#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2doc n SER 2 N 0.00 0.84 -3.64 1.61 2.88 -1.26 -4.94 113.62 109.11 2doc n SER 2 Ca 0.00 1.15 -0.08 0.00 -1.33 0.00 0.00 58.87 58.61 2doc n SER 2 Cb 0.00 -0.97 -0.07 0.00 -0.75 0.00 0.00 64.21 62.42 2doc n SER 2 CO 0.00 0.00 0.00 -0.94 -1.23 0.00 0.00 175.04 172.87 2doc s SER 3 N 1.29 -0.49 0.34 -3.46 1.04 -1.26 -5.15 113.70 106.01 2doc s SER 3 Ca 0.95 0.92 -0.28 0.00 0.48 0.00 0.00 55.95 58.01 2doc s SER 3 Cb -1.27 0.98 -0.10 0.00 0.10 0.00 0.00 66.02 65.74 2doc s SER 3 CO 0.64 -0.16 1.24 -0.83 0.98 0.00 0.00 173.24 175.11 2doc s GLY 4 N 0.46 2.99 -0.21 7.32 0.00 -1.26 -4.97 107.32 111.65 2doc s GLY 4 Ca 0.01 1.14 -0.19 0.00 0.00 0.00 0.00 44.72 45.68 2doc s GLY 4 CO -0.08 1.75 0.16 1.44 0.00 0.00 0.00 173.10 176.37 2doc n SER 5 N 0.70 1.90 -0.03 1.64 7.64 -1.26 -4.55 113.62 119.66 2doc n SER 5 Ca 0.01 0.38 -0.15 0.00 1.01 0.00 0.00 58.87 60.12 2doc n SER 5 Cb 0.43 -0.93 -0.12 0.00 -1.01 0.00 0.00 64.21 62.58 2doc n SER 5 CO 0.00 0.00 0.00 0.28 -3.01 0.00 0.00 175.04 172.31 2doc h SER 6 N -0.86 0.14 0.00 6.43 0.02 -2.09 -3.48 113.55 113.71 2doc h SER 6 Ca -0.40 -0.88 0.00 0.00 -0.84 0.00 0.00 61.79 59.67 2doc h SER 6 Cb 1.44 -0.04 0.00 0.00 0.14 0.00 0.00 62.40 63.93 2doc h SER 6 CO -0.20 1.00 0.00 0.61 -1.14 0.00 0.00 176.83 177.10 2doc n GLY 7 N 1.31 -0.03 3.80 -3.77 0.00 -1.26 -5.18 105.19 100.07 2doc n GLY 7 Ca -0.10 -0.25 -0.26 0.00 0.00 0.00 0.00 46.02 45.41 2doc n GLY 7 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 2doc s GLN 8 N 0.00 2.26 -1.42 1.61 -1.52 -1.26 -4.65 119.66 114.69 2doc s GLN 8 Ca 0.00 -1.92 -0.02 0.00 -1.95 0.00 0.00 55.36 51.47 2doc s GLN 8 Cb 0.00 -2.01 0.01 0.00 -0.22 0.00 0.00 33.01 30.79 2doc s GLN 8 CO 0.00 -0.29 0.17 -1.91 -0.25 0.00 0.00 175.29 173.01 2doc n GLU 9 N -1.43 -2.69 -0.13 2.91 0.00 -1.26 -4.83 120.64 113.21 2doc n GLU 9 Ca -0.03 0.78 -0.22 0.00 0.00 0.00 0.00 57.16 57.69 2doc n GLU 9 Cb 0.64 -5.46 -0.11 0.00 0.00 0.00 0.00 31.44 26.51 2doc n GLU 9 CO 0.00 0.00 0.00 2.48 0.00 0.00 0.00 177.13 179.61 2doc n TYR 10 N -3.87 0.00 0.00 4.31 4.11 -1.26 -4.74 117.16 115.70 2doc n TYR 10 Ca -0.16 0.00 0.00 0.00 -0.00 0.00 0.00 57.90 57.74 2doc n TYR 10 Cb 0.63 -0.99 0.00 0.00 -0.00 0.00 0.00 39.34 38.99 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 -3.60 0.00 0.28 -3.48 2.08 -1.26 -4.74 119.36 108.63 2doc n ILE 11 Ca -0.49 0.00 0.17 0.00 0.56 0.00 0.00 62.75 63.00 2doc n ILE 11 Cb 0.95 -0.37 0.85 0.00 -0.75 0.00 0.00 39.64 40.32 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 0.19 1.39 3.38 -1.96 0.93 115.31 119.24 2doc h LEU 12 Ca 0.00 0.00 -0.31 0.00 0.09 0.00 0.00 57.88 57.66 2doc h LEU 12 Cb 0.50 0.00 0.03 0.00 0.09 0.00 0.00 40.66 41.28 2doc h LEU 12 CO 0.00 0.00 -1.34 0.00 0.09 0.00 0.00 178.44 177.19 2doc h ALA 13 N 1.48 -0.09 -0.16 1.53 0.00 -1.85 -3.23 119.26 116.93 2doc h ALA 13 Ca 0.04 -0.81 0.00 0.00 0.00 0.00 0.00 54.91 54.14 2doc h ALA 13 Cb 0.65 0.15 0.00 0.00 0.00 0.00 0.00 17.79 18.58 2doc h ALA 13 CO -0.00 0.67 0.00 1.28 0.00 0.00 0.00 179.25 181.20 2doc n LEU 14 N -3.78 1.33 -4.64 0.00 4.77 0.18 -4.84 117.00 110.02 2doc n LEU 14 Ca -0.15 -0.59 -0.43 0.00 -0.03 0.00 0.00 56.01 54.81 2doc n LEU 14 Cb 1.04 -0.11 -0.02 0.00 -2.33 0.00 0.00 43.42 42.00 2doc n LEU 14 CO 0.59 0.29 1.09 0.00 -1.33 0.00 0.00 177.39 178.03 2doc s ALA 15 N -1.79 3.46 0.00 -1.18 0.00 -0.37 -4.90 121.76 116.98 2doc s ALA 15 Ca 0.28 0.16 0.00 0.00 0.00 0.00 0.00 51.96 52.41 2doc s ALA 15 Cb 0.15 -3.72 0.00 0.00 0.00 0.00 0.00 23.12 19.55 2doc s ALA 15 CO 0.22 -1.56 0.00 -0.25 0.00 0.00 0.00 175.76 174.17 2doc n ASP 16 N 7.23 0.00 -3.60 0.00 8.00 -1.25 -5.03 116.55 121.90 2doc n ASP 16 Ca 0.14 0.00 -0.05 0.00 0.71 0.00 0.00 54.79 55.59 2doc n ASP 16 Cb 0.46 -0.16 -0.02 0.00 -0.02 0.00 0.00 41.12 41.38 2doc n ASP 16 CO 0.00 0.00 