#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2jyq s ALA 2 N 0.00 3.55 0.63 1.69 0.00 -1.26 -5.05 121.76 121.33 2jyq s ALA 2 Ca 0.00 -0.69 -0.16 0.00 0.00 0.00 0.00 51.96 51.11 2jyq s ALA 2 Cb 0.00 -2.96 -0.01 0.00 0.00 0.00 0.00 23.12 20.15 2jyq s ALA 2 CO 0.00 -0.91 1.11 -1.21 0.00 0.00 0.00 175.76 174.75 2jyq s GLU 3 N 2.40 2.94 0.02 0.00 0.41 -1.26 -4.97 118.70 118.22 2jyq s GLU 3 Ca 0.22 1.40 -0.18 0.00 -0.41 0.00 0.00 54.97 56.00 2jyq s GLU 3 Cb -0.15 -1.97 -0.25 0.00 -1.78 0.00 0.00 34.13 29.98 2jyq s GLU 3 CO 0.11 -1.15 1.09 0.93 -0.49 0.00 0.00 175.26 175.75 2jyq h GLU 4 N 0.25 0.48 -0.03 1.61 5.08 -2.02 -3.36 114.58 116.59 2jyq h GLU 4 Ca -0.47 -0.56 -0.23 0.00 -1.00 0.00 0.00 59.36 57.10 2jyq h GLU 4 Cb 1.25 0.17 0.01 0.00 0.50 0.00 0.00 28.75 30.67 2jyq h GLU 4 CO 0.55 1.20 -0.91 0.11 -1.00 0.00 0.00 179.01 178.95 2jyq h TRP 5 N 0.00 0.74 -3.15 4.33 5.08 -1.94 -3.42 115.95 117.60 2jyq h TRP 5 Ca -0.11 -0.39 -0.61 0.00 1.08 0.00 0.00 58.89 58.87 2jyq h TRP 5 Cb 1.51 -0.09 -0.12 0.00 -3.00 0.00 0.00 29.16 27.45 2jyq h TRP 5 CO 0.14 1.20 0.57 -0.47 -1.28 0.00 0.00 178.44 178.60 2jyq s TYR 6 N -3.38 2.78 -0.89 0.12 5.04 -1.26 -1.31 117.35 118.44 2jyq s TYR 6 Ca -0.07 -0.06 0.24 0.00 -2.44 0.00 0.00 57.07 54.75 2jyq s TYR 6 Cb 0.09 -4.10 0.38 0.00 0.35 0.00 0.00 41.96 38.68 2jyq s TYR 6 CO 0.88 -1.39 1.32 1.19 -1.34 0.00 0.00 175.55 176.21 2jyq n PHE 7 N 7.51 0.13 -1.65 4.97 3.01 -0.82 -4.71 117.46 125.90 2jyq n PHE 7 Ca 0.01 0.04 0.00 0.00 1.01 0.00 0.00 57.45 58.51 2jyq n PHE 7 Cb 0.47 -0.33 0.00 0.00 -0.01 0.00 0.00 39.48 39.61 2jyq n PHE 7 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 2jyq n GLY 8 N 1.46 -1.47 2.61 1.37 0.00 -1.25 -4.58 105.19 103.33 2jyq n GLY 8 Ca 0.05 -1.69 -0.40 0.00 0.00 0.00 0.00 46.02 43.98 2jyq n GLY 8 CO 0.00 0.00 0.00 0.58 0.00 0.00 0.00 173.32 173.90 2jyq n LYS 9 N 0.00 3.01 -3.71 1.61 2.85 -1.26 -0.02 118.16 120.63 2jyq n LYS 9 Ca 0.00 -2.35 -0.36 0.00 -1.05 0.00 0.00 58.31 54.55 2jyq n LYS 9 Cb 0.00 -3.05 -0.06 0.00 -0.65 0.00 0.00 35.03 31.27 2jyq n LYS 9 CO 0.00 0.00 0.00 0.96 -0.05 0.00 0.00 177.40 178.31 2jyq s ILE 10 N 2.99 5.27 0.72 0.58 -4.36 -1.26 -4.92 121.20 120.22 2jyq s ILE 10 Ca 0.55 0.39 -0.07 0.00 -0.26 0.00 0.00 60.65 61.26 2jyq s ILE 10 Cb 0.15 -3.56 0.07 0.00 1.25 0.00 0.00 42.46 40.37 2jyq s ILE 10 CO -0.06 0.50 1.03 0.42 0.24 0.00 0.00 174.94 177.07 2jyq s THR 11 N -1.16 2.24 0.14 8.37 -4.23 -1.26 -4.73 115.64 115.01 2jyq s THR 11 Ca 0.23 -0.25 -0.21 0.00 -1.18 0.00 0.00 61.69 60.28 2jyq s THR 11 Cb -0.14 -2.99 -0.00 0.00 1.34 0.00 0.00 72.50 70.71 2jyq s THR 11 CO 0.12 0.00 1.68 0.03 -0.54 0.00 0.00 174.62 175.90 2jyq h ARG 12 N -0.66 -0.10 -0.99 3.99 3.08 -1.99 -1.12 114.38 116.59 2jyq h ARG 12 Ca -0.44 0.01 0.14 0.00 0.07 0.00 0.00 59.98 59.76 2jyq h ARG 12 Cb 1.31 0.02 -0.09 0.00 0.08 0.00 0.00 29.97 31.29 2jyq h ARG 12 CO 0.60 -0.07 0.61 -0.09 -1.07 0.00 0.00 179.97 179.95 2jyq h ARG 13 N -0.10 0.87 0.22 0.04 2.43 -1.97 0.38 114.38 116.23 2jyq h ARG 13 Ca 0.11 -0.05 -0.01 0.00 -0.81 0.00 0.00 59.98 59.22 2jyq h ARG 13 Cb 0.27 -0.20 0.00 0.00 -0.42 0.00 0.00 29.97 29.63 2jyq h ARG 13 CO -0.27 0.58 -0.10 1.49 -1.51 0.00 0.00 179.97 180.15 2jyq h GLU 14 N 0.90 -0.28 0.31 0.20 4.57 -1.76 -1.98 114.58 116.54 2jyq h GLU 14 Ca 0.52 0.02 -0.02 0.00 -1.18 0.00 0.00 59.36 58.70 2jyq h GLU 14 Cb 0.63 0.06 0.00 0.00 -0.16 