#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1xmw n ASP 2 N 0.00 7.29 -0.09 -2.24 5.75 -1.26 -4.53 116.55 121.47 1xmw n ASP 2 Ca 0.00 -3.61 -0.14 0.00 -0.01 0.00 0.00 54.79 51.03 1xmw n ASP 2 Cb 0.00 -1.06 -0.07 0.00 -1.03 0.00 0.00 41.12 38.97 1xmw n ASP 2 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 1xmw n ALA 3 N -0.34 0.64 -0.76 2.12 0.00 -1.26 -4.94 120.51 115.97 1xmw n ALA 3 Ca 0.53 -0.47 -0.29 0.00 0.00 0.00 0.00 53.44 53.21 1xmw n ALA 3 Cb 0.50 -0.28 0.21 0.00 0.00 0.00 0.00 19.45 19.88 1xmw n ALA 3 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 177.50 175.50 1xmw s GLU 4 N -2.31 -0.09 0.00 0.00 2.12 -1.26 -4.98 118.70 112.18 1xmw s GLU 4 Ca -0.23 0.91 0.00 0.00 0.36 0.00 0.00 54.97 56.02 1xmw s GLU 4 Cb 0.04 -1.65 0.00 0.00 0.26 0.00 0.00 34.13 32.79 1xmw s GLU 4 CO 0.42 -3.19 0.58 0.27 -0.54 0.00 0.00 175.26 172.80 1xmw n ASN 5 N -4.55 -0.36 -1.65 -1.70 2.04 -1.26 -4.95 115.26 102.84 1xmw n ASN 5 Ca 0.05 -1.16 -0.01 0.00 -0.44 0.00 0.00 54.58 53.02 1xmw n ASN 5 Cb 0.54 0.11 0.26 0.00 -2.53 0.00 0.00 39.78 38.16 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 2.22 -4.24 1.53 -5.35 -1.26 -4.90 119.36 107.36 1xmw n ILE 6 Ca -0.10 -1.15 -0.24 0.00 -0.27 0.00 0.00 62.75 60.99 1xmw n ILE 6 Cb 0.50 -0.41 -0.08 0.00 -1.74 0.00 0.00 39.64 37.91 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 -2.36 2.17 0.37 6.28 -1.05 -1.26 -4.96 118.70 117.89 1xmw s GLU 7 Ca 0.41 -1.75 -0.27 0.00 -0.15 0.00 0.00 54.97 53.22 1xmw s GLU 7 Cb 0.32 -1.98 -0.09 0.00 -0.44 0.00 0.00 34.13 31.94 1xmw s GLU 7 CO 0.11 0.05 1.20 -0.47 0.95 0.00 0.00 175.26 177.10 1xmw s TYR 8 N -2.53 3.11 0.21 4.83 6.14 -1.26 -4.59 117.35 123.26 1xmw s TYR 8 Ca 0.37 1.53 0.11 0.00 0.64 0.00 0.00 57.07 59.72 1xmw s TYR 8 Cb 0.01 -3.46 -0.04 0.00 0.42 0.00 0.00 41.96 38.88 1xmw s TYR 8 CO 0.21 -1.39 -0.18 0.15 0.64 0.00 0.00 175.55 174.97 1xmw s LYS 9 N -2.06 1.74 0.03 4.97 1.02 -1.08 -4.96 119.74 119.39 1xmw s LYS 9 Ca 0.54 -1.51 -0.09 0.00 0.02 0.00 0.00 55.97 54.93 1xmw s LYS 9 Cb -0.33 -1.92 0.00 0.00 -0.52 0.00 0.00 37.83 35.05 1xmw s LYS 9 CO 0.43 0.39 0.17 0.08 -0.92 0.00 0.00 175.35 175.50 1xmw s VAL 10 N -1.91 0.10 -0.38 3.17 1.01 -1.26 0.90 120.40 122.03 1xmw s VAL 10 Ca 0.25 -0.85 0.04 0.00 0.00 0.00 0.00 61.98 61.42 1xmw s VAL 10 Cb -0.07 -0.77 0.16 0.00 0.00 0.00 0.00 36.38 35.69 1xmw s VAL 10 CO 0.13 -0.47 0.41 -0.44 0.00 0.00 0.00 175.10 174.73 1xmw s SER 11 N -1.87 0.86 0.01 3.32 0.01 0.20 -4.96 113.70 111.28 1xmw s SER 11 Ca -0.08 -1.50 -0.19 0.00 1.31 0.00 0.00 55.95 55.49 1xmw s SER 11 Cb -0.03 0.72 -0.06 0.00 0.21 0.00 0.00 66.02 66.86 1xmw s SER 11 CO -0.02 -0.25 0.55 -0.63 0.41 0.00 0.00 173.24 173.30 1xmw s ILE 12 N 1.46 4.88 -0.39 1.44 1.01 -1.26 -2.06 121.20 126.29 1xmw s ILE 12 Ca 0.17 1.16 0.03 0.00 0.00 0.00 0.00 60.65 62.00 1xmw s ILE 12 Cb -0.14 -3.88 0.11 0.00 0.01 0.00 0.00 42.46 38.56 1xmw s ILE 12 CO -0.03 0.48 0.14 -0.44 0.00 0.00 0.00 174.94 175.09 1xmw s SER 13 N -0.57 4.27 1.22 3.58 0.01 -0.79 -4.92 113.70 116.49 1xmw s SER 13 Ca 0.29 -2.32 0.00 0.00 1.31 0.00 0.00 55.95 55.23 1xmw s SER 13 Cb -0.18 -1.34 0.00 0.00 0.21 0.00 0.00 66.02 64.71 1xmw s SER 13 CO 0.17 -0.33 0.00 0.61 0.41 0.00 0.00 173.24 174.09 1xmw n GLY 14 N 3.99 2.10 1.77 3.44 0.00 -1.26 -2.52 105.19 112.71 1xmw n GLY 14 Ca 0.04 -0.22 -0.16 0.00 0.00 0.00 0.00 46.02 45.67 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 2.93 -4.28 2.61 -1.04 -1.26 -4.83 114.28 108.41 1xmw n THR 15 Ca 0.00 -2.41 -0.28 0.00 -2.04 0.00 0.00 64.05 59.32 1xmw n THR 15 Cb 0.00 -0.46 -0.10 0.00 -1.82 0.00 0.00 70.33 67.95 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 -1.94 4.20 -0.24 8.00 0.15 -1.05 -0.36 113.70 122.46 1xmw s SER 16 Ca 0.52 -0.54 -0.04 0.00 0.70 0.00 0.00 55.95 56.59 1xmw s SER 16 Cb 0.45 -0.70 0.09 0.00 -1.71 0.00 0.00 66.02 64.15 1xmw s SER 16 CO 0.05 0.13 0.15 -0.69 1.20 0.00 0.00 173.24 174.09 1xmw s VAL 17 N -1.48 -0.16 -0.41 4.45 1.01 -0.83 -1.89 120.40 121.09 1xmw s VAL 17 Ca 0.23 -0.42 -0.16 0.00 0.00 0.00 0.00 61.98 61.63 1xmw s VAL 17 Cb -0.10 -0.80 0.02 0.00 0.00 0.00 0.00 36.38 35.51 1xmw s VAL 17 CO 0.14 -0.46 0.34 -0.70 0.00 0.00 0.00 175.10 174.41 1xmw s GLU 18 N 2.18 3.03 -0.19 2.72 2.12 -0.87 -0.55 118.70 127.14 1xmw s GLU 18 Ca 0.06 -0.93 -0.08 0.00 0.36 0.00 0.00 54.97 54.39 1xmw s GLU 18 Cb -0.16 -3.97 -0.04 0.00 0.26 0.00 0.00 34.13 30.22 1xmw s GLU 18 CO -0.23 -0.77 0.07 -0.51 -0.54 0.00 0.00 175.26 173.28 1xmw s LEU 19 N 1.82 3.81 -0.39 2.70 1.43 -0.08 0.61 118.68 128.57 1xmw s LEU 19 Ca 0.07 0.06 -0.21 0.00 -1.03 0.00 0.00 54.13 53.02 1xmw s LEU 19 Cb -0.18 -1.97 0.01 0.00 0.03 0.00 0.00 46.19 44.08 1xmw s LEU 19 CO 0.11 0.15 0.66 -0.89 0.23 0.00 0.00 176.35 176.62 1xmw s THR 20 N 0.50 4.83 0.28 5.49 2.01 0.26 0.10 115.64 129.12 1xmw s THR 20 Ca 0.03 0.43 -0.27 0.00 0.31 0.00 0.00 61.69 62.19 1xmw s THR 20 Cb -0.13 -4.15 -0.15 0.00 0.01 0.00 0.00 72.50 68.08 1xmw s THR 20 CO 0.01 -0.46 0.69 0.00 -0.69 0.00 0.00 174.62 174.16 1xmw n PRO 22 N 0.83 0.50 -2.47 0.00 -0.04 -1.26 -4.73 135.00 127.83 1xmw n PRO 22 Ca 0.13 -0.04 -0.01 0.00 -0.04 0.00 0.00 63.50 63.54 1xmw n PRO 22 Cb 0.31 -1.32 0.01 0.00 -0.04 0.00 0.00 33.50 32.46 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 1.87 0.00 -4.77 1.53 -0.00 -1.26 -4.82 117.00 109.55 1xmw n LEU 23 Ca 0.02 -0.67 -0.31 0.00 -0.00 0.00 0.00 56.01 55.05 1xmw n LEU 23 Cb 0.25 1.25 0.09 0.00 -0.00 0.00 0.00 43.42 45.01 1xmw n LEU 23 CO 0.02 -0.22 0.70 -1.81 -0.00 0.00 0.00 177.39 176.07 1xmw s ASP 24 N -2.05 4.50 0.15 1.45 1.01 -1.26 -4.96 116.67 115.51 1xmw s ASP 24 Ca 0.10 1.72 -0.31 0.00 0.71 0.00 0.00 52.55 54.76 1xmw s ASP 24 Cb -0.01 -2.44 -0.08 0.00 1.01 0.00 0.00 42.92 