#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 -4.11 -2.20 1.67 -0.08 -1.26 -0.25 116.55 110.32 1xmw n ASP 2 Ca 0.00 -0.83 -0.13 0.00 -1.51 0.00 0.00 54.79 52.31 1xmw n ASP 2 Cb 0.00 -3.67 -0.02 0.00 2.34 0.00 0.00 41.12 39.77 1xmw n ASP 2 CO 0.00 0.00 0.00 0.00 0.12 0.00 0.00 177.20 177.32 1xmw n ALA 3 N -4.60 -0.63 -3.37 -1.67 0.00 -1.26 -4.89 120.51 104.09 1xmw n ALA 3 Ca 0.01 0.13 -0.16 0.00 0.00 0.00 0.00 53.44 53.42 1xmw n ALA 3 Cb 0.54 -1.56 -0.08 0.00 0.00 0.00 0.00 19.45 18.35 1xmw n ALA 3 CO 0.00 0.00 0.00 -1.21 0.00 0.00 0.00 177.50 176.29 1xmw s GLU 4 N -4.61 0.49 -0.10 0.00 2.02 0.66 -4.98 118.70 112.17 1xmw s GLU 4 Ca 0.00 -0.45 0.15 0.00 0.02 0.00 0.00 54.97 54.69 1xmw s GLU 4 Cb 0.00 -0.64 0.23 0.00 0.10 0.00 0.00 34.13 33.82 1xmw s GLU 4 CO 0.00 -1.11 1.12 0.27 0.02 0.00 0.00 175.26 175.56 1xmw n ASN 5 N 4.80 2.27 -1.61 -0.19 6.94 -1.26 -3.64 115.26 122.57 1xmw n ASN 5 Ca 0.05 -2.85 -0.02 0.00 -0.02 0.00 0.00 54.58 51.74 1xmw n ASN 5 Cb 0.46 -0.34 0.24 0.00 -2.36 0.00 0.00 39.78 37.79 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 -1.23 2.15 -3.77 1.53 -5.35 -1.26 -4.32 119.36 107.11 1xmw n ILE 6 Ca 0.13 -1.11 -0.13 0.00 -0.27 0.00 0.00 62.75 61.37 1xmw n ILE 6 Cb 0.56 -0.43 -0.13 0.00 -1.74 0.00 0.00 39.64 37.90 1xmw n ILE 6 CO 0.00 0.00 0.00 -1.61 -1.76 0.00 0.00 176.55 173.18 1xmw s GLU 7 N -2.28 0.21 0.31 6.28 2.02 -1.26 -5.06 118.70 118.92 1xmw s GLU 7 Ca 0.39 0.38 -0.29 0.00 0.02 0.00 0.00 54.97 55.48 1xmw s GLU 7 Cb 0.31 0.00 -0.10 0.00 0.10 0.00 0.00 34.13 34.44 1xmw s GLU 7 CO 0.10 -0.09 1.33 0.71 0.02 0.00 0.00 175.26 177.33 1xmw s TYR 8 N 0.63 3.07 0.21 1.61 1.51 -1.26 -4.56 117.35 118.55 1xmw s TYR 8 Ca -0.04 1.34 0.05 0.00 -1.01 0.00 0.00 57.07 57.40 1xmw s TYR 8 Cb -0.06 -3.69 -0.03 0.00 -0.11 0.00 0.00 41.96 38.07 1xmw s TYR 8 CO -0.04 -1.98 0.25 0.15 -1.11 0.00 0.00 175.55 172.83 1xmw s LYS 9 N -1.41 3.18 -0.02 -0.62 1.02 -1.07 -4.90 119.74 115.92 1xmw s LYS 9 Ca 0.51 -0.83 -0.08 0.00 0.02 0.00 0.00 55.97 55.60 1xmw s LYS 9 Cb -0.40 -2.77 0.01 0.00 -0.52 0.00 0.00 37.83 34.15 1xmw s LYS 9 CO 0.50 0.45 0.16 0.08 -0.92 0.00 0.00 175.35 175.63 1xmw s VAL 10 N -1.92 0.06 -0.37 3.17 1.01 -1.26 -0.25 120.40 120.84 1xmw s VAL 10 Ca 0.33 -0.47 0.03 0.00 0.00 0.00 0.00 61.98 61.87 1xmw s VAL 10 Cb -0.09 -0.39 0.16 0.00 0.00 0.00 0.00 36.38 36.05 1xmw s VAL 10 CO 0.27 -0.26 0.38 -0.55 0.00 0.00 0.00 175.10 174.94 1xmw s SER 11 N -0.94 1.10 0.02 3.32 0.15 0.10 -4.97 113.70 112.49 1xmw s SER 11 Ca -0.10 -1.55 -0.21 0.00 0.70 0.00 0.00 55.95 54.79 1xmw s SER 11 Cb -0.06 0.60 -0.06 0.00 -1.71 0.00 0.00 66.02 64.79 1xmw s SER 11 CO 0.01 -0.26 0.61 -0.63 1.20 0.00 0.00 173.24 174.17 1xmw s ILE 12 N 1.45 4.84 -0.30 6.45 1.01 -1.26 -2.45 121.20 130.94 1xmw s ILE 12 Ca 0.17 1.28 0.02 0.00 0.00 0.00 0.00 60.65 62.12 1xmw s ILE 12 Cb -0.15 -3.95 0.09 0.00 0.01 0.00 0.00 42.46 38.46 1xmw s ILE 12 CO -0.04 0.45 0.02 -0.55 0.00 0.00 0.00 174.94 174.82 1xmw s SER 13 N -0.43 4.32 1.50 3.58 0.15 -0.78 -4.92 113.70 117.13 1xmw s SER 13 Ca 0.31 -1.71 0.00 0.00 0.70 0.00 0.00 55.95 55.25 1xmw s SER 13 Cb -0.19 -1.32 0.00 0.00 -1.71 0.00 0.00 66.02 62.80 1xmw s SER 13 CO 0.18 -0.34 0.00 0.61 1.20 0.00 0.00 173.24 174.90 1xmw n GLY 14 N 4.52 2.04 1.94 9.45 0.00 -1.26 -2.08 105.19 119.80 1xmw n GLY 14 Ca -0.03 -0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.76 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 2.96 -4.40 2.61 -1.04 -1.26 -4.83 114.28 108.32 1xmw n THR 15 Ca 0.00 -3.28 -0.26 0.00 -2.04 0.00 0.00 64.05 58.47 1xmw n THR 15 Cb 0.00 -0.91 -0.12 0.00 -1.82 0.00 0.00 70.33 67.49 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 -2.59 3.26 -0.20 8.00 0.15 -0.88 -1.20 113.70 120.23 1xmw s SER 16 Ca 0.55 -0.85 -0.04 0.00 0.70 0.00 0.00 55.95 56.30 1xmw s SER 16 Cb 0.45 -0.23 0.08 0.00 -1.71 0.00 0.00 66.02 64.61 1xmw s SER 16 CO 0.02 0.10 0.14 -0.69 1.20 0.00 0.00 173.24 174.00 1xmw s VAL 17 N -1.68 -0.17 -0.31 4.45 1.01 -0.79 -1.86 120.40 121.05 1xmw s VAL 17 Ca 0.19 -0.25 -0.09 0.00 0.00 0.00 0.00 61.98 61.83 1xmw s VAL 17 Cb -0.08 -0.68 -0.00 0.00 0.00 0.00 0.00 36.38 35.62 1xmw s VAL 17 CO 0.09 -0.33 0.13 -0.70 0.00 0.00 0.00 175.10 174.28 1xmw s GLU 18 N 2.20 3.24 -0.12 2.72 2.12 -1.03 0.12 118.70 127.95 1xmw s GLU 18 Ca 0.05 -0.77 -0.01 0.00 0.36 0.00 0.00 54.97 54.59 1xmw s GLU 18 Cb -0.16 -3.49 -0.03 0.00 0.26 0.00 0.00 34.13 30.71 1xmw s GLU 18 CO -0.15 -0.43 -0.07 -0.51 -0.54 0.00 0.00 175.26 173.56 1xmw s LEU 19 N 1.57 3.13 -0.37 2.70 1.43 -0.61 0.02 118.68 126.55 1xmw s LEU 19 Ca 0.04 -0.12 -0.18 0.00 -1.03 0.00 0.00 54.13 52.84 1xmw s LEU 19 Cb -0.17 -1.72 0.00 0.00 0.03 0.00 0.00 46.19 44.33 1xmw s LEU 19 CO 0.05 0.24 0.52 -0.89 0.23 0.00 0.00 176.35 176.50 1xmw s THR 20 N -0.10 5.00 0.27 5.49 2.01 0.65 0.12 115.64 129.09 1xmw s THR 20 Ca 0.01 0.24 -0.29 0.00 0.31 0.00 0.00 61.69 61.96 1xmw s THR 20 Cb -0.13 -4.00 -0.14 0.00 0.01 0.00 0.00 72.50 68.24 1xmw s THR 20 CO 0.03 -0.28 1.12 0.00 -0.69 0.00 0.00 174.62 174.80 1xmw n PRO 22 N 1.00 1.38 -1.53 0.00 -0.04 -1.26 -3.45 135.00 131.09 1xmw n PRO 22 Ca 0.10 -0.77 -0.02 0.00 -0.04 0.00 0.00 63.50 62.76 1xmw n PRO 22 Cb 0.31 -1.93 0.02 0.00 -0.04 0.00 0.00 33.50 31.87 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 2.99 -0.72 0.00 1.53 -0.00 -1.26 -4.66 117.00 114.88 1xmw n LEU 23 Ca 0.30 -1.76 0.10 0.00 -0.00 0.00 0.00 56.01 54.65 1xmw n LEU 23 Cb 0.46 0.26 -0.03 0.00 -0.00 0.00 0.00 43.42 44.11 1xmw n LEU 23 CO 0.28 1.26 -0.14 -0.67 -0.00 0.00 0.00 177.39 178.12 1xmw n ASP 24 N -0.48 -5.68 -4.74 1.45 2.03 -1.22 -4.65 116.55 103.25 1xmw n ASP 24 Ca -0.13 0.81 -0.41 0.00 0.52 0.00 0.00 54.79 55.58 1xmw n ASP 24 Cb 0.62 -2.37 -0.05 0.00 -0.72 0.00 0.00 41.12 