#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2ptl n ASN 2 N 0.00 6.54 0.00 1.62 4.13 -1.26 -4.85 115.26 121.45 2ptl n ASN 2 Ca 0.00 -3.77 0.00 0.00 1.68 0.00 0.00 54.58 52.49 2ptl n ASN 2 Cb 0.00 -0.73 0.00 0.00 -1.54 0.00 0.00 39.78 37.51 2ptl n ASN 2 CO 0.00 0.00 0.00 0.29 0.28 0.00 0.00 177.26 177.83 2ptl n LYS 3 N -0.84 0.00 -3.48 3.52 5.02 -1.26 -4.76 118.16 116.35 2ptl n LYS 3 Ca 0.55 0.00 -0.23 0.00 -2.02 0.00 0.00 58.31 56.62 2ptl n LYS 3 Cb 0.79 -0.20 -0.03 0.00 -0.02 0.00 0.00 35.03 35.58 2ptl n LYS 3 CO 0.00 0.00 0.00 -1.91 -0.52 0.00 0.00 177.40 174.97 2ptl n GLU 4 N 0.00 -2.33 0.00 1.97 2.13 -1.26 -4.45 120.64 116.70 2ptl n GLU 4 Ca 0.00 0.21 0.00 0.00 0.66 0.00 0.00 57.16 58.03 2ptl n GLU 4 Cb 0.00 -4.81 0.00 0.00 0.27 0.00 0.00 31.44 26.90 2ptl n GLU 4 CO 0.00 0.00 0.00 0.39 -0.41 0.00 0.00 177.13 177.11 2ptl n GLU 5 N -3.44 0.00 -0.08 5.31 1.02 -1.26 -5.01 120.64 117.18 2ptl n GLU 5 Ca 0.03 0.00 0.00 0.00 -0.02 0.00 0.00 57.16 57.17 2ptl n GLU 5 Cb 0.50 0.00 0.00 0.00 -0.02 0.00 0.00 31.44 31.92 2ptl n GLU 5 CO 0.00 0.00 0.00 -2.37 1.18 0.00 0.00 177.13 175.94 2ptl n THR 6 N 0.00 -1.20 -1.85 2.62 5.66 -1.26 -4.86 114.28 113.39 2ptl n THR 6 Ca 0.00 0.11 -0.42 0.00 -3.05 0.00 0.00 64.05 60.69 2ptl n THR 6 Cb 0.00 -0.93 -0.03 0.00 -1.55 0.00 0.00 70.33 67.82 2ptl n THR 6 CO 0.00 0.00 0.00 -2.16 -3.05 0.00 0.00 175.07 169.86 2ptl s PRO 7 N -4.29 4.17 0.00 1.09 0.04 -1.26 -4.81 135.00 129.94 2ptl s PRO 7 Ca 0.00 2.41 0.00 0.00 0.04 0.00 0.00 61.00 63.45 2ptl s PRO 7 Cb 0.00 -3.86 0.00 0.00 0.04 0.00 0.00 34.50 30.68 2ptl s PRO 7 CO 0.00 -0.84 0.00 0.39 0.04 0.00 0.00 177.00 176.59 2ptl n GLU 8 N 6.55 0.00 -1.77 4.56 -0.58 -1.26 -5.02 120.64 123.12 2ptl n GLU 8 Ca 0.18 0.00 -0.42 0.00 -0.42 0.00 0.00 57.16 56.49 2ptl n GLU 8 Cb 0.41 -0.23 -0.03 0.00 -0.57 0.00 0.00 31.44 31.02 2ptl n GLU 8 CO 0.00 0.00 0.00 0.95 -0.48 0.00 0.00 177.13 177.60 2ptl s THR 9 N -1.93 3.19 -0.26 2.62 -4.23 -1.26 -4.86 115.64 108.91 2ptl s THR 9 Ca 0.00 0.22 -0.29 0.00 -1.18 0.00 0.00 61.69 60.45 2ptl s THR 9 Cb 0.00 -3.17 -0.06 0.00 1.34 0.00 0.00 72.50 70.61 2ptl s THR 9 CO 0.00 -0.05 2.24 -2.65 -0.54 0.00 0.00 174.62 173.62 2ptl n PRO 10 N 7.78 1.80 -0.00 3.99 -0.01 -1.26 -4.75 135.00 142.55 2ptl n PRO 10 Ca 0.22 0.46 0.00 0.00 -0.01 0.00 0.00 63.50 64.18 2ptl n PRO 10 Cb 0.43 -3.19 -0.01 0.00 -0.01 0.00 0.00 33.50 30.72 2ptl n PRO 10 CO 0.00 0.00 0.00 -1.91 -0.01 0.00 0.00 175.50 173.58 2ptl n GLU 11 N 8.75 3.82 0.14 -0.52 2.13 -1.26 -4.59 120.64 129.10 2ptl n GLU 11 Ca 0.32 -0.00 0.06 