#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 -0.82 0.44 1.61 0.01 -1.26 -5.18 113.70 108.51 2rpc s SER 2 Ca 0.00 1.33 0.04 0.00 1.31 0.00 0.00 55.95 58.63 2rpc s SER 2 Cb 0.00 1.21 -0.04 0.00 0.21 0.00 0.00 66.02 67.40 2rpc s SER 2 CO 0.00 -0.23 0.03 -0.55 0.41 0.00 0.00 173.24 172.90 2rpc s SER 3 N 1.59 3.66 0.35 2.44 0.15 -1.26 -5.17 113.70 115.45 2rpc s SER 3 Ca -0.10 -1.54 0.07 0.00 0.70 0.00 0.00 55.95 55.08 2rpc s SER 3 Cb -0.06 0.16 -0.02 0.00 -1.71 0.00 0.00 66.02 64.38 2rpc s SER 3 CO -0.18 -0.71 0.24 0.61 1.20 0.00 0.00 173.24 174.40 2rpc n GLY 4 N -1.05 3.02 3.59 9.45 0.00 -1.26 -5.18 105.19 113.76 2rpc n GLY 4 Ca -0.11 -1.95 -0.04 0.00 0.00 0.00 0.00 46.02 43.92 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 -3.34 -0.15 0.53 1.61 0.15 -1.26 -5.19 113.70 106.05 2rpc s SER 5 Ca 0.34 -0.02 0.04 0.00 0.70 0.00 0.00 55.95 57.01 2rpc s SER 5 Cb 0.02 0.18 0.02 0.00 -1.71 0.00 0.00 66.02 64.52 2rpc s SER 5 CO 0.24 -0.29 0.29 -0.44 1.20 0.00 0.00 173.24 174.24 2rpc s SER 6 N -2.32 4.50 0.60 5.45 0.01 -1.26 -5.05 113.70 115.63 2rpc s SER 6 Ca 0.10 -1.34 0.00 0.00 1.31 0.00 0.00 55.95 56.02 2rpc s SER 6 Cb -0.00 0.39 0.00 0.00 0.21 0.00 0.00 66.02 66.62 2rpc s SER 6 CO -0.05 -1.01 0.00 0.61 0.41 0.00 0.00 173.24 173.20 2rpc n GLY 7 N -1.61 -4.24 3.75 3.44 0.00 -1.26 -4.95 105.19 100.33 2rpc n GLY 7 Ca -0.06 -0.81 -0.32 0.00 0.00 0.00 0.00 46.02 44.83 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 -5.13 2.94 0.00 1.61 1.11 -1.26 -5.12 119.66 113.81 2rpc s GLN 8 Ca 0.00 -0.57 0.00 0.00 0.01 0.00 0.00 55.36 54.80 2rpc s GLN 8 Cb 0.00 -2.78 0.00 0.00 -1.01 0.00 0.00 33.01 29.22 2rpc s GLN 8 CO 0.00 0.62 0.00 -0.35 0.01 0.00 0.00 175.29 175.57 2rpc n PRO 9 N 1.07 -0.51 -4.06 2.91 -0.04 -1.26 -5.05 135.00 128.07 2rpc n PRO 9 Ca -0.12 0.00 -0.33 0.00 -0.04 0.00 0.00 63.50 63.00 2rpc n PRO 9 Cb 0.52 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 -0.75 4.91 -0.55 0.52 1.01 -1.26 -5.06 121.20 120.02 2rpc s ILE 10 Ca 0.00 -0.31 -0.26 0.00 0.00 0.00 0.00 60.65 60.08 2rpc s ILE 10 Cb 0.00 -3.24 0.04 0.00 0.01 0.00 0.00 42.46 39.26 2rpc s ILE 10 CO 0.00 0.37 1.04 -0.75 0.00 0.00 0.00 174.94 175.60 2rpc s LYS 11 N -1.71 3.43 -0.02 2.79 2.20 -1.26 -5.01 119.74 120.16 2rpc s LYS 11 Ca 0.23 -0.01 0.07 0.00 -0.36 0.00 0.00 55.97 55.91 2rpc s LYS 11 Cb -0.12 -4.02 -0.02 0.00 -1.51 0.00 0.00 37.83 32.16 2rpc s LYS 11 CO 0.14 -1.53 -0.24 -1.14 -0.36 0.00 0.00 175.35 172.22 2rpc s GLN 12 N 4.31 2.06 -0.19 4.03 0.74 -1.24 -5.11 119.66 124.26 2rpc s GLN 12 Ca 0.36 -0.88 -0.23 0.00 0.05 0.00 0.00 55.36 54.67 2rpc s GLN 12 Cb -0.10 -1.95 -0.02 0.00 1.10 0.00 0.00 33.01 32.04 2rpc s GLN 12 CO 0.23 0.50 0.72 -1.83 -0.55 0.00 0.00 175.29 174.36 2rpc s GLU 13 N -0.50 4.25 0.37 1.67 -1.05 -1.26 -4.17 118.70 118.00 2rpc s GLU 13 Ca 0.07 0.80 0.04 0.00 -0.15 0.00 0.00 54.97 55.73 2rpc s GLU 13 Cb -0.10 -3.58 -0.01 0.00 -0.44 0.00 0.00 34.13 30.00 2rpc s GLU 13 CO -0.00 -0.29 0.54 -0.51 0.95 0.00 0.00 175.26 175.95 2rpc s LEU 14 N 2.04 3.89 -0.11 1.83 1.43 0.20 -4.94 118.68 123.03 2rpc s LEU 14 Ca 0.33 0.06 -0.06 0.00 -1.03 0.00 0.00 54.13 53.44 2rpc s LEU 14 Cb -0.16 -2.96 0.04 0.00 0.03 0.00 0.00 46.19 43.15 2rpc s LEU 14 CO 0.11 -0.48 0.26 -0.44 0.23 0.00 0.00 176.35 176.03 2rpc s SER 15 N -4.16 -0.28 -0.22 2.29 0.01 -1.26 -3.13 113.70 106.95 2rpc s SER 15 Ca 0.45 0.54 -0.01 0.00 1.31 0.00 0.00 55.95 58.24 2rpc s SER 15 Cb -0.10 0.44 0.02 0.00 0.21 0.00 0.00 66.02 66.60 2rpc s SER 15 CO 0.34 -0.16 -0.11 0.00 0.41 0.00 0.00 173.24 173.72 2rpc s LYS 17 N 1.32 3.08 -0.20 0.00 -0.14 -1.26 -4.35 119.74 118.19 2rpc s LYS 17 Ca 0.02 -1.77 -0.06 0.00 -1.36 0.00 0.00 55.97 52.80 2rpc s LYS 17 Cb -0.15 -4.32 -0.03 0.00 -1.68 0.00 0.00 37.83 31.65 2rpc s LYS 17 CO -0.07 -1.35 0.02 -0.46 -0.76 0.00 0.00 175.35 172.73 2rpc s TRP 18 N 1.52 3.08 -0.31 3.18 -0.11 -1.26 -3.49 118.94 121.55 2rpc s TRP 18 Ca 0.06 -0.32 0.02 0.00 1.22 0.00 0.00 56.10 57.08 2rpc s TRP 18 Cb -0.27 -2.08 0.09 0.00 -1.50 0.00 0.00 33.47 29.71 2rpc s TRP 18 CO 0.02 -0.15 0.04 0.42 -4.62 0.00 0.00 176.95 172.66 2rpc s ILE 19 N 0.86 1.79 -0.36 5.86 1.01 0.11 -1.82 121.20 128.65 2rpc s ILE 19 Ca 0.01 -1.89 -0.24 0.00 0.00 0.00 0.00 60.65 58.53 2rpc s ILE 19 Cb -0.14 -2.26 0.01 0.00 0.01 0.00 0.00 42.46 40.08 2rpc s ILE 19 CO 0.02 -0.51 0.85 -0.62 0.00 0.00 0.00 174.94 174.68 2rpc s ASP 20 N 1.18 6.63 0.59 3.58 -1.08 -1.26 -4.40 116.67 121.90 2rpc s ASP 20 Ca 0.07 0.51 0.36 0.00 -0.52 0.00 0.00 52.55 52.97 2rpc s ASP 20 Cb -0.19 -2.43 1.24 0.00 -1.46 0.00 0.00 42.92 40.08 2rpc s ASP 20 CO -0.12 -0.77 1.41 -0.33 0.52 0.00 0.00 175.17 175.88 2rpc h GLU 21 N 8.41 0.00 -1.11 4.34 5.08 -1.98 1.52 114.58 130.84 2rpc h GLU 21 Ca -0.24 0.00 -0.64 0.00 -1.00 0.00 0.00 59.36 