#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2rpc n SER 2 N 0.00 0.74 0.00 1.61 7.64 -1.26 -4.95 113.62 117.40 2rpc n SER 2 Ca 0.00 0.80 0.00 0.00 1.01 0.00 0.00 58.87 60.68 2rpc n SER 2 Cb 0.00 -1.39 0.00 0.00 -1.01 0.00 0.00 64.21 61.81 2rpc n SER 2 CO 0.00 0.00 0.00 -1.20 -3.01 0.00 0.00 175.04 170.83 2rpc n SER 3 N -0.77 4.59 0.00 6.43 7.64 -1.26 -5.08 113.62 125.18 2rpc n SER 3 Ca 0.14 0.00 0.00 0.00 1.01 0.00 0.00 58.87 60.02 2rpc n SER 3 Cb 0.47 0.32 0.00 0.00 -1.01 0.00 0.00 64.21 64.00 2rpc n SER 3 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2rpc n GLY 4 N 3.14 0.62 3.54 0.23 0.00 -1.26 -5.03 105.19 106.43 2rpc n GLY 4 Ca 0.00 -0.73 -0.43 0.00 0.00 0.00 0.00 46.02 44.87 2rpc n GLY 4 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 2rpc n SER 5 N 0.00 2.46 -3.49 1.61 7.64 -1.26 -4.88 113.62 115.70 2rpc n SER 5 Ca 0.00 0.02 -0.11 0.00 1.01 0.00 0.00 58.87 59.78 2rpc n SER 5 Cb 0.00 -1.45 -0.03 0.00 -1.01 0.00 0.00 64.21 61.72 2rpc n SER 5 CO 0.00 0.00 0.00 -0.44 -3.01 0.00 0.00 175.04 171.59 2rpc s SER 6 N 9.41 0.36 0.00 6.43 0.01 -1.26 -5.03 113.70 123.62 2rpc s SER 6 Ca 1.05 -1.21 0.00 0.00 1.31 0.00 0.00 55.95 57.10 2rpc s SER 6 Cb -0.48 0.66 0.00 0.00 0.21 0.00 0.00 66.02 66.42 2rpc s SER 6 CO 0.37 -1.30 0.00 0.61 0.41 0.00 0.00 173.24 173.32 2rpc n GLY 7 N -0.49 2.22 3.53 3.44 0.00 -1.26 -5.00 105.19 107.64 2rpc n GLY 7 Ca -0.02 -0.68 -0.33 0.00 0.00 0.00 0.00 46.02 44.99 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 0.00 2.62 -0.08 1.61 2.00 -1.26 -5.09 119.66 119.46 2rpc s GLN 8 Ca 0.00 -0.63 -0.30 0.00 -2.00 0.00 0.00 55.36 52.44 2rpc s GLN 8 Cb 0.00 -2.48 -0.04 0.00 0.80 0.00 0.00 33.01 31.29 2rpc s GLN 8 CO 0.00 0.64 1.51 -1.25 -0.50 0.00 0.00 175.29 175.70 2rpc s PRO 9 N -0.79 4.20 -0.07 1.67 0.04 -1.26 -5.01 135.00 133.78 2rpc s PRO 9 Ca 0.12 2.01 0.06 0.00 0.04 0.00 0.00 61.00 63.23 2rpc s PRO 9 Cb -0.11 -3.88 -0.01 0.00 0.04 0.00 0.00 34.50 30.54 2rpc s PRO 9 CO 0.01 -0.78 -0.24 0.42 0.04 0.00 0.00 177.00 176.45 2rpc s ILE 10 N 3.73 2.09 -0.29 0.56 1.01 -1.26 -5.11 121.20 121.94 2rpc s ILE 10 Ca 0.67 -1.05 0.01 0.00 0.00 0.00 0.00 60.65 60.28 2rpc s ILE 10 Cb -0.30 -1.76 0.06 0.00 0.01 0.00 0.00 42.46 40.47 2rpc s ILE 10 CO 0.25 0.57 -0.04 -0.54 0.00 0.00 0.00 174.94 175.17 2rpc s LYS 11 N -0.08 2.24 -0.06 2.79 3.01 -1.26 -4.87 119.74 121.51 2rpc s LYS 11 Ca -0.06 -1.38 0.03 0.00 -1.01 0.00 0.00 55.97 53.55 2rpc s LYS 11 Cb -0.14 -3.05 -0.03 0.00 -1.01 0.00 0.00 37.83 33.60 2rpc s LYS 11 CO 0.05 -0.64 -0.12 -1.14 0.51 0.00 0.00 175.35 174.01 2rpc s GLN 12 N 1.14 2.60 -0.22 1.68 0.74 -0.62 -5.06 119.66 119.92 2rpc s GLN 12 Ca -0.05 -0.65 -0.20 0.00 0.05 0.00 0.00 55.36 54.51 2rpc s GLN 12 Cb -0.20 -2.45 -0.03 0.00 1.10 0.00 0.00 33.01 31.44 2rpc s GLN 12 CO -0.04 0.63 0.58 -1.21 -0.55 0.00 0.00 175.29 174.70 2rpc s GLU 13 N -0.73 4.17 0.38 1.67 2.02 -1.25 -3.53 118.70 121.43 2rpc s GLU 13 Ca 0.11 0.50 0.07 0.00 0.02 0.00 0.00 54.97 55.68 2rpc s GLU 13 Cb -0.11 -3.60 -0.01 0.00 0.10 0.00 0.00 34.13 30.52 2rpc s GLU 13 CO 0.01 -0.26 0.46 -0.51 0.02 0.00 0.00 175.26 174.98 2rpc s LEU 14 N 1.99 3.69 -0.02 1.80 1.43 -0.89 -4.90 118.68 121.77 2rpc s LEU 14 Ca 0.26 -0.43 -0.00 0.00 -1.03 0.00 0.00 54.13 52.92 2rpc s LEU 14 Cb -0.16 -2.50 0.03 0.00 0.03 0.00 0.00 46.19 43.59 2rpc s LEU 14 CO 0.10 -0.58 0.04 -0.44 0.23 0.00 0.00 176.35 175.69 2rpc s SER 15 N -4.20 0.03 -0.53 2.29 0.01 -1.26 -3.88 113.70 106.16 2rpc s SER 15 Ca 0.49 0.07 0.04 0.00 1.31 0.00 0.00 55.95 57.85 2rpc s SER 15 Cb -0.08 -0.02 0.14 0.00 0.21 0.00 0.00 66.02 66.27 2rpc s SER 15 CO 0.30 -0.11 0.30 0.00 0.41 0.00 0.00 173.24 174.14 2rpc s LYS 17 N -0.35 3.22 -0.22 0.00 -0.14 -1.26 -4.00 119.74 116.99 2rpc s LYS 17 Ca 0.19 -0.43 -0.06 0.00 -1.36 0.00 0.00 55.97 54.30 2rpc s LYS 17 Cb -0.21 -4.31 -0.03 0.00 -1.68 0.00 0.00 37.83 31.60 2rpc s LYS 17 CO -0.03 -2.10 0.04 -0.46 -0.76 0.00 0.00 175.35 172.03 2rpc s TRP 18 N 5.38 3.08 -0.35 3.18 -0.11 -1.26 -3.26 118.94 125.61 2rpc s TRP 18 Ca 0.34 -0.40 0.03 0.00 1.22 0.00 0.00 56.10 57.29 2rpc s TRP 18 Cb -0.08 -2.15 0.10 0.00 -1.50 0.00 0.00 33.47 29.83 2rpc s TRP 18 CO 0.12 -0.26 0.08 0.42 -4.62 0.00 0.00 176.95 172.68 2rpc s ILE 19 N 1.23 1.98 -0.59 5.86 1.01 0.39 -2.18 121.20 128.91 2rpc s ILE 19 Ca 0.04 -2.21 -0.27 0.00 0.00 0.00 0.00 60.65 58.21 2rpc s ILE 19 Cb -0.15 -2.47 0.00 0.00 0.01 0.00 0.00 42.46 39.86 2rpc s ILE 19 CO 0.02 -0.63 1.54 -0.62 0.00 0.00 0.00 174.94 175.25 2rpc s ASP 20 N 0.97 5.89 0.22 3.58 2.15 -1.26 -4.47 116.67 123.75 2rpc s ASP 20 Ca 0.11 0.25 -0.10 0.00 0.43 0.00 0.00 52.55 53.24 2rpc s ASP 20 Cb -0.19 -2.54 0.31 0.00 -0.30 0.00 0.00 42.92 40.20 2rpc s ASP 20 CO -0.11 -1.91 1.33 -1.84 -0.17 0.00 0.00 