#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2doc s SER 2 N 0.00 5.74 -1.31 1.61 1.04 -1.26 -3.97 113.70 115.54 2doc s SER 2 Ca 0.00 -0.54 -0.10 0.00 0.48 0.00 0.00 55.95 55.79 2doc s SER 2 Cb 0.00 -2.55 0.00 0.00 0.10 0.00 0.00 66.02 63.57 2doc s SER 2 CO 0.00 -2.14 0.54 -1.20 0.98 0.00 0.00 173.24 171.42 2doc n SER 3 N 11.38 -2.16 -4.04 7.02 7.64 -1.26 -4.97 113.62 127.22 2doc n SER 3 Ca 0.25 -1.05 -0.17 0.00 1.01 0.00 0.00 58.87 58.90 2doc n SER 3 Cb 0.50 -2.97 -0.14 0.00 -1.01 0.00 0.00 64.21 60.59 2doc n SER 3 CO 0.00 0.00 0.00 -0.83 -3.01 0.00 0.00 175.04 171.20 2doc s GLY 4 N -4.02 0.49 0.47 0.23 0.00 -1.26 -5.16 107.32 98.08 2doc s GLY 4 Ca 0.19 -0.51 0.04 0.00 0.00 0.00 0.00 44.72 44.44 2doc s GLY 4 CO 0.89 -0.47 0.04 -0.56 0.00 0.00 0.00 173.10 173.00 2doc s SER 5 N -0.60 4.10 -0.02 1.64 0.01 -1.26 -4.24 113.70 113.33 2doc s SER 5 Ca 0.01 -1.50 -0.11 0.00 1.31 0.00 0.00 55.95 55.66 2doc s SER 5 Cb -0.05 0.15 -0.05 0.00 0.21 0.00 0.00 66.02 66.28 2doc s SER 5 CO 0.00 -0.72 0.33 -0.55 0.41 0.00 0.00 173.24 172.71 2doc s SER 6 N -3.85 6.65 0.00 2.44 0.15 -1.26 -4.78 113.70 113.05 2doc s SER 6 Ca 0.19 0.78 0.00 0.00 0.70 0.00 0.00 55.95 57.62 2doc s SER 6 Cb 0.04 -2.18 0.00 0.00 -1.71 0.00 0.00 66.02 62.17 2doc s SER 6 CO 0.10 0.32 0.00 0.61 1.20 0.00 0.00 173.24 175.47 2doc n GLY 7 N 1.67 1.45 3.42 9.45 0.00 -1.26 -4.96 105.19 114.95 2doc n GLY 7 Ca -0.14 -0.84 -0.27 0.00 0.00 0.00 0.00 46.02 44.77 2doc n GLY 7 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2doc n GLN 8 N 0.00 -0.91 -2.40 1.61 10.64 -1.26 -4.75 117.38 120.31 2doc n GLN 8 Ca 0.00 0.09 -0.37 0.00 -1.83 0.00 0.00 57.00 54.89 2doc n GLN 8 Cb 0.00 -3.13 0.02 0.00 -0.86 0.00 0.00 30.24 26.27 2doc n GLN 8 CO 0.00 0.00 0.00 -0.85 -1.83 0.00 0.00 177.06 174.38 2doc n GLU 9 N -2.79 3.86 -0.05 2.61 0.28 -1.26 -4.31 120.64 118.98 2doc n GLU 9 Ca 0.07 -4.26 -0.07 0.00 -0.16 0.00 0.00 57.16 52.74 2doc n GLU 9 Cb 0.30 -2.33 -0.04 0.00 1.43 0.00 0.00 31.44 30.80 2doc n GLU 9 CO 0.00 0.00 0.00 2.48 -0.16 0.00 0.00 177.13 179.45 2doc n TYR 10 N -0.32 0.00 0.00 -1.84 4.11 -1.26 -4.85 117.16 112.99 2doc n TYR 10 Ca 0.46 0.00 0.00 0.00 -0.00 0.00 0.00 57.90 58.36 2doc n TYR 10 Cb 0.33 -0.37 0.00 0.00 -0.00 0.00 0.00 39.34 39.30 2doc n TYR 10 CO 0.00 0.00 0.00 -0.89 -0.00 0.00 0.00 176.86 175.97 2doc n ILE 11 N -2.88 0.00 0.03 -3.48 2.08 -1.26 -4.62 119.36 109.23 2doc n ILE 11 Ca -0.17 0.00 0.18 0.00 0.56 0.00 0.00 62.75 63.32 2doc n ILE 11 Cb 0.68 -0.74 0.42 0.00 -0.75 0.00 0.00 39.64 39.25 2doc n ILE 11 CO 0.00 0.00 0.00 -0.07 0.56 0.00 0.00 176.55 177.04 2doc h LEU 12 N 0.00 0.00 0.14 1.39 3.38 -1.92 1.28 115.31 119.59 2doc h LEU 12 Ca 0.00 0.00 -0.34 0.00 0.09 0.00 0.00 57.88 57.63 2doc h LEU 12 Cb 0.65 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.39 2doc h LEU 12 CO 0.00 0.00 -1.76 0.00 0.09 0.00 0.00 178.44 176.77 2doc h ALA 13 N 0.65 0.29 -0.36 1.53 0.00 -1.85 -3.32 119.26 116.20 2doc h ALA 13 Ca 0.27 -1.22 0.00 0.00 0.00 0.00 0.00 54.91 53.96 2doc h ALA 13 Cb 2.14 0.48 0.00 0.00 0.00 0.00 0.00 17.79 20.41 2doc h ALA 13 CO -0.00 1.16 0.00 1.28 0.00 0.00 0.00 179.25 181.69 2doc n LEU 14 N -3.50 3.33 0.00 0.00 4.77 0.42 -4.92 117.00 117.11 2doc n LEU 14 Ca -0.24 -1.68 -0.25 0.00 -0.03 0.00 0.00 56.01 53.81 2doc n LEU 14 Cb 1.06 -0.52 0.17 0.00 -2.33 0.00 0.00 43.42 41.80 2doc n LEU 14 CO 0.49 0.50 0.73 0.00 -1.33 0.00 0.00 177.39 177.78 2doc n ALA 15 N 0.47 -1.27 -3.64 -1.18 0.00 0.16 -4.96 120.51 110.11 2doc n ALA 15 Ca 0.16 -1.45 -0.04 0.00 0.00 0.00 0.00 53.44 52.10 2doc n ALA 15 Cb 0.67 -0.07 0.01 0.00 0.00 0.00 0.00 19.45 20.06 2doc n ALA 15 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.50 177.25 2doc n ASP 16 N -3.71 -1.43 -4.49 0.00 9.92 0.74 -4.97 116.55 112.61 2doc n ASP 16 Ca 0.14 -2.23 -0.28 0.00 -0.53 0.00 0.00 54.79 51.89 2doc n ASP 16 Cb 0.48 2.45 -0.11 0.00 -0.64 0.00 0.00 41.12 43.31 2doc