#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1y4o n HIS 2 N 0.00 0.00 -4.06 1.61 8.25 -1.26 -4.97 115.22 114.80 1y4o n HIS 2 Ca 0.00 0.00 -0.18 0.00 -0.26 0.00 0.00 57.72 57.28 1y4o n HIS 2 Cb 0.00 -2.29 -0.16 0.00 1.12 0.00 0.00 29.99 28.66 1y4o n HIS 2 CO 0.00 0.00 0.00 -1.01 0.64 0.00 0.00 176.34 175.97 1y4o s HIS 3 N -2.32 0.51 -0.07 4.41 3.76 -1.26 -5.03 115.29 115.29 1y4o s HIS 3 Ca 0.00 -0.10 -0.21 0.00 -0.15 0.00 0.00 55.06 54.60 1y4o s HIS 3 Cb 0.00 -0.50 -0.17 0.00 1.11 0.00 0.00 32.58 33.02 1y4o s HIS 3 CO 0.00 -0.14 0.81 0.45 -0.85 0.00 0.00 174.74 175.00 1y4o h HIS 4 N 7.09 -0.12 -3.07 1.40 -0.00 -2.09 -3.39 115.15 114.96 1y4o h HIS 4 Ca -0.40 -0.00 -0.68 0.00 -0.00 0.00 0.00 60.37 59.29 1y4o h HIS 4 Cb 1.15 0.04 -0.18 0.00 -0.00 0.00 0.00 27.41 28.42 1y4o h HIS 4 CO 0.49 0.39 0.16 -1.01 -0.00 0.00 0.00 177.93 177.97 1y4o s HIS 5 N -3.07 2.97 0.86 2.45 0.09 -1.26 -5.03 115.29 112.30 1y4o s HIS 5 Ca -0.13 -0.63 -0.13 0.00 -0.00 0.00 0.00 55.06 54.16 1y4o s HIS 5 Cb -0.00 -3.81 0.12 0.00 -0.00 0.00 0.00 32.58 28.89 1y4o s HIS 5 CO 0.49 -1.21 1.23 -1.01 -0.00 0.00 0.00 174.74 174.24 1y4o s HIS 6 N 2.90 2.50 -1.37 1.40 4.02 -1.26 -4.91 115.29 118.57 1y4o s HIS 6 Ca 0.16 0.60 -0.13 0.00 1.02 0.00 0.00 55.06 56.71 1y4o s HIS 6 Cb -0.20 -3.71 0.09 0.00 -1.02 0.00 0.00 32.58 27.74 1y4o s HIS 6 CO 0.10 -2.07 2.00 0.72 1.02 0.00 0.00 174.74 176.52 1y4o n HIS 7 N -3.47 3.63 -0.01 1.40 8.25 -1.26 -4.69 115.22 119.08 1y4o n HIS 7 Ca 0.10 -2.93 -0.11 0.00 -0.26 0.00 0.00 57.72 54.52 1y4o n HIS 7 Cb 0.60 -2.37 -0.05 0.00 1.12 0.00 0.00 29.99 29.29 1y4o n HIS 7 CO 0.00 0.00 0.00 1.25 0.64 0.00 0.00 176.34 178.23 1y4o h LEU 8 N 9.73 0.12 -1.05 2.41 5.85 -1.98 0.75 115.31 131.14 1y4o h LEU 8 Ca 0.49 -0.04 -0.05 0.00 0.84 0.00 0.00 57.88 59.12 1y4o h LEU 8 Cb 0.69 -0.03 -0.01 0.00 0.37 0.00 0.00 40.66 41.68 1y4o h LEU 8 CO 1.71 0.13 -0.22 -0.33 -0.34 0.00 0.00 178.44 179.39 1y4o h GLU 9 N 0.11 0.00 0.22 1.25 5.08 -1.99 0.14 114.58 119.38 1y4o h GLU 9 Ca 0.04 0.00 -0.33 0.00 -1.00 0.00 0.00 59.36 58.07 1y4o h GLU 9 Cb 0.03 0.00 0.03 0.00 0.50 0.00 0.00 28.75 29.31 1y4o h GLU 9 CO -0.01 0.22 -1.50 0.00 -1.00 0.00 0.00 179.01 176.72 1y4o h ALA 10 N 1.78 -0.06 -0.28 3.43 0.00 -1.84 -3.17 119.26 119.11 1y4o h ALA 10 Ca -0.00 -0.92 -0.19 0.00 0.00 0.00 0.00 54.91 53.80 1y4o h ALA 10 Cb 0.77 0.21 0.00 0.00 0.00 0.00 0.00 17.79 18.77 1y4o h ALA 10 CO 0.03 0.81 -0.55 1.49 0.00 0.00 0.00 179.25 181.02 1y4o h GLU 11 N 0.13 0.87 -0.80 0.00 4.81 -0.56 -1.77 114.58 117.25 1y4o h GLU 11 Ca -0.25 -0.55 -0.03 0.00 -0.13 0.00 0.00 59.36 58.39 1y4o h GLU 11 Cb 2.13 0.07 -0.04 0.00 0.63 0.00 0.00 28.75 31.54 1y4o h GLU 11 CO 0.25 1.19 0.37 -0.39 -0.73 0.00 0.00 179.01 179.69 1y4o h VAL 12 N 0.66 1.25 -0.12 0.32 -1.51 -0.86 0.15 116.25 116.15 1y4o h VAL 12 Ca 0.01 -0.73 -0.02 0.00 -1.23 0.00 0.00 66.70 64.74 1y4o h VAL 12 Cb 1.16 0.24 -0.00 0.00 -2.13 0.00 0.00 31.29 30.56 1y4o h VAL 12 CO 0.12 0.31 0.01 -0.33 -1.23 0.00 0.00 177.57 176.46 1y4o h GLU 13 N 1.15 0.20 -0.13 5.19 5.08 -1.51 -0.67 114.58 123.88 1y4o h GLU 13 Ca 0.27 -0.06 0.03 0.00 -1.00 0.00 0.00 59.36 58.61 1y4o h GLU 13 Cb 0.14 -0.02 -0.03 0.00 0.50 0.00 0.00 28.75 29.33 1y4o h GLU 13 CO -0.03 0.41 -0.07 1.49 -1.00 0.00 0.00 179.01 179.81 1y4o h GLU 14 N -0.04 -0.06 0.09 2.33 4.81 -0.89 -0.30 114.58 120.52 1y4o h GLU 14 Ca 0.04 0.00 -0.22 0.00 -0.13 0.00 0.00 59.36 59.05 1y4o h GLU 14 Cb 0.31 0.01 