#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 -7.33 -4.04 -2.24 2.03 -1.26 -4.88 116.55 98.83 1xmw n ASP 2 Ca 0.00 0.58 -0.43 0.00 0.52 0.00 0.00 54.79 55.46 1xmw n ASP 2 Cb 0.00 -4.22 0.01 0.00 -0.72 0.00 0.00 41.12 36.19 1xmw n ASP 2 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 1xmw n ALA 3 N 0.11 5.05 -1.35 -1.67 0.00 -1.26 -5.03 120.51 116.36 1xmw n ALA 3 Ca 0.04 -4.72 -0.30 0.00 0.00 0.00 0.00 53.44 48.46 1xmw n ALA 3 Cb 0.41 -2.45 0.11 0.00 0.00 0.00 0.00 19.45 17.52 1xmw n ALA 3 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 177.50 175.67 1xmw s GLU 4 N -2.14 1.73 0.00 0.00 -1.05 -1.26 -4.98 118.70 111.00 1xmw s GLU 4 Ca 0.32 0.80 0.00 0.00 -0.15 0.00 0.00 54.97 55.94 1xmw s GLU 4 Cb 0.03 -1.86 0.00 0.00 -0.44 0.00 0.00 34.13 31.86 1xmw s GLU 4 CO 0.07 -1.91 0.64 0.27 0.95 0.00 0.00 175.26 175.28 1xmw n ASN 5 N -3.65 -0.26 -1.59 0.83 2.04 -1.26 -4.93 115.26 106.44 1xmw n ASN 5 Ca 0.07 -1.28 -0.01 0.00 -0.44 0.00 0.00 54.58 52.92 1xmw n ASN 5 Cb 0.55 0.07 0.24 0.00 -2.53 0.00 0.00 39.78 38.12 1xmw n ASN 5 CO 0.00 0.00 0.00 2.30 -0.44 0.00 0.00 177.26 179.12 1xmw n ILE 6 N 0.00 2.11 -4.18 1.53 -5.35 -1.26 -5.04 119.36 107.17 1xmw n ILE 6 Ca -0.07 -1.08 0.00 0.00 -0.27 0.00 0.00 62.75 61.33 1xmw n ILE 6 Cb 0.56 -0.42 0.00 0.00 -1.74 0.00 0.00 39.64 38.03 1xmw n ILE 6 CO 0.00 0.00 0.00 1.21 -1.76 0.00 0.00 176.55 176.00 1xmw n GLU 7 N 0.14 0.00 -1.63 6.28 4.07 -1.26 -4.61 120.64 123.63 1xmw n GLU 7 Ca 0.26 0.00 -0.47 0.00 -0.06 0.00 0.00 57.16 56.88 1xmw n GLU 7 Cb 1.03 0.00 -0.04 0.00 -0.06 0.00 0.00 31.44 32.37 1xmw n GLU 7 CO 0.00 0.00 0.00 0.66 -0.06 0.00 0.00 177.13 177.73 1xmw n TYR 8 N 0.00 1.85 -3.98 4.31 4.02 -1.26 -4.66 117.16 117.43 1xmw n TYR 8 Ca 0.00 0.50 -0.23 0.00 -0.01 0.00 0.00 57.90 58.16 1xmw n TYR 8 Cb 0.00 -2.41 -0.03 0.00 -0.02 0.00 0.00 39.34 36.89 1xmw n TYR 8 CO 0.00 0.00 0.00 0.15 -1.01 0.00 0.00 176.86 176.00 1xmw s LYS 9 N -0.01 3.37 -0.05 -0.72 1.02 -1.08 -4.90 119.74 117.37 1xmw s LYS 9 Ca 0.74 -0.74 0.00 0.00 0.02 0.00 0.00 55.97 56.00 1xmw s LYS 9 Cb -0.76 -2.87 0.02 0.00 -0.52 0.00 0.00 37.83 33.70 1xmw s LYS 9 CO 0.48 0.46 -0.03 0.08 -0.92 0.00 0.00 175.35 175.42 1xmw s VAL 10 N -1.90 0.48 -0.36 3.17 1.01 -1.26 -2.00 120.40 119.54 1xmw s VAL 10 Ca 0.34 -0.05 0.00 0.00 0.00 0.00 0.00 61.98 62.27 1xmw s VAL 10 Cb -0.10 -0.54 0.14 0.00 0.00 0.00 0.00 36.38 35.88 1xmw s VAL 10 CO 0.28 0.23 0.21 -0.44 0.00 0.00 0.00 175.10 175.38 1xmw s SER 11 N 1.20 3.04 -0.01 3.32 0.01 -0.43 -5.00 113.70 115.83 1xmw s SER 11 Ca -0.07 -2.19 -0.18 0.00 1.31 0.00 0.00 55.95 54.83 1xmw s SER 11 Cb -0.14 -0.45 -0.06 0.00 0.21 0.00 0.00 66.02 65.59 1xmw s SER 11 CO -0.02 -0.31 0.49 -0.63 0.41 0.00 0.00 173.24 173.19 1xmw s ILE 12 N 1.05 4.97 -0.29 1.44 1.09 -1.26 -2.23 121.20 125.97 1xmw s ILE 12 Ca 0.18 1.02 0.02 0.00 -1.10 0.00 0.00 60.65 60.77 1xmw s ILE 12 Cb -0.23 -3.82 0.08 0.00 -1.06 0.00 0.00 42.46 37.44 1xmw s ILE 12 CO -0.00 0.49 0.01 -0.44 -0.10 0.00 0.00 174.94 174.90 1xmw s SER 13 N -0.57 4.30 1.48 3.58 0.01 -0.78 -4.93 113.70 116.80 1xmw s SER 13 Ca 0.27 -1.67 0.00 0.00 1.31 0.00 0.00 55.95 55.85 1xmw s SER 13 Cb -0.17 -1.32 0.00 0.00 0.21 0.00 0.00 66.02 64.73 1xmw s SER 13 CO 0.15 -0.32 0.00 0.61 0.41 0.00 0.00 173.24 174.08 1xmw n GLY 14 N 4.52 2.59 2.11 3.44 0.00 -1.26 -2.23 105.19 114.36 1xmw n GLY 14 Ca -0.04 -0.09 -0.28 0.00 0.00 0.00 0.00 46.02 45.62 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 3.09 -4.34 2.61 -1.04 -1.26 -4.84 114.28 108.49 1xmw n THR 15 Ca 0.00 -3.42 -0.24 0.00 -2.04 0.00 0.00 64.05 58.35 1xmw n THR 15 Cb 0.00 -1.07 -0.12 0.00 -1.82 0.00 0.00 70.33 67.32 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 -2.60 2.83 -0.22 8.00 0.15 -0.95 -1.42 113.70 119.49 1xmw s SER 16 Ca 0.57 -0.82 -0.05 0.00 0.70 0.00 0.00 55.95 56.36 1xmw s SER 16 Cb 0.46 -0.18 0.08 0.00 -1.71 0.00 0.00 66.02 64.67 1xmw s SER 16 CO 0.01 0.03 0.11 -0.69 1.20 0.00 0.00 173.24 173.90 1xmw s VAL 17 N -1.73 -0.07 -0.36 4.45 1.01 -0.81 -1.86 120.40 121.02 1xmw s VAL 17 Ca 0.15 -0.43 -0.12 0.00 0.00 0.00 0.00 61.98 61.58 1xmw s VAL 17 Cb -0.07 -0.76 0.01 0.00 0.00 0.00 0.00 36.38 35.56 1xmw s VAL 17 CO 0.07 -0.47 0.22 -0.70 0.00 0.00 0.00 175.10 174.21 1xmw s GLU 18 N 2.11 3.07 -0.15 2.72 2.12 -0.95 -0.30 118.70 127.33 1xmw s GLU 18 Ca 0.05 -0.93 -0.05 0.00 0.36 0.00 0.00 54.97 54.41 1xmw s GLU 18 Cb -0.16 -3.76 -0.03 0.00 0.26 0.00 0.00 34.13 30.44 1xmw s GLU 18 CO -0.21 -0.61 0.01 -0.51 -0.54 0.00 0.00 175.26 173.40 1xmw s LEU 19 N 1.62 3.56 -0.37 2.70 1.43 -0.55 -1.32 118.68 125.75 1xmw s LEU 19 Ca 0.04 0.03 -0.21 0.00 -1.03 0.00 0.00 54.13 52.96 1xmw s LEU 19 Cb -0.18 -1.86 0.01 0.00 0.03 0.00 0.00 46.19 44.18 1xmw s LEU 19 CO 0.08 0.23 0.66 -0.89 0.23 0.00 0.00 176.35 176.66 1xmw s THR 20 N 0.01 4.85 0.41 5.49 2.01 -0.85 0.12 115.64 127.70 1xmw s THR 20 Ca 0.03 0.57 -0.23 0.00 0.31 0.00 0.00 61.69 62.37 1xmw s THR 20 Cb -0.13 -4.12 -0.12 0.00 0.01 0.00 0.00 72.50 68.15 1xmw s THR 20 CO 0.02 -0.37 0.76 0.00 -0.69 0.00 0.00 174.62 174.33 1xmw n PRO 22 N 0.38 0.37 -3.85 0.00 -0.04 -1.26 -4.72 135.00 125.89 1xmw n PRO 22 Ca 0.11 0.00 -0.11 0.00 -0.04 0.00 0.00 63.50 63.46 1xmw n PRO 22 Cb 0.39 -1.31 0.01 0.00 -0.04 0.00 0.00 33.50 32.55 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 1.02 0.00 -4.61 1.53 -0.00 -1.26 -5.00 117.00 108.68 1xmw n LEU 23 Ca 0.00 -2.68 -0.29 0.00 -0.00 0.00 0.00 56.01 53.03 1xmw n LEU 23 Cb 0.19 3.52 0.22 0.00 -0.00 0.00 0.00 43.42 47.35 1xmw n LEU 23 CO 0.00 -0.81 0.62 1.51 -0.00 0.00 0.00 177.39 178.70 1xmw s ASP 24 N -3.12 1.55 0.09 1.45 1.47 -1.26 -4.94 116.67 111.92 1xmw s ASP 24 Ca 0.20 0.91 -0.30 0.00 1.18 0.00 0.00 52.55 54.54 1xmw s ASP 24 Cb -0.04 -1.38 -0.06 