n ASP 16 CO 0.00 0.00 0.00 0.68 0.13 0.00 0.00 177.20 178.01 2doc s VAL 17 N -2.48 2.77 0.65 2.53 -7.23 -1.26 -4.45 120.40 110.94 2doc s VAL 17 Ca 0.15 -1.72 -0.15 0.00 -1.81 0.00 0.00 61.98 58.45 2doc s VAL 17 Cb -0.03 -2.32 -0.00 0.00 0.56 0.00 0.00 36.38 34.59 2doc s VAL 17 CO 0.11 -0.03 1.11 -2.16 -0.31 0.00 0.00 175.10 173.82 2doc s PRO 18 N -2.50 2.83 0.63 4.82 0.04 0.41 -4.24 135.00 137.00 2doc s PRO 18 Ca 0.21 1.40 -0.08 0.00 0.04 0.00 0.00 61.00 62.56 2doc s PRO 18 Cb -0.09 -1.95 0.00 0.00 0.04 0.00 0.00 34.50 32.50 2doc s PRO 18 CO 0.11 -1.23 0.98 0.45 0.04 0.00 0.00 177.00 177.35 2doc s SER 19 N -2.55 5.67 0.25 6.66 0.15 -1.26 -3.98 113.70 118.63 2doc s SER 19 Ca 0.67 0.96 -0.31 0.00 0.70 0.00 0.00 55.95 57.97 2doc s SER 19 Cb -0.21 -1.92 -0.13 0.00 -1.71 0.00 0.00 66.02 62.06 2doc s SER 19 CO 0.41 -1.10 1.49 -1.54 1.20 0.00 0.00 173.24 173.70 2doc n SER 20 N -2.73 3.17 -4.72 5.45 3.41 -1.26 -4.69 113.62 112.26 2doc n SER 20 Ca 0.05 1.14 -0.30 0.00 -0.26 0.00 0.00 58.87 59.50 2doc n SER 20 Cb 0.57 -1.48 0.14 0.00 -0.26 0.00 0.00 64.21 63.17 2doc n SER 20 CO 0.00 0.00 0.00 -2.16 -0.16 0.00 0.00 175.04 172.72 2doc s PRO 21 N -0.28 1.21 0.32 4.33 0.04 -1.26 -4.84 135.00 134.51 2doc s PRO 21 Ca 0.68 0.80 0.07 0.00 0.04 0.00 0.00 61.00 62.58 2doc s PRO 21 Cb -0.60 -1.81 -0.03 0.00 0.04 0.00 0.00 34.50 32.11 2doc s PRO 21 CO 0.48 -2.27 0.24 2.48 0.04 0.00 0.00 177.00 177.97 2doc n TYR 22 N -3.90 -0.61 0.00 0.56 0.18 -1.21 -4.78 117.16 107.40 2doc n TYR 22 Ca 0.07 -2.57 0.00 0.00 1.88 0.00 0.00 57.90 57.27 2doc n TYR 22 Cb 0.55 0.23 0.00 0.00 -0.38 0.00 0.00 39.34 39.74 2doc n TYR 22 CO 0.00 0.00 0.00 0.41 -2.08 0.00 0.00 176.86 175.19 2doc n GLY 23 N -0.59 2.94 3.33 -7.48 0.00 -1.26 -0.35 105.19 101.78 2doc n GLY 23 Ca 0.05 0.00 -0.57 0.00 0.00 0.00 0.00 46.02 45.51 2doc n GLY 23 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 2doc n VAL 24 N -2.00 0.00 -3.50 1.61 0.31 -1.25 -4.49 118.33 109.01 2doc n VAL 24 Ca 0.00 0.00 -0.14 0.00 -0.01 0.00 0.00 64.34 64.19 2doc n VAL 24 Cb 0.00 -0.05 -0.04 0.00 -0.91 0.00 0.00 33.84 32.84 2doc n VAL 24 CO 0.00 0.00 0.00 -1.59 -1.32 0.00 0.00 176.83 173.92 2doc s LYS 25 N 0.29 1.03 -0.83 5.55 -2.85 -0.47 -4.95 119.74 117.51 2doc s LYS 25 Ca 0.87 -0.01 -0.08 0.00 -1.00 0.00 0.00 55.97 55.75 2doc s LYS 25 Cb -1.22 0.48 0.21 0.00 -2.06 0.00 0.00 37.83 35.24 2doc s LYS 25 CO 0.56 -0.38 0.73 0.42 0.10 0.00 0.00 175.35 176.79 2doc s ILE 26 N -2.07 4.96 0.10 3.79 -1.09 -1.26 0.17 121.20 125.80 2doc s ILE 26 Ca -0.05 -2.98 -0.15 0.00 -2.23 0.00 0.00 60.65 55.25 2doc s ILE 26 Cb -0.00 -4.09 -0.09 0.00 -1.58 0.00 0.00 42.46 36.69 2doc s ILE 26 CO 0.01 -1.02 1.40 0.16 -1.23 0.00 0.00 174.94 174.25 2doc h ILE 27 N 4.62 1.30 -3.46 2.92 3.07 -1.94 -3.40 117.51 120.64 2doc h ILE 27 Ca 0.09 -1.52 -0.70 0.00 1.55 0.00 0.00 64.86 64.29 2doc h ILE 27 Cb 0.95 1.65 -0.34 0.00 -0.27 0.00 0.00 36.82 38.81 2doc h ILE 27 CO 0.80 0.48 -0.52 -1.61 -1.05 0.00 0.00 178.15 176.25 2doc s GLU 28 N -4.27 2.07 -0.20 0.16 2.02 -1.26 -5.05 118.70 112.18 2doc s GLU 28 Ca -0.12 -1.82 -0.05 0.00 0.02 0.00 0.00 54.97 53.00 2doc s GLU 28 Cb 0.09 -3.63 -0.02 0.00 0.10 0.00 0.00 34.13 30.66 2doc s GLU 28 CO 0.84 -1.09 -0.01 -1.17 0.02 0.00 0.00 175.26 173.84 2doc s LEU 29 N 1.16 3.18 0.00 1.80 2.96 -1.26 -0.25 118.68 126.26 2doc s LEU 29 Ca 0.08 -0.24 0.01 0.00 -0.22 0.00 0.00 54.13 53.76 2doc s LEU 29 Cb -0.23 -1.81 0.01 0.00 0.50 0.00 0.00 46.19 44.66 2doc s LEU 29 CO -0.04 0.05 0.06 -1.20 -1.32 0.00 0.00 176.35 173.90 2doc n SER 30 N 4.33 2.94 0.11 3.68 7.64 -0.48 -4.84 113.62 127.01 2doc n SER 30 Ca -0.17 -2.65 0.04 0.00 1.01 0.00 0.00 58.87 57.10 2doc n SER 30 Cb 0.52 0.21 0.01 0.00 -1.01 0.00 0.00 64.21 63.94 2doc n SER 30 CO 0.00 0.00 0.00 0.06 -3.01 0.00 0.00 175.04 172.09 2doc h GLN 31 N 0.00 0.00 0.00 1.43 -0.00 -1.92 -2.38 115.11 112.25 2doc h GLN 31 Ca -0.31 0.00 -0.04 0.00 -0.00 0.00 0.00 58.65 58.30 2doc h GLN 31 Cb 0.97 0.00 -0.01 0.00 -0.00 0.00 0.00 27.48 28.45 2doc h GLN 31 CO 0.51 0.33 -1.15 0.25 -0.00 0.00 0.00 178.83 178.77 2doc n THR 32 N -3.05 0.15 -3.86 1.86 -2.24 -1.26 -2.68 114.28 103.19 2doc n THR 32 Ca -0.01 -0.08 -0.23 0.00 -2.27 0.00 0.00 64.05 61.46 2doc n THR 32 Cb 0.72 -0.82 -0.05 0.00 -2.10 0.00 0.00 70.33 68.08 2doc n THR 32 CO 0.00 0.00 0.00 0.42 -0.57 0.00 0.00 175.07 174.92 2doc s THR 33 N -2.05 2.41 -0.30 4.28 -4.23 -1.26 -2.27 115.64 112.22 2doc s THR 33 Ca -0.02 -1.52 -0.08 0.00 -1.18 0.00 0.00 61.69 58.89 2doc s THR 33 Cb 0.01 -2.93 0.16 0.00 1.34 0.00 0.00 72.50 71.08 2doc s THR 33 CO 0.08 0.00 0.74 0.00 -0.54 0.00 0.00 174.62 174.89 2doc s ALA 34 N -2.56 -2.37 0.23 3.99 0.00 -0.54 -1.38 121.76 119.14 2doc s ALA 34 Ca 0.44 2.05 -0.10 0.00 0.00 0.00 0.00 51.96 54.34 2doc s ALA 34 Cb 0.00 -2.02 -0.07 0.00 0.00 0.00 0.00 23.12 21.02 2doc s ALA 34 CO 0.25 -1.11 0.56 0.21 0.00 0.00 0.00 175.76 175.67 2doc s LYS 35 N 2.81 3.83 -0.20 0.00 2.20 0.65 -0.63 119.74 128.40 2doc s LYS 35 Ca 0.04 0.32 -0.04 0.00 -0.36 0.00 0.00 55.97 55.93 2doc s LYS 35 Cb -0.12 -2.65 0.07 0.00 -1.51 0.00 0.00 37.83 33.62 2doc s LYS 35 CO -0.19 0.31 0.07 0.54 -0.36 0.00 0.00 175.35 175.73 2doc s VAL 36 N -1.81 0.22 -0.27 4.02 0.11 -0.56 -3.97 120.40 118.14 2doc s VAL 36 Ca 0.47 -0.47 -0.13 0.00 -2.93 0.00 0.00 61.98 58.93 2doc s VAL 36 Cb -0.11 -0.87 -0.05 0.00 -1.53 0.00 0.00 36.38 33.82 2doc s VAL 36 CO 0.21 -0.33 0.26 -0.55 -3.33 0.00 0.00 175.10 171.36 2doc s SER 37 N 1.99 6.13 0.39 3.54 0.15 0.13 -3.53 113.70 122.49 2doc s SER 37 Ca 0.02 0.13 0.02 0.00 0.70 0.00 0.00 55.95 56.82 2doc s SER 37 Cb -0.17 -2.15 -0.01 0.00 -1.71 0.00 0.00 66.02 61.98 2doc s SER 37 CO -0.13 -0.09 0.09 2.22 1.20 0.00 0.00 173.24 176.53 2doc n PHE 38 N 5.06 0.40 -4.70 3.44 -1.74 -0.49 -1.36 117.46 118.06 2doc n PHE 38 Ca -0.12 -2.28 -0.26 0.00 -0.56 0.00 0.00 57.45 54.23 2doc n PHE 38 Cb 0.52 -0.09 -0.14 0.00 1.52 0.00 0.00 39.48 41.28 2doc n PHE 38 CO 0.00 0.00 0.00 -0.80 -0.56 0.00 0.00 176.76 175.40 2doc s ASN 39 N -3.29 2.59 0.69 5.98 0.01 0.53 -4.68 114.94 116.78 2doc s ASN 39 Ca 0.13 -0.53 -0.17 0.00 -0.71 0.00 0.00 52.86 51.58 2doc s ASN 39 Cb 0.01 -0.22 0.02 0.00 0.41 0.00 0.00 41.25 41.46 2doc s ASN 39 CO 0.09 0.18 1.27 -0.54 -1.51 0.00 0.00 177.10 176.59 2doc s LYS 40 N -1.16 2.28 0.36 -0.60 1.02 -1.26 -3.35 119.74 117.03 2doc s LYS 40 Ca 0.08 1.98 -0.27 0.00 0.02 0.00 0.00 55.97 57.78 2doc s LYS 40 Cb -0.09 -1.82 -0.09 0.00 -0.52 0.00 0.00 37.83 35.30 2doc s LYS 40 CO 0.02 -1.78 1.21 -1.25 -0.92 0.00 0.00 175.35 172.62 2doc s PRO 41 N -3.60 4.24 0.50 -1.68 0.04 -1.26 -4.76 135.00 128.47 2doc s PRO 41 Ca 0.80 1.97 0.25 0.00 0.04 0.00 0.00 61.00 64.06 2doc s PRO 41 Cb -0.35 -2.89 1.32 0.00 0.04 0.00 0.00 34.50 32.62 2doc s PRO 41 CO 0.43 -0.20 1.92 0.22 0.04 0.00 0.00 177.00 179.41 2doc h ASP 42 N 3.07 0.13 -1.63 6.66 3.58 -1.92 -3.42 116.42 122.89 2doc h ASP 42 Ca -0.48 0.01 -0.62 0.00 0.42 0.00 0.00 57.03 56.36 2doc h ASP 42 Cb 1.23 -0.01 -0.13 0.00 1.72 0.00 0.00 39.33 42.13 2doc h ASP 42 CO 0.64 0.06 -0.58 -0.55 -2.88 0.00 0.00 179.24 175.93 2doc s SER 43 N -5.86 3.75 0.00 2.28 0.15 -1.26 -5.08 113.70 107.68 2doc s SER 43 Ca -0.06 -1.43 0.00 0.00 0.70 0.00 0.00 55.95 55.16 2doc s SER 43 Cb 0.21 -0.19 0.00 0.00 -1.71 0.00 0.00 66.02 64.33 2doc s SER 43 CO 0.76 -0.55 0.00 0.00 1.20 0.00 0.00 173.24 174.65 2doc n HIS 44 N -0.99 0.00 0.00 3.44 1.44 -1.26 -4.25 115.22 113.60 2doc n HIS 44 Ca -0.07 0.00 0.00 0.00 -2.01 0.00 0.00 57.72 55.64 2doc n HIS 44 Cb 0.67 0.06 0.00 0.00 0.12 0.00 0.00 29.99 30.84 2doc n HIS 44 CO 0.00 0.00 0.00 0.41 -2.81 0.00 0.00 176.34 173.94 2doc n GLY 45 N 2.81 0.82 5.00 -1.39 0.00 -1.26 0.16 105.19 111.32 2doc n GLY 45 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 2doc n GLY 45 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2doc