0.02 0.00 0.63 0.00 0.00 28.75 29.72 1y4o h GLU 14 CO 0.00 -0.04 -0.92 1.79 -0.73 0.00 0.00 179.01 179.12 1y4o h THR 15 N -0.06 1.40 -0.36 0.32 1.35 -1.01 -2.69 112.91 111.86 1y4o h THR 15 Ca 0.08 -2.36 -0.17 0.00 -0.55 0.00 0.00 66.41 63.40 1y4o h THR 15 Cb 0.17 2.82 -0.00 0.00 -1.73 0.00 0.00 68.15 69.41 1y4o h THR 15 CO -0.17 0.69 -0.43 0.25 -0.25 0.00 0.00 175.52 175.61 1y4o h LEU 16 N -0.04 1.00 -1.28 3.87 7.12 -0.99 0.61 115.31 125.61 1y4o h LEU 16 Ca -0.14 -0.48 -0.06 0.00 0.13 0.00 0.00 57.88 57.33 1y4o h LEU 16 Cb 1.65 -0.28 -0.01 0.00 -0.53 0.00 0.00 40.66 41.49 1y4o h LEU 16 CO 0.18 1.29 -0.29 0.11 -0.13 0.00 0.00 178.44 179.59 1y4o h LYS 17 N 0.74 0.00 -0.22 1.25 1.57 -1.17 -0.43 116.57 118.31 1y4o h LYS 17 Ca 0.05 0.00 -0.20 0.00 -1.87 0.00 0.00 60.65 58.63 1y4o h LYS 17 Cb 1.03 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.35 1y4o h LYS 17 CO 0.10 0.29 -0.66 -0.09 -0.57 0.00 0.00 179.45 178.53 1y4o h ARG 18 N 0.00 0.83 0.00 3.15 2.43 -1.02 -0.34 114.38 119.42 1y4o h ARG 18 Ca -0.00 -0.59 -0.03 0.00 -0.81 0.00 0.00 59.98 58.55 1y4o h ARG 18 Cb 0.69 0.10 -0.00 0.00 -0.42 0.00 0.00 29.97 30.33 1y4o h ARG 18 CO 0.04 1.21 -0.14 -0.07 -1.51 0.00 0.00 179.97 179.50 1y4o h LEU 19 N 0.60 0.00 -0.01 3.80 3.38 -0.18 -0.96 115.31 121.94 1y4o h LEU 19 Ca -0.02 0.00 -0.13 0.00 0.09 0.00 0.00 57.88 57.82 1y4o h LEU 19 Cb 1.27 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 42.01 1y4o h LEU 19 CO 0.14 0.14 -0.62 1.56 0.09 0.00 0.00 178.44 179.74 1y4o h GLN 20 N 0.00 0.00 0.00 1.13 1.08 -0.58 -3.28 115.11 113.47 1y4o h GLN 20 Ca -0.00 0.00 -0.12 0.00 -1.45 0.00 0.00 58.65 57.08 1y4o h GLN 20 Cb 0.37 0.00 -0.02 0.00 -0.05 0.00 0.00 27.48 27.79 1y4o h GLN 20 CO 0.02 0.62 -0.57 0.77 -0.95 0.00 0.00 178.83 178.72 1y4o h SER 21 N 0.00 0.00 -3.46 1.46 0.02 0.31 -3.44 113.55 108.44 1y4o h SER 21 Ca -0.01 0.00 -0.54 0.00 -0.84 0.00 0.00 61.79 60.41 1y4o h SER 21 Cb 1.47 0.00 -0.03 0.00 0.14 0.00 0.00 62.40 63.98 1y4o h SER 21 CO 0.08 0.57 0.09 0.00 -1.14 0.00 0.00 176.83 176.43 1y4o s GLN 22 N -3.22 4.35 0.00 3.45 -2.07 -0.98 -4.93 119.66 116.25 1y4o s GLN 22 Ca 0.01 0.93 0.12 0.00 -1.82 0.00 0.00 55.36 54.60 1y4o s GLN 22 Cb 0.10 -3.11 0.01 0.00 -1.09 0.00 0.00 33.01 28.91 1y4o s GLN 22 CO 0.74 0.53 0.72 0.36 -1.32 0.00 0.00 175.29 176.32 1y4o n LYS 23 N 1.30 1.83 -0.37 9.60 2.85 -1.26 -4.32 118.16 127.79 1y4o n LYS 23 Ca -0.06 -0.73 0.01 0.00 -1.05 0.00 0.00 58.31 56.49 1y4o n LYS 23 Cb 0.50 -1.15 0.14 0.00 -0.65 0.00 0.00 35.03 33.87 1y4o n LYS 23 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 177.40 177.76 1y4o n GLY 24 N 0.94 2.21 3.70 2.58 0.00 -1.26 -4.81 105.19 108.54 1y4o n GLY 24 Ca 0.05 -0.37 -0.35 0.00 0.00 0.00 0.00 46.02 45.36 1y4o n GLY 24 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1y4o s VAL 25 N -1.62 4.77 -0.10 1.61 0.11 -1.26 -0.29 120.40 123.62 1y4o s VAL 25 Ca 0.21 -0.06 0.20 0.00 -2.93 0.00 0.00 61.98 59.41 1y4o s VAL 25 Cb 0.16 -3.09 -0.30 0.00 -1.53 0.00 0.00 36.38 31.62 1y4o s VAL 25 CO 0.06 0.54 0.32 0.00 -3.33 0.00 0.00 175.10 172.69 1y4o n GLN 26 N 2.79 0.67 -3.65 1.54 6.02 0.14 -4.93 117.38 119.97 1y4o n GLN 26 Ca -0.18 -0.12 -0.01 0.00 -0.01 0.00 0.00 57.00 56.68 1y4o n GLN 26 Cb 0.53 -1.52 -0.06 0.00 1.02 0.00 0.00 30.24 30.21 1y4o n GLN 26 CO 0.00 0.00 0.00 0.20 -1.01 0.00 0.00 177.06 176.25 1y4o s GLY 27 N -4.90 0.25 -0.16 1.08 0.00 -1.05 -4.84 107.32 97.70 1y4o s GLY 27 Ca -0.09 3.41 -0.14 0.00 