#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1avw s VAL 17 N 0.00 5.31 -0.16 1.39 1.01 0.70 -4.08 120.40 124.57 1avw s VAL 17 Ca 0.00 0.47 0.00 0.00 0.00 0.00 0.00 61.98 62.45 1avw s VAL 17 Cb 0.00 -3.61 0.00 0.00 0.00 0.00 0.00 36.38 32.77 1avw s VAL 17 CO 0.00 0.37 0.00 0.61 0.00 0.00 0.00 175.10 176.08 1avw n GLY 18 N 3.62 0.50 0.00 4.51 0.00 -1.26 -1.86 105.19 110.70 1avw n GLY 18 Ca -0.12 -0.99 0.00 0.00 0.00 0.00 0.00 46.02 44.91 1avw n GLY 18 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1avw n GLY 19 N -2.81 1.82 3.28 -0.02 0.00 -1.26 -4.89 105.19 101.31 1avw n GLY 19 Ca -0.01 -2.03 -0.15 0.00 0.00 0.00 0.00 46.02 43.82 1avw n GLY 19 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 1avw s TYR 20 N 1.90 1.36 -0.10 1.61 1.13 0.06 -4.92 117.35 118.39 1avw s TYR 20 Ca 0.00 -0.97 -0.30 0.00 -1.41 0.00 0.00 57.07 54.40 1avw s TYR 20 Cb 0.00 -0.78 -0.03 0.00 -1.10 0.00 0.00 41.96 40.05 1avw s TYR 20 CO 0.00 -0.12 1.38 0.99 -2.51 0.00 0.00 175.55 175.29 1avw s THR 21 N -3.54 4.01 0.61 -3.49 2.01 -1.26 0.39 115.64 114.37 1avw s THR 21 Ca 0.26 1.26 -0.19 0.00 0.31 0.00 0.00 61.69 63.33 1avw s THR 21 Cb 0.06 -3.81 -0.03 0.00 0.01 0.00 0.00 72.50 68.73 1avw s THR 21 CO 0.06 -0.09 1.25 0.00 -0.69 0.00 0.00 174.62 175.15 1avw s ALA 23 N -1.50 3.22 0.17 0.00 0.00 -1.26 -4.84 121.76 117.54 1avw s ALA 23 Ca 0.80 1.48 -0.33 0.00 0.00 0.00 0.00 51.96 53.90 1avw s ALA 23 Cb -0.34 -3.60 -0.14 0.00 0.00 0.00 0.00 23.12 19.05 1avw s ALA 23 CO 0.36 -1.24 1.60 0.00 0.00 0.00 0.00 175.76 176.48 1avw n ALA 24 N -0.27 1.59 -2.42 0.00 0.00 -1.26 -1.97 120.51 116.19 1avw n ALA 24 Ca 0.05 0.44 -0.11 0.00 0.00 0.00 0.00 53.44 53.82 1avw n ALA 24 Cb 0.42 -2.38 -0.01 0.00 0.00 0.00 0.00 19.45 17.48 1avw n ALA 24 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.50 177.59 1avw n ASN 25 N 3.46 -3.58 -0.09 0.00 3.02 -1.26 -4.84 115.26 111.97 1avw n ASN 25 Ca 0.17 0.23 0.13 0.00 -0.03 0.00 0.00 54.58 55.08 1avw n ASN 25 Cb 0.30 -3.07 0.46 0.00 -0.61 0.00 0.00 39.78 36.86 1avw n ASN 25 CO 0.00 0.00 0.00 -1.54 -2.62 0.00 0.00 177.26 173.10 1avw n SER 26 N -1.73 0.51 -3.54 6.41 3.41 -0.83 -4.13 113.62 113.72 1avw n SER 26 Ca -0.13 -0.36 -0.27 0.00 -0.26 0.00 0.00 58.87 57.85 1avw n SER 26 Cb 0.59 -0.01 -0.09 0.00 -0.26 0.00 0.00 64.21 64.45 1avw n SER 26 CO 0.00 0.00 0.00 -0.38 -0.16 0.00 0.00 175.04 174.50 1avw n ILE 27 N -1.15 2.02 0.64 -1.33 2.08 -1.26 -4.97 119.36 115.39 1avw n ILE 27 Ca 0.10 -5.06 0.10 0.00 0.56 0.00 0.00 62.75 58.45 1avw n ILE 27 Cb 0.32 -2.11 0.42 0.00 -0.75 0.00 0.00 39.64 37.52 1avw n ILE 27 CO 0.00 0.00 0.00 -0.81 0.56 0.00 0.00 176.55 176.30 1avw n PRO 28 N 1.18 0.03 0.02 0.38 -0.04 -1.26 -1.86 135.00 133.46 1avw n PRO 28 Ca 0.27 0.19 0.12 0.00 -0.04 0.00 0.00 63.50 64.05 1avw n PRO 28 Cb 0.40 -1.55 0.29 0.00 -0.04 0.00 0.00 33.50 32.60 1avw n PRO 28 CO 0.00 0.00 0.00 2.48 -0.04 0.00 0.00 175.50 177.94 1avw n TYR 29 N -1.61 0.17 -1.96 0.54 0.18 -1.17 -1.96 117.16 111.34 1avw n TYR 29 Ca 0.04 0.05 -0.42 0.00 1.88 0.00 0.00 57.90 59.46 1avw n TYR 29 Cb 0.24 -0.42 -0.03 0.00 -0.38 0.00 0.00 39.34 38.75 1avw n TYR 29 CO 0.00 0.00 0.00 -1.14 -2.08 0.00 0.00 176.86 173.64 1avw s GLN 30 N -3.05 4.23 0.20 -3.48 2.00 -0.77 -0.54 119.66 118.26 1avw s GLN 30 Ca 0.10 2.33 0.10 0.00 -2.00 0.00 0.00 55.36 55.90 1avw s GLN 30 Cb 0.17 -3.15 -0.04 0.00 0.80 0.00 0.00 33.01 30.78 1avw s GLN 30 CO 0.67 -0.56 -0.21 0.14 -0.50 0.00 0.00 175.29 174.84 1avw s VAL 31 N 0.92 2.16 -0.18 1.34 -7.23 -0.30 -4.52 120.40 112.60 1avw s VAL 31 Ca 0.68 -2.08 -0.07 0.00 -1.81 0.00 0.00 61.98 58.70 1avw s VAL 31 Cb -0.43 -2.06 -0.04 0.00 0.56 0.00 0.00 36.38 34.41 1avw s VAL 31 CO 0.33 -0.27 0.05 -0.55 -0.31 0.00 0.00 175.10 174.36 1avw s SER 32 N -2.87 5.50 -0.16 4.85 0.15 -0.71 -2.21 113.70 118.24 1avw s SER 32 Ca 0.21 0.04 -0.18 0.00 0.70 0.00 0.00 55.95 56.72 1avw s SER 32 Cb -0.06 -1.94 -0.04 0.00 -1.71 0.00 0.00 66.02 62.27 1avw s SER 32 CO 0.10 0.16 0.48 -0.76 1.20 0.00 0.00 173.24 174.41 1avw s LEU 33 N 0.46 4.22 -0.10 3.45 1.43 0.30 -0.84 118.68 127.61 1avw s LEU 33 Ca 0.02 0.73 0.01 0.00 -1.03 0.00 0.00 54.13 53.86 1avw s LEU 33 Cb -0.13 -2.67 0.02 0.00 0.03 0.00 0.00 46.19 43.44 1avw s LEU 33 CO 0.01 -0.07 -0.12 0.21 0.23 0.00 0.00 176.35 176.61 1avw s ASN 34 N 0.84 2.15 -0.40 2.29 3.84 -0.10 -1.70 114.94 121.85 1avw s ASN 34 Ca 0.24 -0.35 0.03 0.00 0.21 0.00 0.00 52.86 53.00 1avw s ASN 34 Cb -0.15 -0.93 0.16 0.00 -0.55 0.00 0.00 41.25 39.78 1avw s ASN 34 CO 0.10 -0.02 0.34 -0.55 -2.79 0.00 0.00 177.10 174.18 1avw s SER 37 N 1.10 1.52 0.00 -4.21 0.15 -1.26 -1.15 113.70 109.85 1avw s SER 37 Ca -0.06 -2.70 0.00 0.00 0.70 0.00 0.00 55.95 53.89 1avw s SER 37 Cb -0.14 -0.21 0.00 0.00 -1.71 0.00 0.00 66.02 63.96 1avw s SER 37 CO -0.02 -0.20 0.00 0.61 1.20 0.00 0.00 173.24 174.83 1avw n GLY 38 N 3.19 2.06 3.43 9.45 0.00 -1.26 -4.85 105.19 117.20 1avw n GLY 38 Ca 0.24 -0.30 -0.15 0.00 0.00 0.00 0.00 46.02 45.81 1avw n GLY 38 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1avw s SER 39 N 0.00 0.97 0.24 1.61 1.04 -1.26 -5.13 113.70 111.16 1avw s SER 39 Ca 0.00 -1.51 -0.31 0.00 0.48 0.00 0.00 55.95 54.61 1avw s SER 39 Cb 0.00 0.61 -0.12 0.00 0.10 0.00 0.00 66.02 66.61 1avw s SER 39 CO 0.00 -1.20 1.67 1.57 0.98 0.00 0.00 173.24 176.26 1avw n HIS 40 N -0.54 2.76 0.00 5.02 -0.00 -1.26 -4.36 115.22 116.83 1avw n HIS 40 Ca 0.02 0.13 0.00 0.00 0.46 0.00 0.00 57.72 58.33 1avw n HIS 40 Cb 0.62 -2.64 0.00 0.00 -0.12 0.00 0.00 29.99 27.85 1avw n HIS 40 CO 0.00 0.00 0.00 1.97 0.46 0.00 0.00 176.34 178.77 1avw n PHE 41 N 3.30 0.00 -3.77 1.57 -1.74 -0.69 -4.95 117.46 111.17 1avw n PHE 41 Ca 0.13 0.00 -0.10 0.00 -0.56 0.00 0.00 57.45 56.93 1avw n PHE 41 Cb 0.35 0.00 -0.05 0.00 1.52 0.00 0.00 39.48 41.31 1avw n PHE 41 CO 0.00 0.00 0.00 0.00 -0.56 0.00 0.00 176.76 176.20 1avw n GLY 43 N -0.30 2.68 2.64 0.00 0.00 0.13 -0.54 105.19 109.81 1avw n GLY 43 Ca -0.10 -2.18 0.01 0.00 0.00 0.00 0.00 46.02 43.75 1avw n GLY 43 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1avw n GLY 44 N 3.68 0.40 2.89 -0.02 0.00 -0.94 -3.90 105.19 107.30 1avw n GLY 44 Ca 0.01 -0.98 -0.16 0.00 0.00 0.00 0.00 46.02 44.88 1avw n GLY 44 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1avw s SER 45 N -2.86 0.52 -0.29 1.61 0.01 -0.28 -1.15 113.70 111.26 1avw s SER 45 Ca 0.20 -0.06 -0.26 0.00 1.31 0.00 0.00 55.95 57.13 1avw s SER 45 Cb -0.01 -0.17 0.01 0.00 0.21 0.00 0.00 66.02 66.06 1avw s SER 45 CO -0.00 -0.02 0.93 -0.22 0.41 0.00 0.00 173.24 174.34 1avw s LEU 46 N 0.46 4.04 -0.02 2.44 2.96 0.30 -1.01 118.68 127.86 1avw s LEU 46 Ca -0.05 0.98 0.14 0.00 -0.22 0.00 0.00 54.13 54.98 1avw s LEU 46 Cb -0.08 -3.33 -0.21 0.00 0.50 0.00 0.00 46.19 43.07 1avw s LEU 46 CO -0.01 -0.70 0.31 2.30 -1.32 0.00 0.00 176.35 176.94 1avw n ILE 47 N 5.56 0.00 -3.74 6.68 -5.35 -0.72 -1.02 119.36 120.77 1avw n ILE 47 Ca 0.08 -0.31 -0.08 0.00 -0.27 0.00 0.00 62.75 62.17 1avw n ILE 47 Cb 0.47 0.22 0.00 0.00 -1.74 0.00 0.00 39.64 38.59 