#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3k0t s THR 4 N 0.00 1.05 -0.13 3.15 2.01 -0.14 -4.98 115.64 116.59 3k0t s THR 4 Ca 0.00 -0.61 -0.22 0.00 0.31 0.00 0.00 61.69 61.17 3k0t s THR 4 Cb 0.00 -0.88 -0.03 0.00 0.01 0.00 0.00 72.50 71.60 3k0t s THR 4 CO 0.00 0.26 0.65 -0.69 -0.69 0.00 0.00 174.62 174.15 3k0t s VAL 5 N -0.37 5.05 -0.21 3.82 1.01 -1.26 -0.82 120.40 127.61 3k0t s VAL 5 Ca 0.05 1.28 -0.11 0.00 0.00 0.00 0.00 61.98 63.20 3k0t s VAL 5 Cb -0.05 -3.98 -0.05 0.00 0.00 0.00 0.00 36.38 32.30 3k0t s VAL 5 CO -0.00 0.19 0.18 -0.63 0.00 0.00 0.00 175.10 174.84 3k0t s ILE 6 N 1.30 5.36 -0.14 2.22 -1.09 -0.08 -4.95 121.20 123.82 3k0t s ILE 6 Ca 0.32 0.27 -0.09 0.00 -2.23 0.00 0.00 60.65 58.92 3k0t s ILE 6 Cb -0.16 -3.52 0.04 0.00 -1.58 0.00 0.00 42.46 37.24 3k0t s ILE 6 CO 0.13 0.38 0.34 -0.89 -1.23 0.00 0.00 174.94 173.68 3k0t s THR 7 N 0.72 -0.02 -0.02 2.92 2.01 -1.26 -2.98 115.64 117.01 3k0t s THR 7 Ca 0.10 0.07 -0.01 0.00 0.31 0.00 0.00 61.69 62.15 3k0t s THR 7 Cb -0.12 -0.50 0.01 0.00 0.01 0.00 0.00 72.50 71.90 3k0t s THR 7 CO 0.02 0.03 0.04 -0.55 -0.69 0.00 0.00 174.62 173.46 3k0t s SER 8 N 0.84 -0.01 0.00 3.53 0.15 -1.26 -4.94 113.70 112.02 3k0t s SER 8 Ca -0.05 0.07 0.27 0.00 0.70 0.00 0.00 55.95 56.93 3k0t s SER 8 Cb -0.06 0.03 1.56 0.00 -1.71 0.00 0.00 66.02 65.84 3k0t s SER 8 CO -0.06 -0.05 1.95 -0.90 1.20 0.00 0.00 173.24 175.38 3k0t n ASP 9 N 3.46 0.00 0.20 5.45 5.75 -1.26 -2.01 116.55 128.15 3k0t n ASP 9 Ca -0.18 -0.69 0.12 0.00 -0.01 0.00 0.00 54.79 54.03 3k0t n ASP 9 Cb 0.56 -0.06 0.18 0.00 -1.03 0.00 0.00 41.12 40.77 3k0t n ASP 9 CO 0.00 0.00 0.00 0.11 -0.11 0.00 0.00 177.20 177.20 3k0t h LYS 10 N 0.00 0.00 -6.17 0.11 1.79 -1.95 -3.45 116.57 106.90 3k0t h LYS 10 Ca 0.00 0.00 -0.48 0.00 -2.18 0.00 0.00 60.65 57.99 3k0t h LYS 10 Cb 0.05 0.00 -0.02 0.00 -1.58 0.00 0.00 32.23 30.68 3k0t h LYS 10 CO 0.00 0.00 -0.45 0.00 -1.08 0.00 0.00 179.45 177.92 3k0t s ALA 11 N -3.21 3.87 0.40 3.86 0.00 -0.85 -4.80 121.76 121.04 3k0t s ALA 11 Ca 0.07 -1.23 -0.26 0.00 0.00 0.00 0.00 51.96 50.53 3k0t s ALA 11 Cb 0.06 -1.66 -0.10 0.00 0.00 0.00 0.00 23.12 21.41 3k0t s ALA 11 CO 0.67 0.29 1.32 -2.30 0.00 0.00 0.00 175.76 175.74 3k0t n PRO 12 N -1.24 2.10 -1.74 0.00 -0.02 -1.26 -4.89 135.00 127.95 3k0t n PRO 12 Ca -0.09 0.74 -0.42 0.00 -2.02 0.00 0.00 63.50 61.72 3k0t n PRO 12 Cb 0.57 -2.43 -0.00 0.00 -0.02 0.00 0.00 33.50 31.61 3k0t n PRO 12 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 3k0t n ALA 13 N -0.02 1.87 -3.25 3.55 0.00 -1.26 -4.93 120.51 116.47 3k0t n ALA 13 Ca 0.05 0.35 -0.46 0.00 0.00 0.00 0.00 53.44 53.39 3k0t n ALA 13 Cb 0.39 -2.34 -0.03 0.00 0.00 0.00 0.00 19.45 17.47 3k0t n ALA 13 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3k0t s ALA 14 N -1.02 3.88 -0.30 0.00 0.00 -1.26 -5.02 121.76 118.04 3k0t s ALA 14 Ca 0.55 -3.08 -0.13 0.00 0.00 0.00 0.00 51.96 49.31 3k0t s ALA 14 Cb -0.52 -3.57 -0.03 0.00 0.00 0.00 0.00 23.12 18.99 3k0t s ALA 14 CO 0.62 -2.36 0.25 0.42 0.00 0.00 0.00 175.76 174.69 3k0t s ILE 15 N 0.88 5.26 -2.39 0.00 -1.09 -1.26 -4.86 121.20 117.74 3k0t s ILE 15 Ca 0.18 0.11 0.00 0.00 -2.23 0.00 0.00 60.65 58.71 3k0t s ILE 15 Cb -0.12 -3.64 0.00 0.00 -1.58 0.00 0.00 42.46 37.11 3k0t s ILE 15 CO -0.07 0.12 0.00 0.61 -1.23 0.00 0.00 174.94 174.37 3k0t n GLY 16 N 5.00 0.93 2.26 6.18 0.00 -1.26 -4.90 105.19 113.40 3k0t n GLY 16 Ca -0.12 -2.15 -0.31 0.00 0.00 0.00 0.00 46.02 43.44 3k0t n GLY 16 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 3k0t n PRO 17 N -1.39 3.14 -3.70 1.61 -0.04 -1.26 -4.84 135.00 128.52 3k0t n PRO 17 Ca 0.00 -1.83 -0.10 0.00 -0.04 0.00 0.00 63.50 61.53 3k0t n PRO 17 Cb 0.00 -2.57 -0.04 0.00 -0.04 0.00 0.00 33.50 30.86 3k0t n PRO 17 CO 0.00 0.00 0.00 1.52 -0.04 0.00 0.00 175.50 176.98 3k0t s TYR 18 N 1.99 -0.15 0.21 0.54 -0.85 -1.26 -5.17 117.35 112.64 3k0t s TYR 18 Ca 0.66 -0.17 0.10 0.00 -0.52 0.00 0.00 57.07 57.13 3k0t s TYR 18 