0.00 0.00 0.00 44.72 47.90 1y4o s GLY 27 CO 0.88 2.62 0.32 -0.42 0.00 0.00 0.00 173.10 176.51 1y4o s ILE 28 N 1.16 5.28 -0.41 0.90 1.01 -1.26 -1.29 121.20 126.59 1y4o s ILE 28 Ca -0.08 0.60 0.02 0.00 0.00 0.00 0.00 60.65 61.20 1y4o s ILE 28 Cb -0.03 -3.66 0.12 0.00 0.01 0.00 0.00 42.46 38.90 1y4o s ILE 28 CO -0.13 0.36 0.19 -0.63 0.00 0.00 0.00 174.94 174.73 1y4o s ILE 29 N 0.61 1.60 -0.32 2.92 1.01 0.14 -0.72 121.20 126.44 1y4o s ILE 29 Ca 0.18 -2.41 -0.07 0.00 0.00 0.00 0.00 60.65 58.35 1y4o s ILE 29 Cb -0.13 -2.14 0.02 0.00 0.01 0.00 0.00 42.46 40.22 1y4o s ILE 29 CO 0.05 -0.80 0.10 0.54 0.00 0.00 0.00 174.94 174.84 1y4o s VAL 30 N 0.59 3.95 0.03 2.92 0.11 -1.11 -0.61 120.40 126.28 1y4o s VAL 30 Ca 0.15 -0.89 0.07 0.00 -2.93 0.00 0.00 61.98 58.38 1y4o s VAL 30 Cb -0.23 -3.14 -0.02 0.00 -1.53 0.00 0.00 36.38 31.46 1y4o s VAL 30 CO -0.06 -0.06 -0.21 0.68 -3.33 0.00 0.00 175.10 172.11 1y4o s VAL 31 N 1.46 1.72 0.61 2.04 -7.23 -0.81 -0.30 120.40 117.89 1y4o s VAL 31 Ca 0.01 -1.16 -0.18 0.00 -1.81 0.00 0.00 61.98 58.84 1y4o s VAL 31 Cb -0.18 -1.48 -0.03 0.00 0.56 0.00 0.00 36.38 35.25 1y4o s VAL 31 CO 0.03 0.28 1.18 0.20 -0.31 0.00 0.00 175.10 176.48 1y4o s ASN 32 N -1.04 5.16 0.47 4.85 0.01 0.11 0.50 114.94 125.00 1y4o s ASN 32 Ca 0.08 2.31 0.23 0.00 -0.71 0.00 0.00 52.86 54.76 1y4o s ASN 32 Cb -0.09 -2.59 1.24 0.00 0.41 0.00 0.00 41.25 40.23 1y4o s ASN 32 CO 0.01 -1.61 1.89 0.74 -1.51 0.00 0.00 177.10 176.63 1y4o h THR 33 N 0.71 0.66 0.00 1.60 2.02 -1.66 0.31 112.91 116.56 1y4o h THR 33 Ca -0.50 -0.08 0.00 0.00 0.77 0.00 0.00 66.41 66.60 1y4o h THR 33 Cb 1.29 0.41 0.00 0.00 -1.74 0.00 0.00 68.15 68.11 1y4o h THR 33 CO 0.55 0.04 0.00 -0.62 0.37 0.00 0.00 175.52 175.86 1y4o n GLU 34 N -4.42 0.58 -0.91 6.66 1.02 -1.26 -4.85 120.64 117.45 1y4o n GLU 34 Ca 0.17 0.03 0.00 0.00 -0.02 0.00 0.00 57.16 57.34 1y4o n GLU 34 Cb 0.74 -1.50 0.00 0.00 -0.02 0.00 0.00 31.44 30.66 1y4o n GLU 34 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1y4o n GLY 35 N 0.62 0.49 2.91 0.62 0.00 0.11 -5.09 105.19 104.84 1y4o n GLY 35 Ca 0.15 -0.23 -0.30 0.00 0.00 0.00 0.00 46.02 45.64 1y4o n GLY 35 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1y4o s ILE 36 N -1.93 1.36 -0.23 -0.61 1.01 -1.17 -4.90 121.20 114.73 1y4o s ILE 36 Ca 0.00 -1.09 -0.29 0.00 0.00 0.00 0.00 60.65 59.27 1y4o s ILE 36 Cb 0.00 -1.66 -0.02 0.00 0.01 0.00 0.00 42.46 40.79 1y4o s ILE 36 CO 0.00 -0.10 1.61 -2.84 0.00 0.00 0.00 174.94 173.60 1y4o s PRO 37 N 1.48 3.79 -0.05 2.79 0.02 -1.26 0.08 135.00 141.85 1y4o s PRO 37 Ca -0.05 1.64 -0.19 0.00 0.02 0.00 0.00 61.00 62.42 1y4o s PRO 37 Cb -0.18 -4.03 -0.31 0.00 0.02 0.00 0.00 34.50 29.99 1y4o s PRO 37 CO -0.07 -1.30 0.83 0.82 -0.33 0.00 0.00 177.00 176.95 1y4o h ILE 38 N 6.15 1.34 -4.06 2.83 2.04 -1.02 -3.47 117.51 121.32 1y4o h ILE 38 Ca -0.33 -2.54 -0.13 0.00 1.00 0.00 0.00 64.86 62.86 1y4o h ILE 38 Cb 1.15 3.05 -0.17 0.00 -0.74 0.00 0.00 36.82 40.11 1y4o h ILE 38 CO 1.00 0.74 -0.64 -0.75 0.00 0.00 0.00 178.15 178.50 1y4o s LYS 39 N -2.47 0.53 -0.29 2.37 2.20 -1.19 -5.05 119.74 115.83 1y4o s LYS 39 Ca -0.14 -0.94 -0.01 0.00 -0.36 0.00 0.00 55.97 54.52 1y4o s LYS 39 Cb 0.02 0.19 0.18 0.00 -1.51 0.00 0.00 37.83 36.72 1y4o s LYS 39 CO 0.84 -0.11 0.58 -1.12 -0.36 0.00 0.00 175.35 175.18 1y4o s SER 40 N -2.33 -1.23 0.00 1.43 0.01 -1.25 -2.75 113.70 107.58 1y4o s SER 40 Ca -0.02 0.78 0.26 0.00 1.31 0.00 0.00 55.95 58.28 1y4o s SER 40 Cb 0.01 2.06 0.73 