#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1xmw s ASP 2 N 0.00 -0.53 0.00 1.67 1.01 -1.26 -5.06 116.67 112.50 1xmw s ASP 2 Ca 0.00 1.02 0.00 0.00 0.71 0.00 0.00 52.55 54.28 1xmw s ASP 2 Cb 0.00 1.03 0.00 0.00 1.01 0.00 0.00 42.92 44.96 1xmw s ASP 2 CO 0.00 -0.18 0.00 0.00 0.21 0.00 0.00 175.17 175.20 1xmw n ALA 3 N 2.81 2.96 -2.63 5.23 0.00 -1.26 -5.05 120.51 122.58 1xmw n ALA 3 Ca -0.13 0.00 -0.41 0.00 0.00 0.00 0.00 53.44 52.89 1xmw n ALA 3 Cb 0.56 0.02 -0.05 0.00 0.00 0.00 0.00 19.45 19.98 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 -1.96 4.10 -0.04 0.00 0.41 -1.26 -4.88 118.70 115.06 1xmw s GLU 4 Ca 0.00 0.66 0.06 0.00 -0.41 0.00 0.00 54.97 55.28 1xmw s GLU 4 Cb 0.00 -3.66 0.09 0.00 -1.78 0.00 0.00 34.13 28.78 1xmw s GLU 4 CO 0.00 -0.49 0.97 0.27 -0.49 0.00 0.00 175.26 175.51 1xmw n ASN 5 N 5.88 1.00 -1.51 -0.19 6.94 -1.26 -4.77 115.26 121.35 1xmw n ASN 5 Ca 0.02 -2.19 -0.01 0.00 -0.02 0.00 0.00 54.58 52.39 1xmw n ASN 5 Cb 0.48 -0.22 0.23 0.00 -2.36 0.00 0.00 39.78 37.92 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 -0.52 1.97 -4.34 1.53 -5.35 -1.26 -4.69 119.36 106.70 1xmw n ILE 6 Ca 0.05 -1.00 -0.29 0.00 -0.27 0.00 0.00 62.75 61.24 1xmw n ILE 6 Cb 0.59 -0.43 -0.12 0.00 -1.74 0.00 0.00 39.64 37.94 1xmw n ILE 6 CO 0.00 0.00 0.00 -1.83 -1.76 0.00 0.00 176.55 172.96 1xmw s GLU 7 N -2.15 1.66 0.29 6.28 -1.05 -1.26 -4.91 118.70 117.55 1xmw s GLU 7 Ca 0.36 -1.26 -0.29 0.00 -0.15 0.00 0.00 54.97 53.63 1xmw s GLU 7 Cb 0.28 -2.03 -0.10 0.00 -0.44 0.00 0.00 34.13 31.84 1xmw s GLU 7 CO 0.10 0.46 1.30 0.71 0.95 0.00 0.00 175.26 178.78 1xmw s TYR 8 N -1.18 3.15 0.21 4.83 1.51 -1.26 -4.51 117.35 120.11 1xmw s TYR 8 Ca 0.17 1.36 0.05 0.00 -1.01 0.00 0.00 57.07 57.64 1xmw s TYR 8 Cb -0.10 -3.63 -0.03 0.00 -0.11 0.00 0.00 41.96 38.08 1xmw s TYR 8 CO 0.09 -1.81 0.30 0.15 -1.11 0.00 0.00 175.55 173.17 1xmw s LYS 9 N -1.21 3.33 -0.02 -0.62 1.02 -1.07 -4.92 119.74 116.25 1xmw s LYS 9 Ca 0.51 -0.77 -0.02 0.00 0.02 0.00 0.00 55.97 55.71 1xmw s LYS 9 Cb -0.38 -2.85 0.01 0.00 -0.52 0.00 0.00 37.83 34.09 1xmw s LYS 9 CO 0.47 0.45 0.07 0.08 -0.92 0.00 0.00 175.35 175.50 1xmw s VAL 10 N -1.93 0.01 -0.38 3.17 1.01 -1.26 -1.44 120.40 119.58 1xmw s VAL 10 Ca 0.34 -0.08 0.04 0.00 0.00 0.00 0.00 61.98 62.28 1xmw s VAL 10 Cb -0.09 -0.13 0.16 0.00 0.00 0.00 0.00 36.38 36.32 1xmw s VAL 10 CO 0.28 -0.04 0.40 -0.44 0.00 0.00 0.00 175.10 175.30 1xmw s SER 11 N -0.10 0.92 -0.03 3.32 0.01 -0.43 -4.99 113.70 112.40 1xmw s SER 11 Ca -0.01 -1.54 -0.16 0.00 1.31 0.00 0.00 55.95 55.54 1xmw s SER 11 Cb -0.01 0.68 -0.05 0.00 0.21 0.00 0.00 66.02 66.84 1xmw s SER 11 CO 0.00 -0.25 0.43 -0.63 0.41 0.00 0.00 173.24 173.21 1xmw s ILE 12 N 1.43 5.06 -0.26 1.44 1.01 -1.26 -2.40 121.20 126.22 1xmw s ILE 12 Ca 0.17 0.89 0.02 0.00 0.00 0.00 0.00 60.65 61.72 1xmw s ILE 12 Cb -0.14 -3.75 0.07 0.00 0.01 0.00 0.00 42.46 38.65 1xmw s ILE 12 CO -0.03 0.50 -0.03 -0.44 0.00 0.00 0.00 174.94 174.94 1xmw s SER 13 N -0.56 4.15 1.57 3.58 0.01 -0.77 -4.92 113.70 116.77 1xmw s SER 13 Ca 0.24 -1.43 0.00 0.00 1.31 0.00 0.00 55.95 56.07 1xmw s SER 13 Cb -0.16 -1.30 0.00 0.00 0.21 0.00 0.00 66.02 64.76 1xmw s SER 13 CO 0.13 -0.27 0.00 0.61 0.41 0.00 0.00 173.24 174.12 1xmw n GLY 14 N 4.57 2.07 1.75 3.44 0.00 -1.26 -1.81 105.19 113.94 1xmw n GLY 14 Ca -0.09 0.05 -0.19 0.00 0.00 0.00 0.00 46.02 45.80 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 2.80 -4.38 2.61 -1.04 -1.26 -4.83 114.28 108.18 1xmw n THR 15 Ca 0.00 -3.33 -0.27 0.00 -2.04 0.00 0.00 64.05 58.41 1xmw n THR 15 Cb 0.00 -0.81 -0.11 0.00 -1.82 0.00 0.00 70.33 67.59 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 -2.76 3.65 -0.16 8.00 0.15 -0.75 -0.04 113.70 121.79 1xmw s SER 16 Ca 0.52 -0.75 -0.04 0.00 0.70 0.00 0.00 55.95 56.37 1xmw s SER 16 Cb 0.43 -0.38 0.06 0.00 -1.71 0.00 0.00 66.02 64.42 1xmw s SER 16 CO 0.01 0.13 0.11 -0.69 1.20 0.00 0.00 173.24 174.00 1xmw s VAL 17 N -1.52 -0.13 -0.35 4.45 1.01 -0.85 -1.85 120.40 121.16 1xmw s VAL 17 Ca 0.20 -0.07 -0.08 0.00 0.00 0.00 0.00 61.98 62.03 1xmw s VAL 17 Cb -0.09 -0.53 0.04 0.00 0.00 0.00 0.00 36.38 35.80 1xmw s VAL 17 CO 0.10 -0.21 0.14 -0.70 0.00 0.00 0.00 175.10 174.44 1xmw s GLU 18 N 2.17 2.67 -0.19 2.72 2.12 -1.01 0.16 118.70 127.35 1xmw s GLU 18 Ca 0.03 -1.16 -0.07 0.00 0.36 0.00 0.00 54.97 54.12 1xmw s GLU 18 Cb -0.15 -3.55 -0.04 0.00 0.26 0.00 0.00 34.13 30.65 1xmw s GLU 18 CO -0.09 -0.69 0.06 -0.51 -0.54 0.00 0.00 175.26 173.50 1xmw s LEU 19 N 1.44 3.77 -0.39 2.70 1.43 -0.62 -1.31 118.68 125.71 1xmw s LEU 19 Ca -0.00 0.05 -0.22 0.00 -1.03 0.00 0.00 54.13 52.93 1xmw s LEU 19 Cb -0.20 -1.96 0.01 0.00 0.03 0.00 0.00 46.19 44.08 1xmw s LEU 19 CO 0.04 0.15 0.71 -0.89 0.23 0.00 0.00 176.35 176.60 1xmw s THR 20 N 0.48 4.78 0.32 5.49 2.01 -0.52 0.82 115.64 129.03 1xmw s THR 20 Ca 0.03 0.58 -0.26 0.00 0.31 0.00 0.00 61.69 62.35 1xmw s THR 20 Cb -0.13 -4.19 -0.14 0.00 0.01 0.00 0.00 72.50 68.06 1xmw s THR 20 CO 0.01 -0.47 0.81 0.00 -0.69 0.00 0.00 174.62 174.28 1xmw n PRO 22 N 0.67 0.39 -3.33 0.00 -0.04 -1.26 -4.72 135.00 126.70 1xmw n PRO 22 Ca 0.11 0.00 -0.07 0.00 -0.04 0.00 0.00 63.50 63.51 1xmw n PRO 22 Cb 0.33 -1.31 0.02 0.00 -0.04 0.00 0.00 33.50 32.51 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 1.67 0.00 -4.77 1.53 -0.00 -1.26 -4.75 117.00 109.42 1xmw n LEU 23 Ca 0.00 -2.02 -0.31 0.00 -0.00 0.00 0.00 56.01 53.68 1xmw n LEU 23 Cb 0.19 3.08 0.09 0.00 -0.00 0.00 0.00 43.42 46.78 1xmw n LEU 23 CO 0.00 -0.67 0.70 -1.81 -0.00 0.00 0.00 177.39 175.60 1xmw s ASP 24 N -2.77 4.47 0.16 1.45 1.01 -1.26 -4.95 116.67 114.78 1xmw s ASP 24 Ca 0.14 1.75 -0.31 0.00 0.71 0.00 0.00 52.55 54.84 1xmw s ASP 24 Cb -0.04 -2.47 -0.09 0.00 1.01 0.00 0.00 42.92 41.34 1xmw s ASP 24 CO 0.09 -2.05 1.45 -0.94 0.21 0.00 0.00 175.17 173.94 1xmw s SER 25 N -3.45 6.73 -0.17 0.27 1.04 -1.26 -4.85 113.70 112.01 1xmw s SER 25 Ca 0.61 2.48 -0.01 0.00 0.48 0.00 0.00 55.95 59.51 1xmw s SER 25 Cb -0.17 -2.60 -0.00 0.00 0.10 0.00 0.00 66.02 63.35 1xmw s SER 25 CO 0.56 -0.71 -0.13 -0.62 0.98 0.00 0.00 173.24 173.32 1xmw s ASP 26 N 0.96 3.81 0.60 7.02 2.15 -1.26 -4.95 116.67 125.00 1xmw s ASP 26 Ca 0.65 -0.44 0.28 0.00 0.43 0.00 0.00 52.55 53.47 1xmw s ASP 26 Cb -0.40 -1.60 1.27 0.00 -0.30 0.00 0.00 42.92 41.89 1xmw s ASP 26 CO 0.33 0.07 1.66 -0.08 -0.17 0.00 0.00 175.17 176.98 1xmw h GLU 27 N 7.40 0.00 0.00 4.34 4.81 -1.95 1.18 114.58 130.37 1xmw h GLU 27 Ca -0.34 0.00 -0.02 0.00 -0.13 0.00 0.00 59.36 58.87 1xmw h GLU 27 Cb 1.18 0.00 -0.03 0.00 0.63 0.00 0.00 28.75 30.53 1xmw h GLU 27 CO 0.58 0.00 -0.49 0.09 -0.73 0.00 0.00 179.01 178.46 1xmw n ASN 28 N -3.50 1.70 -4.63 1.04 3.02 -1.26 -4.85 115.26 106.77 1xmw n ASN 28 Ca 0.14 -3.63 -0.43 0.00 -0.03 0.00 0.00 54.58 50.64 1xmw n ASN 28 Cb 1.01 -0.49 -0.03 0.00 -0.61 0.00 0.00 39.78 39.65 1xmw n ASN 28 CO 0.00 0.00 0.00 -0.11 -2.62 0.00 0.00 177.26 174.53 1xmw n LEU 29 N -1.00 3.71 -4.82 3.41 7.94 0.41 -4.72 117.00 121.93 1xmw n LEU 29 Ca 0.17 0.57 -0.38 0.00 -1.11 0.00 0.00 56.01 55.26 1xmw n LEU 29 Cb 0.72 -1.53 -0.06 0.00 0.53 0.00 0.00 43.42 43.08 1xmw n LEU 29 CO -0.03 -0.23 0.25 -0.54 -1.11 0.00 0.00 177.39 175.73 1xmw s LYS 30 N 5.37 4.15 0.32 1.96 1.02 0.50 -4.23 119.74 128.83 1xmw s LYS 30 Ca 0.95 0.69 0.09 0.00 0.02 0.00 0.00 55.97 57.72 1xmw s LYS 30 Cb -0.40 -3.20 -0.05 0.00 -0.52 0.00 0.00 37.83 33.66 1xmw s LYS 30 CO 0.39 0.63 -0.02 -1.58 -0.92 0.00 0.00 175.35 173.85 1xmw s TRP 31 N -1.15 2.54 -0.07 3.18 0.52 -1.26 -0.24 118.94 122.45 1xmw s TRP 31 Ca 0.30 -0.39 -0.16 0.00 0.02 0.00 0.00 56.10 55.86 1xmw s TRP 31 Cb -0.19 -1.39 0.03 0.00 -1.15 0.00 0.00 33.47 30.78 1xmw s TRP 31 CO 0.19 0.53 0.39 -2.00 0.02 0.00 0.00 176.95 176.07 1xmw s GLU 32 N -3.69 0.63 -0.02 4.98 2.12 0.32 -2.51 118.70 120.53 1xmw s GLU 32 Ca 0.34 0.16 0.01 0.00 0.36 0.00 0.00 54.97 55.83 1xmw s GLU 32 Cb -0.02 0.29 0.02 0.00 0.26 0.00 0.00 34.13 34.68 1xmw s GLU 32 CO 0.19 -0.15 -0.02 -1.59 -0.54 0.00 0.00 175.26 173.15 1xmw s LYS 33 N -0.69 0.35 -1.24 4.30 -2.85 0.24 -1.04 119.74 118.82 1xmw s LYS 33 Ca -0.08 -0.02 -0.05 0.00 -1.00 0.00 0.00 55.97 54.82 1xmw s LYS 33 Cb -0.04 -0.44 0.03 0.00 -2.06 0.00 0.00 37.83 35.32 1xmw s LYS 33 CO 0.03 -0.05 0.31 -1.71 0.10 0.00 0.00 175.35 174.03 1xmw n ASN 34 N 3.70 -4.16 -0.61 0.03 2.85 0.13 0.03 115.26 117.23 1xmw n ASN 34 Ca -0.22 -0.14 -0.05 0.00 -0.11 0.00 0.00 54.58 54.06 1xmw n ASN 34 Cb 0.53 -3.46 -0.00 0.00 1.24 0.00 0.00 39.78 38.09 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 -1.08 0.15 2.87 8.20 0.00 -1.26 -4.99 105.19 109.09 1xmw n GLY 35 Ca -0.08 -0.66 -0.27 0.00 0.00 0.00 0.00 46.02 45.01 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 -4.25 1.33 0.23 1.61 0.74 0.10 -5.12 119.66 114.31 1xmw s GLN 36 Ca 0.00 -0.28 -0.30 0.00 0.05 0.00 0.00 55.36 54.84 1xmw s GLN 36 Cb 0.00 -1.63 -0.09 0.00 1.10 0.00 0.00 33.01 32.39 1xmw s GLN 36 CO 0.00 -0.33 1.10 -1.21 -0.55 0.00 0.00 175.29 174.30 1xmw s GLU 37 N 1.73 4.62 -0.43 1.67 2.02 -1.26 -0.59 118.70 126.47 1xmw s GLU 37 Ca 0.04 1.76 0.03 0.00 0.02 0.00 0.00 54.97 56.81 1xmw s GLU 37 Cb -0.13 -3.23 0.12 0.00 0.10 0.00 0.00 34.13 30.99 1xmw s GLU 37 CO -0.08 0.16 0.19 -0.48 0.02 0.00 0.00 175.26 175.08 1xmw s LEU 38 N -0.95 3.52 -0.80 1.80 2.34 -1.05 -4.95 118.68 118.60 1xmw s LEU 38 Ca 0.47 -2.55 -0.25 0.00 0.06 0.00 0.00 54.13 51.86 1xmw s LEU 38 Cb -0.31 -1.32 -0.02 0.00 -0.56 0.00 0.00 46.19 43.99 1xmw s LEU 38 CO 0.38 -0.29 1.77 -2.16 -1.06 0.00 0.00 176.35 174.99 1xmw s PRO 39 N 0.40 2.80 0.31 1.48 0.04 -1.26 -4.16 135.00 134.60 1xmw s PRO 39 Ca 0.15 -0.10 0.00 0.00 0.04 0.00 0.00 61.00 61.09 1xmw s PRO 39 Cb -0.23 -4.78 0.00 0.00 0.04 0.00 0.00 34.50 29.53 1xmw s PRO 39 CO -0.04 -2.86 0.00 0.94 0.04 0.00 0.00 177.00 175.08 1xmw n GLN 40 N 9.03 0.00 -3.19 4.56 7.27 -1.26 -5.06 117.38 128.73 1xmw n GLN 40 Ca 0.28 0.00 -0.45 0.00 0.07 0.00 0.00 57.00 56.90 1xmw n GLN 40 Cb 0.49 0.00 -0.04 0.00 2.41 0.00 0.00 30.24 33.10 1xmw n GLN 40 CO 0.00 0.00 0.00 0.21 0.07 0.00 0.00 177.06 177.34 1xmw s LYS 41 N -2.00 3.17 -0.25 3.69 2.20 -1.26 -4.88 119.74 120.41 1xmw s LYS 41 Ca 0.00 -1.66 0.08 0.00 -0.36 0.00 0.00 55.97 54.03 1xmw s LYS 41 Cb 0.00 -4.35 0.61 0.00 -1.51 0.00 0.00 37.83 32.58 1xmw s LYS 41 CO 0.00 -1.46 1.58 0.72 -0.36 0.00 0.00 175.35 175.83 1xmw n HIS 42 N 5.64 1.94 -3.08 4.03 8.25 -1.26 -4.63 115.22 126.11 1xmw n HIS 42 Ca -0.04 -0.93 -0.31 0.00 -0.26 0.00 0.00 57.72 56.18 1xmw n HIS 42 Cb 0.43 -0.56 -0.04 0.00 1.12 0.00 0.00 29.99 30.93 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 -0.69 6.60 0.65 0.41 1.01 -1.26 -3.86 116.67 119.52 1xmw s ASP 43 Ca 0.44 1.09 0.39 0.00 0.71 0.00 0.00 52.55 55.17 1xmw s ASP 43 Cb 0.35 -2.30 2.13 0.00 1.01 0.00 0.00 42.92 44.11 1xmw s ASP 43 CO 0.11 -0.27 2.25 0.50 0.21 0.00 0.00 175.17 177.97 1xmw h LYS 44 N 1.79 0.00 -5.28 8.23 3.64 -1.89 -3.40 116.57 119.66 1xmw h LYS 44 Ca -0.47 0.00 -0.63 0.00 -1.27 0.00 0.00 60.65 58.28 1xmw h LYS 44 Cb 1.18 0.00 -0.20 0.00 -0.41 0.00 0.00 32.23 32.81 1xmw h LYS 44 CO 0.65 0.00 -0.63 -1.01 -2.27 0.00 0.00 179.45 176.20 1xmw s HIS 45 N -4.25 3.11 -0.79 1.91 3.76 -1.26 0.11 115.29 117.89 1xmw s HIS 45 Ca -0.05 -0.17 -0.14 0.00 -0.15 0.00 0.00 55.06 54.56 1xmw s HIS 45 Cb 0.13 -2.01 0.21 0.00 1.11 0.00 0.00 32.58 32.01 1xmw s HIS 45 CO 0.42 0.02 0.73 -1.17 -0.85 0.00 0.00 174.74 173.89 1xmw s LEU 46 N 0.41 