57.48 2rpc h GLU 21 Cb 1.09 0.00 -0.35 0.00 0.50 0.00 0.00 28.75 29.99 2rpc h GLU 21 CO 0.94 0.00 0.14 0.00 -1.00 0.00 0.00 179.01 179.09 2rpc n ALA 22 N -2.50 5.77 -0.57 3.43 0.00 -1.26 -5.05 120.51 120.33 2rpc n ALA 22 Ca 0.31 -3.77 -0.23 0.00 0.00 0.00 0.00 53.44 49.75 2rpc n ALA 22 Cb 1.71 -1.17 0.16 0.00 0.00 0.00 0.00 19.45 20.15 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 -0.75 -2.15 -0.00 0.00 0.00 0.52 -4.95 117.38 110.04 2rpc n GLN 23 Ca 0.53 -0.63 0.06 0.00 0.00 0.00 0.00 57.00 56.96 2rpc n GLN 23 Cb 0.71 -1.54 -0.09 0.00 0.00 0.00 0.00 30.24 29.32 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 -1.44 0.14 -4.24 2.61 7.94 -1.26 -5.01 117.00 115.74 2rpc n LEU 24 Ca 0.04 -0.12 -0.16 0.00 -1.11 0.00 0.00 56.01 54.67 2rpc n LEU 24 Cb 0.45 0.00 -0.11 0.00 0.53 0.00 0.00 43.42 44.30 2rpc n LEU 24 CO 0.33 0.03 -0.43 -0.44 -1.11 0.00 0.00 177.39 175.78 2rpc s SER 25 N -3.16 1.85 0.11 1.96 0.01 -1.26 -5.17 113.70 108.04 2rpc s SER 25 Ca -0.02 -0.89 0.04 0.00 1.31 0.00 0.00 55.95 56.39 2rpc s SER 25 Cb 0.08 -0.04 -0.04 0.00 0.21 0.00 0.00 66.02 66.24 2rpc s SER 25 CO 0.52 -0.23 -0.10 -0.13 0.41 0.00 0.00 173.24 173.71 2rpc s ARG 26 N -3.09 0.90 0.59 12.44 1.81 -1.26 -3.97 118.95 126.37 2rpc s ARG 26 Ca 0.11 -1.24 -0.18 0.00 -1.72 0.00 0.00 55.73 52.71 2rpc s ARG 26 Cb -0.02 -0.56 -0.04 0.00 -0.45 0.00 0.00 34.95 33.89 2rpc s ARG 26 CO 0.02 0.08 1.12 -1.25 -0.68 0.00 0.00 175.30 174.59 2rpc s PRO 27 N -3.06 3.13 -0.43 3.54 0.04 -1.26 -4.99 135.00 131.98 2rpc s PRO 27 Ca 0.08 1.52 -0.29 0.00 0.04 0.00 0.00 61.00 62.36 2rpc s PRO 27 Cb -0.01 -1.98 -0.14 0.00 0.04 0.00 0.00 34.50 32.41 2rpc s PRO 27 CO 0.00 -1.01 1.59 1.63 0.04 0.00 0.00 177.00 179.25 2rpc n LYS 28 N -1.75 0.00 -4.28 4.56 5.02 -1.25 -4.89 118.16 115.57 2rpc n LYS 28 Ca 0.11 0.00 -0.24 0.00 -2.02 0.00 0.00 58.31 56.16 2rpc n LYS 28 Cb 0.51 -1.05 -0.08 0.00 -0.02 0.00 0.00 35.03 34.40 2rpc n LYS 28 CO 0.00 0.00 0.00 -1.59 -0.52 0.00 0.00 177.40 175.29 2rpc s LYS 29 N 4.68 2.27 0.37 1.97 -2.85 -1.26 -5.11 119.74 119.81 2rpc s LYS 29 Ca 0.86 -1.32 -0.16 0.00 -1.00 0.00 0.00 55.97 54.35 2rpc s LYS 29 Cb -1.01 -2.20 -0.09 0.00 -2.06 0.00 0.00 37.83 32.47 2rpc s LYS 29 CO 0.43 0.40 0.80 -1.54 0.10 0.00 0.00 175.35 175.54 2rpc s SER 30 N -3.35 6.78 0.23 0.03 1.04 -1.26 -4.66 113.70 112.51 2rpc s SER 30 Ca 0.29 1.37 -0.30 0.00 0.48 0.00 0.00 55.95 57.79 2rpc s SER 30 Cb -0.07 -2.41 -0.15 0.00 0.10 0.00 0.00 66.02 63.48 2rpc s SER 30 CO 0.19 -0.28 1.07 0.00 0.98 0.00 0.00 173.24 175.20 2rpc s ASP 32 N -0.29 6.19 -0.05 0.00 1.47 -1.26 -4.68 116.67 118.04 2rpc s ASP 32 Ca 0.66 -1.36 -0.31 0.00 1.18 0.00 0.00 52.55 52.72 2rpc s ASP 32 Cb -0.78 -2.25 0.11 0.00 -0.34 0.00 0.00 42.92 39.66 2rpc s ASP 32 CO 0.56 -0.89 1.03 -0.60 0.68 0.00 0.00 175.17 175.95 2rpc s ARG 33 N 2.18 0.66 0.19 2.11 3.52 -1.26 -5.16 118.95 121.19 2rpc s ARG 33 Ca 0.09 -0.27 -0.11 0.00 -0.13 0.00 0.00 55.73 55.31 2rpc s ARG 33 Cb -0.24 0.28 -0.00 0.00 -1.56 0.00 0.00 34.95 33.43 2rpc s ARG 33 CO 0.07 -0.29 0.36 0.95 -0.81 0.00 0.00 175.30 175.58 2rpc s THR 34 N -2.85 0.04 0.26 4.11 -4.23 -1.26 -4.40 115.64 107.31 2rpc s THR 34 Ca 0.08 -1.34 -0.12 0.00 -1.18 0.00 0.00 61.69 59.12 2rpc s THR 34 Cb -0.01 -1.94 -0.00 0.00 1.34 0.00 0.00 72.50 71.89 2rpc s THR 34 CO -0.06 -0.17 0.49 -0.36 -0.54 0.00 0.00 174.62 173.98 2rpc s PHE 35 N -3.98 0.39 -0.02 3.99 0.08 -1.18 -4.98 117.98 112.28 2rpc s PHE 35 Ca 0.19 -0.75 0.03 0.00 0.12 0.00 0.00 56.93 56.51 2rpc s PHE 35 Cb 0.02 0.20 -0.04 0.00 -0.57 0.00 0.00 43.02 42.63 2rpc s PHE 35 CO 0.03 -1.02 0.03 -1.13 -0.10 0.00 0.00 175.22 173.03 2rpc n SER 36 N -0.47 4.29 -4.68 1.36 3.41 -1.26 -0.63 113.62 115.64 2rpc n SER 36 Ca -0.02 0.00 -0.23 0.00 -0.26 0.00 0.00 58.87 58.36 2rpc n SER 36 Cb 0.62 0.78 -0.07 0.00 -0.26 0.00 0.00 64.21 65.28 2rpc n SER 36 CO 0.00 0.00 0.00 0.42 -0.16 0.00 0.00 175.04 175.30 2rpc s THR 37 N -2.12 3.43 0.02 6.66 -4.23 -1.26 -3.64 115.64 114.49 2rpc s THR 37 Ca -0.01 -1.83 -0.27 0.00 -1.18 0.00 0.00 61.69 58.40 2rpc s THR 37 Cb 0.01 -2.92 -0.16 0.00 1.34 0.00 0.00 72.50 70.77 2rpc s THR 37 CO 0.12 -0.33 1.29 -0.03 -0.54 0.00 0.00 174.62 175.14 2rpc h MET 38 N 1.78 -0.57 -1.05 3.99 1.85 -1.96 -2.99 114.93 115.99 2rpc h MET 38 Ca -0.44 0.04 0.27 0.00 -0.61 0.00 0.00 59.70 58.95 2rpc h MET 38 Cb 1.25 0.13 -0.10 0.00 0.43 0.00 0.00 31.60 33.31 2rpc h MET 38 CO 0.61 -0.27 0.67 0.45 -0.40 0.00 0.00 176.91 177.97 2rpc h HIS 39 N -0.85 0.69 -0.83 1.39 3.86 -1.99 0.26 115.15 117.68 2rpc h HIS 39 Ca -0.06 0.02 0.04 0.00 -1.16 0.00 0.00 60.37 59.21 2rpc h HIS 39 Cb 0.56 -0.20 -0.05 0.00 1.06 0.00 0.00 27.41 28.78 2rpc h HIS 39 CO 0.01 0.05 0.52 0.93 0.86 0.00 0.00 177.93 180.30 2rpc h GLU 40 N 0.40 0.98 0.36 2.45 4.39 -1.94 0.11 