#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1vou n LYS 30 N 0.00 0.00 -3.12 5.55 0.00 -1.26 -4.96 118.16 114.38 1vou n LYS 30 Ca 0.00 0.00 -0.20 0.00 -0.00 0.00 0.00 58.31 58.11 1vou n LYS 30 Cb 0.00 0.00 0.06 0.00 -0.00 0.00 0.00 35.03 35.09 1vou n LYS 30 CO 0.00 0.00 0.00 0.95 0.00 0.00 0.00 177.40 178.35 1vou s THR 31 N 0.00 2.04 -0.06 0.58 -4.23 -1.26 -5.10 115.64 107.61 1vou s THR 31 Ca 0.00 -1.04 -0.24 0.00 -1.18 0.00 0.00 61.69 59.22 1vou s THR 31 Cb 0.00 -2.09 0.05 0.00 1.34 0.00 0.00 72.50 71.80 1vou s THR 31 CO 0.00 0.00 0.54 -0.47 -0.54 0.00 0.00 174.62 174.15 1vou s TYR 32 N -2.70 -0.50 -0.22 3.99 6.14 -1.26 -5.03 117.35 117.78 1vou s TYR 32 Ca 0.60 0.90 -0.17 0.00 0.64 0.00 0.00 57.07 59.04 1vou s TYR 32 Cb -0.05 0.28 -0.03 0.00 0.42 0.00 0.00 41.96 42.57 1vou s TYR 32 CO 0.38 -0.49 0.46 -1.50 0.64 0.00 0.00 175.55 175.03 1vou s ILE 33 N -1.03 5.14 0.22 3.14 1.10 -1.26 -4.60 121.20 123.92 1vou s ILE 33 Ca -0.10 0.81 0.23 0.00 -0.51 0.00 0.00 60.65 61.07 1vou s ILE 33 Cb -0.02 -3.78 0.22 0.00 0.15 0.00 0.00 42.46 39.02 1vou s ILE 33 CO 0.07 0.18 1.86 1.55 -2.11 0.00 0.00 174.94 176.50 1vou h PRO 34 N 7.62 0.00 -5.25 3.50 0.13 -1.96 -3.47 132.00 132.58 1vou h PRO 34 Ca -0.33 0.00 -0.25 0.00 -0.87 0.00 0.00 66.00 64.55 1vou h PRO 34 Cb 1.16 0.00 0.17 0.00 0.13 0.00 0.00 31.00 32.46 1vou h PRO 34 CO 0.72 0.24 -0.76 1.63 -0.23 0.00 0.00 178.00 179.60 1vou n LYS 35 N -3.52 -3.14 -2.44 0.86 4.76 -1.26 -4.24 118.16 109.17 1vou n LYS 35 Ca -0.01 0.78 -0.03 0.00 -2.87 0.00 0.00 58.31 56.19 1vou n LYS 35 Cb 0.40 -5.47 -0.03 0.00 -1.84 0.00 0.00 35.03 28.09 1vou n LYS 35 CO 0.00 0.00 0.00 -1.71 -1.37 0.00 0.00 177.40 174.32 1vou n ASN 36 N -3.03 -2.66 0.12 4.39 2.85 -1.26 -5.01 115.26 110.66 1vou n ASN 36 Ca -0.12 1.15 0.00 0.00 -0.11 0.00 0.00 54.58 55.50 1vou n ASN 36 Cb 0.62 -4.59 0.00 0.00 1.24 0.00 0.00 39.78 37.05 1vou n ASN 36 CO 0.00 0.00 0.00 -0.67 -2.11 0.00 0.00 177.26 174.48 1vou n ASP 37 N 1.15 -2.09 -4.23 1.20 2.03 -1.26 -5.06 116.55 108.30 1vou n ASP 37 Ca -0.24 0.63 -0.42 0.00 0.52 0.00 0.00 54.79 55.27 1vou n ASP 37 Cb 0.38 2.15 -0.07 0.00 -0.72 0.00 0.00 41.12 42.86 1vou n ASP 37 CO 0.00 0.00 0.00 -0.70 -1.92 0.00 0.00 177.20 174.58 1vou s GLU 38 N -2.00 2.78 0.02 -0.67 2.56 -1.26 -5.03 118.70 115.10 1vou s GLU 38 Ca 0.00 -2.00 -0.09 0.00 0.00 0.00 0.00 54.97 52.88 1vou s GLU 38 Cb 0.00 -4.05 0.00 0.00 2.00 0.00 0.00 34.13 32.08 1vou s GLU 38 CO 0.00 -1.23 0.17 -0.65 -0.56 0.00 0.00 175.26 172.99 1vou s GLN 39 N 0.96 0.59 -0.42 4.30 -0.21 -1.26 -4.96 119.66 118.66 1vou s GLN 39 Ca 0.09 -0.50 0.07 0.00 0.02 0.00 0.00 55.36 55.04 1vou s GLN 39 Cb -0.23 0.24 0.33 0.00 1.00 0.00 0.00 33.01 34.35 1vou s GLN 39 CO -0.02 -0.15 1.22 -1.71 -2.12 0.00 0.00 175.29 172.51 1vou n ASN 40 N 1.09 -2.02 -4.41 5.90 2.85 -1.26 -5.16 115.26 112.25 1vou n ASN 40 Ca -0.21 -2.98 -0.30 0.00 -0.11 0.00 0.00 54.58 50.99 1vou n ASN 40 Cb 0.57 1.49 0.23 0.00 1.24 0.00 0.00 39.78 43.31 1vou n ASN 40 CO 0.00 0.00 0.00 -2.67 -2.11 0.00 0.00 177.26 172.48 1vou n TRP 41 N -0.01 -1.27 -3.88 1.20 2.14 -1.26 -5.03 117.44 109.33 1vou n TRP 41 Ca -0.00 -0.04 -0.28 0.00 2.07 0.00 0.00 57.50 59.25 1vou n TRP 41 Cb 0.75 -1.67 -0.17 0.00 -0.81 0.00 0.00 31.31 29.42 1vou n TRP 41 CO 0.00 0.00 0.00 0.08 2.07 0.00 0.00 177.69 179.84 1vou s VAL 42 N -2.36 1.03 -0.20 -1.67 1.01 -1.26 -4.92 120.40 112.04 1vou s VAL 42 Ca 0.64 -0.54 -0.42 0.00 0.00 0.00 0.00 61.98 61.66 1vou s VAL 42 Cb -0.21 -1.20 -0.19 0.00 0.00 0.00 0.00 36.38 34.78 1vou s VAL 42 CO 0.65 0.15 1.40 0.52 0.00 0.00 0.00 175.10 177.82 1vou n VAL 43 N 4.91 0.05 -0.81 2.92 0.31 -1.26 -4.60 118.33 119.85 1vou n VAL 43 Ca -0.12 -0.01 -0.30 0.00 -0.01 0.00 0.00 64.34 63.91 1vou n VAL 43 Cb 0.48 -0.50 0.18 0.00 -0.91 0.00 0.00 33.84 33.09 1vou n VAL 43 CO 0.00 0.00 0.00 -0.69 -1.32 0.00 0.00 176.83 174.82 1vou s VAL 44 N 1.66 2.27 -0.18 2.52 1.01 0.29 -4.01 120.40 123.95 1vou s VAL 44 Ca 0.96 0.09 -0.17 0.00 0.00 0.00 0.00 61.98 62.86 1vou s VAL 44 Cb -1.26 -2.27 -0.07 0.00 0.00 0.00 0.00 36.38 32.79 1vou s VAL 44 CO 0.65 -0.12 -0.34 0.47 0.00 0.00 0.00 175.10 175.76 1vou n ASP 45 N -4.34 1.92 -1.55 3.32 9.92 -1.26 -4.61 116.55 119.95 1vou n ASP 45 Ca 0.07 0.33 -0.19 0.00 -0.53 0.00 0.00 54.79 54.47 1vou n ASP 45 Cb 0.54 -0.74 -0.08 0.00 -0.64 0.00 0.00 41.12 40.20 1vou n ASP 45 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 1vou n ALA 46 N -4.41 -0.32 -1.05 2.24 0.00 -1.26 -4.59 120.51 111.13 1vou n ALA 46 Ca -0.19 0.30 -0.17 0.00 0.00 0.00 0.00 53.44 53.39 1vou n ALA 46 Cb 0.55 -1.97 -0.14 0.00 0.00 0.00 0.00 19.45 17.89 1vou n ALA 46 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.50 177.93 1vou n SER 47 N -1.19 5.84 0.00 0.00 7.64 -1.26 -3.94 113.62 120.71 