6.64 -0.06 0.89 2.96 0.24 -4.80 118.68 124.96 1xmw s LEU 46 Ca -0.01 -2.61 -0.25 0.00 -0.22 0.00 0.00 54.13 51.04 1xmw s LEU 46 Cb -0.14 -2.19 -0.03 0.00 0.50 0.00 0.00 46.19 44.33 1xmw s LEU 46 CO 0.02 -0.59 0.78 -0.69 -1.32 0.00 0.00 176.35 174.54 1xmw s VAL 47 N 0.30 4.99 -0.36 1.68 1.01 -1.24 -1.59 120.40 125.19 1xmw s VAL 47 Ca 0.16 1.60 -0.01 0.00 0.00 0.00 0.00 61.98 63.74 1xmw s VAL 47 Cb -0.13 -4.11 0.09 0.00 0.00 0.00 0.00 36.38 32.23 1xmw s VAL 47 CO -0.07 0.21 0.10 -0.76 0.00 0.00 0.00 175.10 174.58 1xmw s LEU 48 N 0.99 4.74 0.47 3.92 1.43 0.12 -4.87 118.68 125.49 1xmw s LEU 48 Ca 0.41 -1.86 -0.21 0.00 -1.03 0.00 0.00 54.13 51.44 1xmw s LEU 48 Cb -0.18 -1.74 -0.09 0.00 0.03 0.00 0.00 46.19 44.21 1xmw s LEU 48 CO 0.20 -0.42 1.04 -1.10 0.23 0.00 0.00 176.35 176.29 1xmw s GLN 49 N 1.10 3.87 -1.31 1.70 1.11 -1.26 -2.00 119.66 122.87 1xmw s GLN 49 Ca 0.05 1.37 -0.03 0.00 0.01 0.00 0.00 55.36 56.76 1xmw s GLN 49 Cb -0.21 -2.16 -0.00 0.00 -1.01 0.00 0.00 33.01 29.63 1xmw s GLN 49 CO -0.04 -0.37 0.61 -0.25 0.01 0.00 0.00 175.29 175.24 1xmw n ASP 50 N -0.82 -1.50 -4.77 5.90 8.00 -1.04 -4.91 116.55 117.41 1xmw n ASP 50 Ca 0.09 -0.91 -0.34 0.00 0.71 0.00 0.00 54.79 54.33 1xmw n ASP 50 Cb 0.52 -3.62 0.02 0.00 -0.02 0.00 0.00 41.12 38.03 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 -3.75 2.62 0.01 1.24 2.19 0.95 -5.04 117.98 116.20 1xmw s PHE 51 Ca 0.07 1.55 0.02 0.00 0.33 0.00 0.00 56.93 58.90 1xmw s PHE 51 Cb -0.02 -3.26 -0.01 0.00 -1.31 0.00 0.00 43.02 38.42 1xmw s PHE 51 CO 0.85 -1.69 -0.05 -1.12 1.83 0.00 0.00 175.22 175.04 1xmw s SER 52 N -2.10 0.59 0.00 6.13 0.01 -1.26 -4.57 113.70 112.51 1xmw s SER 52 Ca 0.71 -0.18 0.32 0.00 1.31 0.00 0.00 55.95 58.10 1xmw s SER 52 Cb -0.23 -0.04 1.85 0.00 0.21 0.00 0.00 66.02 67.81 1xmw s SER 52 CO 0.34 -0.00 2.20 1.21 0.41 0.00 0.00 173.24 177.40 1xmw n GLU 53 N 2.65 0.91 -0.12 12.44 0.00 -1.25 -1.12 120.64 134.15 1xmw n GLU 53 Ca -0.15 -0.00 -0.24 0.00 0.00 0.00 0.00 57.16 56.77 1xmw n GLU 53 Cb 0.58 -1.50 -0.11 0.00 0.00 0.00 0.00 31.44 30.40 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 -1.04 1.55 -0.07 6.31 0.31 -1.26 -4.26 118.33 119.87 1xmw n VAL 54 Ca 0.22 -0.41 -0.06 0.00 -0.01 0.00 0.00 64.34 64.09 1xmw n VAL 54 Cb 0.13 -1.76 -0.12 0.00 -0.91 0.00 0.00 33.84 31.18 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 -3.92 1.39 -0.69 5.55 2.13 -1.25 -4.42 120.64 119.43 1xmw n GLU 55 Ca -0.46 -0.02 0.03 0.00 0.66 0.00 0.00 57.16 57.36 1xmw n GLU 55 Cb 0.90 -1.39 0.28 0.00 0.27 0.00 0.00 31.44 31.51 1xmw n GLU 55 CO 0.00 0.00 0.00 -3.47 -0.41 0.00 0.00 177.13 173.25 1xmw n ASP 56 N -2.50 4.42 -4.44 4.31 -0.08 -0.27 -4.87 116.55 113.12 1xmw n ASP 56 Ca -0.22 -2.74 -0.34 0.00 -1.51 0.00 0.00 54.79 49.98 1xmw n ASP 56 Cb 0.93 -0.65 -0.13 0.00 2.34 0.00 0.00 41.12 43.61 1xmw n ASP 56 CO 0.00 0.00 0.00 -0.94 0.12 0.00 0.00 177.20 176.38 1xmw s SER 57 N -0.59 4.55 0.00 1.67 1.04 -1.21 -4.81 113.70 114.35 1xmw s SER 57 Ca 0.41 -0.22 0.00 0.00 0.48 0.00 0.00 55.95 56.62 1xmw s SER 57 Cb 0.31 -1.74 0.00 0.00 0.10 0.00 0.00 66.02 64.69 1xmw s SER 57 CO 0.11 0.13 0.00 0.61 0.98 0.00 0.00 173.24 175.07 1xmw n GLY 58 N 3.80 -0.48 3.76 7.32 0.00 -1.04 -4.96 105.19 113.59 1xmw n GLY 58 Ca -0.18 -0.58 -0.32 0.00 0.00 0.00 0.00 46.02 44.95 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 -4.00 3.20 0.01 1.61 1.51 -1.26 -0.52 117.35 117.90 1xmw s TYR 59 Ca 0.00 0.12 0.02 0.00 -1.01 0.00 0.00 57.07 56.20 1xmw s TYR 59 Cb 0.00 -1.67 -0.01 0.00 -0.11 0.00 0.00 41.96 40.17 1xmw s TYR 59 CO 0.00 0.52 -0.08 0.71 -1.11 0.00 0.00 175.55 175.59 1xmw s TYR 60 N -1.27 0.67 -0.01 2.71 1.51 0.28 0.19 117.35 121.43 1xmw s TYR 60 Ca 0.25 -0.25 -0.24 0.00 -1.01 0.00 0.00 57.07 55.82 1xmw s TYR 60 Cb -0.12 -0.42 0.05 0.00 -0.11 0.00 0.00 41.96 41.37 1xmw s TYR 60 CO 0.17 -0.03 0.53 0.54 -1.11 0.00 0.00 175.55 175.66 1xmw s VAL 61 N -0.60 0.02 0.03 0.71 0.11 -0.21 -1.48 120.40 118.99 1xmw s VAL 61 Ca -0.01 -0.20 -0.01 0.00 -2.93 0.00 0.00 61.98 58.82 1xmw s VAL 61 Cb -0.05 -0.90 -0.03 0.00 -1.53 0.00 0.00 36.38 33.87 1xmw s VAL 61 CO 0.00 -0.11 -0.02 0.00 -3.33 0.00 0.00 175.10 171.64 1xmw s TYR 63 N -2.41 -0.22 0.34 0.00 -0.85 0.67 -4.86 117.35 110.01 1xmw s TYR 63 Ca -0.07 -0.11 0.06 0.00 -0.52 0.00 0.00 57.07 56.42 1xmw s TYR 63 Cb -0.03 0.47 -0.07 0.00 0.38 0.00 0.00 41.96 42.72 1xmw s TYR 63 CO -0.04 -0.95 0.01 0.95 -1.52 0.00 0.00 175.55 174.00 1xmw s THR 64 N -3.85 1.55 -0.63 -3.49 -4.23 -0.79 -0.37 115.64 103.82 1xmw s THR 64 Ca 0.08 -2.04 0.21 0.00 -1.18 0.00 0.00 61.69 58.76 1xmw s THR 64 Cb -0.02 -2.76 0.21 0.00 1.34 0.00 0.00 72.50 71.27 1xmw s THR 64 CO -0.04 -0.08 1.64 -0.81 -0.54 0.00 0.00 174.62 174.79 1xmw n PRO 65 N -0.74 0.14 -0.03 3.99 -0.04 -1.26 -2.97 135.00 134.09 1xmw n PRO 65 Ca -0.04 0.37 -0.01 0.00 -0.04 0.00 0.00 63.50 63.79 1xmw n PRO 65 Cb 0.66 -1.77 -0.08 0.00 -0.04 0.00 0.00 33.50 32.27 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 -1.70 1.99 -4.00 0.55 0.00 -1.26 -4.88 120.51 111.21 1xmw n ALA 66 Ca 0.02 -0.53 -0.32 0.00 0.00 0.00 0.00 53.44 52.62 1xmw n ALA 66 Cb 0.21 -0.12 -0.15 0.00 0.00 0.00 0.00 19.45 19.39 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 -3.90 4.74 -0.34 0.00 1.04 -1.16 -5.07 113.70 109.01 1xmw s SER 67 Ca -0.05 -1.96 -0.04 0.00 0.48 0.00 0.00 55.95 54.38 1xmw s SER 67 Cb 0.05 -1.63 0.05 0.00 0.10 0.00 0.00 66.02 64.59 1xmw s SER 67 CO 0.44 -0.35 0.09 0.21 0.98 0.00 0.00 173.24 174.61 1xmw s ASN 68 N 1.02 5.17 -0.13 7.02 2.47 -1.26 -1.89 114.94 127.34 1xmw s ASN 68 Ca 0.06 -1.32 0.00 0.00 0.42 0.00 0.00 52.86 52.02 1xmw s ASN 68 Cb -0.20 -1.81 0.02 0.00 -1.45 0.00 0.00 41.25 37.81 1xmw s ASN 68 CO -0.07 -0.34 -0.12 -0.75 -3.72 0.00 0.00 177.10 172.10 1xmw s LYS 69 N 1.32 2.02 -0.70 0.43 2.20 -1.26 -5.07 119.74 118.68 1xmw s LYS 69 Ca -0.02 -0.46 -0.26 0.00 -0.36 0.00 0.00 55.97 54.88 1xmw s LYS 69 Cb -0.20 -1.89 -0.02 0.00 -1.51 0.00 0.00 37.83 34.21 1xmw s LYS 69 CO 0.00 -0.22 1.80 -0.80 -0.36 0.00 0.00 175.35 175.78 1xmw s ASN 70 N 1.47 5.39 -0.01 1.43 0.01 -1.26 -4.92 114.94 117.05 1xmw s ASN 70 Ca 0.03 -0.02 0.00 0.00 -0.71 0.00 0.00 52.86 52.16 1xmw s ASN 70 Cb -0.13 -2.54 0.02 0.00 0.41 0.00 0.00 41.25 39.00 1xmw s ASN 70 CO -0.08 -2.36 0.01 0.28 -1.51 0.00 0.00 177.10 173.44 1xmw s THR 71 N 8.77 -0.02 0.08 1.60 -1.32 -1.25 -2.77 115.64 120.72 1xmw s THR 71 Ca 0.63 0.11 0.09 0.00 -1.21 0.00 0.00 61.69 61.31 1xmw s THR 71 Cb -0.10 -0.05 -0.03 0.00 -1.51 0.00 0.00 72.50 70.80 1xmw s THR 71 CO 0.15 0.05 -0.24 -0.31 -2.21 0.00 0.00 174.62 172.05 1xmw s TYR 72 N 0.55 2.08 -0.11 9.09 1.51 -0.85 -4.70 117.35 124.91 1xmw s TYR 72 Ca -0.05 -0.40 0.00 0.00 -1.01 0.00 0.00 57.07 55.62 1xmw s TYR 72 Cb -0.07 -1.18 0.02 0.00 -0.11 0.00 0.00 41.96 40.62 1xmw s TYR 72 CO -0.02 0.20 -0.09 -1.17 -1.11 0.00 0.00 175.55 173.37 1xmw s LEU 73 N -1.64 1.33 -0.76 -1.29 0.20 -0.55 0.12 118.68 116.09 1xmw s LEU 73 Ca 0.10 -0.32 -0.20 0.00 0.69 0.00 0.00 54.13 54.40 1xmw s LEU 73 Cb -0.10 -0.87 0.11 0.00 -0.43 0.00 0.00 46.19 44.90 1xmw s LEU 73 CO 0.04 -0.08 0.96 -0.47 -0.29 0.00 0.00 176.35 176.51 1xmw s TYR 74 N 1.47 2.98 -0.31 5.38 5.04 -0.98 0.98 117.35 131.91 1xmw s TYR 74 Ca 0.01 -1.05 -0.23 0.00 -2.44 0.00 0.00 57.07 53.36 1xmw s TYR 74 Cb -0.13 -4.20 -0.00 0.00 0.35 0.00 0.00 41.96 37.97 1xmw s TYR 74 CO -0.06 -1.47 0.77 -1.17 -1.34 0.00 0.00 175.55 172.27 1xmw s LEU 75 N 3.01 4.10 -0.32 6.97 2.96 0.32 -1.50 118.68 134.21 1xmw s LEU 75 Ca 0.24 0.63 -0.00 0.00 -0.22 0.00 0.00 54.13 54.77 1xmw s LEU 75 Cb -0.13 -3.04 0.10 0.00 0.50 0.00 0.00 46.19 43.62 1xmw s LEU 75 CO 0.01 -0.59 0.10 -0.75 -1.32 0.00 0.00 176.35 173.79 1xmw s LYS 76 N 2.90 0.76 0.20 1.98 2.20 -0.99 -2.50 119.74 124.30 1xmw s LYS 76 Ca 0.31 -1.14 0.00 0.00 -0.36 0.00 0.00 55.97 54.79 1xmw s LYS 76 Cb -0.14 -2.05 -0.04 0.00 -1.51 0.00 0.00 37.83 34.09 1xmw s LYS 76 CO 0.12 -0.99 0.08 0.00 -0.36 0.00 0.00 175.35 174.20 1xmw s ALA 77 N 1.55 1.34 -0.05 3.13 0.00 -1.26 0.32 121.76 126.79 1xmw s ALA 77 Ca 0.10 -1.70 0.02 0.00 0.00 0.00 0.00 51.96 50.38 1xmw s ALA 77 Cb -0.18 1.03 0.02 0.00 0.00 0.00 0.00 23.12 23.99 1xmw s ALA 77 CO -0.24 -0.48 -0.08 0.50 0.00 0.00 0.00 175.76 175.47 1xmw s ARG 78 N -4.05 1.20 -0.15 0.00 3.52 -1.26 -3.94 118.95 114.27 1xmw s ARG 78 Ca 0.33 -0.24 -0.04 0.00 -0.13 0.00 0.00 55.73 55.65 1xmw s ARG 78 Cb 0.07 -1.08 0.07 0.00 -1.56 0.00 0.00 34.95 32.46 1xmw s ARG 78 CO 0.09 -0.03 0.24 0.14 -0.81 0.00 0.00 175.30 174.93 1xmw s VAL 79 N 0.79 -0.37 0.00 7.11 -7.23 -1.26 -5.02 120.40 114.42 1xmw s VAL 79 Ca -0.13 0.16 0.00 0.00 -1.81 0.00 0.00 61.98 60.20 1xmw s VAL 79 Cb -0.15 -0.51 0.00 0.00 0.56 0.00 0.00 36.38 36.28 1xmw s VAL 79 CO 0.02 0.01 0.00 0.61 -0.31 0.00 0.00 175.10 175.43 1xmw n GLY 80 N 5.34 3.75 2.35 2.32 0.00 -1.26 -4.72 105.19 112.97 1xmw n GLY 80 Ca -0.06 -0.28 -0.15 0.00 0.00 0.00 0.00 46.02 45.53 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 3.62 0.00 1.61 7.64 -1.26 -4.81 113.62 120.43 1xmw n SER 81 Ca 0.00 -3.10 0.00 0.00 1.01 0.00 0.00 58.87 56.78 1xmw n SER 81 Cb 0.00 -0.40 0.00 0.00 -1.01 0.00 0.00 64.21 62.80 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 -0.65 2.56 -2.38 -0.43 0.00 -1.26 -5.12 120.51 113.23 1xmw n ALA 82 Ca 0.30 0.00 -0.19 0.00 0.00 0.00 0.00 53.44 53.55 1xmw n ALA 82 Cb 0.89 0.00 -0.10 0.00 0.00 0.00 0.00 19.45 20.24 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 -4.30 2.44 -0.01 0.00 1.01 -1.26 -5.05 116.67 109.50 1xmw s ASP 83 Ca 0.00 -0.96 0.08 0.00 0.71 0.00 0.00 52.55 52.38 1xmw s ASP 83 Cb 0.00 -0.12 -0.13 0.00 1.01 0.00 0.00 42.92 43.69 1xmw s ASP 83 CO 0.00 -0.16 0.19 0.47 0.21 0.00 0.00 175.17 175.89 1xmw n ASP 84 N -0.10 2.91 -2.76 0.27 8.00 -1.26 -4.95 116.55 118.65 1xmw n ASP 84 Ca -0.10 -0.05 -0.02 0.00 0.71 0.00 0.00 54.79 55.32 1xmw n ASP 84 Cb 0.59 1.35 -0.02 0.00 -0.02 0.00 0.00 41.12 43.02 1xmw n ASP 84 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1xmw n ALA 85 N -1.74 -3.17 -1.70 2.24 0.00 -1.26 -4.87 120.51 110.00 1xmw n ALA 85 Ca -0.01 1.21 -0.35 0.00 0.00 0.00 0.00 53.44 54.30 1xmw n ALA 85 Cb 0.21 -2.49 0.01 0.00 0.00 0.00 0.00 19.45 17.19 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 -1.00 3.20 0.23 0.00 1.02 -1.26 -4.91 119.74 117.02 1xmw s LYS 86 Ca -0.12 1.56 0.21 0.00 0.02 0.00 0.00 55.97 57.63 1xmw s LYS 86 Cb 0.01 -1.99 0.05 0.00 -0.52 0.00 0.00 37.83 35.38 1xmw s LYS 86 CO 0.63 -0.97 1.16 1.57 -0.92 0.00 0.00 175.35 176.82 1xmw h LYS 87 N 0.88 0.00 -2.31 1.68 2.10 -1.98 -3.46 116.57 113.48 1xmw h LYS 87 Ca -0.49 0.00 -0.03 0.00 -2.00 0.00 0.00 60.65 58.13 1xmw h LYS 87 Cb 1.26 0.00 -0.24 0.00 -0.90 0.00 0.00 32.23 32.35 1xmw h LYS 87 CO 0.56 0.11 -0.20 0.34 -2.00 0.00 0.00 179.45 178.26 1xmw s ASP 88 N -5.75 -0.69 0.00 7.07 2.15 -1.26 -4.91 116.67 113.28 1xmw s ASP 88 Ca 0.01 1.23 0.00 0.00 0.43 0.00 0.00 52.55 54.22 1xmw s ASP 88 Cb 0.08 1.43 0.00 0.00 -0.30 0.00 0.00 42.92 44.13 1xmw s ASP 88 CO 0.76 -0.22 0.00 0.00 -0.17 0.00 0.00 175.17 175.54 1xmw n ALA 89 N 4.86 2.71 -0.02 3.66 0.00 -1.26 -5.01 120.51 125.45 1xmw n ALA 89 Ca -0.16 0.00 -0.01 0.00 0.00 0.00 0.00 53.44 53.27 1xmw n ALA 89 Cb 0.53 0.00 -0.00 0.00 0.00 0.00 0.00 19.45 19.98 1xmw n ALA 89 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1xmw h ALA 90 N 0.00 0.00 -2.29 0.00 0.00 -1.99 -3.45 119.26 111.53 1xmw h ALA 90 Ca 0.00 -0.31 -0.54 0.00 0.00 0.00 0.00 54.91 54.05 1xmw h ALA 90 Cb 0.00 0.16 -0.00 0.00 0.00 0.00 0.00 17.79 17.94 1xmw h ALA 90 CO 0.00 0.16 1.12 0.21 0.00 0.00 0.00 179.25 180.73 1xmw s LYS 91 N -1.39 4.17 0.75 0.00 2.20 -1.26 -4.96 119.74 119.24 1xmw s LYS 91 Ca -0.05 2.29 -0.13 0.00 -0.36 0.00 0.00 55.97 57.72 1xmw s LYS 91 Cb 0.01 -4.01 0.05 0.00 -1.51 0.00 0.00 37.83 32.36 1xmw s LYS 91 CO 0.07 -0.87 1.14 0.15 -0.36 0.00 0.00 175.35 175.49 1xmw s LYS 92 N 4.09 2.18 1.19 4.03 3.01 -1.26 -4.78 119.74 128.20 1xmw s LYS 92 Ca 0.77 1.50 0.00 0.00 -1.01 0.00 0.00 55.97 57.23 1xmw s LYS 92 Cb -0.36 -1.86 0.00 0.00 -1.01 0.00 0.00 37.83 34.60 1xmw s LYS 92 CO 0.32 -1.75 0.00 -3.47 0.51 0.00 0.00 175.35 170.96 1xmw n ASP 93 N -3.03 -4.16 0.00 2.83 -0.08 -1.26 -4.86 116.55 105.99 1xmw n ASP 93 Ca 0.11 0.12 0.00 0.00 -1.51 0.00 0.00 54.79 53.51 1xmw n ASP 93 Cb 0.52 -0.35 0.00 0.00 2.34 0.00 0.00 41.12 43.62 1xmw n ASP 93 CO 0.00 0.00 0.00 0.47 0.12 0.00 0.00 177.20 177.79 1xmw n ASP 94 N -3.46 0.80 -3.56 1.67 9.92 -1.26 -4.93 116.55 115.74 1xmw n ASP 94 Ca 0.00 0.00 -0.18 0.00 -0.53 0.00 0.00 54.79 54.08 1xmw n ASP 94 Cb 0.05 0.00 -0.14 0.00 -0.64 0.00 0.00 41.12 40.39 1xmw n ASP 94 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 1xmw s ALA 95 N -1.55 -0.24 0.37 2.24 0.00 -1.26 -5.14 121.76 116.17 1xmw s ALA 95 Ca 0.00 0.38 -0.17 0.00 0.00 0.00 0.00 51.96 52.16 1xmw s ALA 95 Cb 0.00 -1.16 -0.10 0.00 0.00 0.00 0.00 23.12 21.87 1xmw s ALA 95 CO 0.00 -0.99 0.82 0.21 0.00 0.00 0.00 175.76 175.80 1xmw s LYS 96 N 2.32 4.08 -0.13 0.00 2.20 -1.26 -5.07 119.74 121.88 1xmw s LYS 96 Ca 0.05 0.84 -0.30 0.00 -0.36 0.00 0.00 55.97 56.20 1xmw s LYS 96 Cb -0.14 -2.33 0.12 0.00 -1.51 0.00 0.00 37.83 33.97 1xmw s LYS 96 CO -0.10 0.07 0.95 0.21 -0.36 0.00 0.00 175.35 176.11 1xmw s LYS 97 N -3.12 0.68 0.00 4.03 2.20 -1.26 -5.11 119.74 117.15 1xmw s LYS 97 Ca 0.57 0.12 0.00 0.00 -0.36 0.00 0.00 55.97 56.30 1xmw s LYS 97 Cb -0.10 0.32 0.00 0.00 -1.51 0.00 0.00 37.83 36.54 1xmw s LYS 97 CO 0.17 -0.22 0.00 -3.47 -0.36 0.00 0.00 175.35 171.47 1xmw n ASP 98 N 0.66 0.00 -3.17 1.43 2.03 -1.26 -5.14 116.55 111.11 1xmw n ASP 98 Ca -0.11 0.00 0.05 0.00 0.52 0.00 0.00 54.79 55.25 1xmw n ASP 98 Cb 0.58 0.04 -0.02 0.00 -0.72 0.00 0.00 41.12 41.00 1xmw n ASP 98 CO 0.00 0.00 0.00 -1.81 -1.92 0.00 0.00 177.20 173.47 1xmw s ASP 99 N 1.73 -0.48 -0.01 1.67 1.01 -1.26 -5.05 116.67 114.28 1xmw s ASP 99 Ca 0.00 0.33 0.02 0.00 0.71 0.00 0.00 52.55 53.61 1xmw s ASP 99 Cb 0.00 1.41 -0.02 0.00 1.01 0.00 0.00 42.92 45.32 1xmw s ASP 99 CO 0.00 -0.09 0.02 0.00 0.21 0.00 0.00 175.17 175.31 1xmw n ALA 100 N 5.41 1.99 -3.58 5.23 0.00 -1.26 -4.84 120.51 123.46 1xmw n ALA 100 Ca -0.07 -0.10 -0.29 0.00 0.00 0.00 0.00 53.44 52.98 1xmw n ALA 100 Cb 0.54 0.13 -0.09 0.00 0.00 0.00 0.00 19.45 20.03 1xmw n ALA 100 CO 0.00 0.00 0.00 0.36 0.00 0.00 0.00 177.50 177.86 1xmw n LYS 101 N -1.92 2.44 0.27 0.00 2.85 -1.26 -4.88 118.16 115.66 1xmw n LYS 101 Ca -0.02 -4.59 0.12 0.00 -1.05 0.00 0.00 58.31 52.77 1xmw n LYS 101 Cb 0.41 -2.30 0.74 0.00 -0.65 0.00 0.00 35.03 33.23 1xmw n LYS 101 CO 0.00 0.00 0.00 -0.22 -0.05 0.00 0.00 177.40 177.13 1xmw h LYS 102 N 4.85 0.00 -2.66 -1.58 3.64 -2.01 -3.48 116.57 115.32 1xmw h LYS 102 Ca 0.18 0.00 0.30 0.00 -1.27 0.00 0.00 60.65 59.86 1xmw h LYS 102 Cb 0.70 0.00 -0.09 0.00 -0.41 0.00 0.00 32.23 32.43 1xmw h LYS 102 CO 0.83 0.10 -0.53 -3.47 -2.27 0.00 0.00 179.45 174.11 1xmw n ASP 103 N -3.77 -6.76 0.00 4.20 -0.08 -1.26 -4.91 116.55 103.97 1xmw n ASP 103 Ca -0.02 0.59 0.00 0.00 -1.51 0.00 0.00 54.79 53.85 1xmw n ASP 103 Cb 0.20 -3.73 0.00 0.00 2.34 0.00 0.00 41.12 39.93 1xmw n ASP 103 CO 0.00 0.00 0.00 0.61 0.12 0.00 0.00 177.20 177.93 1xmw n GLY 104 N -3.58 -0.18 1.43 0.27 0.00 -1.26 -4.96 105.19 96.91 1xmw n GLY 104 Ca -0.01 0.00 0.04 0.00 0.00 0.00 0.00 46.02 46.05 1xmw n GLY 104 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 1xmw n SER 105 N 0.00 1.20 -0.08 1.61 2.88 -1.26 -4.76 113.62 113.20 1xmw n SER 105 Ca 0.00 -2.34 -0.16 0.00 -1.33 0.00 0.00 58.87 55.04 1xmw n SER 105 Cb 0.00 -0.35 -0.10 0.00 -0.75 0.00 0.00 64.21 63.01 1xmw n SER 105 CO 0.00 0.00 0.00 1.56 -1.23 0.00 0.00 175.04 175.37 1xmw h GLN 106 N 1.11 0.00 -1.00 -1.46 1.08 -1.96 -3.42 115.11 109.45 1xmw h GLN 106 Ca -0.18 0.00 -0.38 0.00 -1.45 0.00 0.00 58.65 56.64 1xmw h GLN 106 Cb 1.71 0.00 -0.40 0.00 -0.05 0.00 0.00 27.48 28.74 1xmw h GLN 106 CO 0.10 0.84 -1.13 -2.37 -0.95 0.00 0.00 178.83 175.32 1xmw n THR 107 N -4.54 1.22 -1.51 -0.54 5.66 -1.26 -4.94 114.28 108.37 1xmw n THR 107 Ca -0.19 -3.29 -0.28 0.00 -3.05 0.00 0.00 64.05 57.24 1xmw n THR 107 Cb 0.52 0.46 -0.05 0.00 -1.55 0.00 0.00 70.33 69.71 1xmw n THR 107 CO 0.00 0.00 0.00 0.59 -3.05 0.00 0.00 175.07 172.61 1xmw n ASN 108 N -0.18 6.53 -4.87 1.09 3.02 -1.26 -4.96 115.26 114.62 1xmw n ASN 108 Ca 0.13 -3.23 -0.30 0.00 -0.03 0.00 0.00 54.58 51.15 1xmw n ASN 108 Cb 0.80 -1.23 -0.02 0.00 -0.61 0.00 0.00 39.78 38.72 1xmw n ASN 108 CO 0.00 0.00 0.00 -0.75 -2.62 0.00 0.00 177.26 173.89 1xmw s LYS 109 N -1.79 3.76 0.26 3.52 2.20 -1.26 -5.09 119.74 121.34 1xmw s LYS 109 Ca 0.59 0.58 0.10 0.00 -0.36 0.00 0.00 55.97 56.88 1xmw s LYS 109 Cb 0.38 -2.29 -0.05 0.00 -1.51 0.00 0.00 37.83 34.36 1xmw s LYS 109 CO -0.23 -0.19 -0.17 0.00 -0.36 0.00 0.00 175.35 174.41 1xmw s ALA 110 N -2.59 2.48 -0.12 3.13 0.00 -1.26 -5.14 121.76 118.25 1xmw s ALA 110 Ca 0.53 -1.81 -0.06 0.00 0.00 0.00 0.00 51.96 50.62 1xmw s ALA 110 Cb -0.10 -0.17 0.05 0.00 0.00 0.00 0.00 23.12 22.90 1xmw s ALA 110 CO 0.36 0.18 0.29 -1.59 0.00 0.00 0.00 175.76 175.00 1xmw s LYS 111 N -3.57 0.24 -0.06 0.00 -2.85 -1.26 -5.11 119.74 107.13 1xmw s LYS 111 Ca 0.27 