38.60 1xmw n ASP 24 CO 0.00 0.00 0.00 -0.94 -1.92 0.00 0.00 177.20 174.34 1xmw s SER 25 N -5.05 7.51 -0.13 1.67 1.04 -1.26 -4.59 113.70 112.89 1xmw s SER 25 Ca 0.00 1.80 0.01 0.00 0.48 0.00 0.00 55.95 58.24 1xmw s SER 25 Cb 0.00 -2.58 -0.01 0.00 0.10 0.00 0.00 66.02 63.53 1xmw s SER 25 CO 0.00 0.01 -0.16 -0.62 0.98 0.00 0.00 173.24 173.45 1xmw s ASP 26 N -0.36 3.76 0.59 7.02 -1.08 -1.26 -4.94 116.67 120.40 1xmw s ASP 26 Ca 0.44 -0.40 0.31 0.00 -0.52 0.00 0.00 52.55 52.38 1xmw s ASP 26 Cb -0.24 -1.56 1.24 0.00 -1.46 0.00 0.00 42.92 40.90 1xmw s ASP 26 CO 0.30 0.15 1.55 -0.08 0.52 0.00 0.00 175.17 177.60 1xmw h GLU 27 N 6.84 0.00 -0.44 4.34 4.81 -1.97 0.62 114.58 128.78 1xmw h GLU 27 Ca -0.26 0.00 -0.31 0.00 -0.13 0.00 0.00 59.36 58.66 1xmw h GLU 27 Cb 1.21 0.00 -0.37 0.00 0.63 0.00 0.00 28.75 30.22 1xmw h GLU 27 CO 0.54 0.00 -0.95 0.09 -0.73 0.00 0.00 179.01 177.96 1xmw n ASN 28 N -3.54 2.63 -4.68 1.04 3.02 -1.26 -5.02 115.26 107.44 1xmw n ASN 28 Ca 0.22 -2.76 -0.42 0.00 -0.03 0.00 0.00 54.58 51.59 1xmw n ASN 28 Cb 1.34 -0.42 -0.03 0.00 -0.61 0.00 0.00 39.78 40.06 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 -3.21 4.41 -0.23 3.41 2.96 0.22 -4.59 118.68 121.64 1xmw s LEU 29 Ca 0.37 2.74 -0.06 0.00 -0.22 0.00 0.00 54.13 56.95 1xmw s LEU 29 Cb 0.36 -3.55 -0.03 0.00 0.50 0.00 0.00 46.19 43.48 1xmw s LEU 29 CO -0.03 -1.03 0.04 -0.75 -1.32 0.00 0.00 176.35 173.26 1xmw s LYS 30 N 3.41 3.63 0.65 1.98 2.47 0.97 -4.40 119.74 128.44 1xmw s LYS 30 Ca 0.84 -0.50 0.00 0.00 -1.56 0.00 0.00 55.97 54.75 1xmw s LYS 30 Cb -0.45 -3.24 0.09 0.00 -1.46 0.00 0.00 37.83 32.77 1xmw s LYS 30 CO 0.38 -0.14 0.90 -1.58 0.16 0.00 0.00 175.35 175.08 1xmw s TRP 31 N 1.44 2.13 0.07 4.03 0.52 -1.26 0.26 118.94 126.14 1xmw s TRP 31 Ca 0.05 -0.16 -0.11 0.00 0.02 0.00 0.00 56.10 55.89 1xmw s TRP 31 Cb -0.15 -2.87 0.01 0.00 -1.15 0.00 0.00 33.47 29.31 1xmw s TRP 31 CO 0.02 -1.34 0.26 -2.00 0.02 0.00 0.00 176.95 173.91 1xmw s GLU 32 N -4.98 0.84 -0.28 4.98 2.12 0.41 -1.58 118.70 120.22 1xmw s GLU 32 Ca 0.62 -0.74 -0.01 0.00 0.36 0.00 0.00 54.97 55.21 1xmw s GLU 32 Cb -0.08 0.36 0.09 0.00 0.26 0.00 0.00 34.13 34.76 1xmw s GLU 32 CO 0.42 -0.28 0.06 0.21 -0.54 0.00 0.00 175.26 175.13 1xmw s LYS 33 N -3.27 0.92 -1.21 4.30 2.20 0.23 -2.93 119.74 119.99 1xmw s LYS 33 Ca 0.00 -1.00 -0.00 0.00 -0.36 0.00 0.00 55.97 54.61 1xmw s LYS 33 Cb 0.02 -2.22 0.00 0.00 -1.51 0.00 0.00 37.83 34.12 1xmw s LYS 33 CO -0.08 -0.85 0.02 0.09 -0.36 0.00 0.00 175.35 174.17 1xmw n ASN 34 N 4.81 -4.32 0.00 1.43 5.03 -0.58 0.06 115.26 121.68 1xmw n ASN 34 Ca -0.05 0.13 0.00 0.00 0.87 0.00 0.00 54.58 55.54 1xmw n ASN 34 Cb 0.43 -3.65 0.00 0.00 -1.02 0.00 0.00 39.78 35.55 1xmw n ASN 34 CO 0.00 0.00 0.00 0.61 -1.83 0.00 0.00 177.26 176.04 1xmw n GLY 35 N -0.86 3.00 3.65 7.41 0.00 -1.26 -5.00 105.19 112.13 1xmw n GLY 35 Ca -0.16 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.43 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 -0.79 4.17 0.51 1.61 0.74 0.11 -5.01 119.66 121.01 1xmw s GLN 36 Ca 0.00 1.13 -0.23 0.00 0.05 0.00 0.00 55.36 56.31 1xmw s GLN 36 Cb 0.00 -3.67 -0.06 0.00 1.10 0.00 0.00 33.01 30.38 1xmw s GLN 36 CO 0.00 -0.66 1.36 -1.21 -0.55 0.00 0.00 175.29 174.23 1xmw s GLU 37 N 3.18 3.36 -0.60 1.67 2.02 -1.26 0.78 118.70 127.85 1xmw s GLU 37 Ca 0.41 2.24 -0.04 0.00 0.02 0.00 0.00 54.97 57.60 1xmw s GLU 37 Cb -0.14 -2.39 0.16 0.00 0.10 0.00 0.00 34.13 31.85 1xmw s GLU 37 CO 0.09 -1.01 0.43 -0.51 0.02 0.00 0.00 175.26 174.27 1xmw s LEU 38 N -3.23 5.42 -0.97 1.80 1.43 -0.62 -4.78 118.68 117.74 1xmw s LEU 38 Ca 0.68 -2.63 -0.07 0.00 -1.03 0.00 0.00 54.13 51.07 1xmw s LEU 38 Cb -0.40 -1.90 -0.10 0.00 0.03 0.00 0.00 46.19 43.82 1xmw s LEU 38 CO 0.49 -0.44 2.58 -0.81 0.23 0.00 0.00 176.35 178.40 1xmw n PRO 39 N 3.82 2.53 -3.59 1.29 -0.04 -1.26 -4.26 135.00 133.49 1xmw n PRO 39 Ca 0.05 -1.56 -0.05 0.00 -0.04 0.00 0.00 63.50 61.90 1xmw n PRO 39 Cb 0.39 -2.45 -0.03 0.00 -0.04 0.00 0.00 33.50 31.38 1xmw n PRO 39 CO 0.00 0.00 0.00 -1.14 -0.04 0.00 0.00 175.50 174.32 1xmw s GLN 40 N 2.55 0.36 -0.35 0.54 2.00 -1.26 -5.07 119.66 118.44 1xmw s GLN 40 Ca 0.53 -0.08 -0.17 0.00 -2.00 0.00 0.00 55.36 53.64 1xmw s GLN 40 Cb 0.16 0.17 0.02 0.00 0.80 0.00 0.00 33.01 34.16 1xmw s GLN 40 CO -0.04 -0.15 0.41 1.63 -0.50 0.00 0.00 175.29 176.64 1xmw n LYS 41 N 0.10 -2.19 -1.11 1.67 5.02 -1.26 -4.82 118.16 115.57 1xmw n LYS 41 Ca -0.02 1.88 -0.24 0.00 -2.02 0.00 0.00 58.31 57.91 1xmw n LYS 41 Cb 0.59 -3.94 0.13 0.00 -0.02 0.00 0.00 35.03 31.79 1xmw n LYS 41 CO 0.00 0.00 0.00 0.72 -0.52 0.00 0.00 177.40 177.60 1xmw n HIS 42 N 0.18 2.72 -3.03 2.13 8.25 -1.26 -4.73 115.22 119.47 1xmw n HIS 42 Ca 0.02 -1.99 -0.29 0.00 -0.26 0.00 0.00 57.72 55.20 1xmw n HIS 42 Cb 0.43 -0.99 -0.03 0.00 1.12 0.00 0.00 29.99 30.52 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 -1.10 6.46 0.58 0.41 1.11 -1.26 -4.05 116.67 118.83 1xmw s ASP 43 Ca 0.52 0.94 0.28 0.00 0.18 0.00 0.00 52.55 54.46 1xmw s ASP 43 Cb 0.43 -2.24 1.63 0.00 1.07 0.00 0.00 42.92 43.80 1xmw s ASP 43 CO 0.07 -0.34 2.10 0.07 1.18 0.00 0.00 175.17 178.25 1xmw h LYS 44 N 1.31 0.00 -5.62 8.23 2.10 -1.92 -3.41 116.57 117.26 1xmw h LYS 44 Ca -0.47 0.00 -0.66 0.00 -2.00 0.00 0.00 60.65 57.51 1xmw h LYS 44 Cb 1.19 0.00 -0.08 0.00 -0.90 0.00 0.00 32.23 32.44 1xmw h LYS 44 CO 0.64 0.00 -0.49 -1.01 -2.00 0.00 0.00 179.45 176.59 1xmw s HIS 45 N -4.68 3.55 -0.62 0.07 3.76 -1.26 0.10 115.29 116.22 1xmw s HIS 45 Ca -0.05 0.48 -0.05 0.00 -0.15 0.00 0.00 55.06 55.29 1xmw s HIS 45 Cb 0.16 -1.95 0.16 0.00 1.11 0.00 0.00 32.58 32.05 1xmw s HIS 45 CO 0.57 0.67 0.46 -1.17 -0.85 0.00 0.00 174.74 174.41 1xmw s LEU 46 N -0.86 5.53 -0.05 0.89 2.96 0.33 -4.81 118.68 122.67 1xmw s LEU 46 Ca 0.14 -2.65 -0.26 0.00 -0.22 0.00 0.00 54.13 51.14 1xmw s LEU 46 Cb -0.12 -1.92 -0.03 0.00 0.50 0.00 0.00 46.19 44.61 1xmw s LEU 46 CO 0.03 -0.45 0.82 -0.69 -1.32 0.00 0.00 176.35 174.74 1xmw s VAL 47 N 0.24 4.97 -0.37 1.68 1.01 -1.24 -1.57 120.40 125.12 1xmw s VAL 47 Ca 0.15 1.70 -0.01 0.00 0.00 0.00 0.00 61.98 63.81 1xmw s VAL 47 Cb -0.20 -4.16 0.09 0.00 0.00 0.00 0.00 36.38 32.12 1xmw s VAL 47 CO -0.04 0.20 0.12 -0.76 0.00 0.00 0.00 175.10 174.62 1xmw s LEU 48 N 0.96 4.79 0.35 3.92 1.43 0.12 -4.86 118.68 125.39 1xmw s LEU 48 Ca 0.43 -1.85 -0.26 0.00 -1.03 0.00 0.00 54.13 51.43 1xmw s LEU 48 Cb -0.19 -1.76 -0.09 0.00 0.03 0.00 0.00 46.19 44.18 1xmw s LEU 48 CO 0.22 -0.44 1.05 -1.10 0.23 0.00 0.00 176.35 176.31 1xmw s GLN 49 N 1.13 4.35 -1.21 1.70 1.11 -1.26 -1.89 119.66 123.58 1xmw s GLN 49 Ca 0.05 1.58 -0.08 0.00 0.01 0.00 0.00 55.36 56.92 1xmw s GLN 49 Cb -0.21 -2.77 -0.01 0.00 -1.01 0.00 0.00 33.01 29.01 1xmw s GLN 49 CO -0.04 0.01 0.75 -3.47 0.01 0.00 0.00 175.29 172.55 1xmw n ASP 50 N 0.38 -3.43 -4.55 5.90 -0.08 -0.70 -4.81 116.55 109.27 1xmw n ASP 50 Ca 0.03 -0.88 -0.38 0.00 -1.51 0.00 0.00 54.79 52.04 1xmw n ASP 50 Cb 0.48 -3.95 -0.03 0.00 2.34 0.00 0.00 41.12 39.97 1xmw n ASP 50 CO 0.00 0.00 0.00 0.12 0.12 0.00 0.00 177.20 177.44 1xmw s PHE 51 N -3.57 1.65 0.03 -0.67 2.19 -0.34 -4.95 117.98 112.31 1xmw s PHE 51 Ca 0.24 0.80 -0.30 0.00 0.33 0.00 0.00 56.93 58.00 1xmw s PHE 51 Cb -0.07 -4.08 -0.05 0.00 -1.31 0.00 0.00 43.02 37.52 1xmw s PHE 51 CO 0.82 -2.31 1.17 -1.12 1.83 0.00 0.00 175.22 175.61 1xmw s SER 52 N 8.20 7.12 0.44 6.13 0.01 -1.26 -4.26 113.70 130.09 1xmw s SER 52 Ca 0.68 1.93 0.13 0.00 1.31 0.00 0.00 55.95 60.00 1xmw s SER 52 Cb -0.13 -2.57 1.03 0.00 0.21 0.00 0.00 66.02 64.56 1xmw s SER 52 CO 0.20 -0.46 2.03 1.05 0.41 0.00 0.00 173.24 176.47 1xmw h GLU 53 N 6.91 0.36 0.00 12.44 4.11 -1.84 1.17 114.58 137.73 1xmw h GLU 53 Ca -0.40 -0.02 -0.09 0.00 0.07 0.00 0.00 59.36 58.91 1xmw h GLU 53 Cb 1.21 -0.08 -0.02 0.00 0.50 0.00 0.00 28.75 30.36 1xmw h GLU 53 CO 0.81 0.24 -1.87 0.28 0.07 0.00 0.00 179.01 178.54 1xmw n VAL 54 N -4.47 0.50 0.74 -1.06 0.31 -1.26 -3.31 118.33 109.77 1xmw n VAL 54 Ca 0.06 -0.60 0.08 0.00 -0.01 0.00 0.00 64.34 63.87 1xmw n VAL 54 Cb 0.26 -0.22 -0.00 0.00 -0.91 0.00 0.00 33.84 32.96 1xmw n VAL 54 CO 0.00 0.00 0.00 1.21 -1.32 0.00 0.00 176.83 176.72 1xmw n GLU 55 N -2.49 1.64 0.00 5.55 0.00 -0.96 -4.66 120.64 119.72 1xmw n GLU 55 Ca -0.10 -0.82 0.00 0.00 0.00 0.00 0.00 57.16 56.24 1xmw n GLU 55 Cb 0.72 -1.29 0.00 0.00 0.00 0.00 0.00 31.44 30.87 1xmw n GLU 55 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.13 173.66 1xmw n ASP 56 N -0.12 3.38 -4.74 4.31 -0.08 0.40 -4.79 116.55 114.91 1xmw n ASP 56 Ca 0.07 0.00 -0.38 0.00 -1.51 0.00 0.00 54.79 52.97 1xmw n ASP 56 Cb 0.35 0.14 0.05 0.00 2.34 0.00 0.00 41.12 44.00 1xmw n ASP 56 CO 0.00 0.00 0.00 -0.44 0.12 0.00 0.00 177.20 176.88 1xmw s SER 57 N -3.32 5.09 0.00 1.67 0.01 -1.08 -4.80 113.70 111.27 1xmw s SER 57 Ca 0.00 2.73 0.00 0.00 1.31 0.00 0.00 55.95 59.99 1xmw s SER 57 Cb 0.00 -2.63 0.00 0.00 0.21 0.00 0.00 66.02 63.60 1xmw s SER 57 CO 0.00 -1.69 0.00 0.61 0.41 0.00 0.00 173.24 172.57 1xmw n GLY 58 N 0.77 -0.06 3.73 3.44 0.00 -1.04 -4.91 105.19 107.11 1xmw n GLY 58 Ca 0.12 -0.66 -0.26 0.00 0.00 0.00 0.00 46.02 45.22 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 -2.12 2.98 -0.19 1.61 2.02 -1.26 -2.22 117.35 118.18 1xmw s TYR 59 Ca 0.00 -0.09 -0.17 0.00 -0.37 0.00 0.00 57.07 56.44 1xmw s TYR 59 Cb 0.00 -1.43 0.05 0.00 -0.40 0.00 0.00 41.96 40.18 1xmw s TYR 59 CO 0.00 0.52 0.50 0.71 -1.57 0.00 0.00 175.55 175.71 1xmw s TYR 60 N -1.80 -0.57 -0.01 2.71 2.02 0.11 -1.53 117.35 118.28 1xmw s TYR 60 Ca 0.29 1.36 -0.25 0.00 -0.37 0.00 0.00 57.07 58.10 1xmw s TYR 60 Cb -0.09 0.21 0.06 0.00 -0.40 0.00 0.00 41.96 41.73 1xmw s TYR 60 CO 0.21 -0.28 0.56 0.54 -1.57 0.00 0.00 175.55 175.01 1xmw s VAL 61 N 0.40 0.02 0.05 0.71 0.11 -1.15 -1.77 120.40 118.77 1xmw s VAL 61 Ca -0.01 -0.16 0.01 0.00 -2.93 0.00 0.00 61.98 58.89 1xmw s VAL 61 Cb -0.04 -0.91 -0.03 0.00 -1.53 0.00 0.00 36.38 33.87 1xmw s VAL 61 CO -0.01 -0.09 -0.06 0.00 -3.33 0.00 0.00 175.10 171.61 1xmw s TYR 63 N -2.24 -0.25 0.28 0.00 -0.85 0.14 -4.88 117.35 109.56 1xmw s TYR 63 Ca -0.04 -0.07 0.03 0.00 -0.52 0.00 0.00 57.07 56.47 1xmw s TYR 63 Cb -0.04 0.46 -0.06 0.00 0.38 0.00 0.00 41.96 42.70 1xmw s TYR 63 CO -0.03 -0.91 0.04 0.95 -1.52 0.00 0.00 175.55 174.08 1xmw s THR 64 N -3.84 1.07 -0.82 -3.49 -4.23 -0.88 -0.02 115.64 103.42 1xmw s THR 64 Ca 0.07 -2.02 0.18 0.00 -1.18 0.00 0.00 61.69 58.73 1xmw s THR 64 Cb -0.01 -2.61 0.16 0.00 1.34 0.00 0.00 72.50 71.38 1xmw s THR 64 CO -0.05 -0.12 1.55 -0.81 -0.54 0.00 0.00 174.62 174.65 1xmw n PRO 65 N -0.56 0.07 -0.02 3.99 -0.04 -1.26 -3.04 135.00 134.13 1xmw n PRO 65 Ca -0.03 0.31 -0.00 0.00 -0.04 0.00 0.00 63.50 63.74 1xmw n PRO 65 Cb 0.66 -1.63 -0.05 0.00 -0.04 0.00 0.00 33.50 32.44 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 -1.59 2.02 -3.90 0.55 0.00 -1.26 -4.91 120.51 111.42 1xmw n ALA 66 Ca 0.03 -0.29 -0.33 0.00 0.00 0.00 0.00 53.44 52.85 1xmw n ALA 66 Cb 0.19 -0.03 -0.14 0.00 0.00 0.00 0.00 19.45 19.48 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 -3.30 4.92 -0.34 0.00 1.04 -1.17 -5.06 113.70 109.78 1xmw s SER 67 Ca -0.03 -1.95 -0.04 0.00 0.48 0.00 0.00 55.95 54.41 1xmw s SER 67 Cb 0.03 -1.70 0.06 0.00 0.10 0.00 0.00 66.02 64.51 1xmw s SER 67 CO 0.26 -0.41 0.09 0.21 0.98 0.00 0.00 173.24 174.37 1xmw s ASN 68 N 1.27 5.16 -0.14 7.02 3.84 -1.26 -2.08 114.94 128.75 1xmw s ASN 68 Ca 0.07 -1.38 -0.00 0.00 0.21 0.00 0.00 52.86 51.75 1xmw s ASN 68 Cb -0.20 -1.81 0.03 0.00 -0.55 0.00 0.00 41.25 38.71 1xmw s ASN 68 CO -0.06 -0.36 -0.10 -0.75 -2.79 0.00 0.00 177.10 173.04 1xmw s LYS 