1vou n SER 47 Ca -0.20 -2.49 0.00 0.00 1.01 0.00 0.00 58.87 57.20 1vou n SER 47 Cb 0.64 -1.43 0.00 0.00 -1.01 0.00 0.00 64.21 62.41 1vou n SER 47 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1vou n GLY 48 N 2.71 0.70 3.52 0.23 0.00 -1.26 -5.07 105.19 106.02 1vou n GLY 48 Ca 0.49 -0.74 -0.39 0.00 0.00 0.00 0.00 46.02 45.38 1vou n GLY 48 CO 0.00 0.00 0.00 1.55 0.00 0.00 0.00 173.32 174.87 1vou n VAL 49 N 0.28 2.52 -4.78 1.61 3.14 -1.26 -5.03 118.33 114.82 1vou n VAL 49 Ca 0.00 -0.50 -0.33 0.00 -2.96 0.00 0.00 64.34 60.55 1vou n VAL 49 Cb 0.00 -0.84 -0.07 0.00 -1.06 0.00 0.00 33.84 31.87 1vou n VAL 49 CO 0.00 0.00 0.00 -0.81 -6.46 0.00 0.00 176.83 169.56 1vou n PRO 50 N -0.12 0.73 -3.08 1.45 -0.04 -1.26 -4.98 135.00 127.69 1vou n PRO 50 Ca 0.12 -3.82 -0.23 0.00 -0.04 0.00 0.00 63.50 59.52 1vou n PRO 50 Cb 0.45 1.05 -0.04 0.00 -0.04 0.00 0.00 33.50 34.92 1vou n PRO 50 CO 0.00 0.00 0.00 -0.11 -0.04 0.00 0.00 175.50 175.35 1vou n LEU 51 N 0.00 2.82 0.00 1.53 -0.00 -1.26 -4.65 117.00 115.45 1vou n LEU 51 Ca -0.21 -5.36 0.00 0.00 -0.00 0.00 0.00 56.01 50.43 1vou n LEU 51 Cb 0.66 -0.01 0.00 0.00 -0.00 0.00 0.00 43.42 44.07 1vou n LEU 51 CO 0.36 2.30 0.00 0.61 -0.00 0.00 0.00 177.39 180.66 1vou n GLY 52 N 0.11 0.40 2.39 -3.96 0.00 -1.26 -4.96 105.19 97.90 1vou n GLY 52 Ca 0.28 -0.03 -0.29 0.00 0.00 0.00 0.00 46.02 45.99 1vou n GLY 52 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1vou n ARG 53 N 0.00 3.31 0.00 1.61 1.74 -1.26 -4.62 116.66 117.44 1vou n ARG 53 Ca 0.00 -4.13 0.00 0.00 -0.77 0.00 0.00 57.85 52.95 1vou n ARG 53 Cb 0.00 -2.27 0.00 0.00 -1.02 0.00 0.00 32.46 29.17 1vou n ARG 53 CO 0.00 0.00 0.00 -0.11 -1.52 0.00 0.00 177.63 176.00 1vou n LEU 54 N -0.61 0.00 -0.10 0.55 -0.00 -1.26 -3.97 117.00 111.61 1vou n LEU 54 Ca 0.45 0.00 0.00 0.00 -0.00 0.00 0.00 56.01 56.46 1vou n LEU 54 Cb 0.69 -0.20 0.00 0.00 -0.00 0.00 0.00 43.42 43.91 1vou n LEU 54 CO 0.43 -0.25 0.30 0.00 -0.00 0.00 0.00 177.39 177.87 1vou n ALA 55 N -1.95 2.13 0.00 1.96 0.00 -1.26 -2.89 120.51 118.50 1vou n ALA 55 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.44 1vou n ALA 55 Cb 0.00 -1.00 0.00 0.00 0.00 0.00 0.00 19.45 18.45 1vou n ALA 55 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 177.50 179.91 1vou n THR 56 N -0.36 0.00 1.10 0.00 -1.04 -1.26 -4.54 114.28 108.18 1vou n THR 56 Ca 0.00 -0.17 0.06 0.00 -2.04 0.00 0.00 64.05 61.90 1vou n THR 56 Cb 0.03 0.78 0.18 0.00 -1.82 0.00 0.00 70.33 69.50 1vou n THR 56 CO 0.00 0.00 0.00 -0.11 -0.64 0.00 0.00 175.07 174.32 1vou n LEU 57 N -0.54 1.57 0.23 -4.42 -0.00 -1.14 -2.75 117.00 109.94 1vou n LEU 57 Ca 0.00 -0.77 0.07 0.00 -0.00 0.00 0.00 56.01 55.32 1vou n LEU 57 Cb 0.00 -0.18 0.54 0.00 -0.00 0.00 0.00 43.42 43.78 1vou n LEU 57 CO 0.00 0.38 0.87 0.40 -0.00 0.00 0.00 177.39 179.04 1vou h ILE 58 N 1.78 0.93 -0.03 1.96 1.08 -1.80 -3.39 117.51 118.03 1vou h ILE 58 Ca 0.00 -0.81 0.00 0.00 -0.39 0.00 0.00 64.86 63.66 1vou h ILE 58 Cb 0.40 1.47 0.00 0.00 -3.07 0.00 0.00 36.82 35.62 1vou h ILE 58 CO 0.00 0.21 0.00 0.00 -0.69 0.00 0.00 178.15 177.67 1vou n ALA 59 N -2.39 0.00 -2.47 1.87 0.00 -1.11 -4.35 120.51 112.06 1vou n ALA 59 Ca -0.02 0.00 -0.17 0.00 0.00 0.00 0.00 53.44 53.25 1vou n ALA 59 Cb 0.30 0.00 -0.01 0.00 0.00 0.00 0.00 19.45 19.74 1vou n ALA 59 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 1vou n SER 60 N 0.00 -5.03 0.00 0.00 2.88 -1.26 -4.26 113.62 105.95 1vou n SER 60 Ca 0.00 0.05 0.00 0.00 -1.33 0.00 0.00 58.87 57.59 1vou n SER 60 Cb 0.00 -4.21 0.00 0.00 -0.75 0.00 0.00 64.21 59.25 1vou n SER 60 CO 0.00 0.00 0.00 -1.14 -1.23 0.00 0.00 175.04 172.67 1vou n ARG 61 N -2.99 0.00 -0.15 -1.46 3.00 -1.26 -4.48 116.66 109.32 1vou n ARG 61 Ca -0.19 0.00 -0.03 0.00 -0.00 0.00 0.00 57.85 57.62 1vou n ARG 61 Cb 0.65 0.00 0.04 0.00 0.00 0.00 0.00 32.46 33.15 1vou n ARG 61 CO 0.00 0.00 0.00 0.97 0.00 0.00 0.00 177.63 178.60 1vou h ILE 62 N 0.00 0.56 -0.00 5.15 6.09 -1.76 -2.13 117.51 125.42 1vou h ILE 62 Ca 0.00 -0.01 -0.21 0.00 -1.37 0.00 0.00 64.86 63.26 1vou h ILE 62 Cb 0.00 0.52 -0.00 0.00 0.47 0.00 0.00 36.82 37.81 1vou h ILE 62 CO 0.00 0.01 -0.91 -0.09 -3.07 0.00 0.00 178.15 174.09 1vou h ARG 63 N 0.03 0.33 0.00 2.19 1.12 -1.89 -3.38 114.38 112.79 1vou h ARG 63 Ca 0.23 -0.36 0.00 0.00 -1.11 0.00 0.00 59.98 58.74 1vou h ARG 63 Cb 0.35 0.10 0.00 0.00 -0.01 0.00 0.00 29.97 30.41 1vou h ARG 63 CO -0.46 1.05 0.00 0.41 -3.11 0.00 0.00 179.97 177.86 1vou n GLY 64 N 0.90 -1.22 3.62 2.80 0.00 -0.80 -5.02 105.19 105.47 1vou n GLY 64 Ca -0.05 0.57 -0.42 0.00 0.00 0.00 0.00 46.02 46.12 1vou n GLY 64 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1vou s LYS 65 N 0.00 4.01 0.00 1.61 2.20 -1.20 -3.85 119.74 122.52 1vou s LYS 65 Ca 0.00 0.63 0.00 0.00 -0.36 0.00 0.00 55.97 56.24 