#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 3.35 -0.28 1.61 1.04 -1.26 -5.08 113.70 113.08 2rpc s SER 2 Ca 0.00 -2.71 -0.23 0.00 0.48 0.00 0.00 55.95 53.48 2rpc s SER 2 Cb 0.00 -0.90 0.12 0.00 0.10 0.00 0.00 66.02 65.33 2rpc s SER 2 CO 0.00 -0.25 0.96 -0.55 0.98 0.00 0.00 173.24 174.38 2rpc s SER 3 N 0.28 -0.53 0.00 7.02 0.15 -1.26 -5.18 113.70 114.18 2rpc s SER 3 Ca 0.20 0.98 0.00 0.00 0.70 0.00 0.00 55.95 57.83 2rpc s SER 3 Cb -0.19 1.04 0.00 0.00 -1.71 0.00 0.00 66.02 65.16 2rpc s SER 3 CO -0.04 -0.17 0.00 0.61 1.20 0.00 0.00 173.24 174.85 2rpc n GLY 4 N 2.60 1.60 3.39 9.45 0.00 -1.26 -5.17 105.19 115.80 2rpc n GLY 4 Ca -0.14 -0.99 -0.22 0.00 0.00 0.00 0.00 46.02 44.67 2rpc n GLY 4 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2rpc s SER 5 N 0.00 3.02 -0.14 1.61 0.15 -1.26 -5.15 113.70 111.92 2rpc s SER 5 Ca 0.00 -0.96 -0.14 0.00 0.70 0.00 0.00 55.95 55.55 2rpc s SER 5 Cb 0.00 -0.21 0.04 0.00 -1.71 0.00 0.00 66.02 64.14 2rpc s SER 5 CO 0.00 -0.04 0.40 -0.44 1.20 0.00 0.00 173.24 174.36 2rpc s SER 6 N -3.13 -0.41 0.00 5.45 0.01 -1.26 -5.07 113.70 109.29 2rpc s SER 6 Ca 0.23 0.77 0.00 0.00 1.31 0.00 0.00 55.95 58.25 2rpc s SER 6 Cb -0.04 0.79 0.00 0.00 0.21 0.00 0.00 66.02 66.98 2rpc s SER 6 CO 0.10 -0.16 0.00 0.61 0.41 0.00 0.00 173.24 174.20 2rpc n GLY 7 N 2.76 -0.78 3.49 3.44 0.00 -1.26 -5.17 105.19 107.68 2rpc n GLY 7 Ca -0.14 0.25 -0.31 0.00 0.00 0.00 0.00 46.02 45.83 2rpc n GLY 7 CO 0.00 0.00 0.00 -0.86 0.00 0.00 0.00 173.32 172.46 2rpc s GLN 8 N 0.00 2.09 0.34 1.61 0.00 -1.26 -5.14 119.66 117.31 2rpc s GLN 8 Ca 0.00 -0.98 -0.06 0.00 -0.00 0.00 0.00 55.36 54.32 2rpc s GLN 8 Cb 0.00 -2.23 0.08 0.00 0.00 0.00 0.00 33.01 30.87 2rpc s GLN 8 CO 0.00 0.53 0.30 -0.35 0.00 0.00 0.00 175.29 175.78 2rpc n PRO 9 N 1.34 -1.62 -3.70 9.60 -0.04 -1.26 -5.03 135.00 134.29 2rpc n PRO 9 Ca -0.16 -0.48 -0.37 0.00 -0.04 0.00 0.00 63.50 62.45 2rpc n PRO 9 Cb 0.52 -0.45 -0.06 0.00 -0.04 0.00 0.00 33.50 33.47 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 -1.55 5.27 0.01 0.52 1.01 -1.26 -5.08 121.20 120.12 2rpc s ILE 10 Ca 0.20 0.50 -0.18 0.00 0.00 0.00 0.00 60.65 61.16 2rpc s ILE 10 Cb -0.02 -3.56 -0.06 0.00 0.01 0.00 0.00 42.46 38.84 2rpc s ILE 10 CO 0.15 0.58 0.51 -0.54 0.00 0.00 0.00 174.94 175.64 2rpc s LYS 11 N -1.11 4.15 -0.15 2.79 -0.14 -1.26 -5.06 119.74 118.96 2rpc s LYS 11 Ca 0.20 0.59 -0.19 0.00 -1.36 0.00 0.00 55.97 55.20 2rpc s LYS 11 Cb -0.14 -3.28 -0.04 0.00 -1.68 0.00 0.00 37.83 32.69 2rpc s LYS 11 CO 0.09 0.54 0.55 -1.14 -0.76 0.00 0.00 175.35 174.63 2rpc s GLN 12 N -0.69 4.29 0.02 1.68 2.00 -1.26 -5.05 119.66 120.65 2rpc s GLN 12 Ca 0.27 0.53 -0.24 0.00 -2.00 0.00 0.00 55.36 53.92 2rpc s GLN 12 Cb -0.18 -3.50 -0.05 0.00 0.80 0.00 0.00 33.01 30.09 2rpc s GLN 12 CO 0.16 -0.01 0.73 -1.83 -0.50 0.00 0.00 175.29 173.83 2rpc s GLU 13 N 1.15 4.45 0.53 1.67 -1.05 -1.26 -4.85 118.70 119.34 2rpc s GLU 13 Ca 0.28 0.98 0.00 0.00 -0.15 0.00 0.00 54.97 56.08 2rpc s GLU 13 Cb -0.16 -3.37 0.02 0.00 -0.44 0.00 0.00 34.13 30.18 2rpc s GLU 13 CO 0.11 0.26 0.76 -0.51 0.95 0.00 0.00 175.26 176.83 2rpc s LEU 14 N 0.06 3.37 -0.12 1.83 1.43 -1.20 -5.00 118.68 119.05 2rpc s LEU 14 Ca 0.37 0.14 -0.09 0.00 -1.03 0.00 0.00 54.13 53.53 2rpc s LEU 14 Cb -0.20 -3.01 0.04 0.00 0.03 0.00 0.00 46.19 43.06 2rpc s LEU 14 CO 0.21 -1.02 0.31 -0.44 0.23 0.00 0.00 176.35 175.65 2rpc s SER 15 N -4.36 -0.35 -0.54 2.29 0.01 -1.26 -4.08 113.70 105.41 2rpc s SER 15 Ca 0.54 0.65 0.03 0.00 1.31 0.00 0.00 55.95 58.49 2rpc s SER 15 Cb -0.10 0.60 0.13 0.00 0.21 0.00 0.00 66.02 66.86 2rpc s SER 15 CO 0.39 -0.14 0.29 0.00 0.41 0.00 0.00 173.24 174.18 2rpc s LYS 17 N -0.33 3.20 -0.26 0.00 -0.14 -1.26 -4.12 119.74 116.83 2rpc s LYS 17 Ca 0.17 -0.60 -0.07 0.00 -1.36 0.00 0.00 55.97 54.11 2rpc s LYS 17 Cb -0.25 -4.32 -0.02 0.00 -1.68 0.00 0.00 37.83 31.57 2rpc s LYS 17 CO -0.01 -2.01 0.07 -0.46 -0.76 0.00 0.00 175.35 172.18 2rpc s TRP 18 N 4.89 3.09 -0.37 3.18 -0.11 -1.26 -3.23 118.94 125.13 2rpc s TRP 18 Ca 0.31 -0.60 0.02 0.00 1.22 0.00 0.00 56.10 57.05 2rpc s TRP 18 Cb -0.11 -2.24 0.11 0.00 -1.50 0.00 0.00 33.47 29.73 2rpc s TRP 18 CO 0.10 -0.43 0.11 0.42 -4.62 0.00 0.00 176.95 172.53 2rpc s ILE 19 N 1.58 2.55 -0.35 5.86 1.01 0.03 -1.53 121.20 130.35 2rpc s ILE 19 Ca 0.05 -2.37 -0.29 0.00 0.00 0.00 0.00 60.65 58.05 2rpc s ILE 19 Cb -0.16 -2.84 0.00 0.00 0.01 0.00 0.00 42.46 39.48 2rpc s ILE 19 CO 0.03 -0.64 1.44 -1.81 0.00 0.00 0.00 174.94 173.95 2rpc s ASP 20 N 1.01 6.41 0.51 3.58 1.01 -1.26 -4.51 116.67 123.42 2rpc s ASP 20 Ca 0.11 1.08 0.40 0.00 0.71 0.00 0.00 52.55 54.85 2rpc s ASP 20 Cb -0.20 -2.54 1.57 0.00 1.01 0.00 0.00 42.92 42.76 2rpc s ASP 20 CO -0.07 -1.33 1.64 -0.33 0.21 0.00 0.00 175.17 175.30 2rpc h GLU 21 N 10.45 0.04 -0.95 8.23 4.39 -1.98 1.21 114.58 