#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 -6.95 -3.58 -2.24 2.03 -1.26 -5.03 116.55 99.52 1xmw n ASP 2 Ca 0.00 0.14 -0.23 0.00 0.52 0.00 0.00 54.79 55.22 1xmw n ASP 2 Cb 0.00 -3.96 -0.07 0.00 -0.72 0.00 0.00 41.12 36.37 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 -0.61 0.61 -3.08 -1.67 0.00 -1.26 -5.10 120.51 109.39 1xmw n ALA 3 Ca 0.01 -1.97 -0.45 0.00 0.00 0.00 0.00 53.44 51.03 1xmw n ALA 3 Cb 0.55 1.42 -0.05 0.00 0.00 0.00 0.00 19.45 21.37 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 -3.44 3.04 -0.19 0.00 2.02 -1.26 -4.86 118.70 114.01 1xmw s GLU 4 Ca 0.27 -1.34 0.16 0.00 0.02 0.00 0.00 54.97 54.08 1xmw s GLU 4 Cb 0.01 -4.24 0.55 0.00 0.10 0.00 0.00 34.13 30.55 1xmw s GLU 4 CO 0.19 -1.41 1.45 0.27 0.02 0.00 0.00 175.26 175.77 1xmw n ASN 5 N 6.00 3.95 -1.28 -0.19 6.94 -1.26 -4.59 115.26 124.83 1xmw n ASN 5 Ca -0.10 -3.05 -0.00 0.00 -0.02 0.00 0.00 54.58 51.41 1xmw n ASN 5 Cb 0.42 -0.56 0.17 0.00 -2.36 0.00 0.00 39.78 37.45 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 -0.47 1.51 -0.10 1.53 -5.35 -1.26 -4.88 119.36 110.34 1xmw n ILE 6 Ca 0.22 -0.74 0.00 0.00 -0.27 0.00 0.00 62.75 61.97 1xmw n ILE 6 Cb 0.92 -0.48 0.00 0.00 -1.74 0.00 0.00 39.64 38.34 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 0.16 2.20 -1.88 6.28 4.07 -1.26 -4.28 120.64 125.93 1xmw n GLU 7 Ca 0.17 0.00 -0.42 0.00 -0.06 0.00 0.00 57.16 56.85 1xmw n GLU 7 Cb 0.80 0.00 -0.03 0.00 -0.06 0.00 0.00 31.44 32.15 1xmw n GLU 7 CO 0.00 0.00 0.00 0.71 -0.06 0.00 0.00 177.13 177.78 1xmw s TYR 8 N 0.18 1.87 0.31 4.31 1.51 -1.26 -4.29 117.35 119.98 1xmw s TYR 8 Ca 0.00 0.01 -0.00 0.00 -1.01 0.00 0.00 57.07 56.07 1xmw s TYR 8 Cb 0.00 -4.04 -0.04 0.00 -0.11 0.00 0.00 41.96 37.78 1xmw s TYR 8 CO 0.00 -4.42 0.51 0.15 -1.11 0.00 0.00 175.55 170.68 1xmw s LYS 9 N 3.79 3.51 -0.05 -0.62 1.02 -0.65 -4.85 119.74 121.89 1xmw s LYS 9 Ca 0.78 -0.31 0.01 0.00 0.02 0.00 0.00 55.97 56.47 1xmw s LYS 9 Cb -0.38 -2.70 0.02 0.00 -0.52 0.00 0.00 37.83 34.25 1xmw s LYS 9 CO 0.34 0.21 -0.05 0.08 -0.92 0.00 0.00 175.35 175.02 1xmw s VAL 10 N -2.20 0.57 -0.35 3.17 1.01 -1.26 -1.87 120.40 119.47 1xmw s VAL 10 Ca 0.40 -0.13 0.01 0.00 0.00 0.00 0.00 61.98 62.26 1xmw s VAL 10 Cb -0.10 -0.60 0.14 0.00 0.00 0.00 0.00 36.38 35.82 1xmw s VAL 10 CO 0.34 0.24 0.25 -0.44 0.00 0.00 0.00 175.10 175.49 1xmw s SER 11 N 0.99 2.46 -0.00 3.32 0.01 -0.67 -5.00 113.70 114.81 1xmw s SER 11 Ca -0.10 -1.94 -0.18 0.00 1.31 0.00 0.00 55.95 55.05 1xmw s SER 11 Cb -0.14 -0.10 -0.06 0.00 0.21 0.00 0.00 66.02 65.93 1xmw s SER 11 CO -0.00 -0.30 0.50 -0.63 0.41 0.00 0.00 173.24 173.22 1xmw s ILE 12 N 1.26 4.95 -0.30 1.44 1.09 -1.26 -2.49 121.20 125.88 1xmw s ILE 12 Ca 0.17 1.04 0.02 0.00 -1.10 0.00 0.00 60.65 60.79 1xmw s ILE 12 Cb -0.20 -3.83 0.09 0.00 -1.06 0.00 0.00 42.46 37.46 1xmw s ILE 12 CO -0.03 0.49 0.02 -0.94 -0.10 0.00 0.00 174.94 174.39 1xmw s SER 13 N -0.59 4.36 1.38 3.58 1.04 -0.80 -4.93 113.70 117.74 1xmw s SER 13 Ca 0.27 -1.75 0.00 0.00 0.48 0.00 0.00 55.95 54.95 1xmw s SER 13 Cb -0.17 -1.34 0.00 0.00 0.10 0.00 0.00 66.02 64.61 1xmw s SER 13 CO 0.15 -0.34 0.00 0.61 0.98 0.00 0.00 173.24 174.64 1xmw n GLY 14 N 4.50 2.08 1.85 7.32 0.00 -1.26 -2.37 105.19 117.32 1xmw n GLY 14 Ca -0.03 -0.10 -0.21 0.00 0.00 0.00 0.00 46.02 45.69 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 2.84 -4.39 2.61 -1.04 -1.26 -4.82 114.28 108.22 1xmw n THR 15 Ca 0.00 -3.42 -0.25 0.00 -2.04 0.00 0.00 64.05 58.34 1xmw n THR 15 Cb 0.00 -0.89 -0.12 0.00 -1.82 0.00 0.00 70.33 67.50 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 -2.79 3.15 -0.17 8.00 0.15 -1.00 -1.21 113.70 119.83 1xmw s SER 16 Ca 0.53 -0.85 -0.05 0.00 0.70 0.00 0.00 55.95 56.28 1xmw s SER 16 Cb 0.44 -0.22 0.06 0.00 -1.71 0.00 0.00 66.02 64.59 1xmw s SER 16 CO 0.01 0.07 0.10 -0.69 1.20 0.00 0.00 173.24 173.94 1xmw s VAL 17 N -1.74 -0.12 -0.33 4.45 1.01 -0.80 -1.91 120.40 120.98 1xmw s VAL 17 Ca 0.18 -0.13 -0.09 0.00 0.00 0.00 0.00 61.98 61.95 1xmw s VAL 17 Cb -0.07 -0.56 0.01 0.00 0.00 0.00 0.00 36.38 35.76 1xmw s VAL 17 CO 0.08 -0.25 0.14 -0.70 0.00 0.00 0.00 175.10 174.37 1xmw s GLU 18 N 2.16 3.04 -0.17 2.72 -6.30 -1.04 0.46 118.70 119.58 1xmw s GLU 18 Ca 0.03 -0.91 -0.04 0.00 -2.50 0.00 0.00 54.97 51.55 1xmw s GLU 18 Cb -0.16 -3.54 -0.02 0.00 0.00 0.00 0.00 34.13 30.41 1xmw s GLU 18 CO -0.09 -0.53 -0.04 -0.51 0.02 0.00 0.00 175.26 174.11 1xmw s LEU 19 N 1.54 3.16 -0.40 2.70 1.43 -0.39 -1.67 118.68 125.05 1xmw s LEU 19 Ca 0.03 -0.20 -0.17 0.00 -1.03 0.00 0.00 54.13 52.76 1xmw s LEU 19 Cb -0.18 -1.77 0.01 0.00 0.03 0.00 0.00 46.19 44.28 1xmw s LEU 19 CO 0.05 0.12 0.45 -0.89 0.23 0.00 0.00 176.35 176.31 1xmw s THR 20 N 0.64 5.07 1.24 5.49 2.01 -0.78 0.13 115.64 129.43 1xmw s THR 20 Ca -0.02 -0.16 -0.18 0.00 0.31 0.00 0.00 61.69 61.64 1xmw s THR 20 Cb -0.14 -4.01 0.26 0.00 0.01 0.00 0.00 72.50 68.62 1xmw s THR 20 CO 0.02 -0.36 0.60 0.00 -0.69 0.00 0.00 174.62 174.19 1xmw n PRO 22 N -3.93 1.48 -4.19 0.00 -0.04 -1.26 -4.72 135.00 122.34 1xmw n PRO 22 Ca 0.07 -0.67 -0.15 0.00 -0.04 0.00 0.00 63.50 62.71 1xmw n PRO 22 Cb 0.53 -1.40 -0.08 0.00 -0.04 0.00 0.00 33.50 32.51 1xmw n PRO 22 CO 0.00 0.00 0.00 -0.48 -0.04 0.00 0.00 175.50 174.98 1xmw s LEU 23 N -0.68 1.26 0.00 1.53 2.34 -1.26 -4.98 118.68 116.89 1xmw s LEU 23 Ca 0.12 -1.49 -0.11 0.00 0.06 0.00 0.00 54.13 52.71 1xmw s LEU 23 Cb 0.10 0.77 0.15 0.00 -0.56 0.00 0.00 46.19 46.65 1xmw s LEU 23 CO 0.03 -1.03 0.86 0.47 -1.06 0.00 0.00 176.35 175.62 1xmw n ASP 24 N -0.94 0.02 -4.72 1.48 9.92 -1.26 -4.80 116.55 116.25 1xmw n ASP 24 Ca 0.03 -1.30 -0.42 0.00 -0.53 0.00 0.00 54.79 52.57 1xmw n ASP 24 Cb 0.63 -0.66 -0.03 0.00 -0.64 0.00 0.00 41.12 40.42 1xmw n ASP 24 CO 0.00 0.00 0.00 -0.94 0.13 0.00 0.00 177.20 176.39 1xmw s SER 25 N -4.15 6.90 -0.18 -2.24 1.04 -1.26 -4.43 113.70 109.38 1xmw s SER 25 Ca 0.49 2.24 -0.01 0.00 0.48 0.00 0.00 55.95 59.15 1xmw s SER 25 Cb -0.01 -2.58 -0.00 0.00 0.10 0.00 0.00 66.02 63.52 1xmw s SER 25 CO 0.34 -0.60 -0.12 -0.62 0.98 0.00 0.00 173.24 173.23 1xmw s ASP 26 N 1.07 3.84 0.60 7.02 -1.08 -1.25 -4.89 116.67 121.98 1xmw s ASP 26 Ca 0.63 -0.45 0.27 0.00 -0.52 0.00 0.00 52.55 52.48 1xmw s ASP 26 Cb -0.35 -1.62 1.20 0.00 -1.46 0.00 0.00 42.92 40.70 1xmw s ASP 26 CO 0.30 0.05 1.61 -0.33 0.52 0.00 0.00 175.17 177.32 1xmw h GLU 27 N 7.60 0.00 0.00 4.34 3.07 -1.95 1.02 114.58 128.65 1xmw h GLU 27 Ca -0.37 0.00 -0.04 0.00 -0.50 0.00 0.00 59.36 58.45 1xmw h GLU 27 Cb 1.17 0.00 -0.09 0.00 -0.84 0.00 0.00 28.75 28.99 1xmw h GLU 27 CO 0.59 0.00 -0.62 0.09 -1.40 0.00 0.00 179.01 177.67 1xmw n ASN 28 N -3.42 1.54 -4.63 1.42 3.02 -1.26 -5.00 115.26 106.92 1xmw n ASN 28 Ca 0.14 -3.43 -0.42 0.00 -0.03 0.00 0.00 54.58 50.84 1xmw n ASN 28 Cb 1.05 -0.47 -0.03 0.00 -0.61 0.00 0.00 39.78 39.72 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 -2.44 3.98 -0.30 3.41 2.96 0.35 -4.70 118.68 121.94 1xmw s LEU 29 Ca 0.37 2.29 -0.20 0.00 -0.22 0.00 0.00 54.13 56.37 1xmw s LEU 29 Cb 0.37 -3.52 -0.01 0.00 0.50 0.00 0.00 46.19 43.53 1xmw s LEU 29 CO -0.09 -1.47 0.62 -0.54 -1.32 0.00 0.00 176.35 173.54 1xmw s LYS 30 N 5.32 3.91 0.07 1.98 1.02 0.16 -4.52 119.74 127.68 1xmw s LYS 30 Ca 0.93 0.29 0.02 0.00 0.02 0.00 0.00 55.97 57.23 1xmw s LYS 30 Cb -0.38 -3.72 -0.04 0.00 -0.52 0.00 0.00 37.83 33.17 1xmw s LYS 30 CO 0.38 -0.55 0.12 -1.58 -0.92 0.00 0.00 175.35 172.80 1xmw s TRP 31 N 2.57 3.30 0.03 3.18 0.52 -1.26 -0.30 118.94 126.98 1xmw s TRP 31 Ca 0.25 0.14 0.05 0.00 0.02 0.00 0.00 56.10 56.55 1xmw s TRP 31 Cb -0.15 -1.67 -0.02 0.00 -1.15 0.00 0.00 33.47 30.48 1xmw s TRP 31 CO 0.11 0.55 -0.14 -2.00 0.02 0.00 0.00 176.95 175.49 1xmw s GLU 32 N -2.40 0.92 -0.02 4.98 2.12 0.35 -2.33 118.70 122.32 1xmw s GLU 32 Ca 0.31 -0.73 0.01 0.00 0.36 0.00 0.00 54.97 54.92 1xmw s GLU 32 Cb -0.12 -0.92 0.02 0.00 0.26 0.00 0.00 34.13 33.36 1xmw s GLU 32 CO 0.24 0.23 -0.02 -1.59 -0.54 0.00 0.00 175.26 173.58 1xmw s LYS 33 N -1.07 0.35 -1.20 4.30 -2.85 0.55 -2.10 119.74 117.71 1xmw s LYS 33 Ca 0.01 -0.01 0.00 0.00 -1.00 0.00 0.00 55.97 54.97 1xmw s LYS 33 Cb -0.08 -0.44 0.00 0.00 -2.06 0.00 0.00 37.83 35.25 1xmw s LYS 33 CO 0.01 -0.06 0.00 0.09 0.10 0.00 0.00 175.35 175.49 1xmw n ASN 34 N 3.73 -4.01 -0.16 0.03 3.02 0.63 -0.04 115.26 118.46 1xmw n ASN 34 Ca -0.22 0.20 -0.01 0.00 -0.03 0.00 0.00 54.58 54.52 1xmw n ASN 34 Cb 0.53 -3.46 -0.00 0.00 -0.61 0.00 0.00 39.78 36.24 1xmw n ASN 34 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1xmw n GLY 35 N -0.71 0.33 2.81 7.41 0.00 -1.26 -4.89 105.19 108.88 1xmw n GLY 35 Ca -0.15 -0.83 -0.16 0.00 0.00 0.00 0.00 46.02 44.87 1xmw n GLY 35 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1xmw s GLN 36 N -4.08 0.01 0.62 1.61 -0.21 0.94 -5.14 119.66 113.41 1xmw s GLN 36 Ca 0.00 0.43 -0.17 0.00 0.02 0.00 0.00 55.36 55.64 1xmw s GLN 36 Cb -0.00 -0.30 -0.02 0.00 1.00 0.00 0.00 33.01 33.69 1xmw s GLN 36 CO 0.00 -0.26 1.14 -2.00 -2.12 0.00 0.00 175.29 172.05 1xmw s GLU 37 N 1.86 2.94 -0.28 2.91 2.12 -1.26 -0.33 118.70 126.65 1xmw s GLU 37 Ca -0.01 1.58 -0.01 0.00 0.36 0.00 0.00 54.97 56.90 1xmw s GLU 37 Cb -0.12 -1.95 0.09 0.00 0.26 0.00 0.00 34.13 32.41 1xmw s GLU 37 CO -0.05 -1.17 0.06 -0.48 -0.54 0.00 0.00 175.26 173.08 1xmw s LEU 38 N -4.40 2.32 -1.21 2.70 0.05 -0.99 -4.86 118.68 112.29 1xmw s LEU 38 Ca 0.72 -1.48 -0.21 0.00 0.05 0.00 0.00 54.13 53.20 1xmw s LEU 38 Cb -0.24 -0.93 -0.05 0.00 -2.05 0.00 0.00 46.19 42.92 1xmw s LEU 38 CO 0.35 -0.37 1.89 -0.81 -0.55 0.00 0.00 176.35 176.86 1xmw n PRO 39 N 4.81 2.03 0.15 1.48 -0.04 -1.26 -3.85 135.00 138.31 1xmw n PRO 39 Ca -0.04 -2.67 0.00 0.00 -0.04 0.00 0.00 63.50 60.75 1xmw n PRO 39 Cb 0.43 -3.65 0.00 0.00 -0.04 0.00 0.00 33.50 30.24 1xmw n PRO 39 CO 0.00 0.00 0.00 0.94 -0.04 0.00 0.00 175.50 176.40 1xmw n GLN 40 N 8.26 0.00 -2.78 0.54 7.27 -1.26 -5.04 117.38 124.37 1xmw n GLN 40 Ca 0.46 0.00 -0.43 0.00 0.07 0.00 0.00 57.00 57.10 1xmw n GLN 40 Cb 0.46 0.00 -0.03 0.00 2.41 0.00 0.00 30.24 33.09 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 -1.95 3.62 -0.29 3.69 2.20 -1.25 -4.79 119.74 120.97 1xmw s LYS 41 Ca 0.00 -1.56 0.12 0.00 -0.36 0.00 0.00 55.97 54.17 1xmw s LYS 41 Cb 0.00 -5.11 0.79 0.00 -1.51 0.00 0.00 37.83 32.01 1xmw s LYS 41 CO 0.00 -1.95 1.79 -2.39 -0.36 0.00 0.00 175.35 172.44 1xmw n HIS 42 N 7.44 2.33 -3.21 4.03 1.44 -1.26 -4.54 115.22 121.45 1xmw n HIS 42 Ca 0.28 -0.98 -0.24 0.00 -2.01 0.00 0.00 57.72 54.77 1xmw n HIS 42 Cb 0.49 -0.62 -0.01 0.00 0.12 0.00 0.00 29.99 29.98 1xmw n HIS 42 CO 0.00 0.00 0.00 -0.51 -2.81 0.00 0.00 176.34 173.02 1xmw s ASP 43 N -0.90 6.24 0.33 4.39 1.01 -1.26 -3.94 116.67 122.54 1xmw s ASP 43 Ca 0.55 0.51 0.08 0.00 0.71 0.00 0.00 52.55 54.40 1xmw s ASP 43 Cb 0.43 -2.02 0.79 0.00 1.01 0.00 0.00 42.92 43.14 1xmw s ASP 43 CO 0.15 -0.39 1.80 0.07 0.21 0.00 0.00 175.17 177.02 1xmw h LYS 44 N 0.62 0.70 -6.54 8.23 2.10 -1.87 -3.41 116.57 116.40 1xmw h LYS 44 Ca -0.49 -0.04 -0.47 0.00 -2.00 0.00 0.00 60.65 57.64 1xmw h LYS 44 Cb 1.22 -0.16 0.01 0.00 -0.90 0.00 0.00 32.23 32.40 1xmw h LYS 44 CO 0.61 0.46 -0.18 -3.38 -2.00 0.00 0.00 179.45 174.97 1xmw s HIS 45 N -5.77 3.50 -0.43 0.07 -3.43 -1.26 -1.62 115.29 106.35 1xmw s HIS 45 Ca -0.11 0.37 0.03 0.00 -0.80 0.00 0.00 55.06 54.56 1xmw s HIS 45 Cb 0.24 -1.92 0.12 0.00 -1.43 0.00 0.00 32.58 29.59 1xmw s HIS 45 CO 0.80 0.10 0.18 -1.17 -2.00 0.00 0.00 174.74 172.64 1xmw s LEU 46 N -4.34 4.00 -0.01 5.38 2.96 0.35 -4.81 118.68 122.20 1xmw s LEU 46 Ca 