#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1ur0 s LEU 12 N 0.00 4.43 -0.02 0.99 2.96 -1.26 -5.06 118.68 120.72 1ur0 s LEU 12 Ca 0.00 1.54 0.02 0.00 -0.22 0.00 0.00 54.13 55.46 1ur0 s LEU 12 Cb 0.00 -3.37 -0.03 0.00 0.50 0.00 0.00 46.19 43.29 1ur0 s LEU 12 CO 0.00 -0.08 -0.03 -0.47 -1.32 0.00 0.00 176.35 174.45 1ur0 s TYR 13 N 0.30 3.01 -0.23 5.38 5.04 -1.26 -4.90 117.35 124.69 1ur0 s TYR 13 Ca 0.43 0.05 -0.04 0.00 -2.44 0.00 0.00 57.07 55.06 1ur0 s TYR 13 Cb -0.21 -1.67 0.12 0.00 0.35 0.00 0.00 41.96 40.55 1ur0 s TYR 13 CO 0.25 0.42 0.42 0.08 -1.34 0.00 0.00 175.55 175.38 1ur0 s VAL 14 N -1.00 -0.67 0.12 3.14 1.01 -1.26 -4.86 120.40 116.87 1ur0 s VAL 14 Ca 0.17 0.04 -0.30 0.00 0.00 0.00 0.00 61.98 61.89 1ur0 s VAL 14 Cb -0.11 -0.78 -0.06 0.00 0.00 0.00 0.00 36.38 35.43 1ur0 s VAL 14 CO 0.07 -0.03 1.11 -0.70 0.00 0.00 0.00 175.10 175.55 1ur0 s GLU 15 N 2.61 4.54 0.17 2.72 2.12 -1.26 -1.54 118.70 128.06 1ur0 s GLU 15 Ca 0.07 1.69 -0.33 0.00 0.36 0.00 0.00 54.97 56.75 1ur0 s GLU 15 Cb -0.14 -3.33 -0.15 0.00 0.26 0.00 0.00 34.13 30.77 1ur0 s GLU 15 CO -0.15 -0.04 1.31 1.17 -0.54 0.00 0.00 175.26 177.02 1ur0 n LYS 16 N 3.06 1.50 -2.46 4.30 4.81 -1.26 -4.84 118.16 123.27 1ur0 n LYS 16 Ca 0.05 0.54 -0.42 0.00 -0.87 0.00 0.00 58.31 57.61 1ur0 n LYS 16 Cb 0.47 -2.14 -0.03 0.00 0.02 0.00 0.00 35.03 33.35 1ur0 n LYS 16 CO 0.00 0.00 0.00 0.08 1.17 0.00 0.00 177.40 178.65 1ur0 s VAL 17 N 0.13 4.18 0.03 3.15 1.01 -0.49 -4.98 120.40 123.42 1ur0 s VAL 17 Ca 0.75 1.55 -0.30 0.00 0.00 0.00 0.00 61.98 63.98 1ur0 s VAL 17 Cb -0.80 -3.99 -0.05 0.00 0.00 0.00 0.00 36.38 31.53 1ur0 s VAL 17 CO 0.49 0.09 1.23 -0.44 0.00 0.00 0.00 175.10 176.46 1ur0 s SER 18 N 1.18 7.04 -1.05 3.32 0.01 -1.26 -3.63 113.70 119.31 1ur0 s SER 18 Ca 0.57 1.99 0.00 0.00 1.31 0.00 0.00 55.95 59.82 1ur0 s SER 18 Cb -0.27 -2.57 0.00 0.00 0.21 0.00 0.00 66.02 63.38 1ur0 s SER 18 CO 0.27 -0.53 0.00 0.61 0.41 0.00 0.00 173.24 174.00 1ur0 n GLY 19 N 3.30 1.14 3.65 3.44 0.00 -1.26 -4.81 105.19 110.65 1ur0 n GLY 19 Ca 0.10 -0.57 -0.42 0.00 0.00 0.00 0.00 46.02 45.13 1ur0 n GLY 19 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 1ur0 s LEU 20 N -2.25 4.18 0.46 0.99 2.96 -1.24 -4.95 118.68 118.83 1ur0 s LEU 20 Ca 0.00 2.09 -0.24 0.00 -0.22 0.00 0.00 54.13 55.76 1ur0 s LEU 20 Cb 0.00 -3.53 -0.07 0.00 0.50 0.00 0.00 46.19 43.09 1ur0 s LEU 20 CO 0.00 -1.06 1.30 0.00 -1.32 0.00 0.00 176.35 175.27 1ur0 s ARG 21 N 4.32 3.65 0.46 1.98 1.70 -1.26 -4.92 118.95 124.89 1ur0 s ARG 21 Ca 0.75 2.13 0.26 0.00 -0.47 0.00 0.00 55.73 58.40 1ur0 s ARG 21 Cb -0.32 -2.53 0.77 0.00 -0.57 0.00 0.00 34.95 32.31 1ur0 s ARG 21 CO 0.30 -0.74 1.76 0.87 -1.08 0.00 0.00 175.30 176.41 1ur0 h LYS 22 N 2.15 0.00 -0.61 3.89 1.57 -2.03 -2.85 116.57 118.70 1ur0 h LYS 22 Ca -0.50 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.28 1ur0 h LYS 22 Cb 1.26 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.57 1ur0 h LYS 22 CO 0.60 0.08 0.00 -0.40 -0.57 0.00 0.00 179.45 179.17 1ur0 n ASP 23 N -3.15 3.30 -4.67 0.86 5.75 -1.26 -4.96 116.55 112.42 1ur0 n ASP 23 Ca 0.02 -2.30 -0.45 0.00 -0.01 0.00 0.00 54.79 52.04 1ur0 n ASP 23 Cb 0.45 -0.47 -0.03 0.00 -1.03 0.00 0.00 41.12 40.04 1ur0 n ASP 23 CO 0.00 0.00 0.00 0.33 -0.11 0.00 0.00 177.20 177.42 1ur0 n PHE 24 N 0.65 2.18 -2.31 2.11 7.35 -1.08 -4.89 117.46 121.46 1ur0 n PHE 24 Ca 0.17 0.38 -0.43 0.00 -0.76 0.00 0.00 57.45 56.81 1ur0 n PHE 24 Cb 0.63 -2.49 -0.02 0.00 0.35 0.00 0.00 39.48 37.95 1ur0 n PHE 24 CO 0.00 0.00 0.00 0.42 -0.76 0.00 0.00 176.76 176.42 1ur0 s ILE 25 N 0.34 4.09 -0.46 -2.13 1.01 0.31 -4.97 121.20 119.38 1ur0 s ILE 25 Ca 0.73 1.31 0.02 0.00 0.00 0.00 0.00 60.65 62.70 1ur0 s ILE 25 Cb -0.67 -3.87 0.12 0.00 0.01 0.00 0.00 42.46 38.05 1ur0 s ILE 25 CO 0.45 -0.15 0.21 -0.54 0.00 0.00 0.00 174.94 174.91 1ur0 s LYS 26 N 3.71 1.91 0.41 2.79 1.02 -1.26 -1.40 119.74 126.92 1ur0 s LYS 26 Ca 0.60 -2.23 0.07 0.00 0.02 0.00 0.00 55.97 54.42 1ur0 s LYS 26 Cb -0.24 -3.39 -0.07 0.00 -0.52 0.00 0.00 37.83 33.61 1ur0 s LYS 26 CO 0.19 -1.06 0.08 0.20 -0.92 0.00 0.00 175.35 173.84 1ur0 s GLY 27 N 0.60 2.45 0.00 -3.33 0.00 -0.77 -0.68 107.32 105.59 1ur0 s GLY 27 Ca 0.14 -2.21 -0.03 0.00 0.00 0.00 0.00 44.72 42.61 1ur0 s GLY 27 CO -0.04 -2.02 0.06 -1.34 0.00 0.00 0.00 173.10 169.75 1ur0 s VAL 28 N -2.67 0.08 -0.34 1.40 -7.23 -0.57 -0.80 120.40 110.27 1ur0 s VAL 28 Ca 0.37 -0.66 -0.05 0.00 -1.81 0.00 0.00 61.98 59.83 1ur0 s VAL 28 Cb 0.07 -0.31 0.06 0.00 0.56 0.00 0.00 36.38 36.76 1ur0 s VAL 28 CO 0.20 -0.36 0.09 -0.62 -0.31 0.00 0.00 175.10 174.10 1ur0 s ASP 29 N -1.17 5.19 -0.43 4.85 -1.08 -0.34 -0.33 116.67 123.35 1ur0 s ASP 29 Ca -0.13 -1.33 0.05 0.00 -0.52 0.00 0.00 52.55 50.62 1ur0 s ASP 29 Cb -0.07 -1.82 0.43 0.00 -1.46 0.00 0.00 42.92 39.99 1ur0 s ASP 29 CO 0.00 -0.35 1.19 1.33 0.52 0.00 0.00 175.17 177.86 1ur0 n VAL 30 N 4.73 2.49 -0.10 1.11 0.24 -1.23 -0.13 118.33 125.43 1ur0 n VAL 30 Ca -0.11 -4.71 0.10 0.00 -2.04 0.00 0.00 64.34 57.58 1ur0 n VAL 30 Cb 0.44 -1.24 0.46 0.00 -1.47 0.00 0.00 33.84 32.03 1ur0 n VAL 30 CO 0.00 0.00 0.00 0.28 -2.14 0.00 0.00 176.83 174.97 1ur0 h SER 31 N 2.50 0.44 0.26 -1.34 0.02 -1.93 -1.57 113.55 111.94 1ur0 h SER 31 Ca 0.33 0.01 0.00 0.00 -0.84 0.00 0.00 61.79 61.29 1ur0 h SER 31 Cb 1.01 -0.09 0.00 0.00 0.14 0.00 0.00 62.40 63.46 1ur0 h SER 31 CO 0.87 0.27 0.00 -1.54 -1.14 0.00 0.00 176.83 175.30 1ur0 n SER 32 N -4.48 0.00 -0.36 3.07 3.41 -1.26 -4.06 113.62 109.94 1ur0 n SER 32 Ca 0.10 -0.40 0.09 0.00 -0.26 0.00 0.00 58.87 58.40 1ur0 n SER 32 Cb 0.32 -0.16 0.26 0.00 -0.26 0.00 0.00 64.21 64.38 1ur0 n SER 32 CO 0.00 0.00 0.00 -0.29 -0.16 0.00 0.00 175.04 174.59 1ur0 h ILE 33 N 0.00 0.87 0.30 -1.33 6.09 -1.63 -1.22 117.51 120.59 1ur0 h ILE 33 Ca 0.00 -0.32 -0.01 0.00 -1.37 0.00 0.00 64.86 63.15 1ur0 h ILE 33 Cb 0.13 -0.15 0.00 0.00 0.47 0.00 0.00 36.82 37.27 1ur0 h ILE 33 CO 0.00 0.17 -0.14 0.40 -3.07 0.00 0.00 178.15 175.51 1ur0 h ILE 34 N 0.94 0.70 -0.75 2.19 1.08 -1.82 -0.67 117.51 119.17 1ur0 h ILE 34 Ca 0.52 -0.62 0.10 0.00 -0.39 0.00 0.00 64.86 64.46 1ur0 h ILE 34 Cb 0.60 1.02 -0.07 0.00 -3.07 0.00 0.00 36.82 35.29 1ur0 h ILE 34 CO -0.29 0.12 0.40 0.00 -0.69 0.00 0.00 178.15 177.68 1ur0 h ALA 35 N -0.21 1.05 -0.51 1.87 0.00 -1.75 -0.65 119.26 119.07 1ur0 h ALA 35 Ca -0.04 0.05 -0.01 0.00 0.00 0.00 0.00 54.91 54.90 1ur0 h ALA 35 Cb 0.50 -0.07 -0.02 0.00 0.00 0.00 0.00 17.79 18.19 1ur0 h ALA 35 CO 0.07 -0.00 0.26 -0.07 0.00 0.00 0.00 179.25 179.51 1ur0 h LEU 36 N 0.66 0.65 -1.04 0.00 3.38 -1.15 -1.48 115.31 116.33 1ur0 h LEU 36 Ca 0.37 -0.11 -0.08 0.00 0.09 0.00 0.00 57.88 58.15 1ur0 h LEU 36 Cb 0.38 -0.17 -0.01 0.00 0.09 0.00 0.00 40.66 40.95 1ur0 h LEU 36 CO -0.26 0.57 -0.21 -0.33 0.09 0.00 0.00 178.44 178.30 1ur0 h GLU 37 N 0.68 0.43 0.00 1.13 5.08 -0.43 -0.98 114.58 120.49 1ur0 h GLU 37 Ca 0.18 -0.15 0.00 0.00 -1.00 0.00 0.00 59.36 58.39 1ur0 h GLU 37 Cb 0.08 -0.03 0.00 0.00 0.50 0.00 0.00 28.75 29.30 1ur0 h GLU 37 CO -0.03 0.63 0.00 0.93 -1.00 0.00 0.00 179.01 179.54 1ur0 h GLU 38 N 0.39 0.00 -0.00 2.33 5.08 -0.78 -2.12 114.58 119.48 1ur0 h GLU 38 Ca 0.06 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.42 1ur0 h GLU 38 Cb 0.59 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.84 1ur0 h GLU 38 CO 0.04 0.00 -0.13 0.43 -1.00 0.00 0.00 179.01 178.36 1ur0 n SER 39 N -2.84 0.59 0.00 1.42 7.64 -0.45 -4.91 113.62 115.07 1ur0 n SER 39 Ca 0.02 -0.68 0.00 0.00 1.01 0.00 0.00 58.87 59.22 1ur0 n SER 39 Cb 0.34 -0.03 0.00 0.00 -1.01 0.00 0.00 64.21 63.50 1ur0 n SER 39 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1ur0 n GLY 40 N 1.28 0.86 3.76 0.23 0.00 -0.80 -5.04 105.19 105.49 1ur0 n GLY 40 Ca 0.14 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.78 1ur0 n GLY 40 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1ur0 s VAL 41 N -2.01 4.12 0.08 1.61 1.01 -0.70 -5.01 120.40 119.49 1ur0 s VAL 41 Ca 0.00 1.96 0.03 0.00 0.00 0.00 0.00 61.98 63.98 1ur0 s VAL 41 Cb 0.00 -4.18 -0.03 0.00 0.00 0.00 0.00 36.38 32.17 1ur0 s VAL 41 CO 0.00 0.34 -0.10 0.00 0.00 0.00 0.00 175.10 175.34 1ur0 s ALA 42 N -1.38 0.97 0.23 5.51 0.00 -1.26 -4.33 121.76 121.51 1ur0 s ALA 42 Ca 0.45 -1.06 0.12 0.00 0.00 0.00 0.00 51.96 51.47 1ur0 s ALA 42 Cb -0.23 0.02 -0.05 0.00 0.00 0.00 0.00 23.12 22.87 1ur0 s ALA 42 CO 0.28 -0.01 -0.21 -0.06 0.00 0.00 0.00 175.76 175.76 1ur0 s PHE 43 N -2.04 2.32 0.27 0.00 0.40 -1.26 -4.24 117.98 113.43 1ur0 s PHE 43 Ca 0.00 -0.34 0.02 0.00 -0.60 0.00 0.00 56.93 56.02 1ur0 s PHE 43 Cb -0.05 -1.08 -0.01 0.00 0.51 0.00 0.00 43.02 42.39 1ur0 s PHE 43 CO 0.00 0.60 0.07 0.66 0.70 0.00 0.00 175.22 177.26 1ur0 n TYR 44 N -0.16 0.22 -4.72 0.36 4.02 -0.28 -1.64 117.16 114.95 1ur0 n TYR 44 Ca -0.09 -1.61 -0.32 0.00 -0.01 0.00 0.00 57.90 55.87 1ur0 n TYR 44 Cb 0.58 -0.04 -0.07 0.00 -0.02 0.00 0.00 39.34 39.78 1ur0 n TYR 44 CO 0.00 0.00 0.00 0.27 -1.01 0.00 0.00 176.86 176.12 1ur0 n ASN 45 N -1.62 3.03 -0.28 7.72 6.94 -1.18 -4.42 115.26 125.46 1ur0 n ASN 45 Ca -0.06 -3.26 0.01 0.00 -0.02 0.00 0.00 54.58 51.26 1ur0 n ASN 45 Cb 0.38 0.49 0.08 0.00 -2.36 0.00 0.00 39.78 38.38 1ur0 n ASN 45 CO 0.00 0.00 0.00 -0.33 -1.03 0.00 0.00 177.26 175.90 1ur0 h GLU 46 N 0.00 -0.02 0.00 -3.83 4.39 -1.93 0.33 114.58 113.52 1ur0 h GLU 46 Ca -0.41 0.00 -0.01 0.00 0.34 0.00 0.00 59.36 59.29 1ur0 h GLU 46 Cb 1.29 0.00 -0.00 0.00 -0.10 0.00 0.00 28.75 29.94 1ur0 h GLU 46 CO 0.68 -0.01 -0.03 0.77 -1.16 0.00 0.00 179.01 179.25 1ur0 h SER 47 N -0.02 0.00 0.00 1.42 0.02 -2.01 -3.46 113.55 109.49 1ur0 h SER 47 Ca 0.36 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.31 1ur0 h SER 47 Cb 0.58 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.12 1ur0 h SER 47 CO -0.82 0.03 0.00 0.61 -1.14 0.00 0.00 176.83 175.51 1ur0 n GLY 48 N -0.92 0.91 3.48 -3.77 0.00 0.11 -5.09 105.19 99.91 1ur0 n GLY 48 Ca -0.02 -0.16 -0.33 0.00 0.00 0.00 0.00 46.02 45.50 1ur0 n GLY 48 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1ur0 s LYS 49 N -0.29 3.25 -0.07 1.61 -2.85 -1.26 -4.81 119.74 115.31 1ur0 s LYS 49 Ca 0.00 -0.59 -0.40 0.00 -1.00 0.00 0.00 55.97 53.98 1ur0 s LYS 49 Cb 0.00 -2.70 -0.18 0.00 -2.06 0.00 0.00 37.83 32.89 1ur0 s LYS 49 CO 0.00 0.37 1.33 1.17 0.10 0.00 0.00 175.35 178.32 1ur0 n LYS 50 N 3.09 0.59 -3.57 1.78 4.81 -1.26 -3.10 118.16 120.51 1ur0 n LYS 50 Ca -0.18 0.21 -0.17 0.00 -0.87 0.00 0.00 58.31 57.31 1ur0 n LYS 50 Cb 0.53 -1.79 -0.07 0.00 0.02 0.00 0.00 35.03 33.72 1ur0 n LYS 50 CO 0.00 0.00 0.00 -1.14 1.17 0.00 0.00 177.40 177.43 1ur0 s GLN 51 N 1.04 0.96 0.09 1.64 0.74 -0.65 -4.93 119.66 118.54 1ur0 s GLN 51 Ca 0.91 0.37 -0.35 0.00 0.05 0.00 0.00 55.36 56.34 1ur0 s GLN 51 Cb -1.15 0.45 -0.15 0.00 1.10 0.00 0.00 33.01 33.26 1ur0 s GLN 51 CO 0.57 -0.26 1.54 -3.47 -0.55 0.00 0.00 175.29 173.13 1ur0 n ASP 52 N 1.37 2.63 -0.16 6.67 -0.08 -1.26 -4.36 116.55 121.36 1ur0 n ASP 52 Ca -0.18 1.08 0.06 0.00 -1.51 0.00 0.00 54.79 54.24 1ur0 n ASP 52 Cb 0.57 -1.33 0.36 0.00 2.34 0.00 0.00 41.12 43.05 1ur0 n ASP 52 CO 0.00 0.00 0.00 -0.29 0.12 0.00 0.00 177.20 177.03 1ur0 h ILE 53 N 3.80 1.04 0.00 5.18 2.10 -1.93 -0.79 117.51 126.91 1ur0 h ILE 53 Ca -0.46 -0.26 -0.01 0.00 1.08 0.00 0.00 64.86 65.21 1ur0 h ILE 53 Cb 1.29 0.23 -0.00 0.00 -1.09 0.00 0.00 36.82 37.24 1ur0 h ILE 53 CO 0.86 0.14 -0.06 -0.26 -1.08 0.00 0.00 178.15 177.74 1ur0 h PHE 54 N 0.75 0.00 0.14 2.19 0.04 -1.94 0.14 116.94 118.25 1ur0 h PHE 54 Ca 0.29 0.00 -0.29 0.00 2.80 0.00 0.00 57.97 60.77 1ur0 h PHE 54 Cb 0.21 0.00 0.01 0.00 2.20 0.00 0.00 35.95 38.36 1ur0 h PHE 54 CO -0.00 0.06 -1.36 -0.22 -0.60 0.00 0.00 178.31 176.20 1ur0 h LYS 55 N 0.00 0.30 -0.37 1.51 3.64 -1.51 -2.58 116.57 117.57 1ur0 h LYS 55 Ca -0.00 -0.52 -0.04 0.00 -1.27 0.00 0.00 60.65 58.82 1ur0 h LYS 55 Cb 0.13 0.19 -0.01 0.00 -0.41 0.00 0.00 32.23 32.13 1ur0 h LYS 55 CO 0.01 1.22 0.07 1.15 -2.27 0.00 0.00 179.45 179.63 1ur0 h THR 56 N 0.08 1.24 -0.34 1.00 2.02 -0.94 -1.47 112.91 114.49 1ur0 h THR 56 Ca -0.18 -0.83 0.05 0.00 0.77 0.00 0.00 66.41 66.22 1ur0 h THR 56 Cb 2.01 1.07 -0.04 0.00 -1.74 0.00 0.00 68.15 69.45 1ur0 h THR 56 CO 0.20 0.28 0.09 -0.07 0.37 0.00 0.00 175.52 176.39 1ur0 h LEU 57 N 0.45 0.06 -0.11 2.58 4.07 -0.82 0.24 115.31 121.78 1ur0 h LEU 57 Ca 0.11 0.05 0.03 0.00 0.08 0.00 0.00 57.88 58.15 1ur0 h LEU 57 Cb 0.35 0.05 -0.03 0.00 1.08 0.00 0.00 40.66 42.11 1ur0 h LEU 57 CO 0.01 0.07 -0.07 0.50 -1.08 0.00 0.00 178.44 177.86 1ur0 h LYS 58 N 0.22 -0.07 0.00 1.13 1.63 -1.21 -0.14 116.57 118.12 1ur0 h LYS 58 Ca 0.16 0.01 -0.00 0.00 -0.85 0.00 0.00 60.65 59.96 1ur0 h LYS 58 Cb 0.16 0.02 -0.00 0.00 -0.60 0.00 0.00 32.23 31.81 1ur0 h LYS 58 CO -0.19 -0.05 -0.00 0.93 -3.45 0.00 0.00 179.45 176.69 1ur0 h GLU 59 N -0.08 0.00 -0.00 1.90 5.08 -0.80 0.39 114.58 121.07 1ur0 h GLU 59 Ca 0.07 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.43 1ur0 h GLU 59 Cb 0.18 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.43 1ur0 h GLU 59 CO -0.16 0.00 -0.05 0.00 -1.00 0.00 0.00 179.01 177.80 1ur0 n ALA 60 N -2.09 2.66 -0.14 3.43 0.00 0.03 -4.89 