#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 0.00 -0.72 -2.24 9.92 -1.26 -4.94 116.55 117.31 1xmw n ASP 2 Ca 0.00 0.00 0.06 0.00 -0.53 0.00 0.00 54.79 54.32 1xmw n ASP 2 Cb 0.00 0.00 0.18 0.00 -0.64 0.00 0.00 41.12 40.66 1xmw n ASP 2 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 1xmw n ALA 3 N -2.21 3.45 -3.09 2.24 0.00 -1.26 -5.03 120.51 114.61 1xmw n ALA 3 Ca 0.00 -3.15 -0.11 0.00 0.00 0.00 0.00 53.44 50.18 1xmw n ALA 3 Cb 0.00 -0.41 -0.10 0.00 0.00 0.00 0.00 19.45 18.94 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 -2.75 0.43 0.00 0.00 2.02 -1.26 -5.04 118.70 112.10 1xmw s GLU 4 Ca 0.37 -0.29 0.00 0.00 0.02 0.00 0.00 54.97 55.07 1xmw s GLU 4 Cb 0.37 0.18 0.00 0.00 0.10 0.00 0.00 34.13 34.78 1xmw s GLU 4 CO -0.08 -0.10 0.58 0.27 0.02 0.00 0.00 175.26 175.95 1xmw n ASN 5 N 1.74 0.00 -1.68 -0.19 2.04 -1.26 -3.21 115.26 112.69 1xmw n ASN 5 Ca -0.21 -1.17 -0.02 0.00 -0.44 0.00 0.00 54.58 52.75 1xmw n ASN 5 Cb 0.56 -0.03 0.26 0.00 -2.53 0.00 0.00 39.78 38.04 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 2.29 -3.15 1.53 -5.35 -1.26 -4.76 119.36 108.65 1xmw n ILE 6 Ca 0.00 -1.19 -0.07 0.00 -0.27 0.00 0.00 62.75 61.22 1xmw n ILE 6 Cb 0.53 -0.41 0.02 0.00 -1.74 0.00 0.00 39.64 38.04 1xmw n ILE 6 CO 0.00 0.00 0.00 -0.62 -1.76 0.00 0.00 176.55 174.17 1xmw n GLU 7 N 0.11 0.95 -4.26 6.28 1.02 -1.26 -4.70 120.64 118.78 1xmw n GLU 7 Ca 0.29 -1.05 -0.35 0.00 -0.02 0.00 0.00 57.16 56.02 1xmw n GLU 7 Cb 1.10 -0.03 -0.09 0.00 -0.02 0.00 0.00 31.44 32.40 1xmw n GLU 7 CO 0.00 0.00 0.00 0.71 1.18 0.00 0.00 177.13 179.02 1xmw s TYR 8 N -0.34 3.21 0.22 -0.32 1.51 -1.26 -4.18 117.35 116.18 1xmw s TYR 8 Ca 0.18 0.15 0.08 0.00 -1.01 0.00 0.00 57.07 56.47 1xmw s TYR 8 Cb -0.01 -1.87 -0.04 0.00 -0.11 0.00 0.00 41.96 39.92 1xmw s TYR 8 CO 0.11 0.39 0.07 0.15 -1.11 0.00 0.00 175.55 175.16 1xmw s LYS 9 N -0.54 2.58 -0.02 -0.62 1.02 -1.08 -4.91 119.74 116.17 1xmw s LYS 9 Ca 0.10 -1.16 -0.01 0.00 0.02 0.00 0.00 55.97 54.92 1xmw s LYS 9 Cb -0.12 -2.39 0.01 0.00 -0.52 0.00 0.00 37.83 34.81 1xmw s LYS 9 CO 0.02 0.42 0.04 0.08 -0.92 0.00 0.00 175.35 174.99 1xmw s VAL 10 N -2.02 -0.02 -0.36 3.17 1.01 -1.26 -1.90 120.40 119.01 1xmw s VAL 10 Ca 0.31 0.08 0.03 0.00 0.00 0.00 0.00 61.98 62.39 1xmw s VAL 10 Cb -0.08 -0.07 0.15 0.00 0.00 0.00 0.00 36.38 36.38 1xmw s VAL 10 CO 0.21 0.03 0.35 -0.44 0.00 0.00 0.00 175.10 175.26 1xmw s SER 11 N 0.42 1.41 -0.01 3.32 0.01 -0.67 -4.99 113.70 113.19 1xmw s SER 11 Ca -0.03 -1.61 -0.29 0.00 1.31 0.00 0.00 55.95 55.32 1xmw s SER 11 Cb -0.05 0.44 -0.03 0.00 0.21 0.00 0.00 66.02 66.59 1xmw s SER 11 CO -0.01 -0.27 0.93 -0.63 0.41 0.00 0.00 173.24 173.67 1xmw s ILE 12 N 1.43 4.89 -0.30 1.44 1.09 -1.26 -2.51 121.20 125.99 1xmw s ILE 12 Ca 0.17 1.96 0.02 0.00 -1.10 0.00 0.00 60.65 61.69 1xmw s ILE 12 Cb -0.16 -4.27 0.09 0.00 -1.06 0.00 0.00 42.46 37.05 1xmw s ILE 12 CO -0.04 0.18 0.03 -0.55 -0.10 0.00 0.00 174.94 174.46 1xmw s SER 13 N 0.96 4.27 -0.38 3.58 0.15 -0.62 -4.84 113.70 116.83 1xmw s SER 13 Ca 0.50 -1.70 -0.19 0.00 0.70 0.00 0.00 55.95 55.25 1xmw s SER 13 Cb -0.20 -1.26 0.03 0.00 -1.71 0.00 0.00 66.02 62.87 1xmw s SER 13 CO 0.26 -0.35 0.47 0.61 1.20 0.00 0.00 173.24 175.44 1xmw n GLY 14 N 4.56 -1.20 1.89 9.45 0.00 -1.26 -2.00 105.19 116.62 1xmw n GLY 14 Ca -0.03 0.99 -0.10 0.00 0.00 0.00 0.00 46.02 46.88 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 0.04 -0.08 -4.28 2.61 -1.04 -1.26 -4.70 114.28 105.58 1xmw n THR 15 Ca 0.03 0.00 -0.24 0.00 -2.04 0.00 0.00 64.05 61.80 1xmw n THR 15 Cb 0.46 -1.05 -0.07 0.00 -1.82 0.00 0.00 70.33 67.85 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 -1.89 4.58 -0.25 8.00 0.15 -0.85 -0.19 113.70 123.25 1xmw s SER 16 Ca 0.00 -0.60 -0.02 0.00 0.70 0.00 0.00 55.95 56.03 1xmw s SER 16 Cb 0.00 -0.87 0.11 0.00 -1.71 0.00 0.00 66.02 63.55 1xmw s SER 16 CO 0.00 0.02 0.25 -0.69 1.20 0.00 0.00 173.24 174.02 1xmw s VAL 17 N -2.19 -0.35 -0.35 4.45 1.01 -0.68 -1.59 120.40 120.71 1xmw s VAL 17 Ca 0.30 -0.33 -0.09 0.00 0.00 0.00 0.00 61.98 61.85 1xmw s VAL 17 Cb -0.07 -0.85 0.02 0.00 0.00 0.00 0.00 36.38 35.49 1xmw s VAL 17 CO 0.19 -0.36 0.16 -0.70 0.00 0.00 0.00 175.10 174.39 1xmw s GLU 18 N 2.33 2.91 -0.08 2.72 -6.30 -1.04 0.26 118.70 119.50 1xmw s GLU 18 Ca 0.08 -1.01 0.02 0.00 -2.50 0.00 0.00 54.97 51.57 1xmw s GLU 18 Cb -0.15 -3.61 -0.02 0.00 0.00 0.00 0.00 34.13 30.34 1xmw s GLU 18 CO -0.24 -0.62 -0.13 -0.51 0.02 0.00 0.00 175.26 173.79 1xmw s LEU 19 N 1.53 2.78 -0.30 2.70 1.43 -0.69 -1.66 118.68 124.47 1xmw s LEU 19 Ca 0.02 -0.22 -0.22 0.00 -1.03 0.00 0.00 54.13 52.69 1xmw s LEU 19 Cb -0.19 -1.59 -0.01 0.00 0.03 0.00 0.00 46.19 44.44 1xmw s LEU 19 CO 0.05 0.29 0.70 -0.89 0.23 0.00 0.00 176.35 176.73 1xmw s THR 20 N -0.42 4.88 0.30 5.49 2.01 -0.80 -0.42 115.64 126.68 1xmw s THR 20 Ca 0.05 1.02 -0.05 0.00 0.31 0.00 0.00 61.69 63.02 1xmw s THR 20 Cb -0.12 -4.05 0.07 0.00 0.01 0.00 0.00 72.50 68.41 1xmw s THR 20 CO 0.02 -0.17 0.17 0.00 -0.69 0.00 0.00 174.62 173.95 1xmw n PRO 22 N -2.49 1.91 -2.70 0.00 -0.04 -1.26 -4.68 135.00 125.73 1xmw n PRO 22 Ca 0.03 -0.73 -0.05 0.00 -0.04 0.00 0.00 63.50 62.71 1xmw n PRO 22 Cb 0.12 -1.68 0.02 0.00 -0.04 0.00 0.00 33.50 31.92 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 0.14 0.00 0.00 1.53 -0.00 -1.26 -4.73 117.00 112.69 1xmw n LEU 23 Ca 0.06 -1.41 -0.16 0.00 -0.00 0.00 0.00 56.01 54.51 1xmw n LEU 23 Cb 0.47 2.17 0.12 0.00 -0.00 0.00 0.00 43.42 46.18 1xmw n LEU 23 CO 0.08 -0.47 0.44 0.47 -0.00 0.00 0.00 177.39 177.91 1xmw n ASP 24 N -1.26 -0.41 -4.74 1.45 9.92 -1.26 -4.86 116.55 115.40 1xmw n ASP 24 Ca -0.04 -1.15 -0.41 0.00 -0.53 0.00 0.00 54.79 52.65 1xmw n ASP 24 Cb 0.35 -0.55 -0.04 0.00 -0.64 0.00 0.00 41.12 