#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 -0.11 -0.16 -1.58 0.00 -1.26 -5.15 121.76 113.50 2jyq s ALA 2 Ca 0.00 -0.83 0.01 0.00 0.00 0.00 0.00 51.96 51.14 2jyq s ALA 2 Cb 0.00 0.92 0.01 0.00 0.00 0.00 0.00 23.12 24.05 2jyq s ALA 2 CO 0.00 -0.70 -0.19 -1.21 0.00 0.00 0.00 175.76 173.66 2jyq s GLU 3 N -3.97 3.07 0.42 0.00 2.02 -1.26 -5.02 118.70 113.95 2jyq s GLU 3 Ca 0.18 -0.81 0.15 0.00 0.02 0.00 0.00 54.97 54.51 2jyq s GLU 3 Cb 0.02 -2.56 1.04 0.00 0.10 0.00 0.00 34.13 32.73 2jyq s GLU 3 CO 0.02 -0.09 1.90 0.93 0.02 0.00 0.00 175.26 178.04 2jyq h GLU 4 N 7.59 0.43 0.13 1.61 4.39 -2.01 -1.42 114.58 125.30 2jyq h GLU 4 Ca -0.38 -0.03 -0.30 0.00 0.34 0.00 0.00 59.36 59.00 2jyq h GLU 4 Cb 1.17 -0.10 0.00 0.00 -0.10 0.00 0.00 28.75 29.73 2jyq h GLU 4 CO 0.59 0.28 -1.42 0.11 -1.16 0.00 0.00 179.01 177.41 2jyq h TRP 5 N 0.44 0.52 -3.57 4.33 5.08 -1.95 -3.44 115.95 117.36 2jyq h TRP 5 Ca 0.39 -0.38 -0.62 0.00 1.08 0.00 0.00 58.89 59.37 2jyq h TRP 5 Cb 0.89 -0.02 -0.12 0.00 -3.00 0.00 0.00 29.16 26.91 2jyq h TRP 5 CO -0.00 1.36 0.45 -0.47 -1.28 0.00 0.00 178.44 178.50 2jyq s TYR 6 N -2.63 2.94 -0.38 0.12 5.04 -0.54 -1.57 117.35 120.33 2jyq s TYR 6 Ca -0.07 0.19 0.12 0.00 -2.44 0.00 0.00 57.07 54.87 2jyq s TYR 6 Cb 0.07 -3.82 0.70 0.00 0.35 0.00 0.00 41.96 39.26 2jyq s TYR 6 CO 0.87 -1.08 1.56 1.19 -1.34 0.00 0.00 175.55 176.76 2jyq n PHE 7 N 6.96 1.76 -4.72 4.97 3.01 -0.66 -4.45 117.46 124.33 2jyq n PHE 7 Ca 0.03 -0.61 0.00 0.00 1.01 0.00 0.00 57.45 57.88 2jyq n PHE 7 Cb 0.48 -0.45 0.00 0.00 -0.01 0.00 0.00 39.48 39.50 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 0.55 2.02 3.19 1.37 0.00 -1.26 -4.14 105.19 106.92 2jyq n GLY 8 Ca 0.24 -0.56 -0.40 0.00 0.00 0.00 0.00 46.02 45.30 2jyq n GLY 8 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2jyq s LYS 9 N 0.00 3.14 0.17 1.61 1.02 -1.26 0.10 119.74 124.52 2jyq s LYS 9 Ca 0.00 -2.69 0.04 0.00 0.02 0.00 0.00 55.97 53.34 2jyq s LYS 9 Cb 0.00 -4.05 -0.04 0.00 -0.52 0.00 0.00 37.83 33.23 2jyq s LYS 9 CO 0.00 -1.23 0.21 0.96 -0.92 0.00 0.00 175.35 174.37 2jyq s ILE 10 N -0.31 4.85 0.80 2.17 -4.36 -1.26 -4.97 121.20 118.12 2jyq s ILE 10 Ca 0.20 -0.96 -0.09 0.00 -0.26 0.00 0.00 60.65 59.55 2jyq s ILE 10 Cb -0.14 -3.51 0.13 0.00 1.25 0.00 0.00 42.46 40.19 2jyq s ILE 10 CO -0.07 -0.14 1.12 0.42 0.24 0.00 0.00 174.94 176.52 2jyq s THR 11 N -1.80 2.13 0.12 8.37 -4.23 -1.26 -4.88 115.64 114.09 2jyq s THR 11 Ca 0.33 -0.25 -0.20 0.00 -1.18 0.00 0.00 61.69 60.39 2jyq s THR 11 Cb -0.10 -2.88 -0.08 0.00 1.34 0.00 0.00 72.50 70.78 2jyq s THR 11 CO 0.26 0.00 1.77 0.03 -0.54 0.00 0.00 174.62 176.13 2jyq h ARG 12 N -0.97 0.20 -0.77 3.99 3.08 -2.00 -2.46 114.38 115.46 2jyq h ARG 12 Ca -0.42 -0.01 0.09 0.00 0.07 0.00 0.00 59.98 59.71 2jyq h ARG 12 Cb 1.28 -0.05 -0.07 0.00 0.08 0.00 0.00 29.97 31.21 2jyq h ARG 12 CO 0.48 0.14 0.42 -0.09 -1.07 0.00 0.00 179.97 179.84 2jyq h ARG 13 N 0.21 0.68 0.05 0.04 2.43 -1.98 0.33 114.38 116.15 2jyq h ARG 13 Ca 0.07 -0.04 0.02 0.00 -0.81 0.00 0.00 59.98 59.21 2jyq h ARG 13 Cb -0.01 -0.15 -0.02 0.00 -0.42 0.00 0.00 29.97 29.36 2jyq h ARG 13 CO -0.03 0.45 -0.14 0.93 -1.51 0.00 0.00 179.97 179.67 2jyq h GLU 14 N 0.70 -0.25 -0.11 0.20 4.39 -1.85 0.30 114.58 117.96 2jyq h GLU 14 Ca 0.38 0.02 -0.02 0.00 0.34 0.00 0.00 59.36 60.07 2jyq h GLU 14 Cb 0.36 0.06 -0.00 0.00 -0.10 0.00 0.00 28.75 29.07 