#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 4.43 -1.68 1.61 0.15 -1.26 -4.67 113.70 112.28 2doc s SER 2 Ca 0.00 -1.02 -0.16 0.00 0.70 0.00 0.00 55.95 55.48 2doc s SER 2 Cb 0.00 -0.53 0.14 0.00 -1.71 0.00 0.00 66.02 63.92 2doc s SER 2 CO 0.00 -0.46 0.66 -1.54 1.20 0.00 0.00 173.24 173.10 2doc n SER 3 N -1.19 -2.41 0.00 5.45 3.41 -1.26 -4.88 113.62 112.74 2doc n SER 3 Ca -0.02 -1.06 0.00 0.00 -0.26 0.00 0.00 58.87 57.53 2doc n SER 3 Cb 0.64 -2.56 0.00 0.00 -0.26 0.00 0.00 64.21 62.03 2doc n SER 3 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2doc n GLY 4 N -1.51 1.79 3.65 5.00 0.00 -1.26 -5.18 105.19 107.68 2doc n GLY 4 Ca 0.00 0.00 -0.09 0.00 0.00 0.00 0.00 46.02 45.94 2doc n GLY 4 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2doc s SER 5 N 0.95 -0.14 -0.57 1.61 1.04 -1.26 -5.09 113.70 110.23 2doc s SER 5 Ca 0.00 -0.82 -0.26 0.00 0.48 0.00 0.00 55.95 55.35 2doc s SER 5 Cb 0.00 0.62 -0.05 0.00 0.10 0.00 0.00 66.02 66.69 2doc s SER 5 CO 0.00 -1.18 2.13 -0.55 0.98 0.00 0.00 173.24 174.62 2doc s SER 6 N -2.98 4.85 0.00 7.02 0.15 -1.26 -4.92 113.70 116.56 2doc s SER 6 Ca 0.19 0.64 0.00 0.00 0.70 0.00 0.00 55.95 57.48 2doc s SER 6 Cb -0.02 -2.52 0.00 0.00 -1.71 0.00 0.00 66.02 61.77 2doc s SER 6 CO 0.08 -2.66 0.00 0.61 1.20 0.00 0.00 173.24 172.47 2doc n GLY 7 N 5.90 4.70 3.87 9.45 0.00 -1.26 -5.10 105.19 122.75 2doc n GLY 7 Ca 0.29 -2.02 -0.30 0.00 0.00 0.00 0.00 46.02 43.99 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 2.11 2.30 -1.55 1.61 -1.52 -1.26 -3.83 119.66 117.51 2doc s GLN 8 Ca 0.00 0.34 0.00 0.00 -1.95 0.00 0.00 55.36 53.75 2doc s GLN 8 Cb 0.00 -1.97 0.00 0.00 -0.22 0.00 0.00 33.01 30.82 2doc s GLN 8 CO 0.00 -1.41 0.00 -1.91 -0.25 0.00 0.00 175.29 171.72 2doc n GLU 9 N -3.24 -1.74 0.09 2.91 2.13 -1.26 -4.85 120.64 114.68 2doc n GLU 9 Ca 0.07 0.87 -0.23 0.00 0.66 0.00 0.00 57.16 58.54 2doc n GLU 9 Cb 0.59 -5.39 -0.15 0.00 0.27 0.00 0.00 31.44 26.75 2doc n GLU 9 CO 0.00 0.00 0.00 0.10 -0.41 0.00 0.00 177.13 176.82 2doc h TYR 10 N 0.00 0.75 0.00 4.31 -0.00 -2.00 -3.41 116.97 116.63 2doc h TYR 10 Ca -0.38 -0.55 0.00 0.00 -0.00 0.00 0.00 58.73 57.80 2doc h TYR 10 Cb 1.22 -0.03 0.00 0.00 -0.00 0.00 0.00 36.73 37.92 2doc h TYR 10 CO 0.57 1.53 -0.45 -0.89 -0.00 0.00 0.00 178.16 178.92 2doc n ILE 11 N -3.82 0.00 0.32 -0.90 2.08 -1.26 -4.67 119.36 111.11 2doc n ILE 11 Ca -0.19 0.00 0.12 0.00 0.56 0.00 0.00 62.75 63.24 2doc n ILE 11 Cb 1.00 -0.23 0.65 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 0.06 1.39 3.38 -1.95 0.55 115.31 118.74 2doc h LEU 12 Ca 0.00 0.00 -0.32 0.00 0.09 0.00 0.00 57.88 57.65 2doc h LEU 12 Cb 0.45 0.00 -0.03 0.00 0.09 0.00 0.00 40.66 41.16 2doc h LEU 12 CO 0.00 0.00 -1.78 0.00 0.09 0.00 0.00 178.44 176.75 2doc h ALA 13 N 1.10 0.59 -0.56 1.53 0.00 -1.85 -3.34 119.26 116.73 2doc h ALA 13 Ca 0.00 -1.39 0.00 0.00 0.00 0.00 0.00 54.91 53.52 2doc h ALA 13 Cb 0.89 0.53 0.00 0.00 0.00 0.00 0.00 17.79 19.21 2doc h ALA 13 CO 0.00 1.43 0.00 1.28 0.00 0.00 0.00 179.25 181.96 2doc n LEU 14 N -3.26 3.68 -4.91 0.00 4.77 0.16 -4.93 117.00 112.52 2doc n LEU 14 Ca -0.22 -1.85 -0.29 0.00 -0.03 0.00 0.00 56.01 53.62 2doc n LEU 14 Cb 1.05 -0.48 -0.03 0.00 -2.33 0.00 0.00 43.42 41.63 2doc n LEU 14 CO 0.45 0.72 0.18 0.00 -1.33 0.00 0.00 177.39 177.41 2doc s ALA 15 N -1.58 3.65 -0.21 -1.18 0.00 0.47 -4.47 121.76 118.44 2doc s ALA 15 Ca 0.41 -0.58 -0.17 0.00 0.00 0.00 0.00 51.96 51.62 2doc s ALA 15 Cb 0.25 -2.26 0.06 0.00 0.00 0.00 0.00 23.12 21.17 2doc s ALA 15 CO 0.23 0.29 0.55 -0.51 0.00 0.00 0.00 175.76 176.32 2doc s ASP 16 N -3.11 -0.64 0.57 0.00 1.11 -1.26 -4.81 116.67 108.53 2doc s ASP 16 Ca 0.43 1.15 -0.18 0.00 0.18 0.00 0.00 52.55 54.13 2doc s ASP 16 Cb -0.11 1.11 -0.11 0.00 1.07 0.00 0.00 42.92 44.88 2doc s ASP 16 CO 0.29 -0.20 0.17 1.33 1.18 0.00 