135.98 2rpc h GLU 21 Ca -0.28 -0.00 -0.65 0.00 0.34 0.00 0.00 59.36 58.77 2rpc h GLU 21 Cb 1.11 -0.01 -0.31 0.00 -0.10 0.00 0.00 28.75 29.44 2rpc h GLU 21 CO 1.05 0.03 0.59 0.00 -1.16 0.00 0.00 179.01 179.52 2rpc n ALA 22 N -2.74 6.09 -0.95 3.43 0.00 -1.26 -5.04 120.51 120.04 2rpc n ALA 22 Ca 0.38 -3.51 -0.36 0.00 0.00 0.00 0.00 53.44 49.95 2rpc n ALA 22 Cb 1.62 -1.52 0.06 0.00 0.00 0.00 0.00 19.45 19.61 2rpc n ALA 22 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2rpc n GLN 23 N -0.90 -0.12 -0.00 0.00 0.00 0.42 -4.90 117.38 111.88 2rpc n GLN 23 Ca 0.60 -0.03 0.08 0.00 0.00 0.00 0.00 57.00 57.65 2rpc n GLN 23 Cb 0.75 -1.16 0.07 0.00 0.00 0.00 0.00 30.24 29.90 2rpc n GLN 23 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 177.06 176.95 2rpc n LEU 24 N 2.56 2.35 -4.51 2.61 0.00 -1.26 -5.00 117.00 113.75 2rpc n LEU 24 Ca -0.01 -1.00 -0.25 0.00 0.00 0.00 0.00 56.01 54.75 2rpc n LEU 24 Cb 0.60 -0.00 -0.09 0.00 0.00 0.00 0.00 43.42 43.93 2rpc n LEU 24 CO 0.51 0.42 -0.23 -0.55 0.00 0.00 0.00 177.39 177.53 2rpc s SER 25 N -1.35 2.77 -0.11 1.96 0.15 -1.26 -5.16 113.70 110.70 2rpc s SER 25 Ca 0.19 -1.55 -0.06 0.00 0.70 0.00 0.00 55.95 55.23 2rpc s SER 25 Cb 0.13 0.26 0.04 0.00 -1.71 0.00 0.00 66.02 64.74 2rpc s SER 25 CO 0.20 -0.79 0.26 -0.60 1.20 0.00 0.00 173.24 173.51 2rpc s ARG 26 N -3.80 0.24 0.26 5.44 6.06 -1.26 -4.23 118.95 121.66 2rpc s ARG 26 Ca 0.27 0.49 -0.04 0.00 -2.50 0.00 0.00 55.73 53.95 2rpc s ARG 26 Cb 0.05 -0.04 0.07 0.00 0.06 0.00 0.00 34.95 35.08 2rpc s ARG 26 CO 0.14 -0.13 0.23 -0.35 -2.50 0.00 0.00 175.30 172.69 2rpc n PRO 27 N 3.86 -1.47 -1.87 5.12 -0.04 -1.26 -5.05 135.00 134.29 2rpc n PRO 27 Ca -0.22 -0.37 -0.42 0.00 -0.04 0.00 0.00 63.50 62.45 2rpc n PRO 27 Cb 0.55 -0.35 -0.03 0.00 -0.04 0.00 0.00 33.50 33.63 2rpc n PRO 27 CO 0.00 0.00 0.00 0.15 -0.04 0.00 0.00 175.50 175.61 2rpc s LYS 28 N -3.53 4.18 0.26 0.54 1.02 -1.26 -5.00 119.74 115.95 2rpc s LYS 28 Ca 0.15 2.42 0.07 0.00 0.02 0.00 0.00 55.97 58.63 2rpc s LYS 28 Cb -0.01 -3.43 -0.03 0.00 -0.52 0.00 0.00 37.83 33.83 2rpc s LYS 28 CO 0.12 -0.72 0.21 -1.59 -0.92 0.00 0.00 175.35 172.44 2rpc s LYS 29 N 2.11 2.89 0.15 1.68 -2.85 -1.26 -5.13 119.74 117.33 2rpc s LYS 29 Ca 0.74 -1.09 0.09 0.00 -1.00 0.00 0.00 55.97 54.72 2rpc s LYS 29 Cb -0.43 -2.55 -0.04 0.00 -2.06 0.00 0.00 37.83 32.75 2rpc s LYS 29 CO 0.33 0.36 -0.15 -1.12 0.10 0.00 0.00 175.35 174.87 2rpc s SER 30 N -3.86 4.01 -0.54 0.03 0.01 -1.26 -4.50 113.70 107.59 2rpc s SER 30 Ca 0.34 -0.59 -0.26 0.00 1.31 0.00 0.00 55.95 56.75 2rpc s SER 30 Cb -0.08 -0.60 -0.08 0.00 0.21 0.00 0.00 66.02 65.48 2rpc s SER 30 CO 0.25 0.14 2.38 0.00 0.41 0.00 0.00 173.24 176.43 2rpc s ASP 32 N 11.84 6.56 0.05 0.00 -4.77 -1.26 -4.27 116.67 124.81 2rpc s ASP 32 Ca 0.95 -1.91 -0.02 0.00 -3.30 0.00 0.00 52.55 48.28 2rpc s ASP 32 Cb -0.16 -2.58 -0.03 0.00 -1.09 0.00 0.00 42.92 39.06 2rpc s ASP 32 CO 0.23 -1.45 -0.01 -0.13 0.70 0.00 0.00 175.17 174.51 2rpc s ARG 33 N 4.75 0.58 0.21 2.11 1.81 -1.26 -5.09 118.95 122.05 2rpc s ARG 33 Ca 0.51 -1.08 -0.10 0.00 -1.72 0.00 0.00 55.73 53.34 2rpc s ARG 33 Cb 0.02 0.20 -0.01 0.00 -0.45 0.00 0.00 34.95 34.71 2rpc s ARG 33 CO -0.00 -0.11 0.36 0.95 -0.68 0.00 0.00 175.30 175.82 2rpc s THR 34 N -3.46 0.02 0.25 0.02 -4.23 -1.26 -3.48 115.64 103.50 2rpc s THR 34 Ca 0.03 -1.46 -0.13 0.00 -1.18 0.00 0.00 61.69 58.94 2rpc s THR 34 Cb 0.04 -2.10 -0.00 0.00 1.34 0.00 0.00 72.50 71.78 2rpc s THR 34 CO -0.08 -0.10 0.50 -0.36 -0.54 0.00 0.00 174.62 174.03 2rpc s PHE 35 N -4.02 0.33 -0.19 3.99 0.40 -1.26 -5.01 117.98 112.23 2rpc s PHE 35 Ca 0.23 -0.69 0.06 0.00 -0.60 0.00 0.00 56.93 55.92 2rpc s PHE 35 Cb 0.02 0.23 -0.22 0.00 0.51 0.00 0.00 43.02 43.56 2rpc s PHE 35 CO 0.06 -1.02 0.08 0.45 0.70 0.00 0.00 175.22 175.49 2rpc n SER 36 N -0.40 1.37 -4.60 1.36 2.88 -1.26 -3.21 113.62 109.75 2rpc n SER 36 Ca -0.02 0.03 -0.24 0.00 -1.33 0.00 0.00 58.87 57.32 2rpc n SER 36 Cb 0.62 -0.10 -0.08 0.00 -0.75 0.00 0.00 64.21 63.90 2rpc n SER 36 CO 0.00 0.00 0.00 0.42 -1.23 0.00 0.00 175.04 174.23 2rpc s THR 37 N -2.53 3.25 0.13 2.46 -4.23 -1.26 -4.79 115.64 108.67 2rpc s THR 37 Ca -0.22 -1.93 -0.15 0.00 -1.18 0.00 0.00 61.69 58.21 2rpc s THR 37 Cb 0.08 -2.71 -0.02 0.00 1.34 0.00 0.00 72.50 71.19 2rpc s THR 37 CO 0.72 -0.32 1.60 -0.03 -0.54 0.00 0.00 174.62 176.05 2rpc h MET 38 N 2.17 0.67 -0.79 3.99 4.05 -1.95 -2.97 114.93 120.10 2rpc h MET 38 Ca -0.44 -0.19 0.13 0.00 -0.28 0.00 0.00 59.70 58.92 2rpc h MET 38 Cb 1.24 -0.07 -0.09 0.00 -0.80 0.00 0.00 31.60 31.88 2rpc h MET 38 CO 0.59 0.73 0.39 0.45 0.23 0.00 0.00 176.91 179.30 2rpc h HIS 39 N 0.51 0.69 -0.95 1.39 3.86 -1.99 0.64 115.15 119.31 2rpc h HIS 39 Ca 0.12 0.03 0.07 0.00 -1.16 0.00 0.00 60.37 59.43 2rpc h HIS 39 Cb 0.39 -0.19 -0.06 0.00 1.06 0.00 0.00 27.41 28.61 2rpc