0.00 0.68 -0.39 0.00 0.00 177.20 177.49 2doc s VAL 17 N -0.50 0.00 0.35 2.53 -7.23 -1.26 -4.45 120.40 109.85 2doc s VAL 17 Ca 0.00 0.00 -0.27 0.00 -1.81 0.00 0.00 61.98 59.90 2doc s VAL 17 Cb 0.00 -1.00 -0.09 0.00 0.56 0.00 0.00 36.38 35.85 2doc s VAL 17 CO 0.00 0.00 1.21 -2.16 -0.31 0.00 0.00 175.10 173.84 2doc s PRO 18 N -2.17 4.27 0.57 4.82 0.04 -0.85 -4.17 135.00 137.50 2doc s PRO 18 Ca 0.08 1.98 -0.17 0.00 0.04 0.00 0.00 61.00 62.93 2doc s PRO 18 Cb -0.01 -2.92 -0.05 0.00 0.04 0.00 0.00 34.50 31.57 2doc s PRO 18 CO -0.05 -0.18 1.07 -1.12 0.04 0.00 0.00 177.00 176.76 2doc s SER 19 N -0.84 5.84 0.39 6.66 0.01 0.38 -4.10 113.70 122.04 2doc s SER 19 Ca 0.52 1.91 -0.25 0.00 1.31 0.00 0.00 55.95 59.44 2doc s SER 19 Cb -0.34 -2.55 -0.11 0.00 0.21 0.00 0.00 66.02 63.23 2doc s SER 19 CO 0.44 -1.13 1.01 -1.54 0.41 0.00 0.00 173.24 172.44 2doc n SER 20 N -1.71 1.28 -4.71 2.44 3.41 -1.26 -4.69 113.62 108.39 2doc n SER 20 Ca 0.09 1.06 -0.30 0.00 -0.26 0.00 0.00 58.87 59.47 2doc n SER 20 Cb 0.52 -1.34 0.14 0.00 -0.26 0.00 0.00 64.21 63.28 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 -1.92 1.10 0.23 4.33 0.04 -1.26 -4.77 135.00 132.75 2doc s PRO 21 Ca 0.62 0.76 0.00 0.00 0.04 0.00 0.00 61.00 62.42 2doc s PRO 21 Cb -0.58 -1.80 -0.04 0.00 0.04 0.00 0.00 34.50 32.12 2doc s PRO 21 CO 0.58 -2.33 0.12 1.52 0.04 0.00 0.00 177.00 176.92 2doc s TYR 22 N -2.94 1.34 0.00 0.56 1.13 -1.23 -4.83 117.35 111.38 2doc s TYR 22 Ca 0.64 -1.30 0.00 0.00 -1.41 0.00 0.00 57.07 55.00 2doc s TYR 22 Cb -0.18 -0.71 0.00 0.00 -1.10 0.00 0.00 41.96 39.97 2doc s TYR 22 CO 0.57 -0.51 0.00 0.41 -2.51 0.00 0.00 175.55 173.51 2doc n GLY 23 N -0.36 2.92 3.63 5.49 0.00 -1.26 -0.48 105.19 115.13 2doc n GLY 23 Ca 0.01 0.00 -0.62 0.00 0.00 0.00 0.00 46.02 45.42 2doc n GLY 23 CO 0.00 0.00 0.00 1.55 0.00 0.00 0.00 173.32 174.87 2doc n VAL 24 N -1.99 0.12 -3.65 1.61 3.14 -1.25 -4.57 118.33 111.74 2doc n VAL 24 Ca 0.00 -0.04 -0.13 0.00 -2.96 0.00 0.00 64.34 61.21 2doc n VAL 24 Cb 0.00 -0.85 -0.08 0.00 -1.06 0.00 0.00 33.84 31.85 2doc n VAL 24 CO 0.00 0.00 0.00 -1.59 -6.46 0.00 0.00 176.83 168.78 2doc s LYS 25 N 3.98 0.74 -0.14 1.45 0.00 0.79 -4.95 119.74 121.62 2doc s LYS 25 Ca 1.06 0.94 -0.29 0.00 0.00 0.00 0.00 55.97 57.67 2doc s LYS 25 Cb -1.30 0.34 -0.02 0.00 0.00 0.00 0.00 37.83 36.85 2doc s LYS 25 CO 0.71 -0.10 1.25 0.42 0.00 0.00 0.00 175.35 177.63 2doc s ILE 26 N 0.51 4.28 -0.24 3.79 -1.09 -1.26 -1.93 121.20 125.26 2doc s ILE 26 Ca -0.01 1.56 -0.05 0.00 -2.23 0.00 0.00 60.65 59.91 2doc s ILE 26 Cb -0.05 -4.01 -0.13 0.00 -1.58 0.00 0.00 42.46 36.70 2doc s ILE 26 CO -0.02 -0.10 -0.26 2.30 -1.23 0.00 0.00 174.94 175.63 2doc n ILE 27 N 5.18 1.33 -3.95 2.92 -5.35 -1.14 -4.83 119.36 113.53 2doc n ILE 27 Ca 0.13 -0.43 -0.30 0.00 -0.27 0.00 0.00 62.75 61.89 2doc n ILE 27 Cb 0.45 -1.57 -0.14 0.00 -1.74 0.00 0.00 39.64 36.64 2doc n ILE 27 CO 0.00 0.00 0.00 -1.61 -1.76 0.00 0.00 176.55 173.18 2doc s GLU 28 N -2.46 1.98 -0.22 6.28 2.02 -1.25 -5.04 118.70 120.02 2doc s GLU 28 Ca -0.33 -2.64 -0.10 0.00 0.02 0.00 0.00 54.97 51.92 2doc s GLU 28 Cb 0.11 -3.31 -0.05 0.00 0.10 0.00 0.00 34.13 30.97 2doc s GLU 28 CO 0.48 -1.11 0.15 -1.17 0.02 0.00 0.00 175.26 173.63 2doc s LEU 29 N -0.32 4.15 0.00 1.80 2.96 -1.26 -0.60 118.68 125.41 2doc s LEU 29 Ca 0.17 0.17 0.02 0.00 -0.22 0.00 0.00 54.13 54.27 2doc s LEU 29 Cb -0.26 -2.11 0.02 0.00 0.50 0.00 0.00 46.19 44.35 2doc s LEU 29 CO -0.00 0.11 0.20 -0.24 -1.32 0.00 0.00 176.35 175.09 2doc n SER 30 N 3.99 1.72 0.10 3.68 2.88 0.20 -4.78 113.62 121.41 2doc n SER 30 Ca -0.15 -1.85 -0.02 0.00 -1.33 0.00 0.00 58.87 55.52 2doc n SER 30 Cb 0.52 -0.03 -0.01 0.00 -0.75 0.00 0.00 64.21 63.94 2doc n SER 30 CO 0.00 0.00 0.00 0.06 -1.23 0.00 0.00 175.04 173.87 2doc h GLN 31 N 0.00 0.00 0.00 -1.46 -0.00 -1.92 -2.71 115.11 109.02 2doc h GLN 31 Ca -0.16 