.65 3h7t s ILE 95 N -1.32 4.33 -1.04 2.83 1.01 0.21 -4.96 121.20 122.25 3h7t s ILE 95 Ca 0.61 1.68 -0.23 0.00 0.00 0.00 0.00 60.65 62.72 3h7t s ILE 95 Cb -0.37 -4.08 0.05 0.00 0.01 0.00 0.00 42.46 38.08 3h7t s ILE 95 CO 0.46 0.13 1.47 -0.54 0.00 0.00 0.00 174.94 176.46 3h7t s LYS 96 N 1.02 3.62 0.46 2.79 1.02 -1.26 -4.77 119.74 122.62 3h7t s LYS 96 Ca 0.56 -1.20 -0.24 0.00 0.02 0.00 0.00 55.97 55.11 3h7t s LYS 96 Cb -0.26 -5.37 -0.07 0.00 -0.52 0.00 0.00 37.83 31.61 3h7t s LYS 96 CO 0.29 -2.21 1.26 -0.51 -0.92 0.00 0.00 175.35 173.26 3h7t s LEU 97 N 4.89 4.05 0.00 3.17 1.43 -1.26 -4.82 118.68 126.13 3h7t s LEU 97 Ca 0.46 2.53 0.00 0.00 -1.03 0.00 0.00 54.13 56.10 3h7t s LEU 97 Cb 0.00 -4.12 0.00 0.00 0.03 0.00 0.00 46.19 42.10 3h7t s LEU 97 CO -0.09 -1.04 0.30 -0.90 0.23 0.00 0.00 176.35 174.86 3h7t n ASP 98 N -0.38 0.00 -3.73 2.29 5.75 -0.25 -5.02 116.55 115.21 3h7t n ASP 98 Ca 0.07 -1.00 -0.28 0.00 -0.01 0.00 0.00 54.79 53.56 3h7t n ASP 98 Cb 0.46 0.00 -0.02 0.00 -1.03 0.00 0.00 41.12 40.52 3h7t n ASP 98 CO 0.00 0.00 0.00 -0.90 -0.11 0.00 0.00 177.20 176.19 3h7t n ASP 99 N 0.00 -3.05 0.07 -1.12 5.68 -1.17 -4.67 116.55 112.29 3h7t n ASP 99 Ca 0.00 -0.63 0.00 0.00 -0.50 0.00 0.00 54.79 53.66 3h7t n ASP 99 Cb 0.47 -2.54 0.00 0.00 -1.14 0.00 0.00 41.12 37.90 3h7t n ASP 99 CO 0.00 0.00 0.00 1.17 -1.33 0.00 0.00 177.20 177.04 3h7t n LYS 100 N -3.86 0.00 -0.00 0.11 4.81 -1.26 -4.96 118.16 113.00 3h7t n LYS 100 Ca 0.04 0.00 0.05 0.00 -0.87 0.00 0.00 58.31 57.53 3h7t n LYS 100 Cb 0.51 0.00 -0.07 0.00 0.02 0.00 0.00 35.03 35.49 3h7t n LYS 100 CO 0.00 0.00 0.00 0.25 1.17 0.00 0.00 177.40 178.82 3h7t n THR 101 N -2.90 0.00 -3.61 3.15 -2.24 -1.26 -4.31 114.28 103.10 3h7t n THR 101 Ca 0.00 -0.25 -0.27 0.00 -2.27 0.00 0.00 64.05 61.26 3h7t n THR 101 Cb 0.00 0.70 -0.17 0.00 -2.10 0.00 0.00 70.33 68.77 3h7t n THR 101 CO 0.00 0.00 0.00 -0.89 -0.57 0.00 0.00 175.07 173.61 3h7t s THR 102 N -2.25 -0.02 0.02 4.28 2.01 -1.25 -4.03 115.64 114.40 3h7t s THR 102 Ca 0.01 -0.30 -0.03 0.00 0.31 0.00 0.00 61.69 61.68 3h7t s THR 102 Cb 0.07 -0.68 -0.01 0.00 0.01 0.00 0.00 72.50 71.88 3h7t s THR 102 CO 0.42 -0.34 0.03 -0.54 -0.69 0.00 0.00 174.62 173.49 3h7t s LYS 103 N 2.10 0.42 0.40 4.92 1.02 -0.34 -1.09 119.74 127.17 3h7t s LYS 103 Ca 0.03 -0.62 -0.22 0.00 0.02 0.00 0.00 55.97 55.18 3h7t s LYS 103 Cb -0.16 0.16 -0.11 0.00 -0.52 0.00 0.00 37.83 37.20 3h7t s LYS 103 CO -0.13 -0.08 0.95 -1.59 -0.92 0.00 0.00 175.35 173.58 3h7t s LYS 104 N -1.76 4.31 -0.14 1.68 -2.85 -1.26 -3.45 119.74 116.27 3h7t s LYS 104 Ca -0.13 1.20 -0.05 0.00 -1.00 0.00 0.00 55.97 56.00 3h7t s LYS 104 Cb -0.07 -2.36 -0.04 0.00 -2.06 0.00 0.00 37.83 33.30 3h7t s LYS 104 CO -0.01 0.04 0.03 -1.50 0.10 0.00 0.00 175.35 174.00 3h7t s ILE 105 N -2.00 4.53 0.47 3.79 1.10 0.64 -4.91 121.20 124.82 3h7t s ILE 105 Ca 0.59 -0.14 -0.21 0.00 -0.51 0.00 0.00 60.65 60.37 3h7t s ILE 105 Cb -0.12 -2.98 -0.08 0.00 0.15 0.00 0.00 42.46 39.43 3h7t s ILE 105 CO 0.17 0.53 1.07 -1.61 -2.11 0.00 0.00 174.94 172.99 3h7t s GLU 106 N -0.21 3.83 0.53 3.50 0.41 -1.26 -4.59 118.70 120.91 3h7t s GLU 106 Ca 0.06 1.48 -0.18 0.00 -0.41 0.00 0.00 54.97 55.92 3h7t s GLU 106 Cb -0.12 -2.23 -0.07 0.00 -1.78 0.00 0.00 34.13 29.93 3h7t s GLU 106 CO 0.02 -0.42 1.02 -0.51 -0.49 0.00 0.00 175.26 174.87 3h7t s LEU 107 N -3.26 3.67 0.82 1.80 1.43 -1.26 -0.60 118.68 121.28 3h7t s LEU 107 Ca 0.65 1.76 -0.12 0.00 -1.03 0.00 0.00 54.13 55.39 3h7t s LEU 107 Cb -0.20 -4.53 0.09 0.00 0.03 0.00 0.00 46.19 41.58 3h7t s LEU 107 CO 0.24 -0.81 1.19 -2.16 0.23 0.00 0.00 176.35 175.04 3h7t s PRO 108 N -3.76 1.84 0.79 1.29 0.04 -1.26 -4.77 135.00 129.17 3h7t s PRO 108 Ca 0.63 0.06 -0.11 0.00 0.04 0.00 0.00 61.00 61.62 3h7t s PRO 108 Cb -0.14 -1.94 0.07 0.00 0.04 0.00 0.00 34.50 32.53 3h7t s PRO 108 CO 0.28 -1.67 1.11 -1.54 0.04 0.00 0.00 177.00 175.22 3h7t s SER 109 N -4.61 4.20 0.21 6.66 1.04 -1.26 -4.87 113.70 115.08 3h7t s SER 109 Ca 0.63 1.93 -0.32 0.00 0.48 0.00 0.00 55.95 58.67 3h7t s SER 109 Cb -0.10 -2.53 -0.13 0.00 0.10 0.00 0.00 66.02 63.35 3h7t s SER 109 CO 0.49 -2.24 1.52 -0.11 0.98 0.00 0.00 173.24 173.88 3h7t n LEU 110 N -3.57 3.29 -1.79 2.42 7.94 -1.26 -1.85 117.00 122.17 3h7t n LEU 110 Ca 0.10 1.11 -0.20 0.00 -1.11 0.00 0.00 56.01 55.91 3h7t n LEU 110 Cb 0.53 -1.45 -0.07 0.00 0.53 0.00 0.00 43.42 42.95 3h7t n LEU 110 CO 0.52 -0.30 -0.21 0.18 -1.11 0.00 0.00 177.39 176.47 3h7t n LEU 111 N 2.77 -1.57 -4.61 -1.96 4.77 0.05 -4.94 117.00 111.51 3h7t n LEU 111 Ca 0.14 0.38 -0.47 0.00 -0.03 0.00 0.00 56.01 56.02 3h7t n LEU 111 Cb 0.31 -2.81 -0.03 0.00 -2.33 0.00 0.00 43.42 38.55 3h7t n LEU 111 CO 0.63 -0.85 0.80 0.00 -1.33 0.00 0.00 177.39 176.63 3h7t n TYR 112 N -2.74 1.57 -3.61 -1.77 9.36 -0.77 -4.77 117.16 114.42 3h7t n TYR 112 Ca -0.21 0.61 -0.27 0.00 3.32 0.00 0.00 57.90 61.35 3h7t n TYR 112 Cb 0.67 -2.33 -0.17 0.00 -0.63 0.00 0.00 39.34 36.88 3h7t n TYR 112 CO 0.00 0.00 0.00 0.34 0.22 0.00 0.00 176.86 177.42 3h7t s ASP 113 N 0.03 2.64 0.27 2.98 2.15 -1.26 -4.22 116.67 119.25 3h7t s ASP 113 Ca 0.70 -0.77 -0.31 0.00 0.43 0.00 0.00 52.55 52.60 3h7t s ASP 113 Cb -0.77 -0.31 -0.12 0.00 -0.30 0.00 0.00 42.92 41.42 3h7t s ASP 113 CO 0.52 -0.36 1.57 -2.65 -0.17 0.00 0.00 175.17 174.08 3h7t n PRO 114 N 5.24 2.55 -2.51 4.34 -0.02 -1.26 -4.93 135.00 138.41 3h7t n PRO 114 Ca -0.07 0.91 -0.40 0.00 -2.02 0.00 0.00 63.50 61.92 3h7t n PRO 114 Cb 0.47 -2.67 -0.05 0.00 -0.02 0.00 0.00 33.50 31.24 3h7t n PRO 114 CO 0.00 0.00 0.00 -1.21 1.98 0.00 0.00 175.50 176.27 3h7t s GLU 115 N -0.24 4.67 0.37 -0.52 2.02 -1.26 -4.98 118.70 118.75 3h7t s GLU 115 Ca 0.67 1.76 -0.26 0.00 0.02 0.00 0.00 54.97 57.16 3h7t s GLU 115 Cb -0.54 -3.20 -0.12 0.00 0.10 0.00 0.00 34.13 30.38 3h7t s GLU 115 CO 0.46 0.25 1.03 -2.30 0.02 0.00 0.00 175.26 174.73 3h7t n PRO 116 N 1.22 1.43 -0.25 0.39 -0.02 -1.26 -2.00 135.00 134.51 3h7t n PRO 116 Ca -0.01 0.51 0.00 0.00 -2.02 0.00 0.00 63.50 61.97 3h7t n PRO 116 Cb 0.45 -2.00 0.00 0.00 -0.02 0.00 0.00 33.50 31.94 3h7t n PRO 116 CO 0.00 0.00 0.00 -0.25 1.98 0.00 0.00 175.50 177.23 3h7t n ASP 117 N 0.81 0.00 -4.87 2.55 8.00 0.16 -4.96 116.55 118.25 3h7t n ASP 117 Ca 0.09 0.00 -0.27 0.00 0.71 0.00 0.00 54.79 55.32 3h7t n ASP 117 Cb 0.36 -0.11 0.08 0.00 -0.02 0.00 0.00 41.12 41.43 3h7t n ASP 117 CO 0.00 0.00 0.00 0.42 -0.39 0.00 0.00 177.20 177.23 3h7t s THR 118 N -3.11 2.19 0.03 -3.53 -4.23 -0.85 -4.79 115.64 101.35 3h7t s THR 118 Ca 0.00 -0.21 0.08 0.00 -1.18 0.00 0.00 61.69 60.39 3h7t s THR 118 Cb 0.00 -2.98 -0.03 0.00 1.34 0.00 0.00 72.50 70.83 3h7t s THR 118 CO 0.00 0.00 -0.25 -0.44 -0.54 0.00 0.00 174.62 173.39 3h7t s SER 119 N -4.56 3.27 -0.06 3.99 0.01 -1.26 -0.26 113.70 114.83 3h7t s SER 119 Ca 0.62 -0.52 0.04 0.00 1.31 0.00 0.00 55.95 57.39 3h7t s SER 119 Cb -0.10 -0.37 -0.02 0.00 0.21 0.00 0.00 66.02 65.73 3h7t s SER 119 CO 0.46 0.28 -0.16 0.68 0.41 0.00 0.00 173.24 174.91 3h7t s VAL 120 N -0.78 2.93 -0.25 3.43 -7.23 -0.44 -4.82 120.40 113.25 3h7t s VAL 120 Ca 0.12 -0.77 -0.23 0.00 -1.81 0.00 0.00 61.98 59.30 3h7t s VAL 120 Cb -0.10 -2.14 -0.01 0.00 0.56 0.00 0.00 36.38 34.68 3h7t s VAL 120 CO 0.02 0.58 0.73 -0.22 -0.31 0.00 0.00 175.10 175.90 3h7t s LEU 121 N -0.57 4.07 0.03 1.32 2.96 -0.12 -1.03 118.68 125.34 3h7t s LEU 121 Ca 0.08 0.88 0.09 0.00 -0.22 0.00 0.00 54.13 54.96 3h7t s LEU 121 Cb -0.11 -3.03 -0.03 0.00 0.50 0.00 0.00 46.19 43.52 3h7t s LEU 121 CO 0.01 -0.45 -0.26 -0.69 -1.32 0.00 0.00 176.35 173.65 3h7t s VAL 122 N 2.68 2.07 -0.14 1.68 1.01 -0.18 -0.23 120.40 127.28 3h7t s VAL 122 Ca 0.31 -1.29 -0.10 0.00 0.00 0.00 0.00 61.98 60.90 3h7t s VAL 122 Cb -0.15 -1.76 0.04 0.00 0.00 0.00 0.00 36.38 34.51 3h7t s VAL 122 CO 0.08 0.42 0.35 -0.94 0.00 0.00 0.00 175.10 175.01 3h7t s SER 123 N -1.04 -0.39 -0.01 3.32 1.04 -1.21 -1.23 113.70 114.18 3h7t s SER 123 Ca 0.11 0.72 -0.07 0.00 0.48 0.00 0.00 55.95 57.19 3h7t s SER 123 Cb -0.10 0.68 0.02 0.00 0.10 0.00 0.00 66.02 66.73 3h7t s SER 123 CO 0.01 -0.14 0.33 0.61 0.98 0.00 0.00 173.24 175.03 3h7t n GLY 124 N 3.40 0.53 0.34 7.32 0.00 -0.66 -4.06 105.19 112.06 3h7t n GLY 124 Ca -0.17 -0.89 0.08 0.00 0.00 0.00 0.00 46.02 45.04 3h7t n GLY 124 CO 0.00 0.00 0.00 0.79 0.00 0.00 0.00 173.32 174.11 3h7t n TRP 125 N -0.24 0.16 -1.41 1.61 8.01 -1.26 -1.03 117.44 123.28 3h7t n TRP 125 Ca 0.01 -1.14 -0.30 0.00 -1.31 0.00 0.00 57.50 54.77 3h7t n TRP 125 Cb 0.15 -0.21 0.21 0.00 -2.01 0.00 0.00 31.31 29.45 3h7t n TRP 125 CO 0.00 0.00 0.00 0.20 -1.01 0.00 0.00 177.69 176.88 3h7t s GLY 126 N -2.84 1.65 0.62 6.99 0.00 -1.26 -0.59 107.32 111.88 3h7t s GLY 126 Ca 0.35 -0.98 -0.19 0.00 0.00 0.00 0.00 44.72 43.90 3h7t s GLY 126 CO 0.01 -0.17 1.13 -1.14 0.00 0.00 0.00 173.10 172.92 3h7t n SER 127 N -4.32 1.44 -0.57 1.64 3.41 0.59 -2.42 113.62 113.38 3h7t n SER 127 Ca 0.13 0.83 0.05 0.00 -0.26 0.00 0.00 58.87 59.62 3h7t n SER 127 Cb 0.59 -1.47 0.14 0.00 -0.26 0.00 0.00 64.21 63.22 3h7t n SER 127 CO 0.00 0.00 0.00 0.35 -0.16 0.00 0.00 175.04 175.23 3h7t n THR 128 N -1.75 1.14 -3.62 6.66 -2.24 -1.26 -0.16 114.28 113.04 3h7t n THR 128 Ca 0.14 -1.10 -0.12 0.00 -2.27 0.00 0.00 64.05 60.70 3h7t n THR 128 Cb 0.47 0.42 -0.05 0.00 -2.10 0.00 0.00 70.33 69.07 3h7t n THR 128 CO 0.00 0.00 0.00 0.54 -0.57 0.00 0.00 175.07 175.04 3h7t s ASN 129 N -1.12 -0.31 0.00 3.42 2.20 -1.26 -4.51 114.94 113.37 