40.24 1xmw n ASP 24 CO 0.00 0.00 0.00 -0.44 0.13 0.00 0.00 177.20 176.89 1xmw s SER 25 N -3.51 7.16 -0.15 -2.24 0.01 -1.26 -4.57 113.70 109.14 1xmw s SER 25 Ca 0.40 2.21 -0.00 0.00 1.31 0.00 0.00 55.95 59.87 1xmw s SER 25 Cb -0.02 -2.61 -0.01 0.00 0.21 0.00 0.00 66.02 63.60 1xmw s SER 25 CO 0.29 -0.30 -0.14 -0.62 0.41 0.00 0.00 173.24 172.88 1xmw s ASP 26 N -0.10 3.81 0.59 2.44 -1.08 -1.26 -4.91 116.67 116.16 1xmw s ASP 26 Ca 0.50 -0.42 0.31 0.00 -0.52 0.00 0.00 52.55 52.43 1xmw s ASP 26 Cb -0.32 -1.59 1.25 0.00 -1.46 0.00 0.00 42.92 40.80 1xmw s ASP 26 CO 0.37 0.11 1.56 -0.33 0.52 0.00 0.00 175.17 177.39 1xmw h GLU 27 N 7.15 0.00 -0.21 4.34 5.08 -1.96 0.92 114.58 129.90 1xmw h GLU 27 Ca -0.31 0.00 -0.20 0.00 -1.00 0.00 0.00 59.36 57.86 1xmw h GLU 27 Cb 1.20 0.00 -0.26 0.00 0.50 0.00 0.00 28.75 30.19 1xmw h GLU 27 CO 0.56 0.00 -0.81 0.09 -1.00 0.00 0.00 179.01 177.85 1xmw n ASN 28 N -3.55 2.12 -4.67 1.42 3.02 -1.26 -4.98 115.26 107.36 1xmw n ASN 28 Ca 0.22 -3.05 -0.42 0.00 -0.03 0.00 0.00 54.58 51.30 1xmw n ASN 28 Cb 1.32 -0.42 -0.03 0.00 -0.61 0.00 0.00 39.78 40.04 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 -2.48 4.43 -0.29 3.41 2.96 0.32 -4.75 118.68 122.28 1xmw s LEU 29 Ca 0.38 2.68 -0.09 0.00 -0.22 0.00 0.00 54.13 56.88 1xmw s LEU 29 Cb 0.38 -3.54 -0.02 0.00 0.50 0.00 0.00 46.19 43.51 1xmw s LEU 29 CO -0.07 -1.04 0.12 -0.54 -1.32 0.00 0.00 176.35 173.49 1xmw s LYS 30 N 4.15 3.46 0.61 1.98 1.02 -0.75 -4.51 119.74 125.70 1xmw s LYS 30 Ca 0.87 -0.63 -0.04 0.00 0.02 0.00 0.00 55.97 56.19 1xmw s LYS 30 Cb -0.43 -3.47 0.04 0.00 -0.52 0.00 0.00 37.83 33.45 1xmw s LYS 30 CO 0.40 -0.33 0.89 -1.58 -0.92 0.00 0.00 175.35 173.82 1xmw s TRP 31 N 1.61 2.99 0.03 3.18 0.52 -1.26 -0.65 118.94 125.37 1xmw s TRP 31 Ca 0.05 0.33 0.01 0.00 0.02 0.00 0.00 56.10 56.51 1xmw s TRP 31 Cb -0.16 -2.89 -0.02 0.00 -1.15 0.00 0.00 33.47 29.24 1xmw s TRP 31 CO 0.05 -1.04 -0.06 -2.00 0.02 0.00 0.00 176.95 173.92 1xmw s GLU 32 N -4.99 0.44 -0.19 4.98 2.12 0.23 -2.41 118.70 118.87 1xmw s GLU 32 Ca 0.57 -0.68 -0.04 0.00 0.36 0.00 0.00 54.97 55.18 1xmw s GLU 32 Cb -0.11 -0.13 0.06 0.00 0.26 0.00 0.00 34.13 34.21 1xmw s GLU 32 CO 0.42 0.01 0.07 0.21 -0.54 0.00 0.00 175.26 175.43 1xmw s LYS 33 N -1.49 0.37 -1.40 4.30 2.36 -0.27 -2.69 119.74 120.91 1xmw s LYS 33 Ca -0.12 -0.30 -0.09 0.00 -2.55 0.00 0.00 55.97 52.91 1xmw s LYS 33 Cb -0.10 -1.94 0.06 0.00 -1.05 0.00 0.00 37.83 34.81 1xmw s LYS 33 CO -0.00 -0.68 0.62 -1.71 1.55 0.00 0.00 175.35 175.13 1xmw n ASN 34 N 5.16 -4.52 0.00 1.43 5.15 0.51 -0.68 115.26 122.31 1xmw n ASN 34 Ca -0.08 -0.45 0.00 0.00 -0.60 0.00 0.00 54.58 53.45 1xmw n ASN 34 Cb 0.48 -3.68 0.00 0.00 -0.53 0.00 0.00 39.78 36.04 1xmw n ASN 34 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 1xmw n GLY 35 N -1.36 0.43 2.86 8.20 0.00 -1.26 -4.93 105.19 109.13 1xmw n GLY 35 Ca -0.03 -0.86 -0.28 0.00 0.00 0.00 0.00 46.02 44.85 1xmw n GLY 35 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 1xmw s GLN 36 N -3.85 1.25 0.33 1.61 -0.44 0.15 -5.11 119.66 113.60 1xmw s GLN 36 Ca 0.00 -0.58 -0.29 0.00 -2.50 0.00 0.00 55.36 51.99 1xmw s GLN 36 Cb 0.00 -2.13 -0.11 0.00 -1.64 0.00 0.00 33.01 29.12 1xmw s GLN 36 CO 0.00 -0.52 1.53 0.39 0.50 0.00 0.00 175.29 177.19 1xmw n GLU 37 N 4.88 2.64 -3.39 1.67 1.02 -1.26 -1.11 120.64 125.09 1xmw n GLU 37 Ca -0.11 0.93 -0.44 0.00 -0.02 0.00 0.00 57.16 57.52 1xmw n GLU 37 Cb 0.47 -2.68 -0.07 0.00 -0.02 0.00 0.00 31.44 29.13 1xmw n GLU 37 CO 0.00 0.00 0.00 -0.51 1.18 0.00 0.00 177.13 177.80 1xmw s LEU 38 N -1.11 5.71 0.75 -4.62 1.02 -1.01 -4.90 118.68 114.52 1xmw s LEU 38 Ca 0.59 -1.44 -0.11 0.00 0.02 0.00 0.00 54.13 53.20 1xmw s LEU 38 Cb -0.50 -2.17 0.04 0.00 0.02 0.00 0.00 46.19 43.58 1xmw s LEU 38 CO 0.55 -0.68 1.08 -2.16 0.02 0.00 0.00 176.35 175.16 1xmw s PRO 39 N 1.62 2.43 0.56 1.29 0.04 -1.26 -4.53 135.00 135.15 1xmw s PRO 39 Ca 0.04 0.99 0.00 0.00 0.04 0.00 0.00 61.00 62.07 1xmw s PRO 39 Cb -0.25 -1.93 0.00 0.00 0.04 0.00 0.00 34.50 32.36 1xmw s PRO 39 CO 0.06 -1.47 0.00 0.94 0.04 0.00 0.00 177.00 176.57 1xmw n GLN 40 N -3.38 -3.89 -1.52 4.56 7.27 -1.26 -4.99 117.38 114.17 1xmw n GLN 40 Ca 0.08 3.02 0.00 0.00 0.07 0.00 0.00 57.00 60.17 1xmw n GLN 40 Cb 0.54 -3.80 0.00 0.00 2.41 0.00 0.00 30.24 29.39 1xmw n GLN 40 CO 0.00 0.00 0.00 1.17 0.07 0.00 0.00 177.06 178.30 1xmw n LYS 41 N -2.60 -4.29 -2.68 3.69 4.81 -1.26 -5.02 118.16 110.82 1xmw n LYS 41 Ca -0.00 3.23 -0.05 0.00 -0.87 0.00 0.00 58.31 60.61 1xmw n LYS 41 Cb 0.46 -3.72 0.07 0.00 0.02 0.00 0.00 35.03 31.86 1xmw n LYS 41 CO 0.00 0.00 0.00 -2.39 1.17 0.00 0.00 177.40 176.18 1xmw n HIS 42 N -1.30 -1.18 -3.96 5.64 1.44 -1.26 -4.86 115.22 109.73 1xmw n HIS 42 Ca 0.00 -1.17 -0.21 0.00 -2.01 0.00 0.00 57.72 54.33 1xmw n HIS 42 Cb 0.11 1.33 -0.03 0.00 0.12 0.00 0.00 29.99 31.53 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 -0.54 6.01 0.58 4.39 1.01 -1.26 -4.20 116.67 122.66 1xmw s ASP 43 Ca 0.16 -0.07 0.28 0.00 0.71 0.00 0.00 52.55 53.62 1xmw s ASP 43 Cb 0.24 -1.63 1.58 0.00 1.01 0.00 0.00 42.92 44.12 1xmw s ASP 43 CO -0.10 -0.11 2.05 0.50 0.21 0.00 0.00 175.17 177.72 1xmw h LYS 44 N 1.24 0.00 -5.01 8.23 3.64 -1.89 -3.38 116.57 119.40 1xmw h LYS 44 Ca -0.50 0.00 -0.64 0.00 -1.27 0.00 0.00 60.65 58.24 1xmw h LYS 44 Cb 1.24 0.00 -0.18 0.00 -0.41 0.00 0.00 32.23 32.87 1xmw h LYS 44 CO 0.60 0.00 -0.56 -1.01 -2.27 0.00 0.00 179.45 176.21 1xmw s HIS 45 N -4.69 3.20 -0.82 1.91 3.76 -1.26 -1.96 115.29 115.42 1xmw s HIS 45 Ca -0.05 -0.05 -0.17 0.00 -0.15 0.00 0.00 55.06 54.65 1xmw s HIS 45 Cb 0.16 -2.27 0.16 0.00 1.11 0.00 0.00 32.58 31.74 1xmw s HIS 45 CO 0.57 -0.14 0.91 -1.17 -0.85 0.00 0.00 174.74 174.07 1xmw s LEU 46 N 1.37 5.75 -0.08 0.89 2.96 