0.00 0.00 0.00 -0.00 0.00 0.00 58.65 58.49 2doc h GLN 31 Cb 0.58 0.00 0.00 0.00 -0.00 0.00 0.00 27.48 28.06 2doc h GLN 31 CO 0.24 0.75 -0.89 0.25 -0.00 0.00 0.00 178.83 179.18 2doc n THR 32 N -3.37 0.00 -4.28 1.86 -2.24 -1.26 -2.40 114.28 102.59 2doc n THR 32 Ca 0.01 0.00 -0.23 0.00 -2.27 0.00 0.00 64.05 61.55 2doc n THR 32 Cb 0.81 -0.13 -0.07 0.00 -2.10 0.00 0.00 70.33 68.83 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 -1.83 3.18 -0.18 4.28 -4.23 -1.26 -2.82 115.64 112.78 2doc s THR 33 Ca 0.00 -1.92 -0.06 0.00 -1.18 0.00 0.00 61.69 58.53 2doc s THR 33 Cb 0.00 -2.82 0.08 0.00 1.34 0.00 0.00 72.50 71.10 2doc s THR 33 CO 0.00 -0.32 0.38 0.00 -0.54 0.00 0.00 174.62 174.14 2doc s ALA 34 N -2.39 -0.99 -0.23 3.99 0.00 -0.87 0.62 121.76 121.89 2doc s ALA 34 Ca 0.33 1.35 -0.17 0.00 0.00 0.00 0.00 51.96 53.47 2doc s ALA 34 Cb -0.05 -1.23 -0.03 0.00 0.00 0.00 0.00 23.12 21.81 2doc s ALA 34 CO 0.20 -0.71 0.45 0.21 0.00 0.00 0.00 175.76 175.91 2doc s LYS 35 N 2.53 4.11 -0.21 0.00 2.20 0.23 -0.26 119.74 128.33 2doc s LYS 35 Ca -0.01 0.24 -0.05 0.00 -0.36 0.00 0.00 55.97 55.79 2doc s LYS 35 Cb -0.12 -3.60 -0.02 0.00 -1.51 0.00 0.00 37.83 32.58 2doc s LYS 35 CO -0.12 -0.21 -0.01 0.54 -0.36 0.00 0.00 175.35 175.19 2doc s VAL 36 N 1.85 3.71 -0.19 4.02 0.11 -0.44 -2.87 120.40 126.59 2doc s VAL 36 Ca 0.20 -0.39 -0.02 0.00 -2.93 0.00 0.00 61.98 58.84 2doc s VAL 36 Cb -0.15 -2.69 -0.00 0.00 -1.53 0.00 0.00 36.38 32.01 2doc s VAL 36 CO 0.09 0.42 -0.11 -0.55 -3.33 0.00 0.00 175.10 171.62 2doc s SER 37 N 1.27 3.90 0.39 3.54 0.15 -0.81 -2.30 113.70 119.84 2doc s SER 37 Ca 0.04 -0.45 0.04 0.00 0.70 0.00 0.00 55.95 56.27 2doc s SER 37 Cb -0.15 -1.64 -0.02 0.00 -1.71 0.00 0.00 66.02 62.50 2doc s SER 37 CO 0.00 0.02 0.16 0.72 1.20 0.00 0.00 173.24 175.34 2doc s PHE 38 N 1.21 1.77 0.24 3.44 -0.12 -0.69 -0.15 117.98 123.67 2doc s PHE 38 Ca 0.02 -1.37 0.11 0.00 -0.05 0.00 0.00 56.93 55.65 2doc s PHE 38 Cb -0.14 -1.06 -0.05 0.00 -0.63 0.00 0.00 43.02 41.14 2doc s PHE 38 CO -0.04 -0.43 -0.21 -0.80 -0.05 0.00 0.00 175.22 173.69 2doc s ASN 39 N -3.55 3.46 0.56 1.98 0.01 0.37 -4.75 114.94 113.01 2doc s ASN 39 Ca 0.27 -0.97 -0.20 0.00 -0.71 0.00 0.00 52.86 51.25 2doc s ASN 39 Cb 0.02 -0.27 -0.04 0.00 0.41 0.00 0.00 41.25 41.37 2doc s ASN 39 CO 0.17 0.06 1.26 -0.54 -1.51 0.00 0.00 177.10 176.54 2doc s LYS 40 N -3.19 3.11 0.50 -0.60 -0.14 -1.26 -3.52 119.74 114.64 2doc s LYS 40 Ca 0.26 1.99 -0.21 0.00 -1.36 0.00 0.00 55.97 56.65 2doc s LYS 40 Cb -0.06 -2.11 -0.07 0.00 -1.68 0.00 0.00 37.83 33.91 2doc s LYS 40 CO 0.13 -1.14 1.15 -1.25 -0.76 0.00 0.00 175.35 173.47 2doc s PRO 41 N -3.08 3.56 0.54 -1.68 0.04 -1.26 -4.66 135.00 128.46 2doc s PRO 41 Ca 0.74 1.69 0.32 0.00 0.04 0.00 0.00 61.00 63.79 2doc s PRO 41 Cb -0.34 -2.21 1.34 0.00 0.04 0.00 0.00 34.50 33.32 2doc s PRO 41 CO 0.39 -0.69 1.98 -0.44 0.04 0.00 0.00 177.00 178.28 2doc h ASP 42 N 1.63 0.00 -3.26 6.66 3.32 -1.87 -3.41 116.42 119.49 2doc h ASP 42 Ca -0.50 0.00 -0.53 0.00 0.02 0.00 0.00 57.03 56.02 2doc h ASP 42 Cb 1.25 0.00 -0.38 0.00 0.22 0.00 0.00 39.33 40.43 2doc h ASP 42 CO 0.59 0.05 -0.79 -0.44 -1.72 0.00 0.00 179.24 176.92 2doc s SER 43 N -5.78 2.47 0.15 6.45 0.01 -1.26 -5.00 113.70 110.74 2doc s SER 43 Ca 0.01 -0.48 0.12 0.00 1.31 0.00 0.00 55.95 56.90 2doc s SER 43 Cb 0.09 -0.82 -0.10 0.00 0.21 0.00 0.00 66.02 65.41 2doc s SER 43 CO 0.56 -0.17 1.20 1.12 0.41 0.00 0.00 173.24 176.36 2doc h HIS 44 N 8.17 0.00 -0.40 2.43 2.07 -1.86 0.11 115.15 125.67 2doc h HIS 44 Ca -0.25 0.00 0.00 0.00 -2.85 0.00 0.00 60.37 57.27 2doc h HIS 44 Cb 1.12 0.00 0.00 0.00 2.57 0.00 0.00 27.41 31.10 2doc h HIS 44 CO 0.45 0.75 0.00 0.41 -3.07 0.00 0.00 177.93 176.47 2doc n GLY 45 N 1.33 0.88 3.25 6.13 0.00 -1.26 -2.01 105.19 113.51 2doc n GLY 45 Ca -0.03 -0.21 0.00 0.00 0.00 0.00 0.00 46.02 45.78 