#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 -4.19 1.61 8.25 -1.26 -4.98 115.22 114.65 1y4o n HIS 2 Ca 0.00 0.00 -0.11 0.00 -0.26 0.00 0.00 57.72 57.35 1y4o n HIS 2 Cb 0.00 -0.17 -0.10 0.00 1.12 0.00 0.00 29.99 30.84 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 -2.69 0.99 -0.42 4.41 3.76 -1.26 -5.11 115.29 114.97 1y4o s HIS 3 Ca 0.00 -1.02 -0.25 0.00 -0.15 0.00 0.00 55.06 53.64 1y4o s HIS 3 Cb 0.10 -0.57 0.02 0.00 1.11 0.00 0.00 32.58 33.24 1y4o s HIS 3 CO 0.61 -0.25 0.88 -1.01 -0.85 0.00 0.00 174.74 174.12 1y4o s HIS 4 N -3.73 3.00 0.09 1.40 0.09 -1.26 -4.86 115.29 110.03 1y4o s HIS 4 Ca 0.18 0.48 0.07 0.00 -0.00 0.00 0.00 55.06 55.79 1y4o s HIS 4 Cb 0.06 -3.75 -0.22 0.00 -0.00 0.00 0.00 32.58 28.67 1y4o s HIS 4 CO -0.01 -0.95 1.19 0.45 -0.00 0.00 0.00 174.74 175.42 1y4o h HIS 5 N 8.81 0.05 -3.63 1.40 -0.00 -2.00 -3.44 115.15 116.33 1y4o h HIS 5 Ca -0.24 -0.04 -0.68 0.00 -0.00 0.00 0.00 60.37 59.42 1y4o h HIS 5 Cb 1.08 -0.00 -0.18 0.00 -0.00 0.00 0.00 27.41 28.31 1y4o h HIS 5 CO 0.84 1.03 -0.71 -1.58 -0.00 0.00 0.00 177.93 177.51 1y4o s HIS 6 N -2.69 2.87 -0.60 2.45 5.04 -1.26 -5.07 115.29 116.02 1y4o s HIS 6 Ca -0.00 -0.05 -0.22 0.00 -1.54 0.00 0.00 55.06 53.25 1y4o s HIS 6 Cb 0.09 -1.61 0.07 0.00 0.04 0.00 0.00 32.58 31.18 1y4o s HIS 6 CO 0.83 0.36 0.88 -1.01 -2.34 0.00 0.00 174.74 173.45 1y4o s HIS 7 N -0.98 2.80 0.10 3.88 3.76 -1.26 -4.90 115.29 118.69 1y4o s HIS 7 Ca 0.17 -0.49 -0.16 0.00 -0.15 0.00 0.00 55.06 54.42 1y4o s HIS 7 Cb -0.11 -4.10 -0.05 0.00 1.11 0.00 0.00 32.58 29.43 1y4o s HIS 7 CO 0.07 -1.45 1.54 1.25 -0.85 0.00 0.00 174.74 175.30 1y4o h LEU 8 N 10.85 0.58 -1.12 0.89 7.12 -1.97 -0.77 115.31 130.89 1y4o h LEU 8 Ca -0.28 -0.32 -0.09 0.00 0.13 0.00 0.00 57.88 57.32 1y4o h LEU 8 Cb 1.08 -0.16 -0.01 0.00 -0.53 0.00 0.00 40.66 41.04 1y4o h LEU 8 CO 1.12 0.76 -0.41 -0.33 -0.13 0.00 0.00 178.44 179.45 1y4o h GLU 9 N 0.39 0.00 0.02 1.25 5.08 -2.00 0.57 114.58 119.88 1y4o h GLU 9 Ca 0.09 0.00 -0.21 0.00 -1.00 0.00 0.00 59.36 58.24 1y4o h GLU 9 Cb 0.47 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.71 1y4o h GLU 9 CO 0.02 0.41 -0.94 0.00 -1.00 0.00 0.00 179.01 177.50 1y4o h ALA 10 N 1.59 0.45 -0.25 3.43 0.00 -1.94 -3.22 119.26 119.32 1y4o h ALA 10 Ca -0.00 -0.78 -0.13 0.00 0.00 0.00 0.00 54.91 53.99 1y4o h ALA 10 Cb 0.79 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 18.49 1y4o h ALA 10 CO 0.05 1.00 -0.40 1.49 0.00 0.00 0.00 179.25 181.39 1y4o h GLU 11 N 0.07 0.58 -0.23 0.00 4.81 0.27 -3.07 114.58 117.01 1y4o h GLU 11 Ca -0.05 -0.30 0.06 0.00 -0.13 0.00 0.00 59.36 58.95 1y4o h GLU 11 Cb 1.61 0.01 -0.06 0.00 0.63 0.00 0.00 28.75 30.93 1y4o h GLU 11 CO 0.14 0.88 -0.20 0.28 -0.73 0.00 0.00 179.01 179.39 1y4o h VAL 12 N 0.48 0.47 -0.44 0.32 2.07 -0.95 0.44 116.25 118.63 1y4o h VAL 12 Ca 0.04 0.00 0.02 0.00 0.82 0.00 0.00 66.70 67.58 1y4o h VAL 12 Cb 0.91 0.47 -0.03 0.00 -1.52 0.00 0.00 31.29 31.12 1y4o h VAL 12 CO 0.08 0.00 0.27 -0.33 0.02 0.00 0.00 177.57 177.61 1y4o h GLU 13 N -0.20 0.53 0.03 1.57 5.08 -1.66 0.25 114.58 120.17 1y4o h GLU 13 Ca 0.13 -0.03 -0.00 0.00 -1.00 0.00 0.00 59.36 58.46 1y4o h GLU 13 Cb 0.40 -0.12 0.00 0.00 0.50 0.00 0.00 28.75 29.53 1y4o h GLU 13 CO -0.35 0.35 -0.02 1.49 -1.00 0.00 0.00 179.01 179.48 1y4o h GLU 14 N 0.54 -0.04 -0.68 2.33 4.57 -1.27 -1.01 114.58 119.01 1y4o h GLU 14 Ca 0.17 0.00 -0.05 0.00 -1.18 0.00 0.00 59.36 58.30 1y4o h GLU 14 Cb -0.00 