#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2ctt s SER 2 N 0.00 0.08 0.13 1.61 1.04 -1.26 -5.19 113.70 110.11 2ctt s SER 2 Ca 0.00 -1.01 -0.25 0.00 0.48 0.00 0.00 55.95 55.17 2ctt s SER 2 Cb 0.00 0.71 0.08 0.00 0.10 0.00 0.00 66.02 66.91 2ctt s SER 2 CO 0.00 -1.37 1.07 -0.55 0.98 0.00 0.00 173.24 173.37 2ctt s SER 3 N -3.05 -0.05 0.00 7.02 0.15 -1.26 -5.18 113.70 111.33 2ctt s SER 3 Ca 0.19 -0.49 0.00 0.00 0.70 0.00 0.00 55.95 56.35 2ctt s SER 3 Cb -0.03 0.42 0.00 0.00 -1.71 0.00 0.00 66.02 64.70 2ctt s SER 3 CO 0.11 -0.82 0.00 0.61 1.20 0.00 0.00 173.24 174.34 2ctt n GLY 4 N -0.63 4.59 3.65 9.45 0.00 -1.26 -5.19 105.19 115.79 2ctt n GLY 4 Ca -0.04 -0.78 -0.01 0.00 0.00 0.00 0.00 46.02 45.20 2ctt n GLY 4 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2ctt s SER 5 N 0.00 -0.11 0.03 1.61 1.04 -1.26 -5.19 113.70 109.83 2ctt s SER 5 Ca 0.00 -0.18 -0.28 0.00 0.48 0.00 0.00 55.95 55.97 2ctt s SER 5 Cb 0.00 0.25 0.09 0.00 0.10 0.00 0.00 66.02 66.46 2ctt s SER 5 CO 0.00 -0.45 0.94 -0.44 0.98 0.00 0.00 173.24 174.27 2ctt s SER 6 N -2.88 -0.28 0.00 7.02 0.01 -1.26 -5.19 113.70 111.13 2ctt s SER 6 Ca 0.13 -0.13 0.00 0.00 1.31 0.00 0.00 55.95 57.26 2ctt s SER 6 Cb 0.03 0.39 0.00 0.00 0.21 0.00 0.00 66.02 66.65 2ctt s SER 6 CO -0.03 -0.67 0.00 0.61 0.41 0.00 0.00 173.24 173.56 2ctt n GLY 7 N -0.32 -1.39 3.54 3.44 0.00 -1.26 -5.17 105.19 104.04 2ctt n GLY 7 Ca -0.07 -1.21 -0.13 0.00 0.00 0.00 0.00 46.02 44.61 2ctt n GLY 7 CO 0.00 0.00 0.00 -3.16 0.00 0.00 0.00 173.32 170.16 2ctt s MET 8 N -1.90 0.81 0.26 1.61 0.00 -1.26 -5.19 119.30 113.64 2ctt s MET 8 Ca 0.00 0.11 -0.10 0.00 0.00 0.00 0.00 55.69 55.70 2ctt s MET 8 Cb 0.00 0.38 -0.01 0.00 0.00 0.00 0.00 34.83 35.21 2ctt s MET 8 CO 0.00 -0.27 0.44 -1.83 0.00 0.00 0.00 175.02 173.36 2ctt s GLU 9 N -1.48 1.57 0.22 3.16 4.04 -1.26 -5.19 118.70 119.76 2ctt s GLU 9 Ca -0.04 -1.36 -0.14 0.00 0.04 0.00 0.00 54.97 53.46 2ctt s GLU 9 Cb -0.00 0.45 0.01 0.00 0.02 0.00 0.00 34.13 34.60 2ctt s GLU 9 CO 0.03 -0.64 0.47 -0.48 -1.84 0.00 0.00 175.26 172.79 2ctt s LEU 10 N -3.06 0.34 0.77 1.83 0.05 -1.26 -5.15 118.68 112.19 2ctt s LEU 10 Ca 0.25 -0.76 -0.15 0.00 0.05 0.00 0.00 54.13 53.53 2ctt s LEU 10 Cb 0.00 1.83 0.03 0.00 -2.05 0.00 0.00 46.19 46.00 2ctt s LEU 10 CO 0.11 -1.08 0.94 1.07 -0.55 0.00 0.00 176.35 176.85 2ctt n THR 11 N -0.34 2.16 -3.58 5.48 5.66 -1.26 -5.03 114.28 117.37 2ctt n THR 11 Ca -0.06 -0.30 -0.08 0.00 -3.05 0.00 0.00 64.05 60.56 2ctt n THR 11 Cb 0.62 -1.05 -0.02 0.00 -1.55 0.00 0.00 70.33 68.34 2ctt n THR 11 CO 0.00 0.00 0.00 0.72 -3.05 0.00 0.00 175.07 172.74 2ctt s PHE 12 N -1.99 -0.34 -0.06 1.09 -0.12 -1.26 -5.19 117.98 110.12 2ctt s PHE 12 Ca 0.71 0.10 -0.29 0.00 -0.05 0.00 0.00 56.93 57.40 2ctt s PHE 12 Cb -0.31 0.59 0.10 0.00 -0.63 0.00 0.00 43.02 42.77 2ctt s PHE 12 CO 0.53 -0.80 0.85 0.54 -0.05 0.00 0.00 175.22 176.29 2ctt s ASN 13 N -2.72 -0.46 -0.18 1.98 2.20 -1.26 -5.18 114.94 109.31 2ctt s ASN 13 Ca 0.06 0.34 -0.22 0.00 -0.94 0.00 0.00 52.86 52.10 2ctt s ASN 13 Cb -0.02 0.41 0.06 0.00 -2.00 0.00 0.00 41.25 39.70 2ctt