#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 0.75 0.04 1.61 0.01 -1.26 -5.18 113.70 109.67 2doc s SER 2 Ca 0.00 -1.42 -0.25 0.00 1.31 0.00 0.00 55.95 55.59 2doc s SER 2 Cb 0.00 0.60 0.06 0.00 0.21 0.00 0.00 66.02 66.89 2doc s SER 2 CO 0.00 -1.19 0.58 -0.55 0.41 0.00 0.00 173.24 172.50 2doc s SER 3 N -3.21 -0.53 0.14 2.44 0.15 -1.26 -5.18 113.70 106.25 2doc s SER 3 Ca 0.32 0.32 -0.25 0.00 0.70 0.00 0.00 55.95 57.03 2doc s SER 3 Cb 0.01 0.52 0.07 0.00 -1.71 0.00 0.00 66.02 64.91 2doc s SER 3 CO 0.18 -0.73 0.96 -0.83 1.20 0.00 0.00 173.24 174.02 2doc s GLY 4 N -1.85 -0.25 -0.31 9.45 0.00 -1.26 -5.12 107.32 107.99 2doc s GLY 4 Ca -0.06 0.19 -0.43 0.00 0.00 0.00 0.00 44.72 44.41 2doc s GLY 4 CO 0.00 0.02 1.55 -1.14 0.00 0.00 0.00 173.10 173.53 2doc n SER 5 N -0.46 1.45 -4.44 1.64 3.41 -1.26 -4.87 113.62 109.09 2doc n SER 5 Ca -0.06 1.14 -0.32 0.00 -0.26 0.00 0.00 58.87 59.37 2doc n SER 5 Cb 0.61 -1.00 0.16 0.00 -0.26 0.00 0.00 64.21 63.72 2doc n SER 5 CO 0.00 0.00 0.00 -0.24 -0.16 0.00 0.00 175.04 174.64 2doc n SER 6 N 3.94 -1.61 -4.12 4.04 2.88 -1.26 -5.04 113.62 112.46 2doc n SER 6 Ca 0.27 0.18 -0.08 0.00 -1.33 0.00 0.00 58.87 57.91 2doc n SER 6 Cb 0.04 -1.21 -0.10 0.00 -0.75 0.00 0.00 64.21 62.19 2doc n SER 6 CO 0.00 0.00 0.00 -0.83 -1.23 0.00 0.00 175.04 172.98 2doc s GLY 7 N -2.15 0.61 0.54 0.46 0.00 -1.26 -5.00 107.32 100.52 2doc s GLY 7 Ca 0.60 -1.28 0.32 0.00 0.00 0.00 0.00 44.72 44.37 2doc s GLY 7 CO 0.65 -1.36 1.28 -1.06 0.00 0.00 0.00 173.10 172.60 2doc n GLN 8 N 0.05 0.01 -0.50 2.90 6.02 -1.26 0.90 117.38 125.50 2doc n GLN 8 Ca -0.13 0.96 -0.06 0.00 -0.01 0.00 0.00 57.00 57.77 2doc n GLN 8 Cb 0.61 -2.33 0.02 0.00 1.02 0.00 0.00 30.24 29.56 2doc n GLN 8 CO 0.00 0.00 0.00 0.39 -1.01 0.00 0.00 177.06 176.44 2doc n GLU 9 N -3.32 1.29 0.05 -1.09 1.02 -1.26 -4.36 120.64 112.98 2doc n GLU 9 Ca 0.28 -0.62 -0.13 0.00 -0.02 0.00 0.00 57.16 56.68 2doc n GLU 9 Cb 1.57 -1.24 -0.09 0.00 -0.02 0.00 0.00 31.44 31.66 2doc n GLU 9 CO 0.00 0.00 0.00 0.10 1.18 0.00 0.00 177.13 178.41 2doc h TYR 10 N 0.81 -0.13 0.00 -0.32 -0.00 0.10 -3.37 116.97 114.07 2doc h TYR 10 Ca 0.12 -0.00 0.00 0.00 0.00 0.00 0.00 58.73 58.85 2doc h TYR 10 Cb 1.12 0.04 0.00 0.00 0.00 0.00 0.00 36.73 37.89 2doc h TYR 10 CO 0.40 0.21 -0.80 -0.89 -0.00 0.00 0.00 178.16 177.09 2doc n ILE 11 N -5.00 0.00 0.33 -0.90 5.41 -1.26 -4.61 119.36 113.34 2doc n ILE 11 Ca -0.09 0.00 0.10 0.00 1.00 0.00 0.00 62.75 63.77 2doc n ILE 11 Cb 0.21 -0.83 0.54 0.00 -0.71 0.00 0.00 39.64 38.84 2doc n ILE 11 CO 0.00 0.00 0.00 -0.07 0.00 0.00 0.00 176.55 176.48 2doc h LEU 12 N 0.00 0.00 0.16 1.39 3.38 -1.82 0.57 115.31 118.98 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 0.80 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.55 2doc h LEU 12 CO 0.00 0.00 -1.75 0.00 0.09 0.00 0.00 178.44 176.78 2doc h ALA 13 N 0.89 0.24 -0.31 1.53 0.00 -1.84 -3.31 119.26 116.46 2doc h ALA 13 Ca 0.00 -1.19 0.00 0.00 0.00 0.00 0.00 54.91 53.72 2doc h ALA 13 Cb 1.10 0.46 0.00 0.00 0.00 0.00 0.00 17.79 19.35 2doc h ALA 13 CO 0.00 1.11 0.00 1.28 0.00 0.00 0.00 179.25 181.64 2doc n LEU 14 N -3.53 2.28 -4.87 0.00 4.77 0.18 -4.88 117.00 110.97 2doc n LEU 14 Ca -0.24 -1.15 -0.36 0.00 -0.03 0.00 0.00 56.01 54.23 2doc n LEU 14 Cb 1.06 -0.36 -0.06 0.00 -2.33 0.00 0.00 43.42 41.74 2doc n LEU 14 CO 0.50 0.44 0.00 0.00 -1.33 0.00 0.00 177.39 177.00 2doc s ALA 15 N -1.64 3.78 0.00 -1.18 0.00 -0.38 -4.66 121.76 117.67 2doc s ALA 15 Ca 0.23 -0.44 0.00 0.00 0.00 0.00 0.00 51.96 51.75 2doc s ALA 15 Cb 0.14 -2.19 0.00 0.00 0.00 0.00 0.00 23.12 21.08 2doc s ALA 15 CO 0.12 0.58 0.00 -0.25 0.00 0.00 0.00 175.76 176.21 2doc n ASP 16 N 1.33 0.00 -3.54 0.00 8.00 -1.26 -4.90 116.55 116.19 2doc n ASP 16 Ca -0.12 0.00 -0.11 0.00 0.71 0.00 0.00 54.79 55.27 2doc n ASP 16 Cb 0.53 0.00 -0.04 0.00 -0.02 0.00 0.00 41.12 41.59 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 -0.48 0.00 0.35 2.53 -7.23 -1.26 -4.62 120.40 109.69 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 -1.94 4.29 0.75 4.82 0.04 -0.98 -4.41 135.00 137.58 2doc s PRO 18 Ca -0.01 1.98 -0.11 0.00 0.04 0.00 0.00 61.00 62.91 2doc s PRO 18 Cb -0.01 -2.94 0.04 0.00 0.04 0.00 0.00 34.50 31.63 2doc s PRO 18 CO -0.02 -0.16 1.08 0.45 0.04 0.00 0.00 177.00 178.39 2doc s SER 19 N -0.82 4.94 0.38 6.66 0.15 0.72 -3.93 113.70 121.80 2doc s SER 19 Ca 0.51 1.46 -0.27 0.00 0.70 0.00 0.00 55.95 58.34 2doc s SER 19 Cb -0.35 -2.26 -0.10 0.00 -1.71 0.00 0.00 66.02 61.61 2doc s SER 19 CO 0.45 -1.71 1.36 -0.94 1.20 0.00 0.00 173.24 173.60 2doc s SER 20 N -3.86 6.43 1.12 5.45 1.04 -1.23 -4.65 113.70 117.99 2doc s SER 20 Ca 0.59 2.78 -0.16 0.00 0.48 0.00 0.00 55.95 59.64 2doc s SER 20 Cb -0.14 -2.65 0.25 0.00 0.10 0.00 0.00 66.02 63.57 2doc s SER 20 CO 0.55 -0.78 1.10 -2.16 0.98 0.00 0.00 173.24 172.93 2doc s PRO 21 N -2.08 -0.54 0.21 4.02 0.04 -1.26 -4.86 135.00 130.53 2doc s PRO 21 Ca 0.54 0.18 -0.06 0.00 0.04 0.00 0.00 61.00 61.70 2doc s PRO 21 Cb -0.41 -1.65 -0.02 0.00 0.04 0.00 0.00 34.50 32.45 2doc s PRO 21 CO 0.54 -3.31 0.27 1.52 0.04 0.00 0.00 177.00 176.06 2doc s TYR 22 N -2.99 0.77 0.00 0.56 1.13 -1.25 -4.73 117.35 110.84 2doc s TYR 22 Ca 0.68 -1.07 0.00 0.00 -1.41 0.00 0.00 57.07 55.28 2doc s TYR 22 Cb -0.14 -0.23 0.00 0.00 -1.10 0.00 0.00 41.96 40.49 2doc s TYR 22 CO 0.57 -0.77 0.00 0.41 -2.51 0.00 0.00 175.55 173.25 2doc n GLY 23 N -0.29 2.72 3.32 5.49 0.00 -1.26 -2.11 105.19 113.06 2doc n GLY 23 Ca -0.01 0.00 -0.54 0.00 0.00 0.00 0.00 46.02 45.47 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 -1.96 0.00 -3.98 1.61 3.14 -1.26 -4.72 118.33 111.16 2doc n VAL 24 Ca 0.00 -0.01 -0.11 0.00 -2.96 0.00 0.00 64.34 61.27 2doc n VAL 24 Cb 0.00 -0.53 -0.12 0.00 -1.06 0.00 0.00 33.84 32.13 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 6.85 0.28 -0.44 1.45 0.00 0.61 -4.96 119.74 123.53 2doc s LYS 25 Ca 1.24 -0.46 -0.26 0.00 0.00 0.00 0.00 55.97 56.50 2doc s LYS 25 Cb -1.42 -0.01 0.02 0.00 0.00 0.00 0.00 37.83 36.43 2doc s LYS 25 CO 0.61 -0.01 0.93 0.42 0.00 0.00 0.00 175.35 177.29 2doc s ILE 26 N -1.01 4.50 -0.11 3.79 -1.09 -1.26 -1.36 121.20 124.66 2doc s ILE 26 Ca -0.10 0.86 -0.13 0.00 -2.23 0.00 0.00 60.65 59.05 2doc s ILE 26 Cb -0.07 -4.41 -0.27 0.00 -1.58 0.00 0.00 42.46 36.14 2doc s ILE 26 CO -0.00 -0.76 0.48 0.16 -1.23 0.00 0.00 174.94 173.59 2doc h ILE 27 N 6.01 0.90 -3.71 2.92 3.07 -1.92 -3.44 117.51 121.35 2doc h ILE 27 Ca -0.24 -2.37 -0.68 0.00 1.55 0.00 0.00 64.86 63.12 2doc h ILE 27 Cb 1.08 2.61 -0.34 0.00 -0.27 0.00 0.00 36.82 39.89 2doc h ILE 27 CO 1.01 0.73 -0.68 -1.61 -1.05 0.00 0.00 178.15 176.56 2doc s GLU 28 N -2.50 2.20 -0.18 0.16 2.02 -1.26 -5.05 118.70 114.10 2doc s GLU 28 Ca -0.21 -1.47 -0.02 0.00 0.02 0.00 0.00 54.97 53.28 2doc s GLU 28 Cb 0.05 -3.24 -0.01 0.00 0.10 0.00 0.00 34.13 31.03 2doc s GLU 28 CO 0.76 -0.75 -0.07 -1.17 0.02 0.00 0.00 175.26 174.04 2doc s LEU 29 N 1.17 2.88 0.00 1.80 2.96 -1.26 -0.37 118.68 125.86 2doc s LEU 29 Ca -0.01 -0.33 0.01 0.00 -0.22 0.00 0.00 54.13 53.59 2doc s LEU 29 Cb -0.20 -1.70 0.01 0.00 0.50 0.00 0.00 46.19 44.80 2doc s LEU 29 CO -0.03 0.08 0.11 -1.20 -1.32 0.00 0.00 176.35 173.99 2doc n SER 30 N 4.15 2.64 0.11 3.68 7.64 0.16 -4.82 113.62 127.17 2doc n SER 30 Ca -0.18 -2.41 0.12 0.00 1.01 0.00 0.00 58.87 57.41 2doc n SER 30 Cb 0.52 0.13 0.15 0.00 -1.01 0.00 0.00 64.21 64.00 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 -2.05 115.11 112.57 2doc h GLN 31 Ca -0.26 0.00 0.00 0.00 -0.00 0.00 0.00 58.65 58.39 2doc h GLN 31 Cb 0.86 0.00 0.00 0.00 -0.00 0.00 0.00 27.48 28.34 2doc h GLN 31 CO 0.43 0.00 -0.68 0.25 -0.00 0.00 0.00 178.83 178.84 2doc