#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1rhy s GLU 3 N 0.00 3.93 -0.87 -1.46 2.02 -1.26 -5.01 118.70 116.05 1rhy s GLU 3 Ca 0.00 1.10 -0.05 0.00 0.02 0.00 0.00 54.97 56.05 1rhy s GLU 3 Cb 0.00 -2.13 0.22 0.00 0.10 0.00 0.00 34.13 32.32 1rhy s GLU 3 CO 0.00 -0.29 0.76 1.03 0.02 0.00 0.00 175.26 176.78 1rhy s ARG 4 N -3.66 3.33 0.21 1.61 0.52 -1.26 -5.03 118.95 114.67 1rhy s ARG 4 Ca 0.62 -3.01 0.10 0.00 -0.52 0.00 0.00 55.73 52.92 1rhy s ARG 4 Cb -0.11 -4.07 -0.05 0.00 0.52 0.00 0.00 34.95 31.24 1rhy s ARG 4 CO 0.24 -1.24 -0.19 -1.50 0.02 0.00 0.00 175.30 172.63 1rhy s ILE 5 N -0.87 2.07 -0.25 1.52 2.07 -1.26 -1.36 121.20 123.12 1rhy s ILE 5 Ca 0.25 -2.16 -0.26 0.00 -1.41 0.00 0.00 60.65 57.06 1rhy s ILE 5 Cb -0.11 -2.07 0.12 0.00 0.13 0.00 0.00 42.46 40.53 1rhy s ILE 5 CO -0.09 -0.39 1.01 0.00 -1.91 0.00 0.00 174.94 173.56 1rhy s ALA 6 N -2.38 -1.96 0.02 1.50 0.00 -0.69 -4.50 121.76 113.76 1rhy s ALA 6 Ca 0.23 1.80 0.08 0.00 0.00 0.00 0.00 51.96 54.06 1rhy s ALA 6 Cb -0.04 -1.24 -0.02 0.00 0.00 0.00 0.00 23.12 21.81 1rhy s ALA 6 CO 0.10 -0.26 -0.23 -1.12 0.00 0.00 0.00 175.76 174.25 1rhy s SER 7 N -0.10 2.70 0.02 0.00 0.01 -1.26 -1.46 113.70 113.61 1rhy s SER 7 Ca 0.02 -0.50 -0.11 0.00 1.31 0.00 0.00 55.95 56.66 1rhy s SER 7 Cb -0.04 -0.26 0.01 0.00 0.21 0.00 0.00 66.02 65.95 1rhy s SER 7 CO -0.04 0.23 0.24 0.68 0.41 0.00 0.00 173.24 174.75 1rhy s VAL 8 N -0.71 0.08 -0.06 3.43 -7.23 0.40 -4.99 120.40 111.33 1rhy s VAL 8 Ca 0.09 -0.70 0.04 0.00 -1.81 0.00 0.00 61.98 59.60 1rhy s VAL 8 Cb -0.09 -0.74 0.00 0.00 0.56 0.00 0.00 36.38 36.11 1rhy s VAL 8 CO 0.01 -0.38 -0.17 -1.61 -0.31 0.00 0.00 175.10 172.64 1rhy s GLU 9 N -1.99 1.92 -0.07 4.82 2.02 -1.26 -0.04 118.70 124.10 1rhy s GLU 9 Ca -0.09 -0.59 0.06 0.00 0.02 0.00 0.00 54.97 54.37 1rhy s GLU 9 Cb -0.03 -1.60 -0.01 0.00 0.10 0.00 0.00 34.13 32.58 1rhy s GLU 9 CO -0.00 0.17 -0.24 0.50 0.02 0.00 0.00 175.26 175.71 1rhy s ARG 10 N 0.25 2.65 -1.47 1.61 3.52 0.80 -4.29 118.95 122.02 1rhy s ARG 10 Ca -0.09 -0.89 -0.12 0.00 -0.13 0.00 0.00 55.73 54.51 1rhy s ARG 10 Cb -0.14 -2.21 0.08 0.00 -1.56 0.00 0.00 34.95 31.12 1rhy s ARG 10 CO 0.03 0.36 0.78 0.25 -0.81 0.00 0.00 175.30 175.91 1rhy n THR 11 N 3.02 -1.64 -0.35 4.11 -2.24 -1.26 -2.79 114.28 113.14 1rhy n THR 11 Ca -0.18 0.00 0.25 0.00 -2.27 0.00 0.00 64.05 61.86 1rhy n THR 11 Cb 0.52 -2.54 0.50 0.00 -2.10 0.00 0.00 70.33 66.71 1rhy n THR 11 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1rhy h THR 12 N -1.62 0.30 -0.78 4.28 1.03 -1.86 -3.27 112.91 110.98 1rhy h THR 12 Ca -0.53 -0.10 0.15 0.00 -0.01 0.00 0.00 66.41 65.92 1rhy h THR 12 Cb 1.35 -0.03 -0.15 0.00 -1.07 0.00 0.00 68.15 68.25 1rhy h THR 12 CO 0.62 0.06 -0.21 -1.28 -0.01 0.00 0.00 175.52 174.70 1rhy h SER 13 N 0.30 -0.78 -3.11 0.00 0.87 -1.94 0.56 113.55 109.46 1rhy h SER 13 Ca 0.73 0.24 -0.75 0.00 -1.23 0.00 0.00 61.79 60.78 1rhy h SER 13 Cb 1.76 0.50 -0.32 0.00 -0.44 0.00 0.00 62.40 63.90 1rhy h SER 13 CO -0.56 -0.26 0.25 -1.84 -0.53 0.00 0.00 176.83 173.89 1rhy n GLU 14 N -5.51 3.42 -1.16 2.24 -0.00 -1.23 -4.98 120.64 113.43 1rhy n GLU 14 Ca 0.11 -4.52 -0.24 0.00 -0.00 0.00 0.00 57.16 52.50 1rhy n GLU 14 Cb 0.40 -2.46 -0.15 0.00 -0.00 0.00 0.00 31.44 29.23 1rhy n GLU 14 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 177.13 179.54 1rhy n THR 15 N 1.90 0.00 0.16 3.84 -1.04 0.20 -4.64 114.28 114.70 1rhy n THR 15 Ca 0.25 -0.20 -0.08 0.00 -2.04 0.00 0.00 64.05 61.98 1rhy n THR 15 Cb 0.37 -0.19 -0.04 0.00 -1.82 0.00 0.00 70.33 68.65 1rhy n THR 15 CO 0.00 0.00 0.00 -0.74 -0.64 0.00 0.00 175.07 173.69 1rhy h HIS 16 N 8.85 -0.46 -3.54 -1.42 2.76 -1.67 -3.42 115.15 116.25 1rhy h HIS 16 Ca -0.00 -0.01 -0.48 0.00 -2.20 0.00 0.00 60.37 57.67 1rhy h HIS 16 Cb 0.94 0.15 -0.33 0.00 1.55 0.00 0.00 27.41 29.72 1rhy h HIS 16 CO 0.96 -0.28 -0.80 0.42 -1.30 0.00 0.00 177.93 176.92 1rhy s ILE 17 N -3.15 0.99 -0.02 6.26 1.01 -1.12 0.11 121.20 125.28 1rhy s ILE 17 Ca -0.07 -0.41 0.07 0.00 0.00 0.00 0.00 60.65 60.23 1rhy s ILE 17 Cb 0.01 -0.91 -0.02 0.00 0.01 0.00 0.00 42.46 41.56 1rhy s ILE 17 CO 0.22 0.32 -0.23 -0.55 0.00 0.00 0.00 174.94 174.69 1rhy s SER 18 N 0.57 2.72 -0.07 3.58 0.15 -0.51 -0.14 113.70 120.01 1rhy s SER 18 Ca -0.11 -0.42 -0.05 0.00 0.70 0.00 0.00 55.95 56.06 1rhy s SER 18 Cb -0.14 -0.38 0.02 0.00 -1.71 0.00 0.00 66.02 63.82 1rhy s SER 18 CO 0.02 0.27 0.17 0.00 1.20 0.00 0.00 173.24 174.91 1rhy s THR 20 N 0.44 0.52 0.01 0.00 2.01 0.15 -0.46 115.64 118.31 1rhy s THR 20 Ca -0.03 -0.22 -0.00 0.00 0.31 0.00 0.00 61.69 61.75 1rhy s THR 20 Cb -0.04 -0.48 -0.01 0.00 0.01 0.00 0.00 72.50 71.98 1rhy s THR 20 CO -0.02 0.17 -0.01 -0.51 -0.69 0.00 0.00 174.62 173.57 1rhy s ILE 21 N 0.24 0.04 -0.10 1.82 2.07 -0.54 0.68 121.20 125.41 1rhy s ILE 21 Ca -0.03 -0.33 0.01 0.00 -1.41 0.00 0.00 60.65 58.90 1rhy s ILE 21 Cb -0.07 -0.10 0.02 0.00 0.13 0.00 0.00 42.46 42.43 1rhy s ILE 21 CO -0.00 -0.18 -0.13 -0.62 -1.91 0.00 0.00 174.94 172.10 1rhy s ASP 22 N -0.53 2.23 0.00 4.50 -1.08 -0.05 -1.70 116.67 120.04 1rhy s ASP 22 Ca -0.06 -0.37 0.28 0.00 -0.52 0.00 0.00 52.55 51.88 1rhy s ASP 22 Cb -0.04 -0.98 1.11 0.00 -1.46 0.00 0.00 42.92 41.55 1rhy s ASP 22 CO -0.00 -0.01 1.81 0.18 0.52 0.00 0.00 175.17 177.67 1rhy n LEU 23 N 4.24 0.27 -4.16 -1.34 4.77 -0.47 -0.51 117.00 119.81 1rhy n LEU 23 Ca -0.19 0.20 -0.30 0.00 -0.03 0.00 0.00 56.01 55.69 1rhy n LEU 23 Cb 0.51 -0.32 -0.17 0.00 -2.33 0.00 0.00 43.42 41.12 1rhy n LEU 23 CO 0.23 0.06 -0.53 -1.81 -1.33 0.00 0.00 177.39 174.00 1rhy s ASP 24 N -2.78 2.75 -0.15 -1.43 1.01 -1.26 -4.69 116.67 110.12 1rhy s ASP 24 Ca 0.20 -0.49 0.01 0.00 0.71 0.00 0.00 52.55 52.98 1rhy s ASP 24 Cb 0.19 -1.26 0.02 0.00 1.01 0.00 0.00 42.92 42.88 1rhy s ASP 24 CO 0.54 0.12 -0.18 -2.28 0.21 0.00 0.00 175.17 173.58 1rhy s HIS 25 N 0.48 2.47 -0.68 4.23 5.65 -1.21 -4.83 115.29 121.39 1rhy s HIS 25 Ca -0.17 -1.37 0.05 0.00 0.25 0.00 0.00 55.06 53.82 1rhy s HIS 25 Cb -0.17 -1.74 0.17 0.00 -1.18 0.00 0.00 32.58 29.66 1rhy s HIS 25 CO 0.07 -0.69 0.48 -1.50 -0.65 0.00 0.00 174.74 172.44 1rhy s ILE 26 N 1.24 2.78 0.17 0.89 1.10 -1.26 -5.06 121.20 121.05 1rhy s ILE 26 Ca 0.02 -4.17 -0.32 0.00 -0.51 0.00 0.00 60.65 55.67 1rhy s ILE 26 Cb -0.14 -2.83 -0.16 0.00 0.15 0.00 0.00 42.46 39.48 1rhy s ILE 26 CO -0.09 -1.00 0.97 -0.81 -2.11 0.00 0.00 174.94 171.90 1rhy n PRO 27 N 2.06 0.75 0.00 3.50 -0.04 -1.26 -4.98 135.00 135.03 1rhy n PRO 27 Ca 0.19 0.26 0.00 0.00 -0.04 0.00 0.00 63.50 63.92 1rhy n PRO 27 Cb 0.35 -1.62 0.00 0.00 -0.04 0.00 0.00 33.50 32.19 1rhy n PRO 27 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 1rhy n GLY 28 N 1.82 2.35 0.12 0.55 0.00 -1.26 -5.02 105.19 103.74 1rhy n GLY 28 Ca 0.16 0.20 0.12 0.00 0.00 0.00 0.00 46.02 46.49 1rhy n GLY 28 CO 0.00 0.00 0.00 -0.24 0.00 0.00 0.00 173.32 173.08 1rhy h VAL 29 N 0.00 0.00 -3.10 1.61 3.04 -2.08 -3.47 116.25 112.24 1rhy h VAL 29 Ca 0.00 -0.93 -0.05 0.00 -1.01 0.00 0.00 66.70 64.71 1rhy h VAL 29 Cb 0.00 1.48 0.01 0.00 -2.01 0.00 0.00 31.29 30.77 1rhy h VAL 29 CO 0.00 0.00 0.02 0.35 -1.01 0.00 0.00 177.57 176.93 1rhy n THR 30 N -2.63 0.00 -3.88 3.17 -2.24 -1.26 -5.12 114.28 102.31 1rhy n THR 30 Ca 0.01 -0.15 -0.11 0.00 -2.27 0.00 0.00 64.05 61.52 1rhy n THR 30 Cb 0.53 -1.51 -0.11 0.00 -2.10 0.00 0.00 70.33 67.14 1rhy n THR 30 CO 0.00 0.00 0.00 -1.83 -0.57 0.00 0.00 175.07 172.67 1rhy s GLU 31 N -2.87 0.38 0.27 -0.78 -1.05 -1.26 -5.04 118.70 108.34 1rhy s GLU 31 Ca 0.08 -0.30 -0.31 0.00 -0.15 0.00 0.00 54.97 54.29 1rhy s GLU 31 Cb -0.00 0.16 -0.13 0.00 -0.44 0.00 0.00 34.13 33.72 1rhy s GLU 31 CO 0.05 -0.08 1.48 1.04 0.95 0.00 0.00 175.26 178.70 1rhy n GLN 32 N 1.84 2.32 -2.71 -4.83 6.02 -1.26 -4.91 117.38 113.84 1rhy n GLN 32 Ca -0.21 0.82 -0.43 0.00 -0.01 0.00 0.00 57.00 57.18 1rhy n GLN 32 Cb 0.56 -2.53 -0.03 0.00 1.02 0.00 0.00 30.24 29.27 1rhy n GLN 32 CO 0.00 0.00 0.00 0.21 -1.01 0.00 0.00 177.06 176.26 1rhy s LYS 33 N -0.52 4.30 -0.22 -1.09 2.20 -1.26 -4.97 119.74 118.18 1rhy s LYS 33 Ca 0.66 1.29 -0.03 0.00 -0.36 0.00 0.00 55.97 57.53 1rhy s LYS 33 Cb -0.58 -3.61 0.07 0.00 -1.51 0.00 0.00 37.83 32.21 1rhy s LYS 33 CO 0.50 -0.50 0.07 0.42 -0.36 0.00 0.00 175.35 175.48 1rhy s ILE 34 N 2.71 0.37 -0.20 5.43 1.01 -1.26 -1.72 121.20 127.54 1rhy s ILE 34 Ca 0.44 -0.65 -0.01 0.00 0.00 0.00 0.00 60.65 60.42 1rhy s ILE 34 Cb -0.16 -1.04 0.05 0.00 0.01 0.00 0.00 42.46 41.32 1rhy s ILE 34 CO 0.10 -0.38 -0.02 0.20 0.00 0.00 0.00 174.94 174.84 1rhy s ASN 35 N 1.91 3.15 -0.07 3.58 0.01 -0.30 -4.99 114.94 118.23 1rhy s ASN 35 Ca 0.03 -0.87 0.04 0.00 -0.71 0.00 0.00 52.86 51.35 1rhy s ASN 35 Cb -0.17 -0.86 0.00 0.00 0.41 0.00 0.00 41.25 40.63 1rhy s ASN 35 CO -0.16 -0.25 -0.20 -0.69 -1.51 0.00 0.00 177.10 174.30 1rhy s VAL 36 N 1.65 1.70 -0.31 1.60 1.01 -1.26 -0.90 120.40 123.89 1rhy s VAL 36 Ca -0.02 -0.83 -0.01 0.00 0.00 0.00 0.00 61.98 61.11 1rhy s VAL 36 Cb -0.17 -1.48 0.12 0.00 0.00 0.00 0.00 36.38 34.86 1rhy s VAL 36 CO -0.07 0.48 0.22 -0.55 0.00 0.00 0.00 175.10 175.18 1rhy s SER 37 N 0.26 2.63 -0.07 3.32 0.15 0.79 -4.88 113.70 115.90 1rhy s SER 37 Ca -0.12 -1.38 0.19 0.00 0.70 0.00 0.00 55.95 55.34 1rhy s SER 37 Cb -0.15 -0.02 -0.25 0.00 -1.71 0.00 0.00 66.02 63.89 1rhy s SER 37 CO 0.05 -0.38 0.41 0.35 1.20 0.00 0.00 173.24 174.88 1rhy n THR 38 N 4.88 0.84 0.00 6.45 -2.24 -1.26 -0.22 114.28 122.73 1rhy n THR 38 Ca 0.01 -0.69 0.00 0.00 -2.27 0.00 0.00 64.05 61.10 1rhy n THR 38 Cb 0.42 -0.36 0.00 0.00 -2.10 0.00 0.00 70.33 68.29 1rhy n THR 38 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1rhy n GLY 39 N 1.48 0.70 2.83 3.38 0.00 -1.26 -4.78 105.19 107.54 1rhy n GLY 39 Ca -0.17 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.58 1rhy n GLY 39 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1rhy s ILE 40 N -2.00 0.87 0.21 -0.61 1.01 -1.26 -5.04 121.20 114.38 1rhy s ILE 40 Ca 0.00 -0.54 -0.10 0.00 0.00 0.00 0.00 60.65 60.01 1rhy s ILE 40 Cb 0.00 -1.14 0.16 0.00 0.01 0.00 0.00 42.46 41.49 1rhy s ILE 40 CO 0.00 0.04 1.87 1.23 0.00 0.00 0.00 174.94 178.08 1rhy h GLY 41 N 8.17 1.09 0.92 6.18 0.00 -1.96 -2.34 103.07 115.14 1rhy h GLY 41 Ca -0.21 -0.43 0.02 0.00 0.00 0.00 0.00 47.33 46.71 1rhy h GLY 41 CO 0.36 0.42 0.42 -2.75 0.00 0.00 0.00 176.54 174.99 1rhy h PHE 42 N 1.04 0.79 -0.54 5.60 3.57 -1.96 -0.74 116.94 124.70 1rhy h PHE 42 Ca 0.28 0.02 -0.06 0.00 3.53 0.00 0.00 57.97 61.74 1rhy h PHE 42 Cb -0.08 -0.26 -0.02 0.00 2.79 0.00 0.00 35.95 38.37 1rhy h PHE 42 CO -0.01 0.47 0.11 1.25 -2.23 0.00 0.00 178.31 177.89 1rhy h LEU 43 N 0.83 0.79 -1.53 0.59 5.85 -1.88 -0.70 115.31 119.28 1rhy h LEU 43 Ca 0.26 -0.15 -0.04 0.00 0.84 0.00 0.00 57.88 58.78 1rhy h LEU 43 Cb -0.02 -0.21 -0.01 0.00 0.37 0.00 0.00 40.66 40.79 1rhy h LEU 43 CO -0.09 0.79 -0.10 0.44 -0.34 0.00 0.00 178.44 179.15 1rhy h ASP 44 N 0.81 0.17 0.06 1.25 3.32 -0.79 0.93 116.42 122.17 1rhy h ASP 44 Ca 0.17 -0.03 -0.00 0.00 0.02 0.00 0.00 57.03 57.19 1rhy h ASP 44 Cb 0.33 -0.04 0.00 0.00 0.22 0.00 0.00 39.33 39.84 1rhy h ASP 44 CO 0.00 0.30 -0.03 -0.74 -1.72 0.00 0.00 179.24 177.05 1rhy h HIS 45 N 0.18 -0.08 -0.23 4.55 2.76 0.17 -1.26 115.15 121.23 1rhy h HIS 45 Ca 0.04 -0.00 -0.00 0.00 -2.20 0.00 0.00 60.37 58.21 1rhy h HIS 45 Cb 0.29 0.03 -0.01 0.00 1.55 0.00 0.00 27.41 29.27 1rhy h HIS 45 CO 0.00 0.23 0.15 0.52 -1.30 0.00 0.00 177.93 177.53 1rhy h MET 46 N -0.39 0.32 -0.09 5.26 2.86 -0.43 -0.20 114.93 122.26 1rhy h MET 46 Ca -0.01 -0.03 -0.09 0.00 -2.06 0.00 0.00 59.70 57.52 1rhy h MET 46 Cb 0.34 -0.07 -0.01 0.00 0.06 0.00 0.00 31.60 31.92 1rhy h MET 46 CO 0.01 0.24 -0.33 0.74 1.06 0.00 0.00 176.91 178.63 1rhy h PHE 47 N 0.30 0.19 -0.20 -0.22 0.05 -0.88 0.85 116.94 117.03 1rhy h PHE 47 Ca 0.08 -0.04 -0.11 0.00 3.82 0.00 0.00 57.97 61.72 1rhy h PHE 47 Cb 0.01 -0.05 -0.00 0.00 2.00 0.00 0.00 35.95 37.91 1rhy h PHE 47 CO -0.05 0.49 -0.30 1.15 -0.18 0.00 0.00 178.31 179.42 1rhy h THR 48 N 0.15 1.33 -0.82 -1.55 2.02 -0.94 -1.20 112.91 111.91 1rhy h THR 48 Ca 0.02 -1.52 0.03 0.00 0.77 0.00 0.00 66.41 65.71 1rhy h THR 48 Cb 0.67 1.84 -0.05 0.00 -1.74 0.00 0.00 68.15 68.87 1rhy h THR 48 CO 0.05 0.46 0.53 0.00 0.37 0.00 0.00 175.52 176.93 1rhy h ALA 49 N 0.61 1.07 0.09 6.16 0.00 -0.64 0.48 119.26 127.03 1rhy h ALA 49 Ca 0.02 -0.04 0.01 0.00 0.00 0.00 0.00 54.91 54.90 1rhy h ALA 49 Cb 0.88 -0.29 -0.02 0.00 0.00 0.00 0.00 17.79 18.36 1rhy h ALA 49 CO 0.07 0.38 -0.14 1.25 0.00 0.00 0.00 179.25 180.80 1rhy h LEU 50 N 1.05 -0.39 -0.46 0.00 5.85 -0.59 -0.28 115.31 120.49 1rhy h LEU 50 Ca 0.32 0.05 -0.07 0.00 0.84 0.00 0.00 57.88 59.02 1rhy h LEU 50 Cb -0.03 0.15 -0.02 0.00 0.37 0.00 0.00 40.66 41.14 1rhy h LEU 50 CO -0.10 -0.21 0.02 0.00 -0.34 0.00 0.00 178.44 177.80 1rhy h ALA 51 N 0.58 0.61 0.82 1.25 0.00 -0.94 0.05 119.26 121.64 1rhy h ALA 51 Ca 0.02 -0.26 -0.04 0.00 0.00 0.00 0.00 54.91 54.63 1rhy h ALA 51 Cb 0.30 -0.17 0.00 0.00 0.00 0.00 0.00 17.79 17.92 1rhy h ALA 51 CO -0.08 0.39 -0.43 -0.22 0.00 0.00 0.00 179.25 178.92 1rhy h LYS 52 N 0.64 -1.10 0.00 0.00 1.63 -0.71 -0.61 116.57 116.42 1rhy h LYS 52 Ca 0.13 0.08 0.00 0.00 -0.85 0.00 0.00 60.65 60.01 1rhy h LYS 52 Cb 0.48 0.25 0.00 0.00 -0.60 0.00 0.00 32.23 32.36 1rhy h LYS 52 CO 0.02 -0.73 0.00 0.72 -3.45 0.00 0.00 179.45 176.01 1rhy n HIS 53 N -5.59 0.00 1.27 1.91 8.25 -0.13 -2.40 115.22 118.53 1rhy n HIS 53 Ca -0.15 0.00 0.13 0.00 -0.26 0.00 0.00 57.72 57.44 1rhy n HIS 53 Cb 0.46 -0.43 0.37 0.00 1.12 0.00 0.00 29.99 31.51 1rhy n HIS 53 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1rhy n GLY 54 N 0.73 -0.35 2.67 -1.41 0.00 0.00 -4.19 105.19 102.65 1rhy n GLY 54 Ca 0.07 -0.45 -0.14 0.00 0.00 0.00 0.00 46.02 45.50 1rhy n GLY 54 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1rhy n GLY 55 N 1.31 -0.02 3.42 -0.02 0.00 -0.85 -4.37 105.19 104.65 1rhy n GLY 55 Ca 0.14 -0.15 -0.21 0.00 0.00 0.00 0.00 46.02 45.79 1rhy n GLY 55 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 1rhy s MET 56 N -5.54 1.52 -0.13 1.61 -1.94 -0.29 -3.33 119.30 111.20 1rhy s MET 56 Ca 0.28 -1.73 -0.04 0.00 -1.71 0.00 0.00 55.69 52.49 1rhy s MET 56 Cb -0.12 -1.31 -0.03 0.00 2.01 0.00 0.00 34.83 35.37 1rhy s MET 56 CO 0.35 0.16 0.01 -1.12 -0.01 0.00 0.00 175.02 174.40 1rhy s SER 57 N -3.43 5.24 -0.03 3.03 0.01 0.34 -4.44 113.70 114.42 1rhy s SER 57 Ca 0.27 0.06 0.00 0.00 1.31 0.00 0.00 55.95 57.59 1rhy s SER 57 Cb 0.00 -1.71 0.03 0.00 0.21 0.00 0.00 66.02 64.55 1rhy s SER 57 CO 0.11 0.27 0.01 -0.22 0.41 0.00 0.00 173.24 173.81 1rhy s LEU 58 N -0.20 1.06 -0.24 2.44 2.96 -0.70 -0.87 118.68 123.13 1rhy s LEU 58 Ca 0.06 -0.02 0.02 0.00 -0.22 0.00 0.00 54.13 53.97 1rhy s LEU 58 Cb -0.12 -0.21 0.05 0.00 0.50 0.00 0.00 46.19 46.40 1rhy s LEU 58 CO 0.02 -0.12 -0.12 -1.58 -1.32 0.00 0.00 176.35 173.23 1rhy s GLN 59 N 1.15 2.29 -0.11 1.98 2.00 0.21 -1.15 119.66 126.03 1rhy s GLN 59 Ca -0.08 -1.18 -0.03 0.00 -2.00 0.00 0.00 55.36 52.07 1rhy s GLN 59 Cb -0.13 -2.76 0.04 0.00 0.80 0.00 0.00 33.01 30.96 1rhy s GLN 59 CO -0.02 -0.50 0.05 -1.17 -0.50 0.00 0.00 175.29 173.16 1rhy s LEU 60 N 1.19 0.44 -0.11 3.68 0.20 -0.08 0.35 118.68 124.34 1rhy s LEU 60 Ca -0.06 -0.30 0.00 0.00 0.69 0.00 0.00 54.13 54.46 1rhy s LEU 60 Cb -0.18 -0.30 0.02 0.00 -0.43 0.00 0.00 46.19 45.30 1rhy s LEU 60 CO -0.07 -0.28 -0.09 -1.10 -0.29 0.00 0.00 176.35 174.52 1rhy s GLN 61 N 2.08 1.65 -0.18 1.98 1.11 -0.36 -0.15 119.66 125.79 1rhy s GLN 61 Ca 0.03 -0.32 -0.00 0.00 0.01 0.00 0.00 55.36 55.08 1rhy s GLN 61 Cb -0.14 -1.62 0.01 0.00 -1.01 0.00 0.00 33.01 30.25 1rhy s GLN 61 CO -0.06 -0.21 -0.15 0.00 0.01 0.00 0.00 175.29 174.88 1rhy s LYS 63 N 1.13 3.04 0.00 0.00 1.02 0.31 -4.66 119.74 120.58 1rhy s LYS 63 Ca 0.01 -0.46 0.00 0.00 0.02 0.00 0.00 55.97 55.54 1rhy s LYS 63 Cb -0.14 -2.76 0.00 0.00 -0.52 0.00 0.00 37.83 34.40 1rhy s LYS 63 CO -0.05 0.62 0.00 0.41 -0.92 0.00 0.00 175.35 175.41 1rhy n GLY 64 N 2.39 -0.60 2.51 -3.33 0.00 -1.26 -4.66 105.19 100.24 1rhy n GLY 64 Ca -0.18 -0.64 -0.06 0.00 0.00 0.00 0.00 46.02 45.15 1rhy n GLY 64 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1rhy n ASP 65 N 0.00 -6.51 0.00 1.61 8.00 -1.26 -5.18 116.55 113.21 1rhy n ASP 65 Ca 0.00 0.45 0.00 0.00 0.71 0.00 0.00 54.79 55.95 1rhy n ASP 65 Cb 0.00 -4.33 0.00 0.00 -0.02 0.00 0.00 41.12 36.77 1rhy n ASP 65 CO 0.00 0.00 0.00 0.35 -0.39 0.00 0.00 177.20 177.16 1rhy n THR 73 N -0.30 0.00 0.32 -3.53 -2.24 -1.26 -5.31 114.28 101.97 1rhy n THR 73 Ca 0.09 0.00 0.20 0.00 -2.27 0.00 0.00 64.05 62.07 1rhy n THR 73 Cb 0.33 -0.36 1.10 0.00 -2.10 0.00 0.00 70.33 69.29 1rhy n THR 73 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1rhy h ALA 74 N -0.45 1.19 -0.91 6.98 0.00 -2.00 -2.39 119.26 121.68 1rhy h ALA 74 Ca 0.00 -0.00 0.20 0.00 0.00 0.00 0.00 54.91 55.11 1rhy h ALA 74 Cb 0.00 0.00 -0.07 0.00 0.00 0.00 0.00 17.79 17.72 1rhy h ALA 74 CO 0.00 -0.07 0.60 0.93 0.00 0.00 0.00 179.25 180.70 1rhy h GLU 75 N 0.00 0.45 -0.61 0.00 5.08 -1.95 0.87 114.58 118.42 1rhy h GLU 75 Ca 0.01 -0.03 -0.01 0.00 -1.00 0.00 0.00 59.36 58.33 1rhy h GLU 75 Cb 0.13 -0.10 -0.03 0.00 0.50 0.00 0.00 28.75 29.25 1rhy h GLU 75 CO -0.00 0.30 0.36 -0.44 -1.00 0.00 0.00 179.01 178.23 1rhy h ASP 76 N 0.47 0.73 -0.38 1.42 5.19 -1.86 0.18 116.42 122.16 1rhy h ASP 76 Ca 0.48 -0.04 -0.10 0.00 -0.62 0.00 0.00 57.03 56.75 1rhy h ASP 76 Cb 1.10 -0.18 -0.01 0.00 0.18 0.00 0.00 39.33 40.41 1rhy h ASP 76 CO -0.20 0.57 -0.15 0.00 -3.12 0.00 0.00 179.24 176.34 1rhy h ALA 78 N 0.82 0.75 -0.53 0.00 0.00 -1.05 0.51 119.26 119.75 1rhy h ALA 78 Ca 0.09 -0.07 -0.01 0.00 0.00 0.00 0.00 54.91 54.92 1rhy h ALA 78 Cb 0.69 -0.24 -0.03 0.00 0.00 0.00 0.00 17.79 18.22 1rhy h ALA 78 CO 0.05 0.23 0.31 -0.07 0.00 0.00 0.00 