0.01 -0.03 0.00 -0.16 0.00 0.00 28.75 28.57 1y4o h GLU 14 CO -0.07 0.26 0.21 1.79 -1.18 0.00 0.00 179.01 180.02 1y4o h THR 15 N -0.35 1.25 -0.52 0.32 1.35 -0.08 0.28 112.91 115.17 1y4o h THR 15 Ca -0.00 -0.88 -0.12 0.00 -0.55 0.00 0.00 66.41 64.85 1y4o h THR 15 Cb 0.32 0.53 -0.02 0.00 -1.73 0.00 0.00 68.15 67.26 1y4o h THR 15 CO 0.01 0.34 -0.16 0.25 -0.25 0.00 0.00 175.52 175.71 1y4o h LEU 16 N 1.00 1.04 -1.09 3.87 7.12 -0.85 0.45 115.31 126.86 1y4o h LEU 16 Ca 0.22 -0.37 -0.09 0.00 0.13 0.00 0.00 57.88 57.77 1y4o h LEU 16 Cb 0.30 -0.29 -0.01 0.00 -0.53 0.00 0.00 40.66 40.13 1y4o h LEU 16 CO -0.01 1.18 -0.41 0.11 -0.13 0.00 0.00 178.44 179.18 1y4o h LYS 17 N 0.90 0.00 -0.16 1.25 1.57 -0.99 0.64 116.57 119.77 1y4o h LYS 17 Ca 0.13 0.00 -0.19 0.00 -1.87 0.00 0.00 60.65 58.72 1y4o h LYS 17 Cb 0.74 0.00 -0.00 0.00 0.08 0.00 0.00 32.23 33.05 1y4o h LYS 17 CO 0.06 0.41 -0.66 -0.09 -0.57 0.00 0.00 179.45 178.59 1y4o h ARG 18 N 0.00 0.61 -0.14 3.15 2.43 -0.22 -0.55 114.38 119.66 1y4o h ARG 18 Ca -0.00 -0.45 -0.00 0.00 -0.81 0.00 0.00 59.98 58.72 1y4o h ARG 18 Cb 0.82 0.08 -0.01 0.00 -0.42 0.00 0.00 29.97 30.44 1y4o h ARG 18 CO 0.05 1.07 0.07 -0.07 -1.51 0.00 0.00 179.97 179.58 1y4o h LEU 19 N 0.44 0.16 -0.34 3.80 3.38 0.72 -0.05 115.31 123.43 1y4o h LEU 19 Ca -0.02 -0.01 -0.03 0.00 0.09 0.00 0.00 57.88 57.92 1y4o h LEU 19 Cb 1.24 -0.04 -0.00 0.00 0.09 0.00 0.00 40.66 41.95 1y4o h LEU 19 CO 0.13 0.14 -0.13 1.56 0.09 0.00 0.00 178.44 180.22 1y4o h GLN 20 N 0.19 0.00 -0.44 1.13 1.08 -0.43 -3.13 115.11 113.51 1y4o h GLN 20 Ca 0.05 0.00 0.00 0.00 -1.45 0.00 0.00 58.65 57.25 1y4o h GLN 20 Cb 0.02 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 27.45 1y4o h GLN 20 CO -0.01 0.13 0.00 0.43 -0.95 0.00 0.00 178.83 178.44 1y4o n SER 21 N -3.16 3.48 -4.70 1.46 7.64 -0.20 -4.90 113.62 113.26 1y4o n SER 21 Ca 0.03 -1.97 -0.42 0.00 1.01 0.00 0.00 58.87 57.51 1y4o n SER 21 Cb 0.53 -0.29 -0.03 0.00 -1.01 0.00 0.00 64.21 63.41 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 -1.33 4.41 -0.02 1.43 -1.52 -0.26 -5.01 119.66 117.35 1y4o s GLN 22 Ca 0.39 1.65 -0.02 0.00 -1.95 0.00 0.00 55.36 55.43 1y4o s GLN 22 Cb 0.22 -3.48 -0.04 0.00 -0.22 0.00 0.00 33.01 29.49 1y4o s GLN 22 CO 0.30 -0.33 0.12 0.21 -0.25 0.00 0.00 175.29 175.35 1y4o s LYS 23 N 1.69 3.25 0.00 2.91 2.47 -1.26 -4.17 119.74 124.63 1y4o s LYS 23 Ca 0.56 -0.38 0.00 0.00 -1.56 0.00 0.00 55.97 54.58 1y4o s LYS 23 Cb -0.25 -2.98 0.00 0.00 -1.46 0.00 0.00 37.83 33.13 1y4o s LYS 23 CO 0.25 0.67 0.00 0.41 0.16 0.00 0.00 175.35 176.84 1y4o n GLY 24 N 1.19 0.87 3.73 5.54 0.00 -1.26 -4.87 105.19 110.39 1y4o n GLY 24 Ca -0.13 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.48 1y4o n GLY 24 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1y4o s VAL 25 N -2.00 4.62 -1.90 1.61 -7.23 -1.26 -0.95 120.40 113.29 1y4o s VAL 25 Ca 0.00 2.01 0.15 0.00 -1.81 0.00 0.00 61.98 62.33 1y4o s VAL 25 Cb 0.00 -4.29 0.12 0.00 0.56 0.00 0.00 36.38 32.76 1y4o s VAL 25 CO 0.00 0.29 0.98 0.00 -0.31 0.00 0.00 175.10 176.06 1y4o n GLN 26 N 3.04 1.18 0.00 4.82 6.02 0.21 -4.96 117.38 127.69 1y4o n GLN 26 Ca 0.02 -1.38 0.00 0.00 -0.01 0.00 0.00 57.00 55.63 1y4o n GLN 26 Cb 0.50 -1.29 0.00 0.00 1.02 0.00 0.00 30.24 30.46 1y4o n GLN 26 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 1y4o n GLY 27 N 0.88 1.20 2.92 1.08 0.00 -1.00 -4.85 105.19 105.42 1y4o n GLY 27 Ca 0.09 -0.56 -0.16 0.00 0.00 0.00 