0.00 0.21 0.00 0.00 66.02 69.03 1y4o s SER 40 CO -0.06 -0.27 1.57 0.41 0.41 0.00 0.00 173.24 175.30 1y4o n THR 41 N 5.42 0.00 -3.62 1.44 -1.04 0.10 -4.88 114.28 111.70 1y4o n THR 41 Ca -0.01 -0.01 -0.18 0.00 -2.04 0.00 0.00 64.05 61.80 1y4o n THR 41 Cb 0.51 0.08 0.01 0.00 -1.82 0.00 0.00 70.33 69.11 1y4o n THR 41 CO 0.00 0.00 0.00 0.23 -0.64 0.00 0.00 175.07 174.66 1y4o n MET 42 N -1.39 0.84 -2.43 -2.82 2.81 -1.26 -4.83 117.12 108.04 1y4o n MET 42 Ca 0.07 -2.52 -0.38 0.00 -1.81 0.00 0.00 57.70 53.05 1y4o n MET 42 Cb 0.33 0.17 -0.03 0.00 -0.71 0.00 0.00 33.22 32.99 1y4o n MET 42 CO 0.00 0.00 0.00 -0.51 1.51 0.00 0.00 175.97 176.97 1y4o s ASP 43 N -3.48 6.81 0.18 7.83 1.01 -1.26 -4.88 116.67 122.88 1y4o s ASP 43 Ca 0.28 2.23 -0.13 0.00 0.71 0.00 0.00 52.55 55.64 1y4o s ASP 43 Cb -0.02 -2.61 0.15 0.00 1.01 0.00 0.00 42.92 41.45 1y4o s ASP 43 CO 0.18 -0.47 1.78 0.78 0.21 0.00 0.00 175.17 177.66 1y4o h ASN 44 N 2.92 0.36 -0.31 0.27 4.21 -1.98 0.12 115.58 121.17 1y4o h ASN 44 Ca -0.48 0.03 0.07 0.00 1.21 0.00 0.00 56.30 57.13 1y4o h ASN 44 Cb 1.22 -0.03 -0.08 0.00 -1.12 0.00 0.00 38.32 38.30 1y4o h ASN 44 CO 0.64 0.25 -0.32 1.55 -1.29 0.00 0.00 177.43 178.26 1y4o h PRO 45 N 0.50 -0.28 -0.57 0.81 0.13 -1.99 0.18 132.00 130.77 1y4o h PRO 45 Ca 0.23 0.02 0.02 0.00 -0.87 0.00 0.00 66.00 65.40 1y4o h PRO 45 Cb 0.15 0.06 -0.03 0.00 0.13 0.00 0.00 31.00 31.31 1y4o h PRO 45 CO -0.17 -0.19 0.36 1.15 -0.23 0.00 0.00 178.00 178.93 1y4o h THR 46 N -0.29 1.09 -0.62 1.56 2.02 -1.85 -1.00 112.91 113.84 1y4o h THR 46 Ca 0.15 -0.25 0.05 0.00 0.77 0.00 0.00 66.41 67.13 1y4o h THR 46 Cb 0.53 0.31 -0.05 0.00 -1.74 0.00 0.00 68.15 67.20 1y4o h THR 46 CO -0.48 0.13 0.34 0.74 0.37 0.00 0.00 175.52 176.62 1y4o h THR 47 N 0.72 0.98 -0.61 3.16 2.02 -0.28 -2.11 112.91 116.79 1y4o h THR 47 Ca 0.22 -0.22 -0.03 0.00 0.77 0.00 0.00 66.41 67.15 1y4o h THR 47 Cb -0.02 0.28 -0.03 0.00 -1.74 0.00 0.00 68.15 66.65 1y4o h THR 47 CO -0.08 0.12 0.25 0.74 0.37 0.00 0.00 175.52 176.92 1y4o h THR 48 N 0.64 1.23 0.30 3.16 2.02 0.06 -0.23 112.91 120.09 1y4o h THR 48 Ca 0.27 -0.70 0.00 0.00 0.77 0.00 0.00 66.41 66.75 1y4o h THR 48 Cb 0.15 0.55 -0.02 0.00 -1.74 0.00 0.00 68.15 67.09 1y4o h THR 48 CO -0.17 0.28 -0.30 1.56 0.37 0.00 0.00 175.52 177.26 1y4o h GLN 49 N 0.85 -0.61 -0.44 6.66 4.20 -0.56 -0.87 115.11 124.34 1y4o h GLN 49 Ca 0.20 0.04 -0.10 0.00 0.06 0.00 0.00 58.65 58.86 1y4o h GLN 49 Cb 0.19 0.14 -0.01 0.00 0.30 0.00 0.00 27.48 28.09 1y4o h GLN 49 CO -0.02 -0.40 -0.12 1.88 -0.67 0.00 0.00 178.83 179.50 1y4o h TYR 50 N -0.63 0.96 -0.61 2.96 -1.99 -1.38 -1.62 116.97 114.66 1y4o h TYR 50 Ca -0.01 -0.21 0.02 0.00 2.00 0.00 0.00 58.73 60.53 1y4o h TYR 50 Cb 0.58 -0.23 -0.04 0.00 2.00 0.00 0.00 36.73 39.04 1y4o h TYR 50 CO -0.18 0.96 0.38 0.00 -0.00 0.00 0.00 178.16 179.32 1y4o h ALA 51 N 0.86 0.78 -0.20 3.88 0.00 -0.87 0.10 119.26 123.81 1y4o h ALA 51 Ca 0.11 -0.03 -0.14 0.00 0.00 0.00 0.00 54.91 54.85 1y4o h ALA 51 Cb 0.66 -0.21 0.00 0.00 0.00 0.00 0.00 17.79 18.24 1y4o h ALA 51 CO 0.05 0.14 -0.42 -0.91 0.00 0.00 0.00 179.25 178.11 1y4o h ASN 52 N 0.77 0.73 -0.75 0.00 2.35 -1.12 -2.41 115.58 115.15 1y4o h ASN 52 Ca 0.24 -0.55 -0.01 0.00 -0.55 0.00 0.00 56.30 55.42 1y4o h ASN 52 Cb -0.02 -0.21 -0.04 0.00 0.05 0.00 0.00 38.32 38.10 1y4o h ASN 52 CO -0.08 1.14 0.43 0.25 -1.65 0.00 0.00 177.43 177.53 1y4o h LEU 53 N 0.34 0.91 -0.95 1.61 7.12 -1.04 -2.59 115.31 120.71 1y4o h LEU 53 Ca 0.00 -0.08 -0.08 0.00 0.13 0.00 0.00 57.88 57.86 1y4o h LEU 53 Cb 1.03 -0.23 -0.02 0.00 -0.53 0.00 0.00 40.66 40.91 1y4o h LEU 53 CO 0.09 0.72 -0.05 0.24 -0.13 0.00 0.00 178.44 179.32 1y4o h MET 54 N 1.03 0.71 -0.23 1.25 2.86 -0.75 0.22 114.93 120.01 1y4o h MET 54 Ca 0.27 -0.20 0.02 0.00 -2.06 0.00 0.00 59.70 57.72 1y4o h MET 54 Cb -0.01 -0.08 -0.02 0.00 0.06 0.00 0.00 31.60 31.55 1y4o h MET 54 CO -0.05 0.76 0.10 0.45 1.06 0.00 0.00 176.91 179.23 1y4o h HIS 55 N 0.66 0.19 -0.40 -0.22 3.86 -1.05 0.54 115.15 118.72 1y4o h HIS 55 Ca 0.12 0.01 -0.14 0.00 -1.16 0.00 0.00 60.37 59.21 1y4o h HIS 55 Cb 0.48 -0.05 -0.01 0.00 1.06 0.00 0.00 27.41 28.89 1y4o h HIS 55 CO 0.02 0.10 -0.29 -0.91 0.86 0.00 0.00 177.93 177.72 1y4o h ASN 56 N 0.23 0.91 0.11 2.45 -0.26 -1.16 -2.58 115.58 115.27 1y4o h ASN 56 Ca 0.10 -0.37 -0.01 0.00 -0.56 0.00 0.00 56.30 55.46 1y4o h ASN 56 Cb 0.04 -0.25 0.00 0.00 -1.06 0.00 0.00 38.32 37.05 1y4o h ASN 56 CO -0.08 1.13 -0.05 0.15 -1.06 0.00 0.00 177.43 177.52 1y4o h PHE 57 N 0.74 -0.13 -0.49 1.19 3.57 -0.30 -2.95 116.94 118.58 1y4o h PHE 57 Ca 0.08 -0.00 0.08 0.00 3.53 0.00 0.00 57.97 61.66 1y4o h PHE 57 Cb 0.85 0.04 -0.06 0.00 2.79 0.00 0.00 35.95 39.57 1y4o h PHE 57 CO 0.05 0.37 0.12 0.82 -2.23 0.00 0.00 178.31 177.44 1y4o h ILE 58 N -0.76 0.76 -0.41 1.41 5.03 0.01 0.50 117.51 124.05 1y4o h ILE 58 Ca -0.01 -0.09 -0.09 0.00 -0.12 0.00 0.00 64.86 64.54 1y4o h ILE 58 Cb 0.56 0.47 -0.02 0.00 -3.03 0.00 0.00 36.82 34.80 1y4o h ILE 58 CO 0.02 0.05 -0.12 -0.07 -0.68 0.00 0.00 178.15 177.35 1y4o h LEU 59 N 0.27 0.73 -0.42 1.44 3.38 -1.56 0.90 115.31 120.04 1y4o h LEU 59 Ca 0.24 -0.22 -0.17 0.00 0.09 0.00 0.00 57.88 57.82 1y4o h LEU 59 Cb 0.30 -0.20 -0.00 0.00 0.09 0.00 0.00 40.66 40.85 1y4o h LEU 59 CO -0.29 0.87 -0.56 0.50 0.09 0.00 0.00 178.44 179.05 1y4o h LYS 60 N 0.67 0.67 -0.38 1.13 3.64 -1.26 -2.81 116.57 118.22 1y4o h LYS 60 Ca 0.11 -0.43 -0.10 0.00 -1.27 0.00 0.00 60.65 58.96 1y4o h LYS 60 Cb 0.59 0.05 -0.02 0.00 -0.41 0.00 0.00 32.23 32.45 1y4o h LYS 60 CO 0.04 1.05 -0.15 0.00 -2.27 0.00 0.00 179.45 178.12 1y4o h ALA 61 N 0.86 1.01 -0.36 5.00 0.00 0.46 -1.93 119.26 124.29 1y4o h ALA 61 Ca 0.01 -0.33 0.07 0.00 0.00 0.00 0.00 54.91 54.66 1y4o h ALA 61 Cb 1.13 -0.16 -0.06 0.00 0.00 0.00 0.00 17.79 18.70 1y4o h ALA 61 CO 0.11 0.59 -0.05 0.00 0.00 0.00 0.00 179.25 179.91 1y4o h ARG 62 N 0.63 0.04 0.22 0.00 2.47 -0.68 -0.94 114.38 116.14 1y4o h ARG 62 Ca 0.10 -0.00 0.00 0.00 -1.26 0.00 0.00 59.98 58.82 1y4o h ARG 62 Cb 0.62 -0.01 -0.02 0.00 -1.65 0.00 0.00 29.97 28.91 1y4o h ARG 62 CO 0.04 0.03 -0.23 0.77 0.56 0.00 0.00 179.97 181.15 1y4o h SER 63 N 0.04 -0.60 -0.31 7.04 0.02 -1.21 0.26 113.55 118.79 1y4o h SER 63 Ca 0.17 0.06 0.03 0.00 -0.84 0.00 0.00 61.79 61.21 1y4o h SER 63 Cb 0.26 0.21 -0.02 0.00 0.14 0.00 0.00 62.40 62.99 1y4o h SER 63 CO -0.33 -0.33 0.21 0.71 -1.14 0.00 0.00 176.83 175.94 1y4o h THR 64 N -0.48 1.01 0.02 -2.27 1.35 -0.91 0.25 112.91 111.88 1y4o h THR 64 Ca -0.00 -0.10 -0.09 0.00 -0.55 0.00 0.00 66.41 65.66 1y4o h THR 64 Cb 0.45 0.68 -0.01 0.00 -1.73 0.00 0.00 68.15 67.55 1y4o h THR 64 CO -0.05 0.05 -0.48 0.58 -0.25 0.00 0.00 175.52 175.38 1y4o h VAL 65 N 0.30 1.51 0.00 6.82 2.07 -0.92 -3.38 116.25 122.65 1y4o h VAL 65 Ca 0.13 -2.33 -0.06 0.00 0.82 0.00 0.00 66.70 65.25 1y4o h VAL 65 Cb 0.13 3.06 -0.01 0.00 -1.52 0.00 0.00 31.29 32.95 1y4o h VAL 65 CO -0.03 0.56 -0.31 0.03 0.02 0.00 0.00 177.57 177.85 1y4o h ARG 66 N -0.88 