#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 3.24 -2.81 1.61 7.64 -1.26 -4.90 113.62 117.13 2rpc n SER 2 Ca 0.00 -3.44 -0.28 0.00 1.01 0.00 0.00 58.87 56.15 2rpc n SER 2 Cb 0.00 -0.57 -0.02 0.00 -1.01 0.00 0.00 64.21 62.61 2rpc n SER 2 CO 0.00 0.00 0.00 -1.54 -3.01 0.00 0.00 175.04 170.49 2rpc n SER 3 N -0.09 4.90 -1.32 6.43 3.41 -1.26 -5.04 113.62 120.66 2rpc n SER 3 Ca 0.29 -3.71 0.00 0.00 -0.26 0.00 0.00 58.87 55.19 2rpc n SER 3 Cb 0.50 -0.59 0.00 0.00 -0.26 0.00 0.00 64.21 63.87 2rpc n SER 3 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2rpc n GLY 4 N -0.34 1.37 3.18 5.00 0.00 -1.26 -5.11 105.19 108.03 2rpc n GLY 4 Ca 0.36 -1.74 -0.29 0.00 0.00 0.00 0.00 46.02 44.35 2rpc n GLY 4 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2rpc s SER 5 N -1.00 2.56 -0.21 1.61 0.15 -1.26 -5.11 113.70 110.43 2rpc s SER 5 Ca 0.00 -0.43 -0.24 0.00 0.70 0.00 0.00 55.95 55.98 2rpc s SER 5 Cb 0.00 -0.84 -0.01 0.00 -1.71 0.00 0.00 66.02 63.46 2rpc s SER 5 CO 0.00 0.17 0.77 -0.44 1.20 0.00 0.00 173.24 174.94 2rpc s SER 6 N 0.10 6.81 -0.86 5.45 0.01 -1.26 -4.97 113.70 118.98 2rpc s SER 6 Ca -0.08 1.00 0.00 0.00 1.31 0.00 0.00 55.95 58.19 2rpc s SER 6 Cb -0.14 -2.41 0.34 0.00 0.21 0.00 0.00 66.02 64.02 2rpc s SER 6 CO 0.04 -0.41 1.66 0.61 0.41 0.00 0.00 173.24 175.54 2rpc n GLY 7 N 3.72 5.90 3.87 3.44 0.00 -1.26 -5.01 105.19 115.85 2rpc n GLY 7 Ca 0.03 -2.61 -0.34 0.00 0.00 0.00 0.00 46.02 43.10 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 -4.06 3.71 0.00 1.61 1.11 -1.26 -5.10 119.66 115.66 2rpc s GLN 8 Ca 0.44 0.09 0.00 0.00 0.01 0.00 0.00 55.36 55.91 2rpc s GLN 8 Cb 0.28 -2.99 0.00 0.00 -1.01 0.00 0.00 33.01 29.29 2rpc s GLN 8 CO -0.20 0.56 0.00 -0.35 0.01 0.00 0.00 175.29 175.31 2rpc n PRO 9 N 0.82 -0.51 -4.18 2.91 -0.04 -1.26 -5.03 135.00 127.71 2rpc n PRO 9 Ca -0.08 0.00 -0.34 0.00 -0.04 0.00 0.00 63.50 63.04 2rpc n PRO 9 Cb 0.52 0.00 -0.12 0.00 -0.04 0.00 0.00 33.50 33.87 2rpc n PRO 9 CO 0.00 0.00 0.00 0.42 -0.04 0.00 0.00 175.50 175.88 2rpc s ILE 10 N -0.75 4.16 -0.10 0.52 1.01 -1.26 -5.10 121.20 119.68 2rpc s ILE 10 Ca 0.00 -0.25 -0.01 0.00 0.00 0.00 0.00 60.65 60.39 2rpc s ILE 10 Cb 0.00 -2.86 -0.03 0.00 0.01 0.00 0.00 42.46 39.58 2rpc s ILE 10 CO 0.00 0.46 -0.05 -0.54 0.00 0.00 0.00 174.94 174.81 2rpc s LYS 11 N 0.60 3.12 -0.27 2.79 -0.14 -1.26 -5.10 119.74 119.48 2rpc s LYS 11 Ca -0.00 -0.53 -0.15 0.00 -1.36 0.00 0.00 55.97 53.93 2rpc s LYS 11 Cb -0.14 -2.73 -0.04 0.00 -1.68 0.00 0.00 37.83 33.25 2rpc s LYS 11 CO 0.02 0.51 0.38 -1.14 -0.76 0.00 0.00 175.35 174.35 2rpc s GLN 12 N -0.37 3.99 0.01 1.68 2.00 -0.78 -5.03 119.66 121.16 2rpc s GLN 12 Ca 0.06 0.02 -0.27 0.00 -2.00 0.00 0.00 55.36 53.17 2rpc s GLN 12 Cb -0.12 -3.66 -0.04 0.00 0.80 0.00 0.00 33.01 29.98 2rpc s GLN 12 CO 0.02 -0.29 0.86 -2.00 -0.50 0.00 0.00 175.29 173.38 2rpc s GLU 13 N 2.08 4.54 0.21 1.67 2.56 -1.25 -3.75 118.70 124.76 2rpc s GLU 13 Ca 0.15 1.22 0.09 0.00 0.00 0.00 0.00 54.97 56.42 2rpc s GLU 13 Cb -0.16 -3.43 -0.05 0.00 2.00 0.00 0.00 34.13 32.50 2rpc s GLU 13 CO 0.10 0.08 -0.16 -0.51 -0.56 0.00 0.00 175.26 174.21 2rpc s LEU 14 N 0.62 2.55 -0.05 2.70 1.43 -1.12 -4.94 118.68 119.86 2rpc s LEU 14 Ca 0.45 -1.00 0.01 0.00 -1.03 0.00 0.00 54.13 52.56 2rpc s LEU 14 Cb -0.20 -0.77 0.02 0.00 0.03 0.00 0.00 46.19 45.27 2rpc s LEU 14 CO 0.25 -0.12 -0.04 -0.94 0.23 0.00 0.00 176.35 175.73 2rpc s SER 15 N -3.25 1.13 -0.77 2.29 1.04 -1.26 -3.15 113.70 109.72 2rpc s SER 15 Ca 0.23 -0.14 -0.14 0.00 0.48 0.00 0.00 55.95 56.38 2rpc s SER 15 Cb -0.02 -0.48 0.20 0.00 0.10 0.00 0.00 66.02 65.82 2rpc s SER 15 CO 0.08 -0.07 0.71 0.00 0.98 0.00 0.00 173.24 174.94 2rpc s LYS 17 N 0.42 3.23 -0.26 0.00 -0.14 -1.26 -3.96 119.74 117.77 2rpc s LYS 17 Ca 0.15 -0.48 -0.07 0.00 -1.36 0.00 0.00 55.97 54.21 2rpc s LYS 17 Cb -0.14 -4.33 -0.02 0.00 -1.68 0.00 0.00 37.83 31.66 2rpc s LYS 17 CO -0.07 -2.09 0.06 -0.46 -0.76 0.00 0.00 175.35 172.04 2rpc s TRP 18 N 5.28 3.09 -0.34 3.18 -0.11 -1.26 -2.91 118.94 125.87 2rpc s TRP 18 Ca 0.34 -0.58 0.04 0.00 1.22 0.00 0.00 56.10 57.11 2rpc s TRP 18 Cb -0.09 -2.23 0.10 0.00 -1.50 0.00 0.00 33.47 29.75 2rpc s TRP 18 CO 0.11 -0.42 0.05 0.42 -4.62 0.00 0.00 176.95 172.48 2rpc s ILE 19 N 1.58 2.18 0.07 5.86 1.01 0.47 -1.44 121.20 130.93 2rpc s ILE 19 Ca 0.06 -2.27 -0.31 0.00 0.00 0.00 0.00 60.65 58.13 2rpc s ILE 19 Cb -0.15 -2.61 -0.07 0.00 0.01 0.00 0.00 42.46 39.64 2rpc s ILE 19 CO 0.03 -0.59 1.32 -1.81 0.00 0.00 0.00 174.94 173.89 2rpc s ASP 20 N 0.95 6.92 0.33 3.58 1.01 -1.26 -4.55 116.67 123.65 2rpc s ASP 20 Ca 0.10 2.17 0.12 0.00 0.71 0.00 0.00 52.55 55.65 2rpc s ASP 20 Cb -0.19 -2.58 0.57 0.00 1.01 0.00 0.00 42.92 41.74 2rpc s ASP 20 