175.17 172.47 2rpc n GLU 21 N 8.90 -0.13 -1.17 4.34 0.28 -1.26 0.17 120.64 131.76 2rpc n GLU 21 Ca 0.14 1.32 -0.23 0.00 -0.16 0.00 0.00 57.16 58.23 2rpc n GLU 21 Cb 0.50 -1.97 0.02 0.00 1.43 0.00 0.00 31.44 31.41 2rpc n GLU 21 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 177.13 176.97 2rpc n ALA 22 N -3.63 5.74 -1.76 -1.84 0.00 -1.26 -4.96 120.51 112.80 2rpc n ALA 22 Ca 0.12 -2.43 -0.39 0.00 0.00 0.00 0.00 53.44 50.74 2rpc n ALA 22 Cb 0.39 -1.68 -0.06 0.00 0.00 0.00 0.00 19.45 18.11 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 -2.19 4.69 -0.03 0.00 -2.07 0.44 -4.93 119.66 115.56 2rpc s GLN 23 Ca 0.45 1.48 0.04 0.00 -1.82 0.00 0.00 55.36 55.51 2rpc s GLN 23 Cb 0.33 -3.05 0.17 0.00 -1.09 0.00 0.00 33.01 29.38 2rpc s GLN 23 CO -0.08 0.35 0.91 1.28 -1.32 0.00 0.00 175.29 176.43 2rpc n LEU 24 N 1.02 1.65 -4.58 2.60 7.99 -1.26 -4.82 117.00 119.59 2rpc n LEU 24 Ca -0.00 -0.83 -0.32 0.00 -0.01 0.00 0.00 56.01 54.85 2rpc n LEU 24 Cb 0.48 -0.38 -0.11 0.00 -0.11 0.00 0.00 43.42 43.30 2rpc n LEU 24 CO 0.48 0.30 -0.40 -0.94 -1.51 0.00 0.00 177.39 175.32 2rpc s SER 25 N -0.49 4.51 -0.18 -1.43 1.04 -1.26 -5.12 113.70 110.76 2rpc s SER 25 Ca 0.12 -0.20 -0.13 0.00 0.48 0.00 0.00 55.95 56.22 2rpc s SER 25 Cb 0.08 -1.00 0.05 0.00 0.10 0.00 0.00 66.02 65.25 2rpc s SER 25 CO 0.05 0.27 0.47 -0.13 0.98 0.00 0.00 173.24 174.88 2rpc s ARG 26 N -1.48 0.50 0.60 4.02 1.81 -1.26 -3.73 118.95 119.41 2rpc s ARG 26 Ca 0.17 0.77 -0.17 0.00 -1.72 0.00 0.00 55.73 54.78 2rpc s ARG 26 Cb -0.11 0.13 -0.03 0.00 -0.45 0.00 0.00 34.95 34.49 2rpc s ARG 26 CO 0.08 -0.11 1.12 -1.25 -0.68 0.00 0.00 175.30 174.46 2rpc s PRO 27 N 0.86 3.08 -0.11 3.54 0.04 -1.26 -5.05 135.00 136.10 2rpc s PRO 27 Ca -0.05 1.50 -0.40 0.00 0.04 0.00 0.00 61.00 62.10 2rpc s PRO 27 Cb -0.06 -1.98 -0.17 0.00 0.04 0.00 0.00 34.50 32.33 2rpc s PRO 27 CO -0.07 -1.05 1.45 1.63 0.04 0.00 0.00 177.00 179.00 2rpc n LYS 28 N -1.86 0.82 -4.02 4.56 5.02 -1.24 -4.96 118.16 116.48 2rpc n LYS 28 Ca 0.11 0.30 -0.26 0.00 -2.02 0.00 0.00 58.31 56.44 2rpc n LYS 28 Cb 0.51 -1.91 -0.03 0.00 -0.02 0.00 0.00 35.03 33.58 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 1.65 2.27 -0.15 1.97 0.00 -1.26 -5.13 119.74 119.09 2rpc s LYS 29 Ca 0.92 -1.97 0.01 0.00 0.00 0.00 0.00 55.97 54.93 2rpc s LYS 29 Cb -1.11 -2.03 0.00 0.00 0.00 0.00 0.00 37.83 34.70 2rpc s LYS 29 CO 0.59 -0.41 -0.18 -1.54 0.00 0.00 0.00 175.35 173.80 2rpc s SER 30 N -4.12 3.42 -0.75 0.03 1.04 -1.26 -4.44 113.70 107.62 2rpc s SER 30 Ca 0.34 -0.53 -0.23 0.00 0.48 0.00 0.00 55.95 56.01 2rpc s SER 30 Cb -0.00 -1.51 -0.17 0.00 0.10 0.00 0.00 66.02 64.43 2rpc s SER 30 CO 0.20 0.08 2.01 0.00 0.98 0.00 0.00 173.24 176.51 2rpc s ASP 32 N 6.46 6.63 -0.03 0.00 -4.77 -1.26 -4.29 116.67 119.41 2rpc s ASP 32 Ca 1.02 0.76 -0.31 0.00 -3.30 0.00 0.00 52.55 50.72 2rpc s ASP 32 Cb -0.93 -2.55 0.12 0.00 -1.09 0.00 0.00 42.92 38.47 2rpc s ASP 32 CO 0.37 -1.20 1.26 -0.60 0.70 0.00 0.00 175.17 175.70 2rpc s ARG 33 N 4.38 0.42 0.32 2.11 3.52 -1.26 -5.08 118.95 123.35 2rpc s ARG 33 Ca 0.52 -0.23 -0.15 0.00 -0.13 0.00 0.00 55.73 55.74 2rpc s ARG 33 Cb -0.11 0.15 0.02 0.00 -1.56 0.00 0.00 34.95 33.45 2rpc s ARG 33 CO 0.28 -0.19 0.65 -0.08 -0.81 0.00 0.00 175.30 175.15 2rpc s THR 34 N -2.46 0.00 0.21 4.11 -1.32 -1.26 -4.01 115.64 110.90 2rpc s THR 34 Ca 0.14 -1.17 -0.13 0.00 -1.21 0.00 0.00 61.69 59.31 2rpc s THR 34 Cb 0.04 -2.42 0.00 0.00 -1.51 0.00 0.00 72.50 68.62 2rpc s THR 34 CO -0.04 0.00 0.45 -0.36 -2.21 0.00 0.00 174.62 172.46 2rpc s PHE 35 N -3.30 0.21 -0.15 9.09 0.40 -1.25 -4.89 117.98 118.09 2rpc s PHE 35 Ca 0.18 -0.57 -0.16 0.00 -0.60 0.00 0.00 56.93 55.77 2rpc s PHE 35 Cb -0.04 0.20 -0.24 0.00 0.51 0.00 0.00 43.02 43.46 2rpc s PHE 35 CO 0.11 -0.91 0.37 0.77 0.70 0.00 0.00 175.22 176.26 2rpc h SER 36 N 2.30 0.22 -2.58 1.36 0.02 -1.96 -2.37 113.55 110.54 2rpc h SER 36 Ca -0.28 -0.74 -0.59 0.00 -0.84 0.00 0.00 61.79 59.33 2rpc h SER 36 Cb 1.25 -0.07 -0.12 0.00 0.14 0.00 0.00 62.40 63.60 2rpc h SER 36 CO 0.39 1.61 -0.69 0.42 -1.14 0.00 0.00 176.83 177.42 2rpc s THR 37 N -2.44 3.27 0.09 -2.27 -4.23 -1.26 -1.60 115.64 107.20 2rpc s THR 37 Ca -0.24 -1.82 -0.29 0.00 -1.18 0.00 0.00 61.69 58.15 2rpc s THR 37 Cb 0.05 -2.68 -0.14 0.00 1.34 0.00 0.00 72.50 71.07 2rpc s THR 37 CO 0.69 -0.25 1.65 -0.03 -0.54 0.00 0.00 174.62 176.14 2rpc h MET 38 N 2.40 -0.57 -0.96 3.99 4.05 -1.92 -2.52 114.93 119.39 2rpc h MET 38 Ca -0.45 0.04 0.30 0.00 -0.28 0.00 0.00 59.70 59.31 2rpc h MET 38 Cb 1.23 0.13 -0.17 0.00 -0.80 0.00 0.00 31.60 31.99 2rpc h MET 38 CO 0.58 -0.38 0.25 1.25 0.23 0.00 0.00 176.91 178.84 2rpc h HIS 39 N -0.59 0.36 -0.63 1.39 -0.00 -1.99 0.73 115.15 114.42 2rpc h HIS 39 Ca -0.03 0.06 0.06 0.00 -0.00 0.00 0.00 60.37 