#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1xmw n ASP 2 N 0.00 -4.30 -4.79 1.67 9.92 -1.26 -4.92 116.55 112.87 1xmw n ASP 2 Ca 0.00 -0.31 -0.37 0.00 -0.53 0.00 0.00 54.79 53.57 1xmw n ASP 2 Cb 0.00 -3.54 -0.06 0.00 -0.64 0.00 0.00 41.12 36.88 1xmw n ASP 2 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 1xmw s ALA 3 N -2.96 3.36 -0.31 2.24 0.00 -1.26 -5.05 121.76 117.79 1xmw s ALA 3 Ca 0.34 0.33 0.01 0.00 0.00 0.00 0.00 51.96 52.64 1xmw s ALA 3 Cb -0.17 -2.97 0.14 0.00 0.00 0.00 0.00 23.12 20.12 1xmw s ALA 3 CO 0.42 0.27 0.33 -2.00 0.00 0.00 0.00 175.76 174.78 1xmw s GLU 4 N -1.75 0.41 -0.12 0.00 2.12 -1.26 -4.99 118.70 113.11 1xmw s GLU 4 Ca 0.43 -0.26 0.12 0.00 0.36 0.00 0.00 54.97 55.62 1xmw s GLU 4 Cb -0.19 -0.61 0.56 0.00 0.26 0.00 0.00 34.13 34.14 1xmw s GLU 4 CO 0.24 -1.07 1.39 0.27 -0.54 0.00 0.00 175.26 175.55 1xmw n ASN 5 N 5.08 3.97 -1.56 -1.70 6.94 -1.26 -4.24 115.26 122.49 1xmw n ASN 5 Ca 0.01 -2.48 -0.02 0.00 -0.02 0.00 0.00 54.58 52.07 1xmw n ASN 5 Cb 0.47 -0.56 0.22 0.00 -2.36 0.00 0.00 39.78 37.55 1xmw n ASN 5 CO 0.00 0.00 0.00 2.30 -1.03 0.00 0.00 177.26 178.53 1xmw n ILE 6 N 0.62 2.06 -1.94 1.53 -5.35 -1.26 -5.01 119.36 110.01 1xmw n ILE 6 Ca 0.19 -1.05 0.00 0.00 -0.27 0.00 0.00 62.75 61.62 1xmw n ILE 6 Cb 0.80 -0.45 0.00 0.00 -1.74 0.00 0.00 39.64 38.25 1xmw n ILE 6 CO 0.00 0.00 0.00 -0.62 -1.76 0.00 0.00 176.55 174.17 1xmw n GLU 7 N 0.09 -5.42 -1.71 6.28 -0.58 -1.26 -4.95 120.64 113.09 1xmw n GLU 7 Ca 0.26 3.90 0.00 0.00 -0.42 0.00 0.00 57.16 60.90 1xmw n GLU 7 Cb 1.02 -4.29 0.00 0.00 -0.57 0.00 0.00 31.44 27.60 1xmw n GLU 7 CO 0.00 0.00 0.00 0.66 -0.48 0.00 0.00 177.13 177.31 1xmw n TYR 8 N 0.63 -4.64 -4.35 -0.32 4.01 -1.26 -4.96 117.16 106.26 1xmw n TYR 8 Ca 0.00 2.46 -0.20 0.00 -0.16 0.00 0.00 57.90 60.00 1xmw n TYR 8 Cb 0.00 -3.65 -0.10 0.00 -0.31 0.00 0.00 39.34 35.28 1xmw n TYR 8 CO 0.00 0.00 0.00 0.15 -0.46 0.00 0.00 176.86 176.55 1xmw s LYS 9 N -3.34 1.33 -0.00 -0.72 1.02 -1.02 -4.93 119.74 112.08 1xmw s LYS 9 Ca 0.00 -1.53 0.01 0.00 0.02 0.00 0.00 55.97 54.47 1xmw s LYS 9 Cb 0.00 -1.25 -0.00 0.00 -0.52 0.00 0.00 37.83 36.06 1xmw s LYS 9 CO 0.00 0.23 -0.04 0.08 -0.92 0.00 0.00 175.35 174.70 1xmw s VAL 10 N -2.57 0.30 -0.36 3.17 1.01 -1.26 -0.72 120.40 119.96 1xmw s VAL 10 Ca 0.20 -0.16 0.02 0.00 0.00 0.00 0.00 61.98 62.05 1xmw s VAL 10 Cb -0.03 -0.26 0.15 0.00 0.00 0.00 0.00 36.38 36.24 1xmw s VAL 10 CO 0.07 0.09 0.32 -0.44 0.00 0.00 0.00 175.10 175.14 1xmw s SER 11 N -0.06 1.79 0.02 3.32 0.01 -0.20 -4.99 113.70 113.59 1xmw s SER 11 Ca 0.01 -1.77 -0.19 0.00 1.31 0.00 0.00 55.95 55.31 1xmw s SER 11 Cb -0.02 0.23 -0.06 0.00 0.21 0.00 0.00 66.02 66.39 1xmw s SER 11 CO -0.00 -0.28 0.54 -0.63 0.41 0.00 0.00 173.24 173.28 1xmw s ILE 12 N 1.32 4.88 -0.35 1.44 1.01 -1.26 -2.36 121.20 125.88 1xmw s ILE 12 Ca 0.17 1.13 0.02 0.00 0.00 0.00 0.00 60.65 61.98 1xmw s ILE 12 Cb -0.18 -3.87 0.10 0.00 0.01 0.00 0.00 42.46 38.53 1xmw s ILE 12 CO -0.02 0.50 0.09 -0.55 0.00 0.00 0.00 174.94 174.96 1xmw s SER 13 N -0.69 4.45 1.26 3.58 0.15 -0.79 -4.92 113.70 116.73 1xmw s SER 13 Ca 0.28 -2.08 0.00 0.00 0.70 0.00 0.00 55.95 54.85 1xmw s SER 13 Cb -0.18 -1.36 0.00 0.00 -1.71 0.00 0.00 66.02 62.77 1xmw s SER 13 CO 0.17 -0.38 0.00 0.61 1.20 0.00 0.00 173.24 174.84 1xmw n GLY 14 N 4.32 1.90 1.62 9.45 0.00 -1.26 -2.50 105.19 118.72 1xmw n GLY 14 Ca 0.02 -0.16 -0.15 0.00 0.00 0.00 0.00 46.02 45.74 1xmw n GLY 14 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 1xmw n THR 15 N 0.00 2.78 -4.37 2.61 -1.04 -1.26 -4.83 114.28 108.17 1xmw n THR 15 Ca 0.00 -3.00 -0.27 0.00 -2.04 0.00 0.00 64.05 58.73 1xmw n THR 15 Cb 0.00 -0.62 -0.11 0.00 -1.82 0.00 0.00 70.33 67.77 1xmw n THR 15 CO 0.00 0.00 0.00 -0.55 -0.64 0.00 0.00 175.07 173.88 1xmw s SER 16 N -2.53 3.70 -0.24 8.00 0.15 -1.04 -0.92 113.70 120.83 1xmw s SER 16 Ca 0.50 -0.75 -0.04 0.00 0.70 0.00 0.00 55.95 56.36 1xmw s SER 16 Cb 0.43 -0.41 0.09 0.00 -1.71 0.00 0.00 66.02 64.42 1xmw s SER 16 CO 0.01 0.12 0.15 -0.69 1.20 0.00 0.00 173.24 174.03 1xmw s VAL 17 N -1.60 -0.15 -0.38 4.45 1.01 -0.81 -1.89 120.40 121.04 1xmw s VAL 17 Ca 0.21 -0.44 -0.13 0.00 0.00 0.00 0.00 61.98 61.63 1xmw s VAL 17 Cb -0.09 -0.80 0.01 0.00 0.00 0.00 0.00 36.38 35.51 1xmw s VAL 17 CO 0.11 -0.48 0.25 -0.70 0.00 0.00 0.00 175.10 174.29 1xmw s GLU 18 N 2.17 3.03 -0.13 2.72 2.12 -1.00 -0.45 118.70 127.17 1xmw s GLU 18 Ca 0.06 -0.96 -0.05 0.00 0.36 0.00 0.00 54.97 54.38 1xmw s GLU 18 Cb -0.16 -3.85 -0.04 0.00 0.26 0.00 0.00 34.13 30.35 1xmw s GLU 18 CO -0.23 -0.67 0.04 -0.51 -0.54 0.00 0.00 175.26 173.35 1xmw s LEU 19 N 1.64 3.73 -0.31 2.70 1.43 -0.41 -1.03 118.68 126.42 1xmw s LEU 19 Ca 0.04 0.13 -0.17 0.00 -1.03 0.00 0.00 54.13 53.10 1xmw s LEU 19 Cb -0.19 -1.90 -0.02 0.00 0.03 0.00 0.00 46.19 44.12 1xmw s LEU 19 CO 0.09 0.29 0.48 -0.89 0.23 0.00 0.00 176.35 176.54 1xmw s THR 20 N -0.31 5.07 0.33 5.49 2.01 0.11 0.12 115.64 128.46 1xmw s THR 20 Ca 0.08 0.49 -0.26 0.00 0.31 0.00 0.00 61.69 62.31 1xmw s THR 20 Cb -0.12 -3.87 -0.14 0.00 0.01 0.00 0.00 72.50 68.38 1xmw s THR 20 CO 0.02 -0.07 0.82 0.00 -0.69 0.00 0.00 174.62 174.70 1xmw n PRO 22 N 0.64 0.41 -3.62 0.00 -0.04 -1.26 -4.72 135.00 126.40 1xmw n PRO 22 Ca 0.11 0.00 -0.09 0.00 -0.04 0.00 0.00 63.50 63.48 1xmw n PRO 22 Cb 0.34 -1.30 0.02 0.00 -0.04 0.00 0.00 33.50 32.53 1xmw n PRO 22 CO 0.00 0.00 0.00 1.47 -0.04 0.00 0.00 175.50 176.93 1xmw n LEU 23 N 1.00 0.00 -4.51 1.53 -0.00 -1.26 -4.81 117.00 108.95 1xmw n LEU 23 Ca 0.00 -2.44 -0.29 0.00 -0.00 0.00 0.00 56.01 53.28 1xmw n LEU 23 Cb 0.20 3.53 0.24 0.00 -0.00 0.00 0.00 43.42 47.39 1xmw n LEU 23 CO 0.00 -0.80 0.53 1.51 -0.00 0.00 0.00 177.39 178.64 1xmw s ASP 24 N -2.95 0.99 0.01 1.45 -4.77 -1.26 -4.95 116.67 105.18 1xmw s ASP 24 Ca 0.16 1.27 -0.28 0.00 -3.30 0.00 0.00 52.55 50.40 1xmw s ASP 