0.00 175.17 177.94 2doc n VAL 17 N 3.39 1.10 -2.26 -1.27 0.24 -1.26 -3.98 118.33 114.28 2doc n VAL 17 Ca -0.17 -0.49 -0.36 0.00 -2.04 0.00 0.00 64.34 61.29 2doc n VAL 17 Cb 0.56 -0.35 -0.00 0.00 -1.47 0.00 0.00 33.84 32.58 2doc n VAL 17 CO 0.00 0.00 0.00 -2.16 -2.14 0.00 0.00 176.83 172.53 2doc s PRO 18 N -1.66 3.47 0.85 7.34 0.04 -1.12 -4.70 135.00 139.21 2doc s PRO 18 Ca 0.62 1.66 -0.12 0.00 0.04 0.00 0.00 61.00 63.20 2doc s PRO 18 Cb -0.45 -2.12 0.10 0.00 0.04 0.00 0.00 34.50 32.07 2doc s PRO 18 CO 0.61 -0.76 1.13 0.45 0.04 0.00 0.00 177.00 178.47 2doc s SER 19 N -1.65 4.10 0.30 6.66 0.15 -1.19 -4.01 113.70 118.05 2doc s SER 19 Ca 0.70 1.06 -0.29 0.00 0.70 0.00 0.00 55.95 58.12 2doc s SER 19 Cb -0.25 -1.69 -0.10 0.00 -1.71 0.00 0.00 66.02 62.27 2doc s SER 19 CO 0.29 -2.19 1.27 -0.94 1.20 0.00 0.00 173.24 172.87 2doc s SER 20 N -4.09 6.89 1.22 5.45 1.04 -1.26 -4.66 113.70 118.29 2doc s SER 20 Ca 0.62 2.56 -0.18 0.00 0.48 0.00 0.00 55.95 59.44 2doc s SER 20 Cb -0.14 -2.64 0.26 0.00 0.10 0.00 0.00 66.02 63.61 2doc s SER 20 CO 0.53 -0.45 0.94 -0.81 0.98 0.00 0.00 173.24 174.43 2doc n PRO 21 N 1.15 -2.85 -3.96 4.02 -0.04 -1.26 -4.80 135.00 127.26 2doc n PRO 21 Ca 0.01 -1.50 -0.10 0.00 -0.04 0.00 0.00 63.50 61.86 2doc n PRO 21 Cb 0.42 -1.41 -0.03 0.00 -0.04 0.00 0.00 33.50 32.45 2doc n PRO 21 CO 0.00 0.00 0.00 1.52 -0.04 0.00 0.00 175.50 176.98 2doc s TYR 22 N -2.70 0.42 -0.18 0.54 1.13 -1.17 -4.77 117.35 110.62 2doc s TYR 22 Ca 0.61 -0.83 0.00 0.00 -1.41 0.00 0.00 57.07 55.44 2doc s TYR 22 Cb -0.06 0.33 0.00 0.00 -1.10 0.00 0.00 41.96 41.13 2doc s TYR 22 CO 0.47 -1.19 0.00 0.41 -2.51 0.00 0.00 175.55 172.73 2doc n GLY 23 N -0.47 0.52 3.61 5.49 0.00 -1.26 -0.01 105.19 113.07 2doc n GLY 23 Ca -0.03 -0.36 -0.43 0.00 0.00 0.00 0.00 46.02 45.21 2doc n GLY 23 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2doc s VAL 24 N -1.94 3.18 -0.09 1.61 1.01 -1.26 -4.26 120.40 118.65 2doc s VAL 24 Ca 0.00 0.19 -0.12 0.00 0.00 0.00 0.00 61.98 62.05 2doc s VAL 24 Cb 0.00 -3.22 0.03 0.00 0.00 0.00 0.00 36.38 33.19 2doc s VAL 24 CO 0.00 -0.12 0.32 -1.59 0.00 0.00 0.00 175.10 173.71 2doc s LYS 25 N 5.78 0.48 -0.71 2.72 0.00 -0.50 -4.97 119.74 122.54 2doc s LYS 25 Ca 0.92 0.24 -0.25 0.00 0.00 0.00 0.00 55.97 56.87 2doc s LYS 25 Cb -0.31 0.22 0.05 0.00 0.00 0.00 0.00 37.83 37.79 2doc s LYS 25 CO 0.35 -0.09 1.14 0.42 0.00 0.00 0.00 175.35 177.17 2doc s ILE 26 N -0.33 4.00 0.15 3.79 -1.09 -1.26 -0.82 121.20 125.64 2doc s ILE 26 Ca -0.05 0.03 -0.09 0.00 -2.23 0.00 0.00 60.65 58.32 2doc s ILE 26 Cb -0.03 -4.82 -0.06 0.00 -1.58 0.00 0.00 42.46 35.97 2doc s ILE 26 CO 0.02 -1.68 1.47 0.16 -1.23 0.00 0.00 174.94 173.67 2doc h ILE 27 N 6.02 1.28 -3.29 2.92 3.07 -1.83 -3.40 117.51 122.28 2doc h ILE 27 Ca -0.27 -1.67 -0.61 0.00 1.55 0.00 0.00 64.86 63.85 2doc h ILE 27 Cb 1.06 1.57 -0.40 0.00 -0.27 0.00 0.00 36.82 38.77 2doc h ILE 27 CO 1.24 0.54 -0.74 -1.61 -1.05 0.00 0.00 178.15 176.54 2doc s GLU 28 N -4.20 1.10 -0.20 0.16 2.02 -1.24 -5.04 118.70 111.31 2doc s GLU 28 Ca -0.10 -1.56 -0.09 0.00 0.02 0.00 0.00 54.97 53.25 2doc s GLU 28 Cb 0.11 -2.47 -0.05 0.00 0.10 0.00 0.00 34.13 31.82 2doc s GLU 28 CO 0.87 -1.01 0.10 -1.17 0.02 0.00 0.00 175.26 174.07 2doc s LEU 29 N 1.08 4.01 0.00 1.80 2.96 -1.26 -0.52 118.68 126.75 2doc s LEU 29 Ca 0.12 0.14 0.00 0.00 -0.22 0.00 0.00 54.13 54.17 2doc s LEU 29 Cb -0.20 -2.03 0.00 0.00 0.50 0.00 0.00 46.19 44.46 2doc s LEU 29 CO -0.14 0.16 0.01 -1.20 -1.32 0.00 0.00 176.35 173.86 2doc n SER 30 N 3.63 3.22 0.15 3.68 7.64 0.30 -4.86 113.62 127.37 2doc n SER 30 Ca -0.16 -2.94 0.12 0.00 1.01 0.00 0.00 58.87 56.90 2doc n SER 30 Cb 0.52 0.30 0.26 0.00 -1.01 0.00 0.00 64.21 64.28 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 -2.76 115.11 111.86 2doc h GLN 31 Ca -0.37 0.00 0.00 0.00 -0.00 