#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 4.00 0.14 1.61 0.01 -1.26 -5.09 113.70 113.11 1j26 s SER 2 Ca 0.00 -1.35 -0.18 0.00 1.31 0.00 0.00 55.95 55.73 1j26 s SER 2 Cb 0.00 -1.21 0.04 0.00 0.21 0.00 0.00 66.02 65.06 1j26 s SER 2 CO 0.00 -0.27 0.47 -0.44 0.41 0.00 0.00 173.24 173.40 1j26 s SER 3 N 1.35 -0.32 0.00 2.44 0.01 -1.26 -5.15 113.70 110.77 1j26 s SER 3 Ca -0.02 -0.26 0.00 0.00 1.31 0.00 0.00 55.95 56.98 1j26 s SER 3 Cb -0.19 0.52 0.00 0.00 0.21 0.00 0.00 66.02 66.56 1j26 s SER 3 CO -0.08 -0.91 0.00 0.61 0.41 0.00 0.00 173.24 173.27 1j26 n GLY 4 N -0.28 2.91 2.57 3.44 0.00 -1.26 -5.13 105.19 107.45 1j26 n GLY 4 Ca -0.15 -0.18 -0.14 0.00 0.00 0.00 0.00 46.02 45.54 1j26 n GLY 4 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1j26 n SER 5 N 0.00 -2.01 -4.83 1.61 3.41 -1.26 -5.14 113.62 105.40 1j26 n SER 5 Ca 0.00 -2.76 -0.31 0.00 -0.26 0.00 0.00 58.87 55.54 1j26 n SER 5 Cb 0.00 0.74 0.04 0.00 -0.26 0.00 0.00 64.21 64.73 1j26 n SER 5 CO 0.00 0.00 0.00 -0.94 -0.16 0.00 0.00 175.04 173.94 1j26 s SER 6 N 0.03 5.61 -0.06 4.04 1.04 -1.26 -5.02 113.70 118.08 1j26 s SER 6 Ca 0.32 1.58 -0.12 0.00 0.48 0.00 0.00 55.95 58.20 1j26 s SER 6 Cb 0.06 -2.49 -0.08 0.00 0.10 0.00 0.00 66.02 63.61 1j26 s SER 6 CO -0.13 -1.29 0.49 1.23 0.98 0.00 0.00 173.24 174.52 1j26 h GLY 7 N -0.57 -0.34 -7.00 7.32 0.00 -2.10 -3.47 103.07 96.91 1j26 h GLY 7 Ca -0.44 0.12 -0.59 0.00 0.00 0.00 0.00 47.33 46.42 1j26 h GLY 7 CO 0.58 -0.12 -0.93 1.18 0.00 0.00 0.00 176.54 177.25 1j26 n GLU 8 N -4.99 -0.94 -2.22 4.80 -0.58 -1.26 -4.84 120.64 110.62 1j26 n GLU 8 Ca -0.05 0.09 -0.41 0.00 -0.42 0.00 0.00 57.16 56.37 1j26 n GLU 8 Cb 0.17 -3.46 -0.03 0.00 -0.57 0.00 0.00 31.44 27.55 1j26 n GLU 8 CO 0.00 0.00 0.00 -1.58 -0.48 0.00 0.00 177.13 175.07 1j26 s HIS 9 N -4.30 3.22 -0.93 -0.32 5.65 -1.26 -4.91 115.29 112.43 1j26 s HIS 9 Ca 0.02 1.41 -0.26 0.00 0.25 0.00 0.00 55.06 56.48 1j26 s HIS 9 Cb -0.01 -3.58 -0.19 0.00 -1.18 0.00 0.00 32.58 27.62 1j26 s HIS 9 CO 0.96 -1.61 2.27 0.00 -0.65 0.00 0.00 174.74 175.70 1j26 n ALA 10 N 1.41 0.26 -1.78 1.58 0.00 -1.26 -4.95 120.51 115.78 1j26 n ALA 10 Ca 0.02 -1.80 -0.41 0.00 0.00 0.00 0.00 53.44 51.25 1j26 n ALA 10 Cb 0.43 -3.30 -0.03 0.00 0.00 0.00 0.00 19.45 16.55 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 8.74 4.44 0.34 0.00 2.20 -1.26 -4.98 119.74 129.21 1j26 s LYS 11 Ca 0.87 2.09 -0.28 0.00 -0.36 0.00 0.00 55.97 58.29 1j26 s LYS 11 Cb -0.09 -3.11 -0.10 0.00 -1.51 0.00 0.00 37.83 33.01 1j26 s LYS 11 CO 0.14 -0.08 1.30 -0.65 -0.36 0.00 0.00 175.35 175.69 1j26 s GLN 12 N -1.61 4.32 0.00 4.03 -0.21 -1.26 -5.02 119.66 119.91 1j26 s GLN 12 Ca 0.48 2.19 0.00 0.00 0.02 0.00 0.00 55.36 58.05 1j26 s GLN 12 Cb -0.37 -3.03 0.00 0.00 1.00 0.00 0.00 33.01 30.60 1j26 s GLN 12 CO 0.49 -0.21 0.05 0.00 -2.12 0.00 0.00 175.29 173.50 1j26 n ALA 13 N 0.72 0.00 -3.14 6.09 0.00 -1.26 -4.99 120.51 117.93 1j26 n ALA 13 Ca 0.00 0.00 0.04 0.00 0.00 0.00 0.00 53.44 53.49 1j26 n ALA 13 Cb 0.42 0.00 -0.00 0.00 0.00 0.00 0.00 19.45 19.87 1j26 n ALA 13 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.50 175.96 1j26 s SER 14 N -1.62 -1.19 -0.02 0.00 1.04 -1.26 -4.97 113.70 105.68 1j26 s SER 14 Ca 0.00 0.06 0.03 0.00 0.48 0.00 0.00 55.95 56.51 1j26 s SER 14 Cb 0.00 1.72 0.04 0.00 0.10 0.00 0.00 66.02 67.88 1j26 s SER 14 CO 0.00 -0.21 0.87 -1.54 0.98 0.00 0.00 173.24 173.34 1j26 n SER 15 N 5.17 1.27 -0.05 7.02 3.41 -1.26 -4.91 113.62 124.27 1j26 n SER 15 Ca 0.07 -1.85 -0.02 0.00 -0.26 0.00 0.00 58.87 56.81 1j26 n SER 15 Cb 0.56 -0.08 -0.02 0.00 -0.26 0.00 0.00 