#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 -1.09 -0.20 1.61 0.01 -1.26 -5.16 113.70 107.62 2rpc s SER 2 Ca 0.00 1.31 -0.14 0.00 1.31 0.00 0.00 55.95 58.43 2rpc s SER 2 Cb 0.00 2.15 0.06 0.00 0.21 0.00 0.00 66.02 68.44 2rpc s SER 2 CO 0.00 -0.23 0.50 -0.55 0.41 0.00 0.00 173.24 173.36 2rpc s SER 3 N 2.85 -0.59 0.00 2.44 0.15 -1.26 -4.41 113.70 112.88 2rpc s SER 3 Ca 0.02 1.05 0.00 0.00 0.70 0.00 0.00 55.95 57.72 2rpc s SER 3 Cb -0.13 0.98 0.00 0.00 -1.71 0.00 0.00 66.02 65.16 2rpc s SER 3 CO -0.19 -0.19 0.00 0.61 1.20 0.00 0.00 173.24 174.67 2rpc n GLY 4 N 3.66 0.27 0.33 9.45 0.00 -1.26 -4.85 105.19 112.78 2rpc n GLY 4 Ca -0.19 -1.45 -0.07 0.00 0.00 0.00 0.00 46.02 44.32 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 -0.77 -3.82 1.61 7.64 -1.26 -4.45 113.62 112.57 2rpc n SER 5 Ca 0.00 1.43 -0.28 0.00 1.01 0.00 0.00 58.87 61.04 2rpc n SER 5 Cb 0.00 -0.22 0.24 0.00 -1.01 0.00 0.00 64.21 63.22 2rpc n SER 5 CO 0.00 0.00 0.00 -1.20 -3.01 0.00 0.00 175.04 170.83 2rpc n SER 6 N -5.06 -3.04 -2.78 6.43 7.64 -1.26 -5.00 113.62 110.55 2rpc n SER 6 Ca 0.03 -0.48 -0.08 0.00 1.01 0.00 0.00 58.87 59.35 2rpc n SER 6 Cb 0.24 -1.02 0.07 0.00 -1.01 0.00 0.00 64.21 62.49 2rpc n SER 6 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2rpc n GLY 7 N 1.79 -2.44 3.84 0.23 0.00 -1.26 -4.94 105.19 102.41 2rpc n GLY 7 Ca 0.07 -1.48 -0.35 0.00 0.00 0.00 0.00 46.02 44.26 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 -3.69 4.02 0.16 1.61 1.11 -1.26 -4.62 119.66 116.99 2rpc s GLN 8 Ca 0.20 0.57 -0.30 0.00 0.01 0.00 0.00 55.36 55.83 2rpc s GLN 8 Cb -0.02 -2.82 -0.08 0.00 -1.01 0.00 0.00 33.01 29.08 2rpc s GLN 8 CO 0.15 0.40 1.33 -1.25 0.01 0.00 0.00 175.29 175.92 2rpc s PRO 9 N -2.22 4.37 -0.48 2.91 0.04 -1.26 -4.99 135.00 133.37 2rpc s PRO 9 Ca 0.42 2.04 -0.20 0.00 0.04 0.00 0.00 61.00 63.30 2rpc s PRO 9 Cb -0.14 -3.22 0.04 0.00 0.04 0.00 0.00 34.50 31.22 2rpc s PRO 9 CO 0.20 -0.31 0.67 0.42 0.04 0.00 0.00 177.00 178.01 2rpc s ILE 10 N 0.48 4.80 0.03 0.56 1.01 -1.26 -5.05 121.20 121.78 2rpc s ILE 10 Ca 0.59 -0.14 -0.11 0.00 0.00 0.00 0.00 60.65 60.99 2rpc s ILE 10 Cb -0.36 -4.28 -0.06 0.00 0.01 0.00 0.00 42.46 37.77 2rpc s ILE 10 CO 0.35 -0.74 0.38 -1.59 0.00 0.00 0.00 174.94 173.34 2rpc s LYS 11 N 2.86 3.80 -0.33 2.79 -2.85 -1.26 -5.07 119.74 119.67 2rpc s LYS 11 Ca 0.20 0.24 -0.11 0.00 -1.00 0.00 0.00 55.97 55.30 2rpc s LYS 11 Cb -0.16 -3.10 -0.01 0.00 -2.06 0.00 0.00 37.83 32.50 2rpc s LYS 11 CO 0.16 0.63 0.20 -1.14 0.10 0.00 0.00 175.35 175.29 2rpc s GLN 12 N -1.51 3.37 -0.09 1.78 2.00 -1.26 -5.07 119.66 118.88 2rpc s GLN 12 Ca 0.28 -0.71 -0.25 0.00 -2.00 0.00 0.00 55.36 52.67 2rpc s GLN 12 Cb -0.15 -3.69 -0.03 0.00 0.80 0.00 0.00 33.01 29.95 2rpc s GLN 12 CO 0.15 -0.45 0.80 -1.21 -0.50 0.00 0.00 175.29 174.08 2rpc s GLU 13 N 1.66 4.41 0.39 1.67 2.02 -1.25 -3.66 118.70 123.94 2rpc s GLU 13 Ca 0.05 1.03 -0.02 0.00 0.02 0.00 0.00 54.97 56.05 2rpc s GLU 13 Cb -0.17 -3.49 -0.03 0.00 0.10 0.00 0.00 34.13 30.53 2rpc s GLU 13 CO 0.08 -0.09 0.63 -0.51 0.02 0.00 0.00 175.26 175.39 2rpc s LEU 14 N 1.29 3.89 -0.08 1.80 1.43 -0.53 -4.89 118.68 121.59 2rpc s LEU 14 Ca 0.41 0.61 0.02 0.00 -1.03 0.00 0.00 54.13 54.13 2rpc s LEU 14 Cb -0.18 -3.50 0.02 0.00 0.03 0.00 0.00 46.19 42.55 2rpc s LEU 14 CO 0.18 -0.38 -0.12 -0.94 0.23 0.00 0.00 176.35 175.32 2rpc s SER 15 N -4.03 1.93 -0.30 2.29 1.04 -1.26 -4.19 113.70 109.19 2rpc s SER 15 Ca 0.42 -0.31 0.02 0.00 0.48 0.00 0.00 55.95 56.56 2rpc s SER 15 Cb -0.10 -0.86 0.09 0.00 0.10 0.00 0.00 66.02 65.25 2rpc s SER 15 CO 0.39 -0.00 0.02 0.00 0.98 0.00 0.00 173.24 174.63 2rpc s LYS 17 N 1.19 3.08 -0.20 0.00 -0.14 -1.26 -4.35 119.74 118.07 2rpc s LYS 17 Ca 0.05 -1.69 -0.06 0.00 -1.36 0.00 0.00 55.97 52.92 2rpc s LYS 17 Cb -0.19 -4.32 -0.03 0.00 -1.68 0.00 0.00 37.83 31.62 2rpc s LYS 17 CO -0.11 -1.39 0.02 -0.46 -0.76 0.00 0.00 175.35 172.65 2rpc s TRP 18 N 1.77 3.09 -0.24 3.18 -0.11 -1.26 -3.69 118.94 121.67 2rpc s TRP 18 Ca 0.08 -0.32 0.01 0.00 1.22 0.00 0.00 56.10 57.09 2rpc s TRP 18 Cb -0.26 -2.09 0.06 0.00 -1.50 0.00 0.00 33.47 29.68 2rpc s TRP 18 CO 0.02 -0.15 -0.07 0.42 -4.62 0.00 0.00 176.95 172.55 2rpc s ILE 19 N 0.89 1.71 0.14 5.86 1.01 0.59 -2.14 121.20 129.25 2rpc s ILE 19 Ca 0.02 -1.33 -0.25 0.00 0.00 0.00 0.00 60.65 59.09 2rpc s ILE 19 Cb -0.14 -1.93 -0.07 0.00 0.01 0.00 0.00 42.46 40.33 2rpc s ILE 19 CO 0.02 -0.08 0.75 -1.81 0.00 0.00 0.00 174.94 173.82 2rpc s ASP 20 N 1.31 7.33 0.18 3.58 1.01 -1.26 -4.31 116.67 124.51 2rpc s ASP 20 Ca -0.07 1.57 0.08 0.00 0.71 0.00 0.00 52.55 54.85 2rpc s ASP 20 Cb -0.19 -2.48 0.02 0.00 1.01 0.00 0.00 42.92 41.28 2rpc s ASP 20 CO -0.06 0.19 1.42 -0.33 0.21 0.00 0.00 175.17 176.60 2rpc h GLU 21 N 4.56 0.00 -0.90 8.23 5.08 -2.00 -3.15 