60.46 2rpc h HIS 39 Cb 0.51 0.00 -0.06 0.00 -0.00 0.00 0.00 27.41 27.87 2rpc h HIS 39 CO -0.13 -0.36 0.33 0.93 -0.00 0.00 0.00 177.93 178.70 2rpc h GLU 40 N 0.09 0.60 -0.05 5.26 4.39 -1.87 -0.70 114.58 122.29 2rpc h GLU 40 Ca 0.66 -0.04 -0.02 0.00 0.34 0.00 0.00 59.36 60.30 2rpc h GLU 40 Cb 1.49 -0.13 -0.00 0.00 -0.10 0.00 0.00 28.75 30.00 2rpc h GLU 40 CO -0.79 0.39 -0.04 1.25 -1.16 0.00 0.00 179.01 178.67 2rpc h LEU 41 N 0.61 0.13 -0.34 1.33 5.85 0.45 -3.06 115.31 120.28 2rpc h LEU 41 Ca 0.29 -0.46 0.07 0.00 0.84 0.00 0.00 57.88 58.63 2rpc h LEU 41 Cb 0.21 -0.04 -0.08 0.00 0.37 0.00 0.00 40.66 41.13 2rpc h LEU 41 CO -0.19 0.56 -0.17 0.58 -0.34 0.00 0.00 178.44 178.87 2rpc h VAL 42 N -0.30 0.48 -0.21 1.05 2.07 -0.70 0.25 116.25 118.90 2rpc h VAL 42 Ca 0.01 0.00 0.06 0.00 0.82 0.00 0.00 66.70 67.59 2rpc h VAL 42 Cb 0.52 0.48 -0.01 0.00 -1.52 0.00 0.00 31.29 30.76 2rpc h VAL 42 CO 0.01 0.00 0.22 0.74 0.02 0.00 0.00 177.57 178.56 2rpc h THR 43 N -0.12 0.48 0.00 2.57 2.02 -1.17 0.75 112.91 117.44 2rpc h THR 43 Ca 0.17 0.00 0.00 0.00 0.77 0.00 0.00 66.41 67.35 2rpc h THR 43 Cb 0.38 0.82 0.00 0.00 -1.74 0.00 0.00 68.15 67.62 2rpc h THR 43 CO -0.42 0.00 -0.11 -0.74 0.37 0.00 0.00 175.52 174.62 2rpc h HIS 44 N 0.00 0.00 -0.10 3.16 -0.00 -0.55 -0.44 115.15 117.23 2rpc h HIS 44 Ca 0.10 0.00 0.03 0.00 -0.00 0.00 0.00 60.37 60.50 2rpc h HIS 44 Cb 0.54 0.00 -0.00 0.00 -0.00 0.00 0.00 27.41 27.95 2rpc h HIS 44 CO 0.00 0.00 0.30 0.28 -0.00 0.00 0.00 177.93 178.51 2rpc h VAL 45 N -0.73 0.13 0.00 5.26 2.07 -0.64 2.21 116.25 124.55 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 0.11 0.72 -0.02 0.00 -1.52 0.00 0.00 31.29 30.58 2rpc h VAL 45 CO 0.00 0.00 -1.04 0.41 0.02 0.00 0.00 177.57 176.96 2rpc n THR 46 N -3.17 1.48 -0.10 2.57 -1.04 0.24 -1.80 114.28 112.46 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 0.38 -2.24 -0.12 0.00 -1.82 0.00 0.00 70.33 66.54 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 -0.72 2.00 114.93 115.25 2rpc h MET 47 Ca -0.17 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.47 2rpc h MET 47 Cb 0.94 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.60 2rpc h MET 47 CO -0.10 1.00 0.00 0.39 1.06 0.00 0.00 176.91 179.25 2rpc n GLU 48 N -4.47 0.53 0.00 1.72 -0.58 0.71 -2.30 120.64 116.26 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 0.64 -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 0.86 -0.32 8.25 0.92 -4.81 115.22 119.10 2rpc n HIS 49 Ca 0.08 0.00 0.08 0.00 -0.26 0.00 0.00 57.72 57.62 2rpc n HIS 49 Cb 0.04 0.31 0.43 0.00 1.12 0.00 0.00 29.99 31.89 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 -1.94 0.29 -1.39 1.59 0.31 0.32 -4.95 118.33 112.56 2rpc n VAL 50 Ca 0.00 0.07 0.03 0.00 -0.01 0.00 0.00 64.34 64.44 2rpc n VAL 50 Cb 0.00 -0.82 -0.01 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 0.00 -0.54 0.00 2.92 0.00 0.65 -4.83 105.19 103.39 2rpc n GLY 51 Ca 0.10 -0.42 0.00 0.00 0.00 0.00 0.00 46.02 45.69 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 -0.88 -0.68 0.00 -0.02 0.00 -1.26 -4.41 105.19 97.95 2rpc n GLY 52 Ca 0.00 -1.72 0.07 0.00 0.00 0.00 0.00 46.02 44.37 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 -0.85 0.25 0.16 1.61 -0.04 -1.26 -2.33 135.00 132.55 2rpc n PRO 53 Ca 0.00 0.12 0.06 0.00 -0.04 0.00 0.00 63.50 63.64 2rpc n PRO 53 Cb 0.00 -1.50 0.07 0.00 -0.04 0.00 0.00 33.50 32.03 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 -6.54 0.54 4.39 -1.95 -3.45 114.58 107.57 2rpc h GLU 54 Ca 0.00 0.00 -0.54 0.00 0.34 0.00 0.00 59.36 59.16 2rpc h GLU 54 Cb 0.12 0.00 0.05 0.00 -0.10 0.00 0.00 28.75 28.81 2rpc h GLU 54 CO 0.00 0.30 1.05 1.04 -1.16 0.00 0.00 179.01 180.24 2rpc n GLN 55 N -3.15 2.69 0.00 2.33 6.02 -0.98 -4.92 117.38 119.36 2rpc n GLN 55 Ca 0.02 0.98 0.00 0.00 -0.01 0.00 0.00 57.00 57.99 2rpc n GLN 55 Cb 0.66 -2.84 0.00 0.00 1.02 0.00 0.00 30.24 29.08 2rpc n GLN 55 CO 0.00 0.00 0.00 -1.71 -1.01 0.00 0.00 177.06 174.34 2rpc n ASN 56 N 5.01 0.00 -4.42 1.08 5.15 -1.26 -4.54 115.26 116.27 2rpc n ASN 56 Ca 0.18 0.77 -0.33 0.00 -0.60 0.00 0.00 54.58 54.59 2rpc n ASN 56 Cb 0.35 -0.27 -0.14 0.00 -0.53 0.00 0.00 39.78 39.20 2rpc n ASN 56 CO 0.00 0.00 0.00 0.54 1.40 0.00 0.00 177.26 179.20 2rpc s ASN 57 N -2.69 4.26 -0.47 1.20 4.22 -1.26 -5.08 114.94 115.10 2rpc s ASN 57 Ca 0.00 -0.25 -0.18 0.00 -2.14 0.00 0.00 52.86 50.28 2rpc s ASN 57 Cb 0.00 -1.61 0.05 0.00 1.28 0.00 0.00 41.25 40.97 2rpc s ASN 57 CO 0.00 0.18 0.53 -1.00 -2.04 0.00 0.00 177.10 174.78 2rpc s HIS 58 N 0.27 3.12 -0.01 1.54 3.76 -1.26 -5.03 115.29 117.67 2rpc s HIS 58 Ca -0.07 -0.55 0.00 0.00 -0.15 0.00 0.00 55.06 54.29 2rpc s HIS 58 Cb -0.15 -3.30 0.01 0.00 1.11 0.00 0.00 32.58 30.25 2rpc s HIS 58 CO 0.05 -0.90 0.00 0.08 -0.85 0.00 0.00 