24 Cb -0.04 -1.95 -0.04 0.00 -1.09 0.00 0.00 42.92 39.80 1xmw s ASP 24 CO 0.12 -4.16 0.88 -0.55 0.70 0.00 0.00 175.17 172.16 1xmw s SER 25 N -2.90 7.28 -0.14 2.11 0.15 -1.26 -4.84 113.70 114.10 1xmw s SER 25 Ca 0.68 1.54 0.01 0.00 0.70 0.00 0.00 55.95 58.88 1xmw s SER 25 Cb -0.21 -2.52 -0.01 0.00 -1.71 0.00 0.00 66.02 61.57 1xmw s SER 25 CO 0.62 -0.16 -0.15 -0.62 1.20 0.00 0.00 173.24 174.13 1xmw s ASP 26 N 0.66 3.75 0.59 5.45 -1.08 -1.26 -4.96 116.67 119.82 1xmw s ASP 26 Ca 0.46 -0.42 0.29 0.00 -0.52 0.00 0.00 52.55 52.36 1xmw s ASP 26 Cb -0.21 -1.57 1.40 0.00 -1.46 0.00 0.00 42.92 41.09 1xmw s ASP 26 CO 0.25 0.13 1.81 -0.08 0.52 0.00 0.00 175.17 177.80 1xmw h GLU 27 N 6.96 0.00 -0.14 4.34 4.81 -1.97 1.20 114.58 129.79 1xmw h GLU 27 Ca -0.28 0.00 -0.05 0.00 -0.13 0.00 0.00 59.36 58.91 1xmw h GLU 27 Cb 1.21 0.00 -0.03 0.00 0.63 0.00 0.00 28.75 30.56 1xmw h GLU 27 CO 0.55 0.00 -0.17 0.09 -0.73 0.00 0.00 179.01 178.75 1xmw n ASN 28 N -3.64 2.43 -4.59 1.04 3.02 -1.26 -4.95 115.26 107.31 1xmw n ASN 28 Ca 0.11 -3.51 -0.42 0.00 -0.03 0.00 0.00 54.58 50.72 1xmw n ASN 28 Cb 0.81 -0.53 -0.03 0.00 -0.61 0.00 0.00 39.78 39.42 1xmw n ASN 28 CO 0.00 0.00 0.00 -0.22 -2.62 0.00 0.00 177.26 174.42 1xmw s LEU 29 N -3.08 3.43 -0.24 3.41 2.96 0.41 -4.64 118.68 120.94 1xmw s LEU 29 Ca 0.39 1.76 -0.17 0.00 -0.22 0.00 0.00 54.13 55.89 1xmw s LEU 29 Cb 0.35 -3.41 -0.03 0.00 0.50 0.00 0.00 46.19 43.60 1xmw s LEU 29 CO 0.00 -2.05 0.44 -1.59 -1.32 0.00 0.00 176.35 171.83 1xmw s LYS 30 N 6.52 4.11 0.70 1.98 -2.85 0.07 -4.07 119.74 126.20 1xmw s LYS 30 Ca 0.99 0.23 -0.03 0.00 -1.00 0.00 0.00 55.97 56.15 1xmw s LYS 30 Cb -0.30 -3.60 0.10 0.00 -2.06 0.00 0.00 37.83 31.96 1xmw s LYS 30 CO 0.34 -0.20 0.98 -1.58 0.10 0.00 0.00 175.35 174.99 1xmw s TRP 31 N 1.84 2.12 -0.16 1.78 0.52 -1.26 -0.68 118.94 123.10 1xmw s TRP 31 Ca 0.19 -0.02 -0.13 0.00 0.02 0.00 0.00 56.10 56.16 1xmw s TRP 31 Cb -0.15 -3.09 0.04 0.00 -1.15 0.00 0.00 33.47 29.12 1xmw s TRP 31 CO 0.09 -1.56 0.40 -1.21 0.02 0.00 0.00 176.95 174.69 1xmw s GLU 32 N -5.15 0.45 -0.06 4.98 2.02 0.44 -2.03 118.70 119.35 1xmw s GLU 32 Ca 0.64 0.61 0.01 0.00 0.02 0.00 0.00 54.97 56.25 1xmw s GLU 32 Cb -0.07 0.17 0.02 0.00 0.10 0.00 0.00 34.13 34.35 1xmw s GLU 32 CO 0.44 -0.08 -0.07 -1.59 0.02 0.00 0.00 175.26 173.98 1xmw s LYS 33 N 0.48 1.17 -1.06 1.61 -2.85 0.21 -1.51 119.74 117.79 1xmw s LYS 33 Ca -0.02 -0.21 0.00 0.00 -1.00 0.00 0.00 55.97 54.74 1xmw s LYS 33 Cb -0.04 -1.10 0.00 0.00 -2.06 0.00 0.00 37.83 34.63 1xmw s LYS 33 CO -0.02 -0.07 0.00 -1.71 0.10 0.00 0.00 175.35 173.64 1xmw n ASN 34 N 4.11 -3.39 -0.15 0.03 2.85 -0.97 -0.18 115.26 117.56 1xmw n ASN 34 Ca -0.22 0.24 0.00 0.00 -0.11 0.00 0.00 54.58 54.49 1xmw n ASN 34 Cb 0.51 -3.02 0.00 0.00 1.24 0.00 0.00 39.78 38.51 1xmw n ASN 34 CO 0.00 0.00 0.00 0.61 -2.11 0.00 0.00 177.26 175.76 1xmw n GLY 35 N -0.55 0.93 2.82 8.20 0.00 -1.26 -5.02 105.19 110.31 1xmw n GLY 35 Ca -0.13 -0.54 -0.16 0.00 0.00 0.00 0.00 46.02 45.20 1xmw n GLY 35 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 1xmw s GLN 36 N -3.17 0.02 0.74 1.61 -0.44 0.75 -5.12 119.66 114.05 1xmw s GLN 36 Ca 0.00 0.39 -0.15 0.00 -2.50 0.00 0.00 55.36 53.10 1xmw s GLN 36 Cb 0.00 -0.28 0.05 0.00 -1.64 0.00 0.00 33.01 31.13 1xmw s GLN 36 CO 0.00 -0.24 1.22 -1.21 0.50 0.00 0.00 175.29 175.56 1xmw s GLU 37 N 1.66 2.04 -0.58 1.67 8.01 -1.26 0.64 118.70 130.88 1xmw s GLU 37 Ca -0.03 1.80 -0.02 0.00 0.01 0.00 0.00 54.97 56.73 1xmw s GLU 37 Cb -0.12 -1.82 0.15 0.00 -4.31 0.00 0.00 34.13 28.03 1xmw s GLU 37 CO -0.05 -1.92 0.38 -0.51 0.01 0.00 0.00 175.26 173.17 1xmw s LEU 38 N -5.21 5.18 -1.43 1.80 1.43 -0.86 -4.77 118.68 114.82 1xmw s LEU 38 Ca 0.75 -2.72 -0.09 0.00 -1.03 0.00 0.00 54.13 51.04 1xmw s LEU 38 Cb -0.30 -1.83 -0.10 0.00 0.03 0.00 0.00 46.19 43.98 1xmw s LEU 38 CO 0.46 -0.39 3.03 -0.81 0.23 0.00 0.00 176.35 178.87 1xmw n PRO 39 N 3.66 3.53 -2.54 1.29 -0.04 -1.26 -4.08 135.00 135.57 1xmw n PRO 39 Ca 0.06 -2.10 -0.04 0.00 -0.04 0.00 0.00 63.50 61.38 1xmw n PRO 39 Cb 0.38 -2.70 0.08 0.00 -0.04 0.00 0.00 33.50 31.23 1xmw n PRO 39 CO 0.00 0.00 0.00 1.04 -0.04 0.00 0.00 175.50 176.50 1xmw n GLN 40 N 3.39 0.93 0.01 0.54 1.13 -1.26 -5.03 117.38 117.09 1xmw n GLN 40 Ca 0.74 -1.20 0.00 0.00 -1.94 0.00 0.00 57.00 54.60 1xmw n GLN 40 Cb 0.31 0.12 0.00 0.00 0.11 0.00 0.00 30.24 30.78 1xmw n GLN 40 CO 0.00 0.00 0.00 1.63 -1.44 0.00 0.00 177.06 177.25 1xmw n LYS 41 N -0.82 0.00 -1.74 -1.09 4.76 -1.26 -5.01 118.16 113.01 1xmw n LYS 41 Ca -0.12 0.00 -0.14 0.00 -2.87 0.00 0.00 58.31 55.18 1xmw n LYS 41 Cb 0.78 0.00 -0.04 0.00 -1.84 0.00 0.00 35.03 33.93 1xmw n LYS 41 CO 0.00 0.00 0.00 0.72 -1.37 0.00 0.00 177.40 176.75 1xmw n HIS 42 N -2.08 -0.65 -4.21 2.13 8.25 -1.26 -4.94 115.22 112.47 1xmw n HIS 42 Ca 0.00 0.00 -0.25 0.00 -0.26 0.00 0.00 57.72 57.21 1xmw n HIS 42 Cb 0.00 -2.78 -0.07 0.00 1.12 0.00 0.00 29.99 28.26 1xmw n HIS 42 CO 0.00 0.00 0.00 -0.51 0.64 0.00 0.00 176.34 176.47 1xmw s ASP 43 N -2.14 4.89 0.63 0.41 1.01 -1.26 -4.27 116.67 115.93 1xmw s ASP 43 Ca 0.00 -0.43 0.35 0.00 0.71 0.00 0.00 52.55 53.19 1xmw s ASP 43 Cb 0.00 -1.06 2.02 0.00 1.01 0.00 0.00 42.92 44.89 1xmw s ASP 43 CO 0.00 0.04 2.25 0.50 0.21 0.00 0.00 175.17 178.17 1xmw h LYS 44 N 2.24 0.00 -5.87 8.23 3.11 -1.90 -3.41 116.57 118.97 1xmw h LYS 44 Ca -0.46 0.00 -0.67 0.00 -2.81 0.00 0.00 60.65 56.70 1xmw h LYS 44 Cb 1.22 0.00 -0.19 0.00 -1.00 0.00 0.00 32.23 32.27 1xmw h LYS 44 CO 0.59 0.00 -0.67 -1.01 -2.81 0.00 0.00 179.45 175.56 1xmw s HIS 45 N -4.41 3.02 -0.61 1.91 3.76 -1.26 0.74 115.29 118.46 1xmw s HIS 45 Ca -0.05 -0.01 -0.07 0.00 -0.15 0.00 0.00 55.06 54.78 1xmw s HIS 45 Cb 0.14 -1.80 0.16 0.00 1.11 0.00 0.00 32.58 32.19 1xmw s HIS 45 CO 0.47 0.27 0.46 -1.17 -0.85 0.00 0.00 174.74 173.93 1xmw s LEU 46 N -0.52 5.65 -0.05 0.89 2.96 