#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 2.06 -0.27 1.61 0.01 -1.26 -5.11 113.70 110.75 2rpc s SER 2 Ca 0.00 -0.47 -0.29 0.00 1.31 0.00 0.00 55.95 56.50 2rpc s SER 2 Cb 0.00 -0.16 0.00 0.00 0.21 0.00 0.00 66.02 66.07 2rpc s SER 2 CO 0.00 0.11 1.25 -0.94 0.41 0.00 0.00 173.24 174.06 2rpc s SER 3 N -1.10 6.79 0.15 2.44 1.04 -1.26 -5.01 113.70 116.76 2rpc s SER 3 Ca 0.05 1.30 0.04 0.00 0.48 0.00 0.00 55.95 57.82 2rpc s SER 3 Cb -0.08 -2.54 -0.04 0.00 0.10 0.00 0.00 66.02 63.45 2rpc s SER 3 CO 0.01 -0.96 -0.09 -0.83 0.98 0.00 0.00 173.24 172.36 2rpc s GLY 4 N 2.36 1.08 1.03 7.32 0.00 -1.26 -5.16 107.32 112.69 2rpc s GLY 4 Ca 0.54 -1.50 -0.17 0.00 0.00 0.00 0.00 44.72 43.58 2rpc s GLY 4 CO 0.19 -1.58 1.28 -0.45 0.00 0.00 0.00 173.10 172.54 2rpc s SER 5 N -3.17 2.46 -0.19 1.64 0.15 -1.26 -5.07 113.70 108.26 2rpc s SER 5 Ca 0.17 0.31 -0.01 0.00 0.70 0.00 0.00 55.95 57.12 2rpc s SER 5 Cb 0.03 -0.36 0.05 0.00 -1.71 0.00 0.00 66.02 64.04 2rpc s SER 5 CO 0.01 -3.14 -0.02 -0.55 1.20 0.00 0.00 173.24 170.74 2rpc s SER 6 N -4.69 3.05 1.15 5.45 0.15 -1.26 -5.14 113.70 112.41 2rpc s SER 6 Ca 0.74 -0.81 -0.13 0.00 0.70 0.00 0.00 55.95 56.45 2rpc s SER 6 Cb -0.04 -0.85 0.19 0.00 -1.71 0.00 0.00 66.02 63.60 2rpc s SER 6 CO 0.54 -0.24 0.71 0.61 1.20 0.00 0.00 173.24 176.06 2rpc n GLY 7 N 4.89 -2.57 3.88 9.45 0.00 -1.26 -5.04 105.19 114.55 2rpc n GLY 7 Ca -0.11 -1.49 -0.33 0.00 0.00 0.00 0.00 46.02 44.10 2rpc n GLY 7 CO 0.00 0.00 0.00 -0.86 0.00 0.00 0.00 173.32 172.46 2rpc s GLN 8 N -4.60 3.73 0.35 1.61 0.00 -1.26 -5.07 119.66 114.42 2rpc s GLN 8 Ca 0.45 0.12 -0.28 0.00 -0.00 0.00 0.00 55.36 55.66 2rpc s GLN 8 Cb -0.04 -2.82 -0.09 0.00 0.00 0.00 0.00 33.01 30.05 2rpc s GLN 8 CO 0.35 0.44 1.21 -1.25 0.00 0.00 0.00 175.29 176.04 2rpc s PRO 9 N -2.50 4.30 -0.08 9.60 0.04 -1.26 -5.04 135.00 140.05 2rpc s PRO 9 Ca 0.41 1.99 -0.02 0.00 0.04 0.00 0.00 61.00 63.42 2rpc s PRO 9 Cb -0.12 -2.95 -0.03 0.00 0.04 0.00 0.00 34.50 31.44 2rpc s PRO 9 CO 0.22 -0.16 0.01 0.42 0.04 0.00 0.00 177.00 177.53 2rpc s ILE 10 N -1.24 4.35 -0.52 0.56 1.01 -1.26 -5.08 121.20 119.02 2rpc s ILE 10 Ca 0.51 -0.24 -0.17 0.00 0.00 0.00 0.00 60.65 60.75 2rpc s ILE 10 Cb -0.35 -2.83 0.09 0.00 0.01 0.00 0.00 42.46 39.37 2rpc s ILE 10 CO 0.45 0.60 0.54 -0.54 0.00 0.00 0.00 174.94 175.99 2rpc s LYS 11 N -0.91 3.03 -0.02 2.79 1.02 -1.26 -4.93 119.74 119.46 2rpc s LYS 11 Ca 0.14 -1.30 -0.01 0.00 0.02 0.00 0.00 55.97 54.81 2rpc s LYS 11 Cb -0.11 -4.18 -0.04 0.00 -0.52 0.00 0.00 37.83 32.97 2rpc s LYS 11 CO 0.03 -1.24 0.11 -0.65 -0.92 0.00 0.00 175.35 172.67 2rpc s GLN 12 N 2.09 3.18 -0.32 1.68 -1.52 -0.93 -5.07 119.66 118.77 2rpc s GLN 12 Ca 0.08 -0.42 -0.12 0.00 -1.95 0.00 0.00 55.36 52.95 2rpc s GLN 12 Cb -0.24 -2.94 -0.02 0.00 -0.22 0.00 0.00 33.01 29.59 2rpc s GLN 12 CO 0.07 0.67 0.22 -1.83 -0.25 0.00 0.00 175.29 174.16 2rpc s GLU 13 N -1.70 3.59 0.38 2.91 -1.05 -1.25 -3.71 118.70 117.88 2rpc s GLU 13 Ca 0.23 -0.57 0.08 0.00 -0.15 0.00 0.00 54.97 54.56 2rpc s GLU 13 Cb -0.12 -3.74 -0.02 0.00 -0.44 0.00 0.00 34.13 29.81 2rpc s GLU 13 CO 0.14 -0.37 0.35 -0.51 0.95 0.00 0.00 175.26 175.82 2rpc s LEU 14 N 1.72 3.49 -0.02 1.83 1.43 -0.95 -4.92 118.68 121.25 2rpc s LEU 14 Ca 0.06 -0.63 -0.05 0.00 -1.03 0.00 0.00 54.13 52.48 2rpc s LEU 14 Cb -0.17 -2.14 0.01 0.00 0.03 0.00 0.00 46.19 43.91 2rpc s LEU 14 CO 0.10 -0.53 0.12 -0.44 0.23 0.00 0.00 176.35 175.82 2rpc s SER 15 N -4.08 -0.04 -0.32 2.29 0.01 -1.26 -3.17 113.70 107.12 2rpc s SER 15 Ca 0.45 0.03 0.03 0.00 1.31 0.00 0.00 55.95 57.77 2rpc s SER 15 Cb -0.05 0.23 0.09 0.00 0.21 0.00 0.00 66.02 66.50 2rpc s SER 15 CO 0.28 -0.18 0.03 0.00 0.41 0.00 0.00 173.24 173.78 2rpc s LYS 17 N 1.11 3.12 -0.37 0.00 -0.14 -1.26 -4.09 119.74 118.10 2rpc s LYS 17 Ca 0.07 -1.25 -0.09 0.00 -1.36 0.00 0.00 55.97 53.34 2rpc s LYS 17 Cb -0.19 -4.31 0.05 0.00 -1.68 0.00 0.00 37.83 31.70 2rpc s LYS 17 CO -0.11 -1.63 0.18 -0.46 -0.76 0.00 0.00 175.35 172.57 2rpc s TRP 18 N 3.00 3.28 -0.39 3.18 -0.11 -1.26 -3.19 118.94 123.44 2rpc s TRP 18 Ca 0.16 -1.30 -0.05 0.00 1.22 0.00 0.00 56.10 56.13 2rpc s TRP 18 Cb -0.20 -2.52 0.09 0.00 -1.50 0.00 0.00 33.47 29.33 2rpc s TRP 18 CO 0.06 -0.74 0.19 0.42 -4.62 0.00 0.00 176.95 172.26 2rpc s ILE 19 N 1.46 3.59 0.24 5.86 1.01 -0.15 -1.67 121.20 131.54 2rpc s ILE 19 Ca 0.01 -1.70 -0.30 0.00 0.00 0.00 0.00 60.65 58.67 2rpc s ILE 19 Cb -0.20 -3.29 -0.09 0.00 0.01 0.00 0.00 42.46 38.89 2rpc s ILE 19 CO 0.04 -0.52 1.12 -1.81 0.00 0.00 0.00 174.94 173.76 2rpc s ASP 20 N 1.86 7.24 0.00 3.58 1.11 -1.26 -4.46 116.67 124.73 2rpc s ASP 20 Ca 0.04 2.22 0.00 0.00 0.18 0.00 0.00 52.55 54.99 2rpc s ASP 20 Cb -0.22 -2.62 0.00 0.00 1.07 0.00 0.00 42.92 41.15 2rpc s ASP 20 CO -0.01 -0.20 