h HIS 39 CO 0.03 0.19 0.62 0.93 0.86 0.00 0.00 177.93 180.56 2rpc h GLU 40 N 0.60 1.05 0.05 2.45 4.39 -1.94 -0.76 114.58 120.42 2rpc h GLU 40 Ca 0.42 -0.06 -0.00 0.00 0.34 0.00 0.00 59.36 60.05 2rpc h GLU 40 Cb 0.54 -0.24 0.00 0.00 -0.10 0.00 0.00 28.75 28.95 2rpc h GLU 40 CO -0.33 0.69 -0.03 1.25 -1.16 0.00 0.00 179.01 179.44 2rpc h LEU 41 N 1.08 -0.06 -0.09 1.33 5.85 -1.01 -3.11 115.31 119.30 2rpc h LEU 41 Ca 0.42 -0.57 0.04 0.00 0.84 0.00 0.00 57.88 58.61 2rpc h LEU 41 Cb 0.22 0.02 -0.06 0.00 0.37 0.00 0.00 40.66 41.20 2rpc h LEU 41 CO -0.17 0.58 -0.40 0.58 -0.34 0.00 0.00 178.44 178.69 2rpc h VAL 42 N -0.74 0.18 -0.45 1.05 2.07 -0.71 0.33 116.25 117.97 2rpc h VAL 42 Ca -0.01 0.00 0.13 0.00 0.82 0.00 0.00 66.70 67.64 2rpc h VAL 42 Cb 0.62 0.18 -0.02 0.00 -1.52 0.00 0.00 31.29 30.55 2rpc h VAL 42 CO 0.01 0.00 0.45 0.74 0.02 0.00 0.00 177.57 178.79 2rpc h THR 43 N -0.50 0.41 0.00 2.57 2.02 -1.26 0.16 112.91 116.31 2rpc h THR 43 Ca 0.07 0.00 0.00 0.00 0.77 0.00 0.00 66.41 67.25 2rpc h THR 43 Cb 0.62 0.65 0.00 0.00 -1.74 0.00 0.00 68.15 67.67 2rpc h THR 43 CO -0.36 0.00 -0.10 -0.74 0.37 0.00 0.00 175.52 174.68 2rpc h HIS 44 N 0.00 0.00 -0.11 3.16 -0.00 -0.67 -0.38 115.15 117.15 2rpc h HIS 44 Ca 0.21 0.00 0.03 0.00 -0.00 0.00 0.00 60.37 60.61 2rpc h HIS 44 Cb 1.12 0.00 -0.00 0.00 -0.00 0.00 0.00 27.41 28.52 2rpc h HIS 44 CO 0.00 0.00 0.32 0.28 -0.00 0.00 0.00 177.93 178.53 2rpc h VAL 45 N -0.71 0.13 0.00 5.26 2.07 -0.18 2.27 116.25 125.10 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 0.70 -0.02 0.00 -1.52 0.00 0.00 31.29 30.56 2rpc h VAL 45 CO 0.00 0.00 -1.03 0.41 0.02 0.00 0.00 177.57 176.97 2rpc n THR 46 N -3.18 1.47 -0.10 2.57 -1.04 0.54 -1.79 114.28 112.76 2rpc n THR 46 Ca 0.00 0.07 -0.20 0.00 -2.04 0.00 0.00 64.05 61.88 2rpc n THR 46 Cb 0.40 -2.24 -0.12 0.00 -1.82 0.00 0.00 70.33 66.56 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 -0.70 2.01 114.93 115.28 2rpc h MET 47 Ca -0.17 -0.01 0.00 0.00 -2.06 0.00 0.00 59.70 57.46 2rpc h MET 47 Cb 0.93 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.59 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 -4.45 0.53 0.00 1.72 -0.58 0.73 -2.32 120.64 116.27 2rpc n GLU 48 Ca -0.28 0.00 0.00 0.00 -0.42 0.00 0.00 57.16 56.46 2rpc n GLU 48 Cb 0.65 -1.33 0.00 0.00 -0.57 0.00 0.00 31.44 30.18 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 -0.83 -0.18 0.83 -0.32 8.25 0.89 -4.81 115.22 119.04 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 0.31 0.41 0.00 1.12 0.00 0.00 29.99 31.87 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 -1.93 0.30 -4.53 1.59 0.31 0.32 -4.95 118.33 109.44 2rpc n VAL 50 Ca 0.00 0.07 0.00 0.00 -0.01 0.00 0.00 64.34 64.40 2rpc n VAL 50 Cb 0.00 -0.83 0.00 0.00 -0.91 0.00 0.00 33.84 32.10 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 -0.03 -1.44 0.00 2.92 0.00 0.65 -4.83 105.19 102.46 2rpc n GLY 51 Ca 0.09 -1.19 0.00 0.00 0.00 0.00 0.00 46.02 44.92 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 0.00 1.73 0.00 -0.02 0.00 -1.26 -3.51 105.19 102.13 2rpc n GLY 52 Ca 0.00 -2.06 0.08 0.00 0.00 0.00 0.00 46.02 44.04 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 -0.55 0.37 -1.03 1.61 -0.04 -1.26 -2.72 135.00 131.38 2rpc n PRO 53 Ca 0.00 0.06 -0.15 0.00 -0.04 0.00 0.00 63.50 63.37 2rpc n PRO 53 Cb 0.00 -1.50 0.20 0.00 -0.04 0.00 0.00 33.50 32.16 2rpc n PRO 53 CO 0.00 0.00 0.00 -0.85 -0.04 0.00 0.00 175.50 174.61 2rpc n GLU 54 N -1.12 2.63 -5.12 0.54 0.28 -1.26 -4.89 120.64 111.69 2rpc n GLU 54 Ca 0.10 -2.70 -0.30 0.00 -0.16 0.00 0.00 57.16 54.10 2rpc n GLU 54 Cb 0.08 -2.08 -0.17 0.00 1.43 0.00 0.00 31.44 30.71 2rpc n GLU 54 CO 0.00 0.00 0.00 -0.65 -0.16 0.00 0.00 177.13 176.32 2rpc s GLN 55 N -2.85 2.45 -0.08 3.44 1.11 -1.10 -5.05 119.66 117.58 2rpc s GLN 55 Ca 0.50 -0.81 -0.03 0.00 0.01 0.00 0.00 55.36 55.03 2rpc s GLN 55 Cb 0.41 -2.02 -0.01 0.00 -1.01 0.00 0.00 33.01 30.39 2rpc s GLN 55 CO 0.11 0.28 -0.06 -0.91 0.01 0.00 0.00 175.29 174.72 2rpc h ASN 56 N 6.31 0.00 -2.74 5.90 4.21 -1.91 -3.44 115.58 123.91 2rpc h ASN 56 Ca -0.29 0.00 -0.56 0.00 1.21 0.00 0.00 56.30 56.66 2rpc h ASN 56 Cb 1.19 0.00 -0.09 0.00 -1.12 0.00 0.00 38.32 38.30 2rpc h ASN 56 CO 0.47 0.40 0.93 0.21 -1.29 0.00 0.00 177.43 178.15 2rpc s ASN 57 N -4.76 6.27 -0.33 5.81 2.47 -1.26 -4.99 114.94 118.16 2rpc s ASN 57 Ca -0.05 -0.32 -0.07 0.00 0.42 0.00 0.00 52.86 52.85 2rpc s ASN 57 Cb 0.01 -2.53 0.03 0.00 -1.45 0.00 0.00 41.25 37.31 2rpc s ASN 57 CO 0.08 -1.62 0.10 -1.38 -3.72 0.00 0.00 177.10 170.55 2rpc s HIS 58 N 5.13 3.22 -0.01 0.43 -3.43 -1.26 -5.08 115.29 114.30 2rpc s HIS 58 Ca 0.36 -1.31 -0.00 0.00 -0.80 0.00 0.00 55.06 53.31 2rpc s HIS 58 Cb -0.09 -2.27 0.01 0.00 -1.43 0.00 0.00 32.58 28.79 2rpc s HIS 58 CO 0.18 -0.69 0.01 0.08 -2.00 0.00 0.00 174.74 172.32 