179.25 179.77 1rhy h LEU 79 N 0.80 0.65 -0.19 0.00 3.38 -0.52 0.49 115.31 119.92 1rhy h LEU 79 Ca 0.21 -0.07 0.00 0.00 0.09 0.00 0.00 57.88 58.11 1rhy h LEU 79 Cb -0.02 -0.16 -0.01 0.00 0.09 0.00 0.00 40.66 40.55 1rhy h LEU 79 CO -0.04 0.53 0.13 0.00 0.09 0.00 0.00 178.44 179.15 1rhy h ALA 80 N 1.14 0.24 -0.45 1.53 0.00 -0.83 0.80 119.26 121.70 1rhy h ALA 80 Ca 0.19 -0.01 0.06 0.00 0.00 0.00 0.00 54.91 55.15 1rhy h ALA 80 Cb 0.02 -0.08 -0.05 0.00 0.00 0.00 0.00 17.79 17.67 1rhy h ALA 80 CO -0.03 -0.28 0.13 1.25 0.00 0.00 0.00 179.25 180.32 1rhy h LEU 81 N 0.26 0.11 -0.72 0.00 5.85 -0.39 -0.46 115.31 119.95 1rhy h LEU 81 Ca 0.07 0.06 -0.11 0.00 0.84 0.00 0.00 57.88 58.74 1rhy h LEU 81 Cb -0.03 0.06 -0.01 0.00 0.37 0.00 0.00 40.66 41.05 1rhy h LEU 81 CO -0.02 0.09 -0.24 1.23 -0.34 0.00 0.00 178.44 179.16 1rhy h GLY 82 N 0.29 0.78 0.95 3.75 0.00 -0.58 -0.47 103.07 107.79 1rhy h GLY 82 Ca 0.22 -0.67 -0.03 0.00 0.00 0.00 0.00 47.33 46.85 1rhy h GLY 82 CO -0.24 0.61 0.15 0.83 0.00 0.00 0.00 176.54 177.88 1rhy h GLU 83 N 0.62 0.68 -0.18 4.80 5.08 -0.27 0.16 114.58 125.47 1rhy h GLU 83 Ca 0.08 -0.14 -0.01 0.00 -1.00 0.00 0.00 59.36 58.29 1rhy h GLU 83 Cb 0.74 -0.10 -0.01 0.00 0.50 0.00 0.00 28.75 29.88 1rhy h GLU 83 CO 0.06 0.65 0.06 0.00 -1.00 0.00 0.00 179.01 178.77 1rhy h ALA 84 N 1.00 0.23 -0.37 3.43 0.00 -0.93 -1.05 119.26 121.58 1rhy h ALA 84 Ca 0.14 -0.12 0.06 0.00 0.00 0.00 0.00 54.91 54.99 1rhy h ALA 84 Cb 0.24 -0.07 -0.06 0.00 0.00 0.00 0.00 17.79 17.91 1rhy h ALA 84 CO -0.01 -0.16 0.01 0.35 0.00 0.00 0.00 179.25 179.44 1rhy h PHE 85 N 0.12 -0.01 -0.05 0.00 3.57 -0.86 0.13 116.94 119.84 1rhy h PHE 85 Ca 0.06 0.03 0.01 0.00 3.53 0.00 0.00 57.97 61.60 1rhy h PHE 85 Cb 0.21 0.06 -0.01 0.00 2.79 0.00 0.00 35.95 39.00 1rhy h PHE 85 CO -0.00 -0.06 -0.03 -0.22 -2.23 0.00 0.00 178.31 175.76 1rhy h LYS 86 N 0.11 -0.04 -0.72 1.11 3.64 -0.47 -1.95 116.57 118.25 1rhy h LYS 86 Ca 0.18 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.56 1rhy h LYS 86 Cb 0.24 0.01 -0.04 0.00 -0.41 0.00 0.00 32.23 32.04 1rhy h LYS 86 CO -0.29 -0.02 0.46 -0.22 -2.27 0.00 0.00 179.45 177.11 1rhy h LYS 87 N -0.04 0.95 -0.66 1.90 3.64 -0.69 -2.54 116.57 119.13 1rhy h LYS 87 Ca 0.03 -0.06 0.01 0.00 -1.27 0.00 0.00 60.65 59.36 1rhy h LYS 87 Cb 0.08 -0.21 -0.03 0.00 -0.41 0.00 0.00 32.23 31.66 1rhy h LYS 87 CO -0.07 0.64 0.44 0.00 -2.27 0.00 0.00 179.45 178.19 1rhy h ALA 88 N 1.25 1.54 0.00 5.00 0.00 -0.70 -0.89 119.26 125.46 1rhy h ALA 88 Ca 0.26 -0.04 -0.00 0.00 0.00 0.00 0.00 54.91 55.13 1rhy h ALA 88 Cb -0.09 -0.26 -0.00 0.00 0.00 0.00 0.00 17.79 17.43 1rhy h ALA 88 CO -0.05 0.42 -0.00 -0.07 0.00 0.00 0.00 179.25 179.55 1rhy h LEU 89 N 0.88 0.00 0.00 0.00 -0.00 -0.92 -3.40 115.31 111.87 1rhy h LEU 89 Ca 0.24 0.00 0.00 0.00 -0.00 0.00 0.00 57.88 58.12 1rhy h LEU 89 Cb -0.09 0.00 0.00 0.00 -0.00 0.00 0.00 40.66 40.57 1rhy h LEU 89 CO -0.05 0.00 0.00 0.61 -0.00 0.00 0.00 178.44 179.00 1rhy n GLY 90 N -0.78 3.24 0.00 0.83 0.00 -0.34 -0.77 105.19 107.36 1rhy n GLY 90 Ca -0.02 0.11 0.13 0.00 0.00 0.00 0.00 46.02 46.24 1rhy n GLY 90 CO 0.00 0.00 0.00 -1.84 0.00 0.00 0.00 173.32 171.48 1rhy n GLU 91 N 14.00 0.24 -2.84 1.61 -0.00 -1.26 -4.92 120.64 127.47 1rhy n GLU 91 Ca 0.00 0.04 -0.21 0.00 -0.00 0.00 0.00 57.16 56.99 1rhy n GLU 91 Cb 0.00 -1.50 0.01 0.00 -0.00 0.00 0.00 31.44 29.95 1rhy n GLU 91 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.13 177.67 1rhy n ARG 92 N -1.37 -3.53 -2.59 3.44 1.74 0.05 -4.94 116.66 109.46 1rhy n ARG 92 Ca 0.10 0.84 -0.42 0.00 -0.77 0.00 0.00 57.85 57.60 1rhy n ARG 92 Cb 0.25 -5.60 -0.03 0.00 -1.02 0.00 0.00 32.46 26.07 1rhy n ARG 92 CO 0.00 0.00 0.00 0.15 -1.52 0.00 0.00 177.63 176.26 1rhy s LYS 93 N -5.50 4.43 -1.37 5.56 1.02 -1.26 -3.96 119.74 118.66 1rhy s LYS 93 Ca 0.20 1.53 -0.00 0.00 0.02 0.00 0.00 55.97 57.72 1rhy s LYS 93 Cb -0.09 -3.51 0.00 0.00 -0.52 0.00 0.00 37.83 33.71 1rhy s LYS 93 CO 0.25 -0.30 0.05 0.41 -0.92 0.00 0.00 175.35 174.84 1rhy n GLY 94 N 3.15 -0.30 3.97 -3.33 0.00 -1.26 -4.79 105.19 102.63 1rhy n GLY 94 Ca 0.09 -0.19 -0.21 0.00 0.00 0.00 0.00 46.02 45.71 1rhy n GLY 94 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 1rhy s ILE 95 N -2.84 4.44 0.42 -0.61 -4.36 -1.25 -1.49 121.20 115.50 1rhy s ILE 95 Ca 0.02 -0.86 0.22 0.00 -0.26 0.00 0.00 60.65 59.78 1rhy s ILE 95 Cb -0.01 -3.57 0.24 0.00 1.25 0.00 0.00 42.46 40.37 1rhy s ILE 95 CO 0.03 -0.27 2.02 0.50 0.24 0.00 0.00 174.94 177.47 1rhy h LYS 96 N 0.86 0.00 0.00 0.37 3.64 -0.82 -3.46 116.57 117.16 1rhy h LYS 96 Ca -0.48 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 58.90 1rhy h LYS 96 Cb 1.25 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 33.07 1rhy h LYS 96 CO 0.56 0.16 0.00 -2.13 -2.27 0.00 0.00 179.45 175.77 1rhy n ARG 97 N -3.87 0.00 -3.82 1.90 0.63 0.01 -4.86 116.66 106.65 1rhy n ARG 97 Ca -0.02 0.00 -0.36 0.00 -0.92 0.00 0.00 57.85 56.55 1rhy n ARG 97 Cb 0.26 -0.04 -0.07 0.00 0.45 0.00 0.00 32.46 33.06 1rhy n ARG 97 CO 0.00 0.00 0.00 0.71 -2.51 0.00 0.00 177.63 175.83 1rhy s TYR 98 N 0.00 3.48 0.02 -0.14 1.51 -1.26 -0.32 117.35 120.64 1rhy s TYR 98 Ca 0.00 0.40 -0.04 0.00 -1.01 0.00 0.00 57.07 56.43 1rhy s TYR 98 Cb 0.00 -2.05 -0.01 0.00 -0.11 0.00 0.00 41.96 39.79 1rhy s TYR 98 CO 0.00 0.49 0.05 0.20 -1.11 0.00 0.00 175.55 175.18 1rhy s GLY 99 N -0.29 0.17 -0.04 0.71 0.00 -0.08 -4.09 107.32 103.71 1rhy s GLY 99 Ca 0.11 -0.45 -0.30 0.00 0.00 0.00 0.00 44.72 44.08 1rhy s GLY 99 CO 0.01 -0.56 0.66 -2.52 0.00 0.00 0.00 173.10 170.68 1rhy s TYR 100 N -1.77 -0.63 -0.04 1.90 -0.85 -1.26 -0.30 117.35 114.40 1rhy s TYR 100 Ca -0.12 1.04 -0.29 0.00 -0.52 0.00 0.00 57.07 57.17 1rhy s TYR 100 Cb -0.07 0.40 0.11 0.00 0.38 0.00 0.00 41.96 42.78 1rhy s TYR 100 CO -0.01 -0.61 0.90 0.00 -1.52 0.00 0.00 175.55 174.31 1rhy s ALA 101 N -1.36 -1.84 0.09 9.51 0.00 -0.74 -4.61 121.76 122.80 1rhy s