174.74 173.12 2rpc s VAL 59 N 2.32 0.06 -0.30 -0.90 1.01 -1.26 -3.69 120.40 117.64 2rpc s VAL 59 Ca 0.13 0.04 -0.05 0.00 0.00 0.00 0.00 61.98 62.09 2rpc s VAL 59 Cb -0.19 -0.10 0.03 0.00 0.00 0.00 0.00 36.38 36.11 2rpc s VAL 59 CO 0.12 0.05 0.05 0.00 0.00 0.00 0.00 175.10 175.32 2rpc s TYR 61 N 1.40 3.35 0.15 0.00 1.51 -1.26 -3.59 117.35 118.92 2rpc s TYR 61 Ca -0.00 -1.44 -0.14 0.00 -1.01 0.00 0.00 57.07 54.48 2rpc s TYR 61 Cb -0.18 -3.83 -0.07 0.00 -0.11 0.00 0.00 41.96 37.77 2rpc s TYR 61 CO 0.01 -1.05 0.55 -0.46 -1.11 0.00 0.00 175.55 173.49 2rpc s TRP 62 N 1.36 3.59 0.63 2.71 -0.11 -1.26 -0.46 118.94 125.40 2rpc s TRP 62 Ca 0.08 1.05 0.17 0.00 1.22 0.00 0.00 56.10 58.61 2rpc s TRP 62 Cb -0.24 -2.36 0.67 0.00 -1.50 0.00 0.00 33.47 30.04 2rpc s TRP 62 CO 0.00 0.41 1.29 1.49 -4.62 0.00 0.00 176.95 175.53 2rpc h GLU 63 N 3.46 0.00 -0.00 5.86 4.81 -1.84 -1.70 114.58 125.17 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 -0.14 0.00 0.63 0.00 0.00 28.75 30.43 2rpc h GLU 63 CO 0.66 0.00 -0.30 0.39 -0.73 0.00 0.00 179.01 179.03 2rpc n GLU 64 N -2.96 0.50 -1.51 1.92 -0.58 -1.26 -5.03 120.64 111.71 2rpc n GLU 64 Ca 0.10 -1.11 -0.52 0.00 -0.42 0.00 0.00 57.16 55.22 2rpc n GLU 64 Cb 1.14 0.45 -0.05 0.00 -0.57 0.00 0.00 31.44 32.41 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 2.66 0.00 0.00 0.00 0.13 -1.97 -2.90 132.00 129.92 2rpc h PRO 66 Ca -0.42 0.00 -0.07 0.00 -0.87 0.00 0.00 66.00 64.65 2rpc h PRO 66 Cb 1.39 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.51 2rpc h PRO 66 CO 0.65 0.30 -1.09 0.00 -0.23 0.00 0.00 178.00 177.64 2rpc h ARG 67 N 0.00 0.00 -1.61 0.86 2.47 -1.96 -3.48 114.38 110.66 2rpc h ARG 67 Ca -0.00 0.00 -0.13 0.00 -1.26 0.00 0.00 59.98 58.59 2rpc h ARG 67 Cb 0.72 0.00 0.02 0.00 -1.65 0.00 0.00 29.97 29.06 2rpc h ARG 67 CO 0.04 0.13 -0.19 0.39 0.56 0.00 0.00 179.97 180.90 2rpc n GLU 68 N -2.80 -1.37 -2.82 0.04 1.02 -1.10 -3.83 120.64 109.79 2rpc n GLU 68 Ca -0.03 0.29 -0.11 0.00 -0.02 0.00 0.00 57.16 57.29 2rpc n GLU 68 Cb 0.66 -3.90 0.05 0.00 -0.02 0.00 0.00 31.44 28.24 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 -0.99 -0.32 3.47 0.62 0.00 -1.24 -4.94 105.19 101.80 2rpc n GLY 69 Ca -0.04 0.13 -0.43 0.00 0.00 0.00 0.00 46.02 45.67 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 -4.40 3.62 0.42 1.61 -0.14 -1.25 -4.78 119.74 114.82 2rpc s LYS 70 Ca 0.17 -1.68 -0.13 0.00 -1.36 0.00 0.00 55.97 52.96 2rpc s LYS 70 Cb -0.02 -5.00 -0.11 0.00 -1.68 0.00 0.00 37.83 31.01 2rpc s LYS 70 CO 0.50 -1.85 -0.16 0.43 -0.76 0.00 0.00 175.35 173.51 2rpc n SER 71 N 6.94 -2.98 -4.42 2.83 7.64 -1.26 -4.97 113.62 117.40 2rpc n SER 71 Ca 0.26 0.45 -0.22 0.00 1.01 0.00 0.00 58.87 60.37 2rpc n SER 71 Cb 0.49 -0.63 -0.10 0.00 -1.01 0.00 0.00 64.21 62.96 2rpc n SER 71 CO 0.00 0.00 0.00 -0.36 -3.01 0.00 0.00 175.04 171.67 2rpc s PHE 72 N -1.50 2.02 -0.65 1.43 0.40 -1.24 -5.04 117.98 113.39 2rpc s PHE 72 Ca 0.41 -0.47 -0.02 0.00 -0.60 0.00 0.00 56.93 56.25 2rpc s PHE 72 Cb -0.34 -0.94 0.43 0.00 0.51 0.00 0.00 43.02 42.67 2rpc s PHE 72 CO 0.51 0.52 2.04 1.17 0.70 0.00 0.00 175.22 180.17 2rpc n LYS 73 N -0.53 2.63 -3.64 0.44 0.00 -1.26 -4.81 118.16 110.99 2rpc n LYS 73 Ca -0.06 -3.17 -0.04 0.00 0.00 0.00 0.00 58.31 55.03 2rpc n LYS 73 Cb 0.61 -2.24 -0.07 0.00 0.00 0.00 0.00 35.03 33.33 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 -3.69 -2.23 0.32 3.14 0.00 -1.26 -4.98 121.76 113.05 2rpc s ALA 74 Ca 0.62 1.88 0.00 0.00 0.00 0.00 0.00 51.96 54.46 2rpc s ALA 74 Cb 0.49 -1.70 0.52 0.00 0.00 0.00 0.00 23.12 22.42 2rpc s ALA 74 CO -0.03 -0.22 1.94 0.87 0.00 0.00 0.00 175.76 178.32 2rpc h LYS 75 N 4.29 0.88 -0.00 0.00 1.79 -2.00 -0.96 116.57 120.56 2rpc h LYS 75 Ca -0.27 -0.09 0.00 0.00 -2.18 0.00 0.00 60.65 58.10 2rpc h LYS 75 Cb 1.18 -0.18 0.00 0.00 -1.58 0.00 0.00 32.23 31.66 2rpc h LYS 75 CO 0.17 0.65 -0.18 2.48 -1.08 0.00 0.00 179.45 181.49 2rpc n TYR 76 N -4.38 0.00 0.12 -1.35 4.11 -1.26 -3.18 117.16 111.23 2rpc n TYR 76 Ca 0.06 0.00 -0.24 0.00 -0.00 0.00 0.00 57.90 57.72 2rpc n TYR 76 Cb 0.10 -0.25 -0.16 0.00 -0.00 0.00 0.00 39.34 39.04 2rpc n TYR 76 CO 0.00 0.00 0.00 0.87 -0.00 0.00 0.00 176.86 177.73 2rpc h LYS 77 N 0.41 0.48 0.13 -3.48 1.79 -1.56 -3.03 116.57 111.31 2rpc h LYS 77 Ca 0.00 -0.83 -0.28 0.00 -2.18 0.00 0.00 60.65 57.36 2rpc h LYS 77 Cb 0.42 0.31 0.02 0.00 -1.58 0.00 0.00 32.23 31.40 2rpc h LYS 77 CO 0.00 1.40 -1.24 1.25 -1.08 0.00 0.00 179.45 179.77 2rpc h LEU 78 N 0.02 0.62 0.65 2.94 5.85 -1.59 -3.31 115.31 120.49 2rpc h LEU 78 Ca -0.23 -0.62 -0.03 0.00 0.84 0.00 0.00 57.88 57.84 2rpc h LEU 78 Cb 2.04 -0.20 0.01 0.00 0.37 0.00 0.00 40.66 42.88 2rpc h LEU 78 CO 0.24 1.46 -0.31 0.58 -0.34 0.00 0.00 178.44 180.07 2rpc h VAL 79 N 0.16 0.36 -1.02 1.05 2.07 -1.68 -2.19 116.25 115.00 2rpc h VAL 79 Ca -0.16 -0.01 0.30 0.00 0.82 0.00 0.00 66.70 67.64 2rpc h VAL 79 Cb 1.93 0.37 -0.04 0.00 -1.52 0.00 0.00 31.29 32.03 2rpc h VAL 79 CO 0.22 0.00 0.84 -0.55 0.02 0.00 0.00 177.57 178.10 2rpc h ASN 80 N -0.88 0.00 -0.22 0.57 7.08 -1.66 0.52 115.58 120.99 2rpc h ASN 80 Ca -0.09 0.00 -0.18 0.00 -3.08 0.00 0.00 56.30 52.95 2rpc h ASN 80 Cb 0.67 0.00 0.00 0.00 -2.08 0.00 0.00 38.32 36.92 2rpc h ASN 80 CO 0.15 0.00 -0.57 -0.74 -2.08 0.00 0.00 177.43 174.18 2rpc h HIS 81 N 0.00 0.99 -0.06 4.14 2.76 -1.49 -3.01 115.15 118.48 2rpc h HIS 81 Ca 0.48 -0.39 0.02 0.00 -2.20 0.00 0.00 60.37 58.29 2rpc h HIS 81 Cb 2.16 -0.17 -0.00 0.00 1.55 0.00 0.00 27.41 30.94 2rpc h HIS 81 CO 0.00 1.20 0.10 0.82 -1.30 0.00 0.00 177.93 178.75 2rpc h ILE 82 N 0.50 0.33 -0.98 6.26 2.04 0.31 -2.28 117.51 123.69 2rpc h ILE 82 Ca -0.01 0.00 0.25 0.00 1.00 0.00 0.00 64.86 66.10 2rpc h ILE 82 Cb 1.19 0.91 -0.13 0.00 -0.74 0.00 0.00 36.82 38.06 2rpc h ILE 82 CO 0.12 0.00 0.54 0.03 0.00 0.00 0.00 178.15 178.85 2rpc h ARG 83 N 0.00 0.48 0.00 2.37 -0.00 -1.38 0.99 114.38 116.84 2rpc h ARG 83 Ca 0.03 -0.03 -0.04 0.00 -0.50 0.00 0.00 59.98 59.44 2rpc h ARG 83 Cb 0.23 -0.11 -0.01 0.00 0.00 0.00 0.00 29.97 30.09 2rpc h ARG 83 CO -0.00 0.32 -0.18 -0.39 0.00 0.00 0.00 179.97 179.72 2rpc h VAL 84 N 0.50 0.55 0.00 2.04 -1.51 -1.62 -1.87 116.25 114.35 2rpc h VAL 84 Ca 0.64 -0.84 0.00 0.00 -1.23 0.00 0.00 66.70 65.27 2rpc h VAL 84 Cb 1.26 1.56 0.00 0.00 -2.13 0.00 0.00 31.29 31.99 2rpc h VAL 84 CO -0.51 0.17 0.00 1.41 -1.23 0.00 0.00 177.57 177.41 2rpc n HIS 85 N -3.50 0.00 -0.03 5.19 8.25 0.34 -3.60 115.22 121.88 2rpc n HIS 85 Ca -0.01 0.00 -0.06 0.00 -0.26 0.00 0.00 57.72 57.40 2rpc n HIS 85 Cb 0.34 -0.05 -0.03 0.00 1.12 0.00 0.00 29.99 31.37 2rpc n HIS 85 CO 0.00 0.00 0.00 0.25 0.64 0.00 0.00 176.34 177.23 2rpc n THR 86 N -1.05 0.35 0.00 1.59 -2.24 -0.76 -4.94 114.28 107.23 2rpc n THR 86 Ca 0.18 -0.11 0.00 0.00 -2.27 0.00 0.00 64.05 61.85 2rpc n THR 86 Cb 0.11 -1.13 0.00 0.00 -2.10 0.00 0.00 70.33 67.21 2rpc n THR 86 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2rpc n GLY 87 N 2.92 1.98 3.81 3.38 0.00 -0.89 -5.04 105.19 111.35 2rpc n GLY 87 Ca -0.12 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.54 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 -0.06 3.85 0.07 1.61 2.12 -1.17 -5.07 118.70 120.05 2rpc s GLU 88 Ca 0.00 -0.06 0.09 0.00 0.36 0.00 0.00 54.97 55.37 2rpc s GLU 88 Cb 0.00 -3.30 -0.03 0.00 0.26 0.00 0.00 34.13 31.06 2rpc s GLU 88 CO 0.00 0.54 -0.25 0.15 -0.54 0.00 0.00 175.26 175.16 2rpc s LYS 89 N -0.38 1.75 -0.02 4.30 -0.14 -1.26 -4.64 119.74 119.34 2rpc s LYS 89 Ca 0.14 -1.15 -0.25 0.00 -1.36 0.00 0.00 55.97 53.35 2rpc s LYS 89 Cb -0.12 -2.00 -0.20 0.00 -1.68 0.00 0.00 37.83 33.83 2rpc s LYS 89 CO 0.03 0.50 1.23 -1.00 -0.76 0.00 0.00 175.35 175.36 2rpc h PRO 90 N 4.48 -0.05 -2.36 -1.68 0.13 -1.81 -3.39 132.00 127.31 2rpc h PRO 90 Ca -0.48 0.00 -0.08 0.00 -0.87 0.00 0.00 66.00 64.57 2rpc h PRO 90 Cb 1.15 0.01 -0.21 0.00 0.13 0.00 0.00 31.00 32.08 2rpc h PRO 90 CO 0.43 0.41 -0.02 -0.59 -0.23 0.00 0.00 178.00 178.00 2rpc s PHE 91 N -4.23 -0.58 0.00 1.56 -0.12 -1.26 -0.17 117.98 113.17 2rpc s PHE 91 Ca -0.15 1.29 0.00 0.00 -0.05 0.00 0.00 56.93 58.01 2rpc s PHE 91 Cb 0.02 0.24 0.00 0.00 -0.63 0.00 0.00 43.02 42.65 2rpc s PHE 91 CO 0.65 -0.38 0.00 -0.35 -0.05 0.00 0.00 175.22 175.09 2rpc n PRO 92 N 2.18 -0.02 -3.49 1.99 -0.04 -1.26 -4.25 135.00 130.11 2rpc n PRO 92 Ca -0.16 0.00 -0.38 0.00 -0.04 0.00 0.00 63.50 62.93 2rpc n PRO 92 Cb 0.56 0.00 -0.06 0.00 -0.04 0.00 0.00 33.50 33.96 2rpc n PRO 92 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2rpc n PRO 94 N 2.58 0.49 -3.60 0.00 -0.04 -1.26 -4.70 135.00 128.46 2rpc n PRO 94 Ca -0.12 0.00 -0.36 0.00 -0.04 0.00 0.00 63.50 62.97 2rpc n PRO 94 Cb 0.52 -1.34 -0.07 0.00 -0.04 0.00 0.00 33.50 32.57 2rpc n PRO 94 CO 0.00 0.00 0.00 0.12 -0.04 0.00 0.00 175.50 175.58 2rpc s PHE 95 N -2.00 3.50 -0.02 0.54 2.19 -1.26 -5.01 117.98 115.92 2rpc s PHE 95 Ca 0.16 0.59 -0.23 0.00 0.33 0.00 0.00 56.93 57.78 2rpc s PHE 95 Cb 0.07 -2.26 -0.17 0.00 -1.31 0.00 0.00 43.02 39.36 2rpc s PHE 95 CO 0.12 0.36 1.09 -1.00 1.83 0.00 0.00 175.22 177.62 2rpc h PRO 96 N 6.23 -0.27 -1.83 10.12 0.13 -1.97 -3.24 132.00 141.18 2rpc h PRO 96 Ca -0.44 0.02 -0.19 0.00 -0.87 0.00 0.00 66.00 64.52 2rpc h PRO 96 Cb 1.18 0.06 -0.07 0.00 0.13 0.00 0.00 31.00 32.29 2rpc h PRO 96 CO 0.72 0.12 0.13 0.41 -0.23 0.00 0.00 178.00 179.15 2rpc n GLY 97 N 0.14 3.31 1.71 1.56 0.00 -1.26 -3.93 105.19 106.72 2rpc n GLY 97 Ca -0.09 -0.73 0.00 0.00 0.00 0.00 0.00 46.02 45.21 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 2.02 0.44 3.88 0.00 0.00 -1.23 -4.96 105.19 105.34 