69 N 1.30 1.89 -0.72 0.43 2.20 -1.26 -5.06 119.74 118.52 1xmw s LYS 69 Ca -0.01 -0.45 -0.26 0.00 -0.36 0.00 0.00 55.97 54.90 1xmw s LYS 69 Cb -0.20 -1.90 -0.03 0.00 -1.51 0.00 0.00 37.83 34.18 1xmw s LYS 69 CO -0.00 -0.28 1.90 -0.80 -0.36 0.00 0.00 175.35 175.81 1xmw s ASN 70 N 1.59 5.20 -0.07 1.43 0.01 -1.26 -4.89 114.94 116.95 1xmw s ASN 70 Ca 0.04 -0.02 -0.03 0.00 -0.71 0.00 0.00 52.86 52.14 1xmw s ASN 70 Cb -0.13 -2.54 0.04 0.00 0.41 0.00 0.00 41.25 39.03 1xmw s ASN 70 CO -0.09 -2.53 0.11 0.28 -1.51 0.00 0.00 177.10 173.36 1xmw s THR 71 N 9.52 -0.17 0.05 1.60 -1.32 -1.26 -3.22 115.64 120.83 1xmw s THR 71 Ca 0.69 0.35 0.00 0.00 -1.21 0.00 0.00 61.69 61.53 1xmw s THR 71 Cb -0.10 -0.24 -0.04 0.00 -1.51 0.00 0.00 72.50 70.60 1xmw s THR 71 CO 0.13 0.13 0.15 -0.31 -2.21 0.00 0.00 174.62 172.51 1xmw s TYR 72 N 2.22 3.40 -0.09 9.09 2.02 -0.94 -4.73 117.35 128.32 1xmw s TYR 72 Ca 0.04 0.21 0.00 0.00 -0.37 0.00 0.00 57.07 56.96 1xmw s TYR 72 Cb -0.12 -1.73 0.02 0.00 -0.40 0.00 0.00 41.96 39.73 1xmw s TYR 72 CO -0.05 0.57 -0.07 -1.17 -1.57 0.00 0.00 175.55 173.27 1xmw s LEU 73 N -2.27 1.23 -0.14 -1.29 0.20 -0.73 -1.48 118.68 114.21 1xmw s LEU 73 Ca 0.30 -0.24 -0.02 0.00 0.69 0.00 0.00 54.13 54.86 1xmw s LEU 73 Cb -0.13 -0.72 -0.02 0.00 -0.43 0.00 0.00 46.19 44.89 1xmw s LEU 73 CO 0.23 -0.08 -0.07 -0.47 -0.29 0.00 0.00 176.35 175.66 1xmw s TYR 74 N 1.38 2.94 -0.02 5.38 6.14 -0.84 0.07 117.35 132.41 1xmw s TYR 74 Ca -0.02 -0.39 0.04 0.00 0.64 0.00 0.00 57.07 57.35 1xmw s TYR 74 Cb -0.14 -1.89 -0.01 0.00 0.42 0.00 0.00 41.96 40.35 1xmw s TYR 74 CO -0.04 -0.06 -0.15 -1.17 0.64 0.00 0.00 175.55 174.77 1xmw s LEU 75 N 0.23 1.97 -0.33 6.97 2.96 -0.94 -2.46 118.68 127.09 1xmw s LEU 75 Ca -0.05 -0.28 -0.00 0.00 -0.22 0.00 0.00 54.13 53.58 1xmw s LEU 75 Cb -0.14 -0.80 0.10 0.00 0.50 0.00 0.00 46.19 45.85 1xmw s LEU 75 CO 0.04 0.16 0.11 -0.75 -1.32 0.00 0.00 176.35 174.59 1xmw s LYS 76 N -0.19 0.81 0.33 1.98 2.20 -1.10 -2.49 119.74 121.28 1xmw s LYS 76 Ca 0.02 -1.22 0.08 0.00 -0.36 0.00 0.00 55.97 54.49 1xmw s LYS 76 Cb -0.08 -2.08 -0.07 0.00 -1.51 0.00 0.00 37.83 34.10 1xmw s LYS 76 CO 0.00 -1.01 -0.05 0.00 -0.36 0.00 0.00 175.35 173.93 1xmw s ALA 77 N 1.43 2.76 -0.10 3.13 0.00 -1.25 0.15 121.76 127.89 1xmw s ALA 77 Ca 0.11 -2.07 -0.01 0.00 0.00 0.00 0.00 51.96 49.99 1xmw s ALA 77 Cb -0.18 0.12 0.03 0.00 0.00 0.00 0.00 23.12 23.08 1xmw s ALA 77 CO -0.21 -0.03 -0.04 0.50 0.00 0.00 0.00 175.76 175.98 1xmw s ARG 78 N -3.68 1.09 -0.15 0.00 3.52 -1.25 -4.24 118.95 114.23 1xmw s ARG 78 Ca 0.32 -0.09 -0.04 0.00 -0.13 0.00 0.00 55.73 55.79 1xmw s ARG 78 Cb 0.05 -1.31 0.07 0.00 -1.56 0.00 0.00 34.95 32.20 1xmw s ARG 78 CO 0.15 -0.29 0.22 0.14 -0.81 0.00 0.00 175.30 174.72 1xmw s VAL 79 N 1.83 -0.35 0.00 7.11 -7.23 -1.26 -5.01 120.40 115.49 1xmw s VAL 79 Ca 0.05 0.15 0.00 0.00 -1.81 0.00 0.00 61.98 60.37 1xmw s VAL 79 Cb -0.12 -0.50 0.00 0.00 0.56 0.00 0.00 36.38 36.32 1xmw s VAL 79 CO -0.07 0.01 0.00 0.61 -0.31 0.00 0.00 175.10 175.34 1xmw n GLY 80 N 5.33 3.65 3.34 2.32 0.00 -1.26 -4.71 105.19 113.87 1xmw n GLY 80 Ca -0.05 -0.52 -0.46 0.00 0.00 0.00 0.00 46.02 44.99 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 0.00 6.97 0.65 1.61 1.04 -1.26 -5.04 113.70 117.66 1xmw s SER 81 Ca 0.00 -2.99 -0.14 0.00 0.48 0.00 0.00 55.95 53.30 1xmw s SER 81 Cb 0.00 -2.23 -0.01 0.00 0.10 0.00 0.00 66.02 63.89 1xmw s SER 81 CO 0.00 -0.50 1.08 0.00 0.98 0.00 0.00 173.24 174.79 1xmw s ALA 82 N -0.16 2.59 0.00 5.32 0.00 -1.26 -4.99 121.76 123.27 1xmw s ALA 82 Ca 0.24 0.38 -0.18 0.00 0.00 0.00 0.00 51.96 52.41 1xmw s ALA 82 Cb -0.09 -3.26 -0.10 0.00 0.00 0.00 0.00 23.12 19.67 1xmw s ALA 82 CO -0.08 -1.12 0.92 0.22 0.00 0.00 0.00 175.76 175.69 1xmw h ASP 83 N -0.03 -0.54 -4.18 0.00 3.58 -2.08 -3.45 116.42 109.72 1xmw h ASP 83 Ca -0.46 0.02 -0.69 0.00 0.42 0.00 0.00 57.03 56.32 1xmw h ASP 83 Cb 1.23 0.14 -0.25 0.00 1.72 0.00 0.00 39.33 42.17 1xmw h ASP 83 CO 0.56 -0.26 -0.87 -0.62 -2.88 0.00 0.00 179.24 175.17 1xmw s ASP 84 N -3.92 3.31 0.90 2.28 -1.08 -1.26 -5.14 116.67 111.76 1xmw s ASP 84 Ca -0.09 -0.58 -0.10 0.00 -0.52 0.00 0.00 52.55 51.25 1xmw s ASP 84 Cb 0.01 -0.34 0.20 0.00 -1.46 0.00 0.00 42.92 41.33 1xmw s ASP 84 CO 0.28 0.25 1.22 0.00 0.52 0.00 0.00 175.17 177.44 1xmw n ALA 85 N 1.60 -0.84 -2.50 3.66 0.00 -1.26 -4.95 120.51 116.21 1xmw n ALA 85 Ca -0.17 -1.86 -0.40 0.00 0.00 0.00 0.00 53.44 51.01 1xmw n ALA 85 Cb 0.52 0.08 -0.03 0.00 0.00 0.00 0.00 19.45 20.02 1xmw n ALA 85 CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 177.50 177.65 1xmw s LYS 86 N -5.64 3.42 0.52 0.00 -0.14 -1.26 -4.81 119.74 111.83 1xmw s LYS 86 Ca 0.73 -0.88 0.20 0.00 -1.36 0.00 0.00 55.97 54.66 1xmw s LYS 86 Cb -0.03 -5.14 1.34 0.00 -1.68 0.00 0.00 37.83 32.33 1xmw s LYS 86 CO 0.50 -2.31 2.12 -0.22 -0.76 0.00 0.00 175.35 174.68 1xmw h LYS 87 N 10.06 0.00 0.00 1.68 3.64 -2.06 -3.21 116.57 126.68 1xmw h LYS 87 Ca 0.11 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.49 1xmw h LYS 87 Cb 1.02 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.84 1xmw h LYS 87 CO 1.38 0.06 0.00 -0.25 -2.27 0.00 0.00 179.45 178.38 1xmw n ASP 88 N -4.23 0.00 -0.78 4.20 9.92 -1.26 -4.99 116.55 119.41 1xmw n ASP 88 Ca -0.03 0.76 0.07 0.00 -0.53 0.00 0.00 54.79 55.05 1xmw n ASP 88 Cb 0.14 -0.49 -0.02 0.00 -0.64 0.00 0.00 41.12 40.12 1xmw n ASP 88 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 1xmw n ALA 89 N -1.98 -1.65 -1.96 2.24 0.00 -1.22 -4.20 120.51 111.76 1xmw n ALA 89 Ca 0.00 0.15 -0.40 0.00 0.00 0.00 0.00 53.44 53.19 1xmw n ALA 89 Cb 0.00 -0.53 -0.03 0.00 0.00 0.00 0.00 19.45 18.89 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 -1.70 2.40 -0.11 0.00 0.00 -1.26 -4.94 121.76 116.14 1xmw s ALA 90 Ca 0.00 -0.18 -0.30 