ALA 101 Ca -0.10 1.15 0.10 0.00 0.00 0.00 0.00 51.96 53.10 1rhy s ALA 101 Cb -0.00 0.17 -0.03 0.00 0.00 0.00 0.00 23.12 23.25 1rhy s ALA 101 CO 0.08 -0.60 -0.25 0.71 0.00 0.00 0.00 175.76 175.71 1rhy s TYR 102 N -2.63 2.37 -0.06 0.00 1.51 -1.26 -1.94 117.35 115.34 1rhy s TYR 102 Ca 0.03 -0.37 -0.02 0.00 -1.01 0.00 0.00 57.07 55.70 1rhy s TYR 102 Cb -0.01 -1.34 0.04 0.00 -0.11 0.00 0.00 41.96 40.54 1rhy s TYR 102 CO -0.06 0.25 0.12 0.00 -1.11 0.00 0.00 175.55 174.75 1rhy s ALA 103 N -0.96 -0.16 0.24 3.71 0.00 -0.31 -4.87 121.76 119.42 1rhy s ALA 103 Ca 0.14 0.57 0.07 0.00 0.00 0.00 0.00 51.96 52.73 1rhy s ALA 103 Cb -0.10 -0.46 -0.03 0.00 0.00 0.00 0.00 23.12 22.53 1rhy s ALA 103 CO 0.05 -0.20 0.22 -1.25 0.00 0.00 0.00 175.76 174.58 1rhy s PRO 104 N 1.31 3.03 -0.29 0.00 0.04 -1.26 -1.27 135.00 136.56 1rhy s PRO 104 Ca -0.07 -0.99 0.00 0.00 0.04 0.00 0.00 61.00 59.98 1rhy s PRO 104 Cb -0.12 -2.63 0.14 0.00 0.04 0.00 0.00 34.50 31.93 1rhy s PRO 104 CO -0.05 0.41 0.32 -1.17 0.04 0.00 0.00 177.00 176.55 1rhy s LEU 105 N -3.83 -0.35 0.00 -3.56 2.96 0.54 -4.89 118.68 109.55 1rhy s LEU 105 Ca 0.33 -0.68 0.00 0.00 -0.22 0.00 0.00 54.13 53.56 1rhy s LEU 105 Cb -0.08 0.62 0.00 0.00 0.50 0.00 0.00 46.19 47.23 1rhy s LEU 105 CO 0.26 -0.38 0.00 0.47 -1.32 0.00 0.00 176.35 175.37 1rhy n ASP 106 N 5.32 0.00 0.05 3.68 8.00 -1.26 0.04 116.55 132.38 1rhy n ASP 106 Ca -0.02 0.00 0.12 0.00 0.71 0.00 0.00 54.79 55.61 1rhy n ASP 106 Cb 0.47 0.00 0.49 0.00 -0.02 0.00 0.00 41.12 42.06 1rhy n ASP 106 CO 0.00 0.00 0.00 -1.84 -0.39 0.00 0.00 177.20 174.97 1rhy n GLU 107 N 9.08 0.11 -3.30 -1.24 0.00 -1.26 -4.82 120.64 119.20 1rhy n GLU 107 Ca 0.00 0.16 -0.31 0.00 0.00 0.00 0.00 57.16 57.01 1rhy n GLU 107 Cb 0.00 -1.65 -0.05 0.00 0.00 0.00 0.00 31.44 29.75 1rhy n GLU 107 CO 0.00 0.00 0.00 -1.12 0.00 0.00 0.00 177.13 176.01 1rhy s SER 108 N -3.66 6.58 -0.10 -1.84 0.01 0.11 -3.97 113.70 110.83 1rhy s SER 108 Ca 0.11 0.93 -0.04 0.00 1.31 0.00 0.00 55.95 58.26 1rhy s SER 108 Cb 0.14 -2.23 0.05 0.00 0.21 0.00 0.00 66.02 64.19 1rhy s SER 108 CO 0.50 -0.15 0.20 -0.22 0.41 0.00 0.00 173.24 173.97 1rhy s LEU 109 N -3.13 0.08 0.15 2.44 2.96 -0.70 -0.34 118.68 120.15 1rhy s LEU 109 Ca 0.48 0.43 0.05 0.00 -0.22 0.00 0.00 54.13 54.87 1rhy s LEU 109 Cb -0.11 0.49 -0.04 0.00 0.50 0.00 0.00 46.19 47.03 1rhy s LEU 109 CO 0.24 -0.21 -0.11 -0.44 -1.32 0.00 0.00 176.35 174.51 1rhy s SER 110 N 1.96 1.94 0.07 3.68 0.01 -0.39 0.37 113.70 121.32 1rhy s SER 110 Ca -0.02 -1.00 0.06 0.00 1.31 0.00 0.00 55.95 56.30 1rhy s SER 110 Cb -0.12 -0.04 -0.03 0.00 0.21 0.00 0.00 66.02 66.05 1rhy s SER 110 CO -0.07 -0.29 -0.16 -0.60 0.41 0.00 0.00 173.24 172.53 1rhy s ARG 111 N -3.65 0.95 -0.01 12.44 3.52 0.88 -1.16 118.95 131.91 1rhy s ARG 111 Ca 0.17 -0.94 0.01 0.00 -0.13 0.00 0.00 55.73 54.84 1rhy s ARG 111 Cb 0.01 -1.01 0.01 0.00 -1.56 0.00 0.00 34.95 32.40 1rhy s ARG 111 CO 0.02 0.24 -0.04 0.00 -0.81 0.00 0.00 175.30 174.71 1rhy s ALA 112 N -1.10 0.42 -0.04 6.12 0.00 -0.82 -0.31 121.76 126.03 1rhy s ALA 112 Ca 0.01 -0.11 0.01 0.00 0.00 0.00 0.00 51.96 51.87 1rhy s ALA 112 Cb -0.09 -0.19 0.02 0.00 0.00 0.00 0.00 23.12 22.86 1rhy s ALA 112 CO 0.02 0.05 -0.06 0.08 0.00 0.00 0.00 175.76 175.86 1rhy s VAL 113 N 0.25 0.62 0.01 0.00 1.01 -0.24 -1.80 120.40 120.25 1rhy s VAL 113 Ca -0.02 -0.19 0.00 0.00 0.00 0.00 0.00 61.98 61.77 1rhy s VAL 113 Cb -0.06 -0.62 -0.01 0.00 0.00 0.00 0.00 36.38 35.69 1rhy s VAL 113 CO -0.00 0.24 -0.03 -0.51 0.00 0.00 0.00 175.10 174.80 1rhy s ILE 114 N 0.77 0.15 -0.22 2.22 2.07 0.59 -0.91 121.20 125.89 1rhy s ILE 114 Ca -0.11 -0.44 0.01 0.00 -1.41 0.00 0.00 60.65 58.70 1rhy s ILE 114 Cb -0.14 -0.20 0.05 0.00 0.13 0.00 0.00 42.46 42.30 1rhy s ILE 114 CO 0.01 -0.18 -0.10 -0.62 -1.91 0.00 0.00 174.94 172.14 1rhy s ASP 115 N -0.65 3.68 -1.19 4.50 2.15 0.08 -0.90 116.67 124.33 1rhy s ASP 115 Ca -0.06 -1.04 -0.12 0.00 0.43 0.00 0.00 52.55 51.76 1rhy s ASP 115 Cb -0.05 -1.29 0.20 0.00 -0.30 0.00 0.00 42.92 41.49 1rhy s ASP 115 CO -0.00 -0.17 1.38 -0.38 -0.17 0.00 0.00 175.17 175.83 1rhy n ILE 116 N 4.63 4.37 -0.04 4.11 5.41 0.57 -2.00 119.36 136.41 1rhy n ILE 116 Ca -0.14 -4.92 0.00 0.00 1.00 0.00 0.00 62.75 58.69 1rhy n ILE 116 Cb 0.45 -2.48 0.00 0.00 -0.71 0.00 0.00 39.64 36.90 1rhy n ILE 116 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 176.55 175.01 1rhy n SER 117 N 4.64 0.00 -0.00 4.38 3.41 -1.26 -4.83 113.62 119.95 1rhy n SER 117 Ca 0.33 0.00 0.03 0.00 -0.26 0.00 0.00 58.87 58.97 1rhy n SER 117 Cb 0.41 0.00 -0.04 0.00 -0.26 0.00 0.00 64.21 64.32 1rhy n SER 117 CO 0.00 0.00 0.00 -1.20 -0.16 0.00 0.00 175.04 173.68 1rhy n SER 118 N 0.00 2.45 -4.59 4.04 7.64 -1.26 -4.69 113.62 117.21 1rhy n SER 118 Ca 0.00 -0.23 -0.42 0.00 1.01 0.00 0.00 58.87 59.23 1rhy n SER 118 Cb 0.00 1.17 -0.02 0.00 -1.01 0.00 0.00 64.21 64.34 1rhy n SER 118 CO 0.00 0.00 0.00 -0.13 -3.01 0.00 0.00 175.04 171.90 1rhy s ARG 119 N -2.09 3.38 0.38 1.43 0.52 -1.25 -4.65 118.95 116.66 1rhy s ARG 119 Ca -0.01 1.01 -0.24 0.00 -0.52 0.00 0.00 55.73 55.97 1rhy s ARG 119 Cb 0.04 -4.13 -0.10 0.00 0.52 0.00 0.00 34.95 31.28 1rhy s ARG 119 CO 0.24 -1.81 0.96 -1.25 0.02 0.00 0.00 175.30 173.46 1rhy s PRO 120 N 5.42 4.38 -0.28 3.54 0.04 -1.26 -2.60 135.00 144.24 1rhy s PRO 120 Ca 0.67 1.28 -0.28 0.00 0.04 0.00 0.00 61.00 62.71 1rhy s PRO 120 Cb -0.16 -2.53 0.19 0.00 0.04 0.00 0.00 34.50 32.04 1rhy s PRO 120 CO 0.31 0.09 1.35 -0.47 0.04 0.00 0.00 177.00 178.32 1rhy s TYR 121 N -1.83 -0.07 -0.09 0.56 5.04 -0.58 -4.83 117.35 115.54 1rhy s TYR 121 Ca 0.56 0.14 -0.05 0.00 -2.44 0.00 0.00 57.07 55.28 1rhy s TYR 121 Cb -0.16 0.49 0.04 0.00 0.35 0.00 0.00 41.96 42.68 1rhy s TYR 121 CO 0.20 -0.06 0.21 0.12 -1.34 0.00 0.00 175.55 174.69 1rhy s PHE 122 N -0.78 -0.27 0.02 4.97 5.36 -1.26 -0.28 117.98 125.75 1rhy s PHE 122 Ca 0.08 0.66 0.01 0.00 -0.96 0.00 0.00 56.93 56.72 