#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1ugv s SER 2 N 0.00 0.09 -0.10 1.61 0.01 -1.26 -5.15 113.70 108.90 1ugv s SER 2 Ca 0.00 0.59 -0.06 0.00 1.31 0.00 0.00 55.95 57.80 1ugv s SER 2 Cb 0.00 1.13 -0.04 0.00 0.21 0.00 0.00 66.02 67.32 1ugv s SER 2 CO 0.00 -0.26 0.12 -0.94 0.41 0.00 0.00 173.24 172.57 1ugv s SER 3 N 2.55 6.20 0.00 2.44 1.04 -1.26 -4.92 113.70 119.75 1ugv s SER 3 Ca 0.05 0.40 0.00 0.00 0.48 0.00 0.00 55.95 56.88 1ugv s SER 3 Cb -0.13 -1.96 0.00 0.00 0.10 0.00 0.00 66.02 64.02 1ugv s SER 3 CO -0.13 0.38 0.00 0.61 0.98 0.00 0.00 173.24 175.08 1ugv n GLY 4 N 1.86 0.68 3.19 7.32 0.00 -1.26 -4.96 105.19 112.02 1ugv n GLY 4 Ca -0.19 -1.56 0.05 0.00 0.00 0.00 0.00 46.02 44.32 1ugv n GLY 4 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1ugv s SER 5 N -4.00 -0.23 0.11 1.61 1.04 -1.26 -5.06 113.70 105.91 1ugv s SER 5 Ca 0.00 0.22 -0.30 0.00 0.48 0.00 0.00 55.95 56.34 1ugv s SER 5 Cb 0.00 1.22 -0.11 0.00 0.10 0.00 0.00 66.02 67.24 1ugv s SER 5 CO 0.00 -0.04 1.50 0.28 0.98 0.00 0.00 173.24 175.95 1ugv h SER 6 N 7.65 -1.64 -2.22 7.02 0.02 -2.00 -3.42 113.55 118.96 1ugv h SER 6 Ca -0.13 0.21 -0.49 0.00 -0.84 0.00 0.00 61.79 60.54 1ugv h SER 6 Cb 1.15 0.66 0.24 0.00 0.14 0.00 0.00 62.40 64.59 1ugv h SER 6 CO -0.07 -0.39 -1.42 0.61 -1.14 0.00 0.00 176.83 174.41 1ugv n GLY 7 N -1.36 -2.74 3.87 -3.77 0.00 -1.26 -4.97 105.19 94.96 1ugv n GLY 7 Ca -0.04 -0.64 -0.34 0.00 0.00 0.00 0.00 46.02 45.00 1ugv n GLY 7 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1ugv s THR 8 N -2.19 5.31 0.00 2.61 2.01 -1.26 -5.11 115.64 117.00 1ugv s THR 8 Ca 0.50 -0.12 0.00 0.00 0.31 0.00 0.00 61.69 62.38 1ugv s THR 8 Cb -0.09 -3.43 0.00 0.00 0.01 0.00 0.00 72.50 68.99 1ugv s THR 8 CO 0.68 0.40 0.00 -0.81 -0.69 0.00 0.00 174.62 174.20 1ugv n PRO 9 N 1.25 1.09 -0.90 4.92 -0.04 -1.26 -4.99 135.00 135.07 1ugv n PRO 9 Ca -0.13 0.00 -0.37 0.00 -0.04 0.00 0.00 63.50 62.96 1ugv n PRO 9 Cb 0.53 0.00 0.08 0.00 -0.04 0.00 0.00 33.50 34.07 1ugv n PRO 9 CO 0.00 0.00 0.00 1.19 -0.04 0.00 0.00 175.50 176.65 1ugv n PHE 10 N -0.24 -1.74 -2.71 0.54 3.72 -1.26 -4.97 117.46 110.81 1ugv n PHE 10 Ca 0.00 0.43 -0.23 0.00 -0.05 0.00 0.00 57.45 57.60 1ugv n PHE 10 Cb 0.00 -1.45 0.03 0.00 -0.94 0.00 0.00 39.48 37.11 1ugv n PHE 10 CO 0.00 