0.40 -2.57 -0.27 0.00 -0.22 0.00 0.00 54.13 51.48 1xmw s LEU 46 Cb -0.10 -1.47 -0.04 0.00 0.50 0.00 0.00 46.19 45.09 1xmw s LEU 46 CO 0.36 -0.30 0.83 -0.69 -1.32 0.00 0.00 176.35 175.24 1xmw s VAL 47 N 0.35 4.90 -0.35 1.68 1.01 -1.24 -1.26 120.40 125.49 1xmw s VAL 47 Ca 0.15 1.75 0.01 0.00 0.00 0.00 0.00 61.98 63.88 1xmw s VAL 47 Cb -0.23 -4.18 0.09 0.00 0.00 0.00 0.00 36.38 32.07 1xmw s VAL 47 CO -0.05 0.24 0.09 -0.76 0.00 0.00 0.00 175.10 174.62 1xmw s LEU 48 N 0.70 4.72 0.40 3.92 1.43 0.17 -4.86 118.68 125.16 1xmw s LEU 48 Ca 0.44 -1.92 -0.25 0.00 -1.03 0.00 0.00 54.13 51.37 1xmw s LEU 48 Cb -0.20 -1.71 -0.09 0.00 0.03 0.00 0.00 46.19 44.23 1xmw s LEU 48 CO 0.23 -0.41 1.09 0.00 0.23 0.00 0.00 176.35 177.49 1xmw s GLN 49 N 1.06 4.14 -1.22 1.70 0.00 -1.26 -1.90 119.66 122.18 1xmw s GLN 49 Ca 0.06 1.62 -0.11 0.00 -0.00 0.00 0.00 55.36 56.93 1xmw s GLN 49 Cb -0.21 -2.60 -0.01 0.00 0.00 0.00 0.00 33.01 30.19 1xmw s GLN 49 CO -0.05 -0.19 0.71 -3.47 0.00 0.00 0.00 175.29 172.29 1xmw n ASP 50 N 0.01 -3.54 -4.55 12.60 2.03 -0.68 -4.79 116.55 117.63 1xmw n ASP 50 Ca 0.05 -0.95 -0.34 0.00 0.52 0.00 0.00 54.79 54.06 1xmw n ASP 50 Cb 0.48 -3.58 -0.04 0.00 -0.72 0.00 0.00 41.12 37.26 1xmw n ASP 50 CO 0.00 0.00 0.00 0.12 -1.92 0.00 0.00 177.20 175.40 1xmw s PHE 51 N -3.60 1.70 -0.50 -0.67 5.36 -0.35 -4.93 117.98 114.99 1xmw s PHE 51 Ca 0.28 0.75 -0.28 0.00 -0.96 0.00 0.00 56.93 56.72 1xmw s PHE 51 Cb -0.09 -4.06 0.03 0.00 -0.34 0.00 0.00 43.02 38.56 1xmw s PHE 51 CO 0.85 -2.11 1.12 -1.12 -1.46 0.00 0.00 175.22 172.50 1xmw s SER 52 N 8.16 6.57 0.56 6.13 0.01 -1.26 -4.23 113.70 129.64 1xmw s SER 52 Ca 0.69 0.33 0.32 0.00 1.31 0.00 0.00 55.95 58.59 1xmw s SER 52 Cb -0.11 -2.54 1.45 0.00 0.21 0.00 0.00 66.02 65.04 1xmw s SER 52 CO 0.13 -1.28 1.81 1.05 0.41 0.00 0.00 173.24 175.35 1xmw h GLU 53 N 9.29 0.00 0.70 12.44 4.11 -1.84 1.18 114.58 140.44 1xmw h GLU 53 Ca -0.24 0.00 -0.03 0.00 0.07 0.00 0.00 59.36 59.16 1xmw h GLU 53 Cb 1.06 0.00 0.01 0.00 0.50 0.00 0.00 28.75 30.32 1xmw h GLU 53 CO 1.13 0.00 -0.33 0.28 0.07 0.00 0.00 179.01 180.15 1xmw h VAL 54 N 0.00 0.00 0.00 -1.06 2.07 -1.90 -3.14 116.25 112.22 1xmw h VAL 54 Ca 0.41 -0.03 -0.18 0.00 0.82 0.00 0.00 66.70 67.72 1xmw h VAL 54 Cb 1.83 0.00 -0.03 0.00 -1.52 0.00 0.00 31.29 31.57 1xmw h VAL 54 CO -0.00 0.00 -1.93 1.21 0.02 0.00 0.00 177.57 176.87 1xmw n GLU 55 N -4.59 1.16 0.12 1.57 2.13 -0.90 -4.48 120.64 115.66 1xmw n GLU 55 Ca -0.12 -0.06 -0.03 0.00 0.66 0.00 0.00 57.16 57.62 1xmw n GLU 55 Cb 0.37 -1.39 0.16 0.00 0.27 0.00 0.00 31.44 30.86 1xmw n GLU 55 CO 0.00 0.00 0.00 0.22 -0.41 0.00 0.00 177.13 176.94 1xmw h ASP 56 N 0.00 0.11 -3.63 4.31 1.82 0.12 -3.44 116.42 115.71 1xmw h ASP 56 Ca -0.26 -0.06 -0.53 0.00 -0.39 0.00 0.00 57.03 55.79 1xmw h ASP 56 Cb 1.50 -0.03 0.06 0.00 0.68 0.00 0.00 39.33 41.54 1xmw h ASP 56 CO 0.01 0.68 0.70 -0.55 -1.61 0.00 0.00 179.24 178.47 1xmw s SER 57 N -6.87 6.70 0.00 2.28 0.15 -1.13 -4.88 113.70 109.95 1xmw s SER 57 Ca -0.02 2.69 0.00 0.00 0.70 0.00 0.00 55.95 59.31 1xmw s SER 57 Cb 0.13 -2.64 0.00 0.00 -1.71 0.00 0.00 66.02 61.80 1xmw s SER 57 CO 0.77 -0.63 0.00 0.61 1.20 0.00 0.00 173.24 175.19 1xmw n GLY 58 N 1.49 -0.60 3.93 9.45 0.00 -1.03 -4.92 105.19 113.51 1xmw n GLY 58 Ca 0.03 -0.59 -0.26 0.00 0.00 0.00 0.00 46.02 45.21 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 3.44 -0.05 1.61 1.51 -1.26 -0.82 117.35 117.78 1xmw s TYR 59 Ca 0.00 0.09 -0.02 0.00 -1.01 0.00 0.00 57.07 56.13 1xmw s TYR 59 Cb 0.00 -1.64 0.04 0.00 -0.11 0.00 0.00 41.96 40.25 1xmw s TYR 59 CO 0.00 0.51 0.09 0.71 -1.11 0.00 0.00 175.55 175.76 1xmw s TYR 60 N -1.76 -0.06 0.01 2.71 2.02 0.26 -0.27 117.35 120.26 1xmw s TYR 60 Ca 0.34 0.36 -0.03 0.00 -0.37 0.00 0.00 57.07 57.37 1xmw s TYR 60 Cb -0.11 -0.27 -0.01 0.00 -0.40 0.00 0.00 41.96 41.18 1xmw s TYR 60 CO 0.28 -0.17 0.04 0.54 -1.57 0.00 0.00 175.55 174.67 1xmw s VAL 61 N 1.64 0.08 -0.02 0.71 0.11 -0.89 0.10 120.40 122.13 1xmw s VAL 61 Ca -0.03 -0.67 -0.02 0.00 -2.93 0.00 0.00 61.98 58.32 1xmw s VAL 61 Cb -0.12 -0.29 0.00 0.00 -1.53 0.00 0.00 36.38 34.44 1xmw s VAL 61 CO -0.04 -0.37 0.06 0.00 -3.33 0.00 0.00 175.10 171.41 1xmw s TYR 63 N -0.25 0.32 0.22 0.00 -0.85 0.58 -4.31 117.35 113.07 1xmw s TYR 63 Ca -0.03 -0.85 0.00 0.00 -0.52 0.00 0.00 57.07 55.67 1xmw s TYR 63 Cb -0.02 0.57 -0.04 0.00 0.38 0.00 0.00 41.96 42.85 1xmw s TYR 63 CO 0.00 -1.40 0.16 0.99 -1.52 0.00 0.00 175.55 173.77 1xmw s THR 64 N -2.76 0.01 0.28 -3.49 2.01 -1.19 0.40 115.64 110.90 1xmw s THR 64 Ca 0.19 -2.00 0.23 0.00 0.31 0.00 0.00 61.69 60.42 1xmw s THR 64 Cb -0.04 -2.50 0.22 0.00 0.01 0.00 0.00 72.50 70.19 1xmw s THR 64 CO 0.13 0.00 1.91 1.55 -0.69 0.00 0.00 174.62 177.52 1xmw h PRO 65 N 2.53 0.00 0.00 4.92 0.13 -1.96 -2.82 132.00 134.80 1xmw h PRO 65 Ca -0.34 0.00 -0.22 0.00 -0.87 0.00 0.00 66.00 64.57 1xmw h PRO 65 Cb 1.25 0.00 -0.04 0.00 0.13 0.00 0.00 31.00 32.34 1xmw h PRO 65 CO 0.50 0.23 -2.02 0.00 -0.23 0.00 0.00 178.00 176.48 1xmw n ALA 66 N -2.29 1.96 -2.67 -0.56 0.00 -1.26 -4.86 120.51 110.84 1xmw n ALA 66 Ca -0.01 -0.90 -0.39 0.00 0.00 0.00 0.00 53.44 52.14 1xmw n ALA 66 Cb 0.36 -0.55 -0.07 0.00 0.00 0.00 0.00 19.45 19.20 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 -5.31 6.54 1.06 0.00 1.04 -1.06 -5.05 113.70 110.91 1xmw s SER 67 Ca -0.08 0.65 -0.18 0.00 0.48 0.00 0.00 55.95 56.82 1xmw s SER 67 Cb 0.09 -2.28 0.10 0.00 0.10 0.00 0.00 66.02 64.03 1xmw s SER 67 CO 0.85 -0.14 -0.07 -3.20 0.98 0.00 0.00 173.24 171.66 1xmw n ASN 68 N 4.60 -2.70 -4.73 7.02 2.85 -1.26 -3.14 115.26 117.89 1xmw n ASN 68 Ca -0.06 -0.22 -0.37 0.00 -0.11 0.00 0.00 54.58 53.82 1xmw n ASN 68 Cb 0.51 -0.82 0.06 0.00 1.24 0.00 0.00 39.78 40.77 1xmw n ASN 68 CO 0.00 0.00 