0.00 0.00 58.65 58.28 2doc h GLN 31 Cb 1.12 0.00 0.00 0.00 -0.00 0.00 0.00 27.48 28.60 2doc h GLN 31 CO 0.61 0.00 -0.64 0.25 -0.00 0.00 0.00 178.83 179.05 2doc n THR 32 N -2.64 0.00 -3.93 1.86 -2.24 -1.26 -2.46 114.28 103.62 2doc n THR 32 Ca 0.04 0.00 -0.22 0.00 -2.27 0.00 0.00 64.05 61.61 2doc n THR 32 Cb 0.48 -0.46 -0.04 0.00 -2.10 0.00 0.00 70.33 68.21 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 -1.64 3.50 -0.24 4.28 -4.23 -1.26 -2.52 115.64 113.53 2doc s THR 33 Ca 0.00 -1.47 -0.05 0.00 -1.18 0.00 0.00 61.69 58.99 2doc s THR 33 Cb 0.00 -3.15 0.12 0.00 1.34 0.00 0.00 72.50 70.81 2doc s THR 33 CO 0.00 -0.20 0.47 0.00 -0.54 0.00 0.00 174.62 174.35 2doc s ALA 34 N -2.32 -1.43 -0.29 3.99 0.00 -0.71 -0.54 121.76 120.46 2doc s ALA 34 Ca 0.39 1.52 -0.17 0.00 0.00 0.00 0.00 51.96 53.70 2doc s ALA 34 Cb -0.05 -1.60 -0.02 0.00 0.00 0.00 0.00 23.12 21.44 2doc s ALA 34 CO 0.25 -1.00 0.46 0.21 0.00 0.00 0.00 175.76 175.68 2doc s LYS 35 N 2.67 3.89 -0.22 0.00 2.20 0.32 -0.44 119.74 128.16 2doc s LYS 35 Ca 0.05 0.04 -0.06 0.00 -0.36 0.00 0.00 55.97 55.64 2doc s LYS 35 Cb -0.13 -3.71 -0.03 0.00 -1.51 0.00 0.00 37.83 32.45 2doc s LYS 35 CO -0.16 -0.42 0.04 0.54 -0.36 0.00 0.00 175.35 174.99 2doc s VAL 36 N 2.24 4.21 -0.18 4.02 0.11 -0.10 -2.41 120.40 128.29 2doc s VAL 36 Ca 0.18 -0.22 -0.01 0.00 -2.93 0.00 0.00 61.98 59.00 2doc s VAL 36 Cb -0.16 -2.93 0.00 0.00 -1.53 0.00 0.00 36.38 31.77 2doc s VAL 36 CO 0.11 0.39 -0.14 -0.55 -3.33 0.00 0.00 175.10 171.58 2doc s SER 37 N 1.22 3.63 0.46 3.54 0.15 -0.00 -2.22 113.70 120.48 2doc s SER 37 Ca 0.04 -0.51 0.03 0.00 0.70 0.00 0.00 55.95 56.20 2doc s SER 37 Cb -0.14 -1.58 -0.01 0.00 -1.71 0.00 0.00 66.02 62.57 2doc s SER 37 CO 0.02 0.03 0.09 0.72 1.20 0.00 0.00 173.24 175.31 2doc s PHE 38 N 1.16 1.78 -0.15 3.44 -0.71 -0.56 -1.41 117.98 121.53 2doc s PHE 38 Ca 0.01 -1.22 0.01 0.00 -1.04 0.00 0.00 56.93 54.70 2doc s PHE 38 Cb -0.14 -1.30 0.00 0.00 -1.21 0.00 0.00 43.02 40.37 2doc s PHE 38 CO -0.06 -0.16 -0.18 -0.80 -1.34 0.00 0.00 175.22 172.69 2doc s ASN 39 N -3.72 3.46 0.55 1.98 0.01 0.99 -4.77 114.94 113.44 2doc s ASN 39 Ca 0.15 -0.52 -0.18 0.00 -0.71 0.00 0.00 52.86 51.60 2doc s ASN 39 Cb 0.01 -1.52 -0.11 0.00 0.41 0.00 0.00 41.25 40.04 2doc s ASN 39 CO 0.10 0.08 0.26 2.29 -1.51 0.00 0.00 177.10 178.32 2doc n LYS 40 N 4.09 0.30 -2.14 -0.60 -0.00 -1.26 -3.03 118.16 115.52 2doc n LYS 40 Ca -0.19 0.12 -0.43 0.00 -0.00 0.00 0.00 58.31 57.81 2doc n LYS 40 Cb 0.52 -1.42 -0.03 0.00 -0.00 0.00 0.00 35.03 34.10 2doc n LYS 40 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.40 176.15 2doc s PRO 41 N -1.67 4.08 0.62 -1.58 0.04 -1.26 -4.76 135.00 130.48 2doc s PRO 41 Ca 0.64 1.91 0.24 0.00 0.04 0.00 0.00 61.00 63.83 2doc s PRO 41 Cb -0.46 -3.95 1.17 0.00 0.04 0.00 0.00 34.50 31.30 2doc s PRO 41 CO 0.59 -0.94 1.63 0.38 0.04 0.00 0.00 177.00 178.70 2doc h ASP 42 N 9.55 0.00 -3.84 6.66 3.04 -1.91 -3.37 116.42 126.54 2doc h ASP 42 Ca -0.34 0.00 -0.68 0.00 -3.24 0.00 0.00 57.03 52.76 2doc h ASP 42 Cb 1.15 0.00 -0.28 0.00 -1.04 0.00 0.00 39.33 39.16 2doc h ASP 42 CO 0.97 0.00 -0.82 -0.44 -2.04 0.00 0.00 179.24 176.91 2doc s SER 43 N -4.27 3.56 0.00 4.15 0.01 -1.26 -4.99 113.70 110.89 2doc s SER 43 Ca -0.03 -0.38 0.00 0.00 1.31 0.00 0.00 55.95 56.85 2doc s SER 43 Cb 0.11 -1.04 0.00 0.00 0.21 0.00 0.00 66.02 65.31 2doc s SER 43 CO 0.39 0.25 0.00 0.00 0.41 0.00 0.00 173.24 174.29 2doc n HIS 44 N 2.92 0.00 0.00 2.43 1.44 -1.26 -3.19 115.22 117.56 2doc n HIS 44 Ca -0.18 0.00 0.00 0.00 -2.01 0.00 0.00 57.72 55.53 2doc n HIS 44 Cb 0.52 0.00 0.00 0.00 0.12 0.00 0.00 29.99 30.63 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 3.19 0.53 0.07 -1.39 0.00 -1.26 -2.79 105.19 103.53 2doc n GLY 45 Ca 0.00 -1.66 0.02 0.00 0.00 0.00 0.00 46.02 44.38 