s ASN 13 CO -0.06 -0.54 0.59 -1.58 -2.94 0.00 0.00 177.10 172.57 2ctt s GLN 14 N -1.90 0.75 -0.03 3.55 2.00 -1.26 -5.17 119.66 117.61 2ctt s GLN 14 Ca -0.02 0.68 0.07 0.00 -2.00 0.00 0.00 55.36 54.08 2ctt s GLN 14 Cb -0.01 0.36 -0.02 0.00 0.80 0.00 0.00 33.01 34.15 2ctt s GLN 14 CO -0.00 -0.13 -0.25 0.00 -0.50 0.00 0.00 175.29 174.41 2ctt s ALA 15 N -0.03 2.20 -0.29 1.58 0.00 -1.26 -5.12 121.76 118.85 2ctt s ALA 15 Ca -0.03 -1.09 -0.15 0.00 0.00 0.00 0.00 51.96 50.70 2ctt s ALA 15 Cb -0.04 -0.62 0.10 0.00 0.00 0.00 0.00 23.12 22.57 2ctt s ALA 15 CO 0.02 0.50 0.73 0.00 0.00 0.00 0.00 175.76 177.01 2ctt s ALA 16 N -0.49 -2.00 0.32 0.00 0.00 -1.26 -5.18 121.76 113.15 2ctt s ALA 16 Ca 0.06 2.37 -0.05 0.00 0.00 0.00 0.00 51.96 54.34 2ctt s ALA 16 Cb -0.11 -1.56 0.00 0.00 0.00 0.00 0.00 23.12 21.45 2ctt s ALA 16 CO 0.00 -0.51 0.48 0.15 0.00 0.00 0.00 175.76 175.88 2ctt s LYS 17 N 1.89 1.82 -0.11 0.00 1.02 -1.26 -5.19 119.74 117.91 2ctt s LYS 17 Ca -0.09 -1.62 -0.33 0.00 0.02 0.00 0.00 55.97 53.95 2ctt s LYS 17 Cb -0.06 0.45 0.14 0.00 -0.52 0.00 0.00 37.83 37.84 2ctt s LYS 17 CO -0.19 -0.75 1.33 0.20 -0.92 0.00 0.00 175.35 175.01 2ctt s GLY 18 N -3.18 -0.38 0.01 -3.33 0.00 -1.26 -5.18 107.32 94.00 2ctt s GLY 18 Ca 0.28 1.11 -0.06 0.00 0.00 0.00 0.00 44.72 46.05 2ctt s GLY 18 CO 0.17 0.29 0.11 0.14 0.00 0.00 0.00 173.10 173.80 2ctt s VAL 19 N -2.27 0.10 1.26 1.40 1.01 -1.26 -5.16 120.40 115.48 2ctt s VAL 19 Ca 0.13 -0.82 -0.18 0.00 0.00 0.00 0.00 61.98 61.11 2ctt s VAL 19 Cb 0.04 -0.53 0.31 0.00 0.00 0.00 0.00 36.38 36.20 2ctt s VAL 19 CO -0.05 -0.45 1.02 0.54 0.00 0.00 0.00 175.10 176.16 2ctt s ASN 20 N -1.59 0.32 0.00 3.32 2.20 -1.26 -5.02 114.94 112.92 2ctt s ASN 20 Ca -0.12 0.98 0.00 0.00 -0.94 0.00 0.00 52.86 52.77 2ctt s ASN 20 Cb -0.06 -1.44 0.00 0.00 -2.00 0.00 0.00 41.25 37.74 2ctt s ASN 20 CO -0.00 -4.53 0.00 0.29 -2.94 0.00 0.00 177.10 169.92 2ctt n LYS 21 N -5.08 0.00 -1.02 3.55 4.01 -1.26 -5.08 118.16 113.28 2ctt n LYS 21 Ca 0.09 0.00 -0.36 0.00 -0.51 0.00 0.00 58.31 57.53 2ctt n LYS 21 Cb 0.58 -0.67 -0.03 0.00 -0.51 0.00 0.00 35.03 34.40 2ctt n LYS 21 CO 0.00 0.00 0.00 0.39 -1.11 0.00 0.00 177.40 176.68 2ctt n GLU 22 N -2.28 0.00 -4.16 1.97 1.02 -1.26 -4.96 120.64 110.98 2ctt n GLU 22 Ca 0.00 0.00 -0.16 0.00 -0.02 0.00 0.00 57.16 56.98 2ctt n GLU 22 Cb 0.30 -0.79 -0.06 0.00 -0.02 0.00 0.00 31.44 30.87 2ctt n GLU 22 CO 0.00 0.00 0.00 -0.59 1.18 0.00 0.00 177.13 177.72 2ctt s PHE 23 N -0.57 1.31 -0.01 -0.32 -0.12 -1.26 -5.17 117.98 111.84 2ctt s PHE 23 Ca 0.50 -1.43 0.04 0.00 -0.05 0.00 0.00 56.93 55.99 2ctt s PHE 23 Cb -0.72 -0.31 -0.01 0.00 -0.63 0.00 0.00 43.02 41.35 2ctt s PHE 23 CO 0.40 -1.04 -0.15 0.99 -0.05 0.00 0.00 175.22 175.38 2ctt s THR 24 N -3.21 1.16 0.46 -4.49 2.01 -1.26 -5.02 115.64 105.30 2ctt s THR 24 Ca 0.34 -0.62 0.30 0.00 0.31 0.00 0.00 61.69 62.02 2ctt s THR 24 Cb 0.01 -0.97 0.49 0.00 0.01 0.00 0.00 72.50 72.04 2ctt s THR 24 CO 0.23 0.33 1.72 -0.37 -0.69 0.00 0.00 174.62 175.84 2ctt h VAL 25 N 4.81 0.34 -1.43 3.82 -1.51 -2.02 -3.41 116.25 116.85 2ctt h VAL 25 