114.58 121.32 2rpc h GLU 40 Ca 0.61 -0.06 -0.02 0.00 0.34 0.00 0.00 59.36 60.23 2rpc h GLU 40 Cb 1.52 -0.22 0.00 0.00 -0.10 0.00 0.00 28.75 29.95 2rpc h GLU 40 CO -0.32 0.65 -0.17 1.25 -1.16 0.00 0.00 179.01 179.25 2rpc h LEU 41 N 1.01 -0.41 -0.08 1.33 5.85 -0.46 -2.73 115.31 119.81 2rpc h LEU 41 Ca 0.34 -0.13 0.04 0.00 0.84 0.00 0.00 57.88 58.97 2rpc h LEU 41 Cb 0.05 0.11 -0.06 0.00 0.37 0.00 0.00 40.66 41.12 2rpc h LEU 41 CO -0.13 0.03 -0.34 0.58 -0.34 0.00 0.00 178.44 178.25 2rpc h VAL 42 N -0.99 0.26 -0.32 1.05 2.07 -1.28 0.33 116.25 117.37 2rpc h VAL 42 Ca -0.05 0.00 0.09 0.00 0.82 0.00 0.00 66.70 67.56 2rpc h VAL 42 Cb 0.51 0.26 -0.01 0.00 -1.52 0.00 0.00 31.29 30.54 2rpc h VAL 42 CO 0.08 0.00 0.35 0.74 0.02 0.00 0.00 177.57 178.76 2rpc h THR 43 N -0.44 0.41 0.00 2.57 2.02 -0.88 0.12 112.91 116.71 2rpc h THR 43 Ca 0.08 0.00 0.00 0.00 0.77 0.00 0.00 66.41 67.26 2rpc h THR 43 Cb 0.57 0.72 0.00 0.00 -1.74 0.00 0.00 68.15 67.70 2rpc h THR 43 CO -0.33 0.00 -0.12 -0.74 0.37 0.00 0.00 175.52 174.70 2rpc h HIS 44 N 0.00 0.00 -0.08 3.16 6.17 -0.50 -0.51 115.15 123.39 2rpc h HIS 44 Ca 0.15 0.00 0.02 0.00 0.71 0.00 0.00 60.37 61.26 2rpc h HIS 44 Cb 0.86 0.00 -0.00 0.00 2.52 0.00 0.00 27.41 30.78 2rpc h HIS 44 CO 0.00 0.00 0.29 0.28 0.71 0.00 0.00 177.93 179.21 2rpc h VAL 45 N -0.73 0.10 0.00 5.26 2.07 -0.23 2.26 116.25 124.98 2rpc h VAL 45 Ca 0.00 0.00 -0.19 0.00 0.82 0.00 0.00 66.70 67.33 2rpc h VAL 45 Cb 0.12 0.72 -0.03 0.00 -1.52 0.00 0.00 31.29 30.59 2rpc h VAL 45 CO 0.00 0.00 -1.29 0.41 0.02 0.00 0.00 177.57 176.71 2rpc n THR 46 N -3.13 1.50 -0.09 2.57 -1.04 0.41 -1.76 114.28 112.73 2rpc n THR 46 Ca -0.00 -0.01 -0.18 0.00 -2.04 0.00 0.00 64.05 61.81 2rpc n THR 46 Cb 0.37 -2.14 -0.10 0.00 -1.82 0.00 0.00 70.33 66.63 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 -0.65 1.99 114.93 115.31 2rpc h MET 47 Ca -0.28 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.36 2rpc h MET 47 Cb 1.11 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.77 2rpc h MET 47 CO -0.17 0.87 0.00 0.39 1.06 0.00 0.00 176.91 179.06 2rpc n GLU 48 N -4.48 0.54 0.00 1.72 1.02 0.74 -2.30 120.64 117.88 2rpc n GLU 48 Ca -0.26 0.00 0.00 0.00 -0.02 0.00 0.00 57.16 56.88 2rpc n GLU 48 Cb 0.59 -1.29 0.00 0.00 -0.02 0.00 0.00 31.44 30.73 2rpc n GLU 48 CO 0.00 0.00 0.00 0.72 1.18 0.00 0.00 177.13 179.03 2rpc n HIS 49 N -0.79 -0.16 0.72 -0.32 8.25 0.40 -4.82 115.22 118.50 2rpc n HIS 49 Ca 0.07 0.00 0.07 0.00 -0.26 0.00 0.00 57.72 57.60 2rpc n HIS 49 Cb 0.03 0.27 0.37 0.00 1.12 0.00 0.00 29.99 31.78 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 -1.81 0.46 -4.42 1.59 0.31 0.11 -4.95 118.33 109.61 2rpc n VAL 50 Ca 0.00 0.11 0.00 0.00 -0.01 0.00 0.00 64.34 64.44 2rpc n VAL 50 Cb 0.00 -0.89 0.00 0.00 -0.91 0.00 0.00 33.84 32.04 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 -0.11 -0.91 0.00 2.92 0.00 0.65 -4.84 105.19 102.90 2rpc n GLY 51 Ca 0.08 -1.16 0.00 0.00 0.00 0.00 0.00 46.02 44.94 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 1.83 0.00 -0.02 0.00 -1.26 -3.36 105.19 102.38 2rpc n GLY 52 Ca 0.00 -2.11 0.07 0.00 0.00 0.00 0.00 46.02 43.98 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 -0.93 0.28 0.08 1.61 -0.04 -1.26 -2.45 135.00 132.29 2rpc n PRO 53 Ca 0.00 0.11 -0.04 0.00 -0.04 0.00 0.00 63.50 63.53 2rpc n PRO 53 Cb 0.00 -1.50 -0.08 0.00 -0.04 0.00 0.00 33.50 31.88 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 0.00 -7.11 0.54 5.08 -1.96 -3.46 114.58 107.67 2rpc h GLU 54 Ca 0.00 0.00 -0.53 0.00 -1.00 0.00 0.00 59.36 57.83 2rpc h GLU 54 Cb 0.11 0.00 0.12 0.00 0.50 0.00 0.00 28.75 29.48 2rpc h GLU 54 CO 0.00 0.86 0.47 -0.65 -1.00 0.00 0.00 179.01 178.68 2rpc s GLN 55 N -2.78 2.85 0.00 2.33 1.11 -1.02 -5.01 119.66 117.14 2rpc s GLN 55 Ca 0.02 1.83 0.00 0.00 0.01 0.00 0.00 55.36 57.22 2rpc s GLN 55 Cb 0.09 -1.91 0.00 0.00 -1.01 0.00 0.00 33.01 30.18 2rpc s GLN 55 CO 0.80 -1.30 0.00 -1.71 0.01 0.00 0.00 175.29 173.09 2rpc n ASN 56 N -1.75 0.00 -4.66 5.90 2.85 -1.26 -4.90 115.26 111.44 2rpc n ASN 56 Ca 0.14 0.09 -0.43 0.00 -0.11 0.00 0.00 54.58 54.27 2rpc n ASN 56 Cb 0.50 -0.30 -0.02 0.00 1.24 0.00 0.00 39.78 41.20 2rpc n ASN 56 CO 0.00 0.00 0.00 0.21 -2.11 0.00 0.00 177.26 175.36 2rpc s ASN 57 N -2.60 7.05 -0.31 1.20 3.84 -1.26 -5.02 114.94 117.84 2rpc s ASN 57 Ca 0.00 1.30 -0.06 0.00 0.21 0.00 0.00 52.86 54.31 2rpc s ASN 57 Cb 0.00 -2.53 0.02 0.00 -0.55 0.00 0.00 41.25 38.19 2rpc s ASN 57 CO 0.00 -0.68 0.08 -1.00 -2.79 0.00 0.00 177.10 172.71 2rpc s HIS 58 N 3.22 3.19 -0.04 0.43 3.76 -1.26 -5.07 115.29 119.52 2rpc s HIS 58 Ca 0.43 -1.23 0.00 0.00 -0.15 0.00 0.00 55.06 54.12 2rpc s HIS 58 Cb -0.15 -2.25 0.03 0.00 1.11 0.00 0.00 32.58 31.32 2rpc s HIS 58 CO 0.07 -0.66 -0.01 0.08 -0.85 0.00 0.00 174.74 173.38 2rpc s VAL 59 