0.87 -0.62 1.18 0.00 0.00 175.17 176.39 2rpc n GLU 21 N 1.70 0.00 -0.82 8.23 1.02 -1.26 -2.73 120.64 126.79 2rpc n GLU 21 Ca 0.01 0.49 -0.11 0.00 -0.02 0.00 0.00 57.16 57.52 2rpc n GLU 21 Cb 0.45 -1.37 -0.00 0.00 -0.02 0.00 0.00 31.44 30.50 2rpc n GLU 21 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 2rpc n ALA 22 N -1.82 4.94 -1.03 0.62 0.00 -1.26 -4.95 120.51 117.01 2rpc n ALA 22 Ca 0.00 -1.21 -0.33 0.00 0.00 0.00 0.00 53.44 51.90 2rpc n ALA 22 Cb 0.00 -1.39 0.14 0.00 0.00 0.00 0.00 19.45 18.20 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 0.98 0.07 0.00 0.00 10.64 -1.10 -4.90 117.38 123.06 2rpc n GLN 23 Ca 0.22 0.10 0.14 0.00 -1.83 0.00 0.00 57.00 55.64 2rpc n GLN 23 Cb 0.58 -2.42 0.63 0.00 -0.86 0.00 0.00 30.24 28.16 2rpc n GLN 23 CO 0.00 0.00 0.00 -0.11 -1.83 0.00 0.00 177.06 175.12 2rpc n LEU 24 N -3.43 0.36 -4.84 2.61 7.94 -1.26 -4.84 117.00 113.54 2rpc n LEU 24 Ca 0.13 0.08 -0.27 0.00 -1.11 0.00 0.00 56.01 54.84 2rpc n LEU 24 Cb 0.51 -0.21 -0.05 0.00 0.53 0.00 0.00 43.42 44.19 2rpc n LEU 24 CO 0.48 0.07 -0.18 -0.55 -1.11 0.00 0.00 177.39 176.10 2rpc s SER 25 N -2.53 5.79 -0.17 1.96 0.15 -1.26 -5.12 113.70 112.51 2rpc s SER 25 Ca 0.28 -0.02 -0.16 0.00 0.70 0.00 0.00 55.95 56.75 2rpc s SER 25 Cb 0.20 -1.60 0.05 0.00 -1.71 0.00 0.00 66.02 62.96 2rpc s SER 25 CO 0.48 0.08 0.47 -0.60 1.20 0.00 0.00 173.24 174.87 2rpc s ARG 26 N -3.06 0.55 1.07 5.44 6.06 -1.26 -4.26 118.95 123.49 2rpc s ARG 26 Ca 0.32 0.64 -0.15 0.00 -2.50 0.00 0.00 55.73 54.05 2rpc s ARG 26 Cb -0.11 0.27 0.23 0.00 0.06 0.00 0.00 34.95 35.40 2rpc s ARG 26 CO 0.25 -0.07 1.10 -1.25 -2.50 0.00 0.00 175.30 172.83 2rpc s PRO 27 N 0.23 -0.18 -0.47 5.12 0.04 -1.26 -5.00 135.00 133.49 2rpc s PRO 27 Ca -0.00 0.31 -0.37 0.00 0.04 0.00 0.00 61.00 60.98 2rpc s PRO 27 Cb -0.03 -1.68 -0.14 0.00 0.04 0.00 0.00 34.50 32.68 2rpc s PRO 27 CO 0.01 -3.09 2.24 1.63 0.04 0.00 0.00 177.00 177.83 2rpc n LYS 28 N -4.39 0.65 -3.99 4.56 4.76 -1.26 -4.92 118.16 113.57 2rpc n LYS 28 Ca 0.07 0.16 -0.22 0.00 -2.87 0.00 0.00 58.31 55.45 2rpc n LYS 28 Cb 0.58 -2.14 -0.05 0.00 -1.84 0.00 0.00 35.03 31.58 2rpc n LYS 28 CO 0.00 0.00 0.00 -1.59 -1.37 0.00 0.00 177.40 174.44 2rpc s LYS 29 N 6.58 2.49 0.08 1.97 0.00 -1.26 -5.06 119.74 124.54 2rpc s LYS 29 Ca 1.15 -1.47 0.06 0.00 0.00 0.00 0.00 55.97 55.71 2rpc s LYS 29 Cb -1.05 -2.28 -0.04 0.00 0.00 0.00 0.00 37.83 34.47 2rpc s LYS 29 CO 0.53 0.09 -0.10 -1.54 0.00 0.00 0.00 175.35 174.33 2rpc s SER 30 N -3.90 4.40 0.31 0.03 1.04 -1.26 -4.07 113.70 110.24 2rpc s SER 30 Ca 0.39 -0.34 -0.29 0.00 0.48 0.00 0.00 55.95 56.19 2rpc s SER 30 Cb -0.03 -0.87 -0.13 0.00 0.10 0.00 0.00 66.02 65.09 2rpc s SER 30 CO 0.24 0.20 1.25 0.00 0.98 0.00 0.00 173.24 175.92 2rpc s ASP 32 N -0.24 5.36 -0.16 0.00 2.15 -1.26 -4.24 116.67 118.28 2rpc s ASP 32 Ca 0.59 -0.12 -0.35 0.00 0.43 0.00 0.00 52.55 53.10 2rpc s ASP 32 Cb -0.61 -1.96 0.15 0.00 -0.30 0.00 0.00 42.92 40.20 2rpc s ASP 32 CO 0.59 0.01 1.39 -0.60 -0.17 0.00 0.00 175.17 176.39 2rpc s ARG 33 N 1.35 0.09 0.26 4.34 3.52 -1.26 -5.05 118.95 122.19 2rpc s ARG 33 Ca 0.05 -0.04 -0.05 0.00 -0.13 0.00 0.00 55.73 55.57 2rpc s ARG 33 Cb -0.15 0.03 -0.02 0.00 -1.56 0.00 0.00 34.95 33.26 2rpc s ARG 33 CO 0.04 -0.04 0.34 0.95 -0.81 0.00 0.00 175.30 175.78 2rpc s THR 34 N -2.10 0.00 0.18 4.11 -4.23 -1.26 -3.85 115.64 108.48 2rpc s THR 34 Ca 0.13 -1.71 -0.15 0.00 -1.18 0.00 0.00 61.69 58.79 2rpc s THR 34 Cb 0.04 -2.44 0.02 0.00 1.34 0.00 0.00 72.50 71.46 2rpc s THR 34 CO -0.05 0.00 0.43 -0.36 -0.54 0.00 0.00 174.62 174.10 2rpc s PHE 35 N -3.79 0.03 -0.16 3.99 0.40 -1.19 -4.93 117.98 112.34 2rpc s PHE 35 Ca 0.32 -0.38 0.14 0.00 -0.60 0.00 0.00 56.93 56.40 2rpc s PHE 35 Cb 0.02 0.23 -0.24 0.00 0.51 0.00 0.00 43.02 43.55 2rpc s PHE 35 CO 0.14 -0.83 0.22 -1.13 0.70 0.00 0.00 175.22 174.33 2rpc n SER 36 N -0.28 0.52 -4.36 1.36 3.41 -1.24 -2.23 113.62 110.80 2rpc n SER 36 Ca -0.10 0.11 -0.20 0.00 -0.26 0.00 0.00 58.87 58.42 2rpc n SER 36 Cb 0.63 0.49 -0.10 0.00 -0.26 0.00 0.00 64.21 64.96 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 -2.53 1.86 0.08 6.66 -4.23 -1.26 -2.20 115.64 114.03 2rpc s THR 37 Ca -0.11 -2.15 -0.31 0.00 -1.18 0.00 0.00 61.69 57.94 2rpc s THR 37 Cb 0.07 -2.01 -0.16 0.00 1.34 0.00 0.00 72.50 71.74 2rpc s THR 37 CO 0.80 -0.49 1.63 -0.03 -0.54 0.00 0.00 174.62 176.00 2rpc h MET 38 N 2.74 -0.73 -1.00 3.99 4.05 -1.93 -2.46 114.93 119.58 2rpc h MET 38 Ca -0.40 0.05 0.26 0.00 -0.28 0.00 0.00 59.70 59.34 2rpc h MET 38 Cb 1.22 0.17 -0.13 0.00 -0.80 0.00 0.00 31.60 32.06 2rpc h MET 38 CO 0.58 -0.49 0.58 0.45 0.23 0.00 0.00 176.91 178.27 2rpc h HIS 39 N -0.76 0.98 -0.97 1.39 3.86 -1.99 0.41 115.15 118.07 2rpc h HIS 39 Ca -0.06 0.04 0.02 0.00 -1.16 0.00 0.00 