#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1j26 s SER 2 N 0.00 0.06 0.52 1.61 0.01 -1.26 -5.06 113.70 109.59 1j26 s SER 2 Ca 0.00 -0.66 0.32 0.00 1.31 0.00 0.00 55.95 56.92 1j26 s SER 2 Cb 0.00 0.38 1.20 0.00 0.21 0.00 0.00 66.02 67.81 1j26 s SER 2 CO 0.00 -0.78 1.92 0.28 0.41 0.00 0.00 173.24 175.07 1j26 h SER 3 N 2.66 0.00 0.00 2.44 0.02 -2.08 -3.49 113.55 113.10 1j26 h SER 3 Ca -0.33 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.62 1j26 h SER 3 Cb 1.21 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.75 1j26 h SER 3 CO 0.53 0.00 0.00 0.61 -1.14 0.00 0.00 176.83 176.83 1j26 n GLY 4 N 0.20 2.03 1.98 -3.77 0.00 -1.26 -4.85 105.19 99.52 1j26 n GLY 4 Ca 0.01 -0.44 0.00 0.00 0.00 0.00 0.00 46.02 45.59 1j26 n GLY 4 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 1j26 n SER 5 N -0.97 -1.36 -3.68 1.61 2.88 -1.26 -5.10 113.62 105.74 1j26 n SER 5 Ca 0.00 0.30 -0.29 0.00 -1.33 0.00 0.00 58.87 57.55 1j26 n SER 5 Cb 0.00 1.59 0.03 0.00 -0.75 0.00 0.00 64.21 65.08 1j26 n SER 5 CO 0.00 0.00 0.00 -1.20 -1.23 0.00 0.00 175.04 172.61 1j26 n SER 6 N -2.79 -5.39 -0.24 -3.46 7.64 -1.26 -5.03 113.62 103.08 1j26 n SER 6 Ca 0.00 -0.95 0.00 0.00 1.01 0.00 0.00 58.87 58.93 1j26 n SER 6 Cb 0.00 -3.13 0.00 0.00 -1.01 0.00 0.00 64.21 60.07 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 -1.73 1.74 7.00 0.23 0.00 -1.26 -5.06 105.19 106.11 1j26 n GLY 7 Ca -0.12 -1.96 0.00 0.00 0.00 0.00 0.00 46.02 43.94 1j26 n GLY 7 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1j26 n GLU 8 N 0.00 0.00 -2.45 1.61 1.02 -1.26 -4.87 120.64 114.68 1j26 n GLU 8 Ca 0.00 0.00 -0.24 0.00 -0.02 0.00 0.00 57.16 56.90 1j26 n GLU 8 Cb 0.00 0.00 0.09 0.00 -0.02 0.00 0.00 31.44 31.51 1j26 n GLU 8 CO 0.00 0.00 0.00 -3.38 1.18 0.00 0.00 177.13 174.93 1j26 s HIS 9 N 0.00 2.19 0.14 -0.32 -3.43 -1.26 -5.15 115.29 107.46 1j26 s HIS 9 Ca 0.00 0.00 -0.02 0.00 -0.80 0.00 0.00 55.06 54.24 1j26 s HIS 9 Cb 0.00 -3.08 -0.04 0.00 -1.43 0.00 0.00 32.58 28.03 1j26 s HIS 9 CO 0.00 -1.52 0.10 0.00 -2.00 0.00 0.00 174.74 171.31 1j26 s ALA 10 N -3.14 0.74 0.86 -1.38 0.00 -1.26 -5.17 121.76 112.42 1j26 s ALA 10 Ca 0.63 -1.39 -0.10 0.00 0.00 0.00 0.00 51.96 51.10 1j26 s ALA 10 Cb -0.08 0.89 0.11 0.00 0.00 0.00 0.00 23.12 24.05 1j26 s ALA 10 CO 0.44 -0.52 1.13 0.15 0.00 0.00 0.00 175.76 176.96 1j26 s LYS 11 N -4.04 1.46 -0.48 0.00 3.01 -1.26 -4.90 119.74 113.53 1j26 s LYS 11 Ca 0.24 1.45 -0.28 0.00 -1.01 0.00 0.00 55.97 56.37 1j26 s LYS 11 Cb 0.07 -1.79 -0.01 0.00 -1.01 0.00 0.00 37.83 35.09 1j26 s LYS 11 CO 0.02 -2.29 1.76 -0.65 0.51 0.00 0.00 175.35 174.70 1j26 s GLN 12 N -4.68 3.04 0.25 1.68 -0.21 -1.26 -4.92 119.66 113.56 1j26 s GLN 12 Ca 0.65 0.94 -0.10 0.00 0.02 0.00 0.00 55.36 56.88 1j26 s GLN 12 Cb -0.21 -4.26 -0.01 0.00 1.00 0.00 0.00 33.01 29.53 1j26 s GLN 12 CO 0.57 -2.22 0.43 0.00 -2.12 0.00 0.00 175.29 171.94 1j26 s ALA 13 N 7.65 0.11 0.00 6.09 0.00 -1.26 -5.10 121.76 129.25 1j26 s ALA 13 Ca 0.70 -1.09 0.00 0.00 0.00 0.00 0.00 51.96 51.57 1j26 s ALA 13 Cb -0.16 1.13 0.00 0.00 0.00 0.00 0.00 23.12 24.09 1j26 s ALA 13 CO 0.27 -0.81 0.00 -1.13 0.00 0.00 0.00 175.76 174.10 1j26 n SER 14 N -0.51 0.00 0.00 0.00 3.41 -1.26 -4.85 113.62 110.41 1j26 n SER 14 Ca -0.01 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.60 1j26 n SER 14 Cb 0.62 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 64.57 1j26 n SER 14 CO 0.00 0.00 0.00 -1.20 -0.16 0.00 0.00 175.04 173.68 1j26 n SER 15 N -2.34 -1.91 -0.04 4.04 7.64 -1.26 -4.83 113.62 114.92 1j26 n SER 15 Ca 0.00 0.00 -0.21 0.00 1.01 0.00 0.00 58.87 59.67 1j26 n SER 15 Cb 0.00 -1.78 -0.13 0.00 -1.01 0.00 0.00 64.21 61.28 1j26 n SER 15 CO 0.00 0.00 0.00 0.10 -3.01 0.00 0.00 175.04 172.13 1j26 h TYR 16 N 0.00 0.26 -6.00 1.43 -0.00 -2.02 -3.50 116.97 107.14 1j26 h TYR 16 Ca 0.00 -0.19 0.00 0.00 -0.00 0.00 0.00 58.73 58.54 1j26 h TYR 16 Cb 0.24 -0.01 0.00 0.00 -0.00 0.00 0.00 36.73 36.95 1j26 h TYR 16 CO 0.15 1.48 -0.39 -0.89 -0.00 0.00 0.00 178.16 178.51 1j26 n ILE 17 N -4.14 -1.35 -2.63 -0.90 2.08 -1.26 -4.86 119.36 106.30 1j26 n ILE 17 Ca -0.26 0.19 -0.43 0.00 0.56 0.00 0.00 62.75 62.82 1j26 n ILE 17 Cb 0.79 -2.59 -0.02 0.00 -0.75 0.00 0.00 39.64 37.07 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 -0.39 3.64 0.37 0.38 0.04 -1.26 -4.91 135.00 132.87 1j26 s PRO 18 Ca 0.00 0.42 0.04 0.00 0.04 0.00 0.00 61.00 61.50 1j26 s PRO 18 Cb 0.00 -3.94 0.71 0.00 0.04 0.00 0.00 34.50 31.31 1j26 s PRO 18 CO 0.00 -1.43 2.02 -0.07 0.04 0.00 0.00 177.00 177.56 1j26 h LEU 19 N 11.30 0.64 -0.37 -3.56 3.38 -1.94 -2.44 115.31 122.32 1j26 h LEU 19 Ca -0.24 -0.02 0.00 0.00 0.09 0.00 0.00 57.88 57.71 1j26 h LEU 19 Cb 1.06 -0.16 0.00 0.00 0.09 0.00 0.00 40.66 41.65 1j26 h LEU 19 CO 1.13 0.47 0.00 -0.78 0.09 0.00 0.00 178.44 179.35 1j26 h ASP 20 N 0.75 0.00 0.60 -0.43 3.58 -2.03 -1.57 116.42 117.33 1j26 h ASP 20 Ca 0.20 0.00 0.00 0.00 0.42 0.00 0.00 57.03 57.65 1j26 h ASP 20 Cb -0.08 0.00 0.00 0.00 1.72 0.00 0.00 39.33 40.97 1j26 h ASP 20 CO -0.04 0.00 -0.36 0.54 -2.88 0.00 0.00 179.24 176.50 1j26 n ARG 21 N -2.39 0.05 -2.41 0.28 5.12 -0.93 -4.89 116.66 111.50 1j26 n ARG 21 Ca 0.04 -0.03 -0.18 0.00 -1.93 0.00 0.00 57.85 55.75 1j26 n ARG 21 Cb 0.36 -1.50 0.08 0.00 -1.16 0.00 0.00 32.46 30.24 1j26 n ARG 21 CO 0.00 0.00 0.00 1.28 -1.93 0.00 0.00 177.63 176.98 1j26 n LEU 22 N -1.45 0.00 -3.98 0.55 4.77 -0.59 -4.93 117.00 111.37 1j26 n LEU 22 Ca 0.06 -1.90 -0.31 0.00 -0.03 0.00 0.00 56.01 53.84 1j26 n LEU 22 Cb 0.33 -0.47 -0.15 0.00 -2.33 0.00 0.00 43.42 40.81 1j26 n LEU 22 CO 0.32 -0.82 -0.34 -0.55 -1.33 0.00 0.00 177.39 174.67 1j26 s SER 23 N -4.25 4.60 -0.08 -1.43 0.15 0.42 -4.99 113.70 108.12 1j26 s SER 23 Ca 0.54 -1.98 -0.05 0.00 0.70 0.00 0.00 55.95 55.16 1j26 s SER 23 Cb -0.04 -1.49 -0.04 0.00 -1.71 0.00 0.00 66.02 62.75 1j26 s SER 23 CO 0.35 -0.37 0.12 -0.63 1.20 0.00 0.00 173.24 173.92 1j26 s ILE 24 N 1.04 5.23 -0.14 6.45 1.09 -1.26 -0.48 121.20 133.12 1j26 s ILE 24 Ca 0.09 -0.00 -0.04 0.00 -1.10 0.00 0.00 60.65 59.59 1j26 s ILE 24 Cb -0.19 -3.31 0.07 0.00 -1.06 0.00 0.00 42.46 37.97 1j26 s ILE 24 CO -0.10 0.53 0.25 -0.55 -0.10 0.00 0.00 174.94 174.96 1j26 s SER 25 N -1.27 0.60 0.39 3.58 0.15 -0.29 -4.99 113.70 111.86 1j26 s SER 25 Ca 0.18 0.38 -0.23 0.00 0.70 0.00 0.00 55.95 56.98 1j26 s SER 25 Cb -0.12 0.61 -0.10 0.00 -1.71 0.00 0.00 66.02 64.70 1j26 s SER 25 CO 0.08 -0.26 0.97 -0.31 1.20 0.00 0.00 173.24 174.92 1j26 s TYR 26 N 2.39 3.43 0.34 3.44 2.02 -1.26 -0.76 117.35 126.95 1j26 s TYR 26 Ca 0.03 1.68 0.08 0.00 -0.37 0.00 0.00 57.07 58.49 1j26 s TYR 26 Cb -0.13 -2.95 -0.03 0.00 -0.40 0.00 0.00 41.96 38.46 1j26 s TYR 26 CO -0.09 -0.14 0.28 0.00 -1.57 0.00 0.00 175.55 174.04 1j26 h ARG 28 N 0.00 0.14 0.00 0.00 0.11 -1.87 -1.24 114.38 111.51 1j26 h ARG 28 Ca -0.24 -0.04 0.00 0.00 0.10 0.00 0.00 59.98 59.80 1j26 h ARG 28 Cb 1.22 -0.01 0.00 0.00 1.11 0.00 0.00 29.97 32.29 1j26 h ARG 28 CO 0.35 0.37 0.00 -1.13 0.10 0.00 0.00 179.97 179.67 1j26 n SER 29 N -4.21 0.00 0.00 0.08 3.41 -1.26 -4.42 113.62 107.23 1j26 n SER 29 Ca -0.01 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.60 1j26 n SER 29 Cb 0.33 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 64.28 1j26 n SER 29 CO 0.00 0.00 