114.58 126.41 2rpc h GLU 21 Ca -0.47 -0.00 -0.30 0.00 -1.00 0.00 0.00 59.36 57.59 2rpc h GLU 21 Cb 1.21 0.00 -0.18 0.00 0.50 0.00 0.00 28.75 30.28 2rpc h GLU 21 CO 0.66 0.84 0.38 0.00 -1.00 0.00 0.00 179.01 179.90 2rpc n ALA 22 N -2.38 4.65 -2.16 3.43 0.00 -1.26 -4.95 120.51 117.84 2rpc n ALA 22 Ca -0.01 -2.16 -0.41 0.00 0.00 0.00 0.00 53.44 50.87 2rpc n ALA 22 Cb 0.81 -1.29 -0.05 0.00 0.00 0.00 0.00 19.45 18.92 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 -2.65 4.73 0.00 0.00 -2.07 -1.19 -4.93 119.66 113.54 2rpc s GLN 23 Ca 0.47 1.47 0.23 0.00 -1.82 0.00 0.00 55.36 55.70 2rpc s GLN 23 Cb 0.38 -3.36 1.09 0.00 -1.09 0.00 0.00 33.01 30.04 2rpc s GLN 23 CO 0.10 0.27 1.74 -0.11 -1.32 0.00 0.00 175.29 175.97 2rpc n LEU 24 N 2.53 0.81 -4.62 2.60 7.94 -1.26 -4.78 117.00 120.22 2rpc n LEU 24 Ca 0.02 -0.32 -0.36 0.00 -1.11 0.00 0.00 56.01 54.23 2rpc n LEU 24 Cb 0.49 -0.04 -0.10 0.00 0.53 0.00 0.00 43.42 44.30 2rpc n LEU 24 CO 0.51 0.16 -0.20 -0.94 -1.11 0.00 0.00 177.39 175.81 2rpc s SER 25 N -1.70 5.92 0.04 1.96 1.04 -1.26 -5.09 113.70 114.61 2rpc s SER 25 Ca 0.34 0.06 0.03 0.00 0.48 0.00 0.00 55.95 56.85 2rpc s SER 25 Cb 0.17 -2.06 -0.02 0.00 0.10 0.00 0.00 66.02 64.20 2rpc s SER 25 CO 0.27 0.06 -0.09 -0.13 0.98 0.00 0.00 173.24 174.33 2rpc s ARG 26 N 1.09 0.61 0.35 4.02 1.81 -1.26 -3.30 118.95 122.27 2rpc s ARG 26 Ca 0.07 -0.71 -0.27 0.00 -1.72 0.00 0.00 55.73 53.10 2rpc s ARG 26 Cb -0.14 -0.47 -0.09 0.00 -0.45 0.00 0.00 34.95 33.80 2rpc s ARG 26 CO 0.04 0.10 1.21 -1.25 -0.68 0.00 0.00 175.30 174.73 2rpc s PRO 27 N -1.35 4.28 -0.33 3.54 0.04 -1.26 -5.01 135.00 134.91 2rpc s PRO 27 Ca -0.06 1.99 -0.30 0.00 0.04 0.00 0.00 61.00 62.67 2rpc s PRO 27 Cb -0.09 -2.93 -0.13 0.00 0.04 0.00 0.00 34.50 31.39 2rpc s PRO 27 CO 0.01 -0.17 1.28 1.63 0.04 0.00 0.00 177.00 179.79 2rpc n LYS 28 N 0.57 0.00 -3.03 4.56 5.02 -1.21 -4.90 118.16 119.18 2rpc n LYS 28 Ca 0.02 0.00 -0.19 0.00 -2.02 0.00 0.00 58.31 56.12 2rpc n LYS 28 Cb 0.44 -1.00 0.03 0.00 -0.02 0.00 0.00 35.03 34.48 2rpc n LYS 28 CO 0.00 0.00 0.00 1.63 -0.52 0.00 0.00 177.40 178.51 2rpc n LYS 29 N 4.03 0.75 -4.79 1.97 5.02 -1.26 -5.10 118.16 118.77 2rpc n LYS 29 Ca 0.30 -2.71 -0.32 0.00 -2.02 0.00 0.00 58.31 53.56 2rpc n LYS 29 Cb -0.03 0.05 -0.13 0.00 -0.02 0.00 0.00 35.03 34.90 2rpc n LYS 29 CO 0.00 0.00 0.00 -1.54 -0.52 0.00 0.00 177.40 175.34 2rpc s SER 30 N -3.82 3.87 1.13 4.39 1.04 -1.26 -4.43 113.70 114.61 2rpc s SER 30 Ca 0.38 -0.33 -0.17 0.00 0.48 0.00 0.00 55.95 56.32 2rpc s SER 30 Cb -0.03 -0.70 0.20 0.00 0.10 0.00 0.00 66.02 65.58 2rpc s SER 30 CO 0.24 0.30 0.36 0.00 0.98 0.00 0.00 173.24 175.12 2rpc s ASP 32 N -2.15 2.03 -0.19 0.00 -1.08 -1.26 -4.70 116.67 109.32 2rpc s ASP 32 Ca 0.48 -0.36 -0.31 0.00 -0.52 0.00 0.00 52.55 51.84 2rpc s ASP 32 Cb -0.09 -0.43 0.15 0.00 -1.46 0.00 0.00 42.92 41.09 2rpc s ASP 32 CO 0.47 -0.25 1.15 -0.60 0.52 0.00 0.00 175.17 176.45 2rpc s ARG 33 N 1.98 0.38 0.15 4.34 6.06 -1.26 -5.09 118.95 125.51 2rpc s ARG 33 Ca 0.03 0.01 -0.18 0.00 -2.50 0.00 0.00 55.73 53.08 2rpc s ARG 33 Cb -0.14 0.18 0.04 0.00 0.06 0.00 0.00 34.95 35.09 2rpc s ARG 33 CO -0.06 -0.13 0.49 -0.08 -2.50 0.00 0.00 175.30 173.01 2rpc s THR 34 N -1.55 0.04 0.26 4.11 -1.32 -1.26 -3.82 115.64 112.10 2rpc s THR 34 Ca 0.05 -0.45 -0.13 0.00 -1.21 0.00 0.00 61.69 59.94 2rpc s THR 34 Cb -0.01 -1.21 0.00 0.00 -1.51 0.00 0.00 72.50 69.78 2rpc s THR 34 CO -0.04 -0.18 0.52 -0.36 -2.21 0.00 0.00 174.62 172.36 2rpc s PHE 35 N -3.80 0.32 -0.06 9.09 0.40 -1.26 -4.86 117.98 117.80 2rpc s PHE 35 Ca 0.04 -0.70 -0.12 0.00 -0.60 0.00 0.00 56.93 55.55 2rpc s PHE 35 Cb 0.00 0.27 -0.30 0.00 0.51 0.00 0.00 43.02 43.50 2rpc s PHE 35 CO -0.10 -1.06 0.63 1.03 0.70 0.00 0.00 175.22 176.42 2rpc h SER 36 N 2.20 0.57 -1.97 1.36 0.87 -1.96 -1.41 113.55 113.20 2rpc h SER 36 Ca -0.25 -0.93 -0.58 0.00 -1.23 0.00 0.00 61.79 58.80 2rpc h SER 36 Cb 1.25 -0.19 -0.10 0.00 -0.44 0.00 0.00 62.40 62.92 2rpc h SER 36 CO 0.34 1.77 -0.62 0.42 -0.53 0.00 0.00 176.83 178.21 2rpc s THR 37 N -2.56 2.80 0.03 2.23 -4.23 -1.26 -4.12 115.64 108.52 2rpc s THR 37 Ca -0.17 -1.95 -0.27 0.00 -1.18 0.00 0.00 61.69 58.12 2rpc s THR 37 Cb 0.05 -2.80 -0.17 0.00 1.34 0.00 0.00 72.50 70.92 2rpc s THR 37 CO 0.83 -0.23 1.38 -0.03 -0.54 0.00 0.00 174.62 176.03 2rpc h MET 38 N 1.81 -0.55 -1.42 3.99 4.05 -1.95 -2.84 114.93 118.03 2rpc h MET 38 Ca -0.43 0.04 0.45 0.00 -0.28 0.00 0.00 59.70 59.48 2rpc h MET 38 Cb 1.25 0.12 -0.12 0.00 -0.80 0.00 0.00 31.60 32.06 2rpc h MET 38 CO 0.65 -0.27 0.94 1.25 0.23 0.00 0.00 176.91 179.71 2rpc h HIS 39 N -0.78 0.42 -0.40 1.39 -0.00 -1.99 1.09 115.15 114.87 2rpc h HIS 39 Ca -0.06 0.02 -0.09 0.00 -0.00 0.00 0.00 60.37 60.24 2rpc h HIS 39 Cb 0.54 -0.10 -0.01 0.00 -0.00 0.00 0.00 27.41 