n GLY 46 N 0.00 1.76 3.81 -0.02 0.00 -1.26 -0.19 105.19 109.29 2doc n GLY 46 Ca 0.00 -0.02 -0.35 0.00 0.00 0.00 0.00 46.02 45.64 2doc n GLY 46 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 2doc s VAL 47 N 0.00 4.50 0.42 1.61 -7.23 -1.26 -5.00 120.40 113.45 2doc s VAL 47 Ca 0.00 1.35 -0.24 0.00 -1.81 0.00 0.00 61.98 61.28 2doc s VAL 47 Cb 0.00 -3.83 -0.08 0.00 0.56 0.00 0.00 36.38 33.03 2doc s VAL 47 CO 0.00 0.08 1.18 -2.16 -0.31 0.00 0.00 175.10 173.89 2doc s PRO 48 N -2.27 3.93 0.39 4.82 0.04 -1.26 -4.83 135.00 135.82 2doc s PRO 48 Ca 0.48 1.84 -0.26 0.00 0.04 0.00 0.00 61.00 63.10 2doc s PRO 48 Cb -0.15 -2.57 -0.09 0.00 0.04 0.00 0.00 34.50 31.73 2doc s PRO 48 CO 0.20 -0.43 1.21 0.42 0.04 0.00 0.00 177.00 178.44 2doc s ILE 49 N -1.46 3.01 -0.23 0.56 1.01 -1.26 -3.78 121.20 119.05 2doc s ILE 49 Ca 0.60 0.88 -0.16 0.00 0.00 0.00 0.00 60.65 61.97 2doc s ILE 49 Cb -0.30 -3.51 -0.09 0.00 0.01 0.00 0.00 42.46 38.56 2doc s ILE 49 CO 0.38 0.11 -0.34 1.41 0.00 0.00 0.00 174.94 176.49 2doc n HIS 50 N 0.19 0.03 -3.75 3.97 8.25 -0.84 -4.95 115.22 118.11 2doc n HIS 50 Ca 0.04 0.01 -0.09 0.00 -0.26 0.00 0.00 57.72 57.42 2doc n HIS 50 Cb 0.45 -0.78 0.02 0.00 1.12 0.00 0.00 29.99 30.80 2doc n HIS 50 CO 0.00 0.00 0.00 -2.39 0.64 0.00 0.00 176.34 174.59 2doc n HIS 51 N -4.35 -2.09 -5.08 4.41 1.44 -1.01 -4.40 115.22 104.15 2doc n HIS 51 Ca -0.36 -1.72 -0.32 0.00 -2.01 0.00 0.00 57.72 53.30 2doc n HIS 51 Cb 0.72 0.77 -0.16 0.00 0.12 0.00 0.00 29.99 31.44 2doc n HIS 51 CO 0.00 0.00 0.00 0.71 -2.81 0.00 0.00 176.34 174.24 2doc s TYR 52 N -2.97 2.61 -0.24 -1.40 2.02 -1.26 -2.07 117.35 114.04 2doc s TYR 52 Ca 0.16 -0.77 -0.11 0.00 -0.37 0.00 0.00 57.07 55.98 2doc s TYR 52 Cb -0.04 -1.71 -0.05 0.00 -0.40 0.00 0.00 41.96 39.76 2doc s TYR 52 CO 0.12 -0.25 0.20 -1.14 -1.57 0.00 0.00 175.55 172.90 2doc s GLN 53 N 0.11 4.06 -0.14 -0.62 0.74 -0.89 -3.45 119.66 119.47 2doc s GLN 53 Ca -0.10 -0.21 0.01 0.00 0.05 0.00 0.00 55.36 55.11 2doc s GLN 53 Cb -0.16 -3.56 -0.00 0.00 1.10 0.00 0.00 33.01 30.39 2doc s GLN 53 CO 0.06 0.01 -0.17 0.08 -0.55 0.00 0.00 175.29 174.71 2doc s VAL 54 N 1.21 2.56 -0.13 1.34 1.01 -0.99 -2.18 120.40 123.22 2doc s VAL 54 Ca 0.09 -0.82 0.03 0.00 0.00 0.00 0.00 61.98 61.28 2doc s VAL 54 Cb -0.14 -2.06 0.01 0.00 0.00 0.00 0.00 36.38 34.19 2doc s VAL 54 CO 0.06 0.53 -0.23 -1.81 0.00 0.00 0.00 175.10 173.65 2doc s ASP 55 N 0.64 3.11 0.04 3.32 1.11 -1.07 0.28 116.67 124.10 2doc s ASP 55 Ca -0.09 -0.59 0.01 0.00 0.18 0.00 0.00 52.55 52.07 2doc s ASP 55 Cb -0.16 -1.43 -0.03 0.00 1.07 0.00 0.00 42.92 42.37 2doc s ASP 55 CO 0.02 0.11 -0.06 0.54 1.18 0.00 0.00 175.17 176.96 2doc s VAL 56 N 0.65 0.42 0.06 -1.27 0.11 -0.35 -1.81 120.40 118.21 2doc s VAL 56 Ca -0.11 -1.21 -0.28 0.00 -2.93 0.00 0.00 61.98 57.45 2doc s VAL 56 Cb -0.16 -0.73 0.09 0.00 -1.53 0.00 0.00 36.38 34.05 2doc s VAL 56 CO 0.02 -0.53 1.13 -1.59 -3.33 0.00 0.00 175.10 170.80 2doc s LYS 57 N -2.03 0.78 0.24 1.54 -2.85 -1.13 -0.56 119.74 115.73 2doc s LYS 57 Ca -0.07 -0.43 -0.30 0.00 -1.00 0.00 0.00 55.97 54.17 2doc s LYS 57 Cb -0.07 0.27 -0.09 0.00 -2.06 0.00 0.00 37.83 35.88 2doc s LYS 57 CO -0.01 -0.36 1.00 -1.21 0.10 0.00 0.00 175.35 174.87 2doc s GLU 58 N -2.85 4.76 0.27 1.78 2.02 -1.26 -1.07 118.70 122.36 2doc s GLU 58 Ca 0.13 1.60 0.13 0.00 0.02 0.00 0.00 54.97 56.86 2doc s GLU 58 Cb 0.02 -3.26 0.72 0.00 0.10 0.00 0.00 34.13 31.72 2doc s GLU 58 CO -0.01 0.37 1.33 1.55 0.02 0.00 0.00 175.26 178.52 2doc n VAL 59 N 1.53 0.89 -0.10 2.63 3.14 -1.22 -1.06 118.33 124.14 2doc n VAL 59 Ca -0.01 0.70 -0.12 0.00 -2.96 0.00 0.00 64.34 61.94 2doc n VAL 59 Cb 0.46 -1.70 -0.11 0.00 -1.06 0.00 0.00 33.84 31.44 2doc n VAL 59 CO 0.00 0.00 0.00 0.00 -6.46 0.00 0.00 176.83 170.37 2doc n ALA 60 N -1.59 1.57 -0.74 1.55 0.00 -1.26 -5.01 120.51 115.02 2doc n ALA 60 Ca -0.01 -0.94 -0.30 0.00 0.00 0.00 0.00 53.44 52.19 2doc n ALA 60 Cb 0.20 -0.01 0.18 