0.44 -4.81 118.68 125.20 1xmw s LEU 46 Ca 0.06 -2.16 -0.23 0.00 -0.22 0.00 0.00 54.13 51.59 1xmw s LEU 46 Cb -0.15 -2.31 -0.04 0.00 0.50 0.00 0.00 46.19 44.20 1xmw s LEU 46 CO 0.06 -0.90 0.69 -0.69 -1.32 0.00 0.00 176.35 174.19 1xmw s VAL 47 N 1.76 5.05 -0.38 1.68 1.01 -1.23 -1.70 120.40 126.59 1xmw s VAL 47 Ca 0.23 1.41 -0.03 0.00 0.00 0.00 0.00 61.98 63.59 1xmw s VAL 47 Cb -0.11 -4.03 0.09 0.00 0.00 0.00 0.00 36.38 32.34 1xmw s VAL 47 CO -0.06 0.24 0.15 -0.76 0.00 0.00 0.00 175.10 174.67 1xmw s LEU 48 N 0.91 4.88 0.30 3.92 1.43 0.14 -4.84 118.68 125.42 1xmw s LEU 48 Ca 0.36 -1.79 -0.29 0.00 -1.03 0.00 0.00 54.13 51.38 1xmw s LEU 48 Cb -0.17 -1.81 -0.09 0.00 0.03 0.00 0.00 46.19 44.15 1xmw s LEU 48 CO 0.17 -0.46 1.09 -1.10 0.23 0.00 0.00 176.35 176.27 1xmw s GLN 49 N 1.18 4.58 -1.17 1.70 1.11 -1.26 -1.68 119.66 124.12 1xmw s GLN 49 Ca 0.05 1.75 -0.13 0.00 0.01 0.00 0.00 55.36 57.04 1xmw s GLN 49 Cb -0.22 -3.10 -0.02 0.00 -1.01 0.00 0.00 33.01 28.66 1xmw s GLN 49 CO -0.03 0.17 0.78 -0.25 0.01 0.00 0.00 175.29 175.97 1xmw n ASP 50 N 1.02 -4.48 -4.55 5.90 9.92 -0.78 -4.82 116.55 118.76 1xmw n ASP 50 Ca -0.00 -0.92 -0.39 0.00 -0.53 0.00 0.00 54.79 52.94 1xmw n ASP 50 Cb 0.46 -3.84 -0.03 0.00 -0.64 0.00 0.00 41.12 37.07 1xmw n ASP 50 CO 0.00 0.00 0.00 0.12 0.13 0.00 0.00 177.20 177.45 1xmw s PHE 51 N -3.52 1.81 -0.28 1.24 2.19 0.73 -4.95 117.98 115.19 1xmw s PHE 51 Ca 0.35 0.60 -0.28 0.00 0.33 0.00 0.00 56.93 57.93 1xmw s PHE 51 Cb -0.11 -4.21 0.01 0.00 -1.31 0.00 0.00 43.02 37.40 1xmw s PHE 51 CO 0.83 -2.26 1.00 -1.12 1.83 0.00 0.00 175.22 175.50 1xmw s SER 52 N 7.05 6.94 0.46 6.13 0.01 -1.26 -4.32 113.70 128.70 1xmw s SER 52 Ca 0.60 1.10 0.26 0.00 1.31 0.00 0.00 55.95 59.21 1xmw s SER 52 Cb -0.12 -2.51 1.41 0.00 0.21 0.00 0.00 66.02 65.01 1xmw s SER 52 CO 0.20 -0.74 1.77 -0.08 0.41 0.00 0.00 173.24 174.79 1xmw h GLU 53 N 7.86 0.00 0.31 12.44 4.22 -1.86 0.18 114.58 137.73 1xmw h GLU 53 Ca -0.21 0.00 -0.02 0.00 0.08 0.00 0.00 59.36 59.22 1xmw h GLU 53 Cb 1.07 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.32 1xmw h GLU 53 CO 0.98 0.00 -0.15 0.28 -2.18 0.00 0.00 179.01 177.94 1xmw h VAL 54 N 0.00 0.00 0.00 0.32 2.07 -1.91 -3.33 116.25 113.40 1xmw h VAL 54 Ca 0.00 -0.10 -0.06 0.00 0.82 0.00 0.00 66.70 67.36 1xmw h VAL 54 Cb 0.28 0.00 -0.01 0.00 -1.52 0.00 0.00 31.29 30.04 1xmw h VAL 54 CO 0.00 0.00 -1.75 -1.84 0.02 0.00 0.00 177.57 174.00 1xmw n GLU 55 N -3.41 0.76 0.00 1.57 0.28 -1.15 -4.41 120.64 114.29 1xmw n GLU 55 Ca -0.05 -0.11 0.08 0.00 -0.16 0.00 0.00 57.16 56.93 1xmw n GLU 55 Cb 0.17 -1.36 0.37 0.00 1.43 0.00 0.00 31.44 32.05 1xmw n GLU 55 CO 0.00 0.00 0.00 -3.47 -0.16 0.00 0.00 177.13 173.50 1xmw n ASP 56 N -2.14 0.02 -4.79 -1.84 -0.08 0.61 -4.71 116.55 103.62 1xmw n ASP 56 Ca -0.08 0.51 -0.39 0.00 -1.51 0.00 0.00 54.79 53.32 1xmw n ASP 56 Cb 0.53 -0.51 -0.06 0.00 2.34 0.00 0.00 41.12 43.42 1xmw n ASP 56 CO 0.00 0.00 0.00 -0.55 0.12 0.00 0.00 177.20 176.77 1xmw s SER 57 N -3.04 7.11 0.00 1.67 0.15 -1.24 -4.93 113.70 113.41 1xmw s SER 57 Ca 0.08 1.31 0.00 0.00 0.70 0.00 0.00 55.95 58.05 1xmw s SER 57 Cb 0.11 -2.39 0.00 0.00 -1.71 0.00 0.00 66.02 62.03 1xmw s SER 57 CO 0.32 0.21 0.00 0.61 1.20 0.00 0.00 173.24 175.58 1xmw n GLY 58 N 1.90 -0.63 3.88 9.45 0.00 -1.02 -4.94 105.19 113.83 1xmw n GLY 58 Ca -0.08 -1.09 -0.30 0.00 0.00 0.00 0.00 46.02 44.55 1xmw n GLY 58 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1xmw s TYR 59 N -3.00 3.49 -0.05 1.61 2.02 -1.26 -0.99 117.35 119.17 1xmw s TYR 59 Ca 0.00 1.06 -0.02 0.00 -0.37 0.00 0.00 57.07 57.74 1xmw s TYR 59 Cb 0.00 -2.47 0.04 0.00 -0.40 0.00 0.00 41.96 39.13 1xmw s TYR 59 CO 0.00 -0.17 0.10 0.71 -1.57 0.00 0.00 175.55 174.62 1xmw s TYR 60 N -2.46 -0.07 -0.17 2.71 2.02 0.11 -0.36 117.35 119.12 1xmw s TYR 60 Ca 0.52 0.37 -0.23 0.00 -0.37 0.00 0.00 57.07 57.36 1xmw s TYR 60 Cb -0.10 -0.24 0.06 0.00 -0.40 0.00 0.00 41.96 41.28 1xmw s TYR 60 CO 0.34 -0.17 0.61 0.54 -1.57 0.00 0.00 175.55 175.29 1xmw s VAL 61 N 1.58 0.00 0.37 0.71 0.11 -1.10 -2.33 120.40 119.75 1xmw s VAL 61 Ca -0.04 -0.04 0.06 0.00 -2.93 0.00 0.00 61.98 59.04 1xmw s VAL 61 Cb -0.12 -0.87 -0.07 0.00 -1.53 0.00 0.00 36.38 33.78 1xmw s VAL 61 CO -0.05 -0.02 0.00 0.00 -3.33 0.00 0.00 175.10 171.70 1xmw s TYR 63 N -2.88 -0.57 0.39 0.00 -0.85 0.18 -4.65 117.35 108.98 1xmw s TYR 63 Ca 0.34 0.94 0.06 0.00 -0.52 0.00 0.00 57.07 57.89 1xmw s TYR 63 Cb 0.08 0.36 -0.07 0.00 0.38 0.00 0.00 41.96 42.72 1xmw s TYR 63 CO 0.17 -0.59 0.03 0.95 -1.52 0.00 0.00 175.55 174.59 1xmw s THR 64 N -1.36 1.66 -1.03 -3.49 -4.23 -0.57 -1.81 115.64 104.81 1xmw s THR 64 Ca -0.11 -2.00 0.13 0.00 -1.18 0.00 0.00 61.69 58.54 1xmw s THR 64 Cb -0.01 -2.85 0.12 0.00 1.34 0.00 0.00 72.50 71.10 1xmw s THR 64 CO 0.08 0.00 1.43 -0.81 -0.54 0.00 0.00 174.62 174.77 1xmw n PRO 65 N -0.91 0.02 0.00 3.99 -0.04 -1.26 -3.12 135.00 133.67 1xmw n PRO 65 Ca -0.05 0.26 0.00 0.00 -0.04 0.00 0.00 63.50 63.67 1xmw n PRO 65 Cb 0.67 -1.50 0.00 0.00 -0.04 0.00 0.00 33.50 32.63 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 -1.48 1.86 -4.01 0.55 0.00 -1.26 -4.95 120.51 111.21 1xmw n ALA 66 Ca 0.04 0.00 -0.32 0.00 0.00 0.00 0.00 53.44 53.16 1xmw n ALA 66 Cb 0.15 0.06 -0.15 0.00 0.00 0.00 0.00 19.45 19.51 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 -2.09 4.72 -0.34 0.00 1.04 -1.18 -5.07 113.70 110.77 1xmw s SER 67 Ca 0.00 -1.97 -0.05 0.00 0.48 0.00 0.00 55.95 54.41 1xmw s SER 67 Cb 0.00 -1.62 0.06 0.00 0.10 0.00 0.00 66.02 64.56 1xmw s SER 67 CO 0.00 -0.34 0.10 0.20 0.98 0.00 0.00 173.24 174.17 1xmw s ASN 68 N 0.99 5.19 -0.25 7.02 0.01 -1.26 -1.51 114.94 125.13 1xmw s ASN 68 Ca 0.06 -1.36 0.01 0.00 -0.71 0.00 0.00 52.86 50.86 1xmw s ASN 68 Cb -0.19 -1.82 0.07 0.00 0.41 0.00 0.00 41.25 39.71 1xmw s ASN 68 CO -0.07 -0.36 -0.02 -0.75 -1.51 0.00 0.00 177.10 174.39 1xmw s LYS 69 N 1.31 1.43 -0.65 -0.60 2.47 -1.26 -5.06 119.74 117.37 1xmw s LYS 69 Ca -0.01 -1.02 -0.26 0.00 -1.56 0.00 0.00 55.97 53.12 1xmw s LYS 69 Cb -0.20 -2.53 -0.04 0.00 -1.46 0.00 0.00 37.83 33.59 1xmw s LYS 69 CO 0.00 -0.67 1.99 -0.80 0.16 0.00 0.00 175.35 176.03 1xmw s ASN 70 N 1.42 5.05 -0.29 1.43 0.02 -1.26 -4.87 114.94 116.43 1xmw s ASN 70 Ca -0.02 0.26 -0.04 0.00 -1.02 0.00 0.00 52.86 52.04 1xmw s ASN 70 Cb -0.19 -2.53 0.10 0.00 0.02 0.00 0.00 41.25 38.66 1xmw s ASN 70 CO -0.08 -2.59 0.13 0.28 0.02 0.00 0.00 177.10 174.85 1xmw s THR 71 N 10.02 -0.05 -0.11 1.60 -1.32 -1.25 -2.04 115.64 122.49 1xmw s THR 71 Ca 0.74 -0.82 -0.14 0.00 -1.21 0.00 0.00 61.69 60.26 1xmw s THR 71 Cb -0.12 -0.99 -0.05 0.00 -1.51 0.00 0.00 72.50 69.83 1xmw s THR 71 CO 0.17 -0.74 0.33 -0.31 -2.21 0.00 0.00 174.62 171.86 1xmw s TYR 72 N 2.04 3.56 -0.10 9.09 1.51 -0.91 -4.45 117.35 128.09 1xmw s TYR 72 Ca 0.09 0.73 0.03 0.00 -1.01 0.00 0.00 57.07 56.91 1xmw s TYR 72 Cb -0.16 -2.31 -0.01 0.00 -0.11 0.00 0.00 41.96 39.37 1xmw s TYR 72 CO -0.35 0.40 -0.20 -1.17 -1.11 0.00 0.00 175.55 173.12 1xmw s LEU 73 N -0.11 2.34 -0.74 -1.29 0.20 -0.98 -0.47 118.68 117.63 1xmw s LEU 73 Ca 0.19 -0.45 -0.23 0.00 0.69 0.00 0.00 54.13 54.33 1xmw s LEU 73 Cb -0.14 -1.48 0.07 0.00 -0.43 0.00 0.00 46.19 44.20 1xmw s LEU 73 CO 0.07 0.18 1.10 -0.47 -0.29 0.00 0.00 176.35 176.94 1xmw s TYR 74 N 0.22 2.62 -0.33 5.38 6.14 -0.78 -0.71 117.35 129.89 1xmw s TYR 74 Ca -0.13 -0.55 -0.19 0.00 0.64 0.00 0.00 57.07 56.84 1xmw s TYR 74 Cb -0.16 -4.41 -0.01 0.00 0.42 0.00 0.00 41.96 37.80 1xmw s TYR 74 CO 0.07 -1.76 0.58 -1.17 0.64 0.00 0.00 175.55 173.91 1xmw s LEU 75 N 4.39 4.23 -0.32 6.97 2.96 -0.16 -0.90 118.68 135.84 1xmw s LEU 75 Ca 0.28 0.20 0.01 0.00 -0.22 0.00 0.00 54.13 54.40 1xmw s LEU 75 Cb -0.12 -2.72 0.10 0.00 0.50 0.00 0.00 46.19 43.96 1xmw s LEU 75 CO 0.07 -0.50 0.09 -0.75 -1.32 0.00 0.00 176.35 173.95 1xmw s LYS 76 N 2.55 0.93 0.28 1.98 2.47 -0.98 -2.43 119.74 124.53 1xmw s LYS 76 Ca 0.22 -1.32 0.09 0.00 -1.56 0.00 0.00 55.97 53.40 1xmw s LYS 76 Cb -0.15 -2.30 -0.06 0.00 -1.46 0.00 0.00 37.83 33.86 1xmw s LYS 76 CO 0.13 -0.98 -0.11 0.00 0.16 0.00 0.00 175.35 174.54 1xmw s ALA 77 N 1.38 2.49 -0.08 3.13 0.00 -1.26 -1.14 121.76 126.27 1xmw s ALA 77 Ca 0.10 -1.89 0.00 0.00 0.00 0.00 0.00 51.96 50.18 1xmw s ALA 77 Cb -0.18 -0.01 0.02 0.00 0.00 0.00 0.00 23.12 22.95 1xmw s ALA 77 CO -0.20 0.06 -0.06 0.50 0.00 0.00 0.00 175.76 176.07 1xmw s ARG 78 N -3.64 1.20 -0.15 0.00 3.52 -1.26 -4.24 118.95 114.38 1xmw s ARG 78 Ca 0.29 -0.17 -0.04 0.00 -0.13 0.00 0.00 55.73 55.68 1xmw s ARG 78 Cb 0.01 -1.26 0.07 0.00 -1.56 0.00 0.00 34.95 32.21 1xmw s ARG 78 CO 0.12 -0.19 0.23 0.14 -0.81 0.00 0.00 175.30 174.80 1xmw s VAL 79 N 1.42 -0.36 0.21 7.11 -7.23 -1.26 -4.99 120.40 115.30 1xmw s VAL 79 Ca -0.02 0.16 -0.31 0.00 -1.81 0.00 0.00 61.98 60.00 1xmw s VAL 79 Cb -0.13 -0.50 -0.10 0.00 0.56 0.00 0.00 36.38 36.20 1xmw s VAL 79 CO -0.04 0.01 1.56 -0.83 -0.31 0.00 0.00 175.10 175.50 1xmw s GLY 80 N 2.37 1.79 -0.80 2.32 0.00 -1.26 -4.76 107.32 106.99 1xmw s GLY 80 Ca 0.04 1.42 0.02 0.00 0.00 0.00 0.00 44.72 46.20 1xmw s GLY 80 CO -0.09 2.56 1.12 -1.26 0.00 0.00 0.00 173.10 175.43 1xmw n SER 81 N 3.28 5.08 -0.04 1.64 2.88 -1.26 -4.81 113.62 120.39 1xmw n SER 81 Ca 0.11 -3.52 -0.20 0.00 -1.33 0.00 0.00 58.87 53.94 1xmw n SER 81 Cb 0.38 -0.87 -0.13 0.00 -0.75 0.00 0.00 64.21 62.84 1xmw n SER 81 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 1xmw h ALA 82 N 4.29 0.17 -2.38 -1.46 0.00 -2.03 -3.46 119.26 114.39 1xmw h ALA 82 Ca 0.23 -1.01 -0.49 0.00 0.00 0.00 0.00 54.91 53.64 1xmw h ALA 82 Cb 0.58 0.47 0.06 0.00 0.00 0.00 0.00 17.79 18.89 1xmw h ALA 82 CO 1.01 0.62 0.32 -0.51 0.00 0.00 0.00 179.25 180.70 1xmw s ASP 83 N -6.81 5.78 -0.63 0.00 1.11 -1.26 -4.49 116.67 110.37 1xmw s ASP 83 Ca -0.23 1.09 -0.11 0.00 0.18 0.00 0.00 52.55 53.49 1xmw s ASP 83 Cb 0.03 -2.06 0.01 0.00 1.07 0.00 0.00 42.92 41.98 1xmw s ASP 83 CO 0.70 -1.06 0.65 0.47 1.18 0.00 0.00 175.17 177.10 1xmw n ASP 84 N -2.75 -6.80 -3.66 0.27 9.92 -1.26 -5.02 116.55 107.25 1xmw n ASP 84 Ca 0.05 -0.13 -0.11 0.00 -0.53 0.00 0.00 54.79 54.07 1xmw n ASP 84 Cb 0.56 -3.91 -0.11 0.00 -0.64 0.00 0.00 41.12 37.02 1xmw n ASP 84 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 1xmw s ALA 85 N -2.65 -0.88 -0.04 2.24 0.00 -1.26 -5.02 121.76 114.16 1xmw s ALA 85 Ca 0.13 1.24 0.10 0.00 0.00 0.00 0.00 51.96 53.43 1xmw s ALA 85 Cb -0.02 -1.17 0.19 0.00 0.00 0.00 0.00 23.12 22.11 1xmw s ALA 85 CO 0.81 -0.69 1.10 1.17 0.00 0.00 0.00 175.76 178.15 1xmw n LYS 86 N 5.34 0.18 -4.43 0.00 4.81 -1.26 -4.99 118.16 117.80 1xmw n LYS 86 Ca -0.08 -1.43 -0.21 0.00 -0.87 0.00 0.00 58.31 55.71 1xmw n LYS 86 Cb 0.50 0.25 -0.16 0.00 0.02 0.00 0.00 35.03 35.64 1xmw n LYS 86 CO 0.00 0.00 0.00 0.15 1.17 0.00 0.00 177.40 178.72 1xmw s LYS 87 N -0.15 1.13 -0.05 1.64 -0.14 -1.26 -4.94 119.74 115.97 1xmw s LYS 87 Ca 0.12 -0.33 -0.04 0.00 -1.36 0.00 0.00 55.97 54.37 1xmw s LYS 87 Cb 0.17 -1.02 0.02 0.00 -1.68 0.00 0.00 37.83 35.31 1xmw s LYS 87 CO -0.06 0.09 0.09 -3.47 -0.76 0.00 0.00 175.35 171.23 1xmw n ASP 88 N 3.43 -5.89 -2.77 2.83 -0.08 -1.26 -4.74 116.55 108.08 1xmw n ASP 88 Ca -0.20 1.63 -0.02 0.00 -1.51 0.00 0.00 54.79 54.70 1xmw n ASP 88 Cb 0.53 -4.94 -0.01 0.00 2.34 0.00 0.00 41.12 39.04 1xmw n ASP 88 CO 0.00 0.00 0.00 0.00 0.12 0.00 0.00 177.20 177.32 1xmw n ALA 89 N 1.85 -3.21 0.04 -1.67 0.00 -1.26 -4.93 120.51 111.34 1xmw n ALA 89 Ca -0.15 0.99 0.03 0.00 0.00 0.00 0.00 53.44 54.31 1xmw n ALA 89 Cb 0.23 -2.04 -0.07 0.00 0.00 0.00 0.00 19.45 