Ca -0.35 -0.06 -0.46 0.00 -1.23 0.00 0.00 66.70 64.60 2ctt h VAL 25 Cb 1.16 0.16 0.04 0.00 -2.13 0.00 0.00 31.29 30.52 2ctt h VAL 25 CO 0.49 0.03 -0.07 0.20 -1.23 0.00 0.00 177.57 176.98 2ctt s ASN 26 N -4.91 5.05 -0.51 4.19 -0.87 -1.26 -5.04 114.94 111.59 2ctt s ASN 26 Ca -0.07 -0.56 -0.28 0.00 -1.57 0.00 0.00 52.86 50.38 2ctt s ASN 26 Cb 0.26 -0.09 0.03 0.00 -0.02 0.00 0.00 41.25 41.43 2ctt s ASN 26 CO 0.82 -1.33 1.13 -0.63 -2.57 0.00 0.00 177.10 174.52 2ctt s ILE 27 N -2.73 4.17 -0.18 0.60 1.01 -1.26 -4.98 121.20 117.83 2ctt s ILE 27 Ca 0.61 1.05 -0.04 0.00 0.00 0.00 0.00 60.65 62.27 2ctt s ILE 27 Cb -0.07 -4.63 0.06 0.00 0.01 0.00 0.00 42.46 37.83 2ctt s ILE 27 CO 0.39 -1.11 0.06 -0.04 0.00 0.00 0.00 174.94 174.24 2ctt s MET 28 N 4.54 0.40 0.18 2.79 -1.94 -1.26 -4.43 119.30 119.58 2ctt s MET 28 Ca 0.45 -0.25 0.02 0.00 -1.71 0.00 0.00 55.69 54.20 2ctt s MET 28 Cb -0.08 -1.93 -0.01 0.00 2.01 0.00 0.00 34.83 34.83 2ctt s MET 28 CO 0.29 -0.63 0.08 -0.25 -0.01 0.00 0.00 175.02 174.50 2ctt n ASP 29 N 5.15 0.82 -4.76 3.03 9.92 -0.94 -4.91 116.55 124.86 2ctt n ASP 29 Ca -0.08 -2.01 -0.40 0.00 -0.53 0.00 0.00 54.79 51.77 2ctt n ASP 29 Cb 0.48 0.53 -0.04 0.00 -0.64 0.00 0.00 41.12 41.46 2ctt n ASP 29 CO 0.00 0.00 0.00 -0.89 0.13 0.00 0.00 177.20 176.44 2ctt s THR 30 N -2.32 3.34 0.60 -3.53 2.01 -1.26 -0.18 115.64 114.30 2ctt s THR 30 Ca 0.11 1.32 -0.18 0.00 0.31 0.00 0.00 61.69 63.25 2ctt s THR 30 Cb 0.01 -3.82 -0.06 0.00 0.01 0.00 0.00 72.50 68.63 2ctt s THR 30 CO 0.08 0.29 0.80 0.00 -0.69 0.00 0.00 174.62 175.09 2ctt n GLU 32 N -0.72 0.92 -0.03 0.00 0.28 -1.26 -3.03 120.64 116.81 2ctt n GLU 32 Ca 0.13 -0.09 -0.12 0.00 -0.16 0.00 0.00 57.16 56.92 2ctt n GLU 32 Cb 0.48 -1.38 -0.10 0.00 1.43 0.00 0.00 31.44 31.86 2ctt n GLU 32 CO 0.00 0.00 0.00 -0.09 -0.16 0.00 0.00 177.13 176.88 2ctt h ARG 33 N 0.00 -0.04 0.00 3.44 2.43 -1.97 -3.34 114.38 114.90 2ctt h ARG 33 Ca -0.16 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.01 2ctt h ARG 33 Cb 1.20 0.01 0.00 0.00 -0.42 0.00 0.00 29.97 30.76 2ctt h ARG 33 CO 0.01 0.64 -0.97 0.00 -1.51 0.00 0.00 179.97 178.14 2ctt n ASN 35 N -1.65 -4.86 -0.58 0.00 4.13 -1.17 -2.06 115.26 109.09 2ctt n ASN 35 Ca 0.03 -0.47 -0.08 0.00 1.68 0.00 0.00 54.58 55.75 2ctt n ASN 35 Cb 0.37 -4.34 -0.03 0.00 -1.54 0.00 0.00 39.78 34.23 2ctt n ASN 35 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 2ctt n GLY 36 N -1.62 0.95 0.08 7.41 0.00 -1.22 -4.89 105.19 105.90 2ctt n GLY 36 Ca -0.05 -0.62 -0.13 0.00 0.00 0.00 0.00 46.02 45.22 2ctt n GLY 36 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2ctt h LYS 37 N 0.05 0.00 0.00 1.61 1.79 -1.70 -3.45 116.57 114.87 2ctt h LYS 37 Ca -0.15 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.32 2ctt h LYS 37 Cb 0.52 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 31.17 2ctt h LYS 37 CO 0.23 0.62 0.00 0.41 -1.08 0.00 0.00 179.45 179.63 2ctt n GLY 38 N 1.56 1.31 3.43 3.86 0.00 -1.26 -4.89 105.19 109.19 2ctt n GLY 38 Ca -0.17 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 45.75 2ctt n GLY 38 