#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1y4o s HIS 2 N 0.00 1.27 -0.65 1.61 0.09 -1.26 -5.06 115.29 111.29 1y4o s HIS 2 Ca 0.00 -1.93 -0.15 0.00 -0.00 0.00 0.00 55.06 52.98 1y4o s HIS 2 Cb 0.00 -1.35 0.16 0.00 -0.00 0.00 0.00 32.58 31.39 1y4o s HIS 2 CO 0.00 -0.81 0.61 -1.01 -0.00 0.00 0.00 174.74 173.53 1y4o s HIS 3 N 0.84 3.42 -0.03 1.40 4.02 -1.26 -5.01 115.29 118.68 1y4o s HIS 3 Ca 0.17 -1.53 -0.00 0.00 1.02 0.00 0.00 55.06 54.72 1y4o s HIS 3 Cb -0.23 -3.82 0.03 0.00 -1.02 0.00 0.00 32.58 27.53 1y4o s HIS 3 CO -0.02 -1.03 0.01 -1.01 1.02 0.00 0.00 174.74 173.72 1y4o s HIS 4 N 1.14 0.25 -0.22 1.40 0.09 -1.26 -5.11 115.29 111.58 1y4o s HIS 4 Ca 0.09 0.05 -0.03 0.00 -0.00 0.00 0.00 55.06 55.17 1y4o s HIS 4 Cb -0.22 -0.41 0.07 0.00 -0.00 0.00 0.00 32.58 32.02 1y4o s HIS 4 CO -0.01 -0.14 0.06 -1.01 -0.00 0.00 0.00 174.74 173.64 1y4o s HIS 5 N 1.23 1.00 -0.90 1.40 3.76 -1.26 -5.02 115.29 115.50 1y4o s HIS 5 Ca -0.07 -0.97 0.00 0.00 -0.15 0.00 0.00 55.06 53.87 1y4o s HIS 5 Cb -0.13 -1.10 0.33 0.00 1.11 0.00 0.00 32.58 32.79 1y4o s HIS 5 CO -0.02 -0.67 1.70 0.72 -0.85 0.00 0.00 174.74 175.61 1y4o n HIS 6 N 5.06 3.04 -3.78 1.40 -0.00 -1.26 -4.85 115.22 114.82 1y4o n HIS 6 Ca -0.07 -2.76 -0.15 0.00 -0.00 0.00 0.00 57.72 54.74 1y4o n HIS 6 Cb 0.46 -1.04 -0.16 0.00 -0.00 0.00 0.00 29.99 29.25 1y4o n HIS 6 CO 0.00 0.00 0.00 -1.01 -0.00 0.00 0.00 176.34 175.33 1y4o s HIS 7 N -4.12 0.03 0.00 4.41 3.76 -1.26 -5.10 115.29 113.01 1y4o s HIS 7 Ca 0.43 0.11 0.00 0.00 -0.15 0.00 0.00 55.06 55.46 1y4o s HIS 7 Cb 0.26 -0.22 0.00 0.00 1.11 0.00 0.00 32.58 33.74 1y4o s HIS 7 CO -0.19 -0.08 0.00 1.28 -0.85 0.00 0.00 174.74 174.90 1y4o n LEU 8 N 4.07 0.00 0.24 0.89 7.99 -1.26 -4.59 117.00 124.34 1y4o n LEU 8 Ca -0.26 0.00 0.07 0.00 -0.01 0.00 0.00 56.01 55.81 1y4o n LEU 8 Cb 0.51 -0.00 0.59 0.00 -0.11 0.00 0.00 43.42 44.41 1y4o n LEU 8 CO 0.22 -0.01 0.98 -0.33 -1.51 0.00 0.00 177.39 176.75 1y4o h GLU 9 N 0.00 0.00 0.11 3.23 5.08 -2.00 0.50 114.58 121.51 1y4o h GLU 9 Ca 0.00 0.00 -0.33 0.00 -1.00 0.00 0.00 59.36 58.03 1y4o h GLU 9 Cb 0.00 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.24 1y4o h GLU 9 CO 0.00 0.10 -1.72 0.00 -1.00 0.00 0.00 179.01 176.39 1y4o h ALA 10 N 1.90 0.38 0.00 3.43 0.00 -2.03 -3.35 119.26 119.58 1y4o h ALA 10 Ca -0.00 -1.25 -0.06 0.00 0.00 0.00 0.00 54.91 53.60 1y4o h ALA 10 Cb 0.18 0.46 -0.01 0.00 0.00 0.00 0.00 17.79 18.42 1y4o h ALA 10 CO 0.01 1.24 -0.29 1.49 0.00 0.00 0.00 179.25 181.70 1y4o h GLU 11 N 0.07 0.00 -0.95 0.00 4.81 -1.32 -2.99 114.58 114.20 1y4o h GLU 11 Ca -0.32 0.00 0.11 0.00 -0.13 0.00 0.00 59.36 59.02 1y4o h GLU 11 Cb 2.03 0.00 -0.08 0.00 0.63 0.00 0.00 28.75 31.33 1y4o h GLU 11 CO 0.13 0.29 0.58 0.28 -0.73 0.00 0.00 179.01 179.57 1y4o h VAL 12 N 0.00 0.93 -0.95 0.32 2.07 -0.22 0.48 116.25 118.88 1y4o h VAL 12 Ca -0.00 -0.32 0.02 0.00 0.82 0.00 0.00 66.70 67.21 1y4o h VAL 12 Cb 0.78 -0.10 -0.05 0.00 -1.52 0.00 0.00 31.29 30.40 1y4o h VAL 12 CO 0.04 0.17 0.63 -0.33 0.02 0.00 0.00 177.57 178.10 1y4o h GLU 13 N 0.95 1.23 0.11 1.57 5.08 -1.74 0.49 114.58 122.26 1y4o h GLU 13 Ca 0.46 -0.07 -0.27 0.00 -1.00 0.00 0.00 59.36 58.48 1y4o h GLU 13 Cb 0.43 -0.28 0.03 0.00 0.50 0.00 0.00 28.75 29.43 1y4o h GLU 13 CO -0.25 0.82 -1.12 1.49 -1.00 0.00 0.00 179.01 178.94 1y4o h GLU 14 N 1.27 0.57 -0.00 2.33 4.57 -1.46 -3.32 114.58 118.54 1y4o h GLU 14 Ca 0.36 -0.76 -0.13 0.00 -1.18 0.00 0.00 59.36 57.65 1y4o h GLU 14 Cb -0.12 0.25 -0.02 0.00 -0.16 0.00 0.00 28.75 28.71 1y4o h GLU 14 CO -0.08 1.34 -0.60 1.15 -1.18 0.00 0.00 179.01 179.63 1y4o h THR 15 N 0.16 1.43 -0.71 0.32 2.02 0.56 -1.56 112.91 115.14 1y4o h THR 15 Ca -0.17 -2.06 -0.06 0.00 0.77 0.00 0.00 66.41 64.89 1y4o h THR 15 Cb 1.81 2.11 -0.03 0.00 -1.74 0.00 0.00 68.15 70.30 1y4o h THR 15 CO 0.22 0.59 0.20 0.25 0.37 0.00 0.00 175.52 177.15 1y4o h LEU 16 N 0.00 1.05 -0.74 2.58 7.12 -0.15 0.61 115.31 125.78 1y4o h LEU 16 Ca -0.01 -0.20 -0.12 0.00 0.13 0.00 0.00 57.88 57.67 1y4o h LEU 16 Cb 1.07 -0.27 -0.01 0.00 -0.53 0.00 0.00 40.66 40.91 1y4o h LEU 16 CO 0.08 0.99 -0.39 0.50 -0.13 0.00 0.00 178.44 179.48 1y4o h LYS 17 N 1.07 0.50 -0.17 1.25 3.64 -1.62 -2.81 116.57 118.43 1y4o h LYS 17 Ca 0.23 -0.24 -0.15 0.00 -1.27 0.00 0.00 60.65 59.22 1y4o h LYS 17 Cb 0.33 -0.00 -0.01 0.00 -0.41 0.00 0.00 32.23 32.14 1y4o h LYS 17 CO -0.00 0.81 -0.52 -0.09 -2.27 0.00 0.00 179.45 177.38 1y4o h ARG 18 N 0.42 0.48 0.00 1.90 2.43 -0.15 -2.09 114.38 117.37 1y4o h ARG 18 Ca 0.04 -0.29 -0.01 0.00 -0.81 0.00 0.00 59.98 58.91 1y4o h ARG 18 Cb 0.87 0.03 -0.00 0.00 -0.42 0.00 0.00 29.97 30.44 1y4o h ARG 18 CO 0.07 0.88 -0.03 -0.07 -1.51 0.00 0.00 179.97 179.32 1y4o h LEU 19 N 0.38 0.00 0.00 3.80 3.38 0.40 0.14 115.31 123.41 1y4o h LEU 19 Ca 0.01 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.98 1y4o h LEU 19 Cb 1.03 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.78 1y4o h LEU 19 CO 0.09 0.03 -0.00 0.00 0.09 0.00 0.00 178.44 178.65 1y4o n GLN 20 N -4.37 0.06 -0.41 1.13 6.02 -0.81 -3.25 117.38 115.75 1y4o n GLN 20 Ca -0.03 0.05 0.08 0.00 -0.01 0.00 0.00 57.00 57.09 1y4o n GLN 20 Cb 0.12 -1.57 0.24 0.00 1.02 0.00 0.00 30.24 30.06 1y4o n GLN 20 CO 0.00 0.00 0.00 0.43 -1.01 0.00 0.00 177.06 176.48 1y4o n SER 21 N -1.66 3.77 -4.75 1.08 7.64 0.45 -4.96 113.62 115.19 1y4o n SER 21 Ca 0.07 -2.77 -0.38 0.00 1.01 0.00 0.00 58.87 56.80 1y4o n SER 21 Cb 0.36 -0.48 -0.06 0.00 -1.01 0.00 0.00 64.21 63.02 1y4o n SER 21 CO 0.00 0.00 0.00 -1.10 -3.01 0.00 0.00 175.04 170.93 1y4o s GLN 22 N -2.39 4.27 -0.19 1.43 -1.52 -1.09 -5.03 119.66 115.14 1y4o s GLN 22 Ca 0.39 0.52 -0.29 0.00 -1.95 0.00 0.00 55.36 54.03 1y4o s GLN 22 Cb 0.29 -3.38 0.00 0.00 -0.22 0.00 0.00 33.01 29.71 1y4o s GLN 22 CO 0.11 0.29 1.00 0.21 -0.25 0.00 0.00 175.29 176.65 1y4o s LYS 23 N 0.17 4.30 0.00 2.91 2.20 -1.26 -3.13 119.74 124.93 1y4o s LYS 23 Ca 0.27 1.32 0.00 0.00 -0.36 0.00 0.00 55.97 57.20 1y4o s LYS 23 Cb -0.16 -3.61 0.00 0.00 -1.51 0.00 0.00 37.83 32.55 1y4o s LYS 23 CO 0.13 -0.52 0.00 0.41 -0.36 0.00 0.00 175.35 175.00 1y4o n GLY 24 N 3.30 0.76 3.60 5.54 0.00 -1.26 -4.71 105.19 112.41 1y4o n GLY 24 Ca 0.10 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.69 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 -2.02 3.54 0.07 1.61 0.11 -1.18 0.17 120.40 122.69 1y4o s VAL 25 Ca 0.00 0.56 0.09 0.00 -2.93 0.00 0.00 61.98 59.69 1y4o s VAL 25 Cb 0.00 -3.69 -0.22 0.00 -1.53 0.00 0.00 36.38 30.95 1y4o s VAL 25 CO 0.00 -0.41 1.07 1.56 -3.33 0.00 0.00 175.10 173.99 1y4o h GLN 26 N 12.33 0.00 -1.29 1.54 4.20 -1.05 -3.47 115.11 127.38 1y4o h GLN 26 Ca -0.33 -0.01 0.15 0.00 0.06 0.00 0.00 58.65 58.52 1y4o h GLN 26 Cb 1.16 0.00 -0.28 0.00 0.30 0.00 0.00 27.48 28.66 1y4o h GLN 26 CO 1.03 0.84 0.46 0.20 -0.67 0.00 0.00 178.83 180.69 1y4o s GLY 27 N -4.84 0.15 -0.05 3.46 0.00 -0.51 -4.74 107.32 100.79 1y4o s GLY 27 Ca -0.01 3.33 -0.21 0.00 0.00 0.00 0.00 44.72 47.83 