17.57 1xmw n ALA 89 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1xmw n ALA 90 N 1.21 2.11 -1.50 0.00 0.00 -1.26 -4.92 120.51 116.14 1xmw n ALA 90 Ca -0.13 -0.49 -0.36 0.00 0.00 0.00 0.00 53.44 52.47 1xmw n ALA 90 Cb 0.26 -0.96 0.09 0.00 0.00 0.00 0.00 19.45 18.83 1xmw n ALA 90 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 1xmw n LYS 91 N -2.80 0.76 -1.64 0.00 5.02 -1.26 -4.83 118.16 113.42 1xmw n LYS 91 Ca -0.08 0.32 -0.42 0.00 -2.02 0.00 0.00 58.31 56.11 1xmw n LYS 91 Cb 0.76 -2.44 -0.02 0.00 -0.02 0.00 0.00 35.03 33.32 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 -2.20 2.47 -3.90 1.97 0.00 -1.26 -4.86 118.16 110.38 1xmw n LYS 92 Ca 0.15 -2.43 -0.27 0.00 0.00 0.00 0.00 58.31 55.75 1xmw n LYS 92 Cb 0.49 -3.21 -0.17 0.00 0.00 0.00 0.00 35.03 32.14 1xmw n LYS 92 CO 0.00 0.00 0.00 0.16 0.00 0.00 0.00 177.40 177.56 1xmw s ASP 93 N 3.84 2.48 -0.24 3.14 -4.77 -1.26 -5.11 116.67 114.76 1xmw s ASP 93 Ca 0.51 -0.47 -0.27 0.00 -3.30 0.00 0.00 52.55 49.02 1xmw s ASP 93 Cb 0.13 -0.88 0.14 0.00 -1.09 0.00 0.00 42.92 41.22 1xmw s ASP 93 CO -0.02 -0.15 1.09 1.51 0.70 0.00 0.00 175.17 178.30 1xmw s ASP 94 N 1.67 -0.35 0.00 2.11 -4.77 -1.26 -5.09 116.67 108.98 1xmw s ASP 94 Ca 0.03 0.56 0.00 0.00 -3.30 0.00 0.00 52.55 49.84 1xmw s ASP 94 Cb -0.14 0.53 0.00 0.00 -1.09 0.00 0.00 42.92 42.22 1xmw s ASP 94 CO -0.08 -0.20 0.00 0.00 0.70 0.00 0.00 175.17 175.59 1xmw n ALA 95 N 1.50 0.49 -2.15 2.11 0.00 -1.26 -5.12 120.51 116.07 1xmw n ALA 95 Ca -0.11 0.00 -0.35 0.00 0.00 0.00 0.00 53.44 52.99 1xmw n ALA 95 Cb 0.57 0.00 -0.06 0.00 0.00 0.00 0.00 19.45 19.96 1xmw n ALA 95 CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 177.50 177.65 1xmw s LYS 96 N -0.93 4.13 0.07 0.00 1.02 -1.26 -4.98 119.74 117.79 1xmw s LYS 96 Ca 0.00 0.75 0.08 0.00 0.02 0.00 0.00 55.97 56.82 1xmw s LYS 96 Cb 0.00 -2.74 -0.22 0.00 -0.52 0.00 0.00 37.83 34.35 1xmw s LYS 96 CO 0.00 0.33 1.10 0.87 -0.92 0.00 0.00 175.35 176.73 1xmw h LYS 97 N 3.06 0.01 0.00 1.68 1.57 -2.05 -3.49 116.57 117.34 1xmw h LYS 97 Ca -0.48 -0.02 0.00 0.00 -1.87 0.00 0.00 60.65 58.29 1xmw h LYS 97 Cb 1.19 0.01 0.00 0.00 0.08 0.00 0.00 32.23 33.50 1xmw h LYS 97 CO 0.65 0.87 0.00 -3.47 -0.57 0.00 0.00 179.45 176.93 1xmw n ASP 98 N -3.27 0.00 0.25 0.86 -0.08 -1.26 -5.06 116.55 107.98 1xmw n ASP 98 Ca -0.05 -0.09 0.00 0.00 -1.51 0.00 0.00 54.79 53.14 1xmw n ASP 98 Cb 0.97 0.00 0.00 0.00 2.34 0.00 0.00 41.12 44.43 1xmw n ASP 98 CO 0.00 0.00 0.00 -0.67 0.12 0.00 0.00 177.20 176.65 1xmw n ASP 99 N -0.07 -4.36 -3.87 1.67 -0.08 -1.26 -5.04 116.55 103.54 1xmw n ASP 99 Ca 0.00 0.94 -0.27 0.00 -1.51 0.00 0.00 54.79 53.96 1xmw n ASP 99 Cb 0.00 4.03 0.02 0.00 2.34 0.00 0.00 41.12 47.51 1xmw n ASP 99 CO 0.00 0.00 0.00 0.00 0.12 0.00 0.00 177.20 177.32 1xmw n ALA 100 N -3.49 -1.67 0.29 -1.67 0.00 -1.26 -4.83 120.51 107.88 1xmw n ALA 100 Ca 0.00 -0.03 0.16 0.00 0.00 0.00 0.00 53.44 53.57 1xmw n ALA 100 Cb 0.00 -2.97 0.63 0.00 0.00 0.00 0.00 19.45 17.11 1xmw n ALA 100 CO 0.00 0.00 0.00 1.57 0.00 0.00 0.00 177.50 179.07 1xmw h LYS 101 N -1.92 0.00 -0.24 0.00 2.10 -2.06 -2.66 116.57 111.79 1xmw h LYS 101 Ca -0.60 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.05 1xmw h LYS 101 Cb 1.37 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.70 1xmw h LYS 101 CO 0.63 0.00 0.00 1.17 -2.00 0.00 0.00 179.45 179.25 1xmw n LYS 102 N -2.98 2.36 -1.61 0.07 0.00 -1.26 -5.07 118.16 109.67 1xmw n LYS 102 Ca 0.01 -2.11 0.00 0.00 0.00 0.00 0.00 58.31 56.21 1xmw n LYS 102 Cb 0.31 -1.48 0.00 0.00 0.00 0.00 0.00 35.03 33.86 1xmw n LYS 102 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.40 173.93 1xmw n ASP 103 N 1.39 -8.56 0.00 3.14 -0.08 -1.01 -4.98 116.55 106.45 1xmw n ASP 103 Ca 0.17 1.21 0.00 0.00 -1.51 0.00 0.00 54.79 54.66 1xmw n ASP 103 Cb 0.59 -4.52 0.00 0.00 2.34 0.00 0.00 41.12 39.52 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 -0.19 1.84 3.43 0.27 0.00 -1.26 -5.07 105.19 104.21 1xmw n GLY 104 Ca 0.00 0.00 -0.16 0.00 0.00 0.00 0.00 46.02 45.86 1xmw n GLY 104 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1xmw s SER 105 N -1.00 -0.50 -0.27 1.61 0.01 -1.26 -5.12 113.70 107.16 1xmw s SER 105 Ca 0.00 0.54 -0.29 0.00 1.31 0.00 0.00 55.95 57.51 1xmw s SER 105 Cb 0.00 0.51 0.01 0.00 0.21 0.00 0.00 66.02 66.75 1xmw s SER 105 CO 0.00 -0.53 1.12 -1.58 0.41 0.00 0.00 173.24 172.65 1xmw s GLN 106 N -1.14 4.13 0.88 12.44 2.00 -1.26 -5.02 119.66 131.69 1xmw s GLN 106 Ca -0.11 1.25 -0.12 0.00 -2.00 0.00 0.00 55.36 54.38 1xmw s GLN 106 Cb -0.02 -3.73 0.12 0.00 0.80 0.00 0.00 33.01 30.18 1xmw s GLN 106 CO 0.08 -0.82 1.12 0.99 -0.50 0.00 0.00 175.29 176.15 1xmw s THR 107 N 3.59 2.34 0.50 -0.34 2.01 -1.26 -5.01 115.64 117.46 1xmw s THR 107 Ca 0.47 0.11 -0.20 0.00 0.31 0.00 0.00 61.69 62.38 1xmw s THR 107 Cb -0.15 -2.83 -0.08 0.00 0.01 0.00 0.00 72.50 69.45 1xmw s THR 107 CO 0.13 -0.14 1.05 0.21 -0.69 0.00 0.00 174.62 175.18 1xmw s ASN 108 N -3.94 6.22 0.03 3.53 3.84 -1.26 -4.98 114.94 118.38 1xmw s ASN 108 Ca 0.63 1.97 -0.21 0.00 0.21 0.00 0.00 52.86 55.46 1xmw s ASN 108 Cb -0.15 -2.56 -0.12 0.00 -0.55 0.00 0.00 41.25 37.87 1xmw s ASN 108 CO 0.54 -0.86 1.24 0.11 -2.79 0.00 0.00 177.10 175.33 1xmw h LYS 109 N 1.47 -0.73 0.00 0.43 6.56 -2.06 -3.45 116.57 118.79 1xmw h LYS 109 Ca -0.50 0.05 0.00 0.00 -1.06 0.00 0.00 60.65 59.14 1xmw h LYS 109 Cb 1.23 0.17 0.00 0.00 -0.57 0.00 0.00 32.23 33.05 1xmw h LYS 109 CO 0.59 -0.49 0.00 0.00 -2.06 0.00 0.00 179.45 177.49 1xmw n ALA 110 N -2.41 0.00 0.17 3.86 0.00 -1.26 -5.01 120.51 115.86 1xmw n ALA 110 Ca -0.09 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.35 1xmw n ALA 110 Cb 0.30 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.75 1xmw n ALA 