CO -0.09 -0.60 1.74 -0.33 0.21 0.00 0.00 175.17 176.09 2rpc h GLU 21 N 7.03 0.00 -0.80 8.23 5.08 -1.98 -2.92 114.58 129.21 2rpc h GLU 21 Ca -0.41 0.00 -0.47 0.00 -1.00 0.00 0.00 59.36 57.48 2rpc h GLU 21 Cb 1.20 0.00 -0.26 0.00 0.50 0.00 0.00 28.75 30.19 2rpc h GLU 21 CO 0.86 0.47 0.38 0.00 -1.00 0.00 0.00 179.01 179.72 2rpc n ALA 22 N -2.44 5.40 -2.54 3.43 0.00 -1.26 -4.98 120.51 118.11 2rpc n ALA 22 Ca -0.02 -3.19 -0.43 0.00 0.00 0.00 0.00 53.44 49.81 2rpc n ALA 22 Cb 0.49 -1.24 -0.02 0.00 0.00 0.00 0.00 19.45 18.68 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 -3.44 4.32 0.00 0.00 -2.07 -1.10 -4.89 119.66 112.47 2rpc s GLN 23 Ca 0.55 1.54 0.16 0.00 -1.82 0.00 0.00 55.36 55.79 2rpc s GLN 23 Cb 0.46 -3.63 0.96 0.00 -1.09 0.00 0.00 33.01 29.71 2rpc s GLN 23 CO 0.04 -0.53 1.46 -0.11 -1.32 0.00 0.00 175.29 174.84 2rpc n LEU 24 N 5.77 0.00 -4.53 2.60 0.00 -1.26 -4.69 117.00 114.89 2rpc n LEU 24 Ca 0.11 0.00 -0.34 0.00 0.00 0.00 0.00 56.01 55.79 2rpc n LEU 24 Cb 0.46 0.00 -0.12 0.00 0.00 0.00 0.00 43.42 43.77 2rpc n LEU 24 CO 0.54 0.00 -0.34 -0.44 0.00 0.00 0.00 177.39 177.15 2rpc s SER 25 N -1.73 4.94 0.09 1.96 0.01 -1.26 -5.11 113.70 112.60 2rpc s SER 25 Ca 0.24 -0.08 0.03 0.00 1.31 0.00 0.00 55.95 57.45 2rpc s SER 25 Cb 0.11 -1.79 -0.04 0.00 0.21 0.00 0.00 66.02 64.51 2rpc s SER 25 CO 0.19 0.18 -0.09 -0.13 0.41 0.00 0.00 173.24 173.80 2rpc s ARG 26 N 0.30 0.81 0.66 12.44 1.81 -1.26 -4.02 118.95 129.69 2rpc s ARG 26 Ca -0.02 -1.16 -0.15 0.00 -1.72 0.00 0.00 55.73 52.68 2rpc s ARG 26 Cb -0.14 -0.43 0.00 0.00 -0.45 0.00 0.00 34.95 33.93 2rpc s ARG 26 CO 0.02 0.05 1.11 -1.25 -0.68 0.00 0.00 175.30 174.56 2rpc s PRO 27 N -2.91 2.79 -0.38 3.54 0.04 -1.26 -5.02 135.00 131.81 2rpc s PRO 27 Ca 0.05 1.38 -0.37 0.00 0.04 0.00 0.00 61.00 62.11 2rpc s PRO 27 Cb -0.02 -1.95 -0.13 0.00 0.04 0.00 0.00 34.50 32.44 2rpc s PRO 27 CO -0.01 -1.25 2.18 1.63 0.04 0.00 0.00 177.00 179.58 2rpc n LYS 28 N -2.44 0.86 -3.45 4.56 5.02 -1.26 -4.93 118.16 116.53 2rpc n LYS 28 Ca 0.10 0.23 -0.21 0.00 -2.02 0.00 0.00 58.31 56.41 2rpc n LYS 28 Cb 0.52 -2.26 0.00 0.00 -0.02 0.00 0.00 35.03 33.27 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 6.16 2.45 -0.06 1.97 -2.85 -1.26 -5.10 119.74 121.04 2rpc s LYS 29 Ca 1.12 -1.65 0.05 0.00 -1.00 0.00 0.00 55.97 54.49 2rpc s LYS 29 Cb -0.99 -2.42 -0.02 0.00 -2.06 0.00 0.00 37.83 32.35 2rpc s LYS 29 CO 0.52 -0.47 -0.22 -1.12 0.10 0.00 0.00 175.35 174.17 2rpc s SER 30 N -4.32 3.36 -0.26 0.03 0.01 -1.26 -4.32 113.70 106.94 2rpc s SER 30 Ca 0.49 -0.42 -0.41 0.00 1.31 0.00 0.00 55.95 56.91 2rpc s SER 30 Cb -0.04 -0.88 -0.17 0.00 0.21 0.00 0.00 66.02 65.13 2rpc s SER 30 CO 0.29 0.26 1.60 0.00 0.41 0.00 0.00 173.24 175.81 2rpc s ASP 32 N 2.70 6.28 -0.22 0.00 -4.77 -1.26 -4.01 116.67 115.39 2rpc s ASP 32 Ca 0.98 0.32 -0.36 0.00 -3.30 0.00 0.00 52.55 50.19 2rpc s ASP 32 Cb -1.18 -2.17 0.15 0.00 -1.09 0.00 0.00 42.92 38.63 2rpc s ASP 32 CO 0.67 0.01 1.32 -0.60 0.70 0.00 0.00 175.17 177.27 2rpc s ARG 33 N 1.09 0.15 0.08 2.11 3.52 -1.26 -5.03 118.95 119.62 2rpc s ARG 33 Ca 0.13 -0.06 0.01 0.00 -0.13 0.00 0.00 55.73 55.68 2rpc s ARG 33 Cb -0.14 0.07 -0.04 0.00 -1.56 0.00 0.00 34.95 33.28 2rpc s ARG 33 CO 0.06 -0.07 -0.05 0.95 -0.81 0.00 0.00 175.30 175.37 2rpc s THR 34 N -2.20 0.52 -0.01 4.11 -4.23 -1.26 -4.05 115.64 108.52 2rpc s THR 34 Ca 0.11 -1.84 -0.05 0.00 -1.18 0.00 0.00 61.69 58.73 2rpc s THR 34 Cb 0.00 -1.56 0.00 0.00 1.34 0.00 0.00 72.50 72.28 2rpc s THR 34 CO -0.04 -0.89 0.11 -0.36 -0.54 0.00 0.00 174.62 172.91 2rpc s PHE 35 N -3.59 0.02 -0.26 3.99 0.40 -1.19 -4.93 117.98 112.43 2rpc s PHE 35 Ca 0.09 -0.06 0.19 0.00 -0.60 0.00 0.00 56.93 56.55 2rpc s PHE 35 Cb 0.05 -0.04 0.12 0.00 0.51 0.00 0.00 43.02 43.66 2rpc s PHE 35 CO -0.06 -0.21 1.36 0.77 0.70 0.00 0.00 175.22 177.78 2rpc h SER 36 N 4.80 0.00 -5.46 1.36 0.02 -1.94 -2.98 113.55 109.36 2rpc h SER 36 Ca -0.29 0.00 -0.30 0.00 -0.84 0.00 0.00 61.79 60.36 2rpc h SER 36 Cb 1.20 0.00 -0.15 0.00 0.14 0.00 0.00 62.40 63.59 2rpc h SER 36 CO 0.41 0.28 -0.60 0.42 -1.14 0.00 0.00 176.83 176.20 2rpc s THR 37 N -3.09 0.08 -0.02 -2.27 -4.23 -1.25 -1.87 115.64 102.99 2rpc s THR 37 Ca 0.03 -2.00 -0.22 0.00 -1.18 0.00 0.00 61.69 58.32 2rpc s THR 37 Cb 0.07 -2.52 -0.15 0.00 1.34 0.00 0.00 72.50 71.25 2rpc s THR 37 CO 0.74 0.00 0.99 -0.03 -0.54 0.00 0.00 174.62 175.78 2rpc h MET 38 N 2.50 -0.40 -1.09 3.99 4.05 -1.91 -3.09 114.93 118.98 2rpc h MET 38 Ca -0.34 0.03 0.31 0.00 -0.28 0.00 0.00 59.70 59.41 2rpc h MET 38 Cb 1.25 0.09 -0.11 0.00 -0.80 0.00 0.00 31.60 32.03 2rpc h MET 38 CO 0.51 -0.07 0.69 1.25 0.23 0.00 0.00 176.91 179.52 2rpc h HIS 39 N -0.90 0.70 -0.36 1.39 -0.00 -1.99 0.81 