2jyq h GLU 14 CO -0.26 -0.17 -0.03 1.03 -1.16 0.00 0.00 179.01 178.43 2jyq h SER 15 N -0.26 0.21 -0.47 1.42 0.87 -0.85 -3.04 113.55 111.43 2jyq h SER 15 Ca 0.03 -0.37 -0.08 0.00 -1.23 0.00 0.00 61.79 60.14 2jyq h SER 15 Cb 0.30 -0.06 -0.02 0.00 -0.44 0.00 0.00 62.40 62.18 2jyq h SER 15 CO -0.10 0.53 -0.04 -0.33 -0.53 0.00 0.00 176.83 176.36 2jyq h GLU 16 N -0.11 0.85 -0.89 2.24 5.08 -0.35 -1.96 114.58 119.44 2jyq h GLU 16 Ca 0.03 -0.29 0.09 0.00 -1.00 0.00 0.00 59.36 58.19 2jyq h GLU 16 Cb 0.44 -0.07 -0.07 0.00 0.50 0.00 0.00 28.75 29.55 2jyq h GLU 16 CO 0.01 0.92 0.54 -0.09 -1.00 0.00 0.00 179.01 179.39 2jyq h ARG 17 N 0.69 0.89 -0.07 2.33 2.43 -0.96 0.89 114.38 120.58 2jyq h ARG 17 Ca 0.13 -0.05 -0.13 0.00 -0.81 0.00 0.00 59.98 59.11 2jyq h ARG 17 Cb 0.56 -0.20 0.01 0.00 -0.42 0.00 0.00 29.97 29.91 2jyq h ARG 17 CO 0.03 0.59 -0.47 -0.07 -1.51 0.00 0.00 179.97 178.54 2jyq h LEU 18 N 0.92 0.54 -0.19 3.80 3.38 -1.39 -3.30 115.31 119.07 2jyq h LEU 18 Ca 0.42 -0.67 -0.12 0.00 0.09 0.00 0.00 57.88 57.60 2jyq h LEU 18 Cb 0.33 -0.16 -0.02 0.00 0.09 0.00 0.00 40.66 40.90 2jyq h LEU 18 CO -0.23 1.12 -0.58 -0.07 0.09 0.00 0.00 178.44 178.77 2jyq h LEU 19 N -0.00 0.00 -0.13 1.67 3.38 -1.02 -2.93 115.31 116.27 2jyq h LEU 19 Ca -0.04 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.93 2jyq h LEU 19 Cb 1.13 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.88 2jyq h LEU 19 CO 0.10 0.58 0.00 0.18 0.09 0.00 0.00 178.44 179.39 2jyq n LEU 20 N -3.32 0.20 -4.75 1.67 7.99 0.28 -4.76 117.00 114.31 2jyq n LEU 20 Ca 0.01 -0.08 -0.41 0.00 -0.01 0.00 0.00 56.01 55.52 2jyq n LEU 20 Cb 0.73 -0.01 -0.04 0.00 -0.11 0.00 0.00 43.42 43.99 2jyq n LEU 20 CO 0.41 0.04 0.82 0.20 -1.51 0.00 0.00 177.39 177.35 2jyq s ASN 21 N -1.61 7.21 0.00 -1.43 0.01 -1.11 -4.90 114.94 113.11 2jyq s ASN 21 Ca 0.30 2.24 0.00 0.00 -0.71 0.00 0.00 52.86 54.69 2jyq s ASN 21 Cb 0.14 -2.62 0.00 0.00 0.41 0.00 0.00 41.25 39.18 2jyq s ASN 21 CO 0.23 -0.22 0.67 -0.81 -1.51 0.00 0.00 177.10 175.46 2jyq n PRO 22 N 1.72 0.64 0.00 -0.60 -0.04 -1.26 -2.55 135.00 132.91 2jyq n PRO 22 Ca 0.01 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.47 2jyq n PRO 22 Cb 0.45 -1.18 0.00 0.00 -0.04 0.00 0.00 33.50 32.73 2jyq n PRO 22 CO 0.00 0.00 0.00 0.39 -0.04 0.00 0.00 175.50 175.85 2jyq n GLU 23 N 0.72 1.85 -3.74 0.54 1.02 -1.26 -4.98 120.64 114.79 2jyq n GLU 23 Ca 0.00 -1.19 -0.37 0.00 -0.02 0.00 0.00 57.16 55.58 2jyq n GLU 23 Cb 0.32 -0.97 -0.12 0.00 -0.02 0.00 0.00 31.44 30.65 2jyq n GLU 23 CO 0.00 0.00 0.00 -0.80 1.18 0.00 0.00 177.13 177.51 2jyq s ASN 24 N -0.70 5.20 0.45 1.62 0.01 -1.06 -5.03 114.94 115.45 2jyq s ASN 24 Ca 0.00 -0.67 -0.23 0.00 -0.71 0.00 0.00 52.86 51.25 2jyq s ASN 24 Cb 0.00 -1.90 -0.07 0.00 0.41 0.00 0.00 41.25 39.68 2jyq s ASN 24 CO 0.00 -0.19 1.19 -2.16 -1.51 0.00 0.00 177.10 174.43 2jyq s PRO 25 N 1.52 3.78 -0.11 -0.60 0.04 -1.26 -4.94 135.00 133.43 2jyq s PRO 25 Ca 0.03 1.84 -0.29 0.00 0.04 0.00 0.00 61.00 62.62 2jyq s PRO 25 Cb -0.17 -2.46 -0.07 0.00 0.04 0.00 0.00 34.50 31.84 2jyq s PRO 25 CO 0.03 -0.55 2.08 0.50 0.04 0.00 0.00 177.00 179.10 2jyq s ARG 26 N -2.62 3.60 0.00 4.56 3.52 -1.26 -1.63 118.95 125.13 2jyq s ARG 26 Ca 0.63 2.26 0.00 0.00 -0.13 0.00 0.00 55.73 58.49 2jyq s ARG 26 Cb -0.30 -4.26 0.00 0.00 -1.56 0.00 0.00 34.95 28.82 2jyq s ARG 26 CO 0.37 -1.56 0.00 0.41 -0.81 0.00 0.00 175.30 