1avw n ILE 47 CO 0.00 0.00 0.00 -0.46 -1.76 0.00 0.00 176.55 174.33 1avw n ASN 48 N -1.95 -1.35 0.34 7.28 2.04 -1.17 -4.68 115.26 115.77 1avw n ASN 48 Ca -0.02 -2.26 0.23 0.00 -0.44 0.00 0.00 54.58 52.08 1avw n ASN 48 Cb 0.35 2.35 1.22 0.00 -2.53 0.00 0.00 39.78 41.17 1avw n ASN 48 CO 0.00 0.00 0.00 0.77 -0.44 0.00 0.00 177.26 177.59 1avw h SER 49 N 1.44 0.00 -0.00 0.53 4.64 -1.96 -3.04 113.55 115.17 1avw h SER 49 Ca -0.22 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.10 1avw h SER 49 Cb 0.88 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.97 1avw h SER 49 CO 0.29 0.00 -0.03 0.00 -0.87 0.00 0.00 176.83 176.22 1avw n GLN 50 N -3.09 4.73 -4.79 4.77 6.02 -1.26 0.57 117.38 124.34 1avw n GLN 50 Ca -0.03 -0.15 -0.25 0.00 -0.01 0.00 0.00 57.00 56.56 1avw n GLN 50 Cb 0.07 -0.67 -0.16 0.00 1.02 0.00 0.00 30.24 30.50 1avw n GLN 50 CO 0.00 0.00 0.00 -1.58 -1.01 0.00 0.00 177.06 174.47 1avw s TRP 51 N -0.83 1.60 -0.03 1.08 0.52 -1.15 -0.34 118.94 119.79 1avw s TRP 51 Ca 0.01 -0.43 0.07 0.00 0.02 0.00 0.00 56.10 55.77 1avw s TRP 51 Cb 0.01 -1.08 -0.02 0.00 -1.15 0.00 0.00 33.47 31.23 1avw s TRP 51 CO 0.03 -0.13 -0.25 0.08 0.02 0.00 0.00 176.95 176.70 1avw s VAL 52 N -0.02 2.01 -0.10 4.03 1.01 -0.03 -1.75 120.40 125.54 1avw s VAL 52 Ca -0.02 -1.07 -0.02 0.00 0.00 0.00 0.00 61.98 60.87 1avw s VAL 52 Cb -0.10 -1.68 -0.03 0.00 0.00 0.00 0.00 36.38 34.57 1avw s VAL 52 CO 0.01 0.57 -0.02 0.54 0.00 0.00 0.00 175.10 176.20 1avw s VAL 53 N -0.43 4.08 0.00 2.92 0.11 -0.18 -1.11 120.40 125.78 1avw s VAL 53 Ca 0.05 -0.32 0.00 0.00 -2.93 0.00 0.00 61.98 58.78 1avw s VAL 53 Cb -0.11 -2.73 0.00 0.00 -1.53 0.00 0.00 36.38 32.01 1avw s VAL 53 CO 0.01 0.57 0.00 -0.24 -3.33 0.00 0.00 175.10 172.11 1avw n SER 54 N 2.59 0.00 -4.83 3.54 2.88 -0.61 -1.12 113.62 116.06 1avw n SER 54 Ca -0.18 -0.67 -0.38 0.00 -1.33 0.00 0.00 58.87 56.31 1avw n SER 54 Cb 0.53 0.00 -0.06 0.00 -0.75 0.00 0.00 64.21 63.93 1avw n SER 54 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 1avw s ALA 55 N -1.67 3.69 0.50 -1.46 0.00 -1.26 -1.48 121.76 120.08 1avw s ALA 55 Ca 0.00 -0.23 0.17 0.00 0.00 0.00 0.00 51.96 51.90 1avw s ALA 55 Cb 0.00 -2.39 1.23 0.00 0.00 0.00 0.00 23.12 21.96 1avw s ALA 55 CO 0.00 0.46 2.08 0.00 0.00 0.00 0.00 175.76 178.30 1avw h ALA 56 N 4.82 2.10 0.00 0.00 0.00 -1.70 -1.31 119.26 123.17 1avw h ALA 56 Ca -0.51 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.39 1avw h ALA 56 Cb 1.22 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.99 1avw h ALA 56 CO 0.62 -0.16 0.00 -2.39 0.00 0.00 0.00 179.25 177.32 1avw n HIS 57 N -4.48 0.00 1.69 0.00 1.44 -1.26 -1.99 115.22 110.62 1avw n HIS 57 Ca 0.03 0.00 0.15 0.00 -2.01 0.00 0.00 57.72 55.88 1avw n HIS 57 Cb 0.26 -0.46 0.68 0.00 0.12 0.00 0.00 29.99 30.58 1avw n HIS 57 CO 0.00 0.00 0.00 0.00 -2.81 0.00 0.00 176.34 173.53 1avw n TYR 59 N -0.28 1.94 -3.71 0.00 4.19 -0.84 -4.99 117.16 113.47 1avw n TYR 59 Ca 0.21 0.44 -0.14 0.00 3.31 0.00 0.00 57.90 61.73 1avw n TYR 59 Cb 0.26 -2.44 -0.08 0.00 0.49 0.00 0.00 39.34 37.57 1avw n TYR 59 CO 0.00 0.00 0.00 0.15 0.91 0.00 0.00 176.86 177.92 1avw s LYS 60 N 0.43 0.79 0.19 2.98 1.02 -1.26 -5.07 119.74 118.82 1avw s LYS 60 Ca 0.78 -0.21 -0.01 0.00 0.02 0.00 0.00 55.97 56.55 1avw s LYS 60 Cb -0.77 0.35 0.09 0.00 -0.52 0.00 0.00 37.83 36.98 1avw s LYS 60 CO 0.44 -0.24 1.46 0.66 -0.92 0.00 0.00 175.35 176.75 1avw h SER 61 N 3.50 0.48 -3.15 2.83 4.64 -2.03 -3.41 113.55 116.41 1avw h SER 61 Ca -0.30 -0.30 -0.67 0.00 -0.47 0.00 0.00 61.79 60.05 1avw h SER 61 Cb 1.18 -0.14 -0.34 0.00 -0.31 0.00 0.00 62.40 62.78 1avw h SER 61 CO 0.41 1.02 -0.84 -0.13 -0.87 0.00 0.00 176.83 176.42 1avw s ARG 62 N -3.71 2.97 -0.02 4.77 0.52 -1.26 -5.08 118.95 117.14 1avw s ARG 62 Ca -0.06 -0.85 0.00 0.00 -0.52 0.00 0.00 55.73 54.30 1avw s ARG 62 Cb 0.11 -2.64 0.02 0.00 0.52 0.00 0.00 34.95 32.96 1avw s ARG 62 CO 0.83 -0.24 -0.00 0.42 0.02 0.00 0.00 175.30 176.34 1avw s ILE 63 N 1.29 0.15 -0.20 1.52 1.01 -1.26 -4.76 121.20 118.96 1avw s ILE 63 Ca 0.04 0.06 -0.07 0.00 0.00 0.00 0.00 60.65 60.69 1avw s ILE 63 Cb -0.14 -0.23 -0.03 0.00 0.01 0.00 0.00 42.46 42.07 1avw s ILE 63 CO -0.11 0.12 0.04 -1.58 0.00 0.00 0.00 174.94 173.41 1avw s GLN 64 N 0.81 3.78 -0.14 2.79 0.74 -0.30 -1.55 119.66 125.80 1avw s GLN 64 Ca -0.08 -0.44 -0.21 0.00 0.05 0.00 0.00 55.36 54.69 1avw s GLN 64 Cb -0.11 -3.19 -0.03 0.00 1.10 0.00 0.00 33.01 30.77 1avw s GLN 64 CO -0.02 0.08 0.61 0.08 -0.55 0.00 0.00 175.29 175.49 1avw s VAL 65 N 0.87 5.07 -0.27 1.34 1.01 0.44 -0.93 120.40 127.94 1avw s VAL 65 Ca 0.03 1.19 -0.03 0.00 0.00 0.00 0.00 61.98 63.17 1avw s VAL 65 Cb -0.14 -3.94 0.03 0.00 0.00 0.00 0.00 36.38 32.33 1avw s VAL 65 CO 0.02 0.21 -0.01 -0.13 0.00 0.00 0.00 175.10 175.19 1avw s ARG 66 N 1.25 2.81 0.23 2.72 1.81 -0.02 -0.93 118.95 126.83 1avw s ARG 66 Ca 0.30 -1.01 0.06 0.00 -1.72 0.00 0.00 55.73 53.36 1avw s ARG 66 Cb -0.16 -3.13 -0.03 0.00 -0.45 0.00 0.00 34.95 31.18 1avw s ARG 66 CO 0.12 -0.46 0.25 -0.51 -0.68 0.00 0.00 175.30 174.02 1avw s LEU 67 N 1.35 4.00 -0.23 2.53 1.02 0.49 -1.74 118.68 126.10 1avw s LEU 67 Ca -0.00 -0.11 0.00 0.00 0.02 0.00 0.00 54.13 54.03 1avw s LEU 67 Cb -0.17 -2.55 0.00 0.00 0.02 0.00 0.00 46.19 43.49 1avw s LEU 67 CO -0.02 -0.03 0.00 0.61 0.02 0.00 0.00 176.35 176.93 1avw n GLY 69 N -1.14 0.51 3.78 -3.19 0.00 -1.26 -0.98 105.19 102.91 1avw n GLY 69 Ca -0.08 -0.22 -0.36 0.00 0.00 0.00 0.00 46.02 45.36 1avw n GLY 69 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1avw s GLU 70 N -1.28 4.13 0.18 1.61 0.41 -1.26 -4.14 118.70 118.35 1avw s GLU 70 Ca 0.00 1.48 0.00 0.00 -0.41 0.00 0.00 54.97 56.04 1avw s GLU 70 Cb 0.00 -2.48 0.00 0.00 -1.78 0.00 0.00 34.13 29.87 1avw s GLU 70 CO 0.00 -0.17 0.00 1.58 -0.49 0.00 0.00 175.26 176.18 1avw n HIS 71 N -0.19 -1.21 -3.20 1.61 -0.00 -1.26 -4.73 115.22 106.23 1avw n HIS 71 Ca 0.06 0.21 -0.44 0.00 -0.00 0.00 0.00 57.72 57.55 1avw n HIS 71 Cb 0.50 0.29 -0.07 0.00 -0.00 0.00 0.00 29.99 30.72 1avw n HIS 71 CO 0.00 0.00 0.00 1.21 -0.00 0.00 0.00 176.34 177.55 1avw s ASN 72 N -5.47 6.21 0.00 0.26 3.84 -1.26 -2.44 114.94 116.09 1avw s ASN 72 Ca 0.00 -0.94 0.18 0.00 0.21 0.00 0.00 52.86 52.31 1avw s ASN 72 Cb 0.00 -2.27 0.90 0.00 -0.55 0.00 0.00 41.25 39.33 1avw s ASN 72 CO 0.00 -0.83 1.57 2.30 -2.79 0.00 0.00 177.10 177.34 1avw n ILE 73 N 5.55 0.51 1.00 -5.21 -5.35 -0.45 -3.02 119.36 112.39 1avw n ILE 73 Ca -0.07 0.13 0.10 0.00 -0.27 0.00 0.00 62.75 62.64 1avw n ILE 73 Cb 0.45 -0.82 -0.05 0.00 -1.74 0.00 0.00 39.64 37.48 1avw n ILE 73 CO 0.00 0.00 0.00 0.47 -1.76 0.00 0.00 176.55 175.26 1avw n ASP 74 N -1.33 0.92 -3.99 7.28 8.00 -1.26 -4.94 116.55 121.24 1avw n ASP 74 Ca 0.08 -0.87 -0.20 0.00 0.71 0.00 0.00 54.79 54.51 1avw n ASP 74 Cb 0.16 0.86 -0.15 0.00 -0.02 0.00 0.00 41.12 41.96 1avw n ASP 74 CO 0.00 0.00 0.00 -0.69 -0.39 0.00 0.00 177.20 176.12 1avw s VAL 75 N -2.99 0.71 -0.27 2.53 1.01 -1.17 -5.11 120.40 115.11 1avw s VAL 75 Ca 0.09 -0.33 -0.29 0.00 0.00 0.00 0.00 61.98 