0.00 -0.34 0.00 0.00 42.92 41.10 1xmw s ASP 24 CO 0.14 -3.76 1.14 -0.44 0.68 0.00 0.00 175.17 172.93 1xmw s SER 25 N -3.61 7.18 -0.16 2.11 0.01 -1.26 -4.77 113.70 113.20 1xmw s SER 25 Ca 0.68 2.00 -0.00 0.00 1.31 0.00 0.00 55.95 59.94 1xmw s SER 25 Cb -0.15 -2.59 -0.00 0.00 0.21 0.00 0.00 66.02 63.49 1xmw s SER 25 CO 0.57 -0.36 -0.13 -0.62 0.41 0.00 0.00 173.24 173.11 1xmw s ASP 26 N 0.65 3.79 0.59 2.44 2.15 -1.26 -4.94 116.67 120.09 1xmw s ASP 26 Ca 0.55 -0.44 0.29 0.00 0.43 0.00 0.00 52.55 53.37 1xmw s ASP 26 Cb -0.28 -1.59 1.33 0.00 -0.30 0.00 0.00 42.92 42.07 1xmw s ASP 26 CO 0.31 0.08 1.72 -0.08 -0.17 0.00 0.00 175.17 177.02 1xmw h GLU 27 N 7.36 0.00 0.00 4.34 4.57 -1.96 1.20 114.58 130.09 1xmw h GLU 27 Ca -0.34 0.00 -0.00 0.00 -1.18 0.00 0.00 59.36 57.84 1xmw h GLU 27 Cb 1.19 0.00 -0.00 0.00 -0.16 0.00 0.00 28.75 29.77 1xmw h GLU 27 CO 0.58 0.00 -0.41 0.09 -1.18 0.00 0.00 179.01 178.09 1xmw n ASN 28 N -3.57 1.82 -4.59 1.04 4.13 -1.26 -4.97 115.26 107.86 1xmw n ASN 28 Ca 0.14 -3.74 -0.42 0.00 1.68 0.00 0.00 54.58 52.24 1xmw n ASN 28 Cb 0.96 -0.51 -0.03 0.00 -1.54 0.00 0.00 39.78 38.66 1xmw n ASN 28 CO 0.00 0.00 0.00 -0.11 0.28 0.00 0.00 177.26 177.43 1xmw n LEU 29 N -1.17 3.11 -4.67 3.41 7.94 0.41 -4.71 117.00 121.32 1xmw n LEU 29 Ca 0.18 0.08 -0.39 0.00 -1.11 0.00 0.00 56.01 54.76 1xmw n LEU 29 Cb 0.68 -1.56 -0.06 0.00 0.53 0.00 0.00 43.42 43.01 1xmw n LEU 29 CO -0.03 -0.84 0.31 -0.54 -1.11 0.00 0.00 177.39 175.18 1xmw s LYS 30 N 6.70 4.24 0.35 1.96 1.02 0.01 -4.56 119.74 129.46 1xmw s LYS 30 Ca 1.01 0.56 0.06 0.00 0.02 0.00 0.00 55.97 57.62 1xmw s LYS 30 Cb -0.30 -3.54 -0.01 0.00 -0.52 0.00 0.00 37.83 33.45 1xmw s LYS 30 CO 0.34 -0.14 0.49 -1.58 -0.92 0.00 0.00 175.35 173.54 1xmw s TRP 31 N 1.57 3.11 0.01 3.18 0.52 -1.26 -0.75 118.94 125.33 1xmw s TRP 31 Ca 0.28 -0.20 -0.02 0.00 0.02 0.00 0.00 56.10 56.18 1xmw s TRP 31 Cb -0.16 -2.03 -0.01 0.00 -1.15 0.00 0.00 33.47 30.12 1xmw s TRP 31 CO 0.11 -0.05 0.02 -2.00 0.02 0.00 0.00 176.95 175.04 1xmw s GLU 32 N -4.21 0.35 -0.13 4.98 2.12 0.33 -2.58 118.70 119.57 1xmw s GLU 32 Ca 0.46 -0.53 -0.03 0.00 0.36 0.00 0.00 54.97 55.23 1xmw s GLU 32 Cb -0.10 0.13 0.05 0.00 0.26 0.00 0.00 34.13 34.47 1xmw s GLU 32 CO 0.32 -0.07 0.04 0.21 -0.54 0.00 0.00 175.26 175.22 1xmw s LYS 33 N -1.39 0.42 -1.39 4.30 2.36 0.47 -2.53 119.74 121.98 1xmw s LYS 33 Ca -0.15 -0.08 0.00 0.00 -2.55 0.00 0.00 55.97 53.19 1xmw s LYS 33 Cb -0.09 -1.50 0.00 0.00 -1.05 0.00 0.00 37.83 35.19 1xmw s LYS 33 CO -0.00 -0.51 0.00 -1.71 1.55 0.00 0.00 175.35 174.68 1xmw n ASN 34 N 5.16 -4.25 -0.04 1.43 4.05 -0.28 -0.80 115.26 120.54 1xmw n ASN 34 Ca -0.07 0.23 0.00 0.00 0.45 0.00 0.00 54.58 55.19 1xmw n ASN 34 Cb 0.49 -3.70 0.00 0.00 1.23 0.00 0.00 39.78 37.80 1xmw n ASN 34 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 177.26 174.82 1xmw n GLY 35 N -0.63 1.17 2.88 8.20 0.00 -1.26 -4.99 105.19 110.57 1xmw n GLY 35 Ca -0.16 -0.42 -0.23 0.00 0.00 0.00 0.00 46.02 45.21 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 -2.46 1.09 0.10 1.61 0.74 0.02 -4.78 119.66 115.99 1xmw s GLN 36 Ca 0.00 -0.14 -0.31 0.00 0.05 0.00 0.00 55.36 54.97 1xmw s GLN 36 Cb 0.00 -1.16 -0.07 0.00 1.10 0.00 0.00 33.01 32.88 1xmw s GLN 36 CO 0.00 -0.17 1.25 -1.21 -0.55 0.00 0.00 175.29 174.60 1xmw s GLU 37 N 1.37 4.42 -0.34 1.67 8.01 -1.26 -0.39 118.70 132.17 1xmw s GLU 37 Ca -0.03 1.87 -0.23 0.00 0.01 0.00 0.00 54.97 56.59 1xmw s GLU 37 Cb -0.14 -3.30 0.00 0.00 -4.31 0.00 0.00 34.13 26.39 1xmw s GLU 37 CO -0.03 -0.27 0.77 -0.51 0.01 0.00 0.00 175.26 175.23 1xmw s LEU 38 N 0.78 4.12 0.00 1.80 1.43 -1.06 -4.93 118.68 120.82 1xmw s LEU 38 Ca 0.59 0.47 -0.04 0.00 -1.03 0.00 0.00 54.13 54.11 1xmw s LEU 38 Cb -0.32 -3.02 -0.18 0.00 0.03 0.00 0.00 46.19 42.70 1xmw s LEU 38 CO 0.31 -0.66 3.02 -0.81 0.23 0.00 0.00 176.35 178.44 1xmw n PRO 39 N 6.28 1.62 0.00 1.29 -0.04 -1.26 -4.65 135.00 138.24 1xmw n PRO 39 Ca 0.03 -0.68 0.00 0.00 -0.04 0.00 0.00 63.50 62.81 1xmw n PRO 39 Cb 0.48 -1.71 0.00 0.00 -0.04 0.00 0.00 33.50 32.24 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 2.24 -0.58 -3.36 0.54 1.13 -1.26 -5.06 117.38 111.03 1xmw n GLN 40 Ca 0.29 0.00 -0.10 0.00 -1.94 0.00 0.00 57.00 55.25 1xmw n GLN 40 Cb 0.76 0.00 0.00 0.00 0.11 0.00 0.00 30.24 31.11 1xmw n GLN 40 CO 0.00 0.00 0.00 1.17 -1.44 0.00 0.00 177.06 176.79 1xmw n LYS 41 N -0.13 -1.41 -1.02 -1.09 3.00 -1.26 -4.87 118.16 111.38 1xmw n LYS 41 Ca 0.00 1.18 -0.17 0.00 -0.00 0.00 0.00 58.31 59.32 1xmw n LYS 41 Cb 0.00 -4.36 0.18 0.00 0.00 0.00 0.00 35.03 30.85 1xmw n LYS 41 CO 0.00 0.00 0.00 0.72 0.00 0.00 0.00 177.40 178.12 1xmw n HIS 42 N -2.16 2.53 -2.56 5.64 8.25 -1.26 -4.81 115.22 120.84 1xmw n HIS 42 Ca -0.13 -1.52 -0.27 0.00 -0.26 0.00 0.00 57.72 55.53 1xmw n HIS 42 Cb 0.58 -0.80 0.00 0.00 1.12 0.00 0.00 29.99 30.90 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 -0.93 6.16 0.63 0.41 1.01 -1.26 -4.12 116.67 118.57 1xmw s ASP 43 Ca 0.49 0.92 0.30 0.00 0.71 0.00 0.00 52.55 54.96 1xmw s ASP 43 Cb 0.40 -2.17 1.63 0.00 1.01 0.00 0.00 42.92 43.79 1xmw s ASP 43 CO 0.10 -0.67 1.96 0.50 0.21 0.00 0.00 175.17 177.28 1xmw h LYS 44 N 0.14 0.00 -5.77 8.23 3.64 -1.91 -3.40 116.57 117.51 1xmw h LYS 44 Ca -0.47 0.00 -0.66 0.00 -1.27 0.00 0.00 60.65 58.25 1xmw h LYS 44 Cb 1.21 0.00 -0.16 0.00 -0.41 0.00 0.00 32.23 32.87 1xmw h LYS 44 CO 0.61 0.00 -0.62 -1.01 -2.27 0.00 0.00 179.45 176.16 1xmw s HIS 45 N -4.33 3.15 -0.69 1.91 3.76 -1.26 0.82 115.29 118.65 1xmw s HIS 45 Ca -0.04 0.09 -0.11 0.00 -0.15 0.00 0.00 55.06 54.85 1xmw s HIS 45 Cb 0.12 -1.85 0.18 0.00 1.11 0.00 0.00 32.58 32.13 1xmw s HIS 45 CO 0.40 0.34 0.60 -1.17 -0.85 0.00 0.00 174.74 174.05 1xmw s LEU 46 N -0.50 6.17 -0.05 0.89 2.96 0.33 -4.80 118.68 123.68 1xmw