#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1x5o s SER 2 N 0.00 -0.70 -1.50 1.61 1.04 -1.26 -4.95 113.70 107.93 1x5o s SER 2 Ca 0.00 1.09 -0.11 0.00 0.48 0.00 0.00 55.95 57.41 1x5o s SER 2 Cb 0.00 1.39 0.07 0.00 0.10 0.00 0.00 66.02 67.58 1x5o s SER 2 CO 0.00 -0.17 0.89 -0.24 0.98 0.00 0.00 173.24 174.70 1x5o n SER 3 N 4.16 -3.79 -3.58 7.02 2.88 -1.26 -4.85 113.62 114.20 1x5o n SER 3 Ca -0.18 -0.82 -0.41 0.00 -1.33 0.00 0.00 58.87 56.14 1x5o n SER 3 Cb 0.57 -3.78 -0.01 0.00 -0.75 0.00 0.00 64.21 60.24 1x5o n SER 3 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 1x5o n GLY 4 N -1.67 4.68 2.78 0.46 0.00 -1.26 -4.83 105.19 105.35 1x5o n GLY 4 Ca -0.04 -1.82 -0.19 0.00 0.00 0.00 0.00 46.02 43.98 1x5o n GLY 4 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1x5o s SER 5 N 1.57 1.21 0.34 1.61 0.15 -1.26 -5.15 113.70 112.17 1x5o s SER 5 Ca 0.53 -0.01 0.07 0.00 0.70 0.00 0.00 55.95 57.24 1x5o s SER 5 Cb 0.15 0.26 -0.02 0.00 -1.71 0.00 0.00 66.02 64.71 1x5o s SER 5 CO -0.06 -0.29 0.40 -0.94 1.20 0.00 0.00 173.24 173.54 1x5o s SER 6 N 2.29 5.63 0.09 5.45 1.04 -1.26 -5.04 113.70 121.90 1x5o s SER 6 Ca 0.04 -0.35 -0.06 0.00 0.48 0.00 0.00 55.95 56.06 1x5o s SER 6 Cb -0.14 -1.07 -0.23 0.00 0.10 0.00 0.00 66.02 64.69 1x5o s SER 6 CO -0.09 -0.42 1.18 1.23 0.98 0.00 0.00 173.24 176.12 1x5o h GLY 7 N 1.04 0.42 -3.74 7.32 0.00 -2.02 -3.46 103.07 102.63 1x5o h GLY 7 Ca -0.45 -0.93 -0.12 0.00 0.00 0.00 0.00 47.33 45.83 1x5o h GLY 7 CO 0.55 0.82 -0.14 -0.10 0.00 0.00 0.00 176.54 177.67 1x5o n LEU 8 N -3.65 -0.52 -4.41 3.11 7.94 -1.26 -4.82 117.00 113.40 1x5o n LEU 8 Ca -0.09 0.30 -0.38 0.00 -1.11 0.00 0.00 56.01 54.73 1x5o n LEU 8 Cb 0.96 -1.45 0.03 0.00 0.53 0.00 0.00 43.42 43.50 1x5o n LEU 8 CO 0.54 -0.13 -0.12 2.29 -1.11 0.00 0.00 177.39 178.86 1x5o n LYS 9 N -2.32 0.37 -2.05 1.96 2.85 -1.26 -4.87 118.16 112.84 1x5o n LYS 9 Ca -0.07 0.15 -0.40 0.00 -1.05 0.00 0.00 58.31 56.94 1x5o n LYS 9 Cb 0.46 -1.53 0.04 0.00 -0.65 0.00 0.00 35.03 33.35 1x5o n LYS 9 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 177.40 177.35 1x5o n ALA 10 N -1.68 6.42 -3.59 0.58 0.00 -1.26 -4.93 120.51 116.05 1x5o n ALA 10 Ca 0.11 -4.20 -0.04 0.00 0.00 0.00 0.00 53.44 49.30 1x5o n ALA 10 Cb 0.48 -1.99 -0.02 0.00 0.00 0.00 0.00 19.45 17.91 1x5o n ALA 10 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.50 175.96 1x5o s SER 11 N -1.18 -0.14 0.00 0.00 1.04 -1.26 -5.05 113.70 107.11 1x5o s SER 11 Ca 0.50 -0.00 0.00 0.00 0.48 0.00 0.00 55.95 56.93 1x5o s SER 11 Cb 0.40 0.15 0.00 0.00 0.10 0.00 0.00 66.02 66.67 1x5o s SER 11 CO -0.37 -0.25 0.00 0.61 0.98 0.00 0.00 173.24 174.21 1x5o n GLY 12 N -0.11 0.55 3.74 7.32 0.00 -1.26 -5.01 105.19 110.42 1x5o n GLY 12 Ca -0.00 -0.39 -0.41 0.00 0.00 0.00 0.00 46.02 45.21 1x5o n GLY 12 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1x5o s VAL 13 N -2.70 2.73 -0.15 1.61 0.11 -1.26 -4.95 120.40 115.79 1x5o s VAL 13 Ca 0.00 0.60 -0.27 0.00 -2.93 0.00 0.00 61.98 59.38 1x5o s VAL 13 Cb 0.00 -3.38 -0.24 0.00 -1.53 0.00 0.00 36.38 31.23 1x5o s VAL 13 CO 0.00 0.08 0.62 1.56 -3.33 0.00 0.00 175.10 174.04 1x5o h GLN 14 N 5.42 0.00 -4.32 1.54 4.20 -2.04 -3.49 115.11 116.43 1x5o h GLN 14 Ca -0.45 0.00 -0.18 0.00 0.06 0.00 0.00 58.65 58.07 1x5o h GLN 14 Cb 1.21 0.00 -0.14 0.00 0.30 0.00 0.00 27.48 28.86 1x5o h GLN 14 CO 0.80 0.97 -0.50 0.00 -0.67 0.00 0.00 178.83 179.43 1x5o s ALA 15 N -2.26 0.75 0.11 3.87 0.00 -1.26 -5.11 121.76 117.86 1x5o s ALA 15 Ca -0.21 -1.44 -0.31 0.00 0.00 0.00 0.00 51.96 50.01 1x5o s ALA 15 Cb -0.01 1.22 -0.07 0.00 0.00 0.00 0.00 23.12 24.26 1x5o s ALA 15 CO 0.65 -0.64 1.31 -1.14 0.00 0.00 0.00 175.76 175.94 1x5o s GLN 16 