#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2rpc s SER 2 N 0.00 0.14 0.05 1.61 0.01 -1.26 -5.18 113.70 109.07 2rpc s SER 2 Ca 0.00 -1.14 0.03 0.00 1.31 0.00 0.00 55.95 56.15 2rpc s SER 2 Cb 0.00 0.79 -0.02 0.00 0.21 0.00 0.00 66.02 67.00 2rpc s SER 2 CO 0.00 -1.56 -0.10 -0.55 0.41 0.00 0.00 173.24 171.44 2rpc s SER 3 N -3.08 1.11 0.00 2.44 0.15 -1.26 -5.12 113.70 107.94 2rpc s SER 3 Ca 0.18 -0.52 0.00 0.00 0.70 0.00 0.00 55.95 56.31 2rpc s SER 3 Cb -0.04 -0.01 0.00 0.00 -1.71 0.00 0.00 66.02 64.26 2rpc s SER 3 CO 0.12 -0.13 0.00 0.61 1.20 0.00 0.00 173.24 175.04 2rpc n GLY 4 N 1.57 -0.93 3.42 9.45 0.00 -1.26 -5.16 105.19 112.28 2rpc n GLY 4 Ca -0.21 -0.06 -0.28 0.00 0.00 0.00 0.00 46.02 45.47 2rpc n GLY 4 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2rpc s SER 5 N -4.00 3.47 0.43 1.61 1.04 -1.26 -5.10 113.70 109.88 2rpc s SER 5 Ca 0.00 -0.80 -0.21 0.00 0.48 0.00 0.00 55.95 55.42 2rpc s SER 5 Cb 0.00 -0.28 -0.15 0.00 0.10 0.00 0.00 66.02 65.68 2rpc s SER 5 CO 0.00 0.14 0.06 -1.20 0.98 0.00 0.00 173.24 173.22 2rpc n SER 6 N 0.47 -2.96 0.00 7.02 7.64 -1.26 -4.67 113.62 119.86 2rpc n SER 6 Ca -0.14 0.78 0.00 0.00 1.01 0.00 0.00 58.87 60.52 2rpc n SER 6 Cb 0.55 -0.88 0.00 0.00 -1.01 0.00 0.00 64.21 62.86 2rpc n SER 6 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2rpc n GLY 7 N 2.35 -2.67 3.63 0.23 0.00 -1.26 -4.96 105.19 102.51 2rpc n GLY 7 Ca 0.11 -1.71 -0.32 0.00 0.00 0.00 0.00 46.02 44.09 2rpc n GLY 7 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 2rpc s GLN 8 N -0.67 2.66 1.17 1.61 1.11 -1.26 -5.11 119.66 119.17 2rpc s GLN 8 Ca 0.00 -0.66 -0.20 0.00 0.01 0.00 0.00 55.36 54.51 2rpc s GLN 8 Cb 0.00 -2.57 0.29 0.00 -1.01 0.00 0.00 33.01 29.72 2rpc s GLN 8 CO 0.00 0.62 1.04 -0.35 0.01 0.00 0.00 175.29 176.60 2rpc n PRO 9 N 1.56 -3.05 -3.28 2.91 -0.04 -1.26 -4.99 135.00 126.85 2rpc n PRO 9 Ca -0.15 -1.66 -0.42 0.00 -0.04 0.00 0.00 63.50 61.23 2rpc n PRO 9 Cb 0.53 -1.56 -0.08 0.00 -0.04 0.00 0.00 33.50 32.35 2rpc n PRO 9 CO 0.00 0.00 0.00 0.42 -0.04 0.00 0.00 175.50 175.88 2rpc s ILE 10 N -2.88 5.04 -0.11 0.52 1.01 -1.26 -5.05 121.20 118.47 2rpc s ILE 10 Ca 0.67 0.05 0.03 0.00 0.00 0.00 0.00 60.65 61.41 2rpc s ILE 10 Cb -0.07 -3.99 0.00 0.00 0.01 0.00 0.00 42.46 38.41 2rpc s ILE 10 CO 0.52 -0.31 -0.23 -1.59 0.00 0.00 0.00 174.94 173.33 2rpc s LYS 11 N 2.31 2.97 0.11 2.79 -2.85 -1.26 -5.12 119.74 118.69 2rpc s LYS 11 Ca 0.16 -0.85 -0.14 0.00 -1.00 0.00 0.00 55.97 54.15 2rpc s LYS 11 Cb -0.16 -2.30 -0.07 0.00 -2.06 0.00 0.00 37.83 33.24 2rpc s LYS 11 CO 0.14 0.10 0.50 -1.14 0.10 0.00 0.00 175.35 175.06 2rpc s GLN 12 N 0.53 3.94 -0.13 1.78 0.74 -1.26 -5.07 119.66 120.19 2rpc s GLN 12 Ca -0.15 0.43 -0.15 0.00 0.05 0.00 0.00 55.36 55.54 2rpc s GLN 12 Cb -0.17 -3.00 -0.05 0.00 1.10 0.00 0.00 33.01 30.90 2rpc s GLN 12 CO 0.05 0.53 0.36 -1.21 -0.55 0.00 0.00 175.29 174.47 2rpc s GLU 13 N -1.80 4.23 0.26 1.67 2.02 -1.26 -4.55 118.70 119.27 2rpc s GLU 13 Ca 0.35 0.25 0.05 0.00 0.02 0.00 0.00 54.97 55.64 2rpc s GLU 13 Cb -0.15 -3.40 -0.02 0.00 0.10 0.00 0.00 34.13 30.65 2rpc s GLU 13 CO 0.18 0.28 0.38 -0.51 0.02 0.00 0.00 175.26 175.61 2rpc s LEU 14 N 0.31 4.22 -0.09 1.80 1.43 -1.15 -4.96 118.68 120.24 2rpc s LEU 14 Ca 0.20 -0.00 0.02 0.00 -1.03 0.00 0.00 54.13 53.32 2rpc s LEU 14 Cb -0.14 -2.82 0.01 0.00 0.03 0.00 0.00 46.19 43.27 2rpc s LEU 14 CO 0.07 -0.16 -0.14 -0.44 0.23 0.00 0.00 176.35 175.91 2rpc s SER 15 N -4.03 2.17 -0.57 2.29 0.01 -1.26 -3.55 113.70 108.77 2rpc s SER 15 Ca 0.37 -0.37 -0.04 0.00 1.31 0.00 0.00 55.95 57.22 2rpc s SER 15 Cb -0.09 -0.98 0.15 0.00 0.21 0.00 0.00 66.02 65.30 2rpc s SER 15 CO 0.29 0.03 0.39 0.00 0.41 0.00 0.00 173.24 174.37 2rpc s LYS 17 N 0.38 3.11 -0.31 0.00 -0.14 -1.26 -2.39 119.74 119.13 2rpc s LYS 17 Ca 0.14 -1.38 -0.08 0.00 -1.36 0.00 0.00 55.97 53.29 2rpc s LYS 17 Cb -0.21 -4.31 0.01 0.00 -1.68 0.00 0.00 37.83 31.64 2rpc s LYS 17 CO -0.04 -1.56 0.11 -0.46 -0.76 0.00 0.00 175.35 172.64 2rpc s TRP 18 N 2.64 3.17 -0.29 3.18 -0.11 -1.26 -3.35 118.94 122.91 2rpc s TRP 18 Ca 0.14 -0.90 -0.04 0.00 1.22 0.00 0.00 56.10 56.51 2rpc s TRP 18 Cb -0.22 -2.29 0.02 0.00 -1.50 0.00 0.00 33.47 29.48 2rpc s TRP 18 CO 0.05 -0.56 0.03 0.42 -4.62 0.00 0.00 176.95 172.26 2rpc s ILE 19 N 1.53 3.46 0.02 5.86 1.01 -0.52 -1.00 121.20 131.57 2rpc s ILE 19 Ca 0.03 -0.95 -0.25 0.00 0.00 0.00 0.00 60.65 59.48 2rpc s ILE 19 Cb -0.17 -2.83 -0.05 0.00 0.01 0.00 0.00 42.46 39.42 2rpc s ILE 19 CO 0.04 0.06 0.78 -0.62 0.00 0.00 0.00 174.94 175.20 2rpc s ASP 20 N 1.40 7.20 0.07 3.58 2.15 -1.26 -4.44 116.67 125.37 2rpc s ASP 20 Ca 0.00 1.43 -0.14 0.00 0.43 0.00 0.00 52.55 54.27 2rpc s ASP 20 Cb -0.18 -2.47 -0.23 0.00 -0.30 0.00 0.00 42.92 39.74 2rpc s ASP 20 CO -0.00 -0.04 1.18 1.05 -0.17 0.00 0.00 175.17 177.19 2rpc h GLU 21 N 5.99 0.70 -0.98 4.34 4.11 -1.98 -3.18 114.58 123.56 2rpc h GLU 21 Ca -0.43 -0.75 -0.13 