0.00 0.66 0.00 0.00 57.16 58.19 2ptl n GLU 11 Cb 0.44 -0.75 0.04 0.00 0.27 0.00 0.00 31.44 31.44 2ptl n GLU 11 CO 0.00 0.00 0.00 1.15 -0.41 0.00 0.00 177.13 177.87 2ptl h THR 12 N 0.00 0.42 0.00 6.31 2.02 -2.01 -3.47 112.91 116.18 2ptl h THR 12 Ca 0.00 -1.65 0.00 0.00 0.77 0.00 0.00 66.41 65.53 2ptl h THR 12 Cb 0.03 2.09 0.00 0.00 -1.74 0.00 0.00 68.15 68.53 2ptl h THR 12 CO 0.00 0.24 0.00 -0.67 0.37 0.00 0.00 175.52 175.46 2ptl n ASP 13 N -3.04 0.00 -3.27 4.18 2.03 -1.26 -5.14 116.55 110.05 2ptl n ASP 13 Ca 0.00 0.00 -0.06 0.00 0.52 0.00 0.00 54.79 55.25 2ptl n ASP 13 Cb 0.67 0.00 -0.05 0.00 -0.72 0.00 0.00 41.12 41.02 2ptl n ASP 13 CO 0.00 0.00 0.00 -0.55 -1.92 0.00 0.00 177.20 174.73 2ptl s SER 14 N 0.00 -0.08 0.20 1.67 0.15 -1.26 -4.89 113.70 109.49 2ptl s SER 14 Ca 0.00 -0.21 0.00 0.00 0.70 0.00 0.00 55.95 56.44 2ptl s SER 14 Cb 0.00 1.32 0.00 0.00 -1.71 0.00 0.00 66.02 65.63 2ptl s SER 14 CO 0.00 -0.34 0.00 -1.84 1.20 0.00 0.00 173.24 172.26 2ptl n GLU 15 N 5.37 -0.10 -1.20 5.44 0.28 -1.26 -4.65 120.64 124.52 2ptl n GLU 15 Ca 0.01 0.07 -0.30 0.00 -0.16 0.00 0.00 57.16 56.79 2ptl n GLU 15 Cb 0.50 -0.13 0.14 0.00 1.43 0.00 0.00 31.44 33.39 2ptl n GLU 15 CO 0.00 0.00 0.00 -1.83 -0.16 0.00 0.00 177.13 175.14 2ptl s GLU 16 N -0.20 1.11 0.00 3.44 -1.05 -1.26 -4.98 118.70 115.76 2ptl s GLU 16 Ca 0.00 0.77 0.00 0.00 -0.15 0.00 0.00 54.97 55.59 2ptl s GLU 16 Cb 0.00 -1.80 0.00 0.00 -0.44 0.00 0.00 34.13 31.89 2ptl s GLU 16 CO 0.00 -2.33 0.00 -1.91 0.95 0.00 0.00 175.26 171.97 2ptl n GLU 17 N -3.94 0.00 -2.71 -4.83 2.13 -1.26 -5.01 120.64 105.02 2ptl n GLU 17 Ca 0.07 0.00 -0.23 0.00 0.66 0.00 0.00 57.16 57.66 2ptl n GLU 17 Cb 0.56 0.00 -0.01 0.00 0.27 0.00 0.00 31.44 32.26 2ptl n GLU 17 CO 0.00 0.00 0.00 1.55 -0.41 0.00 0.00 177.13 178.27 2ptl n VAL 18 N 0.00 2.09 -3.11 6.31 3.14 -1.26 -5.01 118.33 120.49 2ptl n VAL 18 Ca 0.00 -4.78 -0.45 0.00 -2.96 0.00 0.00 64.34 56.15 2ptl n VAL 18 Cb 0.00 -0.89 -0.05 0.00 -1.06 0.00 0.00 33.84 31.85 2ptl n VAL 18 CO 0.00 0.00 0.00 -0.89 -6.46 0.00 0.00 176.83 169.48 2ptl s THR 19 N -4.52 4.82 -0.09 1.55 2.01 -1.26 -1.79 115.64 116.36 2ptl s THR 19 Ca 0.44 -0.97 -0.30 0.00 0.31 0.00 0.00 61.69 61.18 2ptl s THR 19 Cb 0.37 -4.48 -0.03 0.00 0.01 0.00 0.00 72.50 68.37 2ptl s THR 19 CO -0.13 -1.11 1.26 -0.51 -0.69 0.00 0.00 174.62 173.44 2ptl s ILE 20 N 2.68 4.19 -0.44 1.82 2.07 0.00 -4.90 121.20 126.62 2ptl s ILE 20 Ca 0.12 1.49 -0.10 0.00 -1.41 0.00 0.00 60.65 60.74 2ptl s ILE 20 Cb -0.24 -3.96 0.09 0.00 0.13 0.00 0.00 42.46 38.48 2ptl s ILE 20 CO 0.07 -0.05 0.31 -0.75 -1.91 0.00 0.00 174.94 172.60 2ptl s LYS 21 N 2.76 2.66 0.53 3.50 2.20 -1.25 -1.91 119.74 128.24 2ptl s LYS 21 Ca 0.57 -1.50 -0.04 0.00 -0.36 0.00 0.00 55.97 54.63 2ptl s LYS 21 Cb -0.25 -3.88 0.11 0.00 -1.51 0.00 0.00 37.83 32.30 2ptl s LYS 21 CO 0.20 -1.02 0.73 0.00 -0.36 0.00 0.00 175.35 174.89 2ptl n ALA 22 N 4.98 -0.33 -3.36 3.13 0.00 -0.74 -3.32 120.51 120.87 2ptl n ALA 22 Ca -0.10 -1.19 -0.09 0.00 0.00 0.00 0.00 53.44 52.06 2ptl n ALA 22 Cb 0.43 0.10 -0.04 0.00 0.00 0.00 0.00 19.45 19.93 2ptl n ALA 22 CO 0.00 0.00 0.00 -0.80 0.00 0.00 0.00 177.50 176.70 2ptl s ASN 23 N -3.81 -0.18 -0.39 0.00 0.01 -1.21 -1.94 114.94 107.42 2ptl s ASN 23 Ca 0.45 -0.70 0.10 0.00 -0.71 0.00 0.00 52.86 52.00 2ptl s ASN 23 Cb -0.02 0.61 0.30 0.00 0.41 0.00 0.00 41.25 42.55 2ptl s ASN 23 CO 0.30 -1.15 0.64 0.18 -1.51 0.00 0.00 177.10 175.57 2ptl n LEU 24 N -0.38 0.33 -4.62 0.60 4.32 -1.09 -3.77 117.00 112.39 2ptl n LEU 24 Ca -0.05 -4.78 -0.43 0.00 -0.02 0.00 0.00 56.01 50.73 2ptl n LEU 24 Cb 0.61 0.69 -0.03 0.00 -1.62 0.00 0.00 43.42 43.07 2ptl n LEU 24 CO 0.19 2.17 0.84 -0.63 -1.22 0.00 0.00 177.39 178.74 2ptl s ILE 25 N -1.67 4.57 0.34 -0.08 1.01 -0.94 -1.43 121.20 123.00 2ptl s ILE 25 Ca 0.37 1.47 0.07 0.00 0.00 0.00 0.00 60.65 62.56 2ptl s ILE 25 Cb 0.26 -4.35 -0.02 0.00 0.01 0.00 0.00 42.46 38.36 2ptl s ILE 25 CO -0.10 -0.47 0.39 -0.36 0.00 0.00 0.00 174.94 174.40 2ptl s PHE 26 N 3.50 3.02 -0.51 3.97 0.08 -1.22 -0.48 117.98 126.35 2ptl s PHE 26 Ca 0.41 -0.26 0.24 0.00 0.12 0.00 0.00 56.93 57.44 2ptl s PHE 26 Cb -0.12 -1.91 0.41 0.00 -0.57 0.00 0.00 43.02 40.82 2ptl s PHE 26 CO 0.16 0.07 1.52 0.00 -0.10 0.00 0.00 175.22 176.87 2ptl h ALA 27 N 1.05 0.86 -0.20 5.36 0.00 -1.77 -3.35 119.26 121.21 2ptl h ALA 27 Ca -0.45 0.00 -0.24 0.00 0.00 0.00 0.00 54.91 54.21 2ptl h ALA 27 Cb 1.26 0.00 -0.09 0.00 0.00 0.00 0.00 17.79 18.95 2ptl h ALA 27 CO 0.55 0.00 -0.00 0.27 0.00 0.00 0.00 179.25 180.07 2ptl n ASN 28 N -2.66 5.74 -2.53 0.00 6.94 -1.26 -4.72 115.26 116.77 2ptl n ASN 28 Ca 0.04 -2.73 -0.08 0.00 -0.02 0.00 0.00 54.58 51.79 2ptl n ASN 28 Cb 0.49 -1.26 -0.00 0.00 -2.36 0.00 0.00 39.78 36.65 2ptl n ASN 28 CO 0.00 0.00 0.00 0.61 -1.03 0.00 0.00 177.26 176.84 2ptl n GLY 29 N 1.59 -0.50 2.66 4.83 0.00 -1.26 -4.80 105.19 107.71 2ptl n GLY 29 Ca 0.34 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 46.11 2ptl n GLY 29 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 2ptl n SER 30 N -1.72 4.28 -4.74 1.61 2.88 -1.26 -5.04 113.62 109.63 2ptl n SER 30 Ca -0.08 -3.62 -0.40 0.00 -1.33 