115.15 114.81 2rpc h HIS 39 Ca -0.04 0.03 -0.06 0.00 -0.00 0.00 0.00 60.37 60.29 2rpc h HIS 39 Cb 0.52 -0.20 -0.02 0.00 -0.00 0.00 0.00 27.41 27.71 2rpc h HIS 39 CO 0.04 -0.03 -0.03 0.93 -0.00 0.00 0.00 177.93 178.84 2rpc h GLU 40 N 0.34 0.57 0.01 5.26 4.39 -1.97 -1.79 114.58 121.39 2rpc h GLU 40 Ca 0.67 -0.14 -0.00 0.00 0.34 0.00 0.00 59.36 60.23 2rpc h GLU 40 Cb 1.73 -0.08 0.00 0.00 -0.10 0.00 0.00 28.75 30.30 2rpc h GLU 40 CO -0.38 0.62 -0.01 1.25 -1.16 0.00 0.00 179.01 179.33 2rpc h LEU 41 N 0.54 -0.01 -0.06 1.33 5.85 0.61 -3.29 115.31 120.28 2rpc h LEU 41 Ca 0.11 -0.80 0.04 0.00 0.84 0.00 0.00 57.88 58.07 2rpc h LEU 41 Cb 0.39 0.00 -0.06 0.00 0.37 0.00 0.00 40.66 41.36 2rpc h LEU 41 CO 0.02 0.84 -0.35 0.58 -0.34 0.00 0.00 178.44 179.18 2rpc h VAL 42 N -0.91 0.25 -1.28 1.05 2.07 -0.93 0.56 116.25 117.06 2rpc h VAL 42 Ca -0.00 0.00 0.37 0.00 0.82 0.00 0.00 66.70 67.89 2rpc h VAL 42 Cb 0.81 0.25 -0.06 0.00 -1.52 0.00 0.00 31.29 30.77 2rpc h VAL 42 CO 0.00 0.00 0.91 0.74 0.02 0.00 0.00 177.57 179.24 2rpc h THR 43 N -0.47 0.36 0.00 2.57 2.02 -1.47 0.45 112.91 116.37 2rpc h THR 43 Ca 0.07 -0.01 0.00 0.00 0.77 0.00 0.00 66.41 67.24 2rpc h THR 43 Cb 0.58 0.31 0.00 0.00 -1.74 0.00 0.00 68.15 67.30 2rpc h THR 43 CO -0.32 0.01 -0.01 -0.74 0.37 0.00 0.00 175.52 174.82 2rpc h HIS 44 N 0.04 0.00 -0.10 3.16 -0.00 -1.03 0.79 115.15 118.01 2rpc h HIS 44 Ca 0.62 0.00 0.03 0.00 -0.00 0.00 0.00 60.37 61.02 2rpc h HIS 44 Cb 2.39 0.00 -0.00 0.00 -0.00 0.00 0.00 27.41 29.80 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 0.12 0.00 5.26 2.07 -0.37 2.23 116.25 124.84 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 0.01 0.71 -0.02 0.00 -1.52 0.00 0.00 31.29 30.48 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 -3.17 1.47 -0.10 2.57 -1.04 0.15 -1.80 114.28 112.37 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 0.39 -2.25 -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 -0.49 2.01 114.93 115.50 2rpc h MET 47 Ca -0.16 -0.01 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 0.00 176.91 179.27 2rpc n GLU 48 N -4.46 0.54 0.00 1.72 -0.58 0.72 -2.31 120.64 116.26 2rpc n GLU 48 Ca -0.27 0.00 0.00 0.00 -0.42 0.00 0.00 57.16 56.47 2rpc n GLU 48 Cb 0.64 -1.31 0.00 0.00 -0.57 0.00 0.00 31.44 30.20 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 0.86 -4.81 115.22 119.03 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 0.32 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 -1.95 0.29 -0.95 1.59 0.31 0.38 -4.95 118.33 113.05 2rpc n VAL 50 Ca 0.00 0.07 0.12 0.00 -0.01 0.00 0.00 64.34 64.52 2rpc n VAL 50 Cb 0.00 -0.82 -0.03 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 0.01 -1.30 0.00 2.92 0.00 0.66 -4.83 105.19 102.64 2rpc n GLY 51 Ca 0.10 -0.67 0.00 0.00 0.00 0.00 0.00 46.02 45.45 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 -3.00 -1.53 0.27 -0.02 0.00 -1.26 -4.42 105.19 95.24 2rpc n GLY 52 Ca -0.01 -1.51 0.16 0.00 0.00 0.00 0.00 46.02 44.67 2rpc n GLY 52 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2rpc h PRO 53 N 0.00 0.00 0.00 1.61 0.13 -1.98 -2.86 132.00 128.91 2rpc h PRO 53 Ca 0.00 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.13 2rpc h PRO 53 Cb 0.00 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.13 2rpc h PRO 53 CO 0.00 0.04 0.00 0.93 -0.23 0.00 0.00 178.00 178.74 2rpc h GLU 54 N 0.00 0.00 -5.82 0.86 3.07 -1.96 -3.38 114.58 107.35 2rpc h GLU 54 Ca -0.00 0.00 -0.62 0.00 -0.50 0.00 0.00 59.36 58.24 2rpc h GLU 54 Cb 0.52 0.00 -0.12 0.00 -0.84 0.00 0.00 28.75 28.31 2rpc h GLU 54 CO 0.01 0.00 0.51 -0.65 -1.40 0.00 0.00 179.01 177.48 2rpc s GLN 55 N -3.61 3.34 0.00 2.33 1.11 -1.08 -4.96 119.66 116.79 2rpc s GLN 55 Ca -0.02 -0.25 0.00 0.00 0.01 0.00 0.00 55.36 55.09 2rpc s GLN 55 Cb 0.07 -4.03 0.00 0.00 -1.01 0.00 0.00 33.01 28.04 2rpc s GLN 55 CO 0.23 -1.41 0.82 0.09 0.01 0.00 0.00 175.29 175.02 2rpc n ASN 56 N 7.28 0.00 -4.50 5.90 3.02 -1.26 -4.34 115.26 121.36 2rpc n ASN 56 Ca 0.02 0.82 -0.43 0.00 -0.03 0.00 0.00 54.58 54.95 2rpc n ASN 56 Cb 0.47 -0.32 -0.05 0.00 -0.61 0.00 0.00 39.78 39.27 2rpc n ASN 56 CO 0.00 0.00 0.00 0.21 -2.62 0.00 0.00 177.26 174.85 2rpc s ASN 57 N -2.21 6.32 -0.23 6.41 2.47 -1.26 -5.03 114.94 121.41 2rpc s ASN 57 Ca 0.00 -0.48 -0.06 0.00 0.42 0.00 0.00 52.86 52.74 2rpc s ASN 57 Cb 0.00 -2.37 -0.03 0.00 -1.45 0.00 0.00 41.25 37.41 2rpc s ASN 57 CO 0.00 -1.02 0.04 -1.38 -3.72 0.00 0.00 177.10 171.02 2rpc s HIS 58 N 3.30 3.06 -0.01 0.43 -3.43 -1.26 -5.09 115.29 112.28 2rpc s HIS 58 Ca 0.25 -0.47 0.01 0.00 -0.80 0.00 0.00 55.06 54.05 2rpc s HIS 58 Cb -0.15 -2.17 0.01 0.00 -1.43 0.00 0.00 32.58 28.84 2rpc s HIS 58 CO 0.18 -0.32 -0.04 0.08 -2.00 0.00 0.00 174.74 172.64 