#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1j26 n SER 2 N 0.00 -5.64 -3.54 1.61 7.64 -1.26 -5.12 113.62 107.31 1j26 n SER 2 Ca 0.00 1.10 -0.02 0.00 1.01 0.00 0.00 58.87 60.95 1j26 n SER 2 Cb 0.00 -3.51 0.01 0.00 -1.01 0.00 0.00 64.21 59.70 1j26 n SER 2 CO 0.00 0.00 0.00 -0.94 -3.01 0.00 0.00 175.04 171.09 1j26 s SER 3 N -6.05 -0.06 0.00 6.43 1.04 -1.26 -5.20 113.70 108.60 1j26 s SER 3 Ca 0.00 -0.51 0.00 0.00 0.48 0.00 0.00 55.95 55.92 1j26 s SER 3 Cb 0.00 0.44 0.00 0.00 0.10 0.00 0.00 66.02 66.56 1j26 s SER 3 CO 0.00 -0.85 0.00 0.61 0.98 0.00 0.00 173.24 173.98 1j26 n GLY 4 N -0.62 1.71 3.53 7.32 0.00 -1.26 -5.20 105.19 110.68 1j26 n GLY 4 Ca -0.04 -0.61 -0.07 0.00 0.00 0.00 0.00 46.02 45.29 1j26 n GLY 4 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1j26 s SER 5 N 0.00 -0.31 0.29 1.61 1.04 -1.26 -5.18 113.70 109.89 1j26 s SER 5 Ca 0.00 -0.01 0.00 0.00 0.48 0.00 0.00 55.95 56.42 1j26 s SER 5 Cb 0.00 0.34 0.00 0.00 0.10 0.00 0.00 66.02 66.46 1j26 s SER 5 CO 0.00 -0.55 0.00 -1.20 0.98 0.00 0.00 173.24 172.47 1j26 n SER 6 N -0.22 -7.47 0.00 7.02 7.64 -1.26 -5.04 113.62 114.29 1j26 n SER 6 Ca -0.07 0.50 0.00 0.00 1.01 0.00 0.00 58.87 60.31 1j26 n SER 6 Cb 0.61 -3.88 0.00 0.00 -1.01 0.00 0.00 64.21 59.93 1j26 n SER 6 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1j26 n GLY 7 N -3.76 1.14 3.56 0.23 0.00 -1.26 -5.10 105.19 100.01 1j26 n GLY 7 Ca 0.01 -0.03 -0.39 0.00 0.00 0.00 0.00 46.02 45.61 1j26 n GLY 7 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1j26 s GLU 8 N 0.00 2.52 0.27 1.61 2.02 -1.26 -4.90 118.70 118.96 1j26 s GLU 8 Ca 0.00 1.35 0.03 0.00 0.02 0.00 0.00 54.97 56.37 1j26 s GLU 8 Cb 0.00 -4.47 -0.01 0.00 0.10 0.00 0.00 34.13 29.75 1j26 s GLU 8 CO 0.00 -2.81 0.29 0.72 0.02 0.00 0.00 175.26 173.48 1j26 n HIS 9 N 13.91 -0.89 -3.41 1.61 8.25 -1.26 -5.13 115.22 128.31 1j26 n HIS 9 Ca 0.31 -2.06 0.00 0.00 -0.26 0.00 0.00 57.72 55.70 1j26 n HIS 9 Cb 0.52 0.32 0.00 0.00 1.12 0.00 0.00 29.99 31.94 1j26 n HIS 9 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 1j26 n ALA 10 N -1.19 0.00 -3.73 -1.41 0.00 -1.26 -5.01 120.51 107.90 1j26 n ALA 10 Ca -0.10 0.00 -0.04 0.00 0.00 0.00 0.00 53.44 53.31 1j26 n ALA 10 Cb 0.47 0.00 -0.01 0.00 0.00 0.00 0.00 19.45 19.91 1j26 n ALA 10 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 177.50 177.71 1j26 s LYS 11 N 0.00 1.13 0.44 0.00 2.20 -1.26 -5.18 119.74 117.08 1j26 s LYS 11 Ca 0.00 -0.61 0.03 0.00 -0.36 0.00 0.00 55.97 55.03 1j26 s LYS 11 Cb 0.00 0.39 -0.03 0.00 -1.51 0.00 0.00 37.83 36.68 1j26 s LYS 11 CO 0.00 -0.52 0.05 -0.65 -0.36 0.00 0.00 175.35 173.87 1j26 s GLN 12 N -3.23 2.02 0.10 4.03 1.11 -1.26 -5.04 119.66 117.38 1j26 s GLN 12 Ca 0.12 -2.23 -0.25 0.00 0.01 0.00 0.00 55.36 53.01 1j26 s GLN 12 Cb -0.01 -1.21 -0.12 0.00 -1.01 0.00 0.00 33.01 30.66 1j26 s GLN 12 CO 0.01 -0.32 1.70 0.00 0.01 0.00 0.00 175.29 176.69 1j26 h ALA 13 N 1.63 -0.20 -3.14 6.09 0.00 -2.07 -3.45 119.26 118.13 1j26 h ALA 13 Ca -0.41 -0.03 -0.32 0.00 0.00 0.00 0.00 54.91 54.15 1j26 h ALA 13 Cb 1.28 0.16 0.17 0.00 0.00 0.00 0.00 17.79 19.41 1j26 h ALA 13 CO 0.70 -0.63 -0.03 0.43 0.00 0.00 0.00 179.25 179.71 1j26 n SER 14 N -5.23 -2.95 -1.22 0.00 7.64 -1.26 -4.20 113.62 106.40 1j26 n SER 14 Ca -0.07 -0.89 -0.14 0.00 1.01 0.00 0.00 58.87 58.78 1j26 n SER 14 Cb 0.15 -0.84 -0.05 0.00 -1.01 0.00 0.00 64.21 62.46 1j26 n SER 14 CO 0.00 0.00 0.00 -1.20 -3.01 0.00 0.00 175.04 170.83 1j26 n SER 15 N -5.02 -4.59 0.00 6.43 7.64 -1.26 -4.96 113.62 111.86 1j26 n SER 15 Ca 0.12 0.25 0.00 0.00 1.01 0.00 0.00 58.87 60.25 1j26 n SER 15 Cb 0.50 -3.44 0.00 0.00 -1.01 0.00 0.00 64.21 