0.00 0.00 0.00 0.00 19.45 19.82 2doc n ALA 60 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 2doc s SER 61 N -5.71 2.62 -0.01 0.00 0.15 -0.22 -4.97 113.70 105.55 2doc s SER 61 Ca -0.22 1.95 0.09 0.00 0.70 0.00 0.00 55.95 58.47 2doc s SER 61 Cb 0.06 -2.48 -0.14 0.00 -1.71 0.00 0.00 66.02 61.76 2doc s SER 61 CO 0.53 -3.25 0.19 1.21 1.20 0.00 0.00 173.24 173.12 2doc n GLU 62 N -4.32 0.28 -3.09 5.44 2.13 -1.26 -4.73 120.64 115.09 2doc n GLU 62 Ca 0.09 -0.08 -0.38 0.00 0.66 0.00 0.00 57.16 57.45 2doc n GLU 62 Cb 0.53 -1.21 -0.06 0.00 0.27 0.00 0.00 31.44 30.97 2doc n GLU 62 CO 0.00 0.00 0.00 0.42 -0.41 0.00 0.00 177.13 177.14 2doc s ILE 63 N -2.60 4.53 -0.05 6.31 -1.09 -1.26 -5.07 121.20 121.96 2doc s ILE 63 Ca -0.03 1.43 -0.00 0.00 -2.23 0.00 0.00 60.65 59.82 2doc s ILE 63 Cb 0.06 -3.98 -0.03 0.00 -1.58 0.00 0.00 42.46 36.92 2doc s ILE 63 CO 0.36 0.41 -0.00 0.26 -1.23 0.00 0.00 174.94 174.74 2doc s TRP 64 N -1.28 3.11 -0.29 3.97 0.52 -1.26 -4.67 118.94 119.03 2doc s TRP 64 Ca 0.37 0.13 -0.08 0.00 0.02 0.00 0.00 56.10 56.54 2doc s TRP 64 Cb -0.20 -1.73 -0.01 0.00 -1.15 0.00 0.00 33.47 30.38 2doc s TRP 64 CO 0.23 0.45 0.12 0.15 0.02 0.00 0.00 176.95 177.92 2doc s LYS 65 N -1.16 3.39 0.03 4.98 1.02 0.27 -4.93 119.74 123.35 2doc s LYS 65 Ca 0.16 -0.67 -0.17 0.00 0.02 0.00 0.00 55.97 55.31 2doc s LYS 65 Cb -0.11 -3.46 -0.06 0.00 -0.52 0.00 0.00 37.83 33.68 2doc s LYS 65 CO 0.06 -0.35 0.48 0.42 -0.92 0.00 0.00 175.35 175.03 2doc s ILE 66 N 1.59 4.90 -0.24 2.17 -1.09 -1.26 -1.22 121.20 126.06 2doc s ILE 66 Ca 0.05 1.00 -0.03 0.00 -2.23 0.00 0.00 60.65 59.44 2doc s ILE 66 Cb -0.16 -3.79 0.11 0.00 -1.58 0.00 0.00 42.46 37.03 2doc s ILE 66 CO 0.05 0.57 0.24 -0.69 -1.23 0.00 0.00 174.94 173.88 2doc s VAL 67 N -1.09 -0.33 0.67 2.92 1.01 0.14 -4.97 120.40 118.74 2doc s VAL 67 Ca 0.26 -0.31 -0.03 0.00 0.00 0.00 0.00 61.98 61.91 2doc s VAL 67 Cb -0.18 -0.82 0.08 0.00 0.00 0.00 0.00 36.38 35.46 2doc s VAL 67 CO 0.16 -0.35 0.94 0.00 0.00 0.00 0.00 175.10 175.85 2doc s ARG 68 N 2.32 2.10 -0.12 2.72 1.70 -1.26 -2.36 118.95 124.05 2doc s ARG 68 Ca 0.08 -0.70 0.01 0.00 -0.47 0.00 0.00 55.73 54.65 2doc s ARG 68 Cb -0.15 -2.32 -0.01 0.00 -0.57 0.00 0.00 34.95 31.90 2doc s ARG 68 CO -0.22 -1.16 -0.16 -1.12 -1.08 0.00 0.00 175.30 171.56 2doc s SER 69 N -4.56 3.75 0.20 -2.89 0.01 -1.22 -4.99 113.70 103.99 2doc s SER 69 Ca 0.62 -0.39 -0.17 0.00 1.31 0.00 0.00 55.95 57.31 2doc s SER 69 Cb -0.09 -1.55 0.19 0.00 0.21 0.00 0.00 66.02 64.78 2doc s SER 69 CO 0.43 0.17 1.40 1.57 0.41 0.00 0.00 173.24 177.21 2doc n HIS 70 N 3.51 -0.02 -1.53 2.43 -0.00 -1.26 -4.62 115.22 113.74 2doc n HIS 70 Ca -0.18 1.11 0.00 0.00 0.46 0.00 0.00 57.72 59.11 2doc n HIS 70 Cb 0.53 -0.81 0.00 0.00 -0.12 0.00 0.00 29.99 29.59 2doc n HIS 70 CO 0.00 0.00 0.00 0.41 0.46 0.00 0.00 176.34 177.21 2doc n GLY 71 N -1.41 3.44 2.21 1.57 0.00 -1.26 -5.01 105.19 104.74 2doc n GLY 71 Ca 0.08 -1.87 -0.23 0.00 0.00 0.00 0.00 46.02 44.00 2doc n GLY 71 CO 0.00 0.00 0.00 3.33 0.00 0.00 0.00 173.32 176.65 2doc n VAL 72 N 0.00 3.18 -1.71 1.61 0.24 -1.26 -4.53 118.33 115.86 2doc n VAL 72 Ca 0.00 -1.89 -0.32 0.00 -2.04 0.00 0.00 64.34 60.09 2doc n VAL 72 Cb 0.00 -0.47 0.04 0.00 -1.47 0.00 0.00 33.84 31.94 2doc n VAL 72 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 2doc s GLN 73 N -3.25 3.01 -0.10 7.34 -2.07 -1.26 -4.98 119.66 118.34 2doc s GLN 73 Ca 0.56 1.07 0.14 0.00 -1.82 0.00 0.00 55.36 55.31 2doc s GLN 73 Cb 0.47 -2.00 0.38 0.00 -1.09 0.00 0.00 33.01 30.78 2doc s GLN 73 CO 0.11 -1.05 1.30 0.25 -1.32 0.00 0.00 175.29 174.58 2doc n THR 74 N -2.77 1.74 -4.03 3.63 -2.24 -1.26 -4.80 114.28 104.54 2doc n THR 74 Ca 0.08 -1.59 -0.31 0.00 -2.27 0.00 0.00 64.05 59.96 2doc n THR 74 Cb 0.53 0.04 -0.16 0.00 -2.10 0.00 0.00 70.33 68.64 2doc n THR 74 CO 0.00 0.00 0.00 -0.32 -0.57 0.00 0.00 175.07 174.18 2doc s MET 75 N -2.12 2.27 0.03 -0.78 -2.45 -1.26 -1.40 119.30 