110 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 177.50 178.67 1xmw n LYS 111 N -0.48 0.00 0.10 0.00 4.81 -1.26 -5.06 118.16 116.27 1xmw n LYS 111 Ca 0.00 0.00 0.00 0.00 -0.87 0.00 0.00 58.31 57.44 1xmw n LYS 111 Cb 0.00 0.00 0.00 0.00 0.02 0.00 0.00 35.03 35.05 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 -3.19 0.00 0.00 1.64 1.74 -1.26 -5.10 116.66 110.49 1xmw n ARG 112 Ca 0.00 0.00 0.00 0.00 -0.77 0.00 0.00 57.85 57.08 1xmw n ARG 112 Cb 0.00 -0.22 0.00 0.00 -1.02 0.00 0.00 32.46 31.22 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 -3.46 1.92 -2.57 7.54 0.00 -1.26 -4.88 120.51 117.80 1xmw n ALA 113 Ca 0.00 0.00 -0.28 0.00 0.00 0.00 0.00 53.44 53.16 1xmw n ALA 113 Cb 0.01 0.00 -0.10 0.00 0.00 0.00 0.00 19.45 19.37 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 -1.91 2.99 0.28 0.00 0.20 -1.26 -1.48 118.68 117.50 1xmw s LEU 114 Ca 0.00 -0.50 -0.19 0.00 0.69 0.00 0.00 54.13 54.13 1xmw s LEU 114 Cb 0.00 -1.73 0.02 0.00 -0.43 0.00 0.00 46.19 44.04 1xmw s LEU 114 CO 0.00 0.14 0.67 -0.70 -0.29 0.00 0.00 176.35 176.16 1xmw s GLU 115 N -2.55 1.75 0.00 1.98 -6.30 -0.00 -4.96 118.70 108.62 1xmw s GLU 115 Ca 0.23 -1.06 0.01 0.00 -2.50 0.00 0.00 54.97 51.65 1xmw s GLU 115 Cb -0.10 0.58 -0.01 0.00 0.00 0.00 0.00 34.13 34.61 1xmw s GLU 115 CO 0.14 -0.79 -0.04 0.54 0.02 0.00 0.00 175.26 175.14 1xmw s VAL 116 N -3.90 0.30 0.08 3.70 0.11 -1.26 0.21 120.40 119.65 1xmw s VAL 116 Ca 0.14 -0.27 0.03 0.00 -2.93 0.00 0.00 61.98 58.95 1xmw s VAL 116 Cb -0.05 -0.28 -0.03 0.00 -1.53 0.00 0.00 36.38 34.49 1xmw s VAL 116 CO 0.08 0.02 -0.09 -0.22 -3.33 0.00 0.00 175.10 171.55 1xmw s LEU 117 N -0.27 2.37 -0.32 2.54 2.96 -0.95 -4.98 118.68 120.03 1xmw s LEU 117 Ca -0.00 -0.76 0.01 0.00 -0.22 0.00 0.00 54.13 53.16 1xmw s LEU 117 Cb -0.02 -0.26 0.08 0.00 0.50 0.00 0.00 46.19 46.48 1xmw s LEU 117 CO -0.00 -0.26 0.01 -1.61 -1.32 0.00 0.00 176.35 173.17 1xmw s GLU 118 N -2.55 2.00 0.03 1.98 8.01 -1.26 -2.29 118.70 124.63 1xmw s GLU 118 Ca 0.02 -1.57 0.06 0.00 0.01 0.00 0.00 54.97 53.49 1xmw s GLU 118 Cb -0.04 -3.16 -0.02 0.00 -4.31 0.00 0.00 34.13 26.60 1xmw s GLU 118 CO -0.00 -0.77 -0.17 0.00 0.01 0.00 0.00 175.26 174.33 1xmw s ALA 119 N 1.07 1.42 -1.32 5.21 0.00 0.15 -4.80 121.76 123.48 1xmw s ALA 119 Ca 0.01 -0.89 -0.03 0.00 0.00 0.00 0.00 51.96 51.04 1xmw s ALA 119 Cb -0.20 -0.27 -0.00 0.00 0.00 0.00 0.00 23.12 22.65 1xmw s ALA 119 CO -0.05 0.30 0.58 -1.91 0.00 0.00 0.00 175.76 174.69 1xmw n GLU 120 N 2.01 -3.52 -1.90 0.00 2.13 -1.26 0.07 120.64 118.17 1xmw n GLU 120 Ca -0.17 0.50 -0.13 0.00 0.66 0.00 0.00 57.16 58.01 1xmw n GLU 120 Cb 0.54 -4.71 -0.03 0.00 0.27 0.00 0.00 31.44 27.51 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 -2.97 -3.75 -4.16 4.31 8.00 -1.26 -4.92 116.55 111.80 1xmw n ASP 121 Ca -0.27 0.25 -0.22 0.00 0.71 0.00 0.00 54.79 55.26 1xmw n ASP 121 Cb 0.67 -3.33 -0.14 0.00 -0.02 0.00 0.00 41.12 38.30 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 -4.06 1.10 -0.04 -1.24 2.20 0.11 -3.90 119.74 113.91 1xmw s LYS 122 Ca 0.00 -0.73 0.05 0.00 -0.36 0.00 0.00 55.97 54.93 1xmw s LYS 122 Cb 0.00 -1.12 -0.01 0.00 -1.51 0.00 0.00 37.83 35.20 1xmw s LYS 122 CO 0.00 0.29 -0.18 0.14 -0.36 0.00 0.00 175.35 175.24 1xmw s VAL 123 N -0.70 1.48 0.01 4.02 -7.23 -0.99 0.30 120.40 117.29 1xmw s VAL 123 Ca 0.04 -0.75 -0.06 0.00 -1.81 0.00 0.00 61.98 59.39 1xmw s VAL 123 Cb -0.07 -1.26 -0.00 0.00 0.56 0.00 0.00 36.38 35.60 1xmw s VAL 123 CO 0.01 0.42 0.11 -0.63 -0.31 0.00 0.00 175.10 174.70 1xmw s ILE 124 N -0.07 0.10 -0.22 -0.62 1.09 -0.97 -3.12 121.20 117.39 1xmw s ILE 124 Ca -0.02 -0.81 -0.10 0.00 -1.10 0.00 0.00 60.65 58.63 1xmw s ILE 124 Cb -0.11 -0.52 -0.05 0.00 -1.06 0.00 0.00 42.46 40.72 1xmw s ILE 124 CO 0.02 -0.44 0.13 -0.76 -0.10 0.00 0.00 174.94 173.78 1xmw s LEU 125 N -1.58 4.03 -0.12 2.97 1.43 -0.96 -2.24 118.68 122.22 1xmw s LEU 125 Ca -0.13 0.11 0.03 0.00 -1.03 0.00 0.00 54.13 53.11 1xmw s LEU 125 Cb -0.06 -2.06 0.00 0.00 0.03 0.00 0.00 46.19 44.10 1xmw s LEU 125 CO -0.00 0.11 -0.22 -0.54 0.23 0.00 0.00 176.35 175.92 1xmw s LYS 126 N 0.81 3.06 0.29 1.70 1.02 0.13 -0.57 119.74 126.18 1xmw s LYS 126 Ca 0.07 -0.85 0.09 0.00 0.02 0.00 0.00 55.97 55.29 1xmw s LYS 126 Cb -0.13 -2.39 -0.06 0.00 -0.52 0.00 0.00 37.83 34.74 1xmw s LYS 126 CO 0.02 0.09 -0.11 0.00 -0.92 0.00 0.00 175.35 174.43 1xmw n ASN 128 N -0.62 0.00 0.00 0.00 2.85 -0.55 -4.82 115.26 112.11 1xmw n ASN 128 Ca -0.06 0.46 0.00 0.00 -0.11 0.00 0.00 54.58 54.87 1xmw n ASN 128 Cb 0.62 -0.47 0.00 0.00 1.24 0.00 0.00 39.78 41.17 1xmw n ASN 128 CO 0.00 0.00 0.00 -1.54 -2.11 0.00 0.00 177.26 173.61 1xmw n SER 129 N -1.47 0.00 -4.60 1.20 3.41 -1.26 -5.13 113.62 105.77 1xmw n SER 129 Ca 0.01 0.00 -0.43 0.00 -0.26 0.00 0.00 58.87 58.19 1xmw n SER 129 Cb 0.05 0.00 -0.01 0.00 -0.26 0.00 0.00 64.21 64.00 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 1.39 -4.76 4.04 2.88 -1.26 -4.16 113.62 111.76 1xmw n SER 130 Ca 0.00 1.14 -0.26 0.00 -1.33 0.00 0.00 58.87 58.41 1xmw n SER 130 Cb 0.00 -1.32 -0.06 0.00 -0.75 0.00 0.00 64.21 62.08 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 -1.13 4.26 -0.24 2.46 1.01 -1.26 -4.27 121.20 122.03 1xmw s ILE 131 Ca 0.59 -1.19 -0.05 0.00 0.00 0.00 0.00 60.65 60.01 1xmw s ILE 131 Cb -0.64 -3.16 -0.01 0.00 0.01 0.00 0.00 42.46 38.65 1xmw s ILE 131 CO 0.59 -0.11 -0.01 -0.89 0.00 0.00 0.00 174.94 174.53 1xmw s THR 132 N -1.75 3.62 -0.50 2.92 2.01 0.35 -4.91 115.64 117.39 1xmw s THR 132 Ca 0.30 -0.47 -0.28 0.00 0.31 0.00 0.00 61.69 61.54 1xmw s THR 132 Cb -0.10 -2.69 0.02 0.00 0.01 0.00 0.00 72.50 69.74 1xmw s THR 132 CO 0.22 0.35 1.31 -0.22 -0.69 0.00 0.00 174.62 175.60 1xmw s LEU 133 N 1.50 3.52 -0.07 4.42 1.98 -1.26 -1.17 