N 1.44 0.26 -0.31 -0.90 1.01 -1.26 -4.59 120.40 116.06 2rpc s VAL 59 Ca 0.00 0.06 -0.10 0.00 0.00 0.00 0.00 61.98 61.95 2rpc s VAL 59 Cb -0.18 -0.36 -0.01 0.00 0.00 0.00 0.00 36.38 35.83 2rpc s VAL 59 CO 0.02 0.18 0.16 0.00 0.00 0.00 0.00 175.10 175.45 2rpc s TYR 61 N 1.63 3.40 0.15 0.00 1.51 -1.26 -4.72 117.35 118.06 2rpc s TYR 61 Ca 0.05 -1.58 -0.13 0.00 -1.01 0.00 0.00 57.07 54.39 2rpc s TYR 61 Cb -0.17 -3.75 -0.07 0.00 -0.11 0.00 0.00 41.96 37.87 2rpc s TYR 61 CO 0.07 -1.00 0.54 -0.46 -1.11 0.00 0.00 175.55 173.58 2rpc s TRP 62 N 1.17 3.58 0.63 2.71 -0.11 -1.26 0.04 118.94 125.70 2rpc s TRP 62 Ca 0.07 1.01 0.15 0.00 1.22 0.00 0.00 56.10 58.55 2rpc s TRP 62 Cb -0.24 -2.34 0.80 0.00 -1.50 0.00 0.00 33.47 30.18 2rpc s TRP 62 CO -0.01 0.42 1.44 1.49 -4.62 0.00 0.00 176.95 175.67 2rpc h GLU 63 N 3.45 0.00 -0.02 5.86 4.81 -1.84 -1.94 114.58 124.90 2rpc h GLU 63 Ca -0.48 0.00 -0.15 0.00 -0.13 0.00 0.00 59.36 58.60 2rpc h GLU 63 Cb 1.19 0.00 -0.16 0.00 0.63 0.00 0.00 28.75 30.41 2rpc h GLU 63 CO 0.66 0.00 -0.36 0.39 -0.73 0.00 0.00 179.01 178.97 2rpc n GLU 64 N -2.64 0.52 -1.59 1.92 1.02 -1.26 -5.05 120.64 113.56 2rpc n GLU 64 Ca -0.01 -1.22 -0.48 0.00 -0.02 0.00 0.00 57.16 55.43 2rpc n GLU 64 Cb 0.67 0.37 -0.04 0.00 -0.02 0.00 0.00 31.44 32.43 2rpc n GLU 64 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 2rpc h PRO 66 N 3.37 0.00 -0.48 0.00 0.13 -1.98 -3.03 132.00 130.01 2rpc h PRO 66 Ca -0.43 0.00 -0.12 0.00 -0.87 0.00 0.00 66.00 64.58 2rpc h PRO 66 Cb 1.34 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.45 2rpc h PRO 66 CO 0.70 0.23 -0.18 0.00 -0.23 0.00 0.00 178.00 178.52 2rpc h ARG 67 N 0.00 0.96 -0.93 0.86 -0.00 -1.95 -3.47 114.38 109.84 2rpc h ARG 67 Ca -0.00 -0.38 -0.07 0.00 -0.50 0.00 0.00 59.98 59.02 2rpc h ARG 67 Cb 0.67 -0.05 0.00 0.00 0.00 0.00 0.00 29.97 30.60 2rpc h ARG 67 CO 0.03 1.05 -0.10 0.39 0.00 0.00 0.00 179.97 181.34 2rpc n GLU 68 N -4.12 -0.64 -2.54 0.04 1.02 -1.15 -3.69 120.64 109.57 2rpc n GLU 68 Ca 0.01 0.17 -0.03 0.00 -0.02 0.00 0.00 57.16 57.29 2rpc n GLU 68 Cb 0.43 -3.66 0.01 0.00 -0.02 0.00 0.00 31.44 28.20 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 -0.93 0.72 3.32 0.62 0.00 -1.26 -5.01 105.19 102.64 2rpc n GLY 69 Ca -0.03 -0.61 -0.46 0.00 0.00 0.00 0.00 46.02 44.92 2rpc n GLY 69 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 2rpc s LYS 70 N -4.99 3.07 0.87 1.61 2.20 -1.24 -5.06 119.74 116.20 2rpc s LYS 70 Ca 0.05 -1.77 -0.15 0.00 -0.36 0.00 0.00 55.97 53.74 2rpc s LYS 70 Cb -0.02 -4.32 -0.04 0.00 -1.51 0.00 0.00 37.83 31.94 2rpc s LYS 70 CO 0.07 -1.34 0.15 -1.13 -0.36 0.00 0.00 175.35 172.74 2rpc n SER 71 N 5.18 -2.77 -3.70 1.43 3.41 -1.26 -5.01 113.62 110.91 2rpc n SER 71 Ca -0.10 0.39 -0.12 0.00 -0.26 0.00 0.00 58.87 58.78 2rpc n SER 71 Cb 0.41 -1.09 0.03 0.00 -0.26 0.00 0.00 64.21 63.30 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 -2.89 -2.18 -0.78 7.33 3.72 -1.26 -5.03 117.46 116.37 2rpc n PHE 72 Ca 0.06 -1.27 0.08 0.00 -0.05 0.00 0.00 57.45 56.27 2rpc n PHE 72 Cb 0.53 -0.31 0.25 0.00 -0.94 0.00 0.00 39.48 39.01 2rpc n PHE 72 CO 0.00 0.00 0.00 1.63 -0.05 0.00 0.00 176.76 178.34 2rpc n LYS 73 N -1.62 3.12 -3.63 -1.08 5.02 -1.26 -5.00 118.16 113.71 2rpc n LYS 73 Ca 0.07 -2.69 -0.03 0.00 -2.02 0.00 0.00 58.31 53.64 2rpc n LYS 73 Cb 0.35 -1.75 -0.02 0.00 -0.02 0.00 0.00 35.03 33.59 2rpc n LYS 73 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 2rpc s ALA 74 N -2.34 -2.17 -0.01 7.82 0.00 -1.26 -5.02 121.76 118.78 2rpc s ALA 74 Ca 0.39 1.79 -0.25 0.00 0.00 0.00 0.00 51.96 53.89 2rpc s ALA 74 Cb 0.30 -0.29 -0.18 0.00 0.00 0.00 0.00 23.12 22.94 2rpc s ALA 74 CO 0.12 -0.58 1.24 -0.22 0.00 0.00 0.00 175.76 176.32 2rpc h LYS 75 N 2.00 -0.15 -0.65 0.00 1.63 -1.97 -3.06 116.57 114.36 2rpc h LYS 75 Ca -0.05 0.01 0.14 0.00 -0.85 0.00 0.00 60.65 59.90 2rpc h LYS 75 Cb 1.14 0.03 -0.04 0.00 -0.60 0.00 0.00 32.23 32.77 2rpc h LYS 75 CO 0.20 0.24 0.44 0.10 -3.45 0.00 0.00 179.45 176.98 2rpc h TYR 76 N -0.59 0.31 -0.83 1.91 -0.00 -1.98 0.15 116.97 115.94 2rpc h TYR 76 Ca -0.02 0.01 -0.03 0.00 -0.00 0.00 0.00 58.73 58.69 2rpc h TYR 76 Cb 0.46 -0.10 -0.04 0.00 -0.00 0.00 0.00 36.73 37.06 2rpc h TYR 76 CO 0.06 0.13 0.41 0.87 -0.00 0.00 0.00 178.16 179.62 2rpc h LYS 77 N 0.27 1.19 0.01 0.10 1.79 -1.93 -1.58 116.57 116.42 2rpc h LYS 77 Ca 0.31 -0.17 -0.00 0.00 -2.18 0.00 0.00 60.65 58.61 2rpc h LYS 77 Cb 0.85 -0.22 0.00 0.00 -1.58 0.00 0.00 32.23 31.28 2rpc h LYS 77 CO -0.07 0.91 -0.01 1.25 -1.08 0.00 0.00 179.45 180.46 2rpc h LEU 78 N 1.18 -0.01 -1.17 2.94 5.85 -0.98 -2.92 115.31 120.20 2rpc h LEU 78 Ca 0.29 -0.80 0.23 0.00 0.84 0.00 0.00 57.88 58.43 2rpc h LEU 78 Cb 0.11 0.00 -0.10 0.00 0.37 0.00 0.00 40.66 41.04 2rpc h LEU 78 CO -0.04 0.83 0.62 0.58 -0.34 0.00 0.00 178.44 