60.37 59.21 2rpc h HIS 39 Cb 0.62 -0.28 -0.05 0.00 1.06 0.00 0.00 27.41 28.76 2rpc h HIS 39 CO -0.10 0.00 0.64 0.93 0.86 0.00 0.00 177.93 180.27 2rpc h GLU 40 N 0.52 1.25 -0.06 2.45 4.39 -1.87 -0.19 114.58 121.07 2rpc h GLU 40 Ca 0.66 -0.07 -0.04 0.00 0.34 0.00 0.00 59.36 60.25 2rpc h GLU 40 Cb 1.32 -0.28 0.00 0.00 -0.10 0.00 0.00 28.75 29.69 2rpc h GLU 40 CO -0.51 0.82 -0.12 1.25 -1.16 0.00 0.00 179.01 179.29 2rpc h LEU 41 N 1.28 0.20 0.19 1.33 5.85 0.00 -3.20 115.31 120.97 2rpc h LEU 41 Ca 0.37 -0.58 0.01 0.00 0.84 0.00 0.00 57.88 58.52 2rpc h LEU 41 Cb -0.09 -0.06 -0.02 0.00 0.37 0.00 0.00 40.66 40.85 2rpc h LEU 41 CO -0.09 0.74 -0.24 0.58 -0.34 0.00 0.00 178.44 179.09 2rpc h VAL 42 N -0.33 0.48 -1.00 1.05 2.07 -0.92 -0.53 116.25 117.07 2rpc h VAL 42 Ca 0.00 0.00 0.29 0.00 0.82 0.00 0.00 66.70 67.81 2rpc h VAL 42 Cb 0.71 0.48 -0.04 0.00 -1.52 0.00 0.00 31.29 30.92 2rpc h VAL 42 CO 0.03 0.00 0.82 0.74 0.02 0.00 0.00 177.57 179.18 2rpc h THR 43 N -0.48 0.33 0.00 2.57 2.02 -1.13 0.38 112.91 116.60 2rpc h THR 43 Ca 0.01 0.00 0.00 0.00 0.77 0.00 0.00 66.41 67.19 2rpc h THR 43 Cb 0.47 0.40 0.00 0.00 -1.74 0.00 0.00 68.15 67.28 2rpc h THR 43 CO -0.08 0.00 -0.10 -0.74 0.37 0.00 0.00 175.52 174.96 2rpc h HIS 44 N 0.00 0.00 -0.11 3.16 -0.00 -1.24 -0.48 115.15 116.48 2rpc h HIS 44 Ca 0.47 0.00 0.03 0.00 -0.00 0.00 0.00 60.37 60.88 2rpc h HIS 44 Cb 2.11 0.00 -0.00 0.00 -0.00 0.00 0.00 27.41 29.52 2rpc h HIS 44 CO 0.00 0.00 0.31 0.28 -0.00 0.00 0.00 177.93 178.52 2rpc h VAL 45 N -0.72 0.13 0.00 5.26 2.07 -0.50 2.25 116.25 124.74 2rpc h VAL 45 Ca 0.00 0.00 -0.11 0.00 0.82 0.00 0.00 66.70 67.41 2rpc h VAL 45 Cb 0.10 0.71 -0.02 0.00 -1.52 0.00 0.00 31.29 30.57 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 -3.19 1.47 -0.10 2.57 -1.04 0.13 -1.79 114.28 112.34 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 -2.24 -0.12 0.00 -1.82 0.00 0.00 70.33 66.55 2rpc n THR 46 CO 0.00 0.00 0.00 0.24 -0.64 0.00 0.00 175.07 174.67 2rpc h MET 47 N -1.00 0.00 0.00 -2.82 2.86 -0.73 2.02 114.93 115.27 2rpc h MET 47 Ca -0.16 -0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.47 2rpc h MET 47 Cb 0.91 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.57 2rpc h MET 47 CO -0.10 1.00 0.00 0.39 1.06 0.00 0.00 176.91 179.26 2rpc n GLU 48 N -4.46 0.53 0.00 1.72 -0.58 0.72 -2.32 120.64 116.26 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 0.65 -1.31 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 -0.81 -0.22 0.86 -0.32 8.25 0.85 -4.81 115.22 119.02 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 31.88 2rpc n HIS 49 CO 0.00 0.00 0.00 0.28 0.64 0.00 0.00 176.34 177.26 2rpc n VAL 50 N -1.93 0.28 -4.58 1.59 0.31 0.34 -4.95 118.33 109.39 2rpc n VAL 50 Ca 0.00 0.07 0.00 0.00 -0.01 0.00 0.00 64.34 64.40 2rpc n VAL 50 Cb 0.00 -0.82 0.00 0.00 -0.91 0.00 0.00 33.84 32.11 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 -0.78 0.00 2.92 0.00 0.66 -4.83 105.19 103.15 2rpc n GLY 51 Ca 0.10 -1.11 0.00 0.00 0.00 0.00 0.00 46.02 45.01 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 2.15 0.00 -0.02 0.00 -1.26 -3.47 105.19 102.59 2rpc n GLY 52 Ca 0.00 -2.10 0.07 0.00 0.00 0.00 0.00 46.02 43.99 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 -0.62 0.31 0.20 1.61 -0.04 -1.26 -2.33 135.00 132.87 2rpc n PRO 53 Ca 0.00 0.09 0.10 0.00 -0.04 0.00 0.00 63.50 63.66 2rpc n PRO 53 Cb 0.00 -1.50 0.14 0.00 -0.04 0.00 0.00 33.50 32.10 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 -7.21 0.54 5.08 -1.96 -3.45 114.58 107.57 2rpc h GLU 54 Ca 0.00 0.00 -0.49 0.00 -1.00 0.00 0.00 59.36 57.87 2rpc h GLU 54 Cb 0.09 0.00 0.06 0.00 0.50 0.00 0.00 28.75 29.39 2rpc h GLU 54 CO 0.00 0.09 0.38 -0.65 -1.00 0.00 0.00 179.01 177.83 2rpc s GLN 55 N -3.17 3.44 -0.04 2.33 1.11 -0.99 -5.03 119.66 117.32 2rpc s GLN 55 Ca 0.06 1.13 -0.04 0.00 0.01 0.00 0.00 55.36 56.52 2rpc s GLN 55 Cb 0.06 -2.05 -0.01 0.00 -1.01 0.00 0.00 33.01 29.99 2rpc s GLN 55 CO 0.69 -0.71 -0.07 0.27 0.01 0.00 0.00 175.29 175.48 2rpc n ASN 56 N -2.01 0.39 -4.58 5.90 0.23 -1.26 -4.89 115.26 109.04 2rpc n ASN 56 Ca 0.08 0.07 -0.43 0.00 -0.53 0.00 0.00 54.58 53.77 2rpc n ASN 56 Cb 0.53 -0.55 -0.03 0.00 -2.08 0.00 0.00 39.78 37.65 2rpc n ASN 56 CO 0.00 0.00 0.00 0.21 -0.93 0.00 0.00 177.26 176.54 2rpc s ASN 57 N -4.38 6.54 -0.39 0.53 2.47 -1.26 -4.99 114.94 113.47 2rpc s ASN 57 Ca -0.06 0.24 -0.13 0.00 0.42 0.00 0.00 52.86 53.33 2rpc s ASN 57 Cb 0.01 -2.50 0.02 0.00 -1.45 0.00 0.00 41.25 37.33 2rpc s ASN 57 CO 0.09 -1.20 0.25 -1.00 -3.72 0.00 0.00 177.10 171.51 2rpc s HIS 58 N 4.21 3.24 -0.02 0.43 3.76 -1.26 -5.06 115.29 120.59 2rpc s HIS 58 Ca 0.42 -0.76 0.01 0.00 -0.15 0.00 0.00 55.06 54.58 2rpc s HIS 58 Cb -0.09 -2.50 0.01 0.00 1.11 0.00 0.00 