2rpc s VAL 59 N 1.35 0.35 -0.28 -5.38 1.01 -1.26 -4.60 120.40 111.59 2rpc s VAL 59 Ca 0.05 -0.13 -0.09 0.00 0.00 0.00 0.00 61.98 61.81 2rpc s VAL 59 Cb -0.15 -0.33 -0.02 0.00 0.00 0.00 0.00 36.38 35.88 2rpc s VAL 59 CO 0.02 0.13 0.12 0.00 0.00 0.00 0.00 175.10 175.36 2rpc s TYR 61 N 1.61 3.43 0.15 0.00 2.02 -1.26 -4.23 117.35 119.07 2rpc s TYR 61 Ca 0.05 -1.77 -0.14 0.00 -0.37 0.00 0.00 57.07 54.85 2rpc s TYR 61 Cb -0.16 -3.64 -0.07 0.00 -0.40 0.00 0.00 41.96 37.68 2rpc s TYR 61 CO 0.05 -0.99 0.55 -0.46 -1.57 0.00 0.00 175.55 173.13 2rpc s TRP 62 N 1.08 3.59 0.65 2.71 -0.11 -1.26 -0.40 118.94 125.21 2rpc s TRP 62 Ca 0.08 1.05 0.15 0.00 1.22 0.00 0.00 56.10 58.60 2rpc s TRP 62 Cb -0.24 -2.36 0.71 0.00 -1.50 0.00 0.00 33.47 30.08 2rpc s TRP 62 CO -0.01 0.42 1.37 1.49 -4.62 0.00 0.00 176.95 175.60 2rpc h GLU 63 N 3.49 0.00 -0.01 5.86 4.81 -1.84 -1.83 114.58 125.06 2rpc h GLU 63 Ca -0.48 0.00 -0.15 0.00 -0.13 0.00 0.00 59.36 58.60 2rpc h GLU 63 Cb 1.19 0.00 -0.16 0.00 0.63 0.00 0.00 28.75 30.41 2rpc h GLU 63 CO 0.66 0.00 -0.34 -1.91 -0.73 0.00 0.00 179.01 176.69 2rpc n GLU 64 N -2.82 0.53 -1.56 1.92 2.13 -1.26 -5.03 120.64 114.55 2rpc n GLU 64 Ca 0.04 -1.20 -0.50 0.00 0.66 0.00 0.00 57.16 56.16 2rpc n GLU 64 Cb 0.88 0.39 -0.04 0.00 0.27 0.00 0.00 31.44 32.94 2rpc n GLU 64 CO 0.00 0.00 0.00 0.00 -0.41 0.00 0.00 177.13 176.72 2rpc h PRO 66 N 3.16 0.00 0.00 0.00 0.13 -1.98 -2.45 132.00 130.87 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 1.36 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.49 2rpc h PRO 66 CO 0.69 0.00 -0.60 0.54 -0.23 0.00 0.00 178.00 178.39 2rpc n ARG 67 N -2.92 0.21 -3.16 0.86 5.12 -1.26 -4.95 116.66 110.55 2rpc n ARG 67 Ca 0.01 0.05 -0.20 0.00 -1.93 0.00 0.00 57.85 55.78 2rpc n ARG 67 Cb 0.28 -1.62 0.05 0.00 -1.16 0.00 0.00 32.46 30.01 2rpc n ARG 67 CO 0.00 0.00 0.00 0.39 -1.93 0.00 0.00 177.63 176.09 2rpc n GLU 68 N -1.92 -5.45 -3.10 5.56 1.02 -0.92 -3.44 120.64 112.39 2rpc n GLU 68 Ca 0.04 0.74 -0.08 0.00 -0.02 0.00 0.00 57.16 57.84 2rpc n GLU 68 Cb 0.41 -5.37 0.04 0.00 -0.02 0.00 0.00 31.44 26.50 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 -1.60 -1.13 3.49 0.62 0.00 -1.26 -5.02 105.19 100.30 2rpc n GLY 69 Ca -0.05 0.50 -0.33 0.00 0.00 0.00 0.00 46.02 46.14 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 -3.77 2.98 1.14 1.61 -0.14 -1.22 -4.97 119.74 115.36 2rpc s LYS 70 Ca 0.26 -0.61 -0.13 0.00 -1.36 0.00 0.00 55.97 54.13 2rpc s LYS 70 Cb -0.03 -2.59 0.27 0.00 -1.68 0.00 0.00 37.83 33.79 2rpc s LYS 70 CO 0.71 0.48 1.04 -1.54 -0.76 0.00 0.00 175.35 175.28 2rpc s SER 71 N -0.34 1.20 0.46 2.83 1.04 -1.26 -4.84 113.70 112.80 2rpc s SER 71 Ca 0.04 1.55 0.01 0.00 0.48 0.00 0.00 55.95 58.02 2rpc s SER 71 Cb -0.13 -2.29 -0.00 0.00 0.10 0.00 0.00 66.02 63.70 2rpc s SER 71 CO 0.02 -4.07 0.03 0.49 0.98 0.00 0.00 173.24 170.69 2rpc n PHE 72 N -4.83 0.92 1.01 5.02 3.01 -1.26 -5.05 117.46 116.28 2rpc n PHE 72 Ca 0.04 -2.40 0.11 0.00 1.01 0.00 0.00 57.45 56.20 2rpc n PHE 72 Cb 0.54 -0.26 -0.01 0.00 -0.01 0.00 0.00 39.48 39.74 2rpc n PHE 72 CO 0.00 0.00 0.00 1.63 1.01 0.00 0.00 176.76 179.40 2rpc n LYS 73 N -1.14 0.78 -3.83 -1.08 4.01 -1.26 -5.01 118.16 110.64 2rpc n LYS 73 Ca -0.17 -0.64 -0.06 0.00 -0.51 0.00 0.00 58.31 56.93 2rpc n LYS 73 Cb 0.61 -1.49 0.01 0.00 -0.51 0.00 0.00 35.03 33.65 2rpc n LYS 73 CO 0.00 0.00 0.00 0.00 -1.11 0.00 0.00 177.40 176.29 2rpc s ALA 74 N -2.66 -1.21 -0.08 7.82 0.00 -1.26 -5.05 121.76 119.32 2rpc s ALA 74 Ca 0.15 -0.45 -0.10 0.00 0.00 0.00 0.00 51.96 51.56 2rpc s ALA 74 Cb 0.17 0.72 -0.07 0.00 0.00 0.00 0.00 23.12 23.94 2rpc s ALA 74 CO 0.67 -1.03 0.39 0.87 0.00 0.00 0.00 175.76 176.66 2rpc h LYS 75 N 2.00 -0.20 0.00 0.00 1.79 -1.98 -3.25 116.57 114.93 2rpc h LYS 75 Ca -0.28 0.01 0.00 0.00 -2.18 0.00 0.00 60.65 58.20 2rpc h LYS 75 Cb 1.24 0.05 0.00 0.00 -1.58 0.00 0.00 32.23 31.93 2rpc h LYS 75 CO 0.35 -0.00 0.38 0.10 -1.08 0.00 0.00 179.45 179.20 2rpc h TYR 76 N -1.03 0.00 -0.19 -1.35 -0.00 -1.98 0.28 116.97 112.70 2rpc h TYR 76 Ca -0.02 0.00 -0.20 0.00 0.00 0.00 0.00 58.73 58.51 2rpc h TYR 76 Cb 0.29 0.00 0.00 0.00 0.00 0.00 0.00 36.73 37.02 2rpc h TYR 76 CO 0.03 0.00 -0.66 0.87 -0.00 0.00 0.00 178.16 178.40 2rpc h LYS 77 N 0.00 0.74 0.13 0.10 1.79 -1.97 -2.74 116.57 114.62 2rpc h LYS 77 Ca 0.00 -0.54 -0.22 0.00 -2.18 0.00 0.00 60.65 57.72 2rpc h LYS 77 Cb 0.75 0.09 0.01 0.00 -1.58 0.00 0.00 32.23 31.51 2rpc h LYS 77 CO 0.00 1.16 -1.03 1.25 -1.08 0.00 0.00 179.45 179.75 2rpc h LEU 78 N 0.53 0.44 -0.88 2.94 5.85 -0.54 -3.18 115.31 120.48 2rpc h LEU 78 Ca -0.02 -0.92 0.13 0.00 0.84 0.00 0.00 57.88 57.92 2rpc h LEU 78 Cb 1.27 -0.14 -0.09 0.00 0.37 0.00 0.00 40.66 42.07 2rpc