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 -0.20 1.97 3.93 -0.02 0.00 -1.26 -3.95 105.19 105.66 2doc n GLY 46 Ca 0.00 -0.23 -0.27 0.00 0.00 0.00 0.00 46.02 45.52 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 5.27 0.53 1.61 -7.23 -1.26 -5.07 120.40 114.24 2doc s VAL 47 Ca 0.00 -0.51 -0.20 0.00 -1.81 0.00 0.00 61.98 59.46 2doc s VAL 47 Cb 0.00 -3.73 -0.06 0.00 0.56 0.00 0.00 36.38 33.15 2doc s VAL 47 CO 0.00 -0.12 1.13 -2.16 -0.31 0.00 0.00 175.10 173.65 2doc s PRO 48 N -3.24 3.43 0.35 4.82 0.04 -1.26 -4.77 135.00 134.37 2doc s PRO 48 Ca 0.36 1.64 -0.27 0.00 0.04 0.00 0.00 61.00 62.77 2doc s PRO 48 Cb -0.11 -2.07 -0.09 0.00 0.04 0.00 0.00 34.50 32.26 2doc s PRO 48 CO 0.29 -0.79 1.20 0.42 0.04 0.00 0.00 177.00 178.15 2doc s ILE 49 N -1.73 3.08 -0.20 0.56 1.01 -1.26 -4.09 121.20 118.56 2doc s ILE 49 Ca 0.71 1.02 -0.19 0.00 0.00 0.00 0.00 60.65 62.19 2doc s ILE 49 Cb -0.25 -3.62 -0.16 0.00 0.01 0.00 0.00 42.46 38.45 2doc s ILE 49 CO 0.28 0.18 0.09 1.57 0.00 0.00 0.00 174.94 177.07 2doc n HIS 50 N 0.59 0.91 -3.85 3.97 -0.00 -0.27 -4.94 115.22 111.63 2doc n HIS 50 Ca 0.01 0.39 -0.08 0.00 0.46 0.00 0.00 57.72 58.50 2doc n HIS 50 Cb 0.44 -1.03 -0.03 0.00 -0.12 0.00 0.00 29.99 29.25 2doc n HIS 50 CO 0.00 0.00 0.00 -3.38 0.46 0.00 0.00 176.34 173.42 2doc s HIS 51 N -2.36 -0.05 -0.13 1.57 -3.43 -1.14 -4.25 115.29 105.50 2doc s HIS 51 Ca -0.27 -0.35 -0.05 0.00 -0.80 0.00 0.00 55.06 53.59 2doc s HIS 51 Cb 0.06 0.50 -0.04 0.00 -1.43 0.00 0.00 32.58 31.67 2doc s HIS 51 CO 0.52 -1.09 0.05 0.71 -2.00 0.00 0.00 174.74 172.93 2doc s TYR 52 N -3.93 3.28 -0.42 0.38 2.02 -1.26 -2.30 117.35 115.12 2doc s TYR 52 Ca 0.13 0.21 -0.08 0.00 -0.37 0.00 0.00 57.07 56.96 2doc s TYR 52 Cb -0.03 -1.92 0.09 0.00 -0.40 0.00 0.00 41.96 39.70 2doc s TYR 52 CO 0.04 0.41 0.26 -1.14 -1.57 0.00 0.00 175.55 173.55 2doc s GLN 53 N -0.47 2.51 -0.14 -0.62 -0.44 -0.43 -3.62 119.66 116.44 2doc s GLN 53 Ca 0.10 -1.55 -0.06 0.00 -2.50 0.00 0.00 55.36 51.35 2doc s GLN 53 Cb -0.12 -3.76 -0.04 0.00 -1.64 0.00 0.00 33.01 27.45 2doc s GLN 53 CO 0.02 -1.00 0.07 0.08 0.50 0.00 0.00 175.29 174.96 2doc s VAL 54 N 1.37 4.88 -0.14 1.34 1.01 -1.18 -2.76 120.40 124.93 2doc s VAL 54 Ca 0.04 -0.01 0.01 0.00 0.00 0.00 0.00 61.98 62.01 2doc s VAL 54 Cb -0.23 -3.15 0.02 0.00 0.00 0.00 0.00 36.38 33.02 2doc s VAL 54 CO 0.01 0.54 -0.15 -0.62 0.00 0.00 0.00 175.10 174.88 2doc s ASP 55 N -0.30 2.62 0.09 3.32 -1.08 -1.11 -0.23 116.67 119.99 2doc s ASP 55 Ca 0.09 -0.47 0.06 0.00 -0.52 0.00 0.00 52.55 51.71 2doc s ASP 55 Cb -0.12 -1.16 -0.03 0.00 -1.46 0.00 0.00 42.92 40.15 2doc s ASP 55 CO 0.01 -0.03 -0.17 0.54 0.52 0.00 0.00 175.17 176.05 2doc s VAL 56 N 1.31 1.36 0.07 1.11 0.11 0.28 -2.24 120.40 122.40 2doc s VAL 56 Ca 0.01 -1.45 -0.28 0.00 -2.93 0.00 0.00 61.98 57.34 2doc s VAL 56 Cb -0.14 -1.31 0.09 0.00 -1.53 0.00 0.00 36.38 33.50 2doc s VAL 56 CO -0.08 -0.19 1.12 -1.59 -3.33 0.00 0.00 175.10 171.03 2doc s LYS 57 N -1.93 0.80 0.25 1.54 -2.85 -1.13 -0.66 119.74 115.77 2doc s LYS 57 Ca 0.03 -0.44 -0.30 0.00 -1.00 0.00 0.00 55.97 54.25 2doc s LYS 57 Cb -0.09 0.27 -0.09 0.00 -2.06 0.00 0.00 37.83 35.86 2doc s LYS 57 CO 0.03 -0.37 1.00 -1.21 0.10 0.00 0.00 175.35 174.90 2doc s GLU 58 N -2.86 4.78 0.12 1.78 2.02 -1.26 -0.88 118.70 122.40 2doc s GLU 58 Ca 0.13 1.60 0.07 0.00 0.02 0.00 0.00 54.97 56.79 2doc s GLU 58 Cb 0.02 -3.25 0.37 0.00 0.10 0.00 0.00 34.13 31.37 2doc s GLU 58 CO -0.01 0.41 1.16 1.55 0.02 0.00 0.00 175.26 178.39 2doc n VAL 59 N 1.40 1.44 -0.06 2.63 3.14 -1.21 -1.15 118.33 124.51 2doc n VAL 59 Ca -0.02 0.59 -0.07 0.00 -2.96 0.00 0.00 64.34 61.88 2doc n VAL 59 Cb 0.46 -1.59 -0.09 0.00 -1.06 0.00 0.00 33.84 31.56 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 -1.54 1.69 -0.92 1.55 0.00 -1.26 -5.02 120.51 115.02 2doc n ALA 60 Ca -0.00 -0.79 -0.29 0.00 0.00 0.00 0.00 53.44 52.35 2doc