64.21 64.41 1j26 n SER 15 CO 0.00 0.00 0.00 0.10 -0.16 0.00 0.00 175.04 174.98 1j26 h TYR 16 N 0.00 -0.01 -5.16 7.33 -0.00 -2.01 -3.51 116.97 113.61 1j26 h TYR 16 Ca 0.00 -0.00 0.00 0.00 -0.00 0.00 0.00 58.73 58.73 1j26 h TYR 16 Cb 0.80 0.00 -0.03 0.00 -0.00 0.00 0.00 36.73 37.50 1j26 h TYR 16 CO 0.01 0.12 -0.48 -0.89 -0.00 0.00 0.00 178.16 176.92 1j26 n ILE 17 N -4.77 -5.03 -2.47 -0.90 2.08 -1.26 -4.89 119.36 102.12 1j26 n ILE 17 Ca -0.01 1.04 -0.41 0.00 0.56 0.00 0.00 62.75 63.93 1j26 n ILE 17 Cb 0.06 -3.61 -0.03 0.00 -0.75 0.00 0.00 39.64 35.32 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 -0.22 3.28 0.19 0.38 0.04 -1.26 -4.91 135.00 132.50 1j26 s PRO 18 Ca -0.06 0.19 -0.11 0.00 0.04 0.00 0.00 61.00 61.05 1j26 s PRO 18 Cb 0.00 -4.13 0.17 0.00 0.04 0.00 0.00 34.50 30.58 1j26 s PRO 18 CO 0.17 -1.99 1.81 -0.07 0.04 0.00 0.00 177.00 176.97 1j26 h LEU 19 N 12.97 0.54 -1.09 -3.56 3.38 -1.94 -1.80 115.31 123.82 1j26 h LEU 19 Ca -0.27 0.02 0.00 0.00 0.09 0.00 0.00 57.88 57.72 1j26 h LEU 19 Cb 1.07 -0.10 0.00 0.00 0.09 0.00 0.00 40.66 41.73 1j26 h LEU 19 CO 1.22 0.37 0.00 -0.78 0.09 0.00 0.00 178.44 179.33 1j26 h ASP 20 N 0.67 0.00 0.87 -0.43 3.58 -2.04 -0.56 116.42 118.51 1j26 h ASP 20 Ca 0.25 0.00 0.00 0.00 0.42 0.00 0.00 57.03 57.70 1j26 h ASP 20 Cb 0.09 0.00 0.00 0.00 1.72 0.00 0.00 39.33 41.14 1j26 h ASP 20 CO -0.13 0.00 0.00 0.03 -2.88 0.00 0.00 179.24 176.26 1j26 h ARG 21 N 0.00 0.00 -5.96 0.28 2.47 -1.73 -3.45 114.38 105.98 1j26 h ARG 21 Ca 0.00 0.00 -0.56 0.00 -1.26 0.00 0.00 59.98 58.16 1j26 h ARG 21 Cb 0.39 0.00 -0.06 0.00 -1.65 0.00 0.00 29.97 28.65 1j26 h ARG 21 CO 0.00 0.00 -0.39 -0.51 0.56 0.00 0.00 179.97 179.63 1j26 s LEU 22 N -5.18 3.00 -0.76 3.04 1.43 -0.22 -4.91 118.68 115.08 1j26 s LEU 22 Ca 0.03 -1.07 -0.01 0.00 -1.03 0.00 0.00 54.13 52.04 1j26 s LEU 22 Cb 0.09 -1.49 0.19 0.00 0.03 0.00 0.00 46.19 45.02 1j26 s LEU 22 CO 0.46 -0.80 0.60 -0.44 0.23 0.00 0.00 176.35 176.40 1j26 s SER 23 N -4.11 5.53 0.32 2.29 0.01 0.74 -4.99 113.70 113.49 1j26 s SER 23 Ca 0.39 -3.38 -0.27 0.00 1.31 0.00 0.00 55.95 54.00 1j26 s SER 23 Cb -0.00 -1.85 -0.09 0.00 0.21 0.00 0.00 66.02 64.28 1j26 s SER 23 CO 0.23 -0.25 1.02 -0.63 0.41 0.00 0.00 173.24 174.02 1j26 s ILE 24 N -0.83 3.82 -0.05 1.44 1.09 -1.26 -0.70 121.20 124.71 1j26 s ILE 24 Ca 0.23 1.61 -0.11 0.00 -1.10 0.00 0.00 60.65 61.28 1j26 s ILE 24 Cb -0.13 -3.94 0.02 0.00 -1.06 0.00 0.00 42.46 37.35 1j26 s ILE 24 CO -0.09 0.22 0.26 -0.55 -0.10 0.00 0.00 174.94 174.68 1j26 s SER 25 N -1.31 -0.18 0.00 3.58 0.15 -0.42 -4.98 113.70 110.54 1j26 s SER 25 Ca 0.49 0.22 0.01 0.00 0.70 0.00 0.00 55.95 57.37 1j26 s SER 25 Cb -0.25 0.39 -0.04 0.00 -1.71 0.00 0.00 66.02 64.42 1j26 s SER 25 CO 0.31 -0.29 0.05 -0.31 1.20 0.00 0.00 173.24 174.20 1j26 s TYR 26 N -0.73 3.19 0.40 3.44 2.02 -1.26 -0.26 117.35 124.14 1j26 s TYR 26 Ca -0.08 0.14 0.05 0.00 -0.37 0.00 0.00 57.07 56.81 1j26 s TYR 26 Cb -0.04 -1.70 -0.02 0.00 -0.40 0.00 0.00 41.96 39.79 1j26 s TYR 26 CO 0.02 0.51 0.19 0.00 -1.57 0.00 0.00 175.55 174.70 1j26 s ARG 28 N -3.59 4.22 -0.08 0.00 3.52 -1.26 -0.77 118.95 120.99 1j26 s ARG 28 Ca 0.28 2.34 -0.30 0.00 -0.13 0.00 0.00 55.73 57.92 1j26 s ARG 28 Cb 0.02 -3.19 -0.05 0.00 -1.56 0.00 0.00 34.95 30.17 1j26 s ARG 28 CO 0.19 -0.60 1.65 -1.54 -0.81 0.00 0.00 175.30 174.19 1j26 s SER 29 N 1.22 6.62 -0.31 -2.12 1.04 -1.26 -4.61 113.70 114.28 1j26 s SER 29 Ca 0.70 2.16 0.04 0.00 0.48 0.00 0.00 55.95 59.33 1j26 s SER 29 Cb -0.43 -2.53 0.17 0.00 0.10 0.00 0.00 66.02 63.33 1j26 s SER 29 CO 0.31 -0.98 1.12 -1.20 0.98 0.00 0.00 