41.39 1xmw s ASP 24 CO 0.03 -2.02 1.39 -0.94 0.21 0.00 0.00 175.17 173.83 1xmw s SER 25 N -3.49 6.81 -0.15 0.27 1.04 -1.26 -4.89 113.70 112.03 1xmw s SER 25 Ca 0.61 2.40 -0.00 0.00 0.48 0.00 0.00 55.95 59.44 1xmw s SER 25 Cb -0.17 -2.60 -0.01 0.00 0.10 0.00 0.00 66.02 63.35 1xmw s SER 25 CO 0.56 -0.64 -0.14 -0.62 0.98 0.00 0.00 173.24 173.38 1xmw s ASP 26 N 0.87 3.79 0.60 7.02 -1.08 -1.26 -4.97 116.67 121.64 1xmw s ASP 26 Ca 0.63 -0.43 0.28 0.00 -0.52 0.00 0.00 52.55 52.51 1xmw s ASP 26 Cb -0.38 -1.59 1.28 0.00 -1.46 0.00 0.00 42.92 40.78 1xmw s ASP 26 CO 0.33 0.10 1.68 -0.08 0.52 0.00 0.00 175.17 177.72 1xmw h GLU 27 N 7.20 0.00 0.00 4.34 4.22 -1.95 1.09 114.58 129.48 1xmw h GLU 27 Ca -0.31 0.00 -0.02 0.00 0.08 0.00 0.00 59.36 59.11 1xmw h GLU 27 Cb 1.19 0.00 -0.05 0.00 0.50 0.00 0.00 28.75 30.40 1xmw h GLU 27 CO 0.57 0.00 -0.57 0.09 -2.18 0.00 0.00 179.01 176.92 1xmw n ASN 28 N -3.50 1.62 -4.57 1.04 3.02 -1.26 -4.93 115.26 106.67 1xmw n ASN 28 Ca 0.13 -3.67 -0.40 0.00 -0.03 0.00 0.00 54.58 50.61 1xmw n ASN 28 Cb 0.97 -0.50 -0.03 0.00 -0.61 0.00 0.00 39.78 39.61 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 -0.92 2.81 -4.74 3.41 7.94 0.38 -4.78 117.00 121.10 1xmw n LEU 29 Ca 0.17 -0.12 -0.39 0.00 -1.11 0.00 0.00 56.01 54.57 1xmw n LEU 29 Cb 0.75 -1.56 -0.06 0.00 0.53 0.00 0.00 43.42 43.08 1xmw n LEU 29 CO -0.04 -1.09 0.27 -0.54 -1.11 0.00 0.00 177.39 174.88 1xmw s LYS 30 N 7.24 4.33 0.49 1.96 1.02 -0.51 -4.19 119.74 130.08 1xmw s LYS 30 Ca 1.00 0.67 0.09 0.00 0.02 0.00 0.00 55.97 57.74 1xmw s LYS 30 Cb -0.27 -3.39 0.05 0.00 -0.52 0.00 0.00 37.83 33.69 1xmw s LYS 30 CO 0.31 0.26 0.67 -1.58 -0.92 0.00 0.00 175.35 174.09 1xmw s TRP 31 N 0.22 2.14 -0.11 3.18 0.52 -1.26 -0.50 118.94 123.12 1xmw s TRP 31 Ca 0.31 -0.56 -0.04 0.00 0.02 0.00 0.00 56.10 55.83 1xmw s TRP 31 Cb -0.17 -2.29 0.06 0.00 -1.15 0.00 0.00 33.47 29.91 1xmw s TRP 31 CO 0.15 -0.76 0.20 -1.21 0.02 0.00 0.00 176.95 175.35 1xmw s GLU 32 N -4.50 0.09 -0.43 4.98 2.02 0.43 -2.33 118.70 118.97 1xmw s GLU 32 Ca 0.58 0.57 -0.11 0.00 0.02 0.00 0.00 54.97 56.03 1xmw s GLU 32 Cb -0.08 -0.33 0.07 0.00 0.10 0.00 0.00 34.13 33.90 1xmw s GLU 32 CO 0.36 -0.35 0.30 0.21 0.02 0.00 0.00 175.26 175.80 1xmw s LYS 33 N 2.34 2.75 -1.50 1.61 2.20 0.33 -2.25 119.74 125.22 1xmw s LYS 33 Ca 0.03 -1.37 0.00 0.00 -0.36 0.00 0.00 55.97 54.27 1xmw s LYS 33 Cb -0.12 -3.89 0.00 0.00 -1.51 0.00 0.00 37.83 32.31 1xmw s LYS 33 CO -0.07 -0.94 0.00 -1.71 -0.36 0.00 0.00 175.35 172.26 1xmw n ASN 34 N 5.02 -4.35 0.00 1.43 5.15 -0.75 -0.43 115.26 121.33 1xmw n ASN 34 Ca -0.11 0.26 0.00 0.00 -0.60 0.00 0.00 54.58 54.13 1xmw n ASN 34 Cb 0.44 -3.82 0.00 0.00 -0.53 0.00 0.00 39.78 35.86 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 -0.56 1.85 3.65 8.20 0.00 -1.26 -4.98 105.19 112.08 1xmw n GLY 35 Ca -0.17 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.43 1xmw n GLY 35 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 1xmw s GLN 36 N -0.08 4.17 0.59 1.61 2.00 0.43 -5.00 119.66 123.38 1xmw s GLN 36 Ca 0.00 1.12 -0.17 0.00 -2.00 0.00 0.00 55.36 54.32 1xmw s GLN 36 Cb 0.00 -3.67 -0.04 0.00 0.80 0.00 0.00 33.01 30.10 1xmw s GLN 36 CO 0.00 -0.66 1.08 -1.21 -0.50 0.00 0.00 175.29 174.00 1xmw s GLU 37 N 3.17 3.26 -0.58 1.67 2.02 -1.26 0.12 118.70 127.10 1xmw s GLU 37 Ca 0.41 1.32 -0.04 0.00 0.02 0.00 0.00 54.97 56.68 1xmw s GLU 37 Cb -0.14 -2.02 0.15 0.00 0.10 0.00 0.00 34.13 32.22 1xmw s GLU 37 CO 0.09 -0.87 0.41 -0.51 0.02 0.00 0.00 175.26 174.39 1xmw s LEU 38 N -4.36 5.41 -1.06 1.80 1.02 -0.98 -4.83 118.68 115.68 1xmw s LEU 38 Ca 0.66 -2.58 -0.10 0.00 0.02 0.00 0.00 54.13 52.13 1xmw s LEU 38 Cb -0.18 -1.89 -0.07 0.00 0.02 0.00 0.00 46.19 44.06 1xmw s LEU 38 CO 0.34 -0.46 2.23 -0.81 0.02 0.00 0.00 176.35 177.68 1xmw n PRO 39 N 3.90 2.32 -3.56 1.29 -0.04 -1.26 -4.34 135.00 133.31 1xmw n PRO 39 Ca 0.05 -1.77 -0.08 0.00 -0.04 0.00 0.00 63.50 61.65 1xmw n PRO 39 Cb 0.40 -2.68 -0.03 0.00 -0.04 0.00 0.00 33.50 31.14 1xmw n PRO 39 CO 0.00 0.00 0.00 -0.65 -0.04 0.00 0.00 175.50 174.81 1xmw s GLN 40 N 3.50 0.61 0.00 0.54 -0.21 -1.26 -5.01 119.66 117.83 1xmw s GLN 40 Ca 0.49 -0.06 0.00 0.00 0.02 0.00 0.00 55.36 55.81 1xmw s GLN 40 Cb 0.13 0.28 0.00 0.00 1.00 0.00 0.00 33.01 34.42 1xmw s GLN 40 CO -0.01 -0.23 0.00 1.17 -2.12 0.00 0.00 175.29 174.09 1xmw n LYS 41 N 0.23 0.00 -3.09 2.91 4.81 -1.26 -4.66 118.16 117.10 1xmw n LYS 41 Ca -0.08 0.00 -0.21 0.00 -0.87 0.00 0.00 58.31 57.15 1xmw n LYS 41 Cb 0.59 0.00 0.01 0.00 0.02 0.00 0.00 35.03 35.65 1xmw n LYS 41 CO 0.00 0.00 0.00 0.72 1.17 0.00 0.00 177.40 179.29 1xmw n HIS 42 N 0.00 -1.77 -3.70 5.64 8.25 -1.26 -4.95 115.22 117.43 1xmw n HIS 42 Ca 0.00 0.40 -0.24 0.00 -0.26 0.00 0.00 57.72 57.62 1xmw n HIS 42 Cb 0.00 -3.42 -0.02 0.00 1.12 0.00 0.00 29.99 27.67 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 -2.59 6.33 0.47 0.41 1.01 -1.26 -3.81 116.67 117.23 1xmw s ASP 43 Ca 0.30 0.28 0.13 0.00 0.71 0.00 0.00 52.55 53.97 1xmw s ASP 43 Cb -0.15 -1.96 1.10 0.00 1.01 0.00 0.00 42.92 42.92 1xmw s ASP 43 CO 0.37 -0.13 2.09 0.50 0.21 0.00 0.00 175.17 178.20 1xmw h LYS 44 N 1.28 0.24 -5.11 8.23 3.64 -1.90 -3.40 116.57 119.55 1xmw h LYS 44 Ca -0.50 -0.01 -0.62 0.00 -1.27 0.00 0.00 60.65 58.24 1xmw h LYS 44 Cb 1.21 -0.06 -0.16 0.00 -0.41 0.00 0.00 32.23 32.82 1xmw h LYS 44 CO 0.63 0.16 -0.54 -1.01 -2.27 0.00 0.00 179.45 176.43 1xmw s HIS 45 N -5.26 3.27 -0.67 1.91 3.76 -1.26 0.10 115.29 117.14 1xmw s HIS 45 Ca -0.06 0.10 -0.13 0.00 -0.15 0.00 0.00 55.06 54.81 1xmw s HIS 45 Cb 0.18 -2.22 0.17 0.00 1.11 0.00 0.00 32.58 31.82 1xmw s HIS 45 CO 0.70 0.03 0.60 -1.17 -0.85 0.00 0.00 174.74 174.05 1xmw s LEU 46 N 0.97 6.33 -0.10 0.89 2.96 0.29 -4.80 118.68 125.21 1xmw s LEU 46 