#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 -0.34 0.25 1.61 0.15 -1.26 -5.18 113.70 108.94 2rpc s SER 2 Ca 0.00 0.65 0.08 0.00 0.70 0.00 0.00 55.95 57.37 2rpc s SER 2 Cb 0.00 0.65 -0.04 0.00 -1.71 0.00 0.00 66.02 64.93 2rpc s SER 2 CO 0.00 -0.12 0.15 -0.55 1.20 0.00 0.00 173.24 173.92 2rpc s SER 3 N 0.13 5.28 -0.20 5.45 0.15 -1.26 -5.13 113.70 118.12 2rpc s SER 3 Ca 0.04 -0.35 -0.33 0.00 0.70 0.00 0.00 55.95 56.01 2rpc s SER 3 Cb -0.05 -1.27 0.15 0.00 -1.71 0.00 0.00 66.02 63.14 2rpc s SER 3 CO -0.09 -0.03 1.21 -0.83 1.20 0.00 0.00 173.24 174.71 2rpc s GLY 4 N -3.80 -0.21 -0.22 9.45 0.00 -1.26 -5.14 107.32 106.14 2rpc s GLY 4 Ca 0.32 1.91 0.01 0.00 0.00 0.00 0.00 44.72 46.97 2rpc s GLY 4 CO 0.24 0.72 -0.15 -1.35 0.00 0.00 0.00 173.10 172.55 2rpc s SER 5 N -1.80 3.74 1.20 1.64 1.04 -1.26 -5.12 113.70 113.14 2rpc s SER 5 Ca 0.08 -0.93 -0.17 0.00 0.48 0.00 0.00 55.95 55.40 2rpc s SER 5 Cb -0.01 -1.53 0.23 0.00 0.10 0.00 0.00 66.02 64.81 2rpc s SER 5 CO -0.05 -0.08 0.51 -1.54 0.98 0.00 0.00 173.24 173.07 2rpc n SER 6 N 4.56 -2.69 0.00 7.02 3.41 -1.26 -4.93 113.62 119.73 2rpc n SER 6 Ca -0.18 -0.34 0.00 0.00 -0.26 0.00 0.00 58.87 58.09 2rpc n SER 6 Cb 0.47 -1.02 0.00 0.00 -0.26 0.00 0.00 64.21 63.40 2rpc n SER 6 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2rpc n GLY 7 N 1.79 2.36 3.58 5.00 0.00 -1.26 -5.06 105.19 111.60 2rpc n GLY 7 Ca 0.04 -1.81 -0.33 0.00 0.00 0.00 0.00 46.02 43.92 2rpc n GLY 7 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 2rpc s GLN 8 N -3.58 2.58 0.00 1.61 0.74 -1.26 -5.13 119.66 114.62 2rpc s GLN 8 Ca 0.00 -0.68 0.00 0.00 0.05 0.00 0.00 55.36 54.73 2rpc s GLN 8 Cb 0.00 -2.50 0.00 0.00 1.10 0.00 0.00 33.01 31.61 2rpc s GLN 8 CO 0.00 0.62 0.00 -0.35 -0.55 0.00 0.00 175.29 175.01 2rpc n PRO 9 N 1.81 -0.26 -3.73 1.67 -0.04 -1.26 -5.02 135.00 128.17 2rpc n PRO 9 Ca -0.16 0.00 -0.36 0.00 -0.04 0.00 0.00 63.50 62.94 2rpc n PRO 9 Cb 0.53 0.00 -0.07 0.00 -0.04 0.00 0.00 33.50 33.92 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 -0.63 5.40 -0.33 0.52 1.01 -1.26 -5.06 121.20 120.85 2rpc s ILE 10 Ca 0.00 0.31 -0.23 0.00 0.00 0.00 0.00 60.65 60.74 2rpc s ILE 10 Cb 0.00 -3.49 0.00 0.00 0.01 0.00 0.00 42.46 38.98 2rpc s ILE 10 CO 0.00 0.50 0.74 -1.59 0.00 0.00 0.00 174.94 174.60 2rpc s LYS 11 N -0.19 3.87 -0.12 2.79 -2.85 -1.26 -5.05 119.74 116.93 2rpc s LYS 11 Ca 0.13 0.41 -0.07 0.00 -1.00 0.00 0.00 55.97 55.44 2rpc s LYS 11 Cb -0.12 -3.76 -0.04 0.00 -2.06 0.00 0.00 37.83 31.85 2rpc s LYS 11 CO 0.02 -0.71 0.14 -1.14 0.10 0.00 0.00 175.35 173.76 2rpc s GLN 12 N 2.91 3.43 -0.15 1.78 0.74 -1.23 -5.05 119.66 122.10 2rpc s GLN 12 Ca 0.30 -0.14 -0.19 0.00 0.05 0.00 0.00 55.36 55.38 2rpc s GLN 12 Cb -0.14 -3.18 -0.04 0.00 1.10 0.00 0.00 33.01 30.75 2rpc s GLN 12 CO 0.14 0.78 0.54 -1.21 -0.55 0.00 0.00 175.29 174.99 2rpc s GLU 13 N -1.04 4.29 0.36 1.67 2.02 -1.26 -4.28 118.70 120.46 2rpc s GLU 13 Ca 0.15 0.53 0.07 0.00 0.02 0.00 0.00 54.97 55.74 2rpc s GLU 13 Cb -0.12 -3.49 -0.01 0.00 0.10 0.00 0.00 34.13 30.61 2rpc s GLU 13 CO 0.04 -0.00 0.44 -0.51 0.02 0.00 0.00 175.26 175.25 2rpc s LEU 14 N 1.13 3.79 -0.01 1.80 1.43 -1.22 -4.94 118.68 120.65 2rpc s LEU 14 Ca 0.28 -0.34 0.02 0.00 -1.03 0.00 0.00 54.13 53.05 2rpc s LEU 14 Cb -0.16 -2.56 -0.00 0.00 0.03 0.00 0.00 46.19 43.50 2rpc s LEU 14 CO 0.11 -0.49 -0.07 -0.44 0.23 0.00 0.00 176.35 175.69 2rpc s SER 15 N -4.16 0.90 -0.38 2.29 0.01 -1.26 -4.23 113.70 106.87 2rpc s SER 15 Ca 0.46 -0.14 0.03 0.00 1.31 0.00 0.00 55.95 57.62 2rpc s SER 15 Cb -0.08 -0.16 0.11 0.00 0.21 0.00 0.00 66.02 66.10 2rpc s SER 15 CO 0.30 0.07 0.11 0.00 0.41 0.00 0.00 173.24 174.13 2rpc s LYS 17 N 0.72 3.15 -0.19 0.00 -0.14 -1.26 -4.02 119.74 118.00 2rpc s LYS 17 Ca 0.12 -1.00 -0.06 0.00 -1.36 0.00 0.00 55.97 53.67 2rpc s LYS 17 Cb -0.20 -4.31 -0.03 0.00 -1.68 0.00 0.00 37.83 31.61 2rpc s LYS 17 CO -0.08 -1.78 0.02 -0.46 -0.76 0.00 0.00 175.35 172.29 2rpc s TRP 18 N 3.73 3.09 -0.30 3.18 -0.11 -1.26 -3.72 118.94 123.55 2rpc s TRP 18 Ca 0.22 -0.29 0.02 0.00 1.22 0.00 0.00 56.10 57.27 2rpc s TRP 18 Cb -0.17 -2.08 0.08 0.00 -1.50 0.00 0.00 33.47 29.81 2rpc s TRP 18 CO 0.07 -0.12 0.01 0.42 -4.62 0.00 0.00 176.95 172.71 2rpc s ILE 19 N 0.81 1.83 -0.08 5.86 1.01 0.77 -1.60 121.20 129.79 2rpc s ILE 19 Ca 0.01 -1.80 -0.24 0.00 0.00 0.00 0.00 60.65 58.62 2rpc s ILE 19 Cb -0.14 -2.23 -0.03 0.00 0.01 0.00 0.00 42.46 40.07 2rpc s ILE 19 CO 0.02 -0.42 0.74 -0.62 0.00 0.00 0.00 174.94 174.66 2rpc s ASP 20 N 1.18 7.00 0.25 3.58 2.15 -1.26 -4.37 116.67 125.20 2rpc s ASP 20 Ca 0.04 1.21 -0.03 0.00 0.43 0.00 0.00 52.55 54.20 2rpc s ASP 20 Cb -0.19 -2.43 0.30 0.00 -0.30 0.00 0.00 42.92 40.30 2rpc s ASP 20 CO -0.10 -0.17 1.73 -0.33 -0.17 0.00 0.00 175.17 176.12 2rpc h GLU 21 N 6.87 0.80 -0.96 4.34 5.08 -1.99 -2.42 114.58 126.30 2rpc h GLU 21 Ca -0.39 -0.23 -0.12 0.00 -1.00 0.00 0.00 59.36 57.62 2rpc h GLU 21 Cb 1.19 -0.08 -0.07 0.00 0.50 0.00 0.00 28.75 30.28 2rpc h GLU 21 CO 0.76 0.83 0.15 0.00 -1.00 0.00 0.00 179.01 179.76 2rpc n ALA 22 N -2.48 3.34 -2.71 3.43 0.00 -1.26 -4.89 120.51 115.94 2rpc n ALA 22 Ca 0.02 -0.84 -0.41 0.00 0.00 0.00 0.00 53.44 52.20 2rpc n ALA 22 Cb 0.33 -1.11 -0.03 0.00 0.00 0.00 0.00 19.45 18.63 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 -1.22 4.52 0.00 0.00 -2.07 -0.91 -4.92 119.66 115.05 2rpc s GLN 23 Ca 0.18 1.29 0.29 0.00 -1.82 0.00 0.00 55.36 55.30 2rpc s GLN 23 Cb 0.15 -3.46 1.43 0.00 -1.09 0.00 0.00 33.01 30.03 2rpc s GLN 23 CO 0.04 -0.05 1.98 -0.11 -1.32 0.00 0.00 175.29 175.84 2rpc n LEU 24 N 3.97 0.00 -4.72 2.60 7.94 -1.26 -4.79 117.00 120.74 2rpc n LEU 24 Ca 0.04 0.31 -0.41 0.00 -1.11 0.00 0.00 56.01 54.84 2rpc n LEU 24 Cb 0.51 -0.31 -0.04 0.00 0.53 0.00 0.00 43.42 44.11 2rpc n LEU 24 CO 0.51 -0.02 0.65 -0.94 -1.11 0.00 0.00 177.39 176.49 2rpc s SER 25 N -2.61 7.40 -0.02 1.96 1.04 -1.26 -5.05 113.70 115.16 2rpc s SER 25 Ca 0.26 1.69 0.00 0.00 0.48 0.00 0.00 55.95 58.38 2rpc s SER 25 Cb 0.19 -2.57 0.02 0.00 0.10 0.00 0.00 66.02 63.76 2rpc s SER 25 CO 0.44 -0.16 -0.00 -0.60 0.98 0.00 0.00 173.24 173.90 2rpc s ARG 26 N 0.51 0.24 1.17 4.02 6.06 -1.26 -3.79 118.95 125.91 2rpc s ARG 26 Ca 0.49 0.04 -0.18 0.00 -2.50 0.00 0.00 55.73 53.58 2rpc s ARG 26 Cb -0.22 -0.38 0.27 0.00 0.06 0.00 0.00 34.95 34.68 2rpc s ARG 26 CO 0.28 -0.09 1.11 -1.25 -2.50 0.00 0.00 175.30 172.85 2rpc s PRO 27 N 0.73 -0.98 -0.05 5.12 0.04 -1.26 -5.05 135.00 133.55 2rpc s PRO 27 Ca -0.07 0.02 -0.30 0.00 0.04 0.00 0.00 61.00 60.70 2rpc s PRO 27 Cb -0.10 -1.62 -0.07 0.00 0.04 0.00 0.00 34.50 32.76 2rpc s PRO 27 CO -0.01 -3.57 1.85 0.15 0.04 0.00 0.00 177.00 175.46 2rpc s LYS 28 N -5.33 4.00 0.03 4.56 -0.14 -1.25 -4.99 119.74 116.63 2rpc s LYS 28 Ca 0.70 2.30 0.04 0.00 -1.36 0.00 0.00 55.97 57.65 2rpc s LYS 28 Cb -0.11 -4.11 -0.04 0.00 -1.68 0.00 0.00 37.83 31.89 2rpc s LYS 28 CO 0.56 -1.09 -0.04 -1.59 -0.76 0.00 0.00 175.35 172.44 2rpc s LYS 29 N 4.56 2.56 0.14 1.68 -2.85 -1.26 -5.12 119.74 119.46 2rpc s LYS 29 Ca 0.83 -0.75 -0.14 0.00 -1.00 0.00 0.00 55.97 54.90 2rpc s LYS 29 Cb -0.36 -2.53 -0.07 0.00 -2.06 0.00 0.00 37.83 32.80 2rpc s LYS 29 CO 0.35 0.58 0.55 -1.54 0.10 0.00 0.00 175.35 175.40 2rpc s SER 30 N -1.76 6.83 0.65 0.03 1.04 -1.26 -4.64 113.70 114.60 2rpc s SER 30 Ca 0.20 1.08 -0.18 0.00 0.48 0.00 0.00 55.95 57.54 2rpc s SER 30 Cb -0.11 -2.29 -0.01 0.00 0.10 0.00 0.00 66.02 63.70 2rpc s SER 30 CO 0.12 0.11 1.18 0.00 0.98 0.00 0.00 173.24 175.63 2rpc s ASP 32 N -1.40 2.38 -0.11 0.00 -1.08 -1.26 -4.13 116.67 111.06 2rpc s ASP 32 Ca 0.80 -0.39 -0.33 0.00 -0.52 0.00 0.00 52.55 52.12 2rpc s ASP 32 Cb -0.38 -0.63 0.12 0.00 -1.46 0.00 0.00 42.92 40.57 2rpc s ASP 32 CO 0.43 0.18 1.12 -0.60 0.52 0.00 0.00 175.17 176.82 2rpc s ARG 33 N -0.04 0.48 0.04 4.34 6.06 -1.26 -5.00 118.95 123.56 2rpc s ARG 33 Ca -0.03 -0.19 0.01 0.00 -2.50 0.00 0.00 55.73 53.02 2rpc s ARG 33 Cb -0.12 0.21 -0.02 0.00 0.06 0.00 0.00 34.95 35.08 2rpc s ARG 33 CO 0.02 -0.21 -0.06 0.95 -2.50 0.00 0.00 175.30 173.50 2rpc s THR 34 N -2.63 0.41 0.08 4.11 -4.23 -1.26 -4.34 115.64 107.78 2rpc s THR 34 Ca 0.09 -1.11 -0.11 0.00 -1.18 0.00 0.00 61.69 59.38 2rpc s THR 34 Cb -0.01 -0.61 0.01 0.00 1.34 0.00 0.00 72.50 73.24 2rpc s THR 34 CO -0.05 -0.47 0.25 -0.36 -0.54 0.00 0.00 174.62 173.44 2rpc s PHE 35 N -1.64 0.04 -0.07 3.99 0.40 -1.26 -4.95 117.98 114.49 2rpc s PHE 35 Ca -0.10 -0.38 -0.06 0.00 -0.60 0.00 0.00 56.93 55.79 2rpc s PHE 35 Cb -0.08 0.02 -0.28 0.00 0.51 0.00 0.00 43.02 43.19 2rpc s PHE 35 CO -0.01 -0.55 0.58 0.66 0.70 0.00 0.00 175.22 176.60 2rpc h SER 36 N 2.82 0.45 -2.79 1.36 4.64 -1.98 -3.22 113.55 114.84 2rpc h SER 36 Ca -0.33 -0.80 -0.51 0.00 -0.47 0.00 0.00 61.79 59.67 2rpc h SER 36 Cb 1.21 -0.15 -0.14 0.00 -0.31 0.00 0.00 62.40 63.01 2rpc h SER 36 CO 0.52 1.70 -0.68 0.42 -0.87 0.00 0.00 176.83 177.92 2rpc s THR 37 N -2.58 1.76 0.08 2.95 -4.23 -1.26 -3.48 115.64 108.88 2rpc s THR 37 Ca -0.16 -2.15 -0.29 0.00 -1.18 0.00 0.00 61.69 57.90 2rpc s THR 37 Cb 0.06 -2.45 -0.17 0.00 1.34 0.00 0.00 72.50 71.29 2rpc s THR 37 CO 0.82 -0.31 1.66 -0.03 -0.54 0.00 0.00 174.62 176.22 2rpc h MET 38 N 2.26 -0.57 -0.93 3.99 4.05 -1.92 -2.76 114.93 119.05 2rpc h MET 38 Ca -0.40 0.04 0.25 0.00 -0.28 0.00 0.00 59.70 59.31 2rpc h MET 38 Cb 1.24 0.13 -0.17 0.00 -0.80 0.00 0.00 31.60 32.00 2rpc h MET 38 CO 0.67 -0.38 0.09 1.25 0.23 0.00 0.00 176.91 178.77 2rpc h HIS 39 N -0.59 0.07 -0.74 1.39 -0.00 -1.99 0.67 115.15 113.95 2rpc h HIS 39 Ca -0.05 0.06 0.08 0.00 -0.00 0.00 0.00 60.37 60.46 2rpc h HIS 39 Cb 0.47 0.12 -0.07 0.00 -0.00 0.00 0.00 27.41 27.93 2rpc h HIS 39 CO -0.07 -0.36 0.41 0.93 -0.00 0.00 0.00 177.93 178.85 2rpc h GLU 40 N 0.07 0.69 -0.15 5.26 5.08 -1.91 -1.06 114.58 122.55 2rpc h GLU 40 Ca 0.57 -0.04 -0.01 0.00 -1.00 0.00 0.00 59.36 58.87 2rpc h GLU 40 Cb 1.16 -0.16 -0.01 0.00 0.50 0.00 0.00 28.75 30.24 2rpc h GLU 40 CO -0.82 0.46 0.04 1.25 -1.00 0.00 0.00 179.01 178.94 2rpc h LEU 41 N 0.71 0.23 -0.12 1.33 5.85 0.39 -3.07 115.31 120.63 2rpc h LEU 41 Ca 0.35 -0.23 0.04 0.00 0.84 0.00 0.00 57.88 58.89 2rpc h LEU 41 Cb 0.30 -0.06 -0.04 0.00 0.37 0.00 0.00 40.66 41.22 2rpc h LEU 41 CO -0.23 0.40 -0.15 0.58 -0.34 0.00 0.00 178.44 178.70 2rpc h VAL 42 N 0.06 0.61 -0.90 1.05 2.07 -0.69 -0.17 116.25 118.26 2rpc h VAL 42 Ca 0.05 0.00 0.26 0.00 0.82 0.00 0.00 66.70 67.83 2rpc h VAL 42 Cb 0.25 0.61 -0.04 0.00 -1.52 0.00 0.00 31.29 30.59 2rpc h VAL 42 CO 0.00 0.00 0.70 0.74 0.02 0.00 0.00 177.57 179.03 2rpc h THR 43 N -0.18 0.46 0.00 2.57 2.02 -1.17 0.36 112.91 116.96 2rpc h THR 43 Ca 0.09 0.00 0.00 0.00 0.77 0.00 0.00 66.41 67.27 2rpc h THR 43 Cb 0.32 0.50 0.00 0.00 -1.74 0.00 0.00 68.15 67.23 2rpc h THR 43 CO -0.23 0.00 -0.10 -0.74 0.37 0.00 0.00 175.52 174.82 2rpc h HIS 44 N 0.00 0.00 -0.11 3.16 -0.00 -1.01 -0.43 115.15 116.75 2rpc h HIS 44 Ca 0.43 0.00 0.03 0.00 -0.00 0.00 0.00 60.37 60.83 2rpc h HIS 44 Cb 1.82 0.00 -0.00 0.00 -0.00 0.00 0.00 27.41 29.22 2rpc h HIS 44 CO 0.00 0.00 0.33 0.28 -0.00 0.00 0.00 177.93 178.54 2rpc h VAL 45 N -0.72 0.13 0.00 5.26 2.07 -0.68 2.22 116.25 124.53 2rpc h VAL 45 Ca 0.00 0.00 -0.10 0.00 0.82 0.00 0.00 66.70 67.42 2rpc h VAL 45 Cb 0.10 0.70 -0.01 0.00 -1.52 0.00 0.00 31.29 30.55 2rpc h VAL 45 CO 0.00 0.00 -0.97 0.41 0.02 0.00 0.00 177.57 177.03 2rpc n THR 46 N -3.18 1.47 -0.09 2.57 -1.04 0.12 -1.81 114.28 112.32 2rpc n THR 46 Ca 0.00 0.09 -0.19 0.00 -2.04 0.00 0.00 64.05 61.91 2rpc n THR 46 Cb 0.42 -2.26 -0.12 0.00 -1.82 0.00 0.00 70.33 66.55 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 -0.71 2.03 114.93 115.29 2rpc h MET 47 Ca -0.15 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.49 2rpc h MET 47 Cb 0.89 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.55 2rpc h MET 47 CO -0.09 0.99 0.00 0.39 1.06 0.00 0.00 176.91 179.27 2rpc n GLU 48 N -4.49 0.54 0.00 1.72 -0.58 0.71 -2.30 120.64 116.25 2rpc n GLU 48 Ca -0.25 0.00 0.00 0.00 -0.42 0.00 0.00 57.16 56.49 2rpc n GLU 48 Cb 0.62 -1.33 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 -0.83 -0.16 0.87 -0.32 8.25 0.82 -4.81 115.22 119.03 2rpc n HIS 49 Ca 0.09 0.00 0.08 0.00 -0.26 0.00 0.00 57.72 57.62 2rpc n HIS 49 Cb 0.04 0.32 0.43 0.00 1.12 0.00 0.00 29.99 31.91 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 -1.96 0.27 -4.52 1.59 0.31 0.56 -4.95 118.33 109.63 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 -0.81 0.00 0.00 -0.91 0.00 0.00 33.84 32.12 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 0.01 -1.38 0.00 2.92 0.00 0.66 -4.83 105.19 102.56 2rpc n GLY 51 Ca 0.10 -1.19 0.00 0.00 0.00 0.00 0.00 46.02 44.93 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 1.26 0.04 -0.02 0.00 -1.26 -3.49 105.19 101.72 2rpc n GLY 52 Ca 0.00 -1.96 0.08 0.00 0.00 0.00 0.00 46.02 44.14 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 -0.23 0.06 0.21 1.61 -0.04 -1.26 -3.47 135.00 131.88 2rpc n PRO 53 Ca 0.00 0.31 -0.09 0.00 -0.04 0.00 0.00 63.50 63.68 2rpc n PRO 53 Cb 0.00 -1.62 -0.04 0.00 -0.04 0.00 0.00 33.50 31.80 2rpc n PRO 53 CO 0.00 0.00 0.00 0.93 -0.04 0.00 0.00 175.50 176.39 2rpc h GLU 54 N 0.00 -0.57 -6.03 0.54 4.39 -1.96 -3.44 114.58 107.50 2rpc h GLU 54 Ca 0.00 0.04 -0.84 0.00 0.34 0.00 0.00 59.36 58.90 2rpc h GLU 54 Cb 0.28 0.13 0.02 0.00 -0.10 0.00 0.00 28.75 29.08 2rpc h GLU 54 CO 0.00 -0.38 0.65 1.04 -1.16 0.00 0.00 179.01 179.16 2rpc n GLN 55 N -4.80 0.24 0.00 2.33 6.02 -1.23 -4.89 117.38 115.05 2rpc n GLN 55 Ca -0.07 0.09 0.00 0.00 -0.01 0.00 0.00 57.00 57.00 2rpc n GLN 55 Cb 0.23 -1.62 0.00 0.00 1.02 0.00 0.00 30.24 29.87 2rpc n GLN 55 CO 0.00 0.00 0.00 0.09 -1.01 0.00 0.00 177.06 176.14 2rpc n ASN 56 N 3.93 0.00 -4.58 1.08 3.02 -1.26 -4.59 115.26 112.85 2rpc n ASN 56 Ca 0.29 0.50 -0.42 0.00 -0.03 0.00 0.00 54.58 54.91 2rpc n ASN 56 Cb -0.00 -0.24 -0.02 0.00 -0.61 0.00 0.00 39.78 38.91 2rpc n ASN 56 CO 0.00 0.00 0.00 0.21 -2.62 0.00 0.00 177.26 174.85 2rpc s ASN 57 N -1.97 6.46 -0.23 6.41 3.04 -1.26 -5.00 114.94 122.39 2rpc s ASN 57 Ca 0.00 0.12 -0.07 0.00 0.04 0.00 0.00 52.86 52.95 2rpc s ASN 57 Cb 0.00 -2.55 -0.03 0.00 -1.54 0.00 0.00 41.25 37.13 2rpc s ASN 57 CO 0.00 -1.47 0.06 -1.38 -3.04 0.00 0.00 177.10 171.27 2rpc s HIS 58 N 4.92 3.11 -0.01 0.43 -3.43 -1.26 -5.09 115.29 113.97 2rpc s HIS 58 Ca 0.43 -0.29 0.01 0.00 -0.80 0.00 0.00 55.06 54.41 2rpc s HIS 58 Cb -0.07 -2.18 0.00 0.00 -1.43 0.00 0.00 32.58 28.90 2rpc s HIS 58 CO 0.26 -0.21 -0.05 0.08 -2.00 0.00 0.00 