0.00 -0.24 -0.16 0.00 0.00 175.04 174.64 1j26 n SER 30 N 0.00 0.00 -3.95 4.04 2.88 -1.26 -4.92 113.62 110.40 1j26 n SER 30 Ca 0.00 0.00 -0.10 0.00 -1.33 0.00 0.00 58.87 57.44 1j26 n SER 30 Cb 0.00 0.00 -0.11 0.00 -0.75 0.00 0.00 64.21 63.35 1j26 n SER 30 CO 0.00 0.00 0.00 -0.83 -1.23 0.00 0.00 175.04 172.98 1j26 s GLY 31 N -1.18 0.19 0.80 0.46 0.00 -1.26 -5.16 107.32 101.17 1j26 s GLY 31 Ca 0.00 -0.48 -0.11 0.00 0.00 0.00 0.00 44.72 44.14 1j26 s GLY 31 CO 0.00 -0.56 1.10 2.56 0.00 0.00 0.00 173.10 176.20 1j26 s PRO 32 N -1.39 2.00 0.00 2.90 0.04 -1.26 -4.84 135.00 132.45 1j26 s PRO 32 Ca -0.15 1.19 0.00 0.00 0.04 0.00 0.00 61.00 62.08 1j26 s PRO 32 Cb -0.09 -1.87 0.00 0.00 0.04 0.00 0.00 34.50 32.58 1j26 s PRO 32 CO -0.00 -1.83 0.00 0.41 0.04 0.00 0.00 177.00 175.61 1j26 n GLY 33 N -1.01 0.00 2.10 0.56 0.00 -1.26 -5.06 105.19 100.52 1j26 n GLY 33 Ca 0.09 0.00 -0.03 0.00 0.00 0.00 0.00 46.02 46.08 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 -4.32 0.00 -0.02 0.00 -1.26 -5.08 105.19 94.50 1j26 n GLY 34 Ca 0.00 0.83 0.00 0.00 0.00 0.00 0.00 46.02 46.85 1j26 n GLY 34 CO 0.00 0.00 0.00 -0.18 0.00 0.00 0.00 173.32 173.14 1j26 n GLN 35 N 0.98 0.00 0.00 1.61 7.27 -1.26 -5.06 117.38 120.93 1j26 n GLN 35 Ca -0.23 0.00 0.00 0.00 0.07 0.00 0.00 57.00 56.84 1j26 n GLN 35 Cb 0.36 0.00 0.00 0.00 2.41 0.00 0.00 30.24 33.01 1j26 n GLN 35 CO 0.00 0.00 0.00 0.09 0.07 0.00 0.00 177.06 177.22 1j26 n ASN 36 N -0.42 0.04 -2.55 1.69 3.02 -1.26 -5.03 115.26 110.74 1j26 n ASN 36 Ca 0.00 0.00 -0.21 0.00 -0.03 0.00 0.00 54.58 54.34 1j26 n ASN 36 Cb 0.00 0.00 -0.09 0.00 -0.61 0.00 0.00 39.78 39.08 1j26 n ASN 36 CO 0.00 0.00 0.00 0.55 -2.62 0.00 0.00 177.26 175.19 1j26 n VAL 37 N -1.31 0.00 0.00 2.41 3.14 -1.26 -4.85 118.33 116.46 1j26 n VAL 37 Ca 0.00 -0.05 0.00 0.00 -2.96 0.00 0.00 64.34 61.33 1j26 n VAL 37 Cb 0.00 -0.23 0.00 0.00 -1.06 0.00 0.00 33.84 32.55 1j26 n VAL 37 CO 0.00 0.00 0.00 0.59 -6.46 0.00 0.00 176.83 170.96 1j26 n ASN 38 N 5.43 0.00 0.00 6.55 3.02 -1.26 -4.95 115.26 124.05 1j26 n ASN 38 Ca 0.38 0.16 0.00 0.00 -0.03 0.00 0.00 54.58 55.08 1j26 n ASN 38 Cb 0.03 -0.28 0.00 0.00 -0.61 0.00 0.00 39.78 38.92 1j26 n ASN 38 CO 0.00 0.00 0.00 0.29 -2.62 0.00 0.00 177.26 174.93 1j26 n LYS 39 N -1.67 0.00 0.45 3.52 5.02 -1.26 -5.03 118.16 119.19 1j26 n LYS 39 Ca 0.00 0.00 -0.18 0.00 -2.02 0.00 0.00 58.31 56.11 1j26 n LYS 39 Cb 0.00 0.00 -0.09 0.00 -0.02 0.00 0.00 35.03 34.92 1j26 n LYS 39 CO 0.00 0.00 0.00 0.28 -0.52 0.00 0.00 177.40 177.16 1j26 h VAL 40 N 0.00 0.00 0.00 -0.18 2.07 -1.98 -3.45 116.25 112.71 1j26 h VAL 40 Ca 0.00 -0.10 0.00 0.00 0.82 0.00 0.00 66.70 67.42 1j26 h VAL 40 Cb 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 31.29 29.77 1j26 h VAL 40 CO 0.00 0.00 0.00 0.59 0.02 0.00 0.00 177.57 178.18 1j26 n ASN 41 N -5.40 0.00 -3.60 0.57 4.13 -1.26 -4.70 115.26 105.00 1j26 n ASN 41 Ca -0.14 0.00 -0.25 0.00 1.68 0.00 0.00 54.58 55.87 1j26 n ASN 41 Cb 0.46 0.00 0.03 0.00 -1.54 0.00 0.00 39.78 38.73 1j26 n ASN 41 CO 0.00 0.00 0.00 -1.20 0.28 0.00 0.00 177.26 176.34 1j26 n SER 42 N 0.11 -5.68 -4.78 6.41 7.64 -1.26 -4.50 113.62 111.56 1j26 n SER 42 Ca 0.00 -0.84 -0.34 0.00 1.01 0.00 0.00 58.87 58.70 1j26 n SER 42 Cb 0.00 -3.34 0.02 0.00 -1.01 0.00 0.00 64.21 59.87 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 -5.23 3.16 -0.11 1.43 2.36 -0.47 -4.81 119.74 116.07 1j26 s LYS 43 Ca 0.29 1.45 0.00 0.00 -2.55 0.00 0.00 55.97 55.17 1j26 s LYS 43 Cb -0.10 -1.99 0.02 0.00 -1.05 0.00 0.00 37.83 34.70 1j26 s LYS 43 CO 0.85 -0.97 -0.10 0.00 1.55 0.00 0.00 175.35 176.68 1j26 s ALA 44 N -2.10 1.40 0.08 