n THR 32 N -2.46 0.00 -4.30 1.86 -2.24 -1.26 -2.40 114.28 103.47 2doc n THR 32 Ca 0.03 0.00 -0.24 0.00 -2.27 0.00 0.00 64.05 61.57 2doc n THR 32 Cb 0.49 -0.61 -0.08 0.00 -2.10 0.00 0.00 70.33 68.03 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 -1.68 2.80 -0.23 4.28 -4.23 -1.26 -2.42 115.64 112.91 2doc s THR 33 Ca 0.00 -1.95 -0.08 0.00 -1.18 0.00 0.00 61.69 58.48 2doc s THR 33 Cb 0.00 -2.80 0.10 0.00 1.34 0.00 0.00 72.50 71.13 2doc s THR 33 CO 0.00 -0.24 0.49 0.00 -0.54 0.00 0.00 174.62 174.34 2doc s ALA 34 N -2.47 -1.42 -0.11 3.99 0.00 -0.87 -0.66 121.76 120.21 2doc s ALA 34 Ca 0.34 1.78 -0.12 0.00 0.00 0.00 0.00 51.96 53.96 2doc s ALA 34 Cb -0.02 -1.41 -0.05 0.00 0.00 0.00 0.00 23.12 21.65 2doc s ALA 34 CO 0.20 -0.73 0.28 0.21 0.00 0.00 0.00 175.76 175.72 2doc s LYS 35 N 2.51 3.97 -0.14 0.00 2.20 0.50 -0.21 119.74 128.57 2doc s LYS 35 Ca -0.04 0.11 0.02 0.00 -0.36 0.00 0.00 55.97 55.70 2doc s LYS 35 Cb -0.11 -3.31 0.00 0.00 -1.51 0.00 0.00 37.83 32.90 2doc s LYS 35 CO -0.15 0.49 -0.19 0.54 -0.36 0.00 0.00 175.35 175.68 2doc s VAL 36 N -0.30 2.34 -0.15 4.02 0.11 -0.19 -3.46 120.40 122.77 2doc s VAL 36 Ca 0.18 -0.89 0.01 0.00 -2.93 0.00 0.00 61.98 58.35 2doc s VAL 36 Cb -0.14 -1.96 0.00 0.00 -1.53 0.00 0.00 36.38 32.76 2doc s VAL 36 CO 0.06 0.53 -0.18 -0.55 -3.33 0.00 0.00 175.10 171.64 2doc s SER 37 N 0.77 3.45 0.26 3.54 0.15 -0.46 -2.57 113.70 118.84 2doc s SER 37 Ca -0.07 -0.53 0.02 0.00 0.70 0.00 0.00 55.95 56.07 2doc s SER 37 Cb -0.16 -1.52 -0.05 0.00 -1.71 0.00 0.00 66.02 62.58 2doc s SER 37 CO -0.00 0.08 0.08 0.72 1.20 0.00 0.00 173.24 175.31 2doc s PHE 38 N 0.86 1.57 0.11 3.44 -0.71 -0.66 -0.28 117.98 122.30 2doc s PHE 38 Ca -0.05 -1.13 0.04 0.00 -1.04 0.00 0.00 56.93 54.75 2doc s PHE 38 Cb -0.15 -0.94 -0.04 0.00 -1.21 0.00 0.00 43.02 40.68 2doc s PHE 38 CO -0.02 -0.27 0.10 -0.80 -1.34 0.00 0.00 175.22 172.90 2doc s ASN 39 N -3.33 5.56 0.64 1.98 0.01 -0.90 -4.71 114.94 114.20 2doc s ASN 39 Ca 0.36 -0.04 -0.18 0.00 -0.71 0.00 0.00 52.86 52.30 2doc s ASN 39 Cb 0.08 -1.49 -0.01 0.00 0.41 0.00 0.00 41.25 40.24 2doc s ASN 39 CO 0.13 0.14 1.26 -0.54 -1.51 0.00 0.00 177.10 176.58 2doc s LYS 40 N -2.63 2.63 1.04 -0.60 -0.14 -1.26 -3.88 119.74 114.91 2doc s LYS 40 Ca 0.30 1.96 -0.13 0.00 -1.36 0.00 0.00 55.97 56.73 2doc s LYS 40 Cb -0.11 -1.87 0.21 0.00 -1.68 0.00 0.00 37.83 34.38 2doc s LYS 40 CO 0.23 -1.51 1.09 -1.25 -0.76 0.00 0.00 175.35 173.16 2doc s PRO 41 N -3.42 0.06 -0.09 -1.68 0.04 -1.26 -4.78 135.00 123.87 2doc s PRO 41 Ca 0.80 0.40 0.13 0.00 0.04 0.00 0.00 61.00 62.38 2doc s PRO 41 Cb -0.34 -1.70 -0.19 0.00 0.04 0.00 0.00 34.50 32.30 2doc s PRO 41 CO 0.38 -2.96 0.16 -0.40 0.04 0.00 0.00 177.00 174.23 2doc n ASP 42 N -4.31 1.64 -3.75 6.66 5.75 -1.26 -4.75 116.55 116.53 2doc n ASP 42 Ca 0.06 0.00 -0.29 0.00 -0.01 0.00 0.00 54.79 54.55 2doc n ASP 42 Cb 0.58 1.18 -0.09 0.00 -1.03 0.00 0.00 41.12 41.75 2doc n ASP 42 CO 0.00 0.00 0.00 -1.20 -0.11 0.00 0.00 177.20 175.89 2doc n SER 43 N -2.30 3.66 0.22 -1.12 7.64 -1.26 -4.87 113.62 115.59 2doc n SER 43 Ca -0.14 -3.31 0.10 0.00 1.01 0.00 0.00 58.87 56.53 2doc n SER 43 Cb 0.72 -0.79 0.42 0.00 -1.01 0.00 0.00 64.21 63.54 2doc n SER 43 CO 0.00 0.00 0.00 1.12 -3.01 0.00 0.00 175.04 173.15 2doc h HIS 44 N 4.99 0.00 0.00 1.43 2.07 -1.85 0.21 115.15 121.99 2doc h HIS 44 Ca 0.17 0.00 0.00 0.00 -2.85 0.00 0.00 60.37 57.69 2doc h HIS 44 Cb 0.72 0.00 0.00 0.00 2.57 0.00 0.00 27.41 30.70 2doc h HIS 44 CO 0.72 0.21 0.00 0.41 -3.07 0.00 0.00 177.93 176.21 2doc n GLY 45 N 0.31 0.62 0.02 6.13 0.00 -1.26 -2.31 105.19 108.70 2doc n GLY 45 Ca 0.01 -1.58 0.07 0.00 0.00 0.00 0.00 46.02 44.52 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 -0.85 3.41 -0.02 0.00 -1.26 -4.97 105.19 101.51 2doc n GLY 46 Ca 0.00 -0.42 -0.30 0.00 0.00 0.00 0.00 46.02 