174.74 172.82 2rpc s VAL 59 N 1.23 0.40 -0.26 -5.38 1.01 -1.26 -4.51 120.40 111.63 2rpc s VAL 59 Ca 0.05 -0.19 -0.04 0.00 0.00 0.00 0.00 61.98 61.80 2rpc s VAL 59 Cb -0.14 -0.36 0.01 0.00 0.00 0.00 0.00 36.38 35.89 2rpc s VAL 59 CO 0.03 0.13 -0.00 0.00 0.00 0.00 0.00 175.10 175.26 2rpc s TYR 61 N 1.42 3.42 0.15 0.00 1.51 -1.26 -3.98 117.35 118.62 2rpc s TYR 61 Ca 0.02 -1.66 -0.14 0.00 -1.01 0.00 0.00 57.07 54.29 2rpc s TYR 61 Cb -0.16 -3.71 -0.07 0.00 -0.11 0.00 0.00 41.96 37.91 2rpc s TYR 61 CO -0.01 -1.00 0.54 -0.46 -1.11 0.00 0.00 175.55 173.51 2rpc s TRP 62 N 1.11 3.59 0.64 2.71 -0.11 -1.26 -0.16 118.94 125.46 2rpc s TRP 62 Ca 0.08 1.03 0.14 0.00 1.22 0.00 0.00 56.10 58.58 2rpc s TRP 62 Cb -0.24 -2.35 0.65 0.00 -1.50 0.00 0.00 33.47 30.03 2rpc s TRP 62 CO -0.01 0.41 1.32 1.49 -4.62 0.00 0.00 176.95 175.55 2rpc h GLU 63 N 3.46 0.00 -0.00 5.86 4.57 -1.85 -1.80 114.58 124.81 2rpc h GLU 63 Ca -0.48 0.00 -0.15 0.00 -1.18 0.00 0.00 59.36 57.55 2rpc h GLU 63 Cb 1.19 0.00 -0.14 0.00 -0.16 0.00 0.00 28.75 29.64 2rpc h GLU 63 CO 0.66 0.00 -0.30 0.39 -1.18 0.00 0.00 179.01 178.58 2rpc n GLU 64 N -2.85 0.57 -1.54 1.92 -0.58 -1.26 -5.06 120.64 111.84 2rpc n GLU 64 Ca 0.06 -1.12 -0.51 0.00 -0.42 0.00 0.00 57.16 55.17 2rpc n GLU 64 Cb 0.98 0.45 -0.05 0.00 -0.57 0.00 0.00 31.44 32.24 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 3.10 0.00 0.00 0.00 0.13 -1.98 -2.51 132.00 130.74 2rpc h PRO 66 Ca -0.43 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.70 2rpc h PRO 66 Cb 1.37 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.50 2rpc h PRO 66 CO 0.68 0.00 -0.70 0.54 -0.23 0.00 0.00 178.00 178.30 2rpc n ARG 67 N -3.09 0.25 -2.55 0.86 5.12 -1.26 -4.96 116.66 111.04 2rpc n ARG 67 Ca 0.00 0.06 -0.12 0.00 -1.93 0.00 0.00 57.85 55.86 2rpc n ARG 67 Cb 0.29 -1.64 0.01 0.00 -1.16 0.00 0.00 32.46 29.97 2rpc n ARG 67 CO 0.00 0.00 0.00 0.39 -1.93 0.00 0.00 177.63 176.09 2rpc n GLU 68 N -2.00 -2.16 -1.28 5.56 1.02 -0.95 -2.49 120.64 118.34 2rpc n GLU 68 Ca 0.03 0.49 -0.10 0.00 -0.02 0.00 0.00 57.16 57.57 2rpc n GLU 68 Cb 0.43 -4.49 -0.04 0.00 -0.02 0.00 0.00 31.44 27.31 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 -1.12 1.10 3.68 0.62 0.00 -1.26 -4.95 105.19 103.26 2rpc n GLY 69 Ca -0.08 -0.44 -0.42 0.00 0.00 0.00 0.00 46.02 45.08 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 -2.67 4.25 1.27 1.61 3.01 -1.04 -4.65 119.74 121.52 2rpc s LYS 70 Ca 0.00 2.02 -0.17 0.00 -1.01 0.00 0.00 55.97 56.81 2rpc s LYS 70 Cb 0.00 -3.66 0.32 0.00 -1.01 0.00 0.00 37.83 33.48 2rpc s LYS 70 CO 0.00 -0.65 0.99 0.45 0.51 0.00 0.00 175.35 176.65 2rpc s SER 71 N 2.19 0.20 0.30 2.83 0.15 -1.26 -4.88 113.70 113.24 2rpc s SER 71 Ca 0.66 1.19 0.01 0.00 0.70 0.00 0.00 55.95 58.50 2rpc s SER 71 Cb -0.32 -1.79 0.01 0.00 -1.71 0.00 0.00 66.02 62.21 2rpc s SER 71 CO 0.27 -4.63 0.05 0.49 1.20 0.00 0.00 173.24 170.61 2rpc n PHE 72 N -5.18 0.35 0.96 3.44 3.01 -1.26 -5.05 117.46 113.73 2rpc n PHE 72 Ca 0.07 -1.44 0.10 0.00 1.01 0.00 0.00 57.45 57.19 2rpc n PHE 72 Cb 0.57 -0.21 -0.05 0.00 -0.01 0.00 0.00 39.48 39.78 2rpc n PHE 72 CO 0.00 0.00 0.00 1.17 1.01 0.00 0.00 176.76 178.94 2rpc n LYS 73 N -0.85 0.92 -3.90 -1.08 3.00 -1.26 -4.99 118.16 110.00 2rpc n LYS 73 Ca -0.10 -0.62 -0.09 0.00 -0.00 0.00 0.00 58.31 57.50 2rpc n LYS 73 Cb 0.37 -1.45 -0.05 0.00 0.00 0.00 0.00 35.03 33.90 2rpc n LYS 73 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.40 177.40 2rpc s ALA 74 N -2.59 -0.55 -0.02 3.14 0.00 -1.26 -5.06 121.76 115.43 2rpc s ALA 74 Ca 0.14 -0.61 -0.20 0.00 0.00 0.00 0.00 51.96 51.29 2rpc s ALA 74 Cb 0.17 0.95 -0.12 0.00 0.00 0.00 0.00 23.12 24.12 2rpc s ALA 74 CO 0.65 -0.84 0.84 -0.22 0.00 0.00 0.00 175.76 176.19 2rpc h LYS 75 N 2.24 -0.53 -0.14 0.00 1.63 -1.96 -3.11 116.57 114.69 2rpc h LYS 75 Ca -0.27 0.04 0.04 0.00 -0.85 0.00 0.00 60.65 59.61 2rpc h LYS 75 Cb 1.25 0.12 -0.01 0.00 -0.60 0.00 0.00 32.23 33.00 2rpc h LYS 75 CO 0.36 -0.27 0.30 0.10 -3.45 0.00 0.00 179.45 176.49 2rpc h TYR 76 N -1.07 0.00 -0.59 1.91 -0.00 -1.99 0.53 116.97 115.77 2rpc h TYR 76 Ca -0.06 0.00 -0.11 0.00 -0.00 0.00 0.00 58.73 58.57 2rpc h TYR 76 Cb 0.51 0.00 -0.02 0.00 -0.00 0.00 0.00 36.73 37.22 2rpc h TYR 76 CO 0.02 0.00 -0.04 0.87 -0.00 0.00 0.00 178.16 179.00 2rpc h LYS 77 N 0.00 1.07 0.05 0.10 1.79 -1.96 -2.15 116.57 115.47 2rpc h LYS 77 Ca 0.07 -0.36 -0.11 0.00 -2.18 0.00 0.00 60.65 58.07 2rpc h LYS 77 Cb 0.67 -0.08 0.01 0.00 -1.58 0.00 0.00 32.23 31.25 2rpc h LYS 77 CO -0.00 1.06 -0.47 1.25 -1.08 0.00 0.00 179.45 180.22 2rpc h LEU 78 N 0.96 0.32 -0.96 2.94 5.85 -0.91 -3.12 115.31 120.38 2rpc h LEU 78 Ca 0.16 -0.88 0.15 0.00 0.84 0.00 0.00 57.88 58.15 2rpc h LEU 78 Cb 0.61 -0.10 -0.09 0.00 0.37 0.00 0.00 40.66 41.45 2rpc h LEU 78 CO 0.04 1.17 0.57 0.58 -0.34 0.00 0.00 178.44 