1vou s LYS 65 Cb 0.00 -3.71 0.00 0.00 -1.51 0.00 0.00 37.83 32.61 1vou s LYS 65 CO 0.00 -0.63 0.00 0.72 -0.36 0.00 0.00 175.35 175.08 1vou n HIS 66 N 6.12 0.00 -2.80 4.03 8.25 -1.26 -4.55 115.22 125.00 1vou n HIS 66 Ca 0.03 0.00 -0.01 0.00 -0.26 0.00 0.00 57.72 57.48 1vou n HIS 66 Cb 0.48 0.00 0.00 0.00 1.12 0.00 0.00 29.99 31.59 1vou n HIS 66 CO 0.00 0.00 0.00 0.54 0.64 0.00 0.00 176.34 177.52 1vou n ARG 67 N 0.00 -3.02 0.16 -0.41 5.12 -1.25 -4.94 116.66 112.32 1vou n ARG 67 Ca 0.00 2.49 0.03 0.00 -1.93 0.00 0.00 57.85 58.44 1vou n ARG 67 Cb 0.00 -4.85 0.20 0.00 -1.16 0.00 0.00 32.46 26.65 1vou n ARG 67 CO 0.00 0.00 0.00 -1.00 -1.93 0.00 0.00 177.63 174.70 1vou h PRO 68 N 3.03 0.00 0.00 5.56 0.13 -1.95 -3.41 132.00 135.36 1vou h PRO 68 Ca -0.01 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.12 1vou h PRO 68 Cb 0.22 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.35 1vou h PRO 68 CO 0.10 0.49 0.00 -3.47 -0.23 0.00 0.00 178.00 174.89 1vou n ASP 69 N -3.48 0.00 -4.44 1.44 4.64 -1.26 -5.12 116.55 108.33 1vou n ASP 69 Ca 0.00 0.00 -0.51 0.00 -1.38 0.00 0.00 54.79 52.90 1vou n ASP 69 Cb 0.61 0.00 -0.07 0.00 -1.04 0.00 0.00 41.12 40.62 1vou n ASP 69 CO 0.00 0.00 0.00 0.49 -0.82 0.00 0.00 177.20 176.87 1vou n PHE 70 N 0.00 1.58 -2.86 -0.67 3.72 -1.26 -4.29 117.46 113.69 1vou n PHE 70 Ca 0.00 0.29 -0.42 0.00 -0.05 0.00 0.00 57.45 57.26 1vou n PHE 70 Cb 0.00 -2.53 -0.04 0.00 -0.94 0.00 0.00 39.48 35.97 1vou n PHE 70 CO 0.00 0.00 0.00 0.99 -0.05 0.00 0.00 176.76 177.70 1vou s THR 71 N 7.31 4.65 0.00 4.37 2.01 -1.26 -4.91 115.64 127.81 1vou s THR 71 Ca 1.10 1.15 0.00 0.00 0.31 0.00 0.00 61.69 64.24 1vou s THR 71 Cb -0.87 -4.28 0.00 0.00 0.01 0.00 0.00 72.50 67.36 1vou s THR 71 CO 0.49 -0.46 0.00 -2.65 -0.69 0.00 0.00 174.62 171.31 1vou n PRO 72 N 6.60 2.25 0.00 4.92 -0.02 -1.26 -4.54 135.00 142.95 1vou n PRO 72 Ca 0.06 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.54 1vou n PRO 72 Cb 0.48 0.00 0.00 0.00 -0.02 0.00 0.00 33.50 33.96 1vou n PRO 72 CO 0.00 0.00 0.00 -1.71 1.98 0.00 0.00 175.50 175.77 1vou n ASN 73 N 0.00 0.00 -4.32 2.55 5.15 -1.26 -4.69 115.26 112.69 1vou n ASN 73 Ca 0.00 0.00 -0.28 0.00 -0.60 0.00 0.00 54.58 53.70 1vou n ASN 73 Cb 0.00 0.00 0.27 0.00 -0.53 0.00 0.00 39.78 39.52 1vou n ASN 73 CO 0.00 0.00 0.00 0.80 1.40 0.00 0.00 177.26 179.46 1vou n MET 74 N 0.00 -2.91 -1.21 1.20 1.56 -1.26 -4.98 117.12 109.52 1vou n MET 74 Ca 0.00 -0.83 -0.30 0.00 -0.27 0.00 0.00 57.70 56.30 1vou n MET 74 Cb 0.00 -2.11 0.13 0.00 2.15 0.00 0.00 33.22 33.39 1vou n MET 74 CO 0.00 0.00 0.00 0.96 -0.73 0.00 0.00 175.97 176.20 1vou s ILE 75 N -2.35 2.76 -0.30 1.12 -0.00 -1.26 -4.98 121.20 116.19 1vou s ILE 75 Ca 0.68 0.25 -0.11 0.00 -0.00 0.00 0.00 60.65 61.47 1vou s ILE 75 Cb -0.24 -2.73 0.19 0.00 -0.00 0.00 0.00 42.46 39.67 1vou s ILE 75 CO 0.65 -0.32 1.05 -1.58 -0.00 0.00 0.00 174.94 174.73 1vou s GLN 76 N -4.93 0.15 0.00 0.37 2.00 -1.26 -5.01 119.66 110.98 1vou s GLN 76 Ca 0.63 0.09 0.00 0.00 -2.00 0.00 0.00 55.36 54.08 1vou s GLN 76 Cb -0.18 0.05 0.00 0.00 0.80 0.00 0.00 33.01 33.68 1vou s GLN 76 CO 0.57 -0.26 0.00 0.41 -0.50 0.00 0.00 175.29 175.50 1vou n GLY 77 N 4.77 5.27 3.67 2.59 0.00 -1.26 -4.61 105.19 115.62 1vou n GLY 77 Ca 0.09 -1.44 -0.05 0.00 0.00 0.00 0.00 46.02 44.62 1vou n GLY 77 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1vou s ASP 78 N 1.00 -0.23 -0.85 1.61 -0.00 -1.26 -5.00 116.67 111.94 1vou s ASP 78 Ca 0.00 -0.26 -0.26 0.00 -0.00 0.00 0.00 52.55 52.03 1vou s ASP 78 Cb 0.00 0.44 -0.12 0.00 -0.00 0.00 0.00 42.92 43.25 1vou s ASP 78 CO 0.00 -0.79 2.26 -0.36 -0.00 0.00 0.00 175.17 176.28 1vou s PHE 79 N -3.20 1.34 -1.05 4.23 0.40 -1.26 -4.84 117.98 113.60 1vou s PHE 79 Ca 0.10 1.61 -0.23 0.00 -0.60 0.00 0.00 56.93 57.81 1vou s PHE 79 Cb -0.01 -3.60 -0.05 0.00 0.51 0.00 0.00 43.02 39.87 1vou s PHE 79 CO -0.02 -1.55 1.89 0.08 0.70 0.00 0.00 175.22 176.32 1vou s VAL 80 N 13.60 3.57 -1.21 -0.44 1.01 -1.26 -4.53 120.40 131.14 1vou s VAL 80 Ca 0.85 -0.71 -0.20 0.00 0.00 0.00 0.00 61.98 61.91 1vou s VAL 80 Cb -0.10 -4.38 -0.03 0.00 0.00 0.00 0.00 36.38 31.86 1vou s VAL 80 CO 0.06 -1.11 1.88 0.52 0.00 0.00 0.00 175.10 176.45 1vou n VAL 81 N 7.68 2.74 -1.07 2.92 0.31 -1.26 -4.70 118.33 124.95 1vou n VAL 81 Ca 0.42 -2.79 -0.31 0.00 -0.01 0.00 0.00 64.34 61.65 1vou n VAL 81 Cb 0.47 -2.28 0.12 0.00 -0.91 0.00 0.00 33.84 31.24 1vou n VAL 81 CO 0.00 0.00 0.00 0.68 -1.32 0.00 0.00 176.83 176.19 1vou s VAL 82 N 7.50 2.90 0.00 2.52 -7.23 -1.26 -0.55 120.40 124.28 1vou s VAL 82 Ca 0.61 0.29 0.00 0.00 -1.81 0.00 0.00 61.98 61.07 1vou s VAL 82 Cb 0.03 -2.63 0.00 0.00 0.56 0.00 0.00 36.38 34.35 1vou s VAL 82 CO 0.10 -0.38 0.00 -0.38 -0.31 0.00 0.00 175.10 174.13 1vou n ILE 83 N -3.77 0.00 0.04 -0.62 