0.00 0.00 0.00 0.00 51.96 51.49 1xmw s ALA 90 Cb 0.00 -4.19 -0.02 0.00 0.00 0.00 0.00 23.12 18.91 1xmw s ALA 90 CO 0.00 -3.44 1.27 0.15 0.00 0.00 0.00 175.76 173.74 1xmw s LYS 91 N 6.62 4.27 -0.31 0.00 1.02 -1.26 -4.91 119.74 125.18 1xmw s LYS 91 Ca 0.76 1.71 0.14 0.00 0.02 0.00 0.00 55.97 58.60 1xmw s LYS 91 Cb -0.17 -3.69 0.47 0.00 -0.52 0.00 0.00 37.83 33.92 1xmw s LYS 91 CO 0.27 -0.62 1.11 0.36 -0.92 0.00 0.00 175.35 175.55 1xmw n LYS 92 N 6.07 2.52 -3.83 1.68 0.00 -1.26 -5.01 118.16 118.33 1xmw n LYS 92 Ca 0.13 -3.84 -0.29 0.00 -0.00 0.00 0.00 58.31 54.31 1xmw n LYS 92 Cb 0.45 -1.87 -0.16 0.00 -0.00 0.00 0.00 35.03 33.45 1xmw n LYS 92 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.40 176.89 1xmw s ASP 93 N -3.58 3.40 0.53 -5.58 1.01 -1.26 -5.09 116.67 106.09 1xmw s ASP 93 Ca 0.38 -1.03 0.00 0.00 0.71 0.00 0.00 52.55 52.61 1xmw s ASP 93 Cb 0.39 -0.87 0.00 0.00 1.01 0.00 0.00 42.92 43.44 1xmw s ASP 93 CO -0.02 -0.28 0.00 -0.67 0.21 0.00 0.00 175.17 174.40 1xmw n ASP 94 N 4.87 -4.43 -3.36 0.27 -0.08 -1.26 -4.90 116.55 107.65 1xmw n ASP 94 Ca -0.10 0.30 -0.11 0.00 -1.51 0.00 0.00 54.79 53.37 1xmw n ASP 94 Cb 0.45 -0.88 0.00 0.00 2.34 0.00 0.00 41.12 43.04 1xmw n ASP 94 CO 0.00 0.00 0.00 0.00 0.12 0.00 0.00 177.20 177.32 1xmw n ALA 95 N -0.48 -2.62 -0.46 -1.67 0.00 -1.26 -4.94 120.51 109.08 1xmw n ALA 95 Ca 0.00 -0.11 -0.29 0.00 0.00 0.00 0.00 53.44 53.04 1xmw n ALA 95 Cb 0.13 -1.42 0.27 0.00 0.00 0.00 0.00 19.45 18.43 1xmw n ALA 95 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 177.50 175.91 1xmw s LYS 96 N -3.88 -2.03 -0.05 0.00 0.00 -1.26 -4.96 119.74 107.56 1xmw s LYS 96 Ca 0.03 0.45 -0.22 0.00 0.00 0.00 0.00 55.97 56.24 1xmw s LYS 96 Cb -0.01 -1.46 -0.31 0.00 0.00 0.00 0.00 37.83 36.05 1xmw s LYS 96 CO 0.81 -4.36 0.90 -0.22 0.00 0.00 0.00 175.35 172.48 1xmw h LYS 97 N -3.06 0.30 -3.54 1.78 3.64 -2.00 -3.47 116.57 110.22 1xmw h LYS 97 Ca -0.53 -0.51 -0.27 0.00 -1.27 0.00 0.00 60.65 58.07 1xmw h LYS 97 Cb 1.34 0.19 -0.02 0.00 -0.41 0.00 0.00 32.23 33.33 1xmw h LYS 97 CO 0.39 1.24 -0.34 -0.25 -2.27 0.00 0.00 179.45 178.22 1xmw n ASP 98 N -4.13 -4.19 0.00 4.20 9.92 -1.26 -4.68 116.55 116.42 1xmw n ASP 98 Ca -0.14 0.17 0.00 0.00 -0.53 0.00 0.00 54.79 54.30 1xmw n ASP 98 Cb 0.82 -3.56 0.00 0.00 -0.64 0.00 0.00 41.12 37.74 1xmw n ASP 98 CO 0.00 0.00 0.00 -0.67 0.13 0.00 0.00 177.20 176.66 1xmw n ASP 99 N -1.75 0.16 -3.58 -2.24 -0.08 -1.26 -4.92 116.55 102.88 1xmw n ASP 99 Ca -0.16 0.00 -0.40 0.00 -1.51 0.00 0.00 54.79 52.72 1xmw n ASP 99 Cb 0.61 0.00 -0.03 0.00 2.34 0.00 0.00 41.12 44.04 1xmw n ASP 99 CO 0.00 0.00 0.00 0.00 0.12 0.00 0.00 177.20 177.32 1xmw n ALA 100 N -2.01 4.43 -1.28 -1.67 0.00 -1.26 -4.63 120.51 114.08 1xmw n ALA 100 Ca 0.00 -3.34 -0.32 0.00 0.00 0.00 0.00 53.44 49.78 1xmw n ALA 100 Cb 0.04 -3.51 0.10 0.00 0.00 0.00 0.00 19.45 16.07 1xmw n ALA 100 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 177.50 178.67 1xmw n LYS 101 N 6.17 2.57 0.07 0.00 4.81 -1.26 -4.48 118.16 126.03 1xmw n LYS 101 Ca 0.51 -3.15 0.00 0.00 -0.87 0.00 0.00 58.31 54.80 1xmw n LYS 101 Cb 0.36 -2.24 0.00 0.00 0.02 0.00 0.00 35.03 33.17 1xmw n LYS 101 CO 0.00 0.00 0.00 1.63 1.17 0.00 0.00 177.40 180.20 1xmw n LYS 102 N -0.90 0.00 -3.33 1.64 5.02 -1.26 -5.08 118.16 114.25 1xmw n LYS 102 Ca 0.61 0.00 -0.11 0.00 -2.02 0.00 0.00 58.31 56.79 1xmw n LYS 102 Cb 0.84 -0.34 0.00 0.00 -0.02 0.00 0.00 35.03 35.51 1xmw n LYS 102 CO 0.00 0.00 0.00 -3.47 -0.52 0.00 0.00 177.40 173.41 1xmw n ASP 103 N -3.37 -6.67 -4.78 4.39 2.03 -1.26 -4.92 116.55 101.97 1xmw n ASP 103 Ca 0.00 -0.36 -0.36 0.00 0.52 0.00 0.00 54.79 54.60 1xmw n ASP 103 Cb 0.07 -3.88 -0.02 0.00 -0.72 0.00 0.00 41.12 36.57 1xmw n ASP 103 CO 0.00 0.00 0.00 -0.83 -1.92 0.00 0.00 177.20 174.45 1xmw s GLY 104 N -2.91 2.66 -0.09 0.27 0.00 -1.26 -5.04 107.32 100.94 1xmw s GLY 104 Ca 0.03 0.78 -0.04 0.00 0.00 0.00 0.00 44.72 45.49 1xmw s GLY 104 CO 0.81 1.17 0.19 -1.35 0.00 0.00 0.00 173.10 173.92 1xmw s SER 105 N -1.68 0.22 -0.17 1.64 1.04 -1.26 -5.03 113.70 108.47 1xmw s SER 105 Ca 0.66 0.41 0.14 0.00 0.48 0.00 0.00 55.95 57.64 1xmw s SER 105 Cb -0.23 0.35 0.43 0.00 0.10 0.00 0.00 66.02 66.67 1xmw s SER 105 CO 0.27 -0.20 1.21 1.67 0.98 0.00 0.00 173.24 177.17 1xmw n GLN 106 N 4.79 1.37 -3.57 4.02 -0.06 -1.26 -5.01 117.38 117.65 1xmw n GLN 106 Ca -0.15 -3.08 -0.39 0.00 -2.00 0.00 0.00 57.00 51.37 1xmw n GLN 106 Cb 0.51 -1.31 -0.11 0.00 -4.06 0.00 0.00 30.24 25.27 1xmw n GLN 106 CO 0.00 0.00 0.00 0.95 -0.20 0.00 0.00 177.06 177.81 1xmw s THR 107 N -2.64 5.19 -0.12 1.69 -4.23 -1.26 -4.94 115.64 109.33 1xmw s THR 107 Ca 0.38 -0.09 -0.08 0.00 -1.18 0.00 0.00 61.69 60.72 1xmw s THR 107 Cb 0.38 -3.58 -0.05 0.00 1.34 0.00 0.00 72.50 70.58 1xmw s THR 107 CO -0.08 0.11 -0.19 -3.20 -0.54 0.00 0.00 174.62 170.71 1xmw n ASN 108 N 5.07 1.23 -2.70 3.99 2.85 -1.26 -4.95 115.26 119.49 1xmw n ASN 108 Ca -0.13 0.20 -0.07 0.00 -0.11 0.00 0.00 54.58 54.47 1xmw n ASN 108 Cb 0.51 -0.48 0.09 0.00 1.24 0.00 0.00 39.78 41.13 1xmw n ASN 108 CO 0.00 0.00 0.00 1.17 -2.11 0.00 0.00 177.26 176.32 1xmw n LYS 109 N -3.80 0.93 -0.26 1.20 4.81 -1.26 -5.15 118.16 114.64 1xmw n LYS 109 Ca -0.22 -1.60 0.00 0.00 -0.87 0.00 0.00 58.31 55.61 1xmw n LYS 109 Cb 0.57 -0.28 0.00 0.00 0.02 0.00 0.00 35.03 35.33 1xmw n LYS 109 CO 0.00 0.00 0.00 0.00 1.17 0.00 0.00 177.40 178.57 1xmw n ALA 110 N -0.28 0.00 -2.75 3.14 0.00 -1.26 -4.97 120.51 114.39 1xmw n ALA 110 Ca -0.05 0.00 -0.03 0.00 0.00 0.00 0.00 53.44 53.36 1xmw n ALA 110 Cb 0.78 0.00 -0.03 0.00 0.00 0.00 0.00 19.45 20.20 1xmw n ALA 110 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 1xmw n LYS 111 N -0.12 -3.54 0.00 0.00 5.02 -1.26 -5.05 118.16 113.21 1xmw n LYS 111 Ca 0.00 2.78 0.00 0.00 -2.02 0.00 