180.09 2rpc h VAL 79 N -0.89 0.61 -0.07 1.05 2.07 -1.06 0.29 116.25 118.25 2rpc h VAL 79 Ca -0.00 -0.20 -0.16 0.00 0.82 0.00 0.00 66.70 67.16 2rpc h VAL 79 Cb 0.81 -0.01 -0.01 0.00 -1.52 0.00 0.00 31.29 30.56 2rpc h VAL 79 CO 0.00 0.11 -0.66 0.78 0.02 0.00 0.00 177.57 177.82 2rpc h ASN 80 N 0.58 0.33 -0.59 0.57 2.35 -1.37 -3.20 115.58 114.26 2rpc h ASN 80 Ca 0.59 -0.20 0.01 0.00 -0.55 0.00 0.00 56.30 56.15 2rpc h ASN 80 Cb 1.18 -0.10 -0.03 0.00 0.05 0.00 0.00 38.32 39.42 2rpc h ASN 80 CO -0.35 0.90 0.38 -0.74 -1.65 0.00 0.00 177.43 175.96 2rpc h HIS 81 N 0.20 0.71 -0.03 1.19 -0.00 -0.24 -1.06 115.15 115.93 2rpc h HIS 81 Ca -0.01 0.02 0.01 0.00 -0.00 0.00 0.00 60.37 60.38 2rpc h HIS 81 Cb 1.19 -0.24 -0.00 0.00 -0.00 0.00 0.00 27.41 28.36 2rpc h HIS 81 CO 0.03 0.43 0.25 0.82 -0.00 0.00 0.00 177.93 179.46 2rpc h ILE 82 N 0.76 0.04 -0.52 6.26 2.04 -1.42 -0.21 117.51 124.46 2rpc h ILE 82 Ca 0.22 0.00 0.01 0.00 1.00 0.00 0.00 64.86 66.10 2rpc h ILE 82 Cb -0.05 0.76 -0.03 0.00 -0.74 0.00 0.00 36.82 36.76 2rpc h ILE 82 CO -0.07 0.00 0.35 0.03 0.00 0.00 0.00 178.15 178.46 2rpc h ARG 83 N 0.00 0.65 0.00 2.37 2.47 -1.30 -0.50 114.38 118.07 2rpc h ARG 83 Ca 0.01 -0.04 -0.03 0.00 -1.26 0.00 0.00 59.98 58.67 2rpc h ARG 83 Cb 0.51 -0.15 -0.00 0.00 -1.65 0.00 0.00 29.97 28.68 2rpc h ARG 83 CO -0.00 0.43 -0.12 -0.39 0.56 0.00 0.00 179.97 180.45 2rpc h VAL 84 N 0.67 0.30 0.00 2.04 -1.51 -1.17 -2.71 116.25 113.87 2rpc h VAL 84 Ca 0.20 -0.89 -0.04 0.00 -1.23 0.00 0.00 66.70 64.74 2rpc h VAL 84 Cb -0.03 1.69 -0.01 0.00 -2.13 0.00 0.00 31.29 30.82 2rpc h VAL 84 CO -0.05 0.12 -0.18 0.45 -1.23 0.00 0.00 177.57 176.69 2rpc h HIS 85 N 0.00 0.00 0.03 5.19 3.86 -1.19 -3.34 115.15 119.69 2rpc h HIS 85 Ca -0.00 0.00 -0.00 0.00 -1.16 0.00 0.00 60.37 59.21 2rpc h HIS 85 Cb 0.68 0.00 0.00 0.00 1.06 0.00 0.00 27.41 29.15 2rpc h HIS 85 CO 0.00 0.18 -0.01 1.79 0.86 0.00 0.00 177.93 180.75 2rpc h THR 86 N 0.00 0.00 -6.49 2.45 1.35 -1.38 -3.48 112.91 105.36 2rpc h THR 86 Ca -0.00 -0.09 -0.50 0.00 -0.55 0.00 0.00 66.41 65.27 2rpc h THR 86 Cb 0.88 0.00 -0.02 0.00 -1.73 0.00 0.00 68.15 67.27 2rpc h THR 86 CO 0.02 0.00 -0.91 0.61 -0.25 0.00 0.00 175.52 174.99 2rpc n GLY 87 N 1.31 -0.44 3.70 5.82 0.00 -1.23 -4.86 105.19 109.49 2rpc n GLY 87 Ca -0.00 0.23 -0.42 0.00 0.00 0.00 0.00 46.02 45.83 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 -6.52 4.30 0.16 1.61 2.12 -1.26 -5.02 118.70 114.09 2rpc s GLU 88 Ca 0.15 2.06 0.08 0.00 0.36 0.00 0.00 54.97 57.61 2rpc s GLU 88 Cb -0.06 -3.40 -0.04 0.00 0.26 0.00 0.00 34.13 30.89 2rpc s GLU 88 CO 0.89 -0.51 -0.17 0.15 -0.54 0.00 0.00 175.26 175.08 2rpc s LYS 89 N 1.70 1.24 -0.02 4.30 -0.14 -1.26 -5.05 119.74 120.52 2rpc s LYS 89 Ca 0.65 -1.40 -0.25 0.00 -1.36 0.00 0.00 55.97 53.61 2rpc s LYS 89 Cb -0.35 -1.25 -0.19 0.00 -1.68 0.00 0.00 37.83 34.36 2rpc s LYS 89 CO 0.29 0.25 1.22 -1.00 -0.76 0.00 0.00 175.35 175.34 2rpc h PRO 90 N 3.22 -0.07 -2.25 -1.68 0.13 -1.92 -3.45 132.00 125.96 2rpc h PRO 90 Ca -0.41 0.00 -0.01 0.00 -0.87 0.00 0.00 66.00 64.71 2rpc h PRO 90 Cb 1.21 0.02 -0.24 0.00 0.13 0.00 0.00 31.00 32.12 2rpc h PRO 90 CO 0.52 0.39 -0.24 -0.59 -0.23 0.00 0.00 178.00 177.85 2rpc s PHE 91 N -4.20 -1.07 0.00 1.56 -0.12 -1.26 -5.16 117.98 107.72 2rpc s PHE 91 Ca -0.15 1.93 0.00 0.00 -0.05 0.00 0.00 56.93 58.66 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 -0.57 0.00 -0.35 -0.05 0.00 0.00 175.22 174.88 2rpc n PRO 92 N 5.37 -0.10 -3.47 1.99 -0.04 -1.26 -4.51 135.00 132.99 2rpc n PRO 92 Ca -0.11 0.00 -0.38 0.00 -0.04 0.00 0.00 63.50 62.98 2rpc n PRO 92 Cb 0.50 0.00 -0.06 0.00 -0.04 0.00 0.00 33.50 33.89 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 5.72 0.00 -6.43 0.00 0.13 -1.95 -3.44 132.00 126.02 2rpc h PRO 94 Ca -0.46 0.00 -0.54 0.00 -0.87 0.00 0.00 66.00 64.13 2rpc h PRO 94 Cb 1.20 0.00 0.01 0.00 0.13 0.00 0.00 31.00 32.34 2rpc h PRO 94 CO 0.68 0.00 0.88 0.12 -0.23 0.00 0.00 178.00 179.46 2rpc s PHE 95 N -3.45 2.75 0.07 1.56 2.19 -1.26 -4.96 117.98 114.88 2rpc s PHE 95 Ca 0.03 0.64 -0.31 0.00 0.33 0.00 0.00 56.93 57.62 2rpc s PHE 95 Cb 0.09 -3.79 -0.07 0.00 -1.31 0.00 0.00 43.02 37.94 2rpc s PHE 95 CO 0.44 -3.01 1.40 -1.25 1.83 0.00 0.00 175.22 174.63 2rpc s PRO 96 N 2.29 4.31 0.00 10.12 0.04 -1.26 -2.48 135.00 148.01 2rpc s PRO 96 Ca 0.68 2.03 0.00 0.00 0.04 0.00 0.00 61.00 63.75 2rpc s PRO 96 Cb -0.36 -3.39 0.00 0.00 0.04 0.00 0.00 34.50 30.80 2rpc s PRO 96 CO 0.29 -0.49 0.00 0.41 0.04 0.00 0.00 177.00 177.25 2rpc n GLY 97 N 3.56 1.71 0.08 0.56 0.00 -1.26 -4.87 105.19 104.97 2rpc n GLY 97 Ca 0.12 0.00 -0.11 0.00 0.00 0.00 0.00 46.02 46.03 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 1.43 -0.38 3.85 0.00 0.00 -1.26 -4.84 105.19 103.99 2rpc n GLY 99 Ca -0.04 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.61 