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 -1.10 3.62 -0.02 0.00 -1.26 -4.84 105.19 101.59 2doc n GLY 46 Ca 0.00 -0.33 -0.31 0.00 0.00 0.00 0.00 46.02 45.38 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 -3.06 3.71 0.57 1.61 -7.23 -1.26 -4.97 120.40 109.76 2doc s VAL 47 Ca -0.06 -0.93 -0.18 0.00 -1.81 0.00 0.00 61.98 58.99 2doc s VAL 47 Cb 0.10 -2.69 -0.04 0.00 0.56 0.00 0.00 36.38 34.31 2doc s VAL 47 CO 0.85 0.26 1.13 -2.16 -0.31 0.00 0.00 175.10 174.86 2doc s PRO 48 N -1.84 3.21 0.14 4.82 0.04 -1.26 -4.90 135.00 135.21 2doc s PRO 48 Ca 0.20 1.56 -0.30 0.00 0.04 0.00 0.00 61.00 62.50 2doc s PRO 48 Cb -0.11 -1.99 -0.07 0.00 0.04 0.00 0.00 34.50 32.37 2doc s PRO 48 CO 0.12 -0.95 1.12 0.42 0.04 0.00 0.00 177.00 177.75 2doc s ILE 49 N -1.91 3.97 -0.18 0.56 1.01 -1.26 -4.24 121.20 119.15 2doc s ILE 49 Ca 0.71 1.60 -0.16 0.00 0.00 0.00 0.00 60.65 62.80 2doc s ILE 49 Cb -0.23 -4.02 -0.12 0.00 0.01 0.00 0.00 42.46 38.09 2doc s ILE 49 CO 0.31 0.23 0.03 1.57 0.00 0.00 0.00 174.94 177.08 2doc n HIS 50 N 2.84 0.95 -3.73 3.97 -0.00 -0.92 -5.00 115.22 113.33 2doc n HIS 50 Ca 0.04 0.41 -0.05 0.00 -0.00 0.00 0.00 57.72 58.12 2doc n HIS 50 Cb 0.46 -0.96 0.02 0.00 -0.00 0.00 0.00 29.99 29.52 2doc n HIS 50 CO 0.00 0.00 0.00 -2.39 -0.00 0.00 0.00 176.34 173.95 2doc n HIS 51 N -4.50 -1.75 -4.98 1.57 1.44 -1.08 -4.42 115.22 101.49 2doc n HIS 51 Ca -0.22 -1.34 -0.31 0.00 -2.01 0.00 0.00 57.72 53.83 2doc n HIS 51 Cb 0.52 0.67 -0.14 0.00 0.12 0.00 0.00 29.99 31.15 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 -3.05 2.46 -0.26 -1.40 1.51 -1.26 -1.95 117.35 113.40 2doc s TYR 52 Ca 0.16 -0.33 -0.05 0.00 -1.01 0.00 0.00 57.07 55.83 2doc s TYR 52 Cb -0.03 -1.50 -0.00 0.00 -0.11 0.00 0.00 41.96 40.32 2doc s TYR 52 CO 0.08 0.11 0.03 -1.14 -1.11 0.00 0.00 175.55 173.52 2doc s GLN 53 N -0.96 3.24 -0.09 -0.62 0.74 -0.34 -4.05 119.66 117.57 2doc s GLN 53 Ca 0.12 -0.74 0.02 0.00 0.05 0.00 0.00 55.36 54.81 2doc s GLN 53 Cb -0.10 -3.22 -0.02 0.00 1.10 0.00 0.00 33.01 30.77 2doc s GLN 53 CO 0.01 -0.33 -0.16 0.08 -0.55 0.00 0.00 175.29 174.34 2doc s VAL 54 N 1.49 2.80 -0.12 1.34 1.01 -1.16 -2.06 120.40 123.72 2doc s VAL 54 Ca 0.04 -0.78 0.02 0.00 0.00 0.00 0.00 61.98 61.26 2doc s VAL 54 Cb -0.16 -2.13 0.02 0.00 0.00 0.00 0.00 36.38 34.11 2doc s VAL 54 CO 0.00 0.55 -0.15 -0.62 0.00 0.00 0.00 175.10 174.88 2doc s ASP 55 N -0.02 2.51 0.09 3.32 -1.08 -1.11 -0.61 116.67 119.77 2doc s ASP 55 Ca -0.05 -0.44 0.09 0.00 -0.52 0.00 0.00 52.55 51.63 2doc s ASP 55 Cb -0.14 -1.12 -0.03 0.00 -1.46 0.00 0.00 42.92 40.16 2doc s ASP 55 CO 0.04 0.01 -0.23 0.54 0.52 0.00 0.00 175.17 176.05 2doc s VAL 56 N 1.05 1.88 0.11 1.11 0.11 -0.29 -2.59 120.40 121.78 2doc s VAL 56 Ca -0.05 -1.51 -0.26 0.00 -2.93 0.00 0.00 61.98 57.23 2doc s VAL 56 Cb -0.15 -1.67 0.08 0.00 -1.53 0.00 0.00 36.38 33.11 2doc s VAL 56 CO -0.03 0.08 1.04 -1.59 -3.33 0.00 0.00 175.10 171.28 2doc s LYS 57 N -1.72 0.98 0.19 1.54 -2.85 -1.12 -1.58 119.74 115.18 2doc s LYS 57 Ca 0.09 -0.54 -0.30 0.00 -1.00 0.00 0.00 55.97 54.22 2doc s LYS 57 Cb -0.10 0.34 -0.08 0.00 -2.06 0.00 0.00 37.83 35.93 2doc s LYS 57 CO 0.04 -0.45 0.95 -1.21 0.10 0.00 0.00 175.35 174.78 2doc s GLU 58 N -3.06 4.79 0.12 1.78 2.02 -1.26 -0.54 118.70 122.54 2doc s GLU 58 Ca 0.13 1.48 0.07 0.00 0.02 0.00 0.00 54.97 56.67 2doc s GLU 58 Cb 0.00 -3.32 0.38 0.00 0.10 0.00 0.00 34.13 31.30 2doc s GLU 58 CO 0.01 0.39 1.17 1.55 0.02 0.00 0.00 175.26 178.39 2doc n VAL 59 N 2.00 1.45 -0.03 2.63 3.14 -1.22 -0.66 118.33 125.64 2doc n VAL 59 Ca -0.00 0.59 0.01 0.00 -2.96 0.00 0.00 64.34 61.98 2doc n VAL 59 Cb 0.48 -1.59 -0.10 0.00 -1.06 0.00 0.00 33.84 31.57 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 2.14 -1.95 1.55 0.00 -1.26 -4.99 120.51 114.46 2doc n ALA 60 Ca -0.00 -0.53 -0.36 0.00 0.00 0.00 0.00 53.44 52.55 2doc n