27.83 2rpc h HIS 39 CO -0.00 -0.16 -0.11 0.93 -0.00 0.00 0.00 177.93 178.59 2rpc h GLU 40 N 0.07 0.77 -0.30 5.26 4.39 -1.93 -2.85 114.58 120.00 2rpc h GLU 40 Ca 0.83 -0.30 -0.07 0.00 0.34 0.00 0.00 59.36 60.16 2rpc h GLU 40 Cb 2.75 -0.04 -0.01 0.00 -0.10 0.00 0.00 28.75 31.35 2rpc h GLU 40 CO -0.34 0.91 -0.08 1.25 -1.16 0.00 0.00 179.01 179.60 2rpc h LEU 41 N 0.59 0.60 -0.37 1.33 5.85 0.12 -3.19 115.31 120.24 2rpc h LEU 41 Ca 0.10 -0.37 0.08 0.00 0.84 0.00 0.00 57.88 58.53 2rpc h LEU 41 Cb 0.63 -0.16 -0.08 0.00 0.37 0.00 0.00 40.66 41.42 2rpc h LEU 41 CO 0.04 0.83 -0.15 0.58 -0.34 0.00 0.00 178.44 179.41 2rpc h VAL 42 N 0.36 0.52 -0.71 1.05 2.07 -1.13 0.17 116.25 118.58 2rpc h VAL 42 Ca 0.08 0.00 0.21 0.00 0.82 0.00 0.00 66.70 67.80 2rpc h VAL 42 Cb 0.57 0.52 -0.03 0.00 -1.52 0.00 0.00 31.29 30.84 2rpc h VAL 42 CO 0.03 0.00 0.59 0.74 0.02 0.00 0.00 177.57 178.95 2rpc h THR 43 N -0.07 0.47 0.00 2.57 2.02 -1.49 0.30 112.91 116.72 2rpc h THR 43 Ca 0.18 0.00 0.00 0.00 0.77 0.00 0.00 66.41 67.36 2rpc h THR 43 Cb 0.35 0.57 0.00 0.00 -1.74 0.00 0.00 68.15 67.34 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 -0.77 -0.53 115.15 116.91 2rpc h HIS 44 Ca 0.34 0.00 0.03 0.00 -0.00 0.00 0.00 60.37 60.74 2rpc h HIS 44 Cb 1.50 0.00 -0.00 0.00 -0.00 0.00 0.00 27.41 28.91 2rpc h HIS 44 CO 0.00 0.00 0.32 0.28 -0.00 0.00 0.00 177.93 178.53 2rpc h VAL 45 N -0.71 0.12 0.00 5.26 2.07 -0.78 2.26 116.25 124.48 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 0.70 -0.02 0.00 -1.52 0.00 0.00 31.29 30.56 2rpc h VAL 45 CO 0.00 0.00 -1.00 0.41 0.02 0.00 0.00 177.57 177.00 2rpc n THR 46 N -3.16 1.47 -0.09 2.57 -1.04 0.10 -1.75 114.28 112.38 2rpc n THR 46 Ca 0.00 0.08 -0.20 0.00 -2.04 0.00 0.00 64.05 61.89 2rpc n THR 46 Cb 0.40 -2.25 -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 0.01 0.00 -2.82 2.86 -0.72 2.00 114.93 115.26 2rpc h MET 47 Ca -0.16 -0.02 0.00 0.00 -2.06 0.00 0.00 59.70 57.46 2rpc h MET 47 Cb 0.91 0.01 0.00 0.00 0.06 0.00 0.00 31.60 32.58 2rpc h MET 47 CO -0.10 1.01 0.00 0.39 1.06 0.00 0.00 176.91 179.27 2rpc n GLU 48 N -4.44 0.54 0.00 1.72 -0.58 0.73 -2.36 120.64 116.24 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 0.66 -1.32 0.00 0.00 -0.57 0.00 0.00 31.44 30.21 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 -0.82 -0.22 0.77 -0.32 8.25 0.85 -4.81 115.22 118.92 2rpc n HIS 49 Ca 0.08 0.00 0.07 0.00 -0.26 0.00 0.00 57.72 57.61 2rpc n HIS 49 Cb 0.04 0.29 0.39 0.00 1.12 0.00 0.00 29.99 31.83 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 -1.87 0.32 -4.79 1.59 0.31 0.28 -4.95 118.33 109.21 2rpc n VAL 50 Ca 0.00 0.08 0.00 0.00 -0.01 0.00 0.00 64.34 64.41 2rpc n VAL 50 Cb 0.00 -0.85 0.00 0.00 -0.91 0.00 0.00 33.84 32.08 2rpc n VAL 50 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 2rpc n GLY 51 N -0.11 0.66 0.00 2.92 0.00 0.65 -4.82 105.19 104.49 2rpc n GLY 51 Ca 0.09 -0.77 0.00 0.00 0.00 0.00 0.00 46.02 45.34 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 3.03 0.06 -0.02 0.00 -1.26 -3.48 105.19 103.51 2rpc n GLY 52 Ca 0.00 -2.12 0.09 0.00 0.00 0.00 0.00 46.02 44.00 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 -0.46 0.09 0.00 1.61 -0.04 -1.26 -1.95 135.00 132.99 2rpc n PRO 53 Ca 0.00 0.33 0.13 0.00 -0.04 0.00 0.00 63.50 63.92 2rpc n PRO 53 Cb 0.00 -1.67 0.38 0.00 -0.04 0.00 0.00 33.50 32.16 2rpc n PRO 53 CO 0.00 0.00 0.00 -1.91 -0.04 0.00 0.00 175.50 173.55 2rpc n GLU 54 N -1.84 1.01 -1.96 0.54 4.07 -1.26 -4.87 120.64 116.33 2rpc n GLU 54 Ca 0.03 -0.61 -0.43 0.00 -0.06 0.00 0.00 57.16 56.09 2rpc n GLU 54 Cb 0.19 -1.49 -0.03 0.00 -0.06 0.00 0.00 31.44 30.06 2rpc n GLU 54 CO 0.00 0.00 0.00 -1.14 -0.06 0.00 0.00 177.13 175.93 2rpc s GLN 55 N -2.42 3.47 0.00 5.31 0.74 -0.82 -4.92 119.66 121.03 2rpc s GLN 55 Ca 0.26 1.64 0.00 0.00 0.05 0.00 0.00 55.36 57.31 2rpc s GLN 55 Cb 0.19 -4.18 0.00 0.00 1.10 0.00 0.00 33.01 30.13 2rpc s GLN 55 CO 0.49 -1.69 0.48 0.27 -0.55 0.00 0.00 175.29 174.29 2rpc n ASN 56 N 9.84 0.00 -4.55 6.67 6.94 -1.26 -4.34 115.26 128.57 2rpc n ASN 56 Ca 0.23 0.48 -0.34 0.00 -0.02 0.00 0.00 54.58 54.92 2rpc n ASN 56 Cb 0.46 -0.09 -0.11 0.00 -2.36 0.00 0.00 39.78 37.68 2rpc n ASN 56 CO 0.00 0.00 0.00 0.54 -1.03 0.00 0.00 177.26 176.77 2rpc s ASN 57 N -2.49 5.00 -0.39 0.53 4.22 -1.26 -5.08 114.94 115.47 2rpc s ASN 57 Ca 0.00 -0.06 -0.08 0.00 -2.14 0.00 0.00 52.86 50.59 2rpc s ASN 57 Cb 0.00 -1.78 0.07 0.00 1.28 0.00 0.00 41.25 40.82 2rpc s ASN 57 CO 0.00 0.20 0.19 -1.38 -2.04 0.00 0.00 177.10 174.07 2rpc s HIS 58 N 0.21 3.33 -0.03 1.54 -3.43 -1.26 -5.06 115.29 110.59 2rpc s HIS 58 Ca -0.01 -1.57 -0.00 0.00 -0.80 0.00 0.00 55.06 52.68 2rpc s HIS 58 Cb -0.13 -2.72 0.03 0.00 -1.43 0.00 0.00 32.58 28.32 2rpc s HIS 58 CO 0.02 -0.81 0.03 0.08 -2.00 0.00 0.00 