60.26 1j26 n SER 15 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1j26 n TYR 16 N -2.98 0.00 -2.03 1.43 4.11 -1.26 -5.08 117.16 111.35 1j26 n TYR 16 Ca -0.15 0.00 0.00 0.00 -0.00 0.00 0.00 57.90 57.75 1j26 n TYR 16 Cb 0.51 0.00 0.00 0.00 -0.00 0.00 0.00 39.34 39.85 1j26 n TYR 16 CO 0.00 0.00 0.00 -0.89 -0.00 0.00 0.00 176.86 175.97 1j26 n ILE 17 N -0.18-13.06 -1.73 -3.48 2.08 -1.26 -5.06 119.36 96.67 1j26 n ILE 17 Ca 0.00 3.24 -0.30 0.00 0.56 0.00 0.00 62.75 66.25 1j26 n ILE 17 Cb 0.00 -5.48 0.08 0.00 -0.75 0.00 0.00 39.64 33.48 1j26 n ILE 17 CO 0.00 0.00 0.00 -2.16 0.56 0.00 0.00 176.55 174.95 1j26 s PRO 18 N -0.75 2.29 0.00 0.38 0.04 -1.26 -5.02 135.00 130.68 1j26 s PRO 18 Ca 0.00 0.47 0.00 0.00 0.04 0.00 0.00 61.00 61.51 1j26 s PRO 18 Cb 0.00 -1.96 0.00 0.00 0.04 0.00 0.00 34.50 32.58 1j26 s PRO 18 CO 0.00 -1.44 0.00 1.28 0.04 0.00 0.00 177.00 176.88 1j26 n LEU 19 N -3.28 2.85 -0.15 -3.56 4.32 -1.26 -4.53 117.00 111.39 1j26 n LEU 19 Ca 0.07 0.00 -0.06 0.00 -0.02 0.00 0.00 56.01 56.00 1j26 n LEU 19 Cb 0.58 0.00 0.12 0.00 -1.62 0.00 0.00 43.42 42.49 1j26 n LEU 19 CO 0.57 0.47 0.87 -0.78 -1.22 0.00 0.00 177.39 177.30 1j26 h ASP 20 N 0.00 0.86 -0.75 -1.43 1.82 -2.03 -1.90 116.42 112.99 1j26 h ASP 20 Ca 0.00 -0.22 0.00 0.00 -0.39 0.00 0.00 57.03 56.43 1j26 h ASP 20 Cb 0.99 -0.23 -0.04 0.00 0.68 0.00 0.00 39.33 40.73 1j26 h ASP 20 CO 0.00 0.92 0.49 0.03 -1.61 0.00 0.00 179.24 179.06 1j26 h ARG 21 N 0.83 1.00 0.00 0.28 3.08 -2.01 -3.45 114.38 114.10 1j26 h ARG 21 Ca 0.16 -0.07 -0.10 0.00 0.07 0.00 0.00 59.98 60.04 1j26 h ARG 21 Cb 0.48 -0.22 0.04 0.00 0.08 0.00 0.00 29.97 30.35 1j26 h ARG 21 CO 0.02 0.67 0.08 1.28 -1.07 0.00 0.00 179.97 180.96 1j26 n LEU 22 N -4.55 0.00 -3.74 3.04 4.77 -0.72 -4.96 117.00 110.85 1j26 n LEU 22 Ca 0.07 -0.37 -0.29 0.00 -0.03 0.00 0.00 56.01 55.39 1j26 n LEU 22 Cb 0.03 -0.22 -0.12 0.00 -2.33 0.00 0.00 43.42 40.77 1j26 n LEU 22 CO 0.36 -0.70 -0.18 -0.55 -1.33 0.00 0.00 177.39 174.99 1j26 s SER 23 N -2.09 3.71 0.27 -1.43 0.15 0.53 -4.97 113.70 109.87 1j26 s SER 23 Ca 0.17 -3.17 -0.29 0.00 0.70 0.00 0.00 55.95 53.36 1j26 s SER 23 Cb -0.01 -1.20 -0.09 0.00 -1.71 0.00 0.00 66.02 63.01 1j26 s SER 23 CO 0.12 -0.18 0.96 -0.63 1.20 0.00 0.00 173.24 174.70 1j26 s ILE 24 N -0.39 4.06 -0.20 6.45 1.09 -1.26 -1.00 121.20 129.95 1j26 s ILE 24 Ca 0.23 1.94 -0.06 0.00 -1.10 0.00 0.00 60.65 61.66 1j26 s ILE 24 Cb -0.13 -4.18 0.10 0.00 -1.06 0.00 0.00 42.46 37.19 1j26 s ILE 24 CO -0.09 0.36 0.39 -0.55 -0.10 0.00 0.00 174.94 174.95 1j26 s SER 25 N -1.31 -0.06 0.38 3.58 0.15 0.01 -4.98 113.70 111.48 1j26 s SER 25 Ca 0.45 0.77 -0.15 0.00 0.70 0.00 0.00 55.95 57.71 1j26 s SER 25 Cb -0.24 1.21 -0.09 0.00 -1.71 0.00 0.00 66.02 65.19 1j26 s SER 25 CO 0.30 -0.25 0.81 -0.31 1.20 0.00 0.00 173.24 174.99 1j26 s TYR 26 N 2.57 3.39 0.13 3.44 2.02 -1.26 -0.51 117.35 127.13 1j26 s TYR 26 Ca 0.02 1.28 -0.01 0.00 -0.37 0.00 0.00 57.07 57.99 1j26 s TYR 26 Cb -0.13 -2.60 0.00 0.00 -0.40 0.00 0.00 41.96 38.83 1j26 s TYR 26 CO -0.13 -0.03 0.18 0.00 -1.57 0.00 0.00 175.55 174.00 1j26 h ARG 28 N 0.00 -0.37 0.00 0.00 2.43 -1.95 0.62 114.38 115.11 1j26 h ARG 28 Ca -0.10 0.03 0.00 0.00 -0.81 0.00 0.00 59.98 59.09 1j26 h ARG 28 Cb 0.45 0.08 0.00 0.00 -0.42 0.00 0.00 29.97 30.08 1j26 h ARG 28 CO 0.14 -0.24 0.00 -1.13 -1.51 0.00 0.00 179.97 177.22 1j26 n SER 29 N -3.59 0.00 0.00 -3.80 3.41 -1.26 -2.10 113.62 106.28 1j26 n SER 29 Ca -0.05 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.56 1j26 n SER 29 Cb 0.15 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 64.10 1j26 n SER 29 CO 0.00 0.00 0.00 -1.20 -0.16 0.00 0.00 175.04 