Ca 0.06 -2.29 -0.24 0.00 -0.22 0.00 0.00 54.13 51.44 1xmw s LEU 46 Cb -0.13 -2.16 -0.03 0.00 0.50 0.00 0.00 46.19 44.36 1xmw s LEU 46 CO 0.03 -0.68 0.74 -0.69 -1.32 0.00 0.00 176.35 174.43 1xmw s VAL 47 N 0.80 5.00 -0.38 1.68 1.01 -1.25 -0.90 120.40 126.36 1xmw s VAL 47 Ca 0.11 1.49 -0.03 0.00 0.00 0.00 0.00 61.98 63.55 1xmw s VAL 47 Cb -0.20 -4.07 0.09 0.00 0.00 0.00 0.00 36.38 32.21 1xmw s VAL 47 CO -0.03 0.19 0.16 -0.76 0.00 0.00 0.00 175.10 174.65 1xmw s LEU 48 N 1.19 4.94 0.38 3.92 1.43 0.29 -4.86 118.68 125.97 1xmw s LEU 48 Ca 0.38 -1.82 -0.24 0.00 -1.03 0.00 0.00 54.13 51.41 1xmw s LEU 48 Cb -0.17 -1.81 -0.09 0.00 0.03 0.00 0.00 46.19 44.14 1xmw s LEU 48 CO 0.17 -0.48 1.02 -1.10 0.23 0.00 0.00 176.35 176.20 1xmw s GLN 49 N 1.18 4.26 -1.34 1.70 1.11 -1.26 -1.97 119.66 123.34 1xmw s GLN 49 Ca 0.05 1.46 -0.01 0.00 0.01 0.00 0.00 55.36 56.87 1xmw s GLN 49 Cb -0.22 -2.58 0.00 0.00 -1.01 0.00 0.00 33.01 29.21 1xmw s GLN 49 CO -0.03 -0.05 0.65 -0.25 0.01 0.00 0.00 175.29 175.62 1xmw n ASP 50 N 0.03 -1.11 -4.61 5.90 9.92 -1.04 -4.80 116.55 120.83 1xmw n ASP 50 Ca 0.04 -0.86 -0.43 0.00 -0.53 0.00 0.00 54.79 53.02 1xmw n ASP 50 Cb 0.50 -3.84 -0.03 0.00 -0.64 0.00 0.00 41.12 37.11 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 -3.72 1.28 0.31 1.24 2.19 0.51 -4.94 117.98 114.86 1xmw s PHE 51 Ca 0.03 0.40 -0.28 0.00 0.33 0.00 0.00 56.93 57.42 1xmw s PHE 51 Cb -0.02 -4.00 -0.09 0.00 -1.31 0.00 0.00 43.02 37.61 1xmw s PHE 51 CO 0.83 -4.14 1.07 -1.12 1.83 0.00 0.00 175.22 173.69 1xmw s SER 52 N 7.35 7.14 0.11 6.13 0.01 -1.26 -4.50 113.70 128.68 1xmw s SER 52 Ca 0.95 2.17 -0.25 0.00 1.31 0.00 0.00 55.95 60.13 1xmw s SER 52 Cb -0.33 -2.61 -0.08 0.00 0.21 0.00 0.00 66.02 63.21 1xmw s SER 52 CO 0.36 -0.23 1.66 -0.33 0.41 0.00 0.00 173.24 175.11 1xmw h GLU 53 N 3.42 -0.34 0.00 12.44 5.08 -1.83 -0.99 114.58 132.37 1xmw h GLU 53 Ca -0.47 0.02 -0.31 0.00 -1.00 0.00 0.00 59.36 57.60 1xmw h GLU 53 Cb 1.21 0.08 -0.06 0.00 0.50 0.00 0.00 28.75 30.48 1xmw h GLU 53 CO 0.65 -0.23 -2.16 0.28 -1.00 0.00 0.00 179.01 176.55 1xmw n VAL 54 N -5.32 1.32 1.46 3.13 0.31 -1.26 -3.31 118.33 114.66 1xmw n VAL 54 Ca -0.06 -0.81 0.15 0.00 -0.01 0.00 0.00 64.34 63.61 1xmw n VAL 54 Cb 0.24 -0.56 0.77 0.00 -0.91 0.00 0.00 33.84 33.38 1xmw n VAL 54 CO 0.00 0.00 0.00 1.21 -1.32 0.00 0.00 176.83 176.72 1xmw n GLU 55 N -2.78 0.46 0.00 5.55 4.07 -1.24 -3.64 120.64 123.06 1xmw n GLU 55 Ca -0.26 0.00 0.00 0.00 -0.06 0.00 0.00 57.16 56.84 1xmw n GLU 55 Cb 1.07 -1.50 0.00 0.00 -0.06 0.00 0.00 31.44 30.95 1xmw n GLU 55 CO 0.00 0.00 0.00 -3.47 -0.06 0.00 0.00 177.13 173.60 1xmw n ASP 56 N -1.27 0.68 -4.82 4.31 -0.08 -0.38 -4.78 116.55 110.21 1xmw n ASP 56 Ca 0.15 -1.28 -0.33 0.00 -1.51 0.00 0.00 54.79 51.82 1xmw n ASP 56 Cb 0.23 0.00 -0.06 0.00 2.34 0.00 0.00 41.12 43.63 1xmw n ASP 56 CO 0.00 0.00 0.00 -0.44 0.12 0.00 0.00 177.20 176.88 1xmw s SER 57 N -0.28 5.92 0.00 1.67 0.01 -1.21 -4.90 113.70 114.91 1xmw s SER 57 Ca 0.00 0.22 0.00 0.00 1.31 0.00 0.00 55.95 57.48 1xmw s SER 57 Cb 0.00 -1.76 0.00 0.00 0.21 0.00 0.00 66.02 64.47 1xmw s SER 57 CO 0.00 0.27 0.00 0.61 0.41 0.00 0.00 173.24 174.53 1xmw n GLY 58 N 1.12 -0.01 3.92 3.44 0.00 -0.98 -4.95 105.19 107.73 1xmw n GLY 58 Ca -0.12 -0.92 -0.27 0.00 0.00 0.00 0.00 46.02 44.71 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 3.48 -0.17 1.61 2.02 -1.26 -0.84 117.35 118.18 1xmw s TYR 59 Ca 0.00 0.44 -0.08 0.00 -0.37 0.00 0.00 57.07 57.06 1xmw s TYR 59 Cb 0.00 -1.94 0.07 0.00 -0.40 0.00 0.00 41.96 39.68 1xmw s TYR 59 CO 0.00 0.28 0.40 0.71 -1.57 0.00 0.00 175.55 175.37 1xmw s TYR 60 N -2.00 -0.63 0.04 2.71 2.02 0.13 -1.81 117.35 117.82 1xmw s TYR 60 Ca 0.40 1.32 -0.22 0.00 -0.37 0.00 0.00 57.07 58.20 1xmw s TYR 60 Cb -0.11 0.26 0.05 0.00 -0.40 0.00 0.00 41.96 41.76 1xmw s TYR 60 CO 0.30 -0.37 0.51 0.54 -1.57 0.00 0.00 175.55 174.96 1xmw s VAL 61 N 1.68 0.03 0.03 0.71 0.11 -0.95 -1.89 120.40 120.12 1xmw s VAL 61 Ca -0.08 -0.26 -0.01 0.00 -2.93 0.00 0.00 61.98 58.70 1xmw s VAL 61 Cb -0.09 -0.97 -0.03 0.00 -1.53 0.00 0.00 36.38 33.76 1xmw s VAL 61 CO -0.13 -0.15 -0.02 0.00 -3.33 0.00 0.00 175.10 171.48 1xmw s TYR 63 N -2.61 -0.17 0.32 0.00 -0.85 0.34 -4.79 117.35 109.60 1xmw s TYR 63 Ca -0.05 -0.18 0.03 0.00 -0.52 0.00 0.00 57.07 56.35 1xmw s TYR 63 Cb -0.02 0.47 -0.06 0.00 0.38 0.00 0.00 41.96 42.73 1xmw s TYR 63 CO -0.05 -0.98 0.06 0.95 -1.52 0.00 0.00 175.55 174.01 1xmw s THR 64 N -3.87 1.12 -0.57 -3.49 -4.23 -0.48 -1.43 115.64 102.69 1xmw s THR 64 Ca 0.09 -2.00 0.22 0.00 -1.18 0.00 0.00 61.69 58.82 1xmw s THR 64 Cb -0.02 -2.78 0.23 0.00 1.34 0.00 0.00 72.50 71.27 1xmw s THR 64 CO -0.01 0.00 1.67 -0.81 -0.54 0.00 0.00 174.62 174.92 1xmw n PRO 65 N -0.67 0.16 -0.02 3.99 -0.04 -1.26 -3.05 135.00 134.11 1xmw n PRO 65 Ca -0.02 0.39 -0.00 0.00 -0.04 0.00 0.00 63.50 63.83 1xmw n PRO 65 Cb 0.67 -1.81 -0.06 0.00 -0.04 0.00 0.00 33.50 32.26 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 -1.73 2.03 -3.99 0.55 0.00 -1.26 -4.90 120.51 111.22 1xmw n ALA 66 Ca 0.02 -0.35 -0.32 0.00 0.00 0.00 0.00 53.44 52.79 1xmw n ALA 66 Cb 0.22 -0.07 -0.15 0.00 0.00 0.00 0.00 19.45 19.45 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 -3.46 4.76 -0.34 0.00 1.04 -1.17 -5.07 113.70 109.46 1xmw s SER 67 Ca -0.03 -1.94 -0.05 0.00 0.48 0.00 0.00 55.95 54.41 1xmw s SER 67 Cb 0.03 -1.64 0.05 0.00 0.10 0.00 0.00 66.02 64.57 1xmw s SER 67 CO 0.31 -0.35 0.09 0.20 0.98 0.00 0.00 173.24 174.47 1xmw s ASN 68 N 1.06 5.19 -0.20 7.02 -0.87 -1.26 -1.38 114.94 124.50 1xmw s ASN 68 Ca 0.06 -1.28 0.00 0.00 -1.57 0.00 0.00 52.86 50.07 1xmw s ASN 68 Cb -0.20 -1.82 0.05 0.00 -0.02 0.00 0.00 41.25 39.26 1xmw s ASN 68 CO -0.07 -0.34 -0.08 -0.75 -2.57 0.00 0.00 177.10 173.30 