s LEU 46 Ca 0.09 -2.52 -0.27 0.00 -0.22 0.00 0.00 54.13 51.21 1xmw s LEU 46 Cb -0.12 -2.09 -0.03 0.00 0.50 0.00 0.00 46.19 44.45 1xmw s LEU 46 CO 0.02 -0.57 0.85 -0.69 -1.32 0.00 0.00 176.35 174.64 1xmw s VAL 47 N 0.44 4.94 -0.37 1.68 1.01 -1.25 -1.48 120.40 125.38 1xmw s VAL 47 Ca 0.14 1.76 -0.01 0.00 0.00 0.00 0.00 61.98 63.87 1xmw s VAL 47 Cb -0.17 -4.18 0.09 0.00 0.00 0.00 0.00 36.38 32.12 1xmw s VAL 47 CO -0.05 0.18 0.12 -0.76 0.00 0.00 0.00 175.10 174.59 1xmw s LEU 48 N 1.08 4.81 0.39 3.92 1.43 0.59 -4.86 118.68 126.03 1xmw s LEU 48 Ca 0.44 -1.87 -0.25 0.00 -1.03 0.00 0.00 54.13 51.42 1xmw s LEU 48 Cb -0.19 -1.76 -0.09 0.00 0.03 0.00 0.00 46.19 44.19 1xmw s LEU 48 CO 0.22 -0.44 1.09 0.00 0.23 0.00 0.00 176.35 177.45 1xmw s GLN 49 N 1.12 4.17 -1.22 1.70 0.00 -1.26 -1.93 119.66 122.24 1xmw s GLN 49 Ca 0.05 1.65 -0.11 0.00 -0.00 0.00 0.00 55.36 56.96 1xmw s GLN 49 Cb -0.21 -2.65 -0.01 0.00 0.00 0.00 0.00 33.01 30.13 1xmw s GLN 49 CO -0.04 -0.17 0.72 -0.25 0.00 0.00 0.00 175.29 175.55 1xmw n ASP 50 N 0.11 -3.59 -4.55 12.60 8.00 -0.51 -4.81 116.55 123.80 1xmw n ASP 50 Ca 0.04 -0.94 -0.37 0.00 0.71 0.00 0.00 54.79 54.23 1xmw n ASP 50 Cb 0.48 -3.65 -0.03 0.00 -0.02 0.00 0.00 41.12 37.90 1xmw n ASP 50 CO 0.00 0.00 0.00 0.12 -0.39 0.00 0.00 177.20 176.93 1xmw s PHE 51 N -3.59 1.95 0.17 1.24 5.36 -0.54 -4.97 117.98 117.59 1xmw s PHE 51 Ca 0.28 0.35 -0.30 0.00 -0.96 0.00 0.00 56.93 56.30 1xmw s PHE 51 Cb -0.09 -4.28 -0.07 0.00 -0.34 0.00 0.00 43.02 38.23 1xmw s PHE 51 CO 0.84 -2.09 1.02 -1.12 -1.46 0.00 0.00 175.22 172.42 1xmw s SER 52 N 6.67 7.42 0.00 6.13 0.01 -1.26 -4.15 113.70 128.51 1xmw s SER 52 Ca 0.58 1.96 0.24 0.00 1.31 0.00 0.00 55.95 60.04 1xmw s SER 52 Cb -0.09 -2.60 1.44 0.00 0.21 0.00 0.00 66.02 64.99 1xmw s SER 52 CO 0.11 -0.10 1.81 1.21 0.41 0.00 0.00 173.24 176.68 1xmw n GLU 53 N 2.35 0.75 -0.08 12.44 0.00 -1.26 -1.39 120.64 133.45 1xmw n GLU 53 Ca 0.02 0.00 -0.11 0.00 0.00 0.00 0.00 57.16 57.07 1xmw n GLU 53 Cb 0.47 -1.50 -0.05 0.00 0.00 0.00 0.00 31.44 30.37 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 -1.00 1.46 -0.06 6.31 0.31 -1.26 -4.30 118.33 119.79 1xmw n VAL 54 Ca 0.18 0.12 -0.03 0.00 -0.01 0.00 0.00 64.34 64.60 1xmw n VAL 54 Cb 0.09 -2.27 -0.12 0.00 -0.91 0.00 0.00 33.84 30.62 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 -4.53 1.30 0.20 5.55 0.00 -1.25 -4.46 120.64 117.45 1xmw n GLU 55 Ca -0.17 -0.04 0.09 0.00 0.00 0.00 0.00 57.16 57.04 1xmw n GLU 55 Cb 0.43 -1.38 0.22 0.00 0.00 0.00 0.00 31.44 30.72 1xmw n GLU 55 CO 0.00 0.00 0.00 0.22 0.00 0.00 0.00 177.13 177.35 1xmw h ASP 56 N 0.00 0.00 -3.75 4.31 3.58 -1.52 -3.45 116.42 115.60 1xmw h ASP 56 Ca -0.29 0.00 -0.50 0.00 0.42 0.00 0.00 57.03 56.66 1xmw h ASP 56 Cb 1.59 0.00 -0.00 0.00 1.72 0.00 0.00 39.33 42.64 1xmw h ASP 56 CO 0.02 0.20 0.42 -0.94 -2.88 0.00 0.00 179.24 176.06 1xmw s SER 57 N -6.24 7.43 0.00 2.28 1.04 -1.04 -4.92 113.70 112.25 1xmw s SER 57 Ca 0.04 2.11 0.00 0.00 0.48 0.00 0.00 55.95 58.58 1xmw s SER 57 Cb 0.07 -2.62 0.00 0.00 0.10 0.00 0.00 66.02 63.57 1xmw s SER 57 CO 0.68 -0.03 0.00 0.61 0.98 0.00 0.00 173.24 175.48 1xmw n GLY 58 N 1.44 -0.49 3.89 7.32 0.00 -1.02 -4.93 105.19 111.39 1xmw n GLY 58 Ca -0.01 -0.95 -0.29 0.00 0.00 0.00 0.00 46.02 44.77 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 -3.48 3.48 -0.07 1.61 2.02 -1.26 -1.20 117.35 118.45 1xmw s TYR 59 Ca 0.00 0.86 -0.06 0.00 -0.37 0.00 0.00 57.07 57.50 1xmw s TYR 59 Cb 0.00 -2.29 0.02 0.00 -0.40 0.00 0.00 41.96 39.29 1xmw s TYR 59 CO 0.00 -0.00 0.19 0.71 -1.57 0.00 0.00 175.55 174.88 1xmw s TYR 60 N -2.28 -0.22 -0.02 2.71 1.51 0.50 -1.12 117.35 118.43 1xmw s TYR 60 Ca 0.48 0.53 -0.25 0.00 -1.01 0.00 0.00 57.07 56.82 1xmw s TYR 60 Cb -0.10 0.06 0.05 0.00 -0.11 0.00 0.00 41.96 41.86 1xmw s TYR 60 CO 0.32 -0.12 0.55 0.54 -1.11 0.00 0.00 175.55 175.73 1xmw s VAL 61 N 0.31 0.02 0.04 0.71 0.11 -1.05 -1.87 120.40 118.67 1xmw s VAL 61 Ca -0.02 -0.17 0.00 0.00 -2.93 0.00 0.00 61.98 58.87 1xmw s VAL 61 Cb -0.03 -0.90 -0.03 0.00 -1.53 0.00 0.00 36.38 33.89 1xmw s VAL 61 CO -0.01 -0.09 -0.04 0.00 -3.33 0.00 0.00 175.10 171.62 1xmw s TYR 63 N -2.40 -0.11 0.31 0.00 -0.85 0.08 -4.83 117.35 109.55 1xmw s TYR 63 Ca -0.05 -0.28 0.03 0.00 -0.52 0.00 0.00 57.07 56.26 1xmw s TYR 63 Cb -0.03 0.51 -0.06 0.00 0.38 0.00 0.00 41.96 42.75 1xmw s TYR 63 CO -0.04 -1.06 0.07 0.95 -1.52 0.00 0.00 175.55 173.95 1xmw s THR 64 N -3.91 1.05 -0.84 -3.49 -4.23 -0.70 -0.81 115.64 102.72 1xmw s THR 64 Ca 0.11 -2.00 0.17 0.00 -1.18 0.00 0.00 61.69 58.80 1xmw s THR 64 Cb -0.03 -2.76 0.16 0.00 1.34 0.00 0.00 72.50 71.21 1xmw s THR 64 CO 0.02 -0.00 1.54 -0.81 -0.54 0.00 0.00 174.62 174.83 1xmw n PRO 65 N -0.63 0.06 -0.03 3.99 -0.04 -1.26 -2.95 135.00 134.14 1xmw n PRO 65 Ca -0.02 0.31 -0.01 0.00 -0.04 0.00 0.00 63.50 63.74 1xmw n PRO 65 Cb 0.66 -1.62 -0.06 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 1.99 -4.00 0.55 0.00 -1.26 -4.90 120.51 111.30 1xmw n ALA 66 Ca 0.03 -0.41 -0.32 0.00 0.00 0.00 0.00 53.44 52.74 1xmw n ALA 66 Cb 0.19 -0.05 -0.15 0.00 0.00 0.00 0.00 19.45 19.44 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 -3.63 4.76 -0.33 0.00 1.04 -1.15 -5.07 113.70 109.31 1xmw s SER 67 Ca -0.04 -2.01 -0.04 0.00 0.48 0.00 0.00 55.95 54.35 1xmw s SER 67 Cb 0.03 -1.63 0.05 0.00 0.10 0.00 0.00 66.02 64.57 1xmw s SER 67 CO 0.34 -0.36 0.07 0.54 0.98 0.00 0.00 173.24 174.81 1xmw s ASN 68 N 1.01 5.13 -0.14 7.02 4.22 -1.26 -1.73 114.94 129.18 1xmw s ASN 68 Ca 0.07 -1.31 0.00 0.00 -2.14 0.00 0.00 52.86 49.48 1xmw s ASN 68 Cb -0.19 -1.80 0.03 0.00 1.28 0.00 0.00 41.25 40.57 1xmw s ASN 68 CO -0.07 -0.33 -0.11 -0.54 -2.04 0.00 0.00 177.10 174.01 1xmw s LYS 69 N 1.31 1.99 -0.68 3.55 1.02 -1.26 -5.07 119.74 120.59 1xmw