173.68 1j26 n SER 30 N 0.00 0.00 -3.03 4.04 7.64 -1.26 -4.97 113.62 116.04 1j26 n SER 30 Ca 0.00 0.00 0.05 0.00 1.01 0.00 0.00 58.87 59.93 1j26 n SER 30 Cb 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.20 1j26 n SER 30 CO 0.00 0.00 0.00 -0.83 -3.01 0.00 0.00 175.04 171.20 1j26 s GLY 31 N 0.00 -1.09 0.02 0.23 0.00 -1.26 -5.13 107.32 100.09 1j26 s GLY 31 Ca 0.00 1.97 -0.30 0.00 0.00 0.00 0.00 44.72 46.39 1j26 s GLY 31 CO 0.00 4.21 1.64 2.56 0.00 0.00 0.00 173.10 181.51 1j26 s PRO 32 N 2.68 4.20 0.00 2.90 0.04 -1.26 -4.64 135.00 138.93 1j26 s PRO 32 Ca 0.25 2.25 0.00 0.00 0.04 0.00 0.00 61.00 63.55 1j26 s PRO 32 Cb 0.00 -3.75 0.00 0.00 0.04 0.00 0.00 34.50 30.79 1j26 s PRO 32 CO -0.21 -0.76 0.00 0.41 0.04 0.00 0.00 177.00 176.48 1j26 n GLY 33 N 4.03 1.67 0.00 0.56 0.00 -1.26 -5.07 105.19 105.11 1j26 n GLY 33 Ca 0.16 -0.62 0.00 0.00 0.00 0.00 0.00 46.02 45.56 1j26 n GLY 33 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1j26 n GLY 34 N 0.00 0.00 5.30 -0.02 0.00 -1.26 -4.81 105.19 104.39 1j26 n GLY 34 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 1j26 n GLY 34 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 1j26 n GLN 35 N -0.23 0.00 -0.05 1.61 6.02 -1.26 -1.31 117.38 122.15 1j26 n GLN 35 Ca 0.00 0.00 -0.06 0.00 -0.01 0.00 0.00 57.00 56.93 1j26 n GLN 35 Cb 0.00 0.00 -0.05 0.00 1.02 0.00 0.00 30.24 31.21 1j26 n GLN 35 CO 0.00 0.00 0.00 0.09 -1.01 0.00 0.00 177.06 176.14 1j26 n ASN 36 N 2.39 3.21 -4.58 1.08 3.02 -1.26 -4.88 115.26 114.25 1j26 n ASN 36 Ca 0.00 -0.05 -0.34 0.00 -0.03 0.00 0.00 54.58 54.17 1j26 n ASN 36 Cb 0.00 -0.03 -0.04 0.00 -0.61 0.00 0.00 39.78 39.11 1j26 n ASN 36 CO 0.00 0.00 0.00 0.54 -2.62 0.00 0.00 177.26 175.18 1j26 s VAL 37 N -2.20 3.76 0.12 2.41 0.11 -0.43 -4.69 120.40 119.48 1j26 s VAL 37 Ca -0.12 -1.26 -0.12 0.00 -2.93 0.00 0.00 61.98 57.55 1j26 s VAL 37 Cb 0.03 -4.80 -0.12 0.00 -1.53 0.00 0.00 36.38 29.96 1j26 s VAL 37 CO 0.24 -1.40 1.36 0.78 -3.33 0.00 0.00 175.10 172.75 1j26 h ASN 38 N 9.00 0.97 0.00 3.54 2.35 -1.90 -3.41 115.58 126.13 1j26 h ASN 38 Ca 0.30 -0.57 0.00 0.00 -0.55 0.00 0.00 56.30 55.47 1j26 h ASN 38 Cb 0.92 -0.28 0.00 0.00 0.05 0.00 0.00 38.32 39.01 1j26 h ASN 38 CO 1.32 1.38 0.00 0.29 -1.65 0.00 0.00 177.43 178.76 1j26 n LYS 39 N -3.97 0.00 -3.50 0.81 4.76 -1.26 -5.09 118.16 109.91 1j26 n LYS 39 Ca -0.06 0.00 -0.10 0.00 -2.87 0.00 0.00 58.31 55.28 1j26 n LYS 39 Cb 0.69 -0.06 -0.10 0.00 -1.84 0.00 0.00 35.03 33.72 1j26 n LYS 39 CO 0.00 0.00 0.00 0.54 -1.37 0.00 0.00 177.40 176.57 1j26 s VAL 40 N -1.67 -0.57 0.15 -0.18 0.11 -1.26 -5.02 120.40 111.97 1j26 s VAL 40 Ca 0.00 0.05 0.19 0.00 -2.93 0.00 0.00 61.98 59.29 1j26 s VAL 40 Cb 0.00 -0.70 0.14 0.00 -1.53 0.00 0.00 36.38 34.28 1j26 s VAL 40 CO 0.00 -0.03 1.72 -1.13 -3.33 0.00 0.00 175.10 172.33 1j26 h ASN 41 N 8.20 0.00 -3.86 3.54 -1.24 -1.73 -3.48 115.58 117.02 1j26 h ASN 41 Ca -0.17 0.00 0.00 0.00 0.71 0.00 0.00 56.30 56.84 1j26 h ASN 41 Cb 1.13 0.00 -0.02 0.00 0.73 0.00 0.00 38.32 40.16 1j26 h ASN 41 CO 0.21 0.37 -0.52 -1.20 -1.29 0.00 0.00 177.43 175.00 1j26 n SER 42 N -3.51 -3.24 -4.88 1.15 7.64 -1.08 -3.64 113.62 106.06 1j26 n SER 42 Ca -0.00 0.58 -0.29 0.00 1.01 0.00 0.00 58.87 60.17 1j26 n SER 42 Cb 0.52 -2.80 -0.02 0.00 -1.01 0.00 0.00 64.21 60.90 1j26 n SER 42 CO 0.00 0.00 0.00 -0.75 -3.01 0.00 0.00 175.04 171.28 1j26 s LYS 43 N -0.75 3.68 -0.05 1.43 2.20 0.21 -4.58 119.74 121.88 1j26 s LYS 43 Ca -0.05 0.45 0.03 0.00 -0.36 0.00 0.00 55.97 56.04 1j26 s LYS 43 Cb 0.00 -2.32 0.01 0.00 -1.51 0.00 0.00 37.83 34.01 1j26 s LYS 43 CO 0.33 -0.19 -0.12 0.00 -0.36 0.00 0.00 175.35 175.01 1j26 s ALA 