32.58 31.11 2rpc s HIS 58 CO 0.28 -0.61 -0.03 0.08 -0.85 0.00 0.00 174.74 173.62 2rpc s VAL 59 N 1.62 0.31 -0.25 -0.90 1.01 -1.26 -4.37 120.40 116.55 2rpc s VAL 59 Ca 0.04 -0.07 -0.04 0.00 0.00 0.00 0.00 61.98 61.91 2rpc s VAL 59 Cb -0.19 -0.33 0.01 0.00 0.00 0.00 0.00 36.38 35.87 2rpc s VAL 59 CO 0.08 0.14 -0.02 0.00 0.00 0.00 0.00 175.10 175.30 2rpc s TYR 61 N 1.44 3.42 0.14 0.00 1.51 -1.26 -3.94 117.35 118.66 2rpc s TYR 61 Ca 0.03 -1.68 -0.14 0.00 -1.01 0.00 0.00 57.07 54.28 2rpc s TYR 61 Cb -0.16 -3.69 -0.07 0.00 -0.11 0.00 0.00 41.96 37.93 2rpc s TYR 61 CO -0.02 -1.00 0.53 -0.46 -1.11 0.00 0.00 175.55 173.49 2rpc s TRP 62 N 1.12 3.59 0.64 2.71 -0.11 -1.26 -0.98 118.94 124.65 2rpc s TRP 62 Ca 0.08 1.02 0.16 0.00 1.22 0.00 0.00 56.10 58.58 2rpc s TRP 62 Cb -0.24 -2.34 0.70 0.00 -1.50 0.00 0.00 33.47 30.09 2rpc s TRP 62 CO -0.01 0.43 1.33 1.49 -4.62 0.00 0.00 176.95 175.57 2rpc h GLU 63 N 3.52 0.00 -0.01 5.86 4.22 -1.82 -1.73 114.58 124.62 2rpc h GLU 63 Ca -0.49 0.00 -0.15 0.00 0.08 0.00 0.00 59.36 58.81 2rpc h GLU 63 Cb 1.19 0.00 -0.15 0.00 0.50 0.00 0.00 28.75 30.29 2rpc h GLU 63 CO 0.66 0.00 -0.33 0.39 -2.18 0.00 0.00 179.01 177.55 2rpc n GLU 64 N -2.94 0.45 -1.52 1.92 -0.58 -1.26 -5.02 120.64 111.69 2rpc n GLU 64 Ca 0.09 -1.15 -0.52 0.00 -0.42 0.00 0.00 57.16 55.16 2rpc n GLU 64 Cb 1.07 0.42 -0.05 0.00 -0.57 0.00 0.00 31.44 32.31 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 2.83 0.00 0.00 0.00 0.13 -1.98 -2.70 132.00 130.28 2rpc h PRO 66 Ca -0.43 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.70 2rpc h PRO 66 Cb 1.39 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.52 2rpc h PRO 66 CO 0.66 0.20 -0.65 0.00 -0.23 0.00 0.00 178.00 177.99 2rpc h ARG 67 N 0.00 0.00 -1.91 0.86 2.47 -1.96 -3.48 114.38 110.36 2rpc h ARG 67 Ca -0.00 0.00 -0.22 0.00 -1.26 0.00 0.00 59.98 58.50 2rpc h ARG 67 Cb 0.64 0.00 0.00 0.00 -1.65 0.00 0.00 29.97 28.97 2rpc h ARG 67 CO 0.03 0.00 -0.29 0.39 0.56 0.00 0.00 179.97 180.65 2rpc n GLU 68 N -2.54 -1.46 -2.76 0.04 1.02 -1.02 -3.62 120.64 110.30 2rpc n GLU 68 Ca 0.02 0.51 -0.11 0.00 -0.02 0.00 0.00 57.16 57.56 2rpc n GLU 68 Cb 0.50 -4.57 0.05 0.00 -0.02 0.00 0.00 31.44 27.41 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 -1.06 -0.46 3.44 0.62 0.00 -1.25 -5.01 105.19 101.48 2rpc n GLY 69 Ca -0.11 0.25 -0.39 0.00 0.00 0.00 0.00 46.02 45.78 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 -4.13 3.30 1.07 1.61 -0.14 -1.24 -4.88 119.74 115.33 2rpc s LYS 70 Ca 0.26 -0.75 -0.22 0.00 -1.36 0.00 0.00 55.97 53.90 2rpc s LYS 70 Cb -0.03 -3.61 -0.01 0.00 -1.68 0.00 0.00 37.83 32.49 2rpc s LYS 70 CO 0.51 -0.45 -0.63 -1.13 -0.76 0.00 0.00 175.35 172.90 2rpc n SER 71 N 5.00 -2.64 -4.47 2.83 3.41 -1.26 -4.93 113.62 111.55 2rpc n SER 71 Ca -0.13 -0.09 -0.31 0.00 -0.26 0.00 0.00 58.87 58.08 2rpc n SER 71 Cb 0.49 -0.76 -0.07 0.00 -0.26 0.00 0.00 64.21 63.61 2rpc n SER 71 CO 0.00 0.00 0.00 -0.36 -0.16 0.00 0.00 175.04 174.52 2rpc s PHE 72 N -2.13 1.77 -0.26 7.33 0.40 -1.26 -5.05 117.98 118.78 2rpc s PHE 72 Ca 0.47 -1.14 0.19 0.00 -0.60 0.00 0.00 56.93 55.85 2rpc s PHE 72 Cb -0.02 -1.40 0.12 0.00 0.51 0.00 0.00 43.02 42.23 2rpc s PHE 72 CO 0.64 -0.03 1.36 -0.22 0.70 0.00 0.00 175.22 177.67 2rpc h LYS 73 N 1.47 0.00 -4.27 0.44 1.63 -1.96 -3.48 116.57 110.40 2rpc h LYS 73 Ca -0.40 0.00 -0.22 0.00 -0.85 0.00 0.00 60.65 59.18 2rpc h LYS 73 Cb 1.31 0.00 -0.12 0.00 -0.60 0.00 0.00 32.23 32.82 2rpc h LYS 73 CO 0.65 0.22 -0.38 0.00 -3.45 0.00 0.00 179.45 176.49 2rpc s ALA 74 N -3.11 0.77 -0.01 5.00 0.00 -1.26 -5.05 121.76 118.10 2rpc s ALA 74 Ca 0.03 -1.47 -0.25 0.00 0.00 0.00 0.00 51.96 50.28 2rpc s ALA 74 Cb 0.07 1.27 -0.19 0.00 0.00 0.00 0.00 23.12 24.26 2rpc s ALA 74 CO 0.73 -0.71 1.24 -0.22 0.00 0.00 0.00 175.76 176.81 2rpc h LYS 75 N 2.37 0.10 0.00 0.00 3.11 -1.94 -3.08 116.57 117.14 2rpc h LYS 75 Ca -0.31 -0.06 -0.01 0.00 -2.81 0.00 0.00 60.65 57.46 2rpc h LYS 75 Cb 1.25 0.01 -0.00 0.00 -1.00 0.00 0.00 32.23 32.48 2rpc h LYS 75 CO 0.44 0.61 -0.05 0.10 -2.81 0.00 0.00 179.45 177.73 2rpc h TYR 76 N -0.40 0.00 -0.95 1.91 -0.00 -1.99 -2.21 116.97 113.34 2rpc h TYR 76 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 58.73 58.74 2rpc h TYR 76 Cb 0.60 0.00 -0.05 0.00 0.00 0.00 0.00 36.73 37.28 2rpc h TYR 76 CO 0.11 0.05 0.61 0.87 -0.00 0.00 0.00 178.16 179.80 2rpc h LYS 77 N 0.00 1.26 0.11 0.10 1.79 -1.95 -2.27 116.57 115.62 2rpc h LYS 77 Ca -0.00 -0.09 -0.25 0.00 -2.18 0.00 0.00 60.65 58.13 2rpc h LYS 77 Cb 0.17 -0.28 0.03 0.00 -1.58 0.00 0.00 32.23 30.56 2rpc h LYS 77 CO 0.01 0.85 -1.04 1.25 -1.08 0.00 0.00 179.45 179.44 2rpc h LEU 78 N 1.29 0.72 -1.27 2.94 5.85 -1.47 -3.21 115.31 120.16 2rpc h LEU 78 Ca 0.34 -0.85 0.20 0.00 0.84 0.00 0.00 57.88 