118.68 127.61 1xmw s LEU 133 Ca 0.05 0.47 -0.09 0.00 -2.89 0.00 0.00 54.13 51.67 1xmw s LEU 133 Cb -0.15 -3.35 -0.06 0.00 0.66 0.00 0.00 46.19 43.30 1xmw s LEU 133 CO -0.01 -1.48 0.35 -0.07 -1.89 0.00 0.00 176.35 173.25 1xmw h LEU 134 N 12.19 -0.21 0.00 -0.68 3.38 -1.82 -3.48 115.31 124.68 1xmw h LEU 134 Ca -0.26 -0.05 0.07 0.00 0.09 0.00 0.00 57.88 57.73 1xmw h LEU 134 Cb 1.08 0.05 -0.01 0.00 0.09 0.00 0.00 40.66 41.87 1xmw h LEU 134 CO 1.14 0.28 0.19 0.00 0.09 0.00 0.00 178.44 180.14 1xmw n GLN 135 N -4.94 0.08 0.00 1.13 10.64 -1.21 -4.99 117.38 118.09 1xmw n GLN 135 Ca -0.04 -0.23 0.00 0.00 -1.83 0.00 0.00 57.00 54.90 1xmw n GLN 135 Cb 0.13 0.36 0.00 0.00 -0.86 0.00 0.00 30.24 29.86 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 -0.20 1.00 3.55 2.61 0.00 -1.26 -1.65 105.19 109.24 1xmw n GLY 136 Ca 0.01 -0.77 -0.26 0.00 0.00 0.00 0.00 46.02 45.00 1xmw n GLY 136 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 1xmw n THR 137 N 0.00 -0.05 -2.67 2.61 -1.04 -0.17 -4.81 114.28 108.16 1xmw n THR 137 Ca 0.00 -0.64 -0.41 0.00 -2.04 0.00 0.00 64.05 60.95 1xmw n THR 137 Cb 0.00 -2.33 0.01 0.00 -1.82 0.00 0.00 70.33 66.19 1xmw n THR 137 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 1xmw n ALA 138 N 16.89 5.90 -1.00 2.41 0.00 -1.26 -4.80 120.51 138.64 1xmw n ALA 138 Ca 0.43 -4.61 0.00 0.00 0.00 0.00 0.00 53.44 49.26 1xmw n ALA 138 Cb 0.47 -2.31 0.00 0.00 0.00 0.00 0.00 19.45 17.62 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 0.54 -1.14 3.02 0.00 0.00 -1.26 -4.94 105.19 101.41 1xmw n GLY 139 Ca 0.43 -0.05 -0.13 0.00 0.00 0.00 0.00 46.02 46.27 1xmw n GLY 139 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 1xmw s GLN 140 N 0.00 0.18 -0.78 1.61 0.74 -1.03 -4.90 119.66 115.49 1xmw s GLN 140 Ca 0.00 0.44 -0.25 0.00 0.05 0.00 0.00 55.36 55.60 1xmw s GLN 140 Cb 0.00 -0.10 -0.03 0.00 1.10 0.00 0.00 33.01 33.98 1xmw s GLN 140 CO 0.00 -0.14 1.88 -1.21 -0.55 0.00 0.00 175.29 175.27 1xmw s GLU 141 N 1.03 2.63 0.00 1.67 2.02 -1.25 -1.11 118.70 123.69 1xmw s GLU 141 Ca -0.08 0.07 0.00 0.00 0.02 0.00 0.00 54.97 54.98 1xmw s GLU 141 Cb -0.09 -4.76 0.00 0.00 0.10 0.00 0.00 34.13 29.38 1xmw s GLU 141 CO -0.06 -3.04 0.00 1.55 0.02 0.00 0.00 175.26 173.73 1xmw n VAL 142 N 7.52 0.00 0.04 2.63 3.14 0.35 -2.75 118.33 129.26 1xmw n VAL 142 Ca 0.31 0.00 -0.08 0.00 -2.96 0.00 0.00 64.34 61.60 1xmw n VAL 142 Cb 0.49 0.00 -0.13 0.00 -1.06 0.00 0.00 33.84 33.15 1xmw n VAL 142 CO 0.00 0.00 0.00 -1.28 -6.46 0.00 0.00 176.83 169.09 1xmw h SER 143 N 0.00 0.04 -0.42 6.55 0.87 -1.90 -3.43 113.55 115.25 1xmw h SER 143 Ca 0.00 -0.05 -0.16 0.00 -1.23 0.00 0.00 61.79 60.35 1xmw h SER 143 Cb 0.00 -0.01 -0.15 0.00 -0.44 0.00 0.00 62.40 61.80 1xmw h SER 143 CO 0.00 1.04 -0.41 0.47 -0.53 0.00 0.00 176.83 177.40 1xmw n ASP 144 N -3.29 -2.85 -2.62 6.23 8.00 -1.17 -5.08 116.55 115.77 1xmw n ASP 144 Ca -0.05 -2.79 -0.04 0.00 0.71 0.00 0.00 54.79 52.62 1xmw n ASP 144 Cb 0.98 1.60 -0.03 0.00 -0.02 0.00 0.00 41.12 43.64 1xmw n ASP 144 CO 0.00 0.00 0.00 0.59 -0.39 0.00 0.00 177.20 177.40 1xmw n ASN 145 N 2.25 -2.80 0.00 -2.24 3.02 -1.11 -4.94 115.26 109.44 1xmw n ASN 145 Ca 0.12 1.37 0.00 0.00 -0.03 0.00 0.00 54.58 56.04 1xmw n ASN 145 Cb 0.61 -4.60 0.00 0.00 -0.61 0.00 0.00 39.78 35.18 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 1.88 0.00 -4.16 3.52 4.76 -1.26 -4.15 118.16 118.75 1xmw n LYS 146 Ca -0.29 0.00 -0.16 0.00 -2.87 0.00 0.00 58.31 54.99 1xmw n LYS 146 Cb 0.45 0.00 -0.06 0.00 -1.84 0.00 0.00 35.03 33.58 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 0.00 0.01 -0.18 2.01 -1.26 -3.06 115.64 113.16 1xmw s THR 147 Ca 0.00 -1.76 0.02 0.00 0.31 0.00 0.00 61.69 60.26 1xmw s THR 147 Cb 0.00 -2.57 -0.01 0.00 0.01 0.00 0.00 72.50 69.93 1xmw s THR 147 CO 0.00 0.00 -0.06 -0.22 -0.69 0.00 0.00 174.62 173.65 1xmw s LEU 148 N -3.28 2.09 -0.24 4.42 1.98 0.27 0.13 118.68 124.05 1xmw s LEU 148 Ca 0.35 -0.25 0.01 0.00 -2.89 0.00 0.00 54.13 51.35 1xmw s LEU 148 Cb 0.01 -0.24 0.06 0.00 0.66 0.00 0.00 46.19 46.67 1xmw s LEU 148 CO 0.22 -0.02 -0.07 0.20 -1.89 0.00 0.00 176.35 174.79 1xmw s ASN 149 N -0.61 4.01 -0.07 3.68 -0.87 -0.27 -2.26 114.94 118.56 1xmw s ASN 149 Ca -0.02 -1.23 0.19 0.00 -1.57 0.00 0.00 52.86 50.23 1xmw s ASN 149 Cb -0.05 -1.30 -0.24 0.00 -0.02 0.00 0.00 41.25 39.65 1xmw s ASN 149 CO 0.00 -0.22 0.44 0.18 -2.57 0.00 0.00 177.10 174.93 1xmw n LEU 150 N 4.60 0.30 0.00 0.60 4.77 -1.18 -2.45 117.00 123.63 1xmw n LEU 150 Ca -0.13 0.13 0.00 0.00 -0.03 0.00 0.00 56.01 55.98 1xmw n LEU 150 Cb 0.44 0.22 0.00 0.00 -2.33 0.00 0.00 43.42 41.75 1xmw n LEU 150 CO 0.19 0.25 0.00 0.61 -1.33 0.00 0.00 177.39 177.11 1xmw n GLY 151 N 1.50 0.19 4.02 -0.72 0.00 -1.26 -4.94 105.19 103.98 1xmw n GLY 151 Ca -0.17 -1.34 -0.20 0.00 0.00 0.00 0.00 46.02 44.30 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 2.20 0.12 1.61 1.02 -1.26 -2.34 119.74 121.09 1xmw s LYS 152 Ca 0.00 -1.43 0.23 0.00 0.02 0.00 0.00 55.97 54.79 1xmw s LYS 152 Cb 0.00 -2.57 0.02 0.00 -0.52 0.00 0.00 37.83 34.76 1xmw s LYS 152 CO 0.00 -0.95 1.01 2.89 -0.92 0.00 0.00 175.35 177.37 1xmw n ARG 153 N -2.36 0.48 0.00 1.68 1.85 -1.25 -3.80 116.66 113.26 1xmw n ARG 153 Ca 0.14 0.04 0.09 0.00 -1.00 0.00 0.00 57.85 57.13 1xmw n ARG 153 Cb 0.61 -1.71 0.44 0.00 -1.05 0.00 0.00 32.46 30.75 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 -2.35 0.57 0.62 8.89 -0.00 -1.26 -2.71 119.36 123.12 1xmw n ILE 154 Ca 0.00 0.14 0.03 0.00 -0.00 0.00 0.00 62.75 62.93 1xmw n ILE 154 Cb 0.51 -0.83 0.14 0.00 -0.00 0.00 0.00 39.64 39.46 1xmw n ILE 154 CO 0.00 0.00 0.00 1.21 -0.00 0.00 0.00 176.55 177.76 1xmw n GLU 155 N -1.39 2.14 -3.21 0.38 4.07 -1.25 -4.92 120.64 116.47 1xmw n GLU 155 Ca 0.07 -1.12 -0.06 