0.00 46.02 45.39 1y4o n GLY 27 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1y4o s ILE 28 N -2.00 0.36 -0.34 -0.61 1.01 -1.20 -0.26 121.20 118.16 1y4o s ILE 28 Ca 0.00 -0.14 -0.01 0.00 0.00 0.00 0.00 60.65 60.50 1y4o s ILE 28 Cb 0.00 -0.35 0.12 0.00 0.01 0.00 0.00 42.46 42.24 1y4o s ILE 28 CO 0.00 0.13 0.17 -0.63 0.00 0.00 0.00 174.94 174.61 1y4o s ILE 29 N 0.25 0.45 -0.33 2.92 1.01 0.13 -0.65 121.20 124.97 1y4o s ILE 29 Ca -0.02 -1.53 -0.09 0.00 0.00 0.00 0.00 60.65 59.00 1y4o s ILE 29 Cb -0.06 -1.34 0.01 0.00 0.01 0.00 0.00 42.46 41.08 1y4o s ILE 29 CO -0.00 -0.84 0.14 0.54 0.00 0.00 0.00 174.94 174.78 1y4o s VAL 30 N 1.34 4.35 0.08 2.92 0.11 -1.13 -2.38 120.40 125.70 1y4o s VAL 30 Ca 0.14 -0.69 0.05 0.00 -2.93 0.00 0.00 61.98 58.55 1y4o s VAL 30 Cb -0.20 -3.31 -0.03 0.00 -1.53 0.00 0.00 36.38 31.31 1y4o s VAL 30 CO -0.15 -0.04 -0.13 0.68 -3.33 0.00 0.00 175.10 172.13 1y4o s VAL 31 N 1.55 1.11 0.75 2.04 -7.23 -1.15 -0.68 120.40 116.79 1y4o s VAL 31 Ca 0.03 -1.41 -0.11 0.00 -1.81 0.00 0.00 61.98 58.68 1y4o s VAL 31 Cb -0.18 -1.17 0.04 0.00 0.56 0.00 0.00 36.38 35.64 1y4o s VAL 31 CO 0.05 -0.30 1.08 0.20 -0.31 0.00 0.00 175.10 175.81 1y4o s ASN 32 N -1.94 4.85 0.42 4.85 0.01 0.09 -1.00 114.94 122.23 1y4o s ASN 32 Ca 0.00 1.50 0.19 0.00 -0.71 0.00 0.00 52.86 53.84 1y4o s ASN 32 Cb -0.08 -2.30 1.11 0.00 0.41 0.00 0.00 41.25 40.39 1y4o s ASN 32 CO 0.02 -1.77 1.85 0.74 -1.51 0.00 0.00 177.10 176.43 1y4o h THR 33 N -0.94 0.66 -0.14 1.60 2.02 -1.65 0.10 112.91 114.55 1y4o h THR 33 Ca -0.45 -0.13 0.00 0.00 0.77 0.00 0.00 66.41 66.60 1y4o h THR 33 Cb 1.24 0.25 0.00 0.00 -1.74 0.00 0.00 68.15 67.89 1y4o h THR 33 CO 0.57 0.07 0.00 -0.62 0.37 0.00 0.00 175.52 175.91 1y4o n GLU 34 N -4.50 1.41 -1.08 6.66 1.02 -1.26 -4.85 120.64 118.04 1y4o n GLU 34 Ca 0.20 -0.63 0.00 0.00 -0.02 0.00 0.00 57.16 56.70 1y4o n GLU 34 Cb 0.73 -1.23 0.00 0.00 -0.02 0.00 0.00 31.44 30.92 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 0.88 1.05 3.39 0.62 0.00 0.34 -5.04 105.19 106.42 1y4o n GLY 35 Ca 0.10 -0.33 -0.44 0.00 0.00 0.00 0.00 46.02 45.35 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 -2.35 5.19 -0.08 -0.61 1.01 -1.19 -4.90 121.20 118.28 1y4o s ILE 36 Ca 0.00 -1.02 -0.30 0.00 0.00 0.00 0.00 60.65 59.33 1y4o s ILE 36 Cb 0.00 -4.07 -0.05 0.00 0.01 0.00 0.00 42.46 38.35 1y4o s ILE 36 CO 0.00 -0.54 1.55 -2.84 0.00 0.00 0.00 174.94 173.11 1y4o s PRO 37 N 1.64 4.20 -0.21 2.79 0.02 -1.26 -0.73 135.00 141.45 1y4o s PRO 37 Ca 0.04 2.05 -0.20 0.00 0.02 0.00 0.00 61.00 62.91 1y4o s PRO 37 Cb -0.23 -3.91 -0.17 0.00 0.02 0.00 0.00 34.50 30.20 1y4o s PRO 37 CO 0.07 -0.80 0.14 -0.89 -0.33 0.00 0.00 177.00 175.19 1y4o n ILE 38 N 5.42 1.52 -4.01 2.83 5.41 0.14 -4.98 119.36 125.69 1y4o n ILE 38 Ca 0.16 -0.02 -0.10 0.00 1.00 0.00 0.00 62.75 63.80 1y4o n ILE 38 Cb 0.43 -2.07 -0.08 0.00 -0.71 0.00 0.00 39.64 37.21 1y4o n ILE 38 CO 0.00 0.00 0.00 -0.75 0.00 0.00 0.00 176.55 175.80 1y4o s LYS 39 N -2.36 1.09 0.03 0.38 2.20 -1.19 -5.06 119.74 114.82 1y4o s LYS 39 Ca -0.28 -1.24 -0.16 0.00 -0.36 0.00 0.00 55.97 53.93 1y4o s LYS 39 Cb 0.06 0.34 0.03 0.00 -1.51 0.00 0.00 37.83 36.75 1y4o s LYS 39 CO 0.55 -0.37 0.35 -1.12 -0.36 0.00 0.00 175.35 174.39 1y4o s SER 40 N -2.99 -0.21 -0.20 1.43 0.01 -1.26 -2.83 113.70 107.66 1y4o s SER 40 Ca 0.19 -0.03 0.18 0.00 1.31 0.00 0.00 55.95 57.59 1y4o s SER 40 Cb 0.04 0.37 0.40 0.00 0.21 0.00 0.00 66.02 67.04 1y4o