58.41 2rpc h LEU 78 Cb -0.11 -0.23 -0.09 0.00 0.37 0.00 0.00 40.66 40.60 2rpc h LEU 78 CO -0.07 1.50 0.61 0.58 -0.34 0.00 0.00 178.44 180.72 2rpc h VAL 79 N 0.04 0.70 -0.22 1.05 2.07 -1.28 0.11 116.25 118.71 2rpc h VAL 79 Ca -0.16 -0.20 -0.15 0.00 0.82 0.00 0.00 66.70 67.00 2rpc h VAL 79 Cb 1.76 0.05 -0.01 0.00 -1.52 0.00 0.00 31.29 31.58 2rpc h VAL 79 CO 0.20 0.11 -0.50 0.78 0.02 0.00 0.00 177.57 178.18 2rpc h ASN 80 N 0.59 0.66 -0.31 0.57 2.35 -1.47 -3.19 115.58 114.78 2rpc h ASN 80 Ca 0.52 -0.33 0.02 0.00 -0.55 0.00 0.00 56.30 55.96 2rpc h ASN 80 Cb 1.03 -0.19 -0.02 0.00 0.05 0.00 0.00 38.32 39.19 2rpc h ASN 80 CO -0.27 1.05 0.16 -0.74 -1.65 0.00 0.00 177.43 175.98 2rpc h HIS 81 N 0.48 0.31 0.00 1.19 -0.00 -0.81 -0.83 115.15 115.48 2rpc h HIS 81 Ca 0.02 0.01 0.00 0.00 -0.00 0.00 0.00 60.37 60.40 2rpc h HIS 81 Cb 1.04 -0.09 0.00 0.00 -0.00 0.00 0.00 27.41 28.35 2rpc h HIS 81 CO 0.05 0.18 0.21 0.82 -0.00 0.00 0.00 177.93 179.19 2rpc h ILE 82 N 0.34 0.00 0.00 6.26 2.04 -1.42 0.20 117.51 124.93 2rpc h ILE 82 Ca 0.12 0.00 -0.02 0.00 1.00 0.00 0.00 64.86 65.96 2rpc h ILE 82 Cb 0.02 0.55 -0.00 0.00 -0.74 0.00 0.00 36.82 36.65 2rpc h ILE 82 CO -0.07 0.00 -0.12 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 -1.22 -2.23 114.38 115.76 2rpc h ARG 83 Ca 0.00 0.00 -0.02 0.00 -1.26 0.00 0.00 59.98 58.70 2rpc h ARG 83 Cb 0.43 0.00 -0.00 0.00 -1.65 0.00 0.00 29.97 28.74 2rpc h ARG 83 CO 0.00 0.12 -0.41 -0.39 0.56 0.00 0.00 179.97 179.84 2rpc h VAL 84 N 0.00 0.13 0.00 2.04 -1.51 -0.73 -3.22 116.25 112.96 2rpc h VAL 84 Ca -0.00 -1.20 0.00 0.00 -1.23 0.00 0.00 66.70 64.27 2rpc h VAL 84 Cb 0.48 1.92 0.00 0.00 -2.13 0.00 0.00 31.29 31.55 2rpc h VAL 84 CO 0.02 0.08 0.00 1.41 -1.23 0.00 0.00 177.57 177.84 2rpc n HIS 85 N -2.99 0.00 -0.11 5.19 8.25 -0.84 -3.48 115.22 121.24 2rpc n HIS 85 Ca 0.02 0.00 -0.20 0.00 -0.26 0.00 0.00 57.72 57.28 2rpc n HIS 85 Cb 0.58 -0.48 -0.07 0.00 1.12 0.00 0.00 29.99 31.13 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 -1.48 1.51 -0.62 1.59 -2.24 -1.22 -5.02 114.28 106.81 2rpc n THR 86 Ca 0.04 -0.13 0.00 0.00 -2.27 0.00 0.00 64.05 61.70 2rpc n THR 86 Cb 0.19 -2.09 0.00 0.00 -2.10 0.00 0.00 70.33 66.33 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 1.37 0.68 3.37 3.38 0.00 -1.23 -5.04 105.19 107.72 2rpc n GLY 87 Ca -0.35 -0.06 -0.37 0.00 0.00 0.00 0.00 46.02 45.24 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 -0.46 3.23 0.09 1.61 2.12 -1.26 -5.09 118.70 118.94 2rpc s GLU 88 Ca 0.00 -0.76 0.10 0.00 0.36 0.00 0.00 54.97 54.67 2rpc s GLU 88 Cb 0.00 -3.35 -0.03 0.00 0.26 0.00 0.00 34.13 31.00 2rpc s GLU 88 CO 0.00 -0.38 -0.26 0.15 -0.54 0.00 0.00 175.26 174.23 2rpc s LYS 89 N 1.53 1.62 -0.02 4.30 -0.14 -1.26 -4.72 119.74 121.04 2rpc s LYS 89 Ca 0.04 -1.23 -0.25 0.00 -1.36 0.00 0.00 55.97 53.17 2rpc s LYS 89 Cb -0.17 -1.95 -0.19 0.00 -1.68 0.00 0.00 37.83 33.84 2rpc s LYS 89 CO 0.02 0.48 1.22 -1.00 -0.76 0.00 0.00 175.35 175.31 2rpc h PRO 90 N 4.30 -0.07 -2.35 -1.68 0.13 -1.79 -3.47 132.00 127.07 2rpc h PRO 90 Ca -0.49 0.00 -0.08 0.00 -0.87 0.00 0.00 66.00 64.57 2rpc h PRO 90 Cb 1.16 0.02 -0.22 0.00 0.13 0.00 0.00 31.00 32.09 2rpc h PRO 90 CO 0.42 0.39 -0.02 -0.59 -0.23 0.00 0.00 178.00 177.96 2rpc s PHE 91 N -4.21 -0.60 0.00 1.56 -0.12 -1.26 -5.16 117.98 108.19 2rpc s PHE 91 Ca -0.15 1.37 0.00 0.00 -0.05 0.00 0.00 56.93 58.10 2rpc s PHE 91 Cb 0.02 0.24 0.00 0.00 -0.63 0.00 0.00 43.02 42.64 2rpc s PHE 91 CO 0.64 -0.36 0.00 -0.35 -0.05 0.00 0.00 175.22 175.09 2rpc n PRO 92 N 2.33 0.23 -3.70 1.99 -0.04 -1.26 -4.18 135.00 130.37 2rpc n PRO 92 Ca -0.15 0.00 -0.37 0.00 -0.04 0.00 0.00 63.50 62.94 2rpc n PRO 92 Cb 0.56 0.00 -0.07 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 2.61 0.49 -3.72 0.00 -0.04 -1.26 -4.69 135.00 128.39 2rpc n PRO 94 Ca -0.16 0.00 -0.36 0.00 -0.04 0.00 0.00 63.50 62.94 2rpc n PRO 94 Cb 0.53 -1.35 -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 3.47 -0.02 0.54 2.19 -1.26 -5.02 117.98 115.88 2rpc s PHE 95 Ca 0.16 0.44 -0.23 0.00 0.33 0.00 0.00 56.93 57.63 2rpc s PHE 95 Cb 0.08 -2.15 -0.17 0.00 -1.31 0.00 0.00 43.02 39.47 2rpc s PHE 95 CO 0.13 0.39 1.09 -1.00 1.83 0.00 0.00 175.22 177.65 2rpc h PRO 96 N 6.25 -0.26 -1.82 10.12 0.13 -1.94 -3.22 132.00 141.26 2rpc h PRO 96 Ca -0.44 0.02 -0.11 0.00 -0.87 0.00 0.00 66.00 64.59 2rpc h PRO 96 Cb 1.17 0.06 -0.05 0.00 0.13 0.00 0.00 31.00 32.31 2rpc h PRO 96 CO 0.72 0.13 0.15 0.41 -0.23 0.00 0.00 178.00 179.17 2rpc n GLY 97 N 0.15 3.06 0.68 1.56 0.00 -1.26 -3.66 105.19 105.72 2rpc n GLY 97 Ca -0.09 -0.39 0.00 0.00 0.00 0.00 0.00 46.02 45.55 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 2.06 -0.43 3.89 0.00 0.00 -1.22 -4.90 105.19 104.60 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 -4.83 3.68 -0.01 1.61 2.47 -1.26 -4.92 119.74 116.47 2rpc s LYS 100 Ca 0.00 0.04 -0.02 0.00 -1.56 0.00 0.00 55.97 54.43 2rpc s LYS 100 Cb 0.00 -2.73 -0.00 0.00 -1.46 0.00 0.00 37.83 33.63 2rpc s LYS 100 CO 0.00 0.36 0.03 0.42 0.16 0.00 0.00 175.35 176.32 2rpc s ILE 101 N -1.82 0.02 -0.03 5.43 1.01 -1.26 -0.55 121.20 124.00 2rpc s ILE 101 Ca 0.44 -0.20 0.04 0.00 0.00 0.00 0.00 60.65 60.93 2rpc s ILE 101 Cb -0.11 -0.12 -0.00 0.00 0.01 0.00 0.00 42.46 42.23 2rpc s ILE 101 CO 0.25 -0.11 -0.15 -0.36 0.00 0.00 0.00 174.94 174.57 2rpc s PHE 102 N -0.31 1.50 -0.56 3.97 0.40 -1.26 -5.01 117.98 116.70 2rpc s PHE 102 Ca -0.04 -0.39 0.25 0.00 -0.60 0.00 0.00 56.93 56.15 2rpc s PHE 102 Cb -0.02 -1.01 0.92 0.00 0.51 0.00 0.00 43.02 43.42 2rpc s PHE 102 CO -0.00 -0.12 1.75 0.00 0.70 0.00 0.00 175.22 177.54 2rpc n ALA 103 N 3.08 1.92 -2.93 5.36 0.00 -1.26 -4.18 120.51 122.51 2rpc n ALA 103 Ca -0.17 0.05 -0.34 0.00 0.00 0.00 0.00 53.44 52.98 2rpc n ALA 103 Cb 0.53 -1.43 -0.12 0.00 0.00 0.00 0.00 19.45 18.43 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 -3.24 3.51 0.08 0.00 3.52 -1.26 -4.50 118.95 117.06 2rpc s ARG 104 Ca 0.07 -0.55 -0.22 0.00 -0.13 0.00 0.00 55.73 54.90 2rpc s ARG 104 Cb 0.10 -2.83 -0.12 0.00 -1.56 0.00 0.00 34.95 30.54 2rpc s ARG 104 CO 0.48 0.29 1.67 0.77 -0.81 0.00 0.00 175.30 177.71 2rpc h SER 105 N 6.50 0.12 -0.25 -2.12 0.02 -1.98 -2.17 113.55 113.67 2rpc h SER 105 Ca -0.32 -0.10 0.07 0.00 -0.84 0.00 0.00 61.79 60.60 2rpc h SER 105 Cb 1.19 -0.03 -0.01 0.00 0.14 0.00 0.00 62.40 63.69 2rpc h SER 105 CO 0.60 0.18 0.20 -0.08 -1.14 0.00 0.00 176.83 176.59 2rpc h GLU 106 N 0.04 0.00 0.26 3.45 4.81 -1.98 -1.33 114.58 119.84 2rpc h GLU 106 Ca 0.03 0.00 -0.01 0.00 -0.13 0.00 0.00 59.36 59.25 2rpc h GLU 106 Cb 0.09 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.47 2rpc h GLU 106 CO -0.00 0.00 -0.12 -0.91 -0.73 0.00 0.00 179.01 177.24 2rpc h ASN 107 N 0.00 -0.29 0.37 1.04 -0.26 -1.81 -2.46 115.58 112.16 2rpc h ASN 107 Ca 0.12 -0.24 -0.01 0.00 -0.56 0.00 0.00 56.30 55.62 2rpc h ASN 107 Cb 0.51 0.08 -0.02 0.00 -1.06 0.00 0.00 38.32 37.83 2rpc h ASN 107 CO -0.00 0.18 -0.32 0.25 -1.06 0.00 0.00 177.43 176.47 2rpc h LEU 108 N -0.87 -0.86 -0.56 1.61 5.85 -0.99 0.28 115.31 119.78 2rpc h LEU 108 Ca -0.04 0.07 0.11 0.00 0.84 0.00 0.00 57.88 58.87 2rpc h LEU 108 Cb 0.51 0.28 -0.11 0.00 0.37 0.00 0.00 40.66 41.72 2rpc h LEU 108 CO 0.06 -0.47 -0.15 0.07 -0.34 0.00 0.00 178.44 177.61 2rpc h LYS 109 N -0.70 -0.01 -0.15 1.25 2.10 -1.38 0.86 116.57 118.54 2rpc h LYS 109 Ca -0.03 0.00 -0.03 0.00 -2.00 0.00 0.00 60.65 58.59 2rpc h LYS 109 Cb 0.62 0.00 -0.01 0.00 -0.90 0.00 0.00 32.23 31.95 2rpc h LYS 109 CO -0.03 -0.01 -0.06 0.82 -2.00 0.00 0.00 179.45 178.17 2rpc h ILE 110 N -0.02 1.14 0.00 0.07 2.04 -1.16 -1.60 117.51 117.98 2rpc h ILE 110 Ca 0.27 -0.57 0.00 0.00 1.00 0.00 0.00 64.86 65.56 2rpc h ILE 110 Cb 0.43 1.09 0.00 0.00 -0.74 0.00 0.00 36.82 37.60 2rpc h ILE 110 CO -0.59 0.18 -0.20 -0.74 0.00 0.00 0.00 178.15 176.81 2rpc h HIS 111 N 0.22 0.00 -0.00 1.37 2.76 0.17 -3.25 115.15 116.42 2rpc h HIS 111 Ca 0.05 0.00 -0.16 0.00 -2.20 0.00 0.00 60.37 58.06 2rpc h HIS 111 Cb 0.25 0.00 -0.02 0.00 1.55 0.00 0.00 27.41 29.19 2rpc h HIS 111 CO 0.00 0.00 -0.78 0.87 -1.30 0.00 0.00 177.93 176.72 2rpc h LYS 112 N 0.00 0.00 -0.05 5.26 1.57 0.15 -3.17 116.57 120.33 2rpc h LYS 112 Ca 0.00 -0.00 -0.15 0.00 -1.87 0.00 0.00 60.65 58.63 2rpc h LYS 112 Cb 1.00 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 33.29 2rpc h LYS 112 CO 0.00 0.78 -0.63 0.07 -0.57 0.00 0.00 179.45 179.10 2rpc h ARG 113 N 0.00 0.20 0.00 3.15 0.11 -1.52 -2.82 114.38 113.50 2rpc h ARG 113 Ca -0.01 -0.14 0.00 0.00 0.10 0.00 0.00 59.98 59.93 2rpc h ARG 113 Cb 1.38 0.02 0.00 0.00 1.11 0.00 0.00 29.97 32.49 2rpc h ARG 113 CO 0.10 0.76 0.00 -2.37 0.10 0.00 0.00 179.97 178.57 2rpc n THR 114 N -3.84 0.98 -0.95 0.08 5.66 -1.20 -3.77 114.28 111.24 2rpc n THR 114 Ca -0.02 0.30 -0.17 0.00 -3.05 0.00 0.00 64.05 61.11 2rpc n THR 114 Cb 0.64 -1.19 -0.11 0.00 -1.55 0.00 0.00 70.33 68.12 2rpc n THR 114 CO 0.00 0.00 0.00 1.41 -3.05 0.00 0.00 175.07 173.43 2rpc n HIS 115 N -1.95 0.62 -4.94 1.09 8.25 -1.06 -4.84 115.22 112.38 2rpc n HIS 115 Ca 0.02 -1.73 -0.30 0.00 -0.26 0.00 0.00 57.72 55.45 2rpc n HIS 115 Cb 0.18 -1.68 -0.15 0.00 1.12 0.00 0.00 29.99 29.46 2rpc n HIS 115 CO 0.00 0.00 0.00 -0.08 0.64 0.00 0.00 176.34 176.90 2rpc s THR 116 N 1.64 2.09 0.00 1.59 -1.32 -1.25 -4.93 115.64 113.47 2rpc s THR 116 Ca 0.59 -1.34 0.00 0.00 -1.21 0.00 0.00 61.69 59.73 2rpc s THR 116 Cb 0.24 -1.78 0.00 0.00 -1.51 0.00 0.00 72.50 69.45 2rpc s THR 116 CO -0.02 0.38 0.00 0.61 -2.21 0.00 0.00 174.62 173.39 2rpc n GLY 117 N 1.87 0.57 3.49 6.08 