173.24 173.47 1j26 n SER 30 N 7.35 -1.25 -4.65 7.02 7.64 -1.26 -4.88 113.62 123.58 1j26 n SER 30 Ca 0.18 -1.84 -0.38 0.00 1.01 0.00 0.00 58.87 57.83 1j26 n SER 30 Cb 0.43 0.87 0.05 0.00 -1.01 0.00 0.00 64.21 64.55 1j26 n SER 30 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1j26 n GLY 31 N -0.57 0.01 3.55 0.23 0.00 -1.26 -4.84 105.19 102.31 1j26 n GLY 31 Ca -0.17 -0.06 -0.38 0.00 0.00 0.00 0.00 46.02 45.41 1j26 n GLY 31 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1j26 s PRO 32 N -2.72 2.55 0.00 1.61 0.04 -1.26 -0.77 135.00 134.45 1j26 s PRO 32 Ca 0.73 0.78 0.00 0.00 0.04 0.00 0.00 61.00 62.56 1j26 s PRO 32 Cb -0.43 -4.42 0.00 0.00 0.04 0.00 0.00 34.50 29.69 1j26 s PRO 32 CO 0.48 -2.80 0.00 0.41 0.04 0.00 0.00 177.00 175.13 1j26 n GLY 33 N 5.75 0.96 3.41 0.56 0.00 -1.26 -5.12 105.19 109.49 1j26 n GLY 33 Ca 0.23 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.96 1j26 n GLY 33 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1j26 s GLY 34 N -0.67 1.54 0.00 -0.02 0.00 0.05 -5.11 107.32 103.11 1j26 s GLY 34 Ca 0.00 -1.31 0.00 0.00 0.00 0.00 0.00 44.72 43.41 1j26 s GLY 34 CO 0.00 -1.24 0.00 -1.06 0.00 0.00 0.00 173.10 170.80 1j26 n GLN 35 N 1.35 0.00 -1.36 2.90 6.02 -1.26 -4.40 117.38 120.63 1j26 n GLN 35 Ca -0.17 0.00 -0.12 0.00 -0.01 0.00 0.00 57.00 56.70 1j26 n GLN 35 Cb 0.52 0.00 -0.05 0.00 1.02 0.00 0.00 30.24 31.73 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 0.00 -5.17 -0.17 1.08 3.02 -1.26 -4.86 115.26 107.90 1j26 n ASN 36 Ca 0.00 0.31 0.00 0.00 -0.03 0.00 0.00 54.58 54.86 1j26 n ASN 36 Cb 0.00 -3.76 0.00 0.00 -0.61 0.00 0.00 39.78 35.41 1j26 n ASN 36 CO 0.00 0.00 0.00 0.52 -2.62 0.00 0.00 177.26 175.16 1j26 n VAL 37 N -2.41 0.00 0.00 2.41 0.31 -1.26 -4.00 118.33 113.38 1j26 n VAL 37 Ca -0.12 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.21 1j26 n VAL 37 Cb 0.52 -0.24 0.00 0.00 -0.91 0.00 0.00 33.84 33.21 1j26 n VAL 37 CO 0.00 0.00 0.00 0.59 -1.32 0.00 0.00 176.83 176.10 1j26 n ASN 38 N -0.26 0.00 -0.52 4.52 4.13 -1.26 -4.28 115.26 117.59 1j26 n ASN 38 Ca 0.00 0.02 0.04 0.00 1.68 0.00 0.00 54.58 56.31 1j26 n ASN 38 Cb 0.05 0.00 0.11 0.00 -1.54 0.00 0.00 39.78 38.40 1j26 n ASN 38 CO 0.00 0.00 0.00 0.29 0.28 0.00 0.00 177.26 177.83 1j26 n LYS 39 N -0.03 1.66 -4.87 3.52 4.76 -1.26 -4.76 118.16 117.19 1j26 n LYS 39 Ca 0.00 -0.89 -0.26 0.00 -2.87 0.00 0.00 58.31 54.29 1j26 n LYS 39 Cb 0.00 -1.27 -0.16 0.00 -1.84 0.00 0.00 35.03 31.76 1j26 n LYS 39 CO 0.00 0.00 0.00 0.08 -1.37 0.00 0.00 177.40 176.11 1j26 s VAL 40 N -1.66 1.45 -0.08 -0.18 1.01 -1.26 -4.96 120.40 114.73 1j26 s VAL 40 Ca 0.16 -0.75 -0.07 0.00 0.00 0.00 0.00 61.98 61.32 1j26 s VAL 40 Cb 0.09 -1.23 0.02 0.00 0.00 0.00 0.00 36.38 35.26 1j26 s VAL 40 CO 0.10 0.42 0.22 0.54 0.00 0.00 0.00 175.10 176.37 1j26 s ASN 41 N -0.15 -0.23 0.00 3.32 2.20 -1.26 -4.34 114.94 114.48 1j26 s ASN 41 Ca 0.00 0.44 0.00 0.00 -0.94 0.00 0.00 52.86 52.37 1j26 s ASN 41 Cb -0.10 0.44 0.00 0.00 -2.00 0.00 0.00 41.25 39.59 1j26 s ASN 41 CO 0.01 -0.08 0.00 -1.20 -2.94 0.00 0.00 177.10 172.89 1j26 n SER 42 N 3.01 0.00 -4.90 3.54 7.64 -1.26 -4.37 113.62 117.27 1j26 n SER 42 Ca -0.13 0.00 -0.28 0.00 1.01 0.00 0.00 58.87 59.47 1j26 n SER 42 Cb 0.58 0.00 -0.02 0.00 -1.01 0.00 0.00 64.21 63.77 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 -1.10 3.61 -0.06 1.43 2.20 0.05 -4.51 119.74 121.36 1j26 s LYS 43 Ca 0.00 0.13 0.03 0.00 -0.36 0.00 0.00 55.97 55.76 1j26 s LYS 43 Cb 0.00 -2.49 0.01 0.00 -1.51 0.00 0.00 37.83 33.84 1j26 s LYS 43 CO 0.00 -0.00 -0.13 0.00 -0.36 0.00 0.00 175.35 174.86 1j26 s