0.00 0.00 58.87 53.43 2ptl n SER 30 Cb 0.56 -0.51 -0.05 0.00 -0.75 0.00 0.00 64.21 63.46 2ptl n SER 30 CO 0.00 0.00 0.00 0.42 -1.23 0.00 0.00 175.04 174.23 2ptl s THR 31 N -4.85 4.10 0.00 2.46 -4.23 -1.26 -3.39 115.64 108.47 2ptl s THR 31 Ca 0.47 1.99 0.00 0.00 -1.18 0.00 0.00 61.69 62.96 2ptl s THR 31 Cb 0.35 -4.26 0.00 0.00 1.34 0.00 0.00 72.50 69.93 2ptl s THR 31 CO -0.15 0.42 0.00 1.67 -0.54 0.00 0.00 174.62 176.02 2ptl n GLN 32 N 1.86 0.00 -3.84 3.99 7.27 -0.52 -4.89 117.38 121.26 2ptl n GLN 32 Ca -0.00 0.00 -0.08 0.00 0.07 0.00 0.00 57.00 56.99 2ptl n GLN 32 Cb 0.47 0.00 -0.00 0.00 2.41 0.00 0.00 30.24 33.12 2ptl n GLN 32 CO 0.00 0.00 0.00 -0.08 0.07 0.00 0.00 177.06 177.05 2ptl s THR 33 N -0.33 0.00 0.20 1.69 -1.32 -1.26 -2.68 115.64 111.94 2ptl s THR 33 Ca 0.00 -0.98 -0.11 0.00 -1.21 0.00 0.00 61.69 59.38 2ptl s THR 33 Cb 0.00 -2.36 -0.00 0.00 -1.51 0.00 0.00 72.50 68.63 2ptl s THR 33 CO 0.00 0.00 0.38 0.00 -2.21 0.00 0.00 174.62 172.79 2ptl s ALA 34 N -3.25 -0.16 -0.11 11.08 0.00 -0.82 -4.68 121.76 123.82 2ptl s ALA 34 Ca 0.13 -0.83 -0.29 0.00 0.00 0.00 0.00 51.96 50.97 2ptl s ALA 34 Cb -0.05 0.97 0.07 0.00 0.00 0.00 0.00 23.12 24.11 2ptl s ALA 34 CO 0.09 -0.74 0.70 -2.00 0.00 0.00 0.00 175.76 173.81 2ptl s GLU 35 N -3.98 0.98 -0.18 0.00 2.12 -1.26 -1.79 118.70 114.59 2ptl s GLU 35 Ca 0.19 0.45 -0.08 0.00 0.36 0.00 0.00 54.97 55.89 2ptl s GLU 35 Cb 0.01 0.47 0.07 0.00 0.26 0.00 0.00 34.13 34.94 2ptl s GLU 35 CO 0.04 -0.26 0.40 -0.06 -0.54 0.00 0.00 175.26 174.84 2ptl s PHE 36 N -0.76 -0.66 0.54 5.30 0.40 -0.80 -4.96 117.98 117.04 2ptl s PHE 36 Ca -0.08 1.35 0.02 0.00 -0.60 0.00 0.00 56.93 57.62 2ptl s PHE 36 Cb -0.01 0.26 0.02 0.00 0.51 0.00 0.00 43.02 43.79 2ptl s PHE 36 CO 0.07 -0.39 0.17 0.15 0.70 0.00 0.00 175.22 175.92 2ptl s LYS 37 N 1.90 2.24 0.00 0.44 1.02 -1.26 -0.82 119.74 123.26 2ptl s LYS 37 Ca -0.06 -2.30 0.00 0.00 0.02 0.00 0.00 55.97 53.63 2ptl s LYS 37 Cb -0.10 -1.74 0.00 0.00 -0.52 0.00 0.00 37.83 35.47 2ptl s LYS 37 CO -0.12 -0.53 0.00 0.41 -0.92 0.00 0.00 175.35 174.19 2ptl n GLY 38 N -1.52 2.33 3.88 -3.33 0.00 -0.74 -4.92 105.19 100.88 2ptl n GLY 38 Ca -0.14 -0.47 -0.30 0.00 0.00 0.00 0.00 46.02 45.11 2ptl n GLY 38 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2ptl s THR 39 N 0.00 4.83 0.00 2.61 -4.23 -1.26 -4.82 115.64 112.78 2ptl s THR 39 Ca 0.00 0.53 0.00 0.00 -1.18 0.00 0.00 61.69 61.04 2ptl s THR 39 Cb 0.00 -3.71 0.00 0.00 1.34 0.00 0.00 72.50 70.13 2ptl s THR 39 CO 0.00 -0.40 0.00 0.33 -0.54 0.00 0.00 174.62 174.01 2ptl n PHE 40 N -1.02 0.00 