3h7t s ASN 129 Ca 0.22 -0.08 0.27 0.00 -0.94 0.00 0.00 52.86 52.32 3h7t s ASN 129 Cb 0.13 0.46 1.19 0.00 -2.00 0.00 0.00 41.25 41.03 3h7t s ASN 129 CO 0.13 -0.76 1.87 0.33 -2.94 0.00 0.00 177.10 175.73 3h7t n PHE 130 N 0.18 0.00 0.03 1.54 -0.00 -1.26 -2.99 117.46 114.96 3h7t n PHE 130 Ca -0.17 0.00 -0.06 0.00 -0.00 0.00 0.00 57.45 57.21 3h7t n PHE 130 Cb 0.62 -0.45 -0.11 0.00 -0.00 0.00 0.00 39.48 39.54 3h7t n PHE 130 CO 0.00 0.00 0.00 0.87 -0.00 0.00 0.00 176.76 177.63 3h7t h LYS 131 N 0.00 0.00 -5.67 -4.13 1.57 -2.02 -3.46 116.57 102.86 3h7t h LYS 131 Ca 0.00 0.00 -0.65 0.00 -1.87 0.00 0.00 60.65 58.13 3h7t h LYS 131 Cb 0.41 0.00 -0.07 0.00 0.08 0.00 0.00 32.23 32.64 3h7t h LYS 131 CO 0.00 0.69 -0.43 0.45 -0.57 0.00 0.00 179.45 179.60 3h7t s SER 132 N -6.36 6.45 0.00 0.86 0.15 -1.16 -4.97 113.70 108.66 3h7t s SER 132 Ca -0.01 0.54 0.24 0.00 0.70 0.00 0.00 55.95 57.41 3h7t s SER 132 Cb 0.09 -2.11 0.40 0.00 -1.71 0.00 0.00 66.02 62.69 3h7t s SER 132 CO 0.82 0.37 1.38 0.18 1.20 0.00 0.00 173.24 177.18 3h7t n LEU 133 N 2.13 3.03 -4.77 3.45 4.77 -1.26 -4.71 117.00 119.63 3h7t n LEU 133 Ca -0.18 -1.18 -0.38 0.00 -0.03 0.00 0.00 56.01 54.24 3h7t n LEU 133 Cb 0.54 -0.13 -0.04 0.00 -2.33 0.00 0.00 43.42 41.47 3h7t n LEU 133 CO 0.33 0.59 0.76 -1.61 -1.33 0.00 0.00 177.39 176.13 3h7t s GLU 134 N -1.74 4.28 0.66 3.23 0.41 -1.26 -4.83 118.70 119.44 3h7t s GLU 134 Ca 0.34 1.62 -0.11 0.00 -0.41 0.00 0.00 54.97 56.41 3h7t s GLU 134 Cb 0.21 -2.72 -0.02 0.00 -1.78 0.00 0.00 34.13 29.82 3h7t s GLU 134 CO 0.31 -0.07 1.05 0.71 -0.49 0.00 0.00 175.26 176.77 3h7t s TYR 135 N -1.50 3.46 0.03 1.61 2.02 -1.26 -3.78 117.35 117.92 3h7t s TYR 135 Ca 0.54 1.26 -0.25 0.00 -0.37 0.00 0.00 57.07 58.25 3h7t s TYR 135 Cb -0.25 -2.83 -0.05 0.00 -0.40 0.00 0.00 41.96 38.42 3h7t s TYR 135 CO 0.32 -0.92 0.78 0.45 -1.57 0.00 0.00 175.55 174.62 3h7t s SER 136 N -4.14 7.21 0.37 2.29 0.15 0.24 -4.86 113.70 114.96 3h7t s SER 136 Ca 0.56 1.45 0.14 0.00 0.70 0.00 0.00 55.95 58.81 3h7t s SER 136 Cb -0.12 -2.48 0.74 0.00 -1.71 0.00 0.00 66.02 62.46 3h7t s SER 136 CO 0.54 -0.03 1.81 1.23 1.20 0.00 0.00 173.24 177.99 3h7t h GLY 137 N 5.89 0.00 -5.11 9.45 0.00 -1.94 -3.43 103.07 107.93 3h7t h GLY 137 Ca -0.43 0.00 -0.66 0.00 0.00 0.00 0.00 47.33 46.24 3h7t h GLY 137 CO 0.72 0.00 -0.58 0.99 0.00 0.00 0.00 176.54 177.67 3h7t s ASP 138 N -6.80 5.62 0.14 0.19 1.01 -1.26 -1.56 116.67 114.01 3h7t s ASP 138 Ca -0.02 0.16 -0.31 0.00 0.71 0.00 0.00 52.55 53.09 3h7t s ASP 138 Cb 0.14 -1.62 -0.10 0.00 1.01 0.00 0.00 42.92 42.35 3h7t s ASP 138 CO 0.71 0.30 1.59 -0.22 0.21 0.00 0.00 175.17 177.77 3h7t s LEU 139 N -1.51 4.37 0.20 1.23 2.96 0.52 -4.70 118.68 121.75 3h7t s LEU 139 Ca 0.20 2.59 0.08 0.00 -0.22 0.00 0.00 54.13 56.79 3h7t s LEU 139 Cb -0.12 -3.59 -0.04 0.00 0.50 0.00 0.00 46.19 42.94 3h7t s LEU 139 CO 0.11 -0.84 -0.02 -0.04 -1.32 0.00 0.00 176.35 174.24 3h7t s MET 140 N 1.52 2.32 0.06 1.98 -1.94 -0.20 -0.23 119.30 122.82 3h7t s MET 140 Ca 0.71 -1.21 0.02 0.00 -1.71 0.00 0.00 55.69 53.50 3h7t s MET 140 Cb -0.43 -2.28 -0.03 0.00 2.01 0.00 0.00 34.83 34.10 3h7t s MET 140 CO 0.32 0.43 -0.08 -1.83 -0.01 0.00 0.00 175.02 173.85 3h7t s GLU 141 N -3.11 0.65 0.02 2.03 -1.05 0.53 -1.66 118.70 116.11 3h7t s GLU 141 Ca 0.28 -0.97 -0.21 0.00 -0.15 0.00 0.00 54.97 53.93 3h7t s GLU 141 Cb -0.08 -0.29 0.04 0.00 -0.44 0.00 0.00 34.13 33.36 3h7t s GLU 141 CO 0.18 0.03 0.47 0.00 0.95 0.00 0.00 175.26 176.90 3h7t s ALA 142 N -2.14 -1.19 -0.27 -0.84 0.00 -0.37 -0.82 121.76 116.14 3h7t s ALA 142 Ca -0.02 0.55 -0.20 0.00 0.00 0.00 0.00 51.96 52.29 3h7t s ALA 142 Cb -0.05 0.27 -0.02 0.00 0.00 0.00 0.00 23.12 23.32 3h7t s ALA 142 CO -0.01 -0.43 0.61 -0.80 0.00 0.00 0.00 175.76 175.13 3h7t s ASN 143 N -1.77 6.53 -0.23 0.00 -0.87 -1.26 -1.01 114.94 116.32 3h7t s ASN 143 Ca -0.07 0.59 -0.12 0.00 -1.57 0.00 0.00 52.86 51.68 3h7t s ASN 143 Cb -0.01 -2.33 -0.05 0.00 -0.02 0.00 0.00 41.25 38.85 3h7t s ASN 143 CO 0.01 -0.39 0.24 -0.36 -2.57 0.00 0.00 177.10 174.03 3h7t s PHE 144 N 2.50 3.33 -0.07 2.20 2.99 -0.20 -4.91 117.98 123.82 3h7t s PHE 144 Ca 0.25 0.35 -0.30 0.00 0.00 0.00 0.00 56.93 57.23 3h7t s PHE 144 Cb -0.15 -2.36 -0.03 0.00 0.00 0.00 0.00 43.02 40.48 3h7t s PHE 144 CO 0.10 0.03 1.13 0.99 -0.00 0.00 0.00 175.22 177.46 3h7t s THR 145 N 1.19 4.45 0.10 0.64 2.01 -1.26 -1.32 115.64 121.44 3h7t s THR 145 Ca 0.11 1.75 -0.31 0.00 0.31 0.00 0.00 61.69 63.55 3h7t s THR 145 Cb -0.14 -4.12 -0.08 0.00 0.01 0.00 0.00 72.50 68.17 3h7t s THR 145 CO 0.06 0.01 1.40 -0.69 -0.69 0.00 0.00 174.62 174.71 3h7t s VAL 146 N 2.07 3.36 -0.15 3.82 1.01 0.64 -0.96 120.40 130.20 3h7t s VAL 146 Ca 0.53 0.94 -0.06 