120.51 119.50 1ur0 n ALA 60 Ca -0.02 -0.23 0.00 0.00 0.00 0.00 0.00 53.44 53.19 1ur0 n ALA 60 Cb 0.14 -1.40 0.00 0.00 0.00 0.00 0.00 19.45 18.19 1ur0 n ALA 60 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1ur0 n GLY 61 N 1.22 0.64 3.77 0.00 0.00 0.13 -3.61 105.19 107.33 1ur0 n GLY 61 Ca 0.17 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.79 1ur0 n GLY 61 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1ur0 s VAL 62 N -2.23 2.85 0.00 1.61 1.01 -0.76 -4.85 120.40 118.02 1ur0 s VAL 62 Ca 0.00 0.76 0.00 0.00 0.00 0.00 0.00 61.98 62.74 1ur0 s VAL 62 Cb 0.00 -3.44 0.00 0.00 0.00 0.00 0.00 36.38 32.94 1ur0 s VAL 62 CO 0.00 0.11 0.64 -0.46 0.00 0.00 0.00 175.10 175.39 1ur0 n ASN 63 N 0.23 0.71 -3.71 3.32 0.23 0.14 -4.45 115.26 111.73 1ur0 n ASN 63 Ca 0.03 -1.34 -0.13 0.00 -0.53 0.00 0.00 54.58 52.61 1ur0 n ASN 63 Cb 0.44 0.00 -0.09 0.00 -2.08 0.00 0.00 39.78 38.05 1ur0 n ASN 63 CO 0.00 0.00 0.00 -0.47 -0.93 0.00 0.00 177.26 175.86 1ur0 s TYR 64 N -0.34 -0.49 -0.07 -2.53 6.14 -1.13 -1.95 117.35 116.98 1ur0 s TYR 64 Ca 0.00 1.19 0.04 0.00 0.64 0.00 0.00 57.07 58.93 1ur0 s TYR 64 Cb 0.00 0.18 0.00 0.00 0.42 0.00 0.00 41.96 42.56 1ur0 s TYR 64 CO 0.00 -0.26 -0.18 0.08 0.64 0.00 0.00 175.55 175.83 1ur0 s VAL 65 N 0.13 1.59 -0.08 3.14 1.01 -0.12 -1.52 120.40 124.55 1ur0 s VAL 65 Ca -0.01 -0.76 -0.02 0.00 0.00 0.00 0.00 61.98 61.19 1ur0 s VAL 65 Cb -0.03 -1.39 -0.03 0.00 0.00 0.00 0.00 36.38 34.92 1ur0 s VAL 65 CO 0.01 0.45 0.02 -0.60 0.00 0.00 0.00 175.10 174.98 1ur0 s ARG 66 N 0.36 3.00 -0.03 2.72 3.52 0.55 -0.20 118.95 128.87 1ur0 s ARG 66 Ca -0.13 -0.40 -0.01 0.00 -0.13 0.00 0.00 55.73 55.06 1ur0 s ARG 66 Cb -0.16 -2.82 0.03 0.00 -1.56 0.00 0.00 34.95 30.45 1ur0 s ARG 66 CO 0.05 0.70 0.03 0.54 -0.81 0.00 0.00 175.30 175.82 1ur0 s VAL 67 N -0.92 -0.00 0.44 7.11 0.11 -0.68 -3.47 120.40 122.99 1ur0 s VAL 67 Ca 0.14 0.25 -0.21 0.00 -2.93 0.00 0.00 61.98 59.24 1ur0 s VAL 67 Cb -0.11 -0.17 -0.10 0.00 -1.53 0.00 0.00 36.38 34.47 1ur0 s VAL 67 CO 0.04 0.14 0.97 0.00 -3.33 0.00 0.00 175.10 172.92 1ur0 s ARG 68 N 1.47 4.12 -0.08 1.54 1.70 -1.26 -0.64 118.95 125.80 1ur0 s ARG 68 Ca -0.04 1.18 -0.02 0.00 -0.47 0.00 0.00 55.73 56.39 1ur0 s ARG 68 Cb -0.13 -2.16 0.03 0.00 -0.57 0.00 0.00 34.95 32.13 1ur0 s ARG 68 CO -0.03 -0.13 0.02 0.42 -1.08 0.00 0.00 175.30 174.50 1ur0 s ILE 69 N -2.13 0.25 -0.07 4.99 1.01 0.21 -4.63 121.20 120.83 1ur0 s ILE 69 Ca 0.63 0.13 -0.03 0.00 0.00 0.00 0.00 60.65 61.38 1ur0 s ILE 69 Cb -0.11 -0.48 -0.04 0.00 0.01 0.00 0.00 42.46 41.84 1ur0 s ILE 69 CO 0.15 0.18 0.07 0.26 0.00 0.00 0.00 174.94 175.59 1ur0 s TRP 70 N 2.02 3.32 0.08 3.97 0.51 0.92 -1.86 118.94 127.91 1ur0 s TRP 70 Ca 0.04 0.29 -0.32 0.00 -2.12 0.00 0.00 56.10 53.99 1ur0 s TRP 70 Cb -0.13 -1.82 -0.17 0.00 -0.81 0.00 0.00 33.47 30.55 1ur0 s TRP 70 CO -0.05 0.57 1.62 -0.91 -0.51 0.00 0.00 176.95 177.67 1ur0 h ASN 71 N 4.78 -0.86 -1.82 2.95 2.35 -1.62 -3.38 115.58 117.98 1ur0 h ASN 71 Ca -0.51 0.05 -0.46 0.00 -0.55 0.00 0.00 56.30 54.82 1ur0 h ASN 71 Cb 1.20 0.25 -0.32 0.00 0.05 0.00 0.00 38.32 39.51 1ur0 h ASN 71 CO 0.58 -0.53 -0.86 -0.67 -1.65 0.00 0.00 177.43 174.29 1ur0 n ASP 72 N -5.48 -1.19 -1.97 5.81 2.03 -1.26 -4.76 116.55 109.73 1ur0 n ASP 72 Ca -0.12 -2.62 -0.07 0.00 0.52 0.00 0.00 54.79 52.50 1ur0 n ASP 72 Cb 0.37 0.11 -0.10 0.00 -0.72 0.00 0.00 41.12 40.78 1ur0 n ASP 72 CO 0.00 0.00 0.00 -0.81 -1.92 0.00 0.00 177.20 174.47 1ur0 n PRO 73 N 2.50 1.37 -3.95 -0.67 -0.04 -1.23 -4.76 135.00 128.22 1ur0 n PRO 73 Ca 0.24 -0.58 -0.08 0.00 -0.04 0.00 0.00 63.50 63.04 1ur0 n PRO 73 Cb 0.52 -1.68 -0.08 0.00 -0.04 0.00 0.00 33.50 32.21 1ur0 n PRO 73 CO 0.00 0.00 0.00 0.71 -0.04 0.00 0.00 175.50 176.17 1ur0 s TYR 74 N 1.15 0.32 0.81 0.54 1.51 -1.26 -0.83 117.35 119.59 1ur0 s TYR 74 Ca 0.39 -0.78 -0.05 0.00 -1.01 0.00 0.00 57.07 55.62 1ur0 s TYR 74 Cb 0.19 -0.18 0.17 0.00 -0.11 0.00 0.00 41.96 42.02 1ur0 s TYR 74 CO 0.00 -0.51 1.11 0.16 -1.11 0.00 0.00 175.55 175.21 1ur0 s ASP 75 N -2.90 3.82 0.50 2.29 1.47 -0.97 -4.88 116.67 116.00 1ur0 s ASP 75 Ca 0.07 -0.31 0.29 0.00 1.18 0.00 0.00 52.55 53.78 1ur0 s ASP 75 Cb 0.06 0.12 1.38 0.00 -0.34 0.00 0.00 42.92 44.15 1ur0 s ASP 75 CO -0.09 -2.23 1.83 0.00 0.68 0.00 0.00 175.17 175.35 1ur0 h ALA 76 N -0.92 2.75 -0.01 2.11 0.00 -1.97 -0.30 119.26 120.92 1ur0 h ALA 76 Ca -0.37 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.53 1ur0 h ALA 76 Cb 1.25 0.06 0.00 0.00 0.00 0.00 0.00 17.79 19.10 1ur0 h ALA 76 CO 0.36 -1.07 -0.18 0.09 0.00 0.00 0.00 179.25 178.45 1ur0 n ASN 77 N -4.34 1.06 0.00 0.00 4.13 -1.26 -4.92 115.26 109.92 1ur0 n ASN 77 Ca 0.23 -0.99 0.00 0.00 1.68 0.00 0.00 54.58 55.49 1ur0 n ASN 77 Cb 1.02 0.08 0.00 0.00 -1.54 0.00 0.00 39.78 39.34 1ur0 n ASN 77 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 1ur0 n GLY 78 N 1.29 0.86 3.54 7.41 0.00 -0.12 -5.04 105.19 113.13 1ur0 n GLY 78 Ca 0.14 -0.36 -0.43 0.00 0.00 0.00 0.00 46.02 45.37 1ur0 n GLY 78 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1ur0 s ASN 79 N -2.34 6.39 0.48 1.61 0.01 -1.26 -4.83 114.94 115.01 1ur0 s ASN 79 Ca 0.00 -0.11 -0.22 0.00 -0.71 0.00 0.00 52.86 51.82 1ur0 s ASN 79 Cb 0.00 -2.35 -0.09 0.00 0.41 0.00 0.00 41.25 39.22 1ur0 s ASN 79 CO 0.00 -0.80 0.92 0.61 -1.51 0.00 0.00 177.10 176.32 1ur0 n GLY 80 N 4.91 -0.44 0.01 0.66 0.00 -1.26 -2.29 105.19 106.78 1ur0 n GLY 80 Ca 0.00 0.03 0.14 0.00 0.00 0.00 0.00 46.02 46.20 1ur0 n GLY 80 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 1ur0 n TYR 81 N -0.95 0.00 -1.24 1.61 4.01 -0.01 -4.68 117.16 115.91 1ur0 n TYR 81 Ca 0.11 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.85 1ur0 n TYR 81 Cb 0.42 -0.39 0.00 0.00 -0.31 0.00 0.00 39.34 39.06 1ur0 n TYR 81 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 1ur0 n GLY 82 N 1.41 -1.15 2.44 2.72 0.00 -1.26 0.04 105.19 109.39 1ur0 n GLY 82 Ca 0.10 -1.72 -0.19 0.00 0.00 0.00 0.00 46.02 44.21 1ur0 n GLY 82 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1ur0 n GLY 83 N 0.00 1.29 0.15 -0.02 0.00 0.12 -0.02 105.19 106.70 1ur0 n GLY 83 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 1ur0 n GLY 83 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1ur0 n GLY 84 N -0.49 0.25 4.05 -0.02 0.00 -0.35 -4.46 105.19 104.17 1ur0 n GLY 84 Ca -0.20 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.55 1ur0 n GLY 84 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1ur0 n ASN 85 N 0.00 -0.15 -4.59 1.61 3.02 0.97 -4.47 115.26 111.64 1ur0 n ASN 85 Ca 0.00 -1.07 -0.43 0.00 -0.03 0.00 0.00 54.58 53.06 1ur0 n ASN 85 Cb 0.00 -2.72 -0.02 0.00 -0.61 0.00 0.00 39.78 36.43 1ur0 n ASN 85 CO 0.00 0.00 0.00 0.20 -2.62 0.00 0.00 177.26 174.84 1ur0 s ASN 86 N -4.33 6.49 0.36 6.41 -0.87 -1.26 -4.88 114.94 116.85 1ur0 s ASN 86 Ca 0.04 0.39 0.01 0.00 -1.57 0.00 0.00 52.86 51.73 1ur0 s ASN 86 Cb -0.02 -2.55 -0.00 0.00 -0.02 0.00 0.00 41.25 38.66 1ur0 s ASN 86 CO 0.92 -1.39 0.03 -0.90 -2.57 0.00 0.00 177.10 173.18 1ur0 n ASP 87 N 8.33 2.50 -0.26 -1.22 5.68 -1.26 -0.05 116.55 130.27 1ur0 n ASP 87 Ca 0.12 -2.64 0.02 0.00 -0.50 0.00 0.00 54.79 51.78 1ur0 n ASP 87 Cb 0.49 0.41 0.14 0.00 -1.14 0.00 0.00 41.12 41.02 1ur0 n ASP 87 CO 0.00 0.00 0.00 0.25 -1.33 0.00 0.00 177.20 176.12 1ur0 h LEU 88 N 0.00 0.54 -0.29 -2.12 5.85 -1.86 -1.64 115.31 115.78 1ur0 h LEU 88 Ca -0.29 0.05 0.04 0.00 0.84 0.00 0.00 57.88 58.52 1ur0 h LEU 88 Cb 0.93 -0.05 -0.04 0.00 0.37 0.00 0.00 40.66 41.88 1ur0 h LEU 88 CO 0.48 0.31 0.07 -0.08 -0.34 0.00 0.00 178.44 178.88 1ur0 h GLU 89 N 0.67 0.17 -0.21 1.25 4.81 -1.96 0.13 114.58 119.45 1ur0 h GLU 89 Ca 0.36 -0.01 -0.10 0.00 -0.13 0.00 0.00 59.36 59.48 1ur0 h GLU 89 Cb 0.35 -0.04 -0.01 0.00 0.63 0.00 0.00 28.75 29.68 1ur0 h GLU 89 CO -0.25 0.12 -0.32 0.87 -0.73 0.00 0.00 179.01 178.69 1ur0 h LYS 90 N 0.18 0.43 -0.84 1.92 1.57 -1.84 -1.66 116.57 116.33 1ur0 h LYS 90 Ca 0.13 -0.18 0.04 0.00 -1.87 0.00 0.00 60.65 58.77 1ur0 h LYS 90 Cb 0.13 -0.02 -0.05 0.00 0.08 0.00 0.00 32.23 32.38 1ur0 h LYS 90 CO -0.17 0.70 0.55 0.00 -0.57 0.00 0.00 179.45 179.96 1ur0 h ALA 91 N 1.30 1.49 -0.21 3.86 0.00 -0.30 0.15 119.26 125.54 1ur0 h ALA 91 Ca 0.05 -0.04 -0.18 0.00 0.00 0.00 0.00 54.91 54.73 1ur0 h ALA 91 Cb 0.74 -0.29 -0.00 0.00 0.00 0.00 0.00 17.79 18.24 1ur0 h ALA 91 CO 0.06 0.43 -0.60 0.82 0.00 0.00 0.00 179.25 179.95 1ur0 h ILE 92 N 1.03 1.30 -0.49 0.00 2.04 -0.36 0.96 117.51 121.99 1ur0 h ILE 92 Ca 0.33 -1.83 -0.04 0.00 1.00 0.00 0.00 64.86 64.32 1ur0 h ILE 92 Cb 0.04 1.78 -0.02 0.00 -0.74 0.00 0.00 36.82 37.88 1ur0 h ILE 92 CO -0.10 0.58 0.15 1.56 0.00 0.00 0.00 178.15 180.34 1ur0 h GLN 93 N 0.52 0.77 -0.44 2.37 4.20 -0.38 -0.56 115.11 121.59 1ur0 h GLN 93 Ca -0.00 -0.17 -0.09 0.00 0.06 0.00 0.00 58.65 58.45 1ur0 h GLN 93 Cb 1.19 -0.11 -0.01 0.00 0.30 0.00 0.00 27.48 28.84 1ur0 h GLN 93 CO 0.12 0.73 -0.08 0.82 -0.67 0.00 0.00 178.83 179.75 1ur0 h ILE 94 N 0.67 1.27 0.42 2.54 2.04 -0.66 -2.81 117.51 120.98 1ur0 h ILE 94 Ca 0.16 -1.17 -0.02 0.00 1.00 0.00 0.00 64.86 64.83 1ur0 h ILE 94 Cb 0.28 1.13 -0.00 0.00 -0.74 0.00 0.00 36.82 37.49 1ur0 h ILE 94 CO -0.00 0.40 -0.23 1.23 0.00 0.00 0.00 178.15 179.55 1ur0 h GLY 95 N 0.67 -0.64 -0.15 5.37 0.00 -0.55 0.14 103.07 107.91 1ur0 h GLY 95 Ca 0.12 0.25 0.17 0.00 0.00 0.00 0.00 47.33 47.87 1ur0 h GLY 95 CO 0.04 -0.24 0.18 0.50 0.00 0.00 0.00 176.54 177.02 1ur0 h LYS 96 N -0.61 0.25 -0.25 4.80 1.57 -1.12 0.47 116.57 121.68 1ur0 h LYS 96 Ca -0.05 -0.02 -0.17 0.00 -1.87 0.00 0.00 60.65 58.55 1ur0 h LYS 96 Cb 0.49 -0.06 -0.00 0.00 0.08 0.00 0.00 32.23 32.74 1ur0 h LYS 96 CO 0.07 0.17 -0.52 0.00 -0.57 0.00 0.00 179.45 178.60 1ur0 h ARG 97 N 0.26 0.70 0.20 3.15 3.08 -1.26 0.38 114.38 120.88 1ur0 h ARG 97 Ca 0.44 -0.42 -0.01 0.00 0.07 0.00 0.00 59.98 60.05 1ur0 h ARG 97 Cb 0.77 0.04 0.00 0.00 0.08 0.00 0.00 29.97 30.87 1ur0 h ARG 97 CO -0.54 1.04 -0.10 0.00 -1.07 0.00 0.00 179.97 179.31 1ur0 h ALA 98 N 0.87 -0.27 -0.21 0.04 0.00 0.14 -1.90 119.26 117.93 1ur0 h ALA 98 Ca 0.02 -0.12 -0.02 0.00 0.00 0.00 0.00 54.91 54.79 1ur0 h ALA 98 Cb 1.08 0.10 -0.01 0.00 0.00 0.00 0.00 17.79 18.96 1ur0 h ALA 98 CO 0.11 -0.57 0.03 1.15 0.00 0.00 0.00 179.25 179.97 1ur0 h THR 99 N -0.42 1.12 0.00 0.00 2.02 -0.16 -0.36 112.91 115.11 1ur0 h THR 99 Ca -0.03 -0.42 0.00 0.00 0.77 0.00 0.00 66.41 66.73 1ur0 h THR 99 Cb 0.33 0.93 0.00 0.00 -1.74 0.00 0.00 68.15 67.66 1ur0 h THR 99 CO 0.04 0.15 0.00 0.00 0.37 0.00 0.00 175.52 176.08 1ur0 h ALA 100 N 1.75 1.00 -0.36 6.16 0.00 -0.49 -2.61 119.26 124.71 1ur0 h ALA 100 Ca 0.07 0.00 -0.21 0.00 0.00 0.00 0.00 54.91 54.78 1ur0 h ALA 100 Cb 0.15 0.00 -0.13 0.00 0.00 0.00 0.00 17.79 17.81 1ur0 h ALA 100 CO -0.00 0.00 -0.17 0.09 0.00 0.00 0.00 179.25 179.17 1ur0 n ASN 101 N -2.88 2.71 -3.79 0.00 3.02 -0.21 -4.97 115.26 109.14 1ur0 n ASN 101 Ca 0.00 -3.81 -0.25 0.00 -0.03 0.00 0.00 54.58 50.49 1ur0 n ASN 101 Cb 0.23 -0.61 0.03 0.00 -0.61 0.00 0.00 39.78 38.82 1ur0 n ASN 101 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1ur0 n GLY 102 N -1.09 -0.37 2.96 7.41 0.00 -0.98 -4.80 105.19 108.31 1ur0 n GLY 102 Ca 0.33 0.16 -0.21 0.00 0.00 0.00 0.00 46.02 46.30 1ur0 n GLY 102 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 1ur0 s MET 103 N -6.26 1.00 0.88 1.61 -1.94 -0.77 -4.86 119.30 108.96 1ur0 s MET 103 Ca 0.28 -0.23 -0.11 0.00 -1.71 0.00 0.00 55.69 53.91 1ur0 s MET 103 Cb -0.14 -0.93 0.12 0.00 2.01 0.00 0.00 34.83 35.89 1ur0 s MET 103 CO 0.82 0.02 1.09 0.15 -0.01 0.00 0.00 175.02 177.09 1ur0 s LYS 104 N 0.56 1.36 0.05 2.03 -0.14 -0.82 -3.42 119.74 119.36 1ur0 s LYS 104 Ca -0.09 0.84 0.07 0.00 -1.36 0.00 0.00 55.97 55.43 1ur0 s LYS 104 Cb -0.12 -1.82 -0.03 0.00 -1.68 0.00 0.00 37.83 34.18 1ur0 s LYS 104 CO 0.01 -2.17 -0.18 -1.17 -0.76 0.00 0.00 175.35 171.08 1ur0 s LEU 105 N -6.18 2.63 -0.29 3.17 2.96 -0.49 -0.94 118.68 119.54 1ur0 s LEU 105 Ca 0.63 -0.43 0.00 0.00 -0.22 0.00 0.00 54.13 54.11 1ur0 s LEU 105 Cb -0.18 -1.53 0.06 0.00 0.50 0.00 0.00 46.19 45.04 1ur0 s LEU 105 CO 0.57 0.25 -0.04 -0.22 -1.32 0.00 0.00 176.35 175.59 1ur0 s LEU 106 N -1.52 3.78 -0.33 -0.68 0.20 0.72 -1.28 118.68 119.58 1ur0 s LEU 106 Ca 0.15 -1.38 -0.24 0.00 0.69 0.00 0.00 54.13 53.35 1ur0 s LEU 106 Cb -0.11 -1.64 0.01 0.00 -0.43 0.00 0.00 46.19 44.02 1ur0 s LEU 106 CO 0.06 -0.24 0.83 0.00 -0.29 0.00 0.00 176.35 176.70 1ur0 s ALA 107 N 1.17 3.48 -0.55 5.97 0.00 -0.39 -1.68 121.76 129.76 1ur0 s ALA 107 Ca -0.06 -0.46 -0.14 0.00 0.00 0.00 0.00 51.96 51.29 1ur0 s ALA 107 Cb -0.20 -3.38 0.14 0.00 0.00 0.00 0.00 23.12 19.68 1ur0 s ALA 107 CO -0.03 -1.35 0.49 0.34 0.00 0.00 0.00 175.76 175.21 1ur0 s ASP 108 N 1.72 6.14 -0.36 0.00 -1.08 0.19 0.31 116.67 123.59 1ur0 s ASP 108 Ca 0.34 -1.90 -0.24 0.00 -0.52 0.00 0.00 52.55 50.23 1ur0 s ASP 108 Cb -0.13 -2.17 0.01 0.00 -1.46 0.00 0.00 42.92 39.17 1ur0 s ASP 108 CO 0.15 -0.80 0.80 -0.36 0.52 0.00 0.00 175.17 175.48 1ur0 s PHE 109 N 1.41 3.11 -0.50 -5.34 0.08 -0.73 0.64 117.98 116.65 1ur0 s PHE 109 Ca 0.05 0.61 0.24 0.00 0.12 0.00 0.00 56.93 57.94 1ur0 s PHE 109 Cb -0.28 -3.42 0.43 0.00 -0.57 0.00 0.00 43.02 39.19 1ur0 s PHE 109 CO 0.01 -0.73 1.61 0.45 -0.10 0.00 0.00 175.22 176.45 1ur0 h HIS 110 N 8.45 0.00 -6.38 0.36 3.86 -1.68 -1.50 115.15 118.26 1ur0 h HIS 110 Ca -0.24 0.00 -0.48 0.00 -1.16 0.00 0.00 60.37 58.49 1ur0 h HIS 110 Cb 1.09 0.00 -0.02 0.00 1.06 0.00 0.00 27.41 29.54 1ur0 h HIS 110 CO 0.80 0.00 -0.87 0.66 0.86 0.00 0.00 177.93 179.37 1ur0 n TYR 111 N -2.84 -1.72 -3.65 2.45 4.01 -1.26 -4.62 117.16 109.53 1ur0 n TYR 111 Ca 0.04 0.77 -0.07 0.00 -0.16 0.00 0.00 57.90 58.48 1ur0 n TYR 111 Cb 0.50 -3.92 -0.02 0.00 -0.31 0.00 0.00 39.34 35.60 1ur0 n TYR 111 CO 0.00 0.00 0.00 0.45 -0.46 0.00 0.00 176.86 176.85 1ur0 s SER 112 N -4.36 -0.33 0.12 7.72 0.15 -1.26 -3.90 113.70 111.84 1ur0 s SER 112 Ca 0.01 -0.27 0.25 0.00 0.70 0.00 0.00 55.95 56.63 1ur0 s SER 112 Cb -0.00 0.55 0.45 0.00 -1.71 0.00 0.00 66.02 65.31 1ur0 s SER 112 CO 0.87 -0.97 1.42 0.47 1.20 0.00 0.00 173.24 176.23 1ur0 n ASP 113 N -0.40 0.69 -1.99 5.45 8.00 -1.26 -1.76 116.55 125.29 1ur0 n ASP 113 Ca -0.09 0.18 -0.07 0.00 0.71 0.00 0.00 54.79 55.52 1ur0 n ASP 113 Cb 0.61 -0.01 -0.02 0.00 -0.02 0.00 0.00 41.12 41.69 1ur0 n ASP 113 CO 0.00 0.00 0.00 0.33 -0.39 0.00 0.00 177.20 177.14 1ur0 n PHE 114 N -2.08 -0.89 -1.00 1.24 7.35 -1.26 -3.49 117.46 117.33 1ur0 n PHE 114 Ca 0.04 -1.17 -0.39 0.00 -0.76 0.00 0.00 57.45 55.17 1ur0 n PHE 114 Cb 0.43 0.26 -0.05 0.00 0.35 0.00 0.00 39.48 40.47 1ur0 n PHE 114 CO 0.00 0.00 0.00 0.91 -0.76 0.00 0.00 176.76 176.91 1ur0 n TRP 115 N -0.29 0.60 -4.08 -5.13 7.02 -1.26 -4.93 117.44 109.37 1ur0 n TRP 115 Ca 0.01 0.69 -0.33 0.00 -1.02 0.00 0.00 57.50 56.85 1ur0 n TRP 115 Cb 0.29 -1.35 -0.15 0.00 -2.42 0.00 0.00 31.31 27.67 1ur0 n TRP 115 CO 0.00 0.00 0.00 0.00 -2.02 0.00 0.00 177.69 175.67 1ur0 s ALA 116 N 0.51 2.47 0.00 6.99 0.00 -1.26 -4.66 121.76 125.81 1ur0 s ALA 116 Ca 0.60 -1.42 0.00 0.00 0.00 0.00 0.00 51.96 51.14 1ur0 s ALA 116 Cb -0.85 -1.39 0.00 0.00 0.00 0.00 0.00 23.12 20.88 1ur0 s ALA 116 CO 0.40 -0.68 0.00 -0.40 0.00 0.00 0.00 175.76 175.08 1ur0 n ASP 117 N 4.57 0.00 0.28 0.00 5.68 0.17 -4.57 116.55 122.68 1ur0 n ASP 117 Ca -0.18 -0.09 0.13 0.00 -0.50 0.00 0.00 54.79 54.14 1ur0 n ASP 117 Cb 0.47 0.00 0.81 0.00 -1.14 0.00 0.00 41.12 41.26 1ur0 n ASP 117 CO 0.00 0.00 0.00 -0.65 -1.33 0.00 0.00 177.20 175.22 1ur0 h PRO 118 N 0.00 0.00 0.00 0.11 0.11 -1.87 -2.97 132.00 127.38 1ur0 h PRO 118 Ca 0.00 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.11 1ur0 h PRO 118 Cb 0.00 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.11 1ur0 h PRO 118 CO 0.00 0.02 -0.95 0.00 -0.21 0.00 0.00 178.00 176.86 1ur0 n ALA 119 N -2.38 3.36 -3.90 -0.75 0.00 -1.26 -4.57 120.51 111.00 1ur0 n ALA 119 Ca -0.03 -0.36 -0.28 0.00 0.00 0.00 0.00 53.44 52.76 1ur0 n ALA 119 Cb 0.10 -0.48 -0.16 0.00 0.00 0.00 0.00 19.45 18.91 1ur0 n ALA 119 CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 177.50 177.65 1ur0 s LYS 120 N -2.49 1.52 -0.37 0.00 1.02 -1.12 -4.96 119.74 113.34 1ur0 s LYS 120 Ca 0.02 -0.51 0.12 0.00 0.02 0.00 0.00 55.97 55.62 1ur0 s LYS 120 Cb 0.10 -1.99 0.39 0.00 -0.52 0.00 0.00 37.83 35.80 1ur0 s LYS 120 CO 0.56 -0.41 0.96 1.04 -0.92 0.00 0.00 175.35 176.58 1ur0 n GLN 121 N 4.86 1.07 -2.53 1.68 1.13 -1.26 0.44 117.38 122.77 1ur0 n GLN 121 Ca -0.12 -2.86 -0.39 0.00 -1.94 0.00 0.00 57.00 51.69 1ur0 n GLN 121 Cb 0.48 -1.19 -0.04 0.00 0.11 0.00 0.00 30.24 29.59 1ur0 n GLN 121 CO 0.00 0.00 0.00 0.21 -1.44 0.00 0.00 177.06 175.83 1ur0 s LYS 122 N -1.81 4.50 0.61 -1.09 2.20 -1.26 -0.80 119.74 122.09 1ur0 s LYS 122 Ca 0.30 1.67 -0.17 0.00 -0.36 0.00 0.00 55.97 57.40 1ur0 s LYS 122 Cb 0.38 -2.97 -0.02 0.00 -1.51 0.00 0.00 37.83 33.71 1ur0 s LYS 122 CO -0.04 0.12 1.16 0.00 -0.36 0.00 0.00 175.35 176.23 1ur0 s ALA 123 N -1.34 2.52 0.61 3.13 0.00 -1.26 -4.36 121.76 121.06 1ur0 s ALA 123 Ca 0.49 0.81 -0.19 0.00 0.00 0.00 0.00 51.96 53.07 1ur0 s ALA 123 Cb -0.28 -3.39 -0.03 0.00 0.00 0.00 0.00 23.12 19.42 1ur0 s ALA 123 CO 0.35 -1.15 1.23 -2.14 0.00 0.00 0.00 175.76 174.05 1ur0 s PRO 124 N -3.59 2.86 0.34 0.00 0.02 -1.26 -4.53 135.00 128.84 1ur0 s PRO 124 Ca 0.73 1.89 0.08 0.00 0.02 0.00 0.00 61.00 63.72 1ur0 s PRO 124 Cb -0.25 -1.91 0.79 0.00 0.02 0.00 0.00 34.50 33.15 1ur0 s PRO 124 CO 0.35 -1.31 1.85 0.87 -0.33 0.00 0.00 177.00 178.43 1ur0 h LYS 125 N 0.80 0.70 0.00 5.54 1.57 -1.92 0.14 116.57 123.40 1ur0 h LYS 125 Ca -0.51 -0.04 -0.01 0.00 -1.87 0.00 0.00 60.65 58.22 1ur0 h LYS 125 Cb 1.31 -0.16 -0.00 0.00 0.08 0.00 0.00 32.23 33.46 1ur0 h LYS 125 CO 0.55 0.46 -0.04 0.00 -0.57 0.00 0.00 179.45 179.85 1ur0 h ALA 126 N 1.60 1.11 -0.01 3.86 0.00 -1.98 -1.58 119.26 122.26 1ur0 h ALA 126 Ca 0.48 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 55.36 1ur0 h ALA 126 Cb 0.77 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.55 1ur0 h ALA 126 CO -0.24 0.05 -0.45 0.91 0.00 0.00 0.00 179.25 179.52 1ur0 n TRP 127 N -3.29 0.00 -0.17 0.00 8.01 -0.07 -4.72 117.44 117.19 1ur0 n TRP 127 Ca -0.02 0.00 0.00 0.00 -1.31 0.00 0.00 57.50 56.18 1ur0 n TRP 127 Cb 0.19 0.00 0.03 0.00 -2.01 0.00 0.00 31.31 29.52 1ur0 n TRP 127 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.69 176.68 1ur0 n ALA 128 N -0.32 -0.02 -3.23 6.99 0.00 -0.55 -1.83 120.51 121.55 1ur0 n ALA 128 Ca 0.07 0.46 -0.25 0.00 0.00 0.00 0.00 53.44 53.72 1ur0 n ALA 128 Cb 0.36 -0.22 -0.06 0.00 0.00 0.00 0.00 19.45 19.52 1ur0 n ALA 128 CO 0.00 0.00 0.00 0.27 0.00 0.00 0.00 177.50 177.77 1ur0 n ASN 129 N -4.68 2.32 -4.44 0.00 6.94 -1.26 -5.05 115.26 109.09 1ur0 n ASN 129 Ca 0.05 -3.18 -0.30 0.00 -0.02 0.00 0.00 54.58 51.12 1ur0 n ASN 129 Cb 0.19 -0.63 -0.13 0.00 -2.36 0.00 0.00 39.78 36.85 1ur0 n ASN 129 CO 0.00 0.00 0.00 -0.76 -1.03 0.00 0.00 177.26 175.47 1ur0 s LEU 130 N -2.23 2.53 0.66 -4.53 1.43 -0.76 -5.11 118.68 110.66 1ur0 s LEU 130 Ca 0.40 -0.49 -0.15 0.00 -1.03 0.00 0.00 54.13 52.86 1ur0 s LEU 130 Cb 0.21 -1.46 0.00 0.00 0.03 0.00 0.00 46.19 44.96 1ur0 s LEU 130 CO -0.07 0.24 1.12 0.54 0.23 0.00 0.00 176.35 178.41 1ur0 s ASN 131 N -1.53 5.03 0.23 2.29 4.22 -1.26 -4.72 114.94 119.21 1ur0 s ASN 131 Ca 0.15 2.06 -0.09 0.00 -2.14 0.00 0.00 52.86 52.83 1ur0 s ASN 131 Cb -0.10 -2.56 0.37 0.00 1.28 0.00 0.00 41.25 40.24 1ur0 s ASN 131 CO 0.05 -1.68 1.63 0.15 -2.04 0.00 0.00 177.10 175.21 1ur0 h PHE 132 N 0.07 -0.13 -0.63 1.54 3.57 -1.99 -0.71 116.94 118.66 1ur0 h PHE 132 Ca -0.47 0.06 0.09 0.00 3.53 0.00 0.00 57.97 61.17 1ur0 h PHE 132 Cb 1.25 0.17 -0.07 0.00 2.79 0.00 0.00 35.95 40.10 1ur0 h PHE 132 CO 0.53 -0.25 0.28 0.93 -2.23 0.00 0.00 178.31 177.58 1ur0 h GLU 133 N 0.08 0.48 -0.14 1.11 4.39 -2.00 0.12 114.58 118.62 1ur0 h GLU 133 Ca 0.38 -0.03 -0.15 0.00 0.34 0.00 0.00 59.36 59.90 1ur0 h GLU 133 Cb 0.64 -0.11 -0.01 0.00 -0.10 0.00 0.00 28.75 29.17 1ur0 h GLU 133 CO -0.66 0.32 -0.54 -0.44 -1.16 0.00 0.00 179.01 176.53 1ur0 h ASP 134 N 0.50 0.45 -0.19 1.42 5.19 -1.59 -2.59 116.42 119.61 1ur0 h ASP 134 Ca 0.31 -0.24 -0.04 0.00 -0.62 0.00 0.00 57.03 56.45 1ur0 h ASP 134 Cb 0.34 -0.13 -0.01 0.00 0.18 0.00 0.00 39.33 39.71 1ur0 h ASP 134 CO -0.27 0.90 -0.02 0.50 -3.12 0.00 0.00 179.24 177.23 1ur0 h LYS 135 N 0.32 0.35 -0.54 3.56 3.64 -0.52 -0.02 116.57 123.37 1ur0 h LYS 135 Ca 0.01 -0.12 0.07 0.00 -1.27 0.00 0.00 60.65 59.34 1ur0 h LYS 135 Cb 1.04 -0.03 -0.06 0.00 -0.41 0.00 0.00 32.23 32.78 1ur0 h LYS 135 CO 0.09 0.58 0.21 -0.22 -2.27 0.00 0.00 179.45 177.84 1ur0 h LYS 136 N 0.09 0.39 0.00 1.90 3.64 -0.74 0.38 116.57 122.23 1ur0 h LYS 136 Ca 0.05 -0.02 -0.07 0.00 -1.27 0.00 0.00 60.65 59.34 1ur0 h LYS 136 Cb 0.44 -0.09 -0.01 0.00 -0.41 0.00 0.00 32.23 32.16 1ur0 h LYS 136 CO 0.01 0.26 -0.34 0.00 -2.27 0.00 0.00 179.45 177.11 1ur0 h THR 137 N 0.40 0.82 -0.09 1.00 1.03 -1.36 -2.06 112.91 112.65 1ur0 h THR 137 Ca 0.26 -1.44 -0.03 0.00 -0.01 0.00 0.00 66.41 65.19 1ur0 h THR 137 Cb 0.28 1.90 -0.00 0.00 -1.07 0.00 0.00 68.15 69.25 1ur0 h THR 137 CO -0.25 0.34 -0.05 0.00 -0.01 0.00 0.00 175.52 175.54 1ur0 h ALA 138 N 1.66 0.13 -0.51 0.00 0.00 0.99 -0.47 119.26 121.06 1ur0 h ALA 138 Ca -0.00 -0.25 0.05 0.00 0.00 0.00 0.00 54.91 54.70 1ur0 h ALA 138 Cb 0.87 -0.03 -0.05 0.00 0.00 0.00 0.00 17.79 18.58 1ur0 h ALA 138 CO 0.04 -0.10 0.25 1.25 0.00 0.00 0.00 179.25 180.69 1ur0 h LEU 139 N -0.18 0.34 -0.60 0.00 6.46 -0.16 0.17 115.31 121.34 1ur0 h LEU 139 Ca 0.02 0.03 -0.06 0.00 -0.12 0.00 0.00 57.88 57.75 1ur0 h LEU 139 Cb 0.51 -0.03 -0.02 0.00 -0.73 0.00 0.00 40.66 40.39 1ur0 h LEU 139 CO 0.01 0.24 0.12 0.22 -0.62 0.00 0.00 178.44 178.41 1ur0 h TYR 140 N 0.48 1.03 -0.35 1.25 5.03 -1.33 -1.65 116.97 121.42 1ur0 h TYR 140 Ca 0.23 -0.13 -0.02 0.00 2.58 0.00 0.00 58.73 61.39 1ur0 h TYR 140 Cb 0.15 -0.29 -0.02 0.00 1.55 0.00 0.00 36.73 38.13 1ur0 h TYR 140 CO -0.11 0.88 0.14 0.37 -1.32 0.00 0.00 178.16 178.12 1ur0 h GLN 141 N 0.88 0.52 -0.05 1.82 5.75 -0.39 -0.40 115.11 123.22 1ur0 h GLN 141 Ca 0.18 -0.09 0.01 0.00 -0.15 0.00 0.00 58.65 58.60 1ur0 h GLN 141 Cb 0.38 -0.08 -0.01 0.00 1.07 0.00 0.00 27.48 28.84 1ur0 h GLN 141 CO 0.01 0.50 -0.01 -0.92 -2.65 0.00 0.00 178.83 175.76 1ur0 h TYR 142 N 0.41 -0.03 -0.20 3.99 3.20 -0.56 0.79 116.97 124.57 1ur0 h TYR 142 Ca 0.12 0.00 0.02 0.00 3.14 0.00 0.00 58.73 62.01 1ur0 h TYR 142 Cb 0.18 0.02 -0.02 0.00 1.54 0.00 0.00 36.73 38.45 1ur0 h TYR 142 CO -0.00 -0.02 0.06 1.15 -1.64 0.00 0.00 178.16 177.70 1ur0 h THR 143 N -0.00 0.94 -0.02 1.81 2.02 -1.17 0.16 112.91 116.64 1ur0 h THR 143 Ca 0.03 -0.05 0.03 0.00 0.77 0.00 0.00 66.41 67.18 1ur0 h THR 143 Cb 0.04 0.77 -0.03 0.00 -1.74 0.00 0.00 68.15 67.19 1ur0 h THR 143 CO -0.06 0.03 -0.16 0.50 0.37 0.00 0.00 175.52 176.21 1ur0 h LYS 144 N 0.16 -0.24 -0.47 6.66 1.63 -0.74 -0.40 116.57 123.17 1ur0 h LYS 144 Ca 0.09 0.02 -0.06 0.00 -0.85 0.00 0.00 60.65 59.84 1ur0 h LYS 144 Cb 0.06 0.05 -0.02 0.00 -0.60 0.00 0.00 32.23 31.73 1ur0 h LYS 144 CO -0.10 -0.16 0.05 1.96 -3.45 0.00 0.00 179.45 177.75 1ur0 h GLN 145 N -0.25 0.80 -0.60 1.90 1.08 -0.62 -1.90 115.11 115.51 1ur0 h GLN 145 Ca 0.06 -0.23 0.02 0.00 -1.45 0.00 0.00 58.65 57.06 1ur0 h GLN 145 Cb 0.33 -0.09 -0.04 0.00 -0.05 0.00 0.00 27.48 27.63 1ur0 h GLN 145 CO -0.17 0.82 0.37 0.77 -0.95 0.00 0.00 178.83 179.67 1ur0 h SER 146 N 0.66 0.61 -0.43 1.46 0.02 -0.42 0.14 113.55 115.58 1ur0 h SER 146 Ca 0.14 0.00 -0.04 0.00 -0.84 0.00 0.00 61.79 61.05 1ur0 h SER 146 Cb 0.43 -0.13 -0.02 0.00 0.14 0.00 0.00 62.40 62.82 1ur0 h SER 146 CO 0.01 0.43 0.10 -0.07 -1.14 0.00 0.00 176.83 176.16 1ur0 h LEU 147 N 0.73 0.66 -0.88 5.07 4.07 -0.99 -2.16 115.31 121.81 1ur0 h LEU 147 Ca 0.24 -0.24 0.05 0.00 0.08 0.00 0.00 57.88 58.01 1ur0 h LEU 147 Cb 0.01 -0.17 -0.06 0.00 1.08 0.00 0.00 40.66 41.52 1ur0 h LEU 147 CO -0.10 0.73 0.56 0.50 -1.08 0.00 0.00 178.44 179.05 1ur0 h LYS 148 N 0.56 1.03 -0.41 1.13 3.64 -0.77 0.88 116.57 122.63 1ur0 h LYS 148 Ca 0.13 -0.06 -0.02 0.00 -1.27 0.00 0.00 60.65 59.43 1ur0 h LYS 148 Cb 0.33 -0.23 -0.02 0.00 -0.41 0.00 0.00 32.23 31.90 1ur0 h LYS 148 CO 0.00 0.68 0.17 0.00 -2.27 0.00 0.00 179.45 178.04 1ur0 h ALA 149 N 1.39 0.53 -0.33 5.00 0.00 -0.78 -1.67 119.26 123.40 1ur0 h ALA 149 Ca 0.37 -0.13 -0.00 0.00 0.00 0.00 0.00 54.91 55.14 1ur0 h ALA 149 Cb 0.08 -0.16 -0.02 0.00 0.00 0.00 0.00 17.79 17.70 1ur0 h ALA 149 CO -0.14 0.12 0.20 0.52 0.00 0.00 0.00 179.25 179.95 1ur0 h MET 150 N 0.52 0.45 -0.44 0.00 2.86 -0.65 -2.58 114.93 115.09 1ur0 h MET 150 Ca 0.14 -0.04 0.07 0.00 -2.06 0.00 0.00 59.70 57.80 1ur0 h MET 150 Cb 0.17 -0.10 -0.06 0.00 0.06 0.00 0.00 31.60 31.67 1ur0 h MET 150 CO -0.01 0.34 0.11 0.87 1.06 0.00 0.00 176.91 179.28 1ur0 h LYS 151 N 0.43 0.24 -0.87 1.72 1.79 -0.64 -1.71 116.57 117.54 1ur0 h LYS 151 Ca 0.12 -0.01 0.08 0.00 -2.18 0.00 0.00 60.65 58.66 1ur0 h LYS 151 Cb 0.00 -0.05 -0.06 0.00 -1.58 0.00 0.00 32.23 30.54 1ur0 h LYS 151 CO -0.02 0.16 0.56 0.00 -1.08 0.00 0.00 179.45 179.07 1ur0 h ALA 152 N 1.32 1.62 0.00 3.86 0.00 -1.04 0.19 119.26 125.20 1ur0 h ALA 152 Ca 0.21 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.11 1ur0 h ALA 152 Cb 0.25 -0.22 0.00 0.00 0.00 0.00 0.00 17.79 17.82 1ur0 h ALA 152 CO -0.26 0.22 0.00 0.00 0.00 0.00 0.00 179.25 179.21 1ur0 n ALA 153 N -2.41 2.28 -1.07 0.00 0.00 -0.67 -4.84 120.51 113.79 1ur0 n ALA 153 Ca 0.14 -0.09 -0.03 0.00 0.00 0.00 0.00 53.44 53.46 1ur0 n ALA 153 Cb 0.27 -1.24 -0.01 0.00 0.00 0.00 0.00 19.45 18.47 1ur0 n ALA 153 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1ur0 n GLY 154 N 0.32 0.56 3.74 0.00 0.00 0.65 -4.88 105.19 105.59 1ur0 n GLY 154 Ca 0.11 -0.33 -0.41 0.00 0.00 0.00 0.00 46.02 45.39 1ur0 n GLY 154 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1ur0 s ILE 155 N -1.93 3.14 -0.90 -0.61 1.01 -1.01 -4.96 121.20 115.95 1ur0 s ILE 155 Ca 0.00 0.98 -0.20 0.00 0.00 0.00 0.00 60.65 61.43 1ur0 s ILE 155 Cb 0.00 -3.63 0.12 0.00 0.01 0.00 0.00 42.46 38.96 1ur0 s ILE 155 CO 0.00 0.17 1.13 -0.62 0.00 0.00 0.00 174.94 175.61 1ur0 s ASP 156 N 0.12 6.55 -0.25 3.58 2.15 -1.26 -4.61 116.67 122.95 1ur0 s ASP 156 Ca 0.55 -1.84 -0.26 0.00 0.43 0.00 0.00 52.55 51.43 1ur0 s ASP 156 Cb -0.37 -2.42 0.00 0.00 -0.30 