Cb 0.21 0.37 -0.04 0.00 0.38 0.00 0.00 41.96 42.88 3k0t s TYR 18 CO -0.04 -0.87 -0.11 -1.12 -1.52 0.00 0.00 175.55 171.88 3k0t s SER 19 N -2.85 4.11 0.28 -0.18 0.01 -1.26 -4.83 113.70 108.98 3k0t s SER 19 Ca 0.08 -0.68 -0.00 0.00 1.31 0.00 0.00 55.95 56.66 3k0t s SER 19 Cb -0.00 -0.63 0.50 0.00 0.21 0.00 0.00 66.02 66.10 3k0t s SER 19 CO -0.05 0.08 1.88 1.56 0.41 0.00 0.00 173.24 177.12 3k0t h GLN 20 N 2.73 1.04 -2.29 12.44 4.20 -1.95 -3.41 115.11 127.87 3k0t h GLN 20 Ca -0.46 -0.06 0.00 0.00 0.06 0.00 0.00 58.65 58.20 3k0t h GLN 20 Cb 1.22 -0.23 -0.17 0.00 0.30 0.00 0.00 27.48 28.60 3k0t h GLN 20 CO 0.55 0.69 0.31 0.00 -0.67 0.00 0.00 178.83 179.70 3k0t s ALA 21 N -5.96 -1.75 -0.10 3.87 0.00 -1.16 -1.33 121.76 115.33 3k0t s ALA 21 Ca -0.12 1.05 0.02 0.00 0.00 0.00 0.00 51.96 52.92 3k0t s ALA 21 Cb 0.21 0.24 0.01 0.00 0.00 0.00 0.00 23.12 23.58 3k0t s ALA 21 CO 0.81 -0.54 -0.17 0.42 0.00 0.00 0.00 175.76 176.28 3k0t s ILE 22 N -2.31 1.60 -0.25 0.00 -1.09 -0.34 -0.90 121.20 117.91 3k0t s ILE 22 Ca -0.03 -0.72 -0.12 0.00 -2.23 0.00 0.00 60.65 57.55 3k0t s ILE 22 Cb -0.01 -1.44 -0.05 0.00 -1.58 0.00 0.00 42.46 39.39 3k0t s ILE 22 CO -0.02 0.46 0.22 -0.75 -1.23 0.00 0.00 174.94 173.62 3k0t s LYS 23 N 0.81 4.04 -0.26 2.79 2.20 0.00 -0.80 119.74 128.52 3k0t s LYS 23 Ca -0.10 -0.20 0.01 0.00 -0.36 0.00 0.00 55.97 55.31 3k0t s LYS 23 Cb -0.16 -3.59 0.07 0.00 -1.51 0.00 0.00 37.83 32.65 3k0t s LYS 23 CO 0.01 -0.06 -0.01 0.00 -0.36 0.00 0.00 175.35 174.93 3k0t s ALA 24 N 1.40 1.95 0.00 3.13 0.00 0.61 -0.96 121.76 127.90 3k0t s ALA 24 Ca 0.09 -1.52 0.00 0.00 0.00 0.00 0.00 51.96 50.53 3k0t s ALA 24 Cb -0.15 -1.52 0.00 0.00 0.00 0.00 0.00 23.12 21.46 3k0t s ALA 24 CO 0.07 -1.33 0.00 0.41 0.00 0.00 0.00 175.76 174.91 3k0t n GLY 25 N 4.67 2.48 0.12 0.00 0.00 -1.26 -1.90 105.19 109.30 3k0t n GLY 25 Ca -0.08 -0.30 0.12 0.00 0.00 0.00 0.00 46.02 45.76 3k0t n GLY 25 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 3k0t n ASN 26 N 7.13 0.83 -4.69 1.61 4.13 -1.26 -4.91 115.26 118.10 3k0t n ASN 26 Ca 0.00 -0.63 -0.36 0.00 1.68 0.00 0.00 54.58 55.27 3k0t n ASN 26 Cb 0.00 0.28 -0.09 0.00 -1.54 0.00 0.00 39.78 38.43 3k0t n ASN 26 CO 0.00 0.00 0.00 -0.89 0.28 0.00 0.00 177.26 176.65 3k0t s THR 27 N -2.78 5.36 -0.26 3.41 2.01 -0.80 -1.73 115.64 120.86 3k0t s THR 27 Ca 0.16 0.18 -0.06 0.00 0.31 0.00 0.00 61.69 62.28 3k0t s THR 27 Cb 0.18 -3.47 -0.01 0.00 0.01 0.00 0.00 72.50 69.21 3k0t s THR 27 CO 0.64 0.40 0.03 -0.69 -0.69 0.00 0.00 174.62 174.30 3k0t s VAL 28 N 0.70 3.81 0.51 3.82 1.01 0.83 -0.28 120.40 130.79 3k0t s VAL 28 Ca 0.08 -0.50 0.03 0.00 0.00 0.00 0.00 61.98 61.58 3k0t s VAL 28 Cb -0.12 -2.84 0.03 0.00 0.00 0.00 0.00 36.38 33.44 3k0t s VAL 28 CO 0.01 0.27 0.71 -0.31 0.00 0.00 0.00 175.10 175.78 3k0t s TYR 29 N 1.52 2.86 0.25 5.22 2.02 0.02 -0.92 117.35 128.31 3k0t s TYR 29 Ca 0.05 -0.12 0.10 0.00 -0.37 0.00 0.00 57.07 56.73 3k0t s TYR 29 Cb -0.16 -2.63 -0.05 0.00 -0.40 0.00 0.00 41.96 38.73 3k0t s TYR 29 CO 0.01 -0.72 -0.16 -1.12 -1.57 0.00 0.00 175.55 171.98 3k0t s SER 31 N -4.39 3.06 0.35 2.29 0.01 -0.44 -1.20 113.70 113.38 3k0t s SER 31 Ca 0.56 -1.04 -0.28 0.00 1.31 0.00 0.00 55.95 56.50 3k0t s SER 31 Cb -0.10 -0.22 -0.10 0.00 0.21 0.00 0.00 66.02 65.81 3k0t s SER 31 CO 0.37 -0.09 1.32 -0.83 0.41 0.00 0.00 173.24 174.42 3k0t s GLY 32 N -3.42 2.98 -0.08 3.44 0.00 -1.26 -4.58 107.32 104.40 3k0t s GLY 32 Ca 0.26 1.28 0.03 0.00 0.00 0.00 0.00 44.72 46.30 3k0t s GLY 32 CO 0.11 1.92 -0.17 1.20 0.00 0.00 0.00 173.10 176.16 3k0t s GLN 33 N -1.92 2.84 0.43 2.90 -1.52 -1.26 -4.95 119.66 116.17 3k0t s GLN 33 Ca 0.51 -0.76 0.07 0.00 -1.95 0.00 0.00 55.36 53.24 3k0t s GLN 33 Cb -0.40 -2.40 -0.03 0.00 -0.22 0.00 0.00 33.01 29.96 3k0t s GLN 33 CO 0.53 0.40 0.32 0.96 -0.25 0.00 0.00 175.29 177.25 3k0t s ILE 34 N -0.17 2.47 0.00 1.08 -4.36 -1.26 -4.35 121.20 114.60 3k0t s ILE 34 Ca -0.01 -1.46 -0.02 0.00 -0.26 0.00 0.00 60.65 