ALA 60 Cb 0.08 -0.25 -0.06 0.00 0.00 0.00 0.00 19.45 19.21 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 -3.94 7.15 -0.26 0.00 0.15 0.16 -4.97 113.70 111.98 2doc s SER 61 Ca -0.05 1.61 0.13 0.00 0.70 0.00 0.00 55.95 58.33 2doc s SER 61 Cb 0.06 -2.49 0.74 0.00 -1.71 0.00 0.00 66.02 62.62 2doc s SER 61 CO 0.52 -0.06 1.71 -0.62 1.20 0.00 0.00 173.24 175.99 2doc n GLU 62 N 0.46 4.04 -3.99 5.44 4.71 -1.26 -4.54 120.64 125.51 2doc n GLU 62 Ca 0.01 -3.09 -0.34 0.00 -0.01 0.00 0.00 57.16 53.73 2doc n GLU 62 Cb 0.51 -2.16 -0.14 0.00 -1.01 0.00 0.00 31.44 28.63 2doc n GLU 62 CO 0.00 0.00 0.00 0.42 0.09 0.00 0.00 177.13 177.64 2doc s ILE 63 N -2.89 2.67 -0.02 -3.67 1.01 -1.26 -5.10 121.20 111.94 2doc s ILE 63 Ca 0.52 -1.26 -0.20 0.00 0.00 0.00 0.00 60.65 59.71 2doc s ILE 63 Cb 0.41 -2.43 -0.05 0.00 0.01 0.00 0.00 42.46 40.40 2doc s ILE 63 CO 0.13 0.09 0.59 0.26 0.00 0.00 0.00 174.94 176.01 2doc s TRP 64 N 1.25 3.66 -0.24 3.97 0.52 -1.26 -4.64 118.94 122.20 2doc s TRP 64 Ca -0.03 1.17 -0.05 0.00 0.02 0.00 0.00 56.10 57.21 2doc s TRP 64 Cb -0.18 -2.61 -0.01 0.00 -1.15 0.00 0.00 33.47 29.52 2doc s TRP 64 CO -0.04 0.33 0.00 0.15 0.02 0.00 0.00 176.95 177.41 2doc s LYS 65 N -0.08 3.45 0.19 4.98 1.02 -0.61 -4.96 119.74 123.73 2doc s LYS 65 Ca 0.31 -0.59 -0.15 0.00 0.02 0.00 0.00 55.97 55.56 2doc s LYS 65 Cb -0.18 -3.14 -0.07 0.00 -0.52 0.00 0.00 37.83 33.91 2doc s LYS 65 CO 0.17 -0.21 0.61 0.42 -0.92 0.00 0.00 175.35 175.41 2doc s ILE 66 N 1.53 4.78 -0.04 2.17 -1.09 -1.26 -1.14 121.20 126.15 2doc s ILE 66 Ca 0.06 0.91 -0.03 0.00 -2.23 0.00 0.00 60.65 59.35 2doc s ILE 66 Cb -0.15 -3.74 0.02 0.00 -1.58 0.00 0.00 42.46 37.01 2doc s ILE 66 CO -0.01 0.17 0.11 -0.69 -1.23 0.00 0.00 174.94 173.29 2doc s VAL 67 N -1.56 -0.02 0.42 2.92 1.01 0.22 -4.99 120.40 118.40 2doc s VAL 67 Ca 0.41 0.08 -0.06 0.00 0.00 0.00 0.00 61.98 62.41 2doc s VAL 67 Cb -0.15 -0.17 -0.05 0.00 0.00 0.00 0.00 36.38 36.02 2doc s VAL 67 CO 0.20 0.03 0.72 -0.13 0.00 0.00 0.00 175.10 175.92 2doc s ARG 68 N 0.49 3.61 -0.33 2.72 3.00 -1.26 -2.97 118.95 124.22 2doc s ARG 68 Ca -0.04 0.19 0.05 0.00 0.00 0.00 0.00 55.73 55.93 2doc s ARG 68 Cb -0.05 -2.45 0.57 0.00 0.00 0.00 0.00 34.95 33.02 2doc s ARG 68 CO -0.02 -0.06 1.70 0.43 0.00 0.00 0.00 175.30 177.34 2doc n SER 69 N -1.76 3.88 -3.18 0.23 7.64 -1.26 -4.89 113.62 114.28 2doc n SER 69 Ca 0.00 -3.19 -0.21 0.00 1.01 0.00 0.00 58.87 56.49 2doc n SER 69 Cb 0.55 -0.75 -0.04 0.00 -1.01 0.00 0.00 64.21 62.96 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 -0.55 -1.16 -0.28 1.43 8.25 -1.26 -4.22 115.22 117.43 2doc n HIS 70 Ca 0.43 0.33 0.00 0.00 -0.26 0.00 0.00 57.72 58.22 2doc n HIS 70 Cb 1.37 -1.19 0.00 0.00 1.12 0.00 0.00 29.99 31.28 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 -0.73 0.45 1.71 -1.41 0.00 -1.26 -4.87 105.19 99.08 2doc n GLY 71 Ca 0.06 -1.45 -0.02 0.00 0.00 0.00 0.00 46.02 44.61 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 9.00 2.77 -2.15 1.61 0.24 -1.26 -4.36 118.33 124.18 2doc n VAL 72 Ca 0.00 -1.77 -0.33 0.00 -2.04 0.00 0.00 64.34 60.19 2doc n VAL 72 Cb 0.00 -0.33 0.00 0.00 -1.47 0.00 0.00 33.84 32.04 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 -2.97 3.39 0.00 7.34 -2.07 -1.26 -4.96 119.66 119.12 2doc s GLN 73 Ca 0.52 1.29 0.19 0.00 -1.82 0.00 0.00 55.36 55.53 2doc s GLN 73 Cb 0.42 -2.04 0.52 0.00 -1.09 0.00 0.00 33.01 30.82 2doc s GLN 73 CO 0.12 -0.77 1.43 0.25 -1.32 0.00 0.00 175.29 175.00 2doc n THR 74 N -1.77 0.94 -4.19 3.63 -2.24 -1.26 -4.79 114.28 104.60 2doc n THR 74 Ca 0.09 -0.97 -0.22 0.00 -2.27 0.00 0.00 64.05 60.68 2doc n THR 74 Cb 0.53 0.55 -0.17 0.00 -2.10 0.00 0.00 70.33 69.14 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 -1.04 1.10 0.04 -0.78 -2.45 -1.26 -1.50 119.30 113.41 2doc s MET 75 Ca 0.40 -0.17 0.00 0.00 -1.25 0.00 