0.00 0.00 28.75 29.29 2jyq h GLU 14 CO -0.31 0.07 -0.15 0.77 -1.18 0.00 0.00 179.01 178.21 2jyq h SER 15 N -0.70 -0.35 0.73 1.04 0.02 -0.44 -2.94 113.55 110.91 2jyq h SER 15 Ca -0.03 -0.04 -0.04 0.00 -0.84 0.00 0.00 61.79 60.84 2jyq h SER 15 Cb 0.49 0.09 -0.01 0.00 0.14 0.00 0.00 62.40 63.11 2jyq h SER 15 CO 0.05 -0.19 -0.19 -0.33 -1.14 0.00 0.00 176.83 175.03 2jyq h GLU 16 N -0.50 0.00 -0.66 3.45 5.08 -0.39 -1.11 114.58 120.45 2jyq h GLU 16 Ca -0.04 0.00 -0.04 0.00 -1.00 0.00 0.00 59.36 58.28 2jyq h GLU 16 Cb 0.37 0.00 -0.03 0.00 0.50 0.00 0.00 28.75 29.59 2jyq h GLU 16 CO 0.07 0.19 0.26 -0.09 -1.00 0.00 0.00 179.01 178.44 2jyq h ARG 17 N 0.00 0.97 0.09 2.33 2.43 -1.18 -0.04 114.38 118.99 2jyq h ARG 17 Ca -0.00 -0.16 -0.27 0.00 -0.81 0.00 0.00 59.98 58.74 2jyq h ARG 17 Cb 0.60 -0.17 -0.01 0.00 -0.42 0.00 0.00 29.97 29.98 2jyq h ARG 17 CO 0.02 0.79 -1.26 -0.07 -1.51 0.00 0.00 179.97 177.95 2jyq h LEU 18 N 0.96 0.30 -0.07 3.80 3.38 -1.26 -3.37 115.31 119.05 2jyq h LEU 18 Ca 0.22 -0.34 -0.22 0.00 0.09 0.00 0.00 57.88 57.63 2jyq h LEU 18 Cb 0.18 -0.10 -0.02 0.00 0.09 0.00 0.00 40.66 40.82 2jyq h LEU 18 CO -0.02 1.27 -1.01 -0.07 0.09 0.00 0.00 178.44 178.70 2jyq h LEU 19 N 0.05 0.14 -0.06 1.67 3.38 -0.91 -3.23 115.31 116.34 2jyq h LEU 19 Ca -0.13 -0.13 0.00 0.00 0.09 0.00 0.00 57.88 57.70 2jyq h LEU 19 Cb 1.93 -0.04 0.00 0.00 0.09 0.00 0.00 40.66 42.64 2jyq h LEU 19 CO 0.17 1.06 0.00 0.18 0.09 0.00 0.00 178.44 179.94 2jyq n LEU 20 N -3.47 0.06 -4.68 1.67 7.99 -0.06 -4.76 117.00 113.76 2jyq n LEU 20 Ca -0.03 -0.03 -0.40 0.00 -0.01 0.00 0.00 56.01 55.54 2jyq n LEU 20 Cb 0.92 -0.03 -0.05 0.00 -0.11 0.00 0.00 43.42 44.15 2jyq n LEU 20 CO 0.48 0.02 0.48 0.20 -1.51 0.00 0.00 177.39 177.05 2jyq s ASN 21 N -0.96 6.88 0.00 -1.43 -0.87 -1.22 -4.92 114.94 112.42 2jyq s ASN 21 Ca 0.00 1.07 0.02 0.00 -1.57 0.00 0.00 52.86 52.38 2jyq s ASN 21 Cb 0.00 -2.41 0.14 0.00 -0.02 0.00 0.00 41.25 38.96 2jyq s ASN 21 CO 0.00 -0.28 0.62 -2.65 -2.57 0.00 0.00 177.10 172.23 2jyq n PRO 22 N 4.77 0.49 0.11 -0.60 -0.02 -1.26 -2.12 135.00 136.36 2jyq n PRO 22 Ca 0.01 0.00 0.13 0.00 -2.02 0.00 0.00 63.50 61.62 2jyq n PRO 22 Cb 0.50 -1.08 0.31 0.00 -0.02 0.00 0.00 33.50 33.21 2jyq n PRO 22 CO 0.00 0.00 0.00 0.93 1.98 0.00 0.00 175.50 178.41 2jyq h GLU 23 N 0.00 0.00 -5.83 -0.52 5.08 -1.94 -3.45 114.58 107.91 2jyq h GLU 23 Ca 0.00 0.00 -0.59 0.00 -1.00 0.00 0.00 59.36 57.77 2jyq h GLU 23 Cb 0.00 0.00 -0.07 0.00 0.50 0.00 0.00 28.75 29.18 2jyq h GLU 23 CO 0.00 0.00 -0.16 -0.80 -1.00 0.00 0.00 179.01 177.05 2jyq s ASN 24 N -4.68 6.73 0.38 1.42 0.01 -0.90 -5.06 114.94 112.83 2jyq s ASN 24 Ca 0.09 0.87 -0.25 0.00 -0.71 0.00 0.00 52.86 52.85 2jyq s ASN 24 Cb 0.12 -2.27 -0.09 0.00 0.41 0.00 0.00 41.25 39.41 2jyq s ASN 24 CO 0.64 0.12 1.09 -2.16 -1.51 0.00 0.00 177.10 175.28 2jyq s PRO 25 N 0.02 4.22 -0.25 -0.60 0.04 -1.26 -4.93 135.00 132.23 2jyq s PRO 25 Ca 0.25 1.67 -0.35 0.00 0.04 0.00 0.00 61.00 62.61 2jyq s PRO 25 Cb -0.16 -2.70 -0.11 0.00 0.04 0.00 0.00 34.50 31.56 2jyq s PRO 25 CO 0.11 -0.13 2.04 -2.13 0.04 0.00 0.00 177.00 176.94 2jyq n ARG 26 N 0.21 1.50 0.00 4.56 0.63 -1.26 -2.33 116.66 119.97 2jyq n ARG 26 Ca 0.04 0.48 0.00 0.00 -0.92 0.00 0.00 57.85 57.45 2jyq n ARG 26 Cb 0.48 -2.55 0.00 0.00 0.45 0.00 0.00 32.46 30.84 2jyq n ARG 26 CO 0.00 0.00 0.00 0.41 -2.51 0.00 0.00 177.63 175.53 2jyq n GLY 27 N 5.52 0.81 3.64 5.14 