0.00 -1.26 -5.10 105.19 110.83 2rpc n GLY 117 Ca -0.17 -0.13 -0.31 0.00 0.00 0.00 0.00 46.02 45.42 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 2.11 0.11 1.61 2.12 -1.26 -5.13 118.70 118.26 2rpc s GLU 118 Ca 0.00 -0.97 -0.13 0.00 0.36 0.00 0.00 54.97 54.23 2rpc s GLU 118 Cb 0.00 -2.23 -0.06 0.00 0.26 0.00 0.00 34.13 32.09 2rpc s GLU 118 CO 0.00 0.54 0.49 0.15 -0.54 0.00 0.00 175.26 175.89 2rpc s LYS 119 N -1.60 3.90 -0.01 4.30 3.01 -1.26 -5.02 119.74 123.05 2rpc s LYS 119 Ca 0.16 0.37 -0.25 0.00 -1.01 0.00 0.00 55.97 55.24 2rpc s LYS 119 Cb -0.11 -2.98 -0.20 0.00 -1.01 0.00 0.00 37.83 33.54 2rpc s LYS 119 CO 0.07 0.52 1.28 -1.00 0.51 0.00 0.00 175.35 176.73 2rpc h PRO 120 N 3.70 0.05 -6.47 -1.68 0.13 -1.88 -3.41 132.00 122.43 2rpc h PRO 120 Ca -0.49 -0.02 -0.55 0.00 -0.87 0.00 0.00 66.00 64.07 2rpc h PRO 120 Cb 1.19 0.00 -0.07 0.00 0.13 0.00 0.00 31.00 32.25 2rpc h PRO 120 CO 0.66 0.52 1.03 -0.06 -0.23 0.00 0.00 178.00 179.92 2rpc s PHE 121 N -4.26 2.43 -0.14 1.56 0.08 0.57 -4.96 117.98 113.26 2rpc s PHE 121 Ca -0.16 0.32 -0.07 0.00 0.12 0.00 0.00 56.93 57.14 2rpc s PHE 121 Cb 0.02 -4.51 -0.04 0.00 -0.57 0.00 0.00 43.02 37.92 2rpc s PHE 121 CO 0.68 -1.82 0.10 0.21 -0.10 0.00 0.00 175.22 174.30 2rpc s LYS 122 N 5.32 3.58 -0.27 0.44 2.20 -1.26 -1.26 119.74 128.49 2rpc s LYS 122 Ca 0.44 -0.23 -0.36 0.00 -0.36 0.00 0.00 55.97 55.46 2rpc s LYS 122 Cb -0.08 -3.16 -0.12 0.00 -1.51 0.00 0.00 37.83 32.95 2rpc s LYS 122 CO 0.23 0.59 2.04 0.00 -0.36 0.00 0.00 175.35 177.85 2rpc n GLU 124 N 7.35 0.12 -2.22 0.00 1.02 -1.26 -4.59 120.64 121.06 2rpc n GLU 124 Ca 0.34 0.61 -0.43 0.00 -0.02 0.00 0.00 57.16 57.66 2rpc n GLU 124 Cb 0.24 -1.89 -0.02 0.00 -0.02 0.00 0.00 31.44 29.74 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 -3.46 2.42 0.60 -0.32 5.36 -1.26 -4.99 117.98 116.33 2rpc s PHE 125 Ca -0.02 0.61 -0.18 0.00 -0.96 0.00 0.00 56.93 56.38 2rpc s PHE 125 Cb 0.05 -3.71 -0.03 0.00 -0.34 0.00 0.00 43.02 39.00 2rpc s PHE 125 CO 0.17 -2.74 1.18 -2.00 -1.46 0.00 0.00 175.22 170.37 2rpc s GLU 126 N 3.77 2.96 0.00 10.12 2.12 -1.26 -2.66 118.70 133.75 2rpc s GLU 126 Ca 0.64 1.73 0.00 0.00 0.36 0.00 0.00 54.97 57.69 2rpc s GLU 126 Cb -0.27 -1.94 0.00 0.00 0.26 0.00 0.00 34.13 32.18 2rpc s GLU 126 CO 0.22 -1.19 0.00 0.41 -0.54 0.00 0.00 175.26 174.16 2rpc n GLY 127 N 0.31 0.23 3.67 -1.50 0.00 -1.26 -4.98 105.19 101.66 2rpc n GLY 127 Ca 0.13 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.85 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 -2.37 4.16 0.30 0.00 1.01 -1.26 -4.92 116.67 113.59 2rpc s ASP 129 Ca 0.25 -1.46 0.04 0.00 0.71 0.00 0.00 52.55 52.09 2rpc s ASP 129 Cb -0.11 -1.30 -0.02 0.00 1.01 0.00 0.00 42.92 42.50 2rpc s ASP 129 CO 0.18 -0.28 0.31 0.54 0.21 0.00 0.00 175.17 176.13 2rpc n ARG 130 N 4.56 0.45 -3.47 8.23 5.12 -1.26 -5.06 116.66 125.22 2rpc n ARG 130 Ca -0.08 -2.84 0.01 0.00 -1.93 0.00 0.00 57.85 53.00 2rpc n ARG 130 Cb 0.43 2.44 -0.04 0.00 -1.16 0.00 0.00 32.46 34.14 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 -3.07 0.45 0.05 5.56 1.70 -1.26 -4.62 118.95 117.77 2rpc s ARG 131 Ca 0.33 1.09 0.01 0.00 -0.47 0.00 0.00 55.73 56.68 2rpc s ARG 131 Cb 0.01 0.65 -0.03 0.00 -0.57 0.00 0.00 34.95 35.00 2rpc s ARG 131 CO 0.23 -0.21 -0.05 -0.06 -1.08 0.00 0.00 175.30 174.13 2rpc s PHE 132 N 2.74 0.59 -0.72 5.89 0.08 -0.39 -4.96 117.98 121.21 2rpc s PHE 132 Ca -0.01 -0.78 0.16 0.00 0.12 0.00 0.00 56.93 56.41 2rpc s PHE 132 Cb -0.10 -0.38 -0.18 0.00 -0.57 0.00 0.00 43.02 41.79 2rpc s PHE 132 CO -0.18 -0.21 0.66 0.00 -0.10 0.00 0.00 175.22 175.39 2rpc n ALA 133 N 0.71 4.01 -2.85 5.36 0.00 -1.26 -0.31 120.51 126.17 2rpc n ALA 133 Ca -0.18 -0.45 -0.17 0.00 0.00 0.00 0.00 53.44 52.64 2rpc n ALA 133 Cb 0.58 -0.58 -0.15 0.00 0.00 0.00 0.00 19.45 19.30 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 -2.58 0.78 0.18 0.00 6.03 -1.26 -4.75 114.94 113.34 2rpc s ASN 134 Ca 0.05 -0.12 -0.14 0.00 -1.03 0.00 0.00 52.86 51.63 2rpc s ASN 134 Cb 0.12 -0.13 0.16 0.00 -3.03 0.00 0.00 41.25 38.37 2rpc s ASN 134 CO 0.66 0.06 1.73 -1.28 -2.03 0.00 0.00 177.10 176.24 2rpc h SER 135 N 6.14 0.07 -1.03 3.54 0.87 -1.97 -1.28 113.55 119.89 2rpc h SER 135 Ca -0.30 0.07 0.33 0.00 -1.23 0.00 0.00 61.79 60.66 2rpc h SER 135 Cb 1.18 0.09 -0.15 0.00 -0.44 0.00 0.00 62.40 63.08 2rpc h SER 135 CO 0.50 0.07 0.60 0.28 -0.53 0.00 0.00 176.83 177.74 2rpc h SER 136 N 0.27 0.48 -0.13 6.23 0.02 -1.98 0.36 113.55 118.80 2rpc h SER 136 Ca 0.23 0.18 -0.09 0.00 -0.84 0.00 0.00 61.79 61.27 2rpc h SER 136 Cb 0.28 0.13 0.00 0.00 0.14 0.00 0.00 62.40 62.95 2rpc h SER 136 CO -0.28 -0.14 -0.27 -0.78 -1.14 0.00 0.00 176.83 174.23 2rpc h ASP 137 N 0.30 0.47 -0.22 3.07 1.82 -1.67 -2.60 116.42 117.58 2rpc h ASP 137 Ca 