0.00 0.00 1.03 -0.05 0.00 0.00 176.76 177.74 1ugv s ARG 11 N -2.49 2.81 0.02 -1.08 0.52 -1.26 -4.84 118.95 112.64 1ugv s ARG 11 Ca 0.43 -0.47 0.01 0.00 -0.52 0.00 0.00 55.73 55.19 1ugv s ARG 11 Cb 0.00 -2.45 -0.02 0.00 0.52 0.00 0.00 34.95 33.00 1ugv s ARG 11 CO 0.68 -0.56 -0.05 0.15 0.02 0.00 0.00 175.30 175.53 1ugv s LYS 12 N -4.76 0.39 0.13 3.54 1.02 -1.26 -1.26 119.74 117.55 1ugv s LYS 12 Ca 0.53 -0.52 0.07 0.00 0.02 0.00 0.00 55.97 56.07 1ugv s LYS 12 Cb -0.10 -0.18 -0.04 0.00 -0.52 0.00 0.00 37.83 36.99 1ugv s LYS 12 CO 0.40 0.03 -0.17 0.00 -0.92 0.00 0.00 175.35 174.69 1ugv s ALA 13 N -0.99 1.70 -0.10 5.17 0.00 -1.09 -1.24 121.76 125.21 1ugv s ALA 13 Ca -0.08 -1.32 0.02 0.00 0.00 0.00 0.00 51.96 50.59 1ugv s ALA 13 Cb -0.07 -0.15 -0.01 0.00 0.00 0.00 0.00 23.12 22.88 1ugv s ALA 13 CO -0.00 0.21 -0.18 0.21 0.00 0.00 0.00 175.76 176.00 1ugv s LYS 14 N -2.43 3.05 0.07 0.00 2.36 -1.14 0.14 119.74 121.79 1ugv s LYS 14 Ca 0.09 -0.78 -0.31 0.00 -2.55 0.00 0.00 55.97 52.43 1ugv s LYS 14 Cb -0.07 -2.43 -0.06 0.00 -1.05 0.00 0.00 37.83 34.21 1ugv s LYS 14 CO 0.04 0.28 1.30 0.00 1.55 0.00 0.00 175.35 178.52 1ugv s ALA 15 N 0.13 3.50 -0.15 3.13 0.00 0.77 0.99 121.76 130.13 1ugv s ALA 15 Ca -0.09 0.95 -0.28 0.00 0.00 0.00 0.00 51.96 52.54 1ugv s ALA 15 Cb -0.16 -3.50 -0.25 0.00 0.00 0.00 0.00 23.12 19.21 1ugv s ALA 15 CO 0.06 -0.57 0.69 -0.07 0.00 0.00 0.00 175.76 175.87 1ugv h LEU 16 N 7.00 0.01 -9.36 0.00 3.38 -0.36 0.38 115.31 116.37 1ugv h LEU 16 Ca -0.41 -0.93 -0.61 0.00 0.09 0.00 0.00 57.88 56.02 1ugv h LEU 16 Cb 1.21 -0.00 -0.13 0.00 0.09 0.00 0.00 40.66 41.82 1ugv h LEU 16 CO 0.84 1.08 -0.71 -0.31 0.09 0.00 0.00 178.44 179.44 1ugv s TYR 17 N -2.25 2.38 0.02 1.13 1.51 -1.25 -4.47 117.35 114.42 1ugv s TYR 17 Ca -0.20 -0.42 -0.24 0.00 -1.01 0.00 0.00 57.07 55.20 1ugv s TYR 17 Cb -0.02 -1.23 -0.05 0.00 -0.11 0.00 0.00 41.96 40.56 1ugv s TYR 17 CO 0.68 0.63 0.74 0.00 -1.11 0.00 0.00 175.55 176.49 1ugv s ALA 18 N -2.55 3.38 0.07 3.71 0.00 -1.26 -3.88 121.76 121.22 1ugv s ALA 18 Ca 0.32 0.23 0.05 0.00 0.00 0.00 0.00 51.96 52.55 1ugv s ALA 18 Cb -0.01 -2.96 -0.03 0.00 0.00 0.00 0.00 23.12 20.12 1ugv s ALA 18 CO 0.16 0.05 -0.13 0.00 0.00 0.00 0.00 175.76 175.84 1ugv n LYS 20 N 1.28 3.14 -3.19 0.00 4.81 -1.26 -2.21 118.16 