2rpc s VAL 59 N 1.43 -0.01 -0.25 -5.38 1.01 -1.26 -4.51 120.40 111.43 2rpc s VAL 59 Ca -0.01 0.04 -0.04 0.00 0.00 0.00 0.00 61.98 61.97 2rpc s VAL 59 Cb -0.19 -0.03 0.01 0.00 0.00 0.00 0.00 36.38 36.17 2rpc s VAL 59 CO 0.03 0.01 -0.01 0.00 0.00 0.00 0.00 175.10 175.13 2rpc s TYR 61 N 1.43 3.43 0.14 0.00 1.51 -1.26 -3.95 117.35 118.65 2rpc s TYR 61 Ca 0.03 -1.66 -0.14 0.00 -1.01 0.00 0.00 57.07 54.29 2rpc s TYR 61 Cb -0.16 -3.72 -0.07 0.00 -0.11 0.00 0.00 41.96 37.90 2rpc s TYR 61 CO -0.02 -1.00 0.54 -0.46 -1.11 0.00 0.00 175.55 173.51 2rpc s TRP 62 N 1.08 3.61 0.59 2.71 -0.11 -1.26 -0.79 118.94 124.77 2rpc s TRP 62 Ca 0.08 1.05 0.32 0.00 1.22 0.00 0.00 56.10 58.78 2rpc s TRP 62 Cb -0.23 -2.36 1.25 0.00 -1.50 0.00 0.00 33.47 30.62 2rpc s TRP 62 CO -0.01 0.43 1.53 1.49 -4.62 0.00 0.00 176.95 175.77 2rpc h GLU 63 N 3.56 0.00 -0.01 5.86 4.81 -1.84 -1.61 114.58 125.35 2rpc h GLU 63 Ca -0.49 0.00 -0.15 0.00 -0.13 0.00 0.00 59.36 58.59 2rpc h GLU 63 Cb 1.19 0.00 -0.24 0.00 0.63 0.00 0.00 28.75 30.33 2rpc h GLU 63 CO 0.66 0.00 -0.61 0.39 -0.73 0.00 0.00 179.01 178.72 2rpc n GLU 64 N -3.55 0.10 -1.49 1.92 4.71 -1.26 -5.03 120.64 116.03 2rpc n GLU 64 Ca 0.24 -1.47 -0.53 0.00 -0.01 0.00 0.00 57.16 55.39 2rpc n GLU 64 Cb 1.39 0.24 -0.05 0.00 -1.01 0.00 0.00 31.44 32.01 2rpc n GLU 64 CO 0.00 0.00 0.00 0.00 0.09 0.00 0.00 177.13 177.22 2rpc h PRO 66 N 2.54 0.00 0.00 0.00 0.13 -1.98 -2.79 132.00 129.90 2rpc h PRO 66 Ca -0.42 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.71 2rpc h PRO 66 Cb 1.41 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.54 2rpc h PRO 66 CO 0.64 0.37 -0.49 0.00 -0.23 0.00 0.00 178.00 178.30 2rpc h ARG 67 N 0.00 0.00 -2.55 0.86 2.47 -1.96 -3.48 114.38 109.72 2rpc h ARG 67 Ca -0.00 0.00 -0.22 0.00 -1.26 0.00 0.00 59.98 58.50 2rpc h ARG 67 Cb 0.77 0.00 0.03 0.00 -1.65 0.00 0.00 29.97 29.12 2rpc h ARG 67 CO 0.05 0.00 -0.32 0.39 0.56 0.00 0.00 179.97 180.65 2rpc n GLU 68 N -2.69 -2.53 -3.10 0.04 1.02 -1.05 -3.70 120.64 108.62 2rpc n GLU 68 Ca 0.02 0.49 -0.12 0.00 -0.02 0.00 0.00 57.16 57.53 2rpc n GLU 68 Cb 0.51 -4.47 0.06 0.00 -0.02 0.00 0.00 31.44 27.52 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 -1.15 -1.04 3.31 0.62 0.00 -1.25 -5.00 105.19 100.67 2rpc n GLY 69 Ca -0.06 0.51 -0.37 0.00 0.00 0.00 0.00 46.02 46.10 2rpc n GLY 69 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2rpc s LYS 70 N -4.10 2.94 0.99 1.61 -0.14 -1.24 -4.91 119.74 114.89 2rpc s LYS 70 Ca 0.36 -0.95 -0.17 0.00 -1.36 0.00 0.00 55.97 53.85 2rpc s LYS 70 Cb -0.05 -3.34 -0.10 0.00 -1.68 0.00 0.00 37.83 32.66 2rpc s LYS 70 CO 0.69 -0.49 -0.58 -1.13 -0.76 0.00 0.00 175.35 173.07 2rpc n SER 71 N 4.83 -4.70 -4.79 2.83 3.41 -1.26 -4.97 113.62 108.97 2rpc n SER 71 Ca -0.14 0.18 -0.30 0.00 -0.26 0.00 0.00 58.87 58.35 2rpc n SER 71 Cb 0.47 -0.84 -0.04 0.00 -0.26 0.00 0.00 64.21 63.54 2rpc n SER 71 CO 0.00 0.00 0.00 0.49 -0.16 0.00 0.00 175.04 175.37 2rpc n PHE 72 N -2.93 0.47 0.14 7.33 3.01 -1.26 -5.04 117.46 119.17 2rpc n PHE 72 Ca 0.00 -2.47 0.08 0.00 1.01 0.00 0.00 57.45 56.07 2rpc n PHE 72 Cb 0.58 -0.39 0.04 0.00 -0.01 0.00 0.00 39.48 39.70 2rpc n PHE 72 CO 0.00 0.00 0.00 -0.22 1.01 0.00 0.00 176.76 177.55 2rpc h LYS 73 N 0.00 0.00 -3.98 -1.08 1.63 -1.96 -3.48 116.57 107.71 2rpc h LYS 73 Ca -0.40 0.00 -0.13 0.00 -0.85 0.00 0.00 60.65 59.27 2rpc h LYS 73 Cb 1.30 0.00 -0.11 0.00 -0.60 0.00 0.00 32.23 32.82 2rpc h LYS 73 CO 0.65 0.16 -0.28 0.00 -3.45 0.00 0.00 179.45 176.53 2rpc s ALA 74 N -3.15 0.27 -0.01 5.00 0.00 -1.26 -5.05 121.76 117.57 2rpc s ALA 74 Ca 0.02 -1.18 -0.25 0.00 0.00 0.00 0.00 51.96 50.56 2rpc s ALA 74 Cb 0.08 1.18 -0.18 0.00 0.00 0.00 0.00 23.12 24.20 2rpc s ALA 74 CO 0.75 -0.77 1.22 -0.22 0.00 0.00 0.00 175.76 176.74 2rpc h LYS 75 N 2.36 -0.20 -0.07 0.00 1.63 -1.96 -2.98 116.57 115.35 2rpc h LYS 75 Ca -0.29 0.01 0.02 0.00 -0.85 0.00 0.00 60.65 59.54 2rpc h LYS 75 Cb 1.25 0.05 -0.00 0.00 -0.60 0.00 0.00 32.23 32.92 2rpc h LYS 75 CO 0.41 0.17 0.10 0.10 -3.45 0.00 0.00 179.45 176.78 2rpc h TYR 76 N -0.63 0.00 -0.58 1.91 -0.00 -1.99 -0.87 116.97 114.81 2rpc h TYR 76 Ca -0.02 0.00 -0.05 0.00 -0.00 0.00 0.00 58.73 58.66 2rpc h TYR 76 Cb 0.47 0.00 -0.03 0.00 -0.00 0.00 0.00 36.73 37.17 2rpc h TYR 76 CO 0.05 0.00 0.16 0.87 -0.00 0.00 0.00 178.16 179.24 2rpc h LYS 77 N 0.00 0.88 0.22 0.10 1.79 -1.93 -2.37 116.57 115.25 2rpc h LYS 77 Ca 0.03 -0.17 -0.28 0.00 -2.18 0.00 0.00 60.65 58.04 2rpc h LYS 77 Cb 0.22 -0.14 0.03 0.00 -1.58 0.00 0.00 32.23 30.77 2rpc h LYS 77 CO -0.00 0.78 -1.25 1.25 -1.08 0.00 0.00 179.45 179.15 2rpc h LEU 78 N 0.85 0.71 -1.59 2.94 5.85 -1.20 -3.24 115.31 119.64 2rpc h LEU 78 Ca 0.19 -0.93 0.14 0.00 0.84 0.00 0.00 57.88 58.12 2rpc h LEU 78 Cb 0.28 -0.23 -0.05 0.00 0.37 0.00 0.00 40.66 41.03 2rpc h LEU 78 CO -0.01 1.60 0.49 