1rhy s PHE 122 Cb -0.02 0.02 -0.02 0.00 -0.34 0.00 0.00 43.02 42.67 1rhy s PHE 122 CO -0.09 -0.19 -0.05 -1.64 -1.46 0.00 0.00 175.22 171.79 1rhy s MET 123 N 0.99 0.39 0.18 10.12 -1.94 -0.54 -5.00 119.30 123.50 1rhy s MET 123 Ca -0.07 -0.52 -0.21 0.00 -1.71 0.00 0.00 55.69 53.18 1rhy s MET 123 Cb -0.09 -0.19 0.05 0.00 2.01 0.00 0.00 34.83 36.62 1rhy s MET 123 CO -0.06 0.03 0.58 0.00 -0.01 0.00 0.00 175.02 175.56 1rhy s HIS 125 N -3.80 0.40 -0.51 0.00 5.65 -0.68 -4.97 115.29 111.38 1rhy s HIS 125 Ca 0.04 -1.07 0.03 0.00 0.25 0.00 0.00 55.06 54.31 1rhy s HIS 125 Cb -0.01 -0.88 0.15 0.00 -1.18 0.00 0.00 32.58 30.66 1rhy s HIS 125 CO -0.08 -0.83 0.32 -0.51 -0.65 0.00 0.00 174.74 172.98 1rhy s LEU 126 N 1.80 3.16 -0.95 8.88 1.43 -1.26 -0.59 118.68 131.14 1rhy s LEU 126 Ca 0.12 -3.06 -0.11 0.00 -1.03 0.00 0.00 54.13 50.05 1rhy s LEU 126 Cb -0.18 -1.14 -0.08 0.00 0.03 0.00 0.00 46.19 44.82 1rhy s LEU 126 CO -0.25 -0.20 2.12 -0.81 0.23 0.00 0.00 176.35 177.44 1rhy n PRO 127 N 2.98 2.07 -1.94 1.29 -0.04 -1.26 -4.95 135.00 133.14 1rhy n PRO 127 Ca 0.15 -1.69 -0.38 0.00 -0.04 0.00 0.00 63.50 61.53 1rhy n PRO 127 Cb 0.37 -2.67 0.02 0.00 -0.04 0.00 0.00 33.50 31.18 1rhy n PRO 127 CO 0.00 0.00 0.00 -0.06 -0.04 0.00 0.00 175.50 175.40 1rhy s PHE 128 N 3.79 2.50 0.00 0.54 0.08 -1.26 -4.97 117.98 118.66 1rhy s PHE 128 Ca 0.47 1.42 0.00 0.00 0.12 0.00 0.00 56.93 58.94 1rhy s PHE 128 Cb 0.12 -3.68 0.00 0.00 -0.57 0.00 0.00 43.02 38.90 1rhy s PHE 128 CO 0.01 -2.45 0.00 0.25 -0.10 0.00 0.00 175.22 172.93 1rhy n THR 129 N -0.76 0.00 -3.04 0.64 -2.24 -1.26 -5.02 114.28 102.60 1rhy n THR 129 Ca 0.09 -0.26 0.00 0.00 -2.27 0.00 0.00 64.05 61.61 1rhy n THR 129 Cb 0.46 0.76 0.00 0.00 -2.10 0.00 0.00 70.33 69.45 1rhy n THR 129 CO 0.00 0.00 0.00 0.54 -0.57 0.00 0.00 175.07 175.04 1rhy n ARG 130 N -1.21 1.19 -0.00 -0.78 3.00 -1.26 -5.04 116.66 112.56 1rhy n ARG 130 Ca 0.00 0.00 0.05 0.00 -0.01 0.00 0.00 57.85 57.89 1rhy n ARG 130 Cb 0.00 0.00 -0.07 0.00 0.00 0.00 0.00 32.46 32.39 1rhy n ARG 130 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.63 178.02 1rhy n GLU 131 N -0.87 2.22 -4.06 5.56 1.02 -1.26 -4.83 120.64 118.42 1rhy n GLU 131 Ca 0.00 -0.04 -0.07 0.00 -0.02 0.00 0.00 57.16 57.03 1rhy n GLU 131 Cb 0.00 -1.10 -0.10 0.00 -0.02 0.00 0.00 31.44 30.22 1rhy n GLU 131 CO 0.00 0.00 0.00 0.15 1.18 0.00 0.00 177.13 178.46 1rhy s LYS 132 N -2.30 0.56 -0.21 3.49 1.02 -1.26 -0.94 119.74 120.10 1rhy s LYS 132 Ca 0.01 -1.10 -0.04 0.00 0.02 0.00 0.00 55.97 54.85 1rhy s LYS 132 Cb 0.07 0.20 0.07 0.00 -0.52 0.00 0.00 37.83 37.65 1rhy s LYS 132 CO 0.43 -0.10 0.10 0.14 -0.92 0.00 0.00 175.35 175.00 1rhy s VAL 133 N -3.47 0.03 0.00 3.17 -7.23 0.01 -4.80 120.40 108.11 1rhy s VAL 133 Ca 0.03 -0.44 0.00 0.00 -1.81 0.00 0.00 61.98 59.76 1rhy s VAL 133 Cb 0.05 -0.79 0.00 0.00 0.56 0.00 0.00 36.38 36.20 1rhy s VAL 133 CO -0.08 -0.42 0.00 0.61 -0.31 0.00 0.00 175.10 174.90 1rhy n GLY 134 N 5.23 1.45 0.14 2.32 0.00 -1.26 -2.13 105.19 110.94 1rhy n GLY 134 Ca -0.07 -0.61 0.13 0.00 0.00 0.00 0.00 46.02 45.47 1rhy n GLY 134 CO 0.00 0.00 0.00 1.29 0.00 0.00 0.00 173.32 174.61 1rhy h ASP 135 N 9.20 0.00 -3.59 1.61 -0.00 -1.97 -3.45 116.42 118.22 1rhy h ASP 135 Ca 0.00 0.00 -0.51 0.00 -0.00 0.00 0.00 57.03 56.52 1rhy h ASP 135 Cb 0.00 0.00 -0.02 0.00 -0.00 0.00 0.00 39.33 39.31 1rhy h ASP 135 CO 0.00 0.00 0.32 -0.22 -0.00 0.00 0.00 179.24 179.34 1rhy s LEU 136 N -4.96 4.54 0.01 0.15 1.98 -0.90 -5.03 118.68 114.47 1rhy s LEU 136 Ca 0.09 1.78 -0.30 0.00 -2.89 0.00 0.00 54.13 52.82 1rhy s LEU 136 Cb 0.10 -3.53 -0.04 0.00 0.66 0.00 0.00 46.19 43.38 1rhy s LEU 136 CO 0.60 0.02 1.02 -0.55 -1.89 0.00 0.00 176.35 175.55 1rhy s SER 137 N -0.37 7.32 0.21 3.68 0.15 -1.26 -0.81 113.70 122.62 1rhy s SER 137 Ca 0.44 1.72 -0.08 0.00 0.70 0.00 0.00 55.95 58.73 1rhy s SER 137 Cb -0.24 -2.57 0.29 0.00 -1.71 0.00 0.00 66.02 61.79 1rhy s SER 137 CO 0.29 -0.29 1.78 0.71 1.20 0.00 0.00 173.24 176.93 1rhy h THR 138 N 4.73 0.87 -0.13 6.45 1.35 -1.35 -1.35 112.91 123.48 1rhy h THR 138 Ca -0.41 -0.19 0.04 0.00 -0.55 0.00 0.00 66.41 65.29 1rhy h THR 138 Cb 1.22 0.25 -0.01 0.00 -1.73 0.00 0.00 68.15 67.88 1rhy h THR 138 CO 0.76 0.10 0.14 1.05 -0.25 0.00 0.00 175.52 177.32 1rhy h GLU 139 N 0.57 0.00 0.00 4.72 9.09 -1.91 -1.70 114.58 125.35 1rhy h GLU 139 Ca 0.32 0.00 -0.09 0.00 0.05 0.00 0.00 59.36 59.64 1rhy h GLU 139 Cb 0.31 0.00 -0.01 0.00 -1.65 0.00 0.00 28.75 27.40 1rhy h GLU 139 CO -0.25 0.00 -0.42 0.52 0.05 0.00 0.00 179.01 178.91 1rhy h MET 140 N 0.00 0.00 -0.06 1.06 2.86 -1.62 -3.30 114.93 113.87 1rhy h MET 140 Ca 0.06 0.00 0.04 0.00 -2.06 0.00 0.00 59.70 57.74 1rhy h MET 140 Cb 0.34 0.00 -0.05 0.00 0.06 0.00 0.00 31.60 31.95 1rhy h MET 140 CO -0.00 0.42 -0.23 0.28 1.06 0.00 0.00 176.91 178.44 1rhy h VAL 141 N 0.00 0.46 -0.65 -2.22 2.07 -1.37 0.32 116.25 114.85 1rhy h VAL 141 Ca -0.00 0.00 0.11 0.00 0.82 0.00 0.00 66.70 67.63 1rhy h VAL 141 Cb 1.00 0.46 -0.08 0.00 -1.52 0.00 0.00 31.29 31.15 1rhy h VAL 141 CO 0.05 0.00 0.23 -1.28 0.02 0.00 0.00 177.57 176.59 1rhy h SER 142 N -0.33 0.19 -0.32 0.57 0.87 -1.72 -1.80 113.55 111.01 1rhy h SER 142 Ca 0.08 0.10 -0.05 0.00 -1.23 0.00 0.00 61.79 60.69 1rhy h SER 142 Cb 0.44 0.09 -0.01 0.00 -0.44 0.00 0.00 62.40 62.48 1rhy h SER 142 CO -0.25 0.10 0.02 0.45 -0.53 0.00 0.00 176.83 176.62 1rhy h HIS 143 N 0.39 0.60 0.00 2.24 -0.00 -1.26 -1.73 115.15 115.39 1rhy h HIS 143 Ca 0.34 -0.10 -0.05 0.00 -0.00 0.00 0.00 60.37 60.57 1rhy h HIS 143 Cb 0.47 -0.16 -0.01 0.00 -0.00 0.00 0.00 27.41 27.72 1rhy h HIS 143 CO -0.19 0.66 -0.24 1.37 -0.00 0.00 0.00 177.93 179.53 1rhy h LEU 144 N 0.36 0.00 -0.46 2.43 -0.00 -0.13 -0.03 115.31 117.48 1rhy h LEU 144 Ca 0.09 0.00 -0.17 0.00 -0.00 0.00 0.00 57.88 57.80 1rhy h LEU 144 Cb 0.41 0.00 -0.01 0.00 -0.00 0.00 0.00 40.66 41.06 1rhy h LEU 144 CO 0.01 0.24 -0.65 -0.07 -0.00 0.00 0.00 