2.08 -1.26 -4.88 119.36 110.95 1vou n ILE 83 Ca 0.10 0.00 -0.02 0.00 0.56 0.00 0.00 62.75 63.39 1vou n ILE 83 Cb 0.53 0.00 -0.01 0.00 -0.75 0.00 0.00 39.64 39.41 1vou n ILE 83 CO 0.00 0.00 0.00 -1.13 0.56 0.00 0.00 176.55 175.98 1vou h ASN 84 N 0.00 -0.10 -5.99 4.38 -0.73 -1.81 -3.07 115.58 108.26 1vou h ASN 84 Ca 0.00 0.00 -0.39 0.00 1.87 0.00 0.00 56.30 57.78 1vou h ASN 84 Cb 0.00 0.03 -0.17 0.00 0.27 0.00 0.00 38.32 38.45 1vou h ASN 84 CO 0.00 0.03 -0.58 0.00 -0.37 0.00 0.00 177.43 176.51 1vou n ALA 85 N -2.22 -1.11 0.37 1.57 0.00 -1.25 -3.96 120.51 113.91 1vou n ALA 85 Ca -0.01 -0.03 0.12 0.00 0.00 0.00 0.00 53.44 53.52 1vou n ALA 85 Cb 0.05 -2.32 0.23 0.00 0.00 0.00 0.00 19.45 17.41 1vou n ALA 85 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1vou h ALA 86 N 0.94 0.91 -0.00 0.00 0.00 -1.88 -2.37 119.26 116.85 1vou h ALA 86 Ca -0.41 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.50 1vou h ALA 86 Cb 1.27 0.00 -0.00 0.00 0.00 0.00 0.00 17.79 19.06 1vou h ALA 86 CO 0.56 0.00 0.03 0.37 0.00 0.00 0.00 179.25 180.21 1vou h GLN 87 N 0.00 0.00 -6.29 0.00 5.75 -1.89 -3.44 115.11 109.25 1vou h GLN 87 Ca 0.00 0.00 -0.60 0.00 -0.15 0.00 0.00 58.65 57.90 1vou h GLN 87 Cb 0.89 0.00 0.17 0.00 1.07 0.00 0.00 27.48 29.61 1vou h GLN 87 CO 0.00 0.00 -0.65 1.55 -2.65 0.00 0.00 178.83 177.08 1vou n VAL 88 N -3.13 1.39 -0.72 2.39 3.14 -0.89 -4.54 118.33 115.98 1vou n VAL 88 Ca -0.03 -0.50 0.00 0.00 -2.96 0.00 0.00 64.34 60.85 1vou n VAL 88 Cb 0.10 -0.41 0.00 0.00 -1.06 0.00 0.00 33.84 32.48 1vou n VAL 88 CO 0.00 0.00 0.00 0.00 -6.46 0.00 0.00 176.83 170.37 1vou n ALA 89 N -1.41 0.00 -0.81 1.55 0.00 -1.26 -5.05 120.51 113.53 1vou n ALA 89 Ca 0.11 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.55 1vou n ALA 89 Cb 0.45 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.90 1vou n ALA 89 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 1vou n LEU 90 N 0.00 0.00 0.00 0.00 4.32 -1.26 -4.87 117.00 115.19 1vou n LEU 90 Ca 0.00 0.00 -0.07 0.00 -0.02 0.00 0.00 56.01 55.92 1vou n LEU 90 Cb 0.00 0.00 0.05 0.00 -1.62 0.00 0.00 43.42 41.85 1vou n LEU 90 CO 0.00 -0.96 0.18 0.35 -1.22 0.00 0.00 177.39 175.74 1vou n THR 91 N -1.11 0.00 0.00 -5.08 -2.24 -1.26 -5.01 114.28 99.58 1vou n THR 91 Ca 0.00 -0.18 0.00 0.00 -2.27 0.00 0.00 64.05 61.60 1vou n THR 91 Cb 0.00 -1.50 0.00 0.00 -2.10 0.00 0.00 70.33 66.73 1vou n THR 91 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1vou n GLY 92 N 1.94 1.11 0.37 3.38 0.00 -1.26 -4.25 105.19 106.47 1vou n GLY 92 Ca 0.04 0.00 0.16 0.00 0.00 0.00 0.00 46.02 46.22 1vou n GLY 92 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1vou h LYS 93 N 0.00 0.00 -1.88 1.61 6.56 -2.01 0.01 116.57 120.86 1vou h LYS 93 Ca 0.00 0.00 -0.69 0.00 -1.06 0.00 0.00 60.65 58.90 1vou h LYS 93 Cb 0.00 0.00 -0.34 0.00 -0.57 0.00 0.00 32.23 31.32 1vou h LYS 93 CO 0.00 0.00 0.25 0.36 -2.06 0.00 0.00 179.45 178.00 1vou n LYS 94 N -3.16 3.35 -0.01 3.15 0.00 -1.26 -4.78 118.16 115.46 1vou n LYS 94 Ca 0.03 -4.14 -0.00 0.00 -0.00 0.00 0.00 58.31 54.20 1vou n LYS 94 Cb 0.60 -2.28 -0.00 0.00 -0.00 0.00 0.00 35.03 33.35 1vou n LYS 94 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 177.40 178.65 1vou h LEU 95 N 2.98 0.00 -5.11 -5.58 5.85 -1.16 -3.40 115.31 108.90 1vou h LEU 95 Ca 0.43 0.00 -0.35 0.00 0.84 0.00 0.00 57.88 58.79 1vou h LEU 95 Cb 0.42 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.46 1vou h LEU 95 CO 1.14 0.06 2.12 0.47 -0.34 0.00 0.00 178.44 181.88 1vou n ASP 96 N -2.39 5.09 -3.59 1.25 8.00 -1.26 -4.41 116.55 119.23 1vou n ASP 96 Ca -0.00 -2.31 -0.02 0.00 0.71 0.00 0.00 54.79 53.17 1vou n ASP 96 Cb 0.02 -1.12 -0.06 0.00 -0.02 0.00 0.00 41.12 39.94 1vou n ASP 96 CO 0.00 0.00 0.00 1.51 -0.39 0.00 0.00 177.20 178.32 1vou s ASP 97 N 2.97 -0.69 -0.02 -2.24 1.47 -1.26 -4.34 116.67 112.57 1vou s ASP 97 Ca 0.45 1.04 -0.30 0.00 1.18 0.00 0.00 52.55 54.92 1vou s ASP 97 Cb 0.14 1.49 0.10 0.00 -0.34 0.00 0.00 42.92 44.31 1vou s ASP 97 CO -0.03 -0.16 1.02 -0.54 0.68 0.00 0.00 175.17 176.15 1vou s LYS 98 N 1.85 0.73 -1.16 2.11 -0.14 -1.26 -4.95 119.74 116.93 1vou s LYS 98 Ca -0.07 -0.32 -0.21 0.00 -1.36 0.00 0.00 55.97 54.00 1vou s LYS 98 Cb -0.05 0.30 0.01 0.00 -1.68 0.00 0.00 37.83 36.41 1vou s LYS 98 CO -0.17 -0.33 1.75 0.08 -0.76 0.00 0.00 175.35 175.92 1vou s VAL 99 N -2.91 3.85 -0.10 3.17 1.01 -1.26 -4.77 120.40 119.38 1vou s VAL 99 Ca 0.09 -1.21 -0.12 0.00 0.00 0.00 0.00 61.98 60.73 1vou s VAL 99 Cb -0.00 -4.86 -0.10 0.00 0.00 0.00 0.00 36.38 31.42 1vou s VAL 99 CO -0.05 -1.61 0.37 1.88 0.00 0.00 0.00 175.10 175.69 1vou h TYR 100 N 9.08 -0.06 -0.79 5.22 0.05 -1.91 -3.50 116.97 125.07 1vou h TYR 100 Ca 0.29 -0.00 0.07 0.00 0.05 0.00 0.00 58.73 59.14 1vou h TYR 100 Cb 0.94 0.02 -0.02 0.00 1.01 0.00 