44 N -2.64 1.18 0.15 3.13 0.00 -1.26 -1.99 121.76 120.34 1j26 s ALA 44 Ca 0.51 -0.42 0.10 0.00 0.00 0.00 0.00 51.96 52.14 1j26 s ALA 44 Cb -0.10 -0.49 -0.04 0.00 0.00 0.00 0.00 23.12 22.49 1j26 s ALA 44 CO 0.39 0.14 -0.18 -2.00 0.00 0.00 0.00 175.76 174.12 1j26 s GLU 45 N 0.45 1.76 0.00 0.00 2.12 0.33 -2.31 118.70 121.06 1j26 s GLU 45 Ca -0.10 -1.30 0.02 0.00 0.36 0.00 0.00 54.97 53.95 1j26 s GLU 45 Cb -0.13 -2.04 -0.01 0.00 0.26 0.00 0.00 34.13 32.21 1j26 s GLU 45 CO 0.02 0.45 -0.05 0.08 -0.54 0.00 0.00 175.26 175.22 1j26 s VAL 46 N -1.41 0.38 -0.01 3.70 1.01 -0.23 -0.81 120.40 123.03 1j26 s VAL 46 Ca 0.20 -0.35 0.01 0.00 0.00 0.00 0.00 61.98 61.85 1j26 s VAL 46 Cb -0.09 -0.35 -0.00 0.00 0.00 0.00 0.00 36.38 35.93 1j26 s VAL 46 CO 0.11 0.02 -0.04 -0.60 0.00 0.00 0.00 175.10 174.58 1j26 s ARG 47 N -0.36 0.39 -0.07 2.72 3.52 -0.17 -1.38 118.95 123.60 1j26 s ARG 47 Ca -0.00 -0.16 -0.13 0.00 -0.13 0.00 0.00 55.73 55.31 1j26 s ARG 47 Cb -0.03 -0.38 0.03 0.00 -1.56 0.00 0.00 34.95 33.00 1j26 s ARG 47 CO -0.00 0.09 0.32 -0.59 -0.81 0.00 0.00 175.30 174.31 1j26 s PHE 48 N -0.03 -0.27 -0.61 5.12 -0.12 -0.51 -0.35 117.98 121.20 1j26 s PHE 48 Ca 0.01 0.58 -0.27 0.00 -0.05 0.00 0.00 56.93 57.19 1j26 s PHE 48 Cb -0.03 0.11 0.01 0.00 -0.63 0.00 0.00 43.02 42.48 1j26 s PHE 48 CO -0.00 -0.28 1.54 -1.58 -0.05 0.00 0.00 175.22 174.84 1j26 s HIS 49 N -0.58 2.06 0.20 3.49 5.65 -1.26 -0.50 115.29 124.35 1j26 s HIS 49 Ca -0.07 0.45 -0.11 0.00 0.25 0.00 0.00 55.06 55.58 1j26 s HIS 49 Cb -0.04 -4.34 0.24 0.00 -1.18 0.00 0.00 32.58 27.25 1j26 s HIS 49 CO 0.02 -2.15 1.76 1.25 -0.65 0.00 0.00 174.74 174.97 1j26 h LEU 50 N 14.17 0.26 -1.61 8.88 6.46 -1.93 -1.87 115.31 139.68 1j26 h LEU 50 Ca -0.27 0.06 0.03 0.00 -0.12 0.00 0.00 57.88 57.58 1j26 h LEU 50 Cb 1.11 0.03 -0.03 0.00 -0.73 0.00 0.00 40.66 41.04 1j26 h LEU 50 CO 1.21 0.17 0.31 0.00 -0.62 0.00 0.00 178.44 179.51 1j26 h ALA 51 N 1.38 1.79 -0.49 1.25 0.00 -1.90 0.36 119.26 121.66 1j26 h ALA 51 Ca 0.28 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 55.17 1j26 h ALA 51 Cb 0.31 -0.14 0.00 0.00 0.00 0.00 0.00 17.79 17.95 1j26 h ALA 51 CO -0.26 0.16 0.00 0.45 0.00 0.00 0.00 179.25 179.59 1j26 n SER 52 N -4.48 2.81 0.23 0.00 2.88 -0.75 -4.58 113.62 109.73 1j26 n SER 52 Ca 0.05 -2.06 -0.09 0.00 -1.33 0.00 0.00 58.87 55.43 1j26 n SER 52 Cb 0.14 -0.36 -0.05 0.00 -0.75 0.00 0.00 64.21 63.20 1j26 n SER 52 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 1j26 h ALA 53 N 3.85 -1.14 0.00 -1.46 0.00 -0.38 -3.46 119.26 116.67 1j26 h ALA 53 Ca 0.00 -0.13 0.00 0.00 0.00 0.00 0.00 54.91 54.78 1j26 h ALA 53 Cb 0.75 0.28 0.00 0.00 0.00 0.00 0.00 17.79 18.81 1j26 h ALA 53 CO 0.03 -1.10 0.00 -3.47 0.00 0.00 0.00 179.25 174.71 1j26 n ASP 54 N -3.70 0.00 0.06 0.00 -0.08 -1.26 -4.58 116.55 106.98 1j26 n ASP 54 Ca -0.08 0.00 0.13 0.00 -1.51 0.00 0.00 54.79 53.33 1j26 n ASP 54 Cb 0.24 -0.35 0.34 0.00 2.34 0.00 0.00 41.12 43.70 1j26 n ASP 54 CO 0.00 0.00 0.00 -2.67 0.12 0.00 0.00 177.20 174.65 1j26 n TRP 55 N -1.45 0.55 -3.66 -0.67 4.27 -1.26 -4.80 117.44 110.42 1j26 n TRP 55 Ca 0.00 0.16 -0.36 0.00 -3.89 0.00 0.00 57.50 53.41 1j26 n TRP 55 Cb 0.00 -0.70 -0.06 0.00 -1.36 0.00 0.00 31.31 29.20 1j26 n TRP 55 CO 0.00 0.00 0.00 0.42 -2.29 0.00 0.00 177.69 175.82 1j26 s ILE 56 N -3.09 5.21 0.44 -1.67 1.01 -1.26 -5.09 121.20 116.75 1j26 s ILE 56 Ca 0.10 0.46 -0.26 0.00 0.00 0.00 0.00 60.65 60.95 1j26 s ILE 56 Cb 0.14 -3.59 -0.08 0.00 0.01 0.00 0.00 42.46 38.93 1j26 s ILE 56 CO 0.64 0.48 1.43 -1.61 0.00 0.00 0.00 174.94 175.87 1j26 s GLU 57 N -1.40 3.74 0.16 2.79 2.02 -1.26 -4.80 118.70 119.94 1j26 s GLU 57 