0.00 0.00 0.00 0.00 61.98 63.40 3h7t s VAL 146 Cb -0.22 -3.61 -0.04 0.00 0.00 0.00 0.00 36.38 32.51 3h7t s VAL 146 CO 0.21 0.06 0.06 -0.69 0.00 0.00 0.00 175.10 174.74 3h7t s VAL 147 N 1.33 4.82 -0.03 2.92 1.01 0.24 -0.66 120.40 130.04 3h7t s VAL 147 Ca 0.65 -0.04 -0.38 0.00 0.00 0.00 0.00 61.98 62.21 3h7t s VAL 147 Cb -0.36 -3.12 -0.17 0.00 0.00 0.00 0.00 36.38 32.73 3h7t s VAL 147 CO 0.30 0.53 1.42 -0.67 0.00 0.00 0.00 175.10 176.68 3h7t n ASP 148 N 2.88 1.66 -0.14 3.32 2.03 -1.26 -4.13 116.55 120.91 3h7t n ASP 148 Ca -0.18 1.11 -0.03 0.00 0.52 0.00 0.00 54.79 56.22 3h7t n ASP 148 Cb 0.53 -1.14 0.05 0.00 -0.72 0.00 0.00 41.12 39.84 3h7t n ASP 148 CO 0.00 0.00 0.00 -0.09 -1.92 0.00 0.00 177.20 175.19 3h7t h ARG 149 N 5.08 0.15 -0.37 -0.67 2.43 -1.96 0.51 114.38 119.55 3h7t h ARG 149 Ca -0.48 -0.01 0.04 0.00 -0.81 0.00 0.00 59.98 58.72 3h7t h ARG 149 Cb 1.34 -0.03 -0.04 0.00 -0.42 0.00 0.00 29.97 30.82 3h7t h ARG 149 CO 0.82 0.10 0.15 -0.22 -1.51 0.00 0.00 179.97 179.31 3h7t h LYS 150 N 0.16 0.32 -0.82 0.20 1.63 -1.99 0.76 116.57 116.83 3h7t h LYS 150 Ca 0.23 -0.02 -0.04 0.00 -0.85 0.00 0.00 60.65 59.98 3h7t h LYS 150 Cb 0.33 -0.07 -0.04 0.00 -0.60 0.00 0.00 32.23 31.85 3h7t h LYS 150 CO -0.35 0.21 0.38 1.03 -3.45 0.00 0.00 179.45 177.27 3h7t h SER 151 N 0.33 1.09 -0.33 4.20 0.87 -1.77 -0.78 113.55 117.16 3h7t h SER 151 Ca 0.16 -0.15 -0.03 0.00 -1.23 0.00 0.00 61.79 60.54 3h7t h SER 151 Cb 0.11 -0.28 -0.01 0.00 -0.44 0.00 0.00 62.40 61.78 3h7t h SER 151 CO -0.15 0.94 0.08 0.00 -0.53 0.00 0.00 176.83 177.17 3h7t h GLU 153 N 0.38 0.73 -0.56 0.00 4.81 -0.57 -0.97 114.58 118.41 3h7t h GLU 153 Ca 0.10 -0.04 0.03 0.00 -0.13 0.00 0.00 59.36 59.32 3h7t h GLU 153 Cb 0.30 -0.17 -0.04 0.00 0.63 0.00 0.00 28.75 29.48 3h7t h GLU 153 CO 0.00 0.48 0.34 0.93 -0.73 0.00 0.00 179.01 180.03 3h7t h GLU 154 N 0.75 0.65 -0.22 1.92 5.08 -1.00 0.16 114.58 121.93 3h7t h GLU 154 Ca 0.29 -0.04 0.01 0.00 -1.00 0.00 0.00 59.36 58.62 3h7t h GLU 154 Cb 0.12 -0.15 -0.01 0.00 0.50 0.00 0.00 28.75 29.21 3h7t h GLU 154 CO -0.15 0.43 0.12 1.96 -1.00 0.00 0.00 179.01 180.37 3h7t h GLN 155 N 0.67 0.25 -0.33 2.33 4.20 -0.99 -2.74 115.11 118.49 3h7t h GLN 155 Ca 0.23 -0.02 -0.05 0.00 0.06 0.00 0.00 58.65 58.87 3h7t h GLN 155 Cb 0.02 -0.06 -0.02 0.00 0.30 0.00 0.00 27.48 27.73 3h7t h GLN 155 CO -0.10 0.17 -0.01 1.88 -0.67 0.00 0.00 178.83 180.10 3h7t h TYR 156 N 0.26 0.54 0.00 2.96 -1.99 -0.93 -2.74 116.97 115.07 3h7t h TYR 156 Ca 0.08 -0.06 -0.00 0.00 2.00 0.00 0.00 58.73 60.76 3h7t h TYR 156 Cb -0.00 -0.16 -0.00 0.00 2.00 0.00 0.00 36.73 38.57 3h7t h TYR 156 CO -0.08 0.54 -0.01 -0.22 -0.00 0.00 0.00 178.16 178.39 3h7t h LYS 157 N 0.50 0.00 -0.67 4.88 3.64 -0.39 0.21 116.57 124.74 3h7t h LYS 157 Ca 0.11 0.00 0.13 0.00 -1.27 0.00 0.00 60.65 59.61 3h7t h LYS 157 Cb 0.34 0.00 -0.04 0.00 -0.41 0.00 0.00 32.23 32.12 3h7t h LYS 157 CO 0.01 0.01 0.45 1.96 -2.27 0.00 0.00 179.45 179.62 3h7t h GLN 158 N 0.00 0.38 -0.26 1.90 4.20 -1.31 -0.77 115.11 119.25 3h7t h GLN 158 Ca -0.00 -0.02 -0.11 0.00 0.06 0.00 0.00 58.65 58.58 3h7t h GLN 158 Cb 0.02 -0.08 -0.06 0.00 0.30 0.00 0.00 27.48 27.65 3h7t h GLN 158 CO 0.00 0.25 -0.12 0.44 -0.67 0.00 0.00 178.83 178.73 3h7t n ILE 159 N -4.47 2.40 -3.94 2.54 -5.35 -0.94 -4.96 119.36 104.64 3h7t n ILE 159 Ca 0.12 -2.63 -0.29 0.00 -0.27 0.00 0.00 62.75 59.68 3h7t n ILE 159 Cb 0.47 -0.29 0.01 0.00 -1.74 0.00 0.00 39.64 38.09 3h7t n ILE 159 CO 0.00 0.00 0.00 -0.62 -1.76 0.00 0.00 176.55 174.17 3h7t n GLU 160 N -1.05 -4.71 -0.13 6.28 -0.58 -0.30 -4.89 120.64 115.27 3h7t n GLU 160 Ca 0.28 0.54 0.04 0.00 -0.42 0.00 0.00 57.16 57.60 3h7t n GLU 160 Cb 0.93 -5.24 0.10 0.00 -0.57 0.00 0.00 31.44 26.66 3h7t n GLU 160 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 3h7t n ALA 161 N -4.52 2.21 0.20 0.62 0.00 0.70 -4.72 120.51 115.00 3h7t n ALA 161 Ca -0.06 -1.38 0.13 0.00 0.00 0.00 0.00 53.44 52.13 3h7t n ALA 161 Cb 0.57 -0.29 0.68 0.00 0.00 0.00 0.00 19.45 20.41 3h7t n ALA 161 CO 0.00 0.00 0.00 0.38 0.00 0.00 0.00 177.50 177.88 3h7t h ASP 162 N 1.00 0.00 0.16 0.00 3.04 -1.82 -2.30 116.42 116.50 3h7t h ASP 162 Ca 0.00 0.00 -0.01 0.00 -3.24 0.00 0.00 57.03 53.78 3h7t h ASP 162 Cb 0.75 0.00 -0.00 0.00 -1.04 0.00 0.00 39.33 39.04 3h7t h ASP 162 CO 0.03 0.00 -0.05 0.07 -2.04 0.00 0.00 179.24 177.25 3h7t h LYS 163 N 0.00 0.00 0.00 4.15 2.10 -1.93 -2.34 116.57 118.55 3h7t h LYS 163 Ca 0.00 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.65 3h7t h LYS 163 Cb 0.02 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 31.35 3h7t h LYS 163 CO 0.00 0.05 0.00 0.66 -2.00 0.00 0.00 179.45 178.16 3h7t n TYR 164 N -3.67 0.94 -3.71 0.07 4.01 -0.87 -4.76 117.16 109.17 3h7t n TYR 164 Ca -0.02 0.28 -0.37 0.00 -0.16 0.00 0.00 57.90 57.63 3h7t n TYR 164 Cb 0.15 -0.96 -0.12 0.00 -0.31 0.00 0.00 39.34 38.09 3h7t n TYR 164 CO 0.00 0.00 0.00 0.42 -0.46 0.00 0.00 176.86 176.82 3h7t s ILE 165 N -3.13 4.47 0.35 -0.72 -1.09 -0.88 -4.93 121.20 115.27 3h7t s ILE 165 Ca 0.10 -0.23 -0.09 0.00 -2.23 0.00 0.00 60.65 58.21 3h7t s ILE 165 Cb 0.12 -3.16 0.02 0.00 -1.58 0.00 0.00 42.46 37.87 3h7t s ILE 165 CO 0.57 0.25 0.61 -0.72 -1.23 0.00 0.00 174.94 174.42 3h7t s TYR 166 N 1.62 0.62 0.48 3.97 -0.85 -1.26 -5.01 117.35 116.93 3h7t s TYR 166 Ca 0.06 -1.04 0.35 0.00 -0.52 0.00 0.00 57.07 55.92 3h7t s TYR 166 Cb -0.16 0.31 1.86 0.00 0.38 0.00 0.00 41.96 44.36 3h7t s TYR 166 CO 0.05 -1.30 2.20 -0.44 -1.52 0.00 0.00 175.55 174.53 3h7t h ASP 167 N 2.07 0.00 -0.04 -0.18 3.32 -2.01 -2.13 116.42 117.45 3h7t h ASP 167 Ca -0.29 0.00 0.00 0.00 0.02 0.00 0.00 57.03 56.76 3h7t h ASP 167 Cb 1.24 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.79 3h7t h ASP 167 CO 0.39 0.04 0.00 0.61 -1.72 0.00 0.00 179.24 178.55 3h7t n GLY 168 N -0.79 -0.58 3.33 2.75 0.00 -1.26 -4.79 105.19 103.85 3h7t n GLY 168 Ca -0.02 -0.25 -0.18 0.00 0.00 0.00 0.00 46.02 45.57 3h7t n GLY 168 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 3h7t s VAL 169 N -1.95 1.68 0.24 1.61 -7.23 -0.80 -0.09 120.40 113.86 3h7t s VAL 169 Ca 0.35 -2.16 0.08 0.00 -1.81 0.00 0.00 61.98 58.44 3h7t s VAL 169 Cb 0.17 -2.00 -0.05 0.00 0.56 0.00 0.00 36.38 35.06 3h7t s VAL 169 CO 0.28 -0.58 -0.13 0.72 -0.31 0.00 0.00 175.10 175.07 3h7t s PHE 170 N -2.91 1.87 -0.01 2.82 -0.12 0.05 -4.70 117.98 114.99 3h7t s PHE 170 Ca 0.21 -0.56 0.03 0.00 -0.05 0.00 0.00 56.93 56.55 3h7t s PHE 170 Cb -0.01 -0.91 -0.03 0.00 -0.63 0.00 0.00 43.02 41.43 3h7t s PHE 170 CO 0.06 0.40 -0.06 0.00 -0.05 0.00 0.00 175.22 175.57 3h7t s ALA 172 N -0.98 -1.13 0.00 0.00 0.00 -0.70 -0.59 121.76 118.36 3h7t s ALA 172 Ca 0.17 0.48 0.00 0.00 0.00 0.00 0.00 51.96 52.61 3h7t s ALA 172 Cb -0.11 0.29 0.00 0.00 0.00 0.00 0.00 23.12 23.29 3h7t s ALA 172 CO 0.07 -0.43 0.00 0.41 0.00 0.00 0.00 175.76 175.81 3h7t n GLY 173 N 0.62 -0.43 0.00 0.00 0.00 -0.13 -0.50 105.19 104.75 3h7t n GLY 173 Ca -0.19 -1.11 0.00 0.00 0.00 0.00 0.00 46.02 44.72 3h7t n GLY 173 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3h7t n GLY 174 N 0.00 -1.52 0.35 -0.02 0.00 -0.45 -4.42 105.19 99.14 3h7t n GLY 174 Ca 0.00 -1.99 0.05 0.00 0.00 0.00 0.00 46.02 44.07 3h7t n GLY 174 CO 0.00 0.00 0.00 -2.09 0.00 0.00 0.00 173.32 171.23 3h7t h GLU 175 N 0.00 0.86 -0.26 1.61 4.81 -1.84 0.93 114.58 120.69 3h7t h GLU 175 Ca 0.00 -0.05 0.05 0.00 -0.13 0.00 0.00 59.36 59.22 3h7t h GLU 175 Cb 0.00 -0.19 -0.04 0.00 0.63 0.00 0.00 28.75 29.14 3h7t h GLU 175 CO 0.00 0.57 -0.02 -0.92 -0.73 0.00 0.00 179.01 177.91 3h7t h TYR 176 N 0.88 -0.04 0.00 0.92 3.20 -1.94 -2.97 116.97 117.03 3h7t h TYR 176 Ca 0.33 0.02 -0.09 0.00 3.14 0.00 0.00 58.73 62.13 3h7t h TYR 176 Cb 0.17 0.06 -0.02 0.00 1.54 0.00 0.00 36.73 38.48 3h7t h TYR 176 CO -0.00 -0.06 -1.05 -0.44 -1.64 0.00 0.00 178.16 174.97 3h7t h ASP 177 N 0.06 0.00 -6.08 -2.11 3.32 -1.79 -3.48 116.42 106.34 3h7t h ASP 177 Ca 0.12 0.00 -0.42 0.00 0.02 0.00 0.00 57.03 56.76 3h7t h ASP 177 Cb 0.17 0.00 0.05 0.00 0.22 0.00 0.00 39.33 39.77 3h7t h ASP 177 CO -0.22 0.33 -0.83 1.21 -1.72 0.00 0.00 179.24 178.01 3h7t n GLU 178 N -2.88 -4.99 -4.17 3.56 4.07 0.30 -5.00 120.64 111.53 3h7t n GLU 178 Ca -0.04 0.62 -0.20 0.00 -0.06 0.00 0.00 57.16 57.48 3h7t n GLU 178 Cb 0.71 -5.21 -0.16 0.00 -0.06 0.00 0.00 31.44 26.71 3h7t n GLU 178 CO 0.00 0.00 0.00 0.99 -0.06 0.00 0.00 177.13 178.06 3h7t s THR 179 N -3.65 0.57 0.01 6.31 2.01 -1.15 -4.31 115.64 115.43 3h7t s THR 179 Ca 0.03 -0.14 -0.08 0.00 0.31 0.00 0.00 61.69 61.82 3h7t s THR 179 Cb -0.01 -0.60 0.00 0.00 0.01 0.00 0.00 72.50 71.90 3h7t s THR 179 CO 0.81 0.24 0.15 -0.31 -0.69 0.00 0.00 174.62 174.81 3h7t s TYR 180 N 0.95 0.04 0.07 4.92 2.02 -0.36 -1.34 117.35 123.65 3h7t s TYR 180 Ca -0.11 -0.15 -0.31 0.00 -0.37 0.00 0.00 57.07 56.13 3h7t s TYR 180 Cb -0.14 -0.05 -0.07 0.00 -0.40 0.00 0.00 41.96 41.30 3h7t s TYR 180 CO 0.00 -0.31 1.39 0.42 -1.57 0.00 0.00 175.55 175.48 3h7t s ILE 181 N -1.57 3.46 0.50 2.71 -1.09 -1.26 -0.78 121.20 123.17 3h7t s ILE 181 Ca -0.13 1.00 0.06 0.00 -2.23 0.00 0.00 60.65 59.35 3h7t s ILE 181 Cb -0.07 -3.64 0.04 0.00 -1.58 0.00 0.00 42.46 37.22 3h7t s ILE 181 CO 0.01 0.05 0.69 -0.83 -1.23 0.00 0.00 174.94 173.63 3h7t s GLY 182 N 1.40 1.86 0.19 6.18 0.00 -1.26 -4.82 107.32 110.87 3h7t s GLY 182 Ca 0.64 -1.71 -0.31 0.00 0.00 0.00 0.00 44.72 43.34 3h7t s GLY 182 CO 0.29 -1.42 1.59 -0.47 0.00 0.00 0.00 