0.00 55.69 54.67 2doc s MET 75 Cb 0.21 -1.08 -0.03 0.00 1.25 0.00 0.00 34.83 35.18 2doc s MET 75 CO 0.28 -0.10 -0.04 0.08 1.05 0.00 0.00 175.02 176.28 2doc s VAL 76 N 1.07 0.26 -0.25 10.11 1.01 -0.94 -4.98 120.40 126.68 2doc s VAL 76 Ca -0.08 -1.19 -0.04 0.00 0.00 0.00 0.00 61.98 60.67 2doc s VAL 76 Cb -0.14 -0.68 0.01 0.00 0.00 0.00 0.00 36.38 35.57 2doc s VAL 76 CO -0.01 -0.60 -0.02 0.54 0.00 0.00 0.00 175.10 175.01 2doc s VAL 77 N -2.07 3.33 0.41 2.92 0.11 -1.26 -0.92 120.40 122.92 2doc s VAL 77 Ca -0.08 -0.72 -0.16 0.00 -2.93 0.00 0.00 61.98 58.09 2doc s VAL 77 Cb -0.05 -2.62 -0.09 0.00 -1.53 0.00 0.00 36.38 32.09 2doc s VAL 77 CO -0.03 0.27 0.86 -0.76 -3.33 0.00 0.00 175.10 172.11 2doc s LEU 78 N 1.43 3.89 0.33 2.54 1.43 0.41 -4.86 118.68 123.85 2doc s LEU 78 Ca 0.03 1.43 0.07 0.00 -1.03 0.00 0.00 54.13 54.63 2doc s LEU 78 Cb -0.16 -4.29 -0.03 0.00 0.03 0.00 0.00 46.19 41.74 2doc s LEU 78 CO -0.02 -0.37 0.26 0.54 0.23 0.00 0.00 176.35 176.99 2doc s ASN 79 N -2.59 1.70 -1.12 2.29 2.20 -1.26 -1.74 114.94 114.42 2doc s ASN 79 Ca 0.57 -1.74 -0.04 0.00 -0.94 0.00 0.00 52.86 50.71 2doc s ASN 79 Cb -0.10 0.55 0.00 0.00 -2.00 0.00 0.00 41.25 39.71 2doc s ASN 79 CO 0.22 -1.05 0.95 0.59 -2.94 0.00 0.00 177.10 174.87 2doc n ASN 80 N -1.49 -3.82 -4.40 3.54 4.13 -1.26 -4.97 115.26 107.00 2doc n ASN 80 Ca 0.06 -0.51 -0.30 0.00 1.68 0.00 0.00 54.58 55.52 2doc n ASN 80 Cb 0.63 -4.52 -0.13 0.00 -1.54 0.00 0.00 39.78 34.21 2doc n ASN 80 CO 0.00 0.00 0.00 -0.76 0.28 0.00 0.00 177.26 176.78 2doc s LEU 81 N -6.16 2.36 0.16 3.41 1.43 -1.05 -5.10 118.68 113.74 2doc s LEU 81 Ca 0.24 -0.60 -0.20 0.00 -1.03 0.00 0.00 54.13 52.54 2doc s LEU 81 Cb -0.11 -1.34 -0.08 0.00 0.03 0.00 0.00 46.19 44.70 2doc s LEU 81 CO 0.64 0.23 0.67 -1.61 0.23 0.00 0.00 176.35 176.50 2doc s GLU 82 N -1.61 4.25 0.79 1.70 2.02 -1.26 -4.31 118.70 120.29 2doc s GLU 82 Ca 0.14 0.83 -0.11 0.00 0.02 0.00 0.00 54.97 55.85 2doc s GLU 82 Cb -0.10 -3.04 0.07 0.00 0.10 0.00 0.00 34.13 31.15 2doc s GLU 82 CO 0.05 0.50 1.09 -1.25 0.02 0.00 0.00 175.26 175.67 2doc s PRO 83 N -1.61 2.08 -1.41 0.39 0.04 -1.03 -3.57 135.00 129.89 2doc s PRO 83 Ca 0.37 1.12 -0.11 0.00 0.04 0.00 0.00 61.00 62.42 2doc s PRO 83 Cb -0.18 -1.88 0.08 0.00 0.04 0.00 0.00 34.50 32.56 2doc s PRO 83 CO 0.21 -1.75 0.64 -1.71 0.04 0.00 0.00 177.00 174.42 2doc n ASN 84 N -3.59 -4.04 -4.18 6.66 2.85 -1.21 -4.92 115.26 106.84 2doc n ASN 84 Ca 0.09 -0.55 -0.16 0.00 -0.11 0.00 0.00 54.58 53.85 2doc n ASN 84 Cb 0.53 -3.30 -0.11 0.00 1.24 0.00 0.00 39.78 38.14 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 -3.07 1.03 0.02 -0.44 2.01 -1.23 -4.96 115.64 109.00 2doc s THR 85 Ca 0.50 -1.50 0.01 0.00 0.31 0.00 0.00 61.69 61.01 2doc s THR 85 Cb -0.26 -1.23 -0.04 0.00 0.01 0.00 0.00 72.50 70.98 2doc s THR 85 CO 0.61 -0.41 0.05 -0.89 -0.69 0.00 0.00 174.62 173.28 2doc s THR 86 N -1.93 4.43 -0.03 -0.82 2.01 -1.26 -0.81 115.64 117.23 2doc s THR 86 Ca 0.02 -0.60 -0.05 0.00 0.31 0.00 0.00 61.69 61.37 2doc s THR 86 Cb -0.06 -3.04 0.01 0.00 0.01 0.00 0.00 72.50 69.42 2doc s THR 86 CO 0.01 0.29 0.13 -0.31 -0.69 0.00 0.00 174.62 174.06 2doc s TYR 87 N -1.21 -0.08 -0.26 4.92 1.51 -0.26 -3.46 117.35 118.51 2doc s TYR 87 Ca 0.23 0.19 -0.12 0.00 -1.01 0.00 0.00 57.07 56.37 2doc s TYR 87 Cb -0.12 0.01 -0.05 0.00 -0.11 0.00 0.00 41.96 41.70 2doc s TYR 87 CO 0.15 -0.14 0.23 -1.21 -1.11 0.00 0.00 175.55 173.47 2doc s GLU 88 N -0.39 4.01 0.00 -0.62 2.02 0.30 -1.52 118.70 122.49 2doc s GLU 88 Ca -0.05 -0.20 0.08 0.00 0.02 0.00 0.00 54.97 54.82 2doc s GLU 88 Cb -0.03 -3.62 -0.02 0.00 0.10 0.00 0.00 34.13 30.55 2doc s GLU 88 CO 0.00 -0.12 -0.24 -1.50 0.02 0.00 0.00 175.26 173.42 2doc s ILE 89 N 1.60 2.25 -0.02 -1.63 2.07 0.14 -2.80 121.20 122.81 2doc s ILE 89 Ca 0.09 -1.17 0.01 0.00 -1.41 0.00 0.00 60.65 58.18 