0.33 -4.82 118.68 123.13 1xmw s LEU 46 Ca 0.08 -2.52 -0.25 0.00 -0.22 0.00 0.00 54.13 51.21 1xmw s LEU 46 Cb -0.12 -1.96 -0.03 0.00 0.50 0.00 0.00 46.19 44.58 1xmw s LEU 46 CO 0.02 -0.50 0.79 -0.69 -1.32 0.00 0.00 176.35 174.65 1xmw s VAL 47 N 0.43 4.99 -0.35 1.68 1.01 -1.25 -1.29 120.40 125.63 1xmw s VAL 47 Ca 0.14 1.64 0.00 0.00 0.00 0.00 0.00 61.98 63.75 1xmw s VAL 47 Cb -0.20 -4.13 0.09 0.00 0.00 0.00 0.00 36.38 32.14 1xmw s VAL 47 CO -0.04 0.22 0.09 -0.76 0.00 0.00 0.00 175.10 174.61 1xmw s LEU 48 N 0.88 4.68 0.38 3.92 1.43 0.41 -4.86 118.68 125.51 1xmw s LEU 48 Ca 0.42 -1.88 -0.25 0.00 -1.03 0.00 0.00 54.13 51.39 1xmw s LEU 48 Cb -0.19 -1.72 -0.09 0.00 0.03 0.00 0.00 46.19 44.23 1xmw s LEU 48 CO 0.21 -0.40 1.07 -1.10 0.23 0.00 0.00 176.35 176.35 1xmw s GLN 49 N 1.08 4.24 -1.18 1.70 1.11 -1.26 -1.93 119.66 123.42 1xmw s GLN 49 Ca 0.05 1.59 -0.12 0.00 0.01 0.00 0.00 55.36 56.89 1xmw s GLN 49 Cb -0.21 -2.67 -0.02 0.00 -1.01 0.00 0.00 33.01 29.10 1xmw s GLN 49 CO -0.05 -0.09 0.77 -0.25 0.01 0.00 0.00 175.29 175.68 1xmw n ASP 50 N 0.18 -4.25 -4.55 5.90 9.92 -0.78 -4.81 116.55 118.15 1xmw n ASP 50 Ca 0.04 -0.91 -0.37 0.00 -0.53 0.00 0.00 54.79 53.02 1xmw n ASP 50 Cb 0.48 -3.87 -0.03 0.00 -0.64 0.00 0.00 41.12 37.06 1xmw n ASP 50 CO 0.00 0.00 0.00 0.12 0.13 0.00 0.00 177.20 177.45 1xmw s PHE 51 N -3.53 1.77 0.14 1.24 5.36 -0.10 -4.96 117.98 117.90 1xmw s PHE 51 Ca 0.33 0.63 -0.30 0.00 -0.96 0.00 0.00 56.93 56.63 1xmw s PHE 51 Cb -0.10 -4.15 -0.07 0.00 -0.34 0.00 0.00 43.02 38.36 1xmw s PHE 51 CO 0.83 -2.18 1.05 -1.12 -1.46 0.00 0.00 175.22 172.34 1xmw s SER 52 N 7.57 7.35 0.00 6.13 0.01 -1.26 -4.25 113.70 129.25 1xmw s SER 52 Ca 0.64 1.96 0.19 0.00 1.31 0.00 0.00 55.95 60.05 1xmw s SER 52 Cb -0.11 -2.60 0.95 0.00 0.21 0.00 0.00 66.02 64.47 1xmw s SER 52 CO 0.16 -0.18 1.56 1.21 0.41 0.00 0.00 173.24 176.40 1xmw n GLU 53 N 2.66 0.28 -0.10 12.44 0.00 -1.26 -0.53 120.64 134.13 1xmw n GLU 53 Ca 0.03 0.11 -0.23 0.00 0.00 0.00 0.00 57.16 57.07 1xmw n GLU 53 Cb 0.47 -1.50 -0.12 0.00 0.00 0.00 0.00 31.44 30.30 1xmw n GLU 53 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.13 177.41 1xmw n VAL 54 N -1.27 1.56 -0.06 6.31 0.31 -1.26 -4.21 118.33 119.71 1xmw n VAL 54 Ca 0.09 -0.46 -0.04 0.00 -0.01 0.00 0.00 64.34 63.91 1xmw n VAL 54 Cb 0.14 -1.69 -0.12 0.00 -0.91 0.00 0.00 33.84 31.26 1xmw n VAL 54 CO 0.00 0.00 0.00 -0.62 -1.32 0.00 0.00 176.83 174.89 1xmw n GLU 55 N -3.74 1.39 0.08 5.55 1.02 -1.22 -4.59 120.64 119.13 1xmw n GLU 55 Ca -0.44 -0.03 -0.18 0.00 -0.02 0.00 0.00 57.16 56.48 1xmw n GLU 55 Cb 0.93 -1.38 -0.14 0.00 -0.02 0.00 0.00 31.44 30.83 1xmw n GLU 55 CO 0.00 0.00 0.00 0.22 1.18 0.00 0.00 177.13 178.53 1xmw h ASP 56 N 0.00 0.47 -3.98 1.62 1.82 -1.09 -3.46 116.42 111.80 1xmw h ASP 56 Ca -0.32 -0.58 -0.52 0.00 -0.39 0.00 0.00 57.03 55.21 1xmw h ASP 56 Cb 1.67 -0.15 0.08 0.00 0.68 0.00 0.00 39.33 41.61 1xmw h ASP 56 CO 0.02 1.48 0.57 -0.94 -1.61 0.00 0.00 179.24 178.75 1xmw s SER 57 N -7.11 6.11 0.00 2.28 1.04 -1.05 -4.87 113.70 110.10 1xmw s SER 57 Ca -0.08 2.55 0.00 0.00 0.48 0.00 0.00 55.95 58.90 1xmw s SER 57 Cb 0.06 -2.63 0.00 0.00 0.10 0.00 0.00 66.02 63.56 1xmw s SER 57 CO 0.87 -0.98 0.00 0.61 0.98 0.00 0.00 173.24 174.73 1xmw n GLY 58 N 0.62 0.06 3.87 7.32 0.00 -0.99 -4.90 105.19 111.16 1xmw n GLY 58 Ca 0.06 -1.22 -0.30 0.00 0.00 0.00 0.00 46.02 44.55 1xmw n GLY 58 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1xmw s TYR 59 N -3.69 3.48 -0.23 1.61 2.02 -1.26 -1.79 117.35 117.49 1xmw s TYR 59 Ca 0.00 1.11 -0.13 0.00 -0.37 0.00 0.00 57.07 57.68 1xmw s TYR 59 Cb 0.00 -2.50 0.07 0.00 -0.40 0.00 0.00 41.96 39.13 1xmw s TYR 59 CO 0.00 -0.20 0.56 0.71 -1.57 0.00 0.00 175.55 175.06 1xmw s TYR 60 N -2.49 -0.84 0.19 2.71 2.02 0.12 -2.30 117.35 116.76 1xmw s TYR 60 Ca 0.52 1.74 -0.19 0.00 -0.37 0.00 0.00 57.07 58.78 1xmw s TYR 60 Cb -0.10 0.45 0.03 0.00 -0.40 0.00 0.00 41.96 41.94 1xmw s TYR 60 CO 0.34 -0.44 0.54 0.54 -1.57 0.00 0.00 175.55 174.96 1xmw s VAL 61 N 1.45 0.02 0.12 0.71 0.11 -0.57 -1.85 120.40 120.39 1xmw s VAL 61 Ca -0.09 -0.67 -0.04 0.00 -2.93 0.00 0.00 61.98 58.25 1xmw s VAL 61 Cb -0.06 -1.50 -0.03 0.00 -1.53 0.00 0.00 36.38 33.25 1xmw s VAL 61 CO -0.16 -0.10 0.10 0.00 -3.33 0.00 0.00 175.10 171.61 1xmw s TYR 63 N -3.98 -0.18 0.34 0.00 2.02 0.14 -4.82 117.35 110.86 1xmw s TYR 63 Ca 0.17 -0.14 0.06 0.00 -0.37 0.00 0.00 57.07 56.80 1xmw s TYR 63 Cb 0.06 0.24 -0.07 0.00 -0.40 0.00 0.00 41.96 41.79 1xmw s TYR 63 CO -0.02 -0.69 -0.01 0.95 -1.57 0.00 0.00 175.55 174.21 1xmw s THR 64 N -3.77 1.72 -1.14 -0.71 -4.23 -1.01 -0.75 115.64 105.75 1xmw s THR 64 Ca 0.03 -2.06 0.14 0.00 -1.18 0.00 0.00 61.69 58.62 1xmw s THR 64 Cb 0.02 -2.74 0.16 0.00 1.34 0.00 0.00 72.50 71.28 1xmw s THR 64 CO -0.12 -0.11 1.44 -0.81 -0.54 0.00 0.00 174.62 174.48 1xmw n PRO 65 N -0.76 0.07 0.00 3.99 -0.04 -1.26 -3.20 135.00 133.80 1xmw n PRO 65 Ca -0.04 0.22 0.00 0.00 -0.04 0.00 0.00 63.50 63.63 1xmw n PRO 65 Cb 0.65 -1.50 0.00 0.00 -0.04 0.00 0.00 33.50 32.61 1xmw n PRO 65 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1xmw n ALA 66 N -1.43 1.31 -4.00 0.55 0.00 -1.26 -4.99 120.51 110.69 1xmw n ALA 66 Ca 0.05 0.00 -0.32 0.00 0.00 0.00 0.00 53.44 53.16 1xmw n ALA 66 Cb 0.15 0.00 -0.15 0.00 0.00 0.00 0.00 19.45 19.45 1xmw n ALA 66 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.50 175.96 1xmw s SER 67 N -1.00 4.57 -0.35 0.00 1.04 -1.19 -5.07 113.70 111.69 1xmw s SER 67 Ca 0.00 -1.50 -0.05 0.00 0.48 0.00 0.00 55.95 54.88 1xmw s SER 67 Cb 0.00 -1.59 0.06 0.00 0.10 0.00 0.00 66.02 64.59 1xmw s SER 67 CO 0.00 -0.23 0.11 0.20 0.98 0.00 0.00 173.24 174.30 1xmw s ASN 68 N 1.10 5.21 -0.25 7.02 -0.87 -1.26 -2.39 114.94 123.50 1xmw s ASN 68 Ca -0.05 -1.40 0.00 0.00 -1.57 0.00 0.00 52.86 49.84 1xmw s ASN 68 Cb -0.20 -1.83 0.07 0.00 -0.02 0.00 