173.70 2jyq n GLY 27 N 5.17 0.93 3.59 8.12 0.00 -0.51 -4.94 105.19 117.55 2jyq n GLY 27 Ca 0.25 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.84 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 -1.67 4.52 0.25 2.61 2.01 -0.64 -2.19 115.64 120.52 2jyq s THR 28 Ca 0.00 1.02 0.11 0.00 0.31 0.00 0.00 61.69 63.13 2jyq s THR 28 Cb 0.00 -4.39 -0.05 0.00 0.01 0.00 0.00 72.50 68.08 2jyq s THR 28 CO 0.00 -0.68 -0.13 0.72 -0.69 0.00 0.00 174.62 173.84 2jyq s PHE 29 N 3.63 2.46 -0.19 4.92 -0.71 -0.17 0.75 117.98 128.67 2jyq s PHE 29 Ca 0.38 -0.29 -0.16 0.00 -1.04 0.00 0.00 56.93 55.82 2jyq s PHE 29 Cb -0.11 -1.12 0.05 0.00 -1.21 0.00 0.00 43.02 40.64 2jyq s PHE 29 CO 0.22 0.63 0.50 -0.48 -1.34 0.00 0.00 175.22 174.75 2jyq s LEU 30 N -3.33 -0.01 -0.26 -1.99 2.34 -0.43 -0.47 118.68 114.54 2jyq s LEU 30 Ca 0.28 1.03 -0.06 0.00 0.06 0.00 0.00 54.13 55.44 2jyq s LEU 30 Cb -0.06 1.72 -0.01 0.00 -0.56 0.00 0.00 46.19 47.27 2jyq s LEU 30 CO 0.16 -0.18 0.04 0.54 -1.06 0.00 0.00 176.35 175.85 2jyq s VAL 31 N 0.50 3.91 0.09 1.48 0.11 -0.61 -1.45 120.40 124.43 2jyq s VAL 31 Ca -0.02 -0.44 0.06 0.00 -2.93 0.00 0.00 61.98 58.65 2jyq s VAL 31 Cb -0.04 -2.88 -0.04 0.00 -1.53 0.00 0.00 36.38 31.89 2jyq s VAL 31 CO -0.02 0.28 -0.06 0.00 -3.33 0.00 0.00 175.10 171.96 2jyq s ARG 32 N 1.54 2.33 -0.12 1.54 1.70 -0.54 -1.66 118.95 123.74 2jyq s ARG 32 Ca 0.05 -0.92 -0.17 0.00 -0.47 0.00 0.00 55.73 54.21 2jyq s ARG 32 Cb -0.16 -2.41 -0.04 0.00 -0.57 0.00 0.00 34.95 31.77 2jyq s ARG 32 CO 0.01 0.53 0.45 -2.00 -1.08 0.00 0.00 175.30 173.21 2jyq s GLU 33 N -2.17 4.31 -0.50 3.89 2.12 0.12 0.14 118.70 126.60 2jyq s GLU 33 Ca 0.23 0.40 -0.08 0.00 0.36 0.00 0.00 54.97 55.88 2jyq s GLU 33 Cb -0.11 -3.42 0.13 0.00 0.26 0.00 0.00 34.13 30.98 2jyq s GLU 33 CO 0.15 0.19 0.37 0.45 -0.54 0.00 0.00 175.26 175.88 2jyq s SER 34 N 0.52 5.68 0.00 -1.70 0.15 -0.18 -4.39 113.70 113.78 2jyq s SER 34 Ca 0.25 -2.06 0.19 0.00 0.70 0.00 0.00 55.95 55.03 2jyq s SER 34 Cb -0.15 -1.99 1.08 0.00 -1.71 0.00 0.00 66.02 63.25 2jyq s SER 34 CO 0.10 -0.65 1.56 -1.84 1.20 0.00 0.00 173.24 173.61 2jyq n GLU 35 N 4.69 0.49 0.29 5.44 0.28 -1.26 -1.26 120.64 129.32 2jyq n GLU 35 Ca -0.05 0.04 0.19 0.00 -0.16 0.00 0.00 57.16 57.19 2jyq n GLU 35 Cb 0.41 -1.50 0.93 0.00 1.43 0.00 0.00 31.44 32.71 2jyq n GLU 35 CO 0.00 0.00 0.00 1.79 -0.16 0.00 0.00 177.13 178.76 2jyq h THR 36 N 0.00 0.00 -2.22 3.84 1.35 -1.92 -3.43 112.91 110.53 2jyq h THR 36 Ca 0.00 -0.23 -0.59 0.00 -0.55 0.00 0.00 66.41 65.03 2jyq h THR 36 Cb 0.06 1.19 -0.13 0.00 -1.73 0.00 0.00 68.15 67.55 2jyq h THR 36 CO 0.00 0.00 -0.72 -0.89 -0.25 0.00 0.00 175.52 173.66 2jyq s THR 37 N -3.87 2.79 -1.43 6.82 2.01 -0.39 -5.04 115.64 116.53 2jyq s THR 37 Ca -0.02 -2.25 -0.15 0.00 0.31 0.00 0.00 61.69 59.59 2jyq s THR 37 Cb 0.11 -2.47 0.05 0.00 0.01 0.00 0.00 72.50 70.20 2jyq s THR 37 CO 0.46 -0.39 2.13 0.29 -0.69 0.00 0.00 174.62 176.42 2jyq n LYS 38 N -0.69 2.93 -1.23 4.92 4.76 -1.26 -3.95 118.16 123.63 2jyq n LYS 38 Ca -0.06 -2.74 0.00 0.00 -2.87 0.00 0.00 58.31 52.64 2jyq n LYS 38 Cb 0.60 -3.32 0.00 0.00 -1.84 0.00 0.00 35.03 30.46 2jyq n LYS 38 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 2jyq n GLY 39 N 4.32 1.04 3.86 0.72 0.00 -1.26 -4.98 105.19 108.89 2jyq n GLY 39 Ca 0.51 -0.49 -0.37 0.00 0.00 0.00 0.00 46.02 45.67 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 -2.13 3.80 0.35 4.61 0.00 -1.25 -4.71 121.76 122.42 2jyq s ALA 40 Ca 0.00 -0.45 0.09 0.00 0.00 0.00 0.00 51.96 51.60 2jyq s ALA 40 Cb 0.00 -2.16 -0.06 0.00 0.00 0.00 0.00 23.12 20.90 2jyq s ALA 40 CO 0.00 0.57 -0.01 0.71 0.00 0.00 0.00 175.76 177.03 2jyq s TYR 41 N -1.12 2.51 -0.24 0.00 1.51 0.55 -1.02 117.35 119.54 2jyq s TYR 41 Ca 0.22 -0.47 0.00 0.00 -1.01 0.00 0.00 57.07 55.80 2jyq s TYR 41 Cb -0.14 -1.50 0.07 0.00 -0.11 0.00 0.00 41.96 40.28 2jyq s TYR 41 CO 0.11 0.49 -0.02 0.00 -1.11 0.00 0.00 175.55 175.02 2jyq s LEU 43 N 1.48 5.10 -0.20 0.00 1.98 0.62 -1.47 118.68 126.19 2jyq s LEU 43 Ca -0.03 -2.02 -0.21 0.00 -2.89 0.00 0.00 54.13 48.99 2jyq s LEU 43 Cb -0.18 -2.39 -0.02 0.00 0.66 0.00 0.00 46.19 44.25 2jyq s LEU 43 CO -0.08 -1.06 0.63 -0.44 -1.89 0.00 0.00 176.35 173.51 2jyq s SER 44 N 3.58 6.68 -0.14 3.68 0.01 -0.53 -1.09 113.70 125.89 2jyq s SER 44 Ca 0.31 0.83 -0.01 0.00 1.31 0.00 0.00 55.95 58.39 2jyq s SER 44 Cb -0.06 -2.35 -0.02 0.00 0.21 0.00 0.00 66.02 63.80 2jyq s SER 44 CO -0.08 -0.28 -0.10 0.54 0.41 0.00 0.00 173.24 173.73 2jyq s VAL 45 N 1.94 3.36 -0.04 3.43 0.11 -0.42 -1.31 120.40 127.48 2jyq s VAL 45 Ca 0.29 -0.55 -0.30 0.00 -2.93 0.00 0.00 61.98 58.49 2jyq s VAL 45 Cb -0.16 -2.44 -0.06 0.00 -1.53 0.00 0.00 36.38 32.20 2jyq s VAL 45 CO 0.10 0.52 1.57 -0.55 -3.33 0.00 0.00 175.10 173.41 2jyq s SER 46 N 0.31 6.72 0.18 3.54 0.15 0.23 -1.07 113.70 123.76 2jyq s SER 46 Ca -0.08 2.20 0.10 0.00 0.70 0.00 0.00 55.95 58.88 2jyq s SER 46 Cb -0.15 -2.54 -0.04 0.00 -1.71 0.00 0.00 66.02 61.57 2jyq s SER 46 CO 0.05 -0.87 -0.22 -0.62 1.20 0.00 0.00 173.24 172.78 2jyq s ASP 47 N 2.82 3.11 -0.34 5.45 2.15 0.52 -1.42 116.67 128.97 2jyq s ASP 47 Ca 0.70 -0.86 -0.01 0.00 0.43 0.00 0.00 52.55 52.81 2jyq s ASP 47 Cb -0.33 -0.21 0.12 0.00 -0.30 0.00 0.00 42.92 42.19 2jyq s ASP 47 CO 0.28 0.06 0.16 0.12 -0.17 0.00 0.00 175.17 175.62 2jyq s PHE 48 N -1.80 1.11 -0.12 -5.34 2.19 -1.26 -0.68 117.98 112.08 2jyq s PHE 48 Ca 0.18 -1.58 -0.29 0.00 0.33 0.00 0.00 56.93 55.57 2jyq s PHE 48 Cb -0.07 -1.31 -0.04 0.00 -1.31 0.00 0.00 43.02 40.29 2jyq s PHE 48 CO 0.08 -0.84 1.61 -0.51 1.83 0.00 0.00 175.22 177.40 2jyq s ASP 49 N 1.41 6.58 -1.22 6.13 1.01 -0.67 -4.88 116.67 125.03 2jyq s ASP 49 Ca 0.13 1.98 -0.08 0.00 0.71 0.00 0.00 52.55 55.29 2jyq s ASP 49 Cb -0.20 -2.53 -0.07 0.00 1.01 0.00 0.00 42.92 41.13 2jyq s ASP 49 CO -0.18 -1.04 2.47 -3.20 0.21 0.00 0.00 175.17 173.43 2jyq n ASN 50 N 7.59 6.46 0.00 0.27 5.15 -1.26 -0.98 115.26 132.49 2jyq n ASN 50 Ca 0.18 -2.45 0.00 0.00 -0.60 0.00 0.00 54.58 51.71 2jyq n ASN 50 Cb 0.44 -1.30 0.00 0.00 -0.53 0.00 0.00 39.78 38.38 2jyq n ASN 50 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 2jyq n ALA 51 N 4.08 0.00 -0.02 5.20 0.00 -1.26 -5.01 120.51 123.50 2jyq n ALA 51 Ca 0.59 0.00 -0.03 0.00 0.00 0.00 0.00 53.44 54.00 2jyq n ALA 51 Cb 0.19 0.00 -0.01 0.00 0.00 0.00 0.00 19.45 19.62 2jyq n ALA 51 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 2jyq n LYS 52 N -0.29 0.20 0.00 0.00 4.76 -0.45 -5.15 118.16 117.23 2jyq n LYS 52 Ca 0.00 0.08 0.00 0.00 -2.87 0.00 0.00 58.31 55.52 2jyq n LYS 52 Cb 0.00 -0.77 0.00 0.00 -1.84 0.00 0.00 35.03 32.42 2jyq n LYS 52 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 2jyq n GLY 53 N 2.32 0.75 3.71 0.72 0.00 -0.15 -4.96 105.19 107.56 2jyq n GLY 53 Ca -0.05 -1.67 -0.42 0.00 0.00 