0.00 -0.90 -4.83 105.19 114.57 2jyq n GLY 27 Ca 0.33 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.92 2jyq n GLY 27 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2jyq s THR 28 N -1.54 3.92 0.29 2.61 2.01 -0.98 -1.19 115.64 120.75 2jyq s THR 28 Ca 0.00 1.06 0.06 0.00 0.31 0.00 0.00 61.69 63.12 2jyq s THR 28 Cb 0.00 -3.86 -0.06 0.00 0.01 0.00 0.00 72.50 68.59 2jyq s THR 28 CO 0.00 -0.29 -0.03 0.72 -0.69 0.00 0.00 174.62 174.33 2jyq s PHE 29 N 4.52 1.92 -0.23 4.92 -0.71 0.89 0.65 117.98 129.94 2jyq s PHE 29 Ca 0.64 -0.77 -0.26 0.00 -1.04 0.00 0.00 56.93 55.49 2jyq s PHE 29 Cb -0.23 -1.14 0.10 0.00 -1.21 0.00 0.00 43.02 40.54 2jyq s PHE 29 CO 0.25 0.20 0.86 -0.48 -1.34 0.00 0.00 175.22 174.71 2jyq s LEU 30 N -3.44 -0.58 -0.21 -1.99 2.34 -0.82 -0.63 118.68 113.34 2jyq s LEU 30 Ca 0.31 1.01 -0.06 0.00 0.06 0.00 0.00 54.13 55.45 2jyq s LEU 30 Cb 0.05 2.19 -0.03 0.00 -0.56 0.00 0.00 46.19 47.84 2jyq s LEU 30 CO 0.12 -0.27 0.04 0.54 -1.06 0.00 0.00 176.35 175.72 2jyq s VAL 31 N -0.06 4.25 0.08 1.48 0.11 -0.43 -1.23 120.40 124.60 2jyq s VAL 31 Ca -0.00 -0.21 0.07 0.00 -2.93 0.00 0.00 61.98 58.91 2jyq s VAL 31 Cb -0.04 -2.94 -0.04 0.00 -1.53 0.00 0.00 36.38 31.83 2jyq s VAL 31 CO -0.00 0.40 -0.16 0.00 -3.33 0.00 0.00 175.10 172.01 2jyq s ARG 32 N 1.07 2.02 -0.18 1.54 1.70 0.06 -1.93 118.95 123.23 2jyq s ARG 32 Ca 0.03 -1.04 -0.29 0.00 -0.47 0.00 0.00 55.73 53.96 2jyq s ARG 32 Cb -0.14 -2.21 -0.00 0.00 -0.57 0.00 0.00 34.95 32.02 2jyq s ARG 32 CO 0.02 0.52 1.09 -2.00 -1.08 0.00 0.00 175.30 173.85 2jyq s GLU 33 N -1.83 4.30 -0.28 3.89 2.12 0.97 -1.64 118.70 126.23 2jyq s GLU 33 Ca 0.17 1.45 -0.14 0.00 0.36 0.00 0.00 54.97 56.81 2jyq s GLU 33 Cb -0.11 -3.64 -0.04 0.00 0.26 0.00 0.00 34.13 30.61 2jyq s GLU 33 CO 0.09 -0.56 0.34 -1.12 -0.54 0.00 0.00 175.26 173.46 2jyq s SER 34 N 1.35 6.20 0.34 -1.70 0.01 -1.26 -4.26 113.70 114.38 2jyq s SER 34 Ca 0.48 0.20 0.19 0.00 1.31 0.00 0.00 55.95 58.13 2jyq s SER 34 Cb -0.18 -2.19 0.18 0.00 0.21 0.00 0.00 66.02 64.04 2jyq s SER 34 CO 0.12 -0.17 1.49 -0.33 0.41 0.00 0.00 173.24 174.76 2jyq h GLU 35 N 8.23 0.00 0.00 12.44 5.08 -1.95 -3.25 114.58 135.13 2jyq h GLU 35 Ca -0.32 0.00 -0.02 0.00 -1.00 0.00 0.00 59.36 58.02 2jyq h GLU 35 Cb 1.17 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 30.41 2jyq h GLU 35 CO 0.63 0.26 -0.09 1.15 -1.00 0.00 0.00 179.01 179.96 2jyq h THR 36 N 0.00 0.25 -2.66 1.13 2.02 -1.95 -3.41 112.91 108.28 2jyq h THR 36 Ca -0.01 -0.68 -0.15 0.00 0.77 0.00 0.00 66.41 66.34 2jyq h THR 36 Cb 1.21 1.54 -0.30 0.00 -1.74 0.00 0.00 68.15 68.87 2jyq h THR 36 CO 0.03 0.09 -0.44 -0.89 0.37 0.00 0.00 175.52 174.69 2jyq s THR 37 N -3.76 -0.54 -1.45 3.16 2.01 -1.23 -5.01 115.64 108.82 2jyq s THR 37 Ca 0.00 0.21 0.01 0.00 0.31 0.00 0.00 61.69 62.23 2jyq s THR 37 Cb 0.10 -0.57 0.04 0.00 0.01 0.00 0.00 72.50 72.08 2jyq s THR 37 CO 0.57 0.09 0.79 2.29 -0.69 0.00 0.00 174.62 177.67 2jyq n LYS 38 N 5.34 1.17 -0.59 4.92 2.85 -1.26 -3.11 118.16 127.48 2jyq n LYS 38 Ca -0.08 -0.17 0.03 0.00 -1.05 0.00 0.00 58.31 57.04 2jyq n LYS 38 Cb 0.50 -1.30 0.05 0.00 -0.65 0.00 0.00 35.03 33.62 2jyq n LYS 38 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 177.40 177.76 2jyq n GLY 39 N 0.29 1.88 3.02 2.58 0.00 -1.26 -4.98 105.19 106.73 2jyq n GLY 39 Ca 0.02 -0.49 -0.03 0.00 0.00 0.00 0.00 46.02 45.51 2jyq n GLY 39 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2jyq