h LEU 78 CO 0.14 1.47 0.49 0.58 -0.34 0.00 0.00 178.44 180.78 2rpc h VAL 79 N -0.35 0.82 -0.28 1.05 2.07 -1.35 -0.22 116.25 117.98 2rpc h VAL 79 Ca -0.20 -0.26 -0.11 0.00 0.82 0.00 0.00 66.70 66.96 2rpc h VAL 79 Cb 1.69 0.00 -0.01 0.00 -1.52 0.00 0.00 31.29 31.45 2rpc h VAL 79 CO 0.12 0.14 -0.27 -0.55 0.02 0.00 0.00 177.57 177.02 2rpc h ASN 80 N 0.75 0.56 0.18 0.57 7.08 -1.60 -3.16 115.58 119.96 2rpc h ASN 80 Ca 0.46 -0.20 -0.00 0.00 -3.08 0.00 0.00 56.30 53.47 2rpc h ASN 80 Cb 0.56 -0.15 -0.01 0.00 -2.08 0.00 0.00 38.32 36.63 2rpc h ASN 80 CO -0.31 0.82 -0.13 -0.74 -2.08 0.00 0.00 177.43 174.99 2rpc h HIS 81 N 0.48 -0.34 0.00 4.14 2.76 -1.03 -1.29 115.15 119.88 2rpc h HIS 81 Ca 0.07 -0.00 0.00 0.00 -2.20 0.00 0.00 60.37 58.23 2rpc h HIS 81 Cb 0.72 0.12 0.00 0.00 1.55 0.00 0.00 27.41 29.81 2rpc h HIS 81 CO 0.03 -0.20 0.41 0.82 -1.30 0.00 0.00 177.93 177.69 2rpc h ILE 82 N -0.32 0.00 -0.17 6.26 2.04 -1.39 0.34 117.51 124.28 2rpc h ILE 82 Ca -0.01 0.00 -0.07 0.00 1.00 0.00 0.00 64.86 65.77 2rpc h ILE 82 Cb 0.28 0.47 -0.01 0.00 -0.74 0.00 0.00 36.82 36.82 2rpc h ILE 82 CO -0.00 0.00 -0.22 0.03 0.00 0.00 0.00 178.15 177.96 2rpc h ARG 83 N 0.00 0.30 0.00 2.37 2.47 -1.29 -2.26 114.38 115.98 2rpc h ARG 83 Ca 0.00 -0.10 -0.03 0.00 -1.26 0.00 0.00 59.98 58.60 2rpc h ARG 83 Cb 0.83 -0.03 -0.00 0.00 -1.65 0.00 0.00 29.97 29.12 2rpc h ARG 83 CO 0.00 0.52 -0.12 -0.39 0.56 0.00 0.00 179.97 180.54 2rpc h VAL 84 N 0.27 0.28 0.00 2.04 -1.51 -0.42 -2.67 116.25 114.25 2rpc h VAL 84 Ca 0.05 -0.90 0.00 0.00 -1.23 0.00 0.00 66.70 64.62 2rpc h VAL 84 Cb 0.55 1.71 0.00 0.00 -2.13 0.00 0.00 31.29 31.42 2rpc h VAL 84 CO 0.04 0.12 0.00 1.41 -1.23 0.00 0.00 177.57 177.90 2rpc n HIS 85 N -3.24 0.22 -0.10 5.19 8.25 -0.85 -3.19 115.22 121.50 2rpc n HIS 85 Ca 0.01 0.09 -0.18 0.00 -0.26 0.00 0.00 57.72 57.37 2rpc n HIS 85 Cb 0.40 -0.64 -0.08 0.00 1.12 0.00 0.00 29.99 30.78 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 -1.70 1.15 -1.02 1.59 -2.24 -1.02 -5.02 114.28 106.02 2rpc n THR 86 Ca 0.03 -0.37 0.00 0.00 -2.27 0.00 0.00 64.05 61.44 2rpc n THR 86 Cb 0.17 -1.49 0.00 0.00 -2.10 0.00 0.00 70.33 66.91 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 2.12 0.40 3.36 3.38 0.00 -1.13 -5.03 105.19 108.29 2rpc n GLY 87 Ca -0.38 -1.06 -0.38 0.00 0.00 0.00 0.00 46.02 44.20 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 -2.03 3.12 0.19 1.61 2.12 -1.26 -5.09 118.70 117.35 2rpc s GLU 88 Ca 0.00 -0.84 -0.03 0.00 0.36 0.00 0.00 54.97 54.46 2rpc s GLU 88 Cb 0.00 -3.42 -0.05 0.00 0.26 0.00 0.00 34.13 30.92 2rpc s GLU 88 CO 0.00 -0.45 0.40 0.15 -0.54 0.00 0.00 175.26 174.82 2rpc s LYS 89 N 1.52 3.56 0.00 4.30 -0.14 -1.26 -5.00 119.74 122.73 2rpc s LYS 89 Ca 0.03 -0.22 0.00 0.00 -1.36 0.00 0.00 55.97 54.42 2rpc s LYS 89 Cb -0.17 -2.82 0.00 0.00 -1.68 0.00 0.00 37.83 33.16 2rpc s LYS 89 CO 0.03 0.40 0.00 -0.35 -0.76 0.00 0.00 175.35 174.67 2rpc n PRO 90 N -0.44 0.00 -4.33 -1.68 -0.04 -1.26 -4.99 135.00 122.27 2rpc n PRO 90 Ca -0.04 0.00 -0.19 0.00 -0.04 0.00 0.00 63.50 63.24 2rpc n PRO 90 Cb 0.53 -0.23 -0.14 0.00 -0.04 0.00 0.00 33.50 33.62 2rpc n PRO 90 CO 0.00 0.00 0.00 -0.59 -0.04 0.00 0.00 175.50 174.87 2rpc s PHE 91 N 0.00 0.96 0.00 0.54 -0.12 -1.26 -5.10 117.98 113.00 2rpc s PHE 91 Ca 0.00 -0.28 0.00 0.00 -0.05 0.00 0.00 56.93 56.60 2rpc s PHE 91 Cb 0.00 -0.59 0.00 0.00 -0.63 0.00 0.00 43.02 41.80 2rpc s PHE 91 CO 0.00 -0.00 0.00 -0.35 -0.05 0.00 0.00 175.22 174.82 2rpc n PRO 92 N 2.31 -0.77 -3.36 1.99 -0.04 -1.26 -4.11 135.00 129.75 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 2.56 0.49 -3.47 0.00 -0.04 -1.26 -4.66 135.00 128.62 2rpc n PRO 94 Ca -0.10 0.00 -0.37 0.00 -0.04 0.00 0.00 63.50 62.99 2rpc n PRO 94 Cb 0.52 -1.35 -0.06 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 3.56 -0.02 0.54 2.19 -1.26 -5.01 117.98 115.98 2rpc s PHE 95 Ca 0.16 0.81 -0.23 0.00 0.33 0.00 0.00 56.93 57.99 2rpc s PHE 95 Cb 0.07 -2.37 -0.17 0.00 -1.31 0.00 0.00 43.02 39.24 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 6.01 -0.26 -1.71 10.12 0.13 -2.04 -3.10 132.00 141.16 2rpc h PRO 96 Ca -0.45 0.02 -0.03 0.00 -0.87 0.00 0.00 66.00 64.67 2rpc h PRO 96 Cb 1.19 0.06 -0.01 0.00 0.13 0.00 0.00 31.00 32.36 2rpc h PRO 96 CO 0.71 0.13 0.04 0.41 -0.23 0.00 0.00 178.00 179.05 2rpc n GLY 97 N 0.15 2.51 1.74 1.56 0.00 -1.26 -4.01 105.19 105.87 2rpc n GLY 97 Ca -0.09 -0.09 0.00 0.00 0.00 0.00 0.00 46.02 45.85 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 2.04 0.49 3.86 0.00 0.00 -1.18 -4.99 105.19 105.42 2rpc n GLY 99 Ca 0.00 -0.23 -0.33 0.00 0.00 0.00 0.00 46.02 45.46 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 -4.21 3.89 0.08 1.61 2.47 -1.26 -4.83 119.74 