1xmw s LYS 69 N 1.33 1.77 -0.60 -0.60 2.20 -1.26 -5.06 119.74 117.53 1xmw s LYS 69 Ca -0.02 -0.80 -0.26 0.00 -0.36 0.00 0.00 55.97 54.53 1xmw s LYS 69 Cb -0.20 -2.36 -0.05 0.00 -1.51 0.00 0.00 37.83 33.70 1xmw s LYS 69 CO 0.01 -0.47 2.15 -0.80 -0.36 0.00 0.00 175.35 175.87 1xmw s ASN 70 N 1.46 4.79 -0.30 1.43 0.02 -1.26 -4.87 114.94 116.20 1xmw s ASN 70 Ca -0.02 0.56 -0.03 0.00 -1.02 0.00 0.00 52.86 52.35 1xmw s ASN 70 Cb -0.17 -2.52 0.11 0.00 0.02 0.00 0.00 41.25 38.69 1xmw s ASN 70 CO -0.08 -2.74 0.14 -0.89 0.02 0.00 0.00 177.10 173.55 1xmw s THR 71 N 10.96 0.07 -0.06 1.60 2.01 -1.26 -2.41 115.64 126.57 1xmw s THR 71 Ca 0.82 -0.96 -0.14 0.00 0.31 0.00 0.00 61.69 61.73 1xmw s THR 71 Cb -0.14 -1.08 -0.05 0.00 0.01 0.00 0.00 72.50 71.24 1xmw s THR 71 CO 0.20 -0.76 0.36 -0.31 -0.69 0.00 0.00 174.62 173.43 1xmw s TYR 72 N 1.91 3.64 -0.12 4.92 1.51 -0.90 -4.59 117.35 123.73 1xmw s TYR 72 Ca 0.10 0.85 -0.00 0.00 -1.01 0.00 0.00 57.07 57.01 1xmw s TYR 72 Cb -0.17 -2.28 0.02 0.00 -0.11 0.00 0.00 41.96 39.42 1xmw s TYR 72 CO -0.31 0.54 -0.08 -1.17 -1.11 0.00 0.00 175.55 173.42 1xmw s LEU 73 N -0.63 1.25 -0.20 -1.29 0.20 -0.79 -1.56 118.68 115.65 1xmw s LEU 73 Ca 0.22 -0.32 -0.15 0.00 0.69 0.00 0.00 54.13 54.56 1xmw s LEU 73 Cb -0.15 -0.88 -0.04 0.00 -0.43 0.00 0.00 46.19 44.68 1xmw s LEU 73 CO 0.10 -0.11 0.36 -0.47 -0.29 0.00 0.00 176.35 175.94 1xmw s TYR 74 N 1.67 3.37 -0.05 5.38 5.04 -0.57 0.20 117.35 132.38 1xmw s TYR 74 Ca 0.05 0.56 0.06 0.00 -2.44 0.00 0.00 57.07 55.30 1xmw s TYR 74 Cb -0.13 -2.48 -0.01 0.00 0.35 0.00 0.00 41.96 39.69 1xmw s TYR 74 CO -0.08 0.01 -0.24 -1.17 -1.34 0.00 0.00 175.55 172.73 1xmw s LEU 75 N 1.23 2.16 -0.31 6.97 2.96 -0.02 -2.61 118.68 129.07 1xmw s LEU 75 Ca 0.17 -0.46 -0.02 0.00 -0.22 0.00 0.00 54.13 53.60 1xmw s LEU 75 Cb -0.14 -1.40 0.11 0.00 0.50 0.00 0.00 46.19 45.26 1xmw s LEU 75 CO 0.07 0.27 0.13 -0.75 -1.32 0.00 0.00 176.35 174.75 1xmw s LYS 76 N -0.28 0.51 0.38 1.98 2.47 -1.11 -2.32 119.74 121.37 1xmw s LYS 76 Ca 0.00 -0.93 0.06 0.00 -1.56 0.00 0.00 55.97 53.54 1xmw s LYS 76 Cb -0.13 -1.60 -0.07 0.00 -1.46 0.00 0.00 37.83 34.57 1xmw s LYS 76 CO 0.03 -1.03 0.02 0.00 0.16 0.00 0.00 175.35 174.53 1xmw s ALA 77 N 1.69 2.93 -0.12 3.13 0.00 -1.26 0.16 121.76 128.29 1xmw s ALA 77 Ca 0.11 -2.23 -0.01 0.00 0.00 0.00 0.00 51.96 49.82 1xmw s ALA 77 Cb -0.18 0.31 0.03 0.00 0.00 0.00 0.00 23.12 23.29 1xmw s ALA 77 CO -0.26 -0.17 -0.03 0.50 0.00 0.00 0.00 175.76 175.80 1xmw s ARG 78 N -3.76 1.03 -0.15 0.00 3.52 -1.12 -4.65 118.95 113.82 1xmw s ARG 78 Ca 0.35 -0.18 -0.04 0.00 -0.13 0.00 0.00 55.73 55.74 1xmw s ARG 78 Cb 0.10 -1.48 0.07 0.00 -1.56 0.00 0.00 34.95 32.07 1xmw s ARG 78 CO 0.17 -0.36 0.22 0.14 -0.81 0.00 0.00 175.30 174.67 1xmw s VAL 79 N 1.82 -0.35 0.27 7.11 -7.23 -1.26 -5.02 120.40 115.75 1xmw s VAL 79 Ca 0.04 0.16 0.11 0.00 -1.81 0.00 0.00 61.98 60.48 1xmw s VAL 79 Cb -0.13 -0.49 -0.05 0.00 0.56 0.00 0.00 36.38 36.26 1xmw s VAL 79 CO -0.07 0.01 -0.19 -0.83 -0.31 0.00 0.00 175.10 173.71 1xmw s GLY 80 N 2.36 1.82 -0.01 2.32 0.00 -1.26 -4.58 107.32 107.98 1xmw s GLY 80 Ca 0.04 -1.85 0.02 0.00 0.00 0.00 0.00 44.72 42.93 1xmw s GLY 80 CO -0.09 -1.94 -0.05 -1.35 0.00 0.00 0.00 173.10 169.67 1xmw s SER 81 N -3.48 0.63 -0.31 1.64 1.04 -1.26 -4.97 113.70 106.99 1xmw s SER 81 Ca 0.29 -0.10 0.11 0.00 0.48 0.00 0.00 55.95 56.73 1xmw s SER 81 Cb -0.04 -0.09 0.46 0.00 0.10 0.00 0.00 66.02 66.45 1xmw s SER 81 CO 0.14 0.06 1.14 0.00 0.98 0.00 0.00 173.24 175.55 1xmw n ALA 82 N 3.04 4.36 -0.03 5.32 0.00 -1.26 -4.81 120.51 127.13 1xmw n ALA 82 Ca -0.14 -3.61 -0.07 0.00 0.00 0.00 0.00 53.44 49.63 1xmw n ALA 82 Cb 0.58 -0.53 -0.02 0.00 0.00 0.00 0.00 19.45 19.47 1xmw n ALA 82 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.50 174.03 1xmw n ASP 83 N -0.59 0.95 -2.99 0.00 -0.08 -1.26 -4.73 116.55 107.84 1xmw n ASP 83 Ca 0.32 0.15 -0.33 0.00 -1.51 0.00 0.00 54.79 53.41 1xmw n ASP 83 Cb 0.86 -0.35 -0.03 0.00 2.34 0.00 0.00 41.12 43.94 1xmw n ASP 83 CO 0.00 0.00 0.00 -0.67 0.12 0.00 0.00 177.20 176.65 1xmw n ASP 84 N -3.57 7.27 -3.62 1.67 2.03 -1.26 -4.81 116.55 114.26 1xmw n ASP 84 Ca -0.13 -3.17 -0.28 0.00 0.52 0.00 0.00 54.79 51.73 1xmw n ASP 84 Cb 0.44 -1.30 -0.16 0.00 -0.72 0.00 0.00 41.12 39.39 1xmw n ASP 84 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 1xmw s ALA 85 N -1.42 0.75 0.00 -1.67 0.00 -1.26 -4.96 121.76 113.21 1xmw s ALA 85 Ca 0.56 -0.89 0.00 0.00 0.00 0.00 0.00 51.96 51.63 1xmw s ALA 85 Cb 0.28 -1.29 0.00 0.00 0.00 0.00 0.00 23.12 22.11 1xmw s ALA 85 CO -0.16 -1.45 0.99 0.36 0.00 0.00 0.00 175.76 175.51 1xmw n LYS 86 N 5.17 0.00 -2.93 0.00 2.85 -1.26 -5.07 118.16 116.92 1xmw n LYS 86 Ca -0.06 -0.98 -0.02 0.00 -1.05 0.00 0.00 58.31 56.20 1xmw n LYS 86 Cb 0.45 -0.49 0.00 0.00 -0.65 0.00 0.00 35.03 34.34 1xmw n LYS 86 CO 0.00 0.00 0.00 1.63 -0.05 0.00 0.00 177.40 178.98 1xmw n LYS 87 N 0.00 -2.18 -0.00 -1.58 5.02 -1.26 -4.99 118.16 113.17 1xmw n LYS 87 Ca 0.00 1.96 -0.00 0.00 -2.02 0.00 0.00 58.31 58.25 1xmw n LYS 87 Cb 0.70 -3.62 -0.00 0.00 -0.02 0.00 0.00 35.03 32.08 1xmw n LYS 87 CO 0.00 0.00 0.00 -0.44 -0.52 0.00 0.00 177.40 176.44 1xmw h ASP 88 N 3.19 0.00 0.00 4.39 3.32 -1.99 -3.49 116.42 121.84 1xmw h ASP 88 Ca -0.02 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.03 1xmw h ASP 88 Cb 0.47 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.02 1xmw h ASP 88 CO 0.07 0.03 0.00 0.00 -1.72 0.00 0.00 179.24 177.62 1xmw n ALA 89 N -2.30 3.00 -0.61 3.45 0.00 -1.26 -5.11 120.51 117.68 1xmw n ALA 89 Ca -0.00 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.44 1xmw n ALA 89 Cb 0.01 0.06 0.00 0.00 0.00 0.00 0.00 19.45 19.52 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 -3.35 0.25 -3.16 