180.46 2rpc h VAL 79 N -0.48 0.80 -0.07 1.05 2.07 -1.42 0.12 116.25 118.32 2rpc h VAL 79 Ca -0.07 -0.28 -0.09 0.00 0.82 0.00 0.00 66.70 67.07 2rpc h VAL 79 Cb 1.29 -0.09 -0.01 0.00 -1.52 0.00 0.00 31.29 30.95 2rpc h VAL 79 CO 0.09 0.15 -0.38 0.78 0.02 0.00 0.00 177.57 178.23 2rpc h ASN 80 N 0.82 0.14 -0.09 0.57 4.21 -1.47 -3.09 115.58 116.66 2rpc h ASN 80 Ca 0.52 -0.05 -0.01 0.00 1.21 0.00 0.00 56.30 57.96 2rpc h ASN 80 Cb 0.67 -0.04 -0.00 0.00 -1.12 0.00 0.00 38.32 37.83 2rpc h ASN 80 CO -0.33 0.51 0.03 -0.74 -1.29 0.00 0.00 177.43 175.61 2rpc h HIS 81 N 0.12 0.16 -0.08 1.19 -0.00 -0.72 -2.42 115.15 113.39 2rpc h HIS 81 Ca 0.01 -0.02 0.02 0.00 -0.00 0.00 0.00 60.37 60.39 2rpc h HIS 81 Cb 0.72 -0.04 -0.00 0.00 -0.00 0.00 0.00 27.41 28.09 2rpc h HIS 81 CO 0.01 0.31 0.24 0.82 -0.00 0.00 0.00 177.93 179.31 2rpc h ILE 82 N -0.05 0.15 0.00 6.26 2.04 -1.33 0.13 117.51 124.70 2rpc h ILE 82 Ca 0.03 0.00 -0.01 0.00 1.00 0.00 0.00 64.86 65.88 2rpc h ILE 82 Cb 0.23 0.78 -0.00 0.00 -0.74 0.00 0.00 36.82 37.09 2rpc h ILE 82 CO -0.00 0.00 -0.03 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 -1.44 -1.05 114.38 116.73 2rpc h ARG 83 Ca 0.04 0.00 -0.02 0.00 -1.26 0.00 0.00 59.98 58.74 2rpc h ARG 83 Cb 0.52 0.00 -0.00 0.00 -1.65 0.00 0.00 29.97 28.84 2rpc h ARG 83 CO -0.00 0.03 -0.60 -0.39 0.56 0.00 0.00 179.97 179.58 2rpc h VAL 84 N 0.00 0.10 0.00 2.04 -1.51 -0.87 -3.26 116.25 112.75 2rpc h VAL 84 Ca -0.00 -1.16 0.00 0.00 -1.23 0.00 0.00 66.70 64.31 2rpc h VAL 84 Cb 0.19 1.80 0.00 0.00 -2.13 0.00 0.00 31.29 31.16 2rpc h VAL 84 CO 0.00 0.06 0.00 1.41 -1.23 0.00 0.00 177.57 177.81 2rpc n HIS 85 N -2.90 0.40 0.01 5.19 8.25 -0.40 -3.22 115.22 122.55 2rpc n HIS 85 Ca 0.01 0.16 -0.08 0.00 -0.26 0.00 0.00 57.72 57.55 2rpc n HIS 85 Cb 0.58 -0.76 -0.06 0.00 1.12 0.00 0.00 29.99 30.87 2rpc n HIS 85 CO 0.00 0.00 0.00 1.79 0.64 0.00 0.00 176.34 178.77 2rpc h THR 86 N 0.00 0.70 0.00 1.59 1.35 -1.63 -3.49 112.91 111.44 2rpc h THR 86 Ca 0.00 -1.29 0.00 0.00 -0.55 0.00 0.00 66.41 64.57 2rpc h THR 86 Cb 0.31 1.26 0.00 0.00 -1.73 0.00 0.00 68.15 67.99 2rpc h THR 86 CO 0.00 0.21 0.00 0.61 -0.25 0.00 0.00 175.52 176.09 2rpc n GLY 87 N 1.15 2.46 3.66 5.82 0.00 -1.20 -5.04 105.19 112.05 2rpc n GLY 87 Ca -0.06 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.57 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 -0.31 4.18 0.10 1.61 2.12 -1.26 -5.07 118.70 120.07 2rpc s GLU 88 Ca 0.00 0.34 0.05 0.00 0.36 0.00 0.00 54.97 55.72 2rpc s GLU 88 Cb 0.00 -3.56 -0.03 0.00 0.26 0.00 0.00 34.13 30.80 2rpc s GLU 88 CO 0.00 -0.11 -0.14 0.15 -0.54 0.00 0.00 175.26 174.62 2rpc s LYS 89 N 1.54 0.92 -0.02 4.30 3.01 -1.26 -4.65 119.74 123.57 2rpc s LYS 89 Ca 0.22 -1.11 -0.25 0.00 -1.01 0.00 0.00 55.97 53.82 2rpc s LYS 89 Cb -0.15 -0.83 -0.19 0.00 -1.01 0.00 0.00 37.83 35.65 2rpc s LYS 89 CO 0.09 0.17 1.21 -1.00 0.51 0.00 0.00 175.35 176.33 2rpc h PRO 90 N 3.84 -0.08 -2.30 -1.68 0.13 -1.82 -3.47 132.00 126.62 2rpc h PRO 90 Ca -0.40 0.01 -0.06 0.00 -0.87 0.00 0.00 66.00 64.67 2rpc h PRO 90 Cb 1.19 0.02 -0.23 0.00 0.13 0.00 0.00 31.00 32.12 2rpc h PRO 90 CO 0.47 0.37 -0.05 -0.59 -0.23 0.00 0.00 178.00 177.97 2rpc s PHE 91 N -4.21 -0.72 0.00 1.56 -0.12 -1.26 -5.17 117.98 108.06 2rpc s PHE 91 Ca -0.15 1.65 0.00 0.00 -0.05 0.00 0.00 56.93 58.37 2rpc s PHE 91 Cb 0.02 0.30 0.00 0.00 -0.63 0.00 0.00 43.02 42.70 2rpc s PHE 91 CO 0.63 -0.35 0.00 -0.35 -0.05 0.00 0.00 175.22 175.10 2rpc n PRO 92 N 3.21 -0.75 -3.27 1.99 -0.04 -1.26 -4.46 135.00 130.42 2rpc n PRO 92 Ca -0.16 0.00 -0.39 0.00 -0.04 0.00 0.00 63.50 62.92 2rpc n PRO 92 Cb 0.56 0.00 -0.06 0.00 -0.04 0.00 0.00 33.50 33.97 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 5.57 0.00 -6.66 0.00 0.13 -1.95 -3.44 132.00 125.66 2rpc h PRO 94 Ca -0.46 0.00 -0.52 0.00 -0.87 0.00 0.00 66.00 64.15 2rpc h PRO 94 Cb 1.20 0.00 0.03 0.00 0.13 0.00 0.00 31.00 32.36 2rpc h PRO 94 CO 0.69 0.06 0.67 0.12 -0.23 0.00 0.00 178.00 179.31 2rpc s PHE 95 N -3.72 3.23 -0.02 1.56 2.19 -1.26 -4.96 117.98 115.01 2rpc s PHE 95 Ca 0.01 1.15 -0.23 0.00 0.33 0.00 0.00 56.93 58.19 2rpc s PHE 95 Cb 0.10 -3.64 -0.17 0.00 -1.31 0.00 0.00 43.02 38.00 2rpc s PHE 95 CO 0.56 -2.04 1.08 -1.00 1.83 0.00 0.00 175.22 175.66 2rpc h PRO 96 N 5.61 -0.26 -1.88 10.12 0.13 -1.90 -3.19 132.00 140.63 2rpc h PRO 96 Ca -0.44 0.02 -0.11 0.00 -0.87 0.00 0.00 66.00 64.60 2rpc h PRO 96 Cb 1.21 0.06 -0.04 0.00 0.13 0.00 0.00 31.00 32.36 2rpc h PRO 96 CO 0.79 0.12 0.09 0.41 -0.23 0.00 0.00 178.00 179.18 2rpc n GLY 97 N 0.15 2.98 1.80 1.56 0.00 -1.26 -3.80 105.19 106.62 2rpc n GLY 97 Ca -0.09 -0.41 0.00 0.00 0.00 0.00 0.00 46.02 45.53 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 1.83 -0.27 3.89 0.00 0.00 -1.21 -4.92 105.19 104.51 2rpc n GLY 99 Ca 0.00 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.71 