61.45 1avw s VAL 75 Cb 0.16 -0.63 -0.01 0.00 0.00 0.00 0.00 36.38 35.90 1avw s VAL 75 CO 0.83 0.22 1.35 -0.76 0.00 0.00 0.00 175.10 176.74 1avw s LEU 76 N 0.17 3.93 -0.02 3.92 1.43 -1.26 -4.74 118.68 122.12 1avw s LEU 76 Ca -0.03 1.35 0.19 0.00 -1.03 0.00 0.00 54.13 54.62 1avw s LEU 76 Cb -0.08 -3.54 -0.27 0.00 0.03 0.00 0.00 46.19 42.33 1avw s LEU 76 CO 0.00 -1.06 0.54 -0.62 0.23 0.00 0.00 176.35 175.44 1avw n GLU 77 N 7.26 0.64 0.00 1.70 1.02 -1.26 -4.98 120.64 125.02 1avw n GLU 77 Ca 0.15 -0.13 0.00 0.00 -0.02 0.00 0.00 57.16 57.17 1avw n GLU 77 Cb 0.46 -1.44 0.00 0.00 -0.02 0.00 0.00 31.44 30.44 1avw n GLU 77 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1avw n GLY 78 N 1.41 0.51 0.56 0.62 0.00 -1.26 -4.95 105.19 102.09 1avw n GLY 78 Ca -0.01 0.00 0.09 0.00 0.00 0.00 0.00 46.02 46.10 1avw n GLY 78 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1avw n ASN 79 N 0.00 2.12 -4.83 1.61 3.02 -1.26 -5.02 115.26 110.90 1avw n ASN 79 Ca 0.00 -1.56 -0.33 0.00 -0.03 0.00 0.00 54.58 52.66 1avw n ASN 79 Cb 0.00 0.28 -0.07 0.00 -0.61 0.00 0.00 39.78 39.39 1avw n ASN 79 CO 0.00 0.00 0.00 -1.61 -2.62 0.00 0.00 177.26 173.03 1avw s GLU 80 N -1.91 4.17 -0.14 3.52 8.01 -1.26 -4.47 118.70 126.62 1avw s GLU 80 Ca 0.18 1.02 -0.00 0.00 0.01 0.00 0.00 54.97 56.18 1avw s GLU 80 Cb 0.15 -2.22 0.03 0.00 -4.31 0.00 0.00 34.13 27.78 1avw s GLU 80 CO 0.37 -0.01 -0.09 -0.65 0.01 0.00 0.00 175.26 174.89 1avw s GLN 81 N -3.21 1.73 -0.34 1.61 -0.21 -0.16 -4.98 119.66 114.11 1avw s GLN 81 Ca 0.60 -0.43 -0.10 0.00 0.02 0.00 0.00 55.36 55.45 1avw s GLN 81 Cb -0.09 -1.86 0.01 0.00 1.00 0.00 0.00 33.01 32.06 1avw s GLN 81 CO 0.15 -0.31 0.18 -0.06 -2.12 0.00 0.00 175.29 173.13 1avw s PHE 82 N 1.62 3.20 -0.06 0.91 0.08 -1.26 -0.38 117.98 122.09 1avw s PHE 82 Ca 0.04 -0.71 0.02 0.00 0.12 0.00 0.00 56.93 56.39 1avw s PHE 82 Cb -0.13 -2.39 0.01 0.00 -0.57 0.00 0.00 43.02 39.94 1avw s PHE 82 CO -0.09 -0.53 -0.10 0.42 -0.10 0.00 0.00 175.22 174.83 1avw s ILE 83 N 1.59 0.94 0.38 0.64 1.01 -0.10 -4.97 121.20 120.69 1avw s ILE 83 Ca 0.04 -0.37 -0.26 0.00 0.00 0.00 0.00 60.65 60.06 1avw s ILE 83 Cb -0.18 -0.88 -0.09 0.00 0.01 0.00 0.00 42.46 41.33 1avw s ILE 83 CO 0.06 0.31 1.14 0.20 0.00 0.00 0.00 174.94 176.65 1avw s ASN 84 N 0.69 6.67 0.12 3.58 0.02 -1.26 -0.42 114.94 124.34 1avw s ASN 84 Ca -0.13 2.27 -0.31 0.00 -1.02 0.00 0.00 52.86 53.68 1avw s ASN 84 Cb -0.15 -2.61 -0.08 0.00 0.02 0.00 0.00 41.25 38.44 1avw s ASN 84 CO 0.03 -0.56 1.34 0.00 0.02 0.00 0.00 177.10 177.92 1avw s ALA 85 N -1.43 3.54 -0.19 0.60 0.00 -0.59 -1.14 121.76 122.55 1avw s ALA 85 Ca 0.55 1.06 -0.15 0.00 0.00 0.00 0.00 51.96 53.42 1avw s ALA 85 Cb -0.29 -3.51 -0.07 0.00 0.00 0.00 0.00 23.12 19.25 1avw s ALA 85 CO 0.37 -0.56 -0.25 0.00 0.00 0.00 0.00 175.76 175.32 1avw n ALA 86 N 3.72 0.80 -2.76 0.00 0.00 0.18 -4.75 120.51 117.70 1avw n ALA 86 Ca 0.10 -0.72 -0.35 0.00 0.00 0.00 0.00 53.44 52.47 1avw n ALA 86 Cb 0.43 -0.01 -0.09 0.00 0.00 0.00 0.00 19.45 19.78 1avw n ALA 86 CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 177.50 177.65 1avw s LYS 87 N -2.61 3.30 -0.25 0.00 1.02 -0.97 -4.95 119.74 115.29 1avw s LYS 87 Ca -0.27 -0.35 -0.01 0.00 0.02 0.00 0.00 55.97 55.36 1avw s LYS 87 Cb 0.05 -2.95 0.08 0.00 -0.52 0.00 0.00 37.83 34.49 1avw s LYS 87 CO 0.39 0.60 0.03 0.42 -0.92 0.00 0.00 175.35 175.88 1avw s ILE 88 N -0.59 0.99 -0.29 2.17 1.01 -1.26 -0.59 121.20 122.64 1avw s ILE 88 Ca 0.10 -1.10 0.02 0.00 0.00 0.00 0.00 60.65 59.68 1avw s ILE 88 Cb -0.12 -1.52 0.08 0.00 0.01 0.00 0.00 42.46 40.91 1avw s ILE 88 CO 0.02 -0.35 0.01 -0.63 0.00 0.00 0.00 174.94 173.99 1avw s ILE 89 N 1.61 1.78 0.49 2.92 1.01 0.58 -4.99 121.20 124.60 1avw s ILE 89 Ca 0.02 -1.75 -0.18 0.00 0.00 0.00 0.00 60.65 58.74 1avw s ILE 89 Cb -0.18 -2.19 -0.09 0.00 0.01 0.00 0.00 42.46 40.02 1avw s ILE 89 CO -0.13 -0.40 0.97 0.42 0.00 0.00 0.00 174.94 175.80 1avw s THR 90 N 1.20 4.49 0.36 2.92 -4.23 -1.26 -0.04 115.64 119.08 1avw s THR 90 Ca 0.03 1.30 -0.28 0.00 -1.18 0.00 0.00 61.69 61.56 1avw s THR 90 Cb -0.19 -3.68 -0.11 0.00 1.34 0.00 0.00 72.50 69.86 1avw s THR 90 CO -0.10 -0.58 1.47 1.57 -0.54 0.00 0.00 174.62 176.44 1avw n HIS 91 N -1.29 2.86 0.31 3.99 -0.00 -0.25 -4.85 115.22 115.99 1avw n HIS 91 Ca 0.07 0.44 0.19 0.00 0.46 0.00 0.00 57.72 58.88 1avw n HIS 91 Cb 0.54 -2.52 0.92 0.00 -0.12 0.00 0.00 29.99 28.80 1avw n HIS 91 CO 0.00 0.00 0.00 -1.00 0.46 0.00 0.00 176.34 175.80 1avw h PRO 92 N 3.15 0.00 -0.54 1.57 0.13 -1.92 -0.97 132.00 133.41 1avw h PRO 92 Ca -0.49 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.64 1avw h PRO 92 Cb 1.25 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.38 1avw h PRO 92 CO 0.66 0.00 0.00 0.09 -0.23 0.00 0.00 178.00 178.52 1avw n ASN 93 N -3.02 4.23 -4.72 1.44 5.03 -1.26 -4.98 115.26 111.98 1avw n ASN 93 Ca -0.01 -2.40 -0.43 0.00 0.87 0.00 0.00 54.58 52.61 1avw n ASN 93 Cb 0.19 -0.50 -0.03 0.00 -1.02 0.00 0.00 39.78 38.42 1avw n ASN 93 CO 0.00 0.00 0.00 0.33 -1.83 0.00 0.00 177.26 175.76 1avw n PHE 94 N 0.83 2.69 -3.95 3.10 7.35 -0.37 -4.66 117.46 122.44 1avw n PHE 94 Ca 0.22 0.13 -0.31 0.00 -0.76 0.00 0.00 57.45 56.74 1avw n PHE 94 Cb 0.78 -2.63 -0.15 0.00 0.35 0.00 0.00 39.48 37.82 1avw n PHE 94 CO 0.00 0.00 0.00 1.21 -0.76 0.00 0.00 176.76 177.21 1avw s ASN 95 N 0.96 4.28 0.43 -2.13 3.84 -0.78 -5.01 114.94 116.53 1avw s ASN 95 Ca 0.73 -1.63 0.11 0.00 0.21 0.00 0.00 52.86 52.28 1avw s ASN 95 Cb -0.53 -1.33 0.97 0.00 -0.55 0.00 0.00 41.25 39.81 1avw s ASN 95 CO 0.37 -0.31 2.03 1.23 -2.79 0.00 0.00 177.10 177.63 1avw h GLY 96 N 7.84 0.53 0.00 1.21 0.00 -1.93 0.20 103.07 110.91 1avw h GLY 96 Ca -0.13 -0.18 0.00 0.00 0.00 0.00 0.00 47.33 47.03 1avw h GLY 96 CO 0.47 0.15 -0.94 0.70 0.00 0.00 0.00 176.54 176.91 1avw n ASN 97 N -4.48 0.83 -0.82 0.19 4.13 -1.26 -3.88 115.26 109.97 1avw n ASN 97 Ca 0.05 -0.80 0.12 0.00 1.68 0.00 0.00 54.58 55.64 1avw n ASN 97 Cb 0.20 1.10 0.18 0.00 -1.54 0.00 0.00 39.78 39.72 1avw n ASN 97 CO 0.00 0.00 0.00 0.35 0.28 0.00 0.00 177.26 177.89 1avw n THR 98 N -1.49 0.00 -1.36 3.41 -2.24 -1.04 -4.97 114.28 106.58 1avw n THR 98 Ca 0.02 -0.43 -0.12 0.00 -2.27 0.00 0.00 64.05 61.25 1avw n THR 98 Cb 0.29 1.26 -0.05 0.00 -2.10 0.00 0.00 70.33 69.73 1avw n THR 98 CO 0.00 0.00 0.00 0.18 -0.57 0.00 0.00 175.07 174.68 1avw n LEU 99 N 0.99 -0.70 -4.92 3.22 4.77 0.69 -4.96 117.00 116.09 1avw n LEU 99 Ca 0.15 0.31 -0.30 0.00 -0.03 0.00 0.00 56.01 56.14 1avw n LEU 99 Cb 0.54 -2.34 -0.04 0.00 -2.33 0.00 0.00 43.42 39.25 1avw n LEU 99 CO 0.16 -0.86 -0.08 -0.62 -1.33 0.00 0.00 177.39 174.66 1avw s ASP 100 N -2.61 6.39 -1.27 -1.43 2.15 -1.16 -4.34 116.67 114.41 1avw s ASP 100 Ca 0.00 0.34 -0.03 0.00 0.43 0.00 0.00 52.55 53.29 1avw s ASP 100 Cb 0.00 -1.99 0.01 0.00 -0.30 0.00 0.00 42.92 40.64 1avw s ASP 100 CO 0.00 0.10 1.04 0.59 -0.17 0.00 0.00 175.17 176.73 1avw n ASN 101 N 0.01 -3.40 -4.17 -0.34 4.13 -1.26 -1.87 115.26 108.36 1avw n ASN 101 Ca -0.05 -0.62 -0.43 0.00 1.68 0.00 0.00 54.58 55.17 