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 -3.89 3.70 0.10 1.61 2.47 -1.26 -4.95 119.74 117.52 2rpc s LYS 100 Ca 0.00 0.06 0.03 0.00 -1.56 0.00 0.00 55.97 54.50 2rpc s LYS 100 Cb 0.00 -3.23 -0.04 0.00 -1.46 0.00 0.00 37.83 33.10 2rpc s LYS 100 CO 0.00 0.68 -0.09 0.42 0.16 0.00 0.00 175.35 176.52 2rpc s ILE 101 N -0.84 0.92 -0.02 5.43 1.01 -1.26 -0.70 121.20 125.73 2rpc s ILE 101 Ca 0.18 -1.73 -0.00 0.00 0.00 0.00 0.00 60.65 59.09 2rpc s ILE 101 Cb -0.13 -1.46 0.03 0.00 0.01 0.00 0.00 42.46 40.90 2rpc s ILE 101 CO 0.07 -0.63 0.04 -0.36 0.00 0.00 0.00 174.94 174.06 2rpc s PHE 102 N -2.73 -0.00 -0.30 3.97 0.40 -1.26 -5.01 117.98 113.05 2rpc s PHE 102 Ca 0.08 0.16 0.26 0.00 -0.60 0.00 0.00 56.93 56.82 2rpc s PHE 102 Cb -0.01 -0.18 1.13 0.00 0.51 0.00 0.00 43.02 44.47 2rpc s PHE 102 CO -0.01 -0.09 1.77 0.00 0.70 0.00 0.00 175.22 177.60 2rpc h ALA 103 N 7.10 1.00 -3.34 5.36 0.00 -1.96 -3.42 119.26 124.00 2rpc h ALA 103 Ca -0.42 0.00 -0.64 0.00 0.00 0.00 0.00 54.91 53.84 2rpc h ALA 103 Cb 1.14 0.00 -0.22 0.00 0.00 0.00 0.00 17.79 18.71 2rpc h ALA 103 CO 0.48 0.00 -0.69 0.50 0.00 0.00 0.00 179.25 179.54 2rpc s ARG 104 N -3.44 3.54 0.11 0.00 6.06 -1.26 -4.95 118.95 119.01 2rpc s ARG 104 Ca 0.02 -0.55 -0.24 0.00 -2.50 0.00 0.00 55.73 52.46 2rpc s ARG 104 Cb 0.09 -2.83 -0.07 0.00 0.06 0.00 0.00 34.95 32.19 2rpc s ARG 104 CO 0.38 0.28 1.67 1.03 -2.50 0.00 0.00 175.30 176.17 2rpc h SER 105 N 6.55 -0.44 -0.69 -2.12 0.87 -1.99 -2.15 113.55 113.58 2rpc h SER 105 Ca -0.32 0.06 0.12 0.00 -1.23 0.00 0.00 61.79 60.42 2rpc h SER 105 Cb 1.19 0.18 -0.09 0.00 -0.44 0.00 0.00 62.40 63.25 2rpc h SER 105 CO 0.61 -0.21 0.27 -0.08 -0.53 0.00 0.00 176.83 176.88 2rpc h GLU 106 N -0.26 0.42 -0.45 2.24 4.57 -1.96 0.12 114.58 119.26 2rpc h GLU 106 Ca 0.05 -0.03 0.05 0.00 -1.18 0.00 0.00 59.36 58.25 2rpc h GLU 106 Cb 0.32 -0.09 -0.05 0.00 -0.16 0.00 0.00 28.75 28.77 2rpc h GLU 106 CO -0.14 0.28 0.17 -0.91 -1.18 0.00 0.00 179.01 177.23 2rpc h ASN 107 N 0.43 0.19 0.10 1.04 -0.26 -1.82 0.21 115.58 115.47 2rpc h ASN 107 Ca 0.37 0.05 -0.00 0.00 -0.56 0.00 0.00 56.30 56.15 2rpc h ASN 107 Cb 0.51 0.02 0.00 0.00 -1.06 0.00 0.00 38.32 37.79 2rpc h ASN 107 CO -0.36 0.14 -0.05 0.25 -1.06 0.00 0.00 177.43 176.35 2rpc h LEU 108 N 0.35 -0.11 -0.26 1.61 5.85 -0.63 -1.21 115.31 120.90 2rpc h LEU 108 Ca 0.21 -0.27 0.05 0.00 0.84 0.00 0.00 57.88 58.71 2rpc h LEU 108 Cb 0.19 0.03 -0.05 0.00 0.37 0.00 0.00 40.66 41.20 2rpc h LEU 108 CO -0.20 0.21 -0.08 0.11 -0.34 0.00 0.00 178.44 178.15 2rpc h LYS 109 N -0.45 -0.01 -0.94 1.25 1.57 -0.57 0.47 116.57 117.89 2rpc h LYS 109 Ca -0.01 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.77 2rpc h LYS 109 Cb 0.37 0.00 -0.05 0.00 0.08 0.00 0.00 32.23 32.64 2rpc h LYS 109 CO 0.02 -0.01 0.59 0.82 -0.57 0.00 0.00 179.45 180.30 2rpc h ILE 110 N -0.01 1.25 0.00 1.86 2.04 -0.60 -0.63 117.51 121.42 2rpc h ILE 110 Ca 0.13 -0.51 -0.01 0.00 1.00 0.00 0.00 64.86 65.47 2rpc h ILE 110 Cb 0.21 -0.09 -0.00 0.00 -0.74 0.00 0.00 36.82 36.19 2rpc h ILE 110 CO -0.28 0.26 -0.04 -0.74 0.00 0.00 0.00 178.15 177.35 2rpc h HIS 111 N 1.28 0.00 0.04 1.37 2.76 -0.33 -1.97 115.15 118.31 2rpc h HIS 111 Ca 0.34 0.00 -0.25 0.00 -2.20 0.00 0.00 60.37 58.26 2rpc h HIS 111 Cb -0.09 0.00 -0.02 0.00 1.55 0.00 0.00 27.41 28.85 2rpc h HIS 111 CO 0.00 0.04 -1.24 0.87 -1.30 0.00 0.00 177.93 176.31 2rpc h LYS 112 N 0.00 0.09 0.09 5.26 1.57 0.11 -3.26 116.57 120.42 2rpc h LYS 112 Ca -0.00 -0.15 -0.27 0.00 -1.87 0.00 0.00 60.65 58.36 2rpc h LYS 112 Cb 0.77 0.06 -0.01 0.00 0.08 0.00 0.00 32.23 33.13 2rpc h LYS 112 CO 0.01 0.98 -1.33 0.07 -0.57 0.00 0.00 179.45 178.61 2rpc h ARG 113 N 0.02 0.18 0.00 3.15 0.11 -1.07 -3.27 114.38 113.50 2rpc h ARG 113 Ca -0.11 -0.31 -0.01 0.00 0.10 0.00 0.00 59.98 59.64 2rpc h ARG 113 Cb 1.88 0.12 -0.00 0.00 1.11 0.00 0.00 29.97 33.08 2rpc h ARG 113 CO 0.14 1.07 -0.07 0.00 0.10 0.00 0.00 179.97 181.21 2rpc h THR 114 N 0.05 0.33 -0.71 0.08 1.03 -1.47 -2.78 112.91 109.44 2rpc h THR 114 Ca -0.16 -0.43 0.08 0.00 -0.01 0.00 0.00 66.41 65.89 2rpc h THR 114 Cb 1.95 1.31 -0.06 0.00 -1.07 0.00 0.00 68.15 70.28 2rpc h THR 114 CO 0.16 0.07 0.38 0.45 -0.01 0.00 0.00 175.52 176.58 2rpc h HIS 115 N 0.00 0.70 -2.00 0.00 3.86 -1.61 -3.44 115.15 112.66 2rpc h HIS 115 Ca -0.00 0.03 -0.55 0.00 -1.16 0.00 0.00 60.37 58.69 2rpc h HIS 115 Cb 0.31 -0.21 0.24 0.00 1.06 0.00 0.00 27.41 28.81 2rpc h HIS 115 CO 0.00 0.30 -1.87 -2.37 0.86 0.00 0.00 177.93 174.85 2rpc n THR 116 N -4.80 0.00 0.00 2.45 5.66 -1.05 -4.25 114.28 112.29 2rpc n THR 116 Ca 0.10 -0.47 0.00 0.00 -3.05 0.00 0.00 64.05 60.63 2rpc n THR 116 Cb 0.22 -0.02 0.00 0.00 -1.55 0.00 0.00 70.33 68.99 2rpc n THR 116 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 175.07 