Ca 0.25 2.42 -0.18 0.00 0.02 0.00 0.00 54.97 57.48 1j26 s GLU 57 Cb -0.14 -2.69 0.06 0.00 0.10 0.00 0.00 34.13 31.46 1j26 s GLU 57 CO 0.13 -0.78 1.67 1.49 0.02 0.00 0.00 175.26 177.79 1j26 h GLU 58 N 2.40 -0.02 0.00 1.61 4.57 -1.98 0.26 114.58 121.42 1j26 h GLU 58 Ca -0.51 0.00 0.00 0.00 -1.18 0.00 0.00 59.36 57.67 1j26 h GLU 58 Cb 1.26 0.00 0.00 0.00 -0.16 0.00 0.00 28.75 29.86 1j26 h GLU 58 CO 0.61 -0.01 0.00 -0.35 -1.18 0.00 0.00 179.01 178.08 1j26 n PRO 59 N -5.29 0.18 -0.10 0.92 -0.04 -1.26 -2.15 135.00 127.25 1j26 n PRO 59 Ca 0.01 0.12 -0.20 0.00 -0.04 0.00 0.00 63.50 63.39 1j26 n PRO 59 Cb 0.20 -1.50 -0.12 0.00 -0.04 0.00 0.00 33.50 32.04 1j26 n PRO 59 CO 0.00 0.00 0.00 0.28 -0.04 0.00 0.00 175.50 175.74 1j26 n VAL 60 N -1.37 1.56 0.05 0.52 0.31 -0.84 -3.90 118.33 114.66 1j26 n VAL 60 Ca 0.08 -0.55 -0.15 0.00 -0.01 0.00 0.00 64.34 63.70 1j26 n VAL 60 Cb 0.19 -1.55 -0.09 0.00 -0.91 0.00 0.00 33.84 31.48 1j26 n VAL 60 CO 0.00 0.00 0.00 0.03 -1.32 0.00 0.00 176.83 175.54 1j26 h ARG 61 N -0.12 -0.63 0.00 5.55 3.08 0.01 -0.51 114.38 121.76 1j26 h ARG 61 Ca -0.56 0.04 -0.04 0.00 0.07 0.00 0.00 59.98 59.49 1j26 h ARG 61 Cb 1.88 0.14 -0.01 0.00 0.08 0.00 0.00 29.97 32.07 1j26 h ARG 61 CO -0.09 -0.42 -0.21 -0.56 -1.07 0.00 0.00 179.97 177.62 1j26 h GLN 62 N -0.65 0.00 0.51 0.04 3.07 -1.77 0.40 115.11 116.69 1j26 h GLN 62 Ca 0.02 0.00 -0.02 0.00 0.09 0.00 0.00 58.65 58.74 1j26 h GLN 62 Cb 0.71 0.00 0.00 0.00 0.08 0.00 0.00 27.48 28.27 1j26 h GLN 62 CO -0.36 0.21 -0.28 -0.22 0.09 0.00 0.00 178.83 178.27 1j26 h LYS 63 N 0.00 -0.70 -0.92 0.06 1.63 -1.25 -2.56 116.57 112.83 1j26 h LYS 63 Ca -0.00 0.05 0.18 0.00 -0.85 0.00 0.00 60.65 60.03 1j26 h LYS 63 Cb 0.44 0.16 -0.08 0.00 -0.60 0.00 0.00 32.23 32.16 1j26 h LYS 63 CO 0.03 -0.47 0.59 0.82 -3.45 0.00 0.00 179.45 176.97 1j26 h ILE 64 N -0.73 0.73 -0.54 2.00 5.03 -0.95 0.62 117.51 123.66 1j26 h ILE 64 Ca -0.07 -0.19 0.05 0.00 -0.12 0.00 0.00 64.86 64.53 1j26 h ILE 64 Cb 0.57 0.12 -0.03 0.00 -3.03 0.00 0.00 36.82 34.46 1j26 h ILE 64 CO 0.09 0.10 0.36 0.00 -0.68 0.00 0.00 178.15 178.02 1j26 h ALA 65 N 1.61 1.83 0.00 1.87 0.00 -0.78 -1.08 119.26 122.72 1j26 h ALA 65 Ca 0.48 -0.02 -0.22 0.00 0.00 0.00 0.00 54.91 55.16 1j26 h ALA 65 Cb 0.99 -0.14 -0.03 0.00 0.00 0.00 0.00 17.79 18.61 1j26 h ALA 65 CO -0.22 0.09 -1.68 1.28 0.00 0.00 0.00 179.25 178.71 1j26 n LEU 66 N -4.47 1.82 0.18 0.00 4.77 -0.06 -3.90 117.00 115.33 1j26 n LEU 66 Ca 0.07 0.31 0.02 0.00 -0.03 0.00 0.00 56.01 56.38 1j26 n LEU 66 Cb 0.21 -0.72 0.33 0.00 -2.33 0.00 0.00 43.42 40.92 1j26 n LEU 66 CO 0.34 0.12 0.69 0.74 -1.33 0.00 0.00 177.39 177.96 1j26 h THR 67 N -0.90 1.29 -0.23 -5.08 2.02 0.07 -2.55 112.91 107.52 1j26 h THR 67 Ca -0.33 -1.38 -0.09 0.00 0.77 0.00 0.00 66.41 65.38 1j26 h THR 67 Cb 1.24 1.75 -0.05 0.00 -1.74 0.00 0.00 68.15 69.35 1j26 h THR 67 CO -0.20 0.40 -0.11 1.41 0.37 0.00 0.00 175.52 177.39 1j26 n HIS 68 N -4.06 0.75 -0.20 3.16 8.25 -0.41 -4.67 115.22 118.04 1j26 n HIS 68 Ca -0.02 -1.34 0.09 0.00 -0.26 0.00 0.00 57.72 56.19 1j26 n HIS 68 Cb 0.43 -0.37 0.38 0.00 1.12 0.00 0.00 29.99 31.55 1j26 n HIS 68 CO 0.00 0.00 0.00 -0.22 0.64 0.00 0.00 176.34 176.76 1j26 h LYS 69 N 1.05 0.67 0.00 -0.41 3.64 -1.46 0.33 116.57 120.38 1j26 h LYS 69 Ca 0.11 -0.04 -0.02 0.00 -1.27 0.00 0.00 60.65 59.43 1j26 h LYS 69 Cb 1.43 -0.15 -0.00 0.00 -0.41 0.00 0.00 32.23 33.10 1j26 h LYS 69 CO 0.24 0.44 -0.10 -0.97 -2.27 0.00 0.00 179.45 176.80 1j26 h ASN 70 N 0.69 0.00 0.96 4.20 -0.00 -1.83 -1.10 115.58 118.50 1j26 h ASN 70 Ca 0.35 0.00 0.00 0.00 -0.00 0.00 0.00 56.30 56.65 1j26 h ASN 70 Cb 0.45 0.00 0.00 0.00 -0.00 