120.74 1ugv n LYS 20 Ca -0.21 -4.02 -0.00 0.00 -0.87 0.00 0.00 58.31 53.20 1ugv n LYS 20 Cb 0.54 -2.26 0.00 0.00 0.02 0.00 0.00 35.03 33.33 1ugv n LYS 20 CO 0.00 0.00 0.00 0.00 1.17 0.00 0.00 177.40 178.57 1ugv n ALA 21 N -0.56 -2.03 0.28 3.14 0.00 -1.20 -4.71 120.51 115.43 1ugv n ALA 21 Ca 0.47 0.01 0.04 0.00 0.00 0.00 0.00 53.44 53.96 1ugv n ALA 21 Cb 0.54 -0.53 0.18 0.00 0.00 0.00 0.00 19.45 19.64 1ugv n ALA 21 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.50 177.89 1ugv n GLU 22 N 1.27 0.01 -3.77 0.00 -0.58 -1.26 -4.53 120.64 111.76 1ugv n GLU 22 Ca -0.00 0.37 -0.13 0.00 -0.42 0.00 0.00 57.16 56.98 1ugv n GLU 22 Cb 0.49 -1.51 -0.13 0.00 -0.57 0.00 0.00 31.44 29.72 1ugv n GLU 22 CO 0.00 0.00 0.00 -1.58 -0.48 0.00 0.00 177.13 175.07 1ugv s HIS 23 N -3.01 -0.25 0.08 -0.32 2.46 -1.26 -5.04 115.29 107.96 1ugv s HIS 23 Ca 0.04 0.61 -0.16 0.00 0.47 0.00 0.00 55.06 56.02 1ugv s HIS 23 Cb 0.05 0.05 -0.04 0.00 -0.13 0.00 0.00 32.58 32.51 1ugv s HIS 23 CO 0.15 -0.15 1.15 -0.25 -2.47 0.00 0.00 174.74 173.17 1ugv n ASP 24 N 3.52 -0.55 -0.32 9.88 8.00 -1.26 0.15 116.55 135.96 1ugv n ASP 24 Ca -0.18 1.28 0.10 0.00 0.71 0.00 0.00 54.79 56.70 1ugv n ASP 24 Cb 0.56 -0.29 0.23 0.00 -0.02 0.00 0.00 41.12 41.59 1ugv n ASP 24 CO 0.00 0.00 0.00 0.28 -0.39 0.00 0.00 177.20 177.09 1ugv h SER 25 N 0.00 -0.49 -4.21 -2.24 0.02 -1.96 -3.40 113.55 101.27 1ugv h SER 25 Ca 0.08 0.25 -0.52 0.00 -0.84 0.00 0.00 61.79 60.77 1ugv h SER 25 Cb 0.21 0.46 0.20 0.00 0.14 0.00 0.00 62.40 63.41 1ugv h SER 25 CO -0.49 -0.29 0.18 -0.62 -1.14 0.00 0.00 176.83 174.47 1ugv n GLU 26 N -5.46 -0.39 -3.83 3.45 1.02 0.40 -2.61 120.64 113.22 1ugv n GLU 26 Ca 0.19 -0.05 -0.22 0.00 -0.02 0.00 0.00 57.16 57.07 1ugv n GLU 26 Cb 0.63 -2.35 -0.04 0.00 -0.02 0.00 0.00 31.44 29.65 1ugv n GLU 26 CO 0.00 0.00 0.00 -0.51 1.18 0.00 0.00 177.13 177.80 1ugv s LEU 27 N -6.21 3.43 0.15 -4.62 1.43 -0.84 -4.73 118.68 107.29 1ugv s LEU 27 Ca 0.67 -0.67 0.10 0.00 -1.03 0.00 0.00 54.13 53.20 1ugv s LEU 27 Cb -0.24 -2.01 -0.04 0.00 0.03 0.00 0.00 46.19 43.93 1ugv s LEU 27 CO 0.58 -0.44 -0.18 -0.44 0.23 0.00 0.00 176.35 176.10 1ugv s SER 28 N -3.99 3.85 0.06 2.29 0.01 -1.26 -3.22 113.70 111.43 1ugv s SER 28 Ca 0.42 -0.64 -0.21 0.00 1.31 0.00 0.00 55.95 56.84 1ugv s SER 28 Cb -0.04 -0.51 0.07 0.00 0.21 0.00 0.00 66.02 65.76 1ugv s SER 28 CO 0.26 0.15 0.97 2.22 0.41 0.00 0.00 173.24 177.25 1ugv n PHE 29 N 0.52 -0.74 -4.55 2.43 1.16 -0.94 -4.95 117.46 110.40 1ugv n PHE 29 Ca -0.14 -0.80 -0.25 0.00 -1.87 0.00 0.00 57.45 54.38 1ugv n PHE 29 Cb 0.54 0.38 -0.14 0.00 -1.61 0.00 0.00 39.48 38.65 1ugv n PHE 29 CO 0.00 0.00 0.00 0.95 -1.87 0.00 0.00 176.76 175.84 1ugv s THR 30 N -2.09 1.69 0.18 1.97 -4.23 -1.26 -2.29 115.64 109.61 1ugv s THR 30 Ca 0.22 -1.30 -0.31 0.00 -1.18 0.00 0.00 61.69 59.13 1ugv s THR 30 Cb -0.01 -1.49 -0.17 0.00 1.34 0.00 0.00 72.50 72.17 1ugv s THR 30 CO 0.02 0.13 0.79 0.00 -0.54 0.00 0.00 174.62 175.02 1ugv n ALA 31 N 1.63 -2.25 -0.57 3.99 0.00 -1.25 -1.61 120.51 120.46 1ugv n ALA 31 Ca -0.18 0.46 0.00 0.00 0.00 0.00 0.00 53.44 53.72 1ugv n ALA 31 Cb 0.53 -1.77 0.00 0.00 0.00 0.00 0.00 19.45 18.22 1ugv n ALA 31 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1ugv n GLY 32 N 1.79 0.66 3.55 0.00 0.00 0.13 -4.95 105.19 106.38 1ugv n GLY 32 Ca 0.16 -0.46 -0.40 0.00 0.00 0.00 0.00 46.02 45.32 1ugv n GLY 32 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1ugv s THR 33 N -2.00 5.20 -0.05 2.61 2.01 -0.63 -4.83 115.64 117.95 1ugv s THR 33 Ca 0.00 0.09 -0.23 0.00 0.31 0.00 0.00 61.69 61.86 1ugv s THR 33 Cb 0.00 -3.76 -0.04 0.00 0.01 0.00 0.00 72.50 68.70 1ugv s THR 33 CO 0.00 -0.02 0.67 -0.69 -0.69 0.00 0.00 174.62 173.90 1ugv s VAL 34 N 1.96 5.00 -0.15 3.82 1.01 -1.26 -0.16 120.40 130.62 1ugv s VAL 34 Ca 0.11 1.40 -0.08 0.00 0.00 0.00 0.00 61.98 63.41 1ugv s VAL 34 Cb -0.16 -4.01 -0.04 0.00 0.00 0.00 0.00 36.38 32.16 1ugv s VAL 34 CO 0.11 0.30 0.12 -0.36 0.00 0.00 0.00 175.10 175.27 1ugv s PHE 35 N 0.52 3.47 -0.10 5.22 0.40 0.37 -4.92 117.98 122.94 1ugv s PHE 35 Ca 0.36 0.39 -0.22 0.00 -0.60 0.00 0.00 56.93 56.86 1ugv s PHE 35 Cb -0.18 -2.02 -0.04 0.00 0.51 0.00 0.00 43.02 41.29 1ugv s PHE 35 CO 0.18 0.50 0.63 -0.51 0.70 0.00 0.00 175.22 176.72 1ugv s ASP 36 N -0.38 6.87 -0.32 1.36 1.11 0.08 -2.67 116.67 122.71 1ugv s ASP 36 Ca 0.11 1.04 -0.06 0.00 0.18 0.00 0.00 52.55 53.83 1ugv s ASP 36 Cb -0.12 -2.37 0.01 0.00 1.07 0.00 0.00 42.92 41.51 1ugv s ASP 36 CO 0.01 -0.11 0.22 -3.20 1.18 0.00 0.00 175.17 173.27 1ugv n ASN 37 N 3.92 -7.46 -4.55 0.27 2.85 -0.74 -1.60 115.26 