0.00 0.07 0.00 0.00 59.36 58.12 2rpc h GLU 21 Cb 1.21 0.21 -0.08 0.00 0.50 0.00 0.00 28.75 30.59 2rpc h GLU 21 CO 0.72 1.32 0.17 0.00 0.07 0.00 0.00 179.01 181.29 2rpc n ALA 22 N -2.65 3.34 -2.01 1.06 0.00 -1.26 -4.90 120.51 114.09 2rpc n ALA 22 Ca -0.11 -0.81 -0.40 0.00 0.00 0.00 0.00 53.44 52.12 2rpc n ALA 22 Cb 0.88 -1.12 -0.05 0.00 0.00 0.00 0.00 19.45 19.16 2rpc n ALA 22 CO 0.00 0.00 0.00 1.14 0.00 0.00 0.00 177.50 178.64 2rpc s GLN 23 N -1.05 4.75 0.00 0.00 -2.07 -1.21 -4.94 119.66 115.14 2rpc s GLN 23 Ca 0.17 1.43 0.26 0.00 -1.82 0.00 0.00 55.36 55.40 2rpc s GLN 23 Cb 0.14 -3.32 0.79 0.00 -1.09 0.00 0.00 33.01 29.53 2rpc s GLN 23 CO 0.03 0.39 1.60 -0.11 -1.32 0.00 0.00 175.29 175.88 2rpc n LEU 24 N 2.09 1.94 -4.70 2.60 0.00 -1.26 -4.87 117.00 112.81 2rpc n LEU 24 Ca -0.01 -0.67 -0.38 0.00 0.00 0.00 0.00 56.01 54.96 2rpc n LEU 24 Cb 0.48 -0.01 -0.07 0.00 0.00 0.00 0.00 43.42 43.82 2rpc n LEU 24 CO 0.50 0.33 0.12 -0.44 0.00 0.00 0.00 177.39 177.90 2rpc s SER 25 N -1.96 6.54 -0.01 1.96 0.01 -1.26 -5.07 113.70 113.91 2rpc s SER 25 Ca 0.35 0.64 0.04 0.00 1.31 0.00 0.00 55.95 58.30 2rpc s SER 25 Cb 0.21 -2.25 -0.01 0.00 0.21 0.00 0.00 66.02 64.18 2rpc s SER 25 CO 0.32 -0.03 -0.15 -0.60 0.41 0.00 0.00 173.24 173.20 2rpc s ARG 26 N 0.92 1.18 0.91 12.44 6.06 -1.26 -3.56 118.95 135.65 2rpc s ARG 26 Ca 0.22 -0.52 -0.12 0.00 -2.50 0.00 0.00 55.73 52.81 2rpc s ARG 26 Cb -0.15 -1.14 0.13 0.00 0.06 0.00 0.00 34.95 33.85 2rpc s ARG 26 CO 0.08 0.31 1.09 -1.25 -2.50 0.00 0.00 175.30 173.04 2rpc s PRO 27 N -0.34 1.17 -0.24 5.12 0.04 -1.26 -5.03 135.00 134.46 2rpc s PRO 27 Ca 0.06 0.78 -0.38 0.00 0.04 0.00 0.00 61.00 61.50 2rpc s PRO 27 Cb -0.06 -1.80 -0.14 0.00 0.04 0.00 0.00 34.50 32.54 2rpc s PRO 27 CO -0.01 -2.29 1.84 1.63 0.04 0.00 0.00 177.00 178.21 2rpc n LYS 28 N -3.91 1.44 -4.05 4.56 4.76 -1.23 -4.95 118.16 114.77 2rpc n LYS 28 Ca 0.07 0.52 -0.28 0.00 -2.87 0.00 0.00 58.31 55.74 2rpc n LYS 28 Cb 0.55 -2.29 -0.06 0.00 -1.84 0.00 0.00 35.03 31.39 2rpc n LYS 28 CO 0.00 0.00 0.00 0.15 -1.37 0.00 0.00 177.40 176.18 2rpc s LYS 29 N 4.01 2.94 0.32 1.97 1.02 -1.26 -5.10 119.74 123.65 2rpc s LYS 29 Ca 0.98 -0.75 0.07 0.00 0.02 0.00 0.00 55.97 56.29 2rpc s LYS 29 Cb -0.94 -2.72 -0.03 0.00 -0.52 0.00 0.00 37.83 33.62 2rpc s LYS 29 CO 0.60 0.53 0.30 -1.54 -0.92 0.00 0.00 175.35 174.33 2rpc s SER 30 N -2.75 5.47 0.13 2.83 1.04 -1.26 -4.42 113.70 114.74 2rpc s SER 30 Ca 0.31 -0.38 -0.29 0.00 0.48 0.00 0.00 55.95 56.07 2rpc s SER 30 Cb -0.11 -1.13 -0.06 0.00 0.10 0.00 0.00 66.02 64.82 2rpc s SER 30 CO 0.23 -0.30 1.59 0.00 0.98 0.00 0.00 173.24 175.75 2rpc n ASP 32 N -5.44 -3.66 -4.51 0.00 8.00 -1.01 -4.94 116.55 104.99 2rpc n ASP 32 Ca -0.05 -0.34 -0.28 0.00 0.71 0.00 0.00 54.79 54.83 2rpc n ASP 32 Cb 0.36 -2.83 -0.11 0.00 -0.02 0.00 0.00 41.12 38.52 2rpc n ASP 32 CO 0.00 0.00 0.00 -0.60 -0.39 0.00 0.00 177.20 176.21 2rpc s ARG 33 N -3.97 1.87 0.22 -1.24 6.06 -1.17 -4.97 118.95 115.73 2rpc s ARG 33 Ca 0.16 -1.25 0.04 0.00 -2.50 0.00 0.00 55.73 52.18 2rpc s ARG 33 Cb -0.02 -2.10 -0.05 0.00 0.06 0.00 0.00 34.95 32.84 2rpc s ARG 33 CO 0.37 0.45 -0.04 0.95 -2.50 0.00 0.00 175.30 174.53 2rpc s THR 34 N -1.43 1.18 0.21 4.11 -4.23 -1.26 -1.22 115.64 113.00 2rpc s THR 34 Ca 0.21 -2.06 -0.14 0.00 -1.18 0.00 0.00 61.69 58.52 2rpc s THR 34 Cb -0.10 -2.24 0.01 0.00 1.34 0.00 0.00 72.50 71.52 2rpc s THR 34 CO 0.12 -0.42 0.47 -0.36 -0.54 0.00 0.00 174.62 173.89 2rpc s PHE 35 N -3.32 0.13 -0.18 3.99 0.40 -1.23 -4.97 117.98 112.80 2rpc s PHE 35 Ca 0.26 -0.50 0.12 0.00 -0.60 0.00 0.00 56.93 56.22 2rpc s PHE 35 Cb 0.04 0.26 -0.23 0.00 0.51 0.00 0.00 43.02 43.60 2rpc s PHE 35 CO 0.07 -0.92 0.15 0.43 0.70 0.00 0.00 175.22 175.65 2rpc n SER 36 N -0.33 0.68 -4.43 1.36 7.64 -1.26 -2.92 113.62 114.35 2rpc n SER 36 Ca -0.06 0.07 -0.21 0.00 1.01 0.00 0.00 58.87 59.67 2rpc n SER 36 Cb 0.62 0.41 -0.10 0.00 -1.01 0.00 0.00 64.21 64.13 2rpc n SER 36 CO 0.00 0.00 0.00 0.42 -3.01 0.00 0.00 175.04 172.45 2rpc s THR 37 N -2.52 1.58 0.03 0.44 -4.23 -1.26 -4.27 115.64 105.41 2rpc s THR 37 Ca -0.14 -2.11 -0.27 0.00 -1.18 0.00 0.00 61.69 57.99 2rpc s THR 37 Cb 0.07 -2.48 -0.17 0.00 1.34 0.00 0.00 72.50 71.27 2rpc s THR 37 CO 0.78 -0.28 1.33 -0.03 -0.54 0.00 0.00 174.62 175.88 2rpc h MET 38 N 2.27 -0.56 -1.34 3.99 4.05 -1.94 -2.87 114.93 118.53 2rpc h MET 38 Ca -0.40 0.04 0.40 0.00 -0.28 0.00 0.00 59.70 59.46 2rpc h MET 38 Cb 1.23 0.13 -0.10 0.00 -0.80 0.00 0.00 31.60 32.06 2rpc h MET 38 CO 0.67 -0.27 0.90 1.25 0.23 0.00 0.00 176.91 179.70 2rpc h HIS 39 N -0.83 0.37 -0.44 1.39 -0.00 -1.99 1.05 115.15 114.70 2rpc h HIS 39 Ca -0.06 0.02 -0.11 0.00 -0.00 0.00 0.00 60.37 60.21 2rpc h HIS 39 Cb 0.55 -0.10 -0.02 0.00 -0.00 0.00 0.00 27.41 27.85 2rpc h HIS 39 CO 0.00 -0.08 -0.17 0.93 -0.00 0.00 0.00 177.93 178.62 2rpc h GLU 40 N 0.12 0.85 -0.17 5.26 5.08 -1.93 -1.34 114.58 122.44 2rpc h GLU 40 Ca 