0.00 -0.54 -2.11 0.00 0.00 177.26 174.61 1xmw s LYS 69 N -3.27 2.60 0.31 1.20 -0.14 -1.26 -4.47 119.74 114.70 1xmw s LYS 69 Ca 0.46 2.02 0.09 0.00 -1.36 0.00 0.00 55.97 57.18 1xmw s LYS 69 Cb -0.07 -1.86 -0.05 0.00 -1.68 0.00 0.00 37.83 34.18 1xmw s LYS 69 CO 0.53 -1.55 0.05 -0.80 -0.76 0.00 0.00 175.35 172.82 1xmw s ASN 70 N -1.44 4.47 0.68 2.83 -0.87 -1.26 -5.05 114.94 114.30 1xmw s ASN 70 Ca 0.82 -0.79 -0.11 0.00 -1.57 0.00 0.00 52.86 51.20 1xmw s ASN 70 Cb -0.36 -0.71 -0.00 0.00 -0.02 0.00 0.00 41.25 40.16 1xmw s ASN 70 CO 0.39 -0.17 1.06 0.28 -2.57 0.00 0.00 177.10 176.08 1xmw s THR 71 N -2.42 4.09 0.34 1.60 -1.32 -1.26 -4.83 115.64 111.84 1xmw s THR 71 Ca 0.35 0.70 -0.02 0.00 -1.21 0.00 0.00 61.69 61.50 1xmw s THR 71 Cb -0.03 -3.45 -0.04 0.00 -1.51 0.00 0.00 72.50 67.47 1xmw s THR 71 CO 0.21 -0.87 0.58 -0.31 -2.21 0.00 0.00 174.62 172.01 1xmw s TYR 72 N -3.02 3.50 -0.08 9.09 1.51 -0.96 -4.49 117.35 122.91 1xmw s TYR 72 Ca 0.58 0.52 0.01 0.00 -1.01 0.00 0.00 57.07 57.17 1xmw s TYR 72 Cb -0.14 -2.03 0.02 0.00 -0.11 0.00 0.00 41.96 39.71 1xmw s TYR 72 CO 0.54 0.10 -0.08 -1.17 -1.11 0.00 0.00 175.55 173.83 1xmw s LEU 73 N -4.04 1.29 -0.81 -1.29 0.20 0.11 0.12 118.68 114.26 1xmw s LEU 73 Ca 0.42 -0.24 -0.22 0.00 0.69 0.00 0.00 54.13 54.78 1xmw s LEU 73 Cb -0.10 -0.71 0.08 0.00 -0.43 0.00 0.00 46.19 45.02 1xmw s LEU 73 CO 0.35 -0.07 1.15 -0.47 -0.29 0.00 0.00 176.35 177.02 1xmw s TYR 74 N 1.26 2.70 -0.33 5.38 6.14 -0.03 0.89 117.35 133.36 1xmw s TYR 74 Ca -0.04 -0.74 -0.21 0.00 0.64 0.00 0.00 57.07 56.72 1xmw s TYR 74 Cb -0.14 -4.42 -0.00 0.00 0.42 0.00 0.00 41.96 37.82 1xmw s TYR 74 CO -0.03 -1.73 0.65 -1.17 0.64 0.00 0.00 175.55 173.91 1xmw s LEU 75 N 4.15 4.19 -0.33 6.97 2.96 -0.00 -0.82 118.68 135.80 1xmw s LEU 75 Ca 0.31 0.32 0.01 0.00 -0.22 0.00 0.00 54.13 54.55 1xmw s LEU 75 Cb -0.09 -2.83 0.10 0.00 0.50 0.00 0.00 46.19 43.87 1xmw s LEU 75 CO 0.02 -0.55 0.09 -0.75 -1.32 0.00 0.00 176.35 173.84 1xmw s LYS 76 N 2.71 0.98 0.34 1.98 2.20 -0.92 -2.47 119.74 124.55 1xmw s LYS 76 Ca 0.26 -1.37 0.04 0.00 -0.36 0.00 0.00 55.97 54.54 1xmw s LYS 76 Cb -0.15 -2.37 -0.06 0.00 -1.51 0.00 0.00 37.83 33.74 1xmw s LYS 76 CO 0.13 -0.98 0.06 0.00 -0.36 0.00 0.00 175.35 174.20 1xmw s ALA 77 N 1.32 2.49 -0.11 3.13 0.00 -1.26 0.43 121.76 127.76 1xmw s ALA 77 Ca 0.11 -2.01 -0.01 0.00 0.00 0.00 0.00 51.96 50.04 1xmw s ALA 77 Cb -0.18 0.61 0.03 0.00 0.00 0.00 0.00 23.12 23.58 1xmw s ALA 77 CO -0.19 -0.29 -0.03 0.50 0.00 0.00 0.00 175.76 175.75 1xmw s ARG 78 N -3.87 1.07 -0.15 0.00 3.52 -1.26 -4.25 118.95 114.02 1xmw s ARG 78 Ca 0.35 -0.17 -0.04 0.00 -0.13 0.00 0.00 55.73 55.74 1xmw s ARG 78 Cb 0.08 -1.47 0.07 0.00 -1.56 0.00 0.00 34.95 32.07 1xmw s ARG 78 CO 0.16 -0.35 0.23 0.14 -0.81 0.00 0.00 175.30 174.67 1xmw s VAL 79 N 1.81 -0.36 0.00 7.11 -7.23 -1.26 -5.03 120.40 115.44 1xmw s VAL 79 Ca 0.04 0.15 0.00 0.00 -1.81 0.00 0.00 61.98 60.35 1xmw s VAL 79 Cb -0.13 -0.51 0.00 0.00 0.56 0.00 0.00 36.38 36.30 1xmw s VAL 79 CO -0.07 0.00 0.00 0.61 -0.31 0.00 0.00 175.10 175.33 1xmw n GLY 80 N 5.34 4.61 3.68 2.32 0.00 -1.26 -4.70 105.19 115.17 1xmw n GLY 80 Ca -0.05 -1.16 -0.30 0.00 0.00 0.00 0.00 46.02 44.51 1xmw n GLY 80 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1xmw s SER 81 N 0.00 3.08 0.02 1.61 0.01 -1.26 -5.05 113.70 112.11 1xmw s SER 81 Ca 0.00 1.92 -0.02 0.00 1.31 0.00 0.00 55.95 59.16 1xmw s SER 81 Cb 0.00 -2.47 -0.02 0.00 0.21 0.00 0.00 66.02 63.74 1xmw s SER 81 CO 0.00 -2.96 0.01 0.00 0.41 0.00 0.00 173.24 170.71 1xmw s ALA 82 N -2.72 0.07 0.15 1.44 0.00 -1.26 -4.95 121.76 114.49 1xmw s ALA 82 Ca 0.65 -0.58 -0.10 0.00 0.00 0.00 0.00 51.96 51.93 1xmw s ALA 82 Cb -0.21 0.17 -0.00 0.00 0.00 0.00 0.00 23.12 23.08 1xmw s ALA 82 CO 0.58 -0.21 0.30 0.34 0.00 0.00 0.00 175.76 176.77 1xmw s ASP 83 N -1.68 0.01 -0.52 0.00 2.15 -1.26 -5.09 116.67 110.28 1xmw s ASP 83 Ca -0.12 -0.77 0.07 0.00 0.43 0.00 0.00 52.55 52.16 1xmw s ASP 83 Cb -0.07 0.44 0.34 0.00 -0.30 0.00 0.00 42.92 43.33 1xmw s ASP 83 CO -0.02 -0.88 0.87 -0.67 -0.17 0.00 0.00 175.17 174.30 1xmw n ASP 84 N -0.20 3.34 -1.60 -0.34 2.03 -1.26 -4.77 116.55 113.75 1xmw n ASP 84 Ca -0.09 -3.47 -0.04 0.00 0.52 0.00 0.00 54.79 51.71 1xmw n ASP 84 Cb 0.63 -0.58 0.02 0.00 -0.72 0.00 0.00 41.12 40.46 1xmw n ASP 84 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 1xmw n ALA 85 N -0.03 2.21 -3.83 -1.67 0.00 -1.26 -4.99 120.51 110.94 1xmw n ALA 85 Ca 0.29 -0.65 -0.26 0.00 0.00 0.00 0.00 53.44 52.83 1xmw n ALA 85 Cb 0.47 -0.52 0.02 0.00 0.00 0.00 0.00 19.45 19.43 1xmw n ALA 85 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 177.50 178.67 1xmw n LYS 86 N -0.56 -4.96 -3.50 0.00 3.00 -1.26 -4.97 118.16 105.90 1xmw n LYS 86 Ca -0.18 0.58 -0.07 0.00 -0.00 0.00 0.00 58.31 58.64 1xmw n LYS 86 Cb 0.69 -5.24 -0.08 0.00 0.00 0.00 0.00 35.03 30.40 1xmw n LYS 86 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 177.40 177.61 1xmw s LYS 87 N -6.32 0.38 0.30 1.64 2.47 -1.26 -5.16 119.74 111.78 1xmw s LYS 87 Ca 0.29 0.90 -0.08 0.00 -1.56 0.00 0.00 55.97 55.52 1xmw s LYS 87 Cb -0.15 0.13 0.03 0.00 -1.46 0.00 0.00 37.83 36.39 1xmw s LYS 87 CO 0.83 -0.42 0.54 -3.47 0.16 0.00 0.00 175.35 173.00 1xmw n ASP 88 N 5.39 -1.56 -0.03 1.43 -0.08 -1.26 -4.62 116.55 115.82 1xmw n ASP 88 Ca -0.06 -2.33 -0.13 0.00 -1.51 0.00 0.00 54.79 50.76 1xmw n ASP 88 Cb 0.50 2.68 -0.01 0.00 2.34 0.00 0.00 41.12 46.62 1xmw n ASP 88 CO 0.00 0.00 0.00 0.00 0.12 0.00 0.00 177.20 177.32 1xmw h ALA 89 N 1.97 0.51 -2.70 -1.67 0.00 -2.00 -3.41 119.26 111.95 1xmw h ALA 89 Ca -0.25 -0.55 -0.64 0.00 0.00 0.00 0.00 54.91 53.48 1xmw h ALA 89 Cb 0.96 -0.06 -0.15 0.00 0.00 0.00 0.00 17.79 18.53 1xmw h ALA 89 CO 0.32 0.69 -0.26 0.00 0.00 0.00 