107.95 1ugv n ASN 37 Ca -0.03 0.98 -0.33 0.00 -0.11 0.00 0.00 54.58 55.10 1ugv n ASN 37 Cb 0.51 -4.97 -0.12 0.00 1.24 0.00 0.00 39.78 36.45 1ugv n ASN 37 CO 0.00 0.00 0.00 -0.69 -2.11 0.00 0.00 177.26 174.46 1ugv s VAL 38 N -1.87 3.42 0.23 3.44 1.01 -0.39 -2.91 120.40 123.33 1ugv s VAL 38 Ca 0.09 -0.72 -0.20 0.00 0.00 0.00 0.00 61.98 61.15 1ugv s VAL 38 Cb -0.03 -2.42 0.03 0.00 0.00 0.00 0.00 36.38 33.96 1ugv s VAL 38 CO 0.71 0.49 0.61 -1.38 0.00 0.00 0.00 175.10 175.54 1ugv s HIS 39 N -0.87 -0.19 -0.28 5.22 -3.43 -0.96 -4.43 115.29 110.36 1ugv s HIS 39 Ca 0.14 -0.18 -0.29 0.00 -0.80 0.00 0.00 55.06 53.94 1ugv s HIS 39 Cb -0.11 0.54 -0.00 0.00 -1.43 0.00 0.00 32.58 31.57 1ugv s HIS 39 CO 0.04 -1.04 1.34 -1.25 -2.00 0.00 0.00 174.74 171.82 1ugv s PRO 40 N -3.88 3.93 1.18 -0.38 0.04 -1.26 0.19 135.00 134.82 1ugv s PRO 40 Ca 0.09 1.34 -0.20 0.00 0.04 0.00 0.00 61.00 62.27 1ugv s PRO 40 Cb -0.03 -3.89 0.30 0.00 0.04 0.00 0.00 34.50 30.92 1ugv s PRO 40 CO 0.00 -1.10 0.95 0.45 0.04 0.00 0.00 177.00 177.34 1ugv n SER 41 N 7.63 -2.50 0.08 6.66 2.88 0.48 -4.71 113.62 124.14 1ugv n SER 41 Ca 0.15 -1.04 -0.06 0.00 -1.33 0.00 0.00 58.87 56.59 1ugv n SER 41 Cb 0.46 -0.92 0.08 0.00 -0.75 0.00 0.00 64.21 63.08 1ugv n SER 41 CO 0.00 0.00 0.00 -0.61 -1.23 0.00 0.00 175.04 173.20 1ugv h GLN 42 N 0.00 0.24 -7.15 -1.46 5.75 -1.95 -3.45 115.11 107.09 1ugv h GLN 42 Ca -0.37 -0.19 -0.49 0.00 -0.15 0.00 0.00 58.65 57.44 1ugv h GLN 42 Cb 1.17 0.04 0.06 0.00 1.07 0.00 0.00 27.48 29.81 1ugv h GLN 42 CO 0.24 0.84 0.39 -1.21 -2.65 0.00 0.00 178.83 176.43 1ugv s GLU 43 N -3.60 3.40 0.03 1.69 8.01 -1.26 -4.99 118.70 121.98 1ugv s GLU 43 Ca -0.04 1.33 -0.30 0.00 0.01 0.00 0.00 54.97 55.97 1ugv s GLU 43 Cb 0.11 -2.04 -0.05 0.00 -4.31 0.00 0.00 34.13 27.85 1ugv s GLU 43 CO 0.81 -0.76 1.18 -1.25 0.01 0.00 0.00 175.26 175.25 1ugv s PRO 44 N -3.72 4.43 -1.32 0.39 0.04 -1.26 -3.03 135.00 130.52 1ugv s PRO 44 Ca 0.66 1.72 -0.03 0.00 0.04 0.00 0.00 61.00 63.39 1ugv s PRO 44 Cb -0.18 -3.40 0.00 0.00 0.04 0.00 0.00 34.50 30.96 1ugv s PRO 44 CO 0.31 -0.28 0.35 0.41 0.04 0.00 0.00 177.00 177.84 1ugv n GLY 45 N 3.22 -0.30 2.80 0.56 0.00 -1.26 -4.99 105.19 105.21 1ugv n GLY 45 Ca 0.09 -0.08 -0.22 0.00 0.00 0.00 0.00 46.02 45.81 1ugv n GLY 45 