0.74 -0.32 -0.20 0.00 -1.00 0.00 0.00 59.36 58.57 2rpc h GLU 40 Cb 2.48 -0.05 0.00 0.00 0.50 0.00 0.00 28.75 31.68 2rpc h GLU 40 CO -0.25 0.96 -0.70 1.25 -1.00 0.00 0.00 179.01 179.26 2rpc h LEU 41 N 0.75 0.86 0.55 1.33 5.85 0.12 -2.87 115.31 121.90 2rpc h LEU 41 Ca 0.11 -0.53 -0.03 0.00 0.84 0.00 0.00 57.88 58.28 2rpc h LEU 41 Cb 0.69 -0.25 0.01 0.00 0.37 0.00 0.00 40.66 41.47 2rpc h LEU 41 CO 0.05 1.31 -0.27 0.58 -0.34 0.00 0.00 178.44 179.78 2rpc h VAL 42 N 0.52 0.31 -0.53 1.05 2.07 -1.08 0.24 116.25 118.83 2rpc h VAL 42 Ca -0.03 -0.37 0.15 0.00 0.82 0.00 0.00 66.70 67.28 2rpc h VAL 42 Cb 1.31 0.42 -0.02 0.00 -1.52 0.00 0.00 31.29 31.48 2rpc h VAL 42 CO 0.14 0.04 0.45 0.74 0.02 0.00 0.00 177.57 178.96 2rpc h THR 43 N -1.02 0.54 0.00 2.57 2.02 -1.35 0.21 112.91 115.88 2rpc h THR 43 Ca -0.08 0.00 0.00 0.00 0.77 0.00 0.00 66.41 67.10 2rpc h THR 43 Cb 0.64 0.67 0.00 0.00 -1.74 0.00 0.00 68.15 67.72 2rpc h THR 43 CO 0.12 0.00 -0.10 -0.74 0.37 0.00 0.00 175.52 175.18 2rpc h HIS 44 N 0.00 0.00 -0.13 3.16 -0.00 -1.32 -0.38 115.15 116.49 2rpc h HIS 44 Ca 0.25 0.00 0.04 0.00 -0.00 0.00 0.00 60.37 60.66 2rpc h HIS 44 Cb 1.15 0.00 -0.01 0.00 -0.00 0.00 0.00 27.41 28.55 2rpc h HIS 44 CO 0.00 0.00 0.34 0.28 -0.00 0.00 0.00 177.93 178.55 2rpc h VAL 45 N -0.71 0.14 0.00 5.26 2.07 -0.27 2.30 116.25 125.04 2rpc h VAL 45 Ca 0.00 0.00 -0.11 0.00 0.82 0.00 0.00 66.70 67.41 2rpc h VAL 45 Cb 0.10 0.69 -0.02 0.00 -1.52 0.00 0.00 31.29 30.54 2rpc h VAL 45 CO 0.00 0.00 -1.02 0.41 0.02 0.00 0.00 177.57 176.98 2rpc n THR 46 N -3.20 1.47 -0.10 2.57 -1.04 0.71 -1.79 114.28 112.91 2rpc n THR 46 Ca 0.01 0.08 -0.20 0.00 -2.04 0.00 0.00 64.05 61.90 2rpc n THR 46 Cb 0.43 -2.24 -0.12 0.00 -1.82 0.00 0.00 70.33 66.58 2rpc n THR 46 CO 0.00 0.00 0.00 0.24 -0.64 0.00 0.00 175.07 174.67 2rpc h MET 47 N -1.00 0.00 0.00 -2.82 2.86 -0.68 2.03 114.93 115.32 2rpc h MET 47 Ca -0.17 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.47 2rpc h MET 47 Cb 0.92 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.58 2rpc h MET 47 CO -0.10 1.00 0.00 0.39 1.06 0.00 0.00 176.91 179.26 2rpc n GLU 48 N -4.48 0.53 0.00 1.72 -0.58 0.74 -2.32 120.64 116.25 2rpc n GLU 48 Ca -0.26 0.00 0.00 0.00 -0.42 0.00 0.00 57.16 56.48 2rpc n GLU 48 Cb 0.63 -1.34 0.00 0.00 -0.57 0.00 0.00 31.44 30.16 2rpc n GLU 48 CO 0.00 0.00 0.00 0.72 -0.48 0.00 0.00 177.13 177.37 2rpc n HIS 49 N -0.84 -0.15 0.80 -0.32 8.25 0.77 -4.81 115.22 118.92 2rpc n HIS 49 Ca 0.09 0.00 0.07 0.00 -0.26 0.00 0.00 57.72 57.62 2rpc n HIS 49 Cb 0.04 0.30 0.40 0.00 1.12 0.00 0.00 29.99 31.85 2rpc n HIS 49 CO 0.00 0.00 0.00 0.28 0.64 0.00 0.00 176.34 177.26 2rpc n VAL 50 N -1.89 0.31 -2.93 1.59 0.31 0.45 -4.95 118.33 111.23 2rpc n VAL 50 Ca 0.00 0.08 0.03 0.00 -0.01 0.00 0.00 64.34 64.44 2rpc n VAL 50 Cb 0.00 -0.84 -0.01 0.00 -0.91 0.00 0.00 33.84 32.08 2rpc n VAL 50 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 2rpc n GLY 51 N -0.07 -1.85 0.00 2.92 0.00 0.66 -4.83 105.19 102.02 2rpc n GLY 51 Ca 0.09 -1.32 0.00 0.00 0.00 0.00 0.00 46.02 44.79 2rpc n GLY 51 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2rpc n GLY 52 N -0.83 3.28 0.00 -0.02 0.00 -1.26 -3.43 105.19 102.93 2rpc n GLY 52 Ca 0.00 -2.04 0.07 0.00 0.00 0.00 0.00 46.02 44.05 2rpc n GLY 52 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 2rpc n PRO 53 N -0.05 0.49 -0.22 1.61 -0.04 -1.26 -1.92 135.00 133.61 2rpc n PRO 53 Ca 0.00 0.00 0.09 0.00 -0.04 0.00 0.00 63.50 63.55 2rpc n PRO 53 Cb 0.00 -1.46 0.21 0.00 -0.04 0.00 0.00 33.50 32.21 2rpc n PRO 53 CO 0.00 0.00 0.00 0.39 -0.04 0.00 0.00 175.50 175.85 2rpc n GLU 54 N -0.96 2.48 -3.16 0.54 -0.58 -1.26 -4.97 120.64 112.73 2rpc n GLU 54 Ca 0.11 -2.22 -0.35 0.00 -0.42 0.00 0.00 57.16 54.28 2rpc n GLU 54 Cb 0.05 -1.43 -0.06 0.00 -0.57 0.00 0.00 31.44 29.43 2rpc n GLU 54 CO 0.00 0.00 0.00 -1.14 -0.48 0.00 0.00 177.13 175.51 2rpc s GLN 55 N -1.15 4.13 0.00 3.49 2.00 -0.81 -5.04 119.66 122.28 2rpc s GLN 55 Ca 0.35 0.74 0.00 0.00 -2.00 0.00 0.00 55.36 54.44 2rpc s GLN 55 Cb 0.19 -2.75 0.00 0.00 0.80 0.00 0.00 33.01 31.25 2rpc s GLN 55 CO 0.26 0.34 0.00 0.27 -0.50 0.00 0.00 175.29 175.66 2rpc n ASN 56 N 0.40 0.00 -4.38 6.67 6.94 -1.26 -4.81 115.26 118.82 2rpc n ASN 56 Ca -0.01 0.21 -0.45 0.00 -0.02 0.00 0.00 54.58 54.31 2rpc n ASN 56 Cb 0.52 -0.41 -0.05 0.00 -2.36 0.00 0.00 39.78 37.48 2rpc n ASN 56 CO 0.00 0.00 0.00 0.21 -1.03 0.00 0.00 177.26 176.44 2rpc s ASN 57 N -3.07 6.19 -0.42 0.53 2.47 -1.26 -5.02 114.94 114.36 2rpc s ASN 57 Ca 0.00 -1.40 -0.21 0.00 0.42 0.00 0.00 52.86 51.67 2rpc s ASN 57 Cb 0.00 -2.29 0.02 0.00 -1.45 0.00 0.00 41.25 37.53 2rpc s ASN 57 CO 0.00 -1.06 0.68 -1.00 -3.72 0.00 0.00 177.10 172.00 2rpc s HIS 58 N 2.57 3.07 -0.02 0.43 3.76 -1.26 -5.03 115.29 118.82 2rpc s HIS 58 Ca 0.11 0.11 0.00 0.00 -0.15 0.00 0.00 55.06 55.14 2rpc s HIS 58 Cb -0.24 -3.37 0.02 0.00 1.11 0.00 0.00 32.58 30.10 2rpc