s LYS 69 Ca -0.02 -0.50 -0.26 0.00 0.02 0.00 0.00 55.97 55.21 1xmw s LYS 69 Cb -0.20 -1.98 -0.02 0.00 -0.52 0.00 0.00 37.83 35.10 1xmw s LYS 69 CO 0.00 -0.28 1.84 -0.80 -0.92 0.00 0.00 175.35 175.20 1xmw s ASN 70 N 1.55 5.30 -0.01 2.83 0.01 -1.26 -4.92 114.94 118.44 1xmw s ASN 70 Ca 0.04 0.06 -0.00 0.00 -0.71 0.00 0.00 52.86 52.25 1xmw s ASN 70 Cb -0.13 -2.54 0.02 0.00 0.41 0.00 0.00 41.25 39.01 1xmw s ASN 70 CO -0.10 -2.42 0.02 0.28 -1.51 0.00 0.00 177.10 173.38 1xmw s THR 71 N 9.07 -0.04 0.07 1.60 -1.32 -1.26 -2.52 115.64 121.24 1xmw s THR 71 Ca 0.66 0.13 0.09 0.00 -1.21 0.00 0.00 61.69 61.36 1xmw s THR 71 Cb -0.11 -0.06 -0.03 0.00 -1.51 0.00 0.00 72.50 70.79 1xmw s THR 71 CO 0.15 0.05 -0.24 -0.31 -2.21 0.00 0.00 174.62 172.07 1xmw s TYR 72 N 0.66 2.05 -0.10 9.09 1.51 -0.99 -4.65 117.35 124.92 1xmw s TYR 72 Ca -0.05 -0.39 0.01 0.00 -1.01 0.00 0.00 57.07 55.62 1xmw s TYR 72 Cb -0.08 -1.19 0.02 0.00 -0.11 0.00 0.00 41.96 40.60 1xmw s TYR 72 CO -0.02 0.16 -0.10 -1.17 -1.11 0.00 0.00 175.55 173.31 1xmw s LEU 73 N -1.45 1.42 -0.78 -1.29 0.20 -0.78 0.15 118.68 116.15 1xmw s LEU 73 Ca 0.10 -0.33 -0.21 0.00 0.69 0.00 0.00 54.13 54.38 1xmw s LEU 73 Cb -0.10 -0.89 0.09 0.00 -0.43 0.00 0.00 46.19 44.87 1xmw s LEU 73 CO 0.03 -0.06 1.04 -0.47 -0.29 0.00 0.00 176.35 176.60 1xmw s TYR 74 N 1.31 2.86 -0.33 5.38 6.14 -0.09 -0.37 117.35 132.25 1xmw s TYR 74 Ca -0.02 -0.91 -0.16 0.00 0.64 0.00 0.00 57.07 56.62 1xmw s TYR 74 Cb -0.14 -4.29 -0.01 0.00 0.42 0.00 0.00 41.96 37.94 1xmw s TYR 74 CO -0.04 -1.58 0.42 -1.17 0.64 0.00 0.00 175.55 173.81 1xmw s LEU 75 N 3.50 4.34 -0.33 6.97 2.96 -0.34 -1.08 118.68 134.70 1xmw s LEU 75 Ca 0.27 -0.07 0.01 0.00 -0.22 0.00 0.00 54.13 54.12 1xmw s LEU 75 Cb -0.12 -2.44 0.10 0.00 0.50 0.00 0.00 46.19 44.23 1xmw s LEU 75 CO 0.01 -0.36 0.09 -0.75 -1.32 0.00 0.00 176.35 174.02 1xmw s LYS 76 N 2.16 1.06 0.30 1.98 2.20 -1.01 -2.43 119.74 123.99 1xmw s LYS 76 Ca 0.15 -1.46 0.06 0.00 -0.36 0.00 0.00 55.97 54.36 1xmw s LYS 76 Cb -0.16 -2.51 -0.06 0.00 -1.51 0.00 0.00 37.83 33.59 1xmw s LYS 76 CO 0.12 -0.98 -0.01 0.00 -0.36 0.00 0.00 175.35 174.12 1xmw s ALA 77 N 1.25 2.40 -0.07 3.13 0.00 -1.26 -0.49 121.76 126.73 1xmw s ALA 77 Ca 0.11 -1.98 0.01 0.00 0.00 0.00 0.00 51.96 50.09 1xmw s ALA 77 Cb -0.18 0.35 0.02 0.00 0.00 0.00 0.00 23.12 23.31 1xmw s ALA 77 CO -0.17 -0.16 -0.07 0.50 0.00 0.00 0.00 175.76 175.86 1xmw s ARG 78 N -3.79 1.23 -0.15 0.00 3.52 -1.24 -4.04 118.95 114.48 1xmw s ARG 78 Ca 0.32 -0.22 -0.04 0.00 -0.13 0.00 0.00 55.73 55.66 1xmw s ARG 78 Cb 0.06 -1.17 0.07 0.00 -1.56 0.00 0.00 34.95 32.35 1xmw s ARG 78 CO 0.13 -0.09 0.23 0.14 -0.81 0.00 0.00 175.30 174.90 1xmw s VAL 79 N 1.05 -0.36 0.00 7.11 -7.23 -1.26 -5.03 120.40 114.69 1xmw s VAL 79 Ca -0.08 0.15 0.00 0.00 -1.81 0.00 0.00 61.98 60.24 1xmw s VAL 79 Cb -0.14 -0.50 0.00 0.00 0.56 0.00 0.00 36.38 36.29 1xmw s VAL 79 CO -0.00 0.01 0.00 0.61 -0.31 0.00 0.00 175.10 175.40 1xmw n GLY 80 N 5.34 -0.01 0.91 2.32 0.00 -1.26 -4.75 105.19 107.73 1xmw n GLY 80 Ca -0.05 0.08 -0.01 0.00 0.00 0.00 0.00 46.02 46.03 1xmw n GLY 80 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 1xmw n SER 81 N 0.00 -0.49 -3.19 1.61 7.64 -1.26 -5.05 113.62 112.88 1xmw n SER 81 Ca 0.00 -1.31 -0.16 0.00 1.01 0.00 0.00 58.87 58.42 1xmw n SER 81 Cb 0.00 0.81 0.01 0.00 -1.01 0.00 0.00 64.21 64.02 1xmw n SER 81 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1xmw n ALA 82 N -2.44 -2.70 -2.32 -0.43 0.00 -1.26 -5.03 120.51 106.34 1xmw n ALA 82 Ca -0.04 0.50 -0.17 0.00 0.00 0.00 0.00 53.44 53.73 1xmw n ALA 82 Cb 0.14 -2.45 -0.10 0.00 0.00 0.00 0.00 19.45 17.04 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 -2.50 1.22 0.00 0.00 1.01 -1.26 -5.03 116.67 110.11 1xmw s ASP 83 Ca 0.18 -1.44 0.16 0.00 0.71 0.00 0.00 52.55 52.17 1xmw s ASP 83 Cb -0.04 0.24 0.50 0.00 1.01 0.00 0.00 42.92 44.64 1xmw s ASP 83 CO 0.81 -0.78 1.39 -0.90 0.21 0.00 0.00 175.17 175.89 1xmw n ASP 84 N -0.59 1.93 -0.06 0.27 5.68 -1.26 -4.93 116.55 117.59 1xmw n ASP 84 Ca 0.00 -1.88 0.00 0.00 -0.50 0.00 0.00 54.79 52.41 1xmw n ASP 84 Cb 0.66 -0.19 0.00 0.00 -1.14 0.00 0.00 41.12 40.44 1xmw n ASP 84 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 1xmw n ALA 85 N 0.52 0.00 -3.47 2.12 0.00 -1.26 -5.12 120.51 113.30 1xmw n ALA 85 Ca 0.14 0.00 -0.28 0.00 0.00 0.00 0.00 53.44 53.31 1xmw n ALA 85 Cb 0.33 0.00 -0.11 0.00 0.00 0.00 0.00 19.45 19.67 1xmw n ALA 85 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 177.50 177.71 1xmw s LYS 86 N 0.83 1.00 -0.07 0.00 2.36 -1.26 -5.05 119.74 117.54 1xmw s LYS 86 Ca 0.00 -2.06 -0.30 0.00 -2.55 0.00 0.00 55.97 51.06 1xmw s LYS 86 Cb 0.00 -1.63 -0.02 0.00 -1.05 0.00 0.00 37.83 35.13 1xmw s LYS 86 CO 0.00 -1.33 1.02 0.21 1.55 0.00 0.00 175.35 176.80 1xmw s LYS 87 N 0.14 4.46 0.27 4.03 2.20 -1.26 -5.04 119.74 124.55 1xmw s LYS 87 Ca 0.28 1.43 0.11 0.00 -0.36 0.00 0.00 55.97 57.44 1xmw s LYS 87 Cb -0.04 -3.51 -0.05 0.00 -1.51 0.00 0.00 37.83 32.72 1xmw s LYS 87 CO -0.14 -0.24 -0.15 0.34 -0.36 0.00 0.00 175.35 174.79 1xmw s ASP 88 N 1.10 3.83 0.53 1.43 2.15 -1.26 -5.13 116.67 119.31 1xmw s ASP 88 Ca 0.50 -0.93 -0.16 0.00 0.43 0.00 0.00 52.55 52.39 1xmw s ASP 88 Cb -0.20 -0.44 -0.07 0.00 -0.30 0.00 0.00 42.92 41.91 1xmw s ASP 88 CO 0.22 0.03 0.99 0.00 -0.17 0.00 0.00 175.17 176.24 1xmw s ALA 89 N -2.44 3.03 -1.09 3.66 0.00 -1.26 -4.98 121.76 118.68 1xmw s ALA 89 Ca 0.30 0.20 -0.15 0.00 0.00 0.00 0.00 51.96 52.31 1xmw s ALA 89 Cb -0.05 -3.13 0.17 0.00 0.00 0.00 0.00 23.12 20.10 1xmw s ALA 89 CO 0.16 -0.31 1.27 0.00 0.00 0.00 0.00 175.76 176.89 1xmw s ALA 90 N -2.62 3.85 -1.09 0.00 0.00 -1.26 -4.48 121.76 116.17 1xmw s ALA 90 Ca 0.59 -3.20 0.00 0.00 0.00 0.00 0.00 51.96 49.36 1xmw s ALA 90 Cb -0.11 -4.03 0.00 