0.58 -0.34 0.00 0.00 178.44 180.77 2rpc h VAL 79 N -0.04 0.81 0.00 1.05 2.07 -1.34 0.22 116.25 119.02 2rpc h VAL 79 Ca -0.22 -0.14 -0.08 0.00 0.82 0.00 0.00 66.70 67.08 2rpc h VAL 79 Cb 1.98 0.36 -0.01 0.00 -1.52 0.00 0.00 31.29 32.10 2rpc h VAL 79 CO 0.23 0.08 -0.39 0.78 0.02 0.00 0.00 177.57 178.29 2rpc h ASN 80 N 0.41 0.00 -0.02 0.57 2.35 -1.50 -3.26 115.58 114.14 2rpc h ASN 80 Ca 0.36 0.00 -0.01 0.00 -0.55 0.00 0.00 56.30 56.10 2rpc h ASN 80 Cb 0.81 0.00 -0.00 0.00 0.05 0.00 0.00 38.32 39.18 2rpc h ASN 80 CO -0.11 0.39 -0.03 -0.74 -1.65 0.00 0.00 177.43 175.29 2rpc h HIS 81 N 0.00 0.05 0.00 1.19 -0.00 -0.60 -2.99 115.15 112.80 2rpc h HIS 81 Ca -0.00 -0.02 0.00 0.00 -0.00 0.00 0.00 60.37 60.35 2rpc h HIS 81 Cb 1.03 -0.01 0.00 0.00 -0.00 0.00 0.00 27.41 28.43 2rpc h HIS 81 CO 0.00 0.58 0.19 0.82 -0.00 0.00 0.00 177.93 179.52 2rpc h ILE 82 N -0.49 0.00 0.00 6.26 2.04 -1.47 0.07 117.51 123.92 2rpc h ILE 82 Ca 0.00 0.00 -0.01 0.00 1.00 0.00 0.00 64.86 65.85 2rpc h ILE 82 Cb 0.58 0.56 -0.00 0.00 -0.74 0.00 0.00 36.82 37.22 2rpc h ILE 82 CO 0.01 0.00 -0.04 0.03 0.00 0.00 0.00 178.15 178.14 2rpc h ARG 83 N 0.00 0.00 0.00 2.37 2.47 -1.59 -0.49 114.38 117.14 2rpc h ARG 83 Ca 0.00 0.00 0.00 0.00 -1.26 0.00 0.00 59.98 58.72 2rpc h ARG 83 Cb 0.38 0.00 0.00 0.00 -1.65 0.00 0.00 29.97 28.70 2rpc h ARG 83 CO 0.00 0.04 -0.37 -0.39 0.56 0.00 0.00 179.97 179.82 2rpc h VAL 84 N 0.00 0.00 0.00 2.04 -1.51 -1.15 -3.26 116.25 112.36 2rpc h VAL 84 Ca -0.00 -1.00 -0.09 0.00 -1.23 0.00 0.00 66.70 64.39 2rpc h VAL 84 Cb 0.11 1.82 -0.01 0.00 -2.13 0.00 0.00 31.29 31.07 2rpc h VAL 84 CO 0.01 0.00 -0.41 0.45 -1.23 0.00 0.00 177.57 176.39 2rpc h HIS 85 N 0.00 0.00 0.66 5.19 3.86 -1.21 -3.31 115.15 120.34 2rpc h HIS 85 Ca 0.00 0.00 -0.03 0.00 -1.16 0.00 0.00 60.37 59.18 2rpc h HIS 85 Cb 1.00 0.00 0.01 0.00 1.06 0.00 0.00 27.41 29.48 2rpc h HIS 85 CO 0.00 0.41 -0.32 1.79 0.86 0.00 0.00 177.93 180.67 2rpc h THR 86 N 0.00 0.27 0.00 2.45 1.35 -1.57 -3.48 112.91 111.93 2rpc h THR 86 Ca -0.00 -0.21 0.00 0.00 -0.55 0.00 0.00 66.41 65.65 2rpc h THR 86 Cb 1.09 0.33 0.00 0.00 -1.73 0.00 0.00 68.15 67.84 2rpc h THR 86 CO 0.05 0.02 0.00 0.61 -0.25 0.00 0.00 175.52 175.96 2rpc n GLY 87 N -1.03 1.02 3.41 5.82 0.00 -1.25 -4.86 105.19 108.31 2rpc n GLY 87 Ca -0.13 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.50 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 3.19 0.04 1.61 2.12 -1.26 -5.08 118.70 119.33 2rpc s GLU 88 Ca 0.00 -0.82 0.03 0.00 0.36 0.00 0.00 54.97 54.55 2rpc s GLU 88 Cb 0.00 -3.58 -0.02 0.00 0.26 0.00 0.00 34.13 30.79 2rpc s GLU 88 CO 0.00 -0.48 -0.11 0.15 -0.54 0.00 0.00 175.26 174.28 2rpc s LYS 89 N 1.58 0.68 -0.02 4.30 -0.14 -1.26 -4.87 119.74 120.02 2rpc s LYS 89 Ca 0.04 -0.74 -0.25 0.00 -1.36 0.00 0.00 55.97 53.65 2rpc s LYS 89 Cb -0.18 -0.59 -0.19 0.00 -1.68 0.00 0.00 37.83 35.19 2rpc s LYS 89 CO 0.06 0.13 1.21 -1.00 -0.76 0.00 0.00 175.35 174.99 2rpc h PRO 90 N 4.71 -0.08 -2.25 -1.68 0.13 -1.86 -3.45 132.00 127.51 2rpc h PRO 90 Ca -0.37 0.01 -0.01 0.00 -0.87 0.00 0.00 66.00 64.76 2rpc h PRO 90 Cb 1.19 0.02 -0.24 0.00 0.13 0.00 0.00 31.00 32.11 2rpc h PRO 90 CO 0.42 0.37 -0.23 -0.59 -0.23 0.00 0.00 178.00 177.75 2rpc s PHE 91 N -4.20 -1.06 0.00 1.56 -0.12 -1.26 -5.17 117.98 107.73 2rpc s PHE 91 Ca -0.15 1.93 0.00 0.00 -0.05 0.00 0.00 56.93 58.65 2rpc s PHE 91 Cb 0.02 0.56 0.00 0.00 -0.63 0.00 0.00 43.02 42.96 2rpc s PHE 91 CO 0.63 -0.56 0.00 -0.35 -0.05 0.00 0.00 175.22 174.89 2rpc n PRO 92 N 5.30 0.02 -3.26 1.99 -0.04 -1.26 -4.37 135.00 133.37 2rpc n PRO 92 Ca -0.12 0.00 -0.39 0.00 -0.04 0.00 0.00 63.50 62.96 2rpc n PRO 92 Cb 0.50 0.00 -0.06 0.00 -0.04 0.00 0.00 33.50 33.90 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 5.56 0.00 -6.61 0.00 0.13 -1.95 -3.44 132.00 125.69 2rpc h PRO 94 Ca -0.46 0.00 -0.53 0.00 -0.87 0.00 0.00 66.00 64.15 2rpc h PRO 94 Cb 1.20 0.00 0.02 0.00 0.13 0.00 0.00 31.00 32.35 2rpc h PRO 94 CO 0.69 0.10 0.61 0.12 -0.23 0.00 0.00 178.00 179.29 2rpc s PHE 95 N -3.74 3.36 -0.02 1.56 2.19 -1.26 -4.96 117.98 115.10 2rpc s PHE 95 Ca 0.00 1.27 -0.23 0.00 0.33 0.00 0.00 56.93 58.30 2rpc s PHE 95 Cb 0.10 -3.51 -0.17 0.00 -1.31 0.00 0.00 43.02 38.13 2rpc s PHE 95 CO 0.58 -1.58 1.09 -1.00 1.83 0.00 0.00 175.22 176.14 2rpc h PRO 96 N 5.85 -0.25 -1.85 10.12 0.13 -2.03 -3.23 132.00 140.73 2rpc h PRO 96 Ca -0.44 0.02 -0.01 0.00 -0.87 0.00 0.00 66.00 64.70 2rpc h PRO 96 Cb 1.21 0.06 -0.00 0.00 0.13 0.00 0.00 31.00 32.40 2rpc h PRO 96 CO 0.78 0.14 0.01 0.41 -0.23 0.00 0.00 178.00 179.12 2rpc n GLY 97 N 0.15 2.49 1.52 1.56 0.00 -1.26 -3.90 105.19 105.76 2rpc n GLY 97 Ca -0.09 -0.04 0.00 0.00 0.00 0.00 0.00 46.02 45.90 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 2.49 1.20 3.86 0.00 0.00 -1.23 -4.98 105.19 106.53 2rpc n GLY 99 Ca 0.00 -0.28 -0.32 0.00 0.00 0.00 0.00 46.02 45.41 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 -3.59 3.92 0.00 1.61 2.47 -1.26 -4.88 119.74 118.01 2rpc s LYS 100 Ca 0.00 0.53 -0.03 0.00 -1.56 0.00 0.00 55.97 54.90 2rpc s LYS 100 Cb 0.00 -2.49 -0.01 0.00 -1.46 0.00 0.00 37.83 33.87 2rpc s LYS 100 CO 0.00 0.19 0.05 0.42 0.16 0.00 0.00 175.35 176.17 2rpc s ILE 101 N -1.97 0.07 0.06 5.43 1.01 -1.26 0.21 121.20 124.75 2rpc s ILE 101 Ca 0.52 -0.60 0.05 0.00 0.00 0.00 0.00 60.65 60.61 2rpc s ILE 101 Cb -0.10 -0.28 -0.03 0.00 0.01 0.00 0.00 42.46 42.06 2rpc s ILE 101 CO 0.20 -0.33 -0.14 -0.36 0.00 0.00 0.00 174.94 174.31 2rpc s PHE 102 N -1.05 1.18 -0.77 3.97 0.40 -1.26 -5.01 117.98 115.43 2rpc s PHE 102 Ca -0.11 -0.43 0.26 0.00 -0.60 0.00 0.00 56.93 56.04 2rpc s PHE 102 Cb -0.07 -0.67 0.92 0.00 0.51 0.00 0.00 43.02 43.71 2rpc s PHE 102 CO 0.00 0.04 1.79 0.00 0.70 0.00 0.00 175.22 177.76 2rpc n ALA 103 N 1.44 2.20 -2.54 5.36 0.00 -1.26 -4.45 120.51 121.27 2rpc n ALA 103 Ca -0.20 -0.03 -0.30 0.00 0.00 0.00 0.00 53.44 52.91 2rpc n ALA 103 Cb 0.54 -1.45 -0.11 0.00 0.00 0.00 0.00 19.45 18.43 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 -3.10 2.00 -0.07 0.00 3.00 -1.26 -4.78 118.95 114.74 2rpc s ARG 104 Ca 0.11 -1.08 -0.27 0.00 0.00 0.00 0.00 55.73 54.49 2rpc s ARG 104 Cb 0.13 -2.23 -0.22 0.00 0.00 0.00 0.00 34.95 32.64 2rpc s ARG 104 CO 0.55 0.50 1.06 1.03 0.00 0.00 0.00 175.30 178.43 2rpc h SER 105 N 3.71 -0.01 -0.64 0.23 0.87 -1.96 -3.12 113.55 112.63 2rpc h SER 105 Ca -0.49 -0.66 0.04 0.00 -1.23 0.00 0.00 61.79 59.45 2rpc h SER 105 Cb 1.17 0.00 -0.04 0.00 -0.44 0.00 0.00 62.40 63.09 2rpc h SER 105 CO 0.50 0.66 0.42 -0.08 -0.53 0.00 0.00 176.83 177.80 2rpc h GLU 106 N -0.70 0.69 0.00 2.24 4.81 -1.98 -0.01 114.58 119.63 2rpc h GLU 106 Ca -0.00 -0.04 -0.04 0.00 -0.13 0.00 0.00 59.36 59.15 2rpc h GLU 106 Cb 0.67 -0.16 -0.01 0.00 0.63 0.00 0.00 28.75 29.89 2rpc h GLU 106 CO 0.00 0.46 -0.18 -0.91 -0.73 0.00 0.00 179.01 177.65 2rpc h ASN 107 N 0.71 0.00 0.00 1.04 -0.26 -1.98 -1.28 115.58 113.81 2rpc h ASN 107 Ca 0.26 0.00 -0.05 0.00 -0.56 0.00 0.00 56.30 55.95 2rpc h ASN 107 Cb 0.15 0.00 -0.01 0.00 -1.06 0.00 0.00 38.32 37.40 2rpc h ASN 107 CO -0.08 0.18 -0.44 0.25 -1.06 0.00 0.00 177.43 176.28 2rpc h LEU 108 N 0.00 0.00 -2.08 1.61 5.85 -1.01 -2.94 115.31 116.73 2rpc h LEU 108 Ca -0.00 -0.28 0.08 0.00 0.84 0.00 0.00 57.88 58.52 2rpc h LEU 108 Cb 0.35 0.00 -0.01 0.00 0.37 0.00 0.00 40.66 41.37 2rpc h LEU 108 CO 0.02 0.88 0.34 0.11 -0.34 0.00 0.00 178.44 179.45 2rpc h LYS 109 N -1.00 0.00 0.05 1.25 1.57 -1.10 0.21 116.57 117.54 2rpc h LYS 109 Ca -0.07 0.00 -0.28 0.00 -1.87 0.00 0.00 60.65 58.43 2rpc h LYS 109 Cb 0.61 0.00 -0.03 0.00 0.08 0.00 0.00 32.23 32.90 2rpc h LYS 109 CO -0.04 0.00 -1.45 0.82 -0.57 0.00 0.00 179.45 178.21 2rpc h ILE 110 N 0.00 1.20 0.00 1.86 2.04 -1.36 -3.31 117.51 117.94 2rpc h ILE 110 Ca 0.13 -2.93 0.00 0.00 1.00 0.00 0.00 64.86 63.05 2rpc h ILE 110 Cb 0.80 2.67 0.00 0.00 -0.74 0.00 0.00 36.82 39.56 2rpc h ILE 110 CO -0.00 0.76 -0.02 -0.74 0.00 0.00 0.00 178.15 178.15 2rpc h HIS 111 N 0.03 0.00 0.00 1.37 -0.00 -0.54 -3.03 115.15 112.98 2rpc h HIS 111 Ca -0.20 0.00 -0.11 0.00 -0.00 0.00 0.00 60.37 60.07 2rpc h HIS 111 Cb 1.95 0.00 -0.02 0.00 -0.00 0.00 0.00 27.41 29.34 2rpc h HIS 111 CO 0.03 0.00 -0.52 0.87 -0.00 0.00 0.00 177.93 178.31 2rpc h LYS 112 N 0.00 0.00 0.09 5.26 1.57 -0.90 2.02 116.57 124.61 2rpc h LYS 112 Ca 0.00 0.00 -0.31 0.00 -1.87 0.00 0.00 60.65 58.47 2rpc h LYS 112 Cb 0.96 0.00 -0.02 0.00 0.08 0.00 0.00 32.23 33.25 2rpc h LYS 112 CO 0.00 0.52 -1.63 0.07 -0.57 0.00 0.00 179.45 177.84 2rpc h ARG 113 N 0.00 0.19 0.00 3.15 0.11 -1.64 -3.36 114.38 112.83 2rpc h ARG 113 Ca -0.01 -0.32 0.00 0.00 0.10 0.00 0.00 59.98 59.75 2rpc h ARG 113 Cb 1.14 0.12 0.00 0.00 1.11 0.00 0.00 29.97 32.34 2rpc h ARG 113 CO 0.07 0.99 -1.77 -2.37 0.10 0.00 0.00 179.97 176.99 2rpc n THR 114 N -3.37 0.04 -3.11 0.08 5.66 -1.15 -4.97 114.28 107.46 2rpc n THR 114 Ca -0.19 -0.42 -0.03 0.00 -3.05 0.00 0.00 64.05 60.37 2rpc n THR 114 Cb 1.04 0.13 -0.00 0.00 -1.55 0.00 0.00 70.33 69.95 2rpc n THR 114 CO 0.00 0.00 0.00 1.57 -3.05 0.00 0.00 175.07 173.59 2rpc n HIS 115 N -2.16 -0.09 -3.20 1.09 -0.00 0.68 -4.82 115.22 106.73 2rpc n HIS 115 Ca -0.02 0.02 -0.26 0.00 0.46 0.00 0.00 57.72 57.92 2rpc n HIS 115 Cb 0.53 -0.19 -0.02 0.00 -0.12 0.00 0.00 29.99 30.20 2rpc n HIS 115 CO 0.00 0.00 0.00 0.99 0.46 0.00 0.00 176.34 177.79 2rpc s THR 116 N -3.88 5.03 0.00 3.57 2.01 -1.26 -4.41 115.64 116.70 2rpc s THR 116 Ca 0.01 -0.14 0.00 0.00 0.31 0.00 0.00 61.69 61.87 2rpc s THR 116 Cb -0.01 -3.82 0.00 0.00 0.01 0.00 0.00 72.50 68.68 2rpc s THR 116 CO 0.07 -0.55 0.00 0.61 -0.69 0.00 0.00 174.62 174.06 2rpc n GLY 117 N -1.61 1.65 3.72 4.40 0.00 -1.26 -4.92 105.19 