n ALA 60 Cb 0.08 0.01 0.18 0.00 0.00 0.00 0.00 19.45 19.73 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 -4.68 2.60 -0.00 0.00 0.15 -0.30 -4.98 113.70 106.48 2doc s SER 61 Ca -0.09 1.61 0.02 0.00 0.70 0.00 0.00 55.95 58.20 2doc s SER 61 Cb 0.04 -2.27 -0.02 0.00 -1.71 0.00 0.00 66.02 62.06 2doc s SER 61 CO 0.48 -3.21 0.08 1.21 1.20 0.00 0.00 173.24 173.01 2doc n GLU 62 N -4.27 5.54 -3.36 5.44 4.07 -1.26 -4.76 120.64 122.05 2doc n GLU 62 Ca 0.07 -0.00 -0.40 0.00 -0.06 0.00 0.00 57.16 56.77 2doc n GLU 62 Cb 0.54 -0.65 -0.09 0.00 -0.06 0.00 0.00 31.44 31.18 2doc n GLU 62 CO 0.00 0.00 0.00 0.42 -0.06 0.00 0.00 177.13 177.49 2doc s ILE 63 N -1.31 5.14 -0.00 6.31 1.01 -1.26 -5.06 121.20 126.03 2doc s ILE 63 Ca 0.01 0.42 -0.23 0.00 0.00 0.00 0.00 60.65 60.85 2doc s ILE 63 Cb 0.02 -3.78 -0.05 0.00 0.01 0.00 0.00 42.46 38.66 2doc s ILE 63 CO 0.09 0.03 0.69 0.26 0.00 0.00 0.00 174.94 176.00 2doc s TRP 64 N 2.13 3.68 -0.25 3.97 0.52 -1.26 -4.73 118.94 122.99 2doc s TRP 64 Ca 0.15 1.32 -0.11 0.00 0.02 0.00 0.00 56.10 57.48 2doc s TRP 64 Cb -0.16 -2.74 -0.05 0.00 -1.15 0.00 0.00 33.47 29.37 2doc s TRP 64 CO 0.11 0.25 0.17 0.15 0.02 0.00 0.00 176.95 177.65 2doc s LYS 65 N 0.12 4.04 -0.13 4.98 -0.14 0.17 -4.93 119.74 123.84 2doc s LYS 65 Ca 0.36 -0.27 -0.11 0.00 -1.36 0.00 0.00 55.97 54.58 2doc s LYS 65 Cb -0.19 -3.57 -0.05 0.00 -1.68 0.00 0.00 37.83 32.34 2doc s LYS 65 CO 0.20 -0.01 0.23 0.42 -0.76 0.00 0.00 175.35 175.43 2doc s ILE 66 N 1.26 5.34 -0.23 2.17 -1.09 -1.26 -0.56 121.20 126.84 2doc s ILE 66 Ca 0.08 0.42 -0.04 0.00 -2.23 0.00 0.00 60.65 58.88 2doc s ILE 66 Cb -0.14 -3.54 0.09 0.00 -1.58 0.00 0.00 42.46 37.28 2doc s ILE 66 CO 0.06 0.50 0.15 -0.69 -1.23 0.00 0.00 174.94 173.73 2doc s VAL 67 N -0.24 -0.15 0.23 2.92 1.01 0.69 -5.01 120.40 119.86 2doc s VAL 67 Ca 0.15 -0.42 -0.02 0.00 0.00 0.00 0.00 61.98 61.69 2doc s VAL 67 Cb -0.13 -0.79 -0.05 0.00 0.00 0.00 0.00 36.38 35.41 2doc s VAL 67 CO 0.04 -0.47 0.45 0.00 0.00 0.00 0.00 175.10 175.13 2doc s ARG 68 N 2.17 3.57 0.25 2.72 1.70 -1.26 -3.13 118.95 124.98 2doc s ARG 68 Ca 0.06 -0.20 -0.10 0.00 -0.47 0.00 0.00 55.73 55.02 2doc s ARG 68 Cb -0.16 -2.77 -0.07 0.00 -0.57 0.00 0.00 34.95 31.38 2doc s ARG 68 CO -0.23 0.34 0.58 -1.12 -1.08 0.00 0.00 175.30 173.79 2doc s SER 69 N -3.12 6.63 0.19 -2.89 0.01 -1.24 -4.99 113.70 108.28 2doc s SER 69 Ca 0.41 0.96 -0.22 0.00 1.31 0.00 0.00 55.95 58.40 2doc s SER 69 Cb -0.11 -2.24 0.10 0.00 0.21 0.00 0.00 66.02 63.98 2doc s SER 69 CO 0.29 -0.11 1.57 -0.74 0.41 0.00 0.00 173.24 174.66 2doc h HIS 70 N 2.38 -1.11 0.00 2.43 2.76 -1.98 -3.44 115.15 116.18 2doc h HIS 70 Ca -0.47 0.08 0.00 0.00 -2.20 0.00 0.00 60.37 57.78 2doc h HIS 70 Cb 1.17 0.58 0.00 0.00 1.55 0.00 0.00 27.41 30.71 2doc h HIS 70 CO 0.61 -0.40 0.00 0.41 -1.30 0.00 0.00 177.93 177.25 2doc n GLY 71 N -1.42 3.96 1.70 5.26 0.00 -1.26 -5.00 105.19 108.42 2doc n GLY 71 Ca 0.04 -0.92 0.04 0.00 0.00 0.00 0.00 46.02 45.19 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 2.36 -0.93 1.61 0.24 -1.26 -4.29 118.33 116.05 2doc n VAL 72 Ca 0.00 -1.20 -0.37 0.00 -2.04 0.00 0.00 64.34 60.73 2doc n VAL 72 Cb 0.00 -0.33 0.06 0.00 -1.47 0.00 0.00 33.84 32.10 2doc n VAL 72 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 2doc n GLN 73 N 0.44 -0.29 0.00 7.34 3.00 -1.26 -4.94 117.38 121.68 2doc n GLN 73 Ca 0.25 -0.08 0.00 0.00 -0.01 0.00 0.00 57.00 57.16 2doc n GLN 73 Cb 1.08 -1.18 0.00 0.00 0.00 0.00 0.00 30.24 30.14 2doc n GLN 73 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.06 177.31 2doc n THR 74 N -3.40 0.00 -4.12 5.09 -2.24 -1.26 -4.88 114.28 103.46 2doc n THR 74 Ca -0.01 -0.47 -0.22 0.00 -2.27 0.00 0.00 64.05 61.07 2doc n THR 74 Cb 0.67 1.02 -0.17 0.00 -2.10 0.00 0.00 70.33 69.75 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 -0.61 1.04 0.01 -0.78 -2.45 -1.26 -1.71 