0.00 0.00 46.02 43.87 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 4.35 0.34 0.99 1.43 -1.26 -1.67 118.68 122.86 2jyq s LEU 54 Ca 0.00 2.10 -0.07 0.00 -1.03 0.00 0.00 54.13 55.12 2jyq s LEU 54 Cb 0.00 -3.57 0.02 0.00 0.03 0.00 0.00 46.19 42.66 2jyq s LEU 54 CO 0.00 -0.59 0.56 0.54 0.23 0.00 0.00 176.35 177.09 2jyq s ASN 55 N 1.30 0.57 -0.16 2.29 2.20 0.15 -4.99 114.94 116.29 2jyq s ASN 55 Ca 0.61 -1.33 0.01 0.00 -0.94 0.00 0.00 52.86 51.20 2jyq s ASN 55 Cb -0.31 0.70 0.02 0.00 -2.00 0.00 0.00 41.25 39.66 2jyq s ASN 55 CO 0.28 -1.38 -0.16 -0.69 -2.94 0.00 0.00 177.10 172.21 2jyq s VAL 56 N -2.98 1.71 -0.58 3.54 1.01 -1.26 -0.35 120.40 121.49 2jyq s VAL 56 Ca 0.26 -0.72 -0.23 0.00 0.00 0.00 0.00 61.98 61.28 2jyq s VAL 56 Cb -0.02 -1.59 0.05 0.00 0.00 0.00 0.00 36.38 34.83 2jyq s VAL 56 CO 0.17 0.48 0.93 -0.54 0.00 0.00 0.00 175.10 176.14 2jyq s LYS 57 N 1.43 3.25 -1.09 2.72 1.02 -0.23 -4.91 119.74 121.93 2jyq s LYS 57 Ca 0.05 -0.47 -0.19 0.00 0.02 0.00 0.00 55.97 55.38 2jyq s LYS 57 Cb -0.13 -4.11 0.10 0.00 -0.52 0.00 0.00 37.83 33.17 2jyq s LYS 57 CO -0.11 -1.58 1.41 -1.01 -0.92 0.00 0.00 175.35 173.14 2jyq s HIS 58 N 3.93 2.95 0.03 3.18 3.76 -1.26 -1.30 115.29 126.59 2jyq s HIS 58 Ca 0.27 -1.42 -0.30 0.00 -0.15 0.00 0.00 55.06 53.46 2jyq s HIS 58 Cb -0.14 -4.51 -0.06 0.00 1.11 0.00 0.00 32.58 28.98 2jyq s HIS 58 CO 0.16 -1.67 1.29 0.71 -0.85 0.00 0.00 174.74 174.38 2jyq s TYR 59 N 3.47 3.19 -0.14 1.40 2.02 -0.25 -4.88 117.35 122.16 2jyq s TYR 59 Ca 0.43 1.08 -0.26 0.00 -0.37 0.00 0.00 57.07 57.95 2jyq s TYR 59 Cb -0.01 -3.54 -0.02 0.00 -0.40 0.00 0.00 41.96 37.99 2jyq s TYR 59 CO -0.04 -1.84 0.87 -1.59 -1.57 0.00 0.00 175.55 171.38 2jyq s LYS 60 N 1.66 4.35 -0.44 -0.62 -2.85 -1.26 -0.28 119.74 120.30 2jyq s LYS 60 Ca 0.61 1.11 -0.13 0.00 -1.00 0.00 0.00 55.97 56.55 2jyq s LYS 60 Cb -0.31 -3.55 0.06 0.00 -2.06 0.00 0.00 37.83 31.97 2jyq s LYS 60 CO 0.27 -0.28 0.33 0.42 0.10 0.00 0.00 175.35 176.19 2jyq s ILE 61 N 1.96 4.90 0.45 3.79 1.01 0.67 -4.11 121.20 129.87 2jyq s ILE 61 Ca 0.41 -1.07 0.07 0.00 0.00 0.00 0.00 60.65 60.06 2jyq s ILE 61 Cb -0.17 -3.89 -0.01 0.00 0.01 0.00 0.00 42.46 38.39 2jyq s ILE 61 CO 0.15 -0.48 0.35 -0.13 0.00 0.00 0.00 174.94 174.83 2jyq s ARG 62 N 1.58 2.40 0.21 2.79 1.81 0.00 -0.33 118.95 127.41 2jyq s ARG 62 Ca 0.04 -1.71 0.09 0.00 -1.72 0.00 0.00 55.73 52.42 2jyq s ARG 62 Cb -0.23 -2.24 -0.05 0.00 -0.45 0.00 0.00 34.95 31.99 2jyq s ARG 62 CO 0.06 -0.29 -0.18 0.15 -0.68 0.00 0.00 175.30 174.36 2jyq s LYS 63 N -4.13 1.41 0.12 3.54 1.02 -1.25 -0.46 119.74 119.99 2jyq s LYS 63 Ca 0.44 -1.56 0.09 0.00 0.02 0.00 0.00 55.97 54.96 2jyq s LYS 63 Cb -0.02 -1.41 -0.04 0.00 -0.52 0.00 0.00 37.83 35.84 2jyq s LYS 63 CO 0.26 0.27 -0.22 -0.51 -0.92 0.00 0.00 175.35 174.22 2jyq s LEU 64 N -3.07 2.33 0.05 3.17 1.43 -0.54 -4.89 118.68 117.16 2jyq s LEU 64 Ca 0.22 -0.74 -0.19 0.00 -1.03 0.00 0.00 54.13 52.38 2jyq s LEU 64 Cb -0.04 -0.98 -0.09 0.00 0.03 0.00 0.00 46.19 45.11 2jyq s LEU 64 CO 0.09 0.08 1.30 0.44 0.23 0.00 0.00 176.35 178.48 2jyq h ASP 65 N 3.84 -0.77 -0.58 2.29 5.19 -2.01 -2.99 116.42 121.40 2jyq h ASP 65 Ca -0.47 0.06 -0.11 0.00 -0.62 0.00 0.00 57.03 55.90 2jyq h ASP 65 Cb 1.18 0.26 -0.06 0.00 0.18 0.00 0.00 39.33 40.89 2jyq h ASP 65 CO 0.42 -0.35 0.12 -1.20 -3.12 0.00 0.00 179.24 175.11 2jyq n SER 66 N -4.02 4.81 0.00 6.45 7.64 -1.26 -4.78 113.62 122.47 2jyq n SER 66 Ca -0.06 -3.13 0.00 0.00 1.01 0.00 0.00 58.87 56.68 2jyq n SER 66 Cb 0.24 -0.68 0.00 0.00 -1.01 0.00 0.00 64.21 62.76 2jyq n SER 66 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2jyq n GLY 67 N -0.05 0.54 0.00 0.23 0.00 -1.13 -5.15 105.19 99.64 2jyq n GLY 67 Ca 0.33 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.35 2jyq n GLY 67 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2jyq n GLY 68 N 4.54 -0.42 3.69 -0.02 0.00 -1.21 -4.43 105.19 107.35 2jyq n GLY 68 Ca 0.00 -0.82 -0.42 0.00 0.00 0.00 0.00 46.02 44.78 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 -4.00 3.54 -0.00 1.61 0.08 0.19 -1.47 117.98 117.93 2jyq s PHE 69 Ca 0.00 1.57 -0.01 0.00 0.12 0.00 0.00 56.93 58.61 2jyq s PHE 69 Cb 0.00 -3.14 -0.00 0.00 -0.57 0.00 0.00 43.02 39.31 2jyq s PHE 69 CO 0.00 -0.16 0.01 1.52 -0.10 0.00 0.00 175.22 176.50 2jyq s TYR 70 N 1.72 0.01 -1.53 0.36 1.13 0.39 -1.50 117.35 117.93 2jyq s TYR 70 Ca 0.48 -0.01 0.20 0.00 -1.41 0.00 0.00 57.07 56.32 2jyq s TYR 70 Cb -0.19 -0.01 -0.08 0.00 -1.10 0.00 0.00 41.96 40.58 2jyq s TYR 70 CO 0.20 -0.03 0.95 -0.89 -2.51 0.00 0.00 175.55 173.26 2jyq n ILE 71 N 2.90 0.00 -3.53 -3.49 5.41 -1.26 -0.82 119.36 118.58 2jyq n ILE 71 Ca -0.13 -0.20 -0.07 0.00 1.00 0.00 0.00 62.75 63.34 2jyq n ILE 71 Cb 0.59 1.16 -0.02 0.00 -0.71 0.00 0.00 39.64 40.66 2jyq n ILE 71 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 176.55 176.83 2jyq s THR 72 N -2.47 0.00 -2.00 1.39 -1.32 -1.26 -4.71 115.64 105.27 2jyq s THR 72 Ca 0.14 -0.00 0.22 0.00 -1.21 0.00 0.00 61.69 60.83 2jyq s THR 72 Cb 0.16 -1.00 0.62 0.00 -1.51 0.00 0.00 72.50 70.76 2jyq s THR 72 CO 0.61 0.00 1.68 -1.54 -2.21 0.00 0.00 174.62 173.16 2jyq n SER 73 N -0.20 0.00 0.14 8.08 3.41 -1.26 -3.51 113.62 120.28 2jyq n SER 73 Ca -0.06 -0.73 -0.13 0.00 -0.26 0.00 0.00 58.87 57.69 2jyq n SER 73 Cb 0.61 0.00 -0.08 0.00 -0.26 0.00 0.00 64.21 64.48 2jyq n SER 73 CO 0.00 0.00 0.00 0.03 -0.16 0.00 0.00 175.04 174.91 2jyq h ARG 74 N 0.00 -0.38 -3.57 4.33 2.47 -1.95 -3.46 114.38 111.82 2jyq h ARG 74 Ca 0.00 0.03 -0.20 0.00 -1.26 0.00 0.00 59.98 58.54 2jyq h ARG 74 Cb 0.00 0.09 -0.26 0.00 -1.65 0.00 0.00 29.97 28.14 2jyq h ARG 74 CO 0.00 -0.05 -0.62 0.99 0.56 0.00 0.00 179.97 180.85 2jyq s THR 75 N -4.46 0.01 -0.03 2.04 2.01 -1.23 -5.05 115.64 108.93 2jyq s THR 75 Ca -0.14 -0.11 0.05 0.00 0.31 0.00 0.00 61.69 61.81 2jyq s THR 75 Cb 0.02 -0.15 -0.01 0.00 0.01 0.00 0.00 72.50 72.37 2jyq s THR 75 CO 0.53 -0.06 -0.19 -1.10 -0.69 0.00 0.00 174.62 173.11 2jyq s GLN 76 N -0.16 1.69 -0.00 4.92 1.11 -1.26 -4.46 119.66 121.50 2jyq s GLN 76 Ca -0.02 -0.67 0.04 0.00 0.01 0.00 0.00 55.36 54.71 2jyq s GLN 76 Cb -0.02 -1.56 -0.01 0.00 -1.01 0.00 0.00 33.01 30.41 2jyq s GLN 76 CO 0.00 0.35 -0.12 -0.06 0.01 0.00 0.00 175.29 175.47 2jyq s PHE 77 N -0.26 1.09 -1.15 0.91 0.08 -0.56 -4.93 117.98 113.15 2jyq s PHE 77 Ca 0.03 -0.22 0.29 0.00 0.12 0.00 0.00 56.93 57.14 2jyq s PHE 77 Cb -0.09 -0.69 1.16 0.00 -0.57 0.00 0.00 43.02 42.83 2jyq s PHE 77 CO 0.01 -0.01 1.86 -1.13 -0.10 0.00 0.00 175.22 175.84 2jyq n SER 78 N 2.67 0.14 -3.99 1.36 3.41 -1.26 0.55 113.62 116.50 2jyq n SER 78 Ca -0.14 0.13 -0.22 0.00 -0.26 0.00 0.00 58.87 58.38 2jyq n SER 78 Cb 0.56 -0.29 -0.16 0.00 -0.26 0.00 0.00 64.21 64.06 2jyq n SER 78 CO 0.00 0.00 0.00 -0.44 -0.16 0.00 0.00 175.04 174.44 2jyq s