0.00 58.31 59.07 1xmw n LYS 111 Cb 0.00 -4.19 0.00 0.00 -0.02 0.00 0.00 35.03 30.82 1xmw n LYS 111 CO 0.00 0.00 0.00 2.89 -0.52 0.00 0.00 177.40 179.77 1xmw n ARG 112 N 1.59 3.81 -0.19 1.97 1.85 -1.26 -4.96 116.66 119.48 1xmw n ARG 112 Ca -0.23 0.00 0.03 0.00 -1.00 0.00 0.00 57.85 56.64 1xmw n ARG 112 Cb 0.40 0.00 -0.01 0.00 -1.05 0.00 0.00 32.46 31.80 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 -0.62 -2.65 2.89 0.00 -1.26 -4.75 120.51 111.13 1xmw n ALA 113 Ca 0.00 0.06 -0.28 0.00 0.00 0.00 0.00 53.44 53.22 1xmw n ALA 113 Cb 0.00 -0.20 -0.03 0.00 0.00 0.00 0.00 19.45 19.22 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 4.15 0.11 0.00 0.20 -1.26 -3.53 118.68 118.34 1xmw s LEU 114 Ca 0.00 0.55 -0.23 0.00 0.69 0.00 0.00 54.13 55.15 1xmw s LEU 114 Cb 0.00 -3.35 0.06 0.00 -0.43 0.00 0.00 46.19 42.48 1xmw s LEU 114 CO 0.00 -0.12 0.56 -1.83 -0.29 0.00 0.00 176.35 174.68 1xmw s GLU 115 N -3.43 1.18 -0.02 1.98 -1.05 0.11 -4.91 118.70 112.56 1xmw s GLU 115 Ca 0.41 -0.39 0.04 0.00 -0.15 0.00 0.00 54.97 54.88 1xmw s GLU 115 Cb -0.11 0.54 -0.00 0.00 -0.44 0.00 0.00 34.13 34.12 1xmw s GLU 115 CO 0.29 -0.48 -0.13 0.54 0.95 0.00 0.00 175.26 176.43 1xmw s VAL 116 N -3.27 1.06 -0.00 1.83 0.11 -1.26 0.92 120.40 119.79 1xmw s VAL 116 Ca -0.01 -0.54 0.02 0.00 -2.93 0.00 0.00 61.98 58.52 1xmw s VAL 116 Cb -0.00 -0.91 -0.01 0.00 -1.53 0.00 0.00 36.38 33.93 1xmw s VAL 116 CO -0.08 0.31 -0.08 -0.22 -3.33 0.00 0.00 175.10 171.70 1xmw s LEU 117 N -0.06 2.02 -0.45 2.54 2.96 -0.97 -4.97 118.68 119.75 1xmw s LEU 117 Ca 0.00 -0.15 -0.14 0.00 -0.22 0.00 0.00 54.13 53.62 1xmw s LEU 117 Cb -0.08 -0.39 0.06 0.00 0.50 0.00 0.00 46.19 46.28 1xmw s LEU 117 CO 0.00 0.09 0.35 -1.61 -1.32 0.00 0.00 176.35 173.86 1xmw s GLU 118 N -0.23 2.90 -0.04 1.98 8.01 -1.26 -2.34 118.70 127.72 1xmw s GLU 118 Ca 0.03 -1.31 0.05 0.00 0.01 0.00 0.00 54.97 53.75 1xmw s GLU 118 Cb -0.03 -4.03 -0.01 0.00 -4.31 0.00 0.00 34.13 25.75 1xmw s GLU 118 CO -0.00 -0.96 -0.20 0.00 0.01 0.00 0.00 175.26 174.11 1xmw s ALA 119 N 1.60 1.70 -0.85 5.21 0.00 0.24 -4.82 121.76 124.84 1xmw s ALA 119 Ca 0.04 -0.82 -0.04 0.00 0.00 0.00 0.00 51.96 51.14 1xmw s ALA 119 Cb -0.23 -0.52 -0.00 0.00 0.00 0.00 0.00 23.12 22.37 1xmw s ALA 119 CO 0.06 0.35 0.68 -1.91 0.00 0.00 0.00 175.76 174.94 1xmw n GLU 120 N 2.93 -1.40 -2.95 0.00 2.13 -1.26 -1.22 120.64 118.88 1xmw n GLU 120 Ca -0.17 1.02 -0.10 0.00 0.66 0.00 0.00 57.16 58.57 1xmw n GLU 120 Cb 0.53 -4.16 -0.02 0.00 0.27 0.00 0.00 31.44 28.06 1xmw n GLU 120 CO 0.00 0.00 0.00 -0.40 -0.41 0.00 0.00 177.13 176.32 1xmw n ASP 121 N -2.28 -1.17 -3.92 4.31 5.68 -1.26 -4.87 116.55 113.03 1xmw n ASP 121 Ca -0.14 0.06 -0.11 0.00 -0.50 0.00 0.00 54.79 54.10 1xmw n ASP 121 Cb 0.59 -1.12 -0.13 0.00 -1.14 0.00 0.00 41.12 39.32 1xmw n ASP 121 CO 0.00 0.00 0.00 -0.75 -1.33 0.00 0.00 177.20 175.12 1xmw s LYS 122 N -5.42 0.17 -0.04 0.11 2.20 -0.35 -3.73 119.74 112.67 1xmw s LYS 122 Ca 0.20 -0.26 0.06 0.00 -0.36 0.00 0.00 55.97 55.61 1xmw s LYS 122 Cb -0.12 -0.01 -0.01 0.00 -1.51 0.00 0.00 37.83 36.18 1xmw s LYS 122 CO 0.25 -0.01 -0.22 0.14 -0.36 0.00 0.00 175.35 175.16 1xmw s VAL 123 N -0.58 1.75 0.04 4.02 -7.23 -0.98 0.80 120.40 118.22 1xmw s VAL 123 Ca -0.06 -0.91 0.02 0.00 -1.81 0.00 0.00 61.98 59.22 1xmw s VAL 123 Cb -0.04 -1.48 -0.03 0.00 0.56 0.00 0.00 36.38 35.39 1xmw s VAL 123 CO -0.00 0.49 -0.07 -0.63 -0.31 0.00 0.00 175.10 174.58 1xmw s ILE 124 N -0.19 0.53 -0.24 -0.62 -1.09 -0.99 -2.98 121.20 115.61 1xmw s ILE 124 Ca -0.00 -1.13 -0.09 0.00 -2.23 0.00 0.00 60.65 57.19 1xmw s ILE 124 Cb -0.12 -0.66 -0.04 0.00 -1.58 0.00 0.00 42.46 40.06 1xmw s ILE 124 CO 0.02 -0.42 0.13 -0.76 -1.23 0.00 0.00 174.94 172.67 1xmw s LEU 125 N -1.67 3.89 -0.11 2.97 1.43 -1.12 -2.30 118.68 121.77 1xmw s LEU 125 Ca -0.09 0.01 0.03 0.00 -1.03 0.00 0.00 54.13 53.06 1xmw s LEU 125 Cb -0.09 -2.04 0.00 0.00 0.03 0.00 0.00 46.19 44.09 1xmw s LEU 125 CO -0.00 0.05 -0.22 -0.54 0.23 0.00 0.00 176.35 175.86 1xmw s LYS 126 N 1.16 2.93 0.42 1.70 1.02 0.26 -1.33 119.74 125.90 1xmw s LYS 126 Ca 0.06 -0.83 0.04 0.00 0.02 0.00 0.00 55.97 55.26 1xmw s LYS 126 Cb -0.14 -2.26 -0.01 0.00 -0.52 0.00 0.00 37.83 34.89 1xmw s LYS 126 CO 0.05 0.11 0.14 0.00 -0.92 0.00 0.00 175.35 174.73 1xmw n ASN 128 N -1.50 0.00 0.00 0.00 5.15 -1.23 -4.89 115.26 112.78 1xmw n ASN 128 Ca -0.07 0.32 0.00 0.00 -0.60 0.00 0.00 54.58 54.23 1xmw n ASN 128 Cb 0.62 -0.41 0.00 0.00 -0.53 0.00 0.00 39.78 39.46 1xmw n ASN 128 CO 0.00 0.00 0.00 -0.24 1.40 0.00 0.00 177.26 178.42 1xmw n SER 129 N -1.41 0.00 -4.60 1.20 2.88 -1.26 -5.07 113.62 105.36 1xmw n SER 129 Ca 0.05 0.00 -0.52 0.00 -1.33 0.00 0.00 58.87 57.07 1xmw n SER 129 Cb 0.14 0.00 -0.06 0.00 -0.75 0.00 0.00 64.21 63.55 1xmw n SER 129 CO 0.00 0.00 0.00 -1.20 -1.23 0.00 0.00 175.04 172.61 1xmw n SER 130 N 0.00 1.73 -4.64 -3.46 7.64 -0.53 -3.73 113.62 110.63 1xmw n SER 130 Ca 0.00 1.12 -0.37 0.00 1.01 0.00 0.00 58.87 60.63 1xmw n SER 130 Cb 0.00 -1.20 -0.10 0.00 -1.01 0.00 0.00 64.21 61.90 1xmw n SER 130 CO 0.00 0.00 0.00 -0.63 -3.01 0.00 0.00 175.04 171.40 1xmw s ILE 131 N 0.54 5.34 0.02 0.44 1.01 -1.26 -1.66 121.20 125.62 1xmw s ILE 131 Ca 0.84 0.21 -0.30 0.00 0.00 0.00 0.00 60.65 61.40 1xmw s ILE 131 Cb -0.94 -3.52 -0.04 0.00 0.01 0.00 0.00 42.46 37.97 1xmw s ILE 131 CO 0.46 0.31 1.02 -0.89 0.00 0.00 0.00 174.94 175.85 1xmw s THR 132 N 1.26 4.69 -0.54 2.92 2.01 0.68 -4.88 115.64 121.78 1xmw s THR 132 Ca 0.08 1.94 -0.24 0.00 0.31 0.00 0.00 61.69 63.78 1xmw s THR 132 Cb -0.14 -4.24 0.04 0.00 0.01 0.00 0.00 72.50 68.17 1xmw s THR 132 CO 0.06 0.16 0.92 -0.22 -0.69 0.00 0.00 174.62 174.85 1xmw s LEU 133 N 0.98 4.14 -0.05 4.42 1.98 -1.26 -0.13 118.68 128.75 1xmw s LEU 133 Ca 0.53 -0.34 -0.09 0.00 -2.89 0.00 0.00 