0.00 -0.06 0.00 0.00 57.16 55.99 1xmw n GLU 155 Cb 0.18 -1.56 0.01 0.00 -0.06 0.00 0.00 31.44 30.01 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 0.27 -7.17 -4.64 4.31 2.03 -1.10 -4.88 116.55 105.37 1xmw n ASP 156 Ca 0.10 -0.30 -0.43 0.00 0.52 0.00 0.00 54.79 54.69 1xmw n ASP 156 Cb 0.46 -4.69 -0.02 0.00 -0.72 0.00 0.00 41.12 36.14 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 -3.53 3.96 -0.22 -0.67 0.04 -1.26 -4.83 135.00 128.49 1xmw s PRO 157 Ca 0.06 1.54 -0.05 0.00 0.04 0.00 0.00 61.00 62.58 1xmw s PRO 157 Cb -0.01 -3.91 0.11 0.00 0.04 0.00 0.00 34.50 30.73 1xmw s PRO 157 CO 0.78 -1.07 0.42 -0.98 0.04 0.00 0.00 177.00 176.19 1xmw s ARG 158 N 4.18 0.35 0.00 4.56 1.04 -1.26 -1.54 118.95 126.27 1xmw s ARG 158 Ca 0.62 0.88 0.00 0.00 -1.04 0.00 0.00 55.73 56.19 1xmw s ARG 158 Cb -0.22 0.08 0.00 0.00 -2.04 0.00 0.00 34.95 32.78 1xmw s ARG 158 CO 0.24 -0.40 0.00 0.41 -0.04 0.00 0.00 175.30 175.51 1xmw n GLY 159 N 5.39 1.36 3.26 3.88 0.00 0.10 -1.00 105.19 118.18 1xmw n GLY 159 Ca -0.07 -0.46 -0.14 0.00 0.00 0.00 0.00 46.02 45.36 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 1.50 0.70 -0.10 1.61 1.75 -0.66 -0.40 119.30 123.70 1xmw s MET 160 Ca 0.00 -0.16 -0.04 0.00 -1.25 0.00 0.00 55.69 54.23 1xmw s MET 160 Cb 0.00 0.31 0.05 0.00 2.84 0.00 0.00 34.83 38.03 1xmw s MET 160 CO 0.00 -0.20 0.21 0.71 -0.65 0.00 0.00 175.02 175.10 1xmw s TYR 161 N -1.33 -0.29 0.35 4.11 1.51 0.12 -2.29 117.35 119.54 1xmw s TYR 161 Ca -0.13 0.73 0.08 0.00 -1.01 0.00 0.00 57.07 56.74 1xmw s TYR 161 Cb -0.05 -0.07 -0.04 0.00 -0.11 0.00 0.00 41.96 41.69 1xmw s TYR 161 CO 0.05 -0.26 0.14 -1.14 -1.11 0.00 0.00 175.55 173.23 1xmw s GLN 162 N 1.77 2.33 0.26 -0.62 0.74 -0.31 -2.17 119.66 121.65 1xmw s GLN 162 Ca -0.04 -1.60 0.03 0.00 0.05 0.00 0.00 55.36 53.80 1xmw s GLN 162 Cb -0.11 -2.13 -0.05 0.00 1.10 0.00 0.00 33.01 31.81 1xmw s GLN 162 CO -0.07 0.08 0.03 0.00 -0.55 0.00 0.00 175.29 174.77 1xmw s GLY 164 N -3.36 2.09 0.26 0.00 0.00 -1.26 -4.28 107.32 100.77 1xmw s GLY 164 Ca 0.32 -0.41 0.02 0.00 0.00 0.00 0.00 44.72 44.65 1xmw s GLY 164 CO 0.11 1.03 0.06 1.18 0.00 0.00 0.00 173.10 175.49 1xmw n GLU 165 N 4.69 0.87 0.00 2.90 -0.58 -1.26 -4.98 120.64 122.27 1xmw n GLU 165 Ca -0.05 -2.08 0.00 0.00 -0.42 0.00 0.00 57.16 54.61 1xmw n GLU 165 Cb 0.51 0.97 0.00 0.00 -0.57 0.00 0.00 31.44 32.35 1xmw n GLU 165 CO 0.00 0.00 0.00 0.27 -0.48 0.00 0.00 177.13 176.92 1xmw n ASN 166 N -1.59 4.20 -0.00 1.62 6.94 -1.26 -4.79 115.26 120.37 1xmw n ASN 166 Ca -0.06 0.00 0.06 0.00 -0.02 0.00 0.00 54.58 54.57 1xmw n ASN 166 Cb 0.37 0.31 -0.09 0.00 -2.36 0.00 0.00 39.78 38.00 1xmw n ASN 166 CO 0.00 0.00 0.00 0.00 -1.03 0.00 0.00 177.26 176.23 1xmw n ALA 167 N -2.02 2.76 -3.26 -2.53 0.00 -1.26 -4.98 120.51 109.21 1xmw n ALA 167 Ca 0.00 -0.32 0.03 0.00 0.00 0.00 0.00 53.44 53.16 1xmw n ALA 167 Cb 0.45 -0.44 -0.03 0.00 0.00 0.00 0.00 19.45 19.42 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 -2.72 0.20 0.26 0.00 2.47 -1.26 -5.14 119.74 113.55 1xmw s LYS 168 Ca -0.02 0.45 -0.29 0.00 -1.56 0.00 0.00 55.97 54.54 1xmw s LYS 168 Cb 0.09 0.27 -0.09 0.00 -1.46 0.00 0.00 37.83 36.63 1xmw s LYS 168 CO 0.53 -0.12 1.18 -1.12 0.16 0.00 0.00 175.35 175.98 1xmw s SER 169 N 2.53 7.10 -0.08 1.43 0.01 -1.26 -4.68 113.70 118.74 1xmw s SER 169 Ca -0.01 2.36 -0.02 0.00 1.31 0.00 0.00 55.95 59.58 1xmw s SER 169 Cb -0.06 -2.63 -0.03 0.00 0.21 0.00 0.00 66.02 63.51 1xmw s SER 169 CO -0.15 -0.30 0.02 0.12 0.41 0.00 0.00 173.24 173.34 1xmw s PHE 170 N -0.80 3.22 0.02 2.43 2.19 -1.26 -4.57 117.98 119.21 1xmw s PHE 170 Ca 0.48 0.23 0.00 0.00 0.33 0.00 0.00 56.93 57.98 1xmw s PHE 170 Cb -0.34 -1.80 -0.01 0.00 -1.31 0.00 0.00 43.02 39.56 1xmw s PHE 170 CO 0.42 0.51 -0.03 0.99 1.83 0.00 0.00 175.22 178.95 1xmw s THR 171 N -0.93 0.11 -0.00 0.12 2.01 -0.86 -2.13 115.64 113.95 1xmw s THR 171 Ca 0.14 -0.68 -0.00 0.00 0.31 0.00 0.00 61.69 61.46 1xmw s THR 171 Cb -0.11 -0.22 0.01 0.00 0.01 0.00 0.00 72.50 72.18 1xmw s THR 171 CO 0.03 -0.36 0.01 -0.22 -0.69 0.00 0.00 174.62 173.39 1xmw s LEU 172 N -1.07 1.83 -0.31 4.42 0.20 -0.92 -2.13 118.68 120.69 1xmw s LEU 172 Ca -0.11 0.01 0.02 0.00 0.69 0.00 0.00 54.13 54.74 1xmw s LEU 172 Cb -0.07 -0.01 0.09 0.00 -0.43 0.00 0.00 46.19 45.77 1xmw s LEU 172 CO -0.01 -0.02 0.03 -1.58 -0.29 0.00 0.00 176.35 174.48 1xmw s GLN 173 N 0.20 1.37 0.38 1.98 0.74 0.38 -0.70 119.66 124.00 1xmw s GLN 173 Ca -0.02 -1.46 -0.24 0.00 0.05 0.00 0.00 55.36 53.69 1xmw s GLN 173 Cb -0.02 -2.76 -0.09 0.00 1.10 0.00 0.00 33.01 31.23 1xmw s GLN 173 CO -0.01 -0.86 1.01 0.54 -0.55 0.00 0.00 175.29 175.43 1xmw s VAL 174 N 1.19 3.91 -0.34 1.34 0.11 0.46 -1.87 120.40 125.21 1xmw s VAL 174 Ca 0.06 1.48 0.02 0.00 -2.93 0.00 0.00 61.98 60.60 1xmw s VAL 174 Cb -0.19 -3.77 0.15 0.00 -1.53 0.00 0.00 36.38 31.05 1xmw s VAL 174 CO -0.12 0.02 0.35 -0.47 -3.33 0.00 0.00 175.10 171.55 1xmw s TYR 175 N -1.69 -0.40 -0.40 1.54 6.14 -0.08 -0.73 117.35 121.74 1xmw s TYR 175 Ca 0.56 -0.52 -0.15 0.00 0.64 0.00 0.00 57.07 57.60 1xmw s TYR 175 Cb -0.20 -0.41 0.01 0.00 0.42 0.00 0.00 41.96 41.78 1xmw s TYR 175 CO 0.25 -0.95 0.30 0.71 0.64 0.00 0.00 175.55 176.50 1xmw s TYR 176 N 1.83 3.23 -0.39 4.97 1.51 -0.59 -2.33 117.35 125.59 1xmw s TYR 176 Ca 0.14 -0.49 -0.22 0.00 -1.01 0.00 0.00 57.07 55.48 1xmw s TYR 176 Cb -0.15 -2.60 0.01 0.00 -0.11 0.00 0.00 41.96 39.11 1xmw s TYR 176 CO -0.16 -0.56 0.74 0.50 -1.11 0.00 0.00 175.55 174.96 1xmw s ARG 177 N 1.74 3.63 0.00 -0.62 3.52 -0.29 -4.54 118.95 122.38 1xmw s ARG 177 Ca 0.06 0.11 0.00 0.00 -0.13 0.00 0.00 55.73 55.77 1xmw s ARG 177 Cb -0.18 -3.85 0.00 0.00 -1.56 0.00 0.00 34.95 29.36 1xmw s ARG 177 CO 0.10 -0.89 0.00 -0.12 -0.81 0.00 0.00 175.30 173.58