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2ctt s ASN 39 N -2.00 0.03 0.32 1.61 4.22 -1.26 -2.77 114.94 115.08 2ctt s ASN 39 Ca 0.00 -1.13 -0.29 0.00 -2.14 0.00 0.00 52.86 49.30 2ctt s ASN 39 Cb 0.00 0.50 -0.10 0.00 1.28 0.00 0.00 41.25 42.93 2ctt s ASN 39 CO 0.00 -1.02 1.27 -1.61 -2.04 0.00 0.00 177.10 173.70 2ctt s GLU 40 N -4.06 4.41 0.00 3.55 0.41 -1.13 -4.36 118.70 117.52 2ctt s GLU 40 Ca 0.29 2.14 0.00 0.00 -0.41 0.00 0.00 54.97 56.99 2ctt s GLU 40 Cb 0.02 -3.09 0.00 0.00 -1.78 0.00 0.00 34.13 29.28 2ctt s GLU 40 CO 0.10 -0.11 0.37 -0.35 -0.49 0.00 0.00 175.26 174.79 2ctt n PRO 41 N 0.89 0.49 -2.69 0.39 -0.04 -1.26 -2.90 135.00 129.88 2ctt n PRO 41 Ca -0.00 0.00 -0.03 0.00 -0.04 0.00 0.00 63.50 63.43 2ctt n PRO 41 Cb 0.42 -1.11 0.12 0.00 -0.04 0.00 0.00 33.50 32.89 2ctt n PRO 41 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 2ctt n GLY 42 N 0.11 1.93 1.94 0.55 0.00 -1.26 -5.14 105.19 103.32 2ctt n GLY 42 Ca 0.00 -0.27 -0.14 0.00 0.00 0.00 0.00 46.02 45.61 2ctt n GLY 42 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 2ctt n THR 43 N -1.32 0.00 -4.39 2.61 -2.24 -1.14 -5.17 114.28 102.62 2ctt n THR 43 Ca -0.13 -1.40 -0.25 0.00 -2.27 0.00 0.00 64.05 60.00 2ctt n THR 43 Cb 0.87 0.55 -0.10 0.00 -2.10 0.00 0.00 70.33 69.55 2ctt n THR 43 CO 0.00 0.00 0.00 -0.54 -0.57 0.00 0.00 175.07 173.96 2ctt s LYS 44 N -2.88 1.84 -0.01 -0.78 1.02 -1.26 -4.98 119.74 112.68 2ctt s LYS 44 Ca 0.15 -1.56 -0.09 0.00 0.02 0.00 0.00 55.97 54.49 2ctt s LYS 44 Cb 0.01 -1.93 0.01 0.00 -0.52 0.00 0.00 37.83 35.39 2ctt s LYS 44 CO 0.10 0.37 0.19 0.54 -0.92 0.00 0.00 175.35 175.63 2ctt s VAL 45 N -2.14 0.07 0.33 3.17 0.11 -1.26 -3.33 120.40 117.35 2ctt s VAL 45 Ca 0.27 -0.54 0.08 0.00 -2.93 0.00 0.00 61.98 58.86 2ctt s VAL 45 Cb -0.07 -0.46 -0.03 0.00 -1.53 0.00 0.00 36.38 34.30 2ctt s VAL 45 CO 0.15 -0.30 0.23 -1.10 -3.33 0.00 0.00 175.10 170.75 2ctt s GLN 46 N -1.16 2.58 -0.09 1.54 -0.21 0.02 -4.93 119.66 117.41 2ctt s GLN 46 Ca -0.12 -1.39 -0.18 0.00 0.02 0.00 0.00 55.36 53.68 2ctt s GLN 46 Cb -0.06 -2.35 -0.05 0.00 1.00 0.00 0.00 33.01 31.55 2ctt s GLN 46 CO 0.02 0.11 0.47 -1.58 -2.12 0.00 0.00 175.29 172.19 2ctt s HIS 47 N -2.35 3.55 -0.15 0.91 5.65 -1.26 0.10 115.29 121.75 2ctt s HIS 47 Ca 0.39 0.92 -0.27 0.00 0.25 0.00 0.00 55.06 56.36 2ctt s HIS 47 Cb -0.04 -2.52 -0.01 0.00 -1.18 0.00 0.00 32.58 28.82 2ctt s HIS 47 CO 0.25 0.25 0.90 0.00 -0.65 0.00 0.00 174.74 175.48 2ctt h HIS 49 N 7.23 0.76 -0.67 0.00 3.86 -1.95 -1.45 115.15 122.94 2ctt h HIS 49 Ca -0.30 -0.56 0.06 0.00 -1.16 0.00 0.00 60.37 58.42 2ctt h HIS 49 Cb 1.13 -0.03 -0.08 0.00 1.06 0.00 0.00 27.41 29.49 2ctt h HIS 49 CO 0.71 1.55 -0.39 0.66 0.86 0.00 0.00 177.93 181.32 2ctt n TYR 50 N -3.61 -0.29 -0.07 2.45 4.02 -1.26 -2.56 117.16 115.84 2ctt n TYR 50 Ca -0.19 0.83 -0.18 0.00 -0.01 0.00 0.00 57.90 58.35 2ctt n TYR 50 Cb 1.08 -0.54 -0.13 0.00 -0.02 0.00 0.00 39.34 39.73 2ctt n TYR 50 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 176.86 175.85 2ctt n GLY 52 N 2.08 0.66 0.00 0.00 0.00 -0.54 -4.13 105.19 103.26 2ctt n GLY 52 Ca -0.38 -0.47 0.00 