0.00 179.25 180.00 1xmw s ALA 90 N -3.94 3.54 -0.27 0.00 0.00 -1.26 -5.05 121.76 114.78 1xmw s ALA 90 Ca -0.09 -0.93 -0.13 0.00 0.00 0.00 0.00 51.96 50.82 1xmw s ALA 90 Cb 0.10 -2.73 -0.04 0.00 0.00 0.00 0.00 23.12 20.45 1xmw s ALA 90 CO 0.87 -0.75 0.27 0.15 0.00 0.00 0.00 175.76 176.30 1xmw s LYS 91 N 2.05 3.99 -0.77 0.00 1.02 -1.26 -5.00 119.74 119.77 1xmw s LYS 91 Ca 0.14 -0.15 -0.26 0.00 0.02 0.00 0.00 55.97 55.73 1xmw s LYS 91 Cb -0.16 -3.65 -0.09 0.00 -0.52 0.00 0.00 37.83 33.42 1xmw s LYS 91 CO 0.11 -0.20 2.20 0.21 -0.92 0.00 0.00 175.35 176.74 1xmw s LYS 92 N 1.82 2.09 -0.55 1.68 2.36 -1.26 -4.85 119.74 121.03 1xmw s LYS 92 Ca 0.11 0.35 0.04 0.00 -2.55 0.00 0.00 55.97 53.92 1xmw s LYS 92 Cb -0.16 -4.81 0.14 0.00 -1.05 0.00 0.00 37.83 31.96 1xmw s LYS 92 CO 0.10 -3.76 0.32 -0.51 1.55 0.00 0.00 175.35 173.05 1xmw s ASP 93 N 9.80 4.14 -0.16 1.43 1.01 -1.26 -4.91 116.67 126.72 1xmw s ASP 93 Ca 0.83 -3.16 -0.10 0.00 0.71 0.00 0.00 52.55 50.83 1xmw s ASP 93 Cb -0.11 -1.43 -0.07 0.00 1.01 0.00 0.00 42.92 42.32 1xmw s ASP 93 CO 0.09 -0.20 -0.24 -0.67 0.21 0.00 0.00 175.17 174.36 1xmw n ASP 94 N 2.88 1.45 -2.18 0.27 2.03 -1.26 -4.98 116.55 114.76 1xmw n ASP 94 Ca 0.11 0.24 -0.13 0.00 0.52 0.00 0.00 54.79 55.54 1xmw n ASP 94 Cb 0.34 -0.58 -0.02 0.00 -0.72 0.00 0.00 41.12 40.15 1xmw n ASP 94 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 1xmw n ALA 95 N -3.95 -0.63 -2.42 -1.67 0.00 -1.26 -4.93 120.51 105.65 1xmw n ALA 95 Ca -0.28 0.13 -0.31 0.00 0.00 0.00 0.00 53.44 52.98 1xmw n ALA 95 Cb 0.63 -1.51 -0.04 0.00 0.00 0.00 0.00 19.45 18.53 1xmw n ALA 95 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 177.50 177.71 1xmw s LYS 96 N -4.57 3.74 0.15 0.00 2.20 -1.26 -5.09 119.74 114.92 1xmw s LYS 96 Ca 0.00 0.21 -0.20 0.00 -0.36 0.00 0.00 55.97 55.62 1xmw s LYS 96 Cb 0.00 -2.61 0.05 0.00 -1.51 0.00 0.00 37.83 33.77 1xmw s LYS 96 CO 0.00 0.23 0.53 0.21 -0.36 0.00 0.00 175.35 175.96 1xmw s LYS 97 N -3.21 1.23 0.04 4.03 2.47 -1.26 -5.18 119.74 117.85 1xmw s LYS 97 Ca 0.47 -0.59 -0.14 0.00 -1.56 0.00 0.00 55.97 54.15 1xmw s LYS 97 Cb -0.11 0.54 0.02 0.00 -1.46 0.00 0.00 37.83 36.83 1xmw s LYS 97 CO 0.25 -0.52 0.30 0.34 0.16 0.00 0.00 175.35 175.89 1xmw s ASP 98 N -2.78 -0.12 0.45 1.43 2.15 -1.26 -5.16 116.67 111.38 1xmw s ASP 98 Ca 0.02 -0.18 -0.15 0.00 0.43 0.00 0.00 52.55 52.67 1xmw s ASP 98 Cb -0.00 0.35 -0.08 0.00 -0.30 0.00 0.00 42.92 42.90 1xmw s ASP 98 CO -0.11 -0.61 0.88 -1.81 -0.17 0.00 0.00 175.17 173.35 1xmw s ASP 99 N -2.03 6.63 0.44 -0.34 1.01 -1.26 -5.08 116.67 116.04 1xmw s ASP 99 Ca -0.05 1.39 0.02 0.00 0.71 0.00 0.00 52.55 54.62 1xmw s ASP 99 Cb -0.01 -2.43 -0.01 0.00 1.01 0.00 0.00 42.92 41.48 1xmw s ASP 99 CO -0.03 -0.46 0.08 0.00 0.21 0.00 0.00 175.17 174.97 1xmw n ALA 100 N -1.28 0.51 -0.19 5.23 0.00 -1.26 -5.11 120.51 118.40 1xmw n ALA 100 Ca 0.05 -2.13 0.00 0.00 0.00 0.00 0.00 53.44 51.36 1xmw n ALA 100 Cb 0.54 1.31 0.00 0.00 0.00 0.00 0.00 19.45 21.30 1xmw n ALA 100 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 1xmw n LYS 101 N -1.05 0.00 -3.26 0.00 5.02 -1.26 -5.01 118.16 112.59 1xmw n LYS 101 Ca -0.12 0.00 -0.25 0.00 -2.02 0.00 0.00 58.31 55.92 1xmw n LYS 101 Cb 0.62 0.00 -0.07 0.00 -0.02 0.00 0.00 35.03 35.55 1xmw n LYS 101 CO 0.00 0.00 0.00 1.17 -0.52 0.00 0.00 177.40 178.05 1xmw n LYS 102 N -2.21 1.13 -2.67 1.97 0.00 -1.26 -5.11 118.16 110.01 1xmw n LYS 102 Ca 0.00 -3.58 -0.31 0.00 0.00 0.00 0.00 58.31 54.42 1xmw n LYS 102 Cb 0.00 -1.49 -0.03 0.00 0.00 0.00 0.00 35.03 33.50 1xmw n LYS 102 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.40 177.74 1xmw s ASP 103 N -1.43 6.56 0.00 3.14 -1.08 -1.26 -4.63 116.67 117.97 1xmw s ASP 103 Ca 0.36 1.31 0.00 0.00 -0.52 0.00 0.00 52.55 53.70 1xmw s ASP 103 Cb 0.16 -2.40 0.00 0.00 -1.46 0.00 0.00 42.92 39.22 1xmw s ASP 103 CO -0.09 -0.47 0.00 0.61 0.52 0.00 0.00 175.17 175.73 1xmw n GLY 104 N -1.40 1.32 2.26 2.66 0.00 -1.26 -5.14 105.19 103.63 1xmw n GLY 104 Ca 0.04 -0.04 -0.18 0.00 0.00 0.00 0.00 46.02 45.85 1xmw n GLY 104 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 1xmw n SER 105 N 0.00 -0.28 -4.32 1.61 7.64 -1.26 -5.10 113.62 111.91 1xmw n SER 105 Ca 0.00 -1.21 -0.17 0.00 1.01 0.00 0.00 58.87 58.50 1xmw n SER 105 Cb 0.00 -0.61 -0.10 0.00 -1.01 0.00 0.00 64.21 62.49 1xmw n SER 105 CO 0.00 0.00 0.00 -1.58 -3.01 0.00 0.00 175.04 170.45 1xmw s GLN 106 N -4.68 1.26 0.88 1.43 0.74 -1.26 -5.15 119.66 112.88 1xmw s GLN 106 Ca 0.44 -1.57 -0.13 0.00 0.05 0.00 0.00 55.36 54.15 1xmw s GLN 106 Cb -0.02 -0.92 0.15 0.00 1.10 0.00 0.00 33.01 33.32 1xmw s GLN 106 CO 0.32 0.11 1.24 0.99 -0.55 0.00 0.00 175.29 177.39 1xmw s THR 107 N -3.13 2.03 -0.38 -0.34 2.01 -1.26 -4.94 115.64 109.63 1xmw s THR 107 Ca 0.22 -0.06 -0.28 0.00 0.31 0.00 0.00 61.69 61.87 1xmw s THR 107 Cb 0.01 -2.97 -0.01 0.00 0.01 0.00 0.00 72.50 69.54 1xmw s THR 107 CO 0.05 0.00 1.75 0.21 -0.69 0.00 0.00 174.62 175.94 1xmw s ASN 108 N -4.76 5.88 -0.34 3.53 3.84 -1.26 -4.96 114.94 116.87 1xmw s ASN 108 Ca 0.69 1.11 -0.20 0.00 0.21 0.00 0.00 52.86 54.67 1xmw s ASN 108 Cb -0.07 -2.53 -0.00 0.00 -0.55 0.00 0.00 41.25 38.10 1xmw s ASN 108 CO 0.51 -1.76 0.61 -0.75 -2.79 0.00 0.00 177.10 172.92 1xmw s LYS 109 N 5.73 3.73 0.70 0.43 2.47 -1.26 -5.06 119.74 126.49 1xmw s LYS 109 Ca 0.75 0.09 -0.08 0.00 -1.56 0.00 0.00 55.97 55.17 1xmw s LYS 109 Cb -0.20 -3.79 0.04 0.00 -1.46 0.00 0.00 37.83 32.43 1xmw s LYS 109 CO 0.32 -0.67 1.04 0.00 0.16 0.00 0.00 175.35 176.19 1xmw s ALA 110 N 2.63 3.04 -0.32 3.13 0.00 -1.26 -5.03 121.76 123.94 1xmw s ALA 110 Ca 0.24 -0.70 0.07 0.00 0.00 0.00 0.00 51.96 51.56 1xmw s ALA 110 Cb -0.15 -2.76 0.27 0.00 0.00 0.00 0.00 23.12 20.49 1xmw s ALA 110 CO 0.14 -1.23 1.24 1.17 0.00 0.00 