0.38 3.99 -0.00 -1.26 -4.39 117.46 115.15 2ptl n PHE 40 Ca 0.02 0.00 0.02 0.00 -0.00 0.00 0.00 57.45 57.48 2ptl n PHE 40 Cb 0.54 0.00 0.13 0.00 -0.00 0.00 0.00 39.48 40.15 2ptl n PHE 40 CO 0.00 0.00 0.00 -1.91 -0.00 0.00 0.00 176.76 174.85 2ptl n GLU 41 N -0.09 2.24 -0.08 -4.13 2.13 -1.26 -2.98 120.64 116.48 2ptl n GLU 41 Ca 0.00 -1.03 -0.05 0.00 0.66 0.00 0.00 57.16 56.74 2ptl n GLU 41 Cb 0.00 -1.74 -0.16 0.00 0.27 0.00 0.00 31.44 29.81 2ptl n GLU 41 CO 0.00 0.00 0.00 1.63 -0.41 0.00 0.00 177.13 178.35 2ptl n LYS 42 N 0.19 0.68 0.07 5.31 4.76 -1.26 -4.00 118.16 123.92 2ptl n LYS 42 Ca 0.10 -0.05 0.13 0.00 -2.87 0.00 0.00 58.31 55.61 2ptl n LYS 42 Cb 0.58 -1.52 0.41 0.00 -1.84 0.00 0.00 35.03 32.65 2ptl n LYS 42 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 2ptl n ALA 43 N -2.63 2.44 0.21 7.82 0.00 -1.16 -3.16 120.51 124.04 2ptl n ALA 43 Ca -0.26 -0.09 -0.08 0.00 0.00 0.00 0.00 53.44 53.01 2ptl n ALA 43 Cb 1.01 -1.41 -0.04 0.00 0.00 0.00 0.00 19.45 19.01 2ptl n ALA 43 CO 0.00 0.00 0.00 1.15 0.00 0.00 0.00 177.50 178.65 2ptl h THR 44 N 0.00 0.00 -0.61 0.00 2.02 -1.69 0.57 112.91 113.20 2ptl h THR 44 Ca 0.00 -0.04 -0.00 0.00 0.77 0.00 0.00 66.41 67.14 2ptl h THR 44 Cb 0.68 0.00 -0.03 0.00 -1.74 0.00 0.00 68.15 67.06 2ptl h THR 44 CO 0.00 0.00 0.37 0.77 0.37 0.00 0.00 175.52 177.03 2ptl h SER 45 N -0.58 0.72 -0.15 4.18 4.64 -1.78 0.14 113.55 120.72 2ptl h SER 45 Ca -0.06 -0.05 0.04 0.00 -0.47 0.00 0.00 61.79 61.26 2ptl h SER 45 Cb 0.42 -0.18 -0.01 0.00 -0.31 0.00 0.00 62.40 62.32 2ptl h SER 45 CO 0.09 0.56 0.17 -0.08 -0.87 0.00 0.00 176.83 176.70 2ptl h GLU 46 N 0.82 0.00 0.09 4.77 4.22 -1.50 0.44 114.58 123.42 2ptl h GLU 46 Ca 0.22 0.00 -0.25 0.00 0.08 0.00 0.00 59.36 59.40 2ptl h GLU 46 Cb -0.04 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.21 2ptl h GLU 46 CO -0.04 0.00 -1.16 0.00 -2.18 0.00 0.00 179.01 175.63 2ptl h ALA 47 N 1.81 0.18 0.00 2.92 0.00 0.27 -2.00 119.26 122.44 2ptl h ALA 47 Ca 0.07 -0.89 -0.06 0.00 0.00 0.00 0.00 54.91 54.04 2ptl h ALA 47 Cb 0.40 -0.04 -0.01 0.00 0.00 0.00 0.00 17.79 18.14 2ptl h ALA 47 CO -0.00 1.04 -0.29 -0.92 0.00 0.00 0.00 179.25 179.09 2ptl h TYR 48 N 0.06 0.00 0.00 0.00 3.20 0.15 -0.76 116.97 119.61 2ptl h TYR 48 Ca -0.10 0.00 -0.19 0.00 3.14 0.00 0.00 58.73 61.58 2ptl h TYR 48 Cb 1.90 0.00 -0.03 0.00 1.54 0.00 0.00 36.73 40.14 2ptl h TYR 48 CO 0.05 0.29 -0.94 0.00 -1.64 0.00 0.00 178.16 175.91 2ptl h ALA 49 N 1.71 0.42 -0.32 1.82 0.00 -1.06 -3.04 119.26 118.80 2ptl h ALA 49 Ca -0.00 -0.85 -0.01 0.00 0.00 0.00 0.00 54.91 54.04 