3.13 0.00 -1.18 -1.42 121.76 121.67 1j26 s ALA 44 Ca 0.69 -0.58 0.03 0.00 0.00 0.00 0.00 51.96 52.10 1j26 s ALA 44 Cb -0.21 -0.85 -0.04 0.00 0.00 0.00 0.00 23.12 22.02 1j26 s ALA 44 CO 0.33 -0.28 0.08 -2.00 0.00 0.00 0.00 175.76 173.89 1j26 s GLU 45 N 1.42 2.90 -0.04 0.00 2.12 0.06 -1.39 118.70 123.76 1j26 s GLU 45 Ca 0.00 -0.68 0.00 0.00 0.36 0.00 0.00 54.97 54.66 1j26 s GLU 45 Cb -0.13 -2.74 0.02 0.00 0.26 0.00 0.00 34.13 31.54 1j26 s GLU 45 CO -0.06 0.57 -0.02 0.08 -0.54 0.00 0.00 175.26 175.29 1j26 s VAL 46 N -1.38 0.39 0.05 3.70 1.01 -0.72 -1.14 120.40 122.31 1j26 s VAL 46 Ca 0.29 -0.01 0.08 0.00 0.00 0.00 0.00 61.98 62.34 1j26 s VAL 46 Cb -0.12 -0.46 -0.03 0.00 0.00 0.00 0.00 36.38 35.76 1j26 s VAL 46 CO 0.22 0.21 -0.20 -0.60 0.00 0.00 0.00 175.10 174.72 1j26 s ARG 47 N 1.16 1.96 -0.12 2.72 3.52 0.36 -1.92 118.95 126.63 1j26 s ARG 47 Ca -0.08 -1.04 -0.11 0.00 -0.13 0.00 0.00 55.73 54.38 1j26 s ARG 47 Cb -0.14 -2.13 0.03 0.00 -1.56 0.00 0.00 34.95 31.16 1j26 s ARG 47 CO -0.01 0.53 0.32 -0.59 -0.81 0.00 0.00 175.30 174.73 1j26 s PHE 48 N -0.93 -0.36 -0.42 5.12 -0.71 -0.20 -0.43 117.98 120.05 1j26 s PHE 48 Ca 0.14 0.86 -0.27 0.00 -1.04 0.00 0.00 56.93 56.63 1j26 s PHE 48 Cb -0.10 0.12 -0.06 0.00 -1.21 0.00 0.00 43.02 41.76 1j26 s PHE 48 CO 0.05 -0.18 2.36 -1.58 -1.34 0.00 0.00 175.22 174.53 1j26 s HIS 49 N 0.28 1.09 0.24 3.49 5.65 -1.26 -0.65 115.29 124.14 1j26 s HIS 49 Ca -0.01 1.29 -0.06 0.00 0.25 0.00 0.00 55.06 56.53 1j26 s HIS 49 Cb -0.03 -3.67 0.31 0.00 -1.18 0.00 0.00 32.58 28.00 1j26 s HIS 49 CO -0.01 -2.96 1.87 1.25 -0.65 0.00 0.00 174.74 174.24 1j26 h LEU 50 N 18.40 0.91 -1.24 8.88 7.12 -1.79 -1.69 115.31 145.91 1j26 h LEU 50 Ca -0.29 0.00 -0.05 0.00 0.13 0.00 0.00 57.88 57.68 1j26 h LEU 50 Cb 1.26 -0.19 -0.02 0.00 -0.53 0.00 0.00 40.66 41.18 1j26 h LEU 50 CO 1.10 0.61 0.02 0.00 -0.13 0.00 0.00 178.44 180.04 1j26 h ALA 51 N 1.39 1.38 0.00 1.25 0.00 -1.89 -1.33 119.26 120.06 1j26 h ALA 51 Ca 0.37 -0.19 0.00 0.00 0.00 0.00 0.00 54.91 55.09 1j26 h ALA 51 Cb 0.08 -0.15 0.00 0.00 0.00 0.00 0.00 17.79 17.72 1j26 h ALA 51 CO -0.14 0.43 0.00 0.45 0.00 0.00 0.00 179.25 179.99 1j26 n SER 52 N -4.29 0.10 -4.21 0.00 2.88 -0.66 -4.61 113.62 102.83 1j26 n SER 52 Ca 0.02 0.52 -0.41 0.00 -1.33 0.00 0.00 58.87 57.66 1j26 n SER 52 Cb 0.23 -0.54 -0.01 0.00 -0.75 0.00 0.00 64.21 63.14 1j26 n SER 52 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 1j26 n ALA 53 N -1.54 4.07 0.25 -1.46 0.00 -0.50 -4.73 120.51 116.59 1j26 n ALA 53 Ca 0.05 -3.74 0.16 0.00 0.00 0.00 0.00 53.44 49.91 1j26 n ALA 53 Cb 0.24 -3.57 0.88 0.00 0.00 0.00 0.00 19.45 16.99 1j26 n ALA 53 CO 0.00 0.00 0.00 -0.44 0.00 0.00 0.00 177.50 177.06 1j26 h ASP 54 N 7.25 0.00 0.61 0.00 3.32 -1.86 -0.11 116.42 125.63 1j26 h ASP 54 Ca 0.47 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.52 1j26 h ASP 54 Cb 0.78 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.33 1j26 h ASP 54 CO 1.63 0.00 0.00 -2.67 -1.72 0.00 0.00 179.24 176.48 1j26 n TRP 55 N -3.79 0.00 -3.79 4.55 4.27 -1.26 -4.61 117.44 112.82 1j26 n TRP 55 Ca -0.00 0.00 -0.35 0.00 -3.89 0.00 0.00 57.50 53.26 1j26 n TRP 55 Cb 0.22 -0.47 -0.05 0.00 -1.36 0.00 0.00 31.31 29.65 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 -2.94 5.34 0.31 -1.67 1.01 -0.05 -5.09 121.20 118.11 1j26 s ILE 56 Ca 0.10 0.15 -0.29 0.00 0.00 0.00 0.00 60.65 60.62 1j26 s ILE 56 Cb 0.12 -3.54 -0.10 0.00 0.01 0.00 0.00 42.46 38.95 1j26 s ILE 56 CO 0.34 0.40 1.34 -1.61 0.00 0.00 0.00 174.94 175.41 1j26 s GLU 57 N -1.65 4.32 0.28 2.79 2.02 -1.26 -4.82 118.70 120.37 1j26 s GLU 57 Ca 0.26 2.25 -0.02 0.00 