113.59 2doc s MET 75 Ca 0.31 -0.77 -0.01 0.00 -1.25 0.00 0.00 55.69 53.97 2doc s MET 75 Cb 0.24 -2.36 -0.02 0.00 1.25 0.00 0.00 34.83 33.93 2doc s MET 75 CO 0.09 -0.34 -0.01 0.08 1.05 0.00 0.00 175.02 175.89 2doc s VAL 76 N 1.40 0.14 -0.15 10.11 1.01 -1.23 -5.01 120.40 126.66 2doc s VAL 76 Ca 0.01 -1.17 0.00 0.00 0.00 0.00 0.00 61.98 60.83 2doc s VAL 76 Cb -0.15 -0.67 -0.00 0.00 0.00 0.00 0.00 36.38 35.56 2doc s VAL 76 CO -0.10 -0.64 -0.15 0.54 0.00 0.00 0.00 175.10 174.75 2doc s VAL 77 N -2.23 2.66 0.29 2.92 0.11 -1.26 -1.49 120.40 121.40 2doc s VAL 77 Ca -0.09 -0.77 -0.11 0.00 -2.93 0.00 0.00 61.98 58.08 2doc s VAL 77 Cb -0.04 -2.12 -0.07 0.00 -1.53 0.00 0.00 36.38 32.61 2doc s VAL 77 CO -0.04 0.52 0.64 -0.76 -3.33 0.00 0.00 175.10 172.13 2doc s LEU 78 N 0.80 4.07 0.00 2.54 1.43 0.20 -4.88 118.68 122.84 2doc s LEU 78 Ca -0.06 1.04 0.05 0.00 -1.03 0.00 0.00 54.13 54.14 2doc s LEU 78 Cb -0.15 -3.84 -0.02 0.00 0.03 0.00 0.00 46.19 42.21 2doc s LEU 78 CO 0.00 -0.18 0.20 -0.46 0.23 0.00 0.00 176.35 176.14 2doc n ASN 79 N -0.47 -0.39 -3.38 2.29 2.04 -1.26 -1.46 115.26 112.62 2doc n ASN 79 Ca 0.01 -2.58 -0.16 0.00 -0.44 0.00 0.00 54.58 51.41 2doc n ASN 79 Cb 0.53 1.18 0.08 0.00 -2.53 0.00 0.00 39.78 39.04 2doc n ASN 79 CO 0.00 0.00 0.00 0.59 -0.44 0.00 0.00 177.26 177.41 2doc n ASN 80 N -2.02 -3.24 -4.19 0.53 3.02 -1.25 -4.94 115.26 103.16 2doc n ASN 80 Ca 0.05 -0.64 -0.22 0.00 -0.03 0.00 0.00 54.58 53.74 2doc n ASN 80 Cb 0.44 -5.14 -0.13 0.00 -0.61 0.00 0.00 39.78 34.33 2doc n ASN 80 CO 0.00 0.00 0.00 -0.76 -2.62 0.00 0.00 177.26 173.88 2doc s LEU 81 N -6.10 2.19 0.18 3.41 1.43 -0.96 -5.08 118.68 113.75 2doc s LEU 81 Ca 0.12 -0.51 -0.21 0.00 -1.03 0.00 0.00 54.13 52.50 2doc s LEU 81 Cb -0.02 -0.72 -0.08 0.00 0.03 0.00 0.00 46.19 45.41 2doc s LEU 81 CO 0.73 0.06 0.70 -1.61 0.23 0.00 0.00 176.35 176.46 2doc s GLU 82 N -1.29 4.30 0.75 1.70 2.02 -1.26 -4.29 118.70 120.63 2doc s GLU 82 Ca 0.03 0.89 -0.11 0.00 0.02 0.00 0.00 54.97 55.80 2doc s GLU 82 Cb -0.09 -3.04 0.05 0.00 0.10 0.00 0.00 34.13 31.15 2doc s GLU 82 CO 0.02 0.49 1.09 -1.25 0.02 0.00 0.00 175.26 175.63 2doc s PRO 83 N -1.61 2.36 -1.42 0.39 0.04 -1.09 -3.54 135.00 130.12 2doc s PRO 83 Ca 0.38 1.21 -0.10 0.00 0.04 0.00 0.00 61.00 62.53 2doc s PRO 83 Cb -0.19 -1.91 0.07 0.00 0.04 0.00 0.00 34.50 32.51 2doc s PRO 83 CO 0.22 -1.57 0.66 -1.71 0.04 0.00 0.00 177.00 174.64 2doc n ASN 84 N -3.31 -4.44 -4.22 6.66 2.85 -1.22 -4.92 115.26 106.67 2doc n ASN 84 Ca 0.09 -0.50 -0.15 0.00 -0.11 0.00 0.00 54.58 53.91 2doc n ASN 84 Cb 0.53 -3.61 -0.11 0.00 1.24 0.00 0.00 39.78 37.83 2doc n ASN 84 CO 0.00 0.00 0.00 -0.89 -2.11 0.00 0.00 177.26 174.26 2doc s THR 85 N -3.09 1.12 0.04 -0.44 2.01 -1.23 -4.97 115.64 109.07 2doc s THR 85 Ca 0.47 -1.83 0.02 0.00 0.31 0.00 0.00 61.69 60.66 2doc s THR 85 Cb -0.24 -1.60 -0.04 0.00 0.01 0.00 0.00 72.50 70.64 2doc s THR 85 CO 0.58 -0.61 0.05 -0.89 -0.69 0.00 0.00 174.62 173.07 2doc s THR 86 N -2.74 4.44 -0.08 -0.82 2.01 -1.26 -1.00 115.64 116.18 2doc s THR 86 Ca 0.11 -0.66 -0.06 0.00 0.31 0.00 0.00 61.69 61.39 2doc s THR 86 Cb -0.01 -3.07 0.03 0.00 0.01 0.00 0.00 72.50 69.46 2doc s THR 86 CO 0.01 0.24 0.20 -0.31 -0.69 0.00 0.00 174.62 174.07 2doc s TYR 87 N -1.26 -0.23 -0.26 4.92 1.51 -0.72 -3.39 117.35 117.93 2doc s TYR 87 Ca 0.25 0.56 -0.15 0.00 -1.01 0.00 0.00 57.07 56.73 2doc s TYR 87 Cb -0.12 0.05 -0.04 0.00 -0.11 0.00 0.00 41.96 41.74 2doc s TYR 87 CO 0.17 -0.14 0.37 -1.21 -1.11 0.00 0.00 175.55 173.63 2doc s GLU 88 N 0.49 4.04 0.09 -0.62 2.02 -0.23 -1.93 118.70 122.55 2doc s GLU 88 Ca -0.03 0.05 0.09 0.00 0.02 0.00 0.00 54.97 55.09 2doc s GLU 88 Cb -0.05 -3.63 -0.04 0.00 0.10 0.00 0.00 34.13 30.51 2doc s GLU 88 CO -0.02 -0.23 -0.20 -1.50 0.02 0.00 0.00 175.26 173.33 2doc s ILE 89 N 1.92 2.71 -0.07 -1.63 2.07 0.15 -2.82 121.20 123.52 2doc s ILE 89 Ca 0.15 -1.41 -0.03 0.00 -1.41 0.00 0.00 60.65 57.95 2doc s ILE 89 