1avw n ASN 101 Cb 0.52 -4.98 0.00 0.00 -1.54 0.00 0.00 39.78 33.78 1avw n ASN 101 CO 0.00 0.00 0.00 -0.67 0.28 0.00 0.00 177.26 176.87 1avw n ASP 102 N -3.08 4.99 -3.78 6.41 2.03 -1.26 -4.14 116.55 117.71 1avw n ASP 102 Ca -0.19 -3.01 -0.13 0.00 0.52 0.00 0.00 54.79 51.99 1avw n ASP 102 Cb 0.63 -1.57 -0.10 0.00 -0.72 0.00 0.00 41.12 39.36 1avw n ASP 102 CO 0.00 0.00 0.00 -0.51 -1.92 0.00 0.00 177.20 174.77 1avw s ILE 103 N 1.61 0.02 -0.03 5.18 2.07 -1.26 -3.70 121.20 125.08 1avw s ILE 103 Ca 0.43 -0.18 -0.07 0.00 -1.41 0.00 0.00 60.65 59.42 1avw s ILE 103 Cb 0.05 -0.46 0.01 0.00 0.13 0.00 0.00 42.46 42.19 1avw s ILE 103 CO 0.00 -0.10 0.17 -0.32 -1.91 0.00 0.00 174.94 172.78 1avw s MET 104 N -0.35 0.35 -0.07 3.50 -2.45 -0.55 -1.09 119.30 118.64 1avw s MET 104 Ca -0.05 -0.05 0.02 0.00 -1.25 0.00 0.00 55.69 54.36 1avw s MET 104 Cb -0.03 0.16 -0.03 0.00 1.25 0.00 0.00 34.83 36.18 1avw s MET 104 CO 0.01 -0.07 -0.11 -0.51 1.05 0.00 0.00 175.02 175.39 1avw s LEU 105 N -0.62 2.89 -0.15 4.11 1.43 0.94 -1.57 118.68 125.71 1avw s LEU 105 Ca -0.07 -0.15 0.01 0.00 -1.03 0.00 0.00 54.13 52.89 1avw s LEU 105 Cb -0.04 -1.61 0.00 0.00 0.03 0.00 0.00 46.19 44.57 1avw s LEU 105 CO 0.01 0.32 -0.18 -0.63 0.23 0.00 0.00 176.35 176.10 1avw s ILE 106 N -0.59 2.40 -0.20 -0.59 1.01 -0.27 -0.31 121.20 122.65 1avw s ILE 106 Ca 0.09 -0.86 -0.17 0.00 0.00 0.00 0.00 60.65 59.71 1avw s ILE 106 Cb -0.11 -1.99 -0.04 0.00 0.01 0.00 0.00 42.46 40.32 1avw s ILE 106 CO 0.01 0.53 0.43 -0.75 0.00 0.00 0.00 174.94 175.16 1avw s LYS 107 N 0.83 4.17 0.43 2.79 2.20 0.25 -0.85 119.74 129.56 1avw s LYS 107 Ca -0.06 0.25 -0.24 0.00 -0.36 0.00 0.00 55.97 55.57 1avw s LYS 107 Cb -0.15 -3.55 -0.08 0.00 -1.51 0.00 0.00 37.83 32.54 1avw s LYS 107 CO -0.01 -0.07 1.13 -0.51 -0.36 0.00 0.00 175.35 175.52 1avw s LEU 108 N 1.41 4.08 0.23 5.43 1.43 0.54 0.49 118.68 132.30 1avw s LEU 108 Ca 0.20 2.22 0.24 0.00 -1.03 0.00 0.00 54.13 55.77 1avw s LEU 108 Cb -0.15 -4.19 0.92 0.00 0.03 0.00 0.00 46.19 42.80 1avw s LEU 108 CO 0.08 -0.74 1.73 -1.54 0.23 0.00 0.00 176.35 176.12 1avw n SER 109 N -0.27 0.69 -3.74 2.29 3.41 -0.29 -4.60 113.62 111.11 1avw n SER 109 Ca 0.06 0.63 -0.12 0.00 -0.26 0.00 0.00 58.87 59.18 1avw n SER 109 Cb 0.48 -0.79 -0.07 0.00 -0.26 0.00 0.00 64.21 63.57 1avw n SER 109 CO 0.00 0.00 0.00 -0.94 -0.16 0.00 0.00 175.04 173.94 1avw s SER 110 N -4.29 -0.17 0.44 4.04 1.04 -1.26 -5.01 113.70 108.49 1avw s SER 110 Ca 0.07 -0.10 -0.24 0.00 0.48 0.00 0.00 55.95 56.15 1avw s SER 110 Cb 0.10 0.36 -0.08 0.00 0.10 0.00 0.00 66.02 66.51 1avw s SER 110 CO 0.46 -0.59 1.24 -2.16 0.98 0.00 0.00 173.24 173.17 1avw s PRO 111 N -2.29 3.83 0.51 4.02 0.04 -1.26 -4.89 135.00 134.96 1avw s PRO 111 Ca -0.07 1.98 -0.22 0.00 0.04 0.00 0.00 61.00 62.73 1avw s PRO 111 Cb -0.02 -2.58 -0.06 0.00 0.04 0.00 0.00 34.50 31.88 1avw s PRO 111 CO -0.02 -0.55 1.25 0.00 0.04 0.00 0.00 177.00 177.72 1avw s ALA 112 N -1.38 2.88 -0.36 8.56 0.00 0.19 -5.00 121.76 126.65 1avw s ALA 112 Ca 0.61 1.10 -0.25 0.00 0.00 0.00 0.00 51.96 53.42 1avw s ALA 112 Cb -0.34 -3.46 0.01 0.00 0.00 0.00 0.00 23.12 19.33 1avw s ALA 112 CO 0.42 -0.99 0.86 0.99 0.00 0.00 0.00 175.76 177.05 1avw s THR 113 N -1.45 4.66 -0.00 0.00 2.01 -1.26 -4.85 115.64 114.74 1avw s THR 113 Ca 0.68 1.09 -0.27 0.00 0.31 0.00 0.00 61.69 63.50 1avw s THR 113 Cb -0.33 -4.27 -0.04 0.00 0.01 0.00 0.00 72.50 67.87 1avw s THR 113 CO 0.40 -0.47 0.86 -0.76 -0.69 0.00 0.00 174.62 173.96 1avw s LEU 114 N 3.29 4.38 0.00 4.42 1.02 -1.26 -4.77 118.68 125.75 1avw s LEU 114 Ca 0.35 1.49 0.00 0.00 0.02 0.00 0.00 54.13 55.99 1avw s LEU 114 Cb -0.13 -3.36 0.00 0.00 0.02 0.00 0.00 46.19 42.72 1avw s LEU 114 CO 0.17 -0.15 0.00 -0.46 0.02 0.00 0.00 176.35 175.93 1avw n ASN 115 N 3.57 0.00 0.01 2.29 2.04 0.33 -4.98 115.26 118.52 1avw n ASN 115 Ca 0.02 -0.10 -0.03 0.00 -0.44 0.00 0.00 54.58 54.02 1avw n ASN 115 Cb 0.51 0.00 0.20 0.00 -2.53 0.00 0.00 39.78 37.96 1avw n ASN 115 CO 0.00 0.00 0.00 0.77 -0.44 0.00 0.00 177.26 177.59 1avw h SER 116 N 0.00 0.50 0.78 0.53 4.64 -1.99 -3.05 113.55 114.95 1avw h SER 116 Ca 0.00 -0.16 0.00 0.00 -0.47 0.00 0.00 61.79 61.16 1avw h SER 116 Cb 0.00 -0.14 0.00 0.00 -0.31 0.00 0.00 62.40 61.95 1avw h SER 116 CO 0.00 0.73 -0.81 0.54 -0.87 0.00 0.00 176.83 176.42 1avw n ARG 117 N -4.13 0.36 -3.78 4.77 3.00 -1.26 -4.77 116.66 110.84 1avw n ARG 117 Ca -0.00 0.07 -0.28 0.00 -0.01 0.00 0.00 57.85 57.62 1avw n ARG 117 Cb 0.39 -1.69 -0.16 0.00 0.00 0.00 0.00 32.46 31.00 1avw n ARG 117 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.63 177.71 1avw s VAL 118 N -3.22 0.78 0.12 1.55 1.01 -1.15 -4.30 120.40 115.19 1avw s VAL 118 Ca 0.04 -0.81 -0.07 0.00 0.00 0.00 0.00 61.98 61.14 1avw s VAL 118 Cb 0.13 -1.28 -0.01 0.00 0.00 0.00 0.00 36.38 35.22 1avw s VAL 118 CO 0.76 -0.25 0.19 0.00 0.00 0.00 0.00 175.10 175.80 1avw s ALA 119 N 1.73 0.06 0.33 5.51 0.00 -0.83 -0.51 121.76 128.05 1avw s ALA 119 Ca -0.01 -0.88 -0.03 0.00 0.00 0.00 0.00 51.96 51.04 1avw s ALA 119 Cb -0.17 0.66 -0.04 0.00 0.00 0.00 0.00 23.12 23.57 1avw s ALA 119 CO -0.10 -0.55 0.59 0.95 0.00 0.00 0.00 175.76 176.65 1avw s THR 120 N -3.93 5.03 0.07 0.00 -4.23 -1.26 -3.07 115.64 108.24 1avw s THR 120 Ca 0.12 -0.07 0.04 0.00 -1.18 0.00 0.00 61.69 60.61 1avw s THR 120 Cb 0.05 -3.79 -0.04 0.00 1.34 0.00 0.00 72.50 70.06 1avw s THR 120 CO -0.05 -0.47 -0.02 0.54 -0.54 0.00 0.00 174.62 174.08 1avw s VAL 121 N -2.25 3.90 0.23 2.29 0.11 -0.19 -4.81 120.40 119.68 1avw s VAL 121 Ca 0.43 -0.94 -0.29 0.00 -2.93 0.00 0.00 61.98 58.25 1avw s VAL 121 Cb -0.10 -2.82 -0.09 0.00 -1.53 0.00 0.00 36.38 31.84 1avw s VAL 121 CO 0.34 0.19 0.91 -0.55 -3.33 0.00 0.00 175.10 172.66 1avw s SER 122 N -2.06 7.60 0.56 3.54 0.15 -1.25 -4.60 113.70 117.65 1avw s SER 122 Ca 0.23 1.90 -0.18 0.00 0.70 0.00 0.00 55.95 58.60 1avw s SER 122 Cb -0.11 -2.59 -0.05 0.00 -1.71 0.00 0.00 66.02 61.56 1avw s SER 122 CO 0.15 0.16 1.10 -0.76 1.20 0.00 0.00 173.24 175.10 1avw s LEU 123 N -1.19 3.66 0.40 3.45 1.43 -1.26 -0.54 118.68 124.62 1avw s LEU 123 Ca 0.40 2.06 -0.25 0.00 -1.03 0.00 0.00 54.13 55.31 1avw s LEU 123 Cb -0.25 -4.57 -0.08 0.00 0.03 0.00 0.00 46.19 41.32 1avw s LEU 123 CO 0.31 -1.23 1.16 -2.16 0.23 0.00 0.00 176.35 174.67 1avw s PRO 124 N -3.54 4.07 0.21 1.29 0.04 -1.25 -4.73 135.00 131.09 1avw s PRO 124 Ca 0.70 1.82 0.22 0.00 0.04 0.00 0.00 61.00 63.78 1avw s PRO 124 Cb -0.21 -2.68 0.01 0.00 0.04 0.00 0.00 34.50 31.66 1avw s PRO 124 CO 0.30 -0.30 1.07 0.00 0.04 0.00 0.00 177.00 178.10 1avw h ARG 125 N 2.65 0.00 -3.21 4.56 2.47 -1.95 -3.48 114.38 115.41 1avw h ARG 125 Ca -0.49 0.00 0.00 0.00 -1.26 0.00 0.00 59.98 58.24 1avw h ARG 125 Cb 1.23 0.00 -0.05 0.00 -1.65 0.00 0.00 29.97 29.50 1avw h ARG 125 CO 0.63 0.04 0.14 -1.54 0.56 0.00 0.00 179.97 179.79 1avw s SER 127 N -5.48 -0.10 0.61 7.04 1.04 -1.26 -5.17 113.70 110.38 1avw s SER 127 Ca -0.00 -0.84 -0.14 0.00 0.48 0.00 0.00 55.95 55.44 1avw s SER 127 Cb 0.09 0.72 -0.03 0.00 0.10 0.00 0.00 66.02 66.90 1avw s