0.00 0.00 -1.26 -5.10 120.51 107.89 1xmw n ALA 90 Ca 0.00 0.00 -0.20 0.00 0.00 0.00 0.00 53.44 53.24 1xmw n ALA 90 Cb 0.00 0.00 0.02 0.00 0.00 0.00 0.00 19.45 19.47 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 -1.58 -2.09 -0.32 0.00 5.02 -1.26 -4.92 118.16 113.01 1xmw n LYS 91 Ca 0.00 1.74 0.08 0.00 -2.02 0.00 0.00 58.31 58.11 1xmw n LYS 91 Cb 0.00 -4.17 0.20 0.00 -0.02 0.00 0.00 35.03 31.04 1xmw n LYS 91 CO 0.00 0.00 0.00 1.63 -0.52 0.00 0.00 177.40 178.51 1xmw n LYS 92 N -0.52 1.98 -2.80 1.97 5.02 -1.26 -5.04 118.16 117.51 1xmw n LYS 92 Ca 0.01 -2.79 -0.02 0.00 -2.02 0.00 0.00 58.31 53.48 1xmw n LYS 92 Cb 0.56 -1.67 -0.02 0.00 -0.02 0.00 0.00 35.03 33.88 1xmw n LYS 92 CO 0.00 0.00 0.00 -3.47 -0.52 0.00 0.00 177.40 173.41 1xmw n ASP 93 N -1.04 -4.53 -4.56 4.39 2.03 -1.26 -4.58 116.55 107.00 1xmw n ASP 93 Ca 0.20 1.18 -0.14 0.00 0.52 0.00 0.00 54.79 56.55 1xmw n ASP 93 Cb 0.78 -4.08 -0.08 0.00 -0.72 0.00 0.00 41.12 37.02 1xmw n ASP 93 CO 0.00 0.00 0.00 0.47 -1.92 0.00 0.00 177.20 175.75 1xmw n ASP 94 N 1.58 1.68 -2.82 1.67 8.00 -1.26 -4.61 116.55 120.79 1xmw n ASP 94 Ca -0.18 -1.45 -0.01 0.00 0.71 0.00 0.00 54.79 53.86 1xmw n ASP 94 Cb 0.34 -1.62 0.05 0.00 -0.02 0.00 0.00 41.12 39.87 1xmw n ASP 94 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1xmw n ALA 95 N 18.22 2.67 -1.18 2.24 0.00 -1.26 -4.88 120.51 136.32 1xmw n ALA 95 Ca 0.48 -2.79 -0.24 0.00 0.00 0.00 0.00 53.44 50.88 1xmw n ALA 95 Cb 0.42 -0.88 0.17 0.00 0.00 0.00 0.00 19.45 19.15 1xmw n ALA 95 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 1xmw n LYS 96 N -0.56 2.26 -1.42 0.00 5.02 -1.26 -4.94 118.16 117.26 1xmw n LYS 96 Ca 0.07 -2.95 0.00 0.00 -2.02 0.00 0.00 58.31 53.42 1xmw n LYS 96 Cb 0.80 -2.16 0.00 0.00 -0.02 0.00 0.00 35.03 33.66 1xmw n LYS 96 CO 0.00 0.00 0.00 1.63 -0.52 0.00 0.00 177.40 178.51 1xmw n LYS 97 N -1.08 2.50 -3.34 1.97 5.02 -1.26 -4.90 118.16 117.07 1xmw n LYS 97 Ca 0.59 0.00 -0.14 0.00 -2.02 0.00 0.00 58.31 56.73 1xmw n LYS 97 Cb 1.55 0.00 0.03 0.00 -0.02 0.00 0.00 35.03 36.59 1xmw n LYS 97 CO 0.00 0.00 0.00 -3.47 -0.52 0.00 0.00 177.40 173.41 1xmw n ASP 98 N -0.79 -6.58 -4.16 4.39 -0.08 -1.26 -4.95 116.55 103.12 1xmw n ASP 98 Ca 0.00 -0.58 -0.39 0.00 -1.51 0.00 0.00 54.79 52.31 1xmw n ASP 98 Cb 0.00 -4.44 -0.08 0.00 2.34 0.00 0.00 41.12 38.94 1xmw n ASP 98 CO 0.00 0.00 0.00 -0.62 0.12 0.00 0.00 177.20 176.70 1xmw s ASP 99 N -3.22 5.62 0.14 1.67 2.15 -1.26 -4.92 116.67 116.85 1xmw s ASP 99 Ca 0.25 -2.68 -0.12 0.00 0.43 0.00 0.00 52.55 50.42 1xmw s ASP 99 Cb -0.06 -1.95 -0.01 0.00 -0.30 0.00 0.00 42.92 40.61 1xmw s ASP 99 CO 0.79 -0.46 1.55 0.00 -0.17 0.00 0.00 175.17 176.88 1xmw h ALA 100 N 7.39 0.62 -5.19 3.66 0.00 -1.93 -3.47 119.26 120.34 1xmw h ALA 100 Ca -0.02 -0.34 -0.39 0.00 0.00 0.00 0.00 54.91 54.17 1xmw h ALA 100 Cb 0.99 -0.16 -0.04 0.00 0.00 0.00 0.00 17.79 18.58 1xmw h ALA 100 CO 0.74 0.51 -0.58 1.17 0.00 0.00 0.00 179.25 181.09 1xmw n LYS 101 N -4.26 -3.91 -3.55 0.00 4.81 -1.26 -2.28 118.16 107.71 1xmw n LYS 101 Ca -0.00 0.61 -0.25 0.00 -0.87 0.00 0.00 58.31 57.79 1xmw n LYS 101 Cb 0.38 -5.37 0.04 0.00 0.02 0.00 0.00 35.03 30.11 1xmw n LYS 101 CO 0.00 0.00 0.00 1.63 1.17 0.00 0.00 177.40 180.20 1xmw n LYS 102 N -3.85 -1.41 -3.24 1.64 4.76 -1.26 -4.99 118.16 109.81 1xmw n LYS 102 Ca -0.04 0.67 -0.02 0.00 -2.87 0.00 0.00 58.31 56.05 1xmw n LYS 102 Cb 0.56 -4.42 -0.04 0.00 -1.84 0.00 0.00 35.03 29.29 1xmw n LYS 102 CO 0.00 0.00 0.00 0.34 -1.37 0.00 0.00 177.40 176.37 1xmw s ASP 103 N -3.35 -0.68 -0.23 4.39 2.15 -0.96 -5.02 116.67 112.96 1xmw s ASP 103 Ca 0.38 0.54 -0.07 0.00 0.43 0.00 0.00 52.55 53.83 1xmw s ASP 103 Cb -0.12 1.70 0.01 0.00 -0.30 0.00 0.00 42.92 44.21 1xmw s ASP 103 CO 0.83 -0.28 0.27 0.61 -0.17 0.00 0.00 175.17 176.43 1xmw n GLY 104 N 5.40 -1.63 0.00 2.66 0.00 -1.26 -4.96 105.19 105.40 1xmw n GLY 104 Ca -0.02 0.56 0.00 0.00 0.00 0.00 0.00 46.02 46.57 1xmw n GLY 104 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1xmw n SER 105 N -0.21 0.00 -4.74 1.61 3.41 -1.26 -5.08 113.62 107.35 1xmw n SER 105 Ca 0.05 -0.17 -0.41 0.00 -0.26 0.00 0.00 58.87 58.08 1xmw n SER 105 Cb 0.21 0.00 -0.04 0.00 -0.26 0.00 0.00 64.21 64.12 1xmw n SER 105 CO 0.00 0.00 0.00 -1.58 -0.16 0.00 0.00 175.04 173.30 1xmw s GLN 106 N 0.48 4.56 -0.43 4.33 0.74 -1.26 -4.96 119.66 123.11 1xmw s GLN 106 Ca 0.00 1.76 0.06 0.00 0.05 0.00 0.00 55.36 57.23 1xmw s GLN 106 Cb 0.00 -3.27 0.42 0.00 1.10 0.00 0.00 33.01 31.26 1xmw s GLN 106 CO 0.00 0.01 1.09 0.25 -0.55 0.00 0.00 175.29 176.09 1xmw n THR 107 N 2.52 2.22 -3.64 -0.34 -2.24 -1.26 -5.01 114.28 106.53 1xmw n THR 107 Ca 0.04 -4.74 -0.10 0.00 -2.27 0.00 0.00 64.05 56.98 1xmw n THR 107 Cb 0.46 -1.05 -0.07 0.00 -2.10 0.00 0.00 70.33 67.56 1xmw n THR 107 CO 0.00 0.00 0.00 0.21 -0.57 0.00 0.00 175.07 174.71 1xmw s ASN 108 N -3.49 -0.84 -0.30 3.42 2.47 -1.26 -5.15 114.94 109.79 1xmw s ASN 108 Ca 0.46 1.43 -0.08 0.00 0.42 0.00 0.00 52.86 55.09 1xmw s ASN 108 Cb 0.40 1.35 0.16 0.00 -1.45 0.00 0.00 41.25 41.71 1xmw s ASN 108 CO -0.16 -0.24 0.71 -1.59 -3.72 0.00 0.00 177.10 172.10 1xmw s LYS 109 N 1.18 0.51 -0.21 0.43 0.00 -1.26 -5.04 119.74 115.35 1xmw s LYS 109 Ca -0.07 1.14 0.14 0.00 0.00 0.00 0.00 55.97 57.18 1xmw s LYS 109 Cb -0.05 0.67 0.34 0.00 0.00 0.00 0.00 37.83 38.79 1xmw s LYS 109 CO -0.12 -0.32 1.28 0.00 0.00 0.00 0.00 175.35 176.19 1xmw n ALA 110 N 5.38 2.96 0.00 0.59 0.00 -1.26 -4.92 120.51 123.25 1xmw n ALA 110 Ca -0.08 -1.49 0.00 0.00 0.00 0.00 0.00 53.44 51.87 1xmw n ALA 110 Cb 0.50 -0.72 0.00 0.00 0.00 0.00 0.00 19.45 19.24 1xmw n ALA 110 CO 0.00 0.00 0.00 0.36 0.00 0.00 0.00 177.50 177.86 1xmw n LYS 111 N -0.75 2.70 -1.87 0.00 2.85 -1.26 -4.92 118.16 114.90 1xmw n LYS 111 Ca -0.12 0.00 -0.22 0.00 -1.05 0.00 0.00 58.31 56.92 1xmw n LYS 111 Cb 0.85 -0.91 -0.06 0.00 -0.65 0.00 0.00 35.03 34.26 1xmw n LYS 111 CO 0.00 0.00 0.00 1.03 -0.05 0.00 0.00 177.40 178.38 1xmw s ARG 112 N -1.82 2.15 0.00 -1.58 0.52 -1.26 -4.81 118.95 112.15 1xmw s ARG 112 Ca 0.00 -0.18 0.00 0.00 -0.52 0.00 0.00 55.73 55.03 1xmw s ARG 112 Cb 0.00 -5.00 0.00 0.00 0.52 0.00 0.00 34.95 30.47 1xmw s ARG 112 CO 0.00 -3.94 0.67 0.00 0.02 0.00 0.00 175.30 172.05 1xmw n ALA 113 N 15.89 -0.32 -2.89 2.13 0.00 -1.26 -4.82 120.51 129.23 1xmw n ALA 113 Ca 0.43 0.00 -0.29 0.00 0.00 0.00 0.00 53.44 53.58 1xmw n ALA 113 Cb 0.46 0.00 -0.04 0.00 0.00 0.00 0.00 19.45 19.87 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 -3.82 4.20 0.27 0.00 0.20 -1.26 -4.17 118.68 114.11 1xmw s LEU 114 Ca 0.00 0.14 -0.19 0.00 0.69 0.00 0.00 54.13 54.77 1xmw s LEU 114 Cb 0.00 -2.80 0.01 0.00 -0.43 0.00 0.00 46.19 42.97 1xmw s LEU 114 CO 0.00 0.11 0.66 -1.61 -0.29 0.00 0.00 176.35 175.22 1xmw s GLU 115 N -2.83 1.73 0.01 1.98 2.02 -0.54 -4.96 118.70 116.11 1xmw s GLU 115 Ca 0.33 -1.05 0.02 0.00 0.02 0.00 0.00 54.97 54.29 1xmw s GLU 115 Cb -0.12 0.58 -0.01 0.00 0.10 0.00 0.00 34.13 34.68 1xmw s GLU 115 CO 0.27 -0.78 -0.06 0.54 0.02 0.00 0.00 175.26 175.25 1xmw s VAL 116 N -3.94 0.49 0.13 2.63 0.11 -1.26 -0.29 120.40 118.27 1xmw s VAL 116 Ca 0.14 -0.44 0.06 0.00 -2.93 0.00 0.00 61.98 58.81 1xmw s VAL 116 Cb -0.05 -0.45 -0.04 0.00 -1.53 0.00 0.00 36.38 34.31 1xmw s VAL 116 CO 0.08 0.02 -0.13 -0.22 -3.33 0.00 0.00 175.10 171.51 1xmw s LEU 117 N -0.46 2.43 -0.34 2.54 0.20 -0.98 -4.97 118.68 117.09 1xmw s LEU 117 Ca -0.00 -0.85 0.00 0.00 0.69 0.00 0.00 54.13 53.97 1xmw s LEU 117 Cb -0.04 -0.51 0.09 0.00 -0.43 0.00 0.00 46.19 45.29 1xmw s LEU 117 CO -0.00 -0.18 0.07 -1.61 -0.29 0.00 0.00 176.35 174.34 1xmw s GLU 118 N -2.86 1.98 0.07 1.98 2.02 -1.26 -2.31 118.70 118.31 1xmw s GLU 118 Ca 0.10 -1.64 0.07 0.00 0.02 0.00 0.00 54.97 53.52 1xmw s GLU 118 Cb -0.04 -3.28 -0.03 0.00 0.10 0.00 0.00 34.13 30.88 1xmw s GLU 118 CO 0.03 -0.86 -0.19 0.00 0.02 0.00 0.00 175.26 174.25 1xmw s ALA 119 N 1.09 1.66 -1.43 5.21 0.00 0.56 -4.77 121.76 124.08 1xmw s ALA 119 Ca 0.04 -1.12 -0.04 0.00 0.00 0.00 0.00 51.96 50.83 1xmw s ALA 119 Cb -0.21 -0.26 0.03 0.00 0.00 0.00 0.00 23.12 22.69 1xmw s ALA 119 CO -0.05 0.34 0.63 -1.91 0.00 0.00 0.00 175.76 174.77 1xmw n GLU 120 N 1.43 -4.09 -1.64 0.00 4.07 -1.26 0.37 120.64 119.53 1xmw n GLU 120 Ca -0.19 0.49 -0.16 0.00 -0.06 0.00 0.00 57.16 57.25 1xmw n GLU 120 Cb 0.54 -4.93 -0.06 0.00 -0.06 0.00 0.00 31.44 26.93 1xmw n GLU 120 CO 0.00 0.00 0.00 -3.47 -0.06 0.00 0.00 177.13 173.60 1xmw n ASP 121 N -2.94 -4.25 -4.40 4.31 -0.08 -1.26 -4.93 116.55 102.99 1xmw n ASP 121 Ca -0.21 0.34 -0.20 0.00 -1.51 0.00 0.00 54.79 53.21 1xmw n ASP 121 Cb 0.64 -3.82 -0.10 0.00 2.34 0.00 0.00 41.12 40.17 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 -3.66 1.49 0.00 -0.67 1.02 0.16 -0.44 119.74 117.65 1xmw s LYS 122 Ca 0.00 -1.75 0.02 0.00 0.02 0.00 0.00 55.97 54.25 1xmw s LYS 122 Cb 0.00 -1.03 -0.01 0.00 -0.52 0.00 0.00 37.83 36.28 1xmw s LYS 122 CO 0.00 0.01 -0.06 0.14 -0.92 0.00 0.00 175.35 174.52 1xmw s VAL 123 N -3.11 0.45 0.01 3.17 -7.23 -0.97 -0.32 120.40 112.40 1xmw s VAL 123 Ca 0.29 -0.35 -0.06 0.00 -1.81 0.00 0.00 61.98 60.05 1xmw s VAL 123 Cb 0.04 -0.40 -0.00 0.00 0.56 0.00 0.00 36.38 36.58 1xmw s VAL 123 CO 0.11 0.05 0.11 -0.63 -0.31 0.00 0.00 175.10 174.44 1xmw s ILE 124 N -0.30 0.09 -0.00 -0.62 1.09 -0.98 -2.95 121.20 117.54 1xmw s ILE 124 Ca 0.01 -0.78 -0.06 0.00 -1.10 0.00 0.00 60.65 58.72 1xmw s ILE 124 Cb -0.03 -0.48 -0.05 0.00 -1.06 0.00 0.00 42.46 40.85 1xmw s ILE 124 CO -0.00 -0.43 0.24 -0.76 -0.10 0.00 0.00 174.94 173.89 1xmw s LEU 125 N -1.51 4.37 -0.07 2.97 1.43 -1.08 -2.33 118.68 122.47 1xmw s LEU 125 Ca -0.14 0.50 0.01 0.00 -1.03 0.00 0.00 54.13 53.48 1xmw s LEU 125 Cb -0.07 -2.63 0.02 0.00 0.03 0.00 0.00 46.19 43.54 1xmw s LEU 125 CO 0.00 0.26 -0.07 -0.54 0.23 0.00 0.00 176.35 176.24 1xmw s LYS 126 N -1.77 1.24 0.22 1.70 1.02 0.61 -2.27 119.74 120.49 1xmw s LYS 126 Ca 0.27 -0.21 0.04 0.00 0.02 0.00 0.00 55.97 56.09 1xmw s LYS 126 Cb -0.13 -1.20 -0.05 0.00 -0.52 0.00 0.00 37.83 35.93 1xmw s LYS 126 CO 0.16 -0.12 -0.03 0.00 -0.92 0.00 0.00 175.35 174.45 1xmw n ASN 128 N -0.40 0.00 0.00 0.00 5.15 -1.26 -4.81 115.26 113.94 1xmw n ASN 128 Ca -0.06 0.27 0.00 0.00 -0.60 0.00 0.00 54.58 54.19 1xmw n ASN 128 Cb 0.63 -0.29 0.00 0.00 -0.53 0.00 0.00 39.78 39.59 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 -1.29 0.03 -4.63 1.20 3.41 -1.26 -5.07 113.62 106.00 1xmw n SER 129 Ca 0.01 0.00 -0.49 0.00 -0.26 0.00 0.00 58.87 58.13 1xmw n SER 129 Cb 0.02 0.00 -0.05 0.00 -0.26 0.00 0.00 64.21 63.92 1xmw n SER 129 CO 0.00 0.00 0.00 -1.54 -0.16 0.00 0.00 175.04 173.34 1xmw n SER 130 N 0.00 2.45 -4.82 4.04 3.41 -1.23 -4.16 113.62 113.31 1xmw n SER 130 Ca 0.00 1.10 -0.38 0.00 -0.26 0.00 0.00 58.87 59.33 1xmw n SER 130 Cb 0.00 -1.32 -0.06 0.00 -0.26 0.00 0.00 64.21 62.57 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 0.72 4.90 -0.56 -1.33 1.01 -0.75 -4.64 121.20 120.54 1xmw s ILE 131 Ca 0.81 1.03 -0.24 0.00 0.00 0.00 0.00 60.65 62.25 1xmw s ILE 131 Cb -0.80 -3.81 0.04 0.00 0.01 0.00 0.00 42.46 37.90 1xmw s ILE 131 CO 0.42 0.55 0.97 -0.89 0.00 0.00 0.00 174.94 175.99 1xmw s THR 132 N -0.99 4.35 -0.59 2.92 2.01 0.58 -4.93 115.64 118.99 1xmw s THR 132 Ca 0.26 0.28 -0.27 0.00 0.31 0.00 0.00 61.69 62.28 1xmw s THR 132 Cb -0.18 -4.57 -0.02 0.00 0.01 0.00 0.00 72.50 67.74 1xmw s THR 132 CO 0.16 -1.16 1.90 -0.22 -0.69 0.00 0.00 174.62 174.61 1xmw s LEU 133 N 4.05 3.31 -0.04 4.42 1.98 -1.26 -0.90 118.68 130.24 1xmw s LEU 133 Ca 0.31 0.43 -0.18 0.00 -2.89 0.00 0.00 54.13 51.80 