174.74 172.06 2rpc s VAL 59 N 1.39 0.00 -0.36 -5.38 1.01 -1.26 -4.49 120.40 111.32 2rpc s VAL 59 Ca 0.02 0.23 -0.17 0.00 0.00 0.00 0.00 61.98 62.06 2rpc s VAL 59 Cb -0.22 -0.16 -0.00 0.00 0.00 0.00 0.00 36.38 36.00 2rpc s VAL 59 CO 0.02 0.13 0.46 0.00 0.00 0.00 0.00 175.10 175.71 2rpc s TYR 61 N 2.27 3.42 0.14 0.00 1.51 -1.26 -4.07 117.35 119.35 2rpc s TYR 61 Ca 0.16 -1.63 -0.13 0.00 -1.01 0.00 0.00 57.07 54.46 2rpc s TYR 61 Cb -0.16 -3.73 -0.07 0.00 -0.11 0.00 0.00 41.96 37.89 2rpc s TYR 61 CO 0.13 -1.00 0.52 -0.46 -1.11 0.00 0.00 175.55 173.63 2rpc s TRP 62 N 1.11 3.60 0.61 2.71 -0.11 -1.26 -0.30 118.94 125.30 2rpc s TRP 62 Ca 0.08 1.01 0.27 0.00 1.22 0.00 0.00 56.10 58.68 2rpc s TRP 62 Cb -0.24 -2.33 1.06 0.00 -1.50 0.00 0.00 33.47 30.46 2rpc s TRP 62 CO -0.01 0.44 1.45 1.49 -4.62 0.00 0.00 176.95 175.71 2rpc h GLU 63 N 3.57 0.00 -0.02 5.86 4.22 -1.84 -1.65 114.58 124.72 2rpc h GLU 63 Ca -0.49 0.00 -0.15 0.00 0.08 0.00 0.00 59.36 58.80 2rpc h GLU 63 Cb 1.19 0.00 -0.20 0.00 0.50 0.00 0.00 28.75 30.24 2rpc h GLU 63 CO 0.66 0.00 -0.50 -0.85 -2.18 0.00 0.00 179.01 176.14 2rpc n GLU 64 N -3.34 0.29 -1.50 1.92 0.00 -1.26 -5.05 120.64 111.70 2rpc n GLU 64 Ca 0.19 -1.39 -0.53 0.00 0.00 0.00 0.00 57.16 55.44 2rpc n GLU 64 Cb 1.31 0.27 -0.05 0.00 0.00 0.00 0.00 31.44 32.96 2rpc n GLU 64 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.13 177.13 2rpc h PRO 66 N 2.60 0.00 0.00 0.00 0.13 -1.98 -2.69 132.00 130.07 2rpc h PRO 66 Ca -0.42 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.71 2rpc h PRO 66 Cb 1.40 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.53 2rpc h PRO 66 CO 0.65 0.15 -0.67 0.00 -0.23 0.00 0.00 178.00 177.90 2rpc h ARG 67 N 0.00 0.00 -1.78 0.86 3.08 -1.96 -3.48 114.38 111.10 2rpc h ARG 67 Ca -0.00 0.00 -0.18 0.00 0.07 0.00 0.00 59.98 59.87 2rpc h ARG 67 Cb 0.61 0.00 0.01 0.00 0.08 0.00 0.00 29.97 30.67 2rpc h ARG 67 CO 0.02 0.00 -0.25 0.39 -1.07 0.00 0.00 179.97 179.06 2rpc n GLU 68 N -2.67 -1.44 -2.98 0.04 1.02 -1.01 -3.57 120.64 110.03 2rpc n GLU 68 Ca 0.02 0.43 -0.12 0.00 -0.02 0.00 0.00 57.16 57.46 2rpc n GLU 68 Cb 0.52 -4.35 0.06 0.00 -0.02 0.00 0.00 31.44 27.65 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 -1.05 -0.32 3.41 0.62 0.00 -1.26 -4.99 105.19 101.61 2rpc n GLY 69 Ca -0.08 0.09 -0.43 0.00 0.00 0.00 0.00 46.02 45.60 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 -4.68 2.95 0.54 1.61 -0.14 -1.23 -4.90 119.74 113.89 2rpc s LYS 70 Ca 0.12 -1.20 -0.19 0.00 -1.36 0.00 0.00 55.97 53.33 2rpc s LYS 70 Cb -0.02 -4.04 -0.09 0.00 -1.68 0.00 0.00 37.83 32.01 2rpc s LYS 70 CO 0.55 -0.89 0.68 0.45 -0.76 0.00 0.00 175.35 175.37 2rpc n SER 71 N 5.16 -0.37 -4.91 2.83 2.88 -1.26 -4.96 113.62 112.99 2rpc n SER 71 Ca -0.12 0.81 -0.20 0.00 -1.33 0.00 0.00 58.87 58.03 2rpc n SER 71 Cb 0.45 -1.23 0.06 0.00 -0.75 0.00 0.00 64.21 62.74 2rpc n SER 71 CO 0.00 0.00 0.00 0.49 -1.23 0.00 0.00 175.04 174.30 2rpc n PHE 72 N -1.46 -2.06 -0.74 0.66 3.01 -1.26 -5.02 117.46 110.59 2rpc n PHE 72 Ca 0.12 -2.14 0.06 0.00 1.01 0.00 0.00 57.45 56.50 2rpc n PHE 72 Cb 0.45 -0.53 0.37 0.00 -0.01 0.00 0.00 39.48 39.76 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 -2.20 4.53 -3.91 -1.08 4.81 -1.26 -4.96 118.16 114.09 2rpc n LYS 73 Ca 0.14 -2.88 0.01 0.00 -0.87 0.00 0.00 58.31 54.70 2rpc n LYS 73 Cb 0.60 -2.20 0.01 0.00 0.02 0.00 0.00 35.03 33.46 2rpc n LYS 73 CO 0.00 0.00 0.00 0.00 1.17 0.00 0.00 177.40 178.57 2rpc s ALA 74 N -2.62 -2.18 -0.15 3.14 0.00 -1.26 -5.03 121.76 113.65 2rpc s ALA 74 Ca 0.50 0.00 -0.20 0.00 0.00 0.00 0.00 51.96 52.26 2rpc s ALA 74 Cb 0.38 0.79 -0.24 0.00 0.00 0.00 0.00 23.12 24.06 2rpc s ALA 74 CO 0.14 -1.11 0.45 0.87 0.00 0.00 0.00 175.76 176.11 2rpc h LYS 75 N 2.00 0.11 0.00 0.00 1.79 -2.00 -3.33 116.57 115.14 2rpc h LYS 75 Ca -0.25 -0.18 -0.02 0.00 -2.18 0.00 0.00 60.65 58.02 2rpc h LYS 75 Cb 1.20 0.07 -0.00 0.00 -1.58 0.00 0.00 32.23 31.91 2rpc h LYS 75 CO 0.32 1.09 -0.09 0.10 -1.08 0.00 0.00 179.45 179.79 2rpc h TYR 76 N -0.68 0.00 -0.50 -1.35 -0.00 -1.98 -0.39 116.97 112.07 2rpc h TYR 76 Ca -0.28 0.00 -0.12 0.00 -0.00 0.00 0.00 58.73 58.33 2rpc h TYR 76 Cb 1.46 0.00 -0.01 0.00 -0.00 0.00 0.00 36.73 38.18 2rpc h TYR 76 CO 0.14 0.09 -0.16 0.87 -0.00 0.00 0.00 178.16 179.10 2rpc h LYS 77 N 0.00 1.00 0.00 0.10 1.79 -1.96 -2.45 116.57 115.05 2rpc h LYS 77 Ca -0.00 -0.40 -0.07 0.00 -2.18 0.00 0.00 60.65 58.00 2rpc h LYS 77 Cb 0.29 -0.05 -0.01 0.00 -1.58 0.00 0.00 32.23 30.88 2rpc h LYS 77 CO 0.01 1.08 -0.38 1.25 -1.08 0.00 0.00 179.45 180.33 2rpc h LEU 78 N 0.86 0.01 -1.23 2.94 5.85 -1.54 -3.22 115.31 118.97 2rpc h LEU 78 Ca 0.12 -0.86 0.26 0.00 0.84 0.00 0.00 57.88 58.25 2rpc h LEU 78 Cb 0.73 -0.00 -0.11 0.00 0.37 0.00 0.00 40.66 41.66 2rpc h LEU 78 CO 0.06 1.15 0.65 