s HIS 58 CO 0.07 -0.83 0.00 0.08 -0.85 0.00 0.00 174.74 173.21 2rpc s VAL 59 N 2.90 0.10 -0.28 -0.90 1.01 -1.26 -3.94 120.40 118.04 2rpc s VAL 59 Ca 0.25 0.08 -0.04 0.00 0.00 0.00 0.00 61.98 62.27 2rpc s VAL 59 Cb -0.14 -0.18 0.02 0.00 0.00 0.00 0.00 36.38 36.08 2rpc s VAL 59 CO 0.19 0.10 0.01 0.00 0.00 0.00 0.00 175.10 175.40 2rpc s TYR 61 N 1.39 3.52 0.16 0.00 1.51 -1.26 -4.58 117.35 118.09 2rpc s TYR 61 Ca 0.00 -2.40 -0.12 0.00 -1.01 0.00 0.00 57.07 53.54 2rpc s TYR 61 Cb -0.17 -3.27 -0.07 0.00 -0.11 0.00 0.00 41.96 38.34 2rpc s TYR 61 CO -0.01 -0.94 0.53 -0.46 -1.11 0.00 0.00 175.55 173.56 2rpc s TRP 62 N 0.85 3.55 0.53 2.71 -0.11 -1.26 -1.43 118.94 123.77 2rpc s TRP 62 Ca 0.10 0.97 0.28 0.00 1.22 0.00 0.00 56.10 58.67 2rpc s TRP 62 Cb -0.22 -2.31 0.96 0.00 -1.50 0.00 0.00 33.47 30.40 2rpc s TRP 62 CO -0.04 0.39 1.20 -1.91 -4.62 0.00 0.00 176.95 171.98 2rpc n GLU 63 N 0.52 0.01 -2.68 5.86 0.00 -1.21 -0.42 120.64 122.72 2rpc n GLU 63 Ca -0.04 0.92 -0.08 0.00 0.00 0.00 0.00 57.16 57.97 2rpc n GLU 63 Cb 0.52 -2.26 0.07 0.00 0.00 0.00 0.00 31.44 29.77 2rpc n GLU 63 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.13 177.52 2rpc n GLU 64 N -3.17 1.18 -3.08 5.31 -0.58 -1.26 -5.04 120.64 114.00 2rpc n GLU 64 Ca 0.25 -2.63 -0.39 0.00 -0.42 0.00 0.00 57.16 53.96 2rpc n GLU 64 Cb 1.46 -0.72 -0.05 0.00 -0.57 0.00 0.00 31.44 31.55 2rpc n GLU 64 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 2rpc h PRO 66 N 5.53 0.00 -0.12 0.00 0.13 -1.94 -2.88 132.00 132.72 2rpc h PRO 66 Ca -0.45 0.00 -0.09 0.00 -0.87 0.00 0.00 66.00 64.60 2rpc h PRO 66 Cb 1.20 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.32 2rpc h PRO 66 CO 0.70 0.00 -0.32 0.00 -0.23 0.00 0.00 178.00 178.15 2rpc h ARG 67 N 0.00 0.23 -0.76 0.86 2.47 -1.89 -3.46 114.38 111.83 2rpc h ARG 67 Ca 0.00 -0.09 -0.18 0.00 -1.26 0.00 0.00 59.98 58.46 2rpc h ARG 67 Cb 0.41 -0.01 -0.07 0.00 -1.65 0.00 0.00 29.97 28.65 2rpc h ARG 67 CO 0.00 0.53 -0.16 0.39 0.56 0.00 0.00 179.97 181.29 2rpc n GLU 68 N -4.11 -1.60 0.00 0.04 1.02 -1.09 0.06 120.64 114.96 2rpc n GLU 68 Ca -0.01 0.66 0.00 0.00 -0.02 0.00 0.00 57.16 57.78 2rpc n GLU 68 Cb 0.41 -4.78 0.00 0.00 -0.02 0.00 0.00 31.44 27.05 2rpc n GLU 68 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 2rpc n GLY 69 N 0.13 1.41 3.48 0.62 0.00 -1.26 -5.06 105.19 104.51 2rpc n GLY 69 Ca -0.09 0.00 -0.45 0.00 0.00 0.00 0.00 46.02 45.48 2rpc n GLY 69 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2rpc n LYS 70 N -0.02 0.81 -0.86 1.61 4.01 0.11 -4.80 118.16 119.01 2rpc n LYS 70 Ca 0.00 0.15 -0.23 0.00 -0.51 0.00 0.00 58.31 57.72 2rpc n LYS 70 Cb 0.00 -2.47 0.19 0.00 -0.51 0.00 0.00 35.03 32.23 2rpc n LYS 70 CO 0.00 0.00 0.00 0.43 -1.11 0.00 0.00 177.40 176.72 2rpc n SER 71 N 11.46 -1.64 -4.84 4.39 7.64 -1.26 -4.87 113.62 124.51 2rpc n SER 71 Ca 0.46 -1.04 -0.28 0.00 1.01 0.00 0.00 58.87 59.01 2rpc n SER 71 Cb 0.26 -0.76 -0.04 0.00 -1.01 0.00 0.00 64.21 62.66 2rpc n SER 71 CO 0.00 0.00 0.00 -0.36 -3.01 0.00 0.00 175.04 171.67 2rpc s PHE 72 N -2.58 1.80 -0.90 1.43 0.40 -1.25 -5.05 117.98 111.82 2rpc s PHE 72 Ca 0.54 -0.86 0.20 0.00 -0.60 0.00 0.00 56.93 56.22 2rpc s PHE 72 Cb -0.05 -1.81 -0.23 0.00 0.51 0.00 0.00 43.02 41.44 2rpc s PHE 72 CO 0.41 -0.17 0.84 1.63 0.70 0.00 0.00 175.22 178.63 2rpc n LYS 73 N -1.54 0.27 -3.79 0.44 4.76 -1.26 -4.95 118.16 112.09 2rpc n LYS 73 Ca -0.08 -0.01 -0.12 0.00 -2.87 0.00 0.00 58.31 55.23 2rpc n LYS 73 Cb 0.65 -1.47 -0.08 0.00 -1.84 0.00 0.00 35.03 32.29 2rpc n LYS 73 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 2rpc s ALA 74 N -2.97 -0.59 0.04 7.82 0.00 -1.26 -5.06 121.76 119.75 2rpc s ALA 74 Ca 0.07 -0.02 -0.27 0.00 0.00 0.00 0.00 51.96 51.74 2rpc s ALA 74 Cb 0.15 0.24 -0.17 0.00 0.00 0.00 0.00 23.12 23.34 2rpc s ALA 74 CO 0.84 -0.35 1.45 -0.22 0.00 0.00 0.00 175.76 177.48 2rpc h LYS 75 N 3.49 -0.49 -0.68 0.00 1.63 -1.99 -1.90 116.57 116.64 2rpc h LYS 75 Ca -0.31 0.03 0.11 0.00 -0.85 0.00 0.00 60.65 59.63 2rpc h LYS 75 Cb 1.19 0.11 -0.04 0.00 -0.60 0.00 0.00 32.23 32.89 2rpc h LYS 75 CO 0.45 -0.23 0.45 0.10 -3.45 0.00 0.00 179.45 176.77 2rpc h TYR 76 N -0.68 0.53 -0.16 1.91 -0.00 -1.99 0.59 116.97 117.17 2rpc h TYR 76 Ca -0.05 0.01 -0.11 0.00 0.00 0.00 0.00 58.73 58.58 2rpc h TYR 76 Cb 0.48 -0.17 -0.01 0.00 0.00 0.00 0.00 36.73 37.03 2rpc h TYR 76 CO -0.01 0.24 -0.38 -0.22 -0.00 0.00 0.00 178.16 177.79 2rpc h LYS 77 N 0.49 0.36 0.04 0.10 1.63 -1.93 -2.50 116.57 114.77 2rpc h LYS 77 Ca 0.32 -0.16 -0.18 0.00 -0.85 0.00 0.00 60.65 59.77 2rpc h LYS 77 Cb 0.58 -0.01 0.02 0.00 -0.60 0.00 0.00 32.23 32.22 2rpc h LYS 77 CO -0.10 0.69 -0.73 1.25 -3.45 0.00 0.00 179.45 177.11 2rpc h LEU 78 N 0.30 0.57 -0.05 5.20 5.85 -0.16 -3.25 115.31 123.77 2rpc h LEU 78 Ca 0.03 -0.81 0.03 0.00 0.84 0.00 0.00 57.88 57.97 2rpc h LEU 78 Cb 0.81 -0.18 -0.03 0.00 0.37 0.00 0.00 40.66 41.63 2rpc h LEU 78 CO 0.06 1.31 -0.12 