0.00 0.00 0.00 0.00 23.12 18.99 1xmw s ALA 90 CO 0.32 -2.77 0.00 1.63 0.00 0.00 0.00 175.76 174.94 1xmw n LYS 91 N 5.64 -2.18 -3.77 0.00 5.02 -1.26 -1.48 118.16 120.13 1xmw n LYS 91 Ca 0.30 0.62 -0.23 0.00 -2.02 0.00 0.00 58.31 56.98 1xmw n LYS 91 Cb 0.45 -5.20 0.02 0.00 -0.02 0.00 0.00 35.03 30.27 1xmw n LYS 91 CO 0.00 0.00 0.00 1.17 -0.52 0.00 0.00 177.40 178.05 1xmw n LYS 92 N -2.78 -4.59 0.23 1.97 0.00 -1.26 -4.84 118.16 106.89 1xmw n LYS 92 Ca -0.15 0.57 0.09 0.00 0.00 0.00 0.00 58.31 58.82 1xmw n LYS 92 Cb 0.61 -5.06 0.57 0.00 0.00 0.00 0.00 35.03 31.15 1xmw n LYS 92 CO 0.00 0.00 0.00 -0.44 0.00 0.00 0.00 177.40 176.96 1xmw h ASP 93 N -1.87 0.00 -1.84 3.14 5.19 -1.64 -3.41 116.42 115.99 1xmw h ASP 93 Ca -0.61 0.00 -0.53 0.00 -0.62 0.00 0.00 57.03 55.27 1xmw h ASP 93 Cb 1.36 0.00 0.00 0.00 0.18 0.00 0.00 39.33 40.88 1xmw h ASP 93 CO 0.58 0.20 1.55 -1.81 -3.12 0.00 0.00 179.24 176.65 1xmw s ASP 94 N -6.49 4.98 -0.27 6.45 1.01 -1.26 -4.89 116.67 116.19 1xmw s ASP 94 Ca -0.03 1.46 -0.15 0.00 0.71 0.00 0.00 52.55 54.55 1xmw s ASP 94 Cb 0.14 -2.51 0.08 0.00 1.01 0.00 0.00 42.92 41.64 1xmw s ASP 94 CO 0.64 -2.40 0.66 0.00 0.21 0.00 0.00 175.17 174.29 1xmw s ALA 95 N 10.12 -1.81 0.23 5.23 0.00 -1.26 -5.17 121.76 129.09 1xmw s ALA 95 Ca 0.98 2.34 0.02 0.00 0.00 0.00 0.00 51.96 55.30 1xmw s ALA 95 Cb -0.25 -1.41 -0.05 0.00 0.00 0.00 0.00 23.12 21.41 1xmw s ALA 95 CO 0.30 -0.40 0.03 0.15 0.00 0.00 0.00 175.76 175.84 1xmw s LYS 96 N 1.70 1.31 -0.18 0.00 1.02 -1.26 -4.99 119.74 117.34 1xmw s LYS 96 Ca -0.10 -1.67 -0.02 0.00 0.02 0.00 0.00 55.97 54.20 1xmw s LYS 96 Cb -0.06 -0.42 0.01 0.00 -0.52 0.00 0.00 37.83 36.84 1xmw s LYS 96 CO -0.19 -0.17 0.04 1.17 -0.92 0.00 0.00 175.35 175.28 1xmw n LYS 97 N -0.40 -2.62 -3.85 1.68 4.81 -1.26 -5.00 118.16 111.53 1xmw n LYS 97 Ca -0.04 2.22 -0.29 0.00 -0.87 0.00 0.00 58.31 59.34 1xmw n LYS 97 Cb 0.65 -3.76 -0.16 0.00 0.02 0.00 0.00 35.03 31.78 1xmw n LYS 97 CO 0.00 0.00 0.00 -0.51 1.17 0.00 0.00 177.40 178.06 1xmw s ASP 98 N -1.18 3.36 -0.49 3.14 1.01 -1.26 -5.03 116.67 116.22 1xmw s ASP 98 Ca -0.05 -0.98 0.08 0.00 0.71 0.00 0.00 52.55 52.32 1xmw s ASP 98 Cb 0.00 -0.91 0.33 0.00 1.01 0.00 0.00 42.92 43.35 1xmw s ASP 98 CO 0.51 -0.26 0.82 0.47 0.21 0.00 0.00 175.17 176.92 1xmw n ASP 99 N 4.85 2.73 -4.02 0.27 9.92 -1.26 -5.07 116.55 123.97 1xmw n ASP 99 Ca -0.11 -3.34 -0.13 0.00 -0.53 0.00 0.00 54.79 50.68 1xmw n ASP 99 Cb 0.46 -0.60 -0.12 0.00 -0.64 0.00 0.00 41.12 40.22 1xmw n ASP 99 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 1xmw s ALA 100 N -2.83 0.45 0.00 2.24 0.00 -1.26 -5.00 121.76 115.35 1xmw s ALA 100 Ca 0.44 -0.58 0.00 0.00 0.00 0.00 0.00 51.96 51.81 1xmw s ALA 100 Cb 0.29 0.02 0.00 0.00 0.00 0.00 0.00 23.12 23.43 1xmw s ALA 100 CO -0.10 -0.01 0.00 0.36 0.00 0.00 0.00 175.76 176.00 1xmw n LYS 101 N 1.89 0.00 -0.07 0.00 2.85 -1.26 -4.98 118.16 116.59 1xmw n LYS 101 Ca -0.20 0.00 -0.09 0.00 -1.05 0.00 0.00 58.31 56.97 1xmw n LYS 101 Cb 0.56 0.00 -0.08 0.00 -0.65 0.00 0.00 35.03 34.86 1xmw n LYS 101 CO 0.00 0.00 0.00 1.17 -0.05 0.00 0.00 177.40 178.52 1xmw n LYS 102 N -1.07 0.95 -2.08 -1.58 4.81 -1.26 -5.09 118.16 112.84 1xmw n LYS 102 Ca 0.00 0.06 -0.04 0.00 -0.87 0.00 0.00 58.31 57.46 1xmw n LYS 102 Cb 0.00 -1.31 0.01 0.00 0.02 0.00 0.00 35.03 33.75 1xmw n LYS 102 CO 0.00 0.00 0.00 -0.40 1.17 0.00 0.00 177.40 178.17 1xmw n ASP 103 N -2.78 -0.77 -3.99 3.14 5.75 -1.26 -5.18 116.55 111.47 1xmw n ASP 103 Ca -0.25 -1.60 -0.14 0.00 -0.01 0.00 0.00 54.79 52.79 1xmw n ASP 103 Cb 0.82 1.29 -0.13 0.00 -1.03 0.00 0.00 41.12 42.08 1xmw n ASP 103 CO 0.00 0.00 0.00 -0.83 -0.11 0.00 0.00 177.20 176.26 1xmw s GLY 104 N -1.75 0.34 -0.37 6.12 0.00 -1.26 -4.81 107.32 105.58 1xmw s GLY 104 Ca 0.07 -0.42 0.04 0.00 0.00 0.00 0.00 44.72 44.40 1xmw s GLY 104 CO 0.05 -0.42 0.72 -1.35 0.00 0.00 0.00 173.10 172.09 1xmw s SER 105 N -0.69 -1.29 -0.04 1.64 1.04 -1.26 -5.02 113.70 108.09 1xmw s SER 105 Ca -0.03 -0.48 0.25 0.00 0.48 0.00 0.00 55.95 56.17 1xmw s SER 105 Cb -0.05 1.67 0.44 0.00 0.10 0.00 0.00 66.02 68.18 1xmw s SER 105 CO 0.00 -0.16 1.16 0.00 0.98 0.00 0.00 173.24 175.22 1xmw n GLN 106 N 4.48 0.24 -3.87 4.02 0.00 -1.26 -5.10 117.38 115.88 1xmw n GLN 106 Ca 0.09 -2.21 -0.09 0.00 0.00 0.00 0.00 57.00 54.80 1xmw n GLN 106 Cb 0.58 -0.22 -0.01 0.00 0.00 0.00 0.00 30.24 30.59 1xmw n GLN 106 CO 0.00 0.00 0.00 -0.08 0.00 0.00 0.00 177.06 176.98 1xmw s THR 107 N -0.52 0.00 0.70 -0.39 -1.32 -1.26 -4.69 115.64 108.17 1xmw s THR 107 Ca 0.33 -1.10 -0.11 0.00 -1.21 0.00 0.00 61.69 59.60 1xmw s THR 107 Cb 0.38 -2.47 0.01 0.00 -1.51 0.00 0.00 72.50 68.92 1xmw s THR 107 CO -0.15 0.00 1.06 0.20 -2.21 0.00 0.00 174.62 173.52 1xmw s ASN 108 N -3.03 5.30 -0.17 8.08 -0.87 -1.26 -5.07 114.94 117.92 1xmw s ASN 108 Ca 0.16 1.61 -0.11 0.00 -1.57 0.00 0.00 52.86 52.96 1xmw s ASN 108 Cb -0.05 -2.48 0.06 0.00 -0.02 0.00 0.00 41.25 38.77 1xmw s ASN 108 CO 0.10 -1.50 0.43 -1.59 -2.57 0.00 0.00 177.10 171.98 1xmw s LYS 109 N -5.04 0.43 -0.75 -0.60 -2.85 -1.26 -4.98 119.74 104.69 1xmw s LYS 109 Ca 0.58 0.77 -0.02 0.00 -1.00 0.00 0.00 55.97 56.31 1xmw s LYS 109 Cb -0.14 0.04 0.00 0.00 -2.06 0.00 0.00 37.83 35.67 1xmw s LYS 109 CO 0.55 -0.14 0.66 0.00 0.10 0.00 0.00 175.35 176.52 1xmw n ALA 110 N 3.99 -2.63 -3.05 0.59 0.00 -1.26 -5.02 120.51 113.13 1xmw n ALA 110 Ca -0.21 -0.02 -0.11 0.00 0.00 0.00 0.00 53.44 53.09 1xmw n ALA 110 Cb 0.56 -1.36 -0.11 0.00 0.00 0.00 0.00 19.45 18.54 1xmw n ALA 110 CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 177.50 177.65 1xmw s LYS 111 N -3.65 0.34 -0.57 0.00 1.02 -1.26 -5.09 119.74 110.53 1xmw s LYS 111 Ca 0.03 -0.26 -0.27 0.00 0.02 0.00 0.00 55.97 55.49 1xmw s LYS 111 Cb -0.00 0.14 -0.01 0.00 -0.52 0.00 0.00 37.83 