0.74 -0.56 0.03 0.00 -0.39 0.00 0.00 57.03 56.85 2rpc h ASP 137 Cb 1.77 -0.13 -0.03 0.00 0.68 0.00 0.00 39.33 41.62 2rpc h ASP 137 CO -0.58 0.94 0.06 -0.09 -1.61 0.00 0.00 179.24 177.96 2rpc h ARG 138 N 0.01 0.14 0.00 0.28 2.43 -0.07 -0.76 114.38 116.42 2rpc h ARG 138 Ca 0.00 -0.01 -0.00 0.00 -0.81 0.00 0.00 59.98 59.17 2rpc h ARG 138 Cb 0.86 -0.03 -0.00 0.00 -0.42 0.00 0.00 29.97 30.38 2rpc h ARG 138 CO 0.06 0.10 -0.00 0.87 -1.51 0.00 0.00 179.97 179.48 2rpc h LYS 139 N 0.15 0.00 0.00 0.20 1.57 -0.95 -1.41 116.57 116.13 2rpc h LYS 139 Ca 0.10 0.00 -0.01 0.00 -1.87 0.00 0.00 60.65 58.87 2rpc h LYS 139 Cb 0.08 0.00 -0.00 0.00 0.08 0.00 0.00 32.23 32.39 2rpc h LYS 139 CO -0.12 0.00 -0.08 0.87 -0.57 0.00 0.00 179.45 179.56 2rpc h LYS 140 N 0.00 0.00 -0.01 3.15 1.57 -0.74 -3.10 116.57 117.44 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 0.27 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.58 2rpc h LYS 140 CO 0.00 0.05 -0.01 1.58 -0.57 0.00 0.00 179.45 180.50 2rpc n HIS 141 N -3.10 0.00 0.10 -1.35 -0.00 -0.53 -3.54 115.22 106.79 2rpc n HIS 141 Ca 0.04 0.00 0.07 0.00 0.46 0.00 0.00 57.72 58.29 2rpc n HIS 141 Cb 0.55 -0.01 -0.01 0.00 -0.12 0.00 0.00 29.99 30.40 2rpc n HIS 141 CO 0.00 0.00 0.00 0.52 0.46 0.00 0.00 176.34 177.32 2rpc h MET 142 N 1.52 0.00 -0.00 1.57 2.86 -1.56 -3.33 114.93 115.99 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 0.34 0.00 -0.00 0.00 0.06 0.00 0.00 31.60 32.00 2rpc h MET 142 CO 0.00 0.14 0.26 0.45 1.06 0.00 0.00 176.91 178.82 2rpc h HIS 143 N 0.00 0.00 0.00 -0.22 3.86 -1.72 0.47 115.15 117.54 2rpc h HIS 143 Ca -0.05 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 59.16 2rpc h HIS 143 Cb 1.23 0.00 0.00 0.00 1.06 0.00 0.00 27.41 29.70 2rpc h HIS 143 CO 0.00 0.00 -1.52 1.55 0.86 0.00 0.00 177.93 178.82 2rpc n VAL 144 N -2.93 0.00 0.32 2.45 3.14 -1.25 -4.18 118.33 115.88 2rpc n VAL 144 Ca -0.02 -0.26 0.13 0.00 -2.96 0.00 0.00 64.34 61.22 2rpc n VAL 144 Cb 0.31 0.46 0.29 0.00 -1.06 0.00 0.00 33.84 33.84 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 -2.02 1.45 3.86 -0.22 -3.45 115.15 114.76 2rpc h HIS 145 Ca 0.00 0.00 -0.51 0.00 -1.16 0.00 0.00 60.37 58.70 2rpc h HIS 145 Cb 0.76 0.00 -0.05 0.00 1.06 0.00 0.00 27.41 29.18 2rpc h HIS 145 CO 0.00 0.00 -0.52 -0.08 0.86 0.00 0.00 177.93 178.19 2rpc s THR 146 N -3.24 3.77 -1.07 2.45 -1.32 -1.05 -5.06 115.64 110.13 2rpc s THR 146 Ca 0.07 -1.50 -0.15 0.00 -1.21 0.00 0.00 61.69 58.90 2rpc s THR 146 Cb 0.07 -3.19 0.17 0.00 -1.51 0.00 0.00 72.50 68.05 2rpc s THR 146 CO 0.63 -0.26 1.23 -0.55 -2.21 0.00 0.00 174.62 173.46 2rpc s SER 147 N -3.88 6.91 0.19 8.08 0.15 -1.26 -4.95 113.70 118.94 2rpc s SER 147 Ca 0.36 -2.68 -0.13 0.00 0.70 0.00 0.00 55.95 54.20 2rpc s SER 147 Cb -0.06 -2.37 0.01 0.00 -1.71 0.00 0.00 66.02 61.89 2rpc s SER 147 CO 0.24 -0.80 0.42 -1.81 1.20 0.00 0.00 173.24 172.49 2rpc s ASP 148 N 2.92 -0.10 -0.97 5.45 1.01 -1.26 -5.06 116.67 118.65 2rpc s ASP 148 Ca 0.36 -0.72 -0.15 0.00 0.71 0.00 0.00 52.55 52.75 2rpc s ASP 148 Cb -0.05 0.52 -0.29 0.00 1.01 0.00 0.00 42.92 44.11 2rpc s ASP 148 CO -0.05 -1.00 2.29 0.29 0.21 0.00 0.00 175.17 176.91 2rpc n LYS 149 N -0.29 0.06 -0.35 8.23 5.02 -1.26 -4.74 118.16 124.83 2rpc n LYS 149 Ca -0.08 -0.06 -0.07 0.00 -2.02 0.00 0.00 58.31 56.09 2rpc n LYS 149 Cb 0.63 -1.35 -0.03 0.00 -0.02 0.00 0.00 35.03 34.25 2rpc n LYS 149 CO 0.00 0.00 0.00 0.77 -0.52 0.00 0.00 177.40 177.65 2rpc h SER 150 N 11.52 -1.72 -0.67 4.39 0.02 -1.93 -3.47 113.55 121.69 2rpc h SER 150 Ca 0.01 0.30 0.00 0.00 -0.84 0.00 0.00 61.79 61.26 2rpc h SER 150 Cb 1.16 0.81 0.00 0.00 0.14 0.00 0.00 62.40 64.51 2rpc h SER 150 CO 1.52 -0.28 0.00 0.61 -1.14 0.00 0.00 176.83 177.54 2rpc n GLY 151 N -1.38 3.02 0.17 -3.77 0.00 -1.26 -4.96 105.19 97.02 2rpc n GLY 151 Ca 0.05 -1.06 -0.01 0.00 0.00 0.00 0.00 46.02 45.01 2rpc n GLY 151 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2rpc h PRO 152 N 0.00 0.09 -4.46 1.61 0.13 -1.90 -3.45 132.00 124.01 2rpc h PRO 152 Ca 0.00 -0.05 -0.19 0.00 -0.87 0.00 0.00 66.00 64.89 2rpc h PRO 152 Cb 0.00 0.00 -0.16 0.00 0.13 0.00 0.00 31.00 30.97 2rpc h PRO 152 CO 0.00 0.55 -0.70 0.45 -0.23 0.00 0.00 178.00 178.08 2rpc s SER 153 N -6.89 0.83 -0.10 1.44 0.15 -1.26 -5.10 113.70 102.77 2rpc s SER 153 Ca -0.03 -0.92 -0.36 0.00 0.70 0.00 0.00 55.95 55.34 2rpc s SER 153 Cb 0.13 0.12 -0.14 0.00 -1.71 0.00 0.00 66.02 64.43 2rpc s SER 153 CO 0.76 -0.47 1.75 -1.54 1.20 0.00 0.00 173.24 174.94 2rpc n SER 154 N 0.30 2.89 0.00 5.45 3.41 -1.26 -5.14 113.62 119.27 2rpc n SER 154 Ca -0.15 1.03 0.00 0.00 -0.26 0.00 0.00 58.87 59.49 2rpc n SER 154 Cb 0.60 -1.29 0.00 0.00 -0.26 0.00 0.00 64.21 63.26 2rpc n SER 154 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49