N -4.10 4.37 -1.61 0.00 0.74 -1.26 -3.24 119.66 114.56 1x5o s GLN 16 Ca 0.32 1.97 -0.10 0.00 0.05 0.00 0.00 55.36 57.60 1x5o s GLN 16 Cb 0.05 -3.27 0.09 0.00 1.10 0.00 0.00 33.01 30.98 1x5o s GLN 16 CO 0.09 -0.35 0.49 -0.12 -0.55 0.00 0.00 175.29 174.85 1x5o n MET 17 N 3.76 -2.44 0.10 1.67 0.00 -1.26 -4.88 117.12 114.09 1x5o n MET 17 Ca 0.10 0.29 -0.06 0.00 0.00 0.00 0.00 57.70 58.03 1x5o n MET 17 Cb 0.44 -4.57 -0.03 0.00 0.00 0.00 0.00 33.22 29.06 1x5o n MET 17 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 175.97 175.97 1x5o h ALA 18 N 0.86 -0.36 -2.15 -5.12 0.00 -1.99 -3.46 119.26 107.04 1x5o h ALA 18 Ca -0.62 -0.09 -0.44 0.00 0.00 0.00 0.00 54.91 53.76 1x5o h ALA 18 Cb 1.39 0.14 0.21 0.00 0.00 0.00 0.00 17.79 19.52 1x5o h ALA 18 CO 0.73 -0.34 0.01 0.15 0.00 0.00 0.00 179.25 179.81 1x5o s LYS 19 N -2.77 -0.97 0.09 0.00 1.02 -1.26 -4.98 119.74 110.86 1x5o s LYS 19 Ca -0.06 0.79 -0.22 0.00 0.02 0.00 0.00 55.97 56.50 1x5o s LYS 19 Cb 0.00 -1.55 -0.07 0.00 -0.52 0.00 0.00 37.83 35.70 1x5o s LYS 19 CO 0.18 -3.75 0.67 -0.65 -0.92 0.00 0.00 175.35 170.89 1x5o s GLN 20 N -4.48 4.39 -0.13 1.68 -0.21 -1.26 -5.06 119.66 114.58 1x5o s GLN 20 Ca 0.68 0.93 -0.10 0.00 0.02 0.00 0.00 55.36 56.89 1x5o s GLN 20 Cb -0.25 -3.28 -0.05 0.00 1.00 0.00 0.00 33.01 30.44 1x5o s GLN 20 CO 0.64 0.53 0.21 -1.14 -2.12 0.00 0.00 175.29 173.41 1x5o s GLN 21 N -0.84 3.85 0.58 2.91 0.74 -1.26 -5.09 119.66 120.55 1x5o s GLN 21 Ca 0.33 -0.03 -0.09 0.00 0.05 0.00 0.00 55.36 55.62 1x5o s GLN 21 Cb -0.21 -3.30 -0.04 0.00 1.10 0.00 0.00 33.01 30.57 1x5o s GLN 21 CO 0.22 0.54 0.96 -1.83 -0.55 0.00 0.00 175.29 174.63 1x5o s GLU 22 N -0.40 3.53 0.48 1.67 1.03 -1.26 -5.01 118.70 118.74 1x5o s GLU 22 Ca 0.15 0.56 -0.23 0.00 0.03 0.00 0.00 54.97 55.48 1x5o s GLU 22 Cb -0.13 -2.17 -0.08 0.00 -0.80 0.00 0.00 34.13 30.96 1x5o s GLU 22 CO 0.04 -0.49 1.19 1.04 -1.33 0.00 0.00 175.26 175.71 1x5o n GLN 23 N -2.62 1.60 -3.63 -4.83 3.00 -1.26 -4.95 117.38 104.70 1x5o n GLN 23 Ca 0.04 0.58 -0.37 0.00 -0.01 0.00 0.00 57.00 57.25 1x5o n GLN 23 Cb 0.55 -2.32 -0.06 0.00 0.00 0.00 0.00 30.24 28.40 1x5o n GLN 23 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.06 177.40 1x5o s ASP 24 N -0.76 5.99 0.00 1.08 2.15 -1.26 -4.88 116.67 118.99 1x5o s ASP 24 Ca 0.66 -3.62 0.14 0.00 0.43 0.00 0.00 52.55 50.16 1x5o s ASP 24 Cb -0.48 -1.92 0.66 0.00 -0.30 0.00 0.00 42.92 40.88 1x5o s ASP 24 CO 0.54 -0.21 1.43 -0.81 -0.17 0.00 0.00 175.17 175.96 1x5o n PRO 25 N 2.48 0.08 -0.16 4.34 -0.04 -1.26 -3.52 135.00 136.92 1x5o n PRO 25 Ca 0.20 0.21 0.28 0.00 -0.04 0.00 0.00 63.50 64.15 1x5o n PRO 25 Cb 0.37 -1.50 0.57 0.00 -0.04 0.00 0.00 33.50 32.91 1x5o n PRO 25 CO 0.00 0.00 0.00 1.79 -0.04 0.00 0.00 175.50 177.25 1x5o h THR 26 N 0.00 0.13 -4.38 0.52 1.35 -1.89 -3.40 112.91 105.23 1x5o h THR 26 Ca 0.00 0.00 -0.50 0.00 -0.55 0.00 0.00 66.41 65.36 1x5o h THR 26 Cb 0.20 0.22 0.08 0.00 -1.73 0.00 0.00 68.15 66.92 1x5o h THR 26 CO 0.00 0.00 0.40 0.21 -0.25 0.00 0.00 175.52 175.88 1x5o s ASN 27 N -4.11 5.71 -0.04 5.36 2.47 -1.23 -1.75 114.94 121.35 1x5o s ASN 27 Ca -0.03 1.37 0.01 0.00 0.42 0.00 0.00 52.86 54.63 1x5o s ASN 27 Cb 0.16 -2.29 0.02 0.00 -1.45 0.00 0.00 41.25 37.68 1x5o s ASN 27 CO 0.54 -1.20 -0.06 -0.76 -3.72 0.00 0.00 177.10 171.90 1x5o s LEU 28 N -5.35 1.45 -0.48 3.21 1.43 0.27 -3.71 118.68 115.51 1x5o s LEU 28 Ca 0.57 -0.15 -0.19 0.00 -1.03 0.00 0.00 54.13 53.32 1x5o s LEU 28 Cb -0.12 -0.49 0.04 0.00 0.03 0.00 0.00 46.19 45.65 1x5o s LEU 28 CO 0.54 -0.03 0.61 -0.47 0.23 0.00 0.00 176.35 177.23 1x5o s TYR 29 N 0.76 3.06 -0.29 0.29 6.14 0.12 -2.57 117.35 124.86 1x5o s TYR 29 Ca -0.11 -0.36 0.01 0.00 0.64 0.00 