37.44 1xmw s LYS 111 CO 0.81 -0.07 1.74 1.03 -0.92 0.00 0.00 175.35 177.94 1xmw s ARG 112 N -0.94 2.87 0.24 1.68 3.00 -1.26 -4.89 118.95 119.65 1xmw s ARG 112 Ca -0.10 0.64 -0.21 0.00 0.00 0.00 0.00 55.73 56.06 1xmw s ARG 112 Cb -0.06 -4.31 0.07 0.00 0.00 0.00 0.00 34.95 30.65 1xmw s ARG 112 CO 0.01 -2.45 0.94 0.00 0.00 0.00 0.00 175.30 173.80 1xmw s ALA 113 N 8.07 -1.35 0.16 2.13 0.00 -1.26 -4.88 121.76 124.64 1xmw s ALA 113 Ca 0.64 -0.38 0.03 0.00 0.00 0.00 0.00 51.96 52.26 1xmw s ALA 113 Cb -0.13 0.72 -0.03 0.00 0.00 0.00 0.00 23.12 23.67 1xmw s ALA 113 CO 0.23 -1.04 0.28 -1.17 0.00 0.00 0.00 175.76 174.06 1xmw s LEU 114 N -3.21 4.29 0.13 0.00 0.20 -1.26 -4.44 118.68 114.38 1xmw s LEU 114 Ca 0.18 0.13 -0.22 0.00 0.69 0.00 0.00 54.13 54.91 1xmw s LEU 114 Cb -0.03 -2.86 0.06 0.00 -0.43 0.00 0.00 46.19 42.93 1xmw s LEU 114 CO 0.07 0.04 0.55 -1.83 -0.29 0.00 0.00 176.35 174.89 1xmw s GLU 115 N -3.32 1.19 0.00 1.98 -1.05 -0.67 -4.89 118.70 111.94 1xmw s GLU 115 Ca 0.34 -0.45 0.05 0.00 -0.15 0.00 0.00 54.97 54.76 1xmw s GLU 115 Cb -0.11 0.54 -0.01 0.00 -0.44 0.00 0.00 34.13 34.11 1xmw s GLU 115 CO 0.28 -0.49 -0.15 0.54 0.95 0.00 0.00 175.26 176.39 1xmw s VAL 116 N -3.46 1.17 0.09 1.83 0.11 -1.26 0.31 120.40 119.18 1xmw s VAL 116 Ca -0.00 -0.73 0.03 0.00 -2.93 0.00 0.00 61.98 58.35 1xmw s VAL 116 Cb -0.00 -0.99 -0.03 0.00 -1.53 0.00 0.00 36.38 33.82 1xmw s VAL 116 CO -0.10 0.25 -0.09 -0.76 -3.33 0.00 0.00 175.10 171.08 1xmw s LEU 117 N -0.54 2.40 -0.35 2.54 1.43 -1.00 -4.98 118.68 118.18 1xmw s LEU 117 Ca 0.05 -0.81 -0.01 0.00 -1.03 0.00 0.00 54.13 52.33 1xmw s LEU 117 Cb -0.06 -0.21 0.08 0.00 0.03 0.00 0.00 46.19 46.03 1xmw s LEU 117 CO -0.00 -0.31 0.08 -1.61 0.23 0.00 0.00 176.35 174.75 1xmw s GLU 118 N -2.81 2.13 0.07 1.70 2.02 -1.26 -2.24 118.70 118.32 1xmw s GLU 118 Ca 0.04 -1.56 0.07 0.00 0.02 0.00 0.00 54.97 53.53 1xmw s GLU 118 Cb -0.02 -3.34 -0.03 0.00 0.10 0.00 0.00 34.13 30.84 1xmw s GLU 118 CO -0.01 -0.84 -0.18 0.00 0.02 0.00 0.00 175.26 174.25 1xmw s ALA 119 N 1.16 1.55 -1.38 5.21 0.00 0.17 -4.79 121.76 123.69 1xmw s ALA 119 Ca 0.02 -1.09 -0.02 0.00 0.00 0.00 0.00 51.96 50.87 1xmw s ALA 119 Cb -0.21 -0.22 0.01 0.00 0.00 0.00 0.00 23.12 22.71 1xmw s ALA 119 CO -0.03 0.30 0.64 -1.91 0.00 0.00 0.00 175.76 174.75 1xmw n GLU 120 N 1.40 -4.39 -1.80 0.00 2.13 -1.26 0.03 120.64 116.75 1xmw n GLU 120 Ca -0.19 0.54 -0.14 0.00 0.66 0.00 0.00 57.16 58.03 1xmw n GLU 120 Cb 0.54 -4.99 -0.04 0.00 0.27 0.00 0.00 31.44 27.22 1xmw n GLU 120 CO 0.00 0.00 0.00 -0.25 -0.41 0.00 0.00 177.13 176.47 1xmw n ASP 121 N -3.00 -3.83 -4.18 4.31 8.00 -1.26 -4.92 116.55 111.67 1xmw n ASP 121 Ca -0.26 0.27 -0.15 0.00 0.71 0.00 0.00 54.79 55.36 1xmw n ASP 121 Cb 0.66 -3.43 -0.11 0.00 -0.02 0.00 0.00 41.12 38.22 1xmw n ASP 121 CO 0.00 0.00 0.00 -0.75 -0.39 0.00 0.00 177.20 176.06 1xmw s LYS 122 N -3.89 0.85 -0.01 -1.24 2.20 0.11 -3.40 119.74 114.35 1xmw s LYS 122 Ca 0.00 -1.14 0.05 0.00 -0.36 0.00 0.00 55.97 54.53 1xmw s LYS 122 Cb 0.00 -0.57 -0.01 0.00 -1.51 0.00 0.00 37.83 35.73 1xmw s LYS 122 CO 0.00 0.09 -0.17 0.14 -0.36 0.00 0.00 175.35 175.05 1xmw s VAL 123 N -2.31 1.36 0.02 4.02 -7.23 -0.96 0.46 120.40 115.76 1xmw s VAL 123 Ca 0.05 -0.77 -0.06 0.00 -1.81 0.00 0.00 61.98 59.38 1xmw s VAL 123 Cb -0.04 -1.14 -0.00 0.00 0.56 0.00 0.00 36.38 35.76 1xmw s VAL 123 CO 0.00 0.35 0.11 -0.63 -0.31 0.00 0.00 175.10 174.63 1xmw s ILE 124 N -0.45 0.11 -0.00 -0.62 1.09 -0.95 -2.96 121.20 117.42 1xmw s ILE 124 Ca 0.06 -0.87 -0.06 0.00 -1.10 0.00 0.00 60.65 58.68 1xmw s ILE 124 Cb -0.07 -0.62 -0.05 0.00 -1.06 0.00 0.00 42.46 40.67 1xmw s ILE 124 CO -0.00 -0.48 0.24 -0.76 -0.10 0.00 0.00 174.94 173.84 1xmw s LEU 125 N -1.71 4.37 -0.08 2.97 1.43 -1.08 -2.39 118.68 122.19 1xmw s LEU 125 Ca -0.11 0.51 0.03 0.00 -1.03 0.00 0.00 54.13 53.53 1xmw s LEU 125 Cb -0.05 -2.62 0.01 0.00 0.03 0.00 0.00 46.19 43.55 1xmw s LEU 125 CO -0.01 0.26 -0.17 -0.54 0.23 0.00 0.00 176.35 176.12 1xmw s LYS 126 N -1.75 2.21 0.06 1.70 1.02 0.15 -1.95 119.74 121.19 1xmw s LYS 126 Ca 0.27 -0.61 -0.01 0.00 0.02 0.00 0.00 55.97 55.64 1xmw s LYS 126 Cb -0.13 -1.75 -0.04 0.00 -0.52 0.00 0.00 37.83 35.39 1xmw s LYS 126 CO 0.16 0.11 -0.03 0.00 -0.92 0.00 0.00 175.35 174.67 1xmw n ASN 128 N 0.07 0.00 0.00 0.00 2.85 -1.26 -4.81 115.26 112.11 1xmw n ASN 128 Ca -0.13 0.21 0.00 0.00 -0.11 0.00 0.00 54.58 54.55 1xmw n ASN 128 Cb 0.61 -0.24 0.00 0.00 1.24 0.00 0.00 39.78 41.39 1xmw n ASN 128 CO 0.00 0.00 0.00 -0.24 -2.11 0.00 0.00 177.26 174.91 1xmw n SER 129 N -1.24 0.40 -4.61 1.20 2.88 -1.26 -5.06 113.62 105.93 1xmw n SER 129 Ca 0.01 0.00 -0.49 0.00 -1.33 0.00 0.00 58.87 57.06 1xmw n SER 129 Cb 0.01 0.00 -0.05 0.00 -0.75 0.00 0.00 64.21 63.42 1xmw n SER 129 CO 0.00 0.00 0.00 -0.24 -1.23 0.00 0.00 175.04 173.57 1xmw n SER 130 N 0.00 1.94 -4.79 -3.46 2.88 -1.14 -3.34 113.62 105.71 1xmw n SER 130 Ca 0.00 1.12 -0.38 0.00 -1.33 0.00 0.00 58.87 58.29 1xmw n SER 130 Cb 0.00 -1.27 -0.06 0.00 -0.75 0.00 0.00 64.21 62.13 1xmw n SER 130 CO 0.00 0.00 0.00 -0.63 -1.23 0.00 0.00 175.04 173.18 1xmw s ILE 131 N 0.23 5.08 -0.44 2.46 1.01 -1.26 -4.43 121.20 123.85 1xmw s ILE 131 Ca 0.77 0.87 -0.26 0.00 0.00 0.00 0.00 60.65 62.03 1xmw s ILE 131 Cb -0.83 -3.75 0.02 0.00 0.01 0.00 0.00 42.46 37.92 1xmw s ILE 131 CO 0.48 0.49 0.93 -0.89 0.00 0.00 0.00 174.94 175.94 1xmw s THR 132 N -0.44 4.50 -0.58 2.92 2.01 0.30 -4.93 115.64 119.42 1xmw s THR 132 Ca 0.24 0.87 -0.27 0.00 0.31 0.00 0.00 61.69 62.84 1xmw s THR 132 Cb -0.16 -4.41 0.03 0.00 0.01 0.00 0.00 72.50 67.97 1xmw s THR 132 CO 0.12 -0.76 1.11 -0.22 -0.69 0.00 0.00 174.62 174.18 1xmw s LEU 133 N 3.69 3.66 -0.01 4.42 1.98 -1.26 -0.03 118.68 131.13 1xmw s LEU 133 Ca 0.37 -0.09 -0.19 0.00 -2.89 0.00 