172.63 2rpc n GLY 117 N 3.45 1.07 3.76 1.09 0.00 -1.26 -4.98 105.19 108.32 2rpc n GLY 117 Ca -0.02 -0.85 -0.40 0.00 0.00 0.00 0.00 46.02 44.75 2rpc n GLY 117 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 2rpc s GLU 118 N 0.00 4.63 0.12 1.61 -6.30 -1.26 -5.07 118.70 112.44 2rpc s GLU 118 Ca 0.00 1.24 0.04 0.00 -2.50 0.00 0.00 54.97 53.75 2rpc s GLU 118 Cb 0.00 -3.28 -0.04 0.00 0.00 0.00 0.00 34.13 30.81 2rpc s GLU 118 CO 0.00 0.51 0.10 0.15 0.02 0.00 0.00 175.26 176.04 2rpc s LYS 119 N -0.97 2.86 0.11 4.30 -0.14 -1.26 -5.04 119.74 119.60 2rpc s LYS 119 Ca 0.38 -0.79 -0.14 0.00 -1.36 0.00 0.00 55.97 54.06 2rpc s LYS 119 Cb -0.23 -2.67 -0.08 0.00 -1.68 0.00 0.00 37.83 33.16 2rpc s LYS 119 CO 0.27 0.53 1.43 -1.00 -0.76 0.00 0.00 175.35 175.82 2rpc h PRO 120 N 2.89 0.74 -4.98 -1.68 0.13 -1.89 -3.42 132.00 123.79 2rpc h PRO 120 Ca -0.47 -0.39 -0.64 0.00 -0.87 0.00 0.00 66.00 63.63 2rpc h PRO 120 Cb 1.18 0.01 -0.16 0.00 0.13 0.00 0.00 31.00 32.16 2rpc h PRO 120 CO 0.64 1.01 -0.40 -0.06 -0.23 0.00 0.00 178.00 178.96 2rpc s PHE 121 N -4.36 3.23 -0.11 1.56 0.08 0.08 -5.01 117.98 113.45 2rpc s PHE 121 Ca -0.12 0.19 0.04 0.00 0.12 0.00 0.00 56.93 57.15 2rpc s PHE 121 Cb 0.09 -2.47 -0.00 0.00 -0.57 0.00 0.00 43.02 40.07 2rpc s PHE 121 CO 0.84 -0.22 -0.23 0.21 -0.10 0.00 0.00 175.22 175.72 2rpc s LYS 122 N 1.88 3.07 -0.48 0.44 2.20 -1.26 0.28 119.74 125.88 2rpc s LYS 122 Ca 0.10 -0.86 -0.44 0.00 -0.36 0.00 0.00 55.97 54.40 2rpc s LYS 122 Cb -0.16 -2.34 -0.19 0.00 -1.51 0.00 0.00 37.83 33.63 2rpc s LYS 122 CO 0.11 0.16 1.59 0.00 -0.36 0.00 0.00 175.35 176.85 2rpc n GLU 124 N 4.26 0.14 -2.29 0.00 0.28 -1.26 -4.72 120.64 117.06 2rpc n GLU 124 Ca 0.33 0.17 -0.42 0.00 -0.16 0.00 0.00 57.16 57.07 2rpc n GLU 124 Cb -0.05 -1.50 -0.03 0.00 1.43 0.00 0.00 31.44 31.29 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 -2.73 2.72 0.61 -1.84 5.36 -1.26 -4.99 117.98 115.86 2rpc s PHE 125 Ca 0.12 0.82 -0.18 0.00 -0.96 0.00 0.00 56.93 56.73 2rpc s PHE 125 Cb 0.10 -3.62 -0.02 0.00 -0.34 0.00 0.00 43.02 39.14 2rpc s PHE 125 CO 0.26 -2.30 1.19 -2.00 -1.46 0.00 0.00 175.22 170.91 2rpc s GLU 126 N 3.09 2.87 0.00 10.12 2.12 -1.26 -2.50 118.70 133.13 2rpc s GLU 126 Ca 0.61 1.76 0.00 0.00 0.36 0.00 0.00 54.97 57.70 2rpc s GLU 126 Cb -0.27 -1.92 0.00 0.00 0.26 0.00 0.00 34.13 32.19 2rpc s GLU 126 CO 0.22 -1.27 0.00 0.41 -0.54 0.00 0.00 175.26 174.08 2rpc n GLY 127 N 0.37 0.14 3.66 -1.50 0.00 -1.26 -4.96 105.19 101.64 2rpc n GLY 127 Ca 0.13 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.83 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 -1.58 4.34 0.21 0.00 1.11 -1.26 -4.94 116.67 114.56 2rpc s ASP 129 Ca 0.19 -1.57 -0.02 0.00 0.18 0.00 0.00 52.55 51.33 2rpc s ASP 129 Cb -0.11 -1.42 0.01 0.00 1.07 0.00 0.00 42.92 42.47 2rpc s ASP 129 CO 0.10 -0.27 0.31 0.54 1.18 0.00 0.00 175.17 177.03 2rpc n ARG 130 N 4.48 0.44 -3.65 8.23 5.12 -1.26 -5.08 116.66 124.94 2rpc n ARG 130 Ca -0.07 -1.59 -0.14 0.00 -1.93 0.00 0.00 57.85 54.12 2rpc n ARG 130 Cb 0.43 1.58 -0.08 0.00 -1.16 0.00 0.00 32.46 33.23 2rpc n ARG 130 CO 0.00 0.00 0.00 -0.98 -1.93 0.00 0.00 177.63 174.72 2rpc s ARG 131 N -2.41 0.76 -0.01 5.56 1.04 -1.26 -4.47 118.95 118.16 2rpc s ARG 131 Ca 0.16 0.91 -0.09 0.00 -1.04 0.00 0.00 55.73 55.67 2rpc s ARG 131 Cb -0.01 0.37 0.01 0.00 -2.04 0.00 0.00 34.95 33.28 2rpc s ARG 131 CO 0.11 -0.09 0.19 -0.06 -0.04 0.00 0.00 175.30 175.41 2rpc s PHE 132 N 0.36 -0.05 -0.58 5.89 0.08 0.14 -4.98 117.98 118.84 2rpc s PHE 132 Ca -0.00 0.05 0.22 0.00 0.12 0.00 0.00 56.93 57.32 2rpc s PHE 132 Cb -0.05 0.00 -0.17 0.00 -0.57 0.00 0.00 43.02 42.24 2rpc s PHE 132 CO 0.01 -0.29 0.81 0.00 -0.10 0.00 0.00 175.22 175.65 2rpc n ALA 133 N 1.58 3.72 -2.88 5.36 0.00 -1.26 -0.74 120.51 126.29 2rpc n ALA 133 Ca -0.21 -0.51 -0.12 0.00 0.00 0.00 0.00 53.44 52.59 2rpc n ALA 133 Cb 0.56 -0.83 -0.12 0.00 0.00 0.00 0.00 19.45 19.06 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 -3.77 0.53 0.56 0.00 6.03 -1.26 -4.72 114.94 112.31 2rpc s ASN 134 Ca 0.02 -0.38 0.26 0.00 -1.03 0.00 0.00 52.86 51.73 2rpc s ASN 134 Cb 0.15 0.03 1.61 0.00 -3.03 0.00 0.00 41.25 40.01 2rpc s ASN 134 CO 0.86 -0.15 2.18 -1.28 -2.03 0.00 0.00 177.10 176.68 2rpc h SER 135 N 5.03 0.00 -0.24 3.54 0.87 -1.97 -2.33 113.55 118.44 2rpc h SER 135 Ca -0.32 0.00 -0.04 0.00 -1.23 0.00 0.00 61.79 60.21 2rpc h SER 135 Cb 1.20 0.00 -0.01 0.00 -0.44 0.00 0.00 62.40 63.15 2rpc h SER 135 CO 0.44 0.04 0.01 -1.28 -0.53 0.00 0.00 176.83 175.51 2rpc h SER 136 N 0.00 0.41 -0.58 6.23 0.87 -1.99 -2.12 113.55 116.37 2rpc h SER 136 Ca -0.00 -0.30 -0.02 0.00 -1.23 0.00 0.00 61.79 60.24 2rpc h SER 136 Cb 0.10 -0.11 -0.03 0.00 -0.44 0.00 0.00 62.40 61.92 2rpc h SER 136 CO 0.01 0.61 0.28 -0.78 -0.53 0.00 0.00 176.83 176.42 2rpc h