54.13 51.34 1xmw s LEU 133 Cb -0.23 -2.84 -0.05 0.00 0.66 0.00 0.00 46.19 43.73 1xmw s LEU 133 CO 0.28 -1.19 0.39 -0.07 -1.89 0.00 0.00 176.35 173.87 1xmw h LEU 134 N 10.85 -0.27 0.00 -0.68 3.38 -1.75 -3.48 115.31 123.36 1xmw h LEU 134 Ca -0.26 0.01 0.00 0.00 0.09 0.00 0.00 57.88 57.72 1xmw h LEU 134 Cb 1.07 0.07 0.00 0.00 0.09 0.00 0.00 40.66 41.89 1xmw h LEU 134 CO 1.07 0.14 0.00 1.67 0.09 0.00 0.00 178.44 181.42 1xmw n GLN 135 N -4.73 0.00 0.00 1.13 7.27 -0.95 -4.98 117.38 115.12 1xmw n GLN 135 Ca -0.04 0.00 0.00 0.00 0.07 0.00 0.00 57.00 57.03 1xmw n GLN 135 Cb 0.13 0.00 0.00 0.00 2.41 0.00 0.00 30.24 32.78 1xmw n GLN 135 CO 0.00 0.00 0.00 0.41 0.07 0.00 0.00 177.06 177.54 1xmw n GLY 136 N 0.00 3.01 3.53 1.69 0.00 -1.26 -1.82 105.19 110.33 1xmw n GLY 136 Ca 0.00 -0.24 -0.30 0.00 0.00 0.00 0.00 46.02 45.49 1xmw n GLY 136 CO 0.00 0.00 0.00 -0.37 0.00 0.00 0.00 173.32 172.95 1xmw n THR 137 N 0.00 -0.03 -2.92 2.61 5.66 0.82 -4.80 114.28 115.62 1xmw n THR 137 Ca 0.00 -0.47 -0.36 0.00 -3.05 0.00 0.00 64.05 60.17 1xmw n THR 137 Cb 0.00 -1.50 -0.01 0.00 -1.55 0.00 0.00 70.33 67.27 1xmw n THR 137 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 1xmw n ALA 138 N 13.22 5.24 -1.00 1.79 0.00 -1.26 -4.72 120.51 133.78 1xmw n ALA 138 Ca 0.53 -4.71 0.00 0.00 0.00 0.00 0.00 53.44 49.26 1xmw n ALA 138 Cb 0.31 -1.71 0.00 0.00 0.00 0.00 0.00 19.45 18.05 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 0.38 -2.58 3.23 0.00 0.00 -1.26 -5.03 105.19 99.93 1xmw n GLY 139 Ca 0.36 -0.43 -0.11 0.00 0.00 0.00 0.00 46.02 45.84 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 0.79 -0.31 1.61 -0.44 -1.03 -4.83 119.66 115.45 1xmw s GLN 140 Ca 0.00 -0.55 -0.28 0.00 -2.50 0.00 0.00 55.36 52.03 1xmw s GLN 140 Cb 0.00 0.34 -0.03 0.00 -1.64 0.00 0.00 33.01 31.68 1xmw s GLN 140 CO 0.00 -0.25 1.94 -1.21 0.50 0.00 0.00 175.29 176.27 1xmw s GLU 141 N -2.61 3.23 0.05 1.67 2.02 -1.26 0.12 118.70 121.92 1xmw s GLU 141 Ca -0.05 1.59 -0.13 0.00 0.02 0.00 0.00 54.97 56.40 1xmw s GLU 141 Cb -0.01 -4.26 -0.05 0.00 0.10 0.00 0.00 34.13 29.91 1xmw s GLU 141 CO -0.04 -1.98 1.21 0.28 0.02 0.00 0.00 175.26 174.76 1xmw h VAL 142 N 6.93 0.00 0.00 2.63 2.07 0.11 -3.39 116.25 124.60 1xmw h VAL 142 Ca -0.35 0.00 -0.02 0.00 0.82 0.00 0.00 66.70 67.15 1xmw h VAL 142 Cb 1.19 0.00 -0.00 0.00 -1.52 0.00 0.00 31.29 30.96 1xmw h VAL 142 CO 1.02 0.00 -0.99 -0.24 0.02 0.00 0.00 177.57 177.38 1xmw n SER 143 N -3.68 1.87 -2.97 0.57 2.88 -1.26 -5.03 113.62 106.00 1xmw n SER 143 Ca -0.02 0.31 0.04 0.00 -1.33 0.00 0.00 58.87 57.87 1xmw n SER 143 Cb 0.15 -0.71 0.00 0.00 -0.75 0.00 0.00 64.21 62.90 1xmw n SER 143 CO 0.00 0.00 0.00 -0.62 -1.23 0.00 0.00 175.04 173.19 1xmw s ASP 144 N -5.98 -0.24 -0.93 -3.46 2.15 -1.26 -5.02 116.67 101.94 1xmw s ASP 144 Ca -0.27 -0.04 -0.09 0.00 0.43 0.00 0.00 52.55 52.59 1xmw s ASP 144 Cb 0.04 0.78 -0.00 0.00 -0.30 0.00 0.00 42.92 43.44 1xmw s ASP 144 CO 0.40 -0.04 0.71 0.59 -0.17 0.00 0.00 175.17 176.66 1xmw n ASN 145 N 4.44 -5.84 0.00 -0.34 3.02 -1.26 -4.79 115.26 110.48 1xmw n ASN 145 Ca 0.08 -0.75 0.00 0.00 -0.03 0.00 0.00 54.58 53.88 1xmw n ASN 145 Cb 0.61 -3.33 0.00 0.00 -0.61 0.00 0.00 39.78 36.45 1xmw n ASN 145 CO 0.00 0.00 0.00 0.29 -2.62 0.00 0.00 177.26 174.93 1xmw n LYS 146 N -3.03 0.00 -4.39 3.52 5.02 -1.24 -1.45 118.16 116.58 1xmw n LYS 146 Ca -0.14 0.00 -0.21 0.00 -2.02 0.00 0.00 58.31 55.94 1xmw n LYS 146 Cb 0.60 0.00 -0.13 0.00 -0.02 0.00 0.00 35.03 35.47 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 -1.20 1.20 0.03 -0.18 -4.23 -1.26 -2.84 115.64 107.16 1xmw s THR 147 Ca 0.00 -1.04 0.04 0.00 -1.18 0.00 0.00 61.69 59.52 1xmw s THR 147 Cb 0.00 -1.08 -0.03 0.00 1.34 0.00 0.00 72.50 72.73 1xmw s THR 147 CO 0.00 0.03 -0.09 -0.22 -0.54 0.00 0.00 174.62 173.80 1xmw s LEU 148 N -1.16 3.06 -0.55 4.79 1.98 -0.44 0.15 118.68 126.52 1xmw s LEU 148 Ca 0.02 -0.23 -0.04 0.00 -2.89 0.00 0.00 54.13 51.00 1xmw s LEU 148 Cb -0.08 -1.78 0.14 0.00 0.66 0.00 0.00 46.19 45.13 1xmw s LEU 148 CO 0.01 0.26 0.37 0.21 -1.89 0.00 0.00 176.35 175.31 1xmw s ASN 149 N -1.56 5.37 0.22 3.68 2.47 0.32 -2.80 114.94 122.65 1xmw s ASN 149 Ca 0.18 -2.46 0.15 0.00 0.42 0.00 0.00 52.86 51.14 1xmw s ASN 149 Cb -0.11 -1.88 0.00 0.00 -1.45 0.00 0.00 41.25 37.81 1xmw s ASN 149 CO 0.08 -0.48 1.30 -0.07 -3.72 0.00 0.00 177.10 174.22 1xmw h LEU 150 N 7.57 0.00 0.00 3.21 3.38 -1.84 -2.73 115.31 124.91 1xmw h LEU 150 Ca -0.07 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.90 1xmw h LEU 150 Cb 1.00 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.75 1xmw h LEU 150 CO 0.73 0.55 0.00 0.61 0.09 0.00 0.00 178.44 180.41 1xmw n GLY 151 N 1.27 0.10 3.99 0.83 0.00 -1.26 -4.84 105.19 105.28 1xmw n GLY 151 Ca -0.01 -1.53 -0.20 0.00 0.00 0.00 0.00 46.02 44.29 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 0.00 2.51 0.11 1.61 -0.14 -1.26 -2.31 119.74 120.26 1xmw s LYS 152 Ca 0.00 -1.03 0.21 0.00 -1.36 0.00 0.00 55.97 53.79 1xmw s LYS 152 Cb 0.00 -2.57 -0.11 0.00 -1.68 0.00 0.00 37.83 33.48 1xmw s LYS 152 CO 0.00 -0.68 0.85 2.89 -0.76 0.00 0.00 175.35 177.65 1xmw n ARG 153 N -2.24 0.62 0.00 1.68 1.85 -1.24 -3.86 116.66 113.47 1xmw n ARG 153 Ca 0.09 0.06 0.14 0.00 -1.00 0.00 0.00 57.85 57.14 1xmw n ARG 153 Cb 0.60 -1.74 0.77 0.00 -1.05 0.00 0.00 32.46 31.03 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 -2.61 0.06 0.06 8.89 -0.00 -1.26 -3.40 119.36 121.09 1xmw n ILE 154 Ca -0.03 0.01 -0.02 0.00 -0.00 0.00 0.00 62.75 62.71 1xmw n ILE 154 Cb 0.62 -0.56 0.16 0.00 -0.00 0.00 0.00 39.64 39.86 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 -1.17 2.42 -3.52 0.38 4.07 -1.25 -4.89 120.64 116.67 1xmw n GLU 155 Ca 0.17 -1.46 -0.24 0.00 -0.06 0.00 0.00 57.16 55.57 1xmw n GLU 155 Cb 0.17 -1.76 0.04 0.00 -0.06 