s SER 40 CO 0.00 -0.59 1.23 0.41 0.41 0.00 0.00 173.24 174.71 1y4o n THR 41 N 0.75 0.50 -3.79 1.44 -1.04 0.17 -4.88 114.28 107.42 1y4o n THR 41 Ca -0.19 -1.61 -0.10 0.00 -2.04 0.00 0.00 64.05 60.11 1y4o n THR 41 Cb 0.59 1.05 -0.07 0.00 -1.82 0.00 0.00 70.33 70.08 1y4o n THR 41 CO 0.00 0.00 0.00 -0.32 -0.64 0.00 0.00 175.07 174.11 1y4o s MET 42 N -1.45 0.87 0.31 -2.82 0.00 -1.25 -3.25 119.30 111.70 1y4o s MET 42 Ca 0.20 -0.81 -0.30 0.00 0.00 0.00 0.00 55.69 54.78 1y4o s MET 42 Cb 0.33 0.36 -0.11 0.00 0.00 0.00 0.00 34.83 35.41 1y4o s MET 42 CO -0.08 -0.29 1.55 -0.51 0.00 0.00 0.00 175.02 175.69 1y4o s ASP 43 N -2.65 6.40 0.19 1.11 1.11 -1.26 -4.82 116.67 116.74 1y4o s ASP 43 Ca 0.02 2.94 -0.12 0.00 0.18 0.00 0.00 52.55 55.57 1y4o s ASP 43 Cb 0.03 -2.64 0.15 0.00 1.07 0.00 0.00 42.92 41.53 1y4o s ASP 43 CO -0.09 -0.88 1.80 0.78 1.18 0.00 0.00 175.17 177.96 1y4o h ASN 44 N 4.46 0.48 -0.76 0.27 4.21 -2.00 0.30 115.58 122.53 1y4o h ASN 44 Ca -0.48 0.02 0.10 0.00 1.21 0.00 0.00 56.30 57.16 1y4o h ASN 44 Cb 1.22 -0.08 -0.08 0.00 -1.12 0.00 0.00 38.32 38.27 1y4o h ASN 44 CO 0.76 0.33 0.39 1.55 -1.29 0.00 0.00 177.43 179.17 1y4o h PRO 45 N 0.61 0.62 -0.39 0.81 0.13 -1.99 -0.76 132.00 131.02 1y4o h PRO 45 Ca 0.24 -0.04 -0.15 0.00 -0.87 0.00 0.00 66.00 65.19 1y4o h PRO 45 Cb 0.10 -0.14 -0.01 0.00 0.13 0.00 0.00 31.00 31.08 1y4o h PRO 45 CO -0.14 0.41 -0.33 1.15 -0.23 0.00 0.00 178.00 178.86 1y4o h THR 46 N 0.64 1.27 -0.63 1.56 2.02 -1.69 -2.18 112.91 113.90 1y4o h THR 46 Ca 0.38 -1.50 -0.06 0.00 0.77 0.00 0.00 66.41 66.00 1y4o h THR 46 Cb 0.42 1.35 -0.03 0.00 -1.74 0.00 0.00 68.15 68.16 1y4o h THR 46 CO -0.28 0.50 0.14 0.71 0.37 0.00 0.00 175.52 176.95 1y4o h THR 47 N 0.73 1.25 -0.58 3.16 1.35 -0.12 -2.08 112.91 116.63 1y4o h THR 47 Ca 0.07 -0.94 -0.03 0.00 -0.55 0.00 0.00 66.41 64.96 1y4o h THR 47 Cb 0.91 0.62 -0.03 0.00 -1.73 0.00 0.00 68.15 67.92 1y4o h THR 47 CO 0.08 0.35 0.22 0.74 -0.25 0.00 0.00 175.52 176.66 1y4o h THR 48 N 0.96 1.21 0.67 6.82 2.02 -0.99 0.23 112.91 123.83 1y4o h THR 48 Ca 0.20 -0.68 -0.03 0.00 0.77 0.00 0.00 66.41 66.67 1y4o h THR 48 Cb 0.36 0.54 0.01 0.00 -1.74 0.00 0.00 68.15 67.32 1y4o h THR 48 CO 0.00 0.27 -0.32 1.56 0.37 0.00 0.00 175.52 177.40 1y4o h GLN 49 N 0.83 -0.87 -0.48 6.66 4.20 -0.76 -2.94 115.11 121.76 1y4o h GLN 49 Ca 0.20 0.06 -0.05 0.00 0.06 0.00 0.00 58.65 58.92 1y4o h GLN 49 Cb 0.18 0.20 -0.02 0.00 0.30 0.00 0.00 27.48 28.14 1y4o h GLN 49 CO -0.02 -0.57 0.11 1.88 -0.67 0.00 0.00 178.83 179.56 1y4o h TYR 50 N -0.94 0.81 -0.54 2.96 0.05 -1.16 -2.08 116.97 116.08 1y4o h TYR 50 Ca -0.09 -0.10 0.05 0.00 0.05 0.00 0.00 58.73 58.64 1y4o h TYR 50 Cb 0.70 -0.23 -0.05 0.00 1.01 0.00 0.00 36.73 38.17 1y4o h TYR 50 CO -0.02 0.74 0.27 0.00 -1.05 0.00 0.00 178.16 178.10 1y4o h ALA 51 N 0.98 0.69 -0.07 3.88 0.00 -0.58 0.46 119.26 124.61 1y4o h ALA 51 Ca 0.15 0.03 -0.24 0.00 0.00 0.00 0.00 54.91 54.84 1y4o h ALA 51 Cb 0.34 -0.07 0.02 0.00 0.00 0.00 0.00 17.79 18.08 1y4o h ALA 51 CO 0.00 -0.08 -0.89 -0.91 0.00 0.00 0.00 179.25 177.37 1y4o h ASN 52 N 0.52 0.91 -0.39 0.00 2.35 -1.51 -2.86 115.58 114.60 1y4o h ASN 52 Ca 0.24 -0.69 -0.04 0.00 -0.55 0.00 0.00 56.30 55.27 1y4o h ASN 52 Cb 0.16 -0.27 -0.02 0.00 0.05 0.00 0.00 38.32 38.24 1y4o h ASN 52 CO -0.17 1.46 0.09 0.25 -1.65 0.00 0.00 177.43 177.42 1y4o h LEU 53 N 0.44 0.59 -0.60 1.61 7.12 -0.90 -2.52 115.31 121.05 1y4o h LEU 53 Ca -0.09 -0.23 0.08 