173.10 173.09 3h7t s TYR 183 N -2.56 3.01 0.00 1.90 5.04 -1.26 -1.24 117.35 122.23 3h7t s TYR 183 Ca 0.58 0.61 0.00 0.00 -2.44 0.00 0.00 57.07 55.82 3h7t s TYR 183 Cb -0.09 -3.97 0.00 0.00 0.35 0.00 0.00 41.96 38.25 3h7t s TYR 183 CO 0.36 -3.56 0.00 0.41 -1.34 0.00 0.00 175.55 171.43 3h7t n GLY 184 N 3.58 0.73 0.69 8.97 0.00 -1.26 -0.30 105.19 117.61 3h7t n GLY 184 Ca 0.13 0.00 0.13 0.00 0.00 0.00 0.00 46.02 46.28 3h7t n GLY 184 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 3h7t n ASP 185 N 0.00 2.15 -4.72 1.61 8.00 -0.37 -3.78 116.55 119.43 3h7t n ASP 185 Ca 0.00 -1.72 -0.43 0.00 0.71 0.00 0.00 54.79 53.35 3h7t n ASP 185 Cb 0.00 -0.03 -0.02 0.00 -0.02 0.00 0.00 41.12 41.05 3h7t n ASP 185 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 3h7t n ALA 186 N 0.67 2.05 -0.00 2.24 0.00 -1.26 -1.96 120.51 122.25 3h7t n ALA 186 Ca 0.17 0.38 0.00 0.00 0.00 0.00 0.00 53.44 53.99 3h7t n ALA 186 Cb 0.45 -2.40 0.00 0.00 0.00 0.00 0.00 19.45 17.50 3h7t n ALA 186 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3h7t n GLY 187 N 2.04 1.10 3.70 0.00 0.00 0.13 -0.96 105.19 111.21 3h7t n GLY 187 Ca 0.09 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.68 3h7t n GLY 187 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 3h7t n ASP 188 N 0.00 2.93 -4.77 1.61 9.92 -0.83 -3.34 116.55 122.06 3h7t n ASP 188 Ca 0.00 1.19 -0.38 0.00 -0.53 0.00 0.00 54.79 55.07 3h7t n ASP 188 Cb 0.00 -1.49 -0.02 0.00 -0.64 0.00 0.00 41.12 38.97 3h7t n ASP 188 CO 0.00 0.00 0.00 -2.16 0.13 0.00 0.00 177.20 175.17 3h7t s PRO 189 N -1.52 4.06 -0.16 -0.24 0.04 -1.26 -0.60 135.00 135.32 3h7t s PRO 189 Ca 0.58 1.79 0.01 0.00 0.04 0.00 0.00 61.00 63.43 3h7t s PRO 189 Cb -0.57 -2.65 0.02 0.00 0.04 0.00 0.00 34.50 31.34 3h7t s PRO 189 CO 0.59 -0.30 -0.17 0.00 0.04 0.00 0.00 177.00 177.16 3h7t s ALA 190 N -1.45 2.05 -0.07 8.56 0.00 -0.22 -3.35 121.76 127.28 3h7t s ALA 190 Ca 0.57 -1.02 0.03 0.00 0.00 0.00 0.00 51.96 51.54 3h7t s ALA 190 Cb -0.29 -1.08 -0.02 0.00 0.00 0.00 0.00 23.12 21.73 3h7t s ALA 190 CO 0.37 -0.32 -0.17 0.08 0.00 0.00 0.00 175.76 175.72 3h7t s VAL 191 N 1.33 2.80 -0.08 0.00 1.01 0.67 -0.97 120.40 125.15 3h7t s VAL 191 Ca 0.03 -0.80 -0.04 0.00 0.00 0.00 0.00 61.98 61.18 3h7t s VAL 191 Cb -0.13 -2.10 0.04 0.00 0.00 0.00 0.00 36.38 34.19 3h7t s VAL 191 CO -0.10 0.57 0.18 -1.58 0.00 0.00 0.00 175.10 174.16 3h7t s GLN 192 N -0.29 0.10 -1.28 2.72 0.74 -0.75 -0.94 119.66 119.97 3h7t s GLN 192 Ca 0.02 0.48 -0.07 0.00 0.05 0.00 0.00 55.36 55.83 3h7t s GLN 192 Cb -0.13 -0.18 -0.01 0.00 1.10 0.00 0.00 33.01 33.80 3h7t s GLN 192 CO 0.03 -0.21 0.63 0.09 -0.55 0.00 0.00 175.29 175.28 3h7t n ASN 193 N 4.57 -2.37 -1.85 6.67 5.03 -1.26 -2.30 115.26 123.75 3h7t n ASN 193 Ca -0.20 -0.95 -0.18 0.00 0.87 0.00 0.00 54.58 54.12 3h7t n ASN 193 Cb 0.51 -3.51 -0.05 0.00 -1.02 0.00 0.00 39.78 35.71 3h7t n ASN 193 CO 0.00 0.00 0.00 0.61 -1.83 0.00 0.00 177.26 176.04 3h7t n GLY 194 N -1.75 0.94 3.19 7.41 0.00 -1.26 -4.97 105.19 108.75 3h7t n GLY 194 Ca -0.23 0.00 -0.14 0.00 0.00 0.00 0.00 46.02 45.65 3h7t n GLY 194 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 3h7t s THR 195 N -2.69 0.94 -0.78 2.61 -4.23 -0.97 -4.08 115.64 106.44 3h7t s THR 195 Ca 0.00 -1.76 -0.24 0.00 -1.18 0.00 0.00 61.69 58.50 3h7t s THR 195 Cb 0.00 -1.50 0.05 0.00 1.34 0.00 0.00 72.50 72.40 3h7t s THR 195 CO 0.00 -0.64 1.21 -0.22 -0.54 0.00 0.00 174.62 174.43 3h7t s LEU 196 N -2.67 3.71 0.17 4.79 2.96 0.23 -1.80 118.68 126.06 3h7t s LEU 196 Ca 0.08 -0.90 0.22 0.00 -0.22 0.00 0.00 54.13 53.31 3h7t s LEU 196 Cb -0.01 -2.51 -0.04 0.00 0.50 0.00 0.00 46.19 44.13 3h7t s LEU 196 CO -0.01 -1.61 0.97 1.33 -1.32 0.00 0.00 176.35 175.71 3h7t n VAL 197 N 6.27 0.56 -3.89 1.68 0.24 -0.15 -4.15 118.33 118.89 3h7t n VAL 197 Ca 0.08 -0.55 -0.09 0.00 -2.04 0.00 0.00 64.34 61.74 3h7t n VAL 197 Cb 0.48 -0.30 -0.08 0.00 -1.47 0.00 0.00 33.84 32.47 3h7t n VAL 197 CO 0.00 0.00 0.00 -0.83 -2.14 0.00 0.00 176.83 173.86 3h7t s GLY 198 N -4.39 0.13 -0.12 7.63 0.00 -0.85 -1.74 107.32 107.98 3h7t s GLY 198 Ca -0.01 -0.59 -0.00 0.00 0.00 0.00 0.00 44.72 44.11 3h7t s GLY 198 CO 0.81 -0.76 -0.07 0.14 0.00 0.00 0.00 173.10 173.22 3h7t s VAL 199 N -3.31 1.03 0.33 1.40 1.01 -0.82 -1.06 120.40 118.97 3h7t s VAL 199 Ca 0.01 -0.32 -0.29 0.00 0.00 0.00 0.00 61.98 61.37 3h7t s VAL 199 Cb 0.03 -1.07 -0.12 0.00 0.00 0.00 0.00 36.38 35.22 3h7t s VAL 199 CO -0.08 0.34 1.48 0.00 0.00 0.00 0.00 175.10 176.84 3h7t n ALA 200 N 4.94 2.12 -2.88 5.51 0.00 0.23 -0.31 120.51 130.12 3h7t n ALA 200 Ca -0.12 0.36 -0.24 0.00 0.00 0.00 0.00 53.44 53.44 3h7t n ALA 200 Cb 0.50 -2.39 -0.04 0.00 0.00 0.00 0.00 19.45 17.52 3h7t n ALA 