107.17 2rpc n GLY 117 Ca -0.03 -0.09 -0.41 0.00 0.00 0.00 0.00 46.02 45.50 2rpc n GLY 117 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2rpc s GLU 118 N 0.00 4.54 0.09 1.61 0.41 -1.26 -5.06 118.70 119.02 2rpc s GLU 118 Ca 0.00 1.22 0.09 0.00 -0.41 0.00 0.00 54.97 55.87 2rpc s GLU 118 Cb 0.00 -3.43 -0.03 0.00 -1.78 0.00 0.00 34.13 28.89 2rpc s GLU 118 CO 0.00 0.08 -0.25 -1.59 -0.49 0.00 0.00 175.26 173.01 2rpc s LYS 119 N 0.61 1.46 0.12 1.61 0.00 -1.26 -5.01 119.74 117.27 2rpc s LYS 119 Ca 0.45 -1.18 -0.13 0.00 0.00 0.00 0.00 55.97 55.11 2rpc s LYS 119 Cb -0.20 -1.77 -0.06 0.00 0.00 0.00 0.00 37.83 35.79 2rpc s LYS 119 CO 0.25 0.43 1.45 -1.00 0.00 0.00 0.00 175.35 176.48 2rpc h PRO 120 N 4.33 0.84 -4.89 1.78 0.13 -1.69 -3.42 132.00 129.08 2rpc h PRO 120 Ca -0.48 -0.45 -0.67 0.00 -0.87 0.00 0.00 66.00 63.54 2rpc h PRO 120 Cb 1.16 0.02 -0.33 0.00 0.13 0.00 0.00 31.00 31.98 2rpc h PRO 120 CO 0.41 1.08 -0.76 -0.06 -0.23 0.00 0.00 178.00 178.44 2rpc s PHE 121 N -4.37 3.12 -0.05 1.56 0.40 -0.96 -4.86 117.98 112.82 2rpc s PHE 121 Ca -0.12 -1.78 0.07 0.00 -0.60 0.00 0.00 56.93 54.50 2rpc s PHE 121 Cb 0.10 -2.03 -0.01 0.00 0.51 0.00 0.00 43.02 41.59 2rpc s PHE 121 CO 0.86 -0.78 -0.25 0.21 0.70 0.00 0.00 175.22 175.96 2rpc s LYS 122 N 1.26 2.42 -0.44 0.44 2.20 -1.26 0.13 119.74 124.50 2rpc s LYS 122 Ca -0.02 -0.91 -0.44 0.00 -0.36 0.00 0.00 55.97 54.24 2rpc s LYS 122 Cb -0.18 -2.12 -0.18 0.00 -1.51 0.00 0.00 37.83 33.84 2rpc s LYS 122 CO -0.05 0.43 1.74 0.00 -0.36 0.00 0.00 175.35 177.11 2rpc n GLU 124 N 5.03 0.38 -2.36 0.00 1.02 -1.26 -4.80 120.64 118.65 2rpc n GLU 124 Ca 0.34 0.07 -0.40 0.00 -0.02 0.00 0.00 57.16 57.14 2rpc n GLU 124 Cb 0.00 -1.50 -0.04 0.00 -0.02 0.00 0.00 31.44 29.89 2rpc n GLU 124 CO 0.00 0.00 0.00 0.12 1.18 0.00 0.00 177.13 178.43 2rpc s PHE 125 N -2.47 3.41 0.62 -0.32 5.36 -1.26 -5.01 117.98 118.31 2rpc s PHE 125 Ca 0.23 1.59 -0.15 0.00 -0.96 0.00 0.00 56.93 57.64 2rpc s PHE 125 Cb 0.15 -3.42 -0.02 0.00 -0.34 0.00 0.00 43.02 39.39 2rpc s PHE 125 CO 0.32 -1.00 1.06 -2.00 -1.46 0.00 0.00 175.22 172.14 2rpc s GLU 126 N -1.42 3.16 -0.74 10.12 2.12 -1.26 -3.19 118.70 127.49 2rpc s GLU 126 Ca 0.47 1.18 0.00 0.00 0.36 0.00 0.00 54.97 56.98 2rpc s GLU 126 Cb -0.34 -2.01 0.00 0.00 0.26 0.00 0.00 34.13 32.04 2rpc s GLU 126 CO 0.44 -0.94 0.00 0.41 -0.54 0.00 0.00 175.26 174.63 2rpc n GLY 127 N -1.10 0.66 3.37 -1.50 0.00 -1.26 -4.93 105.19 100.43 2rpc n GLY 127 Ca 0.09 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.79 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 -0.54 4.13 0.28 0.00 1.47 -1.26 -4.87 116.67 115.88 2rpc s ASP 129 Ca 0.07 -1.47 -0.03 0.00 1.18 0.00 0.00 52.55 52.31 2rpc s ASP 129 Cb -0.11 -1.26 -0.01 0.00 -0.34 0.00 0.00 42.92 41.19 2rpc s ASP 129 CO 0.01 -0.29 0.36 -0.13 0.68 0.00 0.00 175.17 175.80 2rpc s ARG 130 N 1.29 1.63 -0.02 2.11 1.81 -1.26 -5.04 118.95 119.47 2rpc s ARG 130 Ca -0.01 -1.65 -0.03 0.00 -1.72 0.00 0.00 55.73 52.33 2rpc s ARG 130 Cb -0.19 0.39 0.00 0.00 -0.45 0.00 0.00 34.95 34.70 2rpc s ARG 130 CO -0.09 -0.64 0.08 -0.98 -0.68 0.00 0.00 175.30 172.99 2rpc s ARG 131 N -3.61 0.19 0.07 3.54 1.04 -1.26 -4.00 118.95 114.91 2rpc s ARG 131 Ca 0.32 -0.06 -0.05 0.00 -1.04 0.00 0.00 55.73 54.91 2rpc s ARG 131 Cb 0.02 0.08 -0.02 0.00 -2.04 0.00 0.00 34.95 32.99 2rpc s ARG 131 CO 0.17 -0.03 0.07 -0.06 -0.04 0.00 0.00 175.30 175.41 2rpc s PHE 132 N -0.38 0.36 -0.01 5.89 0.08 0.34 -4.97 117.98 119.29 2rpc s PHE 132 Ca -0.04 -0.85 0.10 0.00 0.12 0.00 0.00 56.93 56.25 2rpc s PHE 132 Cb -0.03 -0.24 -0.15 0.00 -0.57 0.00 0.00 43.02 42.03 2rpc s PHE 132 CO 0.00 -0.46 0.21 0.00 -0.10 0.00 0.00 175.22 174.87 2rpc n ALA 133 N 0.02 2.35 -2.63 5.36 0.00 -1.26 -2.27 120.51 122.08 2rpc n ALA 133 Ca -0.14 -0.24 -0.19 0.00 0.00 0.00 0.00 53.44 52.87 2rpc n ALA 133 Cb 0.62 -0.33 -0.12 0.00 0.00 0.00 0.00 19.45 19.62 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 -3.14 1.93 0.18 0.00 6.03 -1.26 -4.81 114.94 113.87 2rpc s ASN 134 Ca -0.04 -0.67 -0.15 0.00 -1.03 0.00 0.00 52.86 50.98 2rpc s ASN 134 Cb 0.06 -0.07 0.16 0.00 -3.03 0.00 0.00 41.25 38.37 2rpc s ASN 134 CO 0.40 -0.06 1.68 0.77 -2.03 0.00 0.00 177.10 177.86 2rpc h SER 135 N 4.09 -0.25 0.25 3.54 4.64 -1.99 -2.36 113.55 121.47 2rpc h SER 135 Ca -0.42 0.12 0.01 0.00 -0.47 0.00 0.00 61.79 61.02 2rpc h SER 135 Cb 1.19 0.21 -0.03 0.00 -0.31 0.00 0.00 62.40 63.47 2rpc h SER 135 CO 0.42 -0.08 -0.31 0.77 -0.87 0.00 0.00 176.83 176.76 2rpc h SER 136 N 0.09 -0.84 -1.23 4.97 4.64 -1.97 -0.75 113.55 118.45 2rpc h SER 136 Ca 0.23 0.08 0.36 0.00 -0.47 0.00 0.00 61.79 61.99 2rpc h SER 136 Cb 0.35 0.30 -0.05 0.00 -0.31 0.00 0.00 62.40 62.68 2rpc h SER 136 CO -0.41 -0.42 1.01 0.44 -0.87 0.00 0.00 176.83 176.59 2rpc h ASP 137 N -0.60 0.00 0.00 4.97 5.19 -1.85 0.87 