117.49 2rpc s LYS 100 Ca 0.00 0.41 0.06 0.00 -1.56 0.00 0.00 55.97 54.88 2rpc s LYS 100 Cb 0.00 -2.69 -0.03 0.00 -1.46 0.00 0.00 37.83 33.64 2rpc s LYS 100 CO 0.00 0.34 -0.16 0.42 0.16 0.00 0.00 175.35 176.11 2rpc s ILE 101 N -1.74 1.29 -0.01 5.43 1.01 -1.26 0.55 121.20 126.47 2rpc s ILE 101 Ca 0.46 -1.41 0.02 0.00 0.00 0.00 0.00 60.65 59.72 2rpc s ILE 101 Cb -0.12 -1.24 -0.00 0.00 0.01 0.00 0.00 42.46 41.10 2rpc s ILE 101 CO 0.20 -0.20 -0.07 -0.36 0.00 0.00 0.00 174.94 174.51 2rpc s PHE 102 N -1.33 0.69 -0.33 3.97 0.40 -1.26 -5.01 117.98 115.11 2rpc s PHE 102 Ca 0.01 -0.14 0.27 0.00 -0.60 0.00 0.00 56.93 56.48 2rpc s PHE 102 Cb -0.10 -0.46 0.83 0.00 0.51 0.00 0.00 43.02 43.80 2rpc s PHE 102 CO 0.03 -0.03 1.77 0.00 0.70 0.00 0.00 175.22 177.69 2rpc h ALA 103 N 6.05 1.00 -3.37 5.36 0.00 -1.94 -3.37 119.26 122.99 2rpc h ALA 103 Ca -0.30 0.00 -0.65 0.00 0.00 0.00 0.00 54.91 53.96 2rpc h ALA 103 Cb 1.18 0.00 -0.23 0.00 0.00 0.00 0.00 17.79 18.74 2rpc h ALA 103 CO 0.50 0.00 -0.70 0.50 0.00 0.00 0.00 179.25 179.54 2rpc s ARG 104 N -3.35 3.44 0.14 0.00 3.52 -1.26 -4.65 118.95 116.79 2rpc s ARG 104 Ca 0.05 -0.58 -0.17 0.00 -0.13 0.00 0.00 55.73 54.91 2rpc s ARG 104 Cb 0.08 -2.77 -0.01 0.00 -1.56 0.00 0.00 34.95 30.69 2rpc s ARG 104 CO 0.58 0.30 1.76 0.77 -0.81 0.00 0.00 175.30 177.90 2rpc h SER 105 N 6.48 0.43 -0.52 -2.12 0.02 -1.99 -2.15 113.55 113.71 2rpc h SER 105 Ca -0.32 -0.06 0.08 0.00 -0.84 0.00 0.00 61.79 60.65 2rpc h SER 105 Cb 1.19 -0.11 -0.03 0.00 0.14 0.00 0.00 62.40 63.60 2rpc h SER 105 CO 0.59 0.37 0.35 -0.08 -1.14 0.00 0.00 176.83 176.92 2rpc h GLU 106 N 0.46 0.37 -0.06 3.45 4.81 -1.98 -0.08 114.58 121.54 2rpc h GLU 106 Ca 0.13 -0.02 -0.13 0.00 -0.13 0.00 0.00 59.36 59.20 2rpc h GLU 106 Cb 0.02 -0.08 -0.01 0.00 0.63 0.00 0.00 28.75 29.30 2rpc h GLU 106 CO -0.02 0.24 -0.57 -0.91 -0.73 0.00 0.00 179.01 177.02 2rpc h ASN 107 N 0.38 0.20 0.05 1.04 4.21 -1.82 -2.38 115.58 117.26 2rpc h ASN 107 Ca 0.23 -0.11 -0.00 0.00 1.21 0.00 0.00 56.30 57.63 2rpc h ASN 107 Cb 0.43 -0.06 0.00 0.00 -1.12 0.00 0.00 38.32 37.57 2rpc h ASN 107 CO -0.06 0.73 -0.02 0.25 -1.29 0.00 0.00 177.43 177.04 2rpc h LEU 108 N 0.14 -0.05 -0.31 1.61 5.85 -0.59 -1.71 115.31 120.23 2rpc h LEU 108 Ca -0.00 -0.56 0.04 0.00 0.84 0.00 0.00 57.88 58.20 2rpc h LEU 108 Cb 1.05 0.01 -0.04 0.00 0.37 0.00 0.00 40.66 42.05 2rpc h LEU 108 CO 0.08 0.57 0.07 0.07 -0.34 0.00 0.00 178.44 178.90 2rpc h LYS 109 N -0.72 0.19 -0.39 1.25 2.10 -1.31 0.69 116.57 118.38 2rpc h LYS 109 Ca -0.01 -0.01 -0.06 0.00 -2.00 0.00 0.00 60.65 58.58 2rpc h LYS 109 Cb 0.61 -0.04 -0.02 0.00 -0.90 0.00 0.00 32.23 31.88 2rpc h LYS 109 CO 0.01 0.12 0.01 0.82 -2.00 0.00 0.00 179.45 178.41 2rpc h ILE 110 N 0.19 1.22 0.00 0.07 2.04 -1.52 -2.10 117.51 117.42 2rpc h ILE 110 Ca 0.15 -0.86 -0.03 0.00 1.00 0.00 0.00 64.86 65.11 2rpc h ILE 110 Cb 0.15 0.91 -0.00 0.00 -0.74 0.00 0.00 36.82 37.13 2rpc h ILE 110 CO -0.18 0.30 -0.16 -0.74 0.00 0.00 0.00 178.15 177.37 2rpc h HIS 111 N 0.60 0.00 0.00 1.37 2.76 -0.49 -3.19 115.15 116.20 2rpc h HIS 111 Ca 0.12 0.00 -0.17 0.00 -2.20 0.00 0.00 60.37 58.12 2rpc h HIS 111 Cb 0.37 0.00 -0.02 0.00 1.55 0.00 0.00 27.41 29.30 2rpc h HIS 111 CO 0.02 0.16 -0.83 0.87 -1.30 0.00 0.00 177.93 176.85 2rpc h LYS 112 N 0.00 0.00 0.00 5.26 1.57 0.10 -3.20 116.57 120.30 2rpc h LYS 112 Ca -0.00 0.00 -0.14 0.00 -1.87 0.00 0.00 60.65 58.64 2rpc h LYS 112 Cb 1.07 0.00 -0.02 0.00 0.08 0.00 0.00 32.23 33.36 2rpc h LYS 112 CO 0.02 0.83 -0.65 0.07 -0.57 0.00 0.00 179.45 179.15 2rpc h ARG 113 N 0.00 0.00 0.00 3.15 0.11 -1.40 -2.98 114.38 113.26 2rpc h ARG 113 Ca -0.01 0.00 0.00 0.00 0.10 0.00 0.00 59.98 60.07 2rpc h ARG 113 Cb 1.52 0.00 0.00 0.00 1.11 0.00 0.00 29.97 32.60 2rpc h ARG 113 CO 0.11 0.65 0.00 -2.37 0.10 0.00 0.00 179.97 178.46 2rpc n THR 114 N -3.52 0.61 1.45 0.08 5.66 -1.21 -2.37 114.28 114.99 2rpc n THR 114 Ca -0.00 0.15 0.03 0.00 -3.05 0.00 0.00 64.05 61.18 2rpc n THR 114 Cb 0.70 -0.88 0.07 0.00 -1.55 0.00 0.00 70.33 68.68 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 -1.34 0.23 0.71 1.09 8.25 -1.12 -3.21 115.22 119.82 2rpc n HIS 115 Ca 0.07 -0.11 0.08 0.00 -0.26 0.00 0.00 57.72 57.49 2rpc n HIS 115 Cb 0.14 -0.00 -0.01 0.00 1.12 0.00 0.00 29.99 31.24 2rpc n HIS 115 CO 0.00 0.00 0.00 -2.37 0.64 0.00 0.00 176.34 174.61 2rpc n THR 116 N -0.00 0.00 -0.14 1.59 5.66 -1.00 -4.60 114.28 115.79 2rpc n THR 116 Ca 0.06 -0.31 -0.29 0.00 -3.05 0.00 0.00 64.05 60.46 2rpc n THR 116 Cb 0.15 1.16 -0.10 0.00 -1.55 0.00 0.00 70.33 69.98 2rpc n THR 116 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 175.07 172.63 2rpc n GLY 117 N 1.18 -0.48 3.73 1.09 0.00 -1.20 -4.94 105.19 104.57 2rpc n GLY 117 Ca 