1y4o s GLY 27 CO 0.82 2.75 0.61 -0.42 0.00 0.00 0.00 173.10 176.86 1y4o s ILE 28 N 1.43 5.01 -0.37 0.90 1.01 -1.26 -0.74 121.20 127.17 1y4o s ILE 28 Ca -0.08 1.25 0.00 0.00 0.00 0.00 0.00 60.65 61.83 1y4o s ILE 28 Cb -0.03 -3.94 0.12 0.00 0.01 0.00 0.00 42.46 38.62 1y4o s ILE 28 CO -0.14 0.34 0.18 -0.63 0.00 0.00 0.00 174.94 174.70 1y4o s ILE 29 N 0.30 0.80 -0.36 2.92 1.01 0.53 -1.62 121.20 124.78 1y4o s ILE 29 Ca 0.32 -1.86 -0.12 0.00 0.00 0.00 0.00 60.65 58.99 1y4o s ILE 29 Cb -0.17 -1.58 0.01 0.00 0.01 0.00 0.00 42.46 40.73 1y4o s ILE 29 CO 0.16 -0.85 0.22 0.54 0.00 0.00 0.00 174.94 175.01 1y4o s VAL 30 N 1.04 4.85 0.12 2.92 0.11 -0.89 -2.22 120.40 126.32 1y4o s VAL 30 Ca 0.15 -0.59 0.10 0.00 -2.93 0.00 0.00 61.98 58.71 1y4o s VAL 30 Cb -0.21 -3.60 -0.04 0.00 -1.53 0.00 0.00 36.38 30.99 1y4o s VAL 30 CO -0.09 -0.13 -0.25 0.68 -3.33 0.00 0.00 175.10 171.97 1y4o s VAL 31 N 1.62 2.09 0.69 2.04 -7.23 -1.07 -0.32 120.40 118.22 1y4o s VAL 31 Ca 0.04 -1.69 -0.13 0.00 -1.81 0.00 0.00 61.98 58.40 1y4o s VAL 31 Cb -0.18 -1.86 0.01 0.00 0.56 0.00 0.00 36.38 34.91 1y4o s VAL 31 CO 0.08 0.05 1.08 0.20 -0.31 0.00 0.00 175.10 176.20 1y4o s ASN 32 N -2.00 5.11 0.59 4.85 0.01 0.57 -0.56 114.94 123.50 1y4o s ASN 32 Ca 0.12 1.82 0.29 0.00 -0.71 0.00 0.00 52.86 54.37 1y4o s ASN 32 Cb -0.10 -2.52 1.69 0.00 0.41 0.00 0.00 41.25 40.72 1y4o s ASN 32 CO 0.05 -1.63 2.14 0.74 -1.51 0.00 0.00 177.10 176.89 1y4o h THR 33 N -0.45 0.50 0.00 1.60 2.02 -1.64 0.23 112.91 115.17 1y4o h THR 33 Ca -0.45 0.00 0.00 0.00 0.77 0.00 0.00 66.41 66.73 1y4o h THR 33 Cb 1.23 0.88 0.00 0.00 -1.74 0.00 0.00 68.15 68.52 1y4o h THR 33 CO 0.54 0.00 0.00 -0.33 0.37 0.00 0.00 175.52 176.10 1y4o h GLU 34 N 0.00 0.00 -0.20 6.66 5.08 -1.91 -3.46 114.58 120.75 1y4o h GLU 34 Ca 0.07 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.43 1y4o h GLU 34 Cb 0.37 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.62 1y4o h GLU 34 CO -0.00 0.00 0.00 0.41 -1.00 0.00 0.00 179.01 178.42 1y4o n GLY 35 N -0.14 1.16 3.21 -3.84 0.00 0.81 -5.08 105.19 101.32 1y4o n GLY 35 Ca 0.01 -0.22 -0.36 0.00 0.00 0.00 0.00 46.02 45.45 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 -2.20 3.24 -0.22 -0.61 1.01 -1.21 -4.89 121.20 116.33 1y4o s ILE 36 Ca 0.00 -1.23 -0.29 0.00 0.00 0.00 0.00 60.65 59.13 1y4o s ILE 36 Cb 0.00 -2.82 -0.03 0.00 0.01 0.00 0.00 42.46 39.62 1y4o s ILE 36 CO 0.00 -0.08 1.72 -2.84 0.00 0.00 0.00 174.94 173.74 1y4o s PRO 37 N 1.32 3.69 -0.12 2.79 0.02 -1.26 -0.32 135.00 141.11 1y4o s PRO 37 Ca -0.03 1.72 -0.26 0.00 0.02 0.00 0.00 61.00 62.44 1y4o s PRO 37 Cb -0.19 -4.10 -0.23 0.00 0.02 0.00 0.00 34.50 30.00 1y4o s PRO 37 CO -0.00 -1.43 0.76 0.82 -0.33 0.00 0.00 177.00 176.82 1y4o h ILE 38 N 6.30 1.61 -3.21 2.83 2.04 -1.03 -3.48 117.51 122.57 1y4o h ILE 38 Ca -0.35 -2.12 -0.09 0.00 1.00 0.00 0.00 64.86 63.30 1y4o h ILE 38 Cb 1.17 3.00 -0.17 0.00 -0.74 0.00 0.00 36.82 40.08 1y4o h ILE 38 CO 1.00 0.53 -0.21 -0.75 0.00 0.00 0.00 178.15 178.72 1y4o s LYS 39 N -2.38 0.83 -0.02 2.37 2.20 -1.21 -5.06 119.74 116.46 1y4o s LYS 39 Ca -0.17 -0.45 -0.29 0.00 -0.36 0.00 0.00 55.97 54.70 1y4o s LYS 39 Cb -0.02 0.36 0.08 0.00 -1.51 0.00 0.00 37.83 36.74 1y4o s LYS 39 CO 0.63 -0.27 0.71 0.45 -0.36 0.00 0.00 175.35 176.52 1y4o s SER 40 N -2.00 -0.59 0.00 1.43 0.15 -1.26 -2.09 113.70 109.33 1y4o s SER 40 Ca -0.06 0.51 0.15 0.00 0.70 0.00 0.00 55.95 57.26 1y4o s SER 40 Cb -0.01 0.51 0.41 0.00 -1.71 0.00 0.00 