0.00 57.07 57.25 1x5o s TYR 29 Cb -0.14 -3.41 0.07 0.00 0.42 0.00 0.00 41.96 38.90 1x5o s TYR 29 CO 0.01 -0.95 -0.04 0.42 0.64 0.00 0.00 175.55 175.63 1x5o s ILE 30 N 2.66 2.47 0.32 3.14 1.01 -1.06 -1.07 121.20 128.68 1x5o s ILE 30 Ca 0.17 -1.69 0.03 0.00 0.00 0.00 0.00 60.65 59.15 1x5o s ILE 30 Cb -0.17 -2.51 0.03 0.00 0.01 0.00 0.00 42.46 39.81 1x5o s ILE 30 CO 0.14 -0.17 0.21 -1.54 0.00 0.00 0.00 174.94 173.59 1x5o n SER 31 N 4.47 2.14 -3.00 3.58 3.41 -0.58 -0.25 113.62 123.38 1x5o n SER 31 Ca -0.11 -2.15 -0.16 0.00 -0.26 0.00 0.00 58.87 56.20 1x5o n SER 31 Cb 0.42 0.01 0.07 0.00 -0.26 0.00 0.00 64.21 64.45 1x5o n SER 31 CO 0.00 0.00 0.00 0.59 -0.16 0.00 0.00 175.04 175.47 1x5o n ASN 32 N -1.82 -3.23 -4.80 4.04 4.13 0.49 -2.50 115.26 111.57 1x5o n ASN 32 Ca -0.03 -0.49 -0.28 0.00 1.68 0.00 0.00 54.58 55.47 1x5o n ASN 32 Cb 0.37 -4.26 -0.06 0.00 -1.54 0.00 0.00 39.78 34.29 1x5o n ASN 32 CO 0.00 0.00 0.00 -0.76 0.28 0.00 0.00 177.26 176.78 1x5o s LEU 33 N -5.77 3.86 0.49 3.41 1.43 0.76 -4.54 118.68 118.33 1x5o s LEU 33 Ca 0.16 -0.04 -0.21 0.00 -1.03 0.00 0.00 54.13 53.01 1x5o s LEU 33 Cb -0.07 -2.50 -0.07 0.00 0.03 0.00 0.00 46.19 43.58 1x5o s LEU 33 CO 0.60 0.12 1.15 -2.16 0.23 0.00 0.00 176.35 176.28 1x5o s PRO 34 N -2.77 3.60 0.00 1.29 0.04 -1.26 -3.91 135.00 131.99 1x5o s PRO 34 Ca 0.31 1.70 0.20 0.00 0.04 0.00 0.00 61.00 63.25 1x5o s PRO 34 Cb -0.11 -2.24 1.16 0.00 0.04 0.00 0.00 34.50 33.34 1x5o s PRO 34 CO 0.23 -0.67 1.58 1.28 0.04 0.00 0.00 177.00 179.46 1x5o n LEU 35 N -0.82 0.00 -0.84 -3.56 4.77 -1.26 -1.96 117.00 113.33 1x5o n LEU 35 Ca 0.09 0.04 0.08 0.00 -0.03 0.00 0.00 56.01 56.19 1x5o n LEU 35 Cb 0.49 -0.04 0.18 0.00 -2.33 0.00 0.00 43.42 41.72 1x5o n LEU 35 CO 0.45 -0.01 0.64 -1.20 -1.33 0.00 0.00 177.39 175.93 1x5o n SER 36 N -1.04 3.05 -4.81 -1.43 7.64 -1.26 -4.73 113.62 111.04 1x5o n SER 36 Ca 0.14 -1.91 -0.32 0.00 1.01 0.00 0.00 58.87 57.80 1x5o n SER 36 Cb 0.08 -0.24 0.05 0.00 -1.01 0.00 0.00 64.21 63.08 1x5o n SER 36 CO 0.00 0.00 0.00 -0.32 -3.01 0.00 0.00 175.04 171.71 1x5o s MET 37 N -1.09 2.94 0.08 1.43 -2.45 -0.83 -4.96 119.30 114.42 1x5o s MET 37 Ca 0.29 1.07 0.02 0.00 -1.25 0.00 0.00 55.69 55.82 1x5o s MET 37 Cb 0.16 -1.99 -0.04 0.00 1.25 0.00 0.00 34.83 34.22 1x5o s MET 37 CO 0.22 -1.11 -0.07 0.16 1.05 0.00 0.00 175.02 175.27 1x5o s ASP 38 N -3.41 1.05 0.58 1.11 -4.77 -1.26 -5.01 116.67 104.96 1x5o s ASP 38 Ca 0.60 -0.87 0.30 0.00 -3.30 0.00 0.00 52.55 49.28 1x5o s ASP 38 Cb -0.15 0.08 1.40 0.00 -1.09 0.00 0.00 42.92 43.15 1x5o s ASP 38 CO 0.50 -0.39 1.78 -0.33 0.70 0.00 0.00 175.17 177.43 1x5o h GLU 39 N 3.43 0.00 0.29 2.11 5.08 -1.96 -0.57 114.58 122.97 1x5o h GLU 39 Ca -0.35 0.00 -0.01 0.00 -1.00 0.00 0.00 59.36 57.99 1x5o h GLU 39 Cb 1.18 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.43 1x5o h GLU 39 CO 0.57 0.00 -0.14 0.37 -1.00 0.00 0.00 179.01 178.81 1x5o h GLN 40 N 0.00 -0.38 0.31 2.33 4.15 -1.96 -3.25 115.11 116.31 1x5o h GLN 40 Ca 0.32 0.03 0.00 0.00 0.77 0.00 0.00 58.65 59.77 1x5o h GLN 40 Cb 1.66 0.09 -0.03 0.00 0.21 0.00 0.00 27.48 29.42 1x5o h GLN 40 CO -0.00 -0.04 -0.35 1.49 -1.93 0.00 0.00 178.83 178.00 1x5o h GLU 41 N -0.87 -0.67 -1.78 1.69 4.57 -1.53 0.13 114.58 116.12 1x5o h GLU 41 Ca -0.04 0.05 0.53 0.00 -1.18 0.00 0.00 59.36 58.71 1x5o h GLU 41 Cb 0.52 0.15 -0.08 0.00 -0.16 0.00 0.00 28.75 29.18 1x5o h GLU 41 CO 0.07 -0.45 1.26 -0.11 -1.18 0.00 0.00 179.01 178.60 1x5o n LEU 42 N -5.45 0.03 -0.08 1.64 7.94 -0.84 0.44 117.00 120.67 1x5o n LEU 42 Ca -0.09 0.98 -0.23 0.00 -1.11 0.00 0.00 56.01 55.57 1x5o n LEU 42 Cb 0.36 -0.49 -0.12 0.00 0.53 0.00 0.00 43.42 43.70 1x5o n LEU 42 CO 0.27 -1.00 -0.84 1.21 -1.11 0.00 0.00 177.39 175.92 1x5o n GLU 43 N -3.91 0.63 -0.29 1.96 2.13 -0.57 -3.93 120.64 116.66 1x5o n GLU 43 Ca 0.41 0.40 0.31 0.00 0.66 0.00 0.00 57.16 58.94 1x5o n GLU 43 Cb 1.84 -1.67 0.68 0.00 0.27 0.00 0.00 31.44 32.56 1x5o n GLU 43 CO 0.00 0.00 0.00 -0.91 -0.41 0.00 0.00 177.13 175.81 1x5o h ASN 44 N -0.61 0.11 1.01 4.31 2.35 0.27 1.38 115.58 124.39 1x5o h ASN 44 Ca -0.45 0.02 -0.15 0.00 -0.55 0.00 0.00 56.30 55.17 1x5o h ASN 44 Cb 1.62 0.00 -0.02 0.00 0.05 0.00 0.00 38.32 39.97 1x5o h ASN 44 CO -0.16 0.02 -0.70 0.00 -1.65 0.00 0.00 177.43 174.94 1x5o h MET 45 N 0.10 0.00 -0.01 0.81 -0.00 -1.25 -3.18 114.93 111.40 1x5o h MET 45 Ca 0.54 0.00 0.00 0.00 -0.00 0.00 0.00 59.70 60.24 1x5o h MET 45 Cb 1.96 0.00 0.00 0.00 -0.00 0.00 0.00 31.60 33.56 1x5o h MET 45 CO -0.08 0.70 -0.60 1.28 -0.00 0.00 0.00 176.91 178.21 1x5o n LEU 46 N -3.45 1.66 0.45 -0.10 4.77 0.30 -4.43 117.00 116.20 1x5o n LEU 46 Ca 0.00 -0.64 -0.18 0.00 -0.03 0.00 0.00 56.01 55.16 1x5o n LEU 46 Cb 0.75 -0.01 -0.09 0.00 -2.33 0.00 0.00 43.42 41.74 1x5o n LEU 46 CO 0.43 0.33 0.46 0.11 -1.33 0.00 0.00 177.39 177.39 1x5o h LYS 47 N 1.66 -1.12 0.00 3.23 1.57 0.14 -0.64 116.57 121.41 1x5o h LYS 47 Ca 0.00 0.08 0.00 0.00 -1.87 0.00 0.00 60.65 58.86 1x5o h LYS 47 Cb 0.67 0.25 0.00 0.00 0.08 0.00 0.00 32.23 33.23 1x5o h LYS 47 CO 0.00 -0.75 0.00 -0.35 -0.57 0.00 0.00 179.45 177.78 1x5o n PRO 48 N -5.55 0.49 -0.12 3.15 -0.04 -1.26 -2.86 135.00 128.82 1x5o n PRO 48 Ca -0.14 0.00 -0.21 0.00 -0.04 0.00 0.00 63.50 63.11 1x5o n PRO 48 Cb 0.46 -1.36 -0.09 0.00 -0.04 0.00 0.00 33.50 32.47 1x5o n PRO 48 CO 0.00 0.00 0.00 1.19 -0.04 0.00 0.00 175.50 176.65 1x5o n PHE 49 N -0.86 0.00 -3.82 0.54 3.01 -1.04 -5.10 117.46 110.18 1x5o n PHE 49 Ca 0.08 0.00 -0.02 0.00 1.01 0.00 0.00 57.45 58.53 1x5o n PHE 49 Cb 0.04 -0.85 0.01 0.00 -0.01 0.00 0.00 39.48 38.66 1x5o n PHE 49 CO 0.00 0.00 0.00 0.20 1.01 0.00 0.00 176.76 177.97 1x5o s GLY 50 N -5.78 -0.08 -0.73 1.37 0.00 -0.27 -4.91 107.32 96.92 1x5o s GLY 50 Ca -0.32 -0.03 -0.26 0.00 0.00 0.00 0.00 44.72 44.12 1x5o s GLY 50 CO 0.46 1.80 1.94 1.62 0.00 0.00 0.00 173.10 178.93 1x5o s GLN 51 N -2.48 2.53 -0.09 2.90 2.00 -1.26 -4.32 119.66 118.94 1x5o s GLN 51 Ca 0.19 0.27 -0.30 0.00 -2.00 0.00 0.00 55.36 53.53 1x5o s GLN 51 Cb -0.01 -4.69 -0.04 0.00 0.80 0.00 0.00 33.01 29.07 1x5o s GLN 51 CO 0.03 -3.09 1.47 0.08 -0.50 0.00 0.00 175.29 173.27 1x5o s VAL 52 N 9.87 3.88 -0.10 1.34 1.01 -1.26 -1.97 120.40 133.16 1x5o s VAL 52 Ca 0.71 1.09 -0.02 0.00 0.00 0.00 0.00 61.98 63.76 1x5o s VAL 52 Cb -0.10 -3.70 -0.02 0.00 0.00 0.00 0.00 36.38 32.56 1x5o s VAL 52 CO 0.12 -0.09 0.04 0.40 0.00 0.00 0.00 175.10 175.57 1x5o h ILE 53 N 5.47 0.10 -3.58 2.22 1.08 -0.35 -3.48 117.51 118.97 1x5o h ILE 53 Ca -0.34 -1.08 -0.12 0.00 -0.39 0.00 0.00 64.86 62.93 1x5o h ILE 53 Cb 1.15 0.19 -0.18 0.00 -3.07 0.00 0.00 36.82 34.91 1x5o h ILE 53 CO 0.95 0.03 -0.43 -0.94 -0.69 0.00 0.00 178.15 177.08 1x5o s SER 54 N -5.60 0.05 -0.00 1.72 1.04 -1.16 -4.99 113.70 104.76 1x5o s SER 54 Ca -0.02 -0.36 0.00 0.00 0.48 0.00 0.00 55.95 56.06 1x5o s SER 54 Cb -0.00 0.26 0.01 0.00 0.10 0.00 0.00 66.02 66.39 1x5o s SER 54 CO 0.05 -0.51 -0.00 0.42 0.98 0.00 0.00 173.24 174.18 1x5o s THR 55 N -2.31 0.04 0.03 2.02 -4.23 -1.26 -0.97 115.64 108.95 1x5o s THR 55 Ca -0.07 0.02 -0.02 0.00 -1.18 0.00 0.00 61.69 60.44 1x5o s THR 55 Cb -0.02 -0.06 -0.02 0.00 1.34 0.00 0.00 72.50 73.73 1x5o s THR 55 CO -0.03 0.03 0.00 -0.60 -0.54 0.00 0.00 174.62 173.49 1x5o s ARG 56 N 0.20 0.44 -0.16 3.99 3.52 -0.02 -4.98 118.95 121.94 1x5o s ARG 56 Ca -0.02 -0.77 0.01 0.00 -0.13 0.00 0.00 55.73 54.83 1x5o s ARG 56 Cb -0.03 0.16 0.02 0.00 -1.56 0.00 0.00 34.95 33.54 1x5o s ARG 56 CO -0.01 -0.09 -0.18 0.42 -0.81 0.00 0.00 175.30 174.64 1x5o s ILE 57 N -2.25 1.88 0.53 4.11 -1.09 -1.26 -0.03 121.20 123.09 1x5o s ILE 57 Ca -0.08 -0.84 -0.22 0.00 -2.23 0.00 0.00 60.65 57.27 1x5o s ILE 57 Cb -0.04 -1.71 -0.05 0.00 -1.58 0.00 0.00 42.46 39.08 1x5o s ILE 57 CO -0.04 0.51 1.35 -0.76 -1.23 0.00 0.00 174.94 174.77 1x5o s LEU 58 N 1.22 3.89 0.08 2.97 1.43 0.86 -4.96 118.68 124.17 1x5o s LEU 58 Ca 0.02 2.74 0.07 0.00 -1.03 0.00 0.00 54.13 55.93 1x5o s LEU 58 Cb -0.14 -4.24 -0.03 0.00 0.03 0.00 0.00 46.19 41.81 1x5o s LEU 58 CO -0.09 -1.48 -0.18 -0.13 0.23 0.00 0.00 176.35 174.70 1x5o s ARG 59 N -2.85 1.00 0.92 1.70 0.52 -1.26 -2.12 118.95 116.88 1x5o s ARG 59 Ca 0.70 -1.04 -0.13 0.00 -0.52 0.00 0.00 55.73 54.74 1x5o s ARG 59 Cb -0.40 -1.14 0.19 0.00 0.52 0.00 0.00 34.95 34.12 1x5o s ARG 59 CO 0.48 0.26 1.27 0.34 0.02 0.00 0.00 175.30 177.67 1x5o s ASP 60 N -1.74 3.27 0.17 0.23 2.15 0.71 -4.82 116.67 116.64 1x5o s ASP 60 Ca 0.03 0.11 -0.16 0.00 0.43 0.00 0.00 52.55 52.96 1x5o s ASP 60 Cb -0.10 -0.18 0.11 0.00 -0.30 0.00 0.00 42.92 42.45 1x5o s ASP 60 CO 0.03 -2.62 1.69 0.77 -0.17 0.00 0.00 175.17 174.88 1x5o h SER 61 N -1.46 -0.20 0.90 -0.34 4.64 -2.00 0.15 113.55 115.24 1x5o h SER 61 Ca -0.43 0.10 0.00 0.00 -0.47 0.00 0.00 61.79 60.99 1x5o h SER 61 Cb 1.23 0.18 0.00 0.00 -0.31 0.00 0.00 62.40 63.50 1x5o h SER 61 CO 0.37 -0.06 0.00 -1.28 -0.87 0.00 0.00 176.83 174.99 1x5o h SER 62 N 0.09 0.00 0.00 4.97 0.87 -2.03 -3.46 113.55 114.00 1x5o h SER 62 Ca 0.20 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.76 1x5o h SER 62 Cb 0.29 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 62.25 1x5o h SER 62 CO -0.34 0.00 0.00 0.61 -0.53 0.00 0.00 176.83 176.57 1x5o n GLY 63 N 0.02 2.00 3.50 5.77 0.00 0.51 -5.11 105.19 111.88 1x5o n GLY 63 Ca 0.01 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.70 1x5o n GLY 63 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1x5o s THR 64 N -2.00 3.80 0.26 2.61 2.01 -1.26 -4.68 115.64 116.39 1x5o s THR 64 Ca 0.00 -0.40 -0.18 0.00 0.31 0.00 0.00 61.69 61.42 1x5o s THR 64 Cb 0.00 -2.64 -0.13 0.00 0.01 0.00 0.00 72.50 69.74 1x5o s THR 64 CO 0.00 0.51 0.18 -0.24 -0.69 0.00 0.00 174.62 174.38 1x5o n SER 65 N 3.34 -1.83 -0.77 3.53 2.88 -1.26 -0.20 113.62 119.30 1x5o n SER 65 Ca -0.18 0.72 0.07 0.00 -1.33 0.00 0.00 58.87 58.16 1x5o n SER 65 Cb 0.53 -0.71 0.20 0.00 -0.75 0.00 0.00 64.21 63.48 1x5o n SER 65 CO 0.00 0.00 0.00 0.54 -1.23 0.00 0.00 175.04 174.35 1x5o n ARG 66 N 0.96 2.93 -1.95 -1.46 1.74 -0.90 -4.61 116.66 113.37 1x5o n ARG 66 Ca 0.11 -2.41 -0.15 0.00 -0.77 0.00 0.00 57.85 54.63 1x5o n ARG 66 Cb 0.27 -1.53 -0.03 0.00 -1.02 0.00 0.00 32.46 30.15 1x5o n ARG 66 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1x5o n GLY 67 N 0.09 0.46 2.78 -0.13 0.00 -1.25 -4.84 105.19 102.29 1x5o n GLY 67 Ca 0.16 -0.28 -0.19 0.00 0.00 0.00 0.00 46.02 45.71 1x5o n GLY 67 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1x5o s VAL 68 N -2.68 0.19 0.04 1.61 1.01 -1.26 -0.17 120.40 119.14 1x5o s VAL 68 Ca 0.00 0.15 0.07 0.00 0.00 0.00 0.00 61.98 62.21 1x5o s VAL 68 Cb 0.00 -0.33 -0.02 0.00 0.00 0.00 0.00 36.38 36.03 1x5o s VAL 68 CO 0.00 0.18 -0.21 -0.83 0.00 0.00 0.00 175.10 174.24 1x5o s GLY 69 N 1.49 1.14 -0.30 4.51 0.00 0.66 -0.10 107.32 114.72 1x5o s GLY 69 Ca -0.03 -1.06 -0.07 0.00 0.00 0.00 0.00 44.72 43.55 1x5o s GLY 69 CO -0.03 -0.98 0.09 -1.36 0.00 0.00 0.00 173.10 170.83 1x5o s PHE 70 N -0.77 3.15 0.12 1.90 0.40 0.95 -2.56 117.98 121.17 1x5o s PHE 70 Ca 0.08 -0.89 0.07 0.00 -0.60 0.00 0.00 56.93 55.59 1x5o s PHE 70 Cb -0.09 -2.27 -0.04 0.00 0.51 0.00 0.00 43.02 