0.00 0.00 42.92 39.84 1ur0 s ASP 156 CO 0.41 -1.16 0.90 -0.63 -0.17 0.00 0.00 175.17 174.53 1ur0 s ILE 157 N 3.08 4.77 -0.14 4.11 1.01 -1.26 -1.40 121.20 131.35 1ur0 s ILE 157 Ca 0.32 1.69 0.18 0.00 0.00 0.00 0.00 60.65 62.84 1ur0 s ILE 157 Cb -0.06 -4.20 -0.25 0.00 0.01 0.00 0.00 42.46 37.96 1ur0 s ILE 157 CO -0.07 -0.14 0.16 0.61 0.00 0.00 0.00 174.94 175.50 1ur0 n GLY 158 N 3.66 -0.93 3.32 6.18 0.00 -0.40 -4.73 105.19 112.29 1ur0 n GLY 158 Ca 0.08 -0.36 -0.13 0.00 0.00 0.00 0.00 46.02 45.61 1ur0 n GLY 158 CO 0.00 0.00 0.00 -0.29 0.00 0.00 0.00 173.32 173.03 1ur0 s MET 159 N -2.70 0.90 -0.03 1.61 -2.45 -0.81 -1.95 119.30 113.87 1ur0 s MET 159 Ca -0.09 -0.34 0.02 0.00 -1.25 0.00 0.00 55.69 54.03 1ur0 s MET 159 Cb 0.07 0.40 0.01 0.00 1.25 0.00 0.00 34.83 36.56 1ur0 s MET 159 CO 0.79 -0.30 -0.08 0.08 1.05 0.00 0.00 175.02 176.56 1ur0 s VAL 160 N -2.36 0.70 -0.32 10.11 1.01 0.06 -1.26 120.40 128.33 1ur0 s VAL 160 Ca -0.06 -0.30 -0.10 0.00 0.00 0.00 0.00 61.98 61.52 1ur0 s VAL 160 Cb -0.01 -0.64 -0.01 0.00 0.00 0.00 0.00 36.38 35.72 1ur0 s VAL 160 CO -0.02 0.23 0.16 -1.58 0.00 0.00 0.00 175.10 173.90 1ur0 s GLN 161 N 0.32 3.34 -1.07 2.72 0.74 0.15 -0.09 119.66 125.77 1ur0 s GLN 161 Ca -0.05 -0.72 -0.15 0.00 0.05 0.00 0.00 55.36 54.50 1ur0 s GLN 161 Cb -0.09 -3.60 0.18 0.00 1.10 0.00 0.00 33.01 30.60 1ur0 s GLN 161 CO 0.00 -0.43 1.22 0.08 -0.55 0.00 0.00 175.29 175.62 1ur0 s VAL 162 N 1.62 5.16 0.00 1.34 1.01 0.11 -1.78 120.40 127.87 1ur0 s VAL 162 Ca 0.05 -2.43 0.00 0.00 0.00 0.00 0.00 61.98 59.59 1ur0 s VAL 162 Cb -0.17 -4.78 0.00 0.00 0.00 0.00 0.00 36.38 31.43 1ur0 s VAL 162 CO 0.07 -1.45 0.00 0.61 0.00 0.00 0.00 175.10 174.32 1ur0 n GLY 163 N 4.28 2.62 2.81 4.51 0.00 -0.56 -4.66 105.19 114.18 1ur0 n GLY 163 Ca 0.28 -1.93 -0.26 0.00 0.00 0.00 0.00 46.02 44.12 1ur0 n GLY 163 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 1ur0 s ASN 164 N 0.00 2.24 -1.41 1.61 2.47 -1.25 -4.30 114.94 114.30 1ur0 s ASN 164 Ca 0.00 -0.41 -0.01 0.00 0.42 0.00 0.00 52.86 52.86 1ur0 s ASN 164 Cb 0.00 -0.64 0.00 0.00 -1.45 0.00 0.00 41.25 39.16 1ur0 s ASN 164 CO 0.00 -0.21 0.39 -0.62 -3.72 0.00 0.00 177.10 172.94 1ur0 n GLU 165 N 5.04 -2.97 -1.37 0.43 1.02 -0.34 -4.14 120.64 118.30 1ur0 n GLU 165 Ca -0.09 0.37 -0.39 0.00 -0.02 0.00 0.00 57.16 57.03 1ur0 n GLU 165 Cb 0.49 -4.40 -0.03 0.00 -0.02 0.00 0.00 31.44 27.48 1ur0 n GLU 165 CO 0.00 0.00 0.00 0.25 1.18 0.00 0.00 177.13 178.56 1ur0 n THR 166 N -4.42 4.40 0.14 2.62 -2.24 -0.69 -3.61 114.28 110.48 1ur0 n THR 166 Ca -0.31 -2.73 0.01 0.00 -2.27 0.00 0.00 64.05 58.76 1ur0 n THR 166 Cb 0.68 -2.56 0.32 0.00 -2.10 0.00 0.00 70.33 66.68 1ur0 n THR 166 CO 0.00 0.00 0.00 0.78 -0.57 0.00 0.00 175.07 175.28 1ur0 h ASN 167 N 4.93 0.12 0.00 3.42 4.21 -1.85 -3.36 115.58 123.06 1ur0 h ASN 167 Ca 0.85 -0.04 0.00 0.00 1.21 0.00 0.00 56.30 58.32 1ur0 h ASN 167 Cb 0.30 -0.03 0.00 0.00 -1.12 0.00 0.00 38.32 37.47 1ur0 h ASN 167 CO 1.74 0.46 -0.28 0.61 -1.29 0.00 0.00 177.43 178.66 1ur0 n GLY 168 N -0.46 -0.69 0.00 2.83 0.00 -1.26 -5.10 105.19 100.52 1ur0 n GLY 168 Ca -0.02 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.00 1ur0 n GLY 168 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1ur0 n GLY 169 N 0.00 0.43 3.55 -0.02 0.00 -1.26 -4.61 105.19 103.28 1ur0 n GLY 169 Ca 0.00 -0.85 -0.01 0.00 0.00 0.00 0.00 46.02 45.16 1ur0 n GLY 169 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 1ur0 s LEU 170 N 0.00 -0.78 -1.53 0.99 2.96 -0.34 -4.51 118.68 115.47 1ur0 s LEU 170 Ca 0.00 1.12 -0.11 0.00 -0.22 0.00 0.00 54.13 54.92 1ur0 s LEU 170 Cb 0.00 1.96 0.08 0.00 0.50 0.00 0.00 46.19 48.73 1ur0 s LEU 170 CO 0.00 -0.16 0.80 0.00 -1.32 0.00 0.00 176.35 175.67 1ur0 n ALA 171 N 4.80 -1.50 -0.58 5.97 0.00 -1.24 -1.10 120.51 126.87 1ur0 n ALA 171 Ca -0.13 0.01 0.00 0.00 0.00 0.00 0.00 53.44 53.32 1ur0 n ALA 171 Cb 0.53 -3.38 0.00 0.00 0.00 0.00 0.00 19.45 16.61 1ur0 n ALA 171 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1ur0 n GLY 172 N -1.65 1.24 3.79 0.00 0.00 0.02 -4.26 105.19 104.33 1ur0 n GLY 172 Ca -0.05 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.63 1ur0 n GLY 172 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1ur0 s GLU 173 N -0.23 3.11 0.00 1.61 8.01 -0.26 -4.91 118.70 126.03 1ur0 s GLU 173 Ca 0.00 -0.45 0.00 0.00 0.01 0.00 0.00 54.97 54.53 1ur0 s GLU 173 Cb 0.00 -2.89 0.00 0.00 -4.31 0.00 0.00 34.13 26.93 1ur0 s GLU 173 CO 0.00 0.66 0.04 0.25 0.01 0.00 0.00 175.26 176.21 1ur0 n THR 174 N 1.25 0.00 -2.82 3.63 -2.24 -1.26 -1.20 114.28 111.65 1ur0 n THR 174 Ca -0.13 -0.35 -0.42 0.00 -2.27 0.00 0.00 64.05 60.87 1ur0 n THR 174 Cb 0.53 1.03 -0.03 0.00 -2.10 0.00 0.00 70.33 69.75 1ur0 n THR 174 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 1ur0 s ASP 175 N -0.64 7.01 0.55 3.42 2.15 -1.26 -4.80 116.67 123.11 1ur0 s ASP 175 Ca 0.00 1.25 0.23 0.00 0.43 0.00 0.00 52.55 54.46 1ur0 s ASP 175 Cb 0.00 -2.48 1.52 0.00 -0.30 0.00 0.00 42.92 41.66 1ur0 s ASP 175 CO 0.00 -0.47 2.17 -0.50 -0.17 0.00 0.00 175.17 176.20 1ur0 h TRP 176 N 7.36 0.00 -0.44 -5.34 4.06 -1.96 0.76 115.95 120.39 1ur0 h TRP 176 Ca -0.27 0.00 -0.08 0.00 2.06 0.00 0.00 58.89 60.60 1ur0 h TRP 176 Cb 1.12 0.00 -0.02 0.00 -1.00 0.00 0.00 29.16 29.26 1ur0 h TRP 176 CO 0.73 0.00 -0.03 0.00 -3.56 0.00 0.00 178.44 175.58 1ur0 h ALA 177 N 1.95 0.59 -0.13 1.49 0.00 -1.99 0.28 119.26 121.45 1ur0 h ALA 177 Ca 0.03 -0.29 -0.18 0.00 0.00 0.00 0.00 54.91 54.48 1ur0 h ALA 177 Cb 0.15 -0.16 -0.00 0.00 0.00 0.00 0.00 17.79 17.78 1ur0 h ALA 177 CO -0.00 0.41 -0.67 0.87 0.00 0.00 0.00 179.25 179.87 1ur0 h LYS 178 N 0.63 0.50 -0.54 0.00 1.57 -1.59 -2.83 116.57 114.30 1ur0 h LYS 178 Ca 0.12 -0.37 -0.02 0.00 -1.87 0.00 0.00 60.65 58.51 1ur0 h LYS 178 Cb 0.54 0.07 -0.02 0.00 0.08 0.00 0.00 32.23 32.89 1ur0 h LYS 178 CO 0.03 0.99 0.26 0.52 -0.57 0.00 0.00 179.45 180.68 1ur0 h MET 179 N 0.36 0.78 -0.70 3.15 2.86 -0.65 -1.10 114.93 119.62 1ur0 h MET 179 Ca -0.02 -0.11 0.02 0.00 -2.06 0.00 0.00 59.70 57.53 1ur0 h MET 179 Cb 1.23 -0.14 -0.04 0.00 0.06 0.00 0.00 31.60 32.71 1ur0 h MET 179 CO 0.12 0.64 0.44 0.77 1.06 0.00 0.00 176.91 179.94 1ur0 h SER 180 N 0.73 0.74 -0.24 1.22 0.02 -0.91 0.47 113.55 115.58 1ur0 h SER 180 Ca 0.19 -0.01 -0.04 0.00 -0.84 0.00 0.00 61.79 61.09 1ur0 h SER 180 Cb 0.12 -0.17 -0.02 0.00 0.14 0.00 0.00 62.40 62.47 1ur0 h SER 180 CO -0.02 0.52 0.02 1.56 -1.14 0.00 0.00 176.83 177.77 1ur0 h GLN 181 N 0.88 0.52 -0.16 3.45 4.20 -1.19 0.26 115.11 123.07 1ur0 h GLN 181 Ca 0.27 -0.10 -0.14 0.00 0.06 0.00 0.00 58.65 58.74 1ur0 h GLN 181 Cb -0.02 -0.08 0.00 0.00 0.30 0.00 0.00 27.48 27.69 1ur0 h GLN 181 CO -0.09 0.53 -0.46 -0.07 -0.67 0.00 0.00 178.83 178.07 1ur0 h LEU 182 N 0.50 0.68 -0.41 1.46 3.38 0.07 0.73 115.31 121.72 1ur0 h LEU 182 Ca 0.11 -0.59 0.05 0.00 0.09 0.00 0.00 57.88 57.54 1ur0 h LEU 182 Cb 0.30 -0.20 -0.05 0.00 0.09 0.00 0.00 40.66 40.80 1ur0 h LEU 182 CO 0.01 1.15 0.15 -0.26 0.09 0.00 0.00 178.44 179.58 1ur0 h PHE 183 N 0.25 0.27 -0.56 1.13 0.04 0.42 0.04 116.94 118.52 1ur0 h PHE 183 Ca -0.01 0.02 -0.05 0.00 2.80 0.00 0.00 57.97 60.73 1ur0 h PHE 183 Cb 1.08 -0.06 -0.03 0.00 2.20 0.00 0.00 35.95 39.14 1ur0 h PHE 183 CO 0.10 0.10 0.16 -0.91 -0.60 0.00 0.00 178.31 177.16 1ur0 h ASN 184 N 0.32 0.78 -0.20 2.17 2.35 -0.34 0.13 115.58 120.78 1ur0 h ASN 184 Ca 0.19 -0.13 -0.00 0.00 -0.55 0.00 0.00 56.30 55.81 1ur0 h ASN 184 Cb 0.17 -0.20 -0.01 0.00 0.05 0.00 0.00 38.32 38.33 1ur0 h ASN 184 CO -0.19 0.75 0.12 0.00 -1.65 0.00 0.00 177.43 176.46 1ur0 h ALA 185 N 1.36 0.25 -0.19 -0.83 0.00 0.17 0.16 119.26 120.18 1ur0 h ALA 185 Ca 0.18 -0.04 -0.01 0.00 0.00 0.00 0.00 54.91 55.05 1ur0 h ALA 185 Cb 0.26 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 17.96 1ur0 h ALA 185 CO -0.01 -0.24 0.09 0.78 0.00 0.00 0.00 179.25 179.88 1ur0 h GLY 186 N 0.24 0.29 0.62 0.00 0.00 -0.54 -2.81 103.07 100.87 1ur0 h GLY 186 Ca 0.07 -0.14 0.06 0.00 0.00 0.00 0.00 47.33 47.33 1ur0 h GLY 186 CO -0.01 0.13 0.30 0.23 0.00 0.00 0.00 176.54 177.18 1ur0 h SER 187 N 0.18 0.41 -0.63 0.19 0.87 -0.48 -2.17 113.55 111.92 1ur0 h SER 187 Ca 0.06 0.04 0.12 0.00 -1.23 0.00 0.00 61.79 60.79 1ur0 h SER 187 Cb 0.10 -0.03 -0.09 0.00 -0.44 0.00 0.00 62.40 61.94 1ur0 h SER 187 CO -0.01 0.26 0.13 -0.61 -0.53 0.00 0.00 176.83 176.08 1ur0 h GLN 188 N 0.55 0.25 -0.69 2.24 5.75 -0.47 -0.23 115.11 122.51 1ur0 h GLN 188 Ca 0.28 -0.02 -0.03 0.00 -0.15 0.00 0.00 58.65 58.73 1ur0 h GLN 188 Cb 0.22 -0.06 -0.03 0.00 1.07 0.00 0.00 27.48 28.68 1ur0 h GLN 188 CO -0.20 0.17 0.31 0.00 -2.65 0.00 0.00 178.83 176.45 1ur0 h ALA 189 N 1.51 1.24 0.20 3.38 0.00 -1.15 -1.45 119.26 122.98 1ur0 h ALA 189 Ca 0.33 -0.15 -0.01 0.00 0.00 0.00 0.00 54.91 55.08 1ur0 h ALA 189 Cb 0.51 -0.28 0.00 0.00 0.00 0.00 0.00 17.79 18.02 1ur0 h ALA 189 CO -0.43 0.57 -0.09 0.28 0.00 0.00 0.00 179.25 179.58 1ur0 h VAL 190 N 0.99 0.89 -1.01 0.00 2.07 -0.87 -2.04 116.25 116.30 1ur0 h VAL 190 Ca 0.24 -0.51 0.14 0.00 0.82 0.00 0.00 66.70 67.39 1ur0 h VAL 190 Cb 0.13 1.19 -0.09 0.00 -1.52 0.00 0.00 31.29 31.01 1ur0 h VAL 190 CO -0.03 0.11 0.63 0.03 0.02 0.00 0.00 177.57 178.34 1ur0 h ARG 191 N -0.51 0.90 0.00 1.57 -0.00 -0.87 0.10 114.38 115.57 1ur0 h ARG 191 Ca -0.03 -0.05 -0.05 0.00 -0.50 0.00 0.00 59.98 59.35 1ur0 h ARG 191 Cb 0.39 -0.20 -0.01 0.00 0.00 0.00 0.00 29.97 30.15 1ur0 h ARG 191 CO 0.04 0.60 -0.25 0.93 0.00 0.00 0.00 179.97 181.29 1ur0 h GLU 192 N 0.93 0.00 0.01 0.04 5.08 -1.18 -3.27 114.58 116.18 1ur0 h GLU 192 Ca 0.52 0.00 -0.01 0.00 -1.00 0.00 0.00 59.36 58.87 1ur0 h GLU 192 Cb 0.61 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.86 1ur0 h GLU 192 CO -0.30 0.25 -0.05 1.15 -1.00 0.00 0.00 179.01 179.07 1ur0 h THR 193 N 0.00 1.74 -1.83 1.13 2.02 -0.11 -3.48 112.91 112.39 1ur0 h THR 193 Ca -0.00 -2.24 0.07 0.00 0.77 0.00 0.00 66.41 65.00 1ur0 h THR 193 Cb 0.83 3.26 -0.22 0.00 -1.74 0.00 0.00 68.15 70.28 1ur0 h THR 193 CO 0.03 0.59 0.06 -0.62 0.37 0.00 0.00 175.52 175.95 1ur0 s ASP 194 N -6.21 -0.89 0.44 4.18 -1.08 -0.37 -5.04 116.67 107.70 1ur0 s ASP 194 Ca -0.18 1.35 0.18 0.00 -0.52 0.00 0.00 52.55 53.37 1ur0 s ASP 194 Cb -0.02 1.64 1.03 0.00 -1.46 0.00 0.00 42.92 44.10 1ur0 s ASP 194 CO 0.70 -0.20 1.96 0.28 0.52 0.00 0.00 175.17 178.42 1ur0 h SER 195 N 7.16 0.00 1.48 -0.34 0.02 -1.82 -2.81 113.55 117.23 1ur0 h SER 195 Ca -0.25 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.70 1ur0 h SER 195 Cb 1.18 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.72 1ur0 h SER 195 CO 0.14 0.23 0.00 0.78 -1.14 0.00 0.00 176.83 176.84 1ur0 h ASN 196 N 0.00 0.00 -2.90 3.07 2.35 -1.94 -3.44 115.58 112.71 1ur0 h ASN 196 Ca -0.00 0.00 -0.53 0.00 -0.55 0.00 0.00 56.30 55.21 1ur0 h ASN 196 Cb 0.45 0.00 0.02 0.00 0.05 0.00 0.00 38.32 38.83 1ur0 h ASN 196 CO 0.03 0.00 0.82 -0.63 -1.65 0.00 0.00 177.43 176.00 1ur0 s ILE 197 N -3.29 3.33 0.19 2.81 1.01 -1.06 -4.93 121.20 119.26 1ur0 s ILE 197 Ca 0.06 0.86 -0.29 0.00 0.00 0.00 0.00 60.65 61.29 1ur0 s ILE 197 Cb 0.08 -3.55 -0.08 0.00 0.01 0.00 0.00 42.46 38.92 1ur0 s ILE 197 CO 0.59 0.03 0.90 -0.76 0.00 0.00 0.00 174.94 175.70 1ur0 s LEU 198 N 1.80 4.60 -0.26 2.97 1.43 -0.82 -4.91 118.68 123.49 1ur0 s LEU 198 Ca 0.66 1.83 -0.10 0.00 -1.03 0.00 0.00 54.13 55.50 1ur0 s LEU 198 Cb -0.36 -3.52 -0.05 0.00 0.03 0.00 0.00 46.19 42.29 1ur0 s LEU 198 CO 0.29 0.12 0.15 -0.69 0.23 0.00 0.00 176.35 176.46 1ur0 s VAL 199 N -0.88 5.11 0.07 -1.59 1.01 -1.26 -0.76 120.40 122.10 1ur0 s VAL 199 Ca 0.41 0.10 0.10 0.00 0.00 0.00 0.00 61.98 62.58 1ur0 s VAL 199 Cb -0.25 -3.41 -0.03 0.00 0.00 0.00 0.00 36.38 32.69 1ur0 s VAL 199 CO 0.30 0.30 -0.25 0.00 0.00 0.00 0.00 175.10 175.45 1ur0 s ALA 200 N 1.47 2.35 -0.06 5.51 0.00 0.87 0.03 121.76 131.93 1ur0 s ALA 200 Ca 0.07 -1.33 0.04 0.00 0.00 0.00 0.00 51.96 50.74 1ur0 s ALA 200 Cb -0.15 -0.49 -0.02 0.00 0.00 0.00 0.00 23.12 22.46 1ur0 s ALA 200 CO 0.07 0.54 -0.17 -0.51 0.00 0.00 0.00 175.76 175.69 1ur0 s LEU 201 N -1.55 2.54 -0.20 0.00 1.43 -0.46 -0.71 118.68 119.72 1ur0 s LEU 201 Ca 0.13 -0.30 -0.00 0.00 -1.03 0.00 0.00 54.13 52.93 1ur0 s LEU 201 Cb -0.10 -1.50 0.02 0.00 0.03 0.00 0.00 46.19 44.63 1ur0 s LEU 201 CO 0.04 0.31 -0.14 -2.28 0.23 0.00 0.00 176.35 174.50 1ur0 s HIS 202 N -0.51 2.88 0.33 0.29 5.65 -1.26 0.03 115.29 122.70 1ur0 s HIS 202 Ca 0.07 -1.50 0.07 0.00 0.25 0.00 0.00 55.06 53.95 1ur0 s HIS 202 Cb -0.12 -1.98 -0.07 0.00 -1.18 0.00 0.00 32.58 29.24 1ur0 s HIS 202 CO 0.01 -0.74 -0.04 -0.06 -0.65 0.00 0.00 174.74 173.26 1ur0 s PHE 203 N 1.33 2.23 0.32 3.88 0.08 -0.37 -1.20 117.98 124.25 1ur0 s PHE 203 Ca 0.04 -0.65 0.07 0.00 0.12 0.00 0.00 56.93 56.50 1ur0 s PHE 203 Cb -0.14 -1.36 -0.03 0.00 -0.57 0.00 0.00 43.02 40.91 1ur0 s PHE 203 CO -0.09 0.39 0.26 -0.08 -0.10 0.00 0.00 175.22 175.60 1ur0 s THR 204 N -2.84 0.00 -0.84 0.64 -1.32 -1.26 -2.13 115.64 107.89 1ur0 s THR 204 Ca 0.33 -2.00 -0.04 0.00 -1.21 0.00 0.00 61.69 58.76 1ur0 s THR 204 Cb 0.05 -2.50 -0.05 0.00 -1.51 0.00 0.00 72.50 68.50 1ur0 s THR 204 CO 0.15 0.00 0.73 0.59 -2.21 0.00 0.00 174.62 173.88 