2ptl h ALA 49 Cb 0.56 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 18.21 2ptl h ALA 49 CO 0.04 1.16 0.14 -0.92 0.00 0.00 0.00 179.25 179.67 2ptl h TYR 50 N 0.00 0.47 -0.08 0.00 3.20 -0.40 -1.10 116.97 119.05 2ptl h TYR 50 Ca -0.02 -0.03 0.00 0.00 3.14 0.00 0.00 58.73 61.82 2ptl h TYR 50 Cb 1.71 -0.14 0.00 0.00 1.54 0.00 0.00 36.73 39.84 2ptl h TYR 50 CO 0.00 0.42 0.00 0.00 -1.64 0.00 0.00 178.16 176.94 2ptl n ALA 51 N -2.26 2.59 -0.02 1.82 0.00 -0.59 -3.40 120.51 118.66 2ptl n ALA 51 Ca -0.02 -0.21 -0.01 0.00 0.00 0.00 0.00 53.44 53.21 2ptl n ALA 51 Cb 0.12 -1.01 -0.04 0.00 0.00 0.00 0.00 19.45 18.52 2ptl n ALA 51 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.50 174.03 2ptl n ASP 52 N -0.05 3.75 0.10 0.00 -0.08 -0.47 -4.51 116.55 115.29 2ptl n ASP 52 Ca 0.03 0.00 0.10 0.00 -1.51 0.00 0.00 54.79 53.42 2ptl n ASP 52 Cb 0.24 0.85 0.45 0.00 2.34 0.00 0.00 41.12 45.00 2ptl n ASP 52 CO 0.00 0.00 0.00 0.41 0.12 0.00 0.00 177.20 177.73 2ptl n THR 53 N -2.01 0.91 0.00 5.18 -1.04 -0.85 -3.64 114.28 112.83 2ptl n THR 53 Ca -0.06 0.28 0.00 0.00 -2.04 0.00 0.00 64.05 62.23 2ptl n THR 53 Cb 0.48 -1.18 0.00 0.00 -1.82 0.00 0.00 70.33 67.80 2ptl n THR 53 CO 0.00 0.00 0.00 0.18 -0.64 0.00 0.00 175.07 174.61 2ptl n LEU 54 N -2.07 0.31 -2.32 -4.42 4.32 -1.26 -4.82 117.00 106.75 2ptl n LEU 54 Ca 0.02 0.57 -0.04 0.00 -0.02 0.00 0.00 56.01 56.54 2ptl n LEU 54 Cb 0.20 -0.43 -0.00 0.00 -1.62 0.00 0.00 43.42 41.56 2ptl n LEU 54 CO 0.17 -0.43 -0.05 1.17 -1.22 0.00 0.00 177.39 177.03 2ptl n LYS 55 N -1.78 -2.55 0.00 3.23 4.81 -1.24 -4.82 118.16 115.81 2ptl n LYS 55 Ca 0.00 0.20 0.00 0.00 -0.87 0.00 0.00 58.31 57.64 2ptl n LYS 55 Cb 0.00 -4.67 0.00 0.00 0.02 0.00 0.00 35.03 30.38 2ptl n LYS 55 CO 0.00 0.00 0.00 1.63 1.17 0.00 0.00 177.40 180.20 2ptl n LYS 56 N -2.44 0.00 -0.88 1.64 5.02 -1.26 -4.57 118.16 115.67 2ptl n LYS 56 Ca -0.05 0.00 0.05 0.00 -2.02 0.00 0.00 58.31 56.30 2ptl n LYS 56 Cb 0.49 -0.79 0.14 0.00 -0.02 0.00 0.00 35.03 34.85 2ptl n LYS 56 CO 0.00 0.00 0.00 -0.40 -0.52 0.00 0.00 177.40 176.48 2ptl n ASP 57 N -0.49 1.47 -0.03 4.39 5.75 -1.26 -4.84 116.55 121.53 2ptl n ASP 57 Ca 0.00 -3.23 -0.01 0.00 -0.01 0.00 0.00 54.79 51.54 2ptl n ASP 57 Cb 0.00 -0.45 -0.00 0.00 -1.03 0.00 0.00 41.12 39.64 2ptl n ASP 57 CO 0.00 0.00 0.00 0.78 -0.11 0.00 0.00 177.20 177.87 2ptl h ASN 58 N 0.96 0.00 -0.61 -1.12 2.35 -1.81 -3.39 115.58 111.96 2ptl h ASN 58 Ca -0.08 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.67 2ptl h ASN 58 Cb 1.30 0.00 0.00 0.00 0.05 0.00 0.00 38.32 39.67 2ptl h ASN 