SER 127 CO 0.78 -1.37 1.04 0.00 0.98 0.00 0.00 173.24 174.67 1avw s ALA 129 N -2.72 3.41 0.40 0.00 0.00 -1.26 -5.04 121.76 116.55 1avw s ALA 129 Ca 0.60 0.28 -0.25 0.00 0.00 0.00 0.00 51.96 52.59 1avw s ALA 129 Cb -0.14 -2.95 -0.08 0.00 0.00 0.00 0.00 23.12 19.95 1avw s ALA 129 CO 0.42 0.16 1.15 0.00 0.00 0.00 0.00 175.76 177.49 1avw s ALA 130 N -0.45 3.14 0.18 0.00 0.00 -1.26 -4.98 121.76 118.40 1avw s ALA 130 Ca 0.37 0.93 -0.32 0.00 0.00 0.00 0.00 51.96 52.95 1avw s ALA 130 Cb -0.21 -3.37 -0.16 0.00 0.00 0.00 0.00 23.12 19.38 1avw s ALA 130 CO 0.23 -0.49 0.99 0.00 0.00 0.00 0.00 175.76 176.49 1avw n ALA 132 N 0.06 -1.42 0.00 0.00 0.00 -1.26 -1.59 120.51 116.30 1avw n ALA 132 Ca 0.04 0.46 0.00 0.00 0.00 0.00 0.00 53.44 53.94 1avw n ALA 132 Cb 0.47 -1.91 0.00 0.00 0.00 0.00 0.00 19.45 18.01 1avw n ALA 132 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1avw n GLY 133 N 1.80 3.25 3.66 0.00 0.00 0.13 -4.96 105.19 109.07 1avw n GLY 133 Ca 0.15 0.00 -0.48 0.00 0.00 0.00 0.00 46.02 45.70 1avw n GLY 133 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 1avw n THR 134 N -1.12 0.15 -2.82 2.61 -1.04 -0.62 -4.56 114.28 106.88 1avw n THR 134 Ca 0.00 -0.03 -0.40 0.00 -2.04 0.00 0.00 64.05 61.58 1avw n THR 134 Cb 0.00 -1.53 -0.05 0.00 -1.82 0.00 0.00 70.33 66.92 1avw n THR 134 CO 0.00 0.00 0.00 -0.70 -0.64 0.00 0.00 175.07 173.73 1avw s GLU 135 N 1.71 4.69 0.20 -2.82 2.12 -1.26 -0.20 118.70 123.14 1avw s GLU 135 Ca 0.83 1.35 0.03 0.00 0.36 0.00 0.00 54.97 57.54 1avw s GLU 135 Cb -0.72 -3.33 -0.05 0.00 0.26 0.00 0.00 34.13 30.29 1avw s GLU 135 CO 0.43 0.38 -0.01 0.00 -0.54 0.00 0.00 175.26 175.52 1avw s LEU 137 N -3.23 2.72 -0.03 0.00 2.96 -0.08 -1.51 118.68 119.50 1avw s LEU 137 Ca 0.26 -0.42 -0.00 0.00 -0.22 0.00 0.00 54.13 53.74 1avw s LEU 137 Cb 0.06 -1.67 -0.04 0.00 0.50 0.00 0.00 46.19 45.04 1avw s LEU 137 CO 0.06 0.02 0.02 -0.63 -1.32 0.00 0.00 176.35 174.50 1avw s ILE 138 N 1.21 4.32 0.03 6.68 1.01 0.44 -1.58 121.20 133.31 1avw s ILE 138 Ca 0.02 -0.43 -0.07 0.00 0.00 0.00 0.00 60.65 60.17 1avw s ILE 138 Cb -0.14 -2.89 -0.00 0.00 0.01 0.00 0.00 42.46 39.43 1avw s ILE 138 CO -0.03 0.46 0.12 -0.94 0.00 0.00 0.00 174.94 174.55 1avw s SER 139 N -1.34 0.10 0.00 3.58 1.04 -1.22 -0.66 113.70 115.20 1avw s SER 139 Ca 0.18 -0.39 0.00 0.00 0.48 0.00 0.00 55.95 56.22 1avw s SER 139 Cb -0.12 0.23 0.00 0.00 0.10 0.00 0.00 66.02 66.23 1avw s SER 139 CO 0.08 -0.46 0.00 0.61 0.98 0.00 0.00 173.24 174.44 1avw n GLY 140 N 1.01 0.77 1.45 7.32 0.00 -0.74 -4.41 105.19 110.59 1avw n GLY 140 Ca -0.20 -0.99 -0.03 0.00 0.00 0.00 0.00 46.02 44.79 1avw n GLY 140 CO 0.00 0.00 0.00 0.79 0.00 0.00 0.00 173.32 174.11 1avw n TRP 141 N -0.47 1.67 -1.66 1.61 8.01 -1.26 -1.67 117.44 123.68 1avw n TRP 141 Ca 0.00 -1.30 -0.30 0.00 -1.31 0.00 0.00 57.50 54.59 1avw n TRP 141 Cb 0.00 -0.55 0.19 0.00 -2.01 0.00 0.00 31.31 28.94 1avw n TRP 141 CO 0.00 0.00 0.00 0.20 -1.01 0.00 0.00 177.69 176.88 1avw s GLY 142 N -1.78 1.70 0.24 6.99 0.00 -1.25 -4.35 107.32 108.87 1avw s GLY 142 Ca 0.49 -1.06 -0.30 0.00 0.00 0.00 0.00 44.72 43.84 1avw s GLY 142 CO 0.08 -0.28 1.16 -2.01 0.00 0.00 0.00 173.10 172.04 1avw n ASN 143 N -4.04 1.68 -0.87 1.64 5.15 0.62 -3.17 115.26 116.26 1avw n ASN 143 Ca 0.14 1.16 0.09 0.00 -0.60 0.00 0.00 54.58 55.37 1avw n ASN 143 Cb 0.59 -1.30 0.15 0.00 -0.53 0.00 0.00 39.78 38.69 1avw n ASN 143 CO 0.00 0.00 0.00 0.35 1.40 0.00 0.00 177.26 179.01 1avw n THR 144 N 1.05 0.37 -5.02 -0.44 -2.24 -0.43 -1.15 114.28 106.43 1avw n THR 144 Ca 0.12 -0.69 -0.32 0.00 -2.27 0.00 0.00 64.05 60.89 1avw n THR 144 Cb 0.29 1.06 -0.14 0.00 -2.10 0.00 0.00 70.33 69.44 1avw n THR 144 CO 0.00 0.00 0.00 -0.54 -0.57 0.00 0.00 175.07 173.96 1avw s LYS 145 N -1.35 2.57 0.00 -0.78 1.02 -1.26 -4.37 119.74 115.57 1avw s LYS 145 Ca 0.28 -0.78 0.29 0.00 0.02 0.00 0.00 55.97 55.79 1avw s LYS 145 Cb 0.17 -2.31 1.26 0.00 -0.52 0.00 0.00 37.83 36.43 1avw s LYS 145 CO 0.25 0.51 1.90 -1.13 -0.92 0.00 0.00 175.35 175.96 1avw n SER 146 N 2.63 0.16 -3.77 2.83 3.41 -1.26 -4.74 113.62 112.88 1avw n SER 146 Ca -0.17 -0.04 -0.14 0.00 -0.26 0.00 0.00 58.87 58.26 1avw n SER 146 Cb 0.52 -0.25 -0.15 0.00 -0.26 0.00 0.00 64.21 64.07 1avw n SER 146 CO 0.00 0.00 0.00 -0.55 -0.16 0.00 0.00 175.04 174.33 1avw s SER 147 N -2.73 -0.06 0.33 4.04 0.15 -1.26 -4.72 113.70 109.45 1avw s SER 147 Ca 0.22 0.21 0.00 0.00 0.70 0.00 0.00 55.95 57.08 1avw s SER 147 Cb 0.20 0.11 0.00 0.00 -1.71 0.00 0.00 66.02 64.62 1avw s SER 147 CO 0.51 -0.13 0.00 0.61 1.20 0.00 0.00 173.24 175.44 1avw n GLY 148 N 4.02 -1.25 3.21 9.45 0.00 -1.26 -4.97 105.19 114.39 1avw n GLY 148 Ca -0.25 -1.22 -0.13 0.00 0.00 0.00 0.00 46.02 44.42 1avw n GLY 148 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1avw s SER 149 N -4.00 -0.21 -0.22 1.61 1.04 -1.26 -4.69 113.70 105.97 1avw s SER 149 Ca 0.00 0.24 -0.04 0.00 0.48 0.00 0.00 55.95 56.63 1avw s SER 149 Cb 0.00 0.41 0.11 0.00 0.10 0.00 0.00 66.02 66.65 1avw s SER 149 CO 0.00 -0.31 0.37 -0.55 0.98 0.00 0.00 173.24 173.73 1avw s SER 150 N -0.78 0.17 -0.27 7.02 0.15 -1.26 -4.95 113.70 113.78 1avw s SER 150 Ca -0.09 0.46 -0.14 0.00 0.70 0.00 0.00 55.95 56.89 1avw s SER 150 Cb -0.04 1.10 -0.04 0.00 -1.71 0.00 0.00 66.02 65.32 1avw s SER 150 CO 0.02 -0.27 0.33 -0.31 1.20 0.00 0.00 173.24 174.21 1avw s TYR 151 N 2.54 3.25 0.46 3.44 1.51 -1.26 -1.31 117.35 125.98 1avw s TYR 151 Ca 0.07 0.35 -0.19 0.00 -1.01 0.00 0.00 57.07 56.29 1avw s TYR 151 Cb -0.14 -2.52 -0.10 0.00 -0.11 0.00 0.00 41.96 39.09 1avw s TYR 151 CO -0.14 -0.19 0.96 -1.25 -1.11 0.00 0.00 175.55 173.82 1avw s PRO 152 N 1.93 4.13 0.10 -1.71 0.04 -1.26 -4.98 135.00 133.25 1avw s PRO 152 Ca 0.13 1.05 -0.16 0.00 0.04 0.00 0.00 61.00 62.07 1avw s PRO 152 Cb -0.16 -2.17 -0.06 0.00 0.04 0.00 0.00 34.50 32.15 1avw s PRO 152 CO 0.10 -0.11 1.49 0.77 0.04 0.00 0.00 177.00 179.29 1avw h SER 153 N 1.57 0.66 -2.79 6.66 0.02 -1.94 -3.46 113.55 114.28 1avw h SER 153 Ca -0.48 -0.39 -0.64 0.00 -0.84 0.00 0.00 61.79 59.44 1avw h SER 153 Cb 1.18 -0.18 -0.06 0.00 0.14 0.00 0.00 62.40 63.48 1avw h SER 153 CO 0.61 0.90 -0.46 -0.76 -1.14 0.00 0.00 176.83 175.98 1avw s LEU 154 N -9.23 4.38 0.31 5.07 2.01 -1.26 -1.33 118.68 118.63 1avw s LEU 154 Ca -0.13 0.44 -0.29 0.00 0.01 0.00 0.00 54.13 54.16 1avw s LEU 154 Cb 0.09 -2.47 -0.11 0.00 0.01 0.00 0.00 46.19 43.71 1avw s LEU 154 CO 0.80 0.30 1.56 -0.22 1.01 0.00 0.00 176.35 179.81 1avw s LEU 155 N -1.62 4.34 0.10 1.79 2.96 -1.02 -4.88 118.68 120.35 1avw s LEU 155 Ca 0.24 2.97 0.05 0.00 -0.22 0.00 0.00 54.13 57.16 1avw s LEU 155 Cb -0.13 -3.64 -0.04 0.00 0.50 0.00 0.00 46.19 42.88 1avw s LEU 155 CO 0.14 -0.90 0.03 -1.10 -1.32 0.00 0.00 176.35 173.20 1avw s GLN 156 N -0.90 2.66 0.08 1.98 -1.52 -0.67 -1.16 119.66 120.14 1avw s GLN 156 Ca 0.60 -0.82 0.05 0.00 -1.95 0.00 0.00 55.36 53.25 1avw s GLN 156 Cb -0.47 -2.59 -0.03 0.00 -0.22 0.00 0.00 33.01 29.70 1avw s GLN 156 CO 0.52 0.54 -0.15 0.00 -0.25 0.00 0.00 175.29 175.94 1avw s LEU 158 N -1.87 -0.20 -0.17 0.00 2.96 0.16 -0.76 118.68 118.81 1avw s LEU 158 Ca 0.00 1.00 -0.14 0.00 -0.22 0.00 0.00 54.13 54.77 1avw s LEU 158 Cb -0.09 1.54 -0.04 0.00 0.50 0.00 0.00 46.19 48.10 1avw s LEU 158 CO 0.02 -0.20 0.33 -0.54 -1.32 0.00 0.00 176.35 174.64 1avw s LYS 159 N 1.32 4.24 -0.05 1.98 1.02 -1.26 -0.42 119.74 126.56 1avw s LYS 159 Ca -0.09 0.13 -0.17 0.00 0.02 0.00 0.00 55.97 55.87 1avw s LYS 159 Cb -0.07 -3.46 0.03 0.00 -0.52 0.00 0.00 37.83 33.82 1avw s LYS 159 CO -0.13 0.16 0.38 0.00 -0.92 0.00 0.00 175.35 174.85 1avw s ALA 160 N 0.69 -0.97 0.17 5.17 0.00 -0.57 -4.94 121.76 121.30 1avw s ALA 160 Ca 0.17 0.66 -0.11 0.00 0.00 0.00 0.00 51.96 52.69 1avw s ALA 160 Cb -0.14 -0.12 -0.07 0.00 0.00 0.00 0.00 23.12 22.80 1avw s ALA 160 CO 0.05 -0.26 0.52 -1.25 0.00 0.00 0.00 175.76 174.82 1avw s PRO 161 N -0.93 3.85 0.13 0.00 0.04 -1.26 -0.12 135.00 136.71 1avw s PRO 161 Ca -0.10 0.32 -0.31 0.00 0.04 0.00 0.00 61.00 60.95 1avw s PRO 161 Cb -0.04 -2.81 -0.10 0.00 0.04 0.00 0.00 34.50 31.59 1avw s PRO 161 CO 0.04 0.42 1.67 0.08 0.04 0.00 0.00 177.00 179.25 1avw s VAL 162 N -1.62 2.63 0.43 -0.36 1.01 0.73 -1.86 120.40 121.36 1avw s VAL 162 Ca 0.42 0.31 -0.08 0.00 0.00 0.00 0.00 61.98 62.62 1avw s VAL 162 Cb -0.13 -3.20 -0.05 0.00 0.00 0.00 0.00 36.38 33.00 1avw s VAL 162 CO 0.20 0.01 0.76 -0.76 0.00 0.00 0.00 175.10 175.32 1avw s LEU 163 N 1.92 3.76 0.57 3.92 1.43 -0.20 0.17 118.68 130.25 1avw s LEU 163 Ca 0.74 1.03 -0.20 0.00 -1.03 0.00 0.00 54.13 54.67 1avw s LEU 163 Cb -0.44 -3.93 -0.04 0.00 0.03 0.00 0.00 46.19 41.81 1avw s LEU 163 CO 0.33 -0.46 1.25 -0.94 0.23 0.00 0.00 176.35 176.75 1avw s SER 164 N -3.55 5.25 0.36 2.29 1.04 -1.26 -4.67 113.70 113.16 1avw s SER 164 Ca 0.49 2.49 0.04 0.00 0.48 0.00 0.00 55.95 59.45 1avw s SER 164 Cb -0.10 -2.61 0.69 0.00 0.10 0.00 0.00 66.02 64.10 1avw s SER 164 CO 0.37 -1.56 2.00 -0.78 0.98 0.00 0.00 173.24 174.25 1avw h ASP 165 N 1.11 0.63 -0.50 7.02 3.58 -1.97 0.15 116.42 126.45 1avw h ASP 165 Ca -0.50 -0.03 -0.10 0.00 0.42 0.00 0.00 57.03 56.81 1avw h ASP 165 Cb 1.30 -0.16 -0.02 0.00 1.72 0.00 0.00 39.33 42.17 1avw h ASP 165 CO 0.56 0.49 -0.09 0.77 -2.88 0.00 0.00 179.24 178.08 1avw h SER 166 N 0.72 0.94 -0.59 2.28 4.64 -1.99 0.18 113.55 119.74 1avw h SER 166 Ca 0.19 -0.35 0.04 0.00 -0.47 0.00 0.00 61.79 61.21 1avw h SER 166 Cb -0.02 -0.26 -0.05 0.00 -0.31 0.00 0.00 62.40 61.77 1avw h SER 166 CO -0.04 1.07 0.32 0.28 -0.87 0.00 0.00 176.83 177.60 1avw h SER 167 N 0.80 0.49 -0.10 4.97 0.02 -1.79 -1.23 113.55 116.70 1avw h SER 167 Ca 0.13 0.02 -0.02 0.00 -0.84 0.00 0.00 61.79 61.08 1avw h SER 167 Cb 0.64 -0.08 -0.00 0.00 0.14 0.00 0.00 62.40 63.10 1avw h SER 167 CO 0.04 0.33 -0.01 0.00 -1.14 0.00 0.00 176.83 176.05 1avw h LYS 169 N -0.11 0.16 0.00 0.00 1.57 -0.51 -1.99 116.57 115.69 1avw h LYS 169 Ca 0.03 -0.03 -0.02 0.00 -1.87 0.00 0.00 60.65 58.76 1avw h LYS 169 Cb 0.39 -0.03 -0.00 0.00 0.08 0.00 0.00 32.23 32.67 1avw h LYS 169 CO 0.01 0.24 -0.10 0.77 -0.57 0.00 0.00 179.45 179.80 1avw h SER 170 N 0.16 0.00 -0.01 0.86 0.02 -1.14 -2.90 113.55 110.54 1avw h SER 170 Ca 0.04 0.00 -0.20 0.00 -0.84 0.00 0.00 61.79 60.78 1avw h SER 170 Cb 0.23 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.77 1avw h SER 170 CO 0.01 0.10 -0.73 0.28 -1.14 0.00 0.00 176.83 175.35 1avw h SER 171 N 0.00 0.77 -2.23 3.07 0.02 -0.68 -3.37 113.55 111.13 1avw h SER 171 Ca -0.00 -0.49 -0.58 0.00 -0.84 0.00 0.00 61.79 59.87 1avw h SER 171 Cb 1.04 -0.23 -0.40 0.00 0.14 0.00 0.00 62.40 62.95 1avw h SER 171 CO 0.01 1.27 -0.85 -1.22 -1.14 0.00 0.00 176.83 174.90 1avw n TYR 172 N -3.91 1.37 -1.67 3.45 4.01 -1.13 -4.90 117.16 114.39 1avw n TYR 172 Ca -0.06 -3.82 -0.48 0.00 -0.16 0.00 0.00 57.90 53.38 1avw n TYR 172 Cb 0.71 -0.37 -0.05 0.00 -0.31 0.00 0.00 39.34 39.32 1avw n TYR 172 CO 0.00 0.00 0.00 -2.30 -0.46 0.00 0.00 176.86 174.10 1avw n PRO 173 N 1.45 2.02 -0.11 -0.72 -0.02 -1.10 -1.10 135.00 135.43 1avw n PRO 173 Ca 0.25 0.74 0.00 0.00 -2.02 0.00 0.00 63.50 62.47 1avw n PRO 173 Cb 0.46 -2.53 0.00 0.00 -0.02 0.00 0.00 33.50 31.41 1avw n PRO 173 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1avw n GLY 174 N 3.90 1.76 0.01 -1.23 0.00 -1.26 -4.85 105.19 103.52 1avw n GLY 174 Ca 0.21 0.00 0.07 0.00 0.00 0.00 0.00 46.02 46.30 1avw n GLY 174 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 1avw n GLN 175 N -2.00 0.65 -3.04 1.61 6.02 -0.26 -4.94 117.38 115.42 1avw n GLN 175 Ca 0.00 -0.12 -0.41 0.00 -0.01 0.00 0.00 57.00 56.46 1avw n GLN 175 Cb 0.00 -1.32 -0.06 0.00 1.02 0.00 0.00 30.24 29.89 1avw n GLN 175 CO 0.00 0.00 0.00 0.42 -1.01 0.00 0.00 177.06 176.47 1avw s ILE 176 N -2.91 4.91 0.70 5.09 -1.09 -1.23 -5.04 121.20 121.64 1avw s ILE 176 Ca -0.04 1.17 0.01 0.00 -2.23 0.00 0.00 60.65 59.56 1avw s ILE 176 Cb 0.09 -4.02 0.13 0.00 -1.58 0.00 0.00 42.46 37.08 1avw s ILE 176 CO 0.58 -0.08 0.97 0.42 -1.23 0.00 0.00 174.94 175.61 1avw s THR 177 N 2.68 2.10 -1.38 2.92 -4.23 -1.26 -4.98 115.64 111.48 1avw s THR 177 Ca 0.29 -0.67 0.17 0.00 -1.18 0.00 0.00 61.69 60.30 1avw s THR 177 Cb -0.15 -2.42 0.28 0.00 1.34 0.00 0.00 72.50 71.55 1avw s THR 177 CO 0.10 0.00 1.52 0.61 -0.54 0.00 0.00 174.62 176.31 1avw n GLY 178 N -2.75 -0.89 1.45 3.99 0.00 -1.26 -2.53 105.19 103.20 1avw n GLY 178 Ca 0.16 -0.08 0.09 0.00 0.00 0.00 0.00 46.02 46.18 1avw n GLY 178 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1avw n ASN 179 N -1.31 4.64 -4.10 1.61 3.02 -1.26 -4.94 115.26 112.91 1avw n ASN 179 Ca 0.08 -2.57 -0.23 0.00 -0.03 0.00 0.00 54.58 51.83 1avw n ASN 179 Cb 0.15 -0.56 -0.15 0.00 -0.61 0.00 0.00 39.78 38.60 1avw n ASN 179 CO 0.00 0.00 0.00 -0.04 -2.62 0.00 0.00 177.26 174.60 1avw s MET 180 N -2.06 1.28 0.13 3.52 -1.94 -1.05 -1.01 119.30 118.17 1avw s MET 180 Ca 0.48 -0.51 0.10 0.00 -1.71 0.00 0.00 55.69 54.05 1avw s MET 180 Cb 0.33 -1.20 -0.04 0.00 2.01 0.00 0.00 34.83 35.93 1avw s MET 180 CO 0.20 0.27 -0.24 0.96 -0.01 0.00 0.00 175.02 176.20 1avw s ILE 181 N -0.17 2.04 -0.15 2.53 -4.36 -0.13 -4.84 121.20 116.12 1avw s ILE 181 Ca 0.02 -1.74 -0.09 0.00 -0.26 0.00 0.00 60.65 58.59 1avw s ILE 181 Cb -0.07 -1.85 -0.04 0.00 1.25 0.00 0.00 42.46 41.74 1avw s ILE 181 CO 0.00 -0.03 0.14 0.00 0.24 0.00 0.00 174.94 175.29 1avw s VAL 183 N -0.38 0.60 -1.77 0.00 1.01 -0.94 -1.03 120.40 117.88 1avw s VAL 183 Ca 0.12 -0.19 0.00 0.00 0.00 0.00 0.00 61.98 61.91 1avw s VAL 183 Cb -0.12 -0.59 0.00 0.00 0.00 0.00 0.00 36.38 35.67 1avw s VAL 183 CO 0.02 0.23 0.00 0.61 0.00 0.00 0.00 175.10 175.95 1avw n GLY 184 N 3.80 0.52 2.80 4.51 0.00 -0.78 -3.20 105.19 112.84 1avw n GLY 184 Ca -0.23 -1.37 -0.18 0.00 0.00 0.00 0.00 46.02 44.25 1avw n GLY 184 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1avw s PHE 184 N -4.00 0.31 0.28 1.61 0.08 -1.26 -4.32 117.98 110.69 1avw s PHE 184 Ca 0.00 0.01 0.28 0.00 0.12 0.00 0.00 56.93 57.35 1avw s PHE 184 Cb 0.00 -0.44 1.32 0.00 -0.57 0.00 0.00 43.02 43.32 1avw s PHE 184 CO 0.00 -0.15 1.99 -0.07 -0.10 0.00 0.00 175.22 176.89 1avw h LEU 185 N 7.46 0.00 -0.57 -0.37 3.38 -1.96 -0.33 115.31 122.93 1avw h LEU 185 Ca -0.38 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.59 1avw h LEU 185 Cb 1.13 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.88 1avw h LEU 185 CO 0.43 0.13 0.00 -0.62 0.09 0.00 0.00 178.44 178.47 1avw n GLU 186 N -3.42 0.19 0.00 1.13 4.71 -1.26 0.66 120.64 122.64 1avw n GLU 186 Ca -0.01 0.38 0.00 0.00 -0.01 0.00 0.00 57.16 57.52 1avw n GLU 186 Cb 0.31 -1.84 0.00 0.00 -1.01 0.00 0.00 31.44 28.89 1avw n GLU 186 CO 0.00 0.00 0.00 0.41 0.09 0.00 0.00 177.13 177.63 1avw n GLY 187 N 0.20 -0.86 3.12 0.62 0.00 -0.13 -4.40 105.19 103.73 1avw n GLY 187 Ca 0.03 -1.18 0.00 0.00 0.00 0.00 0.00 46.02 44.86 1avw n GLY 187 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1avw n GLY 188 N 0.00 2.94 2.90 -0.02 0.00 0.27 -4.86 105.19 106.42 1avw n GLY 188 Ca 0.00 0.00 -0.15 0.00 0.00 0.00 0.00 46.02 45.87 1avw n GLY 188 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1avw s LYS 188 N -0.14 0.08 -0.04 1.61 1.02 -1.26 -4.06 119.74 116.95 1avw s LYS 188 Ca 0.00 0.45 -0.30 0.00 0.02 0.00 0.00 55.97 56.13 1avw s LYS 188 Cb 0.00 -0.21 0.11 0.00 -0.52 0.00 0.00 37.83 37.22 1avw s LYS 188 CO 0.00 -0.21 1.11 0.34 -0.92 0.00 0.00 175.35 175.66 1avw s ASP 189 N 1.56 -0.18 0.79 2.83 2.15 -0.78 -4.39 116.67 118.67 1avw s ASP 189 Ca -0.05 -0.11 -0.10 0.00 0.43 0.00 0.00 52.55 52.72 1avw s ASP 189 Cb -0.12 0.27 0.10 0.00 -0.30 0.00 0.00 42.92 42.88 1avw s ASP 189 CO -0.06 -0.47 1.13 -0.94 -0.17 0.00 0.00 175.17 174.66 1avw s SER 190 N -2.60 4.32 0.14 -0.34 1.04 -1.26 -0.21 113.70 114.78 1avw s SER 190 Ca 0.10 0.44 -0.05 0.00 0.48 0.00 0.00 55.95 56.92 1avw s SER 190 Cb 0.00 -0.89 0.02 0.00 0.10 0.00 0.00 66.02 65.26 1avw s SER 190 CO -0.04 -1.96 0.27 0.00 0.98 0.00 0.00 173.24 172.49 1avw n GLN 192 N -0.19 2.47 0.00 0.00 3.00 -1.26 -1.23 117.38 120.16 1avw n GLN 192 Ca -0.03 0.89 0.00 0.00 -0.01 0.00 0.00 57.00 57.85 1avw n GLN 192 Cb 0.21 -2.68 0.00 0.00 0.00 0.00 0.00 30.24 27.77 1avw n GLN 192 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.06 177.47 1avw n GLY 193 N 3.38 0.60 0.07 1.08 0.00 -1.26 -0.28 105.19 108.77 1avw n GLY 193 Ca 0.15 0.00 0.12 0.00 0.00 0.00 0.00 46.02 46.29 1avw n GLY 193 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1avw n ASP 194 N 0.00 0.68 -4.42 1.61 8.00 -0.37 -3.74 116.55 118.31 1avw n ASP 194 Ca 0.00 0.06 -0.44 0.00 0.71 0.00 0.00 54.79 55.12 1avw n ASP 194 Cb 0.00 0.54 -0.01 0.00 -0.02 0.00 0.00 41.12 41.63 1avw n ASP 194 CO 0.00 0.00 0.00 -1.20 -0.39 0.00 0.00 177.20 175.61 1avw n SER 195 N -2.23 -1.13 0.00 -2.24 7.64 -1.26 -1.87 113.62 112.53 1avw n SER 195 Ca 0.02 1.01 0.00 0.00 1.01 0.00 0.00 58.87 60.90 1avw n SER 195 Cb 0.48 -1.03 0.00 0.00 -1.01 0.00 0.00 64.21 62.65 1avw n SER 195 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1avw n GLY 196 N 1.90 2.76 3.92 0.23 0.00 -0.33 0.18 105.19 113.84 1avw n GLY 196 Ca 0.13 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.87 1avw n GLY 196 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1avw s GLY 197 N -1.72 1.66 0.19 -0.02 0.00 -0.78 -3.26 107.32 103.40 1avw s GLY 197 Ca 0.00 -0.88 -0.22 0.00 0.00 0.00 0.00 44.72 43.62 1avw s GLY 197 CO 0.00 -0.36 0.74 2.56 0.00 0.00 0.00 173.10 176.05 1avw s PRO 198 N -5.53 4.40 -0.27 2.90 0.04 -1.26 -1.45 135.00 133.82 1avw s PRO 198 Ca 0.64 1.00 -0.00 0.00 0.04 0.00 0.00 61.00 62.68 1avw s PRO 198 Cb -0.09 -3.06 0.05 0.00 0.04 0.00 0.00 34.50 31.43 1avw s PRO 198 CO 0.48 0.48 -0.05 0.08 0.04 0.00 0.00 177.00 178.04 1avw s VAL 199 N -1.34 2.73 -0.21 -0.36 1.01 -0.48 -3.41 120.40 118.35 1avw s VAL 199 Ca 0.39 -1.35 -0.01 0.00 0.00 0.00 0.00 61.98 61.01 1avw s VAL 199 Cb -0.20 -2.52 0.01 0.00 0.00 0.00 0.00 36.38 33.68 1avw s VAL 199 CO 0.23 0.00 -0.13 -0.69 0.00 0.00 0.00 175.10 174.52 1avw s VAL 200 N 1.23 2.57 -0.12 2.92 1.01 -0.61 -0.52 120.40 126.87 1avw s VAL 200 Ca -0.05 -0.86 0.02 0.00 0.00 0.00 0.00 61.98 61.09 1avw s VAL 200 Cb -0.19 -2.17 0.01 0.00 0.00 0.00 0.00 36.38 34.04 1avw s VAL 200 CO -0.03 0.42 -0.18 0.00 0.00 0.00 0.00 175.10 175.32 1avw n ASN 202 N 4.19 -6.15 0.00 0.00 3.02 -1.26 -1.28 115.26 113.77 1avw n ASN 202 Ca -0.19 -0.45 0.00 0.00 -0.03 0.00 0.00 54.58 53.91 1avw n ASN 202 Cb 0.51 -4.89 0.00 0.00 -0.61 0.00 0.00 39.78 34.79 1avw n ASN 202 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1avw n GLY 203 N -1.79 0.48 3.29 7.41 0.00 -1.26 -5.01 105.19 108.31 1avw n GLY 203 Ca -0.04 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.69 1avw n GLY 203 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1avw s GLN 204 N -0.36 1.86 -0.44 1.61 -0.21 -0.40 -3.76 119.66 117.96 1avw s GLN 204 Ca 0.00 -0.92 -0.28 0.00 0.02 0.00 0.00 55.36 54.17 1avw s GLN 204 Cb 0.00 -1.87 0.01 0.00 1.00 0.00 0.00 33.01 32.15 1avw s GLN 204 CO 0.00 0.50 1.48 -1.17 -2.12 0.00 0.00 175.29 173.98 1avw s LEU 209 N -0.77 3.52 -0.04 2.90 2.96 0.29 -0.76 118.68 126.79 1avw s LEU 209 Ca 0.10 0.76 0.14 0.00 -0.22 0.00 0.00 54.13 54.90 1avw s LEU 209 Cb -0.09 -3.40 -0.21 0.00 0.50 0.00 0.00 46.19 42.99 1avw s LEU 209 CO -0.00 -1.56 0.25 0.00 -1.32 0.00 0.00 176.35 173.71 1avw n GLN 210 N 8.29 0.75 -4.08 1.98 1.13 0.32 -3.92 117.38 121.85 1avw n GLN 210 Ca 0.17 -0.10 -0.08 0.00 -1.94 0.00 0.00 57.00 55.05 1avw n GLN 210 Cb 0.48 -1.33 -0.10 0.00 0.11 0.00 0.00 30.24 29.40 1avw n GLN 210 CO 0.00 0.00 0.00 0.20 -1.44 0.00 0.00 177.06 175.82 1avw s GLY 211 N -3.84 0.45 -0.11 1.08 0.00 -0.90 -2.32 107.32 101.68 1avw s GLY 211 Ca -0.05 -1.11 0.02 0.00 0.00 0.00 0.00 44.72 43.57 1avw s GLY 211 CO 0.57 -1.22 -0.17 -0.42 0.00 0.00 0.00 173.10 171.86 1avw s ILE 212 N -3.49 1.65 0.03 0.90 1.01 -1.08 -1.38 121.20 118.84 1avw s ILE 212 Ca 0.03 -0.74 -0.34 0.00 0.00 0.00 0.00 60.65 59.60 1avw s ILE 212 Cb 0.05 -1.48 -0.13 0.00 0.01 0.00 0.00 42.46 40.91 1avw s ILE 212 CO -0.08 0.47 1.73 0.52 0.00 0.00 0.00 174.94 177.58 1avw n VAL 213 N 4.08 0.30 0.00 2.92 0.31 -0.53 -1.26 118.33 124.15 1avw n VAL 213 Ca -0.19 -0.05 0.00 0.00 -0.01 0.00 0.00 64.34 64.08 1avw n VAL 213 Cb 0.51 -1.70 0.00 0.00 -0.91 0.00 0.00 33.84 31.75 1avw n VAL 213 CO 0.00 0.00 0.00 -0.24 -1.32 0.00 0.00 176.83 175.27 1avw n SER 214 N 5.08 0.00 -3.37 4.52 2.88 -1.08 -1.18 113.62 120.47 1avw n SER 214 Ca 0.20 0.00 -0.11 0.00 -1.33 0.00 0.00 58.87 57.63 1avw n SER 214 Cb 0.29 0.00 -0.02 0.00 -0.75 0.00 0.00 64.21 63.73 1avw n SER 214 CO 0.00 0.00 0.00 -1.66 -1.23 0.00 0.00 175.04 172.15 1avw s TRP 215 N -0.98 0.50 0.00 0.66 1.48 -0.87 -4.91 118.94 114.82 1avw s TRP 215 Ca 0.00 -0.92 0.00 0.00 -1.06 0.00 0.00 56.10 54.12 1avw s TRP 215 Cb 0.00 0.34 0.00 0.00 -1.16 0.00 0.00 33.47 32.65 1avw s TRP 215 CO 0.00 -1.25 0.00 0.41 -4.06 0.00 0.00 176.95 172.05 1avw n GLY 216 N -0.50 0.24 3.56 3.67 0.00 -1.26 -0.73 105.19 110.16 1avw n GLY 216 Ca -0.03 -0.87 -0.41 0.00 0.00 0.00 0.00 46.02 44.71 1avw n GLY 216 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1avw s TYR 217 N -2.00 3.20 0.00 1.61 2.02 -1.26 -4.97 117.35 115.95 