ALA 44 N -2.42 1.29 0.12 3.13 0.00 -1.21 -3.48 121.76 119.20 1j26 s ALA 44 Ca 0.46 -0.47 0.10 0.00 0.00 0.00 0.00 51.96 52.05 1j26 s ALA 44 Cb -0.10 -0.54 -0.04 0.00 0.00 0.00 0.00 23.12 22.44 1j26 s ALA 44 CO 0.37 0.15 -0.24 -2.00 0.00 0.00 0.00 175.76 174.04 1j26 s GLU 45 N 0.49 1.54 -0.03 0.00 2.12 0.63 -1.80 118.70 121.66 1j26 s GLU 45 Ca -0.12 -1.28 0.01 0.00 0.36 0.00 0.00 54.97 53.94 1j26 s GLU 45 Cb -0.14 -1.98 0.01 0.00 0.26 0.00 0.00 34.13 32.28 1j26 s GLU 45 CO 0.03 0.46 -0.05 0.08 -0.54 0.00 0.00 175.26 175.25 1j26 s VAL 46 N -1.08 0.48 0.08 3.70 1.01 -0.53 -1.29 120.40 122.76 1j26 s VAL 46 Ca 0.15 -0.14 0.09 0.00 0.00 0.00 0.00 61.98 62.09 1j26 s VAL 46 Cb -0.10 -0.48 -0.03 0.00 0.00 0.00 0.00 36.38 35.76 1j26 s VAL 46 CO 0.07 0.19 -0.25 -0.60 0.00 0.00 0.00 175.10 174.51 1j26 s ARG 47 N 0.60 1.54 -0.03 2.72 3.52 0.13 -1.70 118.95 125.72 1j26 s ARG 47 Ca -0.07 -1.17 -0.14 0.00 -0.13 0.00 0.00 55.73 54.21 1j26 s ARG 47 Cb -0.11 -1.82 0.02 0.00 -1.56 0.00 0.00 34.95 31.48 1j26 s ARG 47 CO -0.00 0.45 0.30 -0.59 -0.81 0.00 0.00 175.30 174.65 1j26 s PHE 48 N -0.93 -0.19 -0.73 5.12 -0.12 -0.22 -0.19 117.98 120.72 1j26 s PHE 48 Ca 0.11 0.32 -0.26 0.00 -0.05 0.00 0.00 56.93 57.06 1j26 s PHE 48 Cb -0.10 0.09 -0.02 0.00 -0.63 0.00 0.00 43.02 42.36 1j26 s PHE 48 CO 0.04 -0.35 1.80 -1.58 -0.05 0.00 0.00 175.22 175.08 1j26 s HIS 49 N -1.11 1.82 0.25 3.49 5.65 -1.26 -0.72 115.29 123.41 1j26 s HIS 49 Ca -0.12 0.55 -0.04 0.00 0.25 0.00 0.00 55.06 55.71 1j26 s HIS 49 Cb -0.05 -4.17 0.47 0.00 -1.18 0.00 0.00 32.58 27.65 1j26 s HIS 49 CO 0.03 -2.10 1.72 1.25 -0.65 0.00 0.00 174.74 174.99 1j26 h LEU 50 N 16.27 0.22 -2.56 8.88 7.12 -1.87 0.51 115.31 143.89 1j26 h LEU 50 Ca -0.13 0.12 0.00 0.00 0.13 0.00 0.00 57.88 58.00 1j26 h LEU 50 Cb 1.10 0.11 0.00 0.00 -0.53 0.00 0.00 40.66 41.34 1j26 h LEU 50 CO 1.24 0.07 0.00 0.00 -0.13 0.00 0.00 178.44 179.61 1j26 h ALA 51 N 1.56 1.00 0.00 1.25 0.00 -1.89 -1.71 119.26 119.47 1j26 h ALA 51 Ca 0.42 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.33 1j26 h ALA 51 Cb 0.66 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.45 1j26 h ALA 51 CO -0.43 0.00 -0.07 0.45 0.00 0.00 0.00 179.25 179.20 1j26 n SER 52 N -2.98 1.69 0.25 0.00 2.88 0.03 -4.80 113.62 110.69 1j26 n SER 52 Ca -0.02 -2.41 -0.16 0.00 -1.33 0.00 0.00 58.87 54.95 1j26 n SER 52 Cb 0.11 -0.23 -0.08 0.00 -0.75 0.00 0.00 64.21 63.26 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 0.00 -0.61 0.00 -1.46 0.00 -0.21 -3.46 119.26 113.52 1j26 h ALA 53 Ca 0.00 -0.12 0.00 0.00 0.00 0.00 0.00 54.91 54.79 1j26 h ALA 53 Cb 0.91 0.28 0.00 0.00 0.00 0.00 0.00 17.79 18.98 1j26 h ALA 53 CO 0.00 -0.85 0.00 -3.47 0.00 0.00 0.00 179.25 174.93 1j26 n ASP 54 N -5.37 0.00 -0.05 0.00 2.03 -1.26 -4.52 116.55 107.38 1j26 n ASP 54 Ca -0.11 0.00 0.15 0.00 0.52 0.00 0.00 54.79 55.35 1j26 n ASP 54 Cb 0.27 0.00 0.69 0.00 -0.72 0.00 0.00 41.12 41.37 1j26 n ASP 54 CO 0.00 0.00 0.00 -2.67 -1.92 0.00 0.00 177.20 172.61 1j26 n TRP 55 N -0.86 0.00 -3.85 -0.67 4.27 -1.26 -4.78 117.44 110.29 1j26 n TRP 55 Ca 0.00 0.00 -0.36 0.00 -3.89 0.00 0.00 57.50 53.25 1j26 n TRP 55 Cb 0.00 -0.23 -0.08 0.00 -1.36 0.00 0.00 31.31 29.64 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 -2.52 5.31 0.35 -1.67 1.01 -1.26 -5.09 121.20 117.33 1j26 s ILE 56 Ca 0.29 0.15 -0.28 0.00 0.00 0.00 0.00 60.65 60.81 1j26 s ILE 56 Cb 0.20 -3.37 -0.12 0.00 0.01 0.00 0.00 42.46 39.18 1j26 s ILE 56 CO 0.47 0.51 1.37 -0.62 0.00 0.00 0.00 174.94 176.68 1j26 n GLU 57 N 2.92 2.35 -0.28 2.79 1.02 -1.26 -4.77 120.64 123.40 1j26 n GLU 57 