1xmw s LEU 133 Cb -0.12 -2.56 -0.12 0.00 0.66 0.00 0.00 46.19 44.05 1xmw s LEU 133 CO 0.19 -2.40 0.74 -0.07 -1.89 0.00 0.00 176.35 172.92 1xmw h LEU 134 N 16.61 -0.33 0.00 -0.68 3.38 -1.86 -3.48 115.31 128.94 1xmw h LEU 134 Ca -0.26 -0.15 0.00 0.00 0.09 0.00 0.00 57.88 57.56 1xmw h LEU 134 Cb 1.17 0.09 0.00 0.00 0.09 0.00 0.00 40.66 42.01 1xmw h LEU 134 CO 1.21 0.15 0.00 1.67 0.09 0.00 0.00 178.44 181.56 1xmw n GLN 135 N -5.04 0.00 0.00 1.13 -0.06 -1.10 -5.00 117.38 107.32 1xmw n GLN 135 Ca -0.07 0.00 0.00 0.00 -2.00 0.00 0.00 57.00 54.93 1xmw n GLN 135 Cb 0.23 0.00 0.00 0.00 -4.06 0.00 0.00 30.24 26.41 1xmw n GLN 135 CO 0.00 0.00 0.00 0.41 -0.20 0.00 0.00 177.06 177.27 1xmw n GLY 136 N 0.00 1.67 3.54 1.69 0.00 -1.26 -2.53 105.19 108.30 1xmw n GLY 136 Ca 0.00 -0.62 -0.35 0.00 0.00 0.00 0.00 46.02 45.05 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 -0.06 -2.72 2.61 5.66 0.33 -4.82 114.28 115.29 1xmw n THR 137 Ca 0.00 -0.56 -0.42 0.00 -3.05 0.00 0.00 64.05 60.02 1xmw n THR 137 Cb 0.00 -2.06 0.01 0.00 -1.55 0.00 0.00 70.33 66.73 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 14.45 5.79 -1.00 1.79 0.00 -1.26 -4.90 120.51 135.38 1xmw n ALA 138 Ca 0.46 -4.64 0.00 0.00 0.00 0.00 0.00 53.44 49.27 1xmw n ALA 138 Cb 0.39 -2.31 0.00 0.00 0.00 0.00 0.00 19.45 17.53 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 0.64 -2.07 2.86 0.00 0.00 -1.26 -4.99 105.19 100.38 1xmw n GLY 139 Ca 0.40 -0.30 -0.13 0.00 0.00 0.00 0.00 46.02 45.99 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 0.05 0.43 1.61 -0.21 -1.07 -4.89 119.66 115.58 1xmw s GLN 140 Ca 0.00 0.01 -0.26 0.00 0.02 0.00 0.00 55.36 55.13 1xmw s GLN 140 Cb 0.00 -0.09 -0.09 0.00 1.00 0.00 0.00 33.01 33.83 1xmw s GLN 140 CO 0.00 -0.01 1.41 -1.21 -2.12 0.00 0.00 175.29 173.35 1xmw s GLU 141 N 0.16 3.81 0.00 2.91 2.02 -1.26 -1.20 118.70 125.15 1xmw s GLU 141 Ca -0.01 2.38 0.00 0.00 0.02 0.00 0.00 54.97 57.36 1xmw s GLU 141 Cb -0.02 -2.73 0.00 0.00 0.10 0.00 0.00 34.13 31.48 1xmw s GLU 141 CO -0.00 -0.70 0.00 1.55 0.02 0.00 0.00 175.26 176.12 1xmw n VAL 142 N -0.02 0.00 -0.25 2.63 3.14 0.34 -4.60 118.33 119.57 1xmw n VAL 142 Ca 0.04 0.00 0.19 0.00 -2.96 0.00 0.00 64.34 61.61 1xmw n VAL 142 Cb 0.42 -0.10 0.51 0.00 -1.06 0.00 0.00 33.84 33.60 1xmw n VAL 142 CO 0.00 0.00 0.00 0.77 -6.46 0.00 0.00 176.83 171.14 1xmw h SER 143 N 0.00 0.42 -0.64 6.55 4.64 -1.94 -3.21 113.55 119.37 1xmw h SER 143 Ca 0.00 0.05 -0.30 0.00 -0.47 0.00 0.00 61.79 61.07 1xmw h SER 143 Cb 0.00 -0.03 -0.34 0.00 -0.31 0.00 0.00 62.40 61.72 1xmw h SER 143 CO 0.00 0.16 -0.96 0.47 -0.87 0.00 0.00 176.83 175.63 1xmw n ASP 144 N -4.52 0.65 0.00 4.97 9.92 -1.26 -4.95 116.55 121.35 1xmw n ASP 144 Ca 0.20 -2.50 0.00 0.00 -0.53 0.00 0.00 54.79 51.96 1xmw n ASP 144 Cb 0.71 -0.15 0.00 0.00 -0.64 0.00 0.00 41.12 41.04 1xmw n ASP 144 CO 0.00 0.00 0.00 -3.20 0.13 0.00 0.00 177.20 174.13 1xmw n ASN 145 N -0.36 -3.44 0.24 -2.24 4.05 -1.21 -4.55 115.26 107.74 1xmw n ASN 145 Ca 0.05 0.00 0.13 0.00 0.45 0.00 0.00 54.58 55.21 1xmw n ASN 145 Cb 0.83 -2.68 0.47 0.00 1.23 0.00 0.00 39.78 39.63 1xmw n ASN 145 CO 0.00 0.00 0.00 0.50 -3.05 0.00 0.00 177.26 174.71 1xmw h LYS 146 N 0.28 0.00 -4.37 1.20 3.64 -1.86 -2.00 116.57 113.46 1xmw h LYS 146 Ca 0.00 0.00 -0.33 0.00 -1.27 0.00 0.00 60.65 59.05 1xmw h LYS 146 Cb 0.52 0.00 -0.10 0.00 -0.41 0.00 0.00 32.23 32.25 1xmw h LYS 146 CO 0.00 0.09 -0.29 0.99 -2.27 0.00 0.00 179.45 177.97 1xmw s THR 147 N -3.53 0.00 -0.01 1.00 2.01 -1.26 -3.09 115.64 110.76 1xmw s THR 147 Ca 0.02 -1.73 -0.06 0.00 0.31 0.00 0.00 61.69 60.24 1xmw s THR 147 Cb 0.08 -2.59 0.00 0.00 0.01 0.00 0.00 72.50 70.00 1xmw s THR 147 CO 0.61 0.00 0.12 -0.76 -0.69 0.00 0.00 174.62 173.90 1xmw s LEU 148 N -3.28 1.62 -0.32 4.42 1.43 -0.96 0.12 118.68 121.71 1xmw s LEU 148 Ca 0.34 -0.10 0.03 0.00 -1.03 0.00 0.00 54.13 53.37 1xmw s LEU 148 Cb 0.01 0.55 0.09 0.00 0.03 0.00 0.00 46.19 46.86 1xmw s LEU 148 CO 0.22 -0.27 0.01 0.21 0.23 0.00 0.00 176.35 176.76 1xmw s ASN 149 N -0.98 4.71 0.14 2.29 3.04 -0.34 -2.63 114.94 121.18 1xmw s ASN 149 Ca -0.11 -1.93 0.04 0.00 0.04 0.00 0.00 52.86 50.90 1xmw s ASN 149 Cb -0.06 -1.62 -0.09 0.00 -1.54 0.00 0.00 41.25 37.94 1xmw s ASN 149 CO 0.01 -0.33 1.33 -0.07 -3.04 0.00 0.00 177.10 174.99 1xmw h LEU 150 N 7.68 0.17 0.00 3.21 3.38 -1.86 -2.83 115.31 125.07 1xmw h LEU 150 Ca -0.09 -0.16 0.00 0.00 0.09 0.00 0.00 57.88 57.72 1xmw h LEU 150 Cb 1.03 -0.05 0.00 0.00 0.09 0.00 0.00 40.66 41.72 1xmw h LEU 150 CO 0.51 1.03 0.00 0.61 0.09 0.00 0.00 178.44 180.68 1xmw n GLY 151 N 1.08 0.34 3.94 0.83 0.00 -1.26 -4.81 105.19 105.32 1xmw n GLY 151 Ca -0.03 -1.42 -0.26 0.00 0.00 0.00 0.00 46.02 44.31 1xmw n GLY 151 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1xmw s LYS 152 N -1.12 1.87 0.14 1.61 2.20 -1.26 -2.30 119.74 120.87 1xmw s LYS 152 Ca 0.00 -0.37 0.22 0.00 -0.36 0.00 0.00 55.97 55.47 1xmw s LYS 152 Cb 0.00 -2.13 -0.06 0.00 -1.51 0.00 0.00 37.83 34.14 1xmw s LYS 152 CO 0.00 -1.47 0.93 2.89 -0.36 0.00 0.00 175.35 177.34 1xmw n ARG 153 N -3.07 0.57 0.00 4.03 1.85 0.42 -3.83 116.66 116.64 1xmw n ARG 153 Ca 0.10 0.04 0.12 0.00 -1.00 0.00 0.00 57.85 57.11 1xmw n ARG 153 Cb 0.60 -1.73 0.61 0.00 -1.05 0.00 0.00 32.46 30.89 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 -2.50 0.22 0.05 8.89 -0.00 -1.26 -3.10 119.36 121.67 1xmw n ILE 154 Ca -0.01 0.06 0.04 0.00 -0.00 0.00 0.00 62.75 62.84 1xmw n ILE 154 Cb 0.54 -0.65 0.21 0.00 -0.00 0.00 0.00 39.64 39.74 1xmw n ILE 154 CO 0.00 0.00 0.00 -0.62 -0.00 0.00 0.00 176.55 175.93 1xmw n GLU 155 N -1.31 2.97 -3.42 0.38 -0.58 -1.25 -4.92 120.64 112.51 1xmw n GLU 155 Ca 0.11 -1.59 -0.15 0.00 -0.42 0.00 0.00 57.16 55.11 1xmw n GLU 155 Cb 0.20 -1.88 0.02 0.00 -0.57 