0.00 0.00 0.00 0.00 46.02 45.17 2ctt n GLY 52 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2ctt n GLY 53 N -2.57 1.66 0.00 -0.02 0.00 -1.25 -4.99 105.19 98.02 2ctt n GLY 53 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 2ctt n GLY 53 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 2ctt n SER 54 N 0.00 3.04 -0.96 1.61 3.41 -1.26 -4.81 113.62 114.65 2ctt n SER 54 Ca 0.00 -0.15 -0.09 0.00 -0.26 0.00 0.00 58.87 58.38 2ctt n SER 54 Cb 0.00 0.90 -0.01 0.00 -0.26 0.00 0.00 64.21 64.85 2ctt n SER 54 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2ctt n GLY 55 N 1.82 0.13 3.02 5.00 0.00 -1.26 -4.92 105.19 108.98 2ctt n GLY 55 Ca 0.00 -0.53 -0.21 0.00 0.00 0.00 0.00 46.02 45.28 2ctt n GLY 55 CO 0.00 0.00 0.00 -0.29 0.00 0.00 0.00 173.32 173.03 2ctt s MET 56 N -4.24 1.01 0.28 1.61 -2.45 -1.26 -3.35 119.30 110.89 2ctt s MET 56 Ca 0.00 -0.35 0.11 0.00 -1.25 0.00 0.00 55.69 54.20 2ctt s MET 56 Cb 0.00 -0.94 -0.05 0.00 1.25 0.00 0.00 34.83 35.09 2ctt s MET 56 CO 0.00 0.15 -0.13 -2.00 1.05 0.00 0.00 175.02 174.10 2ctt s GLU 57 N 0.08 1.89 -0.10 4.11 2.12 -0.69 -3.72 118.70 122.39 2ctt s GLU 57 Ca -0.01 -1.67 0.01 0.00 0.36 0.00 0.00 54.97 53.66 2ctt s GLU 57 Cb -0.08 -1.89 0.02 0.00 0.26 0.00 0.00 34.13 32.44 2ctt s GLU 57 CO 0.00 0.32 -0.13 0.99 -0.54 0.00 0.00 175.26 175.91 2ctt s THR 58 N -2.46 1.30 -0.21 -1.70 2.01 -1.26 -3.06 115.64 110.26 2ctt s THR 58 Ca 0.31 -0.52 -0.10 0.00 0.31 0.00 0.00 61.69 61.68 2ctt s THR 58 Cb -0.05 -1.21 -0.05 0.00 0.01 0.00 0.00 72.50 71.20 2ctt s THR 58 CO 0.17 0.40 0.15 -0.63 -0.69 0.00 0.00 174.62 174.02 2ctt s ILE 59 N 1.06 5.39 -0.62 1.82 1.09 -1.11 -4.98 121.20 123.84 2ctt s ILE 59 Ca -0.06 0.20 -0.16 0.00 -1.10 0.00 0.00 60.65 59.53 2ctt s ILE 59 Cb -0.15 -3.49 0.14 0.00 -1.06 0.00 0.00 42.46 37.91 2ctt s ILE 59 CO -0.02 0.41 0.62 0.20 -0.10 0.00 0.00 174.94 176.06 2ctt s ASN 60 N 0.57 6.32 -0.15 3.58 0.02 -1.26 -1.62 114.94 122.39 2ctt s ASN 60 Ca 0.08 -1.90 0.00 0.00 -1.02 0.00 0.00 52.86 50.02 2ctt s ASN 60 Cb -0.12 -2.24 0.03 0.00 0.02 0.00 0.00 41.25 38.94 2ctt s ASN 60 CO 0.00 -0.87 -0.11 0.28 0.02 0.00 0.00 177.10 176.43 2ctt s THR 61 N 1.59 1.41 0.00 1.60 -1.32 -1.15 -5.05 115.64 112.72 2ctt s THR 61 Ca 0.09 -0.64 0.00 0.00 -1.21 0.00 0.00 61.69 59.93 2ctt s THR 61 Cb -0.24 -1.41 0.00 0.00 -1.51 0.00 0.00 72.50 69.34 2ctt s THR 61 CO 0.01 0.33 0.00 0.61 -2.21 0.00 0.00 174.62 173.36 2ctt n GLY 62 N 4.80 0.88 0.00 6.08 0.00 -1.26 -2.38 105.19 113.31 2ctt n GLY 62 Ca -0.15 -0.81 0.06 0.00 0.00 0.00 0.00 46.02 45.12 2ctt n GLY 62 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 2ctt n PRO 63 N 0.00 0.49 -4.71 1.61 -0.04 -1.26 -4.74 135.00 126.35 2ctt n PRO 63 Ca 0.00 0.00 -0.32 0.00 -0.04 0.00 0.00 63.50 63.14 2ctt n PRO 63 Cb 0.00 -1.35 -0.08 0.00 -0.04 0.00 0.00 33.50 32.03 2ctt n PRO 63 CO 0.00 0.00 0.00 -0.59 -0.04 0.00 0.00 175.50 174.87 2ctt s PHE 64 N -2.00 1.86 -0.04 0.54 -0.71 -1.00 -5.16 117.98 111.46 2ctt s PHE 64 Ca 0.17 -1.02 -0.04 0.00 -1.04 0.00 0.00 56.93 54.99 2ctt s PHE 64 Cb 0.08 -1.52 0.01 0.00 -1.21 0.00 