45.30 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 -3.19 2.48 0.25 1.61 -7.23 -1.26 -4.81 120.40 108.25 2doc s VAL 47 Ca -0.07 -1.47 -0.30 0.00 -1.81 0.00 0.00 61.98 58.33 2doc s VAL 47 Cb 0.11 -2.06 -0.09 0.00 0.56 0.00 0.00 36.38 34.90 2doc s VAL 47 CO 0.76 0.22 1.27 -2.16 -0.31 0.00 0.00 175.10 174.89 2doc s PRO 48 N -1.71 4.43 0.50 4.82 0.04 -1.26 -4.92 135.00 136.90 2doc s PRO 48 Ca 0.14 2.05 -0.22 0.00 0.04 0.00 0.00 61.00 63.01 2doc s PRO 48 Cb -0.10 -3.16 -0.08 0.00 0.04 0.00 0.00 34.50 31.20 2doc s PRO 48 CO 0.06 -0.14 1.08 -0.89 0.04 0.00 0.00 177.00 177.15 2doc n ILE 49 N 1.84 3.03 -0.10 0.56 5.41 -1.26 -4.53 119.36 124.31 2doc n ILE 49 Ca 0.03 -0.50 -0.23 0.00 1.00 0.00 0.00 62.75 63.05 2doc n ILE 49 Cb 0.43 -1.30 -0.12 0.00 -0.71 0.00 0.00 39.64 37.95 2doc n ILE 49 CO 0.00 0.00 0.00 1.57 0.00 0.00 0.00 176.55 178.12 2doc n HIS 50 N -0.91 0.46 -3.66 1.39 -0.00 -0.79 -4.97 115.22 106.74 2doc n HIS 50 Ca 0.10 0.14 -0.06 0.00 0.46 0.00 0.00 57.72 58.37 2doc n HIS 50 Cb 0.43 -1.05 0.02 0.00 -0.12 0.00 0.00 29.99 29.26 2doc n HIS 50 CO 0.00 0.00 0.00 -2.39 0.46 0.00 0.00 176.34 174.41 2doc n HIS 51 N -3.86 -1.80 -4.70 1.57 1.44 -0.98 -4.50 115.22 102.39 2doc n HIS 51 Ca -0.43 -1.30 -0.30 0.00 -2.01 0.00 0.00 57.72 53.68 2doc n HIS 51 Cb 0.91 0.65 -0.14 0.00 0.12 0.00 0.00 29.99 31.52 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 -3.51 2.33 -0.29 -1.40 2.02 -1.26 -2.17 117.35 113.07 2doc s TYR 52 Ca 0.14 -0.39 -0.01 0.00 -0.37 0.00 0.00 57.07 56.44 2doc s TYR 52 Cb -0.03 -1.34 0.05 0.00 -0.40 0.00 0.00 41.96 40.24 2doc s TYR 52 CO 0.08 0.21 -0.03 -1.14 -1.57 0.00 0.00 175.55 173.10 2doc s GLN 53 N -1.56 2.43 -0.02 -0.62 0.74 -0.82 -4.15 119.66 115.65 2doc s GLN 53 Ca 0.13 -1.26 -0.02 0.00 0.05 0.00 0.00 55.36 54.26 2doc s GLN 53 Cb -0.10 -3.11 -0.04 0.00 1.10 0.00 0.00 33.01 30.87 2doc s GLN 53 CO 0.04 -0.59 0.10 0.08 -0.55 0.00 0.00 175.29 174.37 2doc s VAL 54 N 1.23 4.93 0.11 1.34 1.01 -1.17 -2.61 120.40 125.24 2doc s VAL 54 Ca -0.06 -0.29 0.04 0.00 0.00 0.00 0.00 61.98 61.67 2doc s VAL 54 Cb -0.20 -3.25 -0.04 0.00 0.00 0.00 0.00 36.38 32.90 2doc s VAL 54 CO -0.02 0.38 -0.10 1.51 0.00 0.00 0.00 175.10 176.88 2doc s ASP 55 N -1.67 1.48 -0.24 3.32 -4.77 -1.17 -0.47 116.67 113.15 2doc s ASP 55 Ca 0.23 -0.89 -0.23 0.00 -3.30 0.00 0.00 52.55 48.36 2doc s ASP 55 Cb -0.12 0.02 0.06 0.00 -1.09 0.00 0.00 42.92 41.79 2doc s ASP 55 CO 0.13 -0.31 0.65 0.54 0.70 0.00 0.00 175.17 176.88 2doc s VAL 56 N -2.85 0.00 -0.08 2.11 0.11 -0.49 -2.95 120.40 116.26 2doc s VAL 56 Ca 0.09 -0.00 -0.30 0.00 -2.93 0.00 0.00 61.98 58.84 2doc s VAL 56 Cb -0.00 -0.91 0.09 0.00 -1.53 0.00 0.00 36.38 34.03 2doc s VAL 56 CO -0.01 -0.00 0.80 -0.75 -3.33 0.00 0.00 175.10 171.81 2doc s LYS 57 N 0.34 0.89 0.23 1.54 2.20 -1.02 -1.95 119.74 121.97 2doc s LYS 57 Ca -0.00 0.16 -0.30 0.00 -0.36 0.00 0.00 55.97 55.47 2doc s LYS 57 Cb -0.05 0.42 -0.09 0.00 -1.51 0.00 0.00 37.83 36.60 2doc s LYS 57 CO 0.01 -0.29 1.35 -1.21 -0.36 0.00 0.00 175.35 174.85 2doc s GLU 58 N -1.38 4.35 0.63 4.03 2.02 -1.26 -0.13 118.70 126.96 2doc s GLU 58 Ca -0.06 2.15 0.24 0.00 0.02 0.00 0.00 54.97 57.32 2doc s GLU 58 Cb -0.00 -3.15 1.19 0.00 0.10 0.00 0.00 34.13 32.27 2doc s GLU 58 CO 0.05 -0.29 1.66 -0.24 0.02 0.00 0.00 175.26 176.45 2doc h VAL 59 N 3.58 0.11 0.05 2.63 3.04 -1.92 0.23 116.25 123.98 2doc h VAL 59 Ca -0.46 0.00 -0.37 0.00 -1.01 0.00 0.00 66.70 64.86 2doc h VAL 59 Cb 1.22 0.43 -0.05 0.00 -2.01 0.00 0.00 31.29 30.89 2doc h VAL 59 CO 0.76 0.00 -2.20 0.00 -1.01 0.00 0.00 177.57 175.12 2doc n ALA 60 N -2.02 1.22 -0.49 3.17 0.00 -1.26 -4.97 120.51 116.16 2doc n ALA 60 Ca 0.05 -0.88 -0.29 0.00 0.00 0.00 0.00 53.44 52.33 2doc n ALA 60 Cb 0.75 -0.42 0.25 0.00 0.00 0.00 0.00 19.45 20.03 2doc n ALA 60 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 