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 1ugv s TRP 46 N -3.00 0.69 0.25 1.61 0.52 -1.17 -2.87 118.94 114.99 1ugv s TRP 46 Ca 0.17 -0.19 -0.04 0.00 0.02 0.00 0.00 56.10 56.07 1ugv s TRP 46 Cb -0.08 -0.78 -0.05 0.00 -1.15 0.00 0.00 33.47 31.41 1ugv s TRP 46 CO 0.22 -0.31 0.50 -0.51 0.02 0.00 0.00 176.95 176.87 1ugv s LEU 47 N 1.76 4.12 -0.29 2.99 1.43 0.51 -0.39 118.68 128.82 1ugv s LEU 47 Ca 0.02 0.63 0.01 0.00 -1.03 0.00 0.00 54.13 53.76 1ugv s LEU 47 Cb -0.13 -3.42 0.08 0.00 0.03 0.00 0.00 46.19 42.75 1ugv s LEU 47 CO -0.04 -0.13 0.02 -0.70 0.23 0.00 0.00 176.35 175.72 1ugv s GLU 48 N -3.41 1.32 0.09 1.70 2.12 0.51 0.16 118.70 121.19 1ugv s GLU 48 Ca 0.42 -1.28 0.02 0.00 0.36 0.00 0.00 54.97 54.49 1ugv s GLU 48 Cb -0.11 -2.61 -0.01 0.00 0.26 0.00 0.00 34.13 31.67 1ugv s GLU 48 CO 0.29 -0.81 0.08 0.41 -0.54 0.00 0.00 175.26 174.69 1ugv n GLY 49 N 4.59 3.64 3.48 -1.50 0.00 -1.23 -2.25 105.19 111.92 1ugv n GLY 49 Ca -0.04 -1.70 -0.31 0.00 0.00 0.00 0.00 46.02 43.97 1ugv n GLY 49 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1ugv s THR 50 N -2.39 2.96 0.02 2.61 2.01 -0.63 -3.13 115.64 117.09 1ugv s THR 50 Ca 0.11 -1.04 -0.02 0.00 0.31 0.00 0.00 61.69 61.05 1ugv s THR 50 Cb 0.00 -2.23 -0.01 0.00 0.01 0.00 0.00 72.50 70.27 1ugv s THR 50 CO 0.08 0.39 -0.03 -0.11 -0.69 0.00 0.00 174.62 174.26 1ugv n LEU 51 N 1.70 0.55 -3.56 4.42 7.94 -1.06 -0.75 117.00 126.23 1ugv n LEU 51 Ca -0.16 0.08 -0.28 0.00 -1.11 0.00 0.00 56.01 54.53 1ugv n LEU 51 Cb 0.52 -0.25 -0.11 0.00 0.53 0.00 0.00 43.42 44.11 1ugv n LEU 51 CO 0.27 -0.56 -0.26 0.20 -1.11 0.00 0.00 177.39 175.93 1ugv s ASN 52 N -5.28 2.79 -0.85 1.96 0.01 -1.26 -4.78 114.94 107.53 1ugv s ASN 52 Ca -0.03 -2.93 0.00 0.00 -0.71 0.00 0.00 52.86 49.19 1ugv s ASN 52 Cb 0.00 -0.76 0.00 0.00 0.41 0.00 0.00 41.25 40.90 1ugv s ASN 52 CO 0.04 -0.20 0.00 0.61 -1.51 0.00 0.00 177.10 176.04 1ugv n GLY 53 N 3.09 0.25 2.80 0.66 0.00 -1.26 -4.88 105.19 105.85 1ugv n GLY 53 Ca 0.20 0.00 -0.15 0.00 0.00 0.00 0.00 46.02 46.06 1ugv n GLY 53 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1ugv s LYS 54 N -3.74 -0.00 -0.03 1.61 2.20 -1.26 -5.15 119.74 113.38 1ugv s LYS 54 Ca 0.00 0.30 0.00 0.00 -0.36 0.00 0.00 55.97 55.91 1ugv s LYS 54 Cb 0.00 -0.27 -0.04 0.00 -1.51 0.00 0.00 37.83 36.02 