119.30 113.54 2doc s MET 75 Ca 0.00 -0.14 0.01 0.00 -1.25 0.00 0.00 55.69 54.31 2doc s MET 75 Cb 0.00 -1.07 -0.01 0.00 1.25 0.00 0.00 34.83 35.00 2doc s MET 75 CO 0.00 -0.13 -0.04 0.08 1.05 0.00 0.00 175.02 175.98 2doc s VAL 76 N 1.19 0.29 -0.19 10.11 1.01 -0.97 -4.98 120.40 126.84 2doc s VAL 76 Ca -0.06 -0.54 -0.07 0.00 0.00 0.00 0.00 61.98 61.30 2doc s VAL 76 Cb -0.14 -0.32 -0.04 0.00 0.00 0.00 0.00 36.38 35.88 2doc s VAL 76 CO -0.02 -0.17 0.06 0.54 0.00 0.00 0.00 175.10 175.52 2doc s VAL 77 N -0.70 4.71 0.26 2.92 0.11 -1.26 -1.33 120.40 125.11 2doc s VAL 77 Ca -0.05 -0.06 -0.09 0.00 -2.93 0.00 0.00 61.98 58.85 2doc s VAL 77 Cb -0.05 -3.13 -0.07 0.00 -1.53 0.00 0.00 36.38 31.59 2doc s VAL 77 CO -0.00 0.44 0.58 -0.76 -3.33 0.00 0.00 175.10 172.03 2doc s LEU 78 N 0.55 4.12 0.00 2.54 1.43 0.64 -4.88 118.68 123.08 2doc s LEU 78 Ca 0.03 0.93 0.05 0.00 -1.03 0.00 0.00 54.13 54.10 2doc s LEU 78 Cb -0.13 -3.71 -0.02 0.00 0.03 0.00 0.00 46.19 42.37 2doc s LEU 78 CO 0.01 -0.12 0.17 -0.46 0.23 0.00 0.00 176.35 176.18 2doc n ASN 79 N -0.36 -0.12 -3.39 2.29 2.04 -1.26 -2.05 115.26 112.40 2doc n ASN 79 Ca 0.00 -2.52 -0.21 0.00 -0.44 0.00 0.00 54.58 51.41 2doc n ASN 79 Cb 0.53 1.06 0.08 0.00 -2.53 0.00 0.00 39.78 38.92 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 -2.00 -5.47 -4.45 0.53 3.02 -1.26 -4.98 115.26 100.65 2doc n ASN 80 Ca 0.03 -0.52 -0.28 0.00 -0.03 0.00 0.00 54.58 53.78 2doc n ASN 80 Cb 0.42 -4.78 -0.12 0.00 -0.61 0.00 0.00 39.78 34.70 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 -6.80 2.56 0.08 3.41 1.43 -1.13 -5.12 118.68 113.12 2doc s LEU 81 Ca 0.46 -0.70 -0.13 0.00 -1.03 0.00 0.00 54.13 52.74 2doc s LEU 81 Cb -0.20 -1.37 -0.06 0.00 0.03 0.00 0.00 46.19 44.59 2doc s LEU 81 CO 0.69 0.15 0.45 -1.61 0.23 0.00 0.00 176.35 176.26 2doc s GLU 82 N -2.36 3.88 0.85 1.70 2.02 -1.26 -4.40 118.70 119.12 2doc s GLU 82 Ca 0.19 0.35 -0.11 0.00 0.02 0.00 0.00 54.97 55.41 2doc s GLU 82 Cb -0.09 -3.04 0.10 0.00 0.10 0.00 0.00 34.13 31.19 2doc s GLU 82 CO 0.10 0.57 1.09 -1.25 0.02 0.00 0.00 175.26 175.79 2doc s PRO 83 N -1.68 1.65 -1.22 0.39 0.04 -1.01 -3.55 135.00 129.63 2doc s PRO 83 Ca 0.32 0.95 -0.09 0.00 0.04 0.00 0.00 61.00 62.22 2doc s PRO 83 Cb -0.15 -1.84 0.07 0.00 0.04 0.00 0.00 34.50 32.61 2doc s PRO 83 CO 0.17 -2.00 0.43 0.27 0.04 0.00 0.00 177.00 175.91 2doc n ASN 84 N -3.74 -3.46 -4.25 6.66 0.23 -1.14 -4.91 115.26 104.66 2doc n ASN 84 Ca 0.08 -0.33 -0.17 0.00 -0.53 0.00 0.00 54.58 53.63 2doc n ASN 84 Cb 0.54 -2.88 -0.11 0.00 -2.08 0.00 0.00 39.78 35.25 2doc n ASN 84 CO 0.00 0.00 0.00 -0.89 -0.93 0.00 0.00 177.26 175.44 2doc s THR 85 N -2.86 1.29 -0.01 5.53 2.01 -1.23 -4.96 115.64 115.41 2doc s THR 85 Ca 0.37 -1.86 0.02 0.00 0.31 0.00 0.00 61.69 60.52 2doc s THR 85 Cb -0.20 -1.66 -0.03 0.00 0.01 0.00 0.00 72.50 70.62 2doc s THR 85 CO 0.45 -0.55 -0.04 -0.89 -0.69 0.00 0.00 174.62 172.91 2doc s THR 86 N -2.60 3.90 -0.03 -0.82 2.01 -1.26 -0.55 115.64 116.29 2doc s THR 86 Ca 0.12 -0.66 -0.02 0.00 0.31 0.00 0.00 61.69 61.44 2doc s THR 86 Cb -0.02 -2.70 0.01 0.00 0.01 0.00 0.00 72.50 69.79 2doc s THR 86 CO 0.02 0.41 0.07 -0.31 -0.69 0.00 0.00 174.62 174.13 2doc s TYR 87 N -1.02 -0.08 -0.26 4.92 1.51 -0.82 -3.34 117.35 118.27 2doc s TYR 87 Ca 0.18 0.21 -0.14 0.00 -1.01 0.00 0.00 57.07 56.30 2doc s TYR 87 Cb -0.11 0.01 -0.04 0.00 -0.11 0.00 0.00 41.96 41.71 2doc s TYR 87 CO 0.08 -0.05 0.32 -1.21 -1.11 0.00 0.00 175.55 173.58 2doc s GLU 88 N 0.13 4.03 0.10 -0.62 2.02 -0.05 -1.97 118.70 122.33 2doc s GLU 88 Ca -0.01 -0.04 0.09 0.00 0.02 0.00 0.00 54.97 55.03 2doc s GLU 88 Cb -0.01 -3.63 -0.04 0.00 0.10 0.00 0.00 34.13 30.55 2doc s GLU 88 CO -0.00 -0.20 -0.21 -1.50 0.02 0.00 0.00 175.26 173.37 2doc s ILE 89 N 1.82 2.65 -0.01 -1.63 2.07 0.14 -2.82 121.20 123.42 2doc s ILE 89 Ca 0.13 -1.50 -0.00 0.00 -1.41 0.00 0.00 60.65 57.87 