0.00 36.73 38.68 1vou h TYR 100 CO 1.31 0.29 -0.09 -2.37 -1.05 0.00 0.00 178.16 176.25 1vou n THR 101 N -4.78 0.00 0.00 -2.88 5.66 -1.26 -4.98 114.28 106.05 1vou n THR 101 Ca -0.04 0.00 0.00 0.00 -3.05 0.00 0.00 64.05 60.96 1vou n THR 101 Cb 0.18 -0.09 0.00 0.00 -1.55 0.00 0.00 70.33 68.88 1vou n THR 101 CO 0.00 0.00 0.00 0.54 -3.05 0.00 0.00 175.07 172.56 1vou n ARG 102 N -1.19 0.00 -2.27 1.09 5.12 -1.26 -4.62 116.66 113.53 1vou n ARG 102 Ca 0.00 0.00 0.00 0.00 -1.93 0.00 0.00 57.85 55.92 1vou n ARG 102 Cb 0.12 -0.10 0.00 0.00 -1.16 0.00 0.00 32.46 31.31 1vou n ARG 102 CO 0.00 0.00 0.00 0.98 -1.93 0.00 0.00 177.63 176.68 1vou n TYR 103 N -0.90 -4.70 -0.55 -1.55 4.19 -1.26 -5.00 117.16 107.39 1vou n TYR 103 Ca 0.00 2.81 0.00 0.00 3.31 0.00 0.00 57.90 64.02 1vou n TYR 103 Cb 0.00 -3.66 0.00 0.00 0.49 0.00 0.00 39.34 36.17 1vou n TYR 103 CO 0.00 0.00 0.00 0.25 0.91 0.00 0.00 176.86 178.02 1vou n THR 104 N 1.90 0.00 -0.05 2.97 -2.24 -1.26 -5.03 114.28 110.58 1vou n THR 104 Ca 0.00 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.78 1vou n THR 104 Cb 0.00 0.45 0.00 0.00 -2.10 0.00 0.00 70.33 68.68 1vou n THR 104 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1vou n GLY 105 N 0.00 0.41 3.24 3.38 0.00 -1.26 -5.07 105.19 105.89 1vou n GLY 105 Ca 0.00 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.70 1vou n GLY 105 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1vou s TYR 106 N -2.13 2.61 -2.40 1.61 2.02 -1.26 -5.05 117.35 112.75 1vou s TYR 106 Ca 0.00 -1.00 0.23 0.00 -0.37 0.00 0.00 57.07 55.94 1vou s TYR 106 Cb 0.00 -1.74 0.09 0.00 -0.40 0.00 0.00 41.96 39.91 1vou s TYR 106 CO 0.00 -0.39 1.17 0.00 -1.57 0.00 0.00 175.55 174.75 1vou n GLN 107 N 3.54 1.63 0.08 -0.62 0.00 -1.26 -4.14 117.38 116.62 1vou n GLN 107 Ca -0.19 -1.34 -0.13 0.00 0.00 0.00 0.00 57.00 55.34 1vou n GLN 107 Cb 0.53 -1.47 -0.07 0.00 0.00 0.00 0.00 30.24 29.22 1vou n GLN 107 CO 0.00 0.00 0.00 0.78 0.00 0.00 0.00 177.06 177.84 1vou h GLY 108 N 4.80 -0.13 0.00 2.61 0.00 -2.03 -3.41 103.07 104.90 1vou h GLY 108 Ca 0.00 0.05 0.00 0.00 0.00 0.00 0.00 47.33 47.38 1vou h GLY 108 CO 0.00 -0.05 0.00 0.61 0.00 0.00 0.00 176.54 177.10 1vou n GLY 109 N -1.02 1.00 1.16 4.60 0.00 -1.26 -5.11 105.19 104.56 1vou n GLY 109 Ca -0.08 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 45.84 1vou n GLY 109 CO 0.00 0.00 0.00 -0.10 0.00 0.00 0.00 173.32 173.22 1vou n LEU 110 N 0.00 0.00 -2.90 0.99 7.94 -1.26 -4.62 117.00 117.15 1vou n LEU 110 Ca 0.00 -0.40 -0.09 0.00 -1.11 0.00 0.00 56.01 54.41 1vou n LEU 110 Cb 0.08 -0.32 0.04 0.00 0.53 0.00 0.00 43.42 43.74 1vou n LEU 110 CO 0.00 -1.23 0.09 1.17 -1.11 0.00 0.00 177.39 176.31 1vou n LYS 111 N -2.40 -1.66 -2.36 1.96 4.81 -1.26 -4.92 118.16 112.32 1vou n LYS 111 Ca 0.05 0.87 -0.43 0.00 -0.87 0.00 0.00 58.31 57.93 1vou n LYS 111 Cb 0.19 -5.06 -0.02 0.00 0.02 0.00 0.00 35.03 30.16 1vou n LYS 111 CO 0.00 0.00 0.00 0.99 1.17 0.00 0.00 177.40 179.56 1vou s THR 112 N -3.24 3.99 -0.71 3.15 2.01 -1.26 -4.74 115.64 114.84 1vou s THR 112 Ca 0.28 1.07 -0.02 0.00 0.31 0.00 0.00 61.69 63.33 1vou s THR 112 Cb -0.04 -4.14 0.29 0.00 0.01 0.00 0.00 72.50 68.62 1vou s THR 112 CO 0.61 -0.59 2.21 -0.62 -0.69 0.00 0.00 174.62 175.54 1vou n GLU 113 N 7.70 2.62 -1.68 4.92 -0.58 -1.26 -4.23 120.64 128.13 1vou n GLU 113 Ca 0.16 -3.13 -0.52 0.00 -0.42 0.00 0.00 57.16 53.25 1vou n GLU 113 Cb 0.47 -2.22 -0.06 0.00 -0.57 0.00 0.00 31.44 29.07 1vou n GLU 113 CO 0.00 0.00 0.00 2.41 -0.48 0.00 0.00 177.13 179.06 1vou n THR 114 N -0.21 0.35 -0.57 2.62 -1.04 -1.26 -4.90 114.28 109.27 1vou n THR 114 Ca 0.53 -0.06 -0.30 0.00 -2.04 0.00 0.00 64.05 62.17 1vou n THR 114 Cb 0.37 -1.48 0.21 0.00 -1.82 0.00 0.00 70.33 67.61 1vou n THR 114 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 1vou n ALA 115 N 5.35 -3.75 0.02 2.41 0.00 -1.26 -4.48 120.51 118.79 1vou n ALA 115 Ca 0.23 -1.31 -0.01 0.00 0.00 0.00 0.00 53.44 52.35 1vou n ALA 115 Cb 0.22 -1.66 -0.01 0.00 0.00 0.00 0.00 19.45 18.01 1vou n ALA 115 CO 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 177.50 177.41 1vou h ARG 116 N -2.41 -0.07 -2.12 0.00 9.65 -1.77 0.21 114.38 117.86 1vou h ARG 116 Ca -0.56 0.00 -0.36 0.00 -1.10 0.00 0.00 59.98 57.96 1vou h ARG 116 Cb 1.33 0.02 -0.10 0.00 -1.39 0.00 0.00 29.97 29.83 1vou h ARG 116 CO 0.41 -0.05 0.40 0.39 2.80 0.00 0.00 179.97 183.93 1vou n GLU 117 N -2.50 2.43 0.00 0.20 4.71 -1.26 -0.72 120.64 123.50 1vou n GLU 117 Ca -0.01 -1.68 0.00 0.00 -0.01 0.00 0.00 57.16 55.46 1vou n GLU 117 Cb 0.03 -2.15 0.00 0.00 -1.01 0.00 0.00 31.44 28.31 1vou n GLU 117 CO 0.00 0.00 0.00 0.00 0.09 0.00 0.00 177.13 177.22 1vou n ALA 118 N 2.03 1.20 1.54 0.62 0.00 -1.12 -4.64 120.51 120.14 1vou n ALA 118 Ca 0.49 0.00 0.14 0.00 0.00 0.00 0.00 53.44 54.07 