58 CO 0.03 0.33 0.00 0.61 -1.65 0.00 0.00 177.43 176.75 2ptl n GLY 59 N 1.77 0.74 0.45 2.83 0.00 -1.26 -3.01 105.19 106.71 2ptl n GLY 59 Ca -0.02 -0.24 0.06 0.00 0.00 0.00 0.00 46.02 45.82 2ptl n GLY 59 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 2ptl n GLU 60 N -0.30 -0.96 -0.88 1.61 1.02 -1.26 -4.77 120.64 115.10 2ptl n GLU 60 Ca 0.00 0.69 0.00 0.00 -0.02 0.00 0.00 57.16 57.83 2ptl n GLU 60 Cb 0.20 -1.15 0.00 0.00 -0.02 0.00 0.00 31.44 30.47 2ptl n GLU 60 CO 0.00 0.00 0.00 2.48 1.18 0.00 0.00 177.13 180.79 2ptl n TYR 61 N -2.73 -0.75 -4.85 -0.32 0.18 -1.26 -2.29 117.16 105.14 2ptl n TYR 61 Ca -0.01 0.00 -0.30 0.00 1.88 0.00 0.00 57.90 59.48 2ptl n TYR 61 Cb 0.21 0.00 -0.15 0.00 -0.38 0.00 0.00 39.34 39.02 2ptl n TYR 61 CO 0.00 0.00 0.00 0.99 -2.08 0.00 0.00 176.86 175.77 2ptl s THR 62 N -2.91 2.12 -0.10 -3.48 2.01 -1.23 -4.93 115.64 107.12 2ptl s THR 62 Ca 0.00 -1.41 -0.10 0.00 0.31 0.00 0.00 61.69 60.49 2ptl s THR 62 Cb 0.00 -1.82 -0.05 0.00 0.01 0.00 0.00 72.50 70.64 2ptl s THR 62 CO 0.00 0.33 0.22 0.54 -0.69 0.00 0.00 174.62 175.02 2ptl s VAL 63 N -0.83 5.36 -0.09 3.82 0.11 -1.26 -3.36 120.40 124.16 2ptl s VAL 63 Ca 0.12 0.39 -0.01 0.00 -2.93 0.00 0.00 61.98 59.55 2ptl s VAL 63 Cb -0.10 -3.50 -0.03 0.00 -1.53 0.00 0.00 36.38 31.22 2ptl s VAL 63 CO 0.02 0.57 -0.04 -1.81 -3.33 0.00 0.00 175.10 170.51 2ptl s ASP 64 N -0.75 4.86 -0.27 3.54 1.11 -0.23 -4.97 116.67 119.94 2ptl s ASP 64 Ca 0.17 0.01 -0.02 0.00 0.18 0.00 0.00 52.55 52.88 2ptl s ASP 64 Cb -0.13 -1.38 0.03 0.00 1.07 0.00 0.00 42.92 42.52 2ptl s ASP 64 CO 0.06 0.33 -0.02 -0.69 1.18 0.00 0.00 175.17 176.03 2ptl s VAL 65 N -0.61 3.03 0.22 -1.27 1.01 -1.26 -2.19 120.40 119.33 2ptl s VAL 65 Ca 0.10 -1.14 -0.06 0.00 0.00 0.00 0.00 61.98 60.87 2ptl s VAL 65 Cb -0.12 -2.63 -0.02 0.00 0.00 0.00 0.00 36.38 33.61 2ptl s VAL 65 CO 0.02 0.06 0.29 0.00 0.00 0.00 0.00 175.10 175.47 2ptl s ALA 66 N 1.31 0.52 -0.85 5.51 0.00 -1.26 -4.80 121.76 122.20 2ptl s ALA 66 Ca -0.02 -1.32 -0.01 0.00 0.00 0.00 0.00 51.96 50.61 2ptl s ALA 66 Cb -0.18 1.24 0.00 0.00 0.00 0.00 0.00 23.12 24.18 2ptl s ALA 66 CO -0.02 -0.71 0.16 -3.47 0.00 0.00 0.00 175.76 171.72 2ptl n ASP 67 N -0.32 -3.68 0.00 0.00 -0.08 -1.26 -2.22 116.55 108.98 2ptl n ASP 67 Ca 0.00 -0.08 0.00 0.00 -1.51 0.00 0.00 54.79 53.20 2ptl n ASP 67 Cb 0.64 -2.75 0.00 0.00 2.34 0.00 0.00 41.12 41.35 2ptl n ASP 67 CO 0.00 0.00 0.00 2.29 0.12 0.00 0.00 177.20 179.61 2ptl n LYS 68 N -2.22 0.00 0.00 -0.67 2.85 -1.26 -3.79 118.16 113.08 2ptl n LYS 68 Ca -0.09 0.00 0.00 0.00 -1.05 0.00 0.00 