0.00 0.00 31.44 29.84 1xmw n GLU 155 CO 0.00 0.00 0.00 -3.47 -0.06 0.00 0.00 177.13 173.60 1xmw n ASP 156 N 0.10 -5.89 -4.67 4.31 2.03 -1.22 -4.88 116.55 106.34 1xmw n ASP 156 Ca 0.18 -0.84 -0.43 0.00 0.52 0.00 0.00 54.79 54.22 1xmw n ASP 156 Cb 0.82 -3.89 -0.02 0.00 -0.72 0.00 0.00 41.12 37.30 1xmw n ASP 156 CO 0.00 0.00 0.00 -2.16 -1.92 0.00 0.00 177.20 173.12 1xmw s PRO 157 N -5.23 4.24 -0.16 -0.67 0.04 -1.26 -4.75 135.00 127.22 1xmw s PRO 157 Ca 0.39 1.84 -0.08 0.00 0.04 0.00 0.00 61.00 63.19 1xmw s PRO 157 Cb -0.12 -3.75 0.06 0.00 0.04 0.00 0.00 34.50 30.73 1xmw s PRO 157 CO 0.82 -0.68 0.38 -0.98 0.04 0.00 0.00 177.00 176.58 1xmw s ARG 158 N 3.26 0.35 0.00 4.56 1.70 -1.26 -1.62 118.95 125.94 1xmw s ARG 158 Ca 0.61 0.77 0.00 0.00 -0.47 0.00 0.00 55.73 56.64 1xmw s ARG 158 Cb -0.26 -0.01 0.00 0.00 -0.57 0.00 0.00 34.95 34.10 1xmw s ARG 158 CO 0.21 -0.17 0.00 0.41 -1.08 0.00 0.00 175.30 174.67 1xmw n GLY 159 N 4.38 -0.54 3.26 3.88 0.00 0.53 -0.13 105.19 116.58 1xmw n GLY 159 Ca -0.22 -0.78 -0.13 0.00 0.00 0.00 0.00 46.02 44.89 1xmw n GLY 159 CO 0.00 0.00 0.00 -3.16 0.00 0.00 0.00 173.32 170.16 1xmw s MET 160 N -0.73 0.44 -0.02 1.61 0.23 -0.76 0.21 119.30 120.29 1xmw s MET 160 Ca 0.00 0.48 0.01 0.00 -1.03 0.00 0.00 55.69 55.15 1xmw s MET 160 Cb 0.00 0.21 0.02 0.00 -1.53 0.00 0.00 34.83 33.53 1xmw s MET 160 CO 0.00 -0.06 -0.02 1.52 -2.03 0.00 0.00 175.02 174.44 1xmw s TYR 161 N 0.13 0.33 0.42 3.16 1.13 -0.48 -2.00 117.35 120.03 1xmw s TYR 161 Ca -0.01 -0.03 0.08 0.00 -1.41 0.00 0.00 57.07 55.70 1xmw s TYR 161 Cb -0.03 -0.33 -0.03 0.00 -1.10 0.00 0.00 41.96 40.47 1xmw s TYR 161 CO 0.01 -0.08 0.35 -1.14 -2.51 0.00 0.00 175.55 172.17 1xmw s GLN 162 N 0.58 2.49 0.70 -3.49 0.74 0.81 -2.38 119.66 119.11 1xmw s GLN 162 Ca -0.06 -1.58 0.02 0.00 0.05 0.00 0.00 55.36 53.79 1xmw s GLN 162 Cb -0.09 -2.32 0.14 0.00 1.10 0.00 0.00 33.01 31.84 1xmw s GLN 162 CO -0.01 -0.18 0.96 0.00 -0.55 0.00 0.00 175.29 175.51 1xmw s GLY 164 N -5.02 2.23 -0.01 0.00 0.00 -0.66 -4.28 107.32 99.56 1xmw s GLY 164 Ca 0.66 -0.63 -0.30 0.00 0.00 0.00 0.00 44.72 44.45 1xmw s GLY 164 CO 0.43 -0.46 1.48 -0.54 0.00 0.00 0.00 173.10 174.01 1xmw s GLU 165 N -1.76 4.25 0.00 2.90 2.02 -1.26 -4.46 118.70 120.39 1xmw s GLU 165 Ca 0.27 2.04 0.00 0.00 0.02 0.00 0.00 54.97 57.29 1xmw s GLU 165 Cb -0.13 -3.67 0.00 0.00 0.10 0.00 0.00 34.13 30.43 1xmw s GLU 165 CO 0.16 -0.66 0.00 -1.71 0.02 0.00 0.00 175.26 173.07 1xmw n ASN 166 N 5.86 0.00 -0.04 -0.19 4.05 -1.26 -4.97 115.26 118.70 1xmw n ASN 166 Ca 0.14 0.00 -0.02 0.00 0.45 0.00 0.00 54.58 55.15 1xmw n ASN 166 Cb 0.43 0.03 -0.10 0.00 1.23 0.00 0.00 39.78 41.37 1xmw n ASN 166 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 177.26 174.21 1xmw n ALA 167 N -1.30 1.92 -3.24 5.20 0.00 -1.26 -5.00 120.51 116.83 1xmw n ALA 167 Ca 0.00 -0.66 0.04 0.00 0.00 0.00 0.00 53.44 52.82 1xmw n ALA 167 Cb 0.00 -0.13 -0.03 0.00 0.00 0.00 0.00 19.45 19.29 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 -2.46 0.18 -0.19 0.00 2.47 -1.26 -5.14 119.74 113.34 1xmw s LYS 168 Ca -0.06 0.39 -0.17 0.00 -1.56 0.00 0.00 55.97 54.57 1xmw s LYS 168 Cb 0.05 0.23 -0.04 0.00 -1.46 0.00 0.00 37.83 36.61 1xmw s LYS 168 CO 0.50 -0.12 0.46 -1.54 0.16 0.00 0.00 175.35 174.82 1xmw s SER 169 N 2.57 6.53 0.14 1.43 1.04 -1.26 -4.71 113.70 119.44 1xmw s SER 169 Ca -0.01 0.64 0.03 0.00 0.48 0.00 0.00 55.95 57.08 1xmw s SER 169 Cb -0.06 -2.27 -0.04 0.00 0.10 0.00 0.00 66.02 63.74 1xmw s SER 169 CO -0.14 -0.11 -0.06 0.12 0.98 0.00 0.00 173.24 174.03 1xmw s PHE 170 N 1.32 1.12 0.00 5.02 2.19 -1.26 -4.94 117.98 121.43 1xmw s PHE 170 Ca 0.22 -0.88 0.00 0.00 0.33 0.00 0.00 56.93 56.61 1xmw s PHE 170 Cb -0.15 -0.61 -0.01 0.00 -1.31 0.00 0.00 43.02 40.94 1xmw s PHE 170 CO 0.09 -0.08 -0.02 0.99 1.83 0.00 0.00 175.22 178.03 1xmw s THR 171 N -3.52 0.13 -0.03 0.12 2.01 -1.20 -0.09 115.64 113.07 1xmw s THR 171 Ca 0.17 -0.25 -0.06 0.00 0.31 0.00 0.00 61.69 61.85 1xmw s THR 171 Cb 0.04 -0.15 0.01 0.00 0.01 0.00 0.00 72.50 72.41 1xmw s THR 171 CO -0.01 -0.08 0.14 -0.22 -0.69 0.00 0.00 174.62 173.77 1xmw s LEU 172 N -0.35 1.49 0.16 4.42 0.20 -1.00 -2.20 118.68 121.39 1xmw s LEU 172 Ca -0.03 0.05 0.11 0.00 0.69 0.00 0.00 54.13 54.95 1xmw s LEU 172 Cb -0.03 0.60 -0.04 0.00 -0.43 0.00 0.00 46.19 46.29 1xmw s LEU 172 CO -0.00 -0.21 -0.22 -1.58 -0.29 0.00 0.00 176.35 174.04 1xmw s GLN 173 N -0.65 1.59 0.01 1.98 0.74 -0.55 -1.38 119.66 121.39 1xmw s GLN 173 Ca -0.07 -1.38 0.01 0.00 0.05 0.00 0.00 55.36 53.97 1xmw s GLN 173 Cb -0.04 -1.95 -0.01 0.00 1.10 0.00 0.00 33.01 32.11 1xmw s GLN 173 CO 0.01 0.43 -0.04 0.54 -0.55 0.00 0.00 175.29 175.68 1xmw s VAL 174 N -1.38 0.31 -0.26 1.34 0.11 0.56 -1.98 120.40 119.09 1xmw s VAL 174 Ca 0.18 -0.37 -0.01 0.00 -2.93 0.00 0.00 61.98 58.85 1xmw s VAL 174 Cb -0.09 -0.30 0.15 0.00 -1.53 0.00 0.00 36.38 34.61 1xmw s VAL 174 CO 0.09 -0.04 0.44 -0.72 -3.33 0.00 0.00 175.10 171.54 1xmw s TYR 175 N -0.41 -1.08 -0.59 1.54 1.13 -1.03 0.20 117.35 117.11 1xmw s TYR 175 Ca -0.02 1.00 -0.22 0.00 -1.41 0.00 0.00 57.07 56.42 1xmw s TYR 175 Cb -0.03 0.14 0.07 0.00 -1.10 0.00 0.00 41.96 41.04 1xmw s TYR 175 CO -0.00 -0.80 0.85 0.71 -2.51 0.00 0.00 175.55 173.79 1xmw s TYR 176 N 2.63 2.83 0.06 -3.49 1.51 -0.64 -2.72 117.35 117.53 1xmw s TYR 176 Ca 0.14 -0.50 -0.31 0.00 -1.01 0.00 0.00 57.07 55.40 1xmw s TYR 176 Cb -0.15 -4.05 -0.06 0.00 -0.11 0.00 0.00 41.96 37.59 1xmw s TYR 176 CO -0.19 -1.40 1.28 1.03 -1.11 0.00 0.00 175.55 175.16 1xmw s ARG 177 N 3.53 4.37 0.00 -0.62 1.81 0.41 -4.68 118.95 123.76 1xmw s ARG 177 Ca 0.21 1.88 0.00 0.00 -1.72 0.00 0.00 55.73 56.09 1xmw s ARG 177 Cb -0.18 -3.37 0.00 0.00 -0.45 0.00 0.00 34.95 30.96 1xmw s ARG 177 CO 0.12 -0.37 0.00 -0.12 -0.68 0.00 0.00 175.30 174.25