0.02 0.00 0.00 54.97 57.47 1j26 s GLU 57 Cb -0.13 -3.07 0.60 0.00 0.10 0.00 0.00 34.13 31.62 1j26 s GLU 57 CO 0.15 -0.26 1.61 1.49 0.02 0.00 0.00 175.26 178.26 1j26 h GLU 58 N 3.72 0.07 0.00 1.61 4.57 -1.93 0.12 114.58 122.75 1j26 h GLU 58 Ca -0.48 -0.00 0.00 0.00 -1.18 0.00 0.00 59.36 57.69 1j26 h GLU 58 Cb 1.23 -0.02 0.00 0.00 -0.16 0.00 0.00 28.75 29.80 1j26 h GLU 58 CO 0.68 0.05 0.00 -1.00 -1.18 0.00 0.00 179.01 177.56 1j26 h PRO 59 N 0.07 0.00 0.09 0.92 0.13 -1.92 -3.04 132.00 128.25 1j26 h PRO 59 Ca 0.51 0.00 -0.36 0.00 -0.87 0.00 0.00 66.00 65.28 1j26 h PRO 59 Cb 0.97 0.00 -0.03 0.00 0.13 0.00 0.00 31.00 32.08 1j26 h PRO 59 CO -0.79 0.00 -2.03 0.28 -0.23 0.00 0.00 178.00 175.23 1j26 n VAL 60 N -2.78 1.71 0.11 1.56 0.31 0.07 -3.56 118.33 115.75 1j26 n VAL 60 Ca 0.01 -0.67 -0.15 0.00 -0.01 0.00 0.00 64.34 63.53 1j26 n VAL 60 Cb 0.30 -1.56 -0.08 0.00 -0.91 0.00 0.00 33.84 31.59 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 0.05 -0.65 0.00 5.55 3.08 -0.75 -1.47 114.38 120.19 1j26 h ARG 61 Ca -0.43 0.04 -0.03 0.00 0.07 0.00 0.00 59.98 59.63 1j26 h ARG 61 Cb 2.02 0.15 -0.00 0.00 0.08 0.00 0.00 29.97 32.21 1j26 h ARG 61 CO 0.06 -0.43 -0.16 -0.56 -1.07 0.00 0.00 179.97 177.81 1j26 h GLN 62 N -0.67 0.00 0.66 0.04 3.07 -1.74 -1.95 115.11 114.52 1j26 h GLN 62 Ca 0.02 0.00 -0.03 0.00 0.09 0.00 0.00 58.65 58.72 1j26 h GLN 62 Cb 0.70 0.00 0.01 0.00 0.08 0.00 0.00 27.48 28.27 1j26 h GLN 62 CO -0.26 0.16 -0.32 -0.22 0.09 0.00 0.00 178.83 178.28 1j26 h LYS 63 N 0.00 -0.86 -1.05 0.06 1.63 -1.34 -2.76 116.57 112.25 1j26 h LYS 63 Ca -0.00 0.06 0.28 0.00 -0.85 0.00 0.00 60.65 60.14 1j26 h LYS 63 Cb 0.29 0.20 -0.07 0.00 -0.60 0.00 0.00 32.23 32.05 1j26 h LYS 63 CO 0.02 -0.57 0.71 0.82 -3.45 0.00 0.00 179.45 176.97 1j26 h ILE 64 N -0.95 0.51 -0.10 2.00 5.03 -1.20 0.57 117.51 123.37 1j26 h ILE 64 Ca -0.09 -0.09 -0.03 0.00 -0.12 0.00 0.00 64.86 64.53 1j26 h ILE 64 Cb 0.68 0.23 -0.01 0.00 -3.03 0.00 0.00 36.82 34.70 1j26 h ILE 64 CO 0.15 0.05 -0.08 0.00 -0.68 0.00 0.00 178.15 177.59 1j26 h ALA 65 N 1.56 1.69 0.00 1.87 0.00 -1.12 -2.31 119.26 120.95 1j26 h ALA 65 Ca 0.56 -0.13 -0.00 0.00 0.00 0.00 0.00 54.91 55.34 1j26 h ALA 65 Cb 1.70 -0.06 -0.00 0.00 0.00 0.00 0.00 17.79 19.43 1j26 h ALA 65 CO -0.19 0.23 -0.93 1.28 0.00 0.00 0.00 179.25 179.65 1j26 n LEU 66 N -4.36 1.88 -0.18 0.00 4.77 0.23 -4.03 117.00 115.30 1j26 n LEU 66 Ca -0.01 0.32 -0.02 0.00 -0.03 0.00 0.00 56.01 56.26 1j26 n LEU 66 Cb 0.20 -0.71 0.20 0.00 -2.33 0.00 0.00 43.42 40.78 1j26 n LEU 66 CO 0.36 -0.31 1.08 0.74 -1.33 0.00 0.00 177.39 177.93 1j26 h THR 67 N -0.92 1.22 -0.24 -5.08 2.02 -0.09 -2.11 112.91 107.71 1j26 h THR 67 Ca -0.00 -0.66 -0.15 0.00 0.77 0.00 0.00 66.41 66.37 1j26 h THR 67 Cb 0.92 0.43 -0.11 0.00 -1.74 0.00 0.00 68.15 67.65 1j26 h THR 67 CO -0.00 0.27 -0.42 1.41 0.37 0.00 0.00 175.52 177.14 1j26 n HIS 68 N -4.33 0.81 -0.26 3.16 8.25 -0.88 -4.72 115.22 117.26 1j26 n HIS 68 Ca 0.06 -1.69 0.13 0.00 -0.26 0.00 0.00 57.72 55.97 1j26 n HIS 68 Cb 0.15 -0.35 0.41 0.00 1.12 0.00 0.00 29.99 31.32 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 1.22 0.61 0.00 -0.41 3.64 -1.30 0.14 116.57 120.46 1j26 h LYS 69 Ca 0.13 -0.04 0.00 0.00 -1.27 0.00 0.00 60.65 59.48 1j26 h LYS 69 Cb 1.26 -0.14 0.00 0.00 -0.41 0.00 0.00 32.23 32.94 1j26 h LYS 69 CO 0.26 0.40 0.00 -0.97 -2.27 0.00 0.00 179.45 176.87 1j26 h ASN 70 N 0.63 0.00 0.33 4.20 -0.00 -1.84 -2.24 115.58 116.66 1j26 h ASN 70 Ca 0.45 0.00 -0.32 0.00 -0.00 0.00 0.00 56.30 56.43 1j26 h ASN 70 Cb 0.81 0.00 -0.05 0.00 -0.00 0.00 0.00 38.32 39.08 1j26 h ASN 70 CO -0.20 0.00 -1.90 0.29 -0.00 0.00 0.00 177.43 175.61 1j26 n LYS 71 N -2.72 0.66 -2.05 6.67 5.02 0.41 -4.85 118.16 121.30 1j26 n LYS 71 Ca -0.01 0.23 -0.39 0.00 -2.02 0.00 0.00 58.31 56.12 1j26 n LYS 71 Cb 0.12 -1.72 0.00 0.00 -0.02 0.00 0.00 35.03 33.41 1j26 n LYS 71 CO 0.00 0.00 0.00 0.42 -0.52 0.00 0.00 177.40 177.30 1j26 s ILE 72 N -2.57 2.61 -0.00 -0.18 1.01 -0.79 -2.64 121.20 118.64 1j26 s ILE 72 Ca -0.09 0.53 -0.06 0.00 0.00 0.00 0.00 60.65 61.02 1j26 s ILE 72 Cb 0.07 -3.30 -0.04 0.00 0.01 0.00 0.00 42.46 39.21 1j26 s ILE 72 CO 0.81 0.06 0.63 -0.55 0.00 0.00 0.00 174.94 175.89 1j26 h ASN 73 N 2.44 -0.19 0.00 3.58 7.08 -1.57 -3.48 115.58 123.44 1j26 h ASN 73 Ca -0.50 0.01 0.00 0.00 -3.08 0.00 0.00 56.30 52.73 1j26 h ASN 73 Cb 1.25 0.05 0.00 0.00 -2.08 0.00 0.00 38.32 37.54 1j26 h ASN 73 CO 0.62 -0.07 0.00 1.17 -2.08 0.00 0.00 177.43 177.07 1j26 n LYS 74 N -3.01 0.00 0.00 4.14 0.00 -1.26 -4.97 118.16 113.06 1j26 n LYS 74 Ca -0.03 0.00 0.10 0.00 0.00 0.00 0.00 58.31 58.38 1j26 n LYS 74 Cb 0.09 0.00 0.59 0.00 0.00 0.00 0.00 35.03 35.71 1j26 n LYS 74 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.40 177.40 1j26 n ALA 75 N -1.89 2.22 -0.43 3.14 0.00 -1.26 -4.82 120.51 117.47 1j26 n ALA 75 Ca 0.00 -0.12 0.00 0.00 0.00 0.00 0.00 53.44 53.32 1j26 n ALA 75 Cb 0.00 -1.34 0.00 0.00 0.00 0.00 0.00 19.45 18.11 1j26 n ALA 75 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1j26 n GLY 76 N 0.33 0.72 3.66 0.00 0.00 -1.26 -5.01 105.19 103.63 1j26 n GLY 76 Ca 0.14 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.74 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 -0.57 4.28 -0.22 1.61 2.02 -1.26 -2.17 118.70 122.39 1j26 s GLU 77 Ca 0.00 1.18 -0.29 0.00 0.02 0.00 0.00 54.97 55.89 1j26 s GLU 77 Cb 0.00 -3.60 0.01 0.00 0.10 0.00 0.00 34.13 30.63 1j26 s GLU 77 CO 0.00 -0.46 1.01 -1.17 0.02 0.00 0.00 175.26 174.66 1j26 s LEU 78 N 2.62 4.11 -0.10 1.80 2.96 0.18 -1.65 118.68 128.59 1j26 s LEU 78 Ca 0.41 1.35 0.02 0.00 -0.22 0.00 0.00 54.13 55.69 1j26 s LEU 78 Cb -0.16 -3.50 0.02 0.00 0.50 0.00 0.00 46.19 43.04 1j26 s LEU 78 CO 0.10 -0.64 -0.14 0.54 -1.32 0.00 0.00 176.35 174.90 1j26 s VAL 79 N 3.08 1.37 0.20 1.68 0.11 -1.08 -1.04 120.40 124.73 1j26 s VAL 79 Ca 0.43 -0.57 0.03 0.00 -2.93 0.00 0.00 61.98 58.94 1j26 s VAL 79 Cb -0.15 -1.27 -0.05 0.00 -1.53 0.00 0.00 36.38 33.38 1j26 s VAL 79 CO 0.07 0.42 -0.02 -1.48 -3.33 0.00 0.00 175.10 170.76 1j26 s LEU 80 N 1.00 2.22 0.14 2.54 2.34 -0.81 -4.72 118.68 121.39 1j26 s LEU 80 Ca -0.07 -1.17 0.07 0.00 0.06 0.00 0.00 54.13 53.02 1j26 s LEU 80 Cb -0.15 -0.22 -0.04 0.00 -0.56 0.00 0.00 46.19 45.22 1j26 s LEU 80 CO -0.01 -0.50 -0.16 0.42 -1.06 0.00 0.00 176.35 175.04 1j26 s THR 81 N -3.48 1.55 -0.12 5.48 -4.23 -1.26 -1.75 115.64 111.83 1j26 s THR 81 Ca 0.25 -1.83 -0.04 0.00 -1.18 0.00 0.00 61.69 58.90 1j26 s THR 81 Cb 0.05 -1.69 0.06 0.00 1.34 0.00 0.00 72.50 72.26 1j26 s THR 81 CO 0.06 -0.39 0.16 -0.94 -0.54 0.00 0.00 174.62 172.98 1j26 s SER 82 N -2.59 1.10 -0.14 3.99 1.04 -0.49 -4.92 113.70 111.69 1j26 s SER 82 Ca 0.12 0.08 -0.04 0.00 0.48 0.00 0.00 55.95 56.60 1j26 s SER 82 Cb -0.05 0.22 0.07 0.00 0.10 0.00 0.00 66.02 66.36 1j26 s SER 82 CO 0.05 -0.28 0.19 -1.83 0.98 0.00 0.00 173.24 172.35 1j26 s GLU 83 N 2.28 0.11 0.00 4.02 4.04 -1.26 -3.09 118.70 124.80 1j26 s GLU 83 Ca 0.04 0.38 0.00 0.00 0.04 0.00 0.00 54.97 55.43 1j26 s GLU 83 Cb -0.13 -0.76 0.00 0.00 0.02 0.00 0.00 34.13 33.25 1j26 s GLU 83 CO -0.07 -0.48 0.18 0.43 -1.84 0.00 0.00 175.26 173.47 1j26 n SER 84 N 5.32 0.00 -3.76 0.83 7.64 -1.26 -5.05 113.62 117.34 1j26 n SER 84 Ca -0.05 -1.02 -0.11 0.00 1.01 0.00 0.00 