0.00 175.76 177.08 1xmw n LYS 111 N -2.94 0.86 -2.53 0.00 4.81 -1.26 -5.01 118.16 112.09 1xmw n LYS 111 Ca 0.07 -1.21 -0.27 0.00 -0.87 0.00 0.00 58.31 56.02 1xmw n LYS 111 Cb 0.59 0.08 -0.00 0.00 0.02 0.00 0.00 35.03 35.71 1xmw n LYS 111 CO 0.00 0.00 0.00 0.54 1.17 0.00 0.00 177.40 179.11 1xmw n ARG 112 N -0.73 3.40 -2.02 1.64 1.74 -1.26 -4.83 116.66 114.60 1xmw n ARG 112 Ca -0.12 -4.55 -0.01 0.00 -0.77 0.00 0.00 57.85 52.40 1xmw n ARG 112 Cb 0.77 -2.25 0.01 0.00 -1.02 0.00 0.00 32.46 29.97 1xmw n ARG 112 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 1xmw n ALA 113 N -0.45 -0.68 -2.67 7.54 0.00 -1.26 -4.51 120.51 118.49 1xmw n ALA 113 Ca 0.38 -0.28 -0.26 0.00 0.00 0.00 0.00 53.44 53.28 1xmw n ALA 113 Cb 0.62 0.17 -0.03 0.00 0.00 0.00 0.00 19.45 20.21 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 4.12 0.30 0.00 0.20 -1.26 -3.74 118.68 118.29 1xmw s LEU 114 Ca 0.06 0.50 -0.18 0.00 0.69 0.00 0.00 54.13 55.20 1xmw s LEU 114 Cb -0.01 -3.31 0.02 0.00 -0.43 0.00 0.00 46.19 42.47 1xmw s LEU 114 CO 0.02 -0.16 0.68 -1.83 -0.29 0.00 0.00 176.35 174.77 1xmw s GLU 115 N -3.71 1.85 -0.00 1.98 -1.05 0.19 -4.82 118.70 113.14 1xmw s GLU 115 Ca 0.40 -1.16 0.01 0.00 -0.15 0.00 0.00 54.97 54.07 1xmw s GLU 115 Cb -0.10 0.58 -0.00 0.00 -0.44 0.00 0.00 34.13 34.16 1xmw s GLU 115 CO 0.31 -0.84 -0.04 0.54 0.95 0.00 0.00 175.26 176.19 1xmw s VAL 116 N -3.56 0.30 0.00 1.83 0.11 -1.26 0.11 120.40 117.94 1xmw s VAL 116 Ca 0.15 -0.20 0.03 0.00 -2.93 0.00 0.00 61.98 59.02 1xmw s VAL 116 Cb -0.05 -0.27 -0.01 0.00 -1.53 0.00 0.00 36.38 34.53 1xmw s VAL 116 CO 0.09 0.06 -0.08 -0.22 -3.33 0.00 0.00 175.10 171.62 1xmw s LEU 117 N -0.15 2.05 -0.44 2.54 0.20 -0.79 -4.98 118.68 117.11 1xmw s LEU 117 Ca 0.01 -0.20 -0.17 0.00 0.69 0.00 0.00 54.13 54.46 1xmw s LEU 117 Cb -0.02 -0.39 0.04 0.00 -0.43 0.00 0.00 46.19 45.39 1xmw s LEU 117 CO -0.00 0.06 0.43 -1.61 -0.29 0.00 0.00 176.35 174.94 1xmw s GLU 118 N -0.38 3.05 0.07 1.98 8.01 -1.26 -2.12 118.70 128.05 1xmw s GLU 118 Ca 0.02 -0.93 0.05 0.00 0.01 0.00 0.00 54.97 54.11 1xmw s GLU 118 Cb -0.04 -4.02 -0.03 0.00 -4.31 0.00 0.00 34.13 25.74 1xmw s GLU 118 CO -0.00 -0.92 -0.14 0.00 0.01 0.00 0.00 175.26 174.21 1xmw s ALA 119 N 2.03 1.14 -1.42 5.21 0.00 0.60 -4.81 121.76 124.51 1xmw s ALA 119 Ca 0.10 -0.96 -0.04 0.00 0.00 0.00 0.00 51.96 51.05 1xmw s ALA 119 Cb -0.19 -0.10 0.03 0.00 0.00 0.00 0.00 23.12 22.86 1xmw s ALA 119 CO 0.11 0.16 0.66 0.39 0.00 0.00 0.00 175.76 177.09 1xmw n GLU 120 N 1.38 -4.32 -1.69 0.00 1.02 -1.26 0.28 120.64 116.05 1xmw n GLU 120 Ca -0.21 0.52 -0.15 0.00 -0.02 0.00 0.00 57.16 57.30 1xmw n GLU 120 Cb 0.54 -5.00 -0.05 0.00 -0.02 0.00 0.00 31.44 26.91 1xmw n GLU 120 CO 0.00 0.00 0.00 -0.25 1.18 0.00 0.00 177.13 178.06 1xmw n ASP 121 N -2.96 -4.11 -4.27 1.62 9.92 -1.26 -4.92 116.55 110.58 1xmw n ASP 121 Ca -0.21 0.31 -0.22 0.00 -0.53 0.00 0.00 54.79 54.14 1xmw n ASP 121 Cb 0.64 -3.68 -0.10 0.00 -0.64 0.00 0.00 41.12 37.34 1xmw n ASP 121 CO 0.00 0.00 0.00 -0.54 0.13 0.00 0.00 177.20 176.79 1xmw s LYS 122 N -3.72 1.71 -0.04 -1.24 1.02 0.14 -2.91 119.74 114.70 1xmw s LYS 122 Ca 0.00 -1.99 0.00 0.00 0.02 0.00 0.00 55.97 54.01 1xmw s LYS 122 Cb 0.00 -0.61 0.02 0.00 -0.52 0.00 0.00 37.83 36.72 1xmw s LYS 122 CO 0.00 -0.33 -0.02 0.14 -0.92 0.00 0.00 175.35 174.22 1xmw s VAL 123 N -3.37 0.34 0.10 3.17 -7.23 -0.79 -0.29 120.40 112.33 1xmw s VAL 123 Ca 0.32 0.01 0.07 0.00 -1.81 0.00 0.00 61.98 60.57 1xmw s VAL 123 Cb 0.06 -0.41 -0.03 0.00 0.56 0.00 0.00 36.38 36.55 1xmw s VAL 123 CO 0.15 0.19 -0.19 -0.63 -0.31 0.00 0.00 175.10 174.31 1xmw s ILE 124 N 1.07 1.55 -0.21 -0.62 -1.09 -0.90 -3.09 121.20 117.90 1xmw s ILE 124 Ca -0.09 -1.50 -0.10 0.00 -2.23 0.00 0.00 60.65 56.74 1xmw s ILE 124 Cb -0.14 -1.44 -0.05 0.00 -1.58 0.00 0.00 42.46 39.26 1xmw s ILE 124 CO -0.01 -0.12 0.13 -0.76 -1.23 0.00 0.00 174.94 172.95 1xmw s LEU 125 N -1.90 4.10 -0.08 2.97 1.43 -1.12 -1.89 118.68 122.20 1xmw s LEU 125 Ca 0.05 0.15 0.01 0.00 -1.03 0.00 0.00 54.13 53.31 1xmw s LEU 125 Cb -0.10 -2.07 -0.03 0.00 0.03 0.00 0.00 46.19 44.02 1xmw s LEU 125 CO 0.04 0.13 -0.10 -0.54 0.23 0.00 0.00 176.35 176.11 1xmw s LYS 126 N 0.66 2.84 0.12 1.70 1.02 0.31 -1.84 119.74 124.54 1xmw s LYS 126 Ca 0.07 -0.62 0.00 0.00 0.02 0.00 0.00 55.97 55.44 1xmw s LYS 126 Cb -0.12 -2.55 -0.04 0.00 -0.52 0.00 0.00 37.83 34.60 1xmw s LYS 126 CO 0.01 0.55 0.00 0.00 -0.92 0.00 0.00 175.35 174.99 1xmw n ASN 128 N -0.07 0.00 0.00 0.00 2.85 -1.25 -4.84 115.26 111.95 1xmw n ASN 128 Ca -0.09 0.21 0.00 0.00 -0.11 0.00 0.00 54.58 54.59 1xmw n ASN 128 Cb 0.62 -0.30 0.00 0.00 1.24 0.00 0.00 39.78 41.34 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 -1.30 0.69 -4.62 1.20 2.88 -1.26 -5.05 113.62 106.15 1xmw n SER 129 Ca 0.03 0.00 -0.49 0.00 -1.33 0.00 0.00 58.87 57.08 1xmw n SER 129 Cb 0.06 0.00 -0.05 0.00 -0.75 0.00 0.00 64.21 63.47 1xmw n SER 129 CO 0.00 0.00 0.00 -1.54 -1.23 0.00 0.00 175.04 172.27 1xmw n SER 130 N 0.00 2.10 -4.68 -3.46 3.41 -0.82 -3.52 113.62 106.65 1xmw n SER 130 Ca 0.00 1.12 -0.38 0.00 -0.26 0.00 0.00 58.87 59.34 1xmw n SER 130 Cb 0.00 -1.29 -0.07 0.00 -0.26 0.00 0.00 64.21 62.60 1xmw n SER 130 CO 0.00 0.00 0.00 -0.63 -0.16 0.00 0.00 175.04 174.25 1xmw s ILE 131 N 0.41 5.18 0.06 -1.33 1.01 -1.26 -2.58 121.20 122.69 1xmw s ILE 131 Ca 0.79 0.81 -0.30 0.00 0.00 0.00 0.00 60.65 61.95 1xmw s ILE 131 Cb -0.83 -3.77 -0.04 0.00 0.01 0.00 0.00 42.46 37.83 1xmw s ILE 131 CO 0.46 0.26 0.97 -0.89 0.00 0.00 0.00 174.94 175.74 1xmw s THR 132 N 1.18 4.68 -0.53 2.92 2.01 0.39 -4.93 115.64 121.36 1xmw s THR 132 Ca 0.21 2.06 -0.20 0.00 0.31 0.00 0.00 61.69 64.08 1xmw s THR 132 Cb -0.15 -4.32 0.06 0.00 0.01 0.00 0.00 72.50 68.11 1xmw s THR 132 CO 0.08 