s ALA 40 N -0.86 -1.64 0.37 4.61 0.00 -1.18 -2.43 121.76 120.62 2jyq s ALA 40 Ca 0.16 1.25 -0.12 0.00 0.00 0.00 0.00 51.96 53.24 2jyq s ALA 40 Cb 0.16 -1.95 -0.07 0.00 0.00 0.00 0.00 23.12 21.25 2jyq s ALA 40 CO -0.03 -1.35 0.76 0.71 0.00 0.00 0.00 175.76 175.85 2jyq s TYR 41 N 2.69 3.43 -0.38 0.00 2.02 -0.04 -4.15 117.35 120.92 2jyq s TYR 41 Ca 0.16 1.12 -0.06 0.00 -0.37 0.00 0.00 57.07 57.92 2jyq s TYR 41 Cb -0.15 -2.49 0.07 0.00 -0.40 0.00 0.00 41.96 39.00 2jyq s TYR 41 CO -0.20 -0.03 0.17 0.00 -1.57 0.00 0.00 175.55 173.93 2jyq s LEU 43 N 1.34 5.11 -0.50 0.00 1.98 -0.27 -0.76 118.68 125.57 2jyq s LEU 43 Ca 0.02 -1.92 -0.24 0.00 -2.89 0.00 0.00 54.13 49.10 2jyq s LEU 43 Cb -0.22 -2.38 0.04 0.00 0.66 0.00 0.00 46.19 44.29 2jyq s LEU 43 CO 0.01 -1.08 0.86 -0.44 -1.89 0.00 0.00 176.35 173.81 2jyq s SER 44 N 3.55 6.38 -0.15 3.68 0.01 -0.37 -1.35 113.70 125.45 2jyq s SER 44 Ca 0.29 -0.24 -0.04 0.00 1.31 0.00 0.00 55.95 57.27 2jyq s SER 44 Cb -0.08 -2.41 -0.03 0.00 0.21 0.00 0.00 66.02 63.71 2jyq s SER 44 CO -0.06 -1.07 -0.02 0.54 0.41 0.00 0.00 173.24 173.04 2jyq s VAL 45 N 3.59 4.05 -0.18 3.43 0.11 -0.66 -1.95 120.40 128.80 2jyq s VAL 45 Ca 0.30 -0.30 -0.22 0.00 -2.93 0.00 0.00 61.98 58.82 2jyq s VAL 45 Cb -0.13 -2.78 -0.02 0.00 -1.53 0.00 0.00 36.38 31.93 2jyq s VAL 45 CO 0.21 0.50 0.70 -0.55 -3.33 0.00 0.00 175.10 172.63 2jyq s SER 46 N 0.27 6.80 -0.06 3.54 0.15 0.21 -0.45 113.70 124.17 2jyq s SER 46 Ca -0.02 0.98 0.06 0.00 0.70 0.00 0.00 55.95 57.67 2jyq s SER 46 Cb -0.14 -2.39 -0.01 0.00 -1.71 0.00 0.00 66.02 61.77 2jyq s SER 46 CO 0.02 -0.30 -0.25 -0.62 1.20 0.00 0.00 173.24 173.30 2jyq s ASP 47 N 1.14 3.00 0.10 5.45 2.15 0.75 -2.11 116.67 127.16 2jyq s ASP 47 Ca 0.33 -0.50 0.09 0.00 0.43 0.00 0.00 52.55 52.90 2jyq s ASP 47 Cb -0.16 -0.81 -0.04 0.00 -0.30 0.00 0.00 42.92 41.61 2jyq s ASP 47 CO 0.12 0.24 -0.19 0.12 -0.17 0.00 0.00 175.17 175.28 2jyq s PHE 48 N -0.16 2.51 0.01 -5.34 5.36 -1.26 -0.25 117.98 118.85 2jyq s PHE 48 Ca -0.03 -0.28 -0.01 0.00 -0.96 0.00 0.00 56.93 55.65 2jyq s PHE 48 Cb -0.14 -1.36 -0.01 0.00 -0.34 0.00 0.00 43.02 41.18 2jyq s PHE 48 CO 0.03 0.35 0.01 0.34 -1.46 0.00 0.00 175.22 174.50 2jyq s ASP 49 N -2.00 0.11 0.20 6.13 -1.08 -0.51 -4.92 116.67 114.60 2jyq s ASP 49 Ca 0.17 -0.26 0.24 0.00 -0.52 0.00 0.00 52.55 52.18 2jyq s ASP 49 Cb -0.10 0.10 0.91 0.00 -1.46 0.00 0.00 42.92 42.37 2jyq s ASP 49 CO 0.09 -0.20 1.72 -0.46 0.52 0.00 0.00 175.17 176.83 2jyq n ASN 50 N 2.11 0.59 0.00 -0.34 6.94 -1.26 -1.20 115.26 122.10 2jyq n ASN 50 Ca -0.20 0.61 0.00 0.00 -0.02 0.00 0.00 54.58 54.98 2jyq n ASN 50 Cb 0.57 -0.75 0.00 0.00 -2.36 0.00 0.00 39.78 37.24 2jyq n ASN 50 CO 0.00 0.00 0.00 0.00 -1.03 0.00 0.00 177.26 176.23 2jyq n ALA 51 N -1.73 1.97 0.10 -2.53 0.00 -1.26 -4.79 120.51 112.27 2jyq n ALA 51 Ca 0.04 0.00 0.02 0.00 0.00 0.00 0.00 53.44 53.49 2jyq n ALA 51 Cb 0.29 0.39 -0.02 0.00 0.00 0.00 0.00 19.45 20.11 2jyq n ALA 51 CO 0.00 0.00 0.00 -0.22 0.00 0.00 0.00 177.50 177.28 2jyq h LYS 52 N 0.00 0.00 0.00 0.00 3.64 -1.97 -3.50 116.57 114.74 2jyq h LYS 52 Ca 0.00 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.38 2jyq h LYS 52 Cb 0.87 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.69 2jyq h LYS 52 CO 0.00 0.42 0.00 0.41 -2.27 0.00 0.00 179.45 178.01 2jyq n GLY 53 N 1.29 -1.80 3.75 5.01 0.00 -0.34 -4.88 105.19 108.22 2jyq n GLY 53 Ca -0.02 -1.63 -0.40 0.00 0.00 0.00 0.00 46.02 43.97 2jyq n GLY 53 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2jyq s LEU 54 N 0.00 4.57 -0.10 0.99 1.43 -1.26 -1.43 118.68 122.88 2jyq s LEU 54 Ca 0.00 2.13 -0.14 0.00 -1.03 0.00 0.00 54.13 55.09 2jyq s LEU 54 Cb 0.00 -3.62 0.03 0.00 0.03 0.00 0.00 46.19 42.64 2jyq s LEU 54 CO 0.00 -0.06 0.37 0.54 0.23 0.00 0.00 176.35 177.44 2jyq s ASN 55 N -0.84 -0.35 -0.25 2.29 2.20 0.66 -5.00 114.94 113.66 2jyq s ASN 55 Ca 0.44 0.58 -0.07 0.00 -0.94 0.00 0.00 52.86 52.87 2jyq s ASN 55 Cb -0.29 0.64 -0.02 0.00 -2.00 0.00 0.00 41.25 39.57 2jyq s ASN 55 CO 0.37 -0.24 0.05 -0.69 -2.94 0.00 0.00 177.10 173.66 2jyq s VAL 56 N -0.27 4.14 -0.61 3.54 1.01 -1.26 -0.18 120.40 126.76 2jyq s VAL 56 Ca -0.04 -0.25 -0.19 0.00 0.00 0.00 0.00 61.98 61.50 2jyq s VAL 56 Cb -0.03 -2.93 0.10 0.00 0.00 0.00 0.00 36.38 33.52 2jyq s VAL 56 CO 0.02 0.34 0.74 -0.54 0.00 0.00 0.00 175.10 175.66 2jyq s LYS 57 N 1.59 3.08 -1.10 2.72 1.02 0.40 -4.92 119.74 122.53 2jyq s LYS 57 Ca 0.06 -1.33 -0.21 0.00 0.02 0.00 0.00 55.97 54.52 2jyq s LYS 57 Cb -0.15 -4.29 0.07 0.00 -0.52 0.00 0.00 37.83 32.94 2jyq s LYS 57 CO 0.02 -1.57 1.51 -1.01 -0.92 0.00 0.00 175.35 173.39 2jyq s HIS 58 N 2.73 2.68 0.31 3.18 3.76 -1.26 -1.65 115.29 125.04 2jyq s HIS 58 Ca 0.13 -1.15 -0.28 0.00 -0.15 0.00 0.00 55.06 53.62 2jyq s HIS 58 Cb -0.23 -4.68 -0.09 0.00 1.11 0.00 0.00 32.58 28.69 2jyq s HIS 58 CO 0.06 -1.85 1.05 0.71 -0.85 0.00 0.00 174.74 173.85 2jyq s TYR 59 N 4.49 3.57 -0.42 1.40 2.02 -0.45 -4.87 117.35 123.09 2jyq s TYR 59 Ca 0.47 1.73 -0.16 0.00 -0.37 0.00 0.00 57.07 58.74 2jyq s TYR 59 Cb 0.01 -3.16 0.03 0.00 -0.40 0.00 0.00 41.96 38.43 2jyq s TYR 59 CO -0.04 -0.35 0.37 -1.59 -1.57 0.00 0.00 175.55 172.36 2jyq s LYS 60 N -1.74 3.02 -0.92 -0.62 -2.85 -1.26 -1.12 119.74 114.25 2jyq s LYS 60 Ca 0.48 -0.96 -0.22 0.00 -1.00 0.00 0.00 55.97 54.27 2jyq s LYS 60 Cb -0.27 -4.00 0.08 0.00 -2.06 0.00 0.00 37.83 31.58 2jyq s LYS 60 CO 0.35 -0.83 1.27 0.42 0.10 0.00 0.00 175.35 176.66 2jyq s ILE 61 N 1.86 4.21 0.40 3.79 1.01 0.17 -4.47 121.20 128.18 2jyq s ILE 61 Ca 0.08 -0.87 -0.24 0.00 0.00 0.00 0.00 60.65 59.62 2jyq s ILE 61 Cb -0.19 -4.91 -0.09 0.00 0.01 0.00 0.00 42.46 37.28 2jyq s ILE 61 CO 0.11 -1.74 1.02 -0.13 0.00 0.00 0.00 174.94 174.20 2jyq s ARG 62 N 4.20 4.20 0.07 2.79 0.52 0.09 -0.86 118.95 129.96 2jyq s ARG 62 Ca 0.38 1.42 0.05 0.00 -0.52 0.00 0.00 55.73 57.06 2jyq s ARG 62 Cb -0.04 -2.49 -0.04 0.00 0.52 0.00 0.00 34.95 32.90 2jyq s ARG 62 CO -0.05 -0.09 -0.06 -1.59 0.02 0.00 0.00 175.30 173.53 2jyq s LYS 63 N -2.59 2.39 -0.20 3.54 -2.85 -1.02 0.25 119.74 119.25 2jyq s LYS 63 Ca 0.58 -0.88 0.04 0.00 -1.00 0.00 0.00 55.97 54.71 2jyq s LYS 63 Cb -0.19 -2.44 0.36 0.00 -2.06 0.00 0.00 37.83 33.50 2jyq s LYS 63 CO 0.24 0.54 1.37 1.28 0.10 0.00 0.00 175.35 178.88 2jyq n LEU 64 N 0.86 4.45 0.00 2.77 4.77 0.12 -4.92 117.00 125.05 2jyq n LEU 64 Ca -0.13 -2.32 0.00 0.00 -0.03 0.00 0.00 56.01 53.53 2jyq n LEU 64 Cb 0.52 -0.65 0.00 0.00 -2.33 0.00 0.00 43.42 40.96 2jyq n LEU 64 CO 0.35 0.68 0.00 -0.67 -1.33 0.00 0.00 177.39 176.42 2jyq n ASP 65 N -0.14 0.00 0.00 -1.43 -0.08 -1.26 -1.71 116.55 111.93 2jyq n ASP 65 Ca 0.25 0.00 0.00 0.00 -1.51 0.00 0.00 54.79 53.53 2jyq n ASP 65 Cb 0.99 0.00 0.00 0.00 2.34 0.00 0.00 41.12 44.45 2jyq n ASP 65 CO 0.00 0.00 0.00 -1.20 0.12 0.00 0.00 177.20 176.12 2jyq n SER 66 N 0.78 