0.00 0.00 1.57 3.08 -0.11 -2.95 114.38 115.09 1y4o h ARG 66 Ca -0.12 0.00 0.00 0.00 0.07 0.00 0.00 59.98 59.93 1y4o h ARG 66 Cb 1.19 0.00 0.00 0.00 0.08 0.00 0.00 29.97 31.24 1y4o h ARG 66 CO -0.03 0.31 0.00 0.39 -1.07 0.00 0.00 179.97 179.57 1y4o n GLU 67 N -3.47 0.11 0.09 0.04 1.02 0.86 -2.13 120.64 117.16 1y4o n GLU 67 Ca -0.00 0.44 -0.10 0.00 -0.02 0.00 0.00 57.16 57.48 1y4o n GLU 67 Cb 0.48 -1.75 -0.07 0.00 -0.02 0.00 0.00 31.44 30.08 1y4o n GLU 67 CO 0.00 0.00 0.00 0.82 1.18 0.00 0.00 177.13 179.13 1y4o h ILE 68 N 0.00 0.63 0.00 -3.67 2.04 -1.71 -3.49 117.51 111.30 1y4o h ILE 68 Ca 0.00 -0.97 0.00 0.00 1.00 0.00 0.00 64.86 64.89 1y4o h ILE 68 Cb 0.20 1.04 0.00 0.00 -0.74 0.00 0.00 36.82 37.32 1y4o h ILE 68 CO 0.00 0.16 0.00 -0.67 0.00 0.00 0.00 178.15 177.64 1y4o n ASP 69 N -4.98 0.00 -0.49 1.72 -0.08 -0.91 -5.01 116.55 106.80 1y4o n ASP 69 Ca -0.07 0.00 0.00 0.00 -1.51 0.00 0.00 54.79 53.21 1y4o n ASP 69 Cb 0.25 0.00 0.00 0.00 2.34 0.00 0.00 41.12 43.71 1y4o n ASP 69 CO 0.00 0.00 0.00 -2.65 0.12 0.00 0.00 177.20 174.67 1y4o n PRO 70 N -0.56 0.00 -0.09 -0.67 -0.02 -1.25 -3.25 135.00 129.16 1y4o n PRO 70 Ca 0.00 0.00 -0.10 0.00 -2.02 0.00 0.00 63.50 61.38 1y4o n PRO 70 Cb 0.00 -0.96 -0.03 0.00 -0.02 0.00 0.00 33.50 32.49 1y4o n PRO 70 CO 0.00 0.00 0.00 1.96 1.98 0.00 0.00 175.50 179.44 1y4o h GLN 71 N 0.90 0.43 -6.29 -0.52 4.20 -1.93 -3.44 115.11 108.47 1y4o h GLN 71 Ca 0.00 -0.10 -0.61 0.00 0.06 0.00 0.00 58.65 58.00 1y4o h GLN 71 Cb 0.00 -0.06 -0.14 0.00 0.30 0.00 0.00 27.48 27.58 1y4o h GLN 71 CO 0.00 0.52 -0.76 0.54 -0.67 0.00 0.00 178.83 178.46 1y4o s ASN 72 N -5.81 3.69 -0.04 1.46 4.22 -1.20 -5.13 114.94 112.13 1y4o s ASN 72 Ca -0.13 -0.94 -0.29 0.00 -2.14 0.00 0.00 52.86 49.35 1y4o s ASN 72 Cb 0.08 -0.37 0.10 0.00 1.28 0.00 0.00 41.25 42.35 1y4o s ASN 72 CO 0.74 0.05 0.88 -0.62 -2.04 0.00 0.00 177.10 176.11 1y4o s ASP 73 N -3.36 -0.41 -0.20 3.54 2.15 -1.26 -4.50 116.67 112.63 1y4o s ASP 73 Ca 0.28 0.18 -0.18 0.00 0.43 0.00 0.00 52.55 53.27 1y4o s ASP 73 Cb -0.06 0.39 -0.03 0.00 -0.30 0.00 0.00 42.92 42.92 1y4o s ASP 73 CO 0.15 -0.56 0.47 -1.48 -0.17 0.00 0.00 175.17 173.58 1y4o s LEU 74 N -2.00 4.15 -0.03 -1.34 0.05 -1.26 -4.90 118.68 113.36 1y4o s LEU 74 Ca 0.01 0.62 0.18 0.00 0.05 0.00 0.00 54.13 55.00 1y4o s LEU 74 Cb -0.01 -2.64 -0.27 0.00 -2.05 0.00 0.00 46.19 41.22 1y4o s LEU 74 CO -0.05 -0.14 0.38 0.35 -0.55 0.00 0.00 176.35 176.35 1y4o n THR 75 N 4.44 0.02 -3.70 5.48 -2.24 -1.26 -4.88 114.28 112.14 1y4o n THR 75 Ca -0.06 -0.41 -0.11 0.00 -2.27 0.00 0.00 64.05 61.20 1y4o n THR 75 Cb 0.51 0.09 -0.11 0.00 -2.10 0.00 0.00 70.33 68.71 1y4o n THR 75 CO 0.00 0.00 0.00 -0.36 -0.57 0.00 0.00 175.07 174.14 1y4o s PHE 76 N -3.22 -0.54 -0.55 4.78 0.40 -1.26 -3.77 117.98 113.82 1y4o s PHE 76 Ca -0.06 1.16 -0.04 0.00 -0.60 0.00 0.00 56.93 57.39 1y4o s PHE 76 Cb 0.11 0.19 0.14 0.00 0.51 0.00 0.00 43.02 43.98 1y4o s PHE 76 CO 0.73 -0.33 0.37 -0.51 0.70 0.00 0.00 175.22 176.18 1y4o s LEU 77 N 1.57 5.31 -0.40 -0.37 1.43 0.34 -4.98 118.68 121.58 1y4o s LEU 77 Ca -0.08 -2.53 -0.05 0.00 -1.03 0.00 0.00 54.13 50.44 1y4o s LEU 77 Cb -0.10 -1.86 0.10 0.00 0.03 0.00 0.00 46.19 44.35 1y4o s LEU 77 CO -0.11 -0.45 0.20 0.00 0.23 0.00 0.00 176.35 176.21 1y4o s ARG 78 N 0.41 2.24 -0.26 1.70 1.70 0.14 -0.14 118.95 124.75 1y4o s ARG 78 Ca 0.13 -1.65 -0.09 0.00 -0.47 0.00 0.00 55.73 53.65 1y4o s ARG 78 Cb -0.21 -3.60 -0.04 0.00 -0.57 0.00 0.00 34.95 30.53 