66.02 65.22 1y4o s SER 40 CO -0.03 -0.64 1.33 0.35 1.20 0.00 0.00 173.24 175.45 1y4o n THR 41 N 0.60 0.90 -2.42 6.45 -2.24 -0.64 -4.92 114.28 112.02 1y4o n THR 41 Ca -0.17 -0.95 -0.24 0.00 -2.27 0.00 0.00 64.05 60.42 1y4o n THR 41 Cb 0.59 0.58 0.08 0.00 -2.10 0.00 0.00 70.33 69.48 1y4o n THR 41 CO 0.00 0.00 0.00 -0.04 -0.57 0.00 0.00 175.07 174.46 1y4o s MET 42 N -1.03 2.02 0.51 -0.78 -1.94 -1.26 -4.81 119.30 112.01 1y4o s MET 42 Ca 0.32 -0.67 0.00 0.00 -1.71 0.00 0.00 55.69 53.64 1y4o s MET 42 Cb 0.17 -2.28 0.02 0.00 2.01 0.00 0.00 34.83 34.74 1y4o s MET 42 CO 0.22 -1.24 0.74 0.34 -0.01 0.00 0.00 175.02 175.07 1y4o s ASP 43 N -4.58 5.54 0.20 3.03 -1.08 -1.26 -4.80 116.67 113.71 1y4o s ASP 43 Ca 0.62 0.17 -0.13 0.00 -0.52 0.00 0.00 52.55 52.69 1y4o s ASP 43 Cb -0.09 -1.22 0.22 0.00 -1.46 0.00 0.00 42.92 40.38 1y4o s ASP 43 CO 0.43 -0.94 1.66 0.78 0.52 0.00 0.00 175.17 177.62 1y4o h ASN 44 N 0.20 -0.32 -0.03 -0.34 4.21 -1.99 0.27 115.58 117.59 1y4o h ASN 44 Ca -0.44 0.14 -0.00 0.00 1.21 0.00 0.00 56.30 57.21 1y4o h ASN 44 Cb 1.27 0.27 -0.00 0.00 -1.12 0.00 0.00 38.32 38.74 1y4o h ASN 44 CO 0.55 -0.12 0.01 1.55 -1.29 0.00 0.00 177.43 178.13 1y4o h PRO 45 N 0.08 0.04 -0.33 0.81 0.13 -2.00 -3.00 132.00 127.74 1y4o h PRO 45 Ca 0.28 -0.01 -0.10 0.00 -0.87 0.00 0.00 66.00 65.30 1y4o h PRO 45 Cb 0.43 -0.01 -0.01 0.00 0.13 0.00 0.00 31.00 31.54 1y4o h PRO 45 CO -0.50 0.14 -0.22 1.15 -0.23 0.00 0.00 178.00 178.34 1y4o h THR 46 N -0.07 1.27 -0.25 1.56 2.02 -1.76 -0.48 112.91 115.19 1y4o h THR 46 Ca 0.01 -1.28 0.00 0.00 0.77 0.00 0.00 66.41 65.91 1y4o h THR 46 Cb 0.11 1.26 -0.01 0.00 -1.74 0.00 0.00 68.15 67.77 1y4o h THR 46 CO -0.00 0.42 0.16 0.71 0.37 0.00 0.00 175.52 177.18 1y4o h THR 47 N 0.55 1.07 -0.70 3.16 1.35 -0.53 -1.80 112.91 116.02 1y4o h THR 47 Ca 0.08 -0.14 -0.03 0.00 -0.55 0.00 0.00 66.41 65.77 1y4o h THR 47 Cb 0.68 0.72 -0.03 0.00 -1.73 0.00 0.00 68.15 67.79 1y4o h THR 47 CO 0.05 0.07 0.30 0.74 -0.25 0.00 0.00 175.52 176.43 1y4o h THR 48 N 0.33 1.24 0.08 6.82 2.02 -1.32 0.21 112.91 122.30 1y4o h THR 48 Ca 0.09 -0.71 0.02 0.00 0.77 0.00 0.00 66.41 66.58 1y4o h THR 48 Cb -0.03 0.41 -0.03 0.00 -1.74 0.00 0.00 68.15 66.76 1y4o h THR 48 CO -0.02 0.29 -0.24 1.56 0.37 0.00 0.00 175.52 177.48 1y4o h GLN 49 N 0.98 -0.41 0.01 6.66 4.20 -0.70 -2.68 115.11 123.18 1y4o h GLN 49 Ca 0.24 0.03 -0.00 0.00 0.06 0.00 0.00 58.65 58.97 1y4o h GLN 49 Cb 0.17 0.09 0.00 0.00 0.30 0.00 0.00 27.48 28.04 1y4o h GLN 49 CO -0.02 -0.27 -0.00 1.88 -0.67 0.00 0.00 178.83 179.74 1y4o h TYR 50 N -0.42 -0.01 -0.47 2.96 0.05 -1.20 -3.21 116.97 114.67 1y4o h TYR 50 Ca 0.04 -0.00 0.05 0.00 0.05 0.00 0.00 58.73 58.86 1y4o h TYR 50 Cb 0.46 0.00 -0.04 0.00 1.01 0.00 0.00 36.73 38.16 1y4o h TYR 50 CO -0.24 0.81 0.22 0.00 -1.05 0.00 0.00 178.16 177.90 1y4o h ALA 51 N -0.01 0.59 0.09 3.88 0.00 -0.64 0.28 119.26 123.45 1y4o h ALA 51 Ca -0.00 0.03 -0.00 0.00 0.00 0.00 0.00 54.91 54.93 1y4o h ALA 51 Cb 0.82 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.57 1y4o h ALA 51 CO 0.00 -0.14 -0.04 -0.91 0.00 0.00 0.00 179.25 178.16 1y4o h ASN 52 N 0.44 -0.10 -0.18 0.00 4.21 -1.65 -1.55 115.58 116.75 1y4o h ASN 52 Ca 0.21 -0.35 0.00 0.00 1.21 0.00 0.00 56.30 57.37 1y4o h ASN 52 Cb 0.14 0.03 -0.01 0.00 -1.12 0.00 0.00 38.32 37.36 1y4o h ASN 52 CO -0.16 0.31 0.11 0.25 -1.29 0.00 0.00 177.43 176.65 1y4o h LEU 53 N -0.54 0.21 -0.36 1.61 7.12 -1.50 -1.16 115.31 120.69 1y4o h LEU 53 Ca -0.01 -0.03 -0.04 0.00 0.13 0.00 0.00 57.88 57.93 1y4o h LEU 53 Cb 0.45 -0.05 -0.01 0.00 -0.53 0.00 0.00 40.66 40.51 1y4o h LEU 53 CO 0.02 0.18 0.07 -0.03 -0.13 0.00 0.00 178.44 178.55 1y4o h MET 54 N 0.22 0.58 -0.53 1.25 4.05 -0.51 0.68 114.93 120.68 1y4o h MET 54 Ca 0.06 -0.15 -0.00 0.00 -0.28 0.00 0.00 59.70 59.33 1y4o h MET 54 Cb 0.00 -0.07 -0.03 0.00 -0.80 0.00 0.00 31.60 30.71 1y4o h MET 54 CO -0.01 0.64 0.32 1.25 0.23 0.00 0.00 176.91 179.34 1y4o h HIS 55 N 0.43 0.70 -0.49 1.39 -0.00 -1.10 0.26 115.15 116.34 1y4o h HIS 55 Ca 0.11 -0.00 -0.08 0.00 -0.00 0.00 0.00 60.37 60.40 1y4o h HIS 55 Cb 0.33 -0.23 -0.02 0.00 -0.00 0.00 0.00 27.41 27.49 1y4o h HIS 55 CO 0.02 0.48 -0.03 -0.91 -0.00 0.00 0.00 177.93 177.49 1y4o h ASN 56 N 0.72 0.82 -0.04 3.26 2.35 -0.98 -2.36 115.58 119.35 1y4o h ASN 56 Ca 0.19 -0.22 -0.12 0.00 -0.55 0.00 0.00 56.30 55.60 1y4o h ASN 56 Cb -0.02 -0.22 -0.01 0.00 0.05 0.00 0.00 38.32 38.12 1y4o h ASN 56 CO -0.04 0.90 -0.36 0.15 -1.65 0.00 0.00 177.43 176.44 1y4o h PHE 57 N 0.78 0.62 -0.51 1.19 3.57 -0.10 -1.52 116.94 120.98 1y4o h PHE 57 Ca 0.14 -0.17 -0.04 0.00 3.53 0.00 0.00 57.97 61.44 1y4o h PHE 57 Cb 0.51 -0.14 -0.02 0.00 2.79 0.00 0.00 35.95 39.09 1y4o h PHE 57 CO 0.03 0.82 0.17 0.82 -2.23 0.00 0.00 178.31 177.92 1y4o h ILE 58 N 0.45 1.22 -0.12 1.41 5.03 -0.24 0.57 117.51 125.84 1y4o h ILE 58 Ca 0.05 -0.73 -0.10 0.00 -0.12 0.00 0.00 64.86 63.95 1y4o h ILE 58 Cb 0.83 0.75 -0.01 0.00 -3.03 0.00 0.00 36.82 35.36 1y4o h ILE 58 CO 0.07 0.27 -0.38 0.25 -0.68 0.00 0.00 178.15 177.68 1y4o h LEU 59 N 0.68 0.26 -0.11 1.44 6.46 -1.28 -1.68 115.31 121.08 1y4o h LEU 59 Ca 0.17 -0.10 -0.07 0.00 -0.12 0.00 0.00 57.88 57.75 1y4o h LEU 59 Cb 0.25 -0.07 0.00 0.00 -0.73 0.00 0.00 40.66 40.10 1y4o h LEU 59 CO -0.01 0.62 -0.20 0.50 -0.62 0.00 0.00 178.44 178.73 1y4o h LYS 60 N 0.22 0.34 -0.29 1.25 3.64 -0.87 -2.96 116.57 117.88 1y4o h LYS 60 Ca 0.02 -0.21 0.01 0.00 -1.27 0.00 0.00 60.65 59.20 1y4o h LYS 60 Cb 0.77 0.02 -0.01 0.00 -0.41 0.00 0.00 32.23 32.60 1y4o h LYS 60 CO 0.06 0.80 0.19 0.00 -2.27 0.00 0.00 179.45 178.23 1y4o h ALA 61 N 0.53 1.82 -0.87 5.00 0.00 0.30 -1.63 119.26 124.41 1y4o h ALA 61 Ca 0.01 -0.02 0.14 0.00 0.00 0.00 0.00 54.91 55.04 1y4o h ALA 61 Cb 0.78 -0.11 -0.07 0.00 0.00 0.00 0.00 17.79 18.39 1y4o h ALA 61 CO 0.05 0.16 0.56 0.00 0.00 0.00 0.00 179.25 180.02 1y4o h ARG 62 N 0.38 0.64 -0.20 0.00 2.47 -1.14 -0.16 114.38 116.37 1y4o h ARG 62 Ca 0.11 -0.04 -0.08 0.00 -1.26 0.00 0.00 59.98 58.71 1y4o h ARG 62 Cb -0.01 -0.14 -0.00 0.00 -1.65 0.00 0.00 29.97 28.16 1y4o h ARG 62 CO -0.02 0.42 -0.21 0.77 0.56 0.00 0.00 179.97 181.49 1y4o h SER 63 N 0.66 0.52 0.54 7.04 0.02 -1.28 -1.26 113.55 119.79 1y4o h SER 63 Ca 0.43 -0.48 -0.21 0.00 -0.84 0.00 0.00 61.79 60.69 1y4o h SER 63 Cb 0.72 -0.15 -0.01 0.00 0.14 0.00 0.00 62.40 63.11 1y4o h SER 63 CO -0.19 0.90 -0.94 0.71 -1.14 0.00 0.00 176.83 176.17 1y4o h THR 64 N 0.16 1.48 -0.17 -2.27 1.35 -1.47 0.39 112.91 112.38 1y4o h THR 64 Ca 0.03 -2.66 -0.16 0.00 -0.55 0.00 0.00 66.41 63.07 1y4o h THR 64 Cb 0.75 2.52 -0.01 0.00 -1.73 0.00 0.00 68.15 69.69 1y4o h THR 64 CO 0.05 0.78 -0.56 1.62 -0.25 0.00 0.00 175.52 177.16 1y4o h VAL 65 N 0.13 1.33 0.00 6.82 3.04 -1.01 -3.02 116.25 123.54 1y4o h VAL 65 Ca -0.06 -1.82 -0.13 0.00 -1.01 0.00 0.00 66.70 63.67 1y4o h VAL 65 Cb 1.58 1.80 -0.02 0.00 -2.01 0.00 0.00 31.29 32.65 1y4o h VAL 65 CO 0.15 0.56 -0.81 0.03 -1.01 0.00 0.00 177.57 176.49 1y4o h ARG 