0.24 0.67 -0.22 -0.69 0.00 0.00 174.62 174.70 1xmw s LEU 133 N 0.50 4.96 -0.04 4.42 1.98 -1.26 -1.42 118.68 127.81 1xmw s LEU 133 Ca 0.50 -0.96 -0.06 0.00 -2.89 0.00 0.00 54.13 50.72 1xmw s LEU 133 Cb -0.22 -2.45 -0.03 0.00 0.66 0.00 0.00 46.19 44.15 1xmw s LEU 133 CO 0.29 -0.97 0.31 -0.07 -1.89 0.00 0.00 176.35 174.02 1xmw h LEU 134 N 9.88 -0.18 0.00 -0.68 3.38 -1.88 -3.48 115.31 122.35 1xmw h LEU 134 Ca -0.28 0.01 0.13 0.00 0.09 0.00 0.00 57.88 57.83 1xmw h LEU 134 Cb 1.09 0.05 -0.02 0.00 0.09 0.00 0.00 40.66 41.86 1xmw h LEU 134 CO 1.00 0.14 0.36 0.00 0.09 0.00 0.00 178.44 180.03 1xmw n GLN 135 N -4.04 0.10 0.00 1.13 10.64 -1.23 -4.98 117.38 119.00 1xmw n GLN 135 Ca -0.03 -0.36 0.00 0.00 -1.83 0.00 0.00 57.00 54.78 1xmw n GLN 135 Cb 0.08 0.57 0.00 0.00 -0.86 0.00 0.00 30.24 30.03 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 -0.37 0.44 3.56 2.61 0.00 -1.26 -1.72 105.19 108.45 1xmw n GLY 136 Ca 0.01 -0.68 -0.36 0.00 0.00 0.00 0.00 46.02 44.99 1xmw n GLY 136 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1xmw s THR 137 N 0.00 3.59 -1.27 2.61 2.01 -0.38 -4.87 115.64 117.34 1xmw s THR 137 Ca 0.00 -0.13 -0.07 0.00 0.31 0.00 0.00 61.69 61.80 1xmw s THR 137 Cb 0.00 -4.44 0.17 0.00 0.01 0.00 0.00 72.50 68.24 1xmw s THR 137 CO 0.00 -1.37 2.07 0.00 -0.69 0.00 0.00 174.62 174.63 1xmw n ALA 138 N 11.44 6.06 -1.00 7.40 0.00 -1.26 -4.89 120.51 138.25 1xmw n ALA 138 Ca 0.25 -4.28 0.00 0.00 0.00 0.00 0.00 53.44 49.41 1xmw n ALA 138 Cb 0.50 -2.78 0.00 0.00 0.00 0.00 0.00 19.45 17.17 1xmw n ALA 138 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1xmw n GLY 139 N 1.98 -1.82 3.23 0.00 0.00 -1.26 -5.01 105.19 102.31 1xmw n GLY 139 Ca 0.49 -0.26 -0.13 0.00 0.00 0.00 0.00 46.02 46.12 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 0.56 -0.25 1.61 -0.21 -1.04 -4.86 119.66 115.47 1xmw s GLN 140 Ca 0.00 0.04 -0.28 0.00 0.02 0.00 0.00 55.36 55.14 1xmw s GLN 140 Cb 0.00 0.25 -0.04 0.00 1.00 0.00 0.00 33.01 34.23 1xmw s GLN 140 CO 0.00 -0.13 1.97 -1.21 -2.12 0.00 0.00 175.29 173.79 1xmw s GLU 141 N -0.78 3.35 0.02 2.91 2.02 -1.26 0.11 118.70 125.08 1xmw s GLU 141 Ca -0.09 1.79 -0.06 0.00 0.02 0.00 0.00 54.97 56.62 1xmw s GLU 141 Cb -0.04 -4.25 -0.02 0.00 0.10 0.00 0.00 34.13 29.91 1xmw s GLU 141 CO 0.03 -1.84 1.11 0.28 0.02 0.00 0.00 175.26 174.86 1xmw h VAL 142 N 6.80 0.00 0.00 2.63 2.07 0.13 -3.39 116.25 124.49 1xmw h VAL 142 Ca -0.38 0.00 -0.02 0.00 0.82 0.00 0.00 66.70 67.13 1xmw h VAL 142 Cb 1.20 0.00 -0.00 0.00 -1.52 0.00 0.00 31.29 30.97 1xmw h VAL 142 CO 0.99 0.00 -0.99 -1.54 0.02 0.00 0.00 177.57 176.05 1xmw n SER 143 N -3.17 1.92 0.00 0.57 3.41 -1.26 -5.04 113.62 110.06 1xmw n SER 143 Ca -0.01 0.37 0.00 0.00 -0.26 0.00 0.00 58.87 58.97 1xmw n SER 143 Cb 0.07 -0.76 0.00 0.00 -0.26 0.00 0.00 64.21 63.26 1xmw n SER 143 CO 0.00 0.00 0.00 -0.90 -0.16 0.00 0.00 175.04 173.98 1xmw n ASP 144 N -4.47 0.00 -3.53 4.04 5.75 -1.26 -5.02 116.55 112.06 1xmw n ASP 144 Ca -0.14 0.00 -0.20 0.00 -0.01 0.00 0.00 54.79 54.44 1xmw n ASP 144 Cb 0.50 0.00 0.02 0.00 -1.03 0.00 0.00 41.12 40.61 1xmw n ASP 144 CO 0.00 0.00 0.00 0.59 -0.11 0.00 0.00 177.20 177.68 1xmw n ASN 145 N 0.00 -5.94 0.00 -1.12 3.02 -1.26 -4.78 115.26 105.18 1xmw n ASN 145 Ca 0.00 -0.72 0.00 0.00 -0.03 0.00 0.00 54.58 53.83 1xmw n ASN 145 Cb 0.00 -3.42 0.00 0.00 -0.61 0.00 0.00 39.78 35.75 1xmw n ASN 145 CO 0.00 0.00 0.00 1.17 -2.62 0.00 0.00 177.26 175.81 1xmw n LYS 146 N -2.96 0.00 -4.32 3.52 0.00 -1.23 -1.95 118.16 111.22 1xmw n LYS 146 Ca -0.14 0.00 -0.18 0.00 0.00 0.00 0.00 58.31 57.99 1xmw n LYS 146 Cb 0.60 0.00 -0.14 0.00 0.00 0.00 0.00 35.03 35.49 1xmw n LYS 146 CO 0.00 0.00 0.00 0.95 0.00 0.00 0.00 177.40 178.35 1xmw s THR 147 N -1.06 0.86 0.10 3.15 -4.23 -1.26 -2.81 115.64 110.39 1xmw s THR 147 Ca 0.00 -0.74 0.05 0.00 -1.18 0.00 0.00 61.69 59.82 1xmw s THR 147 Cb 0.00 -0.77 -0.04 0.00 1.34 0.00 0.00 72.50 73.03 1xmw s THR 147 CO 0.00 0.04 -0.02 -0.22 -0.54 0.00 0.00 174.62 173.88 1xmw s LEU 148 N -0.80 3.37 -0.41 4.79 1.98 -0.77 0.16 118.68 127.01 1xmw s LEU 148 Ca 0.01 -0.23 0.03 0.00 -2.89 0.00 0.00 54.13 51.04 1xmw s LEU 148 Cb -0.06 -2.11 0.11 0.00 0.66 0.00 0.00 46.19 44.79 1xmw s LEU 148 CO 0.00 0.17 0.15 0.21 -1.89 0.00 0.00 176.35 174.99 1xmw s ASN 149 N -2.35 4.36 0.16 3.68 3.04 0.30 -2.78 114.94 121.35 1xmw s ASN 149 Ca 0.25 -2.44 0.10 0.00 0.04 0.00 0.00 52.86 50.81 1xmw s ASN 149 Cb -0.11 -1.44 -0.13 0.00 -1.54 0.00 0.00 41.25 38.03 1xmw s ASN 149 CO 0.17 -0.32 1.28 -0.07 -3.04 0.00 0.00 177.10 175.13 1xmw h LEU 150 N 7.18 0.00 0.00 3.21 3.38 -1.84 -2.77 115.31 124.48 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 0.84 0.00 0.61 0.09 0.00 0.00 178.44 180.54 1xmw n GLY 151 N 1.32 0.41 3.51 0.83 0.00 -1.26 -4.90 105.19 105.10 1xmw n GLY 151 Ca -0.01 -2.16 -0.30 0.00 0.00 0.00 0.00 46.02 43.55 1xmw n GLY 151 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1xmw s LYS 152 N -0.04 -1.65 0.09 1.61 0.00 -1.26 -1.89 119.74 116.60 1xmw s LYS 152 Ca 0.00 0.05 0.23 0.00 0.00 0.00 0.00 55.97 56.25 1xmw s LYS 152 Cb 0.00 -1.54 0.09 0.00 0.00 0.00 0.00 37.83 36.38 1xmw s LYS 152 CO 0.00 -4.02 1.06 2.89 0.00 0.00 0.00 175.35 175.29 1xmw n ARG 153 N -5.00 0.36 0.03 1.78 1.85 -1.14 -3.84 116.66 110.70 1xmw n ARG 153 Ca 0.12 0.03 0.09 0.00 -1.00 0.00 0.00 57.85 57.09 1xmw n ARG 153 Cb 0.59 -1.65 0.37 0.00 -1.05 0.00 0.00 32.46 30.73 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 -2.13 0.88 1.81 8.89 -0.00 -1.26 -2.34 119.36 125.22 1xmw n ILE 154 Ca 0.02 0.22 0.10 0.00 -0.00 0.00 0.00 62.75 63.08 1xmw n ILE 154 Cb 0.46 -0.99 0.55 0.00 -0.00 0.00 0.00 39.64 39.66 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 -1.68 1.18 -3.08 0.38 4.07 -1.25 -4.94 120.64 