0.00 0.00 38.32 38.77 1j26 h ASN 70 CO -0.13 0.10 -0.11 0.29 -0.00 0.00 0.00 177.43 177.57 1j26 n LYS 71 N -4.09 0.04 -1.77 6.67 4.76 0.06 -4.86 118.16 118.96 1j26 n LYS 71 Ca -0.03 0.03 -0.33 0.00 -2.87 0.00 0.00 58.31 55.11 1j26 n LYS 71 Cb 0.18 -1.54 0.05 0.00 -1.84 0.00 0.00 35.03 31.87 1j26 n LYS 71 CO 0.00 0.00 0.00 0.42 -1.37 0.00 0.00 177.40 176.45 1j26 s ILE 72 N -3.02 3.20 0.00 -0.18 1.01 -0.42 -1.48 121.20 120.31 1j26 s ILE 72 Ca 0.13 0.57 0.00 0.00 0.00 0.00 0.00 60.65 61.35 1j26 s ILE 72 Cb 0.18 -3.10 0.00 0.00 0.01 0.00 0.00 42.46 39.55 1j26 s ILE 72 CO 0.58 -0.34 0.13 -0.46 0.00 0.00 0.00 174.94 174.85 1j26 n ASN 73 N -2.36 0.00 0.00 3.58 6.94 -0.47 -4.82 115.26 118.13 1j26 n ASN 73 Ca 0.11 0.13 0.00 0.00 -0.02 0.00 0.00 54.58 54.80 1j26 n ASN 73 Cb 0.52 0.00 0.00 0.00 -2.36 0.00 0.00 39.78 37.94 1j26 n ASN 73 CO 0.00 0.00 0.00 1.17 -1.03 0.00 0.00 177.26 177.40 1j26 n LYS 74 N -0.21 0.00 -0.36 -3.83 0.00 -1.26 -4.92 118.16 107.59 1j26 n LYS 74 Ca 0.00 0.00 0.02 0.00 0.00 0.00 0.00 58.31 58.33 1j26 n LYS 74 Cb 0.00 -0.05 0.17 0.00 0.00 0.00 0.00 35.03 35.16 1j26 n LYS 74 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.40 177.40 1j26 h ALA 75 N 0.00 1.40 0.00 3.14 0.00 -2.03 -3.46 119.26 118.31 1j26 h ALA 75 Ca 0.00 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 54.87 1j26 h ALA 75 Cb 0.00 -0.33 0.00 0.00 0.00 0.00 0.00 17.79 17.46 1j26 h ALA 75 CO 0.00 0.49 0.00 0.41 0.00 0.00 0.00 179.25 180.15 1j26 n GLY 76 N -1.38 1.12 3.74 0.00 0.00 -1.26 -5.11 105.19 102.30 1j26 n GLY 76 Ca 0.14 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.75 1j26 n GLY 76 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1j26 s GLU 77 N 0.00 4.39 -0.06 1.61 2.02 -1.26 -3.79 118.70 121.61 1j26 s GLU 77 Ca 0.00 2.04 -0.27 0.00 0.02 0.00 0.00 54.97 56.77 1j26 s GLU 77 Cb 0.00 -3.20 -0.03 0.00 0.10 0.00 0.00 34.13 31.00 1j26 s GLU 77 CO 0.00 -0.26 0.85 -1.17 0.02 0.00 0.00 175.26 174.70 1j26 s LEU 78 N -0.03 4.31 -0.04 1.80 2.96 0.35 -1.36 118.68 126.66 1j26 s LEU 78 Ca 0.57 1.39 0.04 0.00 -0.22 0.00 0.00 54.13 55.92 1j26 s LEU 78 Cb -0.36 -3.33 -0.00 0.00 0.50 0.00 0.00 46.19 43.00 1j26 s LEU 78 CO 0.38 -0.24 -0.17 -0.69 -1.32 0.00 0.00 176.35 174.31 1j26 s VAL 79 N 1.17 1.42 0.12 1.68 1.01 -0.55 -1.42 120.40 123.82 1j26 s VAL 79 Ca 0.44 -0.71 -0.11 0.00 0.00 0.00 0.00 61.98 61.61 1j26 s VAL 79 Cb -0.19 -1.22 0.01 0.00 0.00 0.00 0.00 36.38 34.98 1j26 s VAL 79 CO 0.21 0.41 0.27 -1.48 0.00 0.00 0.00 175.10 174.51 1j26 s LEU 80 N 0.05 1.06 0.01 3.92 2.34 -0.48 -4.64 118.68 120.95 1j26 s LEU 80 Ca -0.04 -0.62 0.01 0.00 0.06 0.00 0.00 54.13 53.53 1j26 s LEU 80 Cb -0.12 1.28 -0.01 0.00 -0.56 0.00 0.00 46.19 46.78 1j26 s LEU 80 CO 0.02 -0.80 -0.03 0.42 -1.06 0.00 0.00 176.35 174.90 1j26 s THR 81 N -3.87 0.17 -0.11 5.48 -4.23 -1.26 -1.07 115.64 110.75 1j26 s THR 81 Ca 0.07 -0.43 -0.03 0.00 -1.18 0.00 0.00 61.69 60.12 1j26 s THR 81 Cb 0.04 -0.21 0.05 0.00 1.34 0.00 0.00 72.50 73.72 1j26 s THR 81 CO -0.09 -0.17 0.15 -0.55 -0.54 0.00 0.00 174.62 173.42 1j26 s SER 82 N -0.63 1.13 -0.09 3.99 0.15 -0.98 -4.98 113.70 112.29 1j26 s SER 82 Ca -0.05 0.08 -0.00 0.00 0.70 0.00 0.00 55.95 56.67 1j26 s SER 82 Cb -0.04 0.16 0.02 0.00 -1.71 0.00 0.00 66.02 64.45 1j26 s SER 82 CO -0.00 -0.27 -0.06 -1.61 1.20 0.00 0.00 173.24 172.50 1j26 s GLU 83 N 2.26 1.25 0.00 5.44 8.01 -1.26 -4.13 118.70 130.27 1j26 s GLU 83 Ca 0.04 -0.17 0.00 0.00 0.01 0.00 0.00 54.97 54.85 1j26 s GLU 83 Cb -0.13 -1.34 0.00 0.00 -4.31 0.00 0.00 34.13 28.35 1j26 s GLU 83 CO -0.07 -0.22 0.00 0.43 0.01 0.00 0.00 175.26 175.41 1j26 n SER 84 N 4.78 0.00 -4.96 -0.19 