1ugv s LYS 54 CO 0.00 -0.20 0.01 0.99 -0.36 0.00 0.00 175.35 175.79 1ugv s THR 55 N 1.36 4.28 0.00 3.43 2.01 -1.26 -2.58 115.64 122.88 1ugv s THR 55 Ca -0.06 -0.47 0.00 0.00 0.31 0.00 0.00 61.69 61.47 1ugv s THR 55 Cb -0.12 -2.89 0.00 0.00 0.01 0.00 0.00 72.50 69.50 1ugv s THR 55 CO -0.04 0.44 0.00 0.61 -0.69 0.00 0.00 174.62 174.94 1ugv n GLY 56 N 1.57 1.63 3.82 4.40 0.00 -1.18 -5.00 105.19 110.42 1ugv n GLY 56 Ca -0.15 -0.84 -0.37 0.00 0.00 0.00 0.00 46.02 44.66 1ugv n GLY 56 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1ugv s LEU 57 N 0.00 4.39 0.00 0.99 1.43 -1.07 -3.50 118.68 120.92 1ugv s LEU 57 Ca 0.00 1.31 0.03 0.00 -1.03 0.00 0.00 54.13 54.44 1ugv s LEU 57 Cb 0.00 -3.36 -0.01 0.00 0.03 0.00 0.00 46.19 42.85 1ugv s LEU 57 CO 0.00 0.10 -0.09 -0.63 0.23 0.00 0.00 176.35 175.97 1ugv s ILE 58 N -1.41 0.67 -0.13 -0.59 1.01 0.41 -1.98 121.20 119.18 1ugv s ILE 58 Ca 0.39 -0.46 -0.29 0.00 0.00 0.00 0.00 60.65 60.28 1ugv s ILE 58 Cb -0.17 -0.58 -0.02 0.00 0.01 0.00 0.00 42.46 41.70 1ugv s ILE 58 CO 0.20 0.12 1.26 -2.16 0.00 0.00 0.00 174.94 174.36 1ugv s PRO 59 N -0.39 4.26 0.55 2.79 0.04 -1.26 0.19 135.00 141.18 1ugv s PRO 59 Ca 0.02 1.69 0.32 0.00 0.04 0.00 0.00 61.00 63.06 1ugv s PRO 59 Cb -0.04 -3.72 1.56 0.00 0.04 0.00 0.00 34.50 32.34 1ugv s PRO 59 CO -0.00 -0.65 2.08 1.49 0.04 0.00 0.00 177.00 179.96 1ugv h GLU 60 N 8.05 0.00 -0.68 4.56 4.81 -1.88 -0.51 114.58 128.92 1ugv h GLU 60 Ca -0.29 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 58.94 1ugv h GLU 60 Cb 1.12 0.00 0.00 0.00 0.63 0.00 0.00 28.75 30.50 1ugv h GLU 60 CO 0.95 0.08 0.00 0.27 -0.73 0.00 0.00 179.01 179.57 1ugv n ASN 61 N -3.36 2.65 0.00 1.04 6.94 -1.26 -3.27 115.26 118.00 1ugv n ASN 61 Ca -0.01 -2.29 0.00 0.00 -0.02 0.00 0.00 54.58 52.26 1ugv n ASN 61 Cb 0.25 -0.48 0.00 0.00 -2.36 0.00 0.00 39.78 37.19 1ugv n ASN 61 CO 0.00 0.00 0.00 -1.22 -1.03 0.00 0.00 177.26 175.01 1ugv n TYR 62 N 0.31 0.00 -4.43 -2.53 4.02 -0.21 -4.90 117.16 109.41 1ugv n TYR 62 Ca 0.11 -0.05 -0.21 0.00 -0.01 0.00 0.00 57.90 57.74 1ugv n TYR 62 Cb 0.55 -0.01 -0.10 0.00 -0.02 0.00 0.00 39.34 39.76 1ugv n TYR 62 CO 0.00 0.00 0.00 0.14 -1.01 0.00 0.00 176.86 175.99 1ugv s VAL 63 N -0.11 0.97 -0.42 -0.72 -7.23 -1.15 0.38 120.40 112.12 1ugv s VAL 63 Ca 0.00 -2.00 0.05 0.00 -1.81 0.00 0.00 61.98 58.22 1ugv s VAL 63 Cb 0.00 -2.70 0.17 0.00 0.56 0.00 0.00 36.38 34.41 1ugv s VAL 63 CO 0.00 0.00 0.51 -0.70 -0.31 0.00 0.00 175.10 174.60 1ugv s GLU 64 N -3.90 0.81 0.10 4.82 2.12 0.28 -4.69 118.70 118.24 1ugv s GLU 64 Ca 0.35 -0.92 -0.31 0.00 0.36 0.00 0.00 54.97 54.45 1ugv s GLU 64 Cb 0.08 -0.47 -0.17 0.00 0.26 0.00 0.00 34.13 33.83 1ugv s GLU 64 CO 0.15 -1.25 0.72 1.19 -0.54 0.00 0.00 175.26 175.54 1ugv n PHE 65 N 3.84 0.04 -4.12 5.30 3.72 -1.26 -2.90 117.46 122.08 1ugv n PHE 65 Ca 0.15 0.94 -0.33 0.00 -0.05 0.00 0.00 57.45 58.16 1ugv n PHE 65 Cb 0.51 -1.88 -0.07 0.00 -0.94 0.00 0.00 39.48 37.10 1ugv n PHE 65 CO 0.00 0.00 0.00 -0.51 -0.05 0.00 0.00 176.76 176.20 1ugv s LEU 66 N 1.47 3.87 0.65 4.37 1.43 -0.38 -4.87 118.68 125.23 1ugv s LEU 66 Ca 0.71 0.15 0.00 0.00 -1.03 0.00 0.00 54.13 53.96 1ugv s LEU 66 Cb -1.01 -2.21 0.00 0.00 0.03 0.00 0.00 46.19 42.99 1ugv s LEU 66 CO 0.52 0.29 0.00 -0.24 0.23 0.00 0.00 176.35 177.15 1ugv n SER 67 N 1.31 -8.07 0.00 2.29 2.88 -1.26 -4.57 113.62 106.20 1ugv n SER 67 Ca -0.14 1.52 0.00 0.00 -1.33 0.00 0.00 58.87 58.92 1ugv n SER 67 Cb 0.53 -5.13 0.00 0.00 -0.75 0.00 0.00 64.21 58.86 1ugv n SER 67 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 1ugv n GLY 68 N -4.40 -1.20 2.57 0.46 0.00 -1.26 -5.01 105.19 96.35 1ugv n GLY 68 Ca -0.10 -0.92 -0.32 0.00 0.00 0.00 0.00 46.02 44.69 1ugv n GLY 68 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 1ugv n PRO 69 N 0.00 2.66 -3.56 1.61 -0.04 -1.26 -4.65 135.00 129.77 1ugv n PRO 69 Ca 0.00 -1.86 -0.29 0.00 -0.04 0.00 0.00 63.50 61.31 1ugv n PRO 69 Cb 0.00 -2.70 -0.12 0.00 -0.04 0.00 0.00 33.50 30.64 1ugv n PRO 69 CO 0.00 0.00 0.00 0.45 -0.04 0.00 0.00 175.50 175.91 1ugv s SER 70 N 3.12 3.01 0.09 3.54 0.15 -1.26 -4.86 113.70 117.49 1ugv s SER 70 Ca 0.53 -2.57 0.00 0.00 0.70 0.00 0.00 55.95 54.60 1ugv s SER 70 Cb 0.14 -0.68 0.00 0.00 -1.71 0.00 0.00 66.02 63.77 1ugv s SER 70 CO -0.03 -0.26 0.00 -0.24 1.20 0.00 0.00 173.24 173.91 1ugv n SER 71 N 3.56 -0.81 0.00 5.45 2.88 -1.26 -5.15 113.62 118.29 1ugv n SER 71 Ca 0.14 0.49 0.11 0.00 -1.33 0.00 0.00 58.87 58.28 1ugv n SER 71 Cb 0.38 1.08 0.67 0.00 -0.75 0.00 0.00 64.21 65.58 1ugv n SER 71 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42