58.90 3k0t s ILE 34 Cb -0.14 -2.93 -0.07 0.00 1.25 0.00 0.00 42.46 40.57 3k0t s ILE 34 CO 0.03 0.00 1.39 -2.65 0.24 0.00 0.00 174.94 173.95 3k0t n PRO 35 N -1.47 0.63 -3.13 0.37 -0.02 -1.26 -4.55 135.00 125.57 3k0t n PRO 35 Ca 0.02 -0.26 -0.39 0.00 -2.02 0.00 0.00 63.50 60.85 3k0t n PRO 35 Cb 0.63 -1.57 -0.05 0.00 -0.02 0.00 0.00 33.50 32.48 3k0t n PRO 35 CO 0.00 0.00 0.00 -0.51 1.98 0.00 0.00 175.50 176.97 3k0t s LEU 36 N 0.00 4.41 -0.34 2.45 1.43 -1.26 -2.02 118.68 123.35 3k0t s LEU 36 Ca 0.17 1.22 -0.28 0.00 -1.03 0.00 0.00 54.13 54.21 3k0t s LEU 36 Cb 0.08 -3.01 0.02 0.00 0.03 0.00 0.00 46.19 43.31 3k0t s LEU 36 CO 0.00 0.05 1.04 -0.62 0.23 0.00 0.00 176.35 177.04 3k0t s ASP 37 N 0.01 6.84 0.31 2.29 -1.08 -0.38 -4.82 116.67 119.84 3k0t s ASP 37 Ca 0.34 0.88 0.07 0.00 -0.52 0.00 0.00 52.55 53.32 3k0t s ASP 37 Cb -0.19 -2.52 0.79 0.00 -1.46 0.00 0.00 42.92 39.54 3k0t s ASP 37 CO 0.18 -0.89 1.77 -0.65 0.52 0.00 0.00 175.17 176.10 3k0t h PRO 38 N 8.27 0.69 0.00 4.34 0.11 -1.89 -2.19 132.00 141.34 3k0t h PRO 38 Ca -0.21 -0.04 -0.07 0.00 0.11 0.00 0.00 66.00 65.78 3k0t h PRO 38 Cb 1.07 -0.16 -0.01 0.00 0.11 0.00 0.00 31.00 32.01 3k0t h PRO 38 CO 1.02 0.46 -0.34 0.66 -0.21 0.00 0.00 178.00 179.59 3k0t h SER 39 N 0.71 0.00 0.00 -2.05 4.64 -1.93 -3.44 113.55 111.49 3k0t h SER 39 Ca 0.59 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.91 3k0t h SER 39 Cb 0.98 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.07 3k0t h SER 39 CO -0.39 0.34 0.00 0.35 -0.87 0.00 0.00 176.83 176.26 3k0t n THR 40 N -3.27 0.00 0.00 2.95 -2.24 -0.82 -5.21 114.28 105.69 3k0t n THR 40 Ca 0.02 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.80 3k0t n THR 40 Cb 0.60 -0.24 0.00 0.00 -2.10 0.00 0.00 70.33 68.59 3k0t n THR 40 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 3k0t n GLU 42 N 0.00 0.00 -2.65 -0.78 1.02 -1.26 -4.99 120.64 111.99 3k0t n GLU 42 Ca 0.00 0.00 -0.39 0.00 -0.02 0.00 0.00 57.16 56.75 3k0t n GLU 42 Cb 0.00 0.00 -0.05 0.00 -0.02 0.00 0.00 31.44 31.37 3k0t n GLU 42 CO 0.00 0.00 0.00 -0.51 1.18 0.00 0.00 177.13 177.80 3k0t s LEU 43 N 0.00 4.50 0.55 -4.62 1.43 -1.26 -1.25 118.68 118.04 3k0t s LEU 43 Ca 0.00 2.04 -0.17 0.00 -1.03 0.00 0.00 54.13 54.97 3k0t s LEU 43 Cb 0.00 -3.75 -0.06 0.00 0.03 0.00 0.00 46.19 42.41 3k0t s LEU 43 CO 0.00 -0.05 1.03 0.68 0.23 0.00 0.00 176.35 178.24 3k0t s VAL 44 N -1.31 3.98 0.07 -1.59 -7.23 -0.85 -4.90 120.40 108.57 3k0t s VAL 44 Ca 0.46 1.01 -0.19 0.00 -1.81 0.00 0.00 61.98 61.44 3k0t s VAL 44 Cb -0.26 -3.48 -0.07 0.00 0.56 0.00 0.00 36.38 33.13 3k0t s VAL 44 CO 0.33 -0.48 0.57 -1.61 -0.31 0.00 0.00 175.10 173.60 3k0t s GLU 45 N -3.87 4.21 0.00 4.82 0.41 -1.26 -4.67 118.70 118.34 3k0t s GLU 45 Ca 0.63 0.74 0.00 0.00 -0.41 0.00 0.00 54.97 55.94 3k0t s GLU 45 Cb -0.14 -3.24 0.00 0.00 -1.78 0.00 0.00 34.13 28.97 3k0t s GLU 45 CO 0.31 0.64 0.00 0.41 -0.49 0.00 0.00 175.26 176.13 3k0t n GLY 46 N 1.72 1.69 0.27 -1.39 0.00 -1.26 -4.56 105.19 101.66 3k0t n GLY 46 Ca -0.10 -1.48 -0.06 0.00 0.00 0.00 0.00 46.02 44.38 3k0t n GLY 46 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 173.32 174.51 3k0t h ILE 47 N 0.00 1.21 -0.37 -0.61 6.09 -1.99 0.33 117.51 122.17 3k0t h ILE 47 Ca 0.00 -0.54 -0.01 0.00 -1.37 0.00 0.00 64.86 62.93 3k0t h ILE 47 Cb 0.00 0.37 -0.02 0.00 0.47 0.00 0.00 36.82 37.65 3k0t h ILE 47 CO 0.00 0.23 0.18 -0.33 -3.07 0.00 0.00 178.15 175.16 3k0t h GLU 48 N 0.89 0.53 -0.33 2.19 3.07 -1.98 0.65 114.58 119.60 3k0t h GLU 48 Ca 0.23 -0.08 -0.06 0.00 -0.50 0.00 0.00 59.36 58.95 3k0t h GLU 48 Cb 0.06 -0.10 -0.02 0.00 -0.84 0.00 0.00 28.75 27.86 3k0t h GLU 48 CO -0.03 0.47 -0.06 0.00 -1.40 0.00 0.00 179.01 177.99 3k0t h ALA 49 N 1.03 1.28 -0.22 3.43 0.00 -1.75 -0.37 119.26 122.66 3k0t h ALA 49 Ca 0.13 -0.24 -0.11 0.00 0.00 0.00 0.00 54.91 54.68 3k0t h ALA 49 Cb 0.12 -0.15 -0.00 0.00 0.00 0.00 0.00 17.79 17.76 3k0t h ALA 49 CO -0.02 0.48 -0.30 1.96 0.00 0.00 0.00 179.25 