7.64 -1.26 -5.11 113.62 114.52 1j26 n SER 84 Ca -0.14 0.00 -0.20 0.00 1.01 0.00 0.00 58.87 59.55 1j26 n SER 84 Cb 0.50 0.00 -0.01 0.00 -1.01 0.00 0.00 64.21 63.69 1j26 n SER 84 CO 0.00 0.00 0.00 -0.44 -3.01 0.00 0.00 175.04 171.59 1j26 s SER 85 N 0.00 5.82 0.00 6.43 0.01 -1.26 -5.02 113.70 119.68 1j26 s SER 85 Ca 0.00 -0.25 0.28 0.00 1.31 0.00 0.00 55.95 57.29 1j26 s SER 85 Cb 0.00 -1.19 1.00 0.00 0.21 0.00 0.00 66.02 66.04 1j26 s SER 85 CO 0.00 -0.40 1.73 -2.11 0.41 0.00 0.00 173.24 172.87 1j26 n ARG 86 N -1.57 0.48 -2.57 12.44 1.85 -1.24 -4.26 116.66 121.80 1j26 n ARG 86 Ca -0.01 -0.20 -0.22 0.00 -1.00 0.00 0.00 57.85 56.42 1j26 n ARG 86 Cb 0.58 -1.50 0.06 0.00 -1.05 0.00 0.00 32.46 30.56 1j26 n ARG 86 CO 0.00 0.00 0.00 0.71 -0.01 0.00 0.00 177.63 178.33 1j26 s TYR 87 N -2.65 2.47 0.00 2.89 2.02 -1.26 -4.66 117.35 116.16 1j26 s TYR 87 Ca 0.23 -0.04 0.00 0.00 -0.37 0.00 0.00 57.07 56.89 1j26 s TYR 87 Cb 0.19 -2.88 0.00 0.00 -0.40 0.00 0.00 41.96 38.87 1j26 s TYR 87 CO 0.53 -1.20 0.00 0.00 -1.57 0.00 0.00 175.55 173.32 1j26 n GLN 88 N -2.57 0.00 0.27 -0.62 10.64 -1.26 -4.33 117.38 119.51 1j26 n GLN 88 Ca 0.10 0.07 0.11 0.00 -1.83 0.00 0.00 57.00 55.45 1j26 n GLN 88 Cb 0.60 -0.51 0.74 0.00 -0.86 0.00 0.00 30.24 30.20 1j26 n GLN 88 CO 0.00 0.00 0.00 0.35 -1.83 0.00 0.00 177.06 175.58 1j26 h PHE 89 N 0.00 0.00 -0.38 2.61 3.04 -1.98 -2.04 116.94 118.19 1j26 h PHE 89 Ca 0.00 0.00 -0.01 0.00 3.98 0.00 0.00 57.97 61.94 1j26 h PHE 89 Cb 0.00 0.00 -0.02 0.00 2.56 0.00 0.00 35.95 38.49 1j26 h PHE 89 CO 0.00 0.04 0.21 -0.09 -2.02 0.00 0.00 178.31 176.44 1j26 h ARG 90 N 0.00 0.53 -0.60 1.11 1.12 -2.00 0.31 114.38 114.85 1j26 h ARG 90 Ca -0.00 -0.06 -0.08 0.00 -1.11 0.00 0.00 59.98 58.72 1j26 h ARG 90 Cb 0.08 -0.10 -0.02 0.00 -0.01 0.00 0.00 29.97 29.91 1j26 h ARG 90 CO 0.00 0.44 0.05 -0.91 -3.11 0.00 0.00 179.97 176.44 1j26 h ASN 91 N 0.48 0.99 -0.77 -3.80 2.35 -1.57 -3.02 115.58 110.24 1j26 h ASN 91 Ca 0.13 -0.28 -0.02 0.00 -0.55 0.00 0.00 56.30 55.58 1j26 h ASN 91 Cb 0.06 -0.26 -0.04 0.00 0.05 0.00 0.00 38.32 38.13 1j26 h ASN 91 CO -0.02 1.03 0.41 0.25 -1.65 0.00 0.00 177.43 177.44 1j26 h LEU 92 N 0.92 0.98 -0.89 1.61 7.12 -1.03 -2.25 115.31 121.76 1j26 h LEU 92 Ca 0.18 -0.09 0.12 0.00 0.13 0.00 0.00 57.88 58.21 1j26 h LEU 92 Cb 0.49 -0.25 -0.08 0.00 -0.53 0.00 0.00 40.66 40.29 1j26 h LEU 92 CO 0.02 0.80 0.52 0.00 -0.13 0.00 0.00 178.44 179.65 1j26 h ALA 93 N 1.36 1.32 -0.38 1.25 0.00 -0.28 -0.37 119.26 122.16 1j26 h ALA 93 Ca 0.27 0.04 -0.13 0.00 0.00 0.00 0.00 54.91 55.09 1j26 h ALA 93 Cb 0.05 -0.13 -0.01 0.00 0.00 0.00 0.00 17.79 17.70 1j26 h ALA 93 CO -0.04 0.10 -0.28 1.49 0.00 0.00 0.00 179.25 180.52 1j26 h GLU 94 N 0.82 0.86 -0.01 0.00 4.81 -1.44 0.11 114.58 119.73 1j26 h GLU 94 Ca 0.45 -0.42 0.03 0.00 -0.13 0.00 0.00 59.36 59.29 1j26 h GLU 94 Cb 0.48 -0.00 -0.04 0.00 0.63 0.00 0.00 28.75 29.82 1j26 h GLU 94 CO -0.28 1.06 -0.20 0.00 -0.73 0.00 0.00 179.01 178.86 1j26 h LEU 96 N -0.32 0.00 0.08 0.00 3.38 -1.04 -2.82 115.31 114.59 1j26 h LEU 96 Ca 0.06 0.00 -0.29 0.00 0.09 0.00 0.00 57.88 57.74 1j26 h LEU 96 Cb 0.40 0.00 0.03 0.00 0.09 0.00 0.00 40.66 41.18 1j26 h LEU 96 CO -0.20 0.00 -1.20 -0.61 0.09 0.00 0.00 178.44 176.52 1j26 h GLN 97 N 0.00 0.60 -0.37 1.13 5.75 0.18 -3.19 115.11 119.22 1j26 h GLN 97 Ca -0.00 -0.78 -0.13 0.00 -0.15 0.00 0.00 58.65 57.59 1j26 h GLN 97 Cb 0.48 0.25 -0.01 0.00 1.07 0.00 0.00 27.48 29.27 1j26 h GLN 97 CO 0.00 1.35 -0.31 0.87 -2.65 0.00 0.00 178.83 178.09 1j26 h LYS 98 N 0.28 0.80 -0.99 1.69 1.57 -0.84 -1.40 116.57 117.69 1j26 h LYS 98 Ca -0.17 -0.37 0.37 0.00 -1.87 0.00 0.00 60.65 58.61 