1ur0 n ASN 205 N -1.43 -5.14 0.05 8.08 4.13 -1.26 -4.94 115.26 114.75 1ur0 n ASN 205 Ca 0.07 -0.54 0.08 0.00 1.68 0.00 0.00 54.58 55.87 1ur0 n ASN 205 Cb 0.63 -4.18 0.36 0.00 -1.54 0.00 0.00 39.78 35.05 1ur0 n ASN 205 CO 0.00 0.00 0.00 -0.81 0.28 0.00 0.00 177.26 176.73 1ur0 n PRO 206 N -2.93 0.07 0.09 3.52 -0.04 -1.26 -2.77 135.00 131.68 1ur0 n PRO 206 Ca -0.08 0.34 -0.05 0.00 -0.04 0.00 0.00 63.50 63.67 1ur0 n PRO 206 Cb 0.60 -1.64 0.09 0.00 -0.04 0.00 0.00 33.50 32.51 1ur0 n PRO 206 CO 0.00 0.00 0.00 1.05 -0.04 0.00 0.00 175.50 176.51 1ur0 h GLU 207 N 0.00 0.19 -6.12 0.54 -0.00 -1.91 -3.44 114.58 103.83 1ur0 h GLU 207 Ca 0.00 -0.15 -0.65 0.00 -0.00 0.00 0.00 59.36 58.56 1ur0 h GLU 207 Cb 0.27 0.03 0.00 0.00 -0.00 0.00 0.00 28.75 29.05 1ur0 h GLU 207 CO 0.00 0.80 1.22 2.41 -0.00 0.00 0.00 179.01 183.43 1ur0 n THR 208 N -3.80 0.37 -1.69 -1.06 -1.04 -1.11 -4.82 114.28 101.13 1ur0 n THR 208 Ca -0.02 -0.18 -0.50 0.00 -2.04 0.00 0.00 64.05 61.30 1ur0 n THR 208 Cb 0.67 -1.75 -0.05 0.00 -1.82 0.00 0.00 70.33 67.38 1ur0 n THR 208 CO 0.00 0.00 0.00 -0.24 -0.64 0.00 0.00 175.07 174.19 1ur0 n SER 209 N 8.05 3.23 0.00 8.00 2.88 -1.26 -2.32 113.62 132.20 1ur0 n SER 209 Ca 0.31 1.00 0.00 0.00 -1.33 0.00 0.00 58.87 58.84 1ur0 n SER 209 Cb 0.26 -1.33 0.00 0.00 -0.75 0.00 0.00 64.21 62.39 1ur0 n SER 209 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 1ur0 n GLY 210 N 4.33 2.99 0.19 0.46 0.00 -1.26 -4.93 105.19 106.96 1ur0 n GLY 210 Ca 0.23 0.00 -0.06 0.00 0.00 0.00 0.00 46.02 46.19 1ur0 n GLY 210 CO 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 173.32 173.23 1ur0 h ARG 211 N 1.34 -0.16 -0.98 1.61 2.43 -1.82 0.25 114.38 117.04 1ur0 h ARG 211 Ca 0.00 0.01 0.10 0.00 -0.81 0.00 0.00 59.98 59.28 1ur0 h ARG 211 Cb 0.00 0.04 -0.08 0.00 -0.42 0.00 0.00 29.97 29.51 1ur0 h ARG 211 CO 0.00 -0.11 0.62 1.88 -1.51 0.00 0.00 179.97 180.86 1ur0 h TYR 212 N -0.17 1.11 -0.58 2.20 -1.99 -1.89 0.19 116.97 115.84 1ur0 h TYR 212 Ca 0.03 0.03 -0.04 0.00 2.00 0.00 0.00 58.73 60.75 1ur0 h TYR 212 Cb 0.25 -0.36 -0.03 0.00 2.00 0.00 0.00 36.73 38.60 1ur0 h TYR 212 CO -0.64 0.49 0.22 0.00 -0.00 0.00 0.00 178.16 178.23 1ur0 h ALA 213 N 1.52 0.75 -0.56 3.88 0.00 -1.75 -0.35 119.26 122.76 1ur0 h ALA 213 Ca 0.46 -0.17 -0.11 0.00 0.00 0.00 0.00 54.91 55.09 1ur0 h ALA 213 Cb 0.40 -0.22 -0.02 0.00 0.00 0.00 0.00 17.79 17.94 1ur0 h ALA 213 CO -0.22 0.37 -0.08 2.35 0.00 0.00 0.00 179.25 181.67 1ur0 h TRP 214 N 0.80 1.15 -0.29 0.00 7.01 0.75 -2.60 115.95 122.76 1ur0 h TRP 214 Ca 0.19 -0.22 -0.07 0.00 2.11 0.00 0.00 58.89 60.89 1ur0 h TRP 214 Cb 0.21 -0.29 -0.01 0.00 -2.10 0.00 0.00 29.16 26.98 1ur0 h TRP 214 CO 0.01 1.05 -0.11 0.82 -2.79 0.00 0.00 178.44 177.42 1ur0 h ILE 215 N 0.93 1.29 -0.59 2.65 2.04 -0.36 -1.67 117.51 121.79 1ur0 h ILE 215 Ca 0.15 -1.18 -0.03 0.00 1.00 0.00 0.00 64.86 64.80 1ur0 h ILE 215 Cb 0.64 1.46 -0.03 0.00 -0.74 0.00 0.00 36.82 38.15 1ur0 h ILE 215 CO 0.04 0.37 0.26 0.00 0.00 0.00 0.00 178.15 178.82 1ur0 h ALA 216 N 0.76 1.35 -0.28 1.87 0.00 -1.04 0.19 119.26 122.10 1ur0 h ALA 216 Ca 0.07 -0.14 -0.06 0.00 0.00 0.00 0.00 54.91 54.78 1ur0 h ALA 216 Cb 0.61 -0.24 -0.01 0.00 0.00 0.00 0.00 17.79 18.15 1ur0 h ALA 216 CO 0.04 0.50 -0.04 1.49 0.00 0.00 0.00 179.25 181.23 1ur0 h GLU 217 N 0.84 0.52 -0.39 0.00 4.57 -1.37 -0.74 114.58 118.01 1ur0 h GLU 217 Ca 0.20 -0.19 0.00 0.00 -1.18 0.00 0.00 59.36 58.20 1ur0 h GLU 217 Cb 0.13 -0.04 -0.02 0.00 -0.16 0.00 0.00 28.75 28.66 1ur0 h GLU 217 CO -0.02 0.71 0.25 1.15 -1.18 0.00 0.00 179.01 179.91 1ur0 h THR 218 N 0.29 1.11 -0.93 0.32 2.02 -0.87 0.43 112.91 115.29 1ur0 h THR 218 Ca 0.07 -0.24 0.05 0.00 0.77 0.00 0.00 66.41 67.06 1ur0 h THR 218 Cb 0.50 0.57 -0.06 0.00 -1.74 0.00 0.00 68.15 67.43 1ur0 h THR 218 CO 0.02 0.11 0.61 -0.07 0.37 0.00 0.00 175.52 176.56 1ur0 h LEU 219 N 0.52 0.99 0.53 2.58 3.38 -0.85 -1.44 115.31 121.02 1ur0 h LEU 219 Ca 0.14 -0.00 -0.03 0.00 0.09 0.00 0.00 57.88 58.08 1ur0 h LEU 219 Cb -0.03 -0.22 0.01 0.00 0.09 0.00 0.00 40.66 40.51 1ur0 h LEU 219 CO -0.03 0.66 -0.25 -0.74 0.09 0.00 0.00 178.44 178.17 1ur0 h HIS 220 N 1.13 -0.66 -0.90 1.13 2.76 0.01 -1.56 115.15 117.07 1ur0 h HIS 220 Ca 0.38 -0.02 0.22 0.00 -2.20 0.00 0.00 60.37 58.76 1ur0 h HIS 220 Cb 0.07 0.22 -0.06 0.00 1.55 0.00 0.00 27.41 29.19 1ur0 h HIS 220 CO -0.00 -0.33 0.61 0.00 -1.30 0.00 0.00 177.93 176.90 1ur0 h ARG 221 N -0.93 0.25 -0.64 5.26 3.08 0.24 -0.34 114.38 121.30 1ur0 h ARG 221 Ca -0.07 -0.02 0.00 0.00 0.07 0.00 0.00 59.98 59.96 1ur0 h ARG 221 Cb 0.62 -0.06 0.00 0.00 0.08 0.00 0.00 29.97 30.61 1ur0 h ARG 221 CO 0.12 0.17 0.00 0.72 -1.07 0.00 0.00 179.97 179.91 1ur0 n HIS 222 N -4.44 1.50 -3.77 3.04 8.25 -0.58 -4.96 115.22 114.26 1ur0 n HIS 222 Ca 0.19 -0.56 -0.25 0.00 -0.26 0.00 0.00 57.72 56.84 1ur0 n HIS 222 Cb 0.79 -0.31 0.04 0.00 1.12 0.00 0.00 29.99 31.63 1ur0 n HIS 222 CO 0.00 0.00 0.00 0.72 0.64 0.00 0.00 176.34 177.70 1ur0 n HIS 223 N 0.79 -2.17 -2.69 4.41 8.25 -0.14 -4.89 115.22 118.78 1ur0 n HIS 223 Ca 0.23 0.89 -0.42 0.00 -0.26 0.00 0.00 57.72 58.15 1ur0 n HIS 223 Cb 0.90 -4.31 -0.03 0.00 1.12 0.00 0.00 29.99 27.67 1ur0 n HIS 223 CO 0.00 0.00 0.00 0.08 0.64 0.00 0.00 176.34 177.06 1ur0 s VAL 224 N -3.47 4.79 -0.70 1.59 1.01 -0.61 -4.98 120.40 118.03 1ur0 s VAL 224 Ca 0.33 2.05 -0.21 0.00 0.00 0.00 0.00 61.98 64.14 1ur0 s VAL 224 Cb -0.16 -4.31 0.09 0.00 0.00 0.00 0.00 36.38 31.99 1ur0 s VAL 224 CO 0.81 0.03 0.96 -0.62 0.00 0.00 0.00 175.10 176.28 1ur0 s ASP 225 N 1.09 6.26 0.06 3.32 2.15 -1.26 -4.90 116.67 123.39 1ur0 s ASP 225 Ca 0.49 -1.24 -0.05 0.00 0.43 0.00 0.00 52.55 52.18 1ur0 s ASP 225 Cb -0.19 -2.40 -0.02 0.00 -0.30 0.00 0.00 42.92 40.02 1ur0 s ASP 225 CO 0.19 -1.33 0.09 -0.72 -0.17 0.00 0.00 175.17 173.23 1ur0 s TYR 226 N 3.64 0.29 -0.14 -5.34 1.13 -1.26 -4.80 117.35 110.87 1ur0 s TYR 226 Ca 0.23 -0.74 0.07 0.00 -1.41 0.00 0.00 57.07 55.22 1ur0 s TYR 226 Cb -0.16 -0.19 -0.14 0.00 -1.10 0.00 0.00 41.96 40.37 1ur0 s TYR 226 CO 0.06 -0.45 -0.04 -0.25 -2.51 0.00 0.00 175.55 172.36 1ur0 n ASP 227 N 0.18 2.21 -4.34 -0.18 8.00 0.10 -4.98 116.55 117.54 1ur0 n ASP 227 Ca -0.16 -0.04 -0.33 0.00 0.71 0.00 0.00 54.79 54.98 1ur0 n ASP 227 Cb 0.61 0.34 -0.15 0.00 -0.02 0.00 0.00 41.12 41.90 1ur0 n ASP 227 CO 0.00 0.00 0.00 -0.69 -0.39 0.00 0.00 177.20 176.12 1ur0 s VAL 228 N -2.32 2.76 -0.59 2.53 1.01 -0.17 -0.49 120.40 123.13 1ur0 s VAL 228 Ca -0.13 -0.78 -0.15 0.00 0.00 0.00 0.00 61.98 60.92 1ur0 s VAL 228 Cb 0.05 -2.12 0.15 0.00 0.00 0.00 0.00 36.38 34.46 1ur0 s VAL 228 CO 0.46 0.54 0.54 0.12 0.00 0.00 0.00 175.10 176.76 1ur0 s PHE 229 N 0.17 3.38 0.19 5.22 2.19 0.02 -1.35 117.98 127.79 1ur0 s PHE 229 Ca -0.09 -1.52 -0.13 0.00 0.33 0.00 0.00 56.93 55.51 1ur0 s PHE 229 Cb -0.15 -3.76 -0.07 0.00 -1.31 0.00 0.00 43.02 37.72 1ur0 s PHE 229 CO 0.06 -1.01 0.58 0.00 1.83 0.00 0.00 175.22 176.68 1ur0 s ALA 230 N 1.25 3.54 0.03 11.12 0.00 0.10 -3.17 121.76 134.64 1ur0 s ALA 230 Ca 0.07 -0.14 0.03 0.00 0.00 0.00 0.00 51.96 51.91 1ur0 s ALA 230 Cb -0.25 -2.54 -0.02 0.00 0.00 0.00 0.00 23.12 20.31 1ur0 s ALA 230 CO 0.00 0.45 -0.09 0.45 0.00 0.00 0.00 175.76 176.57 1ur0 s SER 231 N -1.97 1.05 0.36 0.00 0.15 -0.27 -1.23 113.70 111.79 1ur0 s SER 231 Ca 0.43 -0.41 -0.11 0.00 0.70 0.00 0.00 55.95 56.56 1ur0 s SER 231 Cb -0.13 -0.03 -0.07 0.00 -1.71 0.00 0.00 66.02 64.07 1ur0 s SER 231 CO 0.20 -0.06 0.73 -0.44 1.20 0.00 0.00 173.24 174.86 1ur0 s SER 232 N -1.08 6.57 -0.31 5.45 0.01 -0.91 -0.25 113.70 123.19 1ur0 s SER 232 Ca -0.03 1.11 0.02 0.00 1.31 0.00 0.00 55.95 58.36 1ur0 s SER 232 Cb -0.07 -2.31 0.16 0.00 0.21 0.00 0.00 66.02 64.01 1ur0 s SER 232 CO 0.01 -0.32 0.41 -0.47 0.41 0.00 0.00 173.24 173.28 1ur0 s TYR 233 N -2.23 -0.93 -0.36 2.43 5.04 0.25 -4.63 117.35 116.92 1ur0 s TYR 233 Ca 0.51 0.15 -0.04 0.00 -2.44 0.00 0.00 57.07 55.25 1ur0 s TYR 233 Cb -0.10 -0.18 0.08 0.00 0.35 0.00 0.00 41.96 42.10 1ur0 s TYR 233 CO 0.28 -0.99 0.13 0.71 -1.34 0.00 0.00 175.55 174.33 1ur0 s TYR 234 N 2.37 3.41 0.60 4.97 2.02 -1.26 -4.17 117.35 125.28 1ur0 s TYR 234 Ca 0.11 -2.01 0.29 0.00 -0.37 0.00 0.00 57.07 55.08 1ur0 s TYR 234 Cb -0.12 -2.69 1.26 0.00 -0.40 0.00 0.00 41.96 40.01 1ur0 s TYR 234 CO -0.26 -0.87 1.64 -1.00 -1.57 0.00 0.00 175.55 173.49 1ur0 h PRO 235 N 8.09 0.00 0.00 -1.71 0.13 -1.87 -0.22 132.00 136.42 1ur0 h PRO 235 Ca -0.18 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.95 1ur0 h PRO 235 Cb 1.06 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.19 1ur0 h PRO 235 CO 0.63 0.00 0.00 1.97 -0.23 0.00 0.00 178.00 180.37 1ur0 n PHE 236 N -3.51 0.00 0.00 1.56 1.16 -1.24 -4.18 117.46 111.24 1ur0 n PHE 236 Ca 0.16 0.00 0.00 0.00 -1.87 0.00 0.00 57.45 55.74 1ur0 n PHE 236 Cb 1.07 -0.28 0.00 0.00 -1.61 0.00 0.00 39.48 38.66 1ur0 n PHE 236 CO 0.00 0.00 0.00 0.91 -1.87 0.00 0.00 176.76 175.80 1ur0 n TRP 237 N -1.28 0.00 -0.36 2.97 8.01 -0.25 -2.91 117.44 123.63 1ur0 n TRP 237 Ca 0.12 0.00 -0.11 0.00 -1.31 0.00 0.00 57.50 56.20 1ur0 n TRP 237 Cb 0.20 0.00 0.05 0.00 -2.01 0.00 0.00 31.31 29.55 1ur0 n TRP 237 CO 0.00 0.00 0.00 0.72 -1.01 0.00 0.00 177.69 177.40 1ur0 n HIS 238 N -0.85 1.15 -4.78 -5.99 8.25 -0.30 -4.91 115.22 107.79 1ur0 n HIS 238 Ca 0.00 -1.41 0.00 0.00 -0.26 0.00 0.00 57.72 56.05 1ur0 n HIS 238 Cb 0.06 -0.70 0.00 0.00 1.12 0.00 0.00 29.99 30.47 1ur0 n HIS 238 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1ur0 n GLY 239 N 0.29 0.14 3.89 -1.41 0.00 -1.26 -4.20 105.19 102.64 1ur0 n GLY 239 Ca 0.22 -0.96 -0.30 0.00 0.00 0.00 0.00 46.02 44.99 1ur0 n GLY 239 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1ur0 s THR 240 N 0.00 3.66 0.18 2.61 -4.23 -1.26 -4.81 115.64 111.79 1ur0 s THR 240 Ca 0.00 0.45 0.11 0.00 -1.18 0.00 0.00 61.69 61.07 1ur0 s THR 240 Cb 0.00 -3.52 -0.06 0.00 1.34 0.00 0.00 72.50 70.26 1ur0 s THR 240 CO 0.00 -0.67 1.51 -0.07 -0.54 0.00 0.00 174.62 174.85 1ur0 h LEU 241 N -0.54 0.00 -0.39 4.79 3.38 -1.98 -2.19 115.31 118.39 1ur0 h LEU 241 Ca -0.45 0.00 -0.02 0.00 0.09 0.00 0.00 57.88 57.50 1ur0 h LEU 241 Cb 1.25 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 41.98 1ur0 h LEU 241 CO 0.63 0.70 0.16 0.50 0.09 0.00 0.00 178.44 180.52 1ur0 h LYS 242 N 0.00 0.58 -0.29 1.13 3.64 -1.99 -1.78 116.57 117.86 1ur0 h LYS 242 Ca -0.01 -0.10 -0.04 0.00 -1.27 0.00 0.00 60.65 59.23 1ur0 h LYS 242 Cb 1.30 -0.10 -0.01 0.00 -0.41 0.00 0.00 32.23 33.02 1ur0 h LYS 242 CO 0.09 0.54 0.03 -0.97 -2.27 0.00 0.00 179.45 176.88 1ur0 h ASN 243 N 0.49 0.47 -0.06 4.20 -1.24 -1.93 -0.93 115.58 116.58 1ur0 h ASN 243 Ca 0.13 -0.28 0.04 0.00 0.71 0.00 0.00 56.30 56.90 1ur0 h ASN 243 Cb 0.18 -0.13 -0.05 0.00 0.73 0.00 0.00 38.32 39.05 1ur0 h ASN 243 CO -0.01 0.63 -0.22 0.25 -1.29 0.00 0.00 177.43 176.79 1ur0 h LEU 244 N 0.30 -0.66 -0.68 0.34 5.85 -1.24 0.10 115.31 119.33 1ur0 h LEU 244 Ca 0.09 0.10 0.05 0.00 0.84 0.00 0.00 57.88 58.96 1ur0 h LEU 244 Cb 0.37 0.28 -0.05 0.00 0.37 0.00 0.00 40.66 41.63 1ur0 h LEU 244 CO 0.01 -0.28 0.39 0.74 -0.34 0.00 0.00 178.44 178.96 1ur0 h THR 245 N -0.32 0.99 0.44 1.05 2.02 -1.25 -1.56 112.91 114.29 1ur0 h THR 245 Ca 0.08 -0.25 -0.02 0.00 0.77 0.00 0.00 66.41 66.99 1ur0 h THR 245 Cb 0.42 0.21 0.00 0.00 -1.74 0.00 0.00 68.15 67.04 1ur0 h THR 245 CO -0.24 0.13 -0.21 -1.28 0.37 0.00 0.00 175.52 174.29 1ur0 h SER 246 N 0.72 -0.50 -0.07 4.18 0.87 -0.28 0.10 113.55 118.58 1ur0 h SER 246 Ca 0.30 -0.02 -0.07 0.00 -1.23 0.00 0.00 61.79 60.77 1ur0 h SER 246 Cb 0.16 0.13 -0.01 0.00 -0.44 0.00 0.00 62.40 62.23 1ur0 h SER 246 CO -0.17 -0.31 -0.16 -0.37 -0.53 0.00 0.00 176.83 175.29 1ur0 h VAL 247 N -0.65 1.23 -0.12 2.23 -1.51 -0.71 -1.61 116.25 115.11 1ur0 h VAL 247 Ca -0.06 -1.03 -0.19 0.00 -1.23 0.00 0.00 66.70 64.19 1ur0 h VAL 247 Cb 0.49 1.22 -0.00 0.00 -2.13 0.00 0.00 31.29 30.86 1ur0 h VAL 247 CO 0.10 0.33 -0.71 -0.07 -1.23 0.00 0.00 177.57 175.98 1ur0 h LEU 248 N 0.39 0.64 -1.03 4.19 3.38 -1.22 -2.54 115.31 119.12 1ur0 h LEU 248 Ca 0.07 -0.41 -0.09 0.00 0.09 0.00 0.00 57.88 57.54 1ur0 h LEU 248 Cb 0.51 -0.19 -0.01 0.00 0.09 0.00 0.00 40.66 41.05 1ur0 h LEU 248 CO 0.03 1.16 -0.33 0.74 0.09 0.00 0.00 178.44 180.13 1ur0 h THR 249 N 0.38 1.28 -0.21 0.22 2.02 -0.47 -0.72 112.91 115.41 1ur0 h THR 249 Ca -0.03 -1.33 -0.03 0.00 0.77 0.00 0.00 66.41 65.79 1ur0 h THR 249 Cb 1.30 1.53 -0.01 0.00 -1.74 0.00 0.00 68.15 69.24 1ur0 h THR 249 CO 0.13 0.40 0.02 -1.28 0.37 0.00 0.00 175.52 175.17 1ur0 h SER 250 N 0.25 0.35 -0.38 4.18 0.87 -1.19 -0.43 113.55 117.19 1ur0 h SER 250 Ca 0.03 -0.28 -0.02 0.00 -1.23 0.00 0.00 61.79 60.29 1ur0 h SER 250 Cb 0.70 -0.09 -0.02 0.00 -0.44 0.00 0.00 62.40 62.56 1ur0 h SER 250 CO 0.05 0.54 0.15 0.58 -0.53 0.00 0.00 176.83 177.62 1ur0 h VAL 251 N 0.14 1.20 0.21 2.23 2.07 -1.21 -0.16 116.25 120.73 1ur0 h VAL 251 Ca 0.06 -0.61 0.01 0.00 0.82 0.00 0.00 66.70 66.98 1ur0 h VAL 251 Cb 0.35 0.89 -0.02 0.00 -1.52 0.00 0.00 31.29 30.98 1ur0 h VAL 251 CO 0.01 0.22 -0.24 0.00 0.02 0.00 0.00 177.57 177.57 1ur0 h ALA 252 N 0.99 -0.47 -0.15 1.67 0.00 -1.00 -0.45 119.26 119.84 1ur0 h ALA 252 Ca 0.13 -0.07 -0.01 