0.58 -0.34 0.00 0.00 178.44 179.94 2rpc h VAL 79 N -0.11 0.69 -0.91 1.05 2.07 -0.95 -1.41 116.25 116.68 2rpc h VAL 79 Ca -0.10 0.00 0.22 0.00 0.82 0.00 0.00 66.70 67.64 2rpc h VAL 79 Cb 1.46 0.69 -0.06 0.00 -1.52 0.00 0.00 31.29 31.86 2rpc h VAL 79 CO 0.14 0.00 0.61 0.78 0.02 0.00 0.00 177.57 179.13 2rpc h ASN 80 N -0.18 0.31 -0.42 0.57 2.35 -1.56 0.14 115.58 116.80 2rpc h ASN 80 Ca 0.06 0.04 -0.14 0.00 -0.55 0.00 0.00 56.30 55.71 2rpc h ASN 80 Cb 0.26 -0.02 -0.01 0.00 0.05 0.00 0.00 38.32 38.60 2rpc h ASN 80 CO -0.15 0.11 -0.27 -0.74 -1.65 0.00 0.00 177.43 174.72 2rpc h HIS 81 N 0.30 1.10 0.00 1.19 -0.00 -1.30 -2.61 115.15 113.82 2rpc h HIS 81 Ca 0.47 -0.28 0.00 0.00 -0.00 0.00 0.00 60.37 60.56 2rpc h HIS 81 Cb 1.34 -0.25 0.00 0.00 -0.00 0.00 0.00 27.41 28.50 2rpc h HIS 81 CO -0.00 1.10 0.00 0.82 -0.00 0.00 0.00 177.93 179.85 2rpc h ILE 82 N 0.80 0.00 0.00 6.26 2.04 -0.26 -1.88 117.51 124.47 2rpc h ILE 82 Ca 0.09 -0.15 -0.01 0.00 1.00 0.00 0.00 64.86 65.79 2rpc h ILE 82 Cb 0.85 0.87 -0.00 0.00 -0.74 0.00 0.00 36.82 37.80 2rpc h ILE 82 CO 0.07 0.00 -0.04 0.03 0.00 0.00 0.00 178.15 178.22 2rpc h ARG 83 N 0.00 0.00 0.00 2.37 2.47 -1.16 -2.09 114.38 115.97 2rpc h ARG 83 Ca 0.00 0.00 -0.04 0.00 -1.26 0.00 0.00 59.98 58.68 2rpc h ARG 83 Cb 0.20 0.00 -0.01 0.00 -1.65 0.00 0.00 29.97 28.52 2rpc h ARG 83 CO 0.00 0.04 -0.25 -0.39 0.56 0.00 0.00 179.97 179.93 2rpc h VAL 84 N 0.00 0.27 0.00 2.04 -1.51 -1.49 -2.37 116.25 113.19 2rpc h VAL 84 Ca -0.00 -1.39 0.00 0.00 -1.23 0.00 0.00 66.70 64.08 2rpc h VAL 84 Cb 0.40 2.10 0.00 0.00 -2.13 0.00 0.00 31.29 31.66 2rpc h VAL 84 CO 0.00 0.16 0.00 1.41 -1.23 0.00 0.00 177.57 177.91 2rpc n HIS 85 N -3.11 0.00 0.02 5.19 8.25 -0.79 -4.23 115.22 120.55 2rpc n HIS 85 Ca 0.03 0.00 -0.01 0.00 -0.26 0.00 0.00 57.72 57.48 2rpc n HIS 85 Cb 0.60 -0.23 -0.00 0.00 1.12 0.00 0.00 29.99 31.48 2rpc n HIS 85 CO 0.00 0.00 0.00 0.25 0.64 0.00 0.00 176.34 177.23 2rpc n THR 86 N -1.23 0.66 0.00 1.59 -2.24 -1.19 -5.06 114.28 106.81 2rpc n THR 86 Ca 0.15 0.22 0.00 0.00 -2.27 0.00 0.00 64.05 62.15 2rpc n THR 86 Cb 0.19 -1.39 0.00 0.00 -2.10 0.00 0.00 70.33 67.03 2rpc n THR 86 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2rpc n GLY 87 N 3.22 0.38 3.70 3.38 0.00 -0.91 -5.15 105.19 109.82 2rpc n GLY 87 Ca -0.01 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.70 2rpc n GLY 87 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 2rpc s GLU 88 N 0.00 2.65 0.09 1.61 2.12 -1.13 -5.08 118.70 118.96 2rpc s GLU 88 Ca 0.00 -0.77 -0.06 0.00 0.36 0.00 0.00 54.97 54.50 2rpc s GLU 88 Cb 0.00 -2.60 -0.05 0.00 0.26 0.00 0.00 34.13 31.74 2rpc s GLU 88 CO 0.00 0.56 0.35 0.21 -0.54 0.00 0.00 175.26 175.84 2rpc s LYS 89 N -2.17 3.64 -0.02 4.30 2.47 -1.26 -4.68 119.74 122.02 2rpc s LYS 89 Ca 0.25 -0.02 -0.25 0.00 -1.56 0.00 0.00 55.97 54.39 2rpc s LYS 89 Cb -0.12 -2.95 -0.19 0.00 -1.46 0.00 0.00 37.83 33.12 2rpc s LYS 89 CO 0.17 0.54 1.19 -1.00 0.16 0.00 0.00 175.35 176.41 2rpc h PRO 90 N 3.35 -0.12 -2.41 4.03 0.13 -1.86 -3.46 132.00 131.67 2rpc h PRO 90 Ca -0.48 0.01 -0.06 0.00 -0.87 0.00 0.00 66.00 64.60 2rpc h PRO 90 Cb 1.18 0.03 -0.26 0.00 0.13 0.00 0.00 31.00 32.08 2rpc h PRO 90 CO 0.69 0.32 -0.29 -0.59 -0.23 0.00 0.00 178.00 177.91 2rpc s PHE 91 N -4.18 -0.89 0.00 1.56 -0.71 -1.26 -5.16 117.98 107.34 2rpc s PHE 91 Ca -0.15 1.68 0.00 0.00 -1.04 0.00 0.00 56.93 57.42 2rpc s PHE 91 Cb 0.02 0.41 0.00 0.00 -1.21 0.00 0.00 43.02 42.24 2rpc s PHE 91 CO 0.61 -0.50 0.00 -0.35 -1.34 0.00 0.00 175.22 173.64 2rpc n PRO 92 N 5.16 -0.18 -3.22 1.99 -0.04 -1.26 -4.09 135.00 133.36 2rpc n PRO 92 Ca -0.12 0.00 -0.39 0.00 -0.04 0.00 0.00 63.50 62.95 2rpc n PRO 92 Cb 0.51 0.00 -0.06 0.00 -0.04 0.00 0.00 33.50 33.91 2rpc n PRO 92 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2rpc h PRO 94 N 6.47 0.00 -6.64 0.00 0.13 -1.95 -3.43 132.00 126.59 2rpc h PRO 94 Ca -0.42 0.00 -0.53 0.00 -0.87 0.00 0.00 66.00 64.18 2rpc h PRO 94 Cb 1.19 0.00 0.03 0.00 0.13 0.00 0.00 31.00 32.35 2rpc h PRO 94 CO 0.74 0.00 0.70 0.12 -0.23 0.00 0.00 178.00 179.33 2rpc s PHE 95 N -3.35 3.22 -0.02 1.56 2.19 -1.26 -4.96 117.98 115.37 2rpc s PHE 95 Ca 0.04 1.09 -0.23 0.00 0.33 0.00 0.00 56.93 58.15 2rpc s PHE 95 Cb 0.09 -3.66 -0.17 0.00 -1.31 0.00 0.00 43.02 37.97 2rpc s PHE 95 CO 0.40 -2.19 1.09 -1.00 1.83 0.00 0.00 175.22 175.34 2rpc h PRO 96 N 5.89 -0.26 -1.81 10.12 0.13 -2.03 -3.17 132.00 140.88 2rpc h PRO 96 Ca -0.44 0.02 -0.16 0.00 -0.87 0.00 0.00 66.00 64.55 2rpc h PRO 96 Cb 1.21 0.06 -0.07 0.00 0.13 0.00 0.00 31.00 32.34 2rpc h PRO 96 CO 0.81 0.12 0.16 0.41 -0.23 0.00 0.00 178.00 179.28 2rpc n GLY 97 N 0.14 3.24 1.79 1.56 0.00 -1.26 -3.93 105.19 106.73 2rpc n GLY 97 Ca -0.09 -0.57 0.00 0.00 0.00 0.00 0.00 46.02 45.37 2rpc n GLY 97 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2rpc n GLY 99 N 1.88 1.70 3.84 0.00 0.00 -1.20 -4.94 105.19 106.47 2rpc n GLY 99 Ca 