1vou n ALA 118 Cb 0.70 0.00 0.57 0.00 0.00 0.00 0.00 19.45 20.72 1vou n ALA 118 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 177.50 177.39 1vou n LEU 119 N -1.46 1.29 -3.32 0.00 -0.00 0.72 -4.66 117.00 109.57 1vou n LEU 119 Ca 0.00 -0.42 -0.27 0.00 -0.00 0.00 0.00 56.01 55.31 1vou n LEU 119 Cb 0.00 -0.01 -0.05 0.00 -0.00 0.00 0.00 43.42 43.36 1vou n LEU 119 CO 0.00 0.22 1.62 -1.54 -0.00 0.00 0.00 177.39 177.69 1vou n SER 120 N -0.02 1.70 0.00 1.96 3.41 0.10 -2.26 113.62 118.52 1vou n SER 120 Ca 0.19 -2.36 0.00 0.00 -0.26 0.00 0.00 58.87 56.44 1vou n SER 120 Cb 0.33 -0.73 0.00 0.00 -0.26 0.00 0.00 64.21 63.54 1vou n SER 120 CO 0.00 0.00 0.00 0.29 -0.16 0.00 0.00 175.04 175.17 1vou n LYS 121 N 6.24 1.66 0.00 4.33 5.02 -1.26 -4.95 118.16 129.20 1vou n LYS 121 Ca 0.33 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.62 1vou n LYS 121 Cb 0.24 -0.14 0.00 0.00 -0.02 0.00 0.00 35.03 35.11 1vou n LYS 121 CO 0.00 0.00 0.00 0.72 -0.52 0.00 0.00 177.40 177.60 1vou n HIS 122 N 0.00 0.00 -3.68 2.13 8.25 -0.96 -5.02 115.22 115.94 1vou n HIS 122 Ca 0.00 0.00 -0.08 0.00 -0.26 0.00 0.00 57.72 57.38 1vou n HIS 122 Cb 0.00 0.00 0.00 0.00 1.12 0.00 0.00 29.99 31.11 1vou n HIS 122 CO 0.00 0.00 0.00 -2.30 0.64 0.00 0.00 176.34 174.68 1vou n PRO 123 N -1.96 -0.85 0.00 -0.41 -0.02 -1.26 -3.96 135.00 126.54 1vou n PRO 123 Ca 0.00 -0.37 0.00 0.00 -2.02 0.00 0.00 63.50 61.11 1vou n PRO 123 Cb 0.00 0.29 0.00 0.00 -0.02 0.00 0.00 33.50 33.77 1vou n PRO 123 CO 0.00 0.00 0.00 -0.85 1.98 0.00 0.00 175.50 176.63 1vou n GLU 124 N -1.57 0.00 -0.01 -0.52 0.28 -1.26 -4.86 120.64 112.71 1vou n GLU 124 Ca -0.02 0.00 0.00 0.00 -0.16 0.00 0.00 57.16 56.98 1vou n GLU 124 Cb 0.10 0.00 0.01 0.00 1.43 0.00 0.00 31.44 32.97 1vou n GLU 124 CO 0.00 0.00 0.00 -2.13 -0.16 0.00 0.00 177.13 174.84 1vou n ARG 125 N 0.00 2.61 0.00 3.44 0.63 -1.25 -4.57 116.66 117.51 1vou n ARG 125 Ca 0.00 -1.42 0.00 0.00 -0.92 0.00 0.00 57.85 55.51 1vou n ARG 125 Cb 0.00 -1.01 0.00 0.00 0.45 0.00 0.00 32.46 31.90 1vou n ARG 125 CO 0.00 0.00 0.00 1.55 -2.51 0.00 0.00 177.63 176.67 1vou n VAL 126 N -0.42 0.00 0.00 5.15 3.14 -1.26 -4.90 118.33 120.05 1vou n VAL 126 Ca 0.00 0.00 0.00 0.00 -2.96 0.00 0.00 64.34 61.38 1vou n VAL 126 Cb 0.23 0.00 0.00 0.00 -1.06 0.00 0.00 33.84 33.01 1vou n VAL 126 CO 0.00 0.00 0.00 -0.38 -6.46 0.00 0.00 176.83 169.99 1vou n ILE 127 N 0.00 0.00 -0.42 1.55 5.41 -1.26 -3.64 119.36 121.00 1vou n ILE 127 Ca 0.00 0.00 0.35 0.00 1.00 0.00 0.00 62.75 64.10 1vou n ILE 127 Cb 0.00 0.00 0.67 0.00 -0.71 0.00 0.00 39.64 39.60 1vou n ILE 127 CO 0.00 0.00 0.00 1.05 0.00 0.00 0.00 176.55 177.60 1vou h GLU 128 N 0.00 0.12 -4.93 0.38 9.09 -1.92 -2.33 114.58 114.98 1vou h GLU 128 Ca 0.00 -0.01 -0.67 0.00 0.05 0.00 0.00 59.36 58.73 1vou h GLU 128 Cb 0.00 -0.03 -0.05 0.00 -1.65 0.00 0.00 28.75 27.02 1vou h GLU 128 CO 0.00 0.08 2.56 0.72 0.05 0.00 0.00 179.01 182.42 1vou n HIS 129 N -4.40 3.89 -0.70 2.06 8.25 -1.24 -3.20 115.22 119.89 1vou n HIS 129 Ca 0.32 -2.76 0.00 0.00 -0.26 0.00 0.00 57.72 55.01 1vou n HIS 129 Cb 1.33 -2.55 0.00 0.00 1.12 0.00 0.00 29.99 29.89 1vou n HIS 129 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 1vou n ALA 130 N 7.67 0.00 -0.74 -1.41 0.00 -0.88 -4.70 120.51 120.44 1vou n ALA 130 Ca 0.50 0.00 0.07 0.00 0.00 0.00 0.00 53.44 54.01 1vou n ALA 130 Cb 0.43 0.00 0.38 0.00 0.00 0.00 0.00 19.45 20.26 1vou n ALA 130 CO 0.00 0.00 0.00 1.55 0.00 0.00 0.00 177.50 179.05 1vou n VAL 131 N 0.00 2.46 -0.67 0.00 3.14 -1.19 -4.37 118.33 117.69 1vou n VAL 131 Ca 0.00 -1.29 -0.15 0.00 -2.96 0.00 0.00 64.34 59.94 1vou n VAL 131 Cb 0.13 -0.21 0.05 0.00 -1.06 0.00 0.00 33.84 32.75 1vou n VAL 131 CO 0.00 0.00 0.00 2.22 -6.46 0.00 0.00 176.83 172.59 1vou n PHE 132 N 0.69 1.54 -0.26 1.45 -1.74 -1.26 -3.02 117.46 114.86 1vou n PHE 132 Ca 0.26 -1.75 0.00 0.00 -0.56 0.00 0.00 57.45 55.40 1vou n PHE 132 Cb 1.10 -0.86 0.00 0.00 1.52 0.00 0.00 39.48 41.24 1vou n PHE 132 CO 0.00 0.00 0.00 0.41 -0.56 0.00 0.00 176.76 176.61 1vou n GLY 133 N 0.17 0.61 2.89 4.97 0.00 -1.26 -5.01 105.19 107.56 1vou n GLY 133 Ca 0.30 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 46.02 1vou n GLY 133 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 1vou s MET 134 N 0.00 1.94 -0.24 1.61 -1.94 -1.17 -5.01 119.30 114.49 1vou s MET 134 Ca 0.00 -2.65 -0.10 0.00 -1.71 0.00 0.00 55.69 51.24 1vou s MET 134 Cb 0.00 -3.15 0.10 0.00 2.01 0.00 0.00 34.83 33.79 1vou s MET 134 CO 0.00 -1.15 0.53 -0.51 -0.01 0.00 0.00 175.02 173.88 1vou s LEU 135 N -0.39 -0.75 0.00 -0.03 1.02 -1.26 -4.87 118.68 112.39 1vou s LEU 135 Ca 0.19 1.24 0.00 0.00 0.02 0.00 0.00 54.13 55.58 1vou s LEU 135 Cb -0.21 1.81 0.00 0.00 0.02 0.00 0.00 46.19 47.81 1vou s LEU 135 CO -0.03 -0.22 0.03 -2.65 0.02 0.00 0.00 