115.32 1xmw n GLU 155 Ca 0.03 -0.27 -0.09 0.00 -0.06 0.00 0.00 57.16 56.77 1xmw n GLU 155 Cb 0.20 -1.34 0.01 0.00 -0.06 0.00 0.00 31.44 30.25 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 -0.53 -7.41 -4.71 4.31 2.03 -0.99 -4.90 116.55 104.36 1xmw n ASP 156 Ca 0.15 0.09 -0.42 0.00 0.52 0.00 0.00 54.79 55.14 1xmw n ASP 156 Cb 0.14 -4.71 -0.03 0.00 -0.72 0.00 0.00 41.12 35.80 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 -2.96 4.36 -0.22 -0.67 0.04 -1.26 -4.84 135.00 129.45 1xmw s PRO 157 Ca 0.14 1.93 -0.05 0.00 0.04 0.00 0.00 61.00 63.05 1xmw s PRO 157 Cb -0.03 -3.35 0.11 0.00 0.04 0.00 0.00 34.50 31.27 1xmw s PRO 157 CO 0.78 -0.39 0.41 -0.98 0.04 0.00 0.00 177.00 176.86 1xmw s ARG 158 N 1.34 0.34 0.00 4.56 1.70 -1.26 -1.95 118.95 123.68 1xmw s ARG 158 Ca 0.62 0.88 0.00 0.00 -0.47 0.00 0.00 55.73 56.76 1xmw s ARG 158 Cb -0.33 0.09 0.00 0.00 -0.57 0.00 0.00 34.95 34.15 1xmw s ARG 158 CO 0.29 -0.38 0.00 0.41 -1.08 0.00 0.00 175.30 174.54 1xmw n GLY 159 N 5.38 -0.72 3.07 3.88 0.00 -0.59 -1.24 105.19 114.97 1xmw n GLY 159 Ca -0.07 -0.79 -0.08 0.00 0.00 0.00 0.00 46.02 45.08 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 -0.59 0.54 -0.15 1.61 -1.94 -0.70 0.14 119.30 118.21 1xmw s MET 160 Ca 0.00 -0.99 -0.05 0.00 -1.71 0.00 0.00 55.69 52.94 1xmw s MET 160 Cb 0.00 0.19 0.07 0.00 2.01 0.00 0.00 34.83 37.10 1xmw s MET 160 CO 0.00 -0.10 0.29 0.71 -0.01 0.00 0.00 175.02 175.91 1xmw s TYR 161 N -3.10 -0.49 0.34 -0.03 2.02 0.52 -2.68 117.35 113.92 1xmw s TYR 161 Ca -0.01 1.02 0.02 0.00 -0.37 0.00 0.00 57.07 57.73 1xmw s TYR 161 Cb 0.02 0.00 -0.03 0.00 -0.40 0.00 0.00 41.96 41.56 1xmw s TYR 161 CO -0.07 -0.40 0.52 -1.14 -1.57 0.00 0.00 175.55 172.89 1xmw s GLN 162 N 2.45 3.38 0.78 -0.62 0.74 -0.51 -2.25 119.66 123.62 1xmw s GLN 162 Ca 0.01 -0.52 -0.03 0.00 0.05 0.00 0.00 55.36 54.87 1xmw s GLN 162 Cb -0.12 -2.71 0.15 0.00 1.10 0.00 0.00 33.01 31.43 1xmw s GLN 162 CO -0.10 0.14 1.07 0.00 -0.55 0.00 0.00 175.29 175.86 1xmw s GLY 164 N -4.81 1.63 -0.11 0.00 0.00 -1.07 -4.48 107.32 98.49 1xmw s GLY 164 Ca 0.69 -1.31 -0.30 0.00 0.00 0.00 0.00 44.72 43.81 1xmw s GLY 164 CO 0.46 -1.16 1.16 1.85 0.00 0.00 0.00 173.10 175.41 1xmw s GLU 165 N -4.39 4.33 0.00 2.90 2.12 -1.26 -4.54 118.70 117.85 1xmw s GLU 165 Ca 0.48 1.58 0.00 0.00 0.36 0.00 0.00 54.97 57.39 1xmw s GLU 165 Cb -0.10 -3.61 0.00 0.00 0.26 0.00 0.00 34.13 30.68 1xmw s GLU 165 CO 0.35 -0.50 0.00 -1.71 -0.54 0.00 0.00 175.26 172.86 1xmw n ASN 166 N 5.59 0.00 -0.06 -1.70 4.05 -1.26 -4.99 115.26 116.88 1xmw n ASN 166 Ca 0.11 0.00 -0.07 0.00 0.45 0.00 0.00 54.58 55.07 1xmw n ASN 166 Cb 0.46 0.16 -0.09 0.00 1.23 0.00 0.00 39.78 41.54 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 -1.71 1.70 -3.25 5.20 0.00 -1.26 -5.02 120.51 116.17 1xmw n ALA 167 Ca 0.00 -0.76 0.03 0.00 0.00 0.00 0.00 53.44 52.72 1xmw n ALA 167 Cb 0.00 0.03 -0.03 0.00 0.00 0.00 0.00 19.45 19.45 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 -2.29 0.15 -0.04 0.00 2.47 -1.26 -5.10 119.74 113.66 1xmw s LYS 168 Ca -0.09 0.35 -0.30 0.00 -1.56 0.00 0.00 55.97 54.37 1xmw s LYS 168 Cb 0.04 0.21 -0.04 0.00 -1.46 0.00 0.00 37.83 36.57 1xmw s LYS 168 CO 0.46 -0.08 1.38 0.45 0.16 0.00 0.00 175.35 177.72 1xmw s SER 169 N 2.40 6.87 0.13 1.43 0.15 -1.26 -4.61 113.70 118.81 1xmw s SER 169 Ca -0.01 2.01 0.02 0.00 0.70 0.00 0.00 55.95 58.67 1xmw s SER 169 Cb -0.05 -2.55 -0.04 0.00 -1.71 0.00 0.00 66.02 61.67 1xmw s SER 169 CO -0.15 -0.73 -0.04 0.12 1.20 0.00 0.00 173.24 173.63 1xmw s PHE 170 N 2.76 1.03 -0.00 3.44 2.19 -1.26 -4.97 117.98 121.16 1xmw s PHE 170 Ca 0.62 -0.95 -0.01 0.00 0.33 0.00 0.00 56.93 56.92 1xmw s PHE 170 Cb -0.29 -0.58 -0.00 0.00 -1.31 0.00 0.00 43.02 40.83 1xmw s PHE 170 CO 0.24 -0.16 0.02 0.99 1.83 0.00 0.00 175.22 178.14 1xmw s THR 171 N -3.63 0.03 -0.03 0.12 2.01 -1.26 -0.20 115.64 112.68 1xmw s THR 171 Ca 0.17 -0.21 -0.02 0.00 0.31 0.00 0.00 61.69 61.94 1xmw s THR 171 Cb 0.05 -0.11 0.01 0.00 0.01 0.00 0.00 72.50 72.47 1xmw s THR 171 CO -0.01 -0.12 0.06 -0.22 -0.69 0.00 0.00 174.62 173.64 1xmw s LEU 172 N -0.34 1.54 0.07 4.42 0.20 -0.96 -2.25 118.68 121.35 1xmw s LEU 172 Ca -0.04 0.12 0.07 0.00 0.69 0.00 0.00 54.13 54.97 1xmw s LEU 172 Cb -0.02 0.17 -0.04 0.00 -0.43 0.00 0.00 46.19 45.87 1xmw s LEU 172 CO -0.00 -0.05 -0.15 -1.58 -0.29 0.00 0.00 176.35 174.28 1xmw s GLN 173 N 0.35 2.08 0.01 1.98 0.74 0.33 -0.35 119.66 124.80 1xmw s GLN 173 Ca -0.03 -1.00 0.07 0.00 0.05 0.00 0.00 55.36 54.45 1xmw s GLN 173 Cb -0.04 -2.24 -0.03 0.00 1.10 0.00 0.00 33.01 31.81 1xmw s GLN 173 CO -0.01 0.53 -0.21 0.54 -0.55 0.00 0.00 175.29 175.59 1xmw s VAL 174 N -1.04 2.54 -0.32 1.34 0.11 0.37 -0.85 120.40 122.54 1xmw s VAL 174 Ca 0.17 -1.12 -0.01 0.00 -2.93 0.00 0.00 61.98 58.09 1xmw s VAL 174 Cb -0.11 -2.00 0.13 0.00 -1.53 0.00 0.00 36.38 32.87 1xmw s VAL 174 CO 0.08 0.45 0.21 -0.47 -3.33 0.00 0.00 175.10 172.04 1xmw s TYR 175 N -0.79 0.29 -0.31 1.54 6.14 -0.00 -1.54 117.35 122.68 1xmw s TYR 175 Ca 0.12 -1.07 -0.18 0.00 0.64 0.00 0.00 57.07 56.58 1xmw s TYR 175 Cb -0.10 -0.78 -0.01 0.00 0.42 0.00 0.00 41.96 41.48 1xmw s TYR 175 CO 0.02 -0.86 0.52 0.71 0.64 0.00 0.00 175.55 176.58 1xmw s TYR 176 N 1.65 3.21 0.11 4.97 1.51 -0.82 -2.17 117.35 125.81 1xmw s TYR 176 Ca 0.14 0.38 0.00 0.00 -1.01 0.00 0.00 57.07 56.58 1xmw s TYR 176 Cb -0.18 -2.86 0.00 0.00 -0.11 0.00 0.00 41.96 38.81 1xmw s TYR 176 CO -0.17 -0.44 0.00 -2.13 -1.11 0.00 0.00 175.55 171.70 1xmw n ARG 177 N 5.68 -0.96 0.00 -0.62 0.63 0.17 -4.70 116.66 116.86 1xmw n ARG 177 Ca -0.04 0.63 0.00 0.00 -0.92 0.00 0.00 57.85 57.52 1xmw n ARG 177 Cb 0.49 -1.17 0.00 0.00 0.45 0.00 0.00 32.46 32.23 1xmw n ARG 177 CO 0.00 0.00 0.00 0.00 -2.51 0.00 0.00 177.63 175.12