0.64 0.18 1.67 7.64 -1.26 -4.69 113.62 118.59 2jyq n SER 66 Ca 0.00 -0.31 0.13 0.00 1.01 0.00 0.00 58.87 59.70 2jyq n SER 66 Cb 0.00 0.75 0.27 0.00 -1.01 0.00 0.00 64.21 64.22 2jyq n SER 66 CO 0.00 0.00 0.00 1.23 -3.01 0.00 0.00 175.04 173.26 2jyq h GLY 67 N 0.00 0.00 0.00 0.23 0.00 -1.73 -3.50 103.07 98.08 2jyq h GLY 67 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 2jyq h GLY 67 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 176.54 177.15 2jyq n GLY 68 N 1.11 0.83 3.29 4.60 0.00 -1.26 -4.68 105.19 109.08 2jyq n GLY 68 Ca 0.04 -2.00 -0.31 0.00 0.00 0.00 0.00 46.02 43.75 2jyq n GLY 68 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 2jyq s PHE 69 N -1.53 2.31 -0.07 1.61 0.08 0.13 0.14 117.98 120.65 2jyq s PHE 69 Ca 0.00 -0.52 -0.03 0.00 0.12 0.00 0.00 56.93 56.50 2jyq s PHE 69 Cb 0.00 -1.50 0.04 0.00 -0.57 0.00 0.00 43.02 40.99 2jyq s PHE 69 CO 0.00 -0.10 0.16 1.52 -0.10 0.00 0.00 175.22 176.70 2jyq s TYR 70 N -0.45 -0.18 0.01 0.36 1.13 0.14 -0.71 117.35 117.65 2jyq s TYR 70 Ca 0.05 0.51 -0.19 0.00 -1.41 0.00 0.00 57.07 56.04 2jyq s TYR 70 Cb -0.11 -0.07 -0.28 0.00 -1.10 0.00 0.00 41.96 40.40 2jyq s TYR 70 CO 0.01 -0.17 1.03 0.82 -2.51 0.00 0.00 175.55 174.73 2jyq h ILE 71 N 6.03 1.40 -3.49 -3.49 2.04 -1.78 0.28 117.51 118.51 2jyq h ILE 71 Ca -0.43 -2.38 -0.66 0.00 1.00 0.00 0.00 64.86 62.40 2jyq h ILE 71 Cb 1.14 2.83 -0.17 0.00 -0.74 0.00 0.00 36.82 39.89 2jyq h ILE 71 CO 0.42 0.70 -0.77 0.28 0.00 0.00 0.00 178.15 178.77 2jyq s THR 72 N -2.87 2.99 -0.85 -0.27 -1.32 -1.26 -4.75 115.64 107.31 2jyq s THR 72 Ca -0.12 -1.53 0.00 0.00 -1.21 0.00 0.00 61.69 58.83 2jyq s THR 72 Cb 0.03 -2.41 0.00 0.00 -1.51 0.00 0.00 72.50 68.62 2jyq s THR 72 CO 0.87 0.04 0.46 -1.54 -2.21 0.00 0.00 174.62 172.24 2jyq n SER 73 N 0.56 1.05 -0.09 8.08 3.41 -1.26 -3.30 113.62 122.06 2jyq n SER 73 Ca -0.14 -1.61 -0.19 0.00 -0.26 0.00 0.00 58.87 56.68 2jyq n SER 73 Cb 0.53 -0.40 -0.06 0.00 -0.26 0.00 0.00 64.21 64.02 2jyq n SER 73 CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 175.04 175.42 2jyq n ARG 74 N 0.17 0.44 -3.96 4.33 5.12 -1.26 -4.98 116.66 116.52 2jyq n ARG 74 Ca 0.00 0.19 -0.30 0.00 -1.93 0.00 0.00 57.85 55.81 2jyq n ARG 74 Cb 0.23 -1.25 -0.16 0.00 -1.16 0.00 0.00 32.46 30.13 2jyq n ARG 74 CO 0.00 0.00 0.00 0.99 -1.93 0.00 0.00 177.63 176.69 2jyq s THR 75 N -2.47 1.57 0.11 0.55 2.01 -1.21 -5.11 115.64 111.08 2jyq s THR 75 Ca -0.28 -1.12 0.06 0.00 0.31 0.00 0.00 61.69 60.66 2jyq s THR 75 Cb 0.09 -1.75 -0.04 0.00 0.01 0.00 0.00 72.50 70.81 2jyq s THR 75 CO 0.36 0.01 -0.02 0.00 -0.69 0.00 0.00 174.62 174.29 2jyq s GLN 76 N 1.40 2.45 0.08 4.92 0.00 -1.26 -4.46 119.66 122.78 2jyq s GLN 76 Ca -0.04 -0.92 0.06 0.00 -0.00 0.00 0.00 55.36 54.46 2jyq s GLN 76 Cb -0.18 -2.47 -0.03 0.00 0.00 0.00 0.00 33.01 30.34 2jyq s GLN 76 CO -0.07 0.52 -0.17 -0.06 0.00 0.00 0.00 175.29 175.51 2jyq s PHE 77 N -1.37 1.44 -0.85 9.60 0.08 0.11 -4.87 117.98 122.12 2jyq s PHE 77 Ca 0.25 -0.44 0.25 0.00 0.12 0.00 0.00 56.93 57.12 2jyq s PHE 77 Cb -0.11 -0.80 0.97 0.00 -0.57 0.00 0.00 43.02 42.51 2jyq s PHE 77 CO 0.18 0.11 1.78 0.43 -0.10 0.00 0.00 175.22 177.61 2jyq n SER 78 N 1.25 0.33 -3.88 1.36 7.64 -1.26 0.18 113.62 119.24 2jyq n SER 78 Ca -0.20 0.54 -0.15 0.00 1.01 0.00 0.00 58.87 60.07 2jyq n SER 78 Cb 0.54 -0.63 -0.15 0.00 -1.01 0.00 0.00 64.21 62.96 2jyq n SER 78 CO 0.00 0.00 0.00 -0.44 -3.01 0.00 0.00 