0.00 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.70 2rpc n GLY 99 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 2rpc s LYS 100 N -3.50 4.05 0.06 1.61 2.47 -1.26 -4.85 119.74 118.32 2rpc s LYS 100 Ca 0.00 0.83 0.05 0.00 -1.56 0.00 0.00 55.97 55.30 2rpc s LYS 100 Cb 0.00 -2.31 -0.03 0.00 -1.46 0.00 0.00 37.83 34.03 2rpc s LYS 100 CO 0.00 0.03 -0.15 0.42 0.16 0.00 0.00 175.35 175.81 2rpc s ILE 101 N -2.15 1.20 -0.03 5.43 1.01 -1.26 0.14 121.20 125.53 2rpc s ILE 101 Ca 0.57 -1.16 0.02 0.00 0.00 0.00 0.00 60.65 60.09 2rpc s ILE 101 Cb -0.10 -1.10 0.00 0.00 0.01 0.00 0.00 42.46 41.28 2rpc s ILE 101 CO 0.19 -0.06 -0.09 -0.36 0.00 0.00 0.00 174.94 174.61 2rpc s PHE 102 N -1.01 1.00 -0.79 3.97 0.40 -1.26 -4.94 117.98 115.34 2rpc s PHE 102 Ca 0.01 -0.26 0.26 0.00 -0.60 0.00 0.00 56.93 56.34 2rpc s PHE 102 Cb -0.09 -0.72 0.63 0.00 0.51 0.00 0.00 43.02 43.35 2rpc s PHE 102 CO 0.02 -0.12 1.54 0.00 0.70 0.00 0.00 175.22 177.36 2rpc n ALA 103 N 3.35 2.81 -2.94 5.36 0.00 -1.26 -4.37 120.51 123.46 2rpc n ALA 103 Ca -0.19 -0.19 -0.34 0.00 0.00 0.00 0.00 53.44 52.72 2rpc n ALA 103 Cb 0.54 -1.28 -0.12 0.00 0.00 0.00 0.00 19.45 18.59 2rpc n ALA 103 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.50 178.53 2rpc s ARG 104 N -3.09 3.53 0.10 0.00 0.52 -1.26 -4.77 118.95 113.98 2rpc s ARG 104 Ca 0.09 -0.55 -0.21 0.00 -0.52 0.00 0.00 55.73 54.54 2rpc s ARG 104 Cb 0.15 -2.83 -0.10 0.00 0.52 0.00 0.00 34.95 32.69 2rpc s ARG 104 CO 0.66 0.28 1.71 0.77 0.02 0.00 0.00 175.30 178.74 2rpc h SER 105 N 6.54 0.17 -0.23 0.23 0.02 -1.98 -1.79 113.55 116.51 2rpc h SER 105 Ca -0.32 -0.07 0.07 0.00 -0.84 0.00 0.00 61.79 60.63 2rpc h SER 105 Cb 1.19 -0.04 -0.01 0.00 0.14 0.00 0.00 62.40 63.68 2rpc h SER 105 CO 0.60 0.19 0.17 -0.08 -1.14 0.00 0.00 176.83 176.57 2rpc h GLU 106 N 0.14 0.01 0.13 3.45 4.57 -1.98 0.58 114.58 121.49 2rpc h GLU 106 Ca 0.05 -0.00 -0.01 0.00 -1.18 0.00 0.00 59.36 58.22 2rpc h GLU 106 Cb 0.05 -0.00 0.00 0.00 -0.16 0.00 0.00 28.75 28.64 2rpc h GLU 106 CO -0.01 0.01 -0.06 -0.91 -1.18 0.00 0.00 179.01 176.86 2rpc h ASN 107 N 0.01 -0.15 0.32 1.04 -0.26 -1.82 -2.51 115.58 112.21 2rpc h ASN 107 Ca 0.11 -0.40 -0.02 0.00 -0.56 0.00 0.00 56.30 55.43 2rpc h ASN 107 Cb 0.43 0.04 0.00 0.00 -1.06 0.00 0.00 38.32 37.73 2rpc h ASN 107 CO -0.00 0.40 -0.16 0.25 -1.06 0.00 0.00 177.43 176.86 2rpc h LEU 108 N -0.78 -0.37 -1.58 1.61 5.85 -0.92 0.54 115.31 119.65 2rpc h LEU 108 Ca -0.02 -0.03 0.19 0.00 0.84 0.00 0.00 57.88 58.86 2rpc h LEU 108 Cb 0.54 0.09 -0.06 0.00 0.37 0.00 0.00 40.66 41.61 2rpc h LEU 108 CO 0.03 -0.21 0.56 0.07 -0.34 0.00 0.00 178.44 178.55 2rpc h LYS 109 N -0.50 0.36 0.00 1.25 2.10 -1.02 0.58 116.57 119.33 2rpc h LYS 109 Ca -0.04 -0.02 -0.22 0.00 -2.00 0.00 0.00 60.65 58.36 2rpc h LYS 109 Cb 0.38 -0.08 -0.04 0.00 -0.90 0.00 0.00 32.23 31.59 2rpc h LYS 109 CO 0.07 0.24 -1.22 0.82 -2.00 0.00 0.00 179.45 177.36 2rpc h ILE 110 N 0.37 1.23 0.00 0.07 2.04 -1.02 -3.22 117.51 116.97 2rpc h ILE 110 Ca 0.43 -2.93 -0.05 0.00 1.00 0.00 0.00 64.86 63.31 2rpc h ILE 110 Cb 1.09 2.59 -0.01 0.00 -0.74 0.00 0.00 36.82 39.75 2rpc h ILE 110 CO -0.14 0.70 -0.22 -0.74 0.00 0.00 0.00 178.15 177.75 2rpc h HIS 111 N 0.00 0.00 0.00 1.37 2.76 0.26 -3.13 115.15 116.41 2rpc h HIS 111 Ca -0.12 0.00 -0.18 0.00 -2.20 0.00 0.00 60.37 57.88 2rpc h HIS 111 Cb 1.80 0.00 -0.03 0.00 1.55 0.00 0.00 27.41 30.73 2rpc h HIS 111 CO 0.00 0.22 -0.84 0.87 -1.30 0.00 0.00 177.93 176.88 2rpc h LYS 112 N 0.00 0.00 0.00 5.26 1.57 -0.05 -3.26 116.57 120.09 2rpc h LYS 112 Ca -0.00 0.00 -0.20 0.00 -1.87 0.00 0.00 60.65 58.58 2rpc h LYS 112 Cb 1.14 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 33.44 2rpc h LYS 112 CO 0.03 0.84 -0.88 0.07 -0.57 0.00 0.00 179.45 178.93 2rpc h ARG 113 N 0.00 0.21 0.00 3.15 0.11 -1.56 -3.12 114.38 113.17 2rpc h ARG 113 Ca -0.01 -0.23 -0.02 0.00 0.10 0.00 0.00 59.98 59.82 2rpc h ARG 113 Cb 1.63 0.07 -0.00 0.00 1.11 0.00 0.00 29.97 32.77 2rpc h ARG 113 CO 0.11 0.96 -0.09 0.00 0.10 0.00 0.00 179.97 181.05 2rpc h THR 114 N 0.12 0.29 0.00 0.08 1.03 -1.59 -2.32 112.91 110.52 2rpc h THR 114 Ca -0.05 -0.63 0.00 0.00 -0.01 0.00 0.00 66.41 65.72 2rpc h THR 114 Cb 1.51 1.49 0.00 0.00 -1.07 0.00 0.00 68.15 70.08 2rpc h THR 114 CO 0.14 0.09 0.00 1.41 -0.01 0.00 0.00 175.52 177.15 2rpc n HIS 115 N -3.31 0.00 -1.73 0.00 8.25 -1.18 -4.74 115.22 112.51 2rpc n HIS 115 Ca -0.01 0.00 -0.30 0.00 -0.26 0.00 0.00 57.72 57.16 2rpc n HIS 115 Cb 0.30 -0.19 0.19 0.00 1.12 0.00 0.00 29.99 31.41 2rpc n HIS 115 CO 0.00 0.00 0.00 -0.08 0.64 0.00 0.00 176.34 176.90 2rpc s THR 116 N -2.38 1.91 0.00 1.59 -1.32 -0.87 -4.49 115.64 110.07 2rpc s THR 116 Ca 0.13 0.00 0.00 0.00 -1.21 0.00 0.00 61.69 60.61 2rpc s THR 116 Cb 0.08 -2.88 0.00 0.00 -1.51 0.00 0.00 72.50 68.19 2rpc s THR 116 CO 0.17 0.00 0.00 0.61 -2.21 0.00 0.00 174.62 173.19 2rpc n GLY 117 N -3.07 2.19 3.78 6.08 0.00 -1.26 -4.92 105.19 107.99 2rpc n GLY 117 Ca 0.14 -0.27 -0.39 0.00 0.00 0.00 0.00 46.02 45.50 2rpc n GLY 117 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 2rpc s GLU 118 N 0.00 4.41 0.05 1.61 -1.05 -1.26 -5.05 118.70 117.41 2rpc s GLU 118 Ca 0.00 0.95 0.05 0.00 -0.15 0.00 0.00 54.97 55.82 2rpc s GLU 118 Cb 0.00 -3.29 -0.04 0.00 -0.44 0.00 0.00 34.13 30.36 2rpc s GLU 118 CO 0.00 0.49 -0.07 0.15 0.95 0.00 0.00 175.26 176.78 2rpc s LYS 119 N -0.73 2.41 -0.02 -4.83 -0.14 -1.26 -5.03 119.74 110.13 2rpc s LYS 119 Ca 0.34 -0.85 -0.26 0.00 -1.36 0.00 0.00 55.97 53.84 2rpc s LYS 119 Cb -0.21 -2.44 -0.20 0.00 -1.68 0.00 0.00 37.83 33.31 2rpc s LYS 119 CO 0.22 0.56 1.24 -1.00 -0.76 0.00 0.00 175.35 175.61 2rpc h PRO 120 N 4.02 -0.04 -6.36 -1.68 0.13 -1.87 -3.42 132.00 122.79 2rpc h PRO 120 Ca -0.48 0.00 -0.54 0.00 -0.87 0.00 0.00 66.00 64.11 2rpc h PRO 120 Cb 1.17 0.01 -0.07 0.00 0.13 0.00 0.00 31.00 32.24 2rpc h PRO 120 CO 0.54 0.43 1.10 -0.06 -0.23 0.00 0.00 178.00 179.79 2rpc s PHE 121 N -4.23 2.25 -0.11 1.56 0.40 0.34 -4.88 117.98 113.31 2rpc s PHE 121 Ca -0.16 0.33 -0.03 0.00 -0.60 0.00 0.00 56.93 56.47 2rpc s PHE 121 Cb 0.02 -4.45 -0.03 0.00 0.51 0.00 0.00 43.02 39.06 2rpc s PHE 121 CO 0.65 -2.00 0.01 0.21 0.70 0.00 0.00 175.22 174.80 2rpc s LYS 122 N 5.69 3.21 0.08 0.44 2.20 -1.26 0.22 119.74 130.32 2rpc s LYS 122 Ca 0.47 -0.39 -0.31 0.00 -0.36 0.00 0.00 55.97 55.38 2rpc s LYS 122 Cb -0.10 -2.88 -0.16 0.00 -1.51 0.00 0.00 37.83 33.17 2rpc s LYS 122 CO 0.21 0.60 0.73 0.00 -0.36 0.00 0.00 175.35 176.53 2rpc n GLU 124 N 1.13 0.48 -2.29 0.00 0.28 -1.26 -4.85 120.64 114.13 2rpc n GLU 124 Ca 0.17 -0.18 -0.42 0.00 -0.16 0.00 0.00 57.16 56.57 2rpc n GLU 124 Cb 0.14 -1.50 -0.03 0.00 1.43 0.00 0.00 31.44 31.48 2rpc n GLU 124 CO 0.00 0.00 0.00 0.12 -0.16 0.00 0.00 177.13 177.09 2rpc s PHE 125 N -2.64 3.13 0.37 -1.84 2.19 -1.26 -4.98 117.98 112.94 2rpc s PHE 125 Ca 0.23 1.01 -0.27 0.00 0.33 0.00 0.00 56.93 58.24 2rpc s PHE 125 Cb 0.19 -3.58 -0.09 0.00 -1.31 0.00 0.00 43.02 38.23 2rpc s PHE 125 CO 0.52 -2.01 1.26 -2.00 1.83 0.00 0.00 175.22 174.82 2rpc s GLU 126 N 1.74 4.18 -0.85 10.12 2.12 -1.26 -2.77 118.70 131.98 2rpc s GLU 126 Ca 0.62 2.08 0.00 0.00 0.36 0.00 0.00 54.97 58.03 2rpc s GLU 126 Cb -0.31 -2.89 0.00 0.00 0.26 0.00 0.00 34.13 31.19 2rpc s GLU 126 CO 0.27 -0.29 0.00 0.41 -0.54 0.00 0.00 175.26 175.12 2rpc n GLY 127 N 0.75 0.91 3.36 -1.50 0.00 -1.26 -5.02 105.19 102.43 2rpc n GLY 127 Ca 0.02 -0.66 -0.28 0.00 0.00 0.00 0.00 46.02 45.10 2rpc n GLY 127 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2rpc s ASP 129 N -1.83 3.97 0.30 0.00 1.11 -1.26 -4.93 116.67 114.03 2rpc s ASP 129 Ca 0.12 -1.27 -0.10 0.00 0.18 0.00 0.00 52.55 51.48 2rpc s ASP 129 Cb -0.10 -1.23 0.01 0.00 1.07 0.00 0.00 42.92 42.67 2rpc s ASP 129 CO 0.05 -0.24 0.53 -0.13 1.18 0.00 0.00 175.17 176.55 2rpc s ARG 130 N 1.35 1.76 -0.08 8.23 1.81 -1.26 -5.04 118.95 125.71 2rpc s ARG 130 Ca -0.05 -1.43 -0.05 0.00 -1.72 0.00 0.00 55.73 52.48 2rpc s ARG 130 Cb -0.19 0.49 0.03 0.00 -0.45 0.00 0.00 34.95 34.83 2rpc s ARG 130 CO -0.07 -0.75 0.20 1.03 -0.68 0.00 0.00 175.30 175.03 2rpc s ARG 131 N -3.49 0.19 0.11 3.54 1.81 -1.26 -4.21 118.95 115.64 2rpc s ARG 131 Ca 0.24 0.38 -0.09 0.00 -1.72 0.00 0.00 55.73 54.53 2rpc s ARG 131 Cb -0.01 -0.04 -0.00 0.00 -0.45 0.00 0.00 34.95 34.45 2rpc s ARG 131 CO 0.13 -0.10 0.22 -0.06 -0.68 0.00 0.00 175.30 174.81 2rpc s PHE 132 N 0.74 0.21 -0.09 -0.53 0.08 0.60 -4.91 117.98 114.08 2rpc s PHE 132 Ca -0.05 -0.61 0.02 0.00 0.12 0.00 0.00 56.93 56.41 2rpc s PHE 132 Cb -0.07 -0.05 -0.03 0.00 -0.57 0.00 0.00 43.02 42.31 2rpc s PHE 132 CO -0.04 -0.60 0.09 0.00 -0.10 0.00 0.00 175.22 174.57 2rpc n ALA 133 N -0.11 2.27 -3.15 5.36 0.00 -1.26 0.13 120.51 123.74 2rpc n ALA 133 Ca -0.13 -0.06 -0.14 0.00 0.00 0.00 0.00 53.44 53.11 2rpc n ALA 133 Cb 0.63 -0.08 -0.15 0.00 0.00 0.00 0.00 19.45 19.85 2rpc n ALA 133 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 2rpc s ASN 134 N -1.34 0.22 0.37 0.00 2.20 -1.26 -4.75 114.94 110.38 2rpc s ASN 134 Ca 0.01 -0.02 0.15 0.00 -0.94 0.00 0.00 52.86 52.05 2rpc s ASN 134 Cb 0.02 -0.07 1.01 0.00 -2.00 0.00 0.00 41.25 40.21 2rpc s ASN 134 CO 0.09 -0.03 1.76 0.28 -2.94 0.00 0.00 177.10 176.27 2rpc h SER 135 N 6.52 0.54 -0.18 3.54 0.02 -1.96 -0.41 113.55 121.62 2rpc h SER 135 Ca -0.32 0.10 0.05 0.00 -0.84 0.00 0.00 61.79 60.78 2rpc h SER 135 Cb 1.18 0.01 -0.06 0.00 0.14 0.00 0.00 62.40 63.68 2rpc h SER 135 CO 0.50 0.11 -0.18 0.28 -1.14 0.00 0.00 176.83 176.39 2rpc h SER 136 N 0.48 -0.56 -0.16 3.07 0.02 -1.98 0.39 113.55 114.80 2rpc h SER 136 Ca 0.61 0.11 -0.00 0.00 -0.84 0.00 0.00 61.79 61.66 2rpc h SER 136 Cb 1.37 0.27 -0.01 0.00 0.14 0.00 0.00 62.40 64.18 2rpc h SER 136 CO -0.36 -0.22 0.09 -0.78 -1.14 0.00 0.00 176.83 174.42 2rpc h ASP 137 N -0.20 0.20 -0.73 3.07 1.82 -1.52 -0.93 116.42 118.13 2rpc h ASP 137 Ca 