58.87 58.70 1j26 n SER 84 Cb 0.50 -0.00 -0.05 0.00 -1.01 0.00 0.00 64.21 63.64 1j26 n SER 84 CO 0.00 0.00 0.00 -0.94 -3.01 0.00 0.00 175.04 171.09 1j26 s SER 85 N -0.02 0.20 0.13 6.43 1.04 -1.26 -5.06 113.70 115.15 1j26 s SER 85 Ca 0.00 -1.13 0.27 0.00 0.48 0.00 0.00 55.95 55.57 1j26 s SER 85 Cb 0.00 0.60 0.86 0.00 0.10 0.00 0.00 66.02 67.58 1j26 s SER 85 CO 0.00 -1.19 1.74 -2.11 0.98 0.00 0.00 173.24 172.67 1j26 n ARG 86 N -0.43 0.18 -1.62 4.02 -4.01 -1.26 -4.35 116.66 109.18 1j26 n ARG 86 Ca -0.01 0.13 -0.28 0.00 -1.04 0.00 0.00 57.85 56.64 1j26 n ARG 86 Cb 0.62 -1.69 0.21 0.00 -3.04 0.00 0.00 32.46 28.56 1j26 n ARG 86 CO 0.00 0.00 0.00 0.66 -3.04 0.00 0.00 177.63 175.25 1j26 n TYR 87 N -1.98 -3.97 0.00 2.89 4.01 -1.26 -4.68 117.16 112.17 1j26 n TYR 87 Ca 0.06 -1.08 0.00 0.00 -0.16 0.00 0.00 57.90 56.72 1j26 n TYR 87 Cb 0.40 -1.01 0.00 0.00 -0.31 0.00 0.00 39.34 38.42 1j26 n TYR 87 CO 0.00 0.00 0.00 1.04 -0.46 0.00 0.00 176.86 177.44 1j26 n GLN 88 N -3.93 0.00 0.25 -0.72 1.13 -1.26 -4.54 117.38 108.31 1j26 n GLN 88 Ca 0.16 0.03 0.12 0.00 -1.94 0.00 0.00 57.00 55.37 1j26 n GLN 88 Cb 0.55 -0.37 0.76 0.00 0.11 0.00 0.00 30.24 31.29 1j26 n GLN 88 CO 0.00 0.00 0.00 0.35 -1.44 0.00 0.00 177.06 175.97 1j26 h PHE 89 N 0.00 0.00 0.32 1.08 3.57 -1.97 -2.40 116.94 117.54 1j26 h PHE 89 Ca 0.00 0.00 -0.01 0.00 3.53 0.00 0.00 57.97 61.49 1j26 h PHE 89 Cb 0.00 0.00 -0.00 0.00 2.79 0.00 0.00 35.95 38.74 1j26 h PHE 89 CO 0.00 0.00 -0.19 -0.09 -2.23 0.00 0.00 178.31 175.80 1j26 h ARG 90 N 0.00 -0.47 -0.35 1.11 9.65 -1.99 0.39 114.38 122.72 1j26 h ARG 90 Ca 0.03 0.03 -0.02 0.00 -1.10 0.00 0.00 59.98 58.91 1j26 h ARG 90 Cb 0.12 0.11 -0.02 0.00 -1.39 0.00 0.00 29.97 28.79 1j26 h ARG 90 CO -0.00 -0.31 0.13 -0.91 2.80 0.00 0.00 179.97 181.68 1j26 h ASN 91 N -0.48 0.50 -0.91 -3.80 2.35 -1.68 -2.70 115.58 108.86 1j26 h ASN 91 Ca -0.04 -0.18 0.01 0.00 -0.55 0.00 0.00 56.30 55.54 1j26 h ASN 91 Cb 0.39 -0.13 -0.05 0.00 0.05 0.00 0.00 38.32 38.59 1j26 h ASN 91 CO 0.05 0.55 0.61 0.25 -1.65 0.00 0.00 177.43 177.23 1j26 h LEU 92 N 0.42 1.05 -1.60 1.61 7.12 -1.34 -2.60 115.31 119.97 1j26 h LEU 92 Ca 0.12 -0.03 -0.03 0.00 0.13 0.00 0.00 57.88 58.07 1j26 h LEU 92 Cb 0.21 -0.26 -0.01 0.00 -0.53 0.00 0.00 40.66 40.07 1j26 h LEU 92 CO -0.01 0.76 -0.02 0.00 -0.13 0.00 0.00 178.44 179.04 1j26 h ALA 93 N 1.34 1.68 -0.55 1.25 0.00 0.10 -1.07 119.26 122.00 1j26 h ALA 93 Ca 0.33 -0.12 -0.11 0.00 0.00 0.00 0.00 54.91 55.02 1j26 h ALA 93 Cb -0.14 -0.08 -0.02 0.00 0.00 0.00 0.00 17.79 17.55 1j26 h ALA 93 CO -0.07 0.24 -0.10 1.49 0.00 0.00 0.00 179.25 180.81 1j26 h GLU 94 N 0.23 1.04 -0.32 0.00 4.81 -1.24 0.12 114.58 119.21 1j26 h GLU 94 Ca 0.05 -0.38 0.06 0.00 -0.13 0.00 0.00 59.36 58.96 1j26 h GLU 94 Cb 0.19 -0.07 -0.06 0.00 0.63 0.00 0.00 28.75 29.44 1j26 h GLU 94 CO 0.01 1.07 -0.03 0.00 -0.73 0.00 0.00 179.01 179.32 1j26 h LEU 96 N 0.05 0.00 -0.26 0.00 3.38 -1.14 -1.35 115.31 115.99 1j26 h LEU 96 Ca 0.15 0.00 -0.11 0.00 0.09 0.00 0.00 57.88 58.01 1j26 h LEU 96 Cb 0.22 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 40.97 1j26 h LEU 96 CO -0.29 0.26 -0.26 -0.61 0.09 0.00 0.00 178.44 177.63 1j26 h GLN 97 N 0.00 0.64 -0.20 1.13 5.75 0.47 -2.37 115.11 120.53 1j26 h GLN 97 Ca -0.00 -0.34 -0.02 0.00 -0.15 0.00 0.00 58.65 58.13 1j26 h GLN 97 Cb 0.47 0.01 -0.01 0.00 1.07 0.00 0.00 27.48 29.02 1j26 h GLN 97 CO 0.03 0.94 0.03 0.87 -2.65 0.00 0.00 178.83 178.06 1j26 h LYS 98 N 0.36 0.34 -0.84 1.69 1.57 -0.62 -2.24 116.57 116.83 1j26 h LYS 98 Ca 0.04 -0.09 0.20 0.00 -1.87 0.00 0.00 60.65 58.93 1j26 h LYS 98 Cb 0.83 -0.04 -0.15 0.00 0.08 0.00 