0.00 54.13 51.34 1xmw s LEU 133 Cb -0.11 -3.01 -0.10 0.00 0.66 0.00 0.00 46.19 43.63 1xmw s LEU 133 CO 0.24 -1.42 0.81 -0.07 -1.89 0.00 0.00 176.35 174.02 1xmw h LEU 134 N 11.66 -0.57 0.00 -0.68 3.38 -1.59 -3.48 115.31 124.03 1xmw h LEU 134 Ca -0.26 0.02 0.14 0.00 0.09 0.00 0.00 57.88 57.88 1xmw h LEU 134 Cb 1.06 0.15 -0.03 0.00 0.09 0.00 0.00 40.66 41.93 1xmw h LEU 134 CO 1.16 -0.19 0.40 0.00 0.09 0.00 0.00 178.44 179.90 1xmw n GLN 135 N -5.00 0.13 0.00 1.13 10.64 -1.23 -4.98 117.38 118.08 1xmw n GLN 135 Ca -0.08 -0.44 0.00 0.00 -1.83 0.00 0.00 57.00 54.65 1xmw n GLN 135 Cb 0.26 0.68 0.00 0.00 -0.86 0.00 0.00 30.24 30.32 1xmw n GLN 135 CO 0.00 0.00 0.00 0.41 -1.83 0.00 0.00 177.06 175.64 1xmw n GLY 136 N -0.41 1.36 3.54 2.61 0.00 -1.26 -2.57 105.19 108.46 1xmw n GLY 136 Ca 0.01 -0.65 -0.28 0.00 0.00 0.00 0.00 46.02 45.11 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 -0.04 -2.85 2.61 5.66 0.31 -4.81 114.28 115.16 1xmw n THR 137 Ca 0.00 -0.56 -0.39 0.00 -3.05 0.00 0.00 64.05 60.05 1xmw n THR 137 Cb 0.00 -1.92 0.00 0.00 -1.55 0.00 0.00 70.33 66.86 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 14.99 5.48 -1.00 1.79 0.00 -1.26 -4.83 120.51 135.68 1xmw n ALA 138 Ca 0.48 -4.70 0.00 0.00 0.00 0.00 0.00 53.44 49.22 1xmw n ALA 138 Cb 0.39 -1.96 0.00 0.00 0.00 0.00 0.00 19.45 17.88 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 0.41 -1.90 3.19 0.00 0.00 -1.26 -5.00 105.19 100.62 1xmw n GLY 139 Ca 0.37 -0.20 -0.13 0.00 0.00 0.00 0.00 46.02 46.07 1xmw n GLY 139 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1xmw s GLN 140 N 0.00 0.55 0.66 1.61 -0.21 -1.01 -4.86 119.66 116.41 1xmw s GLN 140 Ca 0.00 -0.12 -0.13 0.00 0.02 0.00 0.00 55.36 55.13 1xmw s GLN 140 Cb 0.00 0.24 -0.00 0.00 1.00 0.00 0.00 33.01 34.25 1xmw s GLN 140 CO 0.00 -0.14 1.07 -1.21 -2.12 0.00 0.00 175.29 172.90 1xmw s GLU 141 N -1.02 2.96 0.00 2.91 2.02 -1.26 0.10 118.70 124.41 1xmw s GLU 141 Ca -0.11 1.15 0.00 0.00 0.02 0.00 0.00 54.97 56.03 1xmw s GLU 141 Cb -0.05 -1.99 0.00 0.00 0.10 0.00 0.00 34.13 32.19 1xmw s GLU 141 CO 0.03 -1.09 0.00 1.55 0.02 0.00 0.00 175.26 175.76 1xmw n VAL 142 N -2.66 0.00 -0.33 2.63 3.14 0.63 -4.75 118.33 116.99 1xmw n VAL 142 Ca 0.09 0.00 0.10 0.00 -2.96 0.00 0.00 64.34 61.57 1xmw n VAL 142 Cb 0.53 0.00 0.28 0.00 -1.06 0.00 0.00 33.84 33.58 1xmw n VAL 142 CO 0.00 0.00 0.00 0.77 -6.46 0.00 0.00 176.83 171.14 1xmw h SER 143 N 0.00 0.70 -0.58 6.55 4.64 -1.97 -3.39 113.55 119.50 1xmw h SER 143 Ca 0.00 0.09 0.00 0.00 -0.47 0.00 0.00 61.79 61.41 1xmw h SER 143 Cb 0.00 -0.03 -0.17 0.00 -0.31 0.00 0.00 62.40 61.89 1xmw h SER 143 CO 0.00 0.27 -0.28 -0.62 -0.87 0.00 0.00 176.83 175.33 1xmw s ASP 144 N -5.44 -0.87 -0.14 4.97 2.15 -1.26 -5.07 116.67 111.00 1xmw s ASP 144 Ca -0.12 -0.65 -0.04 0.00 0.43 0.00 0.00 52.55 52.17 1xmw s ASP 144 Cb 0.23 1.12 0.02 0.00 -0.30 0.00 0.00 42.92 44.00 1xmw s ASP 144 CO 0.79 -0.07 0.09 0.59 -0.17 0.00 0.00 175.17 176.40 1xmw n ASN 145 N 3.57 -5.08 0.00 -0.34 3.02 -1.26 -4.78 115.26 110.40 1xmw n ASN 145 Ca 0.10 1.12 0.00 0.00 -0.03 0.00 0.00 54.58 55.78 1xmw n ASN 145 Cb 0.60 -3.81 0.00 0.00 -0.61 0.00 0.00 39.78 35.96 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 1.57 0.00 -3.77 3.52 5.02 -1.21 -2.87 118.16 120.41 1xmw n LYS 146 Ca -0.15 0.00 -0.13 0.00 -2.02 0.00 0.00 58.31 56.01 1xmw n LYS 146 Cb 0.32 0.00 -0.14 0.00 -0.02 0.00 0.00 35.03 35.19 1xmw n LYS 146 CO 0.00 0.00 0.00 0.99 -0.52 0.00 0.00 177.40 177.87 1xmw s THR 147 N 0.00 -0.03 0.14 -0.18 2.01 -1.26 -3.00 115.64 113.32 1xmw s THR 147 Ca 0.00 0.11 -0.08 0.00 0.31 0.00 0.00 61.69 62.03 1xmw s THR 147 Cb 0.00 -0.24 -0.06 0.00 0.01 0.00 0.00 72.50 72.21 1xmw s THR 147 CO 0.00 0.05 0.43 -0.22 -0.69 0.00 0.00 174.62 174.18 1xmw s LEU 148 N 0.79 4.28 -0.41 4.42 1.98 -0.82 0.23 118.68 129.15 1xmw s LEU 148 Ca -0.06 0.75 0.03 0.00 -2.89 0.00 0.00 54.13 51.96 1xmw s LEU 148 Cb -0.08 -3.26 0.11 0.00 0.66 0.00 0.00 46.19 43.63 1xmw s LEU 148 CO -0.04 0.07 0.15 0.21 -1.89 0.00 0.00 176.35 174.86 1xmw s ASN 149 N -2.15 4.36 0.23 3.68 2.47 0.29 -2.64 114.94 121.18 1xmw s ASN 149 Ca 0.39 -2.43 0.12 0.00 0.42 0.00 0.00 52.86 51.36 1xmw s ASN 149 Cb -0.13 -1.44 0.06 0.00 -1.45 0.00 0.00 41.25 38.29 1xmw s ASN 149 CO 0.21 -0.32 1.43 -0.07 -3.72 0.00 0.00 177.10 174.63 1xmw h LEU 150 N 7.19 0.00 0.00 3.21 3.38 -1.83 -2.68 115.31 124.58 1xmw h LEU 150 Ca -0.06 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.91 1xmw h LEU 150 Cb 0.96 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.71 1xmw h LEU 150 CO 0.56 0.67 0.00 0.61 0.09 0.00 0.00 178.44 180.37 1xmw n GLY 151 N 1.09 0.23 3.91 0.83 0.00 -1.26 -4.86 105.19 105.12 1xmw n GLY 151 Ca 0.01 -1.55 -0.28 0.00 0.00 0.00 0.00 46.02 44.20 1xmw n GLY 151 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1xmw s LYS 152 N 0.00 2.68 0.08 1.61 2.20 -1.26 -2.26 119.74 122.79 1xmw s LYS 152 Ca 0.00 0.12 0.23 0.00 -0.36 0.00 0.00 55.97 55.96 1xmw s LYS 152 Cb 0.00 -2.14 0.08 0.00 -1.51 0.00 0.00 37.83 34.26 1xmw s LYS 152 CO 0.00 -0.99 1.05 2.89 -0.36 0.00 0.00 175.35 177.95 1xmw n ARG 153 N -2.85 0.35 0.00 4.03 1.85 -1.22 -3.87 116.66 114.96 1xmw n ARG 153 Ca 0.06 0.02 0.13 0.00 -1.00 0.00 0.00 57.85 57.06 1xmw n ARG 153 Cb 0.58 -1.64 0.67 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 -2.11 0.14 1.64 8.89 -0.00 -1.26 -3.13 119.36 123.54 1xmw n ILE 154 Ca 0.02 0.04 0.03 0.00 -0.00 0.00 0.00 62.75 62.83 1xmw n ILE 154 Cb 0.46 -0.62 0.11 0.00 -0.00 0.00 0.00 39.64 39.59 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 -1.22 1.27 -3.63 0.38 4.07 -1.25 -4.90 120.64 115.35 1xmw n GLU 155 Ca 0.14 -0.42 -0.26 0.00 -0.06 0.00 0.00 57.16 56.56 1xmw n GLU 155 Cb 0.18 -1.12 0.04 0.00 -0.06 0.00 0.00 31.44 30.48 1xmw n GLU 