0.00 41.25 39.27 1xmw s ASN 68 CO -0.05 -0.37 -0.01 -0.75 -2.57 0.00 0.00 177.10 173.34 1xmw s LYS 69 N 1.31 1.39 -0.60 -0.60 2.20 -1.26 -5.06 119.74 117.11 1xmw s LYS 69 Ca -0.00 -1.02 -0.26 0.00 -0.36 0.00 0.00 55.97 54.33 1xmw s LYS 69 Cb -0.21 -2.52 -0.06 0.00 -1.51 0.00 0.00 37.83 33.54 1xmw s LYS 69 CO 0.00 -0.68 2.18 0.54 -0.36 0.00 0.00 175.35 177.02 1xmw s ASN 70 N 1.43 4.73 -0.24 1.43 4.22 -1.26 -4.87 114.94 120.37 1xmw s ASN 70 Ca -0.02 0.57 -0.04 0.00 -2.14 0.00 0.00 52.86 51.23 1xmw s ASN 70 Cb -0.18 -2.52 0.08 0.00 1.28 0.00 0.00 41.25 39.91 1xmw s ASN 70 CO -0.09 -2.80 0.11 -0.89 -2.04 0.00 0.00 177.10 171.39 1xmw s THR 71 N 11.20 0.02 0.05 0.54 2.01 -1.26 -2.91 115.64 125.30 1xmw s THR 71 Ca 0.84 -0.58 -0.15 0.00 0.31 0.00 0.00 61.69 62.11 1xmw s THR 71 Cb -0.14 -0.88 -0.06 0.00 0.01 0.00 0.00 72.50 71.43 1xmw s THR 71 CO 0.20 -0.53 0.47 -0.31 -0.69 0.00 0.00 174.62 173.76 1xmw s TYR 72 N 2.07 3.71 -0.09 4.92 1.51 -0.91 -4.69 117.35 123.87 1xmw s TYR 72 Ca 0.06 1.05 -0.01 0.00 -1.01 0.00 0.00 57.07 57.16 1xmw s TYR 72 Cb -0.16 -2.34 0.03 0.00 -0.11 0.00 0.00 41.96 39.38 1xmw s TYR 72 CO -0.25 0.58 -0.03 -1.17 -1.11 0.00 0.00 175.55 173.57 1xmw s LEU 73 N -1.33 0.87 -0.13 -1.29 2.96 -0.77 -0.71 118.68 118.28 1xmw s LEU 73 Ca 0.28 -0.18 -0.06 0.00 -0.22 0.00 0.00 54.13 53.95 1xmw s LEU 73 Cb -0.17 -0.62 -0.04 0.00 0.50 0.00 0.00 46.19 45.86 1xmw s LEU 73 CO 0.16 -0.16 0.10 -0.47 -1.32 0.00 0.00 176.35 174.67 1xmw s TYR 74 N 1.84 3.46 -0.05 5.38 6.14 -0.15 0.11 117.35 134.07 1xmw s TYR 74 Ca 0.05 0.39 0.02 0.00 0.64 0.00 0.00 57.07 58.17 1xmw s TYR 74 Cb -0.12 -1.95 0.01 0.00 0.42 0.00 0.00 41.96 40.32 1xmw s TYR 74 CO -0.07 0.57 -0.09 -1.17 0.64 0.00 0.00 175.55 175.44 1xmw s LEU 75 N -0.69 1.56 -0.33 6.97 2.96 -0.74 -2.37 118.68 126.03 1xmw s LEU 75 Ca 0.13 -0.22 -0.00 0.00 -0.22 0.00 0.00 54.13 53.81 1xmw s LEU 75 Cb -0.12 -0.65 0.10 0.00 0.50 0.00 0.00 46.19 46.03 1xmw s LEU 75 CO 0.03 0.01 0.11 -0.75 -1.32 0.00 0.00 176.35 174.42 1xmw s LYS 76 N 0.67 0.83 0.34 1.98 2.20 -1.09 -2.35 119.74 122.31 1xmw s LYS 76 Ca -0.12 -1.24 0.04 0.00 -0.36 0.00 0.00 55.97 54.29 1xmw s LYS 76 Cb -0.14 -2.12 -0.06 0.00 -1.51 0.00 0.00 37.83 34.00 1xmw s LYS 76 CO 0.02 -1.00 0.07 0.00 -0.36 0.00 0.00 175.35 174.07 1xmw s ALA 77 N 1.43 2.47 -0.07 3.13 0.00 -1.26 0.17 121.76 127.63 1xmw s ALA 77 Ca 0.11 -1.92 0.01 0.00 0.00 0.00 0.00 51.96 50.16 1xmw s ALA 77 Cb -0.18 0.66 0.02 0.00 0.00 0.00 0.00 23.12 23.62 1xmw s ALA 77 CO -0.21 -0.31 -0.06 0.50 0.00 0.00 0.00 175.76 175.68 1xmw s ARG 78 N -3.87 1.16 -0.15 0.00 3.52 -1.26 -4.19 118.95 114.15 1xmw s ARG 78 Ca 0.34 -0.19 -0.04 0.00 -0.13 0.00 0.00 55.73 55.72 1xmw s ARG 78 Cb 0.08 -1.14 0.07 0.00 -1.56 0.00 0.00 34.95 32.40 1xmw s ARG 78 CO 0.15 -0.12 0.24 0.14 -0.81 0.00 0.00 175.30 174.90 1xmw s VAL 79 N 1.13 -0.37 0.00 7.11 -7.23 -1.26 -5.03 120.40 114.75 1xmw s VAL 79 Ca -0.07 0.14 0.00 0.00 -1.81 0.00 0.00 61.98 60.24 1xmw s VAL 79 Cb -0.14 -0.52 0.00 0.00 0.56 0.00 0.00 36.38 36.28 1xmw s VAL 79 CO -0.01 0.00 0.00 0.61 -0.31 0.00 0.00 175.10 175.39 1xmw n GLY 80 N 5.34 -0.77 3.15 2.32 0.00 -1.26 -4.77 105.19 109.20 1xmw n GLY 80 Ca -0.05 -1.03 0.04 0.00 0.00 0.00 0.00 46.02 44.98 1xmw n GLY 80 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1xmw s SER 81 N -4.00 -1.23 -0.40 1.61 1.04 -1.26 -4.94 113.70 104.53 1xmw s SER 81 Ca 0.00 0.25 0.07 0.00 0.48 0.00 0.00 55.95 56.75 1xmw s SER 81 Cb 0.00 1.82 0.23 0.00 0.10 0.00 0.00 66.02 68.18 1xmw s SER 81 CO 0.00 -0.23 0.49 0.00 0.98 0.00 0.00 173.24 174.49 1xmw n ALA 82 N 5.35 2.39 -2.22 5.32 0.00 -1.26 -5.09 120.51 125.00 1xmw n ALA 82 Ca 0.04 -3.27 -0.43 0.00 0.00 0.00 0.00 53.44 49.78 1xmw n ALA 82 Cb 0.54 -0.82 -0.02 0.00 0.00 0.00 0.00 19.45 19.15 1xmw n ALA 82 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 1xmw s ASP 83 N -0.93 6.32 -0.71 0.00 1.11 -1.26 -4.93 116.67 116.27 1xmw s ASP 83 Ca 0.34 1.25 0.04 0.00 0.18 0.00 0.00 52.55 54.37 1xmw s ASP 83 Cb 0.14 -2.53 0.23 0.00 1.07 0.00 0.00 42.92 41.83 1xmw s ASP 83 CO -0.13 -1.37 0.75 0.47 1.18 0.00 0.00 175.17 176.07 1xmw n ASP 84 N 8.77 3.83 -1.58 0.27 9.92 -1.26 -4.85 116.55 131.64 1xmw n ASP 84 Ca 0.18 -3.37 -0.13 0.00 -0.53 0.00 0.00 54.79 50.94 1xmw n ASP 84 Cb 0.47 -0.77 0.17 0.00 -0.64 0.00 0.00 41.12 40.35 1xmw n ASP 84 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 1xmw n ALA 85 N 1.26 4.87 -2.95 2.24 0.00 -1.26 -4.87 120.51 119.79 1xmw n ALA 85 Ca 0.27 -3.20 -0.44 0.00 0.00 0.00 0.00 53.44 50.07 1xmw n ALA 85 Cb 0.39 -0.95 0.00 0.00 0.00 0.00 0.00 19.45 18.89 1xmw n ALA 85 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 1xmw n LYS 86 N -1.08 3.44 -1.97 0.00 5.02 -1.26 -4.86 118.16 117.46 1xmw n LYS 86 Ca 0.43 -3.93 -0.36 0.00 -2.02 0.00 0.00 58.31 52.43 1xmw n LYS 86 Cb 1.13 -2.94 -0.00 0.00 -0.02 0.00 0.00 35.03 33.19 1xmw n LYS 86 CO 0.00 0.00 0.00 1.63 -0.52 0.00 0.00 177.40 178.51 1xmw n LYS 87 N 4.93 3.69 -3.71 1.97 5.02 -1.26 -4.80 118.16 123.99 1xmw n LYS 87 Ca 0.35 -3.41 -0.32 0.00 -2.02 0.00 0.00 58.31 52.92 1xmw n LYS 87 Cb 0.41 -2.36 -0.09 0.00 -0.02 0.00 0.00 35.03 32.97 1xmw n LYS 87 CO 0.00 0.00 0.00 -0.40 -0.52 0.00 0.00 177.40 176.48 1xmw n ASP 88 N 0.54 3.71 0.11 4.39 5.75 -1.26 -4.75 116.55 125.04 1xmw n ASP 88 Ca 0.53 -3.22 0.00 0.00 -0.01 0.00 0.00 54.79 52.09 1xmw n ASP 88 Cb 0.34 -0.88 0.00 0.00 -1.03 0.00 0.00 41.12 39.54 1xmw n ASP 88 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 1xmw n ALA 89 N 1.94 1.07 -2.85 2.12 0.00 -1.26 -5.07 120.51 116.46 1xmw n ALA 89 Ca 0.22 0.00 -0.04 0.00 0.00 0.00 0.00 53.44 53.62 1xmw n ALA 89 Cb 0.36 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.82 1xmw n ALA 89 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1xmw s ALA 90 N -2.00 -1.99 0.30 0.00 0.00 -1.26 -5.14 121.76 