66 N 0.40 0.00 -0.40 4.17 2.47 -1.21 -3.30 114.38 116.51 1y4o h ARG 66 Ca 0.00 0.00 0.00 0.00 -1.26 0.00 0.00 59.98 58.73 1y4o h ARG 66 Cb 1.10 0.00 -0.02 0.00 -1.65 0.00 0.00 29.97 29.40 1y4o h ARG 66 CO 0.10 0.48 0.25 1.49 0.56 0.00 0.00 179.97 182.85 1y4o h GLU 67 N 0.00 0.53 0.06 0.04 4.81 -0.78 -1.39 114.58 117.84 1y4o h GLU 67 Ca -0.05 -0.04 -0.00 0.00 -0.13 0.00 0.00 59.36 59.14 1y4o h GLU 67 Cb 1.47 -0.12 0.00 0.00 0.63 0.00 0.00 28.75 30.74 1y4o h GLU 67 CO 0.06 0.36 -0.03 0.82 -0.73 0.00 0.00 179.01 179.50 1y4o h ILE 68 N 0.54 0.98 0.00 2.32 2.04 -1.62 -3.47 117.51 118.29 1y4o h ILE 68 Ca 0.14 -0.12 0.00 0.00 1.00 0.00 0.00 64.86 65.88 1y4o h ILE 68 Cb -0.04 1.06 0.00 0.00 -0.74 0.00 0.00 36.82 37.10 1y4o h ILE 68 CO -0.03 0.03 0.00 -0.67 0.00 0.00 0.00 178.15 177.48 1y4o n ASP 69 N -5.10 0.00 -1.36 1.72 2.03 -0.53 -5.01 116.55 108.30 1y4o n ASP 69 Ca -0.08 0.00 0.00 0.00 0.52 0.00 0.00 54.79 55.23 1y4o n ASP 69 Cb 0.08 0.00 0.00 0.00 -0.72 0.00 0.00 41.12 40.48 1y4o n ASP 69 CO 0.00 0.00 0.00 -0.81 -1.92 0.00 0.00 177.20 174.47 1y4o n PRO 70 N -0.38 0.46 0.00 -0.67 -0.04 -1.21 -4.20 135.00 128.96 1y4o n PRO 70 Ca 0.00 0.00 0.13 0.00 -0.04 0.00 0.00 63.50 63.59 1y4o n PRO 70 Cb 0.00 -1.27 0.79 0.00 -0.04 0.00 0.00 33.50 32.98 1y4o n PRO 70 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1y4o n GLN 71 N 1.24 0.82 -3.80 0.54 10.64 -1.26 -4.84 117.38 120.71 1y4o n GLN 71 Ca 0.00 0.00 -0.12 0.00 -1.83 0.00 0.00 57.00 55.05 1y4o n GLN 71 Cb 0.23 -1.50 -0.01 0.00 -0.86 0.00 0.00 30.24 28.10 1y4o n GLN 71 CO 0.00 0.00 0.00 0.27 -1.83 0.00 0.00 177.06 175.50 1y4o n ASN 72 N -1.02 -1.70 -4.44 2.61 0.23 -1.26 -5.16 115.26 104.53 1y4o n ASN 72 Ca 0.20 -2.71 -0.21 0.00 -0.53 0.00 0.00 54.58 51.32 1y4o n ASN 72 Cb 0.10 2.98 -0.10 0.00 -2.08 0.00 0.00 39.78 40.67 1y4o n ASN 72 CO 0.00 0.00 0.00 -1.81 -0.93 0.00 0.00 177.26 174.52 1y4o s ASP 73 N -3.06 2.55 -0.63 0.53 1.01 -1.26 -4.99 116.67 110.82 1y4o s ASP 73 Ca 0.23 -1.29 -0.21 0.00 0.71 0.00 0.00 52.55 51.99 1y4o s ASP 73 Cb -0.03 -0.12 0.08 0.00 1.01 0.00 0.00 42.92 43.86 1y4o s ASP 73 CO 0.17 -0.49 0.86 -0.22 0.21 0.00 0.00 175.17 175.70 1y4o s LEU 74 N -3.46 4.75 -0.21 1.23 2.96 -1.26 -4.85 118.68 117.83 1y4o s LEU 74 Ca 0.33 -1.12 0.06 0.00 -0.22 0.00 0.00 54.13 53.18 1y4o s LEU 74 Cb 0.07 -2.39 -0.21 0.00 0.50 0.00 0.00 46.19 44.16 1y4o s LEU 74 CO 0.13 -1.30 -0.03 0.41 -1.32 0.00 0.00 176.35 174.25 1y4o n THR 75 N 5.79 1.50 -3.72 3.68 -1.04 -1.26 -4.54 114.28 114.69 1y4o n THR 75 Ca -0.06 -0.67 -0.14 0.00 -2.04 0.00 0.00 64.05 61.14 1y4o n THR 75 Cb 0.44 -1.17 -0.14 0.00 -1.82 0.00 0.00 70.33 67.64 1y4o n THR 75 CO 0.00 0.00 0.00 -0.36 -0.64 0.00 0.00 175.07 174.07 1y4o s PHE 76 N -2.52 -0.22 -0.35 -1.42 0.40 -1.26 -3.66 117.98 108.95 1y4o s PHE 76 Ca -0.25 0.60 0.01 0.00 -0.60 0.00 0.00 56.93 56.70 1y4o s PHE 76 Cb 0.08 -0.09 0.11 0.00 0.51 0.00 0.00 43.02 43.62 1y4o s PHE 76 CO 0.70 -0.22 0.11 -1.17 0.70 0.00 0.00 175.22 175.34 1y4o s LEU 77 N 1.52 3.28 -0.14 -0.37 0.20 -0.42 -5.01 118.68 117.74 1y4o s LEU 77 Ca -0.06 -2.01 0.01 0.00 0.69 0.00 0.00 54.13 52.76 1y4o s LEU 77 Cb -0.11 -1.19 0.02 0.00 -0.43 0.00 0.00 46.19 44.47 1y4o s LEU 77 CO -0.07 -0.38 -0.15 0.00 -0.29 0.00 0.00 176.35 175.47 1y4o s ARG 78 N 1.12 2.33 -0.18 1.98 1.70 0.21 -0.73 118.95 125.38 1y4o s ARG 78 Ca 0.12 -0.58 0.01 0.00 -0.47 0.00 0.00 55.73 54.81 1y4o s ARG 78 Cb -0.19 -2.08 0.03 0.00 -0.57 0.00 0.00 