0.00 0.13 0.00 0.00 57.88 57.77 1y4o h LEU 53 Cb 1.54 -0.16 -0.07 0.00 -0.53 0.00 0.00 40.66 41.45 1y4o h LEU 53 CO 0.18 0.67 0.25 0.24 -0.13 0.00 0.00 178.44 179.65 1y4o h MET 54 N 0.49 0.44 -0.26 1.25 2.86 -0.15 0.19 114.93 119.75 1y4o h MET 54 Ca 0.12 -0.03 0.03 0.00 -2.06 0.00 0.00 59.70 57.76 1y4o h MET 54 Cb 0.31 -0.10 -0.03 0.00 0.06 0.00 0.00 31.60 31.84 1y4o h MET 54 CO 0.00 0.29 0.09 0.45 1.06 0.00 0.00 176.91 178.80 1y4o h HIS 55 N 0.45 0.16 -0.32 -0.22 3.86 -1.24 0.56 115.15 118.40 1y4o h HIS 55 Ca 0.29 0.01 -0.09 0.00 -1.16 0.00 0.00 60.37 59.42 1y4o h HIS 55 Cb 0.32 -0.04 -0.01 0.00 1.06 0.00 0.00 27.41 28.75 1y4o h HIS 55 CO -0.15 0.08 -0.16 -0.91 0.86 0.00 0.00 177.93 177.65 1y4o h ASN 56 N 0.21 0.69 -0.02 2.45 2.35 -1.01 -2.52 115.58 117.74 1y4o h ASN 56 Ca 0.11 -0.41 -0.08 0.00 -0.55 0.00 0.00 56.30 55.38 1y4o h ASN 56 Cb 0.08 -0.19 0.01 0.00 0.05 0.00 0.00 38.32 38.26 1y4o h ASN 56 CO -0.11 0.95 -0.29 0.15 -1.65 0.00 0.00 177.43 176.47 1y4o h PHE 57 N 0.44 0.34 -0.80 1.19 3.57 -0.49 -3.10 116.94 118.08 1y4o h PHE 57 Ca 0.07 -0.17 -0.01 0.00 3.53 0.00 0.00 57.97 61.39 1y4o h PHE 57 Cb 0.69 -0.04 -0.04 0.00 2.79 0.00 0.00 35.95 39.35 1y4o h PHE 57 CO 0.06 0.94 0.46 0.82 -2.23 0.00 0.00 178.31 178.36 1y4o h ILE 58 N -0.37 1.23 -0.36 1.41 5.03 0.06 0.48 117.51 125.00 1y4o h ILE 58 Ca -0.03 -0.56 -0.12 0.00 -0.12 0.00 0.00 64.86 64.03 1y4o h ILE 58 Cb 1.01 0.14 -0.01 0.00 -3.03 0.00 0.00 36.82 34.93 1y4o h ILE 58 CO 0.06 0.26 -0.25 -0.07 -0.68 0.00 0.00 178.15 177.47 1y4o h LEU 59 N 1.11 0.75 -0.44 1.44 3.38 -1.56 0.20 115.31 120.20 1y4o h LEU 59 Ca 0.28 -0.28 -0.16 0.00 0.09 0.00 0.00 57.88 57.82 1y4o h LEU 59 Cb 0.01 -0.21 -0.01 0.00 0.09 0.00 0.00 40.66 40.54 1y4o h LEU 59 CO -0.05 0.97 -0.38 0.50 0.09 0.00 0.00 178.44 179.57 1y4o h LYS 60 N 0.64 0.90 -0.75 1.13 3.64 -1.38 -2.73 116.57 118.01 1y4o h LYS 60 Ca 0.09 -0.47 -0.01 0.00 -1.27 0.00 0.00 60.65 58.99 1y4o h LYS 60 Cb 0.75 0.01 -0.04 0.00 -0.41 0.00 0.00 32.23 32.55 1y4o h LYS 60 CO 0.06 1.12 0.44 0.00 -2.27 0.00 0.00 179.45 178.79 1y4o h ALA 61 N 0.83 1.35 -0.77 5.00 0.00 0.41 -1.74 119.26 124.33 1y4o h ALA 61 Ca 0.06 -0.10 0.10 0.00 0.00 0.00 0.00 54.91 54.98 1y4o h ALA 61 Cb 0.96 -0.30 -0.08 0.00 0.00 0.00 0.00 17.79 18.37 1y4o h ALA 61 CO 0.09 0.55 0.41 0.00 0.00 0.00 0.00 179.25 180.30 1y4o h ARG 62 N 1.04 0.66 0.15 0.00 2.47 -0.32 0.11 114.38 118.50 1y4o h ARG 62 Ca 0.27 -0.04 -0.01 0.00 -1.26 0.00 0.00 59.98 58.94 1y4o h ARG 62 Cb -0.02 -0.15 0.00 0.00 -1.65 0.00 0.00 29.97 28.16 1y4o h ARG 62 CO -0.05 0.43 -0.07 1.03 0.56 0.00 0.00 179.97 181.87 1y4o h SER 63 N 0.68 -0.18 -0.29 7.04 0.87 -1.18 0.34 113.55 120.83 1y4o h SER 63 Ca 0.38 -0.31 0.01 0.00 -1.23 0.00 0.00 61.79 60.64 1y4o h SER 63 Cb 0.41 0.05 -0.01 0.00 -0.44 0.00 0.00 62.40 62.40 1y4o h SER 63 CO -0.27 0.25 0.19 0.71 -0.53 0.00 0.00 176.83 177.18 1y4o h THR 64 N -0.64 1.07 0.24 2.23 1.35 -1.01 0.37 112.91 116.51 1y4o h THR 64 Ca -0.02 -0.13 -0.32 0.00 -0.55 0.00 0.00 66.41 65.39 1y4o h THR 64 Cb 0.48 0.65 0.04 0.00 -1.73 0.00 0.00 68.15 67.59 1y4o h THR 64 CO 0.03 0.07 -1.41 1.62 -0.25 0.00 0.00 175.52 175.59 1y4o h VAL 65 N 0.38 1.30 0.00 6.82 3.04 -0.68 -3.30 116.25 123.81 1y4o h VAL 65 Ca 0.11 -2.67 -0.10 0.00 -1.01 0.00 0.00 66.70 63.03 1y4o h VAL 65 Cb -0.02 3.04 -0.01 0.00 -2.01 0.00 0.00 31.29 32.28 1y4o h VAL 65 CO -0.02 0.80 -0.47 0.03 -1.01 0.00 0.00 177.57 176.89 