181.38 3k0t h GLN 50 N 0.50 0.60 -0.42 0.00 4.20 -0.42 0.10 115.11 119.67 3k0t h GLN 50 Ca 0.10 -0.34 -0.00 0.00 0.06 0.00 0.00 58.65 58.46 3k0t h GLN 50 Cb 0.42 0.03 -0.02 0.00 0.30 0.00 0.00 27.48 28.21 3k0t h GLN 50 CO 0.02 0.95 0.25 0.82 -0.67 0.00 0.00 178.83 180.20 3k0t h ILE 51 N 0.29 1.14 -0.71 2.54 2.04 -0.69 -1.05 117.51 121.07 3k0t h ILE 51 Ca 0.03 -0.34 -0.04 0.00 1.00 0.00 0.00 64.86 65.51 3k0t h ILE 51 Cb 0.87 0.60 -0.03 0.00 -0.74 0.00 0.00 36.82 37.52 3k0t h ILE 51 CO 0.07 0.14 0.29 0.74 0.00 0.00 0.00 178.15 179.39 3k0t h THR 52 N 0.56 1.25 -0.54 -0.27 2.02 -1.00 -2.08 112.91 112.84 3k0t h THR 52 Ca 0.15 -0.77 -0.07 0.00 0.77 0.00 0.00 66.41 66.49 3k0t h THR 52 Cb 0.01 0.42 -0.02 0.00 -1.74 0.00 0.00 68.15 66.82 3k0t h THR 52 CO -0.03 0.31 0.04 -0.61 0.37 0.00 0.00 175.52 175.60 3k0t h GLN 53 N 1.02 0.89 -0.69 6.66 5.75 -0.37 -0.46 115.11 127.90 3k0t h GLN 53 Ca 0.24 -0.24 -0.05 0.00 -0.15 0.00 0.00 58.65 58.45 3k0t h GLN 53 Cb 0.21 -0.10 -0.03 0.00 1.07 0.00 0.00 27.48 28.62 3k0t h GLN 53 CO -0.02 0.86 0.24 0.28 -2.65 0.00 0.00 178.83 177.54 3k0t h VAL 54 N 0.83 1.25 -0.58 2.39 2.07 -0.84 -0.11 116.25 121.26 3k0t h VAL 54 Ca 0.16 -0.84 -0.11 0.00 0.82 0.00 0.00 66.70 66.73 3k0t h VAL 54 Cb 0.44 0.49 -0.02 0.00 -1.52 0.00 0.00 31.29 30.68 3k0t h VAL 54 CO 0.02 0.33 -0.06 -0.26 0.02 0.00 0.00 177.57 177.62 3k0t h PHE 55 N 1.01 1.17 -0.57 1.57 0.04 -1.02 -0.87 116.94 118.27 3k0t h PHE 55 Ca 0.23 -0.22 -0.02 0.00 2.80 0.00 0.00 57.97 60.76 3k0t h PHE 55 Cb 0.27 -0.30 -0.03 0.00 2.20 0.00 0.00 35.95 38.09 3k0t h PHE 55 CO 0.02 1.05 0.29 0.93 -0.60 0.00 0.00 178.31 180.01 3k0t h GLU 56 N 0.96 0.81 -0.39 1.51 4.39 -0.79 0.14 114.58 121.20 3k0t h GLU 56 Ca 0.16 -0.11 -0.01 0.00 0.34 0.00 0.00 59.36 59.73 3k0t h GLU 56 Cb 0.63 -0.15 -0.02 0.00 -0.10 0.00 0.00 28.75 29.11 3k0t h GLU 56 CO 0.04 0.65 0.19 -0.91 -1.16 0.00 0.00 179.01 177.81 3k0t h ASN 57 N 0.78 0.51 -0.31 1.42 2.35 -0.80 -0.86 115.58 118.66 3k0t h ASN 57 Ca 0.20 -0.13 -0.08 0.00 -0.55 0.00 0.00 56.30 55.74 3k0t h ASN 57 Cb 0.09 -0.13 -0.02 0.00 0.05 0.00 0.00 38.32 38.31 3k0t h ASN 57 CO -0.03 0.50 -0.07 -0.07 -1.65 0.00 0.00 177.43 176.11 3k0t h LEU 58 N 0.49 0.69 -0.64 1.61 3.38 -0.95 -2.50 115.31 117.40 3k0t h LEU 58 Ca 0.13 -0.18 -0.02 0.00 0.09 0.00 0.00 57.88 57.90 3k0t h LEU 58 Cb 0.12 -0.18 -0.03 0.00 0.09 0.00 0.00 40.66 40.66 3k0t h LEU 58 CO -0.02 0.80 0.32 0.50 0.09 0.00 0.00 178.44 180.14 3k0t h LYS 59 N 0.65 0.91 -0.95 1.13 3.64 -0.34 -0.18 116.57 121.43 3k0t h LYS 59 Ca 0.12 -0.12 0.01 0.00 -1.27 0.00 0.00 60.65 59.39 3k0t h LYS 59 Cb 0.51 -0.17 -0.05 0.00 -0.41 0.00 0.00 32.23 32.11 3k0t h LYS 59 CO 0.03 0.71 0.63 0.77 -2.27 0.00 0.00 179.45 179.32 3k0t h SER 60 N 0.88 1.09 -0.18 4.20 0.02 -0.88 -0.73 113.55 117.94 3k0t h SER 60 Ca 0.22 -0.03 -0.13 0.00 -0.84 0.00 0.00 61.79 61.01 3k0t h SER 60 Cb 0.09 -0.27 0.00 0.00 0.14 0.00 0.00 62.40 62.36 3k0t h SER 60 CO -0.03 0.78 -0.40 0.58 -1.14 0.00 0.00 176.83 176.62 3k0t h VAL 61 N 1.28 1.33 -0.83 2.27 2.07 -1.13 -2.29 116.25 118.96 3k0t h VAL 61 Ca 0.35 -1.64 0.05 0.00 0.82 0.00 0.00 66.70 66.28 3k0t h VAL 61 Cb -0.13 1.91 -0.06 0.00 -1.52 0.00 0.00 31.29 31.50 3k0t h VAL 61 CO -0.08 0.51 0.52 0.00 0.02 0.00 0.00 177.57 178.54 3k0t h ALA 62 N 0.58 1.12 -0.64 1.67 0.00 -0.79 -1.66 119.26 119.55 3k0t h ALA 62 Ca 0.00 -0.02 -0.08 0.00 0.00 0.00 0.00 54.91 54.81 3k0t h ALA 62 Cb 1.01 -0.25 -0.03 0.00 0.00 0.00 0.00 17.79 18.52 3k0t h ALA 62 CO 0.09 0.30 0.08 1.96 0.00 0.00 0.00 179.25 181.68 3k0t h GLN 63 N 0.98 1.06 0.00 0.00 4.20 -1.06 -0.98 115.11 119.31 3k0t h GLN 63 Ca 0.35 -0.29 -0.01 0.00 0.06 0.00 0.00 58.65 58.76 3k0t h GLN 63 Cb 0.10 -0.12 -0.00 0.00 0.30 0.00 0.00 27.48 27.76 3k0t h GLN 63 CO -0.15 0.99 -0.06 0.00 -0.67 0.00 0.00 178.83 178.94 3k0t h ALA 64 N 1.08 1.20 -0.22 3.87 0.00 -0.78 -0.64 119.26 123.77 3k0t h ALA 64 Ca 0.19 -0.05 0.00 0.00 0.00 0.00 