111.66 1xmw s ALA 90 Ca 0.00 -0.42 -0.22 0.00 0.00 0.00 0.00 51.96 51.32 1xmw s ALA 90 Cb 0.00 -2.67 -0.09 0.00 0.00 0.00 0.00 23.12 20.35 1xmw s ALA 90 CO 0.00 -2.23 0.85 0.15 0.00 0.00 0.00 175.76 174.53 1xmw s LYS 91 N 0.97 4.37 -0.72 0.00 -0.14 -1.26 -4.33 119.74 118.63 1xmw s LYS 91 Ca 0.28 1.08 -0.04 0.00 -1.36 0.00 0.00 55.97 55.93 1xmw s LYS 91 Cb -0.01 -2.73 0.01 0.00 -1.68 0.00 0.00 37.83 33.43 1xmw s LYS 91 CO -0.06 0.28 0.65 1.63 -0.76 0.00 0.00 175.35 177.09 1xmw n LYS 92 N 0.40 -1.54 0.00 1.68 5.02 -1.26 -4.99 118.16 117.47 1xmw n LYS 92 Ca 0.01 1.29 0.00 0.00 -2.02 0.00 0.00 58.31 57.59 1xmw n LYS 92 Cb 0.51 -4.27 0.00 0.00 -0.02 0.00 0.00 35.03 31.26 1xmw n LYS 92 CO 0.00 0.00 0.00 -3.47 -0.52 0.00 0.00 177.40 173.41 1xmw n ASP 93 N -1.83 0.00 -2.69 4.39 2.03 -1.26 -5.02 116.55 112.16 1xmw n ASP 93 Ca -0.11 0.01 -0.05 0.00 0.52 0.00 0.00 54.79 55.16 1xmw n ASP 93 Cb 0.58 -0.24 0.09 0.00 -0.72 0.00 0.00 41.12 40.82 1xmw n ASP 93 CO 0.00 0.00 0.00 -0.67 -1.92 0.00 0.00 177.20 174.61 1xmw n ASP 94 N -1.96 -1.70 -5.02 1.67 2.03 -1.26 -5.16 116.55 105.14 1xmw n ASP 94 Ca 0.00 -2.39 -0.19 0.00 0.52 0.00 0.00 54.79 52.73 1xmw n ASP 94 Cb 0.00 1.27 0.05 0.00 -0.72 0.00 0.00 41.12 41.72 1xmw n ASP 94 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 1xmw s ALA 95 N 0.20 4.64 -0.07 -1.67 0.00 -1.26 -5.08 121.76 118.53 1xmw s ALA 95 Ca 0.24 -2.00 -0.05 0.00 0.00 0.00 0.00 51.96 50.16 1xmw s ALA 95 Cb 0.26 -1.52 -0.02 0.00 0.00 0.00 0.00 23.12 21.84 1xmw s ALA 95 CO -0.15 -0.70 -0.09 1.63 0.00 0.00 0.00 175.76 176.45 1xmw n LYS 96 N -2.14 0.21 -1.70 0.00 4.76 -1.26 -4.77 118.16 113.26 1xmw n LYS 96 Ca 0.13 0.35 -0.38 0.00 -2.87 0.00 0.00 58.31 55.55 1xmw n LYS 96 Cb 0.61 -1.17 -0.03 0.00 -1.84 0.00 0.00 35.03 32.60 1xmw n LYS 96 CO 0.00 0.00 0.00 0.15 -1.37 0.00 0.00 177.40 176.18 1xmw s LYS 97 N -1.60 2.49 0.15 1.97 -0.14 -1.26 -4.66 119.74 116.69 1xmw s LYS 97 Ca -0.07 1.36 0.00 0.00 -1.36 0.00 0.00 55.97 55.90 1xmw s LYS 97 Cb 0.01 -4.48 0.00 0.00 -1.68 0.00 0.00 37.83 31.69 1xmw s LYS 97 CO 0.11 -2.84 0.00 -0.25 -0.76 0.00 0.00 175.35 171.61 1xmw n ASP 98 N 14.06 0.62 -3.32 2.83 9.92 -1.26 -4.85 116.55 134.55 1xmw n ASP 98 Ca 0.31 0.24 -0.38 0.00 -0.53 0.00 0.00 54.79 54.43 1xmw n ASP 98 Cb 0.52 -0.08 -0.02 0.00 -0.64 0.00 0.00 41.12 40.90 1xmw n ASP 98 CO 0.00 0.00 0.00 0.47 0.13 0.00 0.00 177.20 177.80 1xmw n ASP 99 N -3.43 7.99 -3.73 -2.24 9.92 -1.26 -4.76 116.55 119.04 1xmw n ASP 99 Ca 0.00 -3.02 -0.30 0.00 -0.53 0.00 0.00 54.79 50.94 1xmw n ASP 99 Cb 0.03 -1.39 -0.08 0.00 -0.64 0.00 0.00 41.12 39.04 1xmw n ASP 99 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 1xmw n ALA 100 N 2.03 3.96 -2.08 2.24 0.00 -1.26 -4.82 120.51 120.58 1xmw n ALA 100 Ca 0.64 -4.68 -0.03 0.00 0.00 0.00 0.00 53.44 49.37 1xmw n ALA 100 Cb 0.29 -1.22 0.10 0.00 0.00 0.00 0.00 19.45 18.62 1xmw n ALA 100 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 1xmw n LYS 101 N 1.45 1.82 -4.39 0.00 4.01 -1.26 -5.05 118.16 114.74 1xmw n LYS 101 Ca 0.25 -3.30 -0.33 0.00 -0.51 0.00 0.00 58.31 54.43 1xmw n LYS 101 Cb 0.38 -1.46 -0.10 0.00 -0.51 0.00 0.00 35.03 33.34 1xmw n LYS 101 CO 0.00 0.00 0.00 0.21 -1.11 0.00 0.00 177.40 176.50 1xmw s LYS 102 N -2.75 2.72 -0.37 1.97 2.20 -1.26 -5.08 119.74 117.17 1xmw s LYS 102 Ca 0.39 -0.62 0.06 0.00 -0.36 0.00 0.00 55.97 55.44 1xmw s LYS 102 Cb 0.38 -2.61 0.18 0.00 -1.51 0.00 0.00 37.83 34.26 1xmw s LYS 102 CO -0.06 0.63 0.55 0.34 -0.36 0.00 0.00 175.35 176.45 1xmw s ASP 103 N -1.36 -0.76 0.00 1.43 2.15 -1.26 -5.10 116.67 111.77 1xmw s ASP 103 Ca 0.17 -0.76 0.00 0.00 0.43 0.00 0.00 52.55 52.39 1xmw s ASP 103 Cb -0.11 1.58 0.00 0.00 -0.30 0.00 0.00 42.92 44.09 1xmw s ASP 103 CO 0.08 -0.23 0.00 0.61 -0.17 0.00 0.00 175.17 175.46 1xmw n GLY 104 N 4.63 1.40 3.62 2.66 0.00 -1.26 -4.87 105.19 111.38 1xmw n GLY 104 Ca 0.09 -1.51 -0.43 0.00 0.00 0.00 0.00 46.02 44.17 1xmw n GLY 104 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1xmw s SER 105 N -0.27 6.77 -0.26 1.61 0.01 -1.26 -4.46 113.70 115.84 1xmw s SER 105 Ca 0.00 0.76 -0.07 0.00 1.31 0.00 0.00 55.95 57.95 1xmw s SER 105 Cb 0.00 -2.49 0.01 0.00 0.21 0.00 0.00 66.02 63.75 1xmw s SER 105 CO 0.00 -0.84 0.18 1.67 0.41 0.00 0.00 173.24 174.65 1xmw n GLN 106 N 6.76 -2.23 -0.01 12.44 -0.06 -1.26 -4.97 117.38 128.04 1xmw n GLN 106 Ca 0.09 1.96 -0.00 0.00 -2.00 0.00 0.00 57.00 57.05 1xmw n GLN 106 Cb 0.48 -3.82 -0.00 0.00 -4.06 0.00 0.00 30.24 22.83 1xmw n GLN 106 CO 0.00 0.00 0.00 1.15 -0.20 0.00 0.00 177.06 178.01 1xmw h THR 107 N 2.93 0.00 -2.02 1.69 2.02 -1.90 -3.49 112.91 112.13 1xmw h THR 107 Ca -0.06 -0.22 0.24 0.00 0.77 0.00 0.00 66.41 67.14 1xmw h THR 107 Cb 0.61 0.00 -0.06 0.00 -1.74 0.00 0.00 68.15 66.96 1xmw h THR 107 CO 0.10 0.00 -0.32 -3.20 0.37 0.00 0.00 175.52 172.48 1xmw n ASN 108 N -2.61 -5.42 -2.70 4.18 2.85 -1.26 -4.90 115.26 105.39 1xmw n ASN 108 Ca -0.00 0.94 -0.06 0.00 -0.11 0.00 0.00 54.58 55.35 1xmw n ASN 108 Cb 0.00 -2.81 0.07 0.00 1.24 0.00 0.00 39.78 38.27 1xmw n ASN 108 CO 0.00 0.00 0.00 2.29 -2.11 0.00 0.00 177.26 177.44 1xmw n LYS 109 N -2.81 0.36 -0.28 1.20 0.00 -1.26 -5.01 118.16 110.36 1xmw n LYS 109 Ca 0.01 -1.07 0.01 0.00 -0.00 0.00 0.00 58.31 57.26 1xmw n LYS 109 Cb 0.40 -0.67 0.22 0.00 -0.00 0.00 0.00 35.03 34.98 1xmw n LYS 109 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.40 177.40 1xmw h ALA 110 N 3.42 1.45 -3.31 0.58 0.00 -2.04 -3.43 119.26 115.93 1xmw h ALA 110 Ca -0.21 -0.05 0.00 0.00 0.00 0.00 0.00 54.91 54.66 1xmw h ALA 110 Cb 1.14 -0.31 0.00 0.00 0.00 0.00 0.00 17.79 18.62 1xmw h ALA 110 CO -0.00 0.48 0.00 1.17 0.00 0.00 0.00 179.25 180.90 1xmw n LYS 111 N -4.44 1.45 -0.83 0.00 4.81 -1.26 -5.13 118.16 112.75 1xmw n LYS 111 Ca 0.11 0.00 0.00 0.00 -0.87 0.00 0.00 58.31 57.55 1xmw n LYS 111 Cb 0.09 0.00 0.00 0.00 