1y4o h ARG 66 N 0.11 0.00 0.00 4.17 3.08 -0.23 -3.14 114.38 118.37 1y4o h ARG 66 Ca -0.24 0.00 0.00 0.00 0.07 0.00 0.00 59.98 59.81 1y4o h ARG 66 Cb 2.11 0.00 0.00 0.00 0.08 0.00 0.00 29.97 32.16 1y4o h ARG 66 CO 0.26 0.47 0.00 0.39 -1.07 0.00 0.00 179.97 180.03 1y4o n GLU 67 N -3.36 0.14 0.15 0.04 1.02 0.12 -2.26 120.64 116.50 1y4o n GLU 67 Ca 0.01 0.34 -0.14 0.00 -0.02 0.00 0.00 57.16 57.35 1y4o n GLU 67 Cb 0.65 -1.75 -0.08 0.00 -0.02 0.00 0.00 31.44 30.24 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 0.78 0.00 -3.67 2.04 -1.62 -3.48 117.51 111.56 1y4o h ILE 68 Ca 0.00 -0.29 0.00 0.00 1.00 0.00 0.00 64.86 65.57 1y4o h ILE 68 Cb 0.38 0.95 0.00 0.00 -0.74 0.00 0.00 36.82 37.41 1y4o h ILE 68 CO 0.00 0.06 0.00 -0.67 0.00 0.00 0.00 178.15 177.54 1y4o n ASP 69 N -5.18 0.00 -4.18 1.72 -0.08 -0.96 -5.03 116.55 102.84 1y4o n ASP 69 Ca -0.10 0.00 -0.30 0.00 -1.51 0.00 0.00 54.79 52.89 1y4o n ASP 69 Cb 0.21 0.00 -0.09 0.00 2.34 0.00 0.00 41.12 43.57 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 -0.77 0.73 -0.06 -0.67 -0.02 -1.23 -4.12 135.00 128.86 1y4o n PRO 70 Ca 0.00 -1.79 -0.10 0.00 -2.02 0.00 0.00 63.50 59.59 1y4o n PRO 70 Cb 0.00 -3.40 -0.05 0.00 -0.02 0.00 0.00 33.50 30.04 1y4o n PRO 70 CO 0.00 0.00 0.00 1.04 1.98 0.00 0.00 175.50 178.52 1y4o n GLN 71 N 7.95 0.27 -3.97 -0.52 6.02 -1.26 -5.05 117.38 120.82 1y4o n GLN 71 Ca 0.45 0.09 -0.09 0.00 -0.01 0.00 0.00 57.00 57.43 1y4o n GLN 71 Cb 0.45 -1.09 -0.11 0.00 1.02 0.00 0.00 30.24 30.51 1y4o n GLN 71 CO 0.00 0.00 0.00 0.54 -1.01 0.00 0.00 177.06 176.59 1y4o s ASN 72 N -5.55 0.22 0.24 1.08 4.22 -1.26 -5.16 114.94 108.73 1y4o s ASN 72 Ca -0.16 -0.46 0.11 0.00 -2.14 0.00 0.00 52.86 50.22 1y4o s ASN 72 Cb 0.05 0.10 -0.05 0.00 1.28 0.00 0.00 41.25 42.63 1y4o s ASN 72 CO 0.24 -0.28 -0.21 -0.62 -2.04 0.00 0.00 177.10 174.18 1y4o s ASP 73 N -1.36 3.44 -0.49 3.54 2.15 -1.26 -4.63 116.67 118.06 1y4o s ASP 73 Ca -0.15 -0.96 -0.27 0.00 0.43 0.00 0.00 52.55 51.61 1y4o s ASP 73 Cb -0.09 -0.27 -0.05 0.00 -0.30 0.00 0.00 42.92 42.21 1y4o s ASP 73 CO -0.01 0.06 2.17 -0.22 -0.17 0.00 0.00 175.17 177.00 1y4o s LEU 74 N -3.14 3.38 -0.18 -1.34 2.96 -1.26 -4.76 118.68 114.34 1y4o s LEU 74 Ca 0.25 0.95 0.03 0.00 -0.22 0.00 0.00 54.13 55.14 1y4o s LEU 74 Cb -0.06 -2.70 -0.13 0.00 0.50 0.00 0.00 46.19 43.80 1y4o s LEU 74 CO 0.12 -2.54 -0.14 0.41 -1.32 0.00 0.00 176.35 172.88 1y4o n THR 75 N 7.69 1.08 -3.73 3.68 -1.04 -1.26 -4.63 114.28 116.06 1y4o n THR 75 Ca 0.30 -0.45 -0.16 0.00 -2.04 0.00 0.00 64.05 61.70 1y4o n THR 75 Cb 0.52 -1.10 -0.16 0.00 -1.82 0.00 0.00 70.33 67.77 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 -2.38 -0.04 -0.42 -1.42 0.40 -1.26 -3.69 117.98 109.17 1y4o s PHE 76 Ca -0.23 0.30 -0.02 0.00 -0.60 0.00 0.00 56.93 56.38 1y4o s PHE 76 Cb 0.06 -0.25 0.11 0.00 0.51 0.00 0.00 43.02 43.45 1y4o s PHE 76 CO 0.46 -0.15 0.20 -1.17 0.70 0.00 0.00 175.22 175.26 1y4o s LEU 77 N 1.48 5.15 -0.37 -0.37 2.96 0.64 -4.99 118.68 123.18 1y4o s LEU 77 Ca -0.05 -2.16 -0.04 0.00 -0.22 0.00 0.00 54.13 51.66 1y4o s LEU 77 Cb -0.12 -1.79 0.08 0.00 0.50 0.00 0.00 46.19 44.85 1y4o s LEU 77 CO -0.04 -0.49 0.14 -0.13 -1.32 0.00 0.00 176.35 174.51 1y4o s ARG 78 N 0.94 2.29 -0.32 1.98 0.52 0.56 -0.33 118.95 124.60 1y4o s ARG 78 Ca 0.10 -1.53 -0.09 0.00 -0.52 0.00 0.00 55.73 53.69 1y4o s ARG 78 Cb -0.22 -3.49 0.00 0.00 0.52 0.00 0.00 34.95 31.76 1y4o s ARG 78 CO -0.05 -0.88 0.15 0.42 0.02 