1j26 h LYS 98 Cb 1.87 -0.01 -0.18 0.00 0.08 0.00 0.00 32.23 33.99 1j26 h LYS 98 CO 0.23 1.00 0.37 -0.89 -0.57 0.00 0.00 179.45 179.59 1j26 n ILE 99 N -4.08 -0.42 -0.06 1.86 5.41 -1.08 -0.38 119.36 120.61 1j26 n ILE 99 Ca -0.01 2.06 -0.12 0.00 1.00 0.00 0.00 62.75 65.69 1j26 n ILE 99 Cb 0.49 -3.24 -0.05 0.00 -0.71 0.00 0.00 39.64 36.12 1j26 n ILE 99 CO 0.00 0.00 0.00 0.03 0.00 0.00 0.00 176.55 176.58 1j26 h ARG 100 N 0.00 0.34 -0.32 0.38 3.08 -1.24 -2.24 114.38 114.38 1j26 h ARG 100 Ca 0.77 -0.11 -0.07 0.00 0.07 0.00 0.00 59.98 60.63 1j26 h ARG 100 Cb 1.91 -0.03 -0.01 0.00 0.08 0.00 0.00 29.97 31.93 1j26 h ARG 100 CO -0.82 0.56 -0.09 0.22 -1.07 0.00 0.00 179.97 178.78 1j26 h ASP 101 N 0.08 0.63 -0.99 7.04 3.58 -0.51 0.19 116.42 126.44 1j26 h ASP 101 Ca 0.05 -0.37 0.17 0.00 0.42 0.00 0.00 57.03 57.30 1j26 h ASP 101 Cb 0.42 -0.17 -0.09 0.00 1.72 0.00 0.00 39.33 41.20 1j26 h ASP 101 CO 0.01 0.86 0.61 0.24 -2.88 0.00 0.00 179.24 178.08 1j26 h MET 102 N 0.40 0.75 0.24 0.28 2.86 -0.78 0.15 114.93 118.83 1j26 h MET 102 Ca 0.08 -0.05 -0.33 0.00 -2.06 0.00 0.00 59.70 57.35 1j26 h MET 102 Cb 0.59 -0.17 0.04 0.00 0.06 0.00 0.00 31.60 32.11 1j26 h MET 102 CO 0.03 0.50 -1.43 0.82 1.06 0.00 0.00 176.91 177.90 1j26 h ILE 103 N 0.78 1.30 0.10 -1.22 2.04 -0.86 -3.01 117.51 116.63 1j26 h ILE 103 Ca 0.54 -2.68 -0.00 0.00 1.00 0.00 0.00 64.86 63.72 1j26 h ILE 103 Cb 0.82 3.04 0.00 0.00 -0.74 0.00 0.00 36.82 39.95 1j26 h ILE 103 CO -0.32 0.80 -0.05 0.00 0.00 0.00 0.00 178.15 178.58 1j26 h ALA 104 N 0.15 -0.14 -0.11 1.87 0.00 0.02 0.26 119.26 121.31 1j26 h ALA 104 Ca -0.25 -0.09 -0.09 0.00 0.00 0.00 0.00 54.91 54.48 1j26 h ALA 104 Cb 2.13 0.05 -0.01 0.00 0.00 0.00 0.00 17.79 19.96 1j26 h ALA 104 CO 0.27 -0.51 -0.33 1.05 0.00 0.00 0.00 179.25 179.73 1j26 h GLU 105 N -0.27 0.22 0.00 0.00 4.11 -0.85 -1.34 114.58 116.44 1j26 h GLU 105 Ca -0.01 -0.09 0.00 0.00 0.07 0.00 0.00 59.36 59.33 1j26 h GLU 105 Cb 0.23 -0.01 0.00 0.00 0.50 0.00 0.00 28.75 29.46 1j26 h GLU 105 CO 0.02 0.53 0.00 0.00 0.07 0.00 0.00 179.01 179.63 1j26 h ALA 106 N 1.47 1.00 0.05 1.06 0.00 -1.46 -3.33 119.26 118.06 1j26 h ALA 106 Ca 0.02 0.00 -0.13 0.00 0.00 0.00 0.00 54.91 54.81 1j26 h ALA 106 Cb 0.68 0.00 0.01 0.00 0.00 0.00 0.00 17.79 18.48 1j26 h ALA 106 CO 0.05 0.00 -0.53 1.03 0.00 0.00 0.00 179.25 179.80 1j26 h SER 107 N 0.00 0.37 -3.38 0.00 0.87 0.21 -3.40 113.55 108.22 1j26 h SER 107 Ca 0.00 -0.86 -0.41 0.00 -1.23 0.00 0.00 61.79 59.29 1j26 h SER 107 Cb 0.90 -0.12 0.20 0.00 -0.44 0.00 0.00 62.40 62.94 1j26 h SER 107 CO 0.00 1.20 0.06 -0.83 -0.53 0.00 0.00 176.83 176.73 1j26 s GLY 108 N -4.18 1.53 -1.27 5.77 0.00 -1.00 -4.90 107.32 103.27 1j26 s GLY 108 Ca -0.15 -0.80 -0.16 0.00 0.00 0.00 0.00 44.72 43.61 1j26 s GLY 108 CO 0.79 0.08 1.63 2.56 0.00 0.00 0.00 173.10 178.16 1j26 s PRO 109 N -5.20 4.03 -0.20 2.90 0.04 -1.26 -4.94 135.00 130.36 1j26 s PRO 109 Ca 0.70 -2.22 -0.07 0.00 0.04 0.00 0.00 61.00 59.44 1j26 s PRO 109 Cb -0.13 -5.36 -0.03 0.00 0.04 0.00 0.00 34.50 29.02 1j26 s PRO 109 CO 0.57 -2.07 0.05 -1.12 0.04 0.00 0.00 177.00 174.47 1j26 s SER 110 N 3.70 5.30 -0.24 6.66 0.01 -1.26 -5.08 113.70 122.78 1j26 s SER 110 Ca 0.50 -0.06 -0.03 0.00 1.31 0.00 0.00 55.95 57.67 1j26 s SER 110 Cb 0.01 -1.92 0.11 0.00 0.21 0.00 0.00 66.02 64.43 1j26 s SER 110 CO 0.05 0.10 0.23 -0.94 0.41 0.00 0.00 173.24 173.09 1j26 s SER 111 N 0.81 1.75 0.00 2.44 1.04 -1.26 -5.08 113.70 113.41 1j26 s SER 111 Ca 0.03 -0.52 0.00 0.00 0.48 0.00 0.00 55.95 55.93 1j26 s SER 111 Cb -0.14 0.32 0.00 0.00 0.10 0.00 0.00 66.02 66.30 1j26 s SER 111 CO 0.02 -0.36 0.00 0.61 0.98 0.00 0.00 173.24 174.49