58.31 57.17 2ptl n LYS 68 Cb 0.58 -2.00 0.00 0.00 -0.65 0.00 0.00 35.03 32.96 2ptl n LYS 68 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 177.40 177.76 2ptl n GLY 69 N -2.00 0.60 1.84 2.58 0.00 -0.94 -5.04 105.19 102.23 2ptl n GLY 69 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 2ptl n GLY 69 CO 0.00 0.00 0.00 2.98 0.00 0.00 0.00 173.32 176.30 2ptl n TYR 70 N 0.00 -0.57 -1.76 1.61 9.36 -1.03 -4.89 117.16 119.89 2ptl n TYR 70 Ca 0.00 0.10 -0.40 0.00 3.32 0.00 0.00 57.90 60.92 2ptl n TYR 70 Cb 0.00 0.44 -0.01 0.00 -0.63 0.00 0.00 39.34 39.14 2ptl n TYR 70 CO 0.00 0.00 0.00 2.41 0.22 0.00 0.00 176.86 179.49 2ptl n THR 71 N -2.82 4.76 -1.68 2.97 -1.04 -1.17 -3.74 114.28 111.57 2ptl n THR 71 Ca 0.00 -3.63 -0.46 0.00 -2.04 0.00 0.00 64.05 57.92 2ptl n THR 71 Cb 0.06 -2.32 -0.04 0.00 -1.82 0.00 0.00 70.33 66.21 2ptl n THR 71 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 2ptl n LEU 72 N 2.76 3.45 -4.67 -4.42 -0.00 -1.21 -4.43 117.00 108.48 2ptl n LEU 72 Ca 0.66 1.02 -0.37 0.00 -0.00 0.00 0.00 56.01 57.32 2ptl n LEU 72 Cb 0.26 -1.43 -0.08 0.00 -0.00 0.00 0.00 43.42 42.16 2ptl n LEU 72 CO 0.77 -0.09 -0.01 0.20 -0.00 0.00 0.00 177.39 178.26 2ptl s ASN 73 N 2.54 6.32 -0.78 1.45 0.02 -0.93 -3.36 114.94 120.20 2ptl s ASN 73 Ca 0.85 0.37 -0.12 0.00 -1.02 0.00 0.00 52.86 52.93 2ptl s ASN 73 Cb -0.64 -2.18 0.20 0.00 0.02 0.00 0.00 41.25 38.65 2ptl s ASN 73 CO 0.43 -0.02 0.70 -0.63 0.02 0.00 0.00 177.10 177.60 2ptl s ILE 74 N 1.17 5.28 -0.84 0.60 1.09 -1.25 -1.07 121.20 126.20 2ptl s ILE 74 Ca 0.15 -2.49 -0.25 0.00 -1.10 0.00 0.00 60.65 56.96 2ptl s ILE 74 Cb -0.14 -4.29 0.05 0.00 -1.06 0.00 0.00 42.46 37.01 2ptl s ILE 74 CO 0.06 -0.99 1.28 -0.75 -0.10 0.00 0.00 174.94 174.44 2ptl s LYS 75 N 0.22 3.34 0.83 2.79 2.47 -1.21 -2.21 119.74 125.96 2ptl s LYS 75 Ca 0.17 -0.71 -0.14 0.00 -1.56 0.00 0.00 55.97 53.73 2ptl s LYS 75 Cb -0.13 -4.63 0.04 0.00 -1.46 0.00 0.00 37.83 31.66 2ptl s LYS 75 CO -0.07 -2.10 0.80 1.19 0.16 0.00 0.00 175.35 175.33 2ptl n PHE 76 N 8.80 -0.04 0.00 4.03 3.72 0.37 -3.48 117.46 130.87 2ptl n PHE 76 Ca 0.13 0.34 0.00 0.00 -0.05 0.00 0.00 57.45 57.88 2ptl n PHE 76 Cb 0.49 -1.96 0.00 0.00 -0.94 0.00 0.00 39.48 37.07 2ptl n PHE 76 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 2ptl n ALA 77 N -3.19 -0.29 0.00 4.37 0.00 -0.97 -4.34 120.51 116.09 2ptl n ALA 77 Ca 0.11 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.55 2ptl n ALA 77 Cb 0.51 0.12 0.00 0.00 0.00 0.00 0.00 19.45 20.08 2ptl n ALA 77 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91