0.00 0.00 175.30 174.96 1y4o s ILE 79 N 1.25 4.46 -0.14 1.52 1.01 0.03 -4.95 121.20 124.38 1y4o s ILE 79 Ca 0.02 -0.57 -0.14 0.00 0.00 0.00 0.00 60.65 59.96 1y4o s ILE 79 Cb -0.22 -3.33 -0.05 0.00 0.01 0.00 0.00 42.46 38.88 1y4o s ILE 79 CO -0.01 0.00 0.32 -0.13 0.00 0.00 0.00 174.94 175.12 1y4o s ARG 80 N 1.58 4.21 0.00 2.79 0.52 -1.26 0.18 118.95 126.97 1y4o s ARG 80 Ca 0.04 0.16 0.00 0.00 -0.52 0.00 0.00 55.73 55.41 1y4o s ARG 80 Cb -0.18 -3.40 0.00 0.00 0.52 0.00 0.00 34.95 31.89 1y4o s ARG 80 CO 0.06 0.28 0.00 0.43 0.02 0.00 0.00 175.30 176.09 1y4o n SER 81 N 3.39 1.93 0.12 0.23 7.64 0.49 -4.99 113.62 122.43 1y4o n SER 81 Ca -0.12 -0.88 -0.09 0.00 1.01 0.00 0.00 58.87 58.79 1y4o n SER 81 Cb 0.52 0.00 -0.06 0.00 -1.01 0.00 0.00 64.21 63.66 1y4o n SER 81 CO 0.00 0.00 0.00 0.11 -3.01 0.00 0.00 175.04 172.14 1y4o h LYS 82 N 0.00 -0.36 -0.38 1.43 1.57 -2.02 -3.37 116.57 113.44 1y4o h LYS 82 Ca 0.00 0.02 -0.11 0.00 -1.87 0.00 0.00 60.65 58.70 1y4o h LYS 82 Cb 0.00 0.08 -0.01 0.00 0.08 0.00 0.00 32.23 32.38 1y4o h LYS 82 CO 0.00 -0.08 -0.18 -0.22 -0.57 0.00 0.00 179.45 178.40 1y4o h LYS 83 N -1.00 0.79 -3.46 3.15 3.64 -1.99 -3.48 116.57 114.21 1y4o h LYS 83 Ca -0.04 -0.35 -0.11 0.00 -1.27 0.00 0.00 60.65 58.89 1y4o h LYS 83 Cb 0.45 -0.02 -0.04 0.00 -0.41 0.00 0.00 32.23 32.21 1y4o h LYS 83 CO 0.06 0.97 0.07 0.54 -2.27 0.00 0.00 179.45 178.82 1y4o s ASN 84 N -6.50 0.32 -0.08 4.20 4.22 -1.26 -4.94 114.94 110.90 1y4o s ASN 84 Ca -0.12 -1.22 0.00 0.00 -2.14 0.00 0.00 52.86 49.38 1y4o s ASN 84 Cb 0.10 0.76 -0.03 0.00 1.28 0.00 0.00 41.25 43.36 1y4o s ASN 84 CO 0.83 -1.48 -0.08 -0.70 -2.04 0.00 0.00 177.10 173.63 1y4o s GLU 85 N -2.82 2.89 -0.44 3.55 2.12 0.11 -0.38 118.70 123.73 1y4o s GLU 85 Ca 0.21 -0.57 -0.03 0.00 0.36 0.00 0.00 54.97 54.94 1y4o s GLU 85 Cb -0.03 -2.61 0.12 0.00 0.26 0.00 0.00 34.13 31.86 1y4o s GLU 85 CO 0.14 0.57 0.24 0.42 -0.54 0.00 0.00 175.26 176.10 1y4o s ILE 86 N -0.56 3.38 -0.54 -3.70 1.01 0.13 -2.13 121.20 118.78 1y4o s ILE 86 Ca 0.08 -2.18 -0.17 0.00 0.00 0.00 0.00 60.65 58.38 1y4o s ILE 86 Cb -0.12 -3.30 0.11 0.00 0.01 0.00 0.00 42.46 39.16 1y4o s ILE 86 CO 0.02 -0.72 0.55 -0.32 0.00 0.00 0.00 174.94 174.47 1y4o s MET 87 N 0.97 3.01 -0.32 2.79 1.75 -0.07 -0.79 119.30 126.64 1y4o s MET 87 Ca 0.09 -1.50 -0.00 0.00 -1.25 0.00 0.00 55.69 53.03 1y4o s MET 87 Cb -0.23 -4.26 0.07 0.00 2.84 0.00 0.00 34.83 33.26 1y4o s MET 87 CO -0.04 -1.35 0.02 0.08 -0.65 0.00 0.00 175.02 173.08 1y4o s VAL 88 N 1.99 2.77 -0.36 10.11 1.01 0.55 -0.74 120.40 135.73 1y4o s VAL 88 Ca 0.06 -1.69 -0.17 0.00 0.00 0.00 0.00 61.98 60.19 1y4o s VAL 88 Cb -0.27 -2.72 -0.00 0.00 0.00 0.00 0.00 36.38 33.39 1y4o s VAL 88 CO 0.05 -0.26 0.46 0.00 0.00 0.00 0.00 175.10 175.35 1y4o s ALA 89 N 1.15 3.47 -0.24 5.51 0.00 0.22 -0.26 121.76 131.61 1y4o s ALA 89 Ca -0.01 -1.15 -0.18 0.00 0.00 0.00 0.00 51.96 50.62 1y4o s ALA 89 Cb -0.20 -2.97 -0.03 0.00 0.00 0.00 0.00 23.12 19.92 1y4o s ALA 89 CO -0.03 -1.23 0.53 -1.25 0.00 0.00 0.00 175.76 173.77 1y4o s PRO 90 N 2.25 4.11 0.36 0.00 0.04 -1.24 -1.64 135.00 138.88 1y4o s PRO 90 Ca 0.16 0.37 0.08 0.00 0.04 0.00 0.00 61.00 61.65 1y4o s PRO 90 Cb -0.16 -3.63 -0.07 0.00 0.04 0.00 0.00 34.50 30.68 1y4o s PRO 90 CO 0.13 -0.31 -0.04 0.34 0.04 0.00 0.00 177.00 177.17 1y4o s ASP 91 N 1.43 3.56 0.36 6.66 2.15 0.29 -4.64 116.67 126.48 1y4o s ASP 91 Ca 0.23 -1.28 0.07 0.00 0.43 0.00 0.00 52.55 52.00 1y4o