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 -4.70 3.73 0.04 1.61 2.47 -1.26 -4.88 119.74 116.75 2rpc s LYS 100 Ca 0.00 0.16 -0.01 0.00 -1.56 0.00 0.00 55.97 54.56 2rpc s LYS 100 Cb 0.00 -2.67 -0.03 0.00 -1.46 0.00 0.00 37.83 33.67 2rpc s LYS 100 CO 0.00 0.30 -0.03 0.42 0.16 0.00 0.00 175.35 176.20 2rpc s ILE 101 N -1.87 0.20 0.04 5.43 1.01 -1.26 -0.05 121.20 124.69 2rpc s ILE 101 Ca 0.46 -1.47 0.00 0.00 0.00 0.00 0.00 60.65 59.64 2rpc s ILE 101 Cb -0.11 -1.05 -0.03 0.00 0.01 0.00 0.00 42.46 41.29 2rpc s ILE 101 CO 0.24 -0.80 -0.04 -0.36 0.00 0.00 0.00 174.94 173.98 2rpc s PHE 102 N -2.96 0.46 -0.87 3.97 0.40 -1.26 -5.02 117.98 112.69 2rpc s PHE 102 Ca -0.02 -0.69 0.27 0.00 -0.60 0.00 0.00 56.93 55.89 2rpc s PHE 102 Cb 0.01 -0.31 0.81 0.00 0.51 0.00 0.00 43.02 44.05 2rpc s PHE 102 CO -0.06 -0.21 1.67 0.00 0.70 0.00 0.00 175.22 177.31 2rpc n ALA 103 N 1.06 2.71 -2.65 5.36 0.00 -1.26 -4.15 120.51 121.57 2rpc n ALA 103 Ca -0.20 -0.17 -0.34 0.00 0.00 0.00 0.00 53.44 52.73 2rpc n ALA 103 Cb 0.57 -1.34 -0.12 0.00 0.00 0.00 0.00 19.45 18.57 2rpc n ALA 103 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 177.50 178.00 2rpc s ARG 104 N -3.05 2.87 0.20 0.00 3.52 -1.26 -4.64 118.95 116.59 2rpc s ARG 104 Ca 0.11 -0.57 -0.03 0.00 -0.13 0.00 0.00 55.73 55.11 2rpc s ARG 104 Cb 0.16 -2.60 0.15 0.00 -1.56 0.00 0.00 34.95 31.10 2rpc s ARG 104 CO 0.62 0.58 1.55 1.03 -0.81 0.00 0.00 175.30 178.26 2rpc h SER 105 N 5.54 0.64 0.89 -2.12 0.87 -1.97 -2.84 113.55 114.55 2rpc h SER 105 Ca -0.45 -0.31 -0.05 0.00 -1.23 0.00 0.00 61.79 59.76 2rpc h SER 105 Cb 1.18 -0.18 -0.01 0.00 -0.44 0.00 0.00 62.40 62.95 2rpc h SER 105 CO 0.53 1.00 -0.23 -0.08 -0.53 0.00 0.00 176.83 177.52 2rpc h GLU 106 N 0.47 0.00 -0.19 2.24 4.81 -1.99 -2.54 114.58 117.38 2rpc h GLU 106 Ca 0.03 0.00 -0.19 0.00 -0.13 0.00 0.00 59.36 59.07 2rpc h GLU 106 Cb 0.98 0.00 0.01 0.00 0.63 0.00 0.00 28.75 30.37 2rpc h GLU 106 CO 0.09 0.23 -0.64 -0.91 -0.73 0.00 0.00 179.01 177.05 2rpc h ASN 107 N 0.00 0.89 0.11 1.04 4.21 -1.93 -2.53 115.58 117.38 2rpc h ASN 107 Ca -0.00 -0.59 -0.01 0.00 1.21 0.00 0.00 56.30 56.91 2rpc h ASN 107 Cb 0.74 -0.26 0.00 0.00 -1.12 0.00 0.00 38.32 37.68 2rpc h ASN 107 CO 0.03 1.34 -0.05 0.25 -1.29 0.00 0.00 177.43 177.70 2rpc h LEU 108 N 0.50 -0.12 -1.44 1.61 5.85 -1.42 0.56 115.31 120.86 2rpc h LEU 108 Ca -0.03 -0.39 0.14 0.00 0.84 0.00 0.00 57.88 58.44 2rpc h LEU 108 Cb 1.26 0.03 -0.06 0.00 0.37 0.00 0.00 40.66 42.27 2rpc h LEU 108 CO 0.14 0.36 0.53 0.07 -0.34 0.00 0.00 178.44 179.20 2rpc h LYS 109 N -0.65 0.55 0.00 1.25 2.10 -1.55 0.72 116.57 118.98 2rpc h LYS 109 Ca -0.02 -0.03 -0.20 0.00 -2.00 0.00 0.00 60.65 58.41 2rpc h LYS 109 Cb 0.51 -0.12 -0.03 0.00 -0.90 0.00 0.00 32.23 31.69 2rpc h LYS 109 CO 0.02 0.36 -0.99 0.82 -2.00 0.00 0.00 179.45 177.67 2rpc h ILE 110 N 0.56 1.40 0.00 0.07 2.04 -1.42 -3.23 117.51 116.94 2rpc h ILE 110 Ca 0.40 -3.05 -0.07 0.00 1.00 0.00 0.00 64.86 63.14 2rpc h ILE 110 Cb 0.74 2.68 -0.01 0.00 -0.74 0.00 0.00 36.82 39.49 2rpc h ILE 110 CO -0.15 0.80 -0.48 -0.74 0.00 0.00 0.00 178.15 177.58 2rpc h HIS 111 N 0.00 0.00 0.00 1.37 -0.00 0.11 -3.25 115.15 113.38 2rpc h HIS 111 Ca -0.04 0.00 -0.14 0.00 -0.00 0.00 0.00 60.37 60.18 2rpc h HIS 111 Cb 1.71 0.00 -0.02 0.00 -0.00 0.00 0.00 27.41 29.10 2rpc h HIS 111 CO 0.00 0.31 -0.67 0.87 -0.00 0.00 0.00 177.93 178.43 2rpc h LYS 112 N 0.00 0.00 0.00 5.26 1.57 0.31 -3.07 116.57 120.64 2rpc h LYS 112 Ca -0.02 0.00 -0.08 0.00 -1.87 0.00 0.00 60.65 58.68 2rpc h LYS 112 Cb 1.25 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 33.55 2rpc h LYS 112 CO 0.04 0.67 -0.37 0.07 -0.57 0.00 0.00 179.45 179.29 2rpc h ARG 113 N 0.00 0.00 0.00 3.15 0.11 -1.59 -2.96 114.38 113.09 2rpc h ARG 113 Ca -0.01 0.00 0.00 0.00 0.10 0.00 0.00 59.98 60.07 2rpc h ARG 113 Cb 1.27 0.00 0.00 0.00 1.11 0.00 0.00 29.97 32.35 2rpc h ARG 113 CO 0.09 0.37 0.00 -2.37 0.10 0.00 0.00 179.97 178.16 2rpc n THR 114 N -3.32 0.00 -0.75 0.08 5.66 -1.16 -3.51 114.28 111.27 2rpc n THR 114 Ca 0.01 0.00 -0.19 0.00 -3.05 0.00 0.00 64.05 60.82 2rpc n THR 114 Cb 0.59 -0.53 0.07 0.00 -1.55 0.00 0.00 70.33 68.91 2rpc n THR 114 CO 0.00 0.00 0.00 1.41 -3.05 0.00 0.00 175.07 173.43 2rpc n HIS 115 N -0.93 1.95 -0.58 1.09 8.25 -1.12 -4.90 115.22 118.97 2rpc n HIS 115 Ca 0.16 -1.89 0.00 0.00 -0.26 0.00 0.00 57.72 55.74 2rpc n HIS 115 Cb 0.07 -0.93 0.00 0.00 1.12 0.00 0.00 29.99 30.26 2rpc n HIS 115 CO 0.00 0.00 0.00 2.41 0.64 0.00 0.00 176.34 179.39 2rpc n THR 116 N -0.19 -1.43 -0.22 1.59 -1.04 -1.23 -4.77 114.28 106.99 2rpc n THR 116 Ca 0.38 0.00 0.31 0.00 -2.04 0.00 0.00 64.05 62.70 2rpc n THR 116 Cb 0.84 -1.88 0.66 0.00 -1.82 0.00 0.00 70.33 68.14 2rpc n THR 116 CO 0.00 0.00 0.00 1.23 -0.64 0.00 0.00 175.07 175.66 2rpc h GLY 117 