0.63 -0.00 0.00 -1.00 0.00 0.00 55.97 55.87 1xmw s LYS 111 Cb -0.03 -0.08 0.02 0.00 -2.06 0.00 0.00 37.83 35.69 1xmw s LYS 111 CO 0.12 -0.18 -0.02 1.03 0.10 0.00 0.00 175.35 176.40 1xmw s ARG 112 N 1.48 0.73 0.00 1.78 1.81 -1.26 -5.13 118.95 118.36 1xmw s ARG 112 Ca -0.08 -0.01 0.00 0.00 -1.72 0.00 0.00 55.73 53.92 1xmw s ARG 112 Cb -0.10 -0.90 0.00 0.00 -0.45 0.00 0.00 34.95 33.50 1xmw s ARG 112 CO -0.10 -0.19 0.00 0.00 -0.68 0.00 0.00 175.30 174.34 1xmw n ALA 113 N 4.55 0.00 -2.65 2.13 0.00 -1.26 -4.67 120.51 118.61 1xmw n ALA 113 Ca -0.17 0.00 -0.30 0.00 0.00 0.00 0.00 53.44 52.97 1xmw n ALA 113 Cb 0.50 0.00 -0.04 0.00 0.00 0.00 0.00 19.45 19.91 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 4.22 0.12 0.00 0.20 -1.26 -4.17 118.68 117.80 1xmw s LEU 114 Ca 0.00 0.60 -0.22 0.00 0.69 0.00 0.00 54.13 55.20 1xmw s LEU 114 Cb 0.00 -3.35 0.06 0.00 -0.43 0.00 0.00 46.19 42.47 1xmw s LEU 114 CO 0.00 -0.01 0.56 -1.61 -0.29 0.00 0.00 176.35 175.00 1xmw s GLU 115 N -2.92 1.19 -0.01 1.98 0.41 -0.11 -4.91 118.70 114.32 1xmw s GLU 115 Ca 0.42 -0.43 0.06 0.00 -0.41 0.00 0.00 54.97 54.61 1xmw s GLU 115 Cb -0.12 0.55 -0.02 0.00 -1.78 0.00 0.00 34.13 32.76 1xmw s GLU 115 CO 0.26 -0.49 -0.21 0.54 -0.49 0.00 0.00 175.26 174.87 1xmw s VAL 116 N -3.40 1.65 0.22 2.63 0.11 -1.26 0.47 120.40 120.82 1xmw s VAL 116 Ca -0.00 -0.91 0.04 0.00 -2.93 0.00 0.00 61.98 58.18 1xmw s VAL 116 Cb -0.00 -1.37 -0.05 0.00 -1.53 0.00 0.00 36.38 33.42 1xmw s VAL 116 CO -0.10 0.45 -0.02 -0.76 -3.33 0.00 0.00 175.10 171.34 1xmw s LEU 117 N -0.53 2.27 -0.32 2.54 1.43 -0.94 -4.97 118.68 118.16 1xmw s LEU 117 Ca 0.08 -1.19 0.03 0.00 -1.03 0.00 0.00 54.13 52.03 1xmw s LEU 117 Cb -0.08 -0.32 0.09 0.00 0.03 0.00 0.00 46.19 45.91 1xmw s LEU 117 CO -0.01 -0.47 0.02 -1.61 0.23 0.00 0.00 176.35 174.52 1xmw s GLU 118 N -3.83 1.57 0.10 1.70 2.02 -1.26 -2.15 118.70 116.86 1xmw s GLU 118 Ca 0.27 -1.67 0.08 0.00 0.02 0.00 0.00 54.97 53.67 1xmw s GLU 118 Cb 0.05 -3.02 -0.03 0.00 0.10 0.00 0.00 34.13 31.22 1xmw s GLU 118 CO 0.08 -0.86 -0.20 0.00 0.02 0.00 0.00 175.26 174.31 1xmw s ALA 119 N 1.02 1.71 -1.38 5.21 0.00 0.17 -4.78 121.76 123.72 1xmw s ALA 119 Ca 0.06 -1.22 -0.02 0.00 0.00 0.00 0.00 51.96 50.78 1xmw s ALA 119 Cb -0.19 -0.22 0.01 0.00 0.00 0.00 0.00 23.12 22.73 1xmw s ALA 119 CO -0.09 0.32 0.62 -1.91 0.00 0.00 0.00 175.76 174.70 1xmw n GLU 120 N 1.06 -4.28 -1.80 0.00 2.13 -1.26 0.02 120.64 116.51 1xmw n GLU 120 Ca -0.19 0.53 -0.13 0.00 0.66 0.00 0.00 57.16 58.02 1xmw n GLU 120 Cb 0.54 -4.95 -0.04 0.00 0.27 0.00 0.00 31.44 27.26 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 -3.00 -3.69 -4.19 4.31 -0.08 -1.26 -4.91 116.55 103.72 1xmw n ASP 121 Ca -0.26 0.26 -0.12 0.00 -1.51 0.00 0.00 54.79 53.17 1xmw n ASP 121 Cb 0.66 -3.32 -0.10 0.00 2.34 0.00 0.00 41.12 40.71 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 -3.87 0.91 -0.01 -0.67 1.02 0.10 -3.80 119.74 113.42 1xmw s LYS 122 Ca 0.00 -1.38 0.05 0.00 0.02 0.00 0.00 55.97 54.66 1xmw s LYS 122 Cb 0.00 -0.28 -0.01 0.00 -0.52 0.00 0.00 37.83 37.01 1xmw s LYS 122 CO 0.00 -0.02 -0.15 0.14 -0.92 0.00 0.00 175.35 174.40 1xmw s VAL 123 N -3.58 1.20 0.03 3.17 -7.23 -0.84 0.45 120.40 113.60 1xmw s VAL 123 Ca 0.14 -0.66 -0.03 0.00 -1.81 0.00 0.00 61.98 59.63 1xmw s VAL 123 Cb 0.05 -1.00 -0.02 0.00 0.56 0.00 0.00 36.38 35.97 1xmw s VAL 123 CO -0.03 0.33 0.03 -0.63 -0.31 0.00 0.00 175.10 174.49 1xmw s ILE 124 N -0.37 0.13 -0.03 -0.62 1.09 -0.91 -3.02 121.20 117.47 1xmw s ILE 124 Ca 0.06 -1.05 -0.10 0.00 -1.10 0.00 0.00 60.65 58.46 1xmw s ILE 124 Cb -0.06 -0.62 -0.05 0.00 -1.06 0.00 0.00 42.46 40.67 1xmw s ILE 124 CO -0.01 -0.58 0.29 -0.76 -0.10 0.00 0.00 174.94 173.78 1xmw s LEU 125 N -1.82 4.41 -0.08 2.97 1.43 -1.03 -2.21 118.68 122.36 1xmw s LEU 125 Ca -0.10 0.69 0.02 0.00 -1.03 0.00 0.00 54.13 53.72 1xmw s LEU 125 Cb -0.05 -2.48 0.01 0.00 0.03 0.00 0.00 46.19 43.71 1xmw s LEU 125 CO -0.03 0.32 -0.13 -0.54 0.23 0.00 0.00 176.35 176.20 1xmw s LYS 126 N -1.30 1.84 0.19 1.70 1.02 0.18 -2.02 119.74 121.34 1xmw s LYS 126 Ca 0.23 -0.45 0.05 0.00 0.02 0.00 0.00 55.97 55.82 1xmw s LYS 126 Cb -0.14 -1.54 -0.05 0.00 -0.52 0.00 0.00 37.83 35.58 1xmw s LYS 126 CO 0.11 0.00 -0.08 0.00 -0.92 0.00 0.00 175.35 174.46 1xmw n ASN 128 N -0.32 0.00 0.00 0.00 5.15 -1.26 -4.82 115.26 114.01 1xmw n ASN 128 Ca -0.08 -0.25 0.00 0.00 -0.60 0.00 0.00 54.58 53.65 1xmw n ASN 128 Cb 0.62 -0.00 0.00 0.00 -0.53 0.00 0.00 39.78 39.86 1xmw n ASN 128 CO 0.00 0.00 0.00 -1.54 1.40 0.00 0.00 177.26 177.12 1xmw n SER 129 N -1.00 0.00 -4.66 1.20 3.41 -1.26 -5.06 113.62 106.25 1xmw n SER 129 Ca 0.06 0.00 -0.44 0.00 -0.26 0.00 0.00 58.87 58.23 1xmw n SER 129 Cb 0.03 0.00 -0.02 0.00 -0.26 0.00 0.00 64.21 63.96 1xmw n SER 129 CO 0.00 0.00 0.00 -0.24 -0.16 0.00 0.00 175.04 174.64 1xmw n SER 130 N 0.00 2.35 -4.90 4.04 2.88 -1.17 -3.92 113.62 112.89 1xmw n SER 130 Ca 0.00 1.18 -0.32 0.00 -1.33 0.00 0.00 58.87 58.40 1xmw n SER 130 Cb 0.00 -1.41 -0.05 0.00 -0.75 0.00 0.00 64.21 62.01 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 -0.70 5.28 -0.48 2.46 1.01 -1.26 -4.54 121.20 122.97 1xmw s ILE 131 Ca 0.61 -0.11 -0.17 0.00 0.00 0.00 0.00 60.65 60.98 1xmw s ILE 131 Cb -0.64 -3.61 0.07 0.00 0.01 0.00 0.00 42.46 38.28 1xmw s ILE 131 CO 0.57 0.14 0.46 -0.89 0.00 0.00 0.00 174.94 175.22 1xmw s THR 132 N -1.53 5.13 -0.60 2.92 2.01 0.15 -4.94 115.64 118.78 1xmw s THR 132 Ca 0.36 -0.88 -0.27 0.00 0.31 0.00 0.00 61.69 61.21 1xmw s THR 132 Cb -0.13 -4.17 -0.02 0.00 0.01 0.00 0.00 72.50 68.19 1xmw s THR 132 CO 0.24 -0.64 1.85 -0.22 -0.69 0.00 0.00 174.62 175.17 1xmw s LEU 133 N 1.94 3.30 -0.05 4.42 1.98 -1.26 -1.01 118.68 127.99 1xmw s LEU 133 Ca 0.07 