s ASP 91 Cb -0.16 -0.33 0.68 0.00 -0.30 0.00 0.00 42.92 42.82 1y4o s ASP 91 CO 0.09 -0.35 1.88 0.11 -0.17 0.00 0.00 175.17 176.73 1y4o h LYS 92 N 1.96 0.34 0.00 4.34 1.57 -1.97 -3.29 116.57 119.52 1y4o h LYS 92 Ca -0.42 -0.08 -0.10 0.00 -1.87 0.00 0.00 60.65 58.17 1y4o h LYS 92 Cb 1.24 -0.04 -0.02 0.00 0.08 0.00 0.00 32.23 33.49 1y4o h LYS 92 CO 0.74 0.47 -1.67 -0.25 -0.57 0.00 0.00 179.45 178.16 1y4o n ASP 93 N -4.25 2.17 -4.16 0.86 8.00 -1.26 -4.72 116.55 113.19 1y4o n ASP 93 Ca -0.00 0.00 -0.11 0.00 0.71 0.00 0.00 54.79 55.39 1y4o n ASP 93 Cb 0.28 1.19 -0.10 0.00 -0.02 0.00 0.00 41.12 42.47 1y4o n ASP 93 CO 0.00 0.00 0.00 -0.31 -0.39 0.00 0.00 177.20 176.50 1y4o s TYR 94 N -2.58 0.89 -0.22 1.24 1.51 -1.24 -1.82 117.35 115.12 1y4o s TYR 94 Ca -0.05 -0.84 0.02 0.00 -1.01 0.00 0.00 57.07 55.19 1y4o s TYR 94 Cb 0.06 -0.51 0.05 0.00 -0.11 0.00 0.00 41.96 41.45 1y4o s TYR 94 CO 0.49 -0.12 -0.10 -0.06 -1.11 0.00 0.00 175.55 174.65 1y4o s PHE 95 N -3.24 2.72 -0.75 2.71 0.08 -0.17 -0.55 117.98 118.77 1y4o s PHE 95 Ca 0.09 -1.87 -0.18 0.00 0.12 0.00 0.00 56.93 55.09 1y4o s PHE 95 Cb 0.03 -1.74 0.14 0.00 -0.57 0.00 0.00 43.02 40.87 1y4o s PHE 95 CO -0.04 -0.80 0.86 -0.51 -0.10 0.00 0.00 175.22 174.63 1y4o s LEU 96 N 1.29 5.55 -0.19 -0.37 1.43 -0.65 -2.91 118.68 122.84 1y4o s LEU 96 Ca -0.04 -1.88 -0.02 0.00 -1.03 0.00 0.00 54.13 51.16 1y4o s LEU 96 Cb -0.18 -2.32 -0.00 0.00 0.03 0.00 0.00 46.19 43.72 1y4o s LEU 96 CO -0.07 -0.99 -0.10 -0.63 0.23 0.00 0.00 176.35 174.78 1y4o s ILE 97 N 2.18 2.98 0.05 -0.59 1.01 -1.00 -0.61 121.20 125.23 1y4o s ILE 97 Ca 0.20 -0.64 0.03 0.00 0.00 0.00 0.00 60.65 60.24 1y4o s ILE 97 Cb -0.15 -2.31 -0.03 0.00 0.01 0.00 0.00 42.46 39.98 1y4o s ILE 97 CO -0.02 0.48 -0.10 0.68 0.00 0.00 0.00 174.94 175.98 1y4o s VAL 98 N 1.14 0.72 -0.26 2.92 -7.23 0.08 0.18 120.40 117.96 1y4o s VAL 98 Ca 0.01 -1.19 -0.02 0.00 -1.81 0.00 0.00 61.98 58.97 1y4o s VAL 98 Cb -0.14 -0.80 0.03 0.00 0.56 0.00 0.00 36.38 36.02 1y4o s VAL 98 CO -0.03 -0.36 -0.04 -0.63 -0.31 0.00 0.00 175.10 173.73 1y4o s ILE 99 N -1.46 2.97 0.42 -0.62 1.01 0.64 -0.89 121.20 123.29 1y4o s ILE 99 Ca -0.06 -1.05 0.07 0.00 0.00 0.00 0.00 60.65 59.60 1y4o s ILE 99 Cb -0.09 -2.54 -0.06 0.00 0.01 0.00 0.00 42.46 39.77 1y4o s ILE 99 CO 0.01 0.14 0.08 -1.58 0.00 0.00 0.00 174.94 173.59 1y4o s GLN 100 N 1.33 2.09 0.49 2.79 0.74 -0.90 0.64 119.66 126.83 1y4o s GLN 100 Ca -0.00 -2.04 -0.08 0.00 0.05 0.00 0.00 55.36 53.29 1y4o s GLN 100 Cb -0.17 -1.77 -0.05 0.00 1.10 0.00 0.00 33.01 32.13 1y4o s GLN 100 CO -0.03 -0.12 0.83 0.54 -0.55 0.00 0.00 175.29 175.96 1y4o s ASN 101 N -3.81 6.34 -0.52 6.67 2.20 -0.12 0.07 114.94 125.76 1y4o s ASN 101 Ca 0.34 1.09 -0.26 0.00 -0.94 0.00 0.00 52.86 53.09 1y4o s ASN 101 Cb 0.07 -2.32 -0.04 0.00 -2.00 0.00 0.00 41.25 36.96 1y4o s ASN 101 CO 0.18 -0.58 2.11 -2.16 -2.94 0.00 0.00 177.10 173.71 1y4o s PRO 102 N -4.55 2.47 0.16 3.55 0.04 -1.26 -4.76 135.00 130.65 1y4o s PRO 102 Ca 0.50 1.08 -0.10 0.00 0.04 0.00 0.00 61.00 62.52 1y4o s PRO 102 Cb -0.10 -4.46 -0.07 0.00 0.04 0.00 0.00 34.50 29.91 1y4o s PRO 102 CO 0.42 -2.88 0.49 0.99 0.04 0.00 0.00 177.00 176.06 1y4o s THR 103 N 10.24 4.98 0.00 1.26 2.01 -1.26 -5.15 115.64 127.72 1y4o s THR 103 Ca 0.83 0.51 0.00 0.00 0.31 0.00 0.00 61.69 63.34 1y4o s THR 103 Cb -0.16 -3.66 0.00 0.00 0.01 0.00 0.00 72.50 68.69 1y4o s THR 103 CO 0.25 0.12 0.00 -0.62 -0.69 0.00 0.00 174.62 173.67