41.13 1x5o s PHE 70 CO 0.02 -0.55 -0.08 0.00 0.70 0.00 0.00 175.22 175.31 1x5o s ALA 71 N 1.52 3.03 -0.26 5.36 0.00 -1.06 -0.84 121.76 129.52 1x5o s ALA 71 Ca 0.03 -1.26 -0.00 0.00 0.00 0.00 0.00 51.96 50.73 1x5o s ALA 71 Cb -0.17 -0.93 0.07 0.00 0.00 0.00 0.00 23.12 22.09 1x5o s ALA 71 CO 0.03 0.62 0.02 0.50 0.00 0.00 0.00 175.76 176.93 1x5o s ARG 72 N -2.35 1.13 0.82 0.00 3.52 -0.14 0.98 118.95 122.90 1x5o s ARG 72 Ca 0.23 -0.96 -0.12 0.00 -0.13 0.00 0.00 55.73 54.75 1x5o s ARG 72 Cb -0.11 -2.37 0.08 0.00 -1.56 0.00 0.00 34.95 30.99 1x5o s ARG 72 CO 0.15 -0.75 1.13 -1.64 -0.81 0.00 0.00 175.30 173.38 1x5o s MET 73 N 1.52 1.94 0.52 5.12 -1.94 -0.72 0.38 119.30 126.12 1x5o s MET 73 Ca 0.01 0.39 0.34 0.00 -1.71 0.00 0.00 55.69 54.72 1x5o s MET 73 Cb -0.18 -1.92 1.57 0.00 2.01 0.00 0.00 34.83 36.30 1x5o s MET 73 CO -0.12 -1.67 2.02 1.05 -0.01 0.00 0.00 175.02 176.29 1x5o h GLU 74 N -1.12 0.00 -1.86 2.03 4.11 -1.71 -3.43 114.58 112.61 1x5o h GLU 74 Ca -0.47 0.00 0.26 0.00 0.07 0.00 0.00 59.36 59.21 1x5o h GLU 74 Cb 1.30 0.00 -0.10 0.00 0.50 0.00 0.00 28.75 30.44 1x5o h GLU 74 CO 0.62 0.00 0.67 -1.12 0.07 0.00 0.00 179.01 179.25 1x5o s SER 75 N -5.24 -0.12 0.35 3.06 0.01 -1.26 -5.03 113.70 105.48 1x5o s SER 75 Ca -0.00 -0.25 0.16 0.00 1.31 0.00 0.00 55.95 57.17 1x5o s SER 75 Cb 0.10 0.31 0.63 0.00 0.21 0.00 0.00 66.02 67.27 1x5o s SER 75 CO 0.47 -0.58 1.72 0.74 0.41 0.00 0.00 173.24 176.00 1x5o h THR 76 N 2.00 1.05 -0.90 1.44 2.02 -1.89 -3.08 112.91 113.55 1x5o h THR 76 Ca -0.27 -1.62 0.03 0.00 0.77 0.00 0.00 66.41 65.32 1x5o h THR 76 Cb 1.22 1.94 -0.05 0.00 -1.74 0.00 0.00 68.15 69.52 1x5o h THR 76 CO 0.27 0.42 0.58 -0.08 0.37 0.00 0.00 175.52 177.08 1x5o h GLU 77 N 0.00 1.11 -0.12 6.66 4.81 -1.99 -2.07 114.58 122.98 1x5o h GLU 77 Ca -0.00 -0.07 -0.15 0.00 -0.13 0.00 0.00 59.36 59.01 1x5o h GLU 77 Cb 0.91 -0.25 -0.01 0.00 0.63 0.00 0.00 28.75 30.03 1x5o h GLU 77 CO 0.06 0.74 -0.58 0.87 -0.73 0.00 0.00 179.01 179.36 1x5o h LYS 78 N 1.15 0.37 -0.30 1.92 1.79 -1.95 -3.25 116.57 116.29 1x5o h LYS 78 Ca 0.35 -0.24 0.07 0.00 -2.18 0.00 0.00 60.65 58.65 1x5o h LYS 78 Cb -0.03 0.03 -0.08 0.00 -1.58 0.00 0.00 32.23 30.58 1x5o h LYS 78 CO -0.11 0.84 -0.29 0.00 -1.08 0.00 0.00 179.45 178.82 1x5o h GLU 80 N -0.27 0.05 -0.03 0.00 5.08 -1.57 0.61 114.58 118.45 1x5o h GLU 80 Ca 0.15 -0.00 -0.00 0.00 -1.00 0.00 0.00 59.36 58.51 1x5o h GLU 80 Cb 0.51 -0.01 -0.00 0.00 0.50 0.00 0.00 28.75 29.75 1x5o h GLU 80 CO -0.45 0.03 0.02 0.00 -1.00 0.00 0.00 179.01 177.61 1x5o h ALA 81 N 1.96 0.04 0.42 3.43 0.00 -1.25 0.27 119.26 124.13 1x5o h ALA 81 Ca 0.73 -0.04 -0.02 0.00 0.00 0.00 0.00 54.91 55.58 1x5o h ALA 81 Cb 1.77 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 19.55 1x5o h ALA 81 CO -0.80 -0.42 -0.20 0.28 0.00 0.00 0.00 179.25 178.11 1x5o h VAL 82 N -0.02 0.43 0.10 0.00 2.07 0.16 -2.43 116.25 116.56 1x5o h VAL 82 Ca 0.01 -0.56 0.02 0.00 0.82 0.00 0.00 66.70 67.00 1x5o h VAL 82 Cb 0.07 0.63 -0.04 0.00 -1.52 0.00 0.00 31.29 30.44 1x5o h VAL 82 CO -0.00 0.08 -0.31 0.40 0.02 0.00 0.00 177.57 177.76 1x5o h ILE 83 N -0.95 0.34 -0.95 4.57 2.04 -0.34 1.25 117.51 123.46 1x5o h ILE 83 Ca -0.06 0.00 0.20 0.00 1.00 0.00 0.00 64.86 66.00 1x5o h ILE 83 Cb 0.56 0.34 -0.08 0.00 -0.74 0.00 0.00 36.82 36.90 1x5o h ILE 83 CO 0.09 0.00 0.61 1.23 0.00 0.00 0.00 178.15 180.08 1x5o h GLY 84 N -0.51 1.26 0.00 5.37 0.00 -0.55 0.13 103.07 108.76 1x5o h GLY 84 Ca 0.04 -0.27 0.00 0.00 0.00 0.00 0.00 47.33 47.10 1x5o h GLY 84 CO -0.19 -0.02 0.00 1.57 0.00 0.00 0.00 176.54 177.90 1x5o n HIS 85 N -4.61 0.00 -0.33 5.60 -0.00 -0.70 -4.35 115.22 110.83 1x5o n HIS 85 Ca 0.21 0.00 0.18 0.00 -0.00 0.00 0.00 