155 CO 0.00 0.00 0.00 -0.25 -0.06 0.00 0.00 177.13 176.82 1xmw n ASP 156 N -0.18 -4.21 -4.75 4.31 8.00 -1.18 -4.91 116.55 113.63 1xmw n ASP 156 Ca 0.05 -0.92 -0.41 0.00 0.71 0.00 0.00 54.79 54.22 1xmw n ASP 156 Cb 0.11 -3.82 -0.04 0.00 -0.02 0.00 0.00 41.12 37.36 1xmw n ASP 156 CO 0.00 0.00 0.00 -2.16 -0.39 0.00 0.00 177.20 174.65 1xmw s PRO 157 N -5.76 4.52 -0.10 -0.24 0.04 -1.26 -4.66 135.00 127.55 1xmw s PRO 157 Ca 0.33 1.88 -0.05 0.00 0.04 0.00 0.00 61.00 63.20 1xmw s PRO 157 Cb -0.10 -3.22 0.05 0.00 0.04 0.00 0.00 34.50 31.27 1xmw s PRO 157 CO 0.83 -0.01 0.22 -0.98 0.04 0.00 0.00 177.00 177.10 1xmw s ARG 158 N -0.67 0.16 0.00 4.56 1.70 -1.26 -2.00 118.95 121.45 1xmw s ARG 158 Ca 0.50 0.54 0.00 0.00 -0.47 0.00 0.00 55.73 56.30 1xmw s ARG 158 Cb -0.33 -0.13 0.00 0.00 -0.57 0.00 0.00 34.95 33.92 1xmw s ARG 158 CO 0.39 -0.19 0.00 0.41 -1.08 0.00 0.00 175.30 174.83 1xmw n GLY 159 N 4.48 0.10 3.31 3.88 0.00 -0.18 0.11 105.19 116.89 1xmw n GLY 159 Ca -0.21 -1.07 -0.20 0.00 0.00 0.00 0.00 46.02 44.54 1xmw n GLY 159 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 1xmw s MET 160 N -2.00 1.21 -0.08 1.61 -1.94 -1.06 0.12 119.30 117.16 1xmw s MET 160 Ca 0.00 -1.39 -0.03 0.00 -1.71 0.00 0.00 55.69 52.56 1xmw s MET 160 Cb 0.00 -1.18 0.05 0.00 2.01 0.00 0.00 34.83 35.71 1xmw s MET 160 CO 0.00 0.23 0.16 0.71 -0.01 0.00 0.00 175.02 176.11 1xmw s TYR 161 N -2.22 -0.18 0.20 -0.03 2.02 0.48 -1.37 117.35 116.24 1xmw s TYR 161 Ca 0.15 0.62 -0.05 0.00 -0.37 0.00 0.00 57.07 57.41 1xmw s TYR 161 Cb -0.05 -0.25 -0.06 0.00 -0.40 0.00 0.00 41.96 41.20 1xmw s TYR 161 CO 0.06 -0.27 0.45 -1.14 -1.57 0.00 0.00 175.55 173.07 1xmw s GLN 162 N 2.27 3.65 0.31 -0.62 0.74 0.96 -2.54 119.66 124.43 1xmw s GLN 162 Ca 0.03 -0.02 0.10 0.00 0.05 0.00 0.00 55.36 55.52 1xmw s GLN 162 Cb -0.12 -2.76 -0.05 0.00 1.10 0.00 0.00 33.01 31.17 1xmw s GLN 162 CO -0.06 0.38 -0.09 0.00 -0.55 0.00 0.00 175.29 174.97 1xmw s GLY 164 N -3.61 2.30 0.27 0.00 0.00 -1.26 -3.88 107.32 101.14 1xmw s GLY 164 Ca 0.32 -0.09 0.02 0.00 0.00 0.00 0.00 44.72 44.97 1xmw s GLY 164 CO 0.17 1.22 0.06 1.18 0.00 0.00 0.00 173.10 175.74 1xmw n GLU 165 N 4.43 0.87 0.00 2.90 4.71 -1.26 -4.72 120.64 127.56 1xmw n GLU 165 Ca -0.02 -2.14 0.00 0.00 -0.01 0.00 0.00 57.16 54.99 1xmw n GLU 165 Cb 0.50 0.99 0.00 0.00 -1.01 0.00 0.00 31.44 31.93 1xmw n GLU 165 CO 0.00 0.00 0.00 0.09 0.09 0.00 0.00 177.13 177.31 1xmw n ASN 166 N -1.58 0.00 -0.80 1.62 3.02 -1.26 -4.68 115.26 111.58 1xmw n ASN 166 Ca -0.06 0.02 0.07 0.00 -0.03 0.00 0.00 54.58 54.58 1xmw n ASN 166 Cb 0.38 0.00 0.19 0.00 -0.61 0.00 0.00 39.78 39.74 1xmw n ASN 166 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1xmw n ALA 167 N -2.08 2.28 -3.51 5.41 0.00 -1.26 -4.84 120.51 116.51 1xmw n ALA 167 Ca 0.00 -1.24 -0.28 0.00 0.00 0.00 0.00 53.44 51.92 1xmw n ALA 167 Cb 0.00 -0.55 -0.14 0.00 0.00 0.00 0.00 19.45 18.76 1xmw n ALA 167 CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 177.50 177.65 1xmw s LYS 168 N -1.12 0.28 0.18 0.00 -0.14 -1.26 -5.12 119.74 112.56 1xmw s LYS 168 Ca 0.29 -0.69 -0.30 0.00 -1.36 0.00 0.00 55.97 53.91 1xmw s LYS 168 Cb 0.16 -1.15 -0.08 0.00 -1.68 0.00 0.00 37.83 35.08 1xmw s LYS 168 CO 0.19 -1.06 1.26 0.45 -0.76 0.00 0.00 175.35 175.42 1xmw s SER 169 N 1.88 6.99 -0.07 2.83 0.15 -1.26 -4.53 113.70 119.69 1xmw s SER 169 Ca 0.11 2.29 -0.02 0.00 0.70 0.00 0.00 55.95 59.04 1xmw s SER 169 Cb -0.17 -2.60 -0.03 0.00 -1.71 0.00 0.00 66.02 61.50 1xmw s SER 169 CO -0.28 -0.46 0.02 0.12 1.20 0.00 0.00 173.24 173.84 1xmw s PHE 170 N 0.16 3.18 -0.02 3.44 2.19 -1.25 -4.68 117.98 121.01 1xmw s PHE 170 Ca 0.56 0.20 0.01 0.00 0.33 0.00 0.00 56.93 58.02 1xmw s PHE 170 Cb -0.34 -1.78 0.01 0.00 -1.31 0.00 0.00 43.02 39.60 1xmw s PHE 170 CO 0.36 0.49 -0.03 0.99 1.83 0.00 0.00 175.22 178.87 1xmw s THR 171 N -0.94 0.30 -0.01 0.12 2.01 -1.05 -1.08 115.64 114.99 1xmw s THR 171 Ca 0.15 -0.08 0.05 0.00 0.31 0.00 0.00 61.69 62.12 1xmw s THR 171 Cb -0.11 -0.31 -0.01 0.00 0.01 0.00 0.00 72.50 72.07 1xmw s THR 171 CO 0.04 0.13 -0.15 -0.22 -0.69 0.00 0.00 174.62 173.73 1xmw s LEU 172 N 0.43 2.03 0.14 4.42 0.20 -1.05 -2.34 118.68 122.51 1xmw s LEU 172 Ca -0.04 -0.28 0.09 0.00 0.69 0.00 0.00 54.13 54.59 1xmw s LEU 172 Cb -0.08 -0.79 -0.04 0.00 -0.43 0.00 0.00 46.19 44.85 1xmw s LEU 172 CO -0.01 0.19 -0.18 -1.58 -0.29 0.00 0.00 176.35 174.48 1xmw s GLN 173 N -0.36 1.77 0.02 1.98 0.74 0.39 -0.39 119.66 123.81 1xmw s GLN 173 Ca 0.06 -1.27 0.05 0.00 0.05 0.00 0.00 55.36 54.25 1xmw s GLN 173 Cb -0.06 -2.06 -0.02 0.00 1.10 0.00 0.00 33.01 31.97 1xmw s GLN 173 CO -0.01 0.46 -0.16 0.54 -0.55 0.00 0.00 175.29 175.57 1xmw s VAL 174 N -1.34 1.23 -0.33 1.34 0.11 0.32 -0.91 120.40 120.82 1xmw s VAL 174 Ca 0.20 -0.91 0.01 0.00 -2.93 0.00 0.00 61.98 58.35 1xmw s VAL 174 Cb -0.10 -1.08 0.14 0.00 -1.53 0.00 0.00 36.38 33.82 1xmw s VAL 174 CO 0.11 0.16 0.31 -0.47 -3.33 0.00 0.00 175.10 171.88 1xmw s TYR 175 N -0.66 -0.23 -0.07 1.54 6.14 -0.24 -1.01 117.35 122.82 1xmw s TYR 175 Ca 0.04 -0.65 -0.16 0.00 0.64 0.00 0.00 57.07 56.94 1xmw s TYR 175 Cb -0.07 -0.51 -0.05 0.00 0.42 0.00 0.00 41.96 41.75 1xmw s TYR 175 CO 0.01 -0.93 0.43 0.71 0.64 0.00 0.00 175.55 176.41 1xmw s TYR 176 N 1.81 3.60 -0.36 4.97 2.02 -0.84 -2.42 117.35 126.13 1xmw s TYR 176 Ca 0.14 0.91 0.01 0.00 -0.37 0.00 0.00 57.07 57.76 1xmw s TYR 176 Cb -0.16 -2.43 0.14 0.00 -0.40 0.00 0.00 41.96 39.12 1xmw s TYR 176 CO -0.17 0.38 0.23 0.50 -1.57 0.00 0.00 175.55 174.92 1xmw s ARG 177 N -0.12 0.60 0.00 -0.62 3.52 0.36 -4.57 118.95 118.12 1xmw s ARG 177 Ca 0.24 -1.45 0.00 0.00 -0.13 0.00 0.00 55.73 54.39 1xmw s ARG 177 Cb -0.16 -1.31 0.00 0.00 -1.56 0.00 0.00 34.95 31.92 1xmw s ARG 177 CO 0.11 -1.24 0.03 -1.33 -0.81 0.00 0.00 175.30 172.06