0.00 54.91 55.05 3k0t h ALA 64 Cb 0.46 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.24 3k0t h ALA 64 CO 0.02 0.07 0.00 0.00 0.00 0.00 0.00 179.25 179.34 3k0t n ALA 65 N -2.21 2.50 -1.42 0.00 0.00 -0.69 -4.79 120.51 113.90 3k0t n ALA 65 Ca -0.02 -0.58 -0.04 0.00 0.00 0.00 0.00 53.44 52.80 3k0t n ALA 65 Cb 0.19 -1.05 -0.01 0.00 0.00 0.00 0.00 19.45 18.57 3k0t n ALA 65 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3k0t n GLY 66 N 1.15 0.55 0.00 0.00 0.00 -0.25 -5.01 105.19 101.63 3k0t n GLY 66 Ca 0.16 -0.83 0.00 0.00 0.00 0.00 0.00 46.02 45.35 3k0t n GLY 66 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3k0t n GLY 67 N -2.02 5.71 3.83 -0.02 0.00 -0.44 -5.02 105.19 107.22 3k0t n GLY 67 Ca -0.04 -1.52 -0.07 0.00 0.00 0.00 0.00 46.02 44.39 3k0t n GLY 67 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 3k0t s SER 68 N 1.00 0.03 0.58 1.61 1.04 -1.26 -3.77 113.70 112.93 3k0t s SER 68 Ca 0.00 -1.07 0.39 0.00 0.48 0.00 0.00 55.95 55.75 3k0t s SER 68 Cb 0.00 0.76 2.09 0.00 0.10 0.00 0.00 66.02 68.97 3k0t s SER 68 CO 0.00 -1.52 2.19 -0.26 0.98 0.00 0.00 173.24 174.62 3k0t h PHE 69 N 2.00 0.00 0.00 5.02 -1.00 -1.93 -0.50 116.94 120.53 3k0t h PHE 69 Ca -0.32 0.00 -0.03 0.00 2.81 0.00 0.00 57.97 60.43 3k0t h PHE 69 Cb 1.24 0.00 -0.00 0.00 3.61 0.00 0.00 35.95 40.80 3k0t h PHE 69 CO 1.49 0.00 -0.16 0.87 -1.61 0.00 0.00 178.31 178.91 3k0t h LYS 70 N 0.00 0.00 -0.01 1.51 1.57 -1.95 -2.63 116.57 115.07 3k0t h LYS 70 Ca 0.00 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 3k0t h LYS 70 Cb 0.03 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.34 3k0t h LYS 70 CO 0.00 0.16 -0.17 -0.25 -0.57 0.00 0.00 179.45 178.62 3k0t n ASP 71 N -3.91 1.10 -4.68 0.86 8.00 -0.20 -4.88 116.55 112.85 3k0t n ASP 71 Ca -0.02 -1.04 -0.42 0.00 0.71 0.00 0.00 54.79 54.02 3k0t n ASP 71 Cb 0.25 0.08 -0.03 0.00 -0.02 0.00 0.00 41.12 41.40 3k0t n ASP 71 CO 0.00 0.00 0.00 -0.63 -0.39 0.00 0.00 177.20 176.18 3k0t s ILE 72 N -2.35 4.07 -0.12 0.53 1.01 -0.99 -0.60 121.20 122.75 3k0t s ILE 72 Ca 0.29 1.39 0.19 0.00 0.00 0.00 0.00 60.65 62.52 3k0t s ILE 72 Cb 0.20 -3.90 -0.28 0.00 0.01 0.00 0.00 42.46 38.49 3k0t s ILE 72 CO 0.46 -0.04 0.25 1.33 0.00 0.00 0.00 174.94 176.94 3k0t n VAL 73 N 4.85 0.71 -3.80 2.92 0.24 -0.09 -4.28 118.33 118.87 3k0t n VAL 73 Ca 0.13 -0.66 -0.13 0.00 -2.04 0.00 0.00 64.34 61.63 3k0t n VAL 73 Cb 0.45 -0.25 -0.13 0.00 -1.47 0.00 0.00 33.84 32.44 3k0t n VAL 73 CO 0.00 0.00 0.00 -0.75 -2.14 0.00 0.00 176.83 173.94 3k0t s LYS 74 N -2.93 0.14 -0.05 7.34 2.47 -1.19 -0.33 119.74 125.19 3k0t s LYS 74 Ca -0.09 0.23 0.02 0.00 -1.56 0.00 0.00 55.97 54.58 3k0t s LYS 74 Cb 0.09 0.01 0.01 0.00 -1.46 0.00 0.00 37.83 36.48 3k0t s LYS 74 CO 0.83 -0.06 -0.09 -1.17 0.16 0.00 0.00 175.35 175.03 3k0t s LEU 75 N 0.37 1.58 -0.14 5.43 2.96 -0.31 -1.27 118.68 127.30 3k0t s LEU 75 Ca -0.02 -0.20 -0.03 0.00 -0.22 0.00 0.00 54.13 53.65 3k0t s LEU 75 Cb -0.04 -0.61 -0.03 0.00 0.50 0.00 0.00 46.19 46.02 3k0t s LEU 75 CO -0.02 0.01 -0.04 0.20 -1.32 0.00 0.00 176.35 175.19 3k0t s ASN 76 N 0.60 4.78 -0.19 3.68 0.02 -0.33 -1.79 114.94 121.71 3k0t s ASN 76 Ca -0.10 -0.11 -0.03 0.00 -1.02 0.00 0.00 52.86 51.60 3k0t s ASN 76 Cb -0.13 -1.72 -0.01 0.00 0.02 0.00 0.00 41.25 39.41 3k0t s ASN 76 CO 0.02 0.19 -0.07 -0.63 0.02 0.00 0.00 177.10 176.63 3k0t s ILE 77 N 0.21 3.25 -0.22 0.60 1.01 0.32 -2.52 121.20 123.85 3k0t s ILE 77 Ca -0.02 -0.55 -0.01 0.00 0.00 0.00 0.00 60.65 60.06 3k0t s ILE 77 Cb -0.14 -2.44 0.01 0.00 0.01 0.00 0.00 42.46 39.90 3k0t s ILE 77 CO 0.03 0.46 -0.10 -0.36 0.00 0.00 0.00 174.94 174.96 3k0t s PHE 78 N 1.15 2.94 -0.03 3.97 0.08 0.24 -2.09 117.98 124.24 3k0t s PHE 78 Ca 0.02 -1.38 0.06 0.00 0.12 0.00 0.00 56.93 55.74 3k0t s PHE 78 Cb -0.14 -2.03 -0.01 0.00 -0.57 0.00 0.00 43.02 40.27 3k0t s PHE 78 CO -0.02 -0.70 -0.20 -0.51 -0.10 0.00 0.00 175.22 173.70 3k0t s LEU 79 N 1.36 2.00 0.44 -0.37 1.43 -0.90 -1.24 118.68 