Ca -0.18 0.82 -0.01 0.00 -0.02 0.00 0.00 57.16 57.78 1j26 n GLU 57 Cb 0.53 -2.47 0.02 0.00 -0.02 0.00 0.00 31.44 29.51 1j26 n GLU 57 CO 0.00 0.00 0.00 0.39 1.18 0.00 0.00 177.13 178.70 1j26 n GLU 58 N 0.56 -0.18 -0.14 3.49 4.71 -1.26 -0.42 120.64 127.40 1j26 n GLU 58 Ca 0.04 1.13 -0.06 0.00 -0.01 0.00 0.00 57.16 58.25 1j26 n GLU 58 Cb 0.37 -1.68 0.10 0.00 -1.01 0.00 0.00 31.44 29.22 1j26 n GLU 58 CO 0.00 0.00 0.00 -1.00 0.09 0.00 0.00 177.13 176.22 1j26 h PRO 59 N 0.00 0.89 -0.13 3.49 0.13 -1.96 -2.95 132.00 131.47 1j26 h PRO 59 Ca 0.25 -0.27 -0.15 0.00 -0.87 0.00 0.00 66.00 64.95 1j26 h PRO 59 Cb 0.43 -0.09 0.01 0.00 0.13 0.00 0.00 31.00 31.48 1j26 h PRO 59 CO -0.73 0.91 -0.51 0.28 -0.23 0.00 0.00 178.00 177.71 1j26 h VAL 60 N 0.81 1.35 0.03 1.56 2.07 -1.52 -2.59 116.25 117.95 1j26 h VAL 60 Ca 0.15 -1.80 0.03 0.00 0.82 0.00 0.00 66.70 65.89 1j26 h VAL 60 Cb 0.53 2.10 -0.05 0.00 -1.52 0.00 0.00 31.29 32.35 1j26 h VAL 60 CO 0.03 0.55 -0.45 0.03 0.02 0.00 0.00 177.57 177.75 1j26 h ARG 61 N 0.21 -0.60 0.00 1.57 3.08 -0.62 -1.67 114.38 116.35 1j26 h ARG 61 Ca -0.03 0.04 0.00 0.00 0.07 0.00 0.00 59.98 60.06 1j26 h ARG 61 Cb 1.15 0.14 0.00 0.00 0.08 0.00 0.00 29.97 31.33 1j26 h ARG 61 CO 0.11 -0.40 0.00 -0.56 -1.07 0.00 0.00 179.97 178.05 1j26 h GLN 62 N -0.62 0.00 0.33 0.04 3.07 -1.56 -0.85 115.11 115.52 1j26 h GLN 62 Ca 0.03 0.00 -0.02 0.00 0.09 0.00 0.00 58.65 58.76 1j26 h GLN 62 Cb 0.68 0.00 0.00 0.00 0.08 0.00 0.00 27.48 28.24 1j26 h GLN 62 CO -0.31 0.00 -0.16 -0.22 0.09 0.00 0.00 178.83 178.23 1j26 h LYS 63 N 0.00 -0.43 -1.03 0.06 1.63 -0.91 -3.18 116.57 112.71 1j26 h LYS 63 Ca 0.00 0.03 0.27 0.00 -0.85 0.00 0.00 60.65 60.10 1j26 h LYS 63 Cb 0.55 0.10 -0.08 0.00 -0.60 0.00 0.00 32.23 32.19 1j26 h LYS 63 CO 0.00 -0.28 0.68 0.82 -3.45 0.00 0.00 179.45 177.22 1j26 h ILE 64 N -0.47 0.53 -0.73 2.00 5.03 -0.98 0.45 117.51 123.34 1j26 h ILE 64 Ca -0.05 -0.11 0.08 0.00 -0.12 0.00 0.00 64.86 64.67 1j26 h ILE 64 Cb 0.34 0.18 -0.05 0.00 -3.03 0.00 0.00 36.82 34.26 1j26 h ILE 64 CO 0.07 0.06 0.48 0.00 -0.68 0.00 0.00 178.15 178.08 1j26 h ALA 65 N 1.59 1.78 0.00 1.87 0.00 -1.19 -1.79 119.26 121.51 1j26 h ALA 65 Ca 0.56 -0.01 -0.08 0.00 0.00 0.00 0.00 54.91 55.39 1j26 h ALA 65 Cb 1.57 -0.16 -0.01 0.00 0.00 0.00 0.00 17.79 19.19 1j26 h ALA 65 CO -0.23 0.08 -1.20 1.28 0.00 0.00 0.00 179.25 179.18 1j26 n LEU 66 N -4.49 1.88 0.16 0.00 4.77 0.20 -4.16 117.00 115.37 1j26 n LEU 66 Ca 0.12 0.32 0.04 0.00 -0.03 0.00 0.00 56.01 56.45 1j26 n LEU 66 Cb 0.29 -0.73 0.16 0.00 -2.33 0.00 0.00 43.42 40.81 1j26 n LEU 66 CO 0.33 -0.15 0.55 0.74 -1.33 0.00 0.00 177.39 177.53 1j26 h THR 67 N -0.94 0.87 -0.14 -5.08 2.02 -0.32 -2.69 112.91 106.63 1j26 h THR 67 Ca -0.11 -1.95 -0.06 0.00 0.77 0.00 0.00 66.41 65.05 1j26 h THR 67 Cb 1.05 2.23 -0.04 0.00 -1.74 0.00 0.00 68.15 69.65 1j26 h THR 67 CO -0.07 0.45 -0.24 1.41 0.37 0.00 0.00 175.52 177.43 1j26 n HIS 68 N -3.34 0.46 -0.33 3.16 8.25 -0.69 -4.66 115.22 118.07 1j26 n HIS 68 Ca 0.01 -1.42 0.21 0.00 -0.26 0.00 0.00 57.72 56.26 1j26 n HIS 68 Cb 0.64 -0.33 0.47 0.00 1.12 0.00 0.00 29.99 31.90 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 0.92 0.45 -0.58 -0.41 1.63 -1.34 0.96 116.57 118.20 1j26 h LYS 69 Ca 0.08 -0.03 0.13 0.00 -0.85 0.00 0.00 60.65 59.98 1j26 h LYS 69 Cb 1.27 -0.10 -0.03 0.00 -0.60 0.00 0.00 32.23 32.77 1j26 h LYS 69 CO 0.16 0.30 0.40 -2.95 -3.45 0.00 0.00 179.45 173.90 1j26 h ASN 70 N 0.46 0.22 0.98 4.20 7.08 -1.83 -1.37 115.58 125.31 1j26 h ASN 70 Ca 0.60 0.01 -0.12 0.00 -3.08 0.00 0.00 56.30 53.71 1j26 h ASN 70 Cb 1.39 -0.04 -0.02 