0.37 -0.11 0.00 -2.89 0.00 0.00 54.13 51.58 1xmw s LEU 133 Cb -0.23 -2.58 -0.06 0.00 0.66 0.00 0.00 46.19 43.98 1xmw s LEU 133 CO 0.08 -2.34 0.45 -0.07 -1.89 0.00 0.00 176.35 172.59 1xmw h LEU 134 N 16.25 -0.33 0.00 -0.68 3.38 -1.83 -3.49 115.31 128.61 1xmw h LEU 134 Ca -0.26 0.01 0.12 0.00 0.09 0.00 0.00 57.88 57.84 1xmw h LEU 134 Cb 1.16 0.09 -0.02 0.00 0.09 0.00 0.00 40.66 41.97 1xmw h LEU 134 CO 1.21 0.11 0.34 0.00 0.09 0.00 0.00 178.44 180.20 1xmw n GLN 135 N -5.01 0.12 0.00 1.13 10.64 -1.16 -5.00 117.38 118.10 1xmw n GLN 135 Ca -0.05 -0.39 0.00 0.00 -1.83 0.00 0.00 57.00 54.73 1xmw n GLN 135 Cb 0.15 0.60 0.00 0.00 -0.86 0.00 0.00 30.24 30.14 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 -0.36 0.89 3.54 2.61 0.00 -1.26 -1.46 105.19 109.15 1xmw n GLY 136 Ca 0.01 -0.81 -0.28 0.00 0.00 0.00 0.00 46.02 44.94 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 -2.77 2.61 5.66 -0.81 -4.81 114.28 114.12 1xmw n THR 137 Ca 0.00 -0.55 -0.41 0.00 -3.05 0.00 0.00 64.05 60.04 1xmw n THR 137 Cb 0.00 -1.86 0.02 0.00 -1.55 0.00 0.00 70.33 66.94 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 14.72 5.75 -1.00 1.79 0.00 -1.26 -4.81 120.51 135.70 1xmw n ALA 138 Ca 0.48 -4.68 0.00 0.00 0.00 0.00 0.00 53.44 49.24 1xmw n ALA 138 Cb 0.38 -2.22 0.00 0.00 0.00 0.00 0.00 19.45 17.61 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 -1.95 3.11 0.00 0.00 -1.26 -4.99 105.19 100.51 1xmw n GLY 139 Ca 0.39 -0.18 -0.13 0.00 0.00 0.00 0.00 46.02 46.11 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 0.26 0.72 1.61 -1.52 -1.03 -4.87 119.66 114.84 1xmw s GLN 140 Ca 0.00 0.31 -0.13 0.00 -1.95 0.00 0.00 55.36 53.60 1xmw s GLN 140 Cb 0.00 0.13 0.03 0.00 -0.22 0.00 0.00 33.01 32.95 1xmw s GLN 140 CO 0.00 -0.03 1.11 -1.21 -0.25 0.00 0.00 175.29 174.91 1xmw s GLU 141 N 0.12 2.46 0.00 2.91 2.02 -1.26 -0.07 118.70 124.88 1xmw s GLU 141 Ca -0.00 1.32 0.00 0.00 0.02 0.00 0.00 54.97 56.31 1xmw s GLU 141 Cb -0.02 -1.91 0.00 0.00 0.10 0.00 0.00 34.13 32.30 1xmw s GLU 141 CO 0.00 -1.50 0.00 1.55 0.02 0.00 0.00 175.26 175.33 1xmw n VAL 142 N -2.98 0.00 -0.33 2.63 3.14 0.52 -4.76 118.33 116.56 1xmw n VAL 142 Ca 0.10 0.00 0.14 0.00 -2.96 0.00 0.00 64.34 61.62 1xmw n VAL 142 Cb 0.52 0.00 0.36 0.00 -1.06 0.00 0.00 33.84 33.66 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 0.71 -0.61 6.55 0.02 -1.96 -3.39 113.55 114.87 1xmw h SER 143 Ca 0.00 0.08 -0.03 0.00 -0.84 0.00 0.00 61.79 61.00 1xmw h SER 143 Cb 0.00 -0.05 -0.17 0.00 0.14 0.00 0.00 62.40 62.32 1xmw h SER 143 CO 0.00 0.28 -0.30 -1.81 -1.14 0.00 0.00 176.83 173.85 1xmw s ASP 144 N -5.50 -0.91 -0.14 3.07 1.01 -1.26 -5.07 116.67 107.87 1xmw s ASP 144 Ca -0.11 -0.82 -0.04 0.00 0.71 0.00 0.00 52.55 52.30 1xmw s ASP 144 Cb 0.24 1.18 0.01 0.00 1.01 0.00 0.00 42.92 45.37 1xmw s ASP 144 CO 0.80 -0.06 0.08 0.59 0.21 0.00 0.00 175.17 176.78 1xmw n ASN 145 N 3.31 -5.36 0.00 0.27 5.03 -1.26 -4.81 115.26 112.44 1xmw n ASN 145 Ca 0.12 1.09 0.00 0.00 0.87 0.00 0.00 54.58 56.66 1xmw n ASN 145 Cb 0.60 -3.68 0.00 0.00 -1.02 0.00 0.00 39.78 35.68 1xmw n ASN 145 CO 0.00 0.00 0.00 0.29 -1.83 0.00 0.00 177.26 175.72 1xmw n LYS 146 N 1.55 0.00 -3.78 3.52 4.76 -1.25 -3.05 118.16 119.91 1xmw n LYS 146 Ca -0.13 0.00 -0.15 0.00 -2.87 0.00 0.00 58.31 55.16 1xmw n LYS 146 Cb 0.30 0.00 -0.16 0.00 -1.84 0.00 0.00 35.03 33.33 1xmw n LYS 146 CO 0.00 0.00 0.00 0.99 -1.37 0.00 0.00 177.40 177.02 1xmw s THR 147 N 0.00 -0.05 0.15 -0.18 2.01 -1.26 -3.08 115.64 113.24 1xmw s THR 147 Ca 0.00 0.22 -0.08 0.00 0.31 0.00 0.00 61.69 62.14 1xmw s THR 147 Cb 0.00 -0.09 -0.06 0.00 0.01 0.00 0.00 72.50 72.35 1xmw s THR 147 CO 0.00 0.10 0.43 -0.22 -0.69 0.00 0.00 174.62 174.24 1xmw s LEU 148 N 1.10 4.26 -0.32 4.42 1.98 -0.86 0.20 118.68 129.46 1xmw s LEU 148 Ca -0.09 0.74 0.02 0.00 -2.89 0.00 0.00 54.13 51.92 1xmw s LEU 148 Cb -0.13 -3.34 0.10 0.00 0.66 0.00 0.00 46.19 43.48 1xmw s LEU 148 CO -0.03 0.05 0.05 0.21 -1.89 0.00 0.00 176.35 174.74 1xmw s ASN 149 N -2.24 4.52 0.15 3.68 2.47 0.90 -2.46 114.94 121.96 1xmw s ASN 149 Ca 0.41 -1.95 0.15 0.00 0.42 0.00 0.00 52.86 51.89 1xmw s ASN 149 Cb -0.12 -1.39 -0.06 0.00 -1.45 0.00 0.00 41.25 38.22 1xmw s ASN 149 CO 0.22 -0.38 1.10 -0.07 -3.72 0.00 0.00 177.10 174.26 1xmw h LEU 150 N 7.76 0.00 0.00 3.21 3.38 -1.85 -2.73 115.31 125.08 1xmw h LEU 150 Ca -0.08 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.89 1xmw h LEU 150 Cb 1.02 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.77 1xmw h LEU 150 CO 0.50 0.58 0.00 0.61 0.09 0.00 0.00 178.44 180.22 1xmw n GLY 151 N 1.33 0.19 3.94 0.83 0.00 -1.26 -4.92 105.19 105.30 1xmw n GLY 151 Ca -0.04 -1.50 -0.25 0.00 0.00 0.00 0.00 46.02 44.22 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 2.21 0.14 1.61 3.01 -1.26 -1.99 119.74 123.46 1xmw s LYS 152 Ca 0.00 -0.35 0.22 0.00 -1.01 0.00 0.00 55.97 54.83 1xmw s LYS 152 Cb 0.00 -2.21 -0.09 0.00 -1.01 0.00 0.00 37.83 34.52 1xmw s LYS 152 CO 0.00 -1.19 0.90 2.89 0.51 0.00 0.00 175.35 178.46 1xmw n ARG 153 N -2.85 0.61 0.00 1.68 1.85 -1.25 -3.87 116.66 112.83 1xmw n ARG 153 Ca 0.08 0.04 0.09 0.00 -1.00 0.00 0.00 57.85 57.06 1xmw n ARG 153 Cb 0.60 -1.74 0.44 0.00 -1.05 0.00 0.00 32.46 30.71 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 -2.55 0.53 1.74 8.89 -0.00 -1.26 -2.80 119.36 123.91 1xmw n ILE 154 Ca -0.01 0.13 0.02 0.00 -0.00 0.00 0.00 62.75 62.90 1xmw n ILE 154 Cb 0.55 -0.83 0.10 0.00 -0.00 0.00 0.00 39.64 39.47 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 -1.34 1.19 -3.61 0.38 2.13 -1.25 -4.90 120.64 113.24 1xmw n GLU 155 Ca 0.08 -0.30 -0.24 0.00 0.66 0.00 0.00 57.16 57.36 1xmw n GLU 155 Cb 0.16 -1.10 0.04 0.00 0.27 0.00 0.00 31.44 30.81 1xmw n GLU 