0.00 0.00 0.00 0.00 54.91 54.96 1ur0 h ALA 252 Cb 0.20 0.36 -0.01 0.00 0.00 0.00 0.00 17.79 18.34 1ur0 h ALA 252 CO -0.01 -0.80 0.05 -0.44 0.00 0.00 0.00 179.25 178.05 1ur0 h ASP 253 N -0.50 0.22 -0.55 0.00 3.32 -1.01 0.28 116.42 118.17 1ur0 h ASP 253 Ca 0.00 -0.19 -0.08 0.00 0.02 0.00 0.00 57.03 56.79 1ur0 h ASP 253 Cb 0.48 -0.06 -0.02 0.00 0.22 0.00 0.00 39.33 39.95 1ur0 h ASP 253 CO -0.08 0.34 0.03 0.74 -1.72 0.00 0.00 179.24 178.56 1ur0 h THR 254 N 0.07 1.26 -0.08 0.35 2.02 -0.98 -3.32 112.91 112.23 1ur0 h THR 254 Ca 0.05 -1.06 0.00 0.00 0.77 0.00 0.00 66.41 66.17 1ur0 h THR 254 Cb 0.20 0.86 0.00 0.00 -1.74 0.00 0.00 68.15 67.47 1ur0 h THR 254 CO -0.00 0.38 0.00 -1.22 0.37 0.00 0.00 175.52 175.05 1ur0 n TYR 255 N -4.29 0.09 -2.84 3.16 4.01 -0.18 -4.99 117.16 112.11 1ur0 n TYR 255 Ca 0.02 -0.09 -0.19 0.00 -0.16 0.00 0.00 57.90 57.48 1ur0 n TYR 255 Cb 0.31 -0.00 0.03 0.00 -0.31 0.00 0.00 39.34 39.36 1ur0 n TYR 255 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 1ur0 n GLY 256 N 0.66 -0.34 3.91 2.72 0.00 0.96 -5.00 105.19 108.10 1ur0 n GLY 256 Ca 0.08 -0.02 -0.21 0.00 0.00 0.00 0.00 46.02 45.86 1ur0 n GLY 256 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1ur0 s LYS 257 N -5.45 3.23 0.48 1.61 -0.14 -1.15 -5.05 119.74 113.27 1ur0 s LYS 257 Ca 0.23 -0.88 -0.08 0.00 -1.36 0.00 0.00 55.97 53.88 1ur0 s LYS 257 Cb -0.10 -2.76 -0.05 0.00 -1.68 0.00 0.00 37.83 33.24 1ur0 s LYS 257 CO 0.28 0.41 0.82 0.15 -0.76 0.00 0.00 175.35 176.25 1ur0 s LYS 258 N -3.93 3.64 0.07 1.68 1.02 0.36 -4.42 119.74 118.16 1ur0 s LYS 258 Ca 0.34 0.38 0.02 0.00 0.02 0.00 0.00 55.97 56.73 1ur0 s LYS 258 Cb -0.09 -2.33 -0.03 0.00 -0.52 0.00 0.00 37.83 34.86 1ur0 s LYS 258 CO 0.27 -0.20 -0.07 0.14 -0.92 0.00 0.00 175.35 174.57 1ur0 s VAL 259 N -2.68 0.62 0.19 3.17 -7.23 0.14 -0.80 120.40 113.81 1ur0 s VAL 259 Ca 0.50 -1.57 -0.23 0.00 -1.81 0.00 0.00 61.98 58.86 1ur0 s VAL 259 Cb -0.10 -1.23 0.06 0.00 0.56 0.00 0.00 36.38 35.67 1ur0 s VAL 259 CO 0.41 -0.67 0.94 0.00 -0.31 0.00 0.00 175.10 175.47 1ur0 s MET 260 N -2.89 1.38 -0.31 4.82 0.23 -1.19 -1.60 119.30 119.73 1ur0 s MET 260 Ca 0.03 -0.81 -0.08 0.00 -1.03 0.00 0.00 55.69 53.80 1ur0 s MET 260 Cb -0.01 0.44 0.01 0.00 -1.53 0.00 0.00 34.83 33.74 1ur0 s MET 260 CO -0.03 -0.64 0.11 0.08 -2.03 0.00 0.00 175.02 172.52 1ur0 s VAL 261 N -3.02 4.17 -0.47 5.16 1.01 -0.88 -1.12 120.40 125.26 1ur0 s VAL 261 Ca 0.15 -0.64 0.24 0.00 0.00 0.00 0.00 61.98 61.72 1ur0 s VAL 261 Cb -0.02 -3.16 0.25 0.00 0.00 0.00 0.00 36.38 33.44 1ur0 s VAL 261 CO 0.04 0.05 1.52 0.00 0.00 0.00 0.00 175.10 176.71 1ur0 h ALA 262 N 8.28 0.88 -2.71 5.51 0.00 -0.90 0.12 119.26 130.45 1ur0 h ALA 262 Ca -0.31 0.00 -0.12 0.00 0.00 0.00 0.00 54.91 54.48 1ur0 h ALA 262 Cb 1.13 0.00 -0.26 0.00 0.00 0.00 0.00 17.79 18.66 1ur0 h ALA 262 CO 0.61 0.00 -0.30 -1.21 0.00 0.00 0.00 179.25 178.35 1ur0 s GLU 263 N -3.22 0.40 0.05 0.00 2.02 -1.23 -4.49 118.70 112.22 1ur0 s GLU 263 Ca 0.06 0.71 -0.27 0.00 0.02 0.00 0.00 54.97 55.49 1ur0 s GLU 263 Cb 0.08 0.03 0.09 0.00 0.10 0.00 0.00 34.13 34.43 1ur0 s GLU 263 CO 0.68 -0.13 0.77 -0.08 0.02 0.00 0.00 175.26 176.53 1ur0 s THR 264 N 1.08 0.00 0.01 3.63 -1.32 -1.03 0.86 115.64 118.86 1ur0 s THR 264 Ca -0.07 0.00 -0.28 0.00 -1.21 0.00 0.00 61.69 60.13 1ur0 s THR 264 Cb -0.07 -1.00 0.10 0.00 -1.51 0.00 0.00 72.50 70.02 1ur0 s THR 264 CO -0.09 0.00 1.25 -0.94 -2.21 0.00 0.00 174.62 172.63 1ur0 s SER 265 N -2.43 -0.00 0.01 8.08 1.04 -1.26 0.27 113.70 119.40 1ur0 s SER 265 Ca 0.02 -0.26 -0.28 0.00 0.48 0.00 0.00 55.95 55.92 1ur0 s SER 265 Cb -0.01 0.19 0.09 0.00 0.10 0.00 0.00 66.02 66.40 1ur0 s SER 265 CO -0.09 -0.38 0.78 -0.47 0.98 0.00 0.00 173.24 174.06 1ur0 s TYR 266 N -2.09 -0.47 -0.15 5.02 5.04 -1.26 -4.60 117.35 118.84 1ur0 s TYR 266 Ca 0.27 0.50 -0.28 0.00 -2.44 0.00 0.00 57.07 55.12 1ur0 s TYR 266 Cb -0.00 0.50 -0.01 0.00 0.35 0.00 0.00 41.96 42.80 1ur0 s TYR 266 CO -0.00 -0.61 0.94 0.95 -1.34 0.00 0.00 175.55 175.49 1ur0 s THR 267 N -2.57 4.81 -0.79 4.34 -4.23 -1.26 -4.35 115.64 111.60 1ur0 s THR 267 Ca -0.00 1.87 0.23 0.00 -1.18 0.00 0.00 61.69 62.60 1ur0 s THR 267 Cb -0.01 -4.24 -0.14 0.00 1.34 0.00 0.00 72.50 69.46 1ur0 s THR 267 CO -0.05 -0.01 1.04 0.00 -0.54 0.00 0.00 174.62 175.06 1ur0 n TYR 268 N 5.29 0.11 -3.67 3.99 0.18 -0.21 -3.74 117.16 119.11 1ur0 n TYR 268 Ca 0.07 0.03 -0.14 0.00 1.88 0.00 0.00 57.90 59.74 1ur0 n TYR 268 Cb 0.48 -0.26 -0.07 0.00 -0.38 0.00 0.00 39.34 39.11 1ur0 n TYR 268 CO 0.00 0.00 0.00 -0.08 -2.08 0.00 0.00 176.86 174.70 1ur0 s THR 269 N -3.11 0.04 -1.26 -3.48 -1.32 -1.23 -3.10 115.64 102.19 1ur0 s THR 269 Ca 0.06 -0.36 0.27 0.00 -1.21 0.00 0.00 61.69 60.45 1ur0 s THR 269 Cb 0.16 -0.81 0.21 0.00 -1.51 0.00 0.00 72.50 70.54 1ur0 s THR 269 CO 0.81 -0.20 1.67 0.00 -2.21 0.00 0.00 174.62 174.69 1ur0 n ALA 270 N 0.95 3.01 -2.63 11.08 0.00 -1.26 -4.77 120.51 126.88 1ur0 n ALA 270 Ca -0.20 -0.28 -0.42 0.00 0.00 0.00 0.00 53.44 52.55 1ur0 n ALA 270 Cb 0.57 -1.26 -0.03 0.00 0.00 0.00 0.00 19.45 18.73 1ur0 n ALA 270 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 177.50 175.50 1ur0 s GLU 271 N -2.80 4.58 -0.38 0.00 2.12 -1.26 -4.83 118.70 116.12 1ur0 s GLU 271 Ca 0.18 1.40 -0.26 0.00 0.36 0.00 0.00 54.97 56.65 1ur0 s GLU 271 Cb 0.19 -3.44 0.02 0.00 0.26 0.00 0.00 34.13 31.15 1ur0 s GLU 271 CO 0.58 0.00 0.92 0.34 -0.54 0.00 0.00 175.26 176.56 1ur0 s ASP 272 N 0.82 6.64 0.24 -1.70 2.15 -1.26 -4.58 116.67 118.98 1ur0 s ASP 272 Ca 0.50 0.50 0.26 0.00 0.43 0.00 0.00 52.55 54.24 1ur0 s ASP 272 Cb -0.21 -2.46 0.79 0.00 -0.30 0.00 0.00 42.92 40.74 1ur0 s ASP 272 CO 0.28 -0.88 1.76 1.23 -0.17 0.00 0.00 175.17 177.38 1ur0 h GLY 273 N 10.14 0.00 0.00 2.66 0.00 -1.92 -3.37 103.07 110.58 1ur0 h GLY 273 Ca -0.23 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.10 1ur0 h GLY 273 CO 0.99 0.00 0.00 2.09 0.00 0.00 0.00 176.54 179.62 1ur0 n ASP 274 N -2.34 0.47 0.00 0.19 5.75 -1.26 -2.68 116.55 116.68 1ur0 n ASP 274 Ca 0.05 -0.74 0.00 0.00 -0.01 0.00 0.00 54.79 54.09 1ur0 n ASP 274 Cb 0.42 0.38 0.00 0.00 -1.03 0.00 0.00 41.12 40.88 1ur0 n ASP 274 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 1ur0 n GLY 275 N 0.38 0.49 3.30 6.12 0.00 -1.26 -4.08 105.19 110.13 1ur0 n GLY 275 Ca 0.00 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.65 1ur0 n GLY 275 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 173.32 171.74 1ur0 s HIS 276 N -2.00 3.17 -0.14 1.61 5.65 -1.26 -5.01 115.29 117.31 1ur0 s HIS 276 Ca 0.00 -1.22 -0.21 0.00 0.25 0.00 0.00 55.06 53.87 1ur0 s HIS 276 Cb 0.00 -2.23 -0.10 0.00 -1.18 0.00 0.00 32.58 29.07 1ur0 s HIS 276 CO 0.00 -0.65 0.67 0.41 -0.65 0.00 0.00 174.74 174.52 1ur0 n GLY 277 N 4.81 -0.00 3.89 1.59 0.00 -1.26 -4.59 105.19 109.62 1ur0 n GLY 277 Ca -0.14 0.44 -0.30 0.00 0.00 0.00 0.00 46.02 46.02 1ur0 n GLY 277 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1ur0 s ASN 278 N 0.85 5.66 0.18 1.61 0.01 -1.26 -4.60 114.94 117.38 1ur0 s ASN 278 Ca 0.48 1.12 -0.03 0.00 -0.71 0.00 0.00 52.86 53.73 1ur0 s ASN 278 Cb -0.68 -2.02 0.06 0.00 0.41 0.00 0.00 41.25 39.01 1ur0 s ASN 278 CO 0.35 -1.17 1.44 0.74 -1.51 0.00 0.00 177.10 176.95 1ur0 h THR 279 N -0.48 1.36 -3.64 1.60 2.02 -0.63 -3.47 112.91 109.66 1ur0 h THR 279 Ca -0.45 -2.04 -0.08 0.00 0.77 0.00 0.00 66.41 64.61 1ur0 h THR 279 Cb 1.24 2.02 -0.14 0.00 -1.74 0.00 0.00 68.15 69.53 1ur0 h THR 279 CO 0.63 0.62 -0.27 0.00 0.37 0.00 0.00 175.52 176.87 1ur0 s ALA 280 N -3.72 -0.47 0.43 6.16 0.00 -1.26 -4.52 121.76 118.38 1ur0 s ALA 280 Ca -0.06 -0.39 -0.14 0.00 0.00 0.00 0.00 51.96 51.36 1ur0 s ALA 280 Cb 0.11 0.53 -0.08 0.00 0.00 0.00 0.00 23.12 23.68 1ur0 s ALA 280 CO 0.84 -0.54 0.86 -1.25 0.00 0.00 0.00 175.76 175.67 1ur0 s PRO 281 N -3.72 3.92 0.14 0.00 0.04 -1.26 -4.92 135.00 129.20 1ur0 s PRO 281 Ca 0.03 0.74 0.01 0.00 0.04 0.00 0.00 61.00 61.82 1ur0 s PRO 281 Cb 0.03 -2.29 -0.04 0.00 0.04 0.00 0.00 34.50 32.25 1ur0 s PRO 281 CO -0.11 -0.09 0.00 0.15 0.04 0.00 0.00 177.00 177.00 1ur0 s LYS 282 N -3.71 0.99 0.10 4.56 1.02 -1.26 -5.05 119.74 116.39 1ur0 s LYS 282 Ca 0.56 -1.46 -0.31 0.00 0.02 0.00 0.00 55.97 54.78 1ur0 s LYS 282 Cb -0.10 -0.09 -0.09 0.00 -0.52 0.00 0.00 37.83 37.03 1ur0 s LYS 282 CO 0.27 -0.15 1.59 1.21 -0.92 0.00 0.00 175.35 177.35 1ur0 s ASN 283 N -3.10 6.63 0.00 2.83 2.47 -1.26 -2.56 114.94 119.94 1ur0 s ASN 283 Ca 0.21 2.49 0.00 0.00 0.42 0.00 0.00 52.86 55.98 1ur0 s ASN 283 Cb 0.06 -2.58 0.00 0.00 -1.45 0.00 0.00 41.25 37.29 1ur0 s ASN 283 CO 0.01 -0.83 0.00 0.61 -3.72 0.00 0.00 177.10 173.17 1ur0 n GLY 284 N 3.85 2.79 3.77 1.21 0.00 -1.26 -5.06 105.19 110.49 1ur0 n GLY 284 Ca 0.15 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.83 1ur0 n GLY 284 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1ur0 s GLN 285 N -0.25 3.01 -0.13 1.61 -0.21 -1.06 -4.98 119.66 117.64 1ur0 s GLN 285 Ca 0.00 1.44 -0.24 0.00 0.02 0.00 0.00 55.36 56.58 1ur0 s GLN 285 Cb 0.00 -1.97 -0.02 0.00 1.00 0.00 0.00 33.01 32.01 1ur0 s GLN 285 CO 0.00 -1.09 0.76 0.99 -2.12 0.00 0.00 175.29 173.83 1ur0 s THR 286 N -2.18 4.96 -0.55 -0.19 2.01 -1.14 -4.95 115.64 113.60 1ur0 s THR 286 Ca 0.68 1.51 0.05 0.00 0.31 0.00 0.00 61.69 64.24 1ur0 s THR 286 Cb -0.21 -4.08 0.18 0.00 0.01 0.00 0.00 72.50 68.39 1ur0 s THR 286 CO 0.37 0.12 0.43 0.18 -0.69 0.00 0.00 174.62 175.03 1ur0 n LEU 287 N 4.65 1.19 0.02 4.42 4.77 -1.26 -3.72 117.00 127.07 1ur0 n LEU 287 Ca 0.02 -4.78 0.09 0.00 -0.03 0.00 0.00 56.01 51.30 1ur0 n LEU 287 Cb 0.50 -0.05 0.39 0.00 -2.33 0.00 0.00 43.42 41.92 1ur0 n LEU 287 CO 0.47 1.83 0.79 0.59 -1.33 0.00 0.00 177.39 179.74 1ur0 n ASN 288 N 2.34 0.11 -4.28 -1.43 3.02 -1.26 -4.67 115.26 109.09 1ur0 n ASN 288 Ca 0.25 0.52 -0.27 0.00 -0.03 0.00 0.00 54.58 55.06 1ur0 n ASN 288 Cb 0.42 -0.55 -0.14 0.00 -0.61 0.00 0.00 39.78 38.90 1ur0 n ASN 288 CO 0.00 0.00 0.00 0.20 -2.62 0.00 0.00 177.26 174.84 1ur0 s ASN 289 N -3.20 2.67 0.58 6.41 -0.87 -1.26 -5.10 114.94 114.16 1ur0 s ASN 289 Ca 0.08 -0.55 -0.21 0.00 -1.57 0.00 0.00 52.86 50.62 1ur0 s ASN 289 Cb 0.11 -0.23 -0.04 0.00 -0.02 0.00 0.00 41.25 41.08 1ur0 s ASN 289 CO 0.33 0.19 1.34 -2.16 -2.57 0.00 0.00 177.10 174.23 1ur0 s PRO 290 N -1.22 2.97 -1.33 -0.60 0.04 -1.26 -4.84 135.00 128.76 1ur0 s PRO 290 Ca 0.09 2.20 -0.17 0.00 0.04 0.00 0.00 61.00 63.15 1ur0 s PRO 290 Cb -0.09 -2.14 0.04 0.00 0.04 0.00 0.00 34.50 32.35 1ur0 s PRO 290 CO 0.02 -1.31 1.95 0.28 0.04 0.00 0.00 177.00 177.97 1ur0 n VAL 291 N -1.28 3.53 -4.10 -0.36 0.31 -1.26 -3.90 118.33 111.27 1ur0 n VAL 291 Ca 0.12 -3.44 -0.15 0.00 -0.01 0.00 0.00 64.34 60.86 1ur0 n VAL 291 Cb 0.46 -2.44 -0.05 0.00 -0.91 0.00 0.00 33.84 30.90 1ur0 n VAL 291 CO 0.00 0.00 0.00 0.42 -1.32 0.00 0.00 176.83 175.93 1ur0 s THR 292 N 4.29 0.00 0.16 2.52 -4.23 -1.18 -4.20 115.64 113.00 1ur0 s THR 292 Ca 0.52 -1.64 -0.13 0.00 -1.18 0.00 0.00 61.69 59.27 1ur0 s THR 292 Cb 0.08 -2.59 0.04 0.00 1.34 0.00 0.00 72.50 71.37 1ur0 s THR 292 CO 0.02 0.00 1.66 0.58 -0.54 0.00 0.00 174.62 176.34 1ur0 h VAL 293 N 2.15 1.25 -0.32 2.29 2.07 -1.88 -0.28 116.25 121.53 1ur0 h VAL 293 Ca -0.28 -0.89 -0.07 0.00 0.82 0.00 0.00 66.70 66.28 1ur0 h VAL 293 Cb 1.24 0.82 -0.02 0.00 -1.52 0.00 0.00 31.29 31.81 1ur0 h VAL 293 CO 0.39 0.32 -0.11 1.56 0.02 0.00 0.00 177.57 179.75 1ur0 h GLN 294 N 0.74 0.55 -0.15 1.57 1.08 -1.93 -1.49 115.11 115.47 1ur0 h GLN 294 Ca 0.16 -0.16 -0.02 0.00 -1.45 0.00 0.00 58.65 57.19 1ur0 h GLN 294 Cb 0.36 -0.06 -0.01 0.00 -0.05 0.00 0.00 27.48 27.72 1ur0 h GLN 294 CO 0.00 0.65 0.03 0.78 -0.95 0.00 0.00 178.83 179.35 1ur0 h GLY 295 N 0.93 0.26 0.83 3.46 0.00 -1.56 -0.32 103.07 106.67 1ur0 h GLY 295 Ca 0.09 -0.16 0.04 0.00 0.00 0.00 0.00 47.33 47.30 1ur0 h GLY 295 CO 0.03 0.15 0.39 -1.61 0.00 0.00 0.00 176.54 175.50 1ur0 h GLN 296 N 0.04 0.74 -0.83 4.80 4.15 -0.83 -0.89 115.11 122.29 1ur0 h GLN 296 Ca 0.05 -0.04 -0.03 0.00 0.77 0.00 0.00 58.65 59.39 1ur0 h GLN 296 Cb 0.27 -0.17 -0.04 0.00 0.21 0.00 0.00 27.48 27.75 1ur0 h GLN 296 CO 0.00 0.49 0.39 0.00 -1.93 0.00 0.00 178.83 177.78 1ur0 h ALA 297 N 1.29 1.12 -0.41 3.38 0.00 -1.10 -1.57 119.26 121.97 1ur0 h ALA 297 Ca 0.27 -0.17 0.01 0.00 0.00 0.00 0.00 54.91 55.02 1ur0 h ALA 297 Cb 0.06 -0.33 -0.02 0.00 0.00 0.00 0.00 17.79 17.50 1ur0 h ALA 297 CO -0.12 0.66 0.27 -0.91 0.00 0.00 0.00 179.25 179.14 1ur0 h ASN 298 N 1.19 0.46 -0.24 0.00 2.35 -0.03 -1.14 115.58 118.16 1ur0 h ASN 298 Ca 0.28 -0.01 -0.00 0.00 -0.55 0.00 0.00 56.30 56.02 1ur0 h ASN 298 Cb 0.13 -0.11 -0.01 0.00 0.05 0.00 0.00 38.32 38.38 1ur0 h ASN 298 CO -0.03 0.33 0.14 0.00 -1.65 0.00 0.00 177.43 176.22 1ur0 h ALA 299 N 1.15 0.30 -0.29 -0.83 0.00 -0.72 0.11 119.26 118.98 1ur0 h ALA 299 Ca 0.15 -0.05 -0.01 0.00 0.00 0.00 0.00 54.91 55.01 1ur0 h ALA 299 Cb -0.05 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 17.63 1ur0 h ALA 299 CO -0.04 -0.19 0.14 0.28 0.00 0.00 0.00 179.25 179.44 1ur0 h VAL 300 N 0.29 1.15 -0.37 0.00 2.07 -1.16 -1.76 116.25 116.48 1ur0 h VAL 300 Ca 0.08 -0.43 -0.02 0.00 0.82 0.00 0.00 66.70 67.16 1ur0 h VAL 300 Cb 0.03 0.90 -0.02 