34.95 32.14 1y4o s ARG 78 CO -0.15 -0.18 -0.18 0.42 -1.08 0.00 0.00 175.30 174.14 1y4o s ILE 79 N 1.31 1.98 -0.08 4.99 1.01 0.06 -4.97 121.20 125.49 1y4o s ILE 79 Ca 0.01 -0.97 -0.12 0.00 0.00 0.00 0.00 60.65 59.57 1y4o s ILE 79 Cb -0.13 -1.84 -0.05 0.00 0.01 0.00 0.00 42.46 40.45 1y4o s ILE 79 CO -0.08 0.45 0.29 -0.60 0.00 0.00 0.00 174.94 175.00 1y4o s ARG 80 N 1.31 3.86 -0.36 2.79 3.52 -1.26 0.08 118.95 128.89 1y4o s ARG 80 Ca 0.03 0.16 0.03 0.00 -0.13 0.00 0.00 55.73 55.82 1y4o s ARG 80 Cb -0.14 -3.27 0.16 0.00 -1.56 0.00 0.00 34.95 30.14 1y4o s ARG 80 CO -0.12 0.59 0.38 -1.54 -0.81 0.00 0.00 175.30 173.81 1y4o s SER 81 N -0.63 1.04 0.00 -2.12 1.04 0.11 -4.96 113.70 108.18 1y4o s SER 81 Ca 0.19 -1.43 0.00 0.00 0.48 0.00 0.00 55.95 55.19 1y4o s SER 81 Cb -0.14 0.65 0.00 0.00 0.10 0.00 0.00 66.02 66.63 1y4o s SER 81 CO 0.08 -0.27 0.00 0.29 0.98 0.00 0.00 173.24 174.32 1y4o n LYS 82 N 4.38 0.00 -0.04 4.02 4.76 -1.26 -0.84 118.16 129.19 1y4o n LYS 82 Ca 0.10 0.00 -0.04 0.00 -2.87 0.00 0.00 58.31 55.50 1y4o n LYS 82 Cb 0.46 0.00 0.18 0.00 -1.84 0.00 0.00 35.03 33.83 1y4o n LYS 82 CO 0.00 0.00 0.00 -0.22 -1.37 0.00 0.00 177.40 175.81 1y4o h LYS 83 N 0.00 0.62 0.00 1.97 3.64 -1.98 -3.43 116.57 117.39 1y4o h LYS 83 Ca 0.00 -0.20 -0.20 0.00 -1.27 0.00 0.00 60.65 58.98 1y4o h LYS 83 Cb 0.00 -0.05 -0.05 0.00 -0.41 0.00 0.00 32.23 31.72 1y4o h LYS 83 CO 0.00 0.74 -0.07 0.27 -2.27 0.00 0.00 179.45 178.12 1y4o n ASN 84 N -4.17 -1.22 -3.89 4.20 0.23 -0.02 -4.62 115.26 105.78 1y4o n ASN 84 Ca 0.01 -2.50 -0.18 0.00 -0.53 0.00 0.00 54.58 51.38 1y4o n ASN 84 Cb 0.36 2.21 -0.16 0.00 -2.08 0.00 0.00 39.78 40.12 1y4o n ASN 84 CO 0.00 0.00 0.00 -0.70 -0.93 0.00 0.00 177.26 175.63 1y4o s GLU 85 N -2.56 0.53 -0.39 -3.83 2.12 0.11 0.09 118.70 114.76 1y4o s GLU 85 Ca 0.22 -0.07 -0.02 0.00 0.36 0.00 0.00 54.97 55.46 1y4o s GLU 85 Cb -0.01 -0.58 0.10 0.00 0.26 0.00 0.00 34.13 33.89 1y4o s GLU 85 CO 0.16 -0.04 0.16 0.42 -0.54 0.00 0.00 175.26 175.42 1y4o s ILE 86 N 0.63 3.21 -0.52 -3.70 1.01 0.11 -1.44 121.20 120.49 1y4o s ILE 86 Ca -0.07 -1.94 -0.16 0.00 0.00 0.00 0.00 60.65 58.47 1y4o s ILE 86 Cb -0.10 -3.14 0.11 0.00 0.01 0.00 0.00 42.46 39.33 1y4o s ILE 86 CO -0.01 -0.58 0.49 -0.32 0.00 0.00 0.00 174.94 174.52 1y4o s MET 87 N 1.15 2.99 -0.47 2.79 1.75 -0.73 -0.76 119.30 126.03 1y4o s MET 87 Ca 0.06 -1.58 -0.12 0.00 -1.25 0.00 0.00 55.69 52.80 1y4o s MET 87 Cb -0.22 -4.25 0.09 0.00 2.84 0.00 0.00 34.83 33.29 1y4o s MET 87 CO -0.04 -1.26 0.36 0.08 -0.65 0.00 0.00 175.02 173.51 1y4o s VAL 88 N 1.69 4.73 -0.38 10.11 1.01 0.10 -1.12 120.40 136.53 1y4o s VAL 88 Ca 0.04 -1.37 -0.16 0.00 0.00 0.00 0.00 61.98 60.49 1y4o s VAL 88 Cb -0.28 -3.93 0.01 0.00 0.00 0.00 0.00 36.38 32.18 1y4o s VAL 88 CO 0.04 -0.64 0.36 0.00 0.00 0.00 0.00 175.10 174.86 1y4o s ALA 89 N 1.52 3.47 -0.19 5.51 0.00 -0.31 -1.30 121.76 130.46 1y4o s ALA 89 Ca 0.04 -1.44 -0.25 0.00 0.00 0.00 0.00 51.96 50.31 1y4o s ALA 89 Cb -0.25 -2.90 -0.01 0.00 0.00 0.00 0.00 23.12 19.96 1y4o s ALA 89 CO 0.03 -1.31 0.82 -2.14 0.00 0.00 0.00 175.76 173.16 1y4o s PRO 90 N 1.95 4.27 0.27 0.00 0.02 -1.24 -0.97 135.00 139.30 1y4o s PRO 90 Ca 0.10 0.98 0.02 0.00 0.02 0.00 0.00 61.00 62.11 1y4o s PRO 90 Cb -0.17 -3.59 -0.05 0.00 0.02 0.00 0.00 34.50 30.71 1y4o s PRO 90 CO 0.12 -0.36 0.09 0.34 -0.33 0.00 0.00 177.00 176.85 1y4o s ASP 91 N 1.20 1.33 0.08 2.53 2.15 0.97 -4.65 116.67 120.28 1y4o s ASP 91 Ca 0.37 -1.38 -0.16 0.00 0.43 