N 0.00 0.00 -3.05 3.41 0.00 -1.91 -3.40 103.07 98.12 2rpc h GLY 117 Ca 0.00 0.00 -0.49 0.00 0.00 0.00 0.00 47.33 46.84 2rpc h GLY 117 CO 0.00 0.00 -0.25 1.85 0.00 0.00 0.00 176.54 178.14 2rpc s GLU 118 N -4.68 3.50 0.17 4.80 2.12 -1.26 -5.09 118.70 118.25 2rpc s GLU 118 Ca -0.04 -0.37 -0.16 0.00 0.36 0.00 0.00 54.97 54.76 2rpc s GLU 118 Cb 0.18 -2.73 -0.07 0.00 0.26 0.00 0.00 34.13 31.77 2rpc s GLU 118 CO 0.64 0.25 0.61 0.15 -0.54 0.00 0.00 175.26 176.37 2rpc s LYS 119 N -3.96 4.08 0.45 4.30 -0.14 -1.26 -4.98 119.74 118.22 2rpc s LYS 119 Ca 0.39 0.62 0.23 0.00 -1.36 0.00 0.00 55.97 55.86 2rpc s LYS 119 Cb -0.10 -2.93 1.00 0.00 -1.68 0.00 0.00 37.83 34.13 2rpc s LYS 119 CO 0.33 0.46 1.87 -1.00 -0.76 0.00 0.00 175.35 176.25 2rpc h PRO 120 N 3.56 0.00 -3.07 -1.68 0.13 -1.92 -3.38 132.00 125.64 2rpc h PRO 120 Ca -0.48 0.00 -0.58 0.00 -0.87 0.00 0.00 66.00 64.06 2rpc h PRO 120 Cb 1.19 0.00 -0.40 0.00 0.13 0.00 0.00 31.00 31.93 2rpc h PRO 120 CO 0.65 0.23 -0.78 -0.06 -0.23 0.00 0.00 178.00 177.82 2rpc s PHE 121 N -3.80 1.34 -0.07 1.56 0.08 -0.89 -5.01 117.98 111.19 2rpc s PHE 121 Ca -0.01 -1.76 0.02 0.00 0.12 0.00 0.00 56.93 55.31 2rpc s PHE 121 Cb 0.11 -1.45 -0.02 0.00 -0.57 0.00 0.00 43.02 41.08 2rpc s PHE 121 CO 0.64 -0.83 -0.12 0.21 -0.10 0.00 0.00 175.22 175.01 2rpc s LYS 122 N 1.24 2.78 -0.40 0.44 2.20 -1.26 0.12 119.74 124.86 2rpc s LYS 122 Ca 0.14 -0.65 -0.43 0.00 -0.36 0.00 0.00 55.97 54.66 2rpc s LYS 122 Cb -0.20 -2.50 -0.18 0.00 -1.51 0.00 0.00 37.83 33.44 2rpc s LYS 122 CO -0.14 0.54 1.76 0.00 -0.36 0.00 0.00 175.35 177.14 2rpc n GLU 124 N 5.23 0.57 -2.32 0.00 0.28 -1.26 -4.79 120.64 118.34 2rpc n GLU 124 Ca 0.32 0.03 -0.42 0.00 -0.16 0.00 0.00 57.16 56.94 2rpc n GLU 124 Cb 0.04 -1.50 -0.03 0.00 1.43 0.00 0.00 31.44 31.38 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 -2.26 3.37 0.28 -1.84 5.36 -1.26 -4.99 117.98 116.63 2rpc s PHE 125 Ca 0.30 1.19 -0.29 0.00 -0.96 0.00 0.00 56.93 57.17 2rpc s PHE 125 Cb 0.16 -3.52 -0.10 0.00 -0.34 0.00 0.00 43.02 39.23 2rpc s PHE 125 CO 0.32 -1.66 1.18 -2.00 -1.46 0.00 0.00 175.22 171.59 2rpc s GLU 126 N 0.89 4.53 -0.43 10.12 2.12 -1.26 -2.92 118.70 131.75 2rpc s GLU 126 Ca 0.60 1.94 0.00 0.00 0.36 0.00 0.00 54.97 57.87 2rpc s GLU 126 Cb -0.33 -3.16 0.00 0.00 0.26 0.00 0.00 34.13 30.90 2rpc s GLU 126 CO 0.31 0.04 0.00 0.41 -0.54 0.00 0.00 175.26 175.48 2rpc n GLY 127 N 1.26 0.69 3.35 -1.50 0.00 -1.26 -5.02 105.19 102.71 2rpc n GLY 127 Ca 0.00 -0.64 -0.30 0.00 0.00 0.00 0.00 46.02 45.08 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 -1.30 4.42 0.30 0.00 2.15 -1.26 -4.93 116.67 116.05 2rpc s ASP 129 Ca 0.12 -1.63 -0.09 0.00 0.43 0.00 0.00 52.55 51.38 2rpc s ASP 129 Cb -0.10 -1.46 0.00 0.00 -0.30 0.00 0.00 42.92 41.06 2rpc s ASP 129 CO 0.02 -0.28 0.51 -0.13 -0.17 0.00 0.00 175.17 175.13 2rpc s ARG 130 N 1.12 1.75 -0.12 4.34 1.81 -1.26 -5.06 118.95 121.53 2rpc s ARG 130 Ca -0.01 -1.46 -0.16 0.00 -1.72 0.00 0.00 55.73 52.39 2rpc s ARG 130 Cb -0.19 0.48 0.04 0.00 -0.45 0.00 0.00 34.95 34.82 2rpc s ARG 130 CO -0.07 -0.74 0.42 -0.98 -0.68 0.00 0.00 175.30 173.25 2rpc s ARG 131 N -3.48 0.58 0.15 3.54 1.04 -1.26 -4.18 118.95 115.33 2rpc s ARG 131 Ca 0.25 0.41 -0.10 0.00 -1.04 0.00 0.00 55.73 55.25 2rpc s ARG 131 Cb -0.01 0.27 -0.00 0.00 -2.04 0.00 0.00 34.95 33.17 2rpc s ARG 131 CO 0.13 -0.10 0.29 -0.06 -0.04 0.00 0.00 175.30 175.52 2rpc s PHE 132 N -0.19 0.26 -0.03 5.89 0.08 0.33 -4.97 117.98 119.35 2rpc s PHE 132 Ca -0.04 -0.64 0.09 0.00 0.12 0.00 0.00 56.93 56.46 2rpc s PHE 132 Cb -0.03 -0.00 -0.13 0.00 -0.57 0.00 0.00 43.02 42.28 2rpc s PHE 132 CO 0.02 -0.69 0.17 0.00 -0.10 0.00 0.00 175.22 174.61 2rpc n ALA 133 N -0.19 2.23 -3.17 5.36 0.00 -1.26 -2.10 120.51 121.38 2rpc n ALA 133 Ca -0.10 -0.28 -0.26 0.00 0.00 0.00 0.00 53.44 52.80 2rpc n ALA 133 Cb 0.63 -0.24 -0.16 0.00 0.00 0.00 0.00 19.45 19.68 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 -3.24 2.07 0.22 0.00 2.20 -1.26 -4.72 114.94 110.21 2rpc s ASN 134 Ca -0.03 -0.35 -0.17 0.00 -0.94 0.00 0.00 52.86 51.37 2rpc s ASN 134 Cb 0.05 -0.77 0.22 0.00 -2.00 0.00 0.00 41.25 38.75 2rpc s ASN 134 CO 0.37 0.10 1.58 -1.28 -2.94 0.00 0.00 177.10 174.94 2rpc h SER 135 N 6.60 -1.07 -0.99 3.54 0.87 -1.94 -0.23 113.55 120.33 2rpc h SER 135 Ca -0.30 0.25 0.15 0.00 -1.23 0.00 0.00 61.79 60.65 2rpc h SER 135 Cb 1.19 0.58 -0.16 0.00 -0.44 0.00 0.00 62.40 63.57 2rpc h SER 135 CO 0.48 -0.29 -0.40 -1.28 -0.53 0.00 0.00 176.83 174.80 2rpc h SER 136 N -0.07 -1.49 -0.07 6.23 0.87 -1.97 0.26 113.55 117.31 2rpc h SER 136 Ca 0.31 0.31 0.04 0.00 -1.23 0.00 0.00 61.79 61.22 2rpc h SER 136 Cb 0.57 0.77 -0.05 0.00 -0.44 0.00 0.00 62.40 63.25 2rpc h SER 136 CO -0.79 -0.28 -0.24 -0.78 -0.53 0.00 0.00 176.83 174.20 2rpc h ASP 137 N -0.00 -0.73 -0.47 6.23 1.82 -1.46 