1avw s TYR 217 Ca 0.00 0.12 0.00 0.00 -0.37 0.00 0.00 57.07 56.82 1avw s TYR 217 Cb 0.00 -2.76 0.00 0.00 -0.40 0.00 0.00 41.96 38.80 1avw s TYR 217 CO 0.00 -0.45 0.00 0.41 -1.57 0.00 0.00 175.55 173.94 1avw n GLY 219 N 4.85 0.92 2.94 0.71 0.00 -1.26 -4.69 105.19 108.65 1avw n GLY 219 Ca -0.07 -0.75 -0.15 0.00 0.00 0.00 0.00 46.02 45.04 1avw n GLY 219 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1avw n ALA 221 N 3.06 -0.37 -1.77 0.00 0.00 -1.26 -4.61 120.51 115.56 1avw n ALA 221 Ca -0.14 0.29 -0.38 0.00 0.00 0.00 0.00 53.44 53.21 1avw n ALA 221 Cb 0.58 -2.00 -0.05 0.00 0.00 0.00 0.00 19.45 17.98 1avw n ALA 221 CO 0.00 0.00 0.00 -0.65 0.00 0.00 0.00 177.50 176.85 1avw s GLN 221 N -3.95 4.54 0.33 0.00 -1.52 -1.26 -0.56 119.66 117.24 1avw s GLN 221 Ca 0.00 1.48 -0.27 0.00 -1.95 0.00 0.00 55.36 54.62 1avw s GLN 221 Cb 0.00 -2.88 -0.13 0.00 -0.22 0.00 0.00 33.01 29.78 1avw s GLN 221 CO 0.00 0.21 1.06 1.63 -0.25 0.00 0.00 175.29 177.94 1avw n LYS 222 N 0.67 1.51 -1.10 2.91 5.02 -1.26 -2.16 118.16 123.75 1avw n LYS 222 Ca 0.01 0.53 -0.03 0.00 -2.02 0.00 0.00 58.31 56.80 1avw n LYS 222 Cb 0.49 -1.99 -0.01 0.00 -0.02 0.00 0.00 35.03 33.49 1avw n LYS 222 CO 0.00 0.00 0.00 0.09 -0.52 0.00 0.00 177.40 176.97 1avw n ASN 223 N 0.95 -5.83 -3.27 4.39 5.03 0.21 -4.87 115.26 111.87 1avw n ASN 223 Ca 0.08 0.08 -0.25 0.00 0.87 0.00 0.00 54.58 55.37 1avw n ASN 223 Cb 0.35 -3.62 -0.07 0.00 -1.02 0.00 0.00 39.78 35.41 1avw n ASN 223 CO 0.00 0.00 0.00 0.29 -1.83 0.00 0.00 177.26 175.72 1avw n LYS 224 N 0.33 1.53 -1.10 3.52 4.76 -0.92 -4.77 118.16 121.51 1avw n LYS 224 Ca -0.03 -3.86 -0.29 0.00 -2.87 0.00 0.00 58.31 51.25 1avw n LYS 224 Cb 0.51 -1.68 0.17 0.00 -1.84 0.00 0.00 35.03 32.19 1avw n LYS 224 CO 0.00 0.00 0.00 -1.25 -1.37 0.00 0.00 177.40 174.78 1avw s PRO 225 N -1.83 0.68 0.45 1.97 0.04 -1.26 -4.42 135.00 130.64 1avw s PRO 225 Ca 0.38 0.74 -0.23 0.00 0.04 0.00 0.00 61.00 61.92 1avw s PRO 225 Cb 0.17 -1.75 -0.08 0.00 0.04 0.00 0.00 34.50 32.89 1avw s PRO 225 CO -0.07 -2.61 1.16 0.20 0.04 0.00 0.00 177.00 175.72 1avw s GLY 226 N -3.30 2.79 -0.09 0.56 0.00 -1.19 -4.72 107.32 101.36 1avw s GLY 226 Ca 0.65 0.93 0.02 0.00 0.00 0.00 0.00 44.72 46.32 1avw s GLY 226 CO 0.58 1.39 -0.13 0.14 0.00 0.00 0.00 173.10 175.08 1avw s VAL 227 N -1.53 3.08 0.04 1.40 1.01 0.09 -2.22 120.40 122.26 1avw s VAL 227 Ca 0.63 -0.68 0.05 0.00 0.00 0.00 0.00 61.98 61.97 1avw s VAL 227 Cb -0.29 -2.25 -0.02 0.00 0.00 0.00 0.00 36.38 33.82 1avw s VAL 227 CO 0.35 0.56 -0.14 -0.31 0.00 0.00 0.00 175.10 175.56 1avw s TYR 228 N -0.20 1.23 0.19 5.22 1.51 0.93 -2.05 117.35 124.19 1avw s TYR 228 Ca 0.00 -0.35 -0.31 0.00 -1.01 0.00 0.00 57.07 55.41 1avw s TYR 228 Cb -0.13 -0.73 -0.10 0.00 -0.11 0.00 0.00 41.96 40.89 1avw s TYR 228 CO 0.03 0.03 1.52 0.99 -1.11 0.00 0.00 175.55 177.01 1avw s THR 229 N -0.83 2.65 -1.00 -0.71 2.01 -0.39 -0.95 115.64 116.42 1avw s THR 229 Ca 0.02 0.49 -0.21 0.00 0.31 0.00 0.00 61.69 62.30 1avw s THR 229 Cb -0.08 -3.31 0.09 0.00 0.01 0.00 0.00 72.50 69.21 1avw s THR 229 CO 0.01 0.05 1.32 -0.75 -0.69 0.00 0.00 174.62 174.57 1avw s LYS 230 N 0.62 3.62 0.45 4.92 2.20 -0.18 -2.62 119.74 128.74 1avw s LYS 230 Ca 0.66 -1.45 0.11 0.00 -0.36 0.00 0.00 55.97 54.93 1avw s LYS 230 Cb -0.43 -5.18 1.02 0.00 -1.51 0.00 0.00 37.83 31.74 1avw s LYS 230 CO 0.35 -2.02 2.09 0.28 -0.36 0.00 0.00 175.35 175.70 1avw h VAL 231 N 6.31 1.07 0.00 4.02 2.07 -1.77 -1.89 116.25 126.06 1avw h VAL 231 Ca 0.19 -0.13 0.00 0.00 0.82 0.00 0.00 66.70 67.58 1avw h VAL 231 Cb 1.01 0.72 0.00 0.00 -1.52 0.00 0.00 31.29 31.50 1avw h VAL 231 CO 1.29 0.06 0.00 0.00 0.02 0.00 0.00 177.57 178.95 1avw h ASN 233 N 0.00 0.00 -0.01 0.00 2.35 -1.74 -3.35 115.58 112.83 1avw h ASN 233 Ca 0.00 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.75 1avw h ASN 233 Cb 0.11 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.48 1avw h ASN 233 CO 0.00 0.00 0.00 -1.22 -1.65 0.00 0.00 177.43 174.56 1avw n TYR 234 N -2.31 0.00 -0.32 1.19 4.01 0.14 -4.74 117.16 115.14 1avw n TYR 234 Ca 0.05 -0.00 0.04 0.00 -0.16 0.00 0.00 57.90 57.82 1avw n TYR 234 Cb 0.38 -0.00 0.18 0.00 -0.31 0.00 0.00 39.34 39.59 1avw n TYR 234 CO 0.00 0.00 0.00 0.28 -0.46 0.00 0.00 176.86 176.68 1avw h VAL 235 N 1.59 0.95 -0.32 -0.72 2.07 -1.69 0.11 116.25 118.24 1avw h VAL 235 Ca 0.00 -0.31 -0.08 0.00 0.82 0.00 0.00 66.70 67.13 1avw h VAL 235 Cb 0.34 -0.04 -0.01 0.00 -1.52 0.00 0.00 31.29 30.06 1avw h VAL 235 CO 0.00 0.17 -0.10 0.78 0.02 0.00 0.00 177.57 178.44 1avw h ASN 236 N 0.91 0.64 -0.55 0.57 4.21 -1.90 0.03 115.58 119.49 1avw h ASN 236 Ca 0.42 -0.38 0.02 0.00 1.21 0.00 0.00 56.30 57.57 1avw h ASN 236 Cb 0.34 -0.17 -0.03 0.00 -1.12 0.00 0.00 38.32 37.34 1avw h ASN 236 CO -0.23 0.87 0.35 -0.25 -1.29 0.00 0.00 177.43 176.87 1avw h TRP 237 N 0.40 0.65 0.27 1.19 7.01 -1.73 0.11 115.95 123.86 1avw h TRP 237 Ca 0.08 0.02 -0.01 0.00 2.11 0.00 0.00 58.89 61.09 1avw h TRP 237 Cb 0.60 -0.21 -0.00 0.00 -2.10 0.00 0.00 29.16 27.44 1avw h TRP 237 CO 0.05 0.39 -0.16 0.82 -2.79 0.00 0.00 178.44 176.75 1avw h ILE 238 N 0.69 0.67 -0.90 2.65 2.04 -0.55 -0.16 117.51 121.94 1avw h ILE 238 Ca 0.21 0.00 0.02 0.00 1.00 0.00 0.00 64.86 66.10 1avw h ILE 238 Cb -0.02 0.67 -0.05 0.00 -0.74 0.00 0.00 36.82 36.68 1avw h ILE 238 CO -0.08 0.00 0.59 1.56 0.00 0.00 0.00 178.15 180.23 1avw h GLN 239 N -0.41 1.15 -0.41 2.37 4.20 -0.82 -1.97 115.11 119.21 1avw h GLN 239 Ca -0.03 -0.07 -0.01 0.00 0.06 0.00 0.00 58.65 58.60 1avw h GLN 239 Cb 0.34 -0.26 -0.02 0.00 0.30 0.00 0.00 27.48 27.84 1avw h GLN 239 CO 0.04 0.76 0.23 0.37 -0.67 0.00 0.00 178.83 179.56 1avw h GLN 240 N 1.18 0.57 -0.25 1.46 4.15 -0.56 -1.86 115.11 119.81 1avw h GLN 240 Ca 0.34 -0.06 -0.06 0.00 0.77 0.00 0.00 58.65 59.64 1avw h GLN 240 Cb -0.08 -0.11 -0.01 0.00 0.21 0.00 0.00 27.48 27.49 1avw h GLN 240 CO -0.09 0.45 -0.06 1.15 -1.93 0.00 0.00 178.83 178.35 1avw h THR 241 N 0.53 1.28 -0.62 2.39 2.02 -0.82 -2.11 112.91 115.58 1avw h THR 241 Ca 0.14 -1.07 0.02 0.00 0.77 0.00 0.00 66.41 66.27 1avw h THR 241 Cb 0.05 1.47 -0.04 0.00 -1.74 0.00 0.00 68.15 67.89 1avw h THR 241 CO -0.02 0.34 0.39 0.40 0.37 0.00 0.00 175.52 177.00 1avw h ILE 242 N 0.23 1.11 -0.41 3.11 2.04 -1.32 -2.19 117.51 120.07 1avw h ILE 242 Ca 0.06 -0.27 -0.09 0.00 1.00 0.00 0.00 64.86 65.56 1avw h ILE 242 Cb 0.53 0.25 -0.02 0.00 -0.74 0.00 0.00 36.82 36.85 1avw h ILE 242 CO 0.03 0.14 -0.11 0.00 0.00 0.00 0.00 178.15 178.21 1avw h ALA 243 N 1.25 1.04 -0.00 1.87 0.00 -1.25 -2.66 119.26 119.51 1avw h ALA 243 Ca 0.24 -0.31 0.00 0.00 0.00 0.00 0.00 54.91 54.84 1avw h ALA 243 Cb -0.03 -0.17 0.00 0.00 0.00 0.00 0.00 17.79 17.60 1avw h ALA 243 CO -0.08 0.58 -0.10 0.00 0.00 0.00 0.00 179.25 179.65 1avw n ALA 244 N -2.48 2.67 -0.40 0.00 0.00 -0.80 -5.11 120.51 114.39 1avw n ALA 244 Ca 0.01 -0.20 0.00 0.00 0.00 0.00 0.00 53.44 53.25 1avw n ALA 244 Cb 0.36 -1.39 0.00 0.00 0.00 0.00 0.00 19.45 18.42 1avw n ALA 244 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.50 177.59