57.72 58.11 1x5o n HIS 85 Cb 0.64 -0.29 0.35 0.00 -0.00 0.00 0.00 29.99 30.69 1x5o n HIS 85 CO 0.00 0.00 0.00 1.19 -0.00 0.00 0.00 176.34 177.53 1x5o n PHE 86 N -2.02 0.74 -1.51 1.57 3.01 0.42 -4.00 117.46 115.68 1x5o n PHE 86 Ca 0.00 1.16 -0.17 0.00 1.01 0.00 0.00 57.45 59.45 1x5o n PHE 86 Cb 0.00 -1.30 -0.15 0.00 -0.01 0.00 0.00 39.48 38.02 1x5o n PHE 86 CO 0.00 0.00 0.00 -1.71 1.01 0.00 0.00 176.76 176.06 1x5o n ASN 87 N -5.38 0.05 0.00 4.37 5.15 0.44 0.90 115.26 120.79 1x5o n ASN 87 Ca 0.26 -1.08 0.00 0.00 -0.60 0.00 0.00 54.58 53.16 1x5o n ASN 87 Cb 0.87 -1.08 0.00 0.00 -0.53 0.00 0.00 39.78 39.04 1x5o n ASN 87 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 1x5o n GLY 88 N 6.06 1.73 3.41 8.20 0.00 -1.02 -4.96 105.19 118.62 1x5o n GLY 88 Ca 0.55 -0.13 -0.22 0.00 0.00 0.00 0.00 46.02 46.22 1x5o n GLY 88 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1x5o s LYS 89 N -1.40 1.50 -0.13 1.61 -0.14 0.26 -4.89 119.74 116.55 1x5o s LYS 89 Ca 0.00 -1.66 0.02 0.00 -1.36 0.00 0.00 55.97 52.97 1x5o s LYS 89 Cb 0.00 -1.47 -0.00 0.00 -1.68 0.00 0.00 37.83 34.67 1x5o s LYS 89 CO 0.00 0.27 -0.18 -0.06 -0.76 0.00 0.00 175.35 174.61 1x5o s PHE 90 N -2.63 2.71 0.08 3.18 0.40 -1.26 -0.59 117.98 119.86 1x5o s PHE 90 Ca 0.26 -1.02 -0.16 0.00 -0.60 0.00 0.00 56.93 55.41 1x5o s PHE 90 Cb -0.03 -1.82 -0.06 0.00 0.51 0.00 0.00 43.02 41.61 1x5o s PHE 90 CO 0.11 -0.43 0.52 0.96 0.70 0.00 0.00 175.22 177.07 1x5o s ILE 91 N 0.59 4.86 0.62 0.64 -4.36 -1.26 -5.06 121.20 117.23 1x5o s ILE 91 Ca -0.10 0.96 -0.12 0.00 -0.26 0.00 0.00 60.65 61.13 1x5o s ILE 91 Cb -0.16 -3.79 -0.04 0.00 1.25 0.00 0.00 42.46 39.72 1x5o s ILE 91 CO 0.03 0.44 1.03 -0.54 0.24 0.00 0.00 174.94 176.15 1x5o s LYS 92 N -1.43 3.54 0.13 0.37 1.02 -1.26 -4.83 119.74 117.28 1x5o s LYS 92 Ca 0.31 0.83 0.07 0.00 0.02 0.00 0.00 55.97 57.20 1x5o s LYS 92 Cb -0.17 -2.07 -0.04 0.00 -0.52 0.00 0.00 37.83 35.03 1x5o s LYS 92 CO 0.18 -0.62 -0.17 0.95 -0.92 0.00 0.00 175.35 174.77 1x5o s THR 93 N -3.06 1.57 0.98 2.17 -4.23 -1.26 -5.11 115.64 106.70 1x5o s THR 93 Ca 0.56 -1.73 -0.12 0.00 -1.18 0.00 0.00 61.69 59.23 1x5o s THR 93 Cb -0.11 -1.62 0.18 0.00 1.34 0.00 0.00 72.50 72.28 1x5o s THR 93 CO 0.50 -0.29 1.09 -2.16 -0.54 0.00 0.00 174.62 173.22 1x5o s PRO 94 N -2.50 0.60 -0.67 3.99 0.04 -1.26 -4.91 135.00 130.30 1x5o s PRO 94 Ca 0.10 0.58 -0.26 0.00 0.04 0.00 0.00 61.00 61.46 1x5o s PRO 94 Cb -0.07 -1.75 -0.03 0.00 0.04 0.00 0.00 34.50 32.70 1x5o s PRO 94 CO 0.04 -2.63 1.88 -1.25 0.04 0.00 0.00 177.00 175.08 1x5o s PRO 95 N -4.96 2.61 0.00 0.56 0.04 -1.26 -2.44 135.00 129.55 1x5o s PRO 95 Ca 0.65 0.44 0.00 0.00 0.04 0.00 0.00 61.00 62.13 1x5o s PRO 95 Cb -0.18 -4.51 0.00 0.00 0.04 0.00 0.00 34.50 29.84 1x5o s PRO 95 CO 0.57 -2.86 0.00 0.41 0.04 0.00 0.00 177.00 175.17 1x5o n GLY 96 N 5.92 0.78 3.68 0.56 0.00 -1.26 -5.13 105.19 109.73 1x5o n GLY 96 Ca 0.24 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.91 1x5o n GLY 96 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1x5o s VAL 97 N -0.44 4.40 -0.10 1.61 1.01 -1.02 -5.07 120.40 120.79 1x5o s VAL 97 Ca 0.00 -0.21 -0.29 0.00 0.00 0.00 0.00 61.98 61.48 1x5o s VAL 97 Cb 0.00 -2.87 -0.04 0.00 0.00 0.00 0.00 36.38 33.47 1x5o s VAL 97 CO 0.00 0.59 1.50 -0.44 0.00 0.00 0.00 175.10 176.75 1x5o s SER 98 N -0.71 6.78 0.21 3.32 0.01 -1.26 -4.78 113.70 117.27 1x5o s SER 98 Ca 0.11 2.02 -0.30 0.00 1.31 0.00 0.00 55.95 59.09 1x5o s SER 98 Cb -0.12 -2.54 -0.08 0.00 0.21 0.00 0.00 66.02 63.50 1x5o s SER 98 CO 0.02 -0.86 1.12 0.00 0.41 0.00 0.00 173.24 173.93 1x5o s ALA 99 N 3.82 3.39 0.77 1.44 0.00 -1.26 -4.76 121.76 125.17 1x5o s ALA 99 Ca 0.66 0.87 -0.10 0.00 0.00 0.00 