1y4o s ARG 78 CO -0.04 -0.99 0.11 0.42 -1.08 0.00 0.00 175.30 173.73 1y4o s ILE 79 N 1.24 4.71 -0.02 4.99 1.01 0.78 -4.96 121.20 128.95 1y4o s ILE 79 Ca 0.05 -0.04 -0.20 0.00 0.00 0.00 0.00 60.65 60.47 1y4o s ILE 79 Cb -0.23 -3.22 -0.05 0.00 0.01 0.00 0.00 42.46 38.97 1y4o s ILE 79 CO -0.02 0.31 0.56 -0.13 0.00 0.00 0.00 174.94 175.66 1y4o s ARG 80 N 1.60 4.29 0.05 2.79 0.52 -1.26 -0.05 118.95 126.88 1y4o s ARG 80 Ca 0.06 0.66 0.01 0.00 -0.52 0.00 0.00 55.73 55.94 1y4o s ARG 80 Cb -0.15 -3.35 0.01 0.00 0.52 0.00 0.00 34.95 31.98 1y4o s ARG 80 CO 0.06 0.36 0.07 0.45 0.02 0.00 0.00 175.30 176.26 1y4o n SER 81 N 2.82 0.18 -0.08 0.23 2.88 -0.43 -4.89 113.62 114.33 1y4o n SER 81 Ca -0.07 -1.13 -0.22 0.00 -1.33 0.00 0.00 58.87 56.11 1y4o n SER 81 Cb 0.51 -0.04 -0.12 0.00 -0.75 0.00 0.00 64.21 63.81 1y4o n SER 81 CO 0.00 0.00 0.00 0.29 -1.23 0.00 0.00 175.04 174.10 1y4o n LYS 82 N -1.12 0.62 0.05 -1.46 5.02 -1.26 -4.44 118.16 115.58 1y4o n LYS 82 Ca 0.01 0.47 0.03 0.00 -2.02 0.00 0.00 58.31 56.80 1y4o n LYS 82 Cb 0.05 -1.72 -0.06 0.00 -0.02 0.00 0.00 35.03 33.28 1y4o n LYS 82 CO 0.00 0.00 0.00 1.17 -0.52 0.00 0.00 177.40 178.05 1y4o n LYS 83 N -4.14 0.62 -1.73 1.97 0.00 -1.26 -4.98 118.16 108.64 1y4o n LYS 83 Ca -0.34 0.19 0.00 0.00 0.00 0.00 0.00 58.31 58.16 1y4o n LYS 83 Cb 0.80 -1.81 0.00 0.00 0.00 0.00 0.00 35.03 34.02 1y4o n LYS 83 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.40 177.49 1y4o n ASN 84 N -2.82 0.00 -3.77 3.14 4.13 -1.26 -4.85 115.26 109.83 1y4o n ASN 84 Ca -0.07 -0.87 -0.14 0.00 1.68 0.00 0.00 54.58 55.17 1y4o n ASN 84 Cb 0.76 0.00 -0.15 0.00 -1.54 0.00 0.00 39.78 38.86 1y4o n ASN 84 CO 0.00 0.00 0.00 -0.70 0.28 0.00 0.00 177.26 176.84 1y4o s GLU 85 N -1.62 0.06 -0.25 3.52 2.12 0.04 -1.31 118.70 121.25 1y4o s GLU 85 Ca 0.00 0.29 0.02 0.00 0.36 0.00 0.00 54.97 55.64 1y4o s GLU 85 Cb 0.00 -0.17 0.06 0.00 0.26 0.00 0.00 34.13 34.28 1y4o s GLU 85 CO 0.00 -0.15 -0.10 0.42 -0.54 0.00 0.00 175.26 174.90 1y4o s ILE 86 N 1.00 1.99 -0.43 -3.70 1.01 0.92 0.13 121.20 122.13 1y4o s ILE 86 Ca -0.08 -1.51 -0.11 0.00 0.00 0.00 0.00 60.65 58.95 1y4o s ILE 86 Cb -0.11 -2.14 0.08 0.00 0.01 0.00 0.00 42.46 40.30 1y4o s ILE 86 CO -0.04 -0.04 0.30 -0.32 0.00 0.00 0.00 174.94 174.84 1y4o s MET 87 N 1.19 2.71 -0.49 2.79 1.75 -0.09 -0.16 119.30 127.00 1y4o s MET 87 Ca -0.08 -1.43 -0.10 0.00 -1.25 0.00 0.00 55.69 52.84 1y4o s MET 87 Cb -0.20 -3.87 0.12 0.00 2.84 0.00 0.00 34.83 33.72 1y4o s MET 87 CO -0.05 -0.97 0.37 0.08 -0.65 0.00 0.00 175.02 173.80 1y4o s VAL 88 N 1.48 4.31 -0.37 10.11 1.01 0.80 -0.57 120.40 137.18 1y4o s VAL 88 Ca 0.03 -1.82 -0.20 0.00 0.00 0.00 0.00 61.98 59.99 1y4o s VAL 88 Cb -0.23 -3.83 0.01 0.00 0.00 0.00 0.00 36.38 32.32 1y4o s VAL 88 CO 0.03 -0.80 0.62 0.00 0.00 0.00 0.00 175.10 174.96 1y4o s ALA 89 N 1.30 3.44 -0.22 5.51 0.00 0.79 -0.50 121.76 132.08 1y4o s ALA 89 Ca 0.06 -0.94 -0.24 0.00 0.00 0.00 0.00 51.96 50.84 1y4o s ALA 89 Cb -0.26 -3.18 -0.01 0.00 0.00 0.00 0.00 23.12 19.67 1y4o s ALA 89 CO -0.01 -1.41 0.78 -2.14 0.00 0.00 0.00 175.76 172.99 1y4o s PRO 90 N 2.69 4.21 0.32 0.00 0.02 -1.25 -1.37 135.00 139.62 1y4o s PRO 90 Ca 0.23 0.88 0.10 0.00 0.02 0.00 0.00 61.00 62.23 1y4o s PRO 90 Cb -0.15 -3.62 -0.06 0.00 0.02 0.00 0.00 34.50 30.70 1y4o s PRO 90 CO 0.15 -0.42 -0.11 0.34 -0.33 0.00 0.00 177.00 176.63 1y4o s ASP 91 N 1.29 3.54 0.43 2.53 2.15 -0.10 -4.77 116.67 121.74 1y4o s ASP 91 Ca 0.34 -1.16 0.28 0.00 0.43 0.00 