2doc s ILE 89 Cb -0.15 -1.84 0.01 0.00 0.13 0.00 0.00 42.46 40.61 2doc s ILE 89 CO 0.09 0.49 -0.04 0.00 -1.91 0.00 0.00 174.94 173.57 2doc s ARG 90 N -0.90 0.52 -0.17 3.50 1.04 -1.07 -0.08 118.95 121.80 2doc s ARG 90 Ca 0.11 -0.12 -0.04 0.00 -1.04 0.00 0.00 55.73 54.63 2doc s ARG 90 Cb -0.10 -0.55 -0.03 0.00 -2.04 0.00 0.00 34.95 32.23 2doc s ARG 90 CO 0.01 0.02 -0.02 0.08 -0.04 0.00 0.00 175.30 175.35 2doc s VAL 91 N 0.35 4.01 0.05 4.99 1.01 -1.26 -2.75 120.40 126.80 2doc s VAL 91 Ca -0.04 -0.31 0.04 0.00 0.00 0.00 0.00 61.98 61.67 2doc s VAL 91 Cb -0.08 -2.77 -0.02 0.00 0.00 0.00 0.00 36.38 33.51 2doc s VAL 91 CO -0.00 0.48 -0.12 0.00 0.00 0.00 0.00 175.10 175.45 2doc s ALA 92 N 0.46 1.01 -0.23 5.51 0.00 -0.87 -2.91 121.76 124.74 2doc s ALA 92 Ca -0.02 -0.87 -0.13 0.00 0.00 0.00 0.00 51.96 50.93 2doc s ALA 92 Cb -0.14 -0.09 -0.04 0.00 0.00 0.00 0.00 23.12 22.85 2doc s ALA 92 CO 0.02 0.14 0.28 0.00 0.00 0.00 0.00 175.76 176.20 2doc s ALA 93 N -1.13 3.58 -0.04 0.00 0.00 -1.26 -1.19 121.76 121.72 2doc s ALA 93 Ca -0.03 -0.74 0.07 0.00 0.00 0.00 0.00 51.96 51.27 2doc s ALA 93 Cb -0.09 -2.49 -0.02 0.00 0.00 0.00 0.00 23.12 20.52 2doc s ALA 93 CO 0.01 -0.29 -0.25 0.08 0.00 0.00 0.00 175.76 175.31 2doc s VAL 94 N 1.28 2.04 0.21 0.00 1.01 -0.82 -1.54 120.40 122.58 2doc s VAL 94 Ca 0.13 -1.08 0.03 0.00 0.00 0.00 0.00 61.98 61.06 2doc s VAL 94 Cb -0.14 -1.71 -0.01 0.00 0.00 0.00 0.00 36.38 34.51 2doc s VAL 94 CO 0.07 0.57 0.20 -0.46 0.00 0.00 0.00 175.10 175.48 2doc n ASN 95 N 2.70 -0.53 0.32 3.32 0.23 -0.22 -2.18 115.26 118.90 2doc n ASN 95 Ca -0.17 -2.32 0.14 0.00 -0.53 0.00 0.00 54.58 51.70 2doc n ASN 95 Cb 0.52 1.16 0.71 0.00 -2.08 0.00 0.00 39.78 40.08 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 1.26 0.00 0.00 4.83 0.00 -1.93 -2.10 103.07 105.13 2doc h GLY 96 Ca -0.15 0.00 -0.00 0.00 0.00 0.00 0.00 47.33 47.18 2doc h GLY 96 CO 0.22 0.00 -0.06 1.70 0.00 0.00 0.00 176.54 178.40 2doc h LYS 97 N 0.00 0.00 0.00 4.80 1.63 -1.94 -3.51 116.57 117.54 2doc h LYS 97 Ca 0.01 0.00 0.00 0.00 -0.85 0.00 0.00 60.65 59.81 2doc h LYS 97 Cb 0.88 0.00 0.00 0.00 -0.60 0.00 0.00 32.23 32.51 2doc h LYS 97 CO -0.00 0.03 0.00 0.41 -3.45 0.00 0.00 179.45 176.44 2doc n GLY 98 N 1.76 -0.88 3.06 5.01 0.00 -0.79 -5.03 105.19 108.31 2doc n GLY 98 Ca -0.01 -0.17 -0.32 0.00 0.00 0.00 0.00 46.02 45.52 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 -0.26 1.86 1.37 1.61 0.74 -1.26 -1.06 119.66 122.66 2doc s GLN 99 Ca 0.00 -1.65 -0.22 0.00 0.05 0.00 0.00 55.36 53.55 2doc s GLN 99 Cb 0.00 -3.14 0.34 0.00 1.10 0.00 0.00 33.01 31.31 2doc s GLN 99 CO 0.00 -0.80 0.76 0.41 -0.55 0.00 0.00 175.29 175.11 2doc n GLY 100 N 4.37 -3.57 3.34 2.59 0.00 -0.59 -4.95 105.19 106.38 2doc n GLY 100 Ca -0.04 -1.49 -0.30 0.00 0.00 0.00 0.00 46.02 44.19 2doc n GLY 100 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 2doc n ASP 101 N -4.71 -2.32 -4.64 1.61 9.92 -1.26 -4.67 116.55 110.48 2doc n ASP 101 Ca 0.12 -0.24 -0.34 0.00 -0.53 0.00 0.00 54.79 53.80 2doc n ASP 101 Cb 0.53 -1.08 -0.10 0.00 -0.64 0.00 0.00 41.12 39.83 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 -2.29 3.05 0.59 1.24 1.51 -1.26 -4.33 117.35 115.86 2doc s TYR 102 Ca 0.62 0.10 -0.17 0.00 -1.01 0.00 0.00 57.07 56.61 2doc s TYR 102 Cb -0.18 -1.74 -0.04 0.00 -0.11 0.00 0.00 41.96 39.90 2doc s TYR 102 CO 0.64 0.41 1.10 -1.54 -1.11 0.00 0.00 175.55 175.05 2doc s SER 103 N -0.94 5.58 -0.69 2.29 1.04 -1.14 -4.82 113.70 115.02 2doc s SER 103 Ca 0.14 2.02 -0.39 0.00 0.48 0.00 0.00 55.95 58.20 2doc s SER 103 Cb -0.11 -2.56 -0.20 0.00 0.10 0.00 0.00 66.02 63.25 2doc s SER 103 CO 0.03 -1.31 2.36 1.17 0.98 0.00 0.00 173.24 176.47 2doc n LYS 104 N -1.80 0.02 -1.24 4.02 3.00 -1.26 -4.67 118.16 116.23 2doc n LYS 104 Ca 0.10 0.00 -0.49 0.00 -0.00 0.00 0.00 58.31 57.93 2doc