2doc s ILE 89 Cb -0.15 -2.18 0.02 0.00 0.13 0.00 0.00 42.46 40.28 2doc s ILE 89 CO 0.09 0.16 0.02 0.00 -1.91 0.00 0.00 174.94 173.30 2doc s ARG 90 N -1.93 -0.02 -0.19 3.50 1.70 -0.95 0.29 118.95 121.35 2doc s ARG 90 Ca 0.16 0.11 -0.10 0.00 -0.47 0.00 0.00 55.73 55.43 2doc s ARG 90 Cb -0.10 -0.14 -0.05 0.00 -0.57 0.00 0.00 34.95 34.09 2doc s ARG 90 CO 0.08 -0.10 0.13 0.08 -1.08 0.00 0.00 175.30 174.42 2doc s VAL 91 N 0.61 5.42 0.01 4.99 1.01 -1.26 -2.76 120.40 128.41 2doc s VAL 91 Ca -0.05 0.20 0.02 0.00 0.00 0.00 0.00 61.98 62.14 2doc s VAL 91 Cb -0.07 -3.46 -0.01 0.00 0.00 0.00 0.00 36.38 32.84 2doc s VAL 91 CO -0.02 0.46 -0.05 0.00 0.00 0.00 0.00 175.10 175.50 2doc s ALA 92 N 0.17 0.41 -0.20 5.51 0.00 -1.11 -0.63 121.76 125.90 2doc s ALA 92 Ca 0.09 -0.31 -0.11 0.00 0.00 0.00 0.00 51.96 51.63 2doc s ALA 92 Cb -0.11 -0.06 -0.05 0.00 0.00 0.00 0.00 23.12 22.89 2doc s ALA 92 CO -0.01 0.07 0.16 0.00 0.00 0.00 0.00 175.76 175.98 2doc s ALA 93 N -0.38 3.66 -0.15 0.00 0.00 -1.26 -1.32 121.76 122.31 2doc s ALA 93 Ca -0.01 -0.70 0.02 0.00 0.00 0.00 0.00 51.96 51.27 2doc s ALA 93 Cb -0.03 -2.24 0.01 0.00 0.00 0.00 0.00 23.12 20.86 2doc s ALA 93 CO -0.00 0.07 -0.20 0.08 0.00 0.00 0.00 175.76 175.71 2doc s VAL 94 N 0.54 2.21 0.51 0.00 1.01 -0.97 -0.96 120.40 122.73 2doc s VAL 94 Ca 0.09 -0.92 0.03 0.00 0.00 0.00 0.00 61.98 61.18 2doc s VAL 94 Cb -0.12 -1.90 -0.01 0.00 0.00 0.00 0.00 36.38 34.35 2doc s VAL 94 CO 0.00 0.54 0.12 0.54 0.00 0.00 0.00 175.10 176.30 2doc s ASN 95 N 0.94 4.27 0.40 3.32 4.22 0.12 -1.12 114.94 127.09 2doc s ASN 95 Ca -0.04 -1.48 0.18 0.00 -2.14 0.00 0.00 52.86 49.38 2doc s ASN 95 Cb -0.15 0.36 0.96 0.00 1.28 0.00 0.00 41.25 43.70 2doc s ASN 95 CO -0.04 -0.87 1.47 1.23 -2.04 0.00 0.00 177.10 176.85 2doc h GLY 96 N 1.22 0.00 0.41 0.45 0.00 -1.90 -0.29 103.07 102.96 2doc h GLY 96 Ca -0.42 0.00 -0.18 0.00 0.00 0.00 0.00 47.33 46.73 2doc h GLY 96 CO 0.70 0.00 -0.91 1.70 0.00 0.00 0.00 176.54 178.03 2doc h LYS 97 N 0.00 0.18 0.00 4.80 1.63 -1.92 -3.51 116.57 117.75 2doc h LYS 97 Ca 0.00 -0.30 0.00 0.00 -0.85 0.00 0.00 60.65 59.50 2doc h LYS 97 Cb 0.55 0.11 0.00 0.00 -0.60 0.00 0.00 32.23 32.30 2doc h LYS 97 CO 0.00 1.15 0.00 0.41 -3.45 0.00 0.00 179.45 177.56 2doc n GLY 98 N 1.65 -0.68 3.23 5.01 0.00 -0.12 -5.03 105.19 109.25 2doc n GLY 98 Ca -0.19 -0.43 -0.35 0.00 0.00 0.00 0.00 46.02 45.05 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 -1.06 2.81 1.21 1.61 0.74 -1.26 -0.70 119.66 123.00 2doc s GLN 99 Ca 0.00 -1.01 -0.18 0.00 0.05 0.00 0.00 55.36 54.22 2doc s GLN 99 Cb 0.00 -3.12 0.29 0.00 1.10 0.00 0.00 33.01 31.28 2doc s GLN 99 CO 0.00 -0.46 1.07 0.20 -0.55 0.00 0.00 175.29 175.55 2doc s GLY 100 N 1.35 1.54 0.74 2.59 0.00 -0.13 -4.97 107.32 108.45 2doc s GLY 100 Ca -0.00 -0.76 -0.15 0.00 0.00 0.00 0.00 44.72 43.81 2doc s GLY 100 CO -0.02 0.09 1.07 1.22 0.00 0.00 0.00 173.10 175.46 2doc n ASP 101 N -4.85 0.80 -4.78 1.64 9.92 -1.26 -4.64 116.55 113.39 2doc n ASP 101 Ca 0.11 0.66 -0.39 0.00 -0.53 0.00 0.00 54.79 54.64 2doc n ASP 101 Cb 0.59 -1.45 -0.06 0.00 -0.64 0.00 0.00 41.12 39.56 2doc n ASP 101 CO 0.00 0.00 0.00 -0.31 0.13 0.00 0.00 177.20 177.02 2doc s TYR 102 N -1.85 3.79 1.20 1.24 1.51 -1.26 -4.13 117.35 117.85 2doc s TYR 102 Ca 0.74 1.40 -0.13 0.00 -1.01 0.00 0.00 57.07 58.07 2doc s TYR 102 Cb -0.33 -2.67 0.29 0.00 -0.11 0.00 0.00 41.96 39.14 2doc s TYR 102 CO 0.49 0.44 0.94 0.45 -1.11 0.00 0.00 175.55 176.77 2doc n SER 103 N 2.17 -1.96 -4.58 2.29 2.88 0.20 -4.80 113.62 109.82 2doc n SER 103 Ca -0.07 -0.22 -0.45 0.00 -1.33 0.00 0.00 58.87 56.81 2doc n SER 103 Cb 0.50 -1.22 -0.04 0.00 -0.75 0.00 0.00 64.21 62.70 2doc n SER 103 CO 0.00 0.00 0.00 1.17 -1.23 0.00 0.00 175.04 174.98 2doc n LYS 104 N -4.87 1.84 -1.24 -1.46 3.00 -1.26 -4.68 118.16 109.49 2doc n LYS 104 Ca 0.02 0.52 -0.50 0.00 -0.00 0.00 0.00 