0.58 -0.34 0.00 0.00 178.44 180.53 2rpc h VAL 79 N -0.99 0.53 -0.25 1.05 2.07 -1.17 0.35 116.25 117.84 2rpc h VAL 79 Ca -0.11 -0.16 -0.14 0.00 0.82 0.00 0.00 66.70 67.11 2rpc h VAL 79 Cb 1.10 0.02 -0.01 0.00 -1.52 0.00 0.00 31.29 30.88 2rpc h VAL 79 CO -0.06 0.08 -0.43 -0.55 0.02 0.00 0.00 177.57 176.64 2rpc h ASN 80 N 0.46 0.66 -0.67 0.57 7.08 -1.56 -3.12 115.58 119.01 2rpc h ASN 80 Ca 0.62 -0.31 0.02 0.00 -3.08 0.00 0.00 56.30 53.55 2rpc h ASN 80 Cb 1.41 -0.19 -0.04 0.00 -2.08 0.00 0.00 38.32 37.43 2rpc h ASN 80 CO -0.36 1.00 0.43 -0.74 -2.08 0.00 0.00 177.43 175.68 2rpc h HIS 81 N 0.50 0.81 -0.24 4.14 2.76 -0.32 -1.17 115.15 121.63 2rpc h HIS 81 Ca 0.04 0.02 0.07 0.00 -2.20 0.00 0.00 60.37 58.30 2rpc h HIS 81 Cb 0.95 -0.27 -0.01 0.00 1.55 0.00 0.00 27.41 29.64 2rpc h HIS 81 CO 0.04 0.48 0.35 0.82 -1.30 0.00 0.00 177.93 178.33 2rpc h ILE 82 N 0.86 0.28 0.00 6.26 2.04 -1.37 0.27 117.51 125.84 2rpc h ILE 82 Ca 0.26 0.00 -0.02 0.00 1.00 0.00 0.00 64.86 66.09 2rpc h ILE 82 Cb -0.04 0.70 -0.00 0.00 -0.74 0.00 0.00 36.82 36.74 2rpc h ILE 82 CO -0.08 0.00 -0.11 0.03 0.00 0.00 0.00 178.15 177.99 2rpc h ARG 83 N 0.00 0.00 0.00 2.37 2.47 -1.30 -1.55 114.38 116.38 2rpc h ARG 83 Ca 0.11 0.00 -0.04 0.00 -1.26 0.00 0.00 59.98 58.80 2rpc h ARG 83 Cb 0.81 0.00 -0.01 0.00 -1.65 0.00 0.00 29.97 29.13 2rpc h ARG 83 CO -0.00 0.11 -0.17 -0.39 0.56 0.00 0.00 179.97 180.08 2rpc h VAL 84 N 0.00 0.32 0.00 2.04 -1.51 -0.58 -2.80 116.25 113.71 2rpc h VAL 84 Ca -0.00 -1.28 -0.01 0.00 -1.23 0.00 0.00 66.70 64.19 2rpc h VAL 84 Cb 0.31 2.01 -0.00 0.00 -2.13 0.00 0.00 31.29 31.48 2rpc h VAL 84 CO 0.01 0.17 -0.03 0.45 -1.23 0.00 0.00 177.57 176.95 2rpc h HIS 85 N 0.00 0.00 0.00 5.19 3.86 -1.36 -3.32 115.15 119.52 2rpc h HIS 85 Ca -0.00 0.00 -0.13 0.00 -1.16 0.00 0.00 60.37 59.08 2rpc h HIS 85 Cb 0.99 0.00 -0.02 0.00 1.06 0.00 0.00 27.41 29.44 2rpc h HIS 85 CO 0.00 0.03 -1.10 0.25 0.86 0.00 0.00 177.93 177.97 2rpc n THR 86 N -3.12 1.48 0.00 2.45 -2.24 -1.16 -5.03 114.28 106.66 2rpc n THR 86 Ca 0.02 0.05 0.00 0.00 -2.27 0.00 0.00 64.05 61.85 2rpc n THR 86 Cb 0.40 -2.21 0.00 0.00 -2.10 0.00 0.00 70.33 66.41 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 1.49 1.52 3.77 3.38 0.00 -1.07 -5.11 105.19 109.17 2rpc n GLY 87 Ca -0.22 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.41 2rpc n GLY 87 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 2rpc s GLU 88 N 0.00 4.12 -0.02 1.61 -6.30 -1.26 -5.00 118.70 111.85 2rpc s GLU 88 Ca 0.00 1.86 -0.01 0.00 -2.50 0.00 0.00 54.97 54.32 2rpc s GLU 88 Cb 0.00 -2.74 -0.04 0.00 0.00 0.00 0.00 34.13 31.35 2rpc s GLU 88 CO 0.00 -0.27 0.07 0.15 0.02 0.00 0.00 175.26 175.23 2rpc s LYS 89 N -2.20 3.06 -0.02 4.30 -0.14 -1.26 -4.83 119.74 118.64 2rpc s LYS 89 Ca 0.56 -0.46 -0.25 0.00 -1.36 0.00 0.00 55.97 54.46 2rpc s LYS 89 Cb -0.31 -2.86 -0.19 0.00 -1.68 0.00 0.00 37.83 32.79 2rpc s LYS 89 CO 0.40 0.66 1.21 -1.00 -0.76 0.00 0.00 175.35 175.86 2rpc h PRO 90 N 4.34 -0.09 -2.32 -1.68 0.13 -1.81 -3.47 132.00 127.10 2rpc h PRO 90 Ca -0.50 0.01 -0.07 0.00 -0.87 0.00 0.00 66.00 64.57 2rpc h PRO 90 Cb 1.19 0.02 -0.23 0.00 0.13 0.00 0.00 31.00 32.11 2rpc h PRO 90 CO 0.60 0.37 -0.06 -0.59 -0.23 0.00 0.00 178.00 178.09 2rpc s PHE 91 N -4.21 -0.70 0.00 1.56 -0.12 -1.26 -5.16 117.98 108.09 2rpc s PHE 91 Ca -0.15 1.61 0.00 0.00 -0.05 0.00 0.00 56.93 58.34 2rpc s PHE 91 Cb 0.02 0.29 0.00 0.00 -0.63 0.00 0.00 43.02 42.69 2rpc s PHE 91 CO 0.63 -0.34 0.00 -0.35 -0.05 0.00 0.00 175.22 175.10 2rpc n PRO 92 N 3.18 -0.16 -3.44 1.99 -0.04 -1.26 -4.21 135.00 131.07 2rpc n PRO 92 Ca -0.16 0.00 -0.38 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 33.96 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 2.54 0.49 -3.88 0.00 -0.04 -1.26 -4.65 135.00 128.19 2rpc n PRO 94 Ca -0.11 0.00 -0.35 0.00 -0.04 0.00 0.00 63.50 62.99 2rpc n PRO 94 Cb 0.52 -1.34 -0.10 0.00 -0.04 0.00 0.00 33.50 32.54 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 3.23 -0.02 0.54 2.19 -1.26 -4.64 117.98 116.02 2rpc s PHE 95 Ca 0.16 0.02 -0.24 0.00 0.33 0.00 0.00 56.93 57.20 2rpc s PHE 95 Cb 0.07 -2.15 -0.18 0.00 -1.31 0.00 0.00 43.02 39.45 2rpc s PHE 95 CO 0.12 0.04 1.13 -1.00 1.83 0.00 0.00 175.22 177.35 2rpc h PRO 96 N 7.16 -0.20 0.00 10.12 0.13 -1.87 -2.16 132.00 145.18 2rpc h PRO 96 Ca -0.37 0.01 0.00 0.00 -0.87 0.00 0.00 66.00 64.77 2rpc h PRO 96 Cb 1.17 0.05 0.00 0.00 0.13 0.00 0.00 31.00 32.34 2rpc h PRO 96 CO 0.67 0.21 0.00 0.41 -0.23 0.00 0.00 178.00 179.06 2rpc n GLY 97 N 0.16 -0.43 0.12 1.56 0.00 -1.26 -2.92 105.19 102.43 2rpc n GLY 97 Ca -0.09 -0.05 -0.20 0.00 0.00 0.00 0.00 46.02 45.69 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 1.35 -0.18 3.89 0.00 0.00 -0.82 -4.96 105.19 104.48 2rpc n GLY 99 Ca -0.36 