0.02 0.00 0.00 35.03 35.14 1xmw n LYS 111 CO 0.00 0.00 0.00 2.89 1.17 0.00 0.00 177.40 181.46 1xmw n ARG 112 N -0.49 0.00 0.00 1.64 1.85 -1.26 -5.19 116.66 113.21 1xmw n ARG 112 Ca 0.00 0.00 0.00 0.00 -1.00 0.00 0.00 57.85 56.85 1xmw n ARG 112 Cb 0.00 0.00 0.00 0.00 -1.05 0.00 0.00 32.46 31.41 1xmw n ARG 112 CO 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 177.63 177.62 1xmw n ALA 113 N -3.00 0.00 -2.63 2.89 0.00 -1.26 -4.93 120.51 111.58 1xmw n ALA 113 Ca 0.00 0.00 -0.29 0.00 0.00 0.00 0.00 53.44 53.15 1xmw n ALA 113 Cb 0.00 0.00 -0.03 0.00 0.00 0.00 0.00 19.45 19.42 1xmw n ALA 113 CO 0.00 0.00 0.00 -1.17 0.00 0.00 0.00 177.50 176.33 1xmw s LEU 114 N 0.00 4.16 0.19 0.00 0.20 -1.26 -3.55 118.68 118.41 1xmw s LEU 114 Ca 0.00 0.59 -0.20 0.00 0.69 0.00 0.00 54.13 55.21 1xmw s LEU 114 Cb 0.00 -3.37 0.05 0.00 -0.43 0.00 0.00 46.19 42.43 1xmw s LEU 114 CO 0.00 -0.10 0.58 -0.70 -0.29 0.00 0.00 176.35 175.85 1xmw s GLU 115 N -3.30 1.38 0.00 1.98 -6.30 0.13 -4.95 118.70 107.64 1xmw s GLU 115 Ca 0.42 -0.70 0.03 0.00 -2.50 0.00 0.00 54.97 52.22 1xmw s GLU 115 Cb -0.11 0.56 -0.01 0.00 0.00 0.00 0.00 34.13 34.57 1xmw s GLU 115 CO 0.28 -0.60 -0.11 0.54 0.02 0.00 0.00 175.26 175.39 1xmw s VAL 116 N -3.82 0.85 0.10 3.70 0.11 -1.26 0.72 120.40 120.80 1xmw s VAL 116 Ca 0.05 -0.54 0.04 0.00 -2.93 0.00 0.00 61.98 58.60 1xmw s VAL 116 Cb -0.02 -0.73 -0.04 0.00 -1.53 0.00 0.00 36.38 34.07 1xmw s VAL 116 CO -0.06 0.18 -0.10 -0.22 -3.33 0.00 0.00 175.10 171.56 1xmw s LEU 117 N -0.41 2.41 -0.33 2.54 2.96 -0.95 -4.98 118.68 119.91 1xmw s LEU 117 Ca 0.03 -0.82 0.04 0.00 -0.22 0.00 0.00 54.13 53.16 1xmw s LEU 117 Cb -0.05 -0.33 0.10 0.00 0.50 0.00 0.00 46.19 46.41 1xmw s LEU 117 CO -0.00 -0.25 0.04 -1.61 -1.32 0.00 0.00 176.35 173.20 1xmw s GLU 118 N -2.81 1.56 0.10 1.98 8.01 -1.26 -2.41 118.70 123.87 1xmw s GLU 118 Ca 0.06 -1.83 0.06 0.00 0.01 0.00 0.00 54.97 53.27 1xmw s GLU 118 Cb -0.03 -3.19 -0.03 0.00 -4.31 0.00 0.00 34.13 26.57 1xmw s GLU 118 CO 0.00 -0.91 -0.16 0.00 0.01 0.00 0.00 175.26 174.21 1xmw s ALA 119 N 0.92 1.47 -1.46 5.21 0.00 0.17 -4.79 121.76 123.28 1xmw s ALA 119 Ca 0.09 -1.19 -0.08 0.00 0.00 0.00 0.00 51.96 50.79 1xmw s ALA 119 Cb -0.19 -0.12 0.05 0.00 0.00 0.00 0.00 23.12 22.86 1xmw s ALA 119 CO -0.08 0.19 0.80 -1.91 0.00 0.00 0.00 175.76 174.76 1xmw n GLU 120 N 0.91 -4.79 -1.67 0.00 2.13 -1.26 0.16 120.64 116.11 1xmw n GLU 120 Ca -0.18 0.55 -0.15 0.00 0.66 0.00 0.00 57.16 58.04 1xmw n GLU 120 Cb 0.55 -5.22 -0.05 0.00 0.27 0.00 0.00 31.44 26.99 1xmw n GLU 120 CO 0.00 0.00 0.00 -3.47 -0.41 0.00 0.00 177.13 173.25 1xmw n ASP 121 N -2.91 -4.20 -4.36 4.31 -0.08 -1.26 -4.93 116.55 103.13 1xmw n ASP 121 Ca -0.11 0.32 -0.19 0.00 -1.51 0.00 0.00 54.79 53.30 1xmw n ASP 121 Cb 0.59 -3.76 -0.10 0.00 2.34 0.00 0.00 41.12 40.19 1xmw n ASP 121 CO 0.00 0.00 0.00 -0.54 0.12 0.00 0.00 177.20 176.78 1xmw s LYS 122 N -3.71 1.36 -0.01 -0.67 -0.14 0.12 -2.75 119.74 113.95 1xmw s LYS 122 Ca 0.00 -1.64 0.01 0.00 -1.36 0.00 0.00 55.97 52.99 1xmw s LYS 122 Cb 0.00 -1.02 0.00 0.00 -1.68 0.00 0.00 37.83 35.13 1xmw s LYS 122 CO 0.00 0.10 -0.04 0.14 -0.76 0.00 0.00 175.35 174.79 1xmw s VAL 123 N -3.07 0.37 0.03 3.17 -7.23 -0.79 -0.65 120.40 112.24 1xmw s VAL 123 Ca 0.24 -0.17 -0.06 0.00 -1.81 0.00 0.00 61.98 60.18 1xmw s VAL 123 Cb 0.02 -0.34 -0.01 0.00 0.56 0.00 0.00 36.38 36.61 1xmw s VAL 123 CO 0.08 0.12 0.11 -0.63 -0.31 0.00 0.00 175.10 174.47 1xmw s ILE 124 N 0.06 0.12 -0.16 -0.62 1.09 -1.01 -3.10 121.20 117.59 1xmw s ILE 124 Ca -0.00 -1.02 -0.05 0.00 -1.10 0.00 0.00 60.65 58.47 1xmw s ILE 124 Cb -0.04 -0.84 -0.04 0.00 -1.06 0.00 0.00 42.46 40.49 1xmw s ILE 124 CO -0.00 -0.56 0.02 -0.76 -0.10 0.00 0.00 174.94 173.53 1xmw s LEU 125 N -2.03 3.60 -0.03 2.97 1.43 -0.54 -2.23 118.68 121.85 1xmw s LEU 125 Ca -0.06 0.03 0.07 0.00 -1.03 0.00 0.00 54.13 53.14 1xmw s LEU 125 Cb -0.02 -1.88 -0.02 0.00 0.03 0.00 0.00 46.19 44.30 1xmw s LEU 125 CO -0.04 0.21 -0.25 -0.54 0.23 0.00 0.00 176.35 175.97 1xmw s LYS 126 N 0.13 2.22 0.17 1.70 1.02 0.22 -0.06 119.74 125.14 1xmw s LYS 126 Ca 0.02 -0.90 0.02 0.00 0.02 0.00 0.00 55.97 55.14 1xmw s LYS 126 Cb -0.13 -2.10 -0.05 0.00 -0.52 0.00 0.00 37.83 35.04 1xmw s LYS 126 CO 0.01 0.54 -0.01 0.00 -0.92 0.00 0.00 175.35 174.98 1xmw n ASN 128 N -0.25 0.00 0.00 0.00 6.94 -1.23 -4.85 115.26 115.87 1xmw n ASN 128 Ca -0.07 -0.63 0.00 0.00 -0.02 0.00 0.00 54.58 53.86 1xmw n ASN 128 Cb 0.63 0.00 0.00 0.00 -2.36 0.00 0.00 39.78 38.05 1xmw n ASN 128 CO 0.00 0.00 0.00 -1.54 -1.03 0.00 0.00 177.26 174.69 1xmw n SER 129 N -0.90 0.00 -4.64 0.53 3.41 -1.26 -5.05 113.62 105.71 1xmw n SER 129 Ca 0.10 0.00 -0.47 0.00 -0.26 0.00 0.00 58.87 58.24 1xmw n SER 129 Cb 0.05 0.00 -0.04 0.00 -0.26 0.00 0.00 64.21 63.96 1xmw n SER 129 CO 0.00 0.00 0.00 -1.54 -0.16 0.00 0.00 175.04 173.34 1xmw n SER 130 N 0.00 2.50 -4.70 4.04 3.41 -1.23 -3.87 113.62 113.77 1xmw n SER 130 Ca 0.00 1.12 -0.38 0.00 -0.26 0.00 0.00 58.87 59.35 1xmw n SER 130 Cb 0.00 -1.36 -0.07 0.00 -0.26 0.00 0.00 64.21 62.52 1xmw n SER 130 CO 0.00 0.00 0.00 -0.63 -0.16 0.00 0.00 175.04 174.25 1xmw s ILE 131 N 0.35 5.22 -0.09 -1.33 1.01 -1.26 -1.50 121.20 123.60 1xmw s ILE 131 Ca 0.75 0.76 -0.26 0.00 0.00 0.00 0.00 60.65 61.90 1xmw s ILE 131 Cb -0.74 -3.74 -0.02 0.00 0.01 0.00 0.00 42.46 37.97 1xmw s ILE 131 CO 0.45 0.31 0.85 -0.89 0.00 0.00 0.00 174.94 175.66 1xmw s THR 132 N 0.86 4.92 -0.63 2.92 2.01 0.45 -4.85 115.64 121.32 1xmw s THR 132 Ca 0.21 1.73 -0.24 0.00 0.31 0.00 0.00 61.69 63.70 1xmw s THR 132 Cb -0.14 -4.17 0.05 0.00 0.01 0.00 0.00 72.50 68.25 1xmw s THR 132 CO 0.08 0.12 1.02 -0.22 -0.69 0.00 0.00 174.62 174.92 1xmw s LEU 133 N 1.46 4.05 -0.06 4.42 1.98 -1.26 -1.05 118.68 128.23 1xmw s LEU 133 Ca 0.43 -0.64 -0.11 0.00 -2.89 0.00 0.00 54.13 50.91 1xmw s LEU 133 Cb -0.18 -2.61 -0.06 