0.00 -2.08 0.00 0.00 38.32 37.58 1j26 h ASN 70 CO -0.34 0.12 -1.08 0.11 -2.08 0.00 0.00 177.43 174.16 1j26 h LYS 71 N 0.24 0.00 -7.03 4.14 1.79 -1.12 -3.47 116.57 111.12 1j26 h LYS 71 Ca 0.27 0.00 -0.51 0.00 -2.18 0.00 0.00 60.65 58.23 1j26 h LYS 71 Cb 0.76 0.00 0.08 0.00 -1.58 0.00 0.00 32.23 31.48 1j26 h LYS 71 CO -0.05 0.27 0.48 0.42 -1.08 0.00 0.00 179.45 179.49 1j26 s ILE 72 N -3.02 2.99 0.00 1.86 1.01 -0.52 -1.30 121.20 122.22 1j26 s ILE 72 Ca -0.01 0.71 0.00 0.00 0.00 0.00 0.00 60.65 61.35 1j26 s ILE 72 Cb 0.08 -3.34 0.00 0.00 0.01 0.00 0.00 42.46 39.21 1j26 s ILE 72 CO 0.79 -0.04 0.00 -0.46 0.00 0.00 0.00 174.94 175.22 1j26 n ASN 73 N -0.77 0.00 0.00 3.58 0.23 -0.41 -4.89 115.26 113.00 1j26 n ASN 73 Ca 0.09 0.00 0.00 0.00 -0.53 0.00 0.00 54.58 54.14 1j26 n ASN 73 Cb 0.48 0.00 0.00 0.00 -2.08 0.00 0.00 39.78 38.18 1j26 n ASN 73 CO 0.00 0.00 0.00 1.17 -0.93 0.00 0.00 177.26 177.50 1j26 n LYS 74 N 0.00 0.00 0.24 -3.83 0.00 -1.26 -4.83 118.16 108.49 1j26 n LYS 74 Ca 0.00 0.00 0.10 0.00 0.00 0.00 0.00 58.31 58.41 1j26 n LYS 74 Cb 0.00 -0.44 0.62 0.00 0.00 0.00 0.00 35.03 35.21 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 1.35 0.00 3.14 0.00 -2.03 -3.46 119.26 118.27 1j26 h ALA 75 Ca 0.00 -0.15 0.00 0.00 0.00 0.00 0.00 54.91 54.76 1j26 h ALA 75 Cb 0.00 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 17.76 1j26 h ALA 75 CO 0.00 0.21 0.00 0.41 0.00 0.00 0.00 179.25 179.87 1j26 n GLY 76 N -0.66 0.76 3.67 0.00 0.00 -1.26 -5.05 105.19 102.65 1j26 n GLY 76 Ca -0.02 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.57 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 -0.76 4.30 -0.05 1.61 2.02 -1.26 -2.74 118.70 121.83 1j26 s GLU 77 Ca 0.00 1.39 -0.30 0.00 0.02 0.00 0.00 54.97 56.08 1j26 s GLU 77 Cb 0.00 -3.62 -0.03 0.00 0.10 0.00 0.00 34.13 30.58 1j26 s GLU 77 CO 0.00 -0.54 1.17 -1.17 0.02 0.00 0.00 175.26 174.73 1j26 s LEU 78 N 2.87 4.28 -0.06 1.80 2.96 0.10 -1.29 118.68 129.34 1j26 s LEU 78 Ca 0.46 1.79 0.03 0.00 -0.22 0.00 0.00 54.13 56.19 1j26 s LEU 78 Cb -0.16 -3.56 0.01 0.00 0.50 0.00 0.00 46.19 42.97 1j26 s LEU 78 CO 0.10 -0.55 -0.16 0.54 -1.32 0.00 0.00 176.35 174.96 1j26 s VAL 79 N 2.07 1.38 0.21 1.68 0.11 -0.42 -1.06 120.40 124.37 1j26 s VAL 79 Ca 0.55 -0.64 -0.01 0.00 -2.93 0.00 0.00 61.98 58.95 1j26 s VAL 79 Cb -0.24 -1.22 -0.04 0.00 -1.53 0.00 0.00 36.38 33.35 1j26 s VAL 79 CO 0.22 0.41 0.13 -1.48 -3.33 0.00 0.00 175.10 171.05 1j26 s LEU 80 N 0.42 1.19 0.11 2.54 2.34 -0.69 -4.59 118.68 120.00 1j26 s LEU 80 Ca -0.12 -1.40 0.03 0.00 0.06 0.00 0.00 54.13 52.70 1j26 s LEU 80 Cb -0.15 0.37 -0.04 0.00 -0.56 0.00 0.00 46.19 45.81 1j26 s LEU 80 CO 0.04 -0.84 -0.08 0.42 -1.06 0.00 0.00 176.35 174.83 1j26 s THR 81 N -4.13 0.88 -0.05 5.48 -4.23 -1.26 -1.45 115.64 110.88 1j26 s THR 81 Ca 0.39 -1.86 -0.04 0.00 -1.18 0.00 0.00 61.69 59.01 1j26 s THR 81 Cb 0.07 -1.60 0.02 0.00 1.34 0.00 0.00 72.50 72.33 1j26 s THR 81 CO 0.12 -0.74 0.12 -0.55 -0.54 0.00 0.00 174.62 173.04 1j26 s SER 82 N -2.86 -0.11 -0.06 3.99 0.15 -0.75 -4.88 113.70 109.18 1j26 s SER 82 Ca 0.11 0.25 -0.03 0.00 0.70 0.00 0.00 55.95 56.98 1j26 s SER 82 Cb 0.02 0.22 0.04 0.00 -1.71 0.00 0.00 66.02 64.58 1j26 s SER 82 CO -0.02 -0.07 0.10 -1.61 1.20 0.00 0.00 173.24 172.84 1j26 s GLU 83 N 0.39 -0.03 0.00 5.44 8.01 -1.26 -3.30 118.70 127.94 1j26 s GLU 83 Ca -0.03 0.46 0.00 0.00 0.01 0.00 0.00 54.97 55.41 1j26 s GLU 83 Cb -0.04 -0.41 0.00 0.00 -4.31 0.00 0.00 34.13 29.37 1j26 s GLU 83 CO -0.02 -0.32 0.00 -1.13 0.01 0.00 0.00 175.26 173.80 1j26 n SER 84 N 5.31 0.00 -1.57 -0.19 3.41 -1.26 -5.10 113.62 114.22 1j26 n SER 84 Ca -0.04 0.00 -0.04 0.00 -0.26 0.00 0.00 58.87 58.53 1j26 n SER 84 Cb 0.50 0.00 -0.01 0.00 -0.26 0.00 0.00 64.21 64.44 1j26 n SER 84 CO 0.00 0.00 0.00 -0.24 -0.16 0.00 0.00 175.04 174.64 1j26 n SER 85 N 0.00 -0.42 -0.00 4.04 2.88 -1.26 -5.09 113.62 113.77 1j26 n SER 85 Ca 0.00 -1.54 0.11 0.00 -1.33 0.00 0.00 58.87 56.11 1j26 n SER 85 Cb 0.00 0.77 -0.15 0.00 -0.75 0.00 0.00 64.21 64.08 1j26 n SER 85 CO 0.00 0.00 0.00 -2.11 -1.23 0.00 0.00 175.04 171.70 1j26 n ARG 86 N -0.17 0.53 -0.94 -1.46 0.00 -1.26 -4.49 116.66 108.87 1j26 n ARG 86 Ca -0.00 -0.14 -0.25 0.00 -0.00 0.00 0.00 57.85 57.45 1j26 n ARG 86 Cb 0.17 -1.53 0.21 0.00 -0.00 0.00 0.00 32.46 31.31 1j26 n ARG 86 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.63 178.29 1j26 n TYR 87 N -2.14 -3.78 0.00 2.89 4.01 -1.26 -4.56 117.16 112.32 1j26 n TYR 87 Ca -0.02 -0.86 0.00 0.00 -0.16 0.00 0.00 57.90 56.86 1j26 n TYR 87 Cb 0.52 -0.96 0.00 0.00 -0.31 0.00 0.00 39.34 38.59 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 -4.27 0.00 0.19 -0.72 3.00 -1.26 -4.44 117.38 109.88 1j26 n GLN 88 Ca 0.13 0.00 0.18 0.00 -0.01 0.00 0.00 57.00 57.30 1j26 n GLN 88 Cb 0.50 -0.16 0.73 0.00 0.00 0.00 0.00 30.24 31.31 1j26 n GLN 88 CO 0.00 0.00 0.00 0.35 0.00 0.00 0.00 177.06 177.41 1j26 h PHE 89 N 0.00 0.00 0.62 1.08 3.57 -1.98 -1.37 116.94 118.86 1j26 h PHE 89 Ca 0.00 0.00 -0.03 0.00 3.53 0.00 0.00 57.97 61.47 1j26 h PHE 89 Cb 0.00 0.00 0.01 0.00 2.79 0.00 0.00 35.95 38.75 1j26 h PHE 89 CO 0.00 0.00 -0.30 -0.09 -2.23 0.00 0.00 178.31 175.69 1j26 h ARG 90 N 0.00 -0.80 -0.35 1.11 9.65 -1.99 0.19 114.38 122.18 1j26 h ARG 90 Ca 0.12 0.05 -0.05 0.00 -1.10 0.00 0.00 59.98 59.00 1j26 h ARG 90 Cb 1.02 0.18 -0.01 0.00 -1.39 0.00 0.00 29.97 29.77 1j26 h ARG 90 CO -0.00 -0.50 0.01 -0.91 2.80 0.00 0.00 179.97 181.37 1j26 h ASN 91 N -0.94 0.60 -0.82 -3.80 2.35 -1.49 -3.11 115.58 108.37 1j26 h ASN 91 Ca -0.08 -0.30 0.00 0.00 -0.55 0.00 0.00 56.30 55.37 1j26 h ASN 91 Cb 0.67 -0.16 -0.04 0.00 0.05 0.00 0.00 38.32 38.84 1j26 h ASN 91 CO 0.14 0.75 0.53 0.25 -1.65 0.00 0.00 177.43 177.45 1j26 h LEU 92 N 0.43 0.96 -1.23 1.61 7.12 -1.43 -1.77 115.31 121.00 1j26 h LEU 92 Ca 0.10 -0.04 0.14 0.00 0.13 0.00 0.00 57.88 58.21 1j26 h LEU 92 Cb 0.43 -0.24 -0.07 0.00 -0.53 0.00 0.00 40.66 40.25 1j26 h LEU 92 CO 0.02 0.71 0.59 0.00 -0.13 0.00 0.00 178.44 179.62 1j26 h ALA 93 N 1.29 1.77 -0.29 1.25 0.00 -0.55 -1.81 119.26 120.92 1j26 h ALA 93 Ca 0.30 0.02 -0.16 0.00 0.00 0.00 0.00 54.91 55.07 1j26 h ALA 93 Cb -0.10 -0.14 -0.00 0.00 0.00 0.00 0.00 17.79 17.55 1j26 h ALA 93 CO -0.06 -0.02 -0.45 1.49 0.00 0.00 0.00 179.25 180.22 1j26 h GLU 94 N 0.75 0.82 -0.52 0.00 4.81 -1.29 0.02 114.58 119.16 1j26 h GLU 94 Ca 0.46 -0.49 0.11 0.00 -0.13 0.00 0.00 59.36 59.31 1j26 h GLU 94 Cb 0.68 0.05 -0.09 0.00 0.63 0.00 0.00 28.75 30.01 1j26 h GLU 94 CO -0.22 1.12 -0.06 0.00 -0.73 0.00 0.00 179.01 179.12 1j26 h LEU 96 N 0.06 0.89 -0.57 0.00 3.38 -1.00 -1.18 115.31 116.88 1j26 h LEU 96 Ca 0.26 -0.13 0.03 0.00 0.09 0.00 0.00 57.88 58.14 1j26 h LEU 96 Cb 0.40 -0.23 -0.04 0.00 0.09 0.00 0.00 40.66 40.89 1j26 h LEU 96 CO -0.49 0.76 0.33 -0.61 0.09 0.00 0.00 178.44 178.52 1j26 h GLN 97 N 0.95 0.63 0.05 1.13 5.75 -0.18 0.13 115.11 123.56 1j26 h GLN 97 Ca 0.24 -0.04 -0.00 0.00 -0.15 0.00 0.00 58.65 58.70 1j26 h GLN 97 Cb 0.10 -0.14 0.00 0.00 1.07 0.00 0.00 27.48 28.51 1j26 h GLN 97 CO -0.03 0.42 -0.02 0.87 -2.65 0.00 0.00 178.83 177.41 1j26 h LYS 98 N 0.65 -0.06 -0.93 1.69 1.57 -0.81 -0.66 116.57 118.02 1j26 h LYS 98 Ca 0.24 0.00 0.23 0.00 -1.87 