175.04 171.59 2jyq s SER 79 N -3.62 0.32 0.50 6.43 0.01 -1.26 -4.85 113.70 111.23 2jyq s SER 79 Ca 0.11 -0.04 0.29 0.00 1.31 0.00 0.00 55.95 57.62 2jyq s SER 79 Cb 0.14 -0.09 1.21 0.00 0.21 0.00 0.00 66.02 67.49 2jyq s SER 79 CO 0.49 -0.01 1.94 -0.07 0.41 0.00 0.00 173.24 175.99 2jyq h LEU 80 N 6.48 0.00 -0.11 2.44 3.38 -1.96 -2.14 115.31 123.39 2jyq h LEU 80 Ca -0.32 0.00 -0.01 0.00 0.09 0.00 0.00 57.88 57.64 2jyq h LEU 80 Cb 1.18 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.92 2jyq h LEU 80 CO 0.50 0.11 0.04 -0.61 0.09 0.00 0.00 178.44 178.57 2jyq h GLN 81 N 0.00 0.17 -0.39 1.13 -0.00 -1.99 -1.98 115.11 112.05 2jyq h GLN 81 Ca -0.00 -0.04 -0.03 0.00 -0.00 0.00 0.00 58.65 58.58 2jyq h GLN 81 Cb 0.58 -0.03 -0.02 0.00 0.00 0.00 0.00 27.48 28.01 2jyq h GLN 81 CO 0.01 0.31 0.10 1.96 0.00 0.00 0.00 178.83 181.21 2jyq h GLN 82 N -0.00 0.58 0.41 1.69 1.08 -1.90 -1.76 115.11 115.21 2jyq h GLN 82 Ca 0.04 -0.10 -0.01 0.00 -1.45 0.00 0.00 58.65 57.13 2jyq h GLN 82 Cb 0.21 -0.10 -0.02 0.00 -0.05 0.00 0.00 27.48 27.52 2jyq h GLN 82 CO -0.00 0.53 -0.39 1.25 -0.95 0.00 0.00 178.83 179.27 2jyq h LEU 83 N 0.57 -1.07 -0.67 1.46 7.12 -1.07 -1.06 115.31 120.60 2jyq h LEU 83 Ca 0.13 0.08 -0.04 0.00 0.13 0.00 0.00 57.88 58.19 2jyq h LEU 83 Cb 0.22 0.35 -0.03 0.00 -0.53 0.00 0.00 40.66 40.67 2jyq h LEU 83 CO -0.00 -0.52 0.26 -0.37 -0.13 0.00 0.00 178.44 177.67 2jyq h VAL 84 N -0.79 1.24 -0.32 1.05 -1.51 -1.27 -0.79 116.25 113.86 2jyq h VAL 84 Ca -0.05 -0.77 0.06 0.00 -1.23 0.00 0.00 66.70 64.71 2jyq h VAL 84 Cb 0.68 0.49 -0.05 0.00 -2.13 0.00 0.00 31.29 30.28 2jyq h VAL 84 CO -0.04 0.30 -0.02 0.00 -1.23 0.00 0.00 177.57 176.59 2jyq h ALA 85 N 1.11 0.27 -0.16 5.19 0.00 -1.26 -0.18 119.26 124.23 2jyq h ALA 85 Ca 0.22 0.10 -0.14 0.00 0.00 0.00 0.00 54.91 55.09 2jyq h ALA 85 Cb 0.22 0.17 0.00 0.00 0.00 0.00 0.00 17.79 18.18 2jyq h ALA 85 CO -0.02 -0.42 -0.45 -0.92 0.00 0.00 0.00 179.25 177.44 2jyq h TYR 86 N 0.07 0.77 0.00 0.00 3.20 -0.98 -3.07 116.97 116.96 2jyq h TYR 86 Ca 0.15 -0.30 0.00 0.00 3.14 0.00 0.00 58.73 61.72 2jyq h TYR 86 Cb 0.21 -0.13 0.00 0.00 1.54 0.00 0.00 36.73 38.35 2jyq h TYR 86 CO -0.24 1.07 0.00 0.66 -1.64 0.00 0.00 178.16 178.01 2jyq n TYR 87 N -4.23 0.00 0.21 -3.82 4.02 -0.32 -0.27 117.16 112.75 2jyq n TYR 87 Ca -0.07 0.00 0.10 0.00 -0.01 0.00 0.00 57.90 57.93 2jyq n TYR 87 Cb 0.57 -0.11 0.19 0.00 -0.02 0.00 0.00 39.34 39.97 2jyq n TYR 87 CO 0.00 0.00 0.00 1.03 -1.01 0.00 0.00 176.86 176.88 2jyq h SER 88 N 0.00 0.00 0.00 7.72 0.87 -0.92 -1.94 113.55 119.28 2jyq h SER 88 Ca 0.00 0.00 -0.25 0.00 -1.23 0.00 0.00 61.79 60.31 2jyq h SER 88 Cb 0.08 0.00 -0.04 0.00 -0.44 0.00 0.00 62.40 62.01 2jyq h SER 88 CO 0.00 0.11 -1.85 0.29 -0.53 0.00 0.00 176.83 174.86 2jyq n LYS 89 N -3.14 0.32 -3.73 2.24 5.02 -0.45 -4.32 118.16 114.11 2jyq n LYS 89 Ca 0.03 0.14 -0.37 0.00 -2.02 0.00 0.00 58.31 56.09 2jyq n LYS 89 Cb 0.55 -1.05 -0.11 0.00 -0.02 0.00 0.00 35.03 34.40 2jyq n LYS 89 CO 0.00 0.00 0.00 -1.01 -0.52 0.00 0.00 177.40 175.87 2jyq s HIS 90 N -2.28 3.52 0.25 2.13 3.76 0.63 -4.93 115.29 118.37 2jyq s HIS 90 Ca -0.21 -2.22 0.03 0.00 -0.15 0.00 0.00 55.06 52.51 2jyq s HIS 90 Cb 0.08 -3.17 0.30 0.00 1.11 0.00 0.00 32.58 30.90 2jyq s HIS 90 CO 0.27 -0.95 1.62 0.00 -0.85 0.00 0.00 174.74 174.82 2jyq h ALA 91 N 8.14 0.93 -0.85 -1.40 0.00 -1.81 -3.30 119.26 120.97 2jyq h ALA 91 Ca -0.16 -0.46 0.00 0.00 