155 CO 0.00 0.00 0.00 -0.25 -0.41 0.00 0.00 177.13 176.47 1xmw n ASP 156 N -0.29 -3.84 -4.70 4.31 8.00 -1.12 -4.90 116.55 114.00 1xmw n ASP 156 Ca 0.04 -0.88 -0.42 0.00 0.71 0.00 0.00 54.79 54.24 1xmw n ASP 156 Cb 0.08 -3.98 -0.03 0.00 -0.02 0.00 0.00 41.12 37.17 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 -5.69 4.38 -0.14 -0.24 0.04 -1.26 -4.72 135.00 127.37 1xmw s PRO 157 Ca 0.28 1.80 -0.04 0.00 0.04 0.00 0.00 61.00 63.08 1xmw s PRO 157 Cb -0.08 -3.42 0.07 0.00 0.04 0.00 0.00 34.50 31.11 1xmw s PRO 157 CO 0.82 -0.36 0.25 -0.98 0.04 0.00 0.00 177.00 176.76 1xmw s ARG 158 N 1.54 0.15 0.00 4.56 1.70 -1.26 -2.09 118.95 123.55 1xmw s ARG 158 Ca 0.59 0.62 0.00 0.00 -0.47 0.00 0.00 55.73 56.47 1xmw s ARG 158 Cb -0.29 -0.29 0.00 0.00 -0.57 0.00 0.00 34.95 33.80 1xmw s ARG 158 CO 0.27 -0.37 0.00 0.41 -1.08 0.00 0.00 175.30 174.53 1xmw n GLY 159 N 5.34 2.21 3.25 3.88 0.00 -0.59 -1.93 105.19 117.36 1xmw n GLY 159 Ca -0.06 -0.65 -0.13 0.00 0.00 0.00 0.00 46.02 45.17 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 1.14 0.66 -0.10 1.61 1.75 -0.53 -0.11 119.30 123.71 1xmw s MET 160 Ca 0.00 -0.11 -0.05 0.00 -1.25 0.00 0.00 55.69 54.28 1xmw s MET 160 Cb 0.00 0.30 0.04 0.00 2.84 0.00 0.00 34.83 38.01 1xmw s MET 160 CO 0.00 -0.18 0.24 0.71 -0.65 0.00 0.00 175.02 175.14 1xmw s TYR 161 N -1.18 -0.31 0.22 4.11 2.02 -0.23 -2.36 117.35 119.62 1xmw s TYR 161 Ca -0.12 0.75 0.02 0.00 -0.37 0.00 0.00 57.07 57.35 1xmw s TYR 161 Cb -0.05 0.04 -0.04 0.00 -0.40 0.00 0.00 41.96 41.52 1xmw s TYR 161 CO 0.04 -0.22 0.38 -1.14 -1.57 0.00 0.00 175.55 173.04 1xmw s GLN 162 N 1.14 3.47 0.11 -0.62 0.74 -0.18 -2.28 119.66 122.05 1xmw s GLN 162 Ca -0.08 -0.52 0.00 0.00 0.05 0.00 0.00 55.36 54.81 1xmw s GLN 162 Cb -0.10 -2.86 -0.04 0.00 1.10 0.00 0.00 33.01 31.12 1xmw s GLN 162 CO -0.08 0.40 -0.01 0.00 -0.55 0.00 0.00 175.29 175.06 1xmw s GLY 164 N -3.05 2.72 0.34 0.00 0.00 -1.26 -1.61 107.32 104.46 1xmw s GLY 164 Ca 0.17 0.17 0.00 0.00 0.00 0.00 0.00 44.72 45.07 1xmw s GLY 164 CO -0.02 0.93 0.01 1.18 0.00 0.00 0.00 173.10 175.20 1xmw n GLU 165 N 2.71 1.14 0.03 2.90 -0.58 -0.84 -4.64 120.64 121.36 1xmw n GLU 165 Ca -0.05 -2.51 -0.05 0.00 -0.42 0.00 0.00 57.16 54.13 1xmw n GLU 165 Cb 0.50 0.71 -0.11 0.00 -0.57 0.00 0.00 31.44 31.98 1xmw n GLU 165 CO 0.00 0.00 0.00 -0.97 -0.48 0.00 0.00 177.13 175.68 1xmw h ASN 166 N 0.85 0.00 0.01 1.62 -0.73 -1.98 -3.39 115.58 111.95 1xmw h ASN 166 Ca -0.28 0.00 -0.36 0.00 1.87 0.00 0.00 56.30 57.53 1xmw h ASN 166 Cb 0.87 0.00 -0.05 0.00 0.27 0.00 0.00 38.32 39.40 1xmw h ASN 166 CO 0.47 0.87 -1.98 0.00 -0.37 0.00 0.00 177.43 176.42 1xmw n ALA 167 N -2.43 1.02 -2.07 1.57 0.00 -1.26 -5.08 120.51 112.26 1xmw n ALA 167 Ca -0.09 -0.82 0.00 0.00 0.00 0.00 0.00 53.44 52.53 1xmw n ALA 167 Cb 0.95 -0.21 0.00 0.00 0.00 0.00 0.00 19.45 20.19 1xmw n ALA 167 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 177.50 178.67 1xmw n LYS 168 N -4.25 0.00 -4.38 0.00 3.00 -1.26 -5.16 118.16 106.11 1xmw n LYS 168 Ca -0.44 0.00 -0.21 0.00 -0.00 0.00 0.00 58.31 57.66 1xmw n LYS 168 Cb 0.81 0.00 -0.16 0.00 0.00 0.00 0.00 35.03 35.69 1xmw n LYS 168 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.40 175.86 1xmw s SER 169 N 1.59 1.23 -0.04 3.14 1.04 -1.26 -1.98 113.70 117.42 1xmw s SER 169 Ca 0.00 -0.19 -0.06 0.00 0.48 0.00 0.00 55.95 56.18 1xmw s SER 169 Cb 0.00 -0.40 -0.04 0.00 0.10 0.00 0.00 66.02 65.68 1xmw s SER 169 CO 0.00 0.04 0.20 0.12 0.98 0.00 0.00 173.24 174.59 1xmw s PHE 170 N 0.35 3.58 -0.00 5.02 2.19 -0.64 -4.78 117.98 123.71 1xmw s PHE 170 Ca -0.06 0.51 0.01 0.00 0.33 0.00 0.00 56.93 57.72 1xmw s PHE 170 Cb -0.10 -1.93 -0.00 0.00 -1.31 0.00 0.00 43.02 39.67 1xmw s PHE 170 CO 0.01 0.67 -0.04 0.99 1.83 0.00 0.00 175.22 178.68 1xmw s THR 171 N -1.20 0.28 -0.00 0.12 2.01 -1.12 0.56 115.64 116.29 1xmw s THR 171 Ca 0.23 -0.17 0.01 0.00 0.31 0.00 0.00 61.69 62.08 1xmw s THR 171 Cb -0.13 -0.25 -0.00 0.00 0.01 0.00 0.00 72.50 72.13 1xmw s THR 171 CO 0.13 0.07 -0.05 -0.22 -0.69 0.00 0.00 174.62 173.86 1xmw s LEU 172 N -0.11 1.99 -0.26 4.42 0.20 -0.96 -2.02 118.68 121.94 1xmw s LEU 172 Ca 0.01 -0.09 0.03 0.00 0.69 0.00 0.00 54.13 54.77 1xmw s LEU 172 Cb -0.02 -0.25 0.06 0.00 -0.43 0.00 0.00 46.19 45.56 1xmw s LEU 172 CO -0.00 0.06 -0.09 -1.58 -0.29 0.00 0.00 176.35 174.44 1xmw s GLN 173 N -0.09 2.09 0.41 1.98 0.74 0.32 -1.07 119.66 124.05 1xmw s GLN 173 Ca 0.02 -1.32 -0.23 0.00 0.05 0.00 0.00 55.36 53.87 1xmw s GLN 173 Cb -0.02 -2.86 -0.10 0.00 1.10 0.00 0.00 33.01 31.13 1xmw s GLN 173 CO -0.00 -0.60 0.99 0.54 -0.55 0.00 0.00 175.29 175.67 1xmw s VAL 174 N 1.14 4.05 -0.33 1.34 0.11 0.84 -2.32 120.40 125.23 1xmw s VAL 174 Ca -0.07 1.45 0.00 0.00 -2.93 0.00 0.00 61.98 60.42 1xmw s VAL 174 Cb -0.20 -3.68 0.14 0.00 -1.53 0.00 0.00 36.38 31.10 1xmw s VAL 174 CO -0.05 -0.11 0.27 -0.47 -3.33 0.00 0.00 175.10 171.40 1xmw s TYR 175 N -1.87 0.02 -0.38 1.54 6.14 -0.57 -1.54 117.35 120.69 1xmw s TYR 175 Ca 0.59 -0.86 -0.20 0.00 0.64 0.00 0.00 57.07 57.24 1xmw s TYR 175 Cb -0.16 -0.64 0.01 0.00 0.42 0.00 0.00 41.96 41.59 1xmw s TYR 175 CO 0.21 -0.90 0.63 0.71 0.64 0.00 0.00 175.55 176.84 1xmw s TYR 176 N 1.71 3.13 0.00 4.97 1.51 -0.89 -2.36 117.35 125.43 1xmw s TYR 176 Ca 0.14 0.23 0.00 0.00 -1.01 0.00 0.00 57.07 56.42 1xmw s TYR 176 Cb -0.17 -3.19 0.00 0.00 -0.11 0.00 0.00 41.96 38.49 1xmw s TYR 176 CO -0.16 -0.69 0.00 0.54 -1.11 0.00 0.00 175.55 174.13 1xmw n ARG 177 N 6.09 -0.01 0.00 -0.62 1.74 0.15 -4.53 116.66 119.48 1xmw n ARG 177 Ca -0.02 0.01 0.13 0.00 -0.77 0.00 0.00 57.85 57.20 1xmw n ARG 177 Cb 0.48 -0.01 0.29 0.00 -1.02 0.00 0.00 32.46 32.20 1xmw n ARG 177 CO 0.00 0.00 0.00 -0.12 -1.52 0.00 0.00 177.63 175.99