0.11 -0.09 0.03 0.00 -0.39 0.00 0.00 57.03 56.69 2rpc h ASP 137 Cb 0.37 -0.05 -0.04 0.00 0.68 0.00 0.00 39.33 40.29 2rpc h ASP 137 CO -0.30 0.24 0.48 -0.09 -1.61 0.00 0.00 179.24 177.97 2rpc h ARG 138 N 0.16 0.89 0.00 0.28 2.43 -0.95 -0.69 114.38 116.49 2rpc h ARG 138 Ca 0.06 -0.05 -0.06 0.00 -0.81 0.00 0.00 59.98 59.11 2rpc h ARG 138 Cb 0.08 -0.20 -0.01 0.00 -0.42 0.00 0.00 29.97 29.42 2rpc h ARG 138 CO -0.01 0.59 -0.30 -0.22 -1.51 0.00 0.00 179.97 178.52 2rpc h LYS 139 N 0.91 0.00 0.00 0.20 3.64 0.13 -2.87 116.57 118.58 2rpc h LYS 139 Ca 0.29 0.00 -0.02 0.00 -1.27 0.00 0.00 60.65 59.65 2rpc h LYS 139 Cb 0.02 0.00 -0.00 0.00 -0.41 0.00 0.00 32.23 31.84 2rpc h LYS 139 CO -0.08 0.30 -0.08 0.87 -2.27 0.00 0.00 179.45 178.19 2rpc h LYS 140 N 0.00 0.00 -0.02 1.90 1.57 0.28 -2.72 116.57 117.58 2rpc h LYS 140 Ca -0.00 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 2rpc h LYS 140 Cb 0.91 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.22 2rpc h LYS 140 CO 0.04 0.08 0.00 1.58 -0.57 0.00 0.00 179.45 180.58 2rpc n HIS 141 N -3.16 0.01 0.13 -1.35 -0.00 -1.03 -3.49 115.22 106.32 2rpc n HIS 141 Ca 0.02 -0.00 0.11 0.00 0.46 0.00 0.00 57.72 58.30 2rpc n HIS 141 Cb 0.43 0.00 0.03 0.00 -0.12 0.00 0.00 29.99 30.34 2rpc n HIS 141 CO 0.00 0.00 0.00 0.52 0.46 0.00 0.00 176.34 177.32 2rpc h MET 142 N 1.47 0.00 -0.00 1.57 2.86 -1.57 -3.32 114.93 115.94 2rpc h MET 142 Ca 0.00 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.64 2rpc h MET 142 Cb 0.31 0.00 -0.00 0.00 0.06 0.00 0.00 31.60 31.97 2rpc h MET 142 CO 0.00 0.02 0.18 0.45 1.06 0.00 0.00 176.91 178.62 2rpc h HIS 143 N 0.00 0.00 0.00 -0.22 3.86 -1.71 0.24 115.15 117.32 2rpc h HIS 143 Ca -0.01 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 59.20 2rpc h HIS 143 Cb 1.03 0.00 0.00 0.00 1.06 0.00 0.00 27.41 29.50 2rpc h HIS 143 CO 0.00 0.00 -1.74 1.55 0.86 0.00 0.00 177.93 178.60 2rpc n VAL 144 N -2.99 0.03 0.08 2.45 3.14 -1.25 -3.91 118.33 115.88 2rpc n VAL 144 Ca -0.02 -0.40 -0.11 0.00 -2.96 0.00 0.00 64.34 60.84 2rpc n VAL 144 Cb 0.24 0.17 -0.05 0.00 -1.06 0.00 0.00 33.84 33.14 2rpc n VAL 144 CO 0.00 0.00 0.00 0.45 -6.46 0.00 0.00 176.83 170.82 2rpc h HIS 145 N 0.00 0.42 -0.07 1.45 3.86 -0.68 -3.15 115.15 116.97 2rpc h HIS 145 Ca 0.00 -0.24 0.00 0.00 -1.16 0.00 0.00 60.37 58.97 2rpc h HIS 145 Cb 0.90 -0.04 0.00 0.00 1.06 0.00 0.00 27.41 29.33 2rpc h HIS 145 CO 0.00 1.09 0.00 -2.37 0.86 0.00 0.00 177.93 177.51 2rpc n THR 146 N -3.65 0.08 -4.55 2.45 5.66 -0.85 -4.87 114.28 108.54 2rpc n THR 146 Ca -0.05 -0.32 -0.31 0.00 -3.05 0.00 0.00 64.05 60.31 2rpc n THR 146 Cb 0.86 0.58 -0.11 0.00 -1.55 0.00 0.00 70.33 70.11 2rpc n THR 146 CO 0.00 0.00 0.00 -0.55 -3.05 0.00 0.00 175.07 171.47 2rpc s SER 147 N -1.86 4.21 -0.06 1.09 0.15 -1.19 -5.01 113.70 111.03 2rpc s SER 147 Ca 0.36 -0.29 0.13 0.00 0.70 0.00 0.00 55.95 56.84 2rpc s SER 147 Cb 0.20 -0.84 0.48 0.00 -1.71 0.00 0.00 66.02 64.16 2rpc s SER 147 CO 0.31 0.26 1.36 -0.90 1.20 0.00 0.00 173.24 175.48 2rpc n ASP 148 N 1.51 3.24 -4.85 5.45 5.75 -1.26 -4.89 116.55 121.50 2rpc n ASP 148 Ca -0.16 -2.23 -0.29 0.00 -0.01 0.00 0.00 54.79 52.10 2rpc n ASP 148 Cb 0.52 -0.44 -0.05 0.00 -1.03 0.00 0.00 41.12 40.12 2rpc n ASP 148 CO 0.00 0.00 0.00 -0.75 -0.11 0.00 0.00 177.20 176.34 2rpc s LYS 149 N -1.64 3.16 0.52 0.11 2.20 -1.26 -5.00 119.74 117.82 2rpc s LYS 149 Ca 0.35 -0.61 0.16 0.00 -0.36 0.00 0.00 55.97 55.51 2rpc s LYS 149 Cb 0.21 -2.86 1.27 0.00 -1.51 0.00 0.00 37.83 34.95 2rpc s LYS 149 CO 0.18 0.56 2.15 1.03 -0.36 0.00 0.00 175.35 178.92 2rpc h SER 150 N 2.94 0.00 0.00 1.43 0.87 -1.95 -3.47 113.55 113.37 2rpc h SER 150 Ca -0.46 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.10 2rpc h SER 150 Cb 1.17 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 63.13 2rpc h SER 150 CO 0.69 0.01 0.00 0.61 -0.53 0.00 0.00 176.83 177.61 2rpc n GLY 151 N -1.52 2.77 0.00 5.77 0.00 -1.26 -5.09 105.19 105.86 2rpc n GLY 151 Ca -0.03 -0.88 0.00 0.00 0.00 0.00 0.00 46.02 45.11 2rpc n GLY 151 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 2rpc n PRO 152 N -0.89 -0.60 -3.08 1.61 -0.04 -1.26 -4.96 135.00 125.78 2rpc n PRO 152 Ca 0.00 0.00 -0.43 0.00 -0.04 0.00 0.00 63.50 63.03 2rpc n PRO 152 Cb 0.00 0.00 -0.06 0.00 -0.04 0.00 0.00 33.50 33.40 2rpc n PRO 152 CO 0.00 0.00 0.00 -1.54 -0.04 0.00 0.00 175.50 173.92 2rpc s SER 153 N -1.51 6.28 -0.02 3.54 1.04 -1.26 -4.87 113.70 116.90 2rpc s SER 153 Ca 0.00 -0.61 -0.05 0.00 0.48 0.00 0.00 55.95 55.78 2rpc s SER 153 Cb 0.00 -2.33 -0.02 0.00 0.10 0.00 0.00 66.02 63.77 2rpc s SER 153 CO 0.00 -0.92 -0.09 -0.24 0.98 0.00 0.00 173.24 172.97 2rpc n SER 154 N 6.46 0.83 0.00 7.02 2.88 -1.26 -5.35 113.62 124.21 2rpc n SER 154 Ca -0.03 0.13 0.00 0.00 -1.33 0.00 0.00 58.87 57.64 2rpc n SER 154 Cb 0.47 -0.40 0.00 0.00 -0.75 0.00 0.00 64.21 63.53 2rpc n SER 154 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42