0.00 52.55 52.44 1y4o s ASP 91 Cb -0.16 -0.31 0.97 0.00 -0.30 0.00 0.00 42.92 43.13 1y4o s ASP 91 CO 0.09 -0.18 1.82 0.11 -0.17 0.00 0.00 175.17 176.84 1y4o h LYS 92 N 2.12 0.00 0.00 4.34 1.57 -2.01 -3.20 116.57 119.39 1y4o h LYS 92 Ca -0.41 0.00 -0.37 0.00 -1.87 0.00 0.00 60.65 58.00 1y4o h LYS 92 Cb 1.25 0.00 -0.07 0.00 0.08 0.00 0.00 32.23 33.49 1y4o h LYS 92 CO 0.68 0.00 -2.37 -0.25 -0.57 0.00 0.00 179.45 176.94 1y4o n ASP 93 N -2.84 0.40 -3.84 0.86 9.92 -1.26 -4.77 116.55 115.02 1y4o n ASP 93 Ca 0.02 -0.00 -0.08 0.00 -0.53 0.00 0.00 54.79 54.20 1y4o n ASP 93 Cb 0.36 0.69 -0.03 0.00 -0.64 0.00 0.00 41.12 41.50 1y4o n ASP 93 CO 0.00 0.00 0.00 -0.72 0.13 0.00 0.00 177.20 176.61 1y4o s TYR 94 N -2.50 -0.09 -0.09 1.24 1.13 -1.21 -1.91 117.35 113.92 1y4o s TYR 94 Ca -0.14 -0.32 0.04 0.00 -1.41 0.00 0.00 57.07 55.24 1y4o s TYR 94 Cb 0.07 0.54 0.00 0.00 -1.10 0.00 0.00 41.96 41.47 1y4o s TYR 94 CO 0.79 -1.11 -0.22 -0.06 -2.51 0.00 0.00 175.55 172.44 1y4o s PHE 95 N -3.92 2.39 -0.64 -3.49 0.08 0.18 -0.92 117.98 111.65 1y4o s PHE 95 Ca 0.12 -0.95 -0.16 0.00 0.12 0.00 0.00 56.93 56.06 1y4o s PHE 95 Cb -0.04 -1.61 0.15 0.00 -0.57 0.00 0.00 43.02 40.96 1y4o s PHE 95 CO 0.04 -0.39 0.62 -0.51 -0.10 0.00 0.00 175.22 174.89 1y4o s LEU 96 N 0.36 6.25 -0.32 -0.37 1.43 -0.47 -1.92 118.68 123.64 1y4o s LEU 96 Ca -0.17 -2.04 -0.09 0.00 -1.03 0.00 0.00 54.13 50.80 1y4o s LEU 96 Cb -0.17 -2.22 0.01 0.00 0.03 0.00 0.00 46.19 43.83 1y4o s LEU 96 CO 0.08 -0.80 0.14 -0.63 0.23 0.00 0.00 176.35 175.37 1y4o s ILE 97 N 1.30 4.38 -0.05 -0.59 1.01 0.22 -0.15 121.20 127.32 1y4o s ILE 97 Ca 0.09 -0.63 0.03 0.00 0.00 0.00 0.00 60.65 60.14 1y4o s ILE 97 Cb -0.23 -3.30 0.01 0.00 0.01 0.00 0.00 42.46 38.95 1y4o s ILE 97 CO -0.01 -0.01 -0.13 0.68 0.00 0.00 0.00 174.94 175.48 1y4o s VAL 98 N 1.56 1.14 -0.36 2.92 -7.23 0.27 0.28 120.40 118.97 1y4o s VAL 98 Ca 0.03 -0.51 -0.17 0.00 -1.81 0.00 0.00 61.98 59.52 1y4o s VAL 98 Cb -0.18 -1.02 -0.00 0.00 0.56 0.00 0.00 36.38 35.74 1y4o s VAL 98 CO 0.05 0.35 0.45 -0.63 -0.31 0.00 0.00 175.10 175.01 1y4o s ILE 99 N 0.43 5.07 0.42 -0.62 1.09 -0.41 -0.91 121.20 126.27 1y4o s ILE 99 Ca -0.10 0.12 0.07 0.00 -1.10 0.00 0.00 60.65 59.64 1y4o s ILE 99 Cb -0.13 -3.93 -0.04 0.00 -1.06 0.00 0.00 42.46 37.29 1y4o s ILE 99 CO 0.03 -0.22 0.21 -1.10 -0.10 0.00 0.00 174.94 173.76 1y4o s GLN 100 N 2.24 2.27 0.06 2.79 -0.21 0.12 0.28 119.66 127.20 1y4o s GLN 100 Ca 0.15 -1.82 -0.21 0.00 0.02 0.00 0.00 55.36 53.51 1y4o s GLN 100 Cb -0.16 -2.03 -0.06 0.00 1.00 0.00 0.00 33.01 31.75 1y4o s GLN 100 CO 0.13 -0.15 0.62 -0.80 -2.12 0.00 0.00 175.29 172.97 1y4o s ASN 101 N -3.95 7.09 -0.60 5.90 -0.87 0.60 -0.78 114.94 122.34 1y4o s ASN 101 Ca 0.41 1.30 -0.28 0.00 -1.57 0.00 0.00 52.86 52.72 1y4o s ASN 101 Cb 0.03 -2.39 -0.11 0.00 -0.02 0.00 0.00 41.25 38.76 1y4o s ASN 101 CO 0.23 0.21 2.46 -0.81 -2.57 0.00 0.00 177.10 176.62 1y4o n PRO 102 N 2.03 0.81 -4.02 -0.60 -0.04 -1.26 -4.78 135.00 127.13 1y4o n PRO 102 Ca -0.08 0.05 -0.34 0.00 -0.04 0.00 0.00 63.50 63.09 1y4o n PRO 102 Cb 0.50 -2.82 -0.06 0.00 -0.04 0.00 0.00 33.50 31.08 1y4o n PRO 102 CO 0.00 0.00 0.00 -0.08 -0.04 0.00 0.00 175.50 175.38 1y4o s THR 103 N 10.72 5.05 -2.00 0.52 -1.32 -1.26 -5.09 115.64 122.26 1y4o s THR 103 Ca 1.10 -0.21 0.02 0.00 -1.21 0.00 0.00 61.69 61.39 1y4o s THR 103 Cb -0.54 -3.29 0.05 0.00 -1.51 0.00 0.00 72.50 67.21 1y4o s THR 103 CO 0.35 0.41 0.60 -0.62 -2.21 0.00 0.00 174.62 173.15