0.17 116.42 121.97 2rpc h ASP 137 Ca 0.33 0.11 0.07 0.00 -0.39 0.00 0.00 57.03 57.15 2rpc h ASP 137 Cb 0.58 0.31 -0.06 0.00 0.68 0.00 0.00 39.33 40.84 2rpc h ASP 137 CO -0.98 -0.30 0.13 -0.09 -1.61 0.00 0.00 179.24 176.39 2rpc h ARG 138 N -0.34 0.27 0.00 0.28 2.43 -0.44 0.13 114.38 116.71 2rpc h ARG 138 Ca 0.08 -0.02 0.00 0.00 -0.81 0.00 0.00 59.98 59.24 2rpc h ARG 138 Cb 0.46 -0.06 0.00 0.00 -0.42 0.00 0.00 29.97 29.94 2rpc h ARG 138 CO -0.26 0.18 0.00 0.87 -1.51 0.00 0.00 179.97 179.25 2rpc h LYS 139 N 0.28 0.00 0.00 0.20 1.57 -0.04 -1.82 116.57 116.76 2rpc h LYS 139 Ca 0.23 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 59.01 2rpc h LYS 139 Cb 0.27 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.58 2rpc h LYS 139 CO -0.27 0.00 -0.36 0.87 -0.57 0.00 0.00 179.45 179.12 2rpc h LYS 140 N 0.00 0.00 -0.02 3.15 1.57 0.20 -3.20 116.57 118.27 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 0.35 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.66 2rpc h LYS 140 CO 0.00 0.00 0.00 1.58 -0.57 0.00 0.00 179.45 180.46 2rpc n HIS 141 N -2.72 0.01 0.11 -1.35 -0.00 -0.68 -3.52 115.22 107.08 2rpc n HIS 141 Ca 0.03 -0.00 0.09 0.00 0.46 0.00 0.00 57.72 58.30 2rpc n HIS 141 Cb 0.51 0.00 0.01 0.00 -0.12 0.00 0.00 29.99 30.39 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 1.57 0.00 -0.06 1.57 2.86 -1.60 -3.33 114.93 115.95 2rpc h MET 142 Ca 0.00 0.00 0.02 0.00 -2.06 0.00 0.00 59.70 57.66 2rpc h MET 142 Cb 0.33 0.00 -0.00 0.00 0.06 0.00 0.00 31.60 31.99 2rpc h MET 142 CO 0.00 0.07 0.25 0.45 1.06 0.00 0.00 176.91 178.74 2rpc h HIS 143 N 0.00 0.00 0.00 -0.22 3.86 -1.75 0.48 115.15 117.52 2rpc h HIS 143 Ca -0.03 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 59.18 2rpc h HIS 143 Cb 1.11 0.00 0.00 0.00 1.06 0.00 0.00 27.41 29.58 2rpc h HIS 143 CO 0.00 0.00 -1.18 1.55 0.86 0.00 0.00 177.93 179.16 2rpc n VAL 144 N -3.11 0.01 0.57 2.45 3.14 -1.25 -4.13 118.33 116.01 2rpc n VAL 144 Ca -0.01 -0.11 0.12 0.00 -2.96 0.00 0.00 64.34 61.38 2rpc n VAL 144 Cb 0.33 0.73 0.27 0.00 -1.06 0.00 0.00 33.84 34.11 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 0.00 0.18 1.45 3.86 -0.20 -3.31 115.15 117.14 2rpc h HIS 145 Ca 0.00 0.00 -0.30 0.00 -1.16 0.00 0.00 60.37 58.91 2rpc h HIS 145 Cb 0.61 0.00 0.02 0.00 1.06 0.00 0.00 27.41 29.10 2rpc h HIS 145 CO 0.00 0.00 -1.36 1.15 0.86 0.00 0.00 177.93 178.58 2rpc h THR 146 N 0.00 1.39 -2.58 2.45 2.02 -1.63 -3.44 112.91 111.12 2rpc h THR 146 Ca 0.00 -2.90 -0.27 0.00 0.77 0.00 0.00 66.41 64.01 2rpc h THR 146 Cb 0.76 2.98 -0.34 0.00 -1.74 0.00 0.00 68.15 69.81 2rpc h THR 146 CO 0.00 0.86 -0.59 -0.55 0.37 0.00 0.00 175.52 175.61 2rpc s SER 147 N -7.33 0.95 -1.05 4.18 0.15 -1.24 -5.06 113.70 104.30 2rpc s SER 147 Ca -0.06 0.07 -0.27 0.00 0.70 0.00 0.00 55.95 56.39 2rpc s SER 147 Cb 0.06 0.53 -0.22 0.00 -1.71 0.00 0.00 66.02 64.68 2rpc s SER 147 CO 0.91 -0.30 2.06 0.47 1.20 0.00 0.00 173.24 177.59 2rpc n ASP 148 N 5.33 1.58 -3.66 5.45 8.00 -1.26 -4.77 116.55 127.22 2rpc n ASP 148 Ca -0.05 -2.52 -0.09 0.00 0.71 0.00 0.00 54.79 52.83 2rpc n ASP 148 Cb 0.50 -1.67 -0.10 0.00 -0.02 0.00 0.00 41.12 39.83 2rpc n ASP 148 CO 0.00 0.00 0.00 -0.75 -0.39 0.00 0.00 177.20 176.06 2rpc s LYS 149 N 8.15 0.31 -0.56 -1.24 2.47 -1.26 -5.10 119.74 122.52 2rpc s LYS 149 Ca 0.79 0.98 -0.40 0.00 -1.56 0.00 0.00 55.97 55.78 2rpc s LYS 149 Cb -0.03 0.26 -0.18 0.00 -1.46 0.00 0.00 37.83 36.41 2rpc s LYS 149 CO 0.19 -0.24 2.25 0.45 0.16 0.00 0.00 175.35 178.15 2rpc n SER 150 N 5.24 0.92 -4.49 1.43 2.88 -1.26 -4.90 113.62 113.43 2rpc n SER 150 Ca -0.10 0.53 -0.27 0.00 -1.33 0.00 0.00 58.87 57.70 2rpc n SER 150 Cb 0.50 -0.97 -0.11 0.00 -0.75 0.00 0.00 64.21 62.88 2rpc n SER 150 CO 0.00 0.00 0.00 -0.83 -1.23 0.00 0.00 175.04 172.98 2rpc s GLY 151 N 6.82 1.71 -0.66 0.46 0.00 -1.26 -5.07 107.32 109.32 2rpc s GLY 151 Ca 1.21 -1.52 -0.26 0.00 0.00 0.00 0.00 44.72 44.15 2rpc s GLY 151 CO 0.60 -1.53 1.88 2.56 0.00 0.00 0.00 173.10 176.60 2rpc s PRO 152 N -2.63 2.61 -0.06 2.90 0.04 -1.26 -4.96 135.00 131.64 2rpc s PRO 152 Ca 0.22 0.47 0.06 0.00 0.04 0.00 0.00 61.00 61.78 2rpc s PRO 152 Cb -0.09 -4.49 -0.01 0.00 0.04 0.00 0.00 34.50 29.95 2rpc s PRO 152 CO 0.12 -2.84 -0.24 -1.12 0.04 0.00 0.00 177.00 172.96 2rpc s SER 153 N 8.10 2.97 -0.07 6.66 0.01 -1.26 -5.13 113.70 124.99 2rpc s SER 153 Ca 0.68 -0.50 -0.04 0.00 1.31 0.00 0.00 55.95 57.40 2rpc s SER 153 Cb -0.12 -0.93 -0.04 0.00 0.21 0.00 0.00 66.02 65.15 2rpc s SER 153 CO 0.17 0.22 0.10 -0.55 0.41 0.00 0.00 173.24 173.59 2rpc s SER 154 N -0.04 5.96 0.00 2.44 0.15 -1.26 -5.23 113.70 115.72 2rpc s SER 154 Ca -0.07 0.30 0.00 0.00 0.70 0.00 0.00 55.95 56.88 2rpc s SER 154 Cb -0.14 -1.82 0.00 0.00 -1.71 0.00 0.00 66.02 62.35 2rpc s SER 154 CO 0.05 0.35 0.00 0.61 1.20 0.00 0.00 173.24 175.44