178.44 177.97 1rhy h LEU 145 N 0.00 0.54 -0.29 0.17 3.38 -1.22 0.28 115.31 118.18 1rhy h LEU 145 Ca -0.00 -0.32 -0.06 0.00 0.09 0.00 0.00 57.88 57.59 1rhy h LEU 145 Cb 0.88 -0.16 -0.01 0.00 0.09 0.00 0.00 40.66 41.46 1rhy h LEU 145 CO 0.03 1.04 -0.05 -0.61 0.09 0.00 0.00 178.44 178.95 1rhy h GLN 146 N 0.34 0.54 -0.76 1.13 4.15 -0.92 -0.09 115.11 119.49 1rhy h GLN 146 Ca -0.01 -0.20 -0.05 0.00 0.77 0.00 0.00 58.65 59.15 1rhy h GLN 146 Cb 1.21 -0.04 -0.03 0.00 0.21 0.00 0.00 27.48 28.83 1rhy h GLN 146 CO 0.12 0.72 0.26 0.77 -1.93 0.00 0.00 178.83 178.77 1rhy h SER 147 N 0.30 1.09 -0.07 -0.69 0.02 -0.91 0.17 113.55 113.46 1rhy h SER 147 Ca 0.07 -0.19 0.00 0.00 -0.84 0.00 0.00 61.79 60.83 1rhy h SER 147 Cb 0.51 -0.28 -0.00 0.00 0.14 0.00 0.00 62.40 62.77 1rhy h SER 147 CO 0.02 0.99 0.04 0.15 -1.14 0.00 0.00 176.83 176.90 1rhy h PHE 148 N 1.13 0.08 -0.65 3.45 3.57 -0.70 0.54 116.94 124.36 1rhy h PHE 148 Ca 0.25 0.00 -0.01 0.00 3.53 0.00 0.00 57.97 61.74 1rhy h PHE 148 Cb 0.27 -0.03 -0.03 0.00 2.79 0.00 0.00 35.95 38.96 1rhy h PHE 148 CO 0.02 0.05 0.36 0.00 -2.23 0.00 0.00 178.31 176.52 1rhy h ALA 149 N 1.02 0.83 -0.11 2.41 0.00 -0.39 0.67 119.26 123.68 1rhy h ALA 149 Ca 0.02 -0.10 -0.01 0.00 0.00 0.00 0.00 54.91 54.82 1rhy h ALA 149 Cb -0.01 -0.26 -0.00 0.00 0.00 0.00 0.00 17.79 17.52 1rhy h ALA 149 CO -0.01 0.34 0.02 0.74 0.00 0.00 0.00 179.25 180.34 1rhy h PHE 150 N 0.88 0.20 -0.78 0.00 0.04 -0.82 -0.26 116.94 116.20 1rhy h PHE 150 Ca 0.23 -0.03 -0.01 0.00 2.80 0.00 0.00 57.97 60.96 1rhy h PHE 150 Cb 0.03 -0.06 -0.04 0.00 2.20 0.00 0.00 35.95 38.09 1rhy h PHE 150 CO -0.01 0.38 0.43 0.00 -0.60 0.00 0.00 178.31 178.51 1rhy h ALA 151 N 0.80 1.29 0.00 2.45 0.00 -0.69 -2.16 119.26 120.95 1rhy h ALA 151 Ca 0.03 -0.11 0.00 0.00 0.00 0.00 0.00 54.91 54.83 1rhy h ALA 151 Cb 0.29 -0.31 0.00 0.00 0.00 0.00 0.00 17.79 17.76 1rhy h ALA 151 CO 0.00 0.58 0.00 0.00 0.00 0.00 0.00 179.25 179.83 1rhy h ALA 152 N 1.39 1.00 -3.11 0.00 0.00 -0.74 -3.37 119.26 114.44 1rhy h ALA 152 Ca 0.28 0.00 -0.16 0.00 0.00 0.00 0.00 54.91 55.03 1rhy h ALA 152 Cb 0.01 0.00 0.06 0.00 0.00 0.00 0.00 17.79 17.87 1rhy h ALA 152 CO -0.05 0.00 -0.29 0.41 0.00 0.00 0.00 179.25 179.32 1rhy n GLY 153 N 0.71 0.29 3.35 0.00 0.00 -0.20 -4.58 105.19 104.77 1rhy n GLY 153 Ca 0.03 -0.28 -0.19 0.00 0.00 0.00 0.00 46.02 45.59 1rhy n GLY 153 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1rhy s VAL 154 N -3.14 1.67 -0.25 1.61 -7.23 -0.64 -3.96 120.40 108.46 1rhy s VAL 154 Ca 0.20 -2.19 -0.12 0.00 -1.81 0.00 0.00 61.98 58.06 1rhy s VAL 154 Cb -0.09 -2.11 -0.05 0.00 0.56 0.00 0.00 36.38 34.70 1rhy s VAL 154 CO 0.30 -0.55 0.23 -0.89 -0.31 0.00 0.00 175.10 173.89 1rhy s THR 155 N -3.01 5.29 -0.02 5.32 2.01 -0.85 -1.53 115.64 122.85 1rhy s THR 155 Ca 0.23 0.30 0.01 0.00 0.31 0.00 0.00 61.69 62.55 1rhy s THR 155 Cb 0.00 -3.57 0.01 0.00 0.01 0.00 0.00 72.50 68.95 1rhy s THR 155 CO 0.07 0.27 -0.04 -0.22 -0.69 0.00 0.00 174.62 174.01 1rhy s LEU 156 N 1.49 1.62 -0.13 4.42 2.96 0.62 -0.75 118.68 128.92 1rhy s LEU 156 Ca 0.10 -0.10 0.01 0.00 -0.22 0.00 0.00 54.13 53.92 1rhy s LEU 156 Cb -0.15 -0.34 0.02 0.00 0.50 0.00 0.00 46.19 46.22 1rhy s LEU 156 CO 0.08 -0.00 -0.14 -1.00 -1.32 0.00 0.00 176.35 173.97 1rhy s HIS 157 N 0.44 2.02 -0.11 5.38 3.76 -0.08 -1.47 115.29 125.22 1rhy s HIS 157 Ca -0.05 -1.03 0.03 0.00 -0.15 0.00 0.00 55.06 53.86 1rhy s HIS 157 Cb -0.09 -1.48 0.00 0.00 1.11 0.00 0.00 32.58 32.12 1rhy s HIS 157 CO -0.00 -0.56 -0.23 0.42 -0.85 0.00 0.00 174.74 173.52 1rhy s ILE 158 N 1.24 2.15 -0.04 0.60 1.01 -0.53 -1.08 121.20 124.55 1rhy s ILE 158 Ca -0.01 -0.98 0.01 0.00 0.00 0.00 0.00 60.65 59.67 1rhy s ILE 158 Cb -0.14 -1.83 0.02 0.00 0.01 0.00 0.00 42.46 40.52 1rhy s ILE 158 CO -0.06 0.55 -0.04 -1.81 0.00 0.00 0.00 174.94 173.59 1rhy s ASP 159 N 0.45 0.91 -0.20 3.58 1.01 0.57 -1.68 116.67 121.31 1rhy s ASP 159 Ca -0.16 -0.12 -0.25 0.00 0.71 0.00 0.00 52.55 52.74 1rhy s ASP 159 Cb -0.17 -0.43 -0.01 0.00 1.01 0.00 0.00 42.92 43.32 1rhy s ASP 159 CO 0.06 -0.06 0.82 -0.55 0.21 0.00 0.00 175.17 175.65 1rhy s SER 160 N 0.95 6.88 -0.06 0.27 0.15 0.24 -0.09 113.70 122.04 1rhy s SER 160 Ca -0.11 1.09 -0.06 0.00 0.70 0.00 0.00 55.95 57.58 1rhy s SER 160 Cb -0.14 -2.44 -0.28 0.00 -1.71 0.00 0.00 66.02 61.45 1rhy s SER 160 CO -0.00 -0.44 0.61 0.40 1.20 0.00 0.00 173.24 175.00 1rhy h ILE 161 N 5.29 0.87 -2.70 6.45 1.08 -0.42 -3.48 117.51 124.61 1rhy h ILE 161 Ca -0.27 -2.53 0.07 0.00 -0.39 0.00 0.00 64.86 61.74 1rhy h ILE 161 Cb 1.12 2.65 -0.10 0.00 -3.07 0.00 0.00 36.82 37.41 1rhy h ILE 161 CO 0.85 0.83 0.34 0.00 -0.69 0.00 0.00 178.15 179.48 1rhy s ARG 162 N -2.58 1.27 0.00 2.37 1.70 -1.12 -4.98 118.95 115.61 1rhy s ARG 162 Ca -0.16 -0.59 0.00 0.00 -0.47 0.00 0.00 55.73 54.52 1rhy s ARG 162 Cb 0.06 0.51 0.00 0.00 -0.57 0.00 0.00 34.95 34.95 1rhy s ARG 162 CO 0.82 -0.57 0.00 0.41 -1.08 0.00 0.00 175.30 174.88 1rhy n GLY 163 N -0.38 3.85 0.92 3.88 0.00 -1.25 -1.72 105.19 110.47 1rhy n GLY 163 Ca -0.10 -0.62 -0.02 0.00 0.00 0.00 0.00 46.02 45.27 1rhy n GLY 163 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1rhy n GLU 164 N -1.19 0.06 -2.17 1.61 -0.58 -1.26 -4.99 120.64 112.12 1rhy n GLU 164 Ca 0.00 0.03 -0.43 0.00 -0.42 0.00 0.00 57.16 56.34 1rhy n GLU 164 Cb 0.00 -0.61 -0.02 0.00 -0.57 0.00 0.00 31.44 30.24 1rhy n GLU 164 CO 0.00 0.00 0.00 1.21 -0.48 0.00 0.00 177.13 177.86 1rhy s ASN 165 N -5.56 6.53 0.44 1.62 3.84 -1.26 -4.91 114.94 115.64 1rhy s ASN 165 Ca -0.04 1.68 0.15 0.00 0.21 0.00 0.00 52.86 54.86 1rhy s ASN 165 Cb 0.01 -2.53 1.04 0.00 -0.55 0.00 0.00 41.25 39.22 1rhy s ASN 165 CO 0.05 -1.12 1.97 0.78 -2.79 0.00 0.00 177.10 175.99 1rhy h ASN 166 N 10.03 0.36 -0.31 -4.21 2.35 -1.96 0.93 115.58 122.78 1rhy h ASN 166 Ca -0.33 0.01 -0.02 0.00 -0.55 0.00 0.00 56.30 55.41 1rhy h ASN 166 Cb 1.14 -0.06 -0.01 0.00 0.05 0.00 0.00 38.32 39.44 