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.34 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 -4.79 3.64 -0.01 1.61 2.47 -1.26 -4.92 119.74 116.47 2rpc s LYS 100 Ca 0.00 -0.05 0.03 0.00 -1.56 0.00 0.00 55.97 54.39 2rpc s LYS 100 Cb 0.00 -2.88 -0.01 0.00 -1.46 0.00 0.00 37.83 33.48 2rpc s LYS 100 CO 0.00 0.49 -0.10 0.42 0.16 0.00 0.00 175.35 176.32 2rpc s ILE 101 N -1.60 0.82 0.10 5.43 1.01 -1.26 -0.16 121.20 125.55 2rpc s ILE 101 Ca 0.39 -0.44 0.08 0.00 0.00 0.00 0.00 60.65 60.69 2rpc s ILE 101 Cb -0.12 -0.70 -0.03 0.00 0.01 0.00 0.00 42.46 41.62 2rpc s ILE 101 CO 0.23 0.24 -0.22 -0.36 0.00 0.00 0.00 174.94 174.83 2rpc s PHE 102 N -0.19 1.84 -0.69 3.97 0.40 -1.26 -5.00 117.98 117.05 2rpc s PHE 102 Ca 0.03 -0.41 0.24 0.00 -0.60 0.00 0.00 56.93 56.19 2rpc s PHE 102 Cb -0.05 -1.02 0.33 0.00 0.51 0.00 0.00 43.02 42.80 2rpc s PHE 102 CO -0.00 0.21 1.29 0.00 0.70 0.00 0.00 175.22 177.42 2rpc n ALA 103 N 1.13 3.08 -2.94 5.36 0.00 -1.26 -4.12 120.51 121.76 2rpc n ALA 103 Ca -0.19 -0.29 -0.34 0.00 0.00 0.00 0.00 53.44 52.63 2rpc n ALA 103 Cb 0.53 -1.14 -0.12 0.00 0.00 0.00 0.00 19.45 18.72 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 -3.15 3.54 0.17 0.00 3.52 -1.26 -4.59 118.95 117.17 2rpc s ARG 104 Ca 0.07 -0.55 -0.13 0.00 -0.13 0.00 0.00 55.73 54.99 2rpc s ARG 104 Cb 0.14 -2.84 0.07 0.00 -1.56 0.00 0.00 34.95 30.76 2rpc s ARG 104 CO 0.73 0.28 1.74 0.77 -0.81 0.00 0.00 175.30 178.01 2rpc h SER 105 N 6.55 0.77 0.34 -2.12 0.02 -1.98 -1.97 113.55 115.16 2rpc h SER 105 Ca -0.32 -0.15 -0.02 0.00 -0.84 0.00 0.00 61.79 60.45 2rpc h SER 105 Cb 1.19 -0.20 -0.00 0.00 0.14 0.00 0.00 62.40 63.53 2rpc h SER 105 CO 0.61 0.71 -0.11 -0.08 -1.14 0.00 0.00 176.83 176.81 2rpc h GLU 106 N 0.78 0.00 -0.01 3.45 4.81 -2.00 -2.38 114.58 119.24 2rpc h GLU 106 Ca 0.19 0.00 -0.09 0.00 -0.13 0.00 0.00 59.36 59.33 2rpc h GLU 106 Cb 0.17 0.00 0.01 0.00 0.63 0.00 0.00 28.75 29.55 2rpc h GLU 106 CO -0.02 0.11 -0.36 -0.91 -0.73 0.00 0.00 179.01 177.10 2rpc h ASN 107 N 0.00 0.33 0.34 1.04 4.21 -1.80 -2.77 115.58 116.93 2rpc h ASN 107 Ca -0.00 -0.76 -0.02 0.00 1.21 0.00 0.00 56.30 56.73 2rpc h ASN 107 Cb 0.31 -0.10 0.00 0.00 -1.12 0.00 0.00 38.32 37.42 2rpc h ASN 107 CO 0.01 1.05 -0.16 0.25 -1.29 0.00 0.00 177.43 177.29 2rpc h LEU 108 N -0.36 -0.39 -0.30 1.61 5.85 -1.14 0.13 115.31 120.72 2rpc h LEU 108 Ca -0.04 0.01 0.06 0.00 0.84 0.00 0.00 57.88 58.75 2rpc h LEU 108 Cb 1.10 0.10 -0.06 0.00 0.37 0.00 0.00 40.66 42.17 2rpc h LEU 108 CO 0.07 -0.28 -0.08 0.07 -0.34 0.00 0.00 178.44 177.89 2rpc h LYS 109 N -0.46 -0.01 0.00 1.25 2.10 -1.56 0.39 116.57 118.29 2rpc h LYS 109 Ca -0.05 0.00 -0.04 0.00 -2.00 0.00 0.00 60.65 58.57 2rpc h LYS 109 Cb 0.35 0.00 -0.01 0.00 -0.90 0.00 0.00 32.23 31.68 2rpc h LYS 109 CO 0.08 -0.00 -0.18 0.82 -2.00 0.00 0.00 179.45 178.16 2rpc h ILE 110 N -0.01 0.91 0.00 0.07 2.04 -1.35 -1.18 117.51 117.99 2rpc h ILE 110 Ca 0.15 -0.67 -0.05 0.00 1.00 0.00 0.00 64.86 65.28 2rpc h ILE 110 Cb 0.23 1.39 -0.01 0.00 -0.74 0.00 0.00 36.82 37.69 2rpc h ILE 110 CO -0.32 0.18 -0.41 -0.74 0.00 0.00 0.00 178.15 176.86 2rpc h HIS 111 N 0.00 0.00 0.05 1.37 2.76 0.11 -3.20 115.15 116.24 2rpc h HIS 111 Ca -0.00 0.00 -0.27 0.00 -2.20 0.00 0.00 60.37 57.90 2rpc h HIS 111 Cb 0.37 0.00 -0.03 0.00 1.55 0.00 0.00 27.41 29.31 2rpc h HIS 111 CO 0.00 0.24 -1.40 0.87 -1.30 0.00 0.00 177.93 176.34 2rpc h LYS 112 N 0.00 0.10 0.00 5.26 1.57 0.55 -3.25 116.57 120.81 2rpc h LYS 112 Ca -0.01 -0.17 0.00 0.00 -1.87 0.00 0.00 60.65 58.59 2rpc h LYS 112 Cb 1.19 0.06 0.00 0.00 0.08 0.00 0.00 32.23 33.57 2rpc h LYS 112 CO 0.03 0.92 0.00 0.07 -0.57 0.00 0.00 179.45 179.90 2rpc h ARG 113 N 0.03 0.00 0.00 3.15 0.11 -1.32 -2.81 114.38 113.54 2rpc h ARG 113 Ca -0.18 0.00 0.00 0.00 0.10 0.00 0.00 59.98 59.90 2rpc h ARG 113 Cb 1.93 0.00 0.00 0.00 1.11 0.00 0.00 29.97 33.01 2rpc h ARG 113 CO 0.13 0.00 -0.73 -2.37 0.10 0.00 0.00 179.97 177.10 2rpc n THR 114 N -2.31 0.01 0.02 0.08 5.66 -1.21 -4.28 114.28 112.26 2rpc n THR 114 Ca 0.04 -0.02 -0.12 0.00 -3.05 0.00 0.00 64.05 60.90 2rpc n THR 114 Cb 0.34 0.54 -0.07 0.00 -1.55 0.00 0.00 70.33 69.59 2rpc n THR 114 CO 0.00 0.00 0.00 0.45 -3.05 0.00 0.00 175.07 172.47 2rpc h HIS 115 N 0.00 0.05 -1.27 1.09 3.86 -1.52 -3.46 115.15 113.90 2rpc h HIS 115 Ca 0.00 0.00 0.16 0.00 -1.16 0.00 0.00 60.37 59.37 2rpc h HIS 115 Cb 0.52 -0.02 -0.28 0.00 1.06 0.00 0.00 27.41 28.69 2rpc h HIS 115 CO 0.00 0.07 0.75 0.99 0.86 0.00 0.00 177.93 180.60 2rpc s THR 116 N -6.03 0.00 0.12 2.45 2.01 -1.26 -5.06 115.64 107.87 2rpc s THR 116 Ca -0.13 0.00 -0.22 0.00 0.31 0.00 0.00 61.69 61.65 2rpc s THR 116 Cb 0.06 -1.00 -0.04 0.00 0.01 0.00 0.00 72.50 71.53 2rpc s THR 116 CO 0.67 0.00 1.69 1.23 -0.69 0.00 0.00 174.62 177.51 2rpc h GLY 117 N 2.94 -0.03 -2.52 4.40 0.00 -1.90 -3.43 103.07 102.53 2rpc h GLY 117 Ca -0.20 0.13 -0.49 0.00 0.00 0.00 0.00 47.33 46.76 2rpc h GLY 117 CO 0.20 -0.12 -0.02 -0.54 0.00 0.00 0.00 176.54 176.06 2rpc s GLU 118 N -6.17 3.58 0.15 4.80 2.02 -1.26 -5.08 118.70 116.75 2rpc s GLU 118 Ca -0.14 0.06 -0.16 0.00 0.02 0.00 0.00 54.97 54.75 2rpc s GLU 118 Cb 0.10 -2.51 -0.07 0.00 0.10 0.00 0.00 34.13 31.74 2rpc s GLU 118 CO 0.67 0.00 0.59 0.15 0.02 0.00 0.00 175.26 176.70 2rpc s LYS 119 N -4.23 4.08 0.45 1.61 3.01 -1.26 -4.98 119.74 118.42 2rpc s LYS 119 Ca 0.45 0.62 0.24 0.00 -1.01 0.00 0.00 55.97 56.27 2rpc s LYS 119 Cb -0.10 -2.98 1.00 0.00 -1.01 0.00 0.00 37.83 34.74 2rpc s LYS 119 CO 0.37 0.49 1.87 -1.00 0.51 0.00 0.00 175.35 177.59 2rpc h PRO 120 N 3.72 0.00 -3.92 -1.68 0.13 -1.93 -3.40 132.00 124.92 2rpc h PRO 120 Ca -0.49 0.00 -0.57 0.00 -0.87 0.00 0.00 66.00 64.08 2rpc h PRO 120 Cb 1.20 0.00 -0.39 0.00 0.13 0.00 0.00 31.00 31.94 2rpc h PRO 120 CO 0.65 0.23 -0.77 -0.06 -0.23 0.00 0.00 178.00 177.82 2rpc s PHE 121 N -3.80 1.76 -0.08 1.56 0.08 -0.89 -5.01 117.98 111.61 2rpc s PHE 121 Ca -0.01 -1.40 0.02 0.00 0.12 0.00 0.00 56.93 55.66 2rpc s PHE 121 Cb 0.11 -1.39 -0.02 0.00 -0.57 0.00 0.00 43.02 41.15 2rpc s PHE 121 CO 0.63 -0.72 -0.13 0.21 -0.10 0.00 0.00 175.22 175.12 2rpc s LYS 122 N 1.61 2.80 -0.28 0.44 2.36 -1.26 0.98 119.74 126.39 2rpc s LYS 122 Ca -0.02 -0.67 -0.36 0.00 -2.55 0.00 0.00 55.97 52.38 2rpc s LYS 122 Cb -0.18 -2.49 -0.12 0.00 -1.05 0.00 0.00 37.83 33.99 2rpc s LYS 122 CO -0.09 0.51 2.03 0.00 1.55 0.00 0.00 175.35 179.35 2rpc n GLU 124 N 7.27 0.25 -2.42 0.00 1.02 -1.26 -4.68 120.64 120.82 2rpc n GLU 124 Ca 0.34 0.11 -0.43 0.00 -0.02 0.00 0.00 57.16 57.17 2rpc n GLU 124 Cb 0.22 -1.50 -0.02 0.00 -0.02 0.00 0.00 31.44 30.12 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 -2.39 2.86 0.63 -0.32 5.36 -1.26 -5.00 117.98 117.86 2rpc s PHE 125 Ca 0.14 1.01 -0.18 0.00 -0.96 0.00 0.00 56.93 56.94 2rpc s PHE 125 Cb 0.09 -3.51 -0.02 0.00 -0.34 0.00 0.00 43.02 39.24 2rpc s PHE 125 CO 0.18 -1.72 1.22 -2.00 -1.46 0.00 0.00 175.22 171.44 2rpc s GLU 126 N 3.37 2.75 -1.06 10.12 -6.30 -1.26 -2.49 118.70 123.82 2rpc s GLU 126 Ca 0.55 1.85 0.00 0.00 -2.50 0.00 0.00 54.97 54.87 2rpc s GLU 126 Cb -0.22 -1.90 0.00 0.00 0.00 0.00 0.00 34.13 32.01 2rpc s GLU 126 CO 0.16 -1.39 0.00 0.41 0.02 0.00 0.00 175.26 174.46 2rpc n GLY 127 N 0.53 1.03 3.36 -1.50 0.00 -1.26 -4.97 105.19 102.38 2rpc n GLY 127 Ca 0.14 -0.11 -0.32 0.00 0.00 0.00 0.00 46.02 45.73 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 -0.41 4.88 0.20 0.00 1.47 -1.26 -4.91 116.67 116.64 2rpc s ASP 129 Ca 0.04 -1.62 -0.04 0.00 1.18 0.00 0.00 52.55 52.11 2rpc s ASP 129 Cb -0.12 -1.70 0.02 0.00 -0.34 0.00 0.00 42.92 40.78 2rpc s ASP 129 CO 0.02 -0.33 0.33 0.54 0.68 0.00 0.00 175.17 176.40 2rpc n ARG 130 N 4.52 0.47 -3.58 2.11 5.12 -1.26 -5.09 116.66 118.95 2rpc n ARG 130 Ca -0.08 -1.36 -0.16 0.00 -1.93 0.00 0.00 57.85 54.32 2rpc n ARG 130 Cb 0.42 1.45 -0.06 0.00 -1.16 0.00 0.00 32.46 33.11 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 -2.27 0.98 0.16 5.56 1.04 -1.26 -4.38 118.95 118.78 2rpc s ARG 131 Ca 0.13 0.00 -0.12 0.00 -1.04 0.00 0.00 55.73 54.70 2rpc s ARG 131 Cb -0.01 0.46 0.01 0.00 -2.04 0.00 0.00 34.95 33.36 2rpc s ARG 131 CO 0.09 -0.32 0.34 -0.06 -0.04 0.00 0.00 175.30 175.31 2rpc s PHE 132 N -1.67 0.18 -0.07 5.89 0.08 0.27 -4.94 117.98 117.72 2rpc s PHE 132 Ca -0.09 -0.54 0.03 0.00 0.12 0.00 0.00 56.93 56.44 2rpc s PHE 132 Cb -0.01 0.09 -0.04 0.00 -0.57 0.00 0.00 43.02 42.48 2rpc s PHE 132 CO 0.05 -0.75 0.10 0.00 -0.10 0.00 0.00 175.22 174.51 2rpc n ALA 133 N -0.23 2.24 -3.75 5.36 0.00 -1.26 -2.10 120.51 120.77 2rpc n ALA 133 Ca -0.10 -0.08 -0.16 0.00 0.00 0.00 0.00 53.44 53.11 2rpc n ALA 133 Cb 0.63 -0.11 -0.16 0.00 0.00 0.00 0.00 19.45 19.81 2rpc n ALA 133 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 2rpc s ASN 134 N -1.89 0.22 0.44 0.00 2.20 -1.26 -4.79 114.94 109.85 2rpc s ASN 134 Ca -0.00 0.02 0.31 0.00 -0.94 0.00 0.00 52.86 52.25 2rpc s ASN 134 Cb 0.02 -0.11 1.44 0.00 -2.00 0.00 0.00 41.25 40.60 2rpc s ASN 134 CO 0.13 -0.13 1.62 -1.28 -2.94 0.00 0.00 177.10 174.50 2rpc h SER 135 N 7.35 0.23 -0.48 3.54 0.87 -1.96 0.66 113.55 123.76 2rpc h SER 135 Ca -0.43 0.13 0.06 0.00 -1.23 0.00 0.00 61.79 60.32 2rpc h SER 135 Cb 1.12 0.13 -0.05 0.00 -0.44 0.00 0.00 62.40 63.16 2rpc h SER 135 CO 0.46 -0.18 0.18 0.28 -0.53 0.00 0.00 176.83 177.04 2rpc h SER 136 N 0.08 0.20 -0.24 6.23 0.02 -1.98 0.12 113.55 117.98 2rpc h SER 136 Ca 0.83 0.05 -0.04 0.00 -0.84 0.00 0.00 61.79 61.79 2rpc h SER 136 Cb 2.63 0.03 -0.01 0.00 0.14 0.00 0.00 62.40 65.19 2rpc h SER 136 CO -0.41 0.15 -0.01 -0.78 -1.14 0.00 0.00 176.83 174.64 2rpc h ASP 137 N 0.37 0.42 -0.22 