0.00 -1.52 0.00 0.00 31.29 30.67 1ur0 h VAL 300 CO -0.02 0.15 0.14 -0.09 0.02 0.00 0.00 177.57 177.77 1ur0 h ARG 301 N 0.34 0.52 -0.26 1.57 1.12 -1.03 -2.07 114.38 114.57 1ur0 h ARG 301 Ca 0.10 -0.07 -0.19 0.00 -1.11 0.00 0.00 59.98 58.71 1ur0 h ARG 301 Cb 0.11 -0.10 0.00 0.00 -0.01 0.00 0.00 29.97 29.98 1ur0 h ARG 301 CO -0.01 0.45 -0.58 -0.44 -3.11 0.00 0.00 179.97 176.27 1ur0 h ASP 302 N 0.52 0.92 -0.56 -3.80 3.32 -0.28 -1.46 116.42 115.08 1ur0 h ASP 302 Ca 0.13 -0.51 -0.10 0.00 0.02 0.00 0.00 57.03 56.57 1ur0 h ASP 302 Cb 0.13 -0.27 -0.02 0.00 0.22 0.00 0.00 39.33 39.39 1ur0 h ASP 302 CO -0.01 1.30 -0.05 0.58 -1.72 0.00 0.00 179.24 179.34 1ur0 h VAL 303 N 0.62 1.27 -0.47 -1.35 2.07 -1.04 0.19 116.25 117.53 1ur0 h VAL 303 Ca 0.00 -1.19 0.00 0.00 0.82 0.00 0.00 66.70 66.33 1ur0 h VAL 303 Cb 1.19 0.90 -0.02 0.00 -1.52 0.00 0.00 31.29 31.83 1ur0 h VAL 303 CO 0.13 0.43 0.30 0.40 0.02 0.00 0.00 177.57 178.84 1ur0 h ILE 304 N 0.91 1.13 0.06 4.57 2.04 -1.34 0.46 117.51 125.33 1ur0 h ILE 304 Ca 0.15 -0.26 0.01 0.00 1.00 0.00 0.00 64.86 65.77 1ur0 h ILE 304 Cb 0.61 0.46 -0.02 0.00 -0.74 0.00 0.00 36.82 37.13 1ur0 h ILE 304 CO 0.04 0.13 -0.11 -0.61 0.00 0.00 0.00 178.15 177.59 1ur0 h GLN 305 N 0.63 -0.21 -0.77 2.37 5.75 -0.77 0.53 115.11 122.65 1ur0 h GLN 305 Ca 0.17 0.01 0.11 0.00 -0.15 0.00 0.00 58.65 58.79 1ur0 h GLN 305 Cb -0.05 0.05 -0.08 0.00 1.07 0.00 0.00 27.48 28.47 1ur0 h GLN 305 CO -0.04 -0.14 0.40 0.00 -2.65 0.00 0.00 178.83 176.40 1ur0 h ALA 306 N 0.70 1.10 -0.20 3.38 0.00 -0.10 0.20 119.26 124.34 1ur0 h ALA 306 Ca 0.02 0.06 -0.20 0.00 0.00 0.00 0.00 54.91 54.79 1ur0 h ALA 306 Cb 0.24 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 17.98 1ur0 h ALA 306 CO -0.07 -0.02 -0.65 0.28 0.00 0.00 0.00 179.25 178.78 1ur0 h VAL 307 N 0.65 1.29 -0.33 0.00 2.07 -0.66 -2.96 116.25 116.32 1ur0 h VAL 307 Ca 0.39 -1.88 -0.05 0.00 0.82 0.00 0.00 66.70 65.98 1ur0 h VAL 307 Cb 0.44 1.83 -0.02 0.00 -1.52 0.00 0.00 31.29 32.03 1ur0 h VAL 307 CO -0.29 0.60 -0.02 -1.28 0.02 0.00 0.00 177.57 176.60 1ur0 h SER 308 N 0.54 0.48 0.40 0.57 0.87 -0.11 -1.93 113.55 114.37 1ur0 h SER 308 Ca -0.02 -0.09 0.00 0.00 -1.23 0.00 0.00 61.79 60.45 1ur0 h SER 308 Cb 1.26 -0.13 0.00 0.00 -0.44 0.00 0.00 62.40 63.09 1ur0 h SER 308 CO 0.13 0.57 0.00 0.47 -0.53 0.00 0.00 176.83 177.47 1ur0 n ASP 309 N -4.27 0.42 0.27 6.23 8.00 0.62 -0.98 116.55 126.84 1ur0 n ASP 309 Ca 0.01 0.64 0.15 0.00 0.71 0.00 0.00 54.79 56.30 1ur0 n ASP 309 Cb 0.25 -0.71 0.74 0.00 -0.02 0.00 0.00 41.12 41.38 1ur0 n ASP 309 CO 0.00 0.00 0.00 0.58 -0.39 0.00 0.00 177.20 177.39 1ur0 h VAL 310 N 0.00 0.33 0.00 2.53 2.07 -1.36 -3.48 116.25 116.33 1ur0 h VAL 310 Ca 0.00 -0.56 0.00 0.00 0.82 0.00 0.00 66.70 66.96 1ur0 h VAL 310 Cb 0.20 1.42 0.00 0.00 -1.52 0.00 0.00 31.29 31.39 1ur0 h VAL 310 CO 0.00 0.09 0.00 0.61 0.02 0.00 0.00 177.57 178.29 1ur0 n GLY 311 N -0.40 0.42 0.35 2.17 0.00 -0.16 -4.47 105.19 103.11 1ur0 n GLY 311 Ca -0.01 -1.75 0.18 0.00 0.00 0.00 0.00 46.02 44.44 1ur0 n GLY 311 CO 0.00 0.00 0.00 -2.09 0.00 0.00 0.00 173.32 171.23 1ur0 h GLU 312 N 0.00 0.00 0.00 1.61 4.81 -1.93 -2.08 114.58 116.99 1ur0 h GLU 312 Ca 0.00 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.23 1ur0 h GLU 312 Cb 0.00 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.38 1ur0 h GLU 312 CO 0.00 0.00 -0.61 0.00 -0.73 0.00 0.00 179.01 177.67 1ur0 h ALA 313 N 1.67 0.60 -1.36 2.92 0.00 -1.90 -3.43 119.26 117.77 1ur0 h ALA 313 Ca 0.09 0.00 -0.60 0.00 0.00 0.00 0.00 54.91 54.41 1ur0 h ALA 313 Cb 0.61 0.00 -0.11 0.00 0.00 0.00 0.00 17.79 18.29 1ur0 h ALA 313 CO -0.00 0.00 1.17 0.20 0.00 0.00 0.00 179.25 180.62 1ur0 s GLY 314 N -3.71 1.25 0.17 0.00 0.00 -0.78 0.26 107.32 104.51 1ur0 s GLY 314 Ca 0.06 -2.01 0.25 0.00 0.00 0.00 0.00 44.72 43.02 1ur0 s GLY 314 CO 0.72 2.51 1.54 0.16 0.00 0.00 0.00 173.10 178.03 1ur0 h ILE 315 N 6.34 0.00 0.00 0.90 3.07 -1.58 -3.43 117.51 122.82 1ur0 h ILE 315 Ca -0.01 -0.50 0.00 0.00 1.55 0.00 0.00 64.86 65.90 1ur0 h ILE 315 Cb 1.03 1.29 0.00 0.00 -0.27 0.00 0.00 36.82 38.87 1ur0 h ILE 315 CO 1.31 0.00 0.00 0.61 -1.05 0.00 0.00 178.15 179.02 1ur0 n GLY 316 N 1.32 -2.05 2.89 0.16 0.00 -1.26 -0.53 105.19 105.71 1ur0 n GLY 316 Ca 0.04 -1.18 -0.14 0.00 0.00 0.00 0.00 46.02 44.75 1ur0 n GLY 316 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1ur0 s VAL 317 N -2.20 -0.05 -0.18 1.61 1.01 -0.49 -2.08 120.40 118.01 1ur0 s VAL 317 Ca 0.00 0.19 -0.04 0.00 0.00 0.00 0.00 61.98 62.13 1ur0 s VAL 317 Cb 0.00 -0.20 -0.02 0.00 0.00 0.00 0.00 36.38 36.15 1ur0 s VAL 317 CO 0.00 0.08 -0.02 -0.36 0.00 0.00 0.00 175.10 174.80 1ur0 s PHE 318 N 1.15 3.02 -0.01 5.22 0.40 0.42 -1.84 117.98 126.33 1ur0 s PHE 318 Ca -0.09 -0.45 -0.26 0.00 -0.60 0.00 0.00 56.93 55.53 1ur0 s PHE 318 Cb -0.12 -2.03 -0.04 0.00 0.51 0.00 0.00 43.02 41.34 1ur0 s PHE 318 CO -0.05 -0.19 0.80 -0.47 0.70 0.00 0.00 175.22 176.00 1ur0 s TYR 319 N 0.78 3.65 -0.29 0.36 6.14 0.02 -2.47 117.35 125.54 1ur0 s TYR 319 Ca -0.01 1.44 -0.19 0.00 0.64 0.00 0.00 57.07 58.96 1ur0 s TYR 319 Cb -0.14 -2.90 -0.01 0.00 0.42 0.00 0.00 41.96 39.33 1ur0 s TYR 319 CO 0.02 0.12 0.57 -0.46 0.64 0.00 0.00 175.55 176.44 1ur0 s TRP 320 N 0.58 3.23 -0.72 4.97 -0.00 0.14 -1.20 118.94 125.93 1ur0 s TRP 320 Ca 0.42 0.54 -0.02 0.00 -0.00 0.00 0.00 56.10 57.04 1ur0 s TRP 320 Cb -0.20 -2.88 0.00 0.00 -0.00 0.00 0.00 33.47 30.40 1ur0 s TRP 320 CO 0.22 -0.41 0.67 0.39 -0.00 0.00 0.00 176.95 177.82 1ur0 n GLU 321 N 5.73 -1.48 -0.00 5.86 -0.58 0.81 -4.80 120.64 126.19 1ur0 n GLU 321 Ca -0.03 1.41 0.15 0.00 -0.42 0.00 0.00 57.16 58.27 1ur0 n GLU 321 Cb 0.49 -4.99 0.74 0.00 -0.57 0.00 0.00 31.44 27.11 1ur0 n GLU 321 CO 0.00 0.00 0.00 -0.35 -0.48 0.00 0.00 177.13 176.30 1ur0 n PRO 322 N -1.77 1.32 -1.17 3.49 -0.04 -1.26 -4.05 135.00 131.52 1ur0 n PRO 322 Ca -0.05 -0.46 0.03 0.00 -0.04 0.00 0.00 63.50 62.97 1ur0 n PRO 322 Cb 0.54 -1.48 0.01 0.00 -0.04 0.00 0.00 33.50 32.53 1ur0 n PRO 322 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1ur0 n ALA 323 N -0.43 2.25 -1.63 0.55 0.00 -1.26 0.74 120.51 120.72 1ur0 n ALA 323 Ca 0.21 -1.91 -0.40 0.00 0.00 0.00 0.00 53.44 51.34 1ur0 n ALA 323 Cb 0.23 -0.66 -0.02 0.00 0.00 0.00 0.00 19.45 19.00 1ur0 n ALA 323 CO 0.00 0.00 0.00 1.87 0.00 0.00 0.00 177.50 179.37 1ur0 n TRP 324 N 0.33 2.62 -1.80 0.00 -0.00 -1.26 -4.91 117.44 112.43 1ur0 n TRP 324 Ca 0.04 -2.98 -0.29 0.00 -0.00 0.00 0.00 57.50 54.27 1ur0 n TRP 324 Cb 1.00 -2.26 0.09 0.00 -0.00 0.00 0.00 31.31 30.14 1ur0 n TRP 324 CO 0.00 0.00 0.00 0.96 -0.00 0.00 0.00 177.69 178.65 1ur0 s ILE 325 N 1.12 2.50 0.44 5.87 -4.36 -1.26 -3.49 121.20 122.02 1ur0 s ILE 325 Ca 0.61 0.16 -0.25 0.00 -0.26 0.00 0.00 60.65 60.91 1ur0 s ILE 325 Cb 0.17 -3.09 -0.08 0.00 1.25 0.00 0.00 42.46 40.71 1ur0 s ILE 325 CO -0.07 -0.21 1.31 -2.16 0.24 0.00 0.00 174.94 174.05 1ur0 s PRO 326 N -5.43 3.76 0.42 0.37 0.04 -1.26 -4.93 135.00 127.98 1ur0 s PRO 326 Ca 0.61 2.16 0.23 0.00 0.04 0.00 0.00 61.00 64.04 1ur0 s PRO 326 Cb -0.12 -2.61 0.53 0.00 0.04 0.00 0.00 34.50 32.34 1ur0 s PRO 326 CO 0.51 -0.66 1.67 -0.39 0.04 0.00 0.00 177.00 178.16 1ur0 h VAL 327 N 2.20 0.26 -2.08 -0.36 -1.51 -1.93 -3.47 116.25 109.35 1ur0 h VAL 327 Ca -0.50 -1.19 0.20 0.00 -1.23 0.00 0.00 66.70 63.98 1ur0 h VAL 327 Cb 1.26 1.98 -0.11 0.00 -2.13 0.00 0.00 31.29 32.28 1ur0 h VAL 327 CO 0.61 0.13 0.58 -0.83 -1.23 0.00 0.00 177.57 176.84 1ur0 s GLY 328 N -4.27 -0.32 0.74 5.19 0.00 -1.26 -4.89 107.32 102.51 1ur0 s GLY 328 Ca 0.05 0.53 -0.15 0.00 0.00 0.00 0.00 44.72 45.14 1ur0 s GLY 328 CO 0.66 0.13 0.92 -1.05 0.00 0.00 0.00 173.10 173.76 1ur0 n PRO 329 N -0.40 0.40 0.06 2.90 -0.02 -1.26 -4.33 135.00 132.34 1ur0 n PRO 329 Ca -0.07 0.19 0.13 0.00 -2.02 0.00 0.00 63.50 61.74 1ur0 n PRO 329 Cb 0.61 -2.19 0.61 0.00 -0.02 0.00 0.00 33.50 32.51 1ur0 n PRO 329 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1ur0 h ALA 330 N -0.42 2.18 0.00 3.55 0.00 -1.65 -1.90 119.26 121.02 1ur0 h ALA 330 Ca -0.47 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.43 1ur0 h ALA 330 Cb 1.33 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 19.10 1ur0 h ALA 330 CO 0.46 -0.28 0.00 1.12 0.00 0.00 0.00 179.25 180.55 1ur0 h HIS 331 N 0.14 0.00 -0.30 0.00 2.07 -1.90 -2.88 115.15 112.27 1ur0 h HIS 331 Ca 0.18 0.00 0.00 0.00 -2.85 0.00 0.00 60.37 57.70 1ur0 h HIS 331 Cb 0.53 0.00 0.00 0.00 2.57 0.00 0.00 27.41 30.51 1ur0 h HIS 331 CO -0.00 0.00 0.00 0.54 -3.07 0.00 0.00 177.93 175.40 1ur0 n ARG 332 N -2.88 2.97 -0.10 5.12 1.74 -0.71 -4.72 116.66 118.08 1ur0 n ARG 332 Ca 0.02 -1.63 -0.00 0.00 -0.77 0.00 0.00 57.85 55.48 1ur0 n ARG 332 Cb 0.38 -1.87 0.01 0.00 -1.02 0.00 0.00 32.46 29.97 1ur0 n ARG 332 CO 0.00 0.00 0.00 -0.11 -1.52 0.00 0.00 177.63 176.00 1ur0 n LEU 333 N 0.34 -0.15 -0.17 0.55 0.00 -1.09 0.12 117.00 116.60 1ur0 n LEU 333 Ca 0.14 0.44 -0.10 0.00 0.00 0.00 0.00 56.01 56.49 1ur0 n LEU 333 Cb 0.72 -0.10 0.00 0.00 0.00 0.00 0.00 43.42 44.04 1ur0 n LEU 333 CO 0.17 -0.40 0.77 -0.33 0.00 0.00 0.00 177.39 177.60 1ur0 h GLU 334 N 0.00 0.93 0.00 1.96 4.39 -1.90 -1.23 114.58 118.74 1ur0 h GLU 334 Ca 0.09 -0.33 -0.06 0.00 0.34 0.00 0.00 59.36 59.41 1ur0 h GLU 334 Cb 0.15 -0.07 -0.01 0.00 -0.10 0.00 0.00 28.75 28.73 1ur0 h GLU 334 CO -0.25 0.99 -0.27 -0.22 -1.16 0.00 0.00 179.01 178.10 1ur0 h LYS 335 N 0.80 0.00 -0.11 2.33 1.63 0.55 -2.92 116.57 118.86 1ur0 h LYS 335 Ca 0.14 0.00 -0.05 0.00 -0.85 0.00 0.00 60.65 59.89 1ur0 h LYS 335 Cb 0.60 0.00 -0.00 0.00 -0.60 0.00 0.00 32.23 32.23 1ur0 h LYS 335 CO 0.04 0.27 -0.13 -0.91 -3.45 0.00 0.00 179.45 175.27 1ur0 h ASN 336 N 0.00 0.30 -0.98 4.20 2.35 -0.67 -3.12 115.58 117.66 1ur0 h ASN 336 Ca -0.00 -0.50 0.19 0.00 -0.55 0.00 0.00 56.30 55.44 1ur0 h ASN 336 Cb 0.73 -0.08 -0.09 0.00 0.05 0.00 0.00 38.32 38.92 1ur0 h ASN 336 CO 0.03 0.74 0.61 0.11 -1.65 0.00 0.00 177.43 177.28 1ur0 h LYS 337 N -0.14 0.65 -0.54 0.81 1.57 -1.05 0.21 116.57 118.09 1ur0 h LYS 337 Ca 0.01 -0.04 0.08 0.00 -1.87 0.00 0.00 60.65 58.83 1ur0 h LYS 337 Cb 0.66 -0.15 -0.06 0.00 0.08 0.00 0.00 32.23 32.76 1ur0 h LYS 337 CO 0.03 0.43 0.19 0.00 -0.57 0.00 0.00 179.45 179.53 1ur0 h ALA 338 N 1.63 0.67 -0.26 3.86 0.00 -1.47 0.17 119.26 123.86 1ur0 h ALA 338 Ca 0.55 0.07 -0.08 0.00 0.00 0.00 0.00 54.91 55.45 1ur0 h ALA 338 Cb 0.97 0.05 -0.01 0.00 0.00 0.00 0.00 17.79 18.80 1ur0 h ALA 338 CO -0.31 -0.21 -0.15 -0.07 0.00 0.00 0.00 179.25 178.51 1ur0 h LEU 339 N 0.37 0.58 -1.25 0.00 3.38 -0.69 -0.59 115.31 117.10 1ur0 h LEU 339 Ca 0.26 -0.42 0.03 0.00 0.09 0.00 0.00 57.88 57.84 1ur0 h LEU 339 Cb 0.30 -0.16 -0.04 0.00 0.09 0.00 0.00 40.66 40.85 1ur0 h LEU 339 CO -0.27 0.87 0.52 -0.50 0.09 0.00 0.00 178.44 179.15 1ur0 h TRP 340 N 0.29 0.94 -0.02 1.13 6.55 -0.69 0.60 115.95 124.75 1ur0 h TRP 340 Ca 0.06 0.02 -0.18 0.00 0.95 0.00 0.00 58.89 59.74 1ur0 h TRP 340 Cb 0.66 -0.32 0.01 0.00 -0.86 0.00 0.00 29.16 28.66 1ur0 h TRP 340 CO 0.06 0.56 -0.69 1.49 -1.05 0.00 0.00 178.44 178.81 1ur0 h GLU 341 N 0.99 0.50 -0.08 0.49 4.57 -0.54 -0.37 114.58 120.14 1ur0 h GLU 341 Ca 0.31 -0.52 -0.07 0.00 -1.18 0.00 0.00 59.36 57.90 1ur0 h GLU 341 Cb 0.00 0.14 0.00 0.00 -0.16 0.00 0.00 28.75 28.73 1ur0 h GLU 341 CO -0.08 1.15 -0.21 1.15 -1.18 0.00 0.00 179.01 179.84 1ur0 h THR 342 N 0.06 1.41 -0.08 0.32 2.02 -0.79 -3.35 112.91 112.50 1ur0 h THR 342 Ca -0.08 -1.54 0.00 0.00 0.77 0.00 0.00 66.41 65.56 1ur0 h THR 342 Cb 1.38 2.21 0.00 0.00 -1.74 0.00 0.00 68.15 70.00 1ur0 h THR 342 CO 0.14 0.44 0.00 -1.22 0.37 0.00 0.00 175.52 175.25 1ur0 n TYR 343 N -4.53 0.08 -2.36 3.16 4.01 0.18 -4.94 117.16 112.76 1ur0 n TYR 343 Ca -0.08 -0.05 -0.19 0.00 -0.16 0.00 0.00 57.90 57.42 1ur0 n TYR 343 Cb 0.42 -0.00 -0.01 0.00 -0.31 0.00 0.00 39.34 39.44 1ur0 n TYR 343 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 1ur0 n GLY 344 N 1.10 -0.36 0.07 2.72 0.00 -0.15 -4.68 105.19 103.89 1ur0 n GLY 344 Ca 0.12 0.00 0.05 0.00 0.00 0.00 0.00 46.02 46.19 1ur0 n GLY 344 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1ur0 n SER 345 N -1.93 0.21 -2.91 1.61 3.41 -1.22 -1.22 113.62 111.58 1ur0 n SER 345 Ca -0.23 -1.74 -0.07 0.00 -0.26 0.00 0.00 58.87 56.58 1ur0 n SER 345 Cb 0.67 -0.02 0.01 0.00 -0.26 0.00 0.00 64.21 64.61 1ur0 n SER 345 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1ur0 n GLY 346 N 0.69 2.31 0.23 5.00 0.00 -1.26 -4.62 105.19 107.55 1ur0 n GLY 346 Ca 0.07 -2.18 0.13 0.00 0.00 0.00 0.00 46.02 44.05 1ur0 n GLY 346 CO 0.00 0.00 0.00 0.11 0.00 0.00 0.00 173.32 173.43 1ur0 h TRP 347 N 0.22 0.00 -1.78 1.61 5.08 -1.03 0.33 115.95 120.37 1ur0 h TRP 347 Ca -0.09 0.00 0.11 0.00 1.08 0.00 0.00 58.89 59.99 1ur0 h TRP 347 Cb 0.39 0.00 -0.20 0.00 -3.00 0.00 0.00 29.16 26.35 1ur0 h TRP 347 CO 0.00 0.07 0.56 0.00 -1.28 0.00 0.00 178.44 177.79 1ur0 s ALA 348 N -3.41 -1.91 0.33 0.11 0.00 -1.25 -1.75 121.76 113.87 1ur0 s ALA 348 Ca 0.04 1.40 0.09 0.00 0.00 0.00 0.00 51.96 53.49 1ur0 s ALA 348 Cb 0.07 -0.29 -0.05 0.00 0.00 0.00 0.00 23.12 22.85 1ur0 s ALA 348 CO 0.63 -0.46 0.04 0.95 0.00 0.00 0.00 175.76 176.91 1ur0 s THR 349 N -1.91 2.81 0.57 0.00 -4.23 0.11 -2.19 115.64 110.79 1ur0 s THR 349 Ca 0.02 -1.91 0.27 0.00 -1.18 0.00 0.00 61.69 58.88 1ur0 s THR 349 Cb -0.01 -2.83 0.36 0.00 1.34 0.00 0.00 72.50 71.36 1ur0 s THR 349 CO -0.03 -0.22 2.09 0.77 -0.54 0.00 0.00 174.62 176.69 1ur0 h SER 350 N 1.77 0.00 0.29 3.99 4.64 -1.90 -1.31 113.55 121.02 1ur0 h SER 350 Ca -0.43 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.89 1ur0 h SER 350 Cb 1.25 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.34 1ur0 h SER 350 CO 0.65 0.00 0.00 -1.22 -0.87 0.00 0.00 176.83 175.39 1ur0 n TYR 351 N -3.98 0.23 0.75 4.77 4.01 -1.26 -1.65 117.16 120.03 1ur0 n TYR 351 Ca 0.02 0.10 0.10 0.00 -0.16 0.00 0.00 57.90 57.97 1ur0 n TYR 351 Cb 0.34 -0.67 0.28 0.00 -0.31 0.00 0.00 39.34 38.98 1ur0 n TYR 351 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 1ur0 n ALA 352 N -1.58 2.46 0.16 -0.72 0.00 -0.50 -4.13 120.51 116.20 1ur0 n ALA 352 Ca 0.01 -0.74 0.04 0.00 0.00 0.00 0.00 53.44 52.75 1ur0 n ALA 352 Cb 0.10 -0.99 0.44 0.00 0.00 0.00 0.00 19.45 19.00 1ur0 n ALA 352 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1ur0 h ALA 353 N 4.11 1.61 0.06 0.00 0.00 -1.50 -0.41 119.26 123.13 1ur0 h ALA 353 Ca 0.00 -0.17 -0.00 0.00 0.00 0.00 0.00 54.91 54.74 1ur0 h ALA 353 Cb 0.66 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 18.39 1ur0 h ALA 353 CO 0.00 0.29 -0.03 1.05 0.00 0.00 0.00 179.25 180.56 1ur0 h GLU 354 N 0.15 -0.08 -0.10 0.00 4.11 -1.82 -1.82 114.58 115.02 1ur0 h GLU 354 Ca 0.03 0.01 -0.23 0.00 0.07 0.00 0.00 59.36 59.23 1ur0 h GLU 354 Cb 0.31 0.02 0.01 0.00 0.50 0.00 0.00 28.75 29.59 1ur0 h GLU 354 CO 0.02 0.30 -0.85 -0.92 0.07 0.00 0.00 179.01 177.62 1ur0 h TYR 355 N -0.46 1.02 -2.53 2.06 3.20 -1.81 -3.38 116.97 115.06 1ur0 h TYR 355 Ca -0.01 -0.48 -0.60 0.00 3.14 0.00 0.00 58.73 60.78 1ur0 h TYR 355 Cb 0.41 -0.14 -0.40 0.00 1.54 0.00 0.00 36.73 38.13 1ur0 h TYR 355 CO 0.05 1.31 -0.82 -3.47 -1.64 0.00 0.00 178.16 173.60 1ur0 n ASP 356 N -3.90 1.25 -0.05 -2.11 2.03 -0.17 -4.99 116.55 108.61 1ur0 n ASP 356 Ca -0.08 -2.82 -0.10 0.00 0.52 0.00 0.00 54.79 52.31 1ur0 n ASP 356 Cb 0.79 -0.65 -0.04 0.00 -0.72 0.00 0.00 41.12 40.50 1ur0 n ASP 356 CO 0.00 0.00 0.00 1.55 -1.92 0.00 0.00 177.20 176.83 1ur0 h PRO 357 N 5.16 0.28 -0.21 -0.67 0.13 -1.52 0.13 132.00 135.29 1ur0 h PRO 357 Ca 0.19 -0.02 -0.04 0.00 -0.87 0.00 0.00 66.00 65.26 1ur0 h PRO 357 Cb 0.82 -0.06 -0.01 0.00 0.13 0.00 0.00 31.00 31.89 1ur0 h PRO 357 CO 0.55 0.21 -0.02 0.93 -0.23 0.00 0.00 178.00 179.44 1ur0 h GLU 358 N 0.26 0.39 0.00 0.86 3.07 -1.94 -3.12 114.58 114.10 1ur0 h GLU 358 Ca 0.07 -0.14 0.00 0.00 -0.50 0.00 0.00 59.36 58.80 1ur0 h GLU 358 Cb 0.00 -0.03 0.00 0.00 -0.84 0.00 0.00 28.75 27.89 1ur0 h GLU 358 CO -0.01 0.61 0.00 -3.47 -1.40 0.00 0.00 179.01 174.73 1ur0 n ASP 359 N -4.64 0.00 -0.26 1.42 2.03 -1.25 -4.19 116.55 109.66 1ur0 n ASP 359 Ca -0.04 0.00 0.21 0.00 0.52 0.00 0.00 54.79 55.48 1ur0 n ASP 359 Cb 0.26 0.00 0.54 0.00 -0.72 0.00 0.00 41.12 41.20 1ur0 n ASP 359 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 1ur0 h ALA 360 N -2.00 2.31 -0.61 -1.67 0.00 -1.79 -1.66 119.26 113.83 1ur0 h ALA 360 Ca 0.00 0.02 0.12 0.00 0.00 0.00 0.00 54.91 55.05 1ur0 h ALA 360 Cb 0.00 -0.00 -0.09 0.00 0.00 0.00 0.00 17.79 17.70 1ur0 h ALA 360 CO 0.00 -0.62 0.11 0.78 0.00 0.00 0.00 179.25 179.52 1ur0 h GLY 361 N 0.35 0.76 -1.59 0.00 0.00 -0.89 -1.94 103.07 99.75 1ur0 h GLY 361 Ca 0.50 -0.01 0.00 0.00 0.00 0.00 0.00 47.33 47.82 1ur0 h GLY 361 CO -0.18 -0.14 0.00 0.58 0.00 0.00 0.00 176.54 176.80 1ur0 n LYS 362 N -5.16 2.32 0.00 4.80 2.85 -0.69 -4.57 118.16 117.71 1ur0 n LYS 362 Ca 0.09 -2.00 0.00 0.00 -1.05 0.00 0.00 58.31 55.35 1ur0 n LYS 362 Cb 0.34 -1.35 0.00 0.00 -0.65 0.00 0.00 35.03 33.37 1ur0 n LYS 362 CO 0.00 0.00 0.00 0.91 -0.05 0.00 0.00 177.40 178.26 1ur0 n TRP 363 N 0.88 0.00 -1.28 5.58 5.03 -0.83 -5.10 117.44 121.73 1ur0 n TRP 363 Ca 0.14 0.00 -0.37 0.00 3.03 0.00 0.00 57.50 60.30 1ur0 n TRP 363 Cb 0.46 0.00 0.04 0.00 -1.03 0.00 0.00 31.31 30.78 1ur0 n TRP 363 CO 0.00 0.00 0.00 1.97 -0.03 0.00 0.00 177.69 179.63 1ur0 n PHE 364 N -0.36 -1.75 0.00 -5.99 1.16 -0.74 -4.88 117.46 104.90 1ur0 n PHE 364 Ca 0.00 0.36 0.00 0.00 -1.87 0.00 0.00 57.45 55.94 1ur0 n PHE 364 Cb 0.04 -1.82 0.00 0.00 -1.61 0.00 0.00 39.48 36.09 1ur0 n PHE 364 CO 0.00 0.00 0.00 0.41 -1.87 0.00 0.00 176.76 175.30 1ur0 n GLY 365 N 2.08 -0.64 0.00 4.97 0.00 -0.93 -4.99 105.19 105.68 1ur0 n GLY 365 Ca 0.09 -0.27 0.00 0.00 0.00 0.00 0.00 46.02 45.83 1ur0 n GLY 365 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1ur0 n GLY 366 N 0.00 1.71 3.72 -0.02 0.00 -1.26 -2.97 105.19 106.36 1ur0 n GLY 366 Ca 0.00 -1.75 -0.42 0.00 0.00 0.00 0.00 46.02 43.86 1ur0 n GLY 366 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1ur0 s SER 367 N -1.00 7.33 0.00 1.61 0.15 -1.26 -1.17 113.70 119.36 1ur0 s SER 367 Ca 0.00 1.82 0.22 0.00 0.70 0.00 0.00 55.95 58.69 1ur0 s SER 367 Cb 0.00 -2.58 0.26 0.00 -1.71 0.00 0.00 66.02 61.99 1ur0 s SER 367 CO 0.00 -0.25 1.26 0.00 1.20 0.00 0.00 173.24 175.45 1ur0 n ALA 368 N 3.43 2.44 -1.58 5.45 0.00 -1.26 -4.45 120.51 124.54 1ur0 n ALA 368 Ca 0.05 -0.80 0.02 0.00 0.00 0.00 0.00 53.44 52.71 1ur0 n ALA 368 Cb 0.49 -0.76 0.03 0.00 0.00 0.00 0.00 19.45 19.21 1ur0 n ALA 368 CO 0.00 0.00 0.00 1.33 0.00 0.00 0.00 177.50 178.83 1ur0 n VAL 369 N 1.28 0.43 0.01 0.00 0.24 -1.26 0.16 118.33 119.19 1ur0 n VAL 369 Ca 0.15 -0.51 0.21 0.00 -2.04 0.00 0.00 64.34 62.15 1ur0 n VAL 369 Cb 0.56 0.42 0.72 0.00 -1.47 0.00 0.00 33.84 34.06 1ur0 n VAL 369 CO 0.00 0.00 0.00 -2.24 -2.14 0.00 0.00 176.83 172.45 1ur0 h ASP 370 N 0.00 0.00 -0.19 -1.34 3.04 -1.77 0.25 116.42 116.41 1ur0 h ASP 370 Ca 0.00 0.00 0.00 0.00 -3.24 0.00 0.00 57.03 53.79 1ur0 h ASP 370 Cb 1.22 0.00 0.00 0.00 -1.04 0.00 0.00 39.33 39.51 1ur0 h ASP 370 CO 0.00 0.00 0.00 -0.46 -2.04 0.00 0.00 179.24 176.74 1ur0 n ASN 371 N -4.18 1.16 -0.14 4.15 6.94 -1.26 -3.13 115.26 118.79 1ur0 n ASN 371 Ca 0.10 -1.88 0.01 0.00 -0.02 0.00 0.00 54.58 52.80 1ur0 n ASN 371 Cb 0.64 -0.12 0.03 0.00 -2.36 0.00 0.00 39.78 37.97 1ur0 n ASN 371 CO 0.00 0.00 0.00 0.00 -1.03 0.00 0.00 177.26 176.23 1ur0 n GLN 372 N 0.08 2.54 -1.67 -3.83 6.02 0.88 -1.05 117.38 120.36 1ur0 n GLN 372 Ca 0.10 -1.51 -0.29 0.00 -0.01 0.00 0.00 57.00 55.28 1ur0 n GLN 372 Cb 0.20 -1.06 0.11 0.00 1.02 0.00 0.00 30.24 30.51 1ur0 n GLN 372 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 1ur0 s ALA 373 N -0.91 2.20 -0.48 -1.58 0.00 -1.18 -4.50 121.76 115.31 1ur0 s ALA 373 Ca 0.05 -0.48 0.16 0.00 0.00 0.00 0.00 51.96 51.69 1ur0 s ALA 373 Cb 0.03 -3.03 0.60 0.00 0.00 0.00 0.00 23.12 20.72 1ur0 s ALA 373 CO 0.04 -1.91 1.51 1.28 0.00 0.00 0.00 175.76 176.68 1ur0 n LEU 374 N -3.51 4.35 -4.15 0.00 4.77 0.23 -4.81 117.00 113.88 1ur0 n LEU 374 Ca 0.07 -2.75 -0.15 0.00 -0.03 0.00 0.00 56.01 53.15 1ur0 n LEU 374 Cb 0.59 -0.54 -0.11 0.00 -2.33 0.00 0.00 43.42 41.03 1ur0 n LEU 374 CO 0.57 0.70 -0.43 -0.36 -1.33 0.00 0.00 177.39 176.55 1ur0 s PHE 375 N -2.37 1.02 0.92 -1.77 0.40 -1.24 -0.78 117.98 114.16 1ur0 s PHE 375 Ca 0.44 -0.56 -0.14 0.00 -0.60 0.00 0.00 56.93 56.06 1ur0 s PHE 375 Cb 0.33 -0.57 0.16 0.00 0.51 0.00 0.00 43.02 43.44 1ur0 s PHE 375 CO 0.15 -0.00 1.24 0.16 0.70 0.00 0.00 175.22 177.47 1ur0 s ASP 376 N -2.04 3.53 0.00 1.36 1.47 0.12 -4.81 116.67 116.30 1ur0 s ASP 376 Ca -0.00 0.53 0.00 0.00 1.18 0.00 0.00 52.55 54.26 1ur0 s ASP 376 Cb -0.07 -0.80 0.00 0.00 -0.34 0.00 0.00 42.92 41.72 1ur0 s ASP 376 CO 0.01 -2.49 0.67 0.49 0.68 0.00 0.00 175.17 174.52 1ur0 n PHE 377 N -3.66 0.00 -0.35 2.11 3.72 -1.26 -1.40 117.46 116.61 1ur0 n PHE 377 Ca 0.12 0.00 0.06 0.00 -0.05 0.00 0.00 57.45 57.57 1ur0 n PHE 377 Cb 0.60 -0.19 0.15 0.00 -0.94 0.00 0.00 39.48 39.10 1ur0 n PHE 377 CO 0.00 0.00 0.00 1.63 -0.05 0.00 0.00 176.76 178.34 1ur0 n LYS 378 N -1.17 2.84 -0.93 -1.08 4.76 -1.26 -4.58 118.16 116.73 1ur0 n LYS 378 Ca 0.00 -2.16 0.00 0.00 -2.87 0.00 0.00 58.31 53.28 1ur0 n LYS 378 Cb 0.01 -1.36 0.00 0.00 -1.84 0.00 0.00 35.03 31.84 1ur0 n LYS 378 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 1ur0 n GLY 379 N 0.08 0.88 3.75 0.72 0.00 -0.50 -4.82 105.19 105.32 1ur0 n GLY 379 Ca 0.12 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.75 1ur0 n GLY 379 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1ur0 s ARG 380 N -0.07 4.32 0.40 1.61 0.52 -1.26 -1.13 118.95 123.34 1ur0 s ARG 380 Ca 0.00 0.69 -0.27 0.00 -0.52 0.00 0.00 55.73 55.64 1ur0 s ARG 380 Cb 0.00 -3.37 -0.09 0.00 0.52 0.00 0.00 34.95 32.01 1ur0 s ARG 380 CO 0.00 0.31 1.37 -1.25 0.02 0.00 0.00 175.30 175.75 1ur0 s PRO 381 N 0.02 3.98 0.37 3.54 0.04 -1.26 0.11 135.00 141.79 1ur0 s PRO 381 Ca 0.31 2.32 -0.09 0.00 0.04 0.00 0.00 61.00 63.58 1ur0 s PRO 381 Cb -0.18 -2.82 -0.06 0.00 0.04 0.00 0.00 34.50 31.48 1ur0 s PRO 381 CO 0.16 -0.54 0.70 -0.51 0.04 0.00 0.00 177.00 176.85 1ur0 s LEU 382 N -2.34 3.91 0.63 -3.56 1.43 0.04 -4.77 118.68 114.01 1ur0 s LEU 382 Ca 0.56 1.01 0.32 0.00 -1.03 0.00 0.00 54.13 54.99 1ur0 s LEU 382 Cb -0.42 -3.86 1.80 0.00 0.03 0.00 0.00 46.19 43.74 1ur0 s LEU 382 CO 0.54 -0.33 2.09 1.55 0.23 0.00 0.00 176.35 180.43 1ur0 h PRO 383 N 1.41 0.00 0.00 1.29 0.13 -1.95 -0.25 132.00 132.64 1ur0 h PRO 383 Ca -0.47 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.66 1ur0 h PRO 383 Cb 1.19 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.32 1ur0 h PRO 383 CO 0.65 0.00 0.00 -1.13 -0.23 0.00 0.00 178.00 177.29 1ur0 n SER 384 N -3.38 0.45 0.27 1.44 3.41 -1.26 -1.34 113.62 113.21 1ur0 n SER 384 Ca 0.00 0.65 0.15 0.00 -0.26 0.00 0.00 58.87 59.41 1ur0 n SER 384 Cb 0.32 -0.73 0.74 0.00 -0.26 0.00 0.00 64.21 64.27 1ur0 n SER 384 CO 0.00 0.00 0.00 0.25 -0.16 0.00 0.00 175.04 175.13 1ur0 h LEU 385 N 0.00 0.00 0.00 1.04 5.85 -1.25 -2.14 115.31 118.81 1ur0 h LEU 385 Ca 0.00 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.72 1ur0 h LEU 385 Cb 0.18 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.21 1ur0 h LEU 385 CO 0.00 0.09 0.00 1.41 -0.34 0.00 0.00 178.44 179.60 1ur0 n HIS 386 N -3.33 0.00 0.07 1.25 8.25 -0.45 -3.49 115.22 117.53 1ur0 n HIS 386 Ca -0.01 0.00 0.04 0.00 -0.26 0.00 0.00 57.72 57.49 1ur0 n HIS 386 Cb 0.27 -0.20 0.44 0.00 1.12 0.00 0.00 29.99 31.63 1ur0 n HIS 386 CO 0.00 0.00 0.00 -0.24 0.64 0.00 0.00 176.34 176.74 1ur0 h VAL 387 N 0.00 1.11 -0.04 1.59 3.04 -1.58 -1.70 116.25 118.67 1ur0 h VAL 387 Ca 0.00 -0.35 -0.05 0.00 -1.01 0.00 0.00 66.70 65.29 1ur0 h VAL 387 Cb 0.12 0.79 -0.01 0.00 -2.01 0.00 0.00 31.29 30.18 1ur0 h VAL 387 CO 0.00 0.13 -0.20 -0.26 -1.01 0.00 0.00 177.57 176.23 1ur0 h PHE 388 N 0.38 0.07 0.00 3.17 0.04 -1.77 -2.58 116.94 116.25 1ur0 h PHE 388 Ca 0.10 -0.01 -0.06 0.00 2.80 0.00 0.00 57.97 60.80 1ur0 h PHE 388 Cb 0.08 -0.02 -0.01 0.00 2.20 0.00 0.00 35.95 38.21 1ur0 h PHE 388 CO 0.00 0.27 -0.48 1.96 -0.60 0.00 0.00 178.31 179.47 1ur0 h GLN 389 N 0.06 0.00 0.00 1.51 4.20 -1.50 -3.38 115.11 116.00 1ur0 h GLN 389 Ca 0.01 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.72 1ur0 h GLN 389 Cb 0.40 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.18 1ur0 h GLN 389 CO 0.03 0.44 0.27 1.88 -0.67 0.00 0.00 178.83 180.77 1ur0 h TYR 390 N -1.00 0.00 0.00 2.96 0.05 -1.33 -2.11 116.97 115.54 1ur0 h TYR 390 Ca -0.09 0.00 -0.05 0.00 0.05 0.00 0.00 58.73 58.64 1ur0 h TYR 390 Cb 0.67 0.00 -0.01 0.00 1.01 0.00 0.00 36.73 38.41 1ur0 h TYR 390 CO 0.01 0.00 -0.25 -0.39 -1.05 0.00 0.00 178.16 176.48 1ur0 h VAL 391 N 0.00 0.93 -0.09 -2.88 -1.51 -1.64 0.98 116.25 112.03 1ur0 h VAL 391 Ca 0.00 -0.95 -0.19 0.00 -1.23 0.00 0.00 66.70 64.33 1ur0 h VAL 391 Cb 0.54 1.55 -0.00 0.00 -2.13 0.00 0.00 31.29 31.24 1ur0 h VAL 391 CO 0.00 0.25 -0.73 0.44 -1.23 0.00 0.00 177.57 176.30 1ur0 h ASP 392 N 0.00 0.55 0.00 4.19 3.32 -1.64 -1.30 116.42 121.55 1ur0 h ASP 392 Ca -0.00 -0.36 -0.08 0.00 0.02 0.00 0.00 57.03 56.61 1ur0 h ASP 392 Cb 0.53 -0.16 -0.01 0.00 0.22 0.00 0.00 39.33 39.90 1ur0 h ASP 392 CO 0.03 1.10 -1.29 0.35 -1.72 0.00 0.00 179.24 177.72 1ur0 n THR 393 N -3.86 0.29 0.00 0.35 -2.24 -1.08 -4.81 114.28 102.94 1ur0 n THR 393 Ca -0.05 -0.09 0.00 0.00 -2.27 0.00 0.00 64.05 61.65 1ur0 n THR 393 Cb 0.71 -1.22 0.00 0.00 -2.10 0.00 0.00 70.33 67.72 1ur0 n THR 393 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1ur0 n GLY 394 N 2.90 1.85 3.79 3.38 0.00 0.34 -4.38 105.19 113.07 1ur0 n GLY 394 Ca -0.10 -2.11 -0.38 0.00 0.00 0.00 0.00 46.02 43.44 1ur0 n GLY 394 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1ur0 s THR 395 N -1.87 5.06 0.40 2.61 -4.23 -0.59 -4.82 115.64 112.21 1ur0 s THR 395 Ca 0.00 0.89 0.19 0.00 -1.18 0.00 0.00 61.69 61.60 1ur0 s THR 395 Cb 0.00 -3.76 0.40 0.00 1.34 0.00 0.00 72.50 70.48 1ur0 s THR 395 CO 0.00 0.49 1.77 -0.65 -0.54 0.00 0.00 174.62 175.69 1ur0 h PRO 396 N 5.42 0.36 0.00 3.99 0.11 -1.93 -3.46 132.00 136.49 1ur0 h PRO 396 Ca -0.48 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 65.61 1ur0 h PRO 396 Cb 1.20 -0.08 0.00 0.00 0.11 0.00 0.00 31.00 32.23 1ur0 h PRO 396 CO 0.67 0.24 0.00 0.34 -0.21 0.00 0.00 178.00 179.03