0.00 0.00 0.00 54.91 54.30 2jyq h ALA 91 Cb 1.06 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 18.75 2jyq h ALA 91 CO 0.72 0.65 0.00 -3.47 0.00 0.00 0.00 179.25 177.14 2jyq n ASP 92 N -3.99 0.00 0.07 0.00 -0.08 -1.26 -2.02 116.55 109.27 2jyq n ASP 92 Ca -0.02 0.00 -0.22 0.00 -1.51 0.00 0.00 54.79 53.04 2jyq n ASP 92 Cb 0.53 0.00 -0.15 0.00 2.34 0.00 0.00 41.12 43.84 2jyq n ASP 92 CO 0.00 0.00 0.00 1.23 0.12 0.00 0.00 177.20 178.55 2jyq h GLY 93 N 0.00 0.43 -3.34 0.27 0.00 -1.96 -3.46 103.07 95.01 2jyq h GLY 93 Ca 0.00 -1.09 -0.54 0.00 0.00 0.00 0.00 47.33 45.70 2jyq h GLY 93 CO 0.00 0.96 0.65 1.08 0.00 0.00 0.00 176.54 179.23 2jyq s LEU 94 N -7.64 4.13 0.40 3.11 1.02 -0.86 -4.90 118.68 113.94 2jyq s LEU 94 Ca -0.14 2.78 0.28 0.00 0.02 0.00 0.00 54.13 57.06 2jyq s LEU 94 Cb 0.03 -3.96 0.95 0.00 0.02 0.00 0.00 46.19 43.23 2jyq s LEU 94 CO 0.85 -1.07 1.80 0.00 0.02 0.00 0.00 176.35 177.96 2jyq s HIS 96 N -3.38 0.01 0.37 0.00 5.65 -1.26 -5.10 115.29 111.58 2jyq s HIS 96 Ca 0.05 0.13 -0.26 0.00 0.25 0.00 0.00 55.06 55.22 2jyq s HIS 96 Cb 0.09 -0.16 -0.09 0.00 -1.18 0.00 0.00 32.58 31.23 2jyq s HIS 96 CO 0.54 -0.07 1.22 -0.98 -0.65 0.00 0.00 174.74 174.80 2jyq s ARG 97 N 0.80 4.16 -0.24 2.88 3.03 -1.26 -4.87 118.95 123.44 2jyq s ARG 97 Ca -0.07 1.98 -0.28 0.00 2.03 0.00 0.00 55.73 59.39 2jyq s ARG 97 Cb -0.09 -2.83 -0.05 0.00 -1.03 0.00 0.00 34.95 30.95 2jyq s ARG 97 CO -0.02 -0.27 2.19 -0.51 -1.13 0.00 0.00 175.30 175.55 2jyq s LEU 98 N -2.23 3.44 -0.26 -1.89 1.43 -0.73 -4.82 118.68 113.62 2jyq s LEU 98 Ca 0.54 1.81 -0.15 0.00 -1.03 0.00 0.00 54.13 55.30 2jyq s LEU 98 Cb -0.34 -3.49 -0.12 0.00 0.03 0.00 0.00 46.19 42.27 2jyq s LEU 98 CO 0.44 -1.97 -0.31 0.41 0.23 0.00 0.00 176.35 175.15 2jyq n THR 99 N 7.74 1.52 -3.86 5.49 -1.04 -0.72 -4.38 114.28 119.04 2jyq n THR 99 Ca 0.29 -0.28 -0.11 0.00 -2.04 0.00 0.00 64.05 61.91 2jyq n THR 99 Cb 0.45 -1.96 -0.10 0.00 -1.82 0.00 0.00 70.33 66.90 2jyq n THR 99 CO 0.00 0.00 0.00 0.54 -0.64 0.00 0.00 175.07 174.97 2jyq s ASN 100 N -7.21 -0.01 0.14 8.00 2.20 -0.33 -4.99 114.94 112.75 2jyq s ASN 100 Ca -0.36 -0.14 -0.16 0.00 -0.94 0.00 0.00 52.86 51.26 2jyq s ASN 100 Cb 0.13 0.23 -0.07 0.00 -2.00 0.00 0.00 41.25 39.53 2jyq s ASN 100 CO 0.49 -0.34 0.58 -0.69 -2.94 0.00 0.00 177.10 174.20 2jyq s VAL 101 N -1.24 4.78 0.08 3.54 1.01 -1.26 -0.08 120.40 127.24 2jyq s VAL 101 Ca -0.13 0.99 -0.34 0.00 0.00 0.00 0.00 61.98 62.50 2jyq s VAL 101 Cb -0.07 -3.79 -0.13 0.00 0.00 0.00 0.00 36.38 32.39 2jyq s VAL 101 CO 0.02 0.30 1.70 0.00 0.00 0.00 0.00 175.10 177.12 2jyq s PRO 103 N 2.05 4.25 0.46 0.00 0.02 -1.26 -5.03 135.00 135.49 2jyq s PRO 103 Ca 0.83 2.26 0.07 0.00 0.02 0.00 0.00 61.00 64.18 2jyq s PRO 103 Cb -0.66 -3.21 0.07 0.00 0.02 0.00 0.00 34.50 30.72 2jyq s PRO 103 CO 0.42 -0.56 0.57 -2.37 -0.33 0.00 0.00 177.00 174.73 2jyq n THR 104 N 4.01 0.00 -2.81 0.99 5.66 -1.26 -4.84 114.28 116.04 2jyq n THR 104 Ca 0.13 -1.59 -0.01 0.00 -3.05 0.00 0.00 64.05 59.53 2jyq n THR 104 Cb 0.40 -0.50 0.00 0.00 -1.55 0.00 0.00 70.33 68.68 2jyq n THR 104 CO 0.00 0.00 0.00 -1.20 -3.05 0.00 0.00 175.07 170.82 2jyq n SER 105 N -2.33 -6.77 -0.40 1.09 7.64 -1.26 -5.26 113.62 106.33 2jyq n SER 105 Ca 0.10 -0.09 0.05 0.00 1.01 0.00 0.00 58.87 59.94 2jyq n SER 105 Cb 0.48 -4.58 0.04 0.00 -1.01 0.00 0.00 64.21 59.14 2jyq n SER 105 CO 0.00 0.00 0.00 1.17 -3.01 0.00 0.00 175.04 173.20