3.07 3.58 -0.09 -1.13 116.42 122.41 2rpc h ASP 137 Ca 0.23 -0.32 0.00 0.00 0.42 0.00 0.00 57.03 57.36 2rpc h ASP 137 Cb 0.22 -0.11 -0.01 0.00 1.72 0.00 0.00 39.33 41.15 2rpc h ASP 137 CO -0.22 0.64 0.14 -0.09 -2.88 0.00 0.00 179.24 176.83 2rpc h ARG 138 N 0.19 0.30 0.00 0.28 2.43 -1.04 -0.67 114.38 115.87 2rpc h ARG 138 Ca 0.07 -0.02 -0.05 0.00 -0.81 0.00 0.00 59.98 59.17 2rpc h ARG 138 Cb 0.43 -0.07 -0.01 0.00 -0.42 0.00 0.00 29.97 29.91 2rpc h ARG 138 CO 0.01 0.20 -0.35 0.87 -1.51 0.00 0.00 179.97 179.20 2rpc h LYS 139 N 0.31 0.00 0.00 0.20 1.57 -0.55 -3.21 116.57 114.88 2rpc h LYS 139 Ca 0.08 0.00 -0.02 0.00 -1.87 0.00 0.00 60.65 58.84 2rpc h LYS 139 Cb -0.03 0.00 -0.00 0.00 0.08 0.00 0.00 32.23 32.28 2rpc h LYS 139 CO -0.02 0.20 -0.13 0.87 -0.57 0.00 0.00 179.45 179.81 2rpc h LYS 140 N 0.00 0.00 -0.01 3.15 1.57 0.16 -3.11 116.57 118.33 2rpc h LYS 140 Ca -0.01 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.77 2rpc h LYS 140 Cb 1.18 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.49 2rpc h LYS 140 CO 0.03 0.10 -0.07 1.58 -0.57 0.00 0.00 179.45 180.52 2rpc n HIS 141 N -3.11 0.00 0.11 -1.35 -0.00 -0.75 -3.42 115.22 106.70 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 0.57 -0.10 0.01 0.00 -0.12 0.00 0.00 29.99 30.35 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 0.86 0.00 -0.02 1.57 2.86 -1.64 -3.32 114.93 115.24 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 0.32 0.00 -0.00 0.00 0.06 0.00 0.00 31.60 31.98 2rpc h MET 142 CO 0.00 0.08 0.21 1.12 1.06 0.00 0.00 176.91 179.38 2rpc h HIS 143 N 0.00 0.00 0.00 -0.22 -0.00 -1.71 0.32 115.15 113.54 2rpc h HIS 143 Ca -0.03 0.00 0.00 0.00 -0.00 0.00 0.00 60.37 60.34 2rpc h HIS 143 Cb 1.13 0.00 0.00 0.00 -0.00 0.00 0.00 27.41 28.54 2rpc h HIS 143 CO 0.00 0.00 -1.57 1.55 -0.00 0.00 0.00 177.93 177.91 2rpc n VAL 144 N -3.02 0.05 0.09 6.12 3.14 -1.25 -4.27 118.33 119.19 2rpc n VAL 144 Ca -0.02 -0.34 -0.13 0.00 -2.96 0.00 0.00 64.34 60.89 2rpc n VAL 144 Cb 0.27 0.27 -0.09 0.00 -1.06 0.00 0.00 33.84 33.22 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 0.38 -0.13 1.45 3.86 -0.53 -3.22 115.15 116.97 2rpc h HIS 145 Ca 0.00 -0.25 0.04 0.00 -1.16 0.00 0.00 60.37 58.99 2rpc h HIS 145 Cb 0.84 -0.03 -0.01 0.00 1.06 0.00 0.00 27.41 29.28 2rpc h HIS 145 CO 0.00 1.15 0.49 1.15 0.86 0.00 0.00 177.93 181.58 2rpc h THR 146 N 0.09 0.07 -2.38 2.45 2.02 -1.58 -3.37 112.91 110.21 2rpc h THR 146 Ca -0.09 0.00 -0.05 0.00 0.77 0.00 0.00 66.41 67.04 2rpc h THR 146 Cb 1.79 0.54 -0.25 0.00 -1.74 0.00 0.00 68.15 68.49 2rpc h THR 146 CO 0.17 0.00 -0.25 -0.44 0.37 0.00 0.00 175.52 175.37 2rpc s SER 147 N -4.36 -0.58 0.29 4.18 0.01 -1.22 -5.15 113.70 106.88 2rpc s SER 147 Ca -0.03 1.15 -0.29 0.00 1.31 0.00 0.00 55.95 58.09 2rpc s SER 147 Cb 0.09 1.39 -0.10 0.00 0.21 0.00 0.00 66.02 67.61 2rpc s SER 147 CO 0.30 -0.22 1.13 -1.81 0.41 0.00 0.00 173.24 173.05 2rpc s ASP 148 N 2.22 7.16 0.14 2.44 1.01 -1.26 -4.85 116.67 123.54 2rpc s ASP 148 Ca -0.06 2.34 0.09 0.00 0.71 0.00 0.00 52.55 55.63 2rpc s ASP 148 Cb -0.10 -2.63 -0.04 0.00 1.01 0.00 0.00 42.92 41.16 2rpc s ASP 148 CO -0.15 -0.22 -0.21 -0.75 0.21 0.00 0.00 175.17 174.05 2rpc s LYS 149 N -1.54 1.27 0.57 8.23 2.47 -1.26 -5.02 119.74 124.46 2rpc s LYS 149 Ca 0.46 -1.33 0.26 0.00 -1.56 0.00 0.00 55.97 53.79 2rpc s LYS 149 Cb -0.33 -1.49 1.58 0.00 -1.46 0.00 0.00 37.83 36.13 2rpc s LYS 149 CO 0.43 0.33 2.14 1.03 0.16 0.00 0.00 175.35 179.43 2rpc h SER 150 N 3.61 0.00 -5.08 1.43 0.87 -2.03 -3.44 113.55 108.91 2rpc h SER 150 Ca -0.45 0.00 -0.01 0.00 -1.23 0.00 0.00 61.79 60.10 2rpc h SER 150 Cb 1.19 0.00 -0.09 0.00 -0.44 0.00 0.00 62.40 63.06 2rpc h SER 150 CO 0.45 0.00 0.07 -0.83 -0.53 0.00 0.00 176.83 175.99 2rpc s GLY 151 N -4.04 -0.06 0.15 5.77 0.00 -1.26 -5.14 107.32 102.73 2rpc s GLY 151 Ca -0.05 -0.27 -0.31 0.00 0.00 0.00 0.00 44.72 44.10 2rpc s GLY 151 CO 0.60 -0.24 1.34 2.56 0.00 0.00 0.00 173.10 177.36 2rpc s PRO 152 N -3.89 4.36 -0.42 2.90 0.04 -1.26 -5.00 135.00 131.72 2rpc s PRO 152 Ca 0.11 2.04 -0.15 0.00 0.04 0.00 0.00 61.00 63.03 2rpc s PRO 152 Cb -0.02 -3.23 0.03 0.00 0.04 0.00 0.00 34.50 31.32 2rpc s PRO 152 CO -0.00 -0.34 0.33 -1.54 0.04 0.00 0.00 177.00 175.48 2rpc s SER 153 N 0.78 6.12 -1.45 6.66 1.04 -1.26 -4.42 113.70 121.17 2rpc s SER 153 Ca 0.61 -1.00 -0.12 0.00 0.48 0.00 0.00 55.95 55.93 2rpc s SER 153 Cb -0.36 -2.17 0.05 0.00 0.10 0.00 0.00 66.02 63.64 2rpc s SER 153 CO 0.33 -0.50 1.09 -0.24 0.98 0.00 0.00 173.24 174.90 2rpc n SER 154 N 5.18 -5.63 0.00 7.02 2.88 -1.26 -5.18 113.62 116.63 2rpc n SER 154 Ca -0.11 -0.66 0.15 0.00 -1.33 0.00 0.00 58.87 56.92 2rpc n SER 154 Cb 0.46 -4.45 0.89 0.00 -0.75 0.00 0.00 64.21 60.36 2rpc n SER 154 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42