n LYS 104 Cb 0.52 -1.52 -0.07 0.00 0.00 0.00 0.00 35.03 33.96 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 6.90 0.00 -3.90 3.15 2.08 -1.26 -4.92 119.36 121.41 2doc n ILE 105 Ca 0.59 0.00 -0.31 0.00 0.56 0.00 0.00 62.75 63.59 2doc n ILE 105 Cb -0.01 -0.10 -0.04 0.00 -0.75 0.00 0.00 39.64 38.74 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 0.58 3.45 -0.17 0.38 0.41 0.88 -4.94 118.70 119.30 2doc s GLU 106 Ca 0.75 -0.41 -0.01 0.00 -0.41 0.00 0.00 54.97 54.88 2doc s GLU 106 Cb -1.05 -3.03 0.05 0.00 -1.78 0.00 0.00 34.13 28.32 2doc s GLU 106 CO 0.50 0.60 -0.02 0.42 -0.49 0.00 0.00 175.26 176.27 2doc s ILE 107 N -1.52 0.89 -0.02 -1.63 1.01 -1.26 0.27 121.20 118.93 2doc s ILE 107 Ca 0.35 -0.60 0.08 0.00 0.00 0.00 0.00 60.65 60.49 2doc s ILE 107 Cb -0.13 -1.18 -0.02 0.00 0.01 0.00 0.00 42.46 41.14 2doc s ILE 107 CO 0.28 0.00 -0.26 0.72 0.00 0.00 0.00 174.94 175.68 2doc s PHE 108 N 1.71 2.31 -0.24 3.97 -0.12 -0.58 -4.94 117.98 120.10 2doc s PHE 108 Ca -0.00 -0.44 -0.03 0.00 -0.05 0.00 0.00 56.93 56.41 2doc s PHE 108 Cb -0.16 -1.49 0.01 0.00 -0.63 0.00 0.00 43.02 40.76 2doc s PHE 108 CO -0.07 -0.04 -0.05 -1.14 -0.05 0.00 0.00 175.22 173.87 2doc s GLN 109 N -0.61 3.08 0.88 1.99 0.74 -1.26 -1.10 119.66 123.38 2doc s GLN 109 Ca 0.10 -0.82 -0.13 0.00 0.05 0.00 0.00 55.36 54.56 2doc s GLN 109 Cb -0.10 -3.01 0.06 0.00 1.10 0.00 0.00 33.01 31.06 2doc s GLN 109 CO -0.01 -0.32 0.73 0.25 -0.55 0.00 0.00 175.29 175.39 2doc n THR 110 N 4.74 0.67 -2.77 -0.34 -2.24 0.01 -4.88 114.28 109.46 2doc n THR 110 Ca -0.17 -0.19 -0.38 0.00 -2.27 0.00 0.00 64.05 61.05 2doc n THR 110 Cb 0.49 -0.83 -0.06 0.00 -2.10 0.00 0.00 70.33 67.83 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 -2.95 4.40 -0.14 3.22 1.43 -1.04 -3.29 118.68 120.32 2doc s LEU 111 Ca 0.63 1.86 -0.29 0.00 -1.03 0.00 0.00 54.13 55.30 2doc s LEU 111 Cb -0.25 -3.94 -0.04 0.00 0.03 0.00 0.00 46.19 41.99 2doc s LEU 111 CO 0.61 -0.02 1.56 -2.16 0.23 0.00 0.00 176.35 176.56 2doc s PRO 112 N -1.89 4.06 0.11 1.29 0.04 -1.26 -3.35 135.00 134.00 2doc s PRO 112 Ca 0.48 1.89 -0.22 0.00 0.04 0.00 0.00 61.00 63.20 2doc s PRO 112 Cb -0.20 -3.95 -0.12 0.00 0.04 0.00 0.00 34.50 30.26 2doc s PRO 112 CO 0.25 -0.97 0.46 0.28 0.04 0.00 0.00 177.00 177.06 2doc n VAL 113 N 5.77 1.06 -3.68 -0.36 0.31 -1.26 -4.92 118.33 115.26 2doc n VAL 113 Ca 0.17 -0.27 -0.29 0.00 -0.01 0.00 0.00 64.34 63.94 2doc n VAL 113 Cb 0.44 0.00 -0.12 0.00 -0.91 0.00 0.00 33.84 33.25 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 -0.53 3.44 0.05 4.52 0.15 -1.26 -5.10 113.70 114.97 2doc s SER 114 Ca 0.49 -2.82 0.07 0.00 0.70 0.00 0.00 55.95 54.39 2doc s SER 114 Cb -0.71 -0.99 -0.03 0.00 -1.71 0.00 0.00 66.02 62.59 2doc s SER 114 CO 0.39 -0.23 -0.19 -0.83 1.20 0.00 0.00 173.24 173.58 2doc s GLY 115 N 0.12 1.05 -0.98 9.45 0.00 -1.26 -5.07 107.32 110.62 2doc s GLY 115 Ca 0.21 -1.02 -0.24 0.00 0.00 0.00 0.00 44.72 43.67 2doc s GLY 115 CO -0.05 -0.97 1.95 2.56 0.00 0.00 0.00 173.10 176.59 2doc s PRO 116 N -1.27 2.53 0.28 2.90 0.04 -1.26 -4.96 135.00 133.27 2doc s PRO 116 Ca 0.06 -0.54 -0.17 0.00 0.04 0.00 0.00 61.00 60.38 2doc s PRO 116 Cb -0.09 -5.11 -0.09 0.00 0.04 0.00 0.00 34.50 29.25 2doc s PRO 116 CO 0.02 -3.56 0.74 0.45 0.04 0.00 0.00 177.00 174.69 2doc s SER 117 N 7.60 6.91 -1.05 6.66 0.15 -1.26 -4.99 113.70 127.72 2doc s SER 117 Ca 0.70 1.36 -0.22 0.00 0.70 0.00 0.00 55.95 58.49 2doc s SER 117 Cb -0.05 -2.40 0.04 0.00 -1.71 0.00 0.00 66.02 61.90 2doc s SER 117 CO 0.03 -0.11 1.54 -0.44 1.20 0.00 0.00 173.24 175.46 2doc s SER 118 N -2.00 6.42 0.00 5.45 0.01 -1.26 -5.32 113.70 117.00 2doc s SER 118 Ca 0.50 -1.53 0.00 0.00 1.31 0.00 0.00 55.95 56.23 2doc s SER 118 Cb -0.13 -2.57 0.00 0.00 0.21 0.00 0.00 66.02 63.53 2doc s SER 118 CO 0.19 -1.59 0.00 0.61 0.41 0.00 0.00 173.24 172.86