2doc n SER 61 N -3.29 -1.92 0.00 0.00 2.88 0.82 -4.98 113.62 107.13 2doc n SER 61 Ca -0.36 -0.19 0.00 0.00 -1.33 0.00 0.00 58.87 56.99 2doc n SER 61 Cb 1.04 -1.21 0.00 0.00 -0.75 0.00 0.00 64.21 63.28 2doc n SER 61 CO 0.00 0.00 0.00 -1.84 -1.23 0.00 0.00 175.04 171.97 2doc n GLU 62 N -4.68 1.07 -3.02 -1.46 0.28 -1.26 -4.77 120.64 106.81 2doc n GLU 62 Ca 0.02 0.00 -0.40 0.00 -0.16 0.00 0.00 57.16 56.62 2doc n GLU 62 Cb 0.55 -0.94 -0.05 0.00 1.43 0.00 0.00 31.44 32.44 2doc n GLU 62 CO 0.00 0.00 0.00 0.42 -0.16 0.00 0.00 177.13 177.39 2doc s ILE 63 N -1.76 4.99 -0.13 3.84 -1.09 -1.26 -5.06 121.20 120.74 2doc s ILE 63 Ca 0.00 1.51 -0.09 0.00 -2.23 0.00 0.00 60.65 59.83 2doc s ILE 63 Cb 0.00 -4.07 -0.05 0.00 -1.58 0.00 0.00 42.46 36.77 2doc s ILE 63 CO 0.00 0.26 0.19 0.26 -1.23 0.00 0.00 174.94 174.42 2doc s TRP 64 N 0.68 3.56 -0.23 3.97 0.52 -1.26 -4.72 118.94 121.46 2doc s TRP 64 Ca 0.39 0.55 -0.07 0.00 0.02 0.00 0.00 56.10 56.99 2doc s TRP 64 Cb -0.18 -2.08 -0.03 0.00 -1.15 0.00 0.00 33.47 30.03 2doc s TRP 64 CO 0.19 0.57 0.04 0.15 0.02 0.00 0.00 176.95 177.93 2doc s LYS 65 N -0.56 3.65 -0.16 4.98 -0.14 -0.82 -4.96 119.74 121.72 2doc s LYS 65 Ca 0.15 -0.49 -0.10 0.00 -1.36 0.00 0.00 55.97 54.18 2doc s LYS 65 Cb -0.12 -3.23 -0.05 0.00 -1.68 0.00 0.00 37.83 32.75 2doc s LYS 65 CO 0.04 -0.10 0.16 0.42 -0.76 0.00 0.00 175.35 175.11 2doc s ILE 66 N 1.34 5.42 -0.14 2.17 -1.09 -1.26 -1.40 121.20 126.25 2doc s ILE 66 Ca 0.05 0.25 -0.00 0.00 -2.23 0.00 0.00 60.65 58.71 2doc s ILE 66 Cb -0.15 -3.47 0.03 0.00 -1.58 0.00 0.00 42.46 37.30 2doc s ILE 66 CO 0.03 0.50 -0.07 -0.69 -1.23 0.00 0.00 174.94 173.47 2doc s VAL 67 N -0.13 1.13 0.37 2.92 1.01 0.38 -5.00 120.40 121.06 2doc s VAL 67 Ca 0.12 -0.49 -0.11 0.00 0.00 0.00 0.00 61.98 61.50 2doc s VAL 67 Cb -0.12 -1.21 -0.07 0.00 0.00 0.00 0.00 36.38 34.99 2doc s VAL 67 CO 0.01 0.26 0.73 -0.13 0.00 0.00 0.00 175.10 175.98 2doc s ARG 68 N 1.65 3.82 0.37 2.72 0.52 -1.26 -3.04 118.95 123.72 2doc s ARG 68 Ca 0.03 0.47 0.03 0.00 -0.52 0.00 0.00 55.73 55.74 2doc s ARG 68 Cb -0.14 -2.43 0.07 0.00 0.52 0.00 0.00 34.95 32.97 2doc s ARG 68 CO -0.08 0.04 0.51 0.43 0.02 0.00 0.00 175.30 176.22 2doc n SER 69 N -1.01 1.04 -2.43 0.23 7.64 -1.26 -5.04 113.62 112.79 2doc n SER 69 Ca 0.02 -1.79 -0.30 0.00 1.01 0.00 0.00 58.87 57.81 2doc n SER 69 Cb 0.54 -0.30 0.02 0.00 -1.01 0.00 0.00 64.21 63.46 2doc n SER 69 CO 0.00 0.00 0.00 1.41 -3.01 0.00 0.00 175.04 173.44 2doc n HIS 70 N -1.93 3.13 -1.47 1.43 8.25 -1.26 -5.01 115.22 118.36 2doc n HIS 70 Ca 0.09 -2.71 0.00 0.00 -0.26 0.00 0.00 57.72 54.84 2doc n HIS 70 Cb 0.34 -0.56 0.00 0.00 1.12 0.00 0.00 29.99 30.89 2doc n HIS 70 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 2doc n GLY 71 N -0.61 -0.11 1.38 -1.41 0.00 -1.26 -4.89 105.19 98.29 2doc n GLY 71 Ca 0.47 -1.63 -0.07 0.00 0.00 0.00 0.00 46.02 44.79 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 7.53 1.68 -1.79 1.61 0.24 -1.26 -4.47 118.33 121.88 2doc n VAL 72 Ca 0.00 -0.68 -0.32 0.00 -2.04 0.00 0.00 64.34 61.30 2doc n VAL 72 Cb 0.00 -0.73 0.03 0.00 -1.47 0.00 0.00 33.84 31.67 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 -1.31 3.15 -0.15 7.34 -2.07 -1.26 -4.98 119.66 120.38 2doc s GLN 73 Ca 0.21 1.03 0.16 0.00 -1.82 0.00 0.00 55.36 54.94 2doc s GLN 73 Cb 0.17 -2.02 0.48 0.00 -1.09 0.00 0.00 33.01 30.56 2doc s GLN 73 CO 0.04 -0.94 1.37 0.25 -1.32 0.00 0.00 175.29 174.70 2doc n THR 74 N -2.67 2.10 -3.90 3.63 -2.24 -1.26 -4.82 114.28 105.12 2doc n THR 74 Ca 0.08 -1.81 -0.24 0.00 -2.27 0.00 0.00 64.05 59.80 2doc n THR 74 Cb 0.53 -0.16 -0.17 0.00 -2.10 0.00 0.00 70.33 68.43 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 -2.62 1.04 0.01 -0.78 -2.45 -1.26 -1.66 119.30 111.59 2doc s MET 75 Ca 0.39 -0.08 -0.01 0.00 -1.25 0.00 0.00 