0.00 0.00 31.44 29.21 1xmw n GLU 155 CO 0.00 0.00 0.00 -0.25 -0.48 0.00 0.00 177.13 176.40 1xmw n ASP 156 N 0.32 -6.34 -4.65 1.62 9.92 -1.18 -4.86 116.55 111.38 1xmw n ASP 156 Ca 0.14 -0.58 -0.43 0.00 -0.53 0.00 0.00 54.79 53.39 1xmw n ASP 156 Cb 0.73 -3.85 -0.02 0.00 -0.64 0.00 0.00 41.12 37.34 1xmw n ASP 156 CO 0.00 0.00 0.00 -2.16 0.13 0.00 0.00 177.20 175.17 1xmw s PRO 157 N -4.33 4.13 -0.01 -0.24 0.04 -1.26 -4.61 135.00 128.72 1xmw s PRO 157 Ca 0.14 1.87 0.00 0.00 0.04 0.00 0.00 61.00 63.06 1xmw s PRO 157 Cb -0.04 -3.91 0.01 0.00 0.04 0.00 0.00 34.50 30.60 1xmw s PRO 157 CO 0.82 -0.87 -0.00 0.50 0.04 0.00 0.00 177.00 177.48 1xmw s ARG 158 N 3.93 0.12 0.00 4.56 3.52 -1.26 -1.75 118.95 128.07 1xmw s ARG 158 Ca 0.65 0.04 0.00 0.00 -0.13 0.00 0.00 55.73 56.29 1xmw s ARG 158 Cb -0.27 -0.23 0.00 0.00 -1.56 0.00 0.00 34.95 32.90 1xmw s ARG 158 CO 0.23 -0.05 0.00 0.41 -0.81 0.00 0.00 175.30 175.08 1xmw n GLY 159 N 3.56 2.41 3.38 8.12 0.00 0.90 0.12 105.19 123.69 1xmw n GLY 159 Ca -0.19 -0.99 -0.28 0.00 0.00 0.00 0.00 46.02 44.56 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 -2.00 1.38 -0.07 1.61 1.75 -1.05 0.17 119.30 121.09 1xmw s MET 160 Ca 0.00 -1.36 -0.05 0.00 -1.25 0.00 0.00 55.69 53.02 1xmw s MET 160 Cb 0.00 -1.81 0.02 0.00 2.84 0.00 0.00 34.83 35.89 1xmw s MET 160 CO 0.00 0.42 0.17 0.71 -0.65 0.00 0.00 175.02 175.67 1xmw s TYR 161 N -1.22 -0.20 0.31 4.11 2.02 0.70 -2.65 117.35 120.42 1xmw s TYR 161 Ca 0.14 0.49 0.07 0.00 -0.37 0.00 0.00 57.07 57.41 1xmw s TYR 161 Cb -0.09 0.04 -0.02 0.00 -0.40 0.00 0.00 41.96 41.48 1xmw s TYR 161 CO 0.07 -0.12 0.34 -1.14 -1.57 0.00 0.00 175.55 173.13 1xmw s GLN 162 N 0.36 2.97 0.11 -0.62 0.74 -0.07 -1.61 119.66 121.54 1xmw s GLN 162 Ca -0.02 -1.10 -0.05 0.00 0.05 0.00 0.00 55.36 54.24 1xmw s GLN 162 Cb -0.04 -2.65 -0.02 0.00 1.10 0.00 0.00 33.01 31.40 1xmw s GLN 162 CO -0.02 0.17 0.13 0.00 -0.55 0.00 0.00 175.29 175.03 1xmw s GLY 164 N -2.95 2.82 0.31 0.00 0.00 -1.26 -1.90 107.32 104.34 1xmw s GLY 164 Ca 0.13 0.37 0.08 0.00 0.00 0.00 0.00 44.72 45.30 1xmw s GLY 164 CO -0.05 1.34 0.20 1.85 0.00 0.00 0.00 173.10 176.44 1xmw s GLU 165 N 0.46 2.64 0.26 2.90 -6.30 -1.06 -4.69 118.70 112.91 1xmw s GLU 165 Ca 0.44 -1.31 0.12 0.00 -2.50 0.00 0.00 54.97 51.72 1xmw s GLU 165 Cb -0.20 -2.39 0.28 0.00 0.00 0.00 0.00 34.13 31.82 1xmw s GLU 165 CO 0.24 0.21 1.55 -0.91 0.02 0.00 0.00 175.26 176.37 1xmw h ASN 166 N 1.46 0.00 0.00 -1.70 2.35 -1.96 -3.38 115.58 112.35 1xmw h ASN 166 Ca -0.45 0.00 -0.28 0.00 -0.55 0.00 0.00 56.30 55.02 1xmw h ASN 166 Cb 1.25 0.00 -0.04 0.00 0.05 0.00 0.00 38.32 39.58 1xmw h ASN 166 CO 0.60 0.63 -1.93 0.00 -1.65 0.00 0.00 177.43 175.09 1xmw n ALA 167 N -2.36 1.91 -2.71 -0.83 0.00 -1.26 -5.09 120.51 110.18 1xmw n ALA 167 Ca -0.00 -0.66 0.00 0.00 0.00 0.00 0.00 53.44 52.77 1xmw n ALA 167 Cb 0.67 0.27 0.00 0.00 0.00 0.00 0.00 19.45 20.40 1xmw n ALA 167 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 1xmw n LYS 168 N -3.69 0.00 -4.30 0.00 4.76 -1.26 -5.16 118.16 108.51 1xmw n LYS 168 Ca -0.32 0.00 -0.18 0.00 -2.87 0.00 0.00 58.31 54.93 1xmw n LYS 168 Cb 0.74 0.00 -0.13 0.00 -1.84 0.00 0.00 35.03 33.79 1xmw n LYS 168 CO 0.00 0.00 0.00 -1.12 -1.37 0.00 0.00 177.40 174.91 1xmw s SER 169 N 1.00 1.27 -0.05 4.39 0.01 -1.26 -2.55 113.70 116.51 1xmw s SER 169 Ca 0.00 -0.36 0.01 0.00 1.31 0.00 0.00 55.95 56.91 1xmw s SER 169 Cb 0.00 -0.08 -0.03 0.00 0.21 0.00 0.00 66.02 66.11 1xmw s SER 169 CO 0.00 0.02 -0.04 0.12 0.41 0.00 0.00 173.24 173.75 1xmw s PHE 170 N -0.69 3.00 0.01 2.43 2.19 -0.80 -4.62 117.98 119.51 1xmw s PHE 170 Ca 0.00 0.06 -0.00 0.00 0.33 0.00 0.00 56.93 57.32 1xmw s PHE 170 Cb -0.06 -1.70 -0.01 0.00 -1.31 0.00 0.00 43.02 39.93 1xmw s PHE 170 CO 0.00 0.39 -0.02 0.99 1.83 0.00 0.00 175.22 178.42 1xmw s THR 171 N -0.91 0.07 -0.07 0.12 2.01 -1.01 0.23 115.64 116.08 1xmw s THR 171 Ca 0.15 -0.57 -0.05 0.00 0.31 0.00 0.00 61.69 61.52 1xmw s THR 171 Cb -0.11 -0.17 0.02 0.00 0.01 0.00 0.00 72.50 72.25 1xmw s THR 171 CO 0.04 -0.31 0.17 -0.22 -0.69 0.00 0.00 174.62 173.61 1xmw s LEU 172 N -0.92 1.21 0.11 4.42 0.20 -0.63 -2.12 118.68 120.95 1xmw s LEU 172 Ca -0.10 0.35 0.09 0.00 0.69 0.00 0.00 54.13 55.15 1xmw s LEU 172 Cb -0.06 0.56 -0.04 0.00 -0.43 0.00 0.00 46.19 46.22 1xmw s LEU 172 CO -0.01 -0.08 -0.18 -1.58 -0.29 0.00 0.00 176.35 174.21 1xmw s GLN 173 N 0.31 1.79 0.01 1.98 0.74 -0.60 -0.22 119.66 123.67 1xmw s GLN 173 Ca -0.02 -1.17 0.01 0.00 0.05 0.00 0.00 55.36 54.23 1xmw s GLN 173 Cb -0.03 -2.11 -0.01 0.00 1.10 0.00 0.00 33.01 31.96 1xmw s GLN 173 CO -0.01 0.48 -0.04 0.54 -0.55 0.00 0.00 175.29 175.71 1xmw s VAL 174 N -1.13 0.33 -0.27 1.34 0.11 0.44 -1.52 120.40 119.70 1xmw s VAL 174 Ca 0.18 -0.37 -0.01 0.00 -2.93 0.00 0.00 61.98 58.84 1xmw s VAL 174 Cb -0.11 -0.32 0.16 0.00 -1.53 0.00 0.00 36.38 34.59 1xmw s VAL 174 CO 0.10 -0.04 0.48 -0.72 -3.33 0.00 0.00 175.10 171.59 1xmw s TYR 175 N -0.40 -1.20 -0.58 1.54 1.13 -1.07 0.31 117.35 117.07 1xmw s TYR 175 Ca -0.02 1.19 -0.20 0.00 -1.41 0.00 0.00 57.07 56.62 1xmw s TYR 175 Cb -0.04 0.25 0.07 0.00 -1.10 0.00 0.00 41.96 41.15 1xmw s TYR 175 CO -0.00 -0.81 0.77 0.71 -2.51 0.00 0.00 175.55 173.71 1xmw s TYR 176 N 2.69 2.91 -0.83 -3.49 1.51 -0.72 -2.74 117.35 116.68 1xmw s TYR 176 Ca 0.16 -0.62 -0.25 0.00 -1.01 0.00 0.00 57.07 55.35 1xmw s TYR 176 Cb -0.15 -3.94 -0.02 0.00 -0.11 0.00 0.00 41.96 37.73 1xmw s TYR 176 CO -0.19 -1.31 1.83 0.50 -1.11 0.00 0.00 175.55 175.27 1xmw s ARG 177 N 3.15 2.73 0.00 -0.62 3.00 0.43 -4.60 118.95 123.04 1xmw s ARG 177 Ca 0.17 -0.13 0.00 0.00 -1.00 0.00 0.00 55.73 54.77 1xmw s ARG 177 Cb -0.20 -4.86 0.00 0.00 0.00 0.00 0.00 34.95 29.89 1xmw s ARG 177 CO 0.10 -3.00 0.00 -0.12 0.00 0.00 0.00 175.30 172.28