0.06 -0.12 -0.39 0.00 0.00 0.00 0.00 46.02 45.57 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 -2.50 4.38 -0.05 1.61 2.12 -1.26 -5.07 118.70 117.94 2rpc s GLU 118 Ca -0.38 0.72 -0.04 0.00 0.36 0.00 0.00 54.97 55.63 2rpc s GLU 118 Cb 0.14 -3.41 -0.04 0.00 0.26 0.00 0.00 34.13 31.07 2rpc s GLU 118 CO 0.51 0.18 0.16 0.15 -0.54 0.00 0.00 175.26 175.71 2rpc s LYS 119 N 0.47 3.42 -0.02 4.30 -0.14 -1.26 -4.91 119.74 121.60 2rpc s LYS 119 Ca 0.32 -0.26 -0.26 0.00 -1.36 0.00 0.00 55.97 54.42 2rpc s LYS 119 Cb -0.17 -3.12 -0.20 0.00 -1.68 0.00 0.00 37.83 32.66 2rpc s LYS 119 CO 0.16 0.71 1.26 -1.00 -0.76 0.00 0.00 175.35 175.72 2rpc h PRO 120 N 4.24 -0.01 -6.38 -1.68 0.13 -1.84 -3.42 132.00 123.05 2rpc h PRO 120 Ca -0.51 0.00 -0.57 0.00 -0.87 0.00 0.00 66.00 64.05 2rpc h PRO 120 Cb 1.20 0.00 -0.05 0.00 0.13 0.00 0.00 31.00 32.28 2rpc h PRO 120 CO 0.65 0.48 0.98 -0.06 -0.23 0.00 0.00 178.00 179.82 2rpc s PHE 121 N -4.24 2.65 -0.09 1.56 0.40 0.31 -4.89 117.98 113.68 2rpc s PHE 121 Ca -0.16 0.84 0.03 0.00 -0.60 0.00 0.00 56.93 57.04 2rpc s PHE 121 Cb 0.02 -3.96 -0.02 0.00 0.51 0.00 0.00 43.02 39.57 2rpc s PHE 121 CO 0.67 -1.74 -0.17 0.21 0.70 0.00 0.00 175.22 174.88 2rpc s LYS 122 N 4.26 2.92 -0.16 0.44 2.20 -1.26 0.20 119.74 128.34 2rpc s LYS 122 Ca 0.57 -0.76 -0.34 0.00 -0.36 0.00 0.00 55.97 55.07 2rpc s LYS 122 Cb -0.16 -2.42 -0.16 0.00 -1.51 0.00 0.00 37.83 33.58 2rpc s LYS 122 CO 0.24 0.36 1.03 0.00 -0.36 0.00 0.00 175.35 176.62 2rpc n GLU 124 N 2.01 0.41 -2.31 0.00 1.02 -1.26 -4.80 120.64 115.71 2rpc n GLU 124 Ca 0.20 0.01 -0.42 0.00 -0.02 0.00 0.00 57.16 56.92 2rpc n GLU 124 Cb 0.02 -1.50 -0.03 0.00 -0.02 0.00 0.00 31.44 29.91 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 -2.58 2.78 0.23 -0.32 5.36 -1.26 -4.97 117.98 117.22 2rpc s PHE 125 Ca 0.28 0.87 -0.30 0.00 -0.96 0.00 0.00 56.93 56.81 2rpc s PHE 125 Cb 0.20 -3.60 -0.10 0.00 -0.34 0.00 0.00 43.02 39.18 2rpc s PHE 125 CO 0.45 -2.17 1.47 -2.00 -1.46 0.00 0.00 175.22 171.51 2rpc s GLU 126 N 3.00 4.25 0.00 10.12 2.56 -1.26 -2.28 118.70 135.09 2rpc s GLU 126 Ca 0.60 2.32 0.00 0.00 0.00 0.00 0.00 54.97 57.89 2rpc s GLU 126 Cb -0.27 -3.12 0.00 0.00 2.00 0.00 0.00 34.13 32.74 2rpc s GLU 126 CO 0.22 -0.46 0.00 0.41 -0.56 0.00 0.00 175.26 174.87 2rpc n GLY 127 N 2.49 0.58 3.39 -1.50 0.00 -1.26 -5.05 105.19 103.85 2rpc n GLY 127 Ca 0.08 -0.18 -0.30 0.00 0.00 0.00 0.00 46.02 45.62 2rpc n GLY 127 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2rpc s ASP 129 N -1.36 4.25 0.36 0.00 1.01 -1.26 -4.88 116.67 114.78 2rpc s ASP 129 Ca 0.13 -1.44 0.01 0.00 0.71 0.00 0.00 52.55 51.96 2rpc s ASP 129 Cb -0.10 -1.39 -0.00 0.00 1.01 0.00 0.00 42.92 42.44 2rpc s ASP 129 CO 0.04 -0.25 0.45 -0.13 0.21 0.00 0.00 175.17 175.49 2rpc s ARG 130 N 1.21 1.95 -0.15 8.23 1.81 -1.26 -5.03 118.95 125.70 2rpc s ARG 130 Ca -0.04 -1.88 -0.13 0.00 -1.72 0.00 0.00 55.73 51.97 2rpc s ARG 130 Cb -0.19 0.42 0.04 0.00 -0.45 0.00 0.00 34.95 34.77 2rpc s ARG 130 CO -0.07 -0.79 0.40 1.03 -0.68 0.00 0.00 175.30 175.18 2rpc s ARG 131 N -2.99 0.44 0.12 3.54 0.52 -1.26 -4.30 118.95 115.02 2rpc s ARG 131 Ca 0.33 0.60 -0.15 0.00 -0.52 0.00 0.00 55.73 55.99 2rpc s ARG 131 Cb -0.00 0.17 0.03 0.00 0.52 0.00 0.00 34.95 35.67 2rpc s ARG 131 CO 0.24 -0.08 0.39 -0.06 0.02 0.00 0.00 175.30 175.80 2rpc s PHE 132 N 0.48 -0.17 -0.28 -0.53 0.08 0.53 -4.94 117.98 113.15 2rpc s PHE 132 Ca -0.02 -0.16 0.04 0.00 0.12 0.00 0.00 56.93 56.91 2rpc s PHE 132 Cb -0.04 0.24 -0.02 0.00 -0.57 0.00 0.00 43.02 42.62 2rpc s PHE 132 CO -0.02 -0.70 0.29 0.00 -0.10 0.00 0.00 175.22 174.69 2rpc n ALA 133 N -0.22 2.51 -2.90 5.36 0.00 -1.26 0.11 120.51 124.12 2rpc n ALA 133 Ca -0.16 -0.22 -0.11 0.00 0.00 0.00 0.00 53.44 52.95 2rpc n ALA 133 Cb 0.64 -0.15 -0.13 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 -1.13 0.08 0.37 0.00 2.20 -1.26 -4.79 114.94 110.42 2rpc s ASN 134 Ca 0.02 -0.15 0.07 0.00 -0.94 0.00 0.00 52.86 51.86 2rpc s ASN 134 Cb 0.03 0.03 0.78 0.00 -2.00 0.00 0.00 41.25 40.09 2rpc s ASN 134 CO 0.14 -0.09 1.97 -1.28 -2.94 0.00 0.00 177.10 174.90 2rpc h SER 135 N 5.70 0.62 -0.95 3.54 0.87 -1.99 -1.44 113.55 119.91 2rpc h SER 135 Ca -0.26 0.00 0.09 0.00 -1.23 0.00 0.00 61.79 60.39 2rpc h SER 135 Cb 1.21 -0.13 -0.07 0.00 -0.44 0.00 0.00 62.40 62.97 2rpc h SER 135 CO 0.48 0.40 0.59 0.28 -0.53 0.00 0.00 176.83 178.05 2rpc h SER 136 N 0.70 0.90 -0.04 6.23 0.02 -1.98 0.29 113.55 119.68 2rpc h SER 136 Ca 0.30 0.03 -0.05 0.00 -0.84 0.00 0.00 61.79 61.23 2rpc h SER 136 Cb 0.28 -0.15 0.00 0.00 0.14 0.00 0.00 62.40 62.66 2rpc h SER 136 CO -0.10 0.53 -0.18 -0.78 -1.14 0.00 0.00 176.83 175.17 2rpc h ASP 137 N 1.01 0.23 -0.49 3.07 1.82 -1.71 -2.23 116.42 