SER 79 N -2.86 1.38 0.42 4.04 0.01 -1.26 -4.84 113.70 110.59 2jyq s SER 79 Ca 0.18 -0.22 0.13 0.00 1.31 0.00 0.00 55.95 57.35 2jyq s SER 79 Cb 0.19 -0.52 0.90 0.00 0.21 0.00 0.00 66.02 66.80 2jyq s SER 79 CO 0.54 0.04 1.94 -0.07 0.41 0.00 0.00 173.24 176.10 2jyq h LEU 80 N 6.72 0.03 -0.46 2.44 3.38 -1.97 -1.45 115.31 124.00 2jyq h LEU 80 Ca -0.34 -0.01 0.04 0.00 0.09 0.00 0.00 57.88 57.66 2jyq h LEU 80 Cb 1.17 -0.01 -0.04 0.00 0.09 0.00 0.00 40.66 41.87 2jyq h LEU 80 CO 0.48 0.26 0.23 -0.61 0.09 0.00 0.00 178.44 178.89 2jyq h GLN 81 N 0.03 0.45 0.00 1.13 5.75 -1.99 -1.85 115.11 118.65 2jyq h GLN 81 Ca 0.00 -0.03 -0.02 0.00 -0.15 0.00 0.00 58.65 58.46 2jyq h GLN 81 Cb 0.41 -0.10 -0.00 0.00 1.07 0.00 0.00 27.48 28.86 2jyq h GLN 81 CO 0.03 0.30 -0.11 1.96 -2.65 0.00 0.00 178.83 178.36 2jyq h GLN 82 N 0.47 0.00 0.86 1.69 1.08 -1.82 -1.60 115.11 115.78 2jyq h GLN 82 Ca 0.20 0.00 -0.04 0.00 -1.45 0.00 0.00 58.65 57.36 2jyq h GLN 82 Cb 0.10 0.00 0.01 0.00 -0.05 0.00 0.00 27.48 27.53 2jyq h GLN 82 CO -0.13 0.11 -0.41 1.25 -0.95 0.00 0.00 178.83 178.69 2jyq h LEU 83 N 0.00 -0.98 -0.45 1.46 7.12 -0.61 -2.51 115.31 119.33 2jyq h LEU 83 Ca -0.00 0.03 -0.09 0.00 0.13 0.00 0.00 57.88 57.95 2jyq h LEU 83 Cb 0.93 0.25 -0.02 0.00 -0.53 0.00 0.00 40.66 41.30 2jyq h LEU 83 CO 0.01 -0.63 -0.06 -0.37 -0.13 0.00 0.00 178.44 177.26 2jyq h VAL 84 N -1.29 1.27 -0.00 1.05 -1.51 -1.35 -1.71 116.25 112.71 2jyq h VAL 84 Ca -0.12 -1.16 0.00 0.00 -1.23 0.00 0.00 66.70 64.20 2jyq h VAL 84 Cb 0.89 1.09 -0.00 0.00 -2.13 0.00 0.00 31.29 31.14 2jyq h VAL 84 CO 0.19 0.40 0.00 0.00 -1.23 0.00 0.00 177.57 176.93 2jyq h ALA 85 N 0.89 1.21 0.01 5.19 0.00 -1.36 -0.38 119.26 124.81 2jyq h ALA 85 Ca 0.12 -0.00 -0.29 0.00 0.00 0.00 0.00 54.91 54.74 2jyq h ALA 85 Cb 0.59 0.00 -0.04 0.00 0.00 0.00 0.00 17.79 18.34 2jyq h ALA 85 CO 0.04 -0.00 -1.57 0.98 0.00 0.00 0.00 179.25 178.70 2jyq n TYR 86 N -3.39 0.86 0.95 0.00 9.36 -0.95 -4.28 117.16 119.72 2jyq n TYR 86 Ca -0.03 0.34 0.10 0.00 3.32 0.00 0.00 57.90 61.63 2jyq n TYR 86 Cb 0.07 -1.09 0.51 0.00 -0.63 0.00 0.00 39.34 38.20 2jyq n TYR 86 CO 0.00 0.00 0.00 0.66 0.22 0.00 0.00 176.86 177.74 2jyq n TYR 87 N -4.29 0.00 0.09 2.98 4.02 -0.67 -0.46 117.16 118.82 2jyq n TYR 87 Ca -0.36 0.00 -0.11 0.00 -0.01 0.00 0.00 57.90 57.42 2jyq n TYR 87 Cb 0.76 -0.27 -0.09 0.00 -0.02 0.00 0.00 39.34 39.71 2jyq n TYR 87 CO 0.00 0.00 0.00 0.66 -1.01 0.00 0.00 176.86 176.51 2jyq h SER 88 N 0.00 0.26 0.00 7.72 4.64 -1.25 0.04 113.55 124.96 2jyq h SER 88 Ca 0.00 -0.26 -0.31 0.00 -0.47 0.00 0.00 61.79 60.75 2jyq h SER 88 Cb 0.18 -0.08 -0.05 0.00 -0.31 0.00 0.00 62.40 62.14 2jyq h SER 88 CO 0.00 1.15 -1.82 0.29 -0.87 0.00 0.00 176.83 175.58 2jyq n LYS 89 N -3.53 0.57 -4.04 4.77 5.02 -0.64 -4.05 118.16 116.26 2jyq n LYS 89 Ca -0.05 0.38 -0.32 0.00 -2.02 0.00 0.00 58.31 56.31 2jyq n LYS 89 Cb 0.93 -1.59 -0.15 0.00 -0.02 0.00 0.00 35.03 34.20 2jyq n LYS 89 CO 0.00 0.00 0.00 -1.58 -0.52 0.00 0.00 177.40 175.30 2jyq s HIS 90 N -2.48 3.26 0.28 2.13 2.46 0.39 -4.98 115.29 116.36 2jyq s HIS 90 Ca -0.33 -2.42 -0.02 0.00 0.47 0.00 0.00 55.06 52.76 2jyq s HIS 90 Cb 0.10 -2.14 0.40 0.00 -0.13 0.00 0.00 32.58 30.81 2jyq s HIS 90 CO 0.50 -0.89 1.87 0.00 -2.47 0.00 0.00 174.74 173.75 2jyq h ALA 91 N 7.76 1.27 -0.17 1.58 0.00 -1.79 -3.30 119.26 124.61 2jyq h ALA 91 Ca -0.15 -0.16 0.00 0.00 0.00 0.00 0.00 