55.69 54.74 2doc s MET 75 Cb 0.31 -1.22 -0.01 0.00 1.25 0.00 0.00 34.83 35.16 2doc s MET 75 CO 0.09 -0.25 -0.01 0.08 1.05 0.00 0.00 175.02 175.98 2doc s VAL 76 N 1.70 0.08 -0.15 10.11 1.01 -1.06 -4.99 120.40 127.10 2doc s VAL 76 Ca 0.02 -0.70 -0.03 0.00 0.00 0.00 0.00 61.98 61.27 2doc s VAL 76 Cb -0.13 -0.22 -0.03 0.00 0.00 0.00 0.00 36.38 36.00 2doc s VAL 76 CO -0.05 -0.38 -0.05 0.54 0.00 0.00 0.00 175.10 175.16 2doc s VAL 77 N -1.14 3.82 0.20 2.92 0.11 -1.26 -1.02 120.40 124.03 2doc s VAL 77 Ca -0.12 -0.39 -0.06 0.00 -2.93 0.00 0.00 61.98 58.48 2doc s VAL 77 Cb -0.08 -2.66 -0.06 0.00 -1.53 0.00 0.00 36.38 32.05 2doc s VAL 77 CO -0.01 0.50 0.46 -0.76 -3.33 0.00 0.00 175.10 171.97 2doc s LEU 78 N 0.27 4.20 0.30 2.54 1.43 0.71 -4.90 118.68 123.23 2doc s LEU 78 Ca -0.04 0.71 0.04 0.00 -1.03 0.00 0.00 54.13 53.81 2doc s LEU 78 Cb -0.14 -3.46 -0.03 0.00 0.03 0.00 0.00 46.19 42.58 2doc s LEU 78 CO 0.03 -0.03 0.19 0.20 0.23 0.00 0.00 176.35 176.96 2doc s ASN 79 N -2.56 1.46 -0.95 2.29 0.01 -1.26 -2.05 114.94 111.88 2doc s ASN 79 Ca 0.43 -1.60 -0.01 0.00 -0.71 0.00 0.00 52.86 50.97 2doc s ASN 79 Cb -0.12 0.44 -0.02 0.00 0.41 0.00 0.00 41.25 41.97 2doc s ASN 79 CO 0.24 -0.93 0.80 0.59 -1.51 0.00 0.00 177.10 176.29 2doc n ASN 80 N -1.03 -3.09 -4.20 -1.22 3.02 -1.25 -4.98 115.26 102.51 2doc n ASN 80 Ca 0.03 -0.53 -0.23 0.00 -0.03 0.00 0.00 54.58 53.82 2doc n ASN 80 Cb 0.64 -4.30 -0.14 0.00 -0.61 0.00 0.00 39.78 35.37 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 -5.39 2.15 0.20 3.41 1.43 -1.02 -5.09 118.68 114.37 2doc s LEU 81 Ca 0.11 -0.47 -0.22 0.00 -1.03 0.00 0.00 54.13 52.51 2doc s LEU 81 Cb -0.01 -0.81 -0.08 0.00 0.03 0.00 0.00 46.19 45.31 2doc s LEU 81 CO 0.60 0.11 0.75 -1.61 0.23 0.00 0.00 176.35 176.44 2doc s GLU 82 N -1.08 4.40 0.86 1.70 0.41 -1.26 -4.30 118.70 119.43 2doc s GLU 82 Ca 0.05 1.02 -0.11 0.00 -0.41 0.00 0.00 54.97 55.51 2doc s GLU 82 Cb -0.08 -3.05 0.11 0.00 -1.78 0.00 0.00 34.13 29.32 2doc s GLU 82 CO 0.01 0.47 1.09 -1.25 -0.49 0.00 0.00 175.26 175.10 2doc s PRO 83 N -1.59 1.59 -1.46 0.39 0.04 -1.01 -3.62 135.00 129.32 2doc s PRO 83 Ca 0.40 0.93 -0.14 0.00 0.04 0.00 0.00 61.00 62.23 2doc s PRO 83 Cb -0.20 -1.84 0.11 0.00 0.04 0.00 0.00 34.50 32.62 2doc s PRO 83 CO 0.23 -2.04 0.67 -1.71 0.04 0.00 0.00 177.00 174.18 2doc n ASN 84 N -3.76 -3.67 -4.21 6.66 2.85 -1.21 -4.93 115.26 106.98 2doc n ASN 84 Ca 0.08 -0.67 -0.15 0.00 -0.11 0.00 0.00 54.58 53.72 2doc n ASN 84 Cb 0.54 -3.01 -0.11 0.00 1.24 0.00 0.00 39.78 38.45 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 -3.10 1.08 0.02 -0.44 2.01 -1.24 -4.97 115.64 109.01 2doc s THR 85 Ca 0.57 -1.76 0.03 0.00 0.31 0.00 0.00 61.69 60.84 2doc s THR 85 Cb -0.30 -1.51 -0.04 0.00 0.01 0.00 0.00 72.50 70.66 2doc s THR 85 CO 0.70 -0.57 -0.04 -0.89 -0.69 0.00 0.00 174.62 173.12 2doc s THR 86 N -2.59 3.80 -0.06 -0.82 2.01 -1.26 -0.78 115.64 115.94 2doc s THR 86 Ca 0.09 -0.80 -0.05 0.00 0.31 0.00 0.00 61.69 61.24 2doc s THR 86 Cb -0.02 -2.70 0.01 0.00 0.01 0.00 0.00 72.50 69.81 2doc s THR 86 CO 0.01 0.33 0.15 -0.31 -0.69 0.00 0.00 174.62 174.11 2doc s TYR 87 N -1.08 -0.17 -0.26 4.92 1.51 -0.61 -3.52 117.35 118.15 2doc s TYR 87 Ca 0.19 0.40 -0.14 0.00 -1.01 0.00 0.00 57.07 56.52 2doc s TYR 87 Cb -0.11 0.06 -0.04 0.00 -0.11 0.00 0.00 41.96 41.75 2doc s TYR 87 CO 0.10 -0.08 0.33 -1.21 -1.11 0.00 0.00 175.55 173.58 2doc s GLU 88 N 0.06 4.04 0.08 -0.62 2.02 0.82 -1.89 118.70 123.20 2doc s GLU 88 Ca -0.00 -0.02 0.09 0.00 0.02 0.00 0.00 54.97 55.06 2doc s GLU 88 Cb -0.01 -3.63 -0.03 0.00 0.10 0.00 0.00 34.13 30.56 2doc s GLU 88 CO 0.00 -0.19 -0.24 -1.50 0.02 0.00 0.00 175.26 173.35 2doc s ILE 89 N 1.81 1.97 -0.03 -1.63 2.07 0.16 -2.42 121.20 123.12 2doc s ILE 89 Ca 0.14 -1.48 -0.01 0.00 -1.41 0.00 0.00 60.65 57.88 2doc s ILE 89 Cb -0.15 -1.73 0.02 0.00 0.13 0.00 0.00 42.46 40.73 2doc s ILE 89 CO 0.09 0.16 0.07 0.00 -1.91 0.00 0.00 174.94 173.35 2doc s ARG 90 N -1.60 0.04 -0.17 3.50 1.70 -1.15 0.35 118.95 121.61 2doc s ARG 90 Ca 0.10 0.19 -0.09 0.00 -0.47 0.00 0.00 55.73 55.46 2doc s ARG 90 Cb -0.10 -0.12 -0.05 0.00 -0.57 0.00 0.00 34.95 34.12 2doc s ARG 90 CO 0.04 -0.10 0.14 0.08 -1.08 0.00 0.00 175.30 174.37 2doc s VAL 91 N 0.66 5.43 0.08 4.99 1.01 -1.26 -3.04 120.40 128.27 2doc s VAL 91 Ca -0.05 0.21 0.04 0.00 0.00 0.00 0.00 61.98 62.18 2doc s VAL 91 Cb -0.07 -3.46 -0.03 0.00 0.00 0.00 0.00 36.38 32.82 2doc s VAL 91 CO -0.02 0.49 -0.11 0.00 0.00 0.00 0.00 175.10 175.46 2doc s ALA 92 N -0.05 1.03 -0.22 5.51 0.00 -1.07 -1.46 121.76 125.50 2doc s ALA 92 Ca 0.10 -1.03 -0.09 0.00 0.00 0.00 0.00 51.96 50.94 2doc s ALA 92 Cb -0.11 -0.02 -0.04 0.00 0.00 0.00 0.00 23.12 22.95 2doc s ALA 92 CO -0.00 0.04 0.11 0.00 0.00 0.00 0.00 175.76 175.92 2doc s ALA 93 N -1.78 3.49 -0.09 0.00 0.00 -1.26 -1.94 121.76 120.17 2doc s ALA 93 Ca -0.00 -0.87 0.05 0.00 0.00 0.00 0.00 51.96 51.14 2doc s ALA 93 Cb -0.07 -2.15 -0.00 0.00 0.00 0.00 0.00 23.12 20.89 2doc s ALA 93 CO 0.01 -0.10 -0.24 0.08 0.00 0.00 0.00 175.76 175.51 2doc s VAL 94 N 0.88 2.06 0.37 0.00 1.01 -0.92 -2.41 120.40 121.39 2doc s VAL 94 Ca 0.06 -1.03 0.05 0.00 0.00 0.00 0.00 61.98 61.06 2doc s VAL 94 Cb -0.13 -1.77 -0.02 0.00 0.00 0.00 0.00 36.38 34.46 2doc s VAL 94 CO 0.03 0.56 0.18 -0.46 0.00 0.00 0.00 175.10 175.41 2doc n ASN 95 N 3.35 0.62 -0.34 3.32 0.23 -0.48 -1.89 115.26 120.08 2doc n ASN 95 Ca -0.19 -3.11 0.30 0.00 -0.53 0.00 0.00 54.58 51.05 2doc n ASN 95 Cb 0.53 1.20 0.56 0.00 -2.08 0.00 0.00 39.78 39.99 2doc n ASN 95 CO 0.00 0.00 0.00 1.23 -0.93 0.00 0.00 177.26 177.56 2doc h GLY 96 N 1.71 2.14 0.72 4.83 0.00 -1.92 -0.62 103.07 109.92 2doc h GLY 96 Ca -0.28 -0.17 -0.04 0.00 0.00 0.00 0.00 47.33 46.84 2doc h GLY 96 CO 0.44 -0.69 -0.34 0.50 0.00 0.00 0.00 176.54 176.45 2doc h LYS 97 N 0.10 -0.93 0.00 4.80 1.79 -1.96 -3.50 116.57 116.88 2doc h LYS 97 Ca 0.82 0.06 0.00 0.00 -2.18 0.00 0.00 60.65 59.35 2doc h LYS 97 Cb 2.12 0.21 0.00 0.00 -1.58 0.00 0.00 32.23 32.98 2doc h LYS 97 CO -0.69 -0.62 0.00 0.41 -1.08 0.00 0.00 179.45 177.47 2doc n GLY 98 N -1.40 -0.79 3.13 3.86 0.00 -0.24 -5.10 105.19 104.65 2doc n GLY 98 Ca -0.12 0.04 -0.34 0.00 0.00 0.00 0.00 46.02 45.60 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 -0.35 2.21 0.00 1.61 0.74 -1.26 -1.38 119.66 121.22 2doc s GLN 99 Ca 0.00 -1.45 0.00 0.00 0.05 0.00 0.00 55.36 53.96 2doc s GLN 99 Cb 0.00 -3.20 0.00 0.00 1.10 0.00 0.00 33.01 30.91 2doc s GLN 99 CO 0.00 -0.72 0.00 0.41 -0.55 0.00 0.00 175.29 174.43 2doc n GLY 100 N 4.54 -3.08 3.84 2.59 0.00 -1.01 -4.96 105.19 107.10 2doc n GLY 100 Ca -0.09 -0.98 -0.37 0.00 0.00 0.00 0.00 46.02 44.57 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 -2.01 6.83 0.70 1.61 1.11 -1.25 -4.92 116.67 118.74 2doc s ASP 101 Ca 0.00 1.01 -0.13 0.00 0.18 0.00 0.00 52.55 53.61 2doc s ASP 101 Cb 0.00 -2.26 0.02 0.00 1.07 0.00 0.00 42.92 41.75 2doc s ASP 101 CO 0.00 0.25 1.09 -0.31 1.18 0.00 0.00 175.17 177.38 2doc s TYR 102 N -1.21 2.67 0.55 4.23 2.02 -1.26 -3.58 117.35 120.77 2doc s TYR 102 Ca 0.29 1.54 -0.07 0.00 -0.37 0.00 0.00 57.07 58.46 2doc s TYR 102 Cb -0.16 -3.08 -0.02 0.00 -0.40 0.00 0.00 41.96 38.29 2doc s TYR 102 CO 0.16 -1.65 0.89 -1.54 -1.57 0.00 0.00 175.55 171.84 2doc s SER 103 N -3.01 6.03 -0.43 2.29 1.04 -0.54 -4.77 113.70 114.31 2doc s SER 103 Ca 0.64 0.98 -0.41 0.00 0.48 0.00 0.00 55.95 57.64 2doc s SER 103 Cb -0.18 -2.13 -0.16 0.00 0.10 0.00 0.00 66.02 63.65 2doc s SER 103 CO 0.48 -0.81 2.08 1.17 0.98 0.00 0.00 173.24 177.14 2doc n LYS 104 N -2.49 0.49 -1.53 4.02 0.00 -1.26 -4.63 118.16 112.76 2doc n LYS 104 Ca 0.03 0.14 -0.60 0.00 0.00 0.00 0.00 58.31 57.89 2doc n LYS 