0.00 0.66 0.00 0.00 46.19 43.99 1xmw s LEU 133 CO 0.18 -1.43 0.46 -0.07 -1.89 0.00 0.00 176.35 173.60 1xmw h LEU 134 N 11.51 -0.31 0.00 -0.68 3.38 -1.85 -3.48 115.31 123.88 1xmw h LEU 134 Ca -0.28 -0.02 0.00 0.00 0.09 0.00 0.00 57.88 57.68 1xmw h LEU 134 Cb 1.07 0.08 0.00 0.00 0.09 0.00 0.00 40.66 41.90 1xmw h LEU 134 CO 1.16 0.15 0.00 1.67 0.09 0.00 0.00 178.44 181.52 1xmw n GLN 135 N -5.02 0.00 0.00 1.13 -0.06 -1.13 -4.97 117.38 107.32 1xmw n GLN 135 Ca -0.05 0.00 0.00 0.00 -2.00 0.00 0.00 57.00 54.95 1xmw n GLN 135 Cb 0.16 0.00 0.00 0.00 -4.06 0.00 0.00 30.24 26.34 1xmw n GLN 135 CO 0.00 0.00 0.00 0.41 -0.20 0.00 0.00 177.06 177.27 1xmw n GLY 136 N 0.00 0.53 3.54 1.69 0.00 -1.26 -2.21 105.19 107.49 1xmw n GLY 136 Ca 0.00 -0.80 -0.28 0.00 0.00 0.00 0.00 46.02 44.95 1xmw n GLY 136 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1xmw n THR 137 N 0.00 -0.04 -2.12 2.61 -2.24 0.30 -4.81 114.28 107.98 1xmw n THR 137 Ca 0.00 -0.60 -0.41 0.00 -2.27 0.00 0.00 64.05 60.78 1xmw n THR 137 Cb 0.00 -2.09 -0.00 0.00 -2.10 0.00 0.00 70.33 66.14 1xmw n THR 137 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1xmw n ALA 138 N 15.59 6.39 -1.00 6.98 0.00 -1.26 -4.82 120.51 142.39 1xmw n ALA 138 Ca 0.46 -4.18 0.00 0.00 0.00 0.00 0.00 53.44 49.72 1xmw n ALA 138 Cb 0.42 -2.80 0.00 0.00 0.00 0.00 0.00 19.45 17.08 1xmw n ALA 138 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1xmw n GLY 139 N 1.93 -1.66 3.12 0.00 0.00 -1.26 -4.98 105.19 102.34 1xmw n GLY 139 Ca 0.55 -0.14 -0.13 0.00 0.00 0.00 0.00 46.02 46.31 1xmw n GLY 139 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 1xmw s GLN 140 N 0.00 0.28 -0.85 1.61 0.74 -1.07 -4.89 119.66 115.47 1xmw s GLN 140 Ca 0.00 0.39 -0.23 0.00 0.05 0.00 0.00 55.36 55.57 1xmw s GLN 140 Cb 0.00 0.09 0.07 0.00 1.10 0.00 0.00 33.01 34.27 1xmw s GLN 140 CO 0.00 -0.06 1.24 -1.21 -0.55 0.00 0.00 175.29 174.71 1xmw s GLU 141 N 0.36 3.39 0.00 1.67 2.02 -1.25 0.19 118.70 125.08 1xmw s GLU 141 Ca -0.02 -0.96 0.00 0.00 0.02 0.00 0.00 54.97 54.01 1xmw s GLU 141 Cb -0.03 -4.73 0.00 0.00 0.10 0.00 0.00 34.13 29.46 1xmw s GLU 141 CO -0.02 -2.03 0.00 1.55 0.02 0.00 0.00 175.26 174.79 1xmw n VAL 142 N 6.28 0.00 0.09 2.63 3.14 1.12 -2.23 118.33 129.35 1xmw n VAL 142 Ca 0.16 0.00 -0.08 0.00 -2.96 0.00 0.00 64.34 61.46 1xmw n VAL 142 Cb 0.49 0.00 -0.02 0.00 -1.06 0.00 0.00 33.84 33.25 1xmw n VAL 142 CO 0.00 0.00 0.00 0.28 -6.46 0.00 0.00 176.83 170.65 1xmw h SER 143 N 0.00 0.17 -0.49 6.55 0.02 -1.93 -3.45 113.55 114.42 1xmw h SER 143 Ca 0.00 -0.14 0.17 0.00 -0.84 0.00 0.00 61.79 60.97 1xmw h SER 143 Cb 0.00 -0.05 -0.20 0.00 0.14 0.00 0.00 62.40 62.29 1xmw h SER 143 CO 0.00 0.98 -0.09 -1.81 -1.14 0.00 0.00 176.83 174.78 1xmw s ASP 144 N -6.88 -0.77 0.00 3.07 1.01 -0.95 -5.08 116.67 107.07 1xmw s ASP 144 Ca -0.02 0.18 0.00 0.00 0.71 0.00 0.00 52.55 53.42 1xmw s ASP 144 Cb 0.10 1.52 0.00 0.00 1.01 0.00 0.00 42.92 45.56 1xmw s ASP 144 CO 0.82 -0.14 0.00 -0.46 0.21 0.00 0.00 175.17 175.60 1xmw n ASN 145 N 5.27 -5.40 0.00 0.27 0.23 -1.20 -4.83 115.26 109.61 1xmw n ASN 145 Ca 0.05 0.61 0.00 0.00 -0.53 0.00 0.00 54.58 54.70 1xmw n ASN 145 Cb 0.56 -1.13 0.00 0.00 -2.08 0.00 0.00 39.78 37.13 1xmw n ASN 145 CO 0.00 0.00 0.00 0.29 -0.93 0.00 0.00 177.26 176.62 1xmw n LYS 146 N 1.88 0.00 -3.73 -3.83 5.02 -1.25 -3.51 118.16 112.74 1xmw n LYS 146 Ca 0.00 0.00 -0.13 0.00 -2.02 0.00 0.00 58.31 56.16 1xmw n LYS 146 Cb 0.08 0.00 -0.14 0.00 -0.02 0.00 0.00 35.03 34.95 1xmw n LYS 146 CO 0.00 0.00 0.00 0.95 -0.52 0.00 0.00 177.40 177.83 1xmw s THR 147 N 0.00 -0.08 0.03 -0.18 -4.23 -1.26 -3.02 115.64 106.90 1xmw s THR 147 Ca 0.00 0.18 -0.14 0.00 -1.18 0.00 0.00 61.69 60.56 1xmw s THR 147 Cb 0.00 -0.31 -0.06 0.00 1.34 0.00 0.00 72.50 73.47 1xmw s THR 147 CO 0.00 0.08 0.42 -0.22 -0.54 0.00 0.00 174.62 174.36 1xmw s LEU 148 N 1.34 4.45 -0.27 4.79 1.98 0.91 0.36 118.68 132.24 1xmw s LEU 148 Ca -0.08 0.95 0.02 0.00 -2.89 0.00 0.00 54.13 52.13 1xmw s LEU 148 Cb -0.11 -2.72 0.07 0.00 0.66 0.00 0.00 46.19 44.09 1xmw s LEU 148 CO -0.07 0.28 -0.03 0.21 -1.89 0.00 0.00 176.35 174.85 1xmw s ASN 149 N -1.25 4.15 0.00 3.68 2.47 0.13 -1.47 114.94 122.65 1xmw s ASN 149 Ca 0.27 -1.44 0.15 0.00 0.42 0.00 0.00 52.86 52.26 1xmw s ASN 149 Cb -0.16 -1.30 -0.18 0.00 -1.45 0.00 0.00 41.25 38.15 1xmw s ASN 149 CO 0.15 -0.27 0.72 0.18 -3.72 0.00 0.00 177.10 174.16 1xmw n LEU 150 N 4.57 0.83 0.00 3.21 4.77 -1.18 -2.58 117.00 126.61 1xmw n LEU 150 Ca -0.09 0.38 0.00 0.00 -0.03 0.00 0.00 56.01 56.27 1xmw n LEU 150 Cb 0.43 0.13 0.00 0.00 -2.33 0.00 0.00 43.42 41.65 1xmw n LEU 150 CO 0.19 0.26 0.00 0.61 -1.33 0.00 0.00 177.39 177.12 1xmw n GLY 151 N 1.48 0.07 3.94 -0.72 0.00 -1.26 -4.96 105.19 103.74 1xmw n GLY 151 Ca -0.14 -1.63 -0.28 0.00 0.00 0.00 0.00 46.02 43.97 1xmw n GLY 151 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1xmw s LYS 152 N -0.02 1.02 0.13 1.61 1.02 -1.26 -1.88 119.74 120.36 1xmw s LYS 152 Ca 0.00 -0.53 0.23 0.00 0.02 0.00 0.00 55.97 55.68 1xmw s LYS 152 Cb 0.00 -1.98 -0.00 0.00 -0.52 0.00 0.00 37.83 35.33 1xmw s LYS 152 CO 0.00 -2.10 0.99 2.89 -0.92 0.00 0.00 175.35 176.21 1xmw n ARG 153 N -3.49 0.51 0.00 1.68 1.85 -1.11 -3.82 116.66 112.28 1xmw n ARG 153 Ca 0.14 0.05 0.09 0.00 -1.00 0.00 0.00 57.85 57.13 1xmw n ARG 153 Cb 0.60 -1.72 0.43 0.00 -1.05 0.00 0.00 32.46 30.72 1xmw n ARG 153 CO 0.00 0.00 0.00 -0.89 -0.01 0.00 0.00 177.63 176.73 1xmw n ILE 154 N -2.40 0.60 0.43 8.89 -0.00 -1.26 -2.70 119.36 122.91 1xmw n ILE 154 Ca 0.00 0.15 0.04 0.00 -0.00 0.00 0.00 62.75 62.94 1xmw n ILE 154 Cb 0.52 -0.84 0.17 0.00 -0.00 0.00 0.00 39.64 39.48 1xmw n ILE 154 CO 0.00 0.00 0.00 1.21 -0.00 0.00 0.00 176.55 177.76 1xmw n GLU 155 N -1.39 2.41 -3.28 0.38 0.00 -1.25 -4.92 120.64 112.58 1xmw n GLU 155 Ca 0.07 -1.32 -0.09 0.00 0.00 0.00 0.00 57.16 55.82 1xmw n