121.40 3k0t s LEU 79 Ca 0.04 -0.38 0.24 0.00 -1.03 0.00 0.00 54.13 53.00 3k0t s LEU 79 Cb -0.15 -1.06 0.61 0.00 0.03 0.00 0.00 46.19 45.62 3k0t s LEU 79 CO -0.07 0.21 1.70 0.71 0.23 0.00 0.00 176.35 179.13 3k0t h THR 80 N 4.91 0.19 -2.90 5.49 1.35 -1.55 0.15 112.91 120.55 3k0t h THR 80 Ca -0.36 -1.08 -0.52 0.00 -0.55 0.00 0.00 66.41 63.91 3k0t h THR 80 Cb 1.16 1.92 -0.40 0.00 -1.73 0.00 0.00 68.15 69.10 3k0t h THR 80 CO 0.48 0.10 -0.77 -0.62 -0.25 0.00 0.00 175.52 174.45 3k0t s ASP 81 N -6.12 3.24 0.00 5.36 -1.08 -1.26 -4.64 116.67 112.16 3k0t s ASP 81 Ca 0.04 -1.12 0.04 0.00 -0.52 0.00 0.00 52.55 51.00 3k0t s ASP 81 Cb 0.07 -0.36 0.20 0.00 -1.46 0.00 0.00 42.92 41.36 3k0t s ASP 81 CO 0.65 -0.41 1.13 0.18 0.52 0.00 0.00 175.17 177.24 3k0t n LEU 82 N 5.23 0.00 0.24 -1.34 4.77 -1.26 -1.06 117.00 123.57 3k0t n LEU 82 Ca -0.06 0.48 0.16 0.00 -0.03 0.00 0.00 56.01 56.57 3k0t n LEU 82 Cb 0.44 -0.48 0.81 0.00 -2.33 0.00 0.00 43.42 41.85 3k0t n LEU 82 CO 0.06 -0.41 0.99 1.23 -1.33 0.00 0.00 177.39 177.93 3k0t h GLY 83 N 0.77 0.00 -1.51 -0.72 0.00 -1.98 -1.04 103.07 98.59 3k0t h GLY 83 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 3k0t h GLY 83 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 176.54 177.96 3k0t n HIS 84 N -2.69 0.23 -0.28 5.60 8.25 -0.23 -4.43 115.22 121.68 3k0t n HIS 84 Ca -0.01 -0.12 -0.00 0.00 -0.26 0.00 0.00 57.72 57.33 3k0t n HIS 84 Cb 0.13 0.00 0.20 0.00 1.12 0.00 0.00 29.99 31.44 3k0t n HIS 84 CO 0.00 0.00 0.00 0.35 0.64 0.00 0.00 176.34 177.33 3k0t h PHE 85 N 3.53 1.06 -0.18 4.41 3.57 -1.36 -1.34 116.94 126.63 3k0t h PHE 85 Ca 0.00 0.03 -0.04 0.00 3.53 0.00 0.00 57.97 61.48 3k0t h PHE 85 Cb 0.77 -0.36 -0.01 0.00 2.79 0.00 0.00 35.95 39.14 3k0t h PHE 85 CO 0.12 0.66 -0.08 0.00 -2.23 0.00 0.00 178.31 176.78 3k0t h ALA 86 N 1.47 1.53 -0.37 2.41 0.00 -1.79 -1.02 119.26 121.49 3k0t h ALA 86 Ca 0.31 -0.18 -0.13 0.00 0.00 0.00 0.00 54.91 54.91 3k0t h ALA 86 Cb -0.12 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 17.57 3k0t h ALA 86 CO -0.07 0.34 -0.31 -0.22 0.00 0.00 0.00 179.25 178.99 3k0t h LYS 87 N 0.27 0.81 -0.17 0.00 1.63 -1.56 -0.70 116.57 116.85 3k0t h LYS 87 Ca 0.06 -0.37 -0.01 0.00 -0.85 0.00 0.00 60.65 59.48 3k0t h LYS 87 Cb 0.32 -0.01 -0.01 0.00 -0.60 0.00 0.00 32.23 31.93 3k0t h LYS 87 CO 0.02 1.00 0.08 0.28 -3.45 0.00 0.00 179.45 177.38 3k0t h VAL 88 N 0.68 1.12 -0.90 2.00 2.07 -0.77 -1.27 116.25 119.19 3k0t h VAL 88 Ca 0.08 -0.36 0.09 0.00 0.82 0.00 0.00 66.70 67.33 3k0t h VAL 88 Cb 0.85 1.05 -0.07 0.00 -1.52 0.00 0.00 31.29 31.60 3k0t h VAL 88 CO 0.07 0.12 0.55 0.78 0.02 0.00 0.00 177.57 179.11 3k0t h ASN 89 N 0.15 0.82 0.07 0.57 -0.26 -0.96 -2.76 115.58 113.22 3k0t h ASN 89 Ca 0.06 0.04 -0.00 0.00 -0.56 0.00 0.00 56.30 55.83 3k0t h ASN 89 Cb 0.11 -0.12 0.00 0.00 -1.06 0.00 0.00 38.32 37.25 3k0t h ASN 89 CO -0.01 0.47 -0.03 -0.08 -1.06 0.00 0.00 177.43 176.72 3k0t h GLU 90 N 0.92 -0.09 -2.36 0.81 4.81 -0.82 -3.17 114.58 114.68 3k0t h GLU 90 Ca 0.43 0.01 -0.02 0.00 -0.13 0.00 0.00 59.36 59.65 3k0t h GLU 90 Cb 0.35 0.02 -0.01 0.00 0.63 0.00 0.00 28.75 29.74 3k0t h GLU 90 CO -0.23 0.21 0.14 -0.89 -0.73 0.00 0.00 179.01 177.50 3k0t n ILE 91 N -4.99 0.53 0.00 2.32 5.41 -0.50 -4.05 119.36 118.07 3k0t n ILE 91 Ca -0.08 -0.20 0.00 0.00 1.00 0.00 0.00 62.75 63.46 3k0t n ILE 91 Cb 0.19 -1.33 0.00 0.00 -0.71 0.00 0.00 39.64 37.78 3k0t n ILE 91 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 176.55 177.16 3k0t n GLY 93 N 2.35 0.00 0.70 7.39 0.00 -1.20 -3.51 105.19 110.92 3k0t n GLY 93 Ca 0.04 0.00 0.11 0.00 0.00 0.00 0.00 46.02 46.18 3k0t n GLY 93 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 3k0t n SER 94 N 0.00 2.46 0.00 1.61 2.88 -1.26 -4.45 113.62 114.86 3k0t n SER 94 Ca 0.00 -1.73 0.00 0.00 -1.33 0.00 0.00 58.87 55.81 3k0t n SER 94 Cb 0.00 0.27 0.00 0.00 -0.75 0.00 0.00 64.21 63.73 3k0t n SER 94 CO 0.00 0.00 0.00 -1.22 -1.23 0.00 0.00 175.04 172.59 3k0t