0.00 43.02 40.37 2ctt s PHE 64 CO 0.13 0.12 0.12 0.08 -1.34 0.00 0.00 175.22 174.33 2ctt s VAL 65 N -2.94 0.01 0.49 -2.49 1.01 -1.26 -2.93 120.40 112.29 2ctt s VAL 65 Ca 0.10 -0.08 0.08 0.00 0.00 0.00 0.00 61.98 62.08 2ctt s VAL 65 Cb 0.02 -0.20 0.03 0.00 0.00 0.00 0.00 36.38 36.24 2ctt s VAL 65 CO 0.05 -0.04 0.59 -0.04 0.00 0.00 0.00 175.10 175.66 2ctt s MET 66 N -0.09 2.52 -0.12 2.72 -1.94 -0.64 -4.97 119.30 116.78 2ctt s MET 66 Ca -0.02 -1.53 -0.04 0.00 -1.71 0.00 0.00 55.69 52.40 2ctt s MET 66 Cb -0.02 -2.57 0.05 0.00 2.01 0.00 0.00 34.83 34.30 2ctt s MET 66 CO 0.00 -0.50 0.11 1.03 -0.01 0.00 0.00 175.02 175.65 2ctt s ARG 67 N -4.41 0.03 0.01 2.03 1.81 -1.26 -2.73 118.95 114.42 2ctt s ARG 67 Ca 0.54 0.21 -0.06 0.00 -1.72 0.00 0.00 55.73 54.70 2ctt s ARG 67 Cb -0.06 -1.08 -0.00 0.00 -0.45 0.00 0.00 34.95 33.35 2ctt s ARG 67 CO 0.33 -0.51 0.10 0.45 -0.68 0.00 0.00 175.30 175.00 2ctt s SER 68 N 2.20 0.07 0.33 0.23 0.15 -1.17 -5.04 113.70 110.47 2ctt s SER 68 Ca 0.04 -0.27 -0.25 0.00 0.70 0.00 0.00 55.95 56.17 2ctt s SER 68 Cb -0.14 0.18 -0.14 0.00 -1.71 0.00 0.00 66.02 64.21 2ctt s SER 68 CO -0.07 -0.35 0.69 0.41 1.20 0.00 0.00 173.24 175.12 2ctt n THR 69 N 1.49 1.88 -0.74 6.45 -1.04 -1.26 -1.70 114.28 119.36 2ctt n THR 69 Ca -0.23 -0.50 -0.33 0.00 -2.04 0.00 0.00 64.05 60.95 2ctt n THR 69 Cb 0.55 -0.57 0.14 0.00 -1.82 0.00 0.00 70.33 68.64 2ctt n THR 69 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 2ctt n ARG 71 N -1.25 0.75 0.02 0.00 1.85 -1.26 -4.13 116.66 112.63 2ctt n ARG 71 Ca 0.01 0.00 -0.11 0.00 -1.00 0.00 0.00 57.85 56.75 2ctt n ARG 71 Cb 0.63 -0.86 -0.06 0.00 -1.05 0.00 0.00 32.46 31.12 2ctt n ARG 71 CO 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 177.63 177.62 2ctt h ARG 72 N 0.00 0.01 0.02 2.89 2.47 -2.01 -3.32 114.38 114.44 2ctt h ARG 72 Ca 0.00 -0.00 -0.39 0.00 -1.26 0.00 0.00 59.98 58.33 2ctt h ARG 72 Cb 0.72 -0.00 -0.06 0.00 -1.65 0.00 0.00 29.97 28.97 2ctt h ARG 72 CO 0.00 0.01 -2.39 0.00 0.56 0.00 0.00 179.97 178.15 2ctt n GLY 74 N 2.19 1.51 1.58 0.00 0.00 -1.25 -4.49 105.19 104.72 2ctt n GLY 74 Ca -0.44 -0.12 -0.02 0.00 0.00 0.00 0.00 46.02 45.45 2ctt n GLY 74 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2ctt n GLY 75 N -0.70 0.77 0.02 -0.02 0.00 -1.26 -4.90 105.19 99.11 2ctt n GLY 75 Ca 0.00 -0.58 0.00 0.00 0.00 0.00 0.00 46.02 45.44 2ctt n GLY 75 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 173.32 171.19 2ctt n ARG 76 N -0.89 0.00 0.00 1.61 0.63 -1.26 -4.76 116.66 111.98 2ctt n ARG 76 Ca -0.00 0.00 0.00 0.00 -0.92 0.00 0.00 57.85 56.93 2ctt n ARG 76 Cb 0.51 -0.93 0.00 0.00 0.45 0.00 0.00 32.46 32.49 2ctt n ARG 76 CO 0.00 0.00 0.00 0.41 -2.51 0.00 0.00 177.63 175.53 2ctt n GLY 77 N 3.25 0.63 3.30 5.14 0.00 -1.26 -4.78 105.19 111.47 2ctt n GLY 77 Ca 0.00 0.00 -0.14 0.00 0.00 0.00 0.00 46.02 45.88 2ctt n GLY 77 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2ctt s SER 78 N -1.99 -0.30 -0.61 1.61 0.01 -1.26 -2.58 113.70 108.57 2ctt s SER 78 Ca 0.00 0.27 -0.20 0.00 1.31 0.00 0.00 55.95 57.34 2ctt s SER 78 Cb 0.00 0.40 0.10 0.00 0.21 