GLU 155 Cb 0.18 -1.65 0.01 0.00 0.00 0.00 0.00 31.44 29.98 1xmw n GLU 155 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.13 173.66 1xmw n ASP 156 N 0.33 -6.88 -4.64 4.31 -0.08 -1.10 -4.87 116.55 103.63 1xmw n ASP 156 Ca 0.12 -0.39 -0.43 0.00 -1.51 0.00 0.00 54.79 52.58 1xmw n ASP 156 Cb 0.54 -4.37 -0.02 0.00 2.34 0.00 0.00 41.12 39.61 1xmw n ASP 156 CO 0.00 0.00 0.00 -2.16 0.12 0.00 0.00 177.20 175.16 1xmw s PRO 157 N -3.78 3.99 -0.19 -0.67 0.04 -1.26 -4.83 135.00 128.31 1xmw s PRO 157 Ca 0.08 1.55 -0.09 0.00 0.04 0.00 0.00 61.00 62.58 1xmw s PRO 157 Cb -0.02 -3.90 0.07 0.00 0.04 0.00 0.00 34.50 30.70 1xmw s PRO 157 CO 0.79 -1.03 0.43 -0.98 0.04 0.00 0.00 177.00 176.25 1xmw s ARG 158 N 4.11 0.39 0.00 4.56 1.70 -1.26 -1.82 118.95 126.62 1xmw s ARG 158 Ca 0.61 0.92 0.00 0.00 -0.47 0.00 0.00 55.73 56.79 1xmw s ARG 158 Cb -0.22 0.13 0.00 0.00 -0.57 0.00 0.00 34.95 34.29 1xmw s ARG 158 CO 0.23 -0.19 0.00 0.41 -1.08 0.00 0.00 175.30 174.67 1xmw n GLY 159 N 4.69 0.58 3.47 3.88 0.00 0.49 0.11 105.19 118.42 1xmw n GLY 159 Ca -0.18 -0.99 -0.30 0.00 0.00 0.00 0.00 46.02 44.56 1xmw n GLY 159 CO 0.00 0.00 0.00 -0.29 0.00 0.00 0.00 173.32 173.03 1xmw s MET 160 N -2.00 1.91 -0.08 1.61 1.75 -0.94 0.84 119.30 122.39 1xmw s MET 160 Ca 0.00 -1.09 -0.03 0.00 -1.25 0.00 0.00 55.69 53.31 1xmw s MET 160 Cb 0.00 -2.15 0.04 0.00 2.84 0.00 0.00 34.83 35.57 1xmw s MET 160 CO 0.00 0.51 0.17 0.71 -0.65 0.00 0.00 175.02 175.76 1xmw s TYR 161 N -1.05 -0.21 0.23 4.11 1.51 0.27 -2.51 117.35 119.71 1xmw s TYR 161 Ca 0.16 0.58 0.06 0.00 -1.01 0.00 0.00 57.07 56.87 1xmw s TYR 161 Cb -0.11 -0.09 -0.03 0.00 -0.11 0.00 0.00 41.96 41.62 1xmw s TYR 161 CO 0.08 -0.21 0.24 -1.14 -1.11 0.00 0.00 175.55 173.42 1xmw s GLN 162 N 1.47 3.12 0.92 -0.62 0.74 -0.21 -2.03 119.66 123.04 1xmw s GLN 162 Ca -0.06 -0.91 -0.13 0.00 0.05 0.00 0.00 55.36 54.31 1xmw s GLN 162 Cb -0.11 -2.70 0.21 0.00 1.10 0.00 0.00 33.01 31.50 1xmw s GLN 162 CO -0.06 0.43 1.25 0.00 -0.55 0.00 0.00 175.29 176.35 1xmw s GLY 164 N -5.71 1.64 -0.19 0.00 0.00 -0.56 -4.26 107.32 98.23 1xmw s GLY 164 Ca 0.73 -0.21 -0.22 0.00 0.00 0.00 0.00 44.72 45.01 1xmw s GLY 164 CO 0.50 0.02 0.69 -0.54 0.00 0.00 0.00 173.10 173.77 1xmw s GLU 165 N -4.95 4.24 0.03 2.90 2.02 -1.26 -4.51 118.70 117.17 1xmw s GLU 165 Ca 0.53 0.73 0.00 0.00 0.02 0.00 0.00 54.97 56.25 1xmw s GLU 165 Cb -0.11 -3.58 0.00 0.00 0.10 0.00 0.00 34.13 30.55 1xmw s GLU 165 CO 0.49 -0.26 0.00 -1.71 0.02 0.00 0.00 175.26 173.80 1xmw n ASN 166 N 5.10 -0.27 -0.06 -0.19 2.85 -1.26 -4.98 115.26 116.45 1xmw n ASN 166 Ca 0.00 0.24 -0.05 0.00 -0.11 0.00 0.00 54.58 54.66 1xmw n ASN 166 Cb 0.49 0.47 -0.10 0.00 1.24 0.00 0.00 39.78 41.89 1xmw n ASN 166 CO 0.00 0.00 0.00 0.00 -2.11 0.00 0.00 177.26 175.15 1xmw n ALA 167 N -2.24 1.77 -3.25 5.20 0.00 -1.26 -5.01 120.51 115.72 1xmw n ALA 167 Ca 0.00 -0.76 0.03 0.00 0.00 0.00 0.00 53.44 52.72 1xmw n ALA 167 Cb 0.00 -0.04 -0.03 0.00 0.00 0.00 0.00 19.45 19.38 1xmw n ALA 167 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 177.50 177.71 1xmw s LYS 168 N -2.34 0.19 -0.20 0.00 2.47 -1.26 -5.13 119.74 113.47 1xmw s LYS 168 Ca -0.06 0.42 -0.29 0.00 -1.56 0.00 0.00 55.97 54.48 1xmw s LYS 168 Cb 0.04 0.25 -0.01 0.00 -1.46 0.00 0.00 37.83 36.65 1xmw s LYS 168 CO 0.50 -0.12 1.25 -1.54 0.16 0.00 0.00 175.35 175.60 1xmw s SER 169 N 2.54 6.91 0.20 1.43 1.04 -1.26 -4.83 113.70 119.72 1xmw s SER 169 Ca -0.01 1.56 0.11 0.00 0.48 0.00 0.00 55.95 58.09 1xmw s SER 169 Cb -0.06 -2.54 -0.04 0.00 0.10 0.00 0.00 66.02 63.47 1xmw s SER 169 CO -0.15 -0.81 -0.23 0.12 0.98 0.00 0.00 173.24 173.15 1xmw s PHE 170 N 3.64 2.27 0.01 5.02 2.19 -1.26 -4.87 117.98 124.98 1xmw s PHE 170 Ca 0.54 -0.36 -0.02 0.00 0.33 0.00 0.00 56.93 57.42 1xmw s PHE 170 Cb -0.20 -1.11 -0.01 0.00 -1.31 0.00 0.00 43.02 40.39 1xmw s PHE 170 CO 0.15 0.51 0.01 0.99 1.83 0.00 0.00 175.22 178.72 1xmw s THR 171 N -1.79 0.08 -0.06 0.12 2.01 -1.14 0.13 115.64 114.98 1xmw s THR 171 Ca 0.21 -0.70 -0.08 0.00 0.31 0.00 0.00 61.69 61.44 1xmw s THR 171 Cb -0.07 -0.25 0.02 0.00 0.01 0.00 0.00 72.50 72.20 1xmw s THR 171 CO 0.10 -0.38 0.22 -0.22 -0.69 0.00 0.00 174.62 173.65 1xmw s LEU 172 N -1.16 1.18 -0.05 4.42 0.20 -0.86 -2.14 118.68 120.27 1xmw s LEU 172 Ca -0.13 0.32 0.06 0.00 0.69 0.00 0.00 54.13 55.07 1xmw s LEU 172 Cb -0.08 0.80 -0.01 0.00 -0.43 0.00 0.00 46.19 46.47 1xmw s LEU 172 CO -0.00 -0.16 -0.25 -1.58 -0.29 0.00 0.00 176.35 174.07 1xmw s GLN 173 N -0.24 2.46 -0.01 1.98 0.74 0.12 -0.56 119.66 124.14 1xmw s GLN 173 Ca -0.03 -0.90 0.05 0.00 0.05 0.00 0.00 55.36 54.53 1xmw s GLN 173 Cb -0.03 -2.15 -0.01 0.00 1.10 0.00 0.00 33.01 31.92 1xmw s GLN 173 CO 0.01 0.43 -0.17 0.54 -0.55 0.00 0.00 175.29 175.54 1xmw s VAL 174 N -0.28 1.36 -0.29 1.34 0.11 0.25 -0.98 120.40 121.91 1xmw s VAL 174 Ca -0.00 -0.78 0.01 0.00 -2.93 0.00 0.00 61.98 58.29 1xmw s VAL 174 Cb -0.13 -1.14 0.15 0.00 -1.53 0.00 0.00 36.38 33.74 1xmw s VAL 174 CO 0.03 0.35 0.38 -0.72 -3.33 0.00 0.00 175.10 171.80 1xmw s TYR 175 N -0.45 -0.86 -0.58 1.54 1.13 -1.00 0.18 117.35 117.31 1xmw s TYR 175 Ca 0.06 0.18 -0.21 0.00 -1.41 0.00 0.00 57.07 55.70 1xmw s TYR 175 Cb -0.07 -0.24 0.07 0.00 -1.10 0.00 0.00 41.96 40.62 1xmw s TYR 175 CO -0.00 -0.97 0.80 0.71 -2.51 0.00 0.00 175.55 173.58 1xmw s TYR 176 N 2.49 2.88 0.10 -3.49 1.51 -0.76 -2.67 117.35 117.42 1xmw s TYR 176 Ca 0.10 -0.57 -0.30 0.00 -1.01 0.00 0.00 57.07 55.28 1xmw s TYR 176 Cb -0.13 -3.98 -0.06 0.00 -0.11 0.00 0.00 41.96 37.68 1xmw s TYR 176 CO -0.31 -1.34 1.02 0.50 -1.11 0.00 0.00 175.55 174.30 1xmw s ARG 177 N 3.29 4.63 0.00 -0.62 3.52 0.45 -4.55 118.95 125.67 1xmw s ARG 177 Ca 0.19 1.54 0.10 0.00 -0.13 0.00 0.00 55.73 57.42 1xmw s ARG 177 Cb -0.19 -3.36 0.60 0.00 -1.56 0.00 0.00 34.95 30.43 1xmw s ARG 177 CO 0.11 0.10 1.04 -0.12 -0.81 0.00 0.00 175.30 175.62