54.91 54.60 2jyq h ALA 91 Cb 1.04 -0.26 0.00 0.00 0.00 0.00 0.00 17.79 18.57 2jyq h ALA 91 CO 0.47 0.55 0.00 -3.47 0.00 0.00 0.00 179.25 176.79 2jyq n ASP 92 N -4.32 0.00 -0.03 0.00 -0.08 -1.26 -1.36 116.55 109.51 2jyq n ASP 92 Ca 0.06 0.00 0.04 0.00 -1.51 0.00 0.00 54.79 53.38 2jyq n ASP 92 Cb 0.16 0.00 -0.13 0.00 2.34 0.00 0.00 41.12 43.49 2jyq n ASP 92 CO 0.00 0.00 0.00 0.61 0.12 0.00 0.00 177.20 177.93 2jyq n GLY 93 N 0.00 -0.80 3.84 0.27 0.00 -1.26 -4.97 105.19 102.28 2jyq n GLY 93 Ca 0.00 -0.38 -0.32 0.00 0.00 0.00 0.00 46.02 45.32 2jyq n GLY 93 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2jyq s LEU 94 N -4.48 3.54 0.11 0.99 1.43 -0.46 -4.98 118.68 114.83 2jyq s LEU 94 Ca -0.07 1.57 0.10 0.00 -1.03 0.00 0.00 54.13 54.69 2jyq s LEU 94 Cb 0.09 -4.50 -0.18 0.00 0.03 0.00 0.00 46.19 41.63 2jyq s LEU 94 CO 0.71 -0.70 1.16 0.00 0.23 0.00 0.00 176.35 177.75 2jyq s HIS 96 N -2.73 1.70 0.24 0.00 3.76 -1.26 -5.04 115.29 111.96 2jyq s HIS 96 Ca 0.00 -0.76 -0.30 0.00 -0.15 0.00 0.00 55.06 53.85 2jyq s HIS 96 Cb 0.09 -1.27 -0.09 0.00 1.11 0.00 0.00 32.58 32.42 2jyq s HIS 96 CO 0.81 -0.42 1.18 -0.98 -0.85 0.00 0.00 174.74 174.48 2jyq s ARG 97 N 1.05 4.53 -0.49 1.40 1.04 -1.26 -4.89 118.95 120.33 2jyq s ARG 97 Ca -0.06 1.90 -0.26 0.00 -1.04 0.00 0.00 55.73 56.27 2jyq s ARG 97 Cb -0.15 -3.19 -0.06 0.00 -2.04 0.00 0.00 34.95 29.51 2jyq s ARG 97 CO -0.02 0.01 2.33 -0.51 -0.04 0.00 0.00 175.30 177.07 2jyq s LEU 98 N -0.94 3.40 -0.23 -1.89 1.43 0.00 -4.79 118.68 115.66 2jyq s LEU 98 Ca 0.49 1.03 -0.16 0.00 -1.03 0.00 0.00 54.13 54.46 2jyq s LEU 98 Cb -0.34 -2.57 -0.11 0.00 0.03 0.00 0.00 46.19 43.21 2jyq s LEU 98 CO 0.41 -2.77 -0.26 0.41 0.23 0.00 0.00 176.35 174.37 2jyq n THR 99 N 7.88 1.51 -4.76 5.49 -1.04 -0.98 -4.28 114.28 118.11 2jyq n THR 99 Ca 0.34 -0.15 -0.25 0.00 -2.04 0.00 0.00 64.05 61.95 2jyq n THR 99 Cb 0.54 -2.07 -0.16 0.00 -1.82 0.00 0.00 70.33 66.83 2jyq n THR 99 CO 0.00 0.00 0.00 0.21 -0.64 0.00 0.00 175.07 174.64 2jyq s ASN 100 N -6.86 1.99 0.27 8.00 2.47 -0.93 -5.03 114.94 114.85 2jyq s ASN 100 Ca -0.33 -0.32 -0.15 0.00 0.42 0.00 0.00 52.86 52.48 2jyq s ASN 100 Cb 0.10 -0.50 -0.08 0.00 -1.45 0.00 0.00 41.25 39.31 2jyq s ASN 100 CO 0.47 0.15 0.69 -0.69 -3.72 0.00 0.00 177.10 173.99 2jyq s VAL 101 N -0.00 4.71 -0.04 -5.21 1.01 -1.26 -1.00 120.40 118.60 2jyq s VAL 101 Ca -0.02 0.93 -0.37 0.00 0.00 0.00 0.00 61.98 62.52 2jyq s VAL 101 Cb -0.10 -3.68 -0.15 0.00 0.00 0.00 0.00 36.38 32.45 2jyq s VAL 101 CO 0.01 -0.04 1.61 0.00 0.00 0.00 0.00 175.10 176.68 2jyq s PRO 103 N 2.15 3.92 0.22 0.00 0.02 -1.26 -5.04 135.00 135.02 2jyq s PRO 103 Ca 0.89 1.84 0.05 0.00 0.02 0.00 0.00 61.00 63.81 2jyq s PRO 103 Cb -0.89 -2.57 -0.03 0.00 0.02 0.00 0.00 34.50 31.02 2jyq s PRO 103 CO 0.52 -0.43 0.27 0.95 -0.33 0.00 0.00 177.00 177.97 2jyq s THR 104 N -1.45 4.90 -1.57 0.99 -4.23 -1.26 -5.00 115.64 108.02 2jyq s THR 104 Ca 0.60 -1.09 -0.10 0.00 -1.18 0.00 0.00 61.69 59.91 2jyq s THR 104 Cb -0.31 -3.62 -0.09 0.00 1.34 0.00 0.00 72.50 69.82 2jyq s THR 104 CO 0.38 -0.27 2.98 -1.54 -0.54 0.00 0.00 174.62 175.62 2jyq n SER 105 N -1.08 8.66 0.00 3.99 3.41 -1.26 -5.26 113.62 122.09 2jyq n SER 105 Ca -0.08 -2.58 0.00 0.00 -0.26 0.00 0.00 58.87 55.95 2jyq n SER 105 Cb 0.57 -1.55 0.00 0.00 -0.26 0.00 0.00 64.21 62.96 2jyq n SER 105 CO 0.00 0.00 0.00 1.17 -0.16 0.00 0.00 175.04 176.05