176.35 173.49 1vou n PRO 136 N 5.04 0.00 -0.70 1.29 -0.02 -1.26 -4.81 135.00 134.54 1vou n PRO 136 Ca -0.14 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.34 1vou n PRO 136 Cb 0.52 -1.06 0.00 0.00 -0.02 0.00 0.00 33.50 32.93 1vou n PRO 136 CO 0.00 0.00 0.00 1.17 1.98 0.00 0.00 175.50 178.65 1vou n LYS 137 N -0.30 -1.99 0.00 -0.52 4.81 -1.26 -4.95 118.16 113.95 1vou n LYS 137 Ca 0.00 1.45 0.00 0.00 -0.87 0.00 0.00 58.31 58.89 1vou n LYS 137 Cb 0.00 -1.61 0.00 0.00 0.02 0.00 0.00 35.03 33.44 1vou n LYS 137 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 1vou n GLY 138 N -0.43 0.95 0.00 3.14 0.00 -1.26 -4.69 105.19 102.90 1vou n GLY 138 Ca 0.00 -1.31 0.00 0.00 0.00 0.00 0.00 46.02 44.71 1vou n GLY 138 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 173.32 171.19 1vou n ARG 139 N 0.96 0.00 0.00 1.61 0.00 -1.26 -4.49 116.66 113.48 1vou n ARG 139 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 57.85 57.85 1vou n ARG 139 Cb 0.00 -0.01 0.00 0.00 0.00 0.00 0.00 32.46 32.45 1vou n ARG 139 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.63 178.67 1vou n GLN 140 N 0.00 0.00 0.23 -0.14 1.13 -1.26 0.84 117.38 118.17 1vou n GLN 140 Ca 0.00 0.00 0.16 0.00 -1.94 0.00 0.00 57.00 55.22 1vou n GLN 140 Cb 0.00 0.00 0.83 0.00 0.11 0.00 0.00 30.24 31.18 1vou n GLN 140 CO 0.00 0.00 0.00 0.78 -1.44 0.00 0.00 177.06 176.40 1vou h GLY 141 N 0.00 0.00 -3.68 1.08 0.00 -1.89 -1.29 103.07 97.29 1vou h GLY 141 Ca 0.00 0.00 -0.33 0.00 0.00 0.00 0.00 47.33 47.00 1vou h GLY 141 CO 0.00 0.00 0.35 -2.13 0.00 0.00 0.00 176.54 174.76 1vou n ARG 142 N -2.57 1.88 0.00 4.80 0.00 0.25 -2.66 116.66 118.35 1vou n ARG 142 Ca -0.02 -1.59 0.00 0.00 -0.00 0.00 0.00 57.85 56.24 1vou n ARG 142 Cb 0.05 -1.69 0.00 0.00 0.00 0.00 0.00 32.46 30.82 1vou n ARG 142 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.63 177.63 1vou n ALA 143 N 0.63 0.01 1.49 5.13 0.00 -0.50 -4.86 120.51 122.41 1vou n ALA 143 Ca 0.32 0.00 0.12 0.00 0.00 0.00 0.00 53.44 53.88 1vou n ALA 143 Cb 0.58 0.00 0.70 0.00 0.00 0.00 0.00 19.45 20.74 1vou n ALA 143 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 177.50 176.17 1vou n MET 144 N -0.31 0.75 -1.39 0.00 2.81 -1.09 -4.03 117.12 113.86 1vou n MET 144 Ca 0.00 0.00 -0.39 0.00 -1.81 0.00 0.00 57.70 55.50 1vou n MET 144 Cb 0.00 -1.50 -0.03 0.00 -0.71 0.00 0.00 33.22 30.99 1vou n MET 144 CO 0.00 0.00 0.00 -2.39 1.51 0.00 0.00 175.97 175.09 1vou n HIS 145 N -1.00 2.44 0.00 2.03 -0.00 -1.24 -2.96 115.22 114.49 1vou n HIS 145 Ca 0.18 -3.07 0.00 0.00 -0.00 0.00 0.00 57.72 54.83 1vou n HIS 145 Cb 0.08 -2.42 0.00 0.00 -0.00 0.00 0.00 29.99 27.65 1vou n HIS 145 CO 0.00 0.00 0.00 0.25 -0.00 0.00 0.00 176.34 176.59 1vou n THR 146 N 3.36 0.00 0.27 0.61 -2.24 -1.26 -4.80 114.28 110.23 1vou n THR 146 Ca 0.77 0.00 0.11 0.00 -2.27 0.00 0.00 64.05 62.66 1vou n THR 146 Cb 0.23 -0.24 0.75 0.00 -2.10 0.00 0.00 70.33 68.97 1vou n THR 146 CO 0.00 0.00 0.00 0.03 -0.57 0.00 0.00 175.07 174.53 1vou h ARG 147 N 0.00 0.00 0.00 -0.78 -0.00 -1.85 -3.26 114.38 108.49 1vou h ARG 147 Ca 0.00 0.00 0.00 0.00 -0.50 0.00 0.00 59.98 59.48 1vou h ARG 147 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 29.97 29.97 1vou h ARG 147 CO 0.00 0.03 0.00 1.28 0.00 0.00 0.00 179.97 181.28 1vou n LEU 148 N -4.16 0.00 -3.18 3.04 4.77 -1.26 -4.50 117.00 111.70 1vou n LEU 148 Ca -0.03 0.00 -0.20 0.00 -0.03 0.00 0.00 56.01 55.75 1vou n LEU 148 Cb 0.11 0.00 0.02 0.00 -2.33 0.00 0.00 43.42 41.22 1vou n LEU 148 CO 0.31 0.00 -0.07 1.17 -1.33 0.00 0.00 177.39 177.47 1vou n LYS 149 N 0.00 -2.08 0.00 3.23 3.00 -1.23 -4.79 118.16 116.29 1vou n LYS 149 Ca 0.00 1.72 0.00 0.00 -0.00 0.00 0.00 58.31 60.03 1vou n LYS 149 Cb 0.00 -4.09 0.00 0.00 0.00 0.00 0.00 35.03 30.94 1vou n LYS 149 CO 0.00 0.00 0.00 1.33 0.00 0.00 0.00 177.40 178.73 1vou n VAL 150 N -0.53 0.00 -0.87 3.15 0.24 -1.26 -5.00 118.33 114.07 1vou n VAL 150 Ca 0.00 0.00 0.00 0.00 -2.04 0.00 0.00 64.34 62.30 1vou n VAL 150 Cb 0.56 0.00 0.00 0.00 -1.47 0.00 0.00 33.84 32.93 1vou n VAL 150 CO 0.00 0.00 0.00 -1.22 -2.14 0.00 0.00 176.83 173.47 1vou n TYR 151 N 13.01 0.00 -1.92 6.34 4.01 -1.26 -4.92 117.16 132.41 1vou n TYR 151 Ca 0.00 0.00 -0.01 0.00 -0.16 0.00 0.00 57.90 57.73 1vou n TYR 151 Cb 0.00 -1.89 -0.01 0.00 -0.31 0.00 0.00 39.34 37.13 1vou n TYR 151 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 1vou n ALA 152 N 0.17 2.12 -0.20 -0.72 0.00 -1.16 -4.41 120.51 116.31 1vou n ALA 152 Ca 0.00 -0.12 0.09 0.00 0.00 0.00 0.00 53.44 53.40 1vou n ALA 152 Cb 0.00 -0.06 0.23 0.00 0.00 0.00 0.00 19.45 19.62 1vou n ALA 152 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1vou n GLY 153 N 0.00 2.46 2.56 0.00 0.00 -1.26 -4.70 105.19 104.25 1vou n GLY 153 Ca -0.05 -0.59 -0.01 0.00 0.00 0.00 0.00 46.02 