104 Cb 0.56 -1.89 -0.08 0.00 0.00 0.00 0.00 35.03 33.61 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 6.38 0.00 -4.08 3.15 2.08 -1.26 -4.89 119.36 120.74 2doc n ILE 105 Ca 0.46 0.00 -0.33 0.00 0.56 0.00 0.00 62.75 63.44 2doc n ILE 105 Cb 0.07 -0.24 -0.07 0.00 -0.75 0.00 0.00 39.64 38.65 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 1.43 3.07 -0.19 0.38 0.41 0.15 -4.96 118.70 119.01 2doc s GLU 106 Ca 0.92 -0.50 -0.00 0.00 -0.41 0.00 0.00 54.97 54.97 2doc s GLU 106 Cb -1.30 -2.86 0.05 0.00 -1.78 0.00 0.00 34.13 28.24 2doc s GLU 106 CO 0.66 0.64 -0.04 0.42 -0.49 0.00 0.00 175.26 176.44 2doc s ILE 107 N -1.24 1.15 -0.03 -1.63 1.01 -1.26 0.40 121.20 119.60 2doc s ILE 107 Ca 0.24 -0.76 0.07 0.00 0.00 0.00 0.00 60.65 60.20 2doc s ILE 107 Cb -0.12 -1.38 -0.01 0.00 0.01 0.00 0.00 42.46 40.95 2doc s ILE 107 CO 0.16 0.04 -0.23 0.72 0.00 0.00 0.00 174.94 175.63 2doc s PHE 108 N 1.60 2.13 -0.23 3.97 -0.12 -0.79 -4.97 117.98 119.56 2doc s PHE 108 Ca -0.01 -0.49 -0.04 0.00 -0.05 0.00 0.00 56.93 56.34 2doc s PHE 108 Cb -0.16 -1.38 -0.01 0.00 -0.63 0.00 0.00 43.02 40.84 2doc s PHE 108 CO -0.07 -0.10 -0.02 -1.14 -0.05 0.00 0.00 175.22 173.84 2doc s GLN 109 N -0.38 3.34 1.05 1.99 0.74 -1.26 -1.57 119.66 123.56 2doc s GLN 109 Ca 0.04 -0.66 -0.13 0.00 0.05 0.00 0.00 55.36 54.66 2doc s GLN 109 Cb -0.10 -3.09 0.16 0.00 1.10 0.00 0.00 33.01 31.07 2doc s GLN 109 CO 0.01 -0.24 0.69 0.25 -0.55 0.00 0.00 175.29 175.45 2doc n THR 110 N 4.81 0.00 -3.21 -0.34 -2.24 0.04 -4.91 114.28 108.42 2doc n THR 110 Ca -0.17 -0.24 -0.37 0.00 -2.27 0.00 0.00 64.05 61.00 2doc n THR 110 Cb 0.50 -0.83 -0.06 0.00 -2.10 0.00 0.00 70.33 67.85 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 -4.38 4.41 -0.12 3.22 1.43 -0.77 -3.82 118.68 118.65 2doc s LEU 111 Ca 0.63 1.29 -0.29 0.00 -1.03 0.00 0.00 54.13 54.73 2doc s LEU 111 Cb -0.21 -3.30 -0.04 0.00 0.03 0.00 0.00 46.19 42.68 2doc s LEU 111 CO 0.64 0.13 1.54 -2.16 0.23 0.00 0.00 176.35 176.73 2doc s PRO 112 N -1.69 4.11 0.04 1.29 0.04 -1.26 -3.36 135.00 134.17 2doc s PRO 112 Ca 0.37 1.93 -0.26 0.00 0.04 0.00 0.00 61.00 63.09 2doc s PRO 112 Cb -0.17 -3.94 -0.13 0.00 0.04 0.00 0.00 34.50 30.30 2doc s PRO 112 CO 0.20 -0.90 0.64 0.28 0.04 0.00 0.00 177.00 177.26 2doc n VAL 113 N 5.65 0.38 -3.92 -0.36 0.31 -1.26 -4.93 118.33 114.21 2doc n VAL 113 Ca 0.17 -0.10 -0.30 0.00 -0.01 0.00 0.00 64.34 64.10 2doc n VAL 113 Cb 0.44 0.00 -0.15 0.00 -0.91 0.00 0.00 33.84 33.21 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 -0.19 3.92 0.39 4.52 0.15 -1.26 -5.11 113.70 116.11 2doc s SER 114 Ca 0.59 -1.31 -0.07 0.00 0.70 0.00 0.00 55.95 55.86 2doc s SER 114 Cb -0.82 -1.16 -0.05 0.00 -1.71 0.00 0.00 66.02 62.27 2doc s SER 114 CO 0.40 -0.27 0.69 -0.83 1.20 0.00 0.00 173.24 174.43 2doc s GLY 115 N 1.39 1.75 -0.03 9.45 0.00 -1.26 -5.03 107.32 113.60 2doc s GLY 115 Ca -0.02 -0.44 -0.30 0.00 0.00 0.00 0.00 44.72 43.96 2doc s GLY 115 CO -0.08 -0.29 1.47 2.56 0.00 0.00 0.00 173.10 176.76 2doc s PRO 116 N -4.03 4.24 0.01 2.90 0.04 -1.26 -4.93 135.00 131.97 2doc s PRO 116 Ca 0.47 2.02 -0.20 0.00 0.04 0.00 0.00 61.00 63.33 2doc s PRO 116 Cb -0.10 -3.71 -0.22 0.00 0.04 0.00 0.00 34.50 30.51 2doc s PRO 116 CO 0.35 -0.68 1.14 0.66 0.04 0.00 0.00 177.00 178.50 2doc h SER 117 N 8.37 0.52 -2.42 6.66 4.64 -2.07 -3.45 113.55 125.81 2doc h SER 117 Ca -0.37 -0.72 -0.61 0.00 -0.47 0.00 0.00 61.79 59.62 2doc h SER 117 Cb 1.17 -0.16 0.11 0.00 -0.31 0.00 0.00 62.40 63.22 2doc h SER 117 CO 0.93 1.16 0.09 -1.54 -0.87 0.00 0.00 176.83 176.60 2doc n SER 118 N -4.26 1.15 0.00 4.97 3.41 -1.26 -5.36 113.62 112.26 2doc n SER 118 Ca -0.10 1.17 0.00 0.00 -0.26 0.00 0.00 58.87 59.69 2doc n SER 118 Cb 0.62 -1.27 0.00 0.00 -0.26 0.00 0.00 64.21 63.30 2doc n SER 118 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49