0.00 51.96 53.38 1x5o s ALA 99 Cb -0.29 -3.36 0.06 0.00 0.00 0.00 0.00 23.12 19.53 1x5o s ALA 99 CO 0.24 -0.23 1.09 -1.25 0.00 0.00 0.00 175.76 175.61 1x5o s PRO 100 N -0.63 2.25 -0.08 0.00 0.04 -1.26 -5.00 135.00 130.32 1x5o s PRO 100 Ca 0.49 1.17 0.12 0.00 0.04 0.00 0.00 61.00 62.82 1x5o s PRO 100 Cb -0.31 -1.90 -0.17 0.00 0.04 0.00 0.00 34.50 32.17 1x5o s PRO 100 CO 0.37 -1.65 0.14 2.41 0.04 0.00 0.00 177.00 178.31 1x5o n THR 101 N -3.53 0.51 -3.54 1.26 -1.04 -1.26 -5.00 114.28 101.68 1x5o n THR 101 Ca 0.09 -0.43 -0.33 0.00 -2.04 0.00 0.00 64.05 61.34 1x5o n THR 101 Cb 0.53 -0.33 -0.05 0.00 -1.82 0.00 0.00 70.33 68.66 1x5o n THR 101 CO 0.00 0.00 0.00 -1.61 -0.64 0.00 0.00 175.07 172.82 1x5o s GLU 102 N -2.54 3.74 0.81 -2.82 2.02 -1.26 -5.08 118.70 113.56 1x5o s GLU 102 Ca -0.06 0.13 -0.11 0.00 0.02 0.00 0.00 54.97 54.96 1x5o s GLU 102 Cb 0.06 -2.82 0.08 0.00 0.10 0.00 0.00 34.13 31.54 1x5o s GLU 102 CO 0.52 0.44 1.09 -1.25 0.02 0.00 0.00 175.26 176.08 1x5o s PRO 103 N -2.48 1.96 -0.31 0.39 0.04 -1.26 -4.92 135.00 128.42 1x5o s PRO 103 Ca 0.41 1.06 -0.28 0.00 0.04 0.00 0.00 61.00 62.24 1x5o s PRO 103 Cb -0.12 -1.87 0.01 0.00 0.04 0.00 0.00 34.50 32.56 1x5o s PRO 103 CO 0.22 -1.82 1.00 -0.51 0.04 0.00 0.00 177.00 175.93 1x5o s LEU 104 N -6.01 3.99 -0.59 -3.56 1.43 0.24 -4.66 118.68 109.52 1x5o s LEU 104 Ca 0.62 0.97 -0.23 0.00 -1.03 0.00 0.00 54.13 54.46 1x5o s LEU 104 Cb -0.17 -3.42 0.05 0.00 0.03 0.00 0.00 46.19 42.68 1x5o s LEU 104 CO 0.56 -0.80 0.94 -0.22 0.23 0.00 0.00 176.35 177.06 1x5o s LEU 105 N 3.45 4.24 -0.17 1.79 2.96 -1.04 -2.43 118.68 127.48 1x5o s LEU 105 Ca 0.42 -0.63 -0.07 0.00 -0.22 0.00 0.00 54.13 53.63 1x5o s LEU 105 Cb -0.13 -2.64 -0.04 0.00 0.50 0.00 0.00 46.19 43.88 1x5o s LEU 105 CO 0.14 -1.30 0.07 0.00 -1.32 0.00 0.00 176.35 173.94 1x5o s LYS 107 N 0.09 1.00 -0.20 0.00 -2.85 -0.23 -4.70 119.74 112.85 1x5o s LYS 107 Ca 0.05 0.29 -0.29 0.00 -1.00 0.00 0.00 55.97 55.03 1x5o s LYS 107 Cb -0.12 0.47 -0.06 0.00 -2.06 0.00 0.00 37.83 36.06 1x5o s LYS 107 CO 0.01 -0.29 2.20 1.19 0.10 0.00 0.00 175.35 178.55 1x5o n PHE 108 N 1.12 2.00 -1.28 1.78 3.72 -1.26 0.14 117.46 123.68 1x5o n PHE 108 Ca -0.19 -0.13 -0.30 0.00 -0.05 0.00 0.00 57.45 56.79 1x5o n PHE 108 Cb 0.57 -2.72 0.12 0.00 -0.94 0.00 0.00 39.48 36.51 1x5o n PHE 108 CO 0.00 0.00 0.00 0.45 -0.05 0.00 0.00 176.76 177.16 1x5o s SER 109 N 7.84 3.82 0.00 4.37 0.15 -1.24 -4.80 113.70 123.84 1x5o s SER 109 Ca 1.00 1.50 0.00 0.00 0.70 0.00 0.00 55.95 59.16 1x5o s SER 109 Cb -0.38 -2.20 0.00 0.00 -1.71 0.00 0.00 66.02 61.73 1x5o s SER 109 CO 0.37 -2.42 0.00 0.61 1.20 0.00 0.00 173.24 173.00 1x5o n GLY 110 N -1.32 -3.32 3.73 9.45 0.00 -1.26 -4.67 105.19 107.80 1x5o n GLY 110 Ca 0.07 -1.16 -0.30 0.00 0.00 0.00 0.00 46.02 44.64 1x5o n GLY 110 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1x5o s PRO 111 N 0.00 1.46 0.17 1.61 0.04 -1.26 -4.49 135.00 132.53 1x5o s PRO 111 Ca 0.00 0.89 -0.32 0.00 0.04 0.00 0.00 61.00 61.62 1x5o s PRO 111 Cb 0.00 -1.83 -0.17 0.00 0.04 0.00 0.00 34.50 32.55 1x5o s PRO 111 CO 0.00 -2.12 0.89 0.45 0.04 0.00 0.00 177.00 176.26 1x5o n SER 112 N -3.81 0.16 0.13 6.66 2.88 -1.25 -4.88 113.62 113.52 1x5o n SER 112 Ca 0.07 1.15 -0.11 0.00 -1.33 0.00 0.00 58.87 58.65 1x5o n SER 112 Cb 0.55 -1.08 -0.07 0.00 -0.75 0.00 0.00 64.21 62.86 1x5o n SER 112 CO 0.00 0.00 0.00 -1.28 -1.23 0.00 0.00 175.04 172.53 1x5o h SER 113 N 2.23 -0.33 0.00 -3.46 0.87 -1.94 -3.50 113.55 107.43 1x5o h SER 113 Ca -0.39 -0.20 0.00 0.00 -1.23 0.00 0.00 61.79 59.98 1x5o h SER 113 Cb 1.39 0.09 0.00 0.00 -0.44 0.00 0.00 62.40 63.44 1x5o h SER 113 CO 0.63 0.13 0.00 0.61 -0.53 0.00 0.00 176.83 177.67