58.31 58.35 2doc n LYS 104 Cb 0.55 -3.07 -0.08 0.00 0.00 0.00 0.00 35.03 32.43 2doc n LYS 104 CO 0.00 0.00 0.00 -0.89 0.00 0.00 0.00 177.40 176.51 2doc n ILE 105 N 7.47 0.00 -3.92 3.15 2.08 -1.26 -4.90 119.36 121.99 2doc n ILE 105 Ca 0.31 0.00 -0.32 0.00 0.56 0.00 0.00 62.75 63.31 2doc n ILE 105 Cb 0.40 -0.37 -0.04 0.00 -0.75 0.00 0.00 39.64 38.88 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 2.57 3.44 -0.15 0.38 0.41 0.15 -4.95 118.70 120.54 2doc s GLU 106 Ca 0.80 -0.41 -0.01 0.00 -0.41 0.00 0.00 54.97 54.93 2doc s GLU 106 Cb -1.12 -3.05 0.04 0.00 -1.78 0.00 0.00 34.13 28.23 2doc s GLU 106 CO 0.59 0.63 -0.01 0.42 -0.49 0.00 0.00 175.26 176.40 2doc s ILE 107 N -1.47 0.75 -0.05 -1.63 1.01 -1.26 0.24 121.20 118.80 2doc s ILE 107 Ca 0.33 -0.44 0.05 0.00 0.00 0.00 0.00 60.65 60.59 2doc s ILE 107 Cb -0.13 -1.04 -0.01 0.00 0.01 0.00 0.00 42.46 41.30 2doc s ILE 107 CO 0.26 0.04 -0.21 0.72 0.00 0.00 0.00 174.94 175.75 2doc s PHE 108 N 1.78 2.05 -0.24 3.97 -0.12 -0.83 -4.98 117.98 119.61 2doc s PHE 108 Ca 0.01 -0.62 -0.09 0.00 -0.05 0.00 0.00 56.93 56.18 2doc s PHE 108 Cb -0.15 -1.36 -0.04 0.00 -0.63 0.00 0.00 43.02 40.83 2doc s PHE 108 CO -0.07 -0.21 0.11 -1.14 -0.05 0.00 0.00 175.22 173.86 2doc s GLN 109 N 0.00 3.84 1.15 1.99 0.74 -1.26 -1.94 119.66 124.18 2doc s GLN 109 Ca -0.05 -0.39 -0.13 0.00 0.05 0.00 0.00 55.36 54.84 2doc s GLN 109 Cb -0.13 -3.42 0.27 0.00 1.10 0.00 0.00 33.01 30.83 2doc s GLN 109 CO 0.03 -0.07 0.98 0.25 -0.55 0.00 0.00 175.29 175.93 2doc n THR 110 N 4.63 0.00 -3.18 -0.34 -2.24 0.29 -4.94 114.28 108.50 2doc n THR 110 Ca -0.16 -0.40 -0.37 0.00 -2.27 0.00 0.00 64.05 60.85 2doc n THR 110 Cb 0.52 -0.98 -0.06 0.00 -2.10 0.00 0.00 70.33 67.71 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 -6.91 4.45 -0.15 3.22 1.43 -1.02 -4.10 118.68 115.60 2doc s LEU 111 Ca 0.68 1.35 -0.29 0.00 -1.03 0.00 0.00 54.13 54.84 2doc s LEU 111 Cb -0.25 -3.26 -0.03 0.00 0.03 0.00 0.00 46.19 42.68 2doc s LEU 111 CO 0.65 0.16 1.56 -2.16 0.23 0.00 0.00 176.35 176.79 2doc s PRO 112 N -1.54 4.00 -0.35 1.29 0.04 -1.26 -2.87 135.00 134.31 2doc s PRO 112 Ca 0.36 1.84 -0.36 0.00 0.04 0.00 0.00 61.00 62.88 2doc s PRO 112 Cb -0.18 -3.97 -0.15 0.00 0.04 0.00 0.00 34.50 30.23 2doc s PRO 112 CO 0.21 -1.04 1.19 0.28 0.04 0.00 0.00 177.00 177.69 2doc n VAL 113 N 5.91 0.00 -4.03 -0.36 0.31 -1.26 -4.93 118.33 113.97 2doc n VAL 113 Ca 0.17 0.00 -0.12 0.00 -0.01 0.00 0.00 64.34 64.39 2doc n VAL 113 Cb 0.44 -0.35 -0.11 0.00 -0.91 0.00 0.00 33.84 32.91 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 2.08 0.65 0.00 4.52 0.15 -1.26 -5.10 113.70 114.74 2doc s SER 114 Ca 0.80 -0.54 0.00 0.00 0.70 0.00 0.00 55.95 56.91 2doc s SER 114 Cb -1.14 0.06 0.00 0.00 -1.71 0.00 0.00 66.02 63.23 2doc s SER 114 CO 0.61 -0.24 0.00 0.61 1.20 0.00 0.00 173.24 175.42 2doc n GLY 115 N 1.50 -1.04 0.14 9.45 0.00 -1.26 -4.86 105.19 109.12 2doc n GLY 115 Ca -0.23 -1.40 -0.13 0.00 0.00 0.00 0.00 46.02 44.25 2doc n GLY 115 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2doc h PRO 116 N 0.00 0.39 -6.79 1.61 0.13 -2.05 -3.45 132.00 121.83 2doc h PRO 116 Ca 0.00 -0.20 -0.55 0.00 -0.87 0.00 0.00 66.00 64.38 2doc h PRO 116 Cb 0.00 0.01 0.10 0.00 0.13 0.00 0.00 31.00 31.23 2doc h PRO 116 CO 0.00 0.76 0.74 -1.13 -0.23 0.00 0.00 178.00 178.13 2doc n SER 117 N -4.53 3.46 -4.77 1.44 3.41 -1.26 -4.96 113.62 106.40 2doc n SER 117 Ca -0.06 1.18 -0.32 0.00 -0.26 0.00 0.00 58.87 59.41 2doc n SER 117 Cb 0.37 -1.55 0.06 0.00 -0.26 0.00 0.00 64.21 62.82 2doc n SER 117 CO 0.00 0.00 0.00 -0.44 -0.16 0.00 0.00 175.04 174.44 2doc s SER 118 N 0.13 4.96 0.00 4.04 0.01 -1.26 -5.02 113.70 116.55 2doc s SER 118 Ca 0.60 1.95 0.00 0.00 1.31 0.00 0.00 55.95 59.81 2doc s SER 118 Cb -0.53 -2.54 0.00 0.00 0.21 0.00 0.00 66.02 63.16 2doc s SER 118 CO 0.56 -1.73 0.00 0.61 0.41 0.00 0.00 173.24 173.08