0.00 0.00 52.55 51.81 1y4o s ASP 91 Cb -0.16 0.13 -0.04 0.00 -0.30 0.00 0.00 42.92 42.56 1y4o s ASP 91 CO 0.11 -0.72 0.85 0.29 -0.17 0.00 0.00 175.17 175.53 1y4o n LYS 92 N -0.49 -0.23 0.00 4.34 5.02 -1.26 -2.55 118.16 122.99 1y4o n LYS 92 Ca -0.00 0.83 0.01 0.00 -2.02 0.00 0.00 58.31 57.13 1y4o n LYS 92 Cb 0.66 -1.23 -0.00 0.00 -0.02 0.00 0.00 35.03 34.45 1y4o n LYS 92 CO 0.00 0.00 0.00 -3.47 -0.52 0.00 0.00 177.40 173.41 1y4o n ASP 93 N -4.53 0.67 -4.16 4.39 2.03 -1.26 -4.66 116.55 109.03 1y4o n ASP 93 Ca 0.01 -0.84 -0.26 0.00 0.52 0.00 0.00 54.79 54.22 1y4o n ASP 93 Cb 0.14 0.50 -0.16 0.00 -0.72 0.00 0.00 41.12 40.87 1y4o n ASP 93 CO 0.00 0.00 0.00 -0.31 -1.92 0.00 0.00 177.20 174.97 1y4o s TYR 94 N -0.72 1.77 -0.37 -0.67 1.51 -1.06 -1.87 117.35 115.94 1y4o s TYR 94 Ca 0.02 -0.45 -0.02 0.00 -1.01 0.00 0.00 57.07 55.60 1y4o s TYR 94 Cb 0.02 -1.17 0.09 0.00 -0.11 0.00 0.00 41.96 40.79 1y4o s TYR 94 CO 0.07 -0.13 0.13 -0.06 -1.11 0.00 0.00 175.55 174.45 1y4o s PHE 95 N -0.13 3.49 -0.95 2.71 0.08 0.27 -0.02 117.98 123.43 1y4o s PHE 95 Ca -0.00 -2.25 -0.21 0.00 0.12 0.00 0.00 56.93 54.59 1y4o s PHE 95 Cb -0.10 -2.82 0.10 0.00 -0.57 0.00 0.00 43.02 39.63 1y4o s PHE 95 CO 0.01 -0.91 1.24 -0.51 -0.10 0.00 0.00 175.22 174.95 1y4o s LEU 96 N 1.17 4.44 -0.33 -0.37 1.43 -0.14 -2.58 118.68 122.29 1y4o s LEU 96 Ca 0.04 -1.75 -0.12 0.00 -1.03 0.00 0.00 54.13 51.27 1y4o s LEU 96 Cb -0.21 -2.46 -0.01 0.00 0.03 0.00 0.00 46.19 43.53 1y4o s LEU 96 CO -0.03 -1.25 0.21 -0.63 0.23 0.00 0.00 176.35 174.87 1y4o s ILE 97 N 3.62 4.98 -0.19 -0.59 1.01 -0.94 -1.16 121.20 127.93 1y4o s ILE 97 Ca 0.37 -0.35 0.01 0.00 0.00 0.00 0.00 60.65 60.68 1y4o s ILE 97 Cb -0.04 -3.58 0.03 0.00 0.01 0.00 0.00 42.46 38.89 1y4o s ILE 97 CO -0.08 -0.01 -0.15 0.54 0.00 0.00 0.00 174.94 175.24 1y4o s VAL 98 N 1.67 1.87 -0.36 2.92 0.11 -0.27 -0.34 120.40 125.99 1y4o s VAL 98 Ca 0.05 -0.99 -0.16 0.00 -2.93 0.00 0.00 61.98 57.95 1y4o s VAL 98 Cb -0.17 -1.80 -0.00 0.00 -1.53 0.00 0.00 36.38 32.87 1y4o s VAL 98 CO 0.09 0.35 0.40 -0.63 -3.33 0.00 0.00 175.10 171.98 1y4o s ILE 99 N 1.33 5.13 0.19 7.04 1.01 0.08 -1.77 121.20 134.21 1y4o s ILE 99 Ca 0.01 0.00 0.04 0.00 0.00 0.00 0.00 60.65 60.70 1y4o s ILE 99 Cb -0.15 -3.89 -0.05 0.00 0.01 0.00 0.00 42.46 38.39 1y4o s ILE 99 CO -0.10 -0.18 -0.04 -1.58 0.00 0.00 0.00 174.94 173.04 1y4o s GLN 100 N 2.09 1.21 0.42 2.79 0.74 -0.52 -0.41 119.66 125.98 1y4o s GLN 100 Ca 0.13 -1.58 -0.26 0.00 0.05 0.00 0.00 55.36 53.70 1y4o s GLN 100 Cb -0.16 -0.58 -0.08 0.00 1.10 0.00 0.00 33.01 33.28 1y4o s GLN 100 CO 0.12 -0.04 1.32 -0.80 -0.55 0.00 0.00 175.29 175.35 1y4o s ASN 101 N -3.24 6.20 -0.53 6.67 0.01 0.13 0.05 114.94 124.22 1y4o s ASN 101 Ca 0.24 2.70 -0.27 0.00 -0.71 0.00 0.00 52.86 54.81 1y4o s ASN 101 Cb 0.05 -2.64 -0.03 0.00 0.41 0.00 0.00 41.25 39.03 1y4o s ASN 101 CO 0.05 -0.93 1.98 -2.16 -1.51 0.00 0.00 177.10 174.53 1y4o s PRO 102 N -2.31 2.63 -0.11 -0.60 0.04 -1.26 -4.70 135.00 128.68 1y4o s PRO 102 Ca 0.58 0.95 0.02 0.00 0.04 0.00 0.00 61.00 62.59 1y4o s PRO 102 Cb -0.39 -4.40 0.01 0.00 0.04 0.00 0.00 34.50 29.76 1y4o s PRO 102 CO 0.50 -2.70 -0.18 0.95 0.04 0.00 0.00 177.00 175.61 1y4o s THR 103 N 9.42 1.69 -2.00 1.26 -4.23 -1.26 -5.08 115.64 115.45 1y4o s THR 103 Ca 0.77 -0.76 0.20 0.00 -1.18 0.00 0.00 61.69 60.72 1y4o s THR 103 Cb -0.16 -1.52 0.58 0.00 1.34 0.00 0.00 72.50 72.74 1y4o s THR 103 CO 0.24 0.48 1.60 1.21 -0.54 0.00 0.00 174.62 177.61