n TYR 95 N 0.58 0.00 -4.13 0.66 4.01 -1.23 -5.09 117.16 111.96 3k0t n TYR 95 Ca 0.11 0.00 -0.12 0.00 -0.16 0.00 0.00 57.90 57.73 3k0t n TYR 95 Cb 0.53 0.00 -0.11 0.00 -0.31 0.00 0.00 39.34 39.45 3k0t n TYR 95 CO 0.00 0.00 0.00 -0.06 -0.46 0.00 0.00 176.86 176.34 3k0t s PHE 96 N -1.24 0.85 0.28 -0.72 0.08 -1.26 -4.85 117.98 111.13 3k0t s PHE 96 Ca 0.00 -0.72 -0.07 0.00 0.12 0.00 0.00 56.93 56.26 3k0t s PHE 96 Cb 0.00 -0.49 -0.01 0.00 -0.57 0.00 0.00 43.02 41.95 3k0t s PHE 96 CO 0.00 -0.10 0.43 -1.54 -0.10 0.00 0.00 175.22 173.91 3k0t s SER 97 N -2.41 0.36 0.31 1.36 1.04 -1.26 -4.66 113.70 108.44 3k0t s SER 97 Ca 0.03 -1.23 -0.29 0.00 0.48 0.00 0.00 55.95 54.94 3k0t s SER 97 Cb -0.02 0.59 -0.10 0.00 0.10 0.00 0.00 66.02 66.59 3k0t s SER 97 CO -0.02 -1.16 1.37 -1.10 0.98 0.00 0.00 173.24 173.31 3k0t s GLN 98 N -3.63 4.30 -0.06 4.02 -0.21 -1.26 -3.44 119.66 119.38 3k0t s GLN 98 Ca 0.28 2.29 -0.29 0.00 0.02 0.00 0.00 55.36 57.66 3k0t s GLN 98 Cb 0.01 -3.07 -0.02 0.00 1.00 0.00 0.00 33.01 30.93 3k0t s GLN 98 CO 0.14 -0.30 0.96 -1.25 -2.12 0.00 0.00 175.29 172.72 3k0t s PRO 99 N -1.41 4.47 0.61 2.91 0.04 -1.26 -5.16 135.00 135.19 3k0t s PRO 99 Ca 0.52 1.34 -0.14 0.00 0.04 0.00 0.00 61.00 62.77 3k0t s PRO 99 Cb -0.41 -3.50 -0.03 0.00 0.04 0.00 0.00 34.50 30.59 3k0t s PRO 99 CO 0.51 -0.18 1.04 0.71 0.04 0.00 0.00 177.00 179.12 3k0t s TYR 100 N 1.53 3.24 0.75 0.56 2.02 -1.22 -5.01 117.35 119.22 3k0t s TYR 100 Ca 0.48 1.44 -0.11 0.00 -0.37 0.00 0.00 57.07 58.51 3k0t s TYR 100 Cb -0.19 -2.87 0.04 0.00 -0.40 0.00 0.00 41.96 38.54 3k0t s TYR 100 CO 0.22 -0.92 1.08 -2.14 -1.57 0.00 0.00 175.55 172.22 3k0t s PRO 101 N -4.56 2.44 0.72 -1.71 0.02 -1.26 -5.01 135.00 125.64 3k0t s PRO 101 Ca 0.59 1.07 -0.11 0.00 0.02 0.00 0.00 61.00 62.57 3k0t s PRO 101 Cb -0.13 -1.92 0.02 0.00 0.02 0.00 0.00 34.50 32.48 3k0t s PRO 101 CO 0.44 -1.49 1.07 0.00 -0.33 0.00 0.00 177.00 176.70 3k0t s ALA 102 N -2.96 2.66 0.11 -1.55 0.00 0.55 -4.87 121.76 115.70 3k0t s ALA 102 Ca 0.60 -0.12 -0.25 0.00 0.00 0.00 0.00 51.96 52.20 3k0t s ALA 102 Cb -0.16 -3.11 0.07 0.00 0.00 0.00 0.00 23.12 19.93 3k0t s ALA 102 CO 0.56 -1.27 0.65 -0.98 0.00 0.00 0.00 175.76 174.71 3k0t s ARG 103 N -5.16 1.19 0.06 0.00 1.70 -1.26 -1.16 118.95 114.31 3k0t s ARG 103 Ca 0.58 -0.35 0.05 0.00 -0.47 0.00 0.00 55.73 55.55 3k0t s ARG 103 Cb -0.13 0.55 -0.03 0.00 -0.57 0.00 0.00 34.95 34.77 3k0t s ARG 103 CO 0.54 -0.50 -0.15 0.00 -1.08 0.00 0.00 175.30 174.11 3k0t s ALA 104 N -3.32 1.26 -0.06 7.88 0.00 -0.74 -4.95 121.76 121.82 3k0t s ALA 104 Ca -0.00 -0.95 -0.03 0.00 0.00 0.00 0.00 51.96 50.98 3k0t s ALA 104 Cb -0.01 -0.16 0.04 0.00 0.00 0.00 0.00 23.12 22.99 3k0t s ALA 104 CO -0.09 0.22 0.13 0.00 0.00 0.00 0.00 175.76 176.01 3k0t s ALA 105 N -1.06 -0.14 0.06 0.00 0.00 -1.26 -0.52 121.76 118.83 3k0t s ALA 105 Ca 0.01 0.55 0.02 0.00 0.00 0.00 0.00 51.96 52.53 3k0t s ALA 105 Cb -0.09 -0.56 -0.03 0.00 0.00 0.00 0.00 23.12 22.44 3k0t s ALA 105 CO 0.02 -0.31 -0.06 0.96 0.00 0.00 0.00 175.76 176.37 3k0t s ILE 106 N 1.60 0.50 -0.22 0.00 -4.36 -0.89 -5.01 121.20 112.82 3k0t s ILE 106 Ca -0.04 -1.35 -0.16 0.00 -0.26 0.00 0.00 60.65 58.84 3k0t s ILE 106 Cb -0.12 -0.93 -0.04 0.00 1.25 0.00 0.00 42.46 42.62 3k0t s ILE 106 CO -0.05 -0.58 0.43 -0.83 0.24 0.00 0.00 174.94 174.14 3k0t s GLY 107 N -2.07 2.00 0.34 6.27 0.00 -1.26 -2.12 107.32 110.48 3k0t s GLY 107 Ca -0.03 -0.58 0.07 0.00 0.00 0.00 0.00 44.72 44.18 3k0t s GLY 107 CO -0.02 0.95 0.33 -1.34 0.00 0.00 0.00 173.10 173.02 3k0t s VAL 108 N 1.66 3.63 0.11 1.40 -7.23 0.51 -4.94 120.40 115.54 3k0t s VAL 108 Ca 0.19 -1.28 -0.10 0.00 -1.81 0.00 0.00 61.98 58.98 3k0t s VAL 108 Cb -0.15 -3.23 -0.17 0.00 0.56 0.00 0.00 36.38 33.39 3k0t s VAL 108 CO 0.09 -0.17 1.30 0.00 -0.31 0.00 0.00 175.10 176.01 3k0t h ALA 109 N 1.16 0.32 -2.75 1.32 0.00 -1.90 -3.39 119.26 114.02 3k0t h ALA 109 Ca -0.45 -0.64 0.06 0.00 0.00 0.00 0.00 54.91 53.88 3k0t h