45.37 1vou n GLY 153 CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11 1vou n GLU 154 N 1.10 -1.09 -2.41 1.61 2.13 -1.26 -4.67 120.64 116.06 1vou n GLU 154 Ca 0.18 1.30 0.00 0.00 0.66 0.00 0.00 57.16 59.29 1vou n GLU 154 Cb 0.52 -4.47 0.00 0.00 0.27 0.00 0.00 31.44 27.76 1vou n GLU 154 CO 0.00 0.00 0.00 2.41 -0.41 0.00 0.00 177.13 179.13 1vou n THR 155 N -1.27 -0.82 -3.57 6.31 -1.04 -1.26 -5.03 114.28 107.60 1vou n THR 155 Ca 0.02 0.02 0.04 0.00 -2.04 0.00 0.00 64.05 62.09 1vou n THR 155 Cb 0.46 -1.97 -0.00 0.00 -1.82 0.00 0.00 70.33 67.00 1vou n THR 155 CO 0.00 0.00 0.00 -2.28 -0.64 0.00 0.00 175.07 172.15 1vou s HIS 156 N -0.05 -0.01 -0.91 -1.42 2.46 -1.26 -4.99 115.29 109.11 1vou s HIS 156 Ca 0.00 -0.01 -0.12 0.00 0.47 0.00 0.00 55.06 55.40 1vou s HIS 156 Cb 0.00 0.51 0.02 0.00 -0.13 0.00 0.00 32.58 32.98 1vou s HIS 156 CO 0.00 -0.05 0.59 -2.30 -2.47 0.00 0.00 174.74 170.51 1vou n PRO 157 N -0.50 -1.01 -0.44 2.88 -0.02 -1.26 -4.73 135.00 129.91 1vou n PRO 157 Ca -0.10 0.45 0.08 0.00 -2.02 0.00 0.00 63.50 61.91 1vou n PRO 157 Cb 0.64 -2.11 0.26 0.00 -0.02 0.00 0.00 33.50 32.27 1vou n PRO 157 CO 0.00 0.00 0.00 1.58 1.98 0.00 0.00 175.50 179.06 1vou n HIS 158 N -3.35 1.00 0.87 6.00 -0.00 -1.26 -4.16 115.22 114.32 1vou n HIS 158 Ca -0.23 -0.74 0.14 0.00 0.46 0.00 0.00 57.72 57.34 1vou n HIS 158 Cb 0.61 -0.26 0.53 0.00 -0.12 0.00 0.00 29.99 30.75 1vou n HIS 158 CO 0.00 0.00 0.00 0.45 0.46 0.00 0.00 176.34 177.25 1vou n SER 159 N 0.04 0.30 -0.29 0.26 2.88 -1.26 -2.65 113.62 112.89 1vou n SER 159 Ca 0.20 0.49 -0.06 0.00 -1.33 0.00 0.00 58.87 58.17 1vou n SER 159 Cb 0.81 -0.55 0.07 0.00 -0.75 0.00 0.00 64.21 63.79 1vou n SER 159 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 1vou h ALA 160 N 2.84 1.05 -1.69 -1.46 0.00 -1.94 -3.42 119.26 114.64 1vou h ALA 160 Ca 0.00 -0.20 0.10 0.00 0.00 0.00 0.00 54.91 54.81 1vou h ALA 160 Cb 0.58 -0.31 -0.22 0.00 0.00 0.00 0.00 17.79 17.84 1vou h ALA 160 CO 0.00 0.67 0.03 -1.14 0.00 0.00 0.00 179.25 178.81 1vou s GLN 161 N -5.55 0.50 -0.20 0.00 2.00 -1.09 -5.10 119.66 110.23 1vou s GLN 161 Ca -0.12 1.16 -0.22 0.00 -2.00 0.00 0.00 55.36 54.18 1vou s GLN 161 Cb 0.16 0.59 -0.20 0.00 0.80 0.00 0.00 33.01 34.36 1vou s GLN 161 CO 0.84 -0.16 0.27 0.87 -0.50 0.00 0.00 175.29 176.62 1vou h LYS 162 N 7.56 0.01 0.00 1.67 6.56 -1.79 -3.45 116.57 127.13 1vou h LYS 162 Ca -0.20 -0.02 0.00 0.00 -1.06 0.00 0.00 60.65 59.38 1vou h LYS 162 Cb 1.13 0.01 0.00 0.00 -0.57 0.00 0.00 32.23 32.80 1vou h LYS 162 CO 0.11 1.01 0.00 -2.30 -2.06 0.00 0.00 179.45 176.21 1vou n PRO 163 N -4.42 0.00 -1.50 3.15 -0.02 -1.26 -4.72 135.00 126.23 1vou n PRO 163 Ca -0.30 0.00 -0.34 0.00 -2.02 0.00 0.00 63.50 60.84 1vou n PRO 163 Cb 0.68 0.00 0.08 0.00 -0.02 0.00 0.00 33.50 34.24 1vou n PRO 163 CO 0.00 0.00 0.00 -1.14 1.98 0.00 0.00 175.50 176.34 1vou s GLN 164 N 0.00 2.30 -0.39 -0.52 2.00 -1.26 -4.98 119.66 116.81 1vou s GLN 164 Ca 0.00 1.61 0.05 0.00 -2.00 0.00 0.00 55.36 55.03 1vou s GLN 164 Cb 0.00 -1.87 0.30 0.00 0.80 0.00 0.00 33.01 32.25 1vou s GLN 164 CO 0.00 -1.68 1.24 1.33 -0.50 0.00 0.00 175.29 175.68 1vou n VAL 165 N -2.71 0.00 0.47 1.34 0.24 -1.26 -4.99 118.33 111.42 1vou n VAL 165 Ca 0.12 -1.14 0.12 0.00 -2.04 0.00 0.00 64.34 61.40 1vou n VAL 165 Cb 0.51 1.19 0.08 0.00 -1.47 0.00 0.00 33.84 34.14 1vou n VAL 165 CO 0.00 0.00 0.00 -0.11 -2.14 0.00 0.00 176.83 174.58 1vou n LEU 166 N 0.15 0.68 0.00 1.34 7.94 -1.26 -4.99 117.00 120.85 1vou n LEU 166 Ca -0.03 0.15 0.00 0.00 -1.11 0.00 0.00 56.01 55.02 1vou n LEU 166 Cb 0.74 -0.12 0.00 0.00 0.53 0.00 0.00 43.42 44.56 1vou n LEU 166 CO -0.04 -0.04 0.00 0.29 -1.11 0.00 0.00 177.39 176.49 1vou n LYS 167 N -2.16 0.00 -2.13 1.96 4.01 -1.26 -4.78 118.16 113.81 1vou n LYS 167 Ca 0.02 0.00 -0.03 0.00 -0.51 0.00 0.00 58.31 57.79 1vou n LYS 167 Cb 0.46 0.00 -0.02 0.00 -0.51 0.00 0.00 35.03 34.96 1vou n LYS 167 CO 0.00 0.00 0.00 2.41 -1.11 0.00 0.00 177.40 178.70 1vou n THR 168 N 0.00 -8.58 -1.39 -0.18 -1.04 -1.26 -4.22 114.28 97.61 1vou n THR 168 Ca 0.00 1.54 -0.37 0.00 -2.04 0.00 0.00 64.05 63.17 1vou n THR 168 Cb 0.00 -5.31 0.05 0.00 -1.82 0.00 0.00 70.33 63.25 1vou n THR 168 CO 0.00 0.00 0.00 1.67 -0.64 0.00 0.00 175.07 176.10 1vou n GLN 169 N 0.90 0.43 -3.51 -2.82 -0.06 -1.26 -4.86 117.38 106.21 1vou n GLN 169 Ca -0.22 0.18 -0.37 0.00 -2.00 0.00 0.00 57.00 54.59 1vou n GLN 169 Cb 0.33 -1.74 -0.06 0.00 -4.06 0.00 0.00 30.24 24.71 1vou n GLN 169 CO 0.00 0.00 0.00 -1.25 -0.20 0.00 0.00 177.06 175.61 1vou s PRO 170 N -2.32 4.11 0.00 3.69 0.04 -1.26 -5.11 135.00 134.15 1vou s PRO 170 Ca 0.67 0.24 0.31 0.00 0.04 0.00 0.00 61.00 62.26 1vou s PRO 170 Cb -0.41 -3.35 1.77 0.00 0.04 0.00 0.00 34.50 32.55 1vou s PRO 170 CO 0.56 0.39 2.15 1.28 0.04 0.00 0.00 177.00 181.42