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 -4.47 3.73 0.00 1.61 2.47 -1.26 -4.90 119.74 116.92 2rpc s LYS 100 Ca 0.00 0.15 0.00 0.00 -1.56 0.00 0.00 55.97 54.56 2rpc s LYS 100 Cb 0.00 -2.69 -0.00 0.00 -1.46 0.00 0.00 37.83 33.68 2rpc s LYS 100 CO 0.00 0.33 -0.01 0.42 0.16 0.00 0.00 175.35 176.25 2rpc s ILE 101 N -1.83 0.04 -0.05 5.43 1.01 -1.26 -0.17 121.20 124.37 2rpc s ILE 101 Ca 0.45 -0.11 0.04 0.00 0.00 0.00 0.00 60.65 61.04 2rpc s ILE 101 Cb -0.11 -0.06 -0.00 0.00 0.01 0.00 0.00 42.46 42.29 2rpc s ILE 101 CO 0.23 -0.04 -0.17 -0.36 0.00 0.00 0.00 174.94 174.60 2rpc s PHE 102 N -0.15 1.75 -0.67 3.97 0.40 -1.26 -5.01 117.98 117.02 2rpc s PHE 102 Ca -0.01 -0.54 0.23 0.00 -0.60 0.00 0.00 56.93 56.02 2rpc s PHE 102 Cb -0.01 -1.19 0.91 0.00 0.51 0.00 0.00 43.02 43.24 2rpc s PHE 102 CO -0.00 -0.20 1.71 0.00 0.70 0.00 0.00 175.22 177.44 2rpc n ALA 103 N 3.24 1.89 -2.93 5.36 0.00 -1.26 -4.32 120.51 122.49 2rpc n ALA 103 Ca -0.19 0.02 -0.34 0.00 0.00 0.00 0.00 53.44 52.94 2rpc n ALA 103 Cb 0.53 -1.40 -0.12 0.00 0.00 0.00 0.00 19.45 18.46 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 -3.19 3.52 0.10 0.00 6.06 -1.26 -4.60 118.95 119.59 2rpc s ARG 104 Ca 0.07 -0.55 -0.23 0.00 -2.50 0.00 0.00 55.73 52.52 2rpc s ARG 104 Cb 0.11 -2.83 -0.10 0.00 0.06 0.00 0.00 34.95 32.19 2rpc s ARG 104 CO 0.44 0.29 1.70 0.66 -2.50 0.00 0.00 175.30 175.89 2rpc h SER 105 N 6.53 -0.24 -0.77 -2.12 4.64 -1.99 -2.20 113.55 117.39 2rpc h SER 105 Ca -0.32 0.04 0.10 0.00 -0.47 0.00 0.00 61.79 61.14 2rpc h SER 105 Cb 1.19 0.10 -0.07 0.00 -0.31 0.00 0.00 62.40 63.31 2rpc h SER 105 CO 0.60 -0.12 0.41 -0.08 -0.87 0.00 0.00 176.83 176.77 2rpc h GLU 106 N -0.15 0.65 -0.89 4.77 4.81 -1.97 0.16 114.58 121.96 2rpc h GLU 106 Ca 0.03 -0.04 0.04 0.00 -0.13 0.00 0.00 59.36 59.26 2rpc h GLU 106 Cb 0.19 -0.15 -0.05 0.00 0.63 0.00 0.00 28.75 29.37 2rpc h GLU 106 CO -0.08 0.43 0.58 -0.91 -0.73 0.00 0.00 179.01 178.30 2rpc h ASN 107 N 0.67 0.94 -0.08 1.04 4.21 -1.85 0.16 115.58 120.66 2rpc h ASN 107 Ca 0.38 -0.01 -0.07 0.00 1.21 0.00 0.00 56.30 57.82 2rpc h ASN 107 Cb 0.40 -0.21 0.00 0.00 -1.12 0.00 0.00 38.32 37.39 2rpc h ASN 107 CO -0.27 0.64 -0.21 0.25 -1.29 0.00 0.00 177.43 176.54 2rpc h LEU 108 N 1.08 0.32 -0.18 1.61 5.85 -0.56 -1.80 115.31 121.64 2rpc h LEU 108 Ca 0.36 -0.59 -0.00 0.00 0.84 0.00 0.00 57.88 58.49 2rpc h LEU 108 Cb 0.06 -0.09 -0.01 0.00 0.37 0.00 0.00 40.66 40.99 2rpc h LEU 108 CO -0.11 0.86 0.11 0.11 -0.34 0.00 0.00 178.44 179.06 2rpc h LYS 109 N -0.19 0.24 -0.23 1.25 1.57 -0.67 0.39 116.57 118.93 2rpc h LYS 109 Ca -0.00 -0.02 -0.05 0.00 -1.87 0.00 0.00 60.65 58.71 2rpc h LYS 109 Cb 0.82 -0.05 -0.01 0.00 0.08 0.00 0.00 32.23 33.06 2rpc h LYS 109 CO 0.05 0.20 -0.07 0.82 -0.57 0.00 0.00 179.45 179.88 2rpc h ILE 110 N 0.22 1.18 0.00 1.86 2.04 -0.77 -1.29 117.51 120.75 2rpc h ILE 110 Ca 0.07 -0.75 -0.09 0.00 1.00 0.00 0.00 64.86 65.08 2rpc h ILE 110 Cb 0.01 1.08 -0.01 0.00 -0.74 0.00 0.00 36.82 37.16 2rpc h ILE 110 CO -0.01 0.25 -0.47 -0.74 0.00 0.00 0.00 178.15 177.17 2rpc h HIS 111 N 0.34 0.00 0.04 1.37 2.76 -0.85 -3.26 115.15 115.56 2rpc h HIS 111 Ca 0.07 0.00 -0.22 0.00 -2.20 0.00 0.00 60.37 58.02 2rpc h HIS 111 Cb 0.34 0.00 -0.01 0.00 1.55 0.00 0.00 27.41 29.29 2rpc h HIS 111 CO 0.01 0.44 -1.03 0.87 -1.30 0.00 0.00 177.93 176.92 2rpc h LYS 112 N 0.00 0.15 0.00 5.26 1.57 0.44 -3.22 116.57 120.77 2rpc h LYS 112 Ca -0.01 -0.22 -0.06 0.00 -1.87 0.00 0.00 60.65 58.49 2rpc h LYS 112 Cb 1.34 0.07 -0.01 0.00 0.08 0.00 0.00 32.23 33.72 2rpc h LYS 112 CO 0.06 1.05 -0.29 0.07 -0.57 0.00 0.00 179.45 179.77 2rpc h ARG 113 N 0.06 0.00 0.00 3.15 0.11 -1.30 -2.16 114.38 114.24 2rpc h ARG 113 Ca -0.06 0.00 -0.03 0.00 0.10 0.00 0.00 59.98 59.99 2rpc h ARG 113 Cb 1.73 0.00 -0.00 0.00 1.11 0.00 0.00 29.97 32.81 2rpc h ARG 113 CO 0.15 0.29 -0.12 0.00 0.10 0.00 0.00 179.97 180.39 2rpc h THR 114 N 0.00 0.25 0.00 0.08 1.03 -1.61 -2.94 112.91 109.72 2rpc h THR 114 Ca -0.00 -1.09 0.00 0.00 -0.01 0.00 0.00 66.41 65.31 2rpc h THR 114 Cb 0.54 1.89 0.00 0.00 -1.07 0.00 0.00 68.15 69.51 2rpc h THR 114 CO 0.04 0.12 0.00 1.41 -0.01 0.00 0.00 175.52 177.08 2rpc n HIS 115 N -3.18 0.00 0.17 0.00 8.25 -0.81 -2.26 115.22 117.39 2rpc n HIS 115 Ca 0.02 0.00 0.07 0.00 -0.26 0.00 0.00 57.72 57.55 2rpc n HIS 115 Cb 0.48 -0.45 0.09 0.00 1.12 0.00 0.00 29.99 31.24 2rpc n HIS 115 CO 0.00 0.00 0.00 1.15 0.64 0.00 0.00 176.34 178.13 2rpc h THR 116 N 0.00 0.50 -0.04 1.59 2.02 -1.62 -3.37 112.91 111.99 2rpc h THR 116 Ca 0.00 -1.70 0.00 0.00 0.77 0.00 0.00 66.41 65.49 2rpc h THR 116 Cb 0.25 2.24 -0.01 0.00 -1.74 0.00 0.00 68.15 68.89 2rpc h THR 116 CO 0.00 0.28 -0.06 1.23 0.37 0.00 0.00 175.52 177.34 2rpc h GLY 117 N 3.69 -1.76 -3.54 2.16 0.00 -1.65 -3.42 103.07 98.55 2rpc h GLY 117 Ca -0.00 0.78 -0.60 0.00 0.00 0.00 0.00 47.33 47.52 2rpc h GLY 117 CO 0.04 -0.64 -0.64 -0.54 0.00 0.00 0.00 176.54 174.75 2rpc s GLU 118 N -3.30 2.47 0.02 4.80 2.02 -1.26 -5.13 118.70 118.32 2rpc s GLU 118 Ca -0.02 -1.09 0.04 0.00 0.02 0.00 0.00 54.97 53.92 2rpc s GLU 118 Cb 0.01 -2.39 -0.03 0.00 0.10 0.00 0.00 34.13 31.82 2rpc s GLU 118 CO 0.07 0.45 -0.07 -1.59 0.02 0.00 0.00 175.26 174.14 2rpc s LYS 119 N -3.02 2.48 0.14 1.61 0.00 -1.26 -4.95 119.74 114.74 2rpc s LYS 119 Ca 0.28 -0.77 -0.11 0.00 0.00 0.00 0.00 55.97 55.36 2rpc s LYS 119 Cb -0.09 -2.47 -0.05 0.00 0.00 0.00 0.00 37.83 35.23 2rpc s LYS 119 CO 0.19 0.59 1.47 -1.00 0.00 0.00 0.00 175.35 176.60 2rpc h PRO 120 N 4.37 0.92 -5.22 1.78 0.13 -1.90 -3.43 132.00 128.65 2rpc h PRO 120 Ca -0.48 -0.49 -0.66 0.00 -0.87 0.00 0.00 66.00 63.50 2rpc h PRO 120 Cb 1.17 0.02 -0.29 0.00 0.13 0.00 0.00 31.00 32.02 2rpc h PRO 120 CO 0.53 1.14 -0.79 -0.06 -0.23 0.00 0.00 178.00 178.59 2rpc s PHE 121 N -4.40 2.79 -0.03 1.56 0.08 -0.54 -5.05 117.98 112.40 2rpc s PHE 121 Ca -0.11 -0.93 0.06 0.00 0.12 0.00 0.00 56.93 56.07 2rpc s PHE 121 Cb 0.11 -1.88 -0.01 0.00 -0.57 0.00 0.00 43.02 40.67 2rpc s PHE 121 CO 0.88 -0.40 -0.22 0.21 -0.10 0.00 0.00 175.22 175.59 2rpc s LYS 122 N 0.70 1.95 -0.42 0.44 2.20 -1.26 -0.17 119.74 123.18 2rpc s LYS 122 Ca -0.07 -0.78 -0.43 0.00 -0.36 0.00 0.00 55.97 54.34 2rpc s LYS 122 Cb -0.16 -1.78 -0.17 0.00 -1.51 0.00 0.00 37.83 34.21 2rpc s LYS 122 CO 0.02 0.41 1.87 0.00 -0.36 0.00 0.00 175.35 177.28 2rpc n GLU 124 N 5.93 0.13 -2.34 0.00 1.02 -1.26 -4.76 120.64 119.36 2rpc n GLU 124 Ca 0.38 0.19 -0.40 0.00 -0.02 0.00 0.00 57.16 57.31 2rpc n GLU 124 Cb 0.04 -1.50 -0.03 0.00 -0.02 0.00 0.00 31.44 29.93 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 -2.74 3.31 0.53 -0.32 5.36 -1.26 -5.01 117.98 117.86 2rpc s PHE 125 Ca 0.11 1.59 -0.18 0.00 -0.96 0.00 0.00 56.93 57.49 2rpc s PHE 125 Cb 0.09 -3.41 -0.06 0.00 -0.34 0.00 0.00 43.02 39.30 2rpc s PHE 125 CO 0.23 -1.08 1.03 -2.00 -1.46 0.00 0.00 175.22 171.94 2rpc s GLU 126 N -1.76 3.65 -1.33 10.12 2.12 -1.26 -3.45 118.70 126.79 2rpc s GLU 126 Ca 0.49 1.20 0.00 0.00 0.36 0.00 0.00 54.97 57.02 2rpc s GLU 126 Cb -0.34 -2.08 0.00 0.00 0.26 0.00 0.00 34.13 31.97 2rpc s GLU 126 CO 0.43 -0.54 0.00 0.41 -0.54 0.00 0.00 175.26 175.03 2rpc n GLY 127 N -0.85 0.08 3.27 -1.50 0.00 -1.26 -4.94 105.19 99.98 2rpc n GLY 127 Ca 0.08 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.81 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 -0.53 4.55 0.29 0.00 -1.08 -1.26 -4.89 116.67 113.76 2rpc s ASP 129 Ca 0.08 -1.65 -0.01 0.00 -0.52 0.00 0.00 52.55 50.46 2rpc s ASP 129 Cb -0.09 -1.58 0.00 0.00 -1.46 0.00 0.00 42.92 39.80 2rpc s ASP 129 CO -0.01 -0.25 0.40 0.54 0.52 0.00 0.00 175.17 176.37 2rpc n ARG 130 N 4.37 0.58 -3.67 4.34 5.12 -1.26 -5.06 116.66 121.07 2rpc n ARG 130 Ca -0.08 -2.39 -0.09 0.00 -1.93 0.00 0.00 57.85 53.36 2rpc n ARG 130 Cb 0.42 2.27 -0.09 0.00 -1.16 0.00 0.00 32.46 33.90 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 -2.70 0.54 0.03 5.56 1.70 -1.26 -4.38 118.95 118.43 2rpc s ARG 131 Ca 0.25 0.98 0.03 0.00 -0.47 0.00 0.00 55.73 56.52 2rpc s ARG 131 Cb -0.01 0.06 -0.02 0.00 -0.57 0.00 0.00 34.95 34.41 2rpc s ARG 131 CO 0.18 -0.15 -0.09 -0.06 -1.08 0.00 0.00 175.30 174.10 2rpc s PHE 132 N 1.47 0.78 -0.18 5.89 0.08 0.76 -5.00 117.98 121.78 2rpc s PHE 132 Ca -0.09 -0.37 0.22 0.00 0.12 0.00 0.00 56.93 56.81 2rpc s PHE 132 Cb -0.07 -0.47 -0.09 0.00 -0.57 0.00 0.00 43.02 41.82 2rpc s PHE 132 CO -0.16 -0.03 0.89 0.00 -0.10 0.00 0.00 175.22 175.83 2rpc n ALA 133 N 1.91 2.57 -2.70 5.36 0.00 -1.26 -1.46 120.51 124.92 2rpc n ALA 133 Ca -0.19 -0.32 -0.10 0.00 0.00 0.00 0.00 53.44 52.83 2rpc n ALA 133 Cb 0.55 -1.01 -0.11 0.00 0.00 0.00 0.00 19.45 18.89 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 -5.17 0.52 0.10 0.00 2.20 -1.26 -4.72 114.94 106.62 2rpc s ASN 134 Ca -0.02 -0.66 -0.21 0.00 -0.94 0.00 0.00 52.86 51.02 2rpc s ASN 134 Cb 0.11 0.10 -0.11 0.00 -2.00 0.00 0.00 41.25 39.35 2rpc s ASN 134 CO 0.82 -0.35 1.75 0.28 -2.94 0.00 0.00 177.10 176.66 2rpc h SER 135 N 4.16 0.11 -0.82 3.54 0.02 -1.98 -2.22 113.55 116.37 2rpc h SER 135 Ca -0.34 -0.01 0.20 0.00 -0.84 0.00 0.00 61.79 60.80 2rpc h SER 135 Cb 1.19 -0.03 -0.14 0.00 0.14 0.00 0.00 62.40 63.56 2rpc h SER 135 CO 0.48 0.09 0.09 0.77 -1.14 0.00 0.00 176.83 177.12 2rpc h SER 136 N 0.12 -0.24 -0.08 3.07 4.64 -1.99 0.57 113.55 119.64 2rpc h SER 136 Ca 0.03 0.20 -0.10 0.00 -0.47 0.00 0.00 61.79 61.46 2rpc h SER 136 Cb -0.00 0.33 -0.01 0.00 -0.31 0.00 0.00 62.40 62.40 2rpc h SER 136 CO -0.01 -0.18 -0.26 0.44 -0.87 0.00 0.00 176.83 175.94 2rpc h ASP 137 N 0.14 0.54 0.27 4.97 3.32 -1.92 -2.54 