1rhy h ASN 166 CO 0.99 0.21 0.10 0.45 -1.65 0.00 0.00 177.43 177.53 1rhy h HIS 167 N 0.40 0.49 -0.64 1.19 3.86 -1.94 -1.94 115.15 116.58 1rhy h HIS 167 Ca 0.29 -0.05 -0.04 0.00 -1.16 0.00 0.00 60.37 59.42 1rhy h HIS 167 Cb 0.62 -0.14 -0.03 0.00 1.06 0.00 0.00 27.41 28.92 1rhy h HIS 167 CO -0.00 0.50 0.26 0.45 0.86 0.00 0.00 177.93 180.00 1rhy h HIS 168 N 0.34 0.97 0.08 2.45 3.86 -1.44 0.17 115.15 121.58 1rhy h HIS 168 Ca 0.10 -0.07 0.00 0.00 -1.16 0.00 0.00 60.37 59.24 1rhy h HIS 168 Cb 0.24 -0.29 -0.01 0.00 1.06 0.00 0.00 27.41 28.41 1rhy h HIS 168 CO 0.01 0.76 -0.07 0.82 0.86 0.00 0.00 177.93 180.30 1rhy h ILE 169 N 0.89 0.83 -0.28 2.45 2.04 -0.79 -0.03 117.51 122.62 1rhy h ILE 169 Ca 0.21 0.00 -0.02 0.00 1.00 0.00 0.00 64.86 66.05 1rhy h ILE 169 Cb 0.20 0.83 -0.01 0.00 -0.74 0.00 0.00 36.82 37.10 1rhy h ILE 169 CO -0.02 0.00 0.11 0.00 0.00 0.00 0.00 178.15 178.24 1rhy h ALA 170 N 0.74 0.37 -0.48 1.87 0.00 -1.11 -2.30 119.26 118.35 1rhy h ALA 170 Ca 0.00 -0.13 -0.07 0.00 0.00 0.00 0.00 54.91 54.72 1rhy h ALA 170 Cb 0.16 -0.11 -0.02 0.00 0.00 0.00 0.00 17.79 17.82 1rhy h ALA 170 CO -0.02 -0.03 0.03 1.49 0.00 0.00 0.00 179.25 180.73 1rhy h GLU 171 N 0.30 0.82 -0.35 0.00 4.81 -0.57 -2.04 114.58 117.55 1rhy h GLU 171 Ca 0.09 -0.25 -0.04 0.00 -0.13 0.00 0.00 59.36 59.04 1rhy h GLU 171 Cb 0.20 -0.08 -0.02 0.00 0.63 0.00 0.00 28.75 29.48 1rhy h GLU 171 CO -0.01 0.85 0.07 0.66 -0.73 0.00 0.00 179.01 179.85 1rhy h SER 172 N 0.68 0.47 -0.26 1.04 4.64 -0.96 -0.56 113.55 118.61 1rhy h SER 172 Ca 0.14 -0.07 -0.07 0.00 -0.47 0.00 0.00 61.79 61.32 1rhy h SER 172 Cb 0.46 -0.12 -0.01 0.00 -0.31 0.00 0.00 62.40 62.42 1rhy h SER 172 CO 0.02 0.50 -0.11 0.00 -0.87 0.00 0.00 176.83 176.36 1rhy h ALA 173 N 1.57 0.36 -0.48 5.18 0.00 -1.10 0.14 119.26 124.94 1rhy h ALA 173 Ca 0.12 -0.30 -0.09 0.00 0.00 0.00 0.00 54.91 54.64 1rhy h ALA 173 Cb 0.23 -0.09 -0.02 0.00 0.00 0.00 0.00 17.79 17.91 1rhy h ALA 173 CO -0.00 0.22 -0.05 0.74 0.00 0.00 0.00 179.25 180.16 1rhy h PHE 174 N 0.27 0.89 -0.51 0.00 -1.00 -1.11 0.34 116.94 115.82 1rhy h PHE 174 Ca 0.06 -0.15 -0.06 0.00 2.81 0.00 0.00 57.97 60.63 1rhy h PHE 174 Cb 0.62 -0.24 -0.02 0.00 3.61 0.00 0.00 35.95 39.92 1rhy h PHE 174 CO 0.06 0.84 0.07 0.87 -1.61 0.00 0.00 178.31 178.54 1rhy h LYS 175 N 0.76 0.85 -0.77 1.51 1.57 -0.90 0.17 116.57 119.77 1rhy h LYS 175 Ca 0.14 -0.24 -0.02 0.00 -1.87 0.00 0.00 60.65 58.66 1rhy h LYS 175 Cb 0.53 -0.10 -0.04 0.00 0.08 0.00 0.00 32.23 32.71 1rhy h LYS 175 CO 0.03 0.85 0.39 0.00 -0.57 0.00 0.00 179.45 180.15 1rhy h ALA 176 N 0.97 1.24 -0.38 3.86 0.00 -0.26 -1.42 119.26 123.26 1rhy h ALA 176 Ca 0.15 -0.14 -0.03 0.00 0.00 0.00 0.00 54.91 54.90 1rhy h ALA 176 Cb 0.42 -0.31 -0.02 0.00 0.00 0.00 0.00 17.79 17.89 1rhy h ALA 176 CO 0.01 0.60 0.13 1.25 0.00 0.00 0.00 179.25 181.24 1rhy h LEU 177 N 1.08 0.54 -0.24 0.00 5.85 -0.48 -1.22 115.31 120.85 1rhy h LEU 177 Ca 0.27 -0.19 0.05 0.00 0.84 0.00 0.00 57.88 58.85 1rhy h LEU 177 Cb 0.08 -0.14 -0.05 0.00 0.37 0.00 0.00 40.66 40.91 1rhy h LEU 177 CO -0.04 0.59 -0.10 0.00 -0.34 0.00 0.00 178.44 178.55 1rhy h ALA 178 N 0.98 0.11 -0.50 1.25 0.00 0.03 -0.66 119.26 120.45 1rhy h ALA 178 Ca 0.12 0.09 -0.08 0.00 0.00 0.00 0.00 54.91 55.04 1rhy h ALA 178 Cb 0.23 0.25 -0.02 0.00 0.00 0.00 0.00 17.79 18.24 1rhy h ALA 178 CO -0.01 -0.51 -0.02 -0.07 0.00 0.00 0.00 179.25 178.64 1rhy h LEU 179 N -0.06 0.83 -0.48 0.00 3.38 -1.14 -0.28 115.31 117.57 1rhy h LEU 179 Ca 0.12 -0.22 -0.06 0.00 0.09 0.00 0.00 57.88 57.82 1rhy h LEU 179 Cb 0.25 -0.22 -0.02 0.00 0.09 0.00 0.00 40.66 40.75 1rhy h LEU 179 CO -0.28 0.91 0.07 0.00 0.09 0.00 0.00 178.44 179.24 1rhy h ALA 180 N 1.18 0.64 -0.32 1.53 0.00 -0.84 -1.86 119.26 119.59 1rhy h ALA 180 Ca 0.15 -0.24 -0.02 0.00 0.00 0.00 0.00 54.91 54.80 1rhy h ALA 180 Cb 0.50 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 18.10 1rhy h ALA 180 CO 0.03 0.38 0.12 0.82 0.00 0.00 0.00 179.25 180.59 1rhy h ILE 181 N 0.68 1.19 -0.81 0.00 2.04 -0.89 -0.61 117.51 119.10 1rhy h ILE 181 Ca 0.15 -0.61 0.10 0.00 1.00 0.00 0.00 64.86 65.50 1rhy h ILE 181 Cb 0.40 0.99 -0.07 0.00 -0.74 0.00 0.00 36.82 37.40 1rhy h ILE 181 CO 0.01 0.21 0.45 -0.09 0.00 0.00 0.00 178.15 178.73 1rhy h ARG 182 N 0.37 0.73 -0.12 2.37 2.43 -0.83 -0.33 114.38 119.01 1rhy h ARG 182 Ca 0.11 -0.04 -0.02 0.00 -0.81 0.00 0.00 59.98 59.21 1rhy h ARG 182 Cb 0.21 -0.17 -0.00 0.00 -0.42 0.00 0.00 29.97 29.59 1rhy h ARG 182 CO -0.01 0.48 -0.00 1.98 -1.51 0.00 0.00 179.97 180.91 1rhy h MET 183 N 0.75 0.21 -0.40 0.20 4.05 -1.11 -2.99 114.93 115.64 1rhy h MET 183 Ca 0.39 -0.07 -0.07 0.00 -0.28 0.00 0.00 59.70 59.68 1rhy h MET 183 Cb 0.38 -0.02 -0.02 0.00 -0.80 0.00 0.00 31.60 31.15 1rhy h MET 183 CO -0.26 0.46 -0.04 0.00 0.23 0.00 0.00 176.91 177.31 1rhy h ALA 184 N 0.74 1.19 -0.01 0.39 0.00 -0.44 -2.94 119.26 118.19 1rhy h ALA 184 Ca 0.03 -0.26 0.00 0.00 0.00 0.00 0.00 54.91 54.69 1rhy h ALA 184 Cb 0.37 -0.17 0.00 0.00 0.00 0.00 0.00 17.79 17.99 1rhy h ALA 184 CO 0.01 0.53 -0.19 0.44 0.00 0.00 0.00 179.25 180.04 1rhy n ILE 185 N -4.22 0.00 -1.76 0.00 -5.35 -0.20 -0.81 119.36 107.03 1rhy n ILE 185 Ca 0.02 -0.08 -0.41 0.00 -0.27 0.00 0.00 62.75 62.00 1rhy n ILE 185 Cb 0.30 0.12 -0.00 0.00 -1.74 0.00 0.00 39.64 38.31 1rhy n ILE 185 CO 0.00 0.00 0.00 -1.54 -1.76 0.00 0.00 176.55 173.25 1rhy n SER 186 N -0.87 3.64 -4.91 7.28 3.41 -1.11 -4.69 113.62 116.37 1rhy n SER 186 Ca 0.13 1.22 -0.27 0.00 -0.26 0.00 0.00 58.87 59.69 1rhy n SER 186 Cb 0.31 -1.60 -0.00 0.00 -0.26 0.00 0.00 64.21 62.66 1rhy n SER 186 CO 0.00 0.00 0.00 -0.13 -0.16 0.00 0.00 175.04 174.75 1rhy s ARG 187 N -1.92 2.24 0.00 4.33 0.52 -1.26 -1.08 118.95 121.78 1rhy s ARG 187 Ca 0.55 -2.08 0.00 0.00 -0.52 0.00 0.00 55.73 53.68 1rhy s ARG 187 Cb -0.49 -2.06 0.00 0.00 0.52 0.00 0.00 34.95 32.91 1rhy s ARG 187 CO 0.62 -0.66 0.00 2.41 0.02 0.00 0.00 175.30 177.69