116.42 125.00 2rpc h ASP 137 Ca -0.00 0.00 -0.05 0.00 -0.62 0.00 0.00 57.03 56.36 2rpc h ASP 137 Cb 0.58 0.00 -0.01 0.00 0.18 0.00 0.00 39.33 40.08 2rpc h ASP 137 CO -0.10 0.00 -0.31 -0.09 -3.12 0.00 0.00 179.24 175.62 2rpc h ARG 138 N 0.00 0.00 0.00 3.56 2.43 -0.89 -3.30 114.38 116.18 2rpc h ARG 138 Ca 0.59 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.76 2rpc h ARG 138 Cb 2.61 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 32.16 2rpc h ARG 138 CO -0.01 0.67 0.00 1.57 -1.51 0.00 0.00 179.97 180.70 2rpc h LYS 139 N -1.00 0.00 0.00 0.20 2.10 0.37 -1.73 116.57 116.51 2rpc h LYS 139 Ca -0.07 0.00 -0.02 0.00 -2.00 0.00 0.00 60.65 58.56 2rpc h LYS 139 Cb 0.79 0.00 -0.00 0.00 -0.90 0.00 0.00 32.23 32.11 2rpc h LYS 139 CO -0.04 0.00 -0.08 0.87 -2.00 0.00 0.00 179.45 178.20 2rpc h LYS 140 N 0.00 0.00 -0.01 0.07 1.57 0.55 -3.05 116.57 115.70 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 0.26 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.57 2rpc h LYS 140 CO 0.00 0.08 -0.01 1.58 -0.57 0.00 0.00 179.45 180.54 2rpc n HIS 141 N -3.13 0.00 0.10 -1.35 -0.00 -0.65 -3.63 115.22 106.57 2rpc n HIS 141 Ca 0.03 0.00 0.06 0.00 0.46 0.00 0.00 57.72 58.27 2rpc n HIS 141 Cb 0.54 -0.00 -0.00 0.00 -0.12 0.00 0.00 29.99 30.40 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 1.89 0.00 -0.03 1.57 2.86 -1.61 -3.32 114.93 116.28 2rpc h MET 142 Ca 0.00 0.00 0.01 0.00 -2.06 0.00 0.00 59.70 57.65 2rpc h MET 142 Cb 0.41 0.00 -0.00 0.00 0.06 0.00 0.00 31.60 32.07 2rpc h MET 142 CO 0.00 0.21 0.36 0.45 1.06 0.00 0.00 176.91 178.99 2rpc h HIS 143 N 0.00 0.00 0.00 -0.22 3.86 -1.72 0.64 115.15 117.71 2rpc h HIS 143 Ca -0.06 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 59.15 2rpc h HIS 143 Cb 1.29 0.00 0.00 0.00 1.06 0.00 0.00 27.41 29.76 2rpc h HIS 143 CO 0.00 0.00 -1.62 1.55 0.86 0.00 0.00 177.93 178.72 2rpc n VAL 144 N -2.94 0.00 1.08 2.45 3.14 -1.25 -4.16 118.33 116.66 2rpc n VAL 144 Ca -0.01 -0.31 0.13 0.00 -2.96 0.00 0.00 64.34 61.18 2rpc n VAL 144 Cb 0.42 0.37 0.61 0.00 -1.06 0.00 0.00 33.84 34.18 2rpc n VAL 144 CO 0.00 0.00 0.00 1.41 -6.46 0.00 0.00 176.83 171.78 2rpc n HIS 145 N -1.97 0.00 -0.10 1.45 8.25 0.22 -3.80 115.22 119.27 2rpc n HIS 145 Ca -0.01 0.00 0.24 0.00 -0.26 0.00 0.00 57.72 57.69 2rpc n HIS 145 Cb 0.48 -0.39 0.47 0.00 1.12 0.00 0.00 29.99 31.66 2rpc n HIS 145 CO 0.00 0.00 0.00 1.79 0.64 0.00 0.00 176.34 178.77 2rpc h THR 146 N 0.00 0.07 -1.10 1.59 1.35 -1.67 -3.39 112.91 109.75 2rpc h THR 146 Ca 0.00 0.00 -0.55 0.00 -0.55 0.00 0.00 66.41 65.31 2rpc h THR 146 Cb 0.35 0.14 -0.05 0.00 -1.73 0.00 0.00 68.15 66.85 2rpc h THR 146 CO 0.00 0.00 -0.37 -0.44 -0.25 0.00 0.00 175.52 174.46 2rpc s SER 147 N -3.77 4.71 0.04 5.36 0.01 -1.25 -5.15 113.70 113.65 2rpc s SER 147 Ca -0.03 -1.05 0.07 0.00 1.31 0.00 0.00 55.95 56.25 2rpc s SER 147 Cb 0.13 -0.10 -0.02 0.00 0.21 0.00 0.00 66.02 66.24 2rpc s SER 147 CO 0.44 -0.83 -0.20 -0.62 0.41 0.00 0.00 173.24 172.44 2rpc s ASP 148 N -4.15 2.33 -0.28 2.44 -1.08 -1.26 -5.10 116.67 109.56 2rpc s ASP 148 Ca 0.40 -0.49 -0.03 0.00 -0.52 0.00 0.00 52.55 51.91 2rpc s ASP 148 Cb -0.01 -0.20 0.03 0.00 -1.46 0.00 0.00 42.92 41.28 2rpc s ASP 148 CO 0.24 0.15 0.00 -0.75 0.52 0.00 0.00 175.17 175.33 2rpc s LYS 149 N -1.07 2.77 0.27 4.34 2.20 -1.26 -5.08 119.74 121.90 2rpc s LYS 149 Ca 0.07 -1.05 -0.26 0.00 -0.36 0.00 0.00 55.97 54.37 2rpc s LYS 149 Cb -0.08 -3.17 -0.16 0.00 -1.51 0.00 0.00 37.83 32.90 2rpc s LYS 149 CO 0.01 -0.49 0.52 0.45 -0.36 0.00 0.00 175.35 175.48 2rpc n SER 150 N 4.72 -1.13 0.00 1.43 2.88 -1.26 -4.84 113.62 115.42 2rpc n SER 150 Ca -0.15 1.06 0.00 0.00 -1.33 0.00 0.00 58.87 58.45 2rpc n SER 150 Cb 0.46 -1.00 0.00 0.00 -0.75 0.00 0.00 64.21 62.92 2rpc n SER 150 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 2rpc n GLY 151 N 1.92 -1.24 0.00 0.46 0.00 -1.26 -5.16 105.19 99.91 2rpc n GLY 151 Ca 0.15 0.56 0.00 0.00 0.00 0.00 0.00 46.02 46.73 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 -0.06 -0.86 -4.14 1.61 -0.04 -1.26 -5.09 135.00 125.16 2rpc n PRO 152 Ca 0.00 0.00 -0.15 0.00 -0.04 0.00 0.00 63.50 63.31 2rpc n PRO 152 Cb 0.00 0.00 -0.12 0.00 -0.04 0.00 0.00 33.50 33.34 2rpc n PRO 152 CO 0.00 0.00 0.00 0.45 -0.04 0.00 0.00 175.50 175.91 2rpc s SER 153 N -1.51 0.99 -0.57 3.54 0.15 -1.26 -5.11 113.70 109.92 2rpc s SER 153 Ca 0.00 -0.44 -0.18 0.00 0.70 0.00 0.00 55.95 56.03 2rpc s SER 153 Cb 0.00 -0.02 0.11 0.00 -1.71 0.00 0.00 66.02 64.40 2rpc s SER 153 CO 0.00 -0.09 0.64 -0.94 1.20 0.00 0.00 173.24 174.05 2rpc s SER 154 N -1.19 6.18 0.00 5.45 1.04 -1.26 -5.33 113.70 118.59 2rpc s SER 154 Ca -0.05 -1.53 0.27 0.00 0.48 0.00 0.00 55.95 55.12 2rpc s SER 154 Cb -0.08 -2.27 0.76 0.00 0.10 0.00 0.00 66.02 64.53 2rpc s SER 154 CO 0.01 -1.03 1.58 0.61 0.98 0.00 0.00 173.24 175.38