0.00 0.00 66.02 66.73 2ctt s SER 78 CO 0.00 -0.45 0.76 -0.63 0.41 0.00 0.00 173.24 173.33 2ctt s ILE 79 N -1.17 4.71 -0.68 1.44 1.09 0.29 -4.76 121.20 122.13 2ctt s ILE 79 Ca -0.12 -0.87 -0.26 0.00 -1.10 0.00 0.00 60.65 58.30 2ctt s ILE 79 Cb -0.04 -4.54 0.04 0.00 -1.06 0.00 0.00 42.46 36.86 2ctt s ILE 79 CO 0.05 -1.20 1.18 -0.63 -0.10 0.00 0.00 174.94 174.23 2ctt s ILE 80 N 2.97 3.95 0.41 2.92 1.01 -1.26 -0.80 121.20 130.40 2ctt s ILE 80 Ca 0.14 0.36 0.21 0.00 0.00 0.00 0.00 60.65 61.36 2ctt s ILE 80 Cb -0.22 -4.81 0.41 0.00 0.01 0.00 0.00 42.46 37.85 2ctt s ILE 80 CO 0.07 -1.62 1.75 0.40 0.00 0.00 0.00 174.94 175.53 2ctt h ILE 81 N 6.04 0.45 -3.15 2.92 5.03 -1.94 -3.27 117.51 123.59 2ctt h ILE 81 Ca -0.27 -0.11 -0.60 0.00 -0.12 0.00 0.00 64.86 63.76 2ctt h ILE 81 Cb 1.06 0.10 -0.40 0.00 -3.03 0.00 0.00 36.82 34.54 2ctt h ILE 81 CO 1.23 0.06 -0.75 -0.55 -0.68 0.00 0.00 178.15 177.46 2ctt s SER 82 N -5.12 3.98 0.29 1.72 0.15 -1.26 -5.10 113.70 108.35 2ctt s SER 82 Ca -0.08 -1.98 -0.29 0.00 0.70 0.00 0.00 55.95 54.29 2ctt s SER 82 Cb 0.26 -0.98 -0.10 0.00 -1.71 0.00 0.00 66.02 63.49 2ctt s SER 82 CO 0.80 -0.37 1.24 -2.16 1.20 0.00 0.00 173.24 173.95 2ctt s PRO 83 N 1.18 4.45 0.26 5.44 0.04 -1.24 -2.83 135.00 142.30 2ctt s PRO 83 Ca 0.12 2.06 -0.20 0.00 0.04 0.00 0.00 61.00 63.02 2ctt s PRO 83 Cb -0.20 -3.13 -0.14 0.00 0.04 0.00 0.00 34.50 31.08 2ctt s PRO 83 CO -0.16 -0.07 0.24 0.00 0.04 0.00 0.00 177.00 177.05 2ctt n VAL 85 N -0.45 0.47 -0.08 0.00 0.24 -1.26 -2.51 118.33 114.73 2ctt n VAL 85 Ca 0.12 -0.70 -0.17 0.00 -2.04 0.00 0.00 64.34 61.55 2ctt n VAL 85 Cb 0.27 0.93 -0.06 0.00 -1.47 0.00 0.00 33.84 33.51 2ctt n VAL 85 CO 0.00 0.00 0.00 0.52 -2.14 0.00 0.00 176.83 175.21 2ctt n VAL 86 N 1.39 0.94 -0.13 3.34 0.31 -1.26 -4.69 118.33 118.22 2ctt n VAL 86 Ca 0.19 -0.27 0.04 0.00 -0.01 0.00 0.00 64.34 64.30 2ctt n VAL 86 Cb 0.58 -1.57 0.12 0.00 -0.91 0.00 0.00 33.84 32.06 2ctt n VAL 86 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 2ctt n ARG 88 N 0.30 -1.39 -2.88 0.00 5.12 -1.05 0.11 116.66 116.88 2ctt n ARG 88 Ca 0.09 0.19 -0.15 0.00 -1.93 0.00 0.00 57.85 56.05 2ctt n ARG 88 Cb 0.39 -4.45 0.03 0.00 -1.16 0.00 0.00 32.46 27.26 2ctt n ARG 88 CO 0.00 0.00 0.00 0.41 -1.93 0.00 0.00 177.63 176.11 2ctt n GLY 89 N -1.61 -0.07 0.10 -0.13 0.00 -1.25 -4.84 105.19 97.38 2ctt n GLY 89 Ca -0.04 -0.16 -0.11 0.00 0.00 0.00 0.00 46.02 45.71 2ctt n GLY 89 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2ctt n ALA 90 N -3.27 1.45 0.00 4.61 0.00 0.31 -4.91 120.51 118.71 2ctt n ALA 90 Ca -0.05 -1.03 0.00 0.00 0.00 0.00 0.00 53.44 52.36 2ctt n ALA 90 Cb 0.57 -0.50 0.00 0.00 0.00 0.00 0.00 19.45 19.52 2ctt n ALA 90 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2ctt n GLY 91 N 1.71 3.31 3.39 0.00 0.00 -1.26 -5.04 105.19 107.30 2ctt n GLY 91 Ca -0.27 0.00 -0.20 0.00 0.00 0.00 0.00 46.02 45.56 2ctt n GLY 91 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 2ctt s GLN 92 N -0.99 1.46 0.18 1.61 1.11 -1.26 -2.77 119.66 119.00 2ctt s GLN 92 Ca 0.00 -1.73 -0.15 0.00 0.01 0.00 0.00 55.36 53.49 