200 CO 0.00 0.00 0.00 -1.12 0.00 0.00 0.00 177.50 176.38 3h7t s SER 201 N 0.10 5.92 -0.16 0.00 0.01 0.50 0.19 113.70 120.27 3h7t s SER 201 Ca 0.59 -0.04 -0.00 0.00 1.31 0.00 0.00 55.95 57.81 3h7t s SER 201 Cb -0.52 -1.65 0.04 0.00 0.21 0.00 0.00 66.02 64.10 3h7t s SER 201 CO 0.57 0.00 -0.08 -0.47 0.41 0.00 0.00 173.24 173.67 3h7t s TYR 202 N -1.90 1.85 -0.50 2.43 5.04 -1.26 -4.50 117.35 118.51 3h7t s TYR 202 Ca 0.33 -1.13 -0.14 0.00 -2.44 0.00 0.00 57.07 53.69 3h7t s TYR 202 Cb -0.09 -1.40 0.11 0.00 0.35 0.00 0.00 41.96 40.93 3h7t s TYR 202 CO 0.26 -0.63 0.42 0.42 -1.34 0.00 0.00 175.55 174.69 3h7t s ILE 203 N 1.59 4.95 0.52 3.14 1.01 -1.26 -4.95 121.20 126.20 3h7t s ILE 203 Ca 0.02 -1.42 0.22 0.00 0.00 0.00 0.00 60.65 59.47 3h7t s ILE 203 Cb -0.15 -4.12 0.36 0.00 0.01 0.00 0.00 42.46 38.57 3h7t s ILE 203 CO -0.08 -0.74 2.04 0.77 0.00 0.00 0.00 174.94 176.93 3h7t h SER 204 N 8.73 0.02 1.08 3.58 4.64 -2.03 -0.61 113.55 128.96 3h7t h SER 204 Ca -0.27 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.05 3h7t h SER 204 Cb 1.10 -0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.18 3h7t h SER 204 CO 0.94 0.01 0.00 -1.54 -0.87 0.00 0.00 176.83 175.37 3h7t n SER 205 N -4.43 0.34 -4.71 4.97 3.41 -1.26 -4.83 113.62 107.11 3h7t n SER 205 Ca 0.06 0.54 -0.40 0.00 -0.26 0.00 0.00 58.87 58.81 3h7t n SER 205 Cb 0.44 -0.63 -0.04 0.00 -0.26 0.00 0.00 64.21 63.72 3h7t n SER 205 CO 0.00 0.00 0.00 -0.04 -0.16 0.00 0.00 175.04 174.84 3h7t s MET 206 N -3.06 4.43 0.88 4.33 1.00 -0.24 -5.07 119.30 121.57 3h7t s MET 206 Ca 0.11 0.96 -0.13 0.00 0.00 0.00 0.00 55.69 56.63 3h7t s MET 206 Cb 0.15 -3.47 0.14 0.00 0.00 0.00 0.00 34.83 31.65 3h7t s MET 206 CO 0.51 -0.01 1.24 -1.25 0.00 0.00 0.00 175.02 175.51 3h7t s PRO 207 N 1.04 1.29 1.20 2.03 0.04 -1.26 -4.98 135.00 134.36 3h7t s PRO 207 Ca 0.39 -0.21 -0.20 0.00 0.04 0.00 0.00 61.00 61.03 3h7t s PRO 207 Cb -0.18 -1.92 0.29 0.00 0.04 0.00 0.00 34.50 32.73 3h7t s PRO 207 CO 0.18 -1.99 1.12 -1.54 0.04 0.00 0.00 177.00 174.82 3h7t s SER 208 N -4.74 0.92 0.00 6.66 1.04 -1.26 -4.18 113.70 112.14 3h7t s SER 208 Ca 0.68 0.57 0.00 0.00 0.48 0.00 0.00 55.95 57.68 3h7t s SER 208 Cb -0.07 -0.76 0.00 0.00 0.10 0.00 0.00 66.02 65.29 3h7t s SER 208 CO 0.51 -4.11 0.00 -0.62 0.98 0.00 0.00 173.24 169.99 3h7t n GLU 209 N -4.74 0.00 -4.03 4.02 -0.58 -1.26 -5.03 120.64 109.01 3h7t n GLU 209 Ca 0.14 0.00 -0.32 0.00 -0.42 0.00 0.00 57.16 56.56 3h7t n GLU 209 Cb 0.60 -1.23 -0.06 0.00 -0.57 0.00 0.00 31.44 30.18 3h7t n GLU 209 CO 0.00 0.00 0.00 -0.06 -0.48 0.00 0.00 177.13 176.59 3h7t s PHE 210 N -2.83 3.32 0.64 -0.32 0.08 -1.26 -4.05 117.98 113.55 3h7t s PHE 210 Ca 0.00 0.18 -0.18 0.00 0.12 0.00 0.00 56.93 57.05 3h7t s PHE 210 Cb 0.00 -1.71 -0.01 0.00 -0.57 0.00 0.00 43.02 40.73 3h7t s PHE 210 CO 0.00 0.56 1.28 -2.14 -0.10 0.00 0.00 175.22 174.82 3h7t s PRO 211 N -2.15 2.61 0.67 0.24 0.02 -1.26 -4.28 135.00 130.85 3h7t s PRO 211 Ca 0.28 2.03 -0.11 0.00 0.02 0.00 0.00 61.00 63.22 3h7t s PRO 211 Cb -0.12 -1.86 -0.01 0.00 0.02 0.00 0.00 34.50 32.53 3h7t s PRO 211 CO 0.20 -1.54 1.05 -1.12 -0.33 0.00 0.00 177.00 175.26 3h7t s SER 212 N -1.42 5.69 -0.09 2.53 0.01 0.35 -4.81 113.70 115.95 3h7t s SER 212 Ca 0.82 1.49 0.02 0.00 1.31 0.00 0.00 55.95 59.59 3h7t s SER 212 Cb -0.37 -2.43 -0.02 0.00 0.21 0.00 0.00 66.02 63.41 3h7t s SER 212 CO 0.39 -1.23 -0.13 -0.69 0.41 0.00 0.00 173.24 171.98 3h7t s VAL 213 N -3.12 3.09 -0.05 3.43 1.01 -1.26 -1.72 120.40 121.77 3h7t s VAL 213 Ca 0.57 -0.68 0.02 0.00 0.00 0.00 0.00 61.98 61.89 3h7t s VAL 213 Cb -0.13 -2.26 0.02 0.00 0.00 0.00 0.00 36.38 34.01 3h7t s VAL 213 CO 0.54 0.56 -0.09 -0.36 0.00 0.00 0.00 175.10 175.75 3h7t s PHE 214 N -0.21 1.15 0.18 5.22 0.08 -0.48 -0.37 117.98 123.54 3h7t s PHE 214 Ca 0.01 -0.39 -0.33 0.00 0.12 0.00 0.00 56.93 56.34 3h7t s PHE 214 Cb -0.13 -0.89 -0.13 0.00 -0.57 0.00 0.00 43.02 41.30 3h7t s PHE 214 CO 0.03 -0.23 1.62 -0.11 -0.10 0.00 0.00 175.22 176.43 3h7t n LEU 215 N 3.87 3.39 -4.54 -0.37 7.94 0.58 -0.77 117.00 127.11 3h7t n LEU 215 Ca -0.24 1.08 -0.42 0.00 -1.11 0.00 0.00 56.01 55.32 3h7t n LEU 215 Cb 0.51 -1.48 -0.03 0.00 0.53 0.00 0.00 43.42 42.96 3h7t n LEU 215 CO 0.25 -0.14 1.03 -0.60 -1.11 0.00 0.00 177.39 176.82 3h7t s ARG 216 N 0.95 3.27 0.22 1.96 3.52 0.88 -1.95 118.95 127.80 3h7t s ARG 216 Ca 0.77 -0.24 -0.08 0.00 -0.13 0.00 0.00 55.73 56.05 3h7t s ARG 216 Cb -0.62 -4.14 0.23 0.00 -1.56 0.00 0.00 34.95 28.87 3h7t s ARG 216 CO 0.36 -1.91 1.87 0.28 -0.81 0.00 0.00 175.30 175.09 3h7t h VAL 217 N 6.05 1.12 -1.00 7.11 2.07 -1.62 -2.16 116.25 127.83 3h7t h VAL 217 Ca -0.27 -0.34 0.31 0.00 0.82 0.00 0.00 66.70 67.22 3h7t h VAL 217 Cb 