116.42 121.19 2rpc h ASP 137 Ca 0.48 -0.19 -0.01 0.00 0.02 0.00 0.00 57.03 57.32 2rpc h ASP 137 Cb 0.90 -0.15 0.00 0.00 0.22 0.00 0.00 39.33 40.30 2rpc h ASP 137 CO -0.68 0.79 -0.13 -0.09 -1.72 0.00 0.00 179.24 177.40 2rpc h ARG 138 N 0.46 -0.35 0.00 3.56 2.43 0.62 -2.68 114.38 118.42 2rpc h ARG 138 Ca 0.06 0.02 -0.00 0.00 -0.81 0.00 0.00 59.98 59.26 2rpc h ARG 138 Cb 0.70 0.08 -0.00 0.00 -0.42 0.00 0.00 29.97 30.33 2rpc h ARG 138 CO 0.05 -0.06 -0.00 -0.22 -1.51 0.00 0.00 179.97 178.23 2rpc h LYS 139 N -0.62 0.00 0.00 0.20 3.64 -0.80 0.55 116.57 119.53 2rpc h LYS 139 Ca -0.04 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.34 2rpc h LYS 139 Cb 0.45 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.27 2rpc h LYS 139 CO 0.06 0.00 0.00 0.87 -2.27 0.00 0.00 179.45 178.11 2rpc h LYS 140 N 0.00 0.00 -0.01 1.90 1.57 -1.12 -2.92 116.57 116.00 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 0.04 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.35 2rpc h LYS 140 CO 0.00 0.00 -0.06 1.58 -0.57 0.00 0.00 179.45 180.40 2rpc n HIS 141 N -3.03 0.00 0.10 -1.35 -0.00 0.18 -3.45 115.22 107.68 2rpc n HIS 141 Ca 0.03 0.00 0.07 0.00 0.46 0.00 0.00 57.72 58.28 2rpc n HIS 141 Cb 0.45 -0.08 -0.00 0.00 -0.12 0.00 0.00 29.99 30.24 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 0.97 0.00 -0.03 1.57 2.86 -1.57 -3.32 114.93 115.41 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 0.32 0.00 -0.00 0.00 0.06 0.00 0.00 31.60 31.98 2rpc h MET 142 CO 0.00 0.14 0.20 1.12 1.06 0.00 0.00 176.91 179.43 2rpc h HIS 143 N 0.00 0.00 0.00 -0.22 -0.00 -1.70 0.30 115.15 113.53 2rpc h HIS 143 Ca -0.05 0.00 0.00 0.00 -0.00 0.00 0.00 60.37 60.32 2rpc h HIS 143 Cb 1.21 0.00 0.00 0.00 -0.00 0.00 0.00 27.41 28.62 2rpc h HIS 143 CO 0.00 0.00 -1.54 1.55 -0.00 0.00 0.00 177.93 177.94 2rpc n VAL 144 N -3.06 0.03 0.08 6.12 3.14 -1.25 -4.30 118.33 119.10 2rpc n VAL 144 Ca -0.02 -0.31 -0.16 0.00 -2.96 0.00 0.00 64.34 60.89 2rpc n VAL 144 Cb 0.27 0.34 -0.09 0.00 -1.06 0.00 0.00 33.84 33.30 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 0.69 0.50 1.45 3.86 -0.55 -3.36 115.15 117.73 2rpc h HIS 145 Ca 0.00 -0.42 -0.02 0.00 -1.16 0.00 0.00 60.37 58.77 2rpc h HIS 145 Cb 0.81 -0.06 0.00 0.00 1.06 0.00 0.00 27.41 29.22 2rpc h HIS 145 CO 0.00 1.27 -0.24 1.15 0.86 0.00 0.00 177.93 180.97 2rpc h THR 146 N 0.21 0.00 -4.48 2.45 2.02 -1.61 -3.48 112.91 108.02 2rpc h THR 146 Ca -0.12 -0.03 -0.43 0.00 0.77 0.00 0.00 66.41 66.60 2rpc h THR 146 Cb 1.76 0.00 -0.11 0.00 -1.74 0.00 0.00 68.15 68.07 2rpc h THR 146 CO 0.19 0.00 -0.40 -1.20 0.37 0.00 0.00 175.52 174.49 2rpc n SER 147 N -3.91 -0.09 -4.63 4.18 7.64 -1.26 -5.11 113.62 110.44 2rpc n SER 147 Ca -0.08 -2.86 -0.43 0.00 1.01 0.00 0.00 58.87 56.51 2rpc n SER 147 Cb 0.27 1.27 -0.02 0.00 -1.01 0.00 0.00 64.21 64.71 2rpc n SER 147 CO 0.00 0.00 0.00 1.51 -3.01 0.00 0.00 175.04 173.54 2rpc s ASP 148 N -3.02 6.82 -0.05 6.43 -4.77 -1.26 -4.52 116.67 116.29 2rpc s ASP 148 Ca 0.29 0.98 -0.02 0.00 -3.30 0.00 0.00 52.55 50.50 2rpc s ASP 148 Cb 0.01 -2.54 0.03 0.00 -1.09 0.00 0.00 42.92 39.33 2rpc s ASP 148 CO 0.21 -1.00 0.08 -0.54 0.70 0.00 0.00 175.17 174.62 2rpc s LYS 149 N 3.92 -0.05 0.15 2.11 1.02 -1.26 -5.12 119.74 120.51 2rpc s LYS 149 Ca 0.48 0.41 0.08 0.00 0.02 0.00 0.00 55.97 56.96 2rpc s LYS 149 Cb -0.12 -0.44 -0.04 0.00 -0.52 0.00 0.00 37.83 36.71 2rpc s LYS 149 CO 0.20 -0.31 -0.08 0.45 -0.92 0.00 0.00 175.35 174.69 2rpc s SER 150 N 2.10 4.39 0.00 2.83 0.15 -1.26 -4.90 113.70 117.02 2rpc s SER 150 Ca 0.03 -0.47 0.00 0.00 0.70 0.00 0.00 55.95 56.21 2rpc s SER 150 Cb -0.12 -0.81 0.00 0.00 -1.71 0.00 0.00 66.02 63.37 2rpc s SER 150 CO -0.04 0.13 0.00 0.61 1.20 0.00 0.00 173.24 175.14 2rpc n GLY 151 N 0.27 2.58 3.77 9.45 0.00 -1.26 -5.17 105.19 114.83 2rpc n GLY 151 Ca -0.12 -0.84 -0.32 0.00 0.00 0.00 0.00 46.02 44.75 2rpc n GLY 151 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2rpc s PRO 152 N -0.00 2.58 -0.05 1.61 0.04 -1.26 -5.07 135.00 132.85 2rpc s PRO 152 Ca 0.00 1.31 -0.03 0.00 0.04 0.00 0.00 61.00 62.32 2rpc s PRO 152 Cb 0.00 -1.93 0.02 0.00 0.04 0.00 0.00 34.50 32.63 2rpc s PRO 152 CO 0.00 -1.41 0.11 0.45 0.04 0.00 0.00 177.00 176.19 2rpc s SER 153 N -2.89 -0.10 0.86 6.66 0.15 -1.26 -5.16 113.70 111.96 2rpc s SER 153 Ca 0.65 0.23 -0.10 0.00 0.70 0.00 0.00 55.95 57.43 2rpc s SER 153 Cb -0.19 0.20 0.16 0.00 -1.71 0.00 0.00 66.02 64.48 2rpc s SER 153 CO 0.47 -0.07 1.19 -0.55 1.20 0.00 0.00 173.24 175.48 2rpc s SER 154 N 0.39 3.67 0.00 5.45 0.15 -1.26 -5.37 113.70 116.73 2rpc s SER 154 Ca -0.03 0.09 0.08 0.00 0.70 0.00 0.00 55.95 56.79 2rpc s SER 154 Cb -0.04 -0.29 0.06 0.00 -1.71 0.00 0.00 66.02 64.04 2rpc s SER 154 CO -0.02 -2.35 0.74 0.61 1.20 0.00 0.00 173.24 173.43