0.00 0.00 60.65 59.25 1j26 h LYS 98 Cb 0.07 0.01 -0.17 0.00 0.08 0.00 0.00 32.23 32.22 1j26 h LYS 98 CO -0.12 0.31 -0.06 0.82 -0.57 0.00 0.00 179.45 179.83 1j26 h ILE 99 N -0.44 0.09 -0.18 1.86 2.04 -0.85 0.37 117.51 120.41 1j26 h ILE 99 Ca -0.01 -0.01 -0.02 0.00 1.00 0.00 0.00 64.86 65.83 1j26 h ILE 99 Cb 0.40 0.07 -0.01 0.00 -0.74 0.00 0.00 36.82 36.54 1j26 h ILE 99 CO 0.01 0.00 0.05 0.03 0.00 0.00 0.00 178.15 178.25 1j26 h ARG 100 N 0.03 0.28 -0.89 2.37 3.08 -0.57 -1.50 114.38 117.18 1j26 h ARG 100 Ca 0.52 -0.06 0.02 0.00 0.07 0.00 0.00 59.98 60.52 1j26 h ARG 100 Cb 0.96 -0.04 -0.05 0.00 0.08 0.00 0.00 29.97 30.92 1j26 h ARG 100 CO -0.89 0.40 0.58 0.22 -1.07 0.00 0.00 179.97 179.22 1j26 h ASP 101 N 0.11 0.99 0.02 7.04 1.82 0.70 0.26 116.42 127.36 1j26 h ASP 101 Ca 0.06 -0.02 -0.09 0.00 -0.39 0.00 0.00 57.03 56.59 1j26 h ASP 101 Cb 0.24 -0.24 -0.01 0.00 0.68 0.00 0.00 39.33 40.00 1j26 h ASP 101 CO -0.00 0.70 -0.26 0.24 -1.61 0.00 0.00 179.24 178.32 1j26 h MET 102 N 1.17 0.38 0.15 0.28 2.86 -0.22 0.18 114.93 119.73 1j26 h MET 102 Ca 0.34 -0.14 -0.01 0.00 -2.06 0.00 0.00 59.70 57.83 1j26 h MET 102 Cb -0.08 -0.03 0.00 0.00 0.06 0.00 0.00 31.60 31.56 1j26 h MET 102 CO -0.09 0.61 -0.07 0.82 1.06 0.00 0.00 176.91 179.24 1j26 h ILE 103 N 0.34 0.95 -0.51 -1.22 2.04 -0.78 -2.85 117.51 115.47 1j26 h ILE 103 Ca 0.05 -1.09 0.07 0.00 1.00 0.00 0.00 64.86 64.89 1j26 h ILE 103 Cb 0.63 1.55 -0.06 0.00 -0.74 0.00 0.00 36.82 38.20 1j26 h ILE 103 CO 0.05 0.23 0.18 0.00 0.00 0.00 0.00 178.15 178.60 1j26 h ALA 104 N -0.14 0.63 0.00 1.87 0.00 -0.75 -0.67 119.26 120.20 1j26 h ALA 104 Ca -0.02 0.07 0.00 0.00 0.00 0.00 0.00 54.91 54.96 1j26 h ALA 104 Cb 0.53 0.05 0.00 0.00 0.00 0.00 0.00 17.79 18.37 1j26 h ALA 104 CO 0.03 -0.22 0.00 -0.85 0.00 0.00 0.00 179.25 178.21 1j26 n GLU 105 N -5.01 0.20 0.06 0.00 0.28 0.61 -1.48 120.64 115.29 1j26 n GLU 105 Ca 0.06 0.38 0.11 0.00 -0.16 0.00 0.00 57.16 57.55 1j26 n GLU 105 Cb 0.21 -1.85 -0.04 0.00 1.43 0.00 0.00 31.44 31.20 1j26 n GLU 105 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 177.13 176.97 1j26 n ALA 106 N -1.77 2.80 0.02 -1.84 0.00 -0.61 -4.63 120.51 114.49 1j26 n ALA 106 Ca 0.03 -0.35 0.05 0.00 0.00 0.00 0.00 53.44 53.17 1j26 n ALA 106 Cb 0.27 -0.98 -0.10 0.00 0.00 0.00 0.00 19.45 18.64 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 -2.39 0.49 -3.49 0.00 2.88 -0.36 -4.63 113.62 106.12 1j26 n SER 107 Ca -0.01 0.20 -0.18 0.00 -1.33 0.00 0.00 58.87 57.56 1j26 n SER 107 Cb 0.53 0.88 0.11 0.00 -0.75 0.00 0.00 64.21 64.98 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 1.35 -0.45 3.70 0.46 0.00 -1.19 -5.01 105.19 104.05 1j26 n GLY 108 Ca -0.09 -1.84 -0.42 0.00 0.00 0.00 0.00 46.02 43.67 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 -4.64 4.41 -1.05 1.61 0.04 -1.26 -4.94 135.00 129.17 1j26 s PRO 109 Ca 0.48 1.70 -0.20 0.00 0.04 0.00 0.00 61.00 63.03 1j26 s PRO 109 Cb -0.02 -3.45 -0.08 0.00 0.04 0.00 0.00 34.50 30.99 1j26 s PRO 109 CO 0.33 -0.32 1.96 -1.13 0.04 0.00 0.00 177.00 177.88 1j26 n SER 110 N 4.48 3.15 -4.56 6.66 3.41 -1.26 -4.88 113.62 120.61 1j26 n SER 110 Ca 0.10 -2.74 -0.25 0.00 -0.26 0.00 0.00 58.87 55.71 1j26 n SER 110 Cb 0.47 -1.42 -0.05 0.00 -0.26 0.00 0.00 64.21 62.94 1j26 n SER 110 CO 0.00 0.00 0.00 -0.44 -0.16 0.00 0.00 175.04 174.44 1j26 s SER 111 N 4.91 5.02 0.00 4.04 0.01 -1.26 -5.31 113.70 121.11 1j26 s SER 111 Ca 0.58 -0.64 0.00 0.00 1.31 0.00 0.00 55.95 57.20 1j26 s SER 111 Cb 0.10 -2.56 0.00 0.00 0.21 0.00 0.00 66.02 63.77 1j26 s SER 111 CO 0.08 -2.86 0.00 0.61 0.41 0.00 0.00 173.24 171.48