1.06 0.05 -0.14 0.00 -1.52 0.00 0.00 31.29 30.73 3h7t h VAL 217 CO 1.22 0.18 0.56 1.23 0.02 0.00 0.00 177.57 180.78 3h7t h GLY 218 N 0.98 2.01 2.00 2.17 0.00 -1.76 0.12 103.07 108.59 3h7t h GLY 218 Ca 0.32 -0.24 -0.02 0.00 0.00 0.00 0.00 47.33 47.38 3h7t h GLY 218 CO -0.11 -0.45 -0.10 -1.82 0.00 0.00 0.00 176.54 174.06 3h7t h TYR 219 N 0.36 0.00 0.00 5.60 3.20 -1.61 0.20 116.97 124.73 3h7t h TYR 219 Ca 0.71 0.00 0.00 0.00 3.14 0.00 0.00 58.73 62.58 3h7t h TYR 219 Cb 1.57 0.00 0.00 0.00 1.54 0.00 0.00 36.73 39.84 3h7t h TYR 219 CO -0.02 0.10 -0.00 0.66 -1.64 0.00 0.00 178.16 177.26 3h7t n TYR 220 N -3.50 0.00 -0.16 -3.82 4.01 0.36 -4.78 117.16 109.27 3h7t n TYR 220 Ca -0.01 -0.61 0.03 0.00 -0.16 0.00 0.00 57.90 57.15 3h7t n TYR 220 Cb 0.24 -0.07 0.32 0.00 -0.31 0.00 0.00 39.34 39.52 3h7t n TYR 220 CO 0.00 0.00 0.00 0.28 -0.46 0.00 0.00 176.86 176.68 3h7t h VAL 221 N 0.10 1.11 -0.56 -0.72 2.07 -1.33 0.06 116.25 116.98 3h7t h VAL 221 Ca 0.00 -0.28 -0.04 0.00 0.82 0.00 0.00 66.70 67.20 3h7t h VAL 221 Cb 0.63 0.22 -0.02 0.00 -1.52 0.00 0.00 31.29 30.60 3h7t h VAL 221 CO 0.00 0.15 0.19 -0.07 0.02 0.00 0.00 177.57 177.86 3h7t h LEU 222 N 0.82 0.79 -0.37 2.57 3.38 -1.86 -0.86 115.31 119.78 3h7t h LEU 222 Ca 0.26 -0.19 -0.03 0.00 0.09 0.00 0.00 57.88 58.01 3h7t h LEU 222 Cb 0.03 -0.21 -0.02 0.00 0.09 0.00 0.00 40.66 40.56 3h7t h LEU 222 CO -0.07 0.77 0.11 0.44 0.09 0.00 0.00 178.44 179.78 3h7t h ASP 223 N 0.77 0.55 -0.65 -0.43 3.32 -1.60 -0.17 116.42 118.21 3h7t h ASP 223 Ca 0.18 -0.22 -0.00 0.00 0.02 0.00 0.00 57.03 57.02 3h7t h ASP 223 Cb 0.25 -0.14 -0.03 0.00 0.22 0.00 0.00 39.33 39.62 3h7t h ASP 223 CO -0.01 0.62 0.40 0.40 -1.72 0.00 0.00 179.24 178.93 3h7t h ILE 224 N 0.45 1.18 -0.03 0.35 1.08 -0.89 -1.05 117.51 118.61 3h7t h ILE 224 Ca 0.12 -0.39 -0.12 0.00 -0.39 0.00 0.00 64.86 64.07 3h7t h ILE 224 Cb 0.27 0.27 -0.02 0.00 -3.07 0.00 0.00 36.82 34.28 3h7t h ILE 224 CO -0.00 0.19 -0.56 0.11 -0.69 0.00 0.00 178.15 177.20 3h7t h LYS 225 N 0.88 0.08 -0.48 2.37 1.57 -1.08 -2.04 116.57 117.88 3h7t h LYS 225 Ca 0.23 -0.05 -0.05 0.00 -1.87 0.00 0.00 60.65 58.92 3h7t h LYS 225 Cb -0.04 0.01 -0.02 0.00 0.08 0.00 0.00 32.23 32.25 3h7t h LYS 225 CO -0.05 0.61 0.11 -0.44 -0.57 0.00 0.00 179.45 179.12 3h7t h ASP 226 N 0.06 0.74 -0.07 0.86 3.32 -0.61 -1.43 116.42 119.28 3h7t h ASP 226 Ca -0.00 -0.24 -0.00 0.00 0.02 0.00 0.00 57.03 56.81 3h7t h ASP 226 Cb 1.00 -0.19 -0.00 0.00 0.22 0.00 0.00 39.33 40.36 3h7t h ASP 226 CO 0.08 0.78 0.04 0.40 -1.72 0.00 0.00 179.24 178.82 3h7t h ILE 227 N 0.65 1.04 0.00 0.35 2.04 -1.01 0.08 117.51 120.67 3h7t h ILE 227 Ca 0.15 -0.10 -0.06 0.00 1.00 0.00 0.00 64.86 65.85 3h7t h ILE 227 Cb 0.34 0.99 -0.01 0.00 -0.74 0.00 0.00 36.82 37.40 3h7t h ILE 227 CO 0.00 0.04 -0.28 0.40 0.00 0.00 0.00 178.15 178.31 3h7t h ILE 228 N 0.07 1.08 -0.00 -0.67 2.04 -1.33 -1.73 117.51 116.96 3h7t h ILE 228 Ca 0.02 -1.01 0.00 0.00 1.00 0.00 0.00 64.86 64.87 3h7t h ILE 228 Cb 0.02 1.56 0.00 0.00 -0.74 0.00 0.00 36.82 37.67 3h7t h ILE 228 CO -0.00 0.28 -0.03 -1.20 0.00 0.00 0.00 178.15 177.20 3h7t n SER 229 N -4.03 0.21 0.00 1.72 7.64 -0.55 -4.91 113.62 113.71 3h7t n SER 229 Ca -0.02 -0.64 0.00 0.00 1.01 0.00 0.00 58.87 59.22 3h7t n SER 229 Cb 0.35 -0.11 0.00 0.00 -1.01 0.00 0.00 64.21 63.43 3h7t n SER 229 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 3h7t n GLY 230 N 1.17 0.39 1.11 0.23 0.00 -0.65 -4.95 105.19 102.49 3h7t n GLY 230 Ca 0.18 -1.04 0.10 0.00 0.00 0.00 0.00 46.02 45.26 3h7t n GLY 230 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 3h7t n LYS 231 N -2.56 2.40 -4.30 1.61 5.02 -0.01 -4.86 118.16 115.46 3h7t n LYS 231 Ca 0.00 -2.16 -0.24 0.00 -2.02 0.00 0.00 58.31 53.89 3h7t n LYS 231 Cb 0.11 -1.48 -0.17 0.00 -0.02 0.00 0.00 35.03 33.47 3h7t n LYS 231 CO 0.00 0.00 0.00 0.08 -0.52 0.00 0.00 177.40 176.96 3h7t s VAL 232 N -1.26 0.90 0.35 -0.18 1.01 -1.25 -4.91 120.40 115.07 3h7t s VAL 232 Ca 0.40 -0.31 -0.28 0.00 0.00 0.00 0.00 61.98 61.79 3h7t s VAL 232 Cb 0.21 -0.87 -0.11 0.00 0.00 0.00 0.00 36.38 35.61 3h7t s VAL 232 CO 0.29 0.31 1.42 -1.59 0.00 0.00 0.00 175.10 175.53 3h7t s LYS 233 N 0.99 4.21 0.83 2.72 0.00 -1.26 -4.94 119.74 122.29 3h7t s LYS 233 Ca -0.09 2.42 -0.12 0.00 0.00 0.00 0.00 55.97 58.18 3h7t s LYS 233 Cb -0.15 -3.02 0.09 0.00 0.00 0.00 0.00 37.83 34.76 3h7t s LYS 233 CO 0.00 -0.40 1.10 -1.25 0.00 0.00 0.00 175.35 174.80 3h7t s PRO 234 N -1.82 1.81 0.00 1.78 0.04 -1.26 -4.75 135.00 130.79 3h7t s PRO 234 Ca 0.52 0.67 0.18 0.00 0.04 0.00 0.00 61.00 62.42 3h7t s PRO 234 Cb -0.44 -1.88 1.10 0.00 0.04 0.00 0.00 34.50 33.32 3h7t s PRO 234 CO 0.58 -1.82 1.49 0.94 0.04 0.00 0.00 177.00 178.23