2ctt s GLN 92 Cb 0.00 -0.98 0.02 0.00 -1.01 0.00 0.00 33.01 31.04 2ctt s GLN 92 CO 0.00 0.01 0.44 0.00 0.01 0.00 0.00 175.29 175.75 2ctt s ALA 93 N -3.14 -0.66 -1.33 6.09 0.00 0.75 -4.43 121.76 119.04 2ctt s ALA 93 Ca 0.28 -0.41 -0.17 0.00 0.00 0.00 0.00 51.96 51.67 2ctt s ALA 93 Cb 0.04 0.84 0.07 0.00 0.00 0.00 0.00 23.12 24.07 2ctt s ALA 93 CO 0.10 -0.75 1.82 1.63 0.00 0.00 0.00 175.76 178.57 2ctt n LYS 94 N -0.29 3.15 -1.38 0.00 4.01 -1.26 -2.21 118.16 120.18 2ctt n LYS 94 Ca -0.10 -3.18 -0.39 0.00 -0.51 0.00 0.00 58.31 54.13 2ctt n LYS 94 Cb 0.63 -3.42 0.02 0.00 -0.51 0.00 0.00 35.03 31.74 2ctt n LYS 94 CO 0.00 0.00 0.00 1.04 -1.11 0.00 0.00 177.40 177.33 2ctt n GLN 95 N 7.72 0.30 -1.12 1.97 3.00 -1.26 -4.60 117.38 123.40 2ctt n GLN 95 Ca 0.49 0.12 -0.44 0.00 -0.01 0.00 0.00 57.00 57.16 2ctt n GLN 95 Cb 0.44 -1.36 -0.06 0.00 0.00 0.00 0.00 30.24 29.26 2ctt n GLN 95 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.06 178.69 2ctt n LYS 96 N 0.72 0.00 -3.79 -1.09 5.02 -1.26 -4.90 118.16 112.86 2ctt n LYS 96 Ca 0.10 0.00 -0.30 0.00 -2.02 0.00 0.00 58.31 56.09 2ctt n LYS 96 Cb 0.45 -1.00 -0.04 0.00 -0.02 0.00 0.00 35.03 34.42 2ctt n LYS 96 CO 0.00 0.00 0.00 -1.59 -0.52 0.00 0.00 177.40 175.29 2ctt s LYS 97 N 1.48 3.52 -0.24 1.97 0.00 -1.26 -5.03 119.74 120.18 2ctt s LYS 97 Ca 0.67 -0.30 -0.03 0.00 0.00 0.00 0.00 55.97 56.32 2ctt s LYS 97 Cb -0.96 -2.93 -0.18 0.00 0.00 0.00 0.00 37.83 33.76 2ctt s LYS 97 CO 0.50 0.52 -0.13 -2.13 0.00 0.00 0.00 175.35 174.11 2ctt n ARG 98 N 0.01 0.66 -3.70 1.78 0.63 -1.26 -5.04 116.66 109.74 2ctt n ARG 98 Ca -0.04 0.20 -0.12 0.00 -0.92 0.00 0.00 57.85 56.97 2ctt n ARG 98 Cb 0.52 -1.56 -0.07 0.00 0.45 0.00 0.00 32.46 31.80 2ctt n ARG 98 CO 0.00 0.00 0.00 -1.54 -2.51 0.00 0.00 177.63 173.58 2ctt s SER 99 N -6.77 -0.20 0.00 6.15 1.04 -1.26 -5.13 113.70 107.52 2ctt s SER 99 Ca -0.33 -0.12 0.00 0.00 0.48 0.00 0.00 55.95 55.98 2ctt s SER 99 Cb 0.09 0.40 0.00 0.00 0.10 0.00 0.00 66.02 66.61 2ctt s SER 99 CO 0.61 -0.66 0.00 0.61 0.98 0.00 0.00 173.24 174.78 2ctt n GLY 100 N 0.47 3.13 3.77 7.32 0.00 -1.26 -5.04 105.19 113.57 2ctt n GLY 100 Ca -0.18 -1.11 -0.38 0.00 0.00 0.00 0.00 46.02 44.35 2ctt n GLY 100 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2ctt s PRO 101 N -4.74 3.93 -0.25 1.61 0.04 -1.26 -5.05 135.00 129.28 2ctt s PRO 101 Ca 0.00 1.84 -0.17 0.00 0.04 0.00 0.00 61.00 62.71 2ctt s PRO 101 Cb 0.00 -2.58 0.07 0.00 0.04 0.00 0.00 34.50 32.03 2ctt s PRO 101 CO 0.00 -0.42 0.63 -1.54 0.04 0.00 0.00 177.00 175.71 2ctt s SER 102 N -1.19 -0.79 -0.26 6.66 1.04 -1.26 -5.07 113.70 112.83 2ctt s SER 102 Ca 0.59 1.35 -0.13 0.00 0.48 0.00 0.00 55.95 58.25 2ctt s SER 102 Cb -0.30 1.27 -0.11 0.00 0.10 0.00 0.00 66.02 66.97 2ctt s SER 102 CO 0.38 -0.23 -0.33 -1.54 0.98 0.00 0.00 173.24 172.50 2ctt n SER 103 N 3.82 1.82 0.00 7.02 3.41 -1.26 -5.31 113.62 123.12 2ctt n SER 103 Ca -0.19 0.31 0.00 0.00 -0.26 0.00 0.00 58.87 58.73 2ctt n SER 103 Cb 0.57 -0.75 0.00 0.00 -0.26 0.00 0.00 64.21 63.77 2ctt n SER 103 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49