0.00 32.23 32.94 1j26 h LYS 98 CO 0.07 0.49 -0.06 0.82 -0.57 0.00 0.00 179.45 180.20 1j26 h ILE 99 N 0.14 0.20 -0.07 1.86 2.04 -1.21 0.31 117.51 120.77 1j26 h ILE 99 Ca 0.06 -0.02 0.00 0.00 1.00 0.00 0.00 64.86 65.91 1j26 h ILE 99 Cb 0.31 0.15 -0.00 0.00 -0.74 0.00 0.00 36.82 36.54 1j26 h ILE 99 CO 0.00 0.01 0.05 0.03 0.00 0.00 0.00 178.15 178.24 1j26 h ARG 100 N 0.05 0.10 -0.15 2.37 3.08 -0.94 -1.91 114.38 116.98 1j26 h ARG 100 Ca 0.46 -0.01 -0.01 0.00 0.07 0.00 0.00 59.98 60.49 1j26 h ARG 100 Cb 0.81 -0.02 -0.01 0.00 0.08 0.00 0.00 29.97 30.83 1j26 h ARG 100 CO -0.80 0.06 0.06 -0.44 -1.07 0.00 0.00 179.97 177.79 1j26 h ASP 101 N 0.10 0.20 -0.25 7.04 3.32 -0.37 0.17 116.42 126.63 1j26 h ASP 101 Ca 0.03 -0.16 0.07 0.00 0.02 0.00 0.00 57.03 56.99 1j26 h ASP 101 Cb -0.01 -0.05 -0.01 0.00 0.22 0.00 0.00 39.33 39.48 1j26 h ASP 101 CO -0.01 0.31 0.18 0.24 -1.72 0.00 0.00 179.24 178.25 1j26 h MET 102 N 0.08 0.00 0.21 3.56 2.86 -0.44 -0.17 114.93 121.04 1j26 h MET 102 Ca 0.05 0.00 -0.31 0.00 -2.06 0.00 0.00 59.70 57.38 1j26 h MET 102 Cb 0.17 0.00 0.03 0.00 0.06 0.00 0.00 31.60 31.86 1j26 h MET 102 CO -0.00 0.00 -1.43 0.82 1.06 0.00 0.00 176.91 177.35 1j26 h ILE 103 N 0.00 1.22 0.09 -1.22 2.04 -0.80 -3.25 117.51 115.60 1j26 h ILE 103 Ca 0.12 -2.61 -0.00 0.00 1.00 0.00 0.00 64.86 63.37 1j26 h ILE 103 Cb 0.48 2.98 0.00 0.00 -0.74 0.00 0.00 36.82 39.55 1j26 h ILE 103 CO -0.00 0.80 -0.05 0.00 0.00 0.00 0.00 178.15 178.90 1j26 h ALA 104 N 0.11 -0.13 0.00 1.87 0.00 0.60 -1.03 119.26 120.69 1j26 h ALA 104 Ca -0.26 -0.08 -0.01 0.00 0.00 0.00 0.00 54.91 54.56 1j26 h ALA 104 Cb 2.04 0.05 -0.00 0.00 0.00 0.00 0.00 17.79 19.88 1j26 h ALA 104 CO 0.22 -0.52 -0.03 1.05 0.00 0.00 0.00 179.25 179.97 1j26 h GLU 105 N -0.24 0.00 0.00 0.00 4.11 -1.26 -0.75 114.58 116.45 1j26 h GLU 105 Ca -0.01 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.42 1j26 h GLU 105 Cb 0.19 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.44 1j26 h GLU 105 CO 0.02 0.03 -0.51 0.00 0.07 0.00 0.00 179.01 178.62 1j26 n ALA 106 N -2.12 3.37 0.22 1.06 0.00 -0.98 -3.62 120.51 118.44 1j26 n ALA 106 Ca -0.01 -0.32 0.03 0.00 0.00 0.00 0.00 53.44 53.15 1j26 n ALA 106 Cb 0.25 -1.14 0.04 0.00 0.00 0.00 0.00 19.45 18.59 1j26 n ALA 106 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 1j26 n SER 107 N -1.62 1.71 0.00 0.00 2.88 -0.41 -4.27 113.62 111.91 1j26 n SER 107 Ca 0.05 -1.39 0.00 0.00 -1.33 0.00 0.00 58.87 56.20 1j26 n SER 107 Cb 0.36 -0.02 0.00 0.00 -0.75 0.00 0.00 64.21 63.79 1j26 n SER 107 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 1j26 n GLY 108 N 0.33 4.21 3.62 0.46 0.00 -0.47 -5.04 105.19 108.31 1j26 n GLY 108 Ca 0.04 -0.99 -0.43 0.00 0.00 0.00 0.00 46.02 44.65 1j26 n GLY 108 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1j26 s PRO 109 N 1.36 3.71 0.47 1.61 0.04 -1.26 -4.86 135.00 136.07 1j26 s PRO 109 Ca 0.00 1.65 0.21 0.00 0.04 0.00 0.00 61.00 62.90 1j26 s PRO 109 Cb 0.00 -4.07 1.21 0.00 0.04 0.00 0.00 34.50 31.68 1j26 s PRO 109 CO 0.00 -1.40 1.93 0.77 0.04 0.00 0.00 177.00 178.34 1j26 h SER 110 N 11.17 0.23 -3.57 6.66 0.02 -1.93 -3.09 113.55 123.04 1j26 h SER 110 Ca -0.34 0.02 -0.60 0.00 -0.84 0.00 0.00 61.79 60.02 1j26 h SER 110 Cb 1.16 -0.03 -0.38 0.00 0.14 0.00 0.00 62.40 63.29 1j26 h SER 110 CO 1.00 0.11 -0.79 -0.44 -1.14 0.00 0.00 176.83 175.58 1j26 s SER 111 N -5.95 3.66 0.00 3.07 0.01 -1.26 -4.98 113.70 108.25 1j26 s SER 111 Ca -0.07 -1.07 0.00 0.00 1.31 0.00 0.00 55.95 56.12 1j26 s SER 111 Cb 0.21 -1.15 0.00 0.00 0.21 0.00 0.00 66.02 65.29 1j26 s SER 111 CO 0.76 -0.22 0.00 0.61 0.41 0.00 0.00 173.24 174.80