ASP 137 N 0.20 0.76 0.24 6.23 1.82 -1.85 -2.48 116.42 121.35 2rpc h ASP 137 Ca 0.07 -0.13 -0.00 0.00 -0.39 0.00 0.00 57.03 56.58 2rpc h ASP 137 Cb 0.39 -0.20 -0.01 0.00 0.68 0.00 0.00 39.33 40.20 2rpc h ASP 137 CO 0.01 0.68 -0.17 -0.09 -1.61 0.00 0.00 179.24 178.05 2rpc h ARG 138 N 0.79 -0.40 -0.07 0.28 2.43 -1.43 -1.42 114.38 114.57 2rpc h ARG 138 Ca 0.20 0.03 0.02 0.00 -0.81 0.00 0.00 59.98 59.42 2rpc h ARG 138 Cb 0.12 0.09 -0.00 0.00 -0.42 0.00 0.00 29.97 29.75 2rpc h ARG 138 CO -0.03 -0.27 0.14 -0.22 -1.51 0.00 0.00 179.97 178.09 2rpc h LYS 139 N -0.42 0.00 0.00 0.20 1.63 -1.28 0.27 116.57 116.97 2rpc h LYS 139 Ca -0.02 0.00 -0.02 0.00 -0.85 0.00 0.00 60.65 59.76 2rpc h LYS 139 Cb 0.36 0.00 -0.00 0.00 -0.60 0.00 0.00 32.23 31.99 2rpc h LYS 139 CO -0.00 0.00 -0.12 0.87 -3.45 0.00 0.00 179.45 176.75 2rpc h LYS 140 N 0.00 0.00 -0.01 1.90 1.57 -0.79 -3.05 116.57 116.18 2rpc h LYS 140 Ca 0.03 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.81 2rpc h LYS 140 Cb 0.32 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.63 2rpc h LYS 140 CO -0.00 0.12 -0.03 1.58 -0.57 0.00 0.00 179.45 180.54 2rpc n HIS 141 N -3.14 0.00 0.12 -1.35 -0.00 0.94 -3.52 115.22 108.28 2rpc n HIS 141 Ca 0.03 0.00 0.11 0.00 0.46 0.00 0.00 57.72 58.32 2rpc n HIS 141 Cb 0.56 -0.03 0.03 0.00 -0.12 0.00 0.00 29.99 30.42 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 1.43 0.00 -0.00 1.57 2.86 -1.48 -3.32 114.93 115.98 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 0.35 0.00 -0.00 0.00 0.06 0.00 0.00 31.60 32.01 2rpc h MET 142 CO 0.00 0.03 0.20 0.45 1.06 0.00 0.00 176.91 178.65 2rpc h HIS 143 N 0.00 0.00 0.00 -0.22 3.86 -1.71 0.34 115.15 117.42 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 1.05 0.00 0.00 0.00 1.06 0.00 0.00 27.41 29.52 2rpc h HIS 143 CO 0.00 0.00 -1.47 1.55 0.86 0.00 0.00 177.93 178.87 2rpc n VAL 144 N -2.98 0.02 0.15 2.45 3.14 -1.25 -4.20 118.33 115.65 2rpc n VAL 144 Ca -0.02 -0.26 0.04 0.00 -2.96 0.00 0.00 64.34 61.14 2rpc n VAL 144 Cb 0.25 0.45 0.05 0.00 -1.06 0.00 0.00 33.84 33.53 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 -4.16 1.45 3.86 -0.49 -3.46 115.15 112.35 2rpc h HIS 145 Ca 0.00 0.00 -0.49 0.00 -1.16 0.00 0.00 60.37 58.72 2rpc h HIS 145 Cb 0.76 0.00 0.13 0.00 1.06 0.00 0.00 27.41 29.36 2rpc h HIS 145 CO 0.00 0.41 0.28 -0.08 0.86 0.00 0.00 177.93 179.40 2rpc s THR 146 N -3.01 2.83 -0.03 2.45 -1.32 -0.95 -4.99 115.64 110.62 2rpc s THR 146 Ca 0.04 0.27 -0.09 0.00 -1.21 0.00 0.00 61.69 60.70 2rpc s THR 146 Cb 0.07 -2.84 -0.30 0.00 -1.51 0.00 0.00 72.50 67.92 2rpc s THR 146 CO 0.73 -0.35 0.75 0.28 -2.21 0.00 0.00 174.62 173.83 2rpc h SER 147 N -1.38 0.57 -5.10 8.08 0.02 -1.92 -3.49 113.55 110.33 2rpc h SER 147 Ca -0.48 -0.81 0.06 0.00 -0.84 0.00 0.00 61.79 59.71 2rpc h SER 147 Cb 1.28 -0.19 -0.03 0.00 0.14 0.00 0.00 62.40 63.60 2rpc h SER 147 CO 0.56 1.68 0.33 1.51 -1.14 0.00 0.00 176.83 179.77 2rpc s ASP 148 N -7.22 -0.09 -0.07 3.07 1.47 -1.26 -5.18 116.67 107.38 2rpc s ASP 148 Ca -0.13 -0.84 -0.21 0.00 1.18 0.00 0.00 52.55 52.54 2rpc s ASP 148 Cb 0.06 0.72 0.05 0.00 -0.34 0.00 0.00 42.92 43.41 2rpc s ASP 148 CO 0.86 -1.40 0.50 -0.75 0.68 0.00 0.00 175.17 175.06 2rpc s LYS 149 N -2.85 0.79 -0.66 2.11 2.47 -1.26 -5.11 119.74 115.23 2rpc s LYS 149 Ca 0.15 0.20 0.05 0.00 -1.56 0.00 0.00 55.97 54.81 2rpc s LYS 149 Cb -0.05 0.37 0.17 0.00 -1.46 0.00 0.00 37.83 36.87 2rpc s LYS 149 CO 0.08 -0.21 0.49 0.43 0.16 0.00 0.00 175.35 176.30 2rpc n SER 150 N 1.54 2.56 -3.90 1.43 7.64 -1.26 -5.07 113.62 116.56 2rpc n SER 150 Ca -0.19 -3.11 -0.11 0.00 1.01 0.00 0.00 58.87 56.48 2rpc n SER 150 Cb 0.56 -0.73 -0.10 0.00 -1.01 0.00 0.00 64.21 62.94 2rpc n SER 150 CO 0.00 0.00 0.00 -0.83 -3.01 0.00 0.00 175.04 171.20 2rpc s GLY 151 N -1.30 0.09 0.15 0.23 0.00 -1.26 -5.06 107.32 100.18 2rpc s GLY 151 Ca 0.27 -0.26 -0.10 0.00 0.00 0.00 0.00 44.72 44.63 2rpc s GLY 151 CO -0.17 -0.39 1.49 -0.56 0.00 0.00 0.00 173.10 173.47 2rpc h PRO 152 N 4.27 0.90 -6.04 2.90 0.13 -2.04 -3.43 132.00 128.70 2rpc h PRO 152 Ca -0.31 -0.48 -0.66 0.00 -0.87 0.00 0.00 66.00 63.68 2rpc h PRO 152 Cb 1.20 0.02 -0.01 0.00 0.13 0.00 0.00 31.00 32.33 2rpc h PRO 152 CO 0.42 1.13 1.34 0.43 -0.23 0.00 0.00 178.00 181.09 2rpc n SER 153 N -4.05 2.42 0.06 1.44 7.64 -1.26 -4.80 113.62 115.06 2rpc n SER 153 Ca -0.02 0.51 0.12 0.00 1.01 0.00 0.00 58.87 60.49 2rpc n SER 153 Cb 0.55 -1.29 0.05 0.00 -1.01 0.00 0.00 64.21 62.50 2rpc n SER 153 CO 0.00 0.00 0.00 -1.54 -3.01 0.00 0.00 175.04 170.49 2rpc n SER 154 N 9.27 0.68 0.00 6.43 3.41 -1.26 -5.15 113.62 127.00 2rpc n SER 154 Ca 0.37 0.07 0.00 0.00 -0.26 0.00 0.00 58.87 59.05 2rpc n SER 154 Cb 0.25 0.57 0.00 0.00 -0.26 0.00 0.00 64.21 64.77 2rpc n SER 154 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49