ALA 109 Cb 1.25 -0.00 -0.10 0.00 0.00 0.00 0.00 17.79 18.94 3k0t h ALA 109 CO 0.57 0.72 0.32 0.00 0.00 0.00 0.00 179.25 180.86 3k0t s ALA 110 N -3.54 -1.56 0.07 0.00 0.00 -1.26 -4.99 121.76 110.49 3k0t s ALA 110 Ca -0.09 0.33 0.03 0.00 0.00 0.00 0.00 51.96 52.23 3k0t s ALA 110 Cb 0.09 0.74 -0.03 0.00 0.00 0.00 0.00 23.12 23.92 3k0t s ALA 110 CO 0.89 -0.87 -0.09 -0.51 0.00 0.00 0.00 175.76 175.19 3k0t s LEU 111 N -2.77 2.35 0.18 0.00 1.43 -1.26 -5.01 118.68 113.60 3k0t s LEU 111 Ca 0.06 -0.72 -0.32 0.00 -1.03 0.00 0.00 54.13 52.12 3k0t s LEU 111 Cb -0.02 -0.20 -0.16 0.00 0.03 0.00 0.00 46.19 45.84 3k0t s LEU 111 CO -0.05 -0.27 1.03 -2.65 0.23 0.00 0.00 176.35 174.65 3k0t n PRO 112 N 0.89 0.93 -1.09 1.29 -0.02 -1.26 -1.71 135.00 134.03 3k0t n PRO 112 Ca -0.19 0.33 -0.03 0.00 -2.02 0.00 0.00 63.50 61.59 3k0t n PRO 112 Cb 0.57 -1.73 -0.01 0.00 -0.02 0.00 0.00 33.50 32.30 3k0t n PRO 112 CO 0.00 0.00 0.00 0.54 1.98 0.00 0.00 175.50 178.02 3k0t n ARG 113 N 1.44 -1.27 -1.04 -0.52 1.74 -1.26 -2.39 116.66 113.36 3k0t n ARG 113 Ca 0.15 0.48 0.00 0.00 -0.77 0.00 0.00 57.85 57.71 3k0t n ARG 113 Cb 0.25 -4.51 0.00 0.00 -1.02 0.00 0.00 32.46 27.17 3k0t n ARG 113 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 3k0t n GLY 114 N -0.51 0.40 3.75 -0.13 0.00 -0.69 -4.99 105.19 103.02 3k0t n GLY 114 Ca -0.03 -1.06 -0.36 0.00 0.00 0.00 0.00 46.02 44.57 3k0t n GLY 114 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3k0t s ALA 115 N -2.00 2.46 -0.44 4.61 0.00 -1.00 -4.92 121.76 120.47 3k0t s ALA 115 Ca 0.00 1.00 0.23 0.00 0.00 0.00 0.00 51.96 53.18 3k0t s ALA 115 Cb 0.00 -3.46 -0.05 0.00 0.00 0.00 0.00 23.12 19.61 3k0t s ALA 115 CO 0.00 -1.32 0.92 1.04 0.00 0.00 0.00 175.76 176.40 3k0t n GLN 116 N -1.82 0.41 -3.75 0.00 6.02 -1.26 -4.14 117.38 112.85 3k0t n GLN 116 Ca 0.14 -0.02 -0.13 0.00 -0.01 0.00 0.00 57.00 56.98 3k0t n GLN 116 Cb 0.50 -1.62 -0.10 0.00 1.02 0.00 0.00 30.24 30.04 3k0t n GLN 116 CO 0.00 0.00 0.00 0.54 -1.01 0.00 0.00 177.06 176.59 3k0t s VAL 117 N -3.29 0.02 0.32 5.09 0.11 -1.26 -1.79 120.40 119.60 3k0t s VAL 117 Ca 0.01 -0.16 0.04 0.00 -2.93 0.00 0.00 61.98 58.93 3k0t s VAL 117 Cb 0.13 -0.56 -0.02 0.00 -1.53 0.00 0.00 36.38 34.40 3k0t s VAL 117 CO 0.82 -0.09 0.32 -0.70 -3.33 0.00 0.00 175.10 172.12 3k0t s GLU 118 N -0.37 1.74 0.20 1.54 2.12 -0.37 -4.06 118.70 119.49 3k0t s GLU 118 Ca -0.05 -1.90 -0.23 0.00 0.36 0.00 0.00 54.97 53.15 3k0t s GLU 118 Cb -0.03 0.35 0.06 0.00 0.26 0.00 0.00 34.13 34.76 3k0t s GLU 118 CO 0.02 -0.66 0.91 0.16 -0.54 0.00 0.00 175.26 175.16 3k0t s ASP 120 N -3.31 -0.15 0.21 -1.70 1.47 -1.05 -0.59 116.67 111.55 3k0t s ASP 120 Ca 0.38 -0.55 -0.23 0.00 1.18 0.00 0.00 52.55 53.33 3k0t s ASP 120 Cb 0.02 0.57 0.05 0.00 -0.34 0.00 0.00 42.92 43.21 3k0t s ASP 120 CO 0.24 -1.07 0.70 0.00 0.68 0.00 0.00 175.17 175.72 3k0t s ALA 121 N -3.15 -1.44 -0.07 2.11 0.00 -1.26 -1.19 121.76 116.77 3k0t s ALA 121 Ca 0.14 0.11 0.04 0.00 0.00 0.00 0.00 51.96 52.25 3k0t s ALA 121 Cb -0.03 0.83 0.00 0.00 0.00 0.00 0.00 23.12 23.92 3k0t s ALA 121 CO 0.04 -0.91 -0.20 0.42 0.00 0.00 0.00 175.76 175.11 3k0t s ILE 122 N -3.76 1.70 -0.06 0.00 1.01 -0.39 -4.68 121.20 115.01 3k0t s ILE 122 Ca 0.07 -0.83 0.02 0.00 0.00 0.00 0.00 60.65 59.90 3k0t s ILE 122 Cb -0.03 -1.47 -0.03 0.00 0.01 0.00 0.00 42.46 40.94 3k0t s ILE 122 CO -0.02 0.48 -0.10 -0.22 0.00 0.00 0.00 174.94 175.08 3k0t s LEU 123 N 0.24 2.98 -0.23 2.97 2.96 -0.10 -0.91 118.68 126.59 3k0t s LEU 123 Ca -0.11 -0.10 0.01 0.00 -0.22 0.00 0.00 54.13 53.70 3k0t s LEU 123 Cb -0.15 -1.63 0.06 0.00 0.50 0.00 0.00 46.19 44.96 3k0t s LEU 123 CO 0.05 0.35 -0.05 -0.69 -1.32 0.00 0.00 176.35 174.68 3k0t s VAL 124 N -0.71 1.49 -2.00 1.68 1.01 0.23 -0.12 120.40 121.97 3k0t s VAL 124 Ca 0.11 -1.17 0.16 0.00 0.00 0.00 0.00 61.98 61.08 3k0t s VAL 124 Cb -0.11 -1.75 0.46 0.00 0.00 0.00 0.00 36.38 34.97 3k0t s VAL 124 CO 0.01 -0.08 1.37 -0.38 0.00 0.00 0.00 175.10 176.02