Cb -0.16 -2.19 0.04 0.00 0.13 0.00 0.00 42.46 40.29 2doc s ILE 89 CO 0.09 0.20 0.17 0.00 -1.91 0.00 0.00 174.94 173.49 2doc s ARG 90 N -1.82 0.11 -0.05 3.50 1.70 -0.75 0.13 118.95 121.78 2doc s ARG 90 Ca 0.16 0.41 -0.05 0.00 -0.47 0.00 0.00 55.73 55.78 2doc s ARG 90 Cb -0.10 -0.17 -0.04 0.00 -0.57 0.00 0.00 34.95 34.06 2doc s ARG 90 CO 0.07 -0.17 0.17 0.08 -1.08 0.00 0.00 175.30 174.37 2doc s VAL 91 N 1.23 5.46 0.05 4.99 1.01 -1.26 -2.60 120.40 129.28 2doc s VAL 91 Ca -0.09 -0.00 -0.07 0.00 0.00 0.00 0.00 61.98 61.82 2doc s VAL 91 Cb -0.11 -3.49 -0.01 0.00 0.00 0.00 0.00 36.38 32.77 2doc s VAL 91 CO -0.06 0.44 0.14 0.00 0.00 0.00 0.00 175.10 175.61 2doc s ALA 92 N -1.21 -0.15 -0.23 5.51 0.00 -0.93 0.16 121.76 124.91 2doc s ALA 92 Ca 0.23 -0.54 -0.09 0.00 0.00 0.00 0.00 51.96 51.56 2doc s ALA 92 Cb -0.12 0.32 -0.04 0.00 0.00 0.00 0.00 23.12 23.27 2doc s ALA 92 CO 0.13 -0.38 0.12 0.00 0.00 0.00 0.00 175.76 175.64 2doc s ALA 93 N -2.99 3.48 -0.21 0.00 0.00 -1.26 -2.10 121.76 118.68 2doc s ALA 93 Ca -0.02 -0.91 -0.00 0.00 0.00 0.00 0.00 51.96 51.02 2doc s ALA 93 Cb 0.01 -2.20 0.02 0.00 0.00 0.00 0.00 23.12 20.95 2doc s ALA 93 CO -0.06 -0.19 -0.14 0.08 0.00 0.00 0.00 175.76 175.45 2doc s VAL 94 N 1.05 2.49 0.43 0.00 1.01 -0.88 -2.62 120.40 121.88 2doc s VAL 94 Ca 0.06 -0.91 0.04 0.00 0.00 0.00 0.00 61.98 61.17 2doc s VAL 94 Cb -0.14 -2.13 -0.04 0.00 0.00 0.00 0.00 36.38 34.07 2doc s VAL 94 CO 0.04 0.42 0.04 0.54 0.00 0.00 0.00 175.10 176.13 2doc s ASN 95 N 1.32 3.54 0.51 3.32 4.22 -0.48 -1.99 114.94 125.38 2doc s ASN 95 Ca 0.03 -1.53 0.44 0.00 -2.14 0.00 0.00 52.86 49.66 2doc s ASN 95 Cb -0.14 0.16 1.65 0.00 1.28 0.00 0.00 41.25 44.20 2doc s ASN 95 CO -0.09 -0.71 1.57 1.23 -2.04 0.00 0.00 177.10 177.06 2doc h GLY 96 N 1.67 0.56 0.50 0.45 0.00 -1.89 0.24 103.07 104.59 2doc h GLY 96 Ca -0.42 -0.04 -0.02 0.00 0.00 0.00 0.00 47.33 46.86 2doc h GLY 96 CO 0.72 -0.20 -0.17 1.70 0.00 0.00 0.00 176.54 178.60 2doc h LYS 97 N 0.00 -0.45 0.00 4.80 1.63 -1.90 -3.50 116.57 117.15 2doc h LYS 97 Ca 0.92 0.03 0.00 0.00 -0.85 0.00 0.00 60.65 60.75 2doc h LYS 97 Cb 3.43 0.10 0.00 0.00 -0.60 0.00 0.00 32.23 35.16 2doc h LYS 97 CO -0.19 -0.14 0.00 0.41 -3.45 0.00 0.00 179.45 176.07 2doc n GLY 98 N 0.13 -0.57 3.30 5.01 0.00 0.84 -5.08 105.19 108.82 2doc n GLY 98 Ca -0.08 -0.63 -0.43 0.00 0.00 0.00 0.00 46.02 44.87 2doc n GLY 98 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 2doc s GLN 99 N -1.52 2.79 0.00 1.61 0.74 -1.26 -1.39 119.66 120.63 2doc s GLN 99 Ca 0.00 -1.55 0.00 0.00 0.05 0.00 0.00 55.36 53.86 2doc s GLN 99 Cb 0.00 -4.04 0.00 0.00 1.10 0.00 0.00 33.01 30.07 2doc s GLN 99 CO 0.00 -1.12 0.00 0.41 -0.55 0.00 0.00 175.29 174.03 2doc n GLY 100 N 5.08 -1.21 3.00 2.59 0.00 -1.08 -4.93 105.19 108.64 2doc n GLY 100 Ca -0.11 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 45.77 2doc n GLY 100 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 2doc s ASP 101 N -2.43 0.60 0.44 1.61 1.11 -1.26 -5.04 116.67 111.70 2doc s ASP 101 Ca 0.00 -0.33 -0.22 0.00 0.18 0.00 0.00 52.55 52.17 2doc s ASP 101 Cb 0.00 0.01 -0.09 0.00 1.07 0.00 0.00 42.92 43.91 2doc s ASP 101 CO 0.00 -0.11 1.04 -0.31 1.18 0.00 0.00 175.17 176.97 2doc s TYR 102 N -0.83 3.15 0.70 4.23 2.02 -1.26 -4.08 117.35 121.29 2doc s TYR 102 Ca -0.06 1.61 -0.11 0.00 -0.37 0.00 0.00 57.07 58.14 2doc s TYR 102 Cb -0.06 -3.09 0.01 0.00 -0.40 0.00 0.00 41.96 38.42 2doc s TYR 102 CO -0.00 -0.69 1.07 -1.54 -1.57 0.00 0.00 175.55 172.82 2doc s SER 103 N -1.77 5.39 -0.40 2.29 1.04 0.12 -4.86 113.70 115.51 2doc s SER 103 Ca 0.62 1.38 -0.42 0.00 0.48 0.00 0.00 55.95 58.00 2doc s SER 103 Cb -0.19 -2.24 -0.17 0.00 0.10 0.00 0.00 66.02 63.52 2doc s SER 103 CO 0.23 -1.41 1.84 1.17 0.98 0.00 0.00 173.24 176.05 2doc n LYS 104 N -3.08 0.55 -1.70 4.02 4.81 -1.26 -4.58 118.16 116.91 2doc n LYS 104 Ca 0.07 0.19 -0.62 0.00 -0.87 0.00 0.00 58.31 57.08 2doc n LYS 104 Cb 0.55 -1.84 -0.08 0.00 0.02 0.00 0.00 35.03 33.68 2doc n LYS 104 CO 0.00 0.00 0.00 -0.89 1.17 0.00 0.00 177.40 177.68 2doc n ILE 105 N 5.12 0.13 -3.98 3.15 2.08 -1.26 -4.87 119.36 119.73 2doc n ILE 105 Ca 0.35 -0.02 -0.34 0.00 0.56 0.00 0.00 62.75 63.30 2doc n ILE 105 Cb 0.05 -0.79 -0.06 0.00 -0.75 0.00 0.00 39.64 38.09 2doc n ILE 105 CO 0.00 0.00 0.00 -1.61 0.56 0.00 0.00 176.55 175.50 2doc s GLU 106 N 2.83 3.31 -0.20 0.38 0.41 0.12 -4.95 118.70 120.60 2doc s GLU 106 Ca 1.00 -0.32 0.00 0.00 -0.41 0.00 0.00 54.97 55.24 2doc s GLU 106 Cb -1.26 -3.04 0.05 0.00 -1.78 0.00 0.00 34.13 28.10 2doc s GLU 106 CO 0.71 0.70 -0.07 0.42 -0.49 0.00 0.00 175.26 176.53 2doc s ILE 107 N -1.18 1.41 -0.05 -1.63 1.01 -1.26 0.34 121.20 119.84 2doc s ILE 107 Ca 0.22 -0.94 0.04 0.00 0.00 0.00 0.00 60.65 59.96 2doc s ILE 107 Cb -0.12 -1.59 0.00 0.00 0.01 0.00 0.00 42.46 40.76 2doc s ILE 107 CO 0.13 0.06 -0.16 0.72 0.00 0.00 0.00 174.94 175.69 2doc s PHE 108 N 1.48 1.61 -0.23 3.97 -0.12 -0.81 -4.97 117.98 118.91 2doc s PHE 108 Ca -0.02 -0.49 -0.07 0.00 -0.05 0.00 0.00 56.93 56.31 2doc s PHE 108 Cb -0.17 -1.10 -0.03 0.00 -0.63 0.00 0.00 43.02 41.09 2doc s PHE 108 CO -0.07 -0.19 0.05 -1.14 -0.05 0.00 0.00 175.22 173.82 2doc s GLN 109 N 0.17 3.69 1.06 1.99 0.74 -1.26 -1.76 119.66 124.29 2doc s GLN 109 Ca -0.06 -0.47 -0.14 0.00 0.05 0.00 0.00 55.36 54.74 2doc s GLN 109 Cb -0.12 -3.25 0.16 0.00 1.10 0.00 0.00 33.01 30.90 2doc s GLN 109 CO 0.02 -0.07 0.66 0.25 -0.55 0.00 0.00 175.29 175.60 2doc n THR 110 N 4.55 0.00 -2.94 -0.34 -2.24 -0.17 -4.91 114.28 108.23 2doc n THR 110 Ca -0.16 -0.25 -0.38 0.00 -2.27 0.00 0.00 64.05 60.98 2doc n THR 110 Cb 0.52 -0.81 -0.06 0.00 -2.10 0.00 0.00 70.33 67.87 2doc n THR 110 CO 0.00 0.00 0.00 -0.76 -0.57 0.00 0.00 175.07 173.74 2doc s LEU 111 N -4.24 4.48 -0.14 3.22 1.43 -0.89 -3.86 118.68 118.68 2doc s LEU 111 Ca 0.62 1.67 -0.29 0.00 -1.03 0.00 0.00 54.13 55.10 2doc s LEU 111 Cb -0.21 -3.58 -0.04 0.00 0.03 0.00 0.00 46.19 42.40 2doc s LEU 111 CO 0.64 0.09 1.55 -2.16 0.23 0.00 0.00 176.35 176.71 2doc s PRO 112 N -1.58 4.06 0.06 1.29 0.04 -1.26 -3.37 135.00 134.23 2doc s PRO 112 Ca 0.42 1.89 -0.28 0.00 0.04 0.00 0.00 61.00 63.07 2doc s PRO 112 Cb -0.21 -3.95 -0.15 0.00 0.04 0.00 0.00 34.50 30.23 2doc s PRO 112 CO 0.25 -0.97 0.67 0.28 0.04 0.00 0.00 177.00 177.28 2doc n VAL 113 N 5.77 0.57 -4.36 -0.36 0.31 -1.26 -4.94 118.33 114.06 2doc n VAL 113 Ca 0.17 -0.14 -0.27 0.00 -0.01 0.00 0.00 64.34 64.09 2doc n VAL 113 Cb 0.44 0.00 -0.11 0.00 -0.91 0.00 0.00 33.84 33.26 2doc n VAL 113 CO 0.00 0.00 0.00 -0.55 -1.32 0.00 0.00 176.83 174.96 2doc s SER 114 N -0.29 3.77 0.00 4.52 0.15 -1.26 -5.10 113.70 115.50 2doc s SER 114 Ca 0.63 -0.73 0.00 0.00 0.70 0.00 0.00 55.95 56.55 2doc s SER 114 Cb -0.89 -0.45 0.00 0.00 -1.71 0.00 0.00 66.02 62.97 2doc s SER 114 CO 0.44 0.12 0.00 0.61 1.20 0.00 0.00 173.24 175.61 2doc n GLY 115 N 0.25 0.94 3.68 9.45 0.00 -1.26 -5.13 105.19 113.11 2doc n GLY 115 Ca -0.12 -0.31 -0.42 0.00 0.00 0.00 0.00 46.02 45.16 2doc n GLY 115 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2doc s PRO 116 N -2.00 4.24 -0.05 1.61 0.04 -1.26 -5.00 135.00 132.58 2doc s PRO 116 Ca 0.00 2.02 -0.27 0.00 0.04 0.00 0.00 61.00 62.79 2doc s PRO 116 Cb 0.00 -3.71 0.06 0.00 0.04 0.00 0.00 34.50 30.89 2doc s PRO 116 CO 0.00 -0.68 0.60 0.45 0.04 0.00 0.00 177.00 177.41 2doc s SER 117 N 2.32 -0.56 -0.49 6.66 0.15 -1.26 -5.10 113.70 115.43 2doc s SER 117 Ca 0.66 0.61 -0.44 0.00 0.70 0.00 0.00 55.95 57.48 2doc s SER 117 Cb -0.31 0.53 -0.19 0.00 -1.71 0.00 0.00 66.02 64.34 2doc s SER 117 CO 0.26 -0.56 2.07 -1.20 1.20 0.00 0.00 173.24 175.01 2doc n SER 118 N 1.08 0.90 0.00 5.45 7.64 -1.26 -5.32 113.62 122.11 2doc n SER 118 Ca -0.19 0.74 0.00 0.00 1.01 0.00 0.00 58.87 60.42 2doc n SER 118 Cb 0.57 -0.92 0.00 0.00 -1.01 0.00 0.00 64.21 62.85 2doc n SER 118 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64