118.13 2rpc h ASP 137 Ca 0.44 -0.64 0.00 0.00 -0.39 0.00 0.00 57.03 56.44 2rpc h ASP 137 Cb 0.32 -0.07 -0.02 0.00 0.68 0.00 0.00 39.33 40.24 2rpc h ASP 137 CO -0.22 0.83 0.31 -0.09 -1.61 0.00 0.00 179.24 178.47 2rpc h ARG 138 N -0.35 0.66 0.00 0.28 2.43 -0.98 -1.11 114.38 115.31 2rpc h ARG 138 Ca -0.01 -0.05 -0.08 0.00 -0.81 0.00 0.00 59.98 59.03 2rpc h ARG 138 Cb 0.82 -0.15 -0.01 0.00 -0.42 0.00 0.00 29.97 30.21 2rpc h ARG 138 CO 0.04 0.45 -0.39 -0.22 -1.51 0.00 0.00 179.97 178.34 2rpc h LYS 139 N 0.68 0.00 0.00 0.20 3.11 -0.44 -3.01 116.57 117.10 2rpc h LYS 139 Ca 0.18 0.00 0.00 0.00 -2.81 0.00 0.00 60.65 58.02 2rpc h LYS 139 Cb -0.05 0.00 0.00 0.00 -1.00 0.00 0.00 32.23 31.18 2rpc h LYS 139 CO -0.04 0.39 0.00 0.87 -2.81 0.00 0.00 179.45 177.86 2rpc h LYS 140 N 0.00 0.00 -0.01 1.90 1.57 -0.57 -2.74 116.57 116.72 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 1.10 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.41 2rpc h LYS 140 CO 0.05 0.00 -0.05 1.58 -0.57 0.00 0.00 179.45 180.46 2rpc n HIS 141 N -2.99 0.00 0.12 -1.35 -0.00 -1.02 -3.66 115.22 106.31 2rpc n HIS 141 Ca 0.02 0.00 0.10 0.00 0.46 0.00 0.00 57.72 58.30 2rpc n HIS 141 Cb 0.40 -0.03 0.02 0.00 -0.12 0.00 0.00 29.99 30.26 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 1.90 0.00 -0.05 1.57 2.86 -1.56 -3.33 114.93 116.32 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 0.46 0.00 -0.00 0.00 0.06 0.00 0.00 31.60 32.12 2rpc h MET 142 CO 0.00 0.05 0.25 0.45 1.06 0.00 0.00 176.91 178.72 2rpc h HIS 143 N 0.00 0.00 0.00 -0.22 3.86 -1.70 0.43 115.15 117.53 2rpc h HIS 143 Ca -0.02 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 59.19 2rpc h HIS 143 Cb 1.09 0.00 0.00 0.00 1.06 0.00 0.00 27.41 29.56 2rpc h HIS 143 CO 0.00 0.00 -1.33 1.55 0.86 0.00 0.00 177.93 179.01 2rpc n VAL 144 N -3.10 0.01 0.58 2.45 3.14 -1.25 -4.14 118.33 116.03 2rpc n VAL 144 Ca -0.01 -0.19 0.13 0.00 -2.96 0.00 0.00 64.34 61.31 2rpc n VAL 144 Cb 0.32 0.59 0.32 0.00 -1.06 0.00 0.00 33.84 34.01 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 -1.71 1.45 3.86 -0.30 -3.46 115.15 114.99 2rpc h HIS 145 Ca 0.00 0.00 -0.57 0.00 -1.16 0.00 0.00 60.37 58.64 2rpc h HIS 145 Cb 0.69 0.00 -0.09 0.00 1.06 0.00 0.00 27.41 29.06 2rpc h HIS 145 CO 0.00 0.00 -0.54 -0.08 0.86 0.00 0.00 177.93 178.17 2rpc s THR 146 N -3.13 2.44 0.30 2.45 -1.32 -1.01 -5.09 115.64 110.28 2rpc s THR 146 Ca 0.09 -1.78 -0.30 0.00 -1.21 0.00 0.00 61.69 58.49 2rpc s THR 146 Cb 0.12 -2.95 -0.11 0.00 -1.51 0.00 0.00 72.50 68.05 2rpc s THR 146 CO 0.64 -0.07 1.58 -0.55 -2.21 0.00 0.00 174.62 174.01 2rpc s SER 147 N -3.84 6.39 0.07 8.08 0.15 -1.26 -4.96 113.70 118.32 2rpc s SER 147 Ca 0.39 2.94 -0.19 0.00 0.70 0.00 0.00 55.95 59.78 2rpc s SER 147 Cb 0.03 -2.64 0.04 0.00 -1.71 0.00 0.00 66.02 61.74 2rpc s SER 147 CO 0.21 -0.90 0.46 -0.62 1.20 0.00 0.00 173.24 173.59 2rpc s ASP 148 N 0.44 -0.34 -0.14 5.45 -1.08 -1.26 -5.06 116.67 114.68 2rpc s ASP 148 Ca 0.62 -0.01 0.12 0.00 -0.52 0.00 0.00 52.55 52.76 2rpc s ASP 148 Cb -0.47 0.47 -0.17 0.00 -1.46 0.00 0.00 42.92 41.29 2rpc s ASP 148 CO 0.49 -0.74 0.04 0.29 0.52 0.00 0.00 175.17 175.77 2rpc n LYS 149 N 0.27 1.70 -3.17 4.34 4.76 -1.26 -4.99 118.16 119.81 2rpc n LYS 149 Ca -0.18 -0.00 0.05 0.00 -2.87 0.00 0.00 58.31 55.31 2rpc n LYS 149 Cb 0.61 -1.35 -0.02 0.00 -1.84 0.00 0.00 35.03 32.43 2rpc n LYS 149 CO 0.00 0.00 0.00 0.45 -1.37 0.00 0.00 177.40 176.48 2rpc s SER 150 N -4.73 -0.50 -0.37 4.39 0.15 -1.26 -5.08 113.70 106.30 2rpc s SER 150 Ca -0.08 0.35 0.05 0.00 0.70 0.00 0.00 55.95 56.98 2rpc s SER 150 Cb 0.04 1.44 0.27 0.00 -1.71 0.00 0.00 66.02 66.05 2rpc s SER 150 CO 0.55 -0.09 1.24 0.61 1.20 0.00 0.00 173.24 176.75 2rpc n GLY 151 N 5.40 -0.19 3.60 9.45 0.00 -1.26 -5.12 105.19 117.08 2rpc n GLY 151 Ca -0.07 0.21 -0.43 0.00 0.00 0.00 0.00 46.02 45.74 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 0.13 3.33 0.07 1.61 0.04 -1.26 -4.95 135.00 133.98 2rpc s PRO 152 Ca 0.16 1.26 -0.31 0.00 0.04 0.00 0.00 61.00 62.15 2rpc s PRO 152 Cb 0.25 -4.17 -0.08 0.00 0.04 0.00 0.00 34.50 30.54 2rpc s PRO 152 CO -0.09 -1.86 1.59 -1.12 0.04 0.00 0.00 177.00 175.56 2rpc s SER 153 N 5.76 6.65 -0.50 6.66 0.01 -1.26 -4.87 113.70 126.15 2rpc s SER 153 Ca 0.75 2.44 -0.27 0.00 1.31 0.00 0.00 55.95 60.18 2rpc s SER 153 Cb -0.20 -2.57 -0.08 0.00 0.21 0.00 0.00 66.02 63.